USER MOD reduce.3.24.130724 H: found=0, std=0, add=967, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 965 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A1057 ASN : amide:sc= 0.682 K(o=1.5,f=0.38) USER MOD Set 1.2: A1206 HIS : no HE2:sc= 0.838 K(o=1.5,f=-1.5) USER MOD Set 2.1: A1065 SER OG : rot -74:sc= 1.07 USER MOD Set 2.2: A1069 SER OG : rot 180:sc= 0.92 USER MOD Single : A1058 GLN : amide:sc= 0.971 K(o=0.97,f=0) USER MOD Single : A1060 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1063 THR OG1 : rot -25:sc= 0.331 USER MOD Single : A1066 ASN : amide:sc= 0.747 K(o=0.75,f=0) USER MOD Single : A1070 HIS : no HD1:sc= -0.0617 X(o=-0.062,f=-0.014) USER MOD Single : A1071 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A1072 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1079 THR OG1 : rot 73:sc= 0.385 USER MOD Single : A1082 SER OG : rot -29:sc= 0.186 USER MOD Single : A1083 ASN : amide:sc= 0.278 K(o=0.28,f=-3.7!) USER MOD Single : A1084 SER OG : rot 180:sc= 0 USER MOD Single : A1086 HIS : no HE2:sc= 0.198 K(o=0.2,f=-4.3!) USER MOD Single : A1090 THR OG1 : rot 180:sc= 0 USER MOD Single : A1093 THR OG1 : rot 73:sc= 1.24 USER MOD Single : A1094 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1095 TYR OH : rot 30:sc= 0 USER MOD Single : A1096 CYS SG : rot 132:sc= 0.231 USER MOD Single : A1097 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1098 GLN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A1102 THR OG1 : rot -149:sc= 0.377 USER MOD Single : A1104 THR OG1 : rot 180:sc= 0 USER MOD Single : A1107 THR OG1 : rot 180:sc= 0 USER MOD Single : A1108 CYS SG : rot 180:sc= 0.00234 USER MOD Single : A1112 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1117 CYS SG : rot 180:sc= 0 USER MOD Single : A1120 SER OG : rot 180:sc= 0 USER MOD Single : A1121 CYS SG : rot 180:sc= -0.0619 USER MOD Single : A1122 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.000639) USER MOD Single : A1124 THR OG1 : rot 32:sc= 0.215 USER MOD Single : A1125 ASN : amide:sc= -0.0488 K(o=-0.049,f=-1) USER MOD Single : A1177 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1178 TYR OH : rot 180:sc= 0 USER MOD Single : A1179 LYS NZ :NH3+ 159:sc= 0.444 (180deg=-0.168) USER MOD Single : A1184 ASN : amide:sc= -0.0136 K(o=-0.014,f=-1.7!) USER MOD Single : A1188 MET CE :methyl -165:sc= -0.0122 (180deg=-0.447) USER MOD Single : A1191 ASN : amide:sc= 0.147 X(o=0.15,f=-0.0015) USER MOD Single : A1196 ASN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A1197 ASN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A1200 ASN : amide:sc= 0.669 K(o=0.67,f=-3.4!) USER MOD Single : A1203 MET CE :methyl -133:sc= -0.0201 (180deg=-1.46) USER MOD Single : A1204 THR OG1 : rot 90:sc= 1.23 USER MOD Single : A1209 LYS NZ :NH3+ -173:sc= 1.27 (180deg=1.18) USER MOD Single : A1212 THR OG1 : rot 180:sc= 0 USER MOD Single : A1223 CYS SG : rot 170:sc= -0.53 USER MOD ----------------------------------------------------------------- ATOM 117 N VAL A1055 4.092 -1.416 12.727 1.00 1.63 N ATOM 118 CA VAL A1055 4.199 -0.137 12.002 1.00 1.87 C ATOM 119 C VAL A1055 4.822 -0.331 10.612 1.00 1.66 C ATOM 120 O VAL A1055 5.501 -1.326 10.343 1.00 1.82 O ATOM 121 CB VAL A1055 4.997 0.924 12.797 1.00 2.35 C ATOM 122 CG1 VAL A1055 4.309 1.293 14.116 1.00 3.32 C ATOM 123 CG2 VAL A1055 6.435 0.494 13.108 1.00 2.51 C ATOM 0 HA VAL A1055 3.181 0.233 11.882 1.00 1.87 H new ATOM 0 HB VAL A1055 5.029 1.792 12.139 1.00 2.35 H new ATOM 0 HG11 VAL A1055 4.904 2.040 14.640 1.00 3.32 H new ATOM 0 HG12 VAL A1055 3.319 1.698 13.909 1.00 3.32 H new ATOM 0 HG13 VAL A1055 4.214 0.403 14.738 1.00 3.32 H new ATOM 0 HG21 VAL A1055 6.938 1.283 13.667 1.00 2.51 H new ATOM 0 HG22 VAL A1055 6.421 -0.419 13.703 1.00 2.51 H new ATOM 0 HG23 VAL A1055 6.970 0.312 12.176 1.00 2.51 H new ATOM 133 N VAL A1056 4.614 0.638 9.716 1.00 1.49 N ATOM 134 CA VAL A1056 5.270 0.681 8.399 1.00 1.32 C ATOM 135 C VAL A1056 6.768 0.980 8.553 1.00 1.24 C ATOM 136 O VAL A1056 7.159 1.949 9.203 1.00 1.43 O ATOM 137 CB VAL A1056 4.542 1.648 7.440 1.00 1.34 C ATOM 138 CG1 VAL A1056 4.298 3.052 8.011 1.00 1.66 C ATOM 139 CG2 VAL A1056 5.280 1.775 6.105 1.00 1.69 C ATOM 0 H VAL A1056 3.982 1.421 9.882 1.00 1.49 H new ATOM 0 HA VAL A1056 5.197 -0.302 7.934 1.00 1.32 H new ATOM 0 HB VAL A1056 3.564 1.191 7.291 1.00 1.34 H new ATOM 0 HG11 VAL A1056 3.782 3.662 7.269 1.00 1.66 H new ATOM 0 HG12 VAL A1056 3.685 2.978 8.909 1.00 1.66 H new ATOM 0 HG13 VAL A1056 5.253 3.514 8.260 1.00 1.66 H new ATOM 0 HG21 VAL A1056 4.740 2.463 5.455 1.00 1.69 H new ATOM 0 HG22 VAL A1056 6.286 2.156 6.280 1.00 1.69 H new ATOM 0 HG23 VAL A1056 5.340 0.797 5.628 1.00 1.69 H new ATOM 149 N ASN A1057 7.616 0.131 7.968 1.00 1.09 N ATOM 150 CA ASN A1057 9.066 0.120 8.188 1.00 1.08 C ATOM 151 C ASN A1057 9.874 0.625 6.970 1.00 0.98 C ATOM 152 O ASN A1057 10.816 1.396 7.159 1.00 1.03 O ATOM 153 CB ASN A1057 9.429 -1.267 8.757 1.00 1.13 C ATOM 154 CG ASN A1057 10.713 -1.827 8.205 1.00 1.24 C ATOM 155 OD1 ASN A1057 11.781 -1.689 8.777 1.00 1.95 O ATOM 156 ND2 ASN A1057 10.632 -2.451 7.060 1.00 1.99 N ATOM 0 H ASN A1057 7.307 -0.586 7.312 1.00 1.09 H new ATOM 0 HA ASN A1057 9.368 0.858 8.931 1.00 1.08 H new ATOM 0 HB2 ASN A1057 9.510 -1.196 9.842 1.00 1.13 H new ATOM 0 HB3 ASN A1057 8.617 -1.962 8.543 1.00 1.13 H new ATOM 0 HD21 ASN A1057 11.473 -2.834 6.627 1.00 1.99 H new ATOM 0 HD22 ASN A1057 9.728 -2.555 6.599 1.00 1.99 H new ATOM 163 N GLN A1058 9.508 0.246 5.741 1.00 0.90 N ATOM 164 CA GLN A1058 10.070 0.777 4.484 1.00 0.88 C ATOM 165 C GLN A1058 8.993 0.815 3.387 1.00 0.84 C ATOM 166 O GLN A1058 8.201 -0.120 3.276 1.00 0.79 O ATOM 167 CB GLN A1058 11.232 -0.105 3.971 1.00 0.94 C ATOM 168 CG GLN A1058 12.500 -0.209 4.839 1.00 2.19 C ATOM 169 CD GLN A1058 13.378 1.036 4.799 1.00 2.40 C ATOM 170 OE1 GLN A1058 14.396 1.088 4.117 1.00 2.99 O ATOM 171 NE2 GLN A1058 13.047 2.069 5.535 1.00 3.54 N ATOM 0 H GLN A1058 8.790 -0.461 5.583 1.00 0.90 H new ATOM 0 HA GLN A1058 10.436 1.781 4.698 1.00 0.88 H new ATOM 0 HB2 GLN A1058 10.845 -1.113 3.823 1.00 0.94 H new ATOM 0 HB3 GLN A1058 11.528 0.270 2.991 1.00 0.94 H new ATOM 0 HG2 GLN A1058 12.207 -0.403 5.871 1.00 2.19 H new ATOM 0 HG3 GLN A1058 13.086 -1.066 4.508 1.00 2.19 H new ATOM 0 HE21 GLN A1058 12.203 2.038 6.107 1.00 3.54 H new ATOM 0 HE22 GLN A1058 13.634 2.903 5.536 1.00 3.54 H new ATOM 180 N VAL A1059 9.008 1.842 2.532 1.00 0.90 N ATOM 181 CA VAL A1059 8.199 1.943 1.299 1.00 0.89 C ATOM 182 C VAL A1059 9.070 2.217 0.066 1.00 0.98 C ATOM 183 O VAL A1059 10.021 3.007 0.138 1.00 1.13 O ATOM 184 CB VAL A1059 7.086 3.012 1.403 1.00 0.94 C ATOM 185 CG1 VAL A1059 6.087 2.683 2.512 1.00 0.90 C ATOM 186 CG2 VAL A1059 7.598 4.432 1.667 1.00 1.13 C ATOM 0 H VAL A1059 9.602 2.658 2.678 1.00 0.90 H new ATOM 0 HA VAL A1059 7.720 0.971 1.180 1.00 0.89 H new ATOM 0 HB VAL A1059 6.613 2.988 0.421 1.00 0.94 H new ATOM 0 HG11 VAL A1059 5.321 3.457 2.553 1.00 0.90 H new ATOM 0 HG12 VAL A1059 5.619 1.720 2.306 1.00 0.90 H new ATOM 0 HG13 VAL A1059 6.608 2.636 3.469 1.00 0.90 H new ATOM 0 HG21 VAL A1059 6.753 5.118 1.726 1.00 1.13 H new ATOM 0 HG22 VAL A1059 8.147 4.452 2.608 1.00 1.13 H new ATOM 0 HG23 VAL A1059 8.258 4.738 0.855 1.00 1.13 H new ATOM 196 N LYS A1060 8.740 1.584 -1.068 1.00 0.88 N ATOM 197 CA LYS A1060 9.398 1.767 -2.377 1.00 0.93 C ATOM 198 C LYS A1060 8.347 1.902 -3.490 1.00 0.77 C ATOM 199 O LYS A1060 7.442 1.073 -3.579 1.00 0.73 O ATOM 200 CB LYS A1060 10.344 0.578 -2.669 1.00 1.11 C ATOM 201 CG LYS A1060 11.440 0.372 -1.611 1.00 1.25 C ATOM 202 CD LYS A1060 12.451 -0.747 -1.927 1.00 1.18 C ATOM 203 CE LYS A1060 13.480 -0.312 -2.980 1.00 1.21 C ATOM 204 NZ LYS A1060 14.645 -1.231 -3.045 1.00 1.34 N ATOM 0 H LYS A1060 7.980 0.905 -1.104 1.00 0.88 H new ATOM 0 HA LYS A1060 9.988 2.683 -2.347 1.00 0.93 H new ATOM 0 HB2 LYS A1060 9.751 -0.334 -2.745 1.00 1.11 H new ATOM 0 HB3 LYS A1060 10.816 0.733 -3.639 1.00 1.11 H new ATOM 0 HG2 LYS A1060 11.985 1.308 -1.487 1.00 1.25 H new ATOM 0 HG3 LYS A1060 10.964 0.151 -0.655 1.00 1.25 H new ATOM 0 HD2 LYS A1060 12.969 -1.037 -1.013 1.00 1.18 H new ATOM 0 HD3 LYS A1060 11.917 -1.628 -2.284 1.00 1.18 H new ATOM 0 HE2 LYS A1060 13.000 -0.269 -3.958 1.00 1.21 H new ATOM 0 HE3 LYS A1060 13.827 0.695 -2.751 1.00 1.21 H new ATOM 0 HZ1 LYS A1060 15.311 -0.896 -3.770 1.00 1.34 H new ATOM 0 HZ2 LYS A1060 15.121 -1.254 -2.121 1.00 1.34 H new ATOM 0 HZ3 LYS A1060 14.319 -2.188 -3.290 1.00 1.34 H new ATOM 218 N VAL A1061 8.447 2.925 -4.339 1.00 0.75 N ATOM 219 CA VAL A1061 7.544 3.158 -5.487 1.00 0.65 C ATOM 220 C VAL A1061 8.075 2.458 -6.746 1.00 0.62 C ATOM 221 O VAL A1061 9.288 2.327 -6.937 1.00 0.88 O ATOM 222 CB VAL A1061 7.274 4.669 -5.663 1.00 0.77 C ATOM 223 CG1 VAL A1061 6.422 5.022 -6.890 1.00 0.66 C ATOM 224 CG2 VAL A1061 6.516 5.182 -4.429 1.00 1.25 C ATOM 0 H VAL A1061 9.173 3.637 -4.253 1.00 0.75 H new ATOM 0 HA VAL A1061 6.572 2.705 -5.291 1.00 0.65 H new ATOM 0 HB VAL A1061 8.252 5.132 -5.795 1.00 0.77 H new ATOM 0 HG11 VAL A1061 6.281 6.102 -6.937 1.00 0.66 H new ATOM 0 HG12 VAL A1061 6.928 4.682 -7.794 1.00 0.66 H new ATOM 0 HG13 VAL A1061 5.451 4.533 -6.812 1.00 0.66 H new ATOM 0 HG21 VAL A1061 6.319 6.248 -4.540 1.00 1.25 H new ATOM 0 HG22 VAL A1061 5.571 4.646 -4.334 1.00 1.25 H new ATOM 0 HG23 VAL A1061 7.119 5.016 -3.536 1.00 1.25 H new ATOM 234 N LEU A1062 7.155 1.997 -7.599 1.00 0.65 N ATOM 235 CA LEU A1062 7.439 1.082 -8.716 1.00 0.69 C ATOM 236 C LEU A1062 6.810 1.460 -10.074 1.00 0.73 C ATOM 237 O LEU A1062 6.505 0.570 -10.867 1.00 1.22 O ATOM 238 CB LEU A1062 7.057 -0.346 -8.255 1.00 0.72 C ATOM 239 CG LEU A1062 7.977 -1.444 -8.821 1.00 0.87 C ATOM 240 CD1 LEU A1062 9.360 -1.371 -8.171 1.00 1.61 C ATOM 241 CD2 LEU A1062 7.397 -2.824 -8.517 1.00 1.49 C ATOM 0 H LEU A1062 6.170 2.253 -7.533 1.00 0.65 H new ATOM 0 HA LEU A1062 8.504 1.152 -8.938 1.00 0.69 H new ATOM 0 HB2 LEU A1062 7.084 -0.387 -7.166 1.00 0.72 H new ATOM 0 HB3 LEU A1062 6.030 -0.553 -8.556 1.00 0.72 H new ATOM 0 HG LEU A1062 8.056 -1.289 -9.897 1.00 0.87 H new ATOM 0 HD11 LEU A1062 9.997 -2.154 -8.582 1.00 1.61 H new ATOM 0 HD12 LEU A1062 9.806 -0.397 -8.373 1.00 1.61 H new ATOM 0 HD13 LEU A1062 9.264 -1.510 -7.094 1.00 1.61 H new ATOM 0 HD21 LEU A1062 8.055 -3.593 -8.922 1.00 1.49 H new ATOM 0 HD22 LEU A1062 7.310 -2.952 -7.438 1.00 1.49 H new ATOM 0 HD23 LEU A1062 6.411 -2.913 -8.974 1.00 1.49 H new ATOM 253 N THR A1063 6.556 2.746 -10.343 1.00 0.75 N ATOM 254 CA THR A1063 5.841 3.208 -11.557 1.00 0.82 C ATOM 255 C THR A1063 6.341 4.565 -12.121 1.00 1.18 C ATOM 256 O THR A1063 5.801 5.081 -13.104 1.00 2.85 O ATOM 257 CB THR A1063 4.333 3.216 -11.256 1.00 0.82 C ATOM 258 OG1 THR A1063 3.539 3.454 -12.396 1.00 1.28 O ATOM 259 CG2 THR A1063 3.932 4.233 -10.183 1.00 0.73 C ATOM 0 H THR A1063 6.839 3.507 -9.726 1.00 0.75 H new ATOM 0 HA THR A1063 6.059 2.506 -12.362 1.00 0.82 H new ATOM 0 HB THR A1063 4.144 2.208 -10.886 1.00 0.82 H new ATOM 0 HG1 THR A1063 4.059 3.956 -13.058 1.00 1.28 H new ATOM 0 HG21 THR A1063 2.855 4.185 -10.021 1.00 0.73 H new ATOM 0 HG22 THR A1063 4.450 4.003 -9.252 1.00 0.73 H new ATOM 0 HG23 THR A1063 4.205 5.236 -10.512 1.00 0.73 H new ATOM 267 N GLU A1064 7.367 5.169 -11.505 1.00 1.13 N ATOM 268 CA GLU A1064 7.863 6.535 -11.772 1.00 1.28 C ATOM 269 C GLU A1064 6.773 7.633 -11.708 1.00 1.76 C ATOM 270 O GLU A1064 6.406 8.055 -10.609 1.00 3.15 O ATOM 271 CB GLU A1064 8.720 6.595 -13.053 1.00 1.69 C ATOM 272 CG GLU A1064 10.043 5.831 -12.962 1.00 2.32 C ATOM 273 CD GLU A1064 10.861 6.033 -14.241 1.00 3.05 C ATOM 274 OE1 GLU A1064 11.545 7.078 -14.369 1.00 3.39 O ATOM 275 OE2 GLU A1064 10.811 5.174 -15.153 1.00 4.18 O ATOM 0 H GLU A1064 7.901 4.701 -10.773 1.00 1.13 H new ATOM 0 HA GLU A1064 8.525 6.776 -10.940 1.00 1.28 H new ATOM 0 HB2 GLU A1064 8.139 6.195 -13.884 1.00 1.69 H new ATOM 0 HB3 GLU A1064 8.932 7.639 -13.286 1.00 1.69 H new ATOM 0 HG2 GLU A1064 10.612 6.177 -12.099 1.00 2.32 H new ATOM 0 HG3 GLU A1064 9.848 4.769 -12.810 1.00 2.32 H new ATOM 282 N SER A1065 6.286 8.120 -12.857 1.00 1.63 N ATOM 283 CA SER A1065 5.282 9.199 -12.978 1.00 2.09 C ATOM 284 C SER A1065 4.257 8.965 -14.104 1.00 1.83 C ATOM 285 O SER A1065 3.483 9.866 -14.444 1.00 2.31 O ATOM 286 CB SER A1065 5.992 10.545 -13.199 1.00 3.02 C ATOM 287 OG SER A1065 6.649 10.965 -12.018 1.00 3.60 O ATOM 0 H SER A1065 6.588 7.764 -13.764 1.00 1.63 H new ATOM 0 HA SER A1065 4.722 9.206 -12.043 1.00 2.09 H new ATOM 0 HB2 SER A1065 6.715 10.451 -14.009 1.00 3.02 H new ATOM 0 HB3 SER A1065 5.266 11.299 -13.505 1.00 3.02 H new ATOM 0 HG SER A1065 5.986 11.279 -11.368 1.00 3.60 H new ATOM 293 N ASN A1066 4.241 7.766 -14.698 1.00 1.64 N ATOM 294 CA ASN A1066 3.471 7.414 -15.897 1.00 1.74 C ATOM 295 C ASN A1066 1.960 7.697 -15.764 1.00 1.57 C ATOM 296 O ASN A1066 1.379 8.471 -16.533 1.00 1.96 O ATOM 297 CB ASN A1066 3.721 5.920 -16.187 1.00 2.18 C ATOM 298 CG ASN A1066 5.097 5.670 -16.778 1.00 3.21 C ATOM 299 OD1 ASN A1066 5.324 5.926 -17.953 1.00 3.87 O ATOM 300 ND2 ASN A1066 6.066 5.237 -16.004 1.00 4.45 N ATOM 0 H ASN A1066 4.787 6.982 -14.341 1.00 1.64 H new ATOM 0 HA ASN A1066 3.808 8.043 -16.721 1.00 1.74 H new ATOM 0 HB2 ASN A1066 3.616 5.350 -15.264 1.00 2.18 H new ATOM 0 HB3 ASN A1066 2.960 5.554 -16.876 1.00 2.18 H new ATOM 0 HD21 ASN A1066 7.005 5.115 -16.383 1.00 4.45 H new ATOM 0 HD22 ASN A1066 5.879 5.023 -15.024 1.00 4.45 H new ATOM 307 N ARG A1067 1.337 7.064 -14.768 1.00 1.29 N ATOM 308 CA ARG A1067 -0.074 7.196 -14.388 1.00 1.19 C ATOM 309 C ARG A1067 -0.223 8.107 -13.168 1.00 1.08 C ATOM 310 O ARG A1067 -1.026 9.041 -13.201 1.00 1.30 O ATOM 311 CB ARG A1067 -0.651 5.779 -14.164 1.00 1.19 C ATOM 312 CG ARG A1067 -2.141 5.693 -14.530 1.00 2.34 C ATOM 313 CD ARG A1067 -2.652 4.245 -14.610 1.00 3.13 C ATOM 314 NE ARG A1067 -2.005 3.500 -15.711 1.00 3.78 N ATOM 315 CZ ARG A1067 -2.571 2.969 -16.780 1.00 4.70 C ATOM 316 NH1 ARG A1067 -3.861 2.893 -16.946 1.00 5.23 N ATOM 317 NH2 ARG A1067 -1.829 2.480 -17.732 1.00 5.87 N ATOM 0 H ARG A1067 1.833 6.405 -14.168 1.00 1.29 H new ATOM 0 HA ARG A1067 -0.646 7.674 -15.183 1.00 1.19 H new ATOM 0 HB2 ARG A1067 -0.090 5.062 -14.763 1.00 1.19 H new ATOM 0 HB3 ARG A1067 -0.518 5.496 -13.120 1.00 1.19 H new ATOM 0 HG2 ARG A1067 -2.725 6.239 -13.789 1.00 2.34 H new ATOM 0 HG3 ARG A1067 -2.304 6.185 -15.489 1.00 2.34 H new ATOM 0 HD2 ARG A1067 -2.460 3.738 -13.664 1.00 3.13 H new ATOM 0 HD3 ARG A1067 -3.732 4.247 -14.757 1.00 3.13 H new ATOM 0 HE ARG A1067 -0.995 3.381 -15.636 1.00 3.78 H new ATOM 0 HH11 ARG A1067 -4.490 3.255 -16.229 1.00 5.23 H new ATOM 0 HH12 ARG A1067 -4.242 2.472 -17.793 1.00 5.23 H new ATOM 0 HH21 ARG A1067 -0.813 2.507 -17.651 1.00 5.87 H new ATOM 0 HH22 ARG A1067 -2.264 2.070 -18.558 1.00 5.87 H new ATOM 331 N ILE A1068 0.567 7.839 -12.125 1.00 0.90 N ATOM 332 CA ILE A1068 0.589 8.495 -10.805 1.00 0.80 C ATOM 333 C ILE A1068 2.045 8.717 -10.352 1.00 0.76 C ATOM 334 O ILE A1068 2.903 7.878 -10.634 1.00 0.84 O ATOM 335 CB ILE A1068 -0.142 7.670 -9.703 1.00 0.76 C ATOM 336 CG1 ILE A1068 -0.914 6.399 -10.130 1.00 1.21 C ATOM 337 CG2 ILE A1068 -1.017 8.600 -8.847 1.00 1.36 C ATOM 338 CD1 ILE A1068 -2.250 6.628 -10.842 1.00 2.74 C ATOM 0 H ILE A1068 1.266 7.098 -12.181 1.00 0.90 H new ATOM 0 HA ILE A1068 0.063 9.442 -10.925 1.00 0.80 H new ATOM 0 HB ILE A1068 0.675 7.243 -9.122 1.00 0.76 H new ATOM 0 HG12 ILE A1068 -0.272 5.812 -10.787 1.00 1.21 H new ATOM 0 HG13 ILE A1068 -1.098 5.795 -9.241 1.00 1.21 H new ATOM 0 HG21 ILE A1068 -1.525 8.017 -8.079 1.00 1.36 H new ATOM 0 HG22 ILE A1068 -0.390 9.356 -8.374 1.00 1.36 H new ATOM 0 HG23 ILE A1068 -1.757 9.088 -9.481 1.00 1.36 H new ATOM 0 HD11 ILE A1068 -2.698 5.667 -11.092 1.00 2.74 H new ATOM 0 HD12 ILE A1068 -2.922 7.182 -10.186 1.00 2.74 H new ATOM 0 HD13 ILE A1068 -2.082 7.199 -11.755 1.00 2.74 H new ATOM 350 N SER A1069 2.319 9.790 -9.604 1.00 0.80 N ATOM 351 CA SER A1069 3.642 10.075 -9.012 1.00 0.87 C ATOM 352 C SER A1069 3.758 9.675 -7.526 1.00 0.74 C ATOM 353 O SER A1069 2.761 9.442 -6.839 1.00 0.68 O ATOM 354 CB SER A1069 4.034 11.534 -9.266 1.00 1.14 C ATOM 355 OG SER A1069 4.364 11.699 -10.634 1.00 1.84 O ATOM 0 H SER A1069 1.620 10.500 -9.386 1.00 0.80 H new ATOM 0 HA SER A1069 4.364 9.435 -9.519 1.00 0.87 H new ATOM 0 HB2 SER A1069 3.211 12.196 -8.996 1.00 1.14 H new ATOM 0 HB3 SER A1069 4.883 11.809 -8.640 1.00 1.14 H new ATOM 0 HG SER A1069 4.614 12.632 -10.800 1.00 1.84 H new ATOM 361 N HIS A1070 4.996 9.572 -7.028 1.00 0.80 N ATOM 362 CA HIS A1070 5.345 8.963 -5.734 1.00 0.86 C ATOM 363 C HIS A1070 4.673 9.550 -4.475 1.00 0.82 C ATOM 364 O HIS A1070 4.156 8.789 -3.652 1.00 0.83 O ATOM 365 CB HIS A1070 6.880 8.921 -5.597 1.00 1.10 C ATOM 366 CG HIS A1070 7.594 10.234 -5.353 1.00 1.71 C ATOM 367 ND1 HIS A1070 8.608 10.421 -4.440 1.00 2.51 N ATOM 368 CD2 HIS A1070 7.433 11.426 -6.011 1.00 2.70 C ATOM 369 CE1 HIS A1070 9.039 11.686 -4.530 1.00 3.34 C ATOM 370 NE2 HIS A1070 8.368 12.336 -5.498 1.00 3.55 N ATOM 0 H HIS A1070 5.812 9.922 -7.530 1.00 0.80 H new ATOM 0 HA HIS A1070 4.922 7.959 -5.768 1.00 0.86 H new ATOM 0 HB2 HIS A1070 7.127 8.246 -4.777 1.00 1.10 H new ATOM 0 HB3 HIS A1070 7.287 8.480 -6.507 1.00 1.10 H new ATOM 0 HD2 HIS A1070 6.712 11.629 -6.789 1.00 2.70 H new ATOM 0 HE1 HIS A1070 9.813 12.121 -3.915 1.00 3.34 H new ATOM 0 HE2 HIS A1070 8.511 13.300 -5.799 1.00 3.55 H new ATOM 378 N HIS A1071 4.624 10.874 -4.314 1.00 0.84 N ATOM 379 CA HIS A1071 4.007 11.516 -3.147 1.00 0.90 C ATOM 380 C HIS A1071 2.470 11.424 -3.200 1.00 0.80 C ATOM 381 O HIS A1071 1.818 11.229 -2.171 1.00 0.82 O ATOM 382 CB HIS A1071 4.510 12.965 -3.050 1.00 1.06 C ATOM 383 CG HIS A1071 4.186 13.638 -1.739 1.00 1.61 C ATOM 384 ND1 HIS A1071 4.707 13.309 -0.509 1.00 2.99 N ATOM 385 CD2 HIS A1071 3.366 14.719 -1.550 1.00 2.47 C ATOM 386 CE1 HIS A1071 4.208 14.162 0.399 1.00 3.52 C ATOM 387 NE2 HIS A1071 3.392 15.060 -0.189 1.00 3.30 N ATOM 0 H HIS A1071 5.011 11.534 -4.989 1.00 0.84 H new ATOM 0 HA HIS A1071 4.303 10.989 -2.240 1.00 0.90 H new ATOM 0 HB2 HIS A1071 5.590 12.975 -3.195 1.00 1.06 H new ATOM 0 HB3 HIS A1071 4.074 13.546 -3.863 1.00 1.06 H new ATOM 0 HD2 HIS A1071 2.797 15.223 -2.317 1.00 2.47 H new ATOM 0 HE1 HIS A1071 4.430 14.133 1.456 1.00 3.52 H new ATOM 0 HE2 HIS A1071 2.896 15.829 0.262 1.00 3.30 H new ATOM 395 N LYS A1072 1.880 11.454 -4.404 1.00 0.75 N ATOM 396 CA LYS A1072 0.440 11.226 -4.612 1.00 0.72 C ATOM 397 C LYS A1072 0.037 9.782 -4.287 1.00 0.63 C ATOM 398 O LYS A1072 -1.026 9.573 -3.708 1.00 0.65 O ATOM 399 CB LYS A1072 0.055 11.660 -6.038 1.00 0.83 C ATOM 400 CG LYS A1072 -1.473 11.781 -6.208 1.00 1.47 C ATOM 401 CD LYS A1072 -1.917 12.379 -7.556 1.00 2.23 C ATOM 402 CE LYS A1072 -1.316 13.770 -7.790 1.00 2.46 C ATOM 403 NZ LYS A1072 -1.989 14.499 -8.889 1.00 3.33 N ATOM 0 H LYS A1072 2.391 11.638 -5.267 1.00 0.75 H new ATOM 0 HA LYS A1072 -0.127 11.841 -3.913 1.00 0.72 H new ATOM 0 HB2 LYS A1072 0.523 12.618 -6.265 1.00 0.83 H new ATOM 0 HB3 LYS A1072 0.444 10.937 -6.755 1.00 0.83 H new ATOM 0 HG2 LYS A1072 -1.918 10.792 -6.099 1.00 1.47 H new ATOM 0 HG3 LYS A1072 -1.868 12.399 -5.402 1.00 1.47 H new ATOM 0 HD2 LYS A1072 -1.617 11.713 -8.365 1.00 2.23 H new ATOM 0 HD3 LYS A1072 -3.005 12.444 -7.584 1.00 2.23 H new ATOM 0 HE2 LYS A1072 -1.390 14.353 -6.872 1.00 2.46 H new ATOM 0 HE3 LYS A1072 -0.255 13.670 -8.020 1.00 2.46 H new ATOM 0 HZ1 LYS A1072 -1.547 15.433 -9.008 1.00 3.33 H new ATOM 0 HZ2 LYS A1072 -1.897 13.957 -9.772 1.00 3.33 H new ATOM 0 HZ3 LYS A1072 -2.996 14.620 -8.660 1.00 3.33 H new ATOM 417 N ILE A1073 0.903 8.801 -4.567 1.00 0.60 N ATOM 418 CA ILE A1073 0.724 7.400 -4.136 1.00 0.57 C ATOM 419 C ILE A1073 0.730 7.292 -2.600 1.00 0.58 C ATOM 420 O ILE A1073 -0.166 6.664 -2.033 1.00 0.60 O ATOM 421 CB ILE A1073 1.770 6.480 -4.816 1.00 0.59 C ATOM 422 CG1 ILE A1073 1.461 6.366 -6.328 1.00 0.57 C ATOM 423 CG2 ILE A1073 1.792 5.074 -4.183 1.00 0.61 C ATOM 424 CD1 ILE A1073 2.621 5.804 -7.159 1.00 0.64 C ATOM 0 H ILE A1073 1.757 8.954 -5.104 1.00 0.60 H new ATOM 0 HA ILE A1073 -0.255 7.051 -4.463 1.00 0.57 H new ATOM 0 HB ILE A1073 2.753 6.928 -4.670 1.00 0.59 H new ATOM 0 HG12 ILE A1073 0.588 5.728 -6.463 1.00 0.57 H new ATOM 0 HG13 ILE A1073 1.198 7.352 -6.710 1.00 0.57 H new ATOM 0 HG21 ILE A1073 2.538 4.460 -4.687 1.00 0.61 H new ATOM 0 HG22 ILE A1073 2.043 5.155 -3.125 1.00 0.61 H new ATOM 0 HG23 ILE A1073 0.810 4.612 -4.288 1.00 0.61 H new ATOM 0 HD11 ILE A1073 2.327 5.755 -8.207 1.00 0.64 H new ATOM 0 HD12 ILE A1073 3.490 6.453 -7.056 1.00 0.64 H new ATOM 0 HD13 ILE A1073 2.871 4.804 -6.805 1.00 0.64 H new ATOM 436 N LEU A1074 1.679 7.946 -1.914 1.00 0.62 N ATOM 437 CA LEU A1074 1.737 7.984 -0.444 1.00 0.66 C ATOM 438 C LEU A1074 0.467 8.601 0.174 1.00 0.63 C ATOM 439 O LEU A1074 -0.072 8.065 1.148 1.00 0.65 O ATOM 440 CB LEU A1074 3.012 8.745 -0.018 1.00 0.76 C ATOM 441 CG LEU A1074 3.168 8.949 1.502 1.00 0.99 C ATOM 442 CD1 LEU A1074 3.317 7.629 2.262 1.00 2.24 C ATOM 443 CD2 LEU A1074 4.385 9.822 1.791 1.00 1.64 C ATOM 0 H LEU A1074 2.432 8.466 -2.365 1.00 0.62 H new ATOM 0 HA LEU A1074 1.782 6.963 -0.065 1.00 0.66 H new ATOM 0 HB2 LEU A1074 3.882 8.203 -0.388 1.00 0.76 H new ATOM 0 HB3 LEU A1074 3.014 9.721 -0.503 1.00 0.76 H new ATOM 0 HG LEU A1074 2.255 9.435 1.847 1.00 0.99 H new ATOM 0 HD11 LEU A1074 3.423 7.833 3.328 1.00 2.24 H new ATOM 0 HD12 LEU A1074 2.434 7.012 2.097 1.00 2.24 H new ATOM 0 HD13 LEU A1074 4.200 7.101 1.904 1.00 2.24 H new ATOM 0 HD21 LEU A1074 4.486 9.960 2.867 1.00 1.64 H new ATOM 0 HD22 LEU A1074 5.281 9.338 1.401 1.00 1.64 H new ATOM 0 HD23 LEU A1074 4.259 10.792 1.311 1.00 1.64 H new ATOM 455 N ALA A1075 -0.033 9.695 -0.408 1.00 0.63 N ATOM 456 CA ALA A1075 -1.290 10.329 -0.019 1.00 0.65 C ATOM 457 C ALA A1075 -2.483 9.377 -0.185 1.00 0.66 C ATOM 458 O ALA A1075 -3.129 9.062 0.812 1.00 0.69 O ATOM 459 CB ALA A1075 -1.435 11.642 -0.797 1.00 0.71 C ATOM 0 H ALA A1075 0.436 10.172 -1.178 1.00 0.63 H new ATOM 0 HA ALA A1075 -1.277 10.567 1.045 1.00 0.65 H new ATOM 0 HB1 ALA A1075 -2.370 12.129 -0.518 1.00 0.71 H new ATOM 0 HB2 ALA A1075 -0.599 12.300 -0.560 1.00 0.71 H new ATOM 0 HB3 ALA A1075 -1.440 11.432 -1.867 1.00 0.71 H new ATOM 465 N ILE A1076 -2.757 8.840 -1.383 1.00 0.67 N ATOM 466 CA ILE A1076 -3.959 8.004 -1.574 1.00 0.72 C ATOM 467 C ILE A1076 -3.949 6.735 -0.713 1.00 0.71 C ATOM 468 O ILE A1076 -4.998 6.368 -0.187 1.00 0.79 O ATOM 469 CB ILE A1076 -4.267 7.692 -3.054 1.00 0.74 C ATOM 470 CG1 ILE A1076 -3.199 6.814 -3.739 1.00 0.65 C ATOM 471 CG2 ILE A1076 -4.531 9.008 -3.804 1.00 0.86 C ATOM 472 CD1 ILE A1076 -3.473 6.513 -5.220 1.00 0.69 C ATOM 0 H ILE A1076 -2.182 8.963 -2.216 1.00 0.67 H new ATOM 0 HA ILE A1076 -4.785 8.620 -1.218 1.00 0.72 H new ATOM 0 HB ILE A1076 -5.168 7.080 -3.088 1.00 0.74 H new ATOM 0 HG12 ILE A1076 -2.232 7.310 -3.655 1.00 0.65 H new ATOM 0 HG13 ILE A1076 -3.122 5.871 -3.198 1.00 0.65 H new ATOM 0 HG21 ILE A1076 -4.749 8.793 -4.850 1.00 0.86 H new ATOM 0 HG22 ILE A1076 -5.382 9.519 -3.354 1.00 0.86 H new ATOM 0 HG23 ILE A1076 -3.649 9.646 -3.741 1.00 0.86 H new ATOM 0 HD11 ILE A1076 -2.672 5.891 -5.619 1.00 0.69 H new ATOM 0 HD12 ILE A1076 -4.423 5.987 -5.315 1.00 0.69 H new ATOM 0 HD13 ILE A1076 -3.519 7.448 -5.779 1.00 0.69 H new ATOM 484 N VAL A1077 -2.786 6.111 -0.493 1.00 0.67 N ATOM 485 CA VAL A1077 -2.651 4.965 0.424 1.00 0.71 C ATOM 486 C VAL A1077 -2.942 5.381 1.870 1.00 0.70 C ATOM 487 O VAL A1077 -3.798 4.783 2.522 1.00 0.83 O ATOM 488 CB VAL A1077 -1.260 4.312 0.274 1.00 0.75 C ATOM 489 CG1 VAL A1077 -0.963 3.265 1.354 1.00 0.88 C ATOM 490 CG2 VAL A1077 -1.144 3.610 -1.086 1.00 0.80 C ATOM 0 H VAL A1077 -1.912 6.383 -0.943 1.00 0.67 H new ATOM 0 HA VAL A1077 -3.394 4.214 0.155 1.00 0.71 H new ATOM 0 HB VAL A1077 -0.542 5.127 0.370 1.00 0.75 H new ATOM 0 HG11 VAL A1077 0.030 2.845 1.191 1.00 0.88 H new ATOM 0 HG12 VAL A1077 -1.001 3.735 2.337 1.00 0.88 H new ATOM 0 HG13 VAL A1077 -1.706 2.469 1.304 1.00 0.88 H new ATOM 0 HG21 VAL A1077 -0.158 3.154 -1.177 1.00 0.80 H new ATOM 0 HG22 VAL A1077 -1.909 2.838 -1.163 1.00 0.80 H new ATOM 0 HG23 VAL A1077 -1.282 4.339 -1.885 1.00 0.80 H new ATOM 500 N GLY A1078 -2.284 6.426 2.382 1.00 0.61 N ATOM 501 CA GLY A1078 -2.426 6.818 3.792 1.00 0.58 C ATOM 502 C GLY A1078 -3.764 7.471 4.137 1.00 0.62 C ATOM 503 O GLY A1078 -4.231 7.369 5.271 1.00 0.80 O ATOM 0 H GLY A1078 -1.649 7.016 1.844 1.00 0.61 H new ATOM 0 HA2 GLY A1078 -2.296 5.934 4.416 1.00 0.58 H new ATOM 0 HA3 GLY A1078 -1.623 7.509 4.046 1.00 0.58 H new ATOM 507 N THR A1079 -4.396 8.123 3.167 1.00 0.61 N ATOM 508 CA THR A1079 -5.769 8.649 3.280 1.00 0.72 C ATOM 509 C THR A1079 -6.852 7.571 3.092 1.00 0.80 C ATOM 510 O THR A1079 -7.927 7.700 3.675 1.00 0.96 O ATOM 511 CB THR A1079 -6.006 9.894 2.400 1.00 0.83 C ATOM 512 OG1 THR A1079 -4.925 10.803 2.445 1.00 1.29 O ATOM 513 CG2 THR A1079 -7.170 10.713 2.885 1.00 1.04 C ATOM 0 H THR A1079 -3.968 8.309 2.260 1.00 0.61 H new ATOM 0 HA THR A1079 -5.868 8.985 4.312 1.00 0.72 H new ATOM 0 HB THR A1079 -6.162 9.483 1.403 1.00 0.83 H new ATOM 0 HG1 THR A1079 -4.165 10.433 1.949 1.00 1.29 H new ATOM 0 HG21 THR A1079 -7.301 11.579 2.237 1.00 1.04 H new ATOM 0 HG22 THR A1079 -8.075 10.106 2.866 1.00 1.04 H new ATOM 0 HG23 THR A1079 -6.979 11.048 3.904 1.00 1.04 H new ATOM 521 N ALA A1080 -6.587 6.474 2.370 1.00 0.76 N ATOM 522 CA ALA A1080 -7.490 5.314 2.330 1.00 0.82 C ATOM 523 C ALA A1080 -7.431 4.491 3.633 1.00 0.86 C ATOM 524 O ALA A1080 -8.465 4.147 4.202 1.00 1.02 O ATOM 525 CB ALA A1080 -7.167 4.455 1.102 1.00 0.88 C ATOM 0 H ALA A1080 -5.748 6.365 1.801 1.00 0.76 H new ATOM 0 HA ALA A1080 -8.515 5.676 2.246 1.00 0.82 H new ATOM 0 HB1 ALA A1080 -7.837 3.595 1.073 1.00 0.88 H new ATOM 0 HB2 ALA A1080 -7.299 5.049 0.198 1.00 0.88 H new ATOM 0 HB3 ALA A1080 -6.135 4.109 1.161 1.00 0.88 H new ATOM 531 N GLU A1081 -6.232 4.267 4.176 1.00 0.89 N ATOM 532 CA GLU A1081 -6.000 3.577 5.461 1.00 0.99 C ATOM 533 C GLU A1081 -6.360 4.445 6.692 1.00 1.04 C ATOM 534 O GLU A1081 -6.149 4.041 7.834 1.00 1.30 O ATOM 535 CB GLU A1081 -4.539 3.090 5.504 1.00 1.17 C ATOM 536 CG GLU A1081 -4.234 1.968 4.491 1.00 1.85 C ATOM 537 CD GLU A1081 -4.637 0.571 4.990 1.00 1.95 C ATOM 538 OE1 GLU A1081 -5.735 0.414 5.575 1.00 2.44 O ATOM 539 OE2 GLU A1081 -3.839 -0.375 4.812 1.00 2.80 O ATOM 0 H GLU A1081 -5.367 4.567 3.726 1.00 0.89 H new ATOM 0 HA GLU A1081 -6.672 2.721 5.518 1.00 0.99 H new ATOM 0 HB2 GLU A1081 -3.877 3.934 5.309 1.00 1.17 H new ATOM 0 HB3 GLU A1081 -4.313 2.733 6.509 1.00 1.17 H new ATOM 0 HG2 GLU A1081 -4.758 2.178 3.558 1.00 1.85 H new ATOM 0 HG3 GLU A1081 -3.168 1.972 4.265 1.00 1.85 H new ATOM 546 N SER A1082 -6.965 5.623 6.485 1.00 0.95 N ATOM 547 CA SER A1082 -7.546 6.493 7.525 1.00 1.03 C ATOM 548 C SER A1082 -8.872 5.957 8.111 1.00 1.13 C ATOM 549 O SER A1082 -9.442 6.562 9.021 1.00 1.34 O ATOM 550 CB SER A1082 -7.742 7.892 6.923 1.00 1.12 C ATOM 551 OG SER A1082 -8.034 8.871 7.906 1.00 1.62 O ATOM 0 H SER A1082 -7.069 6.015 5.549 1.00 0.95 H new ATOM 0 HA SER A1082 -6.853 6.523 8.366 1.00 1.03 H new ATOM 0 HB2 SER A1082 -6.840 8.181 6.384 1.00 1.12 H new ATOM 0 HB3 SER A1082 -8.552 7.860 6.195 1.00 1.12 H new ATOM 0 HG SER A1082 -8.494 8.449 8.662 1.00 1.62 H new ATOM 557 N ASN A1083 -9.371 4.834 7.588 1.00 1.19 N ATOM 558 CA ASN A1083 -10.671 4.222 7.882 1.00 1.44 C ATOM 559 C ASN A1083 -10.756 3.593 9.308 1.00 1.55 C ATOM 560 O ASN A1083 -9.937 3.860 10.190 1.00 2.51 O ATOM 561 CB ASN A1083 -10.905 3.245 6.700 1.00 2.12 C ATOM 562 CG ASN A1083 -12.325 2.746 6.499 1.00 2.83 C ATOM 563 OD1 ASN A1083 -13.259 3.112 7.198 1.00 3.20 O ATOM 564 ND2 ASN A1083 -12.521 