USER MOD reduce.3.24.130724 H: found=0, std=0, add=1192, rem=0, adj=51 USER MOD reduce.3.24.130724 removed 1192 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 123 LYS NZ :NH3+ 162:sc= 1.06 (180deg=-0.169) USER MOD Set 1.2: A 145 THR OG1 : rot 146:sc= 0.92 USER MOD Set 2.1: A 93 SER OG : rot -85:sc= -0.046 USER MOD Set 2.2: A 95 CYS SG : rot -35:sc= 1.58 USER MOD Set 2.3: A 107 TYR OH : rot -36:sc= 0.325 USER MOD Set 2.4: A 126 GLN : amide:sc= 0.483 K(o=2.3,f=0.86) USER MOD Set 3.1: A 77 CYS SG : rot 180:sc= 0.092 USER MOD Set 3.2: A 84 SER OG : rot 180:sc= 0 USER MOD Set 4.1: A 30 TYR OH : rot 180:sc= 0 USER MOD Set 4.2: A 103 LYS NZ :NH3+ -167:sc= 1.13 (180deg=0.973) USER MOD Set 5.1: A 8 SER OG : rot 84:sc= 1.9 USER MOD Set 5.2: A 36 GLN : amide:sc= -1.97! C(o=-0.064!,f=-1.1!) USER MOD Set 6.1: A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 6.2: A 102 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0382) USER MOD Single : A 1 MET N :NH3+ 170:sc= 1.36 (180deg=1.14) USER MOD Single : A 3 SER OG : rot -3:sc= 0.323! USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 CYS SG : rot 93:sc= 0.482 USER MOD Single : A 12 LYS NZ :NH3+ 176:sc= 1.26 (180deg=1.23) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0.0176 USER MOD Single : A 14 THR OG1 : rot 130:sc= 0 USER MOD Single : A 15 TYR OH : rot 19:sc= 0.773 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 LYS NZ :NH3+ 150:sc= 2.13 (180deg=0.51) USER MOD Single : A 23 LYS NZ :NH3+ -167:sc= 0.39 (180deg=0.28) USER MOD Single : A 24 HIS : no HD1:sc= -0.926 K(o=-0.93,f=-2.2!) USER MOD Single : A 26 TYR OH : rot -57:sc= 0.003 USER MOD Single : A 35 LYS NZ :NH3+ -178:sc= 1.21 (180deg=1.19) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 49 TYR OH : rot 180:sc= 0.981 USER MOD Single : A 51 GLN : amide:sc= -0.185 K(o=-0.19,f=-5.3!) USER MOD Single : A 57 GLN :FLIP amide:sc= -0.0925 F(o=-2.5!,f=-0.093) USER MOD Single : A 58 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0231) USER MOD Single : A 59 CYS SG : rot -71:sc= 1.28 USER MOD Single : A 64 CYS SG : rot 37:sc= 0.0827 USER MOD Single : A 66 TYR OH : rot 90:sc= -0.0568 USER MOD Single : A 73 TYR OH : rot -137:sc= 1.29 USER MOD Single : A 74 MET CE :methyl 146:sc= -0.229 (180deg=-2.18!) USER MOD Single : A 75 HIS : no HD1:sc= 0.372 K(o=0.37,f=-5!) USER MOD Single : A 76 GLN : amide:sc= 0.964 K(o=0.96,f=-6.2!) USER MOD Single : A 78 GLN : amide:sc= 0 K(o=0,f=-0.74) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 GLN : amide:sc= -0.457 K(o=-0.46,f=-1.7) USER MOD Single : A 88 LYS NZ :NH3+ 174:sc= -0.261 (180deg=-0.375) USER MOD Single : A 92 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0.0338 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ 155:sc= 0.77 (180deg=0.046) USER MOD Single : A 105 MET CE :methyl -114:sc= -1.11 (180deg=-4.84!) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 119:sc= -0.957 USER MOD Single : A 110 SER OG : rot 125:sc= -1.66! USER MOD Single : A 115 LYS NZ :NH3+ -158:sc= 1.16 (180deg=0.727) USER MOD Single : A 116 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.02) USER MOD Single : A 117 SER OG : rot 150:sc= -0.541 USER MOD Single : A 122 GLN : amide:sc= -0.134 K(o=-0.13,f=-0.78) USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 THR OG1 : rot 180:sc= 0.00633 USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD Single : A 134 SER OG : rot 59:sc= 1.22 USER MOD Single : A 141 LYS NZ :NH3+ 156:sc= 1.21 (180deg=1.14) USER MOD Single : A 148 GLN :FLIP amide:sc= -1 F(o=-3.3!,f=-1) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.219 -1.552 0.242 1.00 21.32 N ATOM 2 CA MET A 1 1.917 -0.687 -0.924 1.00 12.35 C ATOM 3 C MET A 1 3.060 -0.703 -1.930 1.00 53.40 C ATOM 4 O MET A 1 2.837 -0.887 -3.126 1.00 52.23 O ATOM 5 CB MET A 1 1.642 0.749 -0.469 1.00 20.11 C ATOM 6 CG MET A 1 0.252 0.948 0.115 1.00 31.54 C ATOM 7 SD MET A 1 -0.047 -0.059 1.582 1.00 62.15 S ATOM 8 CE MET A 1 -1.784 0.278 1.863 1.00 71.05 C ATOM 0 H1 MET A 1 1.509 -1.394 0.985 1.00 21.32 H new ATOM 0 H2 MET A 1 2.197 -2.550 -0.051 1.00 21.32 H new ATOM 0 H3 MET A 1 3.163 -1.320 0.611 1.00 21.32 H new ATOM 0 HA MET A 1 1.026 -1.083 -1.411 1.00 12.35 H new ATOM 0 HB2 MET A 1 2.384 1.033 0.277 1.00 20.11 H new ATOM 0 HB3 MET A 1 1.770 1.421 -1.318 1.00 20.11 H new ATOM 0 HG2 MET A 1 0.118 1.999 0.369 1.00 31.54 H new ATOM 0 HG3 MET A 1 -0.493 0.706 -0.643 1.00 31.54 H new ATOM 0 HE1 MET A 1 -2.124 -0.273 2.740 1.00 71.05 H new ATOM 0 HE2 MET A 1 -1.925 1.346 2.028 1.00 71.05 H new ATOM 0 HE3 MET A 1 -2.361 -0.034 0.992 1.00 71.05 H new ATOM 20 N ALA A 2 4.282 -0.517 -1.445 1.00 11.11 N ATOM 21 CA ALA A 2 5.453 -0.503 -2.311 1.00 60.42 C ATOM 22 C ALA A 2 5.758 -1.902 -2.825 1.00 1.42 C ATOM 23 O ALA A 2 6.367 -2.715 -2.130 1.00 1.41 O ATOM 24 CB ALA A 2 6.656 0.070 -1.577 1.00 5.00 C ATOM 0 H ALA A 2 4.487 -0.374 -0.456 1.00 11.11 H new ATOM 0 HA ALA A 2 5.236 0.137 -3.167 1.00 60.42 H new ATOM 0 HB1 ALA A 2 7.520 0.072 -2.241 1.00 5.00 H new ATOM 0 HB2 ALA A 2 6.438 1.091 -1.262 1.00 5.00 H new ATOM 0 HB3 ALA A 2 6.873 -0.541 -0.701 1.00 5.00 H new ATOM 30 N SER A 3 5.299 -2.190 -4.028 1.00 13.32 N ATOM 31 CA SER A 3 5.522 -3.483 -4.648 1.00 52.24 C ATOM 32 C SER A 3 5.456 -3.349 -6.163 1.00 12.32 C ATOM 33 O SER A 3 5.088 -2.291 -6.678 1.00 74.01 O ATOM 34 CB SER A 3 4.476 -4.491 -4.157 1.00 60.55 C ATOM 35 OG SER A 3 4.543 -4.647 -2.745 1.00 31.24 O ATOM 0 H SER A 3 4.763 -1.538 -4.601 1.00 13.32 H new ATOM 0 HA SER A 3 6.512 -3.845 -4.369 1.00 52.24 H new ATOM 0 HB2 SER A 3 3.479 -4.155 -4.443 1.00 60.55 H new ATOM 0 HB3 SER A 3 4.638 -5.454 -4.641 1.00 60.55 H new ATOM 0 HG SER A 3 5.279 -4.105 -2.391 1.00 31.24 H new ATOM 41 N GLY A 4 5.829 -4.409 -6.872 1.00 52.33 N ATOM 42 CA GLY A 4 5.740 -4.399 -8.317 1.00 10.55 C ATOM 43 C GLY A 4 4.304 -4.329 -8.783 1.00 74.52 C ATOM 44 O GLY A 4 3.492 -5.200 -8.457 1.00 74.45 O ATOM 0 H GLY A 4 6.191 -5.274 -6.470 1.00 52.33 H new ATOM 0 HA2 GLY A 4 6.293 -3.546 -8.711 1.00 10.55 H new ATOM 0 HA3 GLY A 4 6.210 -5.297 -8.718 1.00 10.55 H new ATOM 48 N VAL A 5 3.989 -3.295 -9.539 1.00 33.24 N ATOM 49 CA VAL A 5 2.622 -3.041 -9.947 1.00 25.34 C ATOM 50 C VAL A 5 2.249 -3.876 -11.171 1.00 73.42 C ATOM 51 O VAL A 5 2.977 -3.909 -12.164 1.00 53.35 O ATOM 52 CB VAL A 5 2.412 -1.543 -10.245 1.00 60.33 C ATOM 53 CG1 VAL A 5 0.954 -1.244 -10.539 1.00 74.44 C ATOM 54 CG2 VAL A 5 2.907 -0.699 -9.082 1.00 33.03 C ATOM 0 H VAL A 5 4.666 -2.614 -9.884 1.00 33.24 H new ATOM 0 HA VAL A 5 1.971 -3.330 -9.122 1.00 25.34 H new ATOM 0 HB VAL A 5 2.991 -1.289 -11.133 1.00 60.33 H new ATOM 0 HG11 VAL A 5 0.835 -0.180 -10.746 1.00 74.44 H new ATOM 0 HG12 VAL A 5 0.632 -1.820 -11.406 1.00 74.44 H new ATOM 0 HG13 VAL A 5 0.346 -1.516 -9.677 1.00 74.44 H new ATOM 0 HG21 VAL A 5 2.752 0.356 -9.307 1.00 33.03 H new ATOM 0 HG22 VAL A 5 2.355 -0.963 -8.180 1.00 33.03 H new ATOM 0 HG23 VAL A 5 3.969 -0.884 -8.924 1.00 33.03 H new ATOM 64 N THR A 6 1.113 -4.550 -11.082 1.00 45.43 N ATOM 65 CA THR A 6 0.626 -5.400 -12.156 1.00 62.15 C ATOM 66 C THR A 6 -0.431 -4.657 -12.975 1.00 22.02 C ATOM 67 O THR A 6 -1.153 -3.827 -12.441 1.00 32.45 O ATOM 68 CB THR A 6 0.015 -6.688 -11.574 1.00 22.54 C ATOM 69 OG1 THR A 6 0.967 -7.339 -10.720 1.00 34.43 O ATOM 70 CG2 THR A 6 -0.418 -7.632 -12.682 1.00 32.12 C ATOM 0 H THR A 6 0.504 -4.523 -10.264 1.00 45.43 H new ATOM 0 HA THR A 6 1.464 -5.660 -12.803 1.00 62.15 H new ATOM 0 HB THR A 6 -0.866 -6.417 -10.992 1.00 22.54 H new ATOM 0 HG1 THR A 6 0.571 -8.156 -10.352 1.00 34.43 H new ATOM 0 HG21 THR A 6 -0.846 -8.534 -12.245 1.00 32.12 H new ATOM 0 HG22 THR A 6 -1.165 -7.142 -13.307 1.00 32.12 H new ATOM 0 HG23 THR A 6 0.446 -7.899 -13.291 1.00 32.12 H new ATOM 78 N VAL A 7 -0.510 -4.941 -14.266 1.00 21.03 N ATOM 79 CA VAL A 7 -1.451 -4.253 -15.137 1.00 20.21 C ATOM 80 C VAL A 7 -2.689 -5.113 -15.402 1.00 61.43 C ATOM 81 O VAL A 7 -2.575 -6.299 -15.713 1.00 4.14 O ATOM 82 CB VAL A 7 -0.793 -3.892 -16.484 1.00 53.34 C ATOM 83 CG1 VAL A 7 -1.664 -2.924 -17.270 1.00 33.12 C ATOM 84 CG2 VAL A 7 0.597 -3.315 -16.267 1.00 63.32 C ATOM 0 H VAL A 7 0.065 -5.642 -14.733 1.00 21.03 H new ATOM 0 HA VAL A 7 -1.753 -3.339 -14.625 1.00 20.21 H new ATOM 0 HB VAL A 7 -0.693 -4.807 -17.068 1.00 53.34 H new ATOM 0 HG11 VAL A 7 -1.179 -2.684 -18.216 1.00 33.12 H new ATOM 0 HG12 VAL A 7 -2.633 -3.383 -17.465 1.00 33.12 H new ATOM 0 HG13 VAL A 7 -1.805 -2.010 -16.693 1.00 33.12 H new ATOM 0 HG21 VAL A 7 1.043 -3.067 -17.230 1.00 63.32 H new ATOM 0 HG22 VAL A 7 0.526 -2.414 -15.658 1.00 63.32 H new ATOM 0 HG23 VAL A 7 1.220 -4.049 -15.757 1.00 63.32 H new ATOM 94 N SER A 8 -3.868 -4.516 -15.264 1.00 22.32 N ATOM 95 CA SER A 8 -5.114 -5.193 -15.603 1.00 52.05 C ATOM 96 C SER A 8 -5.397 -5.075 -17.102 1.00 13.42 C ATOM 97 O SER A 8 -4.881 -4.175 -17.770 1.00 24.33 O ATOM 98 CB SER A 8 -6.271 -4.606 -14.795 1.00 15.24 C ATOM 99 OG SER A 8 -6.084 -4.819 -13.406 1.00 70.23 O ATOM 0 H SER A 8 -3.987 -3.563 -14.919 1.00 22.32 H new ATOM 0 HA SER A 8 -5.014 -6.249 -15.354 1.00 52.05 H new ATOM 0 HB2 SER A 8 -6.352 -3.537 -14.994 1.00 15.24 H new ATOM 0 HB3 SER A 8 -7.209 -5.062 -15.113 1.00 15.24 H new ATOM 0 HG SER A 8 -5.506 -4.116 -13.042 1.00 70.23 H new ATOM 105 N ASP A 9 -6.235 -5.965 -17.621 1.00 60.45 N ATOM 106 CA ASP A 9 -6.496 -6.029 -19.058 1.00 61.31 C ATOM 107 C ASP A 9 -7.376 -4.882 -19.526 1.00 53.41 C ATOM 108 O ASP A 9 -7.430 -4.589 -20.721 1.00 31.20 O ATOM 109 CB ASP A 9 -7.131 -7.366 -19.445 1.00 45.33 C ATOM 110 CG ASP A 9 -6.110 -8.355 -19.968 1.00 31.51 C ATOM 111 OD1 ASP A 9 -5.359 -8.929 -19.156 1.00 0.12 O ATOM 112 OD2 ASP A 9 -6.055 -8.572 -21.196 1.00 74.31 O ATOM 0 H ASP A 9 -6.747 -6.654 -17.069 1.00 60.45 H new ATOM 0 HA ASP A 9 -5.531 -5.940 -19.557 1.00 61.31 H new ATOM 0 HB2 ASP A 9 -7.635 -7.792 -18.577 1.00 45.33 H new ATOM 0 HB3 ASP A 9 -7.894 -7.197 -20.205 1.00 45.33 H new ATOM 117 N VAL A 10 -8.051 -4.221 -18.588 1.00 4.33 N ATOM 118 CA VAL A 10 -8.876 -3.059 -18.920 1.00 20.44 C ATOM 119 C VAL A 10 -7.994 -1.931 -19.459 1.00 60.40 C ATOM 120 O VAL A 10 -8.460 -1.026 -20.149 1.00 10.50 O ATOM 121 CB VAL A 10 -9.691 -2.554 -17.700 1.00 60.10 C ATOM 122 CG1 VAL A 10 -10.887 -1.735 -18.164 1.00 74.51 C ATOM 123 CG2 VAL A 10 -10.146 -3.720 -16.842 1.00 23.32 C ATOM 0 H VAL A 10 -8.044 -4.467 -17.598 1.00 4.33 H new ATOM 0 HA VAL A 10 -9.588 -3.370 -19.685 1.00 20.44 H new ATOM 0 HB VAL A 10 -9.047 -1.915 -17.096 1.00 60.10 H new ATOM 0 HG11 VAL A 10 -11.449 -1.388 -17.297 1.00 74.51 H new ATOM 0 HG12 VAL A 10 -10.539 -0.876 -18.738 1.00 74.51 H new ATOM 0 HG13 VAL A 10 -11.531 -2.353 -18.790 1.00 74.51 H new ATOM 0 HG21 VAL A 10 -10.716 -3.345 -15.992 1.00 23.32 H new ATOM 0 HG22 VAL A 10 -10.774 -4.385 -17.435 1.00 23.32 H new ATOM 0 HG23 VAL A 10 -9.275 -4.268 -16.482 1.00 23.32 H new ATOM 133 N CYS A 11 -6.706 -2.006 -19.137 1.00 14.51 N ATOM 134 CA CYS A 11 -5.727 -1.048 -19.634 1.00 4.00 C ATOM 135 C CYS A 11 -5.326 -1.386 -21.062 1.00 14.05 C ATOM 136 O CYS A 11 -5.032 -0.499 -21.863 1.00 15.31 O ATOM 137 CB CYS A 11 -4.484 -1.046 -18.737 1.00 34.23 C ATOM 138 SG CYS A 11 -3.093 -0.086 -19.387 1.00 43.31 S ATOM 0 H CYS A 11 -6.315 -2.726 -18.530 1.00 14.51 H new ATOM 0 HA CYS A 11 -6.181 -0.057 -19.620 1.00 4.00 H new ATOM 0 HB2 CYS A 11 -4.757 -0.650 -17.759 1.00 34.23 H new ATOM 0 HB3 CYS A 11 -4.159 -2.075 -18.585 1.00 34.23 H new ATOM 0 HG CYS A 11 -3.147 1.126 -18.921 1.00 43.31 H new ATOM 144 N LYS A 12 -5.326 -2.674 -21.379 1.00 40.25 N ATOM 145 CA LYS A 12 -4.847 -3.142 -22.670 1.00 20.34 C ATOM 146 C LYS A 12 -5.853 -2.829 -23.766 1.00 55.21 C ATOM 147 O LYS A 12 -5.484 -2.342 -24.832 1.00 1.22 O ATOM 148 CB LYS A 12 -4.582 -4.648 -22.623 1.00 74.24 C ATOM 149 CG LYS A 12 -3.879 -5.188 -23.860 1.00 64.11 C ATOM 150 CD LYS A 12 -3.696 -6.695 -23.783 1.00 53.52 C ATOM 151 CE LYS A 12 -5.010 -7.435 -23.972 1.00 73.54 C ATOM 152 NZ LYS A 12 -5.467 -7.410 -25.387 1.00 32.43 N ATOM 0 H LYS A 12 -5.653 -3.414 -20.757 1.00 40.25 H new ATOM 0 HA LYS A 12 -3.916 -2.622 -22.895 1.00 20.34 H new ATOM 0 HB2 LYS A 12 -3.976 -4.873 -21.745 1.00 74.24 H new ATOM 0 HB3 LYS A 12 -5.531 -5.170 -22.499 1.00 74.24 H new ATOM 0 HG2 LYS A 12 -4.458 -4.936 -24.748 1.00 64.11 H new ATOM 0 HG3 LYS A 12 -2.907 -4.707 -23.966 1.00 64.11 H new ATOM 0 HD2 LYS A 12 -2.986 -7.014 -24.546 1.00 53.52 H new ATOM 0 HD3 LYS A 12 -3.266 -6.960 -22.817 1.00 53.52 H new ATOM 0 HE2 LYS A 12 -4.893 -8.469 -23.647 1.00 73.54 H new ATOM 0 HE3 LYS A 12 -5.773 -6.986 -23.337 1.00 73.54 H new ATOM 0 HZ1 LYS A 12 -6.330 -7.983 -25.483 1.00 32.43 H new ATOM 0 HZ2 LYS A 12 -5.669 -6.430 -25.669 1.00 32.43 H new ATOM 0 HZ3 LYS A 12 -4.722 -7.800 -25.999 1.00 32.43 H new ATOM 166 N THR A 13 -7.122 -3.093 -23.483 1.00 72.00 N ATOM 167 CA THR A 13 -8.186 -2.917 -24.460 1.00 32.14 C ATOM 168 C THR A 13 -8.242 -1.483 -24.982 1.00 63.33 C ATOM 169 O THR A 13 -8.297 -1.256 -26.192 1.00 61.53 O ATOM 170 CB THR A 13 -9.544 -3.306 -23.852 1.00 12.12 C ATOM 171 OG1 THR A 13 -9.642 -2.789 -22.517 1.00 31.10 O ATOM 172 CG2 THR A 13 -9.714 -4.817 -23.829 1.00 50.40 C ATOM 0 H THR A 13 -7.440 -3.433 -22.576 1.00 72.00 H new ATOM 0 HA THR A 13 -7.967 -3.574 -25.302 1.00 32.14 H new ATOM 0 HB THR A 13 -10.334 -2.879 -24.470 1.00 12.12 H new ATOM 0 HG1 THR A 13 -10.509 -3.037 -22.133 1.00 31.10 H new ATOM 0 HG21 THR A 13 -10.682 -5.068 -23.395 1.00 50.40 H new ATOM 0 HG22 THR A 13 -9.661 -5.205 -24.846 1.00 50.40 H new ATOM 0 HG23 THR A 13 -8.921 -5.263 -23.229 1.00 50.40 H new ATOM 180 N THR A 14 -8.205 -0.522 -24.067 1.00 20.32 N ATOM 181 CA THR A 14 -8.243 0.884 -24.437 1.00 24.03 C ATOM 182 C THR A 14 -6.925 1.327 -25.081 1.00 3.14 C ATOM 183 O THR A 14 -6.924 2.118 -26.029 1.00 3.12 O ATOM 184 CB THR A 14 -8.554 1.766 -23.214 1.00 33.23 C ATOM 185 OG1 THR A 14 -9.800 1.361 -22.632 1.00 74.11 O ATOM 186 CG2 THR A 14 -8.632 3.236 -23.601 1.00 63.13 C ATOM 0 H THR A 14 -8.149 -0.693 -23.063 1.00 20.32 H new ATOM 0 HA THR A 14 -9.041 1.006 -25.170 1.00 24.03 H new ATOM 0 HB THR A 14 -7.747 1.642 -22.492 1.00 33.23 H new ATOM 0 HG1 THR A 14 -9.684 1.231 -21.668 1.00 74.11 H new ATOM 0 HG21 THR A 14 -8.853 3.834 -22.717 1.00 63.13 H new ATOM 0 HG22 THR A 14 -7.678 3.552 -24.024 1.00 63.13 H new ATOM 0 HG23 THR A 14 -9.421 3.376 -24.340 1.00 63.13 H new ATOM 194 N TYR A 15 -5.805 0.806 -24.581 1.00 32.23 N ATOM 195 CA TYR A 15 -4.498 1.145 -25.136 1.00 3.04 C ATOM 196 C TYR A 15 -4.400 0.683 -26.588 1.00 71.22 C ATOM 197 O TYR A 15 -3.841 1.384 -27.427 1.00 43.11 O ATOM 198 CB TYR A 15 -3.368 0.535 -24.295 1.00 24.02 C ATOM 199 CG TYR A 15 -1.980 0.753 -24.868 1.00 11.33 C ATOM 200 CD1 TYR A 15 -1.329 1.982 -24.758 1.00 33.23 C ATOM 201 CD2 TYR A 15 -1.322 -0.275 -25.529 1.00 12.11 C ATOM 202 CE1 TYR A 15 -0.066 2.171 -25.290 1.00 3.20 C ATOM 203 CE2 TYR A 15 -0.062 -0.092 -26.063 1.00 32.03 C ATOM 204 CZ TYR A 15 0.563 1.132 -25.941 1.00 53.01 C ATOM 205 OH TYR A 15 1.820 1.316 -26.482 1.00 52.41 O ATOM 0 H TYR A 15 -5.777 0.152 -23.798 1.00 32.23 H new ATOM 0 HA TYR A 15 -4.388 2.229 -25.109 1.00 3.04 H new ATOM 0 HB2 TYR A 15 -3.406 0.961 -23.292 1.00 24.02 H new ATOM 0 HB3 TYR A 15 -3.543 -0.536 -24.194 1.00 24.02 H new ATOM 0 HD1 TYR A 15 -1.819 2.799 -24.249 1.00 33.23 H new ATOM 0 HD2 TYR A 15 -1.805 -1.236 -25.627 1.00 12.11 H new ATOM 0 HE1 TYR A 15 0.425 3.128 -25.196 1.00 3.20 H new ATOM 0 HE2 TYR A 15 0.433 -0.904 -26.575 1.00 32.03 H new ATOM 0 HH TYR A 15 2.243 2.098 -26.069 1.00 52.41 H new ATOM 215 N GLU A 16 -4.960 -0.486 -26.883 1.00 13.14 N ATOM 216 CA GLU A 16 -4.987 -0.994 -28.249 1.00 20.10 C ATOM 217 C GLU A 16 -5.742 -0.034 -29.163 1.00 21.44 C ATOM 218 O GLU A 16 -5.304 0.248 -30.280 1.00 44.05 O ATOM 219 CB GLU A 16 -5.631 -2.382 -28.298 1.00 2.13 C ATOM 220 CG GLU A 16 -4.814 -3.461 -27.603 1.00 4.10 C ATOM 221 CD GLU A 16 -5.488 -4.817 -27.641 1.00 45.13 C ATOM 222 OE1 GLU A 16 -5.377 -5.512 -28.672 1.00 62.54 O ATOM 223 OE2 GLU A 16 -6.129 -5.197 -26.637 1.00 24.20 O ATOM 0 H GLU A 16 -5.400 -1.098 -26.196 1.00 13.14 H new ATOM 0 HA GLU A 16 -3.958 -1.076 -28.600 1.00 20.10 H new ATOM 0 HB2 GLU A 16 -6.617 -2.332 -27.836 1.00 2.13 H new ATOM 0 HB3 GLU A 16 -5.781 -2.667 -29.339 1.00 2.13 H new ATOM 0 HG2 GLU A 16 -3.835 -3.532 -28.077 1.00 4.10 H new ATOM 0 HG3 GLU A 16 -4.645 -3.172 -26.566 1.00 4.10 H new ATOM 230 N GLU A 17 -6.867 0.481 -28.675 1.00 72.22 N ATOM 231 CA GLU A 17 -7.672 1.421 -29.446 1.00 52.11 C ATOM 232 C GLU A 17 -6.899 2.705 -29.716 1.00 15.01 C ATOM 233 O GLU A 17 -6.798 3.147 -30.854 1.00 3.24 O ATOM 234 CB GLU A 17 -8.963 1.775 -28.711 1.00 20.42 C ATOM 235 CG GLU A 17 -9.856 0.586 -28.413 1.00 31.13 C ATOM 236 CD GLU A 17 -11.080 0.981 -27.617 1.00 43.31 C ATOM 237 OE1 GLU A 17 -10.923 1.370 -26.442 1.00 12.32 O ATOM 238 OE2 GLU A 17 -12.203 0.906 -28.160 1.00 40.50 O ATOM 0 H GLU A 17 -7.241 0.263 -27.751 1.00 72.22 H new ATOM 0 HA GLU A 17 -7.915 0.933 -30.390 1.00 52.11 H new ATOM 0 HB2 GLU A 17 -8.710 2.269 -27.773 1.00 20.42 H new ATOM 0 HB3 GLU A 17 -9.523 2.494 -29.309 1.00 20.42 H new ATOM 0 HG2 GLU A 17 -10.167 0.122 -29.349 1.00 31.13 H new ATOM 0 HG3 GLU A 17 -9.290 -0.163 -27.859 1.00 31.13 H new ATOM 245 N ILE A 18 -6.347 3.294 -28.664 1.00 21.23 N ATOM 246 CA ILE A 18 -5.701 4.596 -28.775 1.00 64.03 C ATOM 247 C ILE A 18 -4.368 4.500 -29.525 1.00 12.30 C ATOM 248 O ILE A 18 -3.942 5.458 -30.165 1.00 11.40 O ATOM 249 CB ILE A 18 -5.507 5.253 -27.385 1.00 14.05 C ATOM 250 CG1 ILE A 18 -5.015 6.695 -27.533 1.00 11.04 C ATOM 251 