USER MOD reduce.3.24.130724 H: found=0, std=0, add=846, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 845 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 Single : A 4 THR OG1 : rot -37:sc= 0.0214 USER MOD Single : A 6 CYS SG : rot 180:sc= 0 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.0464 USER MOD Single : A 11 MET CE :methyl -143:sc= -3.97 (180deg=-6.66!) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 MET CE :methyl -153:sc= -0.301 (180deg=-1.05) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ -157:sc= -0.619 (180deg=-1.42) USER MOD Single : A 28 HIS : no HD1:sc= -0.451 X(o=-0.45,f=-0.025) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0.29 USER MOD Single : A 32 LYS NZ :NH3+ -142:sc=-0.00826 (180deg=-0.922) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 GLN : amide:sc= -0.395 K(o=-0.39,f=-4!) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.252 USER MOD Single : A 51 SER OG : rot -132:sc= 0.949 USER MOD Single : A 54 SER OG : rot -155:sc= 0.392 USER MOD Single : A 55 SER OG : rot -170:sc= -0.513 USER MOD Single : A 59 ASN : amide:sc= -0.635 X(o=-0.64,f=-0.54) USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 61 ASN : amide:sc= -0.104 K(o=-0.1,f=-1.1!) USER MOD Single : A 64 SER OG : rot 53:sc= 0.0781 USER MOD Single : A 66 THR OG1 : rot -53:sc= 0.773 USER MOD Single : A 67 ASN :FLIP amide:sc= -0.0863 F(o=-1.4,f=-0.086) USER MOD Single : A 78 SER OG : rot -34:sc= 0.679 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 91 THR OG1 : rot -102:sc= 0.244 USER MOD Single : A 97 TYR OH : rot 34:sc= -0.504 USER MOD ----------------------------------------------------------------- ATOM 38 N THR A 4 0.698 -7.977 -0.139 1.00 2.14 N ATOM 39 CA THR A 4 1.219 -9.327 0.033 1.00 61.21 C ATOM 40 C THR A 4 0.797 -9.913 1.376 1.00 41.15 C ATOM 41 O THR A 4 1.470 -10.787 1.922 1.00 5.43 O ATOM 42 CB THR A 4 2.756 -9.353 -0.065 1.00 61.13 C ATOM 43 OG1 THR A 4 3.328 -8.579 0.995 1.00 31.54 O ATOM 44 CG2 THR A 4 3.222 -8.807 -1.406 1.00 51.44 C ATOM 0 HA THR A 4 0.801 -9.932 -0.772 1.00 61.21 H new ATOM 0 HB THR A 4 3.086 -10.388 0.023 1.00 61.13 H new ATOM 0 HG1 THR A 4 2.773 -7.788 1.159 1.00 31.54 H new ATOM 0 HG21 THR A 4 4.311 -8.835 -1.452 1.00 51.44 H new ATOM 0 HG22 THR A 4 2.809 -9.416 -2.210 1.00 51.44 H new ATOM 0 HG23 THR A 4 2.881 -7.778 -1.518 1.00 51.44 H new ATOM 52 N VAL A 5 -0.322 -9.427 1.902 1.00 14.04 N ATOM 53 CA VAL A 5 -0.835 -9.904 3.181 1.00 34.00 C ATOM 54 C VAL A 5 -2.294 -9.502 3.373 1.00 65.14 C ATOM 55 O VAL A 5 -2.637 -8.321 3.302 1.00 70.51 O ATOM 56 CB VAL A 5 -0.005 -9.358 4.358 1.00 71.21 C ATOM 57 CG1 VAL A 5 0.041 -7.838 4.320 1.00 73.33 C ATOM 58 CG2 VAL A 5 -0.571 -9.850 5.682 1.00 43.33 C ATOM 0 H VAL A 5 -0.891 -8.703 1.463 1.00 14.04 H new ATOM 0 HA VAL A 5 -0.759 -10.991 3.166 1.00 34.00 H new ATOM 0 HB VAL A 5 1.015 -9.730 4.264 1.00 71.21 H new ATOM 0 HG11 VAL A 5 0.632 -7.471 5.159 1.00 73.33 H new ATOM 0 HG12 VAL A 5 0.496 -7.511 3.385 1.00 73.33 H new ATOM 0 HG13 VAL A 5 -0.972 -7.442 4.388 1.00 73.33 H new ATOM 0 HG21 VAL A 5 0.027 -9.455 6.503 1.00 43.33 H new ATOM 0 HG22 VAL A 5 -1.601 -9.509 5.787 1.00 43.33 H new ATOM 0 HG23 VAL A 5 -0.546 -10.939 5.706 1.00 43.33 H new ATOM 68 N CYS A 6 -3.147 -10.491 3.616 1.00 43.24 N ATOM 69 CA CYS A 6 -4.570 -10.241 3.817 1.00 5.44 C ATOM 70 C CYS A 6 -4.983 -10.576 5.246 1.00 32.35 C ATOM 71 O CYS A 6 -4.941 -11.735 5.661 1.00 24.14 O ATOM 72 CB CYS A 6 -5.398 -11.061 2.828 1.00 52.34 C ATOM 73 SG CYS A 6 -5.249 -10.515 1.110 1.00 22.41 S ATOM 0 H CYS A 6 -2.878 -11.473 3.679 1.00 43.24 H new ATOM 0 HA CYS A 6 -4.756 -9.181 3.643 1.00 5.44 H new ATOM 0 HB2 CYS A 6 -5.093 -12.105 2.894 1.00 52.34 H new ATOM 0 HB3 CYS A 6 -6.446 -11.016 3.123 1.00 52.34 H new ATOM 0 HG CYS A 6 -5.984 -11.271 0.349 1.00 22.41 H new ATOM 79 N THR A 7 -5.383 -9.554 5.997 1.00 24.32 N ATOM 80 CA THR A 7 -5.801 -9.740 7.381 1.00 52.13 C ATOM 81 C THR A 7 -7.286 -10.076 7.466 1.00 42.53 C ATOM 82 O THR A 7 -8.066 -9.708 6.587 1.00 61.14 O ATOM 83 CB THR A 7 -5.522 -8.483 8.226 1.00 45.22 C ATOM 84 OG1 THR A 7 -4.838 -7.503 7.436 1.00 71.53 O ATOM 85 CG2 THR A 7 -4.686 -8.828 9.449 1.00 2.11 C ATOM 0 H THR A 7 -5.426 -8.589 5.670 1.00 24.32 H new ATOM 0 HA THR A 7 -5.219 -10.572 7.778 1.00 52.13 H new ATOM 0 HB THR A 7 -6.477 -8.078 8.560 1.00 45.22 H new ATOM 0 HG1 THR A 7 -4.666 -6.706 7.980 1.00 71.53 H new ATOM 0 HG21 THR A 7 -4.502 -7.925 10.030 1.00 2.11 H new ATOM 0 HG22 THR A 7 -5.221 -9.552 10.063 1.00 2.11 H new ATOM 0 HG23 THR A 7 -3.735 -9.255 9.131 1.00 2.11 H new ATOM 93 N ILE A 8 -7.670 -10.774 8.529 1.00 63.34 N ATOM 94 CA ILE A 8 -9.062 -11.157 8.728 1.00 22.33 C ATOM 95 C ILE A 8 -9.545 -10.766 10.121 1.00 73.14 C ATOM 96 O ILE A 8 -8.860 -10.047 10.847 1.00 33.14 O ATOM 97 CB ILE A 8 -9.262 -12.672 8.534 1.00 14.12 C ATOM 98 CG1 ILE A 8 -7.910 -13.373 8.386 1.00 13.43 C ATOM 99 CG2 ILE A 8 -10.139 -12.939 7.320 1.00 50.22 C ATOM 100 CD1 ILE A 8 -7.286 -13.198 7.020 1.00 64.22 C ATOM 0 H ILE A 8 -7.037 -11.086 9.266 1.00 63.34 H new ATOM 0 HA ILE A 8 -9.647 -10.623 7.979 1.00 22.33 H new ATOM 0 HB ILE A 8 -9.763 -13.073 9.415 1.00 14.12 H new ATOM 0 HG12 ILE A 8 -7.225 -12.988 9.141 1.00 13.43 H new ATOM 0 HG13 ILE A 8 -8.038 -14.437 8.585 1.00 13.43 H new ATOM 0 HG21 ILE A 8 -10.271 -14.014 7.196 1.00 50.22 H new ATOM 0 HG22 ILE A 8 -11.111 -12.468 7.463 1.00 50.22 H new ATOM 0 HG23 ILE A 8 -9.664 -12.527 6.430 1.00 50.22 H new ATOM 0 HD11 ILE A 8 -6.330 -13.721 6.987 1.00 64.22 H new ATOM 0 HD12 ILE A 8 -7.951 -13.609 6.261 1.00 64.22 H new ATOM 0 HD13 ILE A 8 -7.126 -12.137 6.826 1.00 64.22 H new ATOM 112 N ALA A 9 -10.729 -11.246 10.486 1.00 15.03 N ATOM 113 CA ALA A 9 -11.303 -10.950 11.793 1.00 13.10 C ATOM 114 C ALA A 9 -10.256 -11.078 12.894 1.00 33.22 C ATOM 115 O ALA A 9 -10.094 -10.177 13.717 1.00 22.34 O ATOM 116 CB ALA A 9 -12.482 -11.871 12.073 1.00 41.42 C ATOM 0 H ALA A 9 -11.309 -11.841 9.895 1.00 15.03 H new ATOM 0 HA ALA A 9 -11.656 -9.919 11.782 1.00 13.10 H new ATOM 0 HB1 ALA A 9 -12.901 -11.639 13.052 1.00 41.42 H new ATOM 0 HB2 ALA A 9 -13.246 -11.727 11.309 1.00 41.42 H new ATOM 0 HB3 ALA A 9 -12.145 -12.908 12.059 1.00 41.42 H new ATOM 122 N ASP A 10 -9.549 -12.203 12.904 1.00 53.24 N ATOM 123 CA ASP A 10 -8.517 -12.449 13.904 1.00 11.30 C ATOM 124 C ASP A 10 -7.475 -13.432 13.380 1.00 52.24 C ATOM 125 O ASP A 10 -7.261 -14.494 13.963 1.00 72.12 O ATOM 126 CB ASP A 10 -9.143 -12.988 15.191 1.00 3.14 C ATOM 127 CG ASP A 10 -10.157 -12.032 15.787 1.00 54.44 C ATOM 128 OD1 ASP A 10 -9.741 -10.985 16.325 1.00 41.45 O ATOM 129 OD2 ASP A 10 -11.368 -12.331 15.715 1.00 11.43 O ATOM 0 H ASP A 10 -9.672 -12.959 12.230 1.00 53.24 H new ATOM 0 HA ASP A 10 -8.021 -11.502 14.119 1.00 11.30 H new ATOM 0 HB2 ASP A 10 -9.626 -13.943 14.984 1.00 3.14 H new ATOM 0 HB3 ASP A 10 -8.357 -13.180 15.921 1.00 3.14 H new ATOM 134 N MET A 11 -6.831 -13.070 12.275 1.00 72.23 N ATOM 135 CA MET A 11 -5.812 -13.921 11.672 1.00 44.11 C ATOM 136 C MET A 11 -5.018 -13.155 10.618 1.00 1.13 C ATOM 137 O MET A 11 -5.424 -12.077 10.182 1.00 64.12 O ATOM 138 CB MET A 11 -6.456 -15.158 11.043 1.00 43.34 C ATOM 139 CG MET A 11 -5.528 -16.360 10.978 1.00 3.05 C ATOM 140 SD MET A 11 -6.376 -17.866 10.465 1.00 13.22 S ATOM 141 CE MET A 11 -5.550 -19.085 11.485 1.00 44.44 C ATOM 0 H MET A 11 -6.997 -12.194 11.780 1.00 72.23 H new ATOM 0 HA MET A 11 -5.127 -14.238 12.459 1.00 44.11 H new ATOM 0 HB2 MET A 11 -7.344 -15.426 11.615 1.00 43.34 H new ATOM 0 HB3 MET A 11 -6.789 -14.911 10.035 1.00 43.34 H new ATOM 0 HG2 MET A 11 -4.716 -16.150 10.282 1.00 3.05 H new ATOM 0 HG3 MET A 11 -5.076 -16.518 11.957 1.00 3.05 H new ATOM 0 HE1 MET A 11 -5.427 -20.009 10.920 1.00 44.44 H new ATOM 0 HE2 MET A 11 -4.571 -18.708 11.782 1.00 44.44 H new ATOM 0 HE3 MET A 11 -6.149 -19.281 12.375 1.00 44.44 H new ATOM 151 N THR A 12 -3.884 -13.718 10.213 1.00 44.40 N ATOM 152 CA THR A 12 -3.033 -13.087 9.212 1.00 44.00 C ATOM 153 C THR A 12 -2.668 -14.068 8.103 1.00 10.25 C ATOM 154 O THR A 12 -1.803 -14.926 8.280 1.00 41.24 O ATOM 155 CB THR A 12 -1.739 -12.537 9.841 1.00 44.41 C ATOM 156 OG1 THR A 12 -2.057 -11.610 10.885 1.00 31.12 O ATOM 157 CG2 THR A 12 -0.877 -11.850 8.792 1.00 2.12 C ATOM 0 H THR A 12 -3.534 -14.610 10.563 1.00 44.40 H new ATOM 0 HA THR A 12 -3.603 -12.260 8.789 1.00 44.00 H new ATOM 0 HB THR A 12 -1.179 -13.375 10.257 1.00 44.41 H new ATOM 0 HG1 THR A 12 -1.229 -11.266 11.281 1.00 31.12 H new ATOM 0 HG21 THR A 12 0.031 -11.470 9.260 1.00 2.12 H new ATOM 0 HG22 THR A 12 -0.612 -12.565 8.013 1.00 2.12 H new ATOM 0 HG23 THR A 12 -1.432 -11.022 8.350 1.00 2.12 H new ATOM 165 N VAL A 13 -3.333 -13.935 6.960 1.00 22.30 N ATOM 166 CA VAL A 13 -3.077 -14.809 5.821 1.00 32.23 C ATOM 167 C VAL A 13 -2.023 -14.212 4.896 1.00 55.34 C ATOM 168 O VAL A 13 -2.011 -13.006 4.649 1.00 10.42 O ATOM 169 CB VAL A 13 -4.363 -15.072 5.015 1.00 13.34 C ATOM 170 CG1 VAL A 13 -4.081 -16.005 3.848 1.00 30.53 C ATOM 171 CG2 VAL A 13 -5.448 -15.643 5.916 1.00 73.04 C ATOM 0 H VAL A 13 -4.053 -13.231 6.798 1.00 22.30 H new ATOM 0 HA VAL A 13 -2.710 -15.753 6.223 1.00 32.23 H new ATOM 0 HB VAL A 13 -4.719 -14.124 4.612 1.00 13.34 H new ATOM 0 HG11 VAL A 13 -5.001 -16.179 3.291 1.00 30.53 H new ATOM 0 HG12 VAL A 13 -3.339 -15.552 3.191 1.00 30.53 H new ATOM 0 HG13 VAL A 13 -3.700 -16.954 4.225 1.00 30.53 H new ATOM 0 HG21 VAL A 13 -6.350 -15.823 5.331 1.00 73.04 H new ATOM 0 HG22 VAL A 13 -5.104 -16.582 6.350 1.00 73.04 H new ATOM 0 HG23 VAL A 13 -5.669 -14.934 6.714 1.00 73.04 H new ATOM 181 N ASP A 14 -1.141 -15.063 4.385 1.00 30.53 N ATOM 182 CA ASP A 14 -0.083 -14.620 3.485 1.00 72.34 C ATOM 183 C ASP A 14 -0.314 -15.151 2.073 1.00 24.11 C ATOM 184 O ASP A 14 -0.418 -16.359 1.863 1.00 25.22 O ATOM 185 CB ASP A 14 1.281 -15.081 4.000 1.00 61.31 C ATOM 186 CG ASP A 14 2.228 -13.923 4.247 1.00 62.54 C ATOM 187 OD1 ASP A 14 2.118 -12.904 3.533 1.00 20.04 O ATOM 188 OD2 ASP A 14 3.079 -14.036 5.153 1.00 30.44 O ATOM 0 H ASP A 14 -1.138 -16.064 4.579 1.00 30.53 H new ATOM 0 HA ASP A 14 -0.100 -13.531 3.452 1.00 72.34 H new ATOM 0 HB2 ASP A 14 1.146 -15.640 4.926 1.00 61.31 H new ATOM 0 HB3 ASP A 14 1.727 -15.764 3.277 1.00 61.31 H new ATOM 193 N MET A 15 -0.393 -14.240 1.109 1.00 13.53 N ATOM 194 CA MET A 15 -0.611 -14.617 -0.282 1.00 54.45 C ATOM 195 C MET A 15 0.699 -15.026 -0.947 1.00 4.23 C ATOM 196 O MET A 15 0.702 -15.602 -2.035 1.00 2.32 O ATOM 197 CB MET A 15 -1.247 -13.458 -1.053 1.00 73.24 C ATOM 198 CG MET A 15 -0.355 -12.231 -1.152 1.00 33.42 C ATOM 199 SD MET A 15 -0.422 -11.453 -2.777 1.00 5.01 S ATOM 200 CE MET A 15 0.185 -12.782 -3.814 1.00 15.23 C ATOM 0 H MET A 15 -0.309 -13.236 1.266 1.00 13.53 H new ATOM 0 HA MET A 15 -1.288 -15.471 -0.299 1.00 54.45 H new ATOM 0 HB2 MET A 15 -1.499 -13.796 -2.058 1.00 73.24 H new ATOM 0 HB3 MET A 15 -2.182 -13.179 -0.567 1.00 73.24 H new ATOM 0 HG2 MET A 15 -0.654 -11.507 -0.394 1.00 33.42 H new ATOM 0 HG3 MET A 15 0.674 -12.516 -0.932 1.00 33.42 H new ATOM 0 HE1 MET A 15 0.650 -12.364 -4.707 1.00 15.23 H new ATOM 0 HE2 MET A 15 0.920 -13.367 -3.262 1.00 15.23 H new ATOM 0 HE3 MET A 15 -0.646 -13.425 -4.105 1.00 15.23 H new ATOM 210 N VAL A 16 1.812 -14.725 -0.285 1.00 43.41 N ATOM 211 CA VAL A 16 3.130 -15.062 -0.811 1.00 55.03 C ATOM 212 C VAL A 16 3.743 -16.231 -0.048 1.00 42.54 C ATOM 213 O VAL A 16 4.504 -17.020 -0.609 1.00 3.45 O ATOM 214 CB VAL A 16 4.087 -13.858 -0.741 1.00 43.31 C ATOM 215 CG1 VAL A 16 3.708 -12.812 -1.779 1.00 32.32 C ATOM 216 CG2 VAL A 16 4.087 -13.258 0.657 1.00 52.11 C ATOM 0 H VAL A 16 1.827 -14.248 0.617 1.00 43.41 H new ATOM 0 HA VAL A 16 2.992 -15.346 -1.854 1.00 55.03 H new ATOM 0 HB VAL A 16 5.096 -14.205 -0.963 1.00 43.31 H new ATOM 0 HG11 VAL A 16 4.396 -11.969 -1.714 1.00 32.32 H new ATOM 0 HG12 VAL A 16 3.765 -13.251 -2.775 1.00 32.32 H new ATOM 0 HG13 VAL A 16 2.691 -12.466 -1.593 1.00 32.32 H new ATOM 0 HG21 VAL A 16 4.769 -12.408 0.688 1.00 52.11 H new ATOM 0 HG22 VAL A 16 3.080 -12.925 0.910 1.00 52.11 H new ATOM 0 HG23 VAL A 16 4.412 -14.010 1.376 1.00 52.11 H new ATOM 226 N ARG A 17 3.407 -16.336 1.233 