USER MOD reduce.3.24.130724 H: found=0, std=0, add=982, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 983 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: A 55 GLN : amide:sc= -2.43! K(o=-4.6!,f=-0.095) USER MOD Set 1.2: A 120 GLN : amide:sc= -2.13 K(o=-4.6,f=-0.044) USER MOD Set 2.1: A 83 MET CE :methyl -162:sc= -2.27 (180deg=-2.58!) USER MOD Set 2.2: A 85 TYR OH : rot -179:sc= -1.58 USER MOD Set 3.1: A 63 THR OG1 : rot -135:sc= -1.04! USER MOD Set 3.2: A 76 LYS NZ :NH3+ -161:sc= -0.27! (180deg=-0.154) USER MOD Set 4.1: A 40 ASN : amide:sc= -1.75 K(o=-2,f=-3.7) USER MOD Set 4.2: A 62 HIS : no HD1:sc= -0.203 K(o=-2,f=-2.7) USER MOD Set 5.1: A 38 GLN : amide:sc= -2.96! C(o=-3.2!,f=-2.8!) USER MOD Set 5.2: A 44 SER OG : rot -30:sc= -0.205 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 67:sc= 1.18 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ -139:sc= -0.642 (180deg=-2.88!) USER MOD Single : A 30 TYR OH : rot 121:sc= -3.13! USER MOD Single : A 35 THR OG1 : rot -73:sc= 0.335 USER MOD Single : A 49 ASN : amide:sc= -1.04 K(o=-1,f=-4.3!) USER MOD Single : A 51 SER OG : rot -170:sc= 0.0485 USER MOD Single : A 56 ASN : amide:sc= -2.69! C(o=-2.7!,f=-8.1!) USER MOD Single : A 58 SER OG : rot 180:sc= -0.359 USER MOD Single : A 69 ASN : amide:sc= -0.763 X(o=-0.76,f=-0.5!) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= -7.52! C(o=-7.5!,f=-4.1!) USER MOD Single : A 73 THR OG1 : rot -176:sc= -2.25! USER MOD Single : A 74 ASN : amide:sc= -1.05 K(o=-1.1,f=-10!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ -157:sc= -1.64! (180deg=-2.33!) USER MOD Single : A 82 SER OG : rot -79:sc= 1.66 USER MOD Single : A 87 LYS NZ :NH3+ 151:sc= 0 (180deg=-0.021) USER MOD Single : A 90 ASN : amide:sc= -1.27 K(o=-1.3,f=-0.0039) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ -112:sc= -2.04 (180deg=-4.69!) USER MOD Single : A 95 TYR OH : rot 130:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot -48:sc= 0.71 USER MOD Single : A 99 SER OG : rot 45:sc= 0.0707 USER MOD Single : A 119 LYS NZ :NH3+ -176:sc= -2.6! (180deg=-2.77) USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= -0.55 USER MOD Single : A 126 CYS SG : rot -70:sc= -2.55! USER MOD Single : A 129 TYR OH : rot 155:sc= -1.33 USER MOD Single : A 130 ASN : amide:sc= -2.19 K(o=-2.2,f=-18!) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 THR OG1 : rot 180:sc= 0.00897 USER MOD Single : A 138 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.112) USER MOD Single : A 140 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.162) USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 100 N ILE A 7 12.425 11.248 3.034 1.00 0.00 N ATOM 101 CA ILE A 7 11.080 11.179 2.398 1.00 0.00 C ATOM 102 C ILE A 7 10.619 12.606 2.044 1.00 0.00 C ATOM 103 O ILE A 7 10.621 13.472 2.896 1.00 0.00 O ATOM 104 CB ILE A 7 10.092 10.568 3.397 1.00 0.00 C ATOM 105 CG1 ILE A 7 10.716 9.333 4.055 1.00 0.00 C ATOM 106 CG2 ILE A 7 8.812 10.162 2.667 1.00 0.00 C ATOM 107 CD1 ILE A 7 9.732 8.747 5.066 1.00 0.00 C ATOM 0 HA ILE A 7 11.124 10.569 1.495 1.00 0.00 H new ATOM 0 HB ILE A 7 9.857 11.305 4.164 1.00 0.00 H new ATOM 0 HG12 ILE A 7 10.963 8.589 3.298 1.00 0.00 H new ATOM 0 HG13 ILE A 7 11.648 9.603 4.552 1.00 0.00 H new ATOM 0 HG21 ILE A 7 8.110 9.727 3.378 1.00 0.00 H new ATOM 0 HG22 ILE A 7 8.363 11.041 2.204 1.00 0.00 H new ATOM 0 HG23 ILE A 7 9.049 9.428 1.897 1.00 0.00 H new ATOM 0 HD11 ILE A 7 10.173 7.868 5.536 1.00 0.00 H new ATOM 0 HD12 ILE A 7 9.507 9.492 5.829 1.00 0.00 H new ATOM 0 HD13 ILE A 7 8.812 8.462 4.555 1.00 0.00 H new ATOM 119 N PRO A 8 10.219 12.873 0.815 1.00 0.00 N ATOM 120 CA PRO A 8 9.758 14.236 0.423 1.00 0.00 C ATOM 121 C PRO A 8 8.888 14.887 1.503 1.00 0.00 C ATOM 122 O PRO A 8 8.035 14.253 2.093 1.00 0.00 O ATOM 123 CB PRO A 8 8.950 13.979 -0.849 1.00 0.00 C ATOM 124 CG PRO A 8 9.620 12.805 -1.486 1.00 0.00 C ATOM 125 CD PRO A 8 10.157 11.940 -0.334 1.00 0.00 C ATOM 0 HA PRO A 8 10.588 14.928 0.280 1.00 0.00 H new ATOM 0 HB2 PRO A 8 7.906 13.764 -0.620 1.00 0.00 H new ATOM 0 HB3 PRO A 8 8.960 14.847 -1.508 1.00 0.00 H new ATOM 0 HG2 PRO A 8 8.917 12.242 -2.101 1.00 0.00 H new ATOM 0 HG3 PRO A 8 10.430 13.127 -2.141 1.00 0.00 H new ATOM 0 HD2 PRO A 8 9.499 11.096 -0.128 1.00 0.00 H new ATOM 0 HD3 PRO A 8 11.139 11.529 -0.568 1.00 0.00 H new ATOM 133 N LYS A 9 9.098 16.148 1.767 1.00 0.00 N ATOM 134 CA LYS A 9 8.283 16.840 2.806 1.00 0.00 C ATOM 135 C LYS A 9 6.953 17.282 2.192 1.00 0.00 C ATOM 136 O LYS A 9 5.989 17.531 2.886 1.00 0.00 O ATOM 137 CB LYS A 9 9.047 18.063 3.318 1.00 0.00 C ATOM 138 CG LYS A 9 10.472 17.649 3.699 1.00 0.00 C ATOM 139 CD LYS A 9 11.259 18.873 4.187 1.00 0.00 C ATOM 140 CE LYS A 9 10.704 19.365 5.533 1.00 0.00 C ATOM 141 NZ LYS A 9 11.762 20.131 6.252 1.00 0.00 N ATOM 0 H LYS A 9 9.799 16.729 1.308 1.00 0.00 H new ATOM 0 HA LYS A 9 8.091 16.161 3.637 1.00 0.00 H new ATOM 0 HB2 LYS A 9 9.074 18.836 2.550 1.00 0.00 H new ATOM 0 HB3 LYS A 9 8.537 18.489 4.182 1.00 0.00 H new ATOM 0 HG2 LYS A 9 10.443 16.890 4.480 1.00 0.00 H new ATOM 0 HG3 LYS A 9 10.972 17.203 2.840 1.00 0.00 H new ATOM 0 HD2 LYS A 9 12.313 18.617 4.293 1.00 0.00 H new ATOM 0 HD3 LYS A 9 11.198 19.671 3.447 1.00 0.00 H new ATOM 0 HE2 LYS A 9 9.830 19.995 5.370 1.00 0.00 H new ATOM 0 HE3 LYS A 9 10.378 18.518 6.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 11.390 20.465 7.164 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 12.584 19.516 6.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 12.052 20.947 5.676 1.00 0.00 H new ATOM 155 N ASP A 10 6.896 17.379 0.890 1.00 0.00 N ATOM 156 CA ASP A 10 5.631 17.803 0.227 1.00 0.00 C ATOM 157 C ASP A 10 4.655 16.625 0.188 1.00 0.00 C ATOM 158 O ASP A 10 4.837 15.675 -0.547 1.00 0.00 O ATOM 159 CB ASP A 10 5.933 18.263 -1.199 1.00 0.00 C ATOM 160 CG ASP A 10 6.859 19.478 -1.156 1.00 0.00 C ATOM 161 OD1 ASP A 10 7.086 19.986 -0.070 1.00 0.00 O ATOM 162 OD2 ASP A 10 7.325 19.881 -2.209 1.00 0.00 O ATOM 0 H ASP A 10 7.672 17.183 0.258 1.00 0.00 H new ATOM 0 HA ASP A 10 5.185 18.625 0.787 1.00 0.00 H new ATOM 0 HB2 ASP A 10 6.401 17.455 -1.762 1.00 0.00 H new ATOM 0 HB3 ASP A 10 5.007 18.516 -1.715 1.00 0.00 H new ATOM 167 N LYS A 11 3.616 16.689 0.971 1.00 0.00 N ATOM 168 CA LYS A 11 2.617 15.589 0.984 1.00 0.00 C ATOM 169 C LYS A 11 1.974 15.490 -0.401 1.00 0.00 C ATOM 170 O LYS A 11 1.131 14.650 -0.644 1.00 0.00 O ATOM 171 CB LYS A 11 1.534 15.891 2.035 1.00 0.00 C ATOM 172 CG LYS A 11 2.044 15.591 3.466 1.00 0.00 C ATOM 173 CD LYS A 11 2.761 16.821 4.052 1.00 0.00 C ATOM 174 CE LYS A 11 1.736 17.833 4.604 1.00 0.00 C ATOM 175 NZ LYS A 11 1.571 17.615 6.069 1.00 0.00 N ATOM 0 H LYS A 11 3.416 17.462 1.606 1.00 0.00 H new ATOM 0 HA LYS A 11 3.105 14.647 1.234 1.00 0.00 H new ATOM 0 HB2 LYS A 11 1.236 16.937 1.964 1.00 0.00 H new ATOM 0 HB3 LYS A 11 0.647 15.292 1.829 1.00 0.00 H new ATOM 0 HG2 LYS A 11 1.207 15.312 4.106 1.00 0.00 H new ATOM 0 HG3 LYS A 11 2.726 14.741 3.445 1.00 0.00 H new ATOM 0 HD2 LYS A 11 3.438 16.510 4.848 1.00 0.00 H new ATOM 0 HD3 LYS A 11 3.370 17.295 3.282 1.00 0.00 H new ATOM 0 HE2 LYS A 11 2.073 18.852 4.412 1.00 0.00 H new ATOM 0 HE3 LYS A 11 0.779 17.713 4.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 0.881 18.295 6.446 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 1.232 16.647 6.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 2.486 17.750 6.545 1.00 0.00 H new ATOM 189 N SER A 12 2.368 16.352 -1.307 1.00 0.00 N ATOM 190 CA SER A 12 1.790 16.338 -2.688 1.00 0.00 C ATOM 191 C SER A 12 2.907 16.110 -3.707 1.00 0.00 C ATOM 192 O SER A 12 2.998 16.797 -4.705 1.00 0.00 O ATOM 193 CB SER A 12 1.117 17.683 -2.966 1.00 0.00 C ATOM 194 OG SER A 12 2.108 18.641 -3.316 1.00 0.00 O ATOM 0 H SER A 12 3.073 17.072 -1.147 1.00 0.00 H new ATOM 0 HA SER A 12 1.056 15.536 -2.769 1.00 0.00 H new ATOM 0 HB2 SER A 12 0.393 17.580 -3.774 1.00 0.00 H new ATOM 0 HB3 SER A 12 0.567 18.016 -2.086 1.00 0.00 H new ATOM 0 HG SER A 12 2.509 18.398 -4.177 1.00 0.00 H new ATOM 200 N LYS A 13 3.754 15.145 -3.468 1.00 0.00 N ATOM 201 CA LYS A 13 4.866 14.862 -4.430 1.00 0.00 C ATOM 202 C LYS A 13 5.125 13.356 -4.473 1.00 0.00 C ATOM 203 O LYS A 13 5.153 12.685 -3.460 1.00 0.00 O ATOM 204 CB LYS A 13 6.139 15.598 -3.987 1.00 0.00 C ATOM 205 CG LYS A 13 7.257 15.401 -5.037 1.00 0.00 C ATOM 206 CD LYS A 13 8.235 16.586 -5.006 1.00 0.00 C ATOM 207 CE LYS A 13 8.999 16.596 -3.682 1.00 0.00 C ATOM 208 NZ LYS A 13 9.897 17.784 -3.634 1.00 0.00 N ATOM 0 H LYS A 13 3.726 14.538 -2.648 1.00 0.00 H new ATOM 0 HA LYS A 13 4.585 15.211 -5.424 1.00 0.00 H new ATOM 0 HB2 LYS A 13 5.930 16.660 -3.862 1.00 0.00 H new ATOM 0 HB3 LYS A 13 6.468 15.222 -3.018 1.00 0.00 H new ATOM 0 HG2 LYS A 13 7.793 14.473 -4.837 1.00 0.00 H new ATOM 0 HG3 LYS A 13 6.819 15.308 -6.031 1.00 0.00 H new ATOM 0 HD2 LYS A 13 8.934 16.513 -5.839 1.00 0.00 H new ATOM 0 HD3 LYS A 13 7.690 17.522 -5.128 1.00 0.00 H new ATOM 0 HE2 LYS A 13 8.299 16.622 -2.847 1.00 0.00 H new ATOM 0 HE3 LYS A 13 9.583 15.681 -3.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 10.417 17.790 -2.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 10.573 17.740 -4.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 9.329 18.652 -3.712 1.00 0.00 H new ATOM 222 N VAL A 14 5.297 12.821 -5.648 1.00 0.00 N ATOM 223 CA VAL A 14 5.534 11.357 -5.787 1.00 0.00 C ATOM 224 C VAL A 14 6.803 10.935 -5.047 1.00 0.00 C ATOM 225 O VAL A 14 7.901 11.302 -5.416 1.00 0.00 O ATOM 226 CB VAL A 14 5.693 11.014 -7.269 1.00 0.00 C ATOM 227 CG1 VAL A 14 5.742 9.492 -7.451 1.00 0.00 C ATOM 228 CG2 VAL A 14 4.513 11.587 -8.053 1.00 0.00 C ATOM 0 H VAL A 14 5.284 13.339 -6.526 1.00 0.00 H new ATOM 0 HA VAL A 14 4.684 10.828 -5.357 1.00 0.00 H new ATOM 0 HB VAL A 14 6.622 11.447 -7.640 1.00 0.00 H new ATOM 0 HG11 VAL A 14 5.855 9.256 -8.509 1.00 0.00 H new ATOM 0 HG12 VAL A 14 6.588 9.086 -6.896 1.00 0.00 H new ATOM 0 HG13 VAL A 14 4.818 9.051 -7.078 1.00 0.00 H new ATOM 0 HG21 VAL A 14 4.625 11.343 -9.109 1.00 0.00 H new ATOM 0 HG22 VAL A 14 3.584 11.157 -7.678 1.00 0.00 H new ATOM 0 HG23 VAL A 14 4.487 12.670 -7.931 1.00 0.00 H new ATOM 238 N ALA A 15 6.664 10.133 -4.024 1.00 0.00 N ATOM 239 CA ALA A 15 7.860 9.645 -3.282 1.00 0.00 C ATOM 240 C ALA A 15 8.243 8.282 -3.858 1.00 0.00 C ATOM 241 O ALA A 15 9.344 7.800 -3.674 1.00 0.00 O ATOM 242 CB ALA A 15 7.523 9.504 -1.795 1.00 0.00 C ATOM 0 H ALA A 15 5.769 9.795 -3.670 1.00 0.00 H new ATOM 0 HA ALA A 15 8.687 10.348 -3.385 1.00 0.00 H new ATOM 0 HB1 ALA A 15 8.400 9.147 -1.255 1.00 0.00 H new ATOM 0 HB2 ALA A 15 7.222 10.473 -1.397 1.00 0.00 H new ATOM 0 HB3 ALA A 15 6.707 8.792 -1.673 1.00 0.00 H new ATOM 248 N GLY A 16 7.334 7.663 -4.567 1.00 0.00 N ATOM 249 CA GLY A 16 7.627 6.334 -5.176 1.00 0.00 C ATOM 250 C GLY A 16 6.523 5.978 -6.176 1.00 0.00 C ATOM 251 O GLY A 16 5.661 6.781 -6.472 1.00 0.00 O ATOM 0 H GLY A 16 6.398 8.024 -4.750 1.00 0.00 H new ATOM 0 HA2 GLY A 16 8.594 6.357 -5.678 1.00 0.00 H new ATOM 0 HA3 GLY A 16 7.689 5.572 -4.399 1.00 0.00 H new ATOM 255 N TYR A 17 6.542 4.780 -6.705 1.00 0.00 N ATOM 256 CA TYR A 17 5.492 4.379 -7.693 1.00 0.00 C ATOM 257 C TYR A 17 5.254 2.866 -7.591 1.00 0.00 C ATOM 258 O TYR A 17 6.167 2.078 -7.724 1.00 0.00 O ATOM 259 CB TYR A 17 5.976 4.743 -9.122 1.00 0.00 C ATOM 260 CG TYR A 17 5.022 5.713 -9.794 1.00 0.00 C ATOM 261 CD1 TYR A 17 3.774 5.267 -10.244 1.00 0.00 C ATOM 262 CD2 TYR A 17 5.393 7.052 -9.977 1.00 0.00 C ATOM 263 CE1 TYR A 17 2.897 6.158 -10.873 1.00 0.00 C ATOM 264 CE2 TYR A 17 4.516 7.943 -10.605 1.00 0.00 C ATOM 265 CZ TYR A 17 3.267 7.496 -11.053 1.00 0.00 C ATOM 266 OH TYR A 17 2.401 8.374 -11.674 1.00 0.00 O ATOM 0 H TYR A 17 7.237 4.063 -6.496 1.00 0.00 H new ATOM 0 HA TYR A 17 4.560 4.904 -7.482 1.00 0.00 H new ATOM 0 HB2 TYR A 17 6.971 5.185 -9.070 1.00 0.00 H new ATOM 0 HB3 TYR A 17 6.060 3.837 -9.722 1.00 0.00 H new ATOM 0 HD1 TYR A 17 3.488 4.235 -10.106 1.00 0.00 H new ATOM 0 HD2 TYR A 17 6.357 7.396 -9.633 1.00 0.00 H new ATOM 0 HE1 TYR A 17 1.934 5.813 -11.220 1.00 0.00 H new ATOM 0 HE2 TYR A 17 4.802 8.975 -10.744 1.00 0.00 H new ATOM 0 HH TYR A 17 2.812 9.263 -11.718 1.00 0.00 H new ATOM 276 N ILE A 18 4.028 2.457 -7.377 1.00 0.00 N ATOM 277 CA ILE A 18 3.728 0.995 -7.291 1.00 0.00 C ATOM 278 C ILE A 18 3.218 0.530 -8.654 1.00 0.00 C ATOM 279 O ILE A 18 2.583 1.276 -9.374 1.00 0.00 O ATOM 280 CB ILE A 18 2.658 0.739 -6.222 1.00 0.00 C ATOM 281 CG1 ILE A 18 2.455 -0.779 -6.045 1.00 0.00 C ATOM 282 CG2 ILE A 18 1.340 1.387 -6.652 1.00 0.00 C ATOM 283 CD1 ILE A 18 1.796 -1.062 -4.692 1.00 0.00 C ATOM 0 H ILE A 18 3.223 3.072 -7.258 1.00 0.00 H new ATOM 0 HA ILE A 18 4.629 0.446 -7.017 1.00 0.00 H new ATOM 0 HB ILE A 18 2.982 1.171 -5.275 1.00 0.00 H new ATOM 0 HG12 ILE A 18 1.833 -1.168 -6.851 1.00 0.00 H new ATOM 0 HG13 ILE A 18 3.414 -1.293 -6.107 1.00 0.00 H new ATOM 0 HG21 ILE A 18 0.580 1.205 -5.892 1.00 0.00 H new ATOM 0 HG22 ILE A 18 1.484 2.461 -6.771 1.00 0.00 H new ATOM 0 HG23 ILE A 18 1.016 0.957 -7.600 1.00 0.00 H new ATOM 0 HD11 ILE A 18 1.655 -2.136 -4.573 1.00 0.00 H new ATOM 0 HD12 ILE A 18 2.434 -0.689 -3.891 1.00 0.00 H new ATOM 0 HD13 ILE A 18 0.828 -0.562 -4.647 1.00 0.00 H new ATOM 295 N GLU A 19 3.507 -0.685 -9.032 1.00 0.00 N ATOM 296 CA GLU A 19 3.054 -1.175 -10.365 1.00 0.00 C ATOM 297 C GLU A 19 2.829 -2.693 -10.331 1.00 0.00 C ATOM 298 O GLU A 19 3.671 -3.447 -9.885 1.00 0.00 O ATOM 299 CB GLU A 19 4.139 -0.847 -11.391 1.00 0.00 C ATOM 300 CG GLU A 19 3.814 -1.514 -12.730 1.00 0.00 C ATOM 301 CD GLU A 19 4.646 -0.874 -13.843 1.00 0.00 C ATOM 302 OE1 GLU A 19 4.642 0.343 -13.933 1.00 0.00 O ATOM 303 OE2 GLU A 19 5.271 -1.610 -14.587 1.00 0.00 O ATOM 0 H GLU A 19 4.036 -1.358 -8.477 1.00 0.00 H new ATOM 0 HA GLU A 19 2.114 -0.692 -10.631 1.00 0.00 H new ATOM 0 HB2 GLU A 19 4.213 0.233 -11.522 1.00 0.00 H new ATOM 0 HB3 GLU A 19 5.108 -1.191 -11.030 1.00 0.00 H new ATOM 0 HG2 GLU A 19 4.024 -2.582 -12.675 1.00 0.00 H new ATOM 0 HG3 GLU A 19 2.752 -1.409 -12.951 1.00 0.00 H new ATOM 310 N ILE A 20 1.704 -3.144 -10.831 1.00 0.00 N ATOM 311 CA ILE A 20 1.410 -4.611 -10.869 1.00 0.00 C ATOM 312 C ILE A 20 0.629 -4.904 -12.167 1.00 0.00 C ATOM 313 O ILE A 20 -0.383 -4.281 -12.421 1.00 0.00 O ATOM 314 CB ILE A 20 0.556 -5.008 -9.642 1.00 0.00 C ATOM 315 CG1 ILE A 20 1.464 -5.160 -8.422 1.00 0.00 C ATOM 316 CG2 ILE A 20 -0.159 -6.345 -9.889 1.00 0.00 C ATOM 317 CD1 ILE A 20 0.619 -5.245 -7.148 1.00 0.00 C ATOM 0 H ILE A 20 0.969 -2.552 -11.218 1.00 0.00 H new ATOM 0 HA ILE A 20 2.337 -5.185 -10.845 1.00 0.00 H new ATOM 0 HB ILE A 