USER MOD reduce.3.24.130724 H: found=0, std=0, add=967, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 965 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A1108 CYS SG : rot 96:sc= 0.0869 USER MOD Set 1.2: A1125 ASN : amide:sc= 0.0645 K(o=0.15,f=-3.2!) USER MOD Set 2.1: A1079 THR OG1 : rot 151:sc= 0.605 USER MOD Set 2.2: A1107 THR OG1 : rot 31:sc= 1.31 USER MOD Set 3.1: A1083 ASN : amide:sc= 0.752 X(o=0.75,f=0.27) USER MOD Set 3.2: A1084 SER OG : rot 180:sc= 0 USER MOD Set 4.1: A1065 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A1069 SER OG : rot 180:sc= 0 USER MOD Single : A1057 ASN : amide:sc= -1.27 X(o=-1.3,f=-1.4) USER MOD Single : A1058 GLN : amide:sc= -0.135 K(o=-0.13,f=-5.4!) USER MOD Single : A1060 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1063 THR OG1 : rot -114:sc= 0.206 USER MOD Single : A1066 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1070 HIS : no HD1:sc= -0.385 X(o=-0.38,f=0.0033) USER MOD Single : A1071 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A1072 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1082 SER OG : rot -48:sc= 0.0137 USER MOD Single : A1086 HIS : no HE2:sc= 0.973 K(o=0.97,f=-3!) USER MOD Single : A1090 THR OG1 : rot 180:sc= 0 USER MOD Single : A1093 THR OG1 : rot 180:sc= 0 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 -150:sc= 0.562 USER MOD Single : A1097 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1098 GLN : amide:sc=-0.00224 K(o=-0.0022,f=-1.8!) USER MOD Single : A1102 THR OG1 : rot 180:sc= 0 USER MOD Single : A1104 THR OG1 : rot 180:sc= 0 USER MOD Single : A1112 GLN : amide:sc= 0.621 K(o=0.62,f=0) USER MOD Single : A1117 CYS SG : rot 180:sc= 0 USER MOD Single : A1120 SER OG : rot 180:sc= 0 USER MOD Single : A1121 CYS SG : rot 180:sc= -0.0707 USER MOD Single : A1122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1124 THR OG1 : rot 180:sc= 0.145 USER MOD Single : A1177 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1178 TYR OH : rot 180:sc= 0 USER MOD Single : A1179 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.000578) USER MOD Single : A1184 ASN : amide:sc= -0.114 K(o=-0.11,f=-1.6) USER MOD Single : A1188 MET CE :methyl -177:sc= -0.725 (180deg=-0.769) USER MOD Single : A1191 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1196 ASN : amide:sc= -0.149 X(o=-0.15,f=0) USER MOD Single : A1197 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1200 ASN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : A1203 MET CE :methyl -145:sc= -0.0129 (180deg=-0.244) USER MOD Single : A1204 THR OG1 : rot 180:sc= 0 USER MOD Single : A1206 HIS : no HD1:sc= 0.0281 X(o=0.028,f=-0.27) USER MOD Single : A1209 LYS NZ :NH3+ -164:sc= 1.14 (180deg=0.939) USER MOD Single : A1212 THR OG1 : rot 180:sc= 0 USER MOD Single : A1223 CYS SG : rot 150:sc= -0.738 USER MOD ----------------------------------------------------------------- ATOM 117 N VAL A1055 5.220 -0.660 13.906 1.00 1.71 N ATOM 118 CA VAL A1055 6.084 0.273 13.163 1.00 2.00 C ATOM 119 C VAL A1055 6.080 -0.094 11.673 1.00 1.67 C ATOM 120 O VAL A1055 6.446 -1.214 11.308 1.00 1.90 O ATOM 121 CB VAL A1055 7.531 0.240 13.716 1.00 2.70 C ATOM 122 CG1 VAL A1055 8.459 1.212 12.975 1.00 3.94 C ATOM 123 CG2 VAL A1055 7.595 0.606 15.206 1.00 3.11 C ATOM 0 HA VAL A1055 5.694 1.283 13.287 1.00 2.00 H new ATOM 0 HB VAL A1055 7.862 -0.788 13.566 1.00 2.70 H new ATOM 0 HG11 VAL A1055 9.461 1.152 13.399 1.00 3.94 H new ATOM 0 HG12 VAL A1055 8.495 0.946 11.918 1.00 3.94 H new ATOM 0 HG13 VAL A1055 8.080 2.229 13.081 1.00 3.94 H new ATOM 0 HG21 VAL A1055 8.630 0.568 15.546 1.00 3.11 H new ATOM 0 HG22 VAL A1055 7.202 1.612 15.351 1.00 3.11 H new ATOM 0 HG23 VAL A1055 6.999 -0.103 15.781 1.00 3.11 H new ATOM 133 N VAL A1056 5.699 0.836 10.789 1.00 1.36 N ATOM 134 CA VAL A1056 5.901 0.672 9.338 1.00 1.23 C ATOM 135 C VAL A1056 7.374 0.951 9.053 1.00 1.12 C ATOM 136 O VAL A1056 7.883 2.046 9.308 1.00 1.28 O ATOM 137 CB VAL A1056 4.909 1.484 8.475 1.00 1.27 C ATOM 138 CG1 VAL A1056 4.795 2.971 8.825 1.00 1.69 C ATOM 139 CG2 VAL A1056 5.247 1.350 6.984 1.00 1.56 C ATOM 0 H VAL A1056 5.248 1.713 11.050 1.00 1.36 H new ATOM 0 HA VAL A1056 5.669 -0.350 9.040 1.00 1.23 H new ATOM 0 HB VAL A1056 3.938 1.043 8.702 1.00 1.27 H new ATOM 0 HG11 VAL A1056 4.074 3.447 8.161 1.00 1.69 H new ATOM 0 HG12 VAL A1056 4.462 3.077 9.858 1.00 1.69 H new ATOM 0 HG13 VAL A1056 5.768 3.448 8.706 1.00 1.69 H new ATOM 0 HG21 VAL A1056 4.536 1.930 6.396 1.00 1.56 H new ATOM 0 HG22 VAL A1056 6.255 1.723 6.805 1.00 1.56 H new ATOM 0 HG23 VAL A1056 5.191 0.302 6.691 1.00 1.56 H new ATOM 149 N ASN A1057 8.093 -0.072 8.589 1.00 1.07 N ATOM 150 CA ASN A1057 9.547 -0.043 8.504 1.00 1.06 C ATOM 151 C ASN A1057 10.045 0.601 7.200 1.00 0.95 C ATOM 152 O ASN A1057 10.997 1.380 7.256 1.00 1.01 O ATOM 153 CB ASN A1057 10.089 -1.436 8.884 1.00 1.07 C ATOM 154 CG ASN A1057 10.355 -2.371 7.726 1.00 1.69 C ATOM 155 OD1 ASN A1057 9.757 -3.424 7.593 1.00 3.15 O ATOM 156 ND2 ASN A1057 11.320 -2.070 6.894 1.00 1.71 N ATOM 0 H ASN A1057 7.679 -0.945 8.262 1.00 1.07 H new ATOM 0 HA ASN A1057 9.982 0.637 9.237 1.00 1.06 H new ATOM 0 HB2 ASN A1057 11.016 -1.306 9.443 1.00 1.07 H new ATOM 0 HB3 ASN A1057 9.376 -1.913 9.556 1.00 1.07 H new ATOM 0 HD21 ASN A1057 11.565 -2.715 6.143 1.00 1.71 H new ATOM 0 HD22 ASN A1057 11.827 -1.191 6.997 1.00 1.71 H new ATOM 163 N GLN A1058 9.403 0.323 6.057 1.00 0.87 N ATOM 164 CA GLN A1058 9.717 0.994 4.787 1.00 0.86 C ATOM 165 C GLN A1058 8.554 0.960 3.782 1.00 0.87 C ATOM 166 O GLN A1058 7.851 -0.046 3.665 1.00 0.82 O ATOM 167 CB GLN A1058 10.990 0.362 4.176 1.00 0.79 C ATOM 168 CG GLN A1058 11.464 0.949 2.832 1.00 1.78 C ATOM 169 CD GLN A1058 11.843 2.431 2.884 1.00 2.81 C ATOM 170 OE1 GLN A1058 11.091 3.291 3.333 1.00 4.38 O ATOM 171 NE2 GLN A1058 13.015 2.797 2.426 1.00 3.01 N ATOM 0 H GLN A1058 8.656 -0.368 5.986 1.00 0.87 H new ATOM 0 HA GLN A1058 9.892 2.047 5.007 1.00 0.86 H new ATOM 0 HB2 GLN A1058 11.801 0.460 4.898 1.00 0.79 H new ATOM 0 HB3 GLN A1058 10.811 -0.705 4.040 1.00 0.79 H new ATOM 0 HG2 GLN A1058 12.326 0.379 2.485 1.00 1.78 H new ATOM 0 HG3 GLN A1058 10.674 0.815 2.093 1.00 1.78 H new ATOM 0 HE21 GLN A1058 13.656 2.099 2.048 1.00 3.01 H new ATOM 0 HE22 GLN A1058 13.287 3.780 2.447 1.00 3.01 H new ATOM 180 N VAL A1059 8.405 2.045 3.011 1.00 0.97 N ATOM 181 CA VAL A1059 7.517 2.168 1.841 1.00 0.97 C ATOM 182 C VAL A1059 8.273 2.775 0.652 1.00 1.04 C ATOM 183 O VAL A1059 9.032 3.731 0.831 1.00 1.24 O ATOM 184 CB VAL A1059 6.252 3.002 2.149 1.00 1.10 C ATOM 185 CG1 VAL A1059 5.362 2.287 3.168 1.00 1.14 C ATOM 186 CG2 VAL A1059 6.528 4.415 2.686 1.00 1.38 C ATOM 0 H VAL A1059 8.924 2.904 3.193 1.00 0.97 H new ATOM 0 HA VAL A1059 7.189 1.161 1.583 1.00 0.97 H new ATOM 0 HB VAL A1059 5.759 3.105 1.182 1.00 1.10 H new ATOM 0 HG11 VAL A1059 4.479 2.893 3.368 1.00 1.14 H new ATOM 0 HG12 VAL A1059 5.056 1.320 2.768 1.00 1.14 H new ATOM 0 HG13 VAL A1059 5.917 2.137 4.094 1.00 1.14 H new ATOM 0 HG21 VAL A1059 5.583 4.924 2.873 1.00 1.38 H new ATOM 0 HG22 VAL A1059 7.094 4.347 3.615 1.00 1.38 H new ATOM 0 HG23 VAL A1059 7.104 4.977 1.951 1.00 1.38 H new ATOM 196 N LYS A1060 8.081 2.243 -0.563 1.00 0.93 N ATOM 197 CA LYS A1060 8.766 2.709 -1.794 1.00 1.05 C ATOM 198 C LYS A1060 7.833 2.757 -3.004 1.00 0.95 C ATOM 199 O LYS A1060 7.005 1.860 -3.177 1.00 0.78 O ATOM 200 CB LYS A1060 9.987 1.834 -2.145 1.00 1.14 C ATOM 201 CG LYS A1060 11.008 1.674 -1.006 1.00 1.70 C ATOM 202 CD LYS A1060 12.205 0.793 -1.390 1.00 1.63 C ATOM 203 CE LYS A1060 13.039 1.388 -2.530 1.00 1.50 C ATOM 204 NZ LYS A1060 14.164 0.495 -2.879 1.00 1.61 N ATOM 0 H LYS A1060 7.440 1.467 -0.729 1.00 0.93 H new ATOM 0 HA LYS A1060 9.100 3.722 -1.568 1.00 1.05 H new ATOM 0 HB2 LYS A1060 9.636 0.846 -2.442 1.00 1.14 H new ATOM 0 HB3 LYS A1060 10.491 2.266 -3.009 1.00 1.14 H new ATOM 0 HG2 LYS A1060 11.369 2.659 -0.709 1.00 1.70 H new ATOM 0 HG3 LYS A1060 10.510 1.242 -0.138 1.00 1.70 H new ATOM 0 HD2 LYS A1060 12.841 0.651 -0.516 1.00 1.63 H new ATOM 0 HD3 LYS A1060 11.845 -0.193 -1.685 1.00 1.63 H new ATOM 0 HE2 LYS A1060 12.408 1.544 -3.405 1.00 1.50 H new ATOM 0 HE3 LYS A1060 13.422 2.365 -2.235 1.00 1.50 H new ATOM 0 HZ1 LYS A1060 14.715 0.917 -3.653 1.00 1.61 H new ATOM 0 HZ2 LYS A1060 14.776 0.367 -2.048 1.00 1.61 H new ATOM 0 HZ3 LYS A1060 13.793 -0.428 -3.182 1.00 1.61 H new ATOM 218 N VAL A1061 8.007 3.761 -3.866 1.00 1.06 N ATOM 219 CA VAL A1061 7.285 3.914 -5.141 1.00 0.88 C ATOM 220 C VAL A1061 7.899 3.027 -6.233 1.00 0.83 C ATOM 221 O VAL A1061 9.115 2.992 -6.430 1.00 1.05 O ATOM 222 CB VAL A1061 7.233 5.399 -5.568 1.00 0.91 C ATOM 223 CG1 VAL A1061 6.541 5.601 -6.923 1.00 0.71 C ATOM 224 CG2 VAL A1061 6.464 6.234 -4.534 1.00 1.29 C ATOM 0 H VAL A1061 8.673 4.515 -3.696 1.00 1.06 H new ATOM 0 HA VAL A1061 6.258 3.580 -4.995 1.00 0.88 H new ATOM 0 HB VAL A1061 8.271 5.721 -5.644 1.00 0.91 H new ATOM 0 HG11 VAL A1061 6.533 6.662 -7.173 1.00 0.71 H new ATOM 0 HG12 VAL A1061 7.082 5.051 -7.693 1.00 0.71 H new ATOM 0 HG13 VAL A1061 5.516 5.234 -6.867 1.00 0.71 H new ATOM 0 HG21 VAL A1061 6.439 7.276 -4.854 1.00 1.29 H new ATOM 0 HG22 VAL A1061 5.445 5.857 -4.447 1.00 1.29 H new ATOM 0 HG23 VAL A1061 6.961 6.163 -3.567 1.00 1.29 H new ATOM 234 N LEU A1062 7.027 2.329 -6.962 1.00 0.76 N ATOM 235 CA LEU A1062 7.369 1.361 -8.018 1.00 0.76 C ATOM 236 C LEU A1062 6.645 1.640 -9.351 1.00 0.80 C ATOM 237 O LEU A1062 6.278 0.729 -10.095 1.00 1.41 O ATOM 238 CB LEU A1062 7.228 -0.069 -7.456 1.00 0.89 C ATOM 239 CG LEU A1062 7.823 -1.202 -8.320 1.00 0.83 C ATOM 240 CD1 LEU A1062 9.233 -0.919 -8.843 1.00 1.61 C ATOM 241 CD2 LEU A1062 7.900 -2.479 -7.489 1.00 1.47 C ATOM 0 H LEU A1062 6.020 2.423 -6.831 1.00 0.76 H new ATOM 0 HA LEU A1062 8.414 1.478 -8.304 1.00 0.76 H new ATOM 0 HB2 LEU A1062 7.703 -0.100 -6.475 1.00 0.89 H new ATOM 0 HB3 LEU A1062 6.168 -0.274 -7.304 1.00 0.89 H new ATOM 0 HG LEU A1062 7.161 -1.294 -9.181 1.00 0.83 H new ATOM 0 HD11 LEU A1062 9.576 -1.764 -9.440 1.00 1.61 H new ATOM 0 HD12 LEU A1062 9.219 -0.021 -9.460 1.00 1.61 H new ATOM 0 HD13 LEU A1062 9.910 -0.770 -8.002 1.00 1.61 H new ATOM 0 HD21 LEU A1062 8.320 -3.282 -8.095 1.00 1.47 H new ATOM 0 HD22 LEU A1062 8.536 -2.310 -6.620 1.00 1.47 H new ATOM 0 HD23 LEU A1062 6.900 -2.759 -7.158 1.00 1.47 H new ATOM 253 N THR A1063 6.426 2.922 -9.641 1.00 0.64 N ATOM 254 CA THR A1063 5.947 3.452 -10.925 1.00 0.63 C ATOM 255 C THR A1063 6.702 4.758 -11.257 1.00 0.68 C ATOM 256 O THR A1063 7.747 5.048 -10.676 1.00 1.65 O ATOM 257 CB THR A1063 4.422 3.643 -10.857 1.00 0.70 C ATOM 258 OG1 THR A1063 3.866 3.857 -12.131 1.00 0.97 O ATOM 259 CG2 THR A1063 3.928 4.754 -9.934 1.00 0.68 C ATOM 0 H THR A1063 6.585 3.659 -8.954 1.00 0.64 H new ATOM 0 HA THR A1063 6.150 2.751 -11.734 1.00 0.63 H new ATOM 0 HB THR A1063 4.083 2.701 -10.426 1.00 0.70 H new ATOM 0 HG1 THR A1063 3.502 4.765 -12.181 1.00 0.97 H new ATOM 0 HG21 THR A1063 2.839 4.797 -9.966 1.00 0.68 H new ATOM 0 HG22 THR A1063 4.253 4.551 -8.914 1.00 0.68 H new ATOM 0 HG23 THR A1063 4.338 5.709 -10.262 1.00 0.68 H new ATOM 267 N GLU A1064 6.170 5.570 -12.164 1.00 1.67 N ATOM 268 CA GLU A1064 6.622 6.921 -12.523 1.00 1.95 C ATOM 269 C GLU A1064 5.392 7.824 -12.718 1.00 2.31 C ATOM 270 O GLU A1064 4.291 7.321 -12.943 1.00 3.51 O ATOM 271 CB GLU A1064 7.521 6.780 -13.777 1.00 2.55 C ATOM 272 CG GLU A1064 7.645 7.963 -14.748 1.00 4.36 C ATOM 273 CD GLU A1064 8.268 9.238 -14.170 1.00 5.05 C ATOM 274 OE1 GLU A1064 8.812 9.220 -13.039 1.00 4.85 O ATOM 275 OE2 GLU A1064 8.138 10.289 -14.847 1.00 6.63 O ATOM 0 H GLU A1064 5.355 5.288 -12.709 1.00 1.67 H new ATOM 0 HA GLU A1064 7.216 7.398 -11.744 1.00 1.95 H new ATOM 0 HB2 GLU A1064 8.525 6.531 -13.434 1.00 2.55 H new ATOM 0 HB3 GLU A1064 7.157 5.925 -14.347 1.00 2.55 H new ATOM 0 HG2 GLU A1064 8.241 7.645 -15.603 1.00 4.36 H new ATOM 0 HG3 GLU A1064 6.651 8.205 -15.124 1.00 4.36 H new ATOM 282 N SER A1065 5.560 9.150 -12.653 1.00 2.25 N ATOM 283 CA SER A1065 4.480 10.163 -12.659 1.00 2.76 C ATOM 284 C SER A1065 3.536 10.170 -13.886 1.00 2.60 C ATOM 285 O SER A1065 2.614 10.987 -13.946 1.00 3.22 O ATOM 286 CB SER A1065 5.083 11.561 -12.453 1.00 3.79 C ATOM 287 OG SER A1065 5.798 11.634 -11.228 1.00 4.20 O ATOM 0 H SER A1065 6.487 9.571 -12.592 1.00 2.25 H new ATOM 0 HA SER A1065 3.833 9.872 -11.832 1.00 2.76 H new ATOM 0 HB2 SER A1065 5.750 11.798 -13.282 1.00 3.79 H new ATOM 0 HB3 SER A1065 4.289 12.308 -12.459 1.00 3.79 H new ATOM 0 HG SER A1065 6.173 12.533 -11.121 1.00 4.20 H new ATOM 293 N ASN A1066 3.726 9.244 -14.835 1.00 2.24 N ATOM 294 CA ASN A1066 2.884 8.970 -15.999 1.00 2.28 C ATOM 295 C ASN A1066 1.384 8.892 -15.652 1.00 2.04 C ATOM 296 O ASN A1066 0.625 9.747 -16.111 1.00 2.31 O ATOM 297 CB ASN A1066 3.391 7.669 -16.650 1.00 2.51 C ATOM 298 CG ASN A1066 2.537 7.235 -17.828 1.00 3.41 C ATOM 299 OD1 ASN A1066 2.319 7.984 -18.776 1.00 4.23 O ATOM 300 ND2 ASN A1066 1.997 6.040 -17.806 1.00 4.06 N ATOM 0 H ASN A1066 4.534 8.622 -14.803 1.00 2.24 H new ATOM 0 HA ASN A1066 2.964 9.800 -16.701 1.00 2.28 H new ATOM 0 HB2 ASN A1066 4.419 7.811 -16.984 1.00 2.51 H new ATOM 0 HB3 ASN A1066 3.405 6.875 -15.904 1.00 2.51 H new ATOM 0 HD21 ASN A1066 1.399 5.736 -18.574 1.00 4.06 H new ATOM 0 HD22 ASN A1066 2.175 5.414 -17.021 1.00 4.06 H new ATOM 307 N ARG A1067 0.956 7.910 -14.839 1.00 1.72 N ATOM 308 CA ARG A1067 -0.438 7.781 -14.379 1.00 1.54 C ATOM 309 C ARG A1067 -0.647 8.449 -13.018 1.00 1.37 C ATOM 310 O ARG A1067 -1.558 9.266 -12.891 1.00 1.53 O ATOM 311 CB ARG A1067 -0.870 6.297 -14.353 1.00 1.46 C ATOM 312 CG ARG A1067 -2.398 6.132 -14.250 1.00 2.60 C ATOM 313 CD ARG A1067 -3.091 6.333 -15.608 1.00 3.86 C ATOM 314 NE ARG A1067 -4.559 6.383 -15.483 1.00 5.13 N ATOM 315 CZ ARG A1067 -5.385 5.373 -15.274 1.00 5.89 C ATOM 316 