USER MOD reduce.3.24.130724 H: found=0, std=0, add=967, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 965 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A1108 CYS SG : rot 180:sc= 0.815 USER MOD Set 1.2: A1125 ASN : amide:sc= -0.248 K(o=0.57,f=-6.2!) USER MOD Set 2.1: A1065 SER OG : rot 60:sc= 1.1 USER MOD Set 2.2: A1069 SER OG : rot 46:sc= 1.18 USER MOD Set 2.3: A1070 HIS : no HE2:sc= -0.432 K(o=1.8,f=-0.69!) USER MOD Single : A1057 ASN : amide:sc= -0.022 K(o=-0.022,f=-0.65) USER MOD Single : A1058 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A1060 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1063 THR OG1 : rot 180:sc= -0.0079 USER MOD Single : A1066 ASN : amide:sc= -0.113 K(o=-0.11,f=-1.2) USER MOD Single : A1071 HIS : no HE2:sc= -0.0967 X(o=-0.097,f=-0.13) USER MOD Single : A1072 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1079 THR OG1 : rot 68:sc= 0.78 USER MOD Single : A1082 SER OG : rot 150:sc= 0.00036 USER MOD Single : A1083 ASN : amide:sc=-0.00261 K(o=-0.0026,f=-0.88) USER MOD Single : A1084 SER OG : rot -24:sc= 1.25 USER MOD Single : A1086 HIS : no HE2:sc= 1.11 K(o=1.1,f=-3.6!) USER MOD Single : A1090 THR OG1 : rot 180:sc= 0.0395 USER MOD Single : A1093 THR OG1 : rot 72:sc= 1.2 USER MOD Single : A1094 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1095 TYR OH : rot 166:sc= 0 USER MOD Single : A1096 CYS SG : rot -129:sc= 0.718 USER MOD Single : A1097 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1098 GLN : amide:sc= -0.095 X(o=-0.095,f=-0.35) USER MOD Single : A1102 THR OG1 : rot -135:sc= 0.241 USER MOD Single : A1104 THR OG1 : rot 180:sc= 0 USER MOD Single : A1107 THR OG1 : rot -160:sc=-0.00823 USER MOD Single : A1112 GLN : amide:sc= 0.404 K(o=0.4,f=-0.17) USER MOD Single : A1117 CYS SG : rot -71:sc= 0.679 USER MOD Single : A1120 SER OG : rot 180:sc= 0 USER MOD Single : A1121 CYS SG : rot -45:sc= -0.361 USER MOD Single : A1122 LYS NZ :NH3+ 164:sc= -0.0463 (180deg=-0.3) USER MOD Single : A1124 THR OG1 : rot 180:sc= 0.184 USER MOD Single : A1177 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1178 TYR OH : rot 180:sc= 0 USER MOD Single : A1179 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1184 ASN : amide:sc= 0.466 K(o=0.47,f=-0.35) USER MOD Single : A1188 MET CE :methyl -157:sc= 0 (180deg=-0.233) USER MOD Single : A1191 ASN : amide:sc= 0.878 K(o=0.88,f=-0.013) USER MOD Single : A1196 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1197 ASN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A1200 ASN : amide:sc= 1.03 K(o=1,f=-7.7!) USER MOD Single : A1203 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A1204 THR OG1 : rot 86:sc= 1.24 USER MOD Single : A1206 HIS : no HD1:sc= -0.0118 X(o=-0.012,f=-0.0016) USER MOD Single : A1209 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0616) USER MOD Single : A1212 THR OG1 : rot 180:sc= 0 USER MOD Single : A1223 CYS SG : rot 170:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 117 N VAL A1055 4.869 -0.515 13.356 1.00 1.49 N ATOM 118 CA VAL A1055 4.544 0.584 12.427 1.00 1.69 C ATOM 119 C VAL A1055 4.981 0.228 10.999 1.00 1.50 C ATOM 120 O VAL A1055 5.777 -0.692 10.792 1.00 1.69 O ATOM 121 CB VAL A1055 5.207 1.918 12.845 1.00 2.53 C ATOM 122 CG1 VAL A1055 4.625 2.469 14.150 1.00 3.51 C ATOM 123 CG2 VAL A1055 6.729 1.810 13.002 1.00 2.78 C ATOM 0 HA VAL A1055 3.463 0.717 12.462 1.00 1.69 H new ATOM 0 HB VAL A1055 4.987 2.603 12.026 1.00 2.53 H new ATOM 0 HG11 VAL A1055 5.121 3.406 14.403 1.00 3.51 H new ATOM 0 HG12 VAL A1055 3.557 2.646 14.026 1.00 3.51 H new ATOM 0 HG13 VAL A1055 4.782 1.747 14.952 1.00 3.51 H new ATOM 0 HG21 VAL A1055 7.134 2.778 13.296 1.00 2.78 H new ATOM 0 HG22 VAL A1055 6.964 1.071 13.767 1.00 2.78 H new ATOM 0 HG23 VAL A1055 7.172 1.504 12.054 1.00 2.78 H new ATOM 133 N VAL A1056 4.496 0.967 9.993 1.00 1.42 N ATOM 134 CA VAL A1056 5.009 0.855 8.617 1.00 1.34 C ATOM 135 C VAL A1056 6.462 1.345 8.560 1.00 1.33 C ATOM 136 O VAL A1056 6.747 2.514 8.834 1.00 1.65 O ATOM 137 CB VAL A1056 4.078 1.543 7.599 1.00 1.52 C ATOM 138 CG1 VAL A1056 3.866 3.051 7.809 1.00 1.92 C ATOM 139 CG2 VAL A1056 4.576 1.301 6.173 1.00 1.76 C ATOM 0 H VAL A1056 3.747 1.651 10.104 1.00 1.42 H new ATOM 0 HA VAL A1056 5.016 -0.194 8.322 1.00 1.34 H new ATOM 0 HB VAL A1056 3.105 1.080 7.765 1.00 1.52 H new ATOM 0 HG11 VAL A1056 3.196 3.435 7.040 1.00 1.92 H new ATOM 0 HG12 VAL A1056 3.427 3.223 8.792 1.00 1.92 H new ATOM 0 HG13 VAL A1056 4.825 3.566 7.745 1.00 1.92 H new ATOM 0 HG21 VAL A1056 3.908 1.793 5.466 1.00 1.76 H new ATOM 0 HG22 VAL A1056 5.582 1.707 6.065 1.00 1.76 H new ATOM 0 HG23 VAL A1056 4.593 0.230 5.971 1.00 1.76 H new ATOM 149 N ASN A1057 7.393 0.443 8.241 1.00 1.08 N ATOM 150 CA ASN A1057 8.827 0.685 8.361 1.00 1.10 C ATOM 151 C ASN A1057 9.420 1.251 7.060 1.00 1.08 C ATOM 152 O ASN A1057 10.293 2.114 7.127 1.00 1.15 O ATOM 153 CB ASN A1057 9.497 -0.601 8.890 1.00 1.02 C ATOM 154 CG ASN A1057 10.326 -1.326 7.854 1.00 1.33 C ATOM 155 OD1 ASN A1057 9.860 -2.193 7.131 1.00 2.71 O ATOM 156 ND2 ASN A1057 11.565 -0.943 7.698 1.00 1.70 N ATOM 0 H ASN A1057 7.166 -0.487 7.888 1.00 1.08 H new ATOM 0 HA ASN A1057 9.030 1.470 9.090 1.00 1.10 H new ATOM 0 HB2 ASN A1057 10.133 -0.346 9.738 1.00 1.02 H new ATOM 0 HB3 ASN A1057 8.726 -1.275 9.262 1.00 1.02 H new ATOM 0 HD21 ASN A1057 12.143 -1.368 6.973 1.00 1.70 H new ATOM 0 HD22 ASN A1057 11.955 -0.219 8.301 1.00 1.70 H new ATOM 163 N GLN A1058 8.933 0.807 5.893 1.00 1.03 N ATOM 164 CA GLN A1058 9.263 1.420 4.603 1.00 1.11 C ATOM 165 C GLN A1058 8.121 1.320 3.582 1.00 1.11 C ATOM 166 O GLN A1058 7.594 0.236 3.331 1.00 0.92 O ATOM 167 CB GLN A1058 10.539 0.780 4.011 1.00 1.11 C ATOM 168 CG GLN A1058 11.029 1.553 2.768 1.00 2.14 C ATOM 169 CD GLN A1058 12.218 0.935 2.038 1.00 2.52 C ATOM 170 OE1 GLN A1058 12.605 -0.214 2.233 1.00 2.91 O ATOM 171 NE2 GLN A1058 12.815 1.668 1.128 1.00 3.40 N ATOM 0 H GLN A1058 8.299 0.012 5.819 1.00 1.03 H new ATOM 0 HA GLN A1058 9.432 2.478 4.801 1.00 1.11 H new ATOM 0 HB2 GLN A1058 11.325 0.765 4.766 1.00 1.11 H new ATOM 0 HB3 GLN A1058 10.337 -0.257 3.741 1.00 1.11 H new ATOM 0 HG2 GLN A1058 10.200 1.641 2.066 1.00 2.14 H new ATOM 0 HG3 GLN A1058 11.298 2.564 3.073 1.00 2.14 H new ATOM 0 HE21 GLN A1058 12.502 2.624 0.957 1.00 3.40 H new ATOM 0 HE22 GLN A1058 13.592 1.282 0.591 1.00 3.40 H new ATOM 180 N VAL A1059 7.796 2.441 2.933 1.00 1.38 N ATOM 181 CA VAL A1059 6.980 2.488 1.708 1.00 1.33 C ATOM 182 C VAL A1059 7.913 2.890 0.561 1.00 1.27 C ATOM 183 O VAL A1059 8.714 3.817 0.722 1.00 1.43 O ATOM 184 CB VAL A1059 5.758 3.432 1.808 1.00 1.37 C ATOM 185 CG1 VAL A1059 4.782 2.977 2.894 1.00 1.43 C ATOM 186 CG2 VAL A1059 6.089 4.898 2.104 1.00 1.49 C ATOM 0 H VAL A1059 8.097 3.363 3.248 1.00 1.38 H new ATOM 0 HA VAL A1059 6.543 1.504 1.535 1.00 1.33 H new ATOM 0 HB VAL A1059 5.321 3.373 0.811 1.00 1.37 H new ATOM 0 HG11 VAL A1059 3.937 3.664 2.935 1.00 1.43 H new ATOM 0 HG12 VAL A1059 4.423 1.974 2.664 1.00 1.43 H new ATOM 0 HG13 VAL A1059 5.289 2.968 3.859 1.00 1.43 H new ATOM 0 HG21 VAL A1059 5.166 5.476 2.154 1.00 1.49 H new ATOM 0 HG22 VAL A1059 6.613 4.967 3.057 1.00 1.49 H new ATOM 0 HG23 VAL A1059 6.723 5.295 1.311 1.00 1.49 H new ATOM 196 N LYS A1060 7.874 2.193 -0.581 1.00 1.04 N ATOM 197 CA LYS A1060 8.701 2.544 -1.751 1.00 1.03 C ATOM 198 C LYS A1060 7.966 2.328 -3.073 1.00 0.73 C ATOM 199 O LYS A1060 7.198 1.377 -3.238 1.00 0.59 O ATOM 200 CB LYS A1060 10.065 1.838 -1.686 1.00 1.28 C ATOM 201 CG LYS A1060 10.019 0.353 -2.071 1.00 1.69 C ATOM 202 CD LYS A1060 11.326 -0.395 -1.779 1.00 1.45 C ATOM 203 CE LYS A1060 12.559 0.348 -2.310 1.00 1.34 C ATOM 204 NZ LYS A1060 13.726 -0.557 -2.403 1.00 1.49 N ATOM 0 H LYS A1060 7.277 1.378 -0.724 1.00 1.04 H new ATOM 0 HA LYS A1060 8.898 3.615 -1.713 1.00 1.03 H new ATOM 0 HB2 LYS A1060 10.761 2.353 -2.348 1.00 1.28 H new ATOM 0 HB3 LYS A1060 10.461 1.928 -0.675 1.00 1.28 H new ATOM 0 HG2 LYS A1060 9.205 -0.129 -1.530 1.00 1.69 H new ATOM 0 HG3 LYS A1060 9.790 0.268 -3.133 1.00 1.69 H new ATOM 0 HD2 LYS A1060 11.427 -0.537 -0.703 1.00 1.45 H new ATOM 0 HD3 LYS A1060 11.282 -1.387 -2.229 1.00 1.45 H new ATOM 0 HE2 LYS A1060 12.340 0.767 -3.292 1.00 1.34 H new ATOM 0 HE3 LYS A1060 12.795 1.185 -1.652 1.00 1.34 H new ATOM 0 HZ1 LYS A1060 14.546 -0.030 -2.765 1.00 1.49 H new ATOM 0 HZ2 LYS A1060 13.947 -0.937 -1.460 1.00 1.49 H new ATOM 0 HZ3 LYS A1060 13.506 -1.341 -3.050 1.00 1.49 H new ATOM 218 N VAL A1061 8.172 3.245 -4.011 1.00 0.77 N ATOM 219 CA VAL A1061 7.403 3.331 -5.256 1.00 0.65 C ATOM 220 C VAL A1061 8.072 2.525 -6.373 1.00 0.60 C ATOM 221 O VAL A1061 9.293 2.528 -6.519 1.00 0.89 O ATOM 222 CB VAL A1061 7.170 4.811 -5.622 1.00 0.79 C ATOM 223 CG1 VAL A1061 6.232 4.954 -6.820 1.00 0.78 C ATOM 224 CG2 VAL A1061 6.517 5.556 -4.444 1.00 1.14 C ATOM 0 H VAL A1061 8.890 3.965 -3.930 1.00 0.77 H new ATOM 0 HA VAL A1061 6.422 2.878 -5.114 1.00 0.65 H new ATOM 0 HB VAL A1061 8.146 5.232 -5.863 1.00 0.79 H new ATOM 0 HG11 VAL A1061 6.092 6.011 -7.048 1.00 0.78 H new ATOM 0 HG12 VAL A1061 6.666 4.451 -7.684 1.00 0.78 H new ATOM 0 HG13 VAL A1061 5.268 4.503 -6.583 1.00 0.78 H new ATOM 0 HG21 VAL A1061 6.358 6.599 -4.716 1.00 1.14 H new ATOM 0 HG22 VAL A1061 5.559 5.093 -4.207 1.00 1.14 H new ATOM 0 HG23 VAL A1061 7.171 5.504 -3.573 1.00 1.14 H new ATOM 234 N LEU A1062 7.250 1.827 -7.159 1.00 0.54 N ATOM 235 CA LEU A1062 7.688 0.927 -8.237 1.00 0.59 C ATOM 236 C LEU A1062 7.313 1.456 -9.634 1.00 0.63 C ATOM 237 O LEU A1062 8.004 1.169 -10.614 1.00 1.34 O ATOM 238 CB LEU A1062 7.176 -0.490 -7.913 1.00 0.69 C ATOM 239 CG LEU A1062 7.758 -1.634 -8.766 1.00 0.75 C ATOM 240 CD1 LEU A1062 9.284 -1.626 -8.854 1.00 1.40 C ATOM 241 CD2 LEU A1062 7.373 -2.967 -8.126 1.00 1.43 C ATOM 0 H LEU A1062 6.235 1.870 -7.064 1.00 0.54 H new ATOM 0 HA LEU A1062 8.776 0.882 -8.282 1.00 0.59 H new ATOM 0 HB2 LEU A1062 7.390 -0.701 -6.865 1.00 0.69 H new ATOM 0 HB3 LEU A1062 6.092 -0.497 -8.024 1.00 0.69 H new ATOM 0 HG LEU A1062 7.354 -1.497 -9.769 1.00 0.75 H new ATOM 0 HD11 LEU A1062 9.617 -2.461 -9.471 1.00 1.40 H new ATOM 0 HD12 LEU A1062 9.618 -0.689 -9.300 1.00 1.40 H new ATOM 0 HD13 LEU A1062 9.707 -1.722 -7.854 1.00 1.40 H new ATOM 0 HD21 LEU A1062 7.779 -3.786 -8.720 1.00 1.43 H new ATOM 0 HD22 LEU A1062 7.778 -3.016 -7.115 1.00 1.43 H new ATOM 0 HD23 LEU A1062 6.287 -3.051 -8.086 1.00 1.43 H new ATOM 253 N THR A1063 6.264 2.279 -9.726 1.00 0.72 N ATOM 254 CA THR A1063 5.967 3.072 -10.931 1.00 0.66 C ATOM 255 C THR A1063 6.891 4.301 -10.997 1.00 0.76 C ATOM 256 O THR A1063 7.593 4.633 -10.038 1.00 1.96 O ATOM 257 CB THR A1063 4.489 3.510 -10.957 1.00 0.66 C ATOM 258 OG1 THR A1063 4.117 4.016 -12.217 1.00 0.87 O ATOM 259 CG2 THR A1063 4.106 4.565 -9.921 1.00 0.59 C ATOM 0 H THR A1063 5.594 2.417 -8.969 1.00 0.72 H new ATOM 0 HA THR A1063 6.147 2.445 -11.804 1.00 0.66 H new ATOM 0 HB THR A1063 3.956 2.590 -10.717 1.00 0.66 H new ATOM 0 HG1 THR A1063 3.174 4.282 -12.197 1.00 0.87 H new ATOM 0 HG21 THR A1063 3.048 4.805 -10.021 1.00 0.59 H new ATOM 0 HG22 THR A1063 4.298 4.178 -8.920 1.00 0.59 H new ATOM 0 HG23 THR A1063 4.699 5.465 -10.082 1.00 0.59 H new ATOM 267 N GLU A1064 6.864 5.015 -12.116 1.00 1.26 N ATOM 268 CA GLU A1064 7.437 6.356 -12.264 1.00 1.40 C ATOM 269 C GLU A1064 6.315 7.322 -12.651 1.00 1.73 C ATOM 270 O GLU A1064 5.340 6.918 -13.286 1.00 3.01 O ATOM 271 CB GLU A1064 8.607 6.358 -13.251 1.00 1.78 C ATOM 272 CG GLU A1064 9.861 5.828 -12.554 1.00 2.25 C ATOM 273 CD GLU A1064 11.017 5.707 -13.538 1.00 2.84 C ATOM 274 OE1 GLU A1064 11.565 6.750 -13.973 1.00 3.22 O ATOM 275 OE2 GLU A1064 11.399 4.557 -13.861 1.00 3.80 O ATOM 0 H GLU A1064 6.431 4.671 -12.973 1.00 1.26 H new ATOM 0 HA GLU A1064 7.864 6.691 -11.319 1.00 1.40 H new ATOM 0 HB2 GLU A1064 8.369 5.738 -14.116 1.00 1.78 H new ATOM 0 HB3 GLU A1064 8.783 7.368 -13.621 1.00 1.78 H new ATOM 0 HG2 GLU A1064 10.140 6.496 -11.739 1.00 2.25 H new ATOM 0 HG3 GLU A1064 9.652 4.855 -12.110 1.00 2.25 H new ATOM 282 N SER A1065 6.435 8.583 -12.237 1.00 1.83 N ATOM 283 CA SER A1065 5.355 9.579 -12.272 1.00 2.39 C ATOM 284 C SER A1065 4.749 9.793 -13.665 1.00 2.15 C ATOM 285 O SER A1065 5.301 10.534 -14.484 1.00 2.64 O ATOM 286 CB SER A1065 5.844 10.913 -11.693 1.00 3.64 C ATOM 287 OG SER A1065 6.291 10.745 -10.356 1.00 4.20 O ATOM 0 H SER A1065 7.306 8.953 -11.858 1.00 1.83 H new ATOM 0 HA SER A1065 4.553 9.175 -11.654 1.00 2.39 H new ATOM 0 HB2 SER A1065 6.655 11.306 -12.306 1.00 3.64 H new ATOM 0 HB3 SER A1065 5.038 11.646 -11.723 1.00 3.64 H new ATOM 0 HG SER A1065 7.032 10.104 -10.337 1.00 4.20 H new ATOM 293 N ASN A1066 3.597 9.162 -13.906 1.00 2.40 N ATOM 294 CA ASN A1066 2.716 9.373 -15.053 1.00 2.68 C ATOM 295 C ASN A1066 1.248 9.308 -14.588 1.00 2.50 C ATOM 296 O ASN A1066 0.613 10.354 -14.417 1.00 3.00 O ATOM 297 CB ASN A1066 3.051 8.364 -16.175 1.00 2.99 C ATOM 298 CG ASN A1066 2.129 8.489 -17.382 1.00 4.08 C ATOM 299 OD1 ASN A1066 1.397 9.457 -17.543 1.00 5.10 O ATOM 300 ND2 ASN A1066 2.111 7.512 -18.251 1.00 4.46 N ATOM 0 H ASN A1066 3.236 8.451 -13.270 1.00 2.40 H new ATOM 0 HA ASN A1066 2.873 10.364 -15.479 1.00 2.68 H new ATOM 0 HB2 ASN A1066 4.082 8.514 -16.495 1.00 2.99 H new ATOM 0 HB3 ASN A1066 2.985 7.351 -15.777 1.00 2.99 H new ATOM 0 HD21 ASN A1066 1.489 7.559 -19.058 1.00 4.46 H new ATOM 0 HD22 ASN A1066 2.719 6.703 -18.122 1.00 4.46 H new ATOM 307 N ARG A1067 0.733 8.101 -14.301 1.00 1.98 N ATOM 308 CA ARG A1067 -0.640 7.894 -13.806 1.00 1.79 C ATOM 309 C ARG A1067 -0.813 8.418 -12.382 1.00 1.61 C ATOM 310 O ARG A1067 -1.821 9.053 -12.078 1.00 1.82 O ATOM 311 CB ARG A1067 -1.026 6.398 -13.892 1.00 1.63 C ATOM 312 CG ARG A1067 -2.543 6.177 -13.751 1.00 2.72 C ATOM 313 CD ARG A1067 -3.320 6.655 -14.989 1.00 4.07 C ATOM 314 NE ARG A1067 -4.753 6.830 -14.703 1.00 5.44 N ATOM 315 