USER MOD reduce.3.24.130724 H: found=0, std=0, add=1203, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1203 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 128 GLN : amide:sc= 0 K(o=-0.55,f=-1.4) USER MOD Set 1.2: A 130 GLN : amide:sc= -0.547 K(o=-0.55,f=-4.8!) USER MOD Set 2.1: A 96 GLN : amide:sc= -3.1 K(o=-2.7,f=-5.9!) USER MOD Set 2.2: A 110 TYR OH : rot -31:sc= 0.353 USER MOD Set 3.1: A 67 CYS SG : rot -123:sc= 1.2 USER MOD Set 3.2: A 98 CYS SG : rot 174:sc= 1.46 USER MOD Set 4.1: A 21 LYS NZ :NH3+ 172:sc= 1.27 (180deg=0) USER MOD Set 4.2: A 23 GLN : amide:sc= 0.933 K(o=2.2,f=-7.2!) USER MOD Set 5.1: A 15 TYR OH : rot -129:sc= 1.23 USER MOD Set 5.2: A 19 HIS : no HD1:sc= 0.967 K(o=2.2,f=-3.6!) USER MOD Set 6.1: A 1 MET N :NH3+ -168:sc= -0.0169 (180deg=-0.266) USER MOD Set 6.2: A 3 SER OG : rot 170:sc= -0.418 USER MOD Set 6.3: A 112 SER OG : rot -133:sc= 0.372 USER MOD Single : A 1 MET CE :methyl -161:sc= -0.103 (180deg=-0.617) USER MOD Single : A 6 LYS NZ :NH3+ -152:sc= -0.21 (180deg=-0.902) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 11 CYS SG : rot 45:sc= -4.1! USER MOD Single : A 12 LYS NZ :NH3+ -179:sc= 2.24 (180deg=2.2) USER MOD Single : A 13 ASN : amide:sc= -0.0165 X(o=-0.016,f=0) USER MOD Single : A 20 ASN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 22 HIS : no HD1:sc= -0.335 X(o=-0.34,f=-0.4) USER MOD Single : A 24 HIS : no HE2:sc= 0.568 K(o=0.57,f=-2.4!) USER MOD Single : A 25 SER OG : rot 48:sc= 0.605 USER MOD Single : A 26 TYR OH : rot 166:sc= 0.157 USER MOD Single : A 30 LYS NZ :NH3+ 178:sc= 1.03 (180deg=0.955) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 ASN : amide:sc= -0.293 X(o=-0.29,f=-0.5!) USER MOD Single : A 36 THR OG1 : rot 3:sc= 0.99 USER MOD Single : A 42 LYS NZ :NH3+ -172:sc= 1.84 (180deg=1.53) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 ASN : amide:sc= -0.248 X(o=-0.25,f=-0.076) USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 MET CE :methyl -133:sc= -0.207 (180deg=-0.428) USER MOD Single : A 58 LYS NZ :NH3+ -164:sc= 1.17 (180deg=0.927) USER MOD Single : A 59 LYS NZ :NH3+ 147:sc= -1.45 (180deg=-3.32!) USER MOD Single : A 65 LYS NZ :NH3+ -164:sc= 0.193 (180deg=0.114) USER MOD Single : A 69 TYR OH : rot 150:sc= 0 USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 GLN : amide:sc= 0 X(o=0,f=0.003) USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 86 THR OG1 : rot 50:sc= 0.0936 USER MOD Single : A 87 SER OG : rot 173:sc= -0.286 USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 ASN : amide:sc= 0.875 K(o=0.88,f=-0.2) USER MOD Single : A 91 LYS NZ :NH3+ 163:sc= -0.0341 (180deg=-0.28) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 ASN : amide:sc= -0.365 K(o=-0.36,f=-1.5) USER MOD Single : A 108 MET CE :methyl 157:sc= -0.184 (180deg=-0.743) USER MOD Single : A 113 SER OG : rot -16:sc= 0.878 USER MOD Single : A 118 LYS NZ :NH3+ 168:sc= 0.0984 (180deg=0.0251) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 84:sc= 1.37 USER MOD Single : A 134 MET CE :methyl 134:sc= -0.234 (180deg=-0.897) USER MOD Single : A 135 SER OG : rot -14:sc= 0.492 USER MOD Single : A 140 LYS NZ :NH3+ 174:sc=-0.00484 (180deg=-0.0616) USER MOD Single : A 141 SER OG : rot 180:sc= -0.518 USER MOD Single : A 143 LYS NZ :NH3+ -111:sc= 1.16 (180deg=0.67) USER MOD Single : A 144 SER OG : rot 134:sc= 0.866 USER MOD Single : A 147 MET CE :methyl -107:sc= -0.651 (180deg=-3!) USER MOD Single : A 148 SER OG : rot 75:sc= 0.885 USER MOD Single : A 149 ASN : amide:sc= 0.655 K(o=0.65,f=-0.72) USER MOD Single : A 150 GLN : amide:sc= -2.33! K(o=-2.3!,f=-4) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.434 -0.575 0.857 1.00 12.22 N ATOM 2 CA MET A 1 1.997 -0.746 -0.504 1.00 22.51 C ATOM 3 C MET A 1 1.844 -2.182 -0.981 1.00 55.31 C ATOM 4 O MET A 1 1.678 -2.433 -2.171 1.00 73.25 O ATOM 5 CB MET A 1 3.473 -0.342 -0.523 1.00 71.15 C ATOM 6 CG MET A 1 3.691 1.146 -0.313 1.00 40.32 C ATOM 7 SD MET A 1 5.434 1.618 -0.340 1.00 42.44 S ATOM 8 CE MET A 1 6.064 0.703 1.069 1.00 2.42 C ATOM 0 H1 MET A 1 1.364 0.439 1.079 1.00 12.22 H new ATOM 0 H2 MET A 1 0.488 -1.005 0.898 1.00 12.22 H new ATOM 0 H3 MET A 1 2.055 -1.039 1.550 1.00 12.22 H new ATOM 0 HA MET A 1 1.442 -0.098 -1.183 1.00 22.51 H new ATOM 0 HB2 MET A 1 4.003 -0.893 0.254 1.00 71.15 H new ATOM 0 HB3 MET A 1 3.911 -0.635 -1.477 1.00 71.15 H new ATOM 0 HG2 MET A 1 3.159 1.698 -1.088 1.00 40.32 H new ATOM 0 HG3 MET A 1 3.256 1.439 0.642 1.00 40.32 H new ATOM 0 HE1 MET A 1 7.013 1.134 1.388 1.00 2.42 H new ATOM 0 HE2 MET A 1 5.347 0.757 1.888 1.00 2.42 H new ATOM 0 HE3 MET A 1 6.216 -0.339 0.788 1.00 2.42 H new ATOM 20 N ALA A 2 1.884 -3.129 -0.055 1.00 54.55 N ATOM 21 CA ALA A 2 1.754 -4.529 -0.414 1.00 52.02 C ATOM 22 C ALA A 2 0.839 -5.273 0.548 1.00 23.44 C ATOM 23 O ALA A 2 1.180 -5.485 1.709 1.00 45.45 O ATOM 24 CB ALA A 2 3.122 -5.185 -0.462 1.00 73.41 C ATOM 0 H ALA A 2 2.005 -2.953 0.942 1.00 54.55 H new ATOM 0 HA ALA A 2 1.299 -4.580 -1.403 1.00 52.02 H new ATOM 0 HB1 ALA A 2 3.013 -6.235 -0.732 1.00 73.41 H new ATOM 0 HB2 ALA A 2 3.741 -4.682 -1.205 1.00 73.41 H new ATOM 0 HB3 ALA A 2 3.596 -5.110 0.517 1.00 73.41 H new ATOM 30 N SER A 3 -0.332 -5.646 0.059 1.00 32.42 N ATOM 31 CA SER A 3 -1.258 -6.474 0.817 1.00 55.24 C ATOM 32 C SER A 3 -2.065 -7.338 -0.146 1.00 41.51 C ATOM 33 O SER A 3 -1.832 -7.294 -1.359 1.00 13.02 O ATOM 34 CB SER A 3 -2.185 -5.604 1.677 1.00 74.53 C ATOM 35 OG SER A 3 -2.881 -4.652 0.890 1.00 12.12 O ATOM 0 H SER A 3 -0.667 -5.386 -0.869 1.00 32.42 H new ATOM 0 HA SER A 3 -0.694 -7.120 1.489 1.00 55.24 H new ATOM 0 HB2 SER A 3 -2.901 -6.239 2.199 1.00 74.53 H new ATOM 0 HB3 SER A 3 -1.600 -5.090 2.439 1.00 74.53 H new ATOM 0 HG SER A 3 -3.576 -4.225 1.432 1.00 12.12 H new ATOM 41 N GLY A 4 -2.997 -8.120 0.381 1.00 0.43 N ATOM 42 CA GLY A 4 -3.808 -8.982 -0.458 1.00 44.31 C ATOM 43 C GLY A 4 -4.898 -8.221 -1.185 1.00 2.42 C ATOM 44 O GLY A 4 -6.033 -8.145 -0.716 1.00 0.04 O ATOM 0 H GLY A 4 -3.207 -8.173 1.378 1.00 0.43 H new ATOM 0 HA2 GLY A 4 -3.169 -9.481 -1.187 1.00 44.31 H new ATOM 0 HA3 GLY A 4 -4.260 -9.761 0.156 1.00 44.31 H new ATOM 48 N VAL A 5 -4.551 -7.647 -2.327 1.00 55.13 N ATOM 49 CA VAL A 5 -5.505 -6.892 -3.120 1.00 73.15 C ATOM 50 C VAL A 5 -5.977 -7.724 -4.307 1.00 22.34 C ATOM 51 O VAL A 5 -5.191 -8.062 -5.193 1.00 73.05 O ATOM 52 CB VAL A 5 -4.904 -5.563 -3.626 1.00 21.32 C ATOM 53 CG1 VAL A 5 -5.958 -4.738 -4.350 1.00 32.45 C ATOM 54 CG2 VAL A 5 -4.301 -4.777 -2.470 1.00 4.35 C ATOM 0 H VAL A 5 -3.613 -7.691 -2.725 1.00 55.13 H new ATOM 0 HA VAL A 5 -6.352 -6.656 -2.476 1.00 73.15 H new ATOM 0 HB VAL A 5 -4.109 -5.792 -4.335 1.00 21.32 H new ATOM 0 HG11 VAL A 5 -5.514 -3.806 -4.699 1.00 32.45 H new ATOM 0 HG12 VAL A 5 -6.338 -5.300 -5.203 1.00 32.45 H new ATOM 0 HG13 VAL A 5 -6.779 -4.516 -3.668 1.00 32.45 H new ATOM 0 HG21 VAL A 5 -3.882 -3.843 -2.844 1.00 4.35 H new ATOM 0 HG22 VAL A 5 -5.076 -4.558 -1.735 1.00 4.35 H new ATOM 0 HG23 VAL A 5 -3.513 -5.366 -2.001 1.00 4.35 H new ATOM 64 N LYS A 6 -7.256 -8.062 -4.294 1.00 34.44 N ATOM 65 CA LYS A 6 -7.866 -8.870 -5.338 1.00 74.12 C ATOM 66 C LYS A 6 -7.777 -8.184 -6.700 1.00 34.13 C ATOM 67 O LYS A 6 -8.245 -7.054 -6.867 1.00 64.22 O ATOM 68 CB LYS A 6 -9.327 -9.110 -4.984 1.00 0.24 C ATOM 69 CG LYS A 6 -10.004 -10.191 -5.799 1.00 73.43 C ATOM 70 CD LYS A 6 -9.507 -11.567 -5.401 1.00 72.21 C ATOM 71 CE LYS A 6 -10.470 -12.648 -5.849 1.00 14.22 C ATOM 72 NZ LYS A 6 -11.819 -12.470 -5.250 1.00 65.32 N ATOM 0 H LYS A 6 -7.903 -7.783 -3.557 1.00 34.44 H new ATOM 0 HA LYS A 6 -7.328 -9.816 -5.404 1.00 74.12 H new ATOM 0 HB2 LYS A 6 -9.393 -9.374 -3.929 1.00 0.24 H new ATOM 0 HB3 LYS A 6 -9.876 -8.178 -5.114 1.00 0.24 H new ATOM 0 HG2 LYS A 6 -11.083 -10.136 -5.657 1.00 73.43 H new ATOM 0 HG3 LYS A 6 -9.813 -10.025 -6.859 1.00 73.43 H new ATOM 0 HD2 LYS A 6 -8.526 -11.744 -5.843 1.00 72.21 H new ATOM 0 HD3 LYS A 6 -9.382 -11.613 -4.319 1.00 72.21 H new ATOM 0 HE2 LYS A 6 -10.551 -12.635 -6.936 1.00 14.22 H new ATOM 0 HE3 LYS A 6 -10.075 -13.625 -5.570 1.00 14.22 H new ATOM 0 HZ1 LYS A 6 -12.287 -13.395 -5.167 1.00 65.32 H new ATOM 0 HZ2 LYS A 6 -11.726 -12.043 -4.306 1.00 65.32 H new ATOM 0 HZ3 LYS A 6 -12.389 -11.847 -5.857 1.00 65.32 H new ATOM 86 N VAL A 7 -7.178 -8.873 -7.662 1.00 43.33 N ATOM 87 CA VAL A 7 -7.098 -8.374 -9.029 1.00 14.42 C ATOM 88 C VAL A 7 -8.199 -8.996 -9.887 1.00 75.32 C ATOM 89 O VAL A 7 -8.562 -10.158 -9.700 1.00 34.22 O ATOM 90 CB VAL A 7 -5.717 -8.653 -9.669 1.00 33.32 C ATOM 91 CG1 VAL A 7 -4.629 -7.874 -8.947 1.00 73.20 C ATOM 92 CG2 VAL A 7 -5.402 -10.143 -9.664 1.00 44.03 C ATOM 0 H VAL A 7 -6.739 -9.783 -7.520 1.00 43.33 H new ATOM 0 HA VAL A 7 -7.234 -7.293 -8.986 1.00 14.42 H new ATOM 0 HB VAL A 7 -5.752 -8.321 -10.706 1.00 33.32 H new ATOM 0 HG11 VAL A 7 -3.664 -8.082 -9.410 1.00 73.20 H new ATOM 0 HG12 VAL A 7 -4.841 -6.807 -9.013 1.00 73.20 H new ATOM 0 HG13 VAL A 7 -4.601 -8.174 -7.899 1.00 73.20 H new ATOM 0 HG21 VAL A 7 -4.426 -10.310 -10.120 1.00 44.03 H new ATOM 0 HG22 VAL A 7 -5.391 -10.509 -8.637 1.00 44.03 H new ATOM 0 HG23 VAL A 7 -6.164 -10.678 -10.232 1.00 44.03 H new ATOM 102 N ASP A 8 -8.745 -8.211 -10.802 1.00 51.10 N ATOM 103 CA ASP A 8 -9.842 -8.667 -11.646 1.00 32.23 C ATOM 104 C ASP A 8 -9.378 -8.900 -13.082 1.00 11.50 C ATOM 105 O ASP A 8 -8.746 -8.033 -13.691 1.00 35.23 O ATOM 106 CB ASP A 8 -10.972 -7.643 -11.616 1.00 34.40 C ATOM 107 CG ASP A 8 -12.095 -7.968 -12.573 1.00 2.12 C ATOM 108 OD1 ASP A 8 -12.916 -8.852 -12.258 1.00 51.53 O ATOM 109 OD2 ASP A 8 -12.176 -7.322 -13.634 1.00 42.34 O ATOM 0 H ASP A 8 -8.447 -7.252 -10.981 1.00 51.10 H new ATOM 0 HA ASP A 8 -10.203 -9.618 -11.255 1.00 32.23 H new ATOM 0 HB2 ASP A 8 -11.372 -7.582 -10.604 1.00 34.40 H new ATOM 0 HB3 ASP A 8 -10.569 -6.660 -11.859 1.00 34.40 H new ATOM 114 N PRO A 9 -9.690 -10.082 -13.637 1.00 12.43 N ATOM 115 CA PRO A 9 -9.290 -10.458 -14.998 1.00 53.03 C ATOM 116 C PRO A 9 -9.983 -9.624 -16.073 1.00 71.20 C ATOM 117 O PRO A 9 -9.436 -9.415 -17.154 1.00 11.22 O ATOM 118 CB PRO A 9 -9.717 -11.924 -15.109 1.00 61.02 C ATOM 119 CG PRO A 9 -10.799 -12.084 -14.100 1.00 53.14 C ATOM 120 CD PRO A 9 -10.450 -11.156 -12.972 1.00 74.32 C ATOM 0 HA PRO A 9 -8.224 -10.294 -15.158 1.00 53.03 H new ATOM 0 HB2 PRO A 9 -10.074 -12.157 -16.112 1.00 61.02 H new ATOM 0 HB3 PRO A 9 -8.883 -12.595 -14.904 1.00 61.02 H new ATOM 0 HG2 PRO A 9 -11.770 -11.833 -14.526 1.00 53.14 H new ATOM 0 HG3 PRO A 9 -10.860 -13.115 -13.753 1.00 53.14 H new ATOM 0 HD2 PRO A 9 -11.342 -10.771 -12.478 1.00 74.32 H new ATOM 0 HD3 PRO A 9 -9.854 -11.657 -12.209 1.00 74.32 H new ATOM 128 N SER A 10 -11.182 -9.143 -15.774 1.00 72.24 N ATOM 129 CA SER A 10 -11.940 -8.348 -16.726 1.00 71.53 C ATOM 130 C SER A 10 -11.288 -6.981 -16.910 1.00 24.22 C ATOM 131 O SER A 10 -11.263 -6.437 -18.015 1.00 42.51 O ATOM 132 CB SER A 10 -13.383 -8.198 -16.248 1.00 22.01 C ATOM 133 OG SER A 10 -13.935 -9.465 -15.930 1.00 2.11 O ATOM 0 H SER A 10 -11.649 -9.290 -14.879 1.00 72.24 H new ATOM 0 HA SER A 10 -11.945 -8.857 -17.690 1.00 71.53 H new ATOM 0 HB2 SER A 10 -13.417 -7.550 -15.372 1.00 22.01 H new ATOM 0 HB3 SER A 10 -13.981 -7.718 -17.023 1.00 22.01 H new ATOM 0 HG SER A 10 -14.859 -9.352 -15.624 1.00 2.11 H new ATOM 139 N CYS A 11 -10.756 -6.439 -15.822 1.00 54.54 N ATOM 140 CA CYS A 11 -10.012 -5.190 -15.868 1.00 12.12 C ATOM 141 C CYS A 11 -8.763 -5.341 -16.729 1.00 12.14 C ATOM 142 O CYS A 11 -8.458 -4.478 -17.550 1.00 61.41 O ATOM 143 CB CYS A 11 -9.632 -4.758 -14.455 1.00 21.52 C ATOM 144 SG CYS A 11 -11.044 -4.593 -13.346 1.00 13.32 S ATOM 0 H CYS A 11 -10.828 -6.850 -14.891 1.00 54.54 H new ATOM 0 HA CYS A 11 -10.645 -4.423 -16.315 1.00 12.12 H new ATOM 0 HB2 CYS A 11 -8.935 -5.485 -14.037 1.00 21.52 H new ATOM 0 HB3 CYS A 11 -9.106 -3.804 -14.505 1.00 21.52 H new ATOM 0 HG CYS A 11 -11.833 -5.615 -13.494 1.00 13.32 H new ATOM 150 N LYS A 12 -8.049 -6.445 -16.545 1.00 15.01 N ATOM 151 CA LYS A 12 -6.878 -6.745 -17.363 1.00 63.34 C ATOM 152 C LYS A 12 -7.291 -6.975 -18.814 1.00 41.43 C ATOM 153 O LYS A 12 -6.621 -6.515 -19.736 1.00 63.34 O ATOM 154 CB LYS A 12 -6.143 -7.966 -16.796 1.00 12.05 C ATOM 155 CG LYS A 12 -5.078 -8.561 -17.709 1.00 45.21 C ATOM 156 CD LYS A 12 -4.066 -7.529 -18.189 1.00 53.00 C ATOM 157 CE LYS A 12 -2.794 -8.206 -18.680 1.00 24.30 C ATOM 158 NZ LYS A 12 -1.882 -7.271 -19.390 1.00 43.34 N ATOM 0 H LYS A 12 -8.260 -7.148 -15.837 1.00 15.01 H new ATOM 0 HA LYS A 12 -6.197 -5.894 -17.339 1.00 63.34 H new ATOM 0 HB2 LYS A 12 -5.675 -7.683 -15.853 1.00 12.05 H new ATOM 0 HB3 LYS A 12 -6.877 -8.739 -16.568 1.00 12.05 H new ATOM 0 HG2 LYS A 12 -4.555 -9.356 -17.178 1.00 45.21 H new ATOM 0 HG3 LYS A 12 -5.561 -9.018 -18.573 1.00 45.21 H new ATOM 0 HD2 LYS A 12 -4.500 -6.934 -18.993 1.00 53.00 H new ATOM 0 HD3 LYS A 12 -3.827 -6.842 -17.377 1.00 53.00 H new ATOM 0 HE2 LYS A 12 -2.269 -8.643 -17.831 1.00 24.30 H new ATOM 0 HE3 LYS A 12 -3.059 -9.026 -19.348 1.00 24.30 H new ATOM 0 HZ1 LYS A 12 -1.041 -7.788 -19.717 1.00 43.34 H new ATOM 0 HZ2 LYS A 12 -2.375 -6.859 -20.208 1.00 43.34 H new ATOM 0 HZ3 LYS A 12 -1.591 -6.511 -18.742 1.00 43.34 H new ATOM 172 N ASN A 13 -8.404 -7.670 -19.004 1.00 5.21 N ATOM 173 CA ASN A 13 -8.963 -7.887 -20.334 1.00 3.42 C ATOM 174 C ASN A 13 -9.231 -6.554 -21.023 1.00 22.22 C ATOM 175 O ASN A 13 -8.910 -6.374 -22.194 1.00 22.31 O ATOM 176 CB ASN A 13 -10.255 -8.707 -20.234 1.00 12.14 C ATOM 177 CG ASN A 13 -10.951 -8.892 -21.571 1.00 11.15 C ATOM 178 OD1 ASN A 13 -10.653 -9.829 -22.312 1.00 1.54 O ATOM 179 ND2 ASN A 13 -11.896 -8.013 -21.877 1.00 42.53 N ATOM 0 H ASN A 13 -8.942 -8.096 -18.249 1.00 5.21 H new ATOM 0 HA ASN A 13 -8.240 -8.443 -20.931 1.00 3.42 H new ATOM 0 HB2 ASN A 13 -10.025 -9.686 -19.813 1.00 12.14 H new ATOM 0 HB3 ASN A 13 -10.938 -8.215 -19.541 1.00 12.14 H new ATOM 0 HD21 ASN A 13 -12.407 -8.099 -22.755 1.00 42.53 H new ATOM 0 HD22 ASN A 13 -12.111 -7.251 -21.234 1.00 42.53 H new ATOM 186 N ALA A 14 -9.793 -5.612 -20.275 1.00 43.44 N ATOM 187 CA ALA A 14 -10.119 -4.297 -20.815 1.00 30.44 C ATOM 188 C ALA A 14 -8.858 -3.464 -21.010 1.00 64.54 C ATOM 189 O ALA A 14 -8.751 -2.693 -21.965 1.00 21.01 O ATOM 190 CB ALA A 14 -11.098 -3.576 -19.900 1.00 65.44 C ATOM 0 H ALA A 14 -10.033 -5.734 -19.291 1.00 43.44 H new ATOM 0 HA ALA A 14 -10.590 -4.434 -21.789 1.00 30.44 H new ATOM 0 HB1 ALA A 14 -11.331 -2.596 -20.317 1.00 65.44 H new ATOM 0 HB2 ALA A 14 -12.014 -4.161 -19.814 1.00 65.44 H new ATOM 0 HB3 ALA A 14 -10.651 -3.454 -18.913 1.00 65.44 H new ATOM 196 N TYR A 15 -7.904 -3.631 -20.103 1.00 11.53 N ATOM 197 CA TYR A 15 -6.642 -2.915 -20.180 1.00 61.23 C ATOM 198 C TYR A 15 -5.817 -3.390 -21.371 1.00 74.12 C ATOM 199 O TYR A 15 -5.241 -2.585 -22.102 1.00 71.24 O ATOM 200 CB TYR A 15 -5.842 -3.094 -18.884 1.00 61.34 C ATOM 201 CG TYR A 15 -4.405 -2.643 -19.003 1.00 32.15 C ATOM 202 CD1 TYR A 15 -4.075 -1.295 -19.004 1.00 3.52 C ATOM 203 CD2 TYR A 15 -3.381 -3.571 -19.142 1.00 61.24 C ATOM 204 CE1 TYR A 15 -2.763 -0.885 -19.139 1.00 54.10 C ATOM 205 CE2 TYR A 15 -2.069 -3.168 -19.282 1.00 53.22 C ATOM 206 CZ TYR A 15 -1.765 -1.825 -19.280 1.00 44.53 C ATOM 207 OH TYR A 15 -0.459 -1.423 -19.434 1.00 13.24 O ATOM 0 H TYR A 15 -7.983 -4.259 -19.303 1.00 11.53 H new ATOM 0 HA TYR A 15 -6.865 -1.857 -20.314 1.00 61.23 H new ATOM 0 HB2 TYR A 15 -6.327 -2.533 -18.085 1.00 61.34 H new ATOM 0 HB3 TYR A 15 -5.863 -4.144 -18.594 1.00 61.34 H new ATOM 0 HD1 TYR A 15 -4.855 -0.556 -18.898 1.00 3.52 H new ATOM 0 HD2 TYR A 15 -3.616 -4.625 -19.140 1.00 61.24 H new ATOM 0 HE1 TYR A 15 -2.520 0.167 -19.134 1.00 54.10 H new ATOM 0 HE2 TYR A 15 -1.285 -3.902 -19.393 1.00 53.22 H new ATOM 0 HH TYR A 15 -0.070 -1.867 -20.216 1.00 13.24 H new ATOM 217 N ASP A 16 -5.762 -4.695 -21.574 1.00 25.14 N ATOM 218 CA ASP A 16 -4.928 -5.250 -22.626 1.00 22.21 C ATOM 219 C ASP A 16 -5.499 -4.918 -23.995 1.00 1.41 C ATOM 220 O ASP A 16 -4.785 -4.942 -24.995 1.00 3.44 O ATOM 221 CB ASP A 16 -4.750 -6.753 -22.465 1.00 33.23 C ATOM 222 CG ASP A 16 -3.334 -7.170 -22.801 1.00 21.23 C ATOM 223 OD1 ASP A 16 -2.442 -6.975 -21.946 1.00 31.33 O ATOM 224 OD2 ASP A 16 -3.101 -7.682 -23.912 1.00 23.32 O ATOM 0 H ASP A 16 -6.280 -5.385 -21.030 1.00 25.14 H new ATOM 0 HA ASP A 16 -3.942 -4.792 -22.542 1.00 22.21 H new ATOM 0 HB2 ASP A 16 -4.985 -7.043 -21.441 1.00 33.23 H new ATOM 0 HB3 ASP A 16 -5.451 -7.278 -23.114 1.00 33.23 H new ATOM 229 N LEU A 17 -6.790 -4.603 -24.037 1.00 50.42 N ATOM 230 CA LEU A 17 -7.415 -4.128 -25.263 1.00 22.01 C ATOM 231 C LEU A 17 -6.666 -2.912 -25.804 1.00 72.52 C ATOM 232 O LEU A 17 -6.436 -2.805 -27.005 1.00 3.12 O ATOM 233 CB LEU A 17 -8.885 -3.772 -25.033 1.00 71.42 C ATOM 234 CG LEU A 17 -9.806 -4.955 -24.730 1.00 33.05 C ATOM 235 CD1 LEU A 17 -11.218 -4.471 -24.450 1.00 34.32 C ATOM 236 CD2 LEU A 17 -9.803 -5.944 -25.885 1.00 70.12 C ATOM 0 H LEU A 17 -7.421 -4.668 -23.238 1.00 50.42 H new ATOM 0 HA LEU A 17 -7.368 -4.934 -25.995 1.00 22.01 H new ATOM 0 HB2 LEU A 17 -8.945 -3.065 -24.205 1.00 71.42 H new ATOM 0 HB3 LEU A 17 -9.260 -3.259 -25.918 1.00 71.42 H new ATOM 0 HG LEU A 17 -9.432 -5.463 -23.841 1.00 33.05 H new ATOM 0 HD11 LEU A 17 -11.860 -5.326 -24.236 1.00 34.32 H new ATOM 0 HD12 LEU A 17 -11.209 -3.800 -23.591 1.00 34.32 H new ATOM 0 HD13 LEU A 17 -11.600 -3.939 -25.321 1.00 34.32 H new ATOM 0 HD21 LEU A 17 -10.464 -6.779 -25.651 1.00 70.12 H new ATOM 0 HD22 LEU A 17 -10.152 -5.447 -26.790 1.00 70.12 H new ATOM 0 HD23 LEU A 17 -8.791 -6.316 -26.043 1.00 70.12 H new ATOM 248 N LEU A 