USER MOD reduce.3.24.130724 H: found=0, std=0, add=981, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 979 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: A1107 THR OG1 : rot -138:sc= 0.085 USER MOD Set 1.2: A1125 ASN : amide:sc= 0.168 K(o=0.25,f=1.9) USER MOD Set 2.1: A1069 SER OG : rot 180:sc= 0.124 USER MOD Set 2.2: A1070 HIS : no HD1:sc= -0.1 X(o=0.023,f=0.12) USER MOD Single : A1053 THR OG1 : rot -23:sc= 0.37 USER MOD Single : A1057 ASN : amide:sc= 0.11 X(o=0.11,f=0) USER MOD Single : A1058 GLN : amide:sc= 0 X(o=0,f=0.14) USER MOD Single : A1060 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1063 THR OG1 : rot 150:sc= 0.455 USER MOD Single : A1065 SER OG : rot 180:sc= 0 USER MOD Single : A1066 ASN : amide:sc= 0.515 K(o=0.51,f=0) USER MOD Single : A1071 HIS : no HE2:sc= 0.298 K(o=0.3,f=-1.8) USER MOD Single : A1072 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1079 THR OG1 : rot 180:sc=-0.00371 USER MOD Single : A1082 SER OG : rot 171:sc= 1.22 USER MOD Single : A1083 ASN : amide:sc= 0.529 K(o=0.53,f=-0.011) USER MOD Single : A1084 SER OG : rot -101:sc= 0.574 USER MOD Single : A1086 HIS : no HD1:sc= 0.0909 K(o=0.091,f=-0.56) USER MOD Single : A1090 THR OG1 : rot -89:sc= 1.25 USER MOD Single : A1093 THR OG1 : rot -16:sc= 0.0742 USER MOD Single : A1094 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1095 TYR OH : rot 180:sc= 0 USER MOD Single : A1096 CYS SG : rot 180:sc= -0.59 USER MOD Single : A1097 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0355) USER MOD Single : A1098 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A1102 THR OG1 : rot -144:sc= 1.09 USER MOD Single : A1104 THR OG1 : rot 180:sc= 0 USER MOD Single : A1108 CYS SG : rot 180:sc=-0.00434 USER MOD Single : A1112 GLN : amide:sc= 0.522 K(o=0.52,f=0) USER MOD Single : A1117 CYS SG : rot 21:sc= 0.375 USER MOD Single : A1120 SER OG : rot 180:sc= 0 USER MOD Single : A1121 CYS SG : rot -26:sc= -0.343 USER MOD Single : A1122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1124 THR OG1 : rot 180:sc= 0 USER MOD Single : A1177 GLN : amide:sc= -0.0857 K(o=-0.086,f=-1.7) USER MOD Single : A1178 TYR OH : rot 180:sc= 0 USER MOD Single : A1179 LYS NZ :NH3+ -144:sc= 1.22 (180deg=0.14) USER MOD Single : A1184 ASN : amide:sc= -0.554 X(o=-0.55,f=-0.55) USER MOD Single : A1188 MET CE :methyl -159:sc= -0.0971 (180deg=-0.911) USER MOD Single : A1191 ASN : amide:sc= 1.15 K(o=1.2,f=-0.04) USER MOD Single : A1196 ASN : amide:sc= -0.0219 X(o=-0.022,f=0) USER MOD Single : A1197 ASN : amide:sc= -0.0392 K(o=-0.039,f=-1.2!) USER MOD Single : A1200 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1203 MET CE :methyl 152:sc= -0.203 (180deg=-1.76!) USER MOD Single : A1204 THR OG1 : rot 180:sc= 0 USER MOD Single : A1206 HIS : no HD1:sc= -0.0041 X(o=-0.0041,f=-0.1) USER MOD Single : A1209 LYS NZ :NH3+ 175:sc= 1.22 (180deg=1.2) USER MOD Single : A1212 THR OG1 : rot 180:sc= 0 USER MOD Single : A1223 CYS SG : rot -23:sc= 0.606 USER MOD ----------------------------------------------------------------- ATOM 89 N THR A1053 -6.290 -7.364 -15.531 1.00 1.73 N ATOM 90 CA THR A1053 -5.452 -7.182 -14.334 1.00 1.30 C ATOM 91 C THR A1053 -4.850 -5.794 -14.140 1.00 1.10 C ATOM 92 O THR A1053 -4.290 -5.210 -15.079 1.00 1.36 O ATOM 93 CB THR A1053 -4.333 -8.242 -14.267 1.00 1.72 C ATOM 94 OG1 THR A1053 -3.815 -8.546 -15.547 1.00 2.25 O ATOM 95 CG2 THR A1053 -4.834 -9.549 -13.669 1.00 2.04 C ATOM 0 HA THR A1053 -6.157 -7.309 -13.512 1.00 1.30 H new ATOM 0 HB THR A1053 -3.556 -7.805 -13.639 1.00 1.72 H new ATOM 0 HG1 THR A1053 -4.484 -8.330 -16.230 1.00 2.25 H new ATOM 0 HG21 THR A1053 -4.018 -10.271 -13.638 1.00 2.04 H new ATOM 0 HG22 THR A1053 -5.199 -9.370 -12.658 1.00 2.04 H new ATOM 0 HG23 THR A1053 -5.644 -9.943 -14.283 1.00 2.04 H new ATOM 103 N PRO A1054 -4.874 -5.292 -12.889 1.00 0.91 N ATOM 104 CA PRO A1054 -4.134 -4.106 -12.496 1.00 0.86 C ATOM 105 C PRO A1054 -2.615 -4.294 -12.662 1.00 0.84 C ATOM 106 O PRO A1054 -2.066 -5.306 -12.225 1.00 1.02 O ATOM 107 CB PRO A1054 -4.555 -3.839 -11.048 1.00 0.95 C ATOM 108 CG PRO A1054 -5.893 -4.539 -10.879 1.00 1.79 C ATOM 109 CD PRO A1054 -5.723 -5.739 -11.784 1.00 1.11 C ATOM 0 HA PRO A1054 -4.360 -3.250 -13.131 1.00 0.86 H new ATOM 0 HB2 PRO A1054 -3.817 -4.228 -10.347 1.00 0.95 H new ATOM 0 HB3 PRO A1054 -4.644 -2.770 -10.856 1.00 0.95 H new ATOM 0 HG2 PRO A1054 -6.076 -4.828 -9.844 1.00 1.79 H new ATOM 0 HG3 PRO A1054 -6.727 -3.909 -11.186 1.00 1.79 H new ATOM 0 HD2 PRO A1054 -5.262 -6.569 -11.249 1.00 1.11 H new ATOM 0 HD3 PRO A1054 -6.687 -6.091 -12.150 1.00 1.11 H new ATOM 117 N VAL A1055 -1.941 -3.317 -13.280 1.00 0.85 N ATOM 118 CA VAL A1055 -0.487 -3.298 -13.526 1.00 0.93 C ATOM 119 C VAL A1055 0.176 -2.123 -12.800 1.00 0.87 C ATOM 120 O VAL A1055 -0.282 -0.976 -12.871 1.00 0.76 O ATOM 121 CB VAL A1055 -0.167 -3.346 -15.039 1.00 1.09 C ATOM 122 CG1 VAL A1055 -0.499 -2.072 -15.818 1.00 1.99 C ATOM 123 CG2 VAL A1055 1.310 -3.666 -15.281 1.00 2.17 C ATOM 0 H VAL A1055 -2.408 -2.484 -13.638 1.00 0.85 H new ATOM 0 HA VAL A1055 -0.053 -4.204 -13.103 1.00 0.93 H new ATOM 0 HB VAL A1055 -0.819 -4.135 -15.413 1.00 1.09 H new ATOM 0 HG11 VAL A1055 -0.238 -2.209 -16.867 1.00 1.99 H new ATOM 0 HG12 VAL A1055 -1.565 -1.862 -15.734 1.00 1.99 H new ATOM 0 HG13 VAL A1055 0.069 -1.237 -15.408 1.00 1.99 H new ATOM 0 HG21 VAL A1055 1.505 -3.693 -16.353 1.00 2.17 H new ATOM 0 HG22 VAL A1055 1.929 -2.897 -14.819 1.00 2.17 H new ATOM 0 HG23 VAL A1055 1.549 -4.636 -14.844 1.00 2.17 H new ATOM 133 N VAL A1056 1.243 -2.408 -12.050 1.00 0.95 N ATOM 134 CA VAL A1056 1.918 -1.429 -11.180 1.00 0.85 C ATOM 135 C VAL A1056 2.636 -0.349 -11.999 1.00 0.84 C ATOM 136 O VAL A1056 3.377 -0.655 -12.934 1.00 1.11 O ATOM 137 CB VAL A1056 2.807 -2.125 -10.135 1.00 1.11 C ATOM 138 CG1 VAL A1056 3.866 -3.031 -10.755 1.00 1.46 C ATOM 139 CG2 VAL A1056 3.470 -1.108 -9.203 1.00 1.08 C ATOM 0 H VAL A1056 1.671 -3.334 -12.026 1.00 0.95 H new ATOM 0 HA VAL A1056 1.160 -0.897 -10.606 1.00 0.85 H new ATOM 0 HB VAL A1056 2.138 -2.761 -9.555 1.00 1.11 H new ATOM 0 HG11 VAL A1056 4.459 -3.491 -9.965 1.00 1.46 H new ATOM 0 HG12 VAL A1056 3.380 -3.809 -11.344 1.00 1.46 H new ATOM 0 HG13 VAL A1056 4.517 -2.441 -11.400 1.00 1.46 H new ATOM 0 HG21 VAL A1056 4.091 -1.631 -8.476 1.00 1.08 H new ATOM 0 HG22 VAL A1056 4.090 -0.429 -9.788 1.00 1.08 H new ATOM 0 HG23 VAL A1056 2.702 -0.539 -8.680 1.00 1.08 H new ATOM 149 N ASN A1057 2.369 0.922 -11.685 1.00 0.67 N ATOM 150 CA ASN A1057 2.764 2.079 -12.498 1.00 0.81 C ATOM 151 C ASN A1057 3.774 3.018 -11.809 1.00 0.83 C ATOM 152 O ASN A1057 4.632 3.587 -12.490 1.00 1.17 O ATOM 153 CB ASN A1057 1.456 2.789 -12.914 1.00 0.83 C ATOM 154 CG ASN A1057 1.117 2.530 -14.356 1.00 1.16 C ATOM 155 OD1 ASN A1057 1.088 3.432 -15.175 1.00 1.69 O ATOM 156 ND2 ASN A1057 0.840 1.297 -14.690 1.00 2.02 N ATOM 0 H ASN A1057 1.861 1.182 -10.840 1.00 0.67 H new ATOM 0 HA ASN A1057 3.316 1.742 -13.375 1.00 0.81 H new ATOM 0 HB2 ASN A1057 0.638 2.446 -12.281 1.00 0.83 H new ATOM 0 HB3 ASN A1057 1.557 3.862 -12.751 1.00 0.83 H new ATOM 0 HD21 ASN A1057 0.593 1.073 -15.654 1.00 2.02 H new ATOM 0 HD22 ASN A1057 0.871 0.559 -13.987 1.00 2.02 H new ATOM 163 N GLN A1058 3.678 3.200 -10.486 1.00 0.58 N ATOM 164 CA GLN A1058 4.701 3.857 -9.661 1.00 0.53 C ATOM 165 C GLN A1058 4.483 3.586 -8.162 1.00 0.49 C ATOM 166 O GLN A1058 3.349 3.417 -7.717 1.00 0.47 O ATOM 167 CB GLN A1058 4.716 5.382 -9.915 1.00 0.61 C ATOM 168 CG GLN A1058 6.108 5.964 -9.663 1.00 1.28 C ATOM 169 CD GLN A1058 6.235 7.422 -10.097 1.00 1.22 C ATOM 170 OE1 GLN A1058 5.535 8.302 -9.618 1.00 1.88 O ATOM 171 NE2 GLN A1058 7.126 7.726 -11.014 1.00 1.82 N ATOM 0 H GLN A1058 2.870 2.888 -9.947 1.00 0.58 H new ATOM 0 HA GLN A1058 5.664 3.435 -9.950 1.00 0.53 H new ATOM 0 HB2 GLN A1058 4.412 5.587 -10.942 1.00 0.61 H new ATOM 0 HB3 GLN A1058 3.990 5.870 -9.265 1.00 0.61 H new ATOM 0 HG2 GLN A1058 6.341 5.886 -8.601 1.00 1.28 H new ATOM 0 HG3 GLN A1058 6.847 5.367 -10.197 1.00 1.28 H new ATOM 0 HE21 GLN A1058 7.713 6.995 -11.417 1.00 1.82 H new ATOM 0 HE22 GLN A1058 7.231 8.693 -11.323 1.00 1.82 H new ATOM 180 N VAL A1059 5.560 3.615 -7.372 1.00 0.53 N ATOM 181 CA VAL A1059 5.515 3.626 -5.897 1.00 0.55 C ATOM 182 C VAL A1059 6.306 4.832 -5.377 1.00 0.57 C ATOM 183 O VAL A1059 7.389 5.118 -5.897 1.00 0.64 O ATOM 184 CB VAL A1059 5.987 2.293 -5.272 1.00 0.60 C ATOM 185 CG1 VAL A1059 5.292 1.086 -5.917 1.00 0.64 C ATOM 186 CG2 VAL A1059 7.498 2.048 -5.359 1.00 0.65 C ATOM 0 H VAL A1059 6.510 3.632 -7.742 1.00 0.53 H new ATOM 0 HA VAL A1059 4.476 3.727 -5.585 1.00 0.55 H new ATOM 0 HB VAL A1059 5.716 2.393 -4.221 1.00 0.60 H new ATOM 0 HG11 VAL A1059 5.650 0.168 -5.451 1.00 0.64 H new ATOM 0 HG12 VAL A1059 4.214 1.168 -5.776 1.00 0.64 H new ATOM 0 HG13 VAL A1059 5.517 1.063 -6.983 1.00 0.64 H new ATOM 0 HG21 VAL A1059 7.739 1.091 -4.896 1.00 0.65 H new ATOM 0 HG22 VAL A1059 7.804 2.033 -6.405 1.00 0.65 H new ATOM 0 HG23 VAL A1059 8.027 2.846 -4.838 1.00 0.65 H new ATOM 196 N LYS A1060 5.761 5.569 -4.400 1.00 0.52 N ATOM 197 CA LYS A1060 6.316 6.852 -3.925 1.00 0.54 C ATOM 198 C LYS A1060 6.215 7.023 -2.404 1.00 0.56 C ATOM 199 O LYS A1060 5.268 6.551 -1.779 1.00 0.50 O ATOM 200 CB LYS A1060 5.635 8.001 -4.678 1.00 0.62 C ATOM 201 CG LYS A1060 6.622 9.164 -4.797 1.00 0.79 C ATOM 202 CD LYS A1060 5.983 10.409 -5.393 1.00 1.14 C ATOM 203 CE LYS A1060 7.073 11.474 -5.371 1.00 1.43 C ATOM 204 NZ LYS A1060 6.568 12.808 -5.770 1.00 2.00 N ATOM 0 H LYS A1060 4.912 5.291 -3.909 1.00 0.52 H new ATOM 0 HA LYS A1060 7.384 6.862 -4.141 1.00 0.54 H new ATOM 0 HB2 LYS A1060 5.320 7.670 -5.668 1.00 0.62 H new ATOM 0 HB3 LYS A1060 4.737 8.320 -4.148 1.00 0.62 H new ATOM 0 HG2 LYS A1060 7.021 9.401 -3.811 1.00 0.79 H new ATOM 0 HG3 LYS A1060 7.465 8.859 -5.417 1.00 0.79 H new ATOM 0 HD2 LYS A1060 5.635 10.224 -6.409 1.00 1.14 H new ATOM 0 HD3 LYS A1060 5.116 10.722 -4.811 1.00 1.14 H new ATOM 0 HE2 LYS A1060 7.498 11.534 -4.369 1.00 1.43 H new ATOM 0 HE3 LYS A1060 7.880 11.178 -6.042 1.00 1.43 H new ATOM 0 HZ1 LYS A1060 7.346 13.497 -5.739 1.00 2.00 H new ATOM 0 HZ2 LYS A1060 6.186 12.760 -6.736 1.00 2.00 H new ATOM 0 HZ3 LYS A1060 5.817 13.105 -5.115 1.00 2.00 H new ATOM 218 N VAL A1061 7.173 7.727 -1.807 1.00 0.72 N ATOM 219 CA VAL A1061 7.236 8.034 -0.366 1.00 0.82 C ATOM 220 C VAL A1061 6.532 9.352 -0.014 1.00 0.90 C ATOM 221 O VAL A1061 6.471 10.282 -0.820 1.00 1.18 O ATOM 222 CB VAL A1061 8.714 8.034 0.093 1.00 1.06 C ATOM 223 CG1 VAL A1061 8.939 8.428 1.560 1.00 1.31 C ATOM 224 CG2 VAL A1061 9.318 6.635 -0.080 1.00 1.07 C ATOM 0 H VAL A1061 7.960 8.117 -2.326 1.00 0.72 H new ATOM 0 HA VAL A1061 6.694 7.257 0.173 1.00 0.82 H new ATOM 0 HB VAL A1061 9.190 8.787 -0.534 1.00 1.06 H new ATOM 0 HG11 VAL A1061 10.005 8.398 1.785 1.00 1.31 H new ATOM 0 HG12 VAL A1061 8.561 9.436 1.728 1.00 1.31 H new ATOM 0 HG13 VAL A1061 8.411 7.730 2.209 1.00 1.31 H new ATOM 0 HG21 VAL A1061 10.358 6.645 0.246 1.00 1.07 H new ATOM 0 HG22 VAL A1061 8.757 5.919 0.521 1.00 1.07 H new ATOM 0 HG23 VAL A1061 9.269 6.345 -1.130 1.00 1.07 H new ATOM 234 N LEU A1062 6.015 9.430 1.217 1.00 0.79 N ATOM 235 CA LEU A1062 5.513 10.644 1.877 1.00 0.83 C ATOM 236 C LEU A1062 6.353 10.997 3.121 1.00 0.89 C ATOM 237 O LEU A1062 6.574 12.174 3.411 1.00 1.02 O ATOM 238 CB LEU A1062 4.021 10.444 2.229 1.00 0.78 C ATOM 239 CG LEU A1062 3.367 11.623 2.986 1.00 0.86 C ATOM 240 CD1 LEU A1062 3.568 12.967 2.282 1.00 1.04 C ATOM 241 CD2 LEU A1062 1.865 11.385 3.096 1.00 0.96 C ATOM 0 H LEU A1062 5.930 8.606 1.812 1.00 0.79 H new ATOM 0 HA LEU A1062 5.605 11.490 1.195 1.00 0.83 H new ATOM 0 HB2 LEU A1062 3.465 10.270 1.307 1.00 0.78 H new ATOM 0 HB3 LEU A1062 3.923 9.543 2.835 1.00 0.78 H new ATOM 0 HG LEU A1062 3.847 11.668 3.964 1.00 0.86 H new ATOM 0 HD11 LEU A1062 3.087 13.756 2.860 1.00 1.04 H new ATOM 0 HD12 LEU A1062 4.634 13.178 2.197 1.00 1.04 H new ATOM 0 HD13 LEU A1062 3.126 12.926 1.286 1.00 1.04 H new ATOM 0 HD21 LEU A1062 1.403 12.216 3.630 1.00 0.96 H new ATOM 0 HD22 LEU A1062 1.434 11.311 2.097 1.00 0.96 H new ATOM 0 HD23 LEU A1062 1.682 10.458 3.640 1.00 0.96 H new ATOM 253 N THR A1063 6.836 9.991 3.854 1.00 0.90 N ATOM 254 CA THR A1063 7.479 10.170 5.164 1.00 0.99 C ATOM 255 C THR A1063 8.916 9.663 5.163 1.00 1.11 C ATOM 256 O THR A1063 9.193 8.478 5.335 1.00 1.38 O ATOM 257 CB THR A1063 6.618 9.526 6.252 1.00 1.09 C ATOM 258 OG1 THR A1063 5.353 10.154 6.232 1.00 1.95 O ATOM 259 CG2 THR A1063 7.184 9.681 7.660 1.00 2.02 C ATOM 0 H THR A1063 6.793 9.017 3.554 1.00 0.90 H new ATOM 0 HA THR A1063 7.549 11.235 5.384 1.00 0.99 H new ATOM 0 HB THR A1063 6.576 8.459 6.034 1.00 1.09 H new ATOM 0 HG1 THR A1063 4.667 9.518 6.525 1.00 1.95 H new ATOM 0 HG21 THR A1063 6.518 9.199 8.375 1.00 2.02 H new ATOM 0 HG22 THR A1063 8.168 9.215 7.710 1.00 2.02 H new ATOM 0 HG23 THR A1063 7.271 10.740 7.903 1.00 2.02 H new ATOM 267 N GLU A1064 9.841 10.600 4.986 1.00 1.47 N ATOM 268 CA GLU A1064 11.284 10.383 5.024 1.00 1.83 C ATOM 269 C GLU A1064 11.841 10.604 6.446 1.00 1.92 C ATOM 270 O GLU A1064 11.408 11.513 7.166 1.00 2.14 O ATOM 271 CB GLU A1064 11.903 11.297 3.954 1.00 2.32 C ATOM 272 CG GLU A1064 13.426 11.191 3.819 1.00 2.74 C ATOM 273 CD GLU A1064 13.976 11.843 2.538 1.00 3.15 C ATOM 274 OE1 GLU A1064 13.206 12.369 1.693 1.00 3.52 O ATOM 275 OE2 GLU A1064 15.219 11.808 2.351 1.00 3.88 O ATOM 0 H GLU A1064 9.596 11.573 4.804 1.00 1.47 H new ATOM 0 HA GLU A1064 11.546 9.351 4.792 1.00 1.83 H new ATOM 0 HB2 GLU A1064 11.450 11.063 2.991 1.00 2.32 H new ATOM 0 HB3 GLU A1064 11.644 12.330 4.185 1.00 2.32 H new ATOM 0 HG2 GLU A1064 13.893 11.660 4.685 1.00 2.74 H new ATOM 0 HG3 GLU A1064 13.712 10.139 3.833 1.00 2.74 H new ATOM 282 N SER A1065 12.798 9.760 6.850 1.00 1.99 N ATOM 283 CA SER A1065 13.570 9.851 8.104 1.00 2.19 C ATOM 284 C SER A1065 12.758 9.968 9.415 1.00 2.17 C ATOM 285 O SER A1065 13.230 10.599 10.369 1.00 2.89 O ATOM 286 CB SER A1065 14.612 10.973 8.007 1.00 2.59 C ATOM 