USER MOD reduce.3.24.130724 H: found=0, std=0, add=868, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 864 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 64 SER OG : rot -140:sc= 0.688 USER MOD Set 1.2: A 67 ASN : amide:sc= 0.479 K(o=1.2,f=-1.7) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 167:sc= -0.018 (180deg=-0.209) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 CYS SG : rot 180:sc= 0 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.00834 USER MOD Single : A 11 MET CE :methyl -124:sc= -3.02 (180deg=-9.37!) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 MET CE :methyl -165:sc= -0.0133 (180deg=-0.258) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot -46:sc= 0.554 USER MOD Single : A 25 LYS NZ :NH3+ -157:sc= -0.0714 (180deg=-0.527) 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=-0.019) USER MOD Single : A 30 THR OG1 : rot 180:sc= -0.0112 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 TYR OH : rot -105:sc= 0.0122 USER MOD Single : A 42 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.574 USER MOD Single : A 51 SER OG : rot 180:sc= -0.122 USER MOD Single : A 54 SER OG : rot 60:sc= 0.643 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 59 ASN : amide:sc= -0.278 K(o=-0.28,f=-1.7!) USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 61 ASN : amide:sc= -0.28 X(o=-0.28,f=-0.73) USER MOD Single : A 66 THR OG1 : rot -55:sc= 0.804 USER MOD Single : A 78 SER OG : rot -30:sc= 0.67 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 159:sc= -0.0919 (180deg=-0.483) USER MOD Single : A 90 HIS : no HD1:sc= -0.202 X(o=-0.2,f=-0.45) USER MOD Single : A 91 THR OG1 : rot -157:sc= 0.082 USER MOD Single : A 97 TYR OH : rot 102:sc= 0.633 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.513 -4.734 -1.367 1.00 65.42 N ATOM 2 CA MET A 1 5.206 -5.124 0.004 1.00 73.20 C ATOM 3 C MET A 1 4.015 -4.335 0.539 1.00 2.03 C ATOM 4 O MET A 1 3.959 -4.006 1.724 1.00 72.22 O ATOM 5 CB MET A 1 6.423 -4.906 0.904 1.00 23.33 C ATOM 6 CG MET A 1 6.872 -3.456 0.980 1.00 53.25 C ATOM 7 SD MET A 1 8.076 -3.168 2.290 1.00 30.23 S ATOM 8 CE MET A 1 7.038 -2.427 3.547 1.00 14.42 C ATOM 0 H1 MET A 1 6.444 -5.111 -1.635 1.00 65.42 H new ATOM 0 H2 MET A 1 4.788 -5.116 -2.007 1.00 65.42 H new ATOM 0 H3 MET A 1 5.526 -3.697 -1.438 1.00 65.42 H new ATOM 0 HA MET A 1 4.948 -6.183 0.005 1.00 73.20 H new ATOM 0 HB2 MET A 1 6.189 -5.258 1.909 1.00 23.33 H new ATOM 0 HB3 MET A 1 7.249 -5.515 0.537 1.00 23.33 H new ATOM 0 HG2 MET A 1 7.305 -3.164 0.023 1.00 53.25 H new ATOM 0 HG3 MET A 1 6.003 -2.819 1.145 1.00 53.25 H new ATOM 0 HE1 MET A 1 7.641 -2.191 4.424 1.00 14.42 H new ATOM 0 HE2 MET A 1 6.591 -1.512 3.157 1.00 14.42 H new ATOM 0 HE3 MET A 1 6.249 -3.126 3.826 1.00 14.42 H new ATOM 18 N ALA A 2 3.066 -4.034 -0.341 1.00 62.11 N ATOM 19 CA ALA A 2 1.877 -3.285 0.044 1.00 75.20 C ATOM 20 C ALA A 2 0.629 -4.159 -0.031 1.00 23.42 C ATOM 21 O ALA A 2 -0.226 -4.113 0.853 1.00 72.34 O ATOM 22 CB ALA A 2 1.717 -2.057 -0.840 1.00 74.44 C ATOM 0 H ALA A 2 3.098 -4.298 -1.326 1.00 62.11 H new ATOM 0 HA ALA A 2 2.001 -2.962 1.078 1.00 75.20 H new ATOM 0 HB1 ALA A 2 0.825 -1.507 -0.541 1.00 74.44 H new ATOM 0 HB2 ALA A 2 2.592 -1.415 -0.733 1.00 74.44 H new ATOM 0 HB3 ALA A 2 1.620 -2.368 -1.880 1.00 74.44 H new ATOM 28 N ALA A 3 0.533 -4.955 -1.091 1.00 54.20 N ATOM 29 CA ALA A 3 -0.610 -5.840 -1.280 1.00 24.41 C ATOM 30 C ALA A 3 -0.173 -7.301 -1.306 1.00 33.34 C ATOM 31 O ALA A 3 -0.329 -7.990 -2.315 1.00 13.32 O ATOM 32 CB ALA A 3 -1.346 -5.485 -2.563 1.00 35.12 C ATOM 0 H ALA A 3 1.233 -5.005 -1.832 1.00 54.20 H new ATOM 0 HA ALA A 3 -1.287 -5.704 -0.437 1.00 24.41 H new ATOM 0 HB1 ALA A 3 -2.197 -6.154 -2.691 1.00 35.12 H new ATOM 0 HB2 ALA A 3 -1.699 -4.455 -2.507 1.00 35.12 H new ATOM 0 HB3 ALA A 3 -0.670 -5.591 -3.411 1.00 35.12 H new ATOM 38 N THR A 4 0.376 -7.770 -0.189 1.00 75.10 N ATOM 39 CA THR A 4 0.836 -9.149 -0.084 1.00 44.32 C ATOM 40 C THR A 4 0.460 -9.753 1.263 1.00 33.45 C ATOM 41 O THR A 4 1.121 -10.671 1.750 1.00 11.33 O ATOM 42 CB THR A 4 2.362 -9.247 -0.269 1.00 44.55 C ATOM 43 OG1 THR A 4 3.028 -8.452 0.719 1.00 72.41 O ATOM 44 CG2 THR A 4 2.770 -8.781 -1.659 1.00 73.44 C ATOM 0 H THR A 4 0.513 -7.214 0.655 1.00 75.10 H new ATOM 0 HA THR A 4 0.344 -9.708 -0.880 1.00 44.32 H new ATOM 0 HB THR A 4 2.653 -10.291 -0.152 1.00 44.55 H new ATOM 0 HG1 THR A 4 3.998 -8.521 0.595 1.00 72.41 H new ATOM 0 HG21 THR A 4 3.852 -8.859 -1.766 1.00 73.44 H new ATOM 0 HG22 THR A 4 2.285 -9.406 -2.409 1.00 73.44 H new ATOM 0 HG23 THR A 4 2.466 -7.744 -1.799 1.00 73.44 H new ATOM 52 N VAL A 5 -0.607 -9.234 1.862 1.00 35.34 N ATOM 53 CA VAL A 5 -1.073 -9.725 3.154 1.00 55.31 C ATOM 54 C VAL A 5 -2.446 -9.156 3.495 1.00 0.52 C ATOM 55 O VAL A 5 -2.635 -7.939 3.525 1.00 2.22 O ATOM 56 CB VAL A 5 -0.086 -9.365 4.280 1.00 33.12 C ATOM 57 CG1 VAL A 5 0.154 -7.864 4.321 1.00 14.41 C ATOM 58 CG2 VAL A 5 -0.602 -9.868 5.620 1.00 4.33 C ATOM 0 H VAL A 5 -1.165 -8.474 1.474 1.00 35.34 H new ATOM 0 HA VAL A 5 -1.142 -10.810 3.075 1.00 55.31 H new ATOM 0 HB VAL A 5 0.866 -9.855 4.076 1.00 33.12 H new ATOM 0 HG11 VAL A 5 0.854 -7.629 5.123 1.00 14.41 H new ATOM 0 HG12 VAL A 5 0.570 -7.536 3.368 1.00 14.41 H new ATOM 0 HG13 VAL A 5 -0.790 -7.349 4.501 1.00 14.41 H new ATOM 0 HG21 VAL A 5 0.107 -9.605 6.405 1.00 4.33 H new ATOM 0 HG22 VAL A 5 -1.567 -9.408 5.834 1.00 4.33 H new ATOM 0 HG23 VAL A 5 -0.717 -10.951 5.582 1.00 4.33 H new ATOM 68 N CYS A 6 -3.401 -10.043 3.752 1.00 3.51 N ATOM 69 CA CYS A 6 -4.758 -9.629 4.092 1.00 43.35 C ATOM 70 C CYS A 6 -5.071 -9.937 5.552 1.00 2.00 C ATOM 71 O CYS A 6 -4.906 -11.069 6.009 1.00 55.13 O ATOM 72 CB CYS A 6 -5.769 -10.328 3.182 1.00 41.21 C ATOM 73 SG CYS A 6 -6.030 -9.500 1.596 1.00 75.44 S ATOM 0 H CYS A 6 -3.261 -11.053 3.731 1.00 3.51 H new ATOM 0 HA CYS A 6 -4.831 -8.552 3.944 1.00 43.35 H new ATOM 0 HB2 CYS A 6 -5.431 -11.347 2.996 1.00 41.21 H new ATOM 0 HB3 CYS A 6 -6.723 -10.399 3.704 1.00 41.21 H new ATOM 0 HG CYS A 6 -6.899 -10.167 0.896 1.00 75.44 H new ATOM 79 N THR A 7 -5.522 -8.922 6.282 1.00 1.34 N ATOM 80 CA THR A 7 -5.855 -9.083 7.692 1.00 53.11 C ATOM 81 C THR A 7 -7.349 -9.324 7.879 1.00 22.25 C ATOM 82 O THR A 7 -8.165 -8.876 7.074 1.00 13.33 O ATOM 83 CB THR A 7 -5.439 -7.847 8.512 1.00 35.55 C ATOM 84 OG1 THR A 7 -4.667 -6.957 7.700 1.00 63.02 O ATOM 85 CG2 THR A 7 -4.632 -8.257 9.735 1.00 44.42 C ATOM 0 H THR A 7 -5.665 -7.979 5.920 1.00 1.34 H new ATOM 0 HA THR A 7 -5.302 -9.951 8.051 1.00 53.11 H new ATOM 0 HB THR A 7 -6.343 -7.339 8.847 1.00 35.55 H new ATOM 0 HG1 THR A 7 -4.408 -6.173 8.229 1.00 63.02 H new ATOM 0 HG21 THR A 7 -4.349 -7.368 10.299 1.00 44.42 H new ATOM 0 HG22 THR A 7 -5.234 -8.911 10.366 1.00 44.42 H new ATOM 0 HG23 THR A 7 -3.734 -8.786 9.417 1.00 44.42 H new ATOM 93 N ILE A 8 -7.699 -10.034 8.947 1.00 72.25 N ATOM 94 CA ILE A 8 -9.095 -10.333 9.240 1.00 53.11 C ATOM 95 C ILE A 8 -9.458 -9.923 10.663 1.00 10.50 C ATOM 96 O ILE A 8 -8.676 -9.264 11.348 1.00 13.12 O ATOM 97 CB ILE A 8 -9.401 -11.831 9.056 1.00 72.10 C ATOM 98 CG1 ILE A 8 -8.109 -12.611 8.804 1.00 41.41 C ATOM 99 CG2 ILE A 8 -10.381 -12.035 7.910 1.00 12.12 C ATOM 100 CD1 ILE A 8 -7.569 -12.448 7.400 1.00 34.20 C ATOM 0 H ILE A 8 -7.035 -10.412 9.623 1.00 72.25 H new ATOM 0 HA ILE A 8 -9.695 -9.759 8.534 1.00 53.11 H new ATOM 0 HB ILE A 8 -9.858 -12.208 9.971 1.00 72.10 H new ATOM 0 HG12 ILE A 8 -7.352 -12.284 9.516 1.00 41.41 H new ATOM 0 HG13 ILE A 8 -8.290 -13.669 8.995 1.00 41.41 H new ATOM 0 HG21 ILE A 8 -10.587 -13.099 7.793 1.00 12.12 H new ATOM 0 HG22 ILE A 8 -11.310 -11.507 8.127 1.00 12.12 H new ATOM 0 HG23 ILE A 8 -9.949 -11.645 6.988 1.00 12.12 H new ATOM 0 HD11 ILE A 8 -6.653 -13.028 7.293 1.00 34.20 H new ATOM 0 HD12 ILE A 8 -8.309 -12.802 6.682 1.00 34.20 H new ATOM 0 HD13 ILE A 8 -7.356 -11.396 7.212 1.00 34.20 H new ATOM 112 N ALA A 9 -10.649 -10.318 11.102 1.00 65.01 N ATOM 113 CA ALA A 9 -11.114 -9.995 12.445 1.00 44.20 C ATOM 114 C ALA A 9 -10.021 -10.245 13.479 1.00 11.51 C ATOM 115 O ALA A 9 -9.746 -9.392 14.323 1.00 3.24 O ATOM 116 CB ALA A 9 -12.357 -10.804 12.782 1.00 60.40 C ATOM 0 H ALA A 9 -11.309 -10.862 10.547 1.00 65.01 H new ATOM 0 HA ALA A 9 -11.366 -8.935 12.470 1.00 44.20 H new ATOM 0 HB1 ALA A 9 -12.693 -10.553 13.788 1.00 60.40 H new ATOM 0 HB2 ALA A 9 -13.147 -10.573 12.067 1.00 60.40 H new ATOM 0 HB3 ALA A 9 -12.123 -11.868 12.733 1.00 60.40 H new ATOM 122 N ASP A 10 -9.403 -11.418 13.408 1.00 63.02 N ATOM 123 CA ASP A 10 -8.340 -11.780 14.338 1.00 5.21 C ATOM 124 C ASP A 10 -7.399 -12.807 13.716 1.00 40.03 C ATOM 125 O ASP A 10 -7.222 -13.903 14.247 1.00 2.30 O ATOM 126 CB ASP A 10 -8.933 -12.333 15.634 1.00 34.34 C ATOM 127 CG ASP A 10 -9.992 -11.421 16.222 1.00 3.23 C ATOM 128 OD1 ASP A 10 -9.629 -10.524 17.011 1.00 11.43 O ATOM 129 OD2 ASP A 10 -11.183 -11.604 15.894 1.00 22.40 O ATOM 0 H ASP A 10 -9.620 -12.135 12.716 1.00 63.02 H new ATOM 0 HA ASP A 10 -7.768 -10.880 14.564 1.00 5.21 H new ATOM 0 HB2 ASP A 10 -9.368 -13.314 15.441 1.00 34.34 H new ATOM 0 HB3 ASP A 10 -8.135 -12.476 16.363 1.00 34.34 H new ATOM 134 N MET A 11 -6.800 -12.445 12.586 1.00 3.11 N ATOM 135 CA MET A 11 -5.877 -13.336 11.891 1.00 12.54 C ATOM 136 C MET A 11 -5.132 -12.593 10.787 1.00 1.52 C ATOM 137 O MET A 11 -5.454 -11.447 10.468 1.00 62.51 O ATOM 138 CB MET A 11 -6.633 -14.527 11.300 1.00 21.12 C ATOM 139 CG MET A 11 -5.820 -15.811 11.277 1.00 31.52 C ATOM 140 SD MET A 11 -6.854 -17.288 11.296 1.00 32.43 S ATOM 141 CE MET A 11 -5.648 -18.541 11.725 1.00 1.25 C ATOM 0 H MET A 11 -6.937 -11.542 12.132 1.00 3.11 H new ATOM 0 HA MET A 11 -5.148 -13.700 12.615 1.00 12.54 H new ATOM 0 HB2 MET A 11 -7.542 -14.693 11.878 1.00 21.12 H new ATOM 0 HB3 MET A 11 -6.941 -14.283 10.283 1.00 21.12 H new ATOM 0 HG2 MET A 11 -5.192 -15.823 10.386 1.00 31.52 H new ATOM 0 HG3 MET A 11 -5.152 -15.829 12.138 1.00 31.52 H new ATOM 0 HE1 MET A 11 -5.649 -19.323 10.965 1.00 1.25 H new ATOM 0 HE2 MET A 11 -4.657 -18.089 11.779 1.00 1.25 H new ATOM 0 HE3 MET A 11 -5.902 -18.975 12.692 1.00 1.25 H new ATOM 151 N THR A 12 -4.133 -13.251 10.206 1.00 15.14 N ATOM 152 CA THR A 12 -3.342 -12.652 9.139 1.00 22.23 C ATOM 153 C THR A 12 -3.109 -13.644 8.005 1.00 4.22 C ATOM 154 O THR A 12 -2.339 -14.594 8.146 1.00 31.45 O ATOM 155 CB THR A 12 -1.980 -12.156 9.661 1.00 62.44 C ATOM 156 OG1 THR A 12 -2.146 -11.509 10.927 1.00 52.22 O ATOM 157 CG2 THR A 12 -1.340 -11.193 8.672 1.00 14.45 C ATOM 0 H THR A 12 -3.853 -14.199 10.457 1.00 15.14 H new ATOM 0 HA THR A 12 -3.910 -11.801 8.763 1.00 22.23 H new ATOM 0 HB THR A 12 -1.325 -13.019 9.779 1.00 62.44 H new ATOM 0 HG1 THR A 12 -1.275 -11.198 11.252 1.00 52.22 H new ATOM 0 HG21 THR A 12 -0.380 -10.856 9.062 1.00 14.45 H new ATOM 0 HG22 THR A 12 -1.187 -11.699 7.719 1.00 14.45 H new ATOM 0 HG23 THR A 12 -1.994 -10.333 8.526 1.00 14.45 H new ATOM 165 N VAL A 13 -3.777 -13.416 6.879 1.00 34.12 N ATOM 166 CA VAL A 13 -3.641 -14.289 5.719 1.00 14.13 C ATOM 167 C VAL A 13 -2.514 -13.819 4.807 1.00 23.12 C ATOM 168 O VAL A 13 -2.331 -12.620 4.596 1.00 71.12 O ATOM 169 CB VAL A 13 -4.949 -14.353 4.909 1.00 75.14 C ATOM 170 CG1 VAL A 13 -4.762 -15.198 3.658 1.00 43.34 C ATOM 171 CG2 VAL A 13 -6.081 -14.900 5.766 1.00 2.21 C ATOM 0 H VAL A 13 -4.418 -12.634 6.745 1.00 34.12 H new ATOM 0 HA VAL A 13 -3.407 -15.284 6.097 1.00 14.13 H new ATOM 0 HB VAL A 13 -5.213 -13.342 4.600 1.00 75.14 H new ATOM 0 HG11 VAL A 13 -5.697 -15.232 3.099 1.00 43.34 H new ATOM 0 HG12 VAL A 13 -3.982 -14.759 3.036 1.00 43.34 H new ATOM 0 HG13 VAL A 13 -4.473 -16.210 3.942 1.00 43.34 H new ATOM 0 HG21 VAL A 13 -6.997 -14.938 5.177 1.00 2.21 H new ATOM 0 HG22 VAL A 13 -5.827 -15.904 6.107 1.00 2.21 H new ATOM 0 HG23 VAL A 13 -6.231 -14.251 6.629 1.00 2.21 H new ATOM 181 N ASP A 14 -1.760 -14.771 4.269 1.00 30.50 N ATOM 182 CA ASP A 14 -0.650 -14.456 3.377 1.00 10.25 C ATOM 183 C ASP A 14 -0.927 -14.961 1.965 1.00 52.52 C ATOM 184 O ASP A 14 -1.060 -16.163 1.740 1.00 62.11 O ATOM 185 CB ASP A 14 0.647 -15.069 3.906 1.00 23.53 C ATOM 186 CG ASP A 14 1.761 -14.049 4.032 1.00 2.15 C ATOM 187 OD1 ASP A 14 1.641 -13.141 4.882 1.00 75.54 O ATOM 188 OD2 ASP A 14 2.753 -14.157 3.281 1.00 3.04 O ATOM 0 H ASP A 14 -1.897 -15.768 4.435 1.00 30.50 H new ATOM 0 HA ASP A 14 -0.542 -13.372 3.341 1.00 10.25 H new ATOM 0 HB2 ASP A 14 0.461 -15.521 4.880 1.00 23.53 H new ATOM 0 HB3 ASP A 14 0.965 -15.870 3.239 1.00 23.53 H new ATOM 193 N MET A 15 -1.014 -14.033 1.017 1.00 14.00 N ATOM 194 CA MET A 15 -1.276 -14.385 -0.374 1.00 1.51 C ATOM 195 C MET A 15 0.015 -14.774 -1.088 1.00 75.00 C ATOM 196 O MET A 15 -0.013 -15.270 -2.214 1.00 70.43 O ATOM 197 CB MET A 15 -1.942 -13.215 -1.101 1.00 71.13 C ATOM 198 CG MET A 15 -0.986 -12.081 -1.432 1.00 4.34 C ATOM 199 SD MET A 15 -1.780 -10.748 -2.350 1.00 1.42 S ATOM 200 CE MET A 15 -2.020 -11.530 -3.943 1.00 62.10 C ATOM 0 H MET A 15 -0.907 -13.033 1.186 1.00 14.00 H new ATOM 0 HA MET A 15 -1.950 -15.242 -0.386 1.00 1.51 H new ATOM 0 HB2 MET A 15 -2.392 -13.581 -2.024 1.00 71.13 H new ATOM 0 HB3 MET A 15 -2.752 -12.828 -0.483 1.00 71.13 H new ATOM 0 HG2 MET A 15 -0.568 -11.682 -0.508 1.00 4.34 H new ATOM 0 HG3 MET A 15 -0.153 -12.472 -2.015 1.00 4.34 H new ATOM 0 HE1 MET A 15 -2.250 -10.770 -4.690 1.00 62.10 H new ATOM 0 HE2 MET A 15 -1.111 -12.058 -4.230 1.00 62.10 H new ATOM 0 HE3 MET A 15 -2.846 -12.238 -3.880 1.00 62.10 H new ATOM 210 N VAL A 16 1.144 -14.545 -0.426 1.00 23.51 N ATOM 211 CA VAL A 16 2.445 -14.873 -0.997 1.00 60.34 C ATOM 212 C VAL A 16 3.032 -16.122 -0.348 1.00 54.31 C ATOM 213 O VAL A 16 3.748 -16.890 -0.991 1.00 1.55 O ATOM 214 CB VAL A 16 3.439 -13.708 -0.835 1.00 22.11 C ATOM 215 CG1 VAL A 16 3.027 -12.529 -1.703 1.00 34.12 C ATOM 216 CG2 VAL A 16 3.542 -13.296 0.626 1.00 53.43 C ATOM 0 H VAL A 16 1.184 -14.134 0.506 1.00 23.51 H new ATOM 0 HA VAL A 16 2.286 -15.060 -2.059 1.00 60.34 H new ATOM 0 HB VAL A 16 4.422 -14.043 -1.164 1.00 22.11 H new ATOM 0 HG11 VAL A 16 3.741 -11.716 -1.575 1.00 34.12 H new ATOM 0 HG12 VAL A 16 3.010 -12.836 -2.749 1.00 34.12 H new ATOM 0 HG13 VAL A 16 2.034 -12.189 -1.408 1.00 34.12 H new ATOM 0 HG21 VAL A 16 4.249 -12.472 0.723 1.00 53.43 H new ATOM 0 HG22 VAL A 16 2.563 -12.979 0.984 1.00 53.43 H new ATOM 0 HG23 VAL A 16 3.889 -14.142 1.219 1.00 53.43 H new ATOM 226 N ARG A 17 2.722 -16.319 0.929 1.00 3.43 N ATOM 227 CA ARG A 17 3.219 -17.474 1.666 1.00 24.05 C ATOM 228 C ARG A 17 2.125 -18.525 1.833 1.00 44.32 C ATOM 229 O ARG A 17 2.407 -19.687 2.125 1.00 14.04 O ATOM 230 CB ARG A 17 3.741 -17.044 3.039 1.00 64.23 C ATOM 231 CG ARG A 17 5.036 -16.251 2.977 1.00 43.24 C ATOM 232 CD ARG A 17 5.821 -16.362 4.275 1.00 72.35 C ATOM 233 NE ARG A 17 7.185 -15.859 4.135 1.00 55.32 N ATOM 234 CZ ARG A 17 8.172 -16.169 4.968 1.00 75.21 C ATOM 235 NH1 ARG A 17 7.947 -16.978 5.994 1.00 3.35 N ATOM 236 NH2 ARG A 17 9.386 -15.671 4.774 1.00 21.04 N ATOM 0 H ARG A 17 2.129 -15.694 1.475 1.00 3.43 H new ATOM 0 HA ARG A 17 4.037 -17.913 1.095 1.00 24.05 H new ATOM 0 HB2 ARG A 17 2.980 -16.442 3.536 1.00 64.23 H new ATOM 0 HB3 ARG A 17 3.897 -17.931 3.653 1.00 64.23 H new ATOM 0 HG2 ARG A 17 5.646 -16.613 2.150 1.00 43.24 H new ATOM 0 HG3 ARG A 17 4.813 -15.204 2.774 1.00 43.24 H new ATOM 0 HD2 ARG A 17 5.308 -15.804 5.058 1.00 72.35 H new ATOM 0 HD3 ARG A 17 5.850 -17.404 4.593 1.00 72.35 H new ATOM 0 HE ARG A 17 7.391 -15.235 3.355 1.00 55.32 H new ATOM 0 HH11 ARG A 17 7.015 -17.363 6.145 1.00 3.35 H new ATOM 0 HH12 ARG A 17 8.706 -17.215 6.633 1.00 3.35 H new ATOM 0 HH21 ARG A 17 9.562 -15.049 3.985 1.00 21.04 H new ATOM 0 HH22 ARG A 17 10.143 -15.910 5.414 1.00 21.04 H new ATOM 250 N ARG A 18 0.878 -18.107 1.645 1.00 72.23 N ATOM 251 CA ARG A 18 -0.258 -19.011 1.776 1.00 73.54 C ATOM 252 C ARG A 18 -0.333 -19.591 3.185 1.00 3.54 C ATOM 253 O ARG A 18 -0.318 -20.808 3.370 1.00 32.04 O ATOM 254 CB ARG A 18 -0.157 -20.144 0.752 1.00 5.03 C ATOM 255 CG ARG A 18 -0.043 -19.659 -0.684 1.00 2.13 C ATOM 256 CD ARG A 18 1.405 -19.408 -1.074 1.00 4.32 C ATOM 257 NE ARG A 18 1.577 -19.334 -2.522 1.00 41.33 N ATOM 258 CZ ARG A 18 1.637 -20.401 -3.311 1.00 21.13 C ATOM 259 NH1 ARG A 18 1.539 -21.618 -2.793 1.00 44.13 N ATOM 260 NH2 ARG A 18 1.795 -20.252 -4.620 1.00 33.52 N ATOM 0 H ARG A 18 0.629 -17.148 1.402 1.00 72.23 H new ATOM 0 HA ARG A 18 -1.167 -18.440 1.588 1.00 73.54 H new ATOM 0 HB2 ARG A 18 0.711 -20.760 0.989 1.00 5.03 H new ATOM 0 HB3 ARG A 18 -1.035 -20.783 0.842 1.00 5.03 H new ATOM 0 HG2 ARG A 18 -0.478 -20.400 -1.355 1.00 2.13 H new ATOM 0 HG3 ARG A 18 -0.618 -18.741 -0.806 1.00 2.13 H new ATOM 0 HD2 ARG A 18 1.746 -18.478 -0.620 1.00 4.32 H new ATOM 0 HD3 ARG A 18 2.031 -20.206 -0.675 1.00 4.32 H new ATOM 0 HE ARG A 18 1.655 -18.412 -2.951 1.00 41.33 H new ATOM 0 HH11 ARG A 18 1.417 -21.736 -1.787 1.00 44.13 H new ATOM 0 HH12 ARG A 18 1.585 -22.436 -3.400 1.00 44.13 H new ATOM 0 HH21 ARG A 18 1.871 -19.317 -5.021 1.00 33.52 H new ATOM 0 HH22 ARG A 18 1.841 -21.072 -5.225 1.00 33.52 H new ATOM 274 N THR A 19 -0.412 -18.710 4.178 1.00 1.21 N ATOM 275 CA THR A 19 -0.487 -19.133 5.571 1.00 43.52 C ATOM 276 C THR A 19 -1.511 -18.308 6.342 1.00 41.44 C ATOM 277 O THR A 19 -2.078 -17.351 5.813 1.00 62.44 O ATOM 278 CB THR A 19 0.882 -19.013 6.268 1.00 35.34 C ATOM 279 OG1 THR A 19 1.162 -17.641 6.565 1.00 45.25 O ATOM 280 CG2 THR A 19 1.987 -19.585 5.393 1.00 33.13 C ATOM 0 H THR A 19 -0.426 -17.699 4.043 1.00 1.21 H new ATOM 0 HA THR A 19 -0.795 -20.178 5.568 1.00 43.52 H new ATOM 0 HB THR A 19 0.844 -19.584 7.196 1.00 35.34 H new ATOM 0 HG1 THR A 19 2.033 -17.574 7.009 1.00 45.25 H new ATOM 0 HG21 THR A 19 2.944 -19.489 5.906 1.00 33.13 H new ATOM 0 HG22 THR A 19 1.786 -20.638 5.194 1.00 33.13 H new ATOM 0 HG23 THR A 19 2.024 -19.039 4.451 1.00 33.13 H new ATOM 288 N VAL A 20 -1.744 -18.683 7.595 1.00 5.25 N ATOM 289 CA VAL A 20 -2.699 -17.976 8.440 1.00 2.03 C ATOM 290 C VAL A 20 -2.169 -17.826 9.862 1.00 34.41 C ATOM 291 O VAL A 20 -1.957 -18.816 10.563 1.00 24.12 O ATOM 292 CB VAL A 20 -4.056 -18.703 8.483 1.00 23.43 C ATOM 293 CG1 VAL A 20 -4.860 -18.409 7.226 1.00 2.32 C ATOM 294 CG2 VAL A 20 -3.852 -20.201 8.657 1.00 43.13 C ATOM 0 H VAL A 20 -1.284 -19.473 8.048 1.00 5.25 H new ATOM 0 HA VAL A 20 -2.839 -16.988 8.002 1.00 2.03 H new ATOM 0 HB VAL A 20 -4.619 -18.334 9.340 1.00 23.43 H new ATOM 0 HG11 VAL A 20 -5.815 -18.931 7.275 1.00 2.32 H new ATOM 0 HG12 VAL A 20 -5.036 -17.336 7.150 1.00 2.32 H new ATOM 0 HG13 VAL A 20 -4.305 -18.749 6.351 1.00 2.32 H new ATOM 0 HG21 VAL A 20 -4.821 -20.699 8.685 1.00 43.13 H new ATOM 0 HG22 VAL A 20 -3.269 -20.588 7.821 1.00 43.13 H new ATOM 0 HG23 VAL A 20 -3.319 -20.390 9.589 1.00 43.13 H new ATOM 304 N ILE A 21 -1.959 -16.583 10.282 1.00 75.24 N ATOM 305 CA ILE A 21 -1.456 -16.304 11.621 1.00 75.21 C ATOM 306 C ILE A 21 -2.568 -15.791 12.530 1.00 52.02 C ATOM 307 O ILE A 21 -3.154 -14.738 12.277 1.00 2.12 O ATOM 308 CB ILE A 21 -0.316 -15.270 11.590 1.00 43.14 C ATOM 309 CG1 ILE A 21 0.912 -15.854 10.889 1.00 45.04 C ATOM 310 CG2 ILE A 21 0.035 -14.825 13.002 1.00 70.43 C ATOM 311 CD1 ILE A 21 0.836 -15.786 9.379 1.00 31.54 C ATOM 0 H ILE A 21 -2.129 -15.753 9.714 1.00 75.24 H new ATOM 0 HA ILE A 21 -1.072 -17.244 12.016 1.00 75.21 H new ATOM 0 HB ILE A 21 -0.652 -14.398 11.029 1.00 43.14 H new ATOM 0 HG12 ILE A 21 1.800 -15.319 11.224 1.00 45.04 H new ATOM 0 HG13 ILE A 21 1.033 -16.894 11.192 1.00 45.04 H new ATOM 0 HG21 ILE A 21 0.843 -14.094 12.963 1.00 70.43 H new ATOM 0 HG22 ILE A 21 -0.840 -14.374 13.470 1.00 70.43 H new ATOM 0 HG23 ILE A 21 0.355 -15.688 13.587 1.00 70.43 H new ATOM 0 HD11 ILE A 21 1.740 -16.218 8.949 1.00 31.54 H new ATOM 0 HD12 ILE A 21 -0.033 -16.345 9.033 1.00 31.54 H new ATOM 0 HD13 ILE A 21 0.746 -14.746 9.066 1.00 31.54 H new ATOM 323 N ARG A 22 -2.853 -16.541 13.589 1.00 25.22 N ATOM 324 CA ARG A 22 -3.894 -16.162 14.537 1.00 44.02 C ATOM 325 C ARG A 22 -3.300 -15.407 15.723 1.00 75.40 C ATOM 326 O ARG A 22 -2.686 -16.004 16.607 1.00 64.34 O ATOM 327 CB ARG A 22 -4.641 -17.403 15.030 1.00 43.42 C ATOM 328 CG ARG A 22 -5.753 -17.091 16.018 1.00 23.21 C ATOM 329 CD ARG A 22 -7.067 -16.809 15.307 1.00 30.22 C ATOM 330 NE ARG A 22 -7.901 -15.868 16.051 1.00 65.25 N ATOM 331 CZ ARG A 22 -8.470 -16.153 17.216 1.00 30.03 C ATOM 332 NH1 ARG A 22 -8.296 -17.346 17.769 1.00 53.41 N ATOM 333 NH2 ARG A 22 -9.215 -15.244 17.832 1.00 3.41 N ATOM 0 H ARG A 22 -2.377 -17.415 13.812 1.00 25.22 H new ATOM 0 HA ARG A 22 -4.596 -15.504 14.024 1.00 44.02 H new ATOM 0 HB2 ARG A 22 -5.064 -17.927 14.173 1.00 43.42 H new ATOM 0 HB3 ARG A 22 -3.930 -18.083 15.499 1.00 43.42 H new ATOM 0 HG2 ARG A 22 -5.881 -17.931 16.701 1.00 23.21 H new ATOM 0 HG3 ARG A 22 -5.473 -16.228 16.622 1.00 23.21 H new ATOM 0 HD2 ARG A 22 -6.863 -16.407 14.315 1.00 30.22 H new ATOM 0 HD3 ARG A 22 -7.611 -17.743 15.167 1.00 30.22 H new ATOM 0 HE ARG A 22 -8.054 -14.941 15.653 1.00 65.25 H new ATOM 0 HH11 ARG A 22 -7.724 -18.047 17.299 1.00 53.41 H new ATOM 0 HH12 ARG A 22 -8.734 -17.562 18.664 1.00 53.41 H new ATOM 0 HH21 ARG A 22 -9.351 -14.325 17.410 1.00 3.41 H new ATOM 0 HH22 ARG A 22 -9.652 -15.464 18.727 1.00 3.41 H new ATOM 347 N SER A 23 -3.489 -14.092 15.735 1.00 51.31 N ATOM 348 CA SER A 23 -2.969 -13.255 16.810 1.00 52.31 C ATOM 349 C SER A 23 -1.484 -13.522 17.037 1.00 52.35 C ATOM 350 O SER A 23 -0.996 -13.460 18.164 1.00 42.41 O ATOM 351 CB SER A 23 -3.747 -13.506 18.103 1.00 74.43 C ATOM 352 OG SER A 23 -3.396 -12.564 19.101 1.00 32.11 O ATOM 0 H SER A 23 -3.998 -13.583 15.013 1.00 51.31 H new ATOM 0 HA SER A 23 -3.092 -12.212 16.517 1.00 52.31 H new ATOM 0 HB2 SER A 23 -4.817 -13.448 17.904 1.00 74.43 H new ATOM 0 HB3 SER A 23 -3.544 -14.515 18.463 1.00 74.43 H new ATOM 0 HG SER A 23 -2.421 -12.471 19.135 1.00 32.11 H new ATOM 358 N GLY A 24 -0.771 -13.820 15.955 1.00 41.34 N ATOM 359 CA GLY A 24 0.651 -14.092 16.055 1.00 31.24 C ATOM 360 C GLY A 24 0.946 -15.566 16.250 1.00 64.21 C ATOM 361 O GLY A 24 2.056 -15.940 16.630 1.00 61.10 O ATOM 0 H GLY A 24 -1.153 -13.878 15.011 1.00 41.34 H new ATOM 0 HA2 GLY A 24 1.150 -13.741 15.151 1.00 31.24 H new ATOM 0 HA3 GLY A 24 1.068 -13.528 16.889 1.00 31.24 H new ATOM 365 N LYS A 25 -0.049 -16.407 15.990 1.00 13.24 N ATOM 366 CA LYS A 25 0.108 -17.849 16.139 1.00 13.21 C ATOM 367 C LYS A 25 -0.382 -18.581 14.894 1.00 55.32 C ATOM 368 O LYS A 25 -1.585 -18.749 14.693 1.00 74.20 O ATOM 369 CB LYS A 25 -0.659 -18.342 17.368 1.00 10.13 C ATOM 370 CG LYS A 25 -0.134 -17.781 18.678 1.00 2.43 C ATOM 371 CD LYS A 25 -0.795 -16.456 19.022 1.00 23.44 C ATOM 372 CE LYS A 25 -0.624 -16.115 20.495 1.00 54.53 C ATOM 373 NZ LYS A 25 -1.325 -17.090 21.375 1.00 23.13 N ATOM 0 H LYS A 25 -0.974 -16.114 15.675 1.00 13.24 H new ATOM 0 HA LYS A 25 1.169 -18.062 16.271 1.00 13.21 H new ATOM 0 HB2 LYS A 25 -1.710 -18.073 17.262 1.00 10.13 H new ATOM 0 HB3 LYS A 25 -0.611 -19.430 17.403 1.00 10.13 H new ATOM 0 HG2 LYS A 25 -0.314 -18.497 19.480 1.00 2.43 H new ATOM 0 HG3 LYS A 25 0.945 -17.643 18.610 1.00 2.43 H new ATOM 0 HD2 LYS A 25 -0.363 -15.663 18.411 1.00 23.44 H new ATOM 0 HD3 LYS A 25 -1.857 -16.504 18.779 1.00 23.44 H new ATOM 0 HE2 LYS A 25 0.437 -16.099 20.743 1.00 54.53 H new ATOM 0 HE3 LYS A 25 -1.010 -15.113 20.683 1.00 54.53 H new ATOM 0 HZ1 LYS A 25 -1.525 -16.647 22.294 1.00 23.13 H new ATOM 0 HZ2 LYS A 25 -2.218 -17.380 20.929 1.00 23.13 H new ATOM 0 HZ3 LYS A 25 -0.722 -17.925 21.517 1.00 23.13 H new ATOM 387 N LYS A 26 0.557 -19.015 14.060 1.00 32.24 N ATOM 388 CA LYS A 26 0.222 -19.732 12.836 1.00 54.13 C ATOM 389 C LYS A 26 -0.483 -21.048 13.151 1.00 44.23 C ATOM 390 O LYS A 26 0.005 -21.847 13.951 1.00 15.21 O ATOM 391 CB LYS A 26 1.485 -20.001 12.016 1.00 64.03 C ATOM 392 CG LYS A 26 1.220 -20.734 10.712 1.00 21.43 C ATOM 393 CD LYS A 26 2.506 -20.988 9.944 1.00 71.15 C ATOM 394 CE LYS A 26 3.018 -19.719 9.280 1.00 61.13 C ATOM 395 NZ LYS A 26 4.289 -19.954 8.540 1.00 21.02 N ATOM 0 H LYS A 26 1.557 -18.882 14.210 1.00 32.24 H new ATOM 0 HA LYS A 26 -0.456 -19.108 12.253 1.00 54.13 H new ATOM 0 HB2 LYS A 26 1.974 -19.052 11.797 1.00 64.03 H new ATOM 0 HB3 LYS A 26 2.180 -20.587 12.617 1.00 64.03 H new ATOM 0 HG2 LYS A 26 0.726 -21.683 10.921 1.00 21.43 H new ATOM 0 HG3 LYS A 26 0.537 -20.148 10.097 1.00 21.43 H new ATOM 0 HD2 LYS A 26 3.265 -21.377 10.622 1.00 71.15 H new ATOM 0 HD3 LYS A 26 2.334 -21.752 9.186 1.00 71.15 H new ATOM 0 HE2 LYS A 26 2.263 -19.339 8.592 1.00 61.13 H new ATOM 0 HE3 LYS A 26 3.175 -18.951 10.037 1.00 61.13 H new ATOM 0 HZ1 LYS A 26 4.605 -19.065 8.102 1.00 21.02 H new ATOM 0 HZ2 LYS A 26 5.018 -20.293 9.200 1.00 21.02 H new ATOM 0 HZ3 LYS A 26 4.133 -20.668 7.800 1.00 21.02 H new ATOM 409 N ILE A 27 -1.629 -21.267 12.516 1.00 50.22 N ATOM 410 CA ILE A 27 -2.398 -22.487 12.727 1.00 24.21 C ATOM 411 C ILE A 27 -1.831 -23.642 11.908 