CZ ARG A1067 -5.694 5.912 -14.769 1.00 6.31 C ATOM 316 NH1 ARG A1067 -5.473 4.688 -15.138 1.00 6.20 N ATOM 317 NH2 ARG A1067 -6.907 6.234 -14.444 1.00 7.73 N ATOM 0 H ARG A1067 1.261 7.235 -14.406 1.00 1.98 H new ATOM 0 HA ARG A1067 -1.312 8.465 -14.446 1.00 1.79 H new ATOM 0 HB2 ARG A1067 -0.689 5.992 -14.846 1.00 1.63 H new ATOM 0 HB3 ARG A1067 -0.506 5.845 -13.109 1.00 1.63 H new ATOM 0 HG2 ARG A1067 -2.740 5.117 -13.588 1.00 2.72 H new ATOM 0 HG3 ARG A1067 -2.905 6.708 -12.870 1.00 2.72 H new ATOM 0 HD2 ARG A1067 -2.901 7.599 -15.338 1.00 4.07 H new ATOM 0 HD3 ARG A1067 -3.196 5.933 -15.796 1.00 4.07 H new ATOM 0 HE ARG A1067 -5.049 7.765 -14.423 1.00 5.44 H new ATOM 0 HH11 ARG A1067 -4.530 4.395 -15.396 1.00 6.20 H new ATOM 0 HH12 ARG A1067 -6.242 4.018 -15.170 1.00 6.20 H new ATOM 0 HH21 ARG A1067 -7.119 7.185 -14.143 1.00 7.73 H new ATOM 0 HH22 ARG A1067 -7.649 5.536 -14.489 1.00 7.73 H new ATOM 331 N ILE A1068 0.180 8.159 -11.535 1.00 1.33 N ATOM 332 CA ILE A1068 0.284 8.643 -10.156 1.00 1.17 C ATOM 333 C ILE A1068 1.752 8.928 -9.806 1.00 1.04 C ATOM 334 O ILE A1068 2.638 8.139 -10.148 1.00 1.08 O ATOM 335 CB ILE A1068 -0.353 7.681 -9.114 1.00 1.07 C ATOM 336 CG1 ILE A1068 -1.083 6.416 -9.627 1.00 1.40 C ATOM 337 CG2 ILE A1068 -1.324 8.488 -8.242 1.00 1.60 C ATOM 338 CD1 ILE A1068 -0.132 5.297 -10.075 1.00 1.26 C ATOM 0 H ILE A1068 0.974 7.578 -11.802 1.00 1.33 H new ATOM 0 HA ILE A1068 -0.291 9.567 -10.104 1.00 1.17 H new ATOM 0 HB ILE A1068 0.506 7.276 -8.578 1.00 1.07 H new ATOM 0 HG12 ILE A1068 -1.732 6.036 -8.838 1.00 1.40 H new ATOM 0 HG13 ILE A1068 -1.726 6.692 -10.463 1.00 1.40 H new ATOM 0 HG21 ILE A1068 -1.782 7.830 -7.503 1.00 1.60 H new ATOM 0 HG22 ILE A1068 -0.780 9.283 -7.732 1.00 1.60 H new ATOM 0 HG23 ILE A1068 -2.100 8.925 -8.870 1.00 1.60 H new ATOM 0 HD11 ILE A1068 -0.713 4.443 -10.422 1.00 1.26 H new ATOM 0 HD12 ILE A1068 0.500 5.659 -10.886 1.00 1.26 H new ATOM 0 HD13 ILE A1068 0.494 4.993 -9.236 1.00 1.26 H new ATOM 350 N SER A1069 2.018 10.047 -9.126 1.00 1.00 N ATOM 351 CA SER A1069 3.377 10.467 -8.745 1.00 0.94 C ATOM 352 C SER A1069 3.820 9.893 -7.388 1.00 0.76 C ATOM 353 O SER A1069 2.988 9.510 -6.567 1.00 0.76 O ATOM 354 CB SER A1069 3.487 11.989 -8.831 1.00 1.17 C ATOM 355 OG SER A1069 4.836 12.420 -8.730 1.00 1.99 O ATOM 0 H SER A1069 1.292 10.695 -8.820 1.00 1.00 H new ATOM 0 HA SER A1069 4.084 10.043 -9.458 1.00 0.94 H new ATOM 0 HB2 SER A1069 3.064 12.333 -9.775 1.00 1.17 H new ATOM 0 HB3 SER A1069 2.898 12.443 -8.034 1.00 1.17 H new ATOM 0 HG SER A1069 5.401 11.863 -9.305 1.00 1.99 H new ATOM 361 N HIS A1070 5.133 9.807 -7.142 1.00 0.86 N ATOM 362 CA HIS A1070 5.713 9.054 -6.017 1.00 1.05 C ATOM 363 C HIS A1070 5.206 9.486 -4.627 1.00 1.13 C ATOM 364 O HIS A1070 4.649 8.675 -3.882 1.00 1.16 O ATOM 365 CB HIS A1070 7.254 9.132 -6.060 1.00 1.32 C ATOM 366 CG HIS A1070 7.919 8.954 -7.406 1.00 2.87 C ATOM 367 ND1 HIS A1070 9.127 9.510 -7.758 1.00 3.94 N ATOM 368 CD2 HIS A1070 7.468 8.255 -8.495 1.00 4.17 C ATOM 369 CE1 HIS A1070 9.396 9.175 -9.029 1.00 5.41 C ATOM 370 NE2 HIS A1070 8.407 8.407 -9.524 1.00 5.66 N ATOM 0 H HIS A1070 5.834 10.264 -7.725 1.00 0.86 H new ATOM 0 HA HIS A1070 5.377 8.026 -6.151 1.00 1.05 H new ATOM 0 HB2 HIS A1070 7.554 10.101 -5.661 1.00 1.32 H new ATOM 0 HB3 HIS A1070 7.649 8.373 -5.385 1.00 1.32 H new ATOM 0 HD1 HIS A1070 9.719 10.081 -7.154 1.00 3.94 H new ATOM 0 HD2 HIS A1070 6.551 7.687 -8.550 1.00 4.17 H new ATOM 0 HE1 HIS A1070 10.277 9.477 -9.575 1.00 5.41 H new ATOM 378 N HIS A1071 5.344 10.767 -4.282 1.00 1.31 N ATOM 379 CA HIS A1071 4.887 11.283 -2.989 1.00 1.56 C ATOM 380 C HIS A1071 3.347 11.269 -2.887 1.00 1.48 C ATOM 381 O HIS A1071 2.797 11.001 -1.817 1.00 1.58 O ATOM 382 CB HIS A1071 5.523 12.663 -2.771 1.00 1.88 C ATOM 383 CG HIS A1071 5.147 13.316 -1.469 1.00 1.94 C ATOM 384 ND1 HIS A1071 4.249 14.345 -1.323 1.00 2.52 N ATOM 385 CD2 HIS A1071 5.630 13.018 -0.223 1.00 3.08 C ATOM 386 CE1 HIS A1071 4.169 14.643 -0.019 1.00 3.30 C ATOM 387 NE2 HIS A1071 5.010 13.874 0.696 1.00 3.44 N ATOM 0 H HIS A1071 5.771 11.471 -4.884 1.00 1.31 H new ATOM 0 HA HIS A1071 5.214 10.635 -2.176 1.00 1.56 H new ATOM 0 HB2 HIS A1071 6.607 12.562 -2.814 1.00 1.88 H new ATOM 0 HB3 HIS A1071 5.231 13.319 -3.591 1.00 1.88 H new ATOM 0 HD1 HIS A1071 3.734 14.802 -2.075 1.00 2.52 H new ATOM 0 HD2 HIS A1071 6.360 12.257 0.010 1.00 3.08 H new ATOM 0 HE1 HIS A1071 3.519 15.397 0.400 1.00 3.30 H new ATOM 395 N LYS A1072 2.629 11.421 -4.011 1.00 1.35 N ATOM 396 CA LYS A1072 1.169 11.245 -4.061 1.00 1.34 C ATOM 397 C LYS A1072 0.718 9.798 -3.811 1.00 1.15 C ATOM 398 O LYS A1072 -0.349 9.602 -3.238 1.00 1.11 O ATOM 399 CB LYS A1072 0.611 11.803 -5.386 1.00 1.37 C ATOM 400 CG LYS A1072 -0.897 12.116 -5.332 1.00 1.64 C ATOM 401 CD LYS A1072 -1.191 13.313 -4.415 1.00 3.11 C ATOM 402 CE LYS A1072 -2.684 13.600 -4.284 1.00 3.71 C ATOM 403 NZ LYS A1072 -2.922 14.756 -3.386 1.00 5.09 N ATOM 0 H LYS A1072 3.043 11.669 -4.909 1.00 1.35 H new ATOM 0 HA LYS A1072 0.749 11.819 -3.235 1.00 1.34 H new ATOM 0 HB2 LYS A1072 1.154 12.712 -5.646 1.00 1.37 H new ATOM 0 HB3 LYS A1072 0.796 11.082 -6.182 1.00 1.37 H new ATOM 0 HG2 LYS A1072 -1.262 12.328 -6.337 1.00 1.64 H new ATOM 0 HG3 LYS A1072 -1.439 11.240 -4.974 1.00 1.64 H new ATOM 0 HD2 LYS A1072 -0.774 13.120 -3.427 1.00 3.11 H new ATOM 0 HD3 LYS A1072 -0.688 14.197 -4.806 1.00 3.11 H new ATOM 0 HE2 LYS A1072 -3.107 13.805 -5.267 1.00 3.71 H new ATOM 0 HE3 LYS A1072 -3.195 12.720 -3.894 1.00 3.71 H new ATOM 0 HZ1 LYS A1072 -3.944 14.933 -3.312 1.00 5.09 H new ATOM 0 HZ2 LYS A1072 -2.537 14.548 -2.443 1.00 5.09 H new ATOM 0 HZ3 LYS A1072 -2.452 15.599 -3.773 1.00 5.09 H new ATOM 417 N ILE A1073 1.523 8.791 -4.157 1.00 1.05 N ATOM 418 CA ILE A1073 1.257 7.379 -3.822 1.00 0.89 C ATOM 419 C ILE A1073 1.358 7.142 -2.308 1.00 0.98 C ATOM 420 O ILE A1073 0.469 6.513 -1.732 1.00 0.97 O ATOM 421 CB ILE A1073 2.168 6.448 -4.656 1.00 0.76 C ATOM 422 CG1 ILE A1073 1.648 6.423 -6.108 1.00 0.59 C ATOM 423 CG2 ILE A1073 2.228 5.015 -4.098 1.00 0.81 C ATOM 424 CD1 ILE A1073 2.710 5.996 -7.123 1.00 0.61 C ATOM 0 H ILE A1073 2.387 8.928 -4.682 1.00 1.05 H new ATOM 0 HA ILE A1073 0.230 7.132 -4.092 1.00 0.89 H new ATOM 0 HB ILE A1073 3.183 6.843 -4.611 1.00 0.76 H new ATOM 0 HG12 ILE A1073 0.800 5.741 -6.171 1.00 0.59 H new ATOM 0 HG13 ILE A1073 1.280 7.415 -6.372 1.00 0.59 H new ATOM 0 HG21 ILE A1073 2.882 4.408 -4.724 1.00 0.81 H new ATOM 0 HG22 ILE A1073 2.618 5.037 -3.080 1.00 0.81 H new ATOM 0 HG23 ILE A1073 1.227 4.584 -4.094 1.00 0.81 H new ATOM 0 HD11 ILE A1073 2.279 6.000 -8.124 1.00 0.61 H new ATOM 0 HD12 ILE A1073 3.549 6.691 -7.087 1.00 0.61 H new ATOM 0 HD13 ILE A1073 3.060 4.992 -6.883 1.00 0.61 H new ATOM 436 N LEU A1074 2.379 7.709 -1.652 1.00 1.09 N ATOM 437 CA LEU A1074 2.497 7.708 -0.183 1.00 1.14 C ATOM 438 C LEU A1074 1.263 8.361 0.472 1.00 1.11 C ATOM 439 O LEU A1074 0.675 7.795 1.401 1.00 1.05 O ATOM 440 CB LEU A1074 3.839 8.379 0.181 1.00 1.28 C ATOM 441 CG LEU A1074 4.158 8.548 1.682 1.00 1.51 C ATOM 442 CD1 LEU A1074 5.666 8.741 1.843 1.00 2.85 C ATOM 443 CD2 LEU A1074 3.499 9.778 2.317 1.00 1.79 C ATOM 0 H LEU A1074 3.149 8.183 -2.124 1.00 1.09 H new ATOM 0 HA LEU A1074 2.510 6.693 0.214 1.00 1.14 H new ATOM 0 HB2 LEU A1074 4.642 7.797 -0.272 1.00 1.28 H new ATOM 0 HB3 LEU A1074 3.860 9.365 -0.282 1.00 1.28 H new ATOM 0 HG LEU A1074 3.776 7.654 2.176 1.00 1.51 H new ATOM 0 HD11 LEU A1074 5.907 8.862 2.899 1.00 2.85 H new ATOM 0 HD12 LEU A1074 6.188 7.869 1.449 1.00 2.85 H new ATOM 0 HD13 LEU A1074 5.980 9.630 1.295 1.00 2.85 H new ATOM 0 HD21 LEU A1074 3.768 9.831 3.372 1.00 1.79 H new ATOM 0 HD22 LEU A1074 3.844 10.679 1.809 1.00 1.79 H new ATOM 0 HD23 LEU A1074 2.416 9.700 2.222 1.00 1.79 H new ATOM 455 N ALA A1075 0.838 9.511 -0.065 1.00 1.20 N ATOM 456 CA ALA A1075 -0.395 10.194 0.317 1.00 1.20 C ATOM 457 C ALA A1075 -1.614 9.267 0.209 1.00 1.14 C ATOM 458 O ALA A1075 -2.140 8.881 1.249 1.00 1.24 O ATOM 459 CB ALA A1075 -0.521 11.493 -0.490 1.00 1.32 C ATOM 0 H ALA A1075 1.357 10.001 -0.794 1.00 1.20 H new ATOM 0 HA ALA A1075 -0.356 10.470 1.371 1.00 1.20 H new ATOM 0 HB1 ALA A1075 -1.440 12.008 -0.209 1.00 1.32 H new ATOM 0 HB2 ALA A1075 0.334 12.136 -0.280 1.00 1.32 H new ATOM 0 HB3 ALA A1075 -0.547 11.259 -1.554 1.00 1.32 H new ATOM 465 N ILE A1076 -2.036 8.852 -0.995 1.00 1.02 N ATOM 466 CA ILE A1076 -3.325 8.156 -1.178 1.00 0.99 C ATOM 467 C ILE A1076 -3.443 6.864 -0.361 1.00 0.86 C ATOM 468 O ILE A1076 -4.530 6.572 0.131 1.00 0.90 O ATOM 469 CB ILE A1076 -3.689 7.915 -2.662 1.00 1.00 C ATOM 470 CG1 ILE A1076 -2.693 6.985 -3.387 1.00 0.87 C ATOM 471 CG2 ILE A1076 -3.873 9.269 -3.375 1.00 1.20 C ATOM 472 CD1 ILE A1076 -3.077 6.645 -4.832 1.00 0.81 C ATOM 0 H ILE A1076 -1.507 8.985 -1.857 1.00 1.02 H new ATOM 0 HA ILE A1076 -4.064 8.851 -0.779 1.00 0.99 H new ATOM 0 HB ILE A1076 -4.637 7.377 -2.696 1.00 1.00 H new ATOM 0 HG12 ILE A1076 -1.710 7.456 -3.387 1.00 0.87 H new ATOM 0 HG13 ILE A1076 -2.603 6.058 -2.821 1.00 0.87 H new ATOM 0 HG21 ILE A1076 -4.129 9.098 -4.420 1.00 1.20 H new ATOM 0 HG22 ILE A1076 -4.674 9.829 -2.892 1.00 1.20 H new ATOM 0 HG23 ILE A1076 -2.946 9.839 -3.318 1.00 1.20 H new ATOM 0 HD11 ILE A1076 -2.322 5.988 -5.264 1.00 0.81 H new ATOM 0 HD12 ILE A1076 -4.044 6.143 -4.843 1.00 0.81 H new ATOM 0 HD13 ILE A1076 -3.138 7.562 -5.418 1.00 0.81 H new ATOM 484 N VAL A1077 -2.345 6.130 -0.136 1.00 0.78 N ATOM 485 CA VAL A1077 -2.337 4.955 0.753 1.00 0.75 C ATOM 486 C VAL A1077 -2.672 5.346 2.201 1.00 0.70 C ATOM 487 O VAL A1077 -3.551 4.733 2.812 1.00 0.77 O ATOM 488 CB VAL A1077 -0.989 4.210 0.638 1.00 0.80 C ATOM 489 CG1 VAL A1077 -0.842 3.085 1.667 1.00 0.91 C ATOM 490 CG2 VAL A1077 -0.842 3.570 -0.751 1.00 0.85 C ATOM 0 H VAL A1077 -1.440 6.331 -0.562 1.00 0.78 H new ATOM 0 HA VAL A1077 -3.121 4.268 0.434 1.00 0.75 H new ATOM 0 HB VAL A1077 -0.222 4.963 0.816 1.00 0.80 H new ATOM 0 HG11 VAL A1077 0.124 2.598 1.538 1.00 0.91 H new ATOM 0 HG12 VAL A1077 -0.907 3.501 2.672 1.00 0.91 H new ATOM 0 HG13 VAL A1077 -1.639 2.355 1.524 1.00 0.91 H new ATOM 0 HG21 VAL A1077 0.114 3.050 -0.813 1.00 0.85 H new ATOM 0 HG22 VAL A1077 -1.653 2.859 -0.912 1.00 0.85 H new ATOM 0 HG23 VAL A1077 -0.883 4.346 -1.515 1.00 0.85 H new ATOM 500 N GLY A1078 -2.056 6.404 2.744 1.00 0.66 N ATOM 501 CA GLY A1078 -2.405 6.905 4.084 1.00 0.61 C ATOM 502 C GLY A1078 -3.750 7.636 4.163 1.00 0.69 C ATOM 503 O GLY A1078 -4.376 7.668 5.223 1.00 0.99 O ATOM 0 H GLY A1078 -1.316 6.930 2.279 1.00 0.66 H new ATOM 0 HA2 GLY A1078 -2.422 6.065 4.778 1.00 0.61 H new ATOM 0 HA3 GLY A1078 -1.619 7.581 4.421 1.00 0.61 H new ATOM 507 N THR A1079 -4.220 8.188 3.049 1.00 0.70 N ATOM 508 CA THR A1079 -5.545 8.815 2.893 1.00 1.00 C ATOM 509 C THR A1079 -6.682 7.777 2.771 1.00 1.05 C ATOM 510 O THR A1079 -7.815 8.071 3.150 1.00 1.41 O ATOM 511 CB THR A1079 -5.535 9.760 1.675 1.00 1.35 C ATOM 512 OG1 THR A1079 -4.382 10.573 1.627 1.00 1.79 O ATOM 513 CG2 THR A1079 -6.624 10.802 1.630 1.00 1.75 C ATOM 0 H THR A1079 -3.672 8.216 2.189 1.00 0.70 H new ATOM 0 HA THR A1079 -5.745 9.389 3.798 1.00 1.00 H new ATOM 0 HB THR A1079 -5.633 9.034 0.868 1.00 1.35 H new ATOM 0 HG1 THR A1079 -3.596 10.015 1.451 1.00 1.79 H new ATOM 0 HG21 THR A1079 -6.513 11.405 0.729 1.00 1.75 H new ATOM 0 HG22 THR A1079 -7.597 10.311 1.621 1.00 1.75 H new ATOM 0 HG23 THR A1079 -6.550 11.444 2.508 1.00 1.75 H new ATOM 521 N ALA A1080 -6.401 6.552 2.309 1.00 0.83 N ATOM 522 CA ALA A1080 -7.367 5.445 2.210 1.00 0.91 C ATOM 523 C ALA A1080 -7.552 4.695 3.546 1.00 0.93 C ATOM 524 O ALA A1080 -8.674 4.485 3.996 1.00 1.21 O ATOM 525 CB ALA A1080 -6.924 4.506 1.082 1.00 0.92 C ATOM 0 H ALA A1080 -5.469 6.294 1.984 1.00 0.83 H new ATOM 0 HA ALA A1080 -8.348 5.857 1.975 1.00 0.91 H new ATOM 0 HB1 ALA A1080 -7.631 3.681 0.997 1.00 0.92 H new ATOM 0 HB2 ALA A1080 -6.894 5.056 0.141 1.00 0.92 H new ATOM 0 HB3 ALA A1080 -5.932 4.113 1.304 1.00 0.92 H new ATOM 531 N GLU A1081 -6.457 4.377 4.244 1.00 0.85 N ATOM 532 CA GLU A1081 -6.477 3.870 5.633 1.00 0.97 C ATOM 533 C GLU A1081 -6.637 5.026 6.651 1.00 1.19 C ATOM 534 O GLU A1081 -6.431 4.856 7.854 1.00 1.52 O ATOM 535 CB GLU A1081 -5.228 3.004 5.898 1.00 1.09 C ATOM 536 CG GLU A1081 -5.404 1.539 5.452 1.00 1.64 C ATOM 537 CD GLU A1081 -6.241 0.682 6.422 1.00 2.25 C ATOM 538 OE1 GLU A1081 -7.038 1.244 7.207 1.00 3.44 O ATOM 539 OE2 GLU A1081 -6.072 -0.562 6.396 1.00 2.63 O ATOM 0 H GLU A1081 -5.516 4.463 3.861 1.00 0.85 H new ATOM 0 HA GLU A1081 -7.349 3.230 5.767 1.00 0.97 H new ATOM 0 HB2 GLU A1081 -4.375 3.437 5.375 1.00 1.09 H new ATOM 0 HB3 GLU A1081 -4.995 3.028 6.963 1.00 1.09 H new ATOM 0 HG2 GLU A1081 -5.877 1.524 4.470 1.00 1.64 H new ATOM 0 HG3 GLU A1081 -4.420 1.084 5.339 1.00 1.64 H new ATOM 546 N SER A1082 -7.038 6.219 6.188 1.00 1.26 N ATOM 547 CA SER A1082 -7.467 7.312 7.067 1.00 1.53 C ATOM 548 C SER A1082 -8.744 6.919 7.807 1.00 1.48 C ATOM 549 O SER A1082 -8.850 7.211 8.994 1.00 1.64 O ATOM 550 CB SER A1082 -7.656 8.607 6.284 1.00 1.66 C ATOM 551 OG SER A1082 -8.074 9.655 7.136 1.00 2.10 O ATOM 0 H SER A1082 -7.073 6.451 5.195 1.00 1.26 H new ATOM 0 HA SER A1082 -6.684 7.492 7.804 1.00 1.53 H new ATOM 0 HB2 SER A1082 -6.721 8.881 5.795 1.00 1.66 H new ATOM 0 HB3 SER A1082 -8.395 8.456 5.497 1.00 1.66 H new ATOM 0 HG SER A1082 -7.744 10.510 6.789 1.00 2.10 H new ATOM 557 N ASN A1083 -9.660 6.160 7.185 1.00 1.54 N ATOM 558 CA ASN A1083 -10.761 5.529 7.924 1.00 1.61 C ATOM 559 C ASN A1083 -10.203 4.577 9.012 1.00 1.92 C ATOM 560 O ASN A1083 -10.695 4.560 10.135 1.00 2.32 O ATOM 561 CB ASN A1083 -11.692 4.811 6.928 1.00 1.85 C ATOM 562 CG ASN A1083 -12.996 4.356 7.570 1.00 2.73 C ATOM 563 OD1 ASN A1083 -13.504 4.959 8.506 1.00 3.46 O ATOM 564 ND2 ASN A1083 -13.604 3.308 7.067 1.00 3.40 N ATOM 0 H ASN