1.00 13.50 N ATOM 227 CA ARG A 17 3.925 -17.408 2.074 1.00 43.23 C ATOM 228 C ARG A 17 2.890 -18.517 2.241 1.00 44.43 C ATOM 229 O ARG A 17 3.224 -19.638 2.625 1.00 52.24 O ATOM 230 CB ARG A 17 4.328 -16.861 3.444 1.00 12.34 C ATOM 231 CG ARG A 17 5.290 -15.686 3.373 1.00 73.02 C ATOM 232 CD ARG A 17 6.059 -15.516 4.674 1.00 51.35 C ATOM 233 NE ARG A 17 6.830 -14.276 4.695 1.00 43.21 N ATOM 234 CZ ARG A 17 7.966 -14.105 4.027 1.00 74.03 C ATOM 235 NH1 ARG A 17 8.458 -15.090 3.288 1.00 5.40 N ATOM 236 NH2 ARG A 17 8.610 -12.947 4.096 1.00 30.21 N ATOM 0 H ARG A 17 2.778 -15.691 1.712 1.00 13.50 H new ATOM 0 HA ARG A 17 4.805 -17.827 1.585 1.00 43.23 H new ATOM 0 HB2 ARG A 17 3.431 -16.553 3.981 1.00 12.34 H new ATOM 0 HB3 ARG A 17 4.788 -17.661 4.024 1.00 12.34 H new ATOM 0 HG2 ARG A 17 5.991 -15.837 2.552 1.00 73.02 H new ATOM 0 HG3 ARG A 17 4.736 -14.773 3.155 1.00 73.02 H new ATOM 0 HD2 ARG A 17 5.361 -15.523 5.511 1.00 51.35 H new ATOM 0 HD3 ARG A 17 6.731 -16.363 4.812 1.00 51.35 H new ATOM 0 HE ARG A 17 6.477 -13.498 5.253 1.00 43.21 H new ATOM 0 HH11 ARG A 17 7.964 -15.981 3.232 1.00 5.40 H new ATOM 0 HH12 ARG A 17 9.330 -14.957 2.776 1.00 5.40 H new ATOM 0 HH21 ARG A 17 8.233 -12.187 4.662 1.00 30.21 H new ATOM 0 HH22 ARG A 17 9.482 -12.817 3.583 1.00 30.21 H new ATOM 250 N ARG A 18 1.634 -18.195 1.950 1.00 0.02 N ATOM 251 CA ARG A 18 0.550 -19.163 2.070 1.00 44.12 C ATOM 252 C ARG A 18 0.474 -19.721 3.488 1.00 64.53 C ATOM 253 O ARG A 18 0.503 -20.936 3.691 1.00 14.33 O ATOM 254 CB ARG A 18 0.745 -20.304 1.070 1.00 20.52 C ATOM 255 CG ARG A 18 0.378 -19.933 -0.357 1.00 73.42 C ATOM 256 CD ARG A 18 1.568 -19.354 -1.106 1.00 72.52 C ATOM 257 NE ARG A 18 2.673 -20.305 -1.196 1.00 2.23 N ATOM 258 CZ ARG A 18 2.696 -21.328 -2.042 1.00 73.22 C ATOM 259 NH1 ARG A 18 1.679 -21.532 -2.868 1.00 34.42 N ATOM 260 NH2 ARG A 18 3.737 -22.150 -2.064 1.00 45.32 N ATOM 0 H ARG A 18 1.342 -17.272 1.630 1.00 0.02 H new ATOM 0 HA ARG A 18 -0.387 -18.652 1.849 1.00 44.12 H new ATOM 0 HB2 ARG A 18 1.786 -20.625 1.097 1.00 20.52 H new ATOM 0 HB3 ARG A 18 0.141 -21.156 1.382 1.00 20.52 H new ATOM 0 HG2 ARG A 18 0.012 -20.816 -0.881 1.00 73.42 H new ATOM 0 HG3 ARG A 18 -0.435 -19.207 -0.348 1.00 73.42 H new ATOM 0 HD2 ARG A 18 1.258 -19.063 -2.109 1.00 72.52 H new ATOM 0 HD3 ARG A 18 1.908 -18.449 -0.602 1.00 72.52 H new ATOM 0 HE ARG A 18 3.471 -20.176 -0.574 1.00 2.23 H new ATOM 0 HH11 ARG A 18 0.877 -20.902 -2.854 1.00 34.42 H new ATOM 0 HH12 ARG A 18 1.699 -22.319 -3.517 1.00 34.42 H new ATOM 0 HH21 ARG A 18 4.521 -21.997 -1.430 1.00 45.32 H new ATOM 0 HH22 ARG A 18 3.753 -22.935 -2.715 1.00 45.32 H new ATOM 274 N THR A 19 0.378 -18.827 4.466 1.00 2.25 N ATOM 275 CA THR A 19 0.300 -19.229 5.865 1.00 70.40 C ATOM 276 C THR A 19 -0.887 -18.573 6.560 1.00 35.53 C ATOM 277 O THR A 19 -1.553 -17.709 5.991 1.00 53.24 O ATOM 278 CB THR A 19 1.590 -18.869 6.626 1.00 15.24 C ATOM 279 OG1 THR A 19 1.624 -17.462 6.893 1.00 31.42 O ATOM 280 CG2 THR A 19 2.820 -19.269 5.826 1.00 1.43 C ATOM 0 H THR A 19 0.352 -17.819 4.315 1.00 2.25 H new ATOM 0 HA THR A 19 0.171 -20.311 5.876 1.00 70.40 H new ATOM 0 HB THR A 19 1.596 -19.418 7.568 1.00 15.24 H new ATOM 0 HG1 THR A 19 2.446 -17.241 7.379 1.00 31.42 H new ATOM 0 HG21 THR A 19 3.719 -19.005 6.384 1.00 1.43 H new ATOM 0 HG22 THR A 19 2.805 -20.345 5.650 1.00 1.43 H new ATOM 0 HG23 THR A 19 2.819 -18.745 4.870 1.00 1.43 H new ATOM 288 N VAL A 20 -1.148 -18.990 7.796 1.00 43.53 N ATOM 289 CA VAL A 20 -2.255 -18.441 8.570 1.00 45.30 C ATOM 290 C VAL A 20 -1.876 -18.290 10.039 1.00 32.42 C ATOM 291 O VAL A 20 -1.738 -19.280 10.759 1.00 0.32 O ATOM 292 CB VAL A 20 -3.509 -19.328 8.462 1.00 10.24 C ATOM 293 CG1 VAL A 20 -4.276 -19.016 7.187 1.00 51.25 C ATOM 294 CG2 VAL A 20 -3.127 -20.799 8.518 1.00 21.23 C ATOM 0 H VAL A 20 -0.608 -19.706 8.282 1.00 43.53 H new ATOM 0 HA VAL A 20 -2.478 -17.459 8.153 1.00 45.30 H new ATOM 0 HB VAL A 20 -4.159 -19.113 9.310 1.00 10.24 H new ATOM 0 HG11 VAL A 20 -5.159 -19.653 7.128 1.00 51.25 H new ATOM 0 HG12 VAL A 20 -4.583 -17.970 7.194 1.00 51.25 H new ATOM 0 HG13 VAL A 20 -3.637 -19.201 6.324 1.00 51.25 H new ATOM 0 HG21 VAL A 20 -4.025 -21.411 8.440 1.00 21.23 H new ATOM 0 HG22 VAL A 20 -2.456 -21.032 7.691 1.00 21.23 H new ATOM 0 HG23 VAL A 20 -2.625 -21.009 9.463 1.00 21.23 H new ATOM 304 N ILE A 21 -1.710 -17.047 10.478 1.00 75.15 N ATOM 305 CA ILE A 21 -1.350 -16.767 11.862 1.00 64.42 C ATOM 306 C ILE A 21 -2.551 -16.256 12.650 1.00 24.34 C ATOM 307 O ILE A 21 -3.053 -15.162 12.396 1.00 41.52 O ATOM 308 CB ILE A 21 -0.214 -15.731 11.949 1.00 23.10 C ATOM 309 CG1 ILE A 21 1.089 -16.323 11.407 1.00 30.22 C ATOM 310 CG2 ILE A 21 -0.032 -15.264 13.385 1.00 13.25 C ATOM 311 CD1 ILE A 21 1.188 -16.286 9.898 1.00 10.12 C ATOM 0 H ILE A 21 -1.819 -16.217 9.895 1.00 75.15 H new ATOM 0 HA ILE A 21 -1.008 -17.707 12.296 1.00 64.42 H new ATOM 0 HB ILE A 21 -0.481 -14.869 11.338 1.00 23.10 H new ATOM 0 HG12 ILE A 21 1.931 -15.777 11.832 1.00 30.22 H new ATOM 0 HG13 ILE A 21 1.177 -17.356 11.744 1.00 30.22 H new ATOM 0 HG21 ILE A 21 0.774 -14.532 13.430 1.00 13.25 H new ATOM 0 HG22 ILE A 21 -0.956 -14.808 13.739 1.00 13.25 H new ATOM 0 HG23 ILE A 21 0.217 -16.117 14.016 1.00 13.25 H new ATOM 0 HD11 ILE A 21 2.137 -16.722 9.585 1.00 10.12 H new ATOM 0 HD12 ILE A 21 0.366 -16.857 9.465 1.00 10.12 H new ATOM 0 HD13 ILE A 21 1.132 -15.253 9.555 1.00 10.12 H new ATOM 323 N ARG A 22 -3.005 -17.056 13.610 1.00 1.40 N ATOM 324 CA ARG A 22 -4.147 -16.684 14.437 1.00 43.00 C ATOM 325 C ARG A 22 -3.692 -15.939 15.689 1.00 61.32 C ATOM 326 O ARG A 22 -3.221 -16.549 16.649 1.00 11.31 O ATOM 327 CB ARG A 22 -4.944 -17.928 14.832 1.00 23.53 C ATOM 328 CG ARG A 22 -6.357 -17.623 15.302 1.00 24.11 C ATOM 329 CD ARG A 22 -7.297 -17.396 14.129 1.00 42.52 C ATOM 330 NE ARG A 22 -8.029 -18.607 13.771 1.00 33.43 N ATOM 331 CZ ARG A 22 -8.938 -18.658 12.804 1.00 63.55 C ATOM 332 NH1 ARG A 22 -9.223 -17.572 12.100 1.00 54.31 N ATOM 333 NH2 ARG A 22 -9.562 -19.799 12.537 1.00 11.35 N ATOM 0 H ARG A 22 -2.600 -17.965 13.834 1.00 1.40 H new ATOM 0 HA ARG A 22 -4.786 -16.022 13.853 1.00 43.00 H new ATOM 0 HB2 ARG A 22 -4.992 -18.604 13.978 1.00 23.53 H new ATOM 0 HB3 ARG A 22 -4.412 -18.453 15.625 1.00 23.53 H new ATOM 0 HG2 ARG A 22 -6.725 -18.449 15.910 1.00 24.11 H new ATOM 0 HG3 ARG A 22 -6.347 -16.738 15.938 1.00 24.11 H new ATOM 0 HD2 ARG A 22 -8.005 -16.606 14.379 1.00 42.52 H new ATOM 0 HD3 ARG A 22 -6.725 -17.051 13.268 1.00 42.52 H new ATOM 0 HE ARG A 22 -7.832 -19.461 14.292 1.00 33.43 H new ATOM 0 HH11 ARG A 22 -8.744 -16.694 12.300 1.00 54.31 H new ATOM 0 HH12 ARG A 22 -9.922 -17.614 11.358 1.00 54.31 H new ATOM 0 HH21 ARG A 22 -9.344 -20.638 13.075 1.00 11.35 H new ATOM 0 HH22 ARG A 22 -10.260 -19.837 11.794 1.00 11.35 H new ATOM 347 N SER A 23 -3.836 -14.618 15.670 1.00 24.01 N ATOM 348 CA SER A 23 -3.436 -13.789 16.801 1.00 23.54 C ATOM 349 C SER A 23 -2.003 -14.102 17.224 1.00 14.11 C ATOM 350 O SER A 23 -1.677 -14.086 18.410 1.00 3.40 O ATOM 351 CB SER A 23 -4.386 -14.006 17.981 1.00 72.15 C ATOM 352 OG SER A 23 -4.465 -12.847 18.792 1.00 53.35 O ATOM 0 H SER A 23 -4.227 -14.099 14.884 1.00 24.01 H new ATOM 0 HA SER A 23 -3.486 -12.745 16.490 1.00 23.54 H new ATOM 0 HB2 SER A 23 -5.378 -14.263 17.610 1.00 72.15 H new ATOM 0 HB3 SER A 23 -4.041 -14.849 18.579 1.00 72.15 H new ATOM 0 HG SER A 23 -5.079 -13.011 19.538 1.00 53.35 H new ATOM 358 N GLY A 24 -1.152 -14.387 16.243 1.00 12.41 N ATOM 359 CA GLY A 24 0.235 -14.699 16.532 1.00 22.02 C ATOM 360 C GLY A 24 0.460 -16.180 16.762 1.00 21.33 C ATOM 361 O GLY A 24 1.508 -16.586 17.265 1.00 60.50 O ATOM 0 H GLY A 24 -1.399 -14.407 15.253 1.00 12.41 H new ATOM 0 HA2 GLY A 24 0.860 -14.364 15.704 1.00 22.02 H new ATOM 0 HA3 GLY A 24 0.552 -14.145 17.415 1.00 22.02 H new ATOM 365 N LYS A 25 -0.527 -16.991 16.395 1.00 3.15 N ATOM 366 CA LYS A 25 -0.433 -18.436 16.565 1.00 73.15 C ATOM 367 C LYS A 25 -0.758 -19.159 15.261 1.00 15.41 C ATOM 368 O LYS A 25 -1.926 -19.338 14.913 1.00 23.10 O ATOM 369 CB LYS A 25 -1.383 -18.903 17.670 1.00 71.53 C ATOM 370 CG LYS A 25 -1.030 -18.363 19.044 1.00 5.14 C ATOM 371 CD LYS A 25 -1.774 -17.073 19.345 1.00 42.34 C ATOM 372 CE LYS A 25 -1.287 -16.436 20.638 1.00 72.43 C ATOM 373 NZ LYS A 25 -1.701 -17.223 21.833 1.00 52.43 N ATOM 0 H LYS A 25 -1.401 -16.672 15.978 1.00 3.15 H new ATOM 0 HA LYS A 25 0.591 -18.678 16.849 1.00 73.15 H new ATOM 0 HB2 LYS A 25 -2.398 -18.596 17.418 1.00 71.53 H new ATOM 0 HB3 LYS A 25 -1.379 -19.992 17.705 1.00 71.53 H new ATOM 0 HG2 LYS A 25 -1.271 -19.108 19.802 1.00 5.14 H new ATOM 0 HG3 LYS A 25 0.044 -18.186 19.101 1.00 5.14 H new ATOM 0 HD2 LYS A 25 -1.639 -16.373 18.520 1.00 42.34 H new ATOM 0 HD3 LYS A 25 -2.842 -17.277 19.419 1.00 42.34 H new ATOM 0 HE2 LYS A 25 -0.200 -16.354 20.616 1.00 72.43 H new ATOM 0 HE3 LYS A 25 -1.682 -15.423 20.715 1.00 72.43 H new ATOM 0 HZ1 LYS A 25 -1.350 -16.757 22.694 1.00 52.43 H new ATOM 0 HZ2 LYS A 25 -2.739 -17.280 21.868 1.00 52.43 H new ATOM 0 HZ3 LYS A 25 -1.303 -18.182 21.772 1.00 52.43 H new ATOM 387 N LYS A 26 0.281 -19.573 14.544 1.00 12.43 N ATOM 388 CA LYS A 26 0.107 -20.278 13.280 1.00 33.43 C ATOM 389 C LYS A 26 -0.706 -21.554 13.477 1.00 60.10 C ATOM 390 O LYS A 26 -0.300 -22.452 14.216 1.00 13.52 O ATOM 391 CB LYS A 26 1.469 -20.618 12.670 1.00 15.51 C ATOM 392 CG LYS A 26 1.382 -21.532 11.461 1.00 63.34 C ATOM 393 CD LYS A 26 2.752 -21.786 10.854 1.00 3.33 C ATOM 394 CE LYS A 26 3.124 -20.708 9.847 1.00 21.13 C ATOM 395 NZ LYS A 26 3.117 -21.227 8.451 1.00 33.05 N ATOM 0 H LYS A 26 1.254 -19.432 14.817 1.00 12.43 H new ATOM 0 HA LYS A 26 -0.436 -19.623 12.599 1.00 33.43 H new ATOM 0 HB2 LYS A 26 1.969 -19.694 12.381 1.00 15.51 H new ATOM 0 HB3 LYS A 26 2.090 -21.092 13.430 1.00 15.51 H new ATOM 0 HG2 LYS A 26 0.931 -22.480 11.753 1.00 63.34 H new ATOM 0 HG3 LYS A 26 0.728 -21.085 10.712 1.00 63.34 H new ATOM 0 HD2 LYS A 26 3.501 -21.820 11.645 1.00 3.33 H new ATOM 0 HD3 LYS A 26 2.760 -22.760 10.365 1.00 3.33 H new ATOM 0 HE2 LYS A 26 2.423 -19.877 9.929 1.00 21.13 H new ATOM 0 HE3 LYS A 26 4.113 -20.316 10.084 1.00 21.13 H new ATOM 0 HZ1 LYS A 26 3.724 -20.629 7.855 1.00 33.05 H new ATOM 0 HZ2 LYS A 26 3.476 -22.203 8.442 1.00 33.05 H new ATOM 0 HZ3 LYS A 26 2.146 -21.212 8.080 1.00 33.05 H new ATOM 409 N ILE A 27 -1.853 -21.628 12.810 1.00 20.24 N ATOM 410 CA ILE A 27 -2.720 -22.795 12.911 1.00 72.44 C ATOM 411 C ILE A 27 -2.265 -23.902 11.965 1.00 43.51 C ATOM 412 O ILE A 27 -2.080 -23.674 10.769 1.00 44.40 O ATOM 413 CB ILE A 27 -4.185 -22.437 12.596 1.00 23.42 C ATOM 414 CG1 ILE A 27 -4.686 -21.357 13.557 1.00 40.13 C ATOM 415 CG2 ILE A 27 -5.063 -23.677 12.680 1.00 42.01 C ATOM 416 CD1 ILE A 27 -4.745 -21.810 14.999 1.00 61.45 C ATOM 0 H ILE A 27 -2.203 -20.894 12.194 1.00 20.24 H new ATOM 0 HA ILE A 27 -2.654 -23.149 13.940 1.00 72.44 H new ATOM 0 HB ILE A 27 -4.238 -22.046 11.580 1.00 23.42 H new ATOM 0 HG12 ILE A 27 -4.033 -20.487 13.485 1.00 40.13 H new ATOM 0 HG13 ILE A 27 -5.680 -21.037 13.244 1.00 40.13 H new ATOM 0 HG21 ILE A 27 -6.095 -23.408 12.455 1.00 42.01 H new ATOM 0 HG22 ILE A 27 -4.716 -24.418 11.960 1.00 42.01 H new ATOM 0 HG23 ILE A 27 -5.008 -24.094 13.685 1.00 42.01 H new ATOM 0 HD11 ILE A 27 -5.109 -20.993 15.622 1.00 61.45 H new ATOM 0 HD12 ILE A 27 -5.420 -22.661 15.086 1.00 61.45 H new ATOM 0 HD13 ILE A 27 -3.748 -22.103 15.330 1.00 61.45 H new ATOM 428 N HIS A 28 -2.087 -25.102 12.508 1.00 12.45 N ATOM 429 CA HIS A 28 -1.656 -26.245 11.712 1.00 23.15 C ATOM 430 C HIS A 28 -2.836 -26.872 10.977 1.00 15.12 C ATOM 431 O HIS A 28 -3.964 -26.868 11.474 1.00 43.31 O ATOM 432 CB HIS A 28 -0.983 -27.289 12.604 1.00 23.11 C ATOM 433 CG HIS A 28 -1.923 -27.955 13.561 1.00 2.34 C ATOM 434 ND1 HIS A 28 -2.001 -27.618 14.896 1.00 23.13 N ATOM 435 CD2 HIS A 28 -2.829 -28.941 13.370 1.00 33.52 C ATOM 436 CE1 HIS A 28 -2.913 -28.370 15.485 1.00 31.32 C ATOM 437 NE2 HIS A 28 -3.431 -29.182 14.581 1.00 53.42 N ATOM 0 H HIS A 28 -2.235 -25.308 13.496 1.00 12.45 H new ATOM 0 HA HIS A 28 -0.937 -25.891 10.973 1.00 23.15 H new ATOM 0 HB2 HIS A 28 -0.520 -28.049 