ATOM 1 C C.2 0 ACE mhp= 40 -0.1002 charge= 0.3983 ATOM 2 O O.2 0 ACE mhp= 58 -0.0233 charge= -0.3241 ATOM 3 CH3 C.3 0 ACE mhp= 1 -1.5603 charge= -0.2135 ATOM 4 HH31 H 0 ACE mhp= 51 0.5234 charge= 0.1000 ATOM 5 HH32 H 0 ACE mhp= 51 0.5234 charge= 0.1000 ATOM 6 HH33 H 0 ACE mhp= 51 0.5234 charge= 0.1000 ATOM 7 N N.2 1 MET mhp= 72 -0.5113 charge= -0.5985 ATOM 8 CA C.3 1 MET mhp= 8 -0.6805 charge= 0.0965 ATOM 9 C C.2 1 MET mhp= 40 -0.1002 charge= 0.3983 ATOM 10 O O.2 1 MET mhp= 58 -0.0233 charge= -0.3241 ATOM 11 CB C.3 1 MET mhp= 2 -1.0120 charge= -0.2000 ATOM 12 CG C.3 1 MET mhp= 6 -1.2486 charge= -0.2500 ATOM 13 SD S.3 1 MET mhp= 107 0.5906 charge= 0.1000 ATOM 14 CE C.3 1 MET mhp= 5 -1.7880 charge= -0.3500 ATOM 15 H H 1 MET mhp= 50 -0.1036 charge= 0.3278 ATOM 16 HA H 1 MET mhp= 51 0.5234 charge= 0.1000 ATOM 17 HB2 H 1 MET mhp= 53 0.5372 charge= 0.1000 ATOM 18 HB3 H 1 MET mhp= 53 0.5372 charge= 0.1000 ATOM 19 HG2 H 1 MET mhp= 47 0.6301 charge= 0.1000 ATOM 20 HG3 H 1 MET mhp= 47 0.6301 charge= 0.1000 ATOM 21 HE1 H 1 MET mhp= 47 0.6301 charge= 0.1000 ATOM 22 HE2 H 1 MET mhp= 47 0.6301 charge= 0.1000 ATOM 23 HE3 H 1 MET mhp= 47 0.6301 charge= 0.1000 ATOM 24 N N.2 2 ASN mhp= 72 -0.5113 charge= -0.5985 ATOM 25 CA C.3 2 ASN mhp= 8 -0.6805 charge= 0.0965 ATOM 26 C C.2 2 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 27 O O.2 2 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 28 CB C.3 2 ASN mhp= 2 -1.0120 charge= -0.1135 ATOM 29 CG C.2 2 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 30 OD1 O.2 2 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 31 ND2 N.2 2 ASN mhp= 72 -0.5113 charge= -0.8163 ATOM 32 H H 2 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 33 HA H 2 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 34 HB2 H 2 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 35 HB3 H 2 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 36 HD21 H 2 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 37 HD22 H 2 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 38 N N.2 3 GLY mhp= 72 -0.5113 charge= -0.5985 ATOM 39 CA C.3 3 GLY mhp= 6 -1.2486 charge= -0.0035 ATOM 40 C C.2 3 GLY mhp= 40 -0.1002 charge= 0.3983 ATOM 41 O O.2 3 GLY mhp= 58 -0.0233 charge= -0.3241 ATOM 42 H H 3 GLY mhp= 50 -0.1036 charge= 0.3278 ATOM 43 HA2 H 3 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 44 HA3 H 3 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 45 N N.2 4 THR mhp= 72 -0.5113 charge= -0.5985 ATOM 46 CA C.3 4 THR mhp= 8 -0.6805 charge= 0.0965 ATOM 47 C C.2 4 THR mhp= 40 -0.1002 charge= 0.3983 ATOM 48 O O.2 4 THR mhp= 58 -0.0233 charge= -0.3241 ATOM 49 CB C.3 4 THR mhp= 8 -0.6805 charge= -0.0700 ATOM 50 OG1 O.3 4 THR mhp= 56 -0.3567 charge= -0.1490 ATOM 51 CG2 C.3 4 THR mhp= 1 -1.5603 charge= -0.3000 ATOM 52 H H 4 THR mhp= 50 -0.1036 charge= 0.3278 ATOM 53 HA H 4 THR mhp= 51 0.5234 charge= 0.1000 ATOM 54 HB H 4 THR mhp= 47 0.6301 charge= 0.1000 ATOM 55 HG1 H 4 THR mhp= 50 -0.1036 charge= 0.1190 ATOM 56 HG21 H 4 THR mhp= 52 0.6666 charge= 0.1000 ATOM 57 HG22 H 4 THR mhp= 52 0.6666 charge= 0.1000 ATOM 58 HG23 H 4 THR mhp= 52 0.6666 charge= 0.1000 ATOM 59 N N.2 5 GLU mhp= 72 -0.5113 charge= -0.5985 ATOM 60 CA C.3 5 GLU mhp= 8 -0.6805 charge= 0.0965 ATOM 61 C C.2 5 GLU mhp= 40 -0.1002 charge= 0.3983 ATOM 62 O O.2 5 GLU mhp= 58 -0.0233 charge= -0.3241 ATOM 63 CB C.3 5 GLU mhp= 2 -1.0120 charge= -0.2000 ATOM 64 CG C.3 5 GLU mhp= 2 -1.0120 charge= -0.1135 ATOM 65 CD C.2 5 GLU mhp= 31 0.0901 charge= 0.0535 ATOM 66 OE1 O.co2 5 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 67 OE2 O.co2 5 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 68 H H 5 GLU mhp= 50 -0.1036 charge= 0.3278 ATOM 69 HA H 5 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 70 HB2 H 5 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 71 HB3 H 5 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 72 HG2 H 5 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 73 HG3 H 5 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 74 N N.2 6 GLY mhp= 72 -0.5113 charge= -0.5985 ATOM 75 CA C.3 6 GLY mhp= 6 -1.2486 charge= -0.0035 ATOM 76 C C.2 6 GLY mhp= 40 -0.1002 charge= 0.3983 ATOM 77 O O.2 6 GLY mhp= 58 -0.0233 charge= -0.3241 ATOM 78 H H 6 GLY mhp= 50 -0.1036 charge= 0.3278 ATOM 79 HA2 H 6 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 80 HA3 H 6 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 81 N N.2 7 PRO mhp= 72 -0.5113 charge= -0.6007 ATOM 82 CA C.3 7 PRO mhp= 8 -0.6805 charge= 0.2065 ATOM 83 C C.2 7 PRO mhp= 40 -0.1002 charge= 0.3983 ATOM 84 O O.2 7 PRO mhp= 58 -0.0233 charge= -0.3241 ATOM 85 CB C.3 7 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 86 CG C.3 7 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 87 CD C.3 7 PRO mhp= 6 -1.2486 charge= 0.0200 ATOM 88 HA H 7 PRO mhp= 51 0.5234 charge= 0.1000 ATOM 89 HB2 H 7 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 90 HB3 H 7 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 91 HG2 H 7 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 92 HG3 H 7 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 93 HD2 H 7 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 94 HD3 H 7 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 95 N N.2 8 ASN mhp= 72 -0.5113 charge= -0.5985 ATOM 96 CA C.3 8 ASN mhp= 8 -0.6805 charge= 0.0965 ATOM 97 C C.2 8 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 98 O O.2 8 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 99 CB C.3 8 ASN mhp= 2 -1.0120 charge= -0.1135 ATOM 100 CG C.2 8 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 101 OD1 O.2 8 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 102 ND2 N.2 8 ASN mhp= 72 -0.5113 charge= -0.8163 ATOM 103 H H 8 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 104 HA H 8 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 105 HB2 H 8 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 106 HB3 H 8 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 107 HD21 H 8 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 108 HD22 H 8 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 109 N N.2 9 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 110 CA C.3 9 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 111 C C.2 9 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 112 O O.2 9 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 113 CB C.3 9 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 114 CG C.ar 9 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 115 CD1 C.ar 9 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 116 CD2 C.ar 9 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 117 CE1 C.ar 9 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 118 CE2 C.ar 9 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 119 CZ C.ar 9 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 120 H H 9 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 121 HA H 9 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 122 HB2 H 9 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 123 HB3 H 9 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 124 HD1 H 9 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 125 HD2 H 9 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 126 HE1 H 9 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 127 HE2 H 9 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 128 HZ H 9 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 129 N N.2 10 TYR mhp= 72 -0.5113 charge= -0.5985 ATOM 130 CA C.3 10 TYR mhp= 8 -0.6805 charge= 0.0965 ATOM 131 C C.2 10 TYR mhp= 40 -0.1002 charge= 0.3983 ATOM 132 O O.2 10 TYR mhp= 58 -0.0233 charge= -0.3241 ATOM 133 CB C.3 10 TYR mhp= 2 -1.0120 charge= -0.2000 ATOM 134 CG C.ar 10 TYR mhp= 25 0.1492 charge= 0.0000 ATOM 135 CD1 C.ar 10 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 136 CD2 C.ar 10 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 137 CE1 C.ar 10 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 138 CE2 C.ar 10 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 139 CZ C.ar 10 TYR mhp= 26 0.1539 charge= 0.0300 ATOM 140 OH O.3 10 TYR mhp= 57 -0.0127 charge= -0.1490 ATOM 141 H H 10 TYR mhp= 50 -0.1036 charge= 0.3278 ATOM 142 HA H 10 TYR mhp= 51 0.5234 charge= 0.1000 ATOM 143 HB2 H 10 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 144 HB3 H 10 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 145 HD1 H 10 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 146 HD2 H 10 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 147 HE1 H 10 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 148 HE2 H 10 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 149 HH H 10 TYR mhp= 50 -0.1036 charge= 0.1190 ATOM 150 N N.2 11 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 151 CA C.3 11 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 152 C C.2 11 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 153 O O.2 11 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 154 CB C.3 11 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 155 CG1 C.3 11 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 156 CG2 C.3 11 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 157 H H 11 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 158 HA H 11 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 159 HB H 11 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 160 HG21 H 11 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 161 HG22 H 11 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 162 HG23 H 11 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 163 HG11 H 11 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 164 HG12 H 11 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 165 HG13 H 11 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 166 N N.2 12 PRO mhp= 72 -0.5113 charge= -0.6007 ATOM 167 CA C.3 12 PRO mhp= 8 -0.6805 charge= 0.2065 ATOM 168 C C.2 12 PRO mhp= 40 -0.1002 charge= 0.3983 ATOM 169 O O.2 12 PRO mhp= 58 -0.0233 charge= -0.3241 ATOM 170 CB C.3 12 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 171 CG C.3 12 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 172 CD C.3 12 PRO mhp= 6 -1.2486 charge= 0.0200 ATOM 173 HA H 12 PRO mhp= 51 0.5234 charge= 0.1000 ATOM 174 HB2 H 12 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 175 HB3 H 12 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 176 HG2 H 12 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 177 HG3 H 12 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 178 HD2 H 12 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 179 HD3 H 12 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 180 N N.2 13 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 181 CA C.3 13 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 182 C C.2 13 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 183 O O.2 13 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 184 CB C.3 13 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 185 CG C.ar 13 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 186 CD1 C.ar 13 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 187 CD2 C.ar 13 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 188 CE1 C.ar 13 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 189 CE2 C.ar 13 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 190 CZ C.ar 13 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 191 H H 13 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 192 HA H 13 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 193 HB2 H 13 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 194 HB3 H 13 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 195 HD1 H 13 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 196 HD2 H 13 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 197 HE1 H 13 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 198 HE2 H 13 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 199 HZ H 13 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 200 N N.2 14 SER mhp= 72 -0.5113 charge= -0.5985 ATOM 201 CA C.3 14 SER mhp= 8 -0.6805 charge= 0.0965 ATOM 202 C C.2 14 SER mhp= 40 -0.1002 charge= 0.3983 ATOM 203 O O.2 14 SER mhp= 58 -0.0233 charge= -0.3241 ATOM 204 CB C.3 14 SER mhp= 6 -1.2486 charge= -0.1700 ATOM 205 OG O.3 14 SER mhp= 56 -0.3567 charge= -0.1490 ATOM 206 H H 14 SER mhp= 50 -0.1036 charge= 0.3278 ATOM 207 HA H 14 SER mhp= 51 0.5234 charge= 0.1000 ATOM 208 HB2 H 14 SER mhp= 47 0.6301 charge= 0.1000 ATOM 209 HB3 H 14 SER mhp= 47 0.6301 charge= 0.1000 ATOM 210 HG H 14 SER mhp= 50 -0.1036 charge= 0.1190 ATOM 211 N N.2 15 ASN mhp= 72 -0.5113 charge= -0.5985 ATOM 212 CA C.3 15 ASN mhp= 8 -0.6805 charge= 0.0965 ATOM 213 C C.2 15 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 214 O O.2 15 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 215 CB C.3 15 ASN mhp= 2 -1.0120 charge= -0.1135 ATOM 216 CG C.2 15 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 217 OD1 O.2 15 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 218 ND2 N.2 15 ASN mhp= 72 -0.5113 charge= -0.8163 ATOM 219 H H 15 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 220 HA H 15 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 221 HB2 H 15 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 222 HB3 H 15 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 223 HD21 H 15 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 224 HD22 H 15 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 225 N N.2 16 LYS mhp= 72 -0.5113 charge= -0.5985 ATOM 226 CA C.3 16 LYS mhp= 8 -0.6805 charge= 0.0965 ATOM 227 C C.2 16 LYS mhp= 40 -0.1002 charge= 0.3983 ATOM 228 O O.2 16 LYS mhp= 58 -0.0233 charge= -0.3241 ATOM 229 CB C.3 16 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 230 CG C.3 16 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 231 CD C.3 16 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 232 CE C.3 16 LYS mhp= 6 -1.2486 charge= 0.2200 ATOM 233 NZ N.4 16 LYS mhp= 79 -1.4439 charge= -0.5000 ATOM 234 H H 16 LYS mhp= 50 -0.1036 charge= 0.3278 ATOM 235 HA H 16 LYS mhp= 51 0.5234 charge= 0.1000 ATOM 236 HB2 H 16 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 237 HB3 H 16 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 238 HG2 H 16 LYS mhp= 46 0.7341 charge= 0.1000 ATOM 239 HG3 H 16 LYS mhp= 46 0.7341 charge= 0.1000 ATOM 240 HD2 H 16 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 241 HD3 H 16 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 242 HE2 H 16 LYS mhp= 47 0.6301 charge= 0.1000 ATOM 243 HE3 H 16 LYS mhp= 47 0.6301 charge= 0.1000 ATOM 244 HZ1 H 16 LYS mhp= 50 -0.1036 charge= 0.3600 ATOM 245 HZ2 H 16 LYS mhp= 50 -0.1036 charge= 0.3600 ATOM 246 HZ3 H 16 LYS mhp= 50 -0.1036 charge= 0.3600 ATOM 247 N N.2 17 THR mhp= 72 -0.5113 charge= -0.5985 ATOM 248 CA C.3 17 THR mhp= 8 -0.6805 charge= 0.0965 ATOM 249 C C.2 17 THR mhp= 40 -0.1002 charge= 0.3983 ATOM 250 O O.2 17 THR mhp= 58 -0.0233 charge= -0.3241 ATOM 251 CB C.3 17 THR mhp= 8 -0.6805 charge= -0.0700 ATOM 252 OG1 O.3 17 THR mhp= 56 -0.3567 charge= -0.1490 ATOM 253 CG2 C.3 17 THR mhp= 1 -1.5603 charge= -0.3000 ATOM 254 H H 17 THR mhp= 50 -0.1036 charge= 0.3278 ATOM 255 HA H 17 THR mhp= 51 0.5234 charge= 0.1000 ATOM 256 HB H 17 THR mhp= 47 0.6301 charge= 0.1000 ATOM 257 HG21 H 17 THR mhp= 52 0.6666 charge= 0.1000 ATOM 258 HG22 H 17 THR mhp= 52 0.6666 charge= 0.1000 ATOM 259 HG23 H 17 THR mhp= 52 0.6666 charge= 0.1000 ATOM 260 HG1 H 17 THR mhp= 50 -0.1036 charge= 0.1190 ATOM 261 N N.2 18 GLY mhp= 72 -0.5113 charge= -0.5985 ATOM 262 CA C.3 18 GLY mhp= 6 -1.2486 charge= -0.0035 ATOM 263 C C.2 18 GLY mhp= 40 -0.1002 charge= 0.3983 ATOM 264 O O.2 18 GLY mhp= 58 -0.0233 charge= -0.3241 ATOM 265 H H 18 GLY mhp= 50 -0.1036 charge= 0.3278 ATOM 266 HA2 H 18 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 267 HA3 H 18 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 268 N N.2 19 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 269 CA C.3 19 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 270 C C.2 19 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 271 O O.2 19 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 272 CB C.3 19 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 273 CG1 C.3 19 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 274 CG2 C.3 19 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 275 H H 19 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 276 HA H 19 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 277 HB H 19 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 278 HG11 H 19 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 279 HG12 H 19 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 280 HG13 H 19 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 281 HG21 H 19 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 282 HG22 H 19 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 283 HG23 H 19 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 284 N N.2 20 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 285 CA C.3 20 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 286 C C.2 20 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 287 O O.2 20 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 288 CB C.3 20 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 289 CG1 C.3 20 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 290 CG2 C.3 20 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 291 H H 20 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 292 HA H 20 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 293 HB H 20 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 294 HG11 H 20 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 295 HG12 H 20 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 296 HG13 H 20 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 297 HG21 H 20 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 298 HG22 H 20 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 299 HG23 H 20 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 300 N N.2 21 ARG mhp= 72 -0.5113 charge= -0.5985 ATOM 301 CA C.3 21 ARG mhp= 8 -0.6805 charge= 0.0965 ATOM 302 C C.2 21 ARG mhp= 40 -0.1002 charge= 0.3983 ATOM 303 O O.2 21 ARG mhp= 58 -0.0233 charge= -0.3241 ATOM 304 CB C.3 21 ARG mhp= 2 -1.0120 charge= -0.2000 ATOM 305 CG C.3 21 ARG mhp= 2 -1.0120 charge= -0.2000 ATOM 306 CD C.3 21 ARG mhp= 6 -1.2486 charge= -0.0900 ATOM 307 NE N.2 21 ARG mhp= 79 -1.4439 charge= 0.0622 ATOM 308 CZ C.cat 21 ARG mhp= 32 0.5142 charge= -0.5000 ATOM 309 NH1 N.3 21 ARG mhp= 79 -1.4439 charge= -0.1556 ATOM 310 NH2 N.3 21 ARG mhp= 79 -1.4439 charge= -0.1556 ATOM 311 H H 21 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 312 HA H 21 ARG mhp= 51 0.5234 charge= 0.1000 ATOM 313 HB2 H 21 ARG mhp= 52 0.6666 charge= 0.1000 ATOM 314 HB3 H 21 ARG mhp= 52 0.6666 charge= 0.1000 ATOM 315 HG2 H 21 ARG mhp= 52 0.6666 charge= 0.1000 ATOM 316 HG3 H 21 ARG mhp= 52 0.6666 charge= 0.1000 ATOM 317 HD2 H 21 ARG mhp= 47 0.6301 charge= 0.1000 ATOM 318 HD3 H 21 ARG mhp= 47 0.6301 charge= 0.1000 ATOM 319 HE H 21 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 320 HH11 H 21 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 321 HH12 H 21 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 322 HH21 H 21 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 323 HH22 H 21 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 324 N N.2 22 SER mhp= 72 -0.5113 charge= -0.5985 ATOM 325 CA C.3 22 SER mhp= 8 -0.6805 charge= 0.0965 ATOM 326 C C.2 22 SER mhp= 40 -0.1002 charge= 0.3983 ATOM 327 O O.2 22 SER mhp= 58 -0.0233 charge= -0.3241 ATOM 328 CB C.3 22 SER mhp= 6 -1.2486 charge= -0.1700 ATOM 329 OG O.3 22 SER mhp= 56 -0.3567 charge= -0.1490 ATOM 330 H H 22 SER mhp= 50 -0.1036 charge= 0.3278 ATOM 331 HA H 22 SER mhp= 51 0.5234 charge= 0.1000 ATOM 332 HB2 H 22 SER mhp= 47 0.6301 charge= 0.1000 ATOM 333 HB3 H 22 SER mhp= 47 0.6301 charge= 0.1000 ATOM 334 HG H 22 SER mhp= 50 -0.1036 charge= 0.1190 ATOM 335 N N.2 23 PRO mhp= 72 -0.5113 charge= -0.6007 ATOM 336 CA C.3 23 PRO mhp= 8 -0.6805 charge= 0.2065 ATOM 337 C C.2 23 PRO mhp= 40 -0.1002 charge= 0.3983 ATOM 338 O O.2 23 PRO mhp= 58 -0.0233 charge= -0.3241 ATOM 339 CB C.3 23 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 340 CG C.3 23 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 341 CD C.3 23 PRO mhp= 6 -1.2486 charge= 0.0200 ATOM 342 HA H 23 PRO mhp= 51 0.5234 charge= 0.1000 ATOM 343 HB2 H 23 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 344 HB3 H 23 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 345 HG2 H 23 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 346 HG3 H 23 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 347 HD2 H 23 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 348 HD3 H 23 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 349 N N.2 24 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 350 CA C.3 24 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 351 C C.2 24 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 352 O O.2 24 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 353 CB C.3 24 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 354 CG C.ar 24 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 355 CD1 C.ar 24 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 356 CD2 C.ar 24 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 357 CE1 C.ar 24 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 358 CE2 C.ar 24 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 359 CZ C.ar 24 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 360 H H 24 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 361 HA H 24 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 362 HB2 H 24 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 363 HB3 H 24 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 364 HD1 H 24 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 365 HD2 H 24 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 366 HE1 H 24 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 367 HE2 H 24 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 368 HZ H 24 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 369 N N.2 25 GLU mhp= 72 -0.5113 charge= -0.5985 ATOM 370 CA C.3 25 GLU mhp= 8 -0.6805 charge= 0.0965 ATOM 371 C C.2 25 GLU mhp= 40 -0.1002 charge= 0.3983 ATOM 372 O O.2 25 GLU mhp= 58 -0.0233 charge= -0.3241 ATOM 373 CB C.3 25 GLU mhp= 2 -1.0120 charge= -0.2000 ATOM 374 CG C.3 25 GLU mhp= 2 -1.0120 charge= -0.1135 ATOM 375 CD C.2 25 GLU mhp= 31 0.0901 charge= 0.0535 ATOM 376 OE1 O.co2 25 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 377 OE2 O.co2 25 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 378 H H 25 GLU mhp= 50 -0.1036 charge= 0.3278 ATOM 379 HA H 25 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 380 HB2 H 25 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 381 HB3 H 25 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 382 HG2 H 25 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 383 HG3 H 25 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 384 N N.2 26 ALA mhp= 72 -0.5113 charge= -0.5985 ATOM 385 CA C.3 26 ALA mhp= 8 -0.6805 charge= 0.0965 ATOM 386 C C.2 26 ALA mhp= 40 -0.1002 charge= 0.3983 ATOM 387 O O.2 26 ALA mhp= 58 -0.0233 charge= -0.3241 ATOM 388 CB C.3 26 ALA mhp= 1 -1.5603 charge= -0.3000 ATOM 389 H H 26 ALA mhp= 50 -0.1036 charge= 0.3278 ATOM 390 HA H 26 ALA mhp= 51 0.5234 charge= 0.1000 ATOM 391 HB1 H 26 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 392 HB2 H 26 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 393 HB3 H 26 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 394 N N.2 27 PRO mhp= 72 -0.5113 charge= -0.6007 ATOM 395 CA C.3 27 PRO mhp= 8 -0.6805 charge= 0.2065 ATOM 396 C C.2 27 PRO mhp= 40 -0.1002 charge= 0.3983 ATOM 397 O O.2 27 PRO mhp= 58 -0.0233 charge= -0.3241 ATOM 398 CB C.3 27 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 399 CG C.3 27 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 400 CD C.3 27 PRO mhp= 6 -1.2486 charge= 0.0200 ATOM 401 HA H 27 PRO mhp= 51 0.5234 charge= 0.1000 ATOM 402 HB2 H 27 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 403 HB3 H 27 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 404 HG2 H 27 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 405 HG3 H 27 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 406 HD2 H 27 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 407 HD3 H 27 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 408 N N.2 28 GLN mhp= 72 -0.5113 charge= -0.5985 ATOM 409 CA C.3 28 GLN mhp= 8 -0.6805 charge= 0.0965 ATOM 410 C C.2 28 GLN mhp= 40 -0.1002 charge= 0.3983 ATOM 411 O O.2 28 GLN mhp= 58 -0.0233 charge= -0.3241 ATOM 412 CB C.3 28 GLN mhp= 2 -1.0120 charge= -0.2000 ATOM 413 CG C.3 28 GLN mhp= 2 -1.0120 charge= -0.1135 ATOM 414 CD C.2 28 GLN mhp= 40 -0.1002 charge= 0.3983 ATOM 415 OE1 O.2 28 GLN mhp= 58 -0.0233 charge= -0.3241 ATOM 416 NE2 N.2 28 GLN mhp= 72 -0.5113 charge= -0.8163 ATOM 417 H H 28 GLN mhp= 50 -0.1036 charge= 0.3278 ATOM 418 HA H 28 GLN mhp= 51 0.5234 charge= 0.1000 ATOM 419 HB2 H 28 GLN mhp= 52 0.6666 charge= 0.1000 ATOM 420 HB3 H 28 GLN mhp= 52 0.6666 charge= 0.1000 ATOM 421 HG2 H 28 GLN mhp= 51 0.5234 charge= 0.1000 ATOM 422 HG3 H 28 GLN mhp= 51 0.5234 charge= 0.1000 ATOM 423 HE21 H 28 GLN mhp= 50 -0.1036 charge= 0.3278 ATOM 424 HE22 H 28 GLN mhp= 50 -0.1036 charge= 0.3278 ATOM 425 N N.2 29 TYR mhp= 72 -0.5113 charge= -0.5985 ATOM 426 CA C.3 29 TYR mhp= 8 -0.6805 charge= 0.0965 ATOM 427 C C.2 29 TYR mhp= 40 -0.1002 charge= 0.3983 ATOM 428 O O.2 29 TYR mhp= 58 -0.0233 charge= -0.3241 ATOM 429 CB C.3 29 TYR mhp= 2 -1.0120 charge= -0.2000 ATOM 430 CG C.ar 29 TYR mhp= 25 0.1492 charge= 0.0000 ATOM 431 CD1 C.ar 29 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 432 CD2 C.ar 29 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 433 CE1 C.ar 29 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 434 CE2 C.ar 29 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 435 CZ C.ar 29 TYR mhp= 26 0.1539 charge= 0.0300 ATOM 436 OH O.3 29 TYR mhp= 57 -0.0127 charge= -0.1490 ATOM 437 H H 29 TYR mhp= 50 -0.1036 charge= 0.3278 ATOM 438 HA H 29 TYR mhp= 51 0.5234 charge= 0.1000 ATOM 439 HB2 H 29 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 440 HB3 H 29 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 441 HD1 H 29 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 442 HD2 H 29 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 443 HE1 H 29 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 444 HE2 H 29 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 445 HH H 29 TYR mhp= 50 -0.1036 charge= 0.1190 ATOM 446 N N.2 30 TYR mhp= 72 -0.5113 charge= -0.5985 ATOM 447 CA C.3 30 TYR mhp= 8 -0.6805 charge= 0.0965 ATOM 448 C C.2 30 TYR mhp= 40 -0.1002 charge= 0.3983 ATOM 449 O O.2 30 TYR mhp= 58 -0.0233 charge= -0.3241 ATOM 450 CB C.3 30 TYR mhp= 2 -1.0120 charge= -0.2000 ATOM 451 CG C.ar 30 TYR mhp= 25 0.1492 charge= 0.0000 ATOM 452 CD1 C.ar 30 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 453 CD2 C.ar 30 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 454 CE1 C.ar 30 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 455 CE2 C.ar 30 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 456 CZ C.ar 30 TYR mhp= 26 0.1539 charge= 0.0300 ATOM 457 OH O.3 30 TYR mhp= 57 -0.0127 charge= -0.1490 ATOM 458 H H 30 TYR mhp= 50 -0.1036 charge= 0.3278 ATOM 459 HA H 30 TYR mhp= 51 0.5234 charge= 0.1000 ATOM 460 HB2 H 30 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 461 HB3 H 30 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 462 HD1 H 30 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 463 HD2 H 30 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 464 HE1 H 30 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 465 HE2 H 30 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 466 HH H 30 TYR mhp= 50 -0.1036 charge= 0.1190 ATOM 467 N N.2 31 LEU mhp= 72 -0.5113 charge= -0.5985 ATOM 468 CA C.3 31 LEU mhp= 8 -0.6805 charge= 0.0965 ATOM 469 C C.2 31 LEU mhp= 40 -0.1002 charge= 0.3983 ATOM 470 O O.2 31 LEU mhp= 58 -0.0233 charge= -0.3241 ATOM 471 CB C.3 31 LEU mhp= 2 -1.0120 charge= -0.2000 ATOM 472 CG C.3 31 LEU mhp= 3 -0.6681 charge= -0.1000 ATOM 473 CD1 C.3 31 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 474 CD2 C.3 31 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 475 H H 31 LEU mhp= 50 -0.1036 charge= 0.3278 ATOM 476 HA H 31 LEU mhp= 51 0.5234 charge= 0.1000 ATOM 477 HB2 H 31 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 478 HB3 H 31 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 479 HG H 31 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 480 HD11 H 31 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 481 HD12 H 31 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 482 HD13 H 31 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 483 HD21 H 31 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 484 HD22 H 31 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 485 HD23 H 31 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 486 N N.2 32 ALA mhp= 72 -0.5113 charge= -0.5985 ATOM 487 CA C.3 32 ALA mhp= 8 -0.6805 charge= 0.0965 ATOM 488 C C.2 32 ALA mhp= 40 -0.1002 charge= 0.3983 ATOM 489 O O.2 32 ALA mhp= 58 -0.0233 charge= -0.3241 ATOM 490 CB C.3 32 ALA mhp= 1 -1.5603 charge= -0.3000 ATOM 491 H H 32 ALA mhp= 50 -0.1036 charge= 0.3278 ATOM 492 HA H 32 ALA mhp= 51 0.5234 charge= 0.1000 ATOM 493 HB1 H 32 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 494 HB2 H 32 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 495 HB3 H 32 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 496 N N.2 33 GLU mhp= 72 -0.5113 charge= -0.5985 ATOM 497 CA C.3 33 GLU mhp= 8 -0.6805 charge= 0.0965 ATOM 498 C C.2 33 GLU mhp= 40 -0.1002 charge= 0.3983 ATOM 499 O O.2 33 GLU mhp= 58 -0.0233 charge= -0.3241 ATOM 500 CB C.3 33 GLU mhp= 2 -1.0120 charge= -0.2000 ATOM 501 CG C.3 33 GLU mhp= 2 -1.0120 charge= -0.1135 ATOM 502 CD C.2 33 GLU mhp= 31 0.0901 charge= 0.0535 ATOM 503 OE1 O.co2 33 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 504 OE2 O.co2 33 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 505 H H 33 GLU mhp= 50 -0.1036 charge= 0.3278 ATOM 506 HA H 33 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 507 HB2 H 33 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 508 HB3 H 33 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 509 HG2 H 33 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 510 HG3 H 33 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 511 N N.2 34 PRO mhp= 72 -0.5113 charge= -0.6007 ATOM 512 CA C.3 34 PRO mhp= 8 -0.6805 charge= 0.2065 ATOM 513 C C.2 34 PRO mhp= 40 -0.1002 charge= 0.3983 ATOM 514 O O.2 34 PRO mhp= 58 -0.0233 charge= -0.3241 ATOM 515 CB C.3 34 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 516 CG C.3 34 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 517 CD C.3 34 PRO mhp= 6 -1.2486 charge= 0.0200 ATOM 518 HA H 34 PRO mhp= 51 0.5234 charge= 0.1000 ATOM 519 HB2 H 34 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 520 HB3 H 34 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 521 HG2 H 34 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 522 HG3 H 34 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 523 HD2 H 34 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 524 HD3 H 34 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 525 N N.2 35 TRP mhp= 72 -0.5113 charge= -0.5985 ATOM 526 CA C.3 35 TRP mhp= 8 -0.6805 charge= 0.0965 ATOM 527 C C.2 35 TRP mhp= 40 -0.1002 charge= 0.3983 ATOM 528 O O.2 35 TRP mhp= 58 -0.0233 charge= -0.3241 ATOM 529 CB C.3 35 TRP mhp= 2 -1.0120 charge= -0.2000 ATOM 530 CG C.ar 35 TRP mhp= 25 0.1492 charge= 0.0000 ATOM 531 CD1 C.ar 35 TRP mhp= 33 -0.3723 charge= 0.0100 ATOM 532 CD2 C.ar 35 TRP mhp= 25 0.1492 charge= 0.0000 ATOM 533 NE1 N.ar 35 TRP mhp= 73 0.1259 charge= -0.5778 ATOM 534 CE2 C.ar 35 TRP mhp= 34 0.2813 charge= 0.1100 ATOM 535 CE3 C.ar 35 TRP mhp= 24 -0.3251 charge= -0.1000 ATOM 536 CZ2 C.ar 35 TRP mhp= 24 -0.3251 charge= -0.1000 ATOM 537 CZ3 C.ar 35 TRP mhp= 24 -0.3251 charge= -0.1000 ATOM 538 CH2 C.ar 35 TRP mhp= 24 -0.3251 charge= -0.1000 ATOM 539 H H 35 TRP mhp= 50 -0.1036 charge= 0.3278 ATOM 540 HA H 35 TRP mhp= 51 0.5234 charge= 0.1000 ATOM 541 HB2 H 35 TRP mhp= 52 0.6666 charge= 0.1000 ATOM 542 HB3 H 35 TRP mhp= 52 0.6666 charge= 0.1000 ATOM 543 HD1 H 35 TRP mhp= 48 0.5180 charge= 0.1300 ATOM 544 HE3 H 35 TRP mhp= 47 0.6301 charge= 0.1000 ATOM 545 HZ2 H 35 TRP mhp= 47 0.6301 charge= 0.1000 ATOM 546 HZ3 H 35 TRP mhp= 47 0.6301 charge= 0.1000 ATOM 547 HH2 H 35 TRP mhp= 47 0.6301 charge= 0.1000 ATOM 548 HE1 H 35 TRP mhp= 50 -0.1036 charge= 0.3278 ATOM 549 N N.2 36 GLN mhp= 72 -0.5113 charge= -0.5985 ATOM 550 CA C.3 36 GLN mhp= 8 -0.6805 charge= 0.0965 ATOM 551 C C.2 36 GLN mhp= 40 -0.1002 charge= 0.3983 ATOM 552 O O.2 36 GLN mhp= 58 -0.0233 charge= -0.3241 ATOM 553 CB C.3 36 GLN mhp= 2 -1.0120 charge= -0.2000 ATOM 554 CG C.3 36 GLN mhp= 2 -1.0120 charge= -0.1135 ATOM 555 CD C.2 36 GLN mhp= 40 -0.1002 charge= 0.3983 ATOM 556 OE1 O.2 36 GLN mhp= 58 -0.0233 charge= -0.3241 ATOM 557 NE2 N.2 36 GLN mhp= 72 -0.5113 charge= -0.8163 ATOM 558 H H 36 GLN mhp= 50 -0.1036 charge= 0.3278 ATOM 559 HA H 36 GLN mhp= 51 0.5234 charge= 0.1000 ATOM 560 HB2 H 36 GLN mhp= 52 0.6666 charge= 0.1000 ATOM 561 HB3 H 36 GLN mhp= 52 0.6666 charge= 0.1000 ATOM 562 HG2 H 36 GLN mhp= 51 0.5234 charge= 0.1000 ATOM 563 HG3 H 36 GLN mhp= 51 0.5234 charge= 0.1000 ATOM 564 HE21 H 36 GLN mhp= 50 -0.1036 charge= 0.3278 ATOM 565 HE22 H 36 GLN mhp= 50 -0.1036 charge= 0.3278 ATOM 566 N N.2 37 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 567 CA C.3 37 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 568 C C.2 37 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 569 O O.2 37 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 570 CB C.3 37 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 571 CG C.ar 37 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 572 CD1 C.ar 37 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 573 CD2 C.ar 37 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 574 CE1 C.ar 37 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 575 CE2 C.ar 37 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 576 CZ C.ar 37 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 577 H H 37 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 578 HA H 37 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 579 HB2 H 37 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 580 HB3 H 37 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 581 HD1 H 37 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 582 HD2 H 37 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 583 HE1 H 37 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 584 HE2 H 37 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 585 HZ H 37 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 586 N N.2 38 SER mhp= 72 -0.5113 charge= -0.5985 ATOM 587 CA C.3 38 SER mhp= 8 -0.6805 charge= 0.0965 ATOM 588 C C.2 38 SER mhp= 40 -0.1002 charge= 0.3983 ATOM 589 O O.2 38 SER mhp= 58 -0.0233 charge= -0.3241 ATOM 590 CB C.3 38 SER mhp= 6 -1.2486 charge= -0.1700 ATOM 591 OG O.3 38 SER mhp= 56 -0.3567 charge= -0.1490 ATOM 592 H H 38 SER mhp= 50 -0.1036 charge= 0.3278 ATOM 593 HA H 38 SER mhp= 51 0.5234 charge= 0.1000 ATOM 594 HB2 H 38 SER mhp= 47 0.6301 charge= 0.1000 ATOM 595 HB3 H 38 SER mhp= 47 0.6301 charge= 0.1000 ATOM 596 HG H 38 SER mhp= 50 -0.1036 charge= 0.1190 ATOM 597 N N.2 39 MET mhp= 72 -0.5113 charge= -0.5985 ATOM 598 CA C.3 39 MET mhp= 8 -0.6805 charge= 0.0965 ATOM 599 C C.2 39 MET mhp= 40 -0.1002 charge= 0.3983 ATOM 600 O O.2 39 MET mhp= 58 -0.0233 charge= -0.3241 ATOM 601 CB C.3 39 MET mhp= 2 -1.0120 charge= -0.2000 ATOM 602 CG C.3 39 MET mhp= 6 -1.2486 charge= -0.2500 ATOM 603 SD S.3 39 MET mhp= 107 0.5906 charge= 0.1000 ATOM 604 CE C.3 39 MET mhp= 5 -1.7880 charge= -0.3500 ATOM 605 H H 39 MET mhp= 50 -0.1036 charge= 0.3278 ATOM 606 HA H 39 MET mhp= 51 0.5234 charge= 0.1000 ATOM 607 HB2 H 39 MET mhp= 53 0.5372 charge= 0.1000 ATOM 608 HB3 H 39 MET mhp= 53 0.5372 charge= 0.1000 ATOM 609 HG2 H 39 MET mhp= 47 0.6301 charge= 0.1000 ATOM 610 HG3 H 39 MET mhp= 47 0.6301 charge= 0.1000 ATOM 611 HE1 H 39 MET mhp= 47 0.6301 charge= 0.1000 ATOM 612 HE2 H 39 MET mhp= 47 0.6301 charge= 0.1000 ATOM 613 HE3 H 39 MET mhp= 47 0.6301 charge= 0.1000 ATOM 614 N N.2 40 LEU mhp= 72 -0.5113 charge= -0.5985 ATOM 615 CA C.3 40 LEU mhp= 8 -0.6805 charge= 0.0965 ATOM 616 C C.2 40 LEU mhp= 40 -0.1002 charge= 0.3983 ATOM 617 O O.2 40 LEU mhp= 58 -0.0233 charge= -0.3241 ATOM 618 CB C.3 40 LEU mhp= 2 -1.0120 charge= -0.2000 ATOM 619 CG C.3 40 LEU mhp= 3 -0.6681 charge= -0.1000 ATOM 620 CD1 C.3 40 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 621 CD2 C.3 40 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 622 H H 40 LEU mhp= 50 -0.1036 charge= 0.3278 ATOM 623 HA H 40 LEU mhp= 51 0.5234 charge= 0.1000 ATOM 624 HB2 H 40 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 625 HB3 H 40 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 626 HG H 40 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 627 HD11 H 40 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 628 HD12 H 40 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 629 HD13 H 40 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 630 HD21 H 40 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 631 HD22 H 40 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 632 HD23 H 40 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 633 N N.2 41 ALA mhp= 72 -0.5113 charge= -0.5985 ATOM 634 CA C.3 41 ALA mhp= 8 -0.6805 charge= 0.0965 ATOM 635 C C.2 41 ALA mhp= 40 -0.1002 charge= 0.3983 ATOM 636 O O.2 41 ALA mhp= 58 -0.0233 charge= -0.3241 ATOM 637 CB C.3 41 ALA mhp= 1 -1.5603 charge= -0.3000 ATOM 638 H H 41 ALA mhp= 50 -0.1036 charge= 0.3278 ATOM 639 HA H 41 ALA mhp= 51 0.5234 charge= 0.1000 ATOM 640 HB1 H 41 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 641 HB2 H 41 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 642 HB3 H 41 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 643 N N.2 42 ALA mhp= 72 -0.5113 charge= -0.5985 ATOM 644 CA C.3 42 ALA mhp= 8 -0.6805 charge= 0.0965 ATOM 645 C C.2 42 ALA mhp= 40 -0.1002 charge= 0.3983 ATOM 646 O O.2 42 ALA mhp= 58 -0.0233 charge= -0.3241 ATOM 647 CB C.3 42 ALA mhp= 1 -1.5603 charge= -0.3000 ATOM 648 H H 42 ALA mhp= 50 -0.1036 charge= 0.3278 ATOM 649 HA H 42 ALA mhp= 51 0.5234 charge= 0.1000 ATOM 650 HB1 H 42 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 651 HB2 H 42 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 652 HB3 H 42 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 653 N N.2 43 TYR mhp= 72 -0.5113 charge= -0.5985 ATOM 654 CA C.3 43 TYR mhp= 8 -0.6805 charge= 0.0965 ATOM 655 C C.2 43 TYR mhp= 40 -0.1002 charge= 0.3983 ATOM 656 O O.2 43 TYR mhp= 58 -0.0233 charge= -0.3241 ATOM 657 CB C.3 43 TYR mhp= 2 -1.0120 charge= -0.2000 ATOM 658 CG C.ar 43 TYR mhp= 25 0.1492 charge= 0.0000 ATOM 659 CD1 C.ar 43 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 660 CD2 C.ar 43 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 661 CE1 C.ar 43 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 662 CE2 C.ar 43 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 663 CZ C.ar 43 TYR mhp= 26 0.1539 charge= 0.0300 ATOM 664 OH O.3 43 TYR mhp= 57 -0.0127 charge= -0.1490 ATOM 665 H H 43 TYR mhp= 50 -0.1036 charge= 0.3278 ATOM 666 HA H 43 TYR mhp= 51 0.5234 charge= 0.1000 ATOM 667 HB2 H 43 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 668 HB3 H 43 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 669 HD1 H 43 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 670 HD2 H 43 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 671 HE1 H 43 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 672 HE2 H 43 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 673 HH H 43 TYR mhp= 50 -0.1036 charge= 0.1190 ATOM 674 N N.2 44 MET mhp= 72 -0.5113 charge= -0.5985 ATOM 675 CA C.3 44 MET mhp= 8 -0.6805 charge= 0.0965 ATOM 676 C C.2 44 MET mhp= 40 -0.1002 charge= 0.3983 ATOM 677 O O.2 44 MET mhp= 58 -0.0233 charge= -0.3241 ATOM 678 CB C.3 44 MET mhp= 2 -1.0120 charge= -0.2000 ATOM 679 CG C.3 44 MET mhp= 6 -1.2486 charge= -0.2500 ATOM 680 SD S.3 44 MET mhp= 107 0.5906 charge= 0.1000 ATOM 681 CE C.3 44 MET mhp= 5 -1.7880 charge= -0.3500 ATOM 682 H H 44 MET mhp= 50 -0.1036 charge= 0.3278 ATOM 683 HA H 44 MET mhp= 51 0.5234 charge= 0.1000 ATOM 684 HB2 H 44 MET mhp= 53 0.5372 charge= 0.1000 ATOM 685 HB3 H 44 MET mhp= 53 0.5372 charge= 0.1000 ATOM 686 HG2 H 44 MET mhp= 47 0.6301 charge= 0.1000 ATOM 687 HG3 H 44 MET mhp= 47 0.6301 charge= 0.1000 ATOM 688 HE1 H 44 MET mhp= 47 0.6301 charge= 0.1000 ATOM 689 HE2 H 44 