A1083 -9.660 5.971 6.183 1.00 1.54 H new ATOM 0 HA ASN A1083 -11.349 6.285 8.444 1.00 1.61 H new ATOM 0 HB2 ASN A1083 -11.914 5.480 6.097 1.00 1.85 H new ATOM 0 HB3 ASN A1083 -11.175 3.946 6.511 1.00 1.85 H new ATOM 0 HD21 ASN A1083 -14.495 3.000 7.456 1.00 3.40 H new ATOM 0 HD22 ASN A1083 -13.186 2.801 6.287 1.00 3.40 H new ATOM 571 N SER A1084 -9.082 3.904 8.723 1.00 2.91 N ATOM 572 CA SER A1084 -8.276 3.108 9.671 1.00 3.91 C ATOM 573 C SER A1084 -8.952 1.793 10.047 1.00 2.90 C ATOM 574 O SER A1084 -9.308 1.523 11.197 1.00 3.68 O ATOM 575 CB SER A1084 -7.790 3.924 10.879 1.00 5.94 C ATOM 576 OG SER A1084 -7.217 5.161 10.479 1.00 7.14 O ATOM 0 H SER A1084 -8.691 3.896 7.781 1.00 2.91 H new ATOM 0 HA SER A1084 -7.366 2.826 9.142 1.00 3.91 H new ATOM 0 HB2 SER A1084 -8.626 4.111 11.553 1.00 5.94 H new ATOM 0 HB3 SER A1084 -7.054 3.345 11.437 1.00 5.94 H new ATOM 0 HG SER A1084 -6.906 5.093 9.552 1.00 7.14 H new ATOM 582 N GLU A1085 -9.119 0.961 9.024 1.00 2.07 N ATOM 583 CA GLU A1085 -9.752 -0.360 9.054 1.00 2.03 C ATOM 584 C GLU A1085 -8.906 -1.429 9.745 1.00 1.97 C ATOM 585 O GLU A1085 -9.411 -2.516 10.039 1.00 2.57 O ATOM 586 CB GLU A1085 -10.041 -0.768 7.603 1.00 2.84 C ATOM 587 CG GLU A1085 -11.273 -0.045 7.063 1.00 3.90 C ATOM 588 CD GLU A1085 -12.567 -0.695 7.588 1.00 5.34 C ATOM 589 OE1 GLU A1085 -12.907 -0.520 8.786 1.00 5.52 O ATOM 590 OE2 GLU A1085 -13.249 -1.438 6.834 1.00 6.87 O ATOM 0 H GLU A1085 -8.795 1.205 8.088 1.00 2.07 H new ATOM 0 HA GLU A1085 -10.666 -0.287 9.643 1.00 2.03 H new ATOM 0 HB2 GLU A1085 -9.178 -0.538 6.979 1.00 2.84 H new ATOM 0 HB3 GLU A1085 -10.195 -1.846 7.549 1.00 2.84 H new ATOM 0 HG2 GLU A1085 -11.243 1.004 7.358 1.00 3.90 H new ATOM 0 HG3 GLU A1085 -11.265 -0.070 5.973 1.00 3.90 H new ATOM 597 N HIS A1086 -7.646 -1.105 10.030 1.00 1.78 N ATOM 598 CA HIS A1086 -6.721 -1.902 10.823 1.00 1.82 C ATOM 599 C HIS A1086 -5.927 -0.989 11.780 1.00 1.57 C ATOM 600 O HIS A1086 -5.770 0.200 11.476 1.00 1.48 O ATOM 601 CB HIS A1086 -5.775 -2.653 9.869 1.00 2.26 C ATOM 602 CG HIS A1086 -6.492 -3.458 8.816 1.00 2.69 C ATOM 603 ND1 HIS A1086 -6.781 -3.036 7.540 1.00 3.84 N ATOM 604 CD2 HIS A1086 -7.022 -4.710 8.962 1.00 2.70 C ATOM 605 CE1 HIS A1086 -7.448 -4.020 6.919 1.00 4.11 C ATOM 606 NE2 HIS A1086 -7.630 -5.067 7.746 1.00 3.40 N ATOM 0 H HIS A1086 -7.225 -0.238 9.697 1.00 1.78 H new ATOM 0 HA HIS A1086 -7.269 -2.625 11.427 1.00 1.82 H new ATOM 0 HB2 HIS A1086 -5.120 -1.933 9.380 1.00 2.26 H new ATOM 0 HB3 HIS A1086 -5.138 -3.319 10.452 1.00 2.26 H new ATOM 0 HD1 HIS A1086 -6.532 -2.133 7.136 1.00 3.84 H new ATOM 0 HD2 HIS A1086 -6.981 -5.317 9.854 1.00 2.70 H new ATOM 0 HE1 HIS A1086 -7.792 -3.978 5.896 1.00 4.11 H new ATOM 614 N PRO A1087 -5.342 -1.494 12.885 1.00 1.69 N ATOM 615 CA PRO A1087 -4.466 -0.688 13.744 1.00 1.75 C ATOM 616 C PRO A1087 -3.182 -0.251 13.024 1.00 1.59 C ATOM 617 O PRO A1087 -2.708 0.870 13.218 1.00 1.83 O ATOM 618 CB PRO A1087 -4.169 -1.564 14.963 1.00 2.06 C ATOM 619 CG PRO A1087 -4.331 -2.987 14.434 1.00 2.29 C ATOM 620 CD PRO A1087 -5.461 -2.847 13.414 1.00 1.98 C ATOM 0 HA PRO A1087 -4.950 0.246 14.031 1.00 1.75 H new ATOM 0 HB2 PRO A1087 -3.163 -1.391 15.345 1.00 2.06 H new ATOM 0 HB3 PRO A1087 -4.860 -1.360 15.781 1.00 2.06 H new ATOM 0 HG2 PRO A1087 -3.414 -3.353 13.973 1.00 2.29 H new ATOM 0 HG3 PRO A1087 -4.589 -3.686 15.229 1.00 2.29 H new ATOM 0 HD2 PRO A1087 -5.368 -3.588 12.620 1.00 1.98 H new ATOM 0 HD3 PRO A1087 -6.433 -3.002 13.882 1.00 1.98 H new ATOM 628 N LEU A1088 -2.650 -1.081 12.118 1.00 1.38 N ATOM 629 CA LEU A1088 -1.559 -0.674 11.225 1.00 1.31 C ATOM 630 C LEU A1088 -2.022 0.371 10.191 1.00 1.19 C ATOM 631 O LEU A1088 -1.207 1.172 9.743 1.00 1.26 O ATOM 632 CB LEU A1088 -0.905 -1.909 10.570 1.00 1.42 C ATOM 633 CG LEU A1088 0.227 -2.587 11.376 1.00 1.87 C ATOM 634 CD1 LEU A1088 1.406 -1.640 11.630 1.00 3.37 C ATOM 635 CD2 LEU A1088 -0.232 -3.154 12.719 1.00 1.99 C ATOM 0 H LEU A1088 -2.960 -2.044 11.984 1.00 1.38 H new ATOM 0 HA LEU A1088 -0.794 -0.181 11.825 1.00 1.31 H new ATOM 0 HB2 LEU A1088 -1.682 -2.649 10.381 1.00 1.42 H new ATOM 0 HB3 LEU A1088 -0.505 -1.612 9.600 1.00 1.42 H new ATOM 0 HG LEU A1088 0.546 -3.415 10.743 1.00 1.87 H new ATOM 0 HD11 LEU A1088 2.175 -2.161 12.199 1.00 3.37 H new ATOM 0 HD12 LEU A1088 1.820 -1.311 10.677 1.00 3.37 H new ATOM 0 HD13 LEU A1088 1.062 -0.773 12.195 1.00 3.37 H new ATOM 0 HD21 LEU A1088 0.615 -3.614 13.228 1.00 1.99 H new ATOM 0 HD22 LEU A1088 -0.633 -2.350 13.336 1.00 1.99 H new ATOM 0 HD23 LEU A1088 -1.006 -3.903 12.552 1.00 1.99 H new ATOM 647 N GLY A1089 -3.320 0.439 9.874 1.00 1.11 N ATOM 648 CA GLY A1089 -3.909 1.531 9.092 1.00 1.03 C ATOM 649 C GLY A1089 -3.760 2.875 9.812 1.00 1.00 C ATOM 650 O GLY A1089 -3.251 3.835 9.232 1.00 0.92 O ATOM 0 H GLY A1089 -3.997 -0.270 10.156 1.00 1.11 H new ATOM 0 HA2 GLY A1089 -3.427 1.583 8.116 1.00 1.03 H new ATOM 0 HA3 GLY A1089 -4.965 1.326 8.915 1.00 1.03 H new ATOM 654 N THR A1090 -4.070 2.917 11.116 1.00 1.15 N ATOM 655 CA THR A1090 -3.797 4.081 11.980 1.00 1.24 C ATOM 656 C THR A1090 -2.309 4.467 11.973 1.00 1.17 C ATOM 657 O THR A1090 -1.976 5.649 11.897 1.00 1.19 O ATOM 658 CB THR A1090 -4.208 3.831 13.444 1.00 1.48 C ATOM 659 OG1 THR A1090 -5.241 2.876 13.583 1.00 2.35 O ATOM 660 CG2 THR A1090 -4.679 5.111 14.125 1.00 1.81 C ATOM 0 H THR A1090 -4.519 2.143 11.605 1.00 1.15 H new ATOM 0 HA THR A1090 -4.395 4.892 11.563 1.00 1.24 H new ATOM 0 HB THR A1090 -3.304 3.449 13.918 1.00 1.48 H new ATOM 0 HG1 THR A1090 -5.455 2.761 14.532 1.00 2.35 H new ATOM 0 HG21 THR A1090 -4.960 4.893 15.155 1.00 1.81 H new ATOM 0 HG22 THR A1090 -3.874 5.845 14.116 1.00 1.81 H new ATOM 0 HG23 THR A1090 -5.541 5.511 13.591 1.00 1.81 H new ATOM 668 N ALA A1091 -1.403 3.482 11.991 1.00 1.13 N ATOM 669 CA ALA A1091 0.041 3.727 11.939 1.00 1.12 C ATOM 670 C ALA A1091 0.507 4.284 10.576 1.00 0.94 C ATOM 671 O ALA A1091 1.366 5.169 10.542 1.00 0.97 O ATOM 672 CB ALA A1091 0.787 2.440 12.311 1.00 1.22 C ATOM 0 H ALA A1091 -1.651 2.494 12.042 1.00 1.13 H new ATOM 0 HA ALA A1091 0.278 4.504 12.666 1.00 1.12 H new ATOM 0 HB1 ALA A1091 1.862 2.619 12.273 1.00 1.22 H new ATOM 0 HB2 ALA A1091 0.505 2.134 13.319 1.00 1.22 H new ATOM 0 HB3 ALA A1091 0.525 1.651 11.606 1.00 1.22 H new ATOM 678 N ILE A1092 -0.074 3.810 9.465 1.00 0.81 N ATOM 679 CA ILE A1092 0.174 4.330 8.110 1.00 0.70 C ATOM 680 C ILE A1092 -0.322 5.772 7.994 1.00 0.65 C ATOM 681 O ILE A1092 0.449 6.634 7.587 1.00 0.63 O ATOM 682 CB ILE A1092 -0.466 3.422 7.029 1.00 0.70 C ATOM 683 CG1 ILE A1092 0.266 2.063 6.943 1.00 0.88 C ATOM 684 CG2 ILE A1092 -0.452 4.076 5.629 1.00 0.73 C ATOM 685 CD1 ILE A1092 -0.538 0.988 6.202 1.00 0.95 C ATOM 0 H ILE A1092 -0.742 3.040 9.482 1.00 0.81 H new ATOM 0 HA ILE A1092 1.250 4.325 7.935 1.00 0.70 H new ATOM 0 HB ILE A1092 -1.501 3.272 7.335 1.00 0.70 H new ATOM 0 HG12 ILE A1092 1.222 2.204 6.439 1.00 0.88 H new ATOM 0 HG13 ILE A1092 0.486 1.712 7.951 1.00 0.88 H new ATOM 0 HG21 ILE A1092 -0.911 3.400 4.907 1.00 0.73 H new ATOM 0 HG22 ILE A1092 -1.012 5.011 5.658 1.00 0.73 H new ATOM 0 HG23 ILE A1092 0.577 4.279 5.332 1.00 0.73 H new ATOM 0 HD11 ILE A1092 0.032 0.059 6.177 1.00 0.95 H new ATOM 0 HD12 ILE A1092 -1.483 0.820 6.718 1.00 0.95 H new ATOM 0 HD13 ILE A1092 -0.736 1.320 5.183 1.00 0.95 H new ATOM 697 N THR A1093 -1.576 6.066 8.360 1.00 0.71 N ATOM 698 CA THR A1093 -2.133 7.422 8.191 1.00 0.78 C ATOM 699 C THR A1093 -1.363 8.452 9.036 1.00 0.82 C ATOM 700 O THR A1093 -1.007 9.517 8.527 1.00 0.83 O ATOM 701 CB THR A1093 -3.660 7.425 8.400 1.00 0.96 C ATOM 702 OG1 THR A1093 -4.246 8.556 7.801 1.00 2.19 O ATOM 703 CG2 THR A1093 -4.125 7.402 9.849 1.00 1.45 C ATOM 0 H THR A1093 -2.222 5.393 8.772 1.00 0.71 H new ATOM 0 HA THR A1093 -1.987 7.742 7.159 1.00 0.78 H new ATOM 0 HB THR A1093 -3.979 6.492 7.936 1.00 0.96 H new ATOM 0 HG1 THR A1093 -4.232 8.454 6.826 1.00 2.19 H new ATOM 0 HG21 THR A1093 -5.215 7.406 9.882 1.00 1.45 H new ATOM 0 HG22 THR A1093 -3.751 6.502 10.337 1.00 1.45 H new ATOM 0 HG23 THR A1093 -3.743 8.281 10.368 1.00 1.45 H new ATOM 711 N LYS A1094 -0.968 8.085 10.267 1.00 0.90 N ATOM 712 CA LYS A1094 -0.121 8.907 11.155 1.00 1.01 C ATOM 713 C LYS A1094 1.308 9.110 10.641 1.00 0.93 C ATOM 714 O LYS A1094 1.843 10.204 10.821 1.00 1.01 O ATOM 715 CB LYS A1094 -0.149 8.335 12.584 1.00 1.28 C ATOM 716 CG LYS A1094 -1.504 8.676 13.224 1.00 1.82 C ATOM 717 CD LYS A1094 -1.801 7.954 14.546 1.00 2.56 C ATOM 718 CE LYS A1094 -0.997 8.508 15.726 1.00 2.83 C ATOM 719 NZ LYS A1094 -1.646 8.192 17.020 1.00 3.62 N ATOM 0 H LYS A1094 -1.232 7.192 10.683 1.00 0.90 H new ATOM 0 HA LYS A1094 -0.550 9.909 11.166 1.00 1.01 H new ATOM 0 HB2 LYS A1094 -0.003 7.255 12.562 1.00 1.28 H new ATOM 0 HB3 LYS A1094 0.665 8.755 13.175 1.00 1.28 H new ATOM 0 HG2 LYS A1094 -1.546 9.751 13.398 1.00 1.82 H new ATOM 0 HG3 LYS A1094 -2.294 8.438 12.512 1.00 1.82 H new ATOM 0 HD2 LYS A1094 -2.865 8.037 14.768 1.00 2.56 H new ATOM 0 HD3 LYS A1094 -1.582 6.893 14.431 1.00 2.56 H new ATOM 0 HE2 LYS A1094 0.009 8.090 15.711 1.00 2.83 H new ATOM 0 HE3 LYS A1094 -0.895 9.588 15.623 1.00 2.83 H new ATOM 0 HZ1 LYS A1094 -1.076 8.581 17.798 1.00 3.62 H new ATOM 0 HZ2 LYS A1094 -2.597 8.612 17.043 1.00 3.62 H new ATOM 0 HZ3 LYS A1094 -1.721 7.160 17.128 1.00 3.62 H new ATOM 733 N TYR A1095 1.920 8.129 9.969 1.00 0.85 N ATOM 734 CA TYR A1095 3.190 8.341 9.259 1.00 0.85 C ATOM 735 C TYR A1095 3.003 9.255 8.034 1.00 0.79 C ATOM 736 O TYR A1095 3.704 10.256 7.889 1.00 0.90 O ATOM 737 CB TYR A1095 3.806 6.989 8.854 1.00 0.84 C ATOM 738 CG TYR A1095 4.901 7.132 7.810 1.00 0.93 C ATOM 739 CD1 TYR A1095 6.081 7.837 8.121 1.00 1.82 C ATOM 740 CD2 TYR A1095 4.673 6.696 6.489 1.00 2.04 C ATOM 741 CE1 TYR A1095 7.003 8.156 7.106 1.00 1.99 C ATOM 742 CE2 TYR A1095 5.602 6.999 5.476 1.00 2.28 C ATOM 743 CZ TYR A1095 6.754 7.756 5.777 1.00 1.61 C ATOM 744 OH TYR A1095 7.603 8.114 4.780 1.00 2.09 O ATOM 0 H TYR A1095 1.557 7.178 9.901 1.00 0.85 H new ATOM 0 HA TYR A1095 3.879 8.845 9.937 1.00 0.85 H new ATOM 0 HB2 TYR A1095 4.215 6.501 9.739 1.00 0.84 H new ATOM 0 HB3 TYR A1095 3.022 6.339 8.465 1.00 0.84 H new ATOM 0 HD1 TYR A1095 6.279 8.133 9.141 1.00 1.82 H new ATOM 0 HD2 TYR A1095 3.784 6.129 6.254 1.00 2.04 H new ATOM 0 HE1 TYR A1095 7.901 8.707 7.345 1.00 1.99 H new ATOM 0 HE2 TYR A1095 5.433 6.652 4.467 1.00 2.28 H new ATOM 0 HH TYR A1095 7.412 7.581 3.980 1.00 2.09 H new ATOM 754 N CYS A1096 2.025 8.961 7.172 1.00 0.69 N ATOM 755 CA CYS A1096 1.822 9.708 5.935 1.00 0.68 C ATOM 756 C CYS A1096 1.508 11.182 6.208 1.00 0.72 C ATOM 757 O CYS A1096 2.175 12.035 5.631 1.00 0.76 O ATOM 758 CB CYS A1096 0.751 9.029 5.073 1.00 0.73 C ATOM 759 SG CYS A1096 1.375 7.424 4.487 1.00 2.29 S ATOM 0 H CYS A1096 1.358 8.203 7.314 1.00 0.69 H new ATOM 0 HA CYS A1096 2.754 9.699 5.370 1.00 0.68 H new ATOM 0 HB2 CYS A1096 -0.162 8.887 5.652 1.00 0.73 H new ATOM 0 HB3 CYS A1096 0.495 9.664 4.225 1.00 0.73 H new ATOM 0 HG CYS A1096 1.213 7.339 3.200 1.00 2.29 H new ATOM 765 N LYS A1097 0.593 11.523 7.131 1.00 0.76 N ATOM 766 CA LYS A1097 0.283 12.936 7.441 1.00 0.85 C ATOM 767 C LYS A1097 1.505 13.713 7.953 1.00 0.85 C ATOM 768 O LYS A1097 1.610 14.911 7.703 1.00 0.91 O ATOM 769 CB LYS A1097 -0.923 13.035 8.406 1.00 1.01 C ATOM 770 CG LYS A1097 -0.605 12.790 9.895 1.00 1.46 C ATOM 771 CD LYS A1097 -0.211 14.067 10.666 1.00 1.59 C ATOM 772 CE LYS A1097 0.427 13.697 12.009 1.00 2.74 C ATOM 773 NZ LYS A1097 0.924 14.884 12.743 1.00 3.16 N ATOM 0 H LYS A1097 0.056 10.847 7.674 1.00 0.76 H new ATOM 0 HA LYS A1097 0.000 13.418 6.505 1.00 0.85 H new ATOM 0 HB2 LYS A1097 -1.366 14.026 8.306 1.00 1.01 H new ATOM 0 HB3 LYS A1097 -1.678 12.315 8.091 1.00 1.01 H new ATOM 0 HG2 LYS A1097 -1.476 12.342 10.374 1.00 1.46 H new ATOM 0 HG3 LYS A1097 0.207 12.067 9.969 1.00 1.46 H new ATOM 0 HD2 LYS A1097 0.488 14.658 10.073 1.00 1.59 H new ATOM 0 HD3 LYS A1097 -1.092 14.687 10.832 1.00 1.59 H new ATOM 0 HE2 LYS A1097 -0.305 13.173 12.624 1.00 2.74 H new ATOM 0 HE3 LYS A1097 1.253 13.007 11.838 1.00 2.74 H new ATOM 0 HZ1 LYS A1097 1.347 14.583 13.644 1.00 3.16 H new ATOM 0 HZ2 LYS A1097 1.642 15.371 12.170 1.00 3.16 H new ATOM 0 HZ3 LYS A1097 0.133 15.532 12.931 1.00 3.16 H new ATOM 787 N GLN A1098 2.427 13.033 8.640 1.00 0.81 N ATOM 788 CA GLN A1098 3.666 13.602 9.170 1.00 0.83 C ATOM 789 C GLN A1098 4.658 13.929 8.036 1.00 0.79 C ATOM 790 O GLN A1098 5.221 15.030 8.005 1.00 0.88 O ATOM 791 CB GLN A1098 4.191 12.635 10.255 1.00 0.89 C ATOM 792 CG GLN A1098 5.581 12.966 10.822 1.00 1.61 C ATOM 793 CD GLN A1098 6.712 12.297 10.040 1.00 2.89 C ATOM 794 OE1 GLN A1098 7.351 12.900 9.186 1.00 3.58 O ATOM 795 NE2 GLN A1098 6.996 11.036 10.290 1.00 4.09 N ATOM 0 H GLN A1098 2.327 12.040 8.848 1.00 0.81 H new ATOM 0 HA GLN A1098 3.502 14.569 9.647 1.00 0.83 H new ATOM 0 HB2 GLN A1098 3.477 12.619 11.078 1.00 0.89 H new ATOM 0 HB3 GLN A1098 4.219 11.629 9.837 1.00 0.89 H new ATOM 0 HG2 GLN A1098 5.726 14.046 10.810 1.00 1.61 H new ATOM 0 HG3 GLN A1098 5.629 12.650 11.864 1.00 1.61 H new ATOM 0 HE21 GLN A1098 6.470 10.526 10.999 1.00 4.09 H new ATOM 0 HE22 GLN A1098 7.742 10.569 9.775 1.00 4.09 H new ATOM 804 N GLU A1099 4.786 13.045 7.042 1.00 0.75 N ATOM 805 CA GLU A1099 5.545 13.302 5.807 1.00 0.80 C ATOM 806 C GLU A1099 4.855 14.325 4.878 1.00 0.88 C ATOM 807 O GLU A1099 5.548 15.096 4.214 1.00 0.97 O ATOM 808 CB GLU A1099 5.840 11.960 5.112 1.00 0.92 C ATOM 809 CG GLU A1099 6.607 12.072 3.783 1.00 1.25 C ATOM 810 CD GLU A1099 7.886 12.915 3.879 1.00 1.47 C ATOM 811 OE1 GLU A1099 8.765 12.608 4.723 1.00 1.65 O ATOM 812 OE2 GLU A1099 8.018 13.898 3.105 1.00 2.48 O ATOM 0 H GLU A1099 4.361 12.118 7.069 1.00 0.75 H new ATOM 0 HA GLU A1099 6.492 13.774 6.070 1.00 0.80 H new ATOM 0 HB2 GLU A1099 6.414 11.333 5.794 1.00 0.92 H new ATOM 0 