20 -0.187 -4.229 -9.472 1.00 0.00 H new ATOM 0 HG12 ILE A 20 2.076 -6.056 -8.523 1.00 0.00 H new ATOM 0 HG13 ILE A 20 2.147 -4.313 -8.359 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -0.754 -6.606 -9.014 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -0.811 -6.254 -10.758 1.00 0.00 H new ATOM 0 HG23 ILE A 20 0.580 -7.125 -10.071 1.00 0.00 H new ATOM 0 HD11 ILE A 20 1.274 -5.353 -6.284 1.00 0.00 H new ATOM 0 HD12 ILE A 20 0.027 -4.336 -7.043 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -0.046 -6.106 -7.209 1.00 0.00 H new ATOM 329 N PRO A 21 1.069 -5.836 -12.988 1.00 0.00 N ATOM 330 CA PRO A 21 0.352 -6.166 -14.254 1.00 0.00 C ATOM 331 C PRO A 21 -0.901 -7.007 -13.989 1.00 0.00 C ATOM 332 O PRO A 21 -1.943 -6.793 -14.577 1.00 0.00 O ATOM 333 CB PRO A 21 1.388 -6.959 -15.058 1.00 0.00 C ATOM 334 CG PRO A 21 2.236 -7.628 -14.024 1.00 0.00 C ATOM 335 CD PRO A 21 2.276 -6.677 -12.821 1.00 0.00 C ATOM 0 HA PRO A 21 -0.004 -5.278 -14.776 1.00 0.00 H new ATOM 0 HB2 PRO A 21 0.909 -7.689 -15.711 1.00 0.00 H new ATOM 0 HB3 PRO A 21 1.982 -6.303 -15.695 1.00 0.00 H new ATOM 0 HG2 PRO A 21 1.817 -8.594 -13.743 1.00 0.00 H new ATOM 0 HG3 PRO A 21 3.240 -7.815 -14.406 1.00 0.00 H new ATOM 0 HD2 PRO A 21 2.254 -7.224 -11.879 1.00 0.00 H new ATOM 0 HD3 PRO A 21 3.185 -6.075 -12.818 1.00 0.00 H new ATOM 343 N ASP A 22 -0.804 -7.959 -13.103 1.00 0.00 N ATOM 344 CA ASP A 22 -1.983 -8.813 -12.794 1.00 0.00 C ATOM 345 C ASP A 22 -3.188 -7.924 -12.478 1.00 0.00 C ATOM 346 O ASP A 22 -4.316 -8.376 -12.478 1.00 0.00 O ATOM 347 CB ASP A 22 -1.669 -9.701 -11.588 1.00 0.00 C ATOM 348 CG ASP A 22 -2.697 -10.833 -11.503 1.00 0.00 C ATOM 349 OD1 ASP A 22 -3.660 -10.789 -12.248 1.00 0.00 O ATOM 350 OD2 ASP A 22 -2.501 -11.724 -10.692 1.00 0.00 O ATOM 0 H ASP A 22 0.042 -8.182 -12.579 1.00 0.00 H new ATOM 0 HA ASP A 22 -2.213 -9.441 -13.655 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -0.665 -10.114 -11.679 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -1.688 -9.109 -10.673 1.00 0.00 H new ATOM 355 N ALA A 23 -2.960 -6.662 -12.203 1.00 0.00 N ATOM 356 CA ALA A 23 -4.093 -5.736 -11.880 1.00 0.00 C ATOM 357 C ALA A 23 -3.896 -4.406 -12.620 1.00 0.00 C ATOM 358 O ALA A 23 -4.525 -3.418 -12.306 1.00 0.00 O ATOM 359 CB ALA A 23 -4.127 -5.493 -10.361 1.00 0.00 C ATOM 0 H ALA A 23 -2.035 -6.232 -12.188 1.00 0.00 H new ATOM 0 HA ALA A 23 -5.036 -6.181 -12.197 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -4.949 -4.820 -10.119 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -4.270 -6.442 -9.844 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -3.186 -5.045 -10.043 1.00 0.00 H new ATOM 365 N ASP A 24 -3.028 -4.379 -13.598 1.00 0.00 N ATOM 366 CA ASP A 24 -2.784 -3.121 -14.369 1.00 0.00 C ATOM 367 C ASP A 24 -2.673 -1.935 -13.408 1.00 0.00 C ATOM 368 O ASP A 24 -3.285 -0.903 -13.597 1.00 0.00 O ATOM 369 CB ASP A 24 -3.927 -2.885 -15.367 1.00 0.00 C ATOM 370 CG ASP A 24 -5.209 -2.500 -14.625 1.00 0.00 C ATOM 371 OD1 ASP A 24 -5.928 -3.400 -14.221 1.00 0.00 O ATOM 372 OD2 ASP A 24 -5.451 -1.315 -14.474 1.00 0.00 O ATOM 0 H ASP A 24 -2.473 -5.180 -13.899 1.00 0.00 H new ATOM 0 HA ASP A 24 -1.849 -3.219 -14.921 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -3.652 -2.095 -16.065 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -4.096 -3.786 -15.956 1.00 0.00 H new ATOM 377 N ILE A 25 -1.884 -2.082 -12.380 1.00 0.00 N ATOM 378 CA ILE A 25 -1.705 -0.977 -11.393 1.00 0.00 C ATOM 379 C ILE A 25 -0.540 -0.100 -11.829 1.00 0.00 C ATOM 380 O ILE A 25 0.483 -0.584 -12.258 1.00 0.00 O ATOM 381 CB ILE A 25 -1.384 -1.577 -10.026 1.00 0.00 C ATOM 382 CG1 ILE A 25 -2.472 -2.585 -9.641 1.00 0.00 C ATOM 383 CG2 ILE A 25 -1.286 -0.483 -8.962 1.00 0.00 C ATOM 384 CD1 ILE A 25 -3.854 -1.911 -9.601 1.00 0.00 C ATOM 0 H ILE A 25 -1.350 -2.928 -12.179 1.00 0.00 H new ATOM 0 HA ILE A 25 -2.617 -0.383 -11.337 1.00 0.00 H new ATOM 0 HB ILE A 25 -0.421 -2.084 -10.084 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -2.484 -3.406 -10.358 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -2.245 -3.017 -8.666 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -1.057 -0.934 -7.997 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -0.496 0.218 -9.232 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -2.236 0.048 -8.898 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -4.610 -2.647 -9.325 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -3.845 -1.107 -8.865 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -4.088 -1.501 -10.584 1.00 0.00 H new ATOM 396 N LYS A 26 -0.695 1.183 -11.704 1.00 0.00 N ATOM 397 CA LYS A 26 0.389 2.136 -12.082 1.00 0.00 C ATOM 398 C LYS A 26 0.029 3.477 -11.441 1.00 0.00 C ATOM 399 O LYS A 26 -0.595 4.313 -12.066 1.00 0.00 O ATOM 400 CB LYS A 26 0.447 2.321 -13.621 1.00 0.00 C ATOM 401 CG LYS A 26 1.259 1.189 -14.319 1.00 0.00 C ATOM 402 CD LYS A 26 0.311 0.207 -15.036 1.00 0.00 C ATOM 403 CE LYS A 26 1.027 -1.125 -15.316 1.00 0.00 C ATOM 404 NZ LYS A 26 0.814 -2.051 -14.168 1.00 0.00 N ATOM 0 H LYS A 26 -1.543 1.625 -11.349 1.00 0.00 H new ATOM 0 HA LYS A 26 1.357 1.762 -11.747 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -0.567 2.339 -14.022 1.00 0.00 H new ATOM 0 HB3 LYS A 26 0.898 3.286 -13.853 1.00 0.00 H new ATOM 0 HG2 LYS A 26 1.954 1.623 -15.038 1.00 0.00 H new ATOM 0 HG3 LYS A 26 1.856 0.654 -13.581 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -0.572 0.030 -14.421 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -0.035 0.645 -15.972 1.00 0.00 H new ATOM 0 HE2 LYS A 26 0.643 -1.571 -16.234 1.00 0.00 H new ATOM 0 HE3 LYS A 26 2.093 -0.953 -15.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 1.699 -2.558 -13.962 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 0.524 -1.506 -13.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 0.070 -2.737 -14.409 1.00 0.00 H new ATOM 418 N GLU A 27 0.368 3.681 -10.195 1.00 0.00 N ATOM 419 CA GLU A 27 -0.012 4.958 -9.523 1.00 0.00 C ATOM 420 C GLU A 27 1.092 5.401 -8.541 1.00 0.00 C ATOM 421 O GLU A 27 1.802 4.580 -7.995 1.00 0.00 O ATOM 422 CB GLU A 27 -1.312 4.692 -8.749 1.00 0.00 C ATOM 423 CG GLU A 27 -2.528 4.992 -9.633 1.00 0.00 C ATOM 424 CD GLU A 27 -2.645 6.502 -9.851 1.00 0.00 C ATOM 425 OE1 GLU A 27 -3.092 7.179 -8.941 1.00 0.00 O ATOM 426 OE2 GLU A 27 -2.285 6.955 -10.926 1.00 0.00 O ATOM 0 H GLU A 27 0.889 3.022 -9.616 1.00 0.00 H new ATOM 0 HA GLU A 27 -0.145 5.750 -10.260 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -1.341 3.654 -8.419 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -1.343 5.312 -7.853 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -2.428 4.483 -10.592 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -3.435 4.611 -9.163 1.00 0.00 H new ATOM 433 N PRO A 28 1.220 6.693 -8.300 1.00 0.00 N ATOM 434 CA PRO A 28 2.236 7.237 -7.350 1.00 0.00 C ATOM 435 C PRO A 28 1.764 7.161 -5.892 1.00 0.00 C ATOM 436 O PRO A 28 0.590 7.032 -5.618 1.00 0.00 O ATOM 437 CB PRO A 28 2.362 8.695 -7.787 1.00 0.00 C ATOM 438 CG PRO A 28 0.987 9.054 -8.242 1.00 0.00 C ATOM 439 CD PRO A 28 0.426 7.790 -8.904 1.00 0.00 C ATOM 0 HA PRO A 28 3.171 6.678 -7.379 1.00 0.00 H new ATOM 0 HB2 PRO A 28 2.690 9.331 -6.965 1.00 0.00 H new ATOM 0 HB3 PRO A 28 3.091 8.810 -8.589 1.00 0.00 H new ATOM 0 HG2 PRO A 28 0.365 9.365 -7.402 1.00 0.00 H new ATOM 0 HG3 PRO A 28 1.012 9.886 -8.945 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -0.639 7.671 -8.702 1.00 0.00 H new ATOM 0 HD3 PRO A 28 0.544 7.820 -9.987 1.00 0.00 H new ATOM 447 N VAL A 29 2.677 7.256 -4.961 1.00 0.00 N ATOM 448 CA VAL A 29 2.308 7.210 -3.510 1.00 0.00 C ATOM 449 C VAL A 29 3.058 8.333 -2.781 1.00 0.00 C ATOM 450 O VAL A 29 4.238 8.221 -2.508 1.00 0.00 O ATOM 451 CB VAL A 29 2.727 5.849 -2.926 1.00 0.00 C ATOM 452 CG1 VAL A 29 1.633 4.809 -3.186 1.00 0.00 C ATOM 453 CG2 VAL A 29 4.029 5.391 -3.593 1.00 0.00 C ATOM 0 H VAL A 29 3.675 7.365 -5.144 1.00 0.00 H new ATOM 0 HA VAL A 29 1.233 7.340 -3.388 1.00 0.00 H new ATOM 0 HB VAL A 29 2.877 5.951 -1.851 1.00 0.00 H new ATOM 0 HG11 VAL A 29 1.937 3.849 -2.770 1.00 0.00 H new ATOM 0 HG12 VAL A 29 0.705 5.131 -2.714 1.00 0.00 H new ATOM 0 HG13 VAL A 29 1.477 4.706 -4.260 1.00 0.00 H new ATOM 0 HG21 VAL A 29 4.329 4.427 -3.182 1.00 0.00 H new ATOM 0 HG22 VAL A 29 3.873 5.294 -4.667 1.00 0.00 H new ATOM 0 HG23 VAL A 29 4.812 6.125 -3.405 1.00 0.00 H new ATOM 463 N TYR A 30 2.395 9.420 -2.461 1.00 0.00 N ATOM 464 CA TYR A 30 3.106 10.533 -1.753 1.00 0.00 C ATOM 465 C TYR A 30 3.198 10.199 -0.255 1.00 0.00 C ATOM 466 O TYR A 30 2.597 9.249 0.213 1.00 0.00 O ATOM 467 CB TYR A 30 2.361 11.884 -1.949 1.00 0.00 C ATOM 468 CG TYR A 30 1.213 11.740 -2.918 1.00 0.00 C ATOM 469 CD1 TYR A 30 0.009 11.164 -2.496 1.00 0.00 C ATOM 470 CD2 TYR A 30 1.343 12.211 -4.229 1.00 0.00 C ATOM 471 CE1 TYR A 30 -1.067 11.059 -3.386 1.00 0.00 C ATOM 472 CE2 TYR A 30 0.273 12.103 -5.120 1.00 0.00 C ATOM 473 CZ TYR A 30 -0.933 11.529 -4.701 1.00 0.00 C ATOM 474 OH TYR A 30 -1.990 11.431 -5.579 1.00 0.00 O ATOM 0 H TYR A 30 1.407 9.584 -2.656 1.00 0.00 H new ATOM 0 HA TYR A 30 4.106 10.635 -2.174 1.00 0.00 H new ATOM 0 HB2 TYR A 30 1.987 12.238 -0.988 1.00 0.00 H new ATOM 0 HB3 TYR A 30 3.058 12.637 -2.317 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -0.090 10.801 -1.484 1.00 0.00 H new ATOM 0 HD2 TYR A 30 2.271 12.658 -4.552 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -1.997 10.617 -3.061 1.00 0.00 H new ATOM 0 HE2 TYR A 30 0.376 12.463 -6.133 1.00 0.00 H new ATOM 0 HH TYR A 30 -2.234 12.325 -5.898 1.00 0.00 H new ATOM 484 N PRO A 31 3.940 10.981 0.496 1.00 0.00 N ATOM 485 CA PRO A 31 4.101 10.769 1.958 1.00 0.00 C ATOM 486 C PRO A 31 2.993 11.442 2.767 1.00 0.00 C ATOM 487 O PRO A 31 2.614 12.567 2.503 1.00 0.00 O ATOM 488 CB PRO A 31 5.449 11.419 2.244 1.00 0.00 C ATOM 489 CG PRO A 31 5.512 12.575 1.295 1.00 0.00 C ATOM 490 CD PRO A 31 4.716 12.155 0.045 1.00 0.00 C ATOM 0 HA PRO A 31 4.048 9.716 2.236 1.00 0.00 H new ATOM 0 HB2 PRO A 31 5.519 11.751 3.280 1.00 0.00 H new ATOM 0 HB3 PRO A 31 6.270 10.722 2.077 1.00 0.00 H new ATOM 0 HG2 PRO A 31 5.084 13.471 1.745 1.00 0.00 H new ATOM 0 HG3 PRO A 31 6.545 12.810 1.037 1.00 0.00 H new ATOM 0 HD2 PRO A 31 4.063 12.956 -0.301 1.00 0.00 H new ATOM 0 HD3 PRO A 31 5.377 11.902 -0.784 1.00 0.00 H new ATOM 498 N GLY A 32 2.475 10.768 3.755 1.00 0.00 N ATOM 499 CA GLY A 32 1.397 11.377 4.584 1.00 0.00 C ATOM 500 C GLY A 32 0.509 10.285 5.175 1.00 0.00 C ATOM 501 O GLY A 32 0.616 9.128 4.822 1.00 0.00 O ATOM 0 H GLY A 32 2.750 9.824 4.024 1.00 0.00 H new ATOM 0 HA2 GLY A 32 1.836 11.973 5.385 1.00 0.00 H new ATOM 0 HA3 GLY A 32 0.798 12.054 3.975 1.00 0.00 H new ATOM 505 N PRO A 33 -0.375 10.662 6.059 1.00 0.00 N ATOM 506 CA PRO A 33 -1.317 9.711 6.705 1.00 0.00 C ATOM 507 C PRO A 33 -2.468 9.365 5.763 1.00 0.00 C ATOM 508 O PRO A 33 -3.217 10.227 5.358 1.00 0.00 O ATOM 509 CB PRO A 33 -1.818 10.489 7.927 1.00 0.00 C ATOM 510 CG PRO A 33 -1.769 11.922 7.502 1.00 0.00 C ATOM 511 CD PRO A 33 -0.576 12.041 6.543 1.00 0.00 C ATOM 0 HA PRO A 33 -0.855 8.759 6.968 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -2.830 10.190 8.201 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -1.187 10.311 8.798 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -2.696 12.214 7.009 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -1.645 12.580 8.362 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -0.789 12.726 5.722 1.00 0.00 H new ATOM 0 HD3 PRO A 33 0.310 12.420 7.052 1.00 0.00 H new ATOM 519 N ALA A 34 -2.596 8.118 5.398 1.00 0.00 N ATOM 520 CA ALA A 34 -3.693 7.714 4.459 1.00 0.00 C ATOM 521 C ALA A 34 -5.009 8.406 4.846 1.00 0.00 C ATOM 522 O ALA A 34 -5.804 7.878 5.598 1.00 0.00 O ATOM 523 CB ALA A 34 -3.874 6.189 4.502 1.00 0.00 C ATOM 0 H ALA A 34 -1.990 7.358 5.707 1.00 0.00 H new ATOM 0 HA ALA A 34 -3.422 8.018 3.448 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -4.672 5.898 3.819 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -2.945 5.704 4.203 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -4.134 5.882 5.515 1.00 0.00 H new ATOM 529 N THR A 35 -5.234 9.582 4.321 1.00 0.00 N ATOM 530 CA THR A 35 -6.490 10.342 4.620 1.00 0.00 C ATOM 531 C THR A 35 -7.301 10.462 3.321 1.00 0.00 C ATOM 532 O THR A 35 -6.746 10.425 2.241 1.00 0.00 O ATOM 533 CB THR A 35 -6.113 11.742 5.129 1.00 0.00 C ATOM 534 OG1 THR A 35 -4.966 12.200 4.428 1.00 0.00 O ATOM 535 CG2 THR A 35 -5.801 11.685 6.627 1.00 0.00 C ATOM 0 H THR A 35 -4.592 10.058 3.687 1.00 0.00 H new ATOM 0 HA THR A 35 -7.081 9.830 5.379 1.00 0.00 H new ATOM 0 HB THR A 35 -6.947 12.423 4.962 1.00 0.00 H new ATOM 0 HG1 THR A 35 -4.176 11.709 4.737 1.00 0.00 H new ATOM 0 HG21 THR A 35 -5.534 12.681 6.981 1.00 0.00 H new ATOM 0 HG22 THR A 35 -6.678 11.330 7.168 1.00 0.00 H new ATOM 0 HG23 THR A 35 -4.968 11.004 6.799 1.00 0.00 H new ATOM 543 N PRO A 36 -8.602 10.602 3.411 1.00 0.00 N ATOM 544 CA PRO A 36 -9.469 10.720 2.202 1.00 0.00 C ATOM 545 C PRO A 36 -9.181 12.002 1.407 1.00 0.00 C ATOM 546 O PRO A 36 -9.126 11.986 0.193 1.00 0.00 O ATOM 547 CB PRO A 36 -10.904 10.714 2.765 1.00 0.00 C ATOM 548 CG PRO A 36 -10.771 11.128 4.200 1.00 0.00 C ATOM 549 CD PRO A 36 -9.386 10.659 4.658 1.00 0.00 C ATOM 0 HA PRO A 36 -9.294 9.910 1.494 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -11.545 11.403 2.215 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -11.355 9.725 2.682 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -10.869 12.209 4.303 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -11.555 10.677 4.809 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -8.946 11.352 5.375 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -9.435 9.685 5.145 1.00 0.00 H new ATOM 557 N GLU A 37 -8.990 13.110 2.073 1.00 0.00 N ATOM 558 CA GLU A 37 -8.706 14.372 1.331 1.00 0.00 C ATOM 559 C GLU A 37 -7.387 14.230 0.565 1.00 0.00 C ATOM 560 O GLU A 37 -7.150 14.914 -0.411 1.00 0.00 O ATOM 561 CB GLU A 37 -8.613 15.555 2.307 1.00 0.00 C ATOM 562 CG GLU A 37 -7.621 15.244 3.446 1.00 0.00 C ATOM 563 CD GLU A 37 -8.356 14.597 4.625 1.00 0.00 C ATOM 564 OE1 GLU A 37 -8.932 13.541 4.433 1.00 0.00 O ATOM 565 OE2 GLU A 37 -8.331 15.173 5.701 1.00 0.00 O ATOM 0 H GLU A 37 -9.018 13.196 3.089 1.00 0.00 H new ATOM 0 HA GLU A 37 -9.518 14.560 0.628 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -8.293 16.449 1.773 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -9.598 15.768 2.723 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -6.839 14.576 3.085 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -7.131 