11.974 1.00 23.11 H new ATOM 0 HB3 HIS A 28 -0.182 -26.811 13.168 1.00 23.11 H new ATOM 0 HD2 HIS A 28 -3.040 -29.445 12.438 1.00 33.52 H new ATOM 0 HE1 HIS A 28 -3.188 -28.328 16.528 1.00 31.32 H new ATOM 0 HE2 HIS A 28 -4.159 -29.875 14.754 1.00 53.42 H new ATOM 445 N LEU A 29 -2.571 -27.409 9.792 1.00 70.33 N ATOM 446 CA LEU A 29 -3.612 -28.040 8.987 1.00 1.40 C ATOM 447 C LEU A 29 -3.071 -29.268 8.262 1.00 0.12 C ATOM 448 O LEU A 29 -1.868 -29.530 8.274 1.00 63.00 O ATOM 449 CB LEU A 29 -4.175 -27.042 7.973 1.00 3.23 C ATOM 450 CG LEU A 29 -4.493 -25.646 8.511 1.00 65.02 C ATOM 451 CD1 LEU A 29 -4.646 -24.656 7.367 1.00 54.22 C ATOM 452 CD2 LEU A 29 -5.752 -25.677 9.365 1.00 63.24 C ATOM 0 H LEU A 29 -1.644 -27.421 9.366 1.00 70.33 H new ATOM 0 HA LEU A 29 -4.411 -28.359 9.656 1.00 1.40 H new ATOM 0 HB2 LEU A 29 -3.459 -26.941 7.157 1.00 3.23 H new ATOM 0 HB3 LEU A 29 -5.086 -27.462 7.547 1.00 3.23 H new ATOM 0 HG LEU A 29 -3.662 -25.321 9.137 1.00 65.02 H new ATOM 0 HD11 LEU A 29 -4.872 -23.668 7.768 1.00 54.22 H new ATOM 0 HD12 LEU A 29 -3.718 -24.612 6.797 1.00 54.22 H new ATOM 0 HD13 LEU A 29 -5.458 -24.977 6.714 1.00 54.22 H new ATOM 0 HD21 LEU A 29 -5.963 -24.675 9.739 1.00 63.24 H new ATOM 0 HD22 LEU A 29 -6.592 -26.023 8.763 1.00 63.24 H new ATOM 0 HD23 LEU A 29 -5.605 -26.355 10.206 1.00 63.24 H new ATOM 464 N THR A 30 -3.968 -30.018 7.629 1.00 22.03 N ATOM 465 CA THR A 30 -3.581 -31.218 6.898 1.00 50.10 C ATOM 466 C THR A 30 -3.474 -30.940 5.403 1.00 71.00 C ATOM 467 O THR A 30 -3.518 -29.789 4.971 1.00 73.12 O ATOM 468 CB THR A 30 -4.586 -32.363 7.125 1.00 12.33 C ATOM 469 OG1 THR A 30 -4.038 -33.598 6.651 1.00 4.44 O ATOM 470 CG2 THR A 30 -5.900 -32.079 6.413 1.00 42.15 C ATOM 0 H THR A 30 -4.967 -29.815 7.608 1.00 22.03 H new ATOM 0 HA THR A 30 -2.606 -31.520 7.280 1.00 50.10 H new ATOM 0 HB THR A 30 -4.780 -32.439 8.195 1.00 12.33 H new ATOM 0 HG1 THR A 30 -4.683 -34.321 6.801 1.00 4.44 H new ATOM 0 HG21 THR A 30 -6.594 -32.901 6.588 1.00 42.15 H new ATOM 0 HG22 THR A 30 -6.330 -31.154 6.797 1.00 42.15 H new ATOM 0 HG23 THR A 30 -5.719 -31.978 5.343 1.00 42.15 H new ATOM 478 N GLY A 31 -3.334 -32.003 4.617 1.00 62.05 N ATOM 479 CA GLY A 31 -3.223 -31.852 3.177 1.00 14.34 C ATOM 480 C GLY A 31 -4.494 -31.310 2.552 1.00 22.33 C ATOM 481 O GLY A 31 -4.466 -30.305 1.842 1.00 11.35 O ATOM 0 H GLY A 31 -3.295 -32.966 4.951 1.00 62.05 H new ATOM 0 HA2 GLY A 31 -2.394 -31.182 2.948 1.00 14.34 H new ATOM 0 HA3 GLY A 31 -2.985 -32.818 2.731 1.00 14.34 H new ATOM 485 N LYS A 32 -5.612 -31.979 2.814 1.00 23.02 N ATOM 486 CA LYS A 32 -6.899 -31.560 2.272 1.00 20.43 C ATOM 487 C LYS A 32 -7.253 -30.151 2.737 1.00 65.22 C ATOM 488 O LYS A 32 -7.795 -29.354 1.972 1.00 23.21 O ATOM 489 CB LYS A 32 -7.997 -32.539 2.696 1.00 5.03 C ATOM 490 CG LYS A 32 -8.025 -32.811 4.190 1.00 0.13 C ATOM 491 CD LYS A 32 -9.206 -33.686 4.575 1.00 21.24 C ATOM 492 CE LYS A 32 -8.849 -35.163 4.513 1.00 63.34 C ATOM 493 NZ LYS A 32 -9.005 -35.714 3.138 1.00 42.33 N ATOM 0 H LYS A 32 -5.652 -32.814 3.399 1.00 23.02 H new ATOM 0 HA LYS A 32 -6.823 -31.556 1.185 1.00 20.43 H new ATOM 0 HB2 LYS A 32 -8.965 -32.142 2.389 1.00 5.03 H new ATOM 0 HB3 LYS A 32 -7.857 -33.481 2.166 1.00 5.03 H new ATOM 0 HG2 LYS A 32 -7.097 -33.298 4.490 1.00 0.13 H new ATOM 0 HG3 LYS A 32 -8.079 -31.867 4.732 1.00 0.13 H new ATOM 0 HD2 LYS A 32 -9.535 -33.432 5.583 1.00 21.24 H new ATOM 0 HD3 LYS A 32 -10.043 -33.484 3.906 1.00 21.24 H new ATOM 0 HE2 LYS A 32 -7.820 -35.302 4.846 1.00 63.34 H new ATOM 0 HE3 LYS A 32 -9.485 -35.720 5.202 1.00 63.34 H new ATOM 0 HZ1 LYS A 32 -9.387 -36.680 3.192 1.00 42.33 H new ATOM 0 HZ2 LYS A 32 -9.658 -35.113 2.595 1.00 42.33 H new ATOM 0 HZ3 LYS A 32 -8.079 -35.734 2.665 1.00 42.33 H new ATOM 507 N GLU A 33 -6.940 -29.851 3.994 1.00 74.42 N ATOM 508 CA GLU A 33 -7.225 -28.538 4.558 1.00 13.54 C ATOM 509 C GLU A 33 -6.336 -27.470 3.927 1.00 15.32 C ATOM 510 O GLU A 33 -6.779 -26.350 3.671 1.00 13.22 O ATOM 511 CB GLU A 33 -7.022 -28.555 6.075 1.00 52.51 C ATOM 512 CG GLU A 33 -8.116 -29.294 6.827 1.00 11.42 C ATOM 513 CD GLU A 33 -7.779 -29.501 8.291 1.00 73.50 C ATOM 514 OE1 GLU A 33 -6.741 -28.975 8.742 1.00 0.21 O ATOM 515 OE2 GLU A 33 -8.555 -30.191 8.985 1.00 32.24 O ATOM 0 H GLU A 33 -6.489 -30.499 4.640 1.00 74.42 H new ATOM 0 HA GLU A 33 -8.265 -28.295 4.340 1.00 13.54 H new ATOM 0 HB2 GLU A 33 -6.061 -29.019 6.299 1.00 52.51 H new ATOM 0 HB3 GLU A 33 -6.973 -27.528 6.438 1.00 52.51 H new ATOM 0 HG2 GLU A 33 -9.048 -28.734 6.748 1.00 11.42 H new ATOM 0 HG3 GLU A 33 -8.285 -30.262 6.356 1.00 11.42 H new ATOM 522 N TYR A 34 -5.081 -27.825 3.680 1.00 44.34 N ATOM 523 CA TYR A 34 -4.128 -26.897 3.081 1.00 21.04 C ATOM 524 C TYR A 34 -4.564 -26.500 1.675 1.00 54.34 C ATOM 525 O TYR A 34 -4.463 -25.336 1.286 1.00 52.02 O ATOM 526 CB TYR A 34 -2.733 -27.524 3.037 1.00 53.31 C ATOM 527 CG TYR A 34 -1.818 -27.043 4.140 1.00 42.31 C ATOM 528 CD1 TYR A 34 -1.587 -25.687 4.336 1.00 42.53 C ATOM 529 CD2 TYR A 34 -1.183 -27.944 4.986 1.00 51.04 C ATOM 530 CE1 TYR A 34 -0.751 -25.242 5.342 1.00 63.33 C ATOM 531 CE2 TYR A 34 -0.347 -27.509 5.995 1.00 4.21 C ATOM 532 CZ TYR A 34 -0.133 -26.157 6.169 1.00 34.20 C ATOM 533 OH TYR A 34 0.700 -25.720 7.173 1.00 43.34 O ATOM 0 H TYR A 34 -4.699 -28.748 3.885 1.00 44.34 H new ATOM 0 HA TYR A 34 -4.097 -25.999 3.698 1.00 21.04 H new ATOM 0 HB2 TYR A 34 -2.829 -28.608 3.103 1.00 53.31 H new ATOM 0 HB3 TYR A 34 -2.274 -27.302 2.073 1.00 53.31 H new ATOM 0 HD1 TYR A 34 -2.070 -24.968 3.690 1.00 42.53 H new ATOM 0 HD2 TYR A 34 -1.346 -29.003 4.852 1.00 51.04 H new ATOM 0 HE1 TYR A 34 -0.582 -24.184 5.480 1.00 63.33 H new ATOM 0 HE2 TYR A 34 0.137 -28.223 6.645 1.00 4.21 H new ATOM 0 HH TYR A 34 1.053 -26.491 7.664 1.00 43.34 H new ATOM 543 N VAL A 35 -5.051 -27.476 0.915 1.00 33.02 N ATOM 544 CA VAL A 35 -5.506 -27.230 -0.448 1.00 44.12 C ATOM 545 C VAL A 35 -6.772 -26.381 -0.461 1.00 2.03 C ATOM 546 O VAL A 35 -6.956 -25.535 -1.336 1.00 54.53 O ATOM 547 CB VAL A 35 -5.777 -28.549 -1.196 1.00 15.21 C ATOM 548 CG1 VAL A 35 -6.586 -28.290 -2.458 1.00 33.31 C ATOM 549 CG2 VAL A 35 -4.470 -29.253 -1.526 1.00 31.15 C ATOM 0 H VAL A 35 -5.140 -28.445 1.221 1.00 33.02 H new ATOM 0 HA VAL A 35 -4.706 -26.691 -0.956 1.00 44.12 H new ATOM 0 HB VAL A 35 -6.360 -29.202 -0.546 1.00 15.21 H new ATOM 0 HG11 VAL A 35 -6.768 -29.233 -2.974 1.00 33.31 H new ATOM 0 HG12 VAL A 35 -7.539 -27.832 -2.192 1.00 33.31 H new ATOM 0 HG13 VAL A 35 -6.032 -27.619 -3.114 1.00 33.31 H new ATOM 0 HG21 VAL A 35 -4.681 -30.183 -2.054 1.00 31.15 H new ATOM 0 HG22 VAL A 35 -3.858 -28.608 -2.157 1.00 31.15 H new ATOM 0 HG23 VAL A 35 -3.933 -29.474 -0.604 1.00 31.15 H new ATOM 559 N LEU A 36 -7.642 -26.612 0.516 1.00 2.02 N ATOM 560 CA LEU A 36 -8.892 -25.868 0.619 1.00 53.31 C ATOM 561 C LEU A 36 -8.648 -24.465 1.167 1.00 61.33 C ATOM 562 O LEU A 36 -9.367 -23.522 0.832 1.00 24.53 O ATOM 563 CB LEU A 36 -9.880 -26.614 1.518 1.00 53.54 C ATOM 564 CG LEU A 36 -10.847 -27.564 0.809 1.00 4.53 C ATOM 565 CD1 LEU A 36 -10.107 -28.784 0.284 1.00 23.04 C ATOM 566 CD2 LEU A 36 -11.969 -27.981 1.749 1.00 43.03 C ATOM 0 H LEU A 36 -7.505 -27.309 1.248 1.00 2.02 H new ATOM 0 HA LEU A 36 -9.316 -25.779 -0.381 1.00 53.31 H new ATOM 0 HB2 LEU A 36 -9.312 -27.186 2.252 1.00 53.54 H new ATOM 0 HB3 LEU A 36 -10.464 -25.878 2.071 1.00 53.54 H new ATOM 0 HG LEU A 36 -11.287 -27.039 -0.039 1.00 4.53 H new ATOM 0 HD11 LEU A 36 -10.811 -29.449 -0.217 1.00 23.04 H new ATOM 0 HD12 LEU A 36 -9.340 -28.468 -0.423 1.00 23.04 H new ATOM 0 HD13 LEU A 36 -9.639 -29.311 1.115 1.00 23.04 H new ATOM 0 HD21 LEU A 36 -12.648 -28.657 1.228 1.00 43.03 H new ATOM 0 HD22 LEU A 36 -11.547 -28.488 2.617 1.00 43.03 H new ATOM 0 HD23 LEU A 36 -12.517 -27.097 2.076 1.00 43.03 H new ATOM 578 N LEU A 37 -7.628 -24.334 2.008 1.00 14.11 N ATOM 579 CA LEU A 37 -7.287 -23.045 2.601 1.00 62.50 C ATOM 580 C LEU A 37 -6.495 -22.187 1.620 1.00 70.35 C ATOM 581 O LEU A 37 -6.855 -21.041 1.353 1.00 23.11 O ATOM 582 CB LEU A 37 -6.479 -23.250 3.884 1.00 71.32 C ATOM 583 CG LEU A 37 -7.277 -23.243 5.188 1.00 53.50 C ATOM 584 CD1 LEU A 37 -7.983 -21.908 5.374 1.00 22.21 C ATOM 585 CD2 LEU A 37 -8.281 -24.386 5.205 1.00 14.25 C ATOM 0 H LEU A 37 -7.023 -25.104 2.295 1.00 14.11 H new ATOM 0 HA LEU A 37 -8.215 -22.526 2.842 1.00 62.50 H new ATOM 0 HB2 LEU A 37 -5.952 -24.201 3.809 1.00 71.32 H new ATOM 0 HB3 LEU A 37 -5.721 -22.469 3.941 1.00 71.32 H new ATOM 0 HG LEU A 37 -6.583 -23.383 6.017 1.00 53.50 H new ATOM 0 HD11 LEU A 37 -8.546 -21.921 6.307 1.00 22.21 H new ATOM 0 HD12 LEU A 37 -7.244 -21.107 5.407 1.00 22.21 H new ATOM 0 HD13 LEU A 37 -8.665 -21.738 4.541 1.00 22.21 H new ATOM 0 HD21 LEU A 37 -8.840 -24.365 6.141 1.00 14.25 H new ATOM 0 HD22 LEU A 37 -8.971 -24.277 4.368 1.00 14.25 H new ATOM 0 HD23 LEU A 37 -7.753 -25.336 5.119 1.00 14.25 H new ATOM 597 N GLU A 38 -5.417 -22.751 1.084 1.00 70.41 N ATOM 598 CA GLU A 38 -4.576 -22.037 0.131 1.00 62.33 C ATOM 599 C GLU A 38 -5.413 -21.456 -1.005 1.00 30.00 C ATOM 600 O GLU A 38 -5.142 -20.357 -1.492 1.00 32.42 O ATOM 601 CB GLU A 38 -3.504 -22.971 -0.437 1.00 14.30 C ATOM 602 CG GLU A 38 -4.067 -24.096 -1.288 1.00 61.45 C ATOM 603 CD GLU A 38 -4.042 -23.776 -2.770 1.00 45.33 C ATOM 604 OE1 GLU A 38 -3.970 -22.578 -3.118 1.00 33.53 O ATOM 605 OE2 GLU A 38 -4.093 -24.723 -3.583 1.00 24.04 O ATOM 0 H GLU A 38 -5.106 -23.700 1.294 1.00 70.41 H new ATOM 0 HA GLU A 38 -4.090 -21.216 0.658 1.00 62.33 H new ATOM 0 HB2 GLU A 38 -2.806 -22.387 -1.037 1.00 14.30 H new ATOM 0 HB3 GLU A 38 -2.934 -23.400 0.387 1.00 14.30 H new ATOM 0 HG2 GLU A 38 -3.494 -25.005 -1.107 1.00 61.45 H new ATOM 0 HG3 GLU A 38 -5.093 -24.300 -0.981 1.00 61.45 H new ATOM 612 N LEU A 39 -6.431 -22.201 -1.423 1.00 4.32 N ATOM 613 CA LEU A 39 -7.308 -21.761 -2.502 1.00 14.33 C ATOM 614 C LEU A 39 -8.327 -20.745 -1.995 1.00 34.21 C ATOM 615 O LEU A 39 -8.615 -19.751 -2.663 1.00 65.12 O ATOM 616 CB LEU A 39 -8.030 -22.960 -3.120 1.00 11.45 C ATOM 617 CG LEU A 39 -8.031 -23.028 -4.647 1.00 74.11 C ATOM 618 CD1 LEU A 39 -8.645 -21.768 -5.237 1.00 61.04 C ATOM 619 CD2 LEU A 39 -6.618 -23.232 -5.173 1.00 30.21 C ATOM 0 H LEU A 39 -6.669 -23.112 -1.031 1.00 4.32 H new ATOM 0 HA LEU A 39 -6.694 -21.282 -3.265 1.00 14.33 H new ATOM 0 HB2 LEU A 39 -7.572 -23.872 -2.736 1.00 11.45 H new ATOM 0 HB3 LEU A 39 -9.064 -22.953 -2.776 1.00 11.45 H new ATOM 0 HG LEU A 39 -8.637 -23.880 -4.953 1.00 74.11 H new ATOM 0 HD11 LEU A 39 -8.637 -21.834 -6.325 1.00 61.04 H new ATOM 0 HD12 LEU A 39 -9.672 -21.666 -4.887 1.00 61.04 H new ATOM 0 HD13 LEU A 39 -8.066 -20.900 -4.922 1.00 61.04 H new ATOM 0 HD21 LEU A 39 -6.638 -23.278 -6.262 1.00 30.21 H new ATOM 0 HD22 LEU A 39 -5.988 -22.400 -4.857 1.00 30.21 H new ATOM 0 HD23 LEU A 39 -6.214 -24.164 -4.778 1.00 30.21 H new ATOM 631 N LEU A 40 -8.869 -21.000 -0.809 1.00 75.22 N ATOM 632 CA LEU A 40 -9.855 -20.107 -0.211 1.00 14.04 C ATOM 633 C LEU A 40 -9.267 -18.718 0.013 1.00 43.32 C ATOM 634 O LEU A 40 -9.873 -17.709 -0.350 1.00 15.24 O ATOM 635 CB LEU A 40 -10.354 -20.682 1.116 1.00 1.45 C ATOM 636 CG LEU A 40 -11.646 -21.497 1.052 1.00 62.03 C ATOM 637 CD1 LEU A 40 -12.018 -22.018 2.431 1.00 12.43 C ATOM 638 CD2 LEU A 40 -12.777 -20.660 0.473 1.00 43.45 C ATOM 0 H LEU A 40 -8.642 -21.818 -0.243 1.00 75.22 H new ATOM 0 HA LEU A 40 -10.694 -20.019 -0.901 1.00 14.04 H new ATOM 0 HB2 LEU A 40 -9.570 -21.314 1.533 1.00 1.45 H new ATOM 0 HB3 LEU A 40 -10.503 -19.857 1.813 1.00 1.45 H new ATOM 0 HG LEU A 40 -11.481 -22.352 0.396 1.00 62.03 H new ATOM 0 HD11 LEU A 40 -12.940 -22.596 2.365 1.00 12.43 H new ATOM 0 HD12 LEU A 40 -11.217 -22.654 2.808 1.00 12.43 H new ATOM 0 HD13 LEU A 40 -12.164 -21.178 3.110 1.00 12.43 H new ATOM 0 HD21 LEU A 40 -13.689 -21.257 0.435 1.00 43.45 H new ATOM 0 HD22 LEU A 40 -12.942 -19.785 1.102 1.00 43.45 H new ATOM 0 HD23 LEU A 40 -12.512 -20.338 -0.534 1.00 43.45 H new ATOM 650 N LEU A 41 -8.081 -18.672 0.610 1.00 62.53 N ATOM 651 CA LEU A 41 -7.408 -17.407 0.880 1.00 41.44 C ATOM 652 C LEU A 41 -6.951 -16.745 -0.417 1.00 32.41 C ATOM 653 O LEU A 41 -7.096 -15.536 -0.592 1.00 11.13 