USER MOD reduce.3.24.130724 H: found=0, std=0, add=981, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 979 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A1108 CYS SG : rot 180:sc= 0 USER MOD Set 1.2: A1177 GLN :FLIP amide:sc= 0 F(o=-1.3!,f=0) USER MOD Set 2.1: A1107 THR OG1 : rot -110:sc= 0.454 USER MOD Set 2.2: A1125 ASN : amide:sc= 0.481 X(o=0.94,f=1) USER MOD Set 3.1: A1102 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A1104 THR OG1 : rot 180:sc= 0 USER MOD Single : A1053 THR OG1 : rot 24:sc= 0.168 USER MOD Single : A1057 ASN : amide:sc= -0.0603 X(o=-0.06,f=0) USER MOD Single : A1058 GLN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A1060 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1063 THR OG1 : rot 154:sc= 1.25 USER MOD Single : A1065 SER OG : rot 180:sc= 0 USER MOD Single : A1066 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1069 SER OG : rot 180:sc= 0.31 USER MOD Single : A1070 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A1071 HIS : no HD1:sc= -0.0029 X(o=-0.0029,f=-0.0029) USER MOD Single : A1072 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1079 THR OG1 : rot -80:sc= 1.08 USER MOD Single : A1082 SER OG : rot -75:sc= 1.31 USER MOD Single : A1083 ASN : amide:sc= -0.338 K(o=-0.34,f=-1.8) USER MOD Single : A1084 SER OG : rot 180:sc= 0.00957 USER MOD Single : A1086 HIS : no HE2:sc= 0 K(o=0,f=-1.7) USER MOD Single : A1090 THR OG1 : rot 180:sc= 0 USER MOD Single : A1093 THR OG1 : rot -172:sc= -0.237 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 125:sc= 0.0491 USER MOD Single : A1097 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1098 GLN : amide:sc= -0.0372 K(o=-0.037,f=-2.2!) USER MOD Single : A1112 GLN : amide:sc= 0.0344 X(o=0.034,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 -20:sc= -0.309 USER MOD Single : A1122 LYS NZ :NH3+ -169:sc=-0.00358 (180deg=-0.188) USER MOD Single : A1124 THR OG1 : rot 180:sc= 0 USER MOD Single : A1178 TYR OH : rot 180:sc= 0 USER MOD Single : A1179 LYS NZ :NH3+ 146:sc= 0.608 (180deg=-0.707!) USER MOD Single : A1184 ASN : amide:sc= 0.857 K(o=0.86,f=-8.2!) USER MOD Single : A1188 MET CE :methyl 162:sc= 0 (180deg=-0.399) USER MOD Single : A1191 ASN : amide:sc= 0.423 X(o=0.42,f=0) USER MOD Single : A1196 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1197 ASN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A1200 ASN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A1203 MET CE :methyl 160:sc= -0.22 (180deg=-1.15) USER MOD Single : A1204 THR OG1 : rot 180:sc= 0 USER MOD Single : A1206 HIS : no HD1:sc=-0.00313 X(o=-0.0031,f=-0.2) USER MOD Single : A1209 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1212 THR OG1 : rot 180:sc= 0 USER MOD Single : A1223 CYS SG : rot -30:sc= 0.498 USER MOD ----------------------------------------------------------------- ATOM 89 N THR A1053 -8.040 -7.594 -14.176 1.00 1.94 N ATOM 90 CA THR A1053 -6.574 -7.693 -14.125 1.00 1.28 C ATOM 91 C THR A1053 -5.942 -6.356 -13.695 1.00 1.20 C ATOM 92 O THR A1053 -6.096 -5.358 -14.405 1.00 1.52 O ATOM 93 CB THR A1053 -6.007 -8.184 -15.464 1.00 1.75 C ATOM 94 OG1 THR A1053 -6.678 -9.355 -15.901 1.00 2.22 O ATOM 95 CG2 THR A1053 -4.529 -8.550 -15.335 1.00 2.38 C ATOM 0 HA THR A1053 -6.312 -8.434 -13.369 1.00 1.28 H new ATOM 0 HB THR A1053 -6.144 -7.368 -16.174 1.00 1.75 H new ATOM 0 HG1 THR A1053 -7.571 -9.390 -15.498 1.00 2.22 H new ATOM 0 HG21 THR A1053 -4.154 -8.894 -16.299 1.00 2.38 H new ATOM 0 HG22 THR A1053 -3.964 -7.674 -15.018 1.00 2.38 H new ATOM 0 HG23 THR A1053 -4.414 -9.343 -14.596 1.00 2.38 H new ATOM 103 N PRO A1054 -5.240 -6.296 -12.547 1.00 1.19 N ATOM 104 CA PRO A1054 -4.495 -5.113 -12.110 1.00 1.13 C ATOM 105 C PRO A1054 -3.119 -5.031 -12.794 1.00 0.98 C ATOM 106 O PRO A1054 -2.535 -6.050 -13.164 1.00 1.35 O ATOM 107 CB PRO A1054 -4.377 -5.277 -10.593 1.00 1.47 C ATOM 108 CG PRO A1054 -4.213 -6.793 -10.454 1.00 2.07 C ATOM 109 CD PRO A1054 -5.151 -7.337 -11.528 1.00 1.65 C ATOM 0 HA PRO A1054 -4.995 -4.182 -12.378 1.00 1.13 H new ATOM 0 HB2 PRO A1054 -3.523 -4.734 -10.188 1.00 1.47 H new ATOM 0 HB3 PRO A1054 -5.262 -4.912 -10.072 1.00 1.47 H new ATOM 0 HG2 PRO A1054 -3.182 -7.105 -10.622 1.00 2.07 H new ATOM 0 HG3 PRO A1054 -4.493 -7.140 -9.459 1.00 2.07 H new ATOM 0 HD2 PRO A1054 -4.765 -8.265 -11.950 1.00 1.65 H new ATOM 0 HD3 PRO A1054 -6.133 -7.561 -11.112 1.00 1.65 H new ATOM 117 N VAL A1055 -2.563 -3.820 -12.914 1.00 0.88 N ATOM 118 CA VAL A1055 -1.215 -3.579 -13.467 1.00 1.00 C ATOM 119 C VAL A1055 -0.568 -2.454 -12.663 1.00 0.91 C ATOM 120 O VAL A1055 -0.992 -1.302 -12.784 1.00 0.89 O ATOM 121 CB VAL A1055 -1.260 -3.213 -14.970 1.00 1.40 C ATOM 122 CG1 VAL A1055 0.147 -3.008 -15.537 1.00 1.59 C ATOM 123 CG2 VAL A1055 -1.921 -4.302 -15.821 1.00 2.74 C ATOM 0 H VAL A1055 -3.039 -2.965 -12.627 1.00 0.88 H new ATOM 0 HA VAL A1055 -0.629 -4.495 -13.388 1.00 1.00 H new ATOM 0 HB VAL A1055 -1.844 -2.294 -15.021 1.00 1.40 H new ATOM 0 HG11 VAL A1055 0.079 -2.752 -16.594 1.00 1.59 H new ATOM 0 HG12 VAL A1055 0.642 -2.199 -14.999 1.00 1.59 H new ATOM 0 HG13 VAL A1055 0.723 -3.926 -15.422 1.00 1.59 H new ATOM 0 HG21 VAL A1055 -1.926 -3.994 -16.867 1.00 2.74 H new ATOM 0 HG22 VAL A1055 -1.362 -5.232 -15.720 1.00 2.74 H new ATOM 0 HG23 VAL A1055 -2.946 -4.456 -15.483 1.00 2.74 H new ATOM 133 N VAL A1056 0.398 -2.760 -11.790 1.00 0.93 N ATOM 134 CA VAL A1056 1.027 -1.726 -10.945 1.00 0.88 C ATOM 135 C VAL A1056 1.938 -0.813 -11.766 1.00 0.85 C ATOM 136 O VAL A1056 2.803 -1.263 -12.524 1.00 0.91 O ATOM 137 CB VAL A1056 1.685 -2.250 -9.659 1.00 0.96 C ATOM 138 CG1 VAL A1056 2.792 -3.263 -9.918 1.00 1.09 C ATOM 139 CG2 VAL A1056 2.251 -1.089 -8.827 1.00 0.95 C ATOM 0 H VAL A1056 0.761 -3.702 -11.647 1.00 0.93 H new ATOM 0 HA VAL A1056 0.205 -1.115 -10.570 1.00 0.88 H new ATOM 0 HB VAL A1056 0.895 -2.761 -9.108 1.00 0.96 H new ATOM 0 HG11 VAL A1056 3.214 -3.592 -8.968 1.00 1.09 H new ATOM 0 HG12 VAL A1056 2.382 -4.122 -10.450 1.00 1.09 H new ATOM 0 HG13 VAL A1056 3.574 -2.802 -10.522 1.00 1.09 H new ATOM 0 HG21 VAL A1056 2.712 -1.482 -7.921 1.00 0.95 H new ATOM 0 HG22 VAL A1056 2.998 -0.553 -9.412 1.00 0.95 H new ATOM 0 HG23 VAL A1056 1.444 -0.408 -8.557 1.00 0.95 H new ATOM 149 N ASN A1057 1.716 0.489 -11.602 1.00 0.81 N ATOM 150 CA ASN A1057 2.272 1.549 -12.393 1.00 0.83 C ATOM 151 C ASN A1057 3.433 2.277 -11.690 1.00 0.76 C ATOM 152 O ASN A1057 4.493 2.440 -12.291 1.00 0.82 O ATOM 153 CB ASN A1057 1.064 2.443 -12.729 1.00 0.94 C ATOM 154 CG ASN A1057 1.444 3.403 -13.813 1.00 1.62 C ATOM 155 OD1 ASN A1057 1.585 4.597 -13.597 1.00 2.84 O ATOM 156 ND2 ASN A1057 1.749 2.877 -14.966 1.00 2.17 N ATOM 0 H ASN A1057 1.104 0.838 -10.865 1.00 0.81 H new ATOM 0 HA ASN A1057 2.753 1.187 -13.302 1.00 0.83 H new ATOM 0 HB2 ASN A1057 0.222 1.830 -13.049 1.00 0.94 H new ATOM 0 HB3 ASN A1057 0.742 2.988 -11.841 1.00 0.94 H new ATOM 0 HD21 ASN A1057 2.115 3.466 -15.714 1.00 2.17 H new ATOM 0 HD22 ASN A1057 1.622 1.877 -15.120 1.00 2.17 H new ATOM 163 N GLN A1058 3.271 2.669 -10.420 1.00 0.73 N ATOM 164 CA GLN A1058 4.317 3.341 -9.637 1.00 0.73 C ATOM 165 C GLN A1058 4.159 3.115 -8.125 1.00 0.75 C ATOM 166 O GLN A1058 3.032 3.078 -7.630 1.00 0.69 O ATOM 167 CB GLN A1058 4.278 4.854 -9.933 1.00 0.72 C ATOM 168 CG GLN A1058 5.597 5.542 -9.562 1.00 1.34 C ATOM 169 CD GLN A1058 5.588 7.050 -9.796 1.00 1.38 C ATOM 170 OE1 GLN A1058 4.959 7.566 -10.710 1.00 1.42 O ATOM 171 NE2 GLN A1058 6.291 7.812 -8.987 1.00 2.49 N ATOM 0 H GLN A1058 2.404 2.528 -9.902 1.00 0.73 H new ATOM 0 HA GLN A1058 5.274 2.912 -9.932 1.00 0.73 H new ATOM 0 HB2 GLN A1058 4.071 5.012 -10.991 1.00 0.72 H new ATOM 0 HB3 GLN A1058 3.460 5.312 -9.377 1.00 0.72 H new ATOM 0 HG2 GLN A1058 5.816 5.347 -8.512 1.00 1.34 H new ATOM 0 HG3 GLN A1058 6.405 5.098 -10.144 1.00 1.34 H new ATOM 0 HE21 GLN A1058 6.819 7.393 -8.222 1.00 2.49 H new ATOM 0 HE22 GLN A1058 6.308 8.823 -9.125 1.00 2.49 H new ATOM 180 N VAL A1059 5.270 3.046 -7.382 1.00 0.85 N ATOM 181 CA VAL A1059 5.288 3.095 -5.907 1.00 0.84 C ATOM 182 C VAL A1059 6.121 4.292 -5.427 1.00 0.83 C ATOM 183 O VAL A1059 7.254 4.482 -5.880 1.00 0.96 O ATOM 184 CB VAL A1059 5.737 1.764 -5.258 1.00 0.89 C ATOM 185 CG1 VAL A1059 5.051 0.551 -5.903 1.00 0.91 C ATOM 186 CG2 VAL A1059 7.248 1.500 -5.297 1.00 0.92 C ATOM 0 H VAL A1059 6.200 2.953 -7.791 1.00 0.85 H new ATOM 0 HA VAL A1059 4.260 3.237 -5.572 1.00 0.84 H new ATOM 0 HB VAL A1059 5.439 1.887 -4.217 1.00 0.89 H new ATOM 0 HG11 VAL A1059 5.395 -0.362 -5.417 1.00 0.91 H new ATOM 0 HG12 VAL A1059 3.971 0.639 -5.787 1.00 0.91 H new ATOM 0 HG13 VAL A1059 5.300 0.514 -6.964 1.00 0.91 H new ATOM 0 HG21 VAL A1059 7.463 0.545 -4.818 1.00 0.92 H new ATOM 0 HG22 VAL A1059 7.586 1.471 -6.333 1.00 0.92 H new ATOM 0 HG23 VAL A1059 7.770 2.297 -4.767 1.00 0.92 H new ATOM 196 N LYS A1060 5.571 5.126 -4.533 1.00 0.72 N ATOM 197 CA LYS A1060 6.208 6.378 -4.083 1.00 0.70 C ATOM 198 C LYS A1060 6.159 6.565 -2.561 1.00 0.58 C ATOM 199 O LYS A1060 5.185 6.193 -1.909 1.00 0.51 O ATOM 200 CB LYS A1060 5.613 7.573 -4.844 1.00 0.81 C ATOM 201 CG LYS A1060 6.719 8.618 -5.003 1.00 1.01 C ATOM 202 CD LYS A1060 6.258 9.915 -5.654 1.00 1.33 C ATOM 203 CE LYS A1060 7.542 10.731 -5.822 1.00 1.78 C ATOM 204 NZ LYS A1060 7.329 12.038 -6.478 1.00 2.49 N ATOM 0 H LYS A1060 4.665 4.952 -4.097 1.00 0.72 H new ATOM 0 HA LYS A1060 7.270 6.315 -4.322 1.00 0.70 H new ATOM 0 HB2 LYS A1060 5.240 7.259 -5.819 1.00 0.81 H new ATOM 0 HB3 LYS A1060 4.767 7.991 -4.299 1.00 0.81 H new ATOM 0 HG2 LYS A1060 7.135 8.844 -4.021 1.00 1.01 H new ATOM 0 HG3 LYS A1060 7.525 8.191 -5.600 1.00 1.01 H new ATOM 0 HD2 LYS A1060 5.776 9.729 -6.614 1.00 1.33 H new ATOM 0 HD3 LYS A1060 5.533 10.438 -5.030 1.00 1.33 H new ATOM 0 HE2 LYS A1060 7.990 10.894 -4.842 1.00 1.78 H new ATOM 0 HE3 LYS A1060 8.257 10.152 -6.407 1.00 1.78 H new ATOM 0 HZ1 LYS A1060 8.238 12.537 -6.560 1.00 2.49 H new ATOM 0 HZ2 LYS A1060 6.929 11.889 -7.426 1.00 2.49 H new ATOM 0 HZ3 LYS A1060 6.670 12.608 -5.910 1.00 2.49 H new ATOM 218 N VAL A1061 7.215 7.150 -1.999 1.00 0.61 N ATOM 219 CA VAL A1061 7.374 7.414 -0.559 1.00 0.55 C ATOM 220 C VAL A1061 6.828 8.793 -0.152 1.00 0.60 C ATOM 221 O VAL A1061 6.951 9.778 -0.885 1.00 0.80 O ATOM 222 CB VAL A1061 8.858 7.242 -0.167 1.00 0.66 C ATOM 223 CG1 VAL A1061 9.149 7.585 1.298 1.00 0.78 C ATOM 224 CG2 VAL A1061 9.303 5.785 -0.373 1.00 0.62 C ATOM 0 H VAL A1061 8.015 7.467 -2.548 1.00 0.61 H new ATOM 0 HA VAL A1061 6.777 6.687 -0.008 1.00 0.55 H new ATOM 0 HB VAL A1061 9.402 7.934 -0.809 1.00 0.66 H new ATOM 0 HG11 VAL A1061 10.210 7.441 1.502 1.00 0.78 H new ATOM 0 HG12 VAL A1061 8.881 8.624 1.489 1.00 0.78 H new ATOM 0 HG13 VAL A1061 8.564 6.934 1.947 1.00 0.78 H new ATOM 0 HG21 VAL A1061 10.351 5.681 -0.092 1.00 0.62 H new ATOM 0 HG22 VAL A1061 8.694 5.127 0.248 1.00 0.62 H new ATOM 0 HG23 VAL A1061 9.180 5.512 -1.421 1.00 0.62 H new ATOM 234 N LEU A1062 6.250 8.851 1.052 1.00 0.50 N ATOM 235 CA LEU A1062 5.848 10.077 1.755 1.00 0.54 C ATOM 236 C LEU A1062 6.597 10.266 3.090 1.00 0.61 C ATOM 237 O LEU A1062 6.858 11.403 3.482 1.00 0.74 O ATOM 238 CB LEU A1062 4.318 10.059 1.947 1.00 0.55 C ATOM 239 CG LEU A1062 3.730 11.359 2.536 1.00 0.69 C ATOM 240 CD1 LEU A1062 4.094 12.609 1.732 1.00 0.82 C ATOM 241 CD2 LEU A1062 2.212 11.241 2.544 1.00 0.74 C ATOM 0 H LEU A1062 6.040 8.009 1.588 1.00 0.50 H new ATOM 0 HA LEU A1062 6.125 10.938 1.146 1.00 0.54 H new ATOM 0 HB2 LEU A1062 3.846 9.866 0.984 1.00 0.55 H new ATOM 0 HB3 LEU A1062 4.057 9.228 2.602 1.00 0.55 H new ATOM 0 HG LEU A1062 4.149 11.473 3.536 1.00 0.69 H new ATOM 0 HD11 LEU A1062 3.648 13.486 2.201 1.00 0.82 H new ATOM 0 HD12 LEU A1062 5.178 12.722 1.706 1.00 0.82 H new ATOM 0 HD13 LEU A1062 3.715 12.510 0.715 1.00 0.82 H new ATOM 0 HD21 LEU A1062 1.778 12.152 2.957 1.00 0.74 H new ATOM 0 HD22 LEU A1062 1.853 11.098 1.525 1.00 0.74 H new ATOM 0 HD23 LEU A1062 1.917 10.388 3.155 1.00 0.74 H new ATOM 253 N THR A1063 6.999 9.173 3.748 1.00 0.66 N ATOM 254 CA THR A1063 7.777 9.178 5.000 1.00 0.75 C ATOM 255 C THR A1063 9.020 8.300 4.859 1.00 1.08 C ATOM 256 O THR A1063 8.901 7.107 4.586 1.00 1.75 O ATOM 257 CB THR A1063 6.926 8.658 6.169 1.00 0.68 C ATOM 258 OG1 THR A1063 5.761 9.438 6.321 1.00 1.55 O ATOM 259 CG2 THR A1063 7.639 8.664 7.518 1.00 1.43 C ATOM 0 H THR A1063 6.788 8.231 3.418 1.00 0.66 H new ATOM 0 HA THR A1063 8.078 10.206 5.203 1.00 0.75 H new ATOM 0 HB THR A1063 6.701 7.625 5.902 1.00 0.68 H new ATOM 0 HG1 THR A1063 5.058 8.898 6.738 1.00 1.55 H new ATOM 0 HG21 THR A1063 6.967 8.282 8.286 1.00 1.43 H new ATOM 0 HG22 THR A1063 8.525 8.032 7.464 1.00 1.43 H new ATOM 0 HG23 THR A1063 7.935 9.683 7.769 1.00 1.43 H new ATOM 267 N GLU A1064 10.198 8.873 5.102 1.00 1.34 N ATOM 268 CA GLU A1064 11.498 8.195 5.076 1.00 1.76 C ATOM 269 C GLU A1064 12.238 8.415 6.409 1.00 1.94 C ATOM 270 O GLU A1064 12.174 9.500 6.990 1.00 2.05 O ATOM 271 CB GLU A1064 12.297 8.723 3.868 1.00 2.12 C ATOM 272 CG GLU A1064 13.733 8.195 3.795 1.00 2.55 C ATOM 273 CD GLU A1064 14.517 8.748 2.595 1.00 2.97 C ATOM 274 OE1 GLU A1064 14.609 9.991 2.428 1.00 3.28 O ATOM 275 OE2 GLU A1064 15.117 7.941 1.843 1.00 3.88 O ATOM 0 H GLU A1064 10.278 9.863 5.332 1.00 1.34 H new ATOM 0 HA GLU A1064 11.371 7.118 4.963 1.00 1.76 H new ATOM 0 HB2 GLU A1064 11.773 8.451 2.952 1.00 2.12 H new ATOM 0 HB3 GLU A1064 12.322 9.812 3.910 1.00 2.12 H new ATOM 0 HG2 GLU A1064 14.257 8.455 4.715 1.00 2.55 H new ATOM 0 HG3 GLU A1064 13.711 7.107 3.737 1.00 2.55 H new ATOM 282 N SER A1065 12.966 7.400 6.887 1.00 2.08 N ATOM 283 CA SER A1065 13.800 7.383 8.110 1.00 2.33 C ATOM 284 C SER A1065 13.068 7.572 9.453 1.00 2.43 C ATOM 285 O SER A1065 13.504 7.012 10.455 1.00 3.40 O ATOM 286 CB SER A1065 14.975 8.366 7.997 1.00 2.58 C ATOM 287 OG SER A1065 15.790 8.091 6.864 1.00 2.66 O ATOM 0 H SER A1065 12.995 6.503 6.402 1.00 2.08 H new ATOM 0 HA SER A1065 14.163 6.356 8.148 1.00 2.33 H new ATOM 0 HB2 SER A1065 14.591 9.384 7.930 1.00 