USER MOD reduce.3.24.130724 H: found=0, std=0, add=1155, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 841 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 22 SER OG : rot 137:sc= -0.947! USER MOD Set 1.2: A 157 CYS SG : rot -33:sc= -2.69! USER MOD Set 2.1: A 83 SER OG : rot 13:sc= -3.11! USER MOD Set 2.2: A 89 SER OG : rot 105:sc= 0.866 USER MOD Set 3.1: A 3 THR OG1 : rot 132:sc= 0.0284 USER MOD Set 3.2: A 52 THR OG1 : rot 180:sc= -0.768 USER MOD Set 4.1: A 17 THR OG1 : rot -29:sc= 0.00678 USER MOD Set 4.2: A 58 THR OG1 : rot 180:sc= 0.00662 USER MOD Single : A 2 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 CYS SG : rot -170:sc= -3.17! USER MOD Single : A 16 LYS NZ :NH3+ -123:sc= -1.98! (180deg=-3.69!) USER MOD Single : A 18 CYS SG : rot 180:sc= 0 USER MOD Single : A 23 TYR OH : rot 180:sc= -2.63! USER MOD Single : A 24 THR OG1 : rot -17:sc= 1.42 USER MOD Single : A 25 THR OG1 : rot 180:sc= -0.139 USER MOD Single : A 26 ASN :FLIP amide:sc= -6.3! C(o=-8.4!,f=-6.3!) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 ASN : amide:sc= -1.23! C(o=-1.2!,f=-10!) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 180:sc= -1.09 USER MOD Single : A 45 MET CE :methyl -153:sc= -0.278 (180deg=-1.52!) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 75 THR OG1 : rot 30:sc= -0.145 USER MOD Single : A 81 CYS SG : rot -93:sc= -2.97 USER MOD Single : A 86 SER OG : rot 180:sc= -1.69 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 94 LYS NZ :NH3+ -138:sc= -9.33! (180deg=-11.5!) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot 74:sc= 0.529 USER MOD Single : A 103 HIS : no HD1:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 104 HIS : no HD1:sc= -0.0356 K(o=-0.036,f=-0.68) USER MOD Single : A 105 CYS SG : rot -179:sc= -1.46 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 THR OG1 : rot -124:sc= -0.65! USER MOD Single : A 115 THR OG1 : rot 122:sc= 0.322 USER MOD Single : A 116 GLN :FLIP amide:sc= -4.74! C(o=-9.2!,f=-4.7!) USER MOD Single : A 138 THR OG1 : rot -155:sc= -1.9! USER MOD Single : A 141 THR OG1 : rot 180:sc= 0 USER MOD Single : A 144 LYS NZ :NH3+ -168:sc= -0.016 (180deg=-0.255) USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 LYS NZ :NH3+ -149:sc= 0.4 (180deg=-0.535!) USER MOD Single : A 154 TYR OH : rot 180:sc= 0 USER MOD Single : A 158 SER OG : rot 68:sc= 0.878 USER MOD Single : A 161 THR OG1 : rot 149:sc= -0.493! USER MOD Single : A 162 GLN :FLIP amide:sc= -8.14! C(o=-11!,f=-8.1!) USER MOD Single : A 163 LYS NZ :NH3+ -117:sc= -0.953 (180deg=-2.62!) USER MOD Single : A 166 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.000825) USER MOD Single : A 167 ASN : amide:sc= 0 K(o=0,f=-1.3) USER MOD ----------------------------------------------------------------- ATOM 20 N GLN A 2 123.938 -2.644 14.418 1.00 0.00 N ATOM 21 CA GLN A 2 123.197 -2.941 13.197 1.00 0.00 C ATOM 22 C GLN A 2 124.063 -2.683 11.968 1.00 0.00 C ATOM 23 O GLN A 2 125.117 -2.055 12.059 1.00 0.00 O ATOM 24 CB GLN A 2 121.938 -2.074 13.128 1.00 0.00 C ATOM 25 CG GLN A 2 121.037 -2.388 14.323 1.00 0.00 C ATOM 26 CD GLN A 2 119.808 -1.486 14.302 1.00 0.00 C ATOM 27 OE1 GLN A 2 119.768 -0.505 13.557 1.00 0.00 O ATOM 28 NE2 GLN A 2 118.797 -1.757 15.081 1.00 0.00 N ATOM 0 HA GLN A 2 122.914 -3.993 13.212 1.00 0.00 H new ATOM 0 HB2 GLN A 2 122.210 -1.018 13.131 1.00 0.00 H new ATOM 0 HB3 GLN A 2 121.404 -2.263 12.197 1.00 0.00 H new ATOM 0 HG2 GLN A 2 120.731 -3.434 14.293 1.00 0.00 H new ATOM 0 HG3 GLN A 2 121.588 -2.244 15.252 1.00 0.00 H new ATOM 0 HE21 GLN A 2 118.831 -2.569 15.697 1.00 0.00 H new ATOM 0 HE22 GLN A 2 117.972 -1.157 15.074 1.00 0.00 H new ATOM 35 N THR A 3 123.605 -3.160 10.816 1.00 0.00 N ATOM 36 CA THR A 3 124.337 -2.965 9.577 1.00 0.00 C ATOM 37 C THR A 3 124.906 -1.556 9.535 1.00 0.00 C ATOM 38 O THR A 3 124.220 -0.589 9.871 1.00 0.00 O ATOM 39 CB THR A 3 123.408 -3.181 8.382 1.00 0.00 C ATOM 40 OG1 THR A 3 122.971 -1.921 7.890 1.00 0.00 O ATOM 41 CG2 THR A 3 122.197 -4.008 8.816 1.00 0.00 C ATOM 0 H THR A 3 122.734 -3.682 10.718 1.00 0.00 H new ATOM 0 HA THR A 3 125.153 -3.686 9.528 1.00 0.00 H new ATOM 0 HB THR A 3 123.945 -3.713 7.597 1.00 0.00 H new ATOM 0 HG1 THR A 3 123.079 -1.894 6.916 1.00 0.00 H new ATOM 0 HG21 THR A 3 121.536 -4.161 7.963 1.00 0.00 H new ATOM 0 HG22 THR A 3 122.532 -4.974 9.193 1.00 0.00 H new ATOM 0 HG23 THR A 3 121.658 -3.479 9.602 1.00 0.00 H new ATOM 46 N ILE A 4 126.163 -1.448 9.139 1.00 0.00 N ATOM 47 CA ILE A 4 126.816 -0.151 9.079 1.00 0.00 C ATOM 48 C ILE A 4 127.359 0.115 7.681 1.00 0.00 C ATOM 49 O ILE A 4 127.800 -0.801 6.991 1.00 0.00 O ATOM 50 CB ILE A 4 127.941 -0.117 10.107 1.00 0.00 C ATOM 51 CG1 ILE A 4 128.433 1.321 10.289 1.00 0.00 C ATOM 52 CG2 ILE A 4 129.098 -0.996 9.627 1.00 0.00 C ATOM 53 CD1 ILE A 4 127.489 2.078 11.227 1.00 0.00 C ATOM 0 H ILE A 4 126.747 -2.235 8.857 1.00 0.00 H new ATOM 0 HA ILE A 4 126.091 0.631 9.306 1.00 0.00 H new ATOM 0 HB ILE A 4 127.569 -0.493 11.060 1.00 0.00 H new ATOM 0 HG12 ILE A 4 129.443 1.320 10.698 1.00 0.00 H new ATOM 0 HG13 ILE A 4 128.481 1.824 9.323 1.00 0.00 H new ATOM 0 HG21 ILE A 4 129.903 -0.972 10.362 1.00 0.00 H new ATOM 0 HG22 ILE A 4 128.749 -2.021 9.504 1.00 0.00 H new ATOM 0 HG23 ILE A 4 129.467 -0.622 8.672 1.00 0.00 H new ATOM 0 HD11 ILE A 4 127.844 3.101 11.353 1.00 0.00 H new ATOM 0 HD12 ILE A 4 126.486 2.092 10.800 1.00 0.00 H new ATOM 0 HD13 ILE A 4 127.464 1.581 12.197 1.00 0.00 H new ATOM 57 N LYS A 5 127.303 1.375 7.263 1.00 0.00 N ATOM 58 CA LYS A 5 127.772 1.747 5.934 1.00 0.00 C ATOM 59 C LYS A 5 129.161 2.371 5.990 1.00 0.00 C ATOM 60 O LYS A 5 129.561 2.951 7.000 1.00 0.00 O ATOM 61 CB LYS A 5 126.794 2.733 5.297 1.00 0.00 C ATOM 62 CG LYS A 5 125.437 2.054 5.099 1.00 0.00 C ATOM 63 CD LYS A 5 124.495 3.003 4.356 1.00 0.00 C ATOM 64 CE LYS A 5 123.105 2.372 4.259 1.00 0.00 C ATOM 65 NZ LYS A 5 122.112 3.412 3.869 1.00 0.00 N ATOM 0 H LYS A 5 126.941 2.149 7.820 1.00 0.00 H new ATOM 0 HA LYS A 5 127.829 0.841 5.331 1.00 0.00 H new ATOM 0 HB2 LYS A 5 126.683 3.612 5.932 1.00 0.00 H new ATOM 0 HB3 LYS A 5 127.182 3.079 4.339 1.00 0.00 H new ATOM 0 HG2 LYS A 5 125.560 1.130 4.534 1.00 0.00 H new ATOM 0 HG3 LYS A 5 125.010 1.783 6.064 1.00 0.00 H new ATOM 0 HD2 LYS A 5 124.437 3.958 4.879 1.00 0.00 H new ATOM 0 HD3 LYS A 5 124.882 3.209 3.358 1.00 0.00 H new ATOM 0 HE2 LYS A 5 123.110 1.566 3.525 1.00 0.00 H new ATOM 0 HE3 LYS A 5 122.827 1.930 5.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 121.167 2.982 3.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 122.100 4.166 4.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 122.375 3.814 2.946 1.00 0.00 H new ATOM 79 N CYS A 6 129.886 2.248 4.884 1.00 0.00 N ATOM 80 CA CYS A 6 131.229 2.801 4.784 1.00 0.00 C ATOM 81 C CYS A 6 131.401 3.507 3.443 1.00 0.00 C ATOM 82 O CYS A 6 130.647 3.258 2.503 1.00 0.00 O ATOM 83 CB CYS A 6 132.267 1.684 4.911 1.00 0.00 C ATOM 84 SG CYS A 6 133.423 1.775 3.521 1.00 0.00 S ATOM 0 H CYS A 6 129.564 1.769 4.043 1.00 0.00 H new ATOM 0 HA CYS A 6 131.375 3.519 5.591 1.00 0.00 H new ATOM 0 HB2 CYS A 6 132.806 1.779 5.853 1.00 0.00 H new ATOM 0 HB3 CYS A 6 131.772 0.713 4.924 1.00 0.00 H new ATOM 0 HG CYS A 6 134.172 0.712 3.509 1.00 0.00 H new ATOM 90 N VAL A 7 132.391 4.386 3.359 1.00 0.00 N ATOM 91 CA VAL A 7 132.639 5.117 2.118 1.00 0.00 C ATOM 92 C VAL A 7 134.083 4.931 1.670 1.00 0.00 C ATOM 93 O VAL A 7 134.952 4.607 2.480 1.00 0.00 O ATOM 94 CB VAL A 7 132.350 6.605 2.321 1.00 0.00 C ATOM 95 CG1 VAL A 7 130.888 6.790 2.730 1.00 0.00 C ATOM 96 CG2 VAL A 7 133.259 7.153 3.421 1.00 0.00 C ATOM 0 H VAL A 7 133.029 4.610 4.123 1.00 0.00 H new ATOM 0 HA VAL A 7 131.978 4.723 1.346 1.00 0.00 H new ATOM 0 HB VAL A 7 132.538 7.142 1.391 1.00 0.00 H new ATOM 0 HG11 VAL A 7 130.682 7.851 2.875 1.00 0.00 H new ATOM 0 HG12 VAL A 7 130.239 6.398 1.947 1.00 0.00 H new ATOM 0 HG13 VAL A 7 130.700 6.254 3.660 1.00 0.00 H new ATOM 0 HG21 VAL A 7 133.055 8.214 3.567 1.00 0.00 H new ATOM 0 HG22 VAL A 7 133.070 6.616 4.350 1.00 0.00 H new ATOM 0 HG23 VAL A 7 134.301 7.021 3.131 1.00 0.00 H new ATOM 100 N VAL A 8 134.342 5.127 0.376 1.00 0.00 N ATOM 101 CA VAL A 8 135.691 4.959 -0.137 1.00 0.00 C ATOM 102 C VAL A 8 136.315 6.301 -0.504 1.00 0.00 C ATOM 103 O VAL A 8 135.747 7.074 -1.277 1.00 0.00 O ATOM 104 CB VAL A 8 135.661 4.070 -1.372 1.00 0.00 C ATOM 105 CG1 VAL A 8 137.093 3.734 -1.790 1.00 0.00 C ATOM 106 CG2 VAL A 8 134.903 2.780 -1.049 1.00 0.00 C ATOM 0 H VAL A 8 133.647 5.397 -0.320 1.00 0.00 H new ATOM 0 HA VAL A 8 136.294 4.498 0.645 1.00 0.00 H new ATOM 0 HB VAL A 8 135.159 4.591 -2.187 1.00 0.00 H new ATOM 0 HG11 VAL A 8 137.074 3.097 -2.674 1.00 0.00 H new ATOM 0 HG12 VAL A 8 137.631 4.654 -2.017 1.00 0.00 H new ATOM 0 HG13 VAL A 8 137.596 3.211 -0.977 1.00 0.00 H new ATOM 0 HG21 VAL A 8 134.880 2.141 -1.932 1.00 0.00 H new ATOM 0 HG22 VAL A 8 135.405 2.257 -0.235 1.00 0.00 H new ATOM 0 HG23 VAL A 8 133.883 3.022 -0.750 1.00 0.00 H new ATOM 110 N VAL A 9 137.499 6.562 0.042 1.00 0.00 N ATOM 111 CA VAL A 9 138.213 7.800 -0.245 1.00 0.00 C ATOM 112 C VAL A 9 139.673 7.490 -0.553 1.00 0.00 C ATOM 113 O VAL A 9 140.336 6.788 0.205 1.00 0.00 O ATOM 114 CB VAL A 9 138.129 8.745 0.954 1.00 0.00 C ATOM 115 CG1 VAL A 9 138.805 10.073 0.609 1.00 0.00 C ATOM 116 CG2 VAL A 9 136.660 8.997 1.305 1.00 0.00 C ATOM 0 H VAL A 9 137.983 5.934 0.684 1.00 0.00 H new ATOM 0 HA VAL A 9 137.755 8.282 -1.109 1.00 0.00 H new ATOM 0 HB VAL A 9 138.634 8.292 1.807 1.00 0.00 H new ATOM 0 HG11 VAL A 9 138.744 10.745 1.465 1.00 0.00 H new ATOM 0 HG12 VAL A 9 139.851 9.895 0.361 1.00 0.00 H new ATOM 0 HG13 VAL A 9 138.302 10.526 -0.245 1.00 0.00 H new ATOM 0 HG21 VAL A 9 136.601 9.671 2.160 1.00 0.00 H new ATOM 0 HG22 VAL A 9 136.154 9.448 0.451 1.00 0.00 H new ATOM 0 HG23 VAL A 9 136.178 8.052 1.554 1.00 0.00 H new ATOM 120 N GLY A 10 140.179 8.007 -1.662 1.00 0.00 N ATOM 121 CA GLY A 10 141.566 7.749 -2.025 1.00 0.00 C ATOM 122 C GLY A 10 142.048 8.712 -3.095 1.00 0.00 C ATOM 123 O GLY A 10 141.677 9.884 -3.101 1.00 0.00 O ATOM 0 H GLY A 10 139.663 8.596 -2.316 1.00 0.00 H new ATOM 0 HA2 GLY A 10 142.198 7.839 -1.141 1.00 0.00 H new ATOM 0 HA3 GLY A 10 141.665 6.725 -2.384 1.00 0.00 H new ATOM 127 N ASP A 11 142.873 8.206 -4.006 1.00 0.00 N ATOM 128 CA ASP A 11 143.396 9.033 -5.083 1.00 0.00 C ATOM 129 C ASP A 11 142.384 9.099 -6.214 1.00 0.00 C ATOM 130 O ASP A 11 142.143 8.099 -6.890 1.00 0.00 O ATOM 131 CB ASP A 11 144.713 8.451 -5.602 1.00 0.00 C ATOM 132 CG ASP A 11 145.328 9.389 -6.636 1.00 0.00 C ATOM 133 OD1 ASP A 11 144.787 10.465 -6.827 1.00 0.00 O ATOM 134 OD2 ASP A 11 146.331 9.016 -7.221 1.00 0.00 O ATOM 0 H ASP A 11 143.190 7.237 -4.019 1.00 0.00 H new ATOM 0 HA ASP A 11 143.579 10.038 -4.702 1.00 0.00 H new ATOM 0 HB2 ASP A 11 145.407 8.305 -4.774 1.00 0.00 H new ATOM 0 HB3 ASP A 11 144.537 7.472 -6.047 1.00 0.00 H new ATOM 139 N GLY A 12 141.805 10.280 -6.415 1.00 0.00 N ATOM 140 CA GLY A 12 140.817 10.471 -7.473 1.00 0.00 C ATOM 141 C GLY A 12 140.079 9.171 -7.772 1.00 0.00 C ATOM 142 O GLY A 12 139.041 8.878 -7.179 1.00 0.00 O ATOM 0 H GLY A 12 142.001 11.115 -5.863 1.00 0.00 H new ATOM 0 HA2 GLY A 12 140.103 11.238 -7.174 1.00 0.00 H new ATOM 0 HA3 GLY A 12 141.311 10.829 -8.376 1.00 0.00 H new ATOM 146 N ALA A 13 140.621 8.404 -8.709 1.00 0.00 N ATOM 147 CA ALA A 13 140.005 7.141 -9.097 1.00 0.00 C ATOM 148 C ALA A 13 141.024 6.004 -9.122 1.00 0.00 C ATOM 149 O ALA A 13 142.060 6.094 -9.780 1.00 0.00 O ATOM 150 CB ALA A 13 139.369 7.280 -10.481 1.00 0.00 C ATOM 0 H ALA A 13 141.479 8.631 -9.211 1.00 0.00 H new ATOM 0 HA ALA A 13 139.243 6.900 -8.356 1.00 0.00 H new ATOM 0 HB1 ALA A 13 138.910 6.334 -10.767 1.00 0.00 H new ATOM 0 HB2 ALA A 13 138.608 8.060 -10.455 1.00 0.00 H new ATOM 0 HB3 ALA A 13 140.136 7.546 -11.209 1.00 0.00 H new ATOM 156 N VAL A 14 140.704 4.928 -8.412 1.00 0.00 N ATOM 157 CA VAL A 14 141.572 3.757 -8.363 1.00 0.00 C ATOM 158 C VAL A 14 140.724 2.494 -8.498 1.00 0.00 C ATOM 159 O VAL A 14 139.517 2.575 -8.727 1.00 0.00 O ATOM 160 CB VAL A 14 142.360 3.727 -7.048 1.00 0.00 C ATOM 161 CG1 VAL A 14 143.791 3.246 -7.314 1.00 0.00 C ATOM 162 CG2 VAL A 14 142.408 5.134 -6.447 1.00 0.00 C ATOM 0 H VAL A 14 139.849 4.842 -7.862 1.00 0.00 H new ATOM 0 HA VAL A 14 142.284 3.806 -9.186 1.00 0.00 H new ATOM 0 HB VAL A 14 141.869 3.046 -6.353 1.00 0.00 H new ATOM 0 HG11 VAL A 14 144.348 3.226 -6.377 1.00 0.00 H new ATOM 0 HG12 VAL A 14 143.764 2.244 -7.742 1.00 0.00 H new ATOM 0 HG13 VAL A 14 144.279 3.926 -8.012 1.00 0.00 H new ATOM 0 HG21 VAL A 14 142.968 5.111 -5.512 1.00 0.00 H new ATOM 0 HG22 VAL A 14 142.897 5.812 -7.147 1.00 0.00 H new ATOM 0 HG23 VAL A 14 141.393 5.482 -6.253 1.00 0.00 H new ATOM 166 N GLY A 15 141.349 1.330 -8.358 1.00 0.00 N ATOM 167 CA GLY A 15 140.617 0.069 -8.472 1.00 0.00 C ATOM 168 C GLY A 15 139.592 -0.080 -7.346 1.00 0.00 C ATOM 169 O GLY A 15 139.451 -1.156 -6.765 1.00 0.00 O ATOM 0 H GLY A 15 142.346 1.231 -8.168 1.00 0.00 H new ATOM 0 HA2 GLY A 15 140.111 0.025 -9.436 1.00 0.00 H new ATOM 0 HA3 GLY A 15 141.318 -0.765 -8.442 1.00 0.00 H new ATOM 173 N LYS A 16 138.886 1.006 -7.037 1.00 0.00 N ATOM 174 CA LYS A 16 137.889 0.986 -5.972 1.00 0.00 C ATOM 175 C LYS A 16 136.758 -0.002 -6.277 1.00 0.00 C ATOM 176 O LYS A 16 136.222 -0.639 -5.370 1.00 0.00 O ATOM 177 CB LYS A 16 137.306 2.391 -5.796 1.00 0.00 C ATOM 178 CG LYS A 16 138.417 3.360 -5.388 1.00 0.00 C ATOM 179 CD LYS A 16 137.822 4.743 -5.120 1.00 0.00 C ATOM 180 CE LYS A 16 138.948 5.727 -4.798 1.00 0.00 C ATOM 181 NZ LYS A 16 138.554 6.582 -3.642 1.00 0.00 N ATOM 0 H LYS A 16 138.986 1.906 -7.507 1.00 0.00 H new ATOM 0 HA LYS A 16 138.380 0.663 -5.054 1.00 0.00 H new ATOM 0 HB2 LYS A 16 136.843 2.723 -6.726 1.00 0.00 H new ATOM 0 HB3 LYS A 16 136.524 2.379 -5.037 1.00 0.00 H new ATOM 0 HG2 LYS A 16 138.924 2.992 -4.496 1.00 0.00 H new ATOM 0 HG3 LYS A 16 139.166 3.423 -6.177 1.00 0.00 H new ATOM 0 HD2 LYS A 16 137.263 5.085 -5.991 1.00 0.00 H new ATOM 0 HD3 LYS A 16 137.119 4.694 -4.289 1.00 0.00 H new ATOM 0 HE2 LYS A 16 139.863 5.183 -4.565 1.00 0.00 H new ATOM 0 HE3 LYS A 16 139.160 6.349 -5.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 138.600 7.583 -3.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 137.583 6.347 -3.