CG2 ILE A 18 -4.547 4.443 -26.526 1.00 14.51 C ATOM 252 CD1 ILE A 18 -4.945 7.448 -26.222 1.00 74.22 C ATOM 0 H ILE A 18 -6.333 2.893 -27.726 1.00 21.23 H new ATOM 0 HA ILE A 18 -6.365 5.236 -29.357 1.00 64.03 H new ATOM 0 HB ILE A 18 -6.474 5.270 -26.883 1.00 14.05 H new ATOM 0 HG12 ILE A 18 -4.026 6.688 -27.992 1.00 11.04 H new ATOM 0 HG13 ILE A 18 -5.678 7.228 -28.214 1.00 11.04 H new ATOM 0 HG21 ILE A 18 -4.429 4.927 -25.556 1.00 14.51 H new ATOM 0 HG22 ILE A 18 -4.945 3.438 -26.384 1.00 14.51 H new ATOM 0 HG23 ILE A 18 -3.578 4.383 -27.021 1.00 14.51 H new ATOM 0 HD11 ILE A 18 -4.589 8.462 -26.403 1.00 74.22 H new ATOM 0 HD12 ILE A 18 -5.937 7.487 -25.771 1.00 74.22 H new ATOM 0 HD13 ILE A 18 -4.259 6.938 -25.546 1.00 74.22 H new ATOM 264 N LYS A 19 -3.728 3.337 -29.473 1.00 23.24 N ATOM 265 CA LYS A 19 -2.483 3.123 -30.191 1.00 13.14 C ATOM 266 C LYS A 19 -2.735 3.038 -31.700 1.00 34.45 C ATOM 267 O LYS A 19 -1.929 3.510 -32.505 1.00 62.20 O ATOM 268 CB LYS A 19 -1.819 1.840 -29.686 1.00 25.34 C ATOM 269 CG LYS A 19 -0.430 1.604 -30.241 1.00 0.05 C ATOM 270 CD LYS A 19 0.146 0.288 -29.749 1.00 73.12 C ATOM 271 CE LYS A 19 1.537 0.070 -30.305 1.00 0.52 C ATOM 272 NZ LYS A 19 2.093 -1.261 -29.941 1.00 74.15 N ATOM 0 H LYS A 19 -4.053 2.530 -28.941 1.00 23.24 H new ATOM 0 HA LYS A 19 -1.818 3.968 -30.009 1.00 13.14 H new ATOM 0 HB2 LYS A 19 -1.763 1.877 -28.598 1.00 25.34 H new ATOM 0 HB3 LYS A 19 -2.451 0.990 -29.944 1.00 25.34 H new ATOM 0 HG2 LYS A 19 -0.467 1.602 -31.330 1.00 0.05 H new ATOM 0 HG3 LYS A 19 0.226 2.423 -29.946 1.00 0.05 H new ATOM 0 HD2 LYS A 19 0.180 0.285 -28.660 1.00 73.12 H new ATOM 0 HD3 LYS A 19 -0.504 -0.534 -30.050 1.00 73.12 H new ATOM 0 HE2 LYS A 19 1.510 0.164 -31.391 1.00 0.52 H new ATOM 0 HE3 LYS A 19 2.200 0.851 -29.933 1.00 0.52 H new ATOM 0 HZ1 LYS A 19 3.046 -1.361 -30.345 1.00 74.15 H new ATOM 0 HZ2 LYS A 19 2.145 -1.344 -28.906 1.00 74.15 H new ATOM 0 HZ3 LYS A 19 1.477 -2.009 -30.318 1.00 74.15 H new ATOM 286 N LYS A 20 -3.859 2.437 -32.077 1.00 54.42 N ATOM 287 CA LYS A 20 -4.177 2.231 -33.486 1.00 64.23 C ATOM 288 C LYS A 20 -5.107 3.313 -34.043 1.00 12.53 C ATOM 289 O LYS A 20 -4.751 4.012 -34.993 1.00 31.32 O ATOM 290 CB LYS A 20 -4.783 0.838 -33.690 1.00 23.14 C ATOM 291 CG LYS A 20 -3.774 -0.288 -33.491 1.00 63.13 C ATOM 292 CD LYS A 20 -4.404 -1.665 -33.657 1.00 52.31 C ATOM 293 CE LYS A 20 -5.370 -1.983 -32.527 1.00 52.51 C ATOM 294 NZ LYS A 20 -5.964 -3.339 -32.667 1.00 11.22 N ATOM 0 H LYS A 20 -4.563 2.085 -31.429 1.00 54.42 H new ATOM 0 HA LYS A 20 -3.243 2.304 -34.044 1.00 64.23 H new ATOM 0 HB2 LYS A 20 -5.611 0.703 -32.994 1.00 23.14 H new ATOM 0 HB3 LYS A 20 -5.198 0.773 -34.696 1.00 23.14 H new ATOM 0 HG2 LYS A 20 -2.960 -0.174 -34.207 1.00 63.13 H new ATOM 0 HG3 LYS A 20 -3.336 -0.209 -32.496 1.00 63.13 H new ATOM 0 HD2 LYS A 20 -4.931 -1.711 -34.610 1.00 52.31 H new ATOM 0 HD3 LYS A 20 -3.620 -2.422 -33.689 1.00 52.31 H new ATOM 0 HE2 LYS A 20 -4.848 -1.913 -31.573 1.00 52.51 H new ATOM 0 HE3 LYS A 20 -6.166 -1.238 -32.510 1.00 52.51 H new ATOM 0 HZ1 LYS A 20 -6.616 -3.516 -31.876 1.00 11.22 H new ATOM 0 HZ2 LYS A 20 -6.484 -3.399 -33.565 1.00 11.22 H new ATOM 0 HZ3 LYS A 20 -5.207 -4.052 -32.657 1.00 11.22 H new ATOM 308 N ASP A 21 -6.285 3.468 -33.445 1.00 60.45 N ATOM 309 CA ASP A 21 -7.296 4.378 -33.988 1.00 24.24 C ATOM 310 C ASP A 21 -7.354 5.692 -33.206 1.00 53.25 C ATOM 311 O ASP A 21 -7.916 6.671 -33.683 1.00 24.51 O ATOM 312 CB ASP A 21 -8.673 3.699 -33.997 1.00 75.22 C ATOM 313 CG ASP A 21 -9.743 4.536 -34.677 1.00 70.45 C ATOM 314 OD1 ASP A 21 -9.523 4.980 -35.828 1.00 71.44 O ATOM 315 OD2 ASP A 21 -10.815 4.745 -34.075 1.00 15.41 O ATOM 0 H ASP A 21 -6.564 2.982 -32.593 1.00 60.45 H new ATOM 0 HA ASP A 21 -7.010 4.618 -35.012 1.00 24.24 H new ATOM 0 HB2 ASP A 21 -8.595 2.738 -34.504 1.00 75.22 H new ATOM 0 HB3 ASP A 21 -8.978 3.494 -32.971 1.00 75.22 H new ATOM 320 N LYS A 22 -6.773 5.684 -32.000 1.00 52.53 N ATOM 321 CA LYS A 22 -6.676 6.863 -31.107 1.00 32.22 C ATOM 322 C LYS A 22 -8.015 7.578 -30.898 1.00 14.24 C ATOM 323 O LYS A 22 -8.046 8.752 -30.533 1.00 24.33 O ATOM 324 CB LYS A 22 -5.624 7.881 -31.599 1.00 2.51 C ATOM 325 CG LYS A 22 -5.999 8.635 -32.871 1.00 24.10 C ATOM 326 CD LYS A 22 -5.486 10.065 -32.845 1.00 42.42 C ATOM 327 CE LYS A 22 -6.472 10.987 -32.149 1.00 22.24 C ATOM 328 NZ LYS A 22 -5.881 12.318 -31.876 1.00 73.24 N ATOM 0 H LYS A 22 -6.347 4.847 -31.603 1.00 52.53 H new ATOM 0 HA LYS A 22 -6.360 6.458 -30.146 1.00 32.22 H new ATOM 0 HB2 LYS A 22 -5.444 8.606 -30.805 1.00 2.51 H new ATOM 0 HB3 LYS A 22 -4.685 7.355 -31.770 1.00 2.51 H new ATOM 0 HG2 LYS A 22 -5.588 8.116 -33.737 1.00 24.10 H new ATOM 0 HG3 LYS A 22 -7.083 8.639 -32.986 1.00 24.10 H new ATOM 0 HD2 LYS A 22 -4.525 10.101 -32.331 1.00 42.42 H new ATOM 0 HD3 LYS A 22 -5.316 10.412 -33.864 1.00 42.42 H new ATOM 0 HE2 LYS A 22 -7.361 11.104 -32.769 1.00 22.24 H new ATOM 0 HE3 LYS A 22 -6.795 10.533 -31.212 1.00 22.24 H new ATOM 0 HZ1 LYS A 22 -6.629 13.040 -31.891 1.00 73.24 H new ATOM 0 HZ2 LYS A 22 -5.426 12.311 -30.941 1.00 73.24 H new ATOM 0 HZ3 LYS A 22 -5.172 12.539 -32.604 1.00 73.24 H new ATOM 342 N LYS A 23 -9.120 6.877 -31.086 1.00 62.34 N ATOM 343 CA LYS A 23 -10.418 7.524 -30.990 1.00 73.41 C ATOM 344 C LYS A 23 -10.902 7.583 -29.547 1.00 21.51 C ATOM 345 O LYS A 23 -11.781 8.379 -29.213 1.00 75.13 O ATOM 346 CB LYS A 23 -11.436 6.825 -31.886 1.00 14.33 C ATOM 347 CG LYS A 23 -12.265 7.798 -32.712 1.00 12.43 C ATOM 348 CD LYS A 23 -11.380 8.757 -33.507 1.00 60.23 C ATOM 349 CE LYS A 23 -10.452 8.021 -34.461 1.00 22.45 C ATOM 350 NZ LYS A 23 -11.193 7.259 -35.497 1.00 24.44 N ATOM 0 H LYS A 23 -9.147 5.880 -31.302 1.00 62.34 H new ATOM 0 HA LYS A 23 -10.309 8.551 -31.339 1.00 73.41 H new ATOM 0 HB2 LYS A 23 -10.914 6.141 -32.555 1.00 14.33 H new ATOM 0 HB3 LYS A 23 -12.102 6.221 -31.269 1.00 14.33 H new ATOM 0 HG2 LYS A 23 -12.906 7.241 -33.396 1.00 12.43 H new ATOM 0 HG3 LYS A 23 -12.921 8.368 -32.054 1.00 12.43 H new ATOM 0 HD2 LYS A 23 -12.008 9.445 -34.072 1.00 60.23 H new ATOM 0 HD3 LYS A 23 -10.788 9.359 -32.818 1.00 60.23 H new ATOM 0 HE2 LYS A 23 -9.790 8.739 -34.946 1.00 22.45 H new ATOM 0 HE3 LYS A 23 -9.820 7.338 -33.894 1.00 22.45 H new ATOM 0 HZ1 LYS A 23 -10.543 6.607 -35.980 1.00 24.44 H new ATOM 0 HZ2 LYS A 23 -11.958 6.716 -35.048 1.00 24.44 H new ATOM 0 HZ3 LYS A 23 -11.599 7.920 -36.190 1.00 24.44 H new ATOM 364 N HIS A 24 -10.326 6.751 -28.688 1.00 23.11 N ATOM 365 CA HIS A 24 -10.582 6.860 -27.258 1.00 51.51 C ATOM 366 C HIS A 24 -9.829 8.057 -26.707 1.00 13.15 C ATOM 367 O HIS A 24 -8.603 8.088 -26.729 1.00 40.10 O ATOM 368 CB HIS A 24 -10.192 5.581 -26.512 1.00 40.51 C ATOM 369 CG HIS A 24 -11.366 4.697 -26.217 1.00 13.11 C ATOM 370 ND1 HIS A 24 -11.605 4.148 -24.976 1.00 72.22 N ATOM 371 CD2 HIS A 24 -12.371 4.267 -27.015 1.00 70.52 C ATOM 372 CE1 HIS A 24 -12.711 3.428 -25.024 1.00 42.21 C ATOM 373 NE2 HIS A 24 -13.196 3.482 -26.250 1.00 2.13 N ATOM 0 H HIS A 24 -9.686 6.002 -28.952 1.00 23.11 H new ATOM 0 HA HIS A 24 -11.652 7.000 -27.106 1.00 51.51 H new ATOM 0 HB2 HIS A 24 -9.466 5.026 -27.107 1.00 40.51 H new ATOM 0 HB3 HIS A 24 -9.700 5.848 -25.577 1.00 40.51 H new ATOM 0 HD2 HIS A 24 -12.500 4.499 -28.062 1.00 70.52 H new ATOM 0 HE1 HIS A 24 -13.146 2.885 -24.198 1.00 42.21 H new ATOM 0 HE2 HIS A 24 -14.044 3.017 -26.575 1.00 2.13 H new ATOM 382 N ARG A 25 -10.578 9.036 -26.222 1.00 1.01 N ATOM 383 CA ARG A 25 -10.018 10.326 -25.846 1.00 5.03 C ATOM 384 C ARG A 25 -9.097 10.199 -24.641 1.00 64.02 C ATOM 385 O ARG A 25 -8.016 10.786 -24.608 1.00 44.31 O ATOM 386 CB ARG A 25 -11.143 11.314 -25.541 1.00 42.21 C ATOM 387 CG ARG A 25 -10.751 12.764 -25.760 1.00 35.21 C ATOM 388 CD ARG A 25 -10.358 13.006 -27.208 1.00 22.05 C ATOM 389 NE ARG A 25 -10.048 14.410 -27.477 1.00 45.35 N ATOM 390 CZ ARG A 25 -9.529 14.844 -28.625 1.00 5.02 C ATOM 391 NH1 ARG A 25 -9.241 13.989 -29.598 1.00 74.52 N ATOM 392 NH2 ARG A 25 -9.279 16.133 -28.804 1.00 22.34 N ATOM 0 H ARG A 25 -11.585 8.960 -26.079 1.00 1.01 H new ATOM 0 HA ARG A 25 -9.428 10.696 -26.685 1.00 5.03 H new ATOM 0 HB2 ARG A 25 -12.002 11.079 -26.169 1.00 42.21 H new ATOM 0 HB3 ARG A 25 -11.460 11.184 -24.506 1.00 42.21 H new ATOM 0 HG2 ARG A 25 -11.583 13.415 -25.491 1.00 35.21 H new ATOM 0 HG3 ARG A 25 -9.919 13.023 -25.105 1.00 35.21 H new ATOM 0 HD2 ARG A 25 -9.491 12.392 -27.453 1.00 22.05 H new ATOM 0 HD3 ARG A 25 -11.170 12.685 -27.860 1.00 22.05 H new ATOM 0 HE ARG A 25 -10.240 15.095 -26.746 1.00 45.35 H new ATOM 0 HH11 ARG A 25 -9.417 12.992 -29.470 1.00 74.52 H new ATOM 0 HH12 ARG A 25 -8.844 14.328 -30.474 1.00 74.52 H new ATOM 0 HH21 ARG A 25 -9.484 16.800 -28.060 1.00 22.34 H new ATOM 0 HH22 ARG A 25 -8.882 16.458 -29.685 1.00 22.34 H new ATOM 406 N TYR A 26 -9.528 9.429 -23.654 1.00 33.34 N ATOM 407 CA TYR A 26 -8.746 9.257 -22.445 1.00 24.41 C ATOM 408 C TYR A 26 -9.090 7.943 -21.759 1.00 5.41 C ATOM 409 O TYR A 26 -10.137 7.341 -22.021 1.00 41.15 O ATOM 410 CB TYR A 26 -8.973 10.428 -21.481 1.00 31.34 C ATOM 411 CG TYR A 26 -10.288 10.381 -20.731 1.00 42.01 C ATOM 412 CD1 TYR A 26 -11.500 10.277 -21.400 1.00 34.13 C ATOM 413 CD2 TYR A 26 -10.310 10.441 -19.345 1.00 23.11 C ATOM 414 CE1 TYR A 26 -12.694 10.231 -20.709 1.00 2.41 C ATOM 415 CE2 TYR A 26 -11.500 10.397 -18.648 1.00 71.15 C ATOM 416 CZ TYR A 26 -12.688 10.291 -19.332 1.00 13.22 C ATOM 417 OH TYR A 26 -13.875 10.249 -18.635 1.00 12.04 O ATOM 0 H TYR A 26 -10.410 8.917 -23.668 1.00 33.34 H new ATOM 0 HA TYR A 26 -7.694 9.236 -22.728 1.00 24.41 H new ATOM 0 HB2 TYR A 26 -8.158 10.449 -20.758 1.00 31.34 H new ATOM 0 HB3 TYR A 26 -8.924 11.360 -22.044 1.00 31.34 H new ATOM 0 HD1 TYR A 26 -11.509 10.231 -22.479 1.00 34.13 H new ATOM 0 HD2 TYR A 26 -9.380 10.524 -18.802 1.00 23.11 H new ATOM 0 HE1 TYR A 26 -13.628 10.148 -21.245 1.00 2.41 H new ATOM 0 HE2 TYR A 26 -11.498 10.446 -17.569 1.00 71.15 H new ATOM 0 HH TYR A 26 -14.455 10.982 -18.931 1.00 12.04 H new ATOM 427 N VAL A 27 -8.200 7.510 -20.889 1.00 5.42 N ATOM 428 CA VAL A 27 -8.401 6.308 -20.108 1.00 10.34 C ATOM 429 C VAL A 27 -7.954 6.550 -18.667 1.00 20.43 C ATOM 430 O VAL A 27 -6.795 6.874 -18.414 1.00 62.34 O ATOM 431 CB VAL A 27 -7.648 5.105 -20.727 1.00 31.15 C ATOM 432 CG1 VAL A 27 -6.212 5.474 -21.071 1.00 4.23 C ATOM 433 CG2 VAL A 27 -7.700 3.898 -19.797 1.00 53.54 C ATOM 0 H VAL A 27 -7.316 7.983 -20.704 1.00 5.42 H new ATOM 0 HA VAL A 27 -9.463 6.063 -20.112 1.00 10.34 H new ATOM 0 HB VAL A 27 -8.150 4.835 -21.656 1.00 31.15 H new ATOM 0 HG11 VAL A 27 -5.708 4.610 -21.504 1.00 4.23 H new ATOM 0 HG12 VAL A 27 -6.209 6.293 -21.790 1.00 4.23 H new ATOM 0 HG13 VAL A 27 -5.689 5.783 -20.166 1.00 4.23 H new ATOM 0 HG21 VAL A 27 -7.165 3.065 -20.252 1.00 53.54 H new ATOM 0 HG22 VAL A 27 -7.234 4.152 -18.845 1.00 53.54 H new ATOM 0 HG23 VAL A 27 -8.739 3.613 -19.628 1.00 53.54 H new ATOM 443 N ILE A 28 -8.895 6.438 -17.734 1.00 12.42 N ATOM 444 CA ILE A 28 -8.617 6.688 -16.326 1.00 75.12 C ATOM 445 C ILE A 28 -8.236 5.403 -15.604 1.00 32.24 C ATOM 446 O ILE A 28 -9.038 4.469 -15.499 1.00 54.35 O ATOM 447 CB ILE A 28 -9.829 7.339 -15.614 1.00 4.11 C ATOM 448 CG1 ILE A 28 -10.068 8.751 -16.151 1.00 41.41 C ATOM 449 CG2 ILE A 28 -9.622 7.372 -14.107 1.00 23.30 C ATOM 450 CD1 ILE A 28 -8.889 9.685 -15.965 1.00 42.41 C ATOM 0 H ILE A 28 -9.861 6.174 -17.931 1.00 12.42 H new ATOM 0 HA ILE A 28 -7.776 7.381 -16.288 1.00 75.12 H new ATOM 0 HB ILE A 28 -10.710 6.732 -15.822 1.00 4.11 H new ATOM 0 HG12 ILE A 28 -10.307 8.690 -17.213 1.00 41.41 H new ATOM 0 HG13 ILE A 28 -10.939 9.177 -15.652 1.00 41.41 H new ATOM 0 HG21 ILE A 28 -10.487 7.834 -13.631 1.00 23.30 H new ATOM 0 HG22 ILE A 28 -9.502 6.355 -13.734 1.00 23.30 H new ATOM 0 HG23 ILE A 28 -8.728 7.951 -13.875 1.00 23.30 H new ATOM 0 HD11 ILE A 28 -9.135 10.666 -16.371 1.00 42.41 H new ATOM 0 HD12 ILE A 28 -8.662 9.778 -14.903 1.00 42.41 H new ATOM 0 HD13 ILE A 28 -8.021 9.284 -16.488 1.00 42.41 H new ATOM 462 N PHE A 29 -7.008 5.365 -15.117 1.00 10.42 N ATOM 463 CA PHE A 29 -6.514 4.226 -14.370 1.00 54.45 C ATOM 464 C PHE A 29 -6.588 4.509 -12.874 1.00 51.41 C ATOM 465 O PHE A 29 -6.256 5.608 -12.423 1.00 64.41 O ATOM 466 CB PHE A 29 -5.059 3.928 -14.732 1.00 71.02 C ATOM 467 CG PHE A 29 -4.753 3.858 -16.204 1.00 43.44 C ATOM 468 CD1 PHE A 29 -4.885 2.671 -16.899 1.00 2.13 C ATOM 469 CD2 PHE A 29 -4.306 4.979 -16.886 1.00 70.43 C ATOM 470 CE1 PHE A 29 -4.580 2.603 -18.245 1.00 44.51 C ATOM 471 CE2 PHE A 29 -4.003 4.917 -18.231 1.00 73.03 C ATOM 472 CZ PHE A 29 -4.140 3.726 -18.911 1.00 71.35 C ATOM 0 H PHE A 29 -6.330 6.119 -15.228 1.00 10.42 H new ATOM 0 HA PHE A 29 -7.136 3.367 -14.623 1.00 54.45 H new ATOM 0 HB2 PHE A 29 -4.428 4.696 -14.285 1.00 71.02 H new ATOM 0 HB3 PHE A 29 -4.778 2.979 -14.276 1.00 71.02 H new ATOM 0 HD1 PHE A 29 -5.230 1.787 -16.384 1.00 2.13 H new ATOM 0 HD2 PHE A 29 -4.193 5.914 -16.357 1.00 70.43 H new ATOM 0 HE1 PHE A 29 -4.687 1.668 -18.776 1.00 44.51 H new ATOM 0 HE2 PHE A 29 -3.659 5.800 -18.750 1.00 73.03 H new ATOM 0 HZ PHE A 29 -3.903 3.673 -19.963 1.00 71.35 H new ATOM 482 N TYR A 30 -7.014 3.519 -12.113 1.00 51.30 N ATOM 483 CA TYR A 30 -7.030 3.614 -10.662 1.00 32.14 C ATOM 484 C TYR A 30 -6.060 2.585 -10.097 1.00 12.55 C ATOM 485 O TYR A 30 -5.542 1.744 -10.836 1.00 62.45 O ATOM 486 CB TYR A 30 -8.450 3.384 -10.119 1.00 3.15 C ATOM 487 CG TYR A 30 -8.599 3.644 -8.630 1.00 72.55 C ATOM 488 CD1 TYR A 30 -8.595 4.938 -8.131 1.00 74.13 C ATOM 489 CD2 TYR A 30 -8.733 2.596 -7.726 1.00 32.01 C ATOM 490 CE1 TYR A 30 -8.721 5.185 -6.776 1.00 53.32 C ATOM 491 CE2 TYR A 30 -8.858 2.834 -6.367 1.00 43.04 C ATOM 492 CZ TYR A 30 -8.851 4.131 -5.898 1.00 70.13 C ATOM 493 OH TYR A 30 -8.977 4.379 -4.548 1.00 4.31 O ATOM 0 H TYR A 30 -7.357 2.631 -12.478 1.00 51.30 H new ATOM 0 HA TYR A 30 -6.721 4.613 -10.355 1.00 32.14 H new ATOM 0 HB2 TYR A 30 -9.142 4.029 -10.660 1.00 3.15 H new ATOM 0 HB3 TYR A 30 -8.744 2.355 -10.328 1.00 3.15 H new ATOM 0 HD1 TYR A 30 -8.492 5.769 -8.813 1.00 74.13 H new ATOM 0 HD2 TYR A 30 -8.740 1.579 -8.090 1.00 32.01 H new ATOM 0 HE1 TYR A 30 -8.718 6.200 -6.407 1.00 53.32 H new ATOM 0 HE2 TYR A 30 -8.960 2.008 -5.678 1.00 43.04 H new ATOM 0 HH TYR A 30 -9.060 3.530 -4.066 1.00 4.31 H new ATOM 503 N ILE A 31 -5.795 2.653 -8.806 1.00 41.41 N ATOM 504 CA ILE A 31 -4.898 1.707 -8.178 1.00 24.30 C ATOM 505 C ILE A 31 -5.698 0.545 -7.567 1.00 4.34 C ATOM 506 O ILE A 31 -6.288 0.646 -6.491 1.00 73.23 O ATOM 507 CB ILE A 31 -3.990 2.422 -7.142 1.00 4.31 C ATOM 508 CG1 ILE A 31 -2.917 1.480 -6.588 1.00 1.24 C ATOM 509 CG2 ILE A 31 -4.803 3.042 -6.012 1.00 73.31 C ATOM 510 CD1 ILE A 31 -2.048 0.860 -7.654 1.00 51.15 C ATOM 0 H ILE A 31 -6.188 3.352 -8.175 1.00 41.41 H new ATOM 0 HA ILE A 31 -4.236 1.279 -8.931 1.00 24.30 H new ATOM 0 HB ILE A 31 -3.484 3.231 -7.669 1.00 4.31 H new ATOM 0 HG12 ILE A 31 -2.285 2.032 -5.892 1.00 1.24 H new ATOM 0 HG13 ILE A 31 -3.401 0.686 -6.019 1.00 1.24 H new ATOM 0 HG21 ILE A 31 -4.132 3.533 -5.308 1.00 73.31 H new ATOM 0 HG22 ILE A 31 -5.497 3.775 -6.423 1.00 73.31 H new ATOM 0 HG23 ILE A 31 -5.363 2.262 -5.496 1.00 73.31 H new ATOM 0 HD11 ILE A 31 -1.312 0.205 -7.188 1.00 51.15 H new ATOM 0 HD12 ILE A 31 -2.668 0.280 -8.337 1.00 51.15 H new ATOM 0 HD13 ILE A 31 -1.535 1.646 -8.208 1.00 51.15 H new ATOM 522 N ARG A 32 -5.710 -0.557 -8.295 1.00 53.34 N ATOM 523 CA ARG A 32 -6.511 -1.724 -7.962 1.00 12.03 C ATOM 524 C ARG A 32 -5.916 -2.455 -6.774 1.00 35.32 C ATOM 525 O ARG A 32 -4.727 -2.801 -6.780 1.00 53.41 O ATOM 526 CB ARG A 32 -6.567 -2.653 -9.169 1.00 45.22 C ATOM 527 CG ARG A 32 -7.534 -3.809 -9.026 1.00 44.31 C ATOM 528 CD ARG A 32 -7.518 -4.674 -10.271 1.00 53.23 C ATOM 529 NE ARG A 32 -8.459 -5.786 -10.180 1.00 34.34 N ATOM 530 CZ ARG A 32 -8.535 -6.765 -11.078 1.00 20.30 C ATOM 531 NH1 ARG A 32 -7.711 -6.780 -12.121 1.00 54.10 N ATOM 532 NH2 ARG A 32 -9.434 -7.732 -10.937 1.00 65.02 N ATOM 0 H ARG A 32 -5.157 -0.669 -9.145 1.00 53.34 H new ATOM 0 HA ARG A 32 -7.519 -1.403 -7.698 1.00 12.03 H new ATOM 0 HB2 ARG A 32 -6.844 -2.070 -10.048 1.00 45.22 H new ATOM 0 HB3 ARG A 32 -5.569 -3.051 -9.352 1.00 45.22 H new ATOM 0 HG2 ARG A 32 -7.266 -4.409 -8.156 1.00 44.31 H new ATOM 0 HG3 ARG A 32 -8.541 -3.429 -8.853 1.00 44.31 H new ATOM 0 HD2 ARG A 32 -7.763 -4.063 -11.140 1.00 53.23 H new ATOM 0 HD3 ARG A 32 -6.512 -5.063 -10.429 1.00 53.23 H new ATOM 0 HE ARG A 32 -9.095 -5.814 -9.383 1.00 34.34 H new ATOM 0 HH11 ARG A 32 -7.018 -6.040 -12.234 1.00 54.10 H new ATOM 0 HH12 ARG A 32 -7.771 -7.532 -12.808 1.00 54.10 H new ATOM 0 HH21 ARG A 32 -10.069 -7.726 -10.139 1.00 65.02 H new ATOM 0 HH22 ARG A 32 -9.490 -8.481 -11.627 1.00 65.02 H new ATOM 546 N ASP A 33 -6.738 -2.652 -5.743 1.00 22.31 N ATOM 547 CA ASP A 33 -6.303 -3.294 -4.498 1.00 25.31 C ATOM 548 C ASP A 33 -5.175 -2.496 -3.851 1.00 41.40 C ATOM 549 O ASP A 33 -4.559 -2.942 -2.883 1.00 50.24 O ATOM 550 CB ASP A 33 -5.844 -4.737 -4.745 1.00 74.13 C ATOM 551 CG ASP A 33 -6.984 -5.701 -5.002 1.00 1.53 C ATOM 552 OD1 ASP A 33 -7.469 -5.769 -6.148 1.00 1.41 O ATOM 553 OD2 ASP A 33 -7.382 -6.420 -4.059 1.00 21.33 O ATOM 0 H ASP A 33 -7.719 -2.374 -5.745 1.00 22.31 H new ATOM 0 HA ASP A 33 -7.158 -3.317 -3.823 1.00 25.31 H new ATOM 0 HB2 ASP A 33 -5.167 -4.753 -5.599 1.00 74.13 H new ATOM 0 HB3 ASP A 33 -5.276 -5.082 -3.881 1.00 74.13 H new ATOM 558 N GLU A 34 -4.927 -1.311 -4.405 1.00 43.34 N ATOM 559 CA GLU A 34 -3.865 -0.423 -3.961 1.00 60.50 C ATOM 560 C GLU A 34 -2.475 -1.049 -4.147 