HB3 GLU A1099 4.896 11.448 4.927 1.00 0.92 H new ATOM 0 HG2 GLU A1099 6.867 11.071 3.438 1.00 1.25 H new ATOM 0 HG3 GLU A1099 5.950 12.508 3.030 1.00 1.25 H new ATOM 819 N LEU A1100 3.518 14.417 4.874 1.00 0.93 N ATOM 820 CA LEU A1100 2.776 15.506 4.210 1.00 1.04 C ATOM 821 C LEU A1100 2.915 16.848 4.943 1.00 1.11 C ATOM 822 O LEU A1100 2.600 17.895 4.381 1.00 1.26 O ATOM 823 CB LEU A1100 1.262 15.184 4.162 1.00 1.06 C ATOM 824 CG LEU A1100 0.787 13.977 3.337 1.00 1.07 C ATOM 825 CD1 LEU A1100 -0.734 13.997 3.178 1.00 1.20 C ATOM 826 CD2 LEU A1100 1.436 13.972 1.971 1.00 1.20 C ATOM 0 H LEU A1100 2.914 13.735 5.333 1.00 0.93 H new ATOM 0 HA LEU A1100 3.204 15.586 3.211 1.00 1.04 H new ATOM 0 HB2 LEU A1100 0.923 15.037 5.188 1.00 1.06 H new ATOM 0 HB3 LEU A1100 0.749 16.067 3.781 1.00 1.06 H new ATOM 0 HG LEU A1100 1.078 13.073 3.872 1.00 1.07 H new ATOM 0 HD11 LEU A1100 -1.050 13.135 2.591 1.00 1.20 H new ATOM 0 HD12 LEU A1100 -1.203 13.958 4.161 1.00 1.20 H new ATOM 0 HD13 LEU A1100 -1.035 14.912 2.668 1.00 1.20 H new ATOM 0 HD21 LEU A1100 1.085 13.109 1.405 1.00 1.20 H new ATOM 0 HD22 LEU A1100 1.172 14.886 1.440 1.00 1.20 H new ATOM 0 HD23 LEU A1100 2.519 13.917 2.083 1.00 1.20 H new ATOM 838 N ASP A1101 3.312 16.816 6.218 1.00 1.05 N ATOM 839 CA ASP A1101 3.249 17.944 7.148 1.00 1.15 C ATOM 840 C ASP A1101 1.843 18.582 7.171 1.00 1.24 C ATOM 841 O ASP A1101 1.702 19.804 7.148 1.00 1.54 O ATOM 842 CB ASP A1101 4.399 18.930 6.888 1.00 1.32 C ATOM 843 CG ASP A1101 4.626 19.862 8.078 1.00 1.44 C ATOM 844 OD1 ASP A1101 5.282 19.419 9.049 1.00 2.36 O ATOM 845 OD2 ASP A1101 4.202 21.043 8.043 1.00 2.62 O ATOM 0 H ASP A1101 3.699 15.974 6.645 1.00 1.05 H new ATOM 0 HA ASP A1101 3.402 17.579 8.164 1.00 1.15 H new ATOM 0 HB2 ASP A1101 5.314 18.375 6.681 1.00 1.32 H new ATOM 0 HB3 ASP A1101 4.177 19.522 6.000 1.00 1.32 H new ATOM 850 N THR A1102 0.789 17.757 7.142 1.00 1.16 N ATOM 851 CA THR A1102 -0.613 18.213 7.219 1.00 1.26 C ATOM 852 C THR A1102 -1.281 17.897 8.560 1.00 1.36 C ATOM 853 O THR A1102 -0.941 16.910 9.214 1.00 1.76 O ATOM 854 CB THR A1102 -1.430 17.670 6.039 1.00 1.62 C ATOM 855 OG1 THR A1102 -2.618 18.418 5.921 1.00 1.83 O ATOM 856 CG2 THR A1102 -1.824 16.199 6.165 1.00 2.10 C ATOM 0 H THR A1102 0.881 16.744 7.064 1.00 1.16 H new ATOM 0 HA THR A1102 -0.589 19.301 7.151 1.00 1.26 H new ATOM 0 HB THR A1102 -0.783 17.759 5.166 1.00 1.62 H new ATOM 0 HG1 THR A1102 -3.375 17.810 5.786 1.00 1.83 H new ATOM 0 HG21 THR A1102 -2.398 15.900 5.288 1.00 2.10 H new ATOM 0 HG22 THR A1102 -0.925 15.586 6.237 1.00 2.10 H new ATOM 0 HG23 THR A1102 -2.430 16.060 7.060 1.00 2.10 H new ATOM 864 N GLU A1103 -2.263 18.704 8.971 1.00 1.36 N ATOM 865 CA GLU A1103 -3.151 18.414 10.112 1.00 1.68 C ATOM 866 C GLU A1103 -4.446 17.680 9.702 1.00 1.77 C ATOM 867 O GLU A1103 -5.250 17.320 10.566 1.00 2.15 O ATOM 868 CB GLU A1103 -3.470 19.706 10.895 1.00 1.97 C ATOM 869 CG GLU A1103 -4.280 20.762 10.123 1.00 2.11 C ATOM 870 CD GLU A1103 -4.820 21.868 11.041 1.00 2.63 C ATOM 871 OE1 GLU A1103 -4.024 22.543 11.744 1.00 3.13 O ATOM 872 OE2 GLU A1103 -6.058 22.082 11.064 1.00 3.25 O ATOM 0 H GLU A1103 -2.471 19.593 8.516 1.00 1.36 H new ATOM 0 HA GLU A1103 -2.608 17.730 10.764 1.00 1.68 H new ATOM 0 HB2 GLU A1103 -4.021 19.438 11.797 1.00 1.97 H new ATOM 0 HB3 GLU A1103 -2.531 20.157 11.217 1.00 1.97 H new ATOM 0 HG2 GLU A1103 -3.651 21.207 9.352 1.00 2.11 H new ATOM 0 HG3 GLU A1103 -5.113 20.277 9.614 1.00 2.11 H new ATOM 879 N THR A1104 -4.674 17.474 8.399 1.00 1.69 N ATOM 880 CA THR A1104 -5.963 17.035 7.834 1.00 2.00 C ATOM 881 C THR A1104 -5.793 16.166 6.582 1.00 1.83 C ATOM 882 O THR A1104 -5.099 16.553 5.644 1.00 2.05 O ATOM 883 CB THR A1104 -6.818 18.283 7.537 1.00 2.30 C ATOM 884 OG1 THR A1104 -8.031 17.946 6.911 1.00 2.98 O ATOM 885 CG2 THR A1104 -6.143 19.341 6.656 1.00 1.87 C ATOM 0 H THR A1104 -3.954 17.610 7.690 1.00 1.69 H new ATOM 0 HA THR A1104 -6.466 16.403 8.566 1.00 2.00 H new ATOM 0 HB THR A1104 -6.976 18.713 8.526 1.00 2.30 H new ATOM 0 HG1 THR A1104 -8.548 18.761 6.739 1.00 2.98 H new ATOM 0 HG21 THR A1104 -6.825 20.178 6.506 1.00 1.87 H new ATOM 0 HG22 THR A1104 -5.235 19.696 7.144 1.00 1.87 H new ATOM 0 HG23 THR A1104 -5.888 18.902 5.691 1.00 1.87 H new ATOM 893 N LEU A1105 -6.414 14.983 6.547 1.00 1.66 N ATOM 894 CA LEU A1105 -6.460 14.103 5.370 1.00 1.37 C ATOM 895 C LEU A1105 -7.619 13.094 5.442 1.00 1.45 C ATOM 896 O LEU A1105 -8.164 12.839 6.513 1.00 1.79 O ATOM 897 CB LEU A1105 -5.106 13.386 5.149 1.00 1.13 C ATOM 898 CG LEU A1105 -4.798 12.138 6.002 1.00 1.62 C ATOM 899 CD1 LEU A1105 -3.430 11.593 5.584 1.00 1.41 C ATOM 900 CD2 LEU A1105 -4.763 12.429 7.500 1.00 2.36 C ATOM 0 H LEU A1105 -6.910 14.600 7.352 1.00 1.66 H new ATOM 0 HA LEU A1105 -6.647 14.741 4.506 1.00 1.37 H new ATOM 0 HB2 LEU A1105 -5.050 13.095 4.100 1.00 1.13 H new ATOM 0 HB3 LEU A1105 -4.312 14.112 5.322 1.00 1.13 H new ATOM 0 HG LEU A1105 -5.599 11.419 5.828 1.00 1.62 H new ATOM 0 HD11 LEU A1105 -3.194 10.709 6.177 1.00 1.41 H new ATOM 0 HD12 LEU A1105 -3.452 11.326 4.527 1.00 1.41 H new ATOM 0 HD13 LEU A1105 -2.669 12.355 5.750 1.00 1.41 H new ATOM 0 HD21 LEU A1105 -4.542 11.511 8.044 1.00 2.36 H new ATOM 0 HD22 LEU A1105 -3.991 13.170 7.709 1.00 2.36 H new ATOM 0 HD23 LEU A1105 -5.731 12.815 7.818 1.00 2.36 H new ATOM 912 N GLY A1106 -7.934 12.493 4.296 1.00 1.27 N ATOM 913 CA GLY A1106 -8.841 11.349 4.131 1.00 1.47 C ATOM 914 C GLY A1106 -9.990 11.600 3.147 1.00 1.21 C ATOM 915 O GLY A1106 -10.396 12.742 2.912 1.00 1.80 O ATOM 0 H GLY A1106 -7.544 12.805 3.407 1.00 1.27 H new ATOM 0 HA2 GLY A1106 -8.265 10.489 3.790 1.00 1.47 H new ATOM 0 HA3 GLY A1106 -9.259 11.087 5.103 1.00 1.47 H new ATOM 919 N THR A1107 -10.457 10.532 2.502 1.00 0.87 N ATOM 920 CA THR A1107 -11.386 10.514 1.378 1.00 0.97 C ATOM 921 C THR A1107 -12.387 9.360 1.538 1.00 0.84 C ATOM 922 O THR A1107 -12.114 8.384 2.249 1.00 0.82 O ATOM 923 CB THR A1107 -10.601 10.355 0.069 1.00 1.27 C ATOM 924 OG1 THR A1107 -9.707 9.272 0.175 1.00 1.29 O ATOM 925 CG2 THR A1107 -9.738 11.578 -0.266 1.00 1.72 C ATOM 0 H THR A1107 -10.174 9.590 2.772 1.00 0.87 H new ATOM 0 HA THR A1107 -11.940 11.453 1.354 1.00 0.97 H new ATOM 0 HB THR A1107 -11.352 10.211 -0.708 1.00 1.27 H new ATOM 0 HG1 THR A1107 -9.004 9.360 -0.503 1.00 1.29 H new ATOM 0 HG21 THR A1107 -9.208 11.404 -1.202 1.00 1.72 H new ATOM 0 HG22 THR A1107 -10.375 12.456 -0.368 1.00 1.72 H new ATOM 0 HG23 THR A1107 -9.016 11.744 0.534 1.00 1.72 H new ATOM 933 N CYS A1108 -13.574 9.465 0.937 1.00 1.03 N ATOM 934 CA CYS A1108 -14.576 8.397 0.961 1.00 1.04 C ATOM 935 C CYS A1108 -14.196 7.231 0.026 1.00 0.86 C ATOM 936 O CYS A1108 -13.699 7.458 -1.089 1.00 0.91 O ATOM 937 CB CYS A1108 -15.959 8.970 0.635 1.00 1.33 C ATOM 938 SG CYS A1108 -16.410 10.246 1.847 1.00 2.14 S ATOM 0 H CYS A1108 -13.868 10.293 0.420 1.00 1.03 H new ATOM 0 HA CYS A1108 -14.610 7.979 1.967 1.00 1.04 H new ATOM 0 HB2 CYS A1108 -15.957 9.396 -0.369 1.00 1.33 H new ATOM 0 HB3 CYS A1108 -16.702 8.173 0.642 1.00 1.33 H new ATOM 0 HG CYS A1108 -17.583 10.724 1.557 1.00 2.14 H new ATOM 944 N ILE A1109 -14.426 5.994 0.504 1.00 0.79 N ATOM 945 CA ILE A1109 -14.092 4.750 -0.174 1.00 0.76 C ATOM 946 C ILE A1109 -15.115 3.617 0.016 1.00 0.79 C ATOM 947 O ILE A1109 -15.811 3.548 1.032 1.00 0.90 O ATOM 948 CB ILE A1109 -12.671 4.237 0.204 1.00 0.75 C ATOM 949 CG1 ILE A1109 -12.529 3.620 1.617 1.00 1.16 C ATOM 950 CG2 ILE A1109 -11.560 5.272 -0.024 1.00 1.27 C ATOM 951 CD1 ILE A1109 -12.740 4.549 2.821 1.00 1.96 C ATOM 0 H ILE A1109 -14.868 5.839 1.410 1.00 0.79 H new ATOM 0 HA ILE A1109 -14.115 5.018 -1.230 1.00 0.76 H new ATOM 0 HB ILE A1109 -12.539 3.417 -0.502 1.00 0.75 H new ATOM 0 HG12 ILE A1109 -13.240 2.798 1.698 1.00 1.16 H new ATOM 0 HG13 ILE A1109 -11.532 3.188 1.697 1.00 1.16 H new ATOM 0 HG21 ILE A1109 -10.599 4.843 0.261 1.00 1.27 H new ATOM 0 HG22 ILE A1109 -11.534 5.552 -1.077 1.00 1.27 H new ATOM 0 HG23 ILE A1109 -11.757 6.157 0.582 1.00 1.27 H new ATOM 0 HD11 ILE A1109 -12.610 3.984 3.744 1.00 1.96 H new ATOM 0 HD12 ILE A1109 -12.012 5.360 2.787 1.00 1.96 H new ATOM 0 HD13 ILE A1109 -13.747 4.964 2.788 1.00 1.96 H new ATOM 963 N ASP A1110 -15.135 2.675 -0.934 1.00 0.83 N ATOM 964 CA ASP A1110 -15.825 1.375 -0.838 1.00 0.91 C ATOM 965 C ASP A1110 -14.777 0.282 -0.545 1.00 0.74 C ATOM 966 O ASP A1110 -14.224 -0.326 -1.462 1.00 0.67 O ATOM 967 CB ASP A1110 -16.618 1.093 -2.132 1.00 1.13 C ATOM 968 CG ASP A1110 -17.225 -0.320 -2.189 1.00 1.25 C ATOM 969 OD1 ASP A1110 -17.546 -0.898 -1.122 1.00 2.43 O ATOM 970 OD2 ASP A1110 -17.412 -0.856 -3.308 1.00 1.75 O ATOM 0 H ASP A1110 -14.655 2.798 -1.825 1.00 0.83 H new ATOM 0 HA ASP A1110 -16.549 1.386 -0.023 1.00 0.91 H new ATOM 0 HB2 ASP A1110 -17.419 1.827 -2.224 1.00 1.13 H new ATOM 0 HB3 ASP A1110 -15.959 1.231 -2.989 1.00 1.13 H new ATOM 975 N PHE A1111 -14.431 0.088 0.729 1.00 0.77 N ATOM 976 CA PHE A1111 -13.361 -0.826 1.166 1.00 0.71 C ATOM 977 C PHE A1111 -13.847 -2.288 1.180 1.00 0.72 C ATOM 978 O PHE A1111 -14.915 -2.585 1.730 1.00 0.81 O ATOM 979 CB PHE A1111 -12.866 -0.353 2.546 1.00 0.82 C ATOM 980 CG PHE A1111 -11.472 -0.755 3.007 1.00 0.81 C ATOM 981 CD1 PHE A1111 -11.220 -2.029 3.561 1.00 1.50 C ATOM 982 CD2 PHE A1111 -10.449 0.217 3.025 1.00 1.70 C ATOM 983 CE1 PHE A1111 -9.975 -2.298 4.162 1.00 1.52 C ATOM 984 CE2 PHE A1111 -9.192 -0.076 3.575 1.00 1.74 C ATOM 985 CZ PHE A1111 -8.960 -1.325 4.171 1.00 0.93 C ATOM 0 H PHE A1111 -14.891 0.567 1.503 1.00 0.77 H new ATOM 0 HA PHE A1111 -12.528 -0.801 0.463 1.00 0.71 H new ATOM 0 HB2 PHE A1111 -12.915 0.736 2.558 1.00 0.82 H new ATOM 0 HB3 PHE A1111 -13.576 -0.713 3.291 1.00 0.82 H new ATOM 0 HD1 PHE A1111 -11.980 -2.795 3.524 1.00 1.50 H new ATOM 0 HD2 PHE A1111 -10.636 1.197 2.611 1.00 1.70 H new ATOM 0 HE1 PHE A1111 -9.798 -3.260 4.620 1.00 1.52 H new ATOM 0 HE2 PHE A1111 -8.403 0.660 3.540 1.00 1.74 H new ATOM 0 HZ PHE A1111 -8.008 -1.538 4.634 1.00 0.93 H new ATOM 995 N GLN A1112 -13.076 -3.203 0.589 1.00 0.69 N ATOM 996 CA GLN A1112 -13.332 -4.648 0.526 1.00 0.70 C ATOM 997 C GLN A1112 -12.055 -5.423 0.896 1.00 0.70 C ATOM 998 O GLN A1112 -10.956 -5.008 0.530 1.00 0.67 O ATOM 999 CB GLN A1112 -13.772 -5.038 -0.901 1.00 0.70 C ATOM 1000 CG GLN A1112 -15.058 -4.353 -1.393 1.00 1.31 C ATOM 1001 CD GLN A1112 -16.303 -4.687 -0.580 1.00 1.82 C ATOM 1002 OE1 GLN A1112 -16.434 -5.739 0.040 1.00 2.47 O ATOM 1003 NE2 GLN A1112 -17.260 -3.789 -0.548 1.00 2.32 N ATOM 0 H GLN A1112 -12.210 -2.945 0.116 1.00 0.69 H new ATOM 0 HA GLN A1112 -14.124 -4.898 1.232 1.00 0.70 H new ATOM 0 HB2 GLN A1112 -12.964 -4.800 -1.592 1.00 0.70 H new ATOM 0 HB3 GLN A1112 -13.916 -6.118 -0.939 1.00 0.70 H new ATOM 0 HG2 GLN A1112 -14.908 -3.273 -1.378 1.00 1.31 H new ATOM 0 HG3 GLN A1112 -15.231 -4.636 -2.431 1.00 1.31 H new ATOM 0 HE21 GLN A1112 -17.156 -2.914 -1.061 1.00 2.32 H new ATOM 0 HE22 GLN A1112 -18.108 -3.966 -0.010 1.00 2.32 H new ATOM 1012 N VAL A1113 -12.192 -6.551 1.601 1.00 0.92 N ATOM 1013 CA VAL A1113 -11.057 -7.354 2.102 1.00 1.05 C ATOM 1014 C VAL A1113 -11.134 -8.806 1.616 1.00 1.15 C ATOM 1015 O VAL A1113 -12.198 -9.427 1.679 1.00 1.29 O ATOM 1016 CB VAL A1113 -10.984 -7.281 3.645 1.00 1.27 C ATOM 1017 CG1 VAL A1113 -9.823 -8.111 4.213 1.00 1.47 C ATOM 1018 CG2 VAL A1113 -10.823 -5.833 4.117 1.00 1.27 C ATOM 0 H VAL A1113 -13.102 -6.942 1.846 1.00 0.92 H new ATOM 0 HA VAL A1113 -10.139 -6.930 1.695 1.00 1.05 H new ATOM 0 HB VAL A1113 -11.923 -7.694 4.014 1.00 1.27 H new ATOM 0 HG11 VAL A1113 -9.814 -8.028 5.300 1.00 1.47 H new ATOM 0 HG12 VAL A1113 -9.950 -9.156 3.930 1.00 1.47 H new ATOM 0 HG13 VAL A1113 -8.880 -7.739 3.813 1.00 1.47 H new ATOM 0 HG21 VAL A1113 -10.774 -5.808 5.206 1.00 1.27 H new ATOM 0 HG22 VAL A1113 -9.905 -5.415 3.703 1.00 1.27 H new ATOM 0 HG23 VAL A1113 -11.675 -5.243 3.779 1.00 1.27 H new ATOM 1028 N VAL A1114 -10.007 -9.339 1.139 1.00 1.16 N ATOM 1029 CA VAL A1114 -9.810 -10.744 0.732 1.00 1.38 C ATOM 1030 C VAL A1114 -8.955 -11.473 1.781 1.00 1.36 C ATOM 1031 O VAL A1114 -7.774 -11.132 1.918 1.00 1.04 O ATOM 1032 CB VAL A1114 -9.147 -10.848 -0.658 1.00 1.44 C ATOM 1033 CG1 VAL A1114 -9.214 -12.288 -1.183 1.00 1.82 C ATOM 1034 CG2 VAL A1114 -9.846 -9.946 -1.675 1.00 2.26 C ATOM 0 H VAL A1114 -9.162 -8.781 1.018 1.00 1.16 H new ATOM 0 HA VAL A1114 -10.790 -11.216 0.666 1.00 1.38 H new ATOM 0 HB VAL A1114 -8.110 -10.535 -0.539 1.00 1.44 H new ATOM 0 HG11 VAL A1114 -8.741 -12.340 -2.164 1.00 1.82 H new ATOM 0 HG12 VAL A1114 -8.692 -12.951 -0.493 1.00 1.82 H new ATOM 0 HG13 VAL A1114 -10.256 -12.597 -1.266 1.00 1.82 H new ATOM 0 HG21 VAL A1114 -9.356 -10.042 -2.644 1.00 2.26 H new ATOM 0 HG22 VAL A1114 -10.891 -10.242 -1.766 1.00 2.26 H new ATOM 0 HG23 VAL A1114 -9.790 -8.910 -1.341 1.00 2.26 H new ATOM 1044 N PRO A1115 -9.499 -12.455 2.530 1.00 1.86 N ATOM 1045 CA PRO A1115 -8.817 -13.076 3.670 1.00 2.03 C ATOM 1046 C PRO A1115 -7.437 -13.672 3.363 1.00 1.77 C ATOM 1047 O PRO A1115 -7.300 -14.723 2.726 1.00 2.19 O ATOM 1048 CB PRO A1115 -9.794 -14.114 4.231 1.00 2.72 C ATOM 1049 CG PRO A1115 -11.141 -13.472 3.924 1.00 2.69 C ATOM 1050 CD PRO A1115 -10.907 -12.838 2.557 1.00 2.34 C ATOM 0 HA PRO A1115 -8.573 -12.306 4.402 1.00 2.03 H new ATOM 0 HB2 PRO A1115 -9.683 -15.084 3.746 1.00 2.72 H new ATOM 0 HB3 PRO A1115 -9.651 -14.274 5.300 1.00 2.72 H new ATOM 0 HG2 PRO A1115 -11.944 -14.209 3.896 1.00 2.69 H new ATOM 0 HG3 PRO A1115 -11.416 -12.729 4.673 1.00 2.69 H new ATOM 0 HD2 PRO A1115 -11.136 -13.541 1.756 1.00 2.34 H new ATOM 0 HD3 PRO A1115 -11.551 -11.970 2.413 1.00 2.34 H new ATOM 1058 N GLY A1116 -6.408 -12.977 3.848 1.00 1.54 N ATOM 1059 CA GLY A1116 -4.992 -13.353 3.787 1.00 1.58 C ATOM 1060 C GLY A1116 -4.262 -12.897 2.520 1.00 1.38 C ATOM 1061 O GLY A1116 -3.048 -13.093 2.432 1.00 1.81 O ATOM 0 H