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 139.203 6.412 -2.848 1.00 0.00 H new ATOM 195 N THR A 17 136.380 -0.107 -7.548 1.00 0.00 N ATOM 196 CA THR A 17 135.290 -1.001 -7.941 1.00 0.00 C ATOM 197 C THR A 17 135.645 -2.475 -7.720 1.00 0.00 C ATOM 198 O THR A 17 134.860 -3.225 -7.141 1.00 0.00 O ATOM 199 CB THR A 17 134.943 -0.777 -9.413 1.00 0.00 C ATOM 200 OG1 THR A 17 134.663 0.600 -9.623 1.00 0.00 O ATOM 201 CG2 THR A 17 133.717 -1.612 -9.786 1.00 0.00 C ATOM 0 H THR A 17 136.806 0.409 -8.318 1.00 0.00 H new ATOM 0 HA THR A 17 134.432 -0.767 -7.311 1.00 0.00 H new ATOM 0 HB THR A 17 135.785 -1.079 -10.036 1.00 0.00 H new ATOM 0 HG1 THR A 17 134.311 0.992 -8.797 1.00 0.00 H new ATOM 0 HG21 THR A 17 133.472 -1.450 -10.836 1.00 0.00 H new ATOM 0 HG22 THR A 17 133.932 -2.668 -9.622 1.00 0.00 H new ATOM 0 HG23 THR A 17 132.871 -1.314 -9.166 1.00 0.00 H new ATOM 206 N CYS A 18 136.819 -2.885 -8.189 1.00 0.00 N ATOM 207 CA CYS A 18 137.250 -4.275 -8.038 1.00 0.00 C ATOM 208 C CYS A 18 137.386 -4.641 -6.563 1.00 0.00 C ATOM 209 O CYS A 18 137.195 -5.794 -6.172 1.00 0.00 O ATOM 210 CB CYS A 18 138.593 -4.481 -8.743 1.00 0.00 C ATOM 211 SG CYS A 18 138.388 -4.218 -10.522 1.00 0.00 S ATOM 0 H CYS A 18 137.485 -2.283 -8.673 1.00 0.00 H new ATOM 0 HA CYS A 18 136.497 -4.920 -8.490 1.00 0.00 H new ATOM 0 HB2 CYS A 18 139.335 -3.788 -8.345 1.00 0.00 H new ATOM 0 HB3 CYS A 18 138.964 -5.488 -8.554 1.00 0.00 H new ATOM 0 HG CYS A 18 139.529 -4.391 -11.121 1.00 0.00 H new ATOM 217 N LEU A 19 137.715 -3.643 -5.758 1.00 0.00 N ATOM 218 CA LEU A 19 137.877 -3.837 -4.320 1.00 0.00 C ATOM 219 C LEU A 19 136.602 -4.406 -3.701 1.00 0.00 C ATOM 220 O LEU A 19 136.657 -5.292 -2.850 1.00 0.00 O ATOM 221 CB LEU A 19 138.224 -2.500 -3.663 1.00 0.00 C ATOM 222 CG LEU A 19 138.446 -2.696 -2.163 1.00 0.00 C ATOM 223 CD1 LEU A 19 139.654 -3.605 -1.939 1.00 0.00 C ATOM 224 CD2 LEU A 19 138.706 -1.334 -1.514 1.00 0.00 C ATOM 0 H LEU A 19 137.876 -2.687 -6.074 1.00 0.00 H new ATOM 0 HA LEU A 19 138.684 -4.550 -4.151 1.00 0.00 H new ATOM 0 HB2 LEU A 19 139.121 -2.083 -4.120 1.00 0.00 H new ATOM 0 HB3 LEU A 19 137.419 -1.784 -3.829 1.00 0.00 H new ATOM 0 HG LEU A 19 137.563 -3.154 -1.718 1.00 0.00 H new ATOM 0 HD11 LEU A 19 139.811 -3.744 -0.869 1.00 0.00 H new ATOM 0 HD12 LEU A 19 139.473 -4.572 -2.408 1.00 0.00 H new ATOM 0 HD13 LEU A 19 140.540 -3.148 -2.380 1.00 0.00 H new ATOM 0 HD21 LEU A 19 138.865 -1.465 -0.444 1.00 0.00 H new ATOM 0 HD22 LEU A 19 139.592 -0.882 -1.960 1.00 0.00 H new ATOM 0 HD23 LEU A 19 137.846 -0.684 -1.676 1.00 0.00 H new ATOM 230 N LEU A 20 135.453 -3.898 -4.135 1.00 0.00 N ATOM 231 CA LEU A 20 134.177 -4.369 -3.620 1.00 0.00 C ATOM 232 C LEU A 20 133.926 -5.814 -4.042 1.00 0.00 C ATOM 233 O LEU A 20 133.382 -6.613 -3.281 1.00 0.00 O ATOM 234 CB LEU A 20 133.054 -3.475 -4.145 1.00 0.00 C ATOM 235 CG LEU A 20 131.701 -4.104 -3.813 1.00 0.00 C ATOM 236 CD1 LEU A 20 130.714 -3.010 -3.408 1.00 0.00 C ATOM 237 CD2 LEU A 20 131.168 -4.834 -5.048 1.00 0.00 C ATOM 0 H LEU A 20 135.381 -3.163 -4.839 1.00 0.00 H new ATOM 0 HA LEU A 20 134.201 -4.326 -2.531 1.00 0.00 H new ATOM 0 HB2 LEU A 20 133.125 -2.484 -3.698 1.00 0.00 H new ATOM 0 HB3 LEU A 20 133.152 -3.346 -5.223 1.00 0.00 H new ATOM 0 HG LEU A 20 131.819 -4.809 -2.990 1.00 0.00 H new ATOM 0 HD11 LEU A 20 129.750 -3.459 -3.171 1.00 0.00 H new ATOM 0 HD12 LEU A 20 131.094 -2.484 -2.532 1.00 0.00 H new ATOM 0 HD13 LEU A 20 130.594 -2.305 -4.231 1.00 0.00 H new ATOM 0 HD21 LEU A 20 130.203 -5.284 -4.816 1.00 0.00 H new ATOM 0 HD22 LEU A 20 131.050 -4.125 -5.867 1.00 0.00 H new ATOM 0 HD23 LEU A 20 131.871 -5.614 -5.342 1.00 0.00 H new ATOM 243 N ILE A 21 134.324 -6.131 -5.267 1.00 0.00 N ATOM 244 CA ILE A 21 134.140 -7.472 -5.812 1.00 0.00 C ATOM 245 C ILE A 21 135.062 -8.479 -5.125 1.00 0.00 C ATOM 246 O ILE A 21 135.114 -9.645 -5.515 1.00 0.00 O ATOM 247 CB ILE A 21 134.432 -7.455 -7.314 1.00 0.00 C ATOM 248 CG1 ILE A 21 133.452 -6.505 -8.009 1.00 0.00 C ATOM 249 CG2 ILE A 21 134.271 -8.865 -7.888 1.00 0.00 C ATOM 250 CD1 ILE A 21 133.856 -6.329 -9.473 1.00 0.00 C ATOM 0 H ILE A 21 134.778 -5.477 -5.905 1.00 0.00 H new ATOM 0 HA ILE A 21 133.108 -7.776 -5.634 1.00 0.00 H new ATOM 0 HB ILE A 21 135.454 -7.114 -7.481 1.00 0.00 H new ATOM 0 HG12 ILE A 21 132.439 -6.902 -7.946 1.00 0.00 H new ATOM 0 HG13 ILE A 21 133.447 -5.539 -7.504 1.00 0.00 H new ATOM 0 HG21 ILE A 21 134.480 -8.848 -8.958 1.00 0.00 H new ATOM 0 HG22 ILE A 21 134.968 -9.541 -7.393 1.00 0.00 H new ATOM 0 HG23 ILE A 21 133.251 -9.211 -7.723 1.00 0.00 H new ATOM 0 HD11 ILE A 21 133.157 -5.653 -9.965 1.00 0.00 H new ATOM 0 HD12 ILE A 21 134.862 -5.912 -9.525 1.00 0.00 H new ATOM 0 HD13 ILE A 21 133.838 -7.297 -9.974 1.00 0.00 H new ATOM 254 N SER A 22 135.803 -8.023 -4.121 1.00 0.00 N ATOM 255 CA SER A 22 136.734 -8.903 -3.420 1.00 0.00 C ATOM 256 C SER A 22 136.011 -10.060 -2.724 1.00 0.00 C ATOM 257 O SER A 22 136.067 -11.190 -3.208 1.00 0.00 O ATOM 258 CB SER A 22 137.518 -8.092 -2.405 1.00 0.00 C ATOM 259 OG SER A 22 138.605 -8.869 -1.920 1.00 0.00 O ATOM 0 H SER A 22 135.779 -7.063 -3.777 1.00 0.00 H new ATOM 0 HA SER A 22 137.411 -9.339 -4.155 1.00 0.00 H new ATOM 0 HB2 SER A 22 137.888 -7.175 -2.863 1.00 0.00 H new ATOM 0 HB3 SER A 22 136.870 -7.797 -1.580 1.00 0.00 H new ATOM 0 HG SER A 22 139.410 -8.312 -1.872 1.00 0.00 H new ATOM 265 N TYR A 23 135.324 -9.809 -1.599 1.00 0.00 N ATOM 266 CA TYR A 23 134.622 -10.895 -0.922 1.00 0.00 C ATOM 267 C TYR A 23 133.581 -11.510 -1.851 1.00 0.00 C ATOM 268 O TYR A 23 133.267 -12.697 -1.756 1.00 0.00 O ATOM 269 CB TYR A 23 133.907 -10.362 0.317 1.00 0.00 C ATOM 270 CG TYR A 23 132.460 -10.107 -0.027 1.00 0.00 C ATOM 271 CD1 TYR A 23 132.108 -8.990 -0.793 1.00 0.00 C ATOM 272 CD2 TYR A 23 131.470 -10.993 0.413 1.00 0.00 C ATOM 273 CE1 TYR A 23 130.765 -8.760 -1.118 1.00 0.00 C ATOM 274 CE2 TYR A 23 130.128 -10.763 0.090 1.00 0.00 C ATOM 275 CZ TYR A 23 129.776 -9.646 -0.676 1.00 0.00 C ATOM 276 OH TYR A 23 128.453 -9.420 -0.997 1.00 0.00 O ATOM 0 H TYR A 23 135.244 -8.894 -1.155 1.00 0.00 H new ATOM 0 HA TYR A 23 135.355 -11.649 -0.636 1.00 0.00 H new ATOM 0 HB2 TYR A 23 133.980 -11.081 1.133 1.00 0.00 H new ATOM 0 HB3 TYR A 23 134.381 -9.442 0.660 1.00 0.00 H new ATOM 0 HD1 TYR A 23 132.871 -8.306 -1.133 1.00 0.00 H new ATOM 0 HD2 TYR A 23 131.742 -11.856 1.003 1.00 0.00 H new ATOM 0 HE1 TYR A 23 130.493 -7.899 -1.710 1.00 0.00 H new ATOM 0 HE2 TYR A 23 129.365 -11.447 0.431 1.00 0.00 H new ATOM 0 HH TYR A 23 127.897 -10.130 -0.613 1.00 0.00 H new ATOM 286 N THR A 24 133.035 -10.681 -2.731 1.00 0.00 N ATOM 287 CA THR A 24 132.006 -11.125 -3.663 1.00 0.00 C ATOM 288 C THR A 24 132.445 -12.370 -4.429 1.00 0.00 C ATOM 289 O THR A 24 131.661 -13.304 -4.606 1.00 0.00 O ATOM 290 CB THR A 24 131.700 -10.006 -4.659 1.00 0.00 C ATOM 291 OG1 THR A 24 131.585 -8.772 -3.963 1.00 0.00 O ATOM 292 CG2 THR A 24 130.388 -10.311 -5.383 1.00 0.00 C ATOM 0 H THR A 24 133.287 -9.697 -2.819 1.00 0.00 H new ATOM 0 HA THR A 24 131.115 -11.373 -3.086 1.00 0.00 H new ATOM 0 HB THR A 24 132.507 -9.937 -5.388 1.00 0.00 H new ATOM 0 HG1 THR A 24 131.463 -8.946 -3.006 1.00 0.00 H new ATOM 0 HG21 THR A 24 130.170 -9.513 -6.093 1.00 0.00 H new ATOM 0 HG22 THR A 24 130.478 -11.257 -5.917 1.00 0.00 H new ATOM 0 HG23 THR A 24 129.579 -10.381 -4.656 1.00 0.00 H new ATOM 297 N THR A 25 133.692 -12.382 -4.888 1.00 0.00 N ATOM 298 CA THR A 25 134.196 -13.527 -5.640 1.00 0.00 C ATOM 299 C THR A 25 135.720 -13.521 -5.707 1.00 0.00 C ATOM 300 O THR A 25 136.353 -14.575 -5.646 1.00 0.00 O ATOM 301 CB THR A 25 133.626 -13.507 -7.061 1.00 0.00 C ATOM 302 OG1 THR A 25 132.950 -12.276 -7.281 1.00 0.00 O ATOM 303 CG2 THR A 25 132.646 -14.667 -7.239 1.00 0.00 C ATOM 0 H THR A 25 134.363 -11.626 -4.756 1.00 0.00 H new ATOM 0 HA THR A 25 133.878 -14.433 -5.124 1.00 0.00 H new ATOM 0 HB THR A 25 134.440 -13.610 -7.779 1.00 0.00 H new ATOM 0 HG1 THR A 25 132.586 -12.261 -8.191 1.00 0.00 H new ATOM 0 HG21 THR A 25 132.242 -14.650 -8.251 1.00 0.00 H new ATOM 0 HG22 THR A 25 133.165 -15.611 -7.071 1.00 0.00 H new ATOM 0 HG23 THR A 25 131.831 -14.568 -6.522 1.00 0.00 H new ATOM 308 N ASN A 26 136.306 -12.335 -5.850 1.00 0.00 N ATOM 309 CA ASN A 26 137.759 -12.223 -5.940 1.00 0.00 C ATOM 310 C ASN A 26 138.303 -13.307 -6.862 1.00 0.00 C ATOM 311 O ASN A 26 138.530 -14.441 -6.436 1.00 0.00 O ATOM 312 CB ASN A 26 138.391 -12.358 -4.552 1.00 0.00 C ATOM 313 CG ASN A 26 137.780 -13.539 -3.808 1.00 0.00 C ATOM 314 OD1 ASN A 26 138.389 -14.694 -3.825 1.00 0.00 O flip ATOM 315 ND2 ASN A 26 136.717 -13.410 -3.201 1.00 0.00 N flip ATOM 0 H ASN A 26 135.805 -11.448 -5.905 1.00 0.00 H new ATOM 0 HA ASN A 26 138.011 -11.243 -6.346 1.00 0.00 H new ATOM 0 HB2 ASN A 26 139.468 -12.496 -4.647 1.00 0.00 H new ATOM 0 HB3 ASN A 26 138.236 -11.441 -3.983 1.00 0.00 H new ATOM 0 HD21 ASN A 26 136.243 -12.507 -3.189 1.00 0.00 H new ATOM 0 HD22 ASN A 26 136.310 -14.206 -2.710 1.00 0.00 H new ATOM 320 N LYS A 27 138.503 -12.958 -8.129 1.00 0.00 N ATOM 321 CA LYS A 27 139.012 -13.923 -9.104 1.00 0.00 C ATOM 322 C LYS A 27 139.770 -13.228 -10.232 1.00 0.00 C ATOM 323 O LYS A 27 140.057 -13.838 -11.261 1.00 0.00 O ATOM 324 CB LYS A 27 137.855 -14.729 -9.706 1.00 0.00 C ATOM 325 CG LYS A 27 137.233 -15.638 -8.642 1.00 0.00 C ATOM 326 CD LYS A 27 136.188 -16.542 -9.302 1.00 0.00 C ATOM 327 CE LYS A 27 135.490 -17.388 -8.236 1.00 0.00 C ATOM 328 NZ LYS A 27 134.155 -17.819 -8.739 1.00 0.00 N ATOM 0 H LYS A 27 138.324 -12.026 -8.504 1.00 0.00 H new ATOM 0 HA LYS A 27 139.697 -14.589 -8.578 1.00 0.00 H new ATOM 0 HB2 LYS A 27 137.099 -14.052 -10.103 1.00 0.00 H new ATOM 0 HB3 LYS A 27 138.216 -15.329 -10.541 1.00 0.00 H new ATOM 0 HG2 LYS A 27 138.005 -16.242 -8.166 1.00 0.00 H new ATOM 0 HG3 LYS A 27 136.770 -15.038 -7.859 1.00 0.00 H new ATOM 0 HD2 LYS A 27 135.456 -15.937 -9.837 1.00 0.00 H new ATOM 0 HD3 LYS A 27 136.666 -17.189 -10.038 1.00 0.00 H new ATOM 0 HE2 LYS A 27 136.098 -18.260 -7.993 1.00 0.00 H new ATOM 0 HE3 LYS A 27 135.376 -16.813 -7.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 133.680 -18.394 -8.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 133.576 -16.981 -8.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 134.276 -18.383 -9.604 1.00 0.00 H new ATOM 342 N LEU A 28 140.088 -11.953 -10.041 1.00 0.00 N ATOM 343 CA LEU A 28 140.810 -11.202 -11.063 1.00 0.00 C ATOM 344 C LEU A 28 139.995 -11.136 -12.356 1.00 0.00 C ATOM 345 O LEU A 28 140.431 -11.600 -13.409 1.00 0.00 O ATOM 346 CB LEU A 28 142.169 -11.862 -11.328 1.00 0.00 C ATOM 347 CG LEU A 28 143.222 -10.778 -11.577 1.00 0.00 C ATOM 348 CD1 LEU A 28 143.475 -10.000 -10.284 1.00 0.00 C ATOM 349 CD2 LEU A 28 144.527 -11.429 -12.039 1.00 0.00 C ATOM 0 H LEU A 28 139.861 -11.422 -9.200 1.00 0.00 H new ATOM 0 HA LEU A 28 140.970 -10.185 -10.705 1.00 0.00 H new ATOM 0 HB2 LEU A 28 142.459 -12.477 -10.476 1.00 0.00 H new ATOM 0 HB3 LEU A 28 142.102 -12.524 -12.191 1.00 0.00 H new ATOM 0 HG LEU A 28 142.861 -10.096 -12.347 1.00 0.00 H new ATOM 0 HD11 LEU A 28 144.225 -9.229 -10.464 1.00 0.00 H new ATOM 0 HD12 LEU A 28 142.547 -9.534 -9.953 1.00 0.00 H new ATOM 0 HD13 LEU A 28 143.834 -10.682 -9.513 1.00 0.00 H new ATOM 0 HD21 LEU A 28 145.276 -10.657 -12.216 1.00 0.00 H new ATOM 0 HD22 LEU A 28 144.885 -12.112 -11.269 1.00 0.00 H new ATOM 0 HD23 LEU A 28 144.351 -11.982 -12.962 1.00 0.00 H new ATOM 355 N PRO A 29 138.826 -10.557 -12.287 1.00 0.00 N ATOM 356 CA PRO A 29 137.923 -10.413 -13.466 1.00 0.00 C ATOM 357 C PRO A 29 138.462 -9.406 -14.480 1.00 0.00 C ATOM 358 O PRO A 29 139.615 -8.982 -14.394 1.00 0.00 O ATOM 359 CB PRO A 29 136.601 -9.930 -12.864 1.00 0.00 C ATOM 360 CG PRO A 29 136.958 -9.299 -11.558 1.00 0.00 C ATOM 361 CD PRO A 29 138.237 -9.977 -11.069 1.00 0.00 C ATOM 0 HA PRO A 29 137.822 -11.347 -14.019 1.00 0.00 H new ATOM 0 HB2 PRO A 29 136.109 -9.215 -13.523 1.00 0.00 H new ATOM 0 HB3 PRO A 29 135.909 -10.760 -12.722 1.00 0.00 H new ATOM 0 HG2 PRO A 29 137.111 -8.226 -11.677 1.00 0.00 H new ATOM 0 HG3 PRO A 29 136.153 -9.427 -10.835 1.00 0.00 H new ATOM 0 HD2 PRO A 29 138.913 -9.262 -10.601 1.00 0.00 H new ATOM 0 HD3 PRO A 29 138.022 -10.745 -10.326 1.00 0.00 H new ATOM 369 N SER A 30 137.624 -9.031 -15.442 1.00 0.00 N ATOM 370 CA SER A 30 138.035 -8.077 -16.468 1.00 0.00 C ATOM 371 C SER A 30 138.512 -6.777 -15.827 1.00 0.00 C ATOM 372 O SER A 30 138.069 -6.410 -14.737 1.00 0.00 O ATOM 373 CB SER A 30 136.867 -7.786 -17.413 1.00 0.00 C ATOM 374 OG SER A 30 136.410 -9.005 -17.983 1.00 0.00 O ATOM 0 H SER A 30 136.666 -9.369 -15.533 1.00 0.00 H new ATOM 0 HA SER A 30 138.857 -8.513 -17.035 1.00 0.00 H new ATOM 0 HB2 SER A 30 136.057 -7.299 -16.870 1.00 0.00 H new ATOM 0 HB3 SER A 30 137.182 -7.099 -18.199 1.00 0.00 H new ATOM 0 HG SER A 30 135.661 -8.823 -18.588 1.00 0.00 H new ATOM 380 N GLU A 31 139.425 -6.090 -16.505 1.00 0.00 N ATOM 381 CA GLU A 31 139.968 -4.837 -15.992 1.00 0.00 C ATOM 382 C GLU A 31 138.867 -3.794 -15.813 1.00 0.00 C ATOM 383 O GLU A 31 138.915 -2.984 -14.888 1.00 0.00 O ATOM 384 CB GLU A 31 141.033 -4.298 -16.949 1.00 0.00 C ATOM 385 CG GLU A 31 141.720 -3.086 -16.319 1.00 0.00 C ATOM 386 CD GLU A 31 142.724 -2.487 -17.298 1.00 0.00 C ATOM 387 OE1 GLU A 31 142.803 -2.982 -18.411 1.00 0.00 O ATOM 388 OE2 GLU A 31 143.400 -1.544 -16.922 1.00 0.00 O ATOM 0 H GLU A 31 139.803 -6.378 -17.407 1.00 0.00 H new ATOM 0 HA GLU A 31 140.417 -5.037 -15.019 1.00 0.00 H new ATOM 0 HB2 GLU A 31 141.768 -5.073 -17.166 1.00 0.00 H new ATOM 0 HB3 GLU A 31 140.576 -4.017 -17.898 1.00 0.00 H new ATOM 0 HG2 GLU A 31 140.976 -2.338 -16.045 1.00 0.00 H new ATOM 0 HG3 GLU A 31 142.227 -3.382 -15.401 1.00 0.00 H new ATOM 395 N TYR A 32 137.880 -3.817 -16.703 1.00 0.00 N ATOM 396 CA TYR A 32 136.779 -2.861 -16.626 1.00 0.00 C ATOM 397 C TYR A 32 135.460 -3.577 -16.348 1.00 0.00 C ATOM 398 O TYR A 32 135.133 -4.570 -16.998 1.00 0.00 O ATOM 399 CB TYR A 32 136.667 -2.084 -17.940 1.00 0.00 C ATOM 400 CG TYR A 32 137.970 -1.374 -18.226 1.00 0.00 C ATOM 401 CD1 TYR A 32 138.249 -0.145 -17.614 1.00 0.00 C ATOM 402 CD2 TYR A 32 138.899 -1.945 -19.105 1.00 0.00 C ATOM 403 CE1 TYR A 32 139.455 0.513 -17.882 1.00 0.00 C ATOM 404 CE2 TYR A 32 140.105 -1.286 -19.374 1.00 0.00 C ATOM 405 CZ TYR A 32 140.383 -0.058 -18.763 1.00 0.00 C ATOM 406 OH TYR A 32 141.572 0.591 -19.029 1.00 0.00 O ATOM 0 H TYR A 32 137.819 -4.478 -17.477 1.00 0.00 H new ATOM 0 HA TYR A 32 136.985 -2.170 -15.808 1.00 0.00 H new ATOM 0 HB2 TYR A 32 136.426 -2.765 -18.757 1.00 0.00 H new ATOM 0 HB3 TYR A 32 135.854 -1.361 -17.878 1.00 0.00 H new ATOM 0 HD1 TYR A 32 137.533 0.295 -16.935 1.00 0.00 H new ATOM 0 HD2 TYR A 32 138.685 -2.893 -19.575 1.00 0.00 H new ATOM 0 HE1 TYR A 32 139.670 1.460 -17.410 1.00 0.00 H new ATOM 0 HE2 TYR A 32 140.821 -1.725 -20.053 1.00 0.00 H new ATOM 0 HH TYR A 32 142.101 0.059 -19.659 1.00 0.00 H new ATOM 416 N VAL A 33 134.706 -3.062 -15.383 1.00 0.00 N ATOM 417 CA VAL A 33 133.420 -3.656 -15.032 1.00 0.00 C ATOM 418 C VAL A 33 132.338 -2.581 -14.965 1.00 0.00 C ATOM 419 O VAL A 33 131.856 -2.237 -13.886 1.00 0.00 O ATOM 420 CB VAL A 33 133.527 -4.367 -13.681 1.00 0.00 C ATOM 421 CG1 VAL A 33 133.911 -5.829 -13.906 1.00 0.00 C ATOM 422 CG2 VAL A 33 134.598 -3.684 -12.827 1.00 0.00 C ATOM 0 H VAL A 33 134.960 -2.241 -14.833 1.00 0.00 H new ATOM 0 HA VAL A 33 133.149 -4.380 -15.800 1.00 0.00 H new ATOM 0 HB VAL A 33 132.567 -4.317 -13.167 1.00 0.00 H new ATOM 0 HG11 VAL A 33 133.988 -6.337 -12.945 1.00 0.00 H new ATOM 0 HG12 VAL A 33 133.149 -6.316 -14.514 1.00 0.00 H new ATOM 0 HG13 VAL A 33 134.871 -5.878 -14.420 1.00 0.00 H new ATOM 0 HG21 VAL A 33 134.674 -4.191 -11.865 1.00 0.00 H new ATOM 0 HG22 VAL A 33 135.559 -3.733 -13.340 1.00 0.00 H new ATOM 0 HG23 VAL A 33 134.325 -2.641 -12.667 1.00 0.00 H new ATOM 426 N PRO A 34 131.958 -2.048 -16.096 1.00 0.00 N ATOM 427 CA PRO A 34 130.917 -0.985 -16.183 1.00 0.00 C ATOM 428 C PRO A 34 129.498 -1.538 -16.055 1.00 0.00 C ATOM 429 O PRO A 34 128.524 -0.822 -16.284 1.00 0.00 O ATOM 430 CB PRO A 34 131.145 -0.379 -17.567 1.00 0.00 C ATOM 431 CG PRO A 34 131.743 -1.475 -18.387 1.00 0.00 C ATOM 432 CD PRO A 34 132.486 -2.405 -17.423 1.00 0.00 C ATOM 0 HA PRO A 34 131.003 -0.263 -15.371 1.00 0.00 H new ATOM 0 HB2 PRO A 34 130.209 -0.029 -18.002 1.00 0.00 H new ATOM 0 HB3 PRO A 34 131.813 0.481 -17.514 1.00 0.00 H new ATOM 0 HG2 PRO A 34 130.968 -2.019 -18.926 1.00 0.00 H new ATOM 0 HG3 PRO A 34 132.426 -1.069 -19.133 1.00 0.00 H new ATOM 0 HD2 PRO A 34 132.299 -3.453 -17.657 1.00 0.00 H new ATOM 0 HD3 PRO A 34 133.564 -2.254 -17.476 1.00 0.00 H new ATOM 440 N THR A 35 129.388 -2.812 -15.695 1.00 0.00 N ATOM 441 CA THR A 35 128.079 -3.440 -15.549 1.00 0.00 C ATOM 442 C THR A 35 127.177 -2.601 -14.648 1.00 0.00 C ATOM 443 O THR A 35 125.981 -2.465 -14.905 1.00 0.00 O ATOM 444 CB THR A 35 128.235 -4.842 -14.956 1.00 0.00 C ATOM 445 OG1 THR A 35 129.115 -5.603 -15.773 1.00 0.00 O ATOM 446 CG2 THR A 35 126.870 -5.527 -14.894 1.00 0.00 C ATOM 0 H THR A 35 130.180 -3.425 -15.501 1.00 0.00 H new ATOM 0 HA THR A 35 127.621 -3.512 -16.535 1.00 0.00 H new ATOM 0 HB THR A 35 128.646 -4.769 -13.949 1.00 0.00 H new ATOM 0 HG1 THR A 35 129.218 -6.501 -15.395 1.00 0.00 H new ATOM 0 HG21 THR A 35 126.983 -6.525 -14.471 1.00 0.00 H new ATOM 0 HG22 THR A 35 126.197 -4.942 -14.267 1.00 0.00 H new ATOM 0 HG23 THR A 35 126.455 -5.603 -15.899 1.00 0.00 H new ATOM 451 N VAL A 36 127.758 -2.035 -13.595 1.00 0.00 N ATOM 452 CA VAL A 36 126.996 -1.205 -12.668 1.00 0.00 C ATOM 453 C VAL A 36 127.712 0.121 -12.436 1.00 0.00 C ATOM 454 O VAL A 36 128.939 0.168 -12.358 1.00 0.00 O ATOM 455 CB VAL A 36 126.822 -1.933 -11.334 1.00 0.00 C ATOM 456 CG1 VAL A 36 128.189 -2.118 -10.673 1.00 0.00 C ATOM 457 CG2 VAL A 36 125.922 -1.104 -10.413 1.00 0.00 C ATOM 0 H VAL A 36 128.746 -2.134 -13.363 1.00 0.00 H new ATOM 0 HA VAL A 36 126.016 -1.009 -13.102 1.00 0.00 H new ATOM 0 HB VAL A 36 126.366 -2.907 -11.509 1.00 0.00 H new ATOM 0 HG11 VAL A 36 128.066 -2.637 -9.722 1.00 0.00 H new ATOM 0 HG12 VAL A 36 128.833 -2.706 -11.327 1.00 0.00 H new ATOM 0 HG13 VAL A 36 128.644 -1.143 -10.498 1.00 0.00 H new ATOM 0 HG21 VAL A 36 125.798 -1.623 -9.462 1.00 0.00 H new ATOM 0 HG22 VAL A 36 126.379 -0.130 -10.238 1.00 0.00 H new ATOM 0 HG23 VAL A 36 124.948 -0.968 -10.882 1.00 0.00 H new ATOM 461 N PHE A 37 126.939 1.200 -12.331 1.00 0.00 N ATOM 462 CA PHE A 37 127.524 2.519 -12.113 1.00 0.00 C ATOM 463 C PHE A 37 128.354 2.524 -10.835 1.00 0.00 C ATOM 464 O PHE A 37 129.506 2.961 -10.833 1.00 0.00 O ATOM 465 CB PHE A 37 126.418 3.570 -12.000 1.00 0.00 C ATOM 466 CG PHE A 37 125.643 3.636 -13.294 1.00 0.00 C ATOM 467 CD1 PHE A 37 126.141 4.373 -14.375 1.00 0.00 C ATOM 468 CD2 PHE A 37 124.424 2.957 -13.412 1.00 0.00 C ATOM 469 CE1 PHE A 37 125.419 4.434 -15.573 1.00 0.00 C ATOM 470 CE2 PHE A 37 123.703 3.017 -14.610 1.00 0.00 C ATOM 471 CZ PHE A 37 124.200 3.755 -15.691 1.00 0.00 C ATOM 0 H PHE A 37 125.921 1.188 -12.392 1.00 0.00 H new ATOM 0 HA PHE A 37 128.167 2.756 -12.960 1.00 0.00 H new ATOM 0 HB2 PHE A 37 125.749 3.320 -11.177 1.00 0.00 H new ATOM 0 HB3 PHE A 37 126.851 4.545 -11.774 1.00 0.00 H new ATOM 0 HD1 PHE A 37 127.082 4.895 -14.285 1.00 0.00 H new ATOM 0 HD2 PHE A 37 124.040 2.387 -12.579 1.00 0.00 H new ATOM 0 HE1 PHE A 37 125.802 5.005 -16.406 1.00 0.00 H new ATOM 0 HE2 PHE A 37 122.763 2.494 -14.701 1.00 0.00 H new ATOM 0 HZ PHE A 37 123.643 3.801 -16.615 1.00 0.00 H new ATOM 481 N ASP A 38 127.763 2.026 -9.753 1.00 0.00 N ATOM 482 CA ASP A 38 128.454 1.969 -8.470 1.00 0.00 C ATOM 483 C ASP A 38 127.589 1.270 -7.427 1.00 0.00 C ATOM 484 O ASP A 38 126.368 1.209 -7.558 1.00 0.00 O ATOM 485 CB ASP A 38 128.791 3.383 -7.989 1.00 0.00 C ATOM 486 CG ASP A 38 127.510 4.165 -7.720 1.00 0.00 C ATOM 487 OD1 ASP A 38 126.460 3.546 -7.668 1.00 0.00 O ATOM 488 OD2 ASP A 38 127.597 5.372 -7.571 1.00 0.00 O ATOM 0 H ASP A 38 126.812 1.658 -9.739 1.00 0.00 H new ATOM 0 HA ASP A 38 129.376 1.403 -8.603 1.00 0.00 H new ATOM 0 HB2 ASP A 38 129.393 3.333 -7.082 1.00 0.00 H new ATOM 0 HB3 ASP A 38 129.390 3.898 -8.740 1.00 0.00 H new ATOM 493 N ASN A 39 128.233 0.745 -6.391 1.00 0.00 N ATOM 494 CA ASN A 39 127.510 0.052 -5.331 1.00 0.00 C ATOM 495 C ASN A 39 127.827 0.670 -3.975 1.00 0.00 C ATOM 496 O ASN A 39 128.739 1.486 -3.851 1.00 0.00 O ATOM 497 CB ASN A 39 127.885 -1.431 -5.319 1.00 0.00 C ATOM 498 CG ASN A 39 126.863 -2.219 -4.507 1.00 0.00 C ATOM 499 OD1 ASN A 39 125.886 -1.651 -4.018 1.00 0.00 O ATOM 500 ND2 ASN A 39 127.030 -3.502 -4.333 1.00 0.00 N ATOM 0 H ASN A 39 129.244 0.785 -6.262 1.00 0.00 H new ATOM 0 HA ASN A 39 126.442 0.152 -5.523 1.00 0.00 H new ATOM 0 HB2 ASN A 39 127.924 -1.813 -6.339 1.00 0.00 H new ATOM 0 HB3 ASN A 39 128.879 -1.560 -4.892 1.00 0.00 H new ATOM 0 HD21 ASN A 39 126.350 -4.036 -3.791 1.00 0.00 H new ATOM 0 HD22 ASN A 39 127.840 -3.971 -4.739 1.00 0.00 H new ATOM 505 N TYR A 40 127.065 0.273 -2.962 1.00 0.00 N ATOM 506 CA TYR A 40 127.263 0.784 -1.616 1.00 0.00 C ATOM 507 C TYR A 40 126.280 0.129 -0.656 1.00 0.00 C ATOM 508 O TYR A 40 126.140 0.554 0.487 1.00 0.00 O ATOM 509 CB TYR A 40 127.083 2.303 -1.589 1.00 0.00 C ATOM 510 CG TYR A 40 126.154 2.726 -2.701 1.00 0.00 C ATOM 511 CD1 TYR A 40 124.872 2.172 -2.794 1.00 0.00 C ATOM 512 CD2 TYR A 40 126.575 3.677 -3.641 1.00 0.00 C ATOM 513 CE1 TYR A 40 124.011 2.566 -3.825 1.00 0.00 C ATOM 514 CE2 TYR A 40 125.712 4.072 -4.671 1.00 0.00 C ATOM 515 CZ TYR A 40 124.430 3.516 -4.763 1.00 0.00 C ATOM 516 OH TYR A 40 123.581 3.906 -5.778 1.00 0.00 O ATOM 0 H TYR A 40 126.305 -0.401 -3.050 1.00 0.00 H new ATOM 0 HA TYR A 40 128.279 0.546 -1.302 1.00 0.00 H new ATOM 0 HB2 TYR A 40 126.678 2.614 -0.626 1.00 0.00 H new ATOM 0 HB3 TYR A 40 128.049 2.795 -1.702 1.00 0.00 H new ATOM 0 HD1 TYR A 40 124.547 1.440 -2.070 1.00 0.00 H new ATOM 0 HD2 TYR A 40 127.564 4.105 -3.571 1.00 0.00 H new ATOM 0 HE1 TYR A 40 123.023 2.136 -3.896 1.00 0.00 H new ATOM 0 HE2 TYR A 40 126.035 4.806 -5.395 1.00 0.00 H new ATOM 0 HH TYR A 40 124.028 4.573 -6.340 1.00 0.00 H new ATOM 526 N ALA A 41 125.612 -0.917 -1.134 1.00 0.00 N ATOM 527 CA ALA A 41 124.648 -1.645 -0.318 1.00 0.00 C ATOM 528 C ALA A 41 124.771 -3.143 -0.583 1.00 0.00 C ATOM 529 O ALA A 41 124.262 -3.650 -1.583 1.00 0.00 O ATOM 530 CB ALA A 41 123.228 -1.180 -0.643 1.00 0.00 C ATOM 0 H ALA A 41 125.721 -1.278 -2.082 1.00 0.00 H new ATOM 0 HA ALA A 41 124.856 -1.447 0.734 1.00 0.00 H new ATOM 0 HB1 ALA A 41 122.515 -1.730 -0.028 1.00 0.00 H new ATOM 0 HB2 ALA A 41 123.138 -0.113 -0.437 1.00 0.00 H new ATOM 0 HB3 ALA A 41 123.017 -1.365 -1.696 1.00 0.00 H new ATOM 536 N VAL A 42 125.455 -3.845 0.314 1.00 0.00 N ATOM 537 CA VAL A 42 125.641 -5.283 0.156 1.00 0.00 C ATOM 538 C VAL A 42 125.388 -6.019 1.466 1.00 0.00 C ATOM 539 O VAL A 42 125.875 -5.617 2.521 1.00 0.00 O ATOM 540 CB VAL A 42 127.061 -5.574 -0.321 1.00 0.00 C ATOM 541 CG1 VAL A 42 127.213 -7.071 -0.587 1.00 0.00 C ATOM 542 CG2 VAL A 42 127.338 -4.796 -1.610 1.00 0.00 C ATOM 0 H VAL A 42 125.885 -3.448 1.149 1.00 0.00 H new ATOM 0 HA VAL A 42 124.922 -5.635 -0.584 1.00 0.00 H new ATOM 0 HB VAL A 42 127.771 -5.267 0.447 1.00 0.00 H new ATOM 0 HG11 VAL A 42 128.227 -7.279 -0.928 1.00 0.00 H new ATOM 0 HG12 VAL A 42 127.018 -7.625 0.331 1.00 0.00 H new ATOM 0 HG13 VAL A 42 126.502 -7.378 -1.354 1.00 0.00 H new ATOM 0 HG21 VAL A 42 128.352 -5.004 -1.950 1.00 0.00 H new ATOM 0 HG22 VAL A 42 126.628 -5.101 -2.379 1.00 0.00 H new ATOM 0 HG23 VAL A 42 127.231 -3.728 -1.420 1.00 0.00 H new ATOM 546 N THR A 43 124.632 -7.108 1.384 1.00 0.00 N ATOM 547 CA THR A 43 124.326 -7.904 2.568 1.00 0.00 C ATOM 548 C THR A 43 124.852 -9.325 2.404 1.00 0.00 C ATOM 549 O THR A 43 124.555 -9.998 1.418 1.00 0.00 O ATOM 550 CB THR A 43 122.813 -7.943 2.796 1.00 0.00 C ATOM 551 OG1 THR A 43 122.541 -8.545 4.054 1.00 0.00 O ATOM 552 CG2 THR A 43 122.149 -8.759 1.686 1.00 0.00 C ATOM 0 H THR A 43 124.222 -7.458 0.518 1.00 0.00 H new ATOM 0 HA THR A 43 124.811 -7.443 3.429 1.00 0.00 H new ATOM 0 HB THR A 43 122.417 -6.927 2.784 1.00 0.00 H new ATOM 0 HG1 THR A 43 121.573 -8.569 4.202 1.00 0.00 H new ATOM 0 HG21 THR A 43 121.072 -8.786 1.849 1.00 0.00 H new ATOM 0 HG22 THR A 43 122.358 -8.298 0.721 1.00 0.00 H new ATOM 0 HG23 THR A 43 122.543 -9.775 1.696 1.00 0.00 H new ATOM 557 N VAL A 44 125.636 -9.774 3.379 1.00 0.00 N ATOM 558 CA VAL A 44 126.201 -11.116 3.332 1.00 0.00 C ATOM 559 C VAL A 44 126.189 -11.755 4.719 1.00 0.00 C ATOM 560 O VAL A 44 126.384 -11.078 5.729 1.00 0.00 O ATOM 561 CB VAL A 44 127.636 -11.058 2.805 1.00 0.00 C ATOM 562 CG1 VAL A 44 128.528 -10.358 3.832 1.00 0.00 C ATOM 563 CG2 VAL A 44 128.155 -12.480 2.562 1.00 0.00 C ATOM 0 H VAL A 44 125.892 -9.233 4.205 1.00 0.00 H new ATOM 0 HA VAL A 44 125.592 -11.723 2.663 1.00 0.00 H new ATOM 0 HB VAL A 44 127.654 -10.503 1.867 1.00 0.00 H new ATOM 0 HG11 VAL A 44 129.551 -10.316 3.457 1.00 0.00 H new ATOM 0 HG12 VAL A 44 128.162 -9.345 4.002 1.00 0.00 H new ATOM 0 HG13 VAL A 44 128.508 -10.913 4.770 1.00 0.00 H new ATOM 0 HG21 VAL A 44 129.177 -12.435 2.187 1.00 0.00 H new ATOM 0 HG22 VAL A 44 128.136 -13.039 3.498 1.00 0.00 H new ATOM 0 HG23 VAL A 44 127.521 -12.978 1.829 1.00 0.00 H new ATOM 567 N MET A 45 125.968 -13.065 4.756 1.00 0.00 N ATOM 568 CA MET A 45 125.947 -13.792 6.020 1.00 0.00 C ATOM 569 C MET A 45 127.221 -14.616 6.173 1.00 0.00 C ATOM 570 O MET A 45 127.534 -15.450 5.323 1.00 0.00 O ATOM 571 CB MET A 45 124.729 -14.716 6.070 1.00 0.00 C ATOM 572 CG MET A 45 123.453 -13.874 6.110 1.00 0.00 C ATOM 573 SD MET A 45 122.017 -14.960 6.298 1.00 0.00 S ATOM 574 CE MET A 45 122.208 -15.859 4.740 1.00 0.00 C ATOM 0 H MET A 45 125.802 -13.642 3.931 1.00 0.00 H new ATOM 0 HA MET A 45 125.887 -13.073 6.837 1.00 0.00 H new ATOM 0 HB2 MET A 45 124.719 -15.370 5.198 1.00 0.00 H new ATOM 0 HB3 MET A 45 124.782 -15.358 6.949 1.00 0.00 H new ATOM 0 HG2 MET A 45 123.498 -13.166 6.938 1.00 0.00 H new ATOM 0 HG3 MET A 45 123.362 -13.289 5.195 1.00 0.00 H new ATOM 0 HE1 MET A 45 121.235 -16.220 4.407 1.00 0.00 H new ATOM 0 HE2 MET A 45 122.626 -15.194 3.985 1.00 0.00 H new ATOM 0 HE3 MET A 45 122.878 -16.706 4.888 1.00 0.00 H new ATOM 584 N ILE A 46 127.949 -14.391 7.262 1.00 0.00 N ATOM 585 CA ILE A 46 129.177 -15.137 7.508 1.00 0.00 C ATOM 586 C ILE A 46 129.217 -15.657 8.941 1.00 0.00 C ATOM 587 O ILE A 46 129.239 -14.877 9.894 1.00 0.00 O ATOM 588 CB ILE A 46 130.393 -14.248 7.246 1.00 0.00 C ATOM 589 CG1 ILE A 46 130.351 -13.747 5.799 1.00 0.00 C ATOM 590 CG2 ILE A 46 131.674 -15.056 7.465 1.00 0.00 C ATOM 591 CD1 ILE A 46 131.459 -12.715 5.578 1.00 0.00 C ATOM 0 H ILE A 46 127.713 -13.706 7.980 1.00 0.00 H new ATOM 0 HA ILE A 46 129.201 -15.989 6.829 1.00 0.00 H new ATOM 0 HB ILE A 46 130.377 -13.399 7.930 1.00 0.00 H new ATOM 0 HG12 ILE A 46 130.477 -14.583 5.111 1.00 0.00 H new ATOM 0 HG13 ILE A 46 129.379 -13.302 5.586 1.00 0.00 H new ATOM 0 HG21 ILE A 46 132.541 -14.422 7.278 1.00 0.00 H new ATOM 0 HG22 ILE A 46 131.704 -15.418 8.493 1.00 0.00 H new ATOM 0 HG23 ILE A 46 131.691 -15.904 6.781 1.00 0.00 H new ATOM 0 HD11 ILE A 46 131.426 -12.361 4.548 1.00 0.00 H new ATOM 0 HD12 ILE A 46 131.313 -11.874 6.256 1.00 0.00 H new ATOM 0 HD13 ILE A 46 132.428 -13.174 5.773 1.00 0.00 H new ATOM 595 N GLY A 47 129.236 -16.977 9.089 1.00 0.00 N ATOM 596 CA GLY A 47 129.283 -17.584 10.414 1.00 0.00 C ATOM 597 C GLY A 47 128.056 -17.203 11.237 1.00 0.00 C ATOM 598 O GLY A 47 128.122 -17.129 12.464 1.00 0.00 O ATOM 0 H GLY A 47 129.220 -17.642 8.316 1.00 0.00 H new ATOM 0 HA2 GLY A 47 129.338 -18.668 10.319 1.00 0.00 H new ATOM 0 HA3 GLY A 47 130.186 -17.263 10.933 1.00 0.00 H new ATOM 602 N GLY A 48 126.940 -16.960 10.559 1.00 0.00 N ATOM 603 CA GLY A 48 125.709 -16.584 11.248 1.00 0.00 C ATOM 604 C GLY A 48 125.757 -15.123 11.683 1.00 0.00 C ATOM 605 O GLY A 48 125.378 -14.785 12.805 1.00 0.00 O ATOM 0 H GLY A 48 126.861 -17.015 9.544 1.00 0.00 H new ATOM 0 HA2 GLY A 48 124.855 -16.744 10.590 1.00 0.00 H new ATOM 0 HA3 GLY A 48 125.565 -17.223 12.119 1.00 0.00 H new ATOM 609 N GLU A 49 126.226 -14.261 10.787 1.00 0.00 N ATOM 610 CA GLU A 49 126.324 -12.837 11.083 1.00 0.00 C ATOM 611 C GLU A 49 125.542 -12.020 10.052 1.00 0.00 C ATOM 612 O GLU A 49 126.106 -11.569 9.055 1.00 0.00 O ATOM 613 CB GLU A 49 127.792 -12.408 11.066 1.00 0.00 C ATOM 614 CG GLU A 49 128.498 -12.963 12.307 1.00 0.00 C ATOM 615 CD GLU A 49 129.996 -13.091 12.050 1.00 0.00 C ATOM 616 OE1 GLU A 49 130.419 -12.782 10.947 1.00 0.00 O ATOM 617 OE2 GLU A 49 130.701 -13.497 12.959 1.00 0.00 O ATOM 0 H GLU A 49 126.543 -14.522 9.853 1.00 0.00 H new ATOM 0 HA GLU A 49 125.900 -12.656 12.071 1.00 0.00 H new ATOM 0 HB2 GLU A 49 128.279 -12.775 10.162 1.00 0.00 H new ATOM 0 HB3 GLU A 49 127.864 -11.321 11.048 1.00 0.00 H new ATOM 0 HG2 GLU A 49 128.323 -12.305 13.158 1.00 0.00 H new ATOM 0 HG3 GLU A 49 128.082 -13.937 12.566 1.00 0.00 H new ATOM 624 N PRO A 50 124.261 -11.833 10.262 1.00 0.00 N ATOM 625 CA PRO A 50 123.405 -11.066 9.315 1.00 0.00 C ATOM 626 C PRO A 50 123.605 -9.558 9.440 1.00 0.00 C ATOM 627 O PRO A 50 123.086 -8.922 10.358 1.00 0.00 O ATOM 628 CB PRO A 50 121.982 -11.470 9.702 1.00 0.00 C ATOM 629 CG PRO A 50 122.052 -11.891 11.134 1.00 0.00 C ATOM 630 CD PRO A 50 123.493 -12.324 11.418 1.00 0.00 C ATOM 0 HA PRO A 50 123.646 -11.289 8.276 1.00 0.00 H new ATOM 0 HB2 PRO A 50 121.291 -10.637 9.573 1.00 0.00 H new ATOM 0 HB3 PRO A 50 121.622 -12.284 9.073 1.00 0.00 H new ATOM 0 HG2 PRO A 50 121.763 -11.070 11.789 1.00 0.00 H new ATOM 0 HG3 PRO A 50 121.360 -12.711 11.326 1.00 0.00 H new ATOM 0 HD2 PRO A 50 123.860 -11.894 12.350 1.00 0.00 H new ATOM 0 HD3 PRO A 50 123.570 -13.407 11.515 1.00 0.00 H new ATOM 638 N TYR A 51 124.361 -8.997 8.503 1.00 0.00 N ATOM 639 CA TYR A 51 124.632 -7.565 8.500 1.00 0.00 C ATOM 640 C TYR A 51 124.967 -7.102 7.088 1.00 0.00 C ATOM 641 O TYR A 51 125.160 -7.925 6.192 1.00 0.00 O ATOM 642 CB TYR A 51 125.788 -7.256 9.450 1.00 0.00 C ATOM 643 CG TYR A 51 125.419 -7.722 10.837 1.00 0.00 C ATOM 644 CD1 TYR A 51 124.695 -6.880 11.688 1.00 0.00 C ATOM 645 CD2 TYR A 51 125.790 -9.002 11.266 1.00 0.00 C ATOM 646 CE1 TYR A 51 124.341 -7.318 12.970 1.00 0.00 C ATOM 647 CE2 TYR A 51 125.438 -9.439 12.549 1.00 0.00 C ATOM 648 CZ TYR A 51 124.713 -8.597 13.401 1.00 0.00 C ATOM 649 OH TYR A 51 124.364 -9.028 14.665 1.00 0.00 O ATOM 0 H TYR A 51 124.796 -9.511 7.737 1.00 0.00 H new ATOM 0 HA TYR A 51 123.745 -7.031 8.840 1.00 0.00 H new ATOM 0 HB2 TYR A 51 126.696 -7.756 9.114 1.00 0.00 H new ATOM 0 HB3 TYR A 51 125.996 -6.186 9.455 1.00 0.00 H new ATOM 0 HD1 TYR A 51 124.409 -5.893 11.356 1.00 0.00 H new ATOM 0 HD2 TYR A 51 126.347 -9.652 10.608 1.00 0.00 H new ATOM 0 HE1 TYR A 51 123.781 -6.669 13.627 1.00 0.00 H new ATOM 0 HE2 TYR A 51 125.726 -10.425 12.881 1.00 0.00 H new ATOM 0 HH TYR A 51 124.699 -9.939 14.804 1.00 0.00 H new ATOM 659 N THR A 52 125.046 -5.790 6.886 1.00 0.00 N ATOM 660 CA THR A 52 125.372 -5.268 5.562 1.00 0.00 C ATOM 661 C THR A 52 126.414 -4.160 5.649 1.00 0.00 C ATOM 662 O THR A 52 126.388 -3.339 6.565 1.00 0.00 O ATOM 663 CB THR A 52 124.110 -4.721 4.887 1.00 0.00 C ATOM 664 OG1 THR A 52 123.860 -3.401 5.351 1.00 0.00 O ATOM 665 CG2 THR A 52 122.920 -5.618 5.225 1.00 0.00 C ATOM 0 H THR A 52 124.893 -5.082 7.604 1.00 0.00 H new ATOM 0 HA THR A 52 125.781 -6.088 4.972 1.00 0.00 H new ATOM 0 HB THR A 52 124.253 -4.704 3.807 1.00 0.00 H new ATOM 0 HG1 THR A 52 123.054 -3.049 4.919 1.00 0.00 H new ATOM 0 HG21 THR A 52 122.023 -5.228 4.745 1.00 0.00 H new ATOM 0 HG22 THR A 52 123.113 -6.629 4.867 1.00 0.00 H new ATOM 0 HG23 THR A 52 122.774 -5.637 6.305 1.00 0.00 H new ATOM 670 N LEU A 53 127.316 -4.128 4.672 1.00 0.00 N ATOM 671 CA LEU A 53 128.345 -3.098 4.632 1.00 0.00 C ATOM 672 C LEU A 53 128.260 -2.329 3.320 1.00 0.00 C ATOM 673 O LEU A 53 128.264 -2.925 2.244 1.00 0.00 O ATOM 674 CB LEU A 53 129.737 -3.715 4.778 1.00 0.00 C ATOM 675 CG LEU A 53 130.777 -2.595 4.853 1.00 0.00 C ATOM 676 CD1 LEU A 53 130.545 -1.766 6.119 1.00 0.00 C ATOM 677 CD2 LEU A 53 132.182 -3.202 4.896 1.00 0.00 C ATOM 0 H LEU A 53 127.354 -4.798 3.904 1.00 0.00 H new ATOM 0 HA LEU A 53 128.178 -2.415 5.465 1.00 0.00 H new ATOM 0 HB2 LEU A 53 129.783 -4.331 5.676 1.00 0.00 H new ATOM 0 HB3 LEU A 53 