16.161 3.772 1.00 0.00 H new ATOM 572 N GLN A 38 -6.522 13.347 0.998 1.00 0.00 N ATOM 573 CA GLN A 38 -5.218 13.164 0.292 1.00 0.00 C ATOM 574 C GLN A 38 -5.375 12.080 -0.784 1.00 0.00 C ATOM 575 O GLN A 38 -5.292 12.346 -1.966 1.00 0.00 O ATOM 576 CB GLN A 38 -4.138 12.747 1.320 1.00 0.00 C ATOM 577 CG GLN A 38 -2.781 13.388 0.981 1.00 0.00 C ATOM 578 CD GLN A 38 -2.490 13.248 -0.516 1.00 0.00 C ATOM 579 OE1 GLN A 38 -2.048 14.186 -1.150 1.00 0.00 O ATOM 580 NE2 GLN A 38 -2.720 12.111 -1.111 1.00 0.00 N ATOM 0 H GLN A 38 -6.663 12.745 1.810 1.00 0.00 H new ATOM 0 HA GLN A 38 -4.915 14.096 -0.184 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -4.447 13.048 2.321 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -4.040 11.661 1.330 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -2.788 14.441 1.261 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -1.990 12.910 1.559 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -3.091 11.323 -0.580 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -2.529 12.009 -2.108 1.00 0.00 H new ATOM 589 N LEU A 39 -5.595 10.857 -0.376 1.00 0.00 N ATOM 590 CA LEU A 39 -5.755 9.749 -1.360 1.00 0.00 C ATOM 591 C LEU A 39 -6.682 10.186 -2.491 1.00 0.00 C ATOM 592 O LEU A 39 -6.720 9.581 -3.544 1.00 0.00 O ATOM 593 CB LEU A 39 -6.356 8.530 -0.658 1.00 0.00 C ATOM 594 CG LEU A 39 -5.465 8.106 0.524 1.00 0.00 C ATOM 595 CD1 LEU A 39 -6.288 7.298 1.535 1.00 0.00 C ATOM 596 CD2 LEU A 39 -4.296 7.250 0.021 1.00 0.00 C ATOM 0 H LEU A 39 -5.671 10.578 0.602 1.00 0.00 H new ATOM 0 HA LEU A 39 -4.779 9.495 -1.773 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -7.359 8.764 -0.301 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -6.453 7.705 -1.364 1.00 0.00 H new ATOM 0 HG LEU A 39 -5.074 9.002 1.007 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -5.651 7.001 2.368 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -7.110 7.910 1.906 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.688 6.408 1.050 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -3.672 6.955 0.864 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -4.684 6.359 -0.473 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -3.701 7.827 -0.687 1.00 0.00 H new ATOM 608 N ASN A 40 -7.422 11.240 -2.293 1.00 0.00 N ATOM 609 CA ASN A 40 -8.329 11.712 -3.371 1.00 0.00 C ATOM 610 C ASN A 40 -7.464 12.145 -4.551 1.00 0.00 C ATOM 611 O ASN A 40 -7.888 12.145 -5.690 1.00 0.00 O ATOM 612 CB ASN A 40 -9.142 12.909 -2.858 1.00 0.00 C ATOM 613 CG ASN A 40 -10.420 12.420 -2.165 1.00 0.00 C ATOM 614 OD1 ASN A 40 -10.535 11.259 -1.826 1.00 0.00 O ATOM 615 ND2 ASN A 40 -11.389 13.264 -1.940 1.00 0.00 N ATOM 0 H ASN A 40 -7.437 11.792 -1.435 1.00 0.00 H new ATOM 0 HA ASN A 40 -9.016 10.922 -3.674 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -8.542 13.494 -2.161 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -9.398 13.567 -3.688 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -12.243 12.949 -1.480 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -11.293 14.239 -2.225 1.00 0.00 H new ATOM 622 N ARG A 41 -6.244 12.499 -4.274 1.00 0.00 N ATOM 623 CA ARG A 41 -5.312 12.922 -5.355 1.00 0.00 C ATOM 624 C ARG A 41 -4.623 11.680 -5.914 1.00 0.00 C ATOM 625 O ARG A 41 -3.961 11.724 -6.932 1.00 0.00 O ATOM 626 CB ARG A 41 -4.260 13.875 -4.782 1.00 0.00 C ATOM 627 CG ARG A 41 -4.947 15.132 -4.240 1.00 0.00 C ATOM 628 CD ARG A 41 -3.975 15.899 -3.338 1.00 0.00 C ATOM 629 NE ARG A 41 -4.510 17.275 -3.061 1.00 0.00 N ATOM 630 CZ ARG A 41 -4.740 18.134 -4.021 1.00 0.00 C ATOM 631 NH1 ARG A 41 -4.356 17.880 -5.242 1.00 0.00 N ATOM 632 NH2 ARG A 41 -5.311 19.275 -3.746 1.00 0.00 N ATOM 0 H ARG A 41 -5.847 12.514 -3.335 1.00 0.00 H new ATOM 0 HA ARG A 41 -5.863 13.433 -6.144 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -3.702 13.381 -3.986 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -3.541 14.146 -5.555 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -5.271 15.766 -5.065 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -5.840 14.858 -3.679 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -3.832 15.360 -2.402 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -2.999 15.969 -3.818 1.00 0.00 H new ATOM 0 HE ARG A 41 -4.700 17.548 -2.097 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -3.873 17.007 -5.453 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -4.539 18.555 -5.985 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -5.576 19.494 -2.786 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -5.492 19.947 -4.491 1.00 0.00 H new ATOM 646 N GLY A 42 -4.783 10.568 -5.248 1.00 0.00 N ATOM 647 CA GLY A 42 -4.147 9.307 -5.729 1.00 0.00 C ATOM 648 C GLY A 42 -3.930 8.353 -4.553 1.00 0.00 C ATOM 649 O GLY A 42 -4.836 8.077 -3.790 1.00 0.00 O ATOM 0 H GLY A 42 -5.328 10.478 -4.390 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -4.779 8.834 -6.481 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -3.194 9.530 -6.209 1.00 0.00 H new ATOM 653 N VAL A 43 -2.733 7.838 -4.413 1.00 0.00 N ATOM 654 CA VAL A 43 -2.429 6.879 -3.301 1.00 0.00 C ATOM 655 C VAL A 43 -1.451 7.523 -2.308 1.00 0.00 C ATOM 656 O VAL A 43 -0.706 8.423 -2.641 1.00 0.00 O ATOM 657 CB VAL A 43 -1.789 5.622 -3.905 1.00 0.00 C ATOM 658 CG1 VAL A 43 -1.839 4.465 -2.907 1.00 0.00 C ATOM 659 CG2 VAL A 43 -2.539 5.224 -5.176 1.00 0.00 C ATOM 0 H VAL A 43 -1.945 8.042 -5.027 1.00 0.00 H new ATOM 0 HA VAL A 43 -3.347 6.620 -2.774 1.00 0.00 H new ATOM 0 HB VAL A 43 -0.748 5.841 -4.143 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -1.381 3.581 -3.351 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -1.295 4.740 -2.003 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -2.877 4.247 -2.654 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -2.083 4.331 -5.603 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -3.582 5.018 -4.934 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -2.488 6.039 -5.899 1.00 0.00 H new ATOM 669 N SER A 44 -1.447 7.049 -1.092 1.00 0.00 N ATOM 670 CA SER A 44 -0.525 7.592 -0.052 1.00 0.00 C ATOM 671 C SER A 44 -0.213 6.465 0.933 1.00 0.00 C ATOM 672 O SER A 44 -0.981 5.534 1.073 1.00 0.00 O ATOM 673 CB SER A 44 -1.199 8.750 0.686 1.00 0.00 C ATOM 674 OG SER A 44 -1.744 9.658 -0.262 1.00 0.00 O ATOM 0 H SER A 44 -2.054 6.295 -0.769 1.00 0.00 H new ATOM 0 HA SER A 44 0.391 7.961 -0.513 1.00 0.00 H new ATOM 0 HB2 SER A 44 -1.986 8.372 1.338 1.00 0.00 H new ATOM 0 HB3 SER A 44 -0.476 9.261 1.322 1.00 0.00 H new ATOM 0 HG SER A 44 -1.203 9.642 -1.079 1.00 0.00 H new ATOM 680 N PHE A 45 0.902 6.514 1.610 1.00 0.00 N ATOM 681 CA PHE A 45 1.213 5.404 2.558 1.00 0.00 C ATOM 682 C PHE A 45 0.107 5.284 3.606 1.00 0.00 C ATOM 683 O PHE A 45 -0.749 6.139 3.727 1.00 0.00 O ATOM 684 CB PHE A 45 2.535 5.647 3.285 1.00 0.00 C ATOM 685 CG PHE A 45 3.710 5.540 2.326 1.00 0.00 C ATOM 686 CD1 PHE A 45 3.942 4.356 1.605 1.00 0.00 C ATOM 687 CD2 PHE A 45 4.572 6.631 2.163 1.00 0.00 C ATOM 688 CE1 PHE A 45 5.031 4.276 0.727 1.00 0.00 C ATOM 689 CE2 PHE A 45 5.658 6.547 1.288 1.00 0.00 C ATOM 690 CZ PHE A 45 5.888 5.370 0.568 1.00 0.00 C ATOM 0 H PHE A 45 1.598 7.257 1.551 1.00 0.00 H new ATOM 0 HA PHE A 45 1.287 4.487 1.973 1.00 0.00 H new ATOM 0 HB2 PHE A 45 2.525 6.635 3.745 1.00 0.00 H new ATOM 0 HB3 PHE A 45 2.650 4.921 4.090 1.00 0.00 H new ATOM 0 HD1 PHE A 45 3.282 3.510 1.727 1.00 0.00 H new ATOM 0 HD2 PHE A 45 4.397 7.542 2.716 1.00 0.00 H new ATOM 0 HE1 PHE A 45 5.209 3.367 0.171 1.00 0.00 H new ATOM 0 HE2 PHE A 45 6.320 7.391 1.167 1.00 0.00 H new ATOM 0 HZ PHE A 45 6.726 5.306 -0.110 1.00 0.00 H new ATOM 700 N ALA A 46 0.136 4.232 4.381 1.00 0.00 N ATOM 701 CA ALA A 46 -0.891 4.053 5.442 1.00 0.00 C ATOM 702 C ALA A 46 -0.466 4.863 6.665 1.00 0.00 C ATOM 703 O ALA A 46 -1.146 4.897 7.671 1.00 0.00 O ATOM 704 CB ALA A 46 -0.993 2.573 5.820 1.00 0.00 C ATOM 0 H ALA A 46 0.831 3.488 4.322 1.00 0.00 H new ATOM 0 HA ALA A 46 -1.862 4.393 5.082 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -1.747 2.447 6.597 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -1.277 1.992 4.942 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -0.029 2.225 6.190 1.00 0.00 H new ATOM 710 N GLU A 47 0.663 5.515 6.580 1.00 0.00 N ATOM 711 CA GLU A 47 1.151 6.329 7.731 1.00 0.00 C ATOM 712 C GLU A 47 2.082 7.439 7.231 1.00 0.00 C ATOM 713 O GLU A 47 2.745 7.307 6.221 1.00 0.00 O ATOM 714 CB GLU A 47 1.917 5.435 8.703 1.00 0.00 C ATOM 715 CG GLU A 47 0.960 4.445 9.374 1.00 0.00 C ATOM 716 CD GLU A 47 1.637 3.830 10.600 1.00 0.00 C ATOM 717 OE1 GLU A 47 2.183 4.583 11.390 1.00 0.00 O ATOM 718 OE2 GLU A 47 1.602 2.617 10.728 1.00 0.00 O ATOM 0 H GLU A 47 1.270 5.519 5.760 1.00 0.00 H new ATOM 0 HA GLU A 47 0.294 6.775 8.236 1.00 0.00 H new ATOM 0 HB2 GLU A 47 2.699 4.893 8.171 1.00 0.00 H new ATOM 0 HB3 GLU A 47 2.410 6.046 9.459 1.00 0.00 H new ATOM 0 HG2 GLU A 47 0.042 4.954 9.669 1.00 0.00 H new ATOM 0 HG3 GLU A 47 0.678 3.662 8.670 1.00 0.00 H new ATOM 725 N GLU A 48 2.121 8.535 7.935 1.00 0.00 N ATOM 726 CA GLU A 48 2.986 9.682 7.529 1.00 0.00 C ATOM 727 C GLU A 48 4.477 9.310 7.571 1.00 0.00 C ATOM 728 O GLU A 48 5.247 9.723 6.726 1.00 0.00 O ATOM 729 CB GLU A 48 2.742 10.847 8.489 1.00 0.00 C ATOM 730 CG GLU A 48 3.620 12.032 8.090 1.00 0.00 C ATOM 731 CD GLU A 48 3.128 13.294 8.803 1.00 0.00 C ATOM 732 OE1 GLU A 48 2.197 13.185 9.583 1.00 0.00 O ATOM 733 OE2 GLU A 48 3.693 14.347 8.558 1.00 0.00 O ATOM 0 H GLU A 48 1.583 8.689 8.788 1.00 0.00 H new ATOM 0 HA GLU A 48 2.731 9.956 6.505 1.00 0.00 H new ATOM 0 HB2 GLU A 48 1.691 11.136 8.467 1.00 0.00 H new ATOM 0 HB3 GLU A 48 2.967 10.542 9.511 1.00 0.00 H new ATOM 0 HG2 GLU A 48 4.659 11.834 8.354 1.00 0.00 H new ATOM 0 HG3 GLU A 48 3.587 12.175 7.010 1.00 0.00 H new ATOM 740 N ASN A 49 4.903 8.573 8.565 1.00 0.00 N ATOM 741 CA ASN A 49 6.359 8.228 8.675 1.00 0.00 C ATOM 742 C ASN A 49 6.698 6.955 7.891 1.00 0.00 C ATOM 743 O ASN A 49 7.768 6.399 8.043 1.00 0.00 O ATOM 744 CB ASN A 49 6.711 8.014 10.148 1.00 0.00 C ATOM 745 CG ASN A 49 6.247 9.220 10.965 1.00 0.00 C ATOM 746 OD1 ASN A 49 5.091 9.592 10.919 1.00 0.00 O ATOM 747 ND2 ASN A 49 7.106 9.852 11.718 1.00 0.00 N ATOM 0 H ASN A 49 4.311 8.195 9.304 1.00 0.00 H new ATOM 0 HA ASN A 49 6.936 9.051 8.254 1.00 0.00 H new ATOM 0 HB2 ASN A 49 6.235 7.106 10.518 1.00 0.00 H new ATOM 0 HB3 ASN A 49 7.787 7.878 10.260 1.00 0.00 H new ATOM 0 HD21 ASN A 49 6.807 10.658 12.267 1.00 0.00 H new ATOM 0 HD22 ASN A 49 8.076 9.540 11.757 1.00 0.00 H new ATOM 754 N GLU A 50 5.818 6.488 7.055 1.00 0.00 N ATOM 755 CA GLU A 50 6.131 5.255 6.274 1.00 0.00 C ATOM 756 C GLU A 50 7.334 5.516 5.368 1.00 0.00 C ATOM 757 O GLU A 50 7.218 6.126 4.325 1.00 0.00 O ATOM 758 CB GLU A 50 4.922 4.879 5.414 1.00 0.00 C ATOM 759 CG GLU A 50 5.282 3.737 4.448 1.00 0.00 C ATOM 760 CD GLU A 50 5.958 2.594 5.209 1.00 0.00 C ATOM 761 OE1 GLU A 50 5.479 2.257 6.280 1.00 0.00 O ATOM 762 OE2 GLU A 50 6.942 2.076 4.708 1.00 0.00 O ATOM 0 H GLU A 50 4.902 6.900 6.877 1.00 0.00 H new ATOM 0 HA GLU A 50 6.362 4.440 6.960 1.00 0.00 H new ATOM 0 HB2 GLU A 50 4.094 4.574 6.054 1.00 0.00 H new ATOM 0 HB3 GLU A 50 4.586 5.748 4.849 1.00 0.00 H new ATOM 0 HG2 GLU A 50 4.382 3.372 3.953 1.00 0.00 H new ATOM 0 HG3 GLU A 50 5.947 4.107 3.667 1.00 0.00 H new ATOM 769 N SER A 51 8.488 5.049 5.755 1.00 0.00 N ATOM 770 CA SER A 51 9.702 5.256 4.915 1.00 0.00 C ATOM 771 C SER A 51 9.892 4.048 4.004 1.00 0.00 C ATOM 772 O SER A 51 9.673 2.919 4.399 1.00 0.00 O ATOM 773 CB SER A 51 10.927 5.407 5.818 1.00 0.00 C ATOM 774 OG SER A 51 11.425 4.118 6.148 1.00 0.00 O ATOM 0 H SER A 51 8.644 4.531 6.620 1.00 0.00 H new ATOM 0 HA SER A 51 9.582 6.157 4.313 1.00 0.00 H new ATOM 0 HB2 SER A 51 11.697 5.989 5.312 1.00 0.00 H new ATOM 0 HB3 SER A 51 10.661 5.950 6.725 1.00 0.00 H new ATOM 0 HG SER A 51 12.107 4.200 6.847 1.00 0.00 H new ATOM 780 N LEU A 52 10.311 4.270 2.791 1.00 0.00 N ATOM 781 CA LEU A 52 10.528 3.138 1.861 1.00 0.00 C ATOM 782 C LEU A 52 11.482 2.154 2.536 1.00 0.00 C ATOM 783 O LEU A 52 11.692 1.051 2.073 1.00 0.00 O ATOM 784 CB LEU A 52 11.135 3.660 0.533 1.00 0.00 C ATOM 785 CG LEU A 52 10.760 5.147 0.316 1.00 0.00 C ATOM 786 CD1 LEU A 52 11.795 6.062 0.999 1.00 0.00 C ATOM 787 CD2 LEU A 52 10.724 5.460 -1.187 1.00 0.00 C ATOM 0 H LEU A 52 10.512 5.193 2.405 1.00 0.00 H new ATOM 0 HA LEU A 52 9.585 2.642 1.630 1.00 0.00 H new ATOM 0 HB2 LEU A 52 12.219 3.551 0.554 1.00 0.00 H new ATOM 0 HB3 LEU A 52 10.770 3.061 -0.301 1.00 0.00 H new ATOM 0 HG LEU A 52 9.777 5.326 0.752 1.00 0.00 H new ATOM 0 HD11 LEU A 52 11.520 7.105 0.839 1.00 0.00 H new ATOM 0 HD12 LEU A 52 11.817 5.852 2.068 1.00 0.00 H new ATOM 0 HD13 LEU A 52 12.781 5.877 0.573 1.00 0.00 H new ATOM 0 HD21 LEU A 52 10.460 6.507 -1.334 1.00 0.00 H new ATOM 0 HD22 LEU A 52 11.705 5.269 -1.622 1.00 0.00 H new ATOM 0 HD23 LEU A 52 9.982 4.827 -1.673 1.00 0.00 H new ATOM 799 N ASP A 53 12.060 2.558 3.638 1.00 0.00 N ATOM 800 CA ASP A 53 13.005 1.670 4.366 1.00 0.00 C ATOM 801 C ASP A 53 12.262 0.920 5.477 1.00 0.00 C ATOM 802 O ASP A 53 12.799 0.015 6.086 1.00 0.00 O ATOM 803 CB ASP A 53 14.123 2.516 4.990 1.00 0.00 C ATOM 804 CG ASP A 53 15.336 1.632 5.287 1.00 0.00 C ATOM 805 OD1 ASP A 53 16.006 1.242 4.344 1.00 0.00 O ATOM 806 OD2 ASP A 53 15.573 1.357 6.451 1.00 0.00 O ATOM 0 H ASP A 53 11.914 3.473 4.065 1.00 0.00 H new ATOM 0 HA ASP A 53 13.432 0.952 3.666 1.00 0.00 H new ATOM 0 HB2 ASP A 53 14.405 3.321 4.311 1.00 0.00 H new ATOM 0 HB3 ASP A 53 13.768 2.984 5.909 1.00 0.00 H new ATOM 811 N ASP A 54 11.037 1.284 5.759 1.00 0.00 N ATOM 812 CA ASP A 54 10.297 0.578 6.837 1.00 0.00 C ATOM 813 C ASP A 54 10.265 -0.916 6.522 1.00 0.00 C ATOM 814 O ASP A 54 9.658 -1.343 5.560 1.00 0.00 O ATOM 815 CB ASP A 54 8.867 1.121 6.917 1.00 0.00 C ATOM 816 CG ASP A 54 8.221 0.682 8.234 1.00 0.00 C ATOM 817 OD1 ASP A 54 8.943 0.522 9.203 1.00 0.00 O ATOM 818 OD2 ASP A 54 7.013 0.519 8.251 1.00 0.00 O ATOM 0 H ASP A 54 10.525 2.033 5.292 1.00 0.00 H new ATOM 0 HA ASP A 54 10.794 0.740 7.794 1.00 0.00 H new ATOM 0 HB2 ASP A 54 8.877 2.209 6.850 1.00 0.00 H new ATOM 0 HB3 ASP A 54 8.281 0.755 6.074 1.00 0.00 H new ATOM 823 N GLN A 55 10.928 -1.710 7.325 1.00 0.00 N ATOM 824 CA GLN A 55 10.956 -3.187 7.086 1.00 0.00 C ATOM 825 C GLN A 55 9.567 -3.682 6.675 1.00 0.00 C ATOM 826 O GLN A 55 9.422 -4.730 6.076 1.00 0.00 O ATOM 827 CB GLN A 55 11.382 -3.908 8.372 1.00 0.00 C ATOM 828 CG GLN A 55 11.783 -5.369 8.051 1.00 0.00 C ATOM 829 CD GLN A 55 11.417 -6.288 9.222 1.00 0.00 C ATOM 830 OE1 GLN A 55 12.278 -6.731 9.957 1.00 0.00 