NH1 ARG A1067 -4.996 4.136 -15.169 1.00 5.80 N ATOM 317 NH2 ARG A1067 -6.657 5.571 -15.151 1.00 7.27 N ATOM 0 H ARG A1067 1.571 7.179 -14.481 1.00 1.72 H new ATOM 0 HA ARG A1067 -1.074 8.305 -15.092 1.00 1.54 H new ATOM 0 HB2 ARG A1067 -0.514 5.802 -15.256 1.00 1.46 H new ATOM 0 HB3 ARG A1067 -0.396 5.798 -13.508 1.00 1.46 H new ATOM 0 HG2 ARG A1067 -2.631 5.138 -13.868 1.00 2.60 H new ATOM 0 HG3 ARG A1067 -2.793 6.850 -13.531 1.00 2.60 H new ATOM 0 HD2 ARG A1067 -2.735 7.258 -16.062 1.00 3.86 H new ATOM 0 HD3 ARG A1067 -2.813 5.521 -16.280 1.00 3.86 H new ATOM 0 HE ARG A1067 -4.987 7.305 -15.568 1.00 5.13 H new ATOM 0 HH11 ARG A1067 -4.006 3.904 -15.248 1.00 5.80 H new ATOM 0 HH12 ARG A1067 -5.681 3.398 -15.007 1.00 5.80 H new ATOM 0 HH21 ARG A1067 -7.035 6.516 -15.215 1.00 7.27 H new ATOM 0 HH22 ARG A1067 -7.283 4.782 -14.990 1.00 7.27 H new ATOM 331 N ILE A1068 0.196 8.121 -12.030 1.00 1.17 N ATOM 332 CA ILE A1068 0.107 8.624 -10.646 1.00 1.07 C ATOM 333 C ILE A1068 1.479 9.117 -10.157 1.00 1.14 C ATOM 334 O ILE A1068 2.482 8.428 -10.342 1.00 1.18 O ATOM 335 CB ILE A1068 -0.479 7.581 -9.648 1.00 0.89 C ATOM 336 CG1 ILE A1068 -1.433 6.511 -10.233 1.00 1.60 C ATOM 337 CG2 ILE A1068 -1.229 8.327 -8.535 1.00 1.36 C ATOM 338 CD1 ILE A1068 -0.685 5.248 -10.683 1.00 1.14 C ATOM 0 H ILE A1068 0.979 7.483 -12.171 1.00 1.17 H new ATOM 0 HA ILE A1068 -0.592 9.460 -10.671 1.00 1.07 H new ATOM 0 HB ILE A1068 0.391 7.026 -9.297 1.00 0.89 H new ATOM 0 HG12 ILE A1068 -2.177 6.242 -9.484 1.00 1.60 H new ATOM 0 HG13 ILE A1068 -1.972 6.933 -11.081 1.00 1.60 H new ATOM 0 HG21 ILE A1068 -1.644 7.607 -7.830 1.00 1.36 H new ATOM 0 HG22 ILE A1068 -0.539 8.990 -8.013 1.00 1.36 H new ATOM 0 HG23 ILE A1068 -2.037 8.914 -8.971 1.00 1.36 H new ATOM 0 HD11 ILE A1068 -1.397 4.528 -11.086 1.00 1.14 H new ATOM 0 HD12 ILE A1068 0.041 5.510 -11.453 1.00 1.14 H new ATOM 0 HD13 ILE A1068 -0.167 4.809 -9.830 1.00 1.14 H new ATOM 350 N SER A1069 1.533 10.291 -9.520 1.00 1.26 N ATOM 351 CA SER A1069 2.771 10.892 -8.990 1.00 1.37 C ATOM 352 C SER A1069 3.158 10.349 -7.604 1.00 1.05 C ATOM 353 O SER A1069 2.302 9.976 -6.799 1.00 0.83 O ATOM 354 CB SER A1069 2.668 12.425 -8.981 1.00 1.67 C ATOM 355 OG SER A1069 2.644 12.917 -10.310 1.00 2.53 O ATOM 0 H SER A1069 0.706 10.864 -9.353 1.00 1.26 H new ATOM 0 HA SER A1069 3.577 10.600 -9.664 1.00 1.37 H new ATOM 0 HB2 SER A1069 1.765 12.734 -8.454 1.00 1.67 H new ATOM 0 HB3 SER A1069 3.514 12.851 -8.442 1.00 1.67 H new ATOM 0 HG SER A1069 2.577 13.895 -10.296 1.00 2.53 H new ATOM 361 N HIS A1070 4.460 10.332 -7.299 1.00 1.14 N ATOM 362 CA HIS A1070 5.043 9.727 -6.086 1.00 1.08 C ATOM 363 C HIS A1070 4.360 10.146 -4.759 1.00 0.87 C ATOM 364 O HIS A1070 3.971 9.283 -3.968 1.00 0.84 O ATOM 365 CB HIS A1070 6.543 10.083 -6.032 1.00 1.39 C ATOM 366 CG HIS A1070 7.439 9.485 -7.102 1.00 2.40 C ATOM 367 ND1 HIS A1070 8.619 8.821 -6.858 1.00 3.53 N ATOM 368 CD2 HIS A1070 7.326 9.586 -8.468 1.00 3.59 C ATOM 369 CE1 HIS A1070 9.194 8.520 -8.033 1.00 5.06 C ATOM 370 NE2 HIS A1070 8.449 8.982 -9.055 1.00 5.08 N ATOM 0 H HIS A1070 5.164 10.751 -7.906 1.00 1.14 H new ATOM 0 HA HIS A1070 4.882 8.652 -6.167 1.00 1.08 H new ATOM 0 HB2 HIS A1070 6.634 11.168 -6.083 1.00 1.39 H new ATOM 0 HB3 HIS A1070 6.928 9.776 -5.059 1.00 1.39 H new ATOM 0 HD2 HIS A1070 6.510 10.052 -9.000 1.00 3.59 H new ATOM 0 HE1 HIS A1070 10.124 7.982 -8.143 1.00 5.06 H new ATOM 0 HE2 HIS A1070 8.658 8.908 -10.051 1.00 5.08 H new ATOM 378 N HIS A1071 4.159 11.446 -4.506 1.00 0.85 N ATOM 379 CA HIS A1071 3.553 11.926 -3.253 1.00 0.81 C ATOM 380 C HIS A1071 2.044 11.639 -3.164 1.00 0.74 C ATOM 381 O HIS A1071 1.527 11.404 -2.071 1.00 0.76 O ATOM 382 CB HIS A1071 3.849 13.419 -3.043 1.00 0.99 C ATOM 383 CG HIS A1071 5.302 13.702 -2.749 1.00 1.74 C ATOM 384 ND1 HIS A1071 6.298 13.866 -3.683 1.00 3.37 N ATOM 385 CD2 HIS A1071 5.882 13.835 -1.516 1.00 2.52 C ATOM 386 CE1 HIS A1071 7.451 14.088 -3.033 1.00 4.38 C ATOM 387 NE2 HIS A1071 7.252 14.077 -1.699 1.00 3.83 N ATOM 0 H HIS A1071 4.409 12.191 -5.157 1.00 0.85 H new ATOM 0 HA HIS A1071 4.017 11.361 -2.445 1.00 0.81 H new ATOM 0 HB2 HIS A1071 3.551 13.971 -3.935 1.00 0.99 H new ATOM 0 HB3 HIS A1071 3.239 13.791 -2.220 1.00 0.99 H new ATOM 0 HD2 HIS A1071 5.373 13.766 -0.566 1.00 2.52 H new ATOM 0 HE1 HIS A1071 8.405 14.253 -3.511 1.00 4.38 H new ATOM 0 HE2 HIS A1071 7.954 14.216 -0.972 1.00 3.83 H new ATOM 395 N LYS A1072 1.335 11.573 -4.302 1.00 0.75 N ATOM 396 CA LYS A1072 -0.073 11.141 -4.345 1.00 0.77 C ATOM 397 C LYS A1072 -0.206 9.683 -3.898 1.00 0.68 C ATOM 398 O LYS A1072 -1.099 9.380 -3.113 1.00 0.81 O ATOM 399 CB LYS A1072 -0.663 11.343 -5.756 1.00 0.93 C ATOM 400 CG LYS A1072 -0.844 12.815 -6.161 1.00 1.45 C ATOM 401 CD LYS A1072 -2.073 13.469 -5.513 1.00 2.42 C ATOM 402 CE LYS A1072 -2.423 14.803 -6.186 1.00 2.56 C ATOM 403 NZ LYS A1072 -1.414 15.855 -5.923 1.00 3.39 N ATOM 0 H LYS A1072 1.719 11.816 -5.215 1.00 0.75 H new ATOM 0 HA LYS A1072 -0.642 11.759 -3.651 1.00 0.77 H new ATOM 0 HB2 LYS A1072 -0.012 10.856 -6.482 1.00 0.93 H new ATOM 0 HB3 LYS A1072 -1.630 10.842 -5.808 1.00 0.93 H new ATOM 0 HG2 LYS A1072 0.048 13.375 -5.882 1.00 1.45 H new ATOM 0 HG3 LYS A1072 -0.934 12.879 -7.245 1.00 1.45 H new ATOM 0 HD2 LYS A1072 -2.925 12.792 -5.581 1.00 2.42 H new ATOM 0 HD3 LYS A1072 -1.881 13.635 -4.453 1.00 2.42 H new ATOM 0 HE2 LYS A1072 -2.512 14.651 -7.262 1.00 2.56 H new ATOM 0 HE3 LYS A1072 -3.396 15.141 -5.830 1.00 2.56 H new ATOM 0 HZ1 LYS A1072 -1.698 16.735 -6.399 1.00 3.39 H new ATOM 0 HZ2 LYS A1072 -1.346 16.022 -4.899 1.00 3.39 H new ATOM 0 HZ3 LYS A1072 -0.489 15.547 -6.286 1.00 3.39 H new ATOM 417 N ILE A1073 0.712 8.809 -4.330 1.00 0.58 N ATOM 418 CA ILE A1073 0.750 7.384 -3.955 1.00 0.57 C ATOM 419 C ILE A1073 0.920 7.206 -2.441 1.00 0.66 C ATOM 420 O ILE A1073 0.111 6.516 -1.823 1.00 0.72 O ATOM 421 CB ILE A1073 1.841 6.635 -4.758 1.00 0.59 C ATOM 422 CG1 ILE A1073 1.421 6.554 -6.241 1.00 0.54 C ATOM 423 CG2 ILE A1073 2.110 5.218 -4.211 1.00 0.74 C ATOM 424 CD1 ILE A1073 2.580 6.177 -7.163 1.00 0.65 C ATOM 0 H ILE A1073 1.466 9.075 -4.963 1.00 0.58 H new ATOM 0 HA ILE A1073 -0.210 6.938 -4.215 1.00 0.57 H new ATOM 0 HB ILE A1073 2.769 7.198 -4.657 1.00 0.59 H new ATOM 0 HG12 ILE A1073 0.623 5.819 -6.349 1.00 0.54 H new ATOM 0 HG13 ILE A1073 1.013 7.516 -6.552 1.00 0.54 H new ATOM 0 HG21 ILE A1073 2.883 4.737 -4.810 1.00 0.74 H new ATOM 0 HG22 ILE A1073 2.443 5.285 -3.175 1.00 0.74 H new ATOM 0 HG23 ILE A1073 1.194 4.629 -4.260 1.00 0.74 H new ATOM 0 HD11 ILE A1073 2.227 6.135 -8.193 1.00 0.65 H new ATOM 0 HD12 ILE A1073 3.369 6.925 -7.080 1.00 0.65 H new ATOM 0 HD13 ILE A1073 2.973 5.202 -6.874 1.00 0.65 H new ATOM 436 N LEU A1074 1.923 7.839 -1.817 1.00 0.73 N ATOM 437 CA LEU A1074 2.141 7.667 -0.370 1.00 0.91 C ATOM 438 C LEU A1074 1.000 8.266 0.474 1.00 0.97 C ATOM 439 O LEU A1074 0.656 7.720 1.526 1.00 1.09 O ATOM 440 CB LEU A1074 3.565 8.117 0.020 1.00 1.23 C ATOM 441 CG LEU A1074 3.861 9.630 0.010 1.00 1.69 C ATOM 442 CD1 LEU A1074 3.505 10.317 1.331 1.00 2.20 C ATOM 443 CD2 LEU A1074 5.352 9.868 -0.235 1.00 2.85 C ATOM 0 H LEU A1074 2.585 8.463 -2.278 1.00 0.73 H new ATOM 0 HA LEU A1074 2.096 6.605 -0.128 1.00 0.91 H new ATOM 0 HB2 LEU A1074 3.775 7.740 1.021 1.00 1.23 H new ATOM 0 HB3 LEU A1074 4.268 7.632 -0.657 1.00 1.23 H new ATOM 0 HG LEU A1074 3.245 10.052 -0.784 1.00 1.69 H new ATOM 0 HD11 LEU A1074 3.736 11.380 1.262 1.00 2.20 H new ATOM 0 HD12 LEU A1074 2.441 10.189 1.533 1.00 2.20 H new ATOM 0 HD13 LEU A1074 4.084 9.872 2.140 1.00 2.20 H new ATOM 0 HD21 LEU A1074 5.553 10.939 -0.241 1.00 2.85 H new ATOM 0 HD22 LEU A1074 5.931 9.394 0.558 1.00 2.85 H new ATOM 0 HD23 LEU A1074 5.635 9.440 -1.197 1.00 2.85 H new ATOM 455 N ALA A1075 0.342 9.322 -0.019 1.00 0.94 N ATOM 456 CA ALA A1075 -0.862 9.863 0.606 1.00 1.08 C ATOM 457 C ALA A1075 -2.037 8.864 0.571 1.00 1.10 C ATOM 458 O ALA A1075 -2.650 8.630 1.615 1.00 1.10 O ATOM 459 CB ALA A1075 -1.208 11.206 -0.049 1.00 1.10 C ATOM 0 H ALA A1075 0.631 9.821 -0.860 1.00 0.94 H new ATOM 0 HA ALA A1075 -0.666 10.035 1.664 1.00 1.08 H new ATOM 0 HB1 ALA A1075 -2.106 11.615 0.413 1.00 1.10 H new ATOM 0 HB2 ALA A1075 -0.380 11.902 0.088 1.00 1.10 H new ATOM 0 HB3 ALA A1075 -1.384 11.057 -1.114 1.00 1.10 H new ATOM 465 N ILE A1076 -2.333 8.237 -0.580 1.00 1.14 N ATOM 466 CA ILE A1076 -3.423 7.239 -0.668 1.00 1.31 C ATOM 467 C ILE A1076 -3.118 5.909 0.031 1.00 1.41 C ATOM 468 O ILE A1076 -4.041 5.259 0.523 1.00 1.61 O ATOM 469 CB ILE A1076 -4.014 7.059 -2.084 1.00 1.21 C ATOM 470 CG1 ILE A1076 -2.973 6.539 -3.100 1.00 0.89 C ATOM 471 CG2 ILE A1076 -4.713 8.373 -2.483 1.00 1.38 C ATOM 472 CD1 ILE A1076 -3.433 6.457 -4.564 1.00 0.83 C ATOM 0 H ILE A1076 -1.840 8.399 -1.458 1.00 1.14 H new ATOM 0 HA ILE A1076 -4.226 7.689 -0.085 1.00 1.31 H new ATOM 0 HB ILE A1076 -4.766 6.270 -2.084 1.00 1.21 H new ATOM 0 HG12 ILE A1076 -2.096 7.185 -3.052 1.00 0.89 H new ATOM 0 HG13 ILE A1076 -2.654 5.545 -2.785 1.00 0.89 H new ATOM 0 HG21 ILE A1076 -5.139 8.270 -3.481 1.00 1.38 H new ATOM 0 HG22 ILE A1076 -5.508 8.593 -1.770 1.00 1.38 H new ATOM 0 HG23 ILE A1076 -3.987 9.186 -2.480 1.00 1.38 H new ATOM 0 HD11 ILE A1076 -2.618 6.079 -5.181 1.00 0.83 H new ATOM 0 HD12 ILE A1076 -4.287 5.784 -4.640 1.00 0.83 H new ATOM 0 HD13 ILE A1076 -3.721 7.449 -4.911 1.00 0.83 H new ATOM 484 N VAL A1077 -1.840 5.537 0.164 1.00 1.34 N ATOM 485 CA VAL A1077 -1.414 4.418 1.028 1.00 1.52 C ATOM 486 C VAL A1077 -1.853 4.670 2.475 1.00 1.42 C ATOM 487 O VAL A1077 -2.362 3.758 3.126 1.00 1.75 O ATOM 488 CB VAL A1077 0.108 4.193 0.909 1.00 1.59 C ATOM 489 CG1 VAL A1077 0.719 3.415 2.079 1.00 1.96 C ATOM 490 CG2 VAL A1077 0.413 3.428 -0.383 1.00 1.80 C ATOM 0 H VAL A1077 -1.070 5.998 -0.321 1.00 1.34 H new ATOM 0 HA VAL A1077 -1.900 3.501 0.695 1.00 1.52 H new ATOM 0 HB VAL A1077 0.556 5.187 0.912 1.00 1.59 H new ATOM 0 HG11 VAL A1077 1.791 3.300 1.919 1.00 1.96 H new ATOM 0 HG12 VAL A1077 0.547 3.960 3.007 1.00 1.96 H new ATOM 0 HG13 VAL A1077 0.254 2.431 2.144 1.00 1.96 H new ATOM 0 HG21 VAL A1077 1.488 3.269 -0.467 1.00 1.80 H new ATOM 0 HG22 VAL A1077 -0.096 2.464 -0.364 1.00 1.80 H new ATOM 0 HG23 VAL A1077 0.064 4.006 -1.239 1.00 1.80 H new ATOM 500 N GLY A1078 -1.716 5.906 2.966 1.00 1.03 N ATOM 501 CA GLY A1078 -2.252 6.318 4.269 1.00 0.85 C ATOM 502 C GLY A1078 -3.781 6.382 4.329 1.00 1.09 C ATOM 503 O GLY A1078 -4.386 5.810 5.232 1.00 1.40 O ATOM 0 H GLY A1078 -1.229 6.652 2.470 1.00 1.03 H new ATOM 0 HA2 GLY A1078 -1.899 5.623 5.030 1.00 0.85 H new ATOM 0 HA3 GLY A1078 -1.849 7.299 4.521 1.00 0.85 H new ATOM 507 N THR A1079 -4.427 7.047 3.370 1.00 1.13 N ATOM 508 CA THR A1079 -5.898 7.229 3.412 1.00 1.48 C ATOM 509 C THR A1079 -6.680 5.912 3.334 1.00 1.71 C ATOM 510 O THR A1079 -7.746 5.809 3.950 1.00 1.92 O ATOM 511 CB THR A1079 -6.466 8.184 2.363 1.00 1.78 C ATOM 512 OG1 THR A1079 -6.220 7.710 1.083 1.00 3.66 O ATOM 513 CG2 THR A1079 -6.025 9.641 2.430 1.00 1.79 C ATOM 0 H THR A1079 -3.971 7.468 2.560 1.00 1.13 H new ATOM 0 HA THR A1079 -6.039 7.685 4.392 1.00 1.48 H new ATOM 0 HB THR A1079 -7.528 8.197 2.607 1.00 1.78 H new ATOM 0 HG1 THR A1079 -6.926 8.020 0.478 1.00 3.66 H new ATOM 0 HG21 THR A1079 -6.504 10.203 1.628 1.00 1.79 H new ATOM 0 HG22 THR A1079 -6.313 10.064 3.392 1.00 1.79 H new ATOM 0 HG23 THR A1079 -4.942 9.699 2.317 1.00 1.79 H new ATOM 521 N ALA A1080 -6.149 4.893 2.648 1.00 1.73 N ATOM 522 CA ALA A1080 -6.713 3.540 2.600 1.00 2.04 C ATOM 523 C ALA A1080 -6.708 2.805 3.960 1.00 1.99 C ATOM 524 O ALA A1080 -7.425 1.818 4.125 1.00 2.62 O ATOM 525 CB ALA A1080 -5.935 2.745 1.545 1.00 2.21 C ATOM 0 H ALA A1080 -5.295 4.989 2.098 1.00 1.73 H new ATOM 0 HA ALA A1080 -7.767 3.624 2.336 1.00 2.04 H new ATOM 0 HB1 ALA A1080 -6.333 1.732 1.486 1.00 2.21 H new ATOM 0 HB2 ALA A1080 -6.037 3.231 0.575 1.00 2.21 H new ATOM 0 HB3 ALA A1080 -4.882 2.706 1.823 1.00 2.21 H new ATOM 531 N GLU A1081 -5.897 3.247 4.927 1.00 1.45 N ATOM 532 CA GLU A1081 -5.796 2.665 6.274 1.00 1.43 C ATOM 533 C GLU A1081 -6.497 3.516 7.357 1.00 1.33 C ATOM 534 O GLU A1081 -6.414 3.202 8.547 1.00 1.44 O ATOM 535 CB GLU A1081 -4.306 2.462 6.616 1.00 1.46 C ATOM 536 CG GLU A1081 -3.470 1.695 5.579 1.00 1.81 C ATOM 537 CD GLU A1081 -3.748 0.192 5.476 1.00 2.16 C ATOM 538 OE1 GLU A1081 -4.659 -0.356 6.140 1.00 2.30 O ATOM 539 OE2 GLU A1081 -3.040 -0.482 4.689 1.00 3.43 O ATOM 0 H GLU A1081 -5.273 4.043 4.792 1.00 1.45 H new ATOM 0 HA GLU A1081 -6.318 1.708 6.266 1.00 1.43 H new ATOM 0 HB2 GLU A1081 -3.852 3.442 6.765 1.00 1.46 H new ATOM 0 HB3 GLU A1081 -4.242 1.933 7.567 1.00 1.46 H new ATOM 0 HG2 GLU A1081 -3.639 2.144 4.600 1.00 1.81 H new ATOM 0 HG3 GLU A1081 -2.415 1.835 5.816 1.00 1.81 H new ATOM 546 N SER A1082 -7.135 4.628 6.971 1.00 1.33 N ATOM 547 CA SER A1082 -7.644 5.676 7.877 1.00 1.28 C ATOM 548 C SER A1082 -9.115 5.578 8.328 1.00 1.22 C ATOM 549 O SER A1082 -9.587 6.453 9.057 1.00 1.34 O ATOM 550 CB SER A1082 -7.346 7.047 7.259 1.00 1.39 C ATOM 551 OG SER A1082 -7.093 8.004 8.272 1.00 1.70 O ATOM 0 H SER A1082 -7.319 4.834 5.989 1.00 1.33 H new ATOM 0 HA SER A1082 -7.108 5.520 8.813 1.00 1.28 H new ATOM 0 HB2 SER A1082 -6.484 6.974 6.596 1.00 1.39 H new ATOM 0 HB3 SER A1082 -8.190 7.369 6.649 1.00 1.39 H new ATOM 0 HG SER A1082 -7.787 7.943 8.961 1.00 1.70 H new ATOM 557 N ASN A1083 -9.879 4.570 7.893 1.00 1.29 N ATOM 558 CA ASN A1083 -11.336 4.536 8.054 1.00 1.38 C ATOM 559 C ASN A1083 -11.842 3.752 9.292 1.00 1.66 C ATOM 560 O ASN A1083 -12.353 4.376 10.229 1.00 2.60 O ATOM 561 CB ASN A1083 -11.904 4.116 6.687 1.00 1.78 C ATOM 562 CG ASN A1083 -13.345 3.662 6.713 1.00 2.65 C ATOM 563 OD1 ASN A1083 -14.263 4.400 7.047 1.00 3.18 O ATOM 564 ND2 ASN A1083 -13.564 2.421 6.362 1.00 3.49 N ATOM 0 H ASN A1083 -9.501 3.751 7.417 