129.949 -4.369 3.932 1.00 0.00 H new ATOM 0 HG LEU A 53 130.683 -1.956 3.975 1.00 0.00 H new ATOM 0 HD11 LEU A 53 131.286 -0.968 6.172 1.00 0.00 H new ATOM 0 HD12 LEU A 53 129.546 -1.332 6.092 1.00 0.00 H new ATOM 0 HD13 LEU A 53 130.638 -2.407 6.996 1.00 0.00 H new ATOM 0 HD21 LEU A 53 132.922 -2.403 4.949 1.00 0.00 H new ATOM 0 HD22 LEU A 53 132.275 -3.842 5.773 1.00 0.00 H new ATOM 0 HD23 LEU A 53 132.351 -3.793 3.996 1.00 0.00 H new ATOM 683 N GLY A 54 128.175 -1.008 3.414 1.00 0.00 N ATOM 684 CA GLY A 54 128.079 -0.185 2.216 1.00 0.00 C ATOM 685 C GLY A 54 129.435 0.391 1.817 1.00 0.00 C ATOM 686 O GLY A 54 130.142 0.970 2.642 1.00 0.00 O ATOM 0 H GLY A 54 128.171 -0.490 4.293 1.00 0.00 H new ATOM 0 HA2 GLY A 54 127.681 -0.782 1.395 1.00 0.00 H new ATOM 0 HA3 GLY A 54 127.375 0.629 2.389 1.00 0.00 H new ATOM 690 N LEU A 55 129.781 0.239 0.541 1.00 0.00 N ATOM 691 CA LEU A 55 131.050 0.761 0.033 1.00 0.00 C ATOM 692 C LEU A 55 130.791 1.831 -1.023 1.00 0.00 C ATOM 693 O LEU A 55 130.107 1.585 -2.013 1.00 0.00 O ATOM 694 CB LEU A 55 131.883 -0.368 -0.579 1.00 0.00 C ATOM 695 CG LEU A 55 132.084 -1.478 0.454 1.00 0.00 C ATOM 696 CD1 LEU A 55 132.974 -2.573 -0.139 1.00 0.00 C ATOM 697 CD2 LEU A 55 132.757 -0.899 1.701 1.00 0.00 C ATOM 0 H LEU A 55 129.208 -0.237 -0.156 1.00 0.00 H new ATOM 0 HA LEU A 55 131.601 1.200 0.865 1.00 0.00 H new ATOM 0 HB2 LEU A 55 131.382 -0.766 -1.462 1.00 0.00 H new ATOM 0 HB3 LEU A 55 132.849 0.016 -0.907 1.00 0.00 H new ATOM 0 HG LEU A 55 131.116 -1.901 0.724 1.00 0.00 H new ATOM 0 HD11 LEU A 55 133.117 -3.364 0.597 1.00 0.00 H new ATOM 0 HD12 LEU A 55 132.498 -2.987 -1.028 1.00 0.00 H new ATOM 0 HD13 LEU A 55 133.941 -2.149 -0.409 1.00 0.00 H new ATOM 0 HD21 LEU A 55 132.900 -1.690 2.437 1.00 0.00 H new ATOM 0 HD22 LEU A 55 133.724 -0.476 1.429 1.00 0.00 H new ATOM 0 HD23 LEU A 55 132.126 -0.118 2.125 1.00 0.00 H new ATOM 703 N PHE A 56 131.329 3.025 -0.808 1.00 0.00 N ATOM 704 CA PHE A 56 131.117 4.112 -1.753 1.00 0.00 C ATOM 705 C PHE A 56 132.210 4.162 -2.822 1.00 0.00 C ATOM 706 O PHE A 56 132.573 5.240 -3.284 1.00 0.00 O ATOM 707 CB PHE A 56 131.037 5.446 -1.012 1.00 0.00 C ATOM 708 CG PHE A 56 130.469 6.500 -1.929 1.00 0.00 C ATOM 709 CD1 PHE A 56 129.116 6.461 -2.287 1.00 0.00 C ATOM 710 CD2 PHE A 56 131.292 7.523 -2.413 1.00 0.00 C ATOM 711 CE1 PHE A 56 128.587 7.446 -3.131 1.00 0.00 C ATOM 712 CE2 PHE A 56 130.764 8.506 -3.256 1.00 0.00 C ATOM 713 CZ PHE A 56 129.411 8.467 -3.615 1.00 0.00 C ATOM 0 H PHE A 56 131.906 3.263 -0.001 1.00 0.00 H new ATOM 0 HA PHE A 56 130.171 3.926 -2.262 1.00 0.00 H new ATOM 0 HB2 PHE A 56 130.410 5.344 -0.126 1.00 0.00 H new ATOM 0 HB3 PHE A 56 132.028 5.743 -0.669 1.00 0.00 H new ATOM 0 HD1 PHE A 56 128.481 5.672 -1.913 1.00 0.00 H new ATOM 0 HD2 PHE A 56 132.335 7.553 -2.135 1.00 0.00 H new ATOM 0 HE1 PHE A 56 127.543 7.417 -3.408 1.00 0.00 H new ATOM 0 HE2 PHE A 56 131.400 9.295 -3.630 1.00 0.00 H new ATOM 0 HZ PHE A 56 129.004 9.226 -4.266 1.00 0.00 H new ATOM 723 N ASP A 57 132.747 2.993 -3.188 1.00 0.00 N ATOM 724 CA ASP A 57 133.807 2.898 -4.200 1.00 0.00 C ATOM 725 C ASP A 57 133.621 3.918 -5.324 1.00 0.00 C ATOM 726 O ASP A 57 132.569 4.548 -5.443 1.00 0.00 O ATOM 727 CB ASP A 57 133.792 1.492 -4.807 1.00 0.00 C ATOM 728 CG ASP A 57 132.454 1.239 -5.494 1.00 0.00 C ATOM 729 OD1 ASP A 57 131.728 2.197 -5.700 1.00 0.00 O ATOM 730 OD2 ASP A 57 132.177 0.092 -5.802 1.00 0.00 O ATOM 0 H ASP A 57 132.464 2.095 -2.797 1.00 0.00 H new ATOM 0 HA ASP A 57 134.757 3.105 -3.708 1.00 0.00 H new ATOM 0 HB2 ASP A 57 134.605 1.388 -5.525 1.00 0.00 H new ATOM 0 HB3 ASP A 57 133.957 0.748 -4.028 1.00 0.00 H new ATOM 735 N THR A 58 134.652 4.064 -6.160 1.00 0.00 N ATOM 736 CA THR A 58 134.591 4.999 -7.281 1.00 0.00 C ATOM 737 C THR A 58 134.359 6.429 -6.795 1.00 0.00 C ATOM 738 O THR A 58 133.434 7.103 -7.247 1.00 0.00 O ATOM 739 CB THR A 58 133.464 4.598 -8.233 1.00 0.00 C ATOM 740 OG1 THR A 58 133.643 3.247 -8.633 1.00 0.00 O ATOM 741 CG2 THR A 58 133.486 5.505 -9.465 1.00 0.00 C ATOM 0 H THR A 58 135.530 3.551 -6.082 1.00 0.00 H new ATOM 0 HA THR A 58 135.547 4.961 -7.803 1.00 0.00 H new ATOM 0 HB THR A 58 132.505 4.703 -7.726 1.00 0.00 H new ATOM 0 HG1 THR A 58 132.920 2.988 -9.242 1.00 0.00 H new ATOM 0 HG21 THR A 58 132.682 5.218 -10.143 1.00 0.00 H new ATOM 0 HG22 THR A 58 133.348 6.541 -9.156 1.00 0.00 H new ATOM 0 HG23 THR A 58 134.444 5.403 -9.975 1.00 0.00 H new ATOM 746 N ALA A 59 135.208 6.886 -5.880 1.00 0.00 N ATOM 747 CA ALA A 59 135.086 8.240 -5.347 1.00 0.00 C ATOM 748 C ALA A 59 136.467 8.861 -5.148 1.00 0.00 C ATOM 749 O ALA A 59 137.462 8.149 -5.019 1.00 0.00 O ATOM 750 CB ALA A 59 134.338 8.210 -4.013 1.00 0.00 C ATOM 0 H ALA A 59 135.982 6.345 -5.494 1.00 0.00 H new ATOM 0 HA ALA A 59 134.527 8.845 -6.061 1.00 0.00 H new ATOM 0 HB1 ALA A 59 134.251 9.224 -3.622 1.00 0.00 H new ATOM 0 HB2 ALA A 59 133.342 7.792 -4.163 1.00 0.00 H new ATOM 0 HB3 ALA A 59 134.887 7.593 -3.302 1.00 0.00 H new ATOM 756 N GLY A 60 136.523 10.191 -5.123 1.00 0.00 N ATOM 757 CA GLY A 60 137.794 10.885 -4.936 1.00 0.00 C ATOM 758 C GLY A 60 137.667 12.374 -5.244 1.00 0.00 C ATOM 759 O GLY A 60 138.200 13.212 -4.517 1.00 0.00 O ATOM 0 H GLY A 60 135.714 10.803 -5.228 1.00 0.00 H new ATOM 0 HA2 GLY A 60 138.135 10.752 -3.909 1.00 0.00 H new ATOM 0 HA3 GLY A 60 138.551 10.442 -5.583 1.00 0.00 H new ATOM 972 N GLN A 74 125.827 9.239 7.240 1.00 0.00 N ATOM 973 CA GLN A 74 125.303 7.904 6.972 1.00 0.00 C ATOM 974 C GLN A 74 126.417 6.861 7.014 1.00 0.00 C ATOM 975 O GLN A 74 126.202 5.703 6.662 1.00 0.00 O ATOM 976 CB GLN A 74 124.623 7.874 5.602 1.00 0.00 C ATOM 977 CG GLN A 74 123.421 8.821 5.608 1.00 0.00 C ATOM 978 CD GLN A 74 122.757 8.827 4.236 1.00 0.00 C ATOM 979 OE1 GLN A 74 123.362 8.407 3.251 1.00 0.00 O ATOM 980 NE2 GLN A 74 121.539 9.281 4.114 1.00 0.00 N ATOM 0 HA GLN A 74 124.574 7.664 7.746 1.00 0.00 H new ATOM 0 HB2 GLN A 74 125.330 8.171 4.827 1.00 0.00 H new ATOM 0 HB3 GLN A 74 124.299 6.860 5.367 1.00 0.00 H new ATOM 0 HG2 GLN A 74 122.704 8.508 6.367 1.00 0.00 H new ATOM 0 HG3 GLN A 74 123.743 9.829 5.870 1.00 0.00 H new ATOM 0 HE21 GLN A 74 121.040 9.629 4.933 1.00 0.00 H new ATOM 0 HE22 GLN A 74 121.087 9.288 3.200 1.00 0.00 H new ATOM 987 N THR A 75 127.604 7.274 7.448 1.00 0.00 N ATOM 988 CA THR A 75 128.737 6.357 7.533 1.00 0.00 C ATOM 989 C THR A 75 129.406 6.470 8.900 1.00 0.00 C ATOM 990 O THR A 75 129.373 7.528 9.528 1.00 0.00 O ATOM 991 CB THR A 75 129.755 6.680 6.435 1.00 0.00 C ATOM 992 OG1 THR A 75 130.671 5.602 6.307 1.00 0.00 O ATOM 993 CG2 THR A 75 130.513 7.957 6.799 1.00 0.00 C ATOM 0 H THR A 75 127.806 8.229 7.744 1.00 0.00 H new ATOM 0 HA THR A 75 128.372 5.339 7.398 1.00 0.00 H new ATOM 0 HB THR A 75 129.234 6.827 5.489 1.00 0.00 H new ATOM 0 HG1 THR A 75 130.227 4.764 6.556 1.00 0.00 H new ATOM 0 HG21 THR A 75 131.237 8.186 6.017 1.00 0.00 H new ATOM 0 HG22 THR A 75 129.809 8.783 6.895 1.00 0.00 H new ATOM 0 HG23 THR A 75 131.034 7.813 7.745 1.00 0.00 H new ATOM 998 N ASP A 76 130.004 5.375 9.361 1.00 0.00 N ATOM 999 CA ASP A 76 130.663 5.381 10.665 1.00 0.00 C ATOM 1000 C ASP A 76 132.103 4.878 10.571 1.00 0.00 C ATOM 1001 O ASP A 76 132.894 5.077 11.493 1.00 0.00 O ATOM 1002 CB ASP A 76 129.883 4.506 11.648 1.00 0.00 C ATOM 1003 CG ASP A 76 128.526 5.136 11.945 1.00 0.00 C ATOM 1004 OD1 ASP A 76 128.325 6.277 11.557 1.00 0.00 O ATOM 1005 OD2 ASP A 76 127.706 4.471 12.556 1.00 0.00 O ATOM 0 H ASP A 76 130.047 4.486 8.862 1.00 0.00 H new ATOM 0 HA ASP A 76 130.684 6.412 11.020 1.00 0.00 H new ATOM 0 HB2 ASP A 76 129.746 3.509 11.230 1.00 0.00 H new ATOM 0 HB3 ASP A 76 130.449 4.390 12.572 1.00 0.00 H new ATOM 1010 N VAL A 77 132.443 4.226 9.463 1.00 0.00 N ATOM 1011 CA VAL A 77 133.798 3.706 9.295 1.00 0.00 C ATOM 1012 C VAL A 77 134.369 4.101 7.937 1.00 0.00 C ATOM 1013 O VAL A 77 133.941 3.590 6.901 1.00 0.00 O ATOM 1014 CB VAL A 77 133.786 2.183 9.416 1.00 0.00 C ATOM 1015 CG1 VAL A 77 134.579 1.762 10.654 1.00 0.00 C ATOM 1016 CG2 VAL A 77 132.341 1.697 9.546 1.00 0.00 C ATOM 0 H VAL A 77 131.813 4.047 8.681 1.00 0.00 H new ATOM 0 HA VAL A 77 134.427 4.134 10.076 1.00 0.00 H new ATOM 0 HB VAL A 77 134.241 1.743 8.528 1.00 0.00 H new ATOM 0 HG11 VAL A 77 134.570 0.675 10.740 1.00 0.00 H new ATOM 0 HG12 VAL A 77 135.608 2.110 10.563 1.00 0.00 H new ATOM 0 HG13 VAL A 77 134.125 2.200 11.543 1.00 0.00 H new ATOM 0 HG21 VAL A 77 132.329 0.611 9.633 1.00 0.00 H new ATOM 0 HG22 VAL A 77 131.888 2.137 10.434 1.00 0.00 H new ATOM 0 HG23 VAL A 77 131.775 1.997 8.664 1.00 0.00 H new ATOM 1020 N PHE A 78 135.317 5.033 7.943 1.00 0.00 N ATOM 1021 CA PHE A 78 135.903 5.497 6.693 1.00 0.00 C ATOM 1022 C PHE A 78 136.845 4.450 6.119 1.00 0.00 C ATOM 1023 O PHE A 78 137.656 3.867 6.835 1.00 0.00 O ATOM 1024 CB PHE A 78 136.662 6.807 6.912 1.00 0.00 C ATOM 1025 CG PHE A 78 135.689 7.904 7.269 1.00 0.00 C ATOM 1026 CD1 PHE A 78 134.956 8.543 6.264 1.00 0.00 C ATOM 1027 CD2 PHE A 78 135.523 8.283 8.607 1.00 0.00 C ATOM 1028 CE1 PHE A 78 134.056 9.562 6.595 1.00 0.00 C ATOM 1029 CE2 PHE A 78 134.622 9.302 8.938 1.00 0.00 C ATOM 1030 CZ PHE A 78 133.888 9.942 7.931 1.00 0.00 C ATOM 0 H PHE A 78 135.690 5.474 8.784 1.00 0.00 H new ATOM 0 HA PHE A 78 135.093 5.668 5.984 1.00 0.00 H new ATOM 0 HB2 PHE A 78 137.396 6.685 7.709 1.00 0.00 H new ATOM 0 HB3 PHE A 78 137.212 7.075 6.010 1.00 0.00 H new ATOM 0 HD1 PHE A 78 135.085 8.250 5.232 1.00 0.00 H new ATOM 0 HD2 PHE A 78 136.090 7.790 9.383 1.00 0.00 H new ATOM 0 HE1 PHE A 78 133.491 10.056 5.818 1.00 0.00 H new ATOM 0 HE2 PHE A 78 134.493 9.595 9.970 1.00 0.00 H new ATOM 0 HZ PHE A 78 133.193 10.728 8.186 1.00 0.00 H new ATOM 1040 N LEU A 79 136.730 4.222 4.819 1.00 0.00 N ATOM 1041 CA LEU A 79 137.576 3.251 4.149 1.00 0.00 C ATOM 1042 C LEU A 79 138.435 3.945 3.102 1.00 0.00 C ATOM 1043 O LEU A 79 137.917 4.633 2.223 1.00 0.00 O ATOM 1044 CB LEU A 79 136.710 2.177 3.483 1.00 0.00 C ATOM 1045 CG LEU A 79 137.591 1.045 2.946 1.00 0.00 C ATOM 1046 CD1 LEU A 79 136.873 -0.290 3.141 1.00 0.00 C ATOM 1047 CD2 LEU A 79 137.852 1.257 1.451 1.00 0.00 C ATOM 0 H LEU A 79 136.061 4.695 4.211 1.00 0.00 H new ATOM 0 HA LEU A 79 138.226 2.779 4.886 1.00 0.00 H new ATOM 0 HB2 LEU A 79 135.993 1.780 4.202 1.00 0.00 H new ATOM 0 HB3 LEU A 79 136.134 2.617 2.669 1.00 0.00 H new ATOM 0 HG LEU A 79 138.538 1.041 3.485 1.00 0.00 H new ATOM 0 HD11 LEU A 79 137.497 -1.098 2.760 1.00 0.00 H new ATOM 0 HD12 LEU A 79 136.682 -0.449 4.202 1.00 0.00 H new ATOM 0 HD13 LEU A 79 135.927 -0.277 2.600 1.00 0.00 H new ATOM 0 HD21 LEU A 79 138.479 0.450 1.073 1.00 0.00 H new ATOM 0 HD22 LEU A 79 136.904 1.262 0.913 1.00 0.00 H new ATOM 0 HD23 LEU A 79 138.359 2.210 1.302 1.00 0.00 H new ATOM 1053 N VAL A 80 139.745 3.760 3.191 1.00 0.00 N ATOM 1054 CA VAL A 80 140.645 4.379 2.231 1.00 0.00 C ATOM 1055 C VAL A 80 141.070 3.358 1.184 1.00 0.00 C ATOM 1056 O VAL A 80 141.446 2.236 1.521 1.00 0.00 O ATOM 1057 CB VAL A 80 141.876 4.941 2.942 1.00 0.00 C ATOM 1058 CG1 VAL A 80 141.486 6.191 3.731 1.00 0.00 C ATOM 1059 CG2 VAL A 80 142.430 3.890 3.903 1.00 0.00 C ATOM 0 H VAL A 80 140.202 3.195 3.907 1.00 0.00 H new ATOM 0 HA VAL A 80 140.121 5.198 1.739 1.00 0.00 H new ATOM 0 HB VAL A 80 142.634 5.199 2.203 1.00 0.00 H new ATOM 0 HG11 VAL A 80 142.365 6.591 4.237 1.00 0.00 H new ATOM 0 HG12 VAL A 80 141.087 6.942 3.049 1.00 0.00 H new ATOM 0 HG13 VAL A 80 140.727 5.933 4.470 1.00 0.00 H new ATOM 0 HG21 VAL A 80 143.308 4.289 4.411 1.00 0.00 H new ATOM 0 HG22 VAL A 80 141.669 3.634 4.640 1.00 0.00 H new ATOM 0 HG23 VAL A 80 142.709 2.997 3.344 1.00 0.00 H new ATOM 1063 N CYS A 81 140.993 3.743 -0.086 1.00 0.00 N ATOM 1064 CA CYS A 81 141.358 2.833 -1.164 1.00 0.00 C ATOM 1065 C CYS A 81 142.402 3.447 -2.090 1.00 0.00 C ATOM 1066 O CYS A 81 142.240 4.562 -2.591 1.00 0.00 O ATOM 1067 CB CYS A 81 140.116 2.458 -1.969 1.00 0.00 C ATOM 1068 SG CYS A 81 140.592 1.379 -3.338 1.00 0.00 S ATOM 0 H CYS A 81 140.685 4.667 -0.391 1.00 0.00 H new ATOM 0 HA CYS A 81 141.791 1.940 -0.713 1.00 0.00 H new ATOM 0 HB2 CYS A 81 139.392 1.954 -1.328 1.00 0.00 H new ATOM 0 HB3 CYS A 81 139.632 3.357 -2.351 1.00 0.00 H new ATOM 0 HG CYS A 81 140.810 2.096 -4.400 1.00 0.00 H new ATOM 1074 N PHE A 82 143.472 2.699 -2.315 1.00 0.00 N ATOM 1075 CA PHE A 82 144.550 3.150 -3.183 1.00 0.00 C ATOM 1076 C PHE A 82 145.266 1.942 -3.775 1.00 0.00 C ATOM 1077 O PHE A 82 145.224 0.855 -3.200 1.00 0.00 O ATOM 1078 CB PHE A 82 145.550 3.966 -2.367 1.00 0.00 C ATOM 1079 CG PHE A 82 146.342 3.024 -1.495 1.00 0.00 C ATOM 1080 CD1 PHE A 82 145.734 2.412 -0.393 1.00 0.00 C ATOM 1081 CD2 PHE A 82 147.679 2.749 -1.796 1.00 0.00 C ATOM 1082 CE1 PHE A 82 146.463 1.523 0.405 1.00 0.00 C ATOM 1083 CE2 PHE A 82 148.410 1.862 -0.996 1.00 0.00 C ATOM 1084 CZ PHE A 82 147.801 1.248 0.103 1.00 0.00 C ATOM 0 H PHE A 82 143.617 1.775 -1.908 1.00 0.00 H new ATOM 0 HA PHE A 82 144.136 3.763 -3.984 1.00 0.00 H new ATOM 0 HB2 PHE A 82 146.216 4.519 -3.029 1.00 0.00 H new ATOM 0 HB3 PHE A 82 145.028 4.700 -1.754 1.00 0.00 H new ATOM 0 HD1 PHE A 82 144.702 2.626 -0.158 1.00 0.00 H new ATOM 0 HD2 PHE A 82 148.149 3.221 -2.646 1.00 0.00 H new ATOM 0 HE1 PHE A 82 145.993 1.049 1.254 1.00 0.00 H new ATOM 0 HE2 PHE A 82 149.444 1.652 -1.228 1.00 0.00 H new ATOM 0 HZ PHE A 82 148.364 0.562 0.718 1.00 0.00 H new ATOM 1094 N SER A 83 145.946 2.126 -4.901 1.00 0.00 N ATOM 1095 CA SER A 83 146.676 1.014 -5.494 1.00 0.00 C ATOM 1096 C SER A 83 147.815 0.637 -4.552 1.00 0.00 C ATOM 1097 O SER A 83 148.518 1.509 -4.054 1.00 0.00 O ATOM 1098 CB SER A 83 147.221 1.404 -6.868 1.00 0.00 C ATOM 1099 OG SER A 83 148.427 2.137 -6.707 1.00 0.00 O ATOM 0 H SER A 83 146.007 3.008 -5.409 1.00 0.00 H new ATOM 0 HA SER A 83 146.011 0.162 -5.633 1.00 0.00 H new ATOM 0 HB2 SER A 83 147.402 0.511 -7.466 1.00 0.00 H new ATOM 0 HB3 SER A 83 146.487 2.004 -7.406 1.00 0.00 H new ATOM 0 HG SER A 83 148.744 2.047 -5.784 1.00 0.00 H new ATOM 1105 N VAL A 84 147.974 -0.650 -4.264 1.00 0.00 N ATOM 1106 CA VAL A 84 149.012 -1.060 -3.322 1.00 0.00 C ATOM 1107 C VAL A 84 150.405 -1.086 -3.946 1.00 0.00 C ATOM 1108 O VAL A 84 151.250 -1.897 -3.546 1.00 0.00 O ATOM 1109 CB VAL A 84 148.679 -2.434 -2.755 1.00 0.00 C ATOM 1110 CG1 VAL A 84 149.157 -2.518 -1.305 1.00 0.00 C ATOM 1111 CG2 VAL A 84 147.163 -2.638 -2.812 1.00 0.00 C ATOM 0 H VAL A 84 147.416 -1.409 -4.655 1.00 0.00 H new ATOM 0 HA VAL A 84 149.032 -0.315 -2.527 1.00 0.00 H new ATOM 0 HB VAL A 84 149.177 -3.208 -3.339 1.00 0.00 H new ATOM 0 HG11 VAL A 84 148.918 -3.501 -0.900 1.00 0.00 H new ATOM 0 HG12 VAL A 84 150.235 -2.362 -1.268 1.00 0.00 H new ATOM 0 HG13 VAL A 84 148.659 -1.751 -0.713 1.00 0.00 H new ATOM 0 HG21 VAL A 84 146.912 -3.619 -2.408 1.00 0.00 H new ATOM 0 HG22 VAL A 84 146.670 -1.866 -2.222 1.00 0.00 H new ATOM 0 HG23 VAL A 84 146.826 -2.574 -3.847 1.00 0.00 H new ATOM 1115 N VAL A 85 150.663 -0.200 -4.906 1.00 0.00 N ATOM 1116 CA VAL A 85 151.972 -0.152 -5.541 1.00 0.00 C ATOM 1117 C VAL A 85 152.596 1.232 -5.368 1.00 0.00 C ATOM 1118 O VAL A 85 151.905 2.209 -5.076 1.00 0.00 O ATOM 1119 CB VAL A 85 151.841 -0.480 -7.031 1.00 0.00 C ATOM 1120 CG1 VAL A 85 151.243 -1.877 -7.194 1.00 0.00 C ATOM 1121 CG2 VAL A 85 150.925 0.546 -7.701 1.00 0.00 C ATOM 0 H VAL A 85 149.992 0.484 -5.255 1.00 0.00 H new ATOM 0 HA VAL A 85 152.618 -0.890 -5.066 1.00 0.00 H new ATOM 0 HB VAL A 85 152.826 -0.448 -7.497 1.00 0.00 H new ATOM 0 HG11 VAL A 85 151.149 -2.111 -8.254 1.00 0.00 H new ATOM 0 HG12 VAL A 85 151.894 -2.609 -6.717 1.00 0.00 