287 OG SER A1065 15.409 10.875 6.838 1.00 2.86 O ATOM 0 H SER A1065 13.071 8.955 6.287 1.00 1.99 H new ATOM 0 HA SER A1065 14.052 8.877 8.190 1.00 2.19 H new ATOM 0 HB2 SER A1065 14.104 11.938 8.017 1.00 2.59 H new ATOM 0 HB3 SER A1065 15.256 10.943 8.886 1.00 2.59 H new ATOM 0 HG SER A1065 16.056 11.611 6.820 1.00 2.86 H new ATOM 293 N ASN A1066 11.536 9.416 9.475 1.00 1.72 N ATOM 294 CA ASN A1066 10.628 9.539 10.636 1.00 1.92 C ATOM 295 C ASN A1066 9.735 8.309 10.936 1.00 1.72 C ATOM 296 O ASN A1066 9.131 8.248 12.011 1.00 2.07 O ATOM 297 CB ASN A1066 9.737 10.781 10.433 1.00 2.23 C ATOM 298 CG ASN A1066 10.412 12.082 10.812 1.00 2.80 C ATOM 299 OD1 ASN A1066 10.393 12.494 11.967 1.00 3.42 O ATOM 300 ND2 ASN A1066 11.017 12.767 9.873 1.00 3.08 N ATOM 0 H ASN A1066 11.142 8.865 8.712 1.00 1.72 H new ATOM 0 HA ASN A1066 11.278 9.625 11.506 1.00 1.92 H new ATOM 0 HB2 ASN A1066 9.432 10.831 9.388 1.00 2.23 H new ATOM 0 HB3 ASN A1066 8.829 10.667 11.025 1.00 2.23 H new ATOM 0 HD21 ASN A1066 11.476 13.649 10.101 1.00 3.08 H new ATOM 0 HD22 ASN A1066 11.029 12.418 8.915 1.00 3.08 H new ATOM 307 N ARG A1067 9.596 7.352 10.010 1.00 1.45 N ATOM 308 CA ARG A1067 8.779 6.126 10.163 1.00 1.50 C ATOM 309 C ARG A1067 9.393 4.982 9.348 1.00 1.29 C ATOM 310 O ARG A1067 10.324 4.337 9.832 1.00 1.43 O ATOM 311 CB ARG A1067 7.290 6.446 9.867 1.00 1.58 C ATOM 312 CG ARG A1067 6.256 5.307 9.939 1.00 2.17 C ATOM 313 CD ARG A1067 6.281 4.451 11.207 1.00 2.73 C ATOM 314 NE ARG A1067 6.041 5.224 12.436 1.00 2.62 N ATOM 315 CZ ARG A1067 5.088 5.085 13.340 1.00 3.41 C ATOM 316 NH1 ARG A1067 3.988 4.407 13.175 1.00 4.48 N ATOM 317 NH2 ARG A1067 5.246 5.660 14.490 1.00 3.94 N ATOM 0 H ARG A1067 10.060 7.404 9.103 1.00 1.45 H new ATOM 0 HA ARG A1067 8.788 5.767 11.192 1.00 1.50 H new ATOM 0 HB2 ARG A1067 6.975 7.222 10.564 1.00 1.58 H new ATOM 0 HB3 ARG A1067 7.238 6.876 8.867 1.00 1.58 H new ATOM 0 HG2 ARG A1067 5.261 5.741 9.838 1.00 2.17 H new ATOM 0 HG3 ARG A1067 6.407 4.652 9.081 1.00 2.17 H new ATOM 0 HD2 ARG A1067 5.526 3.669 11.124 1.00 2.73 H new ATOM 0 HD3 ARG A1067 7.248 3.953 11.282 1.00 2.73 H new ATOM 0 HE ARG A1067 6.707 5.976 12.616 1.00 2.62 H new ATOM 0 HH11 ARG A1067 3.810 3.930 12.291 1.00 4.48 H new ATOM 0 HH12 ARG A1067 3.304 4.353 13.930 1.00 4.48 H new ATOM 0 HH21 ARG A1067 6.089 6.202 14.677 1.00 3.94 H new ATOM 0 HH22 ARG A1067 4.527 5.570 15.208 1.00 3.94 H new ATOM 331 N ILE A1068 8.896 4.724 8.136 1.00 1.49 N ATOM 332 CA ILE A1068 9.351 3.666 7.219 1.00 1.27 C ATOM 333 C ILE A1068 9.372 4.199 5.775 1.00 1.98 C ATOM 334 O ILE A1068 8.504 4.991 5.407 1.00 2.65 O ATOM 335 CB ILE A1068 8.437 2.422 7.332 1.00 0.92 C ATOM 336 CG1 ILE A1068 8.495 1.760 8.731 1.00 1.52 C ATOM 337 CG2 ILE A1068 8.838 1.389 6.270 1.00 0.81 C ATOM 338 CD1 ILE A1068 7.263 0.910 9.035 1.00 1.73 C ATOM 0 H ILE A1068 8.129 5.271 7.745 1.00 1.49 H new ATOM 0 HA ILE A1068 10.362 3.368 7.495 1.00 1.27 H new ATOM 0 HB ILE A1068 7.414 2.763 7.173 1.00 0.92 H new ATOM 0 HG12 ILE A1068 9.386 1.136 8.796 1.00 1.52 H new ATOM 0 HG13 ILE A1068 8.593 2.535 9.491 1.00 1.52 H new ATOM 0 HG21 ILE A1068 8.193 0.514 6.352 1.00 0.81 H new ATOM 0 HG22 ILE A1068 8.731 1.827 5.278 1.00 0.81 H new ATOM 0 HG23 ILE A1068 9.875 1.091 6.425 1.00 0.81 H new ATOM 0 HD11 ILE A1068 7.360 0.471 10.028 1.00 1.73 H new ATOM 0 HD12 ILE A1068 6.371 1.536 9.000 1.00 1.73 H new ATOM 0 HD13 ILE A1068 7.178 0.115 8.294 1.00 1.73 H new ATOM 350 N SER A1069 10.320 3.725 4.959 1.00 2.04 N ATOM 351 CA SER A1069 10.558 4.156 3.573 1.00 2.61 C ATOM 352 C SER A1069 10.503 3.032 2.525 1.00 1.97 C ATOM 353 O SER A1069 10.417 1.847 2.848 1.00 1.40 O ATOM 354 CB SER A1069 11.873 4.919 3.518 1.00 3.44 C ATOM 355 OG SER A1069 11.862 5.765 2.380 1.00 5.04 O ATOM 0 H SER A1069 10.972 2.999 5.257 1.00 2.04 H new ATOM 0 HA SER A1069 9.729 4.806 3.294 1.00 2.61 H new ATOM 0 HB2 SER A1069 12.006 5.508 4.425 1.00 3.44 H new ATOM 0 HB3 SER A1069 12.711 4.224 3.464 1.00 3.44 H new ATOM 0 HG SER A1069 12.705 6.263 2.335 1.00 5.04 H new ATOM 361 N HIS A1070 10.566 3.426 1.249 1.00 2.14 N ATOM 362 CA HIS A1070 10.239 2.632 0.054 1.00 1.79 C ATOM 363 C HIS A1070 10.652 1.149 0.060 1.00 1.31 C ATOM 364 O HIS A1070 9.773 0.305 -0.129 1.00 1.08 O ATOM 365 CB HIS A1070 10.773 3.345 -1.201 1.00 1.94 C ATOM 366 CG HIS A1070 12.245 3.684 -1.179 1.00 1.84 C ATOM 367 ND1 HIS A1070 13.261 2.944 -1.738 1.00 1.89 N ATOM 368 CD2 HIS A1070 12.821 4.809 -0.647 1.00 3.16 C ATOM 369 CE1 HIS A1070 14.413 3.608 -1.554 1.00 2.74 C ATOM 370 NE2 HIS A1070 14.202 4.737 -0.856 1.00 3.66 N ATOM 0 H HIS A1070 10.866 4.370 1.004 1.00 2.14 H new ATOM 0 HA HIS A1070 9.150 2.581 0.053 1.00 1.79 H new ATOM 0 HB2 HIS A1070 10.576 2.714 -2.068 1.00 1.94 H new ATOM 0 HB3 HIS A1070 10.208 4.266 -1.343 1.00 1.94 H new ATOM 0 HD2 HIS A1070 12.298 5.613 -0.151 1.00 3.16 H new ATOM 0 HE1 HIS A1070 15.376 3.280 -1.917 1.00 2.74 H new ATOM 0 HE2 HIS A1070 14.906 5.405 -0.542 1.00 3.66 H new ATOM 378 N HIS A1071 11.920 0.797 0.317 1.00 1.29 N ATOM 379 CA HIS A1071 12.364 -0.602 0.242 1.00 1.07 C ATOM 380 C HIS A1071 11.650 -1.488 1.281 1.00 1.00 C ATOM 381 O HIS A1071 11.293 -2.633 0.982 1.00 0.94 O ATOM 382 CB HIS A1071 13.896 -0.677 0.387 1.00 1.25 C ATOM 383 CG HIS A1071 14.511 -2.031 0.086 1.00 1.21 C ATOM 384 ND1 HIS A1071 13.848 -3.218 -0.155 1.00 1.95 N ATOM 385 CD2 HIS A1071 15.851 -2.307 0.005 1.00 2.47 C ATOM 386 CE1 HIS A1071 14.757 -4.179 -0.384 1.00 2.27 C ATOM 387 NE2 HIS A1071 15.999 -3.672 -0.287 1.00 2.57 N ATOM 0 H HIS A1071 12.652 1.458 0.577 1.00 1.29 H new ATOM 0 HA HIS A1071 12.090 -0.994 -0.737 1.00 1.07 H new ATOM 0 HB2 HIS A1071 14.344 0.063 -0.277 1.00 1.25 H new ATOM 0 HB3 HIS A1071 14.162 -0.394 1.405 1.00 1.25 H new ATOM 0 HD1 HIS A1071 12.836 -3.344 -0.158 1.00 1.95 H new ATOM 0 HD2 HIS A1071 16.654 -1.598 0.142 1.00 2.47 H new ATOM 0 HE1 HIS A1071 14.525 -5.209 -0.613 1.00 2.27 H new ATOM 395 N LYS A1072 11.383 -0.955 2.480 1.00 1.08 N ATOM 396 CA LYS A1072 10.686 -1.693 3.541 1.00 0.94 C ATOM 397 C LYS A1072 9.164 -1.533 3.482 1.00 0.77 C ATOM 398 O LYS A1072 8.481 -2.481 3.852 1.00 0.63 O ATOM 399 CB LYS A1072 11.333 -1.421 4.909 1.00 0.85 C ATOM 400 CG LYS A1072 12.777 -1.965 4.915 1.00 1.70 C ATOM 401 CD LYS A1072 13.407 -1.980 6.310 1.00 1.79 C ATOM 402 CE LYS A1072 14.860 -2.467 6.217 1.00 2.63 C ATOM 403 NZ LYS A1072 15.475 -2.639 7.554 1.00 2.80 N ATOM 0 H LYS A1072 11.643 -0.004 2.741 1.00 1.08 H new ATOM 0 HA LYS A1072 10.820 -2.760 3.366 1.00 0.94 H new ATOM 0 HB2 LYS A1072 11.336 -0.351 5.115 1.00 0.85 H new ATOM 0 HB3 LYS A1072 10.751 -1.896 5.699 1.00 0.85 H new ATOM 0 HG2 LYS A1072 12.779 -2.977 4.511 1.00 1.70 H new ATOM 0 HG3 LYS A1072 13.391 -1.356 4.252 1.00 1.70 H new ATOM 0 HD2 LYS A1072 13.375 -0.981 6.744 1.00 1.79 H new ATOM 0 HD3 LYS A1072 12.836 -2.633 6.970 1.00 1.79 H new ATOM 0 HE2 LYS A1072 14.891 -3.415 5.679 1.00 2.63 H new ATOM 0 HE3 LYS A1072 15.445 -1.753 5.638 1.00 2.63 H new ATOM 0 HZ1 LYS A1072 16.455 -2.969 7.445 1.00 2.80 H new ATOM 0 HZ2 LYS A1072 15.469 -1.729 8.058 1.00 2.80 H new ATOM 0 HZ3 LYS A1072 14.932 -3.340 8.098 1.00 2.80 H new ATOM 417 N ILE A1073 8.621 -0.439 2.924 1.00 0.83 N ATOM 418 CA ILE A1073 7.175 -0.331 2.611 1.00 0.78 C ATOM 419 C ILE A1073 6.782 -1.444 1.626 1.00 0.70 C ATOM 420 O ILE A1073 5.850 -2.202 1.898 1.00 0.63 O ATOM 421 CB ILE A1073 6.759 1.046 2.025 1.00 0.99 C ATOM 422 CG1 ILE A1073 7.070 2.236 2.956 1.00 1.08 C ATOM 423 CG2 ILE A1073 5.250 1.062 1.696 1.00 1.01 C ATOM 424 CD1 ILE A1073 6.923 3.610 2.281 1.00 1.31 C ATOM 0 H ILE A1073 9.160 0.391 2.677 1.00 0.83 H new ATOM 0 HA ILE A1073 6.645 -0.436 3.558 1.00 0.78 H new ATOM 0 HB ILE A1073 7.356 1.169 1.122 1.00 0.99 H new ATOM 0 HG12 ILE A1073 6.405 2.193 3.819 1.00 1.08 H new ATOM 0 HG13 ILE A1073 8.088 2.134 3.332 1.00 1.08 H new ATOM 0 HG21 ILE A1073 4.977 2.035 1.287 1.00 1.01 H new ATOM 0 HG22 ILE A1073 5.029 0.285 0.964 1.00 1.01 H new ATOM 0 HG23 ILE A1073 4.677 0.877 2.605 1.00 1.01 H new ATOM 0 HD11 ILE A1073 7.158 4.395 2.999 1.00 1.31 H new ATOM 0 HD12 ILE A1073 7.607 3.675 1.435 1.00 1.31 H new ATOM 0 HD13 ILE A1073 5.899 3.735 1.929 1.00 1.31 H new ATOM 436 N LEU A1074 7.499 -1.577 0.499 1.00 0.74 N ATOM 437 CA LEU A1074 7.181 -2.604 -0.504 1.00 0.65 C ATOM 438 C LEU A1074 7.394 -4.021 0.058 1.00 0.51 C ATOM 439 O LEU A1074 6.634 -4.929 -0.287 1.00 0.49 O ATOM 440 CB LEU A1074 7.910 -2.315 -1.838 1.00 0.71 C ATOM 441 CG LEU A1074 9.377 -2.785 -1.926 1.00 0.68 C ATOM 442 CD1 LEU A1074 9.500 -4.219 -2.453 1.00 0.57 C ATOM 443 CD2 LEU A1074 10.203 -1.896 -2.856 1.00 0.76 C ATOM 0 H LEU A1074 8.298 -0.990 0.261 1.00 0.74 H new ATOM 0 HA LEU A1074 6.118 -2.558 -0.742 1.00 0.65 H new ATOM 0 HB2 LEU A1074 7.349 -2.788 -2.645 1.00 0.71 H new ATOM 0 HB3 LEU A1074 7.883 -1.240 -2.018 1.00 0.71 H new ATOM 0 HG LEU A1074 9.754 -2.729 -0.905 1.00 0.68 H new ATOM 0 HD11 LEU A1074 10.552 -4.502 -2.496 1.00 0.57 H new ATOM 0 HD12 LEU A1074 8.968 -4.898 -1.787 1.00 0.57 H new ATOM 0 HD13 LEU A1074 9.067 -4.278 -3.452 1.00 0.57 H new ATOM 0 HD21 LEU A1074 11.230 -2.260 -2.891 1.00 0.76 H new ATOM 0 HD22 LEU A1074 9.775 -1.921 -3.858 1.00 0.76 H new ATOM 0 HD23 LEU A1074 10.194 -0.872 -2.483 1.00 0.76 H new ATOM 455 N ALA A1075 8.363 -4.199 0.969 1.00 0.52 N ATOM 456 CA ALA A1075 8.525 -5.453 1.695 1.00 0.50 C ATOM 457 C ALA A1075 7.286 -5.804 2.546 1.00 0.47 C ATOM 458 O ALA A1075 6.634 -6.805 2.252 1.00 0.55 O ATOM 459 CB ALA A1075 9.820 -5.417 2.512 1.00 0.62 C ATOM 0 H ALA A1075 9.046 -3.482 1.216 1.00 0.52 H new ATOM 0 HA ALA A1075 8.609 -6.263 0.971 1.00 0.50 H new ATOM 0 HB1 ALA A1075 9.936 -6.357 3.052 1.00 0.62 H new ATOM 0 HB2 ALA A1075 10.669 -5.277 1.843 1.00 0.62 H new ATOM 0 HB3 ALA A1075 9.779 -4.592 3.223 1.00 0.62 H new ATOM 465 N ILE A1076 6.897 -4.976 3.527 1.00 0.42 N ATOM 466 CA ILE A1076 5.813 -5.320 4.476 1.00 0.42 C ATOM 467 C ILE A1076 4.421 -5.376 3.839 1.00 0.45 C ATOM 468 O ILE A1076 3.605 -6.196 4.252 1.00 0.52 O ATOM 469 CB ILE A1076 5.811 -4.430 5.739 1.00 0.42 C ATOM 470 CG1 ILE A1076 5.554 -2.942 5.413 1.00 0.41 C ATOM 471 CG2 ILE A1076 7.115 -4.659 6.515 1.00 0.45 C ATOM 472 CD1 ILE A1076 5.819 -1.950 6.552 1.00 0.41 C ATOM 0 H ILE A1076 7.315 -4.060 3.689 1.00 0.42 H new ATOM 0 HA ILE A1076 6.048 -6.337 4.791 1.00 0.42 H new ATOM 0 HB ILE A1076 4.976 -4.720 6.377 1.00 0.42 H new ATOM 0 HG12 ILE A1076 6.177 -2.664 4.563 1.00 0.41 H new ATOM 0 HG13 ILE A1076 4.516 -2.833 5.097 1.00 0.41 H new ATOM 0 HG21 ILE A1076 7.121 -4.034 7.408 1.00 0.45 H new ATOM 0 HG22 ILE A1076 7.187 -5.707 6.805 1.00 0.45 H new ATOM 0 HG23 ILE A1076 7.965 -4.398 5.884 1.00 0.45 H new ATOM 0 HD11 ILE A1076 5.605 -0.937 6.210 1.00 0.41 H new ATOM 0 HD12 ILE A1076 5.177 -2.189 7.400 1.00 0.41 H new ATOM 0 HD13 ILE A1076 6.863 -2.017 6.857 1.00 0.41 H new ATOM 484 N VAL A1077 4.142 -4.571 2.804 1.00 0.45 N ATOM 485 CA VAL A1077 2.887 -4.702 2.039 1.00 0.54 C ATOM 486 C VAL A1077 2.872 -6.026 1.269 1.00 0.58 C ATOM 487 O VAL A1077 1.863 -6.729 1.285 1.00 0.65 O ATOM 488 CB VAL A1077 2.658 -3.500 1.100 1.00 0.60 C ATOM 489 CG1 VAL A1077 1.384 -3.655 0.255 1.00 0.73 C ATOM 490 CG2 VAL A1077 2.494 -2.200 1.898 1.00 0.62 C ATOM 0 H VAL A1077 4.760 -3.828 2.477 1.00 0.45 H new ATOM 0 HA VAL A1077 2.059 -4.706 2.748 1.00 0.54 H new ATOM 0 HB VAL A1077 3.536 -3.463 0.455 1.00 0.60 H new ATOM 0 HG11 VAL A1077 1.267 -2.784 -0.389 1.00 0.73 H new ATOM 0 HG12 VAL A1077 1.461 -4.553 -0.359 1.00 0.73 H new ATOM 0 HG13 VAL A1077 0.519 -3.739 0.913 1.00 0.73 H new ATOM 0 HG21 VAL A1077 2.334 -1.369 1.211 1.00 0.62 H new ATOM 0 HG22 VAL A1077 1.637 -2.289 2.566 1.00 0.62 H new ATOM 0 HG23 VAL A1077 3.394 -2.017 2.485 1.00 0.62 H new ATOM 500 N GLY A1078 3.993 -6.414 0.650 1.00 0.58 N ATOM 501 CA GLY A1078 4.110 -7.683 -0.069 1.00 0.68 C ATOM 502 C GLY A1078 4.031 -8.908 0.848 1.00 0.75 C ATOM 503 O GLY A1078 3.320 -9.860 0.531 1.00 0.91 O ATOM 0 H GLY A1078 4.845 -5.854 0.635 1.00 0.58 H new ATOM 0 HA2 GLY A1078 3.318 -7.744 -0.815 1.00 0.68 H new ATOM 0 HA3 GLY A1078 5.057 -7.701 -0.608 1.00 0.68 H new ATOM 507 N THR A1079 4.706 -8.890 2.002 1.00 0.69 N ATOM 508 CA THR A1079 4.670 -10.008 2.959 1.00 0.79 C ATOM 509 C THR A1079 3.340 -10.121 3.700 1.00 0.95 C ATOM 510 O THR A1079 2.936 -11.230 4.048 1.00 1.22 O ATOM 511 CB THR A1079 5.832 -9.998 3.943 1.00 0.77 C ATOM 512 OG1 THR A1079 5.797 -8.877 4.766 1.00 0.78 O ATOM 513 CG2 THR A1079 7.192 -10.059 3.261 1.00 0.69 C ATOM 0 H THR A1079 5.289 -8.108 2.300 1.00 0.69 H new ATOM 0 HA THR A1079 4.778 -10.898 2.339 1.00 0.79 H new ATOM 0 HB THR A1079 5.707 -10.901 4.541 1.00 0.77 H new ATOM 0 HG1 THR A1079 6.555 -8.903 5.386 1.00 0.78 H new ATOM 0 HG21 THR A1079 7.978 -10.049 4.016 1.00 0.69 H new ATOM 0 HG22 THR A1079 7.264 -10.975 2.674 1.00 0.69 H new ATOM 0 HG23 THR A1079 7.309 -9.197 2.604 1.00 0.69 H new ATOM 521 N ALA A1080 2.615 -9.019 3.901 1.00 0.84 N ATOM 522 CA ALA A1080 1.239 -9.058 4.394 1.00 0.92 C ATOM 523 C ALA A1080 0.274 -9.644 3.342 1.00 0.95 C ATOM 524 O ALA A1080 -0.311 -10.710 3.559 1.00 1.14 O ATOM 525 CB ALA A1080 0.828 -7.648 4.832 1.00 0.94 C ATOM 0 H ALA A1080 2.965 -8.077 3.727 1.00 0.84 H new ATOM 0 HA ALA A1080 1.183 -9.724 5.255 1.00 0.92 H new ATOM 0 HB1 ALA A1080 -0.197 -7.666 5.202 1.00 0.94 H new ATOM 0 HB2 ALA A1080 1.493 -7.305 5.624 1.00 0.94 H new ATOM 0 HB3 ALA A1080 0.895 -6.969 3.982 1.00 0.94 H new ATOM 531 N GLU A1081 0.167 -9.000 2.176 1.00 0.92 N ATOM 532 CA GLU A1081 -0.809 -9.327 1.117 1.00 1.01 C ATOM 533 C GLU A1081 -0.565 -10.721 0.500 1.00 0.88 C ATOM 534 O GLU A1081 -1.486 -11.322 -0.055 1.00 0.97 O ATOM 535 CB GLU A1081 -0.807 -8.182 0.086 1.00 1.15 C ATOM 536 CG GLU A1081 -1.745 -8.313 -1.126 1.00 1.34 C ATOM 537 CD GLU A1081 -3.244 -8.419 -0.821 1.00 1.31 C ATOM 538 OE1 GLU A1081 -3.742 -7.700 0.070 1.00 1.80 O ATOM 539 OE2 GLU A1081 -3.929 -9.183 -1.545 1.00 2.34 O ATOM 0 H GLU A1081 0.770 -8.215 1.930 1.00 0.92 H new ATOM 0 HA GLU A1081 -1.808 -9.402 