1.00 1.29 H new ATOM 0 HA ASN A1083 -11.725 5.521 8.314 1.00 1.38 H new ATOM 0 HB2 ASN A1083 -11.815 4.956 5.998 1.00 1.78 H new ATOM 0 HB3 ASN A1083 -11.290 3.309 6.287 1.00 1.78 H new ATOM 0 HD21 ASN A1083 -14.514 2.051 6.363 1.00 3.49 H new ATOM 0 HD22 ASN A1083 -12.784 1.824 6.087 1.00 3.49 H new ATOM 571 N SER A1084 -11.754 2.417 9.310 1.00 1.56 N ATOM 572 CA SER A1084 -12.288 1.562 10.403 1.00 2.09 C ATOM 573 C SER A1084 -11.784 0.104 10.408 1.00 2.07 C ATOM 574 O SER A1084 -12.348 -0.759 11.080 1.00 2.97 O ATOM 575 CB SER A1084 -13.826 1.543 10.330 1.00 3.02 C ATOM 576 OG SER A1084 -14.281 1.027 9.087 1.00 3.87 O ATOM 0 H SER A1084 -11.307 1.884 8.564 1.00 1.56 H new ATOM 0 HA SER A1084 -11.918 2.014 11.324 1.00 2.09 H new ATOM 0 HB2 SER A1084 -14.223 0.937 11.144 1.00 3.02 H new ATOM 0 HB3 SER A1084 -14.211 2.553 10.469 1.00 3.02 H new ATOM 0 HG SER A1084 -15.261 1.026 9.072 1.00 3.87 H new ATOM 582 N GLU A1085 -10.732 -0.212 9.655 1.00 1.71 N ATOM 583 CA GLU A1085 -10.333 -1.590 9.322 1.00 2.20 C ATOM 584 C GLU A1085 -9.166 -2.188 10.124 1.00 1.99 C ATOM 585 O GLU A1085 -9.278 -3.347 10.543 1.00 2.64 O ATOM 586 CB GLU A1085 -10.100 -1.730 7.799 1.00 3.00 C ATOM 587 CG GLU A1085 -9.318 -0.585 7.125 1.00 3.17 C ATOM 588 CD GLU A1085 -10.141 0.705 6.998 1.00 4.20 C ATOM 589 OE1 GLU A1085 -11.346 0.672 6.643 1.00 5.65 O ATOM 590 OE2 GLU A1085 -9.636 1.736 7.500 1.00 4.47 O ATOM 0 H GLU A1085 -10.117 0.493 9.248 1.00 1.71 H new ATOM 0 HA GLU A1085 -11.182 -2.196 9.637 1.00 2.20 H new ATOM 0 HB2 GLU A1085 -9.567 -2.663 7.618 1.00 3.00 H new ATOM 0 HB3 GLU A1085 -11.070 -1.817 7.310 1.00 3.00 H new ATOM 0 HG2 GLU A1085 -8.416 -0.379 7.701 1.00 3.17 H new ATOM 0 HG3 GLU A1085 -8.997 -0.905 6.134 1.00 3.17 H new ATOM 597 N HIS A1086 -8.075 -1.448 10.365 1.00 1.67 N ATOM 598 CA HIS A1086 -6.824 -2.023 10.895 1.00 1.78 C ATOM 599 C HIS A1086 -6.199 -1.208 12.047 1.00 1.51 C ATOM 600 O HIS A1086 -6.074 0.013 11.927 1.00 1.44 O ATOM 601 CB HIS A1086 -5.801 -2.164 9.752 1.00 2.41 C ATOM 602 CG HIS A1086 -6.311 -2.883 8.526 1.00 2.96 C ATOM 603 ND1 HIS A1086 -6.241 -2.420 7.234 1.00 4.22 N ATOM 604 CD2 HIS A1086 -6.916 -4.110 8.477 1.00 2.89 C ATOM 605 CE1 HIS A1086 -6.789 -3.339 6.425 1.00 4.55 C ATOM 606 NE2 HIS A1086 -7.236 -4.388 7.141 1.00 3.74 N ATOM 0 H HIS A1086 -8.031 -0.442 10.201 1.00 1.67 H new ATOM 0 HA HIS A1086 -7.084 -2.996 11.313 1.00 1.78 H new ATOM 0 HB2 HIS A1086 -5.467 -1.169 9.459 1.00 2.41 H new ATOM 0 HB3 HIS A1086 -4.927 -2.695 10.130 1.00 2.41 H new ATOM 0 HD1 HIS A1086 -5.840 -1.529 6.940 1.00 4.22 H new ATOM 0 HD2 HIS A1086 -7.113 -4.753 9.322 1.00 2.89 H new ATOM 0 HE1 HIS A1086 -6.861 -3.250 5.351 1.00 4.55 H new ATOM 614 N PRO A1087 -5.691 -1.851 13.121 1.00 1.67 N ATOM 615 CA PRO A1087 -5.070 -1.156 14.259 1.00 1.85 C ATOM 616 C PRO A1087 -3.686 -0.558 13.951 1.00 1.76 C ATOM 617 O PRO A1087 -3.205 0.299 14.694 1.00 2.09 O ATOM 618 CB PRO A1087 -4.972 -2.219 15.357 1.00 2.28 C ATOM 619 CG PRO A1087 -4.801 -3.518 14.574 1.00 2.29 C ATOM 620 CD PRO A1087 -5.704 -3.290 13.364 1.00 2.01 C ATOM 0 HA PRO A1087 -5.671 -0.292 14.544 1.00 1.85 H new ATOM 0 HB2 PRO A1087 -4.127 -2.035 16.021 1.00 2.28 H new ATOM 0 HB3 PRO A1087 -5.867 -2.239 15.979 1.00 2.28 H new ATOM 0 HG2 PRO A1087 -3.764 -3.683 14.282 1.00 2.29 H new ATOM 0 HG3 PRO A1087 -5.111 -4.387 15.155 1.00 2.29 H new ATOM 0 HD2 PRO A1087 -5.338 -3.836 12.495 1.00 2.01 H new ATOM 0 HD3 PRO A1087 -6.716 -3.644 13.560 1.00 2.01 H new ATOM 628 N LEU A1088 -3.053 -1.012 12.861 1.00 1.55 N ATOM 629 CA LEU A1088 -1.740 -0.575 12.363 1.00 1.67 C ATOM 630 C LEU A1088 -1.798 0.754 11.583 1.00 1.61 C ATOM 631 O LEU A1088 -0.786 1.437 11.435 1.00 1.77 O ATOM 632 CB LEU A1088 -1.178 -1.668 11.421 1.00 1.70 C ATOM 633 CG LEU A1088 -1.247 -3.133 11.898 1.00 1.95 C ATOM 634 CD1 LEU A1088 -0.668 -4.052 10.822 1.00 2.40 C ATOM 635 CD2 LEU A1088 -0.466 -3.367 13.187 1.00 2.29 C ATOM 0 H LEU A1088 -3.465 -1.734 12.270 1.00 1.55 H new ATOM 0 HA LEU A1088 -1.103 -0.417 13.233 1.00 1.67 H new ATOM 0 HB2 LEU A1088 -1.711 -1.599 10.473 1.00 1.70 H new ATOM 0 HB3 LEU A1088 -0.134 -1.431 11.218 1.00 1.70 H new ATOM 0 HG LEU A1088 -2.298 -3.353 12.087 1.00 1.95 H new ATOM 0 HD11 LEU A1088 -0.718 -5.087 11.162 1.00 2.40 H new ATOM 0 HD12 LEU A1088 -1.244 -3.944 9.903 1.00 2.40 H new ATOM 0 HD13 LEU A1088 0.371 -3.782 10.633 1.00 2.40 H new ATOM 0 HD21 LEU A1088 -0.548 -4.414 13.477 1.00 2.29 H new ATOM 0 HD22 LEU A1088 0.583 -3.116 13.028 1.00 2.29 H new ATOM 0 HD23 LEU A1088 -0.873 -2.738 13.979 1.00 2.29 H new ATOM 647 N GLY A1089 -2.982 1.083 11.055 1.00 1.44 N ATOM 648 CA GLY A1089 -3.195 2.155 10.082 1.00 1.32 C ATOM 649 C GLY A1089 -2.630 3.512 10.492 1.00 1.35 C ATOM 650 O GLY A1089 -1.909 4.127 9.706 1.00 1.33 O ATOM 0 H GLY A1089 -3.843 0.595 11.302 1.00 1.44 H new ATOM 0 HA2 GLY A1089 -2.745 1.861 9.134 1.00 1.32 H new ATOM 0 HA3 GLY A1089 -4.266 2.261 9.907 1.00 1.32 H new ATOM 654 N THR A1090 -2.881 3.951 11.730 1.00 1.54 N ATOM 655 CA THR A1090 -2.486 5.294 12.195 1.00 1.66 C ATOM 656 C THR A1090 -0.988 5.585 12.071 1.00 1.62 C ATOM 657 O THR A1090 -0.606 6.739 11.874 1.00 1.63 O ATOM 658 CB THR A1090 -2.888 5.555 13.654 1.00 2.08 C ATOM 659 OG1 THR A1090 -2.164 4.725 14.529 1.00 2.92 O ATOM 660 CG2 THR A1090 -4.368 5.338 13.957 1.00 1.88 C ATOM 0 H THR A1090 -3.360 3.393 12.437 1.00 1.54 H new ATOM 0 HA THR A1090 -3.029 5.960 11.525 1.00 1.66 H new ATOM 0 HB THR A1090 -2.662 6.610 13.805 1.00 2.08 H new ATOM 0 HG1 THR A1090 -2.434 4.909 15.453 1.00 2.92 H new ATOM 0 HG21 THR A1090 -4.558 5.546 15.010 1.00 1.88 H new ATOM 0 HG22 THR A1090 -4.968 6.008 13.341 1.00 1.88 H new ATOM 0 HG23 THR A1090 -4.637 4.305 13.737 1.00 1.88 H new ATOM 668 N ALA A1091 -0.135 4.558 12.149 1.00 1.63 N ATOM 669 CA ALA A1091 1.309 4.716 11.996 1.00 1.64 C ATOM 670 C ALA A1091 1.713 5.008 10.539 1.00 1.41 C ATOM 671 O ALA A1091 2.607 5.826 10.310 1.00 1.41 O ATOM 672 CB ALA A1091 2.012 3.465 12.535 1.00 1.81 C ATOM 0 H ALA A1091 -0.429 3.596 12.320 1.00 1.63 H new ATOM 0 HA ALA A1091 1.625 5.584 12.575 1.00 1.64 H new ATOM 0 HB1 ALA A1091 3.090 3.577 12.423 1.00 1.81 H new ATOM 0 HB2 ALA A1091 1.768 3.336 13.589 1.00 1.81 H new ATOM 0 HB3 ALA A1091 1.678 2.591 11.976 1.00 1.81 H new ATOM 678 N ILE A1092 1.024 4.400 9.563 1.00 1.29 N ATOM 679 CA ILE A1092 1.180 4.702 8.130 1.00 1.16 C ATOM 680 C ILE A1092 0.687 6.119 7.856 1.00 1.09 C ATOM 681 O ILE A1092 1.427 6.908 7.266 1.00 1.08 O ATOM 682 CB ILE A1092 0.429 3.668 7.248 1.00 1.15 C ATOM 683 CG1 ILE A1092 1.095 2.278 7.394 1.00 1.33 C ATOM 684 CG2 ILE A1092 0.382 4.094 5.761 1.00 1.18 C ATOM 685 CD1 ILE A1092 0.310 1.128 6.754 1.00 1.44 C ATOM 0 H ILE A1092 0.332 3.674 9.748 1.00 1.29 H new ATOM 0 HA ILE A1092 2.236 4.635 7.869 1.00 1.16 H new ATOM 0 HB ILE A1092 -0.603 3.617 7.597 1.00 1.15 H new ATOM 0 HG12 ILE A1092 2.088 2.316 6.947 1.00 1.33 H new ATOM 0 HG13 ILE A1092 1.230 2.063 8.454 1.00 1.33 H new ATOM 0 HG21 ILE A1092 -0.153 3.340 5.183 1.00 1.18 H new ATOM 0 HG22 ILE A1092 -0.132 5.051 5.673 1.00 1.18 H new ATOM 0 HG23 ILE A1092 1.398 4.191 5.378 1.00 1.18 H new ATOM 0 HD11 ILE A1092 0.849 0.192 6.904 1.00 1.44 H new ATOM 0 HD12 ILE A1092 -0.675 1.058 7.216 1.00 1.44 H new ATOM 0 HD13 ILE A1092 0.197 1.315 5.686 1.00 1.44 H new ATOM 697 N THR A1093 -0.534 6.467 8.293 1.00 1.11 N ATOM 698 CA THR A1093 -1.111 7.784 7.981 1.00 1.14 C ATOM 699 C THR A1093 -0.227 8.905 8.526 1.00 1.31 C ATOM 700 O THR A1093 0.138 9.809 7.775 1.00 1.41 O ATOM 701 CB THR A1093 -2.581 7.947 8.426 1.00 1.20 C ATOM 702 OG1 THR A1093 -2.692 8.347 9.773 1.00 2.26 O ATOM 703 CG2 THR A1093 -3.433 6.689 8.271 1.00 1.99 C ATOM 0 H THR A1093 -1.134 5.864 8.856 1.00 1.11 H new ATOM 0 HA THR A1093 -1.135 7.855 6.894 1.00 1.14 H new ATOM 0 HB THR A1093 -2.957 8.716 7.751 1.00 1.20 H new ATOM 0 HG1 THR A1093 -3.638 8.439 10.010 1.00 2.26 H new ATOM 0 HG21 THR A1093 -4.449 6.894 8.607 1.00 1.99 H new ATOM 0 HG22 THR A1093 -3.451 6.388 7.223 1.00 1.99 H new ATOM 0 HG23 THR A1093 -3.008 5.885 8.872 1.00 1.99 H new ATOM 711 N LYS A1094 0.227 8.790 9.784 1.00 1.40 N ATOM 712 CA LYS A1094 1.128 9.766 10.407 1.00 1.57 C ATOM 713 C LYS A1094 2.522 9.805 9.797 1.00 1.44 C ATOM 714 O LYS A1094 3.028 10.910 9.624 1.00 1.57 O ATOM 715 CB LYS A1094 1.173 9.575 11.931 1.00 1.80 C ATOM 716 CG LYS A1094 -0.087 10.203 12.534 1.00 2.29 C ATOM 717 CD LYS A1094 -0.212 10.082 14.058 1.00 2.73 C ATOM 718 CE LYS A1094 -0.583 8.654 14.474 1.00 2.75 C ATOM 719 NZ LYS A1094 -0.851 8.567 15.928 1.00 3.28 N ATOM 0 H LYS A1094 -0.023 8.014 10.398 1.00 1.40 H new ATOM 0 HA LYS A1094 0.703 10.747 10.193 1.00 1.57 H new ATOM 0 HB2 LYS A1094 1.224 8.515 12.179 1.00 1.80 H new ATOM 0 HB3 LYS A1094 2.066 10.043 12.346 1.00 1.80 H new ATOM 0 HG2 LYS A1094 -0.111 11.259 12.266 1.00 2.29 H new ATOM 0 HG3 LYS A1094 -0.960 9.738 12.076 1.00 2.29 H new ATOM 0 HD2 LYS A1094 0.730 10.366 14.526 1.00 2.73 H new ATOM 0 HD3 LYS A1094 -0.970 10.777 14.419 1.00 2.73 H new ATOM 0 HE2 LYS A1094 -1.464 8.329 13.920 1.00 2.75 H new ATOM 0 HE3 LYS A1094 0.228 7.974 14.211 1.00 2.75 H new ATOM 0 HZ1 LYS A1094 -1.099 7.588 16.177 1.00 3.28 H new ATOM 0 HZ2 LYS A1094 -0.002 8.854 16.455 1.00 3.28 H new ATOM 0 HZ3 LYS A1094 -1.641 9.198 16.174 1.00 3.28 H new ATOM 733 N TYR A1095 3.123 8.680 9.396 1.00 1.27 N ATOM 734 CA TYR A1095 4.447 8.704 8.756 1.00 1.26 C ATOM 735 C TYR A1095 4.397 9.400 7.386 1.00 1.36 C ATOM 736 O TYR A1095 5.208 10.286 7.113 1.00 1.42 O ATOM 737 CB TYR A1095 5.023 7.280 8.665 1.00 1.31 C ATOM 738 CG TYR A1095 6.458 7.147 8.163 1.00 1.67 C ATOM 739 CD1 TYR A1095 7.438 8.116 8.470 1.00 3.22 C ATOM 740 CD2 TYR A1095 6.836 5.993 7.446 1.00 1.96 C ATOM 741 CE1 TYR A1095 8.776 7.923 8.083 1.00 3.67 C ATOM 742 CE2 TYR A1095 8.178 5.793 7.059 1.00 2.40 C ATOM 743 CZ TYR A1095 9.156 6.757 7.386 1.00 2.80 C ATOM 744 OH TYR A1095 10.470 6.575 7.083 1.00 3.50 O ATOM 0 H TYR A1095 2.720 7.749 9.501 1.00 1.27 H new ATOM 0 HA TYR A1095 5.121 9.294 9.377 1.00 1.26 H new ATOM 0 HB2 TYR A1095 4.966 6.827 9.655 1.00 1.31 H new ATOM 0 HB3 TYR A1095 4.378 6.694 8.009 1.00 1.31 H new ATOM 0 HD1 TYR A1095 7.158 9.011 9.005 1.00 3.22 H new ATOM 0 HD2 TYR A1095 6.090 5.255 7.190 1.00 1.96 H new ATOM 0 HE1 TYR A1095 9.517 8.672 8.321 1.00 3.67 H new ATOM 0 HE2 TYR A1095 8.457 4.904 6.513 1.00 2.40 H new ATOM 0 HH TYR A1095 10.581 5.728 6.603 1.00 3.50 H new ATOM 754 N CYS A1096 3.383 9.097 6.568 1.00 1.42 N ATOM 755 CA CYS A1096 3.146 9.801 5.307 1.00 1.55 C ATOM 756 C CYS A1096 2.842 11.292 5.535 1.00 1.59 C ATOM 757 O CYS A1096 3.452 12.147 4.898 1.00 1.64 O ATOM 758 CB CYS A1096 2.015 9.097 4.545 1.00 1.63 C ATOM 759 SG CYS A1096 2.580 7.459 3.998 1.00 2.85 S ATOM 0 H CYS A1096 2.706 8.359 6.762 1.00 1.42 H new ATOM 0 HA CYS A1096 4.053 9.767 4.704 1.00 1.55 H new ATOM 0 HB2 CYS A1096 1.139 8.996 5.185 1.00 1.63 H new ATOM 0 HB3 CYS A1096 1.714 9.695 3.685 1.00 1.63 H new ATOM 0 HG CYS A1096 1.974 7.137 2.894 1.00 2.85 H new ATOM 765 N LYS A1097 1.964 11.632 6.487 1.00 1.60 N ATOM 766 CA LYS A1097 1.616 13.024 6.828 1.00 1.67 C ATOM 767 C LYS A1097 2.833 13.816 7.319 1.00 1.66 C ATOM 768 O LYS A1097 3.014 14.955 6.903 1.00 1.78 O ATOM 769 CB LYS A1097 0.464 12.982 7.854 1.00 1.70 C ATOM 770 CG LYS A1097 -0.246 14.309 8.168 1.00 2.14 C ATOM 771 CD LYS A1097 0.468 15.313 9.095 1.00 2.39 C ATOM 772 CE LYS A1097 0.825 14.675 10.448 1.00 2.99 C ATOM 773 NZ LYS A1097 1.311 15.666 11.436 1.00 3.51 N ATOM 0 H LYS A1097 1.467 10.942 7.051 1.00 1.60 H new ATOM 0 HA LYS A1097 1.282 13.560 5.939 1.00 1.67 H new ATOM 0 HB2 LYS A1097 -0.284 12.276 7.493 1.00 1.70 H new ATOM 0 HB3 LYS A1097 0.858 12.580 8.788 1.00 1.70 H new ATOM 0 HG2 LYS A1097 -0.446 14.812 7.222 1.00 2.14 H new ATOM 0 HG3 LYS A1097 -1.212 14.073 8.614 1.00 2.14 H new ATOM 0 HD2 LYS A1097 1.375 15.675 8.611 1.00 2.39 H new ATOM 0 HD3 LYS A1097 -0.173 16.179 9.258 1.00 2.39 H new ATOM 0 HE2 LYS A1097 -0.053 14.168 10.849 1.00 2.99 H new ATOM 0 HE3 LYS A1097 1.591 13.914 10.296 1.00 2.99 H new ATOM 0 HZ1 LYS A1097 1.537 15.184 12.329 1.00 3.51 H new ATOM 0 HZ2 LYS A1097 2.165 16.133 11.069 1.00 3.51 H new ATOM 0 HZ3 LYS A1097 0.573 16.379 11.605 1.00 3.51 H new ATOM 787 N GLN A1098 3.700 13.213 8.133 1.00 1.53 N ATOM 788 CA GLN A1098 4.960 13.810 8.598 1.00 1.51 C ATOM 789 C GLN A1098 5.969 14.053 7.454 1.00 1.54 C ATOM 790 O GLN A1098 6.733 15.022 7.524 1.00 1.61 O ATOM 791 CB GLN A1098 5.555 12.920 9.708 1.00 1.46 C ATOM 792 CG GLN A1098 4.900 13.086 11.092 1.00 1.40 C ATOM 793 CD GLN A1098 5.354 14.324 11.864 1.00 2.61 C ATOM 794 OE1 GLN A1098 5.611 15.395 11.324 1.00 3.66 O ATOM 795 NE2 GLN A1098 5.453 14.248 13.168 1.00 3.50 N ATOM 0 H GLN A1098 3.545 12.273 8.498 1.00 1.53 H new ATOM 0 HA GLN A1098 4.742 14.799 9.002 1.00 1.51 H new ATOM 0 HB2 GLN A1098 5.468 11.877 9.403 1.00 1.46 H new ATOM 0 HB3 GLN A1098 6.619 13.138 9.797 1.00 1.46 H new ATOM 0 HG2 GLN A1098 3.818 13.129 10.965 1.00 1.40 H new ATOM 0 HG3 GLN A1098 5.116 12.201 11.690 1.00 1.40 H new ATOM 0 HE21 GLN A1098 5.246 13.371 13.645 1.00 3.50 H new ATOM 0 HE22 GLN A1098 5.737 15.066 13.706 1.00 3.50 H new ATOM 804 N GLU A1099 5.949 13.250 6.380 1.00 1.55 N ATOM 805 CA GLU A1099 6.704 13.508 5.138 1.00 1.61 C ATOM 806 C GLU A1099 6.113 14.678 4.322 1.00 1.69 C ATOM 807 O GLU A1099 6.887 15.486 3.795 1.00 1.75 O ATOM 808 CB GLU A1099 6.824 12.207 4.309 1.00 1.63 C ATOM 809 CG GLU A1099 7.484 12.321 2.915 1.00 1.94 C ATOM 810 CD GLU A1099 9.000 12.587 2.902 1.00 2.19 C ATOM 811 OE1 GLU A1099 9.576 13.008 3.936 1.00 2.20 O ATOM 812 OE2 GLU A1099 9.628 12.390 1.826 1.00 3.02 O ATOM 0 H GLU A1099 5.401 12.390 6.346 1.00 1.55 H new ATOM 0 HA GLU A1099 7.710 13.826 5.413 1.00 1.61 H new ATOM 0 HB2 GLU A1099 7.392 11.484 4.894 1.00 1.63 H new ATOM 0 