H new ATOM 0 HG13 VAL A 85 150.258 -1.908 -6.727 1.00 0.00 H new ATOM 0 HG21 VAL A 85 150.832 0.313 -8.762 1.00 0.00 H new ATOM 0 HG22 VAL A 85 149.940 0.514 -7.234 1.00 0.00 H new ATOM 0 HG23 VAL A 85 151.349 1.543 -7.585 1.00 0.00 H new ATOM 1125 N SER A 86 153.910 1.297 -5.539 1.00 0.00 N ATOM 1126 CA SER A 86 154.653 2.547 -5.390 1.00 0.00 C ATOM 1127 C SER A 86 153.941 3.752 -6.024 1.00 0.00 C ATOM 1128 O SER A 86 153.679 4.733 -5.335 1.00 0.00 O ATOM 1129 CB SER A 86 156.038 2.396 -6.020 1.00 0.00 C ATOM 1130 OG SER A 86 156.013 1.330 -6.960 1.00 0.00 O ATOM 0 H SER A 86 154.489 0.494 -5.783 1.00 0.00 H new ATOM 0 HA SER A 86 154.729 2.743 -4.320 1.00 0.00 H new ATOM 0 HB2 SER A 86 156.329 3.324 -6.513 1.00 0.00 H new ATOM 0 HB3 SER A 86 156.782 2.198 -5.248 1.00 0.00 H new ATOM 0 HG SER A 86 156.899 1.232 -7.367 1.00 0.00 H new ATOM 1136 N PRO A 87 153.663 3.709 -7.312 1.00 0.00 N ATOM 1137 CA PRO A 87 153.014 4.817 -8.079 1.00 0.00 C ATOM 1138 C PRO A 87 152.187 5.814 -7.252 1.00 0.00 C ATOM 1139 O PRO A 87 150.977 5.930 -7.437 1.00 0.00 O ATOM 1140 CB PRO A 87 152.151 4.043 -9.064 1.00 0.00 C ATOM 1141 CG PRO A 87 152.967 2.831 -9.403 1.00 0.00 C ATOM 1142 CD PRO A 87 153.924 2.579 -8.221 1.00 0.00 C ATOM 0 HA PRO A 87 153.755 5.480 -8.524 1.00 0.00 H new ATOM 0 HB2 PRO A 87 151.194 3.767 -8.622 1.00 0.00 H new ATOM 0 HB3 PRO A 87 151.932 4.636 -9.952 1.00 0.00 H new ATOM 0 HG2 PRO A 87 152.323 1.967 -9.567 1.00 0.00 H new ATOM 0 HG3 PRO A 87 153.527 2.990 -10.324 1.00 0.00 H new ATOM 0 HD2 PRO A 87 153.722 1.623 -7.739 1.00 0.00 H new ATOM 0 HD3 PRO A 87 154.964 2.558 -8.546 1.00 0.00 H new ATOM 1150 N SER A 88 152.882 6.559 -6.390 1.00 0.00 N ATOM 1151 CA SER A 88 152.279 7.601 -5.544 1.00 0.00 C ATOM 1152 C SER A 88 150.853 7.287 -5.076 1.00 0.00 C ATOM 1153 O SER A 88 150.181 8.166 -4.535 1.00 0.00 O ATOM 1154 CB SER A 88 152.269 8.924 -6.308 1.00 0.00 C ATOM 1155 OG SER A 88 153.599 9.269 -6.670 1.00 0.00 O ATOM 0 H SER A 88 153.888 6.458 -6.255 1.00 0.00 H new ATOM 0 HA SER A 88 152.894 7.656 -4.646 1.00 0.00 H new ATOM 0 HB2 SER A 88 151.648 8.837 -7.200 1.00 0.00 H new ATOM 0 HB3 SER A 88 151.833 9.710 -5.691 1.00 0.00 H new ATOM 0 HG SER A 88 153.595 10.117 -7.162 1.00 0.00 H new ATOM 1161 N SER A 89 150.381 6.065 -5.271 1.00 0.00 N ATOM 1162 CA SER A 89 149.032 5.717 -4.844 1.00 0.00 C ATOM 1163 C SER A 89 148.938 5.680 -3.321 1.00 0.00 C ATOM 1164 O SER A 89 147.902 6.011 -2.745 1.00 0.00 O ATOM 1165 CB SER A 89 148.641 4.360 -5.422 1.00 0.00 C ATOM 1166 OG SER A 89 149.527 3.368 -4.923 1.00 0.00 O ATOM 0 H SER A 89 150.901 5.308 -5.715 1.00 0.00 H new ATOM 0 HA SER A 89 148.345 6.479 -5.212 1.00 0.00 H new ATOM 0 HB2 SER A 89 147.614 4.118 -5.150 1.00 0.00 H new ATOM 0 HB3 SER A 89 148.684 4.389 -6.511 1.00 0.00 H new ATOM 0 HG SER A 89 149.068 2.832 -4.243 1.00 0.00 H new ATOM 1172 N PHE A 90 150.024 5.270 -2.675 1.00 0.00 N ATOM 1173 CA PHE A 90 150.052 5.184 -1.220 1.00 0.00 C ATOM 1174 C PHE A 90 150.507 6.501 -0.598 1.00 0.00 C ATOM 1175 O PHE A 90 149.974 6.937 0.422 1.00 0.00 O ATOM 1176 CB PHE A 90 151.009 4.071 -0.792 1.00 0.00 C ATOM 1177 CG PHE A 90 152.413 4.617 -0.710 1.00 0.00 C ATOM 1178 CD1 PHE A 90 153.180 4.754 -1.874 1.00 0.00 C ATOM 1179 CD2 PHE A 90 152.951 4.984 0.530 1.00 0.00 C ATOM 1180 CE1 PHE A 90 154.485 5.257 -1.798 1.00 0.00 C ATOM 1181 CE2 PHE A 90 154.255 5.487 0.605 1.00 0.00 C ATOM 1182 CZ PHE A 90 155.022 5.623 -0.558 1.00 0.00 C ATOM 0 H PHE A 90 150.892 4.993 -3.133 1.00 0.00 H new ATOM 0 HA PHE A 90 149.042 4.967 -0.873 1.00 0.00 H new ATOM 0 HB2 PHE A 90 150.707 3.669 0.175 1.00 0.00 H new ATOM 0 HB3 PHE A 90 150.969 3.248 -1.506 1.00 0.00 H new ATOM 0 HD1 PHE A 90 152.765 4.472 -2.830 1.00 0.00 H new ATOM 0 HD2 PHE A 90 152.360 4.879 1.428 1.00 0.00 H new ATOM 0 HE1 PHE A 90 155.077 5.362 -2.695 1.00 0.00 H new ATOM 0 HE2 PHE A 90 154.670 5.770 1.561 1.00 0.00 H new ATOM 0 HZ PHE A 90 156.028 6.010 -0.499 1.00 0.00 H new ATOM 1192 N GLU A 91 151.514 7.113 -1.207 1.00 0.00 N ATOM 1193 CA GLU A 91 152.067 8.365 -0.700 1.00 0.00 C ATOM 1194 C GLU A 91 151.003 9.453 -0.559 1.00 0.00 C ATOM 1195 O GLU A 91 151.084 10.285 0.342 1.00 0.00 O ATOM 1196 CB GLU A 91 153.171 8.860 -1.640 1.00 0.00 C ATOM 1197 CG GLU A 91 153.854 10.087 -1.029 1.00 0.00 C ATOM 1198 CD GLU A 91 154.894 10.641 -1.996 1.00 0.00 C ATOM 1199 OE1 GLU A 91 155.026 10.088 -3.075 1.00 0.00 O ATOM 1200 OE2 GLU A 91 155.544 11.612 -1.644 1.00 0.00 O ATOM 0 H GLU A 91 151.965 6.764 -2.053 1.00 0.00 H new ATOM 0 HA GLU A 91 152.472 8.163 0.292 1.00 0.00 H new ATOM 0 HB2 GLU A 91 153.903 8.069 -1.806 1.00 0.00 H new ATOM 0 HB3 GLU A 91 152.748 9.113 -2.612 1.00 0.00 H new ATOM 0 HG2 GLU A 91 153.111 10.852 -0.803 1.00 0.00 H new ATOM 0 HG3 GLU A 91 154.330 9.817 -0.086 1.00 0.00 H new ATOM 1207 N ASN A 92 150.022 9.464 -1.453 1.00 0.00 N ATOM 1208 CA ASN A 92 148.987 10.486 -1.401 1.00 0.00 C ATOM 1209 C ASN A 92 147.850 10.105 -0.457 1.00 0.00 C ATOM 1210 O ASN A 92 147.597 10.790 0.530 1.00 0.00 O ATOM 1211 CB ASN A 92 148.425 10.721 -2.804 1.00 0.00 C ATOM 1212 CG ASN A 92 149.533 11.201 -3.735 1.00 0.00 C ATOM 1213 OD1 ASN A 92 150.567 11.686 -3.273 1.00 0.00 O ATOM 1214 ND2 ASN A 92 149.380 11.090 -5.026 1.00 0.00 N ATOM 0 H ASN A 92 149.922 8.788 -2.211 1.00 0.00 H new ATOM 0 HA ASN A 92 149.446 11.398 -1.019 1.00 0.00 H new ATOM 0 HB2 ASN A 92 147.989 9.799 -3.189 1.00 0.00 H new ATOM 0 HB3 ASN A 92 147.625 11.460 -2.765 1.00 0.00 H new ATOM 0 HD21 ASN A 92 150.118 11.405 -5.656 1.00 0.00 H new ATOM 0 HD22 ASN A 92 148.523 10.688 -5.405 1.00 0.00 H new ATOM 1219 N VAL A 93 147.136 9.040 -0.791 1.00 0.00 N ATOM 1220 CA VAL A 93 145.990 8.614 0.009 1.00 0.00 C ATOM 1221 C VAL A 93 146.313 8.519 1.497 1.00 0.00 C ATOM 1222 O VAL A 93 145.598 9.076 2.331 1.00 0.00 O ATOM 1223 CB VAL A 93 145.524 7.239 -0.468 1.00 0.00 C ATOM 1224 CG1 VAL A 93 144.516 6.678 0.533 1.00 0.00 C ATOM 1225 CG2 VAL A 93 144.874 7.347 -1.853 1.00 0.00 C ATOM 0 H VAL A 93 147.326 8.456 -1.605 1.00 0.00 H new ATOM 0 HA VAL A 93 145.213 9.368 -0.121 1.00 0.00 H new ATOM 0 HB VAL A 93 146.384 6.573 -0.539 1.00 0.00 H new ATOM 0 HG11 VAL A 93 144.179 5.697 0.199 1.00 0.00 H new ATOM 0 HG12 VAL A 93 144.988 6.586 1.511 1.00 0.00 H new ATOM 0 HG13 VAL A 93 143.661 7.350 0.604 1.00 0.00 H new ATOM 0 HG21 VAL A 93 144.547 6.360 -2.180 1.00 0.00 H new ATOM 0 HG22 VAL A 93 144.014 8.015 -1.800 1.00 0.00 H new ATOM 0 HG23 VAL A 93 145.598 7.743 -2.565 1.00 0.00 H new ATOM 1229 N LYS A 94 147.363 7.787 1.826 1.00 0.00 N ATOM 1230 CA LYS A 94 147.740 7.594 3.220 1.00 0.00 C ATOM 1231 C LYS A 94 148.229 8.879 3.882 1.00 0.00 C ATOM 1232 O LYS A 94 148.261 8.964 5.110 1.00 0.00 O ATOM 1233 CB LYS A 94 148.825 6.522 3.320 1.00 0.00 C ATOM 1234 CG LYS A 94 148.252 5.179 2.859 1.00 0.00 C ATOM 1235 CD LYS A 94 149.305 4.085 3.035 1.00 0.00 C ATOM 1236 CE LYS A 94 148.781 2.784 2.432 1.00 0.00 C ATOM 1237 NZ LYS A 94 148.635 1.761 3.505 1.00 0.00 N ATOM 0 H LYS A 94 147.969 7.318 1.153 1.00 0.00 H new ATOM 0 HA LYS A 94 146.843 7.276 3.752 1.00 0.00 H new ATOM 0 HB2 LYS A 94 149.681 6.796 2.704 1.00 0.00 H new ATOM 0 HB3 LYS A 94 149.183 6.445 4.347 1.00 0.00 H new ATOM 0 HG2 LYS A 94 147.360 4.935 3.436 1.00 0.00 H new ATOM 0 HG3 LYS A 94 147.949 5.241 1.814 1.00 0.00 H new ATOM 0 HD2 LYS A 94 150.235 4.377 2.548 1.00 0.00 H new ATOM 0 HD3 LYS A 94 149.529 3.946 4.093 1.00 0.00 H new ATOM 0 HE2 LYS A 94 147.820 2.957 1.947 1.00 0.00 H new ATOM 0 HE3 LYS A 94 149.466 2.425 1.664 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 148.977 0.842 3.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 149.192 2.047 4.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 147.633 1.679 3.772 1.00 0.00 H new ATOM 1251 N GLU A 95 148.644 9.864 3.086 1.00 0.00 N ATOM 1252 CA GLU A 95 149.159 11.108 3.670 1.00 0.00 C ATOM 1253 C GLU A 95 148.461 12.360 3.135 1.00 0.00 C ATOM 1254 O GLU A 95 147.927 13.146 3.909 1.00 0.00 O ATOM 1255 CB GLU A 95 150.661 11.217 3.399 1.00 0.00 C ATOM 1256 CG GLU A 95 151.234 12.420 4.151 1.00 0.00 C ATOM 1257 CD GLU A 95 152.710 12.590 3.811 1.00 0.00 C ATOM 1258 OE1 GLU A 95 153.212 11.801 3.027 1.00 0.00 O ATOM 1259 OE2 GLU A 95 153.318 13.507 4.339 1.00 0.00 O ATOM 0 H GLU A 95 148.637 9.832 2.067 1.00 0.00 H new ATOM 0 HA GLU A 95 148.957 11.060 4.740 1.00 0.00 H new ATOM 0 HB2 GLU A 95 151.165 10.304 3.716 1.00 0.00 H new ATOM 0 HB3 GLU A 95 150.841 11.325 2.329 1.00 0.00 H new ATOM 0 HG2 GLU A 95 150.684 13.322 3.884 1.00 0.00 H new ATOM 0 HG3 GLU A 95 151.113 12.280 5.225 1.00 0.00 H new ATOM 1266 N LYS A 96 148.513 12.564 1.825 1.00 0.00 N ATOM 1267 CA LYS A 96 147.919 13.754 1.208 1.00 0.00 C ATOM 1268 C LYS A 96 146.408 13.860 1.447 1.00 0.00 C ATOM 1269 O LYS A 96 145.876 14.965 1.606 1.00 0.00 O ATOM 1270 CB LYS A 96 148.199 13.742 -0.301 1.00 0.00 C ATOM 1271 CG LYS A 96 147.753 15.065 -0.944 1.00 0.00 C ATOM 1272 CD LYS A 96 148.831 16.137 -0.740 1.00 0.00 C ATOM 1273 CE LYS A 96 148.443 17.409 -1.498 1.00 0.00 C ATOM 1274 NZ LYS A 96 147.691 18.320 -0.588 1.00 0.00 N ATOM 0 H LYS A 96 148.958 11.925 1.166 1.00 0.00 H new ATOM 0 HA LYS A 96 148.380 14.623 1.679 1.00 0.00 H new ATOM 0 HB2 LYS A 96 149.263 13.586 -0.478 1.00 0.00 H new ATOM 0 HB3 LYS A 96 147.673 12.909 -0.767 1.00 0.00 H new ATOM 0 HG2 LYS A 96 147.571 14.918 -2.009 1.00 0.00 H new ATOM 0 HG3 LYS A 96 146.813 15.395 -0.502 1.00 0.00 H new ATOM 0 HD2 LYS A 96 148.944 16.355 0.322 1.00 0.00 H new ATOM 0 HD3 LYS A 96 149.794 15.770 -1.095 1.00 0.00 H new ATOM 0 HE2 LYS A 96 149.336 17.908 -1.873 1.00 0.00 H new ATOM 0 HE3 LYS A 96 147.831 17.157 -2.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 147.427 19.184 -1.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 146.831 17.842 -0.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 148.289 18.570 0.225 1.00 0.00 H new ATOM 1288 N TRP A 97 145.706 12.735 1.478 1.00 0.00 N ATOM 1289 CA TRP A 97 144.263 12.780 1.694 1.00 0.00 C ATOM 1290 C TRP A 97 143.935 12.851 3.181 1.00 0.00 C ATOM 1291 O TRP A 97 142.967 13.501 3.577 1.00 0.00 O ATOM 1292 CB TRP A 97 143.594 11.564 1.053 1.00 0.00 C ATOM 1293 CG TRP A 97 143.679 11.696 -0.437 1.00 0.00 C ATOM 1294 CD1 TRP A 97 144.820 11.611 -1.152 1.00 0.00 C ATOM 1295 CD2 TRP A 97 142.612 11.945 -1.399 1.00 0.00 C ATOM 1296 NE1 TRP A 97 144.529 11.777 -2.492 1.00 0.00 N ATOM 1297 CE2 TRP A 97 143.179 11.989 -2.698 1.00 0.00 C ATOM 1298 CE3 TRP A 97 141.223 12.128 -1.277 1.00 0.00 C ATOM 1299 CZ2 TRP A 97 142.396 12.212 -3.831 1.00 0.00 C ATOM 1300 CZ3 TRP A 97 140.433 12.353 -2.416 1.00 0.00 C ATOM 1301 CH2 TRP A 97 141.018 12.394 -3.690 1.00 0.00 C ATOM 0 H TRP A 97 146.098 11.801 1.360 1.00 0.00 H new ATOM 0 HA TRP A 97 143.874 13.682 1.222 1.00 0.00 H new ATOM 0 HB2 TRP A 97 144.085 10.647 1.379 1.00 0.00 H new ATOM 0 HB3 TRP A 97 142.552 11.497 1.367 1.00 0.00 H new ATOM 0 HD1 TRP A 97 145.804 11.440 -0.742 1.00 0.00 H new ATOM 0 HE1 TRP A 97 145.225 11.747 -3.237 1.00 0.00 H new ATOM 0 HE3 TRP A 97 140.761 12.095 -0.301 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 142.852 12.244 -4.810 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 139.368 12.495 -2.310 1.00 0.00 H new ATOM 0 HH2 TRP A 97 140.404 12.566 -4.561 1.00 0.00 H new ATOM 1312 N VAL A 98 144.738 12.184 4.008 1.00 0.00 N ATOM 1313 CA VAL A 98 144.503 12.195 5.445 1.00 0.00 C ATOM 1314 C VAL A 98 144.013 13.569 5.915 1.00 0.00 C ATOM 1315 O VAL A 98 142.958 13.657 6.543 1.00 0.00 O ATOM 1316 CB VAL A 98 145.775 11.797 6.199 1.00 0.00 C ATOM 1317 CG1 VAL A 98 145.793 12.467 7.576 1.00 0.00 C ATOM 1318 CG2 VAL A 98 145.796 10.278 6.379 1.00 0.00 C ATOM 0 H VAL A 98 145.546 11.637 3.710 1.00 0.00 H new ATOM 0 HA VAL A 98 143.723 11.465 5.663 1.00 0.00 H new ATOM 0 HB VAL A 98 146.648 12.117 5.630 1.00 0.00 H new ATOM 0 HG11 VAL A 98 146.700 12.180 8.108 1.00 0.00 H new ATOM 0 HG12 VAL A 98 145.771 13.550 7.454 1.00 0.00 H new ATOM 0 HG13 VAL A 98 144.921 12.148 8.147 1.00 0.00 H new ATOM 0 HG21 VAL A 98 146.699 9.988 6.915 1.00 0.00 H new ATOM 0 HG22 VAL A 98 144.920 9.967 6.948 1.00 0.00 H new ATOM 0 HG23 VAL A 98 145.783 9.796 5.402 1.00 0.00 H new ATOM 1322 N PRO A 99 144.724 14.641 5.630 1.00 0.00 N ATOM 1323 CA PRO A 99 144.281 15.997 6.054 1.00 0.00 C ATOM 1324 C PRO A 99 142.968 16.375 5.385 1.00 0.00 C ATOM 1325 O PRO A 99 142.112 17.015 5.996 1.00 0.00 O ATOM 1326 CB PRO A 99 145.411 16.932 5.616 1.00 0.00 C ATOM 1327 CG PRO A 99 146.179 16.181 4.582 1.00 0.00 C ATOM 1328 CD PRO A 99 145.996 14.697 4.888 1.00 0.00 C ATOM 0 HA PRO A 99 144.098 16.052 7.127 1.00 0.00 H new ATOM 0 HB2 PRO A 99 145.014 17.862 5.210 1.00 0.00 H new ATOM 0 HB3 PRO A 99 146.048 17.199 6.460 1.00 0.00 H new ATOM 0 HG2 PRO A 99 145.815 16.417 3.582 1.00 0.00 H new ATOM 0 HG3 PRO A 99 147.234 16.454 4.610 1.00 0.00 H new ATOM 0 HD2 PRO A 99 145.952 14.103 3.975 1.00 0.00 H new ATOM 0 HD3 PRO A 99 146.822 14.307 5.482 1.00 0.00 H new ATOM 1336 N GLU A 100 142.806 15.963 4.129 1.00 0.00 N ATOM 1337 CA GLU A 100 141.575 16.262 3.408 1.00 0.00 C ATOM 1338 C GLU A 100 140.384 15.622 4.118 1.00 0.00 C ATOM 1339 O GLU A 100 139.340 16.251 4.292 1.00 0.00 O ATOM 1340 CB GLU A 100 141.663 15.732 1.976 1.00 0.00 C ATOM 1341 CG GLU A 100 140.436 16.188 1.186 1.00 0.00 C ATOM 1342 CD GLU A 100 140.488 17.697 0.969 1.00 0.00 C ATOM 1343 OE1 GLU A 100 141.581 18.241 0.986 1.00 0.00 O ATOM 1344 OE2 GLU A 100 139.436 18.287 0.790 1.00 0.00 O ATOM 0 H GLU A 100 143.498 15.432 3.600 1.00 0.00 H new ATOM 0 HA GLU A 100 141.439 17.343 3.382 1.00 0.00 H new ATOM 0 HB2 GLU A 100 142.572 16.096 1.498 1.00 0.00 H new ATOM 0 HB3 GLU A 100 141.720 14.644 1.983 1.00 0.00 H new ATOM 0 HG2 GLU A 100 140.400 15.675 0.225 1.00 0.00 H new ATOM 0 HG3 GLU A 100 139.527 15.921 1.724 1.00 0.00 H new ATOM 1351 N ILE A 101 140.556 14.370 4.536 1.00 0.00 N ATOM 1352 CA ILE A 101 139.495 13.652 5.238 1.00 0.00 C ATOM 1353 C ILE A 101 139.358 14.154 6.673 1.00 0.00 C ATOM 1354 O ILE A 101 138.258 14.203 7.222 1.00 0.00 O ATOM 1355 CB ILE A 101 139.799 12.152 5.256 1.00 0.00 C ATOM 1356 CG1 ILE A 101 139.891 11.631 3.820 1.00 0.00 C ATOM 1357 CG2 ILE A 101 138.679 11.415 5.994 1.00 0.00 C ATOM 1358 CD1 ILE A 101 140.298 10.156 3.841 1.00 0.00 C ATOM 0 H ILE A 101 141.414 13.835 4.402 1.00 0.00 H new ATOM 0 HA ILE A 101 138.559 13.831 4.710 1.00 0.00 H new ATOM 0 HB ILE A 101 140.747 11.980 5.766 1.00 0.00 H new ATOM 0 HG12 ILE A 101 138.931 11.748 3.317 1.00 0.00 H new ATOM 0 HG13 ILE A 101 140.620 12.213 3.256 1.00 0.00 H new ATOM 0 HG21 ILE A 101 138.894 10.346 6.008 1.00 0.00 H new ATOM 0 HG22 ILE A 101 138.613 11.785 7.017 1.00 0.00 H new ATOM 0 HG23 ILE A 101 137.732 11.588 5.483 1.00 0.00 H new ATOM 0 HD11 ILE A 101 140.364 9.782 2.819 1.00 0.00 H new ATOM 0 HD12 ILE A 101 141.267 10.053 4.329 1.00 0.00 H new ATOM 0 HD13 ILE A 101 139.553 9.581 4.390 1.00 0.00 H new ATOM 1362 N THR A 102 140.487 14.508 7.278 1.00 0.00 N ATOM 1363 CA THR A 102 140.491 14.983 8.658 1.00 0.00 C ATOM 1364 C THR A 102 139.460 16.089 8.859 1.00 0.00 C ATOM 1365 O THR A 102 138.758 16.115 9.870 1.00 0.00 O ATOM 1366 CB THR A 102 141.878 15.511 9.023 1.00 0.00 C ATOM 1367 OG1 THR A 102 142.849 14.507 8.763 1.00 0.00 O ATOM 1368 CG2 THR A 102 141.910 15.885 10.506 1.00 0.00 C ATOM 0 H THR A 102 141.407 14.476 6.838 1.00 0.00 H new ATOM 0 HA THR A 102 140.233 14.144 9.305 1.00 0.00 H new ATOM 0 HB THR A 102 142.100 16.394 8.424 1.00 0.00 H new ATOM 0 HG1 THR A 102 142.989 14.430 7.796 1.00 0.00 H new ATOM 0 