2.58 H new ATOM 0 HB3 SER A1065 15.581 8.313 8.901 1.00 2.58 H new ATOM 0 HG SER A1065 16.525 8.738 6.825 1.00 2.66 H new ATOM 293 N ASN A1066 11.957 8.314 9.522 1.00 1.74 N ATOM 294 CA ASN A1066 11.326 8.691 10.801 1.00 1.82 C ATOM 295 C ASN A1066 10.406 7.613 11.410 1.00 1.70 C ATOM 296 O ASN A1066 9.965 7.760 12.555 1.00 1.95 O ATOM 297 CB ASN A1066 10.566 10.021 10.650 1.00 2.04 C ATOM 298 CG ASN A1066 11.322 11.113 9.926 1.00 2.28 C ATOM 299 OD1 ASN A1066 10.839 11.662 8.945 1.00 3.13 O ATOM 300 ND2 ASN A1066 12.504 11.455 10.380 1.00 2.88 N ATOM 0 H ASN A1066 11.469 8.670 8.700 1.00 1.74 H new ATOM 0 HA ASN A1066 12.148 8.803 11.508 1.00 1.82 H new ATOM 0 HB2 ASN A1066 9.634 9.831 10.117 1.00 2.04 H new ATOM 0 HB3 ASN A1066 10.297 10.383 11.642 1.00 2.04 H new ATOM 0 HD21 ASN A1066 13.036 12.190 9.914 1.00 2.88 H new ATOM 0 HD22 ASN A1066 12.891 10.986 11.199 1.00 2.88 H new ATOM 307 N ARG A1067 10.085 6.556 10.652 1.00 1.53 N ATOM 308 CA ARG A1067 9.293 5.392 11.103 1.00 1.49 C ATOM 309 C ARG A1067 9.493 4.167 10.201 1.00 1.41 C ATOM 310 O ARG A1067 9.544 3.048 10.703 1.00 1.95 O ATOM 311 CB ARG A1067 7.794 5.781 11.173 1.00 1.46 C ATOM 312 CG ARG A1067 6.863 4.687 11.724 1.00 1.73 C ATOM 313 CD ARG A1067 7.245 4.188 13.125 1.00 2.34 C ATOM 314 NE ARG A1067 6.226 3.258 13.647 1.00 3.37 N ATOM 315 CZ ARG A1067 6.399 2.033 14.113 1.00 4.53 C ATOM 316 NH1 ARG A1067 7.550 1.422 14.144 1.00 5.40 N ATOM 317 NH2 ARG A1067 5.381 1.377 14.573 1.00 5.55 N ATOM 0 H ARG A1067 10.376 6.480 9.677 1.00 1.53 H new ATOM 0 HA ARG A1067 9.645 5.111 12.096 1.00 1.49 H new ATOM 0 HB2 ARG A1067 7.694 6.670 11.796 1.00 1.46 H new ATOM 0 HB3 ARG A1067 7.458 6.053 10.173 1.00 1.46 H new ATOM 0 HG2 ARG A1067 5.844 5.072 11.752 1.00 1.73 H new ATOM 0 HG3 ARG A1067 6.865 3.842 11.036 1.00 1.73 H new ATOM 0 HD2 ARG A1067 8.213 3.689 13.086 1.00 2.34 H new ATOM 0 HD3 ARG A1067 7.350 5.036 13.802 1.00 2.34 H new ATOM 0 HE ARG A1067 5.266 3.604 13.649 1.00 3.37 H new ATOM 0 HH11 ARG A1067 8.386 1.891 13.795 1.00 5.40 H new ATOM 0 HH12 ARG A1067 7.615 0.475 14.517 1.00 5.40 H new ATOM 0 HH21 ARG A1067 4.456 1.806 14.574 1.00 5.55 H new ATOM 0 HH22 ARG A1067 5.505 0.431 14.935 1.00 5.55 H new ATOM 331 N ILE A1068 9.588 4.382 8.886 1.00 1.06 N ATOM 332 CA ILE A1068 9.823 3.374 7.838 1.00 0.85 C ATOM 333 C ILE A1068 10.694 4.009 6.731 1.00 0.95 C ATOM 334 O ILE A1068 10.831 5.231 6.683 1.00 1.37 O ATOM 335 CB ILE A1068 8.498 2.860 7.199 1.00 0.80 C ATOM 336 CG1 ILE A1068 7.187 2.970 8.015 1.00 1.54 C ATOM 337 CG2 ILE A1068 8.658 1.408 6.713 1.00 0.70 C ATOM 338 CD1 ILE A1068 6.886 1.850 9.026 1.00 1.28 C ATOM 0 H ILE A1068 9.498 5.320 8.497 1.00 1.06 H new ATOM 0 HA ILE A1068 10.320 2.521 8.300 1.00 0.85 H new ATOM 0 HB ILE A1068 8.357 3.571 6.385 1.00 0.80 H new ATOM 0 HG12 ILE A1068 7.205 3.916 8.556 1.00 1.54 H new ATOM 0 HG13 ILE A1068 6.356 3.021 7.312 1.00 1.54 H new ATOM 0 HG21 ILE A1068 7.722 1.067 6.270 1.00 0.70 H new ATOM 0 HG22 ILE A1068 9.451 1.359 5.967 1.00 0.70 H new ATOM 0 HG23 ILE A1068 8.914 0.768 7.557 1.00 0.70 H new ATOM 0 HD11 ILE A1068 5.939 2.055 9.525 1.00 1.28 H new ATOM 0 HD12 ILE A1068 6.821 0.896 8.503 1.00 1.28 H new ATOM 0 HD13 ILE A1068 7.684 1.805 9.767 1.00 1.28 H new ATOM 350 N SER A1069 11.223 3.188 5.817 1.00 1.00 N ATOM 351 CA SER A1069 11.902 3.600 4.574 1.00 1.21 C ATOM 352 C SER A1069 11.597 2.624 3.418 1.00 0.86 C ATOM 353 O SER A1069 11.181 1.490 3.665 1.00 0.63 O ATOM 354 CB SER A1069 13.414 3.685 4.806 1.00 1.56 C ATOM 355 OG SER A1069 13.731 4.646 5.798 1.00 2.15 O ATOM 0 H SER A1069 11.191 2.174 5.924 1.00 1.00 H new ATOM 0 HA SER A1069 11.524 4.583 4.293 1.00 1.21 H new ATOM 0 HB2 SER A1069 13.793 2.709 5.109 1.00 1.56 H new ATOM 0 HB3 SER A1069 13.913 3.945 3.872 1.00 1.56 H new ATOM 0 HG SER A1069 14.702 4.677 5.925 1.00 2.15 H new ATOM 361 N HIS A1070 11.817 3.036 2.162 1.00 0.91 N ATOM 362 CA HIS A1070 11.400 2.379 0.906 1.00 0.78 C ATOM 363 C HIS A1070 11.580 0.851 0.874 1.00 0.64 C ATOM 364 O HIS A1070 10.615 0.135 0.594 1.00 0.66 O ATOM 365 CB HIS A1070 12.174 3.035 -0.258 1.00 0.92 C ATOM 366 CG HIS A1070 11.818 2.586 -1.661 1.00 2.06 C ATOM 367 ND1 HIS A1070 12.676 2.586 -2.740 1.00 2.45 N ATOM 368 CD2 HIS A1070 10.586 2.217 -2.140 1.00 4.08 C ATOM 369 CE1 HIS A1070 11.985 2.217 -3.830 1.00 4.06 C ATOM 370 NE2 HIS A1070 10.695 1.990 -3.520 1.00 5.20 N ATOM 0 H HIS A1070 12.328 3.900 1.979 1.00 0.91 H new ATOM 0 HA HIS A1070 10.324 2.527 0.816 1.00 0.78 H new ATOM 0 HB2 HIS A1070 12.024 4.113 -0.199 1.00 0.92 H new ATOM 0 HB3 HIS A1070 13.237 2.852 -0.103 1.00 0.92 H new ATOM 0 HD2 HIS A1070 9.685 2.118 -1.553 1.00 4.08 H new ATOM 0 HE1 HIS A1070 12.406 2.116 -4.819 1.00 4.06 H new ATOM 0 HE2 HIS A1070 9.950 1.710 -4.158 1.00 5.20 H new ATOM 378 N HIS A1071 12.767 0.337 1.217 1.00 0.68 N ATOM 379 CA HIS A1071 13.048 -1.106 1.206 1.00 0.81 C ATOM 380 C HIS A1071 12.164 -1.894 2.194 1.00 0.68 C ATOM 381 O HIS A1071 11.697 -2.991 1.875 1.00 0.73 O ATOM 382 CB HIS A1071 14.530 -1.339 1.536 1.00 1.20 C ATOM 383 CG HIS A1071 15.530 -0.675 0.619 1.00 2.62 C ATOM 384 ND1 HIS A1071 15.435 -0.492 -0.745 1.00 3.37 N ATOM 385 CD2 HIS A1071 16.768 -0.225 0.991 1.00 4.44 C ATOM 386 CE1 HIS A1071 16.578 0.056 -1.181 1.00 5.05 C ATOM 387 NE2 HIS A1071 17.431 0.232 -0.158 1.00 5.69 N ATOM 0 H HIS A1071 13.560 0.908 1.510 1.00 0.68 H new ATOM 0 HA HIS A1071 12.816 -1.475 0.207 1.00 0.81 H new ATOM 0 HB2 HIS A1071 14.713 -0.991 2.552 1.00 1.20 H new ATOM 0 HB3 HIS A1071 14.718 -2.413 1.528 1.00 1.20 H new ATOM 0 HD2 HIS A1071 17.166 -0.222 1.995 1.00 4.44 H new ATOM 0 HE1 HIS A1071 16.784 0.319 -2.208 1.00 5.05 H new ATOM 0 HE2 HIS A1071 18.373 0.620 -0.207 1.00 5.69 H new ATOM 395 N LYS A1072 11.892 -1.330 3.380 1.00 0.61 N ATOM 396 CA LYS A1072 10.985 -1.926 4.375 1.00 0.55 C ATOM 397 C LYS A1072 9.521 -1.774 3.945 1.00 0.45 C ATOM 398 O LYS A1072 8.771 -2.735 4.068 1.00 0.44 O ATOM 399 CB LYS A1072 11.243 -1.339 5.778 1.00 0.66 C ATOM 400 CG LYS A1072 12.600 -1.753 6.386 1.00 1.27 C ATOM 401 CD LYS A1072 12.789 -1.114 7.776 1.00 1.88 C ATOM 402 CE LYS A1072 14.164 -1.389 8.408 1.00 2.52 C ATOM 403 NZ LYS A1072 14.296 -2.758 8.963 1.00 2.57 N ATOM 0 H LYS A1072 12.297 -0.443 3.679 1.00 0.61 H new ATOM 0 HA LYS A1072 11.192 -2.995 4.431 1.00 0.55 H new ATOM 0 HB2 LYS A1072 11.198 -0.251 5.721 1.00 0.66 H new ATOM 0 HB3 LYS A1072 10.443 -1.657 6.447 1.00 0.66 H new ATOM 0 HG2 LYS A1072 12.652 -2.839 6.469 1.00 1.27 H new ATOM 0 HG3 LYS A1072 13.410 -1.445 5.725 1.00 1.27 H new ATOM 0 HD2 LYS A1072 12.648 -0.036 7.692 1.00 1.88 H new ATOM 0 HD3 LYS A1072 12.012 -1.486 8.444 1.00 1.88 H new ATOM 0 HE2 LYS A1072 14.938 -1.234 7.657 1.00 2.52 H new ATOM 0 HE3 LYS A1072 14.341 -0.664 9.203 1.00 2.52 H new ATOM 0 HZ1 LYS A1072 15.245 -2.877 9.373 1.00 2.57 H new ATOM 0 HZ2 LYS A1072 13.579 -2.904 9.702 1.00 2.57 H new ATOM 0 HZ3 LYS A1072 14.157 -3.455 8.204 1.00 2.57 H new ATOM 417 N ILE A1073 9.129 -0.626 3.372 1.00 0.45 N ATOM 418 CA ILE A1073 7.760 -0.379 2.866 1.00 0.45 C ATOM 419 C ILE A1073 7.367 -1.426 1.809 1.00 0.48 C ATOM 420 O ILE A1073 6.332 -2.078 1.949 1.00 0.51 O ATOM 421 CB ILE A1073 7.590 1.067 2.320 1.00 0.49 C ATOM 422 CG1 ILE A1073 7.785 2.118 3.439 1.00 0.47 C ATOM 423 CG2 ILE A1073 6.197 1.261 1.682 1.00 0.55 C ATOM 424 CD1 ILE A1073 7.850 3.578 2.971 1.00 0.51 C ATOM 0 H ILE A1073 9.756 0.168 3.243 1.00 0.45 H new ATOM 0 HA ILE A1073 7.080 -0.479 3.712 1.00 0.45 H new ATOM 0 HB ILE A1073 8.357 1.211 1.559 1.00 0.49 H new ATOM 0 HG12 ILE A1073 6.967 2.020 4.152 1.00 0.47 H new ATOM 0 HG13 ILE A1073 8.705 1.885 3.975 1.00 0.47 H new ATOM 0 HG21 ILE A1073 6.107 2.281 1.309 1.00 0.55 H new ATOM 0 HG22 ILE A1073 6.074 0.560 0.856 1.00 0.55 H new ATOM 0 HG23 ILE A1073 5.426 1.079 2.430 1.00 0.55 H new ATOM 0 HD11 ILE A1073 7.988 4.231 3.833 1.00 0.51 H new ATOM 0 HD12 ILE A1073 8.687 3.703 2.284 1.00 0.51 H new ATOM 0 HD13 ILE A1073 6.921 3.839 2.463 1.00 0.51 H new ATOM 436 N LEU A1074 8.193 -1.637 0.776 1.00 0.50 N ATOM 437 CA LEU A1074 7.871 -2.610 -0.280 1.00 0.56 C ATOM 438 C LEU A1074 7.894 -4.058 0.236 1.00 0.55 C ATOM 439 O LEU A1074 7.108 -4.885 -0.231 1.00 0.62 O ATOM 440 CB LEU A1074 8.746 -2.357 -1.526 1.00 0.63 C ATOM 441 CG LEU A1074 10.178 -2.927 -1.476 1.00 0.66 C ATOM 442 CD1 LEU A1074 10.258 -4.354 -2.030 1.00 0.74 C ATOM 443 CD2 LEU A1074 11.110 -2.068 -2.326 1.00 0.72 C ATOM 0 H LEU A1074 9.082 -1.153 0.648 1.00 0.50 H new ATOM 0 HA LEU A1074 6.839 -2.460 -0.597 1.00 0.56 H new ATOM 0 HB2 LEU A1074 8.239 -2.780 -2.393 1.00 0.63 H new ATOM 0 HB3 LEU A1074 8.810 -1.281 -1.687 1.00 0.63 H new ATOM 0 HG LEU A1074 10.471 -2.929 -0.426 1.00 0.66 H new ATOM 0 HD11 LEU A1074 11.287 -4.709 -1.973 1.00 0.74 H new ATOM 0 HD12 LEU A1074 9.614 -5.009 -1.443 1.00 0.74 H new ATOM 0 HD13 LEU A1074 9.930 -4.360 -3.069 1.00 0.74 H new ATOM 0 HD21 LEU A1074 12.120 -2.477 -2.286 1.00 0.72 H new ATOM 0 HD22 LEU A1074 10.761 -2.065 -3.359 1.00 0.72 H new ATOM 0 HD23 LEU A1074 11.116 -1.048 -1.942 1.00 0.72 H new ATOM 455 N ALA A1075 8.743 -4.359 1.227 1.00 0.50 N ATOM 456 CA ALA A1075 8.771 -5.671 1.863 1.00 0.49 C ATOM 457 C ALA A1075 7.478 -5.957 2.658 1.00 0.47 C ATOM 458 O ALA A1075 6.836 -6.982 2.420 1.00 0.51 O ATOM 459 CB ALA A1075 10.040 -5.785 2.716 1.00 0.49 C ATOM 0 H ALA A1075 9.424 -3.700 1.605 1.00 0.50 H new ATOM 0 HA ALA A1075 8.806 -6.445 1.096 1.00 0.49 H new ATOM 0 HB1 ALA A1075 10.069 -6.763 3.196 1.00 0.49 H new ATOM 0 HB2 ALA A1075 10.918 -5.666 2.080 1.00 0.49 H new ATOM 0 HB3 ALA A1075 10.037 -5.007 3.479 1.00 0.49 H new ATOM 465 N ILE A1076 7.027 -5.050 3.537 1.00 0.44 N ATOM 466 CA ILE A1076 5.820 -5.282 4.362 1.00 0.44 C ATOM 467 C ILE A1076 4.521 -5.288 3.541 1.00 0.49 C ATOM 468 O ILE A1076 3.645 -6.109 3.806 1.00 0.56 O ATOM 469 CB ILE A1076 5.739 -4.360 5.600 1.00 0.42 C ATOM 470 CG1 ILE A1076 5.562 -2.868 5.242 1.00 0.44 C ATOM 471 CG2 ILE A1076 6.958 -4.627 6.502 1.00 0.42 C ATOM 472 CD1 ILE A1076 5.593 -1.905 6.436 1.00 0.45 C ATOM 0 H ILE A1076 7.476 -4.148 3.699 1.00 0.44 H new ATOM 0 HA ILE A1076 5.931 -6.293 4.754 1.00 0.44 H new ATOM 0 HB ILE A1076 4.833 -4.604 6.155 1.00 0.42 H new ATOM 0 HG12 ILE A1076 6.349 -2.582 4.544 1.00 0.44 H new ATOM 0 HG13 ILE A1076 4.613 -2.745 4.721 1.00 0.44 H new ATOM 0 HG21 ILE A1076 6.910 -3.981 7.379 1.00 0.42 H new ATOM 0 HG22 ILE A1076 6.955 -5.670 6.819 1.00 0.42 H new ATOM 0 HG23 ILE A1076 7.873 -4.419 5.948 1.00 0.42 H new ATOM 0 HD11 ILE A1076 5.461 -0.883 6.082 1.00 0.45 H new ATOM 0 HD12 ILE A1076 4.789 -2.157 7.127 1.00 0.45 H new ATOM 0 HD13 ILE A1076 6.552 -1.991 6.948 1.00 0.45 H new ATOM 484 N VAL A1077 4.402 -4.455 2.500 1.00 0.49 N ATOM 485 CA VAL A1077 3.225 -4.481 1.605 1.00 0.54 C ATOM 486 C VAL A1077 3.219 -5.735 0.719 1.00 0.59 C ATOM 487 O VAL A1077 2.188 -6.394 0.591 1.00 0.67 O ATOM 488 CB VAL A1077 3.123 -3.187 0.772 1.00 0.54 C ATOM 489 CG1 VAL A1077 1.909 -3.196 -0.168 1.00 0.62 C ATOM 490 CG2 VAL A1077 2.964 -1.956 1.677 1.00 0.51 C ATOM 0 H VAL A1077 5.101 -3.755 2.252 1.00 0.49 H new ATOM 0 HA VAL A1077 2.335 -4.530 2.233 1.00 0.54 H new ATOM 0 HB VAL A1077 4.047 -3.138 0.195 1.00 0.54 H new ATOM 0 HG11 VAL A1077 1.880 -2.265 -0.733 1.00 0.62 H new ATOM 0 HG12 VAL A1077 1.989 -4.036 -0.857 1.00 0.62 H new ATOM 0 HG13 VAL A1077 0.995 -3.293 0.419 1.00 0.62 H new ATOM 0 HG21 VAL A1077 2.895 -1.059 1.062 1.00 0.51 H new ATOM 0 HG22 VAL A1077 2.058 -2.058 2.274 1.00 0.51 H new ATOM 0 HG23 VAL A1077 3.827 -1.877 2.338 1.00 0.51 H new ATOM 500 N GLY A1078 4.362 -6.118 0.140 1.00 0.57 N ATOM 501 CA GLY A1078 4.447 -7.309 -0.714 1.00 0.61 C ATOM 502 C GLY A1078 4.268 -8.627 0.044 1.00 0.62 C ATOM 503 O GLY A1078 3.656 -9.562 -0.471 1.00 0.69 O ATOM 0 H GLY A1078 5.245 -5.618 0.248 1.00 0.57 H new ATOM 0 HA2 GLY A1078 3.686 -7.242 -1.492 1.00 0.61 H new ATOM 0 HA3 GLY A1078 5.415 -7.317 -1.215 1.00 0.61 H new ATOM 507 N THR A1079 4.740 -8.701 1.293 1.00 0.57 N ATOM 508 CA THR A1079 4.470 -9.844 2.182 1.00 0.56 C ATOM 509 C THR A1079 3.000 -9.908 2.588 1.00 0.67 C ATOM 510 O THR A1079 2.413 -10.987 2.487 1.00 0.88 O ATOM 511 CB THR A1079 5.364 -9.851 3.428 1.00 0.51 C ATOM 512 OG1 THR A1079 5.424 -8.604 4.048 1.00 0.59 O ATOM 513 CG2 THR A1079 6.803 -10.200 3.098 1.00 0.50 C ATOM 0 H THR A1079 5.318 -7.976 1.718 1.00 0.57 H new ATOM 0 HA THR A1079 4.710 -10.735 1.602 1.00 0.56 H new ATOM 0 HB THR A1079 4.909 -10.596 4.080 1.00 0.51 H new ATOM 0 HG1 THR A1079 6.060 -8.032 3.571 1.00 0.59 H new ATOM 0 HG21 THR A1079 7.398 -10.192 4.011 1.00 0.50 H new ATOM 0 HG22 THR A1079 6.843 -11.192 2.647 1.00 0.50 H new ATOM 0 HG23 THR A1079 7.204 -9.467 2.398 1.00 0.50 H new ATOM 521 N ALA A1080 2.372 -8.780 2.935 1.00 0.63 N ATOM 522 CA ALA A1080 0.939 -8.717 3.230 1.00 0.74 C ATOM 523 C ALA A1080 0.074 -9.225 2.059 1.00 0.82 C ATOM 524 O ALA A1080 -0.758 -10.115 2.239 1.00 0.91 O ATOM 525 CB ALA A1080 0.579 -7.275 3.617 1.00 0.82 C ATOM 0 H ALA A1080 2.847 -7.881 3.019 1.00 0.63 H new ATOM 0 HA ALA A1080 0.723 -9.384 4.065 1.00 0.74 H new ATOM 0 HB1 ALA A1080 -0.486 -7.213 3.840 1.00 0.82 H new ATOM 0 HB2 ALA A1080 1.151 -6.981 4.497 1.00 0.82 H new ATOM 0 HB3 ALA A1080 0.816 -6.606 2.790 1.00 0.82 H new ATOM 531 N GLU A1081 0.319 -8.750 0.835 1.00 0.83 N ATOM 532 CA GLU A1081 -0.415 -9.203 -0.358 1.00 0.94 C ATOM 533 C GLU A1081 -0.062 -10.646 -0.792 1.00 0.93 C ATOM 534 O GLU A1081 -0.848 -11.296 -1.490 1.00 1.03 O ATOM 535 CB GLU A1081 -0.293 -8.168 -1.488 1.00 1.00 C ATOM 536 CG GLU A1081 -1.029 -6.855 -1.173 1.00 1.22 C ATOM 537 CD GLU A1081 -2.554 -7.023 -1.044 1.00 1.28 C ATOM 538 OE1 GLU A1081 -3.141 -7.896 -1.730 1.00 1.84 O ATOM 539 OE2 GLU A1081 -3.170 -6.244 -0.286 1.00 2.32 O ATOM 0 H GLU A1081 1.028 -8.043 0.639 1.00 0.83 H new ATOM 0 HA GLU A1081 -1.470 -9.267 -0.090 1.00 0.94 H new ATOM 0 HB2 GLU A1081 0.761 -7.955 -1.668 1.00 1.00 H new ATOM 0 HB3 GLU A1081 -0.694 -8.592 -2.409 1.00 1.00 H new ATOM 0 HG2 GLU A1081 -0.637 -6.442 -0.244 1.00 1.22 H new ATOM 0 HG3 GLU A1081 -0.816 -6.131 -1.959 1.00 1.22 H new ATOM 546 N SER A1082 1.062 -11.218 -0.328 1.00 0.84 N ATOM 547 CA SER A1082 1.356 -12.658 -0.484 1.00 0.71 C ATOM 548 C SER A1082 0.486 -13.544 0.425 1.00 0.65 C ATOM 549 O SER A1082 0.196 -14.692 0.077 1.00 0.58 O ATOM 550 CB SER A1082 2.845 -12.954 -0.244 1.00 0.94 C ATOM 551 OG SER A1082 3.144 -13.144 1.129 1.00 1.62 O ATOM 0 H SER A1082 1.791 -10.701 0.164 1.00 0.84 H new ATOM 0 HA SER A1082 1.108 -12.907 -1.516 1.00 0.71 H new ATOM 0 HB2 SER A1082 3.130 -13.846 -0.802 1.00 0.94 H new ATOM 0 HB3 SER A1082 3.444 -12.130 -0.633 1.00 0.94 H new ATOM 0 HG SER A1082 3.152 -12.277 1.585 1.00 1.62 H new ATOM 557 N ASN A1083 0.057 -13.011 1.577 1.00 0.92 N ATOM 558 CA ASN A1083 -0.850 -13.660 2.528 1.00 1.13 C ATOM 559 C ASN A1083 -2.337 -13.326 2.243 1.00 1.14 C ATOM 560 O ASN A1083 -3.220 -14.100 2.618 1.00 1.22 O ATOM 561 CB ASN A1083 -0.451 -13.195 3.943 1.00 1.57 C ATOM 562 CG ASN A1083 0.820 -13.793 4.520 1.00 2.03 C ATOM 563 OD1 ASN A1083 1.851 -13.146 4.630 1.00 3.48 O ATOM 564 ND2 ASN A1083 0.771 -15.010 4.999 1.00 1.64 N ATOM 0 H ASN A1083 0.344 -12.081 1.882 1.00 0.92 H new ATOM 0 HA ASN A1083 -0.758 -14.742 2.432 1.00 1.13 H new ATOM 0 HB2 ASN A1083 -0.341 -12.111 3.927 1.00 1.57 H new ATOM 0 HB3 ASN A1083 -1.273 -13.422 4.621 1.00 1.57 H new ATOM 0 HD21 ASN A1083 1.589 -15.410 5.459 1.00 1.64 H new ATOM 0 HD22 ASN A1083 -0.085 -15.558 4.912 1.00 1.64 H new ATOM 571 N SER A1084 -2.627 -12.213 1.557 1.00 1.15 N ATOM 572 CA SER A1084 -3.986 -11.745 1.222 1.00 1.15 C ATOM 573 C SER A1084 -4.642 -12.523 0.063 1.00 1.10 C ATOM 574 O SER A1084 -4.022 -13.377 -0.578 1.00 1.32 O ATOM 575 CB SER A1084 -3.955 -10.239 0.922 1.00 1.11 C ATOM 576 OG SER A1084 -5.267 -9.703 0.969 1.00 1.44 O ATOM 0 H SER A1084 -1.900 -11.589 1.206 1.00 1.15 H new ATOM 0 HA SER A1084 -4.611 -11.938 2.094 1.00 1.15 H new ATOM 0 HB2 SER A1084 -3.320 -9.729 1.647 1.00 1.11 H new ATOM 0 HB3 SER A1084 -3.519 -10.066 -0.062 1.00 1.11 H new ATOM 0 HG SER A1084 -5.235 -8.742 0.778 1.00 1.44 H new ATOM 582 N GLU A1085 -5.920 -12.237 -0.203 1.00 1.12 N ATOM 583 CA GLU A1085 -6.772 -12.862 -1.238 1.00 1.23 C ATOM 584 C GLU A1085 -7.507 -11.817 -2.121 1.00 1.06 C ATOM 585 O GLU A1085 -8.467 -12.133 -2.826 1.00 1.19 O ATOM 586 CB GLU A1085 -7.754 -13.852 -0.575 1.00 1.68 C ATOM 587 CG GLU A1085 -7.049 -15.004 0.162 1.00 2.30 C ATOM 588 CD GLU A1085 -8.037 -16.040 0.715 1.00 3.01 C ATOM 589 OE1 GLU A1085 -8.655 -16.771 -0.100 1.00 3.29 O ATOM 590 OE2 GLU A1085 -8.176 -16.155 1.959 1.00 4.08 O ATOM 0 H GLU A1085 -6.423 -11.523 0.324 1.00 1.12 H new ATOM 0 HA GLU A1085 -6.124 -13.414 -1.919 1.00 1.23 H new ATOM 0 HB2 GLU A1085 -8.385 -13.311 0.130 1.00 1.68 H new ATOM 0 HB3 GLU A1085 -8.412 -14.267 -1.338 1.00 1.68 H new ATOM 0 HG2 GLU A1085 -6.355 -15.496 -0.519 1.00 2.30 H new ATOM 0 HG3 GLU A1085 -6.457 -14.598 0.982 1.00 2.30 H new ATOM 597 N HIS A1086 -7.064 -10.556 -2.065 1.00 0.94 N ATOM 598 CA HIS A1086 -7.644 -9.399 -2.765 1.00 0.81 C ATOM 599 C HIS A1086 -7.451 -9.431 -4.302 1.00 0.83 C ATOM 600 O HIS A1086 -6.635 -10.210 -4.802 1.00 1.13 O ATOM 601 CB HIS A1086 -7.051 -8.126 -2.135 1.00 0.72 C ATOM 602 CG HIS A1086 -7.890 -7.583 -1.006 1.00 1.05 C ATOM 603 ND1 HIS A1086 -8.565 -6.383 -1.003 1.00 2.19 N ATOM 604 CD2 HIS A1086 -8.141 -8.186 0.197 1.00 1.05 C ATOM 605 CE1 HIS A1086 -9.190 -6.258 0.181 1.00 2.23 C ATOM 606 NE2 HIS A1086 -8.961 -7.337 0.945 1.00 1.42 N ATOM 0 H HIS A1086 -6.252 -10.300 -1.504 1.00 0.94 H new ATOM 0 HA HIS A1086 -8.726 -9.423 -2.637 1.00 0.81 H new ATOM 0 HB2 HIS A1086 -6.049 -8.343 -1.764 1.00 0.72 H new ATOM 0 HB3 HIS A1086 -6.947 -7.361 -2.904 1.00 0.72 H new ATOM 0 HD1 HIS A1086 -8.587 -5.707 -1.766 1.00 2.19 H new ATOM 0 HD2 HIS A1086 -7.770 -9.150 0.513 1.00 1.05 H new ATOM 0 HE1 HIS A1086 -9.791 -5.410 0.475 1.00 2.23 H new ATOM 614 N PRO A1087 -8.174 -8.590 -5.078 1.00 0.86 N ATOM 615 CA PRO A1087 -8.162 -8.644 -6.545 1.00 1.07 C ATOM 616 C PRO A1087 -7.074 -7.775 -7.205 1.00 1.02 C ATOM 617 O PRO A1087 -6.683 -8.046 -8.339 1.00 1.45 O ATOM 618 CB PRO A1087 -9.550 -8.137 -6.949 1.00 1.28 C ATOM 619 CG PRO A1087 -9.874 -7.094 -5.880 1.00 1.03 C ATOM 620 CD PRO A1087 -9.179 -7.628 -4.626 1.00 1.01 C ATOM 0 HA PRO A1087 -7.936 -9.657 -6.879 1.00 1.07 H new ATOM 0 HB2 PRO A1087 -9.543 -7.700 -7.947 1.00 1.28 H new ATOM 0 HB3 PRO A1087 -10.284 -8.943 -6.959 1.00 1.28 H new ATOM 0 HG2 PRO A1087 -9.499 -6.108 -6.156 1.00 1.03 H new ATOM 0 HG3 PRO A1087 -10.949 -6.995 -5.730 1.00 1.03 H new ATOM 0 HD2 PRO A1087 -8.714 -6.817 -4.067 1.00 1.01 H new ATOM 0 HD3 PRO A1087 -9.897 -8.104 -3.959 1.00 1.01 H new ATOM 628 N LEU A1088 -6.612 -6.735 -6.498 1.00 0.71 N ATOM 629 CA LEU A1088 -5.785 -5.623 -6.997 1.00 0.82 C ATOM 630 C LEU A1088 -4.356 -5.647 -6.425 1.00 0.80 C ATOM 631 O LEU A1088 -3.380 -5.582 -7.172 1.00 1.02 O ATOM 632 CB LEU A1088 -6.615 -4.363 -6.654 1.00 0.89 C ATOM 633 CG LEU A1088 -6.129 -2.952 -7.029 1.00 0.64 C ATOM 634 CD1 LEU A1088 -7.319 -1.991 -6.933 1.00 0.64 C ATOM 635 CD2 LEU A1088 -5.052 -2.407 -6.081 1.00 0.72 C ATOM 0 H LEU A1088 -6.816 -6.640 -5.503 1.00 0.71 H new ATOM 0 HA LEU A1088 -5.590 -5.673 -8.068 1.00 0.82 H new ATOM 0 HB2 LEU A1088 -7.594 -4.494 -7.115 1.00 0.89 H new ATOM 0 HB3 LEU A1088 -6.768 -4.369 -5.575 1.00 0.89 H new ATOM 0 HG LEU A1088 -5.705 -3.023 -8.031 1.00 0.64 H new ATOM 0 HD11 LEU A1088 -6.995 -0.984 -7.195 1.00 0.64 H new ATOM 0 HD12 LEU A1088 -8.102 -2.311 -7.621 1.00 0.64 H new ATOM 0 HD13 LEU A1088 -7.708 -1.994 -5.915 1.00 0.64 H new ATOM 0 HD21 LEU A1088 -4.755 -1.409 -6.403 1.00 0.72 H new ATOM 0 HD22 LEU A1088 -5.451 -2.357 -5.068 1.00 0.72 H new ATOM 0 HD23 LEU A1088 -4.185 -3.067 -6.098 1.00 0.72 H new ATOM 647 N GLY A1089 -4.240 -5.796 -5.102 1.00 0.68 N ATOM 648 CA GLY A1089 -2.959 -5.809 -4.380 1.00 0.86 C ATOM 649 C GLY A1089 -1.961 -6.897 -4.820 1.00 0.87 C ATOM 650 O GLY A1089 -0.749 -6.707 -4.698 1.00 0.93 O ATOM 0 H GLY A1089 -5.047 -5.913 -4.489 1.00 0.68 H new ATOM 0 HA2 GLY A1089 -2.484 -4.835 -4.500 1.00 0.86 H new ATOM 0 HA3 GLY A1089 -3.162 -5.936 -3.317 1.00 0.86 H new ATOM 654 N THR A1090 -2.418 -7.980 -5.459 1.00 0.86 N ATOM 655 CA THR A1090 -1.543 -9.065 -5.946 1.00 0.89 C ATOM 656 C THR A1090 -0.597 -8.653 -7.083 1.00 0.81 C ATOM 657 O THR A1090 0.397 -9.339 -7.343 1.00 0.84 O ATOM 658 CB THR A1090 -2.339 -10.323 -6.315 1.00 0.99 C ATOM 659 OG1 THR A1090 -3.228 -10.061 -7.377 1.00 1.26 O ATOM 660 CG2 THR A1090 -3.139 -10.835 -5.120 1.00 1.28 C ATOM 0 H THR A1090 -3.407 -8.134 -5.656 1.00 0.86 H new ATOM 0 HA THR A1090 -0.899 -9.303 -5.099 1.00 0.89 H new ATOM 0 HB THR A1090 -1.619 -11.082 -6.621 1.00 0.99 H new ATOM 0 HG1 THR A1090 -3.724 -10.877 -7.597 1.00 1.26 H new ATOM 0 HG21 THR A1090 -3.694 -11.727 -5.409 1.00 1.28 H new ATOM 0 HG22 THR A1090 -2.458 -11.079 -4.304 1.00 1.28 H new ATOM 0 HG23 THR A1090 -3.837 -10.064 -4.792 1.00 1.28 H new ATOM 668 N ALA A1091 -0.833 -7.496 -7.713 1.00 0.77 N ATOM 669 CA ALA A1091 0.114 -6.855 -8.628 1.00 0.77 C ATOM 670 C ALA A1091 1.390 -6.395 -7.884 1.00 0.71 C ATOM 671 O ALA A1091 2.508 -6.492 -8.401 1.00 0.72 O ATOM 672 CB ALA A1091 -0.606 -5.662 -9.267 1.00 0.78 C ATOM 0 H ALA A1091 -1.701 -6.972 -7.598 1.00 0.77 H new ATOM 0 HA ALA A1091 0.437 -7.562 -9.392 1.00 0.77 H new ATOM 0 HB1 ALA A1091 0.069 -5.157 -9.958 1.00 0.78 H new ATOM 0 HB2 ALA A1091 -1.483 -6.015 -9.810 1.00 0.78 H new ATOM 0 HB3 ALA A1091 -0.917 -4.965 -8.489 1.00 0.78 H new ATOM 678 N ILE A1092 1.222 -5.932 -6.638 1.00 0.67 N ATOM 679 CA ILE A1092 2.305 -5.555 -5.721 1.00 0.64 C ATOM 680 C ILE A1092 3.036 -6.807 -5.218 1.00 0.64 C ATOM 681 O ILE A1092 4.262 -6.786 -5.117 1.00 0.64 O ATOM 682 CB ILE A1092 1.796 -4.696 -4.535 1.00 0.65 C ATOM 683 CG1 ILE A1092 0.807 -3.579 -4.949 1.00 0.70 C ATOM 684 CG2 ILE A1092 3.008 -4.049 -3.845 1.00 0.71 C ATOM 685 CD1 ILE A1092 0.046 -2.977 -3.762 1.00 0.71 C ATOM 0 H ILE A1092 0.297 -5.806 -6.227 1.00 0.67 H new ATOM 0 HA ILE A1092 3.008 -4.937 -6.279 1.00 0.64 H new ATOM 0 HB ILE A1092 1.251 -5.366 -3.870 1.00 0.65 H new ATOM 0 HG12 ILE A1092 1.356 -2.788 -5.460 1.00 0.70 H new ATOM 0 HG13 ILE A1092 0.091 -3.983 -5.664 1.00 0.70 H new ATOM 0 HG21 ILE A1092 2.668 -3.440 -3.007 1.00 0.71 H new ATOM 0 HG22 ILE A1092 3.677 -4.828 -3.479 1.00 0.71 H new ATOM 0 HG23 ILE A1092 3.540 -3.419 -4.558 1.00 0.71 H new ATOM 0 HD11 ILE A1092 -0.630 -2.200 -4.119 1.00 0.71 H new ATOM 0 HD12 ILE A1092 -0.529 -3.758 -3.265 1.00 0.71 H new ATOM 0 HD13 ILE A1092 0.755 -2.544 -3.057 1.00 0.71 H new ATOM 697 N THR A1093 2.327 -7.922 -4.984 1.00 0.70 N ATOM 698 CA THR A1093 2.974 -9.221 -4.691 1.00 0.76 C ATOM 699 C THR A1093 3.970 -9.609 -5.781 1.00 0.76 C ATOM 700 O THR A1093 5.118 -9.906 -5.454 1.00 0.75 O ATOM 701 CB THR A1093 1.980 -10.380 -4.514 1.00 0.93 C ATOM 702 OG1 THR A1093 0.947 -9.982 -3.663 1.00 1.24 O ATOM 703 CG2 THR A1093 2.629 -11.599 -3.860 1.00 1.13 C ATOM 0 H THR A1093 1.308 -7.956 -4.991 1.00 0.70 H new ATOM 0 HA THR A1093 3.488 -9.065 -3.742 1.00 0.76 H new ATOM 0 HB THR A1093 1.622 -10.641 -5.510 1.00 0.93 H new ATOM 0 HG1 THR A1093 0.383 -10.755 -3.449 1.00 1.24 H new ATOM 0 HG21 THR A1093 1.889 -12.393 -3.755 1.00 1.13 H new ATOM 0 HG22 THR A1093 3.452 -11.950 -4.482 1.00 1.13 H new ATOM 0 HG23 THR A1093 3.009 -11.325 -2.876 1.00 1.13 H new ATOM 711 N LYS A1094 3.586 -9.530 -7.069 1.00 0.79 N ATOM 712 CA LYS A1094 4.499 -9.768 -8.199 1.00 0.83 C ATOM 713 C LYS A1094 5.690 -8.804 -8.179 1.00 0.75 C ATOM 714 O LYS A1094 6.829 -9.261 -8.238 1.00 0.76 O ATOM 715 CB LYS A1094 3.724 -9.745 -9.535 1.00 0.94 C ATOM 716 CG LYS A1094 4.691 -9.776 -10.732 1.00 0.99 C ATOM 717 CD LYS A1094 4.076 -10.239 -12.063 1.00 1.29 C ATOM 718 CE LYS A1094 3.156 -9.198 -12.727 1.00 2.39 C ATOM 719 NZ LYS A1094 2.783 -9.622 -14.103 1.00 2.85 N ATOM 0 H LYS A1094 2.634 -9.299 -7.354 1.00 0.79 H new ATOM 0 HA LYS A1094 4.926 -10.766 -8.095 1.00 0.83 H new ATOM 0 HB2 LYS A1094 3.051 -10.601 -9.584 1.00 0.94 H new ATOM 0 HB3 LYS A1094 3.105 -8.849 -9.586 1.00 0.94 H new ATOM 0 HG2 LYS A1094 5.104 -8.777 -10.870 1.00 0.99 H new ATOM 0 HG3 LYS A1094 5.524 -10.435 -10.487 1.00 0.99 H new ATOM 0 HD2 LYS A1094 4.880 -10.491 -12.754 1.00 1.29 H new ATOM 0 HD3 LYS A1094 3.507 -11.153 -11.890 1.00 1.29 H new ATOM 0 HE2 LYS A1094 2.256 -9.066 -12.126 1.00 2.39 H new ATOM 0 HE3 LYS A1094 3.660 -8.232 -12.764 1.00 2.39 H new ATOM 0 HZ1 LYS A1094 2.163 -8.905 -14.531 1.00 2.85 H new ATOM 0 HZ2 LYS A1094 3.642 -9.725 -14.680 1.00 2.85 H new ATOM 0 HZ3 LYS A1094 2.283 -10.533 -14.062 1.00 2.85 H new ATOM 733 N TYR A1095 5.441 -7.499 -8.026 1.00 0.69 N ATOM 734 CA TYR A1095 6.476 -6.453 -7.977 1.00 0.67 C ATOM 735 C TYR A1095 7.510 -6.710 -6.864 1.00 0.61 C ATOM 736 O TYR A1095 8.718 -6.633 -7.098 1.00 0.64 O ATOM 737 CB TYR A1095 5.767 -5.098 -7.798 1.00 0.65 C ATOM 738 CG TYR A1095 6.627 -3.845 -7.882 1.00 0.69 C ATOM 739 CD1 TYR A1095 7.435 -3.457 -6.792 1.00 1.98 C ATOM 740 CD2 TYR A1095 6.554 -3.016 -9.021 1.00 2.36 C ATOM 741 CE1 TYR A1095 8.177 -2.261 -6.847 1.00 2.04 C ATOM 742 CE2 TYR A1095 7.284 -1.811 -9.072 1.00 2.40 C ATOM 743 CZ TYR A1095 8.103 -1.431 -7.987 1.00 0.97 C ATOM 744 OH TYR A1095 8.801 -0.262 -8.035 1.00 1.17 O ATOM 0 H TYR A1095 4.495 -7.130 -7.930 1.00 0.69 H new ATOM 0 HA TYR A1095 7.045 -6.456 -8.907 1.00 0.67 H new ATOM 0 HB2 TYR A1095 4.986 -5.023 -8.555 1.00 0.65 H new ATOM 0 HB3 TYR A1095 5.271 -5.102 -6.828 1.00 0.65 H new ATOM 0 HD1 TYR A1095 7.485 -4.080 -5.911 1.00 1.98 H new ATOM 0 HD2 TYR A1095 5.936 -3.306 -9.858 1.00 2.36 H new ATOM 0 HE1 TYR A1095 8.804 -1.978 -6.015 1.00 2.04 H new ATOM 0 HE2 TYR A1095 7.216 -1.177 -9.944 1.00 2.40 H new ATOM 0 HH TYR A1095 8.636 0.183 -8.892 1.00 1.17 H new ATOM 754 N CYS A1096 7.051 -7.078 -5.663 1.00 0.57 N ATOM 755 CA CYS A1096 7.909 -7.414 -4.528 1.00 0.57 C ATOM 756 C CYS A1096 8.649 -8.742 -4.747 1.00 0.59 C ATOM 757 O CYS A1096 9.872 -8.765 -4.673 1.00 0.62 O ATOM 758 CB CYS A1096 7.054 -7.406 -3.256 1.00 0.57 C ATOM 759 SG CYS A1096 8.106 -7.611 -1.791 1.00 1.67 S ATOM 0 H CYS A1096 6.056 -7.151 -5.452 1.00 0.57 H new ATOM 0 HA CYS A1096 8.696 -6.667 -4.422 1.00 0.57 H new ATOM 0 HB2 CYS A1096 6.501 -6.469 -3.187 1.00 0.57 H new ATOM 0 HB3 CYS A1096 6.318 -8.209 -3.299 1.00 0.57 H new ATOM 0 HG CYS A1096 7.889 -6.634 -0.961 1.00 1.67 H new ATOM 765 N LYS A1097 7.964 -9.832 -5.117 1.00 0.62 N ATOM 766 CA LYS A1097 8.597 -11.129 -5.417 1.00 0.73 C ATOM 767 C LYS A1097 9.665 -11.018 -6.511 1.00 0.81 C ATOM 768 O LYS A1097 10.713 -11.643 -6.379 1.00 0.90 O ATOM 769 CB LYS A1097 7.478 -12.131 -5.776 1.00 0.73 C ATOM 770 CG LYS A1097 7.898 -13.441 -6.468 1.00 1.22 C ATOM 771 CD LYS A1097 8.618 -14.420 -5.539 1.00 1.04 C ATOM 772 CE LYS A1097 7.673 -15.087 -4.528 1.00 2.34 C ATOM 773 NZ LYS A1097 6.905 -16.201 -5.130 1.00 2.80 N ATOM 0 H LYS A1097 6.949 -9.842 -5.218 1.00 0.62 H new ATOM 0 HA LYS A1097 9.137 -11.487 -4.540 1.00 0.73 H new ATOM 0 HB2 LYS A1097 6.949 -12.389 -4.858 1.00 0.73 H new ATOM 0 HB3 LYS A1097 6.764 -11.622 -6.423 1.00 0.73 H new ATOM 0 HG2 LYS A1097 7.012 -13.926 -6.877 1.00 1.22 H new ATOM 0 HG3 LYS A1097 8.550 -13.205 -7.309 1.00 1.22 H new ATOM 0 HD2 LYS A1097 9.105 -15.190 -6.137 1.00 1.04 H new ATOM 0 HD3 LYS A1097 9.404 -13.891 -5.000 1.00 1.04 H new ATOM 0 HE2 LYS A1097 8.252 -15.462 -3.684 1.00 2.34 H new ATOM 0 HE3 LYS A1097 6.981 -14.342 -4.134 1.00 2.34 H new ATOM 0 HZ1 LYS A1097 6.281 -16.621 -4.411 1.00 2.80 H new ATOM 0 HZ2 LYS A1097 6.331 -15.841 -5.919 1.00 2.80 H new ATOM 0 HZ3 LYS A1097 7.563 -16.925 -5.483 1.00 2.80 H new ATOM 787 N GLN A1098 9.434 -10.206 -7.544 1.00 0.80 N ATOM 788 CA GLN A1098 10.411 -9.934 -8.602 1.00 0.89 C ATOM 789 C GLN A1098 11.602 -9.086 -8.107 1.00 0.87 C ATOM 790 O GLN A1098 12.731 -9.339 -8.523 1.00 0.98 O ATOM 791 CB GLN A1098 9.667 -9.323 -9.809 1.00 0.96 C ATOM 792 CG GLN A1098 10.556 -8.721 -10.911 