1.00 34.23 C ATOM 412 O ILE A 27 -1.383 -23.454 10.777 1.00 64.20 O ATOM 413 CB ILE A 27 -3.880 -22.290 12.359 1.00 41.23 C ATOM 414 CG1 ILE A 27 -4.500 -21.190 13.222 1.00 15.42 C ATOM 415 CG2 ILE A 27 -4.645 -23.595 12.523 1.00 1.53 C ATOM 416 CD1 ILE A 27 -4.525 -21.521 14.698 1.00 72.31 C ATOM 0 H ILE A 27 -2.046 -20.615 11.851 1.00 50.22 H new ATOM 0 HA ILE A 27 -2.325 -22.726 13.788 1.00 24.21 H new ATOM 0 HB ILE A 27 -3.942 -21.985 11.315 1.00 41.23 H new ATOM 0 HG12 ILE A 27 -3.941 -20.266 13.075 1.00 15.42 H new ATOM 0 HG13 ILE A 27 -5.519 -21.004 12.882 1.00 15.42 H new ATOM 0 HG21 ILE A 27 -5.691 -23.439 12.259 1.00 1.53 H new ATOM 0 HG22 ILE A 27 -4.215 -24.354 11.869 1.00 1.53 H new ATOM 0 HG23 ILE A 27 -4.578 -23.928 13.559 1.00 1.53 H new ATOM 0 HD11 ILE A 27 -4.978 -20.696 15.248 1.00 72.31 H new ATOM 0 HD12 ILE A 27 -5.109 -22.428 14.858 1.00 72.31 H new ATOM 0 HD13 ILE A 27 -3.506 -21.678 15.053 1.00 72.31 H new ATOM 428 N HIS A 28 -1.857 -24.839 12.487 1.00 40.14 N ATOM 429 CA HIS A 28 -1.348 -26.026 11.809 1.00 33.33 C ATOM 430 C HIS A 28 -2.494 -26.922 11.348 1.00 14.24 C ATOM 431 O HIS A 28 -3.539 -26.995 11.997 1.00 1.53 O ATOM 432 CB HIS A 28 -0.416 -26.808 12.736 1.00 50.43 C ATOM 433 CG HIS A 28 0.981 -26.268 12.774 1.00 54.01 C ATOM 434 ND1 HIS A 28 1.838 -26.321 11.695 1.00 31.51 N ATOM 435 CD2 HIS A 28 1.668 -25.660 13.769 1.00 52.32 C ATOM 436 CE1 HIS A 28 2.992 -25.771 12.025 1.00 25.14 C ATOM 437 NE2 HIS A 28 2.915 -25.361 13.279 1.00 42.04 N ATOM 0 H HIS A 28 -2.225 -25.012 13.423 1.00 40.14 H new ATOM 0 HA HIS A 28 -0.788 -25.701 10.932 1.00 33.33 H new ATOM 0 HB2 HIS A 28 -0.828 -26.798 13.745 1.00 50.43 H new ATOM 0 HB3 HIS A 28 -0.386 -27.849 12.414 1.00 50.43 H new ATOM 0 HD2 HIS A 28 1.303 -25.449 14.763 1.00 52.32 H new ATOM 0 HE1 HIS A 28 3.853 -25.673 11.380 1.00 25.14 H new ATOM 0 HE2 HIS A 28 3.661 -24.898 13.798 1.00 42.04 H new ATOM 445 N LEU A 29 -2.293 -27.601 10.225 1.00 62.03 N ATOM 446 CA LEU A 29 -3.310 -28.492 9.676 1.00 3.41 C ATOM 447 C LEU A 29 -2.670 -29.618 8.870 1.00 0.34 C ATOM 448 O LEU A 29 -1.445 -29.721 8.790 1.00 34.12 O ATOM 449 CB LEU A 29 -4.281 -27.706 8.794 1.00 75.12 C ATOM 450 CG LEU A 29 -5.071 -26.596 9.488 1.00 33.12 C ATOM 451 CD1 LEU A 29 -5.809 -25.746 8.466 1.00 75.34 C ATOM 452 CD2 LEU A 29 -6.046 -27.186 10.497 1.00 23.02 C ATOM 0 H LEU A 29 -1.435 -27.552 9.676 1.00 62.03 H new ATOM 0 HA LEU A 29 -3.859 -28.933 10.508 1.00 3.41 H new ATOM 0 HB2 LEU A 29 -3.717 -27.264 7.972 1.00 75.12 H new ATOM 0 HB3 LEU A 29 -4.989 -28.408 8.354 1.00 75.12 H new ATOM 0 HG LEU A 29 -4.368 -25.956 10.022 1.00 33.12 H new ATOM 0 HD11 LEU A 29 -6.365 -24.962 8.979 1.00 75.34 H new ATOM 0 HD12 LEU A 29 -5.091 -25.294 7.782 1.00 75.34 H new ATOM 0 HD13 LEU A 29 -6.501 -26.373 7.903 1.00 75.34 H new ATOM 0 HD21 LEU A 29 -6.600 -26.382 10.981 1.00 23.02 H new ATOM 0 HD22 LEU A 29 -6.743 -27.849 9.985 1.00 23.02 H new ATOM 0 HD23 LEU A 29 -5.494 -27.751 11.249 1.00 23.02 H new ATOM 464 N THR A 30 -3.507 -30.460 8.272 1.00 1.12 N ATOM 465 CA THR A 30 -3.024 -31.578 7.472 1.00 42.25 C ATOM 466 C THR A 30 -3.001 -31.223 5.989 1.00 31.12 C ATOM 467 O THR A 30 -3.316 -30.097 5.605 1.00 25.34 O ATOM 468 CB THR A 30 -3.895 -32.832 7.674 1.00 2.14 C ATOM 469 OG1 THR A 30 -3.240 -33.978 7.120 1.00 24.35 O ATOM 470 CG2 THR A 30 -5.258 -32.656 7.022 1.00 45.34 C ATOM 0 H THR A 30 -4.523 -30.389 8.327 1.00 1.12 H new ATOM 0 HA THR A 30 -2.009 -31.792 7.808 1.00 42.25 H new ATOM 0 HB THR A 30 -4.039 -32.978 8.745 1.00 2.14 H new ATOM 0 HG1 THR A 30 -3.800 -34.771 7.254 1.00 24.35 H new ATOM 0 HG21 THR A 30 -5.855 -33.555 7.178 1.00 45.34 H new ATOM 0 HG22 THR A 30 -5.767 -31.801 7.467 1.00 45.34 H new ATOM 0 HG23 THR A 30 -5.131 -32.486 5.953 1.00 45.34 H new ATOM 478 N GLY A 31 -2.627 -32.192 5.159 1.00 73.10 N ATOM 479 CA GLY A 31 -2.571 -31.962 3.727 1.00 13.22 C ATOM 480 C GLY A 31 -3.913 -31.552 3.153 1.00 60.20 C ATOM 481 O GLY A 31 -4.020 -30.534 2.469 1.00 63.01 O ATOM 0 H GLY A 31 -2.362 -33.132 5.453 1.00 73.10 H new ATOM 0 HA2 GLY A 31 -1.836 -31.185 3.515 1.00 13.22 H new ATOM 0 HA3 GLY A 31 -2.228 -32.869 3.229 1.00 13.22 H new ATOM 485 N LYS A 32 -4.941 -32.348 3.429 1.00 2.55 N ATOM 486 CA LYS A 32 -6.283 -32.064 2.936 1.00 50.32 C ATOM 487 C LYS A 32 -6.753 -30.688 3.399 1.00 74.45 C ATOM 488 O LYS A 32 -7.161 -29.857 2.588 1.00 62.22 O ATOM 489 CB LYS A 32 -7.263 -33.137 3.415 1.00 64.30 C ATOM 490 CG LYS A 32 -6.763 -34.556 3.201 1.00 2.43 C ATOM 491 CD LYS A 32 -7.912 -35.525 2.983 1.00 34.01 C ATOM 492 CE LYS A 32 -7.513 -36.951 3.330 1.00 4.12 C ATOM 493 NZ LYS A 32 -6.463 -37.472 2.411 1.00 75.22 N ATOM 0 H LYS A 32 -4.870 -33.196 3.992 1.00 2.55 H new ATOM 0 HA LYS A 32 -6.251 -32.070 1.846 1.00 50.32 H new ATOM 0 HB2 LYS A 32 -7.463 -32.987 4.476 1.00 64.30 H new ATOM 0 HB3 LYS A 32 -8.211 -33.012 2.891 1.00 64.30 H new ATOM 0 HG2 LYS A 32 -6.096 -34.582 2.339 1.00 2.43 H new ATOM 0 HG3 LYS A 32 -6.179 -34.871 4.066 1.00 2.43 H new ATOM 0 HD2 LYS A 32 -8.763 -35.225 3.595 1.00 34.01 H new ATOM 0 HD3 LYS A 32 -8.235 -35.479 1.943 1.00 34.01 H new ATOM 0 HE2 LYS A 32 -7.148 -36.986 4.356 1.00 4.12 H new ATOM 0 HE3 LYS A 32 -8.391 -37.596 3.282 1.00 4.12 H new ATOM 0 HZ1 LYS A 32 -6.218 -38.446 2.680 1.00 75.22 H new ATOM 0 HZ2 LYS A 32 -6.820 -37.462 1.434 1.00 75.22 H new ATOM 0 HZ3 LYS A 32 -5.616 -36.872 2.476 1.00 75.22 H new ATOM 507 N GLU A 33 -6.693 -30.456 4.706 1.00 24.11 N ATOM 508 CA GLU A 33 -7.112 -29.181 5.275 1.00 52.41 C ATOM 509 C GLU A 33 -6.306 -28.029 4.682 1.00 43.21 C ATOM 510 O GLU A 33 -6.843 -26.954 4.412 1.00 32.45 O ATOM 511 CB GLU A 33 -6.953 -29.199 6.797 1.00 52.34 C ATOM 512 CG GLU A 33 -8.121 -29.844 7.523 1.00 71.50 C ATOM 513 CD GLU A 33 -8.169 -31.348 7.330 1.00 41.32 C ATOM 514 OE1 GLU A 33 -8.559 -31.792 6.230 1.00 53.33 O ATOM 515 OE2 GLU A 33 -7.817 -32.080 8.278 1.00 44.10 O ATOM 0 H GLU A 33 -6.358 -31.134 5.391 1.00 24.11 H new ATOM 0 HA GLU A 33 -8.163 -29.031 5.029 1.00 52.41 H new ATOM 0 HB2 GLU A 33 -6.038 -29.733 7.052 1.00 52.34 H new ATOM 0 HB3 GLU A 33 -6.835 -28.176 7.154 1.00 52.34 H new ATOM 0 HG2 GLU A 33 -8.051 -29.620 8.587 1.00 71.50 H new ATOM 0 HG3 GLU A 33 -9.053 -29.406 7.166 1.00 71.50 H new ATOM 522 N TYR A 34 -5.013 -28.261 4.482 1.00 72.00 N ATOM 523 CA TYR A 34 -4.131 -27.243 3.924 1.00 52.10 C ATOM 524 C TYR A 34 -4.576 -26.847 2.520 1.00 53.34 C ATOM 525 O TYR A 34 -4.483 -25.682 2.131 1.00 23.21 O ATOM 526 CB TYR A 34 -2.689 -27.751 3.890 1.00 62.05 C ATOM 527 CG TYR A 34 -1.686 -26.699 3.471 1.00 32.44 C ATOM 528 CD1 TYR A 34 -1.611 -25.480 4.134 1.00 70.43 C ATOM 529 CD2 TYR A 34 -0.813 -26.925 2.414 1.00 30.44 C ATOM 530 CE1 TYR A 34 -0.697 -24.517 3.754 1.00 10.55 C ATOM 531 CE2 TYR A 34 0.105 -25.968 2.029 1.00 3.11 C ATOM 532 CZ TYR A 34 0.159 -24.765 2.702 1.00 40.01 C ATOM 533 OH TYR A 34 1.072 -23.808 2.322 1.00 11.00 O ATOM 0 H TYR A 34 -4.553 -29.145 4.698 1.00 72.00 H new ATOM 0 HA TYR A 34 -4.184 -26.362 4.564 1.00 52.10 H new ATOM 0 HB2 TYR A 34 -2.421 -28.124 4.878 1.00 62.05 H new ATOM 0 HB3 TYR A 34 -2.626 -28.595 3.203 1.00 62.05 H new ATOM 0 HD1 TYR A 34 -2.278 -25.283 4.960 1.00 70.43 H new ATOM 0 HD2 TYR A 34 -0.853 -27.865 1.884 1.00 30.44 H new ATOM 0 HE1 TYR A 34 -0.653 -23.574 4.278 1.00 10.55 H new ATOM 0 HE2 TYR A 34 0.777 -26.160 1.206 1.00 3.11 H new ATOM 0 HH TYR A 34 0.773 -23.383 1.491 1.00 11.00 H new ATOM 543 N VAL A 35 -5.062 -27.825 1.762 1.00 52.12 N ATOM 544 CA VAL A 35 -5.524 -27.580 0.401 1.00 73.02 C ATOM 545 C VAL A 35 -6.796 -26.740 0.395 1.00 14.12 C ATOM 546 O VAL A 35 -6.952 -25.835 -0.426 1.00 14.12 O ATOM 547 CB VAL A 35 -5.790 -28.900 -0.347 1.00 54.35 C ATOM 548 CG1 VAL A 35 -6.594 -28.643 -1.613 1.00 70.32 C ATOM 549 CG2 VAL A 35 -4.480 -29.602 -0.671 1.00 12.20 C ATOM 0 H VAL A 35 -5.146 -28.795 2.068 1.00 52.12 H new ATOM 0 HA VAL A 35 -4.730 -27.035 -0.110 1.00 73.02 H new ATOM 0 HB VAL A 35 -6.375 -29.553 0.300 1.00 54.35 H new ATOM 0 HG11 VAL A 35 -6.772 -29.587 -2.129 1.00 70.32 H new ATOM 0 HG12 VAL A 35 -7.548 -28.186 -1.351 1.00 70.32 H new ATOM 0 HG13 VAL A 35 -6.038 -27.972 -2.267 1.00 70.32 H new ATOM 0 HG21 VAL A 35 -4.687 -30.533 -1.199 1.00 12.20 H new ATOM 0 HG22 VAL A 35 -3.867 -28.956 -1.300 1.00 12.20 H new ATOM 0 HG23 VAL A 35 -3.946 -29.821 0.254 1.00 12.20 H new ATOM 559 N LEU A 36 -7.704 -27.044 1.316 1.00 22.34 N ATOM 560 CA LEU A 36 -8.964 -26.317 1.419 1.00 40.42 C ATOM 561 C LEU A 36 -8.717 -24.834 1.679 1.00 31.14 C ATOM 562 O LEU A 36 -9.289 -23.972 1.012 1.00 54.43 O ATOM 563 CB LEU A 36 -9.826 -26.906 2.536 1.00 15.24 C ATOM 564 CG LEU A 36 -10.929 -27.870 2.096 1.00 25.12 C ATOM 565 CD1 LEU A 36 -11.925 -27.164 1.190 1.00 41.11 C ATOM 566 CD2 LEU A 36 -10.330 -29.080 1.393 1.00 4.43 C ATOM 0 H LEU A 36 -7.591 -27.790 2.003 1.00 22.34 H new ATOM 0 HA LEU A 36 -9.492 -26.418 0.471 1.00 40.42 H new ATOM 0 HB2 LEU A 36 -9.173 -27.428 3.235 1.00 15.24 H new ATOM 0 HB3 LEU A 36 -10.287 -26.084 3.084 1.00 15.24 H new ATOM 0 HG LEU A 36 -11.459 -28.216 2.984 1.00 25.12 H new ATOM 0 HD11 LEU A 36 -12.702 -27.866 0.887 1.00 41.11 H new ATOM 0 HD12 LEU A 36 -12.378 -26.330 1.727 1.00 41.11 H new ATOM 0 HD13 LEU A 36 -11.410 -26.789 0.306 1.00 41.11 H new ATOM 0 HD21 LEU A 36 -11.129 -29.755 1.087 1.00 4.43 H new ATOM 0 HD22 LEU A 36 -9.775 -28.752 0.514 1.00 4.43 H new ATOM 0 HD23 LEU A 36 -9.657 -29.600 2.074 1.00 4.43 H new ATOM 578 N LEU A 37 -7.860 -24.545 2.652 1.00 14.44 N ATOM 579 CA LEU A 37 -7.535 -23.166 3.000 1.00 11.33 C ATOM 580 C LEU A 37 -6.592 -22.552 1.970 1.00 21.33 C ATOM 581 O LEU A 37 -6.613 -21.344 1.738 1.00 24.05 O ATOM 582 CB LEU A 37 -6.899 -23.106 4.390 1.00 12.02 C ATOM 583 CG LEU A 37 -7.870 -23.045 5.570 1.00 3.03 C ATOM 584 CD1 LEU A 37 -8.677 -21.757 5.532 1.00 44.53 C ATOM 585 CD2 LEU A 37 -8.793 -24.255 5.565 1.00 43.13 C ATOM 0 H LEU A 37 -7.378 -25.247 3.214 1.00 14.44 H new ATOM 0 HA LEU A 37 -8.461 -22.591 3.006 1.00 11.33 H new ATOM 0 HB2 LEU A 37 -6.262 -23.982 4.514 1.00 12.02 H new ATOM 0 HB3 LEU A 37 -6.250 -22.231 4.433 1.00 12.02 H new ATOM 0 HG LEU A 37 -7.290 -23.059 6.493 1.00 3.03 H new ATOM 0 HD11 LEU A 37 -9.362 -21.732 6.379 1.00 44.53 H new ATOM 0 HD12 LEU A 37 -8.002 -20.903 5.586 1.00 44.53 H new ATOM 0 HD13 LEU A 37 -9.246 -21.712 4.604 1.00 44.53 H new ATOM 0 HD21 LEU A 37 -9.477 -24.194 6.412 1.00 43.13 H new ATOM 0 HD22 LEU A 37 -9.365 -24.273 4.637 1.00 43.13 H new ATOM 0 HD23 LEU A 37 -8.199 -25.166 5.643 1.00 43.13 H new ATOM 597 N GLU A 38 -5.768 -23.394 1.354 1.00 21.34 N ATOM 598 CA GLU A 38 -4.818 -22.934 0.348 1.00 55.00 C ATOM 599 C GLU A 38 -5.530 -22.157 -0.756 1.00 1.21 C ATOM 600 O GLU A 38 -5.129 -21.046 -1.106 1.00 50.02 O ATOM 601 CB GLU A 38 -4.064 -24.121 -0.254 1.00 62.10 C ATOM 602 CG GLU A 38 -2.673 -24.316 0.327 1.00 73.14 C ATOM 603 CD GLU A 38 -1.575 -23.966 -0.659 1.00 32.02 C ATOM 604 OE1 GLU A 38 -1.588 -24.516 -1.780 1.00 25.41 O ATOM 605 OE2 GLU A 38 -0.704 -23.143 -0.309 1.00 50.44 O ATOM 0 H GLU A 38 -5.739 -24.398 1.534 1.00 21.34 H new ATOM 0 HA GLU A 38 -4.105 -22.269 0.835 1.00 55.00 H new ATOM 0 HB2 GLU A 38 -4.646 -25.029 -0.095 1.00 62.10 H new ATOM 0 HB3 GLU A 38 -3.982 -23.980 -1.332 1.00 62.10 H new ATOM 0 HG2 GLU A 38 -2.566 -23.698 1.219 1.00 73.14 H new ATOM 0 HG3 GLU A 38 -2.557 -25.353 0.642 1.00 73.14 H new ATOM 612 N LEU A 39 -6.587 -22.749 -1.301 1.00 10.43 N ATOM 613 CA LEU A 39 -7.355 -22.113 -2.366 1.00 33.13 C ATOM 614 C LEU A 39 -8.290 -21.048 -1.802 1.00 33.13 C ATOM 615 O LEU A 39 -8.436 -19.968 -2.375 1.00 5.51 O ATOM 616 CB LEU A 39 -8.162 -23.161 -3.134 1.00 71.04 C ATOM 617 CG LEU A 39 -7.445 -23.833 -4.306 1.00 74.20 C ATOM 618 CD1 LEU A 39 -8.322 -24.914 -4.919 1.00 31.32 C ATOM 619 CD2 LEU A 39 -7.055 -22.802 -5.355 1.00 73.10 C ATOM 0 H LEU A 39 -6.932 -23.668 -1.023 1.00 10.43 H new ATOM 0 HA LEU A 39 -6.654 -21.631 -3.048 1.00 33.13 H new ATOM 0 HB2 LEU A 39 -8.475 -23.935 -2.433 1.00 71.04 H new ATOM 0 HB3 LEU A 39 -9.068 -22.688 -3.512 1.00 71.04 H new ATOM 0 HG LEU A 39 -6.535 -24.301 -3.930 1.00 74.20 H new ATOM 0 HD11 LEU A 39 -7.796 -25.381 -5.751 1.00 31.32 H new ATOM 0 HD12 LEU A 39 -8.551 -25.668 -4.165 1.00 31.32 H new ATOM 0 HD13 LEU A 39 -9.249 -24.469 -5.280 1.00 31.32 H new ATOM 0 HD21 LEU A 39 -6.546 -23.298 -6.181 1.00 73.10 H new ATOM 0 HD22 LEU A 39 -7.951 -22.305 -5.727 1.00 73.10 H new ATOM 