HB3 GLU A1099 5.823 11.796 4.177 1.00 1.63 H new ATOM 0 HG2 GLU A1099 7.293 11.397 2.369 1.00 1.94 H new ATOM 0 HG3 GLU A1099 6.990 13.123 2.367 1.00 1.94 H new ATOM 819 N LEU A1100 4.781 14.833 4.256 1.00 1.74 N ATOM 820 CA LEU A1100 4.122 15.985 3.605 1.00 1.85 C ATOM 821 C LEU A1100 4.251 17.291 4.408 1.00 1.91 C ATOM 822 O LEU A1100 4.261 18.384 3.841 1.00 2.20 O ATOM 823 CB LEU A1100 2.606 15.728 3.436 1.00 1.84 C ATOM 824 CG LEU A1100 2.144 14.450 2.723 1.00 1.87 C ATOM 825 CD1 LEU A1100 0.639 14.518 2.462 1.00 1.94 C ATOM 826 CD2 LEU A1100 2.870 14.231 1.406 1.00 2.07 C ATOM 0 H LEU A1100 4.124 14.161 4.654 1.00 1.74 H new ATOM 0 HA LEU A1100 4.628 16.094 2.646 1.00 1.85 H new ATOM 0 HB2 LEU A1100 2.159 15.730 4.430 1.00 1.84 H new ATOM 0 HB3 LEU A1100 2.186 16.577 2.896 1.00 1.84 H new ATOM 0 HG LEU A1100 2.379 13.611 3.378 1.00 1.87 H new ATOM 0 HD11 LEU A1100 0.316 13.608 1.956 1.00 1.94 H new ATOM 0 HD12 LEU A1100 0.109 14.613 3.410 1.00 1.94 H new ATOM 0 HD13 LEU A1100 0.417 15.381 1.834 1.00 1.94 H new ATOM 0 HD21 LEU A1100 2.509 13.315 0.939 1.00 2.07 H new ATOM 0 HD22 LEU A1100 2.682 15.075 0.742 1.00 2.07 H new ATOM 0 HD23 LEU A1100 3.941 14.146 1.591 1.00 2.07 H new ATOM 838 N ASP A1101 4.271 17.161 5.734 1.00 1.67 N ATOM 839 CA ASP A1101 4.148 18.214 6.746 1.00 1.69 C ATOM 840 C ASP A1101 2.926 19.140 6.559 1.00 2.02 C ATOM 841 O ASP A1101 3.002 20.351 6.787 1.00 2.30 O ATOM 842 CB ASP A1101 5.488 18.925 6.993 1.00 1.75 C ATOM 843 CG ASP A1101 5.548 19.468 8.420 1.00 1.48 C ATOM 844 OD1 ASP A1101 5.449 18.649 9.363 1.00 1.87 O ATOM 845 OD2 ASP A1101 5.727 20.693 8.619 1.00 2.55 O ATOM 0 H ASP A1101 4.383 16.243 6.165 1.00 1.67 H new ATOM 0 HA ASP A1101 3.910 17.717 7.687 1.00 1.69 H new ATOM 0 HB2 ASP A1101 6.311 18.231 6.826 1.00 1.75 H new ATOM 0 HB3 ASP A1101 5.610 19.741 6.281 1.00 1.75 H new ATOM 850 N THR A1102 1.794 18.554 6.142 1.00 2.07 N ATOM 851 CA THR A1102 0.469 19.200 6.070 1.00 2.28 C ATOM 852 C THR A1102 -0.576 18.387 6.822 1.00 2.38 C ATOM 853 O THR A1102 -0.615 17.167 6.714 1.00 2.82 O ATOM 854 CB THR A1102 0.047 19.445 4.617 1.00 2.80 C ATOM 855 OG1 THR A1102 -0.996 20.397 4.570 1.00 3.08 O ATOM 856 CG2 THR A1102 -0.434 18.219 3.839 1.00 3.19 C ATOM 0 H THR A1102 1.772 17.582 5.834 1.00 2.07 H new ATOM 0 HA THR A1102 0.545 20.173 6.556 1.00 2.28 H new ATOM 0 HB THR A1102 0.965 19.785 4.137 1.00 2.80 H new ATOM 0 HG1 THR A1102 -1.258 20.549 3.638 1.00 3.08 H new ATOM 0 HG21 THR A1102 -0.705 18.515 2.825 1.00 3.19 H new ATOM 0 HG22 THR A1102 0.364 17.477 3.800 1.00 3.19 H new ATOM 0 HG23 THR A1102 -1.304 17.790 4.337 1.00 3.19 H new ATOM 864 N GLU A1103 -1.445 19.045 7.583 1.00 2.26 N ATOM 865 CA GLU A1103 -2.428 18.387 8.464 1.00 2.36 C ATOM 866 C GLU A1103 -3.717 17.912 7.761 1.00 2.42 C ATOM 867 O GLU A1103 -4.603 17.344 8.409 1.00 2.60 O ATOM 868 CB GLU A1103 -2.712 19.307 9.660 1.00 2.44 C ATOM 869 CG GLU A1103 -3.387 20.628 9.266 1.00 2.59 C ATOM 870 CD GLU A1103 -3.357 21.652 10.405 1.00 2.97 C ATOM 871 OE1 GLU A1103 -3.705 21.317 11.562 1.00 2.79 O ATOM 872 OE2 GLU A1103 -3.002 22.827 10.137 1.00 4.13 O ATOM 0 H GLU A1103 -1.494 20.063 7.612 1.00 2.26 H new ATOM 0 HA GLU A1103 -1.981 17.455 8.810 1.00 2.36 H new ATOM 0 HB2 GLU A1103 -3.348 18.780 10.371 1.00 2.44 H new ATOM 0 HB3 GLU A1103 -1.775 19.525 10.172 1.00 2.44 H new ATOM 0 HG2 GLU A1103 -2.886 21.044 8.392 1.00 2.59 H new ATOM 0 HG3 GLU A1103 -4.421 20.435 8.979 1.00 2.59 H new ATOM 879 N THR A1104 -3.835 18.130 6.446 1.00 2.41 N ATOM 880 CA THR A1104 -5.053 17.896 5.653 1.00 2.53 C ATOM 881 C THR A1104 -4.892 16.733 4.665 1.00 2.33 C ATOM 882 O THR A1104 -4.238 16.837 3.620 1.00 2.69 O ATOM 883 CB THR A1104 -5.559 19.201 5.009 1.00 2.83 C ATOM 884 OG1 THR A1104 -6.691 18.939 4.208 1.00 3.11 O ATOM 885 CG2 THR A1104 -4.531 19.964 4.167 1.00 3.23 C ATOM 0 H THR A1104 -3.062 18.486 5.884 1.00 2.41 H new ATOM 0 HA THR A1104 -5.840 17.573 6.335 1.00 2.53 H new ATOM 0 HB THR A1104 -5.797 19.847 5.854 1.00 2.83 H new ATOM 0 HG1 THR A1104 -7.006 19.774 3.804 1.00 3.11 H new ATOM 0 HG21 THR A1104 -4.990 20.865 3.761 1.00 3.23 H new ATOM 0 HG22 THR A1104 -3.681 20.240 4.792 1.00 3.23 H new ATOM 0 HG23 THR A1104 -4.189 19.331 3.348 1.00 3.23 H new ATOM 893 N LEU A1105 -5.507 15.599 5.011 1.00 1.94 N ATOM 894 CA LEU A1105 -5.675 14.414 4.165 1.00 1.68 C ATOM 895 C LEU A1105 -6.858 13.547 4.631 1.00 1.59 C ATOM 896 O LEU A1105 -7.306 13.620 5.780 1.00 1.84 O ATOM 897 CB LEU A1105 -4.371 13.591 4.043 1.00 1.62 C ATOM 898 CG LEU A1105 -3.932 12.732 5.245 1.00 1.82 C ATOM 899 CD1 LEU A1105 -2.599 12.071 4.901 1.00 1.79 C ATOM 900 CD2 LEU A1105 -3.742 13.540 6.521 1.00 2.46 C ATOM 0 H LEU A1105 -5.922 15.476 5.935 1.00 1.94 H new ATOM 0 HA LEU A1105 -5.911 14.773 3.163 1.00 1.68 H new ATOM 0 HB2 LEU A1105 -4.475 12.930 3.183 1.00 1.62 H new ATOM 0 HB3 LEU A1105 -3.561 14.284 3.817 1.00 1.62 H new ATOM 0 HG LEU A1105 -4.723 12.005 5.430 1.00 1.82 H new ATOM 0 HD11 LEU A1105 -2.270 11.458 5.740 1.00 1.79 H new ATOM 0 HD12 LEU A1105 -2.721 11.443 4.018 1.00 1.79 H new ATOM 0 HD13 LEU A1105 -1.853 12.840 4.699 1.00 1.79 H new ATOM 0 HD21 LEU A1105 -3.433 12.877 7.329 1.00 2.46 H new ATOM 0 HD22 LEU A1105 -2.975 14.298 6.361 1.00 2.46 H new ATOM 0 HD23 LEU A1105 -4.681 14.024 6.788 1.00 2.46 H new ATOM 912 N GLY A1106 -7.340 12.724 3.705 1.00 1.44 N ATOM 913 CA GLY A1106 -8.471 11.800 3.848 1.00 1.41 C ATOM 914 C GLY A1106 -9.250 11.632 2.537 1.00 1.34 C ATOM 915 O GLY A1106 -9.518 12.627 1.857 1.00 1.63 O ATOM 0 H GLY A1106 -6.928 12.678 2.773 1.00 1.44 H new ATOM 0 HA2 GLY A1106 -8.105 10.828 4.178 1.00 1.41 H new ATOM 0 HA3 GLY A1106 -9.143 12.168 4.624 1.00 1.41 H new ATOM 919 N THR A1107 -9.600 10.398 2.160 1.00 1.30 N ATOM 920 CA THR A1107 -10.348 10.052 0.951 1.00 1.27 C ATOM 921 C THR A1107 -11.265 8.859 1.237 1.00 1.35 C ATOM 922 O THR A1107 -10.787 7.858 1.783 1.00 1.67 O ATOM 923 CB THR A1107 -9.427 9.661 -0.210 1.00 1.43 C ATOM 924 OG1 THR A1107 -8.566 8.619 0.172 1.00 1.62 O ATOM 925 CG2 THR A1107 -8.573 10.805 -0.754 1.00 1.66 C ATOM 0 H THR A1107 -9.358 9.578 2.716 1.00 1.30 H new ATOM 0 HA THR A1107 -10.918 10.937 0.667 1.00 1.27 H new ATOM 0 HB THR A1107 -10.103 9.351 -1.007 1.00 1.43 H new ATOM 0 HG1 THR A1107 -9.014 8.050 0.833 1.00 1.62 H new ATOM 0 HG21 THR A1107 -7.953 10.439 -1.572 1.00 1.66 H new ATOM 0 HG22 THR A1107 -9.222 11.602 -1.119 1.00 1.66 H new ATOM 0 HG23 THR A1107 -7.935 11.192 0.040 1.00 1.66 H new ATOM 933 N CYS A1108 -12.540 8.906 0.850 1.00 1.33 N ATOM 934 CA CYS A1108 -13.488 7.812 1.102 1.00 1.50 C ATOM 935 C CYS A1108 -13.271 6.607 0.167 1.00 1.20 C ATOM 936 O CYS A1108 -12.938 6.786 -1.009 1.00 1.01 O ATOM 937 CB CYS A1108 -14.924 8.329 1.049 1.00 1.82 C ATOM 938 SG CYS A1108 -15.135 9.698 2.222 1.00 2.63 S ATOM 0 H CYS A1108 -12.947 9.699 0.354 1.00 1.33 H new ATOM 0 HA CYS A1108 -13.297 7.440 2.108 1.00 1.50 H new ATOM 0 HB2 CYS A1108 -15.161 8.664 0.039 1.00 1.82 H new ATOM 0 HB3 CYS A1108 -15.618 7.524 1.289 1.00 1.82 H new ATOM 0 HG CYS A1108 -14.979 10.829 1.601 1.00 2.63 H new ATOM 944 N ILE A1109 -13.452 5.390 0.691 1.00 1.27 N ATOM 945 CA ILE A1109 -13.111 4.105 0.088 1.00 1.08 C ATOM 946 C ILE A1109 -14.300 3.122 0.118 1.00 0.94 C ATOM 947 O ILE A1109 -14.893 2.865 1.168 1.00 1.16 O ATOM 948 CB ILE A1109 -11.821 3.525 0.730 1.00 1.20 C ATOM 949 CG1 ILE A1109 -11.886 3.402 2.276 1.00 1.47 C ATOM 950 CG2 ILE A1109 -10.616 4.368 0.276 1.00 1.64 C ATOM 951 CD1 ILE A1109 -10.558 3.036 2.955 1.00 1.72 C ATOM 0 H ILE A1109 -13.871 5.273 1.614 1.00 1.27 H new ATOM 0 HA ILE A1109 -12.894 4.268 -0.968 1.00 1.08 H new ATOM 0 HB ILE A1109 -11.712 2.499 0.379 1.00 1.20 H new ATOM 0 HG12 ILE A1109 -12.237 4.349 2.686 1.00 1.47 H new ATOM 0 HG13 ILE A1109 -12.629 2.647 2.534 1.00 1.47 H new ATOM 0 HG21 ILE A1109 -9.705 3.969 0.721 1.00 1.64 H new ATOM 0 HG22 ILE A1109 -10.535 4.332 -0.810 1.00 1.64 H new ATOM 0 HG23 ILE A1109 -10.754 5.401 0.595 1.00 1.64 H new ATOM 0 HD11 ILE A1109 -10.706 2.974 4.033 1.00 1.72 H new ATOM 0 HD12 ILE A1109 -10.211 2.073 2.580 1.00 1.72 H new ATOM 0 HD13 ILE A1109 -9.814 3.801 2.734 1.00 1.72 H new ATOM 963 N ASP A1110 -14.653 2.523 -1.024 1.00 0.70 N ATOM 964 CA ASP A1110 -15.622 1.412 -1.090 1.00 0.73 C ATOM 965 C ASP A1110 -14.930 0.103 -0.662 1.00 0.79 C ATOM 966 O ASP A1110 -14.466 -0.671 -1.495 1.00 0.78 O ATOM 967 CB ASP A1110 -16.240 1.338 -2.497 1.00 0.79 C ATOM 968 CG ASP A1110 -17.330 0.265 -2.587 1.00 0.93 C ATOM 969 OD1 ASP A1110 -18.254 0.280 -1.744 1.00 2.04 O ATOM 970 OD2 ASP A1110 -17.254 -0.622 -3.472 1.00 1.71 O ATOM 0 H ASP A1110 -14.277 2.792 -1.933 1.00 0.70 H new ATOM 0 HA ASP A1110 -16.446 1.581 -0.397 1.00 0.73 H new ATOM 0 HB2 ASP A1110 -16.663 2.308 -2.759 1.00 0.79 H new ATOM 0 HB3 ASP A1110 -15.458 1.124 -3.226 1.00 0.79 H new ATOM 975 N PHE A1111 -14.775 -0.119 0.643 1.00 0.92 N ATOM 976 CA PHE A1111 -13.906 -1.168 1.191 1.00 1.02 C ATOM 977 C PHE A1111 -14.467 -2.597 1.094 1.00 1.02 C ATOM 978 O PHE A1111 -15.495 -2.898 1.710 1.00 1.12 O ATOM 979 CB PHE A1111 -13.575 -0.791 2.641 1.00 1.21 C ATOM 980 CG PHE A1111 -12.262 -1.344 3.144 1.00 1.30 C ATOM 981 CD1 PHE A1111 -11.092 -0.602 2.902 1.00 1.38 C ATOM 982 CD2 PHE A1111 -12.189 -2.548 3.873 1.00 3.23 C ATOM 983 CE1 PHE A1111 -9.860 -1.042 3.391 1.00 1.41 C ATOM 984 CE2 PHE A1111 -10.951 -2.977 4.384 1.00 3.33 C ATOM 985 CZ PHE A1111 -9.788 -2.234 4.129 1.00 1.56 C ATOM 0 H PHE A1111 -15.253 0.428 1.359 1.00 0.92 H new ATOM 0 HA PHE A1111 -13.008 -1.206 0.574 1.00 1.02 H new ATOM 0 HB2 PHE A1111 -13.554 0.296 2.726 1.00 1.21 H new ATOM 0 HB3 PHE A1111 -14.377 -1.146 3.288 1.00 1.21 H new ATOM 0 HD1 PHE A1111 -11.147 0.315 2.334 1.00 1.38 H new ATOM 0 HD2 PHE A1111 -13.079 -3.138 4.038 1.00 3.23 H new ATOM 0 HE1 PHE A1111 -8.966 -0.467 3.202 1.00 1.41 H new ATOM 0 HE2 PHE A1111 -10.895 -3.880 4.974 1.00 3.33 H new ATOM 0 HZ PHE A1111 -8.835 -2.580 4.501 1.00 1.56 H new ATOM 995 N GLN A1112 -13.770 -3.487 0.373 1.00 0.98 N ATOM 996 CA GLN A1112 -14.006 -4.938 0.307 1.00 0.98 C ATOM 997 C GLN A1112 -12.704 -5.725 0.578 1.00 0.97 C ATOM 998 O GLN A1112 -11.609 -5.245 0.273 1.00 0.85 O ATOM 999 CB GLN A1112 -14.585 -5.328 -1.065 1.00 1.13 C ATOM 1000 CG GLN A1112 -15.962 -4.726 -1.397 1.00 1.83 C ATOM 1001 CD GLN A1112 -17.093 -5.290 -0.537 1.00 2.27 C ATOM 1002 OE1 GLN A1112 -17.649 -6.352 -0.804 1.00 2.94 O ATOM 1003 NE2 GLN A1112 -17.449 -4.652 0.553 1.00 2.96 N ATOM 0 H GLN A1112 -12.985 -3.200 -0.211 1.00 0.98 H new ATOM 0 HA GLN A1112 -14.729 -5.196 1.081 1.00 0.98 H new ATOM 0 HB2 GLN A1112 -13.879 -5.024 -1.838 1.00 1.13 H new ATOM 0 HB3 GLN A1112 -14.662 -6.414 -1.112 1.00 1.13 H new ATOM 0 HG2 GLN A1112 -15.919 -3.645 -1.265 1.00 1.83 H new ATOM 0 HG3 GLN A1112 -16.187 -4.910 -2.447 1.00 1.83 H new ATOM 0 HE21 GLN A1112 -17.001 -3.768 0.796 1.00 2.96 H new ATOM 0 HE22 GLN A1112 -18.173 -5.040 1.158 1.00 2.96 H new ATOM 1012 N VAL A1113 -12.811 -6.936 1.138 1.00 1.29 N ATOM 1013 CA VAL A1113 -11.665 -7.728 1.635 1.00 1.42 C ATOM 1014 C VAL A1113 -11.742 -9.191 1.199 1.00 1.53 C ATOM 1015 O VAL A1113 -12.762 -9.852 1.419 1.00 1.59 O ATOM 1016 CB VAL A1113 -11.588 -7.642 3.175 1.00 1.55 C ATOM 1017 CG1 VAL A1113 -10.449 -8.494 3.758 1.00 1.76 C ATOM 1018 CG2 VAL A1113 -11.403 -6.198 3.641 1.00 1.52 C ATOM 0 H VAL A1113 -13.708 -7.406 1.263 1.00 1.29 H new ATOM 0 HA VAL A1113 -10.762 -7.302 1.197 1.00 1.42 H new ATOM 0 HB VAL A1113 -12.537 -8.033 3.541 1.00 1.55 H new ATOM 0 HG11 VAL A1113 -10.441 -8.397 4.844 1.00 1.76 H new ATOM 0 HG12 VAL A1113 -10.602 -9.539 3.489 1.00 1.76 H new ATOM 0 HG13 VAL A1113 -9.496 -8.151 3.356 1.00 1.76 H new ATOM 0 HG21 VAL A1113 -11.352 -6.171 4.729 1.00 1.52 H new ATOM 0 HG22 VAL A1113 -10.479 -5.797 3.225 1.00 1.52 H new ATOM 0 HG23 VAL A1113 -12.246 -5.595 3.302 1.00 1.52 H new ATOM 1028 N VAL A1114 -10.646 -9.718 0.638 1.00 1.61 N ATOM 1029 CA VAL A1114 -10.450 -11.149 0.339 1.00 1.76 C ATOM 1030 C VAL A1114 -9.598 -11.831 1.435 1.00 1.78 C ATOM 1031 O VAL A1114 -8.430 -11.461 1.614 1.00 1.39 O ATOM 1032 CB VAL A1114 -9.930 -11.376 -1.097 1.00 1.73 C ATOM 1033 CG1 VAL A1114 -8.686 -10.562 -1.465 1.00 2.23 C ATOM 1034 CG2 VAL A1114 -9.667 -12.864 -1.367 1.00 3.03 C ATOM 0 H VAL A1114 -9.845 -9.146 0.370 1.00 1.61 H new ATOM 0 HA VAL A1114 -11.422 -11.641 0.363 1.00 1.76 H new ATOM 0 HB VAL A1114 -10.735 -11.014 -1.737 1.00 1.73 H new ATOM 0 HG11 VAL A1114 -8.394 -10.787 -2.491 1.00 2.23 H new ATOM 0 HG12 VAL A1114 -8.908 -9.498 -1.376 1.00 2.23 H new ATOM 0 HG13 VAL A1114 -7.869 -10.820 -0.791 1.00 2.23 H new ATOM 0 HG21 VAL A1114 -9.302 -12.990 -2.386 1.00 3.03 H new ATOM 0 HG22 VAL A1114 -8.920 -13.235 -0.666 1.00 3.03 H new ATOM 0 HG23 VAL A1114 -10.593 -13.426 -1.241 1.00 3.03 H new ATOM 1044 N PRO A1115 -10.142 -12.814 2.191 1.00 2.32 N ATOM 1045 CA PRO A1115 -9.484 -13.386 3.372 1.00 2.48 C ATOM 1046 C PRO A1115 -8.106 -14.012 3.106 1.00 2.15 C ATOM 1047 O PRO A1115 -7.976 -15.008 2.387 1.00 2.54 O ATOM 1048 CB PRO A1115 -10.472 -14.407 3.950 1.00 3.17 C ATOM 1049 CG PRO A1115 -11.822 -13.832 3.545 1.00 3.22 C ATOM 1050 CD PRO A1115 -11.531 -13.273 2.158 1.00 2.86 C ATOM 0 HA PRO A1115 -9.255 -12.586 4.076 1.00 2.48 H new ATOM 0 HB2 PRO A1115 -10.315 -15.403 3.535 1.00 3.17 H new ATOM 0 HB3 PRO A1115 -10.377 -14.494 5.032 1.00 3.17 H new ATOM 0 HG2 PRO A1115 -12.599 -14.596 3.521 1.00 3.22 H new ATOM 0 HG3 PRO A1115 -12.158 -13.057 4.234 1.00 3.22 H new ATOM 0 HD2 PRO A1115 -11.672 -14.036 1.392 1.00 2.86 H new ATOM 0 HD3 PRO A1115 -12.207 -12.453 1.918 1.00 2.86 H new ATOM 1058 N GLY A1116 -7.072 -13.431 3.720 1.00 1.85 N ATOM 1059 CA GLY A1116 -5.682 -13.894 3.673 1.00 1.74 C ATOM 1060 C GLY A1116 -4.845 -13.385 2.491 1.00 1.37 C ATOM 1061 O GLY A1116 -3.629 -13.599 2.485 1.00 1.69 O ATOM 0 H