1.546 1.00 1.01 H new ATOM 0 HB2 GLU A1081 -1.060 -7.259 0.608 1.00 1.15 H new ATOM 0 HB3 GLU A1081 0.211 -8.068 -0.288 1.00 1.15 H new ATOM 0 HG2 GLU A1081 -1.589 -7.450 -1.774 1.00 1.34 H new ATOM 0 HG3 GLU A1081 -1.449 -9.195 -1.693 1.00 1.34 H new ATOM 546 N SER A1082 0.631 -11.298 0.673 1.00 0.70 N ATOM 547 CA SER A1082 0.948 -12.700 0.350 1.00 0.65 C ATOM 548 C SER A1082 -0.048 -13.703 0.971 1.00 0.63 C ATOM 549 O SER A1082 -0.370 -14.728 0.368 1.00 0.67 O ATOM 550 CB SER A1082 2.360 -12.996 0.872 1.00 0.77 C ATOM 551 OG SER A1082 2.756 -14.315 0.571 1.00 1.29 O ATOM 0 H SER A1082 1.430 -10.790 1.052 1.00 0.70 H new ATOM 0 HA SER A1082 0.881 -12.823 -0.731 1.00 0.65 H new ATOM 0 HB2 SER A1082 3.067 -12.293 0.431 1.00 0.77 H new ATOM 0 HB3 SER A1082 2.390 -12.843 1.951 1.00 0.77 H new ATOM 0 HG SER A1082 3.704 -14.431 0.792 1.00 1.29 H new ATOM 557 N ASN A1083 -0.618 -13.388 2.141 1.00 0.72 N ATOM 558 CA ASN A1083 -1.607 -14.228 2.837 1.00 0.82 C ATOM 559 C ASN A1083 -3.044 -14.115 2.273 1.00 0.81 C ATOM 560 O ASN A1083 -3.965 -14.719 2.833 1.00 1.01 O ATOM 561 CB ASN A1083 -1.602 -13.882 4.332 1.00 1.12 C ATOM 562 CG ASN A1083 -0.278 -14.111 5.035 1.00 1.36 C ATOM 563 OD1 ASN A1083 0.038 -15.198 5.501 1.00 2.16 O ATOM 564 ND2 ASN A1083 0.526 -13.088 5.160 1.00 2.56 N ATOM 0 H ASN A1083 -0.402 -12.526 2.642 1.00 0.72 H new ATOM 0 HA ASN A1083 -1.305 -15.263 2.674 1.00 0.82 H new ATOM 0 HB2 ASN A1083 -1.883 -12.835 4.449 1.00 1.12 H new ATOM 0 HB3 ASN A1083 -2.369 -14.475 4.830 1.00 1.12 H new ATOM 0 HD21 ASN A1083 1.416 -13.196 5.646 1.00 2.56 H new ATOM 0 HD22 ASN A1083 0.263 -12.182 4.772 1.00 2.56 H new ATOM 571 N SER A1084 -3.241 -13.347 1.200 1.00 0.89 N ATOM 572 CA SER A1084 -4.544 -12.987 0.616 1.00 1.08 C ATOM 573 C SER A1084 -4.687 -13.441 -0.849 1.00 1.14 C ATOM 574 O SER A1084 -3.807 -14.121 -1.392 1.00 1.43 O ATOM 575 CB SER A1084 -4.747 -11.474 0.775 1.00 1.11 C ATOM 576 OG SER A1084 -4.680 -11.118 2.145 1.00 1.89 O ATOM 0 H SER A1084 -2.461 -12.937 0.686 1.00 0.89 H new ATOM 0 HA SER A1084 -5.330 -13.519 1.153 1.00 1.08 H new ATOM 0 HB2 SER A1084 -3.984 -10.935 0.213 1.00 1.11 H new ATOM 0 HB3 SER A1084 -5.713 -11.183 0.362 1.00 1.11 H new ATOM 0 HG SER A1084 -5.587 -10.989 2.494 1.00 1.89 H new ATOM 582 N GLU A1085 -5.826 -13.134 -1.484 1.00 1.25 N ATOM 583 CA GLU A1085 -6.187 -13.574 -2.847 1.00 1.51 C ATOM 584 C GLU A1085 -6.880 -12.471 -3.679 1.00 1.48 C ATOM 585 O GLU A1085 -7.755 -12.754 -4.503 1.00 1.75 O ATOM 586 CB GLU A1085 -7.064 -14.847 -2.788 1.00 1.94 C ATOM 587 CG GLU A1085 -6.478 -15.969 -1.924 1.00 2.84 C ATOM 588 CD GLU A1085 -7.173 -17.303 -2.189 1.00 3.42 C ATOM 589 OE1 GLU A1085 -8.359 -17.483 -1.808 1.00 3.47 O ATOM 590 OE2 GLU A1085 -6.517 -18.211 -2.752 1.00 4.48 O ATOM 0 H GLU A1085 -6.547 -12.555 -1.054 1.00 1.25 H new ATOM 0 HA GLU A1085 -5.252 -13.803 -3.359 1.00 1.51 H new ATOM 0 HB2 GLU A1085 -8.047 -14.580 -2.401 1.00 1.94 H new ATOM 0 HB3 GLU A1085 -7.211 -15.222 -3.801 1.00 1.94 H new ATOM 0 HG2 GLU A1085 -5.412 -16.067 -2.128 1.00 2.84 H new ATOM 0 HG3 GLU A1085 -6.579 -15.708 -0.870 1.00 2.84 H new ATOM 597 N HIS A1086 -6.564 -11.196 -3.427 1.00 1.23 N ATOM 598 CA HIS A1086 -7.292 -10.052 -3.995 1.00 1.11 C ATOM 599 C HIS A1086 -6.863 -9.676 -5.435 1.00 1.03 C ATOM 600 O HIS A1086 -5.687 -9.804 -5.788 1.00 1.10 O ATOM 601 CB HIS A1086 -7.160 -8.854 -3.046 1.00 1.05 C ATOM 602 CG HIS A1086 -8.069 -8.921 -1.840 1.00 1.23 C ATOM 603 ND1 HIS A1086 -9.448 -9.007 -1.863 1.00 1.78 N ATOM 604 CD2 HIS A1086 -7.690 -8.899 -0.521 1.00 1.46 C ATOM 605 CE1 HIS A1086 -9.887 -9.080 -0.599 1.00 1.91 C ATOM 606 NE2 HIS A1086 -8.850 -9.036 0.250 1.00 1.76 N ATOM 0 H HIS A1086 -5.791 -10.925 -2.819 1.00 1.23 H new ATOM 0 HA HIS A1086 -8.336 -10.351 -4.087 1.00 1.11 H new ATOM 0 HB2 HIS A1086 -6.127 -8.785 -2.706 1.00 1.05 H new ATOM 0 HB3 HIS A1086 -7.375 -7.940 -3.600 1.00 1.05 H new ATOM 0 HD2 HIS A1086 -6.682 -8.795 -0.147 1.00 1.46 H new ATOM 0 HE1 HIS A1086 -10.924 -9.162 -0.307 1.00 1.91 H new ATOM 0 HE2 HIS A1086 -8.898 -9.092 1.267 1.00 1.76 H new ATOM 614 N PRO A1087 -7.773 -9.119 -6.264 1.00 1.06 N ATOM 615 CA PRO A1087 -7.532 -8.843 -7.692 1.00 1.07 C ATOM 616 C PRO A1087 -6.407 -7.834 -7.980 1.00 1.05 C ATOM 617 O PRO A1087 -5.814 -7.850 -9.060 1.00 1.30 O ATOM 618 CB PRO A1087 -8.870 -8.294 -8.212 1.00 1.06 C ATOM 619 CG PRO A1087 -9.552 -7.718 -6.975 1.00 1.01 C ATOM 620 CD PRO A1087 -9.130 -8.718 -5.906 1.00 1.16 C ATOM 0 HA PRO A1087 -7.197 -9.757 -8.182 1.00 1.07 H new ATOM 0 HB2 PRO A1087 -8.716 -7.529 -8.973 1.00 1.06 H new ATOM 0 HB3 PRO A1087 -9.472 -9.080 -8.667 1.00 1.06 H new ATOM 0 HG2 PRO A1087 -9.210 -6.708 -6.750 1.00 1.01 H new ATOM 0 HG3 PRO A1087 -10.635 -7.670 -7.088 1.00 1.01 H new ATOM 0 HD2 PRO A1087 -9.158 -8.267 -4.914 1.00 1.16 H new ATOM 0 HD3 PRO A1087 -9.801 -9.577 -5.885 1.00 1.16 H new ATOM 628 N LEU A1088 -6.121 -6.950 -7.020 1.00 0.90 N ATOM 629 CA LEU A1088 -5.251 -5.779 -7.173 1.00 0.86 C ATOM 630 C LEU A1088 -3.997 -5.880 -6.290 1.00 0.77 C ATOM 631 O LEU A1088 -2.890 -5.628 -6.761 1.00 0.77 O ATOM 632 CB LEU A1088 -6.168 -4.578 -6.879 1.00 0.96 C ATOM 633 CG LEU A1088 -5.664 -3.154 -7.143 1.00 0.65 C ATOM 634 CD1 LEU A1088 -6.880 -2.234 -7.237 1.00 0.62 C ATOM 635 CD2 LEU A1088 -4.796 -2.604 -6.013 1.00 0.82 C ATOM 0 H LEU A1088 -6.504 -7.033 -6.078 1.00 0.90 H new ATOM 0 HA LEU A1088 -4.823 -5.683 -8.171 1.00 0.86 H new ATOM 0 HB2 LEU A1088 -7.079 -4.714 -7.461 1.00 0.96 H new ATOM 0 HB3 LEU A1088 -6.450 -4.634 -5.828 1.00 0.96 H new ATOM 0 HG LEU A1088 -5.068 -3.190 -8.055 1.00 0.65 H new ATOM 0 HD11 LEU A1088 -6.550 -1.212 -7.425 1.00 0.62 H new ATOM 0 HD12 LEU A1088 -7.523 -2.563 -8.053 1.00 0.62 H new ATOM 0 HD13 LEU A1088 -7.436 -2.269 -6.300 1.00 0.62 H new ATOM 0 HD21 LEU A1088 -4.472 -1.593 -6.262 1.00 0.82 H new ATOM 0 HD22 LEU A1088 -5.373 -2.583 -5.088 1.00 0.82 H new ATOM 0 HD23 LEU A1088 -3.923 -3.243 -5.881 1.00 0.82 H new ATOM 647 N GLY A1089 -4.149 -6.346 -5.044 1.00 0.84 N ATOM 648 CA GLY A1089 -3.026 -6.623 -4.135 1.00 0.99 C ATOM 649 C GLY A1089 -2.022 -7.653 -4.680 1.00 0.97 C ATOM 650 O GLY A1089 -0.816 -7.504 -4.492 1.00 0.97 O ATOM 0 H GLY A1089 -5.062 -6.543 -4.634 1.00 0.84 H new ATOM 0 HA2 GLY A1089 -2.500 -5.691 -3.929 1.00 0.99 H new ATOM 0 HA3 GLY A1089 -3.421 -6.983 -3.185 1.00 0.99 H new ATOM 654 N THR A1090 -2.498 -8.630 -5.459 1.00 0.99 N ATOM 655 CA THR A1090 -1.672 -9.655 -6.130 1.00 1.06 C ATOM 656 C THR A1090 -0.615 -9.090 -7.094 1.00 0.85 C ATOM 657 O THR A1090 0.410 -9.737 -7.324 1.00 0.86 O ATOM 658 CB THR A1090 -2.552 -10.665 -6.888 1.00 1.30 C ATOM 659 OG1 THR A1090 -3.605 -10.002 -7.555 1.00 1.33 O ATOM 660 CG2 THR A1090 -3.186 -11.694 -5.954 1.00 1.73 C ATOM 0 H THR A1090 -3.494 -8.738 -5.649 1.00 0.99 H new ATOM 0 HA THR A1090 -1.132 -10.147 -5.321 1.00 1.06 H new ATOM 0 HB THR A1090 -1.893 -11.171 -7.594 1.00 1.30 H new ATOM 0 HG1 THR A1090 -4.377 -9.928 -6.956 1.00 1.33 H new ATOM 0 HG21 THR A1090 -3.797 -12.385 -6.535 1.00 1.73 H new ATOM 0 HG22 THR A1090 -2.402 -12.249 -5.438 1.00 1.73 H new ATOM 0 HG23 THR A1090 -3.811 -11.184 -5.221 1.00 1.73 H new ATOM 668 N ALA A1091 -0.793 -7.878 -7.637 1.00 0.74 N ATOM 669 CA ALA A1091 0.243 -7.213 -8.439 1.00 0.67 C ATOM 670 C ALA A1091 1.426 -6.740 -7.569 1.00 0.55 C ATOM 671 O ALA A1091 2.587 -6.811 -7.984 1.00 0.54 O ATOM 672 CB ALA A1091 -0.395 -6.038 -9.190 1.00 0.74 C ATOM 0 H ALA A1091 -1.650 -7.335 -7.534 1.00 0.74 H new ATOM 0 HA ALA A1091 0.651 -7.928 -9.154 1.00 0.67 H new ATOM 0 HB1 ALA A1091 0.363 -5.535 -9.790 1.00 0.74 H new ATOM 0 HB2 ALA A1091 -1.186 -6.409 -9.842 1.00 0.74 H new ATOM 0 HB3 ALA A1091 -0.817 -5.334 -8.473 1.00 0.74 H new ATOM 678 N ILE A1092 1.130 -6.280 -6.347 1.00 0.54 N ATOM 679 CA ILE A1092 2.113 -5.816 -5.356 1.00 0.52 C ATOM 680 C ILE A1092 2.893 -7.003 -4.780 1.00 0.49 C ATOM 681 O ILE A1092 4.114 -6.925 -4.635 1.00 0.52 O ATOM 682 CB ILE A1092 1.440 -5.006 -4.220 1.00 0.67 C ATOM 683 CG1 ILE A1092 0.406 -3.972 -4.723 1.00 0.86 C ATOM 684 CG2 ILE A1092 2.530 -4.274 -3.421 1.00 0.74 C ATOM 685 CD1 ILE A1092 -0.426 -3.336 -3.603 1.00 0.85 C ATOM 0 H ILE A1092 0.170 -6.218 -6.009 1.00 0.54 H new ATOM 0 HA ILE A1092 2.809 -5.151 -5.867 1.00 0.52 H new ATOM 0 HB ILE A1092 0.895 -5.720 -3.602 1.00 0.67 H new ATOM 0 HG12 ILE A1092 0.928 -3.185 -5.267 1.00 0.86 H new ATOM 0 HG13 ILE A1092 -0.265 -4.458 -5.431 1.00 0.86 H new ATOM 0 HG21 ILE A1092 2.069 -3.700 -2.618 1.00 0.74 H new ATOM 0 HG22 ILE A1092 3.221 -5.002 -2.996 1.00 0.74 H new ATOM 0 HG23 ILE A1092 3.075 -3.600 -4.082 1.00 0.74 H new ATOM 0 HD11 ILE A1092 -1.129 -2.622 -4.032 1.00 0.85 H new ATOM 0 HD12 ILE A1092 -0.977 -4.113 -3.073 1.00 0.85 H new ATOM 0 HD13 ILE A1092 0.235 -2.820 -2.907 1.00 0.85 H new ATOM 697 N THR A1093 2.217 -8.123 -4.496 1.00 0.49 N ATOM 698 CA THR A1093 2.894 -9.335 -4.004 1.00 0.51 C ATOM 699 C THR A1093 3.883 -9.882 -5.019 1.00 0.51 C ATOM 700 O THR A1093 5.000 -10.179 -4.613 1.00 0.53 O ATOM 701 CB THR A1093 1.946 -10.448 -3.556 1.00 0.67 C ATOM 702 OG1 THR A1093 1.110 -10.888 -4.595 1.00 2.06 O ATOM 703 CG2 THR A1093 1.073 -9.951 -2.418 1.00 2.52 C ATOM 0 H THR A1093 1.206 -8.218 -4.597 1.00 0.49 H new ATOM 0 HA THR A1093 3.431 -9.003 -3.115 1.00 0.51 H new ATOM 0 HB THR A1093 2.567 -11.285 -3.237 1.00 0.67 H new ATOM 0 HG1 THR A1093 1.124 -10.234 -5.325 1.00 2.06 H new ATOM 0 HG21 THR A1093 0.399 -10.747 -2.102 1.00 2.52 H new ATOM 0 HG22 THR A1093 1.703 -9.654 -1.579 1.00 2.52 H new ATOM 0 HG23 THR A1093 0.489 -9.094 -2.755 1.00 2.52 H new ATOM 711 N LYS A1094 3.561 -9.898 -6.322 1.00 0.53 N ATOM 712 CA LYS A1094 4.524 -10.206 -7.392 1.00 0.57 C ATOM 713 C LYS A1094 5.711 -9.236 -7.410 1.00 0.57 C ATOM 714 O LYS A1094 6.858 -9.685 -7.409 1.00 0.62 O ATOM 715 CB LYS A1094 3.797 -10.248 -8.744 1.00 0.64 C ATOM 716 CG LYS A1094 4.797 -10.326 -9.910 1.00 0.77 C ATOM 717 CD LYS A1094 4.162 -10.832 -11.207 1.00 0.97 C ATOM 718 CE LYS A1094 3.050 -9.909 -11.719 1.00 2.00 C ATOM 719 NZ LYS A1094 2.452 -10.451 -12.956 1.00 2.33 N ATOM 0 H LYS A1094 2.622 -9.697 -6.665 1.00 0.53 H new ATOM 0 HA LYS A1094 4.950 -11.189 -7.192 1.00 0.57 H new ATOM 0 HB2 LYS A1094 3.130 -11.110 -8.775 1.00 0.64 H new ATOM 0 HB3 LYS A1094 3.175 -9.360 -8.853 1.00 0.64 H new ATOM 0 HG2 LYS A1094 5.224 -9.338 -10.082 1.00 0.77 H new ATOM 0 HG3 LYS A1094 5.620 -10.985 -9.633 1.00 0.77 H new ATOM 0 HD2 LYS A1094 4.933 -10.925 -11.972 1.00 0.97 H new ATOM 0 HD3 LYS A1094 3.754 -11.829 -11.042 1.00 0.97 H new ATOM 0 HE2 LYS A1094 2.281 -9.799 -10.955 1.00 2.00 H new ATOM 0 HE3 LYS A1094 3.454 -8.915 -11.910 1.00 2.00 H new ATOM 0 HZ1 LYS A1094 1.701 -9.812 -13.287 1.00 2.33 H new ATOM 0 HZ2 LYS A1094 3.185 -10.533 -13.689 1.00 2.33 H new ATOM 0 HZ3 LYS A1094 2.048 -11.390 -12.764 1.00 2.33 H new ATOM 733 N TYR A1095 5.446 -7.926 -7.385 1.00 0.56 N ATOM 734 CA TYR A1095 6.487 -6.889 -7.406 1.00 0.59 C ATOM 735 C TYR A1095 7.490 -7.076 -6.254 1.00 0.60 C ATOM 736 O TYR A1095 8.701 -7.004 -6.473 1.00 0.66 O ATOM 737 CB TYR A1095 5.807 -5.509 -7.371 1.00 0.59 C ATOM 738 CG TYR A1095 6.735 -4.312 -7.510 1.00 0.60 C ATOM 739 CD1 TYR A1095 7.077 -3.829 -8.789 1.00 2.11 C ATOM 740 CD2 TYR A1095 7.214 -3.645 -6.363 1.00 2.29 C ATOM 741 CE1 TYR A1095 7.901 -2.695 -8.924 1.00 2.19 C ATOM 742 CE2 TYR A1095 8.034 -2.505 -6.495 1.00 2.28 C ATOM 743 CZ TYR A1095 8.384 -2.031 -7.777 1.00 0.84 C ATOM 744 OH TYR A1095 9.168 -0.926 -7.913 1.00 1.03 O ATOM 0 H TYR A1095 4.498 -7.551 -7.349 1.00 0.56 H new ATOM 0 HA TYR A1095 7.069 -6.970 -8.324 1.00 0.59 H new ATOM 0 HB2 TYR A1095 5.069 -5.468 -8.172 1.00 0.59 H new ATOM 0 HB3 TYR A1095 5.263 -5.416 -6.431 1.00 0.59 H new ATOM 0 HD1 TYR A1095 6.705 -4.331 -9.670 1.00 2.11 H new ATOM 0 HD2 TYR A1095 6.952 -4.009 -5.380 1.00 2.29 H new ATOM 0 HE1 TYR A1095 8.164 -2.333 -9.907 1.00 2.19 H new ATOM 0 HE2 TYR A1095 8.394 -1.995 -5.614 1.00 2.28 H new ATOM 0 HH TYR A1095 9.415 -0.589 -7.027 1.00 1.03 H new ATOM 754 N CYS A1096 6.994 -7.407 -5.054 1.00 0.57 N ATOM 755 CA CYS A1096 7.806 -7.764 -3.892 1.00 0.60 C ATOM 756 C CYS A1096 8.485 -9.143 -4.028 1.00 0.63 C ATOM 757 O CYS A1096 9.706 -9.212 -3.987 1.00 0.64 O ATOM 758 CB CYS A1096 6.932 -7.639 -2.639 1.00 0.59 C ATOM 759 SG CYS A1096 7.943 -7.845 -1.152 1.00 1.84 S ATOM 0 H CYS A1096 5.992 -7.433 -4.864 1.00 0.57 H new ATOM 0 HA CYS A1096 8.643 -7.071 -3.812 1.00 0.60 H new ATOM 0 HB2 CYS A1096 6.443 -6.665 -2.623 1.00 0.59 H new ATOM 0 HB3 CYS A1096 6.144 -8.392 -2.659 1.00 0.59 H new ATOM 0 HG CYS A1096 7.191 -7.735 -0.097 1.00 1.84 H new ATOM 765 N LYS A1097 7.739 -10.233 -4.262 1.00 0.67 N ATOM 766 CA LYS A1097 8.225 -11.617 -4.461 1.00 0.73 C ATOM 767 C LYS A1097 9.458 -11.667 -5.364 1.00 0.87 C ATOM 768 O LYS A1097 10.480 -12.249 -4.993 1.00 1.05 O ATOM 769 CB LYS A1097 7.054 -12.425 -5.083 1.00 0.54 C ATOM 770 CG LYS A1097 7.348 -13.812 -5.688 1.00 0.78 C ATOM 771 CD LYS A1097 7.478 -14.937 -4.658 1.00 1.66 C ATOM 772 CE LYS A1097 6.153 -15.336 -3.985 1.00 2.99 C ATOM 773 NZ LYS A1097 5.216 -15.979 -4.934 1.00 3.43 N ATOM 0 H LYS A1097 6.722 -10.175 -4.322 1.00 0.67 H new ATOM 0 HA LYS A1097 8.533 -12.043 -3.506 1.00 0.73 H new ATOM 0 HB2 LYS A1097 6.296 -12.556 -4.310 1.00 0.54 H new ATOM 0 HB3 LYS A1097 6.609 -11.811 -5.866 1.00 0.54 H new ATOM 0 HG2 LYS A1097 6.551 -14.066 -6.387 1.00 0.78 H new ATOM 0 HG3 LYS A1097 8.271 -13.755 -6.264 1.00 0.78 H new ATOM 0 HD2 LYS A1097 7.902 -15.814 -5.147 1.00 1.66 H new ATOM 0 HD3 LYS A1097 8.185 -14.629 -3.888 1.00 1.66 H new ATOM 0 HE2 LYS A1097 6.357 -16.018 -3.160 1.00 2.99 H new ATOM 0 HE3 LYS A1097 5.683 -14.450 -3.557 1.00 2.99 H new ATOM 0 HZ1 LYS A1097 4.373 -16.307 -4.421 1.00 3.43 H new ATOM 0 HZ2 LYS A1097 4.933 -15.292 -5.662 1.00 3.43 H new ATOM 0 HZ3 LYS A1097 5.683 -16.790 -5.387 1.00 3.43 H new ATOM 787 N GLN A1098 9.353 -11.040 -6.535 1.00 0.85 N ATOM 788 CA GLN A1098 10.415 -11.001 -7.529 1.00 1.01 C ATOM 789 C GLN A1098 11.582 -10.060 -7.114 1.00 0.97 C