1.872 5.545 1.00 3.67 N ATOM 0 H ASN A1083 -8.844 4.292 6.903 1.00 1.19 H new ATOM 0 HA ASN A1083 -11.479 4.952 7.940 1.00 1.44 H new ATOM 0 HB2 ASN A1083 -10.584 3.738 5.782 1.00 2.12 H new ATOM 0 HB3 ASN A1083 -10.257 2.380 6.840 1.00 2.12 H new ATOM 0 HD21 ASN A1083 -13.455 1.494 5.383 1.00 3.67 H new ATOM 0 HD22 ASN A1083 -11.740 1.568 4.963 1.00 3.67 H new ATOM 571 N SER A1084 -11.779 2.771 9.554 1.00 1.60 N ATOM 572 CA SER A1084 -12.073 2.087 10.824 1.00 2.13 C ATOM 573 C SER A1084 -11.855 0.576 10.700 1.00 2.12 C ATOM 574 O SER A1084 -12.781 -0.222 10.846 1.00 3.00 O ATOM 575 CB SER A1084 -13.500 2.415 11.274 1.00 3.16 C ATOM 576 OG SER A1084 -13.614 3.808 11.515 1.00 3.78 O ATOM 0 H SER A1084 -12.466 2.550 8.833 1.00 1.60 H new ATOM 0 HA SER A1084 -11.382 2.448 11.586 1.00 2.13 H new ATOM 0 HB2 SER A1084 -14.213 2.108 10.509 1.00 3.16 H new ATOM 0 HB3 SER A1084 -13.744 1.858 12.179 1.00 3.16 H new ATOM 0 HG SER A1084 -14.528 4.017 11.801 1.00 3.78 H new ATOM 582 N GLU A1085 -10.641 0.175 10.325 1.00 1.69 N ATOM 583 CA GLU A1085 -10.293 -1.215 10.003 1.00 2.09 C ATOM 584 C GLU A1085 -9.676 -1.952 11.199 1.00 2.16 C ATOM 585 O GLU A1085 -10.374 -2.706 11.885 1.00 2.79 O ATOM 586 CB GLU A1085 -9.456 -1.335 8.705 1.00 2.57 C ATOM 587 CG GLU A1085 -8.727 -0.065 8.232 1.00 2.84 C ATOM 588 CD GLU A1085 -7.655 0.334 9.243 1.00 4.23 C ATOM 589 OE1 GLU A1085 -6.662 -0.421 9.359 1.00 5.29 O ATOM 590 OE2 GLU A1085 -7.898 1.282 10.027 1.00 4.97 O ATOM 0 H GLU A1085 -9.854 0.817 10.234 1.00 1.69 H new ATOM 0 HA GLU A1085 -11.229 -1.731 9.790 1.00 2.09 H new ATOM 0 HB2 GLU A1085 -8.713 -2.119 8.851 1.00 2.57 H new ATOM 0 HB3 GLU A1085 -10.117 -1.666 7.904 1.00 2.57 H new ATOM 0 HG2 GLU A1085 -8.271 -0.240 7.257 1.00 2.84 H new ATOM 0 HG3 GLU A1085 -9.442 0.749 8.108 1.00 2.84 H new ATOM 597 N HIS A1086 -8.363 -1.809 11.393 1.00 1.90 N ATOM 598 CA HIS A1086 -7.567 -2.569 12.351 1.00 2.12 C ATOM 599 C HIS A1086 -6.352 -1.751 12.872 1.00 1.72 C ATOM 600 O HIS A1086 -6.149 -0.621 12.419 1.00 1.59 O ATOM 601 CB HIS A1086 -7.225 -3.911 11.672 1.00 2.84 C ATOM 602 CG HIS A1086 -6.055 -3.938 10.726 1.00 2.61 C ATOM 603 ND1 HIS A1086 -5.595 -2.914 9.930 1.00 3.60 N ATOM 604 CD2 HIS A1086 -5.329 -5.053 10.403 1.00 3.20 C ATOM 605 CE1 HIS A1086 -4.626 -3.408 9.144 1.00 4.63 C ATOM 606 NE2 HIS A1086 -4.409 -4.703 9.415 1.00 4.41 N ATOM 0 H HIS A1086 -7.807 -1.135 10.866 1.00 1.90 H new ATOM 0 HA HIS A1086 -8.118 -2.782 13.267 1.00 2.12 H new ATOM 0 HB2 HIS A1086 -7.040 -4.646 12.456 1.00 2.84 H new ATOM 0 HB3 HIS A1086 -8.107 -4.244 11.125 1.00 2.84 H new ATOM 0 HD1 HIS A1086 -5.931 -1.951 9.936 1.00 3.60 H new ATOM 0 HD2 HIS A1086 -5.448 -6.034 10.838 1.00 3.20 H new ATOM 0 HE1 HIS A1086 -4.094 -2.840 8.395 1.00 4.63 H new ATOM 614 N PRO A1087 -5.511 -2.260 13.797 1.00 1.77 N ATOM 615 CA PRO A1087 -4.405 -1.487 14.394 1.00 1.76 C ATOM 616 C PRO A1087 -3.236 -1.104 13.479 1.00 1.60 C ATOM 617 O PRO A1087 -2.301 -0.449 13.949 1.00 1.85 O ATOM 618 CB PRO A1087 -3.928 -2.309 15.601 1.00 2.09 C ATOM 619 CG PRO A1087 -5.136 -3.176 15.949 1.00 2.36 C ATOM 620 CD PRO A1087 -5.722 -3.474 14.572 1.00 2.11 C ATOM 0 HA PRO A1087 -4.798 -0.505 14.656 1.00 1.76 H new ATOM 0 HB2 PRO A1087 -3.057 -2.916 15.353 1.00 2.09 H new ATOM 0 HB3 PRO A1087 -3.642 -1.667 16.435 1.00 2.09 H new ATOM 0 HG2 PRO A1087 -4.847 -4.086 16.475 1.00 2.36 H new ATOM 0 HG3 PRO A1087 -5.845 -2.650 16.589 1.00 2.36 H new ATOM 0 HD2 PRO A1087 -5.227 -4.328 14.109 1.00 2.11 H new ATOM 0 HD3 PRO A1087 -6.782 -3.719 14.640 1.00 2.11 H new ATOM 628 N LEU A1088 -3.230 -1.537 12.213 1.00 1.46 N ATOM 629 CA LEU A1088 -2.207 -1.149 11.239 1.00 1.41 C ATOM 630 C LEU A1088 -2.489 0.119 10.411 1.00 1.24 C ATOM 631 O LEU A1088 -1.555 0.879 10.153 1.00 1.25 O ATOM 632 CB LEU A1088 -1.808 -2.368 10.390 1.00 1.49 C ATOM 633 CG LEU A1088 -0.384 -2.858 10.681 1.00 1.56 C ATOM 634 CD1 LEU A1088 -0.094 -4.089 9.824 1.00 2.21 C ATOM 635 CD2 LEU A1088 0.653 -1.764 10.411 1.00 2.82 C ATOM 0 H LEU A1088 -3.937 -2.168 11.836 1.00 1.46 H new ATOM 0 HA LEU A1088 -1.347 -0.825 11.826 1.00 1.41 H new ATOM 0 HB2 LEU A1088 -2.511 -3.180 10.576 1.00 1.49 H new ATOM 0 HB3 LEU A1088 -1.890 -2.111 9.334 1.00 1.49 H new ATOM 0 HG LEU A1088 -0.314 -3.118 11.737 1.00 1.56 H new ATOM 0 HD11 LEU A1088 0.917 -4.443 10.026 1.00 2.21 H new ATOM 0 HD12 LEU A1088 -0.809 -4.876 10.064 1.00 2.21 H new ATOM 0 HD13 LEU A1088 -0.183 -3.827 8.770 1.00 2.21 H new ATOM 0 HD21 LEU A1088 1.650 -2.147 10.628 1.00 2.82 H new ATOM 0 HD22 LEU A1088 0.600 -1.462 9.365 1.00 2.82 H new ATOM 0 HD23 LEU A1088 0.448 -0.903 11.048 1.00 2.82 H new ATOM 647 N GLY A1089 -3.739 0.379 10.006 1.00 1.15 N ATOM 648 CA GLY A1089 -4.067 1.530 9.147 1.00 1.04 C ATOM 649 C GLY A1089 -3.694 2.866 9.794 1.00 0.99 C ATOM 650 O GLY A1089 -3.096 3.737 9.160 1.00 0.91 O ATOM 0 H GLY A1089 -4.544 -0.193 10.259 1.00 1.15 H new ATOM 0 HA2 GLY A1089 -3.543 1.431 8.196 1.00 1.04 H new ATOM 0 HA3 GLY A1089 -5.134 1.522 8.925 1.00 1.04 H new ATOM 654 N THR A1090 -3.905 2.967 11.109 1.00 1.09 N ATOM 655 CA THR A1090 -3.494 4.110 11.938 1.00 1.14 C ATOM 656 C THR A1090 -1.992 4.416 11.837 1.00 1.10 C ATOM 657 O THR A1090 -1.609 5.584 11.790 1.00 1.09 O ATOM 658 CB THR A1090 -3.869 3.875 13.411 1.00 1.38 C ATOM 659 OG1 THR A1090 -3.312 2.668 13.884 1.00 2.00 O ATOM 660 CG2 THR A1090 -5.381 3.797 13.617 1.00 2.22 C ATOM 0 H THR A1090 -4.379 2.239 11.643 1.00 1.09 H new ATOM 0 HA THR A1090 -4.032 4.975 11.550 1.00 1.14 H new ATOM 0 HB THR A1090 -3.472 4.727 13.962 1.00 1.38 H new ATOM 0 HG1 THR A1090 -3.561 2.538 14.823 1.00 2.00 H new ATOM 0 HG21 THR A1090 -5.596 3.630 14.672 1.00 2.22 H new ATOM 0 HG22 THR A1090 -5.841 4.732 13.296 1.00 2.22 H new ATOM 0 HG23 THR A1090 -5.786 2.973 13.029 1.00 2.22 H new ATOM 668 N ALA A1091 -1.134 3.396 11.727 1.00 1.10 N ATOM 669 CA ALA A1091 0.315 3.571 11.575 1.00 1.10 C ATOM 670 C ALA A1091 0.705 4.109 10.184 1.00 0.96 C ATOM 671 O ALA A1091 1.631 4.922 10.079 1.00 0.96 O ATOM 672 CB ALA A1091 1.025 2.248 11.881 1.00 1.19 C ATOM 0 H ALA A1091 -1.427 2.419 11.741 1.00 1.10 H new ATOM 0 HA ALA A1091 0.639 4.327 12.290 1.00 1.10 H new ATOM 0 HB1 ALA A1091 2.101 2.378 11.768 1.00 1.19 H new ATOM 0 HB2 ALA A1091 0.802 1.943 12.903 1.00 1.19 H new ATOM 0 HB3 ALA A1091 0.678 1.480 11.189 1.00 1.19 H new ATOM 678 N ILE A1092 -0.015 3.697 9.131 1.00 0.88 N ATOM 679 CA ILE A1092 0.151 4.204 7.758 1.00 0.80 C ATOM 680 C ILE A1092 -0.334 5.653 7.674 1.00 0.77 C ATOM 681 O ILE A1092 0.397 6.514 7.178 1.00 0.77 O ATOM 682 CB ILE A1092 -0.591 3.312 6.730 1.00 0.82 C ATOM 683 CG1 ILE A1092 -0.007 1.880 6.749 1.00 0.98 C ATOM 684 CG2 ILE A1092 -0.525 3.910 5.304 1.00 0.87 C ATOM 685 CD1 ILE A1092 -0.788 0.882 5.890 1.00 1.04 C ATOM 0 H ILE A1092 -0.744 2.988 9.210 1.00 0.88 H new ATOM 0 HA ILE A1092 1.211 4.172 7.508 1.00 0.80 H new ATOM 0 HB ILE A1092 -1.642 3.270 7.017 1.00 0.82 H new ATOM 0 HG12 ILE A1092 1.025 1.914 6.401 1.00 0.98 H new ATOM 0 HG13 ILE A1092 0.015 1.520 7.778 1.00 0.98 H new ATOM 0 HG21 ILE A1092 -1.056 3.257 4.611 1.00 0.87 H new ATOM 0 HG22 ILE A1092 -0.989 4.896 5.301 1.00 0.87 H new ATOM 0 HG23 ILE A1092 0.516 3.998 4.994 1.00 0.87 H new ATOM 0 HD11 ILE A1092 -0.318 -0.099 5.954 1.00 1.04 H new ATOM 0 HD12 ILE A1092 -1.815 0.817 6.251 1.00 1.04 H new ATOM 0 HD13 ILE A1092 -0.788 1.217 4.853 1.00 1.04 H new ATOM 697 N THR A1093 -1.541 5.946 8.173 1.00 0.79 N ATOM 698 CA THR A1093 -2.105 7.300 8.100 1.00 0.83 C ATOM 699 C THR A1093 -1.249 8.288 8.900 1.00 0.85 C ATOM 700 O THR A1093 -0.916 9.344 8.368 1.00 0.87 O ATOM 701 CB THR A1093 -3.606 7.313 8.455 1.00 0.96 C ATOM 702 OG1 THR A1093 -4.247 8.375 7.789 1.00 2.17 O ATOM 703 CG2 THR A1093 -3.929 7.463 9.936 1.00 1.47 C ATOM 0 H THR A1093 -2.146 5.264 8.631 1.00 0.79 H new ATOM 0 HA THR A1093 -2.066 7.646 7.067 1.00 0.83 H new ATOM 0 HB THR A1093 -3.962 6.331 8.142 1.00 0.96 H new ATOM 0 HG1 THR A1093 -4.322 8.165 6.835 1.00 2.17 H new ATOM 0 HG21 THR A1093 -5.010 7.460 10.075 1.00 1.47 H new ATOM 0 HG22 THR A1093 -3.490 6.633 10.490 1.00 1.47 H new ATOM 0 HG23 THR A1093 -3.518 8.403 10.305 1.00 1.47 H new ATOM 711 N LYS A1094 -0.757 7.916 10.098 1.00 0.89 N ATOM 712 CA LYS A1094 0.231 8.712 10.854 1.00 0.95 C ATOM 713 C LYS A1094 1.534 8.943 10.082 1.00 0.93 C ATOM 714 O LYS A1094 1.946 10.091 9.972 1.00 1.04 O ATOM 715 CB LYS A1094 0.521 8.067 12.223 1.00 1.07 C ATOM 716 CG LYS A1094 -0.526 8.471 13.276 1.00 1.38 C ATOM 717 CD LYS A1094 -0.293 7.788 14.635 1.00 1.86 C ATOM 718 CE LYS A1094 -0.719 6.316 14.589 1.00 3.23 C ATOM 719 NZ LYS A1094 -0.128 5.521 15.686 1.00 3.81 N ATOM 0 H LYS A1094 -1.033 7.055 10.569 1.00 0.89 H new ATOM 0 HA LYS A1094 -0.219 9.693 11.009 1.00 0.95 H new ATOM 0 HB2 LYS A1094 0.532 6.982 12.119 1.00 1.07 H new ATOM 0 HB3 LYS A1094 1.513 8.365 12.563 1.00 1.07 H new ATOM 0 HG2 LYS A1094 -0.504 9.553 13.409 1.00 1.38 H new ATOM 0 HG3 LYS A1094 -1.521 8.215 12.911 1.00 1.38 H new ATOM 0 HD2 LYS A1094 0.761 7.857 14.905 1.00 1.86 H new ATOM 0 HD3 LYS A1094 -0.856 8.309 15.409 1.00 1.86 H new ATOM 0 HE2 LYS A1094 -1.806 6.254 14.644 1.00 3.23 H new ATOM 0 HE3 LYS A1094 -0.423 5.885 13.632 1.00 3.23 H new ATOM 0 HZ1 LYS A1094 -0.447 4.534 15.610 1.00 3.81 H new ATOM 0 HZ2 LYS A1094 0.909 5.556 15.620 1.00 3.81 H new ATOM 0 HZ3 LYS A1094 -0.430 5.913 16.601 1.00 3.81 H new ATOM 733 N TYR A1095 2.144 7.910 9.492 1.00 0.85 N ATOM 734 CA TYR A1095 3.390 8.055 8.715 1.00 0.83 C ATOM 735 C TYR A1095 3.227 9.026 7.534 1.00 0.77 C ATOM 736 O TYR A1095 4.045 9.937 7.370 1.00 0.79 O ATOM 737 CB TYR A1095 3.860 6.671 8.230 1.00 0.88 C ATOM 738 CG TYR A1095 4.901 6.687 7.118 1.00 1.05 C ATOM 739 CD1 TYR A1095 6.113 7.386 7.285 1.00 1.40 C ATOM 740 CD2 TYR A1095 4.646 6.025 5.900 1.00 2.46 C ATOM 741 CE1 TYR A1095 7.049 7.450 6.236 1.00 1.51 C ATOM 742 CE2 TYR A1095 5.603 6.044 4.867 1.00 2.70 C ATOM 743 CZ TYR A1095 6.805 6.765 5.029 1.00 1.62 C ATOM 744 OH TYR A1095 7.721 6.789 4.025 1.00 1.97 O ATOM 0 H TYR A1095 1.794 6.953 9.536 1.00 0.85 H new ATOM 0 HA TYR A1095 4.149 8.485 9.369 1.00 0.83 H new ATOM 0 HB2 TYR A1095 4.270 6.127 9.081 1.00 0.88 H new ATOM 0 HB3 TYR A1095 2.991 6.112 7.883 1.00 0.88 H new ATOM 0 HD1 TYR A1095 6.325 7.876 8.224 1.00 1.40 H new ATOM 0 HD2 TYR A1095 3.712 5.501 5.758 1.00 2.46 H new ATOM 0 HE1 TYR A1095 7.955 8.025 6.356 1.00 1.51 H new ATOM 0 HE2 TYR A1095 5.417 5.506 3.949 1.00 2.70 H new ATOM 0 HH TYR A1095 8.620 6.878 4.405 1.00 1.97 H new ATOM 754 N CYS A1096 2.140 8.882 6.766 1.00 0.73 N ATOM 755 CA CYS A1096 1.797 9.788 5.669 1.00 0.70 C ATOM 756 C CYS A1096 1.549 11.215 6.182 1.00 0.71 C ATOM 757 O CYS A1096 2.222 12.148 5.747 1.00 0.74 O ATOM 758 CB CYS A1096 0.588 9.204 4.924 1.00 0.76 C ATOM 759 SG CYS A1096 0.113 10.282 3.545 1.00 2.67 S ATOM 0 H CYS A1096 1.469 8.125 6.892 1.00 0.73 H new ATOM 0 HA CYS A1096 2.630 9.870 4.971 1.00 0.70 H new ATOM 0 HB2 CYS A1096 0.829 8.209 4.550 1.00 0.76 H new ATOM 0 HB3 CYS A1096 -0.251 9.091 5.611 1.00 0.76 H new ATOM 0 HG CYS A1096 -0.055 9.566 2.473 1.00 2.67 H new ATOM 765 N LYS A1097 0.662 11.391 7.172 1.00 0.76 N ATOM 766 CA LYS A1097 0.316 12.700 7.752 1.00 0.86 C ATOM 767 C LYS A1097 1.536 13.432 8.325 1.00 0.89 C ATOM 768 O LYS A1097 1.636 14.645 8.172 1.00 0.99 O ATOM 769 CB LYS A1097 -0.746 12.488 8.846 1.00 1.00 C ATOM 770 CG LYS A1097 -1.455 13.792 9.230 1.00 1.34 C ATOM 771 CD LYS A1097 -2.046 13.784 10.643 1.00 2.22 C ATOM 772 CE LYS A1097 -2.941 12.568 10.903 1.00 3.62 C ATOM 773 NZ LYS A1097 -3.583 12.660 12.229 1.00 4.70 N ATOM 0 H LYS A1097 0.156 10.616 7.600 1.00 0.76 H new ATOM 0 HA LYS A1097 -0.076 13.333 6.956 1.00 0.86 H new ATOM 0 HB2 LYS A1097 -1.484 11.765 8.498 1.00 1.00 H new ATOM 0 HB3 LYS A1097 -0.273 12.060 9.730 1.00 1.00 H new ATOM 0 HG2 LYS A1097 -0.747 14.617 9.147 1.00 1.34 H new ATOM 0 HG3 LYS A1097 -2.254 13.984 8.514 1.00 1.34 H new ATOM 0 HD2 LYS A1097 -1.235 13.796 11.371 1.00 2.22 H new ATOM 0 HD3 LYS A1097 -2.625 14.695 10.796 1.00 2.22 H new ATOM 0 HE2 LYS A1097 -3.705 12.502 10.128 1.00 3.62 H new ATOM 0 HE3 LYS A1097 -2.348 11.656 10.844 1.00 3.62 H new ATOM 0 HZ1 LYS A1097 -4.184 11.825 12.382 1.00 4.70 H new ATOM 0 HZ2 LYS A1097 -2.851 12.700 12.967 1.00 4.70 H new ATOM 0 HZ3 LYS A1097 -4.167 13.520 12.273 1.00 4.70 H new ATOM 787 N GLN A1098 2.476 12.703 8.924 1.00 0.87 N ATOM 788 CA GLN A1098 3.757 13.216 9.424 1.00 0.93 C ATOM 789 C GLN A1098 4.706 13.643 8.294 1.00 0.88 C ATOM 790 O GLN A1098 5.464 14.596 8.464 1.00 1.00 O ATOM 791 CB GLN A1098 4.397 12.126 10.300 1.00 1.01 C ATOM 792 CG GLN A1098 3.717 12.025 11.662 1.00 2.19 C ATOM 793 CD GLN A1098 3.988 10.712 12.388 1.00 3.69 C ATOM 794 OE1 GLN A1098 4.822 9.892 12.012 1.00 4.32 O ATOM 795 NE2 GLN A1098 3.285 10.453 13.465 1.00 4.90 N ATOM 0 H GLN A1098 2.365 11.701 9.082 1.00 0.87 H new ATOM 0 HA GLN A1098 3.571 14.117 10.009 1.00 0.93 H new ATOM 0 HB2 GLN A1098 4.334 11.165 9.789 1.00 1.01 H new ATOM 0 HB3 GLN A1098 5.456 12.345 10.437 1.00 1.01 H new ATOM 0 HG2 GLN A1098 4.053 12.852 12.288 1.00 2.19 H new ATOM 0 HG3 GLN A1098 2.641 12.142 11.530 1.00 2.19 H new ATOM 0 HE21 GLN A1098 2.588 11.122 13.792 1.00 4.90 H new ATOM 0 HE22 GLN A1098 3.435 9.583 13.975 1.00 4.90 H new ATOM 804 N GLU A1099 4.645 13.001 7.124 1.00 0.79 N ATOM 805 CA GLU A1099 5.369 13.433 5.922 1.00 0.81 C ATOM 806 C GLU A1099 4.724 14.687 5.284 1.00 0.91 C ATOM 807 O GLU A1099 5.438 15.549 4.767 1.00 1.08 O ATOM 808 CB GLU A1099 5.449 12.257 4.927 1.00 0.84 C ATOM 809 CG GLU A1099 6.720 12.264 4.058 1.00 1.28 C ATOM 810 CD GLU A1099 7.962 11.648 4.731 1.00 1.62 C ATOM 811 OE1 GLU A1099 8.034 11.527 5.982 1.00 2.32 O ATOM 812 OE2 GLU A1099 8.919 11.294 3.996 1.00 2.32 O ATOM 0 H GLU A1099 4.087 12.159 6.982 1.00 0.79 H new ATOM 0 HA GLU A1099 6.381 13.724 6.203 1.00 0.81 