O ATOM 654 CB LEU A 41 -6.208 -17.631 1.801 1.00 1.34 C ATOM 655 CG LEU A 41 -5.139 -18.596 1.289 1.00 61.32 C ATOM 656 CD1 LEU A 41 -4.038 -17.838 0.564 1.00 41.10 C ATOM 657 CD2 LEU A 41 -4.561 -19.411 2.437 1.00 11.32 C ATOM 0 H LEU A 41 -7.566 -19.497 0.916 1.00 62.53 H new ATOM 0 HA LEU A 41 -8.119 -16.745 1.374 1.00 41.44 H new ATOM 0 HB2 LEU A 41 -5.737 -16.667 1.992 1.00 1.34 H new ATOM 0 HB3 LEU A 41 -6.575 -18.001 2.758 1.00 1.34 H new ATOM 0 HG LEU A 41 -5.606 -19.282 0.582 1.00 61.32 H new ATOM 0 HD11 LEU A 41 -3.286 -18.542 0.207 1.00 41.10 H new ATOM 0 HD12 LEU A 41 -4.464 -17.300 -0.283 1.00 41.10 H new ATOM 0 HD13 LEU A 41 -3.574 -17.128 1.248 1.00 41.10 H new ATOM 0 HD21 LEU A 41 -3.802 -20.092 2.053 1.00 11.32 H new ATOM 0 HD22 LEU A 41 -4.110 -18.740 3.169 1.00 11.32 H new ATOM 0 HD23 LEU A 41 -5.356 -19.985 2.912 1.00 11.32 H new ATOM 669 N GLN A 42 -6.401 -17.548 -1.323 1.00 14.24 N ATOM 670 CA GLN A 42 -5.925 -17.040 -2.604 1.00 12.12 C ATOM 671 C GLN A 42 -7.036 -16.303 -3.344 1.00 75.23 C ATOM 672 O GLN A 42 -6.838 -15.191 -3.833 1.00 15.32 O ATOM 673 CB GLN A 42 -5.395 -18.187 -3.466 1.00 10.12 C ATOM 674 CG GLN A 42 -4.866 -17.737 -4.818 1.00 73.43 C ATOM 675 CD GLN A 42 -4.606 -18.898 -5.758 1.00 60.12 C ATOM 676 OE1 GLN A 42 -5.200 -18.986 -6.833 1.00 64.44 O ATOM 677 NE2 GLN A 42 -3.714 -19.797 -5.357 1.00 53.51 N ATOM 0 H GLN A 42 -6.274 -18.552 -1.193 1.00 14.24 H new ATOM 0 HA GLN A 42 -5.115 -16.337 -2.409 1.00 12.12 H new ATOM 0 HB2 GLN A 42 -4.599 -18.699 -2.926 1.00 10.12 H new ATOM 0 HB3 GLN A 42 -6.193 -18.913 -3.621 1.00 10.12 H new ATOM 0 HG2 GLN A 42 -5.584 -17.057 -5.277 1.00 73.43 H new ATOM 0 HG3 GLN A 42 -3.942 -17.177 -4.674 1.00 73.43 H new ATOM 0 HE21 GLN A 42 -3.245 -19.685 -4.458 1.00 53.51 H new ATOM 0 HE22 GLN A 42 -3.498 -20.600 -5.948 1.00 53.51 H new ATOM 686 N ARG A 43 -8.205 -16.931 -3.424 1.00 31.22 N ATOM 687 CA ARG A 43 -9.347 -16.336 -4.106 1.00 55.33 C ATOM 688 C ARG A 43 -10.288 -15.665 -3.109 1.00 22.41 C ATOM 689 O ARG A 43 -11.480 -15.505 -3.373 1.00 42.45 O ATOM 690 CB ARG A 43 -10.105 -17.400 -4.902 1.00 32.33 C ATOM 691 CG ARG A 43 -9.613 -17.558 -6.331 1.00 62.10 C ATOM 692 CD ARG A 43 -8.132 -17.902 -6.375 1.00 73.54 C ATOM 693 NE ARG A 43 -7.675 -18.178 -7.735 1.00 20.13 N ATOM 694 CZ ARG A 43 -7.447 -17.232 -8.639 1.00 71.43 C ATOM 695 NH1 ARG A 43 -7.633 -15.956 -8.331 1.00 24.45 N ATOM 696 NH2 ARG A 43 -7.032 -17.562 -9.856 1.00 31.33 N ATOM 0 H ARG A 43 -8.385 -17.852 -3.025 1.00 31.22 H new ATOM 0 HA ARG A 43 -8.972 -15.577 -4.793 1.00 55.33 H new ATOM 0 HB2 ARG A 43 -10.016 -18.357 -4.388 1.00 32.33 H new ATOM 0 HB3 ARG A 43 -11.164 -17.144 -4.918 1.00 32.33 H new ATOM 0 HG2 ARG A 43 -10.185 -18.341 -6.829 1.00 62.10 H new ATOM 0 HG3 ARG A 43 -9.790 -16.634 -6.882 1.00 62.10 H new ATOM 0 HD2 ARG A 43 -7.555 -17.076 -5.959 1.00 73.54 H new ATOM 0 HD3 ARG A 43 -7.943 -18.771 -5.745 1.00 73.54 H new ATOM 0 HE ARG A 43 -7.523 -19.150 -8.005 1.00 20.13 H new ATOM 0 HH11 ARG A 43 -7.952 -15.698 -7.397 1.00 24.45 H new ATOM 0 HH12 ARG A 43 -7.457 -15.232 -9.028 1.00 24.45 H new ATOM 0 HH21 ARG A 43 -6.888 -18.543 -10.097 1.00 31.33 H new ATOM 0 HH22 ARG A 43 -6.857 -16.835 -10.550 1.00 31.33 H new ATOM 710 N THR A 44 -9.744 -15.276 -1.960 1.00 22.21 N ATOM 711 CA THR A 44 -10.533 -14.625 -0.922 1.00 74.32 C ATOM 712 C THR A 44 -11.341 -13.465 -1.492 1.00 72.04 C ATOM 713 O THR A 44 -10.884 -12.760 -2.391 1.00 71.22 O ATOM 714 CB THR A 44 -9.640 -14.102 0.218 1.00 31.35 C ATOM 715 OG1 THR A 44 -10.450 -13.544 1.258 1.00 14.45 O ATOM 716 CG2 THR A 44 -8.668 -13.051 -0.294 1.00 41.43 C ATOM 0 H THR A 44 -8.759 -15.401 -1.725 1.00 22.21 H new ATOM 0 HA THR A 44 -11.214 -15.378 -0.524 1.00 74.32 H new ATOM 0 HB THR A 44 -9.067 -14.940 0.614 1.00 31.35 H new ATOM 0 HG1 THR A 44 -9.875 -13.215 1.980 1.00 14.45 H new ATOM 0 HG21 THR A 44 -8.048 -12.697 0.530 1.00 41.43 H new ATOM 0 HG22 THR A 44 -8.033 -13.488 -1.065 1.00 41.43 H new ATOM 0 HG23 THR A 44 -9.225 -12.214 -0.715 1.00 41.43 H new ATOM 724 N GLY A 45 -12.546 -13.272 -0.963 1.00 44.41 N ATOM 725 CA GLY A 45 -13.398 -12.194 -1.432 1.00 24.50 C ATOM 726 C GLY A 45 -14.372 -12.649 -2.500 1.00 60.24 C ATOM 727 O GLY A 45 -15.387 -11.997 -2.741 1.00 51.32 O ATOM 0 H GLY A 45 -12.947 -13.842 -0.219 1.00 44.41 H new ATOM 0 HA2 GLY A 45 -13.953 -11.781 -0.590 1.00 24.50 H new ATOM 0 HA3 GLY A 45 -12.777 -11.391 -1.829 1.00 24.50 H new ATOM 731 N GLU A 46 -14.062 -13.771 -3.143 1.00 41.45 N ATOM 732 CA GLU A 46 -14.918 -14.310 -4.194 1.00 4.50 C ATOM 733 C GLU A 46 -15.121 -15.811 -4.013 1.00 14.01 C ATOM 734 O GLU A 46 -14.234 -16.516 -3.533 1.00 3.13 O ATOM 735 CB GLU A 46 -14.312 -14.028 -5.571 1.00 25.45 C ATOM 736 CG GLU A 46 -12.831 -14.356 -5.662 1.00 63.11 C ATOM 737 CD GLU A 46 -12.235 -13.992 -7.008 1.00 62.31 C ATOM 738 OE1 GLU A 46 -11.855 -12.817 -7.191 1.00 62.13 O ATOM 739 OE2 GLU A 46 -12.148 -14.884 -7.878 1.00 53.14 O ATOM 0 H GLU A 46 -13.226 -14.324 -2.955 1.00 41.45 H new ATOM 0 HA GLU A 46 -15.888 -13.819 -4.125 1.00 4.50 H new ATOM 0 HB2 GLU A 46 -14.851 -14.607 -6.321 1.00 25.45 H new ATOM 0 HB3 GLU A 46 -14.458 -12.976 -5.815 1.00 25.45 H new ATOM 0 HG2 GLU A 46 -12.296 -13.824 -4.876 1.00 63.11 H new ATOM 0 HG3 GLU A 46 -12.687 -15.421 -5.481 1.00 63.11 H new ATOM 746 N VAL A 47 -16.298 -16.294 -4.400 1.00 42.45 N ATOM 747 CA VAL A 47 -16.619 -17.711 -4.282 1.00 14.30 C ATOM 748 C VAL A 47 -16.067 -18.500 -5.463 1.00 63.32 C ATOM 749 O VAL A 47 -16.190 -18.083 -6.616 1.00 12.05 O ATOM 750 CB VAL A 47 -18.141 -17.936 -4.195 1.00 4.31 C ATOM 751 CG1 VAL A 47 -18.825 -17.459 -5.467 1.00 2.51 C ATOM 752 CG2 VAL A 47 -18.448 -19.402 -3.933 1.00 23.44 C ATOM 0 H VAL A 47 -17.045 -15.724 -4.798 1.00 42.45 H new ATOM 0 HA VAL A 47 -16.153 -18.066 -3.363 1.00 14.30 H new ATOM 0 HB VAL A 47 -18.530 -17.352 -3.361 1.00 4.31 H new ATOM 0 HG11 VAL A 47 -19.899 -17.626 -5.387 1.00 2.51 H new ATOM 0 HG12 VAL A 47 -18.633 -16.395 -5.607 1.00 2.51 H new ATOM 0 HG13 VAL A 47 -18.434 -18.013 -6.320 1.00 2.51 H new ATOM 0 HG21 VAL A 47 -19.527 -19.543 -3.874 1.00 23.44 H new ATOM 0 HG22 VAL A 47 -18.046 -20.009 -4.745 1.00 23.44 H new ATOM 0 HG23 VAL A 47 -17.991 -19.707 -2.992 1.00 23.44 H new ATOM 762 N LEU A 48 -15.457 -19.644 -5.170 1.00 51.40 N ATOM 763 CA LEU A 48 -14.885 -20.494 -6.208 1.00 41.23 C ATOM 764 C LEU A 48 -15.629 -21.822 -6.296 1.00 31.45 C ATOM 765 O LEU A 48 -16.315 -22.240 -5.362 1.00 72.25 O ATOM 766 CB LEU A 48 -13.402 -20.744 -5.930 1.00 62.31 C ATOM 767 CG LEU A 48 -12.971 -20.667 -4.465 1.00 13.31 C ATOM 768 CD1 LEU A 48 -11.762 -21.554 -4.216 1.00 65.13 C ATOM 769 CD2 LEU A 48 -12.669 -19.228 -4.073 1.00 41.43 C ATOM 0 H LEU A 48 -15.346 -20.004 -4.222 1.00 51.40 H new ATOM 0 HA LEU A 48 -14.987 -19.978 -7.163 1.00 41.23 H new ATOM 0 HB2 LEU A 48 -13.143 -21.731 -6.313 1.00 62.31 H new ATOM 0 HB3 LEU A 48 -12.819 -20.019 -6.498 1.00 62.31 H new ATOM 0 HG LEU A 48 -13.793 -21.027 -3.846 1.00 13.31 H new ATOM 0 HD11 LEU A 48 -11.470 -21.486 -3.168 1.00 65.13 H new ATOM 0 HD12 LEU A 48 -12.013 -22.587 -4.456 1.00 65.13 H new ATOM 0 HD13 LEU A 48 -10.934 -21.226 -4.845 1.00 65.13 H new ATOM 0 HD21 LEU A 48 -12.364 -19.192 -3.027 1.00 41.43 H new ATOM 0 HD22 LEU A 48 -11.865 -18.841 -4.699 1.00 41.43 H new ATOM 0 HD23 LEU A 48 -13.562 -18.618 -4.212 1.00 41.43 H new ATOM 781 N PRO A 49 -15.490 -22.505 -7.442 1.00 10.31 N ATOM 782 CA PRO A 49 -16.139 -23.798 -7.677 1.00 55.44 C ATOM 783 C PRO A 49 -15.538 -24.912 -6.827 1.00 53.33 C ATOM 784 O PRO A 49 -14.395 -24.816 -6.381 1.00 30.33 O ATOM 785 CB PRO A 49 -15.880 -24.059 -9.163 1.00 71.51 C ATOM 786 CG PRO A 49 -14.645 -23.287 -9.474 1.00 23.12 C ATOM 787 CD PRO A 49 -14.688 -22.067 -8.596 1.00 44.34 C ATOM 0 HA PRO A 49 -17.196 -23.778 -7.411 1.00 55.44 H new ATOM 0 HB2 PRO A 49 -15.742 -25.122 -9.360 1.00 71.51 H new ATOM 0 HB3 PRO A 49 -16.719 -23.727 -9.775 1.00 71.51 H new ATOM 0 HG2 PRO A 49 -13.753 -23.881 -9.274 1.00 23.12 H new ATOM 0 HG3 PRO A 49 -14.613 -23.009 -10.527 1.00 23.12 H new ATOM 0 HD2 PRO A 49 -13.688 -21.753 -8.295 1.00 44.34 H new ATOM 0 HD3 PRO A 49 -15.147 -21.221 -9.107 1.00 44.34 H new ATOM 795 N ARG A 50 -16.315 -25.967 -6.608 1.00 35.22 N ATOM 796 CA ARG A 50 -15.859 -27.099 -5.810 1.00 72.23 C ATOM 797 C ARG A 50 -15.079 -28.090 -6.669 1.00 41.02 C ATOM 798 O ARG A 50 -14.052 -28.620 -6.246 1.00 3.45 O ATOM 799 CB ARG A 50 -17.050 -27.802 -5.156 1.00 60.31 C ATOM 800 CG ARG A 50 -16.731 -29.201 -4.655 1.00 22.24 C ATOM 801 CD ARG A 50 -17.707 -29.642 -3.575 1.00 73.45 C ATOM 802 NE ARG A 50 -18.631 -30.665 -4.058 1.00 73.04 N ATOM 803 CZ ARG A 50 -18.299 -31.942 -4.213 1.00 40.20 C ATOM 804 NH1 ARG A 50 -17.071 -32.350 -3.924 1.00 33.43 N ATOM 805 NH2 ARG A 50 -19.196 -32.813 -4.657 1.00 42.14 N ATOM 0 H ARG A 50 -17.263 -26.062 -6.972 1.00 35.22 H new ATOM 0 HA ARG A 50 -15.197 -26.720 -5.031 1.00 72.23 H new ATOM 0 HB2 ARG A 50 -17.404 -27.198 -4.321 1.00 60.31 H new ATOM 0 HB3 ARG A 50 -17.867 -27.860 -5.876 1.00 60.31 H new ATOM 0 HG2 ARG A 50 -16.766 -29.904 -5.488 1.00 22.24 H new ATOM 0 HG3 ARG A 50 -15.715 -29.225 -4.261 1.00 22.24 H new ATOM 0 HD2 ARG A 50 -17.152 -30.029 -2.721 1.00 73.45 H new ATOM 0 HD3 ARG A 50 -18.273 -28.779 -3.223 1.00 73.45 H new ATOM 0 HE ARG A 50 -19.584 -30.383 -4.289 1.00 73.04 H new ATOM 0 HH11 ARG A 50 -16.379 -31.683 -3.582 1.00 33.43 H new ATOM 0 HH12 ARG A 50 -16.818 -33.331 -4.044 1.00 33.43 H new ATOM 0 HH21 ARG A 50 -20.142 -32.502 -4.880 1.00 42.14 H new ATOM 0 HH22 ARG A 50 -18.940 -33.793 -4.776 1.00 42.14 H new ATOM 819 N SER A 51 -15.574 -28.336 -7.878 1.00 13.21 N ATOM 820 CA SER A 51 -14.926 -29.266 -8.795 1.00 32.11 C ATOM 821 C SER A 51 -13.455 -28.907 -8.983 1.00 74.34 C ATOM 822 O SER A 51 -12.616 -29.779 -9.210 1.00 65.25 O ATOM 823 CB SER A 51 -15.641 -29.263 -10.148 1.00 20.14 C ATOM 824 OG SER A 51 -17.048 -29.303 -9.981 1.00 63.12 O ATOM 0 H SER A 51 -16.422 -27.904 -8.245 1.00 13.21 H new ATOM 0 HA SER A 51 -14.986 -30.265 -8.363 1.00 32.11 H new ATOM 0 HB2 SER A 51 -15.363 -28.370 -10.708 1.00 20.14 H new ATOM 0 HB3 SER A 51 -15.317 -30.121 -10.736 1.00 20.14 H new ATOM 0 HG SER A 51 -17.427 -29.993 -10.564 1.00 63.12 H new ATOM 830 N LEU A 52 -13.151 -27.618 -8.888 1.00 2.24 N ATOM 831 CA LEU A 52 -11.781 -27.141 -9.047 1.00 72.32 C ATOM 832 C LEU A 52 -10.928 -27.523 -7.842 1.00 0.21 C ATOM 833 O LEU A 52 -9.867 -28.131 -7.988 1.00 33.14 O ATOM 834 CB LEU A 52 -11.767 -25.623 -9.236 1.00 73.44 C ATOM 835 CG LEU A 52 -10.388 -24.966 -9.284 1.00 43.44 C ATOM 836 CD1 LEU A 52 -9.508 -25.645 -10.323 1.00 13.03 C ATOM 837 CD2 LEU A 52 -10.516 -23.479 -9.582 1.00 1.20 C ATOM 0 H LEU A 52 -13.834 -26.884 -8.702 1.00 2.24 H new ATOM 0 HA LEU A 52 -11.358 -27.615 -9.933 1.00 72.32 H new ATOM 0 HB2 LEU A 52 -12.292 -25.387 -10.162 1.00 73.44 H new ATOM 0 HB3 LEU A 52 -12.335 -25.170 -8.423 1.00 73.44 H new ATOM 0 HG LEU A 52 -9.918 -25.082 -8.308 1.00 43.44 H new ATOM 0 HD11 LEU A 52 -8.530 -25.163 -10.343 1.00 13.03 H new ATOM 0 HD12 LEU A 52 -9.389 -26.698 -10.067 1.00 13.03 H new ATOM 0 HD13 LEU A 52 -9.974 -25.561 -11.305 1.00 13.03 H new ATOM 0 HD21 LEU A 52 -9.524 -23.027 -9.612 1.00 1.20 H new ATOM 0 HD22 LEU A 52 -11.007 -23.342 -10.545 1.00 1.20 H new ATOM 0 HD23 LEU A 52 -11.108 -23.001 -8.802 1.00 1.20 H new ATOM 849 N ILE A 53 -11.399 -27.163 -6.653 1.00 20.44 N ATOM 850 CA ILE A 53 -10.681 -27.471 -5.422 1.00 63.22 C ATOM 851 C ILE A 53 -10.395 -28.965 -5.311 1.00 75.01 C ATOM 852 O ILE A 53 -9.262 -29.374 -5.061 1.00 21.15 O ATOM 853 CB ILE A 53 -11.471 -27.017 -4.180 1.00 64.15 C ATOM 854 CG1 ILE A 53 -11.766 -25.518 -4.257 1.00 41.31 C ATOM 855 CG2 ILE A 53 -10.698 -27.346 -2.912 1.00 32.22 C ATOM 856 CD1 ILE A 53 -12.830 -25.061 -3.284 1.00 1.12 C ATOM 0 H ILE A 53 -12.274 -26.658 -6.516 1.00 20.44 H new ATOM 0 HA ILE A 53 -9.738 -26.925 -5.462 1.00 63.22 H new ATOM 0 HB ILE A 53 -12.419 -27.554 -4.154 1.00 64.15 H new ATOM 0 HG12 ILE A 53 -10.847 -24.965 -4.064 1.00 41.31 H new ATOM 0 HG13 ILE A 53 -12.081 -25.269 -5.270 1.00 41.31 H new ATOM 0 HG21 ILE A 53 -11.269 -27.019 -2.043 1.00 32.22 H new ATOM 0 HG22 ILE A 53 -10.534 -28.422 -2.855 1.00 32.22 H new ATOM 0 HG23 ILE A 53 -9.737 -26.833 -2.929 1.00 32.22 H new ATOM 0 HD11 ILE A 53 -12.987 -23.988 -3.394 1.00 1.12 H new ATOM 0 HD12 ILE A 53 -13.762 -25.587 -3.490 1.00 1.12 H new ATOM 0 HD13 ILE A 53 -12.509 -25.278 -2.265 1.00 1.12 H new ATOM 868 N SER A 54 -11.432 -29.775 -5.501 1.00 63.52 N ATOM 869 CA SER A 54 -11.293 -31.225 -5.421 1.00 14.14 C ATOM 870 C SER A 54 -10.196 -31.719 -6.359 1.00 12.15 C ATOM 871 O SER A 54 -9.538 -32.723 -6.087 1.00 72.33 O ATOM 872 CB SER A 54 -12.620 -31.905 -5.766 1.00 3.12 C ATOM 873 OG SER A 54 -12.668 -33.222 -5.246 1.00 63.42 O ATOM 0 H SER A 54 -12.377 -29.452 -5.711 1.00 63.52 H new ATOM 0 HA SER A 54 -11.015 -31.483 -4.399 1.00 14.14 H new ATOM 0 HB2 SER A 54 -13.447 -31.321 -5.363 1.00 3.12 H new ATOM 0 HB3 SER A 54 -12.747 -31.933 -6.848 1.00 3.12 H new ATOM 0 HG SER A 54 -13.289 -33.762 -5.779 1.00 63.42 H new ATOM 879 N SER A 55 -10.005 -31.005 -7.463 1.00 73.25 N ATOM 880 CA SER A 55 -8.991 -31.372 -8.445 1.00 21.03 C ATOM 881 C SER A 55 -7.590 -31.113 -7.900 1.00 45.52 C ATOM 882 O SER A 55 -6.630 -31.786 -8.278 1.00 5.24 O ATOM 883 CB SER A 55 -9.199 -30.589 -9.742 1.00 54.22 C ATOM 884 OG SER A 55 -8.434 -31.141 -10.800 1.00 13.34 O ATOM 0 H SER A 55 -10.539 -30.169 -7.700 1.00 73.25 H new ATOM 0 HA SER A 55 -9.090 -32.437 -8.653 1.00 21.03 H new ATOM 0 HB2 SER A 55 -10.255 -30.598 -10.010 1.00 54.22 H new ATOM 0 HB3 SER A 55 -8.917 -29.547 -9.591 1.00 54.22 H new ATOM 0 HG SER A 55 -8.458 -30.537 -11.571 1.00 13.34 H new ATOM 890 N LEU A 56 -7.480 -30.132 -7.011 1.00 4.20 N ATOM 891 CA LEU A 56 -6.196 -29.782 -6.413 1.00 41.50 C ATOM 892 C LEU A 56 -5.831 -30.756 -5.297 1.00 50.53 C ATOM 893 O LEU A 56 -4.733 -30.699 -4.744 1.00 64.32 O ATOM 894 CB LEU A 56 -6.239 -28.354 -5.865 1.00 44.15 C ATOM 895 CG LEU A 56 -5.566 -27.284 -6.726 1.00 65.44 C ATOM 896 CD1 LEU A 56 -6.579 -26.242 -7.172 1.00 52.01 C ATOM 897 CD2 LEU A 56 -4.423 -26.628 -5.965 1.00 63.43 C ATOM 0 H LEU A 56 -8.264 -29.565 -6.688 1.00 4.20 H new ATOM 0 HA LEU A 56 -5.433 -29.845 -7.189 1.00 41.50 H new ATOM 0 HB2 LEU A 56 -7.282 -28.073 -5.721 1.00 44.15 H new ATOM 0 HB3 LEU A 56 -5.769 -28.349 -4.882 1.00 44.15 H new ATOM 0 HG LEU A 56 -5.156 -27.765 -7.614 1.00 65.44 H new ATOM 0 HD11 LEU A 56 -6.081 -25.489 -7.783 1.00 52.01 H new ATOM 0 HD12 LEU A 56 -7.363 -26.724 -7.756 1.00 52.01 H new ATOM 0 HD13 LEU A 56 -7.020 -25.765 -6.297 1.00 52.01 H new ATOM 0 HD21 LEU A 56 -3.956 -25.869 -6.593 1.00 63.43 H new ATOM 0 HD22 LEU A 56 -4.810 -26.161 -5.059 1.00 63.43 H new ATOM 0 HD23 LEU A 56 -3.684 -27.383 -5.697 1.00 63.43 H new ATOM 909 N VAL A 57 -6.759 -31.650 -4.973 1.00 32.14 N ATOM 910 CA VAL A 57 -6.534 -32.639 -3.925 1.00 74.23 C ATOM 911 C VAL A 57 -6.754 -34.054 -4.449 1.00 44.04 C ATOM 912 O VAL A 57 -5.798 -34.787 -4.705 1.00 32.15 O ATOM 913 CB VAL A 57 -7.463 -32.401 -2.719 1.00 45.35 C ATOM 914 CG1 VAL A 57 -6.693 -31.770 -1.569 1.00 44.24 C ATOM 915 CG2 VAL A 57 -8.644 -31.531 -3.121 1.00 74.31 C ATOM 0 H VAL A 57 -7.674 -31.710 -5.421 1.00 32.14 H new ATOM 0 HA VAL A 57 -5.498 -32.529 -3.604 1.00 74.23 H new ATOM 0 HB VAL A 57 -7.848 -33.364 -2.382 1.00 45.35 H new ATOM 0 HG11 VAL A 57 -7.365 -31.609 -0.726 1.00 44.24 H new ATOM 0 HG12 VAL A 57 -5.883 -32.434 -1.266 1.00 44.24 H new ATOM 0 HG13 VAL A 57 -6.278 -30.814 -1.890 1.00 44.24 H new ATOM 0 HG21 VAL A 57 -9.290 -31.373 -2.257 1.00 74.31 H new ATOM 0 HG22 VAL A 57 -8.281 -30.569 -3.483 1.00 74.31 H new ATOM 0 HG23 VAL A 57 -9.209 -32.026 -3.911 1.00 74.31 H new ATOM 925 N TRP A 58 -8.017 -34.431 -4.608 1.00 51.31 N ATOM 926 CA TRP A 58 -8.362 -35.759 -5.103 1.00 11.32 C ATOM 927 C TRP A 58 -8.454 -35.766 -6.625 1.00 14.43 C ATOM 928 O TRP A 58 -7.558 -36.260 -7.307 1.00 75.14 O ATOM 929 CB TRP A 58 -9.688 -36.223 -4.497 1.00 42.50 C ATOM 930 CG TRP A 58 -9.592 -36.550 -3.038 1.00 3.25 C ATOM 931 CD1 TRP A 58 -10.009 -35.773 -1.994 1.00 61.43 C ATOM 932 CD2 TRP A 58 -9.042 -37.739 -2.460 1.00 62.04 C ATOM 933 NE1 TRP A 58 -9.751 -36.408 -0.803 1.00 74.43 N ATOM 934 CE2 TRP A 58 -9.159 -37.616 -1.062 1.00 33.20 C ATOM 935 CE3 TRP A 58 -8.464 -38.896 -2.988 1.00 64.44 C ATOM 936 CZ2 TRP A 58 -8.718 -38.607 -0.188 1.00 55.34 C ATOM 937 CZ3 TRP A 58 -8.026 -39.878 -2.120 1.00 73.41 C ATOM 938 CH2 TRP A 58 -8.156 -39.729 -0.733 1.00 32.11 C ATOM 0 H TRP A 58 -8.820 -33.836 -4.401 1.00 51.31 H new ATOM 0 HA TRP A 58 -7.573 -36.448 -4.803 1.00 11.32 H new ATOM 0 HB2 TRP A 58 -10.437 -35.443 -4.639 1.00 42.50 H new ATOM 0 HB3 TRP A 58 -10.038 -37.103 -5.037 1.00 42.50 H new ATOM 0 HD1 TRP A 58 -10.473 -34.803 -2.091 1.00 61.43 H new ATOM 0 HE1 TRP A 58 -9.965 -36.040 0.124 1.00 74.43 H new ATOM 0 HE3 TRP A 58 -8.361 -39.021 -4.056 1.00 64.44 H new ATOM 0 HZ2 TRP A 58 -8.816 -38.494 0.882 1.00 55.34 H new ATOM 0 HZ3 TRP A 58 -7.576 -40.776 -2.518 1.00 73.41 H new ATOM 0 HH2 TRP A 58 -7.806 -40.516 -0.081 1.00 32.11 H new ATOM 949 N ASN A 59 -9.543 -35.214 -7.150 1.00 14.42 N ATOM 950 CA ASN A 59 -9.752 -35.157 -8.592 1.00 50.01 C ATOM 951 C ASN A 59 -10.866 -34.176 -8.942 1.00 55.34 C ATOM 952 O ASN A 59 -11.781 -33.952 -8.151 1.00 14.44 O ATOM 953 CB ASN A 59 -10.092 -36.547 -9.134 1.00 41.21 C ATOM 954 CG ASN A 59 -8.874 -37.269 -9.677 1.00 72.31 C ATOM 955 OD1 ASN A 59 -8.573 -38.392 -9.272 1.00 20.20 O ATOM 956 ND2 ASN A 59 -8.167 -36.626 -10.599 1.00 31.30 N ATOM 0 H ASN A 59 -10.294 -34.800 -6.598 1.00 14.42 H new ATOM 0 HA ASN A 59 -8.828 -34.810 -9.055 1.00 50.01 H new ATOM 0 HB2 ASN A 59 -10.541 -37.144 -8.340 1.00 41.21 H new ATOM 0 HB3 ASN A 59 -10.838 -36.454 -9.923 1.00 41.21 H new ATOM 0 HD21 ASN A 59 -7.337 -37.062 -11.001 1.00 31.30 H new ATOM 0 HD22 ASN A 59 -8.454 -35.696 -10.905 1.00 31.30 H new ATOM 963 N MET A 60 -10.782 -33.594 -10.135 1.00 33.25 N ATOM 964 CA MET A 60 -11.785 -32.638 -10.591 1.00 22.34 C ATOM 965 C MET A 60 -13.161 -33.291 -10.671 1.00 13.33 C ATOM 966 O MET A 60 -14.184 -32.607 -10.659 1.00 42.13 O ATOM 967 CB MET A 60 -11.396 -32.072 -11.957 1.00 44.33 C ATOM 968 CG MET A 60 -11.282 -33.129 -13.043 1.00 63.14 C ATOM 969 SD MET A 60 -11.172 -32.418 -14.697 1.00 14.34 S ATOM 970 CE MET A 60 -12.791 -32.824 -15.348 1.00 2.14 C ATOM 0 H MET A 60 -10.030 -33.768 -10.802 1.00 33.25 H new ATOM 0 HA MET A 60 -11.830 -31.824 -9.868 1.00 22.34 H new ATOM 0 HB2 MET A 60 -12.137 -31.332 -12.259 1.00 44.33 H new ATOM 0 HB3 MET A 60 -10.443 -31.551 -11.867 1.00 44.33 H new ATOM 0 HG2 MET A 60 -10.401 -33.742 -12.856 1.00 63.14 H new ATOM 0 HG3 MET A 60 -12.147 -33.790 -12.993 1.00 63.14 H new ATOM 0 HE1 MET A 60 -12.878 -32.449 -16.368 1.00 2.14 H new ATOM 0 HE2 MET A 60 -12.923 -33.906 -15.347 1.00 2.14 H new ATOM 0 HE3 MET A 60 -13.559 -32.364 -14.726 1.00 2.14 H new ATOM 980 N ASN A 61 -13.179 -34.617 -10.752 1.00 63.23 N ATOM 981 CA ASN A 61 -14.430 -35.361 -10.835 1.00 72.43 C ATOM 982 C ASN A 61 -15.386 -34.945 -9.721 1.00 42.24 C ATOM 983 O ASN A 61 -15.184 -35.286 -8.556 1.00 33.32 O ATOM 984 CB ASN A 61 -14.160 -36.865 -10.755 1.00 23.23 C ATOM 985 CG ASN A 61 -13.791 -37.459 -12.100 1.00 64.33 C ATOM 986 OD1 ASN A 61 -14.296 -37.033 -13.139 1.00 31.41 O ATOM 987 ND2 ASN A 61 -12.905 -38.449 -12.087 1.00 51.21 N ATOM 0 H ASN A 61 -12.341 -35.199 -10.762 1.00 63.23 H new ATOM 0 HA ASN A 61 -14.896 -35.133 -11.794 1.00 72.43 H new ATOM 0 HB2 ASN A 61 -13.353 -37.049 -10.046 1.00 23.23 H new ATOM 0 HB3 ASN A 61 -15.045 -37.370 -10.368 1.00 23.23 H new ATOM 0 HD21 ASN A 61 -12.618 -38.888 -12.962 1.00 51.21 H new ATOM 0 HD22 ASN A 61 -12.512 -38.770 -11.202 1.00 51.21 H new ATOM 994 N PHE A 62 -16.427 -34.205 -10.088 1.00 71.25 N ATOM 995 CA PHE A 62 -17.414 -33.741 -9.121 1.00 34.33 C ATOM 996 C PHE A 62 -18.618 -34.678 -9.080 1.00 53.14 C ATOM 997 O PHE A 62 -19.725 -34.269 -8.728 1.00 60.04 O ATOM 998 CB PHE A 62 -17.870 -32.322 -9.465 1.00 43.33 C ATOM 999 CG PHE A 62 -18.380 -32.180 -10.871 1.00 64.40 C ATOM 1000 CD1 PHE A 62 -19.706 -32.448 -11.171 1.00 64.01 C ATOM 1001 CD2 PHE A 62 -17.533 -31.779 -11.892 1.00 73.51 C ATOM 1002 CE1 PHE A 62 -20.177 -32.320 -12.464 1.00 11.51 C ATOM 1003 CE2 PHE A 62 -17.999 -31.649 -13.187 1.00 12.21 C ATOM 1004 CZ PHE A 62 -19.323 -31.918 -13.473 1.00 32.32 C ATOM 0 H PHE A 62 -16.609 -33.914 -11.049 1.00 71.25 H new ATOM 0 HA PHE A 62 -16.946 -33.736 -8.137 1.00 34.33 H new ATOM 0 HB2 PHE A 62 -18.655 -32.023 -8.770 1.00 43.33 H new ATOM 0 HB3 PHE A 62 -17.036 -31.635 -9.318 1.00 43.33 H new ATOM 0 HD1 PHE A 62 -20.379 -32.760 -10.386 1.00 64.01 H new ATOM 0 HD2 PHE A 62 -16.497 -31.566 -11.673 1.00 73.51 H new ATOM 0 HE1 PHE A 62 -21.212 -32.534 -12.686 1.00 11.51 H new ATOM 0 HE2 PHE A 62 -17.328 -31.337 -13.974 1.00 12.21 H new ATOM 0 HZ PHE A 62 -19.690 -31.814 -14.483 1.00 32.32 H new ATOM 1014 N ASP A 63 -18.394 -35.936 -9.444 1.00 1.31 N ATOM 1015 CA ASP A 63 -19.459 -36.932 -9.449 1.00 52.34 C ATOM 1016 C ASP A 63 -19.986 -37.172 -8.038 1.00 1.31 C ATOM 1017 O ASP A 63 -21.128 -36.836 -7.726 1.00 33.24 O ATOM 1018 CB ASP A 63 -18.955 -38.245 -10.049 1.00 73.33 C ATOM 1019 CG ASP A 63 -18.912 -38.211 -11.564 1.00 51.13 C ATOM 1020 OD1 ASP A 63 -19.985 -38.338 -12.191 1.00 65.40 O ATOM 1021 OD2 ASP A 63 -17.806 -38.057 -12.123 1.00 62.34 O ATOM 0 H ASP A 63 -17.484 -36.290 -9.739 1.00 1.31 H new ATOM 0 HA ASP A 63 -20.276 -36.551 -10.062 1.00 52.34 H new ATOM 0 HB2 ASP A 63 -17.957 -38.457 -9.665 1.00 73.33 H new ATOM 0 HB3 ASP A 63 -19.601 -39.061 -9.725 1.00 73.33 H new ATOM 1026 N SER A 64 -19.146 -37.755 -7.189 1.00 64.45 N ATOM 1027 CA SER A 64 -19.528 -38.045 -5.812 1.00 70.04 C ATOM 1028 C SER A 64 -18.295 -38.244 -4.937 1.00 22.44 C ATOM 1029 O SER A 64 -17.851 -39.372 -4.718 1.00 45.43 O ATOM 1030 CB SER A 64 -20.413 -39.292 -5.758 1.00 51.21 C ATOM 1031 OG SER A 64 -19.888 -40.326 -6.573 1.00 55.51 O ATOM 0 H SER A 64 -18.196 -38.036 -7.431 1.00 64.45 H new ATOM 0 HA SER A 64 -20.090 -37.193 -5.429 1.00 70.04 H new ATOM 0 HB2 SER A 64 -20.492 -39.641 -4.728 1.00 51.21 H new ATOM 0 HB3 SER A 64 -21.421 -39.041 -6.088 1.00 51.21 H new ATOM 0 HG SER A 64 -18.952 -40.490 -6.332 1.00 55.51 H new ATOM 1037 N ASP A 65 -17.747 -37.142 -4.438 1.00 1.22 N ATOM 1038 CA ASP A 65 -16.565 -37.194 -3.585 1.00 14.34 C ATOM 1039 C ASP A 65 -16.944 -36.996 -2.120 1.00 23.30 C ATOM 1040 O ASP A 65 -16.233 -36.329 -1.368 1.00 2.12 O ATOM 1041 CB ASP A 65 -15.555 -36.128 -4.011 1.00 42.02 C ATOM 1042 CG ASP A 65 -14.792 -36.521 -5.261 1.00 52.33 C ATOM 1043 OD1 ASP A 65 -14.991 -37.654 -5.745 1.00 63.51 O ATOM 1044 OD2 ASP A 65 -13.996 -35.695 -5.755 1.00 51.42 O ATOM 0 H ASP A 65 -18.102 -36.201 -4.609 1.00 1.22 H new ATOM 0 HA ASP A 65 -16.111 -38.179 -3.695 1.00 14.34 H new ATOM 0 HB2 ASP A 65 -16.077 -35.187 -4.188 1.00 42.02 H new ATOM 0 HB3 ASP A 65 -14.850 -35.954 -3.198 1.00 42.02 H new ATOM 1049 N THR A 66 -18.069 -37.581 -1.721 1.00 13.43 N ATOM 1050 CA THR A 66 -18.544 -37.467 -0.347 1.00 64.33 C ATOM 1051 C THR A 66 -18.372 -36.047 0.178 1.00 10.23 C ATOM 1052 O THR A 66 -18.102 -35.841 1.361 1.00 41.03 O ATOM 1053 CB THR A 66 -17.800 -38.441 0.586 1.00 20.30 C ATOM 1054 OG1 THR A 66 -18.390 -38.416 1.891 1.00 61.34 O ATOM 1055 CG2 THR A 66 -16.326 -38.078 0.683 1.00 21.24 C ATOM 0 H THR A 66 -18.668 -38.139 -2.330 1.00 13.43 H new ATOM 0 HA THR A 66 -19.604 -37.722 -0.356 1.00 64.33 H new ATOM 0 HB THR A 66 -17.884 -39.445 0.169 1.00 20.30 H new ATOM 0 HG1 THR A 66 -18.429 -37.492 2.215 1.00 61.34 H new ATOM 0 HG21 THR A 66 -15.821 -38.780 1.347 1.00 21.24 H new ATOM 0 HG22 THR A 66 -15.873 -38.126 -0.307 1.00 21.24 H new ATOM 0 HG23 THR A 66 -16.225 -37.067 1.079 1.00 21.24 H new ATOM 1063 N ASN A 67 -18.531 -35.069 -0.708 1.00 74.42 N ATOM 1064 CA ASN A 67 -18.394 -33.667 -0.333 1.00 0.14 C ATOM 1065 C ASN A 67 -17.176 -33.460 0.563 1.00 60.44 C ATOM 1066 O ASN A 67 -17.214 -32.675 1.510 1.00 33.20 O ATOM 1067 CB ASN A 67 -19.656 -33.184 0.385 1.00 40.53 C ATOM 1068 CG ASN A 67 -20.199 -31.896 -0.205 1.00 70.21 C ATOM 1069 OD1 ASN A 67 -19.310 -30.947 -0.474 1.00 22.22 O flip ATOM 1070 ND2 ASN A 67 -21.404 -31.757 -0.417 