1.00 35.45 C ATOM 561 O GLU A 34 -1.570 -0.811 -3.348 1.00 60.43 O ATOM 562 CB GLU A 34 -4.104 0.010 -2.510 1.00 13.14 C ATOM 563 CG GLU A 34 -5.466 0.661 -2.312 1.00 13.10 C ATOM 564 CD GLU A 34 -5.596 1.385 -0.990 1.00 24.25 C ATOM 565 OE1 GLU A 34 -5.813 0.725 0.044 1.00 11.14 O ATOM 566 OE2 GLU A 34 -5.492 2.628 -0.985 1.00 32.31 O ATOM 0 H GLU A 34 -5.468 -0.939 -5.186 1.00 43.34 H new ATOM 0 HA GLU A 34 -3.888 0.467 -4.590 1.00 60.50 H new ATOM 0 HB2 GLU A 34 -4.022 -0.859 -1.857 1.00 13.14 H new ATOM 0 HB3 GLU A 34 -3.324 0.709 -2.210 1.00 13.14 H new ATOM 0 HG2 GLU A 34 -5.646 1.366 -3.124 1.00 13.10 H new ATOM 0 HG3 GLU A 34 -6.240 -0.104 -2.377 1.00 13.10 H new ATOM 573 N LYS A 35 -2.303 -1.833 -5.222 1.00 41.24 N ATOM 574 CA LYS A 35 -0.969 -2.323 -5.594 1.00 31.42 C ATOM 575 C LYS A 35 -0.847 -2.637 -7.093 1.00 63.33 C ATOM 576 O LYS A 35 0.256 -2.861 -7.587 1.00 1.12 O ATOM 577 CB LYS A 35 -0.553 -3.559 -4.777 1.00 52.55 C ATOM 578 CG LYS A 35 -1.334 -4.828 -5.090 1.00 62.34 C ATOM 579 CD LYS A 35 -2.567 -4.966 -4.218 1.00 22.04 C ATOM 580 CE LYS A 35 -2.203 -5.110 -2.747 1.00 64.14 C ATOM 581 NZ LYS A 35 -3.408 -5.238 -1.884 1.00 24.12 N ATOM 0 H LYS A 35 -3.057 -2.137 -5.839 1.00 41.24 H new ATOM 0 HA LYS A 35 -0.290 -1.503 -5.361 1.00 31.42 H new ATOM 0 HB2 LYS A 35 0.506 -3.750 -4.949 1.00 52.55 H new ATOM 0 HB3 LYS A 35 -0.668 -3.331 -3.717 1.00 52.55 H new ATOM 0 HG2 LYS A 35 -1.631 -4.822 -6.139 1.00 62.34 H new ATOM 0 HG3 LYS A 35 -0.689 -5.695 -4.946 1.00 62.34 H new ATOM 0 HD2 LYS A 35 -3.206 -4.093 -4.351 1.00 22.04 H new ATOM 0 HD3 LYS A 35 -3.143 -5.835 -4.537 1.00 22.04 H new ATOM 0 HE2 LYS A 35 -1.568 -5.986 -2.615 1.00 64.14 H new ATOM 0 HE3 LYS A 35 -1.621 -4.244 -2.431 1.00 64.14 H new ATOM 0 HZ1 LYS A 35 -3.116 -5.300 -0.888 1.00 24.12 H new ATOM 0 HZ2 LYS A 35 -4.019 -4.407 -2.015 1.00 24.12 H new ATOM 0 HZ3 LYS A 35 -3.932 -6.097 -2.145 1.00 24.12 H new ATOM 595 N GLN A 36 -1.959 -2.662 -7.825 1.00 11.13 N ATOM 596 CA GLN A 36 -1.900 -2.953 -9.259 1.00 32.00 C ATOM 597 C GLN A 36 -2.744 -1.966 -10.064 1.00 63.44 C ATOM 598 O GLN A 36 -3.606 -1.296 -9.520 1.00 54.13 O ATOM 599 CB GLN A 36 -2.322 -4.395 -9.568 1.00 20.45 C ATOM 600 CG GLN A 36 -3.772 -4.713 -9.255 1.00 33.12 C ATOM 601 CD GLN A 36 -4.217 -6.022 -9.875 1.00 50.02 C ATOM 602 OE1 GLN A 36 -4.701 -6.054 -11.006 1.00 43.11 O ATOM 603 NE2 GLN A 36 -4.055 -7.110 -9.142 1.00 12.44 N ATOM 0 H GLN A 36 -2.895 -2.488 -7.460 1.00 11.13 H new ATOM 0 HA GLN A 36 -0.859 -2.839 -9.560 1.00 32.00 H new ATOM 0 HB2 GLN A 36 -2.141 -4.594 -10.624 1.00 20.45 H new ATOM 0 HB3 GLN A 36 -1.685 -5.075 -9.002 1.00 20.45 H new ATOM 0 HG2 GLN A 36 -3.907 -4.760 -8.174 1.00 33.12 H new ATOM 0 HG3 GLN A 36 -4.406 -3.906 -9.620 1.00 33.12 H new ATOM 0 HE21 GLN A 36 -3.650 -7.040 -8.209 1.00 12.44 H new ATOM 0 HE22 GLN A 36 -4.335 -8.019 -9.510 1.00 12.44 H new ATOM 612 N ILE A 37 -2.463 -1.863 -11.353 1.00 24.04 N ATOM 613 CA ILE A 37 -3.152 -0.925 -12.235 1.00 20.15 C ATOM 614 C ILE A 37 -4.545 -1.433 -12.596 1.00 55.24 C ATOM 615 O ILE A 37 -4.713 -2.606 -12.923 1.00 2.02 O ATOM 616 CB ILE A 37 -2.371 -0.719 -13.549 1.00 75.51 C ATOM 617 CG1 ILE A 37 -0.876 -0.558 -13.263 1.00 32.22 C ATOM 618 CG2 ILE A 37 -2.912 0.486 -14.307 1.00 14.55 C ATOM 619 CD1 ILE A 37 -0.050 -0.155 -14.467 1.00 24.31 C ATOM 0 H ILE A 37 -1.752 -2.425 -11.820 1.00 24.04 H new ATOM 0 HA ILE A 37 -3.225 0.018 -11.692 1.00 20.15 H new ATOM 0 HB ILE A 37 -2.504 -1.601 -14.175 1.00 75.51 H new ATOM 0 HG12 ILE A 37 -0.746 0.190 -12.481 1.00 32.22 H new ATOM 0 HG13 ILE A 37 -0.490 -1.499 -12.871 1.00 32.22 H new ATOM 0 HG21 ILE A 37 -2.350 0.617 -15.231 1.00 14.55 H new ATOM 0 HG22 ILE A 37 -3.964 0.326 -14.542 1.00 14.55 H new ATOM 0 HG23 ILE A 37 -2.810 1.379 -13.691 1.00 14.55 H new ATOM 0 HD11 ILE A 37 0.996 -0.063 -14.176 1.00 24.31 H new ATOM 0 HD12 ILE A 37 -0.145 -0.913 -15.244 1.00 24.31 H new ATOM 0 HD13 ILE A 37 -0.406 0.802 -14.848 1.00 24.31 H new ATOM 631 N ASP A 38 -5.530 -0.551 -12.549 1.00 30.14 N ATOM 632 CA ASP A 38 -6.886 -0.888 -12.970 1.00 64.04 C ATOM 633 C ASP A 38 -7.466 0.253 -13.793 1.00 64.20 C ATOM 634 O ASP A 38 -6.985 1.375 -13.713 1.00 41.42 O ATOM 635 CB ASP A 38 -7.774 -1.162 -11.754 1.00 41.53 C ATOM 636 CG ASP A 38 -9.171 -1.622 -12.133 1.00 41.22 C ATOM 637 OD1 ASP A 38 -9.292 -2.554 -12.958 1.00 53.25 O ATOM 638 OD2 ASP A 38 -10.151 -1.071 -11.595 1.00 32.25 O ATOM 0 H ASP A 38 -5.418 0.409 -12.222 1.00 30.14 H new ATOM 0 HA ASP A 38 -6.850 -1.790 -13.580 1.00 64.04 H new ATOM 0 HB2 ASP A 38 -7.303 -1.922 -11.131 1.00 41.53 H new ATOM 0 HB3 ASP A 38 -7.846 -0.256 -11.152 1.00 41.53 H new ATOM 643 N VAL A 39 -8.482 -0.030 -14.589 1.00 61.51 N ATOM 644 CA VAL A 39 -9.121 0.999 -15.398 1.00 53.33 C ATOM 645 C VAL A 39 -10.601 1.058 -15.079 1.00 31.05 C ATOM 646 O VAL A 39 -11.280 0.031 -15.076 1.00 44.31 O ATOM 647 CB VAL A 39 -8.934 0.744 -16.904 1.00 44.43 C ATOM 648 CG1 VAL A 39 -9.624 1.819 -17.728 1.00 12.51 C ATOM 649 CG2 VAL A 39 -7.461 0.672 -17.253 1.00 30.53 C ATOM 0 H VAL A 39 -8.884 -0.962 -14.694 1.00 61.51 H new ATOM 0 HA VAL A 39 -8.646 1.949 -15.155 1.00 53.33 H new ATOM 0 HB VAL A 39 -9.394 -0.214 -17.144 1.00 44.43 H new ATOM 0 HG11 VAL A 39 -9.476 1.615 -18.789 1.00 12.51 H new ATOM 0 HG12 VAL A 39 -10.691 1.821 -17.504 1.00 12.51 H new ATOM 0 HG13 VAL A 39 -9.200 2.793 -17.483 1.00 12.51 H new ATOM 0 HG21 VAL A 39 -7.349 0.491 -18.322 1.00 30.53 H new ATOM 0 HG22 VAL A 39 -6.979 1.614 -16.992 1.00 30.53 H new ATOM 0 HG23 VAL A 39 -6.995 -0.141 -16.697 1.00 30.53 H new ATOM 659 N GLU A 40 -11.100 2.252 -14.812 1.00 13.51 N ATOM 660 CA GLU A 40 -12.474 2.397 -14.365 1.00 41.05 C ATOM 661 C GLU A 40 -13.298 3.256 -15.317 1.00 52.05 C ATOM 662 O GLU A 40 -14.426 2.903 -15.648 1.00 10.34 O ATOM 663 CB GLU A 40 -12.507 2.986 -12.958 1.00 43.34 C ATOM 664 CG GLU A 40 -11.662 2.207 -11.962 1.00 3.34 C ATOM 665 CD GLU A 40 -11.821 2.720 -10.541 1.00 30.11 C ATOM 666 OE1 GLU A 40 -11.597 3.932 -10.312 1.00 1.14 O ATOM 667 OE2 GLU A 40 -12.193 1.924 -9.652 1.00 41.22 O ATOM 0 H GLU A 40 -10.581 3.126 -14.896 1.00 13.51 H new ATOM 0 HA GLU A 40 -12.923 1.404 -14.353 1.00 41.05 H new ATOM 0 HB2 GLU A 40 -12.156 4.017 -12.995 1.00 43.34 H new ATOM 0 HB3 GLU A 40 -13.538 3.013 -12.607 1.00 43.34 H new ATOM 0 HG2 GLU A 40 -11.941 1.154 -11.998 1.00 3.34 H new ATOM 0 HG3 GLU A 40 -10.613 2.269 -12.253 1.00 3.34 H new ATOM 674 N THR A 41 -12.740 4.369 -15.774 1.00 23.45 N ATOM 675 CA THR A 41 -13.504 5.301 -16.599 1.00 21.44 C ATOM 676 C THR A 41 -12.800 5.585 -17.925 1.00 74.12 C ATOM 677 O THR A 41 -11.648 6.020 -17.951 1.00 55.14 O ATOM 678 CB THR A 41 -13.747 6.634 -15.853 1.00 1.14 C ATOM 679 OG1 THR A 41 -14.314 6.372 -14.562 1.00 64.22 O ATOM 680 CG2 THR A 41 -14.685 7.540 -16.638 1.00 34.03 C ATOM 0 H THR A 41 -11.776 4.648 -15.592 1.00 23.45 H new ATOM 0 HA THR A 41 -14.463 4.826 -16.807 1.00 21.44 H new ATOM 0 HB THR A 41 -12.787 7.139 -15.743 1.00 1.14 H new ATOM 0 HG1 THR A 41 -14.464 7.219 -14.093 1.00 64.22 H new ATOM 0 HG21 THR A 41 -14.837 8.469 -16.089 1.00 34.03 H new ATOM 0 HG22 THR A 41 -14.247 7.761 -17.611 1.00 34.03 H new ATOM 0 HG23 THR A 41 -15.643 7.039 -16.776 1.00 34.03 H new ATOM 688 N VAL A 42 -13.497 5.325 -19.026 1.00 22.01 N ATOM 689 CA VAL A 42 -12.971 5.608 -20.356 1.00 72.41 C ATOM 690 C VAL A 42 -14.049 6.233 -21.234 1.00 25.33 C ATOM 691 O VAL A 42 -15.241 6.005 -21.025 1.00 31.52 O ATOM 692 CB VAL A 42 -12.426 4.339 -21.060 1.00 3.21 C ATOM 693 CG1 VAL A 42 -11.231 3.767 -20.313 1.00 4.24 C ATOM 694 CG2 VAL A 42 -13.515 3.290 -21.209 1.00 62.24 C ATOM 0 H VAL A 42 -14.432 4.917 -19.023 1.00 22.01 H new ATOM 0 HA VAL A 42 -12.143 6.304 -20.220 1.00 72.41 H new ATOM 0 HB VAL A 42 -12.094 4.630 -22.056 1.00 3.21 H new ATOM 0 HG11 VAL A 42 -10.870 2.878 -20.830 1.00 4.24 H new ATOM 0 HG12 VAL A 42 -10.436 4.512 -20.274 1.00 4.24 H new ATOM 0 HG13 VAL A 42 -11.529 3.501 -19.299 1.00 4.24 H new ATOM 0 HG21 VAL A 42 -13.107 2.410 -21.706 1.00 62.24 H new ATOM 0 HG22 VAL A 42 -13.888 3.010 -20.224 1.00 62.24 H new ATOM 0 HG23 VAL A 42 -14.333 3.696 -21.805 1.00 62.24 H new ATOM 704 N ALA A 43 -13.623 7.026 -22.205 1.00 11.45 N ATOM 705 CA ALA A 43 -14.535 7.633 -23.164 1.00 14.32 C ATOM 706 C ALA A 43 -13.790 7.947 -24.449 1.00 74.55 C ATOM 707 O ALA A 43 -12.566 7.800 -24.512 1.00 71.32 O ATOM 708 CB ALA A 43 -15.172 8.893 -22.592 1.00 0.44 C ATOM 0 H ALA A 43 -12.642 7.266 -22.351 1.00 11.45 H new ATOM 0 HA ALA A 43 -15.336 6.926 -23.379 1.00 14.32 H new ATOM 0 HB1 ALA A 43 -15.848 9.326 -23.329 1.00 0.44 H new ATOM 0 HB2 ALA A 43 -15.731 8.641 -21.691 1.00 0.44 H new ATOM 0 HB3 ALA A 43 -14.393 9.615 -22.346 1.00 0.44 H new ATOM 714 N ASP A 44 -14.513 8.380 -25.465 1.00 45.54 N ATOM 715 CA ASP A 44 -13.905 8.653 -26.758 1.00 43.42 C ATOM 716 C ASP A 44 -14.020 10.132 -27.121 1.00 3.42 C ATOM 717 O ASP A 44 -14.374 10.960 -26.282 1.00 73.31 O ATOM 718 CB ASP A 44 -14.545 7.788 -27.846 1.00 44.42 C ATOM 719 CG ASP A 44 -15.960 8.210 -28.176 1.00 35.25 C ATOM 720 OD1 ASP A 44 -16.883 7.841 -27.427 1.00 70.14 O ATOM 721 OD2 ASP A 44 -16.149 8.906 -29.193 1.00 2.23 O ATOM 0 H ASP A 44 -15.518 8.550 -25.423 1.00 45.54 H new ATOM 0 HA ASP A 44 -12.846 8.403 -26.689 1.00 43.42 H new ATOM 0 HB2 ASP A 44 -13.936 7.839 -28.749 1.00 44.42 H new ATOM 0 HB3 ASP A 44 -14.548 6.747 -27.521 1.00 44.42 H new ATOM 726 N ARG A 45 -13.720 10.443 -28.376 1.00 13.25 N ATOM 727 CA ARG A 45 -13.630 11.822 -28.850 1.00 1.04 C ATOM 728 C ARG A 45 -14.989 12.530 -28.898 1.00 31.00 C ATOM 729 O ARG A 45 -15.044 13.745 -29.082 1.00 33.10 O ATOM 730 CB ARG A 45 -12.962 11.847 -30.237 1.00 71.13 C ATOM 731 CG ARG A 45 -13.618 10.926 -31.265 1.00 71.54 C ATOM 732 CD ARG A 45 -14.873 11.538 -31.870 1.00 71.22 C ATOM 733 NE ARG A 45 -15.664 10.556 -32.608 1.00 51.11 N ATOM 734 CZ ARG A 45 -16.754 10.855 -33.314 1.00 13.20 C ATOM 735 NH1 ARG A 45 -17.133 12.119 -33.461 1.00 51.50 N ATOM 736 NH2 ARG A 45 -17.451 9.887 -33.891 1.00 72.12 N ATOM 0 H ARG A 45 -13.532 9.746 -29.097 1.00 13.25 H new ATOM 0 HA ARG A 45 -13.022 12.373 -28.132 1.00 1.04 H new ATOM 0 HB2 ARG A 45 -12.979 12.868 -30.618 1.00 71.13 H new ATOM 0 HB3 ARG A 45 -11.915 11.565 -30.129 1.00 71.13 H new ATOM 0 HG2 ARG A 45 -12.905 10.705 -32.059 1.00 71.54 H new ATOM 0 HG3 ARG A 45 -13.871 9.978 -30.791 1.00 71.54 H new ATOM 0 HD2 ARG A 45 -15.483 11.971 -31.077 1.00 71.22 H new ATOM 0 HD3 ARG A 45 -14.593 12.352 -32.538 1.00 71.22 H new ATOM 0 HE ARG A 45 -15.363 9.582 -32.581 1.00 51.11 H new ATOM 0 HH11 ARG A 45 -16.589 12.868 -33.032 1.00 51.50 H new ATOM 0 HH12 ARG A 45 -17.968 12.341 -34.003 1.00 51.50 H new ATOM 0 HH21 ARG A 45 -17.153 8.916 -33.794 1.00 72.12 H new ATOM 0 HH22 ARG A 45 -18.286 10.112 -34.432 1.00 72.12 H new ATOM 750 N ASN A 46 -16.078 11.777 -28.752 1.00 42.42 N ATOM 751 CA ASN A 46 -17.421 12.359 -28.828 1.00 14.12 C ATOM 752 C ASN A 46 -17.681 13.320 -27.666 1.00 40.55 C ATOM 753 O ASN A 46 -18.453 14.269 -27.796 1.00 53.22 O ATOM 754 CB ASN A 46 -18.486 11.255 -28.857 1.00 53.15 C ATOM 755 CG ASN A 46 -19.883 11.796 -29.111 1.00 63.43 C ATOM 756 OD1 ASN A 46 -20.285 11.993 -30.260 1.00 65.34 O ATOM 757 ND2 ASN A 46 -20.646 12.007 -28.051 1.00 42.34 N ATOM 0 H ASN A 46 -16.060 10.771 -28.582 1.00 42.42 H new ATOM 0 HA ASN A 46 -17.482 12.930 -29.754 1.00 14.12 H new ATOM 0 HB2 ASN A 46 -18.234 10.532 -29.633 1.00 53.15 H new ATOM 0 HB3 ASN A 46 -18.475 10.720 -27.908 1.00 53.15 H new ATOM 0 HD21 ASN A 46 -21.601 12.344 -28.169 1.00 42.34 H new ATOM 0 HD22 ASN A 46 -20.279 11.833 -27.115 1.00 42.34 H new ATOM 764 N ALA A 47 -17.020 13.086 -26.542 1.00 13.10 N ATOM 765 CA ALA A 47 -17.184 13.935 -25.369 1.00 14.11 C ATOM 766 C ALA A 47 -15.997 14.884 -25.225 1.00 52.33 C ATOM 767 O ALA A 47 -14.939 14.659 -25.818 1.00 3.03 O ATOM 768 CB ALA A 47 -17.353 13.078 -24.123 1.00 32.32 C ATOM 0 H ALA A 47 -16.364 12.315 -26.416 1.00 13.10 H new ATOM 0 HA ALA A 47 -18.082 14.539 -25.494 1.00 14.11 H new ATOM 0 HB1 ALA A 47 -17.475 13.722 -23.252 1.00 32.32 H new ATOM 0 HB2 ALA A 47 -18.234 12.446 -24.233 1.00 32.32 H new ATOM 0 HB3 ALA A 47 -16.471 12.451 -23.990 1.00 32.32 H new ATOM 774 N GLU A 48 -16.165 15.941 -24.438 1.00 73.33 N ATOM 775 CA GLU A 48 -15.120 16.949 -24.297 1.00 41.21 C ATOM 776 C GLU A 48 -14.537 16.965 -22.882 1.00 51.15 C ATOM 777 O GLU A 48 -15.016 16.261 -21.989 1.00 21.31 O ATOM 778 CB GLU A 48 -15.649 18.330 -24.694 1.00 53.34 C ATOM 779 CG GLU A 48 -16.824 18.814 -23.864 1.00 22.31 C ATOM 780 CD GLU A 48 -17.474 20.043 -24.465 1.00 13.03 C ATOM 781 OE1 GLU A 48 -16.756 21.031 -24.746 1.00 64.11 O ATOM 782 OE2 GLU A 48 -18.699 20.024 -24.676 1.00 12.51 O ATOM 0 H GLU A 48 -17.007 16.122 -23.892 1.00 73.33 H new ATOM 0 HA GLU A 48 -14.308 16.685 -24.975 1.00 41.21 H new ATOM 0 HB2 GLU A 48 -14.838 19.054 -24.611 1.00 53.34 H new ATOM 0 HB3 GLU A 48 -15.947 18.304 -25.742 1.00 53.34 H new ATOM 0 HG2 GLU A 48 -17.563 18.017 -23.781 1.00 22.31 H new ATOM 0 HG3 GLU A 48 -16.485 19.041 -22.853 1.00 22.31 H new ATOM 789 N TYR A 49 -13.522 17.804 -22.684 1.00 23.51 N ATOM 790 CA TYR A 49 -12.691 17.767 -21.482 1.00 1.33 C ATOM 791 C TYR A 49 -13.456 18.264 -20.260 1.00 64.51 C ATOM 792 O TYR A 49 -13.250 17.771 -19.149 1.00 22.15 O ATOM 793 CB TYR A 49 -11.429 18.615 -21.687 1.00 11.24 C ATOM 794 CG TYR A 49 -10.823 18.482 -23.070 1.00 3.51 C ATOM 795 CD1 TYR A 49 -10.406 17.249 -23.556 1.00 32.41 C ATOM 796 CD2 TYR A 49 -10.677 19.593 -23.892 1.00 21.25 C ATOM 797 CE1 TYR A 49 -9.862 17.128 -24.821 1.00 4.25 C ATOM 798 CE2 TYR A 49 -10.134 19.479 -25.157 1.00 71.42 C ATOM 799 CZ TYR A 49 -9.729 18.245 -25.617 1.00 14.01 C ATOM 800 OH TYR A 49 -9.192 18.128 -26.878 1.00 64.24 O ATOM 0 H TYR A 49 -13.253 18.527 -23.351 1.00 23.51 H new ATOM 0 HA TYR A 49 -12.407 16.730 -21.305 1.00 1.33 H new ATOM 0 HB2 TYR A 49 -11.672 19.662 -21.506 1.00 11.24 H new ATOM 0 HB3 TYR A 49 -10.684 18.328 -20.945 1.00 11.24 H new ATOM 0 HD1 TYR A 49 -10.509 16.371 -22.935 1.00 32.41 H new ATOM 0 HD2 TYR A 49 -10.994 20.562 -23.536 1.00 21.25 H new ATOM 0 HE1 TYR A 49 -9.543 16.162 -25.184 1.00 4.25 H new ATOM 0 HE2 TYR A 49 -10.027 20.353 -25.782 1.00 71.42 H new ATOM 0 HH TYR A 49 -9.170 19.009 -27.307 1.00 64.24 H new ATOM 810 N ASP A 50 -14.336 19.239 -20.474 1.00 40.25 N ATOM 811 CA ASP A 50 -15.153 19.801 -19.396 1.00 72.33 C ATOM 812 C ASP A 50 -15.952 18.707 -18.699 1.00 25.22 C ATOM 813 O ASP A 50 -16.072 18.687 -17.474 1.00 52.43 O ATOM 814 CB ASP A 50 -16.125 20.854 -19.943 1.00 44.32 C ATOM 815 CG ASP A 50 -15.434 22.092 -20.478 1.00 73.12 C ATOM 816 OD1 ASP A 50 -14.911 22.049 -21.609 1.00 12.34 O ATOM 817 OD2 ASP A 50 -15.416 23.122 -19.773 1.00 24.14 O ATOM 0 H ASP A 50 -14.504 19.660 -21.388 1.00 40.25 H new ATOM 0 HA ASP A 50 -14.477 20.269 -18.681 1.00 72.33 H new ATOM 0 HB2 ASP A 50 -16.722 20.408 -20.739 1.00 44.32 H new ATOM 0 HB3 ASP A 50 -16.816 21.146 -19.152 1.00 44.32 H new ATOM 822 N GLN A 51 -16.469 17.786 -19.495 1.00 63.41 N ATOM 823 CA GLN A 51 -17.346 16.735 -19.003 1.00 45.41 C ATOM 824 C GLN A 51 -16.555 15.649 -18.276 1.00 1.22 C ATOM 825 O GLN A 51 -17.056 15.029 -17.338 1.00 24.24 O ATOM 826 CB GLN A 51 -18.116 16.132 -20.179 1.00 31.25 C ATOM 827 CG GLN A 51 -18.871 17.172 -20.995 1.00 13.43 C ATOM 828 CD GLN A 51 -19.333 16.644 -22.339 1.00 34.53 C ATOM 829 OE1 GLN A 51 -18.700 15.768 -22.924 1.00 20.31 O ATOM 830 NE2 GLN A 51 -20.429 17.184 -22.847 1.00 62.35 N ATOM 0 H GLN A 51 -16.293 17.745 -20.499 1.00 63.41 H new ATOM 0 HA GLN A 51 -18.045 17.168 -18.288 1.00 45.41 H new ATOM 0 HB2 GLN A 51 -17.419 15.605 -20.830 1.00 31.25 H new ATOM 0 HB3 GLN A 51 -18.822 15.392 -19.802 1.00 31.25 H new ATOM 0 HG2 GLN A 51 -19.736 17.514 -20.427 1.00 13.43 H new ATOM 0 HG3 GLN A 51 -18.230 18.039 -21.152 1.00 13.43 H new ATOM 0 HE21 GLN A 51 -20.927 17.909 -22.331 1.00 62.35 H new ATOM 0 HE22 GLN A 51 -20.776 16.875 -23.755 1.00 62.35 H new ATOM 839 N PHE A 52 -15.315 15.436 -18.707 1.00 12.41 N ATOM 840 CA PHE A 52 -14.464 14.402 -18.122 1.00 65.11 C ATOM 841 C PHE A 52 -14.084 14.754 -16.688 1.00 52.54 C ATOM 842 O PHE A 52 -14.308 13.971 -15.760 1.00 63.22 O ATOM 843 CB PHE A 52 -13.187 14.215 -18.947 1.00 43.35 C ATOM 844 CG PHE A 52 -13.419 13.799 -20.372 1.00 32.14 C ATOM 845 CD1 PHE A 52 -14.521 13.033 -20.720 1.00 72.34 C ATOM 846 CD2 PHE A 52 -12.528 14.172 -21.365 1.00 12.32 C ATOM 847 CE1 PHE A 52 -14.727 12.649 -22.029 1.00 14.12 C ATOM 848 CE2 PHE A 52 -12.730 13.789 -22.676 1.00 20.21 C ATOM 849 CZ PHE A 52 -13.831 13.027 -23.009 1.00 72.33 C ATOM 0 H PHE A 52 -14.876 15.966 -19.460 1.00 12.41 H new ATOM 0 HA PHE A 52 -15.034 13.473 -18.124 1.00 65.11 H new ATOM 0 HB2 PHE A 52 -12.626 15.150 -18.942 1.00 43.35 H new ATOM 0 HB3 PHE A 52 -12.562 13.466 -18.461 1.00 43.35 H new ATOM 0 HD1 PHE A 52 -15.226 12.734 -19.958 1.00 72.34 H new ATOM 0 HD2 PHE A 52 -11.665 14.770 -21.111 1.00 12.32 H new ATOM 0 HE1 PHE A 52 -15.589 12.052 -22.287 1.00 14.12 H new ATOM 0 HE2 PHE A 52 -12.027 14.086 -23.440 1.00 20.21 H new ATOM 0 HZ PHE A 52 -13.992 12.727 -24.034 1.00 72.33 H new ATOM 859 N LEU A 53 -13.517 15.942 -16.518 1.00 51.15 N ATOM 860 CA LEU A 53 -13.031 16.393 -15.218 1.00 52.20 C ATOM 861 C LEU A 53 -14.190 16.495 -14.226 1.00 52.04 C ATOM 862 O LEU A 53 -14.040 16.199 -13.037 1.00 61.42 O ATOM 863 CB LEU A 53 -12.320 17.747 -15.386 1.00 21.05 C ATOM 864 CG LEU A 53 -11.389 18.186 -14.243 1.00 74.31 C ATOM 865 CD1 LEU A 53 -12.171 18.777 -13.082 