MET mhp= 47 0.6301 charge= 0.1000 ATOM 690 HE3 H 44 MET mhp= 47 0.6301 charge= 0.1000 ATOM 691 N N.2 45 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 692 CA C.3 45 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 693 C C.2 45 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 694 O O.2 45 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 695 CB C.3 45 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 696 CG C.ar 45 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 697 CD1 C.ar 45 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 698 CD2 C.ar 45 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 699 CE1 C.ar 45 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 700 CE2 C.ar 45 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 701 CZ C.ar 45 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 702 H H 45 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 703 HA H 45 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 704 HB2 H 45 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 705 HB3 H 45 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 706 HD1 H 45 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 707 HD2 H 45 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 708 HE1 H 45 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 709 HE2 H 45 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 710 HZ H 45 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 711 N N.2 46 LEU mhp= 72 -0.5113 charge= -0.5985 ATOM 712 CA C.3 46 LEU mhp= 8 -0.6805 charge= 0.0965 ATOM 713 C C.2 46 LEU mhp= 40 -0.1002 charge= 0.3983 ATOM 714 O O.2 46 LEU mhp= 58 -0.0233 charge= -0.3241 ATOM 715 CB C.3 46 LEU mhp= 2 -1.0120 charge= -0.2000 ATOM 716 CG C.3 46 LEU mhp= 3 -0.6681 charge= -0.1000 ATOM 717 CD1 C.3 46 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 718 CD2 C.3 46 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 719 H H 46 LEU mhp= 50 -0.1036 charge= 0.3278 ATOM 720 HA H 46 LEU mhp= 51 0.5234 charge= 0.1000 ATOM 721 HB2 H 46 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 722 HB3 H 46 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 723 HG H 46 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 724 HD21 H 46 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 725 HD22 H 46 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 726 HD23 H 46 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 727 HD11 H 46 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 728 HD12 H 46 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 729 HD13 H 46 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 730 N N.2 47 LEU mhp= 72 -0.5113 charge= -0.5985 ATOM 731 CA C.3 47 LEU mhp= 8 -0.6805 charge= 0.0965 ATOM 732 C C.2 47 LEU mhp= 40 -0.1002 charge= 0.3983 ATOM 733 O O.2 47 LEU mhp= 58 -0.0233 charge= -0.3241 ATOM 734 CB C.3 47 LEU mhp= 2 -1.0120 charge= -0.2000 ATOM 735 CG C.3 47 LEU mhp= 3 -0.6681 charge= -0.1000 ATOM 736 CD1 C.3 47 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 737 CD2 C.3 47 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 738 H H 47 LEU mhp= 50 -0.1036 charge= 0.3278 ATOM 739 HA H 47 LEU mhp= 51 0.5234 charge= 0.1000 ATOM 740 HB2 H 47 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 741 HB3 H 47 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 742 HG H 47 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 743 HD11 H 47 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 744 HD12 H 47 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 745 HD13 H 47 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 746 HD21 H 47 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 747 HD22 H 47 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 748 HD23 H 47 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 749 N N.2 48 ILE mhp= 72 -0.5113 charge= -0.5985 ATOM 750 CA C.3 48 ILE mhp= 8 -0.6805 charge= 0.0965 ATOM 751 C C.2 48 ILE mhp= 40 -0.1002 charge= 0.3983 ATOM 752 O O.2 48 ILE mhp= 58 -0.0233 charge= -0.3241 ATOM 753 CB C.3 48 ILE mhp= 3 -0.6681 charge= -0.1000 ATOM 754 CG1 C.3 48 ILE mhp= 2 -1.0120 charge= -0.2000 ATOM 755 CG2 C.3 48 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 756 CD1 C.3 48 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 757 H H 48 ILE mhp= 50 -0.1036 charge= 0.3278 ATOM 758 HA H 48 ILE mhp= 51 0.5234 charge= 0.1000 ATOM 759 HB H 48 ILE mhp= 52 0.6666 charge= 0.1000 ATOM 760 HG12 H 48 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 761 HG13 H 48 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 762 HG21 H 48 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 763 HG22 H 48 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 764 HG23 H 48 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 765 HD11 H 48 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 766 HD12 H 48 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 767 HD13 H 48 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 768 N N.2 49 MET mhp= 72 -0.5113 charge= -0.5985 ATOM 769 CA C.3 49 MET mhp= 8 -0.6805 charge= 0.0965 ATOM 770 C C.2 49 MET mhp= 40 -0.1002 charge= 0.3983 ATOM 771 O O.2 49 MET mhp= 58 -0.0233 charge= -0.3241 ATOM 772 CB C.3 49 MET mhp= 2 -1.0120 charge= -0.2000 ATOM 773 CG C.3 49 MET mhp= 6 -1.2486 charge= -0.2500 ATOM 774 SD S.3 49 MET mhp= 107 0.5906 charge= 0.1000 ATOM 775 CE C.3 49 MET mhp= 5 -1.7880 charge= -0.3500 ATOM 776 H H 49 MET mhp= 50 -0.1036 charge= 0.3278 ATOM 777 HA H 49 MET mhp= 51 0.5234 charge= 0.1000 ATOM 778 HB2 H 49 MET mhp= 53 0.5372 charge= 0.1000 ATOM 779 HB3 H 49 MET mhp= 53 0.5372 charge= 0.1000 ATOM 780 HG2 H 49 MET mhp= 47 0.6301 charge= 0.1000 ATOM 781 HG3 H 49 MET mhp= 47 0.6301 charge= 0.1000 ATOM 782 HE1 H 49 MET mhp= 47 0.6301 charge= 0.1000 ATOM 783 HE2 H 49 MET mhp= 47 0.6301 charge= 0.1000 ATOM 784 HE3 H 49 MET mhp= 47 0.6301 charge= 0.1000 ATOM 785 N N.2 50 LEU mhp= 72 -0.5113 charge= -0.5985 ATOM 786 CA C.3 50 LEU mhp= 8 -0.6805 charge= 0.0965 ATOM 787 C C.2 50 LEU mhp= 40 -0.1002 charge= 0.3983 ATOM 788 O O.2 50 LEU mhp= 58 -0.0233 charge= -0.3241 ATOM 789 CB C.3 50 LEU mhp= 2 -1.0120 charge= -0.2000 ATOM 790 CG C.3 50 LEU mhp= 3 -0.6681 charge= -0.1000 ATOM 791 CD1 C.3 50 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 792 CD2 C.3 50 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 793 H H 50 LEU mhp= 50 -0.1036 charge= 0.3278 ATOM 794 HA H 50 LEU mhp= 51 0.5234 charge= 0.1000 ATOM 795 HB2 H 50 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 796 HB3 H 50 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 797 HG H 50 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 798 HD11 H 50 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 799 HD12 H 50 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 800 HD13 H 50 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 801 HD21 H 50 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 802 HD22 H 50 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 803 HD23 H 50 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 804 N N.2 51 GLY mhp= 72 -0.5113 charge= -0.5985 ATOM 805 CA C.3 51 GLY mhp= 6 -1.2486 charge= -0.0035 ATOM 806 C C.2 51 GLY mhp= 40 -0.1002 charge= 0.3983 ATOM 807 O O.2 51 GLY mhp= 58 -0.0233 charge= -0.3241 ATOM 808 H H 51 GLY mhp= 50 -0.1036 charge= 0.3278 ATOM 809 HA2 H 51 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 810 HA3 H 51 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 811 N N.2 52 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 812 CA C.3 52 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 813 C C.2 52 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 814 O O.2 52 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 815 CB C.3 52 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 816 CG C.ar 52 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 817 CD1 C.ar 52 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 818 CD2 C.ar 52 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 819 CE1 C.ar 52 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 820 CE2 C.ar 52 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 821 CZ C.ar 52 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 822 H H 52 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 823 HA H 52 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 824 HB2 H 52 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 825 HB3 H 52 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 826 HD1 H 52 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 827 HD2 H 52 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 828 HE1 H 52 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 829 HE2 H 52 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 830 HZ H 52 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 831 N N.2 53 PRO mhp= 72 -0.5113 charge= -0.6007 ATOM 832 CA C.3 53 PRO mhp= 8 -0.6805 charge= 0.2065 ATOM 833 C C.2 53 PRO mhp= 40 -0.1002 charge= 0.3983 ATOM 834 O O.2 53 PRO mhp= 58 -0.0233 charge= -0.3241 ATOM 835 CB C.3 53 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 836 CG C.3 53 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 837 CD C.3 53 PRO mhp= 6 -1.2486 charge= 0.0200 ATOM 838 HA H 53 PRO mhp= 51 0.5234 charge= 0.1000 ATOM 839 HB2 H 53 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 840 HB3 H 53 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 841 HG2 H 53 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 842 HG3 H 53 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 843 HD2 H 53 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 844 HD3 H 53 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 845 N N.2 54 ILE mhp= 72 -0.5113 charge= -0.5985 ATOM 846 CA C.3 54 ILE mhp= 8 -0.6805 charge= 0.0965 ATOM 847 C C.2 54 ILE mhp= 40 -0.1002 charge= 0.3983 ATOM 848 O O.2 54 ILE mhp= 58 -0.0233 charge= -0.3241 ATOM 849 CB C.3 54 ILE mhp= 3 -0.6681 charge= -0.1000 ATOM 850 CG1 C.3 54 ILE mhp= 2 -1.0120 charge= -0.2000 ATOM 851 CG2 C.3 54 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 852 CD1 C.3 54 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 853 H H 54 ILE mhp= 50 -0.1036 charge= 0.3278 ATOM 854 HA H 54 ILE mhp= 51 0.5234 charge= 0.1000 ATOM 855 HB H 54 ILE mhp= 52 0.6666 charge= 0.1000 ATOM 856 HG12 H 54 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 857 HG13 H 54 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 858 HG21 H 54 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 859 HG22 H 54 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 860 HG23 H 54 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 861 HD11 H 54 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 862 HD12 H 54 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 863 HD13 H 54 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 864 N N.2 55 ASN mhp= 72 -0.5113 charge= -0.5985 ATOM 865 CA C.3 55 ASN mhp= 8 -0.6805 charge= 0.0965 ATOM 866 C C.2 55 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 867 O O.2 55 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 868 CB C.3 55 ASN mhp= 2 -1.0120 charge= -0.1135 ATOM 869 CG C.2 55 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 870 OD1 O.2 55 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 871 ND2 N.2 55 ASN mhp= 72 -0.5113 charge= -0.8163 ATOM 872 H H 55 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 873 HA H 55 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 874 HB2 H 55 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 875 HB3 H 55 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 876 HD21 H 55 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 877 HD22 H 55 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 878 N N.2 56 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 879 CA C.3 56 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 880 C C.2 56 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 881 O O.2 56 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 882 CB C.3 56 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 883 CG C.ar 56 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 884 CD1 C.ar 56 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 885 CD2 C.ar 56 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 886 CE1 C.ar 56 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 887 CE2 C.ar 56 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 888 CZ C.ar 56 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 889 H H 56 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 890 HA H 56 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 891 HB2 H 56 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 892 HB3 H 56 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 893 HD1 H 56 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 894 HD2 H 56 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 895 HE1 H 56 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 896 HE2 H 56 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 897 HZ H 56 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 898 N N.2 57 LEU mhp= 72 -0.5113 charge= -0.5985 ATOM 899 CA C.3 57 LEU mhp= 8 -0.6805 charge= 0.0965 ATOM 900 C C.2 57 LEU mhp= 40 -0.1002 charge= 0.3983 ATOM 901 O O.2 57 LEU mhp= 58 -0.0233 charge= -0.3241 ATOM 902 CB C.3 57 LEU mhp= 2 -1.0120 charge= -0.2000 ATOM 903 CG C.3 57 LEU mhp= 3 -0.6681 charge= -0.1000 ATOM 904 CD1 C.3 57 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 905 CD2 C.3 57 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 906 H H 57 LEU mhp= 50 -0.1036 charge= 0.3278 ATOM 907 HA H 57 LEU mhp= 51 0.5234 charge= 0.1000 ATOM 908 HB2 H 57 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 909 HB3 H 57 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 910 HG H 57 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 911 HD21 H 57 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 912 HD22 H 57 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 913 HD23 H 57 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 914 HD11 H 57 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 915 HD12 H 57 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 916 HD13 H 57 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 917 N N.2 58 THR mhp= 72 -0.5113 charge= -0.5985 ATOM 918 CA C.3 58 THR mhp= 8 -0.6805 charge= 0.0965 ATOM 919 C C.2 58 THR mhp= 40 -0.1002 charge= 0.3983 ATOM 920 O O.2 58 THR mhp= 58 -0.0233 charge= -0.3241 ATOM 921 CB C.3 58 THR mhp= 8 -0.6805 charge= -0.0700 ATOM 922 OG1 O.3 58 THR mhp= 56 -0.3567 charge= -0.1490 ATOM 923 CG2 C.3 58 THR mhp= 1 -1.5603 charge= -0.3000 ATOM 924 H H 58 THR mhp= 50 -0.1036 charge= 0.3278 ATOM 925 HA H 58 THR mhp= 51 0.5234 charge= 0.1000 ATOM 926 HB H 58 THR mhp= 47 0.6301 charge= 0.1000 ATOM 927 HG21 H 58 THR mhp= 52 0.6666 charge= 0.1000 ATOM 928 HG22 H 58 THR mhp= 52 0.6666 charge= 0.1000 ATOM 929 HG23 H 58 THR mhp= 52 0.6666 charge= 0.1000 ATOM 930 HG1 H 58 THR mhp= 50 -0.1036 charge= 0.1190 ATOM 931 N N.2 59 LEU mhp= 72 -0.5113 charge= -0.5985 ATOM 932 CA C.3 59 LEU mhp= 8 -0.6805 charge= 0.0965 ATOM 933 C C.2 59 LEU mhp= 40 -0.1002 charge= 0.3983 ATOM 934 O O.2 59 LEU mhp= 58 -0.0233 charge= -0.3241 ATOM 935 CB C.3 59 LEU mhp= 2 -1.0120 charge= -0.2000 ATOM 936 CG C.3 59 LEU mhp= 3 -0.6681 charge= -0.1000 ATOM 937 CD1 C.3 59 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 938 CD2 C.3 59 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 939 H H 59 LEU mhp= 50 -0.1036 charge= 0.3278 ATOM 940 HA H 59 LEU mhp= 51 0.5234 charge= 0.1000 ATOM 941 HB2 H 59 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 942 HB3 H 59 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 943 HG H 59 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 944 HD11 H 59 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 945 HD12 H 59 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 946 HD13 H 59 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 947 HD21 H 59 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 948 HD22 H 59 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 949 HD23 H 59 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 950 N N.2 60 TYR mhp= 72 -0.5113 charge= -0.5985 ATOM 951 CA C.3 60 TYR mhp= 8 -0.6805 charge= 0.0965 ATOM 952 C C.2 60 TYR mhp= 40 -0.1002 charge= 0.3983 ATOM 953 O O.2 60 TYR mhp= 58 -0.0233 charge= -0.3241 ATOM 954 CB C.3 60 TYR mhp= 2 -1.0120 charge= -0.2000 ATOM 955 CG C.ar 60 TYR mhp= 25 0.1492 charge= 0.0000 ATOM 956 CD1 C.ar 60 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 957 CD2 C.ar 60 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 958 CE1 C.ar 60 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 959 CE2 C.ar 60 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 960 CZ C.ar 60 TYR mhp= 26 0.1539 charge= 0.0300 ATOM 961 OH O.3 60 TYR mhp= 57 -0.0127 charge= -0.1490 ATOM 962 H H 60 TYR mhp= 50 -0.1036 charge= 0.3278 ATOM 963 HA H 60 TYR mhp= 51 0.5234 charge= 0.1000 ATOM 964 HB2 H 60 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 965 HB3 H 60 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 966 HD1 H 60 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 967 HD2 H 60 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 968 HE1 H 60 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 969 HE2 H 60 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 970 HH H 60 TYR mhp= 50 -0.1036 charge= 0.1190 ATOM 971 N N.2 61 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 972 CA C.3 61 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 973 C C.2 61 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 974 O O.2 61 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 975 CB C.3 61 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 976 CG1 C.3 61 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 977 CG2 C.3 61 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 978 H H 61 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 979 HA H 61 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 980 HB H 61 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 981 HG11 H 61 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 982 HG12 H 61 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 983 HG13 H 61 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 984 HG21 H 61 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 985 HG22 H 61 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 986 HG23 H 61 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 987 N N.2 62 THR mhp= 72 -0.5113 charge= -0.5985 ATOM 988 CA C.3 62 THR mhp= 8 -0.6805 charge= 0.0965 ATOM 989 C C.2 62 THR mhp= 40 -0.1002 charge= 0.3983 ATOM 990 O O.2 62 THR mhp= 58 -0.0233 charge= -0.3241 ATOM 991 CB C.3 62 THR mhp= 8 -0.6805 charge= -0.0700 ATOM 992 OG1 O.3 62 THR mhp= 56 -0.3567 charge= -0.1490 ATOM 993 CG2 C.3 62 THR mhp= 1 -1.5603 charge= -0.3000 ATOM 994 H H 62 THR mhp= 50 -0.1036 charge= 0.3278 ATOM 995 HA H 62 THR mhp= 51 0.5234 charge= 0.1000 ATOM 996 HB H 62 THR mhp= 47 0.6301 charge= 0.1000 ATOM 997 HG1 H 62 THR mhp= 50 -0.1036 charge= 0.1190 ATOM 998 HG21 H 62 THR mhp= 52 0.6666 charge= 0.1000 ATOM 999 HG22 H 62 THR mhp= 52 0.6666 charge= 0.1000 ATOM 1000 HG23 H 62 THR mhp= 52 0.6666 charge= 0.1000 ATOM 1001 N N.2 63 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 1002 CA C.3 63 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 1003 C C.2 63 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 1004 O O.2 63 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 1005 CB C.3 63 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 1006 CG1 C.3 63 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 1007 CG2 C.3 63 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 1008 H H 63 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 1009 HA H 63 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 1010 HB H 63 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 1011 HG11 H 63 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 1012 HG12 H 63 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 1013 HG13 H 63 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 1014 HG21 H 63 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 1015 HG22 H 63 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 1016 HG23 H 63 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 1017 N N.2 64 GLN mhp= 72 -0.5113 charge= -0.5985 ATOM 1018 CA C.3 64 GLN mhp= 8 -0.6805 charge= 0.0965 ATOM 1019 C C.2 64 GLN mhp= 40 -0.1002 charge= 0.3983 ATOM 1020 O O.2 64 GLN mhp= 58 -0.0233 charge= -0.3241 ATOM 1021 CB C.3 64 GLN mhp= 2 -1.0120 charge= -0.2000 ATOM 1022 CG C.3 64 GLN mhp= 2 -1.0120 charge= -0.1135 ATOM 1023 CD C.2 64 GLN mhp= 40 -0.1002 charge= 0.3983 ATOM 1024 OE1 O.2 64 GLN mhp= 58 -0.0233 charge= -0.3241 ATOM 1025 NE2 N.2 64 GLN mhp= 72 -0.5113 charge= -0.8163 ATOM 1026 H H 64 GLN mhp= 50 -0.1036 charge= 0.3278 ATOM 1027 HA H 64 GLN mhp= 51 0.5234 charge= 0.1000 ATOM 1028 HB2 H 64 GLN mhp= 52 0.6666 charge= 0.1000 ATOM 1029 HB3 H 64 GLN mhp= 52 0.6666 charge= 0.1000 ATOM 1030 HG2 H 64 GLN mhp= 51 0.5234 charge= 0.1000 ATOM 1031 HG3 H 64 GLN mhp= 51 0.5234 charge= 0.1000 ATOM 1032 HE21 H 64 GLN mhp= 50 -0.1036 charge= 0.3278 ATOM 1033 HE22 H 64 GLN mhp= 50 -0.1036 charge= 0.3278 ATOM 1034 N N.2 65 HIS mhp= 72 -0.5113 charge= -0.5985 ATOM 1035 CA C.3 65 HIS mhp= 8 -0.6805 charge= 0.0965 ATOM 1036 C C.2 65 HIS mhp= 40 -0.1002 charge= 0.3983 ATOM 1037 O O.2 65 HIS mhp= 58 -0.0233 charge= -0.3241 ATOM 1038 CB C.3 65 HIS mhp= 2 -1.0120 charge= -0.2000 ATOM 1039 CG C.ar 65 HIS mhp= 28 0.2361 charge= 0.1993 ATOM 1040 ND1 N.ar 65 HIS mhp= 75 -0.1624 charge= -0.3986 ATOM 1041 CD2 C.ar 65 HIS mhp= 33 -0.3723 charge= 0.0693 ATOM 1042 CE1 C.ar 65 HIS mhp= 42 -0.2147 charge= 0.2686 ATOM 1043 NE2 N.ar 65 HIS mhp= 73 0.1259 charge= -0.7264 ATOM 1044 H H 65 HIS mhp= 50 -0.1036 charge= 0.3278 ATOM 1045 HA H 65 HIS mhp= 51 0.5234 charge= 0.1000 ATOM 1046 HB2 H 65 HIS mhp= 51 0.5234 charge= 0.1000 ATOM 1047 HB3 H 65 HIS mhp= 51 0.5234 charge= 0.1000 ATOM 1048 HD2 H 65 HIS mhp= 48 0.5180 charge= 0.1300 ATOM 1049 HE1 H 65 HIS mhp= 49 -0.0371 charge= 0.1300 ATOM 1050 HE2 H 65 HIS mhp= 50 -0.1036 charge= 0.3278 ATOM 1051 N N.2 66 LYS mhp= 72 -0.5113 charge= -0.5985 ATOM 1052 CA C.3 66 LYS mhp= 8 -0.6805 charge= 0.0965 ATOM 1053 C C.2 66 LYS mhp= 40 -0.1002 charge= 0.3983 ATOM 1054 O O.2 66 LYS mhp= 58 -0.0233 charge= -0.3241 ATOM 1055 CB C.3 66 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 1056 CG C.3 66 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 1057 CD C.3 66 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 1058 CE C.3 66 LYS mhp= 6 -1.2486 charge= 0.2200 ATOM 1059 NZ N.4 66 LYS mhp= 79 -1.4439 charge= -0.5000 ATOM 1060 H H 66 LYS mhp= 50 -0.1036 charge= 0.3278 ATOM 1061 HA H 66 LYS mhp= 51 0.5234 charge= 0.1000 ATOM 1062 HB2 H 66 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 1063 HB3 H 66 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 1064 HG2 H 66 LYS mhp= 46 0.7341 charge= 0.1000 ATOM 1065 HG3 H 66 LYS mhp= 46 0.7341 charge= 0.1000 ATOM 1066 HD2 H 66 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 1067 HD3 H 66 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 1068 HE2 H 66 LYS mhp= 47 0.6301 charge= 0.1000 ATOM 1069 HE3 H 66 LYS mhp= 47 0.6301 charge= 0.1000 ATOM 1070 HZ1 H 66 LYS mhp= 50 -0.1036 charge= 0.3600 ATOM 1071 HZ2 H 66 LYS mhp= 50 -0.1036 charge= 0.3600 ATOM 1072 HZ3 H 66 LYS mhp= 50 -0.1036 charge= 0.3600 ATOM 1073 N N.2 67 LYS mhp= 72 -0.5113 charge= -0.5985 ATOM 1074 CA C.3 67 LYS mhp= 8 -0.6805 charge= 0.0965 ATOM 1075 C C.2 67 LYS mhp= 40 -0.1002 charge= 0.3983 ATOM 1076 O O.2 67 LYS mhp= 58 -0.0233 charge= -0.3241 ATOM 1077 CB C.3 67 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 1078 CG C.3 67 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 1079 CD C.3 67 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 1080 CE C.3 67 LYS mhp= 6 -1.2486 charge= 0.2200 ATOM 1081 NZ N.4 67 LYS mhp= 79 -1.4439 charge= -0.5000 ATOM 1082 H H 67 LYS mhp= 50 -0.1036 charge= 0.3278 ATOM 1083 HA H 67 LYS mhp= 51 0.5234 charge= 0.1000 ATOM 1084 HB2 H 67 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 1085 HB3 H 67 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 1086 HG2 H 67 LYS mhp= 46 0.7341 charge= 0.1000 ATOM 1087 HG3 H 67 LYS mhp= 46 0.7341 charge= 0.1000 ATOM 1088 HD2 H 67 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 1089 HD3 H 67 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 1090 HE2 H 67 LYS mhp= 47 0.6301 charge= 0.1000 ATOM 1091 HE3 H 67 LYS mhp= 47 0.6301 charge= 0.1000 ATOM 1092 HZ1 H 67 LYS mhp= 50 -0.1036 charge= 0.3600 ATOM 1093 HZ2 H 67 LYS mhp= 50 -0.1036 charge= 0.3600 ATOM 1094 HZ3 H 67 LYS mhp= 50 -0.1036 charge= 0.3600 ATOM 1095 N N.2 68 LEU mhp= 72 -0.5113 charge= -0.5985 ATOM 1096 CA C.3 68 LEU mhp= 8 -0.6805 charge= 0.0965 ATOM 1097 C C.2 68 LEU mhp= 40 -0.1002 charge= 0.3983 ATOM 1098 O O.2 68 LEU mhp= 58 -0.0233 charge= -0.3241 ATOM 1099 CB C.3 68 LEU mhp= 2 -1.0120 charge= -0.2000 ATOM 1100 CG C.3 68 LEU mhp= 3 -0.6681 charge= -0.1000 ATOM 1101 CD1 C.3 68 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 1102 CD2 C.3 68 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 1103 H H 68 LEU mhp= 50 -0.1036 charge= 0.3278 ATOM 1104 HA H 68 LEU mhp= 51 0.5234 charge= 0.1000 ATOM 1105 HB2 H 68 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 1106 HB3 H 68 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 1107 HG H 68 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1108 HD11 H 68 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1109 HD12 H 68 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1110 HD13 H 68 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1111 HD21 H 68 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1112 HD22 H 68 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1113 HD23 H 68 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1114 N N.2 69 ARG mhp= 72 -0.5113 charge= -0.5985 ATOM 1115 CA C.3 69 ARG mhp= 8 -0.6805 charge= 0.0965 ATOM 1116 C C.2 69 ARG mhp= 40 -0.1002 charge= 0.3983 ATOM 1117 O O.2 69 ARG mhp= 58 -0.0233 charge= -0.3241 ATOM 1118 CB C.3 69 ARG mhp= 2 -1.0120 charge= -0.2000 ATOM 1119 CG C.3 69 ARG mhp= 2 -1.0120 charge= -0.2000 ATOM 1120 CD C.3 69 ARG mhp= 6 -1.2486 charge= -0.0900 ATOM 1121 NE N.2 69 ARG mhp= 79 -1.4439 charge= 0.0622 ATOM 1122 CZ C.cat 69 ARG mhp= 32 0.5142 charge= -0.5000 ATOM 1123 NH1 N.3 69 ARG mhp= 79 -1.4439 charge= -0.1556 ATOM 1124 NH2 N.3 69 ARG mhp= 79 -1.4439 charge= -0.1556 ATOM 1125 H H 69 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 1126 HA H 69 ARG mhp= 51 0.5234 charge= 0.1000 ATOM 1127 HB2 H 69 ARG mhp= 52 0.6666 charge= 0.1000 ATOM 1128 HB3 H 69 ARG mhp= 52 0.6666 charge= 0.1000 ATOM 1129 HG2 H 69 ARG mhp= 52 0.6666 charge= 0.1000 ATOM 1130 HG3 H 69 ARG mhp= 52 0.6666 charge= 0.1000 ATOM 1131 HD2 H 69 ARG mhp= 47 0.6301 charge= 0.1000 ATOM 1132 HD3 H 69 ARG mhp= 47 0.6301 charge= 0.1000 ATOM 1133 HE H 69 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 1134 HH11 H 69 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 1135 HH12 H 69 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 1136 HH21 H 69 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 1137 HH22 H 69 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 1138 N N.2 70 THR mhp= 72 -0.5113 charge= -0.5985 ATOM 1139 CA C.3 70 THR mhp= 8 -0.6805 charge= 0.0965 ATOM 1140 C C.2 70 THR mhp= 40 -0.1002 charge= 0.3983 ATOM 1141 O O.2 70 THR mhp= 58 -0.0233 charge= -0.3241 ATOM 1142 CB C.3 70 THR mhp= 8 -0.6805 charge= -0.0700 ATOM 1143 OG1 O.3 70 THR mhp= 56 -0.3567 charge= -0.1490 ATOM 1144 CG2 C.3 70 THR mhp= 1 -1.5603 charge= -0.3000 ATOM 1145 H H 70 THR mhp= 50 -0.1036 charge= 0.3278 ATOM 1146 HA H 70 THR mhp= 51 0.5234 charge= 0.1000 ATOM 1147 HB H 70 THR mhp= 47 0.6301 charge= 0.1000 ATOM 1148 HG1 H 70 THR mhp= 50 -0.1036 charge= 0.1190 ATOM 1149 HG21 H 70 THR mhp= 52 0.6666 charge= 0.1000 ATOM 1150 HG22 H 70 THR mhp= 52 0.6666 charge= 0.1000 ATOM 1151 HG23 H 70 THR mhp= 52 0.6666 charge= 0.1000 ATOM 1152 N N.2 71 PRO mhp= 72 -0.5113 charge= -0.6007 ATOM 1153 CA C.3 71 PRO mhp= 8 -0.6805 charge= 0.2065 ATOM 1154 C C.2 71 PRO mhp= 40 -0.1002 charge= 0.3983 ATOM 1155 O O.2 71 PRO mhp= 58 -0.0233 charge= -0.3241 ATOM 1156 CB C.3 71 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 1157 CG C.3 71 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 1158 CD C.3 71 PRO mhp= 6 -1.2486 charge= 0.0200 ATOM 1159 HA H 71 PRO mhp= 51 0.5234 charge= 0.1000 ATOM 1160 HB2 H 71 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 1161 HB3 H 71 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 1162 HG2 H 71 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 1163 HG3 H 71 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 1164 HD2 H 71 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 1165 HD3 H 71 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 1166 N N.2 72 LEU mhp= 72 -0.5113 charge= -0.5985 ATOM 1167 CA C.3 72 LEU mhp= 8 -0.6805 charge= 0.0965 ATOM 1168 C C.2 72 LEU mhp= 40 -0.1002 charge= 0.3983 ATOM 1169 O O.2 72 LEU mhp= 58 -0.0233 charge= -0.3241 ATOM 1170 CB C.3 72 LEU mhp= 2 -1.0120 charge= -0.2000 ATOM 1171 CG C.3 72 LEU mhp= 3 -0.6681 charge= -0.1000 ATOM 1172 CD1 C.3 72 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 1173 CD2 C.3 72 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 1174 H H 72 LEU mhp= 50 -0.1036 charge= 0.3278 ATOM 1175 HA H 72 LEU mhp= 51 0.5234 charge= 0.1000 ATOM 1176 HB2 H 72 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 1177 HB3 H 72 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 1178 HG H 72 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1179 HD11 H 72 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1180 HD12 H 72 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1181 HD13 H 72 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1182 HD21 H 72 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1183 HD22 H 72 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1184 HD23 H 72 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1185 N N.2 73 ASN mhp= 72 -0.5113 charge= -0.5985 ATOM 1186 CA C.3 73 ASN mhp= 8 -0.6805 charge= 0.0965 ATOM 1187 C C.2 73 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 1188 O O.2 73 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 1189 CB C.3 73 ASN mhp= 2 -1.0120 charge= -0.1135 ATOM 1190 CG C.2 73 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 1191 OD1 O.2 73 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 1192 ND2 N.2 73 ASN mhp= 72 -0.5113 charge= -0.8163 ATOM 1193 H H 73 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 1194 HA H 73 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 1195 HB2 H 73 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 1196 HB3 H 73 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 1197 HD21 H 73 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 1198 HD22 H 73 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 1199 N N.2 74 TYR mhp= 72 -0.5113 charge= -0.5985 ATOM 1200 CA C.3 74 TYR mhp= 8 -0.6805 charge= 0.0965 ATOM 1201 C C.2 74 TYR mhp= 40 -0.1002 charge= 0.3983 ATOM 1202 O O.2 74 TYR mhp= 58 -0.0233 charge= -0.3241 ATOM 1203 CB C.3 74 TYR mhp= 2 -1.0120 charge= -0.2000 ATOM 1204 CG C.ar 74 TYR mhp= 25 0.1492 charge= 0.0000 ATOM 1205 CD1 C.ar 74 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 1206 CD2 C.ar 74 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 1207 CE1 C.ar 74 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 1208 CE2 C.ar 74 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 1209 CZ C.ar 74 TYR mhp= 26 0.1539 charge= 0.0300 ATOM 1210 OH O.3 74 TYR mhp= 57 -0.0127 charge= -0.1490 ATOM 1211 H H 74 TYR mhp= 50 -0.1036 charge= 0.3278 ATOM 1212 HA H 74 TYR mhp= 51 0.5234 charge= 0.1000 ATOM 1213 HB2 H 74 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 1214 HB3 H 74 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 1215 HD1 H 74 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 1216 HD2 H 74 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 1217 HE1 H 74 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 1218 HE2 H 74 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 1219 HH H 74 TYR mhp= 50 -0.1036 charge= 0.1190 ATOM 1220 N N.2 75 ILE mhp= 72 -0.5113 charge= -0.5985 ATOM 1221 CA C.3 75 ILE mhp= 8 -0.6805 charge= 0.0965 ATOM 1222 C C.2 75 ILE mhp= 40 -0.1002 charge= 0.3983 ATOM 1223 O O.2 75 ILE mhp= 58 -0.0233 charge= -0.3241 ATOM 1224 CB C.3 75 ILE mhp= 3 -0.6681 charge= -0.1000 ATOM 1225 CG1 C.3 75 ILE mhp= 2 -1.0120 charge= -0.2000 ATOM 1226 CG2 C.3 75 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 1227 CD1 C.3 75 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 1228 H H 75 ILE mhp= 50 -0.1036 charge= 0.3278 ATOM 1229 HA H 75 ILE mhp= 51 0.5234 charge= 0.1000 ATOM 1230 HB H 75 ILE mhp= 52 0.6666 charge= 0.1000 ATOM 1231 HG12 H 75 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 1232 HG13 H 75 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 1233 HG21 H 75 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 1234 HG22 H 75 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 1235 HG23 H 75 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 1236 HD11 H 75 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 1237 HD12 H 75 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 1238 HD13 H 75 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 1239 N N.2 76 LEU mhp= 72 -0.5113 charge= -0.5985 ATOM 1240 CA C.3 76 LEU mhp= 8 -0.6805 charge= 0.0965 ATOM 1241 C C.2 76 LEU mhp= 40 -0.1002 charge= 0.3983 ATOM 1242 O O.2 76 LEU mhp= 58 -0.0233 charge= -0.3241 ATOM 1243 CB C.3 76 LEU mhp= 2 -1.0120 charge= -0.2000 ATOM 1244 CG C.3 76 LEU mhp= 3 -0.6681 charge= -0.1000 ATOM 1245 CD1 C.3 76 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 1246 CD2 C.3 76 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 1247 H H 76 LEU mhp= 50 -0.1036 charge= 0.3278 ATOM 1248 HA H 76 LEU mhp= 51 0.5234 charge= 0.1000 ATOM 1249 HB2 H 76 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 1250 HB3 H 76 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 1251 HG H 76 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1252 HD21 H 76 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1253 HD22 H 76 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1254 HD23 H 76 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1255 HD11 H 76 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1256 HD12 H 76 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1257 HD13 H 76 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1258 N N.2 77 LEU mhp= 72 -0.5113 charge= -0.5985 ATOM 1259 CA C.3 77 LEU mhp= 8 -0.6805 charge= 0.0965 ATOM 1260 C C.2 77 LEU mhp= 40 -0.1002 charge= 0.3983 ATOM 1261 O O.2 77 LEU mhp= 58 -0.0233 charge= -0.3241 ATOM 1262 CB C.3 77 LEU mhp= 2 -1.0120 charge= -0.2000 ATOM 1263 CG C.3 77 LEU mhp= 3 -0.6681 charge= -0.1000 ATOM 1264 CD1 C.3 77 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 1265 CD2 C.3 77 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 1266 H H 77 LEU mhp= 50 -0.1036 charge= 0.3278 ATOM 1267 HA H 77 LEU mhp= 51 0.5234 charge= 0.1000 ATOM 1268 HB2 H 77 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 1269 HB3 H 77 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 1270 HG H 77 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1271 HD11 H 77 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1272 HD12 H 77 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1273 HD13 H 77 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1274 HD21 H 77 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1275 HD22 H 77 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1276 HD23 H 77 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1277 N N.2 78 ASN mhp= 72 -0.5113 charge= -0.5985 ATOM 1278 CA C.3 78 ASN mhp= 8 -0.6805 charge= 0.0965 ATOM 1279 C C.2 78 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 1280 O O.2 78 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 1281 CB C.3 78 ASN mhp= 2 -1.0120 charge= -0.1135 ATOM 1282 CG C.2 78 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 1283 OD1 O.2 78 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 1284 ND2 N.2 78 ASN mhp= 72 -0.5113 charge= -0.8163 ATOM 1285 H H 78 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 1286 HA H 78 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 1287 HB2 H 78 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 1288 HB3 H 78 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 1289 HD21 H 78 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 1290 HD22 H 78 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 1291 N N.2 79 LEU mhp= 72 -0.5113 charge= -0.5985 ATOM 1292 CA C.3 79 LEU mhp= 8 -0.6805 charge= 0.0965 ATOM 1293 C C.2 79 LEU mhp= 40 -0.1002 charge= 0.3983 ATOM 1294 O O.2 79 LEU mhp= 58 -0.0233 charge= -0.3241 ATOM 1295 CB C.3 79 LEU mhp= 2 -1.0120 charge= -0.2000 ATOM 1296 CG C.3 79 LEU mhp= 3 -0.6681 charge= -0.1000 ATOM 1297 CD1 C.3 79 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 1298 CD2 C.3 79 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 1299 H H 79 LEU mhp= 50 -0.1036 charge= 0.3278 ATOM 1300 HA H 79 LEU mhp= 51 0.5234 charge= 0.1000 ATOM 1301 HB2 H 79 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 1302 HB3 H 79 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 1303 HG H 79 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1304 HD11 H 79 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1305 HD12 H 79 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1306 HD13 H 79 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1307 HD21 H 79 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1308 HD22 H 79 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1309 HD23 H 79 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1310 N N.2 80 ALA mhp= 72 -0.5113 charge= -0.5985 ATOM 1311 CA C.3 80 ALA mhp= 8 -0.6805 charge= 0.0965 ATOM 1312 C C.2 80 ALA mhp= 40 -0.1002 charge= 0.3983 ATOM 1313 O O.2 80 ALA mhp= 58 -0.0233 charge= -0.3241 ATOM 1314 CB C.3 80 ALA mhp= 1 -1.5603 charge= -0.3000 ATOM 1315 H H 80 ALA mhp= 50 -0.1036 charge= 0.3278 ATOM 1316 HA H 80 ALA mhp= 51 0.5234 charge= 0.1000 ATOM 1317 HB1 H 80 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 1318 HB2 H 80 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 1319 HB3 H 80 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 1320 N N.2 81 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 1321 CA C.3 81 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 1322 C C.2 81 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 1323 O O.2 81 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 1324 CB C.3 81 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 1325 CG1 C.3 81 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 1326 CG2 C.3 81 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 1327 H H 81 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 1328 HA H 81 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 1329 HB H 81 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 1330 HG11 H 81 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 1331 HG12 H 81 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 1332 HG13 H 81 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 1333 HG21 H 81 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 1334 HG22 H 81 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 1335 HG23 H 81 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 1336 N N.2 82 ALA mhp= 72 -0.5113 charge= -0.5985 ATOM 1337 CA C.3 82 ALA mhp= 8 -0.6805 charge= 0.0965 ATOM 1338 C C.2 82 ALA mhp= 40 -0.1002 charge= 0.3983 ATOM 1339 O O.2 82 ALA mhp= 58 -0.0233 charge= -0.3241 ATOM 1340 CB C.3 82 ALA mhp= 1 -1.5603 charge= -0.3000 ATOM 1341 H H 82 ALA mhp= 50 -0.1036 charge= 0.3278 ATOM 1342 HA H 82 ALA mhp= 51 0.5234 charge= 0.1000 ATOM 1343 HB1 H 82 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 1344 HB2 H 82 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 1345 HB3 H 82 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 1346 N N.2 83 ASP mhp= 72 -0.5113 charge= -0.5985 ATOM 1347 CA C.3 83 ASP mhp= 8 -0.6805 charge= 0.0965 ATOM 1348 C C.2 83 ASP mhp= 40 -0.1002 charge= 0.3983 ATOM 1349 O O.2 83 ASP mhp= 58 -0.0233 charge= -0.3241 ATOM 1350 CB C.3 83 ASP mhp= 2 -1.0120 charge= -0.1135 ATOM 1351 CG C.2 83 ASP mhp= 31 0.0901 charge= 0.0535 ATOM 1352 OD1 O.co2 83 ASP mhp= 62 -0.7941 charge= -0.5700 ATOM 1353 OD2 O.co2 83 ASP mhp= 62 -0.7941 charge= -0.5700 ATOM 1354 H H 83 ASP mhp= 50 -0.1036 charge= 0.3278 ATOM 1355 HA H 83 ASP mhp= 51 0.5234 charge= 0.1000 ATOM 1356 HB2 H 83 ASP mhp= 51 0.5234 charge= 0.1000 ATOM 1357 HB3 H 83 ASP mhp= 51 0.5234 charge= 0.1000 ATOM 1358 N N.2 84 LEU mhp= 