HG21 THR A 102 142.900 16.261 10.765 1.00 0.00 H new ATOM 0 HG22 THR A 102 141.165 16.656 10.703 1.00 0.00 H new ATOM 0 HG23 THR A 102 141.688 15.004 11.108 1.00 0.00 H new ATOM 1373 N HIS A 103 139.371 16.997 7.896 1.00 0.00 N ATOM 1374 CA HIS A 103 138.417 18.095 7.991 1.00 0.00 C ATOM 1375 C HIS A 103 136.998 17.554 8.142 1.00 0.00 C ATOM 1376 O HIS A 103 136.195 18.095 8.901 1.00 0.00 O ATOM 1377 CB HIS A 103 138.501 18.974 6.741 1.00 0.00 C ATOM 1378 CG HIS A 103 137.653 20.200 6.936 1.00 0.00 C ATOM 1379 ND1 HIS A 103 136.351 20.283 6.467 1.00 0.00 N ATOM 1380 CD2 HIS A 103 137.907 21.403 7.548 1.00 0.00 C ATOM 1381 CE1 HIS A 103 135.876 21.497 6.800 1.00 0.00 C ATOM 1382 NE2 HIS A 103 136.784 22.220 7.460 1.00 0.00 N ATOM 0 H HIS A 103 139.940 16.997 7.050 1.00 0.00 H new ATOM 0 HA HIS A 103 138.664 18.693 8.868 1.00 0.00 H new ATOM 0 HB2 HIS A 103 139.536 19.260 6.553 1.00 0.00 H new ATOM 0 HB3 HIS A 103 138.160 18.418 5.868 1.00 0.00 H new ATOM 0 HD2 HIS A 103 138.837 21.674 8.025 1.00 0.00 H new ATOM 0 HE1 HIS A 103 134.881 21.844 6.562 1.00 0.00 H new ATOM 0 HE2 HIS A 103 136.677 23.168 7.822 1.00 0.00 H new ATOM 1390 N HIS A 104 136.698 16.488 7.409 1.00 0.00 N ATOM 1391 CA HIS A 104 135.373 15.882 7.461 1.00 0.00 C ATOM 1392 C HIS A 104 135.027 15.444 8.882 1.00 0.00 C ATOM 1393 O HIS A 104 133.918 15.682 9.359 1.00 0.00 O ATOM 1394 CB HIS A 104 135.319 14.673 6.526 1.00 0.00 C ATOM 1395 CG HIS A 104 133.913 14.144 6.470 1.00 0.00 C ATOM 1396 ND1 HIS A 104 133.458 13.163 7.337 1.00 0.00 N ATOM 1397 CD2 HIS A 104 132.851 14.446 5.655 1.00 0.00 C ATOM 1398 CE1 HIS A 104 132.173 12.911 7.027 1.00 0.00 C ATOM 1399 NE2 HIS A 104 131.752 13.667 6.009 1.00 0.00 N ATOM 0 H HIS A 104 137.351 16.027 6.775 1.00 0.00 H new ATOM 0 HA HIS A 104 134.645 16.627 7.142 1.00 0.00 H new ATOM 0 HB2 HIS A 104 135.652 14.957 5.528 1.00 0.00 H new ATOM 0 HB3 HIS A 104 135.997 13.896 6.879 1.00 0.00 H new ATOM 0 HD2 HIS A 104 132.865 15.177 4.860 1.00 0.00 H new ATOM 0 HE1 HIS A 104 131.557 12.186 7.539 1.00 0.00 H new ATOM 0 HE2 HIS A 104 130.825 13.672 5.583 1.00 0.00 H new ATOM 1407 N CYS A 105 135.978 14.802 9.555 1.00 0.00 N ATOM 1408 CA CYS A 105 135.748 14.338 10.920 1.00 0.00 C ATOM 1409 C CYS A 105 137.065 13.914 11.584 1.00 0.00 C ATOM 1410 O CYS A 105 137.632 12.882 11.225 1.00 0.00 O ATOM 1411 CB CYS A 105 134.789 13.146 10.903 1.00 0.00 C ATOM 1412 SG CYS A 105 134.110 12.899 12.562 1.00 0.00 S ATOM 0 H CYS A 105 136.905 14.593 9.183 1.00 0.00 H new ATOM 0 HA CYS A 105 135.315 15.159 11.492 1.00 0.00 H new ATOM 0 HB2 CYS A 105 133.983 13.323 10.191 1.00 0.00 H new ATOM 0 HB3 CYS A 105 135.313 12.248 10.575 1.00 0.00 H new ATOM 0 HG CYS A 105 133.309 11.875 12.555 1.00 0.00 H new ATOM 1418 N PRO A 106 137.567 14.672 12.536 1.00 0.00 N ATOM 1419 CA PRO A 106 138.839 14.332 13.234 1.00 0.00 C ATOM 1420 C PRO A 106 138.645 13.265 14.314 1.00 0.00 C ATOM 1421 O PRO A 106 137.574 13.165 14.912 1.00 0.00 O ATOM 1422 CB PRO A 106 139.276 15.660 13.849 1.00 0.00 C ATOM 1423 CG PRO A 106 138.015 16.429 14.073 1.00 0.00 C ATOM 1424 CD PRO A 106 136.989 15.926 13.053 1.00 0.00 C ATOM 0 HA PRO A 106 139.577 13.906 12.554 1.00 0.00 H new ATOM 0 HB2 PRO A 106 139.811 15.502 14.785 1.00 0.00 H new ATOM 0 HB3 PRO A 106 139.951 16.198 13.183 1.00 0.00 H new ATOM 0 HG2 PRO A 106 137.650 16.282 15.090 1.00 0.00 H new ATOM 0 HG3 PRO A 106 138.189 17.498 13.948 1.00 0.00 H new ATOM 0 HD2 PRO A 106 136.018 15.754 13.518 1.00 0.00 H new ATOM 0 HD3 PRO A 106 136.835 16.651 12.254 1.00 0.00 H new ATOM 1432 N LYS A 107 139.691 12.477 14.557 1.00 0.00 N ATOM 1433 CA LYS A 107 139.638 11.421 15.568 1.00 0.00 C ATOM 1434 C LYS A 107 138.550 10.403 15.238 1.00 0.00 C ATOM 1435 O LYS A 107 137.731 10.060 16.089 1.00 0.00 O ATOM 1436 CB LYS A 107 139.372 12.025 16.950 1.00 0.00 C ATOM 1437 CG LYS A 107 140.510 12.977 17.320 1.00 0.00 C ATOM 1438 CD LYS A 107 140.320 13.470 18.755 1.00 0.00 C ATOM 1439 CE LYS A 107 141.375 14.531 19.073 1.00 0.00 C ATOM 1440 NZ LYS A 107 141.514 14.670 20.550 1.00 0.00 N ATOM 0 H LYS A 107 140.584 12.549 14.069 1.00 0.00 H new ATOM 0 HA LYS A 107 140.602 10.912 15.574 1.00 0.00 H new ATOM 0 HB2 LYS A 107 138.422 12.560 16.948 1.00 0.00 H new ATOM 0 HB3 LYS A 107 139.290 11.233 17.695 1.00 0.00 H new ATOM 0 HG2 LYS A 107 141.469 12.468 17.224 1.00 0.00 H new ATOM 0 HG3 LYS A 107 140.528 13.823 16.633 1.00 0.00 H new ATOM 0 HD2 LYS A 107 139.321 13.887 18.878 1.00 0.00 H new ATOM 0 HD3 LYS A 107 140.406 12.636 19.452 1.00 0.00 H new ATOM 0 HE2 LYS A 107 142.332 14.251 18.632 1.00 0.00 H new ATOM 0 HE3 LYS A 107 141.089 15.486 18.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 142.231 15.392 20.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 140.602 14.956 20.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 141.806 13.759 20.958 1.00 0.00 H new ATOM 1454 N THR A 108 138.545 9.926 13.997 1.00 0.00 N ATOM 1455 CA THR A 108 137.548 8.950 13.570 1.00 0.00 C ATOM 1456 C THR A 108 138.222 7.663 13.074 1.00 0.00 C ATOM 1457 O THR A 108 138.825 7.659 12.001 1.00 0.00 O ATOM 1458 CB THR A 108 136.704 9.541 12.438 1.00 0.00 C ATOM 1459 OG1 THR A 108 137.344 10.705 11.931 1.00 0.00 O ATOM 1460 CG2 THR A 108 135.319 9.910 12.971 1.00 0.00 C ATOM 0 H THR A 108 139.213 10.196 13.275 1.00 0.00 H new ATOM 0 HA THR A 108 136.915 8.710 14.424 1.00 0.00 H new ATOM 0 HB THR A 108 136.599 8.806 11.640 1.00 0.00 H new ATOM 0 HG1 THR A 108 136.727 11.465 11.979 1.00 0.00 H new ATOM 0 HG21 THR A 108 134.719 10.331 12.164 1.00 0.00 H new ATOM 0 HG22 THR A 108 134.829 9.017 13.360 1.00 0.00 H new ATOM 0 HG23 THR A 108 135.420 10.645 13.769 1.00 0.00 H new ATOM 1465 N PRO A 109 138.132 6.576 13.811 1.00 0.00 N ATOM 1466 CA PRO A 109 138.753 5.282 13.393 1.00 0.00 C ATOM 1467 C PRO A 109 138.421 4.947 11.941 1.00 0.00 C ATOM 1468 O PRO A 109 137.352 5.311 11.437 1.00 0.00 O ATOM 1469 CB PRO A 109 138.137 4.258 14.347 1.00 0.00 C ATOM 1470 CG PRO A 109 137.765 5.028 15.569 1.00 0.00 C ATOM 1471 CD PRO A 109 137.443 6.452 15.109 1.00 0.00 C ATOM 0 HA PRO A 109 139.842 5.307 13.443 1.00 0.00 H new ATOM 0 HB2 PRO A 109 137.263 3.782 13.902 1.00 0.00 H new ATOM 0 HB3 PRO A 109 138.846 3.465 14.583 1.00 0.00 H new ATOM 0 HG2 PRO A 109 136.905 4.577 16.064 1.00 0.00 H new ATOM 0 HG3 PRO A 109 138.583 5.029 16.290 1.00 0.00 H new ATOM 0 HD2 PRO A 109 136.369 6.604 15.006 1.00 0.00 H new ATOM 0 HD3 PRO A 109 137.803 7.192 15.823 1.00 0.00 H new ATOM 1479 N PHE A 110 139.337 4.269 11.256 1.00 0.00 N ATOM 1480 CA PHE A 110 139.085 3.933 9.862 1.00 0.00 C ATOM 1481 C PHE A 110 139.784 2.656 9.428 1.00 0.00 C ATOM 1482 O PHE A 110 140.733 2.193 10.059 1.00 0.00 O ATOM 1483 CB PHE A 110 139.524 5.086 8.962 1.00 0.00 C ATOM 1484 CG PHE A 110 140.972 5.443 9.205 1.00 0.00 C ATOM 1485 CD1 PHE A 110 142.002 4.632 8.705 1.00 0.00 C ATOM 1486 CD2 PHE A 110 141.281 6.624 9.889 1.00 0.00 C ATOM 1487 CE1 PHE A 110 143.339 5.010 8.896 1.00 0.00 C ATOM 1488 CE2 PHE A 110 142.616 6.992 10.087 1.00 0.00 C ATOM 1489 CZ PHE A 110 143.645 6.187 9.590 1.00 0.00 C ATOM 0 H PHE A 110 140.232 3.951 11.629 1.00 0.00 H new ATOM 0 HA PHE A 110 138.012 3.764 9.766 1.00 0.00 H new ATOM 0 HB2 PHE A 110 139.385 4.809 7.917 1.00 0.00 H new ATOM 0 HB3 PHE A 110 138.895 5.957 9.148 1.00 0.00 H new ATOM 0 HD1 PHE A 110 141.766 3.721 8.175 1.00 0.00 H new ATOM 0 HD2 PHE A 110 140.487 7.253 10.265 1.00 0.00 H new ATOM 0 HE1 PHE A 110 144.134 4.392 8.507 1.00 0.00 H new ATOM 0 HE2 PHE A 110 142.852 7.899 10.624 1.00 0.00 H new ATOM 0 HZ PHE A 110 144.675 6.473 9.741 1.00 0.00 H new ATOM 1499 N LEU A 111 139.304 2.102 8.325 1.00 0.00 N ATOM 1500 CA LEU A 111 139.887 0.884 7.782 1.00 0.00 C ATOM 1501 C LEU A 111 140.884 1.219 6.684 1.00 0.00 C ATOM 1502 O LEU A 111 140.562 1.933 5.736 1.00 0.00 O ATOM 1503 CB LEU A 111 138.792 -0.026 7.214 1.00 0.00 C ATOM 1504 CG LEU A 111 137.999 -0.663 8.359 1.00 0.00 C ATOM 1505 CD1 LEU A 111 137.059 0.373 8.978 1.00 0.00 C ATOM 1506 CD2 LEU A 111 137.176 -1.838 7.819 1.00 0.00 C ATOM 0 H LEU A 111 138.518 2.473 7.791 1.00 0.00 H new ATOM 0 HA LEU A 111 140.402 0.364 8.589 1.00 0.00 H new ATOM 0 HB2 LEU A 111 138.124 0.550 6.574 1.00 0.00 H new ATOM 0 HB3 LEU A 111 139.238 -0.803 6.593 1.00 0.00 H new ATOM 0 HG LEU A 111 138.693 -1.021 9.120 1.00 0.00 H new ATOM 0 HD11 LEU A 111 136.497 -0.086 9.792 1.00 0.00 H new ATOM 0 HD12 LEU A 111 137.642 1.208 9.365 1.00 0.00 H new ATOM 0 HD13 LEU A 111 136.366 0.736 8.218 1.00 0.00 H new ATOM 0 HD21 LEU A 111 136.611 -2.292 8.634 1.00 0.00 H new ATOM 0 HD22 LEU A 111 136.486 -1.479 7.056 1.00 0.00 H new ATOM 0 HD23 LEU A 111 137.844 -2.581 7.383 1.00 0.00 H new ATOM 1512 N LEU A 112 142.093 0.685 6.811 1.00 0.00 N ATOM 1513 CA LEU A 112 143.117 0.924 5.807 1.00 0.00 C ATOM 1514 C LEU A 112 142.998 -0.144 4.734 1.00 0.00 C ATOM 1515 O LEU A 112 143.098 -1.337 5.022 1.00 0.00 O ATOM 1516 CB LEU A 112 144.507 0.877 6.444 1.00 0.00 C ATOM 1517 CG LEU A 112 145.551 1.376 5.444 1.00 0.00 C ATOM 1518 CD1 LEU A 112 145.479 2.902 5.324 1.00 0.00 C ATOM 1519 CD2 LEU A 112 146.941 0.966 5.931 1.00 0.00 C ATOM 0 H LEU A 112 142.384 0.092 7.588 1.00 0.00 H new ATOM 0 HA LEU A 112 142.979 1.912 5.367 1.00 0.00 H new ATOM 0 HB2 LEU A 112 144.527 1.494 7.343 1.00 0.00 H new ATOM 0 HB3 LEU A 112 144.742 -0.142 6.752 1.00 0.00 H new ATOM 0 HG LEU A 112 145.355 0.937 4.466 1.00 0.00 H new ATOM 0 HD11 LEU A 112 146.227 3.246 4.609 1.00 0.00 H new ATOM 0 HD12 LEU A 112 144.487 3.193 4.980 1.00 0.00 H new ATOM 0 HD13 LEU A 112 145.672 3.353 6.297 1.00 0.00 H new ATOM 0 HD21 LEU A 112 147.693 1.318 5.224 1.00 0.00 H new ATOM 0 HD22 LEU A 112 147.129 1.408 6.910 1.00 0.00 H new ATOM 0 HD23 LEU A 112 146.994 -0.120 6.007 1.00 0.00 H new ATOM 1525 N VAL A 113 142.753 0.280 3.503 1.00 0.00 N ATOM 1526 CA VAL A 113 142.587 -0.672 2.416 1.00 0.00 C ATOM 1527 C VAL A 113 143.330 -0.235 1.164 1.00 0.00 C ATOM 1528 O VAL A 113 143.731 0.920 1.030 1.00 0.00 O ATOM 1529 CB VAL A 113 141.103 -0.845 2.101 1.00 0.00 C ATOM 1530 CG1 VAL A 113 140.934 -1.936 1.044 1.00 0.00 C ATOM 1531 CG2 VAL A 113 140.358 -1.249 3.375 1.00 0.00 C ATOM 0 H VAL A 113 142.666 1.260 3.235 1.00 0.00 H new ATOM 0 HA VAL A 113 143.010 -1.623 2.740 1.00 0.00 H new ATOM 0 HB VAL A 113 140.697 0.093 1.724 1.00 0.00 H new ATOM 0 HG11 VAL A 113 139.875 -2.062 0.817 1.00 0.00 H new ATOM 0 HG12 VAL A 113 141.468 -1.650 0.138 1.00 0.00 H new ATOM 0 HG13 VAL A 113 141.338 -2.875 1.422 1.00 0.00 H new ATOM 0 HG21 VAL A 113 139.298 -1.373 3.153 1.00 0.00 H new ATOM 0 HG22 VAL A 113 140.763 -2.189 3.751 1.00 0.00 H new ATOM 0 HG23 VAL A 113 140.482 -0.473 4.130 1.00 0.00 H new ATOM 1535 N GLY A 114 143.484 -1.173 0.242 1.00 0.00 N ATOM 1536 CA GLY A 114 144.156 -0.903 -1.016 1.00 0.00 C ATOM 1537 C GLY A 114 143.458 -1.650 -2.145 1.00 0.00 C ATOM 1538 O GLY A 114 142.541 -2.436 -1.904 1.00 0.00 O ATOM 0 H GLY A 114 143.150 -2.132 0.344 1.00 0.00 H new ATOM 0 HA2 GLY A 114 144.151 0.168 -1.219 1.00 0.00 H new ATOM 0 HA3 GLY A 114 145.200 -1.211 -0.955 1.00 0.00 H new ATOM 1542 N THR A 115 143.892 -1.407 -3.370 1.00 0.00 N ATOM 1543 CA THR A 115 143.295 -2.072 -4.517 1.00 0.00 C ATOM 1544 C THR A 115 144.370 -2.513 -5.493 1.00 0.00 C ATOM 1545 O THR A 115 145.496 -2.021 -5.458 1.00 0.00 O ATOM 1546 CB THR A 115 142.312 -1.137 -5.220 1.00 0.00 C ATOM 1547 OG1 THR A 115 141.555 -1.876 -6.167 1.00 0.00 O ATOM 1548 CG2 THR A 115 143.081 -0.023 -5.931 1.00 0.00 C ATOM 0 H THR A 115 144.648 -0.761 -3.596 1.00 0.00 H new ATOM 0 HA THR A 115 142.758 -2.951 -4.162 1.00 0.00 H new ATOM 0 HB THR A 115 141.640 -0.695 -4.484 1.00 0.00 H new ATOM 0 HG1 THR A 115 140.601 -1.797 -5.957 1.00 0.00 H new ATOM 0 HG21 THR A 115 142.378 0.642 -6.432 1.00 0.00 H new ATOM 0 HG22 THR A 115 143.659 0.543 -5.201 1.00 0.00 H new ATOM 0 HG23 THR A 115 143.755 -0.459 -6.668 1.00 0.00 H new ATOM 1553 N GLN A 116 144.019 -3.445 -6.361 1.00 0.00 N ATOM 1554 CA GLN A 116 144.968 -3.940 -7.338 1.00 0.00 C ATOM 1555 C GLN A 116 146.238 -4.437 -6.655 1.00 0.00 C ATOM 1556 O GLN A 116 147.319 -4.337 -7.228 1.00 0.00 O ATOM 1557 CB GLN A 116 145.323 -2.824 -8.324 1.00 0.00 C ATOM 1558 CG GLN A 116 144.051 -2.318 -9.005 1.00 0.00 C ATOM 1559 CD GLN A 116 143.543 -3.357 -9.998 1.00 0.00 C ATOM 1560 OE1 GLN A 116 144.234 -4.446 -10.198 1.00 0.00 O flip ATOM 1561 NE2 GLN A 116 142.491 -3.171 -10.610 1.00 0.00 N flip ATOM 0 H GLN A 116 143.093 -3.870 -6.409 1.00 0.00 H new ATOM 0 HA GLN A 116 144.510 -4.772 -7.872 1.00 0.00 H new ATOM 0 HB2 GLN A 116 145.817 -2.006 -7.800 1.00 0.00 H new ATOM 0 HB3 GLN A 116 146.025 -3.195 -9.071 1.00 0.00 H new ATOM 0 HG2 GLN A 116 143.285 -2.113 -8.257 1.00 0.00 H new ATOM 0 HG3 GLN A 116 144.253 -1.379 -9.520 1.00 0.00 H new ATOM 0 HE21 GLN A 116 141.953 -2.319 -10.452 1.00 0.00 H new ATOM 0 HE22 GLN A 116 142.158 -3.869 -11.275 1.00 0.00 H new ATOM 1568 N ILE A 117 146.090 -4.992 -5.438 1.00 0.00 N ATOM 1569 CA ILE A 117 147.213 -5.524 -4.685 1.00 0.00 C ATOM 1570 C ILE A 117 148.522 -4.910 -5.160 1.00 0.00 C ATOM 1571 O ILE A 117 148.581 -3.714 -5.446 1.00 0.00 O ATOM 1572 CB ILE A 117 147.212 -7.057 -4.812 1.00 0.00 C ATOM 1573 CG1 ILE A 117 147.914 -7.653 -3.593 1.00 0.00 C ATOM 1574 CG2 ILE A 117 147.895 -7.530 -6.111 1.00 0.00 C ATOM 1575 CD1 ILE A 117 147.889 -9.179 -3.682 1.00 0.00 C ATOM 0 H ILE A 117 145.192 -5.078 -4.963 1.00 0.00 H new ATOM 0 HA ILE A 117 147.113 -5.262 -3.632 1.00 0.00 H new ATOM 0 HB ILE A 117 146.178 -7.400 -4.856 1.00 0.00 H new ATOM 0 HG12 ILE A 117 148.944 -7.298 -3.544 1.00 0.00 H new ATOM 0 HG13 ILE A 117 147.420 -7.324 -2.679 1.00 0.00 H new ATOM 0 HG21 ILE A 117 147.871 -8.619 -6.159 1.00 0.00 H new ATOM 0 HG22 ILE A 117 147.367 -7.117 -6.971 1.00 0.00 H new ATOM 0 HG23 ILE A 117 148.930 -7.189 -6.123 1.00 0.00 H new ATOM 0 HD11 ILE A 117 148.390 -9.602 -2.812 1.00 0.00 H new ATOM 0 HD12 ILE A 117 146.856 -9.525 -3.710 1.00 0.00 H new ATOM 0 HD13 ILE A 117 148.403 -9.499 -4.588 1.00 0.00 H new ATOM 1579 N ASP A 118 149.559 -5.719 -5.276 1.00 0.00 N ATOM 1580 CA ASP A 118 150.824 -5.206 -5.757 1.00 0.00 C ATOM 1581 C ASP A 118 150.845 -5.266 -7.282 1.00 0.00 C ATOM 1582 O ASP A 118 151.348 -6.216 -7.880 1.00 0.00 O ATOM 1583 CB ASP A 118 151.984 -6.000 -5.153 1.00 0.00 C ATOM 1584 CG ASP A 118 151.797 -7.496 -5.399 1.00 0.00 C ATOM 1585 OD1 ASP A 118 151.080 -7.843 -6.321 1.00 0.00 O ATOM 1586 OD2 ASP A 118 152.367 -8.273 -4.652 1.00 0.00 O ATOM 0 H ASP A 118 149.551 -6.713 -5.049 1.00 0.00 H new ATOM 0 HA ASP A 118 150.940 -4.167 -5.447 1.00 0.00 H new ATOM 0 HB2 ASP A 118 152.926 -5.669 -5.591 1.00 0.00 H new ATOM 0 HB3 ASP A 118 152.045 -5.807 -4.082 1.00 0.00 H new ATOM 1591 N LEU A 119 150.263 -4.243 -7.900 1.00 0.00 N ATOM 1592 CA LEU A 119 150.174 -4.172 -9.349 1.00 0.00 C ATOM 1593 C LEU A 119 149.467 -5.414 -9.863 1.00 0.00 C ATOM 1594 O LEU A 119 149.880 -6.015 -10.851 1.00 0.00 O ATOM 1595 CB LEU A 119 151.568 -4.055 -9.972 1.00 0.00 C ATOM 1596 CG LEU A 119 151.439 -3.566 -11.421 1.00 0.00 C ATOM 1597 CD1 LEU A 119 150.900 -2.133 -11.438 1.00 0.00 C ATOM 1598 CD2 LEU A 119 152.812 -3.591 -12.093 1.00 0.00 C ATOM 0 H LEU A 119 149.845 -3.449 -7.414 1.00 0.00 H new ATOM 0 HA LEU A 119 149.606 -3.285 -9.631 1.00 0.00 H new ATOM 0 HB2 LEU A 119 152.179 -3.361 -9.395 1.00 0.00 H new ATOM 0 HB3 LEU A 119 152.072 -5.021 -9.946 1.00 0.00 H new ATOM 0 HG LEU A 119 150.753 -4.220 -11.958 1.00 0.00 H new ATOM 0 HD11 LEU A 119 150.810 -1.790 -12.469 1.00 0.00 H new ATOM 0 HD12 LEU A 119 149.921 -2.107 -10.960 