1.00 15.45 C ATOM 866 CD2 LEU A 53 -10.536 17.018 -13.767 1.00 3.24 C ATOM 0 H LEU A 53 -13.381 16.617 -17.271 1.00 51.15 H new ATOM 0 HA LEU A 53 -12.318 15.670 -14.820 1.00 52.20 H new ATOM 0 HB2 LEU A 53 -11.736 17.713 -16.306 1.00 21.05 H new ATOM 0 HB3 LEU A 53 -13.081 18.516 -15.520 1.00 21.05 H new ATOM 0 HG LEU A 53 -10.733 18.964 -14.634 1.00 74.31 H new ATOM 0 HD11 LEU A 53 -11.481 19.076 -12.293 1.00 15.45 H new ATOM 0 HD12 LEU A 53 -12.729 19.648 -13.425 1.00 15.45 H new ATOM 0 HD13 LEU A 53 -12.865 18.031 -12.694 1.00 15.45 H new ATOM 0 HD21 LEU A 53 -9.884 17.349 -12.958 1.00 3.24 H new ATOM 0 HD22 LEU A 53 -11.183 16.218 -13.407 1.00 3.24 H new ATOM 0 HD23 LEU A 53 -9.929 16.650 -14.594 1.00 3.24 H new ATOM 878 N GLU A 54 -15.352 16.878 -14.737 1.00 2.10 N ATOM 879 CA GLU A 54 -16.544 17.045 -13.919 1.00 21.11 C ATOM 880 C GLU A 54 -17.080 15.691 -13.442 1.00 71.41 C ATOM 881 O GLU A 54 -17.731 15.600 -12.401 1.00 32.44 O ATOM 882 CB GLU A 54 -17.613 17.791 -14.726 1.00 42.14 C ATOM 883 CG GLU A 54 -18.883 18.105 -13.955 1.00 43.11 C ATOM 884 CD GLU A 54 -18.633 18.950 -12.723 1.00 0.42 C ATOM 885 OE1 GLU A 54 -17.790 19.866 -12.782 1.00 5.41 O ATOM 886 OE2 GLU A 54 -19.308 18.717 -11.696 1.00 2.45 O ATOM 0 H GLU A 54 -15.494 17.081 -15.726 1.00 2.10 H new ATOM 0 HA GLU A 54 -16.285 17.627 -13.035 1.00 21.11 H new ATOM 0 HB2 GLU A 54 -17.187 18.724 -15.093 1.00 42.14 H new ATOM 0 HB3 GLU A 54 -17.873 17.193 -15.600 1.00 42.14 H new ATOM 0 HG2 GLU A 54 -19.580 18.626 -14.611 1.00 43.11 H new ATOM 0 HG3 GLU A 54 -19.361 17.172 -13.658 1.00 43.11 H new ATOM 893 N ASP A 55 -16.799 14.637 -14.196 1.00 51.23 N ATOM 894 CA ASP A 55 -17.306 13.312 -13.855 1.00 31.22 C ATOM 895 C ASP A 55 -16.408 12.621 -12.838 1.00 73.31 C ATOM 896 O ASP A 55 -16.884 12.115 -11.822 1.00 42.44 O ATOM 897 CB ASP A 55 -17.435 12.435 -15.100 1.00 31.32 C ATOM 898 CG ASP A 55 -18.215 11.162 -14.826 1.00 51.20 C ATOM 899 OD1 ASP A 55 -17.608 10.159 -14.400 1.00 33.31 O ATOM 900 OD2 ASP A 55 -19.447 11.158 -15.045 1.00 23.45 O ATOM 0 H ASP A 55 -16.228 14.671 -15.041 1.00 51.23 H new ATOM 0 HA ASP A 55 -18.293 13.450 -13.415 1.00 31.22 H new ATOM 0 HB2 ASP A 55 -17.930 12.999 -15.890 1.00 31.32 H new ATOM 0 HB3 ASP A 55 -16.441 12.178 -15.466 1.00 31.32 H new ATOM 905 N ILE A 56 -15.106 12.614 -13.105 1.00 1.40 N ATOM 906 CA ILE A 56 -14.162 11.884 -12.262 1.00 11.44 C ATOM 907 C ILE A 56 -14.056 12.494 -10.864 1.00 34.13 C ATOM 908 O ILE A 56 -13.790 11.785 -9.891 1.00 52.24 O ATOM 909 CB ILE A 56 -12.755 11.806 -12.895 1.00 51.33 C ATOM 910 CG1 ILE A 56 -12.208 13.206 -13.187 1.00 4.54 C ATOM 911 CG2 ILE A 56 -12.795 10.966 -14.165 1.00 44.53 C ATOM 912 CD1 ILE A 56 -10.793 13.209 -13.726 1.00 33.33 C ATOM 0 H ILE A 56 -14.681 13.102 -13.893 1.00 1.40 H new ATOM 0 HA ILE A 56 -14.560 10.873 -12.176 1.00 11.44 H new ATOM 0 HB ILE A 56 -12.083 11.327 -12.183 1.00 51.33 H new ATOM 0 HG12 ILE A 56 -12.862 13.699 -13.907 1.00 4.54 H new ATOM 0 HG13 ILE A 56 -12.239 13.796 -12.271 1.00 4.54 H new ATOM 0 HG21 ILE A 56 -11.797 10.919 -14.602 1.00 44.53 H new ATOM 0 HG22 ILE A 56 -13.134 9.958 -13.924 1.00 44.53 H new ATOM 0 HG23 ILE A 56 -13.483 11.419 -14.879 1.00 44.53 H new ATOM 0 HD11 ILE A 56 -10.475 14.236 -13.908 1.00 33.33 H new ATOM 0 HD12 ILE A 56 -10.126 12.746 -12.999 1.00 33.33 H new ATOM 0 HD13 ILE A 56 -10.758 12.647 -14.659 1.00 33.33 H new ATOM 924 N GLN A 57 -14.285 13.802 -10.765 1.00 22.03 N ATOM 925 CA GLN A 57 -14.213 14.500 -9.482 1.00 11.31 C ATOM 926 C GLN A 57 -15.390 14.105 -8.595 1.00 35.50 C ATOM 927 O GLN A 57 -15.343 14.238 -7.373 1.00 13.13 O ATOM 928 CB GLN A 57 -14.228 16.015 -9.697 1.00 33.34 C ATOM 929 CG GLN A 57 -15.613 16.571 -9.998 1.00 11.20 C ATOM 930 CD GLN A 57 -15.607 18.053 -10.296 1.00 42.12 C ATOM 931 OE1 GLN A 57 -14.566 18.522 -10.960 1.00 12.21 O flip ATOM 932 NE2 GLN A 57 -16.548 18.766 -9.952 1.00 4.21 N flip ATOM 0 H GLN A 57 -14.522 14.400 -11.557 1.00 22.03 H new ATOM 0 HA GLN A 57 -13.282 14.215 -8.992 1.00 11.31 H new ATOM 0 HB2 GLN A 57 -13.834 16.504 -8.806 1.00 33.34 H new ATOM 0 HB3 GLN A 57 -13.558 16.264 -10.520 1.00 33.34 H new ATOM 0 HG2 GLN A 57 -16.035 16.037 -10.850 1.00 11.20 H new ATOM 0 HG3 GLN A 57 -16.267 16.381 -9.147 1.00 11.20 H new ATOM 0 HE21 GLN A 57 -17.333 18.363 -9.440 1.00 4.21 H new ATOM 0 HE22 GLN A 57 -16.544 19.761 -10.178 1.00 4.21 H new ATOM 941 N LYS A 58 -16.440 13.609 -9.235 1.00 40.44 N ATOM 942 CA LYS A 58 -17.682 13.257 -8.563 1.00 52.44 C ATOM 943 C LYS A 58 -17.512 11.983 -7.733 1.00 73.41 C ATOM 944 O LYS A 58 -18.300 11.706 -6.829 1.00 45.35 O ATOM 945 CB LYS A 58 -18.781 13.118 -9.632 1.00 52.10 C ATOM 946 CG LYS A 58 -20.106 12.534 -9.159 1.00 74.23 C ATOM 947 CD LYS A 58 -20.171 11.029 -9.393 1.00 71.04 C ATOM 948 CE LYS A 58 -19.830 10.658 -10.835 1.00 40.04 C ATOM 949 NZ LYS A 58 -20.717 11.337 -11.821 1.00 42.22 N ATOM 0 H LYS A 58 -16.454 13.439 -10.241 1.00 40.44 H new ATOM 0 HA LYS A 58 -17.969 14.038 -7.859 1.00 52.44 H new ATOM 0 HB2 LYS A 58 -18.973 14.103 -10.057 1.00 52.10 H new ATOM 0 HB3 LYS A 58 -18.398 12.492 -10.438 1.00 52.10 H new ATOM 0 HG2 LYS A 58 -20.239 12.744 -8.098 1.00 74.23 H new ATOM 0 HG3 LYS A 58 -20.927 13.020 -9.685 1.00 74.23 H new ATOM 0 HD2 LYS A 58 -19.479 10.527 -8.716 1.00 71.04 H new ATOM 0 HD3 LYS A 58 -21.171 10.668 -9.153 1.00 71.04 H new ATOM 0 HE2 LYS A 58 -18.793 10.924 -11.040 1.00 40.04 H new ATOM 0 HE3 LYS A 58 -19.913 9.578 -10.959 1.00 40.04 H new ATOM 0 HZ1 LYS A 58 -20.538 10.953 -12.771 1.00 42.22 H new ATOM 0 HZ2 LYS A 58 -21.711 11.174 -11.563 1.00 42.22 H new ATOM 0 HZ3 LYS A 58 -20.521 12.358 -11.818 1.00 42.22 H new ATOM 963 N CYS A 59 -16.467 11.223 -8.027 1.00 13.51 N ATOM 964 CA CYS A 59 -16.184 10.005 -7.283 1.00 63.40 C ATOM 965 C CYS A 59 -15.468 10.334 -5.977 1.00 52.13 C ATOM 966 O CYS A 59 -15.795 9.791 -4.921 1.00 33.22 O ATOM 967 CB CYS A 59 -15.329 9.062 -8.131 1.00 14.53 C ATOM 968 SG CYS A 59 -14.779 7.567 -7.275 1.00 5.40 S ATOM 0 H CYS A 59 -15.803 11.428 -8.774 1.00 13.51 H new ATOM 0 HA CYS A 59 -17.127 9.512 -7.046 1.00 63.40 H new ATOM 0 HB2 CYS A 59 -15.899 8.770 -9.013 1.00 14.53 H new ATOM 0 HB3 CYS A 59 -14.453 9.606 -8.483 1.00 14.53 H new ATOM 0 HG CYS A 59 -13.877 7.879 -6.393 1.00 5.40 H new ATOM 974 N GLY A 60 -14.502 11.236 -6.054 1.00 20.30 N ATOM 975 CA GLY A 60 -13.765 11.636 -4.876 1.00 1.02 C ATOM 976 C GLY A 60 -12.592 12.524 -5.224 1.00 62.43 C ATOM 977 O GLY A 60 -11.795 12.176 -6.087 1.00 0.11 O ATOM 0 H GLY A 60 -14.215 11.700 -6.916 1.00 20.30 H new ATOM 0 HA2 GLY A 60 -14.430 12.163 -4.192 1.00 1.02 H new ATOM 0 HA3 GLY A 60 -13.407 10.750 -4.352 1.00 1.02 H new ATOM 981 N PRO A 61 -12.466 13.690 -4.583 1.00 20.11 N ATOM 982 CA PRO A 61 -11.360 14.611 -4.820 1.00 64.42 C ATOM 983 C PRO A 61 -10.113 14.250 -4.013 1.00 61.34 C ATOM 984 O PRO A 61 -9.119 14.974 -4.034 1.00 23.13 O ATOM 985 CB PRO A 61 -11.914 15.970 -4.363 1.00 72.15 C ATOM 986 CG PRO A 61 -13.292 15.709 -3.829 1.00 70.22 C ATOM 987 CD PRO A 61 -13.400 14.229 -3.597 1.00 43.32 C ATOM 0 HA PRO A 61 -11.040 14.594 -5.862 1.00 64.42 H new ATOM 0 HB2 PRO A 61 -11.277 16.411 -3.596 1.00 72.15 H new ATOM 0 HB3 PRO A 61 -11.947 16.675 -5.194 1.00 72.15 H new ATOM 0 HG2 PRO A 61 -13.457 16.258 -2.902 1.00 70.22 H new ATOM 0 HG3 PRO A 61 -14.050 16.045 -4.537 1.00 70.22 H new ATOM 0 HD2 PRO A 61 -13.120 13.955 -2.580 1.00 43.32 H new ATOM 0 HD3 PRO A 61 -14.415 13.865 -3.757 1.00 43.32 H new ATOM 995 N GLY A 62 -10.171 13.130 -3.304 1.00 3.40 N ATOM 996 CA GLY A 62 -9.057 12.720 -2.474 1.00 52.24 C ATOM 997 C GLY A 62 -8.581 11.314 -2.781 1.00 23.44 C ATOM 998 O GLY A 62 -8.224 10.561 -1.873 1.00 73.14 O ATOM 0 H GLY A 62 -10.971 12.498 -3.290 1.00 3.40 H new ATOM 0 HA2 GLY A 62 -8.230 13.417 -2.613 1.00 52.24 H new ATOM 0 HA3 GLY A 62 -9.350 12.779 -1.426 1.00 52.24 H new ATOM 1002 N GLU A 63 -8.576 10.958 -4.057 1.00 75.12 N ATOM 1003 CA GLU A 63 -8.080 9.659 -4.484 1.00 44.12 C ATOM 1004 C GLU A 63 -7.135 9.827 -5.667 1.00 33.33 C ATOM 1005 O GLU A 63 -7.039 10.911 -6.243 1.00 14.24 O ATOM 1006 CB GLU A 63 -9.239 8.714 -4.831 1.00 43.10 C ATOM 1007 CG GLU A 63 -10.136 9.194 -5.964 1.00 2.05 C ATOM 1008 CD GLU A 63 -11.318 8.269 -6.192 1.00 15.44 C ATOM 1009 OE1 GLU A 63 -11.153 7.242 -6.884 1.00 70.45 O ATOM 1010 OE2 GLU A 63 -12.412 8.550 -5.659 1.00 21.11 O ATOM 0 H GLU A 63 -8.911 11.552 -4.816 1.00 75.12 H new ATOM 0 HA GLU A 63 -7.527 9.208 -3.660 1.00 44.12 H new ATOM 0 HB2 GLU A 63 -8.828 7.741 -5.099 1.00 43.10 H new ATOM 0 HB3 GLU A 63 -9.849 8.568 -3.940 1.00 43.10 H new ATOM 0 HG2 GLU A 63 -10.500 10.196 -5.737 1.00 2.05 H new ATOM 0 HG3 GLU A 63 -9.552 9.267 -6.881 1.00 2.05 H new ATOM 1017 N CYS A 64 -6.427 8.766 -6.016 1.00 74.12 N ATOM 1018 CA CYS A 64 -5.429 8.847 -7.066 1.00 72.12 C ATOM 1019 C CYS A 64 -5.897 8.149 -8.338 1.00 65.21 C ATOM 1020 O CYS A 64 -6.344 7.003 -8.304 1.00 11.31 O ATOM 1021 CB CYS A 64 -4.115 8.234 -6.578 1.00 32.40 C ATOM 1022 SG CYS A 64 -4.302 6.619 -5.779 1.00 73.43 S ATOM 0 H CYS A 64 -6.524 7.844 -5.590 1.00 74.12 H new ATOM 0 HA CYS A 64 -5.273 9.899 -7.306 1.00 72.12 H new ATOM 0 HB2 CYS A 64 -3.438 8.131 -7.426 1.00 32.40 H new ATOM 0 HB3 CYS A 64 -3.644 8.922 -5.876 1.00 32.40 H new ATOM 0 HG CYS A 64 -5.228 5.939 -6.387 1.00 73.43 H new ATOM 1028 N ARG A 65 -5.771 8.849 -9.455 1.00 31.31 N ATOM 1029 CA ARG A 65 -6.119 8.313 -10.762 1.00 62.31 C ATOM 1030 C ARG A 65 -5.234 8.930 -11.831 1.00 51.22 C ATOM 1031 O ARG A 65 -5.149 10.143 -11.948 1.00 22.41 O ATOM 1032 CB ARG A 65 -7.586 8.602 -11.093 1.00 14.52 C ATOM 1033 CG ARG A 65 -8.570 7.630 -10.464 1.00 13.14 C ATOM 1034 CD ARG A 65 -10.003 8.063 -10.717 1.00 71.33 C ATOM 1035 NE ARG A 65 -10.961 6.987 -10.469 1.00 52.44 N ATOM 1036 CZ ARG A 65 -12.260 7.185 -10.271 1.00 2.30 C ATOM 1037 NH1 ARG A 65 -12.749 8.422 -10.231 1.00 44.43 N ATOM 1038 NH2 ARG A 65 -13.065 6.145 -10.108 1.00 1.22 N ATOM 0 H ARG A 65 -5.423 9.808 -9.481 1.00 31.31 H new ATOM 0 HA ARG A 65 -5.967 7.234 -10.738 1.00 62.31 H new ATOM 0 HB2 ARG A 65 -7.829 9.612 -10.763 1.00 14.52 H new ATOM 0 HB3 ARG A 65 -7.713 8.581 -12.175 1.00 14.52 H new ATOM 0 HG2 ARG A 65 -8.411 6.632 -10.872 1.00 13.14 H new ATOM 0 HG3 ARG A 65 -8.389 7.568 -9.391 1.00 13.14 H new ATOM 0 HD2 ARG A 65 -10.241 8.913 -10.078 1.00 71.33 H new ATOM 0 HD3 ARG A 65 -10.101 8.403 -11.748 1.00 71.33 H new ATOM 0 HE ARG A 65 -10.612 6.029 -10.447 1.00 52.44 H new ATOM 0 HH11 ARG A 65 -12.126 9.221 -10.352 1.00 44.43 H new ATOM 0 HH12 ARG A 65 -13.746 8.571 -10.079 1.00 44.43 H new ATOM 0 HH21 ARG A 65 -12.687 5.198 -10.135 1.00 1.22 H new ATOM 0 HH22 ARG A 65 -14.063 6.291 -9.956 1.00 1.22 H new ATOM 1052 N TYR A 66 -4.594 8.099 -12.622 1.00 65.21 N ATOM 1053 CA TYR A 66 -3.752 8.586 -13.699 1.00 64.42 C ATOM 1054 C TYR A 66 -4.398 8.267 -15.035 1.00 10.14 C ATOM 1055 O TYR A 66 -5.098 7.268 -15.160 1.00 33.41 O ATOM 1056 CB TYR A 66 -2.331 8.006 -13.603 1.00 72.44 C ATOM 1057 CG TYR A 66 -2.254 6.575 -13.103 1.00 32.52 C ATOM 1058 CD1 TYR A 66 -2.232 6.296 -11.740 1.00 62.33 C ATOM 1059 CD2 TYR A 66 -2.185 5.508 -13.989 1.00 33.41 C ATOM 1060 CE1 TYR A 66 -2.149 4.997 -11.276 1.00 52.41 C ATOM 1061 CE2 TYR A 66 -2.099 4.205 -13.531 1.00 3.43 C ATOM 1062 CZ TYR A 66 -2.083 3.955 -12.176 1.00 53.45 C ATOM 1063 OH TYR A 66 -1.999 2.660 -11.719 1.00 22.33 O ATOM 0 H TYR A 66 -4.638 7.083 -12.543 1.00 65.21 H new ATOM 0 HA TYR A 66 -3.656 9.668 -13.610 1.00 64.42 H new ATOM 0 HB2 TYR A 66 -1.867 8.056 -14.588 1.00 72.44 H new ATOM 0 HB3 TYR A 66 -1.741 8.639 -12.940 1.00 72.44 H new ATOM 0 HD1 TYR A 66 -2.281 7.110 -11.032 1.00 62.33 H new ATOM 0 HD2 TYR A 66 -2.199 5.698 -15.052 1.00 33.41 H new ATOM 0 HE1 TYR A 66 -2.136 4.799 -10.214 1.00 52.41 H new ATOM 0 HE2 TYR A 66 -2.045 3.386 -14.233 1.00 3.43 H new ATOM 0 HH TYR A 66 -2.901 2.293 -11.608 1.00 22.33 H new ATOM 1073 N GLY A 67 -4.196 9.123 -16.023 1.00 32.41 N ATOM 1074 CA GLY A 67 -4.868 8.929 -17.288 1.00 3.23 C ATOM 1075 C GLY A 67 -3.992 9.221 -18.485 1.00 75.23 C ATOM 1076 O GLY A 67 -3.139 10.110 -18.439 1.00 53.11 O ATOM 0 H GLY A 67 -3.586 9.939 -15.973 1.00 32.41 H new ATOM 0 HA2 GLY A 67 -5.222 7.900 -17.349 1.00 3.23 H new ATOM 0 HA3 GLY A 67 -5.748 9.571 -17.326 1.00 3.23 H new ATOM 1080 N LEU A 68 -4.214 8.471 -19.558 1.00 45.21 N ATOM 1081 CA LEU A 68 -3.525 8.692 -20.821 1.00 34.44 C ATOM 1082 C LEU A 68 -4.470 9.452 -21.746 1.00 41.15 C ATOM 1083 O LEU A 68 -5.596 9.013 -21.985 1.00 43.15 O ATOM 1084 CB LEU A 68 -3.120 7.339 -21.439 1.00 42.13 C ATOM 1085 CG LEU A 68 -2.000 7.368 -22.492 1.00 42.34 C ATOM 1086 CD1 LEU A 68 -1.661 5.953 -22.928 1.00 21.43 C ATOM 1087 CD2 LEU A 68 -2.380 8.203 -23.705 1.00 20.32 C ATOM 0 H LEU A 68 -4.875 7.695 -19.576 1.00 45.21 H new ATOM 0 HA LEU A 68 -2.616 9.274 -20.668 1.00 34.44 H new ATOM 0 HB2 LEU A 68 -2.811 6.675 -20.632 1.00 42.13 H new ATOM 0 HB3 LEU A 68 -4.005 6.895 -21.895 1.00 42.13 H new ATOM 0 HG LEU A 68 -1.128 7.831 -22.030 1.00 42.34 H new ATOM 0 HD11 LEU A 68 -0.867 5.983 -23.674 1.00 21.43 H new ATOM 0 HD12 LEU A 68 -1.327 5.377 -22.065 1.00 21.43 H new ATOM 0 HD13 LEU A 68 -2.545 5.483 -23.358 1.00 21.43 H new ATOM 0 HD21 LEU A 68 -1.560 8.196 -24.423 1.00 20.32 H new ATOM 0 HD22 LEU A 68 -3.273 7.785 -24.170 1.00 20.32 H new ATOM 0 HD23 LEU A 68 -2.580 9.228 -23.393 1.00 20.32 H new ATOM 1099 N PHE A 69 -4.021 10.593 -22.240 1.00 13.33 N ATOM 1100 CA PHE A 69 -4.864 11.464 -23.044 1.00 1.42 C ATOM 1101 C PHE A 69 -4.191 11.799 -24.370 1.00 35.35 C ATOM 1102 O PHE A 69 -3.131 12.417 -24.381 1.00 41.22 O ATOM 1103 CB PHE A 69 -5.119 12.759 -22.272 1.00 24.24 C ATOM 1104 CG PHE A 69 -6.508 13.302 -22.417 1.00 44.11 C ATOM 1105 CD1 PHE A 69 -6.992 13.697 -23.653 1.00 3.31 C ATOM 1106 CD2 PHE A 69 -7.333 13.416 -21.311 1.00 12.11 C ATOM 1107 CE1 PHE A 69 -8.272 14.194 -23.783 1.00 14.30 C ATOM 1108 CE2 PHE A 69 -8.614 13.914 -21.434 1.00 55.34 C ATOM 1109 CZ PHE A 69 -9.084 14.303 -22.672 1.00 74.25 C ATOM 0 H PHE A 69 -3.072 10.940 -22.098 1.00 13.33 H new ATOM 0 HA PHE A 69 -5.803 10.950 -23.250 1.00 1.42 H new ATOM 0 HB2 PHE A 69 -4.919 12.583 -21.215 1.00 24.24 H new ATOM 0 HB3 PHE A 69 -4.409 13.515 -22.609 1.00 24.24 H new ATOM 0 HD1 PHE A 69 -6.360 13.615 -24.525 1.00 3.31 H new ATOM 0 HD2 PHE A 69 -6.970 13.112 -20.341 1.00 12.11 H new ATOM 0 HE1 PHE A 69 -8.638 14.497 -24.753 1.00 14.30 H new ATOM 0 HE2 PHE A 69 -9.247 13.999 -20.563 1.00 55.34 H new ATOM 0 HZ PHE A 69 -10.086 14.692 -22.771 1.00 74.25 H new ATOM 1119 N ASP A 70 -4.793 11.399 -25.480 1.00 55.44 N ATOM 1120 CA ASP A 70 -4.286 11.800 -26.788 1.00 34.24 C ATOM 1121 C ASP A 70 -5.254 12.765 -27.441 1.00 52.33 C ATOM 1122 O ASP A 70 -6.401 12.415 -27.729 1.00 22.41 O ATOM 1123 CB ASP A 70 -4.058 10.605 -27.719 1.00 73.00 C ATOM 1124 CG ASP A 70 -3.583 11.036 -29.103 1.00 30.22 C ATOM 1125 OD1 ASP A 70 -4.427 11.446 -29.929 1.00 31.12 O ATOM 1126 OD2 ASP A 70 -2.366 10.976 -29.369 1.00 73.21 O ATOM 0 H ASP A 70 -5.622 10.805 -25.505 1.00 55.44 H new ATOM 0 HA ASP A 70 -3.322 12.281 -26.624 1.00 34.24 H new ATOM 0 HB2 ASP A 70 -3.320 9.936 -27.275 1.00 73.00 H new ATOM 0 HB3 ASP A 70 -4.985 10.039 -27.815 1.00 73.00 H new ATOM 1131 N PHE A 71 -4.810 13.990 -27.638 1.00 4.12 N ATOM 1132 CA PHE A 71 -5.610 14.959 -28.355 1.00 11.10 C ATOM 1133 C PHE A 71 -4.748 15.787 -29.289 1.00 63.24 C ATOM 1134 O PHE A 71 -3.558 16.002 -29.039 1.00 0.24 O ATOM 1135 CB PHE A 71 -6.419 15.846 -27.401 1.00 51.12 C ATOM 1136 CG PHE A 71 -5.617 16.694 -26.452 1.00 3.21 C ATOM 1137 CD1 PHE A 71 -5.213 17.970 -26.814 1.00 21.12 C ATOM 1138 CD2 PHE A 71 -5.293 16.227 -25.189 1.00 61.51 C ATOM 1139 CE1 PHE A 71 -4.500 18.761 -25.934 1.00 44.14 C ATOM 1140 CE2 PHE A 71 -4.578 17.012 -24.306 1.00 55.10 C ATOM 1141 CZ PHE A 71 -4.181 18.282 -24.678 1.00 14.34 C ATOM 0 H PHE A 71 -3.907 14.335 -27.314 1.00 4.12 H new ATOM 0 HA PHE A 71 -6.329 14.409 -28.963 1.00 11.10 H new ATOM 0 HB2 PHE A 71 -7.053 16.502 -27.997 1.00 51.12 H new ATOM 0 HB3 PHE A 71 -7.081 15.208 -26.816 1.00 51.12 H new ATOM 0 HD1 PHE A 71 -5.458 18.350 -27.795 1.00 21.12 H new ATOM 0 HD2 PHE A 71 -5.603 15.236 -24.891 1.00 61.51 H new ATOM 0 HE1 PHE A 71 -4.192 19.754 -26.228 1.00 44.14 H new ATOM 0 HE2 PHE A 71 -4.329 16.633 -23.326 1.00 55.10 H new ATOM 0 HZ PHE A 71 -3.623 18.899 -23.989 1.00 14.34 H new ATOM 1151 N GLU A 72 -5.354 16.234 -30.373 1.00 20.10 N ATOM 1152 CA GLU A 72 -4.658 17.013 -31.374 1.00 33.02 C ATOM 1153 C GLU A 72 -4.767 18.497 -31.052 1.00 33.51 C ATOM 1154 O GLU A 72 -5.837 19.101 -31.145 1.00 13.54 O ATOM 1155 CB GLU A 72 -5.179 16.696 -32.793 1.00 73.32 C ATOM 1156 CG GLU A 72 -6.700 16.710 -32.955 1.00 55.34 C ATOM 1157 CD GLU A 72 -7.399 15.595 -32.199 1.00 5.41 C ATOM 1158 OE1 GLU A 72 -7.318 14.426 -32.626 1.00 61.42 O ATOM 1159 OE2 GLU A 72 -8.002 15.883 -31.147 1.00 73.44 O ATOM 0 H GLU A 72 -6.338 16.067 -30.582 1.00 20.10 H new ATOM 0 HA GLU A 72 -3.603 16.739 -31.356 1.00 33.02 H new ATOM 0 HB2 GLU A 72 -4.751 17.418 -33.488 1.00 73.32 H new ATOM 0 HB3 GLU A 72 -4.809 15.713 -33.086 1.00 73.32 H new ATOM 0 HG2 GLU A 72 -7.085 17.669 -32.610 1.00 55.34 H new ATOM 0 HG3 GLU A 72 -6.946 16.630 -34.014 1.00 55.34 H new ATOM 1166 N TYR A 73 -3.641 19.070 -30.662 1.00 32.25 N ATOM 1167 CA TYR A 73 -3.595 20.444 -30.195 1.00 31.42 C ATOM 1168 C TYR A 73 -2.688 21.263 -31.102 1.00 2.44 C ATOM 1169 O TYR A 73 -1.557 20.865 -31.382 1.00 23.14 O ATOM 1170 CB TYR A 73 -3.084 20.471 -28.752 1.00 73.30 C