GLY A1116 -6.547 -12.084 4.322 1.00 1.54 H new ATOM 0 HA2 GLY A1116 -4.481 -12.935 4.654 1.00 1.58 H new ATOM 0 HA3 GLY A1116 -4.915 -14.438 3.864 1.00 1.58 H new ATOM 1065 N CYS A1117 -4.986 -12.292 1.569 1.00 1.00 N ATOM 1066 CA CYS A1117 -4.512 -11.994 0.215 1.00 0.90 C ATOM 1067 C CYS A1117 -4.429 -10.504 -0.136 1.00 0.73 C ATOM 1068 O CYS A1117 -3.496 -10.124 -0.846 1.00 0.76 O ATOM 1069 CB CYS A1117 -5.398 -12.745 -0.783 1.00 1.11 C ATOM 1070 SG CYS A1117 -5.031 -14.515 -0.684 1.00 1.75 S ATOM 0 H CYS A1117 -5.947 -11.988 1.728 1.00 1.00 H new ATOM 0 HA CYS A1117 -3.478 -12.333 0.162 1.00 0.90 H new ATOM 0 HB2 CYS A1117 -6.450 -12.566 -0.561 1.00 1.11 H new ATOM 0 HB3 CYS A1117 -5.219 -12.380 -1.794 1.00 1.11 H new ATOM 0 HG CYS A1117 -3.855 -14.743 -1.189 1.00 1.75 H new ATOM 1076 N GLY A1118 -5.359 -9.662 0.334 1.00 0.70 N ATOM 1077 CA GLY A1118 -5.308 -8.225 0.045 1.00 0.70 C ATOM 1078 C GLY A1118 -6.588 -7.427 0.308 1.00 0.65 C ATOM 1079 O GLY A1118 -7.576 -7.933 0.841 1.00 0.73 O ATOM 0 H GLY A1118 -6.149 -9.949 0.911 1.00 0.70 H new ATOM 0 HA2 GLY A1118 -4.505 -7.787 0.638 1.00 0.70 H new ATOM 0 HA3 GLY A1118 -5.036 -8.098 -1.003 1.00 0.70 H new ATOM 1083 N ILE A1119 -6.539 -6.156 -0.083 1.00 0.60 N ATOM 1084 CA ILE A1119 -7.589 -5.136 0.017 1.00 0.59 C ATOM 1085 C ILE A1119 -7.893 -4.606 -1.390 1.00 0.54 C ATOM 1086 O ILE A1119 -6.965 -4.395 -2.175 1.00 0.80 O ATOM 1087 CB ILE A1119 -7.140 -3.951 0.917 1.00 0.76 C ATOM 1088 CG1 ILE A1119 -6.359 -4.338 2.196 1.00 1.33 C ATOM 1089 CG2 ILE A1119 -8.330 -3.043 1.260 1.00 0.69 C ATOM 1090 CD1 ILE A1119 -7.144 -5.159 3.224 1.00 1.31 C ATOM 0 H ILE A1119 -5.695 -5.778 -0.514 1.00 0.60 H new ATOM 0 HA ILE A1119 -8.474 -5.589 0.463 1.00 0.59 H new ATOM 0 HB ILE A1119 -6.417 -3.407 0.309 1.00 0.76 H new ATOM 0 HG12 ILE A1119 -5.475 -4.904 1.904 1.00 1.33 H new ATOM 0 HG13 ILE A1119 -6.008 -3.425 2.677 1.00 1.33 H new ATOM 0 HG21 ILE A1119 -7.991 -2.221 1.891 1.00 0.69 H new ATOM 0 HG22 ILE A1119 -8.759 -2.643 0.341 1.00 0.69 H new ATOM 0 HG23 ILE A1119 -9.086 -3.620 1.792 1.00 0.69 H new ATOM 0 HD11 ILE A1119 -6.505 -5.376 4.080 1.00 1.31 H new ATOM 0 HD12 ILE A1119 -8.014 -4.592 3.555 1.00 1.31 H new ATOM 0 HD13 ILE A1119 -7.472 -6.094 2.769 1.00 1.31 H new ATOM 1102 N SER A1120 -9.163 -4.317 -1.685 1.00 0.54 N ATOM 1103 CA SER A1120 -9.572 -3.578 -2.888 1.00 0.51 C ATOM 1104 C SER A1120 -10.517 -2.439 -2.489 1.00 0.52 C ATOM 1105 O SER A1120 -11.445 -2.626 -1.699 1.00 0.57 O ATOM 1106 CB SER A1120 -10.154 -4.493 -3.979 1.00 0.52 C ATOM 1107 OG SER A1120 -11.330 -5.196 -3.619 1.00 2.05 O ATOM 0 H SER A1120 -9.946 -4.591 -1.091 1.00 0.54 H new ATOM 0 HA SER A1120 -8.685 -3.139 -3.345 1.00 0.51 H new ATOM 0 HB2 SER A1120 -10.368 -3.888 -4.860 1.00 0.52 H new ATOM 0 HB3 SER A1120 -9.392 -5.217 -4.267 1.00 0.52 H new ATOM 0 HG SER A1120 -11.625 -5.748 -4.373 1.00 2.05 H new ATOM 1113 N CYS A1121 -10.269 -1.224 -2.980 1.00 0.50 N ATOM 1114 CA CYS A1121 -11.044 -0.033 -2.606 1.00 0.55 C ATOM 1115 C CYS A1121 -11.314 0.895 -3.804 1.00 0.56 C ATOM 1116 O CYS A1121 -10.660 0.782 -4.847 1.00 0.59 O ATOM 1117 CB CYS A1121 -10.380 0.644 -1.387 1.00 0.63 C ATOM 1118 SG CYS A1121 -8.834 1.458 -1.855 1.00 0.75 S ATOM 0 H CYS A1121 -9.524 -1.034 -3.650 1.00 0.50 H new ATOM 0 HA CYS A1121 -12.046 -0.329 -2.294 1.00 0.55 H new ATOM 0 HB2 CYS A1121 -11.064 1.376 -0.956 1.00 0.63 H new ATOM 0 HB3 CYS A1121 -10.183 -0.101 -0.616 1.00 0.63 H new ATOM 0 HG CYS A1121 -8.143 0.669 -2.623 1.00 0.75 H new ATOM 1124 N LYS A1122 -12.290 1.805 -3.669 1.00 0.63 N ATOM 1125 CA LYS A1122 -12.661 2.786 -4.709 1.00 0.79 C ATOM 1126 C LYS A1122 -12.523 4.150 -4.057 1.00 0.88 C ATOM 1127 O LYS A1122 -13.130 4.296 -3.006 1.00 1.12 O ATOM 1128 CB LYS A1122 -14.129 2.600 -5.153 1.00 1.02 C ATOM 1129 CG LYS A1122 -14.567 1.193 -5.573 1.00 1.69 C ATOM 1130 CD LYS A1122 -13.838 0.679 -6.818 1.00 1.54 C ATOM 1131 CE LYS A1122 -14.414 -0.652 -7.320 1.00 2.17 C ATOM 1132 NZ LYS A1122 -15.842 -0.543 -7.705 1.00 2.64 N ATOM 0 H LYS A1122 -12.854 1.884 -2.823 1.00 0.63 H new ATOM 0 HA LYS A1122 -12.029 2.668 -5.589 1.00 0.79 H new ATOM 0 HB2 LYS A1122 -14.772 2.922 -4.334 1.00 1.02 H new ATOM 0 HB3 LYS A1122 -14.316 3.274 -5.989 1.00 1.02 H new ATOM 0 HG2 LYS A1122 -14.392 0.504 -4.747 1.00 1.69 H new ATOM 0 HG3 LYS A1122 -15.640 1.196 -5.764 1.00 1.69 H new ATOM 0 HD2 LYS A1122 -13.906 1.424 -7.610 1.00 1.54 H new ATOM 0 HD3 LYS A1122 -12.780 0.552 -6.590 1.00 1.54 H new ATOM 0 HE2 LYS A1122 -13.835 -0.995 -8.178 1.00 2.17 H new ATOM 0 HE3 LYS A1122 -14.307 -1.407 -6.541 1.00 2.17 H new ATOM 0 HZ1 LYS A1122 -16.110 -1.367 -8.280 1.00 2.64 H new ATOM 0 HZ2 LYS A1122 -16.431 -0.512 -6.848 1.00 2.64 H new ATOM 0 HZ3 LYS A1122 -15.987 0.326 -8.257 1.00 2.64 H new ATOM 1146 N VAL A1123 -11.789 5.126 -4.588 1.00 0.82 N ATOM 1147 CA VAL A1123 -11.539 6.401 -3.873 1.00 0.90 C ATOM 1148 C VAL A1123 -11.949 7.646 -4.661 1.00 1.03 C ATOM 1149 O VAL A1123 -11.766 7.688 -5.879 1.00 1.08 O ATOM 1150 CB VAL A1123 -10.087 6.452 -3.347 1.00 0.91 C ATOM 1151 CG1 VAL A1123 -9.021 6.456 -4.441 1.00 1.29 C ATOM 1152 CG2 VAL A1123 -9.846 7.656 -2.436 1.00 1.31 C ATOM 0 H VAL A1123 -11.353 5.070 -5.508 1.00 0.82 H new ATOM 0 HA VAL A1123 -12.202 6.418 -3.008 1.00 0.90 H new ATOM 0 HB VAL A1123 -9.984 5.525 -2.783 1.00 0.91 H new ATOM 0 HG11 VAL A1123 -8.032 6.493 -3.985 1.00 1.29 H new ATOM 0 HG12 VAL A1123 -9.111 5.550 -5.040 1.00 1.29 H new ATOM 0 HG13 VAL A1123 -9.159 7.328 -5.080 1.00 1.29 H new ATOM 0 HG21 VAL A1123 -8.812 7.650 -2.091 1.00 1.31 H new ATOM 0 HG22 VAL A1123 -10.038 8.575 -2.989 1.00 1.31 H new ATOM 0 HG23 VAL A1123 -10.516 7.602 -1.578 1.00 1.31 H new ATOM 1162 N THR A1124 -12.491 8.661 -3.967 1.00 1.09 N ATOM 1163 CA THR A1124 -12.860 9.967 -4.575 1.00 1.19 C ATOM 1164 C THR A1124 -12.535 11.120 -3.612 1.00 1.15 C ATOM 1165 O THR A1124 -11.513 11.038 -2.939 1.00 1.09 O ATOM 1166 CB THR A1124 -14.299 9.936 -5.133 1.00 1.28 C ATOM 1167 OG1 THR A1124 -14.602 11.140 -5.807 1.00 1.41 O ATOM 1168 CG2 THR A1124 -15.393 9.644 -4.112 1.00 1.39 C ATOM 0 H THR A1124 -12.689 8.607 -2.968 1.00 1.09 H new ATOM 0 HA THR A1124 -12.244 10.160 -5.453 1.00 1.19 H new ATOM 0 HB THR A1124 -14.299 9.091 -5.821 1.00 1.28 H new ATOM 0 HG1 THR A1124 -15.517 11.099 -6.154 1.00 1.41 H new ATOM 0 HG21 THR A1124 -16.364 9.645 -4.608 1.00 1.39 H new ATOM 0 HG22 THR A1124 -15.218 8.668 -3.660 1.00 1.39 H new ATOM 0 HG23 THR A1124 -15.381 10.410 -3.337 1.00 1.39 H new ATOM 1176 N ASN A1125 -13.306 12.214 -3.552 1.00 1.52 N ATOM 1177 CA ASN A1125 -13.078 13.403 -2.712 1.00 1.55 C ATOM 1178 C ASN A1125 -11.891 14.298 -3.149 1.00 1.84 C ATOM 1179 O ASN A1125 -11.509 15.211 -2.413 1.00 2.08 O ATOM 1180 CB ASN A1125 -13.032 13.073 -1.203 1.00 1.33 C ATOM 1181 CG ASN A1125 -14.212 12.355 -0.587 1.00 2.68 C ATOM 1182 OD1 ASN A1125 -14.850 11.501 -1.172 1.00 3.89 O ATOM 1183 ND2 ASN A1125 -14.453 12.582 0.679 1.00 3.10 N ATOM 0 H ASN A1125 -14.151 12.300 -4.117 1.00 1.52 H new ATOM 0 HA ASN A1125 -13.964 14.015 -2.884 1.00 1.55 H new ATOM 0 HB2 ASN A1125 -12.144 12.467 -1.023 1.00 1.33 H new ATOM 0 HB3 ASN A1125 -12.894 14.009 -0.663 1.00 1.33 H new ATOM 0 HD21 ASN A1125 -15.170 12.045 1.166 1.00 3.10 H new ATOM 0 HD22 ASN A1125 -13.923 13.296 1.179 1.00 3.10 H new ATOM 1951 N GLN A1177 -13.244 8.566 -10.084 1.00 2.39 N ATOM 1952 CA GLN A1177 -12.805 7.577 -9.096 1.00 1.84 C ATOM 1953 C GLN A1177 -11.514 6.848 -9.517 1.00 1.52 C ATOM 1954 O GLN A1177 -11.201 6.720 -10.702 1.00 1.61 O ATOM 1955 CB GLN A1177 -13.948 6.573 -8.834 1.00 2.04 C ATOM 1956 CG GLN A1177 -15.058 7.186 -7.965 1.00 2.14 C ATOM 1957 CD GLN A1177 -16.263 6.283 -7.799 1.00 2.62 C ATOM 1958 OE1 GLN A1177 -17.116 6.138 -8.669 1.00 3.24 O ATOM 1959 NE2 GLN A1177 -16.426 5.668 -6.658 1.00 3.22 N ATOM 0 HA GLN A1177 -12.565 8.108 -8.175 1.00 1.84 H new ATOM 0 HB2 GLN A1177 -14.369 6.246 -9.785 1.00 2.04 H new ATOM 0 HB3 GLN A1177 -13.548 5.687 -8.341 1.00 2.04 H new ATOM 0 HG2 GLN A1177 -14.651 7.420 -6.981 1.00 2.14 H new ATOM 0 HG3 GLN A1177 -15.378 8.128 -8.410 1.00 2.14 H new ATOM 0 HE21 GLN A1177 -15.731 5.772 -5.919 1.00 3.22 H new ATOM 0 HE22 GLN A1177 -17.248 5.084 -6.507 1.00 3.22 H new ATOM 1968 N TYR A1178 -10.776 6.342 -8.526 1.00 1.22 N ATOM 1969 CA TYR A1178 -9.644 5.420 -8.709 1.00 1.02 C ATOM 1970 C TYR A1178 -9.904 4.069 -8.018 1.00 0.83 C ATOM 1971 O TYR A1178 -10.335 4.042 -6.862 1.00 0.78 O ATOM 1972 CB TYR A1178 -8.347 5.995 -8.108 1.00 1.09 C ATOM 1973 CG TYR A1178 -7.613 7.147 -8.777 1.00 1.04 C ATOM 1974 CD1 TYR A1178 -7.297 7.125 -10.151 1.00 1.87 C ATOM 1975 CD2 TYR A1178 -7.071 8.160 -7.958 1.00 1.92 C ATOM 1976 CE1 TYR A1178 -6.416 8.087 -10.692 1.00 1.89 C ATOM 1977 CE2 TYR A1178 -6.188 9.116 -8.493 1.00 2.04 C ATOM 1978 CZ TYR A1178 -5.837 9.069 -9.857 1.00 1.27 C ATOM 1979 OH TYR A1178 -4.929 9.961 -10.335 1.00 1.48 O ATOM 0 H TYR A1178 -10.951 6.566 -7.546 1.00 1.22 H new ATOM 0 HA TYR A1178 -9.536 5.283 -9.785 1.00 1.02 H new ATOM 0 HB2 TYR A1178 -8.581 6.313 -7.092 1.00 1.09 H new ATOM 0 HB3 TYR A1178 -7.639 5.170 -8.029 1.00 1.09 H new ATOM 0 HD1 TYR A1178 -7.730 6.371 -10.791 1.00 1.87 H new ATOM 0 HD2 TYR A1178 -7.336 8.202 -6.912 1.00 1.92 H new ATOM 0 HE1 TYR A1178 -6.184 8.072 -11.747 1.00 1.89 H new ATOM 0 HE2 TYR A1178 -5.779 9.887 -7.857 1.00 2.04 H new ATOM 0 HH TYR A1178 -4.645 10.558 -9.612 1.00 1.48 H new ATOM 1989 N LYS A1179 -9.574 2.956 -8.688 1.00 0.83 N ATOM 1990 CA LYS A1179 -9.472 1.617 -8.079 1.00 0.74 C ATOM 1991 C LYS A1179 -8.059 1.442 -7.516 1.00 0.59 C ATOM 1992 O LYS A1179 -7.093 1.633 -8.257 1.00 0.62 O ATOM 1993 CB LYS A1179 -9.755 0.520 -9.121 1.00 1.00 C ATOM 1994 CG LYS A1179 -11.251 0.374 -9.423 1.00 1.22 C ATOM 1995 CD LYS A1179 -11.562 -0.719 -10.455 1.00 2.50 C ATOM 1996 CE LYS A1179 -10.959 -0.391 -11.827 1.00 3.34 C ATOM 1997 NZ LYS A1179 -11.263 -1.419 -12.849 1.00 3.42 N ATOM 0 H LYS A1179 -9.366 2.958 -9.687 1.00 0.83 H new ATOM 0 HA LYS A1179 -10.211 1.528 -7.283 1.00 0.74 H new ATOM 0 HB2 LYS A1179 -9.222 0.752 -10.043 1.00 1.00 H new ATOM 0 HB3 LYS A1179 -9.366 -0.431 -8.758 1.00 1.00 H new ATOM 0 HG2 LYS A1179 -11.781 0.150 -8.497 1.00 1.22 H new ATOM 0 HG3 LYS A1179 -11.635 1.327 -9.787 1.00 1.22 H new ATOM 0 HD2 LYS A1179 -11.170 -1.673 -10.104 1.00 2.50 H new ATOM 0 HD3 LYS A1179 -12.642 -0.833 -10.550 1.00 2.50 H new ATOM 0 HE2 LYS A1179 -11.339 0.573 -12.164 1.00 3.34 H new ATOM 0 HE3 LYS A1179 -9.878 -0.291 -11.729 1.00 3.34 H new ATOM 0 HZ1 LYS A1179 -10.831 -1.146 -13.755 1.00 3.42 H new ATOM 0 HZ2 LYS A1179 -10.878 -2.336 -12.544 1.00 3.42 H new ATOM 0 HZ3 LYS A1179 -12.293 -1.498 -12.966 1.00 3.42 H new ATOM 2011 N VAL A1180 -7.923 1.087 -6.238 1.00 0.57 N ATOM 2012 CA VAL A1180 -6.619 0.880 -5.574 1.00 0.56 C ATOM 2013 C VAL A1180 -6.605 -0.462 -4.846 1.00 0.59 C ATOM 2014 O VAL A1180 -7.492 -0.740 -4.032 1.00 0.83 O ATOM 2015 CB VAL A1180 -6.273 2.029 -4.601 1.00 0.59 C ATOM 2016 CG1 VAL A1180 -4.849 1.881 -4.047 1.00 1.59 C ATOM 2017 CG2 VAL A1180 -6.401 3.413 -5.249 1.00 1.19 C ATOM 0 H VAL A1180 -8.720 0.931 -5.621 1.00 0.57 H new ATOM 0 HA VAL A1180 -5.853 0.874 -6.350 1.00 0.56 H new ATOM 0 HB VAL A1180 -6.999 1.956 -3.791 1.00 0.59 H new ATOM 0 HG11 VAL A1180 -4.636 2.705 -3.366 1.00 1.59 H new ATOM 0 HG12 VAL A1180 -4.763 0.936 -3.511 1.00 1.59 H new ATOM 0 HG13 VAL A1180 -4.135 1.897 -4.870 1.00 1.59 H new ATOM 0 HG21 VAL A1180 -6.146 4.181 -4.519 1.00 1.19 H new ATOM 0 HG22 VAL A1180 -5.723 3.481 -6.099 1.00 1.19 H new ATOM 0 HG23 VAL A1180 -7.426 3.562 -5.590 1.00 1.19 H new ATOM 2027 N LEU A1181 -5.582 -1.275 -5.129 1.00 0.44 N ATOM 2028 CA LEU A1181 -5.426 -2.641 -4.628 1.00 0.47 C ATOM 2029 C LEU A1181 -4.082 -2.802 -3.901 1.00 0.55 C ATOM 2030 O LEU A1181 -3.045 -2.360 -4.404 1.00 0.57 O ATOM 2031 CB LEU A1181 -5.542 -3.666 -5.775 1.00 0.62 C ATOM 2032 CG LEU A1181 -6.892 -3.713 -6.523 1.00 1.24 C ATOM 2033 CD1 LEU A1181 -6.957 -2.729 -7.697 1.00 1.96 C ATOM 2034 CD2 LEU A1181 -7.093 -5.107 -7.123 1.00 2.01 C ATOM 0 H LEU A1181 -4.813 -0.988 -5.735 1.00 0.44 H new ATOM 0 HA LEU A1181 -6.230 -2.832 -3.917 1.00 0.47 H new ATOM 0 HB2 LEU A1181 -4.757 -3.456 -6.501 1.00 0.62 H new ATOM 0 HB3 LEU A1181 -5.343 -4.657 -5.368 1.00 0.62 H new ATOM 0 HG LEU A1181 -7.655 -3.453 -5.790 1.00 1.24 H new ATOM 0 HD11 LEU A1181 -7.929 -2.807 -8.184 1.00 1.96 H new ATOM 0 HD12 LEU A1181 -6.817 -1.713 -7.328 1.00 1.96 H new ATOM 0 HD13 LEU A1181 -6.171 -2.966 -8.414 1.00 1.96 H new ATOM 0 HD21 LEU A1181 -8.046 -5.142 -7.651 1.00 2.01 H new ATOM 0 HD22 LEU A1181 -6.283 -5.323 -7.820 1.00 2.01 H new ATOM 0 HD23 LEU A1181 -7.093 -5.850 -6.325 1.00 2.01 H new ATOM 2046 N ILE A1182 -4.090 -3.468 -2.741 1.00 0.65 N ATOM 2047 CA ILE A1182 -2.896 -3.719 -1.908 1.00 0.73 C ATOM 2048 C ILE A1182 -2.922 -5.168 -1.414 1.00 0.75 C ATOM 2049 O ILE A1182 -3.906 -5.564 -0.796 1.00 0.81 O ATOM 2050 CB ILE A1182 -2.831 -2.740 -0.705 1.00 0.83 C ATOM 2051 CG1 ILE A1182 -2.875 -1.264 -1.166 1.00 0.88 C ATOM 2052 CG2 ILE A1182 -1.567 -3.019 0.137 1.00 0.95 C ATOM 2053 CD1 ILE A1182 -2.809 -0.220 -0.044 1.00 1.47 C ATOM 0 H ILE A1182 -4.943 -3.859 -2.341 1.00 0.65 H new ATOM 0 HA ILE A1182 -2.006 -3.553 -2.515 1.00 0.73 H new ATOM 0 HB ILE A1182 -3.711 -2.908 -0.084 1.00 0.83 H new ATOM 0 HG12 ILE A1182 -2.044 -1.090 -1.850 1.00 0.88 H new ATOM 0 HG13 ILE A1182 -3.793 -1.106 -1.733 1.00 0.88 H new ATOM 0 HG21 ILE A1182 -1.530 -2.327 0.979 1.00 0.95 H new ATOM 0 HG22 ILE A1182 -1.597 -4.043 0.510 1.00 0.95 H new ATOM 0 HG23 ILE A1182 -0.680 -2.884 -0.482 1.00 0.95 H new ATOM 0 HD11 ILE A1182 -2.847 0.780 -0.475 1.00 1.47 H new ATOM 0 HD12 ILE A1182 -3.654 -0.357 0.630 1.00 1.47 H new ATOM 0 HD13 ILE A1182 -1.879 -0.341 0.511 1.00 1.47 H new ATOM 2065 N GLY A1183 -1.872 -5.964 -1.641 1.00 0.78 N ATOM 