1.00 0.00 H new ATOM 0 HD13 LEU A 119 151.585 -1.480 -10.897 1.00 0.00 H new ATOM 0 HD21 LEU A 119 152.720 -3.244 -13.122 1.00 0.00 H new ATOM 0 HD22 LEU A 119 153.495 -2.938 -11.549 1.00 0.00 H new ATOM 0 HD23 LEU A 119 153.201 -4.609 -12.087 1.00 0.00 H new ATOM 1604 N ARG A 120 148.401 -5.799 -9.165 1.00 0.00 N ATOM 1605 CA ARG A 120 147.641 -6.981 -9.540 1.00 0.00 C ATOM 1606 C ARG A 120 148.593 -8.152 -9.711 1.00 0.00 C ATOM 1607 O ARG A 120 148.757 -8.648 -10.825 1.00 0.00 O ATOM 1608 CB ARG A 120 146.897 -6.728 -10.852 1.00 0.00 C ATOM 1609 CG ARG A 120 145.905 -7.863 -11.112 1.00 0.00 C ATOM 1610 CD ARG A 120 145.317 -7.711 -12.516 1.00 0.00 C ATOM 1611 NE ARG A 120 144.687 -6.402 -12.663 1.00 0.00 N ATOM 1612 CZ ARG A 120 143.387 -6.229 -12.443 1.00 0.00 C ATOM 1613 NH1 ARG A 120 142.640 -7.235 -12.076 1.00 0.00 N ATOM 1614 NH2 ARG A 120 142.855 -5.047 -12.594 1.00 0.00 N ATOM 0 H ARG A 120 148.048 -5.311 -8.342 1.00 0.00 H new ATOM 0 HA ARG A 120 146.915 -7.208 -8.759 1.00 0.00 H new ATOM 0 HB2 ARG A 120 146.369 -5.775 -10.804 1.00 0.00 H new ATOM 0 HB3 ARG A 120 147.607 -6.658 -11.676 1.00 0.00 H new ATOM 0 HG2 ARG A 120 146.405 -8.827 -11.017 1.00 0.00 H new ATOM 0 HG3 ARG A 120 145.109 -7.843 -10.368 1.00 0.00 H new ATOM 0 HD2 ARG A 120 146.103 -7.829 -13.262 1.00 0.00 H new ATOM 0 HD3 ARG A 120 144.584 -8.497 -12.698 1.00 0.00 H new ATOM 0 HE ARG A 120 145.257 -5.603 -12.941 1.00 0.00 H new ATOM 0 HH11 ARG A 120 143.053 -8.160 -11.957 1.00 0.00 H new ATOM 0 HH12 ARG A 120 141.643 -7.096 -11.909 1.00 0.00 H new ATOM 0 HH21 ARG A 120 143.436 -4.259 -12.880 1.00 0.00 H new ATOM 0 HH22 ARG A 120 141.858 -4.911 -12.426 1.00 0.00 H new ATOM 1866 N ILE A 137 154.114 -2.765 -0.829 1.00 0.00 N ATOM 1867 CA ILE A 137 154.133 -1.529 -0.054 1.00 0.00 C ATOM 1868 C ILE A 137 153.007 -1.533 0.971 1.00 0.00 C ATOM 1869 O ILE A 137 152.322 -0.528 1.160 1.00 0.00 O ATOM 1870 CB ILE A 137 153.992 -0.321 -0.982 1.00 0.00 C ATOM 1871 CG1 ILE A 137 154.182 0.972 -0.179 1.00 0.00 C ATOM 1872 CG2 ILE A 137 152.600 -0.326 -1.611 1.00 0.00 C ATOM 1873 CD1 ILE A 137 154.795 2.044 -1.082 1.00 0.00 C ATOM 0 HA ILE A 137 155.086 -1.461 0.470 1.00 0.00 H new ATOM 0 HB ILE A 137 154.749 -0.376 -1.764 1.00 0.00 H new ATOM 0 HG12 ILE A 137 153.224 1.314 0.212 1.00 0.00 H new ATOM 0 HG13 ILE A 137 154.830 0.789 0.678 1.00 0.00 H new ATOM 0 HG21 ILE A 137 152.497 0.534 -2.273 1.00 0.00 H new ATOM 0 HG22 ILE A 137 152.463 -1.243 -2.184 1.00 0.00 H new ATOM 0 HG23 ILE A 137 151.846 -0.272 -0.826 1.00 0.00 H new ATOM 0 HD11 ILE A 137 154.931 2.964 -0.514 1.00 0.00 H new ATOM 0 HD12 ILE A 137 155.761 1.700 -1.452 1.00 0.00 H new ATOM 0 HD13 ILE A 137 154.130 2.233 -1.925 1.00 0.00 H new ATOM 1877 N THR A 138 152.817 -2.669 1.636 1.00 0.00 N ATOM 1878 CA THR A 138 151.764 -2.779 2.639 1.00 0.00 C ATOM 1879 C THR A 138 152.288 -3.367 3.951 1.00 0.00 C ATOM 1880 O THR A 138 152.273 -2.690 4.980 1.00 0.00 O ATOM 1881 CB THR A 138 150.608 -3.633 2.122 1.00 0.00 C ATOM 1882 OG1 THR A 138 150.929 -4.143 0.835 1.00 0.00 O ATOM 1883 CG2 THR A 138 149.348 -2.771 2.038 1.00 0.00 C ATOM 0 H THR A 138 153.370 -3.515 1.501 1.00 0.00 H new ATOM 0 HA THR A 138 151.406 -1.768 2.836 1.00 0.00 H new ATOM 0 HB THR A 138 150.435 -4.468 2.801 1.00 0.00 H new ATOM 0 HG1 THR A 138 150.103 -4.334 0.344 1.00 0.00 H new ATOM 0 HG21 THR A 138 148.518 -3.374 1.669 1.00 0.00 H new ATOM 0 HG22 THR A 138 149.104 -2.385 3.028 1.00 0.00 H new ATOM 0 HG23 THR A 138 149.522 -1.938 1.357 1.00 0.00 H new ATOM 1888 N PRO A 139 152.736 -4.604 3.946 1.00 0.00 N ATOM 1889 CA PRO A 139 153.256 -5.289 5.150 1.00 0.00 C ATOM 1890 C PRO A 139 153.736 -4.329 6.237 1.00 0.00 C ATOM 1891 O PRO A 139 153.090 -4.189 7.273 1.00 0.00 O ATOM 1892 CB PRO A 139 154.405 -6.119 4.575 1.00 0.00 C ATOM 1893 CG PRO A 139 154.037 -6.387 3.139 1.00 0.00 C ATOM 1894 CD PRO A 139 152.817 -5.515 2.800 1.00 0.00 C ATOM 0 HA PRO A 139 152.493 -5.876 5.661 1.00 0.00 H new ATOM 0 HB2 PRO A 139 155.350 -5.579 4.643 1.00 0.00 H new ATOM 0 HB3 PRO A 139 154.530 -7.050 5.127 1.00 0.00 H new ATOM 0 HG2 PRO A 139 154.872 -6.150 2.479 1.00 0.00 H new ATOM 0 HG3 PRO A 139 153.805 -7.442 2.994 1.00 0.00 H new ATOM 0 HD2 PRO A 139 152.955 -4.975 1.863 1.00 0.00 H new ATOM 0 HD3 PRO A 139 151.911 -6.112 2.694 1.00 0.00 H new ATOM 1902 N GLU A 140 154.876 -3.686 6.014 1.00 0.00 N ATOM 1903 CA GLU A 140 155.416 -2.765 7.011 1.00 0.00 C ATOM 1904 C GLU A 140 155.165 -1.304 6.638 1.00 0.00 C ATOM 1905 O GLU A 140 154.803 -0.494 7.490 1.00 0.00 O ATOM 1906 CB GLU A 140 156.920 -2.997 7.172 1.00 0.00 C ATOM 1907 CG GLU A 140 157.167 -4.415 7.692 1.00 0.00 C ATOM 1908 CD GLU A 140 158.656 -4.623 7.952 1.00 0.00 C ATOM 1909 OE1 GLU A 140 159.427 -3.752 7.588 1.00 0.00 O ATOM 1910 OE2 GLU A 140 159.001 -5.650 8.511 1.00 0.00 O ATOM 0 H GLU A 140 155.437 -3.781 5.168 1.00 0.00 H new ATOM 0 HA GLU A 140 154.902 -2.964 7.951 1.00 0.00 H new ATOM 0 HB2 GLU A 140 157.424 -2.856 6.216 1.00 0.00 H new ATOM 0 HB3 GLU A 140 157.339 -2.267 7.864 1.00 0.00 H new ATOM 0 HG2 GLU A 140 156.603 -4.578 8.610 1.00 0.00 H new ATOM 0 HG3 GLU A 140 156.811 -5.145 6.965 1.00 0.00 H new ATOM 1917 N THR A 141 155.393 -0.965 5.373 1.00 0.00 N ATOM 1918 CA THR A 141 155.224 0.414 4.914 1.00 0.00 C ATOM 1919 C THR A 141 153.862 0.994 5.298 1.00 0.00 C ATOM 1920 O THR A 141 153.781 2.124 5.776 1.00 0.00 O ATOM 1921 CB THR A 141 155.384 0.474 3.394 1.00 0.00 C ATOM 1922 OG1 THR A 141 156.628 -0.105 3.027 1.00 0.00 O ATOM 1923 CG2 THR A 141 155.339 1.930 2.926 1.00 0.00 C ATOM 0 H THR A 141 155.693 -1.619 4.650 1.00 0.00 H new ATOM 0 HA THR A 141 155.991 1.013 5.405 1.00 0.00 H new ATOM 0 HB THR A 141 154.571 -0.079 2.923 1.00 0.00 H new ATOM 0 HG1 THR A 141 156.731 -0.069 2.053 1.00 0.00 H new ATOM 0 HG21 THR A 141 155.453 1.968 1.843 1.00 0.00 H new ATOM 0 HG22 THR A 141 154.383 2.373 3.206 1.00 0.00 H new ATOM 0 HG23 THR A 141 156.149 2.488 3.396 1.00 0.00 H new ATOM 1928 N ALA A 142 152.796 0.233 5.077 1.00 0.00 N ATOM 1929 CA ALA A 142 151.455 0.720 5.404 1.00 0.00 C ATOM 1930 C ALA A 142 151.179 0.658 6.903 1.00 0.00 C ATOM 1931 O ALA A 142 150.532 1.548 7.455 1.00 0.00 O ATOM 1932 CB ALA A 142 150.401 -0.101 4.666 1.00 0.00 C ATOM 0 H ALA A 142 152.828 -0.706 4.681 1.00 0.00 H new ATOM 0 HA ALA A 142 151.404 1.762 5.089 1.00 0.00 H new ATOM 0 HB1 ALA A 142 149.408 0.271 4.918 1.00 0.00 H new ATOM 0 HB2 ALA A 142 150.559 -0.014 3.591 1.00 0.00 H new ATOM 0 HB3 ALA A 142 150.482 -1.147 4.961 1.00 0.00 H new ATOM 1938 N GLU A 143 151.651 -0.399 7.556 1.00 0.00 N ATOM 1939 CA GLU A 143 151.416 -0.552 8.987 1.00 0.00 C ATOM 1940 C GLU A 143 152.012 0.610 9.772 1.00 0.00 C ATOM 1941 O GLU A 143 151.404 1.094 10.723 1.00 0.00 O ATOM 1942 CB GLU A 143 152.011 -1.872 9.480 1.00 0.00 C ATOM 1943 CG GLU A 143 151.187 -3.037 8.928 1.00 0.00 C ATOM 1944 CD GLU A 143 151.744 -4.361 9.441 1.00 0.00 C ATOM 1945 OE1 GLU A 143 152.785 -4.337 10.077 1.00 0.00 O ATOM 1946 OE2 GLU A 143 151.121 -5.380 9.192 1.00 0.00 O ATOM 0 H GLU A 143 152.190 -1.151 7.126 1.00 0.00 H new ATOM 0 HA GLU A 143 150.339 -0.557 9.152 1.00 0.00 H new ATOM 0 HB2 GLU A 143 153.048 -1.960 9.156 1.00 0.00 H new ATOM 0 HB3 GLU A 143 152.014 -1.898 10.570 1.00 0.00 H new ATOM 0 HG2 GLU A 143 150.145 -2.931 9.229 1.00 0.00 H new ATOM 0 HG3 GLU A 143 151.207 -3.023 7.838 1.00 0.00 H new ATOM 1953 N LYS A 144 153.194 1.068 9.370 1.00 0.00 N ATOM 1954 CA LYS A 144 153.827 2.185 10.061 1.00 0.00 C ATOM 1955 C LYS A 144 152.952 3.427 9.952 1.00 0.00 C ATOM 1956 O LYS A 144 152.675 4.101 10.944 1.00 0.00 O ATOM 1957 CB LYS A 144 155.201 2.468 9.453 1.00 0.00 C ATOM 1958 CG LYS A 144 155.905 3.558 10.264 1.00 0.00 C ATOM 1959 CD LYS A 144 157.253 3.886 9.618 1.00 0.00 C ATOM 1960 CE LYS A 144 158.036 4.844 10.519 1.00 0.00 C ATOM 1961 NZ LYS A 144 157.304 6.138 10.627 1.00 0.00 N ATOM 0 H LYS A 144 153.724 0.691 8.584 1.00 0.00 H new ATOM 0 HA LYS A 144 153.950 1.924 11.112 1.00 0.00 H new ATOM 0 HB2 LYS A 144 155.802 1.559 9.448 1.00 0.00 H new ATOM 0 HB3 LYS A 144 155.093 2.785 8.416 1.00 0.00 H new ATOM 0 HG2 LYS A 144 155.283 4.452 10.307 1.00 0.00 H new ATOM 0 HG3 LYS A 144 156.054 3.223 11.291 1.00 0.00 H new ATOM 0 HD2 LYS A 144 157.824 2.971 9.460 1.00 0.00 H new ATOM 0 HD3 LYS A 144 157.098 4.338 8.638 1.00 0.00 H new ATOM 0 HE2 LYS A 144 158.167 4.405 11.508 1.00 0.00 H new ATOM 0 HE3 LYS A 144 159.033 5.011 10.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 157.922 6.851 11.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 157.023 6.458 9.678 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 156.456 6.009 11.214 1.00 0.00 H new ATOM 1975 N LEU A 145 152.530 3.727 8.729 1.00 0.00 N ATOM 1976 CA LEU A 145 151.697 4.896 8.477 1.00 0.00 C ATOM 1977 C LEU A 145 150.412 4.854 9.299 1.00 0.00 C ATOM 1978 O LEU A 145 149.900 5.897 9.709 1.00 0.00 O ATOM 1979 CB LEU A 145 151.355 4.984 6.988 1.00 0.00 C ATOM 1980 CG LEU A 145 152.642 5.136 6.168 1.00 0.00 C ATOM 1981 CD1 LEU A 145 152.295 5.205 4.679 1.00 0.00 C ATOM 1982 CD2 LEU A 145 153.362 6.425 6.575 1.00 0.00 C ATOM 0 H LEU A 145 152.751 3.178 7.898 1.00 0.00 H new ATOM 0 HA LEU A 145 152.262 5.779 8.776 1.00 0.00 H new ATOM 0 HB2 LEU A 145 150.817 4.089 6.675 1.00 0.00 H new ATOM 0 HB3 LEU A 145 150.695 5.832 6.807 1.00 0.00 H new ATOM 0 HG LEU A 145 153.290 4.280 6.356 1.00 0.00 H new ATOM 0 HD11 LEU A 145 153.210 5.313 4.097 1.00 0.00 H new ATOM 0 HD12 LEU A 145 151.782 4.290 4.382 1.00 0.00 H new ATOM 0 HD13 LEU A 145 151.645 6.061 4.496 1.00 0.00 H new ATOM 0 HD21 LEU A 145 154.276 6.531 5.991 1.00 0.00 H new ATOM 0 HD22 LEU A 145 152.711 7.279 6.389 1.00 0.00 H new ATOM 0 HD23 LEU A 145 153.611 6.383 7.635 1.00 0.00 H new ATOM 1988 N ALA A 146 149.894 3.657 9.563 1.00 0.00 N ATOM 1989 CA ALA A 146 148.678 3.536 10.357 1.00 0.00 C ATOM 1990 C ALA A 146 148.965 3.908 11.808 1.00 0.00 C ATOM 1991 O ALA A 146 148.159 4.580 12.462 1.00 0.00 O ATOM 1992 CB ALA A 146 148.147 2.103 10.288 1.00 0.00 C ATOM 0 H ALA A 146 150.290 2.773 9.245 1.00 0.00 H new ATOM 0 HA ALA A 146 147.926 4.215 9.955 1.00 0.00 H new ATOM 0 HB1 ALA A 146 147.238 2.023 10.884 1.00 0.00 H new ATOM 0 HB2 ALA A 146 147.925 1.847 9.252 1.00 0.00 H new ATOM 0 HB3 ALA A 146 148.899 1.417 10.678 1.00 0.00 H new ATOM 1998 N ARG A 147 150.131 3.480 12.293 1.00 0.00 N ATOM 1999 CA ARG A 147 150.542 3.783 13.659 1.00 0.00 C ATOM 2000 C ARG A 147 150.616 5.288 13.847 1.00 0.00 C ATOM 2001 O ARG A 147 150.279 5.810 14.910 1.00 0.00 O ATOM 2002 CB ARG A 147 151.903 3.152 13.960 1.00 0.00 C ATOM 2003 CG ARG A 147 151.770 1.628 13.962 1.00 0.00 C ATOM 2004 CD ARG A 147 153.115 0.996 14.319 1.00 0.00 C ATOM 2005 NE ARG A 147 153.077 -0.442 14.074 1.00 0.00 N ATOM 2006 CZ ARG A 147 154.166 -1.192 14.209 1.00 0.00 C ATOM 2007 NH1 ARG A 147 155.294 -0.645 14.576 1.00 0.00 N ATOM 2008 NH2 ARG A 147 154.108 -2.475 13.978 1.00 0.00 N ATOM 0 H ARG A 147 150.802 2.926 11.762 1.00 0.00 H new ATOM 0 HA ARG A 147 149.807 3.368 14.349 1.00 0.00 H new ATOM 0 HB2 ARG A 147 152.633 3.463 13.213 1.00 0.00 H new ATOM 0 HB3 ARG A 147 152.270 3.497 14.927 1.00 0.00 H new ATOM 0 HG2 ARG A 147 151.010 1.320 14.680 1.00 0.00 H new ATOM 0 HG3 ARG A 147 151.442 1.280 12.982 1.00 0.00 H new ATOM 0 HD2 ARG A 147 153.908 1.452 13.727 1.00 0.00 H new ATOM 0 HD3 ARG A 147 153.349 1.188 15.366 1.00 0.00 H new ATOM 0 HE ARG A 147 152.199 -0.879 13.794 1.00 0.00 H new ATOM 0 HH11 ARG A 147 155.339 0.357 14.759 1.00 0.00 H new ATOM 0 HH12 ARG A 147 156.130 -1.220 14.680 1.00 0.00 H new ATOM 0 HH21 ARG A 147 153.227 -2.903 13.694 1.00 0.00 H new ATOM 0 HH22 ARG A 147 154.944 -3.050 14.082 1.00 0.00 H new ATOM 2022 N ASP A 148 151.033 5.988 12.795 1.00 0.00 N ATOM 2023 CA ASP A 148 151.111 7.437 12.856 1.00 0.00 C ATOM 2024 C ASP A 148 149.790 7.954 13.396 1.00 0.00 C ATOM 2025 O ASP A 148 149.735 8.965 14.097 1.00 0.00 O ATOM 2026 CB ASP A 148 151.371 8.017 11.463 1.00 0.00 C ATOM 2027 CG ASP A 148 151.655 9.512 11.564 1.00 0.00 C ATOM 2028 OD1 ASP A 148 151.742 10.005 12.676 1.00 0.00 O ATOM 2029 OD2 ASP A 148 151.780 10.142 10.526 1.00 0.00 O ATOM 0 H ASP A 148 151.317 5.579 11.905 1.00 0.00 H new ATOM 0 HA ASP A 148 151.932 7.740 13.505 1.00 0.00 H new ATOM 0 HB2 ASP A 148 152.217 7.508 11.001 1.00 0.00 H new ATOM 0 HB3 ASP A 148 150.507 7.845 10.822 1.00 0.00 H new ATOM 2034 N LEU A 149 148.732 7.212 13.086 1.00 0.00 N ATOM 2035 CA LEU A 149 147.400 7.539 13.554 1.00 0.00 C ATOM 2036 C LEU A 149 146.812 6.313 14.247 1.00 0.00 C ATOM 2037 O LEU A 149 147.307 5.881 15.288 1.00 0.00 O ATOM 2038 CB LEU A 149 146.511 7.945 12.375 1.00 0.00 C ATOM 2039 CG LEU A 149 147.157 9.111 11.621 1.00 0.00 C ATOM 2040 CD1 LEU A 149 146.286 9.492 10.421 1.00 0.00 C ATOM 2041 CD2 LEU A 149 147.279 10.315 12.558 1.00 0.00 C ATOM 0 H LEU A 149 148.778 6.374 12.507 1.00 0.00 H new ATOM 0 HA LEU A 149 147.451 8.374 14.252 1.00 0.00 H new ATOM 0 HB2 LEU A 149 146.371 7.098 11.704 1.00 0.00 H new ATOM 0 HB3 LEU A 149 145.523 8.234 12.734 1.00 0.00 H new ATOM 0 HG LEU A 149 148.146 8.813 11.273 1.00 0.00 H new ATOM 0 HD11 LEU A 149 146.747 10.322 9.886 1.00 0.00 H new ATOM 0 HD12 LEU A 149 146.193 8.636 9.753 1.00 0.00 H new ATOM 0 HD13 LEU A 149 145.297 9.790 10.769 1.00 0.00 H new ATOM 0 HD21 LEU A 149 147.739 11.147 12.024 1.00 0.00 H new ATOM 0 HD22 LEU A 149 146.288 10.609 12.904 1.00 0.00 H new ATOM 0 HD23 LEU A 149 147.898 10.048 13.415 1.00 0.00 H new ATOM 2047 N LYS A 150 145.757 5.762 13.663 1.00 0.00 N ATOM 2048 CA LYS A 150 145.107 4.585 14.238 1.00 0.00 C ATOM 2049 C LYS A 150 143.980 4.065 13.347 1.00 0.00 C ATOM 2050 O LYS A 150 142.805 4.205 13.685 1.00 0.00 O ATOM 2051 CB LYS A 150 144.531 4.937 15.614 1.00 0.00 C ATOM 2052 CG LYS A 150 144.021 3.668 16.303 1.00 0.00 C ATOM 2053 CD LYS A 150 143.381 4.041 17.642 1.00 0.00 C ATOM 2054 CE LYS A 150 142.990 2.766 18.393 1.00 0.00 C ATOM 2055 NZ LYS A 150 144.019 2.466 19.429 1.00 0.00 N ATOM 0 H LYS A 150 145.334 6.104 12.800 1.00 0.00 H new ATOM 0 HA LYS A 150 145.861 3.803 14.327 1.00 0.00 H new ATOM 0 HB2 LYS A 150 145.296 5.413 16.228 1.00 0.00 H new ATOM 0 HB3 LYS A 150 143.718 5.655 15.505 1.00 0.00 H new ATOM 0 HG2 LYS A 150 143.294 3.163 15.668 1.00 0.00 H new ATOM 0 HG3 LYS A 150 144.844 2.971 16.462 1.00 0.00 H new ATOM 0 HD2 LYS A 150 144.078 4.628 18.239 1.00 0.00 H new ATOM 0 HD3 LYS A 150 142.501 4.663 17.476 1.00 0.00 H new ATOM 0 HE2 LYS A 150 142.013 2.891 18.860 1.00 0.00 H new ATOM 0 HE3 LYS A 150 142.905 1.932 17.696 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 143.755 1.600 19.940 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 144.943 2.330 18.