1.00 1.21 C ATOM 793 CD GLN A1098 11.449 -9.715 -11.649 1.00 2.02 C ATOM 794 OE1 GLN A1098 11.539 -10.900 -11.341 1.00 3.08 O ATOM 795 NE2 GLN A1098 12.134 -9.276 -12.676 1.00 2.47 N ATOM 0 H GLN A1098 8.551 -9.712 -7.672 1.00 0.80 H new ATOM 0 HA GLN A1098 10.874 -10.867 -8.922 1.00 0.89 H new ATOM 0 HB2 GLN A1098 9.042 -10.096 -10.255 1.00 0.96 H new ATOM 0 HB3 GLN A1098 8.998 -8.544 -9.443 1.00 0.96 H new ATOM 0 HG2 GLN A1098 9.916 -8.224 -11.639 1.00 1.21 H new ATOM 0 HG3 GLN A1098 11.188 -7.953 -10.465 1.00 1.21 H new ATOM 0 HE21 GLN A1098 12.073 -8.295 -12.948 1.00 2.47 H new ATOM 0 HE22 GLN A1098 12.728 -9.915 -13.204 1.00 2.47 H new ATOM 804 N GLU A1099 11.389 -8.129 -7.196 1.00 0.77 N ATOM 805 CA GLU A1099 12.457 -7.336 -6.560 1.00 0.78 C ATOM 806 C GLU A1099 13.313 -8.167 -5.581 1.00 0.79 C ATOM 807 O GLU A1099 14.547 -8.080 -5.612 1.00 0.88 O ATOM 808 CB GLU A1099 11.818 -6.119 -5.862 1.00 0.77 C ATOM 809 CG GLU A1099 12.789 -5.205 -5.091 1.00 0.84 C ATOM 810 CD GLU A1099 13.863 -4.553 -5.968 1.00 1.02 C ATOM 811 OE1 GLU A1099 13.577 -4.174 -7.127 1.00 1.68 O ATOM 812 OE2 GLU A1099 15.014 -4.382 -5.497 1.00 2.03 O ATOM 0 H GLU A1099 10.455 -7.877 -6.872 1.00 0.77 H new ATOM 0 HA GLU A1099 13.146 -6.998 -7.334 1.00 0.78 H new ATOM 0 HB2 GLU A1099 11.304 -5.520 -6.614 1.00 0.77 H new ATOM 0 HB3 GLU A1099 11.058 -6.479 -5.168 1.00 0.77 H new ATOM 0 HG2 GLU A1099 12.217 -4.422 -4.594 1.00 0.84 H new ATOM 0 HG3 GLU A1099 13.277 -5.788 -4.310 1.00 0.84 H new ATOM 819 N LEU A1100 12.678 -8.959 -4.710 1.00 0.75 N ATOM 820 CA LEU A1100 13.341 -9.835 -3.733 1.00 0.80 C ATOM 821 C LEU A1100 13.977 -11.083 -4.363 1.00 0.89 C ATOM 822 O LEU A1100 14.965 -11.583 -3.830 1.00 1.05 O ATOM 823 CB LEU A1100 12.365 -10.259 -2.616 1.00 0.77 C ATOM 824 CG LEU A1100 11.622 -9.144 -1.854 1.00 0.77 C ATOM 825 CD1 LEU A1100 10.970 -9.713 -0.594 1.00 0.77 C ATOM 826 CD2 LEU A1100 12.503 -7.962 -1.467 1.00 0.86 C ATOM 0 H LEU A1100 11.660 -9.011 -4.663 1.00 0.75 H new ATOM 0 HA LEU A1100 14.150 -9.241 -3.309 1.00 0.80 H new ATOM 0 HB2 LEU A1100 11.618 -10.920 -3.056 1.00 0.77 H new ATOM 0 HB3 LEU A1100 12.923 -10.848 -1.888 1.00 0.77 H new ATOM 0 HG LEU A1100 10.871 -8.764 -2.546 1.00 0.77 H new ATOM 0 HD11 LEU A1100 10.448 -8.917 -0.063 1.00 0.77 H new ATOM 0 HD12 LEU A1100 10.259 -10.491 -0.872 1.00 0.77 H new ATOM 0 HD13 LEU A1100 11.738 -10.138 0.053 1.00 0.77 H new ATOM 0 HD21 LEU A1100 11.906 -7.222 -0.935 1.00 0.86 H new ATOM 0 HD22 LEU A1100 13.312 -8.307 -0.823 1.00 0.86 H new ATOM 0 HD23 LEU A1100 12.923 -7.511 -2.366 1.00 0.86 H new ATOM 838 N ASP A1101 13.416 -11.590 -5.468 1.00 0.92 N ATOM 839 CA ASP A1101 13.830 -12.826 -6.147 1.00 1.10 C ATOM 840 C ASP A1101 13.845 -14.042 -5.185 1.00 1.03 C ATOM 841 O ASP A1101 14.829 -14.783 -5.113 1.00 1.11 O ATOM 842 CB ASP A1101 15.143 -12.548 -6.911 1.00 1.38 C ATOM 843 CG ASP A1101 15.507 -13.610 -7.951 1.00 1.77 C ATOM 844 OD1 ASP A1101 14.767 -13.747 -8.957 1.00 2.68 O ATOM 845 OD2 ASP A1101 16.577 -14.258 -7.816 1.00 1.94 O ATOM 0 H ASP A1101 12.631 -11.133 -5.932 1.00 0.92 H new ATOM 0 HA ASP A1101 13.095 -13.127 -6.894 1.00 1.10 H new ATOM 0 HB2 ASP A1101 15.061 -11.582 -7.409 1.00 1.38 H new ATOM 0 HB3 ASP A1101 15.958 -12.468 -6.191 1.00 1.38 H new ATOM 850 N THR A1102 12.787 -14.198 -4.369 1.00 1.00 N ATOM 851 CA THR A1102 12.731 -15.165 -3.248 1.00 1.07 C ATOM 852 C THR A1102 11.335 -15.740 -2.966 1.00 1.44 C ATOM 853 O THR A1102 10.339 -15.030 -3.074 1.00 2.61 O ATOM 854 CB THR A1102 13.309 -14.522 -1.974 1.00 1.16 C ATOM 855 OG1 THR A1102 13.819 -15.544 -1.147 1.00 1.59 O ATOM 856 CG2 THR A1102 12.297 -13.704 -1.162 1.00 1.31 C ATOM 0 H THR A1102 11.933 -13.650 -4.468 1.00 1.00 H new ATOM 0 HA THR A1102 13.337 -16.016 -3.559 1.00 1.07 H new ATOM 0 HB THR A1102 14.080 -13.825 -2.304 1.00 1.16 H new ATOM 0 HG1 THR A1102 14.192 -15.149 -0.332 1.00 1.59 H new ATOM 0 HG21 THR A1102 12.788 -13.287 -0.283 1.00 1.31 H new ATOM 0 HG22 THR A1102 11.907 -12.894 -1.778 1.00 1.31 H new ATOM 0 HG23 THR A1102 11.476 -14.349 -0.848 1.00 1.31 H new ATOM 864 N GLU A1103 11.241 -17.003 -2.533 1.00 1.36 N ATOM 865 CA GLU A1103 9.976 -17.727 -2.296 1.00 1.74 C ATOM 866 C GLU A1103 9.617 -17.913 -0.797 1.00 2.05 C ATOM 867 O GLU A1103 8.836 -18.786 -0.417 1.00 2.73 O ATOM 868 CB GLU A1103 9.981 -19.034 -3.118 1.00 1.66 C ATOM 869 CG GLU A1103 8.554 -19.559 -3.317 1.00 2.14 C ATOM 870 CD GLU A1103 8.447 -20.731 -4.289 1.00 2.42 C ATOM 871 OE1 GLU A1103 8.255 -20.483 -5.506 1.00 2.81 O ATOM 872 OE2 GLU A1103 8.466 -21.897 -3.825 1.00 3.39 O ATOM 0 H GLU A1103 12.064 -17.570 -2.331 1.00 1.36 H new ATOM 0 HA GLU A1103 9.155 -17.105 -2.652 1.00 1.74 H new ATOM 0 HB2 GLU A1103 10.446 -18.857 -4.088 1.00 1.66 H new ATOM 0 HB3 GLU A1103 10.582 -19.787 -2.608 1.00 1.66 H new ATOM 0 HG2 GLU A1103 8.154 -19.866 -2.351 1.00 2.14 H new ATOM 0 HG3 GLU A1103 7.926 -18.744 -3.678 1.00 2.14 H new ATOM 879 N THR A1104 10.198 -17.107 0.092 1.00 1.84 N ATOM 880 CA THR A1104 10.087 -17.283 1.559 1.00 2.31 C ATOM 881 C THR A1104 9.255 -16.202 2.259 1.00 1.84 C ATOM 882 O THR A1104 8.950 -16.311 3.451 1.00 2.66 O ATOM 883 CB THR A1104 11.493 -17.387 2.164 1.00 3.02 C ATOM 884 OG1 THR A1104 12.202 -16.195 1.909 1.00 3.99 O ATOM 885 CG2 THR A1104 12.259 -18.543 1.512 1.00 2.19 C ATOM 0 H THR A1104 10.766 -16.304 -0.178 1.00 1.84 H new ATOM 0 HA THR A1104 9.538 -18.209 1.729 1.00 2.31 H new ATOM 0 HB THR A1104 11.401 -17.557 3.237 1.00 3.02 H new ATOM 0 HG1 THR A1104 13.100 -16.259 2.296 1.00 3.99 H new ATOM 0 HG21 THR A1104 13.256 -18.610 1.947 1.00 2.19 H new ATOM 0 HG22 THR A1104 11.724 -19.477 1.685 1.00 2.19 H new ATOM 0 HG23 THR A1104 12.342 -18.365 0.440 1.00 2.19 H new ATOM 893 N LEU A1105 8.839 -15.173 1.513 1.00 1.42 N ATOM 894 CA LEU A1105 8.177 -13.974 2.030 1.00 0.94 C ATOM 895 C LEU A1105 6.738 -14.237 2.540 1.00 0.73 C ATOM 896 O LEU A1105 6.018 -15.077 1.991 1.00 0.94 O ATOM 897 CB LEU A1105 8.302 -12.842 0.979 1.00 0.78 C ATOM 898 CG LEU A1105 7.142 -12.691 -0.031 1.00 0.74 C ATOM 899 CD1 LEU A1105 7.089 -11.273 -0.599 1.00 0.56 C ATOM 900 CD2 LEU A1105 7.306 -13.671 -1.190 1.00 1.14 C ATOM 0 H LEU A1105 8.958 -15.153 0.500 1.00 1.42 H new ATOM 0 HA LEU A1105 8.687 -13.641 2.934 1.00 0.94 H new ATOM 0 HB2 LEU A1105 8.413 -11.897 1.511 1.00 0.78 H new ATOM 0 HB3 LEU A1105 9.222 -13.002 0.417 1.00 0.78 H new ATOM 0 HG LEU A1105 6.217 -12.902 0.505 1.00 0.74 H new ATOM 0 HD11 LEU A1105 6.264 -11.195 -1.307 1.00 0.56 H new ATOM 0 HD12 LEU A1105 6.939 -10.561 0.213 1.00 0.56 H new ATOM 0 HD13 LEU A1105 8.026 -11.050 -1.109 1.00 0.56 H new ATOM 0 HD21 LEU A1105 6.479 -13.549 -1.890 1.00 1.14 H new ATOM 0 HD22 LEU A1105 8.248 -13.474 -1.703 1.00 1.14 H new ATOM 0 HD23 LEU A1105 7.308 -14.691 -0.806 1.00 1.14 H new ATOM 912 N GLY A1106 6.311 -13.471 3.552 1.00 0.60 N ATOM 913 CA GLY A1106 4.995 -13.545 4.198 1.00 0.69 C ATOM 914 C GLY A1106 4.789 -14.767 5.103 1.00 0.65 C ATOM 915 O GLY A1106 5.147 -15.887 4.740 1.00 0.98 O ATOM 0 H GLY A1106 6.903 -12.748 3.962 1.00 0.60 H new ATOM 0 HA2 GLY A1106 4.846 -12.642 4.791 1.00 0.69 H new ATOM 0 HA3 GLY A1106 4.226 -13.549 3.425 1.00 0.69 H new ATOM 919 N THR A1107 4.183 -14.557 6.278 1.00 0.52 N ATOM 920 CA THR A1107 3.817 -15.614 7.242 1.00 0.57 C ATOM 921 C THR A1107 2.410 -15.414 7.827 1.00 0.63 C ATOM 922 O THR A1107 1.664 -16.381 7.963 1.00 1.40 O ATOM 923 CB THR A1107 4.883 -15.733 8.360 1.00 0.66 C ATOM 924 OG1 THR A1107 6.132 -16.068 7.795 1.00 0.80 O ATOM 925 CG2 THR A1107 4.573 -16.832 9.373 1.00 0.83 C ATOM 0 H THR A1107 3.925 -13.623 6.598 1.00 0.52 H new ATOM 0 HA THR A1107 3.792 -16.555 6.692 1.00 0.57 H new ATOM 0 HB THR A1107 4.890 -14.766 8.863 1.00 0.66 H new ATOM 0 HG1 THR A1107 6.366 -16.987 8.041 1.00 0.80 H new ATOM 0 HG21 THR A1107 5.358 -16.862 10.129 1.00 0.83 H new ATOM 0 HG22 THR A1107 3.616 -16.626 9.852 1.00 0.83 H new ATOM 0 HG23 THR A1107 4.523 -17.794 8.863 1.00 0.83 H new ATOM 933 N CYS A1108 2.017 -14.182 8.163 1.00 0.84 N ATOM 934 CA CYS A1108 0.782 -13.854 8.898 1.00 0.89 C ATOM 935 C CYS A1108 0.042 -12.608 8.365 1.00 1.05 C ATOM 936 O CYS A1108 0.702 -11.654 7.956 1.00 1.53 O ATOM 937 CB CYS A1108 1.191 -13.715 10.364 1.00 1.52 C ATOM 938 SG CYS A1108 -0.072 -12.935 11.411 1.00 2.47 S ATOM 0 H CYS A1108 2.565 -13.355 7.925 1.00 0.84 H new ATOM 0 HA CYS A1108 0.047 -14.647 8.762 1.00 0.89 H new ATOM 0 HB2 CYS A1108 1.419 -14.704 10.762 1.00 1.52 H new ATOM 0 HB3 CYS A1108 2.108 -13.129 10.421 1.00 1.52 H new ATOM 0 HG CYS A1108 0.363 -12.862 12.634 1.00 2.47 H new ATOM 944 N ILE A1109 -1.299 -12.642 8.371 1.00 0.82 N ATOM 945 CA ILE A1109 -2.267 -11.553 8.148 1.00 0.84 C ATOM 946 C ILE A1109 -3.435 -11.735 9.141 1.00 0.69 C ATOM 947 O ILE A1109 -3.980 -12.837 9.251 1.00 0.87 O ATOM 948 CB ILE A1109 -2.766 -11.542 6.678 1.00 1.02 C ATOM 949 CG1 ILE A1109 -1.821 -10.745 5.760 1.00 1.52 C ATOM 950 CG2 ILE A1109 -4.196 -11.007 6.483 1.00 2.19 C ATOM 951 CD1 ILE A1109 -1.848 -9.228 5.944 1.00 2.25 C ATOM 0 H ILE A1109 -1.783 -13.522 8.550 1.00 0.82 H new ATOM 0 HA ILE A1109 -1.789 -10.589 8.321 1.00 0.84 H new ATOM 0 HB ILE A1109 -2.773 -12.597 6.403 1.00 1.02 H new ATOM 0 HG12 ILE A1109 -0.802 -11.095 5.925 1.00 1.52 H new ATOM 0 HG13 ILE A1109 -2.072 -10.972 4.724 1.00 1.52 H new ATOM 0 HG21 ILE A1109 -4.455 -11.038 5.425 1.00 2.19 H new ATOM 0 HG22 ILE A1109 -4.896 -11.625 7.046 1.00 2.19 H new ATOM 0 HG23 ILE A1109 -4.252 -9.979 6.840 1.00 2.19 H new ATOM 0 HD11 ILE A1109 -1.147 -8.765 5.250 1.00 2.25 H new ATOM 0 HD12 ILE A1109 -2.853 -8.855 5.747 1.00 2.25 H new ATOM 0 HD13 ILE A1109 -1.563 -8.980 6.967 1.00 2.25 H new ATOM 963 N ASP A1110 -3.870 -10.660 9.812 1.00 0.59 N ATOM 964 CA ASP A1110 -5.026 -10.694 10.741 1.00 0.70 C ATOM 965 C ASP A1110 -6.393 -10.343 10.099 1.00 1.01 C ATOM 966 O ASP A1110 -7.415 -10.751 10.638 1.00 2.60 O ATOM 967 CB ASP A1110 -4.700 -10.007 12.091 1.00 0.93 C ATOM 968 CG ASP A1110 -5.312 -8.630 12.360 1.00 2.13 C ATOM 969 OD1 ASP A1110 -5.375 -7.829 11.405 1.00 3.40 O ATOM 970 OD2 ASP A1110 -5.551 -8.305 13.553 1.00 2.93 O ATOM 0 H ASP A1110 -3.437 -9.740 9.732 1.00 0.59 H new ATOM 0 HA ASP A1110 -5.189 -11.741 10.996 1.00 0.70 H new ATOM 0 HB2 ASP A1110 -5.016 -10.676 12.892 1.00 0.93 H new ATOM 0 HB3 ASP A1110 -3.617 -9.912 12.165 1.00 0.93 H new ATOM 975 N PHE A1111 -6.397 -9.759 8.888 1.00 0.78 N ATOM 976 CA PHE A1111 -7.547 -9.444 8.007 1.00 0.86 C ATOM 977 C PHE A1111 -8.700 -8.601 8.605 1.00 0.83 C ATOM 978 O PHE A1111 -9.473 -9.048 9.448 1.00 1.18 O ATOM 979 CB PHE A1111 -8.149 -10.716 7.362 1.00 1.74 C ATOM 980 CG PHE A1111 -7.609 -11.218 6.029 1.00 1.32 C ATOM 981 CD1 PHE A1111 -7.615 -10.397 4.881 1.00 1.58 C ATOM 982 CD2 PHE A1111 -7.261 -12.576 5.886 1.00 2.59 C ATOM 983 CE1 PHE A1111 -7.291 -10.930 3.620 1.00 2.22 C ATOM 984 CE2 PHE A1111 -6.945 -13.112 4.627 1.00 3.14 C ATOM 985 CZ PHE A1111 -6.970 -12.290 3.489 1.00 2.71 C ATOM 0 H PHE A1111 -5.519 -9.467 8.458 1.00 0.78 H new ATOM 0 HA PHE A1111 -7.076 -8.799 7.265 1.00 0.86 H new ATOM 0 HB2 PHE A1111 -8.042 -11.527 8.082 1.00 1.74 H new ATOM 0 HB3 PHE A1111 -9.217 -10.541 7.235 1.00 1.74 H new ATOM 0 HD1 PHE A1111 -7.870 -9.351 4.971 1.00 1.58 H new ATOM 0 HD2 PHE A1111 -7.237 -13.214 6.757 1.00 2.59 H new ATOM 0 HE1 PHE A1111 -7.289 -10.290 2.750 1.00 2.22 H new ATOM 0 HE2 PHE A1111 -6.683 -14.156 4.534 1.00 3.14 H new ATOM 0 HZ PHE A1111 -6.743 -12.702 2.517 1.00 2.71 H new ATOM 995 N GLN A1112 -8.869 -7.387 8.083 1.00 0.63 N ATOM 996 CA GLN A1112 -10.041 -6.520 8.253 1.00 0.62 C ATOM 997 C GLN A1112 -10.294 -5.865 6.886 1.00 0.61 C ATOM 998 O GLN A1112 -9.656 -4.864 6.548 1.00 0.64 O ATOM 999 CB GLN A1112 -9.790 -5.458 9.344 1.00 0.67 C ATOM 1000 CG GLN A1112 -10.028 -5.887 10.791 1.00 0.77 C ATOM 1001 CD GLN A1112 -8.697 -6.034 11.449 1.00 1.09 C ATOM 1002 OE1 GLN A1112 -8.109 -5.092 11.970 1.00 2.68 O ATOM 1003 NE2 GLN A1112 -8.105 -7.166 11.279 1.00 1.30 N ATOM 0 H GLN A1112 -8.154 -6.955 7.497 1.00 0.63 H new ATOM 0 HA GLN A1112 -10.910 -7.091 8.579 1.00 0.62 H new ATOM 0 HB2 GLN A1112 -8.758 -5.118 9.256 1.00 0.67 H new ATOM 0 HB3 GLN A1112 -10.428 -4.599 9.135 1.00 0.67 H new ATOM 0 HG2 GLN A1112 -10.633 -5.146 11.314 1.00 0.77 H new ATOM 0 HG3 GLN A1112 -10.577 -6.828 10.825 1.00 0.77 H new ATOM 0 HE21 GLN A1112 -8.604 -7.942 10.845 1.00 1.30 H new ATOM 0 HE22 GLN A1112 -7.137 -7.286 11.579 1.00 1.30 H new ATOM 1012 N VAL A1113 -11.155 -6.470 6.060 1.00 0.76 N ATOM 1013 CA VAL A1113 -11.338 -6.074 4.646 1.00 0.85 C ATOM 1014 C VAL A1113 -12.569 -5.176 4.483 1.00 0.90 C ATOM 1015 O VAL A1113 -13.546 -5.325 5.223 1.00 0.98 O ATOM 1016 CB VAL A1113 -11.400 -7.273 3.671 1.00 1.08 C ATOM 1017 CG1 VAL A1113 -10.255 -8.257 3.925 1.00 2.77 C ATOM 1018 CG2 VAL A1113 -12.711 -8.062 3.688 1.00 1.61 C ATOM 0 H VAL A1113 -11.748 -7.249 6.346 1.00 0.76 H new ATOM 0 HA VAL A1113 -10.447 -5.508 4.375 1.00 0.85 H new ATOM 0 HB VAL A1113 -11.316 -6.807 2.689 1.00 1.08 H new ATOM 0 HG11 VAL A1113 -10.327 -9.088 3.223 1.00 2.77 H new ATOM 0 HG12 VAL A1113 -9.301 -7.748 3.788 1.00 2.77 H new ATOM 0 HG13 VAL A1113 -10.321 -8.636 4.945 1.00 2.77 H new ATOM 0 HG21 VAL A1113 -12.653 -8.880 2.970 1.00 1.61 H new ATOM 0 HG22 VAL A1113 -12.880 -8.466 4.686 1.00 1.61 H new ATOM 0 HG23 VAL A1113 -13.536 -7.402 3.420 1.00 1.61 H new ATOM 1028 N VAL A1114 -12.546 -4.274 3.496 1.00 0.91 N ATOM 1029 CA VAL A1114 -13.672 -3.407 3.116 1.00 0.98 C ATOM 1030 C VAL A1114 -13.738 -3.288 1.578 1.00 0.95 C ATOM 1031 O VAL A1114 -12.899 -2.595 0.992 1.00 0.84 O ATOM 1032 CB VAL A1114 -13.542 -2.010 3.766 1.00 1.02 C ATOM 1033 CG1 VAL A1114 -14.798 -1.179 3.480 1.00 1.13 C ATOM 1034 CG2 VAL A1114 -13.349 -2.042 5.290 1.00 1.08 C ATOM 0 H VAL A1114 -11.718 -4.121 2.920 1.00 0.91 H new ATOM 0 HA VAL A1114 -14.597 -3.855 3.480 1.00 0.98 H new ATOM 0 HB VAL A1114 -12.648 -1.571 3.324 1.00 1.02 H new ATOM 0 HG11 VAL A1114 -14.697 -0.197 3.942 1.00 1.13 H new ATOM 0 HG12 VAL A1114 -14.920 -1.063 2.403 1.00 1.13 H new ATOM 0 HG13 VAL A1114 -15.671 -1.686 3.892 1.00 1.13 H new ATOM 0 HG21 VAL A1114 -13.266 -1.023 5.668 1.00 1.08 H new ATOM 0 HG22 VAL A1114 -14.204 -2.533 5.755 1.00 1.08 H new ATOM 0 HG23 VAL A1114 -12.440 -2.593 5.530 1.00 1.08 H new ATOM 1044 N PRO A1115 -14.706 -3.933 0.889 1.00 1.11 N ATOM 1045 CA PRO A1115 -14.852 -3.841 -0.570 1.00 1.05 C ATOM 1046 C PRO A1115 -15.066 -2.394 -1.048 1.00 0.98 C ATOM 1047 O PRO A1115 -15.567 -1.556 -0.301 1.00 1.09 O ATOM 1048 CB PRO A1115 -16.025 -4.753 -0.943 1.00 1.29 C ATOM 1049 CG PRO A1115 -16.138 -5.710 0.243 1.00 1.89 C ATOM 1050 CD PRO A1115 -15.689 -4.860 1.427 1.00 1.39 C ATOM 0 HA PRO A1115 -13.937 -4.162 -1.069 1.00 1.05 H new ATOM 0 HB2 PRO A1115 -16.944 -4.184 -1.086 1.00 1.29 H new ATOM 0 HB3 PRO A1115 -15.834 -5.289 -1.872 1.00 1.29 H new ATOM 0 HG2 PRO A1115 -17.158 -6.071 0.372 1.00 1.89 H new ATOM 0 HG3 PRO A1115 -15.503 -6.587 0.114 1.00 1.89 H new ATOM 0 HD2 PRO A1115 -16.531 -4.327 1.869 1.00 1.39 H new ATOM 0 HD3 PRO A1115 -15.256 -5.479 2.213 1.00 1.39 H new ATOM 1058 N GLY A1116 -14.621 -2.057 -2.262 1.00 1.01 N ATOM 1059 CA GLY A1116 -14.607 -0.671 -2.756 1.00 1.10 C ATOM 1060 C GLY A1116 -13.536 0.229 -2.118 1.00 1.09 C ATOM 1061 O GLY A1116 -13.188 1.271 -2.681 1.00 1.53 O ATOM 0 H GLY A1116 -14.260 -2.735 -2.933 1.00 1.01 H new ATOM 0 HA2 GLY A1116 -14.453 -0.686 -3.835 1.00 1.10 H new ATOM 0 HA3 GLY A1116 -15.587 -0.227 -2.580 1.00 1.10 H new ATOM 1065 N CYS A1117 -12.988 -0.165 -0.961 1.00 0.98 N ATOM 1066 CA CYS A1117 -12.077 0.634 -0.151 1.00 1.09 C ATOM 1067 C CYS A1117 -10.664 0.026 -0.058 1.00 1.29 C ATOM 1068 O CYS A1117 -9.742 0.537 -0.692 1.00 1.98 O ATOM 1069 CB CYS A1117 -12.740 0.907 1.207 1.00 1.16 C ATOM 1070 SG CYS A1117 -11.751 2.064 2.193 1.00 2.30 S ATOM 0 H CYS A1117 -13.177 -1.081 -0.555 1.00 0.98 H new ATOM 0 HA CYS A1117 -11.902 1.593 -0.639 1.00 1.09 H new ATOM 0 HB2 CYS A1117 -13.738 1.317 1.052 1.00 1.16 H new ATOM 0 HB3 CYS A1117 -12.861 -0.029 1.752 1.00 1.16 H new ATOM 0 HG CYS A1117 -12.339 2.275 3.333 1.00 2.30 H new ATOM 1076 N GLY A1118 -10.469 -1.062 0.689 1.00 0.99 N ATOM 1077 CA GLY A1118 -9.135 -1.596 0.980 1.00 1.07 C ATOM 1078 C GLY A1118 -9.116 -2.586 2.144 1.00 0.90 C ATOM 1079 O GLY A1118 -10.110 -3.268 2.396 1.00 1.10 O ATOM 0 H GLY A1118 -11.229 -1.598 1.109 1.00 0.99 H new ATOM 0 HA2 GLY A1118 -8.747 -2.088 0.088 1.00 1.07 H new ATOM 0 HA3 GLY A1118 -8.462 -0.769 1.206 1.00 1.07 H new ATOM 1083 N ILE A1119 -7.978 -2.703 2.832 1.00 0.65 N ATOM 1084 CA ILE A1119 -7.799 -3.603 3.984 1.00 0.62 C ATOM 1085 C ILE A1119 -6.887 -3.004 5.067 1.00 0.48 C ATOM 1086 O ILE A1119 -5.945 -2.278 4.755 1.00 0.46 O ATOM 1087 CB ILE A1119 -7.331 -5.017 3.524 1.00 0.90 C ATOM 1088 CG1 ILE A1119 -6.817 -5.879 4.703 1.00 1.94 C ATOM 1089 CG2 ILE A1119 -6.278 -5.024 2.400 1.00 1.78 C ATOM 1090 CD1 ILE A1119 -6.359 -7.281 4.334 1.00 1.66 C ATOM 0 H ILE A1119 -7.139 -2.169 2.604 1.00 0.65 H new ATOM 0 HA ILE A1119 -8.775 -3.721 4.455 1.00 0.62 H new ATOM 0 HB ILE A1119 -8.239 -5.456 3.109 1.00 0.90 H new ATOM 0 HG12 ILE A1119 -5.986 -5.357 5.178 1.00 1.94 H new ATOM 0 HG13 ILE A1119 -7.610 -5.958 5.446 1.00 1.94 H new ATOM 0 HG21 ILE A1119 -6.018 -6.053 2.151 1.00 1.78 H new ATOM 0 HG22 ILE A1119 -6.684 -4.529 1.518 1.00 1.78 H new ATOM 0 HG23 ILE A1119 -5.386 -4.495 2.734 1.00 1.78 H new ATOM 0 HD11 ILE A1119 -6.019 -7.800 5.230 1.00 1.66 H new ATOM 0 HD12 ILE A1119 -7.189 -7.830 3.890 1.00 1.66 H new ATOM 0 HD13 ILE A1119 -5.540 -7.219 3.617 1.00 1.66 H new ATOM 1102 N SER A1120 -7.158 -3.363 6.330 1.00 0.50 N ATOM 1103 CA SER A1120 -6.270 -3.193 7.489 1.00 0.50 C ATOM 1104 C SER A1120 -5.922 -4.568 8.069 1.00 0.50 C ATOM 1105 O SER A1120 -6.722 -5.504 8.002 1.00 0.49 O ATOM 1106 CB SER A1120 -6.871 -2.254 8.546 1.00 0.53 C ATOM 1107 OG SER A1120 -6.019 -2.158 9.676 1.00 0.56 O ATOM 0 H SER A1120 -8.044 -3.800 6.583 1.00 0.50 H new ATOM 0 HA SER A1120 -5.350 -2.712 7.156 1.00 0.50 H new ATOM 0 HB2 SER A1120 -7.024 -1.265 8.115 1.00 0.53 H new ATOM 0 HB3 SER A1120 -7.850 -2.623 8.853 1.00 0.53 H new ATOM 0 HG SER A1120 -6.419 -1.554 10.337 1.00 0.56 H new ATOM 1113 N CYS A1121 -4.702 -4.735 8.578 1.00 0.51 N ATOM 1114 CA CYS A1121 -4.200 -6.024 9.051 1.00 0.46 C ATOM 1115 C CYS A1121 -2.940 -5.909 9.925 1.00 0.42 C ATOM 1116 O CYS A1121 -2.260 -4.878 9.928 1.00 0.45 O ATOM 1117 CB CYS A1121 -3.922 -6.909 7.823 1.00 0.51 C ATOM 1118 SG CYS A1121 -2.729 -6.111 6.714 1.00 0.73 S ATOM 0 H CYS A1121 -4.030 -3.974 8.674 1.00 0.51 H new ATOM 0 HA CYS A1121 -4.962 -6.467 9.693 1.00 0.46 H new ATOM 0 HB2 CYS A1121 -3.536 -7.876 8.145 1.00 0.51 H new ATOM 0 HB3 CYS A1121 -4.852 -7.100 7.288 1.00 0.51 H new ATOM 0 HG CYS A1121 -2.690 -4.836 6.963 1.00 0.73 H new ATOM 1124 N LYS A1122 -2.599 -6.987 10.646 1.00 0.45 N ATOM 1125 CA LYS A1122 -1.287 -7.145 11.301 1.00 0.60 C ATOM 1126 C LYS A1122 -0.505 -8.223 10.568 1.00 0.62 C ATOM 1127 O LYS A1122 -1.106 -9.204 10.133 1.00 0.89 O ATOM 1128 CB LYS A1122 -1.354 -7.503 12.796 1.00 0.94 C ATOM 1129 CG LYS A1122 -2.438 -6.834 13.613 1.00 1.01 C ATOM 1130 CD LYS A1122 -2.461 -5.314 13.503 1.00 0.81 C ATOM 1131 CE LYS A1122 -3.495 -4.791 14.487 1.00 0.87 C ATOM 1132 NZ LYS A1122 -4.874 -5.251 14.166 1.00 1.32 N ATOM 0 H LYS A1122 -3.226 -7.778 10.793 1.00 0.45 H new ATOM 0 HA LYS A1122 -0.799 -6.172 11.248 1.00 0.60 H new ATOM 0 HB2 LYS A1122 -1.483 -8.582 12.881 1.00 0.94 H new ATOM 0 HB3 LYS A1122 -0.391 -7.260 13.246 1.00 0.94 H new ATOM 0 HG2 LYS A1122 -3.406 -7.224 13.298 1.00 1.01 H new ATOM 0 HG3 LYS A1122 -2.309 -7.109 14.660 1.00 1.01 H new ATOM 0 HD2 LYS A1122 -1.478 -4.900 13.727 1.00 0.81 H new ATOM 0 HD3 LYS A1122 -2.712 -5.009 12.487 1.00 0.81 H new ATOM 0 HE2 LYS A1122 -3.232 -5.118 15.493 1.00 0.87 H new ATOM 0 HE3 LYS A1122 -3.471 -3.701 14.489 1.00 0.87 H new ATOM 0 HZ1 LYS A1122 -5.559 -4.725 14.745 1.00 1.32 H new ATOM 0 HZ2 LYS A1122 -5.070 -5.083 13.159 1.00 1.32 H new ATOM 0 HZ3 LYS A1122 -4.957 -6.267 14.370 1.00 1.32 H new ATOM 1146 N VAL A1123 0.813 -8.080 10.498 1.00 0.58 N ATOM 1147 CA VAL A1123 1.731 -9.097 9.967 1.00 0.57 C ATOM 1148 C VAL A1123 2.786 -9.473 11.008 1.00 0.59 C ATOM 1149 O VAL A1123 3.049 -8.710 11.941 1.00 0.82 O ATOM 1150 CB VAL A1123 2.347 -8.670 8.619 1.00 0.80 C ATOM 1151 CG1 VAL A1123 1.255 -8.433 7.566 1.00 1.78 C ATOM 1152 CG2 VAL A1123 3.206 -7.405 8.709 1.00 2.23 C ATOM 0 H VAL A1123 1.291 -7.236 10.815 1.00 0.58 H new ATOM 0 HA VAL A1123 1.153 -9.997 9.758 1.00 0.57 H new ATOM 0 HB VAL A1123 2.994 -9.498 8.328 1.00 0.80 H new ATOM 0 HG11 VAL A1123 1.716 -8.133 6.625 1.00 1.78 H new ATOM 0 HG12 VAL A1123 0.689 -9.352 7.416 1.00 1.78 H new ATOM 0 HG13 VAL A1123 0.584 -7.645 7.909 1.00 1.78 H new ATOM 0 HG21 VAL A1123 3.606 -7.166 7.724 1.00 2.23 H new ATOM 0 HG22 VAL A1123 2.595 -6.575 9.064 1.00 2.23 H new ATOM 0 HG23 VAL A1123 4.029 -7.573 9.403 1.00 2.23 H new ATOM 1162 N THR A1124 3.323 -10.690 10.915 1.00 0.65 N ATOM 1163 CA THR A1124 4.461 -11.154 11.726 1.00 0.74 C ATOM 1164 C THR A1124 5.357 -12.113 10.952 1.00 0.85 C ATOM 1165 O THR A1124 4.898 -12.807 10.046 1.00 0.90 O ATOM 1166 CB THR A1124 4.038 -11.913 13.012 1.00 0.81 C ATOM 1167 OG1 THR A1124 5.047 -11.767 13.992 1.00 1.05 O ATOM 1168 CG2 THR A1124 3.840 -13.436 12.895 1.00 0.89 C ATOM 0 H THR A1124 2.978 -11.396 10.265 1.00 0.65 H new ATOM 0 HA THR A1124 4.984 -10.235 11.989 1.00 0.74 H new ATOM 0 HB THR A1124 3.073 -11.467 13.250 1.00 0.81 H new ATOM 0 HG1 THR A1124 4.783 -12.243 14.807 1.00 1.05 H new ATOM 0 HG21 THR A1124 3.546 -13.840 13.864 1.00 0.89 H new ATOM 0 HG22 THR A1124 3.061 -13.646 12.163 1.00 0.89 H new ATOM 0 HG23 THR A1124 4.773 -13.901 12.576 1.00 0.89 H new ATOM 1176 N ASN A1125 6.595 -12.195 11.431 1.00 1.06 N ATOM 1177 CA ASN A1125 7.578 -13.263 11.259 1.00 1.28 C ATOM 1178 C ASN A1125 8.707 -13.043 12.292 1.00 1.61 C ATOM 1179 O ASN A1125 9.147 -14.013 12.909 1.00 2.57 O ATOM 1180 CB ASN A1125 8.050 -13.507 9.815 1.00 1.46 C ATOM 1181 CG ASN A1125 9.001 -14.671 9.788 1.00 1.81 C ATOM 1182 OD1 ASN A1125 10.187 -14.575 10.091 1.00 2.55 O ATOM 1183 ND2 ASN A1125 8.481 -15.830 9.520 1.00 1.50 N ATOM 0 H ASN A1125 6.973 -11.442 12.006 1.00 1.06 H new ATOM 0 HA ASN A1125 7.091 -14.217 11.463 1.00 1.28 H new ATOM 0 HB2 ASN A1125 7.194 -13.708 9.171 1.00 1.46 H new ATOM 0 HB3 ASN A1125 8.540 -12.615 9.426 1.00 1.46 H new ATOM 0 HD21 ASN A1125 9.059 -16.670 9.560 1.00 1.50 H new ATOM 0 HD22 ASN A1125 7.495 -15.901 9.269 1.00 1.50 H new ATOM 1951 N GLN A1177 4.669 -7.485 15.984 1.00 1.21 N ATOM 1952 CA GLN A1177 3.687 -7.341 14.894 1.00 0.99 C ATOM 1953 C GLN A1177 3.423 -5.926 14.344 1.00 0.95 C ATOM 1954 O GLN A1177 2.874 -5.048 15.022 1.00 1.55 O ATOM 1955 CB GLN A1177 2.362 -7.976 15.330 1.00 1.07 C ATOM 1956 CG GLN A1177 2.434 -9.496 15.214 1.00 1.06 C ATOM 1957 CD GLN A1177 1.106 -10.066 14.829 1.00 1.18 C ATOM 1958 OE1 GLN A1177 0.861 -10.094 13.555 1.00 2.13 O flip ATOM 1959 NE2 GLN A1177 0.290 -10.479 15.636 1.00 1.16 N flip ATOM 0 HA GLN A1177 4.153 -7.854 14.053 1.00 0.99 H new ATOM 0 HB2 GLN A1177 2.138 -7.694 16.359 1.00 1.07 H new ATOM 0 HB3 GLN A1177 1.549 -7.596 14.711 1.00 1.07 H new ATOM 0 HG2 GLN A1177 3.182 -9.773 14.471 1.00 1.06 H new ATOM 0 HG3 GLN A1177 2.755 -9.922 16.164 1.00 1.06 H new ATOM 0 HE21 GLN A1177 0.499 -10.449 16.634 1.00 1.16 H new ATOM 0 HE22 GLN A1177 -0.602 -10.854 15.313 1.00 1.16 H new ATOM 1968 N TYR A1178 3.718 -5.764 13.055 1.00 0.71 N ATOM 1969 CA TYR A1178 3.490 -4.547 12.276 1.00 0.67 C ATOM 1970 C TYR A1178 2.001 -4.403 11.903 1.00 0.59 C ATOM 1971 O TYR A1178 1.447 -5.300 11.266 1.00 0.63 O ATOM 1972 CB TYR A1178 4.361 -4.634 11.004 1.00 0.65 C ATOM 1973 CG TYR A1178 5.747 -4.015 11.068 1.00 0.85 C ATOM 1974 CD1 TYR A1178 5.894 -2.638 11.335 1.00 1.79 C ATOM 1975 CD2 TYR A1178 6.880 -4.790 10.745 1.00 2.40 C ATOM 1976 CE1 TYR A1178 7.166 -2.035 11.274 1.00 1.90 C ATOM 1977 CE2 TYR A1178 8.153 -4.190 10.683 1.00 2.65 C ATOM 1978 CZ TYR A1178 8.298 -2.810 10.941 1.00 1.55 C ATOM 1979 OH TYR A1178 9.522 -2.226 10.844 1.00 1.95 O ATOM 0 H TYR A1178 4.141 -6.509 12.501 1.00 0.71 H new ATOM 0 HA TYR A1178 3.761 -3.670 12.864 1.00 0.67 H new ATOM 0 HB2 TYR A1178 4.473 -5.686 10.742 1.00 0.65 H new ATOM 0 HB3 TYR A1178 3.816 -4.159 10.188 1.00 0.65 H new ATOM 0 HD1 TYR A1178 5.028 -2.043 11.587 1.00 1.79 H new ATOM 0 HD2 TYR A1178 6.772 -5.846 10.545 1.00 2.40 H new ATOM 0 HE1 TYR A1178 7.275 -0.981 11.482 1.00 1.90 H new ATOM 0 HE2 TYR A1178 9.019 -4.787 10.438 1.00 2.65 H new ATOM 0 HH TYR A1178 10.190 -2.903 10.608 1.00 1.95 H new ATOM 1989 N LYS A1179 1.361 -3.274 12.250 1.00 0.54 N ATOM 1990 CA LYS A1179 0.007 -2.900 11.785 1.00 0.50 C ATOM 1991 C LYS A1179 0.082 -2.118 10.470 1.00 0.46 C ATOM 1992 O LYS A1179 0.698 -1.054 10.436 1.00 0.53 O ATOM 1993 CB LYS A1179 -0.732 -2.102 12.881 1.00 0.54 C ATOM 1994 CG LYS A1179 -2.185 -1.787 12.470 1.00 0.58 C ATOM 1995 CD LYS A1179 -3.030 -1.082 13.542 1.00 0.78 C ATOM 1996 CE LYS A1179 -2.529 0.336 13.835 1.00 1.64 C ATOM 1997 NZ LYS A1179 -3.604 1.194 14.377 1.00 1.27 N ATOM 0 H LYS A1179 1.774 -2.580 12.873 1.00 0.54 H new ATOM 0 HA LYS A1179 -0.563 -3.809 11.591 1.00 0.50 H new ATOM 0 HB2 LYS A1179 -0.731 -2.672 13.810 1.00 0.54 H new ATOM 0 HB3 LYS A1179 -0.199 -1.172 13.077 1.00 0.54 H new ATOM 0 HG2 LYS A1179 -2.166 -1.163 11.577 1.00 0.58 H new ATOM 0 HG3 LYS A1179 -2.679 -2.720 12.196 1.00 0.58 H new ATOM 0 HD2 LYS A1179 -4.068 -1.038 13.213 1.00 0.78 H new ATOM 0 HD3 LYS A1179 -3.012 -1.669 14.460 1.00 0.78 H new ATOM 0 HE2 LYS A1179 -1.705 0.291 14.547 1.00 1.64 H new ATOM 0 HE3 LYS A1179 -2.136 0.779 12.920 1.00 1.64 H new ATOM 0 HZ1 LYS A1179 -3.201 1.865 15.062 1.00 1.27 H new ATOM 0 HZ2 LYS A1179 -4.053 1.720 13.600 1.00 1.27 H new ATOM 0 HZ3 LYS A1179 -4.316 0.601 14.850 1.00 1.27 H new ATOM 2011 N VAL A1180 -0.582 -2.597 9.417 1.00 0.40 N ATOM 2012 CA VAL A1180 -0.569 -1.980 8.075 1.00 0.37 C ATOM 2013 C VAL A1180 -1.972 -1.906 7.455 1.00 0.36 C ATOM 2014 O VAL A1180 -2.774 -2.828 7.606 1.00 0.42 O ATOM 2015 CB VAL A1180 0.448 -2.667 7.129 1.00 0.44 C ATOM 2016 CG1 VAL A1180 1.839 -2.826 7.765 1.00 0.52 C ATOM 2017 CG2 VAL A1180 0.021 -4.059 6.657 1.00 0.48 C ATOM 0 H VAL A1180 -1.156 -3.439 9.466 1.00 0.40 H new ATOM 0 HA VAL A1180 -0.232 -0.952 8.209 1.00 0.37 H new ATOM 0 HB VAL A1180 0.485 -1.989 6.277 1.00 0.44 H new ATOM 0 HG11 VAL A1180 2.509 -3.313 7.057 1.00 0.52 H new ATOM 0 HG12 VAL A1180 2.235 -1.844 8.023 1.00 0.52 H new ATOM 0 HG13 VAL A1180 1.760 -3.434 8.666 1.00 0.52 H new ATOM 0 HG21 VAL A1180 0.786 -4.471 5.999 1.00 0.48 H new ATOM 0 HG22 VAL A1180 -0.106 -4.713 7.520 1.00 0.48 H new ATOM 0 HG23 VAL A1180 -0.922 -3.986 6.115 1.00 0.48 H new ATOM 2027 N LEU A1181 -2.268 -0.811 6.747 1.00 0.35 N ATOM 2028 CA LEU A1181 -3.496 -0.637 5.965 1.00 0.35 C ATOM 2029 C LEU A1181 -3.247 0.092 4.635 1.00 0.37 C ATOM 2030 O LEU A1181 -2.407 0.986 4.545 1.00 0.48 O ATOM 2031 CB LEU A1181 -4.623 0.014 6.799 1.00 0.39 C ATOM 2032 CG LEU A1181 -4.452 1.496 7.184 1.00 0.46 C ATOM 2033 CD1 LEU A1181 -5.804 2.154 7.440 1.00 0.61 C ATOM 2034 CD2 LEU A1181 -3.663 1.689 8.477 1.00 0.39 C ATOM 0 H LEU A1181 -1.647 -0.003 6.701 1.00 0.35 H new ATOM 0 HA LEU A1181 -3.844 -1.635 5.698 1.00 0.35 H new ATOM 0 HB2 LEU A1181 -5.555 -0.084 6.242 1.00 0.39 H new ATOM 0 HB3 LEU A1181 -4.739 -0.562 7.717 1.00 0.39 H new ATOM 0 HG LEU A1181 -3.923 1.941 6.342 1.00 0.46 H new ATOM 0 HD11 LEU A1181 -5.655 3.199 7.710 1.00 0.61 H new ATOM 0 HD12 LEU A1181 -6.414 2.096 6.538 1.00 0.61 H new ATOM 0 HD13 LEU A1181 -6.311 1.638 8.255 1.00 0.61 H new ATOM 0 HD21 LEU A1181 -3.576 2.753 8.695 1.00 0.39 H new ATOM 0 HD22 LEU A1181 -4.181 1.192 9.297 1.00 0.39 H new ATOM 0 HD23 LEU A1181 -2.668 1.260 8.363 1.00 0.39 H new ATOM 2046 N ILE A1182 -3.987 -0.273 3.590 1.00 0.34 N ATOM 2047 CA ILE A1182 -3.812 0.231 2.218 1.00 0.33 C ATOM 2048 C ILE A1182 -5.175 0.362 1.536 1.00 