USER MOD reduce.3.24.130724 H: found=0, std=0, add=846, rem=0, adj=20 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 Set 1.1: A 55 SER OG : rot -120:sc= -0.106 USER MOD Set 1.2: A 60 MET CE :methyl 151:sc= -0.0446 (180deg=0) USER MOD Single : A 4 THR OG1 : rot -33:sc= 0.122 USER MOD Single : A 6 CYS SG : rot 180:sc= 0 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.0119 USER MOD Single : A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot -46:sc= 0.52 USER MOD Single : A 25 LYS NZ :NH3+ -179:sc= -0.446 (180deg=-0.466) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 HIS : no HD1:sc= 0 X(o=0,f=-0.025) USER MOD Single : A 30 THR OG1 : rot -112:sc= 0.0602 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 GLN : amide:sc= -1.4 K(o=-1.4,f=-3.1) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.182 USER MOD Single : A 51 SER OG : rot 180:sc= 0.0239 USER MOD Single : A 54 SER OG : rot 44:sc= 0.803 USER MOD Single : A 59 ASN : amide:sc= -0.317 X(o=-0.32,f=-0.011) USER MOD Single : A 61 ASN : amide:sc= 0.173 K(o=0.17,f=-4.4!) USER MOD Single : A 64 SER OG : rot 180:sc= 0.111 USER MOD Single : A 66 THR OG1 : rot -53:sc= 0.867 USER MOD Single : A 67 ASN : amide:sc= -0.143 X(o=-0.14,f=-0.02) USER MOD Single : A 78 SER OG : rot -14:sc= 0.328 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00241) USER MOD Single : A 90 HIS : no HD1:sc= -0.116 X(o=-0.12,f=-0.26) USER MOD Single : A 91 THR OG1 : rot -159:sc= -0.095 USER MOD Single : A 97 TYR OH : rot 122:sc= 1.06 USER MOD ----------------------------------------------------------------- ATOM 38 N THR A 4 0.362 -8.326 -0.382 1.00 24.12 N ATOM 39 CA THR A 4 0.779 -9.711 -0.201 1.00 3.22 C ATOM 40 C THR A 4 0.379 -10.230 1.176 1.00 43.05 C ATOM 41 O THR A 4 1.042 -11.102 1.738 1.00 73.22 O ATOM 42 CB THR A 4 2.302 -9.866 -0.373 1.00 21.12 C ATOM 43 OG1 THR A 4 2.989 -8.966 0.504 1.00 15.11 O ATOM 44 CG2 THR A 4 2.715 -9.594 -1.812 1.00 13.15 C ATOM 0 HA THR A 4 0.273 -10.297 -0.968 1.00 3.22 H new ATOM 0 HB THR A 4 2.571 -10.892 -0.122 1.00 21.12 H new ATOM 0 HG1 THR A 4 2.466 -8.143 0.604 1.00 15.11 H new ATOM 0 HG21 THR A 4 3.795 -9.710 -1.909 1.00 13.15 H new ATOM 0 HG22 THR A 4 2.214 -10.300 -2.474 1.00 13.15 H new ATOM 0 HG23 THR A 4 2.433 -8.577 -2.085 1.00 13.15 H new ATOM 52 N VAL A 5 -0.709 -9.689 1.714 1.00 72.03 N ATOM 53 CA VAL A 5 -1.199 -10.099 3.024 1.00 22.43 C ATOM 54 C VAL A 5 -2.574 -9.506 3.307 1.00 35.53 C ATOM 55 O VAL A 5 -2.785 -8.302 3.158 1.00 33.22 O ATOM 56 CB VAL A 5 -0.229 -9.676 4.144 1.00 51.25 C ATOM 57 CG1 VAL A 5 -0.070 -8.163 4.169 1.00 74.24 C ATOM 58 CG2 VAL A 5 -0.713 -10.192 5.490 1.00 2.34 C ATOM 0 H VAL A 5 -1.268 -8.965 1.262 1.00 72.03 H new ATOM 0 HA VAL A 5 -1.272 -11.186 3.008 1.00 22.43 H new ATOM 0 HB VAL A 5 0.747 -10.117 3.942 1.00 51.25 H new ATOM 0 HG11 VAL A 5 0.618 -7.883 4.966 1.00 74.24 H new ATOM 0 HG12 VAL A 5 0.325 -7.823 3.212 1.00 74.24 H new ATOM 0 HG13 VAL A 5 -1.040 -7.698 4.347 1.00 74.24 H new ATOM 0 HG21 VAL A 5 -0.016 -9.884 6.270 1.00 2.34 H new ATOM 0 HG22 VAL A 5 -1.700 -9.782 5.703 1.00 2.34 H new ATOM 0 HG23 VAL A 5 -0.770 -11.280 5.463 1.00 2.34 H new ATOM 68 N CYS A 6 -3.507 -10.359 3.717 1.00 71.23 N ATOM 69 CA CYS A 6 -4.864 -9.920 4.021 1.00 53.21 C ATOM 70 C CYS A 6 -5.210 -10.195 5.481 1.00 53.53 C ATOM 71 O CYS A 6 -5.101 -11.326 5.954 1.00 5.05 O ATOM 72 CB CYS A 6 -5.867 -10.623 3.105 1.00 15.14 C ATOM 73 SG CYS A 6 -6.305 -9.679 1.627 1.00 40.23 S ATOM 0 H CYS A 6 -3.348 -11.358 3.846 1.00 71.23 H new ATOM 0 HA CYS A 6 -4.919 -8.845 3.850 1.00 53.21 H new ATOM 0 HB2 CYS A 6 -5.452 -11.584 2.800 1.00 15.14 H new ATOM 0 HB3 CYS A 6 -6.775 -10.833 3.671 1.00 15.14 H new ATOM 0 HG CYS A 6 -7.156 -10.357 0.915 1.00 40.23 H new ATOM 79 N THR A 7 -5.628 -9.151 6.191 1.00 23.11 N ATOM 80 CA THR A 7 -5.987 -9.279 7.598 1.00 51.32 C ATOM 81 C THR A 7 -7.487 -9.492 7.765 1.00 52.11 C ATOM 82 O THR A 7 -8.282 -9.063 6.927 1.00 5.15 O ATOM 83 CB THR A 7 -5.564 -8.034 8.401 1.00 73.03 C ATOM 84 OG1 THR A 7 -4.826 -7.138 7.563 1.00 54.34 O ATOM 85 CG2 THR A 7 -4.717 -8.427 9.602 1.00 52.24 C ATOM 0 H THR A 7 -5.726 -8.208 5.815 1.00 23.11 H new ATOM 0 HA THR A 7 -5.454 -10.149 7.983 1.00 51.32 H new ATOM 0 HB THR A 7 -6.465 -7.536 8.759 1.00 73.03 H new ATOM 0 HG1 THR A 7 -4.562 -6.349 8.080 1.00 54.34 H new ATOM 0 HG21 THR A 7 -4.430 -7.532 10.154 1.00 52.24 H new ATOM 0 HG22 THR A 7 -5.292 -9.086 10.253 1.00 52.24 H new ATOM 0 HG23 THR A 7 -3.821 -8.946 9.261 1.00 52.24 H new ATOM 93 N ILE A 8 -7.868 -10.156 8.851 1.00 73.02 N ATOM 94 CA ILE A 8 -9.274 -10.424 9.128 1.00 51.13 C ATOM 95 C ILE A 8 -9.657 -9.959 10.529 1.00 43.13 C ATOM 96 O ILE A 8 -8.881 -9.283 11.203 1.00 45.42 O ATOM 97 CB ILE A 8 -9.599 -11.923 8.990 1.00 53.02 C ATOM 98 CG1 ILE A 8 -8.317 -12.726 8.761 1.00 74.25 C ATOM 99 CG2 ILE A 8 -10.583 -12.149 7.852 1.00 52.14 C ATOM 100 CD1 ILE A 8 -7.771 -12.604 7.355 1.00 4.45 C ATOM 0 H ILE A 8 -7.223 -10.518 9.553 1.00 73.02 H new ATOM 0 HA ILE A 8 -9.853 -9.866 8.392 1.00 51.13 H new ATOM 0 HB ILE A 8 -10.060 -12.267 9.916 1.00 53.02 H new ATOM 0 HG12 ILE A 8 -7.557 -12.392 9.467 1.00 74.25 H new ATOM 0 HG13 ILE A 8 -8.512 -13.776 8.976 1.00 74.25 H new ATOM 0 HG21 ILE A 8 -10.803 -13.213 7.767 1.00 52.14 H new ATOM 0 HG22 ILE A 8 -11.505 -11.603 8.054 1.00 52.14 H new ATOM 0 HG23 ILE A 8 -10.148 -11.793 6.918 1.00 52.14 H new ATOM 0 HD11 ILE A 8 -6.862 -13.199 7.265 1.00 4.45 H new ATOM 0 HD12 ILE A 8 -8.514 -12.966 6.644 1.00 4.45 H new ATOM 0 HD13 ILE A 8 -7.544 -11.559 7.142 1.00 4.45 H new ATOM 112 N ALA A 9 -10.858 -10.328 10.961 1.00 20.01 N ATOM 113 CA ALA A 9 -11.342 -9.952 12.284 1.00 74.35 C ATOM 114 C ALA A 9 -10.273 -10.183 13.346 1.00 72.10 C ATOM 115 O ALA A 9 -10.024 -9.319 14.187 1.00 64.30 O ATOM 116 CB ALA A 9 -12.604 -10.731 12.624 1.00 15.11 C ATOM 0 H ALA A 9 -11.514 -10.887 10.415 1.00 20.01 H new ATOM 0 HA ALA A 9 -11.577 -8.888 12.269 1.00 74.35 H new ATOM 0 HB1 ALA A 9 -12.955 -10.441 13.614 1.00 15.11 H new ATOM 0 HB2 ALA A 9 -13.376 -10.512 11.887 1.00 15.11 H new ATOM 0 HB3 ALA A 9 -12.386 -11.799 12.615 1.00 15.11 H new ATOM 122 N ASP A 10 -9.646 -11.353 13.302 1.00 25.04 N ATOM 123 CA ASP A 10 -8.602 -11.697 14.262 1.00 74.34 C ATOM 124 C ASP A 10 -7.670 -12.762 13.692 1.00 74.20 C ATOM 125 O ASP A 10 -7.524 -13.842 14.263 1.00 31.41 O ATOM 126 CB ASP A 10 -9.224 -12.192 15.568 1.00 34.22 C ATOM 127 CG ASP A 10 -9.932 -11.087 16.328 1.00 61.23 C ATOM 128 OD1 ASP A 10 -11.124 -10.843 16.047 1.00 72.10 O ATOM 129 OD2 ASP A 10 -9.293 -10.467 17.203 1.00 15.03 O ATOM 0 H ASP A 10 -9.842 -12.079 12.613 1.00 25.04 H new ATOM 0 HA ASP A 10 -8.018 -10.799 14.464 1.00 74.34 H new ATOM 0 HB2 ASP A 10 -9.933 -12.991 15.350 1.00 34.22 H new ATOM 0 HB3 ASP A 10 -8.445 -12.621 16.198 1.00 34.22 H new ATOM 134 N MET A 11 -7.044 -12.450 12.562 1.00 5.15 N ATOM 135 CA MET A 11 -6.126 -13.381 11.916 1.00 44.51 C ATOM 136 C MET A 11 -5.340 -12.687 10.808 1.00 63.14 C ATOM 137 O MET A 11 -5.659 -11.565 10.414 1.00 51.21 O ATOM 138 CB MET A 11 -6.894 -14.573 11.343 1.00 51.12 C ATOM 139 CG MET A 11 -6.107 -15.873 11.371 1.00 35.34 C ATOM 140 SD MET A 11 -7.152 -17.310 11.683 1.00 44.12 S ATOM 141 CE MET A 11 -7.969 -17.484 10.099 1.00 71.13 C ATOM 0 H MET A 11 -7.155 -11.561 12.075 1.00 5.15 H new ATOM 0 HA MET A 11 -5.422 -13.739 12.667 1.00 44.51 H new ATOM 0 HB2 MET A 11 -7.818 -14.705 11.907 1.00 51.12 H new ATOM 0 HB3 MET A 11 -7.177 -14.351 10.314 1.00 51.12 H new ATOM 0 HG2 MET A 11 -5.592 -16.002 10.419 1.00 35.34 H new ATOM 0 HG3 MET A 11 -5.339 -15.812 12.142 1.00 35.34 H new ATOM 0 HE1 MET A 11 -8.651 -18.334 10.133 1.00 71.13 H new ATOM 0 HE2 MET A 11 -8.531 -16.576 9.878 1.00 71.13 H new ATOM 0 HE3 MET A 11 -7.223 -17.648 9.321 1.00 71.13 H new ATOM 151 N THR A 12 -4.309 -13.362 10.307 1.00 32.14 N ATOM 152 CA THR A 12 -3.477 -12.810 9.246 1.00 61.31 C ATOM 153 C THR A 12 -3.258 -13.829 8.133 1.00 23.24 C ATOM 154 O THR A 12 -2.530 -14.807 8.308 1.00 40.35 O ATOM 155 CB THR A 12 -2.108 -12.354 9.785 1.00 13.51 C ATOM 156 OG1 THR A 12 -2.279 -11.649 11.020 1.00 24.01 O ATOM 157 CG2 THR A 12 -1.401 -11.459 8.778 1.00 13.33 C ATOM 0 H THR A 12 -4.031 -14.292 10.620 1.00 32.14 H new ATOM 0 HA THR A 12 -4.008 -11.946 8.845 1.00 61.31 H new ATOM 0 HB THR A 12 -1.495 -13.239 9.954 1.00 13.51 H new ATOM 0 HG1 THR A 12 -1.404 -11.364 11.358 1.00 24.01 H new ATOM 0 HG21 THR A 12 -0.437 -11.149 9.181 1.00 13.33 H new ATOM 0 HG22 THR A 12 -1.247 -12.008 7.849 1.00 13.33 H new ATOM 0 HG23 THR A 12 -2.012 -10.578 8.582 1.00 13.33 H new ATOM 165 N VAL A 13 -3.891 -13.594 6.989 1.00 73.13 N ATOM 166 CA VAL A 13 -3.764 -14.491 5.846 1.00 2.02 C ATOM 167 C VAL A 13 -2.612 -14.068 4.942 1.00 62.24 C ATOM 168 O VAL A 13 -2.402 -12.879 4.701 1.00 73.24 O ATOM 169 CB VAL A 13 -5.062 -14.534 5.019 1.00 74.20 C ATOM 170 CG1 VAL A 13 -4.872 -15.381 3.770 1.00 60.11 C ATOM 171 CG2 VAL A 13 -6.213 -15.063 5.862 1.00 70.44 C ATOM 0 H VAL A 13 -4.497 -12.790 6.828 1.00 73.13 H new ATOM 0 HA VAL A 13 -3.563 -15.485 6.245 1.00 2.02 H new ATOM 0 HB VAL A 13 -5.307 -13.519 4.706 1.00 74.20 H new ATOM 0 HG11 VAL A 13 -5.800 -15.400 3.198 1.00 60.11 H new ATOM 0 HG12 VAL A 13 -4.077 -14.954 3.158 1.00 60.11 H new ATOM 0 HG13 VAL A 13 -4.602 -16.397 4.057 1.00 60.11 H new ATOM 0 HG21 VAL A 13 -7.123 -15.087 5.262 1.00 70.44 H new ATOM 0 HG22 VAL A 13 -5.979 -16.070 6.206 1.00 70.44 H new ATOM 0 HG23 VAL A 13 -6.363 -14.411 6.723 1.00 70.44 H new ATOM 181 N ASP A 14 -1.868 -15.049 4.443 1.00 22.41 N ATOM 182 CA ASP A 14 -0.737 -14.780 3.563 1.00 42.32 C ATOM 183 C ASP A 14 -0.969 -15.381 2.180 1.00 23.33 C ATOM 184 O ASP A 14 -1.061 -16.599 2.030 1.00 23.33 O ATOM 185 CB ASP A 14 0.552 -15.340 4.167 1.00 52.11 C ATOM 186 CG ASP A 14 1.685 -14.333 4.150 1.00 12.30 C ATOM 187 OD1 ASP A 14 1.683 -13.451 3.265 1.00 74.42 O ATOM 188 OD2 ASP A 14 2.573 -14.425 5.023 1.00 61.05 O ATOM 0 H ASP A 14 -2.028 -16.038 4.633 1.00 22.41 H new ATOM 0 HA ASP A 14 -0.640 -13.699 3.458 1.00 42.32 H new ATOM 0 HB2 ASP A 14 0.363 -15.652 5.194 1.00 52.11 H new ATOM 0 HB3 ASP A 14 0.852 -16.230 3.614 1.00 52.11 H new ATOM 193 N MET A 15 -1.063 -14.519 1.174 1.00 52.14 N ATOM 194 CA MET A 15 -1.284 -14.966 -0.197 1.00 14.22 C ATOM 195 C MET A 15 0.029 -15.380 -0.852 1.00 61.23 C ATOM 196 O MET A 15 0.035 -16.003 -1.914 1.00 42.44 O ATOM 197 CB MET A 15 -1.950 -13.858 -1.016 1.00 64.11 C ATOM 198 CG MET A 15 -1.005 -12.726 -1.387 1.00 73.10 C ATOM 199 SD MET A 15 -1.796 -11.468 -2.408 1.00 15.23 S ATOM 200 CE MET A 15 -1.667 -12.217 -4.030 1.00 4.34 C ATOM 0 H MET A 15 -0.990 -13.507 1.281 1.00 52.14 H new ATOM 0 HA MET A 15 -1.944 -15.833 -0.168 1.00 14.22 H new ATOM 0 HB2 MET A 15 -2.363 -14.289 -1.928 1.00 64.11 H new ATOM 0 HB3 MET A 15 -2.787 -13.451 -0.449 1.00 64.11 H new ATOM 0 HG2 MET A 15 -0.624 -12.263 -0.477 1.00 73.10 H new ATOM 0 HG3 MET A 15 -0.147 -13.134 -1.920 1.00 73.10 H new ATOM 0 HE1 MET A 15 -2.114 -11.556 -4.773 1.00 4.34 H new ATOM 0 HE2 MET A 15 -0.617 -12.379 -4.274 1.00 4.34 H new ATOM 0 HE3 MET A 15 -2.191 -13.173 -4.032 1.00 4.34 H new ATOM 210 N VAL A 16 1.141 -15.031 -0.213 1.00 13.44 N ATOM 211 CA VAL A 16 2.460 -15.367 -0.733 1.00 64.03 C ATOM 212 C VAL A 16 3.074 -16.532 0.035 1.00 11.14 C ATOM 213 O VAL A 16 3.843 -17.318 -0.518 1.00 52.03 O ATOM 214 CB VAL A 16 3.415 -14.161 -0.664 1.00 5.42 C ATOM 215 CG1 VAL A 16 3.024 -13.110 -1.691 1.00 42.35 C ATOM 216 CG2 VAL A 16 3.426 -13.570 0.738 1.00 54.31 C ATOM 0 H VAL A 16 1.154 -14.515 0.667 1.00 13.44 H new ATOM 0 HA VAL A 16 2.324 -15.654 -1.776 1.00 64.03 H new ATOM 0 HB VAL A 16 4.423 -14.504 -0.897 1.00 5.42 H new ATOM 0 HG11 VAL A 16 3.710 -12.266 -1.627 1.00 42.35 H new ATOM 0 HG12 VAL A 16 3.073 -13.542 -2.690 1.00 42.35 H new ATOM 0 HG13 VAL A 16 2.008 -12.768 -1.493 1.00 42.35 H new ATOM 0 HG21 VAL A 16 4.106 -12.719 0.769 1.00 54.31 H new ATOM 0 HG22 VAL A 16 2.421 -13.241 1.002 1.00 54.31 H new ATOM 0 HG23 VAL A 16 3.759 -14.326 1.449 1.00 54.31 H new ATOM 226 N ARG A 17 2.728 -16.637 1.314 1.00 23.24 N ATOM 227 CA ARG A 17 3.246 -17.706 2.160 