18 -6.294 -1.992 -24.920 1.00 71.01 N ATOM 249 CA LEU A 18 -5.506 -0.831 -25.323 1.00 1.34 C ATOM 250 C LEU A 18 -4.013 -1.164 -25.354 1.00 73.31 C ATOM 251 O LEU A 18 -3.276 -0.660 -26.195 1.00 14.31 O ATOM 252 CB LEU A 18 -5.796 0.377 -24.412 1.00 50.02 C ATOM 253 CG LEU A 18 -5.516 0.209 -22.915 1.00 11.05 C ATOM 254 CD1 LEU A 18 -4.072 0.566 -22.583 1.00 34.01 C ATOM 255 CD2 LEU A 18 -6.476 1.064 -22.103 1.00 2.25 C ATOM 0 H LEU A 18 -6.523 -2.026 -23.927 1.00 71.01 H new ATOM 0 HA LEU A 18 -5.802 -0.558 -26.336 1.00 1.34 H new ATOM 0 HB2 LEU A 18 -5.208 1.221 -24.773 1.00 50.02 H new ATOM 0 HB3 LEU A 18 -6.846 0.646 -24.531 1.00 50.02 H new ATOM 0 HG LEU A 18 -5.670 -0.838 -22.655 1.00 11.05 H new ATOM 0 HD11 LEU A 18 -3.902 0.438 -21.514 1.00 34.01 H new ATOM 0 HD12 LEU A 18 -3.399 -0.087 -23.139 1.00 34.01 H new ATOM 0 HD13 LEU A 18 -3.881 1.603 -22.859 1.00 34.01 H new ATOM 0 HD21 LEU A 18 -6.267 0.936 -21.041 1.00 2.25 H new ATOM 0 HD22 LEU A 18 -6.349 2.112 -22.374 1.00 2.25 H new ATOM 0 HD23 LEU A 18 -7.501 0.757 -22.311 1.00 2.25 H new ATOM 267 N HIS A 19 -3.592 -2.041 -24.449 1.00 1.10 N ATOM 268 CA HIS A 19 -2.182 -2.406 -24.303 1.00 4.02 C ATOM 269 C HIS A 19 -1.669 -3.172 -25.523 1.00 21.52 C ATOM 270 O HIS A 19 -0.529 -2.993 -25.943 1.00 70.43 O ATOM 271 CB HIS A 19 -2.007 -3.250 -23.029 1.00 63.14 C ATOM 272 CG HIS A 19 -0.592 -3.657 -22.715 1.00 75.40 C ATOM 273 ND1 HIS A 19 0.185 -3.019 -21.769 1.00 15.53 N ATOM 274 CD2 HIS A 19 0.166 -4.677 -23.189 1.00 34.03 C ATOM 275 CE1 HIS A 19 1.355 -3.627 -21.680 1.00 72.40 C ATOM 276 NE2 HIS A 19 1.370 -4.637 -22.527 1.00 61.11 N ATOM 0 H HIS A 19 -4.214 -2.519 -23.797 1.00 1.10 H new ATOM 0 HA HIS A 19 -1.594 -1.491 -24.224 1.00 4.02 H new ATOM 0 HB2 HIS A 19 -2.402 -2.687 -22.183 1.00 63.14 H new ATOM 0 HB3 HIS A 19 -2.614 -4.150 -23.124 1.00 63.14 H new ATOM 0 HD2 HIS A 19 -0.123 -5.390 -23.947 1.00 34.03 H new ATOM 0 HE1 HIS A 19 2.164 -3.344 -21.023 1.00 72.40 H new ATOM 0 HE2 HIS A 19 2.147 -5.283 -22.668 1.00 61.11 H new ATOM 285 N ASN A 20 -2.508 -4.033 -26.077 1.00 50.23 N ATOM 286 CA ASN A 20 -2.104 -4.887 -27.189 1.00 21.01 C ATOM 287 C ASN A 20 -2.703 -4.415 -28.511 1.00 62.15 C ATOM 288 O ASN A 20 -1.988 -4.201 -29.489 1.00 15.51 O ATOM 289 CB ASN A 20 -2.547 -6.329 -26.926 1.00 62.52 C ATOM 290 CG ASN A 20 -2.102 -7.289 -28.013 1.00 2.25 C ATOM 291 OD1 ASN A 20 -2.776 -7.451 -29.033 1.00 23.01 O ATOM 292 ND2 ASN A 20 -0.979 -7.955 -27.791 1.00 71.24 N ATOM 0 H ASN A 20 -3.474 -4.161 -25.776 1.00 50.23 H new ATOM 0 HA ASN A 20 -1.018 -4.834 -27.266 1.00 21.01 H new ATOM 0 HB2 ASN A 20 -2.144 -6.659 -25.969 1.00 62.52 H new ATOM 0 HB3 ASN A 20 -3.633 -6.361 -26.842 1.00 62.52 H new ATOM 0 HD21 ASN A 20 -0.643 -8.631 -28.477 1.00 71.24 H new ATOM 0 HD22 ASN A 20 -0.450 -7.792 -26.934 1.00 71.24 H new ATOM 299 N LYS A 21 -4.021 -4.264 -28.533 1.00 33.52 N ATOM 300 CA LYS A 21 -4.748 -3.988 -29.764 1.00 4.42 C ATOM 301 C LYS A 21 -4.859 -2.482 -30.018 1.00 32.01 C ATOM 302 O LYS A 21 -4.950 -2.041 -31.165 1.00 64.32 O ATOM 303 CB LYS A 21 -6.134 -4.632 -29.652 1.00 75.40 C ATOM 304 CG LYS A 21 -6.852 -4.835 -30.972 1.00 61.44 C ATOM 305 CD LYS A 21 -7.515 -3.569 -31.470 1.00 73.22 C ATOM 306 CE LYS A 21 -8.253 -3.837 -32.755 1.00 34.12 C ATOM 307 NZ LYS A 21 -8.994 -2.646 -33.239 1.00 30.15 N ATOM 0 H LYS A 21 -4.612 -4.329 -27.704 1.00 33.52 H new ATOM 0 HA LYS A 21 -4.209 -4.409 -30.613 1.00 4.42 H new ATOM 0 HB2 LYS A 21 -6.031 -5.599 -29.159 1.00 75.40 H new ATOM 0 HB3 LYS A 21 -6.756 -4.011 -29.008 1.00 75.40 H new ATOM 0 HG2 LYS A 21 -6.140 -5.187 -31.719 1.00 61.44 H new ATOM 0 HG3 LYS A 21 -7.605 -5.615 -30.857 1.00 61.44 H new ATOM 0 HD2 LYS A 21 -8.207 -3.192 -30.717 1.00 73.22 H new ATOM 0 HD3 LYS A 21 -6.764 -2.795 -31.628 1.00 73.22 H new ATOM 0 HE2 LYS A 21 -7.544 -4.156 -33.519 1.00 34.12 H new ATOM 0 HE3 LYS A 21 -8.951 -4.660 -32.605 1.00 34.12 H new ATOM 0 HZ1 LYS A 21 -9.373 -2.835 -34.189 1.00 30.15 H new ATOM 0 HZ2 LYS A 21 -9.778 -2.437 -32.589 1.00 30.15 H new ATOM 0 HZ3 LYS A 21 -8.351 -1.830 -33.279 1.00 30.15 H new ATOM 321 N HIS A 22 -4.850 -1.715 -28.931 1.00 31.13 N ATOM 322 CA HIS A 22 -5.006 -0.256 -28.967 1.00 21.33 C ATOM 323 C HIS A 22 -6.462 0.088 -29.272 1.00 12.52 C ATOM 324 O HIS A 22 -6.767 1.062 -29.957 1.00 72.10 O ATOM 325 CB HIS A 22 -4.050 0.387 -29.990 1.00 74.53 C ATOM 326 CG HIS A 22 -3.924 1.880 -29.857 1.00 3.42 C ATOM 327 ND1 HIS A 22 -4.512 2.771 -30.731 1.00 62.23 N ATOM 328 CD2 HIS A 22 -3.256 2.634 -28.951 1.00 53.31 C ATOM 329 CE1 HIS A 22 -4.212 4.004 -30.367 1.00 21.43 C ATOM 330 NE2 HIS A 22 -3.454 3.950 -29.290 1.00 64.04 N ATOM 0 H HIS A 22 -4.733 -2.089 -27.989 1.00 31.13 H new ATOM 0 HA HIS A 22 -4.742 0.153 -27.991 1.00 21.33 H new ATOM 0 HB2 HIS A 22 -3.063 -0.062 -29.881 1.00 74.53 H new ATOM 0 HB3 HIS A 22 -4.398 0.150 -30.995 1.00 74.53 H new ATOM 0 HD2 HIS A 22 -2.676 2.268 -28.117 1.00 53.31 H new ATOM 0 HE1 HIS A 22 -4.534 4.905 -30.868 1.00 21.43 H new ATOM 0 HE2 HIS A 22 -3.076 4.755 -28.790 1.00 64.04 H new ATOM 339 N GLN A 23 -7.363 -0.722 -28.728 1.00 61.41 N ATOM 340 CA GLN A 23 -8.795 -0.535 -28.931 1.00 13.42 C ATOM 341 C GLN A 23 -9.304 0.668 -28.136 1.00 70.01 C ATOM 342 O GLN A 23 -10.320 1.270 -28.473 1.00 43.13 O ATOM 343 CB GLN A 23 -9.547 -1.803 -28.512 1.00 71.05 C ATOM 344 CG GLN A 23 -11.040 -1.758 -28.790 1.00 45.24 C ATOM 345 CD GLN A 23 -11.354 -1.598 -30.264 1.00 24.32 C ATOM 346 OE1 GLN A 23 -10.606 -2.058 -31.124 1.00 53.20 O ATOM 347 NE2 GLN A 23 -12.454 -0.932 -30.561 1.00 25.35 N ATOM 0 H GLN A 23 -7.125 -1.520 -28.139 1.00 61.41 H new ATOM 0 HA GLN A 23 -8.975 -0.343 -29.989 1.00 13.42 H new ATOM 0 HB2 GLN A 23 -9.116 -2.657 -29.034 1.00 71.05 H new ATOM 0 HB3 GLN A 23 -9.391 -1.970 -27.446 1.00 71.05 H new ATOM 0 HG2 GLN A 23 -11.502 -2.674 -28.421 1.00 45.24 H new ATOM 0 HG3 GLN A 23 -11.484 -0.931 -28.236 1.00 45.24 H new ATOM 0 HE21 GLN A 23 -13.046 -0.567 -29.815 1.00 25.35 H new ATOM 0 HE22 GLN A 23 -12.712 -0.782 -31.536 1.00 25.35 H new ATOM 356 N HIS A 24 -8.590 1.007 -27.074 1.00 14.21 N ATOM 357 CA HIS A 24 -8.947 2.142 -26.231 1.00 41.21 C ATOM 358 C HIS A 24 -7.695 2.956 -25.930 1.00 5.25 C ATOM 359 O HIS A 24 -6.596 2.548 -26.294 1.00 21.02 O ATOM 360 CB HIS A 24 -9.599 1.684 -24.919 1.00 73.23 C ATOM 361 CG HIS A 24 -10.883 0.919 -25.092 1.00 10.34 C ATOM 362 ND1 HIS A 24 -12.101 1.513 -25.349 1.00 2.52 N ATOM 363 CD2 HIS A 24 -11.132 -0.412 -25.019 1.00 52.34 C ATOM 364 CE1 HIS A 24 -13.034 0.585 -25.426 1.00 64.11 C ATOM 365 NE2 HIS A 24 -12.478 -0.593 -25.229 1.00 51.30 N ATOM 0 H HIS A 24 -7.753 0.509 -26.772 1.00 14.21 H new ATOM 0 HA HIS A 24 -9.672 2.755 -26.767 1.00 41.21 H new ATOM 0 HB2 HIS A 24 -8.890 1.060 -24.375 1.00 73.23 H new ATOM 0 HB3 HIS A 24 -9.794 2.560 -24.300 1.00 73.23 H new ATOM 0 HD1 HIS A 24 -12.256 2.515 -25.462 1.00 2.52 H new ATOM 0 HD2 HIS A 24 -10.405 -1.188 -24.830 1.00 52.34 H new ATOM 0 HE1 HIS A 24 -14.082 0.761 -25.619 1.00 64.11 H new ATOM 374 N SER A 25 -7.858 4.109 -25.302 1.00 44.22 N ATOM 375 CA SER A 25 -6.713 4.922 -24.916 1.00 34.14 C ATOM 376 C SER A 25 -6.646 5.068 -23.398 1.00 54.14 C ATOM 377 O SER A 25 -5.569 5.020 -22.809 1.00 25.31 O ATOM 378 CB SER A 25 -6.783 6.299 -25.585 1.00 13.04 C ATOM 379 OG SER A 25 -5.684 7.118 -25.219 1.00 71.14 O ATOM 0 H SER A 25 -8.765 4.502 -25.049 1.00 44.22 H new ATOM 0 HA SER A 25 -5.806 4.420 -25.253 1.00 34.14 H new ATOM 0 HB2 SER A 25 -6.801 6.177 -26.668 1.00 13.04 H new ATOM 0 HB3 SER A 25 -7.714 6.793 -25.305 1.00 13.04 H new ATOM 0 HG SER A 25 -4.851 6.612 -25.319 1.00 71.14 H new ATOM 385 N TYR A 26 -7.802 5.220 -22.766 1.00 23.13 N ATOM 386 CA TYR A 26 -7.850 5.453 -21.328 1.00 3.15 C ATOM 387 C TYR A 26 -8.607 4.330 -20.631 1.00 43.43 C ATOM 388 O TYR A 26 -9.581 3.818 -21.171 1.00 73.11 O ATOM 389 CB TYR A 26 -8.563 6.775 -21.029 1.00 63.41 C ATOM 390 CG TYR A 26 -8.156 7.932 -21.921 1.00 44.43 C ATOM 391 CD1 TYR A 26 -6.919 8.543 -21.783 1.00 14.12 C ATOM 392 CD2 TYR A 26 -9.020 8.419 -22.896 1.00 61.34 C ATOM 393 CE1 TYR A 26 -6.551 9.604 -22.590 1.00 74.31 C ATOM 394 CE2 TYR A 26 -8.659 9.480 -23.706 1.00 73.34 C ATOM 395 CZ TYR A 26 -7.424 10.069 -23.547 1.00 11.34 C ATOM 396 OH TYR A 26 -7.060 11.127 -24.347 1.00 52.01 O ATOM 0 H TYR A 26 -8.714 5.187 -23.222 1.00 23.13 H new ATOM 0 HA TYR A 26 -6.825 5.490 -20.960 1.00 3.15 H new ATOM 0 HB2 TYR A 26 -9.638 6.622 -21.124 1.00 63.41 H new ATOM 0 HB3 TYR A 26 -8.371 7.049 -19.992 1.00 63.41 H new ATOM 0 HD1 TYR A 26 -6.231 8.184 -21.032 1.00 14.12 H new ATOM 0 HD2 TYR A 26 -9.990 7.961 -23.023 1.00 61.34 H new ATOM 0 HE1 TYR A 26 -5.582 10.066 -22.470 1.00 74.31 H new ATOM 0 HE2 TYR A 26 -9.342 9.845 -24.459 1.00 73.34 H new ATOM 0 HH TYR A 26 -7.679 11.193 -25.104 1.00 52.01 H new ATOM 406 N ILE A 27 -8.141 3.915 -19.464 1.00 61.12 N ATOM 407 CA ILE A 27 -8.923 3.030 -18.613 1.00 73.42 C ATOM 408 C ILE A 27 -8.668 3.363 -17.129 1.00 44.55 C ATOM 409 O ILE A 27 -7.524 3.393 -16.670 1.00 62.41 O ATOM 410 CB ILE A 27 -8.648 1.534 -18.953 1.00 25.24 C ATOM 411 CG1 ILE A 27 -9.806 0.627 -18.508 1.00 30.52 C ATOM 412 CG2 ILE A 27 -7.340 1.053 -18.365 1.00 73.33 C ATOM 413 CD1 ILE A 27 -9.952 0.458 -17.011 1.00 4.24 C ATOM 0 H ILE A 27 -7.230 4.174 -19.085 1.00 61.12 H new ATOM 0 HA ILE A 27 -9.983 3.194 -18.805 1.00 73.42 H new ATOM 0 HB ILE A 27 -8.569 1.471 -20.038 1.00 25.24 H new ATOM 0 HG12 ILE A 27 -10.737 1.032 -18.905 1.00 30.52 H new ATOM 0 HG13 ILE A 27 -9.670 -0.357 -18.957 1.00 30.52 H new ATOM 0 HG21 ILE A 27 -7.187 0.006 -18.626 1.00 73.33 H new ATOM 0 HG22 ILE A 27 -6.520 1.650 -18.765 1.00 73.33 H new ATOM 0 HG23 ILE A 27 -7.369 1.156 -17.280 1.00 73.33 H new ATOM 0 HD11 ILE A 27 -10.796 -0.199 -16.800 1.00 4.24 H new ATOM 0 HD12 ILE A 27 -9.041 0.020 -16.604 1.00 4.24 H new ATOM 0 HD13 ILE A 27 -10.125 1.431 -16.550 1.00 4.24 H new ATOM 425 N ILE A 28 -9.735 3.665 -16.398 1.00 22.11 N ATOM 426 CA ILE A 28 -9.637 4.019 -14.984 1.00 53.44 C ATOM 427 C ILE A 28 -10.027 2.834 -14.097 1.00 70.51 C ATOM 428 O ILE A 28 -11.024 2.156 -14.360 1.00 74.33 O ATOM 429 CB ILE A 28 -10.552 5.219 -14.644 1.00 2.12 C ATOM 430 CG1 ILE A 28 -10.277 6.395 -15.591 1.00 1.10 C ATOM 431 CG2 ILE A 28 -10.355 5.642 -13.192 1.00 2.41 C ATOM 432 CD1 ILE A 28 -11.174 7.592 -15.355 1.00 71.24 C ATOM 0 H ILE A 28 -10.687 3.672 -16.764 1.00 22.11 H new ATOM 0 HA ILE A 28 -8.599 4.292 -14.792 1.00 53.44 H new ATOM 0 HB ILE A 28 -11.589 4.910 -14.777 1.00 2.12 H new ATOM 0 HG12 ILE A 28 -9.238 6.704 -15.479 1.00 1.10 H new ATOM 0 HG13 ILE A 28 -10.400 6.057 -16.620 1.00 1.10 H new ATOM 0 HG21 ILE A 28 -11.006 6.487 -12.968 1.00 2.41 H new ATOM 0 HG22 ILE A 28 -10.602 4.809 -12.534 1.00 2.41 H new ATOM 0 HG23 ILE A 28 -9.316 5.932 -13.035 1.00 2.41 H new ATOM 0 HD11 ILE A 28 -10.920 8.382 -16.062 1.00 71.24 H new ATOM 0 HD12 ILE A 28 -12.215 7.300 -15.496 1.00 71.24 H new ATOM 0 HD13 ILE A 28 -11.034 7.957 -14.337 1.00 71.24 H new ATOM 444 N PHE A 29 -9.244 2.594 -13.049 1.00 72.21 N ATOM 445 CA PHE A 29 -9.517 1.505 -12.118 1.00 12.13 C ATOM 446 C PHE A 29 -9.902 2.050 -10.745 1.00 75.23 C ATOM 447 O PHE A 29 -9.605 3.200 -10.414 1.00 64.13 O ATOM 448 CB PHE A 29 -8.291 0.604 -11.964 1.00 72.24 C ATOM 449 CG PHE A 29 -7.801 -0.011 -13.245 1.00 5.13 C ATOM 450 CD1 PHE A 29 -8.408 -1.143 -13.763 1.00 13.31 C ATOM 451 CD2 PHE A 29 -6.721 0.536 -13.922 1.00 74.21 C ATOM 452 CE1 PHE A 29 -7.951 -1.717 -14.933 1.00 51.20 C ATOM 453 CE2 PHE A 29 -6.261 -0.033 -15.094 1.00 54.42 C ATOM 454 CZ PHE A 29 -6.877 -1.161 -15.600 1.00 2.43 C ATOM 0 H PHE A 29 -8.413 3.141 -12.823 1.00 72.21 H new ATOM 0 HA PHE A 29 -10.346 0.926 -12.525 1.00 12.13 H new ATOM 0 HB2 PHE A 29 -7.482 1.186 -11.523 1.00 72.24 H new ATOM 0 HB3 PHE A 29 -8.529 -0.194 -11.261 1.00 72.24 H new ATOM 0 HD1 PHE A 29 -9.248 -1.582 -13.246 1.00 13.31 H new ATOM 0 HD2 PHE A 29 -6.234 1.416 -13.529 1.00 74.21 H new ATOM 0 HE1 PHE A 29 -8.433 -2.600 -15.326 1.00 51.20 H new ATOM 0 HE2 PHE A 29 -5.421 0.404 -15.614 1.00 54.42 H new ATOM 0 HZ PHE A 29 -6.519 -1.608 -16.516 1.00 2.43 H new ATOM 464 N LYS A 30 -10.565 1.220 -9.953 1.00 12.44 N ATOM 465 CA LYS A 30 -10.886 1.560 -8.573 1.00 62.22 C ATOM 466 C LYS A 30 -10.919 0.299 -7.721 1.00 33.45 C ATOM 467 O LYS A 30 -11.112 -0.801 -8.240 1.00 63.21 O ATOM 468 CB LYS A 30 -12.240 2.270 -8.478 1.00 12.13 C ATOM 469 CG LYS A 30 -13.411 1.400 -8.901 1.00 62.50 C ATOM 470 CD LYS A 30 -14.734 1.989 -8.445 1.00 22.55 C ATOM 471 CE LYS A 30 -15.906 1.100 -8.825 1.00 11.13 C ATOM 472 NZ LYS A 30 -16.070 0.976 -10.299 1.00 51.40 N ATOM 0 H LYS A 30 -10.894 0.299 -10.245 1.00 12.44 H new ATOM 0 HA LYS A 30 -10.113 2.235 -8.206 1.00 62.22 H new ATOM 0 HB2 LYS A 30 -12.396 2.602 -7.452 1.00 12.13 H new ATOM 0 HB3 LYS A 30 -12.217 3.164 -9.102 1.00 12.13 H new ATOM 0 HG2 LYS A 30 -13.413 1.293 -9.986 1.00 62.50 H new ATOM 0 HG3 LYS A 30 -13.293 0.400 -8.483 1.00 62.50 H new ATOM 0 HD2 LYS A 30 -14.718 2.127 -7.364 1.00 22.55 H new ATOM 0 HD3 LYS A 30 -14.866 2.975 -8.890 1.00 22.55 H new ATOM 0 HE2 LYS A 30 -15.762 0.109 -8.394 1.00 11.13 H new ATOM 0 HE3 LYS A 30 -16.821 1.506 -8.393 1.00 11.13 H new ATOM 0 HZ1 LYS A 30 -16.861 0.333 -10.507 1.00 51.40 H new ATOM 0 HZ2 LYS A 30 -16.268 1.912 -10.706 1.00 51.40 H new ATOM 0 HZ3 LYS A 30 -15.196 0.596 -10.715 1.00 51.40 H new ATOM 486 N ILE A 31 -10.721 0.456 -6.423 1.00 53.21 N ATOM 487 CA ILE A 31 -10.851 -0.658 -5.500 1.00 31.03 C ATOM 488 C ILE A 31 -12.206 -0.589 -4.794 1.00 0.24 C ATOM 489 O ILE A 31 -12.541 0.409 -4.153 1.00 31.20 O ATOM 490 CB ILE A 31 -9.697 -0.701 -4.467 1.00 44.14 C ATOM 491 CG1 ILE A 31 -9.898 -1.867 -3.491 1.00 24.12 C ATOM 492 CG2 ILE A 31 -9.575 0.624 -3.718 1.00 41.41 C ATOM 493 CD1 ILE A 31 -8.737 -2.072 -2.542 1.00 41.31 C ATOM 0 H ILE A 31 -10.470 1.343 -5.985 1.00 53.21 H new ATOM 0 HA ILE A 31 -10.790 -1.579 -6.079 1.00 31.03 H new ATOM 0 HB ILE A 31 -8.763 -0.860 -5.007 1.00 44.14 H new ATOM 0 HG12 ILE A 31 -10.804 -1.692 -2.911 1.00 24.12 H new ATOM 0 HG13 ILE A 31 -10.057 -2.783 -4.060 1.00 24.12 H new ATOM 0 HG21 ILE A 31 -8.757 0.562 -3.001 1.00 41.41 H new ATOM 0 HG22 ILE A 31 -9.375 1.426 -4.428 1.00 41.41 H new ATOM 0 HG23 ILE A 31 -10.506 0.830 -3.190 1.00 41.41 H new ATOM 0 HD11 ILE A 31 -8.950 -2.913 -1.882 1.00 41.31 H new ATOM 0 HD12 ILE A 31 -7.832 -2.279 -3.113 1.00 41.31 H new ATOM 0 HD13 ILE A 31 -8.591 -1.171 -1.946 1.00 41.31 H new ATOM 505 N ASP A 32 -12.993 -1.640 -4.937 1.00 44.04 N ATOM 506 CA ASP A 32 -14.357 -1.646 -4.426 1.00 55.12 C ATOM 507 C ASP A 32 -14.567 -2.789 -3.436 1.00 10.40 C ATOM 508 O ASP A 32 -13.819 -3.765 -3.458 1.00 24.30 O ATOM 509 CB ASP A 32 -15.336 -1.769 -5.600 1.00 73.03 C ATOM 510 CG ASP A 32 -16.791 -1.717 -5.179 1.00 42.41 C ATOM 511 OD1 ASP A 32 -17.310 -0.608 -4.944 1.00 21.24 O ATOM 512 OD2 ASP A 32 -17.431 -2.786 -5.091 1.00 25.24 O ATOM 0 H ASP A 32 -12.713 -2.503 -5.403 1.00 44.04 H new ATOM 0 HA ASP A 32 -14.539 -0.711 -3.896 1.00 55.12 H new ATOM 0 HB2 ASP A 32 -15.142 -0.965 -6.311 1.00 73.03 H new ATOM 0 HB3 ASP A 32 -15.150 -2.708 -6.122 1.00 73.03 H new ATOM 517 N LYS A 33 -15.560 -2.610 -2.550 1.00 1.03 N ATOM 518 CA LYS A 33 -16.062 -3.636 -1.610 1.00 22.32 C ATOM 519 C LYS A 33 -15.025 -4.070 -0.566 1.00 72.12 C ATOM 520 O LYS A 33 -13.817 -3.972 -0.772 1.00 32.22 O ATOM 521 CB LYS A 33 -16.643 -4.859 -2.355 1.00 20.11 C ATOM 522 CG LYS A 33 -15.619 -5.849 -2.895 1.00 4.15 C ATOM 523 CD LYS A 33 -16.266 -6.882 -3.805 1.00 2.51 C ATOM 524 CE LYS A 33 -16.954 -6.229 -4.997 1.00 44.50 C ATOM 525 NZ LYS A 33 -17.516 -7.232 -5.939 1.00 71.34 N ATOM 0 H LYS A 33 -16.053 -1.722 -2.462 1.00 1.03 H new ATOM 0 HA LYS A 33 -16.870 -3.155 -1.058 1.00 22.32 H new ATOM 0 HB2 LYS A 33 -17.313 -5.390 -1.678 1.00 20.11 H new ATOM 0 HB3 LYS A 33 -17.249 -4.501 -3.187 1.00 20.11 H new ATOM 0 HG2 LYS A 33 -14.847 -5.311 -3.445 1.00 4.15 H new ATOM 0 HG3 LYS A 33 -15.126 -6.353 -2.064 1.00 4.15 H new ATOM 0 HD2 LYS A 33 -15.508 -7.580 -4.160 1.00 2.51 H new ATOM 0 HD3 LYS A 33 -16.994 -7.462 -3.238 1.00 2.51 H new ATOM 0 HE2 LYS A 33 -17.753 -5.579 -4.642 1.00 44.50 H new ATOM 0 HE3 LYS A 33 -16.240 -5.597 -5.525 1.00 44.50 H new ATOM 0 HZ1 LYS A 33 -17.974 -6.743 -6.734 1.00 71.34 H new ATOM 0 HZ2 LYS A 33 -16.751 -7.837 -6.299 1.00 71.34 H new ATOM 0 HZ3 LYS A 33 -18.217 -7.819 -5.443 1.00 71.34 H new ATOM 539 N ASN A 34 -15.529 -4.554 0.570 1.00 35.05 N ATOM 540 CA ASN A 34 -14.687 -5.010 1.677 1.00 14.04 C ATOM 541 C ASN A 34 -13.972 -6.295 1.281 1.00 65.44 C ATOM 542 O ASN A 34 -12.870 -6.585 1.744 1.00 64.21 O ATOM 543 CB ASN A 34 -15.551 -5.246 2.925 1.00 10.31 C ATOM 544 CG ASN A 34 -14.748 -5.423 4.209 1.00 31.50 C ATOM 545 OD1 ASN A 34 -13.619 -5.903 4.205 1.00 2.11 O ATOM 546 ND2 ASN A 34 -15.339 -5.035 5.325 1.00 4.31 N ATOM 0 H ASN A 34 -16.529 -4.641 0.749 1.00 35.05 H new ATOM 0 HA ASN A 34 -13.943 -4.246 1.904 1.00 14.04 H new ATOM 0 HB2 ASN A 34 -16.232 -4.404 3.048 1.00 10.31 H new ATOM 0 HB3 ASN A 34 -16.165 -6.133 2.767 1.00 10.31 H new ATOM 0 HD21 ASN A 34 -14.856 -5.131 6.218 1.00 4.31 H new ATOM 0 HD22 ASN A 34 -16.279 -4.640 5.294 1.00 4.31 H new ATOM 553 N ASP A 35 -14.600 -7.046 0.386 1.00 72.33 N ATOM 554 CA ASP A 35 -14.024 -8.285 -0.135 1.00 1.41 C ATOM 555 C ASP A 35 -12.812 -7.985 -1.017 1.00 10.42 C ATOM 556 O ASP A 35 -12.118 -8.896 -1.463 1.00 72.24 O ATOM 557 CB ASP A 35 -15.092 -9.047 -0.927 1.00 35.31 C ATOM 558 CG ASP A 35 -14.600 -10.367 -1.488 1.00 4.02 C ATOM 559 OD1 