ATOM 790 O GLN A1098 12.738 -10.385 -7.379 1.00 1.07 O ATOM 791 CB GLN A1098 9.760 -10.685 -8.891 1.00 1.11 C ATOM 792 CG GLN A1098 10.679 -10.909 -10.108 1.00 1.74 C ATOM 793 CD GLN A1098 10.807 -12.364 -10.577 1.00 3.30 C ATOM 794 OE1 GLN A1098 9.985 -13.240 -10.308 1.00 4.07 O ATOM 795 NE2 GLN A1098 11.816 -12.672 -11.358 1.00 4.06 N ATOM 0 H GLN A1098 8.512 -10.538 -6.820 1.00 0.85 H new ATOM 0 HA GLN A1098 10.913 -11.967 -7.613 1.00 1.01 H new ATOM 0 HB2 GLN A1098 8.870 -11.304 -9.005 1.00 1.11 H new ATOM 0 HB3 GLN A1098 9.428 -9.647 -8.888 1.00 1.11 H new ATOM 0 HG2 GLN A1098 10.307 -10.309 -10.938 1.00 1.74 H new ATOM 0 HG3 GLN A1098 11.673 -10.535 -9.865 1.00 1.74 H new ATOM 0 HE21 GLN A1098 12.511 -11.964 -11.596 1.00 4.06 H new ATOM 0 HE22 GLN A1098 11.905 -13.619 -11.727 1.00 4.06 H new ATOM 804 N GLU A1099 11.335 -8.950 -6.399 1.00 0.88 N ATOM 805 CA GLU A1099 12.374 -8.084 -5.783 1.00 0.96 C ATOM 806 C GLU A1099 13.173 -8.804 -4.685 1.00 1.03 C ATOM 807 O GLU A1099 14.399 -8.673 -4.613 1.00 1.16 O ATOM 808 CB GLU A1099 11.718 -6.797 -5.234 1.00 0.95 C ATOM 809 CG GLU A1099 12.665 -5.750 -4.619 1.00 1.02 C ATOM 810 CD GLU A1099 13.253 -4.740 -5.615 1.00 1.13 C ATOM 811 OE1 GLU A1099 13.550 -5.084 -6.785 1.00 1.67 O ATOM 812 OE2 GLU A1099 13.469 -3.569 -5.214 1.00 2.26 O ATOM 0 H GLU A1099 10.387 -8.615 -6.225 1.00 0.88 H new ATOM 0 HA GLU A1099 13.091 -7.825 -6.562 1.00 0.96 H new ATOM 0 HB2 GLU A1099 11.166 -6.323 -6.046 1.00 0.95 H new ATOM 0 HB3 GLU A1099 10.988 -7.083 -4.477 1.00 0.95 H new ATOM 0 HG2 GLU A1099 12.124 -5.203 -3.847 1.00 1.02 H new ATOM 0 HG3 GLU A1099 13.486 -6.270 -4.126 1.00 1.02 H new ATOM 819 N LEU A1100 12.506 -9.606 -3.854 1.00 0.96 N ATOM 820 CA LEU A1100 13.135 -10.428 -2.815 1.00 1.06 C ATOM 821 C LEU A1100 13.922 -11.621 -3.385 1.00 1.09 C ATOM 822 O LEU A1100 14.665 -12.267 -2.643 1.00 1.27 O ATOM 823 CB LEU A1100 12.068 -10.889 -1.799 1.00 1.00 C ATOM 824 CG LEU A1100 11.265 -9.780 -1.091 1.00 0.97 C ATOM 825 CD1 LEU A1100 10.505 -10.343 0.110 1.00 0.99 C ATOM 826 CD2 LEU A1100 12.137 -8.616 -0.643 1.00 1.14 C ATOM 0 H LEU A1100 11.491 -9.706 -3.884 1.00 0.96 H new ATOM 0 HA LEU A1100 13.872 -9.807 -2.306 1.00 1.06 H new ATOM 0 HB2 LEU A1100 11.365 -11.542 -2.316 1.00 1.00 H new ATOM 0 HB3 LEU A1100 12.561 -11.492 -1.037 1.00 1.00 H new ATOM 0 HG LEU A1100 10.558 -9.397 -1.827 1.00 0.97 H new ATOM 0 HD11 LEU A1100 9.945 -9.543 0.594 1.00 0.99 H new ATOM 0 HD12 LEU A1100 9.814 -11.116 -0.226 1.00 0.99 H new ATOM 0 HD13 LEU A1100 11.212 -10.772 0.820 1.00 0.99 H new ATOM 0 HD21 LEU A1100 11.518 -7.866 -0.151 1.00 1.14 H new ATOM 0 HD22 LEU A1100 12.894 -8.976 0.054 1.00 1.14 H new ATOM 0 HD23 LEU A1100 12.625 -8.172 -1.511 1.00 1.14 H new ATOM 838 N ASP A1101 13.782 -11.910 -4.683 1.00 0.99 N ATOM 839 CA ASP A1101 14.365 -13.068 -5.373 1.00 1.08 C ATOM 840 C ASP A1101 14.004 -14.415 -4.708 1.00 1.06 C ATOM 841 O ASP A1101 14.801 -15.353 -4.673 1.00 1.22 O ATOM 842 CB ASP A1101 15.870 -12.835 -5.601 1.00 1.40 C ATOM 843 CG ASP A1101 16.522 -13.886 -6.497 1.00 1.76 C ATOM 844 OD1 ASP A1101 15.817 -14.559 -7.287 1.00 2.26 O ATOM 845 OD2 ASP A1101 17.767 -14.044 -6.421 1.00 2.41 O ATOM 0 H ASP A1101 13.236 -11.318 -5.309 1.00 0.99 H new ATOM 0 HA ASP A1101 13.910 -13.157 -6.360 1.00 1.08 H new ATOM 0 HB2 ASP A1101 16.013 -11.850 -6.046 1.00 1.40 H new ATOM 0 HB3 ASP A1101 16.378 -12.826 -4.637 1.00 1.40 H new ATOM 850 N THR A1102 12.792 -14.496 -4.150 1.00 1.05 N ATOM 851 CA THR A1102 12.276 -15.662 -3.415 1.00 1.30 C ATOM 852 C THR A1102 11.079 -16.290 -4.128 1.00 1.56 C ATOM 853 O THR A1102 10.433 -15.664 -4.969 1.00 2.67 O ATOM 854 CB THR A1102 11.935 -15.283 -1.960 1.00 1.52 C ATOM 855 OG1 THR A1102 11.622 -16.438 -1.216 1.00 2.08 O ATOM 856 CG2 THR A1102 10.723 -14.363 -1.822 1.00 1.44 C ATOM 0 H THR A1102 12.120 -13.730 -4.197 1.00 1.05 H new ATOM 0 HA THR A1102 13.062 -16.416 -3.388 1.00 1.30 H new ATOM 0 HB THR A1102 12.823 -14.765 -1.596 1.00 1.52 H new ATOM 0 HG1 THR A1102 10.912 -16.231 -0.574 1.00 2.08 H new ATOM 0 HG21 THR A1102 10.550 -14.144 -0.768 1.00 1.44 H new ATOM 0 HG22 THR A1102 10.909 -13.433 -2.360 1.00 1.44 H new ATOM 0 HG23 THR A1102 9.844 -14.854 -2.239 1.00 1.44 H new ATOM 864 N GLU A1103 10.755 -17.526 -3.767 1.00 1.33 N ATOM 865 CA GLU A1103 9.530 -18.233 -4.156 1.00 1.52 C ATOM 866 C GLU A1103 8.407 -18.030 -3.117 1.00 1.67 C ATOM 867 O GLU A1103 7.229 -18.255 -3.399 1.00 2.08 O ATOM 868 CB GLU A1103 9.876 -19.722 -4.306 1.00 1.59 C ATOM 869 CG GLU A1103 8.859 -20.506 -5.141 1.00 1.87 C ATOM 870 CD GLU A1103 9.081 -20.301 -6.642 1.00 2.30 C ATOM 871 OE1 GLU A1103 9.980 -20.957 -7.225 1.00 2.58 O ATOM 872 OE2 GLU A1103 8.344 -19.496 -7.263 1.00 3.63 O ATOM 0 H GLU A1103 11.360 -18.090 -3.171 1.00 1.33 H new ATOM 0 HA GLU A1103 9.157 -17.834 -5.099 1.00 1.52 H new ATOM 0 HB2 GLU A1103 10.860 -19.813 -4.767 1.00 1.59 H new ATOM 0 HB3 GLU A1103 9.945 -20.172 -3.316 1.00 1.59 H new ATOM 0 HG2 GLU A1103 8.934 -21.567 -4.904 1.00 1.87 H new ATOM 0 HG3 GLU A1103 7.850 -20.191 -4.876 1.00 1.87 H new ATOM 879 N THR A1104 8.755 -17.584 -1.905 1.00 1.58 N ATOM 880 CA THR A1104 7.867 -17.524 -0.734 1.00 1.92 C ATOM 881 C THR A1104 8.189 -16.330 0.162 1.00 1.47 C ATOM 882 O THR A1104 9.354 -16.042 0.454 1.00 1.91 O ATOM 883 CB THR A1104 7.922 -18.835 0.071 1.00 2.64 C ATOM 884 OG1 THR A1104 7.212 -18.698 1.288 1.00 3.52 O ATOM 885 CG2 THR A1104 9.353 -19.282 0.381 1.00 2.05 C ATOM 0 H THR A1104 9.695 -17.243 -1.703 1.00 1.58 H new ATOM 0 HA THR A1104 6.852 -17.392 -1.108 1.00 1.92 H new ATOM 0 HB THR A1104 7.460 -19.598 -0.556 1.00 2.64 H new ATOM 0 HG1 THR A1104 7.254 -19.540 1.788 1.00 3.52 H new ATOM 0 HG21 THR A1104 9.329 -20.211 0.950 1.00 2.05 H new ATOM 0 HG22 THR A1104 9.894 -19.442 -0.551 1.00 2.05 H new ATOM 0 HG23 THR A1104 9.856 -18.512 0.965 1.00 2.05 H new ATOM 893 N LEU A1105 7.150 -15.620 0.605 1.00 1.16 N ATOM 894 CA LEU A1105 7.272 -14.461 1.487 1.00 0.74 C ATOM 895 C LEU A1105 6.051 -14.329 2.413 1.00 0.62 C ATOM 896 O LEU A1105 4.943 -14.721 2.041 1.00 0.84 O ATOM 897 CB LEU A1105 7.566 -13.197 0.648 1.00 0.59 C ATOM 898 CG LEU A1105 6.358 -12.481 0.012 1.00 0.59 C ATOM 899 CD1 LEU A1105 6.763 -11.090 -0.467 1.00 0.52 C ATOM 900 CD2 LEU A1105 5.836 -13.252 -1.193 1.00 0.92 C ATOM 0 H LEU A1105 6.185 -15.839 0.356 1.00 1.16 H new ATOM 0 HA LEU A1105 8.120 -14.598 2.159 1.00 0.74 H new ATOM 0 HB2 LEU A1105 8.087 -12.482 1.285 1.00 0.59 H new ATOM 0 HB3 LEU A1105 8.255 -13.473 -0.150 1.00 0.59 H new ATOM 0 HG LEU A1105 5.581 -12.416 0.774 1.00 0.59 H new ATOM 0 HD11 LEU A1105 5.902 -10.594 -0.914 1.00 0.52 H new ATOM 0 HD12 LEU A1105 7.120 -10.503 0.379 1.00 0.52 H new ATOM 0 HD13 LEU A1105 7.557 -11.177 -1.209 1.00 0.52 H new ATOM 0 HD21 LEU A1105 4.984 -12.724 -1.622 1.00 0.92 H new ATOM 0 HD22 LEU A1105 6.625 -13.336 -1.941 1.00 0.92 H new ATOM 0 HD23 LEU A1105 5.525 -14.249 -0.880 1.00 0.92 H new ATOM 912 N GLY A1106 6.241 -13.769 3.607 1.00 0.63 N ATOM 913 CA GLY A1106 5.202 -13.659 4.635 1.00 0.81 C ATOM 914 C GLY A1106 4.970 -14.919 5.481 1.00 0.78 C ATOM 915 O GLY A1106 5.464 -16.012 5.181 1.00 1.11 O ATOM 0 H GLY A1106 7.136 -13.372 3.894 1.00 0.63 H new ATOM 0 HA2 GLY A1106 5.462 -12.838 5.303 1.00 0.81 H new ATOM 0 HA3 GLY A1106 4.263 -13.391 4.150 1.00 0.81 H new ATOM 919 N THR A1107 4.222 -14.721 6.570 1.00 0.63 N ATOM 920 CA THR A1107 3.938 -15.694 7.643 1.00 0.74 C ATOM 921 C THR A1107 2.598 -15.440 8.349 1.00 0.89 C ATOM 922 O THR A1107 1.899 -16.387 8.708 1.00 1.85 O ATOM 923 CB THR A1107 5.063 -15.614 8.703 1.00 0.79 C ATOM 924 OG1 THR A1107 6.280 -16.020 8.136 1.00 0.90 O ATOM 925 CG2 THR A1107 4.869 -16.525 9.912 1.00 1.05 C ATOM 0 H THR A1107 3.768 -13.824 6.742 1.00 0.63 H new ATOM 0 HA THR A1107 3.886 -16.677 7.175 1.00 0.74 H new ATOM 0 HB THR A1107 5.048 -14.575 9.032 1.00 0.79 H new ATOM 0 HG1 THR A1107 6.764 -16.587 8.772 1.00 0.90 H new ATOM 0 HG21 THR A1107 5.706 -16.400 10.599 1.00 1.05 H new ATOM 0 HG22 THR A1107 3.940 -16.263 10.419 1.00 1.05 H new ATOM 0 HG23 THR A1107 4.822 -17.563 9.582 1.00 1.05 H new ATOM 933 N CYS A1108 2.222 -14.174 8.557 1.00 0.77 N ATOM 934 CA CYS A1108 1.135 -13.753 9.449 1.00 1.03 C ATOM 935 C CYS A1108 0.179 -12.702 8.854 1.00 0.74 C ATOM 936 O CYS A1108 0.600 -11.823 8.100 1.00 1.40 O ATOM 937 CB CYS A1108 1.826 -13.257 10.721 1.00 2.11 C ATOM 938 SG CYS A1108 0.644 -12.728 11.991 1.00 2.97 S ATOM 0 H CYS A1108 2.680 -13.389 8.095 1.00 0.77 H new ATOM 0 HA CYS A1108 0.468 -14.594 9.639 1.00 1.03 H new ATOM 0 HB2 CYS A1108 2.455 -14.052 11.123 1.00 2.11 H new ATOM 0 HB3 CYS A1108 2.484 -12.425 10.472 1.00 2.11 H new ATOM 0 HG CYS A1108 1.290 -12.322 13.043 1.00 2.97 H new ATOM 944 N ILE A1109 -1.116 -12.810 9.166 1.00 0.66 N ATOM 945 CA ILE A1109 -2.155 -11.833 8.802 1.00 0.64 C ATOM 946 C ILE A1109 -3.319 -11.782 9.812 1.00 0.73 C ATOM 947 O ILE A1109 -3.671 -12.794 10.421 1.00 1.17 O ATOM 948 CB ILE A1109 -2.653 -12.139 7.365 1.00 1.03 C ATOM 949 CG1 ILE A1109 -3.105 -10.886 6.593 1.00 1.80 C ATOM 950 CG2 ILE A1109 -3.757 -13.212 7.309 1.00 2.61 C ATOM 951 CD1 ILE A1109 -1.938 -9.933 6.314 1.00 2.01 C ATOM 0 H ILE A1109 -1.484 -13.601 9.694 1.00 0.66 H new ATOM 0 HA ILE A1109 -1.710 -10.838 8.831 1.00 0.64 H new ATOM 0 HB ILE A1109 -1.771 -12.542 6.868 1.00 1.03 H new ATOM 0 HG12 ILE A1109 -3.562 -11.186 5.650 1.00 1.80 H new ATOM 0 HG13 ILE A1109 -3.871 -10.364 7.166 1.00 1.80 H new ATOM 0 HG21 ILE A1109 -4.055 -13.373 6.273 1.00 2.61 H new ATOM 0 HG22 ILE A1109 -3.379 -14.145 7.727 1.00 2.61 H new ATOM 0 HG23 ILE A1109 -4.619 -12.878 7.887 1.00 2.61 H new ATOM 0 HD11 ILE A1109 -2.302 -9.063 5.768 1.00 2.01 H new ATOM 0 HD12 ILE A1109 -1.498 -9.611 7.258 1.00 2.01 H new ATOM 0 HD13 ILE A1109 -1.184 -10.446 5.718 1.00 2.01 H new ATOM 963 N ASP A1110 -3.968 -10.618 9.934 1.00 0.62 N ATOM 964 CA ASP A1110 -5.239 -10.413 10.674 1.00 0.74 C ATOM 965 C ASP A1110 -6.450 -10.061 9.768 1.00 0.86 C ATOM 966 O ASP A1110 -7.593 -10.235 10.188 1.00 2.36 O ATOM 967 CB ASP A1110 -4.993 -9.448 11.852 1.00 1.16 C ATOM 968 CG ASP A1110 -6.037 -8.342 12.017 1.00 2.21 C ATOM 969 OD1 ASP A1110 -5.888 -7.287 11.364 1.00 3.62 O ATOM 970 OD2 ASP A1110 -6.968 -8.500 12.840 1.00 2.62 O ATOM 0 H ASP A1110 -3.619 -9.759 9.510 1.00 0.62 H new ATOM 0 HA ASP A1110 -5.553 -11.366 11.099 1.00 0.74 H new ATOM 0 HB2 ASP A1110 -4.953 -10.028 12.774 1.00 1.16 H new ATOM 0 HB3 ASP A1110 -4.014 -8.986 11.724 1.00 1.16 H new ATOM 975 N PHE A1111 -6.188 -9.634 8.524 1.00 0.94 N ATOM 976 CA PHE A1111 -7.118 -9.491 7.387 1.00 1.02 C ATOM 977 C PHE A1111 -8.494 -8.825 7.649 1.00 1.07 C ATOM 978 O PHE A1111 -9.473 -9.499 7.988 1.00 1.40 O ATOM 979 CB PHE A1111 -7.244 -10.892 6.762 1.00 1.64 C ATOM 980 CG PHE A1111 -7.966 -10.968 5.435 1.00 1.14 C ATOM 981 CD1 PHE A1111 -7.293 -10.608 4.253 1.00 1.84 C ATOM 982 CD2 PHE A1111 -9.285 -11.453 5.368 1.00 2.19 C ATOM 983 CE1 PHE A1111 -7.938 -10.733 3.012 1.00 2.26 C ATOM 984 CE2 PHE A1111 -9.931 -11.570 4.125 1.00 2.76 C ATOM 985 CZ PHE A1111 -9.255 -11.218 2.946 1.00 2.41 C ATOM 0 H PHE A1111 -5.242 -9.356 8.262 1.00 0.94 H new ATOM 0 HA PHE A1111 -6.687 -8.756 6.708 1.00 1.02 H new ATOM 0 HB2 PHE A1111 -6.242 -11.300 6.631 1.00 1.64 H new ATOM 0 HB3 PHE A1111 -7.761 -11.538 7.471 1.00 1.64 H new ATOM 0 HD1 PHE A1111 -6.280 -10.236 4.300 1.00 1.84 H new ATOM 0 HD2 PHE A1111 -9.802 -11.736 6.273 1.00 2.19 H new ATOM 0 HE1 PHE A1111 -7.420 -10.456 2.106 1.00 2.26 H new ATOM 0 HE2 PHE A1111 -10.948 -11.931 4.077 1.00 2.76 H new ATOM 0 HZ PHE A1111 -9.747 -11.320 1.990 1.00 2.41 H new ATOM 995 N GLN A1112 -8.603 -7.520 7.364 1.00 0.93 N ATOM 996 CA GLN A1112 -9.827 -6.705 7.422 1.00 1.00 C ATOM 997 C GLN A1112 -10.144 -6.173 6.018 1.00 1.07 C ATOM 998 O GLN A1112 -9.397 -5.343 5.505 1.00 1.15 O ATOM 999 CB GLN A1112 -9.637 -5.517 8.398 1.00 1.04 C ATOM 1000 CG GLN A1112 -10.296 -5.709 9.763 1.00 1.17 C ATOM 1001 CD GLN A1112 -9.370 -6.540 10.603 1.00 1.32 C ATOM 1002 OE1 GLN A1112 -9.492 -7.752 10.681 1.00 2.46 O ATOM 1003 NE2 GLN A1112 -8.352 -5.917 11.139 1.00 1.08 N ATOM 0 H GLN A1112 -7.794 -6.973 7.070 1.00 0.93 H new ATOM 0 HA GLN A1112 -10.651 -7.322 7.780 1.00 1.00 H new ATOM 0 HB2 GLN A1112 -8.570 -5.350 8.544 1.00 1.04 H new ATOM 0 HB3 GLN A1112 -10.041 -4.616 7.937 1.00 1.04 H new ATOM 0 HG2 GLN A1112 -10.482 -4.745 10.237 1.00 1.17 H new ATOM 0 HG3 GLN A1112 -11.262 -6.203 9.656 1.00 1.17 H new ATOM 0 HE21 GLN A1112 -8.275 -4.903 11.059 1.00 1.08 H new ATOM 0 HE22 GLN A1112 -7.636 -6.445 11.637 1.00 1.08 H new ATOM 1012 N VAL A1113 -11.240 -6.630 5.405 1.00 1.07 N ATOM 1013 CA VAL A1113 -11.670 -6.216 4.055 1.00 1.05 C ATOM 1014 C VAL A1113 -12.772 -5.160 4.121 1.00 0.96 C ATOM 1015 O VAL A1113 -13.736 -5.313 4.876 1.00 1.03 O ATOM 1016 CB VAL A1113 -12.154 -7.430 3.230 1.00 1.09 C ATOM 1017 CG1 VAL A1113 -12.602 -7.047 1.811 1.00 2.25 C ATOM 1018 CG2 VAL A1113 -11.047 -8.477 3.081 1.00 1.88 C ATOM 0 H VAL A1113 -11.867 -7.309 5.835 1.00 1.07 H new ATOM 0 HA VAL A1113 -10.803 -5.779 3.560 1.00 1.05 H new ATOM 0 HB VAL A1113 -13.003 -7.830 3.785 1.00 1.09 H new ATOM 0 HG11 VAL A1113 -12.931 -7.940 1.280 1.00 2.25 H new ATOM 0 HG12 VAL A1113 -13.426 -6.335 1.869 1.00 2.25 H new ATOM 0 HG13 VAL A1113 -11.768 -6.593 1.276 1.00 2.25 H new ATOM 0 HG21 VAL A1113 -11.418 -9.318 2.496 1.00 1.88 H new ATOM 0 HG22 VAL A1113 -10.191 -8.032 2.574 1.00 1.88 H new ATOM 0 HG23 VAL A1113 -10.742 -8.827 4.067 1.00 1.88 H new ATOM 1028 N VAL A1114 -12.685 -4.118 3.289 1.00 0.88 N ATOM 1029 CA VAL A1114 -13.783 -3.165 3.074 1.00 0.86 C ATOM 1030 C VAL A1114 -13.982 -2.977 1.559 1.00 0.77 C ATOM 1031 O VAL A1114 -13.124 -2.365 0.906 1.00 0.79 O ATOM 1032 CB VAL A1114 -13.535 -1.827 3.800 1.00 0.92 C ATOM 1033 CG1 VAL A1114 -14.767 -0.925 3.648 1.00 0.98 C ATOM 1034 CG2 VAL A1114 -13.293 -2.015 5.303 1.00 1.07 C ATOM 0 H VAL A1114 -11.849 -3.909 2.743 1.00 0.88 H new ATOM 0 HA VAL A1114 -14.700 -3.567 3.506 1.00 0.86 H new ATOM 0 HB VAL A1114 -12.647 -1.384 3.348 1.00 0.92 H new ATOM 0 HG11 VAL A1114 -14.591 0.020 4.161 1.00 0.98 H new ATOM 0 HG12 VAL A1114 -14.951 -0.735 2.590 1.00 0.98 H new ATOM 0 HG13 VAL A1114 -15.635 -1.419 4.084 1.00 0.98 H new ATOM 0 HG21 VAL A1114 -13.124 -1.044 5.768 1.00 1.07 H new ATOM 0 HG22 VAL A1114 -14.165 -2.487 5.756 1.00 1.07 H new ATOM 0 HG23 VAL A1114 -12.418 -2.647 5.454 1.00 1.07 H new ATOM 1044 N PRO A1115 -15.073 -3.500 0.961 1.00 0.80 N ATOM 1045 CA PRO A1115 -15.371 -3.306 -0.457 1.00 0.80 C ATOM 1046 C PRO A1115 -15.674 -1.829 -0.739 1.00 0.96 C ATOM 1047 O PRO A1115 -16.254 -1.125 0.100 1.00 1.12 O ATOM 1048 CB PRO A1115 -16.534 -4.248 -0.780 1.00 0.94 C ATOM 1049 CG PRO A1115 -17.252 -4.412 0.557 1.00 1.31 C ATOM 1050 CD PRO A1115 -16.132 -4.281 1.589 1.00 0.96 C ATOM 0 HA PRO A1115 -14.526 -3.547 -1.102 1.00 0.80 H new ATOM 0 HB2 PRO A1115 -17.193 -3.825 -1.538 1.00 0.94 H new ATOM 0 HB3 PRO A1115 -16.179 -5.205 -1.164 1.00 0.94 H new ATOM 0 HG2 PRO A1115 -18.017 -3.648 0.697 1.00 1.31 H new ATOM 0 HG3 PRO A1115 -17.750 -5.379 0.628 1.00 1.31 H new ATOM 0 HD2 PRO A1115 -16.493 -3.788 2.492 1.00 0.96 H new ATOM 0 HD3 PRO A1115 -15.764 -5.263 1.887 1.00 0.96 H new ATOM 1058 N GLY A1116 -15.207 -1.330 -1.886 1.00 1.20 N ATOM 1059 CA GLY A1116 -15.222 0.102 -2.201 1.00 1.54 C ATOM 1060 C GLY A1116 -14.261 0.956 -1.363 1.00 1.40 C ATOM 1061 O GLY A1116 -14.407 2.176 -1.348 1.00 2.02 O ATOM 0 H GLY A1116 -14.807 -1.908 -2.625 1.00 1.20 H new ATOM 0 HA2 GLY A1116 -14.975 0.230 -3.255 1.00 1.54 H new ATOM 0 HA3 GLY A1116 -16.235 0.479 -2.063 1.00 1.54 H new ATOM 1065 N CYS A1117 -13.311 0.337 -0.646 1.00 0.90 N ATOM 1066 CA CYS A1117 -12.232 1.018 0.080 1.00 0.85 C ATOM 1067 C CYS A1117 -10.865 0.315 -0.086 1.00 1.10 C ATOM 1068 O CYS A1117 -10.101 0.674 -0.984 1.00 2.07 O ATOM 1069 CB CYS A1117 -12.609 1.249 1.554 1.00 1.08 C ATOM 1070 SG CYS A1117 -13.782 2.626 1.739 1.00 1.66 S ATOM 0 H CYS A1117 -13.272 -0.678 -0.554 1.00 0.90 H new ATOM 0 HA CYS A1117 -12.109 2.001 -0.375 1.00 0.85 H new ATOM 0 HB2 CYS A1117 -13.048 0.339 1.964 1.00 1.08 H new ATOM 0 HB3 CYS A1117 -11.709 1.458 2.132 1.00 1.08 H new ATOM 0 HG CYS A1117 -14.380 2.842 0.605 1.00 1.66 H new ATOM 1076 N GLY A1118 -10.539 -0.666 0.766 1.00 0.66 N ATOM 1077 CA GLY A1118 -9.190 -1.244 0.849 1.00 0.84 C ATOM 1078 C GLY A1118 -9.056 -2.439 1.811 1.00 0.88 C ATOM 1079 O GLY A1118 -10.009 -3.213 1.971 1.00 1.20 O ATOM 0 H GLY A1118 -11.204 -1.082 1.418 1.00 0.66 H new ATOM 0 HA2 GLY A1118 -8.885 -1.562 -0.148 1.00 0.84 H new ATOM 0 HA3 GLY A1118 -8.495 -0.465 1.161 1.00 0.84 H new ATOM 1083 N ILE A1119 -7.866 -2.640 2.391 1.00 0.70 N ATOM 1084 CA ILE A1119 -7.535 -3.764 3.294 1.00 0.89 C ATOM 1085 C ILE A1119 -6.631 -3.321 4.465 1.00 0.76 C ATOM 1086 O ILE A1119 -5.810 -2.416 4.313 1.00 0.61 O ATOM 1087 CB ILE A1119 -6.967 -4.955 2.469 1.00 1.11 C ATOM 1088 CG1 ILE A1119 -7.734 -6.279 2.651 1.00 1.47 C ATOM 1089 CG2 ILE A1119 -5.449 -5.170 2.561 1.00 2.24 C ATOM 1090 CD1 ILE A1119 -7.279 -7.191 3.792 1.00 1.26 C ATOM 0 H ILE A1119 -7.078 -2.009 2.244 1.00 0.70 H new ATOM 0 HA ILE A1119 -8.448 -4.117 3.774 1.00 0.89 H new ATOM 0 HB ILE A1119 -7.148 -4.618 1.448 1.00 1.11 H new ATOM 0 HG12 ILE A1119 -8.787 -6.043 2.805 1.00 1.47 H new ATOM 0 HG13 ILE A1119 -7.666 -6.841 1.720 1.00 1.47 H new ATOM 0 HG21 ILE A1119 -5.165 -6.025 1.948 1.00 2.24 H new ATOM 0 HG22 ILE A1119 -4.933 -4.279 2.203 1.00 2.24 H new ATOM 0 HG23 ILE A1119 -5.170 -5.359 3.598 1.00 2.24 H new ATOM 0 HD11 ILE A1119 -7.899 -8.087 3.811 1.00 1.26 H new ATOM 0 HD12 ILE A1119 -6.238 -7.474 3.639 1.00 1.26 H new ATOM 0 HD13 ILE A1119 -7.376 -6.663 4.741 1.00 1.26 H new ATOM 1102 N SER A1120 -6.794 -3.944 5.639 1.00 0.82 N ATOM 1103 CA SER A1120 -6.009 -3.713 6.872 1.00 0.65 C ATOM 1104 C SER A1120 -5.566 -5.035 7.510 1.00 0.63 C ATOM 1105 O SER A1120 -6.239 -6.055 7.353 1.00 0.85 O ATOM 1106 CB SER A1120 -6.809 -2.852 7.867 1.00 0.75 C ATOM 1107 OG SER A1120 -6.229 -2.865 9.160 1.00 0.90 O ATOM 0 H SER A1120 -7.510 -4.659 5.768 1.00 0.82 H new ATOM 0 HA SER A1120 -5.105 -3.168 6.600 1.00 0.65 H new ATOM 0 HB2 SER A1120 -6.859 -1.826 7.502 1.00 0.75 H new ATOM 0 HB3 SER A1120 -7.833 -3.220 7.924 1.00 0.75 H new ATOM 0 HG SER A1120 -6.763 -2.307 9.763 1.00 0.90 H new ATOM 1113 N CYS A1121 -4.428 -5.047 8.214 1.00 0.46 N ATOM 1114 CA CYS A1121 -3.917 -6.231 8.909 1.00 0.49 C ATOM 1115 C CYS A1121 -2.838 -5.945 9.978 1.00 0.46 C ATOM 1116 O CYS A1121 -2.232 -4.873 10.024 1.00 0.45 O ATOM 1117 CB CYS A1121 -3.363 -7.198 7.854 1.00 0.65 C ATOM 1118 SG CYS A1121 -1.949 -6.448 7.009 1.00 0.75 S ATOM 0 H CYS A1121 -3.831 -4.226 8.317 1.00 0.46 H new ATOM 0 HA CYS A1121 -4.753 -6.658 9.463 1.00 0.49 H new ATOM 0 HB2 CYS A1121 -3.061 -8.132 8.328 1.00 0.65 H new ATOM 0 HB3 CYS A1121 -4.140 -7.445 7.131 1.00 0.65 H new ATOM 0 HG CYS A1121 -2.048 -5.153 7.064 1.00 0.75 H new ATOM 1124 N LYS A1122 -2.568 -6.960 10.810 1.00 0.51 N ATOM 1125 CA LYS A1122 -1.417 -7.063 11.724 1.00 0.54 C ATOM 1126 C LYS A1122 -0.484 -8.150 11.180 1.00 0.53 C ATOM 1127 O LYS A1122 -0.991 -9.173 10.710 1.00 0.59 O ATOM 1128 CB LYS A1122 -1.850 -7.424 13.160 1.00 0.66 C ATOM 1129 CG LYS A1122 -3.008 -6.610 13.763 1.00 0.71 C ATOM 1130 CD LYS A1122 -2.744 -5.102 13.724 1.00 0.71 C ATOM 1131 CE LYS A1122 -3.629 -4.333 14.708 1.00 0.83 C ATOM 1132 NZ LYS A1122 -5.052 -4.275 14.309 1.00 1.16 N ATOM 0 H LYS A1122 -3.178 -7.776 10.868 1.00 0.51 H new ATOM 0 HA LYS A1122 -0.916 -6.096 11.773 1.00 0.54 H new ATOM 0 HB2 LYS A1122 -2.132 -8.477 13.175 1.00 0.66 H new ATOM 0 HB3 LYS A1122 -0.984 -7.316 13.813 1.00 0.66 H new ATOM 0 HG2 LYS A1122 -3.926 -6.830 13.217 1.00 0.71 H new ATOM 0 HG3 LYS A1122 -3.169 -6.921 14.795 1.00 0.71 H new ATOM 0 HD2 LYS A1122 -1.696 -4.912 13.956 1.00 0.71 H new ATOM 0 HD3 LYS A1122 -2.919 -4.731 12.714 1.00 0.71 H new ATOM 0 HE2 LYS A1122 -3.555 -4.800 15.690 1.00 0.83 H new ATOM 0 HE3 LYS A1122 -3.247 -3.317 14.808 1.00 0.83 H new ATOM 0 HZ1 LYS A1122 -5.590 -3.740 15.020 1.00 1.16 H new ATOM 0 HZ2 LYS A1122 -5.135 -3.804 13.386 1.00 1.16 H new ATOM 0 HZ3 LYS A1122 -5.433 -5.240 14.240 1.00 1.16 H new ATOM 1146 N VAL A1123 0.837 -7.967 11.242 1.00 0.81 N ATOM 1147 CA VAL A1123 1.807 -8.911 10.656 1.00 0.89 C ATOM 1148 C VAL A1123 3.153 -8.987 11.387 1.00 0.95 C ATOM 1149 O VAL A1123 3.717 -7.980 11.813 1.00 0.97 O ATOM 1150 CB VAL A1123 2.014 -8.603 9.154 1.00 0.81 C ATOM 1151 CG1 VAL A1123 2.639 -7.233 8.851 1.00 1.77 C ATOM 1152 CG2 VAL A1123 2.876 -9.677 8.486 1.00 2.04 C ATOM 0 H VAL A1123 1.269 -7.163 11.698 1.00 0.81 H new ATOM 0 HA VAL A1123 1.364 -9.900 10.777 1.00 0.89 H new ATOM 0 HB VAL A1123 1.003 -8.592 8.746 1.00 0.81 H new ATOM 0 HG11 VAL A1123 2.743 -7.111 7.773 1.00 1.77 H new ATOM 0 HG12 VAL A1123 1.997 -6.445 9.245 1.00 1.77 H new ATOM 0 HG13 VAL A1123 3.621 -7.169 9.320 1.00 1.77 H new ATOM 0 HG21 VAL A1123 3.005 -9.436 7.431 1.00 2.04 H new ATOM 0 HG22 VAL A1123 3.851 -9.715 8.972 1.00 2.04 H new ATOM 0 HG23 VAL A1123 2.386 -10.646 8.579 1.00 2.04 H new ATOM 1162 N THR A1124 3.684 -10.209 11.491 1.00 1.11 N ATOM 1163 CA THR A1124 5.067 -10.514 11.887 1.00 1.19 C ATOM 1164 C THR A1124 5.761 -11.363 10.827 1.00 1.07 C ATOM 1165 O THR A1124 5.108 -12.109 10.092 1.00 0.98 O ATOM 1166 CB THR A1124 5.178 -11.323 13.202 1.00 1.48 C ATOM 1167 OG1 THR A1124 6.485 -11.197 13.724 1.00 1.68 O ATOM 1168 CG2 THR A1124 4.958 -12.839 13.060 1.00 1.58 C ATOM 0 H THR A1124 3.141 -11.050 11.294 1.00 1.11 H new ATOM 0 HA THR A1124 5.531 -9.536 12.016 1.00 1.19 H new ATOM 0 HB THR A1124 4.393 -10.910 13.835 1.00 1.48 H new ATOM 0 HG1 THR A1124 6.555 -11.708 14.557 1.00 1.68 H new ATOM 0 HG21 THR A1124 5.057 -13.314 14.036 1.00 1.58 H new ATOM 0 HG22 THR A1124 3.960 -13.026 12.665 1.00 1.58 H new ATOM 0 HG23 THR A1124 5.702 -13.252 12.379 1.00 1.58 H new ATOM 1176 N ASN A1125 7.089 -11.288 10.844 1.00 1.28 N ATOM 1177 CA ASN A1125 8.032 -12.230 10.255 1.00 1.38 C ATOM 1178 C ASN A1125 9.475 -11.815 10.606 1.00 1.71 C ATOM 1179 O ASN A1125 10.258 -12.674 11.010 1.00 1.81 O ATOM 1180 CB ASN A1125 7.824 -12.452 8.747 1.00 1.42 C ATOM 1181 CG ASN A1125 8.855 -13.412 8.251 1.00 1.89 C ATOM 1182 OD1 ASN A1125 9.872 -13.056 7.675 1.00 2.71 O ATOM 1183 ND2 ASN A1125 8.660 -14.650 8.560 1.00 1.59 N ATOM 0 H ASN A1125 7.567 -10.512 11.302 1.00 1.28 H new ATOM 0 HA ASN A1125 7.837 -13.207 10.697 1.00 1.38 H new ATOM 0 HB2 ASN A1125 6.824 -12.842 8.558 1.00 1.42 H new ATOM 0 HB3 ASN A1125 7.903 -11.505 8.213 1.00 1.42 H new ATOM 0 HD21 ASN A1125 9.362 -15.351 8.323 1.00 1.59 H new ATOM 0 HD22 ASN A1125 7.804 -14.927 9.041 1.00 1.59 H new ATOM 1951 N GLN A1177 6.440 -6.677 15.265 1.00 2.38 N ATOM 1952 CA GLN A1177 5.091 -6.715 14.706 1.00 1.83 C ATOM 1953 C GLN A1177 4.673 -5.342 14.173 1.00 1.60 C ATOM 1954 O GLN A1177 5.007 -4.305 14.760 1.00 2.12 O ATOM 1955 CB GLN A1177 4.125 -7.283 15.771 1.00 2.21 C ATOM 1956 CG GLN A1177 3.574 -8.648 15.325 1.00 1.89 C ATOM 1957 CD GLN A1177 2.259 -8.576 14.562 1.00 2.09 C ATOM 1958 OE1 GLN A1177 1.729 -7.524 14.228 1.00 3.17 O ATOM 1959 NE2 GLN A1177 1.690 -9.713 14.241 1.00 1.75 N ATOM 0 HA GLN A1177 5.060 -7.379 13.842 1.00 1.83 H new ATOM 0 HB2 GLN A1177 4.645 -7.388 16.723 1.00 2.21 H new ATOM 0 HB3 GLN A1177 3.302 -6.587 15.932 1.00 2.21 H new ATOM 0 HG2 GLN A1177 4.318 -9.139 14.697 1.00 1.89 H new ATOM 0 HG3 GLN A1177 3.435 -9.276 16.205 1.00 1.89 H new ATOM 0 HE21 GLN A1177 2.123 -10.595 14.514 1.00 1.75 H new ATOM 0 HE22 GLN A1177 0.814 -9.715 13.718 1.00 1.75 H new ATOM 1968 N TYR A1178 3.949 -5.348 13.057 1.00 0.99 N ATOM 1969 CA TYR A1178 3.583 -4.178 12.263 1.00 0.84 C ATOM 1970 C TYR A1178 2.070 -4.167 11.990 1.00 0.68 C ATOM 1971 O TYR A1178 1.486 -5.203 11.668 1.00 0.77 O ATOM 1972 CB TYR A1178 4.372 -4.222 10.942 1.00 0.78 C ATOM 1973 CG TYR A1178 5.861 -3.917 11.010 1.00 0.91 C ATOM 1974 CD1 TYR A1178 6.317 -2.707 11.571 1.00 1.69 C ATOM 1975 CD2 TYR A1178 6.782 -4.787 10.394 1.00 2.44 C ATOM 1976 CE1 TYR A1178 7.684 -2.367 11.520 1.00 1.64 C ATOM 1977 CE2 TYR A1178 8.146 -4.440 10.323 1.00 2.87 C ATOM 1978 CZ TYR A1178 8.603 -3.233 10.889 1.00 1.73 C ATOM 1979 OH TYR A1178 9.922 -2.911 10.797 1.00 2.21 O ATOM 0 H TYR A1178 3.583 -6.214 12.661 1.00 0.99 H new ATOM 0 HA TYR A1178 3.828 -3.267 12.808 1.00 0.84 H new ATOM 0 HB2 TYR A1178 4.250 -5.215 10.509 1.00 0.78 H new ATOM 0 HB3 TYR A1178 3.914 -3.514 10.251 1.00 0.78 H new ATOM 0 HD1 TYR A1178 5.614 -2.036 12.043 1.00 1.69 H new ATOM 0 HD2 TYR A1178 6.442 -5.722 9.975 1.00 2.44 H new ATOM 0 HE1 TYR A1178 8.028 -1.444 11.963 1.00 1.64 H new ATOM 0 HE2 TYR A1178 8.844 -5.102 9.833 1.00 2.87 H new ATOM 0 HH TYR A1178 10.402 -3.627 10.331 1.00 2.21 H new ATOM 1989 N LYS A1179 1.436 -2.993 12.080 1.00 0.68 N ATOM 1990 CA LYS A1179 0.020 -2.774 11.730 1.00 0.53 C ATOM 1991 C LYS A1179 -0.046 -2.021 10.404 1.00 0.46 C ATOM 1992 O LYS A1179 0.379 -0.873 10.365 1.00 0.59 O ATOM 1993 CB LYS A1179 -0.649 -1.997 12.877 1.00 0.57 C ATOM 1994 CG LYS A1179 -2.094 -1.563 12.578 1.00 0.58 C ATOM 1995 CD LYS A1179 -2.639 -0.671 13.699 1.00 0.77 C ATOM 1996 CE LYS A1179 -4.117 -0.367 13.444 1.00 1.23 C ATOM 1997 NZ LYS A1179 -4.664 0.548 14.465 1.00 1.17 N ATOM 0 H LYS A1179 1.901 -2.145 12.406 1.00 0.68 H new ATOM 0 HA LYS A1179 -0.514 -3.716 11.604 1.00 0.53 H new ATOM 0 HB2 LYS A1179 -0.645 -2.617 13.773 1.00 0.57 H new ATOM 0 HB3 LYS A1179 -0.053 -1.112 13.099 1.00 0.57 H new ATOM 0 HG2 LYS A1179 -2.128 -1.025 11.631 1.00 0.58 H new ATOM 0 HG3 LYS A1179 -2.727 -2.443 12.468 1.00 0.58 H new ATOM 0 HD2 LYS A1179 -2.521 -1.168 14.662 1.00 0.77 H new ATOM 0 HD3 LYS A1179 -2.070 0.257 13.747 1.00 0.77 H new ATOM 0 HE2 LYS A1179 -4.233 0.078 12.456 1.00 1.23 H new ATOM 0 HE3 LYS A1179 -4.686 -1.297 13.444 1.00 1.23 H new ATOM 0 HZ1 LYS A1179 -5.649 0.287 14.673 1.00 1.17 H new ATOM 0 HZ2 LYS A1179 -4.097 0.478 15.334 1.00 1.17 H new ATOM 0 HZ3 LYS A1179 -4.632 1.525 14.109 1.00 1.17 H new ATOM 2011 N VAL A1180 -0.555 -2.628 9.332 1.00 0.40 N ATOM 2012 CA VAL A1180 -0.492 -2.029 7.982 1.00 0.38 C ATOM 2013 C VAL A1180 -1.836 -2.044 7.249 1.00 0.36 C ATOM 2014 O VAL A1180 -2.582 -3.025 7.314 1.00 0.49 O ATOM 2015 CB VAL A1180 0.665 -2.602 7.131 1.00 0.49 C ATOM 2016 CG1 VAL A1180 1.998 -2.602 7.896 1.00 0.62 C ATOM 2017 CG2 VAL A1180 0.440 -4.033 6.636 1.00 0.61 C ATOM 0 H VAL A1180 -1.018 -3.536 9.364 1.00 0.40 H new ATOM 0 HA VAL A1180 -0.261 -0.975 8.137 1.00 0.38 H new ATOM 0 HB VAL A1180 0.698 -1.933 6.271 1.00 0.49 H new ATOM 0 HG11 VAL A1180 2.782 -3.013 7.260 1.00 0.62 H new ATOM 0 HG12 VAL A1180 2.256 -1.581 8.177 1.00 0.62 H new ATOM 0 HG13 VAL A1180 1.902 -3.212 8.794 1.00 0.62 H new ATOM 0 HG21 VAL A1180 1.300 -4.354 6.048 1.00 0.61 H new ATOM 0 HG22 VAL A1180 0.316 -4.698 7.490 1.00 0.61 H new ATOM 0 HG23 VAL A1180 -0.456 -4.067 6.016 1.00 0.61 H new ATOM 2027 N LEU A1181 -2.144 -0.947 6.549 1.00 0.30 N ATOM 2028 CA LEU A1181 -3.356 -0.788 5.733 1.00 0.32 C ATOM 2029 C LEU A1181 -3.106 0.002 4.435 1.00 0.29 C ATOM 2030 O LEU A1181 -2.169 0.800 4.347 1.00 0.29 O ATOM 2031 CB LEU A1181 -4.522 -0.194 6.559 1.00 0.41 C ATOM 2032 CG LEU A1181 -4.300 1.237 7.087 1.00 0.44 C ATOM 2033 CD1 LEU A1181 -5.583 2.066 7.073 1.00 0.47 C ATOM 2034 CD2 LEU A1181 -3.799 1.241 8.534 1.00 0.59 C ATOM 0 H LEU A1181 -1.543 -0.123 6.533 1.00 0.30 H new ATOM 0 HA LEU A1181 -3.652 -1.789 5.421 1.00 0.32 H new ATOM 0 HB2 LEU A1181 -5.421 -0.200 5.942 1.00 0.41 H new ATOM 0 HB3 LEU A1181 -4.714 -0.850 7.408 1.00 0.41 H new ATOM 0 HG LEU A1181 -3.558 1.670 6.416 1.00 0.44 H new ATOM 0 HD11 LEU A1181 -5.374 3.066 7.454 1.00 0.47 H new ATOM 0 HD12 LEU A1181 -5.959 2.138 6.052 1.00 0.47 H new ATOM 0 HD13 LEU A1181 -6.333 1.587 7.703 1.00 0.47 H new ATOM 0 HD21 LEU A1181 -3.656 2.269 8.867 1.00 0.59 H new ATOM 0 HD22 LEU A1181 -4.533 0.751 9.174 1.00 0.59 H new ATOM 0 HD23 LEU A1181 -2.851 0.705 8.592 1.00 0.59 H new ATOM 2046 N ILE A1182 -3.948 -0.237 3.427 1.00 0.31 N ATOM 2047 CA ILE A1182 -3.829 0.299 2.062 1.00 0.31 C ATOM 2048 C ILE A1182 -5.205 0.329 1.371 1.00 0.40 C ATOM 2049 O ILE A1182 -5.993 -0.607 1.522 1.00 0.52 O ATOM 2050 CB ILE A1182 -2.780 -0.520 1.246 1.00 0.33 C ATOM 2051 CG1 ILE A1182 -2.776 -0.159 -0.263 1.00 0.36 C ATOM 2052 CG2 ILE A1182 -2.915 -2.047 1.440 1.00 0.46 C ATOM 2053 CD1 ILE A1182 -1.601 -0.754 -1.053 1.00 0.44 C ATOM 0 H ILE A1182 -4.767 -0.834 3.541 1.00 0.31 H new ATOM 0 HA ILE A1182 -3.471 1.327 2.114 1.00 0.31 H new ATOM 0 HB ILE A1182 -1.815 -0.226 1.659 1.00 0.33 H new ATOM 0 HG12 ILE A1182 -3.709 -0.503 -0.709 1.00 0.36 H new ATOM 0 HG13 ILE A1182 -2.754 0.926 -0.365 1.00 0.36 H new ATOM 0 HG21 ILE A1182 -2.157 -2.558 0.846 1.00 0.46 H new ATOM 0 HG22 ILE A1182 -2.778 -2.294 2.493 1.00 0.46 H new ATOM 0 HG23 ILE A1182 -3.906 -2.368 1.118 1.00 0.46 H new ATOM 0 HD11 ILE A1182 -1.675 -0.453 -2.098 1.00 0.44 H new ATOM 0 HD12 ILE A1182 -0.661 -0.391 -0.636 1.00 0.44 H new ATOM 0 HD13 ILE A1182 -1.631 -1.842 -0.986 1.00 0.44 H new ATOM 2065 N GLY A1183 -5.480 1.366 0.572 1.00 0.52 N ATOM 2066 CA GLY A1183 -6.636 1.427 -0.340 1.00 0.79 C ATOM 2067 C GLY A1183 -7.561 2.641 -0.188 1.00 1.04 C ATOM 2068 O GLY A1183 -7.769 3.159 0.906 1.00 2.18 O ATOM 0 H GLY A1183 -4.898 2.203 0.538 1.00 0.52 H new ATOM 0 HA2 GLY A1183 -6.264 1.407 -1.364 1.00 0.79 H new ATOM 0 HA3 GLY A1183 -7.231 0.525 -0.199 1.00 0.79 H new ATOM 2072 N ASN A1184 -8.137 3.074 -1.319 1.00 1.02 N ATOM 2073 CA ASN A1184 -8.887 4.338 -1.477 1.00 1.04 C ATOM 2074 C ASN A1184 -8.073 5.563 -0.959 1.00 1.15 C ATOM 2075 O ASN A1184 -6.839 5.490 -0.890 1.00 2.09 O ATOM 2076 CB ASN A1184 -10.302 4.135 -0.878 1.00 1.30 C ATOM 2077 CG ASN A1184 -11.411 4.011 -1.921 1.00 1.27 C ATOM 2078 OD1 ASN A1184 -12.334 4.813 -1.949 1.00 2.14 O ATOM 2079 ND2 ASN A1184 -11.412 3.007 -2.769 1.00 1.18 N ATOM 0 H ASN A1184 -8.094 2.536 -2.184 1.00 1.02 H new ATOM 0 HA ASN A1184 -9.035 4.593 -2.526 1.00 1.04 H new ATOM 0 HB2 ASN A1184 -10.297 3.237 -0.260 1.00 1.30 H new ATOM 0 HB3 ASN A1184 -10.530 4.974 -0.220 1.00 1.30 H new ATOM 0 HD21 ASN A1184 -12.175 2.905 -3.438 1.00 1.18 H new ATOM 0 HD22 ASN A1184 -10.649 2.330 -2.758 1.00 1.18 H new ATOM 2086 N ARG A1185 -8.720 6.702 -0.636 1.00 0.84 N ATOM 2087 CA ARG A1185 -8.049 7.878 -0.033 1.00 0.95 C ATOM 2088 C ARG A1185 -8.666 8.383 1.278 1.00 0.85 C ATOM 2089 O ARG A1185 -7.924 8.675 2.212 1.00 1.01 O ATOM 2090 CB ARG A1185 -7.845 8.993 -1.082 1.00 1.25 C ATOM 2091 CG ARG A1185 -9.114 9.782 -1.446 1.00 1.79 C ATOM 2092 CD ARG A1185 -8.812 10.907 -2.444 1.00 2.01 C ATOM 2093 NE ARG A1185 -9.919 11.880 -2.470 1.00 3.04 N ATOM 2094 CZ ARG A1185 -10.657 12.267 -3.489 1.00 3.95 C ATOM 2095 NH1 ARG A1185 -10.521 11.826 -4.702 1.00 4.23 N ATOM 2096 NH2 ARG A1185 -11.592 13.136 -3.269 1.00 5.32 N ATOM 0 H ARG A1185 -9.720 6.835 -0.785 1.00 0.84 H new ATOM 0 HA ARG A1185 -7.066 7.528 0.282 1.00 0.95 H new ATOM 0 HB2 ARG A1185 -7.096 9.691 -0.708 1.00 1.25 H new ATOM 0 HB3 ARG A1185 -7.439 8.547 -1.990 1.00 1.25 H new ATOM 0 HG2 ARG A1185 -9.854 9.105 -1.873 1.00 1.79 H new ATOM 0 HG3 ARG A1185 -9.552 10.205 -0.542 1.00 1.79 H new ATOM 0 HD2 ARG A1185 -7.885 11.409 -2.167 1.00 2.01 H new ATOM 0 HD3 ARG A1185 -8.663 10.489 -3.440 1.00 2.01 H new ATOM 0 HE ARG A1185 -10.144 12.313 -1.575 1.00 3.04 H new ATOM 0 HH11 ARG A1185 -9.804 11.132 -4.915 1.00 4.23 H new ATOM 0 HH12 ARG A1185 -11.131 12.173 -5.442 1.00 4.23 H new ATOM 0 HH21 ARG A1185 -11.739 13.500 -2.327 1.00 5.32 H new ATOM 0 HH22 ARG A1185 -12.181 13.457 -4.037 1.00 5.32 H new ATOM 2110 N GLU A1186 -9.989 8.432 1.435 1.00 0.90 N ATOM 2111 CA GLU A1186 -10.612 8.870 2.697 1.00 1.11 C ATOM 2112 C GLU A1186 -10.452 7.822 3.798 1.00 0.88 C ATOM 2113 O GLU A1186 -10.094 8.162 4.922 1.00 0.99 O ATOM 2114 CB GLU A1186 -12.102 9.174 2.515 1.00 1.64 C ATOM 2115 CG GLU A1186 -12.366 10.374 1.609 1.00 2.88 C ATOM 2116 CD GLU A1186 -13.842 10.757 1.692 1.00 3.23 C ATOM 2117 OE1 GLU A1186 -14.698 10.034 1.124 1.00 3.49 O ATOM 2118 OE2 GLU A1186 -14.165 11.790 2.328 1.00 4.05 O ATOM 0 H GLU A1186 -10.655 8.175 0.707 1.00 0.90 H new ATOM 0 HA GLU A1186 -10.094 9.782 2.993 1.00 1.11 H new ATOM 0 HB2 GLU A1186 -12.597 8.297 2.098 1.00 1.64 H new ATOM 0 HB3 GLU A1186 -12.550 9.359 3.491 1.00 1.64 H new ATOM 0 HG2 GLU A1186 -11.743 11.216 1.911 1.00 2.88 H new ATOM 0 HG3 GLU A1186 -12.099 10.133 0.580 1.00 2.88 H new ATOM 2125 N TRP A1187 -10.613 6.538 3.470 1.00 1.05 N ATOM 2126 CA TRP A1187 -10.359 5.417 4.386 1.00 1.30 C ATOM 2127 C TRP A1187 -8.916 5.387 4.941 1.00 1.31 C ATOM 2128 O TRP A1187 -8.680 4.860 6.029 1.00 1.62 O ATOM 2129 CB TRP A1187 -10.699 4.125 3.631 1.00 1.94 C ATOM 2130 CG TRP A1187 -10.877 2.912 4.486 1.00 2.00 C ATOM 2131 CD1 TRP A1187 -11.938 2.680 5.291 1.00 3.09 C ATOM 2132 CD2 TRP A1187 -10.006 1.747 4.624 1.00 1.49 C ATOM 2133 NE1 TRP A1187 -11.775 1.475 5.940 1.00 3.00 N ATOM 2134 CE2 TRP A1187 -10.611 0.848 5.555 1.00 1.88 C ATOM 2135 CE3 TRP A1187 -8.772 1.356 4.061 1.00 1.99 C ATOM 2136 CZ2 TRP A1187 -10.025 -0.371 5.916 1.00 1.63 C ATOM 2137 CZ3 TRP A1187 -8.173 0.133 4.416 1.00 2.49 C ATOM 2138 CH2 TRP A1187 -8.797 -0.726 5.339 1.00 1.87 C ATOM 0 H TRP A1187 -10.928 6.240 2.547 1.00 1.05 H new ATOM 0 HA TRP A1187 -10.988 5.532 5.269 1.00 1.30 H new ATOM 0 HB2 TRP A1187 -11.615 4.286 3.063 1.00 1.94 H new ATOM 0 HB3 TRP A1187 -9.907 3.927 2.909 1.00 1.94 H new ATOM 0 HD1 TRP A1187 -12.785 3.339 5.408 1.00 3.09 H new ATOM 0 HE1 TRP A1187 -12.434 1.095 6.620 1.00 3.00 H new ATOM 0 HE3 TRP A1187 -8.282 2.003 3.349 1.00 1.99 H new ATOM 0 HZ2 TRP A1187 -10.509 -1.026 6.625 1.00 1.63 H new ATOM 0 HZ3 TRP A1187 -7.227 -0.148 3.977 1.00 2.49 H new ATOM 0 HH2 TRP A1187 -8.329 -1.662 5.604 1.00 1.87 H new ATOM 2149 N MET A1188 -7.983 6.015 4.213 1.00 1.23 N ATOM 2150 CA MET A1188 -6.610 6.288 4.661 1.00 1.54 C ATOM 2151 C MET A1188 -6.549 7.447 5.670 1.00 1.46 C ATOM 2152 O MET A1188 -6.053 7.272 6.778 1.00 1.79 O ATOM 2153 CB MET A1188 -5.676 6.511 3.458 1.00 1.85 C ATOM 2154 CG MET A1188 -5.685 5.316 2.491 1.00 2.58 C ATOM 2155 SD MET A1188 -5.176 3.716 3.191 1.00 2.82 S ATOM 2156 CE MET A1188 -3.593 4.160 3.946 1.00 0.92 C ATOM 0 H MET A1188 -8.167 6.357 3.270 1.00 1.23 H new ATOM 0 HA MET A1188 -6.254 5.406 5.193 1.00 1.54 H new ATOM 0 HB2 MET A1188 -5.981 7.411 2.924 1.00 1.85 H new ATOM 0 HB3 MET A1188 -4.660 6.681 3.815 1.00 1.85 H new ATOM 0 HG2 MET A1188 -6.692 5.209 2.087 1.00 2.58 H new ATOM 0 HG3 MET A1188 -5.028 5.548 1.653 1.00 2.58 H new ATOM 0 HE1 MET A1188 -2.990 3.262 4.082 1.00 0.92 H new ATOM 0 HE2 MET A1188 -3.063 4.858 3.297 1.00 0.92 H new ATOM 0 HE3 MET A1188 -3.770 4.628 4.914 1.00 0.92 H new ATOM 2166 N ILE A1189 -7.119 8.606 5.319 1.00 1.34 N ATOM 2167 CA ILE A1189 -7.295 9.790 6.188 1.00 1.62 C ATOM 2168 C ILE A1189 -7.884 9.382 7.547 1.00 1.37 C ATOM 2169 O ILE A1189 -7.274 9.627 8.592 1.00 1.53 O ATOM 2170 CB ILE A1189 -8.072 10.926 5.475 1.00 1.91 C ATOM 2171 CG1 ILE A1189 -7.250 11.448 4.270 1.00 2.19 C ATOM 2172 CG2 ILE A1189 -8.372 12.084 6.448 1.00 2.28 C ATOM 2173 CD1 ILE A1189 -8.015 12.406 3.345 1.00 2.53 C ATOM 0 H ILE A1189 -7.489 8.757 4.381 1.00 1.34 H new ATOM 0 HA ILE A1189 -6.314 10.217 6.397 1.00 1.62 H new ATOM 0 HB ILE A1189 -9.021 10.524 5.120 1.00 1.91 H new ATOM 0 HG12 ILE A1189 -6.362 11.957 4.645 1.00 2.19 H new ATOM 0 HG13 ILE A1189 -6.905 10.595 3.685 1.00 2.19 H new ATOM 0 HG21 ILE A1189 -8.918 12.868 5.923 1.00 2.28 H new ATOM 0 HG22 ILE A1189 -8.975 11.715 7.278 1.00 2.28 H new ATOM 0 HG23 ILE A1189 -7.435 12.488 6.832 1.00 2.28 H new ATOM 0 HD11 ILE A1189 -7.364 12.722 2.530 1.00 2.53 H new ATOM 0 HD12 ILE A1189 -8.888 11.897 2.936 1.00 2.53 H new ATOM 0 HD13 ILE A1189 -8.336 13.280 3.912 1.00 2.53 H new ATOM 2185 N ARG A1190 -9.107 8.832 7.529 1.00 1.13 N ATOM 2186 CA ARG A1190 -9.918 8.351 8.670 1.00 1.17 C ATOM 2187 C ARG A1190 -9.206 7.452 9.689 1.00 0.87 C ATOM 2188 O ARG A1190 -9.734 7.262 10.785 1.00 0.92 O ATOM 2189 CB ARG A1190 -11.141 7.604 8.114 1.00 1.31 C ATOM 2190 CG ARG A1190 -12.131 8.542 7.411 1.00 2.74 C ATOM 2191 CD ARG A1190 -13.229 7.716 6.740 1.00 3.29 C ATOM 2192 NE ARG A1190 -14.069 8.562 5.885 1.00 4.59 N ATOM 2193 CZ ARG A1190 -15.043 8.159 5.099 1.00 5.41 C ATOM 2194 NH1 ARG A1190 -15.415 6.916 5.016 1.00 5.58 N ATOM 2195 NH2 ARG A1190 -15.654 9.035 4.367 1.00 6.60 N ATOM 0 H ARG A1190 -9.600 8.699 6.646 1.00 1.13 H new ATOM 0 HA ARG A1190 -10.178 9.248 9.232 1.00 1.17 H new ATOM 0 HB2 ARG A1190 -10.808 6.840 7.412 1.00 1.31 H new ATOM 0 HB3 ARG A1190 -11.649 7.088 8.929 1.00 1.31 H new ATOM 0 HG2 ARG A1190 -12.570 9.232 8.132 1.00 2.74 H new ATOM 0 HG3 ARG A1190 -11.611 9.146 6.668 1.00 2.74 H new ATOM 0 HD2 ARG A1190 -12.780 6.922 6.144 1.00 3.29 H new ATOM 0 HD3 ARG A1190 -13.844 7.235 7.500 1.00 3.29 H new ATOM 0 HE ARG A1190 -13.878 9.564 5.902 1.00 4.59 H new ATOM 0 HH11 ARG A1190 -14.945 6.205 5.576 1.00 5.58 H new ATOM 0 HH12 ARG A1190 -16.177 6.652 4.391 1.00 5.58 H new ATOM 0 HH21 ARG A1190 -15.377 10.016 4.407 1.00 6.60 H new ATOM 0 HH22 ARG A1190 -16.412 8.744 3.750 1.00 6.60 H new ATOM 2209 N ASN A1191 -8.013 6.930 9.391 1.00 0.64 N ATOM 2210 CA ASN A1191 -7.151 6.257 10.367 1.00 0.52 C ATOM 2211 C ASN A1191 -6.348 7.275 11.231 1.00 0.54 C ATOM 2212 O ASN A1191 -5.262 6.968 11.718 1.00 0.64 O ATOM 2213 CB ASN A1191 -6.293 5.202 9.628 1.00 0.48 C ATOM 2214 CG ASN A1191 -5.868 4.056 10.522 1.00 0.60 C ATOM 2215 OD1 ASN A1191 -6.415 2.965 10.456 1.00 0.75 O ATOM 2216 ND2 ASN A1191 -4.916 4.275 11.391 1.00 0.76 N ATOM 0 H ASN A1191 -7.613 6.963 8.453 1.00 0.64 H new ATOM 0 HA ASN A1191 -7.752 5.720 11.101 1.00 0.52 H new ATOM 0 HB2 ASN A1191 -6.859 4.807 8.784 1.00 0.48 H new ATOM 0 HB3 ASN A1191 -5.406 5.685 9.219 1.00 0.48 H new ATOM 0 HD21 ASN A1191 -4.622 3.531 12.024 1.00 0.76 H new ATOM 0 HD22 ASN A1191 -4.467 5.190 11.436 1.00 0.76 H new ATOM 2223 N GLY A1192 -6.838 8.513 11.392 1.00 0.53 N ATOM 2224 CA GLY A1192 -6.166 9.580 12.145 1.00 0.62 C ATOM 2225 C GLY A1192 -4.875 10.105 11.503 1.00 0.64 C ATOM 2226 O GLY A1192 -3.977 10.546 12.227 1.00 0.82 O ATOM 0 H GLY A1192 -7.730 8.805 10.994 1.00 0.53 H new ATOM 0 HA2 GLY A1192 -6.859 10.412 12.266 1.00 0.62 H new ATOM 0 HA3 GLY A1192 -5.934 9.210 13.144 1.00 0.62 H new ATOM 2230 N LEU A1193 -4.736 10.033 10.173 1.00 0.55 N ATOM 2231 CA LEU A1193 -3.469 10.294 9.470 1.00 0.64 C ATOM 2232 C LEU A1193 -3.323 11.730 8.945 1.00 0.77 C ATOM 2233 O LEU A1193 -4.315 12.430 8.736 1.00 0.94 O ATOM 2234 CB LEU A1193 -3.257 9.281 8.332 1.00 0.66 C ATOM 2235 CG LEU A1193 -3.485 7.812 8.710 1.00 0.57 C ATOM 2236 CD1 LEU A1193 -3.044 6.918 7.558 1.00 0.59 C ATOM 2237 CD2 LEU A1193 -2.702 7.339 9.931 1.00 0.52 C ATOM 0 H LEU A1193 -5.505 9.790 9.548 1.00 0.55 H new ATOM 0 HA LEU A1193 -2.689 10.171 10.221 1.00 0.64 H new ATOM 0 HB2 LEU A1193 -3.928 9.536 7.511 1.00 0.66 H new ATOM 0 HB3 LEU A1193 -2.239 9.389 7.957 1.00 0.66 H new ATOM 0 HG LEU A1193 -4.549 7.744 8.936 1.00 0.57 H new ATOM 0 HD11 LEU A1193 -3.206 5.874 7.825 1.00 0.59 H new ATOM 0 HD12 LEU A1193 -3.625 7.159 6.668 1.00 0.59 H new ATOM 0 HD13 LEU A1193 -1.985 7.081 7.355 1.00 0.59 H new ATOM 0 HD21 LEU A1193 -2.926 6.290 10.123 1.00 0.52 H new ATOM 0 HD22 LEU A1193 -1.634 7.454 9.745 1.00 0.52 H new ATOM 0 HD23 LEU A1193 -2.986 7.935 10.798 1.00 0.52 H new ATOM 2249 N VAL A1194 -2.079 12.148 8.698 1.00 0.92 N ATOM 2250 CA VAL A1194 -1.717 13.471 8.161 1.00 1.17 C ATOM 2251 C VAL A1194 -1.307 13.360 6.691 1.00 1.12 C ATOM 2252 O VAL A1194 -0.398 12.599 6.345 1.00 1.12 O ATOM 2253 CB VAL A1194 -0.594 14.122 8.994 1.00 1.55 C ATOM 2254 CG1 VAL A1194 -0.289 15.538 8.489 1.00 1.78 C ATOM 2255 CG2 VAL A1194 -0.971 14.228 10.479 1.00 1.74 C ATOM 0 H VAL A1194 -1.265 11.558 8.871 1.00 0.92 H new ATOM 0 HA VAL A1194 -2.595 14.113 8.227 1.00 1.17 H new ATOM 0 HB VAL A1194 0.279 13.479 8.884 1.00 1.55 H new ATOM 0 HG11 VAL A1194 0.506 15.976 9.092 1.00 1.78 H new ATOM 0 HG12 VAL A1194 0.029 15.492 7.447 1.00 1.78 H new ATOM 0 HG13 VAL A1194 -1.185 16.153 8.568 1.00 1.78 H new ATOM 0 HG21 VAL A1194 -0.153 14.692 11.030 1.00 1.74 H new ATOM 0 HG22 VAL A1194 -1.870 14.836 10.584 1.00 1.74 H new ATOM 0 HG23 VAL A1194 -1.158 13.231 10.879 1.00 1.74 H new ATOM 2265 N ILE A1195 -1.957 14.147 5.827 1.00 1.18 N ATOM 2266 CA ILE A1195 -1.711 14.222 4.378 1.00 1.10 C ATOM 2267 C ILE A1195 -1.277 15.642 3.975 1.00 1.21 C ATOM 2268 O ILE A1195 -1.676 16.614 4.616 1.00 1.46 O ATOM 2269 CB ILE A1195 -2.945 13.686 3.614 1.00 1.02 C ATOM 2270 CG1 ILE A1195 -2.595 13.373 2.147 1.00 0.93 C ATOM 2271 CG2 ILE A1195 -4.142 14.642 3.687 1.00 1.22 C ATOM 2272 CD1 ILE A1195 -3.635 12.482 1.449 1.00 0.93 C ATOM 0 H ILE A1195 -2.701 14.777 6.128 1.00 1.18 H new ATOM 0 HA ILE A1195 -0.876 13.579 4.098 1.00 1.10 H new ATOM 0 HB ILE A1195 -3.240 12.761 4.110 1.00 1.02 H new ATOM 0 HG12 ILE A1195 -2.501 14.309 1.596 1.00 0.93 H new ATOM 0 HG13 ILE A1195 -1.623 12.882 2.110 1.00 0.93 H new ATOM 0 HG21 ILE A1195 -4.981 14.218 3.135 1.00 1.22 H new ATOM 0 HG22 ILE A1195 -4.429 14.786 4.728 1.00 1.22 H new ATOM 0 HG23 ILE A1195 -3.868 15.602 3.250 1.00 1.22 H new ATOM 0 HD11 ILE A1195 -3.327 12.301 0.419 1.00 0.93 H new ATOM 0 HD12 ILE A1195 -3.713 11.532 1.977 1.00 0.93 H new ATOM 0 HD13 ILE A1195 -4.604 12.981 1.455 1.00 0.93 H new ATOM 2284 N ASN A1196 -0.437 15.769 2.940 1.00 1.10 N ATOM 2285 CA ASN A1196 0.262 17.016 2.584 1.00 1.27 C ATOM 2286 C ASN A1196 0.061 17.422 1.103 1.00 1.38 C ATOM 2287 O ASN A1196 -0.379 16.620 0.276 1.00 1.26 O ATOM 2288 CB ASN A1196 1.748 16.858 2.978 1.00 1.35 C ATOM 2289 CG ASN A1196 1.951 16.632 4.470 1.00 1.89 C ATOM 2290 OD1 ASN A1196 2.111 17.568 5.242 1.00 2.94 O ATOM 2291 ND2 ASN A1196 1.914 15.400 4.931 1.00 1.76 N ATOM 0 H ASN A1196 -0.218 14.995 2.313 1.00 1.10 H new ATOM 0 HA ASN A1196 -0.171 17.847 3.141 1.00 1.27 H new ATOM 0 HB2 ASN A1196 2.176 16.020 2.428 1.00 1.35 H new ATOM 0 HB3 ASN A1196 2.295 17.751 2.674 1.00 1.35 H new ATOM 0 HD21 ASN A1196 2.019 15.226 5.931 