1.00 23.34 N flip ATOM 0 H ASN A 67 -18.755 -35.222 -1.691 1.00 74.42 H new ATOM 0 HA ASN A 67 -18.256 -33.085 -1.244 1.00 0.14 H new ATOM 0 HB2 ASN A 67 -20.422 -33.958 0.328 1.00 40.53 H new ATOM 0 HB3 ASN A 67 -19.434 -33.032 1.441 1.00 40.53 H new ATOM 0 HD21 ASN A 67 -22.051 -32.513 -0.195 1.00 23.34 H new ATOM 0 HD22 ASN A 67 -21.755 -30.886 -0.815 1.00 23.34 H new ATOM 1077 N VAL A 68 -16.095 -34.170 0.255 1.00 31.42 N ATOM 1078 CA VAL A 68 -14.865 -34.064 1.030 1.00 23.22 C ATOM 1079 C VAL A 68 -14.447 -32.608 1.201 1.00 22.00 C ATOM 1080 O VAL A 68 -13.813 -32.246 2.193 1.00 53.10 O ATOM 1081 CB VAL A 68 -13.714 -34.843 0.365 1.00 3.55 C ATOM 1082 CG1 VAL A 68 -13.501 -34.365 -1.063 1.00 3.32 C ATOM 1083 CG2 VAL A 68 -12.436 -34.702 1.179 1.00 33.25 C ATOM 0 H VAL A 68 -16.047 -34.825 -0.526 1.00 31.42 H new ATOM 0 HA VAL A 68 -15.069 -34.497 2.009 1.00 23.22 H new ATOM 0 HB VAL A 68 -13.983 -35.899 0.333 1.00 3.55 H new ATOM 0 HG11 VAL A 68 -12.684 -34.926 -1.517 1.00 3.32 H new ATOM 0 HG12 VAL A 68 -14.413 -34.522 -1.639 1.00 3.32 H new ATOM 0 HG13 VAL A 68 -13.253 -33.304 -1.058 1.00 3.32 H new ATOM 0 HG21 VAL A 68 -11.633 -35.258 0.695 1.00 33.25 H new ATOM 0 HG22 VAL A 68 -12.160 -33.649 1.244 1.00 33.25 H new ATOM 0 HG23 VAL A 68 -12.598 -35.097 2.182 1.00 33.25 H new ATOM 1093 N ILE A 69 -14.806 -31.777 0.228 1.00 21.23 N ATOM 1094 CA ILE A 69 -14.470 -30.360 0.272 1.00 5.30 C ATOM 1095 C ILE A 69 -15.218 -29.651 1.396 1.00 72.40 C ATOM 1096 O ILE A 69 -14.609 -29.031 2.267 1.00 25.34 O ATOM 1097 CB ILE A 69 -14.792 -29.663 -1.063 1.00 71.01 C ATOM 1098 CG1 ILE A 69 -14.000 -30.306 -2.203 1.00 44.33 C ATOM 1099 CG2 ILE A 69 -14.487 -28.175 -0.972 1.00 20.45 C ATOM 1100 CD1 ILE A 69 -12.503 -30.295 -1.980 1.00 75.41 C ATOM 0 H ILE A 69 -15.329 -32.061 -0.600 1.00 21.23 H new ATOM 0 HA ILE A 69 -13.398 -30.297 0.456 1.00 5.30 H new ATOM 0 HB ILE A 69 -15.855 -29.783 -1.271 1.00 71.01 H new ATOM 0 HG12 ILE A 69 -14.333 -31.336 -2.330 1.00 44.33 H new ATOM 0 HG13 ILE A 69 -14.225 -29.782 -3.132 1.00 44.33 H new ATOM 0 HG21 ILE A 69 -14.720 -27.697 -1.923 1.00 20.45 H new ATOM 0 HG22 ILE A 69 -15.092 -27.727 -0.183 1.00 20.45 H new ATOM 0 HG23 ILE A 69 -13.431 -28.033 -0.744 1.00 20.45 H new ATOM 0 HD11 ILE A 69 -12.005 -30.767 -2.827 1.00 75.41 H new ATOM 0 HD12 ILE A 69 -12.157 -29.266 -1.883 1.00 75.41 H new ATOM 0 HD13 ILE A 69 -12.267 -30.845 -1.069 1.00 75.41 H new ATOM 1112 N ASP A 70 -16.543 -29.750 1.371 1.00 43.45 N ATOM 1113 CA ASP A 70 -17.376 -29.121 2.389 1.00 3.11 C ATOM 1114 C ASP A 70 -17.094 -29.716 3.765 1.00 5.11 C ATOM 1115 O ASP A 70 -17.167 -29.023 4.780 1.00 55.31 O ATOM 1116 CB ASP A 70 -18.856 -29.287 2.042 1.00 41.13 C ATOM 1117 CG ASP A 70 -19.768 -28.673 3.086 1.00 70.04 C ATOM 1118 OD1 ASP A 70 -19.455 -27.565 3.569 1.00 11.25 O ATOM 1119 OD2 ASP A 70 -20.795 -29.300 3.418 1.00 72.20 O ATOM 0 H ASP A 70 -17.063 -30.260 0.657 1.00 43.45 H new ATOM 0 HA ASP A 70 -17.134 -28.058 2.415 1.00 3.11 H new ATOM 0 HB2 ASP A 70 -19.053 -28.825 1.075 1.00 41.13 H new ATOM 0 HB3 ASP A 70 -19.086 -30.348 1.942 1.00 41.13 H new ATOM 1124 N VAL A 71 -16.771 -31.005 3.792 1.00 21.10 N ATOM 1125 CA VAL A 71 -16.478 -31.694 5.043 1.00 4.12 C ATOM 1126 C VAL A 71 -15.090 -31.330 5.559 1.00 51.50 C ATOM 1127 O VAL A 71 -14.854 -31.300 6.766 1.00 5.02 O ATOM 1128 CB VAL A 71 -16.566 -33.223 4.876 1.00 12.54 C ATOM 1129 CG1 VAL A 71 -16.232 -33.923 6.185 1.00 51.23 C ATOM 1130 CG2 VAL A 71 -17.948 -33.625 4.384 1.00 32.25 C ATOM 0 H VAL A 71 -16.706 -31.593 2.961 1.00 21.10 H new ATOM 0 HA VAL A 71 -17.228 -31.371 5.765 1.00 4.12 H new ATOM 0 HB VAL A 71 -15.835 -33.533 4.129 1.00 12.54 H new ATOM 0 HG11 VAL A 71 -16.299 -35.002 6.048 1.00 51.23 H new ATOM 0 HG12 VAL A 71 -15.220 -33.659 6.491 1.00 51.23 H new ATOM 0 HG13 VAL A 71 -16.937 -33.610 6.955 1.00 51.23 H new ATOM 0 HG21 VAL A 71 -17.993 -34.708 4.271 1.00 32.25 H new ATOM 0 HG22 VAL A 71 -18.699 -33.304 5.106 1.00 32.25 H new ATOM 0 HG23 VAL A 71 -18.144 -33.152 3.422 1.00 32.25 H new ATOM 1140 N ALA A 72 -14.176 -31.052 4.635 1.00 25.14 N ATOM 1141 CA ALA A 72 -12.811 -30.687 4.997 1.00 55.24 C ATOM 1142 C ALA A 72 -12.770 -29.320 5.671 1.00 5.13 C ATOM 1143 O ALA A 72 -12.010 -29.106 6.616 1.00 42.40 O ATOM 1144 CB ALA A 72 -11.919 -30.697 3.765 1.00 65.13 C ATOM 0 H ALA A 72 -14.355 -31.072 3.631 1.00 25.14 H new ATOM 0 HA ALA A 72 -12.439 -31.425 5.708 1.00 55.24 H new ATOM 0 HB1 ALA A 72 -10.903 -30.423 4.049 1.00 65.13 H new ATOM 0 HB2 ALA A 72 -11.916 -31.695 3.326 1.00 65.13 H new ATOM 0 HB3 ALA A 72 -12.298 -29.981 3.036 1.00 65.13 H new ATOM 1150 N VAL A 73 -13.590 -28.397 5.180 1.00 53.03 N ATOM 1151 CA VAL A 73 -13.647 -27.050 5.736 1.00 71.34 C ATOM 1152 C VAL A 73 -14.431 -27.028 7.043 1.00 54.13 C ATOM 1153 O VAL A 73 -14.101 -26.282 7.964 1.00 5.33 O ATOM 1154 CB VAL A 73 -14.291 -26.061 4.746 1.00 74.40 C ATOM 1155 CG1 VAL A 73 -15.699 -26.509 4.384 1.00 53.10 C ATOM 1156 CG2 VAL A 73 -14.303 -24.656 5.329 1.00 31.41 C ATOM 0 H VAL A 73 -14.225 -28.557 4.398 1.00 53.03 H new ATOM 0 HA VAL A 73 -12.619 -26.743 5.928 1.00 71.34 H new ATOM 0 HB VAL A 73 -13.694 -26.046 3.834 1.00 74.40 H new ATOM 0 HG11 VAL A 73 -16.138 -25.798 3.684 1.00 53.10 H new ATOM 0 HG12 VAL A 73 -15.660 -27.496 3.923 1.00 53.10 H new ATOM 0 HG13 VAL A 73 -16.310 -26.554 5.286 1.00 53.10 H new ATOM 0 HG21 VAL A 73 -14.761 -23.970 4.616 1.00 31.41 H new ATOM 0 HG22 VAL A 73 -14.876 -24.652 6.256 1.00 31.41 H new ATOM 0 HG23 VAL A 73 -13.281 -24.338 5.532 1.00 31.41 H new ATOM 1166 N ARG A 74 -15.472 -27.851 7.116 1.00 73.01 N ATOM 1167 CA ARG A 74 -16.305 -27.925 8.310 1.00 21.44 C ATOM 1168 C ARG A 74 -15.593 -28.690 9.423 1.00 42.43 C ATOM 1169 O ARG A 74 -15.698 -28.337 10.598 1.00 52.15 O ATOM 1170 CB ARG A 74 -17.639 -28.600 7.987 1.00 71.13 C ATOM 1171 CG ARG A 74 -18.619 -27.694 7.259 1.00 30.21 C ATOM 1172 CD ARG A 74 -19.619 -27.069 8.220 1.00 64.33 C ATOM 1173 NE ARG A 74 -20.737 -27.964 8.504 1.00 55.11 N ATOM 1174 CZ ARG A 74 -21.872 -27.565 9.068 1.00 72.23 C ATOM 1175 NH1 ARG A 74 -22.038 -26.294 9.405 1.00 3.23 N ATOM 1176 NH2 ARG A 74 -22.845 -28.439 9.294 1.00 23.14 N ATOM 0 H ARG A 74 -15.759 -28.476 6.362 1.00 73.01 H new ATOM 0 HA ARG A 74 -16.494 -26.908 8.654 1.00 21.44 H new ATOM 0 HB2 ARG A 74 -17.451 -29.483 7.376 1.00 71.13 H new ATOM 0 HB3 ARG A 74 -18.096 -28.945 8.914 1.00 71.13 H new ATOM 0 HG2 ARG A 74 -18.072 -26.908 6.739 1.00 30.21 H new ATOM 0 HG3 ARG A 74 -19.151 -28.267 6.500 1.00 30.21 H new ATOM 0 HD2 ARG A 74 -19.115 -26.812 9.151 1.00 64.33 H new ATOM 0 HD3 ARG A 74 -19.998 -26.139 7.795 1.00 64.33 H new ATOM 0 HE ARG A 74 -20.642 -28.949 8.256 1.00 55.11 H new ATOM 0 HH11 ARG A 74 -21.293 -25.619 9.232 1.00 3.23 H new ATOM 0 HH12 ARG A 74 -22.910 -25.991 9.838 1.00 3.23 H new ATOM 0 HH21 ARG A 74 -22.722 -29.418 9.035 1.00 23.14 H new ATOM 0 HH22 ARG A 74 -23.716 -28.132 9.727 1.00 23.14 H new ATOM 1190 N ARG A 75 -14.869 -29.738 9.044 1.00 41.32 N ATOM 1191 CA ARG A 75 -14.141 -30.553 10.009 1.00 11.31 C ATOM 1192 C ARG A 75 -12.957 -29.783 10.588 1.00 54.03 C ATOM 1193 O ARG A 75 -12.671 -29.869 11.783 1.00 73.23 O ATOM 1194 CB ARG A 75 -13.651 -31.844 9.352 1.00 71.14 C ATOM 1195 CG ARG A 75 -12.484 -31.638 8.400 1.00 23.32 C ATOM 1196 CD ARG A 75 -12.056 -32.946 7.752 1.00 1.32 C ATOM 1197 NE ARG A 75 -11.562 -33.907 8.734 1.00 23.31 N ATOM 1198 CZ ARG A 75 -11.320 -35.183 8.456 1.00 63.44 C ATOM 1199 NH1 ARG A 75 -11.525 -35.649 7.231 1.00 4.41 N ATOM 1200 NH2 ARG A 75 -10.871 -35.997 9.403 1.00 10.11 N ATOM 0 H ARG A 75 -14.771 -30.043 8.076 1.00 41.32 H new ATOM 0 HA ARG A 75 -14.822 -30.803 10.822 1.00 11.31 H new ATOM 0 HB2 ARG A 75 -13.355 -32.548 10.130 1.00 71.14 H new ATOM 0 HB3 ARG A 75 -14.477 -32.301 8.807 1.00 71.14 H new ATOM 0 HG2 ARG A 75 -12.765 -30.923 7.627 1.00 23.32 H new ATOM 0 HG3 ARG A 75 -11.642 -31.207 8.942 1.00 23.32 H new ATOM 0 HD2 ARG A 75 -12.901 -33.378 7.215 1.00 1.32 H new ATOM 0 HD3 ARG A 75 -11.278 -32.748 7.015 1.00 1.32 H new ATOM 0 HE ARG A 75 -11.394 -33.581 9.686 1.00 23.31 H new ATOM 0 HH11 ARG A 75 -11.869 -35.027 6.500 1.00 4.41 H new ATOM 0 HH12 ARG A 75 -11.338 -36.629 7.020 1.00 4.41 H new ATOM 0 HH21 ARG A 75 -10.711 -35.643 10.346 1.00 10.11 H new ATOM 0 HH22 ARG A 75 -10.686 -36.977 9.188 1.00 10.11 H new ATOM 1214 N LEU A 76 -12.273 -29.031 9.733 1.00 64.31 N ATOM 1215 CA LEU A 76 -11.119 -28.246 10.159 1.00 70.25 C ATOM 1216 C LEU A 76 -11.556 -27.040 10.983 1.00 2.33 C ATOM 1217 O LEU A 76 -10.870 -26.637 11.923 1.00 51.41 O ATOM 1218 CB LEU A 76 -10.316 -27.783 8.942 1.00 43.10 C ATOM 1219 CG LEU A 76 -10.705 -26.424 8.358 1.00 32.33 C ATOM 1220 CD1 LEU A 76 -10.044 -25.299 9.139 1.00 52.33 C ATOM 1221 CD2 LEU A 76 -10.328 -26.348 6.886 1.00 22.31 C ATOM 0 H LEU A 76 -12.497 -28.948 8.741 1.00 64.31 H new ATOM 0 HA LEU A 76 -10.489 -28.880 10.783 1.00 70.25 H new ATOM 0 HB2 LEU A 76 -9.262 -27.749 9.219 1.00 43.10 H new ATOM 0 HB3 LEU A 76 -10.416 -28.534 8.159 1.00 43.10 H new ATOM 0 HG LEU A 76 -11.786 -26.310 8.441 1.00 32.33 H new ATOM 0 HD11 LEU A 76 -10.332 -24.340 8.709 1.00 52.33 H new ATOM 0 HD12 LEU A 76 -10.365 -25.341 10.180 1.00 52.33 H new ATOM 0 HD13 LEU A 76 -8.961 -25.409 9.088 1.00 52.33 H new ATOM 0 HD21 LEU A 76 -10.612 -25.374 6.487 1.00 22.31 H new ATOM 0 HD22 LEU A 76 -9.252 -26.484 6.779 1.00 22.31 H new ATOM 0 HD23 LEU A 76 -10.849 -27.131 6.336 1.00 22.31 H new ATOM 1233 N ARG A 77 -12.702 -26.469 10.627 1.00 61.24 N ATOM 1234 CA ARG A 77 -13.231 -25.310 11.334 1.00 1.43 C ATOM 1235 C ARG A 77 -13.565 -25.661 12.781 1.00 22.31 C ATOM 1236 O ARG A 77 -13.193 -24.941 13.707 1.00 25.13 O ATOM 1237 CB ARG A 77 -14.479 -24.779 10.626 1.00 3.22 C ATOM 1238 CG ARG A 77 -14.949 -23.431 11.149 1.00 31.43 C ATOM 1239 CD ARG A 77 -15.986 -23.592 12.250 1.00 21.31 C ATOM 1240 NE ARG A 77 -17.187 -24.274 11.775 1.00 21.34 N ATOM 1241 CZ ARG A 77 -18.263 -24.476 12.527 1.00 12.13 C ATOM 1242 NH1 ARG A 77 -18.288 -24.050 13.782 1.00 15.44 N ATOM 1243 NH2 ARG A 77 -19.318 -25.105 12.024 1.00 44.34 N ATOM 0 H ARG A 77 -13.282 -26.791 9.852 1.00 61.24 H new ATOM 0 HA ARG A 77 -12.464 -24.535 11.334 1.00 1.43 H new ATOM 0 HB2 ARG A 77 -14.272 -24.693 9.559 1.00 3.22 H new ATOM 0 HB3 ARG A 77 -15.286 -25.504 10.737 1.00 3.22 H new ATOM 0 HG2 ARG A 77 -14.096 -22.870 11.530 1.00 31.43 H new ATOM 0 HG3 ARG A 77 -15.373 -22.849 10.330 1.00 31.43 H new ATOM 0 HD2 ARG A 77 -15.553 -24.155 13.077 1.00 21.31 H new ATOM 0 HD3 ARG A 77 -16.256 -22.611 12.640 1.00 21.31 H new ATOM 0 HE ARG A 77 -17.200 -24.614 10.813 1.00 21.34 H new ATOM 0 HH11 ARG A 77 -17.480 -23.566 14.172 1.00 15.44 H new ATOM 0 HH12 ARG A 77 -19.116 -24.206 14.357 1.00 15.44 H new ATOM 0 HH21 ARG A 77 -19.303 -25.434 11.059 1.00 44.34 H new ATOM 0 HH22 ARG A 77 -20.144 -25.259 12.603 1.00 44.34 H new ATOM 1257 N SER A 78 -14.269 -26.773 12.967 1.00 54.01 N ATOM 1258 CA SER A 78 -14.657 -27.218 14.300 1.00 34.12 C ATOM 1259 C SER A 78 -13.515 -27.971 14.975 1.00 11.15 C ATOM 1260 O SER A 78 -13.678 -28.526 16.062 1.00 30.12 O ATOM 1261 CB SER A 78 -15.896 -28.112 14.222 1.00 75.11 C ATOM 1262 OG SER A 78 -16.372 -28.440 15.516 1.00 3.41 O ATOM 0 H SER A 78 -14.582 -27.382 12.211 1.00 54.01 H new ATOM 0 HA SER A 78 -14.891 -26.336 14.897 1.00 34.12 H new ATOM 0 HB2 SER A 78 -16.680 -27.604 13.661 1.00 75.11 H new ATOM 0 HB3 SER A 78 -15.655 -29.025 13.678 1.00 75.11 H new ATOM 0 HG SER A 78 -15.614 -28.530 16.130 1.00 3.41 H new ATOM 1268 N LYS A 79 -12.357 -27.985 14.323 1.00 35.34 N ATOM 1269 CA LYS A 79 -11.186 -28.668 14.859 1.00 44.12 C ATOM 1270 C LYS A 79 -10.358 -27.727 15.729 1.00 33.20 C ATOM 1271 O LYS A 79 -9.700 -28.160 16.676 1.00 75.24 O ATOM 1272 CB LYS A 79 -10.324 -29.215 13.719 1.00 63.51 C ATOM 1273 CG LYS A 79 -10.420 -30.722 13.553 1.00 21.34 C ATOM 1274 CD LYS A 79 -9.702 -31.193 12.300 1.00 44.42 C ATOM 1275 CE LYS A 79 -9.385 -32.679 12.363 1.00 4.24 C ATOM 1276 NZ LYS A 79 -8.358 -33.070 11.359 1.00 62.55 N ATOM 0 H LYS A 79 -12.205 -27.531 13.422 1.00 35.34 H new ATOM 0 HA LYS A 79 -11.531 -29.497 15.477 1.00 44.12 