1.00 33.11 C ATOM 228 C ARG A 17 2.188 -18.783 2.383 1.00 61.32 C ATOM 229 O ARG A 17 2.491 -19.873 2.869 1.00 14.02 O ATOM 230 CB ARG A 17 3.707 -17.143 3.506 1.00 54.03 C ATOM 231 CG ARG A 17 5.015 -16.373 3.428 1.00 61.42 C ATOM 232 CD ARG A 17 5.702 -16.305 4.783 1.00 43.54 C ATOM 233 NE ARG A 17 6.448 -17.524 5.081 1.00 60.33 N ATOM 234 CZ ARG A 17 7.028 -17.763 6.251 1.00 24.25 C ATOM 235 NH1 ARG A 17 6.949 -16.871 7.229 1.00 50.21 N ATOM 236 NH2 ARG A 17 7.689 -18.897 6.447 1.00 65.05 N ATOM 0 H ARG A 17 2.092 -15.995 1.787 1.00 23.24 H new ATOM 0 HA ARG A 17 4.098 -18.157 1.652 1.00 33.11 H new ATOM 0 HB2 ARG A 17 2.932 -16.486 3.900 1.00 54.03 H new ATOM 0 HB3 ARG A 17 3.820 -17.964 4.214 1.00 54.03 H new ATOM 0 HG2 ARG A 17 5.678 -16.851 2.706 1.00 61.42 H new ATOM 0 HG3 ARG A 17 4.823 -15.363 3.065 1.00 61.42 H new ATOM 0 HD2 ARG A 17 6.380 -15.451 4.803 1.00 43.54 H new ATOM 0 HD3 ARG A 17 4.956 -16.138 5.560 1.00 43.54 H new ATOM 0 HE ARG A 17 6.528 -18.231 4.350 1.00 60.33 H new ATOM 0 HH11 ARG A 17 6.441 -15.998 7.083 1.00 50.21 H new ATOM 0 HH12 ARG A 17 7.396 -17.058 8.127 1.00 50.21 H new ATOM 0 HH21 ARG A 17 7.752 -19.587 5.698 1.00 65.05 H new ATOM 0 HH22 ARG A 17 8.134 -19.079 7.347 1.00 65.05 H new ATOM 250 N ARG A 18 0.947 -18.470 2.024 1.00 23.10 N ATOM 251 CA ARG A 18 -0.155 -19.410 2.186 1.00 32.22 C ATOM 252 C ARG A 18 -0.246 -19.897 3.629 1.00 33.44 C ATOM 253 O ARG A 18 -0.182 -21.098 3.897 1.00 42.23 O ATOM 254 CB ARG A 18 0.021 -20.603 1.244 1.00 15.33 C ATOM 255 CG ARG A 18 0.743 -20.257 -0.047 1.00 64.24 C ATOM 256 CD ARG A 18 -0.017 -19.213 -0.849 1.00 54.04 C ATOM 257 NE ARG A 18 -1.123 -19.800 -1.603 1.00 4.45 N ATOM 258 CZ ARG A 18 -0.956 -20.580 -2.664 1.00 41.05 C ATOM 259 NH1 ARG A 18 0.265 -20.866 -3.096 1.00 32.22 N ATOM 260 NH2 ARG A 18 -2.011 -21.076 -3.297 1.00 75.30 N ATOM 0 H ARG A 18 0.680 -17.573 1.619 1.00 23.10 H new ATOM 0 HA ARG A 18 -1.081 -18.892 1.936 1.00 32.22 H new ATOM 0 HB2 ARG A 18 0.575 -21.386 1.762 1.00 15.33 H new ATOM 0 HB3 ARG A 18 -0.960 -21.013 1.003 1.00 15.33 H new ATOM 0 HG2 ARG A 18 1.742 -19.885 0.182 1.00 64.24 H new ATOM 0 HG3 ARG A 18 0.868 -21.158 -0.647 1.00 64.24 H new ATOM 0 HD2 ARG A 18 -0.403 -18.448 -0.175 1.00 54.04 H new ATOM 0 HD3 ARG A 18 0.667 -18.716 -1.537 1.00 54.04 H new ATOM 0 HE ARG A 18 -2.075 -19.599 -1.297 1.00 4.45 H new ATOM 0 HH11 ARG A 18 1.079 -20.486 -2.613 1.00 32.22 H new ATOM 0 HH12 ARG A 18 0.390 -21.466 -3.912 1.00 32.22 H new ATOM 0 HH21 ARG A 18 -2.952 -20.858 -2.969 1.00 75.30 H new ATOM 0 HH22 ARG A 18 -1.881 -21.675 -4.112 1.00 75.30 H new ATOM 274 N THR A 19 -0.396 -18.958 4.558 1.00 53.53 N ATOM 275 CA THR A 19 -0.495 -19.290 5.973 1.00 25.12 C ATOM 276 C THR A 19 -1.533 -18.420 6.672 1.00 42.42 C ATOM 277 O THR A 19 -2.002 -17.428 6.114 1.00 15.42 O ATOM 278 CB THR A 19 0.861 -19.123 6.685 1.00 64.21 C ATOM 279 OG1 THR A 19 1.152 -17.733 6.866 1.00 51.23 O ATOM 280 CG2 THR A 19 1.977 -19.780 5.885 1.00 14.33 C ATOM 0 H THR A 19 -0.452 -17.960 4.355 1.00 53.53 H new ATOM 0 HA THR A 19 -0.802 -20.334 6.031 1.00 25.12 H new ATOM 0 HB THR A 19 0.797 -19.610 7.658 1.00 64.21 H new ATOM 0 HG1 THR A 19 2.015 -17.636 7.321 1.00 51.23 H new ATOM 0 HG21 THR A 19 2.925 -19.649 6.407 1.00 14.33 H new ATOM 0 HG22 THR A 19 1.768 -20.844 5.774 1.00 14.33 H new ATOM 0 HG23 THR A 19 2.039 -19.318 4.900 1.00 14.33 H new ATOM 288 N VAL A 20 -1.887 -18.797 7.896 1.00 11.43 N ATOM 289 CA VAL A 20 -2.869 -18.049 8.672 1.00 11.33 C ATOM 290 C VAL A 20 -2.423 -17.896 10.122 1.00 32.32 C ATOM 291 O VAL A 20 -2.293 -18.882 10.849 1.00 44.13 O ATOM 292 CB VAL A 20 -4.249 -18.733 8.640 1.00 3.32 C ATOM 293 CG1 VAL A 20 -4.950 -18.459 7.318 1.00 22.42 C ATOM 294 CG2 VAL A 20 -4.107 -20.228 8.879 1.00 71.43 C ATOM 0 H VAL A 20 -1.509 -19.616 8.372 1.00 11.43 H new ATOM 0 HA VAL A 20 -2.950 -17.063 8.214 1.00 11.33 H new ATOM 0 HB VAL A 20 -4.861 -18.317 9.440 1.00 3.32 H new ATOM 0 HG11 VAL A 20 -5.923 -18.950 7.314 1.00 22.42 H new ATOM 0 HG12 VAL A 20 -5.085 -17.385 7.194 1.00 22.42 H new ATOM 0 HG13 VAL A 20 -4.345 -18.846 6.498 1.00 22.42 H new ATOM 0 HG21 VAL A 20 -5.091 -20.696 8.853 1.00 71.43 H new ATOM 0 HG22 VAL A 20 -3.478 -20.663 8.102 1.00 71.43 H new ATOM 0 HG23 VAL A 20 -3.650 -20.399 9.854 1.00 71.43 H new ATOM 304 N ILE A 21 -2.192 -16.655 10.537 1.00 64.42 N ATOM 305 CA ILE A 21 -1.762 -16.374 11.901 1.00 42.02 C ATOM 306 C ILE A 21 -2.908 -15.808 12.732 1.00 2.25 C ATOM 307 O ILE A 21 -3.361 -14.687 12.501 1.00 55.01 O ATOM 308 CB ILE A 21 -0.584 -15.381 11.927 1.00 75.53 C ATOM 309 CG1 ILE A 21 0.668 -16.026 11.329 1.00 32.33 C ATOM 310 CG2 ILE A 21 -0.318 -14.913 13.349 1.00 11.34 C ATOM 311 CD1 ILE A 21 0.688 -16.020 9.817 1.00 75.52 C ATOM 0 H ILE A 21 -2.295 -15.828 9.948 1.00 64.42 H new ATOM 0 HA ILE A 21 -1.437 -17.321 12.331 1.00 42.02 H new ATOM 0 HB ILE A 21 -0.846 -14.513 11.323 1.00 75.53 H new ATOM 0 HG12 ILE A 21 1.549 -15.501 11.698 1.00 32.33 H new ATOM 0 HG13 ILE A 21 0.740 -17.055 11.681 1.00 32.33 H new ATOM 0 HG21 ILE A 21 0.517 -14.212 13.351 1.00 11.34 H new ATOM 0 HG22 ILE A 21 -1.207 -14.420 13.742 1.00 11.34 H new ATOM 0 HG23 ILE A 21 -0.073 -15.771 13.975 1.00 11.34 H new ATOM 0 HD11 ILE A 21 1.604 -16.493 9.463 1.00 75.52 H new ATOM 0 HD12 ILE A 21 -0.174 -16.571 9.440 1.00 75.52 H new ATOM 0 HD13 ILE A 21 0.648 -14.992 9.457 1.00 75.52 H new ATOM 323 N ARG A 22 -3.370 -16.590 13.703 1.00 51.44 N ATOM 324 CA ARG A 22 -4.463 -16.166 14.570 1.00 61.03 C ATOM 325 C ARG A 22 -3.928 -15.617 15.889 1.00 34.44 C ATOM 326 O ARG A 22 -3.358 -16.354 16.694 1.00 71.10 O ATOM 327 CB ARG A 22 -5.412 -17.336 14.838 1.00 2.53 C ATOM 328 CG ARG A 22 -6.820 -16.904 15.214 1.00 2.52 C ATOM 329 CD ARG A 22 -7.213 -17.422 16.589 1.00 52.23 C ATOM 330 NE ARG A 22 -7.158 -16.374 17.605 1.00 74.31 N ATOM 331 CZ ARG A 22 -8.072 -15.417 17.724 1.00 31.51 C ATOM 332 NH1 ARG A 22 -9.106 -15.376 16.895 1.00 61.41 N ATOM 333 NH2 ARG A 22 -7.953 -14.499 18.675 1.00 60.44 N ATOM 0 H ARG A 22 -3.005 -17.520 13.909 1.00 51.44 H new ATOM 0 HA ARG A 22 -5.011 -15.372 14.062 1.00 61.03 H new ATOM 0 HB2 ARG A 22 -5.459 -17.965 13.949 1.00 2.53 H new ATOM 0 HB3 ARG A 22 -5.002 -17.949 15.641 1.00 2.53 H new ATOM 0 HG2 ARG A 22 -6.883 -15.816 15.202 1.00 2.52 H new ATOM 0 HG3 ARG A 22 -7.526 -17.273 14.470 1.00 2.52 H new ATOM 0 HD2 ARG A 22 -8.222 -17.833 16.547 1.00 52.23 H new ATOM 0 HD3 ARG A 22 -6.548 -18.237 16.873 1.00 52.23 H new ATOM 0 HE ARG A 22 -6.375 -16.377 18.259 1.00 74.31 H new ATOM 0 HH11 ARG A 22 -9.201 -16.080 16.163 1.00 61.41 H new ATOM 0 HH12 ARG A 22 -9.806 -14.640 16.989 1.00 61.41 H new ATOM 0 HH21 ARG A 22 -7.159 -14.528 19.315 1.00 60.44 H new ATOM 0 HH22 ARG A 22 -8.655 -13.765 18.766 1.00 60.44 H new ATOM 347 N SER A 23 -4.116 -14.319 16.104 1.00 35.22 N ATOM 348 CA SER A 23 -3.650 -13.671 17.324 1.00 45.30 C ATOM 349 C SER A 23 -2.162 -13.932 17.543 1.00 14.10 C ATOM 350 O SER A 23 -1.694 -14.003 18.678 1.00 23.02 O ATOM 351 CB SER A 23 -4.449 -14.168 18.530 1.00 73.34 C ATOM 352 OG SER A 23 -4.166 -13.396 19.683 1.00 15.53 O ATOM 0 H SER A 23 -4.588 -13.695 15.449 1.00 35.22 H new ATOM 0 HA SER A 23 -3.802 -12.597 17.215 1.00 45.30 H new ATOM 0 HB2 SER A 23 -5.515 -14.119 18.309 1.00 73.34 H new ATOM 0 HB3 SER A 23 -4.211 -15.214 18.722 1.00 73.34 H new ATOM 0 HG SER A 23 -3.197 -13.279 19.768 1.00 15.53 H new ATOM 358 N GLY A 24 -1.425 -14.074 16.446 1.00 61.23 N ATOM 359 CA GLY A 24 0.001 -14.326 16.538 1.00 23.20 C ATOM 360 C GLY A 24 0.323 -15.803 16.655 1.00 12.22 C ATOM 361 O GLY A 24 1.436 -16.176 17.027 1.00 74.54 O ATOM 0 H GLY A 24 -1.790 -14.019 15.495 1.00 61.23 H new ATOM 0 HA2 GLY A 24 0.496 -13.918 15.657 1.00 23.20 H new ATOM 0 HA3 GLY A 24 0.405 -13.800 17.403 1.00 23.20 H new ATOM 365 N LYS A 25 -0.654 -16.646 16.339 1.00 31.23 N ATOM 366 CA LYS A 25 -0.471 -18.091 16.411 1.00 73.01 C ATOM 367 C LYS A 25 -0.896 -18.759 15.107 1.00 50.52 C ATOM 368 O LYS A 25 -2.077 -18.768 14.758 1.00 44.55 O ATOM 369 CB LYS A 25 -1.274 -18.670 17.578 1.00 73.22 C ATOM 370 CG LYS A 25 -0.806 -18.185 18.939 1.00 50.33 C ATOM 371 CD LYS A 25 -1.571 -16.950 19.384 1.00 51.32 C ATOM 372 CE LYS A 25 -0.812 -16.179 20.453 1.00 42.23 C ATOM 373 NZ LYS A 25 0.453 -15.597 19.924 1.00 21.41 N ATOM 0 H LYS A 25 -1.581 -16.353 16.030 1.00 31.23 H new ATOM 0 HA LYS A 25 0.588 -18.290 16.572 1.00 73.01 H new ATOM 0 HB2 LYS A 25 -2.324 -18.409 17.450 1.00 73.22 H new ATOM 0 HB3 LYS A 25 -1.210 -19.758 17.548 1.00 73.22 H new ATOM 0 HG2 LYS A 25 -0.936 -18.979 19.674 1.00 50.33 H new ATOM 0 HG3 LYS A 25 0.260 -17.959 18.899 1.00 50.33 H new ATOM 0 HD2 LYS A 25 -1.750 -16.303 18.525 1.00 51.32 H new ATOM 0 HD3 LYS A 25 -2.547 -17.245 19.770 1.00 51.32 H new ATOM 0 HE2 LYS A 25 -1.444 -15.381 20.843 1.00 42.23 H new ATOM 0 HE3 LYS A 25 -0.585 -16.843 21.288 1.00 42.23 H new ATOM 0 HZ1 LYS A 25 0.949 -15.094 20.687 1.00 21.41 H new ATOM 0 HZ2 LYS A 25 1.060 -16.359 19.560 1.00 21.41 H new ATOM 0 HZ3 LYS A 25 0.234 -14.931 19.156 1.00 21.41 H new ATOM 387 N LYS A 26 0.073 -19.318 14.391 1.00 63.12 N ATOM 388 CA LYS A 26 -0.200 -19.991 13.126 1.00 4.14 C ATOM 389 C LYS A 26 -0.956 -21.296 13.356 1.00 4.44 C ATOM 390 O LYS A 26 -0.564 -22.112 14.191 1.00 1.31 O ATOM 391 CB LYS A 26 1.108 -20.271 12.382 1.00 74.15 C ATOM 392 CG LYS A 26 0.903 -20.814 10.978 1.00 64.51 C ATOM 393 CD LYS A 26 2.229 -21.077 10.283 1.00 1.23 C ATOM 394 CE LYS A 26 2.874 -19.784 9.806 1.00 33.41 C ATOM 395 NZ LYS A 26 4.152 -20.036 9.084 1.00 13.43 N ATOM 0 H LYS A 26 1.056 -19.319 14.665 1.00 63.12 H new ATOM 0 HA LYS A 26 -0.823 -19.333 12.520 1.00 4.14 H new ATOM 0 HB2 LYS A 26 1.689 -19.350 12.326 1.00 74.15 H new ATOM 0 HB3 LYS A 26 1.698 -20.985 12.957 1.00 74.15 H new ATOM 0 HG2 LYS A 26 0.326 -21.738 11.025 1.00 64.51 H new ATOM 0 HG3 LYS A 26 0.319 -20.103 10.393 1.00 64.51 H new ATOM 0 HD2 LYS A 26 2.904 -21.591 10.967 1.00 1.23 H new ATOM 0 HD3 LYS A 26 2.070 -21.741 9.433 1.00 1.23 H new ATOM 0 HE2 LYS A 26 2.184 -19.255 9.149 1.00 33.41 H new ATOM 0 HE3 LYS A 26 3.062 -19.135 10.661 1.00 33.41 H new ATOM 0 HZ1 LYS A 26 4.561 -19.131 8.775 1.00 13.43 H new ATOM 0 HZ2 LYS A 26 4.820 -20.519 9.719 1.00 13.43 H new ATOM 0 HZ3 LYS A 26 3.969 -20.635 8.253 1.00 13.43 H new ATOM 409 N ILE A 27 -2.039 -21.486 12.611 1.00 43.14 N ATOM 410 CA ILE A 27 -2.847 -22.693 12.732 1.00 0.33 C ATOM 411 C ILE A 27 -2.215 -23.856 11.975 1.00 15.00 C ATOM 412 O ILE A 27 -1.615 -23.669 10.916 1.00 2.24 O ATOM 413 CB ILE A 27 -4.277 -22.468 12.206 1.00 62.10 C ATOM 414 CG1 ILE A 27 -4.947 -21.318 12.961 1.00 63.02 C ATOM 415 CG2 ILE A 27 -5.096 -23.743 12.337 1.00 30.33 C ATOM 416 CD1 ILE A 27 -5.027 -21.541 14.455 1.00 71.43 C ATOM 0 H ILE A 27 -2.377 -20.820 11.917 1.00 43.14 H new ATOM 0 HA ILE A 27 -2.894 -22.937 13.793 1.00 0.33 H new ATOM 0 HB ILE A 27 -4.222 -22.201 11.151 1.00 62.10 H new ATOM 0 HG12 ILE A 27 -4.396 -20.398 12.768 1.00 63.02 H new ATOM 0 HG13 ILE A 27 -5.954 -21.175 12.569 1.00 63.02 H new ATOM 0 HG21 ILE A 27 -6.104 -23.568 11.961 1.00 30.33 H new ATOM 0 HG22 ILE A 27 -4.626 -24.538 11.759 1.00 30.33 H new ATOM 0 HG23 ILE A 27 -5.146 -24.037 13.385 1.00 30.33 H new ATOM 0 HD11 ILE A 27 -5.513 -20.686 14.925 1.00 71.43 H new ATOM 0 HD12 ILE A 27 -5.604 -22.443 14.658 1.00 71.43 H new ATOM 0 HD13 ILE A 27 -4.022 -21.654 14.860 1.00 71.43 H new ATOM 428 N HIS A 28 -2.357 -25.058 12.524 1.00 62.54 N ATOM 429 CA HIS A 28 -1.802 -26.254 11.899 1.00 51.15 C ATOM 430 C HIS A 28 -2.911 -27.134 11.330 1.00 31.22 C ATOM 431 O HIS A 28 -4.005 -27.213 11.892 1.00 63.05 O ATOM 432 CB HIS A 28 -0.974 -27.047 12.910 1.00 2.42 C ATOM 433 CG HIS A 28 -0.044 -28.036 12.279 1.00 62.23 C ATOM 434 ND1 HIS A 28 1.022 -27.667 11.485 1.00 74.42 N ATOM 435 CD2 HIS A 28 -0.023 -29.389 12.329 1.00 11.30 C ATOM 436 CE1 HIS A 28 1.656 -28.750 11.073 1.00 64.22 C ATOM 437 NE2 HIS A 28 1.043 -29.808 11.572 1.00 73.15 N ATOM 0 H HIS A 28 -2.851 -25.230 13.400 1.00 62.54 H new ATOM 0 HA HIS A 28 -1.156 -25.939 11.080 1.00 51.15 H new ATOM 0 HB2 HIS A 28 -0.394 -26.352 13.517 1.00 2.42 H new