1.00 1.76 H new ATOM 0 HD22 ASN A1196 1.781 14.619 4.289 1.00 1.76 H new ATOM 2298 N ASN A1197 0.387 18.662 0.734 1.00 1.62 N ATOM 2299 CA ASN A1197 0.051 19.212 -0.584 1.00 1.71 C ATOM 2300 C ASN A1197 0.825 18.564 -1.755 1.00 1.63 C ATOM 2301 O ASN A1197 0.293 18.450 -2.860 1.00 1.62 O ATOM 2302 CB ASN A1197 0.252 20.738 -0.559 1.00 1.97 C ATOM 2303 CG ASN A1197 -0.563 21.456 -1.606 1.00 2.69 C ATOM 2304 OD1 ASN A1197 -1.550 20.961 -2.134 1.00 3.16 O ATOM 2305 ND2 ASN A1197 -0.229 22.685 -1.888 1.00 3.22 N ATOM 0 H ASN A1197 0.890 19.313 1.337 1.00 1.62 H new ATOM 0 HA ASN A1197 -0.995 18.972 -0.775 1.00 1.71 H new ATOM 0 HB2 ASN A1197 -0.016 21.118 0.427 1.00 1.97 H new ATOM 0 HB3 ASN A1197 1.308 20.963 -0.711 1.00 1.97 H new ATOM 0 HD21 ASN A1197 -0.789 23.228 -2.545 1.00 3.22 H new ATOM 0 HD22 ASN A1197 0.592 23.103 -1.451 1.00 3.22 H new ATOM 2312 N ASP A1198 2.059 18.106 -1.521 1.00 1.62 N ATOM 2313 CA ASP A1198 2.921 17.440 -2.515 1.00 1.65 C ATOM 2314 C ASP A1198 2.307 16.117 -2.999 1.00 1.28 C ATOM 2315 O ASP A1198 2.308 15.785 -4.188 1.00 1.27 O ATOM 2316 CB ASP A1198 4.279 17.149 -1.847 1.00 1.86 C ATOM 2317 CG ASP A1198 5.411 16.921 -2.851 1.00 3.45 C ATOM 2318 OD1 ASP A1198 5.509 15.799 -3.397 1.00 5.08 O ATOM 2319 OD2 ASP A1198 6.238 17.836 -3.079 1.00 3.74 O ATOM 0 H ASP A1198 2.504 18.189 -0.607 1.00 1.62 H new ATOM 0 HA ASP A1198 3.033 18.093 -3.380 1.00 1.65 H new ATOM 0 HB2 ASP A1198 4.542 17.983 -1.197 1.00 1.86 H new ATOM 0 HB3 ASP A1198 4.183 16.268 -1.212 1.00 1.86 H new ATOM 2324 N VAL A1199 1.773 15.357 -2.041 1.00 1.04 N ATOM 2325 CA VAL A1199 1.114 14.067 -2.248 1.00 0.84 C ATOM 2326 C VAL A1199 -0.308 14.227 -2.788 1.00 0.79 C ATOM 2327 O VAL A1199 -0.662 13.511 -3.718 1.00 0.72 O ATOM 2328 CB VAL A1199 1.228 13.183 -0.990 1.00 0.79 C ATOM 2329 CG1 VAL A1199 0.834 13.899 0.302 1.00 1.10 C ATOM 2330 CG2 VAL A1199 0.412 11.895 -1.106 1.00 0.80 C ATOM 0 H VAL A1199 1.789 15.635 -1.060 1.00 1.04 H new ATOM 0 HA VAL A1199 1.642 13.529 -3.035 1.00 0.84 H new ATOM 0 HB VAL A1199 2.289 12.939 -0.933 1.00 0.79 H new ATOM 0 HG11 VAL A1199 0.939 13.215 1.144 1.00 1.10 H new ATOM 0 HG12 VAL A1199 1.483 14.762 0.452 1.00 1.10 H new ATOM 0 HG13 VAL A1199 -0.202 14.232 0.232 1.00 1.10 H new ATOM 0 HG21 VAL A1199 0.526 11.308 -0.194 1.00 0.80 H new ATOM 0 HG22 VAL A1199 -0.640 12.142 -1.249 1.00 0.80 H new ATOM 0 HG23 VAL A1199 0.767 11.315 -1.958 1.00 0.80 H new ATOM 2340 N ASN A1200 -1.090 15.199 -2.304 1.00 0.90 N ATOM 2341 CA ASN A1200 -2.401 15.542 -2.878 1.00 0.99 C ATOM 2342 C ASN A1200 -2.300 15.926 -4.371 1.00 1.04 C ATOM 2343 O ASN A1200 -3.100 15.474 -5.188 1.00 1.01 O ATOM 2344 CB ASN A1200 -3.016 16.660 -2.025 1.00 1.25 C ATOM 2345 CG ASN A1200 -4.170 17.379 -2.701 1.00 1.95 C ATOM 2346 OD1 ASN A1200 -4.035 18.517 -3.129 1.00 3.72 O ATOM 2347 ND2 ASN A1200 -5.319 16.769 -2.823 1.00 1.56 N ATOM 0 H ASN A1200 -0.833 15.773 -1.501 1.00 0.90 H new ATOM 0 HA ASN A1200 -3.053 14.669 -2.854 1.00 0.99 H new ATOM 0 HB2 ASN A1200 -3.365 16.236 -1.083 1.00 1.25 H new ATOM 0 HB3 ASN A1200 -2.241 17.386 -1.780 1.00 1.25 H new ATOM 0 HD21 ASN A1200 -6.102 17.242 -3.275 1.00 1.56 H new ATOM 0 HD22 ASN A1200 -5.433 15.820 -2.467 1.00 1.56 H new ATOM 2354 N ASP A1201 -1.278 16.698 -4.747 1.00 1.15 N ATOM 2355 CA ASP A1201 -1.040 17.106 -6.135 1.00 1.21 C ATOM 2356 C ASP A1201 -0.688 15.930 -7.075 1.00 1.07 C ATOM 2357 O ASP A1201 -1.069 15.945 -8.249 1.00 1.20 O ATOM 2358 CB ASP A1201 0.069 18.165 -6.116 1.00 1.40 C ATOM 2359 CG ASP A1201 0.445 18.615 -7.520 1.00 1.59 C ATOM 2360 OD1 ASP A1201 -0.278 19.457 -8.101 1.00 1.50 O ATOM 2361 OD2 ASP A1201 1.449 18.090 -8.055 1.00 2.92 O ATOM 0 H ASP A1201 -0.586 17.061 -4.092 1.00 1.15 H new ATOM 0 HA ASP A1201 -1.963 17.514 -6.546 1.00 1.21 H new ATOM 0 HB2 ASP A1201 -0.261 19.026 -5.534 1.00 1.40 H new ATOM 0 HB3 ASP A1201 0.949 17.761 -5.616 1.00 1.40 H new ATOM 2366 N PHE A1202 0.033 14.917 -6.578 1.00 0.90 N ATOM 2367 CA PHE A1202 0.294 13.648 -7.278 1.00 0.79 C ATOM 2368 C PHE A1202 -0.932 12.710 -7.302 1.00 0.62 C ATOM 2369 O PHE A1202 -1.225 12.096 -8.329 1.00 0.60 O ATOM 2370 CB PHE A1202 1.546 13.001 -6.662 1.00 0.92 C ATOM 2371 CG PHE A1202 1.944 11.626 -7.183 1.00 0.92 C ATOM 2372 CD1 PHE A1202 1.775 11.260 -8.535 1.00 1.75 C ATOM 2373 CD2 PHE A1202 2.503 10.694 -6.288 1.00 2.25 C ATOM 2374 CE1 PHE A1202 2.108 9.962 -8.965 1.00 1.85 C ATOM 2375 CE2 PHE A1202 2.824 9.394 -6.717 1.00 2.42 C ATOM 2376 CZ PHE A1202 2.626 9.027 -8.056 1.00 1.43 C ATOM 0 H PHE A1202 0.463 14.956 -5.654 1.00 0.90 H new ATOM 0 HA PHE A1202 0.487 13.852 -8.331 1.00 0.79 H new ATOM 0 HB2 PHE A1202 2.387 13.677 -6.816 1.00 0.92 H new ATOM 0 HB3 PHE A1202 1.392 12.923 -5.586 1.00 0.92 H new ATOM 0 HD1 PHE A1202 1.389 11.979 -9.243 1.00 1.75 H new ATOM 0 HD2 PHE A1202 2.687 10.980 -5.263 1.00 2.25 H new ATOM 0 HE1 PHE A1202 1.964 9.684 -9.999 1.00 1.85 H new ATOM 0 HE2 PHE A1202 3.223 8.677 -6.015 1.00 2.42 H new ATOM 0 HZ PHE A1202 2.871 8.028 -8.386 1.00 1.43 H new ATOM 2386 N MET A1203 -1.684 12.645 -6.200 1.00 0.60 N ATOM 2387 CA MET A1203 -2.930 11.879 -6.074 1.00 0.56 C ATOM 2388 C MET A1203 -3.943 12.338 -7.130 1.00 0.69 C ATOM 2389 O MET A1203 -4.317 11.557 -8.002 1.00 0.76 O ATOM 2390 CB MET A1203 -3.462 12.033 -4.636 1.00 0.68 C ATOM 2391 CG MET A1203 -4.765 11.285 -4.326 1.00 0.98 C ATOM 2392 SD MET A1203 -4.728 9.470 -4.388 1.00 1.09 S ATOM 2393 CE MET A1203 -3.360 9.084 -3.266 1.00 1.00 C ATOM 0 H MET A1203 -1.436 13.139 -5.343 1.00 0.60 H new ATOM 0 HA MET A1203 -2.749 10.820 -6.257 1.00 0.56 H new ATOM 0 HB2 MET A1203 -2.693 11.688 -3.945 1.00 0.68 H new ATOM 0 HB3 MET A1203 -3.617 13.093 -4.437 1.00 0.68 H new ATOM 0 HG2 MET A1203 -5.093 11.580 -3.329 1.00 0.98 H new ATOM 0 HG3 MET A1203 -5.525 11.630 -5.027 1.00 0.98 H new ATOM 0 HE1 MET A1203 -3.520 8.102 -2.821 1.00 1.00 H new ATOM 0 HE2 MET A1203 -2.423 9.082 -3.822 1.00 1.00 H new ATOM 0 HE3 MET A1203 -3.312 9.836 -2.478 1.00 1.00 H new ATOM 2403 N THR A1204 -4.310 13.625 -7.129 1.00 0.83 N ATOM 2404 CA THR A1204 -5.291 14.169 -8.082 1.00 1.01 C ATOM 2405 C THR A1204 -4.818 14.079 -9.540 1.00 0.91 C ATOM 2406 O THR A1204 -5.630 13.849 -10.428 1.00 0.99 O ATOM 2407 CB THR A1204 -5.686 15.606 -7.696 1.00 1.30 C ATOM 2408 OG1 THR A1204 -6.903 15.947 -8.323 1.00 1.48 O ATOM 2409 CG2 THR A1204 -4.635 16.649 -8.077 1.00 1.36 C ATOM 0 H THR A1204 -3.941 14.315 -6.475 1.00 0.83 H new ATOM 0 HA THR A1204 -6.181 13.543 -8.018 1.00 1.01 H new ATOM 0 HB THR A1204 -5.780 15.617 -6.610 1.00 1.30 H new ATOM 0 HG1 THR A1204 -7.154 16.861 -8.075 1.00 1.48 H new ATOM 0 HG21 THR A1204 -4.979 17.639 -7.776 1.00 1.36 H new ATOM 0 HG22 THR A1204 -3.697 16.421 -7.572 1.00 1.36 H new ATOM 0 HG23 THR A1204 -4.480 16.632 -9.156 1.00 1.36 H new ATOM 2417 N GLU A1205 -3.509 14.161 -9.811 1.00 0.84 N ATOM 2418 CA GLU A1205 -2.938 13.943 -11.151 1.00 0.84 C ATOM 2419 C GLU A1205 -3.272 12.552 -11.701 1.00 0.70 C ATOM 2420 O GLU A1205 -3.764 12.433 -12.828 1.00 0.75 O ATOM 2421 CB GLU A1205 -1.432 14.196 -11.092 1.00 1.00 C ATOM 2422 CG GLU A1205 -0.638 13.840 -12.360 1.00 1.22 C ATOM 2423 CD GLU A1205 -0.940 14.663 -13.620 1.00 1.82 C ATOM 2424 OE1 GLU A1205 -1.501 15.779 -13.532 1.00 2.22 O ATOM 2425 OE2 GLU A1205 -0.537 14.220 -14.727 1.00 3.01 O ATOM 0 H GLU A1205 -2.809 14.382 -9.103 1.00 0.84 H new ATOM 0 HA GLU A1205 -3.388 14.647 -11.850 1.00 0.84 H new ATOM 0 HB2 GLU A1205 -1.269 15.251 -10.870 1.00 1.00 H new ATOM 0 HB3 GLU A1205 -1.021 13.627 -10.258 1.00 1.00 H new ATOM 0 HG2 GLU A1205 0.424 13.940 -12.135 1.00 1.22 H new ATOM 0 HG3 GLU A1205 -0.817 12.790 -12.589 1.00 1.22 H new ATOM 2432 N HIS A1206 -3.031 11.506 -10.909 1.00 0.64 N ATOM 2433 CA HIS A1206 -3.365 10.122 -11.281 1.00 0.77 C ATOM 2434 C HIS A1206 -4.869 9.802 -11.249 1.00 0.88 C ATOM 2435 O HIS A1206 -5.356 9.060 -12.107 1.00 1.07 O ATOM 2436 CB HIS A1206 -2.512 9.132 -10.480 1.00 0.83 C ATOM 2437 CG HIS A1206 -1.207 8.886 -11.188 1.00 1.07 C ATOM 2438 ND1 HIS A1206 -0.844 7.725 -11.832 1.00 1.71 N ATOM 2439 CD2 HIS A1206 -0.258 9.825 -11.487 1.00 1.51 C ATOM 2440 CE1 HIS A1206 0.303 7.954 -12.491 1.00 2.15 C ATOM 2441 NE2 HIS A1206 0.696 9.229 -12.320 1.00 2.13 N ATOM 0 H HIS A1206 -2.598 11.590 -9.989 1.00 0.64 H new ATOM 0 HA HIS A1206 -3.108 10.008 -12.334 1.00 0.77 H new ATOM 0 HB2 HIS A1206 -2.325 9.526 -9.481 1.00 0.83 H new ATOM 0 HB3 HIS A1206 -3.051 8.193 -10.356 1.00 0.83 H new ATOM 0 HD2 HIS A1206 -0.247 10.848 -11.141 1.00 1.51 H new ATOM 0 HE1 HIS A1206 0.835 7.218 -13.076 1.00 2.15 H new ATOM 0 HE2 HIS A1206 1.524 9.673 -12.718 1.00 2.13 H new ATOM 2449 N GLU A1207 -5.633 10.410 -10.341 1.00 0.89 N ATOM 2450 CA GLU A1207 -7.096 10.301 -10.342 1.00 1.13 C ATOM 2451 C GLU A1207 -7.716 10.956 -11.595 1.00 1.18 C ATOM 2452 O GLU A1207 -8.562 10.351 -12.256 1.00 1.31 O ATOM 2453 CB GLU A1207 -7.669 10.921 -9.059 1.00 1.29 C ATOM 2454 CG GLU A1207 -7.335 10.161 -7.771 1.00 1.60 C ATOM 2455 CD GLU A1207 -8.072 10.759 -6.568 1.00 2.98 C ATOM 2456 OE1 GLU A1207 -7.996 11.991 -6.332 1.00 4.70 O ATOM 2457 OE2 GLU A1207 -8.790 9.992 -5.879 1.00 3.21 O ATOM 0 H GLU A1207 -5.261 10.989 -9.588 1.00 0.89 H new ATOM 0 HA GLU A1207 -7.357 9.243 -10.371 1.00 1.13 H new ATOM 0 HB2 GLU A1207 -7.297 11.942 -8.968 1.00 1.29 H new ATOM 0 HB3 GLU A1207 -8.753 10.984 -9.156 1.00 1.29 H new ATOM 0 HG2 GLU A1207 -7.608 9.112 -7.883 1.00 1.60 H new ATOM 0 HG3 GLU A1207 -6.260 10.193 -7.595 1.00 1.60 H new ATOM 2464 N ARG A1208 -7.255 12.150 -12.003 1.00 1.10 N ATOM 2465 CA ARG A1208 -7.704 12.853 -13.228 1.00 1.16 C ATOM 2466 C ARG A1208 -7.241 12.153 -14.516 1.00 1.16 C ATOM 2467 O ARG A1208 -7.947 12.204 -15.523 1.00 1.26 O ATOM 2468 CB ARG A1208 -7.278 14.331 -13.179 1.00 1.13 C ATOM 2469 CG ARG A1208 -8.048 15.112 -12.097 1.00 1.41 C ATOM 2470 CD ARG A1208 -7.509 16.537 -11.911 1.00 1.47 C ATOM 2471 NE ARG A1208 -8.098 17.496 -12.870 1.00 2.42 N ATOM 2472 CZ ARG A1208 -7.512 18.109 -13.884 1.00 3.53 C ATOM 2473 NH1 ARG A1208 -6.288 17.896 -14.264 1.00 4.11 N ATOM 2474 NH2 ARG A1208 -8.182 18.982 -14.566 1.00 4.89 N ATOM 0 H ARG A1208 -6.546 12.668 -11.484 1.00 1.10 H new ATOM 0 HA ARG A1208 -8.793 12.815 -13.253 1.00 1.16 H new ATOM 0 HB2 ARG A1208 -6.208 14.395 -12.981 1.00 1.13 H new ATOM 0 HB3 ARG A1208 -7.450 14.792 -14.152 1.00 1.13 H new ATOM 0 HG2 ARG A1208 -9.103 15.158 -12.367 1.00 1.41 H new ATOM 0 HG3 ARG A1208 -7.984 14.576 -11.150 1.00 1.41 H new ATOM 0 HD2 ARG A1208 -7.717 16.871 -10.894 1.00 1.47 H new ATOM 0 HD3 ARG A1208 -6.425 16.530 -12.029 1.00 1.47 H new ATOM 0 HE ARG A1208 -9.085 17.713 -12.731 1.00 2.42 H new ATOM 0 HH11 ARG A1208 -5.711 17.216 -13.769 1.00 4.11 H new ATOM 0 HH12 ARG A1208 -5.904 18.409 -15.058 1.00 4.11 H new ATOM 0 HH21 ARG A1208 -9.150 19.189 -14.318 1.00 4.89 H new ATOM 0 HH22 ARG A1208 -7.742 19.463 -15.351 1.00 4.89 H new ATOM 2488 N LYS A1209 -6.138 11.392 -14.462 1.00 1.12 N ATOM 2489 CA LYS A1209 -5.692 10.456 -15.522 1.00 1.24 C ATOM 2490 C LYS A1209 -6.637 9.258 -15.700 1.00 1.42 C ATOM 2491 O LYS A1209 -6.496 8.519 -16.671 1.00 1.60 O ATOM 2492 CB LYS A1209 -4.289 9.926 -15.179 1.00 1.38 C ATOM 2493 CG LYS A1209 -3.114 10.719 -15.751 1.00 1.24 C ATOM 2494 CD LYS A1209 -1.858 10.446 -14.926 1.00 1.35 C ATOM 2495 CE LYS A1209 -0.542 10.589 -15.700 1.00 1.64 C ATOM 2496 NZ LYS A1209 -0.365 11.923 -16.319 1.00 2.18 N ATOM 0 H LYS A1209 -5.509 11.406 -13.659 1.00 1.12 H new ATOM 0 HA LYS A1209 -5.687 11.017 -16.457 1.00 1.24 H new ATOM 0 HB2 LYS A1209 -4.188 9.898 -14.094 1.00 1.38 H new ATOM 0 HB3 LYS A1209 -4.214 8.898 -15.533 1.00 1.38 H new ATOM 0 HG2 LYS A1209 -2.946 10.439 -16.791 1.00 1.24 H new ATOM 0 HG3 LYS A1209 -3.343 11.785 -15.741 1.00 1.24 H new ATOM 0 HD2 LYS A1209 -1.841 11.130 -14.077 1.00 1.35 H new ATOM 0 HD3 LYS A1209 -1.918 9.436 -14.521 1.00 1.35 H new ATOM 0 HE2 LYS A1209 0.291 10.397 -15.024 1.00 1.64 H new ATOM 0 HE3 LYS A1209 -0.503 9.827 -16.479 1.00 1.64 H new ATOM 0 HZ1 LYS A1209 0.578 11.982 -16.754 1.00 2.18 H new ATOM 0 HZ2 LYS A1209 -1.092 12.066 -17.049 1.00 2.18 H new ATOM 0 HZ3 LYS A1209 -0.457 12.659 -15.590 1.00 2.18 H new ATOM 2510 N GLY A1210 -7.564 9.042 -14.766 1.00 1.44 N ATOM 2511 CA GLY A1210 -8.527 7.932 -14.789 1.00 1.61 C ATOM 2512 C GLY A1210 -7.912 6.586 -14.398 1.00 1.41 C ATOM 2513 O GLY A1210 -8.372 5.531 -14.840 1.00 1.47 O ATOM 0 H GLY A1210 -7.671 9.647 -13.952 1.00 1.44 H new ATOM 0 HA2 GLY A1210 -9.348 8.159 -14.109 1.00 1.61 H new ATOM 0 HA3 GLY A1210 -8.954 7.851 -15.789 1.00 1.61 H new ATOM 2517 N ARG A1211 -6.827 6.604 -13.617 1.00 1.24 N ATOM 2518 CA ARG A1211 -6.097 5.422 -13.138 1.00 1.07 C ATOM 2519 C ARG A1211 -6.210 5.316 -11.610 1.00 0.88 C ATOM 2520 O ARG A1211 -6.783 6.195 -10.964 1.00 1.15 O ATOM 2521 CB ARG A1211 -4.649 5.465 -13.674 1.00 1.09 C ATOM 2522 CG ARG A1211 -4.491 5.709 -15.194 1.00 1.54 C ATOM 2523 CD ARG A1211 -4.778 4.518 -16.122 1.00 1.73 C ATOM 2524 NE ARG A1211 -6.131 3.944 -15.975 1.00 3.63 N ATOM 2525 CZ ARG A1211 -6.485 2.713 -16.294 1.00 4.75 C ATOM 2526 NH1 ARG A1211 -5.722 1.899 -16.962 1.00 4.63 N ATOM 2527 NH2 ARG A1211 -7.631 2.231 -15.927 1.00 6.75 N ATOM 0 H ARG A1211 -6.415 7.477 -13.287 1.00 1.24 H new ATOM 0 HA ARG A1211 -6.539 4.504 -13.525 1.00 1.07 H new ATOM 0 HB2 ARG A1211 -4.110 6.250 -13.143 1.00 1.09 H new ATOM 0 HB3 ARG A1211 -4.164 4.521 -13.426 1.00 1.09 H new ATOM 0 HG2 ARG A1211 -5.153 6.527 -15.477 1.00 1.54 H new ATOM 0 HG3 ARG A1211 -3.471 6.046 -15.380 1.00 1.54 H new ATOM 0 HD2 ARG A1211 -4.642 4.837 -17.155 1.00 1.73 H new ATOM 0 HD3 ARG A1211 -4.042 3.737 -15.930 1.00 1.73 H new ATOM 0 HE ARG A1211 -6.855 4.552 -15.593 1.00 3.63 H new ATOM 0 HH11 ARG A1211 -4.797 2.202 -17.268 1.00 4.63 H new ATOM 0 HH12 ARG A1211 -6.048 0.958 -17.180 1.00 4.63 H new ATOM 0 HH21 ARG A1211 -8.275 2.805 -15.383 1.00 6.75 H new ATOM 0 HH22 ARG A1211 -7.889 1.278 -16.182 1.00 6.75 H new ATOM 2541 N THR A1212 -5.737 4.219 -11.025 1.00 0.67 N ATOM 2542 CA THR A1212 -5.894 