ASP A 35 -14.260 -11.266 -0.696 1.00 13.01 O ATOM 560 OD2 ASP A 35 -14.585 -10.520 -2.728 1.00 14.32 O ATOM 0 H ASP A 35 -15.517 -6.818 0.001 1.00 72.33 H new ATOM 0 HA ASP A 35 -13.687 -8.902 0.698 1.00 1.41 H new ATOM 0 HB2 ASP A 35 -15.949 -9.233 -0.280 1.00 35.31 H new ATOM 0 HB3 ASP A 35 -15.441 -8.420 -1.747 1.00 35.31 H new ATOM 565 N THR A 36 -12.567 -6.687 -1.223 1.00 62.53 N ATOM 566 CA THR A 36 -11.486 -6.164 -2.063 1.00 23.54 C ATOM 567 C THR A 36 -11.604 -6.644 -3.504 1.00 14.02 C ATOM 568 O THR A 36 -11.634 -7.839 -3.785 1.00 4.14 O ATOM 569 CB THR A 36 -10.065 -6.464 -1.510 1.00 13.51 C ATOM 570 OG1 THR A 36 -9.806 -7.871 -1.448 1.00 73.33 O ATOM 571 CG2 THR A 36 -9.891 -5.857 -0.127 1.00 0.33 C ATOM 0 H THR A 36 -13.131 -5.951 -0.798 1.00 62.53 H new ATOM 0 HA THR A 36 -11.610 -5.081 -2.042 1.00 23.54 H new ATOM 0 HB THR A 36 -9.351 -6.014 -2.199 1.00 13.51 H new ATOM 0 HG1 THR A 36 -10.568 -8.361 -1.822 1.00 73.33 H new ATOM 0 HG21 THR A 36 -8.890 -6.078 0.244 1.00 0.33 H new ATOM 0 HG22 THR A 36 -10.027 -4.777 -0.184 1.00 0.33 H new ATOM 0 HG23 THR A 36 -10.631 -6.281 0.552 1.00 0.33 H new ATOM 579 N ALA A 37 -11.714 -5.697 -4.414 1.00 44.01 N ATOM 580 CA ALA A 37 -11.754 -6.010 -5.826 1.00 33.53 C ATOM 581 C ALA A 37 -11.400 -4.787 -6.647 1.00 45.32 C ATOM 582 O ALA A 37 -12.078 -3.762 -6.565 1.00 71.12 O ATOM 583 CB ALA A 37 -13.129 -6.531 -6.224 1.00 65.23 C ATOM 0 H ALA A 37 -11.777 -4.702 -4.199 1.00 44.01 H new ATOM 0 HA ALA A 37 -11.019 -6.791 -6.024 1.00 33.53 H new ATOM 0 HB1 ALA A 37 -13.137 -6.760 -7.290 1.00 65.23 H new ATOM 0 HB2 ALA A 37 -13.354 -7.434 -5.657 1.00 65.23 H new ATOM 0 HB3 ALA A 37 -13.882 -5.772 -6.011 1.00 65.23 H new ATOM 589 N ILE A 38 -10.321 -4.880 -7.403 1.00 63.30 N ATOM 590 CA ILE A 38 -9.993 -3.846 -8.366 1.00 4.43 C ATOM 591 C ILE A 38 -10.912 -4.009 -9.564 1.00 75.23 C ATOM 592 O ILE A 38 -10.948 -5.070 -10.175 1.00 3.04 O ATOM 593 CB ILE A 38 -8.522 -3.934 -8.827 1.00 12.05 C ATOM 594 CG1 ILE A 38 -7.582 -3.864 -7.620 1.00 1.11 C ATOM 595 CG2 ILE A 38 -8.204 -2.818 -9.818 1.00 24.11 C ATOM 596 CD1 ILE A 38 -6.129 -4.122 -7.964 1.00 73.34 C ATOM 0 H ILE A 38 -9.661 -5.657 -7.369 1.00 63.30 H new ATOM 0 HA ILE A 38 -10.128 -2.872 -7.896 1.00 4.43 H new ATOM 0 HB ILE A 38 -8.372 -4.890 -9.328 1.00 12.05 H new ATOM 0 HG12 ILE A 38 -7.668 -2.879 -7.160 1.00 1.11 H new ATOM 0 HG13 ILE A 38 -7.905 -4.592 -6.876 1.00 1.11 H new ATOM 0 HG21 ILE A 38 -7.163 -2.896 -10.132 1.00 24.11 H new ATOM 0 HG22 ILE A 38 -8.853 -2.909 -10.689 1.00 24.11 H new ATOM 0 HG23 ILE A 38 -8.368 -1.851 -9.342 1.00 24.11 H new ATOM 0 HD11 ILE A 38 -5.524 -4.056 -7.060 1.00 73.34 H new ATOM 0 HD12 ILE A 38 -6.029 -5.118 -8.396 1.00 73.34 H new ATOM 0 HD13 ILE A 38 -5.788 -3.378 -8.684 1.00 73.34 H new ATOM 608 N VAL A 39 -11.664 -2.977 -9.885 1.00 43.22 N ATOM 609 CA VAL A 39 -12.658 -3.072 -10.938 1.00 2.42 C ATOM 610 C VAL A 39 -12.647 -1.817 -11.802 1.00 10.11 C ATOM 611 O VAL A 39 -12.305 -0.729 -11.329 1.00 41.32 O ATOM 612 CB VAL A 39 -14.068 -3.322 -10.345 1.00 3.53 C ATOM 613 CG1 VAL A 39 -14.488 -2.180 -9.433 1.00 50.00 C ATOM 614 CG2 VAL A 39 -15.102 -3.558 -11.440 1.00 44.22 C ATOM 0 H VAL A 39 -11.608 -2.064 -9.434 1.00 43.22 H new ATOM 0 HA VAL A 39 -12.404 -3.923 -11.570 1.00 2.42 H new ATOM 0 HB VAL A 39 -14.014 -4.230 -9.744 1.00 3.53 H new ATOM 0 HG11 VAL A 39 -15.481 -2.382 -9.031 1.00 50.00 H new ATOM 0 HG12 VAL A 39 -13.776 -2.089 -8.613 1.00 50.00 H new ATOM 0 HG13 VAL A 39 -14.509 -1.250 -10.001 1.00 50.00 H new ATOM 0 HG21 VAL A 39 -16.079 -3.730 -10.987 1.00 44.22 H new ATOM 0 HG22 VAL A 39 -15.151 -2.683 -12.088 1.00 44.22 H new ATOM 0 HG23 VAL A 39 -14.816 -4.430 -12.028 1.00 44.22 H new ATOM 624 N VAL A 40 -12.981 -1.993 -13.075 1.00 52.14 N ATOM 625 CA VAL A 40 -13.042 -0.894 -14.027 1.00 2.42 C ATOM 626 C VAL A 40 -13.996 0.195 -13.540 1.00 20.15 C ATOM 627 O VAL A 40 -15.093 -0.096 -13.057 1.00 72.10 O ATOM 628 CB VAL A 40 -13.502 -1.384 -15.421 1.00 45.12 C ATOM 629 CG1 VAL A 40 -13.549 -0.233 -16.419 1.00 5.31 C ATOM 630 CG2 VAL A 40 -12.586 -2.484 -15.932 1.00 13.41 C ATOM 0 H VAL A 40 -13.217 -2.901 -13.475 1.00 52.14 H new ATOM 0 HA VAL A 40 -12.036 -0.484 -14.110 1.00 2.42 H new ATOM 0 HB VAL A 40 -14.509 -1.787 -15.316 1.00 45.12 H new ATOM 0 HG11 VAL A 40 -13.875 -0.606 -17.390 1.00 5.31 H new ATOM 0 HG12 VAL A 40 -14.249 0.525 -16.068 1.00 5.31 H new ATOM 0 HG13 VAL A 40 -12.556 0.207 -16.514 1.00 5.31 H new ATOM 0 HG21 VAL A 40 -12.927 -2.815 -16.913 1.00 13.41 H new ATOM 0 HG22 VAL A 40 -11.568 -2.102 -16.011 1.00 13.41 H new ATOM 0 HG23 VAL A 40 -12.605 -3.325 -15.239 1.00 13.41 H new ATOM 640 N GLU A 41 -13.559 1.439 -13.634 1.00 14.44 N ATOM 641 CA GLU A 41 -14.405 2.568 -13.292 1.00 54.03 C ATOM 642 C GLU A 41 -14.884 3.262 -14.563 1.00 14.51 C ATOM 643 O GLU A 41 -16.071 3.537 -14.731 1.00 62.42 O ATOM 644 CB GLU A 41 -13.641 3.558 -12.407 1.00 32.32 C ATOM 645 CG GLU A 41 -14.495 4.708 -11.903 1.00 35.24 C ATOM 646 CD GLU A 41 -15.509 4.273 -10.866 1.00 64.30 C ATOM 647 OE1 GLU A 41 -16.373 3.428 -11.180 1.00 25.30 O ATOM 648 OE2 GLU A 41 -15.428 4.752 -9.719 1.00 22.43 O ATOM 0 H GLU A 41 -12.621 1.692 -13.945 1.00 14.44 H new ATOM 0 HA GLU A 41 -15.270 2.203 -12.738 1.00 54.03 H new ATOM 0 HB2 GLU A 41 -13.226 3.023 -11.553 1.00 32.32 H new ATOM 0 HB3 GLU A 41 -12.799 3.961 -12.970 1.00 32.32 H new ATOM 0 HG2 GLU A 41 -13.849 5.474 -11.474 1.00 35.24 H new ATOM 0 HG3 GLU A 41 -15.016 5.165 -12.745 1.00 35.24 H new ATOM 655 N LYS A 42 -13.952 3.511 -15.473 1.00 5.53 N ATOM 656 CA LYS A 42 -14.262 4.205 -16.713 1.00 23.23 C ATOM 657 C LYS A 42 -13.212 3.909 -17.775 1.00 61.32 C ATOM 658 O LYS A 42 -12.022 4.044 -17.531 1.00 72.14 O ATOM 659 CB LYS A 42 -14.333 5.715 -16.455 1.00 32.40 C ATOM 660 CG LYS A 42 -14.565 6.559 -17.699 1.00 52.44 C ATOM 661 CD LYS A 42 -15.839 6.161 -18.420 1.00 14.02 C ATOM 662 CE LYS A 42 -16.167 7.128 -19.546 1.00 51.02 C ATOM 663 NZ LYS A 42 -15.063 7.240 -20.537 1.00 64.05 N ATOM 0 H LYS A 42 -12.973 3.242 -15.374 1.00 5.53 H new ATOM 0 HA LYS A 42 -15.227 3.852 -17.077 1.00 23.23 H new ATOM 0 HB2 LYS A 42 -15.135 5.912 -15.744 1.00 32.40 H new ATOM 0 HB3 LYS A 42 -13.403 6.034 -15.983 1.00 32.40 H new ATOM 0 HG2 LYS A 42 -14.619 7.611 -17.420 1.00 52.44 H new ATOM 0 HG3 LYS A 42 -13.716 6.452 -18.375 1.00 52.44 H new ATOM 0 HD2 LYS A 42 -15.731 5.154 -18.824 1.00 14.02 H new ATOM 0 HD3 LYS A 42 -16.666 6.133 -17.711 1.00 14.02 H new ATOM 0 HE2 LYS A 42 -17.074 6.798 -20.052 1.00 51.02 H new ATOM 0 HE3 LYS A 42 -16.376 8.112 -19.127 1.00 51.02 H new ATOM 0 HZ1 LYS A 42 -15.275 8.006 -21.207 1.00 64.05 H new ATOM 0 HZ2 LYS A 42 -14.172 7.449 -20.042 1.00 64.05 H new ATOM 0 HZ3 LYS A 42 -14.969 6.343 -21.055 1.00 64.05 H new ATOM 677 N VAL A 43 -13.654 3.497 -18.946 1.00 10.44 N ATOM 678 CA VAL A 43 -12.758 3.311 -20.072 1.00 21.12 C ATOM 679 C VAL A 43 -12.977 4.424 -21.097 1.00 72.42 C ATOM 680 O VAL A 43 -14.110 4.848 -21.332 1.00 12.41 O ATOM 681 CB VAL A 43 -12.952 1.918 -20.724 1.00 35.41 C ATOM 682 CG1 VAL A 43 -14.337 1.777 -21.332 1.00 63.22 C ATOM 683 CG2 VAL A 43 -11.880 1.647 -21.767 1.00 24.23 C ATOM 0 H VAL A 43 -14.632 3.284 -19.144 1.00 10.44 H new ATOM 0 HA VAL A 43 -11.732 3.360 -19.707 1.00 21.12 H new ATOM 0 HB VAL A 43 -12.856 1.173 -19.934 1.00 35.41 H new ATOM 0 HG11 VAL A 43 -14.439 0.789 -21.780 1.00 63.22 H new ATOM 0 HG12 VAL A 43 -15.090 1.902 -20.554 1.00 63.22 H new ATOM 0 HG13 VAL A 43 -14.477 2.539 -22.098 1.00 63.22 H new ATOM 0 HG21 VAL A 43 -12.041 0.663 -22.207 1.00 24.23 H new ATOM 0 HG22 VAL A 43 -11.931 2.407 -22.547 1.00 24.23 H new ATOM 0 HG23 VAL A 43 -10.898 1.677 -21.295 1.00 24.23 H new ATOM 693 N GLY A 44 -11.890 4.914 -21.672 1.00 51.30 N ATOM 694 CA GLY A 44 -11.965 5.989 -22.639 1.00 15.04 C ATOM 695 C GLY A 44 -11.472 5.557 -24.005 1.00 14.23 C ATOM 696 O GLY A 44 -10.662 4.631 -24.118 1.00 24.51 O ATOM 0 H GLY A 44 -10.945 4.581 -21.483 1.00 51.30 H new ATOM 0 HA2 GLY A 44 -12.996 6.335 -22.718 1.00 15.04 H new ATOM 0 HA3 GLY A 44 -11.371 6.834 -22.289 1.00 15.04 H new ATOM 700 N GLU A 45 -11.943 6.235 -25.038 1.00 22.54 N ATOM 701 CA GLU A 45 -11.653 5.843 -26.410 1.00 31.31 C ATOM 702 C GLU A 45 -10.333 6.425 -26.893 1.00 24.41 C ATOM 703 O GLU A 45 -9.786 7.337 -26.281 1.00 10.02 O ATOM 704 CB GLU A 45 -12.792 6.280 -27.332 1.00 61.25 C ATOM 705 CG GLU A 45 -14.110 5.600 -27.006 1.00 52.43 C ATOM 706 CD GLU A 45 -13.959 4.099 -26.891 1.00 40.01 C ATOM 707 OE1 GLU A 45 -13.932 3.418 -27.933 1.00 23.20 O ATOM 708 OE2 GLU A 45 -13.846 3.596 -25.754 1.00 70.04 O ATOM 0 H GLU A 45 -12.531 7.064 -24.953 1.00 22.54 H new ATOM 0 HA GLU A 45 -11.565 4.757 -26.435 1.00 31.31 H new ATOM 0 HB2 GLU A 45 -12.918 7.360 -27.258 1.00 61.25 H new ATOM 0 HB3 GLU A 45 -12.521 6.060 -28.365 1.00 61.25 H new ATOM 0 HG2 GLU A 45 -14.502 5.998 -26.070 1.00 52.43 H new ATOM 0 HG3 GLU A 45 -14.840 5.833 -27.781 1.00 52.43 H new ATOM 715 N LYS A 46 -9.840 5.897 -28.008 1.00 44.11 N ATOM 716 CA LYS A 46 -8.578 6.351 -28.583 1.00 22.32 C ATOM 717 C LYS A 46 -8.824 7.448 -29.614 1.00 40.42 C ATOM 718 O LYS A 46 -7.980 7.730 -30.464 1.00 51.45 O ATOM 719 CB LYS A 46 -7.809 5.164 -29.191 1.00 3.23 C ATOM 720 CG LYS A 46 -8.651 4.231 -30.056 1.00 23.13 C ATOM 721 CD LYS A 46 -8.815 4.743 -31.478 1.00 63.41 C ATOM 722 CE LYS A 46 -9.721 3.833 -32.290 1.00 4.13 C ATOM 723 NZ LYS A 46 -9.785 4.238 -33.719 1.00 3.22 N ATOM 0 H LYS A 46 -10.297 5.152 -28.534 1.00 44.11 H new ATOM 0 HA LYS A 46 -7.962 6.776 -27.791 1.00 22.32 H new ATOM 0 HB2 LYS A 46 -6.987 5.552 -29.793 1.00 3.23 H new ATOM 0 HB3 LYS A 46 -7.365 4.584 -28.382 1.00 3.23 H new ATOM 0 HG2 LYS A 46 -8.186 3.245 -30.080 1.00 23.13 H new ATOM 0 HG3 LYS A 46 -9.634 4.109 -29.602 1.00 23.13 H new ATOM 0 HD2 LYS A 46 -9.231 5.750 -31.459 1.00 63.41 H new ATOM 0 HD3 LYS A 46 -7.839 4.810 -31.958 1.00 63.41 H new ATOM 0 HE2 LYS A 46 -9.360 2.807 -32.220 1.00 4.13 H new ATOM 0 HE3 LYS A 46 -10.724 3.847 -31.864 1.00 4.13 H new ATOM 0 HZ1 LYS A 46 -10.414 3.590 -34.236 1.00 3.22 H new ATOM 0 HZ2 LYS A 46 -10.154 5.208 -33.789 1.00 3.22 H new ATOM 0 HZ3 LYS A 46 -8.832 4.199 -34.134 1.00 3.22 H new ATOM 737 N ASN A 47 -9.991 8.071 -29.511 1.00 61.04 N ATOM 738 CA ASN A 47 -10.375 9.167 -30.389 1.00 71.52 C ATOM 739 C ASN A 47 -10.958 10.290 -29.534 1.00 13.10 C ATOM 740 O ASN A 47 -11.864 11.013 -29.949 1.00 53.40 O ATOM 741 CB ASN A 47 -11.408 8.673 -31.414 1.00 34.51 C ATOM 742 CG ASN A 47 -11.471 9.511 -32.690 1.00 3.12 C ATOM 743 OD1 ASN A 47 -11.751 8.983 -33.769 1.00 41.31 O ATOM 744 ND2 ASN A 47 -11.244 10.810 -32.586 1.00 2.12 N ATOM 0 H ASN A 47 -10.698 7.830 -28.816 1.00 61.04 H new ATOM 0 HA ASN A 47 -9.507 9.539 -30.934 1.00 71.52 H new ATOM 0 HB2 ASN A 47 -11.175 7.642 -31.680 1.00 34.51 H new ATOM 0 HB3 ASN A 47 -12.393 8.667 -30.947 1.00 34.51 H new ATOM 0 HD21 ASN A 47 -11.298 11.405 -33.413 1.00 2.12 H new ATOM 0 HD22 ASN A 47 -11.015 11.217 -31.679 1.00 2.12 H new ATOM 751 N ALA A 48 -10.427 10.422 -28.328 1.00 35.41 N ATOM 752 CA ALA A 48 -10.902 11.418 -27.383 1.00 62.11 C ATOM 753 C ALA A 48 -9.776 12.367 -26.997 1.00 62.15 C ATOM 754 O ALA A 48 -8.619 11.956 -26.918 1.00 74.42 O ATOM 755 CB ALA A 48 -11.472 10.734 -26.147 1.00 34.01 C ATOM 0 H ALA A 48 -9.661 9.846 -27.980 1.00 35.41 H new ATOM 0 HA ALA A 48 -11.692 12.001 -27.856 1.00 62.11 H new ATOM 0 HB1 ALA A 48 -11.826 11.488 -25.444 1.00 34.01 H new ATOM 0 HB2 ALA A 48 -12.303 10.091 -26.438 1.00 34.01 H new ATOM 0 HB3 ALA A 48 -10.696 10.132 -25.674 1.00 34.01 H new ATOM 761 N PRO A 49 -10.094 13.652 -26.782 1.00 34.13 N ATOM 762 CA PRO A 49 -9.115 14.651 -26.360 1.00 12.34 C ATOM 763 C PRO A 49 -8.702 14.462 -24.902 1.00 44.25 C ATOM 764 O PRO A 49 -9.427 13.849 -24.115 1.00 23.23 O ATOM 765 CB PRO A 49 -9.849 15.990 -26.544 1.00 3.42 C ATOM 766 CG PRO A 49 -11.103 15.666 -27.287 1.00 52.43 C ATOM 767 CD PRO A 49 -11.425 14.242 -26.951 1.00 43.33 C ATOM 0 HA PRO A 49 -8.192 14.585 -26.935 1.00 12.34 H new ATOM 0 HB2 PRO A 49 -10.072 16.449 -25.581 1.00 3.42 H new ATOM 0 HB3 PRO A 49 -9.236 16.699 -27.101 1.00 3.42 H new ATOM 0 HG2 PRO A 49 -11.915 16.330 -26.991 1.00 52.43 H new ATOM 0 HG3 PRO A 49 -10.964 15.792 -28.361 1.00 52.43 H new ATOM 0 HD2 PRO A 49 -12.023 14.164 -26.043 1.00 43.33 H new ATOM 0 HD3 PRO A 49 -11.988 13.754 -27.746 1.00 43.33 H new ATOM 775 N TYR A 50 -7.549 15.018 -24.544 1.00 13.01 N ATOM 776 CA TYR A 50 -6.983 14.842 -23.210 1.00 42.25 C ATOM 777 C TYR A 50 -7.910 15.392 -22.130 1.00 2.13 C ATOM 778 O TYR A 50 -8.114 14.759 -21.094 1.00 60.13 O ATOM 779 CB TYR A 50 -5.615 15.527 -23.116 1.00 22.05 C ATOM 780 CG TYR A 50 -4.591 14.990 -24.092 1.00 60.30 C ATOM 781 CD1 TYR A 50 -3.929 13.793 -23.846 1.00 14.10 C ATOM 782 CD2 TYR A 50 -4.290 15.677 -25.263 1.00 31.11 C ATOM 783 CE1 TYR A 50 -2.996 13.298 -24.737 1.00 60.45 C ATOM 784 CE2 TYR A 50 -3.359 15.188 -26.158 1.00 22.55 C ATOM 785 CZ TYR A 50 -2.714 13.999 -25.892 1.00 32.03 C ATOM 786 OH TYR A 50 -1.788 13.508 -26.785 1.00 3.33 O ATOM 0 H TYR A 50 -6.984 15.599 -25.164 1.00 13.01 H new ATOM 0 HA TYR A 50 -6.864 13.771 -23.043 1.00 42.25 H new ATOM 0 HB2 TYR A 50 -5.742 16.596 -23.290 1.00 22.05 H new ATOM 0 HB3 TYR A 50 -5.231 15.412 -22.102 1.00 22.05 H new ATOM 0 HD1 TYR A 50 -4.147 13.241 -22.944 1.00 14.10 H new ATOM 0 HD2 TYR A 50 -4.793 16.609 -25.476 1.00 31.11 H new ATOM 0 HE1 TYR A 50 -2.490 12.367 -24.531 1.00 60.45 H new ATOM 0 HE2 TYR A 50 -3.137 15.735 -27.063 1.00 22.55 H new ATOM 0 HH TYR A 50 -1.709 14.122 -27.545 1.00 3.33 H new ATOM 796 N ALA A 51 -8.480 16.565 -22.385 1.00 53.20 N ATOM 797 CA ALA A 51 -9.352 17.222 -21.418 1.00 21.05 C ATOM 798 C ALA A 51 -10.593 16.389 -21.121 1.00 42.13 C ATOM 799 O ALA A 51 -11.134 16.449 -20.019 1.00 32.21 O ATOM 800 CB ALA A 51 -9.755 18.599 -21.917 1.00 71.25 C ATOM 0 H ALA A 51 -8.353 17.081 -23.255 1.00 53.20 H new ATOM 0 HA ALA A 51 -8.791 17.328 -20.490 1.00 21.05 H new ATOM 0 HB1 ALA A 51 -10.406 19.076 -21.184 1.00 71.25 H new ATOM 0 HB2 ALA A 51 -8.863 19.209 -22.062 1.00 71.25 H new ATOM 0 HB3 ALA A 51 -10.286 18.502 -22.864 1.00 71.25 H new ATOM 806 N GLU A 52 -11.032 15.602 -22.097 1.00 73.12 N ATOM 807 CA GLU A 52 -12.223 14.777 -21.928 1.00 25.41 C ATOM 808 C GLU A 52 -11.970 13.706 -20.870 1.00 52.13 C ATOM 809 O GLU A 52 -12.822 13.447 -20.017 1.00 13.24 O ATOM 810 CB GLU A 52 -12.623 14.138 -23.260 1.00 23.35 C ATOM 811 CG GLU A 52 -13.972 13.440 -23.214 1.00 42.52 C ATOM 812 CD GLU A 52 -14.426 12.940 -24.567 1.00 51.22 C ATOM 813 OE1 GLU A 52 -14.715 13.777 -25.447 1.00 43.12 O ATOM 814 OE2 GLU A 52 -14.532 11.709 -24.750 1.00 54.04 O ATOM 0 H GLU A 52 -10.584 15.518 -23.009 1.00 73.12 H new ATOM 0 HA GLU A 52 -13.046 15.409 -21.593 1.00 25.41 H new ATOM 0 HB2 GLU A 52 -12.647 14.908 -24.031 1.00 23.35 H new ATOM 0 HB3 GLU A 52 -11.859 13.417 -23.553 1.00 23.35 H new ATOM 0 HG2 GLU A 52 -13.916 12.599 -22.522 1.00 42.52 H new ATOM 0 HG3 GLU A 52 -14.718 14.129 -22.819 1.00 42.52 H new ATOM 821 N PHE A 53 -10.782 13.112 -20.922 1.00 34.21 N ATOM 822 CA PHE A 53 -10.356 12.133 -19.929 1.00 3.11 C ATOM 823 C PHE A 53 -10.244 12.785 -18.552 1.00 45.20 C ATOM 824 O PHE A 53 -10.589 12.184 -17.533 1.00 14.10 O ATOM 825 CB PHE A 53 -9.011 11.528 -20.345 1.00 63.21 C ATOM 826 CG PHE A 53 -8.384 10.642 -19.306 1.00 42.24 C ATOM 827 CD1 PHE A 53 -9.026 9.494 -18.872 1.00 3.52 C ATOM 828 CD2 PHE A 53 -7.147 10.962 -18.766 1.00 63.54 C ATOM 829 CE1 PHE A 53 -8.446 8.681 -17.919 1.00 42.52 C ATOM 830 CE2 PHE A 53 -6.563 10.152 -17.814 1.00 60.00 C ATOM 831 CZ PHE A 53 -7.213 9.010 -17.390 1.00 50.32 C ATOM 0 H PHE A 53 -10.091 13.295 -21.650 1.00 34.21 H new ATOM 0 HA PHE A 53 -11.100 11.339 -19.871 1.00 3.11 H new ATOM 0 HB2 PHE A 53 -9.152 10.952 -21.260 1.00 63.21 H new ATOM 0 HB3 PHE A 53 -8.320 12.337 -20.581 1.00 63.21 H new ATOM 0 HD1 PHE A 53 -9.990 9.232 -19.283 1.00 3.52 H new ATOM 0 HD2 PHE A 53 -6.636 11.855 -19.094 1.00 63.54 H new ATOM 0 HE1 PHE A 53 -8.956 7.789 -17.587 1.00 42.52 H new ATOM 0 HE2 PHE A 53 -5.599 10.411 -17.401 1.00 60.00 H new ATOM 0 HZ PHE A 53 -6.758 8.374 -16.645 1.00 50.32 H new ATOM 841 N VAL A 54 -9.775 14.027 -18.530 1.00 41.11 N ATOM 842 CA VAL A 54 -9.642 14.769 -17.284 1.00 42.55 C ATOM 843 C VAL A 54 -11.017 15.022 -16.662 1.00 30.24 C ATOM 844 O VAL A 54 -11.180 14.961 -15.444 1.00 23.44 O ATOM 845 CB VAL A 54 -8.909 16.116 -17.496 1.00 33.04 C ATOM 846 CG1 VAL A 54 -8.720 16.849 -16.174 1.00 61.31 C ATOM 847 CG2 VAL A 54 -7.565 15.898 -18.176 1.00 35.32 C ATOM 0 H VAL A 54 -9.481 14.540 -19.361 1.00 41.11 H new ATOM 0 HA VAL A 54 -9.044 14.160 -16.606 1.00 42.55 H new ATOM 0 HB VAL A 54 -9.529 16.735 -18.145 1.00 33.04 H new ATOM 0 HG11 VAL A 54 -8.203 17.792 -16.351 1.00 61.31 H new ATOM 0 HG12 VAL A 54 -9.693 17.048 -15.726 1.00 61.31 H new ATOM 0 HG13 VAL A 54 -8.128 16.232 -15.497 1.00 61.31 H new ATOM 0 HG21 VAL A 54 -7.068 16.858 -18.315 1.00 35.32 H new ATOM 0 HG22 VAL A 54 -6.943 15.254 -17.555 1.00 35.32 H new ATOM 0 HG23 VAL A 54 -7.720 15.426 -19.146 1.00 35.32 H new ATOM 857 N GLU A 55 -12.007 15.281 -17.509 1.00 1.32 N ATOM 858 CA GLU A 55 -13.367 15.549 -17.049 1.00 3.13 C ATOM 859 C GLU A 55 -14.028 14.296 -16.483 1.00 15.45 C ATOM 860 O GLU A 55 -14.646 14.342 -15.419 1.00 13.35 O ATOM 861 CB GLU A 55 -14.214 16.114 -18.187 1.00 2.20 C ATOM 862 CG GLU A 55 -13.778 17.496 -18.644 1.00 25.31 C ATOM 863 CD GLU A 55 -14.056 18.569 -17.611 1.00 3.25 C ATOM 864 OE1 GLU A 55 -13.258 18.718 -16.663 1.00 52.52 O ATOM 865 OE2 GLU A 55 -15.071 19.284 -17.754 1.00 73.43 O ATOM 0 H GLU A 55 -11.893 15.311 -18.522 1.00 1.32 H new ATOM 0 HA GLU A 55 -13.301 16.286 -16.249 1.00 3.13 H new ATOM 0 HB2 GLU A 55 -14.171 15.430 -19.035 1.00 2.20 H new ATOM 0 HB3 GLU A 55 -15.255 16.158 -17.866 1.00 2.20 H new ATOM 0 HG2 GLU A 55 -12.711 17.480 -18.867 1.00 25.31 H new ATOM 0 HG3 GLU A 55 -14.294 17.747 -19.571 1.00 25.31 H new ATOM 872 N GLU A 56 -13.893 13.172 -17.183 1.00 11.34 N ATOM 873 CA GLU A 56 -14.521 11.933 -16.735 1.00 22.13 C ATOM 874 C GLU A 56 -13.851 11.395 -15.472 1.00 51.15 C ATOM 875 O GLU A 56 -14.445 10.613 -14.733 1.00 14.41 O ATOM 876 CB GLU A 56 -14.534 10.881 -17.851 1.00 71.03 C ATOM 877 CG GLU A 56 -13.176 10.588 -18.468 1.00 75.03 C ATOM 878 CD GLU A 56 -13.280 9.667 -19.667 1.00 24.34 C ATOM 879 OE1 GLU A 56 -13.719 10.131 -20.743 1.00 44.04 O ATOM 880 OE2 GLU A 56 -12.951 8.472 -19.536 1.00 43.41 O ATOM 0 H GLU A 56 -13.362 13.094 -18.050 1.00 11.34 H new ATOM 0 HA GLU A 56 -15.557 12.161 -16.485 1.00 22.13 H new ATOM 0 HB2 GLU A 56 -14.943 9.953 -17.451 1.00 71.03 H new ATOM 0 HB3 GLU A 56 -15.210 11.215 -18.638 1.00 71.03 H new ATOM 0 HG2 GLU A 56 -12.706 11.524 -18.770 1.00 75.03 H new ATOM 0 HG3 GLU A 56 -12.528 10.134 -17.718 1.00 75.03 H new ATOM 887 N MET A 57 -12.618 11.817 -15.225 1.00 11.31 N ATOM 888 CA MET A 57 -11.952 11.519 -13.963 1.00 2.33 C ATOM 889 C MET A 57 -12.427 12.491 -12.886 1.00 14.44 C ATOM 890 O MET A 57 -12.682 12.105 -11.743 1.00 74.24 O ATOM 891 CB MET A 57 -10.430 11.611 -14.119 1.00 2.14 C ATOM 892 CG MET A 57 -9.678 11.400 -12.815 1.00 54.13 C ATOM 893 SD MET A 57 -7.893 11.589 -12.990 1.00 70.45 S ATOM 894 CE MET A 57 -7.507 10.208 -14.063 1.00 71.43 C ATOM 0 H MET A 57 -12.060 12.365 -15.879 1.00 11.31 H new ATOM 0 HA MET A 57 -12.206 10.501 -13.667 1.00 2.33 H new ATOM 0 HB2 MET A 57 -10.101 10.867 -14.845 1.00 2.14 H new ATOM 0 HB3 MET A 57 -10.172 12.589 -14.525 1.00 2.14 H new ATOM 0 HG2 MET A 57 -10.042 12.111 -12.073 1.00 54.13 H new ATOM 0 HG3 MET A 57 -9.896 10.402 -12.434 1.00 54.13 H new ATOM 0 HE1 MET A 57 -6.646 9.669 -13.667 1.00 71.43 H new ATOM 0 HE2 MET A 57 -8.364 9.536 -14.114 1.00 71.43 H new ATOM 0 HE3 MET A 57 -7.276 10.577 -15.062 1.00 71.43 H new ATOM 904 N LYS A 58 -12.562 13.750 -13.279 1.00 22.45 N ATOM 905 CA LYS A 58 -12.975 14.821 -12.380 1.00 61.33 C ATOM 906 C LYS A 58 -14.356 14.558 -11.777 1.00 11.03 C ATOM 907 O LYS A 58 -14.566 14.780 -10.583 1.00 33.45 O ATOM 908 CB LYS A 58 -12.935 16.157 -13.143 1.00 20.00 C ATOM 909 CG LYS A 58 -13.779 17.274 -12.548 1.00 42.34 C ATOM 910 CD LYS A 58 -15.124 17.384 -13.254 1.00 13.11 C ATOM 911 CE LYS A 58 -15.948 18.542 -12.721 1.00 42.13 C ATOM 912 NZ LYS A 58 -16.279 18.370 -11.283 1.00 72.21 N ATOM 0 H LYS A 58 -12.387 14.060 -14.235 1.00 22.45 H new ATOM 0 HA LYS A 58 -12.281 14.866 -11.541 1.00 61.33 H new ATOM 0 HB2 LYS A 58 -11.900 16.495 -13.195 1.00 20.00 H new ATOM 0 HB3 LYS A 58 -13.265 15.981 -14.167 1.00 20.00 H new ATOM 0 HG2 LYS A 58 -13.937 17.087 -11.486 1.00 42.34 H new ATOM 0 HG3 LYS A 58 -13.244 18.220 -12.629 1.00 42.34 H new ATOM 0 HD2 LYS A 58 -14.963 17.515 -14.324 1.00 13.11 H new ATOM 0 HD3 LYS A 58 -15.679 16.454 -13.126 1.00 13.11 H new ATOM 0 HE2 LYS A 58 -15.398 19.473 -12.858 1.00 42.13 H new ATOM 0 HE3 LYS A 58 -16.869 18.628 -13.298 1.00 42.13 H new ATOM 0 HZ1 LYS A 58 -17.050 19.018 -11.024 1.00 72.21 H new ATOM 0 HZ2 LYS A 58 -16.578 17.389 -11.111 1.00 72.21 H new ATOM 0 HZ3 LYS A 58 -15.440 18.582 -10.706 1.00 72.21 H new ATOM 926 N LYS A 59 -15.283 14.065 -12.593 1.00 54.25 N ATOM 927 CA LYS A 59 -16.650 13.805 -12.136 1.00 23.35 C ATOM 928 C LYS A 59 -16.690 12.701 -11.079 1.00 64.22 C ATOM 929 O LYS A 59 -17.653 12.589 -10.322 1.00 11.40 O ATOM 930 CB LYS A 59 -17.561 13.443 -13.314 1.00 23.42 C ATOM 931 CG LYS A 59 -17.147 12.179 -14.053 1.00 52.25 C ATOM 932 CD LYS A 59 -18.095 11.840 -15.199 1.00 3.44 C ATOM 933 CE LYS A 59 -19.379 11.166 -14.721 1.00 12.22 C ATOM 934 NZ LYS A 59 -20.267 12.080 -13.949 1.00 54.42 N ATOM 0 H LYS A 59 -15.116 13.837 -13.573 1.00 54.25 H new ATOM 0 HA LYS A 59 -17.018 14.723 -11.678 1.00 23.35 H new ATOM 0 HB2 LYS A 59 -18.580 13.319 -12.947 1.00 23.42 H new ATOM 0 HB3 LYS A 59 -17.575 14.275 -14.018 1.00 23.42 H new ATOM 0 HG2 LYS A 59 -16.138 12.304 -14.445 1.00 52.25 H new ATOM 0 HG3 LYS A 59 -17.116 11.345 -13.352 1.00 52.25 H new ATOM 0 HD2 LYS A 59 -18.348 12.753 -15.738 1.00 3.44 H new ATOM 0 HD3 LYS A 59 -17.586 11.184 -15.904 1.00 3.44 H new ATOM 0 HE2 LYS A 59 -19.924 10.783 -15.584 1.00 12.22 H new ATOM 0 HE3 LYS A 59 -19.122 10.308 -14.100 1.00 12.22 H new ATOM 0 HZ1 LYS A 59 -21.261 11.828 -14.123 1.00 54.42 H new ATOM 0 HZ2 LYS A 59 -20.060 11.990 -12.934 1.00 54.42 H new ATOM 0 HZ3 LYS A 59 -20.101 13.062 -14.250 1.00 54.42 H new ATOM 948 N LEU A 60 -15.652 11.880 -11.039 1.00 14.01 N ATOM 949 CA LEU A 60 -15.586 10.780 -10.086 1.00 73.41 C ATOM 950 C LEU A 60 -15.049 11.258 -8.738 1.00 11.22 C ATOM 951 O LEU A 60 -15.544 10.867 -7.683 1.00 1.00 O ATOM 952 CB LEU A 60 -14.690 9.668 -10.635 1.00 74.10 C ATOM 953 CG LEU A 60 -15.123 9.084 -11.980 1.00 51.32 C ATOM 954 CD1 LEU A 60 -14.080 8.103 -12.492 1.00 74.43 C ATOM 955 CD2 LEU A 60 -16.478 8.406 -11.856 1.00 72.22 C ATOM 0 H LEU A 60 -14.843 11.954 -11.655 1.00 14.01 H new ATOM 0 HA LEU A 60 -16.595 10.394 -9.938 1.00 73.41 H new ATOM 0 HB2 LEU A 60 -13.677 10.057 -10.736 1.00 74.10 H new ATOM 0 HB3 LEU A 60 -14.650 8.861 -9.903 1.00 74.10 H new ATOM 0 HG LEU A 60 -15.212 9.899 -12.698 1.00 51.32 H new ATOM 0 HD11 LEU A 60 -14.403 7.696 -13.450 1.00 74.43 H new ATOM 0 HD12 LEU A 60 -13.128 8.618 -12.619 1.00 74.43 H new ATOM 0 HD13 LEU A 60 -13.961 7.291 -11.775 1.00 74.43 H new ATOM 0 HD21 LEU A 60 -16.770 7.996 -12.823 1.00 72.22 H new ATOM 0 HD22 LEU A 60 -16.416 7.600 -11.124 1.00 72.22 H new ATOM 0 HD23 LEU A 60 -17.221 9.134 -11.531 1.00 72.22 H new ATOM 967 N VAL A 61 -14.044 12.119 -8.787 1.00 13.12 N ATOM 968 CA VAL A 61 -13.350 12.564 -7.581 1.00 63.24 C ATOM 969 C VAL A 61 -14.152 13.629 -6.825 1.00 11.20 C ATOM 970 O VAL A 61 -14.009 13.779 -5.610 1.00 64.22 O ATOM 971 CB VAL A 61 -11.948 13.122 -7.929 1.00 54.15 C ATOM 972 CG1 VAL A 61 -11.185 13.519 -6.672 1.00 2.00 C ATOM 973 CG2 VAL A 61 -11.152 12.105 -8.736 1.00 44.14 C ATOM 0 H VAL A 61 -13.687 12.527 -9.651 1.00 13.12 H new ATOM 0 HA VAL A 61 -13.242 11.693 -6.935 1.00 63.24 H new ATOM 0 HB VAL A 61 -12.086 14.017 -8.536 1.00 54.15 H new ATOM 0 HG11 VAL A 61 -10.205 13.907 -6.949 1.00 2.00 H new ATOM 0 HG12 VAL A 61 -11.742 14.288 -6.136 1.00 2.00 H new ATOM 0 HG13 VAL A 61 -11.062 12.647 -6.030 1.00 2.00 H new ATOM 0 HG21 VAL A 61 -10.170 12.515 -8.971 1.00 44.14 H new ATOM 0 HG22 VAL A 61 -11.034 11.191 -8.154 1.00 44.14 H new ATOM 0 HG23 VAL A 61 -11.682 11.880 -9.661 1.00 44.14 H new ATOM 983 N GLU A 62 -15.020 14.341 -7.540 1.00 12.21 N ATOM 984 CA GLU A 62 -15.757 15.472 -6.968 1.00 74.43 C ATOM 985 C GLU A 62 -16.681 15.057 -5.817 1.00 41.10 C ATOM 986 O GLU A 62 -17.151 15.910 -5.060 1.00 73.12 O ATOM 987 CB GLU A 62 -16.563 16.197 -8.045 1.00 34.43 C ATOM 988 CG GLU A 62 -17.579 15.320 -8.752 1.00 35.12 C ATOM 989 CD GLU A 62 -18.415 16.096 -9.743 1.00 52.15 C ATOM 990 OE1 GLU A 62 -17.919 16.387 -10.847 1.00 23.23 O ATOM 991 OE2 GLU A 62 -19.573 16.430 -9.415 1.00 44.23 O ATOM 0 H GLU A 62 -15.233 14.156 -8.520 1.00 12.21 H new ATOM 0 HA GLU A 62 -15.008 16.149 -6.557 1.00 74.43 H new ATOM 0 HB2 GLU A 62 -17.081 17.041 -7.590 1.00 34.43 H new ATOM 0 HB3 GLU A 62 -15.875 16.607 -8.785 1.00 34.43 H new ATOM 0 HG2 GLU A 62 -17.061 14.513 -9.270 1.00 35.12 H new ATOM 0 HG3 GLU A 62 -18.233 14.857 -8.013 1.00 35.12 H new ATOM 998 N ASP A 63 -16.929 13.756 -5.678 1.00 22.40 N ATOM 999 CA ASP A 63 -17.806 13.250 -4.619 1.00 4.12 C ATOM 1000 C ASP A 63 -17.217 13.559 -3.245 1.00 44.02 C ATOM 1001 O ASP A 63 -17.946 13.757 -2.271 1.00 5.04 O ATOM 1002 CB ASP A 63 -18.000 11.735 -4.771 1.00 74.44 C ATOM 1003 CG ASP A 63 -18.872 11.136 -3.681 1.00 30.21 C ATOM 1004 OD1 ASP A 63 -20.109 11.295 -3.753 1.00 33.13 O ATOM 1005 OD2 ASP A 63 -18.328 10.486 -2.758 1.00 23.24 O ATOM 0 H ASP A 63 -16.537 13.034 -6.282 1.00 22.40 H new ATOM 0 HA ASP A 63 -18.773 13.745 -4.707 1.00 4.12 H new ATOM 0 HB2 ASP A 63 -18.448 11.527 -5.743 1.00 74.44 H new ATOM 0 HB3 ASP A 63 -17.026 11.246 -4.759 1.00 74.44 H new ATOM 1010 N GLY A 64 -15.898 13.627 -3.189 1.00 1.10 N ATOM 1011 CA GLY A 64 -15.209 13.946 -1.958 1.00 73.43 C ATOM 1012 C GLY A 64 -13.727 14.081 -2.199 1.00 13.40 C ATOM 1013 O GLY A 64 -13.301 14.885 -3.025 1.00 40.53 O ATOM 0 H GLY A 64 -15.284 13.464 -3.987 1.00 1.10 H new ATOM 0 HA2 GLY A 64 -15.602 14.875 -1.545 1.00 73.43 H new ATOM 0 HA3 GLY A 64 -15.393 13.166 -1.219 1.00 73.43 H new ATOM 1017 N LYS A 65 -12.938 13.302 -1.487 1.00 2.41 N ATOM 1018 CA LYS A 65 -11.518 13.222 -1.767 1.00 32.42 C ATOM 1019 C LYS A 65 -11.144 11.799 -2.153 1.00 24.13 C ATOM 1020 O LYS A 65 -10.707 10.997 -1.325 1.00 50.44 O ATOM 1021 CB LYS A 65 -10.684 13.743 -0.595 1.00 74.32 C ATOM 1022 CG LYS A 65 -11.121 13.247 0.774 1.00 50.15 C ATOM 1023 CD LYS A 65 -10.382 14.002 1.860 1.00 1.12 C ATOM 1024 CE LYS A 65 -10.693 13.487 3.252 1.00 25.10 C ATOM 1025 NZ LYS A 65 -9.928 14.240 4.284 1.00 14.13 N ATOM 0 H LYS A 65 -13.254 12.717 -0.713 1.00 2.41 H new ATOM 0 HA LYS A 65 -11.292 13.870 -2.614 1.00 32.42 H new ATOM 0 HB2 LYS A 65 -9.644 13.458 -0.753 1.00 74.32 H new ATOM 0 HB3 LYS A 65 -10.720 14.832 -0.599 1.00 74.32 H new ATOM 0 HG2 LYS A 65 -12.196 13.383 0.893 1.00 50.15 H new ATOM 0 HG3 LYS A 65 -10.923 12.179 0.863 1.00 50.15 H new ATOM 0 HD2 LYS A 65 -9.309 13.928 1.682 1.00 1.12 H new ATOM 0 HD3 LYS A 65 -10.642 15.059 1.802 1.00 1.12 H new ATOM 0 HE2 LYS A 65 -11.761 13.579 3.447 1.00 25.10 H new ATOM 0 HE3 LYS A 65 -10.448 12.427 3.314 1.00 25.10 H new ATOM 0 HZ1 LYS A 65 -9.940 13.712 5.180 1.00 14.13 H new ATOM 0 HZ2 LYS A 65 -8.945 14.362 3.967 1.00 14.13 H new ATOM 0 HZ3 LYS A 65 -10.364 15.173 4.427 1.00 14.13 H new ATOM 1039 N GLU A 66 -11.357 11.488 -3.421 1.00 61.31 N ATOM 1040 CA GLU A 66 -11.175 10.139 -3.929 1.00 12.03 C ATOM 1041 C GLU A 66 -9.848 10.012 -4.668 1.00 1.12 C ATOM 1042 O GLU A 66 -9.390 10.960 -5.311 1.00 5.41 O ATOM 1043 CB GLU A 66 -12.347 9.782 -4.858 1.00 14.35 C ATOM 1044 CG GLU A 66 -12.247 8.406 -5.503 1.00 63.22 C ATOM 1045 CD GLU A 66 -12.215 7.274 -4.493 1.00 32.11 C ATOM 1046 OE1 GLU A 66 -11.125 6.984 -3.960 1.00 20.24 O ATOM 1047 OE2 GLU A 66 -13.275 6.661 -4.252 1.00 32.23 O ATOM 0 H GLU A 66 -11.660 12.161 -4.125 1.00 61.31 H new ATOM 0 HA GLU A 66 -11.156 9.443 -3.090 1.00 12.03 H new ATOM 0 HB2 GLU A 66 -13.275 9.835 -4.288 1.00 14.35 H new ATOM 0 HB3 GLU A 66 -12.412 10.534 -5.645 1.00 14.35 H new ATOM 0 HG2 GLU A 66 -13.095 8.263 -6.173 1.00 63.22 H new ATOM 0 HG3 GLU A 66 -11.346 8.363 -6.116 1.00 63.22 H new ATOM 1054 N CYS A 67 -9.236 8.843 -4.567 1.00 63.54 N ATOM 1055 CA CYS A 67 -8.005 8.557 -5.277 1.00 1.32 C ATOM 1056 C CYS A 67 -8.343 7.853 -6.583 1.00 4.41 C ATOM 1057 O CYS A 67 -9.052 6.844 -6.592 1.00 72.53 O ATOM 1058 CB CYS A 67 -7.086 7.683 -4.416 1.00 1.41 C ATOM 1059 SG CYS A 67 -6.694 8.399 -2.800 1.00 42.51 S ATOM 0 H CYS A 67 -9.578 8.072 -3.994 1.00 63.54 H new ATOM 0 HA CYS A 67 -7.480 9.487 -5.492 1.00 1.32 H new ATOM 0 HB2 CYS A 67 -7.559 6.712 -4.267 1.00 1.41 H new ATOM 0 HB3 CYS A 67 -6.157 7.505 -4.958 1.00 1.41 H new ATOM 0 HG CYS A 67 -5.405 8.509 -2.675 1.00 42.51 H new ATOM 1065 N ARG A 68 -7.852 8.376 -7.689 1.00 72.11 N ATOM 1066 CA ARG A 68 -8.223 7.834 -8.979 1.00 24.14 C ATOM 1067 C ARG A 68 -6.988 7.483 -9.788 1.00 15.41 C ATOM 1068 O ARG A 68 -6.283 8.359 -10.276 1.00 22.02 O ATOM 1069 CB ARG A 68 -9.097 8.826 -9.750 1.00 42.25 C ATOM 1070 CG ARG A 68 -10.106 8.154 -10.667 1.00 13.31 C ATOM 1071 CD ARG A 68 -11.369 7.735 -9.918 1.00 45.30 C ATOM 1072 NE ARG A 68 -11.092 6.941 -8.718 1.00 11.34 N ATOM 1073 CZ ARG A 68 -11.963 6.098 -8.162 1.00 23.13 C ATOM 1074 NH1 ARG A 68 -13.142 5.881 -8.737 1.00 55.13 N ATOM 1075 NH2 ARG A 68 -11.652 5.474 -7.032 1.00 11.24 N ATOM 0 H ARG A 68 -7.205 9.164 -7.721 1.00 72.11 H new ATOM 0 HA ARG A 68 -8.798 6.923 -8.811 1.00 24.14 H new ATOM 0 HB2 ARG A 68 -9.628 9.460 -9.040 1.00 42.25 H new ATOM 0 HB3 ARG A 68 -8.457 9.479 -10.343 1.00 42.25 H new ATOM 0 HG2 ARG A 68 -10.373 8.836 -11.474 1.00 13.31 H new ATOM 0 HG3 ARG A 68 -9.650 7.278 -11.128 1.00 13.31 H new ATOM 0 HD2 ARG A 68 -11.928 8.627 -9.635 1.00 45.30 H new ATOM 0 HD3 ARG A 68 -12.007 7.158 -10.588 1.00 45.30 H new ATOM 0 HE ARG A 68 -10.176 7.039 -8.281 1.00 11.34 H new ATOM 0 HH11 ARG A 68 -13.382 6.360 -9.605 1.00 55.13 H new ATOM 0 HH12 ARG A 68 -13.807 5.236 -8.310 1.00 55.13 H new ATOM 0 HH21 ARG A 68 -10.748 5.640 -6.590 1.00 11.24 H new ATOM 0 HH22 ARG A 68 -12.317 4.829 -6.606 1.00 11.24 H new ATOM 1089 N TYR A 69 -6.722 6.201 -9.911 1.00 25.34 N ATOM 1090 CA TYR A 69 -5.584 5.740 -10.682 1.00 51.55 C ATOM 1091 C TYR A 69 -6.046 5.161 -12.014 1.00 14.44 C ATOM 1092 O TYR A 69 -6.920 4.295 -12.060 1.00 52.40 O ATOM 1093 CB TYR A 69 -4.768 4.723 -9.876 1.00 20.02 C ATOM 1094 CG TYR A 69 -5.596 3.755 -9.056 1.00 75.50 C ATOM 1095 CD1 TYR A 69 -6.018 2.544 -9.587 1.00 44.53 C ATOM 1096 CD2 TYR A 69 -5.947 4.055 -7.745 1.00 43.45 C ATOM 1097 CE1 TYR A 69 -6.767 1.659 -8.836 1.00 34.21 C ATOM 1098 CE2 TYR A 69 -6.693 3.174 -6.986 1.00 54.42 C ATOM 1099 CZ TYR A 69 -7.101 1.978 -7.538 1.00 41.31 C ATOM 1100 OH TYR A 69 -7.840 1.093 -6.788 1.00 55.24 O ATOM 0 H TYR A 69 -7.277 5.458 -9.488 1.00 25.34 H new ATOM 0 HA TYR A 69 -4.934 6.588 -10.897 1.00 51.55 H new ATOM 0 HB2 TYR A 69 -4.142 4.153 -10.563 1.00 20.02 H new ATOM 0 HB3 TYR A 69 -4.098 5.263 -9.208 1.00 20.02 H new ATOM 0 HD1 TYR A 69 -5.757 2.290 -10.604 1.00 44.53 H new ATOM 0 HD2 TYR A 69 -5.631 4.993 -7.312 1.00 43.45 H new ATOM 0 HE1 TYR A 69 -7.089 0.721 -9.264 1.00 34.21 H new ATOM 0 HE2 TYR A 69 -6.955 3.420 -5.968 1.00 54.42 H new ATOM 0 HH TYR A 69 -7.604 1.189 -5.842 1.00 55.24 H new ATOM 1110 N ALA A 70 -5.472 5.661 -13.097 1.00 72.51 N ATOM 1111 CA ALA A 70 -5.891 5.260 -14.428 1.00 25.41 C ATOM 1112 C ALA A 70 -4.696 5.004 -15.331 1.00 73.24 C ATOM 1113 O ALA A 70 -3.615 5.551 -15.120 1.00 55.04 O ATOM 1114 CB ALA A 70 -6.782 6.329 -15.035 1.00 64.44 C ATOM 0 H ALA A 70 -4.715 6.345 -13.079 1.00 72.51 H new ATOM 0 HA ALA A 70 -6.451 4.329 -14.339 1.00 25.41 H new ATOM 0 HB1 ALA A 70 -7.092 6.020 -16.033 1.00 64.44 H new ATOM 0 HB2 ALA A 70 -7.663 6.467 -14.408 1.00 64.44 H new ATOM 0 HB3 ALA A 70 -6.232 7.268 -15.100 1.00 64.44 H new ATOM 1120 N ALA A 71 -4.902 4.168 -16.334 1.00 51.22 N ATOM 1121 CA ALA A 71 -3.873 3.873 -17.313 1.00 40.03 C ATOM 1122 C ALA A 71 -4.233 4.504 -18.649 1.00 73.14 C ATOM 1123 O ALA A 71 -5.348 4.333 -19.145 1.00 52.54 O ATOM 1124 CB ALA A 71 -3.694 2.369 -17.458 1.00 50.45 C ATOM 0 H ALA A 71 -5.782 3.678 -16.491 1.00 51.22 H new ATOM 0 HA ALA A 71 -2.928 4.295 -16.972 1.00 40.03 H new ATOM 0 HB1 ALA A 71 -2.919 2.164 -18.196 1.00 50.45 H new ATOM 0 HB2 ALA A 71 -3.403 1.943 -16.498 1.00 50.45 H new ATOM 0 HB3 ALA A 71 -4.633 1.921 -17.784 1.00 50.45 H new ATOM 1130 N VAL A 72 -3.301 5.249 -19.216 1.00 63.13 N ATOM 1131 CA VAL A 72 -3.536 5.934 -20.475 1.00 73.13 C ATOM 1132 C VAL A 72 -2.420 5.649 -21.473 1.00 54.13 C ATOM 1133 O VAL A 72 -1.245 5.897 -21.198 1.00 71.51 O ATOM 1134 CB VAL A 72 -3.685 7.462 -20.268 1.00 24.34 C ATOM 1135 CG1 VAL A 72 -2.643 7.989 -19.290 1.00 21.32 C ATOM 1136 CG2 VAL A 72 -3.588 8.203 -21.594 1.00 44.43 C ATOM 0 H VAL A 72 -2.371 5.395 -18.823 1.00 63.13 H new ATOM 0 HA VAL A 72 -4.472 5.550 -20.880 1.00 73.13 H new ATOM 0 HB VAL A 72 -4.673 7.642 -19.844 1.00 24.34 H new ATOM 0 HG11 VAL A 72 -2.772 9.064 -19.165 1.00 21.32 H new ATOM 0 HG12 VAL A 72 -2.765 7.494 -18.327 1.00 21.32 H new ATOM 0 HG13 VAL A 72 -1.645 7.786 -19.678 1.00 21.32 H new ATOM 0 HG21 VAL A 72 -3.696 9.274 -21.421 1.00 44.43 H new ATOM 0 HG22 VAL A 72 -2.619 8.005 -22.051 1.00 44.43 H new ATOM 0 HG23 VAL A 72 -4.380 7.862 -22.260 1.00 44.43 H new ATOM 1146 N ASP A 73 -2.797 5.109 -22.621 1.00 65.32 N ATOM 1147 CA ASP A 73 -1.853 4.876 -23.701 1.00 3.33 C ATOM 1148 C ASP A 73 -1.872 6.058 -24.656 1.00 33.32 C ATOM 1149 O ASP A 73 -2.893 6.347 -25.291 1.00 71.44 O ATOM 1150 CB ASP A 73 -2.187 3.586 -24.454 1.00 14.50 C ATOM 1151 CG ASP A 73 -1.276 3.365 -25.648 1.00 52.23 C ATOM 1152 OD1 ASP A 73 -0.213 2.732 -25.484 1.00 31.34 O ATOM 1153 OD2 ASP A 73 -1.624 3.825 -26.755 1.00 73.21 O ATOM 0 H ASP A 73 -3.754 4.823 -22.829 1.00 65.32 H new ATOM 0 HA ASP A 73 -0.856 4.768 -23.274 1.00 3.33 H new ATOM 0 HB2 ASP A 73 -2.103 2.738 -23.774 1.00 14.50 H new ATOM 0 HB3 ASP A 73 -3.223 3.622 -24.792 1.00 14.50 H new ATOM 1158 N VAL A 74 -0.757 6.762 -24.730 1.00 20.32 N ATOM 1159 CA VAL A 74 -0.655 7.926 -25.591 1.00 21.31 C ATOM 1160 C VAL A 74 0.502 7.770 -26.571 1.00 60.33 C ATOM 1161 O VAL A 74 1.600 7.347 -26.199 1.00 54.21 O ATOM 1162 CB VAL A 74 -0.491 9.229 -24.767 1.00 5.44 C ATOM 1163 CG1 VAL A 74 0.725 9.153 -23.858 1.00 3.42 C ATOM 1164 CG2 VAL A 74 -0.403 10.446 -25.679 1.00 33.30 C ATOM 0 H VAL A 74 0.090 6.548 -24.204 1.00 20.32 H new ATOM 0 HA VAL A 74 -1.585 8.001 -26.155 1.00 21.31 H new ATOM 0 HB VAL A 74 -1.376 9.337 -24.140 1.00 5.44 H new ATOM 0 HG11 VAL A 74 0.815 10.080 -23.292 1.00 3.42 H new ATOM 0 HG12 VAL A 74 0.612 8.317 -23.168 1.00 3.42 H new ATOM 0 HG13 VAL A 74 1.621 9.007 -24.461 1.00 