GLY A1116 -7.185 -12.591 4.287 1.00 1.85 H new ATOM 0 HA2 GLY A1116 -5.188 -13.595 4.598 1.00 1.74 H new ATOM 0 HA3 GLY A1116 -5.683 -14.984 3.650 1.00 1.74 H new ATOM 1065 N CYS A1117 -5.451 -12.707 1.509 1.00 1.03 N ATOM 1066 CA CYS A1117 -4.758 -12.245 0.296 1.00 0.85 C ATOM 1067 C CYS A1117 -4.615 -10.716 0.212 1.00 0.69 C ATOM 1068 O CYS A1117 -3.554 -10.237 -0.194 1.00 0.69 O ATOM 1069 CB CYS A1117 -5.469 -12.808 -0.946 1.00 1.13 C ATOM 1070 SG CYS A1117 -5.494 -14.625 -0.923 1.00 1.58 S ATOM 0 H CYS A1117 -6.441 -12.461 1.532 1.00 1.03 H new ATOM 0 HA CYS A1117 -3.738 -12.626 0.342 1.00 0.85 H new ATOM 0 HB2 CYS A1117 -6.490 -12.428 -0.987 1.00 1.13 H new ATOM 0 HB3 CYS A1117 -4.963 -12.460 -1.847 1.00 1.13 H new ATOM 0 HG CYS A1117 -6.103 -15.064 -1.984 1.00 1.58 H new ATOM 1076 N GLY A1118 -5.639 -9.944 0.603 1.00 0.69 N ATOM 1077 CA GLY A1118 -5.593 -8.481 0.525 1.00 0.69 C ATOM 1078 C GLY A1118 -6.940 -7.750 0.524 1.00 0.70 C ATOM 1079 O GLY A1118 -7.993 -8.307 0.840 1.00 0.84 O ATOM 0 H GLY A1118 -6.513 -10.313 0.978 1.00 0.69 H new ATOM 0 HA2 GLY A1118 -5.007 -8.113 1.367 1.00 0.69 H new ATOM 0 HA3 GLY A1118 -5.055 -8.205 -0.382 1.00 0.69 H new ATOM 1083 N ILE A1119 -6.867 -6.468 0.162 1.00 0.65 N ATOM 1084 CA ILE A1119 -7.956 -5.485 0.121 1.00 0.65 C ATOM 1085 C ILE A1119 -8.218 -5.058 -1.329 1.00 0.78 C ATOM 1086 O ILE A1119 -7.281 -4.896 -2.113 1.00 1.07 O ATOM 1087 CB ILE A1119 -7.602 -4.235 0.968 1.00 0.67 C ATOM 1088 CG1 ILE A1119 -6.918 -4.528 2.324 1.00 0.96 C ATOM 1089 CG2 ILE A1119 -8.826 -3.333 1.167 1.00 0.81 C ATOM 1090 CD1 ILE A1119 -7.700 -5.406 3.306 1.00 1.49 C ATOM 0 H ILE A1119 -5.981 -6.057 -0.132 1.00 0.65 H new ATOM 0 HA ILE A1119 -8.851 -5.949 0.536 1.00 0.65 H new ATOM 0 HB ILE A1119 -6.851 -3.712 0.376 1.00 0.67 H new ATOM 0 HG12 ILE A1119 -5.959 -5.007 2.126 1.00 0.96 H new ATOM 0 HG13 ILE A1119 -6.705 -3.577 2.812 1.00 0.96 H new ATOM 0 HG21 ILE A1119 -8.545 -2.466 1.765 1.00 0.81 H new ATOM 0 HG22 ILE A1119 -9.195 -3.001 0.197 1.00 0.81 H new ATOM 0 HG23 ILE A1119 -9.609 -3.890 1.682 1.00 0.81 H new ATOM 0 HD11 ILE A1119 -7.118 -5.539 4.218 1.00 1.49 H new ATOM 0 HD12 ILE A1119 -8.648 -4.926 3.548 1.00 1.49 H new ATOM 0 HD13 ILE A1119 -7.891 -6.378 2.852 1.00 1.49 H new ATOM 1102 N SER A1120 -9.480 -4.788 -1.655 1.00 0.76 N ATOM 1103 CA SER A1120 -9.912 -4.150 -2.907 1.00 0.83 C ATOM 1104 C SER A1120 -10.861 -3.004 -2.556 1.00 0.89 C ATOM 1105 O SER A1120 -11.865 -3.236 -1.879 1.00 1.04 O ATOM 1106 CB SER A1120 -10.598 -5.155 -3.845 1.00 0.91 C ATOM 1107 OG SER A1120 -11.645 -5.848 -3.187 1.00 2.80 O ATOM 0 H SER A1120 -10.260 -5.013 -1.037 1.00 0.76 H new ATOM 0 HA SER A1120 -9.040 -3.768 -3.438 1.00 0.83 H new ATOM 0 HB2 SER A1120 -10.997 -4.630 -4.713 1.00 0.91 H new ATOM 0 HB3 SER A1120 -9.863 -5.870 -4.214 1.00 0.91 H new ATOM 0 HG SER A1120 -12.063 -6.478 -3.810 1.00 2.80 H new ATOM 1113 N CYS A1121 -10.552 -1.773 -2.962 1.00 0.83 N ATOM 1114 CA CYS A1121 -11.434 -0.632 -2.704 1.00 0.90 C ATOM 1115 C CYS A1121 -11.463 0.381 -3.861 1.00 0.80 C ATOM 1116 O CYS A1121 -10.669 0.300 -4.804 1.00 0.79 O ATOM 1117 CB CYS A1121 -11.117 -0.037 -1.314 1.00 1.14 C ATOM 1118 SG CYS A1121 -9.574 0.910 -1.315 1.00 1.23 S ATOM 0 H CYS A1121 -9.699 -1.539 -3.470 1.00 0.83 H new ATOM 0 HA CYS A1121 -12.467 -0.979 -2.667 1.00 0.90 H new ATOM 0 HB2 CYS A1121 -11.938 0.608 -1.000 1.00 1.14 H new ATOM 0 HB3 CYS A1121 -11.047 -0.842 -0.583 1.00 1.14 H new ATOM 0 HG CYS A1121 -9.358 1.388 -0.126 1.00 1.23 H new ATOM 1124 N LYS A1122 -12.391 1.344 -3.787 1.00 0.80 N ATOM 1125 CA LYS A1122 -12.556 2.402 -4.794 1.00 0.90 C ATOM 1126 C LYS A1122 -12.409 3.734 -4.081 1.00 0.94 C ATOM 1127 O LYS A1122 -13.131 3.937 -3.114 1.00 1.18 O ATOM 1128 CB LYS A1122 -13.941 2.250 -5.450 1.00 1.08 C ATOM 1129 CG LYS A1122 -14.056 2.973 -6.797 1.00 1.58 C ATOM 1130 CD LYS A1122 -13.343 2.227 -7.932 1.00 1.51 C ATOM 1131 CE LYS A1122 -14.278 1.392 -8.808 1.00 1.82 C ATOM 1132 NZ LYS A1122 -14.874 0.230 -8.106 1.00 2.20 N ATOM 0 H LYS A1122 -13.057 1.412 -3.017 1.00 0.80 H new ATOM 0 HA LYS A1122 -11.808 2.338 -5.584 1.00 0.90 H new ATOM 0 HB2 LYS A1122 -14.153 1.191 -5.595 1.00 1.08 H new ATOM 0 HB3 LYS A1122 -14.701 2.637 -4.772 1.00 1.08 H new ATOM 0 HG2 LYS A1122 -15.109 3.093 -7.052 1.00 1.58 H new ATOM 0 HG3 LYS A1122 -13.635 3.974 -6.705 1.00 1.58 H new ATOM 0 HD2 LYS A1122 -12.824 2.951 -8.560 1.00 1.51 H new ATOM 0 HD3 LYS A1122 -12.583 1.574 -7.503 1.00 1.51 H new ATOM 0 HE2 LYS A1122 -15.079 2.030 -9.180 1.00 1.82 H new ATOM 0 HE3 LYS A1122 -13.725 1.036 -9.677 1.00 1.82 H new ATOM 0 HZ1 LYS A1122 -15.495 -0.289 -8.759 1.00 2.20 H new ATOM 0 HZ2 LYS A1122 -14.117 -0.401 -7.774 1.00 2.20 H new ATOM 0 HZ3 LYS A1122 -15.429 0.563 -7.292 1.00 2.20 H new ATOM 1146 N VAL A1123 -11.493 4.603 -4.507 1.00 0.88 N ATOM 1147 CA VAL A1123 -11.100 5.813 -3.762 1.00 0.88 C ATOM 1148 C VAL A1123 -11.441 7.097 -4.519 1.00 0.94 C ATOM 1149 O VAL A1123 -11.338 7.139 -5.748 1.00 1.03 O ATOM 1150 CB VAL A1123 -9.623 5.721 -3.325 1.00 0.90 C ATOM 1151 CG1 VAL A1123 -8.624 5.742 -4.482 1.00 1.28 C ATOM 1152 CG2 VAL A1123 -9.255 6.826 -2.336 1.00 1.11 C ATOM 0 H VAL A1123 -10.993 4.491 -5.389 1.00 0.88 H new ATOM 0 HA VAL A1123 -11.695 5.865 -2.850 1.00 0.88 H new ATOM 0 HB VAL A1123 -9.546 4.746 -2.844 1.00 0.90 H new ATOM 0 HG11 VAL A1123 -7.610 5.673 -4.088 1.00 1.28 H new ATOM 0 HG12 VAL A1123 -8.815 4.896 -5.143 1.00 1.28 H new ATOM 0 HG13 VAL A1123 -8.734 6.671 -5.041 1.00 1.28 H new ATOM 0 HG21 VAL A1123 -8.207 6.727 -2.053 1.00 1.11 H new ATOM 0 HG22 VAL A1123 -9.414 7.799 -2.801 1.00 1.11 H new ATOM 0 HG23 VAL A1123 -9.881 6.742 -1.447 1.00 1.11 H new ATOM 1162 N THR A1124 -11.859 8.142 -3.794 1.00 0.94 N ATOM 1163 CA THR A1124 -12.318 9.419 -4.385 1.00 1.06 C ATOM 1164 C THR A1124 -12.016 10.588 -3.439 1.00 1.03 C ATOM 1165 O THR A1124 -11.210 10.428 -2.533 1.00 1.00 O ATOM 1166 CB THR A1124 -13.811 9.327 -4.750 1.00 1.21 C ATOM 1167 OG1 THR A1124 -14.132 10.436 -5.557 1.00 1.34 O ATOM 1168 CG2 THR A1124 -14.757 9.307 -3.548 1.00 1.22 C ATOM 0 H THR A1124 -11.891 8.132 -2.775 1.00 0.94 H new ATOM 0 HA THR A1124 -11.770 9.609 -5.308 1.00 1.06 H new ATOM 0 HB THR A1124 -13.952 8.376 -5.263 1.00 1.21 H new ATOM 0 HG1 THR A1124 -15.080 10.398 -5.804 1.00 1.34 H new ATOM 0 HG21 THR A1124 -15.787 9.241 -3.897 1.00 1.22 H new ATOM 0 HG22 THR A1124 -14.530 8.445 -2.921 1.00 1.22 H new ATOM 0 HG23 THR A1124 -14.628 10.221 -2.968 1.00 1.22 H new ATOM 1176 N ASN A1125 -12.597 11.777 -3.621 1.00 1.22 N ATOM 1177 CA ASN A1125 -12.355 12.970 -2.790 1.00 1.27 C ATOM 1178 C ASN A1125 -10.939 13.582 -2.938 1.00 1.50 C ATOM 1179 O ASN A1125 -10.544 14.449 -2.153 1.00 1.72 O ATOM 1180 CB ASN A1125 -12.764 12.713 -1.314 1.00 1.37 C ATOM 1181 CG ASN A1125 -14.194 12.281 -1.100 1.00 2.66 C ATOM 1182 OD1 ASN A1125 -14.473 11.223 -0.548 1.00 4.15 O ATOM 1183 ND2 ASN A1125 -15.146 13.078 -1.495 1.00 3.14 N ATOM 0 H ASN A1125 -13.268 11.946 -4.370 1.00 1.22 H new ATOM 0 HA ASN A1125 -13.009 13.750 -3.181 1.00 1.27 H new ATOM 0 HB2 ASN A1125 -12.106 11.948 -0.901 1.00 1.37 H new ATOM 0 HB3 ASN A1125 -12.589 13.625 -0.743 1.00 1.37 H new ATOM 0 HD21 ASN A1125 -16.122 12.821 -1.345 1.00 3.14 H new ATOM 0 HD22 ASN A1125 -14.916 13.959 -1.955 1.00 3.14 H new ATOM 1951 N GLN A1177 -11.717 9.344 -9.783 1.00 1.72 N ATOM 1952 CA GLN A1177 -11.998 8.113 -9.035 1.00 1.38 C ATOM 1953 C GLN A1177 -11.035 6.992 -9.466 1.00 1.31 C ATOM 1954 O GLN A1177 -10.795 6.818 -10.666 1.00 1.47 O ATOM 1955 CB GLN A1177 -13.471 7.728 -9.241 1.00 1.42 C ATOM 1956 CG GLN A1177 -14.407 8.751 -8.578 1.00 1.89 C ATOM 1957 CD GLN A1177 -15.812 8.713 -9.125 1.00 2.53 C ATOM 1958 OE1 GLN A1177 -16.214 9.515 -9.962 1.00 4.06 O ATOM 1959 NE2 GLN A1177 -16.628 7.806 -8.667 1.00 2.19 N ATOM 0 HA GLN A1177 -11.835 8.274 -7.969 1.00 1.38 H new ATOM 0 HB2 GLN A1177 -13.689 7.668 -10.307 1.00 1.42 H new ATOM 0 HB3 GLN A1177 -13.654 6.738 -8.822 1.00 1.42 H new ATOM 0 HG2 GLN A1177 -14.437 8.564 -7.505 1.00 1.89 H new ATOM 0 HG3 GLN A1177 -13.997 9.752 -8.716 1.00 1.89 H new ATOM 0 HE21 GLN A1177 -16.305 7.134 -7.971 1.00 2.19 H new ATOM 0 HE22 GLN A1177 -17.590 7.768 -9.005 1.00 2.19 H new ATOM 1968 N TYR A1178 -10.486 6.237 -8.509 1.00 1.17 N ATOM 1969 CA TYR A1178 -9.556 5.122 -8.767 1.00 1.15 C ATOM 1970 C TYR A1178 -9.994 3.785 -8.153 1.00 1.03 C ATOM 1971 O TYR A1178 -10.416 3.736 -6.997 1.00 0.98 O ATOM 1972 CB TYR A1178 -8.149 5.452 -8.248 1.00 1.31 C ATOM 1973 CG TYR A1178 -7.322 6.453 -9.032 1.00 1.25 C ATOM 1974 CD1 TYR A1178 -7.030 6.229 -10.392 1.00 2.81 C ATOM 1975 CD2 TYR A1178 -6.731 7.540 -8.359 1.00 1.71 C ATOM 1976 CE1 TYR A1178 -6.148 7.088 -11.075 1.00 2.95 C ATOM 1977 CE2 TYR A1178 -5.843 8.401 -9.035 1.00 1.72 C ATOM 1978 CZ TYR A1178 -5.548 8.173 -10.397 1.00 1.53 C ATOM 1979 OH TYR A1178 -4.683 8.981 -11.064 1.00 1.78 O ATOM 0 H TYR A1178 -10.675 6.382 -7.517 1.00 1.17 H new ATOM 0 HA TYR A1178 -9.556 5.003 -9.851 1.00 1.15 H new ATOM 0 HB2 TYR A1178 -8.247 5.824 -7.228 1.00 1.31 H new ATOM 0 HB3 TYR A1178 -7.585 4.521 -8.194 1.00 1.31 H new ATOM 0 HD1 TYR A1178 -7.483 5.397 -10.911 1.00 2.81 H new ATOM 0 HD2 TYR A1178 -6.960 7.715 -7.318 1.00 1.71 H new ATOM 0 HE1 TYR A1178 -5.930 6.917 -12.119 1.00 2.95 H new ATOM 0 HE2 TYR A1178 -5.390 9.231 -8.514 1.00 1.72 H new ATOM 0 HH TYR A1178 -4.357 9.681 -10.460 1.00 1.78 H new ATOM 1989 N LYS A1179 -9.795 2.683 -8.887 1.00 1.09 N ATOM 1990 CA LYS A1179 -9.906 1.297 -8.396 1.00 1.08 C ATOM 1991 C LYS A1179 -8.526 0.807 -7.951 1.00 1.06 C ATOM 1992 O LYS A1179 -7.585 0.821 -8.745 1.00 1.12 O ATOM 1993 CB LYS A1179 -10.561 0.439 -9.501 1.00 1.19 C ATOM 1994 CG LYS A1179 -11.237 -0.856 -9.016 1.00 1.38 C ATOM 1995 CD LYS A1179 -10.265 -2.013 -8.743 1.00 1.83 C ATOM 1996 CE LYS A1179 -10.986 -3.297 -8.305 1.00 3.09 C ATOM 1997 NZ LYS A1179 -11.747 -3.938 -9.403 1.00 3.18 N ATOM 0 H LYS A1179 -9.543 2.730 -9.874 1.00 1.09 H new ATOM 0 HA LYS A1179 -10.547 1.222 -7.518 1.00 1.08 H new ATOM 0 HB2 LYS A1179 -11.305 1.046 -10.016 1.00 1.19 H new ATOM 0 HB3 LYS A1179 -9.799 0.178 -10.235 1.00 1.19 H new ATOM 0 HG2 LYS A1179 -11.793 -0.642 -8.104 1.00 1.38 H new ATOM 0 HG3 LYS A1179 -11.962 -1.175 -9.764 1.00 1.38 H new ATOM 0 HD2 LYS A1179 -9.684 -2.215 -9.643 1.00 1.83 H new ATOM 0 HD3 LYS A1179 -9.559 -1.715 -7.968 1.00 1.83 H new ATOM 0 HE2 LYS A1179 -10.253 -4.004 -7.917 1.00 3.09 H new ATOM 0 HE3 LYS A1179 -11.667 -3.063 -7.487 1.00 3.09 H new ATOM 0 HZ1 LYS A1179 -12.197 -4.807 -9.052 1.00 3.18 H new ATOM 0 HZ2 LYS A1179 -12.479 -3.284 -9.747 1.00 3.18 H new ATOM 0 HZ3 LYS A1179 -11.100 -4.174 -10.182 1.00 3.18 H new ATOM 2011 N VAL A1180 -8.392 0.407 -6.684 1.00 1.00 N ATOM 2012 CA VAL A1180 -7.093 0.097 -6.057 1.00 0.96 C ATOM 2013 C VAL A1180 -7.116 -1.224 -5.285 1.00 0.91 C ATOM 2014 O VAL A1180 -8.137 -1.607 -4.704 1.00 1.01 O ATOM 2015 CB VAL A1180 -6.579 1.258 -5.176 1.00 0.93 C ATOM 2016 CG1 VAL A1180 -6.555 2.586 -5.942 1.00 2.32 C ATOM 2017 CG2 VAL A1180 -7.398 1.480 -3.901 1.00 2.28 C ATOM 0 H VAL A1180 -9.185 0.286 -6.054 1.00 1.00 H new ATOM 0 HA VAL A1180 -6.384 -0.027 -6.875 1.00 0.96 H new ATOM 0 HB VAL A1180 -5.572 0.951 -4.895 1.00 0.93 H new ATOM 0 HG11 VAL A1180 -6.188 3.377 -5.288 1.00 2.32 H new ATOM 0 HG12 VAL A1180 -5.897 2.496 -6.807 1.00 2.32 H new ATOM 0 HG13 VAL A1180 -7.563 2.831 -6.277 1.00 2.32 H new ATOM 0 HG21 VAL A1180 -6.975 2.311 -3.337 1.00 2.28 H new ATOM 0 HG22 VAL A1180 -8.430 1.710 -4.167 1.00 2.28 H new ATOM 0 HG23 VAL A1180 -7.373 0.577 -3.291 1.00 2.28 H new ATOM 2027 N LEU A1181 -5.988 -1.938 -5.302 1.00 0.80 N ATOM 2028 CA LEU A1181 -5.807 -3.224 -4.622 1.00 0.80 C ATOM 2029 C LEU A1181 -4.482 -3.233 -3.838 1.00 0.78 C ATOM 2030 O LEU A1181 -3.481 -2.678 -4.302 1.00 0.72 O ATOM 2031 CB LEU A1181 -5.875 -4.412 -5.611 1.00 0.96 C ATOM 2032 CG LEU A1181 -7.154 -4.613 -6.451 1.00 1.12 C ATOM 2033 CD1 LEU A1181 -7.198 -3.736 -7.711 1.00 1.43 C ATOM 2034 CD2 LEU A1181 -7.196 -6.050 -6.981 1.00 2.09 C ATOM 0 H LEU A1181 -5.154 -1.630 -5.802 1.00 0.80 H new ATOM 0 HA LEU A1181 -6.630 -3.347 -3.917 1.00 0.80 H new ATOM 0 HB2 LEU A1181 -5.039 -4.312 -6.303 1.00 0.96 H new ATOM 0 HB3 LEU A1181 -5.709 -5.326 -5.040 1.00 0.96 H new ATOM 0 HG LEU A1181 -7.980 -4.360 -5.786 1.00 1.12 H new ATOM 0 HD11 LEU A1181 -8.123 -3.927 -8.255 1.00 1.43 H new ATOM 0 HD12 LEU A1181 -7.156 -2.685 -7.425 1.00 1.43 H new ATOM 0 HD13 LEU A1181 -6.346 -3.973 -8.349 1.00 1.43 H new ATOM 0 HD21 LEU A1181 -8.099 -6.193 -7.574 1.00 2.09 H new ATOM 0 HD22 LEU A1181 -6.320 -6.234 -7.603 1.00 2.09 H new ATOM 0 HD23 LEU A1181 -7.199 -6.747 -6.143 1.00 2.09 H new ATOM 2046 N ILE A1182 -4.480 -3.858 -2.653 1.00 0.84 N ATOM 2047 CA ILE A1182 -3.317 -3.930 -1.746 1.00 0.75 C ATOM 2048 C ILE A1182 -3.245 -5.313 -1.087 1.00 0.68 C ATOM 2049 O ILE A1182 -4.205 -5.722 -0.433 1.00 0.78 O ATOM 2050 CB ILE A1182 -3.371 -2.831 -0.648 1.00 0.76 C ATOM 2051 CG1 ILE A1182 -3.648 -1.430 -1.242 1.00 0.93 C ATOM 2052 CG2 ILE A1182 -2.056 -2.852 0.161 1.00 0.75 C ATOM 2053 CD1 ILE A1182 -3.603 -0.262 -0.246 1.00 1.04 C ATOM 0 H ILE A1182 -5.302 -4.339 -2.287 1.00 0.84 H new ATOM 0 HA ILE A1182 -2.424 -3.762 -2.347 1.00 0.75 H new ATOM 0 HB ILE A1182 -4.205 -3.049 0.020 1.00 0.76 H new ATOM 0 HG12 ILE A1182 -2.919 -1.239 -2.030 1.00 0.93 H new ATOM 0 HG13 ILE A1182 -4.631 -1.444 -1.713 1.00 0.93 H new ATOM 0 HG21 ILE A1182 -2.091 -2.082 0.932 1.00 0.75 H new ATOM 0 HG22 ILE A1182 -1.932 -3.829 0.629 1.00 0.75 H new ATOM 0 HG23 ILE A1182 -1.215 -2.660 -0.506 1.00 0.75 H new ATOM 0 HD11 ILE A1182 -3.811 0.671 -0.770 1.00 1.04 H new ATOM 0 HD12 ILE A1182 -4.352 -0.417 0.531 1.00 1.04 H new ATOM 0 HD13 ILE A1182 -2.614 -0.210 0.209 1.00 1.04 H new ATOM 2065 N GLY A1183 -2.120 -6.026 -1.191 1.00 