0 HD23 LEU A 39 -6.388 -22.064 -4.909 1.00 73.10 H new ATOM 631 N LEU A 40 -8.921 -21.359 -0.675 1.00 3.25 N ATOM 632 CA LEU A 40 -9.841 -20.427 -0.031 1.00 24.54 C ATOM 633 C LEU A 40 -9.161 -19.088 0.236 1.00 32.24 C ATOM 634 O LEU A 40 -9.696 -18.031 -0.099 1.00 13.52 O ATOM 635 CB LEU A 40 -10.361 -21.019 1.281 1.00 52.43 C ATOM 636 CG LEU A 40 -11.765 -21.623 1.234 1.00 61.22 C ATOM 637 CD1 LEU A 40 -12.153 -22.178 2.596 1.00 50.43 C ATOM 638 CD2 LEU A 40 -12.777 -20.586 0.770 1.00 51.10 C ATOM 0 H LEU A 40 -8.813 -22.249 -0.188 1.00 3.25 H new ATOM 0 HA LEU A 40 -10.681 -20.259 -0.705 1.00 24.54 H new ATOM 0 HB2 LEU A 40 -9.665 -21.792 1.609 1.00 52.43 H new ATOM 0 HB3 LEU A 40 -10.349 -20.236 2.040 1.00 52.43 H new ATOM 0 HG LEU A 40 -11.763 -22.444 0.517 1.00 61.22 H new ATOM 0 HD11 LEU A 40 -13.155 -22.604 2.543 1.00 50.43 H new ATOM 0 HD12 LEU A 40 -11.444 -22.953 2.888 1.00 50.43 H new ATOM 0 HD13 LEU A 40 -12.138 -21.376 3.334 1.00 50.43 H new ATOM 0 HD21 LEU A 40 -13.770 -21.034 0.743 1.00 51.10 H new ATOM 0 HD22 LEU A 40 -12.778 -19.743 1.461 1.00 51.10 H new ATOM 0 HD23 LEU A 40 -12.509 -20.237 -0.227 1.00 51.10 H new ATOM 650 N LEU A 41 -7.979 -19.140 0.840 1.00 62.53 N ATOM 651 CA LEU A 41 -7.224 -17.931 1.150 1.00 60.31 C ATOM 652 C LEU A 41 -6.622 -17.326 -0.114 1.00 62.01 C ATOM 653 O LEU A 41 -6.581 -16.106 -0.270 1.00 42.01 O ATOM 654 CB LEU A 41 -6.116 -18.242 2.158 1.00 72.42 C ATOM 655 CG LEU A 41 -4.903 -18.995 1.611 1.00 71.52 C ATOM 656 CD1 LEU A 41 -3.861 -18.020 1.087 1.00 41.32 C ATOM 657 CD2 LEU A 41 -4.304 -19.893 2.684 1.00 72.13 C ATOM 0 H LEU A 41 -7.523 -20.007 1.125 1.00 62.53 H new ATOM 0 HA LEU A 41 -7.911 -17.206 1.587 1.00 60.31 H new ATOM 0 HB2 LEU A 41 -5.771 -17.302 2.590 1.00 72.42 H new ATOM 0 HB3 LEU A 41 -6.546 -18.827 2.971 1.00 72.42 H new ATOM 0 HG LEU A 41 -5.232 -19.622 0.783 1.00 71.52 H new ATOM 0 HD11 LEU A 41 -3.005 -18.574 0.702 1.00 41.32 H new ATOM 0 HD12 LEU A 41 -4.294 -17.420 0.287 1.00 41.32 H new ATOM 0 HD13 LEU A 41 -3.535 -17.366 1.896 1.00 41.32 H new ATOM 0 HD21 LEU A 41 -3.442 -20.421 2.277 1.00 72.13 H new ATOM 0 HD22 LEU A 41 -3.990 -19.286 3.533 1.00 72.13 H new ATOM 0 HD23 LEU A 41 -5.051 -20.616 3.012 1.00 72.13 H new ATOM 669 N GLN A 42 -6.158 -18.188 -1.014 1.00 1.44 N ATOM 670 CA GLN A 42 -5.559 -17.737 -2.265 1.00 15.04 C ATOM 671 C GLN A 42 -6.565 -16.946 -3.095 1.00 61.21 C ATOM 672 O GLN A 42 -6.213 -15.956 -3.736 1.00 2.54 O ATOM 673 CB GLN A 42 -5.045 -18.933 -3.068 1.00 3.41 C ATOM 674 CG GLN A 42 -4.505 -18.558 -4.439 1.00 10.43 C ATOM 675 CD GLN A 42 -3.602 -19.626 -5.023 1.00 35.41 C ATOM 676 OE1 GLN A 42 -3.511 -20.735 -4.494 1.00 43.34 O ATOM 677 NE2 GLN A 42 -2.930 -19.299 -6.120 1.00 2.31 N ATOM 0 H GLN A 42 -6.185 -19.201 -0.900 1.00 1.44 H new ATOM 0 HA GLN A 42 -4.721 -17.083 -2.024 1.00 15.04 H new ATOM 0 HB2 GLN A 42 -4.258 -19.430 -2.500 1.00 3.41 H new ATOM 0 HB3 GLN A 42 -5.854 -19.653 -3.190 1.00 3.41 H new ATOM 0 HG2 GLN A 42 -5.339 -18.382 -5.118 1.00 10.43 H new ATOM 0 HG3 GLN A 42 -3.952 -17.622 -4.364 1.00 10.43 H new ATOM 0 HE21 GLN A 42 -3.036 -18.369 -6.524 1.00 2.31 H new ATOM 0 HE22 GLN A 42 -2.308 -19.978 -6.559 1.00 2.31 H new ATOM 686 N ARG A 43 -7.817 -17.391 -3.080 1.00 12.20 N ATOM 687 CA ARG A 43 -8.873 -16.725 -3.833 1.00 73.32 C ATOM 688 C ARG A 43 -9.821 -15.980 -2.898 1.00 42.51 C ATOM 689 O ARG A 43 -10.978 -15.730 -3.238 1.00 20.12 O ATOM 690 CB ARG A 43 -9.656 -17.744 -4.664 1.00 32.04 C ATOM 691 CG ARG A 43 -8.796 -18.512 -5.654 1.00 33.43 C ATOM 692 CD ARG A 43 -8.031 -17.573 -6.573 1.00 21.41 C ATOM 693 NE ARG A 43 -7.441 -18.279 -7.708 1.00 15.41 N ATOM 694 CZ ARG A 43 -6.780 -17.672 -8.687 1.00 54.32 C ATOM 695 NH1 ARG A 43 -6.625 -16.355 -8.670 1.00 60.11 N ATOM 696 NH2 ARG A 43 -6.273 -18.382 -9.686 1.00 63.13 N ATOM 0 H ARG A 43 -8.125 -18.209 -2.555 1.00 12.20 H new ATOM 0 HA ARG A 43 -8.407 -16.001 -4.502 1.00 73.32 H new ATOM 0 HB2 ARG A 43 -10.142 -18.452 -3.992 1.00 32.04 H new ATOM 0 HB3 ARG A 43 -10.447 -17.226 -5.207 1.00 32.04 H new ATOM 0 HG2 ARG A 43 -8.093 -19.145 -5.112 1.00 33.43 H new ATOM 0 HG3 ARG A 43 -9.426 -19.172 -6.250 1.00 33.43 H new ATOM 0 HD2 ARG A 43 -8.703 -16.796 -6.939 1.00 21.41 H new ATOM 0 HD3 ARG A 43 -7.244 -17.074 -6.008 1.00 21.41 H new ATOM 0 HE ARG A 43 -7.542 -19.293 -7.751 1.00 15.41 H new ATOM 0 HH11 ARG A 43 -7.014 -15.806 -7.904 1.00 60.11 H new ATOM 0 HH12 ARG A 43 -6.117 -15.892 -9.423 1.00 60.11 H new ATOM 0 HH21 ARG A 43 -6.391 -19.395 -9.703 1.00 63.13 H new ATOM 0 HH22 ARG A 43 -5.766 -17.915 -10.437 1.00 63.13 H new ATOM 710 N THR A 44 -9.322 -15.626 -1.717 1.00 52.15 N ATOM 711 CA THR A 44 -10.124 -14.911 -0.733 1.00 3.54 C ATOM 712 C THR A 44 -10.799 -13.693 -1.353 1.00 3.40 C ATOM 713 O THR A 44 -10.171 -12.928 -2.085 1.00 30.25 O ATOM 714 CB THR A 44 -9.268 -14.455 0.464 1.00 1.13 C ATOM 715 OG1 THR A 44 -10.110 -13.932 1.498 1.00 42.13 O ATOM 716 CG2 THR A 44 -8.262 -13.396 0.038 1.00 21.34 C ATOM 0 H THR A 44 -8.366 -15.823 -1.420 1.00 52.15 H new ATOM 0 HA THR A 44 -10.887 -15.606 -0.382 1.00 3.54 H new ATOM 0 HB THR A 44 -8.723 -15.320 0.843 1.00 1.13 H new ATOM 0 HG1 THR A 44 -9.558 -13.646 2.256 1.00 42.13 H new ATOM 0 HG21 THR A 44 -7.669 -13.090 0.900 1.00 21.34 H new ATOM 0 HG22 THR A 44 -7.604 -13.807 -0.728 1.00 21.34 H new ATOM 0 HG23 THR A 44 -8.791 -12.532 -0.364 1.00 21.34 H new ATOM 724 N GLY A 45 -12.083 -13.517 -1.055 1.00 63.31 N ATOM 725 CA GLY A 45 -12.821 -12.389 -1.592 1.00 34.32 C ATOM 726 C GLY A 45 -13.756 -12.790 -2.716 1.00 32.34 C ATOM 727 O GLY A 45 -14.647 -12.029 -3.091 1.00 70.22 O ATOM 0 H GLY A 45 -12.625 -14.135 -0.451 1.00 63.31 H new ATOM 0 HA2 GLY A 45 -13.397 -11.922 -0.793 1.00 34.32 H new ATOM 0 HA3 GLY A 45 -12.119 -11.640 -1.958 1.00 34.32 H new ATOM 731 N GLU A 46 -13.552 -13.988 -3.254 1.00 62.34 N ATOM 732 CA GLU A 46 -14.383 -14.487 -4.344 1.00 43.00 C ATOM 733 C GLU A 46 -14.713 -15.963 -4.145 1.00 31.35 C ATOM 734 O GLU A 46 -13.946 -16.706 -3.532 1.00 5.41 O ATOM 735 CB GLU A 46 -13.676 -14.288 -5.686 1.00 65.23 C ATOM 736 CG GLU A 46 -12.199 -14.645 -5.655 1.00 60.32 C ATOM 737 CD GLU A 46 -11.542 -14.531 -7.017 1.00 52.31 C ATOM 738 OE1 GLU A 46 -11.041 -13.435 -7.345 1.00 11.15 O ATOM 739 OE2 GLU A 46 -11.529 -15.538 -7.755 1.00 74.05 O ATOM 0 H GLU A 46 -12.819 -14.631 -2.953 1.00 62.34 H new ATOM 0 HA GLU A 46 -15.315 -13.921 -4.345 1.00 43.00 H new ATOM 0 HB2 GLU A 46 -14.172 -14.896 -6.442 1.00 65.23 H new ATOM 0 HB3 GLU A 46 -13.783 -13.248 -5.993 1.00 65.23 H new ATOM 0 HG2 GLU A 46 -11.685 -13.989 -4.952 1.00 60.32 H new ATOM 0 HG3 GLU A 46 -12.083 -15.663 -5.284 1.00 60.32 H new ATOM 746 N VAL A 47 -15.862 -16.382 -4.666 1.00 21.30 N ATOM 747 CA VAL A 47 -16.295 -17.769 -4.546 1.00 60.33 C ATOM 748 C VAL A 47 -15.670 -18.636 -5.634 1.00 12.10 C ATOM 749 O VAL A 47 -15.638 -18.255 -6.805 1.00 2.32 O ATOM 750 CB VAL A 47 -17.828 -17.888 -4.629 1.00 15.43 C ATOM 751 CG1 VAL A 47 -18.274 -19.303 -4.295 1.00 63.34 C ATOM 752 CG2 VAL A 47 -18.491 -16.879 -3.702 1.00 23.53 C ATOM 0 H VAL A 47 -16.510 -15.781 -5.175 1.00 21.30 H new ATOM 0 HA VAL A 47 -15.963 -18.120 -3.569 1.00 60.33 H new ATOM 0 HB VAL A 47 -18.137 -17.668 -5.651 1.00 15.43 H new ATOM 0 HG11 VAL A 47 -19.360 -19.367 -4.359 1.00 63.34 H new ATOM 0 HG12 VAL A 47 -17.827 -20.002 -5.002 1.00 63.34 H new ATOM 0 HG13 VAL A 47 -17.955 -19.556 -3.284 1.00 63.34 H new ATOM 0 HG21 VAL A 47 -19.574 -16.977 -3.773 1.00 23.53 H new ATOM 0 HG22 VAL A 47 -18.176 -17.066 -2.675 1.00 23.53 H new ATOM 0 HG23 VAL A 47 -18.198 -15.870 -3.993 1.00 23.53 H new ATOM 762 N LEU A 48 -15.175 -19.804 -5.240 1.00 51.02 N ATOM 763 CA LEU A 48 -14.551 -20.727 -6.182 1.00 1.11 C ATOM 764 C LEU A 48 -15.319 -22.043 -6.244 1.00 64.41 C ATOM 765 O LEU A 48 -16.082 -22.388 -5.342 1.00 75.21 O ATOM 766 CB LEU A 48 -13.098 -20.989 -5.782 1.00 62.12 C ATOM 767 CG LEU A 48 -12.792 -20.930 -4.285 1.00 53.41 C ATOM 768 CD1 LEU A 48 -11.629 -21.846 -3.941 1.00 23.31 C ATOM 769 CD2 LEU A 48 -12.492 -19.500 -3.859 1.00 22.14 C ATOM 0 H LEU A 48 -15.193 -20.134 -4.275 1.00 51.02 H new ATOM 0 HA LEU A 48 -14.572 -20.269 -7.171 1.00 1.11 H new ATOM 0 HB2 LEU A 48 -12.812 -21.974 -6.152 1.00 62.12 H new ATOM 0 HB3 LEU A 48 -12.465 -20.261 -6.291 1.00 62.12 H new ATOM 0 HG LEU A 48 -13.671 -21.274 -3.740 1.00 53.41 H new ATOM 0 HD11 LEU A 48 -11.426 -21.790 -2.871 1.00 23.31 H new ATOM 0 HD12 LEU A 48 -11.882 -22.872 -4.210 1.00 23.31 H new ATOM 0 HD13 LEU A 48 -10.744 -21.534 -4.495 1.00 23.31 H new ATOM 0 HD21 LEU A 48 -12.276 -19.476 -2.791 1.00 22.14 H new ATOM 0 HD22 LEU A 48 -11.629 -19.129 -4.412 1.00 22.14 H new ATOM 0 HD23 LEU A 48 -13.356 -18.869 -4.069 1.00 22.14 H new ATOM 781 N PRO A 49 -15.111 -22.799 -7.333 1.00 10.02 N ATOM 782 CA PRO A 49 -15.772 -24.091 -7.537 1.00 74.15 C ATOM 783 C PRO A 49 -15.264 -25.161 -6.578 1.00 22.24 C ATOM 784 O PRO A 49 -14.126 -25.100 -6.111 1.00 51.12 O ATOM 785 CB PRO A 49 -15.409 -24.451 -8.980 1.00 53.23 C ATOM 786 CG PRO A 49 -14.136 -23.724 -9.243 1.00 3.11 C ATOM 787 CD PRO A 49 -14.214 -22.450 -8.447 1.00 72.34 C ATOM 0 HA PRO A 49 -16.845 -24.033 -7.354 1.00 74.15 H new ATOM 0 HB2 PRO A 49 -15.282 -25.527 -9.100 1.00 53.23 H new ATOM 0 HB3 PRO A 49 -16.191 -24.143 -9.674 1.00 53.23 H new ATOM 0 HG2 PRO A 49 -13.276 -24.321 -8.940 1.00 3.11 H new ATOM 0 HG3 PRO A 49 -14.019 -23.513 -10.306 1.00 3.11 H new ATOM 0 HD2 PRO A 49 -13.232 -22.138 -8.090 1.00 72.34 H new ATOM 0 HD3 PRO A 49 -14.613 -21.628 -9.042 1.00 72.34 H new ATOM 795 N ARG A 50 -16.113 -26.141 -6.287 1.00 14.11 N ATOM 796 CA ARG A 50 -15.749 -27.224 -5.382 1.00 34.33 C ATOM 797 C ARG A 50 -14.932 -28.288 -6.108 1.00 70.43 C ATOM 798 O ARG A 50 -14.068 -28.934 -5.515 1.00 42.12 O ATOM 799 CB ARG A 50 -17.005 -27.855 -4.777 1.00 22.25 C ATOM 800 CG ARG A 50 -16.711 -28.998 -3.819 1.00 22.32 C ATOM 801 CD ARG A 50 -17.870 -29.980 -3.750 1.00 14.42 C ATOM 802 NE ARG A 50 -18.519 -29.969 -2.441 1.00 71.34 N ATOM 803 CZ ARG A 50 -19.423 -29.067 -2.076 1.00 44.41 C ATOM 804 NH1 ARG A 50 -19.783 -28.106 -2.917 1.00 24.44 N ATOM 805 NH2 ARG A 50 -19.968 -29.124 -0.868 1.00 13.50 N ATOM 0 H ARG A 50 -17.058 -26.207 -6.665 1.00 14.11 H new ATOM 0 HA ARG A 50 -15.139 -26.805 -4.582 1.00 34.33 H new ATOM 0 HB2 ARG A 50 -17.570 -27.086 -4.250 1.00 22.25 H new ATOM 0 HB3 ARG A 50 -17.641 -28.222 -5.582 1.00 22.25 H new ATOM 0 HG2 ARG A 50 -15.809 -29.520 -4.140 1.00 22.32 H new ATOM 0 HG3 ARG A 50 -16.512 -28.598 -2.825 1.00 22.32 H new ATOM 0 HD2 ARG A 50 -18.601 -29.732 -4.519 1.00 14.42 H new ATOM 0 HD3 ARG A 50 -17.507 -30.985 -3.966 1.00 14.42 H new ATOM 0 HE ARG A 50 -18.264 -30.694 -1.770 1.00 71.34 H new ATOM 0 HH11 ARG A 50 -19.365 -28.059 -3.846 1.00 24.44 H new ATOM 0 HH12 ARG A 50 -20.477 -27.415 -2.634 1.00 24.44 H new ATOM 0 HH21 ARG A 50 -19.693 -29.861 -0.219 1.00 13.50 H new ATOM 0 HH22 ARG A 50 -20.662 -28.431 -0.588 1.00 13.50 H new ATOM 819 N SER A 51 -15.212 -28.466 -7.395 1.00 50.14 N ATOM 820 CA SER A 51 -14.506 -29.455 -8.202 1.00 51.50 C ATOM 821 C SER A 51 -13.011 -29.154 -8.244 1.00 41.21 C ATOM 822 O SER A 51 -12.181 -30.055 -8.118 1.00 4.10 O ATOM 823 CB SER A 51 -15.072 -29.483 -9.623 1.00 53.20 C ATOM 824 OG SER A 51 -14.617 -28.372 -10.376 1.00 12.34 O ATOM 0 H SER A 51 -15.923 -27.938 -7.902 1.00 50.14 H new ATOM 0 HA SER A 51 -14.650 -30.433 -7.742 1.00 51.50 H new ATOM 0 HB2 SER A 51 -14.775 -30.408 -10.118 1.00 53.20 H new ATOM 0 HB3 SER A 51 -16.161 -29.478 -9.584 1.00 53.20 H new ATOM 0 HG SER A 51 -14.992 -28.414 -11.281 1.00 12.34 H new ATOM 830 N LEU A 52 -12.675 -27.881 -8.422 1.00 61.14 N ATOM 831 CA LEU A 52 -11.280 -27.459 -8.481 1.00 64.23 C ATOM 832 C LEU A 52 -10.543 -27.834 -7.199 1.00 42.14 C ATOM 833 O LEU A 52 -9.495 -28.479 -7.240 1.00 44.24 O ATOM 834 CB LEU A 52 -11.192 -25.949 -8.711 1.00 31.43 C ATOM 835 CG LEU A 52 -9.786 -25.380 -8.904 1.00 30.25 C ATOM 836 CD1 LEU A 52 -9.057 -26.122 -10.013 1.00 54.14 C ATOM 837 CD2 LEU A 52 -9.851 -23.891 -9.208 1.00 42.32 C ATOM 0 H LEU A 52 -13.350 -27.123 -8.528 1.00 61.14 H new ATOM 0 HA LEU A 52 -10.805 -27.975 -9.315 1.00 64.23 H new ATOM 0 HB2 LEU A 52 -11.787 -25.700 -9.590 1.00 31.43 H new ATOM 0 HB3 LEU A 52 -11.653 -25.445 -7.861 1.00 31.43 H new ATOM 0 HG LEU A 52 -9.229 -25.517 -7.977 1.00 30.25 H new ATOM 0 HD11 LEU A 52 -8.058 -25.703 -10.136 1.00 54.14 H new ATOM 