O ATOM 831 NE2 GLN A 55 10.165 -6.594 9.424 1.00 0.00 N ATOM 0 H GLN A 55 11.454 -1.397 8.141 1.00 0.00 H new ATOM 0 HA GLN A 55 11.666 -3.399 6.287 1.00 0.00 H new ATOM 0 HB2 GLN A 55 12.220 -3.385 8.832 1.00 0.00 H new ATOM 0 HB3 GLN A 55 10.565 -3.896 9.093 1.00 0.00 H new ATOM 0 HG2 GLN A 55 11.276 -5.702 7.145 1.00 0.00 H new ATOM 0 HG3 GLN A 55 12.854 -5.425 7.856 1.00 0.00 H new ATOM 0 HE21 GLN A 55 9.443 -6.222 8.807 1.00 0.00 H new ATOM 0 HE22 GLN A 55 9.908 -7.205 10.199 1.00 0.00 H new ATOM 840 N ASN A 56 8.543 -2.932 6.988 1.00 0.00 N ATOM 841 CA ASN A 56 7.154 -3.341 6.615 1.00 0.00 C ATOM 842 C ASN A 56 6.402 -2.113 6.093 1.00 0.00 C ATOM 843 O ASN A 56 6.173 -1.159 6.811 1.00 0.00 O ATOM 844 CB ASN A 56 6.445 -3.928 7.849 1.00 0.00 C ATOM 845 CG ASN A 56 6.036 -2.810 8.812 1.00 0.00 C ATOM 846 OD1 ASN A 56 6.763 -1.853 8.996 1.00 0.00 O ATOM 847 ND2 ASN A 56 4.892 -2.891 9.431 1.00 0.00 N ATOM 0 H ASN A 56 8.609 -2.047 7.490 1.00 0.00 H new ATOM 0 HA ASN A 56 7.179 -4.103 5.836 1.00 0.00 H new ATOM 0 HB2 ASN A 56 5.564 -4.489 7.537 1.00 0.00 H new ATOM 0 HB3 ASN A 56 7.106 -4.630 8.357 1.00 0.00 H new ATOM 0 HD21 ASN A 56 4.605 -2.151 10.071 1.00 0.00 H new ATOM 0 HD22 ASN A 56 4.284 -3.695 9.275 1.00 0.00 H new ATOM 854 N ILE A 57 6.028 -2.120 4.841 1.00 0.00 N ATOM 855 CA ILE A 57 5.304 -0.947 4.265 1.00 0.00 C ATOM 856 C ILE A 57 3.800 -1.217 4.271 1.00 0.00 C ATOM 857 O ILE A 57 3.357 -2.346 4.199 1.00 0.00 O ATOM 858 CB ILE A 57 5.768 -0.722 2.823 1.00 0.00 C ATOM 859 CG1 ILE A 57 7.296 -0.628 2.787 1.00 0.00 C ATOM 860 CG2 ILE A 57 5.163 0.581 2.291 1.00 0.00 C ATOM 861 CD1 ILE A 57 7.771 -0.523 1.335 1.00 0.00 C ATOM 0 H ILE A 57 6.193 -2.888 4.191 1.00 0.00 H new ATOM 0 HA ILE A 57 5.518 -0.062 4.865 1.00 0.00 H new ATOM 0 HB ILE A 57 5.441 -1.555 2.201 1.00 0.00 H new ATOM 0 HG12 ILE A 57 7.630 0.241 3.353 1.00 0.00 H new ATOM 0 HG13 ILE A 57 7.736 -1.505 3.261 1.00 0.00 H new ATOM 0 HG21 ILE A 57 5.492 0.743 1.265 1.00 0.00 H new ATOM 0 HG22 ILE A 57 4.075 0.514 2.317 1.00 0.00 H new ATOM 0 HG23 ILE A 57 5.490 1.414 2.913 1.00 0.00 H new ATOM 0 HD11 ILE A 57 8.859 -0.456 1.312 1.00 0.00 H new ATOM 0 HD12 ILE A 57 7.450 -1.406 0.782 1.00 0.00 H new ATOM 0 HD13 ILE A 57 7.343 0.368 0.876 1.00 0.00 H new ATOM 873 N SER A 58 3.012 -0.179 4.344 1.00 0.00 N ATOM 874 CA SER A 58 1.529 -0.343 4.343 1.00 0.00 C ATOM 875 C SER A 58 0.930 0.777 3.499 1.00 0.00 C ATOM 876 O SER A 58 0.896 1.922 3.903 1.00 0.00 O ATOM 877 CB SER A 58 0.998 -0.265 5.776 1.00 0.00 C ATOM 878 OG SER A 58 1.228 -1.509 6.427 1.00 0.00 O ATOM 0 H SER A 58 3.336 0.786 4.405 1.00 0.00 H new ATOM 0 HA SER A 58 1.254 -1.312 3.928 1.00 0.00 H new ATOM 0 HB2 SER A 58 1.495 0.540 6.318 1.00 0.00 H new ATOM 0 HB3 SER A 58 -0.067 -0.035 5.770 1.00 0.00 H new ATOM 0 HG SER A 58 0.891 -1.464 7.346 1.00 0.00 H new ATOM 884 N ILE A 59 0.484 0.457 2.312 1.00 0.00 N ATOM 885 CA ILE A 59 -0.087 1.500 1.409 1.00 0.00 C ATOM 886 C ILE A 59 -1.614 1.470 1.446 1.00 0.00 C ATOM 887 O ILE A 59 -2.225 0.499 1.844 1.00 0.00 O ATOM 888 CB ILE A 59 0.389 1.230 -0.021 1.00 0.00 C ATOM 889 CG1 ILE A 59 1.915 1.329 -0.076 1.00 0.00 C ATOM 890 CG2 ILE A 59 -0.225 2.258 -0.973 1.00 0.00 C ATOM 891 CD1 ILE A 59 2.417 0.714 -1.384 1.00 0.00 C ATOM 0 H ILE A 59 0.491 -0.488 1.927 1.00 0.00 H new ATOM 0 HA ILE A 59 0.249 2.481 1.744 1.00 0.00 H new ATOM 0 HB ILE A 59 0.077 0.230 -0.323 1.00 0.00 H new ATOM 0 HG12 ILE A 59 2.226 2.372 -0.009 1.00 0.00 H new ATOM 0 HG13 ILE A 59 2.355 0.810 0.775 1.00 0.00 H new ATOM 0 HG21 ILE A 59 0.116 2.062 -1.989 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -1.312 2.185 -0.935 1.00 0.00 H new ATOM 0 HG23 ILE A 59 0.082 3.260 -0.674 1.00 0.00 H new ATOM 0 HD11 ILE A 59 3.504 0.784 -1.425 1.00 0.00 H new ATOM 0 HD12 ILE A 59 2.118 -0.333 -1.432 1.00 0.00 H new ATOM 0 HD13 ILE A 59 1.987 1.253 -2.228 1.00 0.00 H new ATOM 903 N ALA A 60 -2.230 2.539 1.013 1.00 0.00 N ATOM 904 CA ALA A 60 -3.720 2.614 0.988 1.00 0.00 C ATOM 905 C ALA A 60 -4.131 3.295 -0.319 1.00 0.00 C ATOM 906 O ALA A 60 -3.609 4.335 -0.667 1.00 0.00 O ATOM 907 CB ALA A 60 -4.208 3.433 2.193 1.00 0.00 C ATOM 0 H ALA A 60 -1.756 3.375 0.671 1.00 0.00 H new ATOM 0 HA ALA A 60 -4.162 1.619 1.045 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -5.296 3.490 2.178 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -3.883 2.952 3.116 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -3.792 4.439 2.142 1.00 0.00 H new ATOM 913 N GLY A 61 -5.044 2.711 -1.059 1.00 0.00 N ATOM 914 CA GLY A 61 -5.463 3.327 -2.363 1.00 0.00 C ATOM 915 C GLY A 61 -6.980 3.243 -2.533 1.00 0.00 C ATOM 916 O GLY A 61 -7.648 2.446 -1.905 1.00 0.00 O ATOM 0 H GLY A 61 -5.516 1.839 -0.820 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -5.144 4.369 -2.399 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -4.970 2.815 -3.189 1.00 0.00 H new ATOM 920 N HIS A 62 -7.523 4.065 -3.391 1.00 0.00 N ATOM 921 CA HIS A 62 -9.002 4.045 -3.625 1.00 0.00 C ATOM 922 C HIS A 62 -9.372 2.848 -4.518 1.00 0.00 C ATOM 923 O HIS A 62 -8.523 2.103 -4.955 1.00 0.00 O ATOM 924 CB HIS A 62 -9.432 5.364 -4.302 1.00 0.00 C ATOM 925 CG HIS A 62 -9.792 6.395 -3.259 1.00 0.00 C ATOM 926 ND1 HIS A 62 -11.032 6.414 -2.640 1.00 0.00 N ATOM 927 CD2 HIS A 62 -9.089 7.445 -2.718 1.00 0.00 C ATOM 928 CE1 HIS A 62 -11.038 7.442 -1.772 1.00 0.00 C ATOM 929 NE2 HIS A 62 -9.879 8.104 -1.781 1.00 0.00 N ATOM 0 H HIS A 62 -7.008 4.751 -3.942 1.00 0.00 H new ATOM 0 HA HIS A 62 -9.520 3.946 -2.671 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -8.624 5.739 -4.930 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -10.286 5.184 -4.955 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -8.077 7.717 -2.980 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -11.878 7.700 -1.144 1.00 0.00 H new ATOM 0 HE2 HIS A 62 -9.627 8.918 -1.221 1.00 0.00 H new ATOM 937 N THR A 63 -10.640 2.677 -4.804 1.00 0.00 N ATOM 938 CA THR A 63 -11.082 1.554 -5.678 1.00 0.00 C ATOM 939 C THR A 63 -12.394 1.950 -6.362 1.00 0.00 C ATOM 940 O THR A 63 -13.469 1.746 -5.835 1.00 0.00 O ATOM 941 CB THR A 63 -11.296 0.276 -4.854 1.00 0.00 C ATOM 942 OG1 THR A 63 -12.137 -0.610 -5.578 1.00 0.00 O ATOM 943 CG2 THR A 63 -11.949 0.604 -3.515 1.00 0.00 C ATOM 0 H THR A 63 -11.393 3.276 -4.464 1.00 0.00 H new ATOM 0 HA THR A 63 -10.312 1.356 -6.423 1.00 0.00 H new ATOM 0 HB THR A 63 -10.328 -0.189 -4.669 1.00 0.00 H new ATOM 0 HG1 THR A 63 -12.817 -0.980 -4.977 1.00 0.00 H new ATOM 0 HG21 THR A 63 -12.092 -0.314 -2.946 1.00 0.00 H new ATOM 0 HG22 THR A 63 -11.307 1.283 -2.954 1.00 0.00 H new ATOM 0 HG23 THR A 63 -12.915 1.078 -3.688 1.00 0.00 H new ATOM 951 N PHE A 64 -12.315 2.527 -7.531 1.00 0.00 N ATOM 952 CA PHE A 64 -13.555 2.949 -8.246 1.00 0.00 C ATOM 953 C PHE A 64 -14.090 1.769 -9.062 1.00 0.00 C ATOM 954 O PHE A 64 -13.561 1.426 -10.097 1.00 0.00 O ATOM 955 CB PHE A 64 -13.222 4.122 -9.187 1.00 0.00 C ATOM 956 CG PHE A 64 -13.237 5.428 -8.417 1.00 0.00 C ATOM 957 CD1 PHE A 64 -12.411 5.591 -7.296 1.00 0.00 C ATOM 958 CD2 PHE A 64 -14.073 6.476 -8.827 1.00 0.00 C ATOM 959 CE1 PHE A 64 -12.423 6.798 -6.588 1.00 0.00 C ATOM 960 CE2 PHE A 64 -14.083 7.683 -8.116 1.00 0.00 C ATOM 961 CZ PHE A 64 -13.259 7.843 -6.996 1.00 0.00 C ATOM 0 H PHE A 64 -11.444 2.725 -8.023 1.00 0.00 H new ATOM 0 HA PHE A 64 -14.310 3.265 -7.526 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -12.242 3.969 -9.639 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -13.946 4.162 -10.001 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -11.766 4.785 -6.979 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -14.709 6.353 -9.691 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -11.786 6.923 -5.725 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -14.727 8.490 -8.432 1.00 0.00 H new ATOM 0 HZ PHE A 64 -13.269 8.773 -6.447 1.00 0.00 H new ATOM 971 N ILE A 65 -15.138 1.145 -8.597 1.00 0.00 N ATOM 972 CA ILE A 65 -15.706 -0.018 -9.339 1.00 0.00 C ATOM 973 C ILE A 65 -16.062 0.404 -10.761 1.00 0.00 C ATOM 974 O ILE A 65 -16.004 -0.380 -11.687 1.00 0.00 O ATOM 975 CB ILE A 65 -16.986 -0.503 -8.655 1.00 0.00 C ATOM 976 CG1 ILE A 65 -16.783 -0.591 -7.145 1.00 0.00 C ATOM 977 CG2 ILE A 65 -17.358 -1.884 -9.194 1.00 0.00 C ATOM 978 CD1 ILE A 65 -18.077 -1.093 -6.509 1.00 0.00 C ATOM 0 H ILE A 65 -15.626 1.390 -7.735 1.00 0.00 H new ATOM 0 HA ILE A 65 -14.963 -0.815 -9.352 1.00 0.00 H new ATOM 0 HB ILE A 65 -17.786 0.207 -8.864 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -15.960 -1.267 -6.913 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -16.517 0.386 -6.741 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -18.270 -2.231 -8.708 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -17.521 -1.823 -10.270 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -16.548 -2.585 -8.989 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -17.949 -1.162 -5.429 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -18.887 -0.399 -6.735 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -18.321 -2.077 -6.909 1.00 0.00 H new ATOM 990 N ASP A 66 -16.452 1.633 -10.936 1.00 0.00 N ATOM 991 CA ASP A 66 -16.837 2.104 -12.289 1.00 0.00 C ATOM 992 C ASP A 66 -15.584 2.525 -13.044 1.00 0.00 C ATOM 993 O ASP A 66 -15.643 3.218 -14.040 1.00 0.00 O ATOM 994 CB ASP A 66 -17.791 3.293 -12.158 1.00 0.00 C ATOM 995 CG ASP A 66 -18.459 3.565 -13.507 1.00 0.00 C ATOM 996 OD1 ASP A 66 -19.147 2.684 -13.995 1.00 0.00 O ATOM 997 OD2 ASP A 66 -18.274 4.653 -14.030 1.00 0.00 O ATOM 0 H ASP A 66 -16.520 2.333 -10.197 1.00 0.00 H new ATOM 0 HA ASP A 66 -17.336 1.303 -12.835 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -18.547 3.084 -11.402 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -17.245 4.176 -11.827 1.00 0.00 H new ATOM 1002 N ARG A 67 -14.447 2.103 -12.573 1.00 0.00 N ATOM 1003 CA ARG A 67 -13.169 2.463 -13.251 1.00 0.00 C ATOM 1004 C ARG A 67 -12.141 1.339 -13.017 1.00 0.00 C ATOM 1005 O ARG A 67 -11.207 1.487 -12.256 1.00 0.00 O ATOM 1006 CB ARG A 67 -12.661 3.810 -12.686 1.00 0.00 C ATOM 1007 CG ARG A 67 -11.984 4.642 -13.793 1.00 0.00 C ATOM 1008 CD ARG A 67 -13.042 5.420 -14.586 1.00 0.00 C ATOM 1009 NE ARG A 67 -13.570 6.535 -13.750 1.00 0.00 N ATOM 1010 CZ ARG A 67 -14.247 7.502 -14.306 1.00 0.00 C ATOM 1011 NH1 ARG A 67 -14.454 7.499 -15.594 1.00 0.00 N ATOM 1012 NH2 ARG A 67 -14.717 8.474 -13.572 1.00 0.00 N ATOM 0 H ARG A 67 -14.345 1.520 -11.742 1.00 0.00 H new ATOM 0 HA ARG A 67 -13.322 2.573 -14.325 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -13.494 4.370 -12.261 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -11.954 3.628 -11.877 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -11.267 5.334 -13.352 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -11.425 3.987 -14.462 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -12.606 5.814 -15.504 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -13.854 4.755 -14.879 1.00 0.00 H new ATOM 0 HE ARG A 67 -13.402 6.542 -12.744 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -14.086 6.740 -16.168 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -14.983 8.256 -16.027 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -14.555 8.477 -12.565 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -15.246 9.230 -14.006 1.00 0.00 H new ATOM 1026 N PRO A 68 -12.330 0.217 -13.666 1.00 0.00 N ATOM 1027 CA PRO A 68 -11.424 -0.973 -13.536 1.00 0.00 C ATOM 1028 C PRO A 68 -9.950 -0.662 -13.860 1.00 0.00 C ATOM 1029 O PRO A 68 -9.198 -1.538 -14.240 1.00 0.00 O ATOM 1030 CB PRO A 68 -12.001 -1.982 -14.545 1.00 0.00 C ATOM 1031 CG PRO A 68 -13.425 -1.568 -14.734 1.00 0.00 C ATOM 1032 CD PRO A 68 -13.437 -0.048 -14.598 1.00 0.00 C ATOM 0 HA PRO A 68 -11.401 -1.338 -12.509 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -11.454 -1.955 -15.487 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -11.933 -3.002 -14.166 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -13.795 -1.876 -15.712 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -14.070 -2.033 -13.988 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -13.281 0.443 -15.558 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -14.388 0.313 -14.206 1.00 0.00 H new ATOM 1040 N ASN A 69 -9.527 0.563 -13.708 1.00 0.00 N ATOM 1041 CA ASN A 69 -8.104 0.911 -14.001 1.00 0.00 C ATOM 1042 C ASN A 69 -7.676 2.068 -13.098 1.00 0.00 C ATOM 1043 O ASN A 69 -6.972 2.965 -13.517 1.00 0.00 O ATOM 1044 CB ASN A 69 -7.969 1.332 -15.466 1.00 0.00 C ATOM 1045 CG ASN A 69 -8.948 2.468 -15.766 1.00 0.00 C ATOM 1046 OD1 ASN A 69 -8.823 3.552 -15.231 1.00 0.00 O ATOM 1047 ND2 ASN A 69 -9.925 2.266 -16.607 1.00 0.00 N ATOM 0 H ASN A 69 -10.106 1.341 -13.393 1.00 0.00 H new ATOM 0 HA ASN A 69 -7.470 0.044 -13.816 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -6.948 1.655 -15.669 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -8.171 0.483 -16.119 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -10.583 3.017 -16.815 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -10.031 1.357 -17.057 1.00 0.00 H new ATOM 1054 N TYR A 70 -8.107 2.056 -11.860 1.00 0.00 N ATOM 1055 CA TYR A 70 -7.747 3.158 -10.909 1.00 0.00 C ATOM 1056 C TYR A 70 -6.695 2.661 -9.908 1.00 0.00 C ATOM 1057 O TYR A 70 -5.914 1.775 -10.191 1.00 0.00 O ATOM 1058 CB TYR A 70 -9.012 3.612 -10.159 1.00 0.00 C ATOM 1059 CG TYR A 70 -8.881 5.059 -9.720 1.00 0.00 C ATOM 1060 CD1 TYR A 70 -8.761 6.073 -10.680 1.00 0.00 C ATOM 1061 CD2 TYR A 70 -8.887 5.387 -8.356 1.00 0.00 C ATOM 1062 CE1 TYR A 70 -8.645 7.409 -10.277 1.00 0.00 C ATOM 1063 CE2 TYR A 70 -8.772 6.722 -7.955 1.00 0.00 C ATOM 1064 CZ TYR A 70 -8.652 7.734 -8.915 1.00 0.00 C ATOM 1065 OH TYR A 70 -8.538 9.051 -8.519 1.00 0.00 O ATOM 0 H TYR A 70 -8.697 1.325 -11.463 1.00 0.00 H new ATOM 0 HA TYR A 70 -7.332 3.999 -11.465 1.00 0.00 H new ATOM 0 HB2 TYR A 70 -9.884 3.499 -10.803 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -9.174 2.975 -9.289 1.00 0.00 H new ATOM 0 HD1 TYR A 70 -8.758 5.824 -11.731 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -8.981 4.607 -7.614 1.00 0.00 H new ATOM 0 HE1 TYR A 70 -8.550 8.190 -11.017 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -8.776 6.972 -6.904 1.00 0.00 H new ATOM 0 HH TYR A 70 -8.561 9.102 -7.541 1.00 0.00 H new ATOM 1075 N GLN A 71 -6.664 3.256 -8.748 1.00 0.00 N ATOM 1076 CA GLN A 71 -5.662 2.870 -7.713 1.00 0.00 C ATOM 1077 C GLN A 71 -5.874 1.430 -7.224 1.00 0.00 C ATOM 1078 O GLN A 71 -5.292 0.495 -7.737 1.00 0.00 O ATOM 1079 CB GLN A 71 -5.793 3.831 -6.530 