H new ATOM 0 HB2 LYS A 79 -10.622 -28.735 12.787 1.00 63.51 H new ATOM 0 HB3 LYS A 79 -9.284 -28.943 13.899 1.00 63.51 H new ATOM 0 HG2 LYS A 79 -9.990 -31.213 14.426 1.00 21.34 H new ATOM 0 HG3 LYS A 79 -11.468 -31.017 13.505 1.00 21.34 H new ATOM 0 HD2 LYS A 79 -10.321 -30.989 11.426 1.00 44.42 H new ATOM 0 HD3 LYS A 79 -8.778 -30.628 12.175 1.00 44.42 H new ATOM 0 HE2 LYS A 79 -9.031 -32.933 13.362 1.00 4.24 H new ATOM 0 HE3 LYS A 79 -10.296 -33.252 12.192 1.00 4.24 H new ATOM 0 HZ1 LYS A 79 -8.170 -34.090 11.434 1.00 62.55 H new ATOM 0 HZ2 LYS A 79 -8.706 -32.851 10.404 1.00 62.55 H new ATOM 0 HZ3 LYS A 79 -7.480 -32.542 11.537 1.00 62.55 H new ATOM 1290 N ILE A 80 -10.397 -26.440 15.403 1.00 12.43 N ATOM 1291 CA ILE A 80 -9.653 -25.439 16.157 1.00 11.53 C ATOM 1292 C ILE A 80 -10.381 -24.099 16.159 1.00 0.44 C ATOM 1293 O ILE A 80 -10.501 -23.447 17.197 1.00 34.53 O ATOM 1294 CB ILE A 80 -8.237 -25.240 15.585 1.00 72.03 C ATOM 1295 CG1 ILE A 80 -7.526 -24.095 16.310 1.00 71.53 C ATOM 1296 CG2 ILE A 80 -8.304 -24.967 14.090 1.00 51.24 C ATOM 1297 CD1 ILE A 80 -7.421 -24.300 17.805 1.00 62.13 C ATOM 0 H ILE A 80 -10.936 -26.066 14.622 1.00 12.43 H new ATOM 0 HA ILE A 80 -9.574 -25.809 17.179 1.00 11.53 H new ATOM 0 HB ILE A 80 -7.665 -26.155 15.743 1.00 72.03 H new ATOM 0 HG12 ILE A 80 -6.524 -23.980 15.896 1.00 71.53 H new ATOM 0 HG13 ILE A 80 -8.060 -23.165 16.115 1.00 71.53 H new ATOM 0 HG21 ILE A 80 -7.296 -24.828 13.700 1.00 51.24 H new ATOM 0 HG22 ILE A 80 -8.775 -25.811 13.587 1.00 51.24 H new ATOM 0 HG23 ILE A 80 -8.889 -24.065 13.911 1.00 51.24 H new ATOM 0 HD11 ILE A 80 -6.906 -23.450 18.253 1.00 62.13 H new ATOM 0 HD12 ILE A 80 -8.420 -24.385 18.232 1.00 62.13 H new ATOM 0 HD13 ILE A 80 -6.861 -25.212 18.009 1.00 62.13 H new ATOM 1309 N ASP A 81 -10.866 -23.693 14.991 1.00 71.51 N ATOM 1310 CA ASP A 81 -11.585 -22.432 14.858 1.00 55.03 C ATOM 1311 C ASP A 81 -12.866 -22.446 15.687 1.00 23.31 C ATOM 1312 O ASP A 81 -13.448 -21.398 15.966 1.00 21.14 O ATOM 1313 CB ASP A 81 -11.917 -22.162 13.389 1.00 34.22 C ATOM 1314 CG ASP A 81 -13.044 -21.161 13.225 1.00 44.32 C ATOM 1315 OD1 ASP A 81 -14.215 -21.551 13.407 1.00 35.21 O ATOM 1316 OD2 ASP A 81 -12.753 -19.987 12.913 1.00 52.42 O ATOM 0 H ASP A 81 -10.774 -24.219 14.122 1.00 71.51 H new ATOM 0 HA ASP A 81 -10.941 -21.635 15.230 1.00 55.03 H new ATOM 0 HB2 ASP A 81 -11.027 -21.790 12.881 1.00 34.22 H new ATOM 0 HB3 ASP A 81 -12.193 -23.098 12.904 1.00 34.22 H new ATOM 1321 N ASP A 82 -13.299 -23.640 16.077 1.00 63.23 N ATOM 1322 CA ASP A 82 -14.510 -23.791 16.874 1.00 32.32 C ATOM 1323 C ASP A 82 -14.435 -22.947 18.142 1.00 0.42 C ATOM 1324 O ASP A 82 -15.439 -22.395 18.593 1.00 32.22 O ATOM 1325 CB ASP A 82 -14.727 -25.261 17.238 1.00 71.03 C ATOM 1326 CG ASP A 82 -16.146 -25.721 16.967 1.00 61.22 C ATOM 1327 OD1 ASP A 82 -16.708 -25.327 15.924 1.00 71.01 O ATOM 1328 OD2 ASP A 82 -16.695 -26.475 17.798 1.00 4.22 O ATOM 0 H ASP A 82 -12.829 -24.517 15.854 1.00 63.23 H new ATOM 0 HA ASP A 82 -15.353 -23.444 16.277 1.00 32.32 H new ATOM 0 HB2 ASP A 82 -14.033 -25.879 16.669 1.00 71.03 H new ATOM 0 HB3 ASP A 82 -14.495 -25.409 18.293 1.00 71.03 H new ATOM 1333 N ASP A 83 -13.239 -22.851 18.713 1.00 52.42 N ATOM 1334 CA ASP A 83 -13.033 -22.073 19.929 1.00 24.22 C ATOM 1335 C ASP A 83 -11.899 -21.069 19.746 1.00 12.32 C ATOM 1336 O ASP A 83 -11.109 -20.835 20.661 1.00 63.32 O ATOM 1337 CB ASP A 83 -12.724 -23.000 21.106 1.00 32.01 C ATOM 1338 CG ASP A 83 -12.790 -22.283 22.440 1.00 24.03 C ATOM 1339 OD1 ASP A 83 -13.783 -21.566 22.681 1.00 55.33 O ATOM 1340 OD2 ASP A 83 -11.847 -22.440 23.244 1.00 14.15 O ATOM 0 H ASP A 83 -12.398 -23.302 18.353 1.00 52.42 H new ATOM 0 HA ASP A 83 -13.951 -21.524 20.139 1.00 24.22 H new ATOM 0 HB2 ASP A 83 -13.431 -23.829 21.107 1.00 32.01 H new ATOM 0 HB3 ASP A 83 -11.730 -23.429 20.976 1.00 32.01 H new ATOM 1345 N PHE A 84 -11.825 -20.478 18.558 1.00 13.42 N ATOM 1346 CA PHE A 84 -10.787 -19.500 18.254 1.00 13.42 C ATOM 1347 C PHE A 84 -11.366 -18.312 17.491 1.00 40.21 C ATOM 1348 O PHE A 84 -11.036 -17.160 17.772 1.00 31.33 O ATOM 1349 CB PHE A 84 -9.668 -20.149 17.437 1.00 34.12 C ATOM 1350 CG PHE A 84 -8.292 -19.730 17.867 1.00 44.45 C ATOM 1351 CD1 PHE A 84 -8.011 -18.400 18.138 1.00 53.02 C ATOM 1352 CD2 PHE A 84 -7.278 -20.665 17.999 1.00 1.44 C ATOM 1353 CE1 PHE A 84 -6.745 -18.011 18.532 1.00 30.32 C ATOM 1354 CE2 PHE A 84 -6.010 -20.282 18.394 1.00 43.11 C ATOM 1355 CZ PHE A 84 -5.743 -18.953 18.662 1.00 73.44 C ATOM 0 H PHE A 84 -12.471 -20.659 17.790 1.00 13.42 H new ATOM 0 HA PHE A 84 -10.376 -19.139 19.197 1.00 13.42 H new ATOM 0 HB2 PHE A 84 -9.751 -21.233 17.518 1.00 34.12 H new ATOM 0 HB3 PHE A 84 -9.804 -19.897 16.385 1.00 34.12 H new ATOM 0 HD1 PHE A 84 -8.791 -17.659 18.040 1.00 53.02 H new ATOM 0 HD2 PHE A 84 -7.481 -21.705 17.791 1.00 1.44 H new ATOM 0 HE1 PHE A 84 -6.539 -16.971 18.738 1.00 30.32 H new ATOM 0 HE2 PHE A 84 -5.229 -21.021 18.493 1.00 43.11 H new ATOM 0 HZ PHE A 84 -4.753 -18.651 18.972 1.00 73.44 H new ATOM 1365 N GLU A 85 -12.230 -18.602 16.523 1.00 13.03 N ATOM 1366 CA GLU A 85 -12.854 -17.558 15.718 1.00 24.14 C ATOM 1367 C GLU A 85 -14.312 -17.896 15.424 1.00 33.10 C ATOM 1368 O GLU A 85 -14.743 -19.044 15.531 1.00 74.44 O ATOM 1369 CB GLU A 85 -12.088 -17.368 14.407 1.00 20.53 C ATOM 1370 CG GLU A 85 -11.041 -16.269 14.467 1.00 10.14 C ATOM 1371 CD GLU A 85 -11.285 -15.175 13.446 1.00 64.01 C ATOM 1372 OE1 GLU A 85 -10.959 -15.389 12.259 1.00 3.14 O ATOM 1373 OE2 GLU A 85 -11.800 -14.106 13.833 1.00 55.35 O ATOM 0 H GLU A 85 -12.514 -19.550 16.277 1.00 13.03 H new ATOM 0 HA GLU A 85 -12.823 -16.629 16.287 1.00 24.14 H new ATOM 0 HB2 GLU A 85 -11.602 -18.307 14.141 1.00 20.53 H new ATOM 0 HB3 GLU A 85 -12.797 -17.139 13.612 1.00 20.53 H new ATOM 0 HG2 GLU A 85 -11.034 -15.833 15.466 1.00 10.14 H new ATOM 0 HG3 GLU A 85 -10.055 -16.702 14.301 1.00 10.14 H new ATOM 1380 N PRO A 86 -15.092 -16.872 15.045 1.00 24.30 N ATOM 1381 CA PRO A 86 -16.513 -17.035 14.727 1.00 34.14 C ATOM 1382 C PRO A 86 -16.733 -17.810 13.432 1.00 11.44 C ATOM 1383 O PRO A 86 -15.789 -18.340 12.846 1.00 34.22 O ATOM 1384 CB PRO A 86 -17.011 -15.595 14.580 1.00 31.02 C ATOM 1385 CG PRO A 86 -15.801 -14.813 14.202 1.00 41.20 C ATOM 1386 CD PRO A 86 -14.645 -15.477 14.897 1.00 64.12 C ATOM 0 HA PRO A 86 -17.039 -17.606 15.492 1.00 34.14 H new ATOM 0 HB2 PRO A 86 -17.785 -15.520 13.817 1.00 31.02 H new ATOM 0 HB3 PRO A 86 -17.444 -15.229 15.511 1.00 31.02 H new ATOM 0 HG2 PRO A 86 -15.659 -14.813 13.121 1.00 41.20 H new ATOM 0 HG3 PRO A 86 -15.897 -13.772 14.511 1.00 41.20 H new ATOM 0 HD2 PRO A 86 -13.730 -15.409 14.309 1.00 64.12 H new ATOM 0 HD3 PRO A 86 -14.439 -15.016 15.863 1.00 64.12 H new ATOM 1394 N LYS A 87 -17.985 -17.871 12.990 1.00 4.31 N ATOM 1395 CA LYS A 87 -18.329 -18.579 11.763 1.00 12.10 C ATOM 1396 C LYS A 87 -17.919 -17.772 10.535 1.00 5.15 C ATOM 1397 O LYS A 87 -18.667 -16.915 10.064 1.00 13.35 O ATOM 1398 CB LYS A 87 -19.832 -18.864 11.719 1.00 30.45 C ATOM 1399 CG LYS A 87 -20.692 -17.638 11.974 1.00 63.34 C ATOM 1400 CD LYS A 87 -21.492 -17.775 13.258 1.00 0.20 C ATOM 1401 CE LYS A 87 -22.439 -16.601 13.452 1.00 0.42 C ATOM 1402 NZ LYS A 87 -23.650 -16.717 12.594 1.00 51.15 N ATOM 0 H LYS A 87 -18.778 -17.438 13.464 1.00 4.31 H new ATOM 0 HA LYS A 87 -17.785 -19.523 11.754 1.00 12.10 H new ATOM 0 HB2 LYS A 87 -20.086 -19.279 10.744 1.00 30.45 H new ATOM 0 HB3 LYS A 87 -20.071 -19.626 12.461 1.00 30.45 H new ATOM 0 HG2 LYS A 87 -20.058 -16.753 12.032 1.00 63.34 H new ATOM 0 HG3 LYS A 87 -21.372 -17.488 11.135 1.00 63.34 H new ATOM 0 HD2 LYS A 87 -22.062 -18.704 13.236 1.00 0.20 H new ATOM 0 HD3 LYS A 87 -20.811 -17.839 14.107 1.00 0.20 H new ATOM 0 HE2 LYS A 87 -22.739 -16.546 14.498 1.00 0.42 H new ATOM 0 HE3 LYS A 87 -21.918 -15.672 13.221 1.00 0.42 H new ATOM 0 HZ1 LYS A 87 -24.270 -15.898 12.756 1.00 51.15 H new ATOM 0 HZ2 LYS A 87 -23.366 -16.744 11.594 1.00 51.15 H new ATOM 0 HZ3 LYS A 87 -24.162 -17.591 12.832 1.00 51.15 H new ATOM 1416 N LEU A 88 -16.726 -18.052 10.021 1.00 54.02 N ATOM 1417 CA LEU A 88 -16.217 -17.353 8.846 1.00 3.12 C ATOM 1418 C LEU A 88 -16.481 -18.157 7.577 1.00 43.30 C ATOM 1419 O LEU A 88 -15.872 -17.909 6.536 1.00 51.43 O ATOM 1420 CB LEU A 88 -14.717 -17.091 8.995 1.00 60.11 C ATOM 1421 CG LEU A 88 -14.325 -15.941 9.924 1.00 73.15 C ATOM 1422 CD1 LEU A 88 -14.196 -16.433 11.357 1.00 53.41 C ATOM 1423 CD2 LEU A 88 -13.026 -15.299 9.459 1.00 71.31 C ATOM 0 H LEU A 88 -16.094 -18.757 10.399 1.00 54.02 H new ATOM 0 HA LEU A 88 -16.740 -16.400 8.765 1.00 3.12 H new ATOM 0 HB2 LEU A 88 -14.244 -18.003 9.359 1.00 60.11 H new ATOM 0 HB3 LEU A 88 -14.304 -16.890 8.007 1.00 60.11 H new ATOM 0 HG LEU A 88 -15.112 -15.187 9.890 1.00 73.15 H new ATOM 0 HD11 LEU A 88 -13.917 -15.601 12.004 1.00 53.41 H new ATOM 0 HD12 LEU A 88 -15.149 -16.845 11.687 1.00 53.41 H new ATOM 0 HD13 LEU A 88 -13.429 -17.206 11.409 1.00 53.41 H new ATOM 0 HD21 LEU A 88 -12.762 -14.483 10.132 1.00 71.31 H new ATOM 0 HD22 LEU A 88 -12.230 -16.044 9.463 1.00 71.31 H new ATOM 0 HD23 LEU A 88 -13.154 -14.910 8.449 1.00 71.31 H new ATOM 1435 N ILE A 89 -17.393 -19.118 7.671 1.00 63.50 N ATOM 1436 CA ILE A 89 -17.739 -19.956 6.530 1.00 54.05 C ATOM 1437 C ILE A 89 -19.014 -19.463 5.853 1.00 33.43 C ATOM 1438 O ILE A 89 -20.055 -19.321 6.496 1.00 54.14 O ATOM 1439 CB ILE A 89 -17.928 -21.426 6.947 1.00 73.42 C ATOM 1440 CG1 ILE A 89 -16.654 -21.961 7.604 1.00 42.44 C ATOM 1441 CG2 ILE A 89 -18.305 -22.275 5.742 1.00 52.25 C ATOM 1442 CD1 ILE A 89 -16.811 -23.346 8.189 1.00 20.51 C ATOM 0 H ILE A 89 -17.906 -19.336 8.525 1.00 63.50 H new ATOM 0 HA ILE A 89 -16.908 -19.891 5.827 1.00 54.05 H new ATOM 0 HB ILE A 89 -18.739 -21.480 7.673 1.00 73.42 H new ATOM 0 HG12 ILE A 89 -15.853 -21.976 6.865 1.00 42.44 H new ATOM 0 HG13 ILE A 89 -16.346 -21.275 8.393 1.00 42.44 H new ATOM 0 HG21 ILE A 89 -18.435 -23.311 6.053 1.00 52.25 H new ATOM 0 HG22 ILE A 89 -19.237 -21.905 5.314 1.00 52.25 H new ATOM 0 HG23 ILE A 89 -17.514 -22.217 4.994 1.00 52.25 H new ATOM 0 HD11 ILE A 89 -15.869 -23.660 8.638 1.00 20.51 H new ATOM 0 HD12 ILE A 89 -17.589 -23.333 8.952 1.00 20.51 H new ATOM 0 HD13 ILE A 89 -17.088 -24.045 7.400 1.00 20.51 H new ATOM 1454 N HIS A 90 -18.926 -19.206 4.552 1.00 32.02 N ATOM 1455 CA HIS A 90 -20.074 -18.731 3.787 1.00 22.52 C ATOM 1456 C HIS A 90 -20.123 -19.395 2.414 1.00 14.22 C ATOM 1457 O HIS A 90 -19.105 -19.510 1.731 1.00 73.21 O ATOM 1458 CB HIS A 90 -20.016 -17.212 3.630 1.00 2.35 C ATOM 1459 CG HIS A 90 -20.638 -16.468 4.772 1.00 51.43 C ATOM 1460 ND1 HIS A 90 -21.858 -15.831 4.679 1.00 21.23 N ATOM 1461 CD2 HIS A 90 -20.203 -16.262 6.037 1.00 60.02 C ATOM 1462 CE1 HIS A 90 -22.145 -15.265 5.838 1.00 53.23 C ATOM 1463 NE2 HIS A 90 -21.157 -15.512 6.679 1.00 53.22 N ATOM 0 H HIS A 90 -18.072 -19.319 4.005 1.00 32.02 H new ATOM 0 HA HIS A 90 -20.979 -18.997 4.333 1.00 22.52 H new ATOM 0 HB2 HIS A 90 -18.975 -16.905 3.531 1.00 2.35 H new ATOM 0 HB3 HIS A 90 -20.521 -16.931 2.706 1.00 2.35 H new ATOM 0 HD2 HIS A 90 -19.277 -16.621 6.462 1.00 60.02 H new ATOM 0 HE1 HIS A 90 -23.036 -14.697 6.060 1.00 53.23 H new ATOM 0 HE2 HIS A 90 -21.110 -15.197 7.648 1.00 53.22 H new ATOM 1471 N THR A 91 -21.314 -19.831 2.015 1.00 15.43 N ATOM 1472 CA THR A 91 -21.497 -20.484 0.725 1.00 24.14 C ATOM 1473 C THR A 91 -22.621 -19.829 -0.069 1.00 23.01 C ATOM 1474 O THR A 91 -23.781 -19.852 0.343 1.00 44.20 O ATOM 1475 CB THR A 91 -21.808 -21.983 0.894 1.00 35.11 C ATOM 1476 OG1 THR A 91 -20.649 -22.674 1.371 1.00 23.14 O ATOM 1477 CG2 THR A 91 -22.262 -22.593 -0.424 1.00 20.14 C ATOM 0 H THR A 91 -22.167 -19.743 2.568 1.00 15.43 H new ATOM 0 HA THR A 91 -20.560 -20.374 0.179 1.00 24.14 H new ATOM 0 HB THR A 91 -22.614 -22.084 1.620 1.00 35.11 H new ATOM 0 HG1 THR A 91 -20.224 -23.151 0.628 1.00 23.14 H new ATOM 0 HG21 THR A 91 -22.476 -23.652 -0.280 1.00 20.14 H new ATOM 0 HG22 THR A 91 -23.162 -22.085 -0.769 1.00 20.14 H new ATOM 0 HG23 THR A 91 -21.473 -22.480 -1.168 1.00 20.14 H new ATOM 1485 N VAL A 92 -22.270 -19.246 -1.211 1.00 11.21 N ATOM 1486 CA VAL A 92 -23.251 -18.585 -2.064 1.00 65.55 C ATOM 1487 C VAL A 92 -24.116 -19.604 -2.798 1.00 24.43 C ATOM 1488 O VAL A 92 -23.624 -20.368 -3.628 1.00 63.34 O ATOM 1489 CB VAL A 92 -22.568 -17.669 -3.098 1.00 35.32 C ATOM 1490 CG1 VAL A 92 -23.606 -16.999 -3.985 1.00 75.31 C ATOM 1491 CG2 VAL A 92 -21.702 -16.632 -2.400 1.00 13.23 C ATOM 0 H VAL A 92 -21.314 -19.218 -1.567 1.00 11.21 H new ATOM 0 HA VAL A 92 -23.881 -17.980 -1.412 1.00 65.55 H new ATOM 0 HB VAL A 92 -21.924 -18.280 -3.731 1.00 35.32 H new ATOM 0 HG11 VAL A 92 -23.105 -16.356 -4.709 1.00 75.31 H new ATOM 0 HG12 VAL A 92 -24.180 -17.761 -4.512 1.00 75.31 H new ATOM 0 HG13 VAL A 92 -24.277 -16.399 -3.370 1.00 75.31 H new ATOM 0 HG21 VAL A 92 -21.227 -15.994 -3.145 1.00 13.23 H new ATOM 0 HG22 VAL A 92 -22.322 -16.023 -1.743 1.00 13.23 H new ATOM 0 HG23 VAL A 92 -20.935 -17.135 -1.811 1.00 13.23 H new ATOM 1501 N ARG A 93 -25.407 -19.610 -2.485 1.00 53.20 N ATOM 1502 CA ARG A 93 -26.342 -20.536 -3.114 1.00 3.42 C ATOM 1503 C ARG A 93 -26.238 -20.464 -4.634 1.00 51.44 C ATOM 1504 O ARG A 93 -26.742 -19.530 -5.258 1.00 20.33 O ATOM 1505 CB ARG A 93 -27.774 -20.225 -2.674 1.00 62.32 C ATOM 1506 CG ARG A 93 -28.769 -21.320 -3.024 1.00 1.31 C ATOM 1507 CD ARG A 93 -28.584 -22.544 -2.140 1.00 51.45 C ATOM 1508 NE ARG A 93 -29.420 -23.661 -2.572 1.00 21.04 N ATOM 1509 CZ ARG A 93 -29.710 -24.702 -1.799 1.00 73.25 C ATOM 1510 NH1 ARG A 93 -29.235 -24.768 -0.563 1.00 74.14 N ATOM 1511 NH2 ARG A 93 -30.478 -25.680 -2.263 1.00 61.14 N ATOM 0 H ARG A 93 -25.830 -18.984 -1.800 1.00 53.20 H new ATOM 0 HA ARG A 93 -26.083 -21.546 -2.797 1.00 3.42 H new ATOM 0 HB2 ARG A 93 -27.787 -20.064 -1.596 1.00 62.32 H new ATOM 0 HB3 ARG A 93 -28.094 -19.293 -3.139 1.00 62.32 H new ATOM 0 HG2 ARG A 93 -29.784 -20.940 -2.913 1.00 1.31 H new ATOM 0 HG3 ARG A 93 -28.647 -21.603 -4.070 1.00 1.31 H new ATOM 0 HD2 ARG A 93 -27.537 -22.847 -2.155 1.00 51.45 H new ATOM 0 HD3 ARG A 93 -28.827 -22.287 -1.109 1.00 51.45 H new ATOM 0 HE ARG A 93 -29.802 -23.641 -3.518 1.00 21.04 H new ATOM 0 HH11 ARG A 93 -28.645 -24.018 -0.203 1.00 74.14 H new ATOM 0 HH12 ARG A 93 -29.460 -25.569 0.028 1.00 74.14 H new ATOM 0 HH21 ARG A 93 -30.846 -25.633 -3.213 1.00 61.14 H new ATOM 0 HH22 ARG A 93 -30.700 -26.479 -1.669 1.00 61.14 H new ATOM 1525 N GLY A 94 -25.580 -21.456 -5.226 1.00 31.55 N ATOM 1526 CA GLY A 94 -25.422 -21.486 -6.668 1.00 24.33 C ATOM 1527 C GLY A 94 -24.090 -20.917 -7.117 1.00 34.14 C ATOM 1528 O GLY A 94 -24.016 -20.216 -8.125 1.00 40.11 O ATOM 0 H GLY A 94 -25.153 -22.240 -4.732 1.00 31.55 H new ATOM 0 HA2 GLY A 94 -25.511 -22.514 -7.019 1.00 24.33 H new ATOM 0 HA3 GLY A 94 -26.230 -20.920 -7.131 1.00 24.33 H new ATOM 1532 N ALA A 95 -23.036 -21.218 -6.365 1.00 54.11 N ATOM 1533 CA ALA A 95 -21.702 -20.732 -6.691 1.00 44.55 C ATOM 1534 C ALA A 95 -20.635 -21.743 -6.287 1.00 63.34 C ATOM 1535 O ALA A 95 -20.000 -22.364 -7.139 1.00 5.21 O ATOM 1536 CB ALA A 95 -21.447 -19.394 -6.013 1.00 41.41 C ATOM 0 H ALA A 95 -23.081 -21.796 -5.526 1.00 54.11 H new ATOM 0 HA ALA A 95 -21.646 -20.596 -7.771 1.00 44.55 H new ATOM 0 HB1 ALA A 95 -20.446 -19.043 -6.266 1.00 41.41 H new ATOM 0 HB2 ALA A 95 -22.184 -18.667 -6.355 1.00 41.41 H new ATOM 0 HB3 ALA A 95 -21.528 -19.512 -4.932 1.00 41.41 H new ATOM 1542 N GLY A 96 -20.442 -21.904 -4.982 1.00 32.24 N ATOM 1543 CA GLY A 96 -19.450 -22.841 -4.488 1.00 33.41 C ATOM 1544 C GLY A 96 -19.158 -22.653 -3.012 1.00 75.14 C ATOM 1545 O GLY A 96 -19.994 -22.964 -2.163 1.00 4.43 O ATOM 0 H GLY A 96 -20.955 -21.402 -4.257 1.00 32.24 H new ATOM 0 HA2 GLY A 96 -19.800 -23.859 -4.659 1.00 33.41 H new ATOM 0 HA3 GLY A 96 -18.527 -22.721 -5.056 1.00 33.41 H new ATOM 1549 N TYR A 97 -17.970 -22.145 -2.706 1.00 50.34 N ATOM 1550 CA TYR A 97 -17.568 -21.919 -1.323 1.00 34.40 C ATOM 1551 C TYR A 97 -16.671 -20.691 -1.209 1.00 52.34 C ATOM 1552 O TYR A 97 -15.858 -20.418 -2.092 1.00 44.41 O ATOM 1553 CB TYR A 97 -16.841 -23.148 -0.775 1.00 31.25 C ATOM 1554 CG TYR A 97 -17.333 -23.586 0.587 1.00 51.43 C ATOM 1555 CD1 TYR A 97 -18.395 -24.473 0.711 1.00 11.45 C ATOM 1556 CD2 TYR A 97 -16.735 -23.112 1.748 1.00 21.32 C ATOM 1557 CE1 TYR A 97 -18.848 -24.874 1.953 1.00 32.11 C ATOM 1558 CE2 TYR A 97 -17.180 -23.510 2.994 1.00 15.40 C ATOM 1559 CZ TYR A 97 -18.238 -24.390 3.091 1.00 24.13 C ATOM 1560 OH TYR A 97 -18.685 -24.789 4.330 1.00 52.10 O ATOM 0 H TYR A 97 -17.268 -21.882 -3.397 1.00 50.34 H new ATOM 0 HA TYR A 97 -18.468 -21.744 -0.734 1.00 34.40 H new ATOM 0 HB2 TYR A 97 -16.960 -23.973 -1.477 1.00 31.25 H new ATOM 0 HB3 TYR A 97 -15.774 -22.932 -0.714 1.00 31.25 H new ATOM 0 HD1 TYR A 97 -18.874 -24.855 -0.178 1.00 11.45 H new ATOM 0 HD2 TYR A 97 -15.908 -22.421 1.675 1.00 21.32 H new ATOM 0 HE1 TYR A 97 -19.676 -25.563 2.032 1.00 32.11 H new ATOM 0 HE2 TYR A 97 -16.702 -23.134 3.887 1.00 15.40 H new ATOM 0 HH TYR A 97 -18.995 -25.717 4.282 1.00 52.10 H new ATOM 1570 N VAL A 98 -16.826 -19.952 -0.115 1.00 24.52 N ATOM 1571 CA VAL A 98 -16.029 -18.753 0.117 1.00 33.43 C ATOM 1572 C VAL A 98 -15.913 -18.450 1.607 1.00 72.51 C ATOM 1573 O VAL A 98 -16.696 -18.951 2.416 1.00 5.22 O ATOM 1574 CB VAL A 98 -16.634 -17.531 -0.598 1.00 41.14 C ATOM 1575 CG1 VAL A 98 -17.848 -17.015 0.159 1.00 1.11 C ATOM 1576 CG2 VAL A 98 -15.589 -16.436 -0.757 1.00 74.41 C ATOM 0 H VAL A 98 -17.496 -20.163 0.625 1.00 24.52 H new ATOM 0 HA VAL A 98 -15.037 -18.949 -0.289 1.00 33.43 H new ATOM 0 HB VAL A 98 -16.960 -17.838 -1.592 1.00 41.14 H new ATOM 0 HG11 VAL A 98 -18.262 -16.151 -0.362 1.00 1.11 H new ATOM 0 HG12 VAL A 98 -18.602 -17.800 0.216 1.00 1.11 H new ATOM 0 HG13 VAL A 98 -17.552 -16.723 1.167 1.00 1.11 H new ATOM 0 HG21 VAL A 98 -16.034 -15.580 -1.264 1.00 74.41 H new ATOM 0 HG22 VAL A 98 -15.231 -16.130 0.226 1.00 74.41 H new ATOM 0 HG23 VAL A 98 -14.753 -16.813 -1.347 1.00 74.41 H new ATOM 1586 N LEU A 99 -14.933 -17.628 1.963 1.00 63.00 N ATOM 1587 CA LEU A 99 -14.714 -17.257 3.357 1.00 43.23 C ATOM 1588 C LEU A 99 -15.072 -15.793 3.593 1.00 23.10 C ATOM 1589 O LEU A 99 -14.950 -14.962 2.694 1.00 5.21 O ATOM 1590 CB LEU A 99 -13.256 -17.507 3.749 1.00 54.14 C ATOM 1591 CG LEU A 99 -12.218 -17.287 2.648 1.00 50.11 C ATOM 1592 CD1 LEU A 99 -12.242 -15.842 2.173 1.00 62.54 C ATOM 1593 CD2 LEU A 99 -10.829 -17.665 3.142 1.00 72.04 C ATOM 0 H LEU A 99 -14.277 -17.205 1.306 1.00 63.00 H new ATOM 0 HA LEU A 99 -15.362 -17.875 3.978 1.00 43.23 H new ATOM 0 HB2 LEU A 99 -13.010 -16.856 4.588 1.00 54.14 H new ATOM 0 HB3 LEU A 99 -13.167 -18.534 4.105 1.00 54.14 H new ATOM 0 HG LEU A 99 -12.469 -17.930 1.804 1.00 50.11 H new ATOM 0 HD11 LEU A 99 -11.497 -15.704 1.390 1.00 62.54 H new ATOM 0 HD12 LEU A 99 -13.230 -15.605 1.780 1.00 62.54 H new ATOM 0 HD13 LEU A 99 -12.016 -15.180 3.009 1.00 62.54 H new ATOM 0 HD21 LEU A 99 -10.103 -17.502 2.346 1.00 72.04 H new ATOM 0 HD22 LEU A 99 -10.568 -17.048 4.002 1.00 72.04 H new ATOM 0 HD23 LEU A 99 -10.820 -18.716 3.432 1.00 72.04 H new ATOM 1605 N GLU A 100 -15.512 -15.486 4.809 1.00 13.21 N ATOM 1606 CA GLU A 100 -15.886 -14.122 5.163 1.00 14.42 C ATOM 1607 C GLU A 100 -15.697 -13.876 6.657 1.00 1.13 C ATOM 1608 O GLU A 100 -15.199 -14.739 7.381 1.00 45.05 O ATOM 1609 CB GLU A 100 -17.340 -13.850 4.771 1.00 51.32 C ATOM 1610 CG GLU A 100 -17.576 -13.851 3.270 1.00 61.43 C ATOM 1611 CD GLU A 100 -16.762 -12.794 2.550 1.00 3.31 C ATOM 1612 OE1 GLU A 100 -16.394 -11.788 3.192 1.00 32.15 O ATOM 1613 OE2 GLU A 100 -16.492 -12.973 1.344 1.00 41.42 O ATOM 0 H GLU A 100 -15.618 -16.163 5.565 1.00 13.21 H new ATOM 0 HA GLU A 100 -15.235 -13.441 4.615 1.00 14.42 H new ATOM 0 HB2 GLU A 100 -17.979 -14.604 5.231 1.00 51.32 H new ATOM 0 HB3 GLU A 100 -17.643 -12.885 5.177 1.00 51.32 H new ATOM 0 HG2 GLU A 100 -17.326 -14.833 2.868 1.00 61.43 H new ATOM 0 HG3 GLU A 100 -18.635 -13.685 3.073 1.00 61.43 H new ATOM 1620 N ILE A 101 -16.097 -12.693 7.112 1.00 75.42 N ATOM 1621 CA ILE A 101 -15.972 -12.334 8.519 1.00 75.11 C ATOM 1622 C ILE A 101 -17.283 -11.775 9.062 1.00 40.51 C ATOM 1623 O ILE A 101 -18.260 -11.631 8.327 1.00 52.10 O ATOM 1624 CB ILE A 101 -14.855 -11.298 8.738 1.00 3.51 C ATOM 1625 CG1 ILE A 101 -15.140 -10.029 7.931 1.00 64.54 C ATOM 1626 CG2 ILE A 101 -13.505 -11.885 8.354 1.00 40.23 C ATOM 1627 CD1 ILE A 101 -14.602 -10.080 6.517 1.00 15.34 C ATOM 0 H ILE A 101 -16.510 -11.967 6.527 1.00 75.42 H new ATOM 0 HA ILE A 101 -15.719 -13.248 9.057 1.00 75.11 H new ATOM 0 HB ILE A 101 -14.827 -11.034 9.795 1.00 3.51 H new ATOM 0 HG12 ILE A 101 -16.217 -9.864 7.896 1.00 64.54 H new ATOM 0 HG13 ILE A 101 -14.703 -9.174 8.447 1.00 64.54 H new ATOM 0 HG21 ILE A 101 -12.725 -11.140 8.514 1.00 40.23 H new ATOM 0 HG22 ILE A 101 -13.301 -12.762 8.969 1.00 40.23 H new ATOM 0 HG23 ILE A 101 -13.520 -12.174 7.303 1.00 40.23 H new ATOM 0 HD11 ILE A 101 -14.840 -9.148 6.003 1.00 15.34 H new ATOM 0 HD12 ILE A 101 -13.521 -10.214 6.544 1.00 15.34 H new ATOM 0 HD13 ILE A 101 -15.058 -10.915 5.984 1.00 15.34 H new ATOM 1639 N ARG A 102 -17.295 -11.459 10.353 1.00 54.43 N ATOM 1640 CA ARG A 102 -18.486 -10.914 10.994 1.00 3.35 C ATOM 1641 C ARG A 102 -18.574 -9.405 10.784 1.00 12.04 C ATOM 1642 O ARG A 102 -19.660 -8.828 10.814 1.00 15.33 O ATOM 1643 CB ARG A 102 -18.475 -11.231 12.491 1.00 61.31 C ATOM 1644 CG ARG A 102 -18.987 -12.624 12.822 1.00 43.23 C ATOM 1645 CD ARG A 102 -20.504 -12.651 12.917 1.00 31.42 C ATOM 1646 NE ARG A 102 -21.134 -12.726 11.602 1.00 50.33 N ATOM 1647 CZ ARG A 102 -22.419 -12.468 11.387 1.00 52.23 C ATOM 1648 NH1 ARG A 102 -23.207 -12.120 12.395 1.00 22.21 N ATOM 1649 NH2 ARG A 102 -22.919 -12.557 10.161 1.00 50.13 N ATOM 0 H ARG A 102 -16.494 -11.571 10.975 1.00 54.43 H new ATOM 0 HA ARG A 102 -19.359 -11.379 10.537 1.00 3.35 H new ATOM 0 HB2 ARG A 102 -17.458 -11.128 12.868 1.00 61.31 H new ATOM 0 HB3 ARG A 102 -19.085 -10.495 13.014 1.00 61.31 H new ATOM 0 HG2 ARG A 102 -18.657 -13.326 12.056 1.00 43.23 H new ATOM 0 HG3 ARG A 102 -18.556 -12.956 13.766 1.00 43.23 H new ATOM 0 HD2 ARG A 102 -20.814 -13.507 13.517 1.00 31.42 H new ATOM 0 HD3 ARG A 102 -20.851 -11.756 13.434 1.00 31.42 H new ATOM 0 HE ARG A 102 -20.556 -12.991 10.805 1.00 50.33 H new ATOM 0 HH11 ARG A 102 -22.827 -12.050 13.339 1.00 22.21 H new ATOM 0 HH12 ARG A 102 -24.193 -11.922 12.227 1.00 22.21 H new ATOM 0 HH21 ARG A 102 -22.316 -12.824 9.383 1.00 50.13 H new ATOM 0 HH22 ARG A 102 -23.906 -12.359 9.997 1.00 50.13 H new ATOM 1663 N GLU A 103 -17.424 -8.774 10.573 1.00 43.53 N ATOM 1664 CA GLU A 103 -17.372 -7.332 10.359 1.00 12.03 C ATOM 1665 C GLU A 103 -18.184 -6.935 9.130 1.00 42.24 C ATOM 1666 O GLU A 103 -18.778 -5.858 9.087 1.00 5.11 O ATOM 1667 CB GLU A 103 -15.923 -6.869 10.199 1.00 63.24 C ATOM 1668 CG GLU A 103 -14.983 -7.435 11.250 1.00 61.31 C ATOM 1669 CD GLU A 103 -13.812 -6.516 11.542 1.00 75.44 C ATOM 1670 OE1 GLU A 103 -13.284 -5.907 10.588 1.00 24.44 O ATOM 1671 OE2 GLU A 103 -13.426 -6.406 12.724 1.00 21.31 O ATOM 0 H GLU A 103 -16.516 -9.238 10.546 1.00 43.53 H new ATOM 0 HA GLU A 103 -17.806 -6.845 11.232 1.00 12.03 H new ATOM 0 HB2 GLU A 103 -15.565 -7.158 9.211 1.00 63.24 H new ATOM 0 HB3 GLU A 103 -15.891 -5.780 10.244 1.00 63.24 H new ATOM 0 HG2 GLU A 103 -15.539 -7.613 12.171 1.00 61.31 H new ATOM 0 HG3 GLU A 103 -14.607 -8.401 10.913 1.00 61.31 H new ATOM 1678 N GLU A 104 -18.203 -7.813 8.131 1.00 0.35 N ATOM 1679 CA GLU A 104 -18.940 -7.553 6.901 1.00 52.25 C ATOM 1680 C GLU A 104 -20.416 -7.297 7.194 1.00 62.44 C ATOM 1681 O GLU A 104 -21.199 -8.234 7.346 1.00 53.11 O ATOM 1682 CB GLU A 104 -18.797 -8.732 5.936 1.00 51.34 C ATOM 1683 CG GLU A 104 -19.643 -8.597 4.681 1.00 71.14 C ATOM 1684 CD GLU A 104 -19.444 -9.750 3.716 1.00 22.33 C ATOM 1685 OE1 GLU A 104 -18.945 -10.809 4.153 1.00 2.42 O ATOM 1686 OE2 GLU A 104 -19.786 -9.595 2.526 1.00 52.23 O ATOM 0 H GLU A 104 -17.717 -8.709 8.150 1.00 0.35 H new ATOM 0 HA GLU A 104 -18.520 -6.660 6.438 1.00 52.25 H new ATOM 0 HB2 GLU A 104 -17.750 -8.831 5.649 1.00 51.34 H new ATOM 0 HB3 GLU A 104 -19.074 -9.650 6.454 1.00 51.34 H new ATOM 0 HG2 GLU A 104 -20.695 -8.540 4.961 1.00 71.14 H new ATOM 0 HG3 GLU A 104 -19.395 -7.661 4.179 1.00 71.14 H new