0 HD12 LEU A 52 -8.978 -27.178 -9.754 1.00 54.14 H new ATOM 0 HD13 LEU A 52 -9.611 -26.018 -10.946 1.00 54.14 H new ATOM 0 HD21 LEU A 52 -8.841 -23.503 -9.342 1.00 42.32 H new ATOM 0 HD22 LEU A 52 -10.426 -23.731 -10.120 1.00 42.32 H new ATOM 0 HD23 LEU A 52 -10.332 -23.371 -8.380 1.00 42.32 H new ATOM 849 N ILE A 53 -11.099 -27.427 -6.063 1.00 62.42 N ATOM 850 CA ILE A 53 -10.496 -27.723 -4.770 1.00 30.55 C ATOM 851 C ILE A 53 -10.249 -29.220 -4.608 1.00 12.54 C ATOM 852 O ILE A 53 -9.155 -29.642 -4.233 1.00 52.33 O ATOM 853 CB ILE A 53 -11.382 -27.232 -3.610 1.00 34.32 C ATOM 854 CG1 ILE A 53 -11.642 -25.730 -3.738 1.00 50.13 C ATOM 855 CG2 ILE A 53 -10.730 -27.550 -2.273 1.00 25.11 C ATOM 856 CD1 ILE A 53 -12.815 -25.247 -2.914 1.00 41.33 C ATOM 0 H ILE A 53 -11.966 -26.892 -6.012 1.00 62.42 H new ATOM 0 HA ILE A 53 -9.543 -27.194 -4.738 1.00 30.55 H new ATOM 0 HB ILE A 53 -12.338 -27.753 -3.658 1.00 34.32 H new ATOM 0 HG12 ILE A 53 -10.747 -25.187 -3.434 1.00 50.13 H new ATOM 0 HG13 ILE A 53 -11.821 -25.488 -4.786 1.00 50.13 H new ATOM 0 HG21 ILE A 53 -11.369 -27.197 -1.464 1.00 25.11 H new ATOM 0 HG22 ILE A 53 -10.592 -28.627 -2.182 1.00 25.11 H new ATOM 0 HG23 ILE A 53 -9.761 -27.054 -2.214 1.00 25.11 H new ATOM 0 HD11 ILE A 53 -12.940 -24.173 -3.054 1.00 41.33 H new ATOM 0 HD12 ILE A 53 -13.721 -25.763 -3.233 1.00 41.33 H new ATOM 0 HD13 ILE A 53 -12.630 -25.457 -1.860 1.00 41.33 H new ATOM 868 N SER A 54 -11.273 -30.017 -4.894 1.00 33.12 N ATOM 869 CA SER A 54 -11.169 -31.467 -4.778 1.00 44.12 C ATOM 870 C SER A 54 -10.048 -32.003 -5.663 1.00 44.05 C ATOM 871 O SER A 54 -9.423 -33.016 -5.348 1.00 74.14 O ATOM 872 CB SER A 54 -12.495 -32.127 -5.159 1.00 61.25 C ATOM 873 OG SER A 54 -13.201 -31.343 -6.105 1.00 75.53 O ATOM 0 H SER A 54 -12.184 -29.683 -5.208 1.00 33.12 H new ATOM 0 HA SER A 54 -10.937 -31.708 -3.741 1.00 44.12 H new ATOM 0 HB2 SER A 54 -12.306 -33.118 -5.572 1.00 61.25 H new ATOM 0 HB3 SER A 54 -13.106 -32.264 -4.267 1.00 61.25 H new ATOM 0 HG SER A 54 -12.657 -31.236 -6.913 1.00 75.53 H new ATOM 879 N SER A 55 -9.798 -31.315 -6.773 1.00 72.12 N ATOM 880 CA SER A 55 -8.755 -31.723 -7.707 1.00 74.02 C ATOM 881 C SER A 55 -7.370 -31.455 -7.126 1.00 74.20 C ATOM 882 O SER A 55 -6.406 -32.153 -7.442 1.00 21.30 O ATOM 883 CB SER A 55 -8.915 -30.983 -9.037 1.00 64.50 C ATOM 884 OG SER A 55 -8.062 -31.529 -10.029 1.00 52.21 O ATOM 0 H SER A 55 -10.304 -30.473 -7.047 1.00 72.12 H new ATOM 0 HA SER A 55 -8.855 -32.794 -7.881 1.00 74.02 H new ATOM 0 HB2 SER A 55 -9.951 -31.045 -9.369 1.00 64.50 H new ATOM 0 HB3 SER A 55 -8.688 -29.926 -8.899 1.00 64.50 H new ATOM 0 HG SER A 55 -8.184 -31.041 -10.870 1.00 52.21 H new ATOM 890 N LEU A 56 -7.279 -30.439 -6.275 1.00 35.52 N ATOM 891 CA LEU A 56 -6.013 -30.078 -5.648 1.00 1.41 C ATOM 892 C LEU A 56 -5.613 -31.106 -4.595 1.00 63.53 C ATOM 893 O LEU A 56 -4.485 -31.100 -4.103 1.00 5.44 O ATOM 894 CB LEU A 56 -6.115 -28.691 -5.010 1.00 21.35 C ATOM 895 CG LEU A 56 -5.424 -27.553 -5.762 1.00 75.32 C ATOM 896 CD1 LEU A 56 -6.419 -26.817 -6.646 1.00 14.12 C ATOM 897 CD2 LEU A 56 -4.762 -26.592 -4.786 1.00 35.34 C ATOM 0 H LEU A 56 -8.067 -29.851 -6.004 1.00 35.52 H new ATOM 0 HA LEU A 56 -5.245 -30.061 -6.421 1.00 1.41 H new ATOM 0 HB2 LEU A 56 -7.170 -28.440 -4.902 1.00 21.35 H new ATOM 0 HB3 LEU A 56 -5.695 -28.743 -4.006 1.00 21.35 H new ATOM 0 HG LEU A 56 -4.650 -27.981 -6.399 1.00 75.32 H new ATOM 0 HD11 LEU A 56 -5.910 -26.010 -7.174 1.00 14.12 H new ATOM 0 HD12 LEU A 56 -6.846 -27.511 -7.370 1.00 14.12 H new ATOM 0 HD13 LEU A 56 -7.215 -26.401 -6.029 1.00 14.12 H new ATOM 0 HD21 LEU A 56 -4.275 -25.789 -5.340 1.00 35.34 H new ATOM 0 HD22 LEU A 56 -5.517 -26.170 -4.123 1.00 35.34 H new ATOM 0 HD23 LEU A 56 -4.019 -27.128 -4.196 1.00 35.34 H new ATOM 909 N VAL A 57 -6.545 -31.992 -4.256 1.00 45.22 N ATOM 910 CA VAL A 57 -6.288 -33.030 -3.265 1.00 13.43 C ATOM 911 C VAL A 57 -6.547 -34.417 -3.842 1.00 2.23 C ATOM 912 O VAL A 57 -5.612 -35.155 -4.152 1.00 41.13 O ATOM 913 CB VAL A 57 -7.162 -32.836 -2.011 1.00 70.11 C ATOM 914 CG1 VAL A 57 -6.350 -32.216 -0.884 1.00 63.14 C ATOM 915 CG2 VAL A 57 -8.377 -31.981 -2.336 1.00 54.01 C ATOM 0 H VAL A 57 -7.484 -32.011 -4.653 1.00 45.22 H new ATOM 0 HA VAL A 57 -5.238 -32.947 -2.984 1.00 13.43 H new ATOM 0 HB VAL A 57 -7.512 -33.813 -1.679 1.00 70.11 H new ATOM 0 HG11 VAL A 57 -6.984 -32.087 -0.007 1.00 63.14 H new ATOM 0 HG12 VAL A 57 -5.515 -32.871 -0.635 1.00 63.14 H new ATOM 0 HG13 VAL A 57 -5.968 -31.246 -1.202 1.00 63.14 H new ATOM 0 HG21 VAL A 57 -8.983 -31.854 -1.439 1.00 54.01 H new ATOM 0 HG22 VAL A 57 -8.050 -31.005 -2.694 1.00 54.01 H new ATOM 0 HG23 VAL A 57 -8.970 -32.470 -3.109 1.00 54.01 H new ATOM 925 N TRP A 58 -7.821 -34.764 -3.983 1.00 23.52 N ATOM 926 CA TRP A 58 -8.203 -36.064 -4.524 1.00 23.25 C ATOM 927 C TRP A 58 -8.201 -36.041 -6.048 1.00 71.20 C ATOM 928 O TRP A 58 -7.295 -36.576 -6.685 1.00 22.32 O ATOM 929 CB TRP A 58 -9.585 -36.467 -4.009 1.00 33.44 C ATOM 930 CG TRP A 58 -9.558 -37.052 -2.629 1.00 30.12 C ATOM 931 CD1 TRP A 58 -9.521 -36.366 -1.449 1.00 24.14 C ATOM 932 CD2 TRP A 58 -9.564 -38.442 -2.287 1.00 71.41 C ATOM 933 NE1 TRP A 58 -9.503 -37.246 -0.394 1.00 20.34 N ATOM 934 CE2 TRP A 58 -9.530 -38.526 -0.881 1.00 40.03 C ATOM 935 CE3 TRP A 58 -9.597 -39.625 -3.031 1.00 52.33 C ATOM 936 CZ2 TRP A 58 -9.527 -39.745 -0.208 1.00 43.23 C ATOM 937 CZ3 TRP A 58 -9.594 -40.834 -2.362 1.00 4.52 C ATOM 938 CH2 TRP A 58 -9.559 -40.886 -0.962 1.00 74.50 C ATOM 0 H TRP A 58 -8.607 -34.164 -3.731 1.00 23.52 H new ATOM 0 HA TRP A 58 -7.470 -36.799 -4.190 1.00 23.25 H new ATOM 0 HB2 TRP A 58 -10.235 -35.592 -4.012 1.00 33.44 H new ATOM 0 HB3 TRP A 58 -10.023 -37.192 -4.695 1.00 33.44 H new ATOM 0 HD1 TRP A 58 -9.508 -35.290 -1.358 1.00 24.14 H new ATOM 0 HE1 TRP A 58 -9.474 -36.988 0.592 1.00 20.34 H new ATOM 0 HE3 TRP A 58 -9.624 -39.595 -4.110 1.00 52.33 H new ATOM 0 HZ2 TRP A 58 -9.500 -39.788 0.871 1.00 43.23 H new ATOM 0 HZ3 TRP A 58 -9.619 -41.754 -2.927 1.00 4.52 H new ATOM 0 HH2 TRP A 58 -9.557 -41.847 -0.468 1.00 74.50 H new ATOM 949 N ASN A 59 -9.222 -35.418 -6.627 1.00 51.13 N ATOM 950 CA ASN A 59 -9.338 -35.326 -8.078 1.00 42.02 C ATOM 951 C ASN A 59 -10.562 -34.507 -8.476 1.00 34.45 C ATOM 952 O ASN A 59 -11.483 -34.324 -7.680 1.00 53.41 O ATOM 953 CB ASN A 59 -9.424 -36.724 -8.693 1.00 64.24 C ATOM 954 CG ASN A 59 -10.481 -37.584 -8.029 1.00 21.53 C ATOM 955 OD1 ASN A 59 -11.618 -37.153 -7.836 1.00 44.53 O ATOM 956 ND2 ASN A 59 -10.110 -38.809 -7.674 1.00 61.22 N ATOM 0 H ASN A 59 -9.981 -34.969 -6.114 1.00 51.13 H new ATOM 0 HA ASN A 59 -8.448 -34.823 -8.457 1.00 42.02 H new ATOM 0 HB2 ASN A 59 -9.646 -36.637 -9.757 1.00 64.24 H new ATOM 0 HB3 ASN A 59 -8.455 -37.215 -8.609 1.00 64.24 H new ATOM 0 HD21 ASN A 59 -10.778 -39.433 -7.222 1.00 61.22 H new ATOM 0 HD22 ASN A 59 -9.157 -39.125 -7.853 1.00 61.22 H new ATOM 963 N MET A 60 -10.565 -34.019 -9.711 1.00 52.15 N ATOM 964 CA MET A 60 -11.678 -33.221 -10.215 1.00 65.40 C ATOM 965 C MET A 60 -12.866 -34.109 -10.570 1.00 32.24 C ATOM 966 O MET A 60 -12.708 -35.146 -11.212 1.00 72.14 O ATOM 967 CB MET A 60 -11.242 -32.418 -11.442 1.00 15.31 C ATOM 968 CG MET A 60 -10.927 -33.280 -12.653 1.00 73.41 C ATOM 969 SD MET A 60 -9.808 -32.469 -13.811 1.00 74.53 S ATOM 970 CE MET A 60 -10.274 -33.266 -15.346 1.00 72.33 C ATOM 0 H MET A 60 -9.810 -34.161 -10.382 1.00 52.15 H new ATOM 0 HA MET A 60 -11.985 -32.532 -9.428 1.00 65.40 H new ATOM 0 HB2 MET A 60 -12.031 -31.713 -11.704 1.00 15.31 H new ATOM 0 HB3 MET A 60 -10.361 -31.829 -11.186 1.00 15.31 H new ATOM 0 HG2 MET A 60 -10.482 -34.218 -12.321 1.00 73.41 H new ATOM 0 HG3 MET A 60 -11.855 -33.532 -13.166 1.00 73.41 H new ATOM 0 HE1 MET A 60 -9.668 -32.869 -16.161 1.00 72.33 H new ATOM 0 HE2 MET A 60 -10.111 -34.340 -15.262 1.00 72.33 H new ATOM 0 HE3 MET A 60 -11.327 -33.074 -15.551 1.00 72.33 H new ATOM 980 N ASN A 61 -14.056 -33.695 -10.146 1.00 2.22 N ATOM 981 CA ASN A 61 -15.271 -34.454 -10.418 1.00 51.43 C ATOM 982 C ASN A 61 -16.237 -33.644 -11.278 1.00 0.42 C ATOM 983 O ASN A 61 -16.033 -32.451 -11.504 1.00 0.32 O ATOM 984 CB ASN A 61 -15.951 -34.855 -9.108 1.00 31.32 C ATOM 985 CG ASN A 61 -16.760 -36.131 -9.244 1.00 12.35 C ATOM 986 OD1 ASN A 61 -16.305 -37.107 -9.839 1.00 71.22 O ATOM 987 ND2 ASN A 61 -17.967 -36.127 -8.690 1.00 33.10 N ATOM 0 H ASN A 61 -14.204 -32.838 -9.613 1.00 2.22 H new ATOM 0 HA ASN A 61 -14.992 -35.355 -10.965 1.00 51.43 H new ATOM 0 HB2 ASN A 61 -15.194 -34.988 -8.335 1.00 31.32 H new ATOM 0 HB3 ASN A 61 -16.604 -34.047 -8.779 1.00 31.32 H new ATOM 0 HD21 ASN A 61 -18.558 -36.957 -8.748 1.00 33.10 H new ATOM 0 HD22 ASN A 61 -18.303 -35.294 -8.206 1.00 33.10 H new ATOM 994 N PHE A 62 -17.290 -34.300 -11.754 1.00 63.10 N ATOM 995 CA PHE A 62 -18.288 -33.642 -12.589 1.00 45.31 C ATOM 996 C PHE A 62 -19.147 -32.690 -11.762 1.00 4.11 C ATOM 997 O PHE A 62 -19.588 -31.650 -12.252 1.00 32.32 O ATOM 998 CB PHE A 62 -19.175 -34.682 -13.276 1.00 12.32 C ATOM 999 CG PHE A 62 -18.468 -35.457 -14.350 1.00 74.53 C ATOM 1000 CD1 PHE A 62 -17.991 -34.819 -15.484 1.00 21.23 C ATOM 1001 CD2 PHE A 62 -18.281 -36.825 -14.227 1.00 11.32 C ATOM 1002 CE1 PHE A 62 -17.341 -35.531 -16.474 1.00 41.01 C ATOM 1003 CE2 PHE A 62 -17.631 -37.542 -15.214 1.00 14.31 C ATOM 1004 CZ PHE A 62 -17.160 -36.894 -16.339 1.00 2.44 C ATOM 0 H PHE A 62 -17.474 -35.287 -11.576 1.00 63.10 H new ATOM 0 HA PHE A 62 -17.764 -33.063 -13.349 1.00 45.31 H new ATOM 0 HB2 PHE A 62 -19.553 -35.377 -12.527 1.00 12.32 H new ATOM 0 HB3 PHE A 62 -20.040 -34.180 -13.710 1.00 12.32 H new ATOM 0 HD1 PHE A 62 -18.129 -33.754 -15.595 1.00 21.23 H new ATOM 0 HD2 PHE A 62 -18.648 -37.337 -13.349 1.00 11.32 H new ATOM 0 HE1 PHE A 62 -16.975 -35.022 -17.353 1.00 41.01 H new ATOM 0 HE2 PHE A 62 -17.492 -38.607 -15.106 1.00 14.31 H new ATOM 0 HZ PHE A 62 -16.651 -37.452 -17.112 1.00 2.44 H new ATOM 1014 N ASP A 63 -19.380 -33.053 -10.506 1.00 23.54 N ATOM 1015 CA ASP A 63 -20.185 -32.233 -9.609 1.00 13.30 C ATOM 1016 C ASP A 63 -19.478 -32.034 -8.272 1.00 12.30 C ATOM 1017 O ASP A 63 -18.952 -30.957 -7.991 1.00 12.21 O ATOM 1018 CB ASP A 63 -21.554 -32.877 -9.385 1.00 72.01 C ATOM 1019 CG ASP A 63 -22.572 -32.450 -10.425 1.00 21.44 C ATOM 1020 OD1 ASP A 63 -22.645 -31.240 -10.722 1.00 42.51 O ATOM 1021 OD2 ASP A 63 -23.295 -33.328 -10.941 1.00 41.54 O ATOM 0 H ASP A 63 -19.022 -33.911 -10.086 1.00 23.54 H new ATOM 0 HA ASP A 63 -20.323 -31.257 -10.075 1.00 13.30 H new ATOM 0 HB2 ASP A 63 -21.450 -33.962 -9.407 1.00 72.01 H new ATOM 0 HB3 ASP A 63 -21.919 -32.612 -8.393 1.00 72.01 H new ATOM 1026 N SER A 64 -19.471 -33.079 -7.451 1.00 2.12 N ATOM 1027 CA SER A 64 -18.833 -33.017 -6.141 1.00 63.41 C ATOM 1028 C SER A 64 -18.362 -34.400 -5.701 1.00 31.33 C ATOM 1029 O SER A 64 -19.016 -35.407 -5.975 1.00 4.00 O ATOM 1030 CB SER A 64 -19.800 -32.442 -5.105 1.00 54.34 C ATOM 1031 OG SER A 64 -19.400 -32.781 -3.789 1.00 45.41 O ATOM 0 H SER A 64 -19.900 -33.978 -7.669 1.00 2.12 H new ATOM 0 HA SER A 64 -17.964 -32.363 -6.218 1.00 63.41 H new ATOM 0 HB2 SER A 64 -19.844 -31.358 -5.207 1.00 54.34 H new ATOM 0 HB3 SER A 64 -20.805 -32.821 -5.292 1.00 54.34 H new ATOM 0 HG SER A 64 -20.191 -33.001 -3.253 1.00 45.41 H new ATOM 1037 N ASP A 65 -17.224 -34.441 -5.016 1.00 52.34 N ATOM 1038 CA ASP A 65 -16.665 -35.699 -4.536 1.00 71.12 C ATOM 1039 C ASP A 65 -17.181 -36.025 -3.138 1.00 52.41 C ATOM 1040 O ASP A 65 -16.599 -35.607 -2.136 1.00 53.13 O ATOM 1041 CB ASP A 65 -15.137 -35.632 -4.527 1.00 31.14 C ATOM 1042 CG ASP A 65 -14.536 -35.925 -5.887 1.00 52.03 C ATOM 1043 OD1 ASP A 65 -15.135 -36.720 -6.641 1.00 62.30 O ATOM 1044 OD2 ASP A 65 -13.467 -35.359 -6.198 1.00 62.52 O ATOM 0 H ASP A 65 -16.671 -33.617 -4.781 1.00 52.34 H new ATOM 0 HA ASP A 65 -16.982 -36.491 -5.214 1.00 71.12 H new ATOM 0 HB2 ASP A 65 -14.822 -34.641 -4.200 1.00 31.14 H new ATOM 0 HB3 ASP A 65 -14.749 -36.346 -3.800 1.00 31.14 H new ATOM 1049 N THR A 66 -18.279 -36.773 -3.077 1.00 4.40 N ATOM 1050 CA THR A 66 -18.875 -37.152 -1.802 1.00 62.45 C ATOM 1051 C THR A 66 -18.860 -35.987 -0.820 1.00 33.12 C ATOM 1052 O THR A 66 -18.674 -36.178 0.381 1.00 4.00 O ATOM 1053 CB THR A 66 -18.138 -38.350 -1.172 1.00 54.43 C ATOM 1054 OG1 THR A 66 -18.824 -38.780 0.009 1.00 3.52 O ATOM 1055 CG2 THR A 66 -16.703 -37.981 -0.827 1.00 34.32 C ATOM 0 H THR A 66 -18.773 -37.128 -3.896 1.00 4.40 H