3.936 -9.589 1.00 0.61 C ATOM 2543 C THR A1212 -4.810 4.630 -8.768 1.00 0.53 C ATOM 2544 O THR A1212 -3.618 4.475 -9.050 1.00 0.56 O ATOM 2545 CB THR A1212 -5.918 2.422 -9.315 1.00 0.70 C ATOM 2546 OG1 THR A1212 -6.967 1.832 -10.062 1.00 0.83 O ATOM 2547 CG2 THR A1212 -6.194 2.086 -7.850 1.00 0.79 C ATOM 0 H THR A1212 -5.230 3.493 -11.531 1.00 0.67 H new ATOM 0 HA THR A1212 -6.857 4.341 -9.277 1.00 0.61 H new ATOM 0 HB THR A1212 -4.933 2.044 -9.590 1.00 0.70 H new ATOM 0 HG1 THR A1212 -6.986 0.867 -9.893 1.00 0.83 H new ATOM 0 HG21 THR A1212 -6.199 1.004 -7.720 1.00 0.79 H new ATOM 0 HG22 THR A1212 -5.417 2.524 -7.224 1.00 0.79 H new ATOM 0 HG23 THR A1212 -7.164 2.490 -7.560 1.00 0.79 H new ATOM 2555 N ALA A1213 -5.228 5.380 -7.750 1.00 0.52 N ATOM 2556 CA ALA A1213 -4.374 6.203 -6.898 1.00 0.52 C ATOM 2557 C ALA A1213 -4.752 5.999 -5.415 1.00 0.56 C ATOM 2558 O ALA A1213 -5.843 6.387 -4.990 1.00 0.69 O ATOM 2559 CB ALA A1213 -4.535 7.654 -7.384 1.00 0.56 C ATOM 0 H ALA A1213 -6.212 5.432 -7.486 1.00 0.52 H new ATOM 0 HA ALA A1213 -3.322 5.925 -6.967 1.00 0.52 H new ATOM 0 HB1 ALA A1213 -3.914 8.312 -6.776 1.00 0.56 H new ATOM 0 HB2 ALA A1213 -4.226 7.725 -8.427 1.00 0.56 H new ATOM 0 HB3 ALA A1213 -5.579 7.954 -7.293 1.00 0.56 H new ATOM 2565 N VAL A1214 -3.880 5.334 -4.644 1.00 0.46 N ATOM 2566 CA VAL A1214 -4.147 4.902 -3.250 1.00 0.46 C ATOM 2567 C VAL A1214 -2.927 5.074 -2.339 1.00 0.37 C ATOM 2568 O VAL A1214 -1.793 5.057 -2.813 1.00 0.39 O ATOM 2569 CB VAL A1214 -4.658 3.445 -3.180 1.00 0.57 C ATOM 2570 CG1 VAL A1214 -5.979 3.260 -3.939 1.00 0.69 C ATOM 2571 CG2 VAL A1214 -3.650 2.414 -3.708 1.00 0.62 C ATOM 0 H VAL A1214 -2.950 5.073 -4.971 1.00 0.46 H new ATOM 0 HA VAL A1214 -4.935 5.560 -2.884 1.00 0.46 H new ATOM 0 HB VAL A1214 -4.810 3.264 -2.116 1.00 0.57 H new ATOM 0 HG11 VAL A1214 -6.300 2.221 -3.863 1.00 0.69 H new ATOM 0 HG12 VAL A1214 -6.741 3.908 -3.506 1.00 0.69 H new ATOM 0 HG13 VAL A1214 -5.835 3.519 -4.988 1.00 0.69 H new ATOM 0 HG21 VAL A1214 -4.077 1.414 -3.628 1.00 0.62 H new ATOM 0 HG22 VAL A1214 -3.423 2.629 -4.752 1.00 0.62 H new ATOM 0 HG23 VAL A1214 -2.734 2.466 -3.119 1.00 0.62 H new ATOM 2581 N LEU A1215 -3.137 5.224 -1.025 1.00 0.39 N ATOM 2582 CA LEU A1215 -2.058 5.420 -0.042 1.00 0.33 C ATOM 2583 C LEU A1215 -1.790 4.175 0.829 1.00 0.33 C ATOM 2584 O LEU A1215 -2.578 3.229 0.820 1.00 0.34 O ATOM 2585 CB LEU A1215 -2.317 6.657 0.835 1.00 0.48 C ATOM 2586 CG LEU A1215 -2.643 7.979 0.120 1.00 0.42 C ATOM 2587 CD1 LEU A1215 -4.155 8.187 -0.026 1.00 0.63 C ATOM 2588 CD2 LEU A1215 -2.107 9.136 0.962 1.00 0.73 C ATOM 0 H LEU A1215 -4.068 5.213 -0.608 1.00 0.39 H new ATOM 0 HA LEU A1215 -1.152 5.589 -0.624 1.00 0.33 H new ATOM 0 HB2 LEU A1215 -3.143 6.426 1.507 1.00 0.48 H new ATOM 0 HB3 LEU A1215 -1.436 6.819 1.456 1.00 0.48 H new ATOM 0 HG LEU A1215 -2.188 7.943 -0.870 1.00 0.42 H new ATOM 0 HD11 LEU A1215 -4.345 9.132 -0.536 1.00 0.63 H new ATOM 0 HD12 LEU A1215 -4.580 7.369 -0.607 1.00 0.63 H new ATOM 0 HD13 LEU A1215 -4.616 8.209 0.961 1.00 0.63 H new ATOM 0 HD21 LEU A1215 -2.331 10.081 0.467 1.00 0.73 H new ATOM 0 HD22 LEU A1215 -2.579 9.120 1.944 1.00 0.73 H new ATOM 0 HD23 LEU A1215 -1.028 9.033 1.076 1.00 0.73 H new ATOM 2600 N VAL A1216 -0.697 4.202 1.606 1.00 0.34 N ATOM 2601 CA VAL A1216 -0.247 3.136 2.524 1.00 0.35 C ATOM 2602 C VAL A1216 0.075 3.705 3.914 1.00 0.35 C ATOM 2603 O VAL A1216 0.845 4.663 4.036 1.00 0.43 O ATOM 2604 CB VAL A1216 1.010 2.419 1.983 1.00 0.54 C ATOM 2605 CG1 VAL A1216 1.283 1.131 2.770 1.00 1.53 C ATOM 2606 CG2 VAL A1216 0.901 2.061 0.497 1.00 1.67 C ATOM 0 H VAL A1216 -0.069 5.006 1.614 1.00 0.34 H new ATOM 0 HA VAL A1216 -1.066 2.420 2.600 1.00 0.35 H new ATOM 0 HB VAL A1216 1.830 3.126 2.107 1.00 0.54 H new ATOM 0 HG11 VAL A1216 2.173 0.643 2.372 1.00 1.53 H new ATOM 0 HG12 VAL A1216 1.442 1.373 3.821 1.00 1.53 H new ATOM 0 HG13 VAL A1216 0.429 0.460 2.678 1.00 1.53 H new ATOM 0 HG21 VAL A1216 1.814 1.560 0.176 1.00 1.67 H new ATOM 0 HG22 VAL A1216 0.050 1.398 0.344 1.00 1.67 H new ATOM 0 HG23 VAL A1216 0.762 2.971 -0.087 1.00 1.67 H new ATOM 2616 N ALA A1217 -0.462 3.093 4.971 1.00 0.37 N ATOM 2617 CA ALA A1217 -0.251 3.504 6.362 1.00 0.39 C ATOM 2618 C ALA A1217 0.282 2.353 7.235 1.00 0.38 C ATOM 2619 O ALA A1217 -0.010 1.182 6.987 1.00 0.45 O ATOM 2620 CB ALA A1217 -1.537 4.096 6.917 1.00 0.52 C ATOM 0 H ALA A1217 -1.070 2.279 4.883 1.00 0.37 H new ATOM 0 HA ALA A1217 0.523 4.272 6.383 1.00 0.39 H new ATOM 0 HB1 ALA A1217 -1.380 4.402 7.951 1.00 0.52 H new ATOM 0 HB2 ALA A1217 -1.825 4.963 6.322 1.00 0.52 H new ATOM 0 HB3 ALA A1217 -2.329 3.348 6.876 1.00 0.52 H new ATOM 2626 N VAL A1218 1.061 2.710 8.258 1.00 0.37 N ATOM 2627 CA VAL A1218 1.876 1.821 9.100 1.00 0.54 C ATOM 2628 C VAL A1218 1.878 2.290 10.571 1.00 0.51 C ATOM 2629 O VAL A1218 2.306 3.400 10.888 1.00 0.52 O ATOM 2630 CB VAL A1218 3.311 1.711 8.532 1.00 0.79 C ATOM 2631 CG1 VAL A1218 3.338 1.022 7.161 1.00 0.83 C ATOM 2632 CG2 VAL A1218 4.012 3.064 8.325 1.00 0.92 C ATOM 0 H VAL A1218 1.147 3.686 8.541 1.00 0.37 H new ATOM 0 HA VAL A1218 1.431 0.826 9.084 1.00 0.54 H new ATOM 0 HB VAL A1218 3.834 1.133 9.294 1.00 0.79 H new ATOM 0 HG11 VAL A1218 4.366 0.967 6.802 1.00 0.83 H new ATOM 0 HG12 VAL A1218 2.931 0.015 7.252 1.00 0.83 H new ATOM 0 HG13 VAL A1218 2.737 1.594 6.454 1.00 0.83 H new ATOM 0 HG21 VAL A1218 5.012 2.898 7.925 1.00 0.92 H new ATOM 0 HG22 VAL A1218 3.436 3.669 7.624 1.00 0.92 H new ATOM 0 HG23 VAL A1218 4.085 3.586 9.279 1.00 0.92 H new ATOM 2642 N ASP A1219 1.359 1.462 11.480 1.00 0.54 N ATOM 2643 CA ASP A1219 1.131 1.752 12.909 1.00 0.54 C ATOM 2644 C ASP A1219 0.480 3.138 13.144 1.00 0.54 C ATOM 2645 O ASP A1219 0.964 3.981 13.905 1.00 0.66 O ATOM 2646 CB ASP A1219 2.391 1.451 13.741 1.00 0.68 C ATOM 2647 CG ASP A1219 2.622 -0.051 13.950 1.00 1.54 C ATOM 2648 OD1 ASP A1219 3.147 -0.736 13.046 1.00 2.85 O ATOM 2649 OD2 ASP A1219 2.303 -0.558 15.053 1.00 2.37 O ATOM 0 H ASP A1219 1.068 0.517 11.231 1.00 0.54 H new ATOM 0 HA ASP A1219 0.375 1.064 13.287 1.00 0.54 H new ATOM 0 HB2 ASP A1219 3.260 1.882 13.244 1.00 0.68 H new ATOM 0 HB3 ASP A1219 2.305 1.939 14.712 1.00 0.68 H new ATOM 2654 N ASP A1220 -0.655 3.362 12.469 1.00 0.58 N ATOM 2655 CA ASP A1220 -1.470 4.592 12.510 1.00 0.74 C ATOM 2656 C ASP A1220 -0.708 5.869 12.083 1.00 0.76 C ATOM 2657 O ASP A1220 -0.930 6.965 12.608 1.00 0.87 O ATOM 2658 CB ASP A1220 -2.218 4.729 13.855 1.00 0.85 C ATOM 2659 CG ASP A1220 -2.927 3.440 14.282 1.00 0.86 C ATOM 2660 OD1 ASP A1220 -4.086 3.212 13.861 1.00 1.52 O ATOM 2661 OD2 ASP A1220 -2.323 2.630 15.024 1.00 1.51 O ATOM 0 H ASP A1220 -1.053 2.658 11.848 1.00 0.58 H new ATOM 0 HA ASP A1220 -2.233 4.482 11.739 1.00 0.74 H new ATOM 0 HB2 ASP A1220 -1.509 5.021 14.630 1.00 0.85 H new ATOM 0 HB3 ASP A1220 -2.952 5.531 13.776 1.00 0.85 H new ATOM 2666 N GLU A1221 0.227 5.730 11.141 1.00 0.66 N ATOM 2667 CA GLU A1221 1.047 6.809 10.576 1.00 0.62 C ATOM 2668 C GLU A1221 1.216 6.600 9.056 1.00 0.44 C ATOM 2669 O GLU A1221 1.295 5.465 8.595 1.00 0.44 O ATOM 2670 CB GLU A1221 2.404 6.822 11.312 1.00 0.83 C ATOM 2671 CG GLU A1221 2.896 8.216 11.710 1.00 1.44 C ATOM 2672 CD GLU A1221 3.249 9.068 10.497 1.00 1.33 C ATOM 2673 OE1 GLU A1221 2.364 9.768 9.950 1.00 2.16 O ATOM 2674 OE2 GLU A1221 4.417 9.077 10.056 1.00 2.69 O ATOM 0 H GLU A1221 0.445 4.822 10.731 1.00 0.66 H new ATOM 0 HA GLU A1221 0.564 7.776 10.714 1.00 0.62 H new ATOM 0 HB2 GLU A1221 2.322 6.209 12.210 1.00 0.83 H new ATOM 0 HB3 GLU A1221 3.154 6.354 10.674 1.00 0.83 H new ATOM 0 HG2 GLU A1221 2.125 8.719 12.294 1.00 1.44 H new ATOM 0 HG3 GLU A1221 3.771 8.121 12.353 1.00 1.44 H new ATOM 2681 N LEU A1222 1.264 7.656 8.239 1.00 0.40 N ATOM 2682 CA LEU A1222 1.509 7.516 6.793 1.00 0.38 C ATOM 2683 C LEU A1222 2.982 7.212 6.478 1.00 0.50 C ATOM 2684 O LEU A1222 3.867 7.755 7.137 1.00 0.78 O ATOM 2685 CB LEU A1222 1.020 8.772 6.044 1.00 0.42 C ATOM 2686 CG LEU A1222 -0.204 8.462 5.167 1.00 0.43 C ATOM 2687 CD1 LEU A1222 -1.068 9.693 4.928 1.00 0.54 C ATOM 2688 CD2 LEU A1222 0.217 7.899 3.811 1.00 0.47 C ATOM 0 H LEU A1222 1.137 8.619 8.550 1.00 0.40 H new ATOM 0 HA LEU A1222 0.936 6.658 6.442 1.00 0.38 H new ATOM 0 HB2 LEU A1222 0.766 9.550 6.763 1.00 0.42 H new ATOM 0 HB3 LEU A1222 1.825 9.163 5.422 1.00 0.42 H new ATOM 0 HG LEU A1222 -0.787 7.721 5.715 1.00 0.43 H new ATOM 0 HD11 LEU A1222 -1.920 9.424 4.304 1.00 0.54 H new ATOM 0 HD12 LEU A1222 -1.425 10.078 5.883 1.00 0.54 H new ATOM 0 HD13 LEU A1222 -0.478 10.460 4.426 1.00 0.54 H new ATOM 0 HD21 LEU A1222 -0.670 7.689 3.213 1.00 0.47 H new ATOM 0 HD22 LEU A1222 0.841 8.627 3.292 1.00 0.47 H new ATOM 0 HD23 LEU A1222 0.781 6.978 3.959 1.00 0.47 H new ATOM 2700 N CYS A1223 3.235 6.419 5.427 1.00 0.43 N ATOM 2701 CA CYS A1223 4.580 6.188 4.871 1.00 0.51 C ATOM 2702 C CYS A1223 4.695 6.576 3.381 1.00 0.57 C ATOM 2703 O CYS A1223 5.660 7.244 3.004 1.00 0.75 O ATOM 2704 CB CYS A1223 5.027 4.731 5.115 1.00 0.53 C ATOM 2705 SG CYS A1223 3.856 3.532 4.412 1.00 0.55 S ATOM 0 H CYS A1223 2.502 5.912 4.931 1.00 0.43 H new ATOM 0 HA CYS A1223 5.260 6.853 5.404 1.00 0.51 H new ATOM 0 HB2 CYS A1223 6.012 4.576 4.675 1.00 0.53 H new ATOM 0 HB3 CYS A1223 5.125 4.557 6.186 1.00 0.53 H new ATOM 0 HG CYS A1223 2.688 4.089 4.285 1.00 0.55 H new ATOM 2711 N GLY A1224 3.720 6.217 2.531 1.00 0.46 N ATOM 2712 CA GLY A1224 3.785 6.452 1.081 1.00 0.51 C ATOM 2713 C GLY A1224 2.484 6.159 0.321 1.00 0.39 C ATOM 2714 O GLY A1224 1.428 5.973 0.926 1.00 0.36 O ATOM 0 H GLY A1224 2.862 5.754 2.832 1.00 0.46 H new ATOM 0 HA2 GLY A1224 4.064 7.491 0.908 1.00 0.51 H new ATOM 0 HA3 GLY A1224 4.580 5.835 0.663 1.00 0.51 H new ATOM 2718 N LEU A1225 2.560 6.159 -1.012 1.00 0.41 N ATOM 2719 CA LEU A1225 1.447 5.911 -1.932 1.00 0.41 C ATOM 2720 C LEU A1225 1.835 5.126 -3.199 1.00 0.44 C ATOM 2721 O LEU A1225 3.006 5.062 -3.579 1.00 0.47 O ATOM 2722 CB LEU A1225 0.736 7.233 -2.261 1.00 0.54 C ATOM 2723 CG LEU A1225 1.497 8.225 -3.164 1.00 0.69 C ATOM 2724 CD1 LEU A1225 0.452 9.194 -3.713 1.00 1.03 C ATOM 2725 CD2 LEU A1225 2.584 9.022 -2.430 1.00 0.60 C ATOM 0 H LEU A1225 3.437 6.340 -1.501 1.00 0.41 H new ATOM 0 HA LEU A1225 0.751 5.252 -1.414 1.00 0.41 H new ATOM 0 HB2 LEU A1225 -0.214 6.998 -2.740 1.00 0.54 H new ATOM 0 HB3 LEU A1225 0.504 7.737 -1.323 1.00 0.54 H new ATOM 0 HG LEU A1225 2.015 7.662 -3.941 1.00 0.69 H new ATOM 0 HD11 LEU A1225 0.937 9.923 -4.362 1.00 1.03 H new ATOM 0 HD12 LEU A1225 -0.294 8.640 -4.283 1.00 1.03 H new ATOM 0 HD13 LEU A1225 -0.034 9.712 -2.886 1.00 1.03 H new ATOM 0 HD21 LEU A1225 3.075 9.698 -3.130 1.00 0.60 H new ATOM 0 HD22 LEU A1225 2.130 9.600 -1.625 1.00 0.60 H new ATOM 0 HD23 LEU A1225 3.320 8.335 -2.013 1.00 0.60 H new ATOM 2737 N ILE A1226 0.827 4.546 -3.855 1.00 0.44 N ATOM 2738 CA ILE A1226 0.953 3.629 -4.995 1.00 0.45 C ATOM 2739 C ILE A1226 0.047 4.079 -6.157 1.00 0.43 C ATOM 2740 O ILE A1226 -1.135 4.383 -5.964 1.00 0.42 O ATOM 2741 CB ILE A1226 0.613 2.180 -4.558 1.00 0.49 C ATOM 2742 CG1 ILE A1226 1.316 1.699 -3.262 1.00 0.54 C ATOM 2743 CG2 ILE A1226 0.898 1.190 -5.699 1.00 0.54 C ATOM 2744 CD1 ILE A1226 2.835 1.516 -3.343 1.00 0.71 C ATOM 0 H ILE A1226 -0.146 4.709 -3.595 1.00 0.44 H new ATOM 0 HA ILE A1226 1.985 3.649 -5.346 1.00 0.45 H new ATOM 0 HB ILE A1226 -0.451 2.205 -4.324 1.00 0.49 H new ATOM 0 HG12 ILE A1226 1.099 2.415 -2.469 1.00 0.54 H new ATOM 0 HG13 ILE A1226 0.872 0.749 -2.964 1.00 0.54 H new ATOM 0 HG21 ILE A1226 0.653 0.179 -5.373 1.00 0.54 H new ATOM 0 HG22 ILE A1226 0.290 1.449 -6.566 1.00 0.54 H new ATOM 0 HG23 ILE A1226 1.953 1.239 -5.968 1.00 0.54 H new ATOM 0 HD11 ILE A1226 3.213 1.178 -2.378 1.00 0.71 H new ATOM 0 HD12 ILE A1226 3.072 0.774 -4.106 1.00 0.71 H new ATOM 0 HD13 ILE A1226 3.303 2.466 -3.603 1.00 0.71 H new ATOM 2756 N ALA A1227 0.595 4.065 -7.373 1.00 0.45 N ATOM 2757 CA ALA A1227 -0.096 4.322 -8.637 1.00 0.44 C ATOM 2758 C ALA A1227 -0.192 3.024 -9.465 1.00 0.45 C ATOM 2759 O ALA A1227 0.823 2.368 -9.718 1.00 0.45 O ATOM 2760 CB ALA A1227 0.664 5.424 -9.385 1.00 0.48 C ATOM 0 H ALA A1227 1.585 3.863 -7.510 1.00 0.45 H new ATOM 0 HA ALA A1227 -1.117 4.658 -8.456 1.00 0.44 H new ATOM 0 HB1 ALA A1227 0.165 5.632 -10.332 1.00 0.48 H new ATOM 0 HB2 ALA A1227 0.682 6.329 -8.778 1.00 0.48 H new ATOM 0 HB3 ALA A1227 1.685 5.095 -9.577 1.00 0.48 H new ATOM 2766 N ILE A1228 -1.401 2.646 -9.895 1.00 0.53 N ATOM 2767 CA ILE A1228 -1.694 1.408 -10.653 1.00 0.53 C ATOM 2768 C ILE A1228 -2.635 1.721 -11.831 1.00 0.68 C ATOM 2769 O ILE A1228 -3.390 2.692 -11.773 1.00 0.89 O ATOM 2770 CB ILE A1228 -2.280 0.308 -9.711 1.00 0.63 C ATOM 2771 CG1 ILE A1228 -1.452 0.209 -8.408 1.00 0.84 C ATOM 2772 CG2 ILE A1228 -2.381 -1.070 -10.388 1.00 1.08 C ATOM 2773 CD1 ILE A1228 -1.576 -1.069 -7.567 1.00 1.57 C ATOM 0 H ILE A1228 -2.235 3.207 -9.723 1.00 0.53 H new ATOM 0 HA ILE A1228 -0.765 1.013 -11.065 1.00 0.53 H new ATOM 0 HB ILE A1228 -3.297 0.616 -9.469 1.00 0.63 H new ATOM 0 HG12 ILE A1228 -0.402 0.335 -8.670 1.00 0.84 H new ATOM 0 HG13 ILE A1228 -1.725 1.053 -7.774 1.00 0.84 H new ATOM 0 HG21 ILE A1228 -2.795 -1.792 -9.684 1.00 1.08 H new ATOM 0 HG22 ILE A1228 -3.031 -1.000 -11.260 1.00 1.08 H new ATOM 0 HG23 ILE A1228 -1.389 -1.396 -10.700 1.00 1.08 H new ATOM 0 HD11 ILE A1228 -0.937 -0.989 -6.687 1.00 1.57 H new ATOM 0 HD12 ILE A1228 -2.612 -1.199 -7.253 1.00 1.57 H new ATOM 0 HD13 ILE A1228 -1.267 -1.928 -8.163 1.00 1.57 H new ATOM 2785 N ALA A1229 -2.592 0.913 -12.894 1.00 0.70 N ATOM 2786 CA ALA A1229 -3.481 0.999 -14.056 1.00 0.91 C ATOM 2787 C ALA A1229 -4.264 -0.314 -14.265 1.00 1.04 C ATOM 2788 O ALA A1229 -3.661 -1.371 -14.433 1.00 1.42 O ATOM 2789 CB ALA A1229 -2.609 1.342 -15.269 1.00 0.98 C ATOM 0 H ALA A1229 -1.914 0.155 -12.972 1.00 0.70 H new ATOM 0 HA ALA A1229 -4.234 1.772 -13.905 1.00 0.91 H new ATOM 0 HB1 ALA A1229 -3.235 1.415 -16.158 1.00 0.98 H new ATOM 0 HB2 ALA A1229 -2.107 2.295 -15.099 1.00 0.98 H new ATOM 0 HB3 ALA A1229 -1.863 0.560 -15.414 1.00 0.98 H new