ATOM 0 HB3 HIS A 28 -1.648 -27.574 13.585 1.00 2.42 H new ATOM 0 HD2 HIS A 28 -0.716 -30.021 12.865 1.00 11.30 H new ATOM 0 HE1 HIS A 28 2.528 -28.767 10.436 1.00 64.22 H new ATOM 0 HE2 HIS A 28 1.317 -30.779 11.420 1.00 73.15 H new ATOM 445 N LEU A 29 -2.623 -27.794 10.214 1.00 44.43 N ATOM 446 CA LEU A 29 -3.596 -28.668 9.568 1.00 23.14 C ATOM 447 C LEU A 29 -2.898 -29.781 8.793 1.00 41.45 C ATOM 448 O LEU A 29 -1.669 -29.850 8.755 1.00 21.40 O ATOM 449 CB LEU A 29 -4.492 -27.860 8.628 1.00 34.35 C ATOM 450 CG LEU A 29 -3.821 -26.699 7.894 1.00 72.55 C ATOM 451 CD1 LEU A 29 -2.599 -27.186 7.131 1.00 63.01 C ATOM 452 CD2 LEU A 29 -4.806 -26.024 6.951 1.00 75.34 C ATOM 0 H LEU A 29 -1.723 -27.741 9.737 1.00 44.43 H new ATOM 0 HA LEU A 29 -4.211 -29.122 10.345 1.00 23.14 H new ATOM 0 HB2 LEU A 29 -4.911 -28.539 7.886 1.00 34.35 H new ATOM 0 HB3 LEU A 29 -5.327 -27.464 9.206 1.00 34.35 H new ATOM 0 HG LEU A 29 -3.495 -25.966 8.633 1.00 72.55 H new ATOM 0 HD11 LEU A 29 -2.134 -26.346 6.615 1.00 63.01 H new ATOM 0 HD12 LEU A 29 -1.885 -27.623 7.829 1.00 63.01 H new ATOM 0 HD13 LEU A 29 -2.901 -27.938 6.402 1.00 63.01 H new ATOM 0 HD21 LEU A 29 -4.311 -25.200 6.437 1.00 75.34 H new ATOM 0 HD22 LEU A 29 -5.162 -26.748 6.218 1.00 75.34 H new ATOM 0 HD23 LEU A 29 -5.652 -25.640 7.522 1.00 75.34 H new ATOM 464 N THR A 30 -3.690 -30.649 8.172 1.00 72.14 N ATOM 465 CA THR A 30 -3.149 -31.758 7.395 1.00 12.35 C ATOM 466 C THR A 30 -3.069 -31.404 5.915 1.00 64.52 C ATOM 467 O THR A 30 -3.368 -30.279 5.518 1.00 61.22 O ATOM 468 CB THR A 30 -4.002 -33.029 7.563 1.00 71.45 C ATOM 469 OG1 THR A 30 -3.292 -34.166 7.057 1.00 2.52 O ATOM 470 CG2 THR A 30 -5.330 -32.890 6.834 1.00 51.03 C ATOM 0 H THR A 30 -4.709 -30.606 8.192 1.00 72.14 H new ATOM 0 HA THR A 30 -2.145 -31.951 7.774 1.00 12.35 H new ATOM 0 HB THR A 30 -4.201 -33.168 8.626 1.00 71.45 H new ATOM 0 HG1 THR A 30 -3.742 -34.502 6.254 1.00 2.52 H new ATOM 0 HG21 THR A 30 -5.915 -33.800 6.967 1.00 51.03 H new ATOM 0 HG22 THR A 30 -5.881 -32.042 7.240 1.00 51.03 H new ATOM 0 HG23 THR A 30 -5.147 -32.729 5.772 1.00 51.03 H new ATOM 478 N GLY A 31 -2.663 -32.374 5.101 1.00 65.32 N ATOM 479 CA GLY A 31 -2.551 -32.145 3.672 1.00 24.41 C ATOM 480 C GLY A 31 -3.866 -31.726 3.047 1.00 13.34 C ATOM 481 O GLY A 31 -3.939 -30.708 2.358 1.00 2.13 O ATOM 0 H GLY A 31 -2.410 -33.314 5.406 1.00 65.32 H new ATOM 0 HA2 GLY A 31 -1.803 -31.374 3.488 1.00 24.41 H new ATOM 0 HA3 GLY A 31 -2.196 -33.055 3.188 1.00 24.41 H new ATOM 485 N LYS A 32 -4.910 -32.512 3.286 1.00 34.03 N ATOM 486 CA LYS A 32 -6.231 -32.218 2.742 1.00 2.12 C ATOM 487 C LYS A 32 -6.718 -30.849 3.207 1.00 33.42 C ATOM 488 O LYS A 32 -7.093 -30.005 2.394 1.00 64.21 O ATOM 489 CB LYS A 32 -7.231 -33.297 3.163 1.00 24.32 C ATOM 490 CG LYS A 32 -6.731 -34.713 2.932 1.00 42.24 C ATOM 491 CD LYS A 32 -7.827 -35.737 3.172 1.00 61.43 C ATOM 492 CE LYS A 32 -7.395 -37.128 2.733 1.00 74.40 C ATOM 493 NZ LYS A 32 -6.316 -37.674 3.602 1.00 72.20 N ATOM 0 H LYS A 32 -4.867 -33.359 3.853 1.00 34.03 H new ATOM 0 HA LYS A 32 -6.155 -32.207 1.655 1.00 2.12 H new ATOM 0 HB2 LYS A 32 -7.465 -33.171 4.220 1.00 24.32 H new ATOM 0 HB3 LYS A 32 -8.160 -33.154 2.612 1.00 24.32 H new ATOM 0 HG2 LYS A 32 -6.361 -34.807 1.911 1.00 42.24 H new ATOM 0 HG3 LYS A 32 -5.890 -34.916 3.596 1.00 42.24 H new ATOM 0 HD2 LYS A 32 -8.087 -35.752 4.231 1.00 61.43 H new ATOM 0 HD3 LYS A 32 -8.725 -35.445 2.628 1.00 61.43 H new ATOM 0 HE2 LYS A 32 -8.254 -37.799 2.756 1.00 74.40 H new ATOM 0 HE3 LYS A 32 -7.046 -37.091 1.701 1.00 74.40 H new ATOM 0 HZ1 LYS A 32 -6.050 -38.623 3.270 1.00 72.20 H new ATOM 0 HZ2 LYS A 32 -5.487 -37.048 3.561 1.00 72.20 H new ATOM 0 HZ3 LYS A 32 -6.657 -37.733 4.583 1.00 72.20 H new ATOM 507 N GLU A 33 -6.709 -30.637 4.520 1.00 74.45 N ATOM 508 CA GLU A 33 -7.151 -29.370 5.091 1.00 65.40 C ATOM 509 C GLU A 33 -6.319 -28.211 4.550 1.00 52.22 C ATOM 510 O GLU A 33 -6.827 -27.106 4.357 1.00 41.24 O ATOM 511 CB GLU A 33 -7.054 -29.413 6.617 1.00 1.24 C ATOM 512 CG GLU A 33 -8.250 -30.070 7.285 1.00 70.40 C ATOM 513 CD GLU A 33 -8.370 -31.544 6.947 1.00 42.31 C ATOM 514 OE1 GLU A 33 -8.813 -31.861 5.824 1.00 61.25 O ATOM 515 OE2 GLU A 33 -8.020 -32.379 7.807 1.00 63.34 O ATOM 0 H GLU A 33 -6.401 -31.325 5.207 1.00 74.45 H new ATOM 0 HA GLU A 33 -8.191 -29.213 4.804 1.00 65.40 H new ATOM 0 HB2 GLU A 33 -6.149 -29.951 6.900 1.00 1.24 H new ATOM 0 HB3 GLU A 33 -6.951 -28.396 6.995 1.00 1.24 H new ATOM 0 HG2 GLU A 33 -8.167 -29.954 8.366 1.00 70.40 H new ATOM 0 HG3 GLU A 33 -9.161 -29.555 6.979 1.00 70.40 H new ATOM 522 N TYR A 34 -5.039 -28.471 4.308 1.00 12.30 N ATOM 523 CA TYR A 34 -4.136 -27.449 3.792 1.00 0.12 C ATOM 524 C TYR A 34 -4.533 -27.034 2.379 1.00 53.31 C ATOM 525 O TYR A 34 -4.401 -25.870 2.001 1.00 50.42 O ATOM 526 CB TYR A 34 -2.695 -27.962 3.799 1.00 1.30 C ATOM 527 CG TYR A 34 -1.678 -26.915 3.403 1.00 60.33 C ATOM 528 CD1 TYR A 34 -1.755 -25.620 3.900 1.00 55.14 C ATOM 529 CD2 TYR A 34 -0.640 -27.221 2.531 1.00 74.41 C ATOM 530 CE1 TYR A 34 -0.829 -24.660 3.540 1.00 71.32 C ATOM 531 CE2 TYR A 34 0.291 -26.269 2.167 1.00 42.31 C ATOM 532 CZ TYR A 34 0.193 -24.990 2.674 1.00 54.43 C ATOM 533 OH TYR A 34 1.118 -24.037 2.312 1.00 31.33 O ATOM 0 H TYR A 34 -4.603 -29.381 4.461 1.00 12.30 H new ATOM 0 HA TYR A 34 -4.207 -26.576 4.441 1.00 0.12 H new ATOM 0 HB2 TYR A 34 -2.454 -28.331 4.796 1.00 1.30 H new ATOM 0 HB3 TYR A 34 -2.616 -28.809 3.118 1.00 1.30 H new ATOM 0 HD1 TYR A 34 -2.553 -25.359 4.580 1.00 55.14 H new ATOM 0 HD2 TYR A 34 -0.560 -28.221 2.131 1.00 74.41 H new ATOM 0 HE1 TYR A 34 -0.905 -23.657 3.934 1.00 71.32 H new ATOM 0 HE2 TYR A 34 1.092 -26.524 1.489 1.00 42.31 H new ATOM 0 HH TYR A 34 1.771 -24.432 1.698 1.00 31.33 H new ATOM 543 N VAL A 35 -5.022 -27.995 1.602 1.00 21.41 N ATOM 544 CA VAL A 35 -5.441 -27.731 0.231 1.00 61.43 C ATOM 545 C VAL A 35 -6.701 -26.874 0.197 1.00 70.05 C ATOM 546 O VAL A 35 -6.799 -25.926 -0.584 1.00 12.25 O ATOM 547 CB VAL A 35 -5.703 -29.040 -0.538 1.00 24.20 C ATOM 548 CG1 VAL A 35 -6.476 -28.762 -1.818 1.00 31.31 C ATOM 549 CG2 VAL A 35 -4.392 -29.751 -0.841 1.00 11.22 C ATOM 0 H VAL A 35 -5.138 -28.964 1.899 1.00 21.41 H new ATOM 0 HA VAL A 35 -4.625 -27.192 -0.251 1.00 61.43 H new ATOM 0 HB VAL A 35 -6.309 -29.694 0.089 1.00 24.20 H new ATOM 0 HG11 VAL A 35 -6.652 -29.698 -2.348 1.00 31.31 H new ATOM 0 HG12 VAL A 35 -7.432 -28.299 -1.573 1.00 31.31 H new ATOM 0 HG13 VAL A 35 -5.899 -28.089 -2.452 1.00 31.31 H new ATOM 0 HG21 VAL A 35 -4.596 -30.674 -1.384 1.00 11.22 H new ATOM 0 HG22 VAL A 35 -3.759 -29.104 -1.449 1.00 11.22 H new ATOM 0 HG23 VAL A 35 -3.881 -29.985 0.093 1.00 11.22 H new ATOM 559 N LEU A 36 -7.663 -27.213 1.047 1.00 14.32 N ATOM 560 CA LEU A 36 -8.919 -26.473 1.116 1.00 72.44 C ATOM 561 C LEU A 36 -8.671 -25.010 1.466 1.00 50.32 C ATOM 562 O LEU A 36 -9.238 -24.108 0.848 1.00 13.40 O ATOM 563 CB LEU A 36 -9.851 -27.106 2.151 1.00 62.43 C ATOM 564 CG LEU A 36 -10.953 -28.011 1.598 1.00 44.02 C ATOM 565 CD1 LEU A 36 -11.922 -27.210 0.742 1.00 4.11 C ATOM 566 CD2 LEU A 36 -10.351 -29.156 0.796 1.00 43.53 C ATOM 0 H LEU A 36 -7.598 -27.995 1.698 1.00 14.32 H new ATOM 0 HA LEU A 36 -9.392 -26.517 0.135 1.00 72.44 H new ATOM 0 HB2 LEU A 36 -9.247 -27.687 2.847 1.00 62.43 H new ATOM 0 HB3 LEU A 36 -10.319 -26.307 2.726 1.00 62.43 H new ATOM 0 HG LEU A 36 -11.505 -28.433 2.438 1.00 44.02 H new ATOM 0 HD11 LEU A 36 -12.699 -27.870 0.357 1.00 4.11 H new ATOM 0 HD12 LEU A 36 -12.379 -26.426 1.346 1.00 4.11 H new ATOM 0 HD13 LEU A 36 -11.384 -26.759 -0.092 1.00 4.11 H new ATOM 0 HD21 LEU A 36 -11.150 -29.789 0.410 1.00 43.53 H new ATOM 0 HD22 LEU A 36 -9.774 -28.753 -0.036 1.00 43.53 H new ATOM 0 HD23 LEU A 36 -9.698 -29.746 1.439 1.00 43.53 H new ATOM 578 N LEU A 37 -7.819 -24.781 2.459 1.00 42.23 N ATOM 579 CA LEU A 37 -7.493 -23.426 2.890 1.00 2.11 C ATOM 580 C LEU A 37 -6.535 -22.758 1.909 1.00 4.23 C ATOM 581 O LEU A 37 -6.567 -21.541 1.726 1.00 35.45 O ATOM 582 CB LEU A 37 -6.874 -23.450 4.289 1.00 52.11 C ATOM 583 CG LEU A 37 -7.859 -23.434 5.459 1.00 42.13 C ATOM 584 CD1 LEU A 37 -8.634 -22.126 5.486 1.00 3.42 C ATOM 585 CD2 LEU A 37 -8.811 -24.618 5.371 1.00 43.12 C ATOM 0 H LEU A 37 -7.341 -25.516 2.981 1.00 42.23 H new ATOM 0 HA LEU A 37 -8.417 -22.848 2.918 1.00 2.11 H new ATOM 0 HB2 LEU A 37 -6.253 -24.342 4.375 1.00 52.11 H new ATOM 0 HB3 LEU A 37 -6.211 -22.590 4.386 1.00 52.11 H new ATOM 0 HG LEU A 37 -7.293 -23.517 6.387 1.00 42.13 H new ATOM 0 HD11 LEU A 37 -9.330 -22.133 6.325 1.00 3.42 H new ATOM 0 HD12 LEU A 37 -7.939 -21.294 5.597 1.00 3.42 H new ATOM 0 HD13 LEU A 37 -9.189 -22.013 4.555 1.00 3.42 H new ATOM 0 HD21 LEU A 37 -9.505 -24.590 6.211 1.00 43.12 H new ATOM 0 HD22 LEU A 37 -9.370 -24.566 4.437 1.00 43.12 H new ATOM 0 HD23 LEU A 37 -8.241 -25.546 5.402 1.00 43.12 H new ATOM 597 N GLU A 38 -5.684 -23.562 1.280 1.00 61.42 N ATOM 598 CA GLU A 38 -4.718 -23.048 0.316 1.00 23.14 C ATOM 599 C GLU A 38 -5.417 -22.257 -0.786 1.00 25.32 C ATOM 600 O GLU A 38 -5.013 -21.141 -1.116 1.00 35.20 O ATOM 601 CB GLU A 38 -3.914 -24.197 -0.296 1.00 61.02 C ATOM 602 CG GLU A 38 -2.547 -24.390 0.339 1.00 34.52 C ATOM 603 CD GLU A 38 -1.411 -24.037 -0.601 1.00 14.21 C ATOM 604 OE1 GLU A 38 -1.599 -23.134 -1.443 1.00 43.22 O ATOM 605 OE2 GLU A 38 -0.336 -24.663 -0.495 1.00 11.50 O ATOM 0 H GLU A 38 -5.644 -24.571 1.420 1.00 61.42 H new ATOM 0 HA GLU A 38 -4.038 -22.379 0.843 1.00 23.14 H new ATOM 0 HB2 GLU A 38 -4.484 -25.121 -0.198 1.00 61.02 H new ATOM 0 HB3 GLU A 38 -3.787 -24.012 -1.363 1.00 61.02 H new ATOM 0 HG2 GLU A 38 -2.477 -23.773 1.235 1.00 34.52 H new ATOM 0 HG3 GLU A 38 -2.441 -25.427 0.657 1.00 34.52 H new ATOM 612 N LEU A 39 -6.466 -22.844 -1.352 1.00 5.40 N ATOM 613 CA LEU A 39 -7.221 -22.195 -2.418 1.00 35.20 C ATOM 614 C LEU A 39 -8.150 -21.124 -1.854 1.00 23.44 C ATOM 615 O LEU A 39 -8.260 -20.029 -2.406 1.00 44.00 O ATOM 616 CB LEU A 39 -8.034 -23.231 -3.197 1.00 64.30 C ATOM 617 CG LEU A 39 -7.364 -23.809 -4.445 1.00 14.42 C ATOM 618 CD1 LEU A 39 -7.241 -22.745 -5.525 1.00 5.14 C ATOM 619 CD2 LEU A 39 -5.998 -24.383 -4.100 1.00 0.31 C ATOM 0 H LEU A 39 -6.813 -23.767 -1.091 1.00 5.40 H new ATOM 0 HA LEU A 39 -6.511 -21.716 -3.092 1.00 35.20 H new ATOM 0 HB2 LEU A 39 -8.276 -24.054 -2.525 1.00 64.30 H new ATOM 0 HB3 LEU A 39 -8.978 -22.774 -3.494 1.00 64.30 H new ATOM 0 HG LEU A 39 -7.988 -24.616 -4.829 1.00 14.42 H new ATOM 0 HD11 LEU A 39 -6.762 -23.174 -6.405 1.00 5.14 H new ATOM 0 HD12 LEU A 39 -8.233 -22.382 -5.792 1.00 5.14 H new ATOM 0 HD13 LEU A 39 -6.639 -21.916 -5.152 1.00 5.14 H new ATOM 0 HD21 LEU A 39 -5.536 -24.790 -5.000 1.00 0.31 H new ATOM 0 HD22 LEU A 39 -5.365 -23.595 -3.692 1.00 0.31 H new ATOM 0 HD23 LEU A 39 -6.113 -25.176 -3.361 1.00 0.31 H new ATOM 631 N LEU A 40 -8.814 -21.447 -0.750 1.00 31.15 N ATOM 632 CA LEU A 40 -9.732 -20.512 -0.108 1.00 2.10 C ATOM 633 C LEU A 40 -9.029 -19.198 0.220 1.00 74.21 C ATOM 634 O LEU A 40 -9.527 -18.118 -0.103 1.00 21.55 O ATOM 635 CB LEU A 40 -10.309 -21.127 1.168 1.00 23.31 C ATOM 636 CG LEU A 40 -11.730 -21.680 1.063 1.00 33.53 C ATOM 637 CD1 LEU A 40 -12.176 -22.264 2.395 1.00 1.43 C ATOM 638 CD2 LEU A 40 -12.693 -20.594 0.606 1.00 61.22 C ATOM 0 H LEU A 40 -8.734 -22.349 -0.281 1.00 31.15 H new ATOM 0 HA LEU A 40 -10.545 -20.305 -0.803 1.00 2.10 H new ATOM 0 HB2 LEU A 40 -9.650 -21.933 1.489 1.00 23.31 H new ATOM 0 HB3 LEU A 40 -10.292 -20.370 1.952 1.00 23.31 H new ATOM 0 HG LEU A 40 -11.734 -22.478 0.320 1.00 33.53 H new ATOM 0 HD11 LEU A 40 -13.190 -22.653 2.301 1.00 1.43 H new ATOM 0 HD12 LEU A 40 -11.503 -23.072 2.682 1.00 1.43 H new ATOM 0 HD13 LEU A 40 -12.155 -21.486 3.158 1.00 1.43 H new ATOM 0 HD21 LEU A 40 -13.700 -21.006 0.537 1.00 61.22 H new ATOM 0 HD22 LEU A 40 -12.685 -19.774 1.325 1.00 61.22 H new ATOM 0 HD23 LEU A 40 -12.385 -20.223 -0.371 1.00 61.22 H new ATOM 650 N LEU A 41 -7.870 -19.297 0.860 1.00 21.25 N ATOM 651 CA LEU A 41 -7.097 -18.117 1.230 1.00 1.43 C ATOM 652 C LEU A 41 -6.497 -17.450 -0.004 1.00 31.14 C ATOM 653 O LEU A 41 -6.457 -16.224 -0.100 1.00 0.10 O ATOM 654 CB LEU A 41 -5.985 -18.497 2.210 1.00 51.13 C ATOM 655 CG LEU A 41 -4.797 -19.255 1.616 1.00 54.24 C ATOM 656 CD1 LEU A 41 -3.746 -18.283 1.104 1.00 3.41 C ATOM 657 CD2 LEU A 41 -4.197 -20.199 2.647 1.00 10.32 C ATOM 0 H LEU A 41 -7.444 -20.183 1.134 1.00 21.25 H new ATOM 0 HA LEU A 41 -7.771 -17.409 1.712 1.00 1.43 H new ATOM 0 HB2 LEU A 41 -5.612 -17.585 2.677 1.00 51.13 H new ATOM 0 HB3 LEU A 41 -6.419 -19.106 3.003 1.00 51.13 H new ATOM 0 HG LEU A 41 -5.153 -19.849 0.774 1.00 54.24 H new ATOM 0 HD11 LEU A 41 -2.908 -18.840 0.685 1.00 3.41 H new ATOM 0 HD12 LEU A 41 -4.182 -17.649 0.332 1.00 3.41 H new ATOM 0 HD13 LEU A 41 -3.393 -17.662 1.927 1.00 3.41 H new ATOM 0 HD21 LEU A 41 -3.353 -20.730 2.207 1.00 10.32 H new ATOM 0 HD22 LEU A 41 -3.856 -19.626 3.509 1.00 10.32 H new ATOM 0 HD23 LEU A 41 -4.952 -20.918 2.965 1.00 10.32 H new ATOM 669 N GLN A 42 -6.034 -18.266 -0.945 1.00 33.41 N ATOM 670 CA GLN A 42 -5.438 -17.755 -2.173 1.00 72.04 C ATOM 671 C GLN A 42 -6.451 -16.943 -2.973 1.00 15.41 C ATOM 672 O GLN A 42 -6.109 -15.926 -3.577 1.00 64.32 O ATOM 673 CB GLN A 42 -4.905 -18.908 -3.025 1.00 73.42 C ATOM 674 CG GLN A 42 -4.233 -18.455 -4.311 1.00 40.00 C ATOM 675 CD GLN A 42 -2.732 -18.300 -4.162 1.00 14.54 C ATOM 676 OE1 GLN A 42 -2.246 -17.802 -3.145 1.00 73.24 O ATOM 677 NE2 GLN A 42 -1.989 -18.725 -5.176 1.00 61.50 N ATOM 0 H GLN A 42 -6.060 -19.284 -0.880 1.00 33.41 H new ATOM 0 HA GLN A 42 -4.610 -17.101 -1.900 1.00 72.04 H new ATOM 0 HB2 GLN A 42 -4.192 -19.484 -2.436 1.00 73.42 H new ATOM 0 HB3 GLN A 42 -5.729 -19.577 -3.272 1.00 73.42 H new ATOM 0 HG2 GLN A 42 -4.443 -19.177 -5.100 1.00 40.00 H new ATOM 0 HG3 GLN A 42 -4.663 -17.504 -4.626 1.00 40.00 H new ATOM 0 HE21 GLN A 42 -2.434 -19.131 -5.999 1.00 61.50 H new ATOM 0 HE22 GLN A 42 -0.973 -18.646 -5.132 1.00 61.50 H new ATOM 686 N ARG A 43 -7.700 -17.398 -2.972 1.00 52.31 N ATOM 687 CA ARG A 43 -8.763 -16.714 -3.699 1.00 0.21 C ATOM 688 C ARG A 43 -9.698 -15.987 -2.737 1.00 55.33 C ATOM 689 O ARG A 43 -10.849 -15.701 -3.070 1.00 13.13 O ATOM 690 CB ARG A 43 -9.557 -17.712 -4.543 1.00 33.53 C ATOM 691 CG ARG A 43 -8.721 -18.419 -5.597 1.00 34.50 C ATOM 692 CD ARG A 43 -8.009 -17.426 -6.502 1.00 31.15 C ATOM 693 NE ARG A 43 -7.252 -18.093 -7.558 1.00 14.41 N ATOM 694 CZ ARG A 43 -6.617 -17.444 -8.528 1.00 21.43 C ATOM 695 NH1 ARG A 43 -6.647 -16.120 -8.574 1.00 44.33 N ATOM 696 NH2 ARG A 43 -5.949 -18.121 -9.453 1.00 74.53 N ATOM 0 H ARG A 43 -8.000 -18.237 -2.476 1.00 52.31 H new ATOM 0 HA ARG A 43 -8.303 -15.977 -4.358 1.00 0.21 H new ATOM 0 HB2 ARG A 43 -10.003 -18.458 -3.885 1.00 33.53 H new ATOM 0 HB3 ARG A 43 -10.378 -17.188 -5.033 1.00 33.53 H new ATOM 0 HG2 ARG A 43 -7.987 -19.061 -5.110 1.00 34.50 H new ATOM 0 HG3 ARG A 43 -9.361 -19.066 -6.197 1.00 34.50 H new ATOM 0 HD2 ARG A 43 -8.741 -16.754 -6.950 1.00 31.15 H new ATOM 0 HD3 ARG A 43 -7.335 -16.811 -5.906 1.00 31.15 H new ATOM 0 HE ARG A 43 -7.208 -19.112 -7.550 1.00 14.41 H new ATOM 0 HH11 ARG A 43 -7.158 -15.596 -7.864 1.00 44.33 H new ATOM 0 HH12 ARG A 43 -6.159 -15.624 -9.320 1.00 44.33 H new ATOM 0 HH21 ARG A 43 -5.923 -19.140 -9.420 1.00 74.53 H new ATOM 0 HH22 ARG A 43 -5.462 -17.622 -10.197 1.00 74.53 H new ATOM 710 N THR A 44 -9.197 -15.690 -1.542 1.00 62.23 N ATOM 711 CA THR A 44 -9.987 -14.998 -0.532 1.00 30.51 C ATOM 712 C THR A 44 -10.630 -13.740 -1.103 1.00 74.23 C ATOM 713 O THR A 44 -9.984 -12.966 -1.808 1.00 10.12 O ATOM 714 CB THR A 44 -9.128 -14.614 0.687 1.00 4.31 C ATOM 715 OG1 THR A 44 -9.965 -14.130 1.744 1.00 65.24 O ATOM 716 CG2 THR A 44 -8.106 -13.549 0.315 1.00 74.41 C ATOM 0 H THR A 44 -8.247 -15.918 -1.250 1.00 62.23 H new ATOM 0 HA THR A 44 -10.768 -15.689 -0.214 1.00 30.51 H new ATOM 0 HB THR A 44 -8.596 -15.504 1.024 1.00 4.31 H new ATOM 0 HG1 THR A 44 -9.411 -13.890 2.516 1.00 65.24 H new ATOM 0 HG21 THR A 44 -7.511 -13.294 1.192 1.00 74.41 H new ATOM 0 HG22 THR A 44 -7.452 -13.931 -0.469 1.00 74.41 H new ATOM 0 HG23 THR A 44 -8.622 -12.659 -0.045 1.00 74.41 H new ATOM 724 N GLY A 45 -11.908 -13.542 -0.794 1.00 53.35 N ATOM 725 CA GLY A 45 -12.618 -12.375 -1.286 1.00 4.35 C ATOM 726 C GLY A 45 -13.578 -12.710 -2.409 1.00 63.25 C ATOM 727 O GLY A 45 -14.482 -11.933 -2.714 1.00 32.34 O ATOM 0 H GLY A 45 -12.464 -14.168 -0.212 1.00 53.35 H new ATOM 0 HA2 GLY A 45 -13.170 -11.917 -0.465 1.00 4.35 H new ATOM 0 HA3 GLY A 45 -11.897 -11.636 -1.637 1.00 4.35 H new ATOM 731 N GLU A 46 -13.380 -13.870 -3.029 1.00 2.24 N ATOM 732 CA GLU A 46 -14.235 -14.304 -4.127 1.00 64.12 C ATOM 733 C GLU A 46 -14.603 -15.778 -3.980 1.00 42.32 C ATOM 734 O GLU A 46 -13.826 -16.574 -3.453 1.00 43.11 O ATOM 735 CB GLU A 46 -13.536 -14.073 -5.469 1.00 22.13 C ATOM 736 CG GLU A 46 -12.087 -14.531 -5.487 1.00 72.42 C ATOM 737 CD GLU A 46 -11.488 -14.515 -6.880 1.00 40.01 C ATOM 738 OE1 GLU A 46 -12.015 -15.227 -7.760 1.00 61.33 O ATOM 739 OE2 GLU A 46 -10.493 -13.791 -7.090 1.00 2.31 O ATOM 0 H GLU A 46 -12.636 -14.525 -2.789 1.00 2.24 H new ATOM 0 HA GLU A 46 -15.151 -13.714 -4.096 1.00 64.12 H new ATOM 0 HB2 GLU A 46 -14.084 -14.599 -6.250 1.00 22.13 H new ATOM 0 HB3 GLU A 46 -13.576 -13.011 -5.712 1.00 22.13 H new ATOM 0 HG2 GLU A 46 -11.498 -13.886 -4.835 1.00 72.42 H new ATOM 0 HG3 GLU A 46 -12.024 -15.540 -5.080 1.00 72.42 H new ATOM 746 N VAL A 47 -15.794 -16.134 -4.450 1.00 14.41 N ATOM 747 CA VAL A 47 -16.267 -17.511 -4.372 1.00 3.22 C ATOM 748 C VAL A 47 -15.659 -18.364 -5.480 1.00 1.25 C ATOM 749 O VAL A 47 -15.644 -17.968 -6.646 1.00 0.01 O ATOM 750 CB VAL A 47 -17.802 -17.584 -4.467 1.00 13.32 C ATOM 751 CG1 VAL A 47 -18.289 -18.995 -4.174 1.00 52.25 C ATOM 752 CG2 VAL A 47 -18.443 -16.582 -3.517 1.00 64.52 C ATOM 0 H VAL A 47 -16.449 -15.487 -4.889 1.00 14.41 H new ATOM 0 HA VAL A 47 -15.952 -17.899 -3.403 1.00 3.22 H new ATOM 0 HB VAL A 47 -18.098 -17.327 -5.484 1.00 13.32 H new ATOM 0 HG11 VAL A 47 -19.376 -19.027 -4.246 1.00 52.25 H new ATOM 0 HG12 VAL A 47 -17.857 -19.687 -4.897 1.00 52.25 H new ATOM 0 HG13 VAL A 47 -17.983 -19.284 -3.168 1.00 52.25 H new ATOM 0 HG21 VAL A 47 -19.528 -16.647 -3.597 1.00 64.52 H new ATOM 0 HG22 VAL A 47 -18.141 -16.806 -2.494 1.00 64.52 H new ATOM 0 HG23 VAL A 47 -18.120 -15.574 -3.779 1.00 64.52 H new ATOM 762 N LEU A 48 -15.158 -19.537 -5.108 1.00 14.10 N ATOM 763 CA LEU A 48 -14.549 -20.448 -6.070 1.00 61.14 C ATOM 764 C LEU A 48 -15.286 -21.783 -6.098 1.00 63.42 C ATOM 765 O LEU A 48 -15.992 -22.150 -5.159 1.00 32.21 O ATOM 766 CB LEU A 48 -13.075 -20.673 -5.727 1.00 53.22 C ATOM 767 CG LEU A 48 -12.726 -20.677 -4.239 1.00 1.04 C ATOM 768 CD1 LEU A 48 -11.530 -21.578 -3.974 1.00 5.34 C ATOM 769 CD2 LEU A 48 -12.449 -19.262 -3.752 1.00 23.11 C ATOM 0 H LEU A 48 -15.162 -19.879 -4.147 1.00 14.10 H new ATOM 0 HA LEU A 48 -14.620 -19.994 -7.058 1.00 61.14 H new ATOM 0 HB2 LEU A 48 -12.764 -21.626 -6.155 1.00 53.22 H new ATOM 0 HB3 LEU A 48 -12.486 -19.897 -6.216 1.00 53.22 H new ATOM 0 HG LEU A 48 -13.580 -21.069 -3.686 1.00 1.04 H new ATOM 0 HD11 LEU A 48 -11.296 -21.568 -2.909 1.00 5.34 H new ATOM 0 HD12 LEU A 48 -11.765 -22.596 -4.285 1.00 5.34 H new ATOM 0 HD13 LEU A 48 -10.670 -21.216 -4.538 1.00 5.34 H new ATOM 0 HD21 LEU A 48 -12.202 -19.284 -2.691 1.00 23.11 H new ATOM 0 HD22 LEU A 48 -11.612 -18.842 -4.310 1.00 23.11 H new ATOM 0 HD23 LEU A 48 -13.334 -18.644 -3.906 1.00 23.11 H new ATOM 781 N PRO A 49 -15.117 -22.530 -7.200 1.00 1.13 N ATOM 782 CA PRO A 49 -15.756 -23.838 -7.375 1.00 44.42 C ATOM 783 C PRO A 49 -15.171 -24.898 -6.448 1.00 45.42 C ATOM 784 O PRO A 49 -14.162 -24.665 -5.782 1.00 44.32 O ATOM 785 CB PRO A 49 -15.460 -24.183 -8.837 1.00 30.42 C ATOM 786 CG PRO A 49 -14.221 -23.424 -9.163 1.00 5.25 C ATOM 787 CD PRO A 49 -14.289 -22.155 -8.358 1.00 61.13 C ATOM 0 HA PRO A 49 -16.819 -23.808 -7.136 1.00 44.42 H new ATOM 0 HB2 PRO A 49 -15.313 -25.255 -8.969 1.00 30.42 H new ATOM 0 HB3 PRO A 49 -16.285 -23.892 -9.487 1.00 30.42 H new ATOM 0 HG2 PRO A 49 -13.332 -24.001 -8.908 1.00 5.25 H new ATOM 0 HG3 PRO A 49 -14.166 -23.207 -10.230 1.00 5.25 H new ATOM 0 HD2 PRO A 49 -13.298 -21.820 -8.052 1.00 61.13 H new ATOM 0 HD3 PRO A 49 -14.739 -21.342 -8.927 1.00 61.13 H new ATOM 795 N ARG A 50 -15.810 -26.062 -6.411 1.00 23.24 N ATOM 796 CA ARG A 50 -15.352 -27.158 -5.564 1.00 55.24 C ATOM 797 C ARG A 50 -14.584 -28.192 -6.382 1.00 3.22 C ATOM 798 O ARG A 50 -13.604 -28.768 -5.909 1.00 33.22 O ATOM 799 CB ARG A 50 -16.541 -27.823 -4.869 1.00 32.35 C ATOM 800 CG ARG A 50 -16.190 -29.133 -4.182 1.00 61.34 C ATOM 801 CD ARG A 50 -17.413 -29.774 -3.546 1.00 31.24 C ATOM 802 NE ARG A 50 -18.557 -29.791 -4.453 1.00 52.20 N ATOM 803 CZ ARG A 50 -18.641 -30.583 -5.516 1.00 45.22 C ATOM 804 NH1 ARG A 50 -17.652 -31.419 -5.803 1.00 52.55 N ATOM 805 NH2 ARG A 50 -19.715 -30.540 -6.294 1.00 65.03 N ATOM 0 H ARG A 50 -16.646 -26.271 -6.957 1.00 23.24 H new ATOM 0 HA ARG A 50 -14.682 -26.746 -4.809 1.00 55.24 H new ATOM 0 HB2 ARG A 50 -16.951 -27.134 -4.131 1.00 32.35 H new ATOM 0 HB3 ARG A 50 -17.325 -28.007 -5.604 1.00 32.35 H new ATOM 0 HG2 ARG A 50 -15.754 -29.820 -4.907 1.00 61.34 H new ATOM 0 HG3 ARG A 50 -15.434 -28.953 -3.418 1.00 61.34 H new ATOM 0 HD2 ARG A 50 -17.173 -30.794 -3.246 1.00 31.24 H new ATOM 0 HD3 ARG A 50 -17.677 -29.230 -2.640 1.00 31.24 H new ATOM 0 HE ARG A 50 -19.335 -29.160 -4.260 1.00 52.20 H new ATOM 0 HH11 ARG A 50 -16.825 -31.455 -5.207 1.00 52.55 H new ATOM 0 HH12 ARG A 50 -17.718 -32.026 -6.620 1.00 52.55 H new ATOM 0 HH21 ARG A 50 -20.477 -29.898 -6.076 1.00 65.03 H new ATOM 0 HH22 ARG A 50 -19.778 -31.149 -7.110 1.00 65.03 H new ATOM 819 N SER A 51 -15.035 -28.422 -7.611 1.00 10.43 N ATOM 820 CA SER A 51 -14.393 -29.389 -8.492 1.00 64.15 C ATOM 821 C SER A 51 -12.894 -29.121 -8.593 1.00 51.03 C ATOM 822 O SER A 51 -12.087 -30.050 -8.639 1.00 62.23 O ATOM 823 CB SER A 51 -15.026 -29.341 -9.884 1.00 64.25 C ATOM 824 OG SER A 51 -15.379 -28.015 -10.238 1.00 74.45 O ATOM 0 H SER A 51 -15.843 -27.951 -8.019 1.00 10.43 H new ATOM 0 HA SER A 51 -14.539 -30.383 -8.068 1.00 64.15 H new ATOM 0 HB2 SER A 51 -14.328 -29.743 -10.618 1.00 64.25 H new ATOM 0 HB3 SER A 51 -15.912 -29.975 -9.906 1.00 64.25 H new ATOM 0 HG SER A 51 -15.780 -28.011 -11.132 1.00 74.45 H new ATOM 830 N LEU A 52 -12.529 -27.844 -8.627 1.00 72.25 N ATOM 831 CA LEU A 52 -11.127 -27.451 -8.723 1.00 34.31 C ATOM 832 C LEU A 52 -10.361 -27.859 -7.469 1.00 30.32 C ATOM 833 O LEU A 52 -9.329 -28.526 -7.550 1.00 31.32 O ATOM 834 CB LEU A 52 -11.014 -25.941 -8.935 1.00 10.32 C ATOM 835 CG LEU A 52 -9.629 -25.334 -8.711 1.00 45.32 C ATOM 836 CD1 LEU A 52 -8.596 -26.024 -9.589 1.00 4.44 C ATOM 837 CD2 LEU A 52 -9.651 -23.837 -8.987 1.00 30.32 C ATOM 0 H LEU A 52 -13.184 -27.063 -8.590 1.00 72.25 H new ATOM 0 HA LEU A 52 -10.688 -27.965 -9.578 1.00 34.31 H new ATOM 0 HB2 LEU A 52 -11.328 -25.713 -9.953 1.00 10.32 H new ATOM 0 HB3 LEU A 52 -11.718 -25.447 -8.266 1.00 10.32 H new ATOM 0 HG LEU A 52 -9.351 -25.487 -7.668 1.00 45.32 H new ATOM 0 HD11 LEU A 52 -7.616 -25.579 -9.416 1.00 4.44 H new ATOM 0 HD12 LEU A 52 -8.561 -27.085 -9.344 1.00 4.44 H new ATOM 0 HD13 LEU A 52 -8.870 -25.903 -10.637 1.00 4.44 H new ATOM 0 HD21 LEU A 52 -8.657 -23.422 -8.822 1.00 30.32 H new ATOM 0 HD22 LEU A 52 -9.951 -23.662 -10.020 1.00 30.32 H new ATOM 0 HD23 LEU A 52 -10.361 -23.354 -8.316 1.00 30.32 H new ATOM 849 N ILE A 53 -10.874 -27.456 -6.311 1.00 64.21 N ATOM 850 CA ILE A 53 -10.239 -27.783 -5.040 1.00 50.12 C ATOM 851 C ILE A 53 -10.032 -29.287 -4.900 1.00 22.12 C ATOM 852 O ILE A 53 -8.933 -29.746 -4.587 1.00 73.34 O ATOM 853 CB ILE A 53 -11.073 -27.277 -3.848 1.00 70.52 C ATOM 854 CG1 ILE A 53 -11.290 -25.766 -3.953 1.00 64.54 C ATOM 855 CG2 ILE A 53 -10.389 -27.630 -2.536 1.00 1.12 C ATOM 856 CD1 ILE A 53 -12.399 -25.252 -3.063 1.00 41.42 C ATOM 0 H ILE A 53 -11.727 -26.903 -6.227 1.00 64.21 H new ATOM 0 HA ILE A 53 -9.270 -27.284 -5.033 1.00 50.12 H new ATOM 0 HB ILE A 53 -12.047 -27.766 -3.871 1.00 70.52 H new ATOM 0 HG12 ILE A 53 -10.362 -25.255 -3.696 1.00 64.54 H new ATOM 0 HG13 ILE A 53 -11.518 -25.511 -4.988 1.00 64.54 H new ATOM 0 HG21 ILE A 53 -10.990 -27.266 -1.703 1.00 1.12 H new ATOM 0 HG22 ILE A 