new ATOM 0 HA THR A 66 -19.907 -37.436 -2.007 1.00 62.45 H new ATOM 0 HB THR A 66 -18.122 -39.163 -1.898 1.00 54.43 H new ATOM 0 HG1 THR A 66 -18.921 -38.024 0.625 1.00 3.52 H new ATOM 0 HG21 THR A 66 -16.202 -38.842 -0.384 1.00 34.32 H new ATOM 0 HG22 THR A 66 -16.176 -37.682 -1.733 1.00 34.32 H new ATOM 0 HG23 THR A 66 -16.701 -37.154 -0.116 1.00 34.32 H new ATOM 1063 N ASN A 67 -19.059 -34.779 -1.338 1.00 75.51 N ATOM 1064 CA ASN A 67 -19.069 -33.582 -0.505 1.00 74.41 C ATOM 1065 C ASN A 67 -17.898 -33.590 0.473 1.00 73.33 C ATOM 1066 O ASN A 67 -18.053 -33.253 1.646 1.00 10.34 O ATOM 1067 CB ASN A 67 -20.389 -33.481 0.263 1.00 62.21 C ATOM 1068 CG ASN A 67 -21.597 -33.549 -0.652 1.00 3.54 C ATOM 1069 OD1 ASN A 67 -21.466 -33.506 -1.875 1.00 31.40 O ATOM 1070 ND2 ASN A 67 -22.781 -33.653 -0.060 1.00 71.53 N ATOM 0 H ASN A 67 -19.215 -34.603 -2.331 1.00 75.51 H new ATOM 0 HA ASN A 67 -18.968 -32.715 -1.157 1.00 74.41 H new ATOM 0 HB2 ASN A 67 -20.444 -34.288 0.993 1.00 62.21 H new ATOM 0 HB3 ASN A 67 -20.411 -32.545 0.821 1.00 62.21 H new ATOM 0 HD21 ASN A 67 -23.630 -33.701 -0.623 1.00 71.53 H new ATOM 0 HD22 ASN A 67 -22.841 -33.685 0.958 1.00 71.53 H new ATOM 1077 N VAL A 68 -16.726 -33.978 -0.020 1.00 1.33 N ATOM 1078 CA VAL A 68 -15.528 -34.028 0.809 1.00 25.12 C ATOM 1079 C VAL A 68 -15.028 -32.626 1.140 1.00 54.05 C ATOM 1080 O VAL A 68 -14.431 -32.401 2.193 1.00 53.13 O ATOM 1081 CB VAL A 68 -14.398 -34.813 0.116 1.00 31.20 C ATOM 1082 CG1 VAL A 68 -13.918 -34.075 -1.125 1.00 33.35 C ATOM 1083 CG2 VAL A 68 -13.247 -35.055 1.081 1.00 15.43 C ATOM 0 H VAL A 68 -16.581 -34.262 -0.989 1.00 1.33 H new ATOM 0 HA VAL A 68 -15.804 -34.539 1.731 1.00 25.12 H new ATOM 0 HB VAL A 68 -14.790 -35.781 -0.195 1.00 31.20 H new ATOM 0 HG11 VAL A 68 -13.120 -34.645 -1.601 1.00 33.35 H new ATOM 0 HG12 VAL A 68 -14.747 -33.959 -1.823 1.00 33.35 H new ATOM 0 HG13 VAL A 68 -13.543 -33.092 -0.841 1.00 33.35 H new ATOM 0 HG21 VAL A 68 -12.458 -35.611 0.574 1.00 15.43 H new ATOM 0 HG22 VAL A 68 -12.854 -34.099 1.425 1.00 15.43 H new ATOM 0 HG23 VAL A 68 -13.604 -35.629 1.936 1.00 15.43 H new ATOM 1093 N ILE A 69 -15.277 -31.687 0.233 1.00 13.44 N ATOM 1094 CA ILE A 69 -14.854 -30.306 0.429 1.00 15.45 C ATOM 1095 C ILE A 69 -15.621 -29.653 1.575 1.00 31.30 C ATOM 1096 O ILE A 69 -15.038 -28.966 2.414 1.00 51.13 O ATOM 1097 CB ILE A 69 -15.053 -29.469 -0.848 1.00 73.13 C ATOM 1098 CG1 ILE A 69 -14.210 -30.036 -1.992 1.00 25.23 C ATOM 1099 CG2 ILE A 69 -14.695 -28.013 -0.590 1.00 24.44 C ATOM 1100 CD1 ILE A 69 -12.733 -30.114 -1.672 1.00 40.44 C ATOM 0 H ILE A 69 -15.769 -31.857 -0.644 1.00 13.44 H new ATOM 0 HA ILE A 69 -13.792 -30.334 0.674 1.00 15.45 H new ATOM 0 HB ILE A 69 -16.103 -29.518 -1.136 1.00 73.13 H new ATOM 0 HG12 ILE A 69 -14.573 -31.033 -2.241 1.00 25.23 H new ATOM 0 HG13 ILE A 69 -14.350 -29.416 -2.878 1.00 25.23 H new ATOM 0 HG21 ILE A 69 -14.841 -27.435 -1.503 1.00 24.44 H new ATOM 0 HG22 ILE A 69 -15.335 -27.615 0.198 1.00 24.44 H new ATOM 0 HG23 ILE A 69 -13.652 -27.944 -0.280 1.00 24.44 H new ATOM 0 HD11 ILE A 69 -12.197 -30.525 -2.527 1.00 40.44 H new ATOM 0 HD12 ILE A 69 -12.355 -29.115 -1.452 1.00 40.44 H new ATOM 0 HD13 ILE A 69 -12.582 -30.758 -0.806 1.00 40.44 H new ATOM 1112 N ASP A 70 -16.931 -29.875 1.605 1.00 45.00 N ATOM 1113 CA ASP A 70 -17.778 -29.311 2.650 1.00 63.34 C ATOM 1114 C ASP A 70 -17.521 -29.998 3.987 1.00 5.03 C ATOM 1115 O ASP A 70 -17.553 -29.361 5.040 1.00 21.13 O ATOM 1116 CB ASP A 70 -19.253 -29.447 2.268 1.00 4.50 C ATOM 1117 CG ASP A 70 -20.175 -29.307 3.463 1.00 20.11 C ATOM 1118 OD1 ASP A 70 -19.933 -28.411 4.299 1.00 43.34 O ATOM 1119 OD2 ASP A 70 -21.140 -30.094 3.563 1.00 45.34 O ATOM 0 H ASP A 70 -17.429 -30.441 0.918 1.00 45.00 H new ATOM 0 HA ASP A 70 -17.533 -28.254 2.752 1.00 63.34 H new ATOM 0 HB2 ASP A 70 -19.505 -28.688 1.527 1.00 4.50 H new ATOM 0 HB3 ASP A 70 -19.416 -30.417 1.799 1.00 4.50 H new ATOM 1124 N VAL A 71 -17.266 -31.302 3.938 1.00 10.22 N ATOM 1125 CA VAL A 71 -17.003 -32.075 5.146 1.00 73.42 C ATOM 1126 C VAL A 71 -15.597 -31.813 5.671 1.00 5.14 C ATOM 1127 O VAL A 71 -15.344 -31.907 6.872 1.00 21.01 O ATOM 1128 CB VAL A 71 -17.172 -33.585 4.893 1.00 65.32 C ATOM 1129 CG1 VAL A 71 -16.834 -34.378 6.147 1.00 54.15 C ATOM 1130 CG2 VAL A 71 -18.585 -33.892 4.422 1.00 33.03 C ATOM 0 H VAL A 71 -17.236 -31.845 3.075 1.00 10.22 H new ATOM 0 HA VAL A 71 -17.731 -31.755 5.892 1.00 73.42 H new ATOM 0 HB VAL A 71 -16.479 -33.883 4.106 1.00 65.32 H new ATOM 0 HG11 VAL A 71 -16.959 -35.443 5.949 1.00 54.15 H new ATOM 0 HG12 VAL A 71 -15.801 -34.181 6.434 1.00 54.15 H new ATOM 0 HG13 VAL A 71 -17.499 -34.079 6.957 1.00 54.15 H new ATOM 0 HG21 VAL A 71 -18.686 -34.963 4.248 1.00 33.03 H new ATOM 0 HG22 VAL A 71 -19.299 -33.579 5.184 1.00 33.03 H new ATOM 0 HG23 VAL A 71 -18.785 -33.354 3.495 1.00 33.03 H new ATOM 1140 N ALA A 72 -14.684 -31.483 4.764 1.00 43.33 N ATOM 1141 CA ALA A 72 -13.302 -31.204 5.136 1.00 53.21 C ATOM 1142 C ALA A 72 -13.179 -29.839 5.805 1.00 21.35 C ATOM 1143 O ALA A 72 -12.393 -29.662 6.736 1.00 31.15 O ATOM 1144 CB ALA A 72 -12.401 -31.277 3.912 1.00 0.23 C ATOM 0 H ALA A 72 -14.876 -31.402 3.766 1.00 43.33 H new ATOM 0 HA ALA A 72 -12.984 -31.961 5.853 1.00 53.21 H new ATOM 0 HB1 ALA A 72 -11.372 -31.067 4.204 1.00 0.23 H new ATOM 0 HB2 ALA A 72 -12.458 -32.275 3.477 1.00 0.23 H new ATOM 0 HB3 ALA A 72 -12.727 -30.542 3.176 1.00 0.23 H new ATOM 1150 N VAL A 73 -13.960 -28.877 5.325 1.00 3.31 N ATOM 1151 CA VAL A 73 -13.938 -27.528 5.878 1.00 40.44 C ATOM 1152 C VAL A 73 -14.692 -27.463 7.201 1.00 75.43 C ATOM 1153 O VAL A 73 -14.311 -26.725 8.109 1.00 30.54 O ATOM 1154 CB VAL A 73 -14.553 -26.510 4.899 1.00 72.15 C ATOM 1155 CG1 VAL A 73 -15.996 -26.876 4.584 1.00 23.22 C ATOM 1156 CG2 VAL A 73 -14.464 -25.102 5.468 1.00 63.32 C ATOM 0 H VAL A 73 -14.616 -29.006 4.555 1.00 3.31 H new ATOM 0 HA VAL A 73 -12.892 -27.273 6.047 1.00 40.44 H new ATOM 0 HB VAL A 73 -13.985 -26.538 3.969 1.00 72.15 H new ATOM 0 HG11 VAL A 73 -16.414 -26.146 3.891 1.00 23.22 H new ATOM 0 HG12 VAL A 73 -16.029 -27.867 4.131 1.00 23.22 H new ATOM 0 HG13 VAL A 73 -16.580 -26.878 5.504 1.00 23.22 H new ATOM 0 HG21 VAL A 73 -14.903 -24.396 4.763 1.00 63.32 H new ATOM 0 HG22 VAL A 73 -15.006 -25.056 6.412 1.00 63.32 H new ATOM 0 HG23 VAL A 73 -13.419 -24.843 5.637 1.00 63.32 H new ATOM 1166 N ARG A 74 -15.765 -28.242 7.302 1.00 0.33 N ATOM 1167 CA ARG A 74 -16.574 -28.273 8.515 1.00 52.13 C ATOM 1168 C ARG A 74 -15.867 -29.051 9.620 1.00 30.24 C ATOM 1169 O ARG A 74 -15.908 -28.665 10.789 1.00 51.03 O ATOM 1170 CB ARG A 74 -17.939 -28.902 8.226 1.00 3.55 C ATOM 1171 CG ARG A 74 -18.866 -28.003 7.424 1.00 21.32 C ATOM 1172 CD ARG A 74 -19.510 -26.942 8.302 1.00 54.10 C ATOM 1173 NE ARG A 74 -20.802 -26.507 7.776 1.00 23.13 N ATOM 1174 CZ ARG A 74 -20.936 -25.717 6.717 1.00 4.42 C ATOM 1175 NH1 ARG A 74 -19.863 -25.277 6.074 1.00 23.20 N ATOM 1176 NH2 ARG A 74 -22.145 -25.365 6.299 1.00 3.41 N ATOM 0 H ARG A 74 -16.094 -28.859 6.559 1.00 0.33 H new ATOM 0 HA ARG A 74 -16.718 -27.247 8.853 1.00 52.13 H new ATOM 0 HB2 ARG A 74 -17.792 -29.835 7.683 1.00 3.55 H new ATOM 0 HB3 ARG A 74 -18.420 -29.156 9.171 1.00 3.55 H new ATOM 0 HG2 ARG A 74 -18.305 -27.522 6.623 1.00 21.32 H new ATOM 0 HG3 ARG A 74 -19.642 -28.606 6.952 1.00 21.32 H new ATOM 0 HD2 ARG A 74 -19.643 -27.337 9.309 1.00 54.10 H new ATOM 0 HD3 ARG A 74 -18.843 -26.083 8.381 1.00 54.10 H new ATOM 0 HE ARG A 74 -21.647 -26.828 8.248 1.00 23.13 H new ATOM 0 HH11 ARG A 74 -18.932 -25.545 6.393 1.00 23.20 H new ATOM 0 HH12 ARG A 74 -19.969 -24.670 5.261 1.00 23.20 H new ATOM 0 HH21 ARG A 74 -22.973 -25.701 6.791 1.00 3.41 H new ATOM 0 HH22 ARG A 74 -22.247 -24.758 5.485 1.00 3.41 H new ATOM 1190 N ARG A 75 -15.220 -30.149 9.243 1.00 3.13 N ATOM 1191 CA ARG A 75 -14.505 -30.982 10.203 1.00 73.22 C ATOM 1192 C ARG A 75 -13.276 -30.257 10.743 1.00 33.25 C ATOM 1193 O ARG A 75 -12.975 -30.328 11.936 1.00 65.44 O ATOM 1194 CB ARG A 75 -14.087 -32.302 9.552 1.00 21.02 C ATOM 1195 CG ARG A 75 -12.971 -32.151 8.531 1.00 13.10 C ATOM 1196 CD ARG A 75 -12.626 -33.482 7.882 1.00 31.10 C ATOM 1197 NE ARG A 75 -12.166 -34.465 8.860 1.00 42.43 N ATOM 1198 CZ ARG A 75 -12.094 -35.768 8.614 1.00 43.03 C ATOM 1199 NH1 ARG A 75 -12.449 -36.243 7.428 1.00 15.10 N ATOM 1200 NH2 ARG A 75 -11.664 -36.599 9.555 1.00 74.23 N ATOM 0 H ARG A 75 -15.176 -30.482 8.280 1.00 3.13 H new ATOM 0 HA ARG A 75 -15.176 -31.192 11.036 1.00 73.22 H new ATOM 0 HB2 ARG A 75 -13.765 -32.995 10.329 1.00 21.02 H new ATOM 0 HB3 ARG A 75 -14.955 -32.748 9.066 1.00 21.02 H new ATOM 0 HG2 ARG A 75 -13.273 -31.438 7.764 1.00 13.10 H new ATOM 0 HG3 ARG A 75 -12.085 -31.741 9.016 1.00 13.10 H new ATOM 0 HD2 ARG A 75 -13.502 -33.870 7.363 1.00 31.10 H new ATOM 0 HD3 ARG A 75 -11.852 -33.329 7.130 1.00 31.10 H new ATOM 0 HE ARG A 75 -11.885 -34.132 9.782 1.00 42.43 H new ATOM 0 HH11 ARG A 75 -12.778 -35.607 6.702 1.00 15.10 H new ATOM 0 HH12 ARG A 75 -12.393 -37.244 7.242 1.00 15.10 H new ATOM 0 HH21 ARG A 75 -11.389 -36.237 10.468 1.00 74.23 H new ATOM 0 HH22 ARG A 75 -11.609 -37.600 9.365 1.00 74.23 H new ATOM 1214 N LEU A 76 -12.571 -29.560 9.860 1.00 64.54 N ATOM 1215 CA LEU A 76 -11.374 -28.822 10.247 1.00 25.34 C ATOM 1216 C LEU A 76 -11.738 -27.575 11.046 1.00 41.21 C ATOM 1217 O LEU A 76 -11.005 -27.167 11.947 1.00 14.14 O ATOM 1218 CB LEU A 76 -10.568 -28.431 9.007 1.00 2.25 C ATOM 1219 CG LEU A 76 -10.889 -27.064 8.402 1.00 13.11 C ATOM 1220 CD1 LEU A 76 -10.142 -25.964 9.140 1.00 65.23 C ATOM 1221 CD2 LEU A 76 -10.546 -27.043 6.920 1.00 71.13 C ATOM 0 H LEU A 76 -12.807 -29.490 8.870 1.00 64.54 H new ATOM 0 HA LEU A 76 -10.766 -29.470 10.878 1.00 25.34 H new ATOM 0 HB2 LEU A 76 -9.509 -28.452 9.265 1.00 2.25 H new ATOM 0 HB3 LEU A 76 -10.725 -29.191 8.242 1.00 2.25 H new ATOM 0 HG LEU A 76 -11.958 -26.883 8.510 1.00 13.11 H new ATOM 0 HD11 LEU A 76 -10.383 -24.999 8.695 1.00 65.23 H new ATOM 0 HD12 LEU A 76 -10.438 -25.964 10.189 1.00 65.23 H new ATOM 0 HD13 LEU A 76 -9.069 -26.140 9.066 1.00 65.23 H new ATOM 0 HD21 LEU A 76 -10.781 -26.062 6.506 1.00 71.13 H new ATOM 0 HD22 LEU A 76 -9.483 -27.247 6.790 1.00 71.13 H new ATOM 0 HD23 LEU A 76 -11.128 -27.805 6.401 1.00 71.13 H new ATOM 1233 N ARG A 77 -12.875 -26.975 10.710 1.00 51.41 N ATOM 1234 CA ARG A 77 -13.337 -25.774 11.396 1.00 33.32 C ATOM 1235 C ARG A 77 -13.639 -26.069 12.863 1.00 51.43 C ATOM 1236 O ARG A 77 -13.254 -25.308 13.751 1.00 64.42 O ATOM 1237 CB ARG A 77 -14.586 -25.217 10.709 1.00 25.14 C ATOM 1238 CG ARG A 77 -15.073 -23.906 11.303 1.00 12.32 C ATOM 1239 CD ARG A 77 -16.157 -24.135 12.345 1.00 1.21 C ATOM 1240 NE ARG A 77 -17.350 -24.749 11.768 1.00 23.23 N ATOM 1241 CZ ARG A 77 -18.243 -24.083 11.045 1.00 20.12 C ATOM 1242 NH1 ARG A 77 -18.079 -22.788 10.811 1.00 21.52 N ATOM 1243 NH2 ARG A 77 -19.303 -24.712 10.554 1.00 61.40 N ATOM 0 H ARG A 77 -13.493 -27.301 9.967 1.00 51.41 H new ATOM 0 HA ARG A 77 -12.542 -25.030 11.348 1.00 33.32 H new ATOM 0 HB2 ARG A 77 -14.373 -25.070 9.650 1.00 25.14 H new ATOM 0 HB3 ARG A 77 -15.386 -25.955 10.774 1.00 25.14 H new ATOM 0 HG2 ARG A 77 -14.235 -23.378 11.758 1.00 12.32 H new ATOM 0 HG3 ARG A 77 -15.459 -23.267 10.509 1.00 12.32 H new ATOM 0 HD2 ARG A 77 -15.768 -24.774 13.138 1.00 1.21 H new ATOM 0 HD3 ARG A 77 -16.425 -23.184 12.804 1.00 1.21 H new ATOM 0 HE ARG A 77 -17.506 -25.744 11.929 1.00 23.23 H new ATOM 0 HH11 ARG A 77 -17.265 -22.301 11.187 1.00 21.52 H new ATOM 0 HH12 ARG A 77 -18.766 -22.279 10.255 1.00 21.52 H new ATOM 0 HH21 ARG A 77 -19.433 -25.708 10.732 1.00 61.40 H new ATOM 0 HH22 ARG A 77 -19.988 -24.200 9.999 1.00 61.40 H new ATOM 1257 N SER A 78 -14.331 -27.177 13.108 1.00 12.53 N ATOM 1258 CA SER A 78 -14.689 -27.569 14.466 1.00 24.24 C ATOM 1259 C SER A 78 -13.518 -28.263 15.157 1.00 14.21 C ATOM 1260 O SER A 78 -13.633 -28.714 16.297 1.00 75.32 O ATOM 1261 CB SER A 78 -15.906 -28.495 14.448 1.00 34.23 C ATOM 1262 OG SER A 78 -16.338 -28.796 15.764 1.00 25.42 O ATOM 0 H SER A 78 -14.655 -27.819 12.384 1.00 12.53 H new ATOM 0 HA SER A 78 -14.936 -26.667 15.025 1.00 24.24 H new ATOM 0 HB2 SER A 78 -16.718 -28.023 13.895 1.00 34.23 H new ATOM 0 HB3 SER A 78 -15.657 -29.418 13.924 1.00 34.23 H new ATOM 0 HG SER A 78 -15.569 -28.785 16.371 1.00 25.42 H new ATOM 1268 N LYS A 79 -12.391 -28.344 14.459 1.00 51.05 N ATOM 1269 CA LYS A 79 -11.198 -28.981 15.002 1.00 5.24 C ATOM 1270 C LYS A 79 -10.356 -27.979 15.786 1.00 25.01 C ATOM 1271 O LYS A 79 -9.733 -28.328 16.790 1.00 74.32 O ATOM 1272 CB LYS A 79 -10.363 -29.593 13.875 1.00 22.34 C ATOM 1273 CG LYS A 79 -10.403 -31.111 13.845 1.00 23.40 C ATOM 1274 CD LYS A 79 -9.645 -31.665 12.650 1.00 25.34 C ATOM 1275 CE LYS A 79 -8.141 -31.524 12.830 1.00 2.21 C ATOM 1276 NZ LYS A 79 -7.385 -32.389 11.883 1.00 70.13 N ATOM 0 H LYS A 79 -12.279 -27.976 13.514 1.00 51.05 H new ATOM 0 HA LYS A 79 -11.516 -29.772 15.681 1.00 5.24 H new ATOM 0 HB2 LYS A 79 -10.721 -29.209 12.919 1.00 22.34 H new ATOM 0 HB3 LYS A 79 -9.328 -29.267 13.982 1.00 22.34 H new ATOM 0 HG2 LYS A 79 -9.972 -31.506 14.765 1.00 23.40 H new ATOM 0 HG3 LYS A 79 -11.439 -31.448 13.808 1.00 23.40 H new ATOM 0 HD2 LYS A 79 -9.899 -32.716 12.512 1.00 25.34 H new ATOM 0 HD3 LYS A 79 -9.955 -31.141 11.746 1.00 25.34 H new ATOM 0 HE2 LYS A 79 -7.853 -30.483 12.680 1.00 2.21 H new ATOM 0 HE3 LYS A 79 -7.872 -31.785 13.854 1.00 2.21 H new ATOM 0 HZ1 LYS A 79 -6.364 -32.264 12.038 1.00 70.13 H new ATOM 0 HZ2 LYS A 79 -7.640 -33.384 12.043 1.00 70.13 H new ATOM 0 HZ3 LYS A 79 -7.622 -32.124 10.906 1.00 70.13 H new ATOM 1290 N ILE A 80 -10.342 -26.734 15.323 1.00 42.15 N ATOM 1291 CA ILE A 80 -9.578 -25.682 15.982 1.00 33.13 C ATOM 1292 C ILE A 80 -10.325 -24.353 15.941 1.00 4.12 C ATOM 1293 O ILE A 80 -10.336 -23.605 16.919 1.00 35.44 O ATOM 1294 CB ILE A 80 -8.193 -25.501 15.334 1.00 52.42 C ATOM 1295 CG1 ILE A 80 -7.537 -24.211 15.833 1.00 74.24 C ATOM 1296 CG2 ILE A 80 -8.316 -25.487 13.818 1.00 50.55 C ATOM 1297 CD1 ILE A 80 -7.746 -23.031 14.910 1.00 61.14 C ATOM 0 H ILE A 80 -10.851 -26.429 14.494 1.00 42.15 H new ATOM 0 HA ILE A 80 -9.446 -25.990 17.019 1.00 33.13 H new ATOM 0 HB ILE A 80 -7.561 -26.342 15.620 1.00 52.42 H new ATOM 0 HG12 ILE A 80 -7.936 -23.967 16.817 1.00 74.24 H new ATOM 0 HG13 ILE A 80 -6.467 -24.381 15.956 1.00 74.24 H new ATOM 0 HG21 ILE A 80 -7.329 -25.358 13.374 1.00 50.55 H new ATOM 0 HG22 ILE A 80 -8.746 -26.429 13.479 1.00 50.55 H new ATOM 0 HG23 ILE A 80 -8.961 -24.663 13.513 1.00 50.55 H new ATOM 0 HD11 ILE A 80 -7.254 -22.152 15.326 1.00 61.14 H new ATOM 0 HD12 ILE A 80 -7.321 -23.255 13.931 1.00 61.14 H new ATOM 0 HD13 ILE A 80 -8.813 -22.835 14.806 1.00 61.14 H new ATOM 1309 N ASP A 81 -10.948 -24.066 14.804 1.00 44.53 N ATOM 1310 CA ASP A 81 -11.700 -22.827 14.635 1.00 25.44 C ATOM 1311 C ASP A 81 -12.890 -22.781 15.588 1.00 1.23 C ATOM 1312 O ASP A 81 -13.439 -21.713 15.860 1.00 4.21 O ATOM 1313 CB ASP A 81 -12.182 -22.691 13.190 1.00 5.13 C ATOM 1314 CG ASP A 81 -11.372 -21.679 12.403 1.00 13.23 C ATOM 1315 OD1 ASP A 81 -10.180 -21.495 12.724 1.00 43.00 O ATOM 1316 OD2 ASP A 81 -11.932 -21.070 11.467 1.00 1.02 O ATOM 0 H ASP A 81 -10.948 -24.674 13.985 1.00 44.53 H new ATOM 0 HA ASP A 81 -11.038 -21.993 14.868 1.00 25.44 H new ATOM 0 HB2 ASP A 81 -12.123 -23.662 12.697 1.00 5.13 H new ATOM 0 HB3 ASP A 81 -13.231 -22.395 13.186 1.00 5.13 H new ATOM 1321 N ASP A 82 -13.284 -23.945 16.091 1.00 34.32 N ATOM 1322 CA ASP A 82 -14.410 -24.038 17.014 1.00 41.21 C ATOM 1323 C ASP A 82 -14.119 -23.277 18.304 1.00 53.34 C ATOM 1324 O ASP A 82 -15.030 -22.755 18.947 1.00 52.22 O ATOM 1325 CB ASP A 82 -14.719 -25.502 17.330 1.00 71.03 C ATOM 1326 CG ASP A 82 -16.162 -25.865 17.037 1.00 65.41 C ATOM 1327 OD1 ASP A 82 -16.701 -25.380 16.021 1.00 64.14 O ATOM 1328 OD2 ASP A 82 -16.752 -26.634 17.825 1.00 63.44 O ATOM 0 H ASP A 82 -12.841 -24.838 15.876 1.00 34.32 H new ATOM 0 HA ASP A 82 -15.279 -23.587 16.535 1.00 41.21 H new ATOM 0 HB2 ASP A 82 -14.060 -26.144 16.745 1.00 71.03 H new ATOM 0 HB3 ASP A 82 -14.504 -25.697 18.381 1.00 71.03 H new ATOM 1333 N ASP A 83 -12.845 -23.219 18.676 1.00 55.21 N ATOM 1334 CA ASP A 83 -12.434 -22.522 19.889 1.00 14.41 C ATOM 1335 C ASP A 83 -11.300 -21.545 19.597 1.00 44.04 C ATOM 1336 O ASP A 83 -10.376 -21.392 20.397 1.00 74.23 O ATOM 1337 CB ASP A 83 -11.997 -23.526 20.957 1.00 53.23 C ATOM 1338 CG ASP A 83 -12.003 -22.929 22.350 1.00 14.22 C ATOM 1339 OD1 ASP A 83 -13.104 -22.743 22.912 1.00 64.42 O ATOM 1340 OD2 ASP A 83 -10.908 -22.648 22.880 1.00 51.14 O ATOM 0 H ASP A 83 -12.079 -23.646 18.155 1.00 55.21 H new ATOM 0 HA ASP A 83 -13.289 -21.957 20.261 1.00 14.41 H new ATOM 0 HB2 ASP A 83 -12.661 -24.390 20.932 1.00 53.23 H new ATOM 0 HB3 ASP A 83 -10.995 -23.887 20.724 1.00 53.23 H new ATOM 1345 N PHE A 84 -11.374 -20.887 18.445 1.00 55.24 N ATOM 1346 CA PHE A 84 -10.353 -19.926 18.045 1.00 25.31 C ATOM 1347 C PHE A 84 -10.983 -18.706 17.380 1.00 31.13 C ATOM 1348 O PHE A 84 -11.068 -17.635 17.980 1.00 40.11 O ATOM 1349 CB PHE A 84 -9.352 -20.581 17.090 1.00 32.34 C ATOM 1350 CG PHE A 84 -8.120 -21.100 17.776 1.00 54.51 C ATOM 1351 CD1 PHE A 84 -8.200 -22.162 18.662 1.00 3.21 C ATOM 1352 CD2 PHE A 84 -6.883 -20.525 17.534 1.00 51.11 C ATOM 1353 CE1 PHE A 84 -7.068 -22.640 19.295 1.00 61.03 C ATOM 1354 CE2 PHE A 84 -5.748 -20.999 18.163 1.00 25.24 C ATOM 1355 CZ PHE A 84 -5.840 -22.059 19.044 1.00 11.12 C ATOM 0 H PHE A 84 -12.131 -21.002 17.771 1.00 55.24 H new ATOM 0 HA PHE A 84 -9.828 -19.598 18.942 1.00 25.31 H new ATOM 0 HB2 PHE A 84 -9.843 -21.404 16.570 1.00 32.34 H new ATOM 0 HB3 PHE A 84 -9.058 -19.856 16.332 1.00 32.34 H new ATOM 0 HD1 PHE A 84 -9.157 -22.621 18.860 1.00 3.21 H new ATOM 0 HD2 PHE A 84 -6.805 -19.697 16.846 1.00 51.11 H new ATOM 0 HE1 PHE A 84 -7.143 -23.467 19.985 1.00 61.03 H new ATOM 0 HE2 PHE A 84 -4.790 -20.541 17.966 1.00 25.24 H new ATOM 0 HZ PHE A 84 -4.954 -22.433 19.535 1.00 11.12 H new ATOM 1365 N GLU A 85 -11.423 -18.878 16.138 1.00 51.23 N ATOM 1366 CA GLU A 85 -12.044 -17.790 15.391 1.00 75.41 C ATOM 1367 C GLU A 85 -13.490 -18.129 15.039 1.00 52.23 C ATOM 1368 O GLU A 85 -13.900 -19.290 15.037 1.00 42.11 O ATOM 1369 CB GLU A 85 -11.252 -17.500 14.115 1.00 63.12 C ATOM 1370 CG GLU A 85 -10.640 -18.739 13.483 1.00 32.30 C ATOM 1371 CD GLU A 85 -10.596 -18.661 11.969 1.00 23.04 C ATOM 1372 OE1 GLU A 85 -11.553 -18.124 11.374 1.00 2.31 O ATOM 1373 OE2 GLU A 85 -9.603 -19.137 11.380 1.00 22.42 O ATOM 0 H GLU A 85 -11.361 -19.759 15.628 1.00 51.23 H new ATOM 0 HA GLU A 85 -12.040 -16.901 16.022 1.00 75.41 H new ATOM 0 HB2 GLU A 85 -11.910 -17.020 13.390 1.00 63.12 H new ATOM 0 HB3 GLU A 85 -10.458 -16.789 14.344 1.00 63.12 H new ATOM 0 HG2 GLU A 85 -9.628 -18.875 13.866 1.00 32.30 H new ATOM 0 HG3 GLU A 85 -11.215 -19.616 13.781 1.00 32.30 H new ATOM 1380 N PRO A 86 -14.283 -17.091 14.734 1.00 40.32 N ATOM 1381 CA PRO A 86 -15.695 -17.252 14.374 1.00 0.24 C ATOM 1382 C PRO A 86 -15.875 -17.915 13.013 1.00 3.01 C ATOM 1383 O PRO A 86 -14.965 -17.910 12.183 1.00 20.35 O ATOM 1384 CB PRO A 86 -16.219 -15.814 14.342 1.00 10.10 C ATOM 1385 CG PRO A 86 -15.018 -14.979 14.058 1.00 72.44 C ATOM 1386 CD PRO A 86 -13.862 -15.680 14.716 1.00 42.22 C ATOM 0 HA PRO A 86 -16.223 -17.897 15.076 1.00 0.24 H new ATOM 0 HB2 PRO A 86 -16.980 -15.687 13.572 1.00 10.10 H new ATOM 0 HB3 PRO A 86 -16.677 -15.538 15.292 1.00 10.10 H new ATOM 0 HG2 PRO A 86 -14.855 -14.881 12.985 1.00 72.44 H new ATOM 0 HG3 PRO A 86 -15.141 -13.971 14.455 1.00 72.44 H new ATOM 0 HD2 PRO A 86 -12.938 -15.544 14.155 1.00 42.22 H new ATOM 0 HD3 PRO A 86 -13.683 -15.301 15.722 1.00 42.22 H new ATOM 1394 N LYS A 87 -17.054 -18.485 12.789 1.00 42.11 N ATOM 1395 CA LYS A 87 -17.355 -19.151 11.527 1.00 25.23 C ATOM 1396 C LYS A 87 -17.085 -18.225 10.345 1.00 34.43 C ATOM 1397 O LYS A 87 -17.868 -17.317 10.064 1.00 14.13 O ATOM 1398 CB LYS A 87 -18.814 -19.612 11.506 1.00 64.54 C ATOM 1399 CG LYS A 87 -19.806 -18.507 11.821 1.00 41.54 C ATOM 1400 CD LYS A 87 -20.880 -18.979 12.785 1.00 32.54 C ATOM 1401 CE LYS A 87 -22.097 -18.068 12.755 1.00 53.22 C ATOM 1402 NZ LYS A 87 -22.829 -18.162 11.461 1.00 23.21 N ATOM 0 H LYS A 87 -17.817 -18.499 13.465 1.00 42.11 H new ATOM 0 HA LYS A 87 -16.704 -20.021 11.439 1.00 25.23 H new ATOM 0 HB2 LYS A 87 -19.042 -20.024 10.523 1.00 64.54 H new ATOM 0 HB3 LYS A 87 -18.941 -20.419 12.227 1.00 64.54 H new ATOM 0 HG2 LYS A 87 -19.279 -17.656 12.251 1.00 41.54 H new ATOM 0 HG3 LYS A 87 -20.271 -18.161 10.898 1.00 41.54 H new ATOM 0 HD2 LYS A 87 -21.179 -19.995 12.529 1.00 32.54 H new ATOM 0 HD3 LYS A 87 -20.474 -19.012 13.796 1.00 32.54 H new ATOM 0 HE2 LYS A 87 -22.768 -18.332 13.572 1.00 53.22 H new ATOM 0 HE3 LYS A 87 -21.783 -17.037 12.921 1.00 53.22 H new ATOM 0 HZ1 LYS A 87 -23.806 -17.829 11.590 1.00 23.21 H new ATOM 0 HZ2 LYS A 87 -22.353 -17.572 10.749 1.00 23.21 H new ATOM 0 HZ3 LYS A 87 -22.840 -19.151 11.139 1.00 23.21 H new ATOM 1416 N LEU A 88 -15.975 -18.462 9.655 1.00 12.24 N ATOM 1417 CA LEU A 88 -15.604 -17.650 8.502 1.00 44.31 C ATOM 1418 C LEU A 88 -15.929 -18.373 7.199 1.00 22.30 C ATOM 1419 O LEU A 88 -15.525 -17.940 6.120 1.00 42.05 O ATOM 1420 CB LEU A 88 -14.113 -17.310 8.551 1.00 0.15 C ATOM 1421 CG LEU A 88 -13.762 -15.897 9.020 1.00 62.31 C ATOM 1422 CD1 LEU A 88 -13.872 -15.794 10.533 1.00 11.02 C ATOM 1423 CD2 LEU A 88 -12.363 -15.514 8.558 1.00 74.42 C ATOM 0 H LEU A 88 -15.317 -19.210 9.874 1.00 12.24 H new ATOM 0 HA LEU A 88 -16.183 -16.727 8.538 1.00 44.31 H new ATOM 0 HB2 LEU A 88 -13.620 -18.023 9.211 1.00 0.15 H new ATOM 0 HB3 LEU A 88 -13.695 -17.455 7.555 1.00 0.15 H new ATOM 0 HG LEU A 88 -14.473 -15.200 8.576 1.00 62.31 H new ATOM 0 HD11 LEU A 88 -13.619 -14.782 10.848 1.00 11.02 H new ATOM 0 HD12 LEU A 88 -14.892 -16.025 10.840 1.00 11.02 H new ATOM 0 HD13 LEU A 88 -13.184 -16.501 10.997 1.00 11.02 H new ATOM 0 HD21 LEU A 88 -12.130 -14.506 8.901 1.00 74.42 H new ATOM 0 HD22 LEU A 88 -11.638 -16.215 8.973 1.00 74.42 H new ATOM 0 HD23 LEU A 88 -12.318 -15.547 7.469 1.00 74.42 H new ATOM 1435 N ILE A 89 -16.662 -19.476 7.308 1.00 53.21 N ATOM 1436 CA ILE A 89 -17.044 -20.257 6.138 1.00 34.11 C ATOM 1437 C ILE A 89 -18.374 -19.776 5.566 1.00 24.11 C ATOM 1438 O ILE A 89 -19.385 -19.733 6.268 1.00 43.12 O ATOM 1439 CB ILE A 89 -17.155 -21.756 6.474 1.00 73.01 C ATOM 1440 CG1 ILE A 89 -15.820 -22.282 7.005 1.00 72.23 C ATOM 1441 CG2 ILE A 89 -17.591 -22.543 5.247 1.00 42.11 C ATOM 1442 CD1 ILE A 89 -15.952 -23.544 7.829 1.00 54.24 C ATOM 0 H ILE A 89 -17.003 -19.849 8.194 1.00 53.21 H new ATOM 0 HA ILE A 89 -16.259 -20.116 5.395 1.00 34.11 H new ATOM 0 HB ILE A 89 -17.909 -21.885 7.250 1.00 73.01 H new ATOM 0 HG12 ILE A 89 -15.154 -22.475 6.164 1.00 72.23 H new ATOM 0 HG13 ILE A 89 -15.350 -21.509 7.612 1.00 72.23 H new ATOM 0 HG21 ILE A 89 -17.665 -23.601 5.500 1.00 42.11 H new ATOM 0 HG22 ILE A 89 -18.563 -22.182 4.909 1.00 42.11 H new ATOM 0 HG23 ILE A 89 -16.858 -22.411 4.451 1.00 42.11 H new ATOM 0 HD11 ILE A 89 -14.967 -23.859 8.172 1.00 54.24 H new ATOM 0 HD12 ILE A 89 -16.592 -23.351 8.690 1.00 54.24 H new ATOM 0 HD13 ILE A 89 -16.393 -24.332 7.219 1.00 54.24 H new ATOM 1454 N HIS A 90 -18.366 -19.417 4.286 1.00 5.43 N ATOM 1455 CA HIS A 90 -19.572 -18.941 3.618 1.00 4.22 C ATOM 1456 C HIS A 90 -19.717 -19.579 2.240 1.00 31.21 C ATOM 1457 O HIS A 90 -18.749 -19.681 1.485 1.00 13.43 O ATOM 1458 CB HIS A 90 -19.540 -17.418 3.487 1.00 52.21 C ATOM 1459 CG HIS A 90 -19.992 -16.701 4.722 1.00 51.33 C ATOM 1460 ND1 HIS A 90 -21.000 -17.169 5.538 1.00 62.40 N ATOM 1461 CD2 HIS A 90 -19.566 -15.543 5.279 1.00 33.11 C ATOM 1462 CE1 HIS A 90 -21.175 -16.330 6.543 1.00 34.20 C ATOM 1463 NE2 HIS A 90 -20.317 -15.335 6.410 1.00 55.14 N ATOM 0 H HIS A 90 -17.538 -19.447 3.691 1.00 5.43 H new ATOM 0 HA HIS A 90 -20.431 -19.228 4.224 1.00 4.22 H new ATOM 0 HB2 HIS A 90 -18.525 -17.104 3.245 1.00 52.21 H new ATOM 0 HB3 HIS A 90 -20.173 -17.120 2.651 1.00 52.21 H new ATOM 0 HD2 HIS A 90 -18.782 -14.902 4.904 1.00 33.11 H new ATOM 0 HE1 HIS A 90 -21.897 -16.439 7.339 1.00 34.20 H new ATOM 0 HE2 HIS A 90 -20.227 -14.541 7.044 1.00 55.14 H new ATOM 1471 N THR A 91 -20.933 -20.009 1.918 1.00 71.52 N ATOM 1472 CA THR A 91 -21.205 -20.640 0.632 1.00 1.41 C ATOM 1473 C THR A 91 -22.376 -19.966 -0.074 1.00 10.12 C ATOM 1474 O THR A 91 -23.482 -19.900 0.462 1.00 35.50 O ATOM 1475 CB THR A 91 -21.513 -22.140 0.796 1.00 52.12 C ATOM 1476 OG1 THR A 91 -20.356 -22.827 1.285 1.00 71.32 O ATOM 1477 CG2 THR A 91 -21.950 -22.750 -0.527 1.00 74.13 C ATOM 0 H THR A 91 -21.745 -19.932 2.530 1.00 71.52 H new ATOM 0 HA THR A 91 -20.305 -20.526 0.027 1.00 1.41 H new ATOM 0 HB THR A 91 -22.327 -22.245 1.513 1.00 52.12 H new ATOM 0 HG1 THR A 91 -20.415 -23.776 1.050 1.00 71.32 H new ATOM 0 