72 -0.5113 charge= -0.5985 ATOM 1359 CA C.3 84 LEU mhp= 8 -0.6805 charge= 0.0965 ATOM 1360 C C.2 84 LEU mhp= 40 -0.1002 charge= 0.3983 ATOM 1361 O O.2 84 LEU mhp= 58 -0.0233 charge= -0.3241 ATOM 1362 CB C.3 84 LEU mhp= 2 -1.0120 charge= -0.2000 ATOM 1363 CG C.3 84 LEU mhp= 3 -0.6681 charge= -0.1000 ATOM 1364 CD1 C.3 84 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 1365 CD2 C.3 84 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 1366 H H 84 LEU mhp= 50 -0.1036 charge= 0.3278 ATOM 1367 HA H 84 LEU mhp= 51 0.5234 charge= 0.1000 ATOM 1368 HB2 H 84 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 1369 HB3 H 84 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 1370 HG H 84 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1371 HD11 H 84 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1372 HD12 H 84 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1373 HD13 H 84 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1374 HD21 H 84 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1375 HD22 H 84 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1376 HD23 H 84 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1377 N N.2 85 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 1378 CA C.3 85 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 1379 C C.2 85 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 1380 O O.2 85 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 1381 CB C.3 85 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 1382 CG C.ar 85 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 1383 CD1 C.ar 85 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1384 CD2 C.ar 85 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1385 CE1 C.ar 85 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1386 CE2 C.ar 85 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1387 CZ C.ar 85 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1388 H H 85 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 1389 HA H 85 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 1390 HB2 H 85 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 1391 HB3 H 85 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 1392 HD1 H 85 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1393 HD2 H 85 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1394 HE1 H 85 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1395 HE2 H 85 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1396 HZ H 85 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1397 N N.2 86 MET mhp= 72 -0.5113 charge= -0.5985 ATOM 1398 CA C.3 86 MET mhp= 8 -0.6805 charge= 0.0965 ATOM 1399 C C.2 86 MET mhp= 40 -0.1002 charge= 0.3983 ATOM 1400 O O.2 86 MET mhp= 58 -0.0233 charge= -0.3241 ATOM 1401 CB C.3 86 MET mhp= 2 -1.0120 charge= -0.2000 ATOM 1402 CG C.3 86 MET mhp= 6 -1.2486 charge= -0.2500 ATOM 1403 SD S.3 86 MET mhp= 107 0.5906 charge= 0.1000 ATOM 1404 CE C.3 86 MET mhp= 5 -1.7880 charge= -0.3500 ATOM 1405 H H 86 MET mhp= 50 -0.1036 charge= 0.3278 ATOM 1406 HA H 86 MET mhp= 51 0.5234 charge= 0.1000 ATOM 1407 HB2 H 86 MET mhp= 53 0.5372 charge= 0.1000 ATOM 1408 HB3 H 86 MET mhp= 53 0.5372 charge= 0.1000 ATOM 1409 HG2 H 86 MET mhp= 47 0.6301 charge= 0.1000 ATOM 1410 HG3 H 86 MET mhp= 47 0.6301 charge= 0.1000 ATOM 1411 HE1 H 86 MET mhp= 47 0.6301 charge= 0.1000 ATOM 1412 HE2 H 86 MET mhp= 47 0.6301 charge= 0.1000 ATOM 1413 HE3 H 86 MET mhp= 47 0.6301 charge= 0.1000 ATOM 1414 N N.2 87 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 1415 CA C.3 87 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 1416 C C.2 87 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 1417 O O.2 87 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 1418 CB C.3 87 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 1419 CG1 C.3 87 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 1420 CG2 C.3 87 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 1421 H H 87 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 1422 HA H 87 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 1423 HB H 87 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 1424 HG11 H 87 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 1425 HG12 H 87 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 1426 HG13 H 87 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 1427 HG21 H 87 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 1428 HG22 H 87 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 1429 HG23 H 87 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 1430 N N.2 88 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 1431 CA C.3 88 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 1432 C C.2 88 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 1433 O O.2 88 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 1434 CB C.3 88 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 1435 CG C.ar 88 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 1436 CD1 C.ar 88 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1437 CD2 C.ar 88 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1438 CE1 C.ar 88 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1439 CE2 C.ar 88 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1440 CZ C.ar 88 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1441 H H 88 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 1442 HA H 88 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 1443 HB2 H 88 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 1444 HB3 H 88 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 1445 HD1 H 88 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1446 HD2 H 88 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1447 HE1 H 88 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1448 HE2 H 88 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1449 HZ H 88 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1450 N N.2 89 GLY mhp= 72 -0.5113 charge= -0.5985 ATOM 1451 CA C.3 89 GLY mhp= 6 -1.2486 charge= -0.0035 ATOM 1452 C C.2 89 GLY mhp= 40 -0.1002 charge= 0.3983 ATOM 1453 O O.2 89 GLY mhp= 58 -0.0233 charge= -0.3241 ATOM 1454 H H 89 GLY mhp= 50 -0.1036 charge= 0.3278 ATOM 1455 HA2 H 89 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 1456 HA3 H 89 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 1457 N N.2 90 GLY mhp= 72 -0.5113 charge= -0.5985 ATOM 1458 CA C.3 90 GLY mhp= 6 -1.2486 charge= -0.0035 ATOM 1459 C C.2 90 GLY mhp= 40 -0.1002 charge= 0.3983 ATOM 1460 O O.2 90 GLY mhp= 58 -0.0233 charge= -0.3241 ATOM 1461 H H 90 GLY mhp= 50 -0.1036 charge= 0.3278 ATOM 1462 HA2 H 90 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 1463 HA3 H 90 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 1464 N N.2 91 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 1465 CA C.3 91 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 1466 C C.2 91 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 1467 O O.2 91 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 1468 CB C.3 91 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 1469 CG C.ar 91 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 1470 CD1 C.ar 91 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1471 CD2 C.ar 91 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1472 CE1 C.ar 91 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1473 CE2 C.ar 91 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1474 CZ C.ar 91 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1475 H H 91 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 1476 HA H 91 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 1477 HB2 H 91 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 1478 HB3 H 91 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 1479 HD1 H 91 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1480 HD2 H 91 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1481 HE1 H 91 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1482 HE2 H 91 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1483 HZ H 91 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1484 N N.2 92 THR mhp= 72 -0.5113 charge= -0.5985 ATOM 1485 CA C.3 92 THR mhp= 8 -0.6805 charge= 0.0965 ATOM 1486 C C.2 92 THR mhp= 40 -0.1002 charge= 0.3983 ATOM 1487 O O.2 92 THR mhp= 58 -0.0233 charge= -0.3241 ATOM 1488 CB C.3 92 THR mhp= 8 -0.6805 charge= -0.0700 ATOM 1489 OG1 O.3 92 THR mhp= 56 -0.3567 charge= -0.1490 ATOM 1490 CG2 C.3 92 THR mhp= 1 -1.5603 charge= -0.3000 ATOM 1491 H H 92 THR mhp= 50 -0.1036 charge= 0.3278 ATOM 1492 HA H 92 THR mhp= 51 0.5234 charge= 0.1000 ATOM 1493 HB H 92 THR mhp= 47 0.6301 charge= 0.1000 ATOM 1494 HG1 H 92 THR mhp= 50 -0.1036 charge= 0.1190 ATOM 1495 HG21 H 92 THR mhp= 52 0.6666 charge= 0.1000 ATOM 1496 HG22 H 92 THR mhp= 52 0.6666 charge= 0.1000 ATOM 1497 HG23 H 92 THR mhp= 52 0.6666 charge= 0.1000 ATOM 1498 N N.2 93 THR mhp= 72 -0.5113 charge= -0.5985 ATOM 1499 CA C.3 93 THR mhp= 8 -0.6805 charge= 0.0965 ATOM 1500 C C.2 93 THR mhp= 40 -0.1002 charge= 0.3983 ATOM 1501 O O.2 93 THR mhp= 58 -0.0233 charge= -0.3241 ATOM 1502 CB C.3 93 THR mhp= 8 -0.6805 charge= -0.0700 ATOM 1503 OG1 O.3 93 THR mhp= 56 -0.3567 charge= -0.1490 ATOM 1504 CG2 C.3 93 THR mhp= 1 -1.5603 charge= -0.3000 ATOM 1505 H H 93 THR mhp= 50 -0.1036 charge= 0.3278 ATOM 1506 HA H 93 THR mhp= 51 0.5234 charge= 0.1000 ATOM 1507 HB H 93 THR mhp= 47 0.6301 charge= 0.1000 ATOM 1508 HG21 H 93 THR mhp= 52 0.6666 charge= 0.1000 ATOM 1509 HG22 H 93 THR mhp= 52 0.6666 charge= 0.1000 ATOM 1510 HG23 H 93 THR mhp= 52 0.6666 charge= 0.1000 ATOM 1511 HG1 H 93 THR mhp= 50 -0.1036 charge= 0.1190 ATOM 1512 N N.2 94 THR mhp= 72 -0.5113 charge= -0.5985 ATOM 1513 CA C.3 94 THR mhp= 8 -0.6805 charge= 0.0965 ATOM 1514 C C.2 94 THR mhp= 40 -0.1002 charge= 0.3983 ATOM 1515 O O.2 94 THR mhp= 58 -0.0233 charge= -0.3241 ATOM 1516 CB C.3 94 THR mhp= 8 -0.6805 charge= -0.0700 ATOM 1517 OG1 O.3 94 THR mhp= 56 -0.3567 charge= -0.1490 ATOM 1518 CG2 C.3 94 THR mhp= 1 -1.5603 charge= -0.3000 ATOM 1519 H H 94 THR mhp= 50 -0.1036 charge= 0.3278 ATOM 1520 HA H 94 THR mhp= 51 0.5234 charge= 0.1000 ATOM 1521 HB H 94 THR mhp= 47 0.6301 charge= 0.1000 ATOM 1522 HG1 H 94 THR mhp= 50 -0.1036 charge= 0.1190 ATOM 1523 HG21 H 94 THR mhp= 52 0.6666 charge= 0.1000 ATOM 1524 HG22 H 94 THR mhp= 52 0.6666 charge= 0.1000 ATOM 1525 HG23 H 94 THR mhp= 52 0.6666 charge= 0.1000 ATOM 1526 N N.2 95 LEU mhp= 72 -0.5113 charge= -0.5985 ATOM 1527 CA C.3 95 LEU mhp= 8 -0.6805 charge= 0.0965 ATOM 1528 C C.2 95 LEU mhp= 40 -0.1002 charge= 0.3983 ATOM 1529 O O.2 95 LEU mhp= 58 -0.0233 charge= -0.3241 ATOM 1530 CB C.3 95 LEU mhp= 2 -1.0120 charge= -0.2000 ATOM 1531 CG C.3 95 LEU mhp= 3 -0.6681 charge= -0.1000 ATOM 1532 CD1 C.3 95 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 1533 CD2 C.3 95 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 1534 H H 95 LEU mhp= 50 -0.1036 charge= 0.3278 ATOM 1535 HA H 95 LEU mhp= 51 0.5234 charge= 0.1000 ATOM 1536 HB2 H 95 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 1537 HB3 H 95 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 1538 HG H 95 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1539 HD11 H 95 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1540 HD12 H 95 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1541 HD13 H 95 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1542 HD21 H 95 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1543 HD22 H 95 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1544 HD23 H 95 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1545 N N.2 96 TYR mhp= 72 -0.5113 charge= -0.5985 ATOM 1546 CA C.3 96 TYR mhp= 8 -0.6805 charge= 0.0965 ATOM 1547 C C.2 96 TYR mhp= 40 -0.1002 charge= 0.3983 ATOM 1548 O O.2 96 TYR mhp= 58 -0.0233 charge= -0.3241 ATOM 1549 CB C.3 96 TYR mhp= 2 -1.0120 charge= -0.2000 ATOM 1550 CG C.ar 96 TYR mhp= 25 0.1492 charge= 0.0000 ATOM 1551 CD1 C.ar 96 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 1552 CD2 C.ar 96 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 1553 CE1 C.ar 96 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 1554 CE2 C.ar 96 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 1555 CZ C.ar 96 TYR mhp= 26 0.1539 charge= 0.0300 ATOM 1556 OH O.3 96 TYR mhp= 57 -0.0127 charge= -0.1490 ATOM 1557 H H 96 TYR mhp= 50 -0.1036 charge= 0.3278 ATOM 1558 HA H 96 TYR mhp= 51 0.5234 charge= 0.1000 ATOM 1559 HB2 H 96 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 1560 HB3 H 96 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 1561 HD1 H 96 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 1562 HD2 H 96 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 1563 HE1 H 96 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 1564 HE2 H 96 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 1565 HH H 96 TYR mhp= 50 -0.1036 charge= 0.1190 ATOM 1566 N N.2 97 THR mhp= 72 -0.5113 charge= -0.5985 ATOM 1567 CA C.3 97 THR mhp= 8 -0.6805 charge= 0.0965 ATOM 1568 C C.2 97 THR mhp= 40 -0.1002 charge= 0.3983 ATOM 1569 O O.2 97 THR mhp= 58 -0.0233 charge= -0.3241 ATOM 1570 CB C.3 97 THR mhp= 8 -0.6805 charge= -0.0700 ATOM 1571 OG1 O.3 97 THR mhp= 56 -0.3567 charge= -0.1490 ATOM 1572 CG2 C.3 97 THR mhp= 1 -1.5603 charge= -0.3000 ATOM 1573 H H 97 THR mhp= 50 -0.1036 charge= 0.3278 ATOM 1574 HA H 97 THR mhp= 51 0.5234 charge= 0.1000 ATOM 1575 HB H 97 THR mhp= 47 0.6301 charge= 0.1000 ATOM 1576 HG1 H 97 THR mhp= 50 -0.1036 charge= 0.1190 ATOM 1577 HG21 H 97 THR mhp= 52 0.6666 charge= 0.1000 ATOM 1578 HG22 H 97 THR mhp= 52 0.6666 charge= 0.1000 ATOM 1579 HG23 H 97 THR mhp= 52 0.6666 charge= 0.1000 ATOM 1580 N N.2 98 SER mhp= 72 -0.5113 charge= -0.5985 ATOM 1581 CA C.3 98 SER mhp= 8 -0.6805 charge= 0.0965 ATOM 1582 C C.2 98 SER mhp= 40 -0.1002 charge= 0.3983 ATOM 1583 O O.2 98 SER mhp= 58 -0.0233 charge= -0.3241 ATOM 1584 CB C.3 98 SER mhp= 6 -1.2486 charge= -0.1700 ATOM 1585 OG O.3 98 SER mhp= 56 -0.3567 charge= -0.1490 ATOM 1586 H H 98 SER mhp= 50 -0.1036 charge= 0.3278 ATOM 1587 HA H 98 SER mhp= 51 0.5234 charge= 0.1000 ATOM 1588 HB2 H 98 SER mhp= 47 0.6301 charge= 0.1000 ATOM 1589 HB3 H 98 SER mhp= 47 0.6301 charge= 0.1000 ATOM 1590 HG H 98 SER mhp= 50 -0.1036 charge= 0.1190 ATOM 1591 N N.2 99 LEU mhp= 72 -0.5113 charge= -0.5985 ATOM 1592 CA C.3 99 LEU mhp= 8 -0.6805 charge= 0.0965 ATOM 1593 C C.2 99 LEU mhp= 40 -0.1002 charge= 0.3983 ATOM 1594 O O.2 99 LEU mhp= 58 -0.0233 charge= -0.3241 ATOM 1595 CB C.3 99 LEU mhp= 2 -1.0120 charge= -0.2000 ATOM 1596 CG C.3 99 LEU mhp= 3 -0.6681 charge= -0.1000 ATOM 1597 CD1 C.3 99 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 1598 CD2 C.3 99 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 1599 H H 99 LEU mhp= 50 -0.1036 charge= 0.3278 ATOM 1600 HA H 99 LEU mhp= 51 0.5234 charge= 0.1000 ATOM 1601 HB2 H 99 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 1602 HB3 H 99 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 1603 HG H 99 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1604 HD11 H 99 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1605 HD12 H 99 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1606 HD13 H 99 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1607 HD21 H 99 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1608 HD22 H 99 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1609 HD23 H 99 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1610 N N.2 100 HIS mhp= 72 -0.5113 charge= -0.5985 ATOM 1611 CA C.3 100 HIS mhp= 8 -0.6805 charge= 0.0965 ATOM 1612 C C.2 100 HIS mhp= 40 -0.1002 charge= 0.3983 ATOM 1613 O O.2 100 HIS mhp= 58 -0.0233 charge= -0.3241 ATOM 1614 CB C.3 100 HIS mhp= 2 -1.0120 charge= -0.2000 ATOM 1615 CG C.ar 100 HIS mhp= 34 0.2813 charge= 0.1993 ATOM 1616 ND1 N.ar 100 HIS mhp= 73 0.1259 charge= -0.7264 ATOM 1617 CD2 C.ar 100 HIS mhp= 27 0.0005 charge= 0.0693 ATOM 1618 CE1 C.ar 100 HIS mhp= 42 -0.2147 charge= 0.2686 ATOM 1619 NE2 N.ar 100 HIS mhp= 75 -0.1624 charge= -0.3986 ATOM 1620 H H 100 HIS mhp= 50 -0.1036 charge= 0.3278 ATOM 1621 HA H 100 HIS mhp= 51 0.5234 charge= 0.1000 ATOM 1622 HB2 H 100 HIS mhp= 51 0.5234 charge= 0.1000 ATOM 1623 HB3 H 100 HIS mhp= 51 0.5234 charge= 0.1000 ATOM 1624 HD2 H 100 HIS mhp= 49 -0.0371 charge= 0.1300 ATOM 1625 HE1 H 100 HIS mhp= 49 -0.0371 charge= 0.1300 ATOM 1626 HD1 H 100 HIS mhp= 50 -0.1036 charge= 0.3278 ATOM 1627 N N.2 101 GLY mhp= 72 -0.5113 charge= -0.5985 ATOM 1628 CA C.3 101 GLY mhp= 6 -1.2486 charge= -0.0035 ATOM 1629 C C.2 101 GLY mhp= 40 -0.1002 charge= 0.3983 ATOM 1630 O O.2 101 GLY mhp= 58 -0.0233 charge= -0.3241 ATOM 1631 H H 101 GLY mhp= 50 -0.1036 charge= 0.3278 ATOM 1632 HA2 H 101 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 1633 HA3 H 101 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 1634 N N.2 102 TYR mhp= 72 -0.5113 charge= -0.5985 ATOM 1635 CA C.3 102 TYR mhp= 8 -0.6805 charge= 0.0965 ATOM 1636 C C.2 102 TYR mhp= 40 -0.1002 charge= 0.3983 ATOM 1637 O O.2 102 TYR mhp= 58 -0.0233 charge= -0.3241 ATOM 1638 CB C.3 102 TYR mhp= 2 -1.0120 charge= -0.2000 ATOM 1639 CG C.ar 102 TYR mhp= 25 0.1492 charge= 0.0000 ATOM 1640 CD1 C.ar 102 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 1641 CD2 C.ar 102 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 1642 CE1 C.ar 102 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 1643 CE2 C.ar 102 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 1644 CZ C.ar 102 TYR mhp= 26 0.1539 charge= 0.0300 ATOM 1645 OH O.3 102 TYR mhp= 57 -0.0127 charge= -0.1490 ATOM 1646 H H 102 TYR mhp= 50 -0.1036 charge= 0.3278 ATOM 1647 HA H 102 TYR mhp= 51 0.5234 charge= 0.1000 ATOM 1648 HB2 H 102 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 1649 HB3 H 102 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 1650 HD1 H 102 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 1651 HD2 H 102 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 1652 HE1 H 102 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 1653 HE2 H 102 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 1654 HH H 102 TYR mhp= 50 -0.1036 charge= 0.1190 ATOM 1655 N N.2 103 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 1656 CA C.3 103 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 1657 C C.2 103 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 1658 O O.2 103 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 1659 CB C.3 103 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 1660 CG C.ar 103 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 1661 CD1 C.ar 103 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1662 CD2 C.ar 103 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1663 CE1 C.ar 103 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1664 CE2 C.ar 103 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1665 CZ C.ar 103 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1666 H H 103 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 1667 HA H 103 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 1668 HB2 H 103 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 1669 HB3 H 103 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 1670 HD1 H 103 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1671 HD2 H 103 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1672 HE1 H 103 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1673 HE2 H 103 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1674 HZ H 103 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1675 N N.2 104 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 1676 CA C.3 104 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 1677 C C.2 104 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 1678 O O.2 104 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 1679 CB C.3 104 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 1680 CG1 C.3 104 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 1681 CG2 C.3 104 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 1682 H H 104 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 1683 HA H 104 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 1684 HB H 104 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 1685 HG21 H 104 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 1686 HG22 H 104 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 1687 HG23 H 104 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 1688 HG11 H 104 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 1689 HG12 H 104 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 1690 HG13 H 104 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 1691 N N.2 105 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 1692 CA C.3 105 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 1693 C C.2 105 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 1694 O O.2 105 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 1695 CB C.3 105 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 1696 CG C.ar 105 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 1697 CD1 C.ar 105 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1698 CD2 C.ar 105 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1699 CE1 C.ar 105 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1700 CE2 C.ar 105 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1701 CZ C.ar 105 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1702 H H 105 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 1703 HA H 105 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 1704 HB2 H 105 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 1705 HB3 H 105 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 1706 HD1 H 105 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1707 HD2 H 105 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1708 HE1 H 105 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1709 HE2 H 105 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1710 HZ H 105 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1711 N N.2 106 GLY mhp= 72 -0.5113 charge= -0.5985 ATOM 1712 CA C.3 106 GLY mhp= 6 -1.2486 charge= -0.0035 ATOM 1713 C C.2 106 GLY mhp= 40 -0.1002 charge= 0.3983 ATOM 1714 O O.2 106 GLY mhp= 58 -0.0233 charge= -0.3241 ATOM 1715 H H 106 GLY mhp= 50 -0.1036 charge= 0.3278 ATOM 1716 HA2 H 106 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 1717 HA3 H 106 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 1718 N N.2 107 PRO mhp= 72 -0.5113 charge= -0.6007 ATOM 1719 CA C.3 107 PRO mhp= 8 -0.6805 charge= 0.2065 ATOM 1720 C C.2 107 PRO mhp= 40 -0.1002 charge= 0.3983 ATOM 1721 O O.2 107 PRO mhp= 58 -0.0233 charge= -0.3241 ATOM 1722 CB C.3 107 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 1723 CG C.3 107 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 1724 CD C.3 107 PRO mhp= 6 -1.2486 charge= 0.0200 ATOM 1725 HA H 107 PRO mhp= 51 0.5234 charge= 0.1000 ATOM 1726 HB2 H 107 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 1727 HB3 H 107 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 1728 HG2 H 107 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 1729 HG3 H 107 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 1730 HD2 H 107 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 1731 HD3 H 107 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 1732 N N.2 108 THR mhp= 72 -0.5113 charge= -0.5985 ATOM 1733 CA C.3 108 THR mhp= 8 -0.6805 charge= 0.0965 ATOM 1734 C C.2 108 THR mhp= 40 -0.1002 charge= 0.3983 ATOM 1735 O O.2 108 THR mhp= 58 -0.0233 charge= -0.3241 ATOM 1736 CB C.3 108 THR mhp= 8 -0.6805 charge= -0.0700 ATOM 1737 OG1 O.3 108 THR mhp= 56 -0.3567 charge= -0.1490 ATOM 1738 CG2 C.3 108 THR mhp= 1 -1.5603 charge= -0.3000 ATOM 1739 H H 108 THR mhp= 50 -0.1036 charge= 0.3278 ATOM 1740 HA H 108 THR mhp= 51 0.5234 charge= 0.1000 ATOM 1741 HB H 108 THR mhp= 47 0.6301 charge= 0.1000 ATOM 1742 HG1 H 108 THR mhp= 50 -0.1036 charge= 0.1190 ATOM 1743 HG21 H 108 THR mhp= 52 0.6666 charge= 0.1000 ATOM 1744 HG22 H 108 THR mhp= 52 0.6666 charge= 0.1000 ATOM 1745 HG23 H 108 THR mhp= 52 0.6666 charge= 0.1000 ATOM 1746 N N.2 109 GLY mhp= 72 -0.5113 charge= -0.5985 ATOM 1747 CA C.3 109 GLY mhp= 6 -1.2486 charge= -0.0035 ATOM 1748 C C.2 109 GLY mhp= 40 -0.1002 charge= 0.3983 ATOM 1749 O O.2 109 GLY mhp= 58 -0.0233 charge= -0.3241 ATOM 1750 H H 109 GLY mhp= 50 -0.1036 charge= 0.3278 ATOM 1751 HA2 H 109 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 1752 HA3 H 109 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 1753 N N.2 110 CYS mhp= 72 -0.5113 charge= -0.5985 ATOM 1754 CA C.3 110 CYS mhp= 8 -0.6805 charge= 0.0965 ATOM 1755 C C.2 110 CYS mhp= 40 -0.1002 charge= 0.3983 ATOM 1756 O O.2 110 CYS mhp= 58 -0.0233 charge= -0.3241 ATOM 1757 CB C.3 110 CYS mhp= 6 -1.2486 charge= -0.3000 ATOM 1758 SG S.3 110 CYS mhp= 107 0.5906 charge= 0.0500 ATOM 1759 H H 110 CYS mhp= 50 -0.1036 charge= 0.3278 ATOM 1760 HA H 110 CYS mhp= 51 0.5234 charge= 0.1000 ATOM 1761 HB2 H 110 CYS mhp= 47 0.6301 charge= 0.1000 ATOM 1762 HB3 H 110 CYS mhp= 47 0.6301 charge= 0.1000 ATOM 1763 N N.2 111 ASN mhp= 72 -0.5113 charge= -0.5985 ATOM 1764 CA C.3 111 ASN mhp= 8 -0.6805 charge= 0.0965 ATOM 1765 C C.2 111 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 1766 O O.2 111 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 1767 CB C.3 111 ASN mhp= 2 -1.0120 charge= -0.1135 ATOM 1768 CG C.2 111 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 1769 OD1 O.2 111 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 1770 ND2 N.2 111 ASN mhp= 72 -0.5113 charge= -0.8163 ATOM 1771 H H 111 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 1772 HA H 111 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 1773 HB2 H 111 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 1774 HB3 H 111 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 1775 HD21 H 111 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 1776 HD22 H 111 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 1777 N N.2 112 LEU mhp= 72 -0.5113 charge= -0.5985 ATOM 1778 CA C.3 112 LEU mhp= 8 -0.6805 charge= 0.0965 ATOM 1779 C C.2 112 LEU mhp= 40 -0.1002 charge= 0.3983 ATOM 1780 O O.2 112 LEU mhp= 58 -0.0233 charge= -0.3241 ATOM 1781 CB C.3 112 LEU mhp= 2 -1.0120 charge= -0.2000 ATOM 1782 CG C.3 112 LEU mhp= 3 -0.6681 charge= -0.1000 ATOM 1783 CD1 C.3 112 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 1784 CD2 C.3 112 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 1785 H H 112 LEU mhp= 50 -0.1036 charge= 0.3278 ATOM 1786 HA H 112 LEU mhp= 51 0.5234 charge= 0.1000 ATOM 1787 HB2 H 112 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 1788 HB3 H 112 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 1789 HG H 112 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1790 HD11 H 112 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1791 HD12 H 112 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1792 HD13 H 112 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1793 HD21 H 112 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1794 HD22 H 112 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1795 HD23 H 112 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1796 N N.2 113 GLU mhp= 72 -0.5113 charge= -0.5985 ATOM 1797 CA C.3 113 GLU mhp= 8 -0.6805 charge= 0.0965 ATOM 1798 C C.2 113 GLU mhp= 40 -0.1002 charge= 0.3983 ATOM 1799 O O.2 113 GLU mhp= 58 -0.0233 charge= -0.3241 ATOM 1800 CB C.3 113 GLU mhp= 2 -1.0120 charge= -0.2000 ATOM 1801 CG C.3 113 GLU mhp= 2 -1.0120 charge= -0.1135 ATOM 1802 CD C.2 113 GLU mhp= 31 0.0901 charge= 0.0535 ATOM 1803 OE1 O.co2 113 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 1804 OE2 O.co2 113 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 1805 H H 113 GLU mhp= 50 -0.1036 charge= 0.3278 ATOM 1806 HA H 113 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 1807 HB2 H 113 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 1808 HB3 H 113 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 1809 HG2 H 113 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 1810 HG3 H 113 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 1811 N N.2 114 GLY mhp= 72 -0.5113 charge= -0.5985 ATOM 1812 CA C.3 114 GLY mhp= 6 -1.2486 charge= -0.0035 ATOM 1813 C C.2 114 GLY mhp= 40 -0.1002 charge= 0.3983 ATOM 1814 O O.2 114 GLY mhp= 58 -0.0233 charge= -0.3241 ATOM 1815 H H 114 GLY mhp= 50 -0.1036 charge= 0.3278 ATOM 1816 HA2 H 114 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 1817 HA3 H 114 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 1818 N N.2 115 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 1819 CA C.3 115 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 1820 C C.2 115 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 1821 O O.2 115 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 1822 CB C.3 115 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 1823 CG C.ar 115 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 1824 CD1 C.ar 115 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1825 CD2 C.ar 115 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1826 CE1 C.ar 115 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1827 CE2 C.ar 115 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1828 CZ C.ar 115 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1829 H H 115 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 1830 HA H 115 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 1831 HB2 H 115 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 1832 HB3 H 115 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 1833 HD1 H 115 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1834 HD2 H 115 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1835 HE1 H 115 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1836 HE2 H 115 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1837 HZ H 115 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1838 N N.2 116 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 1839 CA C.3 116 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 1840 C C.2 116 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 1841 O O.2 116 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 1842 CB C.3 116 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 1843 CG C.ar 116 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 1844 CD1 C.ar 116 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1845 CD2 C.ar 116 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1846 CE1 C.ar 116 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1847 CE2 C.ar 116 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1848 CZ C.ar 116 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 1849 H H 116 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 1850 HA H 116 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 1851 HB2 H 116 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 1852 HB3 H 116 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 1853 HD1 H 116 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1854 HD2 H 116 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1855 HE1 H 116 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1856 HE2 H 116 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1857 HZ H 116 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 1858 N N.2 117 ALA mhp= 72 -0.5113 charge= -0.5985 ATOM 1859 CA C.3 117 ALA mhp= 8 -0.6805 charge= 0.0965 ATOM 1860 C C.2 117 ALA mhp= 40 -0.1002 charge= 0.3983 ATOM 1861 O O.2 117 ALA mhp= 58 -0.0233 charge= -0.3241 ATOM 1862 CB C.3 117 ALA mhp= 1 -1.5603 charge= -0.3000 ATOM 1863 H H 117 ALA mhp= 50 -0.1036 charge= 0.3278 ATOM 1864 HA H 117 ALA mhp= 51 0.5234 charge= 0.1000 ATOM 1865 HB1 H 117 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 1866 HB2 H 117 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 1867 HB3 H 117 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 1868 N N.2 118 THR mhp= 72 -0.5113 charge= -0.5985 ATOM 1869 CA C.3 118 THR mhp= 8 -0.6805 charge= 0.0965 ATOM 1870 C C.2 118 THR mhp= 40 -0.1002 charge= 0.3983 ATOM 1871 O O.2 118 THR mhp= 58 -0.0233 charge= -0.3241 ATOM 1872 CB C.3 118 THR mhp= 8 -0.6805 charge= -0.0700 ATOM 1873 OG1 O.3 118 THR mhp= 56 -0.3567 charge= -0.1490 ATOM 1874 CG2 C.3 118 THR mhp= 1 -1.5603 charge= -0.3000 ATOM 1875 H H 118 THR mhp= 50 -0.1036 charge= 0.3278 ATOM 1876 HA H 118 THR mhp= 51 0.5234 charge= 0.1000 ATOM 1877 HB H 118 THR mhp= 47 0.6301 charge= 0.1000 ATOM 1878 HG1 H 118 THR mhp= 50 -0.1036 charge= 0.1190 ATOM 1879 HG21 H 118 THR mhp= 52 0.6666 charge= 0.1000 ATOM 1880 HG22 H 118 THR mhp= 52 0.6666 charge= 0.1000 ATOM 1881 HG23 H 118 THR mhp= 52 0.6666 charge= 0.1000 ATOM 1882 N N.2 119 LEU mhp= 72 -0.5113 charge= -0.5985 ATOM 1883 CA C.3 119 LEU mhp= 8 -0.6805 charge= 0.0965 ATOM 1884 C C.2 119 LEU mhp= 40 -0.1002 charge= 0.3983 ATOM 1885 O O.2 119 LEU mhp= 58 -0.0233 charge= -0.3241 ATOM 1886 CB C.3 119 LEU mhp= 2 -1.0120 charge= -0.2000 ATOM 1887 CG C.3 119 LEU mhp= 3 -0.6681 charge= -0.1000 ATOM 1888 CD1 C.3 119 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 1889 CD2 C.3 119 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 1890 H H 119 LEU mhp= 50 -0.1036 charge= 0.3278 ATOM 1891 HA H 119 LEU mhp= 51 0.5234 charge= 0.1000 ATOM 1892 HB2 H 119 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 1893 HB3 H 119 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 1894 HG H 119 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1895 HD11 H 119 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1896 HD12 H 119 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1897 HD13 H 119 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1898 HD21 H 119 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1899 HD22 H 119 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1900 HD23 H 119 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1901 N N.2 120 GLY mhp= 72 -0.5113 charge= -0.5985 ATOM 1902 CA C.3 120 GLY mhp= 6 -1.2486 charge= -0.0035 ATOM 1903 C C.2 120 GLY mhp= 40 -0.1002 charge= 0.3983 ATOM 1904 O O.2 120 GLY mhp= 58 -0.0233 charge= -0.3241 ATOM 1905 H H 120 GLY mhp= 50 -0.1036 charge= 0.3278 ATOM 1906 HA2 H 120 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 1907 HA3 H 120 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 1908 N N.2 121 GLY mhp= 72 -0.5113 charge= -0.5985 ATOM 1909 CA C.3 121 GLY mhp= 6 -1.2486 charge= -0.0035 ATOM 1910 C C.2 121 GLY mhp= 40 -0.1002 charge= 0.3983 ATOM 1911 O O.2 121 GLY mhp= 58 -0.0233 charge= -0.3241 ATOM 1912 H H 121 GLY mhp= 50 -0.1036 charge= 0.3278 ATOM 1913 HA2 H 121 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 1914 HA3 H 121 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 1915 N N.2 122 GLU mhp= 72 -0.5113 charge= -0.5985 ATOM 1916 CA C.3 122 GLU mhp= 8 -0.6805 charge= 0.0965 ATOM 1917 C C.2 122 GLU mhp= 40 -0.1002 charge= 0.3983 ATOM 1918 O O.2 122 GLU mhp= 58 -0.0233 charge= -0.3241 ATOM 1919 CB C.3 122 GLU mhp= 2 -1.0120 charge= -0.2000 ATOM 1920 CG C.3 122 GLU mhp= 2 -1.0120 charge= -0.1135 ATOM 1921 CD C.2 122 GLU mhp= 31 0.0901 charge= 0.0535 ATOM 1922 OE1 O.co2 122 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 1923 OE2 O.co2 122 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 1924 H H 122 GLU mhp= 50 -0.1036 charge= 0.3278 ATOM 1925 HA H 122 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 1926 HB2 H 122 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 1927 HB3 H 122 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 1928 HG2 H 122 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 1929 HG3 H 122 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 1930 N N.2 123 ILE mhp= 72 -0.5113 charge= -0.5985 ATOM 1931 CA C.3 123 ILE mhp= 8 -0.6805 charge= 0.0965 ATOM 1932 C C.2 123 ILE mhp= 40 -0.1002 charge= 0.3983 ATOM 1933 O O.2 123 ILE mhp= 58 -0.0233 charge= -0.3241 ATOM 1934 CB C.3 123 ILE mhp= 3 -0.6681 charge= -0.1000 ATOM 1935 CG1 C.3 123 ILE mhp= 2 -1.0120 charge= -0.2000 ATOM 1936 CG2 C.3 123 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 1937 CD1 C.3 123 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 1938 H H 123 ILE mhp= 50 -0.1036 charge= 0.3278 ATOM 1939 HA H 123 ILE mhp= 51 0.5234 charge= 0.1000 ATOM 1940 HB H 123 ILE mhp= 52 0.6666 charge= 0.1000 ATOM 1941 HG12 H 123 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 1942 HG13 H 123 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 1943 HG21 H 123 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 1944 HG22 H 123 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 1945 HG23 H 123 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 1946 HD11 H 123 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 1947 HD12 H 123 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 1948 HD13 H 123 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 1949 N N.2 124 ALA mhp= 72 -0.5113 charge= -0.5985 ATOM 1950 CA C.3 124 ALA mhp= 8 -0.6805 charge= 0.0965 ATOM 1951 C C.2 124 ALA mhp= 40 -0.1002 charge= 0.3983 ATOM 1952 O O.2 124 ALA mhp= 58 -0.0233 charge= -0.3241 ATOM 1953 CB C.3 124 ALA mhp= 1 -1.5603 charge= -0.3000 ATOM 1954 H H 124 ALA mhp= 50 -0.1036 charge= 0.3278 ATOM 1955 HA H 124 ALA mhp= 51 0.5234 charge= 0.1000 ATOM 1956 HB1 H 124 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 1957 HB2 H 124 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 1958 HB3 H 124 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 1959 N N.2 125 LEU mhp= 72 -0.5113 charge= -0.5985 ATOM 1960 CA C.3 125 LEU mhp= 8 -0.6805 charge= 0.0965 ATOM 1961 C C.2 125 LEU mhp= 40 -0.1002 charge= 0.3983 ATOM 1962 O O.2 125 LEU mhp= 58 -0.0233 charge= -0.3241 ATOM 1963 CB C.3 125 LEU mhp= 2 -1.0120 charge= -0.2000 ATOM 1964 CG C.3 125 LEU mhp= 3 -0.6681 charge= -0.1000 ATOM 1965 CD1 C.3 125 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 1966 CD2 C.3 125 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 1967 H H 125 LEU mhp= 50 -0.1036 charge= 0.3278 ATOM 1968 HA H 125 LEU mhp= 51 0.5234 charge= 0.1000 ATOM 1969 HB2 H 125 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 1970 HB3 H 125 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 1971 HG H 125 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1972 HD11 H 125 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1973 HD12 H 125 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1974 HD13 H 125 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1975 HD21 H 125 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1976 HD22 H 125 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1977 HD23 H 125 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 1978 N N.2 126 TRP mhp= 72 -0.5113 charge= -0.5985 ATOM 1979 CA C.3 126 TRP mhp= 8 -0.6805 charge= 0.0965 ATOM 1980 C C.2 126 TRP mhp= 40 -0.1002 charge= 0.3983 ATOM 1981 O O.2 126 TRP mhp= 58 -0.0233 charge= -0.3241 ATOM 1982 CB C.3 126 TRP mhp= 2 -1.0120 charge= -0.2000 ATOM 1983 CG C.ar 126 TRP mhp= 25 0.1492 charge= 0.0000 ATOM 1984 CD1 C.ar 126 TRP mhp= 27 0.0005 charge= 0.0100 ATOM 1985 CD2 C.ar 126 TRP mhp= 25 0.1492 charge= 0.0000 ATOM 1986 NE1 N.ar 126 TRP mhp= 75 -0.1624 charge= -1.2500 ATOM 1987 CE2 C.ar 126 TRP mhp= 28 0.2361 charge= 0.1100 ATOM 1988 CE3 C.ar 126 TRP mhp= 24 -0.3251 charge= -0.1000 ATOM 1989 CZ2 C.ar 126 TRP mhp= 24 -0.3251 charge= -0.1000 ATOM 1990 CZ3 C.ar 126 TRP mhp= 24 -0.3251 charge= -0.1000 ATOM 1991 CH2 C.ar 126 TRP mhp= 24 -0.3251 charge= -0.1000 ATOM 1992 H H 126 TRP mhp= 50 -0.1036 charge= 0.3278 ATOM 1993 HA H 126 TRP mhp= 51 0.5234 charge= 0.1000 ATOM 1994 HB2 H 126 TRP mhp= 52 0.6666 charge= 0.1000 ATOM 1995 HB3 H 126 TRP mhp= 52 0.6666 charge= 0.1000 ATOM 1996 HD1 H 126 TRP mhp= 49 -0.0371 charge= 0.1300 ATOM 1997 HE3 H 126 TRP mhp= 47 0.6301 charge= 0.1000 ATOM 1998 HZ2 H 126 TRP mhp= 47 0.6301 charge= 0.1000 ATOM 1999 HZ3 H 126 TRP mhp= 47 0.6301 charge= 0.1000 ATOM 2000 HH2 H 126 TRP mhp= 47 0.6301 charge= 0.1000 ATOM 2001 N N.2 127 SER mhp= 72 -0.5113 charge= -0.5985 ATOM 2002 CA C.3 127 SER mhp= 8 -0.6805 charge= 0.0965 ATOM 2003 C C.2 127 SER mhp= 40 -0.1002 charge= 0.3983 ATOM 2004 O O.2 127 SER mhp= 58 -0.0233 charge= -0.3241 ATOM 2005 CB C.3 127 SER mhp= 6 -1.2486 charge= -0.1700 ATOM 2006 OG O.3 127 SER mhp= 56 -0.3567 charge= -0.1490 ATOM 2007 H H 127 SER mhp= 50 -0.1036 charge= 0.3278 ATOM 2008 HA H 127 SER mhp= 51 0.5234 charge= 0.1000 ATOM 2009 HB2 H 127 SER mhp= 47 0.6301 charge= 0.1000 ATOM 2010 HB3 H 127 SER mhp= 47 0.6301 charge= 0.1000 ATOM 2011 HG H 127 SER mhp= 50 -0.1036 charge= 0.1190 ATOM 2012 N N.2 128 LEU mhp= 72 -0.5113 charge= -0.5985 ATOM 2013 CA C.3 128 LEU mhp= 8 -0.6805 charge= 0.0965 ATOM 2014 C C.2 128 LEU mhp= 40 -0.1002 charge= 0.3983 ATOM 2015 O O.2 128 LEU mhp= 58 -0.0233 charge= -0.3241 ATOM 2016 CB C.3 128 LEU mhp= 2 -1.0120 charge= -0.2000 ATOM 2017 CG C.3 128 LEU mhp= 3 -0.6681 charge= -0.1000 ATOM 2018 CD1 C.3 128 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 2019 CD2 C.3 128 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 2020 H