0.37 C ATOM 2049 O ILE A1182 -6.067 -0.462 1.757 1.00 0.40 O ATOM 2050 CB ILE A1182 -2.822 -0.670 1.422 1.00 0.34 C ATOM 2051 CG1 ILE A1182 -2.634 -0.226 -0.057 1.00 0.38 C ATOM 2052 CG2 ILE A1182 -3.179 -2.167 1.533 1.00 0.39 C ATOM 2053 CD1 ILE A1182 -1.362 -0.790 -0.707 1.00 0.52 C ATOM 0 H ILE A1182 -4.749 -0.947 3.671 1.00 0.34 H new ATOM 0 HA ILE A1182 -3.367 1.225 2.248 1.00 0.33 H new ATOM 0 HB ILE A1182 -1.852 -0.532 1.900 1.00 0.34 H new ATOM 0 HG12 ILE A1182 -3.501 -0.544 -0.637 1.00 0.38 H new ATOM 0 HG13 ILE A1182 -2.603 0.863 -0.100 1.00 0.38 H new ATOM 0 HG21 ILE A1182 -2.461 -2.756 0.962 1.00 0.39 H new ATOM 0 HG22 ILE A1182 -3.148 -2.472 2.579 1.00 0.39 H new ATOM 0 HG23 ILE A1182 -4.181 -2.333 1.137 1.00 0.39 H new ATOM 0 HD11 ILE A1182 -1.294 -0.440 -1.737 1.00 0.52 H new ATOM 0 HD12 ILE A1182 -0.488 -0.451 -0.151 1.00 0.52 H new ATOM 0 HD13 ILE A1182 -1.400 -1.879 -0.695 1.00 0.52 H new ATOM 2065 N GLY A1183 -5.322 1.369 0.671 1.00 0.45 N ATOM 2066 CA GLY A1183 -6.467 1.509 -0.232 1.00 0.69 C ATOM 2067 C GLY A1183 -7.227 2.830 -0.132 1.00 0.76 C ATOM 2068 O GLY A1183 -7.138 3.558 0.858 1.00 1.66 O ATOM 0 H GLY A1183 -4.639 2.121 0.577 1.00 0.45 H new ATOM 0 HA2 GLY A1183 -6.116 1.389 -1.257 1.00 0.69 H new ATOM 0 HA3 GLY A1183 -7.163 0.694 -0.036 1.00 0.69 H new ATOM 2072 N ASN A1184 -8.005 3.102 -1.183 1.00 0.93 N ATOM 2073 CA ASN A1184 -8.907 4.251 -1.315 1.00 1.06 C ATOM 2074 C ASN A1184 -8.225 5.609 -0.997 1.00 1.16 C ATOM 2075 O ASN A1184 -7.020 5.790 -1.186 1.00 2.16 O ATOM 2076 CB ASN A1184 -10.139 3.930 -0.436 1.00 1.50 C ATOM 2077 CG ASN A1184 -11.419 4.609 -0.874 1.00 1.54 C ATOM 2078 OD1 ASN A1184 -11.718 5.704 -0.423 1.00 2.39 O ATOM 2079 ND2 ASN A1184 -12.175 4.014 -1.765 1.00 1.49 N ATOM 0 H ASN A1184 -8.025 2.498 -2.005 1.00 0.93 H new ATOM 0 HA ASN A1184 -9.217 4.390 -2.351 1.00 1.06 H new ATOM 0 HB2 ASN A1184 -10.297 2.852 -0.435 1.00 1.50 H new ATOM 0 HB3 ASN A1184 -9.922 4.221 0.592 1.00 1.50 H new ATOM 0 HD21 ASN A1184 -13.029 4.466 -2.093 1.00 1.49 H new ATOM 0 HD22 ASN A1184 -11.909 3.100 -2.130 1.00 1.49 H new ATOM 2086 N ARG A1185 -9.036 6.563 -0.526 1.00 1.01 N ATOM 2087 CA ARG A1185 -8.663 7.849 0.070 1.00 1.04 C ATOM 2088 C ARG A1185 -9.372 8.091 1.407 1.00 0.98 C ATOM 2089 O ARG A1185 -8.774 8.696 2.294 1.00 0.97 O ATOM 2090 CB ARG A1185 -8.904 8.985 -0.940 1.00 1.24 C ATOM 2091 CG ARG A1185 -10.354 9.104 -1.462 1.00 2.74 C ATOM 2092 CD ARG A1185 -10.461 9.273 -2.988 1.00 3.25 C ATOM 2093 NE ARG A1185 -10.049 8.052 -3.712 1.00 4.03 N ATOM 2094 CZ ARG A1185 -8.877 7.781 -4.258 1.00 4.68 C ATOM 2095 NH1 ARG A1185 -7.879 8.618 -4.330 1.00 4.77 N ATOM 2096 NH2 ARG A1185 -8.672 6.592 -4.734 1.00 6.18 N ATOM 0 H ARG A1185 -10.049 6.446 -0.554 1.00 1.01 H new ATOM 0 HA ARG A1185 -7.598 7.826 0.302 1.00 1.04 H new ATOM 0 HB2 ARG A1185 -8.624 9.930 -0.474 1.00 1.24 H new ATOM 0 HB3 ARG A1185 -8.239 8.840 -1.791 1.00 1.24 H new ATOM 0 HG2 ARG A1185 -10.909 8.214 -1.166 1.00 2.74 H new ATOM 0 HG3 ARG A1185 -10.834 9.955 -0.979 1.00 2.74 H new ATOM 0 HD2 ARG A1185 -11.488 9.522 -3.254 1.00 3.25 H new ATOM 0 HD3 ARG A1185 -9.838 10.109 -3.304 1.00 3.25 H new ATOM 0 HE ARG A1185 -10.760 7.326 -3.801 1.00 4.03 H new ATOM 0 HH11 ARG A1185 -7.974 9.559 -3.948 1.00 4.77 H new ATOM 0 HH12 ARG A1185 -7.004 8.332 -4.769 1.00 4.77 H new ATOM 0 HH21 ARG A1185 -9.408 5.888 -4.682 1.00 6.18 H new ATOM 0 HH22 ARG A1185 -7.774 6.361 -5.160 1.00 6.18 H new ATOM 2110 N GLU A1186 -10.588 7.569 1.623 1.00 1.11 N ATOM 2111 CA GLU A1186 -11.338 7.826 2.863 1.00 1.19 C ATOM 2112 C GLU A1186 -10.666 7.215 4.103 1.00 0.92 C ATOM 2113 O GLU A1186 -10.622 7.859 5.146 1.00 0.87 O ATOM 2114 CB GLU A1186 -12.790 7.325 2.739 1.00 1.68 C ATOM 2115 CG GLU A1186 -13.673 7.954 3.833 1.00 2.27 C ATOM 2116 CD GLU A1186 -15.039 7.278 3.968 1.00 3.06 C ATOM 2117 OE1 GLU A1186 -15.866 7.364 3.024 1.00 3.19 O ATOM 2118 OE2 GLU A1186 -15.305 6.714 5.056 1.00 4.19 O ATOM 0 H GLU A1186 -11.073 6.967 0.957 1.00 1.11 H new ATOM 0 HA GLU A1186 -11.343 8.907 3.003 1.00 1.19 H new ATOM 0 HB2 GLU A1186 -13.185 7.577 1.755 1.00 1.68 H new ATOM 0 HB3 GLU A1186 -12.815 6.239 2.824 1.00 1.68 H new ATOM 0 HG2 GLU A1186 -13.151 7.898 4.788 1.00 2.27 H new ATOM 0 HG3 GLU A1186 -13.818 9.011 3.610 1.00 2.27 H new ATOM 2125 N TRP A1187 -10.068 6.020 4.018 1.00 0.97 N ATOM 2126 CA TRP A1187 -9.409 5.408 5.187 1.00 1.04 C ATOM 2127 C TRP A1187 -8.155 6.186 5.641 1.00 0.83 C ATOM 2128 O TRP A1187 -7.761 6.131 6.805 1.00 1.00 O ATOM 2129 CB TRP A1187 -9.120 3.920 4.933 1.00 1.52 C ATOM 2130 CG TRP A1187 -9.200 3.009 6.130 1.00 1.69 C ATOM 2131 CD1 TRP A1187 -9.117 3.367 7.434 1.00 2.96 C ATOM 2132 CD2 TRP A1187 -9.409 1.560 6.144 1.00 1.15 C ATOM 2133 NE1 TRP A1187 -9.277 2.263 8.243 1.00 2.99 N ATOM 2134 CE2 TRP A1187 -9.439 1.118 7.501 1.00 1.72 C ATOM 2135 CE3 TRP A1187 -9.588 0.572 5.148 1.00 1.80 C ATOM 2136 CZ2 TRP A1187 -9.632 -0.223 7.857 1.00 1.46 C ATOM 2137 CZ3 TRP A1187 -9.782 -0.779 5.494 1.00 2.29 C ATOM 2138 CH2 TRP A1187 -9.792 -1.177 6.842 1.00 1.56 C ATOM 0 H TRP A1187 -10.025 5.461 3.166 1.00 0.97 H new ATOM 0 HA TRP A1187 -10.106 5.470 6.023 1.00 1.04 H new ATOM 0 HB2 TRP A1187 -9.822 3.559 4.181 1.00 1.52 H new ATOM 0 HB3 TRP A1187 -8.122 3.834 4.504 1.00 1.52 H new ATOM 0 HD1 TRP A1187 -8.949 4.373 7.789 1.00 2.96 H new ATOM 0 HE1 TRP A1187 -9.275 2.292 9.263 1.00 2.99 H new ATOM 0 HE3 TRP A1187 -9.576 0.858 4.107 1.00 1.80 H new ATOM 0 HZ2 TRP A1187 -9.657 -0.517 8.896 1.00 1.46 H new ATOM 0 HZ3 TRP A1187 -9.924 -1.516 4.717 1.00 2.29 H new ATOM 0 HH2 TRP A1187 -9.923 -2.218 7.096 1.00 1.56 H new ATOM 2149 N MET A1188 -7.590 7.008 4.754 1.00 0.79 N ATOM 2150 CA MET A1188 -6.494 7.926 5.082 1.00 1.07 C ATOM 2151 C MET A1188 -6.978 9.078 5.988 1.00 1.09 C ATOM 2152 O MET A1188 -6.238 9.568 6.840 1.00 1.42 O ATOM 2153 CB MET A1188 -5.856 8.390 3.761 1.00 1.35 C ATOM 2154 CG MET A1188 -4.334 8.524 3.832 1.00 2.26 C ATOM 2155 SD MET A1188 -3.321 7.063 4.256 1.00 2.52 S ATOM 2156 CE MET A1188 -4.308 5.584 3.876 1.00 1.25 C ATOM 0 H MET A1188 -7.882 7.056 3.778 1.00 0.79 H new ATOM 0 HA MET A1188 -5.726 7.424 5.671 1.00 1.07 H new ATOM 0 HB2 MET A1188 -6.114 7.682 2.974 1.00 1.35 H new ATOM 0 HB3 MET A1188 -6.285 9.351 3.478 1.00 1.35 H new ATOM 0 HG2 MET A1188 -3.993 8.888 2.863 1.00 2.26 H new ATOM 0 HG3 MET A1188 -4.108 9.301 4.562 1.00 2.26 H new ATOM 0 HE1 MET A1188 -3.652 4.716 3.808 1.00 1.25 H new ATOM 0 HE2 MET A1188 -5.041 5.423 4.666 1.00 1.25 H new ATOM 0 HE3 MET A1188 -4.824 5.725 2.926 1.00 1.25 H new ATOM 2166 N ILE A1189 -8.251 9.467 5.850 1.00 0.98 N ATOM 2167 CA ILE A1189 -9.009 10.335 6.765 1.00 1.20 C ATOM 2168 C ILE A1189 -9.315 9.532 8.042 1.00 1.03 C ATOM 2169 O ILE A1189 -8.822 9.862 9.123 1.00 1.11 O ATOM 2170 CB ILE A1189 -10.271 10.953 6.107 1.00 1.46 C ATOM 2171 CG1 ILE A1189 -9.952 11.644 4.759 1.00 1.70 C ATOM 2172 CG2 ILE A1189 -10.918 11.957 7.080 1.00 1.75 C ATOM 2173 CD1 ILE A1189 -11.201 11.982 3.935 1.00 2.06 C ATOM 0 H ILE A1189 -8.813 9.169 5.053 1.00 0.98 H new ATOM 0 HA ILE A1189 -8.404 11.203 7.028 1.00 1.20 H new ATOM 0 HB ILE A1189 -10.966 10.141 5.893 1.00 1.46 H new ATOM 0 HG12 ILE A1189 -9.395 12.561 4.952 1.00 1.70 H new ATOM 0 HG13 ILE A1189 -9.303 10.995 4.171 1.00 1.70 H new ATOM 0 HG21 ILE A1189 -11.805 12.391 6.618 1.00 1.75 H new ATOM 0 HG22 ILE A1189 -11.202 11.443 7.998 1.00 1.75 H new ATOM 0 HG23 ILE A1189 -10.206 12.748 7.313 1.00 1.75 H new ATOM 0 HD11 ILE A1189 -10.903 12.464 3.004 1.00 2.06 H new ATOM 0 HD12 ILE A1189 -11.748 11.066 3.711 1.00 2.06 H new ATOM 0 HD13 ILE A1189 -11.841 12.657 4.504 1.00 2.06 H new ATOM 2185 N ARG A1190 -10.166 8.499 7.902 1.00 0.89 N ATOM 2186 CA ARG A1190 -10.745 7.613 8.937 1.00 0.96 C ATOM 2187 C ARG A1190 -9.742 7.023 9.955 1.00 0.77 C ATOM 2188 O ARG A1190 -10.166 6.637 11.042 1.00 0.86 O ATOM 2189 CB ARG A1190 -11.513 6.480 8.211 1.00 1.10 C ATOM 2190 CG ARG A1190 -12.732 5.938 8.968 1.00 2.04 C ATOM 2191 CD ARG A1190 -13.253 4.623 8.361 1.00 2.49 C ATOM 2192 NE ARG A1190 -13.946 4.757 7.058 1.00 3.30 N ATOM 2193 CZ ARG A1190 -14.434 3.753 6.340 1.00 4.56 C ATOM 2194 NH1 ARG A1190 -14.214 2.502 6.623 1.00 5.37 N ATOM 2195 NH2 ARG A1190 -15.161 3.996 5.295 1.00 5.56 N ATOM 0 H ARG A1190 -10.499 8.236 6.975 1.00 0.89 H new ATOM 0 HA ARG A1190 -11.400 8.232 9.550 1.00 0.96 H new ATOM 0 HB2 ARG A1190 -11.841 6.848 7.239 1.00 1.10 H new ATOM 0 HB3 ARG A1190 -10.824 5.656 8.024 1.00 1.10 H new ATOM 0 HG2 ARG A1190 -12.466 5.774 10.012 1.00 2.04 H new ATOM 0 HG3 ARG A1190 -13.527 6.683 8.954 1.00 2.04 H new ATOM 0 HD2 ARG A1190 -12.412 3.941 8.238 1.00 2.49 H new ATOM 0 HD3 ARG A1190 -13.938 4.160 9.072 1.00 2.49 H new ATOM 0 HE ARG A1190 -14.057 5.699 6.682 1.00 3.30 H new ATOM 0 HH11 ARG A1190 -13.642 2.255 7.431 1.00 5.37 H new ATOM 0 HH12 ARG A1190 -14.614 1.769 6.037 1.00 5.37 H new ATOM 0 HH21 ARG A1190 -15.358 4.959 5.024 1.00 5.56 H new ATOM 0 HH22 ARG A1190 -15.536 3.224 4.744 1.00 5.56 H new ATOM 2209 N ASN A1191 -8.439 6.950 9.647 1.00 0.63 N ATOM 2210 CA ASN A1191 -7.382 6.512 10.581 1.00 0.61 C ATOM 2211 C ASN A1191 -6.689 7.663 11.360 1.00 0.66 C ATOM 2212 O ASN A1191 -5.629 7.459 11.959 1.00 0.72 O ATOM 2213 CB ASN A1191 -6.372 5.593 9.858 1.00 0.56 C ATOM 2214 CG ASN A1191 -5.806 4.542 10.795 1.00 0.70 C ATOM 2215 OD1 ASN A1191 -6.370 3.478 10.997 1.00 0.93 O ATOM 2216 ND2 ASN A1191 -4.724 4.837 11.463 1.00 0.79 N ATOM 0 H ASN A1191 -8.080 7.198 8.725 1.00 0.63 H new ATOM 0 HA ASN A1191 -7.882 5.936 11.360 1.00 0.61 H new ATOM 0 HB2 ASN A1191 -6.861 5.105 9.015 1.00 0.56 H new ATOM 0 HB3 ASN A1191 -5.559 6.194 9.450 1.00 0.56 H new ATOM 0 HD21 ASN A1191 -4.354 4.180 12.150 1.00 0.79 H new ATOM 0 HD22 ASN A1191 -4.249 5.724 11.298 1.00 0.79 H new ATOM 2223 N GLY A1192 -7.238 8.881 11.347 1.00 0.68 N ATOM 2224 CA GLY A1192 -6.708 10.011 12.122 1.00 0.74 C ATOM 2225 C GLY A1192 -5.345 10.535 11.646 1.00 0.69 C ATOM 2226 O GLY A1192 -4.512 10.898 12.474 1.00 0.71 O ATOM 0 H GLY A1192 -8.065 9.114 10.798 1.00 0.68 H new ATOM 0 HA2 GLY A1192 -7.429 10.828 12.086 1.00 0.74 H new ATOM 0 HA3 GLY A1192 -6.621 9.709 13.166 1.00 0.74 H new ATOM 2230 N LEU A1193 -5.090 10.540 10.331 1.00 0.73 N ATOM 2231 CA LEU A1193 -3.828 11.002 9.725 1.00 0.72 C ATOM 2232 C LEU A1193 -3.964 12.436 9.153 1.00 0.77 C ATOM 2233 O LEU A1193 -5.079 12.969 9.056 1.00 0.90 O ATOM 2234 CB LEU A1193 -3.363 10.008 8.634 1.00 0.68 C ATOM 2235 CG LEU A1193 -3.564 8.507 8.931 1.00 0.66 C ATOM 2236 CD1 LEU A1193 -3.136 7.655 7.745 1.00 0.64 C ATOM 2237 CD2 LEU A1193 -2.760 7.983 10.116 1.00 0.65 C ATOM 0 H LEU A1193 -5.768 10.216 9.641 1.00 0.73 H new ATOM 0 HA LEU A1193 -3.069 11.038 10.507 1.00 0.72 H new ATOM 0 HB2 LEU A1193 -3.891 10.245 7.710 1.00 0.68 H new ATOM 0 HB3 LEU A1193 -2.303 10.179 8.448 1.00 0.68 H new ATOM 0 HG LEU A1193 -4.629 8.429 9.152 1.00 0.66 H new ATOM 0 HD11 LEU A1193 -3.288 6.602 7.980 1.00 0.64 H new ATOM 0 HD12 LEU A1193 -3.732 7.921 6.872 1.00 0.64 H new ATOM 0 HD13 LEU A1193 -2.082 7.831 7.532 1.00 0.64 H new ATOM 0 HD21 LEU A1193 -2.962 6.921 10.252 1.00 0.65 H new ATOM 0 HD22 LEU A1193 -1.696 8.128 9.927 1.00 0.65 H new ATOM 0 HD23 LEU A1193 -3.046 8.525 11.018 1.00 0.65 H new ATOM 2249 N VAL A1194 -2.856 13.044 8.719 1.00 0.78 N ATOM 2250 CA VAL A1194 -2.784 14.332 7.990 1.00 0.85 C ATOM 2251 C VAL A1194 -2.101 14.145 6.628 1.00 0.75 C ATOM 2252 O VAL A1194 -1.213 13.300 6.498 1.00 0.64 O ATOM 2253 CB VAL A1194 -2.071 15.397 8.859 1.00 1.09 C ATOM 2254 CG1 VAL A1194 -1.543 16.622 8.098 1.00 1.06 C ATOM 2255 CG2 VAL A1194 -3.033 15.926 9.928 1.00 1.68 C ATOM 0 H VAL A1194 -1.933 12.637 8.870 1.00 0.78 H new ATOM 0 HA VAL A1194 -3.795 14.690 7.794 1.00 0.85 H new ATOM 0 HB VAL A1194 -1.211 14.871 9.274 1.00 1.09 H new ATOM 0 HG11 VAL A1194 -1.062 17.305 8.798 1.00 1.06 H new ATOM 0 HG12 VAL A1194 -0.819 16.301 7.349 1.00 1.06 H new ATOM 0 HG13 VAL A1194 -2.373 17.130 7.607 1.00 1.06 H new ATOM 0 HG21 VAL A1194 -2.525 16.675 10.536 1.00 1.68 H new ATOM 0 HG22 VAL A1194 -3.900 16.377 9.446 1.00 1.68 H new ATOM 0 HG23 VAL A1194 -3.359 15.103 10.564 1.00 1.68 H new ATOM 2265 N ILE A1195 -2.496 14.933 5.617 1.00 1.05 N ATOM 2266 CA ILE A1195 -1.927 14.891 4.256 1.00 1.11 C ATOM 2267 C ILE A1195 -1.357 16.241 3.778 1.00 1.26 C ATOM 2268 O ILE A1195 -1.752 17.311 4.252 1.00 1.52 O ATOM 2269 CB ILE A1195 -2.935 14.250 3.275 1.00 1.25 C ATOM 2270 CG1 ILE A1195 -2.218 13.795 1.989 1.00 1.30 C ATOM 2271 CG2 ILE A1195 -4.102 15.188 2.933 1.00 1.60 C ATOM 2272 CD1 ILE A1195 -2.979 12.715 1.210 1.00 1.41 C ATOM 0 H ILE A1195 -3.233 15.631 5.721 1.00 1.05 H new ATOM 0 HA ILE A1195 -1.048 14.247 4.286 1.00 1.11 H new ATOM 0 HB ILE A1195 -3.360 13.381 3.778 1.00 1.25 H new ATOM 0 HG12 ILE A1195 -2.067 14.659 1.342 1.00 1.30 H new ATOM 0 HG13 ILE A1195 -1.230 13.415 2.249 1.00 1.30 H new ATOM 0 HG21 ILE A1195 -4.780 14.688 2.241 1.00 1.60 H new ATOM 0 HG22 ILE A1195 -4.640 15.447 3.845 1.00 1.60 H new ATOM 0 HG23 ILE A1195 -3.715 16.096 2.470 1.00 1.60 H new ATOM 0 HD11 ILE A1195 -2.415 12.444 0.318 1.00 1.41 H new ATOM 0 HD12 ILE A1195 -3.107 11.834 1.839 1.00 1.41 H new ATOM 0 HD13 ILE A1195 -3.957 13.098 0.918 1.00 1.41 H new ATOM 2284 N ASN A1196 -0.408 16.174 2.840 1.00 1.18 N ATOM 2285 CA ASN A1196 0.436 17.273 2.358 1.00 1.43 C ATOM 2286 C ASN A1196 0.238 17.593 0.853 1.00 1.56 C ATOM 2287 O ASN A1196 -0.335 16.802 0.103 1.00 1.33 O ATOM 2288 CB ASN A1196 1.890 16.889 2.692 1.00 1.47 C ATOM 2289 CG ASN A1196 2.228 17.083 4.154 1.00 1.95 C ATOM 2290 OD1 ASN A1196 2.605 18.172 4.566 1.00 2.95 O ATOM 2291 ND2 ASN A1196 2.130 16.068 4.979 1.00 1.94 N ATOM 0 H ASN A1196 -0.195 15.296 2.367 1.00 1.18 H new ATOM 0 HA ASN A1196 0.154 18.201 2.856 1.00 1.43 H new ATOM 0 HB2 ASN A1196 2.057 15.847 2.421 1.00 1.47 H new ATOM 0 HB3 ASN A1196 2.568 17.489 2.085 1.00 1.47 H new ATOM 0 HD21 ASN A1196 2.368 16.186 5.964 1.00 1.94 H new ATOM 0 HD22 ASN A1196 1.816 15.160 