2066 CA GLY A1183 -1.887 -7.376 -1.229 1.00 0.88 C ATOM 2067 C GLY A1183 -0.641 -8.198 -1.567 1.00 0.97 C ATOM 2068 O GLY A1183 0.474 -7.681 -1.624 1.00 0.95 O ATOM 0 H GLY A1183 -1.012 -5.663 -2.100 1.00 0.78 H new ATOM 0 HA2 GLY A1183 -2.040 -7.415 -0.150 1.00 0.88 H new ATOM 0 HA3 GLY A1183 -2.749 -7.857 -1.691 1.00 0.88 H new ATOM 2072 N ASN A1184 -0.828 -9.505 -1.745 1.00 1.17 N ATOM 2073 CA ASN A1184 0.263 -10.457 -1.964 1.00 1.26 C ATOM 2074 C ASN A1184 0.725 -10.520 -3.433 1.00 1.20 C ATOM 2075 O ASN A1184 -0.033 -10.236 -4.362 1.00 1.19 O ATOM 2076 CB ASN A1184 -0.181 -11.857 -1.504 1.00 1.55 C ATOM 2077 CG ASN A1184 -0.550 -11.992 -0.039 1.00 1.60 C ATOM 2078 OD1 ASN A1184 -0.294 -11.142 0.812 1.00 2.67 O ATOM 2079 ND2 ASN A1184 -1.178 -13.096 0.278 1.00 2.66 N ATOM 0 H ASN A1184 -1.751 -9.939 -1.741 1.00 1.17 H new ATOM 0 HA ASN A1184 1.114 -10.109 -1.379 1.00 1.26 H new ATOM 0 HB2 ASN A1184 -1.040 -12.159 -2.103 1.00 1.55 H new ATOM 0 HB3 ASN A1184 0.623 -12.561 -1.722 1.00 1.55 H new ATOM 0 HD21 ASN A1184 -1.463 -13.262 1.243 1.00 2.66 H new ATOM 0 HD22 ASN A1184 -1.382 -13.791 -0.440 1.00 2.66 H new ATOM 2086 N ARG A1185 1.938 -11.050 -3.645 1.00 1.24 N ATOM 2087 CA ARG A1185 2.516 -11.360 -4.968 1.00 1.30 C ATOM 2088 C ARG A1185 1.651 -12.302 -5.819 1.00 1.27 C ATOM 2089 O ARG A1185 1.608 -12.152 -7.037 1.00 1.36 O ATOM 2090 CB ARG A1185 3.943 -11.936 -4.781 1.00 1.44 C ATOM 2091 CG ARG A1185 3.986 -13.248 -3.962 1.00 1.65 C ATOM 2092 CD ARG A1185 5.360 -13.924 -3.894 1.00 1.96 C ATOM 2093 NE ARG A1185 6.382 -13.160 -3.157 1.00 1.96 N ATOM 2094 CZ ARG A1185 6.525 -13.004 -1.854 1.00 3.02 C ATOM 2095 NH1 ARG A1185 5.659 -13.366 -0.960 1.00 3.89 N ATOM 2096 NH2 ARG A1185 7.602 -12.455 -1.387 1.00 4.42 N ATOM 0 H ARG A1185 2.568 -11.284 -2.877 1.00 1.24 H new ATOM 0 HA ARG A1185 2.557 -10.425 -5.526 1.00 1.30 H new ATOM 0 HB2 ARG A1185 4.383 -12.117 -5.762 1.00 1.44 H new ATOM 0 HB3 ARG A1185 4.564 -11.189 -4.286 1.00 1.44 H new ATOM 0 HG2 ARG A1185 3.651 -13.036 -2.947 1.00 1.65 H new ATOM 0 HG3 ARG A1185 3.273 -13.951 -4.392 1.00 1.65 H new ATOM 0 HD2 ARG A1185 5.247 -14.901 -3.425 1.00 1.96 H new ATOM 0 HD3 ARG A1185 5.716 -14.097 -4.910 1.00 1.96 H new ATOM 0 HE ARG A1185 7.076 -12.685 -3.734 1.00 1.96 H new ATOM 0 HH11 ARG A1185 4.786 -13.810 -1.246 1.00 3.89 H new ATOM 0 HH12 ARG A1185 5.850 -13.207 0.029 1.00 3.89 H new ATOM 0 HH21 ARG A1185 8.335 -12.145 -2.026 1.00 4.42 H new ATOM 0 HH22 ARG A1185 7.717 -12.332 -0.381 1.00 4.42 H new ATOM 2110 N GLU A1186 0.977 -13.268 -5.185 1.00 1.23 N ATOM 2111 CA GLU A1186 0.080 -14.237 -5.832 1.00 1.25 C ATOM 2112 C GLU A1186 -1.271 -13.626 -6.233 1.00 1.16 C ATOM 2113 O GLU A1186 -1.700 -13.765 -7.379 1.00 1.29 O ATOM 2114 CB GLU A1186 -0.025 -15.532 -4.999 1.00 1.35 C ATOM 2115 CG GLU A1186 -0.363 -15.413 -3.498 1.00 2.18 C ATOM 2116 CD GLU A1186 -1.840 -15.199 -3.123 1.00 4.04 C ATOM 2117 OE1 GLU A1186 -2.754 -15.545 -3.911 1.00 4.88 O ATOM 2118 OE2 GLU A1186 -2.087 -14.701 -2.000 1.00 5.39 O ATOM 0 H GLU A1186 1.042 -13.403 -4.176 1.00 1.23 H new ATOM 0 HA GLU A1186 0.527 -14.525 -6.783 1.00 1.25 H new ATOM 0 HB2 GLU A1186 -0.784 -16.164 -5.461 1.00 1.35 H new ATOM 0 HB3 GLU A1186 0.925 -16.060 -5.085 1.00 1.35 H new ATOM 0 HG2 GLU A1186 -0.017 -16.319 -3.001 1.00 2.18 H new ATOM 0 HG3 GLU A1186 0.213 -14.584 -3.087 1.00 2.18 H new ATOM 2125 N TRP A1187 -1.921 -12.910 -5.312 1.00 1.06 N ATOM 2126 CA TRP A1187 -3.207 -12.238 -5.529 1.00 0.97 C ATOM 2127 C TRP A1187 -3.238 -11.226 -6.688 1.00 0.95 C ATOM 2128 O TRP A1187 -4.295 -11.007 -7.280 1.00 0.93 O ATOM 2129 CB TRP A1187 -3.582 -11.567 -4.200 1.00 0.97 C ATOM 2130 CG TRP A1187 -4.961 -10.994 -4.154 1.00 1.06 C ATOM 2131 CD1 TRP A1187 -6.097 -11.703 -4.327 1.00 2.21 C ATOM 2132 CD2 TRP A1187 -5.376 -9.605 -3.985 1.00 0.77 C ATOM 2133 NE1 TRP A1187 -7.182 -10.855 -4.289 1.00 2.31 N ATOM 2134 CE2 TRP A1187 -6.800 -9.551 -4.078 1.00 1.23 C ATOM 2135 CE3 TRP A1187 -4.698 -8.379 -3.817 1.00 1.69 C ATOM 2136 CZ2 TRP A1187 -7.513 -8.347 -4.021 1.00 1.16 C ATOM 2137 CZ3 TRP A1187 -5.406 -7.164 -3.733 1.00 2.17 C ATOM 2138 CH2 TRP A1187 -6.808 -7.146 -3.843 1.00 1.50 C ATOM 0 H TRP A1187 -1.558 -12.777 -4.368 1.00 1.06 H new ATOM 0 HA TRP A1187 -3.932 -12.992 -5.837 1.00 0.97 H new ATOM 0 HB2 TRP A1187 -3.481 -12.299 -3.399 1.00 0.97 H new ATOM 0 HB3 TRP A1187 -2.866 -10.771 -3.997 1.00 0.97 H new ATOM 0 HD1 TRP A1187 -6.147 -12.772 -4.473 1.00 2.21 H new ATOM 0 HE1 TRP A1187 -8.149 -11.157 -4.403 1.00 2.31 H new ATOM 0 HE3 TRP A1187 -3.620 -8.372 -3.752 1.00 1.69 H new ATOM 0 HZ2 TRP A1187 -8.589 -8.342 -4.113 1.00 1.16 H new ATOM 0 HZ3 TRP A1187 -4.868 -6.240 -3.583 1.00 2.17 H new ATOM 0 HH2 TRP A1187 -7.342 -6.209 -3.791 1.00 1.50 H new ATOM 2149 N MET A1188 -2.098 -10.646 -7.069 1.00 1.10 N ATOM 2150 CA MET A1188 -2.014 -9.733 -8.222 1.00 1.17 C ATOM 2151 C MET A1188 -2.144 -10.432 -9.587 1.00 1.35 C ATOM 2152 O MET A1188 -2.603 -9.804 -10.545 1.00 1.24 O ATOM 2153 CB MET A1188 -0.736 -8.881 -8.106 1.00 1.31 C ATOM 2154 CG MET A1188 -1.077 -7.432 -7.733 1.00 1.45 C ATOM 2155 SD MET A1188 -2.185 -7.215 -6.302 1.00 1.52 S ATOM 2156 CE MET A1188 -2.364 -5.415 -6.290 1.00 1.07 C ATOM 0 H MET A1188 -1.208 -10.792 -6.593 1.00 1.10 H new ATOM 0 HA MET A1188 -2.883 -9.076 -8.186 1.00 1.17 H new ATOM 0 HB2 MET A1188 -0.076 -9.309 -7.352 1.00 1.31 H new ATOM 0 HB3 MET A1188 -0.194 -8.900 -9.052 1.00 1.31 H new ATOM 0 HG2 MET A1188 -0.147 -6.901 -7.531 1.00 1.45 H new ATOM 0 HG3 MET A1188 -1.536 -6.953 -8.598 1.00 1.45 H new ATOM 0 HE1 MET A1188 -2.649 -5.084 -5.291 1.00 1.07 H new ATOM 0 HE2 MET A1188 -1.417 -4.953 -6.569 1.00 1.07 H new ATOM 0 HE3 MET A1188 -3.135 -5.121 -7.003 1.00 1.07 H new ATOM 2166 N ILE A1189 -1.869 -11.740 -9.667 1.00 1.71 N ATOM 2167 CA ILE A1189 -2.050 -12.554 -10.887 1.00 1.95 C ATOM 2168 C ILE A1189 -3.535 -12.571 -11.298 1.00 2.04 C ATOM 2169 O ILE A1189 -3.875 -12.417 -12.473 1.00 2.16 O ATOM 2170 CB ILE A1189 -1.483 -13.979 -10.658 1.00 2.43 C ATOM 2171 CG1 ILE A1189 0.027 -13.932 -10.299 1.00 2.15 C ATOM 2172 CG2 ILE A1189 -1.717 -14.864 -11.895 1.00 3.90 C ATOM 2173 CD1 ILE A1189 0.580 -15.234 -9.699 1.00 2.35 C ATOM 0 H ILE A1189 -1.509 -12.275 -8.877 1.00 1.71 H new ATOM 0 HA ILE A1189 -1.494 -12.111 -11.713 1.00 1.95 H new ATOM 0 HB ILE A1189 -2.016 -14.417 -9.814 1.00 2.43 H new ATOM 0 HG12 ILE A1189 0.594 -13.692 -11.198 1.00 2.15 H new ATOM 0 HG13 ILE A1189 0.194 -13.121 -9.591 1.00 2.15 H new ATOM 0 HG21 ILE A1189 -1.311 -15.859 -11.712 1.00 3.90 H new ATOM 0 HG22 ILE A1189 -2.786 -14.939 -12.092 1.00 3.90 H new ATOM 0 HG23 ILE A1189 -1.219 -14.422 -12.758 1.00 3.90 H new ATOM 0 HD11 ILE A1189 1.640 -15.111 -9.479 1.00 2.35 H new ATOM 0 HD12 ILE A1189 0.043 -15.468 -8.780 1.00 2.35 H new ATOM 0 HD13 ILE A1189 0.449 -16.048 -10.412 1.00 2.35 H new ATOM 2185 N ARG A1190 -4.437 -12.628 -10.308 1.00 2.05 N ATOM 2186 CA ARG A1190 -5.906 -12.486 -10.415 1.00 2.20 C ATOM 2187 C ARG A1190 -6.379 -11.160 -11.049 1.00 2.03 C ATOM 2188 O ARG A1190 -7.512 -11.070 -11.530 1.00 2.38 O ATOM 2189 CB ARG A1190 -6.455 -12.650 -8.977 1.00 2.25 C ATOM 2190 CG ARG A1190 -7.637 -13.611 -8.827 1.00 2.16 C ATOM 2191 CD ARG A1190 -8.925 -13.119 -9.484 1.00 2.74 C ATOM 2192 NE ARG A1190 -10.039 -14.049 -9.226 1.00 2.79 N ATOM 2193 CZ ARG A1190 -11.323 -13.758 -9.155 1.00 3.44 C ATOM 2194 NH1 ARG A1190 -11.765 -12.537 -9.159 1.00 4.32 N ATOM 2195 NH2 ARG A1190 -12.190 -14.721 -9.086 1.00 3.60 N ATOM 0 H ARG A1190 -4.145 -12.785 -9.343 1.00 2.05 H new ATOM 0 HA ARG A1190 -6.289 -13.245 -11.097 1.00 2.20 H new ATOM 0 HB2 ARG A1190 -5.645 -12.996 -8.335 1.00 2.25 H new ATOM 0 HB3 ARG A1190 -6.758 -11.670 -8.609 1.00 2.25 H new ATOM 0 HG2 ARG A1190 -7.366 -14.574 -9.259 1.00 2.16 H new ATOM 0 HG3 ARG A1190 -7.823 -13.779 -7.766 1.00 2.16 H new ATOM 0 HD2 ARG A1190 -9.177 -12.130 -9.102 1.00 2.74 H new ATOM 0 HD3 ARG A1190 -8.773 -13.017 -10.559 1.00 2.74 H new ATOM 0 HE ARG A1190 -9.788 -15.028 -9.087 1.00 2.79 H new ATOM 0 HH11 ARG A1190 -11.110 -11.758 -9.219 1.00 4.32 H new ATOM 0 HH12 ARG A1190 -12.767 -12.357 -9.102 1.00 4.32 H new ATOM 0 HH21 ARG A1190 -11.876 -15.691 -9.087 1.00 3.60 H new ATOM 0 HH22 ARG A1190 -13.186 -14.508 -9.031 1.00 3.60 H new ATOM 2209 N ASN A1191 -5.492 -10.167 -11.094 1.00 1.74 N ATOM 2210 CA ASN A1191 -5.673 -8.814 -11.645 1.00 1.62 C ATOM 2211 C ASN A1191 -4.729 -8.521 -12.840 1.00 1.56 C ATOM 2212 O ASN A1191 -4.324 -7.380 -13.042 1.00 2.06 O ATOM 2213 CB ASN A1191 -5.510 -7.794 -10.499 1.00 1.29 C ATOM 2214 CG ASN A1191 -6.306 -6.518 -10.726 1.00 1.72 C ATOM 2215 OD1 ASN A1191 -7.406 -6.353 -10.215 1.00 1.86 O ATOM 2216 ND2 ASN A1191 -5.785 -5.602 -11.507 1.00 2.26 N ATOM 0 H ASN A1191 -4.552 -10.292 -10.718 1.00 1.74 H new ATOM 0 HA ASN A1191 -6.677 -8.731 -12.061 1.00 1.62 H new ATOM 0 HB2 ASN A1191 -5.828 -8.253 -9.563 1.00 1.29 H new ATOM 0 HB3 ASN A1191 -4.455 -7.544 -10.389 1.00 1.29 H new ATOM 0 HD21 ASN A1191 -6.297 -4.740 -11.695 1.00 2.26 H new ATOM 0 HD22 ASN A1191 -4.867 -5.751 -11.927 1.00 2.26 H new ATOM 2223 N GLY A1192 -4.324 -9.544 -13.602 1.00 1.66 N ATOM 2224 CA GLY A1192 -3.417 -9.409 -14.755 1.00 1.56 C ATOM 2225 C GLY A1192 -2.018 -8.828 -14.474 1.00 1.12 C ATOM 2226 O GLY A1192 -1.302 -8.504 -15.426 1.00 1.28 O ATOM 0 H GLY A1192 -4.620 -10.506 -13.435 1.00 1.66 H new ATOM 0 HA2 GLY A1192 -3.292 -10.393 -15.206 1.00 1.56 H new ATOM 0 HA3 GLY A1192 -3.904 -8.778 -15.498 1.00 1.56 H new ATOM 2230 N LEU A1193 -1.621 -8.673 -13.207 1.00 0.83 N ATOM 2231 CA LEU A1193 -0.391 -7.990 -12.786 1.00 0.69 C ATOM 2232 C LEU A1193 0.673 -8.973 -12.268 1.00 1.02 C ATOM 2233 O LEU A1193 0.353 -10.059 -11.784 1.00 1.58 O ATOM 2234 CB LEU A1193 -0.747 -6.933 -11.724 1.00 0.67 C ATOM 2235 CG LEU A1193 -1.499 -5.703 -12.272 1.00 1.06 C ATOM 2236 CD1 LEU A1193 -2.152 -4.958 -11.109 1.00 1.38 C ATOM 2237 CD2 LEU A1193 -0.582 -4.717 -12.997 1.00 1.49 C ATOM 0 H LEU A1193 -2.163 -9.030 -12.420 1.00 0.83 H new ATOM 0 HA LEU A1193 0.051 -7.500 -13.653 1.00 0.69 H new ATOM 0 HB2 LEU A1193 -1.358 -7.403 -10.953 1.00 0.67 H new ATOM 0 HB3 LEU A1193 0.171 -6.597 -11.242 1.00 0.67 H new ATOM 0 HG LEU A1193 -2.233 -6.076 -12.987 1.00 1.06 H new ATOM 0 HD11 LEU A1193 -2.686 -4.087 -11.489 1.00 1.38 H new ATOM 0 HD12 LEU A1193 -2.853 -5.620 -10.601 1.00 1.38 H new ATOM 0 HD13 LEU A1193 -1.384 -4.635 -10.407 1.00 1.38 H new ATOM 0 HD21 LEU A1193 -1.169 -3.873 -13.360 1.00 1.49 H new ATOM 0 HD22 LEU A1193 0.183 -4.358 -12.308 1.00 1.49 H new ATOM 0 HD23 LEU A1193 -0.105 -5.216 -13.840 1.00 1.49 H new ATOM 2249 N VAL A1194 1.946 -8.575 -12.350 1.00 1.14 N ATOM 2250 CA VAL A1194 3.091 -9.353 -11.840 1.00 1.55 C ATOM 2251 C VAL A1194 4.246 -8.438 -11.403 1.00 1.09 C ATOM 2252 O VAL A1194 4.459 -7.382 -12.004 1.00 1.04 O ATOM 2253 CB VAL A1194 3.524 -10.395 -12.893 1.00 2.29 C ATOM 2254 CG1 VAL A1194 4.139 -9.777 -14.153 1.00 2.16 C ATOM 2255 CG2 VAL A1194 4.496 -11.424 -12.317 1.00 3.25 C ATOM 0 H VAL A1194 2.220 -7.691 -12.778 1.00 1.14 H new ATOM 0 HA VAL A1194 2.783 -9.892 -10.944 1.00 1.55 H new ATOM 0 HB VAL A1194 2.598 -10.891 -13.183 1.00 2.29 H new ATOM 0 HG11 VAL A1194 4.419 -10.569 -14.847 1.00 2.16 H new ATOM 0 HG12 VAL A1194 3.411 -9.119 -14.628 1.00 2.16 H new ATOM 0 HG13 VAL A1194 5.025 -9.203 -13.881 1.00 2.16 H new ATOM 0 HG21 VAL A1194 4.773 -12.137 -13.093 1.00 3.25 H new ATOM 0 HG22 VAL A1194 5.390 -10.917 -11.954 1.00 3.25 H new ATOM 0 HG23 VAL A1194 4.019 -11.953 -11.492 1.00 3.25 H new ATOM 2265 N ILE A1195 4.993 -8.819 -10.359 1.00 1.30 N ATOM 2266 CA ILE A1195 6.089 -8.021 -9.768 1.00 1.15 C ATOM 2267 C ILE A1195 7.503 -8.534 -10.122 1.00 1.22 C ATOM 2268 O ILE A1195 7.682 -9.689 -10.525 1.00 1.58 O ATOM 2269 CB ILE A1195 5.841 -7.831 -8.254 1.00 1.76 C ATOM 2270 CG1 ILE A1195 6.583 -6.580 -7.745 1.00 2.04 C ATOM 2271 CG2 ILE A1195 6.232 -9.082 -7.446 1.00 2.33 C ATOM 2272 CD1 ILE A1195 6.106 -6.062 -6.384 1.00 2.54 C ATOM 0 H ILE A1195 4.853 -9.712 -9.886 1.00 1.30 H new ATOM 0 HA ILE A1195 6.071 -7.034 -10.230 1.00 1.15 H new ATOM 0 HB ILE A1195 4.771 -7.683 -8.106 1.00 1.76 H new ATOM 0 HG12 ILE A1195 7.647 -6.807 -7.679 1.00 2.04 H new ATOM 0 HG13 ILE A1195 6.472 -5.784 -8.481 1.00 2.04 H new ATOM 0 HG21 ILE A1195 6.042 -8.906 -6.387 1.00 2.33 H new ATOM 0 HG22 ILE A1195 5.641 -9.933 -7.784 1.00 2.33 H new ATOM 0 HG23 ILE A1195 7.291 -9.294 -7.594 1.00 2.33 H new ATOM 0 HD11 ILE A1195 6.684 -5.181 -6.107 1.00 2.54 H new ATOM 0 HD12 ILE A1195 5.050 -5.799 -6.445 1.00 2.54 H new ATOM 0 HD13 ILE A1195 6.244 -6.838 -5.631 1.00 2.54 H new ATOM 2284 N ASN A1196 8.520 -7.667 -10.005 1.00 1.03 N ATOM 2285 CA ASN A1196 9.911 -7.972 -10.381 1.00 1.13 C ATOM 2286 C ASN A1196 10.652 -8.873 -9.372 1.00 1.10 C ATOM 2287 O ASN A1196 10.395 -8.824 -8.172 1.00 1.01 O ATOM 2288 CB ASN A1196 10.666 -6.656 -10.655 1.00 1.30 C ATOM 2289 CG ASN A1196 10.758 -6.392 -12.143 1.00 2.04 C ATOM 2290 OD1 ASN A1196 11.771 -6.627 -12.789 1.00 3.24 O ATOM 2291 ND2 ASN A1196 9.675 -5.969 -12.734 1.00 2.07 N ATOM 0 H ASN A1196 8.399 -6.722 -9.642 1.00 1.03 H new ATOM 0 HA ASN A1196 9.879 -8.567 -11.294 1.00 1.13 H new ATOM 0 HB2 ASN A1196 10.154 -5.828 -10.165 1.00 1.30 H new ATOM 0 HB3 ASN A1196 11.667 -6.709 -10.227 1.00 1.30 H new ATOM 0 HD21 ASN A1196 9.666 -5.831 -13.745 1.00 2.07 H new ATOM 0 HD22 ASN A1196 8.837 -5.776 -12.186 1.00 2.07 H new ATOM 2298 N ASN A1197 11.609 -9.667 -9.858 1.00 1.25 N ATOM 2299 CA ASN A1197 12.348 -10.669 -9.078 1.00 1.31 C ATOM 2300 C ASN A1197 13.243 -10.050 -7.981 1.00 1.30 C ATOM 2301 O ASN A1197 13.277 -10.541 -6.858 1.00 1.29 O ATOM 2302 CB ASN A1197 13.172 -11.473 -10.094 1.00 1.50 C ATOM 2303 CG ASN A1197 13.826 -12.730 -9.546 1.00 1.98 C ATOM 2304 OD1 ASN A1197 13.265 -13.474 -8.752 1.00 2.54 O ATOM 2305 ND2 ASN A1197 