1.00 0.00 C ATOM 1080 CG GLN A 71 -5.469 5.254 -6.994 1.00 0.00 C ATOM 1081 CD GLN A 71 -5.965 6.264 -5.956 1.00 0.00 C ATOM 1082 OE1 GLN A 71 -6.539 7.276 -6.303 1.00 0.00 O ATOM 1083 NE2 GLN A 71 -5.763 6.035 -4.687 1.00 0.00 N ATOM 0 H GLN A 71 -7.299 4.004 -8.469 1.00 0.00 H new ATOM 0 HA GLN A 71 -4.667 2.926 -8.155 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -6.804 3.790 -6.124 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -5.116 3.534 -5.729 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -4.394 5.364 -7.137 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -5.940 5.448 -7.958 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -5.281 5.186 -4.392 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -6.087 6.705 -3.990 1.00 0.00 H new ATOM 1092 N PHE A 72 -6.674 1.258 -6.206 1.00 0.00 N ATOM 1093 CA PHE A 72 -6.910 -0.103 -5.628 1.00 0.00 C ATOM 1094 C PHE A 72 -8.160 -0.736 -6.256 1.00 0.00 C ATOM 1095 O PHE A 72 -8.774 -1.610 -5.683 1.00 0.00 O ATOM 1096 CB PHE A 72 -7.114 0.063 -4.101 1.00 0.00 C ATOM 1097 CG PHE A 72 -6.416 -1.029 -3.308 1.00 0.00 C ATOM 1098 CD1 PHE A 72 -6.931 -2.333 -3.292 1.00 0.00 C ATOM 1099 CD2 PHE A 72 -5.265 -0.726 -2.568 1.00 0.00 C ATOM 1100 CE1 PHE A 72 -6.292 -3.328 -2.548 1.00 0.00 C ATOM 1101 CE2 PHE A 72 -4.632 -1.721 -1.819 1.00 0.00 C ATOM 1102 CZ PHE A 72 -5.145 -3.024 -1.811 1.00 0.00 C ATOM 0 H PHE A 72 -7.182 2.011 -5.742 1.00 0.00 H new ATOM 0 HA PHE A 72 -6.060 -0.754 -5.833 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -6.734 1.036 -3.789 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -8.180 0.049 -3.875 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -7.822 -2.568 -3.855 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -4.867 0.278 -2.577 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -6.685 -4.334 -2.543 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -3.747 -1.485 -1.246 1.00 0.00 H new ATOM 0 HZ PHE A 72 -4.654 -3.794 -1.235 1.00 0.00 H new ATOM 1112 N THR A 73 -8.557 -0.309 -7.415 1.00 0.00 N ATOM 1113 CA THR A 73 -9.773 -0.914 -8.020 1.00 0.00 C ATOM 1114 C THR A 73 -9.462 -2.334 -8.512 1.00 0.00 C ATOM 1115 O THR A 73 -10.348 -3.154 -8.641 1.00 0.00 O ATOM 1116 CB THR A 73 -10.251 -0.063 -9.201 1.00 0.00 C ATOM 1117 OG1 THR A 73 -10.549 1.245 -8.745 1.00 0.00 O ATOM 1118 CG2 THR A 73 -11.514 -0.678 -9.809 1.00 0.00 C ATOM 0 H THR A 73 -8.103 0.421 -7.965 1.00 0.00 H new ATOM 0 HA THR A 73 -10.556 -0.955 -7.263 1.00 0.00 H new ATOM 0 HB THR A 73 -9.466 -0.026 -9.956 1.00 0.00 H new ATOM 0 HG1 THR A 73 -10.914 1.774 -9.485 1.00 0.00 H new ATOM 0 HG21 THR A 73 -11.848 -0.068 -10.648 1.00 0.00 H new ATOM 0 HG22 THR A 73 -11.295 -1.687 -10.159 1.00 0.00 H new ATOM 0 HG23 THR A 73 -12.299 -0.718 -9.054 1.00 0.00 H new ATOM 1126 N ASN A 74 -8.213 -2.627 -8.814 1.00 0.00 N ATOM 1127 CA ASN A 74 -7.851 -3.993 -9.332 1.00 0.00 C ATOM 1128 C ASN A 74 -6.856 -4.695 -8.402 1.00 0.00 C ATOM 1129 O ASN A 74 -6.638 -5.885 -8.515 1.00 0.00 O ATOM 1130 CB ASN A 74 -7.217 -3.843 -10.715 1.00 0.00 C ATOM 1131 CG ASN A 74 -8.257 -3.294 -11.694 1.00 0.00 C ATOM 1132 OD1 ASN A 74 -9.136 -2.548 -11.309 1.00 0.00 O ATOM 1133 ND2 ASN A 74 -8.194 -3.632 -12.953 1.00 0.00 N ATOM 0 H ASN A 74 -7.430 -1.980 -8.724 1.00 0.00 H new ATOM 0 HA ASN A 74 -8.758 -4.596 -9.383 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -6.360 -3.172 -10.663 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -6.846 -4.807 -11.064 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -8.882 -3.270 -13.613 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -7.457 -4.258 -13.277 1.00 0.00 H new ATOM 1140 N LEU A 75 -6.245 -3.992 -7.491 1.00 0.00 N ATOM 1141 CA LEU A 75 -5.269 -4.665 -6.581 1.00 0.00 C ATOM 1142 C LEU A 75 -5.942 -5.895 -5.957 1.00 0.00 C ATOM 1143 O LEU A 75 -5.283 -6.799 -5.484 1.00 0.00 O ATOM 1144 CB LEU A 75 -4.834 -3.684 -5.472 1.00 0.00 C ATOM 1145 CG LEU A 75 -3.497 -3.010 -5.828 1.00 0.00 C ATOM 1146 CD1 LEU A 75 -3.201 -1.913 -4.800 1.00 0.00 C ATOM 1147 CD2 LEU A 75 -2.351 -4.051 -5.827 1.00 0.00 C ATOM 0 H LEU A 75 -6.374 -2.992 -7.335 1.00 0.00 H new ATOM 0 HA LEU A 75 -4.388 -4.975 -7.143 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -5.603 -2.924 -5.331 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -4.736 -4.218 -4.527 1.00 0.00 H new ATOM 0 HG LEU A 75 -3.568 -2.575 -6.825 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -2.255 -1.430 -5.045 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -4.001 -1.173 -4.817 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -3.136 -2.354 -3.805 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -1.412 -3.559 -6.081 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -2.269 -4.501 -4.838 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -2.564 -4.827 -6.562 1.00 0.00 H new ATOM 1159 N LYS A 76 -7.247 -5.938 -5.960 1.00 0.00 N ATOM 1160 CA LYS A 76 -7.959 -7.112 -5.375 1.00 0.00 C ATOM 1161 C LYS A 76 -8.134 -8.167 -6.465 1.00 0.00 C ATOM 1162 O LYS A 76 -8.542 -9.283 -6.211 1.00 0.00 O ATOM 1163 CB LYS A 76 -9.329 -6.672 -4.844 1.00 0.00 C ATOM 1164 CG LYS A 76 -9.947 -5.648 -5.798 1.00 0.00 C ATOM 1165 CD LYS A 76 -11.423 -5.449 -5.442 1.00 0.00 C ATOM 1166 CE LYS A 76 -12.029 -4.381 -6.350 1.00 0.00 C ATOM 1167 NZ LYS A 76 -11.550 -3.038 -5.924 1.00 0.00 N ATOM 0 H LYS A 76 -7.852 -5.211 -6.342 1.00 0.00 H new ATOM 0 HA LYS A 76 -7.382 -7.528 -4.549 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -9.987 -7.536 -4.747 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -9.222 -6.239 -3.849 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -9.413 -4.700 -5.728 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -9.853 -5.991 -6.828 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -11.965 -6.388 -5.556 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -11.519 -5.150 -4.398 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -11.748 -4.567 -7.386 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -13.117 -4.423 -6.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -12.183 -2.306 -6.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -11.545 -2.985 -4.885 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -10.586 -2.883 -6.283 1.00 0.00 H new ATOM 1181 N ALA A 77 -7.816 -7.818 -7.682 1.00 0.00 N ATOM 1182 CA ALA A 77 -7.946 -8.785 -8.804 1.00 0.00 C ATOM 1183 C ALA A 77 -6.670 -9.627 -8.881 1.00 0.00 C ATOM 1184 O ALA A 77 -6.661 -10.715 -9.422 1.00 0.00 O ATOM 1185 CB ALA A 77 -8.135 -8.011 -10.109 1.00 0.00 C ATOM 0 H ALA A 77 -7.469 -6.896 -7.947 1.00 0.00 H new ATOM 0 HA ALA A 77 -8.804 -9.438 -8.643 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -8.231 -8.713 -10.938 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -9.036 -7.401 -10.043 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -7.272 -7.366 -10.278 1.00 0.00 H new ATOM 1191 N ALA A 78 -5.593 -9.127 -8.338 1.00 0.00 N ATOM 1192 CA ALA A 78 -4.314 -9.891 -8.372 1.00 0.00 C ATOM 1193 C ALA A 78 -4.545 -11.294 -7.801 1.00 0.00 C ATOM 1194 O ALA A 78 -5.659 -11.676 -7.504 1.00 0.00 O ATOM 1195 CB ALA A 78 -3.261 -9.158 -7.536 1.00 0.00 C ATOM 0 H ALA A 78 -5.544 -8.221 -7.872 1.00 0.00 H new ATOM 0 HA ALA A 78 -3.963 -9.974 -9.401 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -2.325 -9.716 -7.560 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -3.100 -8.161 -7.946 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -3.608 -9.075 -6.506 1.00 0.00 H new ATOM 1201 N LYS A 79 -3.501 -12.065 -7.647 1.00 0.00 N ATOM 1202 CA LYS A 79 -3.662 -13.446 -7.098 1.00 0.00 C ATOM 1203 C LYS A 79 -2.392 -13.844 -6.344 1.00 0.00 C ATOM 1204 O LYS A 79 -1.320 -13.336 -6.605 1.00 0.00 O ATOM 1205 CB LYS A 79 -3.897 -14.426 -8.248 1.00 0.00 C ATOM 1206 CG LYS A 79 -5.198 -14.067 -8.971 1.00 0.00 C ATOM 1207 CD LYS A 79 -5.595 -15.209 -9.913 1.00 0.00 C ATOM 1208 CE LYS A 79 -4.508 -15.408 -10.973 1.00 0.00 C ATOM 1209 NZ LYS A 79 -5.073 -16.171 -12.122 1.00 0.00 N ATOM 0 H LYS A 79 -2.543 -11.799 -7.877 1.00 0.00 H new ATOM 0 HA LYS A 79 -4.513 -13.471 -6.418 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -3.060 -14.391 -8.945 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -3.951 -15.445 -7.865 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -5.992 -13.888 -8.245 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -5.069 -13.144 -9.536 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -5.735 -16.129 -9.345 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -6.547 -14.983 -10.393 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -4.134 -14.442 -11.312 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -3.662 -15.946 -10.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -4.337 -16.308 -12.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -5.410 -17.098 -11.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -5.867 -15.641 -12.534 1.00 0.00 H new ATOM 1223 N LYS A 80 -2.504 -14.751 -5.410 1.00 0.00 N ATOM 1224 CA LYS A 80 -1.302 -15.183 -4.641 1.00 0.00 C ATOM 1225 C LYS A 80 -0.186 -15.568 -5.613 1.00 0.00 C ATOM 1226 O LYS A 80 -0.064 -16.707 -6.018 1.00 0.00 O ATOM 1227 CB LYS A 80 -1.661 -16.386 -3.765 1.00 0.00 C ATOM 1228 CG LYS A 80 -0.552 -16.612 -2.735 1.00 0.00 C ATOM 1229 CD LYS A 80 -0.790 -17.932 -1.994 1.00 0.00 C ATOM 1230 CE LYS A 80 -2.177 -17.924 -1.343 1.00 0.00 C ATOM 1231 NZ LYS A 80 -2.461 -16.570 -0.791 1.00 0.00 N ATOM 0 H LYS A 80 -3.376 -15.211 -5.147 1.00 0.00 H new ATOM 0 HA LYS A 80 -0.962 -14.364 -4.007 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -2.611 -16.212 -3.260 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -1.786 -17.275 -4.383 1.00 0.00 H new ATOM 0 HG2 LYS A 80 0.418 -16.633 -3.231 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -0.529 -15.785 -2.025 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -0.710 -18.768 -2.689 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -0.023 -18.075 -1.233 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -2.936 -18.195 -2.077 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -2.221 -18.669 -0.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -3.177 -16.644 -0.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -1.587 -16.165 -0.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -2.817 -15.954 -1.549 1.00 0.00 H new ATOM 1245 N GLY A 81 0.629 -14.620 -5.995 1.00 0.00 N ATOM 1246 CA GLY A 81 1.741 -14.912 -6.946 1.00 0.00 C ATOM 1247 C GLY A 81 2.001 -13.674 -7.804 1.00 0.00 C ATOM 1248 O GLY A 81 3.030 -13.546 -8.437 1.00 0.00 O ATOM 0 H GLY A 81 0.571 -13.649 -5.687 1.00 0.00 H new ATOM 0 HA2 GLY A 81 2.642 -15.186 -6.398 1.00 0.00 H new ATOM 0 HA3 GLY A 81 1.482 -15.761 -7.579 1.00 0.00 H new ATOM 1252 N SER A 82 1.077 -12.753 -7.817 1.00 0.00 N ATOM 1253 CA SER A 82 1.268 -11.518 -8.617 1.00 0.00 C ATOM 1254 C SER A 82 2.476 -10.780 -8.061 1.00 0.00 C ATOM 1255 O SER A 82 2.471 -10.326 -6.933 1.00 0.00 O ATOM 1256 CB SER A 82 0.024 -10.636 -8.509 1.00 0.00 C ATOM 1257 OG SER A 82 -1.135 -11.431 -8.725 1.00 0.00 O ATOM 0 H SER A 82 0.196 -12.806 -7.305 1.00 0.00 H new ATOM 0 HA SER A 82 1.427 -11.765 -9.667 1.00 0.00 H new ATOM 0 HB2 SER A 82 -0.020 -10.168 -7.526 1.00 0.00 H new ATOM 0 HB3 SER A 82 0.069 -9.832 -9.243 1.00 0.00 H new ATOM 0 HG SER A 82 -1.258 -11.575 -9.686 1.00 0.00 H new ATOM 1263 N MET A 83 3.521 -10.673 -8.824 1.00 0.00 N ATOM 1264 CA MET A 83 4.721 -9.982 -8.303 1.00 0.00 C ATOM 1265 C MET A 83 4.424 -8.492 -8.149 1.00 0.00 C ATOM 1266 O MET A 83 3.331 -8.037 -8.421 1.00 0.00 O ATOM 1267 CB MET A 83 5.899 -10.184 -9.264 1.00 0.00 C ATOM 1268 CG MET A 83 5.564 -9.583 -10.633 1.00 0.00 C ATOM 1269 SD MET A 83 6.636 -10.315 -11.896 1.00 0.00 S ATOM 1270 CE MET A 83 8.206 -10.108 -11.020 1.00 0.00 C ATOM 0 H MET A 83 3.595 -11.031 -9.776 1.00 0.00 H new ATOM 0 HA MET A 83 4.984 -10.399 -7.331 1.00 0.00 H new ATOM 0 HB2 MET A 83 6.795 -9.713 -8.859 1.00 0.00 H new ATOM 0 HB3 MET A 83 6.117 -11.247 -9.367 1.00 0.00 H new ATOM 0 HG2 MET A 83 4.518 -9.769 -10.877 1.00 0.00 H new ATOM 0 HG3 MET A 83 5.699 -8.502 -10.610 1.00 0.00 H new ATOM 0 HE1 MET A 83 9.031 -10.194 -11.727 1.00 0.00 H new ATOM 0 HE2 MET A 83 8.233 -9.126 -10.548 1.00 0.00 H new ATOM 0 HE3 MET A 83 8.301 -10.880 -10.256 1.00 0.00 H new ATOM 1280 N VAL A 84 5.387 -7.728 -7.704 1.00 0.00 N ATOM 1281 CA VAL A 84 5.163 -6.263 -7.514 1.00 0.00 C ATOM 1282 C VAL A 84 6.431 -5.497 -7.893 1.00 0.00 C ATOM 1283 O VAL A 84 7.526 -6.015 -7.806 1.00 0.00 O ATOM 1284 CB VAL A 84 4.836 -5.995 -6.041 1.00 0.00 C ATOM 1285 CG1 VAL A 84 4.248 -4.591 -5.891 1.00 0.00 C ATOM 1286 CG2 VAL A 84 3.821 -7.030 -5.549 1.00 0.00 C ATOM 0 H VAL A 84 6.322 -8.056 -7.463 1.00 0.00 H new ATOM 0 HA VAL A 84 4.338 -5.935 -8.146 1.00 0.00 H new ATOM 0 HB VAL A 84 5.748 -6.068 -5.449 1.00 0.00 H new ATOM 0 HG11 VAL A 84 4.017 -4.404 -4.842 1.00 0.00 H new ATOM 0 HG12 VAL A 84 4.971 -3.854 -6.240 1.00 0.00 H new ATOM 0 HG13 VAL A 84 3.336 -4.513 -6.483 1.00 0.00 H new ATOM 0 HG21 VAL A 84 3.587 -6.841 -4.501 1.00 0.00 H new ATOM 0 HG22 VAL A 84 2.910 -6.957 -6.143 1.00 0.00 H new ATOM 0 HG23 VAL A 84 4.242 -8.030 -5.652 1.00 0.00 H new ATOM 1296 N TYR A 85 6.287 -4.260 -8.306 1.00 0.00 N ATOM 1297 CA TYR A 85 7.477 -3.439 -8.686 1.00 0.00 C ATOM 1298 C TYR A 85 7.360 -2.068 -8.019 1.00 0.00 C ATOM 1299 O TYR A 85 6.609 -1.215 -8.453 1.00 0.00 O ATOM 1300 CB TYR A 85 7.510 -3.257 -10.206 1.00 0.00 C ATOM 1301 CG TYR A 85 7.880 -4.557 -10.880 1.00 0.00 C ATOM 1302 CD1 TYR A 85 9.225 -4.925 -11.005 1.00 0.00 C ATOM 1303 CD2 TYR A 85 6.877 -5.389 -11.393 1.00 0.00 C ATOM 1304 CE1 TYR A 85 9.566 -6.126 -11.639 1.00 0.00 C ATOM 1305 CE2 TYR A 85 7.218 -6.588 -12.028 1.00 0.00 C ATOM 1306 CZ TYR A 85 8.563 -6.957 -12.151 1.00 0.00 C ATOM 1307 OH TYR A 85 8.899 -8.140 -12.778 1.00 0.00 O ATOM 0 H TYR A 85 5.390 -3.783 -8.396 1.00 0.00 H new ATOM 0 HA TYR A 85 8.390 -3.939 -8.362 1.00 0.00 H new ATOM 0 HB2 TYR A 85 6.536 -2.920 -10.560 1.00 0.00 H new ATOM 0 HB3 TYR A 85 8.231 -2.484 -10.471 1.00 0.00 H new ATOM 0 HD1 TYR A 85 9.999 -4.283 -10.612 1.00 0.00 H new ATOM 0 HD2 TYR A 85 5.839 -5.105 -11.298 1.00 0.00 H new ATOM 0 HE1 TYR A 85 10.603 -6.411 -11.733 1.00 0.00 H new ATOM 0 HE2 TYR A 85 6.444 -7.229 -12.423 1.00 0.00 H new ATOM 0 HH TYR A 85 8.085 -8.589 -13.088 1.00 0.00 H new ATOM 1317 N PHE A 86 8.104 -1.847 -6.965 1.00 0.00 N ATOM 1318 CA PHE A 86 8.055 -0.530 -6.260 1.00 0.00 C ATOM 1319 C PHE A 86 9.176 0.342 -6.820 1.00 0.00 C ATOM 1320 O PHE A 86 10.343 0.066 -6.632 1.00 0.00 O ATOM 1321 CB PHE A 86 8.264 -0.756 -4.756 1.00 0.00 C ATOM 1322 CG PHE A 86 7.804 0.453 -3.964 1.00 0.00 C ATOM 1323 CD1 PHE A 86 6.457 0.840 -3.993 1.00 0.00 C ATOM 1324 CD2 PHE A 86 8.723 1.181 -3.191 1.00 0.00 C ATOM 1325 CE1 PHE A 86 6.030 1.948 -3.253 1.00 0.00 C ATOM 1326 CE2 PHE A 86 8.293 2.292 -2.451 1.00 0.00 C ATOM 1327 CZ PHE A 86 6.947 2.675 -2.482 1.00 0.00 C ATOM 0 H PHE A 86 8.747 -2.527 -6.560 1.00 0.00 H new ATOM 0 HA PHE A 86 7.092 -0.042 -6.411 1.00 0.00 H new ATOM 0 HB2 PHE A 86 7.711 -1.639 -4.435 1.00 0.00 H new ATOM 0 HB3 PHE A 86 9.318 -0.949 -4.555 1.00 0.00 H new ATOM 0 HD1 PHE A 86 5.748 0.282 -4.587 1.00 0.00 H new ATOM 0 HD2 PHE A 86 9.761 0.885 -3.166 1.00 0.00 H new ATOM 0 HE1 PHE A 86 4.992 2.244 -3.276 1.00 0.00 H new ATOM 0 HE2 PHE A 86 9.000 2.852 -1.857 1.00 0.00 H new ATOM 0 HZ PHE A 86 6.615 3.530 -1.912 1.00 0.00 H new ATOM 1337 N LYS A 87 8.831 1.382 -7.531 1.00 0.00 N ATOM 1338 CA LYS A 87 9.880 2.256 -8.133 1.00 0.00 C ATOM 1339 C LYS A 87 10.249 3.387 -7.176 1.00 0.00 C ATOM 1340 O LYS A 87 9.450 3.841 -6.383 1.00 0.00 O ATOM 1341 CB LYS A 87 9.352 2.848 -9.441 1.00 0.00 C ATOM 1342 CG LYS A 87 10.467 3.651 -10.125 1.00 0.00 C ATOM 1343 CD LYS A 87 10.056 4.009 -11.567 1.00 0.00 C ATOM 1344 CE LYS A 87 10.443 2.876 -12.527 1.00 0.00 C ATOM 1345 NZ LYS A 87 11.896 2.971 -12.841 1.00 0.00 N ATOM 0 H LYS A 87 7.869 1.664 -7.721 1.00 0.00 H new ATOM 0 HA LYS A 87 10.770 1.658 -8.326 1.00 0.00 H new ATOM 0 HB2 LYS A 87 9.006 2.051 -10.100 1.00 0.00 H new ATOM 0 HB3 LYS A 87 8.495 3.492 -9.242 1.00 0.00 H new ATOM 0 HG2 LYS A 87 10.669 4.561 -9.560 1.00 0.00 H new ATOM 0 HG3 LYS A 87 11.390 3.071 -10.135 1.00 0.00 H new ATOM 0 HD2 LYS A 87 8.981 4.183 -11.614 1.00 0.00 H new ATOM 0 HD3 LYS A 87 10.543 4.936 -11.872 1.00 0.00 H new ATOM 0 HE2 LYS A 87 10.219 1.909 -12.076 1.00 0.00 H new ATOM 0 HE3 LYS A 87 9.856 2.944 -13.