ATOM 1171 CG TYR A 73 -3.438 21.720 -27.974 1.00 3.10 C ATOM 1172 CD1 TYR A 73 -4.558 22.481 -28.295 1.00 63.32 C ATOM 1173 CD2 TYR A 73 -2.659 22.124 -26.901 1.00 21.22 C ATOM 1174 CE1 TYR A 73 -4.884 23.611 -27.566 1.00 32.30 C ATOM 1175 CE2 TYR A 73 -2.982 23.246 -26.167 1.00 61.21 C ATOM 1176 CZ TYR A 73 -4.093 23.987 -26.501 1.00 72.30 C ATOM 1177 OH TYR A 73 -4.413 25.106 -25.765 1.00 3.02 O ATOM 0 H TYR A 73 -2.737 18.598 -30.660 1.00 32.25 H new ATOM 0 HA TYR A 73 -4.594 20.879 -30.223 1.00 31.42 H new ATOM 0 HB2 TYR A 73 -3.485 19.606 -28.224 1.00 73.30 H new ATOM 0 HB3 TYR A 73 -1.999 20.363 -28.764 1.00 73.30 H new ATOM 0 HD1 TYR A 73 -5.182 22.185 -29.125 1.00 63.32 H new ATOM 0 HD2 TYR A 73 -1.784 21.550 -26.635 1.00 21.22 H new ATOM 0 HE1 TYR A 73 -5.753 24.195 -27.830 1.00 32.30 H new ATOM 0 HE2 TYR A 73 -2.365 23.543 -25.332 1.00 61.21 H new ATOM 0 HH TYR A 73 -3.599 25.618 -25.577 1.00 3.02 H new ATOM 1187 N MET A 74 -3.185 22.398 -31.567 1.00 74.12 N ATOM 1188 CA MET A 74 -2.432 23.229 -32.494 1.00 12.02 C ATOM 1189 C MET A 74 -1.755 24.386 -31.771 1.00 53.01 C ATOM 1190 O MET A 74 -2.309 24.958 -30.835 1.00 4.01 O ATOM 1191 CB MET A 74 -3.342 23.765 -33.607 1.00 42.33 C ATOM 1192 CG MET A 74 -4.515 24.591 -33.107 1.00 73.24 C ATOM 1193 SD MET A 74 -5.476 25.325 -34.454 1.00 23.50 S ATOM 1194 CE MET A 74 -5.939 23.865 -35.384 1.00 2.03 C ATOM 0 H MET A 74 -4.104 22.765 -31.319 1.00 74.12 H new ATOM 0 HA MET A 74 -1.659 22.605 -32.942 1.00 12.02 H new ATOM 0 HB2 MET A 74 -2.746 24.374 -34.287 1.00 42.33 H new ATOM 0 HB3 MET A 74 -3.724 22.924 -34.185 1.00 42.33 H new ATOM 0 HG2 MET A 74 -5.167 23.960 -32.503 1.00 73.24 H new ATOM 0 HG3 MET A 74 -4.145 25.383 -32.456 1.00 73.24 H new ATOM 0 HE1 MET A 74 -6.929 24.008 -35.817 1.00 2.03 H new ATOM 0 HE2 MET A 74 -5.215 23.697 -36.181 1.00 2.03 H new ATOM 0 HE3 MET A 74 -5.955 23.001 -34.720 1.00 2.03 H new ATOM 1204 N HIS A 75 -0.538 24.697 -32.191 1.00 11.20 N ATOM 1205 CA HIS A 75 0.186 25.855 -31.683 1.00 63.21 C ATOM 1206 C HIS A 75 0.826 26.611 -32.837 1.00 53.32 C ATOM 1207 O HIS A 75 1.322 26.002 -33.788 1.00 52.02 O ATOM 1208 CB HIS A 75 1.259 25.435 -30.673 1.00 13.24 C ATOM 1209 CG HIS A 75 0.874 25.672 -29.241 1.00 2.11 C ATOM 1210 ND1 HIS A 75 1.272 26.785 -28.533 1.00 2.05 N ATOM 1211 CD2 HIS A 75 0.131 24.932 -28.381 1.00 65.44 C ATOM 1212 CE1 HIS A 75 0.793 26.721 -27.304 1.00 3.12 C ATOM 1213 NE2 HIS A 75 0.099 25.607 -27.187 1.00 74.32 N ATOM 0 H HIS A 75 -0.026 24.158 -32.889 1.00 11.20 H new ATOM 0 HA HIS A 75 -0.524 26.506 -31.173 1.00 63.21 H new ATOM 0 HB2 HIS A 75 1.478 24.376 -30.810 1.00 13.24 H new ATOM 0 HB3 HIS A 75 2.178 25.980 -30.887 1.00 13.24 H new ATOM 0 HD2 HIS A 75 -0.346 23.987 -28.596 1.00 65.44 H new ATOM 0 HE1 HIS A 75 0.944 27.456 -26.527 1.00 3.12 H new ATOM 0 HE2 HIS A 75 -0.384 25.296 -26.344 1.00 74.32 H new ATOM 1222 N GLN A 76 0.780 27.931 -32.771 1.00 61.22 N ATOM 1223 CA GLN A 76 1.389 28.769 -33.787 1.00 4.22 C ATOM 1224 C GLN A 76 2.872 28.934 -33.490 1.00 44.14 C ATOM 1225 O GLN A 76 3.242 29.535 -32.485 1.00 72.31 O ATOM 1226 CB GLN A 76 0.717 30.147 -33.834 1.00 1.45 C ATOM 1227 CG GLN A 76 -0.804 30.107 -33.891 1.00 53.25 C ATOM 1228 CD GLN A 76 -1.451 30.103 -32.516 1.00 21.41 C ATOM 1229 OE1 GLN A 76 -0.884 29.606 -31.542 1.00 2.03 O ATOM 1230 NE2 GLN A 76 -2.648 30.658 -32.432 1.00 55.35 N ATOM 0 H GLN A 76 0.324 28.447 -32.019 1.00 61.22 H new ATOM 0 HA GLN A 76 1.258 28.288 -34.756 1.00 4.22 H new ATOM 0 HB2 GLN A 76 1.020 30.715 -32.954 1.00 1.45 H new ATOM 0 HB3 GLN A 76 1.086 30.688 -34.705 1.00 1.45 H new ATOM 0 HG2 GLN A 76 -1.164 30.969 -34.453 1.00 53.25 H new ATOM 0 HG3 GLN A 76 -1.118 29.217 -34.437 1.00 53.25 H new ATOM 0 HE21 GLN A 76 -3.084 31.059 -33.263 1.00 55.35 H new ATOM 0 HE22 GLN A 76 -3.136 30.685 -31.537 1.00 55.35 H new ATOM 1239 N CYS A 77 3.713 28.406 -34.361 1.00 23.21 N ATOM 1240 CA CYS A 77 5.149 28.455 -34.151 1.00 2.05 C ATOM 1241 C CYS A 77 5.761 29.663 -34.847 1.00 74.32 C ATOM 1242 O CYS A 77 5.320 30.053 -35.934 1.00 33.20 O ATOM 1243 CB CYS A 77 5.796 27.163 -34.658 1.00 10.41 C ATOM 1244 SG CYS A 77 5.384 26.754 -36.374 1.00 22.25 S ATOM 0 H CYS A 77 3.426 27.938 -35.221 1.00 23.21 H new ATOM 0 HA CYS A 77 5.337 28.551 -33.082 1.00 2.05 H new ATOM 0 HB2 CYS A 77 6.879 27.251 -34.567 1.00 10.41 H new ATOM 0 HB3 CYS A 77 5.488 26.338 -34.015 1.00 10.41 H new ATOM 0 HG CYS A 77 5.979 25.648 -36.711 1.00 22.25 H new ATOM 1250 N GLN A 78 6.756 30.264 -34.195 1.00 25.43 N ATOM 1251 CA GLN A 78 7.502 31.394 -34.746 1.00 43.24 C ATOM 1252 C GLN A 78 6.605 32.635 -34.846 1.00 50.34 C ATOM 1253 O GLN A 78 6.838 33.539 -35.649 1.00 73.01 O ATOM 1254 CB GLN A 78 8.099 31.008 -36.106 1.00 73.33 C ATOM 1255 CG GLN A 78 9.133 31.979 -36.646 1.00 63.15 C ATOM 1256 CD GLN A 78 9.720 31.510 -37.962 1.00 41.30 C ATOM 1257 OE1 GLN A 78 9.061 30.808 -38.729 1.00 72.22 O ATOM 1258 NE2 GLN A 78 10.958 31.888 -38.233 1.00 33.32 N ATOM 0 H GLN A 78 7.068 29.979 -33.267 1.00 25.43 H new ATOM 0 HA GLN A 78 8.325 31.645 -34.077 1.00 43.24 H new ATOM 0 HB2 GLN A 78 8.557 30.023 -36.019 1.00 73.33 H new ATOM 0 HB3 GLN A 78 7.290 30.921 -36.831 1.00 73.33 H new ATOM 0 HG2 GLN A 78 8.674 32.958 -36.782 1.00 63.15 H new ATOM 0 HG3 GLN A 78 9.933 32.101 -35.915 1.00 63.15 H new ATOM 0 HE21 GLN A 78 11.470 32.470 -37.570 1.00 33.32 H new ATOM 0 HE22 GLN A 78 11.401 31.597 -39.105 1.00 33.32 H new ATOM 1267 N GLY A 79 5.580 32.673 -34.003 1.00 13.12 N ATOM 1268 CA GLY A 79 4.719 33.839 -33.912 1.00 70.14 C ATOM 1269 C GLY A 79 3.570 33.836 -34.906 1.00 5.52 C ATOM 1270 O GLY A 79 2.466 34.274 -34.580 1.00 72.02 O ATOM 0 H GLY A 79 5.328 31.910 -33.375 1.00 13.12 H new ATOM 0 HA2 GLY A 79 4.313 33.900 -32.902 1.00 70.14 H new ATOM 0 HA3 GLY A 79 5.320 34.735 -34.069 1.00 70.14 H new ATOM 1274 N THR A 80 3.809 33.335 -36.109 1.00 1.30 N ATOM 1275 CA THR A 80 2.786 33.338 -37.147 1.00 23.32 C ATOM 1276 C THR A 80 1.825 32.167 -36.959 1.00 13.20 C ATOM 1277 O THR A 80 2.232 31.080 -36.540 1.00 3.44 O ATOM 1278 CB THR A 80 3.422 33.278 -38.549 1.00 43.54 C ATOM 1279 OG1 THR A 80 4.467 34.257 -38.645 1.00 54.11 O ATOM 1280 CG2 THR A 80 2.390 33.536 -39.639 1.00 74.14 C ATOM 0 H THR A 80 4.698 32.923 -36.391 1.00 1.30 H new ATOM 0 HA THR A 80 2.227 34.270 -37.061 1.00 23.32 H new ATOM 0 HB THR A 80 3.829 32.277 -38.692 1.00 43.54 H new ATOM 0 HG1 THR A 80 4.872 34.217 -39.536 1.00 54.11 H new ATOM 0 HG21 THR A 80 2.872 33.486 -40.615 1.00 74.14 H new ATOM 0 HG22 THR A 80 1.605 32.782 -39.583 1.00 74.14 H new ATOM 0 HG23 THR A 80 1.953 34.525 -39.500 1.00 74.14 H new ATOM 1288 N SER A 81 0.550 32.398 -37.254 1.00 41.22 N ATOM 1289 CA SER A 81 -0.481 31.391 -37.058 1.00 65.21 C ATOM 1290 C SER A 81 -0.385 30.256 -38.079 1.00 63.12 C ATOM 1291 O SER A 81 -1.163 30.194 -39.033 1.00 50.43 O ATOM 1292 CB SER A 81 -1.867 32.038 -37.110 1.00 3.21 C ATOM 1293 OG SER A 81 -1.993 33.042 -36.117 1.00 3.22 O ATOM 0 H SER A 81 0.207 33.281 -37.632 1.00 41.22 H new ATOM 0 HA SER A 81 -0.323 30.952 -36.073 1.00 65.21 H new ATOM 0 HB2 SER A 81 -2.033 32.473 -38.096 1.00 3.21 H new ATOM 0 HB3 SER A 81 -2.634 31.277 -36.963 1.00 3.21 H new ATOM 0 HG SER A 81 -2.885 33.443 -36.169 1.00 3.22 H new ATOM 1299 N GLU A 82 0.597 29.383 -37.891 1.00 65.34 N ATOM 1300 CA GLU A 82 0.679 28.147 -38.655 1.00 3.44 C ATOM 1301 C GLU A 82 -0.292 27.143 -38.063 1.00 33.52 C ATOM 1302 O GLU A 82 -0.939 26.378 -38.779 1.00 14.35 O ATOM 1303 CB GLU A 82 2.098 27.571 -38.604 1.00 72.14 C ATOM 1304 CG GLU A 82 3.166 28.520 -39.111 1.00 74.35 C ATOM 1305 CD GLU A 82 2.959 28.913 -40.557 1.00 65.44 C ATOM 1306 OE1 GLU A 82 3.374 28.154 -41.453 1.00 10.33 O ATOM 1307 OE2 GLU A 82 2.409 30.004 -40.805 1.00 41.25 O ATOM 0 H GLU A 82 1.349 29.510 -37.214 1.00 65.34 H new ATOM 0 HA GLU A 82 0.427 28.354 -39.695 1.00 3.44 H new ATOM 0 HB2 GLU A 82 2.330 27.295 -37.576 1.00 72.14 H new ATOM 0 HB3 GLU A 82 2.129 26.656 -39.195 1.00 72.14 H new ATOM 0 HG2 GLU A 82 3.172 29.417 -38.492 1.00 74.35 H new ATOM 0 HG3 GLU A 82 4.144 28.051 -39.003 1.00 74.35 H new ATOM 1314 N SER A 83 -0.385 27.179 -36.735 1.00 2.34 N ATOM 1315 CA SER A 83 -1.261 26.293 -35.984 1.00 54.22 C ATOM 1316 C SER A 83 -0.943 24.831 -36.292 1.00 51.22 C ATOM 1317 O SER A 83 -1.703 24.148 -36.981 1.00 70.34 O ATOM 1318 CB SER A 83 -2.724 26.609 -36.293 1.00 13.43 C ATOM 1319 OG SER A 83 -2.993 27.991 -36.116 1.00 2.55 O ATOM 0 H SER A 83 0.147 27.825 -36.152 1.00 2.34 H new ATOM 0 HA SER A 83 -1.091 26.456 -34.920 1.00 54.22 H new ATOM 0 HB2 SER A 83 -2.954 26.318 -37.318 1.00 13.43 H new ATOM 0 HB3 SER A 83 -3.372 26.022 -35.642 1.00 13.43 H new ATOM 0 HG SER A 83 -3.934 28.170 -36.321 1.00 2.55 H new ATOM 1325 N SER A 84 0.200 24.371 -35.799 1.00 35.33 N ATOM 1326 CA SER A 84 0.623 22.995 -35.999 1.00 43.20 C ATOM 1327 C SER A 84 -0.257 22.053 -35.187 1.00 24.00 C ATOM 1328 O SER A 84 0.000 21.803 -34.007 1.00 72.12 O ATOM 1329 CB SER A 84 2.092 22.832 -35.599 1.00 41.45 C ATOM 1330 OG SER A 84 2.916 23.760 -36.290 1.00 35.31 O ATOM 0 H SER A 84 0.852 24.936 -35.255 1.00 35.33 H new ATOM 0 HA SER A 84 0.520 22.744 -37.055 1.00 43.20 H new ATOM 0 HB2 SER A 84 2.198 22.977 -34.524 1.00 41.45 H new ATOM 0 HB3 SER A 84 2.421 21.816 -35.817 1.00 41.45 H new ATOM 0 HG SER A 84 3.849 23.637 -36.016 1.00 35.31 H new ATOM 1336 N LYS A 85 -1.325 21.579 -35.809 1.00 73.43 N ATOM 1337 CA LYS A 85 -2.264 20.698 -35.159 1.00 14.23 C ATOM 1338 C LYS A 85 -1.753 19.265 -35.175 1.00 4.34 C ATOM 1339 O LYS A 85 -1.901 18.553 -36.165 1.00 44.42 O ATOM 1340 CB LYS A 85 -3.614 20.785 -35.861 1.00 4.12 C ATOM 1341 CG LYS A 85 -4.712 20.018 -35.161 1.00 55.22 C ATOM 1342 CD LYS A 85 -6.017 20.127 -35.920 1.00 51.14 C ATOM 1343 CE LYS A 85 -7.134 19.437 -35.172 1.00 64.31 C ATOM 1344 NZ LYS A 85 -8.419 19.485 -35.916 1.00 31.20 N ATOM 0 H LYS A 85 -1.559 21.798 -36.777 1.00 73.43 H new ATOM 0 HA LYS A 85 -2.378 21.007 -34.120 1.00 14.23 H new ATOM 0 HB2 LYS A 85 -3.907 21.832 -35.939 1.00 4.12 H new ATOM 0 HB3 LYS A 85 -3.510 20.407 -36.878 1.00 4.12 H new ATOM 0 HG2 LYS A 85 -4.427 18.970 -35.069 1.00 55.22 H new ATOM 0 HG3 LYS A 85 -4.842 20.403 -34.150 1.00 55.22 H new ATOM 0 HD2 LYS A 85 -6.269 21.177 -36.070 1.00 51.14 H new ATOM 0 HD3 LYS A 85 -5.906 19.681 -36.908 1.00 51.14 H new ATOM 0 HE2 LYS A 85 -6.860 18.398 -34.990 1.00 64.31 H new ATOM 0 HE3 LYS A 85 -7.262 19.908 -34.198 1.00 64.31 H new ATOM 0 HZ1 LYS A 85 -9.157 19.000 -35.366 1.00 31.20 H new ATOM 0 HZ2 LYS A 85 -8.695 20.476 -36.068 1.00 31.20 H new ATOM 0 HZ3 LYS A 85 -8.306 19.013 -36.836 1.00 31.20 H new ATOM 1358 N LYS A 86 -1.125 18.864 -34.084 1.00 61.43 N ATOM 1359 CA LYS A 86 -0.627 17.508 -33.946 1.00 72.20 C ATOM 1360 C LYS A 86 -1.232 16.870 -32.715 1.00 52.34 C ATOM 1361 O LYS A 86 -1.518 17.560 -31.738 1.00 33.24 O ATOM 1362 CB LYS A 86 0.903 17.493 -33.847 1.00 23.45 C ATOM 1363 CG LYS A 86 1.601 18.085 -35.062 1.00 11.52 C ATOM 1364 CD LYS A 86 3.103 17.835 -35.026 1.00 42.50 C ATOM 1365 CE LYS A 86 3.416 16.347 -35.060 1.00 40.40 C ATOM 1366 NZ LYS A 86 4.875 16.079 -35.127 1.00 11.12 N ATOM 0 H LYS A 86 -0.947 19.462 -33.277 1.00 61.43 H new ATOM 0 HA LYS A 86 -0.915 16.940 -34.831 1.00 72.20 H new ATOM 0 HB2 LYS A 86 1.206 18.048 -32.959 1.00 23.45 H new ATOM 0 HB3 LYS A 86 1.239 16.465 -33.711 1.00 23.45 H new ATOM 0 HG2 LYS A 86 1.182 17.651 -35.970 1.00 11.52 H new ATOM 0 HG3 LYS A 86 1.411 19.158 -35.104 1.00 11.52 H new ATOM 0 HD2 LYS A 86 3.576 18.328 -35.875 1.00 42.50 H new ATOM 0 HD3 LYS A 86 3.526 18.277 -34.124 1.00 42.50 H new ATOM 0 HE2 LYS A 86 3.002 15.871 -34.171 1.00 40.40 H new ATOM 0 HE3 LYS A 86 2.926 15.895 -35.922 1.00 40.40 H new ATOM 0 HZ1 LYS A 86 5.039 15.052 -35.148 1.00 11.12 H new ATOM 0 HZ2 LYS A 86 5.268 16.510 -35.988 1.00 11.12 H new ATOM 0 HZ3 LYS A 86 5.342 16.487 -34.292 1.00 11.12 H new ATOM 1380 N GLN A 87 -1.456 15.569 -32.764 1.00 43.25 N ATOM 1381 CA GLN A 87 -1.926 14.859 -31.592 1.00 21.15 C ATOM 1382 C GLN A 87 -0.751 14.485 -30.706 1.00 25.21 C ATOM 1383 O GLN A 87 0.296 14.051 -31.185 1.00 24.51 O ATOM 1384 CB GLN A 87 -2.771 13.624 -31.958 1.00 55.35 C ATOM 1385 CG GLN A 87 -2.370 12.886 -33.235 1.00 24.03 C ATOM 1386 CD GLN A 87 -0.940 12.380 -33.235 1.00 2.21 C ATOM 1387 OE1 GLN A 87 -0.038 13.038 -33.756 1.00 62.13 O ATOM 1388 NE2 GLN A 87 -0.719 11.229 -32.620 1.00 54.24 N ATOM 0 H GLN A 87 -1.322 14.990 -33.593 1.00 43.25 H new ATOM 0 HA GLN A 87 -2.585 15.527 -31.037 1.00 21.15 H new ATOM 0 HB2 GLN A 87 -2.726 12.920 -31.127 1.00 55.35 H new ATOM 0 HB3 GLN A 87 -3.811 13.937 -32.055 1.00 55.35 H new ATOM 0 HG2 GLN A 87 -3.043 12.041 -33.380 1.00 24.03 H new ATOM 0 HG3 GLN A 87 -2.508 13.553 -34.086 1.00 24.03 H new ATOM 0 HE21 GLN A 87 -1.496 10.717 -32.202 1.00 54.24 H new ATOM 0 HE22 GLN A 87 0.228 10.854 -32.564 1.00 54.24 H new ATOM 1397 N LYS A 88 -0.898 14.713 -29.419 1.00 25.11 N ATOM 1398 CA LYS A 88 0.156 14.392 -28.483 1.00 55.04 C ATOM 1399 C LYS A 88 -0.435 13.672 -27.288 1.00 53.14 C ATOM 1400 O LYS A 88 -1.375 14.163 -26.663 1.00 32.12 O ATOM 1401 CB LYS A 88 0.895 15.656 -28.016 1.00 72.22 C ATOM 1402 CG LYS A 88 1.235 16.645 -29.127 1.00 20.35 C ATOM 1403 CD LYS A 88 0.216 17.773 -29.198 1.00 51.22 C ATOM 1404 CE LYS A 88 0.709 18.921 -30.067 1.00 3.12 C ATOM 1405 NZ LYS A 88 1.794 19.696 -29.407 1.00 64.40 N ATOM 0 H LYS A 88 -1.734 15.118 -28.998 1.00 25.11 H new ATOM 0 HA LYS A 88 0.878 13.748 -28.986 1.00 55.04 H new ATOM 0 HB2 LYS A 88 0.282 16.164 -27.271 1.00 72.22 H new ATOM 0 HB3 LYS A 88 1.818 15.358 -27.519 1.00 72.22 H new ATOM 0 HG2 LYS A 88 2.228 17.060 -28.955 1.00 20.35 H new ATOM 0 HG3 LYS A 88 1.269 16.123 -30.083 1.00 20.35 H new ATOM 0 HD2 LYS A 88 -0.723 17.391 -29.598 1.00 51.22 H new ATOM 0 HD3 LYS A 88 0.008 18.140 -28.193 1.00 51.22 H new ATOM 0 HE2 LYS A 88 1.071 18.527 -31.016 1.00 3.12 H new ATOM 0 HE3 LYS A 88 -0.124 19.586 -30.295 1.00 3.12 H new ATOM 0 HZ1 LYS A 88 2.169 20.403 -30.071 1.00 64.40 H new ATOM 0 HZ2 LYS A 88 1.415 20.178 -28.567 1.00 64.40 H new ATOM 0 HZ3 LYS A 88 2.557 19.050 -29.121 1.00 64.40 H new ATOM 1419 N LEU A 89 0.101 12.502 -26.987 1.00 42.14 N ATOM 1420 CA LEU A 89 -0.361 11.738 -25.845 1.00 61.24 C ATOM 1421 C LEU A 89 0.241 12.303 -24.570 1.00 34.34 C ATOM 1422 O LEU A 89 1.465 12.315 -24.395 1.00 72.11 O ATOM 1423 CB LEU A 89 0.002 10.254 -25.966 1.00 62.24 C ATOM 1424 CG LEU A 89 -0.464 9.537 -27.238 1.00 44.34 C ATOM 1425 CD1 LEU A 89 0.454 9.853 -28.413 1.00 62.44 C ATOM 1426 CD2 LEU A 89 -0.529 8.035 -27.004 1.00 15.22 C ATOM 0 H LEU A 89 0.854 12.063 -27.516 1.00 42.14 H new ATOM 0 HA LEU A 89 -1.448 11.817 -25.814 1.00 61.24 H new ATOM 0 HB2 LEU A 89 1.086 10.162 -25.900 1.00 62.24 H new ATOM 0 HB3 LEU A 89 -0.415 9.730 -25.106 1.00 62.24 H new ATOM 0 HG LEU A 89 -1.463 9.898 -27.484 1.00 44.34 H new ATOM 0 HD11 LEU A 89 0.100 9.331 -29.302 1.00 62.44 H new ATOM 0 HD12 LEU A 89 0.452 10.927 -28.598 1.00 62.44 H new ATOM 0 HD13 LEU A 89 1.468 9.527 -28.181 1.00 62.44 H new ATOM 0 HD21 LEU A 89 -0.861 7.539 -27.916 1.00 15.22 H new ATOM 0 HD22 LEU A 89 0.459 7.666 -26.730 1.00 15.22 H new ATOM 0 HD23 LEU A 89 -1.232 7.822 -26.198 1.00 15.22 H new ATOM 1438 N PHE A 90 -0.619 12.785 -23.699 1.00 11.32 N ATOM 1439 CA PHE A 90 -0.198 13.319 -22.424 1.00 21.04 C ATOM 1440 C PHE A 90 -0.653 12.401 -21.302 1.00 14.22 C ATOM 1441 O PHE A 90 -1.794 11.941 -21.280 1.00 21.50 O ATOM 1442 CB PHE A 90 -0.761 14.727 -22.218 1.00 4.20 C ATOM 1443 CG PHE A 90 -0.356 15.694 -23.295 1.00 63.51 C ATOM 1444 CD1 PHE A 90 0.974 16.026 -23.479 1.00 50.11 C ATOM 1445 CD2 PHE A 90 -1.306 16.269 -24.120 1.00 15.15 C ATOM 1446 CE1 PHE A 90 1.352 16.915 -24.466 1.00 53.01 C ATOM 1447 CE2 PHE A 90 -0.936 17.160 -25.109 1.00 32.51 C ATOM 1448 CZ PHE A 90 0.395 17.483 -25.282 1.00 32.31 C ATOM 0 H PHE A 90 -1.626 12.817 -23.855 1.00 11.32 H new ATOM 0 HA PHE A 90 0.890 13.380 -22.413 1.00 21.04 H new ATOM 0 HB2 PHE A 90 -1.849 14.673 -22.178 1.00 4.20 H new ATOM 0 HB3 PHE A 90 -0.425 15.107 -21.253 1.00 4.20 H new ATOM 0 HD1 PHE A 90 1.727 15.584 -22.843 1.00 50.11 H new ATOM 0 HD2 PHE A 90 -2.348 16.019 -23.990 1.00 15.15 H new ATOM 0 HE1 PHE A 90 2.394 17.165 -24.599 1.00 53.01 H new ATOM 0 HE2 PHE A 90 -1.687 17.603 -25.746 1.00 32.51 H new ATOM 0 HZ PHE A 90 0.687 18.179 -26.055 1.00 32.31 H new ATOM 1458 N LEU A 91 0.257 12.116 -20.398 1.00 10.25 N ATOM 1459 CA LEU A 91 -0.037 11.321 -19.226 1.00 62.53 C ATOM 1460 C LEU A 91 -0.002 12.212 -18.000 1.00 52.54 C ATOM 1461 O LEU A 91 1.036 12.792 -17.669 1.00 63.34 O ATOM 1462 CB LEU A 91 0.992 10.195 -19.088 1.00 51.34 C ATOM 1463 CG LEU A 91 0.966 9.428 -17.764 1.00 35.51 C ATOM 1464 CD1 LEU A 91 -0.296 8.587 -17.644 1.00 23.51 C ATOM 1465 CD2 LEU A 91 2.207 8.561 -17.641 1.00 64.42 C ATOM 0 H LEU A 91 1.226 12.430 -20.455 1.00 10.25 H new ATOM 0 HA LEU A 91 -1.028 10.877 -19.324 1.00 62.53 H new ATOM 0 HB2 LEU A 91 0.837 9.485 -19.901 1.00 51.34 H new ATOM 0 HB3 LEU A 91 1.987 10.619 -19.221 1.00 51.34 H new ATOM 0 HG LEU A 91 0.961 10.149 -16.947 1.00 35.51 H new ATOM 0 HD11 LEU A 91 -0.288 8.053 -16.694 1.00 23.51 H new ATOM 0 HD12 LEU A 91 -1.171 9.235 -17.689 1.00 23.51 H new ATOM 0 HD13 LEU A 91 -0.334 7.869 -18.463 1.00 23.51 H new ATOM 0 HD21 LEU A 91 2.180 8.019 -16.696 1.00 64.42 H new ATOM 0 HD22 LEU A 91 2.237 7.850 -18.466 1.00 64.42 H new ATOM 0 HD23 LEU A 91 3.096 9.191 -17.672 1.00 64.42 H new ATOM 1477 N MET A 92 -1.129 12.332 -17.330 1.00 43.21 N ATOM 1478 CA MET A 92 -1.192 13.132 -16.126 1.00 32.43 C ATOM 1479 C MET A 92 -1.715 12.305 -14.970 1.00 33.40 C ATOM 1480 O MET A 92 -2.798 11.722 -15.037 1.00 12.13 O ATOM 1481 CB MET A 92 -2.030 14.402 -16.332 1.00 23.03 C ATOM 1482 CG MET A 92 -3.459 14.157 -16.785 1.00 72.03 C ATOM 1483 SD MET A 92 -4.376 15.696 -16.982 1.00 61.22 S ATOM 1484 CE MET A 92 -5.971 15.082 -17.521 1.00 20.32 C ATOM 0 H MET A 92 -2.008 11.889 -17.597 1.00 43.21 H new ATOM 0 HA MET A 92 -0.180 13.457 -15.884 1.00 32.43 H new ATOM 0 HB2 MET A 92 -2.051 14.962 -15.397 1.00 23.03 H new ATOM 0 HB3 MET A 92 -1.533 15.032 -17.070 1.00 23.03 H new ATOM 0 HG2 MET A 92 -3.452 13.615 -17.731 1.00 72.03 H new ATOM 0 HG3 MET A 92 -3.966 13.523 -16.058 1.00 72.03 H new ATOM 0 HE1 MET A 92 -6.648 15.921 -17.684 1.00 20.32 H new ATOM 0 HE2 MET A 92 -5.852 14.526 -18.451 1.00 20.32 H new ATOM 0 HE3 MET A 92 -6.385 14.425 -16.756 1.00 20.32 H new ATOM 1494 N SER A 93 -0.915 12.229 -13.923 1.00 52.55 N ATOM 1495 CA SER A 93 -1.273 11.458 -12.754 1.00 13.00 C ATOM 1496 C SER A 93 -2.061 12.313 -11.774 1.00 50.31 C ATOM 1497 O SER A 93 -1.484 13.051 -10.980 1.00 61.40 O ATOM 1498 CB SER A 93 -0.028 10.885 -12.082 1.00 34.25 C ATOM 1499 OG SER A 93 -0.386 9.956 -11.080 1.00 21.22 O ATOM 0 H SER A 93 -0.010 12.695 -13.861 1.00 52.55 H new ATOM 0 HA SER A 93 -1.902 10.627 -13.072 1.00 13.00 H new ATOM 0 HB2 SER A 93 0.603 10.400 -12.827 1.00 34.25 H new ATOM 0 HB3 SER A 93 0.559 11.692 -11.644 1.00 34.25 H new ATOM 0 HG SER A 93 -0.561 10.431 -10.241 1.00 21.22 H new ATOM 1505 N TRP A 94 -3.376 12.205 -11.829 1.00 32.12 N ATOM 1506 CA TRP A 94 -4.239 13.004 -10.979 1.00 43.23 C ATOM 1507 C TRP A 94 -4.302 12.391 -9.591 1.00 61.24 C ATOM 1508 O TRP A 94 -4.903 11.342 -9.384 1.00 42.44 O ATOM 1509 CB TRP A 94 -5.645 13.105 -11.578 1.00 15.33 C ATOM 1510 CG TRP A 94 -6.587 13.915 -10.742 1.00 51.22 C ATOM 1511 CD1 TRP A 94 -6.592 15.271 -10.589 1.00 33.11 C ATOM 1512 CD2 TRP A 94 -7.659 13.413 -9.939 1.00 24.05 C ATOM 1513 NE1 TRP A 94 -7.600 15.642 -9.733 1.00 31.20 N ATOM 1514 CE2 TRP A 94 -8.270 14.520 -9.321 1.00 1.32 C ATOM 1515 CE3 TRP A 94 -8.162 12.135 -9.679 1.00 24.04 C ATOM 1516 CZ2 TRP A 94 -9.358 14.386 -8.465 1.00 32.03 C ATOM 1517 CZ3 TRP A 94 -9.241 12.004 -8.828 1.00 2.30 C ATOM 1518 CH2 TRP A 94 -9.828 13.125 -8.230 1.00 23.23 C ATOM 0 H TRP A 94 -3.871 11.570 -12.455 1.00 32.12 H new ATOM 0 HA TRP A 94 -3.826 14.010 -10.908 1.00 43.23 H new ATOM 0 HB2 TRP A 94 -5.578 13.549 -12.571 1.00 15.33 H new ATOM 0 HB3 TRP A 94 -6.052 12.102 -11.703 1.00 15.33 H new ATOM 0 HD1 TRP A 94 -5.905 15.952 -11.070 1.00 33.11 H new ATOM 0 HE1 TRP A 94 -7.815 16.598 -9.450 1.00 31.20 H new ATOM 0 HE3 TRP A 94 -7.714 11.265 -10.136 1.00 24.04 H new ATOM 0 HZ2 TRP A 94 -9.815 15.248 -8.002 1.00 32.03 H new ATOM 0 HZ3 TRP A 94 -9.638 11.021 -8.620 1.00 2.30 H new ATOM 0 HH2 TRP A 94 -10.671 12.990 -7.568 1.00 23.23 H new ATOM 1529 N CYS A 95 -3.655 13.044 -8.649 1.00 13.02 N ATOM 1530 CA CYS A 95 -3.560 12.534 -7.296 1.00 34.24 C ATOM 1531 C CYS A 95 -3.064 13.616 -6.354 1.00 14.44 C ATOM 1532 O CYS A 95 -1.865 13.890 -6.283 1.00 23.31 O ATOM 1533 CB CYS A 95 -2.629 11.320 -7.259 1.00 31.15 C ATOM 1534 SG CYS A 95 -1.146 11.507 -8.274 1.00 74.21 S ATOM 0 H CYS A 95 -3.183 13.936 -8.797 1.00 13.02 H new ATOM 0 HA CYS A 95 -4.552 12.224 -6.966 1.00 34.24 H new ATOM 0 HB2 CYS A 95 -2.331 11.134 -6.227 1.00 31.15 H new ATOM 0 HB3 CYS A 95 -3.180 10.441 -7.595 1.00 31.15 H new ATOM 0 HG CYS A 95 -1.437 12.181 -9.347 1.00 74.21 H new ATOM 1540 N PRO A 96 -3.990 14.285 -5.658 1.00 13.31 N ATOM 1541 CA PRO A 96 -3.649 15.293 -4.659 1.00 53.12 C ATOM 1542 C PRO A 96 -2.746 14.737 -3.568 1.00 31.20 C ATOM 1543 O PRO A 96 -3.139 13.858 -2.802 1.00 74.11 O ATOM 1544 CB PRO A 96 -5.007 15.704 -4.088 1.00 23.42 C ATOM 1545 CG PRO A 96 -5.954 15.415 -5.193 1.00 1.22 C ATOM 1546 CD PRO A 96 -5.450 14.143 -5.809 1.00 31.33 C ATOM 0 HA PRO A 96 -3.091 16.125 -5.088 1.00 53.12 H new ATOM 0 HB2 PRO A 96 -5.253 15.136 -3.191 1.00 23.42 H new ATOM 0 HB3 PRO A 96 -5.023 16.758 -3.812 1.00 23.42 H new ATOM 0 HG2 PRO A 96 -6.972 15.298 -4.821 1.00 1.22 H new ATOM 0 HG3 PRO A 96 -5.972 16.226 -5.921 1.00 1.22 H new ATOM 0 HD2 PRO A 96 -5.830 13.261 -5.292 1.00 31.33 H new ATOM 0 HD3 PRO A 96 -5.745 14.051 -6.854 1.00 31.33 H new ATOM 1554 N ASP A 97 -1.520 15.240 -3.530 1.00 23.12 N ATOM 1555 CA ASP A 97 -0.550 14.862 -2.509 1.00 71.43 C ATOM 1556 C ASP A 97 -1.108 15.140 -1.117 1.00 73.31 C ATOM 1557 O ASP A 97 -0.826 14.426 -0.159 1.00 51.31 O ATOM 1558 CB ASP A 97 0.749 15.644 -2.724 1.00 24.15 C ATOM 1559 CG ASP A 97 1.810 15.323 -1.692 1.00 64.41 C ATOM 1560 OD1 ASP A 97 2.602 14.386 -1.917 1.00 21.33 O ATOM 1561 OD2 ASP A 97 1.862 16.011 -0.651 1.00 71.43 O ATOM 0 H ASP A 97 -1.169 15.920 -4.204 1.00 23.12 H new ATOM 0 HA ASP A 97 -0.345 13.794 -2.590 1.00 71.43 H new ATOM 0 HB2 ASP A 97 1.139 15.425 -3.718 1.00 24.15 H new ATOM 0 HB3 ASP A 97 0.533 16.712 -2.695 1.00 24.15 H new ATOM 1566 N THR A 98 -1.947 16.157 -1.037 1.00 63.14 N ATOM 1567 CA THR A 98 -2.529 16.607 0.216 1.00 42.24 C ATOM 1568 C THR A 98 -3.661 15.691 0.708 1.00 22.43 C ATOM 1569 O THR A 98 -4.457 16.091 1.559 1.00 64.42 O ATOM 1570 CB THR A 98 -3.065 18.038 0.050 1.00 11.20 C ATOM 1571 OG1 THR A 98 -3.830 18.130 -1.159 1.00 20.25 O ATOM 1572 CG2 THR A 98 -1.925 19.043 0.009 1.00 21.03 C ATOM 0 H THR A 98 -2.247 16.699 -1.847 1.00 63.14 H new ATOM 0 HA THR A 98 -1.739 16.578 0.966 1.00 42.24 H new ATOM 0 HB THR A 98 -3.699 18.269 0.906 1.00 11.20 H new ATOM 0 HG1 THR A 98 -4.172 19.043 -1.261 1.00 20.25 H new ATOM 0 HG21 THR A 98 -2.330 20.048 -0.109 1.00 21.03 H new ATOM 0 HG22 THR A 98 -1.357 18.987 0.938 1.00 21.03 H new ATOM 0 HG23 THR A 98 -1.269 18.815 -0.831 1.00 21.03 H new ATOM 1580 N ALA A 99 -3.730 14.467 0.184 1.00 35.12 N ATOM 1581 CA ALA A 99 -4.823 13.563 0.526 1.00 0.31 C ATOM 1582 C ALA A 99 -4.500 12.768 1.786 1.00 42.21 C ATOM 1583 O ALA A 99 -5.089 12.994 2.843 1.00 72.42 O ATOM 1584 CB ALA A 99 -5.126 12.623 -0.631 1.00 51.31 C ATOM 0 H ALA A 99 -3.049 14.084 -0.472 1.00 35.12 H new ATOM 0 HA ALA A 99 -5.709 14.167 0.722 1.00 0.31 H new ATOM 0 HB1 ALA A 99 -5.944 11.958 -0.355 1.00 51.31 H new ATOM 0 HB2 ALA A 99 -5.412 13.205 -1.507 1.00 51.31 H new ATOM 0 HB3 ALA A 99 -4.240 12.032 -0.861 1.00 51.31 H new ATOM 1590 N LYS A 100 -3.560 11.837 1.662 1.00 13.33 N ATOM 1591 CA LYS A 100 -3.140 11.006 2.782 1.00 43.31 C ATOM 1592 C LYS A 100 -1.824 10.313 2.450 1.00 24.21 C ATOM 1593 O LYS A 100 -1.590 9.941 1.298 1.00 23.34 O ATOM 1594 CB LYS A 100 -4.228 9.978 3.131 1.00 11.14 C ATOM 1595 CG LYS A 100 -3.803 8.974 4.192 1.00 70.31 C ATOM 1596 CD LYS A 100 -4.993 8.385 4.933 1.00 73.14 C ATOM 1597 CE LYS A 100 -5.701 9.442 5.769 1.00 1.41 C ATOM 1598 NZ LYS A 100 -6.666 8.843 6.724 1.00 23.45 N ATOM 0 H LYS A 100 -3.072 11.639 0.789 1.00 13.33 H new ATOM 0 HA LYS A 100 -2.988 11.641 3.655 1.00 43.31 H new ATOM 0 HB2 LYS A 100 -5.116 10.506 3.478 1.00 11.14 H new ATOM 0 HB3 LYS A 100 -4.510 9.440 2.226 1.00 11.14 H new ATOM 0 HG2 LYS A 100 -3.235 8.171 3.723 1.00 70.31 H new ATOM 0 HG3 LYS A 100 -3.138 9.461 4.905 1.00 70.31 H new ATOM 0 HD2 LYS A 100 -5.693 7.955 4.217 1.00 73.14 H new ATOM 0 HD3 LYS A 100 -4.657 7.573 5.578 1.00 73.14 H new ATOM 0 HE2 LYS A 100 -4.961 10.024 6.319 1.00 1.41 H new ATOM 0 HE3 LYS A 100 -6.226 10.134 5.110 1.00 1.41 H new ATOM 0 HZ1 LYS A 100 -7.125 9.598 7.273 1.00 23.45 H new ATOM 0 HZ2 LYS A 100 -7.387 8.308 6.199 1.00 23.45 H new ATOM 0 HZ3 LYS A 100 -6.163 8.203 7.370 1.00 23.45 H new ATOM 1612 N VAL A 101 -0.979 10.135 3.464 1.00 13.32 N ATOM 1613 CA VAL A 101 0.363 9.583 3.278 1.00 1.23 C ATOM 1614 C VAL A 101 0.339 8.187 2.652 1.00 40.40 C ATOM 1615 O VAL A 101 1.256 7.814 1.928 1.00 25.31 O ATOM 1616 CB VAL A 101 1.147 9.536 4.610 1.00 33.02 C ATOM 1617 CG1 VAL A 101 1.368 10.940 5.153 1.00 61.14 C ATOM 1618 CG2 VAL A 101 0.426 8.676 5.641 1.00 12.53 C ATOM 0 H VAL A 101 -1.203 10.367 4.432 1.00 13.32 H new ATOM 0 HA VAL A 101 0.871 10.257 2.588 1.00 1.23 H new ATOM 0 HB VAL A 101 2.118 9.084 4.410 1.00 33.02 H new ATOM 0 HG11 VAL A 101 1.921 10.885 6.090 1.00 61.14 H new ATOM 0 HG12 VAL A 101 1.937 11.524 4.430 1.00 61.14 H new ATOM 0 HG13 VAL A 101 0.404 11.418 5.328 1.00 61.14 H new ATOM 0 HG21 VAL A 101 1.000 8.661 6.568 1.00 12.53 H new ATOM 0 HG22 VAL A 101 -0.563 9.091 5.834 1.00 12.53 H new ATOM 0 HG23 VAL A 101 0.325 7.660 5.260 1.00 12.53 H new ATOM 1628 N LYS A 102 -0.712 7.426 2.919 1.00 75.31 N ATOM 1629 CA LYS A 102 -0.827 6.078 2.373 1.00 32.53 C ATOM 1630 C LYS A 102 -1.232 6.119 0.903 1.00 44.33 C ATOM 1631 O LYS A 102 -0.759 5.321 0.094 1.00 52.11 O ATOM 1632 CB LYS A 102 -1.839 5.260 3.182 1.00 31.11 C ATOM 1633 CG LYS A 102 -1.443 5.073 4.640 1.00 43.22 C ATOM 1634 CD LYS A 102 -0.110 4.346 4.769 1.00 23.54 C ATOM 1635 CE LYS A 102 -0.211 2.893 4.326 1.00 3.40 C ATOM 1636 NZ LYS A 102 -0.966 2.062 5.299 1.00 22.43 N ATOM 0 H LYS A 102 -1.494 7.715 3.507 1.00 75.31 H new ATOM 0 HA LYS A 102 0.149 5.598 2.444 1.00 32.53 H new ATOM 0 HB2 LYS A 102 -2.810 5.753 3.138 1.00 31.11 H new ATOM 0 HB3 LYS A 102 -1.957 4.281 2.718 1.00 31.11 H new ATOM 0 HG2 LYS A 102 -1.377 6.046 5.127 1.00 43.22 H new ATOM 0 HG3 LYS A 102 -2.218 4.509 5.159 1.00 43.22 H new ATOM 0 HD2 LYS A 102 0.642 4.857 4.168 1.00 23.54 H new ATOM 0 HD3 LYS A 102 0.227 4.387 5.805 1.00 23.54 H new ATOM 0 HE2 LYS A 102 -0.700 2.845 3.353 1.00 3.40 H new ATOM 0 HE3 LYS A 102 0.791 2.483 4.200 1.00 3.40 H new ATOM 0 HZ1 LYS A 102 -0.923 1.064 5.010 1.00 22.43 H new ATOM 0 HZ2 LYS A 102 -0.546 2.167 6.245 1.00 22.43 H new ATOM 0 HZ3 LYS A 102 -1.958 2.373 5.325 1.00 22.43 H new ATOM 1650 N LYS A 103 -2.087 7.076 0.559 1.00 63.42 N ATOM 1651 CA LYS A 103 -2.590 7.208 -0.804 1.00 31.11 C ATOM 1652 C LYS A 103 -1.482 7.683 -1.742 1.00 63.14 C ATOM 1653 O LYS A 103 -1.338 7.182 -2.856 1.00 44.02 O ATOM 1654 CB LYS A 103 -3.763 8.195 -0.837 1.00 1.04 C ATOM 1655 CG LYS A 103 -4.521 8.225 -2.159 1.00 2.04 C ATOM 1656 CD LYS A 103 -5.675 7.226 -2.186 1.00 70.42 C ATOM 1657 CE LYS A 103 -5.192 5.784 -2.151 1.00 5.25 C ATOM 1658 NZ LYS A 103 -6.322 4.823 -2.047 1.00 5.04 N ATOM 0 H LYS A 103 -2.448 7.775 1.209 1.00 63.42 H new ATOM 0 HA LYS A 103 -2.935 6.231 -1.142 1.00 31.11 H new ATOM 0 HB2 LYS A 103 -4.459 7.940 -0.038 1.00 1.04 H new ATOM 0 HB3 LYS A 103 -3.387 9.196 -0.625 1.00 1.04 H new ATOM 0 HG2 LYS A 103 -4.908 9.229 -2.331 1.00 2.04 H new ATOM 0 HG3 LYS A 103 -3.833 8.005 -2.975 1.00 2.04 H new ATOM 0 HD2 LYS A 103 -6.330 7.408 -1.334 1.00 70.42 H new ATOM 0 HD3 LYS A 103 -6.270 7.386 -3.085 1.00 70.42 H new ATOM 0 HE2 LYS A 103 -4.617 5.572 -3.052 1.00 5.25 H new ATOM 0 HE3 LYS A 103 -4.520 5.647 -1.304 1.00 5.25 H new ATOM 0 HZ1 LYS A 103 -5.955 3.880 -1.806 1.00 5.04 H new ATOM 0 HZ2 LYS A 103 -6.979 5.139 -1.305 1.00 5.04 H new ATOM 0 HZ3 LYS A 103 -6.823 4.777 -2.957 1.00 5.04 H new ATOM 1672 N LYS A 104 -0.693 8.640 -1.272 1.00 3.30 N ATOM 1673 CA LYS A 104 0.410 9.187 -2.060 1.00 33.31 C ATOM 1674 C LYS A 104 1.572 8.195 -2.142 1.00 24.23 C ATOM 1675 O LYS A 104 2.454 8.324 -2.992 1.00 64.10 O ATOM 1676 CB LYS A 104 0.901 10.507 -1.450 1.00 32.34 C ATOM 1677 CG LYS A 104 1.240 10.385 0.026 1.00 65.22 C ATOM 1678 CD LYS A 104 2.209 11.457 0.497 1.00 14.11 C ATOM 1679 CE LYS A 104 1.541 12.812 0.589 1.00 54.41 C ATOM 1680 NZ LYS A 104 2.455 13.851 1.123 1.00 44.51 N ATOM 0 H LYS A 104 -0.795 9.056 -0.346 1.00 3.30 H new ATOM 0 HA LYS A 104 0.039 9.373 -3.068 1.00 33.31 H new ATOM 0 HB2 LYS A 104 1.783 10.847 -1.993 1.00 32.34 H new ATOM 0 HB3 LYS A 104 0.133 11.269 -1.580 1.00 32.34 H new ATOM 0 HG2 LYS A 104 0.323 10.448 0.611 1.00 65.22 H new ATOM 0 HG3 LYS A 104 1.672 9.402 0.215 1.00 65.22 H new ATOM 0 HD2 LYS A 104 2.610 11.182 1.472 1.00 14.11 H new ATOM 0 HD3 LYS A 104 3.053 11.513 -0.191 1.00 14.11 H new ATOM 0 HE2 LYS A 104 1.191 13.111 -0.399 1.00 54.41 H new ATOM 0 HE3 LYS A 104 0.662 12.739 1.230 1.00 54.41 H new ATOM 0 HZ1 LYS A 104 2.148 14.787 0.791 1.00 44.51 H new ATOM 0 HZ2 LYS A 104 2.436 13.829 2.163 1.00 44.51 H new ATOM 0 HZ3 LYS A 104 3.423 13.666 0.790 1.00 44.51 H new ATOM 1694 N MET A 105 1.571 7.210 -1.254 1.00 60.25 N ATOM 1695 CA MET A 105 2.672 6.259 -1.173 1.00 25.31 C ATOM 1696 C MET A 105 2.512 5.165 -2.224 1.00 44.54 C ATOM 1697 O MET A 105 3.414 4.936 -3.031 1.00 25.15 O ATOM 1698 CB MET A 105 2.743 5.649 0.231 1.00 22.14 C ATOM 1699 CG MET A 105 4.086 5.016 0.569 1.00 64.04 C ATOM 1700 SD MET A 105 4.392 3.471 -0.310 1.00 43.54 S ATOM 1701 CE MET A 105 6.070 3.131 0.208 1.00 40.54 C ATOM 0 H MET A 105 0.822 7.049 -0.581 1.00 60.25 H new ATOM 0 HA MET A 105 3.604 6.789 -1.370 1.00 25.31 H new ATOM 0 HB2 MET A 105 2.525 6.426 0.964 1.00 22.14 H new ATOM 0 HB3 MET A 105 1.963 4.893 0.327 1.00 22.14 H new ATOM 0 HG2 MET A 105 4.882 5.723 0.334 1.00 64.04 H new ATOM 0 HG3 MET A 105 4.132 4.830 1.642 1.00 64.04 H new ATOM 0 HE1 MET A 105 6.736 3.196 -0.652 1.00 40.54 H new ATOM 0 HE2 MET A 105 6.374 3.861 0.958 1.00 40.54 H new ATOM 0 HE3 MET A 105 6.123 2.129 0.634 1.00 40.54 H new ATOM 1711 N LEU A 106 1.357 4.504 -2.225 1.00 64.20 N ATOM 1712 CA LEU A 106 1.088 3.435 -3.184 1.00 60.01 C ATOM 1713 C LEU A 106 1.122 3.968 -4.615 1.00 25.42 C ATOM 1714 O LEU A 106 1.503 3.261 -5.548 1.00 52.24 O ATOM 1715 CB LEU A 106 -0.256 2.762 -2.868 1.00 75.40 C ATOM 1716 CG LEU A 106 -1.433 3.710 -2.621 1.00 51.41 C ATOM 1717 CD1 LEU A 106 -2.114 4.096 -3.923 1.00 63.21 C ATOM 1718 CD2 LEU A 106 -2.424 3.078 -1.664 1.00 71.34 C ATOM 0 H LEU A 106 0.594 4.689 -1.574 1.00 64.20 H new ATOM 0 HA LEU A 106 1.871 2.682 -3.096 1.00 60.01 H new ATOM 0 HB2 LEU A 106 -0.514 2.101 -3.696 1.00 75.40 H new ATOM 0 HB3 LEU A 106 -0.128 2.134 -1.986 1.00 75.40 H new ATOM 0 HG LEU A 106 -1.044 4.623 -2.169 1.00 51.41 H new ATOM 0 HD11 LEU A 106 -2.945 4.769 -3.713 1.00 63.21 H new ATOM 0 HD12 LEU A 106 -1.397 4.596 -4.574 1.00 63.21 H new ATOM 0 HD13 LEU A 106 -2.489 3.200 -4.417 1.00 63.21 H new ATOM 0 HD21 LEU A 106 -3.256 3.762 -1.497 1.00 71.34 H new ATOM 0 HD22 LEU A 106 -2.799 2.148 -2.091 1.00 71.34 H new ATOM 0 HD23 LEU A 106 -1.930 2.868 -0.715 1.00 71.34 H new ATOM 1730 N TYR A 107 0.745 5.231 -4.768 1.00 41.12 N ATOM 1731 CA TYR A 107 0.806 5.907 -6.054 1.00 12.23 C ATOM 1732 C TYR A 107 2.244 5.968 -6.564 1.00 45.11 C ATOM 1733 O TYR A 107 2.503 5.795 -7.757 1.00 61.34 O ATOM 1734 CB TYR A 107 0.219 7.321 -5.922 1.00 71.55 C ATOM 1735 CG TYR A 107 0.903 8.359 -6.788 1.00 4.22 C ATOM 1736 CD1 TYR A 107 0.802 8.321 -8.171 1.00 0.13 C ATOM 1737 CD2 TYR A 107 1.671 9.365 -6.213 1.00 61.44 C ATOM 1738 CE1 TYR A 107 1.446 9.255 -8.955 1.00 31.43 C ATOM 1739 CE2 TYR A 107 2.318 10.303 -6.994 1.00 65.23 C ATOM 1740 CZ TYR A 107 2.202 10.243 -8.365 1.00 21.03 C ATOM 1741 OH TYR A 107 2.844 11.173 -9.150 1.00 64.01 O ATOM 0 H TYR A 107 0.391 5.811 -4.008 1.00 41.12 H new ATOM 0 HA TYR A 107 0.217 5.344 -6.778 1.00 12.23 H new ATOM 0 HB2 TYR A 107 -0.839 7.289 -6.180 1.00 71.55 H new ATOM 0 HB3 TYR A 107 0.284 7.634 -4.880 1.00 71.55 H new ATOM 0 HD1 TYR A 107 0.211 7.549 -8.640 1.00 0.13 H new ATOM 0 HD2 TYR A 107 1.763 9.414 -5.138 1.00 61.44 H new ATOM 0 HE1 TYR A 107 1.357 9.212 -10.030 1.00 31.43 H new ATOM 0 HE2 TYR A 107 2.911 11.079 -6.532 1.00 65.23 H new ATOM 0 HH TYR A 107 3.167 10.743 -9.969 1.00 64.01 H new ATOM 1751 N SER A 108 3.174 6.190 -5.645 1.00 44.31 N ATOM 1752 CA SER A 108 4.575 6.371 -5.991 1.00 62.42 C ATOM 1753 C SER A 108 5.122 5.122 -6.687 1.00 61.50 C ATOM 1754 O SER A 108 6.015 5.208 -7.533 1.00 31.55 O ATOM 1755 CB SER A 108 5.382 6.688 -4.725 1.00 14.05 C ATOM 1756 OG SER A 108 6.587 7.368 -5.031 1.00 72.22 O ATOM 0 H SER A 108 2.979 6.249 -4.645 1.00 44.31 H new ATOM 0 HA SER A 108 4.666 7.207 -6.684 1.00 62.42 H new ATOM 0 HB2 SER A 108 4.780 7.299 -4.052 1.00 14.05 H new ATOM 0 HB3 SER A 108 5.610 5.762 -4.197 1.00 14.05 H new ATOM 0 HG SER A 108 7.076 7.556 -4.203 1.00 72.22 H new ATOM 1762 N SER A 109 4.558 3.968 -6.349 1.00 74.42 N ATOM 1763 CA SER A 109 4.977 2.711 -6.947 1.00 50.32 C ATOM 1764 C SER A 109 4.391 2.552 -8.354 1.00 71.24 C ATOM 1765 O SER A 109 5.101 2.189 -9.293 1.00 71.53 O ATOM 1766 CB SER A 109 4.547 1.545 -6.055 1.00 73.15 C ATOM 1767 OG SER A 109 5.031 1.722 -4.732 1.00 11.22 O ATOM 0 H SER A 109 3.809 3.879 -5.663 1.00 74.42 H new ATOM 0 HA SER A 109 6.064 2.712 -7.034 1.00 50.32 H new ATOM 0 HB2 SER A 109 3.460 1.471 -6.043 1.00 73.15 H new ATOM 0 HB3 SER A 109 4.926 0.608 -6.464 1.00 73.15 H new ATOM 0 HG SER A 109 4.274 1.776 -4.111 1.00 11.22 H new ATOM 1773 N SER A 110 3.099 2.840 -8.497 1.00 74.43 N ATOM 1774 CA SER A 110 2.416 2.705 -9.779 1.00 70.41 C ATOM 1775 C SER A 110 2.971 3.666 -10.834 1.00 53.43 C ATOM 1776 O SER A 110 3.061 3.309 -12.009 1.00 44.13 O ATOM 1777 CB SER A 110 0.929 2.967 -9.582 1.00 52.33 C ATOM 1778 OG SER A 110 0.468 2.328 -8.410 1.00 55.20 O ATOM 0 H SER A 110 2.504 3.169 -7.737 1.00 74.43 H new ATOM 0 HA SER A 110 2.582 1.691 -10.142 1.00 70.41 H new ATOM 0 HB2 SER A 110 0.748 4.040 -9.514 1.00 52.33 H new ATOM 0 HB3 SER A 110 0.372 2.604 -10.445 1.00 52.33 H new ATOM 0 HG SER A 110 0.038 2.987 -7.826 1.00 55.20 H new ATOM 1784 N PHE A 111 3.354 4.866 -10.396 1.00 32.12 N ATOM 1785 CA PHE A 111 3.753 5.950 -11.300 1.00 53.50 C ATOM 1786 C PHE A 111 4.787 5.505 -12.341 1.00 72.31 C ATOM 1787 O PHE A 111 4.657 5.823 -13.522 1.00 50.34 O ATOM 1788 CB PHE A 111 4.298 7.136 -10.492 1.00 51.43 C ATOM 1789 CG PHE A 111 4.673 8.331 -11.333 1.00 0.50 C ATOM 1790 CD1 PHE A 111 3.714 9.258 -11.723 1.00 13.20 C ATOM 1791 CD2 PHE A 111 5.986 8.527 -11.735 1.00 40.51 C ATOM 1792 CE1 PHE A 111 4.060 10.351 -12.495 1.00 5.02 C ATOM 1793 CE2 PHE A 111 6.336 9.619 -12.507 1.00 65.22 C ATOM 1794 CZ PHE A 111 5.372 10.531 -12.888 1.00 73.14 C ATOM 0 H PHE A 111 3.397 5.115 -9.408 1.00 32.12 H new ATOM 0 HA PHE A 111 2.860 6.253 -11.847 1.00 53.50 H new ATOM 0 HB2 PHE A 111 3.548 7.440 -9.761 1.00 51.43 H new ATOM 0 HB3 PHE A 111 5.174 6.809 -9.932 1.00 51.43 H new ATOM 0 HD1 PHE A 111 2.686 9.123 -11.419 1.00 13.20 H new ATOM 0 HD2 PHE A 111 6.745 7.817 -11.441 1.00 40.51 H new ATOM 0 HE1 PHE A 111 3.305 11.064 -12.791 1.00 5.02 H new ATOM 0 HE2 PHE A 111 7.363 9.759 -12.812 1.00 65.22 H new ATOM 0 HZ PHE A 111 5.643 11.384 -13.492 1.00 73.14 H new ATOM 1804 N ASP A 112 5.811 4.778 -11.913 1.00 62.40 N ATOM 1805 CA ASP A 112 6.863 4.363 -12.835 1.00 70.50 C ATOM 1806 C ASP A 112 6.477 3.098 -13.593 1.00 15.13 C ATOM 1807 O ASP A 112 6.800 2.952 -14.771 1.00 51.12 O ATOM 1808 CB ASP A 112 8.188 4.145 -12.107 1.00 72.34 C ATOM 1809 CG ASP A 112 9.333 3.921 -13.075 1.00 52.45 C ATOM 1810 OD1 ASP A 112 9.781 4.907 -13.706 1.00 51.14 O ATOM 1811 OD2 ASP A 112 9.794 2.768 -13.206 1.00 34.03 O ATOM 0 H ASP A 112 5.936 4.467 -10.950 1.00 62.40 H new ATOM 0 HA ASP A 112 6.989 5.173 -13.554 1.00 70.50 H new ATOM 0 HB2 ASP A 112 8.405 5.011 -11.481 1.00 72.34 H new ATOM 0 HB3 ASP A 112 8.100 3.285 -11.443 1.00 72.34 H new ATOM 1816 N ALA A 113 5.775 2.194 -12.920 1.00 21.33 N ATOM 1817 CA ALA A 113 5.397 0.916 -13.516 1.00 73.14 C ATOM 1818 C ALA A 113 4.503 1.103 -14.740 1.00 63.33 C ATOM 1819 O ALA A 113 4.650 0.402 -15.742 1.00 3.54 O ATOM 1820 CB ALA A 113 4.701 0.045 -12.485 1.00 44.32 C ATOM 0 H ALA A 113 5.455 2.322 -11.960 1.00 21.33 H new ATOM 0 HA ALA A 113 6.310 0.422 -13.848 1.00 73.14 H new ATOM 0 HB1 ALA A 113 4.423 -0.906 -12.940 1.00 44.32 H new ATOM 0 HB2 ALA A 113 5.375 -0.136 -11.648 1.00 44.32 H new ATOM 0 HB3 ALA A 113 3.805 0.551 -12.126 1.00 44.32 H new ATOM 1826 N LEU A 114 3.591 2.067 -14.660 1.00 3.32 N ATOM 1827 CA LEU A 114 2.644 2.322 -15.739 1.00 42.24 C ATOM 1828 C LEU A 114 3.356 2.836 -16.990 1.00 43.40 C ATOM 1829 O LEU A 114 2.862 2.677 -18.106 1.00 3.20 O ATOM 1830 CB LEU A 114 1.572 3.320 -15.272 1.00 51.01 C ATOM 1831 CG LEU A 114 2.093 4.675 -14.776 1.00 11.32 C ATOM 1832 CD1 LEU A 114 2.282 5.643 -15.929 1.00 40.25 C ATOM 1833 CD2 LEU A 114 1.156 5.267 -13.739 1.00 40.03 C ATOM 0 H LEU A 114 3.488 2.686 -13.856 1.00 3.32 H new ATOM 0 HA LEU A 114 2.159 1.381 -16.000 1.00 42.24 H new ATOM 0 HB2 LEU A 114 0.883 3.497 -16.098 1.00 51.01 H new ATOM 0 HB3 LEU A 114 0.997 2.858 -14.470 1.00 51.01 H new ATOM 0 HG LEU A 114 3.064 4.506 -14.310 1.00 11.32 H new ATOM 0 HD11 LEU A 114 2.652 6.595 -15.548 1.00 40.25 H new ATOM 0 HD12 LEU A 114 3.002 5.231 -16.636 1.00 40.25 H new ATOM 0 HD13 LEU A 114 1.328 5.800 -16.433 1.00 40.25 H new ATOM 0 HD21 LEU A 114 1.546 6.227 -13.402 1.00 40.03 H new ATOM 0 HD22 LEU A 114 0.169 5.411 -14.180 1.00 40.03 H new ATOM 0 HD23 LEU A 114 1.078 4.589 -12.889 1.00 40.03 H new ATOM 1845 N LYS A 115 4.535 3.421 -16.793 1.00 1.22 N ATOM 1846 CA LYS A 115 5.315 4.004 -17.883 1.00 52.11 C ATOM 1847 C LYS A 115 5.756 2.933 -18.874 1.00 13.01 C ATOM 1848 O LYS A 115 6.015 3.218 -20.042 1.00 53.10 O ATOM 1849 CB LYS A 115 6.535 4.735 -17.315 1.00 73.21 C ATOM 1850 CG LYS A 115 6.172 5.946 -16.469 1.00 2.24 C ATOM 1851 CD LYS A 115 7.333 6.434 -15.606 1.00 11.14 C ATOM 1852 CE LYS A 115 8.607 6.673 -16.405 1.00 13.12 C ATOM 1853 NZ LYS A 115 9.510 5.488 -16.387 1.00 54.43 N ATOM 0 H LYS A 115 4.976 3.504 -15.877 1.00 1.22 H new ATOM 0 HA LYS A 115 4.685 4.716 -18.415 1.00 52.11 H new ATOM 0 HB2 LYS A 115 7.117 4.040 -16.710 1.00 73.21 H new ATOM 0 HB3 LYS A 115 7.174 5.054 -18.138 1.00 73.21 H new ATOM 0 HG2 LYS A 115 5.846 6.755 -17.122 1.00 2.24 H new ATOM 0 HG3 LYS A 115 5.328 5.695 -15.826 1.00 2.24 H new ATOM 0 HD2 LYS A 115 7.044 7.359 -15.107 1.00 11.14 H new ATOM 0 HD3 LYS A 115 7.532 5.700 -14.825 1.00 11.14 H new ATOM 0 HE2 LYS A 115 8.348 6.915 -17.436 1.00 13.12 H new ATOM 0 HE3 LYS A 115 9.134 7.536 -15.997 1.00 13.12 H new ATOM 0 HZ1 LYS A 115 10.482 5.789 -16.600 1.00 54.43 H new ATOM 0 HZ2 LYS A 115 9.483 5.045 -15.446 1.00 54.43 H new ATOM 0 HZ3 LYS A 115 9.196 4.801 -17.102 1.00 54.43 H new ATOM 1867 N LYS A 116 5.823 1.702 -18.395 1.00 53.02 N ATOM 1868 CA LYS A 116 6.210 0.569 -19.219 1.00 42.14 C ATOM 1869 C LYS A 116 5.013 0.045 -20.014 1.00 34.03 C ATOM 1870 O LYS A 116 5.171 -0.573 -21.069 1.00 41.15 O ATOM 1871 CB LYS A 116 6.813 -0.513 -18.310 1.00 33.32 C ATOM 1872 CG LYS A 116 6.960 -1.897 -18.933 1.00 71.52 C ATOM 1873 CD LYS A 116 5.812 -2.816 -18.530 1.00 33.21 C ATOM 1874 CE LYS A 116 5.630 -2.854 -17.016 1.00 34.33 C ATOM 1875 NZ LYS A 116 6.831 -3.381 -16.315 1.00 20.24 N ATOM 0 H LYS A 116 5.611 1.460 -17.427 1.00 53.02 H new ATOM 0 HA LYS A 116 6.960 0.874 -19.949 1.00 42.14 H new ATOM 0 HB2 LYS A 116 7.796 -0.177 -17.980 1.00 33.32 H new ATOM 0 HB3 LYS A 116 6.191 -0.600 -17.419 1.00 33.32 H new ATOM 0 HG2 LYS A 116 6.991 -1.807 -20.019 1.00 71.52 H new ATOM 0 HG3 LYS A 116 7.907 -2.338 -18.622 1.00 71.52 H new ATOM 0 HD2 LYS A 116 4.890 -2.475 -19.000 1.00 33.21 H new ATOM 0 HD3 LYS A 116 6.004 -3.823 -18.900 1.00 33.21 H new ATOM 0 HE2 LYS A 116 5.412 -1.849 -16.653 1.00 34.33 H new ATOM 0 HE3 LYS A 116 4.768 -3.475 -16.772 1.00 34.33 H new ATOM 0 HZ1 LYS A 116 6.635 -3.451 -15.296 1.00 20.24 H new ATOM 0 HZ2 LYS A 116 7.065 -4.323 -16.688 1.00 20.24 H new ATOM 0 HZ3 LYS A 116 7.633 -2.738 -16.470 1.00 20.24 H new ATOM 1889 N SER A 117 3.817 0.322 -19.515 1.00 52.32 N ATOM 1890 CA SER A 117 2.599 -0.179 -20.132 1.00 20.31 C ATOM 1891 C SER A 117 2.088 0.778 -21.206 1.00 54.34 C ATOM 1892 O SER A 117 1.782 0.364 -22.323 1.00 10.22 O ATOM 1893 CB SER A 117 1.533 -0.390 -19.058 1.00 52.02 C ATOM 1894 OG SER A 117 2.069 -1.113 -17.964 1.00 43.23 O ATOM 0 H SER A 117 3.665 0.892 -18.683 1.00 52.32 H new ATOM 0 HA SER A 117 2.822 -1.130 -20.616 1.00 20.31 H new ATOM 0 HB2 SER A 117 1.157 0.574 -18.716 1.00 52.02 H new ATOM 0 HB3 SER A 117 0.686 -0.931 -19.479 1.00 52.02 H new ATOM 0 HG SER A 117 1.610 -0.848 -17.140 1.00 43.23 H new ATOM 1900 N LEU A 118 2.012 2.059 -20.872 1.00 12.31 N ATOM 1901 CA LEU A 118 1.498 3.059 -21.801 1.00 74.12 C ATOM 1902 C LEU A 118 2.628 3.709 -22.593 1.00 70.14 C ATOM 1903 O LEU A 118 2.561 4.889 -22.941 1.00 25.20 O ATOM 1904 CB LEU A 118 0.665 4.105 -21.047 1.00 61.30 C ATOM 1905 CG LEU A 118 1.225 4.592 -19.702 1.00 73.05 C ATOM 1906 CD1 LEU A 118 2.387 5.554 -19.896 1.00 63.33 C ATOM 1907 CD2 LEU A 118 0.126 5.249 -18.881 1.00 60.33 C ATOM 0 H LEU A 118 2.299 2.431 -19.967 1.00 12.31 H new ATOM 0 HA LEU A 118 0.848 2.561 -22.520 1.00 74.12 H new ATOM 0 HB2 LEU A 118 0.537 4.971 -21.696 1.00 61.30 H new ATOM 0 HB3 LEU A 118 -0.327 3.689 -20.872 1.00 61.30 H new ATOM 0 HG LEU A 118 1.601 3.722 -19.163 1.00 73.05 H new ATOM 0 HD11 LEU A 118 2.758 5.878 -18.923 1.00 63.33 H new ATOM 0 HD12 LEU A 118 3.187 5.053 -20.441 1.00 63.33 H new ATOM 0 HD13 LEU A 118 2.050 6.422 -20.463 1.00 63.33 H new ATOM 0 HD21 LEU A 118 0.536 5.590 -17.930 1.00 60.33 H new ATOM 0 HD22 LEU A 118 -0.277 6.101 -19.428 1.00 60.33 H new ATOM 0 HD23 LEU A 118 -0.670 4.528 -18.695 1.00 60.33 H new ATOM 1919 N VAL A 119 3.652 2.918 -22.893 1.00 15.24 N ATOM 1920 CA VAL A 119 4.801 3.388 -23.658 1.00 44.23 C ATOM 1921 C VAL A 119 4.361 4.023 -24.985 1.00 74.34 C ATOM 1922 O VAL A 119 3.556 3.453 -25.729 1.00 55.41 O ATOM 1923 CB VAL A 119 5.810 2.238 -23.913 1.00 53.55 C ATOM 1924 CG1 VAL A 119 5.154 1.080 -24.648 1.00 1.45 C ATOM 1925 CG2 VAL A 119 7.023 2.735 -24.688 1.00 74.31 C ATOM 0 H VAL A 119 3.709 1.938 -22.615 1.00 15.24 H new ATOM 0 HA VAL A 119 5.300 4.154 -23.064 1.00 44.23 H new ATOM 0 HB VAL A 119 6.145 1.878 -22.940 1.00 53.55 H new ATOM 0 HG11 VAL A 119 5.888 0.290 -24.811 1.00 1.45 H new ATOM 0 HG12 VAL A 119 4.329 0.691 -24.051 1.00 1.45 H new ATOM 0 HG13 VAL A 119 4.775 1.427 -25.609 1.00 1.45 H new ATOM 0 HG21 VAL A 119 7.714 1.908 -24.853 1.00 74.31 H new ATOM 0 HG22 VAL A 119 6.701 3.136 -25.649 1.00 74.31 H new ATOM 0 HG23 VAL A 119 7.524 3.518 -24.118 1.00 74.31 H new ATOM 1935 N GLY A 120 4.875 5.215 -25.256 1.00 2.31 N ATOM 1936 CA GLY A 120 4.465 5.958 -26.432 1.00 61.43 C ATOM 1937 C GLY A 120 4.091 7.381 -26.081 1.00 30.32 C ATOM 1938 O GLY A 120 4.236 8.294 -26.896 1.00 52.43 O ATOM 0 H GLY A 120 5.573 5.683 -24.678 1.00 2.31 H new ATOM 0 HA2 GLY A 120 5.274 5.962 -27.162 1.00 61.43 H new ATOM 0 HA3 GLY A 120 3.615 5.461 -26.900 1.00 61.43 H new ATOM 1942 N VAL A 121 3.600 7.556 -24.859 1.00 23.00 N ATOM 1943 CA VAL A 121 3.260 8.875 -24.329 1.00 21.22 C ATOM 1944 C VAL A 121 4.469 9.821 -24.365 1.00 53.31 C ATOM 1945 O VAL A 121 5.605 9.399 -24.143 1.00 20.34 O ATOM 1946 CB VAL A 121 2.738 8.763 -22.879 1.00 52.11 C ATOM 1947 CG1 VAL A 121 2.416 10.130 -22.302 1.00 2.14 C ATOM 1948 CG2 VAL A 121 1.513 7.867 -22.826 1.00 40.32 C ATOM 0 H VAL A 121 3.426 6.790 -24.208 1.00 23.00 H new ATOM 0 HA VAL A 121 2.476 9.287 -24.964 1.00 21.22 H new ATOM 0 HB VAL A 121 3.527 8.319 -22.272 1.00 52.11 H new ATOM 0 HG11 VAL A 121 2.051 10.017 -21.281 1.00 2.14 H new ATOM 0 HG12 VAL A 121 3.316 10.745 -22.300 1.00 2.14 H new ATOM 0 HG13 VAL A 121 1.650 10.610 -22.910 1.00 2.14 H new ATOM 0 HG21 VAL A 121 1.157 7.798 -21.798 1.00 40.32 H new ATOM 0 HG22 VAL A 121 0.728 8.287 -23.455 1.00 40.32 H new ATOM 0 HG23 VAL A 121 1.774 6.872 -23.187 1.00 40.32 H new ATOM 1958 N GLN A 122 4.215 11.098 -24.651 1.00 21.33 N ATOM 1959 CA GLN A 122 5.279 12.097 -24.740 1.00 32.11 C ATOM 1960 C GLN A 122 5.479 12.826 -23.412 1.00 55.13 C ATOM 1961 O GLN A 122 6.608 13.017 -22.962 1.00 15.34 O ATOM 1962 CB GLN A 122 4.961 13.113 -25.841 1.00 53.34 C ATOM 1963 CG GLN A 122 5.134 12.571 -27.250 1.00 41.31 C ATOM 1964 CD GLN A 122 6.567 12.174 -27.546 1.00 51.10 C ATOM 1965 OE1 GLN A 122 7.511 12.734 -26.982 1.00 32.34 O ATOM 1966 NE2 GLN A 122 6.742 11.214 -28.437 1.00 54.21 N ATOM 0 H GLN A 122 3.279 11.465 -24.825 1.00 21.33 H new ATOM 0 HA GLN A 122 6.203 11.572 -24.982 1.00 32.11 H new ATOM 0 HB2 GLN A 122 3.934 13.457 -25.718 1.00 53.34 H new ATOM 0 HB3 GLN A 122 5.605 13.983 -25.716 1.00 53.34 H new ATOM 0 HG2 GLN A 122 4.485 11.706 -27.385 1.00 41.31 H new ATOM 0 HG3 GLN A 122 4.813 13.326 -27.968 1.00 41.31 H new ATOM 0 HE21 GLN A 122 5.934 10.776 -28.881 1.00 54.21 H new ATOM 0 HE22 GLN A 122 7.685 10.910 -28.681 1.00 54.21 H new ATOM 1975 N LYS A 123 4.382 13.245 -22.800 1.00 4.42 N ATOM 1976 CA LYS A 123 4.439 13.993 -21.548 1.00 35.43 C ATOM 1977 C LYS A 123 3.931 13.147 -20.392 1.00 75.13 C ATOM 1978 O LYS A 123 2.824 12.628 -20.447 1.00 70.35 O ATOM 1979 CB LYS A 123 3.600 15.275 -21.656 1.00 44.30 C ATOM 1980 CG LYS A 123 3.214 15.890 -20.309 1.00 52.00 C ATOM 1981 CD LYS A 123 4.026 17.134 -19.977 1.00 45.24 C ATOM 1982 CE LYS A 123 5.514 16.836 -19.889 1.00 5.11 C ATOM 1983 NZ LYS A 123 6.318 18.071 -19.712 1.00 13.33 N ATOM 0 H LYS A 123 3.438 13.080 -23.149 1.00 4.42 H new ATOM 0 HA LYS A 123 5.479 14.258 -21.358 1.00 35.43 H new ATOM 0 HB2 LYS A 123 4.158 16.013 -22.233 1.00 44.30 H new ATOM 0 HB3 LYS A 123 2.691 15.054 -22.215 1.00 44.30 H new ATOM 0 HG2 LYS A 123 2.154 16.145 -20.321 1.00 52.00 H new ATOM 0 HG3 LYS A 123 3.354 15.149 -19.522 1.00 52.00 H new ATOM 0 HD2 LYS A 123 3.853 17.894 -20.739 1.00 45.24 H new ATOM 0 HD3 LYS A 123 3.683 17.549 -19.029 1.00 45.24 H new ATOM 0 HE2 LYS A 123 5.700 16.160 -19.055 1.00 5.11 H new ATOM 0 HE3 LYS A 123 5.835 16.321 -20.794 1.00 5.11 H new ATOM 0 HZ1 LYS A 123 7.263 17.822 -19.356 1.00 13.33 H new ATOM 0 HZ2 LYS A 123 6.409 18.560 -20.625 1.00 13.33 H new ATOM 0 HZ3 LYS A 123 5.846 18.698 -19.030 1.00 13.33 H new ATOM 1997 N TYR A 124 4.739 13.006 -19.355 1.00 11.11 N ATOM 1998 CA TYR A 124 4.298 12.346 -18.137 1.00 60.14 C ATOM 1999 C TYR A 124 4.501 13.268 -16.938 1.00 11.43 C ATOM 2000 O TYR A 124 5.627 13.616 -16.586 1.00 71.21 O ATOM 2001 CB TYR A 124 5.009 10.994 -17.944 1.00 12.32 C ATOM 2002 CG TYR A 124 6.517 11.021 -18.117 1.00 74.34 C ATOM 2003 CD1 TYR A 124 7.092 10.904 -19.378 1.00 21.43 C ATOM 2004 CD2 TYR A 124 7.363 11.140 -17.020 1.00 22.52 C ATOM 2005 CE1 TYR A 124 8.466 10.910 -19.540 1.00 35.41 C ATOM 2006 CE2 TYR A 124 8.736 11.143 -17.173 1.00 45.14 C ATOM 2007 CZ TYR A 124 9.282 11.028 -18.434 1.00 63.31 C ATOM 2008 OH TYR A 124 10.651 11.019 -18.587 1.00 61.24 O ATOM 0 H TYR A 124 5.703 13.339 -19.331 1.00 11.11 H new ATOM 0 HA TYR A 124 3.233 12.132 -18.224 1.00 60.14 H new ATOM 0 HB2 TYR A 124 4.781 10.622 -16.945 1.00 12.32 H new ATOM 0 HB3 TYR A 124 4.592 10.279 -18.653 1.00 12.32 H new ATOM 0 HD1 TYR A 124 6.455 10.807 -20.245 1.00 21.43 H new ATOM 0 HD2 TYR A 124 6.939 11.232 -16.031 1.00 22.52 H new ATOM 0 HE1 TYR A 124 8.897 10.823 -20.526 1.00 35.41 H new ATOM 0 HE2 TYR A 124 9.378 11.235 -16.310 1.00 45.14 H new ATOM 0 HH TYR A 124 11.079 11.113 -17.710 1.00 61.24 H new ATOM 2018 N ILE A 125 3.394 13.694 -16.344 1.00 73.23 N ATOM 2019 CA ILE A 125 3.427 14.637 -15.235 1.00 12.43 C ATOM 2020 C ILE A 125 2.253 14.383 -14.286 1.00 20.23 C ATOM 2021 O ILE A 125 1.166 14.011 -14.721 1.00 71.40 O ATOM 2022 CB ILE A 125 3.385 16.096 -15.753 1.00 52.44 C ATOM 2023 CG1 ILE A 125 3.470 17.088 -14.589 1.00 61.33 C ATOM 2024 CG2 ILE A 125 2.127 16.338 -16.579 1.00 43.03 C ATOM 2025 CD1 ILE A 125 3.539 18.533 -15.026 1.00 14.15 C ATOM 0 H ILE A 125 2.456 13.399 -16.615 1.00 73.23 H new ATOM 0 HA ILE A 125 4.360 14.490 -14.691 1.00 12.43 H new ATOM 0 HB ILE A 125 4.250 16.254 -16.397 1.00 52.44 H new ATOM 0 HG12 ILE A 125 2.601 16.954 -13.945 1.00 61.33 H new ATOM 0 HG13 ILE A 125 4.350 16.857 -13.990 1.00 61.33 H new ATOM 0 HG21 ILE A 125 2.117 17.369 -16.933 1.00 43.03 H new ATOM 0 HG22 ILE A 125 2.117 15.661 -17.433 1.00 43.03 H new ATOM 0 HG23 ILE A 125 1.247 16.158 -15.962 1.00 43.03 H new ATOM 0 HD11 ILE A 125 3.597 19.176 -14.148 1.00 14.15 H new ATOM 0 HD12 ILE A 125 4.423 18.684 -15.646 1.00 14.15 H new ATOM 0 HD13 ILE A 125 2.647 18.783 -15.600 1.00 14.15 H new ATOM 2037 N GLN A 126 2.474 14.552 -12.992 1.00 44.10 N ATOM 2038 CA GLN A 126 1.408 14.389 -12.012 1.00 71.42 C ATOM 2039 C GLN A 126 0.552 15.652 -11.930 1.00 40.35 C ATOM 2040 O GLN A 126 1.050 16.770 -12.071 1.00 43.43 O ATOM 2041 CB GLN A 126 1.994 14.042 -10.640 1.00 52.02 C ATOM 2042 CG GLN A 126 1.056 14.305 -9.465 1.00 12.14 C ATOM 2043 CD GLN A 126 1.733 14.112 -8.121 1.00 51.03 C ATOM 2044 OE1 GLN A 126 2.939 14.322 -7.984 1.00 32.04 O ATOM 2045 NE2 GLN A 126 0.966 13.720 -7.116 1.00 54.10 N ATOM 0 H GLN A 126 3.380 14.802 -12.595 1.00 44.10 H new ATOM 0 HA GLN A 126 0.768 13.567 -12.332 1.00 71.42 H new ATOM 0 HB2 GLN A 126 2.275 12.989 -10.635 1.00 52.02 H new ATOM 0 HB3 GLN A 126 2.909 14.617 -10.494 1.00 52.02 H new ATOM 0 HG2 GLN A 126 0.674 15.324 -9.532 1.00 12.14 H new ATOM 0 HG3 GLN A 126 0.198 13.637 -9.534 1.00 12.14 H new ATOM 0 HE21 GLN A 126 -0.029 13.556 -7.268 1.00 54.10 H new ATOM 0 HE22 GLN A 126 1.370 13.582 -6.190 1.00 54.10 H new ATOM 2054 N ALA A 127 -0.737 15.454 -11.728 1.00 12.00 N ATOM 2055 CA ALA A 127 -1.675 16.547 -11.549 1.00 41.11 C ATOM 2056 C ALA A 127 -2.322 16.434 -10.176 1.00 44.54 C ATOM 2057 O ALA A 127 -3.053 15.488 -9.906 1.00 45.42 O ATOM 2058 CB ALA A 127 -2.729 16.524 -12.644 1.00 72.00 C ATOM 0 H ALA A 127 -1.164 14.529 -11.683 1.00 12.00 H new ATOM 0 HA ALA A 127 -1.143 17.496 -11.615 1.00 41.11 H new ATOM 0 HB1 ALA A 127 -3.425 17.350 -12.496 1.00 72.00 H new ATOM 0 HB2 ALA A 127 -2.246 16.626 -13.616 1.00 72.00 H new ATOM 0 HB3 ALA A 127 -3.272 15.580 -12.606 1.00 72.00 H new ATOM 2064 N THR A 128 -2.028 17.379 -9.305 1.00 23.21 N ATOM 2065 CA THR A 128 -2.518 17.330 -7.939 1.00 13.03 C ATOM 2066 C THR A 128 -4.003 17.684 -7.864 1.00 63.41 C ATOM 2067 O THR A 128 -4.859 16.809 -7.754 1.00 3.11 O ATOM 2068 CB THR A 128 -1.730 18.304 -7.054 1.00 1.12 C ATOM 2069 OG1 THR A 128 -0.367 18.356 -7.494 1.00 63.23 O ATOM 2070 CG2 THR A 128 -1.775 17.890 -5.594 1.00 34.34 C ATOM 0 H THR A 128 -1.451 18.193 -9.518 1.00 23.21 H new ATOM 0 HA THR A 128 -2.381 16.309 -7.582 1.00 13.03 H new ATOM 0 HB THR A 128 -2.190 19.288 -7.142 1.00 1.12 H new ATOM 0 HG1 THR A 128 0.135 18.980 -6.929 1.00 63.23 H new ATOM 0 HG21 THR A 128 -1.206 18.602 -4.996 1.00 34.34 H new ATOM 0 HG22 THR A 128 -2.810 17.874 -5.252 1.00 34.34 H new ATOM 0 HG23 THR A 128 -1.341 16.896 -5.484 1.00 34.34 H new ATOM 2078 N ASP A 129 -4.298 18.974 -7.951 1.00 55.10 N ATOM 2079 CA ASP A 129 -5.660 19.468 -7.784 1.00 22.32 C ATOM 2080 C ASP A 129 -6.441 19.361 -9.092 1.00 24.22 C ATOM 2081 O ASP A 129 -5.860 19.123 -10.152 1.00 35.41 O ATOM 2082 CB ASP A 129 -5.624 20.926 -7.303 1.00 70.25 C ATOM 2083 CG ASP A 129 -7.003 21.485 -7.009 1.00 14.34 C ATOM 2084 OD1 ASP A 129 -7.509 21.265 -5.891 1.00 63.13 O ATOM 2085 OD2 ASP A 129 -7.589 22.131 -7.903 1.00 51.22 O ATOM 0 H ASP A 129 -3.608 19.702 -8.137 1.00 55.10 H new ATOM 0 HA ASP A 129 -6.166 18.855 -7.038 1.00 22.32 H new ATOM 0 HB2 ASP A 129 -5.012 20.992 -6.404 1.00 70.25 H new ATOM 0 HB3 ASP A 129 -5.142 21.542 -8.062 1.00 70.25 H new ATOM 2090 N LEU A 130 -7.757 19.533 -9.008 1.00 63.31 N ATOM 2091 CA LEU A 130 -8.620 19.556 -10.185 1.00 34.01 C ATOM 2092 C LEU A 130 -8.153 20.628 -11.167 1.00 60.13 C ATOM 2093 O LEU A 130 -8.261 20.460 -12.382 1.00 25.03 O ATOM 2094 CB LEU A 130 -10.068 19.831 -9.773 1.00 3.41 C ATOM 2095 CG LEU A 130 -10.695 18.785 -8.852 1.00 23.10 C ATOM 2096 CD1 LEU A 130 -12.081 19.227 -8.409 1.00 51.40 C ATOM 2097 CD2 LEU A 130 -10.768 17.436 -9.551 1.00 15.34 C ATOM 0 H LEU A 130 -8.254 19.660 -8.126 1.00 63.31 H new ATOM 0 HA LEU A 130 -8.565 18.582 -10.671 1.00 34.01 H new ATOM 0 HB2 LEU A 130 -10.109 20.800 -9.276 1.00 3.41 H new ATOM 0 HB3 LEU A 130 -10.676 19.909 -10.674 1.00 3.41 H new ATOM 0 HG LEU A 130 -10.065 18.684 -7.968 1.00 23.10 H new ATOM 0 HD11 LEU A 130 -12.512 18.470 -7.754 1.00 51.40 H new ATOM 0 HD12 LEU A 130 -12.007 20.172 -7.872 1.00 51.40 H new ATOM 0 HD13 LEU A 130 -12.719 19.356 -9.284 1.00 51.40 H new ATOM 0 HD21 LEU A 130 -11.217 16.703 -8.881 1.00 15.34 H new ATOM 0 HD22 LEU A 130 -11.376 17.525 -10.451 1.00 15.34 H new ATOM 0 HD23 LEU A 130 -9.763 17.112 -9.822 1.00 15.34 H new ATOM 2109 N SER A 131 -7.622 21.722 -10.623 1.00 31.11 N ATOM 2110 CA SER A 131 -7.068 22.804 -11.430 1.00 52.21 C ATOM 2111 C SER A 131 -5.966 22.283 -12.347 1.00 43.13 C ATOM 2112 O SER A 131 -5.845 22.710 -13.494 1.00 14.22 O ATOM 2113 CB SER A 131 -6.512 23.909 -10.519 1.00 42.52 C ATOM 2114 OG SER A 131 -5.878 24.936 -11.268 1.00 21.33 O ATOM 0 H SER A 131 -7.565 21.881 -9.617 1.00 31.11 H new ATOM 0 HA SER A 131 -7.866 23.216 -12.047 1.00 52.21 H new ATOM 0 HB2 SER A 131 -7.322 24.336 -9.929 1.00 42.52 H new ATOM 0 HB3 SER A 131 -5.799 23.477 -9.817 1.00 42.52 H new ATOM 0 HG SER A 131 -5.537 25.623 -10.658 1.00 21.33 H new ATOM 2120 N GLU A 132 -5.192 21.329 -11.846 1.00 5.12 N ATOM 2121 CA GLU A 132 -4.049 20.804 -12.577 1.00 4.30 C ATOM 2122 C GLU A 132 -4.498 19.896 -13.714 1.00 13.22 C ATOM 2123 O GLU A 132 -3.804 19.755 -14.718 1.00 13.11 O ATOM 2124 CB GLU A 132 -3.130 20.032 -11.634 1.00 61.41 C ATOM 2125 CG GLU A 132 -2.693 20.833 -10.421 1.00 3.55 C ATOM 2126 CD GLU A 132 -2.006 22.125 -10.800 1.00 24.54 C ATOM 2127 OE1 GLU A 132 -0.783 22.098 -11.039 1.00 44.30 O ATOM 2128 OE2 GLU A 132 -2.682 23.172 -10.850 1.00 73.20 O ATOM 0 H GLU A 132 -5.337 20.902 -10.931 1.00 5.12 H new ATOM 0 HA GLU A 132 -3.505 21.647 -13.002 1.00 4.30 H new ATOM 0 HB2 GLU A 132 -3.642 19.130 -11.298 1.00 61.41 H new ATOM 0 HB3 GLU A 132 -2.246 19.710 -12.184 1.00 61.41 H new ATOM 0 HG2 GLU A 132 -3.563 21.055 -9.803 1.00 3.55 H new ATOM 0 HG3 GLU A 132 -2.017 20.230 -9.815 1.00 3.55 H new ATOM 2135 N ALA A 133 -5.657 19.275 -13.551 1.00 32.21 N ATOM 2136 CA ALA A 133 -6.189 18.393 -14.580 1.00 11.02 C ATOM 2137 C ALA A 133 -7.131 19.152 -15.503 1.00 63.35 C ATOM 2138 O ALA A 133 -7.691 18.589 -16.443 1.00 64.41 O ATOM 2139 CB ALA A 133 -6.899 17.204 -13.957 1.00 3.05 C ATOM 0 H ALA A 133 -6.244 19.364 -12.722 1.00 32.21 H new ATOM 0 HA ALA A 133 -5.353 18.020 -15.172 1.00 11.02 H new ATOM 0 HB1 ALA A 133 -7.288 16.559 -14.745 1.00 3.05 H new ATOM 0 HB2 ALA A 133 -6.196 16.642 -13.342 1.00 3.05 H new ATOM 0 HB3 ALA A 133 -7.723 17.556 -13.336 1.00 3.05 H new ATOM 2145 N SER A 134 -7.301 20.435 -15.229 1.00 61.14 N ATOM 2146 CA SER A 134 -8.129 21.277 -16.062 1.00 21.21 C ATOM 2147 C SER A 134 -7.383 21.647 -17.339 1.00 53.12 C ATOM 2148 O SER A 134 -6.168 21.849 -17.330 1.00 40.34 O ATOM 2149 CB SER A 134 -8.569 22.521 -15.293 1.00 73.30 C ATOM 2150 OG SER A 134 -9.387 22.168 -14.191 1.00 74.23 O ATOM 0 H SER A 134 -6.874 20.912 -14.435 1.00 61.14 H new ATOM 0 HA SER A 134 -9.027 20.727 -16.343 1.00 21.21 H new ATOM 0 HB2 SER A 134 -7.693 23.066 -14.942 1.00 73.30 H new ATOM 0 HB3 SER A 134 -9.115 23.191 -15.957 1.00 73.30 H new ATOM 0 HG SER A 134 -8.892 21.567 -13.595 1.00 74.23 H new ATOM 2156 N ARG A 135 -8.135 21.731 -18.427 1.00 72.32 N ATOM 2157 CA ARG A 135 -7.587 21.907 -19.770 1.00 11.43 C ATOM 2158 C ARG A 135 -6.729 23.169 -19.912 1.00 33.21 C ATOM 2159 O ARG A 135 -5.895 23.249 -20.816 1.00 22.22 O ATOM 2160 CB ARG A 135 -8.712 21.898 -20.823 1.00 44.42 C ATOM 2161 CG ARG A 135 -9.972 22.673 -20.437 1.00 34.13 C ATOM 2162 CD ARG A 135 -10.856 21.878 -19.478 1.00 22.43 C ATOM 2163 NE ARG A 135 -12.110 22.561 -19.167 1.00 70.32 N ATOM 2164 CZ ARG A 135 -12.563 22.786 -17.927 1.00 53.14 C ATOM 2165 NH1 ARG A 135 -11.816 22.503 -16.864 1.00 43.22 N ATOM 2166 NH2 ARG A 135 -13.768 23.309 -17.751 1.00 31.11 N ATOM 0 H ARG A 135 -9.153 21.679 -18.405 1.00 72.32 H new ATOM 0 HA ARG A 135 -6.924 21.059 -19.944 1.00 11.43 H new ATOM 0 HB2 ARG A 135 -8.321 22.312 -21.752 1.00 44.42 H new ATOM 0 HB3 ARG A 135 -8.989 20.864 -21.026 1.00 44.42 H new ATOM 0 HG2 ARG A 135 -9.690 23.618 -19.972 1.00 34.13 H new ATOM 0 HG3 ARG A 135 -10.538 22.917 -21.336 1.00 34.13 H new ATOM 0 HD2 ARG A 135 -11.077 20.905 -19.916 1.00 22.43 H new ATOM 0 HD3 ARG A 135 -10.308 21.694 -18.554 1.00 22.43 H new ATOM 0 HE ARG A 135 -12.679 22.889 -19.948 1.00 70.32 H new ATOM 0 HH11 ARG A 135 -10.883 22.109 -16.986 1.00 43.22 H new ATOM 0 HH12 ARG A 135 -12.176 22.680 -15.926 1.00 43.22 H new ATOM 0 HH21 ARG A 135 -14.347 23.539 -18.559 1.00 31.11 H new ATOM 0 HH22 ARG A 135 -14.116 23.482 -16.808 1.00 31.11 H new ATOM 2180 N GLU A 136 -6.923 24.146 -19.035 1.00 42.10 N ATOM 2181 CA GLU A 136 -6.116 25.358 -19.075 1.00 44.33 C ATOM 2182 C GLU A 136 -4.706 25.081 -18.552 1.00 54.10 C ATOM 2183 O GLU A 136 -3.717 25.381 -19.219 1.00 43.15 O ATOM 2184 CB GLU A 136 -6.771 26.476 -18.261 1.00 11.31 C ATOM 2185 CG GLU A 136 -6.086 27.822 -18.433 1.00 14.22 C ATOM 2186 CD GLU A 136 -6.738 28.919 -17.619 1.00 62.14 C ATOM 2187 OE1 GLU A 136 -7.854 29.353 -17.983 1.00 30.13 O ATOM 2188 OE2 GLU A 136 -6.135 29.356 -16.617 1.00 31.44 O ATOM 0 H GLU A 136 -7.625 24.124 -18.295 1.00 42.10 H new ATOM 0 HA GLU A 136 -6.047 25.683 -20.113 1.00 44.33 H new ATOM 0 HB2 GLU A 136 -7.816 26.567 -18.556 1.00 11.31 H new ATOM 0 HB3 GLU A 136 -6.761 26.202 -17.206 1.00 11.31 H new ATOM 0 HG2 GLU A 136 -5.040 27.732 -18.141 1.00 14.22 H new ATOM 0 HG3 GLU A 136 -6.100 28.100 -19.487 1.00 14.22 H new ATOM 2195 N ALA A 137 -4.617 24.492 -17.365 1.00 43.53 N ATOM 2196 CA ALA A 137 -3.325 24.178 -16.762 1.00 1.32 C ATOM 2197 C ALA A 137 -2.622 23.046 -17.507 1.00 63.11 C ATOM 2198 O ALA A 137 -1.411 22.870 -17.387 1.00 64.10 O ATOM 2199 CB ALA A 137 -3.488 23.825 -15.293 1.00 41.45 C ATOM 0 H ALA A 137 -5.423 24.222 -16.801 1.00 43.53 H new ATOM 0 HA ALA A 137 -2.701 25.068 -16.839 1.00 1.32 H new ATOM 0 HB1 ALA A 137 -2.513 23.595 -14.864 1.00 41.45 H new ATOM 0 HB2 ALA A 137 -3.928 24.670 -14.762 1.00 41.45 H new ATOM 0 HB3 ALA A 137 -4.141 22.957 -15.198 1.00 41.45 H new ATOM 2205 N VAL A 138 -3.383 22.271 -18.270 1.00 40.32 N ATOM 2206 CA VAL A 138 -2.801 21.219 -19.094 1.00 32.21 C ATOM 2207 C VAL A 138 -1.885 21.824 -20.163 1.00 1.32 C ATOM 2208 O VAL A 138 -0.871 21.230 -20.535 1.00 62.12 O ATOM 2209 CB VAL A 138 -3.896 20.331 -19.742 1.00 42.44 C ATOM 2210 CG1 VAL A 138 -3.317 19.420 -20.817 1.00 23.32 C ATOM 2211 CG2 VAL A 138 -4.596 19.498 -18.678 1.00 14.00 C ATOM 0 H VAL A 138 -4.398 22.350 -18.335 1.00 40.32 H new ATOM 0 HA VAL A 138 -2.203 20.578 -18.446 1.00 32.21 H new ATOM 0 HB VAL A 138 -4.619 20.993 -20.217 1.00 42.44 H new ATOM 0 HG11 VAL A 138 -4.114 18.814 -21.248 1.00 23.32 H new ATOM 0 HG12 VAL A 138 -2.859 20.026 -21.599 1.00 23.32 H new ATOM 0 HG13 VAL A 138 -2.564 18.768 -20.375 1.00 23.32 H new ATOM 0 HG21 VAL A 138 -5.362 18.879 -19.146 1.00 14.00 H new ATOM 0 HG22 VAL A 138 -3.868 18.858 -18.179 1.00 14.00 H new ATOM 0 HG23 VAL A 138 -5.060 20.159 -17.946 1.00 14.00 H new ATOM 2221 N GLU A 139 -2.225 23.032 -20.606 1.00 30.13 N ATOM 2222 CA GLU A 139 -1.441 23.746 -21.610 1.00 61.53 C ATOM 2223 C GLU A 139 0.004 23.945 -21.155 1.00 32.44 C ATOM 2224 O GLU A 139 0.937 23.502 -21.821 1.00 73.43 O ATOM 2225 CB GLU A 139 -2.080 25.108 -21.901 1.00 33.42 C ATOM 2226 CG GLU A 139 -1.245 26.013 -22.799 1.00 64.34 C ATOM 2227 CD GLU A 139 -1.298 25.630 -24.264 1.00 32.50 C ATOM 2228 OE1 GLU A 139 -0.479 24.796 -24.704 1.00 35.44 O ATOM 2229 OE2 GLU A 139 -2.149 26.182 -24.993 1.00 61.13 O ATOM 0 H GLU A 139 -3.047 23.541 -20.281 1.00 30.13 H new ATOM 0 HA GLU A 139 -1.432 23.142 -22.517 1.00 61.53 H new ATOM 0 HB2 GLU A 139 -3.052 24.948 -22.369 1.00 33.42 H new ATOM 0 HB3 GLU A 139 -2.261 25.620 -20.956 1.00 33.42 H new ATOM 0 HG2 GLU A 139 -1.591 27.041 -22.688 1.00 64.34 H new ATOM 0 HG3 GLU A 139 -0.208 25.988 -22.463 1.00 64.34 H new ATOM 2236 N GLU A 140 0.182 24.584 -20.000 1.00 51.53 N ATOM 2237 CA GLU A 140 1.506 25.014 -19.553 1.00 31.51 C ATOM 2238 C GLU A 140 2.497 23.852 -19.438 1.00 62.34 C ATOM 2239 O GLU A 140 3.662 23.996 -19.805 1.00 33.33 O ATOM 2240 CB GLU A 140 1.412 25.790 -18.233 1.00 2.35 C ATOM 2241 CG GLU A 140 0.647 25.075 -17.134 1.00 42.54 C ATOM 2242 CD GLU A 140 0.606 25.870 -15.845 1.00 42.34 C ATOM 2243 OE1 GLU A 140 -0.298 26.720 -15.689 1.00 15.20 O ATOM 2244 OE2 GLU A 140 1.485 25.654 -14.983 1.00 2.41 O ATOM 0 H GLU A 140 -0.575 24.816 -19.356 1.00 51.53 H new ATOM 0 HA GLU A 140 1.896 25.681 -20.321 1.00 31.51 H new ATOM 0 HB2 GLU A 140 2.421 26.001 -17.878 1.00 2.35 H new ATOM 0 HB3 GLU A 140 0.934 26.751 -18.425 1.00 2.35 H new ATOM 0 HG2 GLU A 140 -0.372 24.882 -17.471 1.00 42.54 H new ATOM 0 HG3 GLU A 140 1.109 24.106 -16.945 1.00 42.54 H new ATOM 2251 N LYS A 141 2.039 22.697 -18.963 1.00 51.23 N ATOM 2252 CA LYS A 141 2.920 21.538 -18.833 1.00 5.04 C ATOM 2253 C LYS A 141 3.279 20.953 -20.193 1.00 54.43 C ATOM 2254 O LYS A 141 4.396 20.468 -20.386 1.00 23.31 O ATOM 2255 CB LYS A 141 2.303 20.444 -17.958 1.00 61.13 C ATOM 2256 CG LYS A 141 0.795 20.518 -17.842 1.00 62.44 C ATOM 2257 CD LYS A 141 0.255 19.352 -17.043 1.00 41.43 C ATOM 2258 CE LYS A 141 -1.152 19.630 -16.551 1.00 42.12 C ATOM 2259 NZ LYS A 141 -1.667 18.542 -15.681 1.00 64.34 N ATOM 0 H LYS A 141 1.076 22.538 -18.665 1.00 51.23 H new ATOM 0 HA LYS A 141 3.828 21.898 -18.350 1.00 5.04 H new ATOM 0 HB2 LYS A 141 2.577 19.471 -18.365 1.00 61.13 H new ATOM 0 HB3 LYS A 141 2.736 20.505 -16.960 1.00 61.13 H new ATOM 0 HG2 LYS A 141 0.509 21.455 -17.364 1.00 62.44 H new ATOM 0 HG3 LYS A 141 0.350 20.519 -18.837 1.00 62.44 H new ATOM 0 HD2 LYS A 141 0.257 18.453 -17.660 1.00 41.43 H new ATOM 0 HD3 LYS A 141 0.909 19.156 -16.193 1.00 41.43 H new ATOM 0 HE2 LYS A 141 -1.163 20.570 -15.999 1.00 42.12 H new ATOM 0 HE3 LYS A 141 -1.816 19.754 -17.406 1.00 42.12 H new ATOM 0 HZ1 LYS A 141 -2.410 18.918 -15.058 1.00 64.34 H new ATOM 0 HZ2 LYS A 141 -2.062 17.783 -16.272 1.00 64.34 H new ATOM 0 HZ3 LYS A 141 -0.890 18.162 -15.104 1.00 64.34 H new ATOM 2273 N LEU A 142 2.344 20.992 -21.136 1.00 25.54 N ATOM 2274 CA LEU A 142 2.596 20.407 -22.441 1.00 4.22 C ATOM 2275 C LEU A 142 3.495 21.322 -23.267 1.00 32.21 C ATOM 2276 O LEU A 142 4.482 20.865 -23.838 1.00 21.55 O ATOM 2277 CB LEU A 142 1.281 20.064 -23.178 1.00 11.32 C ATOM 2278 CG LEU A 142 0.448 21.229 -23.734 1.00 23.13 C ATOM 2279 CD1 LEU A 142 0.893 21.600 -25.144 1.00 13.43 C ATOM 2280 CD2 LEU A 142 -1.029 20.869 -23.728 1.00 74.45 C ATOM 0 H LEU A 142 1.423 21.415 -21.022 1.00 25.54 H new ATOM 0 HA LEU A 142 3.122 19.463 -22.297 1.00 4.22 H new ATOM 0 HB2 LEU A 142 1.525 19.401 -24.008 1.00 11.32 H new ATOM 0 HB3 LEU A 142 0.650 19.498 -22.492 1.00 11.32 H new ATOM 0 HG LEU A 142 0.606 22.094 -23.090 1.00 23.13 H new ATOM 0 HD11 LEU A 142 0.286 22.427 -25.511 1.00 13.43 H new ATOM 0 HD12 LEU A 142 1.941 21.899 -25.128 1.00 13.43 H new ATOM 0 HD13 LEU A 142 0.771 20.740 -25.802 1.00 13.43 H new ATOM 0 HD21 LEU A 142 -1.608 21.703 -24.124 1.00 74.45 H new ATOM 0 HD22 LEU A 142 -1.191 19.987 -24.348 1.00 74.45 H new ATOM 0 HD23 LEU A 142 -1.348 20.658 -22.707 1.00 74.45 H new ATOM 2292 N ARG A 143 3.189 22.622 -23.281 1.00 44.15 N ATOM 2293 CA ARG A 143 3.944 23.575 -24.093 1.00 62.33 C ATOM 2294 C ARG A 143 5.348 23.795 -23.540 1.00 52.13 C ATOM 2295 O ARG A 143 6.230 24.276 -24.245 1.00 12.12 O ATOM 2296 CB ARG A 143 3.183 24.908 -24.255 1.00 35.02 C ATOM 2297 CG ARG A 143 2.781 25.608 -22.957 1.00 72.32 C ATOM 2298 CD ARG A 143 3.944 26.333 -22.293 1.00 23.12 C ATOM 2299 NE ARG A 143 3.496 27.184 -21.191 1.00 34.43 N ATOM 2300 CZ ARG A 143 4.245 27.507 -20.136 1.00 23.11 C ATOM 2301 NH1 ARG A 143 5.513 27.116 -20.064 1.00 42.12 N ATOM 2302 NH2 ARG A 143 3.730 28.248 -19.162 1.00 63.53 N ATOM 0 H ARG A 143 2.428 23.035 -22.742 1.00 44.15 H new ATOM 0 HA ARG A 143 4.052 23.140 -25.086 1.00 62.33 H new ATOM 0 HB2 ARG A 143 3.803 25.590 -24.836 1.00 35.02 H new ATOM 0 HB3 ARG A 143 2.282 24.721 -24.839 1.00 35.02 H new ATOM 0 HG2 ARG A 143 1.985 26.323 -23.166 1.00 72.32 H new ATOM 0 HG3 ARG A 143 2.374 24.872 -22.264 1.00 72.32 H new ATOM 0 HD2 ARG A 143 4.662 25.603 -21.920 1.00 23.12 H new ATOM 0 HD3 ARG A 143 4.464 26.941 -23.034 1.00 23.12 H new ATOM 0 HE ARG A 143 2.547 27.555 -21.232 1.00 34.43 H new ATOM 0 HH11 ARG A 143 5.920 26.565 -20.819 1.00 42.12 H new ATOM 0 HH12 ARG A 143 6.079 27.367 -19.254 1.00 42.12 H new ATOM 0 HH21 ARG A 143 2.764 28.569 -19.222 1.00 63.53 H new ATOM 0 HH22 ARG A 143 4.301 28.496 -18.354 1.00 63.53 H new ATOM 2316 N ALA A 144 5.551 23.442 -22.276 1.00 60.40 N ATOM 2317 CA ALA A 144 6.871 23.539 -21.664 1.00 64.32 C ATOM 2318 C ALA A 144 7.832 22.532 -22.290 1.00 44.31 C ATOM 2319 O ALA A 144 9.051 22.687 -22.222 1.00 33.12 O ATOM 2320 CB ALA A 144 6.776 23.319 -20.161 1.00 40.13 C ATOM 0 H ALA A 144 4.822 23.087 -21.657 1.00 60.40 H new ATOM 0 HA ALA A 144 7.260 24.541 -21.845 1.00 64.32 H new ATOM 0 HB1 ALA A 144 7.769 23.394 -19.719 1.00 40.13 H new ATOM 0 HB2 ALA A 144 6.125 24.076 -19.723 1.00 40.13 H new ATOM 0 HB3 ALA A 144 6.365 22.329 -19.963 1.00 40.13 H new ATOM 2326 N THR A 145 7.275 21.495 -22.897 1.00 30.23 N ATOM 2327 CA THR A 145 8.076 20.466 -23.540 1.00 44.43 C ATOM 2328 C THR A 145 7.688 20.310 -25.006 1.00 33.32 C ATOM 2329 O THR A 145 8.067 19.337 -25.656 1.00 72.13 O ATOM 2330 CB THR A 145 7.917 19.117 -22.817 1.00 30.32 C ATOM 2331 OG1 THR A 145 6.549 18.937 -22.406 1.00 55.10 O ATOM 2332 CG2 THR A 145 8.838 19.035 -21.607 1.00 4.22 C ATOM 0 H THR A 145 6.268 21.344 -22.957 1.00 30.23 H new ATOM 0 HA THR A 145 9.119 20.777 -23.483 1.00 44.43 H new ATOM 0 HB THR A 145 8.192 18.323 -23.511 1.00 30.32 H new ATOM 0 HG1 THR A 145 6.313 17.987 -22.462 1.00 55.10 H new ATOM 0 HG21 THR A 145 8.706 18.072 -21.114 1.00 4.22 H new ATOM 0 HG22 THR A 145 9.874 19.138 -21.930 1.00 4.22 H new ATOM 0 HG23 THR A 145 8.594 19.836 -20.909 1.00 4.22 H new ATOM 2340 N ASP A 146 6.940 21.281 -25.517 1.00 25.14 N ATOM 2341 CA ASP A 146 6.438 21.229 -26.887 1.00 25.23 C ATOM 2342 C ASP A 146 6.968 22.427 -27.673 1.00 4.42 C ATOM 2343 O ASP A 146 7.901 23.100 -27.230 1.00 65.31 O ATOM 2344 CB ASP A 146 4.904 21.227 -26.880 1.00 61.12 C ATOM 2345 CG ASP A 146 4.299 20.616 -28.131 1.00 31.24 C ATOM 2346 OD1 ASP A 146 4.055 19.390 -28.146 1.00 62.21 O ATOM 2347 OD2 ASP A 146 4.032 21.362 -29.097 1.00 15.34 O ATOM 0 H ASP A 146 6.666 22.118 -25.002 1.00 25.14 H new ATOM 0 HA ASP A 146 6.784 20.313 -27.366 1.00 25.23 H new ATOM 0 HB2 ASP A 146 4.552 20.676 -26.008 1.00 61.12 H new ATOM 0 HB3 ASP A 146 4.547 22.251 -26.775 1.00 61.12 H new ATOM 2352 N ARG A 147 6.377 22.702 -28.825 1.00 35.23 N ATOM 2353 CA ARG A 147 6.830 23.797 -29.664 1.00 61.43 C ATOM 2354 C ARG A 147 5.890 24.987 -29.537 1.00 34.51 C ATOM 2355 O ARG A 147 4.747 24.951 -29.996 1.00 64.31 O ATOM 2356 CB ARG A 147 6.954 23.335 -31.117 1.00 22.12 C ATOM 2357 CG ARG A 147 7.984 22.230 -31.287 1.00 54.34 C ATOM 2358 CD ARG A 147 8.115 21.780 -32.731 1.00 41.42 C ATOM 2359 NE ARG A 147 9.158 20.765 -32.877 1.00 32.41 N ATOM 2360 CZ ARG A 147 9.481 20.174 -34.024 1.00 50.05 C ATOM 2361 NH1 ARG A 147 8.848 20.486 -35.146 1.00 41.14 N ATOM 2362 NH2 ARG A 147 10.447 19.268 -34.044 1.00 13.13 N ATOM 0 H ARG A 147 5.583 22.182 -29.199 1.00 35.23 H new ATOM 0 HA ARG A 147 7.817 24.116 -29.328 1.00 61.43 H new ATOM 0 HB2 ARG A 147 5.984 22.981 -31.467 1.00 22.12 H new ATOM 0 HB3 ARG A 147 7.229 24.184 -31.743 1.00 22.12 H new ATOM 0 HG2 ARG A 147 8.952 22.581 -30.929 1.00 54.34 H new ATOM 0 HG3 ARG A 147 7.705 21.378 -30.667 1.00 54.34 H new ATOM 0 HD2 ARG A 147 7.163 21.379 -33.077 1.00 41.42 H new ATOM 0 HD3 ARG A 147 8.348 22.638 -33.362 1.00 41.42 H new ATOM 0 HE ARG A 147 9.674 20.491 -32.041 1.00 32.41 H new ATOM 0 HH11 ARG A 147 8.105 21.185 -35.135 1.00 41.14 H new ATOM 0 HH12 ARG A 147 9.103 20.027 -36.020 1.00 41.14 H new ATOM 0 HH21 ARG A 147 10.938 19.027 -33.183 1.00 13.13 H new ATOM 0 HH22 ARG A 147 10.700 18.811 -34.920 1.00 13.13 H new ATOM 2376 N GLN A 148 6.382 26.029 -28.892 1.00 34.32 N ATOM 2377 CA GLN A 148 5.588 27.211 -28.601 1.00 23.45 C ATOM 2378 C GLN A 148 6.035 28.394 -29.458 1.00 35.23 C ATOM 2379 O GLN A 148 7.018 29.068 -29.089 1.00 35.01 O ATOM 2380 CB GLN A 148 5.691 27.546 -27.109 1.00 63.21 C ATOM 2381 CG GLN A 148 7.119 27.514 -26.572 1.00 71.44 C ATOM 2382 CD GLN A 148 7.206 27.857 -25.101 1.00 62.20 C ATOM 2383 OE1 GLN A 148 6.154 27.556 -24.361 1.00 62.24 O flip ATOM 2384 NE2 GLN A 148 8.209 28.395 -24.631 1.00 51.34 N flip ATOM 2385 OXT GLN A 148 5.407 28.639 -30.508 1.00 0.00 O ATOM 0 H GLN A 148 7.343 26.081 -28.555 1.00 34.32 H new ATOM 0 HA GLN A 148 4.546 27.004 -28.845 1.00 23.45 H new ATOM 0 HB2 GLN A 148 5.270 28.537 -26.938 1.00 63.21 H new ATOM 0 HB3 GLN A 148 5.083 26.839 -26.544 1.00 63.21 H new ATOM 0 HG2 GLN A 148 7.540 26.521 -26.733 1.00 71.44 H new ATOM 0 HG3 GLN A 148 7.730 28.215 -27.140 1.00 71.44 H new ATOM 0 HE21 GLN A 148 9.002 28.612 -25.235 1.00 51.34 H new ATOM 0 HE22 GLN A 148 8.247 28.624 -23.638 1.00 51.34 H new TER 2394 GLN A 148