15.002 -13.057 -10.022 1.00 2.46 N ATOM 0 H ASN A1197 11.902 -9.631 -10.834 1.00 1.25 H new ATOM 0 HA ASN A1197 11.652 -11.304 -8.530 1.00 1.31 H new ATOM 0 HB2 ASN A1197 12.523 -11.753 -10.924 1.00 1.50 H new ATOM 0 HB3 ASN A1197 13.949 -10.826 -10.501 1.00 1.50 H new ATOM 0 HD21 ASN A1197 15.446 -13.928 -9.731 1.00 2.46 H new ATOM 0 HD22 ASN A1197 15.474 -12.441 -10.684 1.00 2.46 H new ATOM 2312 N ASP A1198 13.912 -8.937 -8.284 1.00 1.40 N ATOM 2313 CA ASP A1198 14.829 -8.235 -7.371 1.00 1.50 C ATOM 2314 C ASP A1198 14.093 -7.615 -6.166 1.00 1.26 C ATOM 2315 O ASP A1198 14.540 -7.725 -5.020 1.00 1.24 O ATOM 2316 CB ASP A1198 15.595 -7.170 -8.170 1.00 1.84 C ATOM 2317 CG ASP A1198 16.617 -6.424 -7.316 1.00 2.16 C ATOM 2318 OD1 ASP A1198 17.478 -7.082 -6.685 1.00 3.36 O ATOM 2319 OD2 ASP A1198 16.554 -5.173 -7.254 1.00 2.04 O ATOM 0 H ASP A1198 13.832 -8.483 -9.194 1.00 1.40 H new ATOM 0 HA ASP A1198 15.531 -8.957 -6.952 1.00 1.50 H new ATOM 0 HB2 ASP A1198 16.104 -7.645 -9.008 1.00 1.84 H new ATOM 0 HB3 ASP A1198 14.887 -6.456 -8.590 1.00 1.84 H new ATOM 2324 N VAL A1199 12.947 -6.974 -6.418 1.00 1.18 N ATOM 2325 CA VAL A1199 12.057 -6.453 -5.363 1.00 1.14 C ATOM 2326 C VAL A1199 11.309 -7.569 -4.623 1.00 1.01 C ATOM 2327 O VAL A1199 11.033 -7.443 -3.429 1.00 1.01 O ATOM 2328 CB VAL A1199 11.094 -5.362 -5.879 1.00 1.28 C ATOM 2329 CG1 VAL A1199 11.810 -4.356 -6.781 1.00 2.75 C ATOM 2330 CG2 VAL A1199 9.877 -5.883 -6.628 1.00 1.91 C ATOM 0 H VAL A1199 12.605 -6.799 -7.363 1.00 1.18 H new ATOM 0 HA VAL A1199 12.710 -5.972 -4.635 1.00 1.14 H new ATOM 0 HB VAL A1199 10.738 -4.885 -4.966 1.00 1.28 H new ATOM 0 HG11 VAL A1199 11.099 -3.604 -7.124 1.00 2.75 H new ATOM 0 HG12 VAL A1199 12.610 -3.871 -6.222 1.00 2.75 H new ATOM 0 HG13 VAL A1199 12.232 -4.875 -7.641 1.00 2.75 H new ATOM 0 HG21 VAL A1199 9.261 -5.043 -6.951 1.00 1.91 H new ATOM 0 HG22 VAL A1199 10.202 -6.451 -7.500 1.00 1.91 H new ATOM 0 HG23 VAL A1199 9.294 -6.529 -5.971 1.00 1.91 H new ATOM 2340 N ASN A1200 10.999 -8.681 -5.300 1.00 1.00 N ATOM 2341 CA ASN A1200 10.349 -9.833 -4.682 1.00 1.03 C ATOM 2342 C ASN A1200 11.308 -10.568 -3.725 1.00 1.00 C ATOM 2343 O ASN A1200 10.924 -10.914 -2.611 1.00 1.05 O ATOM 2344 CB ASN A1200 9.785 -10.744 -5.790 1.00 1.12 C ATOM 2345 CG ASN A1200 9.008 -11.945 -5.282 1.00 1.32 C ATOM 2346 OD1 ASN A1200 8.797 -12.135 -4.093 1.00 2.03 O ATOM 2347 ND2 ASN A1200 8.522 -12.781 -6.167 1.00 1.80 N ATOM 0 H ASN A1200 11.194 -8.803 -6.294 1.00 1.00 H new ATOM 0 HA ASN A1200 9.516 -9.502 -4.063 1.00 1.03 H new ATOM 0 HB2 ASN A1200 9.134 -10.152 -6.434 1.00 1.12 H new ATOM 0 HB3 ASN A1200 10.610 -11.096 -6.409 1.00 1.12 H new ATOM 0 HD21 ASN A1200 7.972 -13.584 -5.862 1.00 1.80 H new ATOM 0 HD22 ASN A1200 8.694 -12.629 -7.161 1.00 1.80 H new ATOM 2354 N ASP A1201 12.576 -10.736 -4.104 1.00 1.01 N ATOM 2355 CA ASP A1201 13.611 -11.308 -3.235 1.00 1.08 C ATOM 2356 C ASP A1201 13.846 -10.451 -1.975 1.00 1.05 C ATOM 2357 O ASP A1201 14.014 -11.007 -0.887 1.00 1.11 O ATOM 2358 CB ASP A1201 14.902 -11.505 -4.037 1.00 1.27 C ATOM 2359 CG ASP A1201 15.948 -12.237 -3.201 1.00 1.53 C ATOM 2360 OD1 ASP A1201 15.814 -13.471 -3.012 1.00 2.53 O ATOM 2361 OD2 ASP A1201 16.863 -11.565 -2.665 1.00 1.94 O ATOM 0 H ASP A1201 12.918 -10.478 -5.029 1.00 1.01 H new ATOM 0 HA ASP A1201 13.267 -12.280 -2.880 1.00 1.08 H new ATOM 0 HB2 ASP A1201 14.690 -12.073 -4.943 1.00 1.27 H new ATOM 0 HB3 ASP A1201 15.292 -10.537 -4.351 1.00 1.27 H new ATOM 2366 N PHE A1202 13.757 -9.118 -2.104 1.00 1.01 N ATOM 2367 CA PHE A1202 13.741 -8.175 -0.976 1.00 0.98 C ATOM 2368 C PHE A1202 12.555 -8.428 -0.028 1.00 0.90 C ATOM 2369 O PHE A1202 12.769 -8.588 1.177 1.00 0.93 O ATOM 2370 CB PHE A1202 13.770 -6.721 -1.496 1.00 1.02 C ATOM 2371 CG PHE A1202 13.133 -5.701 -0.563 1.00 0.90 C ATOM 2372 CD1 PHE A1202 13.767 -5.359 0.648 1.00 1.73 C ATOM 2373 CD2 PHE A1202 11.864 -5.162 -0.860 1.00 1.74 C ATOM 2374 CE1 PHE A1202 13.125 -4.517 1.573 1.00 1.62 C ATOM 2375 CE2 PHE A1202 11.226 -4.312 0.064 1.00 1.96 C ATOM 2376 CZ PHE A1202 11.849 -4.000 1.286 1.00 1.13 C ATOM 0 H PHE A1202 13.693 -8.658 -3.012 1.00 1.01 H new ATOM 0 HA PHE A1202 14.641 -8.340 -0.383 1.00 0.98 H new ATOM 0 HB2 PHE A1202 14.806 -6.433 -1.674 1.00 1.02 H new ATOM 0 HB3 PHE A1202 13.259 -6.683 -2.458 1.00 1.02 H new ATOM 0 HD1 PHE A1202 14.751 -5.746 0.867 1.00 1.73 H new ATOM 0 HD2 PHE A1202 11.381 -5.401 -1.796 1.00 1.74 H new ATOM 0 HE1 PHE A1202 13.612 -4.267 2.504 1.00 1.62 H new ATOM 0 HE2 PHE A1202 10.255 -3.898 -0.166 1.00 1.96 H new ATOM 0 HZ PHE A1202 11.349 -3.365 2.002 1.00 1.13 H new ATOM 2386 N MET A1203 11.329 -8.512 -0.562 1.00 0.86 N ATOM 2387 CA MET A1203 10.139 -8.827 0.245 1.00 0.85 C ATOM 2388 C MET A1203 10.278 -10.190 0.929 1.00 0.90 C ATOM 2389 O MET A1203 10.069 -10.297 2.132 1.00 0.96 O ATOM 2390 CB MET A1203 8.851 -8.821 -0.599 1.00 0.85 C ATOM 2391 CG MET A1203 8.425 -7.411 -1.020 1.00 1.14 C ATOM 2392 SD MET A1203 6.694 -7.255 -1.560 1.00 1.28 S ATOM 2393 CE MET A1203 6.659 -8.362 -2.997 1.00 1.85 C ATOM 0 H MET A1203 11.134 -8.366 -1.552 1.00 0.86 H new ATOM 0 HA MET A1203 10.066 -8.045 1.001 1.00 0.85 H new ATOM 0 HB2 MET A1203 9.002 -9.431 -1.489 1.00 0.85 H new ATOM 0 HB3 MET A1203 8.046 -9.284 -0.029 1.00 0.85 H new ATOM 0 HG2 MET A1203 8.590 -6.733 -0.182 1.00 1.14 H new ATOM 0 HG3 MET A1203 9.073 -7.080 -1.831 1.00 1.14 H new ATOM 0 HE1 MET A1203 5.658 -8.365 -3.429 1.00 1.85 H new ATOM 0 HE2 MET A1203 7.375 -8.014 -3.742 1.00 1.85 H new ATOM 0 HE3 MET A1203 6.923 -9.372 -2.684 1.00 1.85 H new ATOM 2403 N THR A1204 10.681 -11.213 0.177 1.00 0.92 N ATOM 2404 CA THR A1204 10.825 -12.604 0.633 1.00 0.95 C ATOM 2405 C THR A1204 11.746 -12.711 1.854 1.00 0.99 C ATOM 2406 O THR A1204 11.379 -13.307 2.866 1.00 1.06 O ATOM 2407 CB THR A1204 11.378 -13.468 -0.515 1.00 1.07 C ATOM 2408 OG1 THR A1204 10.551 -13.403 -1.661 1.00 1.53 O ATOM 2409 CG2 THR A1204 11.482 -14.929 -0.114 1.00 1.38 C ATOM 0 H THR A1204 10.927 -11.096 -0.806 1.00 0.92 H new ATOM 0 HA THR A1204 9.840 -12.964 0.929 1.00 0.95 H new ATOM 0 HB THR A1204 12.366 -13.067 -0.740 1.00 1.07 H new ATOM 0 HG1 THR A1204 10.801 -12.624 -2.201 1.00 1.53 H new ATOM 0 HG21 THR A1204 11.876 -15.508 -0.949 1.00 1.38 H new ATOM 0 HG22 THR A1204 12.151 -15.025 0.742 1.00 1.38 H new ATOM 0 HG23 THR A1204 10.494 -15.304 0.154 1.00 1.38 H new ATOM 2417 N GLU A1205 12.917 -12.078 1.793 1.00 1.03 N ATOM 2418 CA GLU A1205 13.894 -12.083 2.889 1.00 1.15 C ATOM 2419 C GLU A1205 13.374 -11.342 4.139 1.00 1.16 C ATOM 2420 O GLU A1205 13.646 -11.756 5.270 1.00 1.25 O ATOM 2421 CB GLU A1205 15.199 -11.484 2.342 1.00 1.29 C ATOM 2422 CG GLU A1205 16.352 -11.519 3.350 1.00 1.47 C ATOM 2423 CD GLU A1205 17.693 -11.041 2.780 1.00 2.05 C ATOM 2424 OE1 GLU A1205 17.858 -10.894 1.541 1.00 2.55 O ATOM 2425 OE2 GLU A1205 18.615 -10.800 3.598 1.00 3.33 O ATOM 0 H GLU A1205 13.219 -11.543 0.979 1.00 1.03 H new ATOM 0 HA GLU A1205 14.073 -13.103 3.231 1.00 1.15 H new ATOM 0 HB2 GLU A1205 15.493 -12.030 1.445 1.00 1.29 H new ATOM 0 HB3 GLU A1205 15.019 -10.452 2.042 1.00 1.29 H new ATOM 0 HG2 GLU A1205 16.091 -10.898 4.207 1.00 1.47 H new ATOM 0 HG3 GLU A1205 16.468 -12.538 3.719 1.00 1.47 H new ATOM 2432 N HIS A1206 12.582 -10.282 3.944 1.00 1.09 N ATOM 2433 CA HIS A1206 11.922 -9.524 5.013 1.00 1.09 C ATOM 2434 C HIS A1206 10.757 -10.300 5.661 1.00 1.04 C ATOM 2435 O HIS A1206 10.548 -10.217 6.872 1.00 1.16 O ATOM 2436 CB HIS A1206 11.456 -8.179 4.429 1.00 1.12 C ATOM 2437 CG HIS A1206 11.334 -7.077 5.449 1.00 1.40 C ATOM 2438 ND1 HIS A1206 10.242 -6.782 6.232 1.00 2.21 N ATOM 2439 CD2 HIS A1206 12.292 -6.142 5.726 1.00 1.68 C ATOM 2440 CE1 HIS A1206 10.538 -5.700 6.973 1.00 2.56 C ATOM 2441 NE2 HIS A1206 11.788 -5.275 6.706 1.00 2.14 N ATOM 0 H HIS A1206 12.377 -9.918 3.014 1.00 1.09 H new ATOM 0 HA HIS A1206 12.635 -9.353 5.820 1.00 1.09 H new ATOM 0 HB2 HIS A1206 12.158 -7.868 3.655 1.00 1.12 H new ATOM 0 HB3 HIS A1206 10.490 -8.320 3.945 1.00 1.12 H new ATOM 0 HD2 HIS A1206 13.269 -6.082 5.269 1.00 1.68 H new ATOM 0 HE1 HIS A1206 9.868 -5.237 7.682 1.00 2.56 H new ATOM 0 HE2 HIS A1206 12.270 -4.483 7.131 1.00 2.14 H new ATOM 2449 N GLU A1207 10.015 -11.097 4.883 1.00 0.97 N ATOM 2450 CA GLU A1207 8.994 -12.019 5.400 1.00 1.04 C ATOM 2451 C GLU A1207 9.642 -13.125 6.249 1.00 1.22 C ATOM 2452 O GLU A1207 9.242 -13.339 7.397 1.00 1.45 O ATOM 2453 CB GLU A1207 8.159 -12.611 4.248 1.00 1.01 C ATOM 2454 CG GLU A1207 7.274 -11.578 3.537 1.00 1.85 C ATOM 2455 CD GLU A1207 6.469 -12.227 2.404 1.00 2.23 C ATOM 2456 OE1 GLU A1207 7.046 -12.630 1.366 1.00 3.13 O ATOM 2457 OE2 GLU A1207 5.233 -12.396 2.552 1.00 2.65 O ATOM 0 H GLU A1207 10.106 -11.121 3.867 1.00 0.97 H new ATOM 0 HA GLU A1207 8.317 -11.458 6.045 1.00 1.04 H new ATOM 0 HB2 GLU A1207 8.831 -13.065 3.519 1.00 1.01 H new ATOM 0 HB3 GLU A1207 7.528 -13.409 4.640 1.00 1.01 H new ATOM 0 HG2 GLU A1207 6.593 -11.122 4.256 1.00 1.85 H new ATOM 0 HG3 GLU A1207 7.895 -10.778 3.134 1.00 1.85 H new ATOM 2464 N ARG A1208 10.720 -13.748 5.747 1.00 1.20 N ATOM 2465 CA ARG A1208 11.521 -14.756 6.477 1.00 1.42 C ATOM 2466 C ARG A1208 12.120 -14.224 7.791 1.00 1.57 C ATOM 2467 O ARG A1208 12.226 -14.987 8.753 1.00 1.91 O ATOM 2468 CB ARG A1208 12.615 -15.311 5.546 1.00 1.43 C ATOM 2469 CG ARG A1208 12.044 -16.260 4.478 1.00 2.03 C ATOM 2470 CD ARG A1208 13.143 -16.746 3.525 1.00 1.98 C ATOM 2471 NE ARG A1208 12.584 -17.573 2.438 1.00 3.42 N ATOM 2472 CZ ARG A1208 13.028 -17.667 1.196 1.00 4.21 C ATOM 2473 NH1 ARG A1208 14.144 -17.126 0.807 1.00 3.97 N ATOM 2474 NH2 ARG A1208 12.321 -18.276 0.292 1.00 5.83 N ATOM 0 H ARG A1208 11.069 -13.565 4.806 1.00 1.20 H new ATOM 0 HA ARG A1208 10.847 -15.560 6.771 1.00 1.42 H new ATOM 0 HB2 ARG A1208 13.128 -14.483 5.057 1.00 1.43 H new ATOM 0 HB3 ARG A1208 13.360 -15.841 6.139 1.00 1.43 H new ATOM 0 HG2 ARG A1208 11.574 -17.116 4.962 1.00 2.03 H new ATOM 0 HG3 ARG A1208 11.267 -15.748 3.911 1.00 2.03 H new ATOM 0 HD2 ARG A1208 13.665 -15.888 3.101 1.00 1.98 H new ATOM 0 HD3 ARG A1208 13.881 -17.324 4.082 1.00 1.98 H new ATOM 0 HE ARG A1208 11.765 -18.134 2.670 1.00 3.42 H new ATOM 0 HH11 ARG A1208 14.716 -16.603 1.470 1.00 3.97 H new ATOM 0 HH12 ARG A1208 14.448 -17.224 -0.162 1.00 3.97 H new ATOM 0 HH21 ARG A1208 11.419 -18.684 0.539 1.00 5.83 H new ATOM 0 HH22 ARG A1208 12.668 -18.346 -0.665 1.00 5.83 H new ATOM 2488 N LYS A1209 12.371 -12.910 7.870 1.00 1.43 N ATOM 2489 CA LYS A1209 12.796 -12.182 9.090 1.00 1.55 C ATOM 2490 C LYS A1209 11.789 -12.351 10.243 1.00 1.74 C ATOM 2491 O LYS A1209 12.164 -12.724 11.357 1.00 2.26 O ATOM 2492 CB LYS A1209 13.019 -10.693 8.756 1.00 1.61 C ATOM 2493 CG LYS A1209 14.076 -10.013 9.636 1.00 2.74 C ATOM 2494 CD LYS A1209 15.493 -10.324 9.131 1.00 2.66 C ATOM 2495 CE LYS A1209 16.576 -9.599 9.943 1.00 4.02 C ATOM 2496 NZ LYS A1209 16.530 -8.135 9.721 1.00 5.03 N ATOM 0 H LYS A1209 12.283 -12.296 7.061 1.00 1.43 H new ATOM 0 HA LYS A1209 13.736 -12.613 9.433 1.00 1.55 H new ATOM 0 HB2 LYS A1209 13.318 -10.605 7.712 1.00 1.61 H new ATOM 0 HB3 LYS A1209 12.074 -10.161 8.863 1.00 1.61 H new ATOM 0 HG2 LYS A1209 13.915 -8.935 9.638 1.00 2.74 H new ATOM 0 HG3 LYS A1209 13.970 -10.353 10.666 1.00 2.74 H new ATOM 0 HD2 LYS A1209 15.665 -11.399 9.179 1.00 2.66 H new ATOM 0 HD3 LYS A1209 15.574 -10.035 8.083 1.00 2.66 H new ATOM 0 HE2 LYS A1209 16.441 -9.812 11.003 1.00 4.02 H new ATOM 0 HE3 LYS A1209 17.558 -9.980 9.664 1.00 4.02 H new ATOM 0 HZ1 LYS A1209 17.354 -7.689 10.173 1.00 5.03 H new ATOM 0 HZ2 LYS A1209 16.547 -7.938 8.700 1.00 5.03 H new ATOM 0 HZ3 LYS A1209 15.657 -7.749 10.134 1.00 5.03 H new ATOM 2510 N GLY A1210 10.509 -12.086 9.967 1.00 1.67 N ATOM 2511 CA GLY A1210 9.405 -12.117 10.951 1.00 1.84 C ATOM 2512 C GLY A1210 8.662 -10.779 10.991 1.00 1.66 C ATOM 2513 O GLY A1210 8.419 -10.196 12.048 1.00 1.89 O ATOM 0 H GLY A1210 10.196 -11.836 9.029 1.00 1.67 H new ATOM 0 HA2 GLY A1210 8.708 -12.915 10.695 1.00 1.84 H new ATOM 0 HA3 GLY A1210 9.802 -12.345 11.940 1.00 1.84 H new ATOM 2517 N ARG A1211 8.441 -10.228 9.797 1.00 1.41 N ATOM 2518 CA ARG A1211 7.899 -8.899 9.489 1.00 1.17 C ATOM 2519 C ARG A1211 6.996 -9.047 8.250 1.00 1.01 C ATOM 2520 O ARG A1211 7.081 -10.068 7.563 1.00 1.37 O ATOM 2521 CB ARG A1211 9.068 -7.914 9.259 1.00 1.15 C ATOM 2522 CG ARG A1211 9.690 -7.319 10.541 1.00 1.63 C ATOM 2523 CD ARG A1211 10.818 -8.158 11.180 1.00 2.09 C ATOM 2524 NE ARG A1211 11.208 -7.714 12.538 1.00 2.48 N ATOM 2525 CZ ARG A1211 10.476 -7.680 13.641 1.00 3.75 C ATOM 2526 NH1 ARG A1211 9.221 -8.021 13.690 1.00 5.21 N ATOM 2527 NH2 ARG A1211 11.019 -7.287 14.750 1.00 4.14 N ATOM 0 H ARG A1211 8.655 -10.744 8.944 1.00 1.41 H new ATOM 0 HA ARG A1211 7.304 -8.497 10.309 1.00 1.17 H new ATOM 0 HB2 ARG A1211 9.850 -8.428 8.700 1.00 1.15 H new ATOM 0 HB3 ARG A1211 8.714 -7.095 8.633 1.00 1.15 H new ATOM 0 HG2 ARG A1211 10.083 -6.329 10.308 1.00 1.63 H new ATOM 0 HG3 ARG A1211 8.899 -7.182 11.279 1.00 1.63 H new ATOM 0 HD2 ARG A1211 10.499 -9.199 11.228 1.00 2.09 H new ATOM 0 HD3 ARG A1211 11.694 -8.122 10.532 1.00 2.09 H new ATOM 0 HE ARG A1211 12.170 -7.391 12.637 1.00 2.48 H new ATOM 0 HH11 ARG A1211 8.745 -8.337 12.845 1.00 5.21 H new ATOM 0 HH12 ARG A1211 8.713 -7.972 14.573 1.00 5.21 H new ATOM 0 HH21 ARG A1211 12.000 -7.008 14.767 1.00 4.14 H new ATOM 0 HH22 ARG A1211 10.465 -7.256 15.606 1.00 4.14 H new ATOM 2541 N THR A1212 6.125 -8.086 7.941 1.00 0.80 N ATOM 2542 CA THR A1212 5.068 -8.269 6.916 1.00 0.75 C ATOM 2543 C THR A1212 5.304 -7.415 5.665 1.00 0.63 C ATOM 2544 O THR A1212 5.697 -6.252 5.784 1.00 0.67 O ATOM 2545 CB THR A1212 3.686 -7.969 7.523 1.00 0.88 C ATOM 2546 OG1 THR A1212 3.594 -8.544 8.808 1.00 1.09 O ATOM 2547 CG2 THR A1212 2.533 -8.541 6.700 1.00 1.15 C ATOM 0 H THR A1212 6.122 -7.166 8.381 1.00 