H 128 LEU mhp= 50 -0.1036 charge= 0.3278 ATOM 2021 HA H 128 LEU mhp= 51 0.5234 charge= 0.1000 ATOM 2022 HB2 H 128 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 2023 HB3 H 128 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 2024 HG H 128 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 2025 HD21 H 128 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 2026 HD22 H 128 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 2027 HD23 H 128 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 2028 HD11 H 128 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 2029 HD12 H 128 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 2030 HD13 H 128 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 2031 N N.2 129 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 2032 CA C.3 129 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 2033 C C.2 129 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 2034 O O.2 129 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 2035 CB C.3 129 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 2036 CG1 C.3 129 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 2037 CG2 C.3 129 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 2038 H H 129 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 2039 HA H 129 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 2040 HB H 129 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 2041 HG11 H 129 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2042 HG12 H 129 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2043 HG13 H 129 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2044 HG21 H 129 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2045 HG22 H 129 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2046 HG23 H 129 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2047 N N.2 130 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 2048 CA C.3 130 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 2049 C C.2 130 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 2050 O O.2 130 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 2051 CB C.3 130 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 2052 CG1 C.3 130 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 2053 CG2 C.3 130 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 2054 H H 130 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 2055 HA H 130 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 2056 HB H 130 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 2057 HG21 H 130 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2058 HG22 H 130 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2059 HG23 H 130 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2060 HG11 H 130 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2061 HG12 H 130 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2062 HG13 H 130 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2063 N N.2 131 LEU mhp= 72 -0.5113 charge= -0.5985 ATOM 2064 CA C.3 131 LEU mhp= 8 -0.6805 charge= 0.0965 ATOM 2065 C C.2 131 LEU mhp= 40 -0.1002 charge= 0.3983 ATOM 2066 O O.2 131 LEU mhp= 58 -0.0233 charge= -0.3241 ATOM 2067 CB C.3 131 LEU mhp= 2 -1.0120 charge= -0.2000 ATOM 2068 CG C.3 131 LEU mhp= 3 -0.6681 charge= -0.1000 ATOM 2069 CD1 C.3 131 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 2070 CD2 C.3 131 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 2071 H H 131 LEU mhp= 50 -0.1036 charge= 0.3278 ATOM 2072 HA H 131 LEU mhp= 51 0.5234 charge= 0.1000 ATOM 2073 HB2 H 131 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 2074 HB3 H 131 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 2075 HG H 131 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 2076 HD21 H 131 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 2077 HD22 H 131 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 2078 HD23 H 131 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 2079 HD11 H 131 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 2080 HD12 H 131 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 2081 HD13 H 131 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 2082 N N.2 132 ALA mhp= 72 -0.5113 charge= -0.5985 ATOM 2083 CA C.3 132 ALA mhp= 8 -0.6805 charge= 0.0965 ATOM 2084 C C.2 132 ALA mhp= 40 -0.1002 charge= 0.3983 ATOM 2085 O O.2 132 ALA mhp= 58 -0.0233 charge= -0.3241 ATOM 2086 CB C.3 132 ALA mhp= 1 -1.5603 charge= -0.3000 ATOM 2087 H H 132 ALA mhp= 50 -0.1036 charge= 0.3278 ATOM 2088 HA H 132 ALA mhp= 51 0.5234 charge= 0.1000 ATOM 2089 HB1 H 132 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 2090 HB2 H 132 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 2091 HB3 H 132 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 2092 N N.2 133 ILE mhp= 72 -0.5113 charge= -0.5985 ATOM 2093 CA C.3 133 ILE mhp= 8 -0.6805 charge= 0.0965 ATOM 2094 C C.2 133 ILE mhp= 40 -0.1002 charge= 0.3983 ATOM 2095 O O.2 133 ILE mhp= 58 -0.0233 charge= -0.3241 ATOM 2096 CB C.3 133 ILE mhp= 3 -0.6681 charge= -0.1000 ATOM 2097 CG1 C.3 133 ILE mhp= 2 -1.0120 charge= -0.2000 ATOM 2098 CG2 C.3 133 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 2099 CD1 C.3 133 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 2100 H H 133 ILE mhp= 50 -0.1036 charge= 0.3278 ATOM 2101 HA H 133 ILE mhp= 51 0.5234 charge= 0.1000 ATOM 2102 HB H 133 ILE mhp= 52 0.6666 charge= 0.1000 ATOM 2103 HG12 H 133 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2104 HG13 H 133 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2105 HG21 H 133 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2106 HG22 H 133 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2107 HG23 H 133 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2108 HD11 H 133 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2109 HD12 H 133 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2110 HD13 H 133 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2111 N N.2 134 GLU mhp= 72 -0.5113 charge= -0.5985 ATOM 2112 CA C.3 134 GLU mhp= 8 -0.6805 charge= 0.0965 ATOM 2113 C C.2 134 GLU mhp= 40 -0.1002 charge= 0.3983 ATOM 2114 O O.2 134 GLU mhp= 58 -0.0233 charge= -0.3241 ATOM 2115 CB C.3 134 GLU mhp= 2 -1.0120 charge= -0.2000 ATOM 2116 CG C.3 134 GLU mhp= 2 -1.0120 charge= -0.1135 ATOM 2117 CD C.2 134 GLU mhp= 31 0.0901 charge= 0.0535 ATOM 2118 OE1 O.co2 134 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 2119 OE2 O.co2 134 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 2120 H H 134 GLU mhp= 50 -0.1036 charge= 0.3278 ATOM 2121 HA H 134 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 2122 HB2 H 134 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 2123 HB3 H 134 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 2124 HG2 H 134 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 2125 HG3 H 134 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 2126 N N.2 135 ARG mhp= 72 -0.5113 charge= -0.5985 ATOM 2127 CA C.3 135 ARG mhp= 8 -0.6805 charge= 0.0965 ATOM 2128 C C.2 135 ARG mhp= 40 -0.1002 charge= 0.3983 ATOM 2129 O O.2 135 ARG mhp= 58 -0.0233 charge= -0.3241 ATOM 2130 CB C.3 135 ARG mhp= 2 -1.0120 charge= -0.2000 ATOM 2131 CG C.3 135 ARG mhp= 2 -1.0120 charge= -0.2000 ATOM 2132 CD C.3 135 ARG mhp= 6 -1.2486 charge= -0.0900 ATOM 2133 NE N.2 135 ARG mhp= 79 -1.4439 charge= 0.0622 ATOM 2134 CZ C.cat 135 ARG mhp= 32 0.5142 charge= -0.5000 ATOM 2135 NH1 N.3 135 ARG mhp= 79 -1.4439 charge= -0.1556 ATOM 2136 NH2 N.3 135 ARG mhp= 79 -1.4439 charge= -0.1556 ATOM 2137 H H 135 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 2138 HA H 135 ARG mhp= 51 0.5234 charge= 0.1000 ATOM 2139 HB2 H 135 ARG mhp= 52 0.6666 charge= 0.1000 ATOM 2140 HB3 H 135 ARG mhp= 52 0.6666 charge= 0.1000 ATOM 2141 HG2 H 135 ARG mhp= 52 0.6666 charge= 0.1000 ATOM 2142 HG3 H 135 ARG mhp= 52 0.6666 charge= 0.1000 ATOM 2143 HD2 H 135 ARG mhp= 47 0.6301 charge= 0.1000 ATOM 2144 HD3 H 135 ARG mhp= 47 0.6301 charge= 0.1000 ATOM 2145 HE H 135 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 2146 HH11 H 135 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 2147 HH12 H 135 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 2148 HH21 H 135 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 2149 HH22 H 135 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 2150 N N.2 136 TYR mhp= 72 -0.5113 charge= -0.5985 ATOM 2151 CA C.3 136 TYR mhp= 8 -0.6805 charge= 0.0965 ATOM 2152 C C.2 136 TYR mhp= 40 -0.1002 charge= 0.3983 ATOM 2153 O O.2 136 TYR mhp= 58 -0.0233 charge= -0.3241 ATOM 2154 CB C.3 136 TYR mhp= 2 -1.0120 charge= -0.2000 ATOM 2155 CG C.ar 136 TYR mhp= 25 0.1492 charge= 0.0000 ATOM 2156 CD1 C.ar 136 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 2157 CD2 C.ar 136 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 2158 CE1 C.ar 136 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 2159 CE2 C.ar 136 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 2160 CZ C.ar 136 TYR mhp= 26 0.1539 charge= 0.0300 ATOM 2161 OH O.3 136 TYR mhp= 57 -0.0127 charge= -0.1490 ATOM 2162 H H 136 TYR mhp= 50 -0.1036 charge= 0.3278 ATOM 2163 HA H 136 TYR mhp= 51 0.5234 charge= 0.1000 ATOM 2164 HB2 H 136 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 2165 HB3 H 136 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 2166 HD1 H 136 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 2167 HD2 H 136 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 2168 HE1 H 136 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 2169 HE2 H 136 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 2170 HH H 136 TYR mhp= 50 -0.1036 charge= 0.1190 ATOM 2171 N N.2 137 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 2172 CA C.3 137 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 2173 C C.2 137 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 2174 O O.2 137 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 2175 CB C.3 137 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 2176 CG1 C.3 137 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 2177 CG2 C.3 137 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 2178 H H 137 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 2179 HA H 137 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 2180 HB H 137 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 2181 HG21 H 137 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2182 HG22 H 137 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2183 HG23 H 137 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2184 HG11 H 137 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2185 HG12 H 137 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2186 HG13 H 137 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2187 N N.2 138 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 2188 CA C.3 138 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 2189 C C.2 138 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 2190 O O.2 138 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 2191 CB C.3 138 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 2192 CG1 C.3 138 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 2193 CG2 C.3 138 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 2194 H H 138 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 2195 HA H 138 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 2196 HB H 138 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 2197 HG11 H 138 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2198 HG12 H 138 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2199 HG13 H 138 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2200 HG21 H 138 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2201 HG22 H 138 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2202 HG23 H 138 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2203 N N.2 139 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 2204 CA C.3 139 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 2205 C C.2 139 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 2206 O O.2 139 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 2207 CB C.3 139 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 2208 CG1 C.3 139 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 2209 CG2 C.3 139 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 2210 H H 139 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 2211 HA H 139 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 2212 HB H 139 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 2213 HG11 H 139 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2214 HG12 H 139 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2215 HG13 H 139 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2216 HG21 H 139 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2217 HG22 H 139 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2218 HG23 H 139 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2219 N N.2 140 CYS mhp= 72 -0.5113 charge= -0.5985 ATOM 2220 CA C.3 140 CYS mhp= 8 -0.6805 charge= 0.0965 ATOM 2221 C C.2 140 CYS mhp= 40 -0.1002 charge= 0.3983 ATOM 2222 O O.2 140 CYS mhp= 58 -0.0233 charge= -0.3241 ATOM 2223 CB C.3 140 CYS mhp= 6 -1.2486 charge= -0.3000 ATOM 2224 SG S.3 140 CYS mhp= 106 0.6146 charge= 0.0213 ATOM 2225 H H 140 CYS mhp= 50 -0.1036 charge= 0.3278 ATOM 2226 HA H 140 CYS mhp= 51 0.5234 charge= 0.1000 ATOM 2227 HB2 H 140 CYS mhp= 47 0.6301 charge= 0.1000 ATOM 2228 HB3 H 140 CYS mhp= 47 0.6301 charge= 0.1000 ATOM 2229 HG H 140 CYS mhp= 50 -0.1036 charge= 0.0787 ATOM 2230 N N.2 141 LYS mhp= 72 -0.5113 charge= -0.5985 ATOM 2231 CA C.3 141 LYS mhp= 8 -0.6805 charge= 0.0965 ATOM 2232 C C.2 141 LYS mhp= 40 -0.1002 charge= 0.3983 ATOM 2233 O O.2 141 LYS mhp= 58 -0.0233 charge= -0.3241 ATOM 2234 CB C.3 141 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 2235 CG C.3 141 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 2236 CD C.3 141 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 2237 CE C.3 141 LYS mhp= 6 -1.2486 charge= 0.2200 ATOM 2238 NZ N.4 141 LYS mhp= 79 -1.4439 charge= -0.5000 ATOM 2239 H H 141 LYS mhp= 50 -0.1036 charge= 0.3278 ATOM 2240 HA H 141 LYS mhp= 51 0.5234 charge= 0.1000 ATOM 2241 HB2 H 141 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 2242 HB3 H 141 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 2243 HG2 H 141 LYS mhp= 46 0.7341 charge= 0.1000 ATOM 2244 HG3 H 141 LYS mhp= 46 0.7341 charge= 0.1000 ATOM 2245 HD2 H 141 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 2246 HD3 H 141 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 2247 HE2 H 141 LYS mhp= 47 0.6301 charge= 0.1000 ATOM 2248 HE3 H 141 LYS mhp= 47 0.6301 charge= 0.1000 ATOM 2249 HZ1 H 141 LYS mhp= 50 -0.1036 charge= 0.3600 ATOM 2250 HZ2 H 141 LYS mhp= 50 -0.1036 charge= 0.3600 ATOM 2251 HZ3 H 141 LYS mhp= 50 -0.1036 charge= 0.3600 ATOM 2252 N N.2 142 PRO mhp= 72 -0.5113 charge= -0.6007 ATOM 2253 CA C.3 142 PRO mhp= 8 -0.6805 charge= 0.2065 ATOM 2254 C C.2 142 PRO mhp= 40 -0.1002 charge= 0.3983 ATOM 2255 O O.2 142 PRO mhp= 58 -0.0233 charge= -0.3241 ATOM 2256 CB C.3 142 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 2257 CG C.3 142 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 2258 CD C.3 142 PRO mhp= 6 -1.2486 charge= 0.0200 ATOM 2259 HA H 142 PRO mhp= 51 0.5234 charge= 0.1000 ATOM 2260 HB2 H 142 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 2261 HB3 H 142 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 2262 HG2 H 142 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 2263 HG3 H 142 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 2264 HD2 H 142 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 2265 HD3 H 142 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 2266 N N.2 143 MET mhp= 72 -0.5113 charge= -0.5985 ATOM 2267 CA C.3 143 MET mhp= 8 -0.6805 charge= 0.0965 ATOM 2268 C C.2 143 MET mhp= 40 -0.1002 charge= 0.3983 ATOM 2269 O O.2 143 MET mhp= 58 -0.0233 charge= -0.3241 ATOM 2270 CB C.3 143 MET mhp= 2 -1.0120 charge= -0.2000 ATOM 2271 CG C.3 143 MET mhp= 6 -1.2486 charge= -0.2500 ATOM 2272 SD S.3 143 MET mhp= 107 0.5906 charge= 0.1000 ATOM 2273 CE C.3 143 MET mhp= 5 -1.7880 charge= -0.3500 ATOM 2274 H H 143 MET mhp= 50 -0.1036 charge= 0.3278 ATOM 2275 HA H 143 MET mhp= 51 0.5234 charge= 0.1000 ATOM 2276 HB2 H 143 MET mhp= 53 0.5372 charge= 0.1000 ATOM 2277 HB3 H 143 MET mhp= 53 0.5372 charge= 0.1000 ATOM 2278 HG2 H 143 MET mhp= 47 0.6301 charge= 0.1000 ATOM 2279 HG3 H 143 MET mhp= 47 0.6301 charge= 0.1000 ATOM 2280 HE1 H 143 MET mhp= 47 0.6301 charge= 0.1000 ATOM 2281 HE2 H 143 MET mhp= 47 0.6301 charge= 0.1000 ATOM 2282 HE3 H 143 MET mhp= 47 0.6301 charge= 0.1000 ATOM 2283 N N.2 144 SER mhp= 72 -0.5113 charge= -0.5985 ATOM 2284 CA C.3 144 SER mhp= 8 -0.6805 charge= 0.0965 ATOM 2285 C C.2 144 SER mhp= 40 -0.1002 charge= 0.3983 ATOM 2286 O O.2 144 SER mhp= 58 -0.0233 charge= -0.3241 ATOM 2287 CB C.3 144 SER mhp= 6 -1.2486 charge= -0.1700 ATOM 2288 OG O.3 144 SER mhp= 56 -0.3567 charge= -0.1490 ATOM 2289 H H 144 SER mhp= 50 -0.1036 charge= 0.3278 ATOM 2290 HA H 144 SER mhp= 51 0.5234 charge= 0.1000 ATOM 2291 HB2 H 144 SER mhp= 47 0.6301 charge= 0.1000 ATOM 2292 HB3 H 144 SER mhp= 47 0.6301 charge= 0.1000 ATOM 2293 HG H 144 SER mhp= 50 -0.1036 charge= 0.1190 ATOM 2294 N N.2 145 ASN mhp= 72 -0.5113 charge= -0.5985 ATOM 2295 CA C.3 145 ASN mhp= 8 -0.6805 charge= 0.0965 ATOM 2296 C C.2 145 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 2297 O O.2 145 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 2298 CB C.3 145 ASN mhp= 2 -1.0120 charge= -0.1135 ATOM 2299 CG C.2 145 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 2300 OD1 O.2 145 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 2301 ND2 N.2 145 ASN mhp= 72 -0.5113 charge= -0.8163 ATOM 2302 H H 145 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 2303 HA H 145 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 2304 HB2 H 145 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 2305 HB3 H 145 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 2306 HD21 H 145 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 2307 HD22 H 145 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 2308 N N.2 146 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 2309 CA C.3 146 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 2310 C C.2 146 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 2311 O O.2 146 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 2312 CB C.3 146 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 2313 CG C.ar 146 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 2314 CD1 C.ar 146 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 2315 CD2 C.ar 146 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 2316 CE1 C.ar 146 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 2317 CE2 C.ar 146 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 2318 CZ C.ar 146 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 2319 H H 146 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 2320 HA H 146 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 2321 HB2 H 146 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 2322 HB3 H 146 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 2323 HD1 H 146 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 2324 HD2 H 146 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 2325 HE1 H 146 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 2326 HE2 H 146 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 2327 HZ H 146 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 2328 N N.2 147 ARG mhp= 72 -0.5113 charge= -0.5985 ATOM 2329 CA C.3 147 ARG mhp= 8 -0.6805 charge= 0.0965 ATOM 2330 C C.2 147 ARG mhp= 40 -0.1002 charge= 0.3983 ATOM 2331 O O.2 147 ARG mhp= 58 -0.0233 charge= -0.3241 ATOM 2332 CB C.3 147 ARG mhp= 2 -1.0120 charge= -0.2000 ATOM 2333 CG C.3 147 ARG mhp= 2 -1.0120 charge= -0.2000 ATOM 2334 CD C.3 147 ARG mhp= 6 -1.2486 charge= -0.0900 ATOM 2335 NE N.2 147 ARG mhp= 79 -1.4439 charge= 0.0622 ATOM 2336 CZ C.cat 147 ARG mhp= 32 0.5142 charge= -0.5000 ATOM 2337 NH1 N.3 147 ARG mhp= 79 -1.4439 charge= -0.1556 ATOM 2338 NH2 N.3 147 ARG mhp= 79 -1.4439 charge= -0.1556 ATOM 2339 H H 147 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 2340 HA H 147 ARG mhp= 51 0.5234 charge= 0.1000 ATOM 2341 HB2 H 147 ARG mhp= 52 0.6666 charge= 0.1000 ATOM 2342 HB3 H 147 ARG mhp= 52 0.6666 charge= 0.1000 ATOM 2343 HG2 H 147 ARG mhp= 52 0.6666 charge= 0.1000 ATOM 2344 HG3 H 147 ARG mhp= 52 0.6666 charge= 0.1000 ATOM 2345 HD2 H 147 ARG mhp= 47 0.6301 charge= 0.1000 ATOM 2346 HD3 H 147 ARG mhp= 47 0.6301 charge= 0.1000 ATOM 2347 HE H 147 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 2348 HH11 H 147 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 2349 HH12 H 147 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 2350 HH21 H 147 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 2351 HH22 H 147 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 2352 N N.2 148 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 2353 CA C.3 148 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 2354 C C.2 148 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 2355 O O.2 148 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 2356 CB C.3 148 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 2357 CG C.ar 148 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 2358 CD1 C.ar 148 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 2359 CD2 C.ar 148 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 2360 CE1 C.ar 148 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 2361 CE2 C.ar 148 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 2362 CZ C.ar 148 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 2363 H H 148 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 2364 HA H 148 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 2365 HB2 H 148 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 2366 HB3 H 148 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 2367 HD1 H 148 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 2368 HD2 H 148 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 2369 HE1 H 148 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 2370 HE2 H 148 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 2371 HZ H 148 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 2372 N N.2 149 GLY mhp= 72 -0.5113 charge= -0.5985 ATOM 2373 CA C.3 149 GLY mhp= 6 -1.2486 charge= -0.0035 ATOM 2374 C C.2 149 GLY mhp= 40 -0.1002 charge= 0.3983 ATOM 2375 O O.2 149 GLY mhp= 58 -0.0233 charge= -0.3241 ATOM 2376 H H 149 GLY mhp= 50 -0.1036 charge= 0.3278 ATOM 2377 HA2 H 149 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 2378 HA3 H 149 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 2379 N N.2 150 GLU mhp= 72 -0.5113 charge= -0.5985 ATOM 2380 CA C.3 150 GLU mhp= 8 -0.6805 charge= 0.0965 ATOM 2381 C C.2 150 GLU mhp= 40 -0.1002 charge= 0.3983 ATOM 2382 O O.2 150 GLU mhp= 58 -0.0233 charge= -0.3241 ATOM 2383 CB C.3 150 GLU mhp= 2 -1.0120 charge= -0.2000 ATOM 2384 CG C.3 150 GLU mhp= 2 -1.0120 charge= -0.1135 ATOM 2385 CD C.2 150 GLU mhp= 31 0.0901 charge= 0.0535 ATOM 2386 OE1 O.co2 150 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 2387 OE2 O.co2 150 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 2388 H H 150 GLU mhp= 50 -0.1036 charge= 0.3278 ATOM 2389 HA H 150 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 2390 HB2 H 150 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 2391 HB3 H 150 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 2392 HG2 H 150 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 2393 HG3 H 150 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 2394 N N.2 151 ASN mhp= 72 -0.5113 charge= -0.5985 ATOM 2395 CA C.3 151 ASN mhp= 8 -0.6805 charge= 0.0965 ATOM 2396 C C.2 151 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 2397 O O.2 151 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 2398 CB C.3 151 ASN mhp= 2 -1.0120 charge= -0.1135 ATOM 2399 CG C.2 151 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 2400 OD1 O.2 151 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 2401 ND2 N.2 151 ASN mhp= 72 -0.5113 charge= -0.8163 ATOM 2402 H H 151 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 2403 HA H 151 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 2404 HB2 H 151 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 2405 HB3 H 151 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 2406 HD21 H 151 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 2407 HD22 H 151 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 2408 N N.2 152 HIS mhp= 72 -0.5113 charge= -0.5985 ATOM 2409 CA C.3 152 HIS mhp= 8 -0.6805 charge= 0.0965 ATOM 2410 C C.2 152 HIS mhp= 40 -0.1002 charge= 0.3983 ATOM 2411 O O.2 152 HIS mhp= 58 -0.0233 charge= -0.3241 ATOM 2412 CB C.3 152 HIS mhp= 2 -1.0120 charge= -0.2000 ATOM 2413 CG C.ar 152 HIS mhp= 28 0.2361 charge= 0.1993 ATOM 2414 ND1 N.ar 152 HIS mhp= 75 -0.1624 charge= -0.3986 ATOM 2415 CD2 C.ar 152 HIS mhp= 33 -0.3723 charge= 0.0693 ATOM 2416 CE1 C.ar 152 HIS mhp= 42 -0.2147 charge= 0.2686 ATOM 2417 NE2 N.ar 152 HIS mhp= 73 0.1259 charge= -0.7264 ATOM 2418 H H 152 HIS mhp= 50 -0.1036 charge= 0.3278 ATOM 2419 HA H 152 HIS mhp= 51 0.5234 charge= 0.1000 ATOM 2420 HB2 H 152 HIS mhp= 51 0.5234 charge= 0.1000 ATOM 2421 HB3 H 152 HIS mhp= 51 0.5234 charge= 0.1000 ATOM 2422 HD2 H 152 HIS mhp= 48 0.5180 charge= 0.1300 ATOM 2423 HE1 H 152 HIS mhp= 49 -0.0371 charge= 0.1300 ATOM 2424 HE2 H 152 HIS mhp= 50 -0.1036 charge= 0.3278 ATOM 2425 N N.2 153 ALA mhp= 72 -0.5113 charge= -0.5985 ATOM 2426 CA C.3 153 ALA mhp= 8 -0.6805 charge= 0.0965 ATOM 2427 C C.2 153 ALA mhp= 40 -0.1002 charge= 0.3983 ATOM 2428 O O.2 153 ALA mhp= 58 -0.0233 charge= -0.3241 ATOM 2429 CB C.3 153 ALA mhp= 1 -1.5603 charge= -0.3000 ATOM 2430 H H 153 ALA mhp= 50 -0.1036 charge= 0.3278 ATOM 2431 HA H 153 ALA mhp= 51 0.5234 charge= 0.1000 ATOM 2432 HB1 H 153 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 2433 HB2 H 153 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 2434 HB3 H 153 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 2435 N N.2 154 ILE mhp= 72 -0.5113 charge= -0.5985 ATOM 2436 CA C.3 154 ILE mhp= 8 -0.6805 charge= 0.0965 ATOM 2437 C C.2 154 ILE mhp= 40 -0.1002 charge= 0.3983 ATOM 2438 O O.2 154 ILE mhp= 58 -0.0233 charge= -0.3241 ATOM 2439 CB C.3 154 ILE mhp= 3 -0.6681 charge= -0.1000 ATOM 2440 CG1 C.3 154 ILE mhp= 2 -1.0120 charge= -0.2000 ATOM 2441 CG2 C.3 154 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 2442 CD1 C.3 154 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 2443 H H 154 ILE mhp= 50 -0.1036 charge= 0.3278 ATOM 2444 HA H 154 ILE mhp= 51 0.5234 charge= 0.1000 ATOM 2445 HB H 154 ILE mhp= 52 0.6666 charge= 0.1000 ATOM 2446 HG12 H 154 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2447 HG13 H 154 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2448 HG21 H 154 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2449 HG22 H 154 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2450 HG23 H 154 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2451 HD11 H 154 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2452 HD12 H 154 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2453 HD13 H 154 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2454 N N.2 155 MET mhp= 72 -0.5113 charge= -0.5985 ATOM 2455 CA C.3 155 MET mhp= 8 -0.6805 charge= 0.0965 ATOM 2456 C C.2 155 MET mhp= 40 -0.1002 charge= 0.3983 ATOM 2457 O O.2 155 MET mhp= 58 -0.0233 charge= -0.3241 ATOM 2458 CB C.3 155 MET mhp= 2 -1.0120 charge= -0.2000 ATOM 2459 CG C.3 155 MET mhp= 6 -1.2486 charge= -0.2500 ATOM 2460 SD S.3 155 MET mhp= 107 0.5906 charge= 0.1000 ATOM 2461 CE C.3 155 MET mhp= 5 -1.7880 charge= -0.3500 ATOM 2462 H H 155 MET mhp= 50 -0.1036 charge= 0.3278 ATOM 2463 HA H 155 MET mhp= 51 0.5234 charge= 0.1000 ATOM 2464 HB2 H 155 MET mhp= 53 0.5372 charge= 0.1000 ATOM 2465 HB3 H 155 MET mhp= 53 0.5372 charge= 0.1000 ATOM 2466 HG2 H 155 MET mhp= 47 0.6301 charge= 0.1000 ATOM 2467 HG3 H 155 MET mhp= 47 0.6301 charge= 0.1000 ATOM 2468 HE1 H 155 MET mhp= 47 0.6301 charge= 0.1000 ATOM 2469 HE2 H 155 MET mhp= 47 0.6301 charge= 0.1000 ATOM 2470 HE3 H 155 MET mhp= 47 0.6301 charge= 0.1000 ATOM 2471 N N.2 156 GLY mhp= 72 -0.5113 charge= -0.5985 ATOM 2472 CA C.3 156 GLY mhp= 6 -1.2486 charge= -0.0035 ATOM 2473 C C.2 156 GLY mhp= 40 -0.1002 charge= 0.3983 ATOM 2474 O O.2 156 GLY mhp= 58 -0.0233 charge= -0.3241 ATOM 2475 H H 156 GLY mhp= 50 -0.1036 charge= 0.3278 ATOM 2476 HA2 H 156 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 2477 HA3 H 156 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 2478 N N.2 157 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 2479 CA C.3 157 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 2480 C C.2 157 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 2481 O O.2 157 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 2482 CB C.3 157 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 2483 CG1 C.3 157 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 2484 CG2 C.3 157 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 2485 H H 157 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 2486 HA H 157 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 2487 HB H 157 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 2488 HG11 H 157 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2489 HG12 H 157 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2490 HG13 H 157 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2491 HG21 H 157 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2492 HG22 H 157 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2493 HG23 H 157 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2494 N N.2 158 ALA mhp= 72 -0.5113 charge= -0.5985 ATOM 2495 CA C.3 158 ALA mhp= 8 -0.6805 charge= 0.0965 ATOM 2496 C C.2 158 ALA mhp= 40 -0.1002 charge= 0.3983 ATOM 2497 O O.2 158 ALA mhp= 58 -0.0233 charge= -0.3241 ATOM 2498 CB C.3 158 ALA mhp= 1 -1.5603 charge= -0.3000 ATOM 2499 H H 158 ALA mhp= 50 -0.1036 charge= 0.3278 ATOM 2500 HA H 158 ALA mhp= 51 0.5234 charge= 0.1000 ATOM 2501 HB1 H 158 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 2502 HB2 H 158 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 2503 HB3 H 158 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 2504 N N.2 159 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 2505 CA C.3 159 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 2506 C C.2 159 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 2507 O O.2 159 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 2508 CB C.3 159 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 2509 CG C.ar 159 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 2510 CD1 C.ar 159 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 2511 CD2 C.ar 159 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 2512 CE1 C.ar 159 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 2513 CE2 C.ar 159 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 2514 CZ C.ar 159 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 2515 H H 159 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 2516 HA H 159 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 2517 HB2 H 159 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 2518 HB3 H 159 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 2519 HD1 H 159 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 2520 HD2 H 159 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 2521 HE1 H 159 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 2522 HE2 H 159 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 2523 HZ H 159 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 2524 N N.2 160 THR mhp= 72 -0.5113 charge= -0.5985 ATOM 2525 CA C.3 160 THR mhp= 8 -0.6805 charge= 0.0965 ATOM 2526 C C.2 160 THR mhp= 40 -0.1002 charge= 0.3983 ATOM 2527 O O.2 160 THR mhp= 58 -0.0233 charge= -0.3241 ATOM 2528 CB C.3 160 THR mhp= 8 -0.6805 charge= -0.0700 ATOM 2529 OG1 O.3 160 THR mhp= 56 -0.3567 charge= -0.1490 ATOM 2530 CG2 C.3 160 THR mhp= 1 -1.5603 charge= -0.3000 ATOM 2531 H H 160 THR mhp= 50 -0.1036 charge= 0.3278 ATOM 2532 HA H 160 THR mhp= 51 0.5234 charge= 0.1000 ATOM 2533 HB H 160 THR mhp= 47 0.6301 charge= 0.1000 ATOM 2534 HG1 H 160 THR mhp= 50 -0.1036 charge= 0.1190 ATOM 2535 HG21 H 160 THR mhp= 52 0.6666 charge= 0.1000 ATOM 2536 HG22 H 160 THR mhp= 52 0.6666 charge= 0.1000 ATOM 2537 HG23 H 160 THR mhp= 52 0.6666 charge= 0.1000 ATOM 2538 N N.2 161 TRP mhp= 72 -0.5113 charge= -0.5985 ATOM 2539 CA C.3 161 TRP mhp= 8 -0.6805 charge= 0.0965 ATOM 2540 C C.2 161 TRP mhp= 40 -0.1002 charge= 0.3983 ATOM 2541 O O.2 161 TRP mhp= 58 -0.0233 charge= -0.3241 ATOM 2542 CB C.3 161 TRP mhp= 2 -1.0120 charge= -0.2000 ATOM 2543 CG C.ar 161 TRP mhp= 25 0.1492 charge= 0.0000 ATOM 2544 CD1 C.ar 161 TRP mhp= 33 -0.3723 charge= 0.0100 ATOM 2545 CD2 C.ar 161 TRP mhp= 25 0.1492 charge= 0.0000 ATOM 2546 NE1 N.ar 161 TRP mhp= 73 0.1259 charge= -0.5778 ATOM 2547 CE2 C.ar 161 TRP mhp= 34 0.2813 charge= 0.1100 ATOM 2548 CE3 C.ar 161 TRP mhp= 24 -0.3251 charge= -0.1000 ATOM 2549 CZ2 C.ar 161 TRP mhp= 24 -0.3251 charge= -0.1000 ATOM 2550 CZ3 C.ar 161 TRP mhp= 24 -0.3251 charge= -0.1000 ATOM 2551 CH2 C.ar 161 TRP mhp= 24 -0.3251 charge= -0.1000 ATOM 2552 H H 161 TRP mhp= 50 -0.1036 charge= 0.3278 ATOM 2553 HA H 161 TRP mhp= 51 0.5234 charge= 0.1000 ATOM 2554 HB2 H 161 TRP mhp= 52 0.6666 charge= 0.1000 ATOM 2555 HB3 H 161 TRP mhp= 52 0.6666 charge= 0.1000 ATOM 2556 HD1 H 161 TRP mhp= 48 0.5180 charge= 0.1300 ATOM 2557 HE3 H 161 TRP mhp= 47 0.6301 charge= 0.1000 ATOM 2558 HZ2 H 161 TRP mhp= 47 0.6301 charge= 0.1000 ATOM 2559 HZ3 H 161 TRP mhp= 47 0.6301 charge= 0.1000 ATOM 2560 HH2 H 161 TRP mhp= 47 0.6301 charge= 0.1000 ATOM 2561 HE1 H 161 TRP mhp= 50 -0.1036 charge= 0.3278 ATOM 2562 N N.2 162 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 2563 CA C.3 162 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 2564 C C.2 162 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 2565 O O.2 162 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 2566 CB C.3 162 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 2567 CG1 C.3 162 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 2568 CG2 C.3 162 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 2569 H H 162 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 2570 HA H 162 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 2571 HB H 162 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 2572 HG11 H 162 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2573 HG12 H 162 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2574 HG13 H 162 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2575 HG21 H 162 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2576 HG22 H 162 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2577 HG23 H 162 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2578 N N.2 163 MET mhp= 72 -0.5113 charge= -0.5985 ATOM 2579 CA C.3 163 MET mhp= 8 -0.6805 charge= 0.0965 ATOM 2580 C C.2 163 MET mhp= 40 -0.1002 charge= 0.3983 ATOM 2581 O O.2 163 MET mhp= 58 -0.0233 charge= -0.3241 ATOM 2582 CB C.3 163 MET mhp= 2 -1.0120 charge= -0.2000 ATOM 2583 CG C.3 163 MET mhp= 6 -1.2486 charge= -0.2500 ATOM 2584 SD S.3 163 MET mhp= 107 0.5906 charge= 0.1000 ATOM 2585 CE C.3 163 MET mhp= 5 -1.7880 charge= -0.3500 ATOM 2586 H H 163 MET mhp= 50 -0.1036 charge= 0.3278 ATOM 2587 HA H 163 MET mhp= 51 0.5234 charge= 0.1000 ATOM 2588 HB2 H 163 MET mhp= 53 0.5372 charge= 0.1000 ATOM 2589 HB3 H 163 MET mhp= 53 0.5372 charge= 0.1000 ATOM 2590 HG2 H 163 MET mhp= 47 0.6301 charge= 0.1000 ATOM 2591 HG3 H 163 MET mhp= 47 0.6301 charge= 0.1000 ATOM 2592 HE1 H 163 MET mhp= 47 0.6301 charge= 0.1000 ATOM 2593 HE2 H 163 MET mhp= 47 0.6301 charge= 0.1000 ATOM 2594 HE3 H 163 MET mhp= 47 0.6301 charge= 0.1000 ATOM 2595 N N.2 164 ALA mhp= 72 -0.5113 charge= -0.5985 ATOM 2596 CA C.3 164 ALA mhp= 8 -0.6805 charge= 0.0965 ATOM 2597 C C.2 164 ALA mhp= 40 -0.1002 charge= 0.3983 ATOM 2598 O O.2 164 ALA mhp= 58 -0.0233 charge= -0.3241 ATOM 2599 CB C.3 164 ALA mhp= 1 -1.5603 charge= -0.3000 ATOM 2600 H H 164 ALA mhp= 50 -0.1036 charge= 0.3278 ATOM 2601 HA H 164 ALA mhp= 51 0.5234 charge= 0.1000 ATOM 2602 HB1 H 164 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 2603 HB2 H 164 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 2604 HB3 H 164 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 2605 N N.2 165 LEU mhp= 72 -0.5113 charge= -0.5985 ATOM 2606 CA C.3 165 LEU mhp= 8 -0.6805 charge= 0.0965 ATOM 2607 C C.2 165 LEU mhp= 40 -0.1002 charge= 0.3983 ATOM 2608 O O.2 165 LEU mhp= 58 -0.0233 charge= -0.3241 ATOM 2609 CB C.3 165 LEU mhp= 2 -1.0120 charge= -0.2000 ATOM 2610 CG C.3 165 LEU mhp= 3 -0.6681 charge= -0.1000 ATOM 2611 CD1 C.3 165 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 2612 CD2 C.3 165 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 2613 H H 165 LEU mhp= 50 -0.1036 charge= 0.3278 ATOM 2614 HA H 165 LEU mhp= 51 0.5234 charge= 0.1000 ATOM 2615 HB2 H 165 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 2616 HB3 H 165 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 2617 HG H 165 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 2618 HD11 H 165 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 2619 HD12 H 165 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 2620 HD13 H 165 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 2621 HD21 H 165 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 2622 HD22 H 165 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 2623 HD23 H 165 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 2624 N N.2 166 ALA mhp= 72 -0.5113 charge= -0.5985 ATOM 2625 CA C.3 166 ALA mhp= 8 -0.6805 charge= 0.0965 ATOM 2626 C C.2 166 ALA mhp= 40 -0.1002 charge= 0.3983 ATOM 2627 O O.2 166 ALA mhp= 58 -0.0233 charge= -0.3241 ATOM 2628 CB C.3 166 ALA mhp= 1 -1.5603 charge= -0.3000 ATOM 2629 H H 166 ALA mhp= 50 -0.1036 charge= 0.3278 ATOM 2630 HA H 166 ALA mhp= 51 0.5234 charge= 0.1000 ATOM 2631 HB1 H 166 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 2632 HB2 H 166 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 2633 HB3 H 166 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 2634 N N.2 167 CYS mhp= 72 -0.5113 charge= -0.5985 ATOM 2635 CA C.3 167 CYS mhp= 8 -0.6805 charge= 0.0965 ATOM 2636 C C.2 167 CYS mhp= 40 -0.1002 charge= 0.3983 ATOM 2637 O O.2 167 CYS mhp= 58 -0.0233 charge= -0.3241 ATOM 2638 CB C.3 167 CYS mhp= 6 -1.2486 charge= -0.3000 ATOM 2639 SG S.3 167 CYS mhp= 106 0.6146 charge= 0.0213 ATOM 2640 H H 167 CYS mhp= 50 -0.1036 charge= 0.3278 ATOM 2641 HA H 167 CYS mhp= 51 0.5234 charge= 0.1000 ATOM 2642 HB2 H 167 CYS mhp= 47 0.6301 charge= 0.1000 ATOM 2643 HB3 H 167 CYS mhp= 47 0.6301 charge= 0.1000 ATOM 2644 HG H 167 CYS mhp= 50 -0.1036 charge= 0.0787 ATOM 2645 N N.2 168 ALA mhp= 72 -0.5113 charge= -0.5985 ATOM 2646 CA C.3 168 ALA mhp= 8 -0.6805 charge= 0.0965 ATOM 2647 C C.2 168 ALA mhp= 40 -0.1002 charge= 0.3983 ATOM 2648 O O.2 168 ALA mhp= 58 -0.0233 charge= -0.3241 ATOM 2649 CB C.3 168 ALA mhp= 1 -1.5603 charge= -0.3000 ATOM 2650 H H 168 ALA mhp= 50 -0.1036 charge= 0.3278 ATOM 2651 HA H 168 ALA mhp= 51 0.5234 charge= 0.1000 ATOM 2652 HB1 H 168 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 2653 HB2 H 168 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 2654 HB3 H 168 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 2655 N N.2 169 ALA mhp= 72 -0.5113 charge= -0.5985 ATOM 2656 CA C.3 169 ALA mhp= 8 -0.6805 charge= 0.0965 ATOM 2657 C C.2 169 ALA mhp= 40 -0.1002 charge= 0.3983 ATOM 2658 O O.2 169 ALA mhp= 58 -0.0233 charge= -0.3241 ATOM 2659 CB C.3 169 ALA mhp= 1 -1.5603 charge= -0.3000 ATOM 2660 H H 169 ALA mhp= 50 -0.1036 charge= 0.3278 ATOM 2661 HA H 169 ALA mhp= 51 0.5234 charge= 0.1000 ATOM 2662 HB1 H 169 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 2663 HB2 H 169 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 2664 HB3 H 169 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 2665 N N.2 170 PRO mhp= 72 -0.5113 charge= -0.6007 ATOM 2666 CA C.3 170 PRO mhp= 8 -0.6805 charge= 0.2065 ATOM 2667 C C.2 170 PRO mhp= 40 -0.1002 charge= 0.3983 ATOM 2668 O O.2 170 PRO mhp= 58 -0.0233 charge= -0.3241 ATOM 2669 CB C.3 170 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 2670 CG C.3 170 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 2671 CD C.3 170 PRO mhp= 6 -1.2486 charge= 0.0200 ATOM 2672 HA H 170 PRO mhp= 51 0.5234 charge= 0.1000 ATOM 2673 HB2 H 170 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 2674 HB3 H 170 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 2675 HG2 H 170 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 2676 HG3 H 170 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 2677 HD2 H 170 