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 12.269 2.023 -13.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 12.033 3.586 -13.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 12.402 3.371 -12.025 1.00 0.00 H new ATOM 1359 N VAL A 88 11.466 3.842 -7.262 1.00 0.00 N ATOM 1360 CA VAL A 88 11.934 4.949 -6.384 1.00 0.00 C ATOM 1361 C VAL A 88 13.003 5.745 -7.134 1.00 0.00 C ATOM 1362 O VAL A 88 13.706 5.216 -7.974 1.00 0.00 O ATOM 1363 CB VAL A 88 12.538 4.368 -5.105 1.00 0.00 C ATOM 1364 CG1 VAL A 88 13.032 5.506 -4.211 1.00 0.00 C ATOM 1365 CG2 VAL A 88 11.473 3.559 -4.360 1.00 0.00 C ATOM 0 H VAL A 88 12.167 3.489 -7.913 1.00 0.00 H new ATOM 0 HA VAL A 88 11.097 5.597 -6.122 1.00 0.00 H new ATOM 0 HB VAL A 88 13.375 3.718 -5.361 1.00 0.00 H new ATOM 0 HG11 VAL A 88 13.463 5.092 -3.299 1.00 0.00 H new ATOM 0 HG12 VAL A 88 13.790 6.082 -4.741 1.00 0.00 H new ATOM 0 HG13 VAL A 88 12.196 6.156 -3.954 1.00 0.00 H new ATOM 0 HG21 VAL A 88 11.903 3.144 -3.448 1.00 0.00 H new ATOM 0 HG22 VAL A 88 10.636 4.208 -4.104 1.00 0.00 H new ATOM 0 HG23 VAL A 88 11.121 2.747 -4.997 1.00 0.00 H new ATOM 1375 N GLY A 89 13.134 7.008 -6.845 1.00 0.00 N ATOM 1376 CA GLY A 89 14.160 7.827 -7.552 1.00 0.00 C ATOM 1377 C GLY A 89 15.537 7.170 -7.414 1.00 0.00 C ATOM 1378 O GLY A 89 16.509 7.627 -7.983 1.00 0.00 O ATOM 0 H GLY A 89 12.578 7.509 -6.152 1.00 0.00 H new ATOM 0 HA2 GLY A 89 13.898 7.924 -8.605 1.00 0.00 H new ATOM 0 HA3 GLY A 89 14.184 8.834 -7.135 1.00 0.00 H new ATOM 1382 N ASN A 90 15.630 6.105 -6.655 1.00 0.00 N ATOM 1383 CA ASN A 90 16.945 5.415 -6.466 1.00 0.00 C ATOM 1384 C ASN A 90 17.009 4.150 -7.323 1.00 0.00 C ATOM 1385 O ASN A 90 17.994 3.888 -7.987 1.00 0.00 O ATOM 1386 CB ASN A 90 17.101 5.031 -4.993 1.00 0.00 C ATOM 1387 CG ASN A 90 16.839 6.256 -4.118 1.00 0.00 C ATOM 1388 OD1 ASN A 90 17.521 7.255 -4.234 1.00 0.00 O ATOM 1389 ND2 ASN A 90 15.872 6.222 -3.242 1.00 0.00 N ATOM 0 H ASN A 90 14.848 5.682 -6.156 1.00 0.00 H new ATOM 0 HA ASN A 90 17.747 6.089 -6.767 1.00 0.00 H new ATOM 0 HB2 ASN A 90 16.404 4.233 -4.738 1.00 0.00 H new ATOM 0 HB3 ASN A 90 18.105 4.648 -4.810 1.00 0.00 H new ATOM 0 HD21 ASN A 90 15.688 7.035 -2.654 1.00 0.00 H new ATOM 0 HD22 ASN A 90 15.300 5.383 -3.146 1.00 0.00 H new ATOM 1396 N GLU A 91 15.975 3.355 -7.313 1.00 0.00 N ATOM 1397 CA GLU A 91 15.990 2.102 -8.123 1.00 0.00 C ATOM 1398 C GLU A 91 14.592 1.472 -8.099 1.00 0.00 C ATOM 1399 O GLU A 91 13.606 2.146 -7.877 1.00 0.00 O ATOM 1400 CB GLU A 91 17.028 1.123 -7.533 1.00 0.00 C ATOM 1401 CG GLU A 91 17.631 0.252 -8.646 1.00 0.00 C ATOM 1402 CD GLU A 91 18.281 -0.993 -8.035 1.00 0.00 C ATOM 1403 OE1 GLU A 91 19.055 -0.836 -7.105 1.00 0.00 O ATOM 1404 OE2 GLU A 91 17.993 -2.080 -8.508 1.00 0.00 O ATOM 0 H GLU A 91 15.121 3.518 -6.780 1.00 0.00 H new ATOM 0 HA GLU A 91 16.263 2.327 -9.154 1.00 0.00 H new ATOM 0 HB2 GLU A 91 17.818 1.680 -7.029 1.00 0.00 H new ATOM 0 HB3 GLU A 91 16.555 0.490 -6.782 1.00 0.00 H new ATOM 0 HG2 GLU A 91 16.854 -0.041 -9.352 1.00 0.00 H new ATOM 0 HG3 GLU A 91 18.372 0.823 -9.206 1.00 0.00 H new ATOM 1411 N THR A 92 14.500 0.183 -8.332 1.00 0.00 N ATOM 1412 CA THR A 92 13.168 -0.500 -8.330 1.00 0.00 C ATOM 1413 C THR A 92 13.241 -1.782 -7.502 1.00 0.00 C ATOM 1414 O THR A 92 14.003 -2.682 -7.792 1.00 0.00 O ATOM 1415 CB THR A 92 12.774 -0.847 -9.767 1.00 0.00 C ATOM 1416 OG1 THR A 92 12.735 0.340 -10.547 1.00 0.00 O ATOM 1417 CG2 THR A 92 11.396 -1.509 -9.772 1.00 0.00 C ATOM 0 H THR A 92 15.295 -0.427 -8.524 1.00 0.00 H new ATOM 0 HA THR A 92 12.424 0.167 -7.894 1.00 0.00 H new ATOM 0 HB THR A 92 13.507 -1.534 -10.190 1.00 0.00 H new ATOM 0 HG1 THR A 92 12.484 0.118 -11.468 1.00 0.00 H new ATOM 0 HG21 THR A 92 11.115 -1.756 -10.796 1.00 0.00 H new ATOM 0 HG22 THR A 92 11.428 -2.420 -9.174 1.00 0.00 H new ATOM 0 HG23 THR A 92 10.661 -0.823 -9.350 1.00 0.00 H new ATOM 1425 N ARG A 93 12.440 -1.871 -6.473 1.00 0.00 N ATOM 1426 CA ARG A 93 12.440 -3.097 -5.618 1.00 0.00 C ATOM 1427 C ARG A 93 11.385 -4.072 -6.144 1.00 0.00 C ATOM 1428 O ARG A 93 10.612 -3.745 -7.023 1.00 0.00 O ATOM 1429 CB ARG A 93 12.110 -2.723 -4.166 1.00 0.00 C ATOM 1430 CG ARG A 93 13.053 -1.599 -3.676 1.00 0.00 C ATOM 1431 CD ARG A 93 12.462 -0.201 -3.979 1.00 0.00 C ATOM 1432 NE ARG A 93 13.539 0.698 -4.504 1.00 0.00 N ATOM 1433 CZ ARG A 93 14.698 0.790 -3.906 1.00 0.00 C ATOM 1434 NH1 ARG A 93 14.899 0.202 -2.759 1.00 0.00 N ATOM 1435 NH2 ARG A 93 15.648 1.507 -4.441 1.00 0.00 N ATOM 0 H ARG A 93 11.783 -1.145 -6.186 1.00 0.00 H new ATOM 0 HA ARG A 93 13.425 -3.562 -5.651 1.00 0.00 H new ATOM 0 HB2 ARG A 93 11.073 -2.395 -4.094 1.00 0.00 H new ATOM 0 HB3 ARG A 93 12.212 -3.599 -3.525 1.00 0.00 H new ATOM 0 HG2 ARG A 93 13.219 -1.702 -2.604 1.00 0.00 H new ATOM 0 HG3 ARG A 93 14.024 -1.699 -4.160 1.00 0.00 H new ATOM 0 HD2 ARG A 93 11.657 -0.286 -4.709 1.00 0.00 H new ATOM 0 HD3 ARG A 93 12.028 0.225 -3.075 1.00 0.00 H new ATOM 0 HE ARG A 93 13.365 1.249 -5.344 1.00 0.00 H new ATOM 0 HH11 ARG A 93 14.149 -0.334 -2.322 1.00 0.00 H new ATOM 0 HH12 ARG A 93 15.806 0.278 -2.299 1.00 0.00 H new ATOM 0 HH21 ARG A 93 15.485 1.993 -5.323 1.00 0.00 H new ATOM 0 HH22 ARG A 93 16.554 1.581 -3.977 1.00 0.00 H new ATOM 1449 N LYS A 94 11.348 -5.272 -5.622 1.00 0.00 N ATOM 1450 CA LYS A 94 10.345 -6.270 -6.103 1.00 0.00 C ATOM 1451 C LYS A 94 9.875 -7.146 -4.939 1.00 0.00 C ATOM 1452 O LYS A 94 10.593 -7.376 -3.986 1.00 0.00 O ATOM 1453 CB LYS A 94 10.989 -7.159 -7.168 1.00 0.00 C ATOM 1454 CG LYS A 94 11.638 -6.283 -8.240 1.00 0.00 C ATOM 1455 CD LYS A 94 12.002 -7.143 -9.454 1.00 0.00 C ATOM 1456 CE LYS A 94 13.052 -8.189 -9.060 1.00 0.00 C ATOM 1457 NZ LYS A 94 12.378 -9.352 -8.415 1.00 0.00 N ATOM 0 H LYS A 94 11.969 -5.604 -4.884 1.00 0.00 H new ATOM 0 HA LYS A 94 9.490 -5.741 -6.523 1.00 0.00 H new ATOM 0 HB2 LYS A 94 11.737 -7.808 -6.712 1.00 0.00 H new ATOM 0 HB3 LYS A 94 10.237 -7.807 -7.619 1.00 0.00 H new ATOM 0 HG2 LYS A 94 10.955 -5.487 -8.537 1.00 0.00 H new ATOM 0 HG3 LYS A 94 12.531 -5.803 -7.840 1.00 0.00 H new ATOM 0 HD2 LYS A 94 11.111 -7.638 -9.840 1.00 0.00 H new ATOM 0 HD3 LYS A 94 12.388 -6.512 -10.255 1.00 0.00 H new ATOM 0 HE2 LYS A 94 13.602 -8.517 -9.942 1.00 0.00 H new ATOM 0 HE3 LYS A 94 13.778 -7.751 -8.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 12.638 -9.389 -7.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 11.347 -9.248 -8.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 12.679 -10.231 -8.883 1.00 0.00 H new ATOM 1471 N TYR A 95 8.671 -7.653 -5.025 1.00 0.00 N ATOM 1472 CA TYR A 95 8.131 -8.538 -3.947 1.00 0.00 C ATOM 1473 C TYR A 95 7.365 -9.687 -4.609 1.00 0.00 C ATOM 1474 O TYR A 95 7.260 -9.751 -5.818 1.00 0.00 O ATOM 1475 CB TYR A 95 7.183 -7.743 -3.037 1.00 0.00 C ATOM 1476 CG TYR A 95 7.878 -6.494 -2.536 1.00 0.00 C ATOM 1477 CD1 TYR A 95 8.115 -5.429 -3.416 1.00 0.00 C ATOM 1478 CD2 TYR A 95 8.284 -6.396 -1.193 1.00 0.00 C ATOM 1479 CE1 TYR A 95 8.755 -4.272 -2.960 1.00 0.00 C ATOM 1480 CE2 TYR A 95 8.927 -5.237 -0.742 1.00 0.00 C ATOM 1481 CZ TYR A 95 9.162 -4.176 -1.623 1.00 0.00 C ATOM 1482 OH TYR A 95 9.795 -3.034 -1.176 1.00 0.00 O ATOM 0 H TYR A 95 8.033 -7.490 -5.804 1.00 0.00 H new ATOM 0 HA TYR A 95 8.949 -8.926 -3.341 1.00 0.00 H new ATOM 0 HB2 TYR A 95 6.280 -7.473 -3.585 1.00 0.00 H new ATOM 0 HB3 TYR A 95 6.872 -8.360 -2.194 1.00 0.00 H new ATOM 0 HD1 TYR A 95 7.803 -5.502 -4.447 1.00 0.00 H new ATOM 0 HD2 TYR A 95 8.100 -7.213 -0.511 1.00 0.00 H new ATOM 0 HE1 TYR A 95 8.936 -3.452 -3.639 1.00 0.00 H new ATOM 0 HE2 TYR A 95 9.242 -5.162 0.288 1.00 0.00 H new ATOM 0 HH TYR A 95 9.360 -2.718 -0.357 1.00 0.00 H new ATOM 1492 N LYS A 96 6.833 -10.598 -3.834 1.00 0.00 N ATOM 1493 CA LYS A 96 6.079 -11.747 -4.430 1.00 0.00 C ATOM 1494 C LYS A 96 4.873 -12.084 -3.554 1.00 0.00 C ATOM 1495 O LYS A 96 5.008 -12.657 -2.491 1.00 0.00 O ATOM 1496 CB LYS A 96 6.995 -12.968 -4.513 1.00 0.00 C ATOM 1497 CG LYS A 96 6.333 -14.047 -5.371 1.00 0.00 C ATOM 1498 CD LYS A 96 7.192 -15.311 -5.355 1.00 0.00 C ATOM 1499 CE LYS A 96 6.505 -16.406 -6.172 1.00 0.00 C ATOM 1500 NZ LYS A 96 7.283 -17.672 -6.057 1.00 0.00 N ATOM 0 H LYS A 96 6.887 -10.598 -2.815 1.00 0.00 H new ATOM 0 HA LYS A 96 5.738 -11.472 -5.428 1.00 0.00 H new ATOM 0 HB2 LYS A 96 7.956 -12.686 -4.943 1.00 0.00 H new ATOM 0 HB3 LYS A 96 7.194 -13.355 -3.514 1.00 0.00 H new ATOM 0 HG2 LYS A 96 5.336 -14.268 -4.991 1.00 0.00 H new ATOM 0 HG3 LYS A 96 6.212 -13.690 -6.394 1.00 0.00 H new ATOM 0 HD2 LYS A 96 8.178 -15.099 -5.769 1.00 0.00 H new ATOM 0 HD3 LYS A 96 7.342 -15.648 -4.329 1.00 0.00 H new ATOM 0 HE2 LYS A 96 5.487 -16.558 -5.813 1.00 0.00 H new ATOM 0 HE3 LYS A 96 6.433 -16.104 -7.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 6.817 -18.418 -6.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 8.246 -17.522 -6.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 7.330 -17.961 -5.059 1.00 0.00 H new ATOM 1514 N MET A 97 3.693 -11.736 -3.992 1.00 0.00 N ATOM 1515 CA MET A 97 2.480 -12.044 -3.183 1.00 0.00 C ATOM 1516 C MET A 97 2.513 -13.515 -2.760 1.00 0.00 C ATOM 1517 O MET A 97 2.627 -14.404 -3.581 1.00 0.00 O ATOM 1518 CB MET A 97 1.223 -11.779 -4.017 1.00 0.00 C ATOM 1519 CG MET A 97 0.978 -10.270 -4.113 1.00 0.00 C ATOM 1520 SD MET A 97 -0.611 -9.968 -4.924 1.00 0.00 S ATOM 1521 CE MET A 97 -0.578 -8.160 -4.818 1.00 0.00 C ATOM 0 H MET A 97 3.517 -11.253 -4.873 1.00 0.00 H new ATOM 0 HA MET A 97 2.464 -11.409 -2.297 1.00 0.00 H new ATOM 0 HB2 MET A 97 1.340 -12.203 -5.014 1.00 0.00 H new ATOM 0 HB3 MET A 97 0.362 -12.269 -3.562 1.00 0.00 H new ATOM 0 HG2 MET A 97 0.981 -9.826 -3.117 1.00 0.00 H new ATOM 0 HG3 MET A 97 1.782 -9.795 -4.676 1.00 0.00 H new ATOM 0 HE1 MET A 97 -1.483 -7.753 -5.268 1.00 0.00 H new ATOM 0 HE2 MET A 97 -0.525 -7.858 -3.772 1.00 0.00 H new ATOM 0 HE3 MET A 97 0.294 -7.780 -5.350 1.00 0.00 H new ATOM 1531 N THR A 98 2.413 -13.779 -1.484 1.00 0.00 N ATOM 1532 CA THR A 98 2.437 -15.190 -1.003 1.00 0.00 C ATOM 1533 C THR A 98 1.621 -15.299 0.285 1.00 0.00 C ATOM 1534 O THR A 98 1.766 -16.235 1.047 1.00 0.00 O ATOM 1535 CB THR A 98 3.883 -15.616 -0.734 1.00 0.00 C ATOM 1536 OG1 THR A 98 3.918 -17.002 -0.422 1.00 0.00 O ATOM 1537 CG2 THR A 98 4.449 -14.814 0.440 1.00 0.00 C ATOM 0 H THR A 98 2.315 -13.075 -0.752 1.00 0.00 H new ATOM 0 HA THR A 98 2.006 -15.842 -1.763 1.00 0.00 H new ATOM 0 HB THR A 98 4.485 -15.426 -1.622 1.00 0.00 H new ATOM 0 HG1 THR A 98 3.228 -17.205 0.244 1.00 0.00 H new ATOM 0 HG21 THR A 98 5.478 -15.121 0.628 1.00 0.00 H new ATOM 0 HG22 THR A 98 4.425 -13.751 0.200 1.00 0.00 H new ATOM 0 HG23 THR A 98 3.847 -14.998 1.330 1.00 0.00 H new ATOM 1545 N SER A 99 0.760 -14.350 0.535 1.00 0.00 N ATOM 1546 CA SER A 99 -0.069 -14.393 1.763 1.00 0.00 C ATOM 1547 C SER A 99 -1.038 -13.234 1.679 1.00 0.00 C ATOM 1548 O SER A 99 -0.640 -12.101 1.513 1.00 0.00 O ATOM 1549 CB SER A 99 0.815 -14.247 2.998 1.00 0.00 C ATOM 1550 OG SER A 99 1.816 -13.269 2.749 1.00 0.00 O ATOM 0 H SER A 99 0.598 -13.542 -0.067 1.00 0.00 H new ATOM 0 HA SER A 99 -0.600 -15.342 1.842 1.00 0.00 H new ATOM 0 HB2 SER A 99 0.212 -13.955 3.858 1.00 0.00 H new ATOM 0 HB3 SER A 99 1.278 -15.203 3.243 1.00 0.00 H new ATOM 0 HG SER A 99 1.411 -12.490 2.314 1.00 0.00 H new ATOM 1556 N ILE A 100 -2.307 -13.501 1.745 1.00 0.00 N ATOM 1557 CA ILE A 100 -3.298 -12.403 1.612 1.00 0.00 C ATOM 1558 C ILE A 100 -4.497 -12.656 2.530 1.00 0.00 C ATOM 1559 O ILE A 100 -4.874 -13.782 2.784 1.00 0.00 O ATOM 1560 CB ILE A 100 -3.742 -12.369 0.149 1.00 0.00 C ATOM 1561 CG1 ILE A 100 -4.581 -13.632 -0.153 1.00 0.00 C ATOM 1562 CG2 ILE A 100 -2.499 -12.318 -0.755 1.00 0.00 C ATOM 1563 CD1 ILE A 100 -4.615 -13.918 -1.657 1.00 0.00 C ATOM 0 H ILE A 100 -2.702 -14.431 1.885 1.00 0.00 H new ATOM 0 HA ILE A 100 -2.859 -11.448 1.901 1.00 0.00 H new ATOM 0 HB ILE A 100 -4.351 -11.486 -0.041 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -4.160 -14.488 0.375 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -5.597 -13.496 0.219 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -2.810 -12.294 -1.800 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -1.920 -11.423 -0.528 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -1.885 -13.201 -0.580 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -5.211 -14.811 -1.844 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -5.058 -13.070 -2.179 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -3.600 -14.077 -2.020 1.00 0.00 H new ATOM 1842 N ASP A 118 10.989 -10.614 5.729 1.00 0.00 N ATOM 1843 CA ASP A 118 11.778 -9.714 4.830 1.00 0.00 C ATOM 1844 C ASP A 118 10.884 -8.547 4.423 1.00 0.00 C ATOM 1845 O ASP A 118 9.699 -8.574 4.675 1.00 0.00 O ATOM 1846 CB ASP A 118 12.209 -10.489 3.582 1.00 0.00 C ATOM 1847 CG ASP A 118 12.813 -11.831 4.000 1.00 0.00 C ATOM 1848 OD1 ASP A 118 13.938 -11.831 4.470 1.00 0.00 O ATOM 1849 OD2 ASP A 118 12.139 -12.836 3.844 1.00 0.00 O ATOM 0 HA ASP A 118 12.667 -9.348 5.344 1.00 0.00 H new ATOM 0 HB2 ASP A 118 11.353 -10.651 2.928 1.00 0.00 H new ATOM 0 HB3 ASP A 118 12.938 -9.910 3.015 1.00 0.00 H new ATOM 1854 N LYS A 119 11.438 -7.528 3.802 1.00 0.00 N ATOM 1855 CA LYS A 119 10.615 -6.348 3.367 1.00 0.00 C ATOM 1856 C LYS A 119 9.248 -6.838 2.869 1.00 0.00 C ATOM 1857 O LYS A 119 9.071 -7.188 1.718 1.00 0.00 O ATOM 1858 CB LYS A 119 11.343 -5.595 2.239 1.00 0.00 C ATOM 1859 CG LYS A 119 10.834 -4.140 2.158 1.00 0.00 C ATOM 1860 CD LYS A 119 11.597 -3.244 3.162 1.00 0.00 C ATOM 1861 CE LYS A 119 12.837 -2.631 2.495 1.00 0.00 C ATOM 1862 NZ LYS A 119 13.464 -3.630 1.585 1.00 0.00 N ATOM 0 H LYS A 119 12.431 -7.463 3.577 1.00 0.00 H new ATOM 0 HA LYS A 119 10.472 -5.672 4.210 1.00 0.00 H new ATOM 0 HB2 LYS A 119 12.418 -5.603 2.421 1.00 0.00 H new ATOM 0 HB3 LYS A 119 11.177 -6.100 1.288 1.00 0.00 H new ATOM 0 HG2 LYS A 119 10.967 -3.758 1.146 1.00 0.00 H new ATOM 0 HG3 LYS A 119 9.766 -4.109 2.373 1.00 0.00 H new ATOM 0 HD2 LYS A 119 10.941 -2.452 3.524 1.00 0.00 H new ATOM 0 HD3 LYS A 119 11.896 -3.832 4.030 1.00 0.00 H new ATOM 0 HE2 LYS A 119 12.557 -1.740 1.934 1.00 0.00 H new ATOM 0 HE3 LYS A 119 13.553 -2.317 3.255 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 14.340 -3.236 1.