3.42 H new ATOM 0 HG21 VAL A 74 -0.288 11.346 -25.075 1.00 33.30 H new ATOM 0 HG22 VAL A 74 0.456 10.342 -26.342 1.00 33.30 H new ATOM 0 HG23 VAL A 74 -1.313 10.522 -26.274 1.00 33.30 H new ATOM 1174 N GLU A 75 0.248 8.097 -27.826 1.00 11.22 N ATOM 1175 CA GLU A 75 1.265 8.002 -28.855 1.00 41.23 C ATOM 1176 C GLU A 75 1.952 9.350 -29.031 1.00 43.01 C ATOM 1177 O GLU A 75 1.297 10.388 -29.153 1.00 50.43 O ATOM 1178 CB GLU A 75 0.671 7.512 -30.188 1.00 55.31 C ATOM 1179 CG GLU A 75 -0.333 8.459 -30.836 1.00 2.13 C ATOM 1180 CD GLU A 75 -1.621 8.594 -30.049 1.00 43.14 C ATOM 1181 OE1 GLU A 75 -2.536 7.775 -30.252 1.00 12.41 O ATOM 1182 OE2 GLU A 75 -1.719 9.520 -29.220 1.00 61.11 O ATOM 0 H GLU A 75 -0.657 8.432 -28.156 1.00 11.22 H new ATOM 0 HA GLU A 75 2.005 7.267 -28.539 1.00 41.23 H new ATOM 0 HB2 GLU A 75 1.487 7.337 -30.889 1.00 55.31 H new ATOM 0 HB3 GLU A 75 0.184 6.551 -30.020 1.00 55.31 H new ATOM 0 HG2 GLU A 75 0.123 9.443 -30.945 1.00 2.13 H new ATOM 0 HG3 GLU A 75 -0.564 8.102 -31.840 1.00 2.13 H new ATOM 1189 N VAL A 76 3.272 9.340 -29.007 1.00 34.04 N ATOM 1190 CA VAL A 76 4.037 10.564 -29.158 1.00 74.40 C ATOM 1191 C VAL A 76 4.928 10.473 -30.390 1.00 20.45 C ATOM 1192 O VAL A 76 5.720 9.537 -30.525 1.00 1.33 O ATOM 1193 CB VAL A 76 4.903 10.852 -27.912 1.00 43.11 C ATOM 1194 CG1 VAL A 76 5.573 12.212 -28.025 1.00 12.14 C ATOM 1195 CG2 VAL A 76 4.066 10.773 -26.647 1.00 1.10 C ATOM 0 H VAL A 76 3.836 8.499 -28.885 1.00 34.04 H new ATOM 0 HA VAL A 76 3.329 11.384 -29.275 1.00 74.40 H new ATOM 0 HB VAL A 76 5.681 10.091 -27.856 1.00 43.11 H new ATOM 0 HG11 VAL A 76 6.178 12.394 -27.137 1.00 12.14 H new ATOM 0 HG12 VAL A 76 6.211 12.231 -28.909 1.00 12.14 H new ATOM 0 HG13 VAL A 76 4.811 12.987 -28.111 1.00 12.14 H new ATOM 0 HG21 VAL A 76 4.695 10.979 -25.781 1.00 1.10 H new ATOM 0 HG22 VAL A 76 3.263 11.509 -26.695 1.00 1.10 H new ATOM 0 HG23 VAL A 76 3.638 9.775 -26.555 1.00 1.10 H new ATOM 1205 N THR A 77 4.773 11.432 -31.293 1.00 41.03 N ATOM 1206 CA THR A 77 5.561 11.467 -32.513 1.00 62.20 C ATOM 1207 C THR A 77 6.872 12.201 -32.284 1.00 53.54 C ATOM 1208 O THR A 77 6.893 13.407 -32.034 1.00 33.03 O ATOM 1209 CB THR A 77 4.785 12.126 -33.674 1.00 5.11 C ATOM 1210 OG1 THR A 77 5.648 12.336 -34.799 1.00 12.34 O ATOM 1211 CG2 THR A 77 4.154 13.449 -33.256 1.00 33.15 C ATOM 0 H THR A 77 4.106 12.198 -31.201 1.00 41.03 H new ATOM 0 HA THR A 77 5.774 10.435 -32.791 1.00 62.20 H new ATOM 0 HB THR A 77 3.983 11.443 -33.954 1.00 5.11 H new ATOM 0 HG1 THR A 77 5.141 12.753 -35.527 1.00 12.34 H new ATOM 0 HG21 THR A 77 3.618 13.880 -34.102 1.00 33.15 H new ATOM 0 HG22 THR A 77 3.458 13.277 -32.435 1.00 33.15 H new ATOM 0 HG23 THR A 77 4.934 14.138 -32.932 1.00 33.15 H new ATOM 1219 N VAL A 78 7.968 11.461 -32.339 1.00 53.42 N ATOM 1220 CA VAL A 78 9.281 12.038 -32.123 1.00 63.31 C ATOM 1221 C VAL A 78 10.291 11.409 -33.068 1.00 21.43 C ATOM 1222 O VAL A 78 10.034 10.355 -33.627 1.00 23.41 O ATOM 1223 CB VAL A 78 9.781 11.823 -30.678 1.00 11.15 C ATOM 1224 CG1 VAL A 78 10.709 12.948 -30.276 1.00 15.44 C ATOM 1225 CG2 VAL A 78 8.635 11.701 -29.687 1.00 63.33 C ATOM 0 H VAL A 78 7.972 10.459 -32.532 1.00 53.42 H new ATOM 0 HA VAL A 78 9.187 13.108 -32.309 1.00 63.31 H new ATOM 0 HB VAL A 78 10.327 10.880 -30.657 1.00 11.15 H new ATOM 0 HG11 VAL A 78 11.056 12.787 -29.255 1.00 15.44 H new ATOM 0 HG12 VAL A 78 11.565 12.972 -30.950 1.00 15.44 H new ATOM 0 HG13 VAL A 78 10.176 13.897 -30.332 1.00 15.44 H new ATOM 0 HG21 VAL A 78 9.035 11.551 -28.684 1.00 63.33 H new ATOM 0 HG22 VAL A 78 8.038 12.613 -29.707 1.00 63.33 H new ATOM 0 HG23 VAL A 78 8.008 10.851 -29.958 1.00 63.33 H new ATOM 1235 N GLN A 79 11.431 12.050 -33.255 1.00 43.21 N ATOM 1236 CA GLN A 79 12.507 11.441 -34.016 1.00 11.22 C ATOM 1237 C GLN A 79 13.402 10.659 -33.060 1.00 31.22 C ATOM 1238 O GLN A 79 14.147 11.247 -32.273 1.00 41.44 O ATOM 1239 CB GLN A 79 13.317 12.509 -34.750 1.00 1.12 C ATOM 1240 CG GLN A 79 14.317 11.944 -35.742 1.00 2.42 C ATOM 1241 CD GLN A 79 15.314 12.984 -36.214 1.00 62.32 C ATOM 1242 OE1 GLN A 79 15.082 13.697 -37.193 1.00 61.54 O ATOM 1243 NE2 GLN A 79 16.437 13.076 -35.523 1.00 31.41 N ATOM 0 H GLN A 79 11.635 12.982 -32.895 1.00 43.21 H new ATOM 0 HA GLN A 79 12.089 10.766 -34.763 1.00 11.22 H new ATOM 0 HB2 GLN A 79 12.632 13.173 -35.277 1.00 1.12 H new ATOM 0 HB3 GLN A 79 13.849 13.116 -34.017 1.00 1.12 H new ATOM 0 HG2 GLN A 79 14.853 11.114 -35.281 1.00 2.42 H new ATOM 0 HG3 GLN A 79 13.783 11.540 -36.602 1.00 2.42 H new ATOM 0 HE21 GLN A 79 16.592 12.468 -34.719 1.00 31.41 H new ATOM 0 HE22 GLN A 79 17.148 13.755 -35.794 1.00 31.41 H new ATOM 1252 N ARG A 80 13.310 9.337 -33.102 1.00 52.53 N ATOM 1253 CA ARG A 80 14.046 8.501 -32.163 1.00 20.35 C ATOM 1254 C ARG A 80 15.140 7.726 -32.883 1.00 1.42 C ATOM 1255 O ARG A 80 15.176 7.683 -34.112 1.00 71.22 O ATOM 1256 CB ARG A 80 13.108 7.518 -31.446 1.00 5.22 C ATOM 1257 CG ARG A 80 11.892 8.168 -30.796 1.00 35.14 C ATOM 1258 CD ARG A 80 12.276 9.260 -29.808 1.00 24.54 C ATOM 1259 NE ARG A 80 13.005 8.752 -28.640 1.00 33.32 N ATOM 1260 CZ ARG A 80 12.805 9.200 -27.399 1.00 62.23 C ATOM 1261 NH1 ARG A 80 11.826 10.067 -27.165 1.00 53.25 N ATOM 1262 NH2 ARG A 80 13.554 8.761 -26.389 1.00 11.15 N ATOM 0 H ARG A 80 12.737 8.823 -33.771 1.00 52.53 H new ATOM 0 HA ARG A 80 14.499 9.158 -31.420 1.00 20.35 H new ATOM 0 HB2 ARG A 80 12.766 6.772 -32.164 1.00 5.22 H new ATOM 0 HB3 ARG A 80 13.674 6.988 -30.680 1.00 5.22 H new ATOM 0 HG2 ARG A 80 11.252 8.591 -31.570 1.00 35.14 H new ATOM 0 HG3 ARG A 80 11.308 7.405 -30.281 1.00 35.14 H new ATOM 0 HD2 ARG A 80 12.891 10.002 -30.317 1.00 24.54 H new ATOM 0 HD3 ARG A 80 11.374 9.770 -29.471 1.00 24.54 H new ATOM 0 HE ARG A 80 13.700 8.019 -28.784 1.00 33.32 H new ATOM 0 HH11 ARG A 80 11.233 10.386 -27.931 1.00 53.25 H new ATOM 0 HH12 ARG A 80 11.667 10.414 -26.219 1.00 53.25 H new ATOM 0 HH21 ARG A 80 14.290 8.075 -26.560 1.00 11.15 H new ATOM 0 HH22 ARG A 80 13.392 9.111 -25.445 1.00 11.15 H new ATOM 1276 N GLN A 81 16.030 7.116 -32.109 1.00 52.33 N ATOM 1277 CA GLN A 81 17.101 6.304 -32.666 1.00 63.34 C ATOM 1278 C GLN A 81 16.526 5.134 -33.448 1.00 1.40 C ATOM 1279 O GLN A 81 15.870 4.260 -32.882 1.00 61.00 O ATOM 1280 CB GLN A 81 18.013 5.793 -31.551 1.00 32.23 C ATOM 1281 CG GLN A 81 18.720 6.902 -30.792 1.00 20.42 C ATOM 1282 CD GLN A 81 19.581 6.373 -29.664 1.00 20.31 C ATOM 1283 OE1 GLN A 81 19.134 6.259 -28.524 1.00 2.53 O ATOM 1284 NE2 GLN A 81 20.817 6.024 -29.979 1.00 41.13 N ATOM 0 H GLN A 81 16.029 7.170 -31.090 1.00 52.33 H new ATOM 0 HA GLN A 81 17.688 6.923 -33.344 1.00 63.34 H new ATOM 0 HB2 GLN A 81 17.422 5.203 -30.850 1.00 32.23 H new ATOM 0 HB3 GLN A 81 18.759 5.124 -31.980 1.00 32.23 H new ATOM 0 HG2 GLN A 81 19.341 7.472 -31.483 1.00 20.42 H new ATOM 0 HG3 GLN A 81 17.979 7.591 -30.387 1.00 20.42 H new ATOM 0 HE21 GLN A 81 21.150 6.134 -30.937 1.00 41.13 H new ATOM 0 HE22 GLN A 81 21.438 5.644 -29.264 1.00 41.13 H new ATOM 1293 N GLY A 82 16.765 5.139 -34.747 1.00 54.33 N ATOM 1294 CA GLY A 82 16.240 4.102 -35.605 1.00 4.34 C ATOM 1295 C GLY A 82 15.580 4.672 -36.842 1.00 45.00 C ATOM 1296 O GLY A 82 15.585 4.048 -37.904 1.00 14.35 O ATOM 0 H GLY A 82 17.318 5.849 -35.226 1.00 54.33 H new ATOM 0 HA2 GLY A 82 17.048 3.432 -35.901 1.00 4.34 H new ATOM 0 HA3 GLY A 82 15.517 3.504 -35.051 1.00 4.34 H new ATOM 1300 N ALA A 83 15.015 5.864 -36.707 1.00 10.53 N ATOM 1301 CA ALA A 83 14.342 6.518 -37.816 1.00 64.32 C ATOM 1302 C ALA A 83 14.481 8.031 -37.724 1.00 20.31 C ATOM 1303 O ALA A 83 14.291 8.619 -36.662 1.00 71.42 O ATOM 1304 CB ALA A 83 12.874 6.120 -37.855 1.00 61.03 C ATOM 0 H ALA A 83 15.011 6.397 -35.837 1.00 10.53 H new ATOM 0 HA ALA A 83 14.817 6.191 -38.741 1.00 64.32 H new ATOM 0 HB1 ALA A 83 12.384 6.618 -38.691 1.00 61.03 H new ATOM 0 HB2 ALA A 83 12.793 5.040 -37.978 1.00 61.03 H new ATOM 0 HB3 ALA A 83 12.392 6.416 -36.923 1.00 61.03 H new ATOM 1310 N GLU A 84 14.805 8.650 -38.849 1.00 22.14 N ATOM 1311 CA GLU A 84 14.965 10.099 -38.923 1.00 4.34 C ATOM 1312 C GLU A 84 13.621 10.780 -39.167 1.00 51.01 C ATOM 1313 O GLU A 84 13.548 12.000 -39.321 1.00 45.51 O ATOM 1314 CB GLU A 84 15.921 10.464 -40.058 1.00 1.01 C ATOM 1315 CG GLU A 84 15.430 9.992 -41.416 1.00 41.43 C ATOM 1316 CD GLU A 84 16.267 10.515 -42.559 1.00 51.11 C ATOM 1317 OE1 GLU A 84 16.035 11.662 -42.991 1.00 40.23 O ATOM 1318 OE2 GLU A 84 17.146 9.772 -43.043 1.00 20.13 O ATOM 0 H GLU A 84 14.964 8.168 -39.733 1.00 22.14 H new ATOM 0 HA GLU A 84 15.372 10.442 -37.972 1.00 4.34 H new ATOM 0 HB2 GLU A 84 16.054 11.546 -40.081 1.00 1.01 H new ATOM 0 HB3 GLU A 84 16.899 10.026 -39.858 1.00 1.01 H new ATOM 0 HG2 GLU A 84 15.433 8.902 -41.439 1.00 41.43 H new ATOM 0 HG3 GLU A 84 14.397 10.311 -41.554 1.00 41.43 H new ATOM 1325 N GLY A 85 12.566 9.985 -39.212 1.00 71.34 N ATOM 1326 CA GLY A 85 11.254 10.513 -39.512 1.00 62.43 C ATOM 1327 C GLY A 85 10.374 10.583 -38.288 1.00 2.31 C ATOM 1328 O GLY A 85 10.838 10.357 -37.166 1.00 50.12 O ATOM 0 H GLY A 85 12.595 8.979 -39.045 1.00 71.34 H new ATOM 0 HA2 GLY A 85 11.355 11.509 -39.942 1.00 62.43 H new ATOM 0 HA3 GLY A 85 10.776 9.887 -40.266 1.00 62.43 H new ATOM 1332 N THR A 86 9.105 10.892 -38.501 1.00 32.04 N ATOM 1333 CA THR A 86 8.149 10.985 -37.414 1.00 10.14 C ATOM 1334 C THR A 86 7.883 9.616 -36.794 1.00 63.53 C ATOM 1335 O THR A 86 7.056 8.844 -37.280 1.00 32.04 O ATOM 1336 CB THR A 86 6.831 11.607 -37.902 1.00 14.21 C ATOM 1337 OG1 THR A 86 6.455 11.025 -39.161 1.00 14.30 O ATOM 1338 CG2 THR A 86 6.969 13.116 -38.049 1.00 41.50 C ATOM 0 H THR A 86 8.713 11.083 -39.423 1.00 32.04 H new ATOM 0 HA THR A 86 8.581 11.630 -36.649 1.00 10.14 H new ATOM 0 HB THR A 86 6.056 11.402 -37.163 1.00 14.21 H new ATOM 0 HG1 THR A 86 6.490 10.048 -39.093 1.00 14.30 H new ATOM 0 HG21 THR A 86 6.025 13.536 -38.395 1.00 41.50 H new ATOM 0 HG22 THR A 86 7.228 13.553 -37.085 1.00 41.50 H new ATOM 0 HG23 THR A 86 7.753 13.341 -38.772 1.00 41.50 H new ATOM 1346 N SER A 87 8.614 9.311 -35.736 1.00 15.01 N ATOM 1347 CA SER A 87 8.465 8.048 -35.041 1.00 2.03 C ATOM 1348 C SER A 87 7.433 8.178 -33.933 1.00 24.32 C ATOM 1349 O SER A 87 7.692 8.784 -32.893 1.00 62.12 O ATOM 1350 CB SER A 87 9.813 7.608 -34.471 1.00 13.05 C ATOM 1351 OG SER A 87 10.769 7.455 -35.506 1.00 1.31 O ATOM 0 H SER A 87 9.322 9.928 -35.338 1.00 15.01 H new ATOM 0 HA SER A 87 8.119 7.291 -35.745 1.00 2.03 H new ATOM 0 HB2 SER A 87 10.166 8.345 -33.749 1.00 13.05 H new ATOM 0 HB3 SER A 87 9.697 6.666 -33.935 1.00 13.05 H new ATOM 0 HG SER A 87 11.651 7.284 -35.114 1.00 1.31 H new ATOM 1357 N THR A 88 6.255 7.628 -34.163 1.00 51.42 N ATOM 1358 CA THR A 88 5.188 7.718 -33.192 1.00 73.31 C ATOM 1359 C THR A 88 5.105 6.435 -32.377 1.00 14.20 C ATOM 1360 O THR A 88 4.709 5.385 -32.883 1.00 62.31 O ATOM 1361 CB THR A 88 3.839 7.982 -33.882 1.00 44.45 C ATOM 1362 OG1 THR A 88 4.008 8.966 -34.909 1.00 20.51 O ATOM 1363 CG2 THR A 88 2.805 8.474 -32.882 1.00 21.04 C ATOM 0 H THR A 88 6.016 7.116 -35.012 1.00 51.42 H new ATOM 0 HA THR A 88 5.408 8.553 -32.526 1.00 73.31 H new ATOM 0 HB THR A 88 3.488 7.046 -34.316 1.00 44.45 H new ATOM 0 HG1 THR A 88 3.148 9.131 -35.348 1.00 20.51 H new ATOM 0 HG21 THR A 88 1.860 8.653 -33.394 1.00 21.04 H new ATOM 0 HG22 THR A 88 2.661 7.721 -32.108 1.00 21.04 H new ATOM 0 HG23 THR A 88 3.152 9.401 -32.426 1.00 21.04 H new ATOM 1371 N LEU A 89 5.491 6.524 -31.117 1.00 5.20 N ATOM 1372 CA LEU A 89 5.435 5.383 -30.222 1.00 64.54 C ATOM 1373 C LEU A 89 4.371 5.621 -29.166 1.00 32.44 C ATOM 1374 O LEU A 89 4.421 6.622 -28.446 1.00 74.43 O ATOM 1375 CB LEU A 89 6.789 5.128 -29.539 1.00 61.15 C ATOM 1376 CG LEU A 89 7.940 4.662 -30.444 1.00 73.25 C ATOM 1377 CD1 LEU A 89 8.507 5.816 -31.259 1.00 54.52 C ATOM 1378 CD2 LEU A 89 9.037 4.013 -29.610 1.00 54.11 C ATOM 0 H LEU A 89 5.848 7.378 -30.689 1.00 5.20 H new ATOM 0 HA LEU A 89 5.188 4.502 -30.815 1.00 64.54 H new ATOM 0 HB2 LEU A 89 7.098 6.047 -29.041 1.00 61.15 H new ATOM 0 HB3 LEU A 89 6.642 4.378 -28.761 1.00 61.15 H new ATOM 0 HG LEU A 89 7.541 3.925 -31.141 1.00 73.25 H new ATOM 0 HD11 LEU A 89 9.319 5.452 -31.888 1.00 54.52 H new ATOM 0 HD12 LEU A 89 7.722 6.238 -31.887 1.00 54.52 H new ATOM 0 HD13 LEU A 89 8.886 6.585 -30.586 1.00 54.52 H new ATOM 0 HD21 LEU A 89 9.846 3.687 -30.263 1.00 54.11 H new ATOM 0 HD22 LEU A 89 9.421 4.735 -28.889 1.00 54.11 H new ATOM 0 HD23 LEU A 89 8.630 3.152 -29.080 1.00 54.11 H new ATOM 1390 N ASN A 90 3.402 4.724 -29.091 1.00 1.34 N ATOM 1391 CA ASN A 90 2.360 4.826 -28.082 1.00 4.22 C ATOM 1392 C ASN A 90 2.806 4.123 -26.810 1.00 11.11 C ATOM 1393 O ASN A 90 3.192 2.952 -26.829 1.00 54.44 O ATOM 1394 CB ASN A 90 1.018 4.263 -28.588 1.00 2.40 C ATOM 1395 CG ASN A 90 1.053 2.779 -28.907 1.00 42.32 C ATOM 1396 OD1 ASN A 90 1.423 2.382 -30.015 1.00 51.51 O ATOM 1397 ND2 ASN A 90 0.638 1.953 -27.961 1.00 74.12 N ATOM 0 H ASN A 90 3.315 3.921 -29.713 1.00 1.34 H new ATOM 0 HA ASN A 90 2.197 5.881 -27.864 1.00 4.22 H new ATOM 0 HB2 ASN A 90 0.252 4.444 -27.834 1.00 2.40 H new ATOM 0 HB3 ASN A 90 0.720 4.810 -29.483 1.00 2.40 H new ATOM 0 HD21 ASN A 90 0.616 0.948 -28.135 1.00 74.12 H new ATOM 0 HD22 ASN A 90 0.340 2.321 -27.057 1.00 74.12 H new ATOM 1404 N LYS A 91 2.816 4.865 -25.719 1.00 52.44 N ATOM 1405 CA LYS A 91 3.231 4.330 -24.438 1.00 72.51 C ATOM 1406 C LYS A 91 2.115 4.466 -23.425 1.00 30.44 C ATOM 1407 O LYS A 91 1.598 5.561 -23.194 1.00 13.21 O ATOM 1408 CB LYS A 91 4.494 5.031 -23.923 1.00 44.20 C ATOM 1409 CG LYS A 91 5.782 4.292 -24.251 1.00 42.44 C ATOM 1410 CD LYS A 91 5.993 4.163 -25.747 1.00 41.43 C ATOM 1411 CE LYS A 91 7.215 3.325 -26.069 1.00 34.21 C ATOM 1412 NZ LYS A 91 7.097 1.930 -25.565 1.00 62.32 N ATOM 0 H LYS A 91 2.539 5.846 -25.696 1.00 52.44 H new ATOM 0 HA LYS A 91 3.462 3.274 -24.578 1.00 72.51 H new ATOM 0 HB2 LYS A 91 4.542 6.033 -24.350 1.00 44.20 H new ATOM 0 HB3 LYS A 91 4.418 5.148 -22.842 1.00 44.20 H new ATOM 0 HG2 LYS A 91 6.627 4.821 -23.809 1.00 42.44 H new ATOM 0 HG3 LYS A 91 5.756 3.300 -23.801 1.00 42.44 H new ATOM 0 HD2 LYS A 91 5.111 3.711 -26.202 1.00 41.43 H new ATOM 0 HD3 LYS A 91 6.105 5.154 -26.186 1.00 41.43 H new ATOM 0 HE2 LYS A 91 7.365 3.307 -27.148 1.00 34.21 H new ATOM 0 HE3 LYS A 91 8.098 3.792 -25.632 1.00 34.21 H new ATOM 0 HZ1 LYS A 91 7.798 1.328 -26.042 1.00 62.32 H new ATOM 0 HZ2 LYS A 91 7.269 1.916 -24.539 1.00 62.32 H new ATOM 0 HZ3 LYS A 91 6.141 1.570 -25.761 1.00 62.32 H new ATOM 1426 N VAL A 92 1.738 3.350 -22.839 1.00 64.21 N ATOM 1427 CA VAL A 92 0.715 3.350 -21.808 1.00 42.22 C ATOM 1428 C VAL A 92 1.323 3.708 -20.451 1.00 5.34 C ATOM 1429 O VAL A 92 2.170 2.992 -19.915 1.00 3.11 O ATOM 1430 CB VAL A 92 -0.044 1.998 -21.738 1.00 72.52 C ATOM 1431 CG1 VAL A 92 0.913 0.820 -21.620 1.00 72.34 C ATOM 1432 CG2 VAL A 92 -1.044 1.999 -20.589 1.00 30.03 C ATOM 0 H VAL A 92 2.122 2.430 -23.056 1.00 64.21 H new ATOM 0 HA VAL A 92 -0.018 4.112 -22.074 1.00 42.22 H new ATOM 0 HB VAL A 92 -0.592 1.882 -22.673 1.00 72.52 H new ATOM 0 HG11 VAL A 92 0.343 -0.108 -21.574 1.00 72.34 H new ATOM 0 HG12 VAL A 92 1.572 0.798 -22.488 1.00 72.34 H new ATOM 0 HG13 VAL A 92 1.510 0.925 -20.714 1.00 72.34 H new ATOM 0 HG21 VAL A 92 -1.565 1.042 -20.559 1.00 30.03 H new ATOM 0 HG22 VAL A 92 -0.517 2.155 -19.648 1.00 30.03 H new ATOM 0 HG23 VAL A 92 -1.767 2.801 -20.737 1.00 30.03 H new ATOM 1442 N ILE A 93 0.903 4.840 -19.919 1.00 54.21 N ATOM 1443 CA ILE A 93 1.417 5.330 -18.655 1.00 64.14 C ATOM 1444 C ILE A 93 0.326 5.277 -17.588 1.00 15.41 C ATOM 1445 O ILE A 93 -0.858 5.448 -17.888 1.00 3.12 O ATOM 1446 CB ILE A 93 1.963 6.770 -18.804 1.00 3.51 C ATOM 1447 CG1 ILE A 93 2.579 7.263 -17.493 1.00 43.43 C ATOM 1448 CG2 ILE A 93 0.863 7.717 -19.266 1.00 4.32 C ATOM 1449 CD1 ILE A 93 3.275 8.599 -17.616 1.00 15.32 C ATOM 0 H ILE A 93 0.200 5.442 -20.348 1.00 54.21 H new ATOM 0 HA ILE A 93 2.241 4.688 -18.345 1.00 64.14 H new ATOM 0 HB ILE A 93 2.747 6.755 -19.561 1.00 3.51 H new ATOM 0 HG12 ILE A 93 1.795 7.339 -16.739 1.00 43.43 H new ATOM 0 HG13 ILE A 93 3.294 6.522 -17.136 1.00 43.43 H new ATOM 0 HG21 ILE A 93 1.268 8.724 -19.365 1.00 4.32 H new ATOM 0 HG22 ILE A 93 0.478 7.385 -20.230 1.00 4.32 H new ATOM 0 HG23 ILE A 93 0.055 7.721 -18.534 1.00 4.32 H new ATOM 0 HD11 ILE A 93 3.687 8.885 -16.648 1.00 15.32 H new ATOM 0 HD12 ILE A 93 4.081 8.523 -18.346 1.00 15.32 H new ATOM 0 HD13 ILE A 93 2.559 9.353 -17.943 1.00 15.32 H new ATOM 1461 N PHE A 94 0.723 5.014 -16.354 1.00 54.50 N ATOM 1462 CA PHE A 94 -0.221 4.896 -15.257 1.00 61.00 C ATOM 1463 C PHE A 94 -0.209 6.159 -14.405 1.00 11.14 C ATOM 1464 O PHE A 94 0.787 6.471 -13.753 1.00 14.21 O ATOM 1465 CB PHE A 94 0.125 3.675 -14.404 1.00 71.24 C ATOM 1466 CG PHE A 94 -0.943 3.303 -13.421 1.00 41.32 C ATOM 1467 CD1 PHE A 94 -2.092 2.658 -13.846 1.00 44.35 C ATOM 1468 CD2 PHE A 94 -0.797 3.591 -12.075 1.00 64.40 C ATOM 1469 CE1 PHE A 94 -3.077 2.309 -12.946 1.00 40.44 C ATOM 1470 CE2 PHE A 94 -1.779 3.245 -11.170 1.00 21.10 C ATOM 1471 CZ PHE A 94 -2.920 2.602 -11.607 1.00 42.22 C ATOM 0 H PHE A 94 1.698 4.878 -16.087 1.00 54.50 H new ATOM 0 HA PHE A 94 -1.223 4.769 -15.667 1.00 61.00 H new ATOM 0 HB2 PHE A 94 0.313 2.826 -15.061 1.00 71.24 H new ATOM 0 HB3 PHE A 94 1.051 3.871 -13.864 1.00 71.24 H new ATOM 0 HD1 PHE A 94 -2.218 2.426 -14.893 1.00 44.35 H new ATOM 0 HD2 PHE A 94 0.095 4.092 -11.730 1.00 64.40 H new ATOM 0 HE1 PHE A 94 -3.970 1.807 -13.289 1.00 40.44 H new ATOM 0 HE2 PHE A 94 -1.656 3.476 -10.122 1.00 21.10 H new ATOM 0 HZ PHE A 94 -3.690 2.328 -10.901 1.00 42.22 H new ATOM 1481 N VAL A 95 -1.314 6.885 -14.419 1.00 33.55 N ATOM 1482 CA VAL A 95 -1.427 8.123 -13.663 1.00 41.12 C ATOM 1483 C VAL A 95 -2.291 7.908 -12.425 1.00 72.54 C ATOM 1484 O VAL A 95 -3.522 7.935 -12.495 1.00 11.22 O ATOM 1485 CB VAL A 95 -2.029 9.262 -14.515 1.00 73.22 C ATOM 1486 CG1 VAL A 95 -2.055 10.567 -13.732 1.00 13.43 C ATOM 1487 CG2 VAL A 95 -1.255 9.432 -15.814 1.00 23.34 C ATOM 0 H VAL A 95 -2.150 6.638 -14.948 1.00 33.55 H new ATOM 0 HA VAL A 95 -0.420 8.415 -13.366 1.00 41.12 H new ATOM 0 HB VAL A 95 -3.056 8.992 -14.762 1.00 73.22 H new ATOM 0 HG11 VAL A 95 -2.483 11.355 -14.352 1.00 13.43 H new ATOM 0 HG12 VAL A 95 -2.662 10.441 -12.835 1.00 13.43 H new ATOM 0 HG13 VAL A 95 -1.039 10.841 -13.447 1.00 13.43 H new ATOM 0 HG21 VAL A 95 -1.697 10.240 -16.398 1.00 23.34 H new ATOM 0 HG22 VAL A 95 -0.216 9.673 -15.590 1.00 23.34 H new ATOM 0 HG23 VAL A 95 -1.297 8.505 -16.387 1.00 23.34 H new ATOM 1497 N GLN A 96 -1.643 7.629 -11.307 1.00 34.43 N ATOM 1498 CA GLN A 96 -2.338 7.451 -10.042 1.00 3.11 C ATOM 1499 C GLN A 96 -2.553 8.790 -9.335 1.00 42.32 C ATOM 1500 O GLN A 96 -1.605 9.414 -8.856 1.00 42.52 O ATOM 1501 CB GLN A 96 -1.584 6.458 -9.149 1.00 65.32 C ATOM 1502 CG GLN A 96 -0.099 6.749 -9.005 1.00 63.20 C ATOM 1503 CD GLN A 96 0.634 5.688 -8.205 1.00 61.31 C ATOM 1504 OE1 GLN A 96 1.610 5.979 -7.519 1.00 43.52 O ATOM 1505 NE2 GLN A 96 0.177 4.448 -8.295 1.00 42.50 N ATOM 0 H GLN A 96 -0.630 7.520 -11.249 1.00 34.43 H new ATOM 0 HA GLN A 96 -3.324 7.034 -10.250 1.00 3.11 H new ATOM 0 HB2 GLN A 96 -2.040 6.459 -8.159 1.00 65.32 H new ATOM 0 HB3 GLN A 96 -1.708 5.455 -9.556 1.00 65.32 H new ATOM 0 HG2 GLN A 96 0.349 6.825 -9.996 1.00 63.20 H new ATOM 0 HG3 GLN A 96 0.032 7.717 -8.521 1.00 63.20 H new ATOM 0 HE21 GLN A 96 -0.637 4.245 -8.875 1.00 42.50 H new ATOM 0 HE22 GLN A 96 0.639 3.696 -7.784 1.00 42.50 H new ATOM 1514 N TYR A 97 -3.799 9.232 -9.288 1.00 74.12 N ATOM 1515 CA TYR A 97 -4.149 10.472 -8.607 1.00 31.12 C ATOM 1516 C TYR A 97 -4.386 10.215 -7.121 1.00 72.21 C ATOM 1517 O TYR A 97 -5.220 9.384 -6.753 1.00 1.23 O ATOM 1518 CB TYR A 97 -5.402 11.090 -9.243 1.00 3.12 C ATOM 1519 CG TYR A 97 -5.892 12.357 -8.569 1.00 14.05 C ATOM 1520 CD1 TYR A 97 -5.385 13.598 -8.930 1.00 42.30 C ATOM 1521 CD2 TYR A 97 -6.870 12.312 -7.579 1.00 52.13 C ATOM 1522 CE1 TYR A 97 -5.834 14.755 -8.324 1.00 11.20 C ATOM 1523 CE2 TYR A 97 -7.323 13.468 -6.969 1.00 65.40 C ATOM 1524 CZ TYR A 97 -6.802 14.686 -7.346 1.00 34.11 C ATOM 1525 OH TYR A 97 -7.250 15.840 -6.740 1.00 13.24 O ATOM 0 H TYR A 97 -4.590 8.749 -9.715 1.00 74.12 H new ATOM 0 HA TYR A 97 -3.319 11.171 -8.711 1.00 31.12 H new ATOM 0 HB2 TYR A 97 -5.192 11.309 -10.290 1.00 3.12 H new ATOM 0 HB3 TYR A 97 -6.204 10.352 -9.226 1.00 3.12 H new ATOM 0 HD1 TYR A 97 -4.627 13.660 -9.697 1.00 42.30 H new ATOM 0 HD2 TYR A 97 -7.282 11.359 -7.282 1.00 52.13 H new ATOM 0 HE1 TYR A 97 -5.427 15.712 -8.616 1.00 11.20 H new ATOM 0 HE2 TYR A 97 -8.081 13.416 -6.201 1.00 65.40 H new ATOM 0 HH TYR A 97 -7.933 15.616 -6.074 1.00 13.24 H new ATOM 1535 N CYS A 98 -3.648 10.929 -6.279 1.00 21.35 N ATOM 1536 CA CYS A 98 -3.782 10.808 -4.833 1.00 63.53 C ATOM 1537 C CYS A 98 -3.091 11.977 -4.135 1.00 0.14 C ATOM 1538 O CYS A 98 -1.862 12.057 -4.114 1.00 64.43 O ATOM 1539 CB CYS A 98 -3.184 9.484 -4.347 1.00 74.21 C ATOM 1540 SG CYS A 98 -3.374 9.193 -2.570 1.00 73.45 S ATOM 0 H CYS A 98 -2.944 11.604 -6.577 1.00 21.35 H new ATOM 0 HA CYS A 98 -4.843 10.826 -4.586 1.00 63.53 H new ATOM 0 HB2 CYS A 98 -3.654 8.664 -4.890 1.00 74.21 H new ATOM 0 HB3 CYS A 98 -2.123 9.464 -4.596 1.00 74.21 H new ATOM 0 HG CYS A 98 -2.962 7.994 -2.280 1.00 73.45 H new ATOM 1546 N PRO A 99 -3.872 12.906 -3.568 1.00 73.21 N ATOM 1547 CA PRO A 99 -3.335 14.075 -2.870 1.00 53.25 C ATOM 1548 C PRO A 99 -2.964 13.780 -1.418 1.00 74.30 C ATOM 1549 O PRO A 99 -3.187 12.676 -0.919 1.00 73.22 O ATOM 1550 CB PRO A 99 -4.502 15.055 -2.929 1.00 62.32 C ATOM 1551 CG PRO A 99 -5.715 14.190 -2.885 1.00 52.42 C ATOM 1552 CD PRO A 99 -5.347 12.898 -3.570 1.00 61.35 C ATOM 0 HA PRO A 99 -2.412 14.438 -3.322 1.00 53.25 H new ATOM 0 HB2 PRO A 99 -4.479 15.751 -2.090 1.00 62.32 H new ATOM 0 HB3 PRO A 99 -4.473 15.653 -3.840 1.00 62.32 H new ATOM 0 HG2 PRO A 99 -6.024 14.009 -1.856 1.00 52.42 H new ATOM 0 HG3 PRO A 99 -6.553 14.671 -3.390 1.00 52.42 H new ATOM 0 HD2 PRO A 99 -5.743 12.035 -3.035 1.00 61.35 H new ATOM 0 HD3 PRO A 99 -5.745 12.855 -4.584 1.00 61.35 H new ATOM 1560 N ASP A 100 -2.413 14.783 -0.742 1.00 74.43 N ATOM 1561 CA ASP A 100 -2.041 14.660 0.667 1.00 61.32 C ATOM 1562 C ASP A 100 -3.281 14.741 1.546 1.00 61.34 C ATOM 1563 O ASP A 100 -3.265 14.355 2.711 1.00 54.41 O ATOM 1564 CB ASP A 100 -1.072 15.777 1.076 1.00 75.02 C ATOM 1565 CG ASP A 100 0.200 15.797 0.256 1.00 21.40 C ATOM 1566 OD1 ASP A 100 0.197 16.401 -0.839 1.00 22.32 O ATOM 1567 OD2 ASP A 100 1.215 15.233 0.711 1.00 34.55 O ATOM 0 H ASP A 100 -2.212 15.697 -1.149 1.00 74.43 H new ATOM 0 HA ASP A 100 -1.553 13.695 0.800 1.00 61.32 H new ATOM 0 HB2 ASP A 100 -1.575 16.739 0.977 1.00 75.02 H new ATOM 0 HB3 ASP A 100 -0.815 15.658 2.129 1.00 75.02 H new ATOM 1572 N ASN A 101 -4.353 15.257 0.961 1.00 61.30 N ATOM 1573 CA ASN A 101 -5.607 15.473 1.673 1.00 15.13 C ATOM 1574 C ASN A 101 -6.428 14.183 1.737 1.00 51.22 C ATOM 1575 O ASN A 101 -7.409 14.092 2.478 1.00 64.54 O ATOM 1576 CB ASN A 101 -6.393 16.585 0.965 1.00 65.05 C ATOM 1577 CG ASN A 101 -7.678 16.970 1.673 1.00 31.24 C ATOM 1578 OD1 ASN A 101 -8.754 16.469 1.353 1.00 63.02 O ATOM 1579 ND2 ASN A 101 -7.576 17.869 2.635 1.00 64.25 N ATOM 0 H ASN A 101 -4.379 15.538 -0.019 1.00 61.30 H new ATOM 0 HA ASN A 101 -5.394 15.774 2.699 1.00 15.13 H new ATOM 0 HB2 ASN A 101 -5.759 17.467 0.878 1.00 65.05 H new ATOM 0 HB3 ASN A 101 -6.630 16.261 -0.048 1.00 65.05 H new ATOM 0 HD21 ASN A 101 -8.408 18.171 3.142 1.00 64.25 H new ATOM 0 HD22 ASN A 101 -6.665 18.262 2.872 1.00 64.25 H new ATOM 1586 N ALA A 102 -5.995 13.182 0.975 1.00 21.41 N ATOM 1587 CA ALA A 102 -6.712 11.914 0.864 1.00 2.00 C ATOM 1588 C ALA A 102 -6.810 11.202 2.213 1.00 55.23 C ATOM 1589 O ALA A 102 -5.929 11.339 3.064 1.00 11.52 O ATOM 1590 CB ALA A 102 -6.028 11.017 -0.160 1.00 62.25 C ATOM 0 H ALA A 102 -5.141 13.226 0.419 1.00 21.41 H new ATOM 0 HA ALA A 102 -7.727 12.130 0.532 1.00 2.00 H new ATOM 0 HB1 ALA A 102 -6.569 10.074 -0.236 1.00 62.25 H new ATOM 0 HB2 ALA A 102 -6.022 11.512 -1.131 1.00 62.25 H new ATOM 0 HB3 ALA A 102 -5.002 10.823 0.154 1.00 62.25 H new ATOM 1596 N PRO A 103 -7.895 10.439 2.426 1.00 64.41 N ATOM 1597 CA PRO A 103 -8.101 9.687 3.665 1.00 4.43 C ATOM 1598 C PRO A 103 -7.062 8.584 3.837 1.00 43.33 C ATOM 1599 O PRO A 103 -6.705 7.907 2.870 1.00 44.14 O ATOM 1600 CB PRO A 103 -9.502 9.079 3.502 1.00 25.32 C ATOM 1601 CG PRO A 103 -10.130 9.823 2.374 1.00 33.44 C ATOM 1602 CD PRO A 103 -9.003 10.247 1.480 1.00 22.54 C ATOM 0 HA PRO A 103 -8.006 10.322 4.546 1.00 4.43 H new ATOM 0 HB2 PRO A 103 -9.444 8.012 3.285 1.00 25.32 H new ATOM 0 HB3 PRO A 103 -10.085 9.187 4.416 1.00 25.32 H new ATOM 0 HG2 PRO A 103 -10.838 9.192 1.837 1.00 33.44 H new ATOM 0 HG3 PRO A 103 -10.686 10.687 2.738 1.00 33.44 H new ATOM 0 HD2 PRO A 103 -8.771 9.488 0.733 1.00 22.54 H new ATOM 0 HD3 PRO A 103 -9.238 11.164 0.940 1.00 22.54 H new ATOM 1610 N VAL A 104 -6.586 8.411 5.067 1.00 30.23 N ATOM 1611 CA VAL A 104 -5.572 7.406 5.381 1.00 75.34 C ATOM 1612 C VAL A 104 -5.983 6.023 4.883 1.00 4.21 C ATOM 1613 O VAL A 104 -5.216 5.358 4.189 1.00 43.43 O ATOM 1614 CB VAL A 104 -5.304 7.337 6.900 1.00 0.21 C ATOM 1615 CG1 VAL A 104 -4.209 6.329 7.210 1.00 11.24 C ATOM 1616 CG2 VAL A 104 -4.935 8.708 7.442 1.00 32.32 C ATOM 0 H VAL A 104 -6.890 8.960 5.871 1.00 30.23 H new ATOM 0 HA VAL A 104 -4.659 7.710 4.869 1.00 75.34 H new ATOM 0 HB VAL A 104 -6.220 7.008 7.391 1.00 0.21 H new ATOM 0 HG11 VAL A 104 -4.037 6.298 8.286 1.00 11.24 H new ATOM 0 HG12 VAL A 104 -4.514 5.342 6.862 1.00 11.24 H new ATOM 0 HG13 VAL A 104 -3.289 6.624 6.704 1.00 11.24 H new ATOM 0 HG21 VAL A 104 -4.750 8.638 8.514 1.00 32.32 H new ATOM 0 HG22 VAL A 104 -4.036 9.067 6.941 1.00 32.32 H new ATOM 0 HG23 VAL A 104 -5.754 9.404 7.260 1.00 32.32 H new ATOM 1626 N ARG A 105 -7.203 5.610 5.217 1.00 10.15 N ATOM 1627 CA ARG A 105 -7.711 4.298 4.809 1.00 43.30 C ATOM 1628 C ARG A 105 -7.722 4.168 3.289 1.00 32.24 C ATOM 1629 O ARG A 105 -7.370 3.127 2.736 1.00 71.11 O ATOM 1630 CB ARG A 105 -9.133 4.066 5.339 1.00 53.52 C ATOM 1631 CG ARG A 105 -9.225 3.680 6.812 1.00 0.45 C ATOM 1632 CD ARG A 105 -8.709 4.773 7.731 1.00 75.44 C ATOM 1633 NE ARG A 105 -9.325 4.708 9.054 1.00 41.44 N ATOM 1634 CZ ARG A 105 -8.724 5.091 10.178 1.00 41.44 C ATOM 1635 NH1 ARG A 105 -7.437 5.415 10.168 1.00 75.21 N ATOM 1636 NH2 ARG A 105 -9.400 5.094 11.319 1.00 34.34 N ATOM 0 H ARG A 105 -7.859 6.162 5.769 1.00 10.15 H new ATOM 0 HA ARG A 105 -7.043 3.548 5.233 1.00 43.30 H new ATOM 0 HB2 ARG A 105 -9.714 4.974 5.182 1.00 53.52 H new ATOM 0 HB3 ARG A 105 -9.601 3.281 4.745 1.00 53.52 H new ATOM 0 HG2 ARG A 105 -10.262 3.458 7.062 1.00 0.45 H new ATOM 0 HG3 ARG A 105 -8.654 2.767 6.982 1.00 0.45 H new ATOM 0 HD2 ARG A 105 -7.627 4.684 7.829 1.00 75.44 H new ATOM 0 HD3 ARG A 105 -8.909 5.747 7.285 1.00 75.44 H new ATOM 0 HE ARG A 105 -10.276 4.346 9.121 1.00 41.44 H new ATOM 0 HH11 ARG A 105 -6.907 5.371 9.298 1.00 75.21 H new ATOM 0 HH12 ARG A 105 -6.978 5.708 11.030 1.00 75.21 H new ATOM 0 HH21 ARG A 105 -10.378 4.803 11.333 1.00 34.34 H new ATOM 0 HH22 ARG A 105 -8.942 5.387 12.182 1.00 34.34 H new ATOM 1650 N ARG A 106 -8.108 5.245 2.623 1.00 72.23 N ATOM 1651 CA ARG A 106 -8.284 5.235 1.179 1.00 33.45 C ATOM 1652 C ARG A 106 -6.936 5.238 0.458 1.00 12.40 C ATOM 1653 O ARG A 106 -6.734 4.484 -0.495 1.00 51.12 O ATOM 1654 CB ARG A 106 -9.139 6.433 0.759 1.00 11.53 C ATOM 1655 CG ARG A 106 -9.393 6.528 -0.736 1.00 74.42 C ATOM 1656 CD ARG A 106 -10.455 7.570 -1.048 1.00 40.33 C ATOM 1657 NE ARG A 106 -11.794 7.127 -0.649 1.00 71.13 N ATOM 1658 CZ ARG A 106 -12.899 7.862 -0.782 1.00 14.03 C ATOM 1659 NH1 ARG A 106 -12.823 9.115 -1.211 1.00 43.32 N ATOM 1660 NH2 ARG A 106 -14.080 7.349 -0.466 1.00 42.43 N ATOM 0 H ARG A 106 -8.307 6.143 3.063 1.00 72.23 H new ATOM 0 HA ARG A 106 -8.799 4.318 0.893 1.00 33.45 H new ATOM 0 HB2 ARG A 106 -10.097 6.379 1.276 1.00 11.53 H new ATOM 0 HB3 ARG A 106 -8.649 7.348 1.091 1.00 11.53 H new ATOM 0 HG2 ARG A 106 -8.466 6.784 -1.249 1.00 74.42 H new ATOM 0 HG3 ARG A 106 -9.710 5.557 -1.116 1.00 74.42 H new ATOM 0 HD2 ARG A 106 -10.213 8.500 -0.533 1.00 40.33 H new ATOM 0 HD3 ARG A 106 -10.448 7.786 -2.116 1.00 40.33 H new ATOM 0 HE ARG A 106 -11.887 6.196 -0.243 1.00 71.13 H new ATOM 0 HH11 ARG A 106 -11.916 9.521 -1.441 1.00 43.32 H new ATOM 0 HH12 ARG A 106 -13.671 9.672 -1.311 1.00 43.32 H new ATOM 0 HH21 ARG A 106 -14.144 6.391 -0.121 1.00 42.43 H new ATOM 0 HH22 ARG A 106 -14.924 7.912 -0.568 1.00 42.43 H new ATOM 1674 N ARG A 107 -6.004 6.060 0.929 1.00 72.43 N ATOM 1675 CA ARG A 107 -4.690 6.142 0.301 1.00 1.13 C ATOM 1676 C ARG A 107 -3.856 4.908 0.647 1.00 3.33 C ATOM 1677 O ARG A 107 -2.920 4.556 -0.068 1.00 31.12 O ATOM 1678 CB ARG A 107 -3.964 7.441 0.704 1.00 13.34 C ATOM 1679 CG ARG A 107 -3.341 7.432 2.097 1.00 12.31 C ATOM 1680 CD ARG A 107 -1.911 6.904 2.065 1.00 54.55 C ATOM 1681 NE ARG A 107 -1.315 6.829 3.396 1.00 32.11 N ATOM 1682 CZ ARG A 107 -0.278 6.048 3.701 1.00 2.13 C ATOM 1683 NH1 ARG A 107 0.284 5.293 2.763 1.00 23.02 N ATOM 1684 NH2 ARG A 107 0.208 6.031 4.938 1.00 71.22 N ATOM 0 H ARG A 107 -6.131 6.673 1.734 1.00 72.43 H new ATOM 0 HA ARG A 107 -4.826 6.166 -0.780 1.00 1.13 H new ATOM 0 HB2 ARG A 107 -3.180 7.641 -0.026 1.00 13.34 H new ATOM 0 HB3 ARG A 107 -4.672 8.267 0.646 1.00 13.34 H new ATOM 0 HG2 ARG A 107 -3.348 8.442 2.507 1.00 12.31 H new ATOM 0 HG3 ARG A 107 -3.944 6.814 2.762 1.00 12.31 H new ATOM 0 HD2 ARG A 107 -1.902 5.914 1.610 1.00 54.55 H new ATOM 0 HD3 ARG A 107 -1.302 7.551 1.433 1.00 54.55 H new ATOM 0 HE ARG A 107 -1.715 7.407 4.135 1.00 32.11 H new ATOM 0 HH11 ARG A 107 -0.078 5.311 1.809 1.00 23.02 H new ATOM 0 HH12 ARG A 107 1.077 4.696 2.997 1.00 23.02 H new ATOM 0 HH21 ARG A 107 -0.212 6.617 5.659 1.00 71.22 H new ATOM 0 HH22 ARG A 107 1.001 5.432 5.166 1.00 71.22 H new ATOM 1698 N MET A 108 -4.204 4.250 1.746 1.00 53.34 N ATOM 1699 CA MET A 108 -3.525 3.026 2.144 1.00 60.43 C ATOM 1700 C MET A 108 -3.846 1.915 1.149 1.00 13.01 C ATOM 1701 O MET A 108 -2.964 1.157 0.740 1.00 63.14 O ATOM 1702 CB MET A 108 -3.946 2.614 3.555 1.00 61.22 C ATOM 1703 CG MET A 108 -3.138 1.457 4.117 1.00 40.51 C ATOM 1704 SD MET A 108 -1.418 1.903 4.438 1.00 3.45 S ATOM 1705 CE MET A 108 -1.627 3.138 5.719 1.00 63.14 C ATOM 0 H MET A 108 -4.951 4.544 2.375 1.00 53.34 H new ATOM 0 HA MET A 108 -2.449 3.203 2.147 1.00 60.43 H new ATOM 0 HB2 MET A 108 -3.847 3.472 4.220 1.00 61.22 H new ATOM 0 HB3 MET A 108 -5.001 2.339 3.545 1.00 61.22 H new ATOM 0 HG2 MET A 108 -3.599 1.112 5.043 1.00 40.51 H new ATOM 0 HG3 MET A 108 -3.169 0.623 3.416 1.00 40.51 H new ATOM 0 HE1 MET A 108 -0.709 3.216 6.302 1.00 63.14 H new ATOM 0 HE2 MET A 108 -1.850 4.102 5.262 1.00 63.14 H new ATOM 0 HE3 MET A 108 -2.449 2.848 6.373 1.00 63.14 H new ATOM 1715 N LEU A 109 -5.113 1.843 0.747 1.00 71.33 N ATOM 1716 CA LEU A 109 -5.544 0.880 -0.264 1.00 33.23 C ATOM 1717 C LEU A 109 -4.904 1.207 -1.608 1.00 31.01 C ATOM 1718 O LEU A 109 -4.463 0.314 -2.334 1.00 53.15 O ATOM 1719 CB LEU A 109 -7.069 0.881 -0.398 1.00 33.34 C ATOM 1720 CG LEU A 109 -7.835 0.462 0.859 1.00 14.44 C ATOM 1721 CD1 LEU A 109 -9.333 0.554 0.625 1.00 42.04 C ATOM 1722 CD2 LEU A 109 -7.450 -0.948 1.282 1.00 30.23 C ATOM 0 H LEU A 109 -5.859 2.439 1.105 1.00 71.33 H new ATOM 0 HA LEU A 109 -5.224 -0.113 0.051 1.00 33.23 H new ATOM 0 HB2 LEU A 109 -7.392 1.882 -0.684 1.00 33.34 H new ATOM 0 HB3 LEU A 109 -7.346 0.212 -1.213 1.00 33.34 H new ATOM 0 HG LEU A 109 -7.566 1.146 1.664 1.00 14.44 H new ATOM 0 HD11 LEU A 109 -9.862 0.252 1.529 1.00 42.04 H new ATOM 0 HD12 LEU A 109 -9.600 1.581 0.374 1.00 42.04 H new ATOM 0 HD13 LEU A 109 -9.614 -0.105 -0.197 1.00 42.04 H new ATOM 0 HD21 LEU A 109 -8.007 -1.224 2.177 1.00 30.23 H new ATOM 0 HD22 LEU A 109 -7.685 -1.646 0.479 1.00 30.23 H new ATOM 0 HD23 LEU A 109 -6.381 -0.985 1.494 1.00 30.23 H new ATOM 1734 N TYR A 110 -4.852 2.501 -1.920 1.00 61.34 N ATOM 1735 CA TYR A 110 -4.192 2.988 -3.127 1.00 72.41 C ATOM 1736 C TYR A 110 -2.751 2.486 -3.194 1.00 32.23 C ATOM 1737 O TYR A 110 -2.300 2.006 -4.233 1.00 1.13 O ATOM 1738 CB TYR A 110 -4.254 4.528 -3.166 1.00 65.04 C ATOM 1739 CG TYR A 110 -2.985 5.213 -3.648 1.00 0.43 C ATOM 1740 CD1 TYR A 110 -2.686 5.323 -5.002 1.00 72.53 C ATOM 1741 CD2 TYR A 110 -2.086 5.753 -2.735 1.00 12.32 C ATOM 1742 CE1 TYR A 110 -1.527 5.950 -5.426 1.00 52.34 C ATOM 1743 CE2 TYR A 110 -0.929 6.380 -3.151 1.00 74.33 C ATOM 1744 CZ TYR A 110 -0.654 6.476 -4.495 1.00 43.43 C ATOM 1745 OH TYR A 110 0.502 7.099 -4.909 1.00 2.53 O ATOM 0 H TYR A 110 -5.264 3.237 -1.346 1.00 61.34 H new ATOM 0 HA TYR A 110 -4.713 2.599 -4.002 1.00 72.41 H new ATOM 0 HB2 TYR A 110 -5.078 4.827 -3.814 1.00 65.04 H new ATOM 0 HB3 TYR A 110 -4.487 4.892 -2.165 1.00 65.04 H new ATOM 0 HD1 TYR A 110 -3.368 4.913 -5.733 1.00 72.53 H new ATOM 0 HD2 TYR A 110 -2.297 5.680 -1.678 1.00 12.32 H new ATOM 0 HE1 TYR A 110 -1.307 6.027 -6.480 1.00 52.34 H new ATOM 0 HE2 TYR A 110 -0.244 6.793 -2.425 1.00 74.33 H new ATOM 0 HH TYR A 110 0.814 6.689 -5.743 1.00 2.53 H new ATOM 1755 N ALA A 111 -2.045 2.573 -2.073 1.00 74.12 N ATOM 1756 CA ALA A 111 -0.665 2.120 -2.004 1.00 52.10 C ATOM 1757 C ALA A 111 -0.574 0.613 -2.222 1.00 73.02 C ATOM 1758 O ALA A 111 0.267 0.137 -2.979 1.00 42.03 O ATOM 1759 CB ALA A 111 -0.053 2.504 -0.665 1.00 63.30 C ATOM 0 H ALA A 111 -2.408 2.954 -1.199 1.00 74.12 H new ATOM 0 HA ALA A 111 -0.103 2.609 -2.800 1.00 52.10 H new ATOM 0 HB1 ALA A 111 0.980 2.160 -0.625 1.00 63.30 H new ATOM 0 HB2 ALA A 111 -0.079 3.588 -0.550 1.00 63.30 H new ATOM 0 HB3 ALA A 111 -0.621 2.040 0.141 1.00 63.30 H new ATOM 1765 N SER A 112 -1.447 -0.131 -1.557 1.00 71.52 N ATOM 1766 CA SER A 112 -1.475 -1.584 -1.670 1.00 61.33 C ATOM 1767 C SER A 112 -1.759 -2.047 -3.099 1.00 63.43 C ATOM 1768 O SER A 112 -1.194 -3.043 -3.559 1.00 51.21 O ATOM 1769 CB SER A 112 -2.538 -2.148 -0.735 1.00 3.31 C ATOM 1770 OG SER A 112 -2.238 -1.861 0.617 1.00 4.14 O ATOM 0 H SER A 112 -2.152 0.252 -0.927 1.00 71.52 H new ATOM 0 HA SER A 112 -0.488 -1.954 -1.392 1.00 61.33 H new ATOM 0 HB2 SER A 112 -3.511 -1.728 -0.991 1.00 3.31 H new ATOM 0 HB3 SER A 112 -2.611 -3.227 -0.872 1.00 3.31 H new ATOM 0 HG SER A 112 -2.349 -2.672 1.156 1.00 4.14 H new ATOM 1776 N SER A 113 -2.636 -1.335 -3.796 1.00 12.31 N ATOM 1777 CA SER A 113 -3.038 -1.736 -5.137 1.00 14.31 C ATOM 1778 C SER A 113 -1.906 -1.545 -6.146 1.00 34.40 C ATOM 1779 O SER A 113 -1.924 -2.145 -7.222 1.00 54.14 O ATOM 1780 CB SER A 113 -4.288 -0.967 -5.577 1.00 23.44 C ATOM 1781 OG SER A 113 -4.076 0.436 -5.572 1.00 70.44 O ATOM 0 H SER A 113 -3.080 -0.482 -3.457 1.00 12.31 H new ATOM 0 HA SER A 113 -3.275 -2.800 -5.106 1.00 14.31 H new ATOM 0 HB2 SER A 113 -4.577 -1.287 -6.578 1.00 23.44 H new ATOM 0 HB3 SER A 113 -5.117 -1.211 -4.913 1.00 23.44 H new ATOM 0 HG SER A 113 -3.273 0.644 -5.050 1.00 70.44 H new ATOM 1787 N VAL A 114 -0.912 -0.737 -5.784 1.00 3.12 N ATOM 1788 CA VAL A 114 0.199 -0.440 -6.683 1.00 13.41 C ATOM 1789 C VAL A 114 0.929 -1.713 -7.094 1.00 23.02 C ATOM 1790 