53 -10.282 -28.712 -2.461 1.00 1.12 H new ATOM 0 HG23 ILE A 53 -9.404 -27.165 -2.503 1.00 1.12 H new ATOM 0 HD11 ILE A 53 -12.497 -24.174 -3.189 1.00 41.42 H new ATOM 0 HD12 ILE A 53 -13.337 -25.736 -3.335 1.00 41.42 H new ATOM 0 HD13 ILE A 53 -12.164 -25.476 -2.022 1.00 41.42 H new ATOM 868 N SER A 54 -11.095 -30.050 -5.135 1.00 2.24 N ATOM 869 CA SER A 54 -11.030 -31.503 -5.033 1.00 35.05 C ATOM 870 C SER A 54 -9.911 -32.060 -5.906 1.00 43.14 C ATOM 871 O SER A 54 -9.317 -33.091 -5.591 1.00 5.20 O ATOM 872 CB SER A 54 -12.368 -32.124 -5.441 1.00 1.24 C ATOM 873 OG SER A 54 -12.981 -31.378 -6.478 1.00 62.22 O ATOM 0 H SER A 54 -12.011 -29.686 -5.397 1.00 2.24 H new ATOM 0 HA SER A 54 -10.819 -31.760 -3.995 1.00 35.05 H new ATOM 0 HB2 SER A 54 -12.210 -33.151 -5.772 1.00 1.24 H new ATOM 0 HB3 SER A 54 -13.032 -32.166 -4.577 1.00 1.24 H new ATOM 0 HG SER A 54 -12.309 -31.139 -7.150 1.00 62.22 H new ATOM 879 N SER A 55 -9.628 -31.370 -7.007 1.00 15.23 N ATOM 880 CA SER A 55 -8.583 -31.796 -7.929 1.00 60.34 C ATOM 881 C SER A 55 -7.200 -31.556 -7.332 1.00 21.33 C ATOM 882 O SER A 55 -6.247 -32.276 -7.633 1.00 61.12 O ATOM 883 CB SER A 55 -8.712 -31.052 -9.260 1.00 14.44 C ATOM 884 OG SER A 55 -8.006 -31.721 -10.290 1.00 32.13 O ATOM 0 H SER A 55 -10.109 -30.513 -7.281 1.00 15.23 H new ATOM 0 HA SER A 55 -8.703 -32.865 -8.105 1.00 60.34 H new ATOM 0 HB2 SER A 55 -9.764 -30.967 -9.532 1.00 14.44 H new ATOM 0 HB3 SER A 55 -8.328 -30.038 -9.152 1.00 14.44 H new ATOM 0 HG SER A 55 -7.319 -31.125 -10.656 1.00 32.13 H new ATOM 890 N LEU A 56 -7.098 -30.540 -6.483 1.00 3.32 N ATOM 891 CA LEU A 56 -5.832 -30.203 -5.841 1.00 64.02 C ATOM 892 C LEU A 56 -5.461 -31.242 -4.788 1.00 74.50 C ATOM 893 O LEU A 56 -4.340 -31.254 -4.279 1.00 74.22 O ATOM 894 CB LEU A 56 -5.915 -28.817 -5.199 1.00 73.20 C ATOM 895 CG LEU A 56 -5.178 -27.694 -5.928 1.00 43.25 C ATOM 896 CD1 LEU A 56 -3.675 -27.831 -5.740 1.00 21.34 C ATOM 897 CD2 LEU A 56 -5.533 -27.695 -7.408 1.00 55.10 C ATOM 0 H LEU A 56 -7.877 -29.935 -6.223 1.00 3.32 H new ATOM 0 HA LEU A 56 -5.056 -30.196 -6.607 1.00 64.02 H new ATOM 0 HB2 LEU A 56 -6.966 -28.540 -5.115 1.00 73.20 H new ATOM 0 HB3 LEU A 56 -5.521 -28.884 -4.185 1.00 73.20 H new ATOM 0 HG LEU A 56 -5.492 -26.742 -5.499 1.00 43.25 H new ATOM 0 HD11 LEU A 56 -3.167 -27.023 -6.266 1.00 21.34 H new ATOM 0 HD12 LEU A 56 -3.435 -27.780 -4.678 1.00 21.34 H new ATOM 0 HD13 LEU A 56 -3.344 -28.789 -6.141 1.00 21.34 H new ATOM 0 HD21 LEU A 56 -4.999 -26.889 -7.911 1.00 55.10 H new ATOM 0 HD22 LEU A 56 -5.248 -28.650 -7.850 1.00 55.10 H new ATOM 0 HD23 LEU A 56 -6.607 -27.547 -7.525 1.00 55.10 H new ATOM 909 N VAL A 57 -6.411 -32.116 -4.467 1.00 5.12 N ATOM 910 CA VAL A 57 -6.183 -33.162 -3.477 1.00 15.02 C ATOM 911 C VAL A 57 -6.467 -34.542 -4.060 1.00 51.42 C ATOM 912 O VAL A 57 -5.546 -35.296 -4.371 1.00 63.41 O ATOM 913 CB VAL A 57 -7.062 -32.954 -2.229 1.00 0.22 C ATOM 914 CG1 VAL A 57 -6.247 -32.348 -1.097 1.00 4.22 C ATOM 915 CG2 VAL A 57 -8.261 -32.078 -2.562 1.00 23.44 C ATOM 0 H VAL A 57 -7.345 -32.120 -4.878 1.00 5.12 H new ATOM 0 HA VAL A 57 -5.134 -33.101 -3.188 1.00 15.02 H new ATOM 0 HB VAL A 57 -7.431 -33.925 -1.900 1.00 0.22 H new ATOM 0 HG11 VAL A 57 -6.885 -32.208 -0.224 1.00 4.22 H new ATOM 0 HG12 VAL A 57 -5.425 -33.016 -0.843 1.00 4.22 H new ATOM 0 HG13 VAL A 57 -5.847 -31.384 -1.412 1.00 4.22 H new ATOM 0 HG21 VAL A 57 -8.871 -31.941 -1.669 1.00 23.44 H new ATOM 0 HG22 VAL A 57 -7.915 -31.107 -2.917 1.00 23.44 H new ATOM 0 HG23 VAL A 57 -8.857 -32.557 -3.339 1.00 23.44 H new ATOM 925 N TRP A 58 -7.747 -34.864 -4.206 1.00 51.03 N ATOM 926 CA TRP A 58 -8.153 -36.154 -4.753 1.00 45.23 C ATOM 927 C TRP A 58 -8.097 -36.141 -6.277 1.00 10.40 C ATOM 928 O TRP A 58 -7.187 -36.709 -6.879 1.00 31.13 O ATOM 929 CB TRP A 58 -9.565 -36.508 -4.285 1.00 61.32 C ATOM 930 CG TRP A 58 -9.614 -37.012 -2.874 1.00 51.04 C ATOM 931 CD1 TRP A 58 -10.338 -36.488 -1.842 1.00 2.33 C ATOM 932 CD2 TRP A 58 -8.909 -38.138 -2.342 1.00 30.44 C ATOM 933 NE1 TRP A 58 -10.125 -37.220 -0.699 1.00 31.41 N ATOM 934 CE2 TRP A 58 -9.253 -38.239 -0.979 1.00 73.03 C ATOM 935 CE3 TRP A 58 -8.022 -39.073 -2.883 1.00 33.02 C ATOM 936 CZ2 TRP A 58 -8.740 -39.236 -0.154 1.00 11.22 C ATOM 937 CZ3 TRP A 58 -7.514 -40.062 -2.062 1.00 45.51 C ATOM 938 CH2 TRP A 58 -7.874 -40.137 -0.710 1.00 61.41 C ATOM 0 H TRP A 58 -8.522 -34.250 -3.953 1.00 51.03 H new ATOM 0 HA TRP A 58 -7.457 -36.910 -4.389 1.00 45.23 H new ATOM 0 HB2 TRP A 58 -10.200 -35.626 -4.371 1.00 61.32 H new ATOM 0 HB3 TRP A 58 -9.981 -37.266 -4.949 1.00 61.32 H new ATOM 0 HD1 TRP A 58 -10.983 -35.625 -1.914 1.00 2.33 H new ATOM 0 HE1 TRP A 58 -10.548 -37.035 0.211 1.00 31.41 H new ATOM 0 HE3 TRP A 58 -7.739 -39.024 -3.924 1.00 33.02 H new ATOM 0 HZ2 TRP A 58 -9.016 -39.296 0.888 1.00 11.22 H new ATOM 0 HZ3 TRP A 58 -6.828 -40.790 -2.470 1.00 45.51 H new ATOM 0 HH2 TRP A 58 -7.459 -40.922 -0.095 1.00 61.41 H new ATOM 949 N ASN A 59 -9.076 -35.488 -6.895 1.00 11.11 N ATOM 950 CA ASN A 59 -9.138 -35.401 -8.349 1.00 60.44 C ATOM 951 C ASN A 59 -10.357 -34.599 -8.795 1.00 62.33 C ATOM 952 O ASN A 59 -11.190 -34.211 -7.977 1.00 43.41 O ATOM 953 CB ASN A 59 -9.183 -36.802 -8.963 1.00 31.30 C ATOM 954 CG ASN A 59 -10.216 -37.692 -8.298 1.00 5.23 C ATOM 955 OD1 ASN A 59 -9.876 -38.570 -7.504 1.00 40.51 O ATOM 956 ND2 ASN A 59 -11.484 -37.468 -8.620 1.00 33.33 N ATOM 0 H ASN A 59 -9.837 -35.011 -6.411 1.00 11.11 H new ATOM 0 HA ASN A 59 -8.241 -34.888 -8.696 1.00 60.44 H new ATOM 0 HB2 ASN A 59 -9.407 -36.722 -10.027 1.00 31.30 H new ATOM 0 HB3 ASN A 59 -8.200 -37.265 -8.878 1.00 31.30 H new ATOM 0 HD21 ASN A 59 -12.223 -38.035 -8.205 1.00 33.33 H new ATOM 0 HD22 ASN A 59 -11.719 -36.729 -9.283 1.00 33.33 H new ATOM 963 N MET A 60 -10.454 -34.356 -10.098 1.00 61.13 N ATOM 964 CA MET A 60 -11.572 -33.602 -10.653 1.00 41.13 C ATOM 965 C MET A 60 -12.603 -34.538 -11.276 1.00 42.45 C ATOM 966 O MET A 60 -12.273 -35.643 -11.703 1.00 71.41 O ATOM 967 CB MET A 60 -11.072 -32.605 -11.700 1.00 54.43 C ATOM 968 CG MET A 60 -10.632 -33.258 -13.000 1.00 42.23 C ATOM 969 SD MET A 60 -9.901 -32.082 -14.156 1.00 15.02 S ATOM 970 CE MET A 60 -8.189 -32.113 -13.633 1.00 64.33 C ATOM 0 H MET A 60 -9.772 -34.670 -10.789 1.00 61.13 H new ATOM 0 HA MET A 60 -12.049 -33.055 -9.840 1.00 41.13 H new ATOM 0 HB2 MET A 60 -11.864 -31.887 -11.913 1.00 54.43 H new ATOM 0 HB3 MET A 60 -10.236 -32.043 -11.284 1.00 54.43 H new ATOM 0 HG2 MET A 60 -9.909 -34.043 -12.781 1.00 42.23 H new ATOM 0 HG3 MET A 60 -11.491 -33.738 -13.470 1.00 42.23 H new ATOM 0 HE1 MET A 60 -7.545 -31.891 -14.484 1.00 64.33 H new ATOM 0 HE2 MET A 60 -8.033 -31.366 -12.854 1.00 64.33 H new ATOM 0 HE3 MET A 60 -7.946 -33.101 -13.242 1.00 64.33 H new ATOM 980 N ASN A 61 -13.852 -34.086 -11.325 1.00 71.41 N ATOM 981 CA ASN A 61 -14.931 -34.884 -11.896 1.00 33.45 C ATOM 982 C ASN A 61 -16.217 -34.069 -11.993 1.00 73.45 C ATOM 983 O ASN A 61 -16.397 -33.085 -11.276 1.00 35.21 O ATOM 984 CB ASN A 61 -15.171 -36.136 -11.049 1.00 3.04 C ATOM 985 CG ASN A 61 -15.889 -37.227 -11.819 1.00 43.04 C ATOM 986 OD1 ASN A 61 -16.098 -37.114 -13.027 1.00 64.34 O ATOM 987 ND2 ASN A 61 -16.270 -38.291 -11.122 1.00 14.41 N ATOM 0 H ASN A 61 -14.142 -33.172 -10.977 1.00 71.41 H new ATOM 0 HA ASN A 61 -14.635 -35.184 -12.901 1.00 33.45 H new ATOM 0 HB2 ASN A 61 -14.215 -36.517 -10.691 1.00 3.04 H new ATOM 0 HB3 ASN A 61 -15.758 -35.869 -10.170 1.00 3.04 H new ATOM 0 HD21 ASN A 61 -16.757 -39.057 -11.587 1.00 14.41 H new ATOM 0 HD22 ASN A 61 -16.076 -38.342 -10.122 1.00 14.41 H new ATOM 994 N PHE A 62 -17.109 -34.486 -12.886 1.00 70.32 N ATOM 995 CA PHE A 62 -18.379 -33.795 -13.079 1.00 24.32 C ATOM 996 C PHE A 62 -19.270 -33.942 -11.849 1.00 4.33 C ATOM 997 O PHE A 62 -20.112 -33.087 -11.574 1.00 3.24 O ATOM 998 CB PHE A 62 -19.099 -34.343 -14.313 1.00 14.45 C ATOM 999 CG PHE A 62 -20.435 -33.702 -14.560 1.00 13.03 C ATOM 1000 CD1 PHE A 62 -20.561 -32.323 -14.596 1.00 41.31 C ATOM 1001 CD2 PHE A 62 -21.566 -34.479 -14.755 1.00 65.31 C ATOM 1002 CE1 PHE A 62 -21.789 -31.730 -14.824 1.00 4.13 C ATOM 1003 CE2 PHE A 62 -22.796 -33.892 -14.983 1.00 63.25 C ATOM 1004 CZ PHE A 62 -22.908 -32.516 -15.017 1.00 3.14 C ATOM 0 H PHE A 62 -16.976 -35.299 -13.487 1.00 70.32 H new ATOM 0 HA PHE A 62 -18.169 -32.736 -13.230 1.00 24.32 H new ATOM 0 HB2 PHE A 62 -18.467 -34.196 -15.188 1.00 14.45 H new ATOM 0 HB3 PHE A 62 -19.236 -35.418 -14.196 1.00 14.45 H new ATOM 0 HD1 PHE A 62 -19.689 -31.704 -14.444 1.00 41.31 H new ATOM 0 HD2 PHE A 62 -21.485 -35.556 -14.728 1.00 65.31 H new ATOM 0 HE1 PHE A 62 -21.873 -30.654 -14.851 1.00 4.13 H new ATOM 0 HE2 PHE A 62 -23.669 -34.509 -15.135 1.00 63.25 H new ATOM 0 HZ PHE A 62 -23.869 -32.056 -15.194 1.00 3.14 H new ATOM 1014 N ASP A 63 -19.078 -35.031 -11.113 1.00 63.01 N ATOM 1015 CA ASP A 63 -19.863 -35.291 -9.912 1.00 3.52 C ATOM 1016 C ASP A 63 -19.153 -34.754 -8.673 1.00 13.35 C ATOM 1017 O ASP A 63 -18.162 -34.031 -8.777 1.00 15.24 O ATOM 1018 CB ASP A 63 -20.119 -36.791 -9.758 1.00 40.43 C ATOM 1019 CG ASP A 63 -20.661 -37.418 -11.028 1.00 21.15 C ATOM 1020 OD1 ASP A 63 -21.893 -37.381 -11.228 1.00 44.43 O ATOM 1021 OD2 ASP A 63 -19.853 -37.948 -11.820 1.00 13.33 O ATOM 0 H ASP A 63 -18.385 -35.748 -11.327 1.00 63.01 H new ATOM 0 HA ASP A 63 -20.818 -34.776 -10.014 1.00 3.52 H new ATOM 0 HB2 ASP A 63 -19.190 -37.288 -9.478 1.00 40.43 H new ATOM 0 HB3 ASP A 63 -20.826 -36.955 -8.945 1.00 40.43 H new ATOM 1026 N SER A 64 -19.668 -35.112 -7.501 1.00 12.55 N ATOM 1027 CA SER A 64 -19.087 -34.662 -6.241 1.00 10.20 C ATOM 1028 C SER A 64 -18.505 -35.837 -5.461 1.00 40.21 C ATOM 1029 O SER A 64 -19.162 -36.862 -5.279 1.00 12.20 O ATOM 1030 CB SER A 64 -20.142 -33.946 -5.395 1.00 42.01 C ATOM 1031 OG SER A 64 -19.797 -33.971 -4.021 1.00 25.11 O ATOM 0 H SER A 64 -20.486 -35.712 -7.398 1.00 12.55 H new ATOM 0 HA SER A 64 -18.281 -33.965 -6.470 1.00 10.20 H new ATOM 0 HB2 SER A 64 -20.241 -32.913 -5.729 1.00 42.01 H new ATOM 0 HB3 SER A 64 -21.112 -34.422 -5.538 1.00 42.01 H new ATOM 0 HG SER A 64 -20.486 -33.506 -3.502 1.00 25.11 H new ATOM 1037 N ASP A 65 -17.268 -35.680 -5.003 1.00 41.21 N ATOM 1038 CA ASP A 65 -16.596 -36.726 -4.242 1.00 21.34 C ATOM 1039 C ASP A 65 -17.175 -36.831 -2.834 1.00 42.01 C ATOM 1040 O ASP A 65 -16.585 -36.341 -1.870 1.00 72.31 O ATOM 1041 CB ASP A 65 -15.093 -36.449 -4.169 1.00 75.23 C ATOM 1042 CG ASP A 65 -14.436 -36.463 -5.535 1.00 62.52 C ATOM 1043 OD1 ASP A 65 -14.017 -37.552 -5.980 1.00 74.43 O ATOM 1044 OD2 ASP A 65 -14.339 -35.386 -6.159 1.00 5.54 O ATOM 0 H ASP A 65 -16.710 -34.838 -5.146 1.00 41.21 H new ATOM 0 HA ASP A 65 -16.758 -37.674 -4.754 1.00 21.34 H new ATOM 0 HB2 ASP A 65 -14.927 -35.480 -3.699 1.00 75.23 H new ATOM 0 HB3 ASP A 65 -14.619 -37.197 -3.533 1.00 75.23 H new ATOM 1049 N THR A 66 -18.334 -37.472 -2.722 1.00 71.05 N ATOM 1050 CA THR A 66 -18.994 -37.639 -1.434 1.00 32.11 C ATOM 1051 C THR A 66 -18.911 -36.363 -0.604 1.00 23.31 C ATOM 1052 O THR A 66 -18.783 -36.414 0.619 1.00 75.43 O ATOM 1053 CB THR A 66 -18.376 -38.801 -0.633 1.00 14.33 C ATOM 1054 OG1 THR A 66 -19.131 -39.027 0.563 1.00 75.43 O ATOM 1055 CG2 THR A 66 -16.928 -38.501 -0.275 1.00 35.41 C ATOM 0 H THR A 66 -18.835 -37.884 -3.509 1.00 71.05 H new ATOM 0 HA THR A 66 -20.040 -37.866 -1.641 1.00 32.11 H new ATOM 0 HB THR A 66 -18.402 -39.696 -1.254 1.00 14.33 H new ATOM 0 HG1 THR A 66 -19.213 -38.187 1.062 1.00 75.43 H new ATOM 0 HG21 THR A 66 -16.513 -39.335 0.290 1.00 35.41 H new ATOM 0 HG22 THR A 66 -16.350 -38.357 -1.188 1.00 35.41 H new ATOM 0 HG23 THR A 66 -16.883 -37.595 0.329 1.00 35.41 H new ATOM 1063 N ASN A 67 -18.984 -35.219 -1.277 1.00 22.35 N ATOM 1064 CA ASN A 67 -18.917 -33.929 -0.600 1.00 25.21 C ATOM 1065 C ASN A 67 -17.787 -33.911 0.425 1.00 4.32 C ATOM 1066 O ASN A 67 -17.947 -33.398 1.533 1.00 71.40 O ATOM 1067 CB ASN A 67 -20.248 -33.620 0.087 1.00 53.01 C ATOM 1068 CG ASN A 67 -21.441 -33.962 -0.785 1.00 13.23 C ATOM 1069 OD1 ASN A 67 -21.951 -33.115 -1.518 1.00 15.30 O ATOM 1070 ND2 ASN A 67 -21.892 -35.209 -0.708 1.00 11.41 N ATOM 0 H ASN A 67 -19.089 -35.159 -2.290 1.00 22.35 H new ATOM 0 HA ASN A 67 -18.717 -33.164 -1.350 1.00 25.21 H new ATOM 0 HB2 ASN A 67 -20.311 -34.180 1.020 1.00 53.01 H new ATOM 0 HB3 ASN A 67 -20.283 -32.562 0.347 1.00 53.01 H new ATOM 0 HD21 ASN A 67 -22.692 -35.498 -1.271 1.00 11.41 H new ATOM 0 HD22 ASN A 67 -21.438 -35.878 -0.086 1.00 11.41 H new ATOM 1077 N VAL A 68 -16.643 -34.473 0.047 1.00 21.03 N ATOM 1078 CA VAL A 68 -15.485 -34.520 0.932 1.00 31.02 C ATOM 1079 C VAL A 68 -14.896 -33.129 1.141 1.00 32.40 C ATOM 1080 O VAL A 68 -14.291 -32.850 2.176 1.00 11.33 O ATOM 1081 CB VAL A 68 -14.391 -35.451 0.376 1.00 10.41 C ATOM 1082 CG1 VAL A 68 -13.798 -34.875 -0.901 1.00 0.54 C ATOM 1083 CG2 VAL A 68 -13.308 -35.682 1.419 1.00 35.44 C ATOM 0 H VAL A 68 -16.493 -34.902 -0.866 1.00 21.03 H new ATOM 0 HA VAL A 68 -15.833 -34.911 1.888 1.00 31.02 H new ATOM 0 HB VAL A 68 -14.844 -36.413 0.136 1.00 10.41 H new ATOM 0 HG11 VAL A 68 -13.027 -35.546 -1.279 1.00 0.54 H new ATOM 0 HG12 VAL A 68 -14.583 -34.766 -1.649 1.00 0.54 H new ATOM 0 HG13 VAL A 68 -13.359 -33.900 -0.691 1.00 0.54 H new ATOM 0 HG21 VAL A 68 -12.543 -36.342 1.009 1.00 35.44 H new ATOM 0 HG22 VAL A 68 -12.856 -34.728 1.692 1.00 35.44 H new ATOM 0 HG23 VAL A 68 -13.748 -36.142 2.304 1.00 35.44 H new ATOM 1093 N ILE A 69 -15.078 -32.261 0.152 1.00 61.44 N ATOM 1094 CA ILE A 69 -14.566 -30.899 0.228 1.00 41.22 C ATOM 1095 C ILE A 69 -15.293 -30.098 1.302 1.00 1.44 C ATOM 1096 O ILE A 69 -14.672 -29.578 2.230 1.00 15.12 O ATOM 1097 CB ILE A 69 -14.703 -30.169 -1.122 1.00 34.44 C ATOM 1098 CG1 ILE A 69 -14.040 -30.982 -2.235 1.00 71.24 C ATOM 1099 CG2 ILE A 69 -14.092 -28.779 -1.037 1.00 2.01 C ATOM 1100 CD1 ILE A 69 -12.546 -31.139 -2.061 1.00 22.31 C ATOM 0 H ILE A 69 -15.576 -32.477 -0.711 1.00 61.44 H new ATOM 0 HA ILE A 69 -13.510 -30.973 0.486 1.00 41.22 H new ATOM 0 HB ILE A 69 -15.762 -30.064 -1.356 1.00 34.44 H new ATOM 0 HG12 ILE A 69 -14.499 -31.970 -2.275 1.00 71.24 H new ATOM 0 HG13 ILE A 69 -14.237 -30.500 -3.193 1.00 71.24 H new ATOM 0 HG21 ILE A 69 -14.197 -28.276 -1.998 1.00 2.01 H new ATOM 0 HG22 ILE A 69 -14.606 -28.202 -0.268 1.00 2.01 H new ATOM 0 HG23 ILE A 69 -13.035 -28.861 -0.784 1.00 2.01 H new ATOM 0 HD11 ILE A 69 -12.143 -31.726 -2.886 1.00 22.31 H new ATOM 0 HD12 ILE A 69 -12.075 -30.156 -2.052 1.00 22.31 H new ATOM 0 HD13 ILE A 69 -12.341 -31.648 -1.119 1.00 22.31 H new ATOM 1112 N ASP A 70 -16.612 -30.003 1.172 1.00 65.34 N ATOM 1113 CA ASP A 70 -17.425 -29.268 2.133 1.00 3.11 C ATOM 1114 C ASP A 70 -17.251 -29.836 3.538 1.00 12.23 C ATOM 1115 O ASP A 70 -17.121 -29.090 4.509 1.00 11.10 O ATOM 1116 CB ASP A 70 -18.899 -29.316 1.729 1.00 41.33 C ATOM 1117 CG ASP A 70 -19.826 -28.975 2.879 1.00 51.13 C ATOM 1118 OD1 ASP A 70 -19.451 -28.122 3.710 1.00 50.01 O ATOM 1119 OD2 ASP A 70 -20.927 -29.562 2.948 1.00 4.30 O ATOM 0 H ASP A 70 -17.141 -30.426 0.410 1.00 65.34 H new ATOM 0 HA ASP A 70 -17.091 -28.230 2.136 1.00 3.11 H new ATOM 0 HB2 ASP A 70 -19.071 -28.619 0.909 1.00 41.33 H new ATOM 0 HB3 ASP A 70 -19.138 -30.312 1.356 1.00 41.33 H new ATOM 1124 N VAL A 71 -17.251 -31.161 3.640 1.00 74.23 N ATOM 1125 CA VAL A 71 -17.094 -31.830 4.926 1.00 51.41 C ATOM 1126 C VAL A 71 -15.696 -31.608 5.493 1.00 73.31 C ATOM 1127 O VAL A 71 -15.510 -31.555 6.708 1.00 3.31 O ATOM 1128 CB VAL A 71 -17.354 -33.343 4.807 1.00 34.15 C ATOM 1129 CG1 VAL A 71 -17.121 -34.031 6.144 1.00 62.44 C ATOM 1130 CG2 VAL A 71 -18.766 -33.603 4.304 1.00 14.44 C ATOM 0 H VAL A 71 -17.358 -31.793 2.847 1.00 74.23 H new ATOM 0 HA VAL A 71 -17.830 -31.395 5.602 1.00 51.41 H new ATOM 0 HB VAL A 71 -16.653 -33.759 4.084 1.00 34.15 H new ATOM 0 HG11 VAL A 71 -17.309 -35.100 6.041 1.00 62.44 H new ATOM 0 HG12 VAL A 71 -16.090 -33.873 6.460 1.00 62.44 H new ATOM 0 HG13 VAL A 71 -17.797 -33.614 6.891 1.00 62.44 H new ATOM 0 HG21 VAL A 71 -18.932 -34.677 4.226 1.00 14.44 H new ATOM 0 HG22 VAL A 71 -19.485 -33.174 5.002 1.00 14.44 H new ATOM 0 HG23 VAL A 71 -18.893 -33.144 3.324 1.00 14.44 H new ATOM 1140 N ALA A 72 -14.717 -31.480 4.604 1.00 3.10 N ATOM 1141 CA ALA A 72 -13.336 -31.262 5.016 1.00 45.44 C ATOM 1142 C ALA A 72 -13.164 -29.889 5.657 1.00 33.05 C ATOM 1143 O ALA A 72 -12.382 -29.723 6.594 1.00 72.53 O ATOM 1144 CB ALA A 72 -12.400 -31.410 3.825 1.00 52.13 C ATOM 0 H ALA A 72 -14.854 -31.523 3.594 1.00 3.10 H new ATOM 0 HA ALA A 72 -13.082 -32.017 5.761 1.00 45.44 H new ATOM 0 HB1 ALA A 72 -11.372 -31.245 4.147 1.00 52.13 H new ATOM 0 HB2 ALA A 72 -12.493 -32.414 3.411 1.00 52.13 H new ATOM 0 HB3 ALA A 72 -12.663 -30.677 3.062 1.00 52.13 H new ATOM 1150 N VAL A 73 -13.900 -28.906 5.148 1.00 73.44 N ATOM 1151 CA VAL A 73 -13.830 -27.548 5.672 1.00 40.34 C ATOM 1152 C VAL A 73 -14.602 -27.423 6.980 1.00 3.24 C ATOM 1153 O VAL A 73 -14.180 -26.717 7.897 1.00 50.24 O ATOM 1154 CB VAL A 73 -14.386 -26.527 4.661 1.00 11.10 C ATOM 1155 CG1 VAL A 73 -14.063 -25.108 5.103 1.00 55.31 C ATOM 1156 CG2 VAL A 73 -13.834 -26.800 3.270 1.00 4.42 C ATOM 0 H VAL A 73 -14.552 -29.025 4.373 1.00 73.44 H new ATOM 0 HA VAL A 73 -12.777 -27.333 5.853 1.00 40.34 H new ATOM 0 HB VAL A 73 -15.470 -26.632 4.623 1.00 11.10 H new ATOM 0 HG11 VAL A 73 -14.463 -24.401 4.377 1.00 55.31 H new ATOM 0 HG12 VAL A 73 -14.512 -24.920 6.078 1.00 55.31 H new ATOM 0 HG13 VAL A 73 -12.982 -24.985 5.171 1.00 55.31 H new ATOM 0 HG21 VAL A 73 -14.237 -26.069 2.569 1.00 4.42 H new ATOM 0 HG22 VAL A 73 -12.747 -26.724 3.289 1.00 4.42 H new ATOM 0 HG23 VAL A 73 -14.122 -27.803 2.955 1.00 4.42 H new ATOM 1166 N ARG A 74 -15.734 -28.113 7.061 1.00 33.33 N ATOM 1167 CA ARG A 74 -16.566 -28.079 8.258 1.00 31.32 C ATOM 1168 C ARG A 74 -15.938 -28.901 9.380 1.00 2.53 C ATOM 1169 O ARG A 74 -15.997 -28.520 10.550 1.00 43.55 O ATOM 1170 CB ARG A 74 -17.967 -28.609 7.947 1.00 60.22 C ATOM 1171 CG ARG A 74 -18.819 -27.642 7.141 1.00 64.34 C ATOM 1172 CD ARG A 74 -19.597 -26.699 8.044 1.00 3.42 C ATOM 1173 NE ARG A 74 -19.849 -25.411 7.403 1.00 1.23 N ATOM 1174 CZ ARG A 74 -20.286 -24.339 8.055 1.00 52.24 C ATOM 1175 NH1 ARG A 74 -20.518 -24.400 9.359 1.00 71.14 N ATOM 1176 NH2 ARG A 74 -20.492 -23.202 7.401 1.00 22.25 N ATOM 0 H ARG A 74 -16.097 -28.703 6.312 1.00 33.33 H new ATOM 0 HA ARG A 74 -16.642 -27.043 8.588 1.00 31.32 H new ATOM 0 HB2 ARG A 74 -17.878 -29.546 7.398 1.00 60.22 H new ATOM 0 HB3 ARG A 74 -18.477 -28.835 8.883 1.00 60.22 H new ATOM 0 HG2 ARG A 74 -18.181 -27.064 6.473 1.00 64.34 H new ATOM 0 HG3 ARG A 74 -19.513 -28.202 6.514 1.00 64.34 H new ATOM 0 HD2 ARG A 74 -20.546 -27.160 8.317 1.00 3.42 H new ATOM 0 HD3 ARG A 74 -19.041 -26.541 8.968 1.00 3.42 H new ATOM 0 HE ARG A 74 -19.680 -25.330 6.400 1.00 1.23 H new ATOM 0 HH11 ARG A 74 -20.361 -25.272 9.865 1.00 71.14 H new ATOM 0 HH12 ARG A 74 -20.853 -23.575 9.856 1.00 71.14 H new ATOM 0 HH21 ARG A 74 -20.315 -23.151 6.398 1.00 22.25 H new ATOM 0 HH22 ARG A 74 -20.828 -22.379 7.902 1.00 22.25 H new ATOM 1190 N ARG A 75 -15.338 -30.029 9.016 1.00 5.11 N ATOM 1191 CA ARG A 75 -14.700 -30.905 9.992 1.00 51.40 C ATOM 1192 C ARG A 75 -13.443 -30.256 10.565 1.00 32.30 C ATOM 1193 O ARG A 75 -13.174 -30.351 11.763 1.00 22.32 O ATOM 1194 CB ARG A 75 -14.347 -32.247 9.350 1.00 63.42 C ATOM 1195 CG ARG A 75 -13.147 -32.180 8.419 1.00 73.33 C ATOM 1196 CD ARG A 75 -12.845 -33.536 7.800 1.00 34.55 C ATOM 1197 NE ARG A 75 -12.406 -34.508 8.799 1.00 40.51 N ATOM 1198 CZ ARG A 75 -12.353 -35.816 8.578 1.00 70.23 C ATOM 1199 NH1 ARG A 75 -12.710 -36.308 7.399 1.00 3.31 N ATOM 1200 NH2 ARG A 75 -11.942 -36.636 9.536 1.00 30.35 N ATOM 0 H ARG A 75 -15.280 -30.358 8.052 1.00 5.11 H new ATOM 0 HA ARG A 75 -15.404 -31.074 10.807 1.00 51.40 H new ATOM 0 HB2 ARG A 75 -14.146 -32.975 10.136 1.00 63.42 H new ATOM 0 HB3 ARG A 75 -15.209 -32.611 8.792 1.00 63.42 H new ATOM 0 HG2 ARG A 75 -13.338 -31.453 7.630 1.00 73.33 H new ATOM 0 HG3 ARG A 75 -12.276 -31.829 8.972 1.00 73.33 H new ATOM 0 HD2 ARG A 75 -13.736 -33.911 7.296 1.00 34.55 H new ATOM 0 HD3 ARG A 75 -12.072 -33.423 7.040 1.00 34.55 H new ATOM 0 HE ARG A 75 -12.125 -34.162 9.717 1.00 40.51 H new ATOM 0 HH11 ARG A 75 -13.026 -35.681 6.659 1.00 3.31 H new ATOM 0 HH12 ARG A 75 -12.668 -37.313 7.232 1.00 3.31 H new ATOM 0 HH21 ARG A 75 -11.666 -36.262 10.444 1.00 30.35 H new ATOM 0 HH22 ARG A 75 -11.902 -37.641 9.365 1.00 30.35 H new ATOM 1214 N LEU A 76 -12.677 -29.598 9.702 1.00 74.11 N ATOM 1215 CA LEU A 76 -11.448 -28.934 10.122 1.00 52.14 C ATOM 1216 C LEU A 76 -11.757 -27.662 10.905 1.00 44.35 C ATOM 1217 O LEU A 76 -11.033 -27.302 11.833 1.00 32.15 O ATOM 1218 CB LEU A 76 -10.584 -28.600 8.904 1.00 33.31 C ATOM 1219 CG LEU A 76 -10.826 -27.233 8.264 1.00 72.03 C ATOM 1220 CD1 LEU A 76 -10.052 -26.153 9.003 1.00 42.10 C ATOM 1221 CD2 LEU A 76 -10.439 -27.257 6.792 1.00 21.13 C ATOM 0 H LEU A 76 -12.885 -29.510 8.707 1.00 74.11 H new ATOM 0 HA LEU A 76 -10.900 -29.615 10.773 1.00 52.14 H new ATOM 0 HB2 LEU A 76 -9.536 -28.660 9.199 1.00 33.31 H new ATOM 0 HB3 LEU A 76 -10.747 -29.367 8.147 1.00 33.31 H new ATOM 0 HG LEU A 76 -11.889 -27.003 8.336 1.00 72.03 H new ATOM 0 HD11 LEU A 76 -10.237 -25.187 8.533 1.00 42.10 H new ATOM 0 HD12 LEU A 76 -10.377 -26.119 10.043 1.00 42.10 H new ATOM 0 HD13 LEU A 76 -8.986 -26.378 8.964 1.00 42.10 H new ATOM 0 HD21 LEU A 76 -10.618 -26.276 6.353 1.00 21.13 H new ATOM 0 HD22 LEU A 76 -9.383 -27.510 6.698 1.00 21.13 H new ATOM 0 HD23 LEU A 76 -11.039 -28.003 6.270 1.00 21.13 H new ATOM 1233 N ARG A 77 -12.836 -26.986 10.524 1.00 20.13 N ATOM 1234 CA ARG A 77 -13.241 -25.755 11.191 1.00 2.44 C ATOM 1235 C ARG A 77 -13.637 -26.026 12.640 1.00 53.23 C ATOM 1236 O ARG A 77 -13.265 -25.280 13.546 1.00 74.14 O ATOM 1237 CB ARG A 77 -14.408 -25.105 10.445 1.00 4.01 C ATOM 1238 CG ARG A 77 -14.785 -23.733 10.981 1.00 60.54 C ATOM 1239 CD ARG A 77 -15.951 -23.817 11.953 1.00 11.40 C ATOM 1240 NE ARG A 77 -16.006 -22.659 12.842 1.00 72.12 N ATOM 1241 CZ ARG A 77 -16.973 -22.460 13.731 1.00 73.35 C ATOM 1242 NH1 ARG A 77 -17.960 -23.338 13.848 1.00 14.44 N ATOM 1243 NH2 ARG A 77 -16.954 -21.382 14.504 1.00 61.30 N ATOM 0 H ARG A 77 -13.445 -27.270 9.757 1.00 20.13 H new ATOM 0 HA ARG A 77 -12.391 -25.073 11.186 1.00 2.44 H new ATOM 0 HB2 ARG A 77 -14.149 -25.015 9.390 1.00 4.01 H new ATOM 0 HB3 ARG A 77 -15.277 -25.761 10.505 1.00 4.01 H new ATOM 0 HG2 ARG A 77 -13.925 -23.287 11.480 1.00 60.54 H new ATOM 0 HG3 ARG A 77 -15.048 -23.076 10.151 1.00 60.54 H new ATOM 0 HD2 ARG A 77 -16.884 -23.890 11.394 1.00 11.40 H new ATOM 0 HD3 ARG A 77 -15.863 -24.727 12.547 1.00 11.40 H new ATOM 0 HE ARG A 77 -15.261 -21.965 12.777 1.00 72.12 H new ATOM 0 HH11 ARG A 77 -17.978 -24.168 13.255 1.00 14.44 H new ATOM 0 HH12 ARG A 77 -18.702 -23.184 14.531 1.00 14.44 H new ATOM 0 HH21 ARG A 77 -16.196 -20.705 14.416 1.00 61.30 H new ATOM 0 HH22 ARG A 77 -17.697 -21.230 15.186 1.00 61.30 H new ATOM 1257 N SER A 78 -14.395 -27.098 12.850 1.00 43.23 N ATOM 1258 CA SER A 78 -14.845 -27.465 14.187 1.00 74.21 C ATOM 1259 C SER A 78 -13.744 -28.195 14.950 1.00 11.10 C ATOM 1260 O SER A 78 -13.923 -28.579 16.106 1.00 2.11 O ATOM 1261 CB SER A 78 -16.093 -28.346 14.103 1.00 34.23 C ATOM 1262 OG SER A 78 -16.791 -28.360 15.337 1.00 73.25 O ATOM 0 H SER A 78 -14.710 -27.727 12.111 1.00 43.23 H new ATOM 0 HA SER A 78 -15.090 -26.549 14.725 1.00 74.21 H new ATOM 0 HB2 SER A 78 -16.749 -27.978 13.314 1.00 34.23 H new ATOM 0 HB3 SER A 78 -15.807 -29.362 13.832 1.00 34.23 H new ATOM 0 HG SER A 78 -16.217 -27.994 16.042 1.00 73.25 H new ATOM 1268 N LYS A 79 -12.604 -28.383 14.294 1.00 22.05 N ATOM 1269 CA LYS A 79 -11.471 -29.065 14.909 1.00 71.21 C ATOM 1270 C LYS A 79 -10.673 -28.110 15.791 1.00 54.45 C ATOM 1271 O LYS A 79 -10.041 -28.528 16.761 1.00 41.51 O ATOM 1272 CB LYS A 79 -10.562 -29.661 13.831 1.00 12.42 C ATOM 1273 CG LYS A 79 -10.511 -31.179 13.849 1.00 12.51 C ATOM 1274 CD LYS A 79 -9.773 -31.726 12.639 1.00 51.11 C ATOM 1275 CE LYS A 79 -9.805 -33.246 12.607 1.00 31.34 C ATOM 1276 NZ LYS A 79 -8.739 -33.805 11.731 1.00 23.41 N ATOM 0 H LYS A 79 -12.440 -28.073 13.336 1.00 22.05 H new ATOM 0 HA LYS A 79 -11.859 -29.869 15.534 1.00 71.21 H new ATOM 0 HB2 LYS A 