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 2678 HD3 H 170 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 2679 N N.2 171 PRO mhp= 72 -0.5113 charge= -0.6007 ATOM 2680 CA C.3 171 PRO mhp= 8 -0.6805 charge= 0.2065 ATOM 2681 C C.2 171 PRO mhp= 40 -0.1002 charge= 0.3983 ATOM 2682 O O.2 171 PRO mhp= 58 -0.0233 charge= -0.3241 ATOM 2683 CB C.3 171 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 2684 CG C.3 171 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 2685 CD C.3 171 PRO mhp= 6 -1.2486 charge= 0.0200 ATOM 2686 HA H 171 PRO mhp= 51 0.5234 charge= 0.1000 ATOM 2687 HB2 H 171 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 2688 HB3 H 171 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 2689 HG2 H 171 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 2690 HG3 H 171 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 2691 HD2 H 171 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 2692 HD3 H 171 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 2693 N N.2 172 LEU mhp= 72 -0.5113 charge= -0.5985 ATOM 2694 CA C.3 172 LEU mhp= 8 -0.6805 charge= 0.0965 ATOM 2695 C C.2 172 LEU mhp= 40 -0.1002 charge= 0.3983 ATOM 2696 O O.2 172 LEU mhp= 58 -0.0233 charge= -0.3241 ATOM 2697 CB C.3 172 LEU mhp= 2 -1.0120 charge= -0.2000 ATOM 2698 CG C.3 172 LEU mhp= 3 -0.6681 charge= -0.1000 ATOM 2699 CD1 C.3 172 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 2700 CD2 C.3 172 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 2701 H H 172 LEU mhp= 50 -0.1036 charge= 0.3278 ATOM 2702 HA H 172 LEU mhp= 51 0.5234 charge= 0.1000 ATOM 2703 HB2 H 172 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 2704 HB3 H 172 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 2705 HG H 172 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 2706 HD21 H 172 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 2707 HD22 H 172 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 2708 HD23 H 172 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 2709 HD11 H 172 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 2710 HD12 H 172 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 2711 HD13 H 172 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 2712 N N.2 173 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 2713 CA C.3 173 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 2714 C C.2 173 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 2715 O O.2 173 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 2716 CB C.3 173 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 2717 CG1 C.3 173 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 2718 CG2 C.3 173 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 2719 H H 173 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 2720 HA H 173 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 2721 HB H 173 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 2722 HG11 H 173 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2723 HG12 H 173 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2724 HG13 H 173 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2725 HG21 H 173 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2726 HG22 H 173 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2727 HG23 H 173 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 2728 N N.2 174 GLY mhp= 72 -0.5113 charge= -0.5985 ATOM 2729 CA C.3 174 GLY mhp= 6 -1.2486 charge= -0.0035 ATOM 2730 C C.2 174 GLY mhp= 40 -0.1002 charge= 0.3983 ATOM 2731 O O.2 174 GLY mhp= 58 -0.0233 charge= -0.3241 ATOM 2732 H H 174 GLY mhp= 50 -0.1036 charge= 0.3278 ATOM 2733 HA2 H 174 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 2734 HA3 H 174 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 2735 N N.2 175 TRP mhp= 72 -0.5113 charge= -0.5985 ATOM 2736 CA C.3 175 TRP mhp= 8 -0.6805 charge= 0.0965 ATOM 2737 C C.2 175 TRP mhp= 40 -0.1002 charge= 0.3983 ATOM 2738 O O.2 175 TRP mhp= 58 -0.0233 charge= -0.3241 ATOM 2739 CB C.3 175 TRP mhp= 2 -1.0120 charge= -0.2000 ATOM 2740 CG C.ar 175 TRP mhp= 25 0.1492 charge= 0.0000 ATOM 2741 CD1 C.ar 175 TRP mhp= 33 -0.3723 charge= 0.0100 ATOM 2742 CD2 C.ar 175 TRP mhp= 25 0.1492 charge= 0.0000 ATOM 2743 NE1 N.ar 175 TRP mhp= 73 0.1259 charge= -0.5778 ATOM 2744 CE2 C.ar 175 TRP mhp= 34 0.2813 charge= 0.1100 ATOM 2745 CE3 C.ar 175 TRP mhp= 24 -0.3251 charge= -0.1000 ATOM 2746 CZ2 C.ar 175 TRP mhp= 24 -0.3251 charge= -0.1000 ATOM 2747 CZ3 C.ar 175 TRP mhp= 24 -0.3251 charge= -0.1000 ATOM 2748 CH2 C.ar 175 TRP mhp= 24 -0.3251 charge= -0.1000 ATOM 2749 H H 175 TRP mhp= 50 -0.1036 charge= 0.3278 ATOM 2750 HA H 175 TRP mhp= 51 0.5234 charge= 0.1000 ATOM 2751 HB2 H 175 TRP mhp= 52 0.6666 charge= 0.1000 ATOM 2752 HB3 H 175 TRP mhp= 52 0.6666 charge= 0.1000 ATOM 2753 HD1 H 175 TRP mhp= 48 0.5180 charge= 0.1300 ATOM 2754 HE3 H 175 TRP mhp= 47 0.6301 charge= 0.1000 ATOM 2755 HZ2 H 175 TRP mhp= 47 0.6301 charge= 0.1000 ATOM 2756 HZ3 H 175 TRP mhp= 47 0.6301 charge= 0.1000 ATOM 2757 HH2 H 175 TRP mhp= 47 0.6301 charge= 0.1000 ATOM 2758 HE1 H 175 TRP mhp= 50 -0.1036 charge= 0.3278 ATOM 2759 N N.2 176 SER mhp= 72 -0.5113 charge= -0.5985 ATOM 2760 CA C.3 176 SER mhp= 8 -0.6805 charge= 0.0965 ATOM 2761 C C.2 176 SER mhp= 40 -0.1002 charge= 0.3983 ATOM 2762 O O.2 176 SER mhp= 58 -0.0233 charge= -0.3241 ATOM 2763 CB C.3 176 SER mhp= 6 -1.2486 charge= -0.1700 ATOM 2764 OG O.3 176 SER mhp= 56 -0.3567 charge= -0.1490 ATOM 2765 H H 176 SER mhp= 50 -0.1036 charge= 0.3278 ATOM 2766 HA H 176 SER mhp= 51 0.5234 charge= 0.1000 ATOM 2767 HB2 H 176 SER mhp= 47 0.6301 charge= 0.1000 ATOM 2768 HB3 H 176 SER mhp= 47 0.6301 charge= 0.1000 ATOM 2769 HG H 176 SER mhp= 50 -0.1036 charge= 0.1190 ATOM 2770 N N.2 177 ARG mhp= 72 -0.5113 charge= -0.5985 ATOM 2771 CA C.3 177 ARG mhp= 8 -0.6805 charge= 0.0965 ATOM 2772 C C.2 177 ARG mhp= 40 -0.1002 charge= 0.3983 ATOM 2773 O O.2 177 ARG mhp= 58 -0.0233 charge= -0.3241 ATOM 2774 CB C.3 177 ARG mhp= 2 -1.0120 charge= -0.2000 ATOM 2775 CG C.3 177 ARG mhp= 2 -1.0120 charge= -0.2000 ATOM 2776 CD C.3 177 ARG mhp= 6 -1.2486 charge= -0.0900 ATOM 2777 NE N.2 177 ARG mhp= 79 -1.4439 charge= 0.0622 ATOM 2778 CZ C.cat 177 ARG mhp= 32 0.5142 charge= -0.5000 ATOM 2779 NH1 N.3 177 ARG mhp= 79 -1.4439 charge= -0.1556 ATOM 2780 NH2 N.3 177 ARG mhp= 79 -1.4439 charge= -0.1556 ATOM 2781 H H 177 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 2782 HA H 177 ARG mhp= 51 0.5234 charge= 0.1000 ATOM 2783 HB2 H 177 ARG mhp= 52 0.6666 charge= 0.1000 ATOM 2784 HB3 H 177 ARG mhp= 52 0.6666 charge= 0.1000 ATOM 2785 HG2 H 177 ARG mhp= 52 0.6666 charge= 0.1000 ATOM 2786 HG3 H 177 ARG mhp= 52 0.6666 charge= 0.1000 ATOM 2787 HD2 H 177 ARG mhp= 47 0.6301 charge= 0.1000 ATOM 2788 HD3 H 177 ARG mhp= 47 0.6301 charge= 0.1000 ATOM 2789 HE H 177 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 2790 HH11 H 177 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 2791 HH12 H 177 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 2792 HH21 H 177 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 2793 HH22 H 177 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 2794 N N.2 178 TYR mhp= 72 -0.5113 charge= -0.5985 ATOM 2795 CA C.3 178 TYR mhp= 8 -0.6805 charge= 0.0965 ATOM 2796 C C.2 178 TYR mhp= 40 -0.1002 charge= 0.3983 ATOM 2797 O O.2 178 TYR mhp= 58 -0.0233 charge= -0.3241 ATOM 2798 CB C.3 178 TYR mhp= 2 -1.0120 charge= -0.2000 ATOM 2799 CG C.ar 178 TYR mhp= 25 0.1492 charge= 0.0000 ATOM 2800 CD1 C.ar 178 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 2801 CD2 C.ar 178 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 2802 CE1 C.ar 178 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 2803 CE2 C.ar 178 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 2804 CZ C.ar 178 TYR mhp= 26 0.1539 charge= 0.0300 ATOM 2805 OH O.3 178 TYR mhp= 57 -0.0127 charge= -0.1490 ATOM 2806 H H 178 TYR mhp= 50 -0.1036 charge= 0.3278 ATOM 2807 HA H 178 TYR mhp= 51 0.5234 charge= 0.1000 ATOM 2808 HB2 H 178 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 2809 HB3 H 178 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 2810 HD1 H 178 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 2811 HD2 H 178 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 2812 HE1 H 178 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 2813 HE2 H 178 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 2814 HH H 178 TYR mhp= 50 -0.1036 charge= 0.1190 ATOM 2815 N N.2 179 ILE mhp= 72 -0.5113 charge= -0.5985 ATOM 2816 CA C.3 179 ILE mhp= 8 -0.6805 charge= 0.0965 ATOM 2817 C C.2 179 ILE mhp= 40 -0.1002 charge= 0.3983 ATOM 2818 O O.2 179 ILE mhp= 58 -0.0233 charge= -0.3241 ATOM 2819 CB C.3 179 ILE mhp= 3 -0.6681 charge= -0.1000 ATOM 2820 CG1 C.3 179 ILE mhp= 2 -1.0120 charge= -0.2000 ATOM 2821 CG2 C.3 179 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 2822 CD1 C.3 179 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 2823 H H 179 ILE mhp= 50 -0.1036 charge= 0.3278 ATOM 2824 HA H 179 ILE mhp= 51 0.5234 charge= 0.1000 ATOM 2825 HB H 179 ILE mhp= 52 0.6666 charge= 0.1000 ATOM 2826 HG12 H 179 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2827 HG13 H 179 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2828 HG21 H 179 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2829 HG22 H 179 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2830 HG23 H 179 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2831 HD11 H 179 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2832 HD12 H 179 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2833 HD13 H 179 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2834 N N.2 180 PRO mhp= 72 -0.5113 charge= -0.6007 ATOM 2835 CA C.3 180 PRO mhp= 8 -0.6805 charge= 0.2065 ATOM 2836 C C.2 180 PRO mhp= 40 -0.1002 charge= 0.3983 ATOM 2837 O O.2 180 PRO mhp= 58 -0.0233 charge= -0.3241 ATOM 2838 CB C.3 180 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 2839 CG C.3 180 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 2840 CD C.3 180 PRO mhp= 6 -1.2486 charge= 0.0200 ATOM 2841 HA H 180 PRO mhp= 51 0.5234 charge= 0.1000 ATOM 2842 HB2 H 180 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 2843 HB3 H 180 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 2844 HG2 H 180 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 2845 HG3 H 180 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 2846 HD2 H 180 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 2847 HD3 H 180 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 2848 N N.2 181 GLU mhp= 72 -0.5113 charge= -0.5985 ATOM 2849 CA C.3 181 GLU mhp= 8 -0.6805 charge= 0.0965 ATOM 2850 C C.2 181 GLU mhp= 40 -0.1002 charge= 0.3983 ATOM 2851 O O.2 181 GLU mhp= 58 -0.0233 charge= -0.3241 ATOM 2852 CB C.3 181 GLU mhp= 2 -1.0120 charge= -0.2000 ATOM 2853 CG C.3 181 GLU mhp= 2 -1.0120 charge= -0.1135 ATOM 2854 CD C.2 181 GLU mhp= 31 0.0901 charge= 0.0535 ATOM 2855 OE1 O.co2 181 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 2856 OE2 O.co2 181 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 2857 H H 181 GLU mhp= 50 -0.1036 charge= 0.3278 ATOM 2858 HA H 181 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 2859 HB2 H 181 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 2860 HB3 H 181 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 2861 HG2 H 181 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 2862 HG3 H 181 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 2863 N N.2 182 GLY mhp= 72 -0.5113 charge= -0.5985 ATOM 2864 CA C.3 182 GLY mhp= 6 -1.2486 charge= -0.0035 ATOM 2865 C C.2 182 GLY mhp= 40 -0.1002 charge= 0.3983 ATOM 2866 O O.2 182 GLY mhp= 58 -0.0233 charge= -0.3241 ATOM 2867 H H 182 GLY mhp= 50 -0.1036 charge= 0.3278 ATOM 2868 HA2 H 182 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 2869 HA3 H 182 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 2870 N N.2 183 MET mhp= 72 -0.5113 charge= -0.5985 ATOM 2871 CA C.3 183 MET mhp= 8 -0.6805 charge= 0.0965 ATOM 2872 C C.2 183 MET mhp= 40 -0.1002 charge= 0.3983 ATOM 2873 O O.2 183 MET mhp= 58 -0.0233 charge= -0.3241 ATOM 2874 CB C.3 183 MET mhp= 2 -1.0120 charge= -0.2000 ATOM 2875 CG C.3 183 MET mhp= 6 -1.2486 charge= -0.2500 ATOM 2876 SD S.3 183 MET mhp= 107 0.5906 charge= 0.1000 ATOM 2877 CE C.3 183 MET mhp= 5 -1.7880 charge= -0.3500 ATOM 2878 H H 183 MET mhp= 50 -0.1036 charge= 0.3278 ATOM 2879 HA H 183 MET mhp= 51 0.5234 charge= 0.1000 ATOM 2880 HB2 H 183 MET mhp= 53 0.5372 charge= 0.1000 ATOM 2881 HB3 H 183 MET mhp= 53 0.5372 charge= 0.1000 ATOM 2882 HG2 H 183 MET mhp= 47 0.6301 charge= 0.1000 ATOM 2883 HG3 H 183 MET mhp= 47 0.6301 charge= 0.1000 ATOM 2884 HE1 H 183 MET mhp= 47 0.6301 charge= 0.1000 ATOM 2885 HE2 H 183 MET mhp= 47 0.6301 charge= 0.1000 ATOM 2886 HE3 H 183 MET mhp= 47 0.6301 charge= 0.1000 ATOM 2887 N N.2 184 GLN mhp= 72 -0.5113 charge= -0.5985 ATOM 2888 CA C.3 184 GLN mhp= 8 -0.6805 charge= 0.0965 ATOM 2889 C C.2 184 GLN mhp= 40 -0.1002 charge= 0.3983 ATOM 2890 O O.2 184 GLN mhp= 58 -0.0233 charge= -0.3241 ATOM 2891 CB C.3 184 GLN mhp= 2 -1.0120 charge= -0.2000 ATOM 2892 CG C.3 184 GLN mhp= 2 -1.0120 charge= -0.1135 ATOM 2893 CD C.2 184 GLN mhp= 40 -0.1002 charge= 0.3983 ATOM 2894 OE1 O.2 184 GLN mhp= 58 -0.0233 charge= -0.3241 ATOM 2895 NE2 N.2 184 GLN mhp= 72 -0.5113 charge= -0.8163 ATOM 2896 H H 184 GLN mhp= 50 -0.1036 charge= 0.3278 ATOM 2897 HA H 184 GLN mhp= 51 0.5234 charge= 0.1000 ATOM 2898 HB2 H 184 GLN mhp= 52 0.6666 charge= 0.1000 ATOM 2899 HB3 H 184 GLN mhp= 52 0.6666 charge= 0.1000 ATOM 2900 HG2 H 184 GLN mhp= 51 0.5234 charge= 0.1000 ATOM 2901 HG3 H 184 GLN mhp= 51 0.5234 charge= 0.1000 ATOM 2902 HE21 H 184 GLN mhp= 50 -0.1036 charge= 0.3278 ATOM 2903 HE22 H 184 GLN mhp= 50 -0.1036 charge= 0.3278 ATOM 2904 N N.2 185 CYS mhp= 72 -0.5113 charge= -0.5985 ATOM 2905 CA C.3 185 CYS mhp= 8 -0.6805 charge= 0.0965 ATOM 2906 C C.2 185 CYS mhp= 40 -0.1002 charge= 0.3983 ATOM 2907 O O.2 185 CYS mhp= 58 -0.0233 charge= -0.3241 ATOM 2908 CB C.3 185 CYS mhp= 6 -1.2486 charge= -0.3000 ATOM 2909 SG S.3 185 CYS mhp= 106 0.6146 charge= 0.0213 ATOM 2910 H H 185 CYS mhp= 50 -0.1036 charge= 0.3278 ATOM 2911 HA H 185 CYS mhp= 51 0.5234 charge= 0.1000 ATOM 2912 HB2 H 185 CYS mhp= 47 0.6301 charge= 0.1000 ATOM 2913 HB3 H 185 CYS mhp= 47 0.6301 charge= 0.1000 ATOM 2914 HG H 185 CYS mhp= 50 -0.1036 charge= 0.0787 ATOM 2915 N N.2 186 SER mhp= 72 -0.5113 charge= -0.5985 ATOM 2916 CA C.3 186 SER mhp= 8 -0.6805 charge= 0.0965 ATOM 2917 C C.2 186 SER mhp= 40 -0.1002 charge= 0.3983 ATOM 2918 O O.2 186 SER mhp= 58 -0.0233 charge= -0.3241 ATOM 2919 CB C.3 186 SER mhp= 6 -1.2486 charge= -0.1700 ATOM 2920 OG O.3 186 SER mhp= 56 -0.3567 charge= -0.1490 ATOM 2921 H H 186 SER mhp= 50 -0.1036 charge= 0.3278 ATOM 2922 HA H 186 SER mhp= 51 0.5234 charge= 0.1000 ATOM 2923 HB2 H 186 SER mhp= 47 0.6301 charge= 0.1000 ATOM 2924 HB3 H 186 SER mhp= 47 0.6301 charge= 0.1000 ATOM 2925 HG H 186 SER mhp= 50 -0.1036 charge= 0.1190 ATOM 2926 N N.2 187 CYS mhp= 72 -0.5113 charge= -0.5985 ATOM 2927 CA C.3 187 CYS mhp= 8 -0.6805 charge= 0.0965 ATOM 2928 C C.2 187 CYS mhp= 40 -0.1002 charge= 0.3983 ATOM 2929 O O.2 187 CYS mhp= 58 -0.0233 charge= -0.3241 ATOM 2930 CB C.3 187 CYS mhp= 6 -1.2486 charge= -0.3000 ATOM 2931 SG S.3 187 CYS mhp= 107 0.5906 charge= 0.0500 ATOM 2932 H H 187 CYS mhp= 50 -0.1036 charge= 0.3278 ATOM 2933 HA H 187 CYS mhp= 51 0.5234 charge= 0.1000 ATOM 2934 HB2 H 187 CYS mhp= 47 0.6301 charge= 0.1000 ATOM 2935 HB3 H 187 CYS mhp= 47 0.6301 charge= 0.1000 ATOM 2936 N N.2 188 GLY mhp= 72 -0.5113 charge= -0.5985 ATOM 2937 CA C.3 188 GLY mhp= 6 -1.2486 charge= -0.0035 ATOM 2938 C C.2 188 GLY mhp= 40 -0.1002 charge= 0.3983 ATOM 2939 O O.2 188 GLY mhp= 58 -0.0233 charge= -0.3241 ATOM 2940 H H 188 GLY mhp= 50 -0.1036 charge= 0.3278 ATOM 2941 HA2 H 188 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 2942 HA3 H 188 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 2943 N N.2 189 ILE mhp= 72 -0.5113 charge= -0.5985 ATOM 2944 CA C.3 189 ILE mhp= 8 -0.6805 charge= 0.0965 ATOM 2945 C C.2 189 ILE mhp= 40 -0.1002 charge= 0.3983 ATOM 2946 O O.2 189 ILE mhp= 58 -0.0233 charge= -0.3241 ATOM 2947 CB C.3 189 ILE mhp= 3 -0.6681 charge= -0.1000 ATOM 2948 CG1 C.3 189 ILE mhp= 2 -1.0120 charge= -0.2000 ATOM 2949 CG2 C.3 189 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 2950 CD1 C.3 189 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 2951 H H 189 ILE mhp= 50 -0.1036 charge= 0.3278 ATOM 2952 HA H 189 ILE mhp= 51 0.5234 charge= 0.1000 ATOM 2953 HB H 189 ILE mhp= 52 0.6666 charge= 0.1000 ATOM 2954 HG12 H 189 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2955 HG13 H 189 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2956 HG21 H 189 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2957 HG22 H 189 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2958 HG23 H 189 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2959 HD11 H 189 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2960 HD12 H 189 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2961 HD13 H 189 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 2962 N N.2 190 ASP mhp= 72 -0.5113 charge= -0.5985 ATOM 2963 CA C.3 190 ASP mhp= 8 -0.6805 charge= 0.0965 ATOM 2964 C C.2 190 ASP mhp= 40 -0.1002 charge= 0.3983 ATOM 2965 O O.2 190 ASP mhp= 58 -0.0233 charge= -0.3241 ATOM 2966 CB C.3 190 ASP mhp= 2 -1.0120 charge= -0.1135 ATOM 2967 CG C.2 190 ASP mhp= 31 0.0901 charge= 0.0535 ATOM 2968 OD1 O.co2 190 ASP mhp= 62 -0.7941 charge= -0.5700 ATOM 2969 OD2 O.co2 190 ASP mhp= 62 -0.7941 charge= -0.5700 ATOM 2970 H H 190 ASP mhp= 50 -0.1036 charge= 0.3278 ATOM 2971 HA H 190 ASP mhp= 51 0.5234 charge= 0.1000 ATOM 2972 HB2 H 190 ASP mhp= 51 0.5234 charge= 0.1000 ATOM 2973 HB3 H 190 ASP mhp= 51 0.5234 charge= 0.1000 ATOM 2974 N N.2 191 TYR mhp= 72 -0.5113 charge= -0.5985 ATOM 2975 CA C.3 191 TYR mhp= 8 -0.6805 charge= 0.0965 ATOM 2976 C C.2 191 TYR mhp= 40 -0.1002 charge= 0.3983 ATOM 2977 O O.2 191 TYR mhp= 58 -0.0233 charge= -0.3241 ATOM 2978 CB C.3 191 TYR mhp= 2 -1.0120 charge= -0.2000 ATOM 2979 CG C.ar 191 TYR mhp= 25 0.1492 charge= 0.0000 ATOM 2980 CD1 C.ar 191 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 2981 CD2 C.ar 191 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 2982 CE1 C.ar 191 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 2983 CE2 C.ar 191 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 2984 CZ C.ar 191 TYR mhp= 26 0.1539 charge= 0.0300 ATOM 2985 OH O.3 191 TYR mhp= 57 -0.0127 charge= -0.1490 ATOM 2986 H H 191 TYR mhp= 50 -0.1036 charge= 0.3278 ATOM 2987 HA H 191 TYR mhp= 51 0.5234 charge= 0.1000 ATOM 2988 HB2 H 191 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 2989 HB3 H 191 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 2990 HD1 H 191 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 2991 HD2 H 191 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 2992 HE1 H 191 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 2993 HE2 H 191 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 2994 HH H 191 TYR mhp= 50 -0.1036 charge= 0.1190 ATOM 2995 N N.2 192 TYR mhp= 72 -0.5113 charge= -0.5985 ATOM 2996 CA C.3 192 TYR mhp= 8 -0.6805 charge= 0.0965 ATOM 2997 C C.2 192 TYR mhp= 40 -0.1002 charge= 0.3983 ATOM 2998 O O.2 192 TYR mhp= 58 -0.0233 charge= -0.3241 ATOM 2999 CB C.3 192 TYR mhp= 2 -1.0120 charge= -0.2000 ATOM 3000 CG C.ar 192 TYR mhp= 25 0.1492 charge= 0.0000 ATOM 3001 CD1 C.ar 192 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 3002 CD2 C.ar 192 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 3003 CE1 C.ar 192 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 3004 CE2 C.ar 192 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 3005 CZ C.ar 192 TYR mhp= 26 0.1539 charge= 0.0300 ATOM 3006 OH O.3 192 TYR mhp= 57 -0.0127 charge= -0.1490 ATOM 3007 H H 192 TYR mhp= 50 -0.1036 charge= 0.3278 ATOM 3008 HA H 192 TYR mhp= 51 0.5234 charge= 0.1000 ATOM 3009 HB2 H 192 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 3010 HB3 H 192 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 3011 HD1 H 192 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 3012 HD2 H 192 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 3013 HE1 H 192 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 3014 HE2 H 192 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 3015 HH H 192 TYR mhp= 50 -0.1036 charge= 0.1190 ATOM 3016 N N.2 193 THR mhp= 72 -0.5113 charge= -0.5985 ATOM 3017 CA C.3 193 THR mhp= 8 -0.6805 charge= 0.0965 ATOM 3018 C C.2 193 THR mhp= 40 -0.1002 charge= 0.3983 ATOM 3019 O O.2 193 THR mhp= 58 -0.0233 charge= -0.3241 ATOM 3020 CB C.3 193 THR mhp= 8 -0.6805 charge= -0.0700 ATOM 3021 OG1 O.3 193 THR mhp= 56 -0.3567 charge= -0.1490 ATOM 3022 CG2 C.3 193 THR mhp= 1 -1.5603 charge= -0.3000 ATOM 3023 H H 193 THR mhp= 50 -0.1036 charge= 0.3278 ATOM 3024 HA H 193 THR mhp= 51 0.5234 charge= 0.1000 ATOM 3025 HB H 193 THR mhp= 47 0.6301 charge= 0.1000 ATOM 3026 HG1 H 193 THR mhp= 50 -0.1036 charge= 0.1190 ATOM 3027 HG21 H 193 THR mhp= 52 0.6666 charge= 0.1000 ATOM 3028 HG22 H 193 THR mhp= 52 0.6666 charge= 0.1000 ATOM 3029 HG23 H 193 THR mhp= 52 0.6666 charge= 0.1000 ATOM 3030 N N.2 194 PRO mhp= 72 -0.5113 charge= -0.6007 ATOM 3031 CA C.3 194 PRO mhp= 8 -0.6805 charge= 0.2065 ATOM 3032 C C.2 194 PRO mhp= 40 -0.1002 charge= 0.3983 ATOM 3033 O O.2 194 PRO mhp= 58 -0.0233 charge= -0.3241 ATOM 3034 CB C.3 194 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 3035 CG C.3 194 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 3036 CD C.3 194 PRO mhp= 6 -1.2486 charge= 0.0200 ATOM 3037 HA H 194 PRO mhp= 51 0.5234 charge= 0.1000 ATOM 3038 HB2 H 194 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 3039 HB3 H 194 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 3040 HG2 H 194 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 3041 HG3 H 194 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 3042 HD2 H 194 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 3043 HD3 H 194 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 3044 N N.2 195 HIS mhp= 72 -0.5113 charge= -0.5985 ATOM 3045 CA C.3 195 HIS mhp= 8 -0.6805 charge= 0.0965 ATOM 3046 C C.2 195 HIS mhp= 40 -0.1002 charge= 0.3983 ATOM 3047 O O.2 195 HIS mhp= 58 -0.0233 charge= -0.3241 ATOM 3048 CB C.3 195 HIS mhp= 2 -1.0120 charge= -0.2000 ATOM 3049 CG C.ar 195 HIS mhp= 28 0.2361 charge= 0.1993 ATOM 3050 ND1 N.ar 195 HIS mhp= 75 -0.1624 charge= -0.3986 ATOM 3051 CD2 C.ar 195 HIS mhp= 33 -0.3723 charge= 0.0693 ATOM 3052 CE1 C.ar 195 HIS mhp= 42 -0.2147 charge= 0.2686 ATOM 3053 NE2 N.ar 195 HIS mhp= 73 0.1259 charge= -0.7264 ATOM 3054 H H 195 HIS mhp= 50 -0.1036 charge= 0.3278 ATOM 3055 HA H 195 HIS mhp= 51 0.5234 charge= 0.1000 ATOM 3056 HB2 H 195 HIS mhp= 51 0.5234 charge= 0.1000 ATOM 3057 HB3 H 195 HIS mhp= 51 0.5234 charge= 0.1000 ATOM 3058 HD2 H 195 HIS mhp= 48 0.5180 charge= 0.1300 ATOM 3059 HE1 H 195 HIS mhp= 49 -0.0371 charge= 0.1300 ATOM 3060 HE2 H 195 HIS mhp= 50 -0.1036 charge= 0.3278 ATOM 3061 N N.2 196 GLU mhp= 72 -0.5113 charge= -0.5985 ATOM 3062 CA C.3 196 GLU mhp= 8 -0.6805 charge= 0.0965 ATOM 3063 C C.2 196 GLU mhp= 40 -0.1002 charge= 0.3983 ATOM 3064 O O.2 196 GLU mhp= 58 -0.0233 charge= -0.3241 ATOM 3065 CB C.3 196 GLU mhp= 2 -1.0120 charge= -0.2000 ATOM 3066 CG C.3 196 GLU mhp= 2 -1.0120 charge= -0.1135 ATOM 3067 CD C.2 196 GLU mhp= 31 0.0901 charge= 0.0535 ATOM 3068 OE1 O.co2 196 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 3069 OE2 O.co2 196 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 3070 H H 196 GLU mhp= 50 -0.1036 charge= 0.3278 ATOM 3071 HA H 196 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 3072 HB2 H 196 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 3073 HB3 H 196 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 3074 HG2 H 196 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 3075 HG3 H 196 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 3076 N N.2 197 GLU mhp= 72 -0.5113 charge= -0.5985 ATOM 3077 CA C.3 197 GLU mhp= 8 -0.6805 charge= 0.0965 ATOM 3078 C C.2 197 GLU mhp= 40 -0.1002 charge= 0.3983 ATOM 3079 O O.2 197 GLU mhp= 58 -0.0233 charge= -0.3241 ATOM 3080 CB C.3 197 GLU mhp= 2 -1.0120 charge= -0.2000 ATOM 3081 CG C.3 197 GLU mhp= 2 -1.0120 charge= -0.1135 ATOM 3082 CD C.2 197 GLU mhp= 31 0.0901 charge= 0.0535 ATOM 3083 OE1 O.co2 197 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 3084 OE2 O.co2 197 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 3085 H H 197 GLU mhp= 50 -0.1036 charge= 0.3278 ATOM 3086 HA H 197 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 3087 HB2 H 197 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 3088 HB3 H 197 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 3089 HG2 H 197 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 3090 HG3 H 197 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 3091 N N.2 198 THR mhp= 72 -0.5113 charge= -0.5985 ATOM 3092 CA C.3 198 THR mhp= 8 -0.6805 charge= 0.0965 ATOM 3093 C C.2 198 THR mhp= 40 -0.1002 charge= 0.3983 ATOM 3094 O O.2 198 THR mhp= 58 -0.0233 charge= -0.3241 ATOM 3095 CB C.3 198 THR mhp= 8 -0.6805 charge= -0.0700 ATOM 3096 OG1 O.3 198 THR mhp= 56 -0.3567 charge= -0.1490 ATOM 3097 CG2 C.3 198 THR mhp= 1 -1.5603 charge= -0.3000 ATOM 3098 H H 198 THR mhp= 50 -0.1036 charge= 0.3278 ATOM 3099 HA H 198 THR mhp= 51 0.5234 charge= 0.1000 ATOM 3100 HB H 198 THR mhp= 47 0.6301 charge= 0.1000 ATOM 3101 HG1 H 198 THR mhp= 50 -0.1036 charge= 0.1190 ATOM 3102 HG21 H 198 THR mhp= 52 0.6666 charge= 0.1000 ATOM 3103 HG22 H 198 THR mhp= 52 0.6666 charge= 0.1000 ATOM 3104 HG23 H 198 THR mhp= 52 0.6666 charge= 0.1000 ATOM 3105 N N.2 199 ASN mhp= 72 -0.5113 charge= -0.5985 ATOM 3106 CA C.3 199 ASN mhp= 8 -0.6805 charge= 0.0965 ATOM 3107 C C.2 199 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 3108 O O.2 199 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 3109 CB C.3 199 ASN mhp= 2 -1.0120 charge= -0.1135 ATOM 3110 CG C.2 199 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 3111 OD1 O.2 199 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 3112 ND2 N.2 199 ASN mhp= 72 -0.5113 charge= -0.8163 ATOM 3113 H H 199 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 3114 HA H 199 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 3115 HB2 H 199 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 3116 HB3 H 199 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 3117 HD21 H 199 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 3118 HD22 H 199 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 3119 N N.2 200 ASN mhp= 72 -0.5113 charge= -0.5985 ATOM 3120 CA C.3 200 ASN mhp= 8 -0.6805 charge= 0.0965 ATOM 3121 C C.2 200 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 3122 O O.2 200 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 3123 CB C.3 200 ASN mhp= 2 -1.0120 charge= -0.1135 ATOM 3124 CG C.2 200 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 3125 OD1 O.2 200 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 3126 ND2 N.2 200 ASN mhp= 72 -0.5113 charge= -0.8163 ATOM 3127 H H 200 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 3128 HA H 200 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 3129 HB2 H 200 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 3130 HB3 H 200 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 3131 HD21 H 200 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 3132 HD22 H 200 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 3133 N N.2 201 GLU mhp= 72 -0.5113 charge= -0.5985 ATOM 3134 CA C.3 201 GLU mhp= 8 -0.6805 charge= 0.0965 ATOM 3135 C C.2 201 GLU mhp= 40 -0.1002 charge= 0.3983 ATOM 3136 O O.2 201 GLU mhp= 58 -0.0233 charge= -0.3241 ATOM 3137 CB C.3 201 GLU mhp= 2 -1.0120 charge= -0.2000 ATOM 3138 CG C.3 201 GLU mhp= 2 -1.0120 charge= -0.1135 ATOM 3139 CD C.2 201 GLU mhp= 31 0.0901 charge= 0.0535 ATOM 3140 OE1 O.co2 201 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 3141 OE2 O.co2 201 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 3142 H H 201 GLU mhp= 50 -0.1036 charge= 0.3278 ATOM 3143 HA H 201 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 3144 HB2 H 201 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 3145 HB3 H 201 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 3146 HG2 H 201 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 3147 HG3 H 201 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 3148 N N.2 202 SER mhp= 72 -0.5113 charge= -0.5985 ATOM 3149 CA C.3 202 SER mhp= 8 -0.6805 charge= 0.0965 ATOM 3150 C C.2 202 SER mhp= 40 -0.1002 charge= 0.3983 ATOM 3151 O O.2 202 SER mhp= 58 -0.0233 charge= -0.3241 ATOM 3152 CB C.3 202 SER mhp= 6 -1.2486 charge= -0.1700 ATOM 3153 OG O.3 202 SER mhp= 56 -0.3567 charge= -0.1490 ATOM 3154 H H 202 SER mhp= 50 -0.1036 charge= 0.3278 ATOM 3155 HA H 202 SER mhp= 51 0.5234 charge= 0.1000 ATOM 3156 HB2 H 202 SER mhp= 47 0.6301 charge= 0.1000 ATOM 3157 HB3 H 202 SER mhp= 47 0.6301 charge= 0.1000 ATOM 3158 HG H 202 SER mhp= 50 -0.1036 charge= 0.1190 ATOM 3159 N N.2 203 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 3160 CA C.3 203 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 3161 C C.2 203 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 3162 O O.2 203 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 3163 CB C.3 203 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 3164 CG C.ar 203 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 3165 CD1 C.ar 203 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3166 CD2 C.ar 203 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3167 CE1 C.ar 203 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3168 CE2 C.ar 203 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3169 CZ C.ar 203 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3170 H H 203 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 3171 HA H 203 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 3172 HB2 H 203 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 3173 HB3 H 203 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 3174 HD1 H 203 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3175 HD2 H 203 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3176 HE1 H 203 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3177 HE2 H 203 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3178 HZ H 203 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3179 N N.2 204 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 3180 CA C.3 204 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 3181 C C.2 204 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 3182 O O.2 204 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 3183 CB C.3 204 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 3184 CG1 C.3 204 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 3185 CG2 C.3 204 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 3186 H H 204 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 3187 HA H 204 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 3188 HB H 204 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 3189 HG11 H 204 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3190 HG12 H 204 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3191 HG13 H 204 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3192 HG21 H 204 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3193 HG22 H 204 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3194 HG23 H 204 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3195 N N.2 205 ILE mhp= 72 -0.5113 charge= -0.5985 ATOM 3196 CA C.3 205 ILE mhp= 8 -0.6805 charge= 0.0965 ATOM 3197 C C.2 205 ILE mhp= 40 -0.1002 charge= 0.3983 ATOM 3198 O O.2 205 ILE mhp= 58 -0.0233 charge= -0.3241 ATOM 3199 CB C.3 205 ILE mhp= 3 -0.6681 charge= -0.1000 ATOM 3200 CG1 C.3 205 ILE mhp= 2 -1.0120 charge= -0.2000 ATOM 3201 CG2 C.3 205 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 3202 CD1 C.3 205 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 3203 H H 205 ILE mhp= 50 -0.1036 charge= 0.3278 ATOM 3204 HA H 205 ILE mhp= 51 0.5234 charge= 0.1000 ATOM 3205 HB H 205 ILE mhp= 52 0.6666 charge= 0.1000 ATOM 3206 HG12 H 205 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3207 HG13 H 205 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3208 HG21 H 205 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3209 HG22 H 205 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3210 HG23 H 205 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3211 HD11 H 205 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3212 HD12 H 205 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3213 HD13 H 205 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3214 N N.2 206 TYR mhp= 72 -0.5113 charge= -0.5985 ATOM 3215 CA C.3 206 TYR mhp= 8 -0.6805 charge= 0.0965 ATOM 3216 C C.2 206 TYR mhp= 40 -0.1002 charge= 0.3983 ATOM 3217 O O.2 206 TYR mhp= 58 -0.0233 charge= -0.3241 ATOM 3218 CB C.3 206 TYR mhp= 2 -1.0120 charge= -0.2000 ATOM 3219 CG C.ar 206 TYR mhp= 25 0.1492 charge= 0.0000 ATOM 3220 CD1 C.ar 206 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 3221 CD2 C.ar 206 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 3222 CE1 C.ar 206 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 3223 CE2 C.ar 206 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 3224 CZ C.ar 206 TYR mhp= 26 0.1539 charge= 0.0300 ATOM 3225 OH O.3 206 TYR mhp= 57 -0.0127 charge= -0.1490 ATOM 3226 H H 206 TYR mhp= 50 -0.1036 charge= 0.3278 ATOM 3227 HA H 206 TYR mhp= 51 0.5234 charge= 0.1000 ATOM 3228 HB2 H 206 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 3229 HB3 H 206 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 3230 HD1 H 206 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 3231 HD2 H 206 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 3232 HE1 H 206 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 3233 HE2 H 206 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 3234 HH H 206 TYR mhp= 50 -0.1036 charge= 0.1190 ATOM 3235 N N.2 207 MET mhp= 72 -0.5113 charge= -0.5985 ATOM 3236 CA C.3 207 MET mhp= 8 -0.6805 charge= 0.0965 ATOM 3237 C C.2 207 MET mhp= 40 -0.1002 charge= 0.3983 ATOM 3238 O O.2 207 MET mhp= 58 -0.0233 charge= -0.3241 ATOM 3239 CB C.3 207 MET mhp= 2 -1.0120 charge= -0.2000 ATOM 3240 CG C.3 207 MET mhp= 6 -1.2486 charge= -0.2500 ATOM 3241 SD S.3 207 MET mhp= 107 0.5906 charge= 0.1000 ATOM 3242 CE C.3 207 MET mhp= 5 -1.7880 charge= -0.3500 ATOM 3243 H H 207 MET mhp= 50 -0.1036 charge= 0.3278 ATOM 3244 HA H 207 MET mhp= 51 0.5234 charge= 0.1000 ATOM 3245 HB2 H 207 MET mhp= 53 0.5372 charge= 0.1000 ATOM 3246 HB3 H 207 MET mhp= 53 0.5372 charge= 0.1000 ATOM 3247 HG2 H 207 MET mhp= 47 0.6301 charge= 0.1000 ATOM 3248 HG3 H 207 MET mhp= 47 0.6301 charge= 0.1000 ATOM 3249 HE1 H 207 MET mhp= 47 0.6301 charge= 0.1000 ATOM 3250 HE2 H 207 MET mhp= 47 0.6301 charge= 0.1000 ATOM 3251 HE3 H 207 MET mhp= 47 0.6301 charge= 0.1000 ATOM 3252 N N.2 208 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 3253 CA C.3 208 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 3254 C C.2 208 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 3255 O O.2 208 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 3256 CB C.3 208 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 3257 CG C.ar 208 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 3258 CD1 C.ar 208 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3259 CD2 C.ar 208 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3260 CE1 C.ar 208 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3261 CE2 C.ar 208 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3262 CZ C.ar 208 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3263 H H 208 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 3264 HA H 208 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 3265 HB2 H 208 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 3266 HB3 H 208 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 3267 HD1 H 208 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3268 HD2 H 208 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3269 HE1 H 208 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3270 HE2 H 208 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3271 HZ H 208 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3272 N N.2 209 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 3273 CA C.3 209 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 3274 C C.2 209 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 3275 O O.2 209 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 3276 CB C.3 209 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 3277 CG1 C.3 209 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 3278 CG2 C.3 209 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 3279 H H 209 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 3280 HA H 209 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 3281 HB H 209 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 3282 HG11 H 209 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3283 HG12 H 209 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3284 HG13 H 209 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3285 HG21 H 209 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3286 HG22 H 209 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3287 HG23 H 209 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3288 N N.2 210 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 3289 CA C.3 210 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 3290 C C.2 210 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 3291 O O.2 210 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 3292 CB C.3 210 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 3293 CG1 C.3 210 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 3294 CG2 C.3 210 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 3295 H H 210 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 3296 HA H 210 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 3297 HB H 210 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 3298 HG11 H 210 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3299 HG12 H 210 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3300 HG13 H 210 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3301 HG21 H 210 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3302 HG22 H 210 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3303 HG23 H 210 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3304 N N.2 211 HIS mhp= 72 -0.5113 charge= -0.5985 ATOM 3305 CA C.3 211 HIS mhp= 8 -0.6805 charge= 0.0965 ATOM 3306 C C.2 211 HIS mhp= 40 -0.1002 charge= 0.3983 ATOM 3307 O O.2 211 HIS mhp= 58 -0.0233 charge= -0.3241 ATOM 3308 CB C.3 211 HIS mhp= 2 -1.0120 charge= -0.2000 ATOM 3309 CG C.ar 211 HIS mhp= 34 0.2813 charge= 0.5326 ATOM 3310 ND1 N.ar 211 HIS mhp= 73 0.1259 charge= -0.7264 ATOM 3311 CD2 C.ar 211 HIS mhp= 33 -0.3723 charge= 0.4026 ATOM 3312 CE1 C.ar 211 HIS mhp= 42 -0.2147 charge= 0.6019 ATOM 3313 NE2 N.ar 211 HIS mhp= 73 0.1259 charge= -0.7264 ATOM 3314 H H 211 HIS mhp= 50 -0.1036 charge= 0.3278 ATOM 3315 HA H 211 HIS mhp= 51 0.5234 charge= 0.1000 ATOM 3316 HB2 H 211 HIS mhp= 51 0.5234 charge= 0.1000 ATOM 3317 HB3 H 211 HIS mhp= 51 0.5234 charge= 0.1000 ATOM 3318 HD2 H 211 HIS mhp= 48 0.5180 charge= 0.1300 ATOM 3319 HE1 H 211 HIS mhp= 49 -0.0371 charge= 0.1300 ATOM 3320 HE2 H 211 HIS mhp= 50 -0.1036 charge= 0.3278 ATOM 3321 HD1 H 211 HIS mhp= 50 -0.1036 charge= 0.3278 ATOM 3322 N N.2 212 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 3323 CA C.3 212 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 3324 C C.2 212 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 3325 O O.2 212 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 3326 CB C.3 212 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 3327 CG C.ar 212 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 3328 CD1 C.ar 212 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3329 CD2 C.ar 212 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3330 CE1 C.ar 212 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3331 CE2 C.ar 212 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3332 CZ C.ar 212 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3333 H H 212 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 3334 HA H 212 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 3335 HB2 H 212 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 3336 HB3 H 212 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 3337 HD1 H 212 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3338 HD2 H 212 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3339 HE1 H 212 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3340 HE2 H 212 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3341 HZ H 212 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3342 N N.2 213 ILE mhp= 