O VAL A 114 1.075 -1.997 -8.282 1.00 32.03 O ATOM 1791 CB VAL A 114 1.205 0.549 -6.050 1.00 14.51 C ATOM 1792 CG1 VAL A 114 2.401 0.771 -6.966 1.00 24.12 C ATOM 1793 CG2 VAL A 114 0.524 1.872 -5.739 1.00 23.01 C ATOM 0 H VAL A 114 -0.854 -0.277 -4.875 1.00 3.12 H new ATOM 0 HA VAL A 114 -0.233 0.028 -7.568 1.00 13.41 H new ATOM 0 HB VAL A 114 1.567 0.114 -5.118 1.00 14.51 H new ATOM 0 HG11 VAL A 114 3.093 1.470 -6.497 1.00 24.12 H new ATOM 0 HG12 VAL A 114 2.907 -0.179 -7.140 1.00 24.12 H new ATOM 0 HG13 VAL A 114 2.060 1.180 -7.917 1.00 24.12 H new ATOM 0 HG21 VAL A 114 1.246 2.557 -5.294 1.00 23.01 H new ATOM 0 HG22 VAL A 114 0.133 2.305 -6.660 1.00 23.01 H new ATOM 0 HG23 VAL A 114 -0.295 1.704 -5.040 1.00 23.01 H new ATOM 1803 N ARG A 115 1.358 -2.496 -6.113 1.00 23.44 N ATOM 1804 CA ARG A 115 2.097 -3.720 -6.397 1.00 33.04 C ATOM 1805 C ARG A 115 1.180 -4.759 -7.036 1.00 53.31 C ATOM 1806 O ARG A 115 1.641 -5.686 -7.696 1.00 11.22 O ATOM 1807 CB ARG A 115 2.741 -4.281 -5.114 1.00 1.31 C ATOM 1808 CG ARG A 115 1.773 -4.990 -4.167 1.00 53.15 C ATOM 1809 CD ARG A 115 1.657 -6.474 -4.495 1.00 13.51 C ATOM 1810 NE ARG A 115 0.626 -7.143 -3.703 1.00 21.33 N ATOM 1811 CZ ARG A 115 0.242 -8.403 -3.903 1.00 22.04 C ATOM 1812 NH1 ARG A 115 0.785 -9.119 -4.876 1.00 75.52 N ATOM 1813 NH2 ARG A 115 -0.690 -8.950 -3.137 1.00 12.44 N ATOM 0 H ARG A 115 1.209 -2.308 -5.122 1.00 23.44 H new ATOM 0 HA ARG A 115 2.895 -3.483 -7.101 1.00 33.04 H new ATOM 0 HB2 ARG A 115 3.529 -4.980 -5.396 1.00 1.31 H new ATOM 0 HB3 ARG A 115 3.219 -3.462 -4.576 1.00 1.31 H new ATOM 0 HG2 ARG A 115 2.114 -4.869 -3.139 1.00 53.15 H new ATOM 0 HG3 ARG A 115 0.790 -4.524 -4.234 1.00 53.15 H new ATOM 0 HD2 ARG A 115 1.430 -6.592 -5.555 1.00 13.51 H new ATOM 0 HD3 ARG A 115 2.618 -6.958 -4.319 1.00 13.51 H new ATOM 0 HE ARG A 115 0.175 -6.615 -2.955 1.00 21.33 H new ATOM 0 HH11 ARG A 115 1.500 -8.706 -5.475 1.00 75.52 H new ATOM 0 HH12 ARG A 115 0.488 -10.083 -5.026 1.00 75.52 H new ATOM 0 HH21 ARG A 115 -1.119 -8.406 -2.388 1.00 12.44 H new ATOM 0 HH22 ARG A 115 -0.979 -9.915 -3.296 1.00 12.44 H new ATOM 1827 N ALA A 116 -0.121 -4.597 -6.831 1.00 41.41 N ATOM 1828 CA ALA A 116 -1.088 -5.590 -7.269 1.00 64.43 C ATOM 1829 C ALA A 116 -1.445 -5.429 -8.742 1.00 61.44 C ATOM 1830 O ALA A 116 -1.233 -6.340 -9.539 1.00 43.23 O ATOM 1831 CB ALA A 116 -2.341 -5.515 -6.409 1.00 74.12 C ATOM 0 H ALA A 116 -0.529 -3.787 -6.364 1.00 41.41 H new ATOM 0 HA ALA A 116 -0.628 -6.571 -7.152 1.00 64.43 H new ATOM 0 HB1 ALA A 116 -3.059 -6.263 -6.746 1.00 74.12 H new ATOM 0 HB2 ALA A 116 -2.080 -5.705 -5.368 1.00 74.12 H new ATOM 0 HB3 ALA A 116 -2.783 -4.523 -6.496 1.00 74.12 H new ATOM 1837 N LEU A 117 -1.960 -4.264 -9.113 1.00 75.12 N ATOM 1838 CA LEU A 117 -2.481 -4.078 -10.462 1.00 65.45 C ATOM 1839 C LEU A 117 -1.384 -3.708 -11.454 1.00 33.23 C ATOM 1840 O LEU A 117 -1.419 -4.132 -12.605 1.00 23.22 O ATOM 1841 CB LEU A 117 -3.619 -3.043 -10.475 1.00 44.33 C ATOM 1842 CG LEU A 117 -3.283 -1.642 -9.947 1.00 20.23 C ATOM 1843 CD1 LEU A 117 -2.684 -0.773 -11.042 1.00 51.53 C ATOM 1844 CD2 LEU A 117 -4.524 -0.985 -9.369 1.00 44.33 C ATOM 0 H LEU A 117 -2.028 -3.444 -8.510 1.00 75.12 H new ATOM 0 HA LEU A 117 -2.890 -5.035 -10.785 1.00 65.45 H new ATOM 0 HB2 LEU A 117 -3.977 -2.944 -11.500 1.00 44.33 H new ATOM 0 HB3 LEU A 117 -4.446 -3.439 -9.886 1.00 44.33 H new ATOM 0 HG LEU A 117 -2.540 -1.747 -9.156 1.00 20.23 H new ATOM 0 HD11 LEU A 117 -2.456 0.214 -10.639 1.00 51.53 H new ATOM 0 HD12 LEU A 117 -1.769 -1.234 -11.413 1.00 51.53 H new ATOM 0 HD13 LEU A 117 -3.398 -0.675 -11.860 1.00 51.53 H new ATOM 0 HD21 LEU A 117 -4.271 0.008 -8.998 1.00 44.33 H new ATOM 0 HD22 LEU A 117 -5.285 -0.900 -10.145 1.00 44.33 H new ATOM 0 HD23 LEU A 117 -4.908 -1.591 -8.549 1.00 44.33 H new ATOM 1856 N LYS A 118 -0.400 -2.945 -11.007 1.00 71.13 N ATOM 1857 CA LYS A 118 0.643 -2.469 -11.899 1.00 44.22 C ATOM 1858 C LYS A 118 1.527 -3.625 -12.367 1.00 2.25 C ATOM 1859 O LYS A 118 1.903 -3.700 -13.540 1.00 60.00 O ATOM 1860 CB LYS A 118 1.458 -1.367 -11.204 1.00 54.21 C ATOM 1861 CG LYS A 118 2.689 -0.922 -11.966 1.00 72.43 C ATOM 1862 CD LYS A 118 3.914 -1.706 -11.535 1.00 60.23 C ATOM 1863 CE LYS A 118 5.078 -1.457 -12.467 1.00 54.44 C ATOM 1864 NZ LYS A 118 6.305 -2.164 -12.014 1.00 35.43 N ATOM 0 H LYS A 118 -0.302 -2.644 -10.037 1.00 71.13 H new ATOM 0 HA LYS A 118 0.185 -2.039 -12.790 1.00 44.22 H new ATOM 0 HB2 LYS A 118 0.814 -0.503 -11.043 1.00 54.21 H new ATOM 0 HB3 LYS A 118 1.764 -1.724 -10.221 1.00 54.21 H new ATOM 0 HG2 LYS A 118 2.526 -1.056 -13.035 1.00 72.43 H new ATOM 0 HG3 LYS A 118 2.858 0.142 -11.800 1.00 72.43 H new ATOM 0 HD2 LYS A 118 4.191 -1.424 -10.519 1.00 60.23 H new ATOM 0 HD3 LYS A 118 3.680 -2.770 -11.517 1.00 60.23 H new ATOM 0 HE2 LYS A 118 4.817 -1.788 -13.472 1.00 54.44 H new ATOM 0 HE3 LYS A 118 5.275 -0.387 -12.525 1.00 54.44 H new ATOM 0 HZ1 LYS A 118 7.018 -2.141 -12.771 1.00 35.43 H new ATOM 0 HZ2 LYS A 118 6.684 -1.694 -11.167 1.00 35.43 H new ATOM 0 HZ3 LYS A 118 6.073 -3.152 -11.787 1.00 35.43 H new ATOM 1878 N ALA A 119 1.834 -4.538 -11.458 1.00 25.44 N ATOM 1879 CA ALA A 119 2.676 -5.678 -11.787 1.00 31.33 C ATOM 1880 C ALA A 119 1.894 -6.737 -12.555 1.00 34.42 C ATOM 1881 O ALA A 119 2.400 -7.322 -13.514 1.00 64.24 O ATOM 1882 CB ALA A 119 3.277 -6.274 -10.524 1.00 0.35 C ATOM 0 H ALA A 119 1.514 -4.512 -10.490 1.00 25.44 H new ATOM 0 HA ALA A 119 3.484 -5.326 -12.428 1.00 31.33 H new ATOM 0 HB1 ALA A 119 3.904 -7.126 -10.787 1.00 0.35 H new ATOM 0 HB2 ALA A 119 3.881 -5.521 -10.018 1.00 0.35 H new ATOM 0 HB3 ALA A 119 2.477 -6.603 -9.861 1.00 0.35 H new ATOM 1888 N SER A 120 0.650 -6.959 -12.146 1.00 50.22 N ATOM 1889 CA SER A 120 -0.176 -8.007 -12.731 1.00 44.24 C ATOM 1890 C SER A 120 -0.584 -7.664 -14.163 1.00 0.23 C ATOM 1891 O SER A 120 -0.688 -8.549 -15.016 1.00 3.15 O ATOM 1892 CB SER A 120 -1.421 -8.237 -11.867 1.00 52.34 C ATOM 1893 OG SER A 120 -2.199 -9.322 -12.343 1.00 43.52 O ATOM 0 H SER A 120 0.191 -6.425 -11.409 1.00 50.22 H new ATOM 0 HA SER A 120 0.415 -8.922 -12.763 1.00 44.24 H new ATOM 0 HB2 SER A 120 -1.119 -8.431 -10.838 1.00 52.34 H new ATOM 0 HB3 SER A 120 -2.028 -7.332 -11.856 1.00 52.34 H new ATOM 0 HG SER A 120 -2.983 -9.440 -11.767 1.00 43.52 H new ATOM 1899 N LEU A 121 -0.782 -6.379 -14.443 1.00 74.34 N ATOM 1900 CA LEU A 121 -1.299 -5.968 -15.744 1.00 4.43 C ATOM 1901 C LEU A 121 -0.171 -5.748 -16.744 1.00 4.32 C ATOM 1902 O LEU A 121 -0.420 -5.451 -17.913 1.00 45.30 O ATOM 1903 CB LEU A 121 -2.162 -4.708 -15.623 1.00 31.54 C ATOM 1904 CG LEU A 121 -3.647 -4.949 -15.315 1.00 62.24 C ATOM 1905 CD1 LEU A 121 -3.832 -5.697 -14.002 1.00 74.24 C ATOM 1906 CD2 LEU A 121 -4.399 -3.629 -15.280 1.00 2.30 C ATOM 0 H LEU A 121 -0.595 -5.613 -13.796 1.00 74.34 H new ATOM 0 HA LEU A 121 -1.927 -6.778 -16.115 1.00 4.43 H new ATOM 0 HB2 LEU A 121 -1.744 -4.077 -14.839 1.00 31.54 H new ATOM 0 HB3 LEU A 121 -2.089 -4.148 -16.555 1.00 31.54 H new ATOM 0 HG LEU A 121 -4.055 -5.571 -16.112 1.00 62.24 H new ATOM 0 HD11 LEU A 121 -4.895 -5.850 -13.817 1.00 74.24 H new ATOM 0 HD12 LEU A 121 -3.331 -6.664 -14.060 1.00 74.24 H new ATOM 0 HD13 LEU A 121 -3.402 -5.114 -13.187 1.00 74.24 H new ATOM 0 HD21 LEU A 121 -5.450 -3.815 -15.061 1.00 2.30 H new ATOM 0 HD22 LEU A 121 -3.975 -2.989 -14.507 1.00 2.30 H new ATOM 0 HD23 LEU A 121 -4.312 -3.135 -16.248 1.00 2.30 H new ATOM 1918 N GLY A 122 1.062 -5.901 -16.280 1.00 31.43 N ATOM 1919 CA GLY A 122 2.211 -5.810 -17.162 1.00 61.23 C ATOM 1920 C GLY A 122 2.651 -4.385 -17.430 1.00 25.33 C ATOM 1921 O GLY A 122 2.846 -3.997 -18.581 1.00 24.22 O ATOM 0 H GLY A 122 1.289 -6.088 -15.303 1.00 31.43 H new ATOM 0 HA2 GLY A 122 3.042 -6.363 -16.723 1.00 61.23 H new ATOM 0 HA3 GLY A 122 1.972 -6.293 -18.109 1.00 61.23 H new ATOM 1925 N LEU A 123 2.811 -3.601 -16.371 1.00 54.00 N ATOM 1926 CA LEU A 123 3.309 -2.235 -16.508 1.00 64.12 C ATOM 1927 C LEU A 123 4.740 -2.137 -15.991 1.00 51.01 C ATOM 1928 O LEU A 123 5.223 -1.052 -15.675 1.00 45.31 O ATOM 1929 CB LEU A 123 2.418 -1.231 -15.760 1.00 62.23 C ATOM 1930 CG LEU A 123 1.042 -0.973 -16.379 1.00 60.25 C ATOM 1931 CD1 LEU A 123 0.075 -2.095 -16.048 1.00 73.45 C ATOM 1932 CD2 LEU A 123 0.493 0.363 -15.909 1.00 33.22 C ATOM 0 H LEU A 123 2.605 -3.884 -15.413 1.00 54.00 H new ATOM 0 HA LEU A 123 3.289 -1.984 -17.568 1.00 64.12 H new ATOM 0 HB2 LEU A 123 2.276 -1.589 -14.740 1.00 62.23 H new ATOM 0 HB3 LEU A 123 2.949 -0.282 -15.693 1.00 62.23 H new ATOM 0 HG LEU A 123 1.158 -0.940 -17.462 1.00 60.25 H new ATOM 0 HD11 LEU A 123 -0.894 -1.885 -16.500 1.00 73.45 H new ATOM 0 HD12 LEU A 123 0.462 -3.036 -16.439 1.00 73.45 H new ATOM 0 HD13 LEU A 123 -0.038 -2.171 -14.967 1.00 73.45 H new ATOM 0 HD21 LEU A 123 -0.486 0.532 -16.358 1.00 33.22 H new ATOM 0 HD22 LEU A 123 0.398 0.356 -14.823 1.00 33.22 H new ATOM 0 HD23 LEU A 123 1.172 1.161 -16.208 1.00 33.22 H new ATOM 1944 N GLU A 124 5.419 -3.278 -15.931 1.00 72.51 N ATOM 1945 CA GLU A 124 6.781 -3.345 -15.404 1.00 72.30 C ATOM 1946 C GLU A 124 7.742 -2.458 -16.193 1.00 25.54 C ATOM 1947 O GLU A 124 8.601 -1.796 -15.616 1.00 42.12 O ATOM 1948 CB GLU A 124 7.288 -4.790 -15.412 1.00 50.41 C ATOM 1949 CG GLU A 124 6.511 -5.711 -14.489 1.00 70.42 C ATOM 1950 CD GLU A 124 6.501 -5.212 -13.060 1.00 13.14 C ATOM 1951 OE1 GLU A 124 7.511 -5.391 -12.352 1.00 4.24 O ATOM 1952 OE2 GLU A 124 5.493 -4.612 -12.645 1.00 20.13 O ATOM 0 H GLU A 124 5.047 -4.175 -16.243 1.00 72.51 H new ATOM 0 HA GLU A 124 6.748 -2.977 -14.379 1.00 72.30 H new ATOM 0 HB2 GLU A 124 7.235 -5.179 -16.429 1.00 50.41 H new ATOM 0 HB3 GLU A 124 8.338 -4.799 -15.121 1.00 50.41 H new ATOM 0 HG2 GLU A 124 5.486 -5.802 -14.848 1.00 70.42 H new ATOM 0 HG3 GLU A 124 6.949 -6.709 -14.521 1.00 70.42 H new ATOM 1959 N SER A 125 7.590 -2.442 -17.508 1.00 2.23 N ATOM 1960 CA SER A 125 8.476 -1.668 -18.369 1.00 10.11 C ATOM 1961 C SER A 125 7.797 -0.380 -18.836 1.00 53.31 C ATOM 1962 O SER A 125 8.215 0.237 -19.815 1.00 14.11 O ATOM 1963 CB SER A 125 8.891 -2.517 -19.570 1.00 62.23 C ATOM 1964 OG SER A 125 9.436 -3.757 -19.145 1.00 51.31 O ATOM 0 H SER A 125 6.862 -2.956 -18.004 1.00 2.23 H new ATOM 0 HA SER A 125 9.363 -1.390 -17.800 1.00 10.11 H new ATOM 0 HB2 SER A 125 8.028 -2.695 -20.212 1.00 62.23 H new ATOM 0 HB3 SER A 125 9.626 -1.977 -20.167 1.00 62.23 H new ATOM 0 HG SER A 125 9.694 -4.287 -19.928 1.00 51.31 H new ATOM 1970 N LEU A 126 6.754 0.022 -18.125 1.00 2.44 N ATOM 1971 CA LEU A 126 6.010 1.222 -18.478 1.00 21.21 C ATOM 1972 C LEU A 126 6.281 2.333 -17.473 1.00 11.30 C ATOM 1973 O LEU A 126 7.194 2.229 -16.651 1.00 53.50 O ATOM 1974 CB LEU A 126 4.507 0.934 -18.564 1.00 51.34 C ATOM 1975 CG LEU A 126 4.044 0.182 -19.823 1.00 30.11 C ATOM 1976 CD1 LEU A 126 4.566 0.867 -21.081 1.00 63.04 C ATOM 1977 CD2 LEU A 126 4.476 -1.277 -19.789 1.00 55.23 C ATOM 0 H LEU A 126 6.404 -0.465 -17.300 1.00 2.44 H new ATOM 0 HA LEU A 126 6.348 1.550 -19.461 1.00 21.21 H new ATOM 0 HB2 LEU A 126 4.216 0.353 -17.689 1.00 51.34 H new ATOM 0 HB3 LEU A 126 3.970 1.881 -18.511 1.00 51.34 H new ATOM 0 HG LEU A 126 2.954 0.206 -19.842 1.00 30.11 H new ATOM 0 HD11 LEU A 126 4.227 0.319 -21.961 1.00 63.04 H new ATOM 0 HD12 LEU A 126 4.189 1.889 -21.122 1.00 63.04 H new ATOM 0 HD13 LEU A 126 5.656 0.883 -21.061 1.00 63.04 H new ATOM 0 HD21 LEU A 126 4.133 -1.779 -20.693 1.00 55.23 H new ATOM 0 HD22 LEU A 126 5.563 -1.333 -19.733 1.00 55.23 H new ATOM 0 HD23 LEU A 126 4.042 -1.765 -18.916 1.00 55.23 H new ATOM 1989 N PHE A 127 5.490 3.392 -17.535 1.00 25.41 N ATOM 1990 CA PHE A 127 5.725 4.561 -16.705 1.00 1.31 C ATOM 1991 C PHE A 127 4.582 4.758 -15.720 1.00 22.21 C ATOM 1992 O PHE A 127 3.436 4.408 -16.009 1.00 2.41 O ATOM 1993 CB PHE A 127 5.878 5.806 -17.581 1.00 54.42 C ATOM 1994 CG PHE A 127 6.794 5.600 -18.751 1.00 40.44 C ATOM 1995 CD1 PHE A 127 8.161 5.486 -18.567 1.00 72.14 C ATOM 1996 CD2 PHE A 127 6.283 5.506 -20.036 1.00 11.34 C ATOM 1997 CE1 PHE A 127 9.003 5.284 -19.643 1.00 2.15 C ATOM 1998 CE2 PHE A 127 7.120 5.304 -21.114 1.00 13.20 C ATOM 1999 CZ PHE A 127 8.480 5.193 -20.918 1.00 51.34 C ATOM 0 H PHE A 127 4.680 3.466 -18.151 1.00 25.41 H new ATOM 0 HA PHE A 127 6.646 4.404 -16.143 1.00 1.31 H new ATOM 0 HB2 PHE A 127 4.896 6.108 -17.946 1.00 54.42 H new ATOM 0 HB3 PHE A 127 6.257 6.626 -16.971 1.00 54.42 H new ATOM 0 HD1 PHE A 127 8.574 5.556 -17.571 1.00 72.14 H new ATOM 0 HD2 PHE A 127 5.218 5.592 -20.195 1.00 11.34 H new ATOM 0 HE1 PHE A 127 10.068 5.197 -19.488 1.00 2.15 H new ATOM 0 HE2 PHE A 127 6.710 5.233 -22.111 1.00 13.20 H new ATOM 0 HZ PHE A 127 9.136 5.035 -21.761 1.00 51.34 H new ATOM 2009 N GLN A 128 4.899 5.317 -14.564 1.00 21.22 N ATOM 2010 CA GLN A 128 3.899 5.603 -13.549 1.00 30.41 C ATOM 2011 C GLN A 128 4.101 7.011 -13.003 1.00 51.41 C ATOM 2012 O GLN A 128 5.219 7.390 -12.651 1.00 1.11 O ATOM 2013 CB GLN A 128 3.982 4.585 -12.411 1.00 74.51 C ATOM 2014 CG GLN A 128 2.907 4.770 -11.353 1.00 24.11 C ATOM 2015 CD GLN A 128 3.078 3.836 -10.175 1.00 3.04 C ATOM 2016 OE1 GLN A 128 2.557 2.721 -10.170 1.00 23.44 O ATOM 2017 NE2 GLN A 128 3.802 4.289 -9.161 1.00 15.33 N ATOM 0 H GLN A 128 5.849 5.583 -14.304 1.00 21.22 H new ATOM 0 HA GLN A 128 2.911 5.533 -14.005 1.00 30.41 H new ATOM 0 HB2 GLN A 128 3.903 3.580 -12.826 1.00 74.51 H new ATOM 0 HB3 GLN A 128 4.962 4.659 -11.939 1.00 74.51 H new ATOM 0 HG2 GLN A 128 2.925 5.801 -10.999 1.00 24.11 H new ATOM 0 HG3 GLN A 128 1.928 4.605 -11.803 1.00 24.11 H new ATOM 0 HE21 GLN A 128 4.216 5.220 -9.206 1.00 15.33 H new ATOM 0 HE22 GLN A 128 3.945 3.707 -8.336 1.00 15.33 H new ATOM 2026 N VAL A 129 3.027 7.785 -12.958 1.00 12.23 N ATOM 2027 CA VAL A 129 3.079 9.140 -12.429 1.00 33.24 C ATOM 2028 C VAL A 129 2.019 9.332 -11.353 1.00 3.55 C ATOM 2029 O VAL A 129 0.819 9.305 -11.630 1.00 64.24 O ATOM 2030 CB VAL A 129 2.880 10.204 -13.535 1.00 74.44 C ATOM 2031 CG1 VAL A 129 2.874 11.607 -12.941 1.00 33.40 C ATOM 2032 CG2 VAL A 129 3.962 10.087 -14.595 1.00 71.14 C ATOM 0 H VAL A 129 2.104 7.496 -13.283 1.00 12.23 H new ATOM 0 HA VAL A 129 4.072 9.275 -12.000 1.00 33.24 H new ATOM 0 HB VAL A 129 1.913 10.023 -14.005 1.00 74.44 H new ATOM 0 HG11 VAL A 129 2.733 12.338 -13.737 1.00 33.40 H new ATOM 0 HG12 VAL A 129 2.061 11.693 -12.220 1.00 33.40 H new ATOM 0 HG13 VAL A 129 3.824 11.794 -12.440 1.00 33.40 H new ATOM 0 HG21 VAL A 129 3.803 10.844 -15.363 1.00 71.14 H new ATOM 0 HG22 VAL A 129 4.939 10.236 -14.135 1.00 71.14 H new ATOM 0 HG23 VAL A 129 3.922 9.097 -15.048 1.00 71.14 H new ATOM 2042 N GLN A 130 2.470 9.490 -10.121 1.00 34.21 N ATOM 2043 CA GLN A 130 1.580 9.789 -9.014 1.00 43.25 C ATOM 2044 C GLN A 130 1.362 11.293 -8.913 1.00 72.35 C ATOM 2045 O GLN A 130 2.309 12.054 -8.710 1.00 4.35 O ATOM 2046 CB GLN A 130 2.127 9.230 -7.689 1.00 30.24 C ATOM 2047 CG GLN A 130 3.608 9.498 -7.445 1.00 50.23 C ATOM 2048 CD GLN A 130 4.517 8.393 -7.972 1.00 34.41 C ATOM 2049 OE1 GLN A 130 4.194 7.703 -8.940 1.00 72.45 O ATOM 2050 NE2 GLN A 130 5.666 8.221 -7.336 1.00 72.50 N ATOM 0 H GLN A 130 3.454 9.416 -9.862 1.00 34.21 H new ATOM 0 HA GLN A 130 0.623 9.304 -9.205 1.00 43.25 H new ATOM 0 HB2 GLN A 130 1.554 9.658 -6.866 1.00 30.24 H new ATOM 0 HB3 GLN A 130 1.959 8.153 -7.668 1.00 30.24 H new ATOM 0 HG2 GLN A 130 3.882 10.441 -7.918 1.00 50.23 H new ATOM 0 HG3 GLN A 130 3.777 9.618 -6.375 1.00 50.23 H new ATOM 0 HE21 GLN A 130 5.900 8.811 -6.538 1.00 72.50 H new ATOM 0 HE22 GLN A 130 6.316 7.498 -7.644 1.00 72.50 H new ATOM 2059 N ALA A 131 0.118 11.713 -9.070 1.00 34.51 N ATOM 2060 CA ALA A 131 -0.220 13.127 -9.074 1.00 65.44 C ATOM 2061 C ALA A 131 -1.070 13.488 -7.865 1.00 2.34 C ATOM 2062 O ALA A 131 -2.025 12.781 -7.535 1.00 71.14 O ATOM 2063 CB ALA A 131 -0.949 13.488 -10.360 1.00 20.12 C ATOM 0 H ALA A 131 -0.680 11.090 -9.197 1.00 34.51 H new ATOM 0 HA ALA A 131 0.706 13.700 -9.019 1.00 65.44 H new ATOM 0 HB1 ALA A 131 -1.197 14.549 -10.352 1.00 20.12 H new ATOM 0 HB2 ALA A 131 -0.308 13.272 -11.215 1.00 20.12 H new ATOM 0 HB3 ALA A 131 -1.865 12.902 -10.436 1.00 20.12 H new ATOM 2069 N SER A 132 -0.715 14.578 -7.204 1.00 0.20 N ATOM 2070 CA SER A 132 -1.460 15.047 -6.049 1.00 61.10 C ATOM 2071 C SER A 132 -2.714 15.817 -6.467 1.00 34.02 C ATOM 2072 O SER A 132 -3.815 15.514 -6.013 1.00 74.22 O ATOM 2073 CB SER A 132 -0.554 15.908 -5.164 1.00 40.15 C ATOM 2074 OG SER A 132 0.492 16.503 -5.923 1.00 42.12 O ATOM 0 H SER A 132 0.088 15.156 -7.450 1.00 0.20 H new ATOM 0 HA SER A 132 -1.792 14.181 -5.477 1.00 61.10 H new ATOM 0 HB2 SER A 132 -1.145 16.687 -4.682 1.00 40.15 H new ATOM 0 HB3 SER A 132 -0.127 15.295 -4.370 1.00 40.15 H new ATOM 0 HG SER A 132 0.167 17.330 -6.336 1.00 42.12 H new ATOM 2080 N GLU A 133 -2.546 16.806 -7.333 1.00 72.51 N ATOM 2081 CA GLU A 133 -3.673 17.589 -7.820 1.00 1.33 C ATOM 2082 C GLU A 133 -3.905 17.330 -9.305 1.00 74.22 C ATOM 2083 O GLU A 133 -3.026 16.817 -9.999 1.00 61.03 O ATOM 2084 CB GLU A 133 -3.460 19.089 -7.566 1.00 22.24 C ATOM 2085 CG GLU A 133 -2.166 19.657 -8.138 1.00 62.31 C ATOM 2086 CD GLU A 133 -0.952 19.339 -7.289 1.00 52.15 C ATOM 2087 OE1 GLU A 133 -0.694 20.074 -6.311 1.00 13.52 O ATOM 2088 OE2 GLU A 133 -0.254 18.352 -7.590 1.00 43.45 O ATOM 0 H GLU A 133 -1.641 17.085 -7.713 1.00 72.51 H new ATOM 0 HA GLU A 133 -4.559 17.276 -7.268 1.00 1.33 H new ATOM 0 HB2 GLU A 133 -4.300 19.638 -7.991 1.00 22.24 H new ATOM 0 HB3 GLU A 133 -3.474 19.267 -6.491 1.00 22.24 H new ATOM 0 HG2 GLU A 133 -2.014 19.260 -9.142 1.00 62.31 H new ATOM 0 HG3 GLU A 133 -2.262 20.739 -8.234 1.00 62.31 H new ATOM 2095 N MET A 134 -5.092 17.689 -9.790 1.00 64.24 N ATOM 2096 CA MET A 134 -5.456 17.469 -11.192 1.00 61.30 C ATOM 2097 C MET A 134 -4.601 18.321 -12.125 1.00 62.52 C ATOM 2098 O MET A 134 -4.555 18.084 -13.327 1.00 1.51 O ATOM 2099 CB MET A 134 -6.953 17.754 -11.414 1.00 5.22 C ATOM 2100 CG MET A 134 -7.391 19.180 -11.083 1.00 11.12 C ATOM 2101 SD MET A 134 -6.965 20.382 -12.364 1.00 70.23 S ATOM 2102 CE MET A 134 -7.950 19.780 -13.735 1.00 14.33 C ATOM 0 H MET A 134 -5.821 18.135 -9.233 1.00 64.24 H new ATOM 0 HA MET A 134 -5.265 16.422 -11.428 1.00 61.30 H new ATOM 0 HB2 MET A 134 -7.197 17.547 -12.456 1.00 5.22 H new ATOM 0 HB3 MET A 134 -7.534 17.060 -10.806 1.00 5.22 H new ATOM 0 HG2 MET A 134 -8.470 19.193 -10.928 1.00 11.12 H new ATOM 0 HG3 MET A 134 -6.930 19.484 -10.143 1.00 11.12 H new ATOM 0 HE1 MET A 134 -8.465 20.616 -14.208 1.00 14.33 H new ATOM 0 HE2 MET A 134 -7.301 19.295 -14.464 1.00 14.33 H new ATOM 0 HE3 MET A 134 -8.684 19.062 -13.368 1.00 14.33 H new ATOM 2112 N SER A 135 -3.928 19.308 -11.560 1.00 3.22 N ATOM 2113 CA SER A 135 -3.066 20.185 -12.332 1.00 54.11 C ATOM 2114 C SER A 135 -1.692 19.548 -12.535 1.00 53.41 C ATOM 2115 O SER A 135 -0.915 19.976 -13.385 1.00 73.14 O ATOM 2116 CB SER A 135 -2.939 21.528 -11.617 1.00 4.42 C ATOM 2117 OG SER A 135 -4.222 22.008 -11.244 1.00 31.02 O ATOM 0 H SER A 135 -3.963 19.523 -10.563 1.00 3.22 H new ATOM 0 HA SER A 135 -3.507 20.345 -13.316 1.00 54.11 H new ATOM 0 HB2 SER A 135 -2.312 21.419 -10.732 1.00 4.42 H new ATOM 0 HB3 SER A 135 -2.448 22.250 -12.269 1.00 4.42 H new ATOM 0 HG SER A 135 -4.912 21.499 -11.719 1.00 31.02 H new ATOM 2123 N ASP A 136 -1.399 18.517 -11.747 1.00 21.24 N ATOM 2124 CA ASP A 136 -0.101 17.853 -11.810 1.00 22.12 C ATOM 2125 C ASP A 136 -0.080 16.826 -12.936 1.00 12.51 C ATOM 2126 O ASP A 136 0.971 16.533 -13.506 1.00 71.32 O ATOM 2127 CB ASP A 136 0.215 17.177 -10.475 1.00 30.42 C ATOM 2128 CG ASP A 136 1.652 16.699 -10.386 1.00 51.45 C ATOM 2129 OD1 ASP A 136 2.567 17.539 -10.519 1.00 35.14 O ATOM 2130 OD2 ASP A 136 1.871 15.491 -10.169 1.00 10.43 O ATOM 0 H ASP A 136 -2.041 18.124 -11.059 1.00 21.24 H new ATOM 0 HA ASP A 136 0.661 18.606 -12.012 1.00 22.12 H new ATOM 0 HB2 ASP A 136 0.018 17.877 -9.663 1.00 30.42 H new ATOM 0 HB3 ASP A 136 -0.455 16.329 -10.334 1.00 30.42 H new ATOM 2135 N LEU A 137 -1.254 16.304 -13.279 1.00 45.41 N ATOM 2136 CA LEU A 137 -1.365 15.315 -14.343 1.00 2.41 C ATOM 2137 C LEU A 137 -1.396 15.993 -15.713 1.00 11.33 C ATOM 2138 O LEU A 137 -1.468 15.327 -16.748 1.00 2.25 O ATOM 2139 CB LEU A 137 -2.595 14.414 -14.128 1.00 5.31 C ATOM 2140 CG LEU A 137 -3.947 15.125 -13.973 1.00 41.34 C ATOM 2141 CD1 LEU A 137 -4.548 15.482 -15.327 1.00 64.03 C ATOM 2142 CD2 LEU A 137 -4.907 14.257 -13.174 1.00 61.52 C ATOM 0 H LEU A 137 -2.139 16.550 -12.836 1.00 45.41 H new ATOM 0 HA LEU A 137 -0.482 14.677 -14.312 1.00 2.41 H new ATOM 0 HB2 LEU A 137 -2.666 13.727 -14.971 1.00 5.31 H new ATOM 0 HB3 LEU A 137 -2.423 13.809 -13.237 1.00 5.31 H new ATOM 0 HG LEU A 137 -3.778 16.056 -13.432 1.00 41.34 H new ATOM 0 HD11 LEU A 137 -5.504 15.984 -15.180 1.00 64.03 H new ATOM 0 HD12 LEU A 137 -3.869 16.145 -15.863 1.00 64.03 H new ATOM 0 HD13 LEU A 137 -4.701 14.573 -15.908 1.00 64.03 H new ATOM 0 HD21 LEU A 137 -5.862 14.771 -13.070 1.00 61.52 H new ATOM 0 HD22 LEU A 137 -5.059 13.310 -13.692 1.00 61.52 H new ATOM 0 HD23 LEU A 137 -4.489 14.066 -12.186 1.00 61.52 H new ATOM 2154 N ASP A 138 -1.341 17.322 -15.703 1.00 32.14 N ATOM 2155 CA ASP A 138 -1.228 18.105 -16.928 1.00 64.34 C ATOM 2156 C ASP A 138 0.003 17.687 -17.722 1.00 72.22 C ATOM 2157 O ASP A 138 1.032 17.314 -17.147 1.00 13.41 O ATOM 2158 CB ASP A 138 -1.176 19.603 -16.627 1.00 4.11 C ATOM 2159 CG ASP A 138 -2.545 20.251 -16.634 1.00 63.42 C ATOM 2160 OD1 ASP A 138 -3.003 20.662 -17.722 1.00 22.21 O ATOM 2161 OD2 ASP A 138 -3.159 20.368 -15.557 1.00 52.21 O ATOM 0 H ASP A 138 -1.373 17.882 -14.851 1.00 32.14 H new ATOM 0 HA ASP A 138 -2.117 17.909 -17.528 1.00 64.34 H new ATOM 0 HB2 ASP A 138 -0.711 19.757 -15.653 1.00 4.11 H new ATOM 0 HB3 ASP A 138 -0.542 20.095 -17.365 1.00 4.11 H new ATOM 2166 N GLU A 139 -0.122 17.739 -19.043 1.00 31.22 N ATOM 2167 CA GLU A 139 0.896 17.232 -19.959 1.00 20.22 C ATOM 2168 C GLU A 139 2.300 17.776 -19.671 1.00 24.13 C ATOM 2169 O GLU A 139 3.286 17.137 -20.042 1.00 21.34 O ATOM 2170 CB GLU A 139 0.516 17.545 -21.407 1.00 63.23 C ATOM 2171 CG GLU A 139 0.434 19.029 -21.713 1.00 10.15 C ATOM 2172 CD GLU A 139 0.338 19.307 -23.195 1.00 70.22 C ATOM 2173 OE1 GLU A 139 1.401 19.435 -23.844 1.00 4.01 O ATOM 2174 OE2 GLU A 139 -0.790 19.395 -23.717 1.00 75.00 O ATOM 0 H GLU A 139 -0.936 18.136 -19.512 1.00 31.22 H new ATOM 0 HA GLU A 139 0.931 16.154 -19.802 1.00 20.22 H new ATOM 0 HB2 GLU A 139 1.248 17.087 -22.072 1.00 63.23 H new ATOM 0 HB3 GLU A 139 -0.447 17.085 -21.627 1.00 63.23 H new ATOM 0 HG2 GLU A 139 -0.434 19.454 -21.209 1.00 10.15 H new ATOM 0 HG3 GLU A 139 1.314 19.530 -21.308 1.00 10.15 H new ATOM 2181 N LYS A 140 2.392 18.944 -19.022 1.00 55.25 N ATOM 2182 CA LYS A 140 3.690 19.575 -18.756 1.00 12.10 C ATOM 2183 C LYS A 140 4.663 18.600 -18.084 1.00 22.45 C ATOM 2184 O LYS A 140 5.869 18.661 -18.320 1.00 65.22 O ATOM 2185 CB LYS A 140 3.549 20.855 -17.902 1.00 0.02 C ATOM 2186 CG LYS A 140 3.443 20.632 -16.393 1.00 12.04 C ATOM 2187 CD LYS A 140 2.064 20.150 -15.980 1.00 64.15 C ATOM 2188 CE LYS A 140 1.982 19.839 -14.489 1.00 34.50 C ATOM 2189 NZ LYS A 140 2.270 21.027 -13.639 1.00 2.20 N ATOM 0 H LYS A 140 1.589 19.468 -18.674 1.00 55.25 H new ATOM 0 HA LYS A 140 4.098 19.860 -19.726 1.00 12.10 H new ATOM 0 HB2 LYS A 140 4.408 21.497 -18.097 1.00 0.02 H new ATOM 0 HB3 LYS A 140 2.664 21.397 -18.235 1.00 0.02 H new ATOM 0 HG2 LYS A 140 4.190 19.901 -16.082 1.00 12.04 H new ATOM 0 HG3 LYS A 140 3.672 21.562 -15.873 1.00 12.04 H new ATOM 0 HD2 LYS A 140 1.325 20.911 -16.231 1.00 64.15 H new ATOM 0 HD3 LYS A 140 1.808 19.257 -16.550 1.00 64.15 H new ATOM 0 HE2 LYS A 140 0.986 19.462 -14.255 1.00 34.50 H new ATOM 0 HE3 LYS A 140 2.688 19.045 -14.248 1.00 34.50 H new ATOM 0 HZ1 LYS A 140 2.102 20.789 -12.641 1.00 2.20 H new ATOM 0 HZ2 LYS A 140 3.262 21.312 -13.765 1.00 2.20 H new ATOM 0 HZ3 LYS A 140 1.647 21.812 -13.917 1.00 2.20 H new ATOM 2203 N SER A 141 4.137 17.690 -17.271 1.00 73.45 N ATOM 2204 CA SER A 141 4.971 16.708 -16.596 1.00 13.44 C ATOM 2205 C SER A 141 4.762 15.315 -17.186 1.00 62.30 C ATOM 2206 O SER A 141 5.693 14.717 -17.723 1.00 13.45 O ATOM 2207 CB SER A 141 4.663 16.694 -15.098 1.00 43.53 C ATOM 2208 OG SER A 141 4.755 17.999 -14.547 1.00 24.05 O ATOM 0 H SER A 141 3.141 17.614 -17.065 1.00 73.45 H new ATOM 0 HA SER A 141 6.014 16.990 -16.744 1.00 13.44 H new ATOM 0 HB2 SER A 141 3.662 16.295 -14.933 1.00 43.53 H new ATOM 0 HB3 SER A 141 5.359 16.029 -14.586 1.00 43.53 H new ATOM 0 HG SER A 141 4.552 17.965 -13.589 1.00 24.05 H new ATOM 2214 N VAL A 142 3.526 14.825 -17.112 1.00 2.30 N ATOM 2215 CA VAL A 142 3.201 13.457 -17.519 1.00 11.30 C ATOM 2216 C VAL A 142 3.622 13.173 -18.959 1.00 53.32 C ATOM 2217 O VAL A 142 4.358 12.220 -19.219 1.00 15.15 O ATOM 2218 CB VAL A 142 1.690 13.178 -17.367 1.00 25.55 C ATOM 2219 CG1 VAL A 142 1.342 11.765 -17.818 1.00 21.51 C ATOM 2220 CG2 VAL A 142 1.260 13.399 -15.927 1.00 61.22 C ATOM 0 H VAL A 142 2.727 15.359 -16.771 1.00 2.30 H new ATOM 0 HA VAL A 142 3.761 12.795 -16.859 1.00 11.30 H new ATOM 0 HB VAL A 142 1.149 13.874 -18.008 1.00 25.55 H new ATOM 0 HG11 VAL A 142 0.271 11.598 -17.699 1.00 21.51 H new ATOM 0 HG12 VAL A 142 1.614 11.640 -18.866 1.00 21.51 H new ATOM 0 HG13 VAL A 142 1.891 11.044 -17.212 1.00 21.51 H new ATOM 0 HG21 VAL A 142 0.193 13.199 -15.831 1.00 61.22 H new ATOM 0 HG22 VAL A 142 1.815 12.725 -15.274 1.00 61.22 H new ATOM 0 HG23 VAL A 142 1.463 14.431 -15.641 1.00 61.22 H new ATOM 2230 N LYS A 143 3.168 14.007 -19.887 1.00 72.14 N ATOM 2231 CA LYS A 143 3.451 13.798 -21.301 1.00 2.11 C ATOM 2232 C LYS A 143 4.944 13.965 -21.581 1.00 41.52 C ATOM 2233 O LYS A 143 5.526 13.199 -22.344 1.00 22.43 O ATOM 2234 CB LYS A 143 2.611 14.764 -22.158 1.00 12.14 C ATOM 2235 CG LYS A 143 2.761 14.582 -23.667 1.00 52.13 C ATOM 2236 CD LYS A 143 3.926 15.387 -24.228 1.00 45.22 C ATOM 2237 CE LYS A 143 3.678 16.888 -24.125 1.00 75.31 C ATOM 2238 NZ LYS A 143 2.607 17.344 -25.054 1.00 63.41 N ATOM 0 H LYS A 143 2.604 14.832 -19.686 1.00 72.14 H new ATOM 0 HA LYS A 143 3.176 12.778 -21.569 1.00 2.11 H new ATOM 0 HB2 LYS A 143 1.561 14.640 -21.895 1.00 12.14 H new ATOM 0 HB3 LYS A 143 2.886 15.787 -21.901 1.00 12.14 H new ATOM 0 HG2 LYS A 143 2.909 13.526 -23.891 1.00 52.13 H new ATOM 0 HG3 LYS A 143 1.839 14.886 -24.162 1.00 52.13 H new ATOM 0 HD2 LYS A 143 4.838 15.131 -23.688 1.00 45.22 H new ATOM 0 HD3 LYS A 143 4.086 15.116 -25.271 1.00 45.22 H new ATOM 0 HE2 LYS A 143 3.401 17.140 -23.101 1.00 75.31 H new ATOM 0 HE3 LYS A 143 4.601 17.424 -24.346 1.00 75.31 H new ATOM 0 HZ1 LYS A 143 3.025 17.928 -25.806 1.00 63.41 H new ATOM 0 HZ2 LYS A 143 2.139 16.517 -25.477 1.00 63.41 H new ATOM 0 HZ3 LYS A 143 1.907 17.906 -24.528 1.00 63.41 H new ATOM 2252 N SER A 144 5.559 14.954 -20.944 1.00 45.12 N ATOM 2253 CA SER A 144 6.975 15.237 -21.149 1.00 15.33 C ATOM 2254 C SER A 144 7.853 14.088 -20.653 1.00 73.13 C ATOM 2255 O SER A 144 8.866 13.757 -21.279 1.00 32.12 O ATOM 2256 CB SER A 144 7.351 16.540 -20.442 1.00 21.03 C ATOM 2257 OG SER A 144 6.512 17.600 -20.871 1.00 22.32 O ATOM 0 H SER A 144 5.098 15.575 -20.279 1.00 45.12 H new ATOM 0 HA SER A 144 7.149 15.345 -22.220 1.00 15.33 H new ATOM 0 HB2 SER A 144 7.263 16.413 -19.363 1.00 21.03 H new ATOM 0 HB3 SER A 144 8.392 16.786 -20.650 1.00 21.03 H new ATOM 0 HG SER A 144 6.196 18.103 -20.092 1.00 22.32 H new ATOM 2263 N ASP A 145 7.456 13.473 -19.543 1.00 22.25 N ATOM 2264 CA ASP A 145 8.214 12.365 -18.970 1.00 64.50 C ATOM 2265 C ASP A 145 8.273 11.199 -19.946 1.00 55.12 C ATOM 2266 O ASP A 145 9.351 10.779 -20.375 1.00 34.42 O ATOM 2267 CB ASP A 145 7.583 11.895 -17.658 1.00 4.44 C ATOM 2268 CG ASP A 145 8.460 10.901 -16.915 1.00 32.02 C ATOM 2269 OD1 ASP A 145 8.502 9.716 -17.305 1.00 12.45 O ATOM 2270 OD2 ASP A 145 9.113 11.308 -15.929 1.00 23.42 O ATOM 0 H ASP A 145 6.615 13.723 -19.023 1.00 22.25 H new ATOM 0 HA ASP A 145 9.225 12.721 -18.770 1.00 64.50 H new ATOM 0 HB2 ASP A 145 7.395 12.758 -17.019 1.00 4.44 H new ATOM 0 HB3 ASP A 145 6.616 11.437 -17.867 1.00 4.44 H new ATOM 2275 N LEU A 146 7.099 10.707 -20.324 1.00 54.15 N ATOM 2276 CA LEU A 146 6.995 9.547 -21.198 1.00 13.15 C ATOM 2277 C LEU A 146 7.487 9.866 -22.609 1.00 5.23 C ATOM 2278 O LEU A 146 7.826 8.967 -23.368 1.00 45.43 O ATOM 2279 CB LEU A 146 5.547 9.031 -21.223 1.00 1.45 C ATOM 2280 CG LEU A 146 4.494 9.995 -21.784 1.00 53.43 C ATOM 2281 CD1 LEU A 146 4.369 9.854 -23.293 1.00 4.10 C ATOM 2282 CD2 LEU A 146 3.151 9.761 -21.114 1.00 70.13 C ATOM 0 H LEU A 146 6.201 11.097 -20.036 1.00 54.15 H new ATOM 0 HA LEU A 146 7.638 8.762 -20.800 1.00 13.15 H new ATOM 0 HB2 LEU A 146 5.520 8.114 -21.812 1.00 1.45 H new ATOM 0 HB3 LEU A 146 5.260 8.765 -20.206 1.00 1.45 H new ATOM 0 HG LEU A 146 4.819 11.013 -21.568 1.00 53.43 H new ATOM 0 HD11 LEU A 146 3.615 10.550 -23.662 1.00 4.10 H new ATOM 0 HD12 LEU A 146 5.328 10.077 -23.760 1.00 4.10 H new ATOM 0 HD13 LEU A 146 4.074 8.834 -23.540 1.00 4.10 H new ATOM 0 HD21 LEU A 146 2.415 10.453 -21.523 1.00 70.13 H new ATOM 0 HD22 LEU A 146 2.827 8.736 -21.297 1.00 70.13 H new ATOM 0 HD23 LEU A 146 3.246 9.926 -20.041 1.00 70.13 H new ATOM 2294 N MET A 147 7.521 11.148 -22.954 1.00 1.25 N ATOM 2295 CA MET A 147 8.029 11.576 -24.252 1.00 72.10 C ATOM 2296 C MET A 147 9.548 11.462 -24.291 1.00 72.02 C ATOM 2297 O MET A 147 10.136 11.147 -25.325 1.00 3.45 O ATOM 2298 CB MET A 147 7.600 13.016 -24.545 1.00 23.32 C ATOM 2299 CG MET A 147 8.130 13.558 -25.862 1.00 61.11 C ATOM 2300 SD MET A 147 7.533 15.223 -26.218 1.00 70.55 S ATOM 2301 CE MET A 147 8.155 16.116 -24.794 1.00 73.24 C ATOM 0 H MET A 147 7.203 11.909 -22.353 1.00 1.25 H new ATOM 0 HA MET A 147 7.610 10.924 -25.019 1.00 72.10 H new ATOM 0 HB2 MET A 147 6.511 13.066 -24.554 1.00 23.32 H new ATOM 0 HB3 MET A 147 7.942 13.659 -23.734 1.00 23.32 H new ATOM 0 HG2 MET A 147 9.220 13.565 -25.836 1.00 61.11 H new ATOM 0 HG3 MET A 147 7.835 12.890 -26.671 1.00 61.11 H new ATOM 0 HE1 MET A 147 7.328 16.356 -24.126 1.00 73.24 H new ATOM 0 HE2 MET A 147 8.881 15.498 -24.266 1.00 73.24 H new ATOM 0 HE3 MET A 147 8.635 17.038 -25.124 1.00 73.24 H new ATOM 2311 N SER A 148 10.179 11.705 -23.155 1.00 15.32 N ATOM 2312 CA SER A 148 11.626 11.616 -23.060 1.00 40.03 C ATOM 2313 C SER A 148 12.046 10.170 -22.810 1.00 53.53 C ATOM 2314 O SER A 148 12.911 9.627 -23.506 1.00 11.21 O ATOM 2315 CB SER A 148 12.130 12.526 -21.937 1.00 1.34 C ATOM 2316 OG SER A 148 11.611 13.842 -22.081 1.00 31.33 O ATOM 0 H SER A 148 9.712 11.965 -22.286 1.00 15.32 H new ATOM 0 HA SER A 148 12.068 11.945 -24.000 1.00 40.03 H new ATOM 0 HB2 SER A 148 11.833 12.117 -20.971 1.00 1.34 H new ATOM 0 HB3 SER A 148 13.219 12.557 -21.949 1.00 1.34 H new ATOM 0 HG SER A 148 10.668 13.852 -21.816 1.00 31.33 H new ATOM 2322 N ASN A 149 11.383 9.538 -21.848 1.00 22.05 N ATOM 2323 CA ASN A 149 11.698 8.168 -21.447 1.00 53.50 C ATOM 2324 C ASN A 149 11.087 7.155 -22.414 1.00 23.32 C ATOM 2325 O ASN A 149 11.179 5.947 -22.205 1.00 5.11 O ATOM 2326 CB ASN A 149 11.181 7.920 -20.029 1.00 14.21 C ATOM 2327 CG ASN A 149 11.934 8.723 -18.983 1.00 35.33 C ATOM 2328 OD1 ASN A 149 13.143 8.934 -19.095 1.00 4.15 O ATOM 2329 ND2 ASN A 149 11.224 9.205 -17.973 1.00 51.31 N ATOM 0 H ASN A 149 10.614 9.957 -21.325 1.00 22.05 H new ATOM 0 HA ASN A 149 12.780 8.041 -21.470 1.00 53.50 H new ATOM 0 HB2 ASN A 149 10.122 8.174 -19.983 1.00 14.21 H new ATOM 0 HB3 ASN A 149 11.265 6.858 -19.796 1.00 14.21 H new ATOM 0 HD21 ASN A 149 11.677 9.771 -17.256 1.00 51.31 H new ATOM 0 HD22 ASN A 149 10.225 9.010 -17.913 1.00 51.31 H new ATOM 2336 N GLN A 150 10.479 7.673 -23.476 1.00 11.44 N ATOM 2337 CA GLN A 150 9.820 6.869 -24.507 1.00 32.54 C ATOM 2338 C GLN A 150 10.730 5.765 -25.023 1.00 23.13 C ATOM 2339 O GLN A 150 10.310 4.623 -25.201 1.00 21.11 O ATOM 2340 CB GLN A 150 9.447 7.780 -25.670 1.00 51.24 C ATOM 2341 CG GLN A 150 8.419 7.204 -26.624 1.00 61.11 C ATOM 2342 CD GLN A 150 8.214 8.092 -27.835 1.00 25.02 C ATOM 2343 OE1 GLN A 150 9.139 8.766 -28.291 1.00 1.13 O ATOM 2344 NE2 GLN A 150 6.998 8.113 -28.353 1.00 73.25 N ATOM 0 H GLN A 150 10.428 8.677 -23.650 1.00 11.44 H new ATOM 0 HA GLN A 150 8.936 6.406 -24.069 1.00 32.54 H new ATOM 0 HB2 GLN A 150 9.065 8.719 -25.270 1.00 51.24 H new ATOM 0 HB3 GLN A 150 10.351 8.017 -26.232 1.00 51.24 H new ATOM 0 HG2 GLN A 150 8.740 6.214 -26.949 1.00 61.11 H new ATOM 0 HG3 GLN A 150 7.471 7.076 -26.102 1.00 61.11 H new ATOM 0 HE21 GLN A 150 6.260 7.539 -27.945 1.00 73.25 H new ATOM 0 HE22 GLN A 150 6.798 8.703 -29.161 1.00 73.25 H new ATOM 2353 N ARG A 151 11.977 6.127 -25.271 1.00 75.13 N ATOM 2354 CA ARG A 151 12.948 5.206 -25.829 1.00 32.22 C ATOM 2355 C ARG A 151 14.338 5.543 -25.307 1.00 33.33 C ATOM 2356 O ARG A 151 15.080 6.308 -25.927 1.00 22.24 O ATOM 2357 CB ARG A 151 12.898 5.257 -27.366 1.00 74.14 C ATOM 2358 CG ARG A 151 13.984 4.456 -28.075 1.00 72.33 C ATOM 2359 CD ARG A 151 13.946 2.978 -27.719 1.00 61.44 C ATOM 2360 NE ARG A 151 14.924 2.223 -28.502 1.00 1.43 N ATOM 2361 CZ ARG A 151 16.182 2.007 -28.117 1.00 54.32 C ATOM 2362 NH1 ARG A 151 16.597 2.420 -26.926 1.00 64.24 N ATOM 2363 NH2 ARG A 151 17.011 1.354 -28.922 1.00 42.12 N ATOM 0 H ARG A 151 12.342 7.062 -25.092 1.00 75.13 H new ATOM 0 HA ARG A 151 12.707 4.189 -25.519 1.00 32.22 H new ATOM 0 HB2 ARG A 151 11.925 4.891 -27.695 1.00 74.14 H new ATOM 0 HB3 ARG A 151 12.971 6.298 -27.682 1.00 74.14 H new ATOM 0 HG2 ARG A 151 13.869 4.570 -29.153 1.00 72.33 H new ATOM 0 HG3 ARG A 151 14.960 4.864 -27.814 1.00 72.33 H new ATOM 0 HD2 ARG A 151 14.151 2.851 -26.656 1.00 61.44 H new ATOM 0 HD3 ARG A 151 12.947 2.582 -27.901 1.00 61.44 H new ATOM 0 HE ARG A 151 14.625 1.838 -29.398 1.00 1.43 H new ATOM 0 HH11 ARG A 151 15.953 2.905 -26.301 1.00 64.24 H new ATOM 0 HH12 ARG A 151 17.560 2.253 -26.635 1.00 64.24 H new ATOM 0 HH21 ARG A 151 16.684 1.021 -29.829 1.00 42.12 H new ATOM 0 HH22 ARG A 151 17.975 1.185 -28.634 1.00 42.12 H new ATOM 2377 N ILE A 152 14.643 5.025 -24.127 1.00 2.40 N ATOM 2378 CA ILE A 152 15.973 5.161 -23.541 1.00 62.32 C ATOM 2379 C ILE A 152 16.501 3.808 -23.059 1.00 42.50 C ATOM 2380 O ILE A 152 16.659 3.612 -21.836 1.00 70.35 O ATOM 2381 CB ILE A 152 16.004 6.194 -22.383 1.00 44.20 C ATOM 2382 CG1 ILE A 152 14.642 6.306 -21.677 1.00 4.01 C ATOM 2383 CG2 ILE A 152 16.439 7.554 -22.905 1.00 11.13 C ATOM 2384 CD1 ILE A 152 14.267 5.109 -20.826 1.00 0.54 C ATOM 2385 OXT ILE A 152 16.740 2.932 -23.917 1.00 0.00 O ATOM 0 H ILE A 152 13.984 4.502 -23.551 1.00 2.40 H new ATOM 0 HA ILE A 152 16.626 5.534 -24.330 1.00 62.32 H new ATOM 0 HB ILE A 152 16.727 5.842 -21.647 1.00 44.20 H new ATOM 0 HG12 ILE A 152 14.647 7.195 -21.046 1.00 4.01 H new ATOM 0 HG13 ILE A 152 13.869 6.455 -22.431 1.00 4.01 H new ATOM 0 HG21 ILE A 152 16.457 8.270 -22.084 1.00 11.13 H new ATOM 0 HG22 ILE A 152 17.436 7.475 -23.340 1.00 11.13 H new ATOM 0 HG23 ILE A 152 15.737 7.893 -23.667 1.00 11.13 H new ATOM 0 HD11 ILE A 152 13.292 5.279 -20.369 1.00 0.54 H new ATOM 0 HD12 ILE A 152 14.224 4.217 -21.451 1.00 0.54 H new ATOM 0 HD13 ILE A 152 15.015 4.969 -20.045 1.00 0.54 H new TER 2397 ILE A 152