0.62 N ATOM 2066 CA GLY A1183 -1.964 -7.322 -0.514 1.00 0.66 C ATOM 2067 C GLY A1183 -0.712 -8.124 -0.886 1.00 0.64 C ATOM 2068 O GLY A1183 0.287 -7.571 -1.344 1.00 0.72 O ATOM 0 H GLY A1183 -1.307 -5.733 -1.733 1.00 0.62 H new ATOM 0 HA2 GLY A1183 -1.955 -7.149 0.562 1.00 0.66 H new ATOM 0 HA3 GLY A1183 -2.841 -7.932 -0.732 1.00 0.66 H new ATOM 2072 N ASN A1184 -0.774 -9.441 -0.681 1.00 0.71 N ATOM 2073 CA ASN A1184 0.284 -10.389 -1.049 1.00 0.74 C ATOM 2074 C ASN A1184 0.508 -10.445 -2.581 1.00 0.65 C ATOM 2075 O ASN A1184 -0.375 -10.088 -3.362 1.00 0.58 O ATOM 2076 CB ASN A1184 -0.114 -11.751 -0.446 1.00 0.88 C ATOM 2077 CG ASN A1184 0.770 -12.894 -0.903 1.00 2.12 C ATOM 2078 OD1 ASN A1184 0.454 -13.606 -1.849 1.00 3.36 O ATOM 2079 ND2 ASN A1184 1.928 -13.055 -0.317 1.00 2.98 N ATOM 0 H ASN A1184 -1.579 -9.890 -0.245 1.00 0.71 H new ATOM 0 HA ASN A1184 1.247 -10.073 -0.648 1.00 0.74 H new ATOM 0 HB2 ASN A1184 -0.075 -11.684 0.641 1.00 0.88 H new ATOM 0 HB3 ASN A1184 -1.147 -11.971 -0.715 1.00 0.88 H new ATOM 0 HD21 ASN A1184 2.571 -13.775 -0.647 1.00 2.98 H new ATOM 0 HD22 ASN A1184 2.188 -12.461 0.470 1.00 2.98 H new ATOM 2086 N ARG A1185 1.669 -10.949 -3.032 1.00 0.80 N ATOM 2087 CA ARG A1185 2.056 -10.944 -4.457 1.00 0.87 C ATOM 2088 C ARG A1185 1.127 -11.739 -5.388 1.00 0.99 C ATOM 2089 O ARG A1185 0.929 -11.329 -6.527 1.00 1.07 O ATOM 2090 CB ARG A1185 3.523 -11.409 -4.621 1.00 1.17 C ATOM 2091 CG ARG A1185 3.781 -12.884 -4.251 1.00 1.57 C ATOM 2092 CD ARG A1185 5.222 -13.333 -4.540 1.00 1.87 C ATOM 2093 NE ARG A1185 5.399 -14.752 -4.176 1.00 2.49 N ATOM 2094 CZ ARG A1185 6.285 -15.615 -4.637 1.00 3.22 C ATOM 2095 NH1 ARG A1185 7.173 -15.353 -5.549 1.00 4.04 N ATOM 2096 NH2 ARG A1185 6.275 -16.822 -4.164 1.00 3.91 N ATOM 0 H ARG A1185 2.367 -11.372 -2.421 1.00 0.80 H new ATOM 0 HA ARG A1185 1.953 -9.907 -4.777 1.00 0.87 H new ATOM 0 HB2 ARG A1185 3.826 -11.251 -5.656 1.00 1.17 H new ATOM 0 HB3 ARG A1185 4.161 -10.777 -4.002 1.00 1.17 H new ATOM 0 HG2 ARG A1185 3.566 -13.030 -3.192 1.00 1.57 H new ATOM 0 HG3 ARG A1185 3.090 -13.518 -4.807 1.00 1.57 H new ATOM 0 HD2 ARG A1185 5.450 -13.190 -5.596 1.00 1.87 H new ATOM 0 HD3 ARG A1185 5.922 -12.716 -3.977 1.00 1.87 H new ATOM 0 HE ARG A1185 4.751 -15.114 -3.476 1.00 2.49 H new ATOM 0 HH11 ARG A1185 7.219 -14.422 -5.963 1.00 4.04 H new ATOM 0 HH12 ARG A1185 7.823 -16.078 -5.851 1.00 4.04 H new ATOM 0 HH21 ARG A1185 5.593 -17.085 -3.453 1.00 3.91 H new ATOM 0 HH22 ARG A1185 6.949 -17.508 -4.503 1.00 3.91 H new ATOM 2110 N GLU A1186 0.555 -12.853 -4.930 1.00 1.11 N ATOM 2111 CA GLU A1186 -0.130 -13.821 -5.801 1.00 1.22 C ATOM 2112 C GLU A1186 -1.446 -13.297 -6.402 1.00 1.30 C ATOM 2113 O GLU A1186 -1.548 -13.200 -7.626 1.00 1.54 O ATOM 2114 CB GLU A1186 -0.254 -15.162 -5.056 1.00 1.38 C ATOM 2115 CG GLU A1186 -1.216 -16.161 -5.705 1.00 3.15 C ATOM 2116 CD GLU A1186 -1.152 -17.521 -5.008 1.00 3.66 C ATOM 2117 OE1 GLU A1186 -1.598 -17.647 -3.841 1.00 4.43 O ATOM 2118 OE2 GLU A1186 -0.715 -18.510 -5.642 1.00 4.37 O ATOM 0 H GLU A1186 0.551 -13.114 -3.944 1.00 1.11 H new ATOM 0 HA GLU A1186 0.480 -13.986 -6.689 1.00 1.22 H new ATOM 0 HB2 GLU A1186 0.733 -15.619 -4.989 1.00 1.38 H new ATOM 0 HB3 GLU A1186 -0.585 -14.967 -4.036 1.00 1.38 H new ATOM 0 HG2 GLU A1186 -2.234 -15.773 -5.659 1.00 3.15 H new ATOM 0 HG3 GLU A1186 -0.967 -16.278 -6.760 1.00 3.15 H new ATOM 2125 N TRP A1187 -2.443 -12.896 -5.604 1.00 1.44 N ATOM 2126 CA TRP A1187 -3.723 -12.427 -6.159 1.00 1.61 C ATOM 2127 C TRP A1187 -3.600 -11.101 -6.941 1.00 1.23 C ATOM 2128 O TRP A1187 -4.420 -10.821 -7.824 1.00 1.23 O ATOM 2129 CB TRP A1187 -4.762 -12.330 -5.033 1.00 2.17 C ATOM 2130 CG TRP A1187 -4.752 -11.050 -4.256 1.00 1.10 C ATOM 2131 CD1 TRP A1187 -3.730 -10.583 -3.504 1.00 2.78 C ATOM 2132 CD2 TRP A1187 -5.798 -10.033 -4.178 1.00 0.85 C ATOM 2133 NE1 TRP A1187 -4.058 -9.341 -3.001 1.00 3.69 N ATOM 2134 CE2 TRP A1187 -5.320 -8.949 -3.387 1.00 2.05 C ATOM 2135 CE3 TRP A1187 -7.106 -9.923 -4.695 1.00 2.50 C ATOM 2136 CZ2 TRP A1187 -6.087 -7.802 -3.142 1.00 2.26 C ATOM 2137 CZ3 TRP A1187 -7.898 -8.789 -4.437 1.00 2.42 C ATOM 2138 CH2 TRP A1187 -7.385 -7.727 -3.673 1.00 1.03 C ATOM 0 H TRP A1187 -2.392 -12.886 -4.585 1.00 1.44 H new ATOM 0 HA TRP A1187 -4.054 -13.161 -6.894 1.00 1.61 H new ATOM 0 HB2 TRP A1187 -5.754 -12.465 -5.465 1.00 2.17 H new ATOM 0 HB3 TRP A1187 -4.600 -13.156 -4.341 1.00 2.17 H new ATOM 0 HD1 TRP A1187 -2.800 -11.102 -3.325 1.00 2.78 H new ATOM 0 HE1 TRP A1187 -3.440 -8.781 -2.414 1.00 3.69 H new ATOM 0 HE3 TRP A1187 -7.506 -10.723 -5.300 1.00 2.50 H new ATOM 0 HZ2 TRP A1187 -5.687 -6.989 -2.554 1.00 2.26 H new ATOM 0 HZ3 TRP A1187 -8.903 -8.735 -4.827 1.00 2.42 H new ATOM 0 HH2 TRP A1187 -7.990 -6.851 -3.494 1.00 1.03 H new ATOM 2149 N MET A1188 -2.546 -10.321 -6.664 1.00 1.07 N ATOM 2150 CA MET A1188 -2.167 -9.118 -7.412 1.00 0.98 C ATOM 2151 C MET A1188 -1.647 -9.474 -8.811 1.00 1.01 C ATOM 2152 O MET A1188 -2.119 -8.911 -9.798 1.00 1.09 O ATOM 2153 CB MET A1188 -1.107 -8.320 -6.631 1.00 1.31 C ATOM 2154 CG MET A1188 -1.616 -7.792 -5.285 1.00 2.05 C ATOM 2155 SD MET A1188 -3.020 -6.648 -5.348 1.00 1.97 S ATOM 2156 CE MET A1188 -2.181 -5.183 -5.993 1.00 0.80 C ATOM 0 H MET A1188 -1.914 -10.518 -5.888 1.00 1.07 H new ATOM 0 HA MET A1188 -3.057 -8.500 -7.534 1.00 0.98 H new ATOM 0 HB2 MET A1188 -0.238 -8.955 -6.459 1.00 1.31 H new ATOM 0 HB3 MET A1188 -0.773 -7.480 -7.240 1.00 1.31 H new ATOM 0 HG2 MET A1188 -1.898 -8.645 -4.668 1.00 2.05 H new ATOM 0 HG3 MET A1188 -0.790 -7.292 -4.780 1.00 2.05 H new ATOM 0 HE1 MET A1188 -2.887 -4.354 -6.048 1.00 0.80 H new ATOM 0 HE2 MET A1188 -1.357 -4.915 -5.332 1.00 0.80 H new ATOM 0 HE3 MET A1188 -1.793 -5.395 -6.989 1.00 0.80 H new ATOM 2166 N ILE A1189 -0.747 -10.457 -8.926 1.00 1.18 N ATOM 2167 CA ILE A1189 -0.317 -11.008 -10.224 1.00 1.60 C ATOM 2168 C ILE A1189 -1.532 -11.564 -10.985 1.00 1.77 C ATOM 2169 O ILE A1189 -1.689 -11.283 -12.177 1.00 2.20 O ATOM 2170 CB ILE A1189 0.796 -12.065 -10.010 1.00 1.75 C ATOM 2171 CG1 ILE A1189 2.100 -11.380 -9.532 1.00 2.80 C ATOM 2172 CG2 ILE A1189 1.081 -12.871 -11.292 1.00 2.21 C ATOM 2173 CD1 ILE A1189 3.080 -12.351 -8.860 1.00 2.91 C ATOM 0 H ILE A1189 -0.294 -10.896 -8.124 1.00 1.18 H new ATOM 0 HA ILE A1189 0.112 -10.218 -10.841 1.00 1.60 H new ATOM 0 HB ILE A1189 0.440 -12.758 -9.248 1.00 1.75 H new ATOM 0 HG12 ILE A1189 2.590 -10.911 -10.385 1.00 2.80 H new ATOM 0 HG13 ILE A1189 1.849 -10.584 -8.831 1.00 2.80 H new ATOM 0 HG21 ILE A1189 1.867 -13.600 -11.096 1.00 2.21 H new ATOM 0 HG22 ILE A1189 0.175 -13.390 -11.605 1.00 2.21 H new ATOM 0 HG23 ILE A1189 1.403 -12.194 -12.083 1.00 2.21 H new ATOM 0 HD11 ILE A1189 3.973 -11.809 -8.548 1.00 2.91 H new ATOM 0 HD12 ILE A1189 2.606 -12.801 -7.988 1.00 2.91 H new ATOM 0 HD13 ILE A1189 3.359 -13.133 -9.566 1.00 2.91 H new ATOM 2185 N ARG A1190 -2.452 -12.262 -10.300 1.00 1.62 N ATOM 2186 CA ARG A1190 -3.701 -12.781 -10.890 1.00 1.93 C ATOM 2187 C ARG A1190 -4.590 -11.665 -11.467 1.00 1.74 C ATOM 2188 O ARG A1190 -5.210 -11.879 -12.506 1.00 1.99 O ATOM 2189 CB ARG A1190 -4.439 -13.642 -9.841 1.00 2.11 C ATOM 2190 CG ARG A1190 -5.233 -14.838 -10.400 1.00 2.83 C ATOM 2191 CD ARG A1190 -6.268 -14.474 -11.468 1.00 3.69 C ATOM 2192 NE ARG A1190 -7.299 -15.510 -11.629 1.00 4.09 N ATOM 2193 CZ ARG A1190 -7.278 -16.550 -12.442 1.00 5.37 C ATOM 2194 NH1 ARG A1190 -6.255 -16.893 -13.171 1.00 6.72 N ATOM 2195 NH2 ARG A1190 -8.330 -17.295 -12.553 1.00 5.65 N ATOM 0 H ARG A1190 -2.350 -12.485 -9.310 1.00 1.62 H new ATOM 0 HA ARG A1190 -3.448 -13.410 -11.743 1.00 1.93 H new ATOM 0 HB2 ARG A1190 -3.707 -14.017 -9.126 1.00 2.11 H new ATOM 0 HB3 ARG A1190 -5.125 -13.000 -9.288 1.00 2.11 H new ATOM 0 HG2 ARG A1190 -4.531 -15.557 -10.823 1.00 2.83 H new ATOM 0 HG3 ARG A1190 -5.742 -15.337 -9.575 1.00 2.83 H new ATOM 0 HD2 ARG A1190 -6.744 -13.530 -11.201 1.00 3.69 H new ATOM 0 HD3 ARG A1190 -5.762 -14.318 -12.421 1.00 3.69 H new ATOM 0 HE ARG A1190 -8.129 -15.414 -11.043 1.00 4.09 H new ATOM 0 HH11 ARG A1190 -5.396 -16.343 -13.136 1.00 6.72 H new ATOM 0 HH12 ARG A1190 -6.312 -17.711 -13.777 1.00 6.72 H new ATOM 0 HH21 ARG A1190 -9.168 -17.077 -12.014 1.00 5.65 H new ATOM 0 HH22 ARG A1190 -8.321 -18.100 -13.179 1.00 5.65 H new ATOM 2209 N ASN A1191 -4.619 -10.458 -10.885 1.00 1.38 N ATOM 2210 CA ASN A1191 -5.346 -9.298 -11.440 1.00 1.25 C ATOM 2211 C ASN A1191 -4.921 -8.910 -12.882 1.00 1.35 C ATOM 2212 O ASN A1191 -5.660 -8.200 -13.571 1.00 1.43 O ATOM 2213 CB ASN A1191 -5.179 -8.092 -10.483 1.00 1.07 C ATOM 2214 CG ASN A1191 -6.257 -7.033 -10.676 1.00 1.48 C ATOM 2215 OD1 ASN A1191 -7.418 -7.227 -10.335 1.00 1.63 O ATOM 2216 ND2 ASN A1191 -5.916 -5.895 -11.226 1.00 2.03 N ATOM 0 H ASN A1191 -4.137 -10.253 -10.010 1.00 1.38 H new ATOM 0 HA ASN A1191 -6.393 -9.590 -11.518 1.00 1.25 H new ATOM 0 HB2 ASN A1191 -5.204 -8.446 -9.452 1.00 1.07 H new ATOM 0 HB3 ASN A1191 -4.200 -7.641 -10.642 1.00 1.07 H new ATOM 0 HD21 ASN A1191 -6.617 -5.168 -11.371 1.00 2.03 H new ATOM 0 HD22 ASN A1191 -4.949 -5.735 -11.509 1.00 2.03 H new ATOM 2223 N GLY A1192 -3.752 -9.369 -13.346 1.00 1.54 N ATOM 2224 CA GLY A1192 -3.157 -9.031 -14.648 1.00 1.73 C ATOM 2225 C GLY A1192 -1.920 -8.130 -14.544 1.00 1.55 C ATOM 2226 O GLY A1192 -1.462 -7.590 -15.554 1.00 1.75 O ATOM 0 H GLY A1192 -3.172 -10.010 -12.805 1.00 1.54 H new ATOM 0 HA2 GLY A1192 -2.883 -9.952 -15.163 1.00 1.73 H new ATOM 0 HA3 GLY A1192 -3.907 -8.534 -15.263 1.00 1.73 H new ATOM 2230 N LEU A1193 -1.391 -7.931 -13.334 1.00 1.26 N ATOM 2231 CA LEU A1193 -0.211 -7.107 -13.060 1.00 1.14 C ATOM 2232 C LEU A1193 1.089 -7.852 -13.411 1.00 1.44 C ATOM 2233 O LEU A1193 1.124 -9.087 -13.421 1.00 1.75 O ATOM 2234 CB LEU A1193 -0.247 -6.647 -11.589 1.00 0.77 C ATOM 2235 CG LEU A1193 -1.491 -5.810 -11.221 1.00 0.80 C ATOM 2236 CD1 LEU A1193 -1.581 -5.550 -9.722 1.00 1.18 C ATOM 2237 CD2 LEU A1193 -1.501 -4.437 -11.890 1.00 1.12 C ATOM 0 H LEU A1193 -1.784 -8.352 -12.492 1.00 1.26 H new ATOM 0 HA LEU A1193 -0.230 -6.223 -13.697 1.00 1.14 H new ATOM 0 HB2 LEU A1193 -0.209 -7.525 -10.944 1.00 0.77 H new ATOM 0 HB3 LEU A1193 0.647 -6.060 -11.381 1.00 0.77 H new ATOM 0 HG LEU A1193 -2.332 -6.409 -11.570 1.00 0.80 H new ATOM 0 HD11 LEU A1193 -2.471 -4.958 -9.508 1.00 1.18 H new ATOM 0 HD12 LEU A1193 -1.641 -6.500 -9.191 1.00 1.18 H new ATOM 0 HD13 LEU A1193 -0.696 -5.006 -9.393 1.00 1.18 H new ATOM 0 HD21 LEU A1193 -2.399 -3.895 -11.594 1.00 1.12 H new ATOM 0 HD22 LEU A1193 -0.619 -3.875 -11.581 1.00 1.12 H new ATOM 0 HD23 LEU A1193 -1.492 -4.560 -12.973 1.00 1.12 H new ATOM 2249 N VAL A1194 2.163 -7.097 -13.668 1.00 1.70 N ATOM 2250 CA VAL A1194 3.521 -7.638 -13.862 1.00 2.02 C ATOM 2251 C VAL A1194 4.447 -7.180 -12.735 1.00 1.67 C ATOM 2252 O VAL A1194 4.405 -6.020 -12.308 1.00 1.56 O ATOM 2253 CB VAL A1194 4.073 -7.337 -15.275 1.00 2.61 C ATOM 2254 CG1 VAL A1194 4.825 -6.004 -15.389 1.00 2.91 C ATOM 2255 CG2 VAL A1194 5.013 -8.451 -15.748 1.00 2.92 C ATOM 0 H VAL A1194 2.117 -6.081 -13.749 1.00 1.70 H new ATOM 0 HA VAL A1194 3.468 -8.725 -13.805 1.00 2.02 H new ATOM 0 HB VAL A1194 3.186 -7.274 -15.906 1.00 2.61 H new ATOM 0 HG11 VAL A1194 5.178 -5.872 -16.412 1.00 2.91 H new ATOM 0 HG12 VAL A1194 4.155 -5.185 -15.128 1.00 2.91 H new ATOM 0 HG13 VAL A1194 5.677 -6.007 -14.709 1.00 2.91 H new ATOM 0 HG21 VAL A1194 5.386 -8.213 -16.744 1.00 2.92 H new ATOM 0 HG22 VAL A1194 5.852 -8.537 -15.057 1.00 2.92 H new ATOM 0 HG23 VAL A1194 4.470 -9.396 -15.780 1.00 2.92 H new ATOM 2265 N ILE A1195 5.278 -8.096 -12.248 1.00 1.73 N ATOM 2266 CA ILE A1195 6.152 -7.920 -11.086 1.00 1.34 C ATOM 2267 C ILE A1195 7.628 -8.076 -11.454 1.00 1.26 C ATOM 2268 O ILE A1195 7.991 -8.669 -12.471 1.00 1.66 O ATOM 2269 CB ILE A1195 5.644 -8.805 -9.917 1.00 1.49 C ATOM 2270 CG1 ILE A1195 4.786 -7.932 -8.974 1.00 2.35 C ATOM 2271 CG2 ILE A1195 6.708 -9.607 -9.140 1.00 1.59 C ATOM 2272 CD1 ILE A1195 5.559 -6.940 -8.096 1.00 2.35 C ATOM 0 H ILE A1195 5.367 -9.021 -12.668 1.00 1.73 H new ATOM 0 HA ILE A1195 6.099 -6.894 -10.723 1.00 1.34 H new ATOM 0 HB ILE A1195 5.051 -9.594 -10.380 1.00 1.49 H new ATOM 0 HG12 ILE A1195 4.071 -7.373 -9.577 1.00 2.35 H new ATOM 0 HG13 ILE A1195 4.209 -8.590 -8.324 1.00 2.35 H new ATOM 0 HG21 ILE A1195 6.225 -10.183 -8.351 1.00 1.59 H new ATOM 0 HG22 ILE A1195 7.222 -10.285 -9.821 1.00 1.59 H new ATOM 0 HG23 ILE A1195 7.430 -8.920 -8.698 1.00 1.59 H new ATOM 0 HD11 ILE A1195 4.859 -6.381 -7.475 1.00 2.35 H new ATOM 0 HD12 ILE A1195 6.255 -7.485 -7.458 1.00 2.35 H new ATOM 0 HD13 ILE A1195 6.114 -6.248 -8.730 1.00 2.35 H new ATOM 2284 N ASN A1196 8.470 -7.463 -10.622 1.00 0.94 N ATOM 2285 CA ASN A1196 9.896 -7.263 -10.867 1.00 1.09 C ATOM 2286 C ASN A1196 10.727 -8.024 -9.802 1.00 1.05 C ATOM 2287 O ASN A1196 10.330 -8.084 -8.635 1.00 0.93 O ATOM 2288 CB ASN A1196 10.182 -5.738 -10.918 1.00 1.23 C ATOM 2289 CG ASN A1196 9.116 -4.919 -11.652 1.00 1.56 C ATOM 2290 OD1 ASN A1196 9.234 -4.592 -12.824 1.00 2.29 O ATOM 2291 ND2 ASN A1196 8.032 -4.570 -10.983 1.00 1.98 N ATOM 0 H ASN A1196 8.166 -7.079 -9.727 1.00 0.94 H new ATOM 0 HA ASN A1196 10.196 -7.678 -11.829 1.00 1.09 H new ATOM 0 HB2 ASN A1196 10.273 -5.363 -9.898 1.00 1.23 H new ATOM 0 HB3 ASN A1196 11.145 -5.577 -11.403 1.00 1.23 H new ATOM 0 HD21 ASN A1196 7.299 -4.031 -11.444 1.00 1.98 H new ATOM 0 HD22 ASN A1196 7.927 -4.840 -10.005 1.00 1.98 H new ATOM 2298 N ASN A1197 11.888 -8.578 -10.163 1.00 1.26 N ATOM 2299 CA ASN A1197 12.690 -9.458 -9.289 1.00 1.33 C ATOM 2300 C ASN A1197 13.142 -8.782 -7.973 1.00 1.35 C ATOM 2301 O ASN A1197 13.246 -9.438 -6.936 1.00 1.30 O ATOM 2302 CB ASN A1197 13.900 -9.959 -10.102 1.00 1.75 C ATOM 2303 CG ASN A1197 14.651 -11.081 -9.399 1.00 2.18 C ATOM 2304 OD1 ASN A1197 14.190 -12.213 -9.328 1.00 2.18 O ATOM 2305 ND2 