H new ATOM 0 HB2 GLU A1099 5.405 11.320 5.482 1.00 0.84 H new ATOM 0 HB3 GLU A1099 4.575 12.284 4.276 1.00 0.84 H new ATOM 0 HG2 GLU A1099 6.516 11.721 3.135 1.00 1.28 H new ATOM 0 HG3 GLU A1099 6.947 13.293 3.779 1.00 1.28 H new ATOM 819 N LEU A1100 3.394 14.852 5.367 1.00 0.91 N ATOM 820 CA LEU A1100 2.680 16.090 4.989 1.00 1.09 C ATOM 821 C LEU A1100 2.849 17.227 6.016 1.00 1.24 C ATOM 822 O LEU A1100 2.711 18.409 5.690 1.00 1.46 O ATOM 823 CB LEU A1100 1.161 15.817 4.879 1.00 1.15 C ATOM 824 CG LEU A1100 0.680 14.662 3.986 1.00 1.07 C ATOM 825 CD1 LEU A1100 -0.843 14.684 3.863 1.00 1.24 C ATOM 826 CD2 LEU A1100 1.284 14.730 2.597 1.00 1.30 C ATOM 0 H LEU A1100 2.771 14.118 5.704 1.00 0.91 H new ATOM 0 HA LEU A1100 3.115 16.399 4.038 1.00 1.09 H new ATOM 0 HB2 LEU A1100 0.784 15.635 5.886 1.00 1.15 H new ATOM 0 HB3 LEU A1100 0.686 16.731 4.521 1.00 1.15 H new ATOM 0 HG LEU A1100 1.006 13.736 4.461 1.00 1.07 H new ATOM 0 HD11 LEU A1100 -1.169 13.860 3.228 1.00 1.24 H new ATOM 0 HD12 LEU A1100 -1.289 14.578 4.852 1.00 1.24 H new ATOM 0 HD13 LEU A1100 -1.159 15.629 3.422 1.00 1.24 H new ATOM 0 HD21 LEU A1100 0.917 13.895 2.000 1.00 1.30 H new ATOM 0 HD22 LEU A1100 0.999 15.669 2.122 1.00 1.30 H new ATOM 0 HD23 LEU A1100 2.370 14.675 2.669 1.00 1.30 H new ATOM 838 N ASP A1101 3.077 16.850 7.274 1.00 1.23 N ATOM 839 CA ASP A1101 3.029 17.693 8.469 1.00 1.46 C ATOM 840 C ASP A1101 1.693 18.465 8.609 1.00 1.46 C ATOM 841 O ASP A1101 1.658 19.638 8.991 1.00 1.53 O ATOM 842 CB ASP A1101 4.314 18.525 8.577 1.00 1.76 C ATOM 843 CG ASP A1101 4.493 19.174 9.946 1.00 2.21 C ATOM 844 OD1 ASP A1101 4.061 18.606 10.981 1.00 3.75 O ATOM 845 OD2 ASP A1101 5.083 20.279 9.997 1.00 2.16 O ATOM 0 H ASP A1101 3.316 15.885 7.500 1.00 1.23 H new ATOM 0 HA ASP A1101 3.018 17.063 9.359 1.00 1.46 H new ATOM 0 HB2 ASP A1101 5.172 17.886 8.369 1.00 1.76 H new ATOM 0 HB3 ASP A1101 4.302 19.301 7.812 1.00 1.76 H new ATOM 850 N THR A1102 0.583 17.805 8.254 1.00 1.44 N ATOM 851 CA THR A1102 -0.809 18.295 8.404 1.00 1.58 C ATOM 852 C THR A1102 -1.501 17.779 9.669 1.00 1.84 C ATOM 853 O THR A1102 -1.011 16.874 10.346 1.00 2.32 O ATOM 854 CB THR A1102 -1.629 17.945 7.150 1.00 1.84 C ATOM 855 OG1 THR A1102 -2.822 18.691 7.112 1.00 2.05 O ATOM 856 CG2 THR A1102 -2.039 16.480 7.019 1.00 2.34 C ATOM 0 H THR A1102 0.623 16.875 7.836 1.00 1.44 H new ATOM 0 HA THR A1102 -0.753 19.378 8.513 1.00 1.58 H new ATOM 0 HB THR A1102 -0.949 18.180 6.331 1.00 1.84 H new ATOM 0 HG1 THR A1102 -3.520 18.169 6.664 1.00 2.05 H new ATOM 0 HG21 THR A1102 -2.612 16.343 6.102 1.00 2.34 H new ATOM 0 HG22 THR A1102 -1.147 15.854 6.987 1.00 2.34 H new ATOM 0 HG23 THR A1102 -2.651 16.196 7.875 1.00 2.34 H new ATOM 864 N GLU A1103 -2.664 18.348 9.976 1.00 1.73 N ATOM 865 CA GLU A1103 -3.627 17.827 10.960 1.00 1.97 C ATOM 866 C GLU A1103 -5.020 17.573 10.326 1.00 2.06 C ATOM 867 O GLU A1103 -5.964 17.221 11.033 1.00 2.34 O ATOM 868 CB GLU A1103 -3.629 18.661 12.262 1.00 2.21 C ATOM 869 CG GLU A1103 -3.894 20.163 12.095 1.00 2.40 C ATOM 870 CD GLU A1103 -4.070 20.873 13.454 1.00 2.77 C ATOM 871 OE1 GLU A1103 -5.148 20.754 14.089 1.00 3.23 O ATOM 872 OE2 GLU A1103 -3.149 21.609 13.887 1.00 3.28 O ATOM 0 H GLU A1103 -2.978 19.213 9.536 1.00 1.73 H new ATOM 0 HA GLU A1103 -3.295 16.839 11.278 1.00 1.97 H new ATOM 0 HB2 GLU A1103 -4.384 18.251 12.932 1.00 2.21 H new ATOM 0 HB3 GLU A1103 -2.664 18.534 12.753 1.00 2.21 H new ATOM 0 HG2 GLU A1103 -3.066 20.619 11.552 1.00 2.40 H new ATOM 0 HG3 GLU A1103 -4.790 20.308 11.491 1.00 2.40 H new ATOM 879 N THR A1104 -5.147 17.698 8.993 1.00 1.94 N ATOM 880 CA THR A1104 -6.405 17.532 8.226 1.00 2.09 C ATOM 881 C THR A1104 -6.193 16.909 6.831 1.00 1.81 C ATOM 882 O THR A1104 -5.422 17.427 6.013 1.00 2.11 O ATOM 883 CB THR A1104 -7.140 18.883 8.129 1.00 2.52 C ATOM 884 OG1 THR A1104 -8.325 18.782 7.363 1.00 3.11 O ATOM 885 CG2 THR A1104 -6.296 20.027 7.547 1.00 2.05 C ATOM 0 H THR A1104 -4.352 17.925 8.395 1.00 1.94 H new ATOM 0 HA THR A1104 -7.024 16.821 8.773 1.00 2.09 H new ATOM 0 HB THR A1104 -7.368 19.129 9.166 1.00 2.52 H new ATOM 0 HG1 THR A1104 -8.765 19.657 7.325 1.00 3.11 H new ATOM 0 HG21 THR A1104 -6.892 20.939 7.515 1.00 2.05 H new ATOM 0 HG22 THR A1104 -5.419 20.188 8.174 1.00 2.05 H new ATOM 0 HG23 THR A1104 -5.977 19.767 6.538 1.00 2.05 H new ATOM 893 N LEU A1105 -6.872 15.788 6.541 1.00 1.52 N ATOM 894 CA LEU A1105 -6.898 15.121 5.220 1.00 1.25 C ATOM 895 C LEU A1105 -8.110 14.174 5.041 1.00 1.15 C ATOM 896 O LEU A1105 -8.720 13.748 6.027 1.00 1.42 O ATOM 897 CB LEU A1105 -5.556 14.400 4.949 1.00 1.07 C ATOM 898 CG LEU A1105 -5.299 13.048 5.641 1.00 1.35 C ATOM 899 CD1 LEU A1105 -3.885 12.583 5.297 1.00 1.23 C ATOM 900 CD2 LEU A1105 -5.426 13.081 7.160 1.00 2.11 C ATOM 0 H LEU A1105 -7.437 15.302 7.238 1.00 1.52 H new ATOM 0 HA LEU A1105 -7.025 15.902 4.470 1.00 1.25 H new ATOM 0 HB2 LEU A1105 -5.474 14.243 3.873 1.00 1.07 H new ATOM 0 HB3 LEU A1105 -4.751 15.078 5.234 1.00 1.07 H new ATOM 0 HG LEU A1105 -6.069 12.370 5.274 1.00 1.35 H new ATOM 0 HD11 LEU A1105 -3.689 11.626 5.781 1.00 1.23 H new ATOM 0 HD12 LEU A1105 -3.792 12.470 4.217 1.00 1.23 H new ATOM 0 HD13 LEU A1105 -3.164 13.321 5.648 1.00 1.23 H new ATOM 0 HD21 LEU A1105 -5.229 12.088 7.563 1.00 2.11 H new ATOM 0 HD22 LEU A1105 -4.705 13.789 7.570 1.00 2.11 H new ATOM 0 HD23 LEU A1105 -6.435 13.390 7.434 1.00 2.11 H new ATOM 912 N GLY A1106 -8.441 13.801 3.795 1.00 1.11 N ATOM 913 CA GLY A1106 -9.490 12.806 3.489 1.00 1.19 C ATOM 914 C GLY A1106 -9.971 12.698 2.032 1.00 1.35 C ATOM 915 O GLY A1106 -10.001 13.687 1.298 1.00 1.86 O ATOM 0 H GLY A1106 -7.988 14.181 2.964 1.00 1.11 H new ATOM 0 HA2 GLY A1106 -9.122 11.826 3.794 1.00 1.19 H new ATOM 0 HA3 GLY A1106 -10.356 13.029 4.112 1.00 1.19 H new ATOM 919 N THR A1107 -10.373 11.487 1.633 1.00 1.17 N ATOM 920 CA THR A1107 -10.852 11.071 0.310 1.00 1.36 C ATOM 921 C THR A1107 -11.938 9.999 0.476 1.00 1.26 C ATOM 922 O THR A1107 -11.847 9.161 1.382 1.00 1.19 O ATOM 923 CB THR A1107 -9.711 10.466 -0.529 1.00 1.51 C ATOM 924 OG1 THR A1107 -8.993 9.487 0.194 1.00 1.43 O ATOM 925 CG2 THR A1107 -8.687 11.502 -0.988 1.00 1.82 C ATOM 0 H THR A1107 -10.371 10.703 2.285 1.00 1.17 H new ATOM 0 HA THR A1107 -11.245 11.952 -0.197 1.00 1.36 H new ATOM 0 HB THR A1107 -10.212 10.033 -1.395 1.00 1.51 H new ATOM 0 HG1 THR A1107 -8.278 9.123 -0.369 1.00 1.43 H new ATOM 0 HG21 THR A1107 -7.910 11.011 -1.574 1.00 1.82 H new ATOM 0 HG22 THR A1107 -9.182 12.256 -1.601 1.00 1.82 H new ATOM 0 HG23 THR A1107 -8.237 11.980 -0.117 1.00 1.82 H new ATOM 933 N CYS A1108 -12.956 9.998 -0.389 1.00 1.41 N ATOM 934 CA CYS A1108 -14.014 8.976 -0.403 1.00 1.41 C ATOM 935 C CYS A1108 -13.479 7.647 -0.972 1.00 1.16 C ATOM 936 O CYS A1108 -12.659 7.675 -1.892 1.00 1.12 O ATOM 937 CB CYS A1108 -15.246 9.491 -1.165 1.00 1.70 C ATOM 938 SG CYS A1108 -15.743 11.137 -0.579 1.00 2.50 S ATOM 0 H CYS A1108 -13.073 10.712 -1.108 1.00 1.41 H new ATOM 0 HA CYS A1108 -14.331 8.775 0.620 1.00 1.41 H new ATOM 0 HB2 CYS A1108 -15.025 9.534 -2.232 1.00 1.70 H new ATOM 0 HB3 CYS A1108 -16.073 8.792 -1.038 1.00 1.70 H new ATOM 0 HG CYS A1108 -16.784 11.539 -1.246 1.00 2.50 H new ATOM 944 N ILE A1109 -13.905 6.504 -0.419 1.00 1.08 N ATOM 945 CA ILE A1109 -13.350 5.165 -0.650 1.00 0.86 C ATOM 946 C ILE A1109 -14.443 4.083 -0.651 1.00 0.89 C ATOM 947 O ILE A1109 -15.076 3.815 0.372 1.00 0.93 O ATOM 948 CB ILE A1109 -12.258 4.828 0.405 1.00 0.73 C ATOM 949 CG1 ILE A1109 -12.631 5.238 1.855 1.00 1.56 C ATOM 950 CG2 ILE A1109 -10.922 5.462 -0.013 1.00 1.38 C ATOM 951 CD1 ILE A1109 -11.660 4.736 2.930 1.00 1.53 C ATOM 0 H ILE A1109 -14.687 6.488 0.236 1.00 1.08 H new ATOM 0 HA ILE A1109 -12.892 5.174 -1.639 1.00 0.86 H new ATOM 0 HB ILE A1109 -12.169 3.742 0.425 1.00 0.73 H new ATOM 0 HG12 ILE A1109 -12.682 6.325 1.909 1.00 1.56 H new ATOM 0 HG13 ILE A1109 -13.628 4.860 2.080 1.00 1.56 H new ATOM 0 HG21 ILE A1109 -10.159 5.224 0.728 1.00 1.38 H new ATOM 0 HG22 ILE A1109 -10.620 5.068 -0.984 1.00 1.38 H new ATOM 0 HG23 ILE A1109 -11.038 6.544 -0.080 1.00 1.38 H new ATOM 0 HD11 ILE A1109 -11.999 5.069 3.911 1.00 1.53 H new ATOM 0 HD12 ILE A1109 -11.625 3.647 2.909 1.00 1.53 H new ATOM 0 HD13 ILE A1109 -10.664 5.134 2.736 1.00 1.53 H new ATOM 963 N ASP A1110 -14.615 3.362 -1.764 1.00 0.99 N ATOM 964 CA ASP A1110 -15.485 2.170 -1.818 1.00 1.05 C ATOM 965 C ASP A1110 -14.714 0.917 -1.335 1.00 0.96 C ATOM 966 O ASP A1110 -14.406 0.009 -2.108 1.00 0.86 O ATOM 967 CB ASP A1110 -16.130 2.040 -3.210 1.00 1.12 C ATOM 968 CG ASP A1110 -17.314 1.063 -3.225 1.00 1.29 C ATOM 969 OD1 ASP A1110 -18.211 1.164 -2.347 1.00 2.21 O ATOM 970 OD2 ASP A1110 -17.378 0.213 -4.146 1.00 2.02 O ATOM 0 H ASP A1110 -14.161 3.582 -2.650 1.00 0.99 H new ATOM 0 HA ASP A1110 -16.319 2.278 -1.124 1.00 1.05 H new ATOM 0 HB2 ASP A1110 -16.470 3.021 -3.542 1.00 1.12 H new ATOM 0 HB3 ASP A1110 -15.378 1.705 -3.924 1.00 1.12 H new ATOM 975 N PHE A1111 -14.319 0.942 -0.058 1.00 1.09 N ATOM 976 CA PHE A1111 -13.366 0.050 0.622 1.00 1.07 C ATOM 977 C PHE A1111 -13.895 -1.355 0.949 1.00 1.05 C ATOM 978 O PHE A1111 -15.015 -1.531 1.431 1.00 1.22 O ATOM 979 CB PHE A1111 -12.929 0.796 1.896 1.00 1.31 C ATOM 980 CG PHE A1111 -11.612 0.416 2.553 1.00 1.31 C ATOM 981 CD1 PHE A1111 -10.434 1.097 2.187 1.00 2.34 C ATOM 982 CD2 PHE A1111 -11.588 -0.468 3.650 1.00 1.44 C ATOM 983 CE1 PHE A1111 -9.260 0.941 2.942 1.00 2.38 C ATOM 984 CE2 PHE A1111 -10.412 -0.615 4.409 1.00 1.56 C ATOM 985 CZ PHE A1111 -9.252 0.100 4.065 1.00 1.52 C ATOM 0 H PHE A1111 -14.687 1.645 0.583 1.00 1.09 H new ATOM 0 HA PHE A1111 -12.537 -0.156 -0.055 1.00 1.07 H new ATOM 0 HB2 PHE A1111 -12.884 1.858 1.657 1.00 1.31 H new ATOM 0 HB3 PHE A1111 -13.717 0.670 2.639 1.00 1.31 H new ATOM 0 HD1 PHE A1111 -10.434 1.742 1.321 1.00 2.34 H new ATOM 0 HD2 PHE A1111 -12.472 -1.033 3.908 1.00 1.44 H new ATOM 0 HE1 PHE A1111 -8.362 1.469 2.658 1.00 2.38 H new ATOM 0 HE2 PHE A1111 -10.401 -1.280 5.260 1.00 1.56 H new ATOM 0 HZ PHE A1111 -8.358 0.002 4.663 1.00 1.52 H new ATOM 995 N GLN A1112 -13.059 -2.360 0.705 1.00 1.01 N ATOM 996 CA GLN A1112 -13.347 -3.791 0.774 1.00 1.06 C ATOM 997 C GLN A1112 -12.136 -4.538 1.366 1.00 1.13 C ATOM 998 O GLN A1112 -11.028 -4.375 0.861 1.00 1.03 O ATOM 999 CB GLN A1112 -13.648 -4.222 -0.670 1.00 1.06 C ATOM 1000 CG GLN A1112 -13.592 -5.729 -0.889 1.00 2.25 C ATOM 1001 CD GLN A1112 -14.426 -6.121 -2.098 1.00 2.85 C ATOM 1002 OE1 GLN A1112 -14.206 -5.676 -3.222 1.00 3.82 O ATOM 1003 NE2 GLN A1112 -15.472 -6.885 -1.896 1.00 3.72 N ATOM 0 H GLN A1112 -12.092 -2.184 0.434 1.00 1.01 H new ATOM 0 HA GLN A1112 -14.193 -4.021 1.422 1.00 1.06 H new ATOM 0 HB2 GLN A1112 -14.638 -3.861 -0.948 1.00 1.06 H new ATOM 0 HB3 GLN A1112 -12.934 -3.741 -1.339 1.00 1.06 H new ATOM 0 HG2 GLN A1112 -12.559 -6.043 -1.035 1.00 2.25 H new ATOM 0 HG3 GLN A1112 -13.960 -6.245 -0.003 1.00 2.25 H new ATOM 0 HE21 GLN A1112 -15.660 -7.257 -0.965 1.00 3.72 H new ATOM 0 HE22 GLN A1112 -16.098 -7.107 -2.670 1.00 3.72 H new ATOM 1012 N VAL A1113 -12.335 -5.368 2.397 1.00 1.39 N ATOM 1013 CA VAL A1113 -11.253 -6.027 3.165 1.00 1.52 C ATOM 1014 C VAL A1113 -11.375 -7.559 3.164 1.00 1.72 C ATOM 1015 O VAL A1113 -12.442 -8.110 3.455 1.00 1.92 O ATOM 1016 CB VAL A1113 -11.221 -5.489 4.616 1.00 1.81 C ATOM 1017 CG1 VAL A1113 -10.087 -6.101 5.448 1.00 2.04 C ATOM 1018 CG2 VAL A1113 -11.030 -3.968 4.655 1.00 1.78 C ATOM 0 H VAL A1113 -13.267 -5.610 2.733 1.00 1.39 H new ATOM 0 HA VAL A1113 -10.314 -5.784 2.667 1.00 1.52 H new ATOM 0 HB VAL A1113 -12.186 -5.770 5.039 1.00 1.81 H new ATOM 0 HG11 VAL A1113 -10.112 -5.688 6.456 1.00 2.04 H new ATOM 0 HG12 VAL A1113 -10.213 -7.183 5.495 1.00 2.04 H new ATOM 0 HG13 VAL A1113 -9.129 -5.868 4.984 1.00 2.04 H new ATOM 0 HG21 VAL A1113 -11.013 -3.630 5.691 1.00 1.78 H new ATOM 0 HG22 VAL A1113 -10.088 -3.707 4.173 1.00 1.78 H new ATOM 0 HG23 VAL A1113 -11.853 -3.484 4.129 1.00 1.78 H new ATOM 1028 N VAL A1114 -10.259 -8.248 2.889 1.00 1.73 N ATOM 1029 CA VAL A1114 -10.105 -9.712 2.996 1.00 2.05 C ATOM 1030 C VAL A1114 -8.861 -10.054 3.837 1.00 2.10 C ATOM 1031 O VAL A1114 -7.746 -10.016 3.301 1.00 1.65 O ATOM 1032 CB VAL A1114 -10.030 -10.380 1.607 1.00 1.97 C ATOM 1033 CG1 VAL A1114 -9.976 -11.909 1.739 1.00 2.73 C ATOM 1034 CG2 VAL A1114 -11.246 -10.040 0.740 1.00 2.62 C ATOM 0 H VAL A1114 -9.405 -7.787 2.574 1.00 1.73 H new ATOM 0 HA VAL A1114 -10.988 -10.108 3.497 1.00 2.05 H new ATOM 0 HB VAL A1114 -9.124 -9.998 1.136 1.00 1.97 H new ATOM 0 HG11 VAL A1114 -9.924 -12.358 0.747 1.00 2.73 H new ATOM 0 HG12 VAL A1114 -9.094 -12.194 2.313 1.00 2.73 H new ATOM 0 HG13 VAL A1114 -10.872 -12.262 2.250 1.00 2.73 H new ATOM 0 HG21 VAL A1114 -11.151 -10.531 -0.228 1.00 2.62 H new ATOM 0 HG22 VAL A1114 -12.154 -10.386 1.235 1.00 2.62 H new ATOM 0 HG23 VAL A1114 -11.300 -8.961 0.596 1.00 2.62 H new ATOM 1044 N PRO A1115 -9.012 -10.393 5.135 1.00 2.71 N ATOM 1045 CA PRO A1115 -7.885 -10.648 6.032 1.00 2.87 C ATOM 1046 C PRO A1115 -7.206 -11.985 5.695 1.00 2.51 C ATOM 1047 O PRO A1115 -7.714 -13.071 5.995 1.00 3.17 O ATOM 1048 CB PRO A1115 -8.467 -10.588 7.446 1.00 3.91 C ATOM 1049 CG PRO A1115 -9.912 -11.032 7.259 1.00 3.44 C ATOM 1050 CD PRO A1115 -10.268 -10.494 5.872 1.00 3.26 C ATOM 0 HA PRO A1115 -7.089 -9.911 5.929 1.00 2.87 H new ATOM 0 HB2 PRO A1115 -7.930 -11.247 8.128 1.00 3.91 H new ATOM 0 HB3 PRO A1115 -8.407 -9.582 7.862 1.00 3.91 H new ATOM 0 HG2 PRO A1115 -10.009 -12.117 7.307 1.00 3.44 H new ATOM 0 HG3 PRO A1115 -10.563 -10.619 8.030 1.00 3.44 H new ATOM 0 HD2 PRO A1115 -10.964 -11.161 5.364 1.00 3.26 H new ATOM 0 HD3 PRO A1115 -10.755 -9.521 5.946 1.00 3.26 H new ATOM 1058 N GLY A1116 -6.056 -11.892 5.029 1.00 1.97 N ATOM 1059 CA GLY A1116 -5.292 -13.008 4.461 1.00 1.73 C ATOM 1060 C GLY A1116 -4.934 -12.816 2.979 1.00 