72 -0.5113 charge= -0.5985 ATOM 3343 CA C.3 213 ILE mhp= 8 -0.6805 charge= 0.0965 ATOM 3344 C C.2 213 ILE mhp= 40 -0.1002 charge= 0.3983 ATOM 3345 O O.2 213 ILE mhp= 58 -0.0233 charge= -0.3241 ATOM 3346 CB C.3 213 ILE mhp= 3 -0.6681 charge= -0.1000 ATOM 3347 CG1 C.3 213 ILE mhp= 2 -1.0120 charge= -0.2000 ATOM 3348 CG2 C.3 213 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 3349 CD1 C.3 213 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 3350 H H 213 ILE mhp= 50 -0.1036 charge= 0.3278 ATOM 3351 HA H 213 ILE mhp= 51 0.5234 charge= 0.1000 ATOM 3352 HB H 213 ILE mhp= 52 0.6666 charge= 0.1000 ATOM 3353 HG12 H 213 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3354 HG13 H 213 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3355 HG21 H 213 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3356 HG22 H 213 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3357 HG23 H 213 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3358 HD11 H 213 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3359 HD12 H 213 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3360 HD13 H 213 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3361 N N.2 214 ILE mhp= 72 -0.5113 charge= -0.5985 ATOM 3362 CA C.3 214 ILE mhp= 8 -0.6805 charge= 0.0965 ATOM 3363 C C.2 214 ILE mhp= 40 -0.1002 charge= 0.3983 ATOM 3364 O O.2 214 ILE mhp= 58 -0.0233 charge= -0.3241 ATOM 3365 CB C.3 214 ILE mhp= 3 -0.6681 charge= -0.1000 ATOM 3366 CG1 C.3 214 ILE mhp= 2 -1.0120 charge= -0.2000 ATOM 3367 CG2 C.3 214 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 3368 CD1 C.3 214 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 3369 H H 214 ILE mhp= 50 -0.1036 charge= 0.3278 ATOM 3370 HA H 214 ILE mhp= 51 0.5234 charge= 0.1000 ATOM 3371 HB H 214 ILE mhp= 52 0.6666 charge= 0.1000 ATOM 3372 HG12 H 214 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3373 HG13 H 214 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3374 HG21 H 214 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3375 HG22 H 214 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3376 HG23 H 214 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3377 HD11 H 214 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3378 HD12 H 214 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3379 HD13 H 214 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3380 N N.2 215 PRO mhp= 72 -0.5113 charge= -0.6007 ATOM 3381 CA C.3 215 PRO mhp= 8 -0.6805 charge= 0.2065 ATOM 3382 C C.2 215 PRO mhp= 40 -0.1002 charge= 0.3983 ATOM 3383 O O.2 215 PRO mhp= 58 -0.0233 charge= -0.3241 ATOM 3384 CB C.3 215 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 3385 CG C.3 215 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 3386 CD C.3 215 PRO mhp= 6 -1.2486 charge= 0.0200 ATOM 3387 HA H 215 PRO mhp= 51 0.5234 charge= 0.1000 ATOM 3388 HB2 H 215 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 3389 HB3 H 215 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 3390 HG2 H 215 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 3391 HG3 H 215 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 3392 HD2 H 215 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 3393 HD3 H 215 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 3394 N N.2 216 LEU mhp= 72 -0.5113 charge= -0.5985 ATOM 3395 CA C.3 216 LEU mhp= 8 -0.6805 charge= 0.0965 ATOM 3396 C C.2 216 LEU mhp= 40 -0.1002 charge= 0.3983 ATOM 3397 O O.2 216 LEU mhp= 58 -0.0233 charge= -0.3241 ATOM 3398 CB C.3 216 LEU mhp= 2 -1.0120 charge= -0.2000 ATOM 3399 CG C.3 216 LEU mhp= 3 -0.6681 charge= -0.1000 ATOM 3400 CD1 C.3 216 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 3401 CD2 C.3 216 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 3402 H H 216 LEU mhp= 50 -0.1036 charge= 0.3278 ATOM 3403 HA H 216 LEU mhp= 51 0.5234 charge= 0.1000 ATOM 3404 HB2 H 216 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 3405 HB3 H 216 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 3406 HG H 216 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 3407 HD21 H 216 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 3408 HD22 H 216 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 3409 HD23 H 216 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 3410 HD11 H 216 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 3411 HD12 H 216 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 3412 HD13 H 216 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 3413 N N.2 217 ILE mhp= 72 -0.5113 charge= -0.5985 ATOM 3414 CA C.3 217 ILE mhp= 8 -0.6805 charge= 0.0965 ATOM 3415 C C.2 217 ILE mhp= 40 -0.1002 charge= 0.3983 ATOM 3416 O O.2 217 ILE mhp= 58 -0.0233 charge= -0.3241 ATOM 3417 CB C.3 217 ILE mhp= 3 -0.6681 charge= -0.1000 ATOM 3418 CG1 C.3 217 ILE mhp= 2 -1.0120 charge= -0.2000 ATOM 3419 CG2 C.3 217 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 3420 CD1 C.3 217 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 3421 H H 217 ILE mhp= 50 -0.1036 charge= 0.3278 ATOM 3422 HA H 217 ILE mhp= 51 0.5234 charge= 0.1000 ATOM 3423 HB H 217 ILE mhp= 52 0.6666 charge= 0.1000 ATOM 3424 HG12 H 217 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3425 HG13 H 217 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3426 HD11 H 217 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3427 HD12 H 217 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3428 HD13 H 217 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3429 HG21 H 217 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3430 HG22 H 217 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3431 HG23 H 217 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3432 N N.2 218 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 3433 CA C.3 218 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 3434 C C.2 218 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 3435 O O.2 218 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 3436 CB C.3 218 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 3437 CG1 C.3 218 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 3438 CG2 C.3 218 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 3439 H H 218 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 3440 HA H 218 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 3441 HB H 218 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 3442 HG21 H 218 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3443 HG22 H 218 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3444 HG23 H 218 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3445 HG11 H 218 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3446 HG12 H 218 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3447 HG13 H 218 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3448 N N.2 219 ILE mhp= 72 -0.5113 charge= -0.5985 ATOM 3449 CA C.3 219 ILE mhp= 8 -0.6805 charge= 0.0965 ATOM 3450 C C.2 219 ILE mhp= 40 -0.1002 charge= 0.3983 ATOM 3451 O O.2 219 ILE mhp= 58 -0.0233 charge= -0.3241 ATOM 3452 CB C.3 219 ILE mhp= 3 -0.6681 charge= -0.1000 ATOM 3453 CG1 C.3 219 ILE mhp= 2 -1.0120 charge= -0.2000 ATOM 3454 CG2 C.3 219 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 3455 CD1 C.3 219 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 3456 H H 219 ILE mhp= 50 -0.1036 charge= 0.3278 ATOM 3457 HA H 219 ILE mhp= 51 0.5234 charge= 0.1000 ATOM 3458 HB H 219 ILE mhp= 52 0.6666 charge= 0.1000 ATOM 3459 HG12 H 219 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3460 HG13 H 219 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3461 HD11 H 219 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3462 HD12 H 219 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3463 HD13 H 219 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3464 HG21 H 219 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3465 HG22 H 219 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3466 HG23 H 219 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3467 N N.2 220 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 3468 CA C.3 220 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 3469 C C.2 220 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 3470 O O.2 220 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 3471 CB C.3 220 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 3472 CG C.ar 220 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 3473 CD1 C.ar 220 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3474 CD2 C.ar 220 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3475 CE1 C.ar 220 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3476 CE2 C.ar 220 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3477 CZ C.ar 220 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3478 H H 220 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 3479 HA H 220 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 3480 HB2 H 220 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 3481 HB3 H 220 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 3482 HD1 H 220 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3483 HD2 H 220 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3484 HE1 H 220 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3485 HE2 H 220 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3486 HZ H 220 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3487 N N.2 221 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 3488 CA C.3 221 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 3489 C C.2 221 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 3490 O O.2 221 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 3491 CB C.3 221 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 3492 CG C.ar 221 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 3493 CD1 C.ar 221 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3494 CD2 C.ar 221 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3495 CE1 C.ar 221 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3496 CE2 C.ar 221 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3497 CZ C.ar 221 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3498 H H 221 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 3499 HA H 221 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 3500 HB2 H 221 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 3501 HB3 H 221 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 3502 HD1 H 221 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3503 HD2 H 221 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3504 HE1 H 221 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3505 HE2 H 221 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3506 HZ H 221 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3507 N N.2 222 CYS mhp= 72 -0.5113 charge= -0.5985 ATOM 3508 CA C.3 222 CYS mhp= 8 -0.6805 charge= 0.0965 ATOM 3509 C C.2 222 CYS mhp= 40 -0.1002 charge= 0.3983 ATOM 3510 O O.2 222 CYS mhp= 58 -0.0233 charge= -0.3241 ATOM 3511 CB C.3 222 CYS mhp= 6 -1.2486 charge= -0.3000 ATOM 3512 SG S.3 222 CYS mhp= 106 0.6146 charge= 0.0213 ATOM 3513 H H 222 CYS mhp= 50 -0.1036 charge= 0.3278 ATOM 3514 HA H 222 CYS mhp= 51 0.5234 charge= 0.1000 ATOM 3515 HB2 H 222 CYS mhp= 47 0.6301 charge= 0.1000 ATOM 3516 HB3 H 222 CYS mhp= 47 0.6301 charge= 0.1000 ATOM 3517 HG H 222 CYS mhp= 50 -0.1036 charge= 0.0787 ATOM 3518 N N.2 223 TYR mhp= 72 -0.5113 charge= -0.5985 ATOM 3519 CA C.3 223 TYR mhp= 8 -0.6805 charge= 0.0965 ATOM 3520 C C.2 223 TYR mhp= 40 -0.1002 charge= 0.3983 ATOM 3521 O O.2 223 TYR mhp= 58 -0.0233 charge= -0.3241 ATOM 3522 CB C.3 223 TYR mhp= 2 -1.0120 charge= -0.2000 ATOM 3523 CG C.ar 223 TYR mhp= 25 0.1492 charge= 0.0000 ATOM 3524 CD1 C.ar 223 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 3525 CD2 C.ar 223 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 3526 CE1 C.ar 223 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 3527 CE2 C.ar 223 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 3528 CZ C.ar 223 TYR mhp= 26 0.1539 charge= 0.0300 ATOM 3529 OH O.3 223 TYR mhp= 57 -0.0127 charge= -0.1490 ATOM 3530 H H 223 TYR mhp= 50 -0.1036 charge= 0.3278 ATOM 3531 HA H 223 TYR mhp= 51 0.5234 charge= 0.1000 ATOM 3532 HB2 H 223 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 3533 HB3 H 223 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 3534 HD1 H 223 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 3535 HD2 H 223 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 3536 HE1 H 223 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 3537 HE2 H 223 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 3538 HH H 223 TYR mhp= 50 -0.1036 charge= 0.1190 ATOM 3539 N N.2 224 GLY mhp= 72 -0.5113 charge= -0.5985 ATOM 3540 CA C.3 224 GLY mhp= 6 -1.2486 charge= -0.0035 ATOM 3541 C C.2 224 GLY mhp= 40 -0.1002 charge= 0.3983 ATOM 3542 O O.2 224 GLY mhp= 58 -0.0233 charge= -0.3241 ATOM 3543 H H 224 GLY mhp= 50 -0.1036 charge= 0.3278 ATOM 3544 HA2 H 224 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 3545 HA3 H 224 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 3546 N N.2 225 GLN mhp= 72 -0.5113 charge= -0.5985 ATOM 3547 CA C.3 225 GLN mhp= 8 -0.6805 charge= 0.0965 ATOM 3548 C C.2 225 GLN mhp= 40 -0.1002 charge= 0.3983 ATOM 3549 O O.2 225 GLN mhp= 58 -0.0233 charge= -0.3241 ATOM 3550 CB C.3 225 GLN mhp= 2 -1.0120 charge= -0.2000 ATOM 3551 CG C.3 225 GLN mhp= 2 -1.0120 charge= -0.1135 ATOM 3552 CD C.2 225 GLN mhp= 40 -0.1002 charge= 0.3983 ATOM 3553 OE1 O.2 225 GLN mhp= 58 -0.0233 charge= -0.3241 ATOM 3554 NE2 N.2 225 GLN mhp= 72 -0.5113 charge= -0.8163 ATOM 3555 H H 225 GLN mhp= 50 -0.1036 charge= 0.3278 ATOM 3556 HA H 225 GLN mhp= 51 0.5234 charge= 0.1000 ATOM 3557 HB2 H 225 GLN mhp= 52 0.6666 charge= 0.1000 ATOM 3558 HB3 H 225 GLN mhp= 52 0.6666 charge= 0.1000 ATOM 3559 HG2 H 225 GLN mhp= 51 0.5234 charge= 0.1000 ATOM 3560 HG3 H 225 GLN mhp= 51 0.5234 charge= 0.1000 ATOM 3561 HE21 H 225 GLN mhp= 50 -0.1036 charge= 0.3278 ATOM 3562 HE22 H 225 GLN mhp= 50 -0.1036 charge= 0.3278 ATOM 3563 N N.2 226 LEU mhp= 72 -0.5113 charge= -0.5985 ATOM 3564 CA C.3 226 LEU mhp= 8 -0.6805 charge= 0.0965 ATOM 3565 C C.2 226 LEU mhp= 40 -0.1002 charge= 0.3983 ATOM 3566 O O.2 226 LEU mhp= 58 -0.0233 charge= -0.3241 ATOM 3567 CB C.3 226 LEU mhp= 2 -1.0120 charge= -0.2000 ATOM 3568 CG C.3 226 LEU mhp= 3 -0.6681 charge= -0.1000 ATOM 3569 CD1 C.3 226 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 3570 CD2 C.3 226 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 3571 H H 226 LEU mhp= 50 -0.1036 charge= 0.3278 ATOM 3572 HA H 226 LEU mhp= 51 0.5234 charge= 0.1000 ATOM 3573 HB2 H 226 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 3574 HB3 H 226 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 3575 HG H 226 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 3576 HD21 H 226 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 3577 HD22 H 226 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 3578 HD23 H 226 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 3579 HD11 H 226 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 3580 HD12 H 226 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 3581 HD13 H 226 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 3582 N N.2 227 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 3583 CA C.3 227 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 3584 C C.2 227 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 3585 O O.2 227 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 3586 CB C.3 227 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 3587 CG1 C.3 227 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 3588 CG2 C.3 227 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 3589 H H 227 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 3590 HA H 227 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 3591 HB H 227 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 3592 HG11 H 227 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3593 HG12 H 227 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3594 HG13 H 227 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3595 HG21 H 227 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3596 HG22 H 227 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3597 HG23 H 227 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3598 N N.2 228 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 3599 CA C.3 228 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 3600 C C.2 228 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 3601 O O.2 228 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 3602 CB C.3 228 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 3603 CG C.ar 228 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 3604 CD1 C.ar 228 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3605 CD2 C.ar 228 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3606 CE1 C.ar 228 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3607 CE2 C.ar 228 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3608 CZ C.ar 228 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 3609 H H 228 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 3610 HA H 228 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 3611 HB2 H 228 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 3612 HB3 H 228 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 3613 HD1 H 228 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3614 HD2 H 228 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3615 HE1 H 228 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3616 HE2 H 228 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3617 HZ H 228 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 3618 N N.2 229 THR mhp= 72 -0.5113 charge= -0.5985 ATOM 3619 CA C.3 229 THR mhp= 8 -0.6805 charge= 0.0965 ATOM 3620 C C.2 229 THR mhp= 40 -0.1002 charge= 0.3983 ATOM 3621 O O.2 229 THR mhp= 58 -0.0233 charge= -0.3241 ATOM 3622 CB C.3 229 THR mhp= 8 -0.6805 charge= -0.0700 ATOM 3623 OG1 O.3 229 THR mhp= 56 -0.3567 charge= -0.1490 ATOM 3624 CG2 C.3 229 THR mhp= 1 -1.5603 charge= -0.3000 ATOM 3625 H H 229 THR mhp= 50 -0.1036 charge= 0.3278 ATOM 3626 HA H 229 THR mhp= 51 0.5234 charge= 0.1000 ATOM 3627 HB H 229 THR mhp= 47 0.6301 charge= 0.1000 ATOM 3628 HG1 H 229 THR mhp= 50 -0.1036 charge= 0.1190 ATOM 3629 HG21 H 229 THR mhp= 52 0.6666 charge= 0.1000 ATOM 3630 HG22 H 229 THR mhp= 52 0.6666 charge= 0.1000 ATOM 3631 HG23 H 229 THR mhp= 52 0.6666 charge= 0.1000 ATOM 3632 N N.2 230 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 3633 CA C.3 230 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 3634 C C.2 230 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 3635 O O.2 230 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 3636 CB C.3 230 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 3637 CG1 C.3 230 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 3638 CG2 C.3 230 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 3639 H H 230 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 3640 HA H 230 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 3641 HB H 230 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 3642 HG11 H 230 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3643 HG12 H 230 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3644 HG13 H 230 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3645 HG21 H 230 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3646 HG22 H 230 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3647 HG23 H 230 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3648 N N.2 231 LYS mhp= 72 -0.5113 charge= -0.5985 ATOM 3649 CA C.3 231 LYS mhp= 8 -0.6805 charge= 0.0965 ATOM 3650 C C.2 231 LYS mhp= 40 -0.1002 charge= 0.3983 ATOM 3651 O O.2 231 LYS mhp= 58 -0.0233 charge= -0.3241 ATOM 3652 CB C.3 231 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 3653 CG C.3 231 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 3654 CD C.3 231 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 3655 CE C.3 231 LYS mhp= 6 -1.2486 charge= 0.2200 ATOM 3656 NZ N.4 231 LYS mhp= 79 -1.4439 charge= -0.5000 ATOM 3657 H H 231 LYS mhp= 50 -0.1036 charge= 0.3278 ATOM 3658 HA H 231 LYS mhp= 51 0.5234 charge= 0.1000 ATOM 3659 HB2 H 231 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 3660 HB3 H 231 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 3661 HG2 H 231 LYS mhp= 46 0.7341 charge= 0.1000 ATOM 3662 HG3 H 231 LYS mhp= 46 0.7341 charge= 0.1000 ATOM 3663 HD2 H 231 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 3664 HD3 H 231 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 3665 HE2 H 231 LYS mhp= 47 0.6301 charge= 0.1000 ATOM 3666 HE3 H 231 LYS mhp= 47 0.6301 charge= 0.1000 ATOM 3667 HZ1 H 231 LYS mhp= 50 -0.1036 charge= 0.3600 ATOM 3668 HZ2 H 231 LYS mhp= 50 -0.1036 charge= 0.3600 ATOM 3669 HZ3 H 231 LYS mhp= 50 -0.1036 charge= 0.3600 ATOM 3670 N N.2 232 GLU mhp= 72 -0.5113 charge= -0.5985 ATOM 3671 CA C.3 232 GLU mhp= 8 -0.6805 charge= 0.0965 ATOM 3672 C C.2 232 GLU mhp= 40 -0.1002 charge= 0.3983 ATOM 3673 O O.2 232 GLU mhp= 58 -0.0233 charge= -0.3241 ATOM 3674 CB C.3 232 GLU mhp= 2 -1.0120 charge= -0.2000 ATOM 3675 CG C.3 232 GLU mhp= 2 -1.0120 charge= -0.1135 ATOM 3676 CD C.2 232 GLU mhp= 31 0.0901 charge= 0.0535 ATOM 3677 OE1 O.co2 232 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 3678 OE2 O.co2 232 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 3679 H H 232 GLU mhp= 50 -0.1036 charge= 0.3278 ATOM 3680 HA H 232 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 3681 HB2 H 232 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 3682 HB3 H 232 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 3683 HG2 H 232 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 3684 HG3 H 232 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 3685 N N.2 233 ALA mhp= 72 -0.5113 charge= -0.5985 ATOM 3686 CA C.3 233 ALA mhp= 8 -0.6805 charge= 0.0965 ATOM 3687 C C.2 233 ALA mhp= 40 -0.1002 charge= 0.3983 ATOM 3688 O O.2 233 ALA mhp= 58 -0.0233 charge= -0.3241 ATOM 3689 CB C.3 233 ALA mhp= 1 -1.5603 charge= -0.3000 ATOM 3690 H H 233 ALA mhp= 50 -0.1036 charge= 0.3278 ATOM 3691 HA H 233 ALA mhp= 51 0.5234 charge= 0.1000 ATOM 3692 HB1 H 233 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 3693 HB2 H 233 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 3694 HB3 H 233 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 3695 N N.2 234 ALA mhp= 72 -0.5113 charge= -0.5985 ATOM 3696 CA C.3 234 ALA mhp= 8 -0.6805 charge= 0.0965 ATOM 3697 C C.2 234 ALA mhp= 40 -0.1002 charge= 0.3983 ATOM 3698 O O.2 234 ALA mhp= 58 -0.0233 charge= -0.3241 ATOM 3699 CB C.3 234 ALA mhp= 1 -1.5603 charge= -0.3000 ATOM 3700 H H 234 ALA mhp= 50 -0.1036 charge= 0.3278 ATOM 3701 HA H 234 ALA mhp= 51 0.5234 charge= 0.1000 ATOM 3702 HB1 H 234 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 3703 HB2 H 234 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 3704 HB3 H 234 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 3705 N N.2 235 ALA mhp= 72 -0.5113 charge= -0.5985 ATOM 3706 CA C.3 235 ALA mhp= 8 -0.6805 charge= 0.0100 ATOM 3707 C C.1 235 ALA mhp= 0 0.0000 charge= 0.3800 ATOM 3708 O O.2 235 ALA mhp= 58 -0.0233 charge= -0.3800 ATOM 3709 CB C.3 235 ALA mhp= 1 -1.5603 charge= -0.3000 ATOM 3710 H H 235 ALA mhp= 50 -0.1036 charge= 0.3278 ATOM 3711 HA H 235 ALA mhp= 51 0.5234 charge= 0.1000 ATOM 3712 HB1 H 235 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 3713 HB2 H 235 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 3714 HB3 H 235 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 3715 N N.1 241 ALA mhp= 78 0.4208 charge= -0.4378 ATOM 3716 CA C.3 241 ALA mhp= 8 -0.6805 charge= 0.0965 ATOM 3717 C C.2 241 ALA mhp= 40 -0.1002 charge= 0.3983 ATOM 3718 O O.2 241 ALA mhp= 58 -0.0233 charge= -0.3241 ATOM 3719 CB C.3 241 ALA mhp= 1 -1.5603 charge= -0.3000 ATOM 3720 HA H 241 ALA mhp= 51 0.5234 charge= 0.1000 ATOM 3721 HB1 H 241 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 3722 HB2 H 241 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 3723 HB3 H 241 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 3724 H H 241 ALA mhp= 50 -0.1036 charge= 0.3278 ATOM 3725 N N.2 242 THR mhp= 72 -0.5113 charge= -0.5985 ATOM 3726 CA C.3 242 THR mhp= 8 -0.6805 charge= 0.0965 ATOM 3727 C C.2 242 THR mhp= 40 -0.1002 charge= 0.3983 ATOM 3728 O O.2 242 THR mhp= 58 -0.0233 charge= -0.3241 ATOM 3729 CB C.3 242 THR mhp= 8 -0.6805 charge= -0.0700 ATOM 3730 OG1 O.3 242 THR mhp= 56 -0.3567 charge= -0.1490 ATOM 3731 CG2 C.3 242 THR mhp= 1 -1.5603 charge= -0.3000 ATOM 3732 H H 242 THR mhp= 50 -0.1036 charge= 0.3278 ATOM 3733 HA H 242 THR mhp= 51 0.5234 charge= 0.1000 ATOM 3734 HB H 242 THR mhp= 47 0.6301 charge= 0.1000 ATOM 3735 HG1 H 242 THR mhp= 50 -0.1036 charge= 0.1190 ATOM 3736 HG21 H 242 THR mhp= 52 0.6666 charge= 0.1000 ATOM 3737 HG22 H 242 THR mhp= 52 0.6666 charge= 0.1000 ATOM 3738 HG23 H 242 THR mhp= 52 0.6666 charge= 0.1000 ATOM 3739 N N.2 243 THR mhp= 72 -0.5113 charge= -0.5985 ATOM 3740 CA C.3 243 THR mhp= 8 -0.6805 charge= 0.0965 ATOM 3741 C C.2 243 THR mhp= 40 -0.1002 charge= 0.3983 ATOM 3742 O O.2 243 THR mhp= 58 -0.0233 charge= -0.3241 ATOM 3743 CB C.3 243 THR mhp= 8 -0.6805 charge= -0.0700 ATOM 3744 OG1 O.3 243 THR mhp= 56 -0.3567 charge= -0.1490 ATOM 3745 CG2 C.3 243 THR mhp= 1 -1.5603 charge= -0.3000 ATOM 3746 H H 243 THR mhp= 50 -0.1036 charge= 0.3278 ATOM 3747 HA H 243 THR mhp= 51 0.5234 charge= 0.1000 ATOM 3748 HB H 243 THR mhp= 47 0.6301 charge= 0.1000 ATOM 3749 HG21 H 243 THR mhp= 52 0.6666 charge= 0.1000 ATOM 3750 HG22 H 243 THR mhp= 52 0.6666 charge= 0.1000 ATOM 3751 HG23 H 243 THR mhp= 52 0.6666 charge= 0.1000 ATOM 3752 HG1 H 243 THR mhp= 50 -0.1036 charge= 0.1190 ATOM 3753 N N.2 244 GLN mhp= 72 -0.5113 charge= -0.5985 ATOM 3754 CA C.3 244 GLN mhp= 8 -0.6805 charge= 0.0965 ATOM 3755 C C.2 244 GLN mhp= 40 -0.1002 charge= 0.3983 ATOM 3756 O O.2 244 GLN mhp= 58 -0.0233 charge= -0.3241 ATOM 3757 CB C.3 244 GLN mhp= 2 -1.0120 charge= -0.2000 ATOM 3758 CG C.3 244 GLN mhp= 2 -1.0120 charge= -0.1135 ATOM 3759 CD C.2 244 GLN mhp= 40 -0.1002 charge= 0.3983 ATOM 3760 OE1 O.2 244 GLN mhp= 58 -0.0233 charge= -0.3241 ATOM 3761 NE2 N.2 244 GLN mhp= 72 -0.5113 charge= -0.8163 ATOM 3762 H H 244 GLN mhp= 50 -0.1036 charge= 0.3278 ATOM 3763 HA H 244 GLN mhp= 51 0.5234 charge= 0.1000 ATOM 3764 HB2 H 244 GLN mhp= 52 0.6666 charge= 0.1000 ATOM 3765 HB3 H 244 GLN mhp= 52 0.6666 charge= 0.1000 ATOM 3766 HG2 H 244 GLN mhp= 51 0.5234 charge= 0.1000 ATOM 3767 HG3 H 244 GLN mhp= 51 0.5234 charge= 0.1000 ATOM 3768 HE21 H 244 GLN mhp= 50 -0.1036 charge= 0.3278 ATOM 3769 HE22 H 244 GLN mhp= 50 -0.1036 charge= 0.3278 ATOM 3770 N N.2 245 LYS mhp= 72 -0.5113 charge= -0.5985 ATOM 3771 CA C.3 245 LYS mhp= 8 -0.6805 charge= 0.0965 ATOM 3772 C C.2 245 LYS mhp= 40 -0.1002 charge= 0.3983 ATOM 3773 O O.2 245 LYS mhp= 58 -0.0233 charge= -0.3241 ATOM 3774 CB C.3 245 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 3775 CG C.3 245 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 3776 CD C.3 245 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 3777 CE C.3 245 LYS mhp= 6 -1.2486 charge= 0.2200 ATOM 3778 NZ N.4 245 LYS mhp= 79 -1.4439 charge= -0.5000 ATOM 3779 H H 245 LYS mhp= 50 -0.1036 charge= 0.3278 ATOM 3780 HA H 245 LYS mhp= 51 0.5234 charge= 0.1000 ATOM 3781 HB2 H 245 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 3782 HB3 H 245 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 3783 HG2 H 245 LYS mhp= 46 0.7341 charge= 0.1000 ATOM 3784 HG3 H 245 LYS mhp= 46 0.7341 charge= 0.1000 ATOM 3785 HD2 H 245 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 3786 HD3 H 245 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 3787 HE2 H 245 LYS mhp= 47 0.6301 charge= 0.1000 ATOM 3788 HE3 H 245 LYS mhp= 47 0.6301 charge= 0.1000 ATOM 3789 HZ1 H 245 LYS mhp= 50 -0.1036 charge= 0.3600 ATOM 3790 HZ2 H 245 LYS mhp= 50 -0.1036 charge= 0.3600 ATOM 3791 HZ3 H 245 LYS mhp= 50 -0.1036 charge= 0.3600 ATOM 3792 N N.2 246 ALA mhp= 72 -0.5113 charge= -0.5985 ATOM 3793 CA C.3 246 ALA mhp= 8 -0.6805 charge= 0.0965 ATOM 3794 C C.2 246 ALA mhp= 40 -0.1002 charge= 0.3983 ATOM 3795 O O.2 246 ALA mhp= 58 -0.0233 charge= -0.3241 ATOM 3796 CB C.3 246 ALA mhp= 1 -1.5603 charge= -0.3000 ATOM 3797 H H 246 ALA mhp= 50 -0.1036 charge= 0.3278 ATOM 3798 HA H 246 ALA mhp= 51 0.5234 charge= 0.1000 ATOM 3799 HB1 H 246 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 3800 HB2 H 246 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 3801 HB3 H 246 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 3802 N N.2 247 GLU mhp= 72 -0.5113 charge= -0.5985 ATOM 3803 CA C.3 247 GLU mhp= 8 -0.6805 charge= 0.0965 ATOM 3804 C C.2 247 GLU mhp= 40 -0.1002 charge= 0.3983 ATOM 3805 O O.2 247 GLU mhp= 58 -0.0233 charge= -0.3241 ATOM 3806 CB C.3 247 GLU mhp= 2 -1.0120 charge= -0.2000 ATOM 3807 CG C.3 247 GLU mhp= 2 -1.0120 charge= -0.1135 ATOM 3808 CD C.2 247 GLU mhp= 31 0.0901 charge= 0.0535 ATOM 3809 OE1 O.co2 247 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 3810 OE2 O.co2 247 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 3811 H H 247 GLU mhp= 50 -0.1036 charge= 0.3278 ATOM 3812 HA H 247 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 3813 HB2 H 247 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 3814 HB3 H 247 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 3815 HG2 H 247 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 3816 HG3 H 247 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 3817 N N.2 248 LYS mhp= 72 -0.5113 charge= -0.5985 ATOM 3818 CA C.3 248 LYS mhp= 8 -0.6805 charge= 0.0965 ATOM 3819 C C.2 248 LYS mhp= 40 -0.1002 charge= 0.3983 ATOM 3820 O O.2 248 LYS mhp= 58 -0.0233 charge= -0.3241 ATOM 3821 CB C.3 248 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 3822 CG C.3 248 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 3823 CD C.3 248 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 3824 CE C.3 248 LYS mhp= 6 -1.2486 charge= 0.2200 ATOM 3825 NZ N.4 248 LYS mhp= 79 -1.4439 charge= -0.5000 ATOM 3826 H H 248 LYS mhp= 50 -0.1036 charge= 0.3278 ATOM 3827 HA H 248 LYS mhp= 51 0.5234 charge= 0.1000 ATOM 3828 HB2 H 248 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 3829 HB3 H 248 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 3830 HG2 H 248 LYS mhp= 46 0.7341 charge= 0.1000 ATOM 3831 HG3 H 248 LYS mhp= 46 0.7341 charge= 0.1000 ATOM 3832 HD2 H 248 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 3833 HD3 H 248 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 3834 HE2 H 248 LYS mhp= 47 0.6301 charge= 0.1000 ATOM 3835 HE3 H 248 LYS mhp= 47 0.6301 charge= 0.1000 ATOM 3836 HZ1 H 248 LYS mhp= 50 -0.1036 charge= 0.3600 ATOM 3837 HZ2 H 248 LYS mhp= 50 -0.1036 charge= 0.3600 ATOM 3838 HZ3 H 248 LYS mhp= 50 -0.1036 charge= 0.3600 ATOM 3839 N N.2 249 GLU mhp= 72 -0.5113 charge= -0.5985 ATOM 3840 CA C.3 249 GLU mhp= 8 -0.6805 charge= 0.0965 ATOM 3841 C C.2 249 GLU mhp= 40 -0.1002 charge= 0.3983 ATOM 3842 O O.2 249 GLU mhp= 58 -0.0233 charge= -0.3241 ATOM 3843 CB C.3 249 GLU mhp= 2 -1.0120 charge= -0.2000 ATOM 3844 CG C.3 249 GLU mhp= 2 -1.0120 charge= -0.1135 ATOM 3845 CD C.2 249 GLU mhp= 31 0.0901 charge= 0.0535 ATOM 3846 OE1 O.co2 249 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 3847 OE2 O.co2 249 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 3848 H H 249 GLU mhp= 50 -0.1036 charge= 0.3278 ATOM 3849 HA H 249 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 3850 HB2 H 249 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 3851 HB3 H 249 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 3852 HG2 H 249 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 3853 HG3 H 249 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 3854 N N.2 250 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 3855 CA C.3 250 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 3856 C C.2 250 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 3857 O O.2 250 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 3858 CB C.3 250 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 3859 CG1 C.3 250 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 3860 CG2 C.3 250 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 3861 H H 250 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 3862 HA H 250 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 3863 HB H 250 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 3864 HG11 H 250 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3865 HG12 H 250 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3866 HG13 H 250 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3867 HG21 H 250 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3868 HG22 H 250 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3869 HG23 H 250 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3870 N N.2 251 THR mhp= 72 -0.5113 charge= -0.5985 ATOM 3871 CA C.3 251 THR mhp= 8 -0.6805 charge= 0.0965 ATOM 3872 C C.2 251 THR mhp= 40 -0.1002 charge= 0.3983 ATOM 3873 O O.2 251 THR mhp= 58 -0.0233 charge= -0.3241 ATOM 3874 CB C.3 251 THR mhp= 8 -0.6805 charge= -0.0700 ATOM 3875 OG1 O.3 251 THR mhp= 56 -0.3567 charge= -0.1490 ATOM 3876 CG2 C.3 251 THR mhp= 1 -1.5603 charge= -0.3000 ATOM 3877 H H 251 THR mhp= 50 -0.1036 charge= 0.3278 ATOM 3878 HA H 251 THR mhp= 51 0.5234 charge= 0.1000 ATOM 3879 HB H 251 THR mhp= 47 0.6301 charge= 0.1000 ATOM 3880 HG1 H 251 THR mhp= 50 -0.1036 charge= 0.1190 ATOM 3881 HG21 H 251 THR mhp= 52 0.6666 charge= 0.1000 ATOM 3882 HG22 H 251 THR mhp= 52 0.6666 charge= 0.1000 ATOM 3883 HG23 H 251 THR mhp= 52 0.6666 charge= 0.1000 ATOM 3884 N N.2 252 ARG mhp= 72 -0.5113 charge= -0.5985 ATOM 3885 CA C.3 252 ARG mhp= 8 -0.6805 charge= 0.0965 ATOM 3886 C C.2 252 ARG mhp= 40 -0.1002 charge= 0.3983 ATOM 3887 O O.2 252 ARG mhp= 58 -0.0233 charge= -0.3241 ATOM 3888 CB C.3 252 ARG mhp= 2 -1.0120 charge= -0.2000 ATOM 3889 CG C.3 252 ARG mhp= 2 -1.0120 charge= -0.2000 ATOM 3890 CD C.3 252 ARG mhp= 6 -1.2486 charge= -0.0900 ATOM 3891 NE N.2 252 ARG mhp= 79 -1.4439 charge= 0.0622 ATOM 3892 CZ C.cat 252 ARG mhp= 32 0.5142 charge= -0.5000 ATOM 3893 NH1 N.3 252 ARG mhp= 79 -1.4439 charge= -0.1556 ATOM 3894 NH2 N.3 252 ARG mhp= 79 -1.4439 charge= -0.1556 ATOM 3895 H H 252 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 3896 HA H 252 ARG mhp= 51 0.5234 charge= 0.1000 ATOM 3897 HB2 H 252 ARG mhp= 52 0.6666 charge= 0.1000 ATOM 3898 HB3 H 252 ARG mhp= 52 0.6666 charge= 0.1000 ATOM 3899 HG2 H 252 ARG mhp= 52 0.6666 charge= 0.1000 ATOM 3900 HG3 H 252 ARG mhp= 52 0.6666 charge= 0.1000 ATOM 3901 HD2 H 252 ARG mhp= 47 0.6301 charge= 0.1000 ATOM 3902 HD3 H 252 ARG mhp= 47 0.6301 charge= 0.1000 ATOM 3903 HE H 252 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 3904 HH11 H 252 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 3905 HH12 H 252 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 3906 HH21 H 252 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 3907 HH22 H 252 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 3908 N N.2 253 MET mhp= 72 -0.5113 charge= -0.5985 ATOM 3909 CA C.3 253 MET mhp= 8 -0.6805 charge= 0.0965 ATOM 3910 C C.2 253 MET mhp= 40 -0.1002 charge= 0.3983 ATOM 3911 O O.2 253 MET mhp= 58 -0.0233 charge= -0.3241 ATOM 3912 CB C.3 253 MET mhp= 2 -1.0120 charge= -0.2000 ATOM 3913 CG C.3 253 MET mhp= 6 -1.2486 charge= -0.2500 ATOM 3914 SD S.3 253 MET mhp= 107 0.5906 charge= 0.1000 ATOM 3915 CE C.3 253 MET mhp= 5 -1.7880 charge= -0.3500 ATOM 3916 H H 253 MET mhp= 50 -0.1036 charge= 0.3278 ATOM 3917 HA H 253 MET mhp= 51 0.5234 charge= 0.1000 ATOM 3918 HB2 H 253 MET mhp= 53 0.5372 charge= 0.1000 ATOM 3919 HB3 H 253 MET mhp= 53 0.5372 charge= 0.1000 ATOM 3920 HG2 H 253 MET mhp= 47 0.6301 charge= 0.1000 ATOM 3921 HG3 H 253 MET mhp= 47 0.6301 charge= 0.1000 ATOM 3922 HE1 H 253 MET mhp= 47 0.6301 charge= 0.1000 ATOM 3923 HE2 H 253 MET mhp= 47 0.6301 charge= 0.1000 ATOM 3924 HE3 H 253 MET mhp= 47 0.6301 charge= 0.1000 ATOM 3925 N N.2 254 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 3926 CA C.3 254 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 3927 C C.2 254 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 3928 O O.2 254 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 3929 CB C.3 254 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 3930 CG1 C.3 254 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 3931 CG2 C.3 254 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 3932 H H 254 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 3933 HA H 254 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 3934 HB H 254 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 3935 HG11 H 254 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3936 HG12 H 254 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3937 HG13 H 254 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3938 HG21 H 254 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3939 HG22 H 254 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3940 HG23 H 254 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 3941 N N.2 255 ILE mhp= 72 -0.5113 charge= -0.5985 ATOM 3942 CA C.3 255 ILE mhp= 8 -0.6805 charge= 0.0965 ATOM 3943 C C.2 255 ILE mhp= 40 -0.1002 charge= 0.3983 ATOM 3944 O O.2 255 ILE mhp= 58 -0.0233 charge= -0.3241 ATOM 3945 CB C.3 255 ILE mhp= 3 -0.6681 charge= -0.1000 ATOM 3946 CG1 C.3 255 ILE mhp= 2 -1.0120 charge= -0.2000 ATOM 3947 CG2 C.3 255 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 3948 CD1 C.3 255 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 3949 H H 255 ILE mhp= 50 -0.1036 charge= 0.3278 ATOM 3950 HA H 255 ILE mhp= 51 0.5234 charge= 0.1000 ATOM 3951 HB H 255 ILE mhp= 52 0.6666 charge= 0.1000 ATOM 3952 HG12 H 255 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3953 HG13 H 255 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3954 HD11 H 255 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3955 HD12 H 255 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3956 HD13 H 255 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3957 HG21 H 255 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3958 HG22 H 255 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3959 HG23 H 255 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3960 N N.2 256 ILE mhp= 72 -0.5113 charge= -0.5985 ATOM 3961 CA C.3 256 ILE mhp= 8 -0.6805 charge= 0.0965 ATOM 3962 C C.2 256 ILE mhp= 40 -0.1002 charge= 0.3983 ATOM 3963 O O.2 256 ILE mhp= 58 -0.0233 charge= -0.3241 ATOM 3964 CB C.3 256 ILE mhp= 3 -0.6681 charge= -0.1000 ATOM 3965 CG1 C.3 256 ILE mhp= 2 -1.0120 charge= -0.2000 ATOM 3966 CG2 C.3 256 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 3967 CD1 C.3 256 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 3968 H H 256 ILE mhp= 50 -0.1036 charge= 0.3278 ATOM 3969 HA H 256 ILE mhp= 51 0.5234 charge= 0.1000 ATOM 3970 HB H 256 ILE mhp= 52 0.6666 charge= 0.1000 ATOM 3971 HG12 H 256 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3972 HG13 H 256 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3973 HG21 H 256 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3974 HG22 H 256 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3975 HG23 H 256 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3976 HD11 H 256 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3977 HD12 H 256 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3978 HD13 H 256 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 3979 N N.2 257 MET mhp= 72 -0.5113 charge= -0.5985 ATOM 3980 CA C.3 257 MET mhp= 8 -0.6805 charge= 0.0965 ATOM 3981 C C.2 257 MET mhp= 40 -0.1002 charge= 0.3983 ATOM 3982 O O.2 257 MET mhp= 58 -0.0233 charge= -0.3241 ATOM 3983 CB C.3 257 MET mhp= 2 -1.0120 charge= -0.2000 ATOM 3984 CG C.3 257 MET mhp= 6 -1.2486 charge= -0.2500 ATOM 3985 SD S.3 257 MET mhp= 107 0.5906 charge= 0.1000 ATOM 3986 CE C.3 257 MET mhp= 5 -1.7880 charge= -0.3500 ATOM 3987 H H 257 MET mhp= 50 -0.1036 charge= 0.3278 ATOM 3988 HA H 257 MET mhp= 51 0.5234 charge= 0.1000 ATOM 3989 HB2 H 257 MET mhp= 53 0.5372 charge= 0.1000 ATOM 3990 HB3 H 257 MET mhp= 53 0.5372 charge= 0.1000 ATOM 3991 HG2 H 257 MET mhp= 47 0.6301 charge= 0.1000 ATOM 3992 HG3 H 257 MET mhp= 47 0.6301 charge= 0.1000 ATOM 3993 HE1 H 257 MET mhp= 47 0.6301 charge= 0.1000 ATOM 3994 HE2 H 257 MET mhp= 47 0.6301 charge= 0.1000 ATOM 3995 HE3 H 257 MET mhp= 47 0.6301 charge= 0.1000 ATOM 3996 N N.2 258 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 3997 CA C.3 258 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 3998 C C.2 258 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 3999 O O.2 258 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 4000 CB C.3 258 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 4001 CG1 C.3 258 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 4002 CG2 C.3 258 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 4003 H H 258 