ASN A1197 15.820 -10.807 -8.870 1.00 3.36 N ATOM 0 H ASN A1197 12.308 -8.430 -11.081 1.00 1.26 H new ATOM 0 HA ASN A1197 12.062 -10.291 -8.973 1.00 1.33 H new ATOM 0 HB2 ASN A1197 13.559 -10.309 -11.076 1.00 1.75 H new ATOM 0 HB3 ASN A1197 14.581 -9.128 -10.283 1.00 1.75 H new ATOM 0 HD21 ASN A1197 16.350 -11.539 -8.397 1.00 3.36 H new ATOM 0 HD22 ASN A1197 16.199 -9.862 -8.932 1.00 3.36 H new ATOM 2312 N ASP A1198 13.354 -7.463 -8.011 1.00 1.53 N ATOM 2313 CA ASP A1198 13.861 -6.647 -6.899 1.00 1.71 C ATOM 2314 C ASP A1198 12.870 -6.483 -5.735 1.00 1.60 C ATOM 2315 O ASP A1198 13.259 -6.529 -4.567 1.00 1.78 O ATOM 2316 CB ASP A1198 14.202 -5.257 -7.441 1.00 1.93 C ATOM 2317 CG ASP A1198 14.951 -4.426 -6.409 1.00 2.29 C ATOM 2318 OD1 ASP A1198 16.085 -4.825 -6.049 1.00 2.32 O ATOM 2319 OD2 ASP A1198 14.437 -3.362 -5.989 1.00 3.52 O ATOM 0 H ASP A1198 13.171 -6.911 -8.849 1.00 1.53 H new ATOM 0 HA ASP A1198 14.730 -7.168 -6.498 1.00 1.71 H new ATOM 0 HB2 ASP A1198 14.809 -5.355 -8.341 1.00 1.93 H new ATOM 0 HB3 ASP A1198 13.285 -4.742 -7.729 1.00 1.93 H new ATOM 2324 N VAL A1199 11.592 -6.292 -6.073 1.00 1.38 N ATOM 2325 CA VAL A1199 10.493 -6.139 -5.107 1.00 1.37 C ATOM 2326 C VAL A1199 10.130 -7.468 -4.447 1.00 1.23 C ATOM 2327 O VAL A1199 9.879 -7.496 -3.245 1.00 1.25 O ATOM 2328 CB VAL A1199 9.286 -5.391 -5.707 1.00 1.37 C ATOM 2329 CG1 VAL A1199 8.843 -5.941 -7.063 1.00 1.96 C ATOM 2330 CG2 VAL A1199 8.073 -5.379 -4.773 1.00 1.82 C ATOM 0 H VAL A1199 11.283 -6.238 -7.044 1.00 1.38 H new ATOM 0 HA VAL A1199 10.852 -5.498 -4.302 1.00 1.37 H new ATOM 0 HB VAL A1199 9.650 -4.373 -5.844 1.00 1.37 H new ATOM 0 HG11 VAL A1199 7.990 -5.368 -7.427 1.00 1.96 H new ATOM 0 HG12 VAL A1199 9.665 -5.860 -7.775 1.00 1.96 H new ATOM 0 HG13 VAL A1199 8.558 -6.988 -6.956 1.00 1.96 H new ATOM 0 HG21 VAL A1199 7.254 -4.839 -5.248 1.00 1.82 H new ATOM 0 HG22 VAL A1199 7.762 -6.403 -4.568 1.00 1.82 H new ATOM 0 HG23 VAL A1199 8.339 -4.886 -3.838 1.00 1.82 H new ATOM 2340 N ASN A1200 10.174 -8.587 -5.180 1.00 1.12 N ATOM 2341 CA ASN A1200 10.021 -9.903 -4.559 1.00 1.09 C ATOM 2342 C ASN A1200 11.201 -10.204 -3.609 1.00 1.20 C ATOM 2343 O ASN A1200 10.984 -10.625 -2.475 1.00 1.27 O ATOM 2344 CB ASN A1200 9.834 -10.967 -5.650 1.00 1.18 C ATOM 2345 CG ASN A1200 9.599 -12.328 -5.023 1.00 1.49 C ATOM 2346 OD1 ASN A1200 8.540 -12.605 -4.477 1.00 1.68 O ATOM 2347 ND2 ASN A1200 10.593 -13.180 -5.008 1.00 2.01 N ATOM 0 H ASN A1200 10.313 -8.606 -6.190 1.00 1.12 H new ATOM 0 HA ASN A1200 9.127 -9.917 -3.936 1.00 1.09 H new ATOM 0 HB2 ASN A1200 8.989 -10.701 -6.286 1.00 1.18 H new ATOM 0 HB3 ASN A1200 10.716 -11.001 -6.289 1.00 1.18 H new ATOM 0 HD21 ASN A1200 10.486 -14.080 -4.540 1.00 2.01 H new ATOM 0 HD22 ASN A1200 11.474 -12.944 -5.465 1.00 2.01 H new ATOM 2354 N ASP A1201 12.427 -9.879 -4.029 1.00 1.35 N ATOM 2355 CA ASP A1201 13.658 -9.993 -3.231 1.00 1.61 C ATOM 2356 C ASP A1201 13.675 -9.074 -1.985 1.00 1.65 C ATOM 2357 O ASP A1201 14.252 -9.436 -0.959 1.00 1.84 O ATOM 2358 CB ASP A1201 14.839 -9.714 -4.174 1.00 1.89 C ATOM 2359 CG ASP A1201 16.185 -9.648 -3.463 1.00 2.51 C ATOM 2360 OD1 ASP A1201 16.754 -10.710 -3.115 1.00 2.37 O ATOM 2361 OD2 ASP A1201 16.698 -8.523 -3.267 1.00 3.80 O ATOM 0 H ASP A1201 12.599 -9.516 -4.967 1.00 1.35 H new ATOM 0 HA ASP A1201 13.725 -10.999 -2.817 1.00 1.61 H new ATOM 0 HB2 ASP A1201 14.877 -10.493 -4.935 1.00 1.89 H new ATOM 0 HB3 ASP A1201 14.665 -8.771 -4.692 1.00 1.89 H new ATOM 2366 N PHE A1202 13.019 -7.910 -2.047 1.00 1.59 N ATOM 2367 CA PHE A1202 12.763 -7.024 -0.902 1.00 1.67 C ATOM 2368 C PHE A1202 11.710 -7.601 0.063 1.00 1.43 C ATOM 2369 O PHE A1202 11.915 -7.599 1.280 1.00 1.54 O ATOM 2370 CB PHE A1202 12.347 -5.638 -1.432 1.00 1.79 C ATOM 2371 CG PHE A1202 11.701 -4.714 -0.413 1.00 1.92 C ATOM 2372 CD1 PHE A1202 12.490 -3.889 0.410 1.00 2.13 C ATOM 2373 CD2 PHE A1202 10.297 -4.679 -0.290 1.00 2.81 C ATOM 2374 CE1 PHE A1202 11.878 -3.043 1.355 1.00 2.20 C ATOM 2375 CE2 PHE A1202 9.689 -3.865 0.682 1.00 3.05 C ATOM 2376 CZ PHE A1202 10.480 -3.039 1.500 1.00 2.32 C ATOM 0 H PHE A1202 12.639 -7.546 -2.921 1.00 1.59 H new ATOM 0 HA PHE A1202 13.679 -6.933 -0.319 1.00 1.67 H new ATOM 0 HB2 PHE A1202 13.230 -5.143 -1.837 1.00 1.79 H new ATOM 0 HB3 PHE A1202 11.653 -5.779 -2.260 1.00 1.79 H new ATOM 0 HD1 PHE A1202 13.566 -3.905 0.317 1.00 2.13 H new ATOM 0 HD2 PHE A1202 9.685 -5.281 -0.946 1.00 2.81 H new ATOM 0 HE1 PHE A1202 12.485 -2.395 1.970 1.00 2.20 H new ATOM 0 HE2 PHE A1202 8.616 -3.874 0.800 1.00 3.05 H new ATOM 0 HZ PHE A1202 10.014 -2.403 2.238 1.00 2.32 H new ATOM 2386 N MET A1203 10.587 -8.108 -0.459 1.00 1.19 N ATOM 2387 CA MET A1203 9.483 -8.612 0.368 1.00 1.08 C ATOM 2388 C MET A1203 9.829 -9.938 1.047 1.00 1.08 C ATOM 2389 O MET A1203 9.667 -10.055 2.260 1.00 1.11 O ATOM 2390 CB MET A1203 8.192 -8.761 -0.449 1.00 1.07 C ATOM 2391 CG MET A1203 7.560 -7.415 -0.825 1.00 1.25 C ATOM 2392 SD MET A1203 5.854 -7.532 -1.437 1.00 1.42 S ATOM 2393 CE MET A1203 6.115 -8.645 -2.841 1.00 1.82 C ATOM 0 H MET A1203 10.418 -8.181 -1.462 1.00 1.19 H new ATOM 0 HA MET A1203 9.319 -7.869 1.148 1.00 1.08 H new ATOM 0 HB2 MET A1203 8.407 -9.321 -1.359 1.00 1.07 H new ATOM 0 HB3 MET A1203 7.472 -9.346 0.123 1.00 1.07 H new ATOM 0 HG2 MET A1203 7.576 -6.763 0.049 1.00 1.25 H new ATOM 0 HG3 MET A1203 8.175 -6.939 -1.589 1.00 1.25 H new ATOM 0 HE1 MET A1203 5.439 -8.372 -3.652 1.00 1.82 H new ATOM 0 HE2 MET A1203 7.146 -8.562 -3.184 1.00 1.82 H new ATOM 0 HE3 MET A1203 5.917 -9.672 -2.533 1.00 1.82 H new ATOM 2403 N THR A1204 10.340 -10.923 0.300 1.00 1.11 N ATOM 2404 CA THR A1204 10.613 -12.263 0.847 1.00 1.19 C ATOM 2405 C THR A1204 11.687 -12.237 1.936 1.00 1.19 C ATOM 2406 O THR A1204 11.589 -12.985 2.899 1.00 1.18 O ATOM 2407 CB THR A1204 10.934 -13.271 -0.270 1.00 1.26 C ATOM 2408 OG1 THR A1204 10.774 -14.592 0.211 1.00 2.32 O ATOM 2409 CG2 THR A1204 12.351 -13.162 -0.834 1.00 2.13 C ATOM 0 H THR A1204 10.574 -10.820 -0.687 1.00 1.11 H new ATOM 0 HA THR A1204 9.699 -12.605 1.333 1.00 1.19 H new ATOM 0 HB THR A1204 10.237 -13.032 -1.073 1.00 1.26 H new ATOM 0 HG1 THR A1204 10.979 -15.228 -0.506 1.00 2.32 H new ATOM 0 HG21 THR A1204 12.490 -13.909 -1.615 1.00 2.13 H new ATOM 0 HG22 THR A1204 12.500 -12.167 -1.253 1.00 2.13 H new ATOM 0 HG23 THR A1204 13.074 -13.332 -0.036 1.00 2.13 H new ATOM 2417 N GLU A1205 12.653 -11.316 1.851 1.00 1.33 N ATOM 2418 CA GLU A1205 13.627 -11.083 2.924 1.00 1.47 C ATOM 2419 C GLU A1205 12.960 -10.588 4.220 1.00 1.39 C ATOM 2420 O GLU A1205 13.228 -11.131 5.289 1.00 1.39 O ATOM 2421 CB GLU A1205 14.709 -10.095 2.467 1.00 1.77 C ATOM 2422 CG GLU A1205 15.980 -10.280 3.304 1.00 1.62 C ATOM 2423 CD GLU A1205 16.929 -9.083 3.256 1.00 2.82 C ATOM 2424 OE1 GLU A1205 17.220 -8.544 2.160 1.00 3.62 O ATOM 2425 OE2 GLU A1205 17.420 -8.697 4.344 1.00 3.82 O ATOM 0 H GLU A1205 12.782 -10.712 1.039 1.00 1.33 H new ATOM 0 HA GLU A1205 14.093 -12.043 3.146 1.00 1.47 H new ATOM 0 HB2 GLU A1205 14.933 -10.252 1.412 1.00 1.77 H new ATOM 0 HB3 GLU A1205 14.344 -9.073 2.567 1.00 1.77 H new ATOM 0 HG2 GLU A1205 15.698 -10.467 4.340 1.00 1.62 H new ATOM 0 HG3 GLU A1205 16.509 -11.166 2.953 1.00 1.62 H new ATOM 2432 N HIS A1206 12.045 -9.613 4.141 1.00 1.40 N ATOM 2433 CA HIS A1206 11.307 -9.131 5.314 1.00 1.41 C ATOM 2434 C HIS A1206 10.356 -10.203 5.880 1.00 1.24 C ATOM 2435 O HIS A1206 10.234 -10.327 7.101 1.00 1.34 O ATOM 2436 CB HIS A1206 10.566 -7.825 4.971 1.00 1.59 C ATOM 2437 CG HIS A1206 11.453 -6.600 4.906 1.00 1.32 C ATOM 2438 ND1 HIS A1206 12.468 -6.275 5.779 1.00 2.78 N ATOM 2439 CD2 HIS A1206 11.374 -5.576 3.999 1.00 1.65 C ATOM 2440 CE1 HIS A1206 13.003 -5.105 5.402 1.00 3.17 C ATOM 2441 NE2 HIS A1206 12.370 -4.638 4.312 1.00 2.39 N ATOM 0 H HIS A1206 11.798 -9.141 3.271 1.00 1.40 H new ATOM 0 HA HIS A1206 12.026 -8.918 6.105 1.00 1.41 H new ATOM 0 HB2 HIS A1206 10.066 -7.947 4.010 1.00 1.59 H new ATOM 0 HB3 HIS A1206 9.789 -7.656 5.716 1.00 1.59 H new ATOM 0 HD2 HIS A1206 10.668 -5.503 3.185 1.00 1.65 H new ATOM 0 HE1 HIS A1206 13.823 -4.610 5.901 1.00 3.17 H new ATOM 0 HE2 HIS A1206 12.573 -3.773 3.811 1.00 2.39 H new ATOM 2449 N GLU A1207 9.737 -11.027 5.028 1.00 1.07 N ATOM 2450 CA GLU A1207 8.918 -12.175 5.453 1.00 1.07 C ATOM 2451 C GLU A1207 9.765 -13.310 6.071 1.00 1.15 C ATOM 2452 O GLU A1207 9.310 -13.970 7.004 1.00 1.33 O ATOM 2453 CB GLU A1207 8.076 -12.699 4.273 1.00 1.02 C ATOM 2454 CG GLU A1207 7.030 -11.687 3.780 1.00 1.76 C ATOM 2455 CD GLU A1207 6.068 -12.283 2.740 1.00 2.12 C ATOM 2456 OE1 GLU A1207 6.509 -12.838 1.702 1.00 2.81 O ATOM 2457 OE2 GLU A1207 4.834 -12.200 2.954 1.00 2.83 O ATOM 0 H GLU A1207 9.789 -10.918 4.015 1.00 1.07 H new ATOM 0 HA GLU A1207 8.249 -11.821 6.237 1.00 1.07 H new ATOM 0 HB2 GLU A1207 8.740 -12.957 3.448 1.00 1.02 H new ATOM 0 HB3 GLU A1207 7.571 -13.616 4.575 1.00 1.02 H new ATOM 0 HG2 GLU A1207 6.456 -11.321 4.631 1.00 1.76 H new ATOM 0 HG3 GLU A1207 7.540 -10.827 3.346 1.00 1.76 H new ATOM 2464 N ARG A1208 10.997 -13.539 5.590 1.00 1.13 N ATOM 2465 CA ARG A1208 11.969 -14.501 6.152 1.00 1.28 C ATOM 2466 C ARG A1208 12.570 -14.041 7.485 1.00 1.42 C ATOM 2467 O ARG A1208 12.802 -14.868 8.366 1.00 1.70 O ATOM 2468 CB ARG A1208 13.046 -14.794 5.094 1.00 1.31 C ATOM 2469 CG ARG A1208 13.959 -15.968 5.478 1.00 1.85 C ATOM 2470 CD ARG A1208 14.891 -16.364 4.326 1.00 2.13 C ATOM 2471 NE ARG A1208 15.931 -15.352 4.070 1.00 3.72 N ATOM 2472 CZ ARG A1208 16.032 -14.526 3.046 1.00 4.87 C ATOM 2473 NH1 ARG A1208 15.180 -14.458 2.068 1.00 4.78 N ATOM 2474 NH2 ARG A1208 17.031 -13.707 2.975 1.00 6.70 N ATOM 0 H ARG A1208 11.359 -13.046 4.774 1.00 1.13 H new ATOM 0 HA ARG A1208 11.441 -15.424 6.393 1.00 1.28 H new ATOM 0 HB2 ARG A1208 12.562 -15.013 4.142 1.00 1.31 H new ATOM 0 HB3 ARG A1208 13.654 -13.902 4.945 1.00 1.31 H new ATOM 0 HG2 ARG A1208 14.554 -15.696 6.350 1.00 1.85 H new ATOM 0 HG3 ARG A1208 13.349 -16.825 5.763 1.00 1.85 H new ATOM 0 HD2 ARG A1208 15.365 -17.318 4.558 1.00 2.13 H new ATOM 0 HD3 ARG A1208 14.302 -16.513 3.421 1.00 2.13 H new ATOM 0 HE ARG A1208 16.666 -15.281 4.774 1.00 3.72 H new ATOM 0 HH11 ARG A1208 14.365 -15.071 2.058 1.00 4.78 H new ATOM 0 HH12 ARG A1208 15.326 -13.792 1.310 1.00 4.78 H new ATOM 0 HH21 ARG A1208 17.739 -13.701 3.710 1.00 6.70 H new ATOM 0 HH22 ARG A1208 17.111 -13.068 2.184 1.00 6.70 H new ATOM 2488 N LYS A1209 12.759 -12.727 7.654 1.00 1.31 N ATOM 2489 CA LYS A1209 13.077 -12.124 8.964 1.00 1.48 C ATOM 2490 C LYS A1209 11.892 -12.358 9.909 1.00 1.61 C ATOM 2491 O LYS A1209 12.062 -12.928 10.985 1.00 2.25 O ATOM 2492 CB LYS A1209 13.453 -10.633 8.840 1.00 1.55 C ATOM 2493 CG LYS A1209 14.971 -10.387 8.802 1.00 2.02 C ATOM 2494 CD LYS A1209 15.654 -10.719 7.468 1.00 1.67 C ATOM 2495 CE LYS A1209 17.141 -10.358 7.591 1.00 2.23 C ATOM 2496 NZ LYS A1209 17.912 -10.642 6.360 1.00 2.30 N ATOM 0 H LYS A1209 12.697 -12.050 6.893 1.00 1.31 H new ATOM 0 HA LYS A1209 13.961 -12.606 9.381 1.00 1.48 H new ATOM 0 HB2 LYS A1209 13.004 -10.227 7.934 1.00 1.55 H new ATOM 0 HB3 LYS A1209 13.025 -10.087 9.680 1.00 1.55 H new ATOM 0 HG2 LYS A1209 15.159 -9.339 9.037 1.00 2.02 H new ATOM 0 HG3 LYS A1209 15.439 -10.979 9.589 1.00 2.02 H new ATOM 0 HD2 LYS A1209 15.537 -11.777 7.234 1.00 1.67 H new ATOM 0 HD3 LYS A1209 15.192 -10.159 6.654 1.00 1.67 H new ATOM 0 HE2 LYS A1209 17.233 -9.299 7.834 1.00 2.23 H new ATOM 0 HE3 LYS A1209 17.576 -10.914 8.421 1.00 2.23 H new ATOM 0 HZ1 LYS A1209 18.929 -10.639 6.579 1.00 2.30 H new ATOM 0 HZ2 LYS A1209 17.640 -11.574 5.988 1.00 2.30 H new ATOM 0 HZ3 LYS A1209 17.709 -9.912 5.647 1.00 2.30 H new ATOM 2510 N GLY A1210 10.687 -12.017 9.448 1.00 1.48 N ATOM 2511 CA GLY A1210 9.420 -12.287 10.142 1.00 1.59 C ATOM 2512 C GLY A1210 8.597 -11.021 10.397 1.00 1.44 C ATOM 2513 O GLY A1210 8.111 -10.794 11.510 1.00 1.60 O ATOM 0 H GLY A1210 10.559 -11.533 8.559 1.00 1.48 H new ATOM 0 HA2 GLY A1210 8.829 -12.985 9.549 1.00 1.59 H new ATOM 0 HA3 GLY A1210 9.630 -12.775 11.094 1.00 1.59 H new ATOM 2517 N ARG A1211 8.498 -10.170 9.371 1.00 1.25 N ATOM 2518 CA ARG A1211 7.646 -8.973 9.260 1.00 1.21 C ATOM 2519 C ARG A1211 6.491 -9.243 8.280 1.00 1.28 C ATOM 2520 O ARG A1211 6.466 -10.292 7.628 1.00 1.68 O ATOM 2521 CB ARG A1211 8.513 -7.791 8.781 1.00 1.28 C ATOM 2522 CG ARG A1211 9.667 -7.443 9.735 1.00 1.48 C ATOM 2523 CD ARG A1211 10.448 -6.227 9.228 1.00 2.29 C ATOM 2524 NE ARG A1211 11.615 -5.958 10.083 1.00 2.71 N ATOM 2525 CZ ARG A1211 12.598 -5.110 9.851 1.00 4.06 C ATOM 2526 NH1 ARG A1211 12.585 -4.305 8.826 1.00 5.28 N ATOM 2527 NH2 ARG A1211 13.624 -5.063 10.647 1.00 4.58 N ATOM 0 H ARG A1211 9.054 -10.308 8.527 1.00 1.25 H new ATOM 0 HA ARG A1211 7.213 -8.727 10.229 1.00 1.21 H new ATOM 0 HB2 ARG A1211 8.924 -8.028 7.800 1.00 1.28 H new ATOM 0 HB3 ARG A1211 7.878 -6.913 8.658 1.00 1.28 H new ATOM 0 HG2 ARG A1211 9.272 -7.237 10.730 1.00 1.48 H new ATOM 0 HG3 ARG A1211 10.337 -8.298 9.828 1.00 1.48 H new ATOM 0 HD2 ARG A1211 10.776 -6.402 8.203 1.00 2.29 H new ATOM 0 HD3 ARG A1211 9.797 -5.353 9.210 1.00 2.29 H new ATOM 0 HE ARG A1211 11.670 -6.487 10.953 1.00 2.71 H new ATOM 0 HH11 ARG A1211 11.799 -4.320 8.176 1.00 5.28 H new ATOM 0 HH12 ARG A1211 13.361 -3.660 8.674 1.00 5.28 H new ATOM 0 HH21 ARG A1211 13.671 -5.684 11.455 1.00 4.58 H new ATOM 0 HH22 ARG A1211 14.382 -4.406 10.464 1.00 4.58 H new ATOM 2541 N THR A1212 5.556 -8.306 8.136 1.00 1.12 N ATOM 2542 CA THR A1212 4.493 -8.348 7.111 1.00 1.06 C ATOM 2543 C THR A1212 4.917 -7.552 5.877 1.00 0.90 C ATOM 2544 O THR A1212 5.403 -6.430 6.023 1.00 0.89 O ATOM 2545 CB THR A1212 3.187 -7.763 7.672 1.00 1.10 C ATOM 2546 OG1 THR A1212 2.832 -8.451 8.850 1.00 1.35 O ATOM 2547 CG2 THR A1212 2.008 -7.886 6.709 1.00 1.10 C ATOM 0 H THR A1212 5.507 -7.480 8.733 1.00 1.12 H new ATOM 