1.46 C ATOM 1061 O GLY A1116 -4.129 -13.587 2.445 1.00 1.73 O ATOM 0 H GLY A1116 -5.607 -10.992 4.861 1.00 1.97 H new ATOM 0 HA2 GLY A1116 -4.374 -13.138 5.034 1.00 1.73 H new ATOM 0 HA3 GLY A1116 -5.869 -13.926 4.571 1.00 1.73 H new ATOM 1065 N CYS A1117 -5.510 -11.802 2.321 1.00 1.28 N ATOM 1066 CA CYS A1117 -5.305 -11.495 0.900 1.00 1.17 C ATOM 1067 C CYS A1117 -4.963 -10.014 0.663 1.00 1.02 C ATOM 1068 O CYS A1117 -4.002 -9.726 -0.054 1.00 0.90 O ATOM 1069 CB CYS A1117 -6.560 -11.890 0.108 1.00 1.45 C ATOM 1070 SG CYS A1117 -6.854 -13.682 0.190 1.00 1.85 S ATOM 0 H CYS A1117 -6.151 -11.153 2.777 1.00 1.28 H new ATOM 0 HA CYS A1117 -4.449 -12.074 0.553 1.00 1.17 H new ATOM 0 HB2 CYS A1117 -7.425 -11.359 0.504 1.00 1.45 H new ATOM 0 HB3 CYS A1117 -6.447 -11.585 -0.932 1.00 1.45 H new ATOM 0 HG CYS A1117 -7.923 -13.978 -0.488 1.00 1.85 H new ATOM 1076 N GLY A1118 -5.724 -9.084 1.253 1.00 1.11 N ATOM 1077 CA GLY A1118 -5.516 -7.644 1.084 1.00 1.11 C ATOM 1078 C GLY A1118 -6.786 -6.795 1.194 1.00 1.12 C ATOM 1079 O GLY A1118 -7.743 -7.155 1.887 1.00 1.35 O ATOM 0 H GLY A1118 -6.507 -9.313 1.865 1.00 1.11 H new ATOM 0 HA2 GLY A1118 -4.802 -7.304 1.834 1.00 1.11 H new ATOM 0 HA3 GLY A1118 -5.062 -7.469 0.109 1.00 1.11 H new ATOM 1083 N ILE A1119 -6.759 -5.641 0.528 1.00 0.92 N ATOM 1084 CA ILE A1119 -7.774 -4.580 0.514 1.00 0.91 C ATOM 1085 C ILE A1119 -7.980 -4.110 -0.938 1.00 0.75 C ATOM 1086 O ILE A1119 -7.028 -4.031 -1.717 1.00 0.74 O ATOM 1087 CB ILE A1119 -7.357 -3.403 1.437 1.00 0.99 C ATOM 1088 CG1 ILE A1119 -6.998 -3.911 2.856 1.00 1.25 C ATOM 1089 CG2 ILE A1119 -8.449 -2.319 1.511 1.00 1.01 C ATOM 1090 CD1 ILE A1119 -6.569 -2.822 3.844 1.00 2.19 C ATOM 0 H ILE A1119 -5.964 -5.402 -0.064 1.00 0.92 H new ATOM 0 HA ILE A1119 -8.716 -4.969 0.901 1.00 0.91 H new ATOM 0 HB ILE A1119 -6.469 -2.948 0.997 1.00 0.99 H new ATOM 0 HG12 ILE A1119 -7.861 -4.434 3.267 1.00 1.25 H new ATOM 0 HG13 ILE A1119 -6.193 -4.641 2.771 1.00 1.25 H new ATOM 0 HG21 ILE A1119 -8.118 -1.513 2.167 1.00 1.01 H new ATOM 0 HG22 ILE A1119 -8.635 -1.922 0.513 1.00 1.01 H new ATOM 0 HG23 ILE A1119 -9.367 -2.754 1.906 1.00 1.01 H new ATOM 0 HD11 ILE A1119 -6.339 -3.276 4.808 1.00 2.19 H new ATOM 0 HD12 ILE A1119 -5.684 -2.312 3.462 1.00 2.19 H new ATOM 0 HD13 ILE A1119 -7.378 -2.102 3.966 1.00 2.19 H new ATOM 1102 N SER A1120 -9.214 -3.749 -1.291 1.00 0.95 N ATOM 1103 CA SER A1120 -9.576 -3.081 -2.550 1.00 0.83 C ATOM 1104 C SER A1120 -10.389 -1.827 -2.236 1.00 0.85 C ATOM 1105 O SER A1120 -11.208 -1.837 -1.319 1.00 1.04 O ATOM 1106 CB SER A1120 -10.404 -4.013 -3.442 1.00 0.89 C ATOM 1107 OG SER A1120 -10.715 -3.383 -4.673 1.00 1.39 O ATOM 0 H SER A1120 -10.020 -3.918 -0.690 1.00 0.95 H new ATOM 0 HA SER A1120 -8.662 -2.814 -3.081 1.00 0.83 H new ATOM 0 HB2 SER A1120 -9.850 -4.933 -3.628 1.00 0.89 H new ATOM 0 HB3 SER A1120 -11.324 -4.293 -2.929 1.00 0.89 H new ATOM 0 HG SER A1120 -11.242 -3.994 -5.229 1.00 1.39 H new ATOM 1113 N CYS A1121 -10.173 -0.725 -2.949 1.00 0.72 N ATOM 1114 CA CYS A1121 -11.052 0.442 -2.885 1.00 0.75 C ATOM 1115 C CYS A1121 -11.173 1.159 -4.238 1.00 0.67 C ATOM 1116 O CYS A1121 -10.383 0.913 -5.157 1.00 0.60 O ATOM 1117 CB CYS A1121 -10.577 1.374 -1.755 1.00 1.02 C ATOM 1118 SG CYS A1121 -9.071 2.271 -2.220 1.00 1.27 S ATOM 0 H CYS A1121 -9.385 -0.614 -3.587 1.00 0.72 H new ATOM 0 HA CYS A1121 -12.063 0.108 -2.653 1.00 0.75 H new ATOM 0 HB2 CYS A1121 -11.366 2.086 -1.514 1.00 1.02 H new ATOM 0 HB3 CYS A1121 -10.390 0.789 -0.854 1.00 1.02 H new ATOM 0 HG CYS A1121 -8.707 3.045 -1.241 1.00 1.27 H new ATOM 1124 N LYS A1122 -12.149 2.069 -4.352 1.00 0.81 N ATOM 1125 CA LYS A1122 -12.201 3.044 -5.451 1.00 0.94 C ATOM 1126 C LYS A1122 -12.098 4.394 -4.745 1.00 1.05 C ATOM 1127 O LYS A1122 -12.971 4.679 -3.924 1.00 1.51 O ATOM 1128 CB LYS A1122 -13.508 2.918 -6.267 1.00 1.14 C ATOM 1129 CG LYS A1122 -13.826 1.535 -6.868 1.00 1.37 C ATOM 1130 CD LYS A1122 -12.781 1.050 -7.883 1.00 1.49 C ATOM 1131 CE LYS A1122 -13.220 -0.221 -8.626 1.00 1.87 C ATOM 1132 NZ LYS A1122 -14.291 0.037 -9.615 1.00 2.70 N ATOM 0 H LYS A1122 -12.921 2.151 -3.690 1.00 0.81 H new ATOM 0 HA LYS A1122 -11.406 2.895 -6.181 1.00 0.94 H new ATOM 0 HB2 LYS A1122 -14.339 3.207 -5.623 1.00 1.14 H new ATOM 0 HB3 LYS A1122 -13.470 3.641 -7.082 1.00 1.14 H new ATOM 0 HG2 LYS A1122 -13.902 0.806 -6.061 1.00 1.37 H new ATOM 0 HG3 LYS A1122 -14.801 1.575 -7.354 1.00 1.37 H new ATOM 0 HD2 LYS A1122 -12.590 1.842 -8.608 1.00 1.49 H new ATOM 0 HD3 LYS A1122 -11.841 0.857 -7.366 1.00 1.49 H new ATOM 0 HE2 LYS A1122 -12.359 -0.656 -9.134 1.00 1.87 H new ATOM 0 HE3 LYS A1122 -13.569 -0.958 -7.902 1.00 1.87 H new ATOM 0 HZ1 LYS A1122 -14.538 -0.850 -10.099 1.00 2.70 H new ATOM 0 HZ2 LYS A1122 -15.131 0.411 -9.128 1.00 2.70 H new ATOM 0 HZ3 LYS A1122 -13.958 0.732 -10.314 1.00 2.70 H new ATOM 1146 N VAL A1123 -11.075 5.201 -5.024 1.00 0.86 N ATOM 1147 CA VAL A1123 -10.743 6.411 -4.244 1.00 0.85 C ATOM 1148 C VAL A1123 -10.926 7.676 -5.075 1.00 0.98 C ATOM 1149 O VAL A1123 -10.646 7.669 -6.269 1.00 1.06 O ATOM 1150 CB VAL A1123 -9.350 6.303 -3.588 1.00 0.76 C ATOM 1151 CG1 VAL A1123 -8.193 6.281 -4.588 1.00 1.26 C ATOM 1152 CG2 VAL A1123 -9.086 7.431 -2.583 1.00 1.02 C ATOM 0 H VAL A1123 -10.441 5.038 -5.806 1.00 0.86 H new ATOM 0 HA VAL A1123 -11.452 6.486 -3.420 1.00 0.85 H new ATOM 0 HB VAL A1123 -9.382 5.342 -3.074 1.00 0.76 H new ATOM 0 HG11 VAL A1123 -7.248 6.204 -4.050 1.00 1.26 H new ATOM 0 HG12 VAL A1123 -8.303 5.424 -5.253 1.00 1.26 H new ATOM 0 HG13 VAL A1123 -8.202 7.199 -5.175 1.00 1.26 H new ATOM 0 HG21 VAL A1123 -8.093 7.308 -2.151 1.00 1.02 H new ATOM 0 HG22 VAL A1123 -9.143 8.393 -3.092 1.00 1.02 H new ATOM 0 HG23 VAL A1123 -9.834 7.395 -1.791 1.00 1.02 H new ATOM 1162 N THR A1124 -11.415 8.761 -4.474 1.00 1.08 N ATOM 1163 CA THR A1124 -11.769 9.991 -5.211 1.00 1.26 C ATOM 1164 C THR A1124 -11.606 11.231 -4.326 1.00 1.33 C ATOM 1165 O THR A1124 -11.100 11.124 -3.213 1.00 1.29 O ATOM 1166 CB THR A1124 -13.175 9.844 -5.817 1.00 1.42 C ATOM 1167 OG1 THR A1124 -13.455 10.919 -6.689 1.00 1.57 O ATOM 1168 CG2 THR A1124 -14.275 9.753 -4.769 1.00 1.46 C ATOM 0 H THR A1124 -11.579 8.820 -3.469 1.00 1.08 H new ATOM 0 HA THR A1124 -11.078 10.136 -6.041 1.00 1.26 H new ATOM 0 HB THR A1124 -13.167 8.903 -6.366 1.00 1.42 H new ATOM 0 HG1 THR A1124 -12.625 11.219 -7.116 1.00 1.57 H new ATOM 0 HG21 THR A1124 -15.241 9.651 -5.263 1.00 1.46 H new ATOM 0 HG22 THR A1124 -14.100 8.886 -4.132 1.00 1.46 H new ATOM 0 HG23 THR A1124 -14.273 10.657 -4.160 1.00 1.46 H new ATOM 1176 N ASN A1125 -11.992 12.415 -4.810 1.00 1.55 N ATOM 1177 CA ASN A1125 -11.678 13.721 -4.206 1.00 1.76 C ATOM 1178 C ASN A1125 -10.168 14.055 -4.267 1.00 1.99 C ATOM 1179 O ASN A1125 -9.669 14.897 -3.517 1.00 2.25 O ATOM 1180 CB ASN A1125 -12.357 13.892 -2.818 1.00 1.76 C ATOM 1181 CG ASN A1125 -13.809 14.338 -2.888 1.00 2.49 C ATOM 1182 OD1 ASN A1125 -14.414 14.494 -3.943 1.00 3.37 O ATOM 1183 ND2 ASN A1125 -14.426 14.542 -1.752 1.00 2.64 N ATOM 0 H ASN A1125 -12.550 12.498 -5.660 1.00 1.55 H new ATOM 0 HA ASN A1125 -12.130 14.499 -4.821 1.00 1.76 H new ATOM 0 HB2 ASN A1125 -12.304 12.945 -2.281 1.00 1.76 H new ATOM 0 HB3 ASN A1125 -11.792 14.620 -2.236 1.00 1.76 H new ATOM 0 HD21 ASN A1125 -15.405 14.829 -1.748 1.00 2.64 H new ATOM 0 HD22 ASN A1125 -13.928 14.414 -0.871 1.00 2.64 H new ATOM 1951 N GLN A1177 -11.682 9.658 -10.148 1.00 1.73 N ATOM 1952 CA GLN A1177 -11.581 8.402 -9.400 1.00 1.43 C ATOM 1953 C GLN A1177 -10.316 7.583 -9.749 1.00 1.38 C ATOM 1954 O GLN A1177 -9.859 7.584 -10.892 1.00 1.66 O ATOM 1955 CB GLN A1177 -12.799 7.505 -9.682 1.00 1.66 C ATOM 1956 CG GLN A1177 -14.160 8.082 -9.276 1.00 1.90 C ATOM 1957 CD GLN A1177 -15.248 7.048 -9.415 1.00 2.31 C ATOM 1958 OE1 GLN A1177 -15.836 6.840 -10.471 1.00 3.21 O ATOM 1959 NE2 GLN A1177 -15.561 6.347 -8.361 1.00 2.59 N ATOM 0 HA GLN A1177 -11.532 8.693 -8.351 1.00 1.43 H new ATOM 0 HB2 GLN A1177 -12.823 7.282 -10.749 1.00 1.66 H new ATOM 0 HB3 GLN A1177 -12.657 6.558 -9.162 1.00 1.66 H new ATOM 0 HG2 GLN A1177 -14.117 8.434 -8.245 1.00 1.90 H new ATOM 0 HG3 GLN A1177 -14.393 8.946 -9.898 1.00 1.90 H new ATOM 0 HE21 GLN A1177 -15.079 6.511 -7.477 1.00 2.59 H new ATOM 0 HE22 GLN A1177 -16.288 5.634 -8.420 1.00 2.59 H new ATOM 1968 N TYR A1178 -9.805 6.807 -8.792 1.00 1.12 N ATOM 1969 CA TYR A1178 -8.780 5.769 -8.984 1.00 1.02 C ATOM 1970 C TYR A1178 -9.224 4.397 -8.443 1.00 0.87 C ATOM 1971 O TYR A1178 -9.671 4.287 -7.302 1.00 0.90 O ATOM 1972 CB TYR A1178 -7.454 6.184 -8.323 1.00 1.12 C ATOM 1973 CG TYR A1178 -6.627 7.274 -8.987 1.00 1.02 C ATOM 1974 CD1 TYR A1178 -6.506 7.350 -10.389 1.00 1.86 C ATOM 1975 CD2 TYR A1178 -5.892 8.166 -8.178 1.00 1.90 C ATOM 1976 CE1 TYR A1178 -5.650 8.301 -10.977 1.00 1.91 C ATOM 1977 CE2 TYR A1178 -5.028 9.114 -8.764 1.00 2.00 C ATOM 1978 CZ TYR A1178 -4.895 9.176 -10.167 1.00 1.27 C ATOM 1979 OH TYR A1178 -4.049 10.073 -10.737 1.00 1.51 O ATOM 0 H TYR A1178 -10.104 6.885 -7.820 1.00 1.12 H new ATOM 0 HA TYR A1178 -8.635 5.669 -10.060 1.00 1.02 H new ATOM 0 HB2 TYR A1178 -7.677 6.508 -7.306 1.00 1.12 H new ATOM 0 HB3 TYR A1178 -6.829 5.294 -8.244 1.00 1.12 H new ATOM 0 HD1 TYR A1178 -7.072 6.676 -11.015 1.00 1.86 H new ATOM 0 HD2 TYR A1178 -5.992 8.123 -7.103 1.00 1.90 H new ATOM 0 HE1 TYR A1178 -5.571 8.361 -12.052 1.00 1.91 H new ATOM 0 HE2 TYR A1178 -4.468 9.793 -8.138 1.00 2.00 H new ATOM 0 HH TYR A1178 -3.608 10.598 -10.037 1.00 1.51 H new ATOM 1989 N LYS A1179 -9.027 3.328 -9.221 1.00 0.84 N ATOM 1990 CA LYS A1179 -9.172 1.922 -8.794 1.00 0.85 C ATOM 1991 C LYS A1179 -7.880 1.466 -8.105 1.00 0.67 C ATOM 1992 O LYS A1179 -6.841 1.479 -8.757 1.00 0.68 O ATOM 1993 CB LYS A1179 -9.514 1.107 -10.063 1.00 1.12 C ATOM 1994 CG LYS A1179 -9.813 -0.390 -9.885 1.00 1.53 C ATOM 1995 CD LYS A1179 -8.580 -1.300 -9.757 1.00 1.97 C ATOM 1996 CE LYS A1179 -8.948 -2.792 -9.688 1.00 2.49 C ATOM 1997 NZ LYS A1179 -9.471 -3.340 -10.965 1.00 2.68 N ATOM 0 H LYS A1179 -8.753 3.415 -10.200 1.00 0.84 H new ATOM 0 HA LYS A1179 -9.968 1.781 -8.063 1.00 0.85 H new ATOM 0 HB2 LYS A1179 -10.380 1.569 -10.536 1.00 1.12 H new ATOM 0 HB3 LYS A1179 -8.681 1.203 -10.759 1.00 1.12 H new ATOM 0 HG2 LYS A1179 -10.430 -0.516 -8.995 1.00 1.53 H new ATOM 0 HG3 LYS A1179 -10.406 -0.728 -10.735 1.00 1.53 H new ATOM 0 HD2 LYS A1179 -7.920 -1.132 -10.608 1.00 1.97 H new ATOM 0 HD3 LYS A1179 -8.022 -1.026 -8.861 1.00 1.97 H new ATOM 0 HE2 LYS A1179 -8.066 -3.361 -9.393 1.00 2.49 H new ATOM 0 HE3 LYS A1179 -9.696 -2.937 -8.908 1.00 2.49 H new ATOM 0 HZ1 LYS A1179 -9.364 -4.374 -10.969 1.00 2.68 H new ATOM 0 HZ2 LYS A1179 -10.477 -3.096 -11.061 1.00 2.68 H new ATOM 0 HZ3 LYS A1179 -8.939 -2.934 -11.761 1.00 2.68 H new ATOM 2011 N VAL A1180 -7.905 1.073 -6.825 1.00 0.60 N ATOM 2012 CA VAL A1180 -6.683 0.789 -6.033 1.00 0.50 C ATOM 2013 C VAL A1180 -6.794 -0.496 -5.202 1.00 0.48 C ATOM 2014 O VAL A1180 -7.801 -0.711 -4.530 1.00 0.60 O ATOM 2015 CB VAL A1180 -6.341 1.970 -5.093 1.00 0.57 C ATOM 2016 CG1 VAL A1180 -4.991 1.784 -4.382 1.00 1.46 C ATOM 2017 CG2 VAL A1180 -6.284 3.313 -5.832 1.00 1.47 C ATOM 0 H VAL A1180 -8.770 0.940 -6.301 1.00 0.60 H new ATOM 0 HA VAL A1180 -5.884 0.651 -6.761 1.00 0.50 H new ATOM 0 HB VAL A1180 -7.150 1.980 -4.363 1.00 0.57 H new ATOM 0 HG11 VAL A1180 -4.799 2.640 -3.735 1.00 1.46 H new ATOM 0 HG12 VAL A1180 -5.018 0.875 -3.782 1.00 1.46 H new ATOM 0 HG13 VAL A1180 -4.197 1.705 -5.124 1.00 1.46 H new ATOM 0 HG21 VAL A1180 -6.041 4.107 -5.126 1.00 1.47 H new ATOM 0 HG22 VAL A1180 -5.519 3.270 -6.607 1.00 1.47 H new ATOM 0 HG23 VAL A1180 -7.252 3.518 -6.289 1.00 1.47 H new ATOM 2027 N LEU A1181 -5.734 -1.316 -5.194 1.00 0.42 N ATOM 2028 CA LEU A1181 -5.559 -2.466 -4.292 1.00 0.53 C ATOM 2029 C LEU A1181 -4.276 -2.316 -3.457 1.00 0.61 C ATOM 2030 O LEU A1181 -3.253 -1.842 -3.955 1.00 0.63 O ATOM 2031 CB LEU A1181 -5.489 -3.810 -5.049 1.00 0.77 C ATOM 2032 CG LEU A1181 -6.804 -4.427 -5.553 1.00 0.97 C ATOM 2033 CD1 LEU A1181 -7.325 -3.711 -6.791 1.00 1.32 C ATOM 2034 CD2 LEU A1181 -6.560 -5.879 -5.975 1.00 1.72 C ATOM 0 H LEU A1181 -4.950 -1.195 -5.835 1.00 0.42 H new ATOM 0 HA LEU A1181 -6.437 -2.476 -3.646 1.00 0.53 H new ATOM 0 HB2 LEU A1181 -4.833 -3.674 -5.909 1.00 0.77 H new ATOM 0 HB3 LEU A1181 -5.009 -4.537 -4.394 1.00 0.77 H new ATOM 0 HG LEU A1181 -7.524 -4.345 -4.738 1.00 0.97 H new ATOM 0 HD11 LEU A1181 -8.255 -4.177 -7.116 1.00 1.32 H new ATOM 0 HD12 LEU A1181 -7.507 -2.662 -6.555 1.00 1.32 H new ATOM 0 HD13 LEU A1181 -6.586 -3.780 -7.589 1.00 1.32 H new ATOM 0 HD21 LEU A1181 -7.493 -6.316 -6.332 1.00 1.72 H new ATOM 0 HD22 LEU A1181 -5.818 -5.906 -6.773 1.00 1.72 H new ATOM 0 HD23 LEU A1181 -6.196 -6.450 -5.121 1.00 1.72 H new ATOM 2046 N ILE A1182 -4.318 -2.814 -2.219 1.00 0.67 N ATOM 2047 CA ILE A1182 -3.168 -2.983 -1.313 1.00 0.69 C ATOM 2048 C ILE A1182 -3.223 -4.427 -0.805 1.00 0.68 C ATOM 2049 O ILE A1182 -4.224 -4.805 -0.202 1.00 0.82 O ATOM 2050 CB ILE A1182 -3.245 -1.990 -0.123 1.00 0.75 C ATOM 2051 CG1 ILE A1182 -3.275 -0.508 -0.569 1.00 0.79 C ATOM 2052 CG2 ILE A1182 -2.063 -2.225 0.841 1.00 0.82 C ATOM 2053 CD1 ILE A1182 -3.736 0.455 0.534 1.00 1.29 C ATOM 0 H ILE A1182 -5.192 -3.126 -1.797 1.00 0.67 H new ATOM 0 HA ILE A1182 -2.233 -2.780 -1.835 1.00 0.69 H new ATOM 0 HB ILE A1182 -4.188 -2.186 0.387 1.00 0.75 H new ATOM 0 HG12 ILE A1182 -2.279 -0.217 -0.901 1.00 0.79 H new ATOM 0 HG13 ILE A1182 -3.939 -0.409 -1.428 1.00 0.79 H new ATOM 0 HG21 ILE A1182 -2.127 -1.523 1.672 1.00 0.82 H new ATOM 0 HG22 ILE A1182 -2.103 -3.245 1.223 1.00 0.82 H new ATOM 0 HG23 ILE A1182 -1.124 -2.073 0.309 1.00 0.82 H new ATOM 0 HD11 ILE A1182 -3.733 1.475 0.151 1.00 1.29 H new ATOM 0 HD12 ILE A1182 -4.745 0.190 0.850 1.00 1.29 H new ATOM 0 HD13 ILE A1182 -3.058 0.385 1.385 1.00 1.29 H new ATOM 2065 N GLY