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 13.684 -4.495 2.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 12.805 -3.858 0.813 1.00 0.00 H new ATOM 1876 N GLN A 120 8.303 -6.897 3.763 1.00 0.00 N ATOM 1877 CA GLN A 120 6.940 -7.392 3.424 1.00 0.00 C ATOM 1878 C GLN A 120 6.020 -6.217 3.099 1.00 0.00 C ATOM 1879 O GLN A 120 6.146 -5.142 3.652 1.00 0.00 O ATOM 1880 CB GLN A 120 6.385 -8.168 4.632 1.00 0.00 C ATOM 1881 CG GLN A 120 6.511 -7.324 5.936 1.00 0.00 C ATOM 1882 CD GLN A 120 7.206 -8.128 7.047 1.00 0.00 C ATOM 1883 OE1 GLN A 120 6.876 -9.273 7.281 1.00 0.00 O ATOM 1884 NE2 GLN A 120 8.166 -7.568 7.741 1.00 0.00 N ATOM 0 H GLN A 120 8.421 -6.617 4.737 1.00 0.00 H new ATOM 0 HA GLN A 120 6.992 -8.044 2.552 1.00 0.00 H new ATOM 0 HB2 GLN A 120 5.340 -8.422 4.458 1.00 0.00 H new ATOM 0 HB3 GLN A 120 6.927 -9.107 4.747 1.00 0.00 H new ATOM 0 HG2 GLN A 120 7.077 -6.415 5.732 1.00 0.00 H new ATOM 0 HG3 GLN A 120 5.521 -7.015 6.271 1.00 0.00 H new ATOM 0 HE21 GLN A 120 8.443 -6.606 7.544 1.00 0.00 H new ATOM 0 HE22 GLN A 120 8.636 -8.094 8.478 1.00 0.00 H new ATOM 1893 N LEU A 121 5.089 -6.420 2.203 1.00 0.00 N ATOM 1894 CA LEU A 121 4.141 -5.328 1.827 1.00 0.00 C ATOM 1895 C LEU A 121 2.793 -5.570 2.505 1.00 0.00 C ATOM 1896 O LEU A 121 2.436 -6.686 2.821 1.00 0.00 O ATOM 1897 CB LEU A 121 3.930 -5.334 0.309 1.00 0.00 C ATOM 1898 CG LEU A 121 5.195 -4.848 -0.414 1.00 0.00 C ATOM 1899 CD1 LEU A 121 4.990 -5.001 -1.926 1.00 0.00 C ATOM 1900 CD2 LEU A 121 5.475 -3.367 -0.078 1.00 0.00 C ATOM 0 H LEU A 121 4.944 -7.302 1.712 1.00 0.00 H new ATOM 0 HA LEU A 121 4.554 -4.370 2.144 1.00 0.00 H new ATOM 0 HB2 LEU A 121 3.678 -6.341 -0.025 1.00 0.00 H new ATOM 0 HB3 LEU A 121 3.088 -4.692 0.051 1.00 0.00 H new ATOM 0 HG LEU A 121 6.047 -5.444 -0.087 1.00 0.00 H new ATOM 0 HD11 LEU A 121 5.882 -4.659 -2.451 1.00 0.00 H new ATOM 0 HD12 LEU A 121 4.808 -6.049 -2.164 1.00 0.00 H new ATOM 0 HD13 LEU A 121 4.134 -4.404 -2.239 1.00 0.00 H new ATOM 0 HD21 LEU A 121 6.375 -3.040 -0.599 1.00 0.00 H new ATOM 0 HD22 LEU A 121 4.630 -2.756 -0.395 1.00 0.00 H new ATOM 0 HD23 LEU A 121 5.618 -3.259 0.997 1.00 0.00 H new ATOM 1912 N THR A 122 2.034 -4.526 2.708 1.00 0.00 N ATOM 1913 CA THR A 122 0.687 -4.666 3.338 1.00 0.00 C ATOM 1914 C THR A 122 -0.267 -3.726 2.598 1.00 0.00 C ATOM 1915 O THR A 122 -0.441 -2.578 2.957 1.00 0.00 O ATOM 1916 CB THR A 122 0.767 -4.296 4.825 1.00 0.00 C ATOM 1917 OG1 THR A 122 1.469 -5.316 5.524 1.00 0.00 O ATOM 1918 CG2 THR A 122 -0.642 -4.162 5.409 1.00 0.00 C ATOM 0 H THR A 122 2.293 -3.571 2.461 1.00 0.00 H new ATOM 0 HA THR A 122 0.329 -5.693 3.269 1.00 0.00 H new ATOM 0 HB THR A 122 1.290 -3.345 4.930 1.00 0.00 H new ATOM 0 HG1 THR A 122 1.524 -5.083 6.474 1.00 0.00 H new ATOM 0 HG21 THR A 122 -0.575 -3.899 6.465 1.00 0.00 H new ATOM 0 HG22 THR A 122 -1.185 -3.382 4.875 1.00 0.00 H new ATOM 0 HG23 THR A 122 -1.171 -5.109 5.304 1.00 0.00 H new ATOM 1926 N LEU A 123 -0.860 -4.206 1.542 1.00 0.00 N ATOM 1927 CA LEU A 123 -1.777 -3.357 0.729 1.00 0.00 C ATOM 1928 C LEU A 123 -3.113 -3.146 1.458 1.00 0.00 C ATOM 1929 O LEU A 123 -3.604 -4.017 2.146 1.00 0.00 O ATOM 1930 CB LEU A 123 -2.016 -4.056 -0.613 1.00 0.00 C ATOM 1931 CG LEU A 123 -0.705 -4.664 -1.120 1.00 0.00 C ATOM 1932 CD1 LEU A 123 -0.909 -5.206 -2.535 1.00 0.00 C ATOM 1933 CD2 LEU A 123 0.388 -3.591 -1.139 1.00 0.00 C ATOM 0 H LEU A 123 -0.748 -5.161 1.203 1.00 0.00 H new ATOM 0 HA LEU A 123 -1.325 -2.378 0.571 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -2.769 -4.836 -0.499 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -2.403 -3.343 -1.341 1.00 0.00 H new ATOM 0 HG LEU A 123 -0.404 -5.475 -0.457 1.00 0.00 H new ATOM 0 HD11 LEU A 123 0.024 -5.639 -2.897 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -1.684 -5.972 -2.523 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -1.212 -4.394 -3.196 1.00 0.00 H new ATOM 0 HD21 LEU A 123 1.319 -4.027 -1.500 1.00 0.00 H new ATOM 0 HD22 LEU A 123 0.088 -2.778 -1.800 1.00 0.00 H new ATOM 0 HD23 LEU A 123 0.536 -3.204 -0.131 1.00 0.00 H new ATOM 1945 N ILE A 124 -3.703 -1.982 1.300 1.00 0.00 N ATOM 1946 CA ILE A 124 -5.014 -1.681 1.969 1.00 0.00 C ATOM 1947 C ILE A 124 -5.908 -0.905 0.994 1.00 0.00 C ATOM 1948 O ILE A 124 -5.428 -0.143 0.179 1.00 0.00 O ATOM 1949 CB ILE A 124 -4.785 -0.799 3.203 1.00 0.00 C ATOM 1950 CG1 ILE A 124 -3.721 -1.419 4.110 1.00 0.00 C ATOM 1951 CG2 ILE A 124 -6.096 -0.656 3.983 1.00 0.00 C ATOM 1952 CD1 ILE A 124 -3.371 -0.426 5.218 1.00 0.00 C ATOM 0 H ILE A 124 -3.330 -1.221 0.732 1.00 0.00 H new ATOM 0 HA ILE A 124 -5.482 -2.620 2.264 1.00 0.00 H new ATOM 0 HB ILE A 124 -4.443 0.182 2.874 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -4.090 -2.350 4.541 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -2.831 -1.667 3.531 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -5.931 -0.029 4.859 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -6.851 -0.197 3.345 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -6.440 -1.640 4.301 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -2.613 -0.860 5.870 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -2.986 0.493 4.775 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -4.264 -0.201 5.801 1.00 0.00 H new ATOM 1964 N THR A 125 -7.205 -1.080 1.073 1.00 0.00 N ATOM 1965 CA THR A 125 -8.122 -0.332 0.150 1.00 0.00 C ATOM 1966 C THR A 125 -8.648 0.918 0.865 1.00 0.00 C ATOM 1967 O THR A 125 -8.462 1.086 2.054 1.00 0.00 O ATOM 1968 CB THR A 125 -9.308 -1.222 -0.249 1.00 0.00 C ATOM 1969 OG1 THR A 125 -10.377 -1.027 0.665 1.00 0.00 O ATOM 1970 CG2 THR A 125 -8.883 -2.690 -0.219 1.00 0.00 C ATOM 0 H THR A 125 -7.669 -1.705 1.733 1.00 0.00 H new ATOM 0 HA THR A 125 -7.572 -0.045 -0.746 1.00 0.00 H new ATOM 0 HB THR A 125 -9.632 -0.957 -1.255 1.00 0.00 H new ATOM 0 HG1 THR A 125 -11.134 -1.594 0.409 1.00 0.00 H new ATOM 0 HG21 THR A 125 -9.727 -3.319 -0.503 1.00 0.00 H new ATOM 0 HG22 THR A 125 -8.063 -2.846 -0.920 1.00 0.00 H new ATOM 0 HG23 THR A 125 -8.556 -2.954 0.787 1.00 0.00 H new ATOM 1978 N CYS A 126 -9.305 1.796 0.151 1.00 0.00 N ATOM 1979 CA CYS A 126 -9.845 3.035 0.792 1.00 0.00 C ATOM 1980 C CYS A 126 -11.118 3.483 0.057 1.00 0.00 C ATOM 1981 O CYS A 126 -11.058 4.174 -0.939 1.00 0.00 O ATOM 1982 CB CYS A 126 -8.781 4.142 0.721 1.00 0.00 C ATOM 1983 SG CYS A 126 -7.729 4.058 2.193 1.00 0.00 S ATOM 0 H CYS A 126 -9.491 1.709 -0.848 1.00 0.00 H new ATOM 0 HA CYS A 126 -10.091 2.834 1.835 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -8.177 4.024 -0.179 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -9.260 5.119 0.658 1.00 0.00 H new ATOM 0 HG CYS A 126 -8.413 4.423 3.236 1.00 0.00 H new ATOM 1989 N ASP A 127 -12.269 3.103 0.545 1.00 0.00 N ATOM 1990 CA ASP A 127 -13.537 3.517 -0.126 1.00 0.00 C ATOM 1991 C ASP A 127 -14.681 3.503 0.891 1.00 0.00 C ATOM 1992 O ASP A 127 -14.746 2.648 1.752 1.00 0.00 O ATOM 1993 CB ASP A 127 -13.851 2.550 -1.268 1.00 0.00 C ATOM 1994 CG ASP A 127 -13.984 1.130 -0.715 1.00 0.00 C ATOM 1995 OD1 ASP A 127 -13.152 0.749 0.092 1.00 0.00 O ATOM 1996 OD2 ASP A 127 -14.916 0.447 -1.108 1.00 0.00 O ATOM 0 H ASP A 127 -12.386 2.525 1.377 1.00 0.00 H new ATOM 0 HA ASP A 127 -13.424 4.524 -0.528 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -14.775 2.846 -1.765 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -13.060 2.587 -2.017 1.00 0.00 H new ATOM 2001 N ASP A 128 -15.576 4.451 0.805 1.00 0.00 N ATOM 2002 CA ASP A 128 -16.714 4.505 1.768 1.00 0.00 C ATOM 2003 C ASP A 128 -16.170 4.785 3.169 1.00 0.00 C ATOM 2004 O ASP A 128 -16.407 4.042 4.094 1.00 0.00 O ATOM 2005 CB ASP A 128 -17.469 3.167 1.763 1.00 0.00 C ATOM 2006 CG ASP A 128 -17.500 2.602 0.341 1.00 0.00 C ATOM 2007 OD1 ASP A 128 -17.694 3.380 -0.580 1.00 0.00 O ATOM 2008 OD2 ASP A 128 -17.329 1.404 0.197 1.00 0.00 O ATOM 0 H ASP A 128 -15.567 5.194 0.106 1.00 0.00 H new ATOM 0 HA ASP A 128 -17.401 5.298 1.475 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -16.982 2.461 2.436 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -18.485 3.310 2.131 1.00 0.00 H new ATOM 2013 N TYR A 129 -15.435 5.848 3.332 1.00 0.00 N ATOM 2014 CA TYR A 129 -14.873 6.160 4.675 1.00 0.00 C ATOM 2015 C TYR A 129 -16.011 6.443 5.662 1.00 0.00 C ATOM 2016 O TYR A 129 -16.827 7.315 5.444 1.00 0.00 O ATOM 2017 CB TYR A 129 -13.951 7.383 4.567 1.00 0.00 C ATOM 2018 CG TYR A 129 -13.300 7.666 5.902 1.00 0.00 C ATOM 2019 CD1 TYR A 129 -14.021 8.304 6.921 1.00 0.00 C ATOM 2020 CD2 TYR A 129 -11.969 7.295 6.119 1.00 0.00 C ATOM 2021 CE1 TYR A 129 -13.407 8.567 8.152 1.00 0.00 C ATOM 2022 CE2 TYR A 129 -11.355 7.558 7.347 1.00 0.00 C ATOM 2023 CZ TYR A 129 -12.075 8.195 8.365 1.00 0.00 C ATOM 2024 OH TYR A 129 -11.470 8.454 9.578 1.00 0.00 O ATOM 0 H TYR A 129 -15.199 6.513 2.596 1.00 0.00 H new ATOM 0 HA TYR A 129 -14.299 5.307 5.038 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -13.186 7.205 3.812 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -14.524 8.252 4.242 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -15.049 8.592 6.757 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -11.413 6.803 5.334 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -13.962 9.058 8.938 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -10.327 7.270 7.510 1.00 0.00 H new ATOM 0 HH TYR A 129 -10.737 7.819 9.720 1.00 0.00 H new ATOM 2034 N ASN A 130 -16.075 5.713 6.752 1.00 0.00 N ATOM 2035 CA ASN A 130 -17.169 5.954 7.742 1.00 0.00 C ATOM 2036 C ASN A 130 -16.759 7.092 8.683 1.00 0.00 C ATOM 2037 O ASN A 130 -15.735 7.035 9.333 1.00 0.00 O ATOM 2038 CB ASN A 130 -17.407 4.683 8.560 1.00 0.00 C ATOM 2039 CG ASN A 130 -18.494 4.940 9.603 1.00 0.00 C ATOM 2040 OD1 ASN A 130 -18.994 6.042 9.716 1.00 0.00 O ATOM 2041 ND2 ASN A 130 -18.885 3.961 10.373 1.00 0.00 N ATOM 0 H ASN A 130 -15.422 4.968 6.995 1.00 0.00 H new ATOM 0 HA ASN A 130 -18.084 6.224 7.215 1.00 0.00 H new ATOM 0 HB2 ASN A 130 -17.705 3.866 7.903 1.00 0.00 H new ATOM 0 HB3 ASN A 130 -16.483 4.376 9.051 1.00 0.00 H new ATOM 0 HD21 ASN A 130 -19.611 4.120 11.071 1.00 0.00 H new ATOM 0 HD22 ASN A 130 -18.464 3.037 10.276 1.00 0.00 H new ATOM 2048 N GLU A 131 -17.553 8.130 8.751 1.00 0.00 N ATOM 2049 CA GLU A 131 -17.216 9.285 9.637 1.00 0.00 C ATOM 2050 C GLU A 131 -17.764 9.040 11.045 1.00 0.00 C ATOM 2051 O GLU A 131 -17.679 9.891 11.908 1.00 0.00 O ATOM 2052 CB GLU A 131 -17.842 10.560 9.064 1.00 0.00 C ATOM 2053 CG GLU A 131 -19.286 10.275 8.646 1.00 0.00 C ATOM 2054 CD GLU A 131 -20.025 11.595 8.424 1.00 0.00 C ATOM 2055 OE1 GLU A 131 -19.368 12.624 8.411 1.00 0.00 O ATOM 2056 OE2 GLU A 131 -21.234 11.556 8.268 1.00 0.00 O ATOM 0 H GLU A 131 -18.424 8.228 8.229 1.00 0.00 H new ATOM 0 HA GLU A 131 -16.133 9.395 9.689 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -17.818 11.356 9.808 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -17.266 10.907 8.207 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -19.300 9.680 7.733 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -19.789 9.690 9.415 1.00 0.00 H new ATOM 2063 N LYS A 132 -18.325 7.889 11.288 1.00 0.00 N ATOM 2064 CA LYS A 132 -18.873 7.604 12.646 1.00 0.00 C ATOM 2065 C LYS A 132 -17.732 7.201 13.581 1.00 0.00 C ATOM 2066 O LYS A 132 -17.528 7.797 14.619 1.00 0.00 O ATOM 2067 CB LYS A 132 -19.892 6.466 12.561 1.00 0.00 C ATOM 2068 CG LYS A 132 -21.168 6.977 11.888 1.00 0.00 C ATOM 2069 CD LYS A 132 -22.071 5.793 11.534 1.00 0.00 C ATOM 2070 CE LYS A 132 -23.447 6.312 11.110 1.00 0.00 C ATOM 2071 NZ LYS A 132 -24.246 5.192 10.538 1.00 0.00 N ATOM 0 H LYS A 132 -18.428 7.135 10.609 1.00 0.00 H new ATOM 0 HA LYS A 132 -19.363 8.497 13.034 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -19.477 5.633 11.994 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -20.119 6.091 13.559 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -21.693 7.662 12.554 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -20.917 7.538 10.988 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -21.626 5.210 10.728 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -22.170 5.127 12.392 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -23.965 6.742 11.967 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -23.336 7.107 10.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -25.181 5.544 10.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -23.753 4.801 9.