79 -10.908 -29.329 12.852 1.00 12.42 H new ATOM 0 HB3 LYS A 79 -9.553 -29.270 13.962 1.00 12.42 H new ATOM 0 HG2 LYS A 79 -10.018 -31.517 14.760 1.00 12.51 H new ATOM 0 HG3 LYS A 79 -11.525 -31.578 13.869 1.00 12.51 H new ATOM 0 HD2 LYS A 79 -10.224 -31.332 11.728 1.00 51.11 H new ATOM 0 HD3 LYS A 79 -8.739 -31.383 12.657 1.00 51.11 H new ATOM 0 HE2 LYS A 79 -9.684 -33.633 13.619 1.00 31.34 H new ATOM 0 HE3 LYS A 79 -10.780 -33.581 12.252 1.00 31.34 H new ATOM 0 HZ1 LYS A 79 -8.795 -34.844 11.736 1.00 23.41 H new ATOM 0 HZ2 LYS A 79 -8.869 -33.456 10.760 1.00 23.41 H new ATOM 0 HZ3 LYS A 79 -7.807 -33.506 12.084 1.00 23.41 H new ATOM 1290 N ILE A 80 -10.709 -26.826 15.448 1.00 71.43 N ATOM 1291 CA ILE A 80 -9.991 -25.812 16.210 1.00 35.30 C ATOM 1292 C ILE A 80 -10.688 -24.459 16.117 1.00 34.11 C ATOM 1293 O ILE A 80 -10.824 -23.749 17.114 1.00 63.22 O ATOM 1294 CB ILE A 80 -8.539 -25.664 15.721 1.00 3.50 C ATOM 1295 CG1 ILE A 80 -7.847 -24.510 16.451 1.00 34.11 C ATOM 1296 CG2 ILE A 80 -8.506 -25.440 14.216 1.00 35.35 C ATOM 1297 CD1 ILE A 80 -7.837 -24.667 17.956 1.00 51.05 C ATOM 0 H ILE A 80 -11.228 -26.464 14.648 1.00 71.43 H new ATOM 0 HA ILE A 80 -9.984 -26.143 17.248 1.00 35.30 H new ATOM 0 HB ILE A 80 -8.001 -26.586 15.944 1.00 3.50 H new ATOM 0 HG12 ILE A 80 -6.820 -24.429 16.095 1.00 34.11 H new ATOM 0 HG13 ILE A 80 -8.347 -23.576 16.194 1.00 34.11 H new ATOM 0 HG21 ILE A 80 -7.472 -25.337 13.886 1.00 35.35 H new ATOM 0 HG22 ILE A 80 -8.965 -26.290 13.711 1.00 35.35 H new ATOM 0 HG23 ILE A 80 -9.057 -24.532 13.971 1.00 35.35 H new ATOM 0 HD11 ILE A 80 -7.331 -23.814 18.407 1.00 51.05 H new ATOM 0 HD12 ILE A 80 -8.862 -24.717 18.323 1.00 51.05 H new ATOM 0 HD13 ILE A 80 -7.311 -25.584 18.223 1.00 51.05 H new ATOM 1309 N ASP A 81 -11.130 -24.109 14.914 1.00 34.13 N ATOM 1310 CA ASP A 81 -11.817 -22.842 14.691 1.00 43.12 C ATOM 1311 C ASP A 81 -13.145 -22.804 15.441 1.00 43.44 C ATOM 1312 O ASP A 81 -13.750 -21.743 15.597 1.00 75.24 O ATOM 1313 CB ASP A 81 -12.054 -22.623 13.196 1.00 54.21 C ATOM 1314 CG ASP A 81 -11.035 -21.685 12.579 1.00 14.11 C ATOM 1315 OD1 ASP A 81 -10.608 -20.735 13.269 1.00 32.52 O ATOM 1316 OD2 ASP A 81 -10.664 -21.901 11.407 1.00 55.34 O ATOM 0 H ASP A 81 -11.025 -24.685 14.079 1.00 34.13 H new ATOM 0 HA ASP A 81 -11.183 -22.041 15.072 1.00 43.12 H new ATOM 0 HB2 ASP A 81 -12.018 -23.583 12.681 1.00 54.21 H new ATOM 0 HB3 ASP A 81 -13.055 -22.218 13.045 1.00 54.21 H new ATOM 1321 N ASP A 82 -13.592 -23.967 15.901 1.00 3.44 N ATOM 1322 CA ASP A 82 -14.848 -24.066 16.635 1.00 72.41 C ATOM 1323 C ASP A 82 -14.908 -23.031 17.754 1.00 62.40 C ATOM 1324 O ASP A 82 -15.970 -22.484 18.050 1.00 3.44 O ATOM 1325 CB ASP A 82 -15.015 -25.472 17.214 1.00 70.10 C ATOM 1326 CG ASP A 82 -16.470 -25.887 17.316 1.00 25.24 C ATOM 1327 OD1 ASP A 82 -17.347 -25.049 17.024 1.00 53.15 O ATOM 1328 OD2 ASP A 82 -16.730 -27.050 17.690 1.00 32.23 O ATOM 0 H ASP A 82 -13.104 -24.854 15.779 1.00 3.44 H new ATOM 0 HA ASP A 82 -15.663 -23.868 15.939 1.00 72.41 H new ATOM 0 HB2 ASP A 82 -14.480 -26.186 16.588 1.00 70.10 H new ATOM 0 HB3 ASP A 82 -14.559 -25.511 18.203 1.00 70.10 H new ATOM 1333 N ASP A 83 -13.762 -22.770 18.372 1.00 4.33 N ATOM 1334 CA ASP A 83 -13.683 -21.800 19.459 1.00 31.51 C ATOM 1335 C ASP A 83 -12.676 -20.701 19.135 1.00 20.33 C ATOM 1336 O ASP A 83 -12.817 -19.564 19.584 1.00 14.50 O ATOM 1337 CB ASP A 83 -13.295 -22.496 20.765 1.00 60.44 C ATOM 1338 CG ASP A 83 -13.873 -21.805 21.983 1.00 13.15 C ATOM 1339 OD1 ASP A 83 -15.116 -21.735 22.093 1.00 24.41 O ATOM 1340 OD2 ASP A 83 -13.084 -21.334 22.828 1.00 4.22 O ATOM 0 H ASP A 83 -12.875 -23.216 18.139 1.00 4.33 H new ATOM 0 HA ASP A 83 -14.666 -21.344 19.578 1.00 31.51 H new ATOM 0 HB2 ASP A 83 -13.641 -23.529 20.739 1.00 60.44 H new ATOM 0 HB3 ASP A 83 -12.209 -22.525 20.849 1.00 60.44 H new ATOM 1345 N PHE A 84 -11.659 -21.049 18.354 1.00 23.33 N ATOM 1346 CA PHE A 84 -10.626 -20.093 17.972 1.00 13.00 C ATOM 1347 C PHE A 84 -11.244 -18.849 17.341 1.00 54.13 C ATOM 1348 O PHE A 84 -11.324 -17.795 17.971 1.00 32.32 O ATOM 1349 CB PHE A 84 -9.640 -20.738 16.996 1.00 52.22 C ATOM 1350 CG PHE A 84 -8.301 -21.038 17.607 1.00 74.01 C ATOM 1351 CD1 PHE A 84 -8.212 -21.616 18.863 1.00 74.10 C ATOM 1352 CD2 PHE A 84 -7.132 -20.742 16.925 1.00 0.35 C ATOM 1353 CE1 PHE A 84 -6.982 -21.894 19.428 1.00 20.01 C ATOM 1354 CE2 PHE A 84 -5.899 -21.018 17.485 1.00 1.33 C ATOM 1355 CZ PHE A 84 -5.824 -21.593 18.739 1.00 63.44 C ATOM 0 H PHE A 84 -11.528 -21.986 17.973 1.00 23.33 H new ATOM 0 HA PHE A 84 -10.091 -19.794 18.873 1.00 13.00 H new ATOM 0 HB2 PHE A 84 -10.072 -21.663 16.614 1.00 52.22 H new ATOM 0 HB3 PHE A 84 -9.500 -20.075 16.142 1.00 52.22 H new ATOM 0 HD1 PHE A 84 -9.115 -21.852 19.407 1.00 74.10 H new ATOM 0 HD2 PHE A 84 -7.185 -20.291 15.945 1.00 0.35 H new ATOM 0 HE1 PHE A 84 -6.927 -22.346 20.407 1.00 20.01 H new ATOM 0 HE2 PHE A 84 -4.995 -20.784 16.943 1.00 1.33 H new ATOM 0 HZ PHE A 84 -4.861 -21.807 19.180 1.00 63.44 H new ATOM 1365 N GLU A 85 -11.679 -18.980 16.091 1.00 35.44 N ATOM 1366 CA GLU A 85 -12.289 -17.867 15.374 1.00 1.42 C ATOM 1367 C GLU A 85 -13.773 -18.125 15.128 1.00 44.21 C ATOM 1368 O GLU A 85 -14.248 -19.259 15.179 1.00 31.35 O ATOM 1369 CB GLU A 85 -11.572 -17.635 14.042 1.00 32.43 C ATOM 1370 CG GLU A 85 -10.578 -16.487 14.077 1.00 23.25 C ATOM 1371 CD GLU A 85 -10.551 -15.698 12.783 1.00 74.33 C ATOM 1372 OE1 GLU A 85 -10.717 -16.314 11.709 1.00 50.41 O ATOM 1373 OE2 GLU A 85 -10.365 -14.465 12.844 1.00 12.21 O ATOM 0 H GLU A 85 -11.620 -19.846 15.555 1.00 35.44 H new ATOM 0 HA GLU A 85 -12.191 -16.974 15.991 1.00 1.42 H new ATOM 0 HB2 GLU A 85 -11.050 -18.548 13.757 1.00 32.43 H new ATOM 0 HB3 GLU A 85 -12.315 -17.438 13.269 1.00 32.43 H new ATOM 0 HG2 GLU A 85 -10.830 -15.819 14.900 1.00 23.25 H new ATOM 0 HG3 GLU A 85 -9.582 -16.880 14.279 1.00 23.25 H new ATOM 1380 N PRO A 86 -14.523 -17.047 14.854 1.00 22.20 N ATOM 1381 CA PRO A 86 -15.963 -17.130 14.594 1.00 31.53 C ATOM 1382 C PRO A 86 -16.274 -17.807 13.263 1.00 1.43 C ATOM 1383 O PRO A 86 -15.369 -18.230 12.544 1.00 51.13 O ATOM 1384 CB PRO A 86 -16.404 -15.665 14.565 1.00 3.23 C ATOM 1385 CG PRO A 86 -15.179 -14.909 14.182 1.00 3.51 C ATOM 1386 CD PRO A 86 -14.023 -15.664 14.776 1.00 25.43 C ATOM 0 HA PRO A 86 -16.478 -17.729 15.345 1.00 31.53 H new ATOM 0 HB2 PRO A 86 -17.208 -15.508 13.846 1.00 3.23 H new ATOM 0 HB3 PRO A 86 -16.779 -15.345 15.537 1.00 3.23 H new ATOM 0 HG2 PRO A 86 -15.085 -14.842 13.098 1.00 3.51 H new ATOM 0 HG3 PRO A 86 -15.215 -13.888 14.563 1.00 3.51 H new ATOM 0 HD2 PRO A 86 -13.133 -15.593 14.151 1.00 25.43 H new ATOM 0 HD3 PRO A 86 -13.754 -15.278 15.759 1.00 25.43 H new ATOM 1394 N LYS A 87 -17.559 -17.905 12.941 1.00 52.32 N ATOM 1395 CA LYS A 87 -17.991 -18.528 11.695 1.00 5.32 C ATOM 1396 C LYS A 87 -17.556 -17.697 10.492 1.00 11.32 C ATOM 1397 O LYS A 87 -18.284 -16.811 10.041 1.00 61.32 O ATOM 1398 CB LYS A 87 -19.511 -18.700 11.687 1.00 71.10 C ATOM 1399 CG LYS A 87 -20.269 -17.434 12.048 1.00 63.03 C ATOM 1400 CD LYS A 87 -21.435 -17.194 11.103 1.00 4.33 C ATOM 1401 CE LYS A 87 -22.708 -17.852 11.612 1.00 53.53 C ATOM 1402 NZ LYS A 87 -22.776 -19.291 11.238 1.00 72.41 N ATOM 0 H LYS A 87 -18.320 -17.561 13.526 1.00 52.32 H new ATOM 0 HA LYS A 87 -17.521 -19.509 11.626 1.00 5.32 H new ATOM 0 HB2 LYS A 87 -19.825 -19.032 10.697 1.00 71.10 H new ATOM 0 HB3 LYS A 87 -19.783 -19.489 12.389 1.00 71.10 H new ATOM 0 HG2 LYS A 87 -20.638 -17.509 13.071 1.00 63.03 H new ATOM 0 HG3 LYS A 87 -19.591 -16.581 12.015 1.00 63.03 H new ATOM 0 HD2 LYS A 87 -21.598 -16.122 10.989 1.00 4.33 H new ATOM 0 HD3 LYS A 87 -21.191 -17.586 10.115 1.00 4.33 H new ATOM 0 HE2 LYS A 87 -22.758 -17.756 12.697 1.00 53.53 H new ATOM 0 HE3 LYS A 87 -23.574 -17.330 11.206 1.00 53.53 H new ATOM 0 HZ1 LYS A 87 -23.666 -19.699 11.589 1.00 72.41 H new ATOM 0 HZ2 LYS A 87 -22.737 -19.383 10.203 1.00 72.41 H new ATOM 0 HZ3 LYS A 87 -21.972 -19.798 11.661 1.00 72.41 H new ATOM 1416 N LEU A 88 -16.367 -17.988 9.976 1.00 11.22 N ATOM 1417 CA LEU A 88 -15.836 -17.268 8.824 1.00 72.14 C ATOM 1418 C LEU A 88 -16.179 -17.991 7.525 1.00 13.00 C ATOM 1419 O LEU A 88 -15.861 -17.514 6.435 1.00 33.12 O ATOM 1420 CB LEU A 88 -14.320 -17.113 8.949 1.00 44.21 C ATOM 1421 CG LEU A 88 -13.832 -15.885 9.719 1.00 40.12 C ATOM 1422 CD1 LEU A 88 -13.846 -16.153 11.216 1.00 71.23 C ATOM 1423 CD2 LEU A 88 -12.437 -15.487 9.260 1.00 42.14 C ATOM 0 H LEU A 88 -15.752 -18.718 10.337 1.00 11.22 H new ATOM 0 HA LEU A 88 -16.295 -16.280 8.801 1.00 72.14 H new ATOM 0 HB2 LEU A 88 -13.923 -18.004 9.436 1.00 44.21 H new ATOM 0 HB3 LEU A 88 -13.894 -17.081 7.946 1.00 44.21 H new ATOM 0 HG LEU A 88 -14.511 -15.057 9.512 1.00 40.12 H new ATOM 0 HD11 LEU A 88 -13.496 -15.268 11.747 1.00 71.23 H new ATOM 0 HD12 LEU A 88 -14.862 -16.389 11.534 1.00 71.23 H new ATOM 0 HD13 LEU A 88 -13.191 -16.994 11.441 1.00 71.23 H new ATOM 0 HD21 LEU A 88 -12.106 -14.612 9.819 1.00 42.14 H new ATOM 0 HD22 LEU A 88 -11.747 -16.312 9.436 1.00 42.14 H new ATOM 0 HD23 LEU A 88 -12.457 -15.252 8.196 1.00 42.14 H new ATOM 1435 N ILE A 89 -16.831 -19.142 7.649 1.00 32.11 N ATOM 1436 CA ILE A 89 -17.220 -19.928 6.485 1.00 33.42 C ATOM 1437 C ILE A 89 -18.537 -19.429 5.900 1.00 62.24 C ATOM 1438 O ILE A 89 -19.559 -19.391 6.586 1.00 41.55 O ATOM 1439 CB ILE A 89 -17.361 -21.421 6.836 1.00 63.52 C ATOM 1440 CG1 ILE A 89 -16.039 -21.966 7.381 1.00 31.15 C ATOM 1441 CG2 ILE A 89 -17.802 -22.213 5.614 1.00 70.21 C ATOM 1442 CD1 ILE A 89 -16.104 -23.425 7.777 1.00 40.30 C ATOM 0 H ILE A 89 -17.101 -19.551 8.544 1.00 32.11 H new ATOM 0 HA ILE A 89 -16.428 -19.810 5.745 1.00 33.42 H new ATOM 0 HB ILE A 89 -18.123 -21.527 7.608 1.00 63.52 H new ATOM 0 HG12 ILE A 89 -15.263 -21.837 6.626 1.00 31.15 H new ATOM 0 HG13 ILE A 89 -15.742 -21.376 8.248 1.00 31.15 H new ATOM 0 HG21 ILE A 89 -17.897 -23.266 5.878 1.00 70.21 H new ATOM 0 HG22 ILE A 89 -18.764 -21.838 5.265 1.00 70.21 H new ATOM 0 HG23 ILE A 89 -17.061 -22.103 4.822 1.00 70.21 H new ATOM 0 HD11 ILE A 89 -15.132 -23.743 8.154 1.00 40.30 H new ATOM 0 HD12 ILE A 89 -16.856 -23.558 8.555 1.00 40.30 H new ATOM 0 HD13 ILE A 89 -16.371 -24.026 6.908 1.00 40.30 H new ATOM 1454 N HIS A 90 -18.506 -19.049 4.626 1.00 25.22 N ATOM 1455 CA HIS A 90 -19.698 -18.554 3.946 1.00 25.45 C ATOM 1456 C HIS A 90 -19.789 -19.118 2.532 1.00 54.14 C ATOM 1457 O HIS A 90 -18.789 -19.203 1.819 1.00 44.20 O ATOM 1458 CB HIS A 90 -19.686 -17.026 3.900 1.00 73.24 C ATOM 1459 CG HIS A 90 -20.211 -16.385 5.147 1.00 3.13 C ATOM 1460 ND1 HIS A 90 -21.352 -16.814 5.791 1.00 10.35 N ATOM 1461 CD2 HIS A 90 -19.742 -15.341 5.871 1.00 62.33 C ATOM 1462 CE1 HIS A 90 -21.563 -16.060 6.856 1.00 75.50 C ATOM 1463 NE2 HIS A 90 -20.600 -15.160 6.927 1.00 12.40 N ATOM 0 H HIS A 90 -17.669 -19.074 4.044 1.00 25.22 H new ATOM 0 HA HIS A 90 -20.572 -18.886 4.507 1.00 25.45 H new ATOM 0 HB2 HIS A 90 -18.666 -16.684 3.728 1.00 73.24 H new ATOM 0 HB3 HIS A 90 -20.282 -16.692 3.051 1.00 73.24 H new ATOM 0 HD2 HIS A 90 -18.858 -14.759 5.657 1.00 62.33 H new ATOM 0 HE1 HIS A 90 -22.384 -16.163 7.550 1.00 75.50 H new ATOM 0 HE2 HIS A 90 -20.508 -14.446 7.649 1.00 12.40 H new ATOM 1471 N THR A 91 -20.997 -19.503 2.130 1.00 20.13 N ATOM 1472 CA THR A 91 -21.219 -20.060 0.802 1.00 33.21 C ATOM 1473 C THR A 91 -22.339 -19.322 0.077 1.00 63.33 C ATOM 1474 O THR A 91 -23.367 -18.995 0.670 1.00 64.11 O ATOM 1475 CB THR A 91 -21.569 -21.559 0.873 1.00 53.42 C ATOM 1476 OG1 THR A 91 -20.464 -22.295 1.408 1.00 32.14 O ATOM 1477 CG2 THR A 91 -21.924 -22.097 -0.505 1.00 60.11 C ATOM 0 H THR A 91 -21.836 -19.439 2.706 1.00 20.13 H new ATOM 0 HA THR A 91 -20.288 -19.938 0.248 1.00 33.21 H new ATOM 0 HB THR A 91 -22.434 -21.678 1.526 1.00 53.42 H new ATOM 0 HG1 THR A 91 -20.541 -23.236 1.147 1.00 32.14 H new ATOM 0 HG21 THR A 91 -22.167 -23.157 -0.430 1.00 60.11 H new ATOM 0 HG22 THR A 91 -22.784 -21.554 -0.897 1.00 60.11 H new ATOM 0 HG23 THR A 91 -21.075 -21.966 -1.176 1.00 60.11 H new ATOM 1485 N VAL A 92 -22.133 -19.063 -1.211 1.00 32.22 N ATOM 1486 CA VAL A 92 -23.127 -18.365 -2.018 1.00 65.12 C ATOM 1487 C VAL A 92 -23.918 -19.341 -2.881 1.00 34.44 C ATOM 1488 O VAL A 92 -23.351 -20.057 -3.706 1.00 73.04 O ATOM 1489 CB VAL A 92 -22.469 -17.310 -2.928 1.00 15.02 C ATOM 1490 CG1 VAL A 92 -23.522 -16.589 -3.756 1.00 0.43 C ATOM 1491 CG2 VAL A 92 -21.661 -16.322 -2.100 1.00 34.22 C ATOM 0 H VAL A 92 -21.287 -19.326 -1.717 1.00 32.22 H new ATOM 0 HA VAL A 92 -23.804 -17.866 -1.325 1.00 65.12 H new ATOM 0 HB VAL A 92 -21.788 -17.818 -3.611 1.00 15.02 H new ATOM 0 HG11 VAL A 92 -23.039 -15.848 -4.393 1.00 0.43 H new ATOM 0 HG12 VAL A 92 -24.053 -17.310 -4.377 1.00 0.43 H new ATOM 0 HG13 VAL A 92 -24.229 -16.092 -3.092 1.00 0.43 H new ATOM 0 HG21 VAL A 92 -21.203 -15.584 -2.759 1.00 34.22 H new ATOM 0 HG22 VAL A 92 -22.318 -15.818 -1.392 1.00 34.22 H new ATOM 0 HG23 VAL A 92 -20.882 -16.855 -1.556 1.00 34.22 H new ATOM 1501 N ARG A 93 -25.232 -19.365 -2.684 1.00 35.04 N ATOM 1502 CA ARG A 93 -26.103 -20.254 -3.443 1.00 71.30 C ATOM 1503 C ARG A 93 -25.963 -20.003 -4.942 1.00 13.35 C ATOM 1504 O ARG A 93 -26.548 -19.064 -5.481 1.00 22.11 O ATOM 1505 CB ARG A 93 -27.560 -20.063 -3.017 1.00 22.34 C ATOM 1506 CG ARG A 93 -28.508 -21.092 -3.610 1.00 20.40 C ATOM 1507 CD ARG A 93 -28.404 -22.427 -2.888 1.00 51.05 C ATOM 1508 NE ARG A 93 -29.128 -22.421 -1.620 1.00 60.21 N ATOM 1509 CZ ARG A 93 -29.058 -23.405 -0.730 1.00 15.42 C ATOM 1510 NH1 ARG A 93 -28.301 -24.467 -0.968 1.00 13.31 N ATOM 1511 NH2 ARG A 93 -29.747 -23.327 0.402 1.00 41.41 N ATOM 0 H ARG A 93 -25.717 -18.779 -2.005 1.00 35.04 H new ATOM 0 HA ARG A 93 -25.803 -21.281 -3.234 1.00 71.30 H new ATOM 0 HB2 ARG A 93 -27.621 -20.110 -1.930 1.00 22.34 H new ATOM 0 HB3 ARG A 93 -27.888 -19.066 -3.312 1.00 22.34 H new ATOM 0 HG2 ARG A 93 -29.532 -20.723 -3.549 1.00 20.40 H new ATOM 0 HG3 ARG A 93 -28.282 -21.230 -4.667 1.00 20.40 H new ATOM 0 HD2 ARG A 93 -28.799 -23.217 -3.527 1.00 51.05 H new ATOM 0 HD3 ARG A 93 -27.355 -22.660 -2.705 1.00 51.05 H new ATOM 0 HE ARG A 93 -29.719 -21.618 -1.406 1.00 60.21 H new ATOM 0 HH11 ARG A 93 -27.770 -24.530 -1.837 1.00 13.31 H new ATOM 0 HH12 ARG A 93 -28.250 -25.221 -0.283 1.00 13.31 H new ATOM 0 HH21 ARG A 93 -30.330 -22.511 0.589 1.00 41.41 H new ATOM 0 HH22 ARG A 93 -29.693 -24.083 1.085 1.00 41.41 H new ATOM 1525 N GLY A 94 -25.184 -20.849 -5.608 1.00 44.54 N ATOM 1526 CA GLY A 94 -24.981 -20.700 -7.038 1.00 25.53 C ATOM 1527 C GLY A 94 -23.583 -20.222 -7.378 1.00 52.33 C ATOM 1528 O GLY A 94 -23.386 -19.511 -8.364 1.00 32.34 O ATOM 0 H GLY A 94 -24.690 -21.634 -5.184 1.00 44.54 H new ATOM 0 HA2 GLY A 94 -25.165 -21.655 -7.529 1.00 25.53 H new ATOM 0 HA3 GLY A 94 -25.710 -19.993 -7.434 1.00 25.53 H new ATOM 1532 N ALA A 95 -22.611 -20.610 -6.560 1.00 65.22 N ATOM 1533 CA ALA A 95 -21.224 -20.216 -6.780 1.00 75.31 C ATOM 1534 C ALA A 95 -20.266 -21.333 -6.381 1.00 33.42 C ATOM 1535 O ALA A 95 -19.696 -22.010 -7.235 1.00 63.03 O ATOM 1536 CB ALA A 95 -20.908 -18.945 -6.006 1.00 61.13 C ATOM 0 H ALA A 95 -22.758 -21.197 -5.739 1.00 65.22 H new ATOM 0 HA ALA A 95 -21.091 -20.023 -7.844 1.00 75.31 H new ATOM 0 HB1 ALA A 95 -19.870 -18.662 -6.179 1.00 61.13 H new ATOM 0 HB2 ALA A 95 -21.564 -18.142 -6.342 1.00 61.13 H new ATOM 0 HB3 ALA A 95 -21.064 -19.119 -4.941 1.00 61.13 H new ATOM 1542 N GLY A 96 -20.094 -21.521 -5.076 1.00 3.32 N ATOM 1543 CA GLY A 96 -19.203 -22.557 -4.586 1.00 41.45 C ATOM 1544 C GLY A 96 -18.923 -22.427 -3.102 1.00 62.04 C ATOM 1545 O GLY A 96 -19.748 -22.809 -2.272 1.00 41.32 O ATOM 0 H GLY A 96 -20.556 -20.974 -4.349 1.00 3.32 H new ATOM 0 HA2 GLY A 96 -19.643 -23.534 -4.785 1.00 41.45 H new ATOM 0 HA3 GLY A 96 -18.263 -22.513 -5.135 1.00 41.45 H new ATOM 1549 N TYR A 97 -17.756 -21.889 -2.767 1.00 45.23 N ATOM 1550 CA TYR A 97 -17.367 -21.714 -1.373 1.00 2.11 C ATOM 1551 C TYR A 97 -16.381 -20.559 -1.223 1.00 15.21 C ATOM 1552 O TYR A 97 -15.488 -20.378 -2.050 1.00 62.11 O ATOM 1553 CB TYR A 97 -16.747 -23.002 -0.829 1.00 45.10 C ATOM 1554 CG TYR A 97 -17.687 -23.808 0.038 1.00 52.11 C ATOM 1555 CD1 TYR A 97 -18.529 -24.763 -0.518 1.00 33.13 C ATOM 1556 CD2 TYR A 97 -17.733 -23.615 1.413 1.00 11.32 C ATOM 1557 CE1 TYR A 97 -19.391 -25.501 0.271 1.00 62.14 C ATOM 1558 CE2 TYR A 97 -18.590 -24.349 2.209 1.00 34.25 C ATOM 1559 CZ TYR A 97 -19.418 -25.291 1.633 1.00 5.25 C ATOM 1560 OH TYR A 97 -20.273 -26.025 2.422 1.00 13.14 O ATOM 0 H TYR A 97 -17.063 -21.566 -3.442 1.00 45.23 H new ATOM 0 HA TYR A 97 -18.264 -21.479 -0.799 1.00 2.11 H new ATOM 0 HB2 TYR A 97 -16.419 -23.619 -1.666 1.00 45.10 H new ATOM 0 HB3 TYR A 97 -15.858 -22.751 -0.250 1.00 45.10 H new ATOM 0 HD1 TYR A 97 -18.510 -24.932 -1.585 1.00 33.13 H new ATOM 0 HD2 TYR A 97 -17.087 -22.878 1.867 1.00 11.32 H new ATOM 0 HE1 TYR A 97 -20.040 -26.239 -0.177 1.00 62.14 H new ATOM 0 HE2 TYR A 97 -18.612 -24.187 3.277 1.00 34.25 H new ATOM 0 HH TYR A 97 -19.758 -26.509 3.100 1.00 13.14 H new ATOM 1570 N VAL A 98 -16.551 -19.779 -0.160 1.00 13.02 N ATOM 1571 CA VAL A 98 -15.677 -18.642 0.102 1.00 50.13 C ATOM 1572 C VAL A 98 -15.481 -18.432 1.599 1.00 63.51 C ATOM 1573 O VAL A 98 -16.299 -18.867 2.410 1.00 20.44 O ATOM 1574 CB VAL A 98 -16.239 -17.348 -0.517 1.00 63.12 C ATOM 1575 CG1 VAL A 98 -17.473 -16.885 0.241 1.00 33.43 C ATOM 1576 CG2 VAL A 98 -15.175 -16.261 -0.535 1.00 1.24 C ATOM 0 H VAL A 98 -17.286 -19.914 0.534 1.00 13.02 H new ATOM 0 HA VAL A 98 -14.716 -18.869 -0.359 1.00 50.13 H new ATOM 0 HB VAL A 98 -16.532 -17.556 -1.546 1.00 63.12 H new ATOM 0 HG11 VAL A 98 -17.856 -15.970 -0.211 1.00 33.43 H new ATOM 0 HG12 VAL A 98 -18.239 -17.659 0.197 1.00 33.43 H new ATOM 0 HG13 VAL A 98 -17.210 -16.694 1.281 1.00 33.43 H new ATOM 0 HG21 VAL A 98 -15.589 -15.354 -0.975 1.00 1.24 H new ATOM 0 HG22 VAL A 98 -14.850 -16.054 0.484 1.00 1.24 H new ATOM 0 HG23 VAL A 98 -14.323 -16.596 -1.127 1.00 1.24 H new ATOM 1586 N LEU A 99 -14.391 -17.763 1.959 1.00 31.31 N ATOM 1587 CA LEU A 99 -14.086 -17.495 3.360 1.00 14.23 C ATOM 1588 C LEU A 99 -14.086 -15.995 3.640 1.00 71.32 C ATOM 1589 O LEU A 99 -13.502 -15.215 2.889 1.00 24.01 O ATOM 1590 CB LEU A 99 -12.729 -18.095 3.732 1.00 51.45 C ATOM 1591 CG LEU A 99 -11.504 -17.243 3.395 1.00 74.31 C ATOM 1592 CD1 LEU A 99 -10.248 -17.855 3.995 1.00 61.15 C ATOM 1593 CD2 LEU A 99 -11.359 -17.091 1.888 1.00 43.22 C ATOM 0 H LEU A 99 -13.704 -17.396 1.300 1.00 31.31 H new ATOM 0 HA LEU A 99 -14.861 -17.960 3.970 1.00 14.23 H new ATOM 0 HB2 LEU A 99 -12.724 -18.295 4.803 1.00 51.45 H new ATOM 0 HB3 LEU A 99 -12.628 -19.056 3.228 1.00 51.45 H new ATOM 0 HG LEU A 99 -11.643 -16.252 3.828 1.00 74.31 H new ATOM 0 HD11 LEU A 99 -9.386 -17.236 3.745 1.00 61.15 H new ATOM 0 HD12 LEU A 99 -10.353 -17.911 5.079 1.00 61.15 H new ATOM 0 HD13 LEU A 99 -10.103 -18.857 3.592 1.00 61.15 H new ATOM 0 HD21 LEU A 99 -10.483 -16.482 1.666 1.00 43.22 H new ATOM 0 HD22 LEU A 99 -11.242 -18.074 1.433 1.00 43.22 H new ATOM 0 HD23 LEU A 99 -12.248 -16.607 1.484 1.00 43.22 H new ATOM 1605 N GLU A 100 -14.744 -15.601 4.726 1.00 43.33 N ATOM 1606 CA GLU A 100 -14.817 -14.194 5.104 1.00 34.53 C ATOM 1607 C GLU A 100 -15.515 -14.030 6.451 1.00 15.43 C ATOM 1608 O GLU A 100 -16.169 -14.952 6.940 1.00 1.43 O ATOM 1609 CB GLU A 100 -15.558 -13.393 4.032 1.00 12.21 C ATOM 1610 CG GLU A 100 -15.264 -11.903 4.074 1.00 3.31 C ATOM 1611 CD GLU A 100 -13.778 -11.601 4.061 1.00 23.23 C ATOM 1612 OE1 GLU A 100 -13.071 -12.133 3.180 1.00 53.14 O ATOM 1613 OE2 GLU A 100 -13.321 -10.833 4.934 1.00 54.44 O ATOM 0 H GLU A 100 -15.233 -16.235 5.358 1.00 43.33 H new ATOM 0 HA GLU A 100 -13.799 -13.814 5.192 1.00 34.53 H new ATOM 0 HB2 GLU A 100 -15.288 -13.780 3.050 1.00 12.21 H new ATOM 0 HB3 GLU A 100 -16.630 -13.547 4.152 1.00 12.21 H new ATOM 0 HG2 GLU A 100 -15.737 -11.419 3.219 1.00 3.31 H new ATOM 0 HG3 GLU A 100 -15.710 -11.474 4.971 1.00 3.31 H new ATOM 1620 N ILE A 101 -15.371 -12.850 7.045 1.00 14.30 N ATOM 1621 CA ILE A 101 -15.988 -12.564 8.334 1.00 10.44 C ATOM 1622 C ILE A 101 -17.298 -11.802 8.161 1.00 63.13 C ATOM 1623 O ILE A 101 -17.474 -11.063 7.192 1.00 60.10 O ATOM 1624 CB ILE A 101 -15.048 -11.745 9.239 1.00 23.50 C ATOM 1625 CG1 ILE A 101 -14.664 -10.431 8.556 1.00 22.04 C ATOM 1626 CG2 ILE A 101 -13.805 -12.554 9.580 1.00 21.02 C ATOM 1627 CD1 ILE A 101 -14.373 -9.308 9.527 1.00 22.35 C ATOM 0 H ILE A 101 -14.833 -12.077 6.654 1.00 14.30 H new ATOM 0 HA ILE A 101 -16.189 -13.525 8.807 1.00 10.44 H new ATOM 0 HB ILE A 101 -15.572 -11.511 10.166 1.00 23.50 H new ATOM 0 HG12 ILE A 101 -13.786 -10.598 7.932 1.00 22.04 H new ATOM 0 HG13 ILE A 101 -15.473 -10.126 7.892 1.00 22.04 H new ATOM 0 HG21 ILE A 101 -13.150 -11.963 10.220 1.00 21.02 H new ATOM 0 HG22 ILE A 101 -14.096 -13.465 10.102 1.00 21.02 H new ATOM 0 HG23 ILE A 101 -13.277 -12.814 8.662 1.00 21.02 H new ATOM 0 HD11 ILE A 101 -14.108 -8.408 8.973 1.00 22.35 H new ATOM 0 HD12 ILE A 101 -15.257 -9.113 10.134 1.00 22.35 H new ATOM 0 HD13 ILE A 101 -13.544 -9.593 10.175 1.00 22.35 H new ATOM 1639 N ARG A 102 -18.213 -11.986 9.107 1.00 61.45 N ATOM 1640 CA ARG A 102 -19.507 -11.316 9.059 1.00 62.24 C ATOM 1641 C ARG A 102 -19.402 -9.892 9.597 1.00 62.24 C ATOM 1642 O ARG A 102 -20.189 -9.021 9.229 1.00 2.41 O ATOM 1643 CB ARG A 102 -20.542 -12.102 9.865 1.00 74.33 C ATOM 1644 CG ARG A 102 -20.177 -12.265 11.331 1.00 13.31 C ATOM 1645 CD ARG A 102 -20.893 -11.242 12.200 1.00 62.21 C ATOM 1646 NE ARG A 102 -22.162 -11.752 12.713 1.00 4.10 N ATOM 1647 CZ ARG A 102 -22.951 -11.067 13.533 1.00 70.10 C ATOM 1648 NH1 ARG A 102 -22.604 -9.851 13.930 1.00 12.34 N ATOM 1649 NH2 ARG A 102 -24.091 -11.599 13.957 1.00 45.12 N ATOM 0 H ARG A 102 -18.082 -12.593 9.916 1.00 61.45 H new ATOM 0 HA ARG A 102 -19.826 -11.270 8.018 1.00 62.24 H new ATOM 0 HB2 ARG A 102 -21.505 -11.597 9.793 1.00 74.33 H new ATOM 0 HB3 ARG A 102 -20.665 -13.089 9.418 1.00 74.33 H new ATOM 0 HG2 ARG A 102 -20.436 -13.271 11.662 1.00 13.31 H new ATOM 0 HG3 ARG A 102 -19.099 -12.157 11.453 1.00 13.31 H new ATOM 0 HD2 ARG A 102 -20.251 -10.963 13.035 1.00 62.21 H new ATOM 0 HD3 ARG A 102 -21.074 -10.337 11.620 1.00 62.21 H new ATOM 0 HE ARG A 102 -22.458 -12.685 12.426 1.00 4.10 H new ATOM 0 HH11 ARG A 102 -21.729 -9.439 13.606 1.00 12.34 H new ATOM 0 HH12 ARG A 102 -23.212 -9.327 14.560 1.00 12.34 H new ATOM 0 HH21 ARG A 102 -24.361 -12.534 13.653 1.00 45.12 H new ATOM 0 HH22 ARG A 102 -24.696 -11.072 14.587 1.00 45.12 H new ATOM 1663 N GLU A 103 -18.425 -9.665 10.469 1.00 22.21 N ATOM 1664 CA GLU A 103 -18.219 -8.347 11.058 1.00 23.43 C ATOM 1665 C GLU A 103 -18.016 -7.293 9.974 1.00 5.44 C ATOM 1666 O GLU A 103 -18.428 -6.143 10.128 1.00 64.40 O ATOM 1667 CB GLU A 103 -17.011 -8.368 11.998 1.00 15.42 C ATOM 1668 CG GLU A 103 -16.755 -7.038 12.688 1.00 22.41 C ATOM 1669 CD GLU A 103 -15.725 -7.145 13.796 1.00 65.25 C ATOM 1670 OE1 GLU A 103 -14.540 -7.389 13.483 1.00 13.45 O ATOM 1671 OE2 GLU A 103 -16.103 -6.985 14.975 1.00 53.22 O ATOM 0 H GLU A 103 -17.764 -10.376 10.783 1.00 22.21 H new ATOM 0 HA GLU A 103 -19.111 -8.088 11.629 1.00 23.43 H new ATOM 0 HB2 GLU A 103 -17.163 -9.137 12.755 1.00 15.42 H new ATOM 0 HB3 GLU A 103 -16.124 -8.650 11.431 1.00 15.42 H new ATOM 0 HG2 GLU A 103 -16.416 -6.310 11.951 1.00 22.41 H new ATOM 0 HG3 GLU A 103 -17.691 -6.661 13.102 1.00 22.41 H new ATOM 1678 N GLU A 104 -17.377 -7.693 8.879 1.00 22.14 N ATOM 1679 CA GLU A 104 -17.118 -6.782 7.771 1.00 43.03 C ATOM 1680 C GLU A 104 -18.420 -6.203 7.226 1.00 35.23 C ATOM 1681 O GLU A 104 -18.494 -5.021 6.893 1.00 13.13 O ATOM 1682 CB GLU A 104 -16.362 -7.505 6.654 1.00 43.52 C ATOM 1683 CG GLU A 104 -16.145 -6.652 5.415 1.00 2.41 C ATOM 1684 CD GLU A 104 -15.594 -5.277 5.742 1.00 20.33 C ATOM 1685 OE1 GLU A 104 -14.604 -5.201 6.500 1.00 50.40 O ATOM 1686 OE2 GLU A 104 -16.152 -4.279 5.241 1.00 33.05 O ATOM 0 H GLU A 104 -17.030 -8.641 8.736 1.00 22.14 H new ATOM 0 HA GLU A 104 -16.505 -5.962 8.144 1.00 43.03 H new ATOM 0 HB2 GLU A 104 -15.394 -7.832 7.034 1.00 43.52 H new ATOM 0 HB3 GLU A 104 -16.914 -8.402 6.375 1.00 43.52 H new ATOM 0 HG2 GLU A 104 -15.457 -7.164 4.742 1.00 2.41 H new ATOM 0 HG3 GLU A 104 -17.090 -6.543 4.883 1.00 2.41 H new