A1183 -2.207 -5.263 -1.031 1.00 0.58 N ATOM 2066 CA GLY A1183 -2.317 -6.669 -0.625 1.00 0.62 C ATOM 2067 C GLY A1183 -1.132 -7.574 -0.940 1.00 0.61 C ATOM 2068 O GLY A1183 -0.033 -7.126 -1.268 1.00 0.63 O ATOM 0 H GLY A1183 -1.327 -5.005 -1.477 1.00 0.58 H new ATOM 0 HA2 GLY A1183 -2.489 -6.699 0.451 1.00 0.62 H new ATOM 0 HA3 GLY A1183 -3.202 -7.091 -1.101 1.00 0.62 H new ATOM 2072 N ASN A1184 -1.363 -8.877 -0.789 1.00 0.73 N ATOM 2073 CA ASN A1184 -0.308 -9.881 -0.831 1.00 0.81 C ATOM 2074 C ASN A1184 0.081 -10.272 -2.271 1.00 0.81 C ATOM 2075 O ASN A1184 -0.694 -10.144 -3.226 1.00 0.77 O ATOM 2076 CB ASN A1184 -0.760 -11.091 0.013 1.00 1.04 C ATOM 2077 CG ASN A1184 -1.000 -10.777 1.483 1.00 2.60 C ATOM 2078 OD1 ASN A1184 -0.464 -9.837 2.055 1.00 3.92 O ATOM 2079 ND2 ASN A1184 -1.786 -11.578 2.159 1.00 3.43 N ATOM 0 H ASN A1184 -2.293 -9.265 -0.633 1.00 0.73 H new ATOM 0 HA ASN A1184 0.604 -9.465 -0.404 1.00 0.81 H new ATOM 0 HB2 ASN A1184 -1.678 -11.494 -0.415 1.00 1.04 H new ATOM 0 HB3 ASN A1184 -0.004 -11.873 -0.060 1.00 1.04 H new ATOM 0 HD21 ASN A1184 -1.947 -11.415 3.153 1.00 3.43 H new ATOM 0 HD22 ASN A1184 -2.237 -12.364 1.691 1.00 3.43 H new ATOM 2086 N ARG A1185 1.279 -10.844 -2.410 1.00 0.92 N ATOM 2087 CA ARG A1185 1.949 -11.109 -3.693 1.00 0.93 C ATOM 2088 C ARG A1185 1.173 -12.091 -4.581 1.00 0.93 C ATOM 2089 O ARG A1185 0.989 -11.816 -5.765 1.00 0.98 O ATOM 2090 CB ARG A1185 3.384 -11.565 -3.373 1.00 1.13 C ATOM 2091 CG ARG A1185 4.238 -11.868 -4.608 1.00 1.46 C ATOM 2092 CD ARG A1185 5.640 -12.335 -4.170 1.00 1.54 C ATOM 2093 NE ARG A1185 6.246 -13.263 -5.139 1.00 2.75 N ATOM 2094 CZ ARG A1185 5.828 -14.488 -5.395 1.00 3.43 C ATOM 2095 NH1 ARG A1185 4.893 -15.063 -4.694 1.00 3.67 N ATOM 2096 NH2 ARG A1185 6.333 -15.154 -6.385 1.00 4.86 N ATOM 0 H ARG A1185 1.831 -11.147 -1.608 1.00 0.92 H new ATOM 0 HA ARG A1185 1.984 -10.201 -4.295 1.00 0.93 H new ATOM 0 HB2 ARG A1185 3.877 -10.790 -2.786 1.00 1.13 H new ATOM 0 HB3 ARG A1185 3.339 -12.457 -2.749 1.00 1.13 H new ATOM 0 HG2 ARG A1185 3.760 -12.639 -5.212 1.00 1.46 H new ATOM 0 HG3 ARG A1185 4.319 -10.978 -5.233 1.00 1.46 H new ATOM 0 HD2 ARG A1185 6.288 -11.467 -4.047 1.00 1.54 H new ATOM 0 HD3 ARG A1185 5.571 -12.822 -3.197 1.00 1.54 H new ATOM 0 HE ARG A1185 7.059 -12.930 -5.657 1.00 2.75 H new ATOM 0 HH11 ARG A1185 4.458 -14.565 -3.918 1.00 3.67 H new ATOM 0 HH12 ARG A1185 4.596 -16.012 -4.921 1.00 3.67 H new ATOM 0 HH21 ARG A1185 7.055 -14.731 -6.968 1.00 4.86 H new ATOM 0 HH22 ARG A1185 6.008 -16.101 -6.581 1.00 4.86 H new ATOM 2110 N GLU A1186 0.645 -13.185 -4.027 1.00 0.97 N ATOM 2111 CA GLU A1186 -0.195 -14.130 -4.784 1.00 1.03 C ATOM 2112 C GLU A1186 -1.595 -13.578 -5.112 1.00 1.07 C ATOM 2113 O GLU A1186 -2.238 -14.069 -6.046 1.00 1.35 O ATOM 2114 CB GLU A1186 -0.316 -15.477 -4.051 1.00 1.14 C ATOM 2115 CG GLU A1186 1.014 -16.233 -3.878 1.00 1.61 C ATOM 2116 CD GLU A1186 1.633 -16.749 -5.188 1.00 2.79 C ATOM 2117 OE1 GLU A1186 0.905 -17.075 -6.150 1.00 4.04 O ATOM 2118 OE2 GLU A1186 2.877 -16.911 -5.237 1.00 3.61 O ATOM 0 H GLU A1186 0.783 -13.444 -3.050 1.00 0.97 H new ATOM 0 HA GLU A1186 0.316 -14.282 -5.735 1.00 1.03 H new ATOM 0 HB2 GLU A1186 -0.751 -15.303 -3.067 1.00 1.14 H new ATOM 0 HB3 GLU A1186 -1.012 -16.113 -4.599 1.00 1.14 H new ATOM 0 HG2 GLU A1186 1.730 -15.574 -3.388 1.00 1.61 H new ATOM 0 HG3 GLU A1186 0.851 -17.079 -3.210 1.00 1.61 H new ATOM 2125 N TRP A1187 -2.098 -12.549 -4.414 1.00 0.92 N ATOM 2126 CA TRP A1187 -3.414 -11.960 -4.693 1.00 0.99 C ATOM 2127 C TRP A1187 -3.338 -10.932 -5.833 1.00 0.92 C ATOM 2128 O TRP A1187 -4.279 -10.793 -6.620 1.00 0.96 O ATOM 2129 CB TRP A1187 -3.941 -11.343 -3.392 1.00 1.06 C ATOM 2130 CG TRP A1187 -5.371 -10.910 -3.412 1.00 1.26 C ATOM 2131 CD1 TRP A1187 -6.427 -11.724 -3.633 1.00 2.36 C ATOM 2132 CD2 TRP A1187 -5.934 -9.590 -3.128 1.00 1.00 C ATOM 2133 NE1 TRP A1187 -7.597 -11.005 -3.511 1.00 2.54 N ATOM 2134 CE2 TRP A1187 -7.357 -9.687 -3.184 1.00 1.53 C ATOM 2135 CE3 TRP A1187 -5.390 -8.328 -2.805 1.00 1.66 C ATOM 2136 CZ2 TRP A1187 -8.198 -8.595 -2.931 1.00 1.46 C ATOM 2137 CZ3 TRP A1187 -6.224 -7.223 -2.544 1.00 2.05 C ATOM 2138 CH2 TRP A1187 -7.624 -7.353 -2.611 1.00 1.48 C ATOM 0 H TRP A1187 -1.604 -12.103 -3.641 1.00 0.92 H new ATOM 0 HA TRP A1187 -4.106 -12.730 -5.034 1.00 0.99 H new ATOM 0 HB2 TRP A1187 -3.812 -12.069 -2.589 1.00 1.06 H new ATOM 0 HB3 TRP A1187 -3.323 -10.480 -3.144 1.00 1.06 H new ATOM 0 HD1 TRP A1187 -6.364 -12.776 -3.869 1.00 2.36 H new ATOM 0 HE1 TRP A1187 -8.528 -11.400 -3.646 1.00 2.54 H new ATOM 0 HE3 TRP A1187 -4.318 -8.208 -2.757 1.00 1.66 H new ATOM 0 HZ2 TRP A1187 -9.271 -8.706 -2.981 1.00 1.46 H new ATOM 0 HZ3 TRP A1187 -5.786 -6.269 -2.291 1.00 2.05 H new ATOM 0 HH2 TRP A1187 -8.256 -6.499 -2.417 1.00 1.48 H new ATOM 2149 N MET A1188 -2.186 -10.272 -5.993 1.00 0.88 N ATOM 2150 CA MET A1188 -1.877 -9.463 -7.178 1.00 0.86 C ATOM 2151 C MET A1188 -1.769 -10.353 -8.431 1.00 0.96 C ATOM 2152 O MET A1188 -2.278 -9.981 -9.489 1.00 0.96 O ATOM 2153 CB MET A1188 -0.589 -8.655 -6.933 1.00 0.91 C ATOM 2154 CG MET A1188 -0.890 -7.224 -6.468 1.00 0.91 C ATOM 2155 SD MET A1188 -1.874 -7.045 -4.955 1.00 1.63 S ATOM 2156 CE MET A1188 -2.342 -5.301 -5.119 1.00 0.83 C ATOM 0 H MET A1188 -1.437 -10.284 -5.300 1.00 0.88 H new ATOM 0 HA MET A1188 -2.689 -8.758 -7.357 1.00 0.86 H new ATOM 0 HB2 MET A1188 0.019 -9.160 -6.182 1.00 0.91 H new ATOM 0 HB3 MET A1188 -0.001 -8.622 -7.850 1.00 0.91 H new ATOM 0 HG2 MET A1188 0.059 -6.709 -6.319 1.00 0.91 H new ATOM 0 HG3 MET A1188 -1.410 -6.707 -7.275 1.00 0.91 H new ATOM 0 HE1 MET A1188 -2.721 -4.935 -4.165 1.00 0.83 H new ATOM 0 HE2 MET A1188 -1.470 -4.716 -5.411 1.00 0.83 H new ATOM 0 HE3 MET A1188 -3.117 -5.202 -5.879 1.00 0.83 H new ATOM 2166 N ILE A1189 -1.218 -11.567 -8.298 1.00 1.13 N ATOM 2167 CA ILE A1189 -1.206 -12.589 -9.362 1.00 1.34 C ATOM 2168 C ILE A1189 -2.635 -13.043 -9.725 1.00 1.37 C ATOM 2169 O ILE A1189 -2.937 -13.211 -10.909 1.00 1.46 O ATOM 2170 CB ILE A1189 -0.270 -13.759 -8.959 1.00 1.62 C ATOM 2171 CG1 ILE A1189 1.202 -13.274 -8.975 1.00 1.45 C ATOM 2172 CG2 ILE A1189 -0.444 -14.985 -9.877 1.00 2.88 C ATOM 2173 CD1 ILE A1189 2.189 -14.215 -8.269 1.00 1.67 C ATOM 0 H ILE A1189 -0.762 -11.874 -7.439 1.00 1.13 H new ATOM 0 HA ILE A1189 -0.800 -12.153 -10.275 1.00 1.34 H new ATOM 0 HB ILE A1189 -0.542 -14.075 -7.952 1.00 1.62 H new ATOM 0 HG12 ILE A1189 1.518 -13.146 -10.010 1.00 1.45 H new ATOM 0 HG13 ILE A1189 1.253 -12.293 -8.503 1.00 1.45 H new ATOM 0 HG21 ILE A1189 0.231 -15.778 -9.557 1.00 2.88 H new ATOM 0 HG22 ILE A1189 -1.473 -15.339 -9.820 1.00 2.88 H new ATOM 0 HG23 ILE A1189 -0.213 -14.705 -10.905 1.00 2.88 H new ATOM 0 HD11 ILE A1189 3.195 -13.798 -8.328 1.00 1.67 H new ATOM 0 HD12 ILE A1189 1.903 -14.324 -7.223 1.00 1.67 H new ATOM 0 HD13 ILE A1189 2.171 -15.191 -8.754 1.00 1.67 H new ATOM 2185 N ARG A1190 -3.563 -13.138 -8.755 1.00 1.35 N ATOM 2186 CA ARG A1190 -5.002 -13.366 -9.021 1.00 1.40 C ATOM 2187 C ARG A1190 -5.625 -12.214 -9.822 1.00 1.24 C ATOM 2188 O ARG A1190 -6.365 -12.469 -10.771 1.00 1.30 O ATOM 2189 CB ARG A1190 -5.739 -13.670 -7.697 1.00 1.51 C ATOM 2190 CG ARG A1190 -7.274 -13.580 -7.747 1.00 1.95 C ATOM 2191 CD ARG A1190 -7.928 -14.590 -8.700 1.00 2.03 C ATOM 2192 NE ARG A1190 -9.354 -14.277 -8.900 1.00 2.30 N ATOM 2193 CZ ARG A1190 -10.361 -14.563 -8.097 1.00 2.86 C ATOM 2194 NH1 ARG A1190 -10.198 -15.163 -6.953 1.00 4.19 N ATOM 2195 NH2 ARG A1190 -11.566 -14.230 -8.446 1.00 3.38 N ATOM 0 H ARG A1190 -3.340 -13.059 -7.763 1.00 1.35 H new ATOM 0 HA ARG A1190 -5.112 -14.243 -9.659 1.00 1.40 H new ATOM 0 HB2 ARG A1190 -5.463 -14.673 -7.372 1.00 1.51 H new ATOM 0 HB3 ARG A1190 -5.378 -12.978 -6.936 1.00 1.51 H new ATOM 0 HG2 ARG A1190 -7.670 -13.734 -6.743 1.00 1.95 H new ATOM 0 HG3 ARG A1190 -7.559 -12.573 -8.050 1.00 1.95 H new ATOM 0 HD2 ARG A1190 -7.411 -14.578 -9.659 1.00 2.03 H new ATOM 0 HD3 ARG A1190 -7.826 -15.597 -8.295 1.00 2.03 H new ATOM 0 HE ARG A1190 -9.590 -13.781 -9.760 1.00 2.30 H new ATOM 0 HH11 ARG A1190 -9.263 -15.431 -6.646 1.00 4.19 H new ATOM 0 HH12 ARG A1190 -11.005 -15.365 -6.363 1.00 4.19 H new ATOM 0 HH21 ARG A1190 -11.726 -13.752 -9.333 1.00 3.38 H new ATOM 0 HH22 ARG A1190 -12.352 -14.446 -7.833 1.00 3.38 H new ATOM 2209 N ASN A1191 -5.286 -10.957 -9.516 1.00 1.10 N ATOM 2210 CA ASN A1191 -5.700 -9.786 -10.307 1.00 1.00 C ATOM 2211 C ASN A1191 -5.084 -9.736 -11.730 1.00 1.01 C ATOM 2212 O ASN A1191 -5.453 -8.874 -12.528 1.00 1.08 O ATOM 2213 CB ASN A1191 -5.365 -8.517 -9.495 1.00 0.93 C ATOM 2214 CG ASN A1191 -6.141 -7.292 -9.958 1.00 1.15 C ATOM 2215 OD1 ASN A1191 -7.289 -7.078 -9.593 1.00 1.34 O ATOM 2216 ND2 ASN A1191 -5.557 -6.458 -10.784 1.00 1.72 N ATOM 0 H ASN A1191 -4.712 -10.719 -8.707 1.00 1.10 H new ATOM 0 HA ASN A1191 -6.773 -9.857 -10.482 1.00 1.00 H new ATOM 0 HB2 ASN A1191 -5.579 -8.699 -8.442 1.00 0.93 H new ATOM 0 HB3 ASN A1191 -4.297 -8.314 -9.573 1.00 0.93 H new ATOM 0 HD21 ASN A1191 -6.060 -5.636 -11.119 1.00 1.72 H new ATOM 0 HD22 ASN A1191 -4.600 -6.631 -11.092 1.00 1.72 H new ATOM 2223 N GLY A1192 -4.132 -10.620 -12.051 1.00 1.15 N ATOM 2224 CA GLY A1192 -3.423 -10.642 -13.336 1.00 1.25 C ATOM 2225 C GLY A1192 -2.273 -9.633 -13.421 1.00 1.16 C ATOM 2226 O GLY A1192 -1.915 -9.196 -14.517 1.00 1.26 O ATOM 0 H GLY A1192 -3.827 -11.354 -11.412 1.00 1.15 H new ATOM 0 HA2 GLY A1192 -3.029 -11.644 -13.507 1.00 1.25 H new ATOM 0 HA3 GLY A1192 -4.134 -10.438 -14.137 1.00 1.25 H new ATOM 2230 N LEU A1193 -1.714 -9.238 -12.273 1.00 1.06 N ATOM 2231 CA LEU A1193 -0.555 -8.344 -12.161 1.00 1.03 C ATOM 2232 C LEU A1193 0.746 -9.141 -11.964 1.00 1.23 C ATOM 2233 O LEU A1193 0.713 -10.299 -11.543 1.00 1.69 O ATOM 2234 CB LEU A1193 -0.797 -7.342 -11.017 1.00 0.90 C ATOM 2235 CG LEU A1193 -2.104 -6.542 -11.150 1.00 0.99 C ATOM 2236 CD1 LEU A1193 -2.319 -5.675 -9.914 1.00 1.06 C ATOM 2237 CD2 LEU A1193 -2.128 -5.629 -12.370 1.00 1.28 C ATOM 0 H LEU A1193 -2.067 -9.541 -11.365 1.00 1.06 H new ATOM 0 HA LEU A1193 -0.437 -7.787 -13.090 1.00 1.03 H new ATOM 0 HB2 LEU A1193 -0.809 -7.883 -10.071 1.00 0.90 H new ATOM 0 HB3 LEU A1193 0.040 -6.645 -10.975 1.00 0.90 H new ATOM 0 HG LEU A1193 -2.896 -7.282 -11.260 1.00 0.99 H new ATOM 0 HD11 LEU A1193 -3.247 -5.114 -10.020 1.00 1.06 H new ATOM 0 HD12 LEU A1193 -2.378 -6.310 -9.030 1.00 1.06 H new ATOM 0 HD13 LEU A1193 -1.485 -4.981 -9.807 1.00 1.06 H new ATOM 0 HD21 LEU A1193 -3.077 -5.094 -12.405 1.00 1.28 H new ATOM 0 HD22 LEU A1193 -1.309 -4.912 -12.304 1.00 1.28 H new ATOM 0 HD23 LEU A1193 -2.015 -6.227 -13.274 1.00 1.28 H new ATOM 2249 N VAL A1194 1.897 -8.530 -12.256 1.00 1.19 N ATOM 2250 CA VAL A1194 3.222 -9.173 -12.148 1.00 1.30 C ATOM 2251 C VAL A1194 4.281 -8.232 -11.558 1.00 1.01 C ATOM 2252 O VAL A1194 4.316 -7.037 -11.860 1.00 1.01 O ATOM 2253 CB VAL A1194 3.639 -9.795 -13.500 1.00 1.67 C ATOM 2254 CG1 VAL A1194 3.955 -8.758 -14.582 1.00 1.52 C ATOM 2255 CG2 VAL A1194 4.836 -10.739 -13.343 1.00 2.38 C ATOM 0 H VAL A1194 1.942 -7.563 -12.578 1.00 1.19 H new ATOM 0 HA VAL A1194 3.143 -9.992 -11.434 1.00 1.30 H new ATOM 0 HB VAL A1194 2.766 -10.359 -13.829 1.00 1.67 H new ATOM 0 HG11 VAL A1194 4.240 -9.268 -15.502 1.00 1.52 H new ATOM 0 HG12 VAL A1194 3.074 -8.143 -14.765 1.00 1.52 H new ATOM 0 HG13 VAL A1194 4.777 -8.124 -14.249 1.00 1.52 H new ATOM 0 HG21 VAL A1194 5.100 -11.157 -14.315 1.00 2.38 H new ATOM 0 HG22 VAL A1194 5.686 -10.186 -12.943 1.00 2.38 H new ATOM 0 HG23 VAL A1194 4.575 -11.547 -12.659 1.00 2.38 H new ATOM 2265 N ILE A1195 5.134 -8.781 -10.686 1.00 1.14 N ATOM 2266 CA ILE A1195 6.158 -8.058 -9.915 1.00 1.09 C ATOM 2267 C ILE A1195 7.552 -8.173 -10.557 1.00 1.11 C ATOM 2268 O ILE A1195 7.857 -9.161 -11.229 1.00 1.24 O ATOM 2269 CB ILE A1195 6.132 -8.538 -8.443 1.00 1.32 C ATOM 2270 CG1 ILE A1195 6.925 -7.634 -7.475 1.00 1.45 C ATOM 2271 CG2 ILE A1195 6.651 -9.979 -8.298 1.00 1.48 C ATOM 2272 CD1 ILE A1195 6.364 -6.213 -7.362 1.00 2.46 C ATOM 0 H ILE A1195 5.132 -9.782 -10.488 1.00 1.14 H new ATOM 0 HA ILE A1195 5.923 -6.994 -9.927 1.00 1.09 H new ATOM 0 HB ILE A1195 5.079 -8.488 -8.165 1.00 1.32 H new ATOM 0 HG12 ILE A1195 6.931 -8.093 -6.486 1.00 1.45 H new ATOM 0 HG13 ILE A1195 7.961 -7.581 -7.808 1.00 1.45 H new ATOM 0 HG21 ILE A1195 6.615 -10.275 -7.250 1.00 1.48 H new ATOM 0 HG22 ILE A1195 6.027 -10.652 -8.886 1.00 1.48 H new ATOM 0 HG23 ILE A1195 7.679 -10.033 -8.655 1.00 1.48 H new ATOM 0 HD11 ILE A1195 6.972 -5.636 -6.665 1.00 2.46 H new ATOM 0 HD12 ILE A1195 6.383 -5.735 -8.342 1.00 2.46 H new ATOM 0 HD13 ILE A1195 5.337 -6.255 -6.999 1.00 2.46 H new ATOM 2284 N ASN A1196 8.419 -7.185 -10.314 1.00 1.07 N ATOM 2285 CA ASN A1196 9.772 -7.169 -10.886 1.00 1.13 C ATOM 2286 C ASN A1196 10.740 -8.051 -10.070 1.00 1.05 C ATOM 2287 O ASN A1196 10.599 -8.182 -8.852 1.00 0.93 O ATOM 2288 CB ASN A1196 10.248 -5.715 -11.045 1.00 1.24 C ATOM 2289 CG ASN A1196 9.309 -4.883 -11.905 1.00 1.50 C ATOM 2290 OD1 ASN A1196 8.770 -5.323 -12.913 1.00 2.17 O ATOM 2291 ND2 ASN A1196 9.055 -3.657 -11.521 1.00 2.01 N ATOM 0 H ASN A1196 8.208 -6.382 -9.722 1.00 1.07 H new ATOM 0 HA ASN A1196 9.753 -7.612 -11.882 1.00 1.13 H new ATOM 0 HB2 ASN A1196 10.336 -5.256 -10.060 1.00 1.24 H new ATOM 0 HB3 ASN A1196 11.243 -5.709 -11.490 1.00 1.24 H new ATOM 0 HD21 ASN A1196 8.413 -3.076 -12.060 1.00 2.01 H new ATOM 0 HD22 ASN A1196 9.500 -3.283 -10.683 1.00 2.01 H new ATOM 2298 N ASN A1197 11.727 -8.662 -10.726 1.00 1.19 N ATOM 2299 CA ASN A1197 12.594 -9.690 -10.134 1.00 1.23 C ATOM 2300 C ASN A1197 13.522 -9.140 -9.032 1.00 1.22 C ATOM 2301 O ASN A1197 13.741 -9.825 -8.027 1.00 1.22 O ATOM 2302 CB ASN A1197 13.404 -10.363 -11.261 1.00 1.47 C ATOM 2303 CG ASN A1197 12.584 -11.216 -12.219 1.00 2.85 C ATOM 2304 OD1 ASN A1197 11.369 -11.350 -12.126 1.00 3.98 O ATOM 2305 ND2 ASN