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 4004 HA H 258 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 4005 HB H 258 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 4006 HG11 H 258 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4007 HG12 H 258 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4008 HG13 H 258 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4009 HG21 H 258 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4010 HG22 H 258 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4011 HG23 H 258 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4012 N N.2 259 ILE mhp= 72 -0.5113 charge= -0.5985 ATOM 4013 CA C.3 259 ILE mhp= 8 -0.6805 charge= 0.0965 ATOM 4014 C C.2 259 ILE mhp= 40 -0.1002 charge= 0.3983 ATOM 4015 O O.2 259 ILE mhp= 58 -0.0233 charge= -0.3241 ATOM 4016 CB C.3 259 ILE mhp= 3 -0.6681 charge= -0.1000 ATOM 4017 CG1 C.3 259 ILE mhp= 2 -1.0120 charge= -0.2000 ATOM 4018 CG2 C.3 259 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 4019 CD1 C.3 259 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 4020 H H 259 ILE mhp= 50 -0.1036 charge= 0.3278 ATOM 4021 HA H 259 ILE mhp= 51 0.5234 charge= 0.1000 ATOM 4022 HB H 259 ILE mhp= 52 0.6666 charge= 0.1000 ATOM 4023 HG12 H 259 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4024 HG13 H 259 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4025 HG21 H 259 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4026 HG22 H 259 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4027 HG23 H 259 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4028 HD11 H 259 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4029 HD12 H 259 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4030 HD13 H 259 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4031 N N.2 260 ALA mhp= 72 -0.5113 charge= -0.5985 ATOM 4032 CA C.3 260 ALA mhp= 8 -0.6805 charge= 0.0965 ATOM 4033 C C.2 260 ALA mhp= 40 -0.1002 charge= 0.3983 ATOM 4034 O O.2 260 ALA mhp= 58 -0.0233 charge= -0.3241 ATOM 4035 CB C.3 260 ALA mhp= 1 -1.5603 charge= -0.3000 ATOM 4036 H H 260 ALA mhp= 50 -0.1036 charge= 0.3278 ATOM 4037 HA H 260 ALA mhp= 51 0.5234 charge= 0.1000 ATOM 4038 HB1 H 260 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 4039 HB2 H 260 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 4040 HB3 H 260 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 4041 N N.2 261 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 4042 CA C.3 261 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 4043 C C.2 261 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 4044 O O.2 261 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 4045 CB C.3 261 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 4046 CG C.ar 261 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 4047 CD1 C.ar 261 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4048 CD2 C.ar 261 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4049 CE1 C.ar 261 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4050 CE2 C.ar 261 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4051 CZ C.ar 261 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4052 H H 261 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 4053 HA H 261 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 4054 HB2 H 261 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 4055 HB3 H 261 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 4056 HD1 H 261 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4057 HD2 H 261 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4058 HE1 H 261 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4059 HE2 H 261 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4060 HZ H 261 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4061 N N.2 262 LEU mhp= 72 -0.5113 charge= -0.5985 ATOM 4062 CA C.3 262 LEU mhp= 8 -0.6805 charge= 0.0965 ATOM 4063 C C.2 262 LEU mhp= 40 -0.1002 charge= 0.3983 ATOM 4064 O O.2 262 LEU mhp= 58 -0.0233 charge= -0.3241 ATOM 4065 CB C.3 262 LEU mhp= 2 -1.0120 charge= -0.2000 ATOM 4066 CG C.3 262 LEU mhp= 3 -0.6681 charge= -0.1000 ATOM 4067 CD1 C.3 262 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 4068 CD2 C.3 262 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 4069 H H 262 LEU mhp= 50 -0.1036 charge= 0.3278 ATOM 4070 HA H 262 LEU mhp= 51 0.5234 charge= 0.1000 ATOM 4071 HB2 H 262 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 4072 HB3 H 262 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 4073 HG H 262 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 4074 HD11 H 262 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 4075 HD12 H 262 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 4076 HD13 H 262 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 4077 HD21 H 262 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 4078 HD22 H 262 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 4079 HD23 H 262 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 4080 N N.2 263 ILE mhp= 72 -0.5113 charge= -0.5985 ATOM 4081 CA C.3 263 ILE mhp= 8 -0.6805 charge= 0.0965 ATOM 4082 C C.2 263 ILE mhp= 40 -0.1002 charge= 0.3983 ATOM 4083 O O.2 263 ILE mhp= 58 -0.0233 charge= -0.3241 ATOM 4084 CB C.3 263 ILE mhp= 3 -0.6681 charge= -0.1000 ATOM 4085 CG1 C.3 263 ILE mhp= 2 -1.0120 charge= -0.2000 ATOM 4086 CG2 C.3 263 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 4087 CD1 C.3 263 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 4088 H H 263 ILE mhp= 50 -0.1036 charge= 0.3278 ATOM 4089 HA H 263 ILE mhp= 51 0.5234 charge= 0.1000 ATOM 4090 HB H 263 ILE mhp= 52 0.6666 charge= 0.1000 ATOM 4091 HG12 H 263 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4092 HG13 H 263 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4093 HG21 H 263 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4094 HG22 H 263 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4095 HG23 H 263 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4096 HD11 H 263 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4097 HD12 H 263 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4098 HD13 H 263 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4099 N N.2 264 CYS mhp= 72 -0.5113 charge= -0.5985 ATOM 4100 CA C.3 264 CYS mhp= 8 -0.6805 charge= 0.0965 ATOM 4101 C C.2 264 CYS mhp= 40 -0.1002 charge= 0.3983 ATOM 4102 O O.2 264 CYS mhp= 58 -0.0233 charge= -0.3241 ATOM 4103 CB C.3 264 CYS mhp= 6 -1.2486 charge= -0.2500 ATOM 4104 SG S.2 264 CYS mhp= 0 0.0000 charge= 0.0500 ATOM 4105 H H 264 CYS mhp= 50 -0.1036 charge= 0.3278 ATOM 4106 HA H 264 CYS mhp= 51 0.5234 charge= 0.1000 ATOM 4107 HB2 H 264 CYS mhp= 47 0.6301 charge= 0.1000 ATOM 4108 HB3 H 264 CYS mhp= 47 0.6301 charge= 0.1000 ATOM 4109 N N.2 265 TRP mhp= 72 -0.5113 charge= -0.5985 ATOM 4110 CA C.3 265 TRP mhp= 8 -0.6805 charge= 0.0965 ATOM 4111 C C.2 265 TRP mhp= 40 -0.1002 charge= 0.3983 ATOM 4112 O O.2 265 TRP mhp= 58 -0.0233 charge= -0.3241 ATOM 4113 CB C.3 265 TRP mhp= 2 -1.0120 charge= -0.2000 ATOM 4114 CG C.ar 265 TRP mhp= 25 0.1492 charge= 0.0000 ATOM 4115 CD1 C.ar 265 TRP mhp= 33 -0.3723 charge= 0.0100 ATOM 4116 CD2 C.ar 265 TRP mhp= 25 0.1492 charge= 0.0000 ATOM 4117 NE1 N.ar 265 TRP mhp= 73 0.1259 charge= -0.5778 ATOM 4118 CE2 C.ar 265 TRP mhp= 34 0.2813 charge= 0.1100 ATOM 4119 CE3 C.ar 265 TRP mhp= 24 -0.3251 charge= -0.1000 ATOM 4120 CZ2 C.ar 265 TRP mhp= 24 -0.3251 charge= -0.1000 ATOM 4121 CZ3 C.ar 265 TRP mhp= 24 -0.3251 charge= -0.1000 ATOM 4122 CH2 C.ar 265 TRP mhp= 24 -0.3251 charge= -0.1000 ATOM 4123 H H 265 TRP mhp= 50 -0.1036 charge= 0.3278 ATOM 4124 HA H 265 TRP mhp= 51 0.5234 charge= 0.1000 ATOM 4125 HB2 H 265 TRP mhp= 52 0.6666 charge= 0.1000 ATOM 4126 HB3 H 265 TRP mhp= 52 0.6666 charge= 0.1000 ATOM 4127 HD1 H 265 TRP mhp= 48 0.5180 charge= 0.1300 ATOM 4128 HE3 H 265 TRP mhp= 47 0.6301 charge= 0.1000 ATOM 4129 HZ2 H 265 TRP mhp= 47 0.6301 charge= 0.1000 ATOM 4130 HZ3 H 265 TRP mhp= 47 0.6301 charge= 0.1000 ATOM 4131 HH2 H 265 TRP mhp= 47 0.6301 charge= 0.1000 ATOM 4132 HE1 H 265 TRP mhp= 50 -0.1036 charge= 0.3278 ATOM 4133 N N.2 266 LEU mhp= 72 -0.5113 charge= -0.5985 ATOM 4134 CA C.3 266 LEU mhp= 8 -0.6805 charge= 0.0965 ATOM 4135 C C.2 266 LEU mhp= 40 -0.1002 charge= 0.3983 ATOM 4136 O O.2 266 LEU mhp= 58 -0.0233 charge= -0.3241 ATOM 4137 CB C.3 266 LEU mhp= 2 -1.0120 charge= -0.2000 ATOM 4138 CG C.3 266 LEU mhp= 3 -0.6681 charge= -0.1000 ATOM 4139 CD1 C.3 266 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 4140 CD2 C.3 266 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 4141 H H 266 LEU mhp= 50 -0.1036 charge= 0.3278 ATOM 4142 HA H 266 LEU mhp= 51 0.5234 charge= 0.1000 ATOM 4143 HB2 H 266 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 4144 HB3 H 266 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 4145 HG H 266 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 4146 HD11 H 266 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 4147 HD12 H 266 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 4148 HD13 H 266 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 4149 HD21 H 266 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 4150 HD22 H 266 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 4151 HD23 H 266 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 4152 N N.2 267 PRO mhp= 72 -0.5113 charge= -0.6007 ATOM 4153 CA C.3 267 PRO mhp= 8 -0.6805 charge= 0.1200 ATOM 4154 C C.2 267 PRO mhp= 40 -0.1002 charge= 0.3358 ATOM 4155 O O.2 267 PRO mhp= 58 -0.0233 charge= -0.3800 ATOM 4156 CB C.3 267 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 4157 CG C.3 267 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 4158 CD C.3 267 PRO mhp= 6 -1.2486 charge= 0.0200 ATOM 4159 HA H 267 PRO mhp= 51 0.5234 charge= 0.1000 ATOM 4160 HB2 H 267 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 4161 HB3 H 267 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 4162 HG2 H 267 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 4163 HG3 H 267 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 4164 HD2 H 267 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 4165 HD3 H 267 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 4166 N N.1 268 TYR mhp= 74 0.1349 charge= -0.1758 ATOM 4167 CA C.3 268 TYR mhp= 8 -0.6805 charge= 0.2065 ATOM 4168 C C.2 268 TYR mhp= 40 -0.1002 charge= 0.3983 ATOM 4169 O O.2 268 TYR mhp= 58 -0.0233 charge= -0.3241 ATOM 4170 CB C.3 268 TYR mhp= 2 -1.0120 charge= -0.2000 ATOM 4171 CG C.ar 268 TYR mhp= 25 0.1492 charge= 0.0000 ATOM 4172 CD1 C.ar 268 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 4173 CD2 C.ar 268 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 4174 CE1 C.ar 268 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 4175 CE2 C.ar 268 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 4176 CZ C.ar 268 TYR mhp= 26 0.1539 charge= 0.0300 ATOM 4177 OH O.3 268 TYR mhp= 57 -0.0127 charge= -0.1490 ATOM 4178 HA H 268 TYR mhp= 51 0.5234 charge= 0.1000 ATOM 4179 HB2 H 268 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 4180 HB3 H 268 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 4181 HD1 H 268 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 4182 HD2 H 268 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 4183 HE1 H 268 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 4184 HE2 H 268 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 4185 HH H 268 TYR mhp= 50 -0.1036 charge= 0.1190 ATOM 4186 N N.2 269 ALA mhp= 72 -0.5113 charge= -0.5985 ATOM 4187 CA C.3 269 ALA mhp= 8 -0.6805 charge= 0.0965 ATOM 4188 C C.2 269 ALA mhp= 40 -0.1002 charge= 0.3983 ATOM 4189 O O.2 269 ALA mhp= 58 -0.0233 charge= -0.3241 ATOM 4190 CB C.3 269 ALA mhp= 1 -1.5603 charge= -0.3000 ATOM 4191 H H 269 ALA mhp= 50 -0.1036 charge= 0.3278 ATOM 4192 HA H 269 ALA mhp= 51 0.5234 charge= 0.1000 ATOM 4193 HB1 H 269 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 4194 HB2 H 269 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 4195 HB3 H 269 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 4196 N N.2 270 GLY mhp= 72 -0.5113 charge= -0.5985 ATOM 4197 CA C.3 270 GLY mhp= 6 -1.2486 charge= -0.0035 ATOM 4198 C C.2 270 GLY mhp= 40 -0.1002 charge= 0.3983 ATOM 4199 O O.2 270 GLY mhp= 58 -0.0233 charge= -0.3241 ATOM 4200 H H 270 GLY mhp= 50 -0.1036 charge= 0.3278 ATOM 4201 HA2 H 270 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 4202 HA3 H 270 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 4203 N N.2 271 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 4204 CA C.3 271 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 4205 C C.2 271 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 4206 O O.2 271 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 4207 CB C.3 271 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 4208 CG1 C.3 271 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 4209 CG2 C.3 271 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 4210 H H 271 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 4211 HA H 271 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 4212 HB H 271 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 4213 HG11 H 271 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4214 HG12 H 271 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4215 HG13 H 271 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4216 HG21 H 271 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4217 HG22 H 271 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4218 HG23 H 271 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4219 N N.2 272 ALA mhp= 72 -0.5113 charge= -0.5985 ATOM 4220 CA C.3 272 ALA mhp= 8 -0.6805 charge= 0.0965 ATOM 4221 C C.2 272 ALA mhp= 40 -0.1002 charge= 0.3983 ATOM 4222 O O.2 272 ALA mhp= 58 -0.0233 charge= -0.3241 ATOM 4223 CB C.3 272 ALA mhp= 1 -1.5603 charge= -0.3000 ATOM 4224 H H 272 ALA mhp= 50 -0.1036 charge= 0.3278 ATOM 4225 HA H 272 ALA mhp= 51 0.5234 charge= 0.1000 ATOM 4226 HB1 H 272 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 4227 HB2 H 272 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 4228 HB3 H 272 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 4229 N N.2 273 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 4230 CA C.3 273 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 4231 C C.2 273 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 4232 O O.2 273 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 4233 CB C.3 273 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 4234 CG C.ar 273 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 4235 CD1 C.ar 273 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4236 CD2 C.ar 273 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4237 CE1 C.ar 273 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4238 CE2 C.ar 273 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4239 CZ C.ar 273 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4240 H H 273 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 4241 HA H 273 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 4242 HB2 H 273 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 4243 HB3 H 273 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 4244 HD1 H 273 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4245 HD2 H 273 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4246 HE1 H 273 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4247 HE2 H 273 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4248 HZ H 273 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4249 N N.2 274 TYR mhp= 72 -0.5113 charge= -0.5985 ATOM 4250 CA C.3 274 TYR mhp= 8 -0.6805 charge= 0.0965 ATOM 4251 C C.2 274 TYR mhp= 40 -0.1002 charge= 0.3983 ATOM 4252 O O.2 274 TYR mhp= 58 -0.0233 charge= -0.3241 ATOM 4253 CB C.3 274 TYR mhp= 2 -1.0120 charge= -0.2000 ATOM 4254 CG C.ar 274 TYR mhp= 25 0.1492 charge= 0.0000 ATOM 4255 CD1 C.ar 274 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 4256 CD2 C.ar 274 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 4257 CE1 C.ar 274 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 4258 CE2 C.ar 274 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 4259 CZ C.ar 274 TYR mhp= 26 0.1539 charge= 0.0300 ATOM 4260 OH O.3 274 TYR mhp= 57 -0.0127 charge= -0.1490 ATOM 4261 H H 274 TYR mhp= 50 -0.1036 charge= 0.3278 ATOM 4262 HA H 274 TYR mhp= 51 0.5234 charge= 0.1000 ATOM 4263 HB2 H 274 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 4264 HB3 H 274 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 4265 HD1 H 274 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 4266 HD2 H 274 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 4267 HE1 H 274 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 4268 HE2 H 274 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 4269 HH H 274 TYR mhp= 50 -0.1036 charge= 0.1190 ATOM 4270 N N.2 275 ILE mhp= 72 -0.5113 charge= -0.5985 ATOM 4271 CA C.3 275 ILE mhp= 8 -0.6805 charge= 0.0965 ATOM 4272 C C.2 275 ILE mhp= 40 -0.1002 charge= 0.3983 ATOM 4273 O O.2 275 ILE mhp= 58 -0.0233 charge= -0.3241 ATOM 4274 CB C.3 275 ILE mhp= 3 -0.6681 charge= -0.1000 ATOM 4275 CG1 C.3 275 ILE mhp= 2 -1.0120 charge= -0.2000 ATOM 4276 CG2 C.3 275 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 4277 CD1 C.3 275 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 4278 H H 275 ILE mhp= 50 -0.1036 charge= 0.3278 ATOM 4279 HA H 275 ILE mhp= 51 0.5234 charge= 0.1000 ATOM 4280 HB H 275 ILE mhp= 52 0.6666 charge= 0.1000 ATOM 4281 HG12 H 275 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4282 HG13 H 275 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4283 HG21 H 275 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4284 HG22 H 275 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4285 HG23 H 275 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4286 HD11 H 275 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4287 HD12 H 275 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4288 HD13 H 275 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4289 N N.2 276 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 4290 CA C.3 276 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 4291 C C.2 276 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 4292 O O.2 276 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 4293 CB C.3 276 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 4294 CG C.ar 276 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 4295 CD1 C.ar 276 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4296 CD2 C.ar 276 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4297 CE1 C.ar 276 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4298 CE2 C.ar 276 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4299 CZ C.ar 276 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4300 H H 276 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 4301 HA H 276 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 4302 HB2 H 276 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 4303 HB3 H 276 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 4304 HD1 H 276 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4305 HD2 H 276 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4306 HE1 H 276 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4307 HE2 H 276 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4308 HZ H 276 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4309 N N.2 277 THR mhp= 72 -0.5113 charge= -0.5985 ATOM 4310 CA C.3 277 THR mhp= 8 -0.6805 charge= 0.0965 ATOM 4311 C C.2 277 THR mhp= 40 -0.1002 charge= 0.3983 ATOM 4312 O O.2 277 THR mhp= 58 -0.0233 charge= -0.3241 ATOM 4313 CB C.3 277 THR mhp= 8 -0.6805 charge= -0.0700 ATOM 4314 OG1 O.3 277 THR mhp= 56 -0.3567 charge= -0.1490 ATOM 4315 CG2 C.3 277 THR mhp= 1 -1.5603 charge= -0.3000 ATOM 4316 H H 277 THR mhp= 50 -0.1036 charge= 0.3278 ATOM 4317 HA H 277 THR mhp= 51 0.5234 charge= 0.1000 ATOM 4318 HB H 277 THR mhp= 47 0.6301 charge= 0.1000 ATOM 4319 HG1 H 277 THR mhp= 50 -0.1036 charge= 0.1190 ATOM 4320 HG21 H 277 THR mhp= 52 0.6666 charge= 0.1000 ATOM 4321 HG22 H 277 THR mhp= 52 0.6666 charge= 0.1000 ATOM 4322 HG23 H 277 THR mhp= 52 0.6666 charge= 0.1000 ATOM 4323 N N.2 278 HIS mhp= 72 -0.5113 charge= -0.5985 ATOM 4324 CA C.3 278 HIS mhp= 8 -0.6805 charge= 0.0965 ATOM 4325 C C.2 278 HIS mhp= 40 -0.1002 charge= 0.3983 ATOM 4326 O O.2 278 HIS mhp= 58 -0.0233 charge= -0.3241 ATOM 4327 CB C.3 278 HIS mhp= 2 -1.0120 charge= -0.2000 ATOM 4328 CG C.ar 278 HIS mhp= 28 0.2361 charge= 0.1993 ATOM 4329 ND1 N.ar 278 HIS mhp= 75 -0.1624 charge= -0.3986 ATOM 4330 CD2 C.ar 278 HIS mhp= 33 -0.3723 charge= 0.0693 ATOM 4331 CE1 C.ar 278 HIS mhp= 42 -0.2147 charge= 0.2686 ATOM 4332 NE2 N.ar 278 HIS mhp= 73 0.1259 charge= -0.7264 ATOM 4333 H H 278 HIS mhp= 50 -0.1036 charge= 0.3278 ATOM 4334 HA H 278 HIS mhp= 51 0.5234 charge= 0.1000 ATOM 4335 HB2 H 278 HIS mhp= 51 0.5234 charge= 0.1000 ATOM 4336 HB3 H 278 HIS mhp= 51 0.5234 charge= 0.1000 ATOM 4337 HD2 H 278 HIS mhp= 48 0.5180 charge= 0.1300 ATOM 4338 HE1 H 278 HIS mhp= 49 -0.0371 charge= 0.1300 ATOM 4339 HE2 H 278 HIS mhp= 50 -0.1036 charge= 0.3278 ATOM 4340 N N.2 279 GLN mhp= 72 -0.5113 charge= -0.5985 ATOM 4341 CA C.3 279 GLN mhp= 8 -0.6805 charge= 0.0965 ATOM 4342 C C.2 279 GLN mhp= 40 -0.1002 charge= 0.3983 ATOM 4343 O O.2 279 GLN mhp= 58 -0.0233 charge= -0.3241 ATOM 4344 CB C.3 279 GLN mhp= 2 -1.0120 charge= -0.2000 ATOM 4345 CG C.3 279 GLN mhp= 2 -1.0120 charge= -0.1135 ATOM 4346 CD C.2 279 GLN mhp= 40 -0.1002 charge= 0.3983 ATOM 4347 OE1 O.2 279 GLN mhp= 58 -0.0233 charge= -0.3241 ATOM 4348 NE2 N.2 279 GLN mhp= 72 -0.5113 charge= -0.8163 ATOM 4349 H H 279 GLN mhp= 50 -0.1036 charge= 0.3278 ATOM 4350 HA H 279 GLN mhp= 51 0.5234 charge= 0.1000 ATOM 4351 HB2 H 279 GLN mhp= 52 0.6666 charge= 0.1000 ATOM 4352 HB3 H 279 GLN mhp= 52 0.6666 charge= 0.1000 ATOM 4353 HG2 H 279 GLN mhp= 51 0.5234 charge= 0.1000 ATOM 4354 HG3 H 279 GLN mhp= 51 0.5234 charge= 0.1000 ATOM 4355 HE21 H 279 GLN mhp= 50 -0.1036 charge= 0.3278 ATOM 4356 HE22 H 279 GLN mhp= 50 -0.1036 charge= 0.3278 ATOM 4357 N N.2 280 GLY mhp= 72 -0.5113 charge= -0.5985 ATOM 4358 CA C.3 280 GLY mhp= 6 -1.2486 charge= -0.0035 ATOM 4359 C C.2 280 GLY mhp= 40 -0.1002 charge= 0.3983 ATOM 4360 O O.2 280 GLY mhp= 58 -0.0233 charge= -0.3241 ATOM 4361 H H 280 GLY mhp= 50 -0.1036 charge= 0.3278 ATOM 4362 HA2 H 280 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 4363 HA3 H 280 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 4364 N N.2 281 SER mhp= 72 -0.5113 charge= -0.5985 ATOM 4365 CA C.3 281 SER mhp= 8 -0.6805 charge= 0.0965 ATOM 4366 C C.2 281 SER mhp= 40 -0.1002 charge= 0.3983 ATOM 4367 O O.2 281 SER mhp= 58 -0.0233 charge= -0.3241 ATOM 4368 CB C.3 281 SER mhp= 6 -1.2486 charge= -0.1700 ATOM 4369 OG O.3 281 SER mhp= 56 -0.3567 charge= -0.1490 ATOM 4370 H H 281 SER mhp= 50 -0.1036 charge= 0.3278 ATOM 4371 HA H 281 SER mhp= 51 0.5234 charge= 0.1000 ATOM 4372 HB2 H 281 SER mhp= 47 0.6301 charge= 0.1000 ATOM 4373 HB3 H 281 SER mhp= 47 0.6301 charge= 0.1000 ATOM 4374 HG H 281 SER mhp= 50 -0.1036 charge= 0.1190 ATOM 4375 N N.2 282 ASP mhp= 72 -0.5113 charge= -0.5985 ATOM 4376 CA C.3 282 ASP mhp= 8 -0.6805 charge= 0.0965 ATOM 4377 C C.2 282 ASP mhp= 40 -0.1002 charge= 0.3983 ATOM 4378 O O.2 282 ASP mhp= 58 -0.0233 charge= -0.3241 ATOM 4379 CB C.3 282 ASP mhp= 2 -1.0120 charge= -0.1135 ATOM 4380 CG C.2 282 ASP mhp= 31 0.0901 charge= 0.0535 ATOM 4381 OD1 O.co2 282 ASP mhp= 62 -0.7941 charge= -0.5700 ATOM 4382 OD2 O.co2 282 ASP mhp= 62 -0.7941 charge= -0.5700 ATOM 4383 H H 282 ASP mhp= 50 -0.1036 charge= 0.3278 ATOM 4384 HA H 282 ASP mhp= 51 0.5234 charge= 0.1000 ATOM 4385 HB2 H 282 ASP mhp= 51 0.5234 charge= 0.1000 ATOM 4386 HB3 H 282 ASP mhp= 51 0.5234 charge= 0.1000 ATOM 4387 N N.2 283 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 4388 CA C.3 283 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 4389 C C.2 283 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 4390 O O.2 283 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 4391 CB C.3 283 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 4392 CG C.ar 283 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 4393 CD1 C.ar 283 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4394 CD2 C.ar 283 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4395 CE1 C.ar 283 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4396 CE2 C.ar 283 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4397 CZ C.ar 283 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4398 H H 283 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 4399 HA H 283 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 4400 HB2 H 283 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 4401 HB3 H 283 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 4402 HD1 H 283 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4403 HD2 H 283 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4404 HE1 H 283 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4405 HE2 H 283 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4406 HZ H 283 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4407 N N.2 284 GLY mhp= 72 -0.5113 charge= -0.5985 ATOM 4408 CA C.3 284 GLY mhp= 6 -1.2486 charge= -0.0035 ATOM 4409 C C.2 284 GLY mhp= 40 -0.1002 charge= 0.3983 ATOM 4410 O O.2 284 GLY mhp= 58 -0.0233 charge= -0.3241 ATOM 4411 H H 284 GLY mhp= 50 -0.1036 charge= 0.3278 ATOM 4412 HA2 H 284 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 4413 HA3 H 284 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 4414 N N.2 285 PRO mhp= 72 -0.5113 charge= -0.6007 ATOM 4415 CA C.3 285 PRO mhp= 8 -0.6805 charge= 0.2065 ATOM 4416 C C.2 285 PRO mhp= 40 -0.1002 charge= 0.3983 ATOM 4417 O O.2 285 PRO mhp= 58 -0.0233 charge= -0.3241 ATOM 4418 CB C.3 285 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 4419 CG C.3 285 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 4420 CD C.3 285 PRO mhp= 6 -1.2486 charge= 0.0200 ATOM 4421 HA H 285 PRO mhp= 51 0.5234 charge= 0.1000 ATOM 4422 HB2 H 285 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 4423 HB3 H 285 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 4424 HG2 H 285 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 4425 HG3 H 285 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 4426 HD2 H 285 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 4427 HD3 H 285 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 4428 N N.2 286 ILE mhp= 72 -0.5113 charge= -0.5985 ATOM 4429 CA C.3 286 ILE mhp= 8 -0.6805 charge= 0.0965 ATOM 4430 C C.2 286 ILE mhp= 40 -0.1002 charge= 0.3983 ATOM 4431 O O.2 286 ILE mhp= 58 -0.0233 charge= -0.3241 ATOM 4432 CB C.3 286 ILE mhp= 3 -0.6681 charge= -0.1000 ATOM 4433 CG1 C.3 286 ILE mhp= 2 -1.0120 charge= -0.2000 ATOM 4434 CG2 C.3 286 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 4435 CD1 C.3 286 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 4436 H H 286 ILE mhp= 50 -0.1036 charge= 0.3278 ATOM 4437 HA H 286 ILE mhp= 51 0.5234 charge= 0.1000 ATOM 4438 HB H 286 ILE mhp= 52 0.6666 charge= 0.1000 ATOM 4439 HG12 H 286 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4440 HG13 H 286 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4441 HG21 H 286 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4442 HG22 H 286 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4443 HG23 H 286 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4444 HD11 H 286 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4445 HD12 H 286 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4446 HD13 H 286 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4447 N N.2 287 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 4448 CA C.3 287 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 4449 C C.2 287 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 4450 O O.2 287 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 4451 CB C.3 287 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 4452 CG C.ar 287 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 4453 CD1 C.ar 287 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4454 CD2 C.ar 287 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4455 CE1 C.ar 287 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4456 CE2 C.ar 287 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4457 CZ C.ar 287 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4458 H H 287 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 4459 HA H 287 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 4460 HB2 H 287 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 4461 HB3 H 287 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 4462 HD1 H 287 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4463 HD2 H 287 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4464 HE1 H 287 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4465 HE2 H 287 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4466 HZ H 287 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4467 N N.2 288 MET mhp= 72 -0.5113 charge= -0.5985 ATOM 4468 CA C.3 288 MET mhp= 8 -0.6805 charge= 0.0965 ATOM 4469 C C.2 288 MET mhp= 40 -0.1002 charge= 0.3983 ATOM 4470 O O.2 288 MET mhp= 58 -0.0233 charge= -0.3241 ATOM 4471 CB C.3 288 MET mhp= 2 -1.0120 charge= -0.2000 ATOM 4472 CG C.3 288 MET mhp= 6 -1.2486 charge= -0.2500 ATOM 4473 SD S.3 288 MET mhp= 107 0.5906 charge= 0.1000 ATOM 4474 CE C.3 288 MET mhp= 5 -1.7880 charge= -0.3500 ATOM 4475 H H 288 MET mhp= 50 -0.1036 charge= 0.3278 ATOM 4476 HA H 288 MET mhp= 51 0.5234 charge= 0.1000 ATOM 4477 HB2 H 288 MET mhp= 53 0.5372 charge= 0.1000 ATOM 4478 HB3 H 288 MET mhp= 53 0.5372 charge= 0.1000 ATOM 4479 HG2 H 288 MET mhp= 47 0.6301 charge= 0.1000 ATOM 4480 HG3 H 288 MET mhp= 47 0.6301 charge= 0.1000 ATOM 4481 HE1 H 288 MET mhp= 47 0.6301 charge= 0.1000 ATOM 4482 HE2 H 288 MET mhp= 47 0.6301 charge= 0.1000 ATOM 4483 HE3 H 288 MET mhp= 47 0.6301 charge= 0.1000 ATOM 4484 N N.2 289 THR mhp= 72 -0.5113 charge= -0.5985 ATOM 4485 CA C.3 289 THR mhp= 8 -0.6805 charge= 0.0965 ATOM 4486 C C.2 289 THR mhp= 40 -0.1002 charge= 0.3983 ATOM 4487 O O.2 289 THR mhp= 58 -0.0233 charge= -0.3241 ATOM 4488 CB C.3 289 THR mhp= 8 -0.6805 charge= -0.0700 ATOM 4489 OG1 O.3 289 THR mhp= 56 -0.3567 charge= -0.1490 ATOM 4490 CG2 C.3 289 THR mhp= 1 -1.5603 charge= -0.3000 ATOM 4491 H H 289 THR mhp= 50 -0.1036 charge= 0.3278 ATOM 4492 HA H 289 THR mhp= 51 0.5234 charge= 0.1000 ATOM 4493 HB H 289 THR mhp= 47 0.6301 charge= 0.1000 ATOM 4494 HG1 H 289 THR mhp= 50 -0.1036 charge= 0.1190 ATOM 4495 HG21 H 289 THR mhp= 52 0.6666 charge= 0.1000 ATOM 4496 HG22 H 289 THR mhp= 52 0.6666 charge= 0.1000 ATOM 4497 HG23 H 289 THR mhp= 52 0.6666 charge= 0.1000 ATOM 4498 N N.2 290 ILE mhp= 72 -0.5113 charge= -0.5985 ATOM 4499 CA C.3 290 ILE mhp= 8 -0.6805 charge= 0.0965 ATOM 4500 C C.2 290 ILE mhp= 40 -0.1002 charge= 0.3983 ATOM 4501 O O.2 290 ILE mhp= 58 -0.0233 charge= -0.3241 ATOM 4502 CB C.3 290 ILE mhp= 3 -0.6681 charge= -0.1000 ATOM 4503 CG1 C.3 290 ILE mhp= 2 -1.0120 charge= -0.2000 ATOM 4504 CG2 C.3 290 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 4505 CD1 C.3 290 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 4506 H H 290 ILE mhp= 50 -0.1036 charge= 0.3278 ATOM 4507 HA H 290 ILE mhp= 51 0.5234 charge= 0.1000 ATOM 4508 HB H 290 ILE mhp= 52 0.6666 charge= 0.1000 ATOM 4509 HG12 H 290 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4510 HG13 H 290 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4511 HG21 H 290 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4512 HG22 H 290 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4513 HG23 H 290 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4514 HD11 H 290 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4515 HD12 H 290 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4516 HD13 H 290 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4517 N N.2 291 PRO mhp= 72 -0.5113 charge= -0.6007 ATOM 4518 CA C.3 291 PRO mhp= 8 -0.6805 charge= 0.2065 ATOM 4519 C C.2 291 PRO mhp= 40 -0.1002 charge= 0.3983 ATOM 4520 O O.2 291 PRO mhp= 58 -0.0233 charge= -0.3241 ATOM 4521 CB C.3 291 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 4522 CG C.3 291 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 4523 CD C.3 291 PRO mhp= 6 -1.2486 charge= 0.0200 ATOM 4524 HA H 291 PRO mhp= 51 0.5234 charge= 0.1000 ATOM 4525 HB2 H 291 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 4526 HB3 H 291 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 4527 HG2 H 291 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 4528 HG3 H 291 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 4529 HD2 H 291 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 4530 HD3 H 291 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 4531 N N.2 292 ALA mhp= 72 -0.5113 charge= -0.5985 ATOM 4532 CA C.3 292 ALA mhp= 8 -0.6805 charge= 0.0965 ATOM 4533 C C.2 292 ALA mhp= 40 -0.1002 charge= 0.3983 ATOM 4534 O O.2 292 ALA mhp= 58 -0.0233 charge= -0.3241 ATOM 4535 CB C.3 292 ALA mhp= 1 -1.5603 charge= -0.3000 ATOM 4536 H H 292 ALA mhp= 50 -0.1036 charge= 0.3278 ATOM 4537 HA H 292 ALA mhp= 51 0.5234 charge= 0.1000 ATOM 4538 HB1 H 292 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 4539 HB2 H 292 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 4540 HB3 H 292 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 4541 N N.2 293 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 4542 CA C.3 293 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 4543 C C.2 293 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 4544 O O.2 293 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 4545 CB C.3 293 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 4546 CG C.ar 293 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 4547 CD1 C.ar 293 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4548 CD2 C.ar 293 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4549 CE1 C.ar 293 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4550 CE2 C.ar 293 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4551 CZ C.ar 293 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4552 H H 293 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 4553 HA H 293 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 4554 HB2 H 293 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 4555 HB3 H 293 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 4556 HD1 H 293 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4557 HD2 H 293 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4558 HE1 H 293 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4559 HE2 H 293 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4560 HZ H 293 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4561 N N.2 294 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 4562 CA C.3 294 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 4563 C C.2 294 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 4564 O O.2 294 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 4565 CB C.3 294 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 4566 CG C.ar 294 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 4567 CD1 C.ar 294 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4568 CD2 C.ar 294 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4569 CE1 C.ar 294 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4570 CE2 C.ar 294 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4571 CZ C.ar 294 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4572 H H 294 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 4573 HA H 294 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 4574 HB2 H 294 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 4575 HB3 H 294 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 4576 HD1 H 294 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4577 HD2 H 294 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4578 HE1 H 294 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4579 HE2 H 294 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4580 HZ H 294 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4581 N N.2 295 ALA mhp= 72 -0.5113 charge= -0.5985 ATOM 4582 CA C.3 295 ALA mhp= 8 -0.6805 charge= 0.0965 ATOM 4583 C C.2 295 ALA mhp= 40 -0.1002 charge= 0.3983 ATOM 4584 O O.2 295 ALA mhp= 58 -0.0233 charge= -0.3241 ATOM 4585 CB C.3 295 ALA mhp= 1 -1.5603 charge= -0.3000 ATOM 4586 H H 295 ALA mhp= 50 -0.1036 charge= 0.3278 ATOM 4587 HA H 295 ALA mhp= 51 0.5234 charge= 0.1000 ATOM 4588 HB1 H 295 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 4589 HB2 H 295 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 4590 HB3 H 295 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 4591 N N.2 296 LYS mhp= 72 -0.5113 charge= -0.5985 ATOM 4592 CA C.3 296 LYS mhp= 8 -0.6805 charge= 0.0965 ATOM 4593 C C.2 296 LYS mhp= 40 -0.1002 charge= 0.3983 ATOM 4594 O O.2 296 LYS mhp= 58 -0.0233 charge= -0.3241 ATOM 4595 CB C.3 296 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 4596 CG C.3 296 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 4597 CD C.3 296 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 4598 CE C.3 296 LYS mhp= 6 -1.2486 charge= 0.0200 ATOM 4599 NZ N.3 296 LYS mhp= 66 -0.5427 charge= -0.6972 ATOM 4600 H H 296 LYS mhp= 50 -0.1036 charge= 0.3278 ATOM 4601 HA H 296 LYS mhp= 51 0.5234 charge= 0.1000 ATOM 4602 HB2 H 296 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 4603 HB3 H 296 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 4604 HG2 H 296 LYS mhp= 46 0.7341 charge= 0.1000 ATOM 4605 HG3 H 296 LYS mhp= 46 0.7341 charge= 0.1000 ATOM 4606 HD2 H 296 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 4607 HD3 H 296 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 4608 HE2 H 296 LYS mhp= 47 0.6301 charge= 0.1000 ATOM 4609 HE3 H 296 LYS mhp= 47 0.6301 charge= 0.1000 ATOM 4610 HZ2 H 296 LYS mhp= 50 -0.1036 charge= 0.2386 ATOM 4611 HZ3 H 296 LYS mhp= 50 -0.1036 charge= 0.2386 ATOM 4612 N N.2 297 THR mhp= 72 -0.5113 charge= -0.5985 ATOM 4613 CA C.3 297 THR mhp= 8 -0.6805 charge= 0.0965 ATOM 4614 C C.2 297 THR mhp= 40 -0.1002 charge= 0.3983 ATOM 4615 O O.2 297 THR mhp= 58 -0.0233 charge= -0.3241 ATOM 4616 CB C.3 297 THR mhp= 8 -0.6805 charge= -0.0700 ATOM 4617 OG1 O.3 297 THR mhp= 56 -0.3567 charge= -0.1490 ATOM 4618 CG2 C.3 297 THR mhp= 1 -1.5603 charge= -0.3000 ATOM 4619 H H 297 THR mhp= 50 -0.1036 charge= 0.3278 ATOM 4620 HA H 297 THR mhp= 51 0.5234 charge= 0.1000 ATOM 4621 HB H 297 THR mhp= 47 0.6301 charge= 0.1000 ATOM 4622 HG1 H 297 THR mhp= 50 -0.1036 charge= 0.1190 ATOM 4623 HG21 H 297 THR mhp= 52 0.6666 charge= 0.1000 ATOM 4624 HG22 H 297 THR mhp= 52 0.6666 charge= 0.1000 ATOM 4625 HG23 H 297 THR mhp= 52 0.6666 charge= 0.1000 ATOM 4626 N N.2 298 SER mhp= 72 -0.5113 charge= -0.5985 ATOM 4627 CA C.3 298 SER mhp= 8 -0.6805 charge= 0.0965 ATOM 4628 C C.2 298 SER mhp= 40 -0.1002 charge= 0.3983 ATOM 4629 O O.2 298 SER mhp= 58 -0.0233 charge= -0.3241 ATOM 4630 CB C.3 298 SER mhp= 6 -1.2486 charge= -0.1700 ATOM 4631 OG O.3 298 SER mhp= 56 -0.3567 charge= -0.1490 ATOM 4632 H H 298 SER mhp= 50 -0.1036 charge= 0.3278 ATOM 4633 HA H 298 SER mhp= 51 0.5234 charge= 0.1000 ATOM 4634 HB2 H 298 SER mhp= 47 0.6301 charge= 0.1000 ATOM 4635 HB3 H 298 SER mhp= 47 0.6301 charge= 0.1000 ATOM 4636 HG H 298 SER mhp= 50 -0.1036 charge= 0.1190 ATOM 4637 N N.2 299 ALA mhp= 72 -0.5113 charge= -0.5985 ATOM 4638 CA C.3 299 ALA mhp= 8 -0.6805 charge= 0.0965 ATOM 4639 C C.2 299 ALA mhp= 40 -0.1002 charge= 0.3983 ATOM 4640 O O.2 299 ALA mhp= 58 -0.0233 charge= -0.3241 ATOM 4641 CB C.3 299 ALA mhp= 1 -1.5603 charge= -0.3000 ATOM 4642 H H 299 ALA mhp= 50 -0.1036 charge= 0.3278 ATOM 4643 HA H 299 ALA mhp= 51 0.5234 charge= 0.1000 ATOM 4644 HB1 H 299 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 4645 HB2 H 299 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 4646 HB3 H 299 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 4647 N N.2 300 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 4648 CA C.3 300 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 4649 C C.2 300 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 4650 O O.2 300 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 4651 CB C.3 300 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 4652 CG1 C.3 300 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 4653 CG2 C.3 300 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 4654 H H 300 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 4655 HA H 300 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 4656 HB H 300 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 4657 HG11 H 300 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4658 HG12 H 300 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4659 HG13 H 300 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4660 HG21 H 300 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4661 