0.80 H new ATOM 0 HA THR A1212 5.106 -9.310 6.596 1.00 0.75 H new ATOM 0 HB THR A1212 3.599 -6.883 7.548 1.00 0.88 H new ATOM 0 HG1 THR A1212 2.713 -8.349 9.191 1.00 1.09 H new ATOM 0 HG21 THR A1212 1.586 -8.295 7.181 1.00 1.15 H new ATOM 0 HG22 THR A1212 2.553 -8.112 5.698 1.00 1.15 H new ATOM 0 HG23 THR A1212 2.636 -9.624 6.633 1.00 1.15 H new ATOM 2555 N ALA A1213 5.058 -7.976 4.472 1.00 0.57 N ATOM 2556 CA ALA A1213 5.316 -7.323 3.179 1.00 0.48 C ATOM 2557 C ALA A1213 4.157 -7.472 2.167 1.00 0.51 C ATOM 2558 O ALA A1213 3.634 -8.577 1.974 1.00 0.58 O ATOM 2559 CB ALA A1213 6.619 -7.906 2.610 1.00 0.50 C ATOM 0 H ALA A1213 4.667 -8.913 4.376 1.00 0.57 H new ATOM 0 HA ALA A1213 5.406 -6.250 3.349 1.00 0.48 H new ATOM 0 HB1 ALA A1213 6.837 -7.440 1.649 1.00 0.50 H new ATOM 0 HB2 ALA A1213 7.438 -7.710 3.302 1.00 0.50 H new ATOM 0 HB3 ALA A1213 6.508 -8.982 2.474 1.00 0.50 H new ATOM 2565 N VAL A1214 3.767 -6.381 1.492 1.00 0.57 N ATOM 2566 CA VAL A1214 2.699 -6.347 0.465 1.00 0.75 C ATOM 2567 C VAL A1214 3.023 -5.387 -0.691 1.00 0.72 C ATOM 2568 O VAL A1214 3.712 -4.385 -0.507 1.00 0.60 O ATOM 2569 CB VAL A1214 1.322 -5.964 1.063 1.00 0.98 C ATOM 2570 CG1 VAL A1214 0.743 -7.087 1.932 1.00 1.71 C ATOM 2571 CG2 VAL A1214 1.347 -4.666 1.883 1.00 0.83 C ATOM 0 H VAL A1214 4.194 -5.468 1.645 1.00 0.57 H new ATOM 0 HA VAL A1214 2.648 -7.363 0.074 1.00 0.75 H new ATOM 0 HB VAL A1214 0.682 -5.801 0.196 1.00 0.98 H new ATOM 0 HG11 VAL A1214 -0.223 -6.777 2.331 1.00 1.71 H new ATOM 0 HG12 VAL A1214 0.614 -7.985 1.328 1.00 1.71 H new ATOM 0 HG13 VAL A1214 1.425 -7.298 2.755 1.00 1.71 H new ATOM 0 HG21 VAL A1214 0.349 -4.461 2.270 1.00 0.83 H new ATOM 0 HG22 VAL A1214 2.044 -4.774 2.714 1.00 0.83 H new ATOM 0 HG23 VAL A1214 1.666 -3.840 1.247 1.00 0.83 H new ATOM 2581 N LEU A1215 2.500 -5.680 -1.885 1.00 0.87 N ATOM 2582 CA LEU A1215 2.603 -4.853 -3.097 1.00 0.81 C ATOM 2583 C LEU A1215 1.335 -4.006 -3.367 1.00 0.67 C ATOM 2584 O LEU A1215 0.293 -4.220 -2.748 1.00 0.54 O ATOM 2585 CB LEU A1215 3.076 -5.726 -4.280 1.00 0.93 C ATOM 2586 CG LEU A1215 2.289 -7.012 -4.597 1.00 1.34 C ATOM 2587 CD1 LEU A1215 0.803 -6.767 -4.788 1.00 2.91 C ATOM 2588 CD2 LEU A1215 2.811 -7.609 -5.905 1.00 1.97 C ATOM 0 H LEU A1215 1.970 -6.537 -2.043 1.00 0.87 H new ATOM 0 HA LEU A1215 3.367 -4.091 -2.944 1.00 0.81 H new ATOM 0 HB2 LEU A1215 3.072 -5.104 -5.175 1.00 0.93 H new ATOM 0 HB3 LEU A1215 4.112 -6.008 -4.092 1.00 0.93 H new ATOM 0 HG LEU A1215 2.428 -7.678 -3.745 1.00 1.34 H new ATOM 0 HD11 LEU A1215 0.304 -7.711 -5.009 1.00 2.91 H new ATOM 0 HD12 LEU A1215 0.385 -6.340 -3.877 1.00 2.91 H new ATOM 0 HD13 LEU A1215 0.652 -6.075 -5.616 1.00 2.91 H new ATOM 0 HD21 LEU A1215 2.258 -8.520 -6.135 1.00 1.97 H new ATOM 0 HD22 LEU A1215 2.677 -6.889 -6.712 1.00 1.97 H new ATOM 0 HD23 LEU A1215 3.870 -7.844 -5.800 1.00 1.97 H new ATOM 2600 N VAL A1216 1.431 -3.026 -4.278 1.00 0.80 N ATOM 2601 CA VAL A1216 0.400 -1.997 -4.548 1.00 0.71 C ATOM 2602 C VAL A1216 0.183 -1.779 -6.055 1.00 0.60 C ATOM 2603 O VAL A1216 1.150 -1.683 -6.818 1.00 0.69 O ATOM 2604 CB VAL A1216 0.782 -0.647 -3.892 1.00 0.83 C ATOM 2605 CG1 VAL A1216 -0.341 0.393 -4.023 1.00 0.84 C ATOM 2606 CG2 VAL A1216 1.123 -0.780 -2.401 1.00 0.92 C ATOM 0 H VAL A1216 2.254 -2.919 -4.870 1.00 0.80 H new ATOM 0 HA VAL A1216 -0.529 -2.367 -4.114 1.00 0.71 H new ATOM 0 HB VAL A1216 1.668 -0.317 -4.434 1.00 0.83 H new ATOM 0 HG11 VAL A1216 -0.031 1.325 -3.550 1.00 0.84 H new ATOM 0 HG12 VAL A1216 -0.549 0.573 -5.078 1.00 0.84 H new ATOM 0 HG13 VAL A1216 -1.241 0.020 -3.535 1.00 0.84 H new ATOM 0 HG21 VAL A1216 1.382 0.199 -1.998 1.00 0.92 H new ATOM 0 HG22 VAL A1216 0.261 -1.176 -1.865 1.00 0.92 H new ATOM 0 HG23 VAL A1216 1.968 -1.457 -2.280 1.00 0.92 H new ATOM 2616 N ALA A1217 -1.081 -1.635 -6.474 1.00 0.46 N ATOM 2617 CA ALA A1217 -1.497 -1.299 -7.841 1.00 0.39 C ATOM 2618 C ALA A1217 -2.653 -0.270 -7.875 1.00 0.35 C ATOM 2619 O ALA A1217 -3.452 -0.197 -6.937 1.00 0.39 O ATOM 2620 CB ALA A1217 -1.902 -2.591 -8.557 1.00 0.47 C ATOM 0 H ALA A1217 -1.874 -1.754 -5.844 1.00 0.46 H new ATOM 0 HA ALA A1217 -0.657 -0.828 -8.351 1.00 0.39 H new ATOM 0 HB1 ALA A1217 -2.214 -2.360 -9.575 1.00 0.47 H new ATOM 0 HB2 ALA A1217 -1.053 -3.274 -8.584 1.00 0.47 H new ATOM 0 HB3 ALA A1217 -2.728 -3.060 -8.022 1.00 0.47 H new ATOM 2626 N VAL A1218 -2.770 0.493 -8.971 1.00 0.38 N ATOM 2627 CA VAL A1218 -3.827 1.510 -9.191 1.00 0.45 C ATOM 2628 C VAL A1218 -4.383 1.396 -10.616 1.00 0.58 C ATOM 2629 O VAL A1218 -3.608 1.451 -11.564 1.00 0.65 O ATOM 2630 CB VAL A1218 -3.294 2.943 -8.955 1.00 0.56 C ATOM 2631 CG1 VAL A1218 -4.398 3.996 -9.136 1.00 0.69 C ATOM 2632 CG2 VAL A1218 -2.704 3.134 -7.548 1.00 0.52 C ATOM 0 H VAL A1218 -2.119 0.424 -9.753 1.00 0.38 H new ATOM 0 HA VAL A1218 -4.623 1.319 -8.471 1.00 0.45 H new ATOM 0 HB VAL A1218 -2.509 3.078 -9.700 1.00 0.56 H new ATOM 0 HG11 VAL A1218 -3.985 4.990 -8.962 1.00 0.69 H new ATOM 0 HG12 VAL A1218 -4.792 3.939 -10.151 1.00 0.69 H new ATOM 0 HG13 VAL A1218 -5.201 3.807 -8.424 1.00 0.69 H new ATOM 0 HG21 VAL A1218 -2.346 4.158 -7.440 1.00 0.52 H new ATOM 0 HG22 VAL A1218 -3.473 2.938 -6.801 1.00 0.52 H new ATOM 0 HG23 VAL A1218 -1.874 2.442 -7.405 1.00 0.52 H new ATOM 2642 N ASP A1219 -5.702 1.229 -10.776 1.00 0.69 N ATOM 2643 CA ASP A1219 -6.419 1.097 -12.069 1.00 0.86 C ATOM 2644 C ASP A1219 -5.702 0.194 -13.104 1.00 0.78 C ATOM 2645 O ASP A1219 -5.603 0.500 -14.296 1.00 0.91 O ATOM 2646 CB ASP A1219 -6.834 2.478 -12.608 1.00 1.17 C ATOM 2647 CG ASP A1219 -7.860 2.397 -13.752 1.00 1.56 C ATOM 2648 OD1 ASP A1219 -8.895 1.701 -13.610 1.00 2.86 O ATOM 2649 OD2 ASP A1219 -7.684 3.088 -14.784 1.00 1.64 O ATOM 0 H ASP A1219 -6.335 1.179 -9.977 1.00 0.69 H new ATOM 0 HA ASP A1219 -7.339 0.548 -11.869 1.00 0.86 H new ATOM 0 HB2 ASP A1219 -7.253 3.068 -11.793 1.00 1.17 H new ATOM 0 HB3 ASP A1219 -5.947 3.005 -12.960 1.00 1.17 H new ATOM 2654 N ASP A1220 -5.191 -0.943 -12.626 1.00 0.70 N ATOM 2655 CA ASP A1220 -4.412 -1.948 -13.366 1.00 0.78 C ATOM 2656 C ASP A1220 -2.985 -1.527 -13.826 1.00 0.79 C ATOM 2657 O ASP A1220 -2.467 -2.052 -14.816 1.00 0.96 O ATOM 2658 CB ASP A1220 -5.257 -2.633 -14.457 1.00 0.94 C ATOM 2659 CG ASP A1220 -6.722 -2.861 -14.076 1.00 1.92 C ATOM 2660 OD1 ASP A1220 -7.024 -3.645 -13.144 1.00 2.61 O ATOM 2661 OD2 ASP A1220 -7.611 -2.254 -14.716 1.00 3.08 O ATOM 0 H ASP A1220 -5.317 -1.207 -11.649 1.00 0.70 H new ATOM 0 HA ASP A1220 -4.171 -2.706 -12.620 1.00 0.78 H new ATOM 0 HB2 ASP A1220 -5.220 -2.026 -15.362 1.00 0.94 H new ATOM 0 HB3 ASP A1220 -4.804 -3.594 -14.699 1.00 0.94 H new ATOM 2666 N GLU A1221 -2.330 -0.591 -13.129 1.00 0.74 N ATOM 2667 CA GLU A1221 -0.891 -0.260 -13.237 1.00 0.77 C ATOM 2668 C GLU A1221 -0.154 -0.717 -11.962 1.00 0.62 C ATOM 2669 O GLU A1221 -0.584 -0.385 -10.853 1.00 0.55 O ATOM 2670 CB GLU A1221 -0.664 1.266 -13.388 1.00 0.85 C ATOM 2671 CG GLU A1221 -0.995 1.875 -14.757 1.00 1.62 C ATOM 2672 CD GLU A1221 0.002 1.489 -15.857 1.00 1.86 C ATOM 2673 OE1 GLU A1221 -0.147 0.393 -16.451 1.00 2.39 O ATOM 2674 OE2 GLU A1221 0.938 2.271 -16.161 1.00 2.85 O ATOM 0 H GLU A1221 -2.806 -0.011 -12.438 1.00 0.74 H new ATOM 0 HA GLU A1221 -0.508 -0.771 -14.120 1.00 0.77 H new ATOM 0 HB2 GLU A1221 -1.263 1.776 -12.634 1.00 0.85 H new ATOM 0 HB3 GLU A1221 0.381 1.479 -13.163 1.00 0.85 H new ATOM 0 HG2 GLU A1221 -1.994 1.557 -15.055 1.00 1.62 H new ATOM 0 HG3 GLU A1221 -1.021 2.961 -14.666 1.00 1.62 H new ATOM 2681 N LEU A1222 0.984 -1.424 -12.078 1.00 0.67 N ATOM 2682 CA LEU A1222 1.886 -1.695 -10.943 1.00 0.69 C ATOM 2683 C LEU A1222 2.376 -0.363 -10.353 1.00 0.62 C ATOM 2684 O LEU A1222 2.828 0.495 -11.116 1.00 0.74 O ATOM 2685 CB LEU A1222 3.112 -2.507 -11.436 1.00 0.83 C ATOM 2686 CG LEU A1222 3.501 -3.770 -10.645 1.00 0.69 C ATOM 2687 CD1 LEU A1222 3.768 -3.467 -9.171 1.00 0.87 C ATOM 2688 CD2 LEU A1222 2.454 -4.878 -10.734 1.00 0.97 C ATOM 0 H LEU A1222 1.305 -1.824 -12.960 1.00 0.67 H new ATOM 0 HA LEU A1222 1.349 -2.263 -10.184 1.00 0.69 H new ATOM 0 HB2 LEU A1222 2.925 -2.803 -12.468 1.00 0.83 H new ATOM 0 HB3 LEU A1222 3.974 -1.840 -11.447 1.00 0.83 H new ATOM 0 HG LEU A1222 4.419 -4.122 -11.117 1.00 0.69 H new ATOM 0 HD11 LEU A1222 4.039 -4.387 -8.654 1.00 0.87 H new ATOM 0 HD12 LEU A1222 4.586 -2.751 -9.089 1.00 0.87 H new ATOM 0 HD13 LEU A1222 2.870 -3.046 -8.718 1.00 0.87 H new ATOM 0 HD21 LEU A1222 2.787 -5.740 -10.156 1.00 0.97 H new ATOM 0 HD22 LEU A1222 1.507 -4.517 -10.334 1.00 0.97 H new ATOM 0 HD23 LEU A1222 2.320 -5.169 -11.776 1.00 0.97 H new ATOM 2700 N CYS A1223 2.334 -0.186 -9.027 1.00 0.59 N ATOM 2701 CA CYS A1223 2.570 1.126 -8.416 1.00 0.58 C ATOM 2702 C CYS A1223 3.579 1.160 -7.249 1.00 0.58 C ATOM 2703 O CYS A1223 4.334 2.134 -7.168 1.00 0.61 O ATOM 2704 CB CYS A1223 1.194 1.770 -8.145 1.00 0.77 C ATOM 2705 SG CYS A1223 1.082 2.615 -6.543 1.00 0.76 S ATOM 0 H CYS A1223 2.139 -0.932 -8.359 1.00 0.59 H new ATOM 0 HA CYS A1223 3.117 1.750 -9.123 1.00 0.58 H new ATOM 0 HB2 CYS A1223 0.976 2.485 -8.938 1.00 0.77 H new ATOM 0 HB3 CYS A1223 0.426 0.998 -8.192 1.00 0.77 H new ATOM 0 HG CYS A1223 -0.021 3.302 -6.491 1.00 0.76 H new ATOM 2711 N GLY A1224 3.696 0.142 -6.390 1.00 0.60 N ATOM 2712 CA GLY A1224 4.590 0.213 -5.220 1.00 0.60 C ATOM 2713 C GLY A1224 4.680 -1.069 -4.391 1.00 0.65 C ATOM 2714 O GLY A1224 4.055 -2.077 -4.724 1.00 0.79 O ATOM 0 H GLY A1224 3.188 -0.738 -6.478 1.00 0.60 H new ATOM 0 HA2 GLY A1224 5.591 0.476 -5.563 1.00 0.60 H new ATOM 0 HA3 GLY A1224 4.252 1.022 -4.573 1.00 0.60 H new ATOM 2718 N LEU A1225 5.475 -1.024 -3.319 1.00 0.61 N ATOM 2719 CA LEU A1225 5.540 -2.051 -2.273 1.00 0.63 C ATOM 2720 C LEU A1225 5.779 -1.457 -0.870 1.00 0.65 C ATOM 2721 O LEU A1225 6.308 -0.351 -0.726 1.00 0.69 O ATOM 2722 CB LEU A1225 6.511 -3.192 -2.645 1.00 0.65 C ATOM 2723 CG LEU A1225 8.010 -2.855 -2.753 1.00 0.73 C ATOM 2724 CD1 LEU A1225 8.814 -4.154 -2.757 1.00 1.68 C ATOM 2725 CD2 LEU A1225 8.366 -2.122 -4.046 1.00 1.54 C ATOM 0 H LEU A1225 6.113 -0.246 -3.148 1.00 0.61 H new ATOM 0 HA LEU A1225 4.554 -2.512 -2.214 1.00 0.63 H new ATOM 0 HB2 LEU A1225 6.398 -3.982 -1.903 1.00 0.65 H new ATOM 0 HB3 LEU A1225 6.191 -3.605 -3.602 1.00 0.65 H new ATOM 0 HG LEU A1225 8.243 -2.212 -1.904 1.00 0.73 H new ATOM 0 HD11 LEU A1225 9.877 -3.924 -2.833 1.00 1.68 H new ATOM 0 HD12 LEU A1225 8.627 -4.701 -1.833 1.00 1.68 H new ATOM 0 HD13 LEU A1225 8.513 -4.765 -3.608 1.00 1.68 H new ATOM 0 HD21 LEU A1225 9.436 -1.913 -4.063 1.00 1.54 H new ATOM 0 HD22 LEU A1225 8.105 -2.745 -4.901 1.00 1.54 H new ATOM 0 HD23 LEU A1225 7.812 -1.185 -4.097 1.00 1.54 H new ATOM 2737 N ILE A1226 5.355 -2.190 0.163 1.00 0.65 N ATOM 2738 CA ILE A1226 5.294 -1.739 1.563 1.00 0.68 C ATOM 2739 C ILE A1226 5.796 -2.839 2.511 1.00 0.59 C ATOM 2740 O ILE A1226 5.399 -3.999 2.386 1.00 0.61 O ATOM 2741 CB ILE A1226 3.850 -1.316 1.938 1.00 0.78 C ATOM 2742 CG1 ILE A1226 3.297 -0.249 0.958 1.00 0.84 C ATOM 2743 CG2 ILE A1226 3.812 -0.832 3.403 1.00 0.86 C ATOM 2744 CD1 ILE A1226 1.880 0.250 1.261 1.00 0.97 C ATOM 0 H ILE A1226 5.032 -3.150 0.047 1.00 0.65 H new ATOM 0 HA ILE A1226 5.946 -0.872 1.670 1.00 0.68 H new ATOM 0 HB ILE A1226 3.196 -2.183 1.848 1.00 0.78 H new ATOM 0 HG12 ILE A1226 3.973 0.606 0.959 1.00 0.84 H new ATOM 0 HG13 ILE A1226 3.310 -0.664 -0.050 1.00 0.84 H new ATOM 0 HG21 ILE A1226 2.796 -0.536 3.662 1.00 0.86 H new ATOM 0 HG22 ILE A1226 4.134 -1.639 4.061 1.00 0.86 H new ATOM 0 HG23 ILE A1226 4.480 0.021 3.522 1.00 0.86 H new ATOM 0 HD11 ILE A1226 1.589 0.992 0.518 1.00 0.97 H new ATOM 0 HD12 ILE A1226 1.184 -0.588 1.228 1.00 0.97 H new ATOM 0 HD13 ILE A1226 1.858 0.702 2.253 1.00 0.97 H new ATOM 2756 N ALA A1227 6.621 -2.454 3.490 1.00 0.62 N ATOM 2757 CA ALA A1227 7.157 -3.303 4.553 1.00 0.63 C ATOM 2758 C ALA A1227 6.850 -2.731 5.956 1.00 0.68 C ATOM 2759 O ALA A1227 6.932 -1.520 6.187 1.00 0.89 O ATOM 2760 CB ALA A1227 8.660 -3.489 4.312 1.00 0.66 C ATOM 0 H ALA A1227 6.949 -1.491 3.564 1.00 0.62 H new ATOM 0 HA ALA A1227 6.669 -4.277 4.525 1.00 0.63 H new ATOM 0 HB1 ALA A1227 9.079 -4.120 5.096 1.00 0.66 H new ATOM 0 HB2 ALA A1227 8.817 -3.962 3.342 1.00 0.66 H new ATOM 0 HB3 ALA A1227 9.154 -2.517 4.326 1.00 0.66 H new ATOM 2766 N ILE A1228 6.459 -3.605 6.887 1.00 0.61 N ATOM 2767 CA ILE A1228 5.974 -3.276 8.241 1.00 0.67 C ATOM 2768 C ILE A1228 6.856 -3.975 9.293 1.00 0.77 C ATOM 2769 O ILE A1228 7.276 -5.111 9.065 1.00 0.93 O ATOM 2770 CB ILE A1228 4.478 -3.664 8.370 1.00 0.78 C ATOM 2771 CG1 ILE A1228 3.630 -3.089 7.203 1.00 1.07 C ATOM 2772 CG2 ILE A1228 3.907 -3.184 9.713 1.00 1.18 C ATOM 2773 CD1 ILE A1228 2.130 -3.411 7.267 1.00 1.24 C ATOM 0 H ILE A1228 6.470 -4.610 6.715 1.00 0.61 H new ATOM 0 HA ILE A1228 6.047 -2.203 8.417 1.00 0.67 H new ATOM 0 HB ILE A1228 4.423 -4.752 8.324 1.00 0.78 H new ATOM 0 HG12 ILE A1228 3.753 -2.006 7.185 1.00 1.07 H new ATOM 0 HG13 ILE A1228 4.028 -3.471 6.263 1.00 1.07 H new ATOM 0 HG21 ILE A1228 2.857 -3.466 9.783 1.00 1.18 H new ATOM 0 HG22 ILE A1228 4.462 -3.645 10.530 1.00 1.18 H new ATOM 0 HG23 ILE A1228 3.997 -2.100 9.780 1.00 1.18 H new ATOM 0 HD11 ILE A1228 1.625 -2.966 6.409 1.00 1.24 H new ATOM 0 HD12 ILE A1228 1.989 -4.492 7.251 1.00 1.24 H new ATOM 0 HD13 ILE A1228 1.709 -3.004 8.187 1.00 1.24 H new ATOM 2785 N ALA A1229 7.181 -3.310 10.413 1.00 0.87 N ATOM 2786 CA ALA A1229 8.066 -3.869 11.444 1.00 1.01 C ATOM 2787 C ALA A1229 7.879 -3.282 12.860 1.00 1.60 C ATOM 2788 O ALA A1229 7.556 -2.103 13.041 1.00 1.97 O ATOM 2789 CB ALA A1229 9.526 -3.655 11.011 1.00 1.13 C ATOM 0 H ALA A1229 6.839 -2.373 10.628 1.00 0.87 H new ATOM 0 HA ALA A1229 7.801 -4.923 11.522 1.00 1.01 H new ATOM 0 HB1 ALA A1229 10.194 -4.066 11.768 1.00 1.13 H new ATOM 0 HB2 ALA A1229 9.701 -4.159 10.061 1.00 1.13 H new ATOM 0 HB3 ALA A1229 9.719 -2.588 10.897 1.00 1.13 H new