A1197 13.220 -11.788 -13.209 1.00 3.63 N ATOM 0 H ASN A1197 11.953 -8.456 -11.699 1.00 1.19 H new ATOM 0 HA ASN A1197 11.959 -10.424 -9.638 1.00 1.23 H new ATOM 0 HB2 ASN A1197 13.915 -9.589 -11.833 1.00 1.47 H new ATOM 0 HB3 ASN A1197 14.175 -10.988 -10.811 1.00 1.47 H new ATOM 0 HD21 ASN A1197 12.705 -12.340 -13.895 1.00 3.63 H new ATOM 0 HD22 ASN A1197 14.231 -11.682 -13.295 1.00 3.63 H new ATOM 2312 N ASP A1198 14.015 -7.906 -9.193 1.00 1.28 N ATOM 2313 CA ASP A1198 14.853 -7.205 -8.211 1.00 1.34 C ATOM 2314 C ASP A1198 14.107 -7.000 -6.883 1.00 1.25 C ATOM 2315 O ASP A1198 14.584 -7.421 -5.824 1.00 1.26 O ATOM 2316 CB ASP A1198 15.330 -5.862 -8.798 1.00 1.47 C ATOM 2317 CG ASP A1198 16.229 -5.092 -7.825 1.00 1.68 C ATOM 2318 OD1 ASP A1198 17.335 -5.598 -7.515 1.00 2.60 O ATOM 2319 OD2 ASP A1198 15.821 -4.010 -7.334 1.00 2.14 O ATOM 0 H ASP A1198 13.838 -7.353 -10.031 1.00 1.28 H new ATOM 0 HA ASP A1198 15.725 -7.822 -7.994 1.00 1.34 H new ATOM 0 HB2 ASP A1198 15.874 -6.045 -9.725 1.00 1.47 H new ATOM 0 HB3 ASP A1198 14.464 -5.250 -9.052 1.00 1.47 H new ATOM 2324 N VAL A1199 12.917 -6.391 -6.940 1.00 1.21 N ATOM 2325 CA VAL A1199 12.089 -6.175 -5.743 1.00 1.22 C ATOM 2326 C VAL A1199 11.473 -7.453 -5.185 1.00 1.11 C ATOM 2327 O VAL A1199 11.180 -7.502 -3.993 1.00 1.03 O ATOM 2328 CB VAL A1199 11.008 -5.102 -5.927 1.00 1.30 C ATOM 2329 CG1 VAL A1199 11.605 -3.808 -6.462 1.00 2.96 C ATOM 2330 CG2 VAL A1199 9.831 -5.531 -6.791 1.00 1.98 C ATOM 0 H VAL A1199 12.503 -6.038 -7.803 1.00 1.21 H new ATOM 0 HA VAL A1199 12.799 -5.803 -5.005 1.00 1.22 H new ATOM 0 HB VAL A1199 10.604 -4.938 -4.928 1.00 1.30 H new ATOM 0 HG11 VAL A1199 10.816 -3.066 -6.583 1.00 2.96 H new ATOM 0 HG12 VAL A1199 12.351 -3.434 -5.761 1.00 2.96 H new ATOM 0 HG13 VAL A1199 12.076 -3.996 -7.427 1.00 2.96 H new ATOM 0 HG21 VAL A1199 9.117 -4.711 -6.866 1.00 1.98 H new ATOM 0 HG22 VAL A1199 10.188 -5.794 -7.787 1.00 1.98 H new ATOM 0 HG23 VAL A1199 9.344 -6.396 -6.340 1.00 1.98 H new ATOM 2340 N ASN A1200 11.294 -8.504 -5.996 1.00 1.13 N ATOM 2341 CA ASN A1200 10.796 -9.781 -5.490 1.00 1.10 C ATOM 2342 C ASN A1200 11.817 -10.439 -4.550 1.00 1.09 C ATOM 2343 O ASN A1200 11.454 -10.944 -3.488 1.00 1.06 O ATOM 2344 CB ASN A1200 10.440 -10.718 -6.657 1.00 1.13 C ATOM 2345 CG ASN A1200 9.862 -12.032 -6.153 1.00 1.24 C ATOM 2346 OD1 ASN A1200 8.779 -12.069 -5.589 1.00 1.42 O ATOM 2347 ND2 ASN A1200 10.573 -13.130 -6.264 1.00 1.56 N ATOM 0 H ASN A1200 11.486 -8.492 -6.998 1.00 1.13 H new ATOM 0 HA ASN A1200 9.891 -9.590 -4.914 1.00 1.10 H new ATOM 0 HB2 ASN A1200 9.720 -10.229 -7.312 1.00 1.13 H new ATOM 0 HB3 ASN A1200 11.331 -10.915 -7.253 1.00 1.13 H new ATOM 0 HD21 ASN A1200 10.220 -14.007 -5.881 1.00 1.56 H new ATOM 0 HD22 ASN A1200 11.478 -13.106 -6.734 1.00 1.56 H new ATOM 2354 N ASP A1201 13.104 -10.386 -4.903 1.00 1.14 N ATOM 2355 CA ASP A1201 14.165 -10.929 -4.054 1.00 1.14 C ATOM 2356 C ASP A1201 14.340 -10.104 -2.764 1.00 1.12 C ATOM 2357 O ASP A1201 14.599 -10.663 -1.697 1.00 1.13 O ATOM 2358 CB ASP A1201 15.466 -11.037 -4.860 1.00 1.26 C ATOM 2359 CG ASP A1201 16.324 -12.182 -4.330 1.00 1.42 C ATOM 2360 OD1 ASP A1201 15.936 -13.359 -4.521 1.00 2.49 O ATOM 2361 OD2 ASP A1201 17.374 -11.933 -3.699 1.00 1.86 O ATOM 0 H ASP A1201 13.436 -9.971 -5.774 1.00 1.14 H new ATOM 0 HA ASP A1201 13.882 -11.931 -3.732 1.00 1.14 H new ATOM 0 HB2 ASP A1201 15.237 -11.202 -5.913 1.00 1.26 H new ATOM 0 HB3 ASP A1201 16.019 -10.100 -4.798 1.00 1.26 H new ATOM 2366 N PHE A1202 14.114 -8.787 -2.840 1.00 1.11 N ATOM 2367 CA PHE A1202 14.041 -7.890 -1.681 1.00 1.09 C ATOM 2368 C PHE A1202 12.840 -8.203 -0.765 1.00 1.01 C ATOM 2369 O PHE A1202 13.031 -8.332 0.442 1.00 1.02 O ATOM 2370 CB PHE A1202 14.020 -6.436 -2.180 1.00 1.15 C ATOM 2371 CG PHE A1202 13.493 -5.426 -1.178 1.00 1.08 C ATOM 2372 CD1 PHE A1202 14.330 -4.940 -0.156 1.00 1.84 C ATOM 2373 CD2 PHE A1202 12.147 -5.011 -1.243 1.00 1.80 C ATOM 2374 CE1 PHE A1202 13.823 -4.048 0.806 1.00 1.76 C ATOM 2375 CE2 PHE A1202 11.640 -4.128 -0.269 1.00 1.92 C ATOM 2376 CZ PHE A1202 12.478 -3.643 0.750 1.00 1.16 C ATOM 0 H PHE A1202 13.974 -8.305 -3.728 1.00 1.11 H new ATOM 0 HA PHE A1202 14.924 -8.046 -1.062 1.00 1.09 H new ATOM 0 HB2 PHE A1202 15.033 -6.150 -2.464 1.00 1.15 H new ATOM 0 HB3 PHE A1202 13.409 -6.385 -3.081 1.00 1.15 H new ATOM 0 HD1 PHE A1202 15.363 -5.252 -0.110 1.00 1.84 H new ATOM 0 HD2 PHE A1202 11.507 -5.369 -2.036 1.00 1.80 H new ATOM 0 HE1 PHE A1202 14.467 -3.674 1.588 1.00 1.76 H new ATOM 0 HE2 PHE A1202 10.605 -3.823 -0.305 1.00 1.92 H new ATOM 0 HZ PHE A1202 12.089 -2.959 1.490 1.00 1.16 H new ATOM 2386 N MET A1203 11.628 -8.392 -1.309 1.00 0.97 N ATOM 2387 CA MET A1203 10.460 -8.768 -0.491 1.00 0.93 C ATOM 2388 C MET A1203 10.680 -10.119 0.183 1.00 1.01 C ATOM 2389 O MET A1203 10.490 -10.239 1.391 1.00 1.08 O ATOM 2390 CB MET A1203 9.141 -8.785 -1.286 1.00 0.85 C ATOM 2391 CG MET A1203 8.660 -7.353 -1.550 1.00 1.26 C ATOM 2392 SD MET A1203 6.900 -7.141 -1.950 1.00 1.25 S ATOM 2393 CE MET A1203 6.811 -7.892 -3.593 1.00 2.11 C ATOM 0 H MET A1203 11.430 -8.292 -2.305 1.00 0.97 H new ATOM 0 HA MET A1203 10.364 -7.993 0.269 1.00 0.93 H new ATOM 0 HB2 MET A1203 9.285 -9.308 -2.232 1.00 0.85 H new ATOM 0 HB3 MET A1203 8.381 -9.335 -0.731 1.00 0.85 H new ATOM 0 HG2 MET A1203 8.883 -6.752 -0.669 1.00 1.26 H new ATOM 0 HG3 MET A1203 9.247 -6.943 -2.372 1.00 1.26 H new ATOM 0 HE1 MET A1203 6.259 -7.234 -4.264 1.00 2.11 H new ATOM 0 HE2 MET A1203 7.819 -8.042 -3.980 1.00 2.11 H new ATOM 0 HE3 MET A1203 6.301 -8.853 -3.527 1.00 2.11 H new ATOM 2403 N THR A1204 11.176 -11.097 -0.575 1.00 1.09 N ATOM 2404 CA THR A1204 11.479 -12.440 -0.072 1.00 1.22 C ATOM 2405 C THR A1204 12.433 -12.402 1.124 1.00 1.24 C ATOM 2406 O THR A1204 12.144 -12.991 2.166 1.00 1.29 O ATOM 2407 CB THR A1204 12.115 -13.300 -1.172 1.00 1.44 C ATOM 2408 OG1 THR A1204 11.311 -13.344 -2.336 1.00 1.97 O ATOM 2409 CG2 THR A1204 12.286 -14.728 -0.680 1.00 1.32 C ATOM 0 H THR A1204 11.382 -10.979 -1.567 1.00 1.09 H new ATOM 0 HA THR A1204 10.531 -12.874 0.246 1.00 1.22 H new ATOM 0 HB THR A1204 13.077 -12.847 -1.413 1.00 1.44 H new ATOM 0 HG1 THR A1204 11.565 -12.612 -2.937 1.00 1.97 H new ATOM 0 HG21 THR A1204 12.738 -15.332 -1.467 1.00 1.32 H new ATOM 0 HG22 THR A1204 12.931 -14.735 0.199 1.00 1.32 H new ATOM 0 HG23 THR A1204 11.312 -15.142 -0.419 1.00 1.32 H new ATOM 2417 N GLU A1205 13.565 -11.706 0.985 1.00 1.28 N ATOM 2418 CA GLU A1205 14.582 -11.625 2.038 1.00 1.35 C ATOM 2419 C GLU A1205 14.114 -10.775 3.230 1.00 1.46 C ATOM 2420 O GLU A1205 14.447 -11.087 4.373 1.00 1.61 O ATOM 2421 CB GLU A1205 15.897 -11.113 1.437 1.00 1.48 C ATOM 2422 CG GLU A1205 17.085 -11.136 2.412 1.00 1.60 C ATOM 2423 CD GLU A1205 17.472 -12.541 2.893 1.00 2.63 C ATOM 2424 OE1 GLU A1205 17.470 -13.498 2.083 1.00 3.77 O ATOM 2425 OE2 GLU A1205 17.867 -12.691 4.070 1.00 3.64 O ATOM 0 H GLU A1205 13.802 -11.184 0.141 1.00 1.28 H new ATOM 0 HA GLU A1205 14.751 -12.624 2.440 1.00 1.35 H new ATOM 0 HB2 GLU A1205 16.145 -11.718 0.565 1.00 1.48 H new ATOM 0 HB3 GLU A1205 15.750 -10.092 1.085 1.00 1.48 H new ATOM 0 HG2 GLU A1205 17.948 -10.679 1.928 1.00 1.60 H new ATOM 0 HG3 GLU A1205 16.842 -10.521 3.278 1.00 1.60 H new ATOM 2432 N HIS A1206 13.306 -9.735 2.996 1.00 1.45 N ATOM 2433 CA HIS A1206 12.766 -8.907 4.082 1.00 1.57 C ATOM 2434 C HIS A1206 11.696 -9.663 4.895 1.00 1.57 C ATOM 2435 O HIS A1206 11.664 -9.552 6.126 1.00 1.70 O ATOM 2436 CB HIS A1206 12.276 -7.544 3.565 1.00 1.69 C ATOM 2437 CG HIS A1206 12.259 -6.466 4.630 1.00 1.71 C ATOM 2438 ND1 HIS A1206 12.136 -6.652 5.991 1.00 2.54 N ATOM 2439 CD2 HIS A1206 12.483 -5.129 4.434 1.00 1.79 C ATOM 2440 CE1 HIS A1206 12.300 -5.463 6.598 1.00 2.74 C ATOM 2441 NE2 HIS A1206 12.504 -4.493 5.685 1.00 2.14 N ATOM 0 H HIS A1206 13.011 -9.446 2.063 1.00 1.45 H new ATOM 0 HA HIS A1206 13.580 -8.695 4.775 1.00 1.57 H new ATOM 0 HB2 HIS A1206 12.918 -7.223 2.744 1.00 1.69 H new ATOM 0 HB3 HIS A1206 11.271 -7.658 3.158 1.00 1.69 H new ATOM 0 HD1 HIS A1206 11.952 -7.540 6.458 1.00 2.54 H new ATOM 0 HD2 HIS A1206 12.620 -4.646 3.478 1.00 1.79 H new ATOM 0 HE1 HIS A1206 12.272 -5.308 7.666 1.00 2.74 H new ATOM 2449 N GLU A1207 10.871 -10.486 4.238 1.00 1.46 N ATOM 2450 CA GLU A1207 9.969 -11.442 4.896 1.00 1.52 C ATOM 2451 C GLU A1207 10.760 -12.509 5.662 1.00 1.66 C ATOM 2452 O GLU A1207 10.378 -12.853 6.780 1.00 1.84 O ATOM 2453 CB GLU A1207 9.061 -12.138 3.871 1.00 1.43 C ATOM 2454 CG GLU A1207 7.954 -11.232 3.324 1.00 2.27 C ATOM 2455 CD GLU A1207 7.125 -11.977 2.272 1.00 2.53 C ATOM 2456 OE1 GLU A1207 7.670 -12.358 1.212 1.00 3.52 O ATOM 2457 OE2 GLU A1207 5.913 -12.217 2.504 1.00 2.65 O ATOM 0 H GLU A1207 10.809 -10.508 3.220 1.00 1.46 H new ATOM 0 HA GLU A1207 9.356 -10.875 5.596 1.00 1.52 H new ATOM 0 HB2 GLU A1207 9.670 -12.496 3.041 1.00 1.43 H new ATOM 0 HB3 GLU A1207 8.607 -13.014 4.335 1.00 1.43 H new ATOM 0 HG2 GLU A1207 7.309 -10.903 4.139 1.00 2.27 H new ATOM 0 HG3 GLU A1207 8.393 -10.337 2.883 1.00 2.27 H new ATOM 2464 N ARG A1208 11.888 -12.978 5.105 1.00 1.61 N ATOM 2465 CA ARG A1208 12.809 -13.957 5.715 1.00 1.73 C ATOM 2466 C ARG A1208 13.539 -13.421 6.955 1.00 1.86 C ATOM 2467 O ARG A1208 13.972 -14.216 7.790 1.00 2.15 O ATOM 2468 CB ARG A1208 13.778 -14.451 4.629 1.00 1.72 C ATOM 2469 CG ARG A1208 14.716 -15.580 5.065 1.00 2.26 C ATOM 2470 CD ARG A1208 15.576 -16.006 3.873 1.00 2.58 C ATOM 2471 NE ARG A1208 16.642 -16.929 4.295 1.00 3.59 N ATOM 2472 CZ ARG A1208 17.941 -16.770 4.148 1.00 4.83 C ATOM 2473 NH1 ARG A1208 18.483 -15.737 3.566 1.00 5.51 N ATOM 2474 NH2 ARG A1208 18.734 -17.685 4.615 1.00 5.82 N ATOM 0 H ARG A1208 12.198 -12.675 4.181 1.00 1.61 H new ATOM 0 HA ARG A1208 12.224 -14.795 6.094 1.00 1.73 H new ATOM 0 HB2 ARG A1208 13.197 -14.792 3.772 1.00 1.72 H new ATOM 0 HB3 ARG A1208 14.381 -13.608 4.290 1.00 1.72 H new ATOM 0 HG2 ARG A1208 15.350 -15.246 5.886 1.00 2.26 H new ATOM 0 HG3 ARG A1208 14.138 -16.428 5.434 1.00 2.26 H new ATOM 0 HD2 ARG A1208 14.950 -16.487 3.122 1.00 2.58 H new ATOM 0 HD3 ARG A1208 16.016 -15.126 3.405 1.00 2.58 H new ATOM 0 HE ARG A1208 16.341 -17.789 4.753 1.00 3.59 H new ATOM 0 HH11 ARG A1208 17.892 -14.993 3.193 1.00 5.51 H new ATOM 0 HH12 ARG A1208 19.498 -15.672 3.483 1.00 5.51 H new ATOM 0 HH21 ARG A1208 18.347 -18.504 5.083 1.00 5.82 H new ATOM 0 HH22 ARG A1208 19.744 -17.585 4.514 1.00 5.82 H new ATOM 2488 N LYS A1209 13.637 -12.094 7.137 1.00 1.74 N ATOM 2489 CA LYS A1209 14.079 -11.508 8.428 1.00 1.82 C ATOM 2490 C LYS A1209 13.061 -11.898 9.512 1.00 1.88 C ATOM 2491 O LYS A1209 13.432 -12.397 10.576 1.00 2.33 O ATOM 2492 CB LYS A1209 14.292 -9.983 8.357 1.00 1.73 C ATOM 2493 CG LYS A1209 15.220 -9.477 7.237 1.00 2.16 C ATOM 2494 CD LYS A1209 16.504 -10.290 7.035 1.00 1.99 C ATOM 2495 CE LYS A1209 17.419 -9.645 5.989 1.00 2.69 C ATOM 2496 NZ LYS A1209 18.544 -10.546 5.642 1.00 2.65 N ATOM 0 H LYS A1209 13.420 -11.405 6.417 1.00 1.74 H new ATOM 0 HA LYS A1209 15.059 -11.915 8.679 1.00 1.82 H new ATOM 0 HB2 LYS A1209 13.319 -9.507 8.237 1.00 1.73 H new ATOM 0 HB3 LYS A1209 14.695 -9.649 9.313 1.00 1.73 H new ATOM 0 HG2 LYS A1209 14.662 -9.470 6.300 1.00 2.16 H new ATOM 0 HG3 LYS A1209 15.493 -8.444 7.453 1.00 2.16 H new ATOM 0 HD2 LYS A1209 17.036 -10.374 7.983 1.00 1.99 H new ATOM 0 HD3 LYS A1209 16.249 -11.303 6.722 1.00 1.99 H new ATOM 0 HE2 LYS A1209 16.845 -9.412 5.092 1.00 2.69 H new ATOM 0 HE3 LYS A1209 17.808 -8.702 6.373 1.00 2.69 H new ATOM 0 HZ1 LYS A1209 19.213 -10.044 5.024 1.00 2.65 H new ATOM 0 HZ2 LYS A1209 19.032 -10.843 6.511 1.00 2.65 H new ATOM 0 HZ3 LYS A1209 18.178 -11.384 5.147 1.00 2.65 H new ATOM 2510 N GLY A1210 11.783 -11.805 9.153 1.00 1.82 N ATOM 2511 CA GLY A1210 10.630 -12.272 9.934 1.00 1.88 C ATOM 2512 C GLY A1210 9.590 -11.165 10.078 1.00 1.60 C ATOM 2513 O GLY A1210 9.150 -10.862 11.183 1.00 1.83 O ATOM 0 H GLY A1210 11.505 -11.382 8.267 1.00 1.82 H new ATOM 0 HA2 GLY A1210 10.181 -13.138 9.447 1.00 1.88 H new ATOM 0 HA3 GLY A1210 10.961 -12.597 10.920 1.00 1.88 H new ATOM 2517 N ARG A1211 9.297 -10.492 8.959 1.00 1.27 N ATOM 2518 CA ARG A1211 8.463 -9.282 8.829 1.00 1.12 C ATOM 2519 C ARG A1211 7.388 -9.496 7.743 1.00 1.10 C ATOM 2520 O ARG A1211 7.361 -10.554 7.109 1.00 1.50 O ATOM 2521 CB ARG A1211 9.380 -8.088 8.488 1.00 1.09 C ATOM 2522 CG ARG A1211 10.561 -7.824 9.443 1.00 1.54 C ATOM 2523 CD ARG A1211 10.158 -7.583 10.904 1.00 1.96 C ATOM 2524 NE ARG A1211 11.296 -7.065 11.686 1.00 2.10 N ATOM 2525 CZ ARG A1211 11.284 -6.674 12.948 1.00 3.13 C ATOM 2526 NH1 ARG A1211 10.227 -6.714 13.700 1.00 4.56 N ATOM 2527 NH2 ARG A1211 12.348 -6.202 13.515 1.00 3.47 N ATOM 0 H ARG A1211 9.660 -10.796 8.055 1.00 1.27 H new ATOM 0 HA ARG A1211 7.945 -9.075 9.765 1.00 1.12 H new ATOM 0 HB2 ARG A1211 9.781 -8.243 7.486 1.00 1.09 H new ATOM 0 HB3 ARG A1211 8.766 -7.188 8.450 1.00 1.09 H new ATOM 0 HG2 ARG A1211 11.241 -8.675 9.403 1.00 1.54 H new ATOM 0 HG3 ARG A1211 11.115 -6.956 9.084 1.00 1.54 H new ATOM 0 HD2 ARG A1211 9.331 -6.874 10.945 1.00 1.96 H new ATOM 0 HD3 ARG A1211 9.802 -8.514 11.345 1.00 1.96 H new ATOM 0 HE ARG A1211 12.190 -7.002 11.199 1.00 2.10 H new ATOM 0 HH11 ARG A1211 9.345 -7.061 13.322 1.00 4.56 H new ATOM 0 HH12 ARG A1211 10.278 -6.398 14.669 1.00 4.56 H new ATOM 0 HH21 ARG A1211 13.217 -6.126 12.986 1.00 3.47 H new ATOM 0 HH22 ARG A1211 12.317 -5.906 14.491 1.00 3.47 H new ATOM 2541 N THR A1212 6.514 -8.521 7.486 1.00 0.97 N ATOM 2542 CA THR A1212 5.471 -8.608 6.438 1.00 1.00 C ATOM 2543 C THR A1212 5.802 -7.735 5.226 1.00 0.90 C ATOM 2544 O THR A1212 6.253 -6.607 5.396 1.00 0.89 O ATOM 2545 CB THR A1212 4.096 -8.260 7.033 1.00 1.12 C ATOM 2546 OG1 THR A1212 3.682 -9.354 7.815 1.00 1.56 O ATOM 2547 CG2 THR A1212 2.978 -8.030 6.016 1.00 1.13 C ATOM 0 H THR A1212 6.502 -7.639 7.998 