HG22 H 300 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4662 HG23 H 300 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4663 N N.2 301 TYR mhp= 72 -0.5113 charge= -0.5985 ATOM 4664 CA C.3 301 TYR mhp= 8 -0.6805 charge= 0.0965 ATOM 4665 C C.2 301 TYR mhp= 40 -0.1002 charge= 0.3983 ATOM 4666 O O.2 301 TYR mhp= 58 -0.0233 charge= -0.3241 ATOM 4667 CB C.3 301 TYR mhp= 2 -1.0120 charge= -0.2000 ATOM 4668 CG C.ar 301 TYR mhp= 25 0.1492 charge= 0.0000 ATOM 4669 CD1 C.ar 301 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 4670 CD2 C.ar 301 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 4671 CE1 C.ar 301 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 4672 CE2 C.ar 301 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 4673 CZ C.ar 301 TYR mhp= 26 0.1539 charge= 0.0300 ATOM 4674 OH O.3 301 TYR mhp= 57 -0.0127 charge= -0.1490 ATOM 4675 H H 301 TYR mhp= 50 -0.1036 charge= 0.3278 ATOM 4676 HA H 301 TYR mhp= 51 0.5234 charge= 0.1000 ATOM 4677 HB2 H 301 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 4678 HB3 H 301 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 4679 HD1 H 301 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 4680 HD2 H 301 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 4681 HE1 H 301 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 4682 HE2 H 301 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 4683 HH H 301 TYR mhp= 50 -0.1036 charge= 0.1190 ATOM 4684 N N.2 302 ASN mhp= 72 -0.5113 charge= -0.5985 ATOM 4685 CA C.3 302 ASN mhp= 8 -0.6805 charge= 0.0965 ATOM 4686 C C.2 302 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 4687 O O.2 302 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 4688 CB C.3 302 ASN mhp= 2 -1.0120 charge= -0.1135 ATOM 4689 CG C.2 302 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 4690 OD1 O.2 302 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 4691 ND2 N.2 302 ASN mhp= 72 -0.5113 charge= -0.8163 ATOM 4692 H H 302 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 4693 HA H 302 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 4694 HB2 H 302 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 4695 HB3 H 302 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 4696 HD21 H 302 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 4697 HD22 H 302 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 4698 N N.2 303 PRO mhp= 72 -0.5113 charge= -0.6007 ATOM 4699 CA C.3 303 PRO mhp= 8 -0.6805 charge= 0.2065 ATOM 4700 C C.2 303 PRO mhp= 40 -0.1002 charge= 0.3983 ATOM 4701 O O.2 303 PRO mhp= 58 -0.0233 charge= -0.3241 ATOM 4702 CB C.3 303 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 4703 CG C.3 303 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 4704 CD C.3 303 PRO mhp= 6 -1.2486 charge= 0.0200 ATOM 4705 HA H 303 PRO mhp= 51 0.5234 charge= 0.1000 ATOM 4706 HB2 H 303 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 4707 HB3 H 303 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 4708 HG2 H 303 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 4709 HG3 H 303 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 4710 HD2 H 303 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 4711 HD3 H 303 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 4712 N N.2 304 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 4713 CA C.3 304 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 4714 C C.2 304 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 4715 O O.2 304 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 4716 CB C.3 304 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 4717 CG1 C.3 304 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 4718 CG2 C.3 304 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 4719 H H 304 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 4720 HA H 304 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 4721 HB H 304 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 4722 HG11 H 304 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4723 HG12 H 304 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4724 HG13 H 304 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4725 HG21 H 304 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4726 HG22 H 304 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4727 HG23 H 304 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4728 N N.2 305 ILE mhp= 72 -0.5113 charge= -0.5985 ATOM 4729 CA C.3 305 ILE mhp= 8 -0.6805 charge= 0.0965 ATOM 4730 C C.2 305 ILE mhp= 40 -0.1002 charge= 0.3983 ATOM 4731 O O.2 305 ILE mhp= 58 -0.0233 charge= -0.3241 ATOM 4732 CB C.3 305 ILE mhp= 3 -0.6681 charge= -0.1000 ATOM 4733 CG1 C.3 305 ILE mhp= 2 -1.0120 charge= -0.2000 ATOM 4734 CG2 C.3 305 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 4735 CD1 C.3 305 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 4736 H H 305 ILE mhp= 50 -0.1036 charge= 0.3278 ATOM 4737 HA H 305 ILE mhp= 51 0.5234 charge= 0.1000 ATOM 4738 HB H 305 ILE mhp= 52 0.6666 charge= 0.1000 ATOM 4739 HG12 H 305 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4740 HG13 H 305 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4741 HG21 H 305 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4742 HG22 H 305 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4743 HG23 H 305 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4744 HD11 H 305 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4745 HD12 H 305 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4746 HD13 H 305 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4747 N N.2 306 TYR mhp= 72 -0.5113 charge= -0.5985 ATOM 4748 CA C.3 306 TYR mhp= 8 -0.6805 charge= 0.0965 ATOM 4749 C C.2 306 TYR mhp= 40 -0.1002 charge= 0.3983 ATOM 4750 O O.2 306 TYR mhp= 58 -0.0233 charge= -0.3241 ATOM 4751 CB C.3 306 TYR mhp= 2 -1.0120 charge= -0.2000 ATOM 4752 CG C.ar 306 TYR mhp= 25 0.1492 charge= 0.0000 ATOM 4753 CD1 C.ar 306 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 4754 CD2 C.ar 306 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 4755 CE1 C.ar 306 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 4756 CE2 C.ar 306 TYR mhp= 24 -0.3251 charge= -0.1000 ATOM 4757 CZ C.ar 306 TYR mhp= 26 0.1539 charge= 0.0300 ATOM 4758 OH O.3 306 TYR mhp= 57 -0.0127 charge= -0.1490 ATOM 4759 H H 306 TYR mhp= 50 -0.1036 charge= 0.3278 ATOM 4760 HA H 306 TYR mhp= 51 0.5234 charge= 0.1000 ATOM 4761 HB2 H 306 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 4762 HB3 H 306 TYR mhp= 52 0.6666 charge= 0.1000 ATOM 4763 HD1 H 306 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 4764 HD2 H 306 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 4765 HE1 H 306 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 4766 HE2 H 306 TYR mhp= 47 0.6301 charge= 0.1000 ATOM 4767 HH H 306 TYR mhp= 50 -0.1036 charge= 0.1190 ATOM 4768 N N.2 307 ILE mhp= 72 -0.5113 charge= -0.5985 ATOM 4769 CA C.3 307 ILE mhp= 8 -0.6805 charge= 0.0965 ATOM 4770 C C.2 307 ILE mhp= 40 -0.1002 charge= 0.3983 ATOM 4771 O O.2 307 ILE mhp= 58 -0.0233 charge= -0.3241 ATOM 4772 CB C.3 307 ILE mhp= 3 -0.6681 charge= -0.1000 ATOM 4773 CG1 C.3 307 ILE mhp= 2 -1.0120 charge= -0.2000 ATOM 4774 CG2 C.3 307 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 4775 CD1 C.3 307 ILE mhp= 1 -1.5603 charge= -0.3000 ATOM 4776 H H 307 ILE mhp= 50 -0.1036 charge= 0.3278 ATOM 4777 HA H 307 ILE mhp= 51 0.5234 charge= 0.1000 ATOM 4778 HB H 307 ILE mhp= 52 0.6666 charge= 0.1000 ATOM 4779 HG12 H 307 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4780 HG13 H 307 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4781 HG21 H 307 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4782 HG22 H 307 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4783 HG23 H 307 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4784 HD11 H 307 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4785 HD12 H 307 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4786 HD13 H 307 ILE mhp= 46 0.7341 charge= 0.1000 ATOM 4787 N N.2 308 MET mhp= 72 -0.5113 charge= -0.5985 ATOM 4788 CA C.3 308 MET mhp= 8 -0.6805 charge= 0.0965 ATOM 4789 C C.2 308 MET mhp= 40 -0.1002 charge= 0.3983 ATOM 4790 O O.2 308 MET mhp= 58 -0.0233 charge= -0.3241 ATOM 4791 CB C.3 308 MET mhp= 2 -1.0120 charge= -0.2000 ATOM 4792 CG C.3 308 MET mhp= 6 -1.2486 charge= -0.2500 ATOM 4793 SD S.3 308 MET mhp= 107 0.5906 charge= 0.1000 ATOM 4794 CE C.3 308 MET mhp= 5 -1.7880 charge= -0.3500 ATOM 4795 H H 308 MET mhp= 50 -0.1036 charge= 0.3278 ATOM 4796 HA H 308 MET mhp= 51 0.5234 charge= 0.1000 ATOM 4797 HB2 H 308 MET mhp= 53 0.5372 charge= 0.1000 ATOM 4798 HB3 H 308 MET mhp= 53 0.5372 charge= 0.1000 ATOM 4799 HG2 H 308 MET mhp= 47 0.6301 charge= 0.1000 ATOM 4800 HG3 H 308 MET mhp= 47 0.6301 charge= 0.1000 ATOM 4801 HE1 H 308 MET mhp= 47 0.6301 charge= 0.1000 ATOM 4802 HE2 H 308 MET mhp= 47 0.6301 charge= 0.1000 ATOM 4803 HE3 H 308 MET mhp= 47 0.6301 charge= 0.1000 ATOM 4804 N N.2 309 MET mhp= 72 -0.5113 charge= -0.5985 ATOM 4805 CA C.3 309 MET mhp= 8 -0.6805 charge= 0.0965 ATOM 4806 C C.2 309 MET mhp= 40 -0.1002 charge= 0.3983 ATOM 4807 O O.2 309 MET mhp= 58 -0.0233 charge= -0.3241 ATOM 4808 CB C.3 309 MET mhp= 2 -1.0120 charge= -0.2000 ATOM 4809 CG C.3 309 MET mhp= 6 -1.2486 charge= -0.2500 ATOM 4810 SD S.3 309 MET mhp= 107 0.5906 charge= 0.1000 ATOM 4811 CE C.3 309 MET mhp= 5 -1.7880 charge= -0.3500 ATOM 4812 H H 309 MET mhp= 50 -0.1036 charge= 0.3278 ATOM 4813 HA H 309 MET mhp= 51 0.5234 charge= 0.1000 ATOM 4814 HB2 H 309 MET mhp= 53 0.5372 charge= 0.1000 ATOM 4815 HB3 H 309 MET mhp= 53 0.5372 charge= 0.1000 ATOM 4816 HG2 H 309 MET mhp= 47 0.6301 charge= 0.1000 ATOM 4817 HG3 H 309 MET mhp= 47 0.6301 charge= 0.1000 ATOM 4818 HE1 H 309 MET mhp= 47 0.6301 charge= 0.1000 ATOM 4819 HE2 H 309 MET mhp= 47 0.6301 charge= 0.1000 ATOM 4820 HE3 H 309 MET mhp= 47 0.6301 charge= 0.1000 ATOM 4821 N N.2 310 ASN mhp= 72 -0.5113 charge= -0.5985 ATOM 4822 CA C.3 310 ASN mhp= 8 -0.6805 charge= 0.0965 ATOM 4823 C C.2 310 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 4824 O O.2 310 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 4825 CB C.3 310 ASN mhp= 2 -1.0120 charge= -0.1135 ATOM 4826 CG C.2 310 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 4827 OD1 O.2 310 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 4828 ND2 N.2 310 ASN mhp= 72 -0.5113 charge= -0.8163 ATOM 4829 H H 310 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 4830 HA H 310 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 4831 HB2 H 310 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 4832 HB3 H 310 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 4833 HD21 H 310 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 4834 HD22 H 310 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 4835 N N.2 311 LYS mhp= 72 -0.5113 charge= -0.5985 ATOM 4836 CA C.3 311 LYS mhp= 8 -0.6805 charge= 0.0965 ATOM 4837 C C.2 311 LYS mhp= 40 -0.1002 charge= 0.3983 ATOM 4838 O O.2 311 LYS mhp= 58 -0.0233 charge= -0.3241 ATOM 4839 CB C.3 311 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 4840 CG C.3 311 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 4841 CD C.3 311 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 4842 CE C.3 311 LYS mhp= 6 -1.2486 charge= -0.0900 ATOM 4843 NZ N.2 311 LYS mhp= 66 -0.5427 charge= -0.7656 ATOM 4844 H H 311 LYS mhp= 50 -0.1036 charge= 0.3278 ATOM 4845 HA H 311 LYS mhp= 51 0.5234 charge= 0.1000 ATOM 4846 HB2 H 311 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 4847 HB3 H 311 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 4848 HG2 H 311 LYS mhp= 46 0.7341 charge= 0.1000 ATOM 4849 HG3 H 311 LYS mhp= 46 0.7341 charge= 0.1000 ATOM 4850 HD2 H 311 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 4851 HD3 H 311 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 4852 HE2 H 311 LYS mhp= 47 0.6301 charge= 0.1000 ATOM 4853 HE3 H 311 LYS mhp= 47 0.6301 charge= 0.1000 ATOM 4854 HZ1 H 311 LYS mhp= 50 -0.1036 charge= 0.3278 ATOM 4855 HZ2 H 311 LYS mhp= 50 -0.1036 charge= 0.3278 ATOM 4856 N N.2 312 GLN mhp= 72 -0.5113 charge= -0.5985 ATOM 4857 CA C.3 312 GLN mhp= 8 -0.6805 charge= 0.0965 ATOM 4858 C C.2 312 GLN mhp= 40 -0.1002 charge= 0.3983 ATOM 4859 O O.2 312 GLN mhp= 58 -0.0233 charge= -0.3241 ATOM 4860 CB C.3 312 GLN mhp= 2 -1.0120 charge= -0.2000 ATOM 4861 CG C.3 312 GLN mhp= 2 -1.0120 charge= -0.1135 ATOM 4862 CD C.2 312 GLN mhp= 40 -0.1002 charge= 0.3983 ATOM 4863 OE1 O.2 312 GLN mhp= 58 -0.0233 charge= -0.3241 ATOM 4864 NE2 N.2 312 GLN mhp= 72 -0.5113 charge= -0.8163 ATOM 4865 H H 312 GLN mhp= 50 -0.1036 charge= 0.3278 ATOM 4866 HA H 312 GLN mhp= 51 0.5234 charge= 0.1000 ATOM 4867 HB2 H 312 GLN mhp= 52 0.6666 charge= 0.1000 ATOM 4868 HB3 H 312 GLN mhp= 52 0.6666 charge= 0.1000 ATOM 4869 HG2 H 312 GLN mhp= 51 0.5234 charge= 0.1000 ATOM 4870 HG3 H 312 GLN mhp= 51 0.5234 charge= 0.1000 ATOM 4871 HE21 H 312 GLN mhp= 50 -0.1036 charge= 0.3278 ATOM 4872 HE22 H 312 GLN mhp= 50 -0.1036 charge= 0.3278 ATOM 4873 N N.2 313 PHE mhp= 72 -0.5113 charge= -0.5985 ATOM 4874 CA C.3 313 PHE mhp= 8 -0.6805 charge= 0.0965 ATOM 4875 C C.2 313 PHE mhp= 40 -0.1002 charge= 0.3983 ATOM 4876 O O.2 313 PHE mhp= 58 -0.0233 charge= -0.3241 ATOM 4877 CB C.3 313 PHE mhp= 2 -1.0120 charge= -0.2000 ATOM 4878 CG C.ar 313 PHE mhp= 25 0.1492 charge= 0.0000 ATOM 4879 CD1 C.ar 313 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4880 CD2 C.ar 313 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4881 CE1 C.ar 313 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4882 CE2 C.ar 313 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4883 CZ C.ar 313 PHE mhp= 24 -0.3251 charge= -0.1000 ATOM 4884 H H 313 PHE mhp= 50 -0.1036 charge= 0.3278 ATOM 4885 HA H 313 PHE mhp= 51 0.5234 charge= 0.1000 ATOM 4886 HB2 H 313 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 4887 HB3 H 313 PHE mhp= 52 0.6666 charge= 0.1000 ATOM 4888 HD1 H 313 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4889 HD2 H 313 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4890 HE1 H 313 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4891 HE2 H 313 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4892 HZ H 313 PHE mhp= 47 0.6301 charge= 0.1000 ATOM 4893 N N.2 314 ARG mhp= 72 -0.5113 charge= -0.5985 ATOM 4894 CA C.3 314 ARG mhp= 8 -0.6805 charge= 0.0965 ATOM 4895 C C.2 314 ARG mhp= 40 -0.1002 charge= 0.3983 ATOM 4896 O O.2 314 ARG mhp= 58 -0.0233 charge= -0.3241 ATOM 4897 CB C.3 314 ARG mhp= 2 -1.0120 charge= -0.2000 ATOM 4898 CG C.3 314 ARG mhp= 2 -1.0120 charge= -0.2000 ATOM 4899 CD C.3 314 ARG mhp= 6 -1.2486 charge= -0.0900 ATOM 4900 NE N.2 314 ARG mhp= 79 -1.4439 charge= 0.0622 ATOM 4901 CZ C.cat 314 ARG mhp= 32 0.5142 charge= -0.5000 ATOM 4902 NH1 N.3 314 ARG mhp= 79 -1.4439 charge= -0.1556 ATOM 4903 NH2 N.3 314 ARG mhp= 79 -1.4439 charge= -0.1556 ATOM 4904 H H 314 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 4905 HA H 314 ARG mhp= 51 0.5234 charge= 0.1000 ATOM 4906 HB2 H 314 ARG mhp= 52 0.6666 charge= 0.1000 ATOM 4907 HB3 H 314 ARG mhp= 52 0.6666 charge= 0.1000 ATOM 4908 HG2 H 314 ARG mhp= 52 0.6666 charge= 0.1000 ATOM 4909 HG3 H 314 ARG mhp= 52 0.6666 charge= 0.1000 ATOM 4910 HD2 H 314 ARG mhp= 47 0.6301 charge= 0.1000 ATOM 4911 HD3 H 314 ARG mhp= 47 0.6301 charge= 0.1000 ATOM 4912 HE H 314 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 4913 HH11 H 314 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 4914 HH12 H 314 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 4915 HH21 H 314 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 4916 HH22 H 314 ARG mhp= 50 -0.1036 charge= 0.3278 ATOM 4917 N N.2 315 ASN mhp= 72 -0.5113 charge= -0.5985 ATOM 4918 CA C.3 315 ASN mhp= 8 -0.6805 charge= 0.0965 ATOM 4919 C C.2 315 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 4920 O O.2 315 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 4921 CB C.3 315 ASN mhp= 2 -1.0120 charge= -0.1135 ATOM 4922 CG C.2 315 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 4923 OD1 O.2 315 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 4924 ND2 N.2 315 ASN mhp= 72 -0.5113 charge= -0.8163 ATOM 4925 H H 315 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 4926 HA H 315 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 4927 HB2 H 315 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 4928 HB3 H 315 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 4929 HD21 H 315 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 4930 HD22 H 315 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 4931 N N.2 316 CYS mhp= 72 -0.5113 charge= -0.5985 ATOM 4932 CA C.3 316 CYS mhp= 8 -0.6805 charge= 0.0965 ATOM 4933 C C.2 316 CYS mhp= 40 -0.1002 charge= 0.3983 ATOM 4934 O O.2 316 CYS mhp= 58 -0.0233 charge= -0.3241 ATOM 4935 CB C.3 316 CYS mhp= 6 -1.2486 charge= -0.3000 ATOM 4936 SG S.3 316 CYS mhp= 106 0.6146 charge= 0.0213 ATOM 4937 H H 316 CYS mhp= 50 -0.1036 charge= 0.3278 ATOM 4938 HA H 316 CYS mhp= 51 0.5234 charge= 0.1000 ATOM 4939 HB2 H 316 CYS mhp= 47 0.6301 charge= 0.1000 ATOM 4940 HB3 H 316 CYS mhp= 47 0.6301 charge= 0.1000 ATOM 4941 HG H 316 CYS mhp= 50 -0.1036 charge= 0.0787 ATOM 4942 N N.2 317 MET mhp= 72 -0.5113 charge= -0.5985 ATOM 4943 CA C.3 317 MET mhp= 8 -0.6805 charge= 0.0965 ATOM 4944 C C.2 317 MET mhp= 40 -0.1002 charge= 0.3983 ATOM 4945 O O.2 317 MET mhp= 58 -0.0233 charge= -0.3241 ATOM 4946 CB C.3 317 MET mhp= 2 -1.0120 charge= -0.2000 ATOM 4947 CG C.3 317 MET mhp= 6 -1.2486 charge= -0.2500 ATOM 4948 SD S.3 317 MET mhp= 107 0.5906 charge= 0.1000 ATOM 4949 CE C.3 317 MET mhp= 5 -1.7880 charge= -0.3500 ATOM 4950 H H 317 MET mhp= 50 -0.1036 charge= 0.3278 ATOM 4951 HA H 317 MET mhp= 51 0.5234 charge= 0.1000 ATOM 4952 HB2 H 317 MET mhp= 53 0.5372 charge= 0.1000 ATOM 4953 HB3 H 317 MET mhp= 53 0.5372 charge= 0.1000 ATOM 4954 HG2 H 317 MET mhp= 47 0.6301 charge= 0.1000 ATOM 4955 HG3 H 317 MET mhp= 47 0.6301 charge= 0.1000 ATOM 4956 HE1 H 317 MET mhp= 47 0.6301 charge= 0.1000 ATOM 4957 HE2 H 317 MET mhp= 47 0.6301 charge= 0.1000 ATOM 4958 HE3 H 317 MET mhp= 47 0.6301 charge= 0.1000 ATOM 4959 N N.2 318 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 4960 CA C.3 318 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 4961 C C.2 318 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 4962 O O.2 318 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 4963 CB C.3 318 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 4964 CG1 C.3 318 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 4965 CG2 C.3 318 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 4966 H H 318 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 4967 HA H 318 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 4968 HB H 318 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 4969 HG11 H 318 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4970 HG12 H 318 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4971 HG13 H 318 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4972 HG21 H 318 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4973 HG22 H 318 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4974 HG23 H 318 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 4975 N N.2 319 THR mhp= 72 -0.5113 charge= -0.5985 ATOM 4976 CA C.3 319 THR mhp= 8 -0.6805 charge= 0.0965 ATOM 4977 C C.2 319 THR mhp= 40 -0.1002 charge= 0.3983 ATOM 4978 O O.2 319 THR mhp= 58 -0.0233 charge= -0.3241 ATOM 4979 CB C.3 319 THR mhp= 8 -0.6805 charge= -0.0700 ATOM 4980 OG1 O.3 319 THR mhp= 56 -0.3567 charge= -0.1490 ATOM 4981 CG2 C.3 319 THR mhp= 1 -1.5603 charge= -0.3000 ATOM 4982 H H 319 THR mhp= 50 -0.1036 charge= 0.3278 ATOM 4983 HA H 319 THR mhp= 51 0.5234 charge= 0.1000 ATOM 4984 HB H 319 THR mhp= 47 0.6301 charge= 0.1000 ATOM 4985 HG21 H 319 THR mhp= 52 0.6666 charge= 0.1000 ATOM 4986 HG22 H 319 THR mhp= 52 0.6666 charge= 0.1000 ATOM 4987 HG23 H 319 THR mhp= 52 0.6666 charge= 0.1000 ATOM 4988 HG1 H 319 THR mhp= 50 -0.1036 charge= 0.1190 ATOM 4989 N N.2 320 THR mhp= 72 -0.5113 charge= -0.5985 ATOM 4990 CA C.3 320 THR mhp= 8 -0.6805 charge= 0.0965 ATOM 4991 C C.2 320 THR mhp= 40 -0.1002 charge= 0.3983 ATOM 4992 O O.2 320 THR mhp= 58 -0.0233 charge= -0.3241 ATOM 4993 CB C.3 320 THR mhp= 8 -0.6805 charge= -0.0700 ATOM 4994 OG1 O.3 320 THR mhp= 56 -0.3567 charge= -0.1490 ATOM 4995 CG2 C.3 320 THR mhp= 1 -1.5603 charge= -0.3000 ATOM 4996 H H 320 THR mhp= 50 -0.1036 charge= 0.3278 ATOM 4997 HA H 320 THR mhp= 51 0.5234 charge= 0.1000 ATOM 4998 HB H 320 THR mhp= 47 0.6301 charge= 0.1000 ATOM 4999 HG1 H 320 THR mhp= 50 -0.1036 charge= 0.1190 ATOM 5000 HG21 H 320 THR mhp= 52 0.6666 charge= 0.1000 ATOM 5001 HG22 H 320 THR mhp= 52 0.6666 charge= 0.1000 ATOM 5002 HG23 H 320 THR mhp= 52 0.6666 charge= 0.1000 ATOM 5003 N N.2 321 LEU mhp= 72 -0.5113 charge= -0.5985 ATOM 5004 CA C.3 321 LEU mhp= 8 -0.6805 charge= 0.0965 ATOM 5005 C C.2 321 LEU mhp= 40 -0.1002 charge= 0.3983 ATOM 5006 O O.2 321 LEU mhp= 58 -0.0233 charge= -0.3241 ATOM 5007 CB C.3 321 LEU mhp= 2 -1.0120 charge= -0.2000 ATOM 5008 CG C.3 321 LEU mhp= 3 -0.6681 charge= -0.1000 ATOM 5009 CD1 C.3 321 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 5010 CD2 C.3 321 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 5011 H H 321 LEU mhp= 50 -0.1036 charge= 0.3278 ATOM 5012 HA H 321 LEU mhp= 51 0.5234 charge= 0.1000 ATOM 5013 HB2 H 321 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 5014 HB3 H 321 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 5015 HG H 321 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 5016 HD21 H 321 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 5017 HD22 H 321 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 5018 HD23 H 321 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 5019 HD11 H 321 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 5020 HD12 H 321 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 5021 HD13 H 321 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 5022 N N.2 322 CYS mhp= 72 -0.5113 charge= -0.5985 ATOM 5023 CA C.3 322 CYS mhp= 8 -0.6805 charge= 0.0965 ATOM 5024 C C.2 322 CYS mhp= 40 -0.1002 charge= 0.3983 ATOM 5025 O O.2 322 CYS mhp= 58 -0.0233 charge= -0.3241 ATOM 5026 CB C.3 322 CYS mhp= 6 -1.2486 charge= -0.3000 ATOM 5027 SG S.3 322 CYS mhp= 106 0.6146 charge= 0.0213 ATOM 5028 H H 322 CYS mhp= 50 -0.1036 charge= 0.3278 ATOM 5029 HA H 322 CYS mhp= 51 0.5234 charge= 0.1000 ATOM 5030 HB2 H 322 CYS mhp= 47 0.6301 charge= 0.1000 ATOM 5031 HB3 H 322 CYS mhp= 47 0.6301 charge= 0.1000 ATOM 5032 HG H 322 CYS mhp= 50 -0.1036 charge= 0.0787 ATOM 5033 N N.2 323 CYS mhp= 72 -0.5113 charge= -0.5985 ATOM 5034 CA C.3 323 CYS mhp= 8 -0.6805 charge= 0.0965 ATOM 5035 C C.2 323 CYS mhp= 40 -0.1002 charge= 0.3983 ATOM 5036 O O.2 323 CYS mhp= 58 -0.0233 charge= -0.3241 ATOM 5037 CB C.3 323 CYS mhp= 6 -1.2486 charge= -0.3000 ATOM 5038 SG S.3 323 CYS mhp= 106 0.6146 charge= 0.0213 ATOM 5039 H H 323 CYS mhp= 50 -0.1036 charge= 0.3278 ATOM 5040 HA H 323 CYS mhp= 51 0.5234 charge= 0.1000 ATOM 5041 HB2 H 323 CYS mhp= 47 0.6301 charge= 0.1000 ATOM 5042 HB3 H 323 CYS mhp= 47 0.6301 charge= 0.1000 ATOM 5043 HG H 323 CYS mhp= 50 -0.1036 charge= 0.0787 ATOM 5044 N N.2 324 GLY mhp= 72 -0.5113 charge= -0.5985 ATOM 5045 CA C.3 324 GLY mhp= 6 -1.2486 charge= -0.0035 ATOM 5046 C C.2 324 GLY mhp= 40 -0.1002 charge= 0.3983 ATOM 5047 O O.2 324 GLY mhp= 58 -0.0233 charge= -0.3241 ATOM 5048 H H 324 GLY mhp= 50 -0.1036 charge= 0.3278 ATOM 5049 HA2 H 324 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 5050 HA3 H 324 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 5051 N N.2 325 LYS mhp= 72 -0.5113 charge= -0.5985 ATOM 5052 CA C.3 325 LYS mhp= 8 -0.6805 charge= 0.0965 ATOM 5053 C C.2 325 LYS mhp= 40 -0.1002 charge= 0.3983 ATOM 5054 O O.2 325 LYS mhp= 58 -0.0233 charge= -0.3241 ATOM 5055 CB C.3 325 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 5056 CG C.3 325 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 5057 CD C.3 325 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 5058 CE C.3 325 LYS mhp= 6 -1.2486 charge= 0.2200 ATOM 5059 NZ N.4 325 LYS mhp= 79 -1.4439 charge= -0.5000 ATOM 5060 H H 325 LYS mhp= 50 -0.1036 charge= 0.3278 ATOM 5061 HA H 325 LYS mhp= 51 0.5234 charge= 0.1000 ATOM 5062 HB2 H 325 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 5063 HB3 H 325 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 5064 HG2 H 325 LYS mhp= 46 0.7341 charge= 0.1000 ATOM 5065 HG3 H 325 LYS mhp= 46 0.7341 charge= 0.1000 ATOM 5066 HD2 H 325 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 5067 HD3 H 325 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 5068 HE2 H 325 LYS mhp= 47 0.6301 charge= 0.1000 ATOM 5069 HE3 H 325 LYS mhp= 47 0.6301 charge= 0.1000 ATOM 5070 HZ1 H 325 LYS mhp= 50 -0.1036 charge= 0.3600 ATOM 5071 HZ2 H 325 LYS mhp= 50 -0.1036 charge= 0.3600 ATOM 5072 HZ3 H 325 LYS mhp= 50 -0.1036 charge= 0.3600 ATOM 5073 N N.2 326 ASN mhp= 72 -0.5113 charge= -0.5985 ATOM 5074 CA C.3 326 ASN mhp= 8 -0.6805 charge= 0.0965 ATOM 5075 C C.2 326 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 5076 O O.2 326 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 5077 CB C.3 326 ASN mhp= 2 -1.0120 charge= -0.1135 ATOM 5078 CG C.2 326 ASN mhp= 40 -0.1002 charge= 0.3983 ATOM 5079 OD1 O.2 326 ASN mhp= 58 -0.0233 charge= -0.3241 ATOM 5080 ND2 N.2 326 ASN mhp= 72 -0.5113 charge= -0.8163 ATOM 5081 H H 326 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 5082 HA H 326 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 5083 HB2 H 326 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 5084 HB3 H 326 ASN mhp= 51 0.5234 charge= 0.1000 ATOM 5085 HD21 H 326 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 5086 HD22 H 326 ASN mhp= 50 -0.1036 charge= 0.3278 ATOM 5087 N N.2 327 PRO mhp= 72 -0.5113 charge= -0.6007 ATOM 5088 CA C.3 327 PRO mhp= 8 -0.6805 charge= 0.2065 ATOM 5089 C C.2 327 PRO mhp= 40 -0.1002 charge= 0.3983 ATOM 5090 O O.2 327 PRO mhp= 58 -0.0233 charge= -0.3241 ATOM 5091 CB C.3 327 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 5092 CG C.3 327 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 5093 CD C.3 327 PRO mhp= 6 -1.2486 charge= 0.0200 ATOM 5094 HA H 327 PRO mhp= 51 0.5234 charge= 0.1000 ATOM 5095 HB2 H 327 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 5096 HB3 H 327 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 5097 HG2 H 327 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 5098 HG3 H 327 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 5099 HD2 H 327 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 5100 HD3 H 327 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 5101 N N.2 328 LEU mhp= 72 -0.5113 charge= -0.5985 ATOM 5102 CA C.3 328 LEU mhp= 8 -0.6805 charge= 0.0965 ATOM 5103 C C.2 328 LEU mhp= 40 -0.1002 charge= 0.3983 ATOM 5104 O O.2 328 LEU mhp= 58 -0.0233 charge= -0.3241 ATOM 5105 CB C.3 328 LEU mhp= 2 -1.0120 charge= -0.2000 ATOM 5106 CG C.3 328 LEU mhp= 3 -0.6681 charge= -0.1000 ATOM 5107 CD1 C.3 328 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 5108 CD2 C.3 328 LEU mhp= 1 -1.5603 charge= -0.3000 ATOM 5109 H H 328 LEU mhp= 50 -0.1036 charge= 0.3278 ATOM 5110 HA H 328 LEU mhp= 51 0.5234 charge= 0.1000 ATOM 5111 HB2 H 328 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 5112 HB3 H 328 LEU mhp= 52 0.6666 charge= 0.1000 ATOM 5113 HG H 328 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 5114 HD11 H 328 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 5115 HD12 H 328 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 5116 HD13 H 328 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 5117 HD21 H 328 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 5118 HD22 H 328 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 5119 HD23 H 328 LEU mhp= 46 0.7341 charge= 0.1000 ATOM 5120 N N.2 329 GLY mhp= 72 -0.5113 charge= -0.5985 ATOM 5121 CA C.3 329 GLY mhp= 6 -1.2486 charge= -0.0900 ATOM 5122 C C.2 329 GLY mhp= 40 -0.1002 charge= 0.3358 ATOM 5123 O O.2 329 GLY mhp= 58 -0.0233 charge= -0.3800 ATOM 5124 H H 329 GLY mhp= 50 -0.1036 charge= 0.3278 ATOM 5125 HA2 H 329 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 5126 HA3 H 329 GLY mhp= 51 0.5234 charge= 0.1000 ATOM 5127 N N.1 330 ASP mhp= 74 0.1349 charge= -0.1758 ATOM 5128 CA C.3 330 ASP mhp= 8 -0.6805 charge= 0.1200 ATOM 5129 C C.1 330 ASP mhp= 0 0.0000 charge= 0.3800 ATOM 5130 O O.2 330 ASP mhp= 58 -0.0233 charge= -0.3800 ATOM 5131 CB C.3 330 ASP mhp= 2 -1.0120 charge= -0.1135 ATOM 5132 CG C.2 330 ASP mhp= 31 0.0901 charge= 0.0535 ATOM 5133 OD1 O.co2 330 ASP mhp= 62 -0.7941 charge= -0.5700 ATOM 5134 OD2 O.co2 330 ASP mhp= 62 -0.7941 charge= -0.5700 ATOM 5135 HA H 330 ASP mhp= 51 0.5234 charge= 0.1000 ATOM 5136 HB2 H 330 ASP mhp= 51 0.5234 charge= 0.1000 ATOM 5137 HB3 H 330 ASP mhp= 51 0.5234 charge= 0.1000 ATOM 5138 N N.1 334 SER mhp= 78 0.4208 charge= -0.4378 ATOM 5139 CA C.3 334 SER mhp= 8 -0.6805 charge= 0.0965 ATOM 5140 C C.2 334 SER mhp= 40 -0.1002 charge= 0.3983 ATOM 5141 O O.2 334 SER mhp= 58 -0.0233 charge= -0.3241 ATOM 5142 CB C.3 334 SER mhp= 6 -1.2486 charge= -0.1700 ATOM 5143 OG O.3 334 SER mhp= 56 -0.3567 charge= -0.1490 ATOM 5144 HA H 334 SER mhp= 51 0.5234 charge= 0.1000 ATOM 5145 HB2 H 334 SER mhp= 47 0.6301 charge= 0.1000 ATOM 5146 HB3 H 334 SER mhp= 47 0.6301 charge= 0.1000 ATOM 5147 HG H 334 SER mhp= 50 -0.1036 charge= 0.1190 ATOM 5148 H H 334 SER mhp= 50 -0.1036 charge= 0.3278 ATOM 5149 N N.2 335 THR mhp= 72 -0.5113 charge= -0.5985 ATOM 5150 CA C.3 335 THR mhp= 8 -0.6805 charge= 0.0965 ATOM 5151 C C.2 335 THR mhp= 40 -0.1002 charge= 0.3983 ATOM 5152 O O.2 335 THR mhp= 58 -0.0233 charge= -0.3241 ATOM 5153 CB C.3 335 THR mhp= 8 -0.6805 charge= -0.0700 ATOM 5154 OG1 O.3 335 THR mhp= 56 -0.3567 charge= -0.1490 ATOM 5155 CG2 C.3 335 THR mhp= 1 -1.5603 charge= -0.3000 ATOM 5156 H H 335 THR mhp= 50 -0.1036 charge= 0.3278 ATOM 5157 HA H 335 THR mhp= 51 0.5234 charge= 0.1000 ATOM 5158 HB H 335 THR mhp= 47 0.6301 charge= 0.1000 ATOM 5159 HG21 H 335 THR mhp= 52 0.6666 charge= 0.1000 ATOM 5160 HG22 H 335 THR mhp= 52 0.6666 charge= 0.1000 ATOM 5161 HG23 H 335 THR mhp= 52 0.6666 charge= 0.1000 ATOM 5162 HG1 H 335 THR mhp= 50 -0.1036 charge= 0.1190 ATOM 5163 N N.2 336 THR mhp= 72 -0.5113 charge= -0.5985 ATOM 5164 CA C.3 336 THR mhp= 8 -0.6805 charge= 0.0965 ATOM 5165 C C.2 336 THR mhp= 40 -0.1002 charge= 0.3983 ATOM 5166 O O.2 336 THR mhp= 58 -0.0233 charge= -0.3241 ATOM 5167 CB C.3 336 THR mhp= 8 -0.6805 charge= -0.0700 ATOM 5168 OG1 O.3 336 THR mhp= 56 -0.3567 charge= -0.1490 ATOM 5169 CG2 C.3 336 THR mhp= 1 -1.5603 charge= -0.3000 ATOM 5170 H H 336 THR mhp= 50 -0.1036 charge= 0.3278 ATOM 5171 HA H 336 THR mhp= 51 0.5234 charge= 0.1000 ATOM 5172 HB H 336 THR mhp= 47 0.6301 charge= 0.1000 ATOM 5173 HG1 H 336 THR mhp= 50 -0.1036 charge= 0.1190 ATOM 5174 HG21 H 336 THR mhp= 52 0.6666 charge= 0.1000 ATOM 5175 HG22 H 336 THR mhp= 52 0.6666 charge= 0.1000 ATOM 5176 HG23 H 336 THR mhp= 52 0.6666 charge= 0.1000 ATOM 5177 N N.2 337 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 5178 CA C.3 337 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 5179 C C.2 337 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 5180 O O.2 337 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 5181 CB C.3 337 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 5182 CG1 C.3 337 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 5183 CG2 C.3 337 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 5184 H H 337 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 5185 HA H 337 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 5186 HB H 337 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 5187 HG21 H 337 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 5188 HG22 H 337 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 5189 HG23 H 337 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 5190 HG11 H 337 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 5191 HG12 H 337 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 5192 HG13 H 337 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 5193 N N.2 338 SER mhp= 72 -0.5113 charge= -0.5985 ATOM 5194 CA C.3 338 SER mhp= 8 -0.6805 charge= 0.0965 ATOM 5195 C C.2 338 SER mhp= 40 -0.1002 charge= 0.3983 ATOM 5196 O O.2 338 SER mhp= 58 -0.0233 charge= -0.3241 ATOM 5197 CB C.3 338 SER mhp= 6 -1.2486 charge= -0.1700 ATOM 5198 OG O.3 338 SER mhp= 56 -0.3567 charge= -0.1490 ATOM 5199 H H 338 SER mhp= 50 -0.1036 charge= 0.3278 ATOM 5200 HA H 338 SER mhp= 51 0.5234 charge= 0.1000 ATOM 5201 HB2 H 338 SER mhp= 47 0.6301 charge= 0.1000 ATOM 5202 HB3 H 338 SER mhp= 47 0.6301 charge= 0.1000 ATOM 5203 HG H 338 SER mhp= 50 -0.1036 charge= 0.1190 ATOM 5204 N N.2 339 LYS mhp= 72 -0.5113 charge= -0.5985 ATOM 5205 CA C.3 339 LYS mhp= 8 -0.6805 charge= 0.0965 ATOM 5206 C C.2 339 LYS mhp= 40 -0.1002 charge= 0.3983 ATOM 5207 O O.2 339 LYS mhp= 58 -0.0233 charge= -0.3241 ATOM 5208 CB C.3 339 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 5209 CG C.3 339 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 5210 CD C.3 339 LYS mhp= 2 -1.0120 charge= -0.2000 ATOM 5211 CE C.3 339 LYS mhp= 6 -1.2486 charge= 0.2200 ATOM 5212 NZ N.4 339 LYS mhp= 79 -1.4439 charge= -0.5000 ATOM 5213 H H 339 LYS mhp= 50 -0.1036 charge= 0.3278 ATOM 5214 HA H 339 LYS mhp= 51 0.5234 charge= 0.1000 ATOM 5215 HB2 H 339 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 5216 HB3 H 339 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 5217 HG2 H 339 LYS mhp= 46 0.7341 charge= 0.1000 ATOM 5218 HG3 H 339 LYS mhp= 46 0.7341 charge= 0.1000 ATOM 5219 HD2 H 339 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 5220 HD3 H 339 LYS mhp= 52 0.6666 charge= 0.1000 ATOM 5221 HE2 H 339 LYS mhp= 47 0.6301 charge= 0.1000 ATOM 5222 HE3 H 339 LYS mhp= 47 0.6301 charge= 0.1000 ATOM 5223 HZ1 H 339 LYS mhp= 50 -0.1036 charge= 0.3600 ATOM 5224 HZ2 H 339 LYS mhp= 50 -0.1036 charge= 0.3600 ATOM 5225 HZ3 H 339 LYS mhp= 50 -0.1036 charge= 0.3600 ATOM 5226 N N.2 340 THR mhp= 72 -0.5113 charge= -0.5985 ATOM 5227 CA C.3 340 THR mhp= 8 -0.6805 charge= 0.0965 ATOM 5228 C C.2 340 THR mhp= 40 -0.1002 charge= 0.3983 ATOM 5229 O O.2 340 THR mhp= 58 -0.0233 charge= -0.3241 ATOM 5230 CB C.3 340 THR mhp= 8 -0.6805 charge= -0.0700 ATOM 5231 OG1 O.3 340 THR mhp= 56 -0.3567 charge= -0.1490 ATOM 5232 CG2 C.3 340 THR mhp= 1 -1.5603 charge= -0.3000 ATOM 5233 H H 340 THR mhp= 50 -0.1036 charge= 0.3278 ATOM 5234 HA H 340 THR mhp= 51 0.5234 charge= 0.1000 ATOM 5235 HB H 340 THR mhp= 47 0.6301 charge= 0.1000 ATOM 5236 HG1 H 340 THR mhp= 50 -0.1036 charge= 0.1190 ATOM 5237 HG21 H 340 THR mhp= 52 0.6666 charge= 0.1000 ATOM 5238 HG22 H 340 THR mhp= 52 0.6666 charge= 0.1000 ATOM 5239 HG23 H 340 THR mhp= 52 0.6666 charge= 0.1000 ATOM 5240 N N.2 341 GLU mhp= 72 -0.5113 charge= -0.5985 ATOM 5241 CA C.3 341 GLU mhp= 8 -0.6805 charge= 0.0965 ATOM 5242 C C.2 341 GLU mhp= 40 -0.1002 charge= 0.3983 ATOM 5243 O O.2 341 GLU mhp= 58 -0.0233 charge= -0.3241 ATOM 5244 CB C.3 341 GLU mhp= 2 -1.0120 charge= -0.2000 ATOM 5245 CG C.3 341 GLU mhp= 2 -1.0120 charge= -0.1135 ATOM 5246 CD C.2 341 GLU mhp= 31 0.0901 charge= 0.0535 ATOM 5247 OE1 O.co2 341 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 5248 OE2 O.co2 341 GLU mhp= 62 -0.7941 charge= -0.5700 ATOM 5249 H H 341 GLU mhp= 50 -0.1036 charge= 0.3278 ATOM 5250 HA H 341 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 5251 HB2 H 341 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 5252 HB3 H 341 GLU mhp= 52 0.6666 charge= 0.1000 ATOM 5253 HG2 H 341 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 5254 HG3 H 341 GLU mhp= 51 0.5234 charge= 0.1000 ATOM 5255 N N.2 342 THR mhp= 72 -0.5113 charge= -0.5985 ATOM 5256 CA C.3 342 THR mhp= 8 -0.6805 charge= 0.0965 ATOM 5257 C C.2 342 THR mhp= 40 -0.1002 charge= 0.3983 ATOM 5258 O O.2 342 THR mhp= 58 -0.0233 charge= -0.3241 ATOM 5259 CB C.3 342 THR mhp= 8 -0.6805 charge= -0.0700 ATOM 5260 OG1 O.3 342 THR mhp= 56 -0.3567 charge= -0.1490 ATOM 5261 CG2 C.3 342 THR mhp= 1 -1.5603 charge= -0.3000 ATOM 5262 H H 342 THR mhp= 50 -0.1036 charge= 0.3278 ATOM 5263 HA H 342 THR mhp= 51 0.5234 charge= 0.1000 ATOM 5264 HB H 342 THR mhp= 47 0.6301 charge= 0.1000 ATOM 5265 HG1 H 342 THR mhp= 50 -0.1036 charge= 0.1190 ATOM 5266 HG21 H 342 THR mhp= 52 0.6666 charge= 0.1000 ATOM 5267 HG22 H 342 THR mhp= 52 0.6666 charge= 0.1000 ATOM 5268 HG23 H 342 THR mhp= 52 0.6666 charge= 0.1000 ATOM 5269 N N.2 343 SER mhp= 72 -0.5113 charge= -0.5985 ATOM 5270 CA C.3 343 SER mhp= 8 -0.6805 charge= 0.0965 ATOM 5271 C C.2 343 SER mhp= 40 -0.1002 charge= 0.3983 ATOM 5272 O O.2 343 SER mhp= 58 -0.0233 charge= -0.3241 ATOM 5273 CB C.3 343 SER mhp= 6 -1.2486 charge= -0.1700 ATOM 5274 OG O.3 343 SER mhp= 56 -0.3567 charge= -0.1490 ATOM 5275 H H 343 SER mhp= 50 -0.1036 charge= 0.3278 ATOM 5276 HA H 343 SER mhp= 51 0.5234 charge= 0.1000 ATOM 5277 HB2 H 343 SER mhp= 47 0.6301 charge= 0.1000 ATOM 5278 HB3 H 343 SER mhp= 47 0.6301 charge= 0.1000 ATOM 5279 HG H 343 SER mhp= 50 -0.1036 charge= 0.1190 ATOM 5280 N N.2 344 GLN mhp= 72 -0.5113 charge= -0.5985 ATOM 5281 CA C.3 344 GLN mhp= 8 -0.6805 charge= 0.0965 ATOM 5282 C C.2 344 GLN mhp= 40 -0.1002 charge= 0.3983 ATOM 5283 O O.2 344 GLN mhp= 58 -0.0233 charge= -0.3241 ATOM 5284 CB C.3 344 GLN mhp= 2 -1.0120 charge= -0.2000 ATOM 5285 CG C.3 344 GLN mhp= 2 -1.0120 charge= -0.1135 ATOM 5286 CD C.2 344 GLN mhp= 40 -0.1002 charge= 0.3983 ATOM 5287 OE1 O.2 344 GLN mhp= 58 -0.0233 charge= -0.3241 ATOM 5288 NE2 N.2 344 GLN mhp= 72 -0.5113 charge= -0.8163 ATOM 5289 H H 344 GLN mhp= 50 -0.1036 charge= 0.3278 ATOM 5290 HA H 344 GLN mhp= 51 0.5234 charge= 0.1000 ATOM 5291 HB2 H 344 GLN mhp= 52 0.6666 charge= 0.1000 ATOM 5292 HB3 H 344 GLN mhp= 52 0.6666 charge= 0.1000 ATOM 5293 HG2 H 344 GLN mhp= 51 0.5234 charge= 0.1000 ATOM 5294 HG3 H 344 GLN mhp= 51 0.5234 charge= 0.1000 ATOM 5295 HE21 H 344 GLN mhp= 50 -0.1036 charge= 0.3278 ATOM 5296 HE22 H 344 GLN mhp= 50 -0.1036 charge= 0.3278 ATOM 5297 N N.2 345 VAL mhp= 72 -0.5113 charge= -0.5985 ATOM 5298 CA C.3 345 VAL mhp= 8 -0.6805 charge= 0.0965 ATOM 5299 C C.2 345 VAL mhp= 40 -0.1002 charge= 0.3983 ATOM 5300 O O.2 345 VAL mhp= 58 -0.0233 charge= -0.3241 ATOM 5301 CB C.3 345 VAL mhp= 3 -0.6681 charge= -0.1000 ATOM 5302 CG1 C.3 345 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 5303 CG2 C.3 345 VAL mhp= 1 -1.5603 charge= -0.3000 ATOM 5304 H H 345 VAL mhp= 50 -0.1036 charge= 0.3278 ATOM 5305 HA H 345 VAL mhp= 51 0.5234 charge= 0.1000 ATOM 5306 HB H 345 VAL mhp= 52 0.6666 charge= 0.1000 ATOM 5307 HG11 H 345 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 5308 HG12 H 345 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 5309 HG13 H 345 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 5310 HG21 H 345 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 5311 HG22 H 345 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 5312 HG23 H 345 VAL mhp= 46 0.7341 charge= 0.1000 ATOM 5313 N N.2 346 ALA mhp= 72 -0.5113 charge= -0.5985 ATOM 5314 CA C.3 346 ALA mhp= 8 -0.6805 charge= 0.0965 ATOM 5315 C C.2 346 ALA mhp= 40 -0.1002 charge= 0.3983 ATOM 5316 O O.2 346 ALA mhp= 58 -0.0233 charge= -0.3241 ATOM 5317 CB C.3 346 ALA mhp= 1 -1.5603 charge= -0.3000 ATOM 5318 H H 346 ALA mhp= 50 -0.1036 charge= 0.3278 ATOM 5319 HA H 346 ALA mhp= 51 0.5234 charge= 0.1000 ATOM 5320 HB1 H 346 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 5321 HB2 H 346 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 5322 HB3 H 346 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 5323 N N.2 347 PRO mhp= 72 -0.5113 charge= -0.6007 ATOM 5324 CA C.3 347 PRO mhp= 8 -0.6805 charge= 0.2065 ATOM 5325 C C.2 347 PRO mhp= 40 -0.1002 charge= 0.3983 ATOM 5326 O O.2 347 PRO mhp= 58 -0.0233 charge= -0.3241 ATOM 5327 CB C.3 347 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 5328 CG C.3 347 PRO mhp= 2 -1.0120 charge= -0.2000 ATOM 5329 CD C.3 347 PRO mhp= 6 -1.2486 charge= 0.0200 ATOM 5330 HA H 347 PRO mhp= 51 0.5234 charge= 0.1000 ATOM 5331 HB2 H 347 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 5332 HB3 H 347 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 5333 HG2 H 347 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 5334 HG3 H 347 PRO mhp= 52 0.6666 charge= 0.1000 ATOM 5335 HD2 H 347 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 5336 HD3 H 347 PRO mhp= 47 0.6301 charge= 0.1000 ATOM 5337 N N.2 348 ALA mhp= 72 -0.5113 charge= -0.5985 ATOM 5338 CA C.3 348 ALA mhp= 8 -0.6805 charge= 0.0965 ATOM 5339 C C.2 348 ALA mhp= 31 0.0901 charge= 0.0535 ATOM 5340 O O.co2 348 ALA mhp= 62 -0.7941 charge= -0.5700 ATOM 5341 CB C.3 348 ALA mhp= 1 -1.5603 charge= -0.3000 ATOM 5342 OXT O.co2 348 ALA mhp= 62 -0.7941 charge= -0.5700 ATOM 5343 H H 348 ALA mhp= 50 -0.1036 charge= 0.3278 ATOM 5344 HA H 348 ALA mhp= 51 0.5234 charge= 0.1000 ATOM 5345 HB1 H 348 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 5346 HB2 H 348 ALA mhp= 52 0.6666 charge= 0.1000 ATOM 5347 HB3 H 348 ALA mhp= 52 0.6666 charge= 0.1000