HG21 THR A 91 -22.162 -23.810 -0.387 1.00 74.13 H new ATOM 0 HG22 THR A 91 -22.848 -22.244 -0.882 1.00 74.13 H new ATOM 0 HG23 THR A 91 -21.154 -22.634 -1.262 1.00 74.13 H new ATOM 1485 N VAL A 92 -22.126 -19.466 -1.280 1.00 21.21 N ATOM 1486 CA VAL A 92 -23.161 -18.799 -2.060 1.00 42.44 C ATOM 1487 C VAL A 92 -24.005 -19.808 -2.831 1.00 43.41 C ATOM 1488 O VAL A 92 -23.475 -20.722 -3.462 1.00 24.41 O ATOM 1489 CB VAL A 92 -22.552 -17.790 -3.053 1.00 73.21 C ATOM 1490 CG1 VAL A 92 -23.644 -17.131 -3.882 1.00 34.13 C ATOM 1491 CG2 VAL A 92 -21.729 -16.746 -2.314 1.00 31.21 C ATOM 0 H VAL A 92 -21.216 -19.510 -1.738 1.00 21.21 H new ATOM 0 HA VAL A 92 -23.795 -18.265 -1.353 1.00 42.44 H new ATOM 0 HB VAL A 92 -21.890 -18.328 -3.731 1.00 73.21 H new ATOM 0 HG11 VAL A 92 -23.195 -16.422 -4.577 1.00 34.13 H new ATOM 0 HG12 VAL A 92 -24.187 -17.893 -4.441 1.00 34.13 H new ATOM 0 HG13 VAL A 92 -24.334 -16.605 -3.222 1.00 34.13 H new ATOM 0 HG21 VAL A 92 -21.306 -16.042 -3.031 1.00 31.21 H new ATOM 0 HG22 VAL A 92 -22.367 -16.210 -1.612 1.00 31.21 H new ATOM 0 HG23 VAL A 92 -20.923 -17.237 -1.769 1.00 31.21 H new ATOM 1501 N ARG A 93 -25.321 -19.634 -2.776 1.00 32.40 N ATOM 1502 CA ARG A 93 -26.239 -20.531 -3.468 1.00 53.55 C ATOM 1503 C ARG A 93 -26.066 -20.424 -4.981 1.00 12.23 C ATOM 1504 O ARG A 93 -26.660 -19.560 -5.624 1.00 54.14 O ATOM 1505 CB ARG A 93 -27.685 -20.209 -3.086 1.00 12.01 C ATOM 1506 CG ARG A 93 -28.713 -21.037 -3.840 1.00 11.32 C ATOM 1507 CD ARG A 93 -29.886 -21.415 -2.949 1.00 1.13 C ATOM 1508 NE ARG A 93 -31.156 -20.927 -3.479 1.00 51.03 N ATOM 1509 CZ ARG A 93 -31.574 -19.673 -3.349 1.00 2.22 C ATOM 1510 NH1 ARG A 93 -30.826 -18.785 -2.709 1.00 42.51 N ATOM 1511 NH2 ARG A 93 -32.742 -19.305 -3.859 1.00 50.24 N ATOM 0 H ARG A 93 -25.776 -18.881 -2.260 1.00 32.40 H new ATOM 0 HA ARG A 93 -26.008 -21.552 -3.164 1.00 53.55 H new ATOM 0 HB2 ARG A 93 -27.814 -20.372 -2.016 1.00 12.01 H new ATOM 0 HB3 ARG A 93 -27.874 -19.152 -3.273 1.00 12.01 H new ATOM 0 HG2 ARG A 93 -29.075 -20.474 -4.700 1.00 11.32 H new ATOM 0 HG3 ARG A 93 -28.242 -21.941 -4.226 1.00 11.32 H new ATOM 0 HD2 ARG A 93 -29.929 -22.499 -2.847 1.00 1.13 H new ATOM 0 HD3 ARG A 93 -29.729 -21.007 -1.951 1.00 1.13 H new ATOM 0 HE ARG A 93 -31.755 -21.586 -3.977 1.00 51.03 H new ATOM 0 HH11 ARG A 93 -29.927 -19.064 -2.315 1.00 42.51 H new ATOM 0 HH12 ARG A 93 -31.149 -17.823 -2.610 1.00 42.51 H new ATOM 0 HH21 ARG A 93 -33.320 -19.985 -4.352 1.00 50.24 H new ATOM 0 HH22 ARG A 93 -33.062 -18.342 -3.758 1.00 50.24 H new ATOM 1525 N GLY A 94 -25.247 -21.308 -5.542 1.00 31.44 N ATOM 1526 CA GLY A 94 -25.010 -21.296 -6.973 1.00 62.02 C ATOM 1527 C GLY A 94 -23.627 -20.787 -7.327 1.00 43.33 C ATOM 1528 O GLY A 94 -23.457 -20.060 -8.306 1.00 33.11 O ATOM 0 H GLY A 94 -24.743 -22.033 -5.030 1.00 31.44 H new ATOM 0 HA2 GLY A 94 -25.135 -22.305 -7.367 1.00 62.02 H new ATOM 0 HA3 GLY A 94 -25.759 -20.670 -7.457 1.00 62.02 H new ATOM 1532 N ALA A 95 -22.635 -21.167 -6.528 1.00 73.33 N ATOM 1533 CA ALA A 95 -21.260 -20.745 -6.763 1.00 11.42 C ATOM 1534 C ALA A 95 -20.274 -21.835 -6.357 1.00 40.31 C ATOM 1535 O ALA A 95 -19.663 -22.481 -7.207 1.00 51.55 O ATOM 1536 CB ALA A 95 -20.967 -19.457 -6.006 1.00 75.34 C ATOM 0 H ALA A 95 -22.758 -21.767 -5.712 1.00 73.33 H new ATOM 0 HA ALA A 95 -21.139 -20.562 -7.831 1.00 11.42 H new ATOM 0 HB1 ALA A 95 -19.937 -19.153 -6.190 1.00 75.34 H new ATOM 0 HB2 ALA A 95 -21.643 -18.673 -6.347 1.00 75.34 H new ATOM 0 HB3 ALA A 95 -21.111 -19.622 -4.938 1.00 75.34 H new ATOM 1542 N GLY A 96 -20.123 -22.034 -5.051 1.00 40.31 N ATOM 1543 CA GLY A 96 -19.209 -23.046 -4.556 1.00 23.02 C ATOM 1544 C GLY A 96 -18.901 -22.878 -3.081 1.00 52.00 C ATOM 1545 O GLY A 96 -19.675 -23.308 -2.225 1.00 53.35 O ATOM 0 H GLY A 96 -20.617 -21.512 -4.327 1.00 40.31 H new ATOM 0 HA2 GLY A 96 -19.639 -24.033 -4.724 1.00 23.02 H new ATOM 0 HA3 GLY A 96 -18.280 -23.002 -5.125 1.00 23.02 H new ATOM 1549 N TYR A 97 -17.768 -22.253 -2.782 1.00 41.13 N ATOM 1550 CA TYR A 97 -17.358 -22.033 -1.401 1.00 4.15 C ATOM 1551 C TYR A 97 -16.420 -20.834 -1.295 1.00 21.11 C ATOM 1552 O TYR A 97 -15.587 -20.604 -2.171 1.00 45.33 O ATOM 1553 CB TYR A 97 -16.671 -23.282 -0.845 1.00 52.02 C ATOM 1554 CG TYR A 97 -17.529 -24.065 0.123 1.00 55.14 C ATOM 1555 CD1 TYR A 97 -18.382 -25.066 -0.327 1.00 2.24 C ATOM 1556 CD2 TYR A 97 -17.487 -23.804 1.487 1.00 70.02 C ATOM 1557 CE1 TYR A 97 -19.168 -25.783 0.554 1.00 12.21 C ATOM 1558 CE2 TYR A 97 -18.269 -24.517 2.375 1.00 23.10 C ATOM 1559 CZ TYR A 97 -19.108 -25.505 1.904 1.00 70.12 C ATOM 1560 OH TYR A 97 -19.889 -26.218 2.785 1.00 63.15 O ATOM 0 H TYR A 97 -17.117 -21.890 -3.478 1.00 41.13 H new ATOM 0 HA TYR A 97 -18.252 -21.826 -0.813 1.00 4.15 H new ATOM 0 HB2 TYR A 97 -16.389 -23.931 -1.674 1.00 52.02 H new ATOM 0 HB3 TYR A 97 -15.749 -22.987 -0.344 1.00 52.02 H new ATOM 0 HD1 TYR A 97 -18.431 -25.287 -1.383 1.00 2.24 H new ATOM 0 HD2 TYR A 97 -16.832 -23.030 1.859 1.00 70.02 H new ATOM 0 HE1 TYR A 97 -19.826 -26.557 0.188 1.00 12.21 H new ATOM 0 HE2 TYR A 97 -18.224 -24.302 3.432 1.00 23.10 H new ATOM 0 HH TYR A 97 -19.340 -26.893 3.237 1.00 63.15 H new ATOM 1570 N VAL A 98 -16.562 -20.073 -0.214 1.00 71.32 N ATOM 1571 CA VAL A 98 -15.728 -18.899 0.009 1.00 44.30 C ATOM 1572 C VAL A 98 -15.570 -18.611 1.498 1.00 73.21 C ATOM 1573 O VAL A 98 -16.399 -19.022 2.312 1.00 42.23 O ATOM 1574 CB VAL A 98 -16.314 -17.654 -0.684 1.00 25.11 C ATOM 1575 CG1 VAL A 98 -17.577 -17.192 0.026 1.00 20.53 C ATOM 1576 CG2 VAL A 98 -15.282 -16.537 -0.734 1.00 22.32 C ATOM 0 H VAL A 98 -17.247 -20.249 0.521 1.00 71.32 H new ATOM 0 HA VAL A 98 -14.751 -19.119 -0.421 1.00 44.30 H new ATOM 0 HB VAL A 98 -16.578 -17.920 -1.707 1.00 25.11 H new ATOM 0 HG11 VAL A 98 -17.976 -16.312 -0.478 1.00 20.53 H new ATOM 0 HG12 VAL A 98 -18.319 -17.990 0.005 1.00 20.53 H new ATOM 0 HG13 VAL A 98 -17.342 -16.942 1.061 1.00 20.53 H new ATOM 0 HG21 VAL A 98 -15.713 -15.665 -1.227 1.00 22.32 H new ATOM 0 HG22 VAL A 98 -14.985 -16.271 0.280 1.00 22.32 H new ATOM 0 HG23 VAL A 98 -14.408 -16.874 -1.291 1.00 22.32 H new ATOM 1586 N LEU A 99 -14.503 -17.903 1.848 1.00 5.03 N ATOM 1587 CA LEU A 99 -14.236 -17.559 3.241 1.00 62.03 C ATOM 1588 C LEU A 99 -14.412 -16.062 3.475 1.00 21.21 C ATOM 1589 O LEU A 99 -13.956 -15.242 2.679 1.00 71.21 O ATOM 1590 CB LEU A 99 -12.819 -17.984 3.629 1.00 22.52 C ATOM 1591 CG LEU A 99 -11.705 -16.990 3.299 1.00 71.11 C ATOM 1592 CD1 LEU A 99 -10.386 -17.447 3.902 1.00 43.40 C ATOM 1593 CD2 LEU A 99 -11.574 -16.817 1.793 1.00 63.53 C ATOM 0 H LEU A 99 -13.808 -17.555 1.187 1.00 5.03 H new ATOM 0 HA LEU A 99 -14.953 -18.093 3.865 1.00 62.03 H new ATOM 0 HB2 LEU A 99 -12.800 -18.177 4.702 1.00 22.52 H new ATOM 0 HB3 LEU A 99 -12.595 -18.928 3.131 1.00 22.52 H new ATOM 0 HG LEU A 99 -11.964 -16.025 3.734 1.00 71.11 H new ATOM 0 HD11 LEU A 99 -9.605 -16.727 3.657 1.00 43.40 H new ATOM 0 HD12 LEU A 99 -10.486 -17.518 4.985 1.00 43.40 H new ATOM 0 HD13 LEU A 99 -10.120 -18.423 3.497 1.00 43.40 H new ATOM 0 HD21 LEU A 99 -10.777 -16.106 1.576 1.00 63.53 H new ATOM 0 HD22 LEU A 99 -11.338 -17.778 1.336 1.00 63.53 H new ATOM 0 HD23 LEU A 99 -12.514 -16.443 1.387 1.00 63.53 H new ATOM 1605 N GLU A 100 -15.074 -15.714 4.574 1.00 31.31 N ATOM 1606 CA GLU A 100 -15.309 -14.316 4.913 1.00 5.44 C ATOM 1607 C GLU A 100 -15.985 -14.192 6.276 1.00 71.24 C ATOM 1608 O GLU A 100 -16.868 -14.981 6.616 1.00 42.35 O ATOM 1609 CB GLU A 100 -16.170 -13.645 3.841 1.00 30.22 C ATOM 1610 CG GLU A 100 -15.908 -12.156 3.693 1.00 0.24 C ATOM 1611 CD GLU A 100 -16.187 -11.651 2.291 1.00 2.20 C ATOM 1612 OE1 GLU A 100 -17.267 -11.968 1.751 1.00 71.44 O ATOM 1613 OE2 GLU A 100 -15.325 -10.939 1.734 1.00 15.31 O ATOM 0 H GLU A 100 -15.457 -16.381 5.244 1.00 31.31 H new ATOM 0 HA GLU A 100 -14.343 -13.813 4.959 1.00 5.44 H new ATOM 0 HB2 GLU A 100 -15.989 -14.134 2.884 1.00 30.22 H new ATOM 0 HB3 GLU A 100 -17.222 -13.798 4.084 1.00 30.22 H new ATOM 0 HG2 GLU A 100 -16.529 -11.609 4.402 1.00 0.24 H new ATOM 0 HG3 GLU A 100 -14.870 -11.946 3.951 1.00 0.24 H new ATOM 1620 N ILE A 101 -15.564 -13.198 7.051 1.00 73.44 N ATOM 1621 CA ILE A 101 -16.129 -12.971 8.375 1.00 74.31 C ATOM 1622 C ILE A 101 -17.550 -12.425 8.280 1.00 3.52 C ATOM 1623 O ILE A 101 -18.031 -12.103 7.194 1.00 42.05 O ATOM 1624 CB ILE A 101 -15.268 -11.992 9.194 1.00 20.12 C ATOM 1625 CG1 ILE A 101 -15.585 -10.548 8.801 1.00 14.23 C ATOM 1626 CG2 ILE A 101 -13.790 -12.289 8.991 1.00 62.40 C ATOM 1627 CD1 ILE A 101 -15.426 -10.275 7.322 1.00 21.00 C ATOM 0 H ILE A 101 -14.834 -12.537 6.785 1.00 73.44 H new ATOM 0 HA ILE A 101 -16.147 -13.936 8.881 1.00 74.31 H new ATOM 0 HB ILE A 101 -15.503 -12.121 10.250 1.00 20.12 H new ATOM 0 HG12 ILE A 101 -16.608 -10.316 9.097 1.00 14.23 H new ATOM 0 HG13 ILE A 101 -14.932 -9.877 9.358 1.00 14.23 H new ATOM 0 HG21 ILE A 101 -13.194 -11.589 9.576 1.00 62.40 H new ATOM 0 HG22 ILE A 101 -13.576 -13.307 9.316 1.00 62.40 H new ATOM 0 HG23 ILE A 101 -13.539 -12.184 7.935 1.00 62.40 H new ATOM 0 HD11 ILE A 101 -15.667 -9.232 7.117 1.00 21.00 H new ATOM 0 HD12 ILE A 101 -14.397 -10.475 7.024 1.00 21.00 H new ATOM 0 HD13 ILE A 101 -16.099 -10.921 6.758 1.00 21.00 H new ATOM 1639 N ARG A 102 -18.215 -12.320 9.426 1.00 74.22 N ATOM 1640 CA ARG A 102 -19.581 -11.811 9.472 1.00 22.54 C ATOM 1641 C ARG A 102 -19.591 -10.299 9.674 1.00 21.02 C ATOM 1642 O ARG A 102 -20.501 -9.609 9.217 1.00 41.24 O ATOM 1643 CB ARG A 102 -20.363 -12.492 10.597 1.00 32.01 C ATOM 1644 CG ARG A 102 -21.280 -13.604 10.115 1.00 61.32 C ATOM 1645 CD ARG A 102 -21.763 -14.468 11.269 1.00 21.23 C ATOM 1646 NE ARG A 102 -23.156 -14.874 11.104 1.00 12.41 N ATOM 1647 CZ ARG A 102 -24.189 -14.082 11.373 1.00 63.23 C ATOM 1648 NH1 ARG A 102 -23.985 -12.850 11.817 1.00 54.53 N ATOM 1649 NH2 ARG A 102 -25.428 -14.523 11.197 1.00 63.32 N ATOM 0 H ARG A 102 -17.831 -12.580 10.334 1.00 74.22 H new ATOM 0 HA ARG A 102 -20.059 -12.036 8.518 1.00 22.54 H new ATOM 0 HB2 ARG A 102 -19.659 -12.902 11.321 1.00 32.01 H new ATOM 0 HB3 ARG A 102 -20.958 -11.743 11.120 1.00 32.01 H new ATOM 0 HG2 ARG A 102 -22.137 -13.172 9.599 1.00 61.32 H new ATOM 0 HG3 ARG A 102 -20.752 -14.224 9.391 1.00 61.32 H new ATOM 0 HD2 ARG A 102 -21.134 -15.355 11.346 1.00 21.23 H new ATOM 0 HD3 ARG A 102 -21.654 -13.918 12.204 1.00 21.23 H new ATOM 0 HE ARG A 102 -23.347 -15.817 10.764 1.00 12.41 H new ATOM 0 HH11 ARG A 102 -23.034 -12.508 11.953 1.00 54.53 H new ATOM 0 HH12 ARG A 102 -24.779 -12.244 12.023 1.00 54.53 H new ATOM 0 HH21 ARG A 102 -25.588 -15.470 10.855 1.00 63.32 H new ATOM 0 HH22 ARG A 102 -26.220 -13.915 11.404 1.00 63.32 H new ATOM 1663 N GLU A 103 -18.573 -9.792 10.363 1.00 62.24 N ATOM 1664 CA GLU A 103 -18.466 -8.362 10.626 1.00 52.13 C ATOM 1665 C GLU A 103 -18.620 -7.559 9.337 1.00 3.33 C ATOM 1666 O GLU A 103 -19.098 -6.425 9.354 1.00 23.04 O ATOM 1667 CB GLU A 103 -17.122 -8.040 11.283 1.00 34.40 C ATOM 1668 CG GLU A 103 -16.797 -8.931 12.470 1.00 62.40 C ATOM 1669 CD GLU A 103 -15.790 -8.302 13.413 1.00 14.33 C ATOM 1670 OE1 GLU A 103 -15.030 -7.418 12.967 1.00 41.23 O ATOM 1671 OE2 GLU A 103 -15.764 -8.693 14.599 1.00 21.40 O ATOM 0 H GLU A 103 -17.811 -10.350 10.749 1.00 62.24 H new ATOM 0 HA GLU A 103 -19.270 -8.083 11.306 1.00 52.13 H new ATOM 0 HB2 GLU A 103 -16.331 -8.137 10.539 1.00 34.40 H new ATOM 0 HB3 GLU A 103 -17.127 -7.000 11.610 1.00 34.40 H new ATOM 0 HG2 GLU A 103 -17.714 -9.150 13.017 1.00 62.40 H new ATOM 0 HG3 GLU A 103 -16.406 -9.882 12.109 1.00 62.40 H new ATOM 1678 N GLU A 104 -18.210 -8.156 8.222 1.00 0.34 N ATOM 1679 CA GLU A 104 -18.301 -7.495 6.925 1.00 23.34 C ATOM 1680 C GLU A 104 -19.713 -6.972 6.679 1.00 43.10 C ATOM 1681 O GLU A 104 -19.940 -5.763 6.644 1.00 4.04 O ATOM 1682 CB GLU A 104 -17.900 -8.461 5.808 1.00 54.53 C ATOM 1683 CG GLU A 104 -18.201 -7.936 4.414 1.00 41.23 C ATOM 1684 CD GLU A 104 -17.344 -8.589 3.347 1.00 4.11 C ATOM 1685 OE1 GLU A 104 -16.204 -8.988 3.665 1.00 5.32 O ATOM 1686 OE2 GLU A 104 -17.812 -8.701 2.195 1.00 22.01 O ATOM 0 H GLU A 104 -17.812 -9.095 8.191 1.00 0.34 H new ATOM 0 HA GLU A 104 -17.615 -6.648 6.927 1.00 23.34 H new ATOM 0 HB2 GLU A 104 -16.833 -8.671 5.886 1.00 54.53 H new ATOM 0 HB3 GLU A 104 -18.422 -9.407 5.952 1.00 54.53 H new ATOM 0 HG2 GLU A 104 -19.253 -8.107 4.185 1.00 41.23 H new ATOM 0 HG3 GLU A 104 -18.041 -6.858 4.394 1.00 41.23 H new TER 1693 GLU A 104