1.00 0.97 H new ATOM 0 HA THR A1212 5.439 -9.635 6.075 1.00 1.00 H new ATOM 0 HB THR A1212 4.240 -7.326 7.576 1.00 1.12 H new ATOM 0 HG1 THR A1212 2.806 -9.161 8.210 1.00 1.56 H new ATOM 0 HG21 THR A1212 2.053 -7.791 6.540 1.00 1.13 H new ATOM 0 HG22 THR A1212 3.247 -7.202 5.360 1.00 1.13 H new ATOM 0 HG23 THR A1212 2.836 -8.932 5.421 1.00 1.13 H new ATOM 2555 N ALA A1213 5.539 -8.223 4.009 1.00 0.85 N ATOM 2556 CA ALA A1213 5.670 -7.457 2.763 1.00 0.69 C ATOM 2557 C ALA A1213 4.385 -7.499 1.914 1.00 0.64 C ATOM 2558 O ALA A1213 3.806 -8.572 1.710 1.00 0.67 O ATOM 2559 CB ALA A1213 6.888 -7.961 1.981 1.00 0.78 C ATOM 0 H ALA A1213 5.223 -9.181 3.859 1.00 0.85 H new ATOM 0 HA ALA A1213 5.824 -6.408 3.017 1.00 0.69 H new ATOM 0 HB1 ALA A1213 6.987 -7.393 1.056 1.00 0.78 H new ATOM 0 HB2 ALA A1213 7.787 -7.831 2.584 1.00 0.78 H new ATOM 0 HB3 ALA A1213 6.758 -9.017 1.746 1.00 0.78 H new ATOM 2565 N VAL A1214 3.941 -6.342 1.410 1.00 0.60 N ATOM 2566 CA VAL A1214 2.722 -6.172 0.590 1.00 0.60 C ATOM 2567 C VAL A1214 2.957 -5.221 -0.587 1.00 0.57 C ATOM 2568 O VAL A1214 3.807 -4.331 -0.522 1.00 0.57 O ATOM 2569 CB VAL A1214 1.516 -5.683 1.427 1.00 0.68 C ATOM 2570 CG1 VAL A1214 1.092 -6.734 2.456 1.00 1.38 C ATOM 2571 CG2 VAL A1214 1.763 -4.355 2.153 1.00 0.79 C ATOM 0 H VAL A1214 4.434 -5.462 1.564 1.00 0.60 H new ATOM 0 HA VAL A1214 2.484 -7.160 0.197 1.00 0.60 H new ATOM 0 HB VAL A1214 0.720 -5.519 0.701 1.00 0.68 H new ATOM 0 HG11 VAL A1214 0.243 -6.361 3.028 1.00 1.38 H new ATOM 0 HG12 VAL A1214 0.808 -7.652 1.942 1.00 1.38 H new ATOM 0 HG13 VAL A1214 1.923 -6.938 3.131 1.00 1.38 H new ATOM 0 HG21 VAL A1214 0.873 -4.078 2.718 1.00 0.79 H new ATOM 0 HG22 VAL A1214 2.606 -4.465 2.835 1.00 0.79 H new ATOM 0 HG23 VAL A1214 1.986 -3.577 1.423 1.00 0.79 H new ATOM 2581 N LEU A1215 2.198 -5.405 -1.667 1.00 0.56 N ATOM 2582 CA LEU A1215 2.256 -4.604 -2.892 1.00 0.54 C ATOM 2583 C LEU A1215 1.080 -3.615 -2.946 1.00 0.35 C ATOM 2584 O LEU A1215 0.020 -3.850 -2.360 1.00 0.48 O ATOM 2585 CB LEU A1215 2.239 -5.489 -4.155 1.00 0.98 C ATOM 2586 CG LEU A1215 3.290 -6.599 -4.341 1.00 1.13 C ATOM 2587 CD1 LEU A1215 3.226 -7.723 -3.302 1.00 2.80 C ATOM 2588 CD2 LEU A1215 3.034 -7.258 -5.701 1.00 1.78 C ATOM 0 H LEU A1215 1.498 -6.145 -1.716 1.00 0.56 H new ATOM 0 HA LEU A1215 3.196 -4.053 -2.872 1.00 0.54 H new ATOM 0 HB2 LEU A1215 1.258 -5.962 -4.204 1.00 0.98 H new ATOM 0 HB3 LEU A1215 2.316 -4.824 -5.016 1.00 0.98 H new ATOM 0 HG LEU A1215 4.262 -6.116 -4.245 1.00 1.13 H new ATOM 0 HD11 LEU A1215 4.003 -8.458 -3.513 1.00 2.80 H new ATOM 0 HD12 LEU A1215 3.381 -7.307 -2.306 1.00 2.80 H new ATOM 0 HD13 LEU A1215 2.249 -8.204 -3.347 1.00 2.80 H new ATOM 0 HD21 LEU A1215 3.764 -8.051 -5.864 1.00 1.78 H new ATOM 0 HD22 LEU A1215 2.029 -7.680 -5.717 1.00 1.78 H new ATOM 0 HD23 LEU A1215 3.127 -6.512 -6.490 1.00 1.78 H new ATOM 2600 N VAL A1216 1.244 -2.545 -3.725 1.00 0.36 N ATOM 2601 CA VAL A1216 0.184 -1.586 -4.068 1.00 0.38 C ATOM 2602 C VAL A1216 0.047 -1.504 -5.590 1.00 0.33 C ATOM 2603 O VAL A1216 1.049 -1.452 -6.314 1.00 0.36 O ATOM 2604 CB VAL A1216 0.439 -0.195 -3.452 1.00 0.46 C ATOM 2605 CG1 VAL A1216 -0.805 0.695 -3.587 1.00 0.51 C ATOM 2606 CG2 VAL A1216 0.789 -0.269 -1.958 1.00 0.56 C ATOM 0 H VAL A1216 2.142 -2.312 -4.149 1.00 0.36 H new ATOM 0 HA VAL A1216 -0.754 -1.943 -3.642 1.00 0.38 H new ATOM 0 HB VAL A1216 1.283 0.223 -4.000 1.00 0.46 H new ATOM 0 HG11 VAL A1216 -0.603 1.671 -3.146 1.00 0.51 H new ATOM 0 HG12 VAL A1216 -1.052 0.817 -4.642 1.00 0.51 H new ATOM 0 HG13 VAL A1216 -1.644 0.229 -3.069 1.00 0.51 H new ATOM 0 HG21 VAL A1216 0.959 0.737 -1.574 1.00 0.56 H new ATOM 0 HG22 VAL A1216 -0.035 -0.731 -1.414 1.00 0.56 H new ATOM 0 HG23 VAL A1216 1.692 -0.865 -1.825 1.00 0.56 H new ATOM 2616 N ALA A1217 -1.194 -1.499 -6.078 1.00 0.32 N ATOM 2617 CA ALA A1217 -1.529 -1.426 -7.498 1.00 0.34 C ATOM 2618 C ALA A1217 -2.680 -0.442 -7.761 1.00 0.36 C ATOM 2619 O ALA A1217 -3.588 -0.302 -6.940 1.00 0.37 O ATOM 2620 CB ALA A1217 -1.866 -2.834 -7.999 1.00 0.47 C ATOM 0 H ALA A1217 -2.017 -1.547 -5.477 1.00 0.32 H new ATOM 0 HA ALA A1217 -0.670 -1.044 -8.049 1.00 0.34 H new ATOM 0 HB1 ALA A1217 -2.118 -2.793 -9.059 1.00 0.47 H new ATOM 0 HB2 ALA A1217 -1.005 -3.487 -7.856 1.00 0.47 H new ATOM 0 HB3 ALA A1217 -2.715 -3.226 -7.439 1.00 0.47 H new ATOM 2626 N VAL A1218 -2.648 0.223 -8.918 1.00 0.44 N ATOM 2627 CA VAL A1218 -3.582 1.289 -9.318 1.00 0.53 C ATOM 2628 C VAL A1218 -4.000 1.087 -10.771 1.00 0.66 C ATOM 2629 O VAL A1218 -3.150 0.870 -11.619 1.00 0.83 O ATOM 2630 CB VAL A1218 -2.946 2.685 -9.163 1.00 0.62 C ATOM 2631 CG1 VAL A1218 -3.964 3.788 -9.492 1.00 0.69 C ATOM 2632 CG2 VAL A1218 -2.463 2.943 -7.729 1.00 0.62 C ATOM 0 H VAL A1218 -1.946 0.030 -9.632 1.00 0.44 H new ATOM 0 HA VAL A1218 -4.452 1.234 -8.664 1.00 0.53 H new ATOM 0 HB VAL A1218 -2.101 2.707 -9.851 1.00 0.62 H new ATOM 0 HG11 VAL A1218 -3.493 4.764 -9.376 1.00 0.69 H new ATOM 0 HG12 VAL A1218 -4.308 3.671 -10.520 1.00 0.69 H new ATOM 0 HG13 VAL A1218 -4.814 3.712 -8.814 1.00 0.69 H new ATOM 0 HG21 VAL A1218 -2.022 3.938 -7.667 1.00 0.62 H new ATOM 0 HG22 VAL A1218 -3.308 2.877 -7.043 1.00 0.62 H new ATOM 0 HG23 VAL A1218 -1.716 2.198 -7.457 1.00 0.62 H new ATOM 2642 N ASP A1219 -5.295 1.167 -11.072 1.00 0.73 N ATOM 2643 CA ASP A1219 -5.872 1.052 -12.425 1.00 0.89 C ATOM 2644 C ASP A1219 -5.448 -0.221 -13.202 1.00 0.80 C ATOM 2645 O ASP A1219 -5.437 -0.254 -14.436 1.00 1.06 O ATOM 2646 CB ASP A1219 -5.607 2.367 -13.184 1.00 1.35 C ATOM 2647 CG ASP A1219 -6.612 2.628 -14.303 1.00 1.69 C ATOM 2648 OD1 ASP A1219 -7.825 2.397 -14.079 1.00 1.50 O ATOM 2649 OD2 ASP A1219 -6.213 3.139 -15.377 1.00 3.20 O ATOM 0 H ASP A1219 -6.006 1.320 -10.356 1.00 0.73 H new ATOM 0 HA ASP A1219 -6.948 0.910 -12.327 1.00 0.89 H new ATOM 0 HB2 ASP A1219 -5.634 3.198 -12.479 1.00 1.35 H new ATOM 0 HB3 ASP A1219 -4.602 2.339 -13.606 1.00 1.35 H new ATOM 2654 N ASP A1220 -5.174 -1.299 -12.455 1.00 0.72 N ATOM 2655 CA ASP A1220 -4.570 -2.567 -12.902 1.00 0.87 C ATOM 2656 C ASP A1220 -3.101 -2.456 -13.412 1.00 0.90 C ATOM 2657 O ASP A1220 -2.661 -3.201 -14.292 1.00 1.11 O ATOM 2658 CB ASP A1220 -5.547 -3.381 -13.777 1.00 1.20 C ATOM 2659 CG ASP A1220 -6.881 -3.645 -13.063 1.00 2.16 C ATOM 2660 OD1 ASP A1220 -6.899 -4.362 -12.037 1.00 3.20 O ATOM 2661 OD2 ASP A1220 -7.945 -3.139 -13.493 1.00 2.91 O ATOM 0 H ASP A1220 -5.381 -1.312 -11.456 1.00 0.72 H new ATOM 0 HA ASP A1220 -4.419 -3.177 -12.011 1.00 0.87 H new ATOM 0 HB2 ASP A1220 -5.734 -2.843 -14.706 1.00 1.20 H new ATOM 0 HB3 ASP A1220 -5.086 -4.331 -14.046 1.00 1.20 H new ATOM 2666 N GLU A1221 -2.314 -1.566 -12.797 1.00 0.83 N ATOM 2667 CA GLU A1221 -0.857 -1.371 -12.941 1.00 0.88 C ATOM 2668 C GLU A1221 -0.135 -1.438 -11.576 1.00 0.72 C ATOM 2669 O GLU A1221 -0.658 -0.953 -10.570 1.00 0.69 O ATOM 2670 CB GLU A1221 -0.601 -0.015 -13.640 1.00 1.04 C ATOM 2671 CG GLU A1221 -0.711 -0.132 -15.171 1.00 1.62 C ATOM 2672 CD GLU A1221 0.586 -0.644 -15.808 1.00 2.45 C ATOM 2673 OE1 GLU A1221 0.747 -1.883 -15.948 1.00 3.63 O ATOM 2674 OE2 GLU A1221 1.453 0.201 -16.159 1.00 2.89 O ATOM 0 H GLU A1221 -2.708 -0.905 -12.128 1.00 0.83 H new ATOM 0 HA GLU A1221 -0.450 -2.178 -13.550 1.00 0.88 H new ATOM 0 HB2 GLU A1221 -1.319 0.721 -13.279 1.00 1.04 H new ATOM 0 HB3 GLU A1221 0.391 0.350 -13.374 1.00 1.04 H new ATOM 0 HG2 GLU A1221 -1.529 -0.807 -15.424 1.00 1.62 H new ATOM 0 HG3 GLU A1221 -0.960 0.843 -15.591 1.00 1.62 H new ATOM 2681 N LEU A1222 1.075 -2.016 -11.513 1.00 0.70 N ATOM 2682 CA LEU A1222 1.948 -1.956 -10.324 1.00 0.61 C ATOM 2683 C LEU A1222 2.237 -0.495 -9.962 1.00 0.59 C ATOM 2684 O LEU A1222 2.568 0.283 -10.857 1.00 0.77 O ATOM 2685 CB LEU A1222 3.305 -2.667 -10.591 1.00 0.70 C ATOM 2686 CG LEU A1222 3.666 -3.857 -9.684 1.00 1.03 C ATOM 2687 CD1 LEU A1222 3.801 -3.448 -8.217 1.00 1.16 C ATOM 2688 CD2 LEU A1222 2.651 -4.996 -9.778 1.00 1.52 C ATOM 0 H LEU A1222 1.480 -2.541 -12.288 1.00 0.70 H new ATOM 0 HA LEU A1222 1.430 -2.458 -9.507 1.00 0.61 H new ATOM 0 HB2 LEU A1222 3.306 -3.017 -11.623 1.00 0.70 H new ATOM 0 HB3 LEU A1222 4.098 -1.924 -10.505 1.00 0.70 H new ATOM 0 HG LEU A1222 4.630 -4.209 -10.051 1.00 1.03 H new ATOM 0 HD11 LEU A1222 4.056 -4.322 -7.618 1.00 1.16 H new ATOM 0 HD12 LEU A1222 4.586 -2.699 -8.119 1.00 1.16 H new ATOM 0 HD13 LEU A1222 2.856 -3.031 -7.867 1.00 1.16 H new ATOM 0 HD21 LEU A1222 2.954 -5.809 -9.118 1.00 1.52 H new ATOM 0 HD22 LEU A1222 1.668 -4.633 -9.478 1.00 1.52 H new ATOM 0 HD23 LEU A1222 2.606 -5.359 -10.805 1.00 1.52 H new ATOM 2700 N CYS A1223 2.204 -0.142 -8.673 1.00 0.48 N ATOM 2701 CA CYS A1223 2.595 1.198 -8.231 1.00 0.48 C ATOM 2702 C CYS A1223 3.587 1.230 -7.053 1.00 0.47 C ATOM 2703 O CYS A1223 4.355 2.189 -6.961 1.00 0.51 O ATOM 2704 CB CYS A1223 1.333 2.057 -8.044 1.00 0.53 C ATOM 2705 SG CYS A1223 0.820 2.135 -6.307 1.00 0.46 S ATOM 0 H CYS A1223 1.911 -0.765 -7.920 1.00 0.48 H new ATOM 0 HA CYS A1223 3.194 1.652 -9.020 1.00 0.48 H new ATOM 0 HB2 CYS A1223 1.522 3.065 -8.412 1.00 0.53 H new ATOM 0 HB3 CYS A1223 0.521 1.645 -8.644 1.00 0.53 H new ATOM 0 HG CYS A1223 -0.110 3.033 -6.169 1.00 0.46 H new ATOM 2711 N GLY A1224 3.671 0.197 -6.199 1.00 0.49 N ATOM 2712 CA GLY A1224 4.641 0.202 -5.098 1.00 0.55 C ATOM 2713 C GLY A1224 4.683 -1.079 -4.270 1.00 0.59 C ATOM 2714 O GLY A1224 3.931 -2.022 -4.516 1.00 0.62 O ATOM 0 H GLY A1224 3.088 -0.638 -6.250 1.00 0.49 H new ATOM 0 HA2 GLY A1224 5.634 0.384 -5.509 1.00 0.55 H new ATOM 0 HA3 GLY A1224 4.412 1.037 -4.436 1.00 0.55 H new ATOM 2718 N LEU A1225 5.579 -1.098 -3.283 1.00 0.64 N ATOM 2719 CA LEU A1225 5.702 -2.144 -2.268 1.00 0.71 C ATOM 2720 C LEU A1225 6.057 -1.573 -0.882 1.00 0.78 C ATOM 2721 O LEU A1225 6.715 -0.535 -0.768 1.00 0.87 O ATOM 2722 CB LEU A1225 6.671 -3.250 -2.729 1.00 0.77 C ATOM 2723 CG LEU A1225 8.154 -2.848 -2.872 1.00 0.82 C ATOM 2724 CD1 LEU A1225 9.023 -4.092 -2.744 1.00 1.70 C ATOM 2725 CD2 LEU A1225 8.498 -2.228 -4.227 1.00 1.67 C ATOM 0 H LEU A1225 6.267 -0.354 -3.164 1.00 0.64 H new ATOM 0 HA LEU A1225 4.723 -2.609 -2.150 1.00 0.71 H new ATOM 0 HB2 LEU A1225 6.608 -4.076 -2.021 1.00 0.77 H new ATOM 0 HB3 LEU A1225 6.325 -3.628 -3.691 1.00 0.77 H new ATOM 0 HG LEU A1225 8.336 -2.109 -2.092 1.00 0.82 H new ATOM 0 HD11 LEU A1225 10.072 -3.815 -2.844 1.00 1.70 H new ATOM 0 HD12 LEU A1225 8.860 -4.551 -1.769 1.00 1.70 H new ATOM 0 HD13 LEU A1225 8.759 -4.802 -3.527 1.00 1.70 H new ATOM 0 HD21 LEU A1225 9.557 -1.972 -4.252 1.00 1.67 H new ATOM 0 HD22 LEU A1225 8.279 -2.943 -5.020 1.00 1.67 H new ATOM 0 HD23 LEU A1225 7.903 -1.327 -4.376 1.00 1.67 H new ATOM 2737 N ILE A1226 5.620 -2.266 0.172 1.00 0.75 N ATOM 2738 CA ILE A1226 5.710 -1.844 1.576 1.00 0.79 C ATOM 2739 C ILE A1226 6.185 -3.018 2.443 1.00 0.75 C ATOM 2740 O ILE A1226 5.617 -4.107 2.369 1.00 0.69 O ATOM 2741 CB ILE A1226 4.338 -1.322 2.082 1.00 0.79 C ATOM 2742 CG1 ILE A1226 3.722 -0.272 1.122 1.00 0.86 C ATOM 2743 CG2 ILE A1226 4.486 -0.793 3.523 1.00 0.89 C ATOM 2744 CD1 ILE A1226 2.407 0.362 1.595 1.00 0.92 C ATOM 0 H ILE A1226 5.174 -3.177 0.068 1.00 0.75 H new ATOM 0 HA ILE A1226 6.432 -1.031 1.650 1.00 0.79 H new ATOM 0 HB ILE A1226 3.632 -2.152 2.095 1.00 0.79 H new ATOM 0 HG12 ILE A1226 4.452 0.522 0.963 1.00 0.86 H new ATOM 0 HG13 ILE A1226 3.550 -0.745 0.155 1.00 0.86 H new ATOM 0 HG21 ILE A1226 3.522 -0.427 3.877 1.00 0.89 H new ATOM 0 HG22 ILE A1226 4.829 -1.598 4.173 1.00 0.89 H new ATOM 0 HG23 ILE A1226 5.211 0.020 3.539 1.00 0.89 H new ATOM 0 HD11 ILE A1226 2.062 1.081 0.852 1.00 0.92 H new ATOM 0 HD12 ILE A1226 1.654 -0.416 1.725 1.00 0.92 H new ATOM 0 HD13 ILE A1226 2.570 0.871 2.545 1.00 0.92 H new ATOM 2756 N ALA A1227 7.181 -2.786 3.304 1.00 0.83 N ATOM 2757 CA ALA A1227 7.648 -3.728 4.322 1.00 0.81 C ATOM 2758 C ALA A1227 7.284 -3.229 5.737 1.00 0.82 C ATOM 2759 O ALA A1227 7.663 -2.122 6.132 1.00 0.88 O ATOM 2760 CB ALA A1227 9.151 -3.968 4.131 1.00 0.88 C ATOM 0 H ALA A1227 7.700 -1.908 3.310 1.00 0.83 H new ATOM 0 HA ALA A1227 7.145 -4.688 4.208 1.00 0.81 H new ATOM 0 HB1 ALA A1227 9.506 -4.669 4.886 1.00 0.88 H new ATOM 0 HB2 ALA A1227 9.330 -4.382 3.139 1.00 0.88 H new ATOM 0 HB3 ALA A1227 9.686 -3.024 4.232 1.00 0.88 H new ATOM 2766 N ILE A1228 6.571 -4.057 6.503 1.00 0.83 N ATOM 2767 CA ILE A1228 5.896 -3.766 7.781 1.00 0.93 C ATOM 2768 C ILE A1228 6.498 -4.617 8.914 1.00 0.94 C ATOM 2769 O ILE A1228 6.790 -5.795 8.699 1.00 0.94 O ATOM 2770 CB ILE A1228 4.378 -4.037 7.615 1.00 1.16 C ATOM 2771 CG1 ILE A1228 3.782 -3.212 6.446 1.00 1.32 C ATOM 2772 CG2 ILE A1228 3.609 -3.763 8.917 1.00 1.55 C ATOM 2773 CD1 ILE A1228 2.286 -3.430 6.183 1.00 1.51 C ATOM 0 H ILE A1228 6.436 -5.030 6.228 1.00 0.83 H new ATOM 0 HA ILE A1228 6.043 -2.720 8.050 1.00 0.93 H new ATOM 0 HB ILE A1228 4.266 -5.095 7.376 1.00 1.16 H new ATOM 0 HG12 ILE A1228 3.948 -2.154 6.649 1.00 1.32 H new ATOM 0 HG13 ILE A1228 4.332 -3.452 5.536 1.00 1.32 H new ATOM 0 HG21 ILE A1228 2.549 -3.964 8.763 1.00 1.55 H new ATOM 0 HG22 ILE A1228 3.989 -4.410 9.707 1.00 1.55 H new ATOM 0 HG23 ILE A1228 3.743 -2.721 9.206 1.00 1.55 H new ATOM 0 HD11 ILE A1228 1.969 -2.807 5.347 1.00 1.51 H new ATOM 0 HD12 ILE A1228 2.108 -4.478 5.943 1.00 1.51 H new ATOM 0 HD13 ILE A1228 1.717 -3.160 7.073 1.00 1.51 H new ATOM 2785 N ALA A1229 6.686 -4.036 10.105 1.00 1.08 N ATOM 2786 CA ALA A1229 7.386 -4.667 11.231 1.00 1.14 C ATOM 2787 C ALA A1229 6.771 -4.327 12.605 1.00 1.32 C ATOM 2788 O ALA A1229 6.416 -3.174 12.862 1.00 1.45 O ATOM 2789 CB ALA A1229 8.848 -4.207 11.180 1.00 1.23 C ATOM 0 H ALA A1229 6.350 -3.097 10.317 1.00 1.08 H new ATOM 0 HA ALA A1229 7.297 -5.748 11.128 1.00 1.14 H new ATOM 0 HB1 ALA A1229 9.400 -4.658 12.005 1.00 1.23 H new ATOM 0 HB2 ALA A1229 9.293 -4.515 10.234 1.00 1.23 H new ATOM 0 HB3 ALA A1229 8.891 -3.121 11.265 1.00 1.23 H new