0 HA THR A1212 4.328 -9.388 6.830 1.00 1.06 H new ATOM 0 HB THR A1212 3.381 -6.705 7.850 1.00 1.10 H new ATOM 0 HG1 THR A1212 2.000 -8.077 9.209 1.00 1.35 H new ATOM 0 HG21 THR A1212 1.118 -7.454 7.166 1.00 1.10 H new ATOM 0 HG22 THR A1212 2.236 -7.354 5.785 1.00 1.10 H new ATOM 0 HG23 THR A1212 1.828 -8.938 6.487 1.00 1.10 H new ATOM 2555 N ALA A1213 4.706 -8.092 4.671 1.00 0.82 N ATOM 2556 CA ALA A1213 5.033 -7.433 3.402 1.00 0.71 C ATOM 2557 C ALA A1213 3.851 -7.467 2.416 1.00 0.65 C ATOM 2558 O ALA A1213 3.327 -8.545 2.126 1.00 0.68 O ATOM 2559 CB ALA A1213 6.269 -8.121 2.803 1.00 0.74 C ATOM 0 H ALA A1213 4.295 -9.017 4.548 1.00 0.82 H new ATOM 0 HA ALA A1213 5.246 -6.381 3.591 1.00 0.71 H new ATOM 0 HB1 ALA A1213 6.528 -7.645 1.858 1.00 0.74 H new ATOM 0 HB2 ALA A1213 7.106 -8.033 3.496 1.00 0.74 H new ATOM 0 HB3 ALA A1213 6.051 -9.175 2.630 1.00 0.74 H new ATOM 2565 N VAL A1214 3.451 -6.315 1.865 1.00 0.63 N ATOM 2566 CA VAL A1214 2.360 -6.193 0.874 1.00 0.63 C ATOM 2567 C VAL A1214 2.698 -5.193 -0.238 1.00 0.55 C ATOM 2568 O VAL A1214 3.473 -4.258 -0.037 1.00 0.57 O ATOM 2569 CB VAL A1214 1.004 -5.826 1.523 1.00 0.83 C ATOM 2570 CG1 VAL A1214 0.506 -6.920 2.473 1.00 1.57 C ATOM 2571 CG2 VAL A1214 1.021 -4.492 2.280 1.00 0.78 C ATOM 0 H VAL A1214 3.882 -5.420 2.096 1.00 0.63 H new ATOM 0 HA VAL A1214 2.260 -7.182 0.427 1.00 0.63 H new ATOM 0 HB VAL A1214 0.321 -5.727 0.680 1.00 0.83 H new ATOM 0 HG11 VAL A1214 -0.448 -6.620 2.905 1.00 1.57 H new ATOM 0 HG12 VAL A1214 0.377 -7.851 1.920 1.00 1.57 H new ATOM 0 HG13 VAL A1214 1.235 -7.069 3.270 1.00 1.57 H new ATOM 0 HG21 VAL A1214 0.036 -4.303 2.707 1.00 0.78 H new ATOM 0 HG22 VAL A1214 1.760 -4.537 3.080 1.00 0.78 H new ATOM 0 HG23 VAL A1214 1.279 -3.687 1.592 1.00 0.78 H new ATOM 2581 N LEU A1215 2.107 -5.378 -1.419 1.00 0.52 N ATOM 2582 CA LEU A1215 2.325 -4.550 -2.610 1.00 0.45 C ATOM 2583 C LEU A1215 1.048 -3.792 -3.024 1.00 0.38 C ATOM 2584 O LEU A1215 -0.063 -4.233 -2.722 1.00 0.45 O ATOM 2585 CB LEU A1215 2.997 -5.424 -3.691 1.00 0.63 C ATOM 2586 CG LEU A1215 2.069 -6.259 -4.586 1.00 1.17 C ATOM 2587 CD1 LEU A1215 1.558 -5.432 -5.769 1.00 2.83 C ATOM 2588 CD2 LEU A1215 2.865 -7.424 -5.172 1.00 1.60 C ATOM 0 H LEU A1215 1.441 -6.133 -1.580 1.00 0.52 H new ATOM 0 HA LEU A1215 3.018 -3.733 -2.410 1.00 0.45 H new ATOM 0 HB2 LEU A1215 3.591 -4.773 -4.332 1.00 0.63 H new ATOM 0 HB3 LEU A1215 3.691 -6.103 -3.195 1.00 0.63 H new ATOM 0 HG LEU A1215 1.230 -6.599 -3.978 1.00 1.17 H new ATOM 0 HD11 LEU A1215 0.903 -6.047 -6.387 1.00 2.83 H new ATOM 0 HD12 LEU A1215 1.003 -4.570 -5.398 1.00 2.83 H new ATOM 0 HD13 LEU A1215 2.403 -5.089 -6.366 1.00 2.83 H new ATOM 0 HD21 LEU A1215 2.216 -8.024 -5.810 1.00 1.60 H new ATOM 0 HD22 LEU A1215 3.696 -7.037 -5.762 1.00 1.60 H new ATOM 0 HD23 LEU A1215 3.252 -8.043 -4.363 1.00 1.60 H new ATOM 2600 N VAL A1216 1.210 -2.658 -3.716 1.00 0.37 N ATOM 2601 CA VAL A1216 0.151 -1.671 -4.017 1.00 0.39 C ATOM 2602 C VAL A1216 -0.017 -1.468 -5.534 1.00 0.35 C ATOM 2603 O VAL A1216 0.974 -1.266 -6.247 1.00 0.36 O ATOM 2604 CB VAL A1216 0.484 -0.314 -3.344 1.00 0.50 C ATOM 2605 CG1 VAL A1216 -0.721 0.635 -3.316 1.00 0.63 C ATOM 2606 CG2 VAL A1216 0.974 -0.446 -1.892 1.00 0.63 C ATOM 0 H VAL A1216 2.115 -2.387 -4.099 1.00 0.37 H new ATOM 0 HA VAL A1216 -0.787 -2.058 -3.620 1.00 0.39 H new ATOM 0 HB VAL A1216 1.285 0.088 -3.965 1.00 0.50 H new ATOM 0 HG11 VAL A1216 -0.436 1.571 -2.835 1.00 0.63 H new ATOM 0 HG12 VAL A1216 -1.049 0.836 -4.336 1.00 0.63 H new ATOM 0 HG13 VAL A1216 -1.535 0.173 -2.757 1.00 0.63 H new ATOM 0 HG21 VAL A1216 1.187 0.544 -1.488 1.00 0.63 H new ATOM 0 HG22 VAL A1216 0.202 -0.925 -1.290 1.00 0.63 H new ATOM 0 HG23 VAL A1216 1.881 -1.050 -1.868 1.00 0.63 H new ATOM 2616 N ALA A1217 -1.262 -1.446 -6.031 1.00 0.35 N ATOM 2617 CA ALA A1217 -1.580 -1.155 -7.439 1.00 0.35 C ATOM 2618 C ALA A1217 -2.834 -0.274 -7.627 1.00 0.37 C ATOM 2619 O ALA A1217 -3.788 -0.350 -6.847 1.00 0.45 O ATOM 2620 CB ALA A1217 -1.721 -2.475 -8.206 1.00 0.38 C ATOM 0 H ALA A1217 -2.087 -1.632 -5.461 1.00 0.35 H new ATOM 0 HA ALA A1217 -0.753 -0.569 -7.840 1.00 0.35 H new ATOM 0 HB1 ALA A1217 -1.957 -2.266 -9.250 1.00 0.38 H new ATOM 0 HB2 ALA A1217 -0.785 -3.030 -8.149 1.00 0.38 H new ATOM 0 HB3 ALA A1217 -2.522 -3.068 -7.765 1.00 0.38 H new ATOM 2626 N VAL A1218 -2.838 0.521 -8.703 1.00 0.41 N ATOM 2627 CA VAL A1218 -3.905 1.462 -9.091 1.00 0.49 C ATOM 2628 C VAL A1218 -4.297 1.215 -10.549 1.00 0.58 C ATOM 2629 O VAL A1218 -3.464 1.356 -11.437 1.00 0.60 O ATOM 2630 CB VAL A1218 -3.441 2.928 -8.919 1.00 0.63 C ATOM 2631 CG1 VAL A1218 -4.539 3.922 -9.324 1.00 0.77 C ATOM 2632 CG2 VAL A1218 -3.026 3.257 -7.478 1.00 0.67 C ATOM 0 H VAL A1218 -2.060 0.529 -9.362 1.00 0.41 H new ATOM 0 HA VAL A1218 -4.765 1.296 -8.442 1.00 0.49 H new ATOM 0 HB VAL A1218 -2.576 3.028 -9.574 1.00 0.63 H new ATOM 0 HG11 VAL A1218 -4.175 4.941 -9.189 1.00 0.77 H new ATOM 0 HG12 VAL A1218 -4.803 3.766 -10.370 1.00 0.77 H new ATOM 0 HG13 VAL A1218 -5.419 3.766 -8.701 1.00 0.77 H new ATOM 0 HG21 VAL A1218 -2.710 4.299 -7.419 1.00 0.67 H new ATOM 0 HG22 VAL A1218 -3.872 3.096 -6.810 1.00 0.67 H new ATOM 0 HG23 VAL A1218 -2.201 2.610 -7.180 1.00 0.67 H new ATOM 2642 N ASP A1219 -5.559 0.862 -10.806 1.00 0.77 N ATOM 2643 CA ASP A1219 -6.162 0.721 -12.145 1.00 0.90 C ATOM 2644 C ASP A1219 -5.275 0.001 -13.196 1.00 0.76 C ATOM 2645 O ASP A1219 -5.020 0.516 -14.290 1.00 0.82 O ATOM 2646 CB ASP A1219 -6.734 2.079 -12.598 1.00 1.20 C ATOM 2647 CG ASP A1219 -7.634 1.992 -13.839 1.00 1.58 C ATOM 2648 OD1 ASP A1219 -8.284 0.944 -14.081 1.00 2.95 O ATOM 2649 OD2 ASP A1219 -7.705 2.994 -14.594 1.00 1.56 O ATOM 0 H ASP A1219 -6.222 0.657 -10.058 1.00 0.77 H new ATOM 0 HA ASP A1219 -6.993 0.021 -12.059 1.00 0.90 H new ATOM 0 HB2 ASP A1219 -7.304 2.514 -11.777 1.00 1.20 H new ATOM 0 HB3 ASP A1219 -5.908 2.759 -12.807 1.00 1.20 H new ATOM 2654 N ASP A1220 -4.814 -1.212 -12.859 1.00 0.85 N ATOM 2655 CA ASP A1220 -3.893 -2.071 -13.638 1.00 1.02 C ATOM 2656 C ASP A1220 -2.424 -1.575 -13.744 1.00 0.88 C ATOM 2657 O ASP A1220 -1.632 -2.127 -14.510 1.00 1.11 O ATOM 2658 CB ASP A1220 -4.564 -2.483 -14.972 1.00 1.39 C ATOM 2659 CG ASP A1220 -3.735 -3.383 -15.886 1.00 3.55 C ATOM 2660 OD1 ASP A1220 -3.604 -4.595 -15.601 1.00 4.25 O ATOM 2661 OD2 ASP A1220 -3.241 -2.904 -16.934 1.00 5.18 O ATOM 0 H ASP A1220 -5.088 -1.653 -11.981 1.00 0.85 H new ATOM 0 HA ASP A1220 -3.735 -2.981 -13.059 1.00 1.02 H new ATOM 0 HB2 ASP A1220 -5.500 -2.993 -14.743 1.00 1.39 H new ATOM 0 HB3 ASP A1220 -4.821 -1.578 -15.522 1.00 1.39 H new ATOM 2666 N GLU A1221 -1.997 -0.583 -12.956 1.00 0.72 N ATOM 2667 CA GLU A1221 -0.586 -0.183 -12.815 1.00 0.77 C ATOM 2668 C GLU A1221 -0.029 -0.465 -11.408 1.00 0.62 C ATOM 2669 O GLU A1221 -0.530 0.048 -10.403 1.00 0.67 O ATOM 2670 CB GLU A1221 -0.406 1.309 -13.181 1.00 0.92 C ATOM 2671 CG GLU A1221 -0.394 1.577 -14.691 1.00 1.41 C ATOM 2672 CD GLU A1221 0.798 0.902 -15.376 1.00 1.96 C ATOM 2673 OE1 GLU A1221 1.948 1.356 -15.150 1.00 3.04 O ATOM 2674 OE2 GLU A1221 0.606 -0.114 -16.091 1.00 2.56 O ATOM 0 H GLU A1221 -2.631 -0.023 -12.386 1.00 0.72 H new ATOM 0 HA GLU A1221 -0.012 -0.794 -13.512 1.00 0.77 H new ATOM 0 HB2 GLU A1221 -1.211 1.885 -12.725 1.00 0.92 H new ATOM 0 HB3 GLU A1221 0.528 1.670 -12.750 1.00 0.92 H new ATOM 0 HG2 GLU A1221 -1.322 1.213 -15.133 1.00 1.41 H new ATOM 0 HG3 GLU A1221 -0.356 2.652 -14.870 1.00 1.41 H new ATOM 2681 N LEU A1222 1.045 -1.262 -11.334 1.00 0.55 N ATOM 2682 CA LEU A1222 1.885 -1.417 -10.135 1.00 0.57 C ATOM 2683 C LEU A1222 2.370 -0.029 -9.702 1.00 0.54 C ATOM 2684 O LEU A1222 2.776 0.749 -10.569 1.00 0.68 O ATOM 2685 CB LEU A1222 3.111 -2.302 -10.488 1.00 0.68 C ATOM 2686 CG LEU A1222 3.373 -3.567 -9.641 1.00 1.05 C ATOM 2687 CD1 LEU A1222 4.189 -3.239 -8.391 1.00 1.26 C ATOM 2688 CD2 LEU A1222 2.114 -4.330 -9.223 1.00 1.92 C ATOM 0 H LEU A1222 1.362 -1.829 -12.120 1.00 0.55 H new ATOM 0 HA LEU A1222 1.318 -1.884 -9.330 1.00 0.57 H new ATOM 0 HB2 LEU A1222 3.007 -2.614 -11.527 1.00 0.68 H new ATOM 0 HB3 LEU A1222 4.001 -1.675 -10.431 1.00 0.68 H new ATOM 0 HG LEU A1222 3.935 -4.223 -10.306 1.00 1.05 H new ATOM 0 HD11 LEU A1222 4.356 -4.150 -7.816 1.00 1.26 H new ATOM 0 HD12 LEU A1222 5.149 -2.813 -8.684 1.00 1.26 H new ATOM 0 HD13 LEU A1222 3.645 -2.519 -7.780 1.00 1.26 H new ATOM 0 HD21 LEU A1222 2.396 -5.202 -8.633 1.00 1.92 H new ATOM 0 HD22 LEU A1222 1.475 -3.679 -8.626 1.00 1.92 H new ATOM 0 HD23 LEU A1222 1.573 -4.654 -10.112 1.00 1.92 H new ATOM 2700 N CYS A1223 2.345 0.285 -8.400 1.00 0.48 N ATOM 2701 CA CYS A1223 2.676 1.636 -7.925 1.00 0.50 C ATOM 2702 C CYS A1223 3.557 1.722 -6.666 1.00 0.56 C ATOM 2703 O CYS A1223 4.240 2.732 -6.497 1.00 0.71 O ATOM 2704 CB CYS A1223 1.379 2.448 -7.803 1.00 0.53 C ATOM 2705 SG CYS A1223 0.431 1.932 -6.352 1.00 0.60 S ATOM 0 H CYS A1223 2.101 -0.373 -7.660 1.00 0.48 H new ATOM 0 HA CYS A1223 3.329 2.075 -8.679 1.00 0.50 H new ATOM 0 HB2 CYS A1223 1.615 3.510 -7.730 1.00 0.53 H new ATOM 0 HB3 CYS A1223 0.777 2.317 -8.702 1.00 0.53 H new ATOM 0 HG CYS A1223 -0.249 2.942 -5.897 1.00 0.60 H new ATOM 2711 N GLY A1224 3.635 0.685 -5.824 1.00 0.50 N ATOM 2712 CA GLY A1224 4.537 0.684 -4.665 1.00 0.52 C ATOM 2713 C GLY A1224 4.528 -0.608 -3.843 1.00 0.44 C ATOM 2714 O GLY A1224 3.840 -1.571 -4.186 1.00 0.39 O ATOM 0 H GLY A1224 3.083 -0.167 -5.924 1.00 0.50 H new ATOM 0 HA2 GLY A1224 5.553 0.869 -5.013 1.00 0.52 H new ATOM 0 HA3 GLY A1224 4.268 1.515 -4.013 1.00 0.52 H new ATOM 2718 N LEU A1225 5.281 -0.610 -2.740 1.00 0.53 N ATOM 2719 CA LEU A1225 5.294 -1.677 -1.730 1.00 0.50 C ATOM 2720 C LEU A1225 5.394 -1.147 -0.286 1.00 0.67 C ATOM 2721 O LEU A1225 5.809 -0.008 -0.058 1.00 0.89 O ATOM 2722 CB LEU A1225 6.357 -2.755 -2.057 1.00 0.53 C ATOM 2723 CG LEU A1225 7.849 -2.373 -2.213 1.00 0.66 C ATOM 2724 CD1 LEU A1225 8.193 -1.818 -3.596 1.00 2.31 C ATOM 2725 CD2 LEU A1225 8.369 -1.374 -1.184 1.00 2.32 C ATOM 0 H LEU A1225 5.919 0.154 -2.516 1.00 0.53 H new ATOM 0 HA LEU A1225 4.322 -2.167 -1.780 1.00 0.50 H new ATOM 0 HB2 LEU A1225 6.300 -3.510 -1.273 1.00 0.53 H new ATOM 0 HB3 LEU A1225 6.050 -3.236 -2.986 1.00 0.53 H new ATOM 0 HG LEU A1225 8.344 -3.331 -2.053 1.00 0.66 H new ATOM 0 HD11 LEU A1225 9.254 -1.571 -3.635 1.00 2.31 H new ATOM 0 HD12 LEU A1225 7.966 -2.567 -4.355 1.00 2.31 H new ATOM 0 HD13 LEU A1225 7.604 -0.920 -3.784 1.00 2.31 H new ATOM 0 HD21 LEU A1225 9.422 -1.169 -1.376 1.00 2.32 H new ATOM 0 HD22 LEU A1225 7.800 -0.447 -1.257 1.00 2.32 H new ATOM 0 HD23 LEU A1225 8.257 -1.791 -0.183 1.00 2.32 H new ATOM 2737 N ILE A1226 5.004 -1.991 0.675 1.00 0.62 N ATOM 2738 CA ILE A1226 4.952 -1.697 2.122 1.00 0.76 C ATOM 2739 C ILE A1226 5.522 -2.871 2.944 1.00 0.72 C ATOM 2740 O ILE A1226 5.108 -4.015 2.747 1.00 0.67 O ATOM 2741 CB ILE A1226 3.486 -1.424 2.565 1.00 0.88 C ATOM 2742 CG1 ILE A1226 2.741 -0.406 1.663 1.00 0.99 C ATOM 2743 CG2 ILE A1226 3.426 -0.988 4.045 1.00 1.03 C ATOM 2744 CD1 ILE A1226 1.252 -0.240 1.993 1.00 1.24 C ATOM 0 H ILE A1226 4.701 -2.942 0.462 1.00 0.62 H new ATOM 0 HA ILE A1226 5.559 -0.811 2.305 1.00 0.76 H new ATOM 0 HB ILE A1226 2.960 -2.372 2.451 1.00 0.88 H new ATOM 0 HG12 ILE A1226 3.230 0.564 1.749 1.00 0.99 H new ATOM 0 HG13 ILE A1226 2.838 -0.720 0.624 1.00 0.99 H new ATOM 0 HG21 ILE A1226 2.390 -0.804 4.328 1.00 1.03 H new ATOM 0 HG22 ILE A1226 3.839 -1.777 4.674 1.00 1.03 H new ATOM 0 HG23 ILE A1226 4.007 -0.075 4.179 1.00 1.03 H new ATOM 0 HD11 ILE A1226 0.808 0.489 1.315 1.00 1.24 H new ATOM 0 HD12 ILE A1226 0.745 -1.198 1.878 1.00 1.24 H new ATOM 0 HD13 ILE A1226 1.144 0.107 3.021 1.00 1.24 H new ATOM 2756 N ALA A1227 6.402 -2.592 3.915 1.00 0.85 N ATOM 2757 CA ALA A1227 6.874 -3.558 4.920 1.00 0.95 C ATOM 2758 C ALA A1227 6.674 -3.045 6.366 1.00 0.92 C ATOM 2759 O ALA A1227 7.005 -1.894 6.670 1.00 0.93 O ATOM 2760 CB ALA A1227 8.338 -3.903 4.623 1.00 1.09 C ATOM 0 H ALA A1227 6.816 -1.667 4.027 1.00 0.85 H new ATOM 0 HA ALA A1227 6.274 -4.465 4.851 1.00 0.95 H new ATOM 0 HB1 ALA A1227 8.700 -4.619 5.361 1.00 1.09 H new ATOM 0 HB2 ALA A1227 8.414 -4.339 3.627 1.00 1.09 H new ATOM 0 HB3 ALA A1227 8.942 -2.997 4.669 1.00 1.09 H new ATOM 2766 N ILE A1228 6.116 -3.889 7.251 1.00 0.94 N ATOM 2767 CA ILE A1228 5.673 -3.521 8.614 1.00 0.93 C ATOM 2768 C ILE A1228 6.159 -4.521 9.679 1.00 1.13 C ATOM 2769 O ILE A1228 5.879 -5.721 9.598 1.00 1.46 O ATOM 2770 CB ILE A1228 4.131 -3.375 8.706 1.00 0.99 C ATOM 2771 CG1 ILE A1228 3.510 -2.622 7.506 1.00 1.14 C ATOM 2772 CG2 ILE A1228 3.784 -2.665 10.029 1.00 1.35 C ATOM 2773 CD1 ILE A1228 1.981 -2.500 7.557 1.00 1.35 C ATOM 0 H ILE A1228 5.955 -4.873 7.036 1.00 0.94 H new ATOM 0 HA ILE A1228 6.129 -2.552 8.819 1.00 0.93 H new ATOM 0 HB ILE A1228 3.700 -4.376 8.679 1.00 0.99 H new ATOM 0 HG12 ILE A1228 3.941 -1.622 7.458 1.00 1.14 H new ATOM 0 HG13 ILE A1228 3.791 -3.135 6.586 1.00 1.14 H new ATOM 0 HG21 ILE A1228 2.703 -2.554 10.110 1.00 1.35 H new ATOM 0 HG22 ILE A1228 4.152 -3.257 10.867 1.00 1.35 H new ATOM 0 HG23 ILE A1228 4.252 -1.681 10.047 1.00 1.35 H new ATOM 0 HD11 ILE A1228 1.630 -1.959 6.678 1.00 1.35 H new ATOM 0 HD12 ILE A1228 1.537 -3.495 7.572 1.00 1.35 H new ATOM 0 HD13 ILE A1228 1.689 -1.959 8.457 1.00 1.35 H new ATOM 2785 N ALA A1229 6.807 -4.005 10.726 1.00 1.07 N ATOM 2786 CA ALA A1229 7.335 -4.744 11.868 1.00 1.28 C ATOM 2787 C ALA A1229 6.420 -4.673 13.109 1.00 1.64 C ATOM 2788 O ALA A1229 5.628 -3.742 13.289 1.00 1.93 O ATOM 2789 CB ALA A1229 8.740 -4.207 12.177 1.00 1.48 C ATOM 0 H ALA A1229 6.986 -3.004 10.801 1.00 1.07 H new ATOM 0 HA ALA A1229 7.382 -5.801 11.607 1.00 1.28 H new ATOM 0 HB1 ALA A1229 9.156 -4.745 13.029 1.00 1.48 H new ATOM 0 HB2 ALA A1229 9.383 -4.349 11.309 1.00 1.48 H new ATOM 0 HB3 ALA A1229 8.680 -3.145 12.413 1.00 1.48 H new