4.636 1.00 1.94 H new ATOM 2298 N ASN A1197 0.725 18.759 0.408 1.00 1.95 N ATOM 2299 CA ASN A1197 0.441 19.324 -0.922 1.00 2.08 C ATOM 2300 C ASN A1197 1.026 18.525 -2.107 1.00 1.85 C ATOM 2301 O ASN A1197 0.311 18.264 -3.071 1.00 1.68 O ATOM 2302 CB ASN A1197 0.951 20.780 -0.947 1.00 2.61 C ATOM 2303 CG ASN A1197 0.565 21.558 -2.191 1.00 3.75 C ATOM 2304 OD1 ASN A1197 -0.392 21.277 -2.898 1.00 4.26 O ATOM 2305 ND2 ASN A1197 1.275 22.620 -2.466 1.00 4.54 N ATOM 0 H ASN A1197 1.339 19.348 0.971 1.00 1.95 H new ATOM 0 HA ASN A1197 -0.638 19.273 -1.065 1.00 2.08 H new ATOM 0 HB2 ASN A1197 0.565 21.303 -0.072 1.00 2.61 H new ATOM 0 HB3 ASN A1197 2.038 20.773 -0.860 1.00 2.61 H new ATOM 0 HD21 ASN A1197 1.029 23.206 -3.264 1.00 4.54 H new ATOM 0 HD22 ASN A1197 2.075 22.863 -1.883 1.00 4.54 H new ATOM 2312 N ASP A1198 2.304 18.120 -2.056 1.00 1.90 N ATOM 2313 CA ASP A1198 2.967 17.437 -3.181 1.00 1.79 C ATOM 2314 C ASP A1198 2.269 16.108 -3.519 1.00 1.35 C ATOM 2315 O ASP A1198 2.023 15.812 -4.694 1.00 1.18 O ATOM 2316 CB ASP A1198 4.444 17.148 -2.865 1.00 2.10 C ATOM 2317 CG ASP A1198 5.377 18.351 -2.955 1.00 2.59 C ATOM 2318 OD1 ASP A1198 5.551 19.087 -1.951 1.00 2.95 O ATOM 2319 OD2 ASP A1198 6.035 18.498 -4.011 1.00 3.64 O ATOM 0 H ASP A1198 2.904 18.254 -1.242 1.00 1.90 H new ATOM 0 HA ASP A1198 2.902 18.109 -4.037 1.00 1.79 H new ATOM 0 HB2 ASP A1198 4.509 16.733 -1.859 1.00 2.10 H new ATOM 0 HB3 ASP A1198 4.802 16.380 -3.550 1.00 2.10 H new ATOM 2324 N VAL A1199 1.926 15.334 -2.483 1.00 1.23 N ATOM 2325 CA VAL A1199 1.199 14.066 -2.607 1.00 0.92 C ATOM 2326 C VAL A1199 -0.271 14.264 -2.980 1.00 0.80 C ATOM 2327 O VAL A1199 -0.783 13.472 -3.764 1.00 0.64 O ATOM 2328 CB VAL A1199 1.387 13.209 -1.339 1.00 0.87 C ATOM 2329 CG1 VAL A1199 0.736 13.792 -0.086 1.00 0.99 C ATOM 2330 CG2 VAL A1199 0.851 11.794 -1.546 1.00 0.79 C ATOM 0 H VAL A1199 2.150 15.576 -1.518 1.00 1.23 H new ATOM 0 HA VAL A1199 1.632 13.514 -3.442 1.00 0.92 H new ATOM 0 HB VAL A1199 2.464 13.196 -1.174 1.00 0.87 H new ATOM 0 HG11 VAL A1199 0.915 13.128 0.760 1.00 0.99 H new ATOM 0 HG12 VAL A1199 1.165 14.772 0.124 1.00 0.99 H new ATOM 0 HG13 VAL A1199 -0.337 13.893 -0.247 1.00 0.99 H new ATOM 0 HG21 VAL A1199 0.997 11.213 -0.636 1.00 0.79 H new ATOM 0 HG22 VAL A1199 -0.212 11.839 -1.781 1.00 0.79 H new ATOM 0 HG23 VAL A1199 1.385 11.319 -2.369 1.00 0.79 H new ATOM 2340 N ASN A1200 -0.958 15.312 -2.506 1.00 1.00 N ATOM 2341 CA ASN A1200 -2.345 15.577 -2.910 1.00 1.02 C ATOM 2342 C ASN A1200 -2.438 15.995 -4.391 1.00 0.94 C ATOM 2343 O ASN A1200 -3.268 15.459 -5.126 1.00 0.89 O ATOM 2344 CB ASN A1200 -2.967 16.605 -1.959 1.00 1.27 C ATOM 2345 CG ASN A1200 -4.478 16.744 -2.082 1.00 1.46 C ATOM 2346 OD1 ASN A1200 -5.174 16.024 -2.792 1.00 1.87 O ATOM 2347 ND2 ASN A1200 -5.044 17.665 -1.349 1.00 1.90 N ATOM 0 H ASN A1200 -0.577 15.988 -1.844 1.00 1.00 H new ATOM 0 HA ASN A1200 -2.923 14.656 -2.831 1.00 1.02 H new ATOM 0 HB2 ASN A1200 -2.722 16.328 -0.934 1.00 1.27 H new ATOM 0 HB3 ASN A1200 -2.509 17.577 -2.144 1.00 1.27 H new ATOM 0 HD21 ASN A1200 -6.057 17.782 -1.369 1.00 1.90 H new ATOM 0 HD22 ASN A1200 -4.473 18.267 -0.756 1.00 1.90 H new ATOM 2354 N ASP A1201 -1.532 16.867 -4.851 1.00 0.96 N ATOM 2355 CA ASP A1201 -1.423 17.261 -6.262 1.00 0.91 C ATOM 2356 C ASP A1201 -1.159 16.042 -7.165 1.00 0.70 C ATOM 2357 O ASP A1201 -1.847 15.858 -8.170 1.00 0.66 O ATOM 2358 CB ASP A1201 -0.321 18.326 -6.413 1.00 1.08 C ATOM 2359 CG ASP A1201 -0.353 18.994 -7.790 1.00 1.01 C ATOM 2360 OD1 ASP A1201 -0.022 18.348 -8.809 1.00 1.77 O ATOM 2361 OD2 ASP A1201 -0.780 20.167 -7.890 1.00 1.94 O ATOM 0 H ASP A1201 -0.847 17.324 -4.249 1.00 0.96 H new ATOM 0 HA ASP A1201 -2.372 17.691 -6.584 1.00 0.91 H new ATOM 0 HB2 ASP A1201 -0.441 19.084 -5.639 1.00 1.08 H new ATOM 0 HB3 ASP A1201 0.654 17.864 -6.257 1.00 1.08 H new ATOM 2366 N PHE A1202 -0.236 15.161 -6.760 1.00 0.67 N ATOM 2367 CA PHE A1202 0.069 13.886 -7.424 1.00 0.58 C ATOM 2368 C PHE A1202 -1.116 12.894 -7.388 1.00 0.49 C ATOM 2369 O PHE A1202 -1.367 12.185 -8.363 1.00 0.52 O ATOM 2370 CB PHE A1202 1.315 13.313 -6.732 1.00 0.69 C ATOM 2371 CG PHE A1202 1.825 12.003 -7.293 1.00 0.69 C ATOM 2372 CD1 PHE A1202 1.214 10.798 -6.910 1.00 1.86 C ATOM 2373 CD2 PHE A1202 2.922 11.979 -8.169 1.00 1.83 C ATOM 2374 CE1 PHE A1202 1.683 9.570 -7.411 1.00 2.03 C ATOM 2375 CE2 PHE A1202 3.400 10.752 -8.664 1.00 1.85 C ATOM 2376 CZ PHE A1202 2.781 9.547 -8.287 1.00 1.07 C ATOM 0 H PHE A1202 0.339 15.321 -5.933 1.00 0.67 H new ATOM 0 HA PHE A1202 0.256 14.055 -8.485 1.00 0.58 H new ATOM 0 HB2 PHE A1202 2.115 14.051 -6.793 1.00 0.69 H new ATOM 0 HB3 PHE A1202 1.090 13.173 -5.675 1.00 0.69 H new ATOM 0 HD1 PHE A1202 0.378 10.814 -6.226 1.00 1.86 H new ATOM 0 HD2 PHE A1202 3.399 12.902 -8.463 1.00 1.83 H new ATOM 0 HE1 PHE A1202 1.200 8.648 -7.123 1.00 2.03 H new ATOM 0 HE2 PHE A1202 4.245 10.735 -9.336 1.00 1.85 H new ATOM 0 HZ PHE A1202 3.149 8.606 -8.670 1.00 1.07 H new ATOM 2386 N MET A1203 -1.873 12.845 -6.288 1.00 0.51 N ATOM 2387 CA MET A1203 -3.018 11.946 -6.098 1.00 0.56 C ATOM 2388 C MET A1203 -4.165 12.293 -7.058 1.00 0.63 C ATOM 2389 O MET A1203 -4.627 11.428 -7.804 1.00 0.70 O ATOM 2390 CB MET A1203 -3.454 12.006 -4.623 1.00 0.67 C ATOM 2391 CG MET A1203 -4.623 11.091 -4.248 1.00 0.84 C ATOM 2392 SD MET A1203 -4.394 9.304 -4.459 1.00 0.83 S ATOM 2393 CE MET A1203 -2.777 9.018 -3.695 1.00 0.57 C ATOM 0 H MET A1203 -1.702 13.446 -5.482 1.00 0.51 H new ATOM 0 HA MET A1203 -2.726 10.923 -6.335 1.00 0.56 H new ATOM 0 HB2 MET A1203 -2.599 11.750 -3.998 1.00 0.67 H new ATOM 0 HB3 MET A1203 -3.727 13.034 -4.384 1.00 0.67 H new ATOM 0 HG2 MET A1203 -4.873 11.276 -3.203 1.00 0.84 H new ATOM 0 HG3 MET A1203 -5.487 11.391 -4.840 1.00 0.84 H new ATOM 0 HE1 MET A1203 -2.677 7.963 -3.439 1.00 0.57 H new ATOM 0 HE2 MET A1203 -1.989 9.297 -4.395 1.00 0.57 H new ATOM 0 HE3 MET A1203 -2.690 9.621 -2.791 1.00 0.57 H new ATOM 2403 N THR A1204 -4.576 13.565 -7.108 1.00 0.68 N ATOM 2404 CA THR A1204 -5.575 14.026 -8.090 1.00 0.79 C ATOM 2405 C THR A1204 -5.032 13.952 -9.520 1.00 0.73 C ATOM 2406 O THR A1204 -5.773 13.576 -10.418 1.00 0.79 O ATOM 2407 CB THR A1204 -6.113 15.424 -7.731 1.00 0.96 C ATOM 2408 OG1 THR A1204 -7.204 15.791 -8.550 1.00 1.25 O ATOM 2409 CG2 THR A1204 -5.089 16.546 -7.864 1.00 1.00 C ATOM 0 H THR A1204 -4.235 14.296 -6.483 1.00 0.68 H new ATOM 0 HA THR A1204 -6.425 13.345 -8.047 1.00 0.79 H new ATOM 0 HB THR A1204 -6.402 15.322 -6.685 1.00 0.96 H new ATOM 0 HG1 THR A1204 -7.520 16.682 -8.293 1.00 1.25 H new ATOM 0 HG21 THR A1204 -5.552 17.495 -7.592 1.00 1.00 H new ATOM 0 HG22 THR A1204 -4.246 16.350 -7.201 1.00 1.00 H new ATOM 0 HG23 THR A1204 -4.736 16.596 -8.894 1.00 1.00 H new ATOM 2417 N GLU A1205 -3.736 14.191 -9.746 1.00 0.70 N ATOM 2418 CA GLU A1205 -3.086 14.070 -11.062 1.00 0.75 C ATOM 2419 C GLU A1205 -3.186 12.659 -11.656 1.00 0.74 C ATOM 2420 O GLU A1205 -3.581 12.509 -12.815 1.00 0.82 O ATOM 2421 CB GLU A1205 -1.631 14.529 -10.904 1.00 0.81 C ATOM 2422 CG GLU A1205 -0.687 14.386 -12.092 1.00 1.00 C ATOM 2423 CD GLU A1205 0.564 15.251 -11.877 1.00 2.71 C ATOM 2424 OE1 GLU A1205 0.493 16.492 -12.058 1.00 3.13 O ATOM 2425 OE2 GLU A1205 1.644 14.716 -11.526 1.00 4.38 O ATOM 0 H GLU A1205 -3.094 14.480 -9.008 1.00 0.70 H new ATOM 0 HA GLU A1205 -3.607 14.704 -11.780 1.00 0.75 H new ATOM 0 HB2 GLU A1205 -1.645 15.581 -10.617 1.00 0.81 H new ATOM 0 HB3 GLU A1205 -1.199 13.977 -10.070 1.00 0.81 H new ATOM 0 HG2 GLU A1205 -0.400 13.342 -12.215 1.00 1.00 H new ATOM 0 HG3 GLU A1205 -1.194 14.687 -13.008 1.00 1.00 H new ATOM 2432 N HIS A1206 -2.887 11.633 -10.854 1.00 0.69 N ATOM 2433 CA HIS A1206 -3.035 10.224 -11.248 1.00 0.74 C ATOM 2434 C HIS A1206 -4.503 9.766 -11.362 1.00 0.76 C ATOM 2435 O HIS A1206 -4.828 9.017 -12.286 1.00 0.84 O ATOM 2436 CB HIS A1206 -2.190 9.322 -10.340 1.00 0.81 C ATOM 2437 CG HIS A1206 -0.761 9.264 -10.821 1.00 1.18 C ATOM 2438 ND1 HIS A1206 -0.259 8.381 -11.750 1.00 1.78 N ATOM 2439 CD2 HIS A1206 0.246 10.147 -10.528 1.00 1.65 C ATOM 2440 CE1 HIS A1206 1.013 8.713 -12.001 1.00 2.32 C ATOM 2441 NE2 HIS A1206 1.370 9.795 -11.288 1.00 2.29 N ATOM 0 H HIS A1206 -2.533 11.755 -9.905 1.00 0.69 H new ATOM 0 HA HIS A1206 -2.647 10.130 -12.262 1.00 0.74 H new ATOM 0 HB2 HIS A1206 -2.219 9.698 -9.317 1.00 0.81 H new ATOM 0 HB3 HIS A1206 -2.613 8.318 -10.322 1.00 0.81 H new ATOM 0 HD2 HIS A1206 0.184 10.971 -9.832 1.00 1.65 H new ATOM 0 HE1 HIS A1206 1.663 8.184 -12.683 1.00 2.32 H new ATOM 0 HE2 HIS A1206 2.275 10.265 -11.298 1.00 2.29 H new ATOM 2449 N GLU A1207 -5.413 10.262 -10.515 1.00 0.73 N ATOM 2450 CA GLU A1207 -6.857 10.028 -10.690 1.00 0.81 C ATOM 2451 C GLU A1207 -7.405 10.666 -11.986 1.00 0.89 C ATOM 2452 O GLU A1207 -8.171 10.038 -12.721 1.00 0.98 O ATOM 2453 CB GLU A1207 -7.642 10.564 -9.476 1.00 0.91 C ATOM 2454 CG GLU A1207 -7.707 9.624 -8.259 1.00 1.12 C ATOM 2455 CD GLU A1207 -9.120 9.555 -7.649 1.00 1.96 C ATOM 2456 OE1 GLU A1207 -9.760 10.621 -7.459 1.00 2.96 O ATOM 2457 OE2 GLU A1207 -9.629 8.436 -7.399 1.00 2.32 O ATOM 0 H GLU A1207 -5.178 10.829 -9.700 1.00 0.73 H new ATOM 0 HA GLU A1207 -6.993 8.949 -10.769 1.00 0.81 H new ATOM 0 HB2 GLU A1207 -7.192 11.506 -9.162 1.00 0.91 H new ATOM 0 HB3 GLU A1207 -8.660 10.788 -9.794 1.00 0.91 H new ATOM 0 HG2 GLU A1207 -7.393 8.624 -8.558 1.00 1.12 H new ATOM 0 HG3 GLU A1207 -7.002 9.966 -7.501 1.00 1.12 H new ATOM 2464 N ARG A1208 -6.990 11.896 -12.312 1.00 0.90 N ATOM 2465 CA ARG A1208 -7.463 12.687 -13.467 1.00 1.03 C ATOM 2466 C ARG A1208 -6.995 12.138 -14.819 1.00 1.06 C ATOM 2467 O ARG A1208 -7.705 12.271 -15.818 1.00 1.18 O ATOM 2468 CB ARG A1208 -7.032 14.147 -13.255 1.00 1.08 C ATOM 2469 CG ARG A1208 -7.972 14.855 -12.263 1.00 1.28 C ATOM 2470 CD ARG A1208 -7.422 16.206 -11.796 1.00 1.40 C ATOM 2471 NE ARG A1208 -7.217 17.132 -12.922 1.00 2.53 N ATOM 2472 CZ ARG A1208 -7.516 18.414 -12.979 1.00 3.10 C ATOM 2473 NH1 ARG A1208 -8.051 19.081 -11.999 1.00 2.85 N ATOM 2474 NH2 ARG A1208 -7.266 19.045 -14.079 1.00 4.80 N ATOM 0 H ARG A1208 -6.289 12.391 -11.761 1.00 0.90 H new ATOM 0 HA ARG A1208 -8.550 12.619 -13.512 1.00 1.03 H new ATOM 0 HB2 ARG A1208 -6.009 14.178 -12.880 1.00 1.08 H new ATOM 0 HB3 ARG A1208 -7.038 14.675 -14.209 1.00 1.08 H new ATOM 0 HG2 ARG A1208 -8.944 15.005 -12.733 1.00 1.28 H new ATOM 0 HG3 ARG A1208 -8.132 14.212 -11.397 1.00 1.28 H new ATOM 0 HD2 ARG A1208 -8.113 16.652 -11.080 1.00 1.40 H new ATOM 0 HD3 ARG A1208 -6.477 16.053 -11.275 1.00 1.40 H new ATOM 0 HE ARG A1208 -6.792 16.733 -13.759 1.00 2.53 H new ATOM 0 HH11 ARG A1208 -8.264 18.611 -11.119 1.00 2.85 H new ATOM 0 HH12 ARG A1208 -8.257 20.074 -12.110 1.00 2.85 H new ATOM 0 HH21 ARG A1208 -6.850 18.550 -14.868 1.00 4.80 H new ATOM 0 HH22 ARG A1208 -7.485 20.038 -14.158 1.00 4.80 H new ATOM 2488 N LYS A1209 -5.867 11.423 -14.843 1.00 1.00 N ATOM 2489 CA LYS A1209 -5.421 10.619 -16.002 1.00 1.09 C ATOM 2490 C LYS A1209 -6.096 9.237 -16.101 1.00 1.14 C ATOM 2491 O LYS A1209 -5.688 8.406 -16.904 1.00 1.28 O ATOM 2492 CB LYS A1209 -3.908 10.592 -16.098 1.00 1.23 C ATOM 2493 CG LYS A1209 -3.341 9.775 -14.960 1.00 2.04 C ATOM 2494 CD LYS A1209 -1.896 9.447 -15.232 1.00 1.89 C ATOM 2495 CE LYS A1209 -0.936 10.559 -14.795 1.00 2.01 C ATOM 2496 NZ LYS A1209 0.350 10.502 -15.527 1.00 2.87 N ATOM 0 H LYS A1209 -5.224 11.381 -14.052 1.00 1.00 H new ATOM 0 HA LYS A1209 -5.775 11.127 -16.899 1.00 1.09 H new ATOM 0 HB2 LYS A1209 -3.602 10.165 -17.053 1.00 1.23 H new ATOM 0 HB3 LYS A1209 -3.513 11.607 -16.062 1.00 1.23 H new ATOM 0 HG2 LYS A1209 -3.427 10.329 -14.025 1.00 2.04 H new ATOM 0 HG3 LYS A1209 -3.915 8.856 -14.840 1.00 2.04 H new ATOM 0 HD2 LYS A1209 -1.635 8.525 -14.713 1.00 1.89 H new ATOM 0 HD3 LYS A1209 -1.766 9.261 -16.298 1.00 1.89 H new ATOM 0 HE2 LYS A1209 -1.405 11.529 -14.961 1.00 2.01 H new ATOM 0 HE3 LYS A1209 -0.748 10.475 -13.725 1.00 2.01 H new ATOM 0 HZ1 LYS A1209 0.969 11.271 -15.201 1.00 2.87 H new ATOM 0 HZ2 LYS A1209 0.811 9.587 -15.348 1.00 2.87 H new ATOM 0 HZ3 LYS A1209 0.174 10.608 -16.547 1.00 2.87 H new ATOM 2510 N GLY A1210 -7.100 8.994 -15.261 1.00 1.12 N ATOM 2511 CA GLY A1210 -8.032 7.856 -15.295 1.00 1.24 C ATOM 2512 C GLY A1210 -7.622 6.622 -14.482 1.00 1.27 C ATOM 2513 O GLY A1210 -8.396 5.665 -14.373 1.00 1.72 O ATOM 0 H GLY A1210 -7.302 9.625 -14.486 1.00 1.12 H new ATOM 0 HA2 GLY A1210 -9.003 8.197 -14.935 1.00 1.24 H new ATOM 0 HA3 GLY A1210 -8.166 7.553 -16.334 1.00 1.24 H new ATOM 2517 N ARG A1211 -6.418 6.619 -13.900 1.00 0.96 N ATOM 2518 CA ARG A1211 -5.816 5.447 -13.243 1.00 0.91 C ATOM 2519 C ARG A1211 -6.128 5.419 -11.742 1.00 0.81 C ATOM 2520 O ARG A1211 -6.567 6.416 -11.166 1.00 1.05 O ATOM 2521 CB ARG A1211 -4.313 5.370 -13.586 1.00 0.96 C ATOM 2522 CG ARG A1211 -4.045 4.812 -14.998 1.00 1.37 C ATOM 2523 CD ARG A1211 -4.387 5.745 -16.161 1.00 1.73 C ATOM 2524 NE ARG A1211 -4.053 5.119 -17.450 1.00 1.89 N ATOM 2525 CZ ARG A1211 -3.962 5.712 -18.621 1.00 2.53 C ATOM 2526 NH1 ARG A1211 -4.201 6.979 -18.797 1.00 3.66 N ATOM 2527 NH2 ARG A1211 -3.623 5.001 -19.648 1.00 2.84 N ATOM 0 H ARG A1211 -5.821 7.445 -13.870 1.00 0.96 H new ATOM 0 HA ARG A1211 -6.269 4.535 -13.632 1.00 0.91 H new ATOM 0 HB2 ARG A1211 -3.876 6.365 -13.506 1.00 0.96 H new ATOM 0 HB3 ARG A1211 -3.810 4.741 -12.851 1.00 0.96 H new ATOM 0 HG2 ARG A1211 -2.990 4.547 -15.069 1.00 1.37 H new ATOM 0 HG3 ARG A1211 -4.614 3.890 -15.117 1.00 1.37 H new ATOM 0 HD2 ARG A1211 -5.449 5.991 -16.136 1.00 1.73 H new ATOM 0 HD3 ARG A1211 -3.840 6.682 -16.054 1.00 1.73 H new ATOM 0 HE ARG A1211 -3.872 4.115 -17.434 1.00 1.89 H new ATOM 0 HH11 ARG A1211 -4.473 7.561 -18.005 1.00 3.66 H new ATOM 0 HH12 ARG A1211 -4.116 7.390 -19.727 1.00 3.66 H new ATOM 0 HH21 ARG A1211 -3.433 4.005 -19.538 1.00 2.84 H new ATOM 0 HH22 ARG A1211 -3.545 5.437 -20.567 1.00 2.84 H new ATOM 2541 N THR A1212 -5.961 4.261 -11.109 1.00 0.75 N ATOM 2542 CA THR A1212 -6.214 4.070 -9.674 1.00 0.70 C ATOM 