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -24.363 4.447 11.255 1.00 0.00 H new ATOM 2085 N THR A 133 -16.982 6.194 13.219 1.00 0.00 N ATOM 2086 CA THR A 133 -15.848 5.747 14.084 1.00 0.00 C ATOM 2087 C THR A 133 -14.548 6.393 13.599 1.00 0.00 C ATOM 2088 O THR A 133 -13.536 6.353 14.270 1.00 0.00 O ATOM 2089 CB THR A 133 -15.719 4.224 14.007 1.00 0.00 C ATOM 2090 OG1 THR A 133 -15.707 3.819 12.644 1.00 0.00 O ATOM 2091 CG2 THR A 133 -16.901 3.573 14.727 1.00 0.00 C ATOM 0 H THR A 133 -17.105 5.659 12.359 1.00 0.00 H new ATOM 0 HA THR A 133 -16.039 6.046 15.115 1.00 0.00 H new ATOM 0 HB THR A 133 -14.791 3.913 14.486 1.00 0.00 H new ATOM 0 HG1 THR A 133 -15.623 2.844 12.593 1.00 0.00 H new ATOM 0 HG21 THR A 133 -16.808 2.488 14.672 1.00 0.00 H new ATOM 0 HG22 THR A 133 -16.907 3.884 15.772 1.00 0.00 H new ATOM 0 HG23 THR A 133 -17.832 3.882 14.251 1.00 0.00 H new ATOM 2099 N GLY A 134 -14.565 6.990 12.437 1.00 0.00 N ATOM 2100 CA GLY A 134 -13.329 7.637 11.913 1.00 0.00 C ATOM 2101 C GLY A 134 -12.389 6.568 11.352 1.00 0.00 C ATOM 2102 O GLY A 134 -11.203 6.571 11.616 1.00 0.00 O ATOM 0 H GLY A 134 -15.381 7.057 11.829 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -13.585 8.356 11.134 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -12.832 8.192 12.708 1.00 0.00 H new ATOM 2106 N VAL A 135 -12.911 5.647 10.584 1.00 0.00 N ATOM 2107 CA VAL A 135 -12.052 4.567 10.007 1.00 0.00 C ATOM 2108 C VAL A 135 -12.584 4.169 8.629 1.00 0.00 C ATOM 2109 O VAL A 135 -13.757 4.302 8.344 1.00 0.00 O ATOM 2110 CB VAL A 135 -12.094 3.341 10.927 1.00 0.00 C ATOM 2111 CG1 VAL A 135 -10.934 2.402 10.586 1.00 0.00 C ATOM 2112 CG2 VAL A 135 -11.975 3.788 12.387 1.00 0.00 C ATOM 0 H VAL A 135 -13.898 5.595 10.330 1.00 0.00 H new ATOM 0 HA VAL A 135 -11.029 4.931 9.915 1.00 0.00 H new ATOM 0 HB VAL A 135 -13.039 2.817 10.784 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -10.966 1.531 11.241 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -11.020 2.079 9.549 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -9.989 2.926 10.725 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -12.005 2.915 13.039 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -11.032 4.315 12.530 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -12.803 4.453 12.633 1.00 0.00 H new ATOM 2122 N TRP A 136 -11.734 3.664 7.776 1.00 0.00 N ATOM 2123 CA TRP A 136 -12.203 3.244 6.433 1.00 0.00 C ATOM 2124 C TRP A 136 -13.238 2.131 6.604 1.00 0.00 C ATOM 2125 O TRP A 136 -12.919 1.036 7.019 1.00 0.00 O ATOM 2126 CB TRP A 136 -11.007 2.739 5.612 1.00 0.00 C ATOM 2127 CG TRP A 136 -10.295 3.907 5.007 1.00 0.00 C ATOM 2128 CD1 TRP A 136 -9.104 4.397 5.417 1.00 0.00 C ATOM 2129 CD2 TRP A 136 -10.720 4.744 3.896 1.00 0.00 C ATOM 2130 NE1 TRP A 136 -8.775 5.484 4.625 1.00 0.00 N ATOM 2131 CE2 TRP A 136 -9.738 5.735 3.673 1.00 0.00 C ATOM 2132 CE3 TRP A 136 -11.853 4.736 3.071 1.00 0.00 C ATOM 2133 CZ2 TRP A 136 -9.874 6.687 2.663 1.00 0.00 C ATOM 2134 CZ3 TRP A 136 -11.996 5.692 2.050 1.00 0.00 C ATOM 2135 CH2 TRP A 136 -11.008 6.667 1.848 1.00 0.00 C ATOM 0 H TRP A 136 -10.739 3.526 7.954 1.00 0.00 H new ATOM 0 HA TRP A 136 -12.657 4.084 5.908 1.00 0.00 H new ATOM 0 HB2 TRP A 136 -10.327 2.174 6.249 1.00 0.00 H new ATOM 0 HB3 TRP A 136 -11.348 2.061 4.830 1.00 0.00 H new ATOM 0 HD1 TRP A 136 -8.508 4.006 6.228 1.00 0.00 H new ATOM 0 HE1 TRP A 136 -7.922 6.033 4.734 1.00 0.00 H new ATOM 0 HE3 TRP A 136 -12.621 3.991 3.220 1.00 0.00 H new ATOM 0 HZ2 TRP A 136 -9.108 7.434 2.512 1.00 0.00 H new ATOM 0 HZ3 TRP A 136 -12.871 5.676 1.418 1.00 0.00 H new ATOM 0 HH2 TRP A 136 -11.124 7.401 1.064 1.00 0.00 H new ATOM 2146 N GLU A 137 -14.484 2.415 6.307 1.00 0.00 N ATOM 2147 CA GLU A 137 -15.555 1.387 6.468 1.00 0.00 C ATOM 2148 C GLU A 137 -15.054 0.027 5.958 1.00 0.00 C ATOM 2149 O GLU A 137 -14.582 -0.793 6.720 1.00 0.00 O ATOM 2150 CB GLU A 137 -16.803 1.810 5.683 1.00 0.00 C ATOM 2151 CG GLU A 137 -17.978 0.886 6.026 1.00 0.00 C ATOM 2152 CD GLU A 137 -17.806 -0.454 5.311 1.00 0.00 C ATOM 2153 OE1 GLU A 137 -17.952 -0.481 4.100 1.00 0.00 O ATOM 2154 OE2 GLU A 137 -17.530 -1.432 5.988 1.00 0.00 O ATOM 0 H GLU A 137 -14.804 3.319 5.959 1.00 0.00 H new ATOM 0 HA GLU A 137 -15.810 1.299 7.524 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -17.060 2.842 5.921 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -16.600 1.771 4.613 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -18.028 0.730 7.104 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -18.918 1.351 5.727 1.00 0.00 H new ATOM 2161 N LYS A 138 -15.135 -0.212 4.676 1.00 0.00 N ATOM 2162 CA LYS A 138 -14.645 -1.510 4.120 1.00 0.00 C ATOM 2163 C LYS A 138 -13.146 -1.373 3.831 1.00 0.00 C ATOM 2164 O LYS A 138 -12.680 -0.325 3.426 1.00 0.00 O ATOM 2165 CB LYS A 138 -15.413 -1.828 2.813 1.00 0.00 C ATOM 2166 CG LYS A 138 -16.536 -2.847 3.080 1.00 0.00 C ATOM 2167 CD LYS A 138 -15.963 -4.279 3.109 1.00 0.00 C ATOM 2168 CE LYS A 138 -15.918 -4.862 1.691 1.00 0.00 C ATOM 2169 NZ LYS A 138 -17.290 -5.271 1.279 1.00 0.00 N ATOM 0 H LYS A 138 -15.520 0.436 3.988 1.00 0.00 H new ATOM 0 HA LYS A 138 -14.811 -2.320 4.831 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -15.836 -0.912 2.401 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -14.724 -2.225 2.067 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -17.022 -2.623 4.030 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -17.299 -2.769 2.306 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -14.961 -4.269 3.537 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -16.577 -4.911 3.750 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -15.523 -4.123 0.995 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -15.246 -5.720 1.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -17.230 -5.915 0.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -17.760 -5.756 2.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -17.839 -4.428 1.015 1.00 0.00 H new ATOM 2183 N ARG A 139 -12.383 -2.414 4.032 1.00 0.00 N ATOM 2184 CA ARG A 139 -10.921 -2.312 3.761 1.00 0.00 C ATOM 2185 C ARG A 139 -10.304 -3.708 3.602 1.00 0.00 C ATOM 2186 O ARG A 139 -9.902 -4.335 4.561 1.00 0.00 O ATOM 2187 CB ARG A 139 -10.234 -1.572 4.916 1.00 0.00 C ATOM 2188 CG ARG A 139 -10.855 -2.011 6.250 1.00 0.00 C ATOM 2189 CD ARG A 139 -10.043 -1.450 7.432 1.00 0.00 C ATOM 2190 NE ARG A 139 -10.122 -2.402 8.587 1.00 0.00 N ATOM 2191 CZ ARG A 139 -11.271 -2.872 9.000 1.00 0.00 C ATOM 2192 NH1 ARG A 139 -12.390 -2.370 8.554 1.00 0.00 N ATOM 2193 NH2 ARG A 139 -11.301 -3.808 9.909 1.00 0.00 N ATOM 0 H ARG A 139 -12.705 -3.321 4.369 1.00 0.00 H new ATOM 0 HA ARG A 139 -10.775 -1.759 2.833 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -9.165 -1.785 4.913 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -10.345 -0.495 4.789 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -11.886 -1.662 6.311 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -10.883 -3.099 6.304 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -9.004 -1.304 7.137 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -10.431 -0.474 7.724 1.00 0.00 H new ATOM 0 HE ARG A 139 -9.265 -2.689 9.059 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -12.373 -1.606 7.879 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -13.282 -2.742 8.881 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -10.430 -4.171 10.296 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -12.196 -4.176 10.233 1.00 0.00 H new ATOM 2207 N LYS A 140 -10.197 -4.183 2.391 1.00 0.00 N ATOM 2208 CA LYS A 140 -9.572 -5.516 2.168 1.00 0.00 C ATOM 2209 C LYS A 140 -8.060 -5.361 2.337 1.00 0.00 C ATOM 2210 O LYS A 140 -7.546 -4.256 2.331 1.00 0.00 O ATOM 2211 CB LYS A 140 -9.889 -6.004 0.751 1.00 0.00 C ATOM 2212 CG LYS A 140 -11.370 -5.768 0.451 1.00 0.00 C ATOM 2213 CD LYS A 140 -11.731 -6.420 -0.885 1.00 0.00 C ATOM 2214 CE LYS A 140 -13.181 -6.085 -1.241 1.00 0.00 C ATOM 2215 NZ LYS A 140 -13.267 -4.668 -1.692 1.00 0.00 N ATOM 0 H LYS A 140 -10.515 -3.706 1.548 1.00 0.00 H new ATOM 0 HA LYS A 140 -9.960 -6.243 2.881 1.00 0.00 H new ATOM 0 HB2 LYS A 140 -9.271 -5.475 0.026 1.00 0.00 H new ATOM 0 HB3 LYS A 140 -9.652 -7.064 0.658 1.00 0.00 H new ATOM 0 HG2 LYS A 140 -11.984 -6.185 1.249 1.00 0.00 H new ATOM 0 HG3 LYS A 140 -11.578 -4.699 0.414 1.00 0.00 H new ATOM 0 HD2 LYS A 140 -11.062 -6.064 -1.668 1.00 0.00 H new ATOM 0 HD3 LYS A 140 -11.601 -7.500 -0.821 1.00 0.00 H new ATOM 0 HE2 LYS A 140 -13.537 -6.750 -2.028 1.00 0.00 H new ATOM 0 HE3 LYS A 140 -13.825 -6.242 -0.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 -14.185 -4.506 -2.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 -13.176 -4.036 -0.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 -12.501 -4.471 -2.367 1.00 0.00 H new ATOM 2229 N ILE A 141 -7.337 -6.443 2.505 1.00 0.00 N ATOM 2230 CA ILE A 141 -5.856 -6.327 2.698 1.00 0.00 C ATOM 2231 C ILE A 141 -5.126 -7.497 2.026 1.00 0.00 C ATOM 2232 O ILE A 141 -5.671 -8.567 1.839 1.00 0.00 O ATOM 2233 CB ILE A 141 -5.550 -6.336 4.203 1.00 0.00 C ATOM 2234 CG1 ILE A 141 -6.619 -5.523 4.941 1.00 0.00 C ATOM 2235 CG2 ILE A 141 -4.170 -5.719 4.457 1.00 0.00 C ATOM 2236 CD1 ILE A 141 -6.244 -5.390 6.417 1.00 0.00 C ATOM 0 H ILE A 141 -7.705 -7.394 2.517 1.00 0.00 H new ATOM 0 HA ILE A 141 -5.512 -5.398 2.244 1.00 0.00 H new ATOM 0 HB ILE A 141 -5.554 -7.363 4.567 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -6.713 -4.535 4.490 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -7.589 -6.010 4.846 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -3.959 -5.728 5.526 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -3.410 -6.298 3.932 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -4.158 -4.691 4.094 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -7.008 -4.811 6.936 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -6.173 -6.381 6.865 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -5.283 -4.883 6.504 1.00 0.00 H new ATOM 2248 N PHE A 142 -3.880 -7.288 1.683 1.00 0.00 N ATOM 2249 CA PHE A 142 -3.063 -8.361 1.039 1.00 0.00 C ATOM 2250 C PHE A 142 -1.644 -8.292 1.611 1.00 0.00 C ATOM 2251 O PHE A 142 -1.273 -7.316 2.231 1.00 0.00 O ATOM 2252 CB PHE A 142 -3.013 -8.136 -0.474 1.00 0.00 C ATOM 2253 CG PHE A 142 -4.413 -8.209 -1.041 1.00 0.00 C ATOM 2254 CD1 PHE A 142 -5.305 -7.149 -0.837 1.00 0.00 C ATOM 2255 CD2 PHE A 142 -4.819 -9.336 -1.767 1.00 0.00 C ATOM 2256 CE1 PHE A 142 -6.603 -7.217 -1.358 1.00 0.00 C ATOM 2257 CE2 PHE A 142 -6.117 -9.403 -2.287 1.00 0.00 C ATOM 2258 CZ PHE A 142 -7.008 -8.344 -2.083 1.00 0.00 C ATOM 0 H PHE A 142 -3.387 -6.406 1.824 1.00 0.00 H new ATOM 0 HA PHE A 142 -3.506 -9.337 1.237 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -2.570 -7.164 -0.693 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -2.379 -8.888 -0.944 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -4.992 -6.279 -0.278 1.00 0.00 H new ATOM 0 HD2 PHE A 142 -4.131 -10.153 -1.926 1.00 0.00 H new ATOM 0 HE1 PHE A 142 -7.292 -6.400 -1.201 1.00 0.00 H new ATOM 0 HE2 PHE A 142 -6.431 -10.272 -2.846 1.00 0.00 H new ATOM 0 HZ PHE A 142 -8.009 -8.396 -2.485 1.00 0.00 H new ATOM 2268 N VAL A 143 -0.842 -9.311 1.419 1.00 0.00 N ATOM 2269 CA VAL A 143 0.551 -9.270 1.970 1.00 0.00 C ATOM 2270 C VAL A 143 1.510 -10.040 1.055 1.00 0.00 C ATOM 2271 O VAL A 143 1.144 -11.014 0.416 1.00 0.00 O ATOM 2272 CB VAL A 143 0.571 -9.893 3.368 1.00 0.00 C ATOM 2273 CG1 VAL A 143 1.985 -9.807 3.944 1.00 0.00 C ATOM 2274 CG2 VAL A 143 -0.394 -9.133 4.281 1.00 0.00 C ATOM 0 H VAL A 143 -1.087 -10.161 0.911 1.00 0.00 H new ATOM 0 HA VAL A 143 0.874 -8.230 2.027 1.00 0.00 H new ATOM 0 HB VAL A 143 0.265 -10.937 3.303 1.00 0.00 H new ATOM 0 HG11 VAL A 143 2.000 -10.250 4.940 1.00 0.00 H new ATOM 0 HG12 VAL A 143 2.675 -10.347 3.296 1.00 0.00 H new ATOM 0 HG13 VAL A 143 2.289 -8.762 4.008 1.00 0.00 H new ATOM 0 HG21 VAL A 143 -0.379 -9.577 5.276 1.00 0.00 H new ATOM 0 HG22 VAL A 143 -0.088 -8.089 4.345 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -1.403 -9.191 3.873 1.00 0.00 H new ATOM 2284 N ALA A 144 2.745 -9.603 0.996 1.00 0.00 N ATOM 2285 CA ALA A 144 3.760 -10.282 0.133 1.00 0.00 C ATOM 2286 C ALA A 144 5.109 -10.295 0.861 1.00 0.00 C ATOM 2287 O ALA A 144 5.231 -9.794 1.962 1.00 0.00 O ATOM 2288 CB ALA A 144 3.899 -9.508 -1.181 1.00 0.00 C ATOM 0 H ALA A 144 3.095 -8.797 1.514 1.00 0.00 H new ATOM 0 HA ALA A 144 3.446 -11.305 -0.076 1.00 0.00 H new ATOM 0 HB1 ALA A 144 4.638 -9.998 -1.815 1.00 0.00 H new ATOM 0 HB2 ALA A 144 2.938 -9.486 -1.694 1.00 0.00 H new ATOM 0 HB3 ALA A 144 4.221 -8.488 -0.970 1.00 0.00 H new ATOM 2294 N THR A 145 6.125 -10.867 0.261 1.00 0.00 N ATOM 2295 CA THR A 145 7.467 -10.912 0.929 1.00 0.00 C ATOM 2296 C THR A 145 8.577 -10.743 -0.114 1.00 0.00 C ATOM 2297 O THR A 145 8.488 -11.242 -1.218 1.00 0.00 O ATOM 2298 CB THR A 145 7.636 -12.258 1.645 1.00 0.00 C ATOM 2299 OG1 THR A 145 8.791 -12.207 2.472 1.00 0.00 O ATOM 2300 CG2 THR A 145 7.793 -13.384 0.619 1.00 0.00 C ATOM 0 H THR A 145 6.085 -11.304 -0.660 1.00 0.00 H new ATOM 0 HA THR A 145 7.533 -10.101 1.654 1.00 0.00 H new ATOM 0 HB THR A 145 6.753 -12.453 2.254 1.00 0.00 H new ATOM 0 HG1 THR A 145 8.902 -13.065 2.933 1.00 0.00 H new ATOM 0 HG21 THR A 145 7.912 -14.335 1.138 1.00 0.00 H new ATOM 0 HG22 THR A 145 6.907 -13.425 -0.015 1.00 0.00 H new ATOM 0 HG23 THR A 145 8.672 -13.194 0.002 1.00 0.00 H new ATOM 2308 N GLU A 146 9.626 -10.046 0.235 1.00 0.00 N ATOM 2309 CA GLU A 146 10.747 -9.848 -0.729 1.00 0.00 C ATOM 2310 C GLU A 146 11.274 -11.207 -1.189 1.00 0.00 C ATOM 2311 O GLU A 146 11.189 -12.190 -0.481 1.00 0.00 O ATOM 2312 CB GLU A 146 11.877 -9.079 -0.044 1.00 0.00 C ATOM 2313 CG GLU A 146 12.935 -8.690 -1.080 1.00 0.00 C ATOM 2314 CD GLU A 146 14.013 -7.835 -0.411 1.00 0.00 C ATOM 2315 OE1 GLU A 146 14.290 -8.070 0.753 1.00 0.00 O ATOM 2316 OE2 GLU A 146 14.545 -6.961 -1.076 1.00 0.00 O ATOM 0 H GLU A 146 9.755 -9.605 1.146 1.00 0.00 H new ATOM 0 HA GLU A 146 10.386 -9.285 -1.590 1.00 0.00 H new ATOM 0 HB2 GLU A 146 11.482 -8.186 0.440 1.00 0.00 H new ATOM 0 HB3 GLU A 146 12.326 -9.692 0.737 1.00 0.00 H new ATOM 0 HG2 GLU A 146 13.382 -9.585 -1.513 1.00 0.00 H new ATOM 0 HG3 GLU A 146 12.473 -8.137 -1.898 1.00 0.00 H new ATOM 2323 N VAL A 147 11.823 -11.267 -2.374 1.00 0.00 N ATOM 2324 CA VAL A 147 12.365 -12.555 -2.891 1.00 0.00 C ATOM 2325 C VAL A 147 13.852 -12.653 -2.545 1.00 0.00 C ATOM 2326 O VAL A 147 14.468 -11.689 -2.133 1.00 0.00 O ATOM 2327 CB VAL A 147 12.195 -12.596 -4.410 1.00 0.00 C ATOM 2328 CG1 VAL A 147 10.728 -12.856 -4.755 1.00 0.00 C ATOM 2329 CG2 VAL A 147 12.628 -11.254 -5.007 1.00 0.00 C ATOM 0 H VAL A 147 11.919 -10.474 -3.008 1.00 0.00 H new ATOM 0 HA VAL A 147 11.829 -13.389 -2.438 1.00 0.00 H new ATOM 0 HB VAL A 147 12.811 -13.395 -4.822 1.00 0.00 H new ATOM 0 HG11 VAL A 147 10.609 -12.885 -5.838 1.00 0.00 H new ATOM 0 HG12 VAL A 147 10.418 -13.811 -4.330 1.00 0.00 H new ATOM 0 HG13 VAL A 147 10.110 -12.058 -4.343 1.00 0.00 H new ATOM 0 HG21 VAL A 147 12.507 -11.282 -6.090 1.00 0.00 H new ATOM 0 HG22 VAL A 147 12.011 -10.456 -4.593 1.00 0.00 H new ATOM 0 HG23 VAL A 147 13.674 -11.068 -4.763 1.00 0.00 H new