2543 C THR A1212 -5.078 4.676 -8.852 1.00 0.60 C ATOM 2544 O THR A1212 -3.929 4.244 -8.959 1.00 0.65 O ATOM 2545 CB THR A1212 -6.406 2.583 -9.346 1.00 0.81 C ATOM 2546 OG1 THR A1212 -7.637 2.155 -9.876 1.00 1.11 O ATOM 2547 CG2 THR A1212 -6.465 2.273 -7.848 1.00 0.83 C ATOM 0 H THR A1212 -5.642 3.414 -11.580 1.00 0.75 H new ATOM 0 HA THR A1212 -7.137 4.586 -9.412 1.00 0.70 H new ATOM 0 HB THR A1212 -5.540 2.076 -9.772 1.00 0.81 H new ATOM 0 HG1 THR A1212 -7.768 1.205 -9.673 1.00 1.11 H new ATOM 0 HG21 THR A1212 -6.602 1.201 -7.703 1.00 0.83 H new ATOM 0 HG22 THR A1212 -5.535 2.587 -7.375 1.00 0.83 H new ATOM 0 HG23 THR A1212 -7.300 2.810 -7.398 1.00 0.83 H new ATOM 2555 N ALA A1213 -5.405 5.654 -8.009 1.00 0.61 N ATOM 2556 CA ALA A1213 -4.459 6.367 -7.154 1.00 0.59 C ATOM 2557 C ALA A1213 -4.842 6.163 -5.675 1.00 0.62 C ATOM 2558 O ALA A1213 -5.943 6.547 -5.269 1.00 0.75 O ATOM 2559 CB ALA A1213 -4.454 7.837 -7.601 1.00 0.61 C ATOM 0 H ALA A1213 -6.365 5.982 -7.899 1.00 0.61 H new ATOM 0 HA ALA A1213 -3.443 5.984 -7.249 1.00 0.59 H new ATOM 0 HB1 ALA A1213 -3.757 8.403 -6.983 1.00 0.61 H new ATOM 0 HB2 ALA A1213 -4.146 7.899 -8.645 1.00 0.61 H new ATOM 0 HB3 ALA A1213 -5.455 8.254 -7.493 1.00 0.61 H new ATOM 2565 N VAL A1214 -3.978 5.504 -4.890 1.00 0.54 N ATOM 2566 CA VAL A1214 -4.280 5.050 -3.510 1.00 0.54 C ATOM 2567 C VAL A1214 -3.099 5.216 -2.547 1.00 0.44 C ATOM 2568 O VAL A1214 -1.944 5.263 -2.969 1.00 0.41 O ATOM 2569 CB VAL A1214 -4.774 3.588 -3.487 1.00 0.69 C ATOM 2570 CG1 VAL A1214 -6.097 3.429 -4.243 1.00 0.85 C ATOM 2571 CG2 VAL A1214 -3.763 2.587 -4.065 1.00 0.75 C ATOM 0 H VAL A1214 -3.034 5.264 -5.193 1.00 0.54 H new ATOM 0 HA VAL A1214 -5.080 5.702 -3.159 1.00 0.54 H new ATOM 0 HB VAL A1214 -4.911 3.359 -2.430 1.00 0.69 H new ATOM 0 HG11 VAL A1214 -6.414 2.387 -4.206 1.00 0.85 H new ATOM 0 HG12 VAL A1214 -6.858 4.057 -3.780 1.00 0.85 H new ATOM 0 HG13 VAL A1214 -5.961 3.730 -5.282 1.00 0.85 H new ATOM 0 HG21 VAL A1214 -4.179 1.581 -4.016 1.00 0.75 H new ATOM 0 HG22 VAL A1214 -3.552 2.842 -5.103 1.00 0.75 H new ATOM 0 HG23 VAL A1214 -2.840 2.627 -3.486 1.00 0.75 H new ATOM 2581 N LEU A1215 -3.373 5.284 -1.239 1.00 0.44 N ATOM 2582 CA LEU A1215 -2.364 5.493 -0.187 1.00 0.38 C ATOM 2583 C LEU A1215 -2.179 4.267 0.730 1.00 0.44 C ATOM 2584 O LEU A1215 -3.039 3.384 0.781 1.00 0.49 O ATOM 2585 CB LEU A1215 -2.724 6.752 0.620 1.00 0.36 C ATOM 2586 CG LEU A1215 -2.711 8.052 -0.207 1.00 0.41 C ATOM 2587 CD1 LEU A1215 -4.137 8.567 -0.426 1.00 0.53 C ATOM 2588 CD2 LEU A1215 -1.899 9.142 0.490 1.00 0.81 C ATOM 0 H LEU A1215 -4.320 5.194 -0.872 1.00 0.44 H new ATOM 0 HA LEU A1215 -1.400 5.636 -0.675 1.00 0.38 H new ATOM 0 HB2 LEU A1215 -3.714 6.621 1.056 1.00 0.36 H new ATOM 0 HB3 LEU A1215 -2.022 6.853 1.448 1.00 0.36 H new ATOM 0 HG LEU A1215 -2.250 7.819 -1.167 1.00 0.41 H new ATOM 0 HD11 LEU A1215 -4.106 9.486 -1.012 1.00 0.53 H new ATOM 0 HD12 LEU A1215 -4.717 7.815 -0.960 1.00 0.53 H new ATOM 0 HD13 LEU A1215 -4.604 8.767 0.538 1.00 0.53 H new ATOM 0 HD21 LEU A1215 -1.908 10.047 -0.117 1.00 0.81 H new ATOM 0 HD22 LEU A1215 -2.337 9.355 1.465 1.00 0.81 H new ATOM 0 HD23 LEU A1215 -0.871 8.803 0.620 1.00 0.81 H new ATOM 2600 N VAL A1216 -1.061 4.232 1.468 1.00 0.43 N ATOM 2601 CA VAL A1216 -0.723 3.191 2.457 1.00 0.50 C ATOM 2602 C VAL A1216 -0.244 3.793 3.787 1.00 0.47 C ATOM 2603 O VAL A1216 0.734 4.547 3.853 1.00 0.43 O ATOM 2604 CB VAL A1216 0.252 2.147 1.867 1.00 0.70 C ATOM 2605 CG1 VAL A1216 1.495 2.734 1.185 1.00 1.76 C ATOM 2606 CG2 VAL A1216 0.699 1.109 2.901 1.00 2.19 C ATOM 0 H VAL A1216 -0.341 4.950 1.393 1.00 0.43 H new ATOM 0 HA VAL A1216 -1.638 2.650 2.696 1.00 0.50 H new ATOM 0 HB VAL A1216 -0.344 1.665 1.092 1.00 0.70 H new ATOM 0 HG11 VAL A1216 2.117 1.924 0.803 1.00 1.76 H new ATOM 0 HG12 VAL A1216 1.188 3.376 0.359 1.00 1.76 H new ATOM 0 HG13 VAL A1216 2.064 3.319 1.907 1.00 1.76 H new ATOM 0 HG21 VAL A1216 1.382 0.400 2.433 1.00 2.19 H new ATOM 0 HG22 VAL A1216 1.205 1.611 3.725 1.00 2.19 H new ATOM 0 HG23 VAL A1216 -0.172 0.576 3.281 1.00 2.19 H new ATOM 2616 N ALA A1217 -0.941 3.426 4.864 1.00 0.59 N ATOM 2617 CA ALA A1217 -0.705 3.854 6.239 1.00 0.61 C ATOM 2618 C ALA A1217 -0.254 2.669 7.115 1.00 0.55 C ATOM 2619 O ALA A1217 -0.578 1.512 6.849 1.00 0.50 O ATOM 2620 CB ALA A1217 -1.957 4.540 6.781 1.00 0.64 C ATOM 0 H ALA A1217 -1.731 2.785 4.793 1.00 0.59 H new ATOM 0 HA ALA A1217 0.109 4.578 6.261 1.00 0.61 H new ATOM 0 HB1 ALA A1217 -1.781 4.860 7.808 1.00 0.64 H new ATOM 0 HB2 ALA A1217 -2.191 5.409 6.166 1.00 0.64 H new ATOM 0 HB3 ALA A1217 -2.794 3.842 6.757 1.00 0.64 H new ATOM 2626 N VAL A1218 0.507 2.951 8.168 1.00 0.57 N ATOM 2627 CA VAL A1218 1.203 1.948 8.990 1.00 0.55 C ATOM 2628 C VAL A1218 1.328 2.415 10.440 1.00 0.56 C ATOM 2629 O VAL A1218 1.889 3.474 10.728 1.00 0.53 O ATOM 2630 CB VAL A1218 2.585 1.586 8.403 1.00 0.69 C ATOM 2631 CG1 VAL A1218 2.462 0.845 7.065 1.00 0.67 C ATOM 2632 CG2 VAL A1218 3.491 2.796 8.150 1.00 0.89 C ATOM 0 H VAL A1218 0.665 3.907 8.487 1.00 0.57 H new ATOM 0 HA VAL A1218 0.597 1.042 8.978 1.00 0.55 H new ATOM 0 HB VAL A1218 3.033 0.954 9.170 1.00 0.69 H new ATOM 0 HG11 VAL A1218 3.457 0.609 6.687 1.00 0.67 H new ATOM 0 HG12 VAL A1218 1.901 -0.078 7.211 1.00 0.67 H new ATOM 0 HG13 VAL A1218 1.941 1.477 6.346 1.00 0.67 H new ATOM 0 HG21 VAL A1218 4.442 2.459 7.738 1.00 0.89 H new ATOM 0 HG22 VAL A1218 3.008 3.471 7.443 1.00 0.89 H new ATOM 0 HG23 VAL A1218 3.668 3.321 9.089 1.00 0.89 H new ATOM 2642 N ASP A1219 0.756 1.635 11.360 1.00 0.64 N ATOM 2643 CA ASP A1219 0.681 1.927 12.798 1.00 0.68 C ATOM 2644 C ASP A1219 0.345 3.408 13.089 1.00 0.66 C ATOM 2645 O ASP A1219 1.043 4.120 13.811 1.00 0.69 O ATOM 2646 CB ASP A1219 1.907 1.350 13.517 1.00 0.74 C ATOM 2647 CG ASP A1219 1.892 1.681 15.007 1.00 2.11 C ATOM 2648 OD1 ASP A1219 0.832 1.499 15.651 1.00 3.30 O ATOM 2649 OD2 ASP A1219 2.921 2.179 15.519 1.00 3.23 O ATOM 0 H ASP A1219 0.315 0.748 11.117 1.00 0.64 H new ATOM 0 HA ASP A1219 -0.174 1.410 13.233 1.00 0.68 H new ATOM 0 HB2 ASP A1219 1.932 0.268 13.384 1.00 0.74 H new ATOM 0 HB3 ASP A1219 2.815 1.748 13.064 1.00 0.74 H new ATOM 2654 N ASP A1220 -0.734 3.878 12.462 1.00 0.66 N ATOM 2655 CA ASP A1220 -1.277 5.234 12.583 1.00 0.66 C ATOM 2656 C ASP A1220 -0.396 6.391 12.051 1.00 0.64 C ATOM 2657 O ASP A1220 -0.586 7.545 12.440 1.00 0.75 O ATOM 2658 CB ASP A1220 -1.853 5.470 13.995 1.00 0.72 C ATOM 2659 CG ASP A1220 -2.675 4.280 14.506 1.00 0.75 C ATOM 2660 OD1 ASP A1220 -3.804 4.069 14.008 1.00 1.43 O ATOM 2661 OD2 ASP A1220 -2.198 3.490 15.358 1.00 1.44 O ATOM 0 H ASP A1220 -1.280 3.297 11.826 1.00 0.66 H new ATOM 0 HA ASP A1220 -2.101 5.270 11.871 1.00 0.66 H new ATOM 0 HB2 ASP A1220 -1.035 5.666 14.688 1.00 0.72 H new ATOM 0 HB3 ASP A1220 -2.481 6.361 13.983 1.00 0.72 H new ATOM 2666 N GLU A1221 0.538 6.128 11.132 1.00 0.55 N ATOM 2667 CA GLU A1221 1.276 7.137 10.349 1.00 0.56 C ATOM 2668 C GLU A1221 1.217 6.812 8.847 1.00 0.49 C ATOM 2669 O GLU A1221 1.123 5.651 8.458 1.00 0.54 O ATOM 2670 CB GLU A1221 2.756 7.218 10.776 1.00 0.70 C ATOM 2671 CG GLU A1221 3.016 7.856 12.148 1.00 1.63 C ATOM 2672 CD GLU A1221 2.532 9.311 12.249 1.00 1.66 C ATOM 2673 OE1 GLU A1221 2.641 10.086 11.274 1.00 1.92 O ATOM 2674 OE2 GLU A1221 2.001 9.717 13.315 1.00 2.78 O ATOM 0 H GLU A1221 0.815 5.174 10.901 1.00 0.55 H new ATOM 0 HA GLU A1221 0.797 8.097 10.541 1.00 0.56 H new ATOM 0 HB2 GLU A1221 3.170 6.210 10.780 1.00 0.70 H new ATOM 0 HB3 GLU A1221 3.303 7.785 10.022 1.00 0.70 H new ATOM 0 HG2 GLU A1221 2.520 7.262 12.916 1.00 1.63 H new ATOM 0 HG3 GLU A1221 4.085 7.821 12.359 1.00 1.63 H new ATOM 2681 N LEU A1222 1.292 7.818 7.977 1.00 0.43 N ATOM 2682 CA LEU A1222 1.484 7.600 6.534 1.00 0.40 C ATOM 2683 C LEU A1222 2.913 7.126 6.208 1.00 0.43 C ATOM 2684 O LEU A1222 3.875 7.595 6.821 1.00 0.67 O ATOM 2685 CB LEU A1222 1.133 8.891 5.766 1.00 0.46 C ATOM 2686 CG LEU A1222 -0.161 8.735 4.953 1.00 0.51 C ATOM 2687 CD1 LEU A1222 -0.804 10.088 4.672 1.00 0.61 C ATOM 2688 CD2 LEU A1222 0.115 8.014 3.632 1.00 0.53 C ATOM 0 H LEU A1222 1.223 8.800 8.243 1.00 0.43 H new ATOM 0 HA LEU A1222 0.813 6.802 6.215 1.00 0.40 H new ATOM 0 HB2 LEU A1222 1.023 9.715 6.471 1.00 0.46 H new ATOM 0 HB3 LEU A1222 1.954 9.151 5.097 1.00 0.46 H new ATOM 0 HG LEU A1222 -0.852 8.139 5.549 1.00 0.51 H new ATOM 0 HD11 LEU A1222 -1.718 9.944 4.095 1.00 0.61 H new ATOM 0 HD12 LEU A1222 -1.044 10.580 5.615 1.00 0.61 H new ATOM 0 HD13 LEU A1222 -0.111 10.709 4.105 1.00 0.61 H new ATOM 0 HD21 LEU A1222 -0.814 7.914 3.071 1.00 0.53 H new ATOM 0 HD22 LEU A1222 0.832 8.589 3.046 1.00 0.53 H new ATOM 0 HD23 LEU A1222 0.524 7.025 3.836 1.00 0.53 H new ATOM 2700 N CYS A1223 3.078 6.258 5.198 1.00 0.39 N ATOM 2701 CA CYS A1223 4.408 5.913 4.661 1.00 0.40 C ATOM 2702 C CYS A1223 4.561 6.189 3.157 1.00 0.40 C ATOM 2703 O CYS A1223 5.633 6.626 2.735 1.00 0.44 O ATOM 2704 CB CYS A1223 4.808 4.474 5.030 1.00 0.40 C ATOM 2705 SG CYS A1223 3.718 3.235 4.277 1.00 0.43 S ATOM 0 H CYS A1223 2.306 5.780 4.734 1.00 0.39 H new ATOM 0 HA CYS A1223 5.111 6.590 5.147 1.00 0.40 H new ATOM 0 HB2 CYS A1223 5.834 4.292 4.711 1.00 0.40 H new ATOM 0 HB3 CYS A1223 4.787 4.361 6.114 1.00 0.40 H new ATOM 0 HG CYS A1223 2.529 3.738 4.127 1.00 0.43 H new ATOM 2711 N GLY A1224 3.512 5.999 2.351 1.00 0.40 N ATOM 2712 CA GLY A1224 3.599 6.180 0.902 1.00 0.44 C ATOM 2713 C GLY A1224 2.278 6.023 0.151 1.00 0.42 C ATOM 2714 O GLY A1224 1.195 5.991 0.740 1.00 0.40 O ATOM 0 H GLY A1224 2.589 5.718 2.682 1.00 0.40 H new ATOM 0 HA2 GLY A1224 3.999 7.173 0.698 1.00 0.44 H new ATOM 0 HA3 GLY A1224 4.314 5.460 0.503 1.00 0.44 H new ATOM 2718 N LEU A1225 2.391 5.955 -1.174 1.00 0.45 N ATOM 2719 CA LEU A1225 1.285 5.812 -2.117 1.00 0.47 C ATOM 2720 C LEU A1225 1.637 4.929 -3.323 1.00 0.53 C ATOM 2721 O LEU A1225 2.804 4.804 -3.703 1.00 0.56 O ATOM 2722 CB LEU A1225 0.762 7.198 -2.534 1.00 0.49 C ATOM 2723 CG LEU A1225 1.723 8.087 -3.350 1.00 0.57 C ATOM 2724 CD1 LEU A1225 0.877 9.164 -4.019 1.00 0.71 C ATOM 2725 CD2 LEU A1225 2.797 8.796 -2.514 1.00 0.54 C ATOM 0 H LEU A1225 3.297 6.000 -1.640 1.00 0.45 H new ATOM 0 HA LEU A1225 0.480 5.285 -1.606 1.00 0.47 H new ATOM 0 HB2 LEU A1225 -0.148 7.056 -3.117 1.00 0.49 H new ATOM 0 HB3 LEU A1225 0.481 7.741 -1.632 1.00 0.49 H new ATOM 0 HG LEU A1225 2.249 7.436 -4.048 1.00 0.57 H new ATOM 0 HD11 LEU A1225 1.520 9.818 -4.609 1.00 0.71 H new ATOM 0 HD12 LEU A1225 0.140 8.695 -4.671 1.00 0.71 H new ATOM 0 HD13 LEU A1225 0.365 9.751 -3.256 1.00 0.71 H new ATOM 0 HD21 LEU A1225 3.428 9.399 -3.168 1.00 0.54 H new ATOM 0 HD22 LEU A1225 2.318 9.440 -1.777 1.00 0.54 H new ATOM 0 HD23 LEU A1225 3.409 8.053 -2.003 1.00 0.54 H new ATOM 2737 N ILE A1226 0.609 4.338 -3.934 1.00 0.54 N ATOM 2738 CA ILE A1226 0.712 3.417 -5.071 1.00 0.57 C ATOM 2739 C ILE A1226 -0.214 3.890 -6.203 1.00 0.57 C ATOM 2740 O ILE A1226 -1.374 4.243 -5.972 1.00 0.56 O ATOM 2741 CB ILE A1226 0.377 1.962 -4.648 1.00 0.60 C ATOM 2742 CG1 ILE A1226 1.043 1.482 -3.332 1.00 0.65 C ATOM 2743 CG2 ILE A1226 0.715 0.978 -5.784 1.00 0.62 C ATOM 2744 CD1 ILE A1226 2.563 1.290 -3.368 1.00 0.72 C ATOM 0 H ILE A1226 -0.356 4.492 -3.641 1.00 0.54 H new ATOM 0 HA ILE A1226 1.741 3.419 -5.431 1.00 0.57 H new ATOM 0 HB ILE A1226 -0.694 1.975 -4.448 1.00 0.60 H new ATOM 0 HG12 ILE A1226 0.808 2.202 -2.548 1.00 0.65 H new ATOM 0 HG13 ILE A1226 0.586 0.536 -3.043 1.00 0.65 H new ATOM 0 HG21 ILE A1226 0.474 -0.037 -5.470 1.00 0.62 H new ATOM 0 HG22 ILE A1226 0.133 1.232 -6.670 1.00 0.62 H new ATOM 0 HG23 ILE A1226 1.778 1.043 -6.017 1.00 0.62 H new ATOM 0 HD11 ILE A1226 2.910 0.953 -2.391 1.00 0.72 H new ATOM 0 HD12 ILE A1226 2.818 0.544 -4.121 1.00 0.72 H new ATOM 0 HD13 ILE A1226 3.043 2.236 -3.618 1.00 0.72 H new ATOM 2756 N ALA A1227 0.291 3.859 -7.436 1.00 0.60 N ATOM 2757 CA ALA A1227 -0.480 4.055 -8.660 1.00 0.67 C ATOM 2758 C ALA A1227 -0.664 2.704 -9.375 1.00 0.80 C ATOM 2759 O ALA A1227 0.309 1.975 -9.594 1.00 0.82 O ATOM 2760 CB ALA A1227 0.222 5.103 -9.537 1.00 0.74 C ATOM 0 H ALA A1227 1.281 3.691 -7.614 1.00 0.60 H new ATOM 0 HA ALA A1227 -1.476 4.434 -8.433 1.00 0.67 H new ATOM 0 HB1 ALA A1227 -0.350 5.253 -10.453 1.00 0.74 H new ATOM 0 HB2 ALA A1227 0.291 6.045 -8.993 1.00 0.74 H new ATOM 0 HB3 ALA A1227 1.224 4.755 -9.788 1.00 0.74 H new ATOM 2766 N ILE A1228 -1.897 2.370 -9.762 1.00 0.91 N ATOM 2767 CA ILE A1228 -2.248 1.164 -10.522 1.00 0.90 C ATOM 2768 C ILE A1228 -2.979 1.597 -11.791 1.00 0.91 C ATOM 2769 O ILE A1228 -3.907 2.399 -11.748 1.00 1.26 O ATOM 2770 CB ILE A1228 -3.077 0.142 -9.700 1.00 0.95 C ATOM 2771 CG1 ILE A1228 -2.351 -0.375 -8.438 1.00 1.13 C ATOM 2772 CG2 ILE A1228 -3.398 -1.091 -10.562 1.00 0.94 C ATOM 2773 CD1 ILE A1228 -2.540 0.532 -7.222 1.00 1.32 C ATOM 0 H ILE A1228 -2.708 2.951 -9.548 1.00 0.91 H new ATOM 0 HA ILE A1228 -1.330 0.635 -10.779 1.00 0.90 H new ATOM 0 HB ILE A1228 -3.973 0.680 -9.392 1.00 0.95 H new ATOM 0 HG12 ILE A1228 -2.717 -1.373 -8.199 1.00 1.13 H new ATOM 0 HG13 ILE A1228 -1.286 -0.469 -8.652 1.00 1.13 H new ATOM 0 HG21 ILE A1228 -3.980 -1.803 -9.977 1.00 0.94 H new ATOM 0 HG22 ILE A1228 -3.973 -0.784 -11.436 1.00 0.94 H new ATOM 0 HG23 ILE A1228 -2.469 -1.561 -10.885 1.00 0.94 H new ATOM 0 HD11 ILE A1228 -2.006 0.113 -6.369 1.00 1.32 H new ATOM 0 HD12 ILE A1228 -2.148 1.525 -7.444 1.00 1.32 H new ATOM 0 HD13 ILE A1228 -3.601 0.606 -6.984 1.00 1.32 H new ATOM 2785 N ALA A1229 -2.540 1.062 -12.924 1.00 0.69 N ATOM 2786 CA ALA A1229 -3.048 1.428 -14.245 1.00 0.85 C ATOM 2787 C ALA A1229 -4.114 0.474 -14.799 1.00 1.20 C ATOM 2788 O ALA A1229 -5.013 0.917 -15.513 1.00 3.08 O ATOM 2789 CB ALA A1229 -1.859 1.561 -15.195 1.00 0.84 C ATOM 0 H ALA A1229 -1.810 0.350 -12.954 1.00 0.69 H new ATOM 0 HA ALA A1229 -3.570 2.380 -14.149 1.00 0.85 H new ATOM 0 HB1 ALA A1229 -2.216 1.834 -16.188 1.00 0.84 H new ATOM 0 HB2 ALA A1229 -1.184 2.333 -14.827 1.00 0.84 H new ATOM 0 HB3 ALA A1229 -1.328 0.611 -15.249 1.00 0.84 H new