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 144.078 3.259 20.099 1.00 0.00 H new ATOM 2069 N ALA A 151 144.331 3.462 12.214 1.00 0.00 N ATOM 2070 CA ALA A 151 143.326 2.924 11.300 1.00 0.00 C ATOM 2071 C ALA A 151 142.499 1.843 11.987 1.00 0.00 C ATOM 2072 O ALA A 151 142.120 1.982 13.149 1.00 0.00 O ATOM 2073 CB ALA A 151 144.029 2.320 10.083 1.00 0.00 C ATOM 0 H ALA A 151 145.296 3.334 11.908 1.00 0.00 H new ATOM 0 HA ALA A 151 142.662 3.732 10.992 1.00 0.00 H new ATOM 0 HB1 ALA A 151 143.285 1.916 9.396 1.00 0.00 H new ATOM 0 HB2 ALA A 151 144.609 3.092 9.577 1.00 0.00 H new ATOM 0 HB3 ALA A 151 144.695 1.520 10.407 1.00 0.00 H new ATOM 2079 N VAL A 152 142.226 0.765 11.255 1.00 0.00 N ATOM 2080 CA VAL A 152 141.456 -0.350 11.805 1.00 0.00 C ATOM 2081 C VAL A 152 141.800 -1.658 11.084 1.00 0.00 C ATOM 2082 O VAL A 152 142.097 -2.666 11.725 1.00 0.00 O ATOM 2083 CB VAL A 152 139.954 -0.070 11.706 1.00 0.00 C ATOM 2084 CG1 VAL A 152 139.174 -1.341 12.050 1.00 0.00 C ATOM 2085 CG2 VAL A 152 139.578 1.037 12.693 1.00 0.00 C ATOM 0 H VAL A 152 142.523 0.639 10.287 1.00 0.00 H new ATOM 0 HA VAL A 152 141.722 -0.456 12.857 1.00 0.00 H new ATOM 0 HB VAL A 152 139.709 0.245 10.692 1.00 0.00 H new ATOM 0 HG11 VAL A 152 138.105 -1.142 11.980 1.00 0.00 H new ATOM 0 HG12 VAL A 152 139.442 -2.133 11.351 1.00 0.00 H new ATOM 0 HG13 VAL A 152 139.419 -1.655 13.065 1.00 0.00 H new ATOM 0 HG21 VAL A 152 138.509 1.238 12.624 1.00 0.00 H new ATOM 0 HG22 VAL A 152 139.823 0.719 13.707 1.00 0.00 H new ATOM 0 HG23 VAL A 152 140.134 1.943 12.452 1.00 0.00 H new ATOM 2089 N LYS A 153 141.765 -1.636 9.751 1.00 0.00 N ATOM 2090 CA LYS A 153 142.086 -2.837 8.962 1.00 0.00 C ATOM 2091 C LYS A 153 143.360 -2.622 8.148 1.00 0.00 C ATOM 2092 O LYS A 153 144.000 -1.580 8.271 1.00 0.00 O ATOM 2093 CB LYS A 153 140.928 -3.174 8.019 1.00 0.00 C ATOM 2094 CG LYS A 153 140.317 -4.524 8.403 1.00 0.00 C ATOM 2095 CD LYS A 153 141.246 -5.657 7.954 1.00 0.00 C ATOM 2096 CE LYS A 153 140.555 -7.006 8.166 1.00 0.00 C ATOM 2097 NZ LYS A 153 140.735 -7.439 9.580 1.00 0.00 N ATOM 0 H LYS A 153 141.522 -0.815 9.197 1.00 0.00 H new ATOM 0 HA LYS A 153 142.244 -3.666 9.652 1.00 0.00 H new ATOM 0 HB2 LYS A 153 140.168 -2.394 8.069 1.00 0.00 H new ATOM 0 HB3 LYS A 153 141.284 -3.206 6.989 1.00 0.00 H new ATOM 0 HG2 LYS A 153 140.164 -4.572 9.481 1.00 0.00 H new ATOM 0 HG3 LYS A 153 139.338 -4.637 7.937 1.00 0.00 H new ATOM 0 HD2 LYS A 153 141.506 -5.532 6.903 1.00 0.00 H new ATOM 0 HD3 LYS A 153 142.177 -5.622 8.519 1.00 0.00 H new ATOM 0 HE2 LYS A 153 139.494 -6.924 7.932 1.00 0.00 H new ATOM 0 HE3 LYS A 153 140.974 -7.751 7.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 153 140.765 -8.478 9.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 153 141.625 -7.051 9.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 153 139.940 -7.091 10.153 1.00 0.00 H new ATOM 2111 N TYR A 154 143.730 -3.600 7.308 1.00 0.00 N ATOM 2112 CA TYR A 154 144.917 -3.467 6.491 1.00 0.00 C ATOM 2113 C TYR A 154 144.930 -4.610 5.505 1.00 0.00 C ATOM 2114 O TYR A 154 145.349 -5.722 5.827 1.00 0.00 O ATOM 2115 CB TYR A 154 146.175 -3.508 7.362 1.00 0.00 C ATOM 2116 CG TYR A 154 145.799 -3.908 8.769 1.00 0.00 C ATOM 2117 CD1 TYR A 154 145.094 -5.096 8.995 1.00 0.00 C ATOM 2118 CD2 TYR A 154 146.156 -3.089 9.848 1.00 0.00 C ATOM 2119 CE1 TYR A 154 144.744 -5.465 10.300 1.00 0.00 C ATOM 2120 CE2 TYR A 154 145.806 -3.458 11.153 1.00 0.00 C ATOM 2121 CZ TYR A 154 145.101 -4.646 11.378 1.00 0.00 C ATOM 2122 OH TYR A 154 144.756 -5.010 12.665 1.00 0.00 O ATOM 0 H TYR A 154 143.223 -4.477 7.186 1.00 0.00 H new ATOM 0 HA TYR A 154 144.906 -2.511 5.967 1.00 0.00 H new ATOM 0 HB2 TYR A 154 146.893 -4.217 6.950 1.00 0.00 H new ATOM 0 HB3 TYR A 154 146.659 -2.531 7.367 1.00 0.00 H new ATOM 0 HD1 TYR A 154 144.820 -5.728 8.163 1.00 0.00 H new ATOM 0 HD2 TYR A 154 146.701 -2.173 9.674 1.00 0.00 H new ATOM 0 HE1 TYR A 154 144.199 -6.381 10.475 1.00 0.00 H new ATOM 0 HE2 TYR A 154 146.080 -2.826 11.985 1.00 0.00 H new ATOM 0 HH TYR A 154 145.080 -4.333 13.295 1.00 0.00 H new ATOM 2132 N VAL A 155 144.441 -4.342 4.311 1.00 0.00 N ATOM 2133 CA VAL A 155 144.375 -5.372 3.304 1.00 0.00 C ATOM 2134 C VAL A 155 144.660 -4.811 1.925 1.00 0.00 C ATOM 2135 O VAL A 155 144.244 -3.705 1.582 1.00 0.00 O ATOM 2136 CB VAL A 155 142.989 -6.014 3.322 1.00 0.00 C ATOM 2137 CG1 VAL A 155 141.953 -4.998 2.836 1.00 0.00 C ATOM 2138 CG2 VAL A 155 142.980 -7.242 2.409 1.00 0.00 C ATOM 0 H VAL A 155 144.088 -3.430 4.020 1.00 0.00 H new ATOM 0 HA VAL A 155 145.134 -6.121 3.529 1.00 0.00 H new ATOM 0 HB VAL A 155 142.743 -6.323 4.338 1.00 0.00 H new ATOM 0 HG11 VAL A 155 140.963 -5.454 2.848 1.00 0.00 H new ATOM 0 HG12 VAL A 155 141.960 -4.128 3.493 1.00 0.00 H new ATOM 0 HG13 VAL A 155 142.197 -4.687 1.820 1.00 0.00 H new ATOM 0 HG21 VAL A 155 141.990 -7.699 2.423 1.00 0.00 H new ATOM 0 HG22 VAL A 155 143.226 -6.940 1.391 1.00 0.00 H new ATOM 0 HG23 VAL A 155 143.717 -7.963 2.762 1.00 0.00 H new ATOM 2142 N GLU A 156 145.348 -5.609 1.139 1.00 0.00 N ATOM 2143 CA GLU A 156 145.677 -5.241 -0.223 1.00 0.00 C ATOM 2144 C GLU A 156 145.060 -6.275 -1.134 1.00 0.00 C ATOM 2145 O GLU A 156 145.619 -7.340 -1.303 1.00 0.00 O ATOM 2146 CB GLU A 156 147.194 -5.242 -0.393 1.00 0.00 C ATOM 2147 CG GLU A 156 147.809 -6.320 0.505 1.00 0.00 C ATOM 2148 CD GLU A 156 149.321 -6.360 0.314 1.00 0.00 C ATOM 2149 OE1 GLU A 156 149.795 -5.752 -0.632 1.00 0.00 O ATOM 2150 OE2 GLU A 156 149.983 -6.997 1.116 1.00 0.00 O ATOM 0 H GLU A 156 145.694 -6.526 1.422 1.00 0.00 H new ATOM 0 HA GLU A 156 145.298 -4.247 -0.461 1.00 0.00 H new ATOM 0 HB2 GLU A 156 147.454 -5.430 -1.435 1.00 0.00 H new ATOM 0 HB3 GLU A 156 147.600 -4.264 -0.135 1.00 0.00 H new ATOM 0 HG2 GLU A 156 147.572 -6.114 1.549 1.00 0.00 H new ATOM 0 HG3 GLU A 156 147.378 -7.292 0.266 1.00 0.00 H new ATOM 2157 N CYS A 157 143.879 -5.985 -1.663 1.00 0.00 N ATOM 2158 CA CYS A 157 143.174 -6.952 -2.483 1.00 0.00 C ATOM 2159 C CYS A 157 142.893 -6.489 -3.888 1.00 0.00 C ATOM 2160 O CYS A 157 142.302 -5.438 -4.133 1.00 0.00 O ATOM 2161 CB CYS A 157 141.841 -7.335 -1.813 1.00 0.00 C ATOM 2162 SG CYS A 157 140.463 -6.720 -2.808 1.00 0.00 S ATOM 0 H CYS A 157 143.395 -5.096 -1.539 1.00 0.00 H new ATOM 0 HA CYS A 157 143.843 -7.809 -2.562 1.00 0.00 H new ATOM 0 HB2 CYS A 157 141.773 -8.418 -1.709 1.00 0.00 H new ATOM 0 HB3 CYS A 157 141.793 -6.915 -0.808 1.00 0.00 H new ATOM 0 HG CYS A 157 140.806 -5.605 -3.383 1.00 0.00 H new ATOM 2168 N SER A 158 143.238 -7.375 -4.792 1.00 0.00 N ATOM 2169 CA SER A 158 142.939 -7.193 -6.189 1.00 0.00 C ATOM 2170 C SER A 158 142.077 -8.374 -6.531 1.00 0.00 C ATOM 2171 O SER A 158 142.585 -9.425 -6.927 1.00 0.00 O ATOM 2172 CB SER A 158 144.207 -7.241 -7.038 1.00 0.00 C ATOM 2173 OG SER A 158 144.707 -8.572 -7.062 1.00 0.00 O ATOM 0 H SER A 158 143.733 -8.241 -4.578 1.00 0.00 H new ATOM 0 HA SER A 158 142.466 -6.230 -6.379 1.00 0.00 H new ATOM 0 HB2 SER A 158 143.993 -6.903 -8.052 1.00 0.00 H new ATOM 0 HB3 SER A 158 144.958 -6.566 -6.629 1.00 0.00 H new ATOM 0 HG SER A 158 144.090 -9.144 -7.564 1.00 0.00 H new ATOM 2179 N ALA A 159 140.778 -8.217 -6.333 1.00 0.00 N ATOM 2180 CA ALA A 159 139.864 -9.311 -6.567 1.00 0.00 C ATOM 2181 C ALA A 159 140.544 -10.604 -6.127 1.00 0.00 C ATOM 2182 O ALA A 159 140.266 -11.685 -6.644 1.00 0.00 O ATOM 2183 CB ALA A 159 139.493 -9.365 -8.042 1.00 0.00 C ATOM 0 H ALA A 159 140.342 -7.352 -6.015 1.00 0.00 H new ATOM 0 HA ALA A 159 138.946 -9.173 -5.996 1.00 0.00 H new ATOM 0 HB1 ALA A 159 138.804 -10.192 -8.214 1.00 0.00 H new ATOM 0 HB2 ALA A 159 139.016 -8.429 -8.332 1.00 0.00 H new ATOM 0 HB3 ALA A 159 140.393 -9.514 -8.638 1.00 0.00 H new ATOM 2189 N LEU A 160 141.469 -10.455 -5.171 1.00 0.00 N ATOM 2190 CA LEU A 160 142.236 -11.579 -4.656 1.00 0.00 C ATOM 2191 C LEU A 160 142.289 -11.567 -3.129 1.00 0.00 C ATOM 2192 O LEU A 160 141.606 -12.367 -2.504 1.00 0.00 O ATOM 2193 CB LEU A 160 143.660 -11.531 -5.214 1.00 0.00 C ATOM 2194 CG LEU A 160 144.415 -12.799 -4.809 1.00 0.00 C ATOM 2195 CD1 LEU A 160 143.807 -14.015 -5.513 1.00 0.00 C ATOM 2196 CD2 LEU A 160 145.885 -12.662 -5.212 1.00 0.00 C ATOM 0 H LEU A 160 141.700 -9.559 -4.741 1.00 0.00 H new ATOM 0 HA LEU A 160 141.741 -12.497 -4.973 1.00 0.00 H new ATOM 0 HB2 LEU A 160 143.633 -11.444 -6.300 1.00 0.00 H new ATOM 0 HB3 LEU A 160 144.180 -10.650 -4.836 1.00 0.00 H new ATOM 0 HG LEU A 160 144.338 -12.934 -3.730 1.00 0.00 H new ATOM 0 HD11 LEU A 160 144.349 -14.914 -5.220 1.00 0.00 H new ATOM 0 HD12 LEU A 160 142.760 -14.114 -5.228 1.00 0.00 H new ATOM 0 HD13 LEU A 160 143.879 -13.884 -6.593 1.00 0.00 H new ATOM 0 HD21 LEU A 160 146.426 -13.563 -4.925 1.00 0.00 H new ATOM 0 HD22 LEU A 160 145.955 -12.524 -6.291 1.00 0.00 H new ATOM 0 HD23 LEU A 160 146.322 -11.800 -4.707 1.00 0.00 H new ATOM 2202 N THR A 161 143.171 -10.721 -2.550 1.00 0.00 N ATOM 2203 CA THR A 161 143.371 -10.675 -1.073 1.00 0.00 C ATOM 2204 C THR A 161 142.068 -10.666 -0.289 1.00 0.00 C ATOM 2205 O THR A 161 141.899 -9.895 0.656 1.00 0.00 O ATOM 2206 CB THR A 161 144.238 -9.476 -0.646 1.00 0.00 C ATOM 2207 OG1 THR A 161 145.325 -9.361 -1.557 1.00 0.00 O ATOM 2208 CG2 THR A 161 144.767 -9.654 0.796 1.00 0.00 C ATOM 0 H THR A 161 143.753 -10.065 -3.071 1.00 0.00 H new ATOM 0 HA THR A 161 143.896 -11.599 -0.831 1.00 0.00 H new ATOM 0 HB THR A 161 143.633 -8.570 -0.663 1.00 0.00 H new ATOM 0 HG1 THR A 161 145.577 -8.418 -1.648 1.00 0.00 H new ATOM 0 HG21 THR A 161 145.376 -8.792 1.069 1.00 0.00 H new ATOM 0 HG22 THR A 161 143.926 -9.737 1.484 1.00 0.00 H new ATOM 0 HG23 THR A 161 145.373 -10.558 0.852 1.00 0.00 H new ATOM 2213 N GLN A 162 141.188 -11.586 -0.632 1.00 0.00 N ATOM 2214 CA GLN A 162 139.961 -11.743 0.100 1.00 0.00 C ATOM 2215 C GLN A 162 140.379 -12.345 1.420 1.00 0.00 C ATOM 2216 O GLN A 162 139.574 -12.589 2.313 1.00 0.00 O ATOM 2217 CB GLN A 162 138.983 -12.664 -0.643 1.00 0.00 C ATOM 2218 CG GLN A 162 139.213 -14.125 -0.240 1.00 0.00 C ATOM 2219 CD GLN A 162 140.688 -14.484 -0.379 1.00 0.00 C ATOM 2220 OE1 GLN A 162 141.351 -14.896 0.667 1.00 0.00 O flip ATOM 2221 NE2 GLN A 162 141.250 -14.390 -1.468 1.00 0.00 N flip ATOM 0 H GLN A 162 141.306 -12.232 -1.413 1.00 0.00 H new ATOM 0 HA GLN A 162 139.436 -10.796 0.227 1.00 0.00 H new ATOM 0 HB2 GLN A 162 137.957 -12.375 -0.415 1.00 0.00 H new ATOM 0 HB3 GLN A 162 139.115 -12.552 -1.719 1.00 0.00 H new ATOM 0 HG2 GLN A 162 138.889 -14.281 0.789 1.00 0.00 H new ATOM 0 HG3 GLN A 162 138.611 -14.782 -0.867 1.00 0.00 H new ATOM 0 HE21 GLN A 162 140.730 -14.068 -2.284 1.00 0.00 H new ATOM 0 HE22 GLN A 162 142.236 -14.634 -1.556 1.00 0.00 H new ATOM 2228 N LYS A 163 141.697 -12.531 1.528 1.00 0.00 N ATOM 2229 CA LYS A 163 142.287 -13.053 2.746 1.00 0.00 C ATOM 2230 C LYS A 163 141.915 -12.103 3.853 1.00 0.00 C ATOM 2231 O LYS A 163 141.837 -12.468 5.025 1.00 0.00 O ATOM 2232 CB LYS A 163 143.810 -13.157 2.625 1.00 0.00 C ATOM 2233 CG LYS A 163 144.175 -14.173 1.541 1.00 0.00 C ATOM 2234 CD LYS A 163 145.680 -14.450 1.587 1.00 0.00 C ATOM 2235 CE LYS A 163 146.448 -13.177 1.226 1.00 0.00 C ATOM 2236 NZ LYS A 163 146.721 -12.394 2.466 1.00 0.00 N ATOM 0 H LYS A 163 142.366 -12.327 0.786 1.00 0.00 H new ATOM 0 HA LYS A 163 141.916 -14.058 2.946 1.00 0.00 H new ATOM 0 HB2 LYS A 163 144.232 -12.182 2.380 1.00 0.00 H new ATOM 0 HB3 LYS A 163 144.240 -13.460 3.580 1.00 0.00 H new ATOM 0 HG2 LYS A 163 143.619 -15.098 1.693 1.00 0.00 H new ATOM 0 HG3 LYS A 163 143.895 -13.790 0.560 1.00 0.00 H new ATOM 0 HD2 LYS A 163 145.967 -14.790 2.582 1.00 0.00 H new ATOM 0 HD3 LYS A 163 145.934 -15.250 0.891 1.00 0.00 H new ATOM 0 HE2 LYS A 163 147.385 -13.432 0.731 1.00 0.00 H new ATOM 0 HE3 LYS A 163 145.869 -12.577 0.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 163 146.237 -11.475 2.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 163 146.371 -12.919 3.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 163 147.745 -12.241 2.561 1.00 0.00 H new ATOM 2250 N GLY A 164 141.629 -10.878 3.435 1.00 0.00 N ATOM 2251 CA GLY A 164 141.189 -9.840 4.336 1.00 0.00 C ATOM 2252 C GLY A 164 139.809 -9.407 3.888 1.00 0.00 C ATOM 2253 O GLY A 164 138.831 -9.601 4.610 1.00 0.00 O ATOM 0 H GLY A 164 141.698 -10.583 2.461 1.00 0.00 H new ATOM 0 HA2 GLY A 164 141.162 -10.208 5.362 1.00 0.00 H new ATOM 0 HA3 GLY A 164 141.880 -8.998 4.318 1.00 0.00 H new ATOM 2257 N LEU A 165 139.731 -8.804 2.695 1.00 0.00 N ATOM 2258 CA LEU A 165 138.453 -8.336 2.159 1.00 0.00 C ATOM 2259 C LEU A 165 137.313 -9.316 2.416 1.00 0.00 C ATOM 2260 O LEU A 165 136.150 -8.966 2.234 1.00 0.00 O ATOM 2261 CB LEU A 165 138.575 -8.115 0.660 1.00 0.00 C ATOM 2262 CG LEU A 165 138.375 -6.631 0.333 1.00 0.00 C ATOM 2263 CD1 LEU A 165 136.971 -6.194 0.751 1.00 0.00 C ATOM 2264 CD2 LEU A 165 139.412 -5.799 1.088 1.00 0.00 C ATOM 0 H LEU A 165 140.533 -8.631 2.089 1.00 0.00 H new ATOM 0 HA LEU A 165 138.218 -7.404 2.673 1.00 0.00 H new ATOM 0 HB2 LEU A 165 139.555 -8.444 0.314 1.00 0.00 H new ATOM 0 HB3 LEU A 165 137.833 -8.715 0.134 1.00 0.00 H new ATOM 0 HG LEU A 165 138.495 -6.480 -0.740 1.00 0.00 H new ATOM 0 HD11 LEU A 165 136.834 -5.138 0.517 1.00 0.00 H new ATOM 0 HD12 LEU A 165 136.230 -6.785 0.212 1.00 0.00 H new ATOM 0 HD13 LEU A 165 136.846 -6.347 1.823 1.00 0.00 H new ATOM 0 HD21 LEU A 165 139.270 -4.743 0.856 1.00 0.00 H new ATOM 0 HD22 LEU A 165 139.292 -5.954 2.160 1.00 0.00 H new ATOM 0 HD23 LEU A 165 140.414 -6.106 0.787 1.00 0.00 H new ATOM 2270 N LYS A 166 137.625 -10.518 2.875 1.00 0.00 N ATOM 2271 CA LYS A 166 136.571 -11.476 3.187 1.00 0.00 C ATOM 2272 C LYS A 166 136.209 -11.303 4.646 1.00 0.00 C ATOM 2273 O LYS A 166 135.037 -11.289 5.022 1.00 0.00 O ATOM 2274 CB LYS A 166 137.024 -12.916 2.927 1.00 0.00 C ATOM 2275 CG LYS A 166 135.837 -13.862 3.129 1.00 0.00 C ATOM 2276 CD LYS A 166 136.294 -15.309 2.940 1.00 0.00 C ATOM 2277 CE LYS A 166 135.078 -16.238 2.965 1.00 0.00 C ATOM 2278 NZ LYS A 166 134.423 -16.235 1.626 1.00 0.00 N ATOM 0 H LYS A 166 138.576 -10.850 3.038 1.00 0.00 H new ATOM 0 HA LYS A 166 135.710 -11.290 2.545 1.00 0.00 H new ATOM 0 HB2 LYS A 166 137.411 -13.010 1.912 1.00 0.00 H new ATOM 0 HB3 LYS A 166 137.836 -13.182 3.604 1.00 0.00 H new ATOM 0 HG2 LYS A 166 135.420 -13.730 4.127 1.00 0.00 H new ATOM 0 HG3 LYS A 166 135.045 -13.625 2.418 1.00 0.00 H new ATOM 0 HD2 LYS A 166 136.824 -15.413 1.993 1.00 0.00 H new ATOM 0 HD3 LYS A 166 136.993 -15.586 3.729 1.00 0.00 H new ATOM 0 HE2 LYS A 166 135.385 -17.250 3.229 1.00 0.00 H new ATOM 0 HE3 LYS A 166 134.372 -15.910 3.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 166 133.607 -16.879 1.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 166 134.101 -15.272 1.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 166 135.103 -16.551 0.906 1.00 0.00 H new ATOM 2292 N ASN A 167 137.245 -11.137 5.457 1.00 0.00 N ATOM 2293 CA ASN A 167 137.064 -10.924 6.877 1.00 0.00 C ATOM 2294 C ASN A 167 136.748 -9.456 7.125 1.00 0.00 C ATOM 2295 O ASN A 167 136.520 -9.043 8.260 1.00 0.00 O ATOM 2296 CB ASN A 167 138.333 -11.318 7.635 1.00 0.00 C ATOM 2297 CG ASN A 167 138.625 -12.801 7.431 1.00 0.00 C ATOM 2298 OD1 ASN A 167 137.733 -13.567 7.069 1.00 0.00 O ATOM 2299 ND2 ASN A 167 139.831 -13.255 7.643 1.00 0.00 N ATOM 0 H ASN A 167 138.218 -11.147 5.151 1.00 0.00 H new ATOM 0 HA ASN A 167 136.240 -11.542 7.233 1.00 0.00 H new ATOM 0 HB2 ASN A 167 139.175 -10.722 7.284 1.00 0.00 H new ATOM 0 HB3 ASN A 167 138.212 -11.106 8.697 1.00 0.00 H new ATOM 0 HD21 ASN A 167 140.034 -14.245 7.508 1.00 0.00 H new ATOM 0 HD22 ASN A 167 140.570 -12.619 7.943 1.00 0.00 H new ATOM 2304 N VAL A 168 136.699 -8.674 6.042 1.00 0.00 N ATOM 2305 CA VAL A 168 136.368 -7.257 6.156 1.00 0.00 C ATOM 2306 C VAL A 168 134.872 -7.100 6.332 1.00 0.00 C ATOM 2307 O VAL A 168 134.414 -6.534 7.321 1.00 0.00 O ATOM 2308 CB VAL A 168 136.806 -6.496 4.909 1.00 0.00 C ATOM 2309 CG1 VAL A 168 136.167 -5.105 4.914 1.00 0.00 C ATOM 2310 CG2 VAL A 168 138.327 -6.353 4.914 1.00 0.00 C ATOM 0 H VAL A 168 136.882 -8.995 5.091 1.00 0.00 H new ATOM 0 HA VAL A 168 136.893 -6.849 7.020 1.00 0.00 H new ATOM 0 HB VAL A 168 136.492 -7.040 4.018 1.00 0.00 H new ATOM 0 HG11 VAL A 168 136.478 -4.558 4.024 1.00 0.00 H new ATOM 0 HG12 VAL A 168 135.081 -5.203 4.918 1.00 0.00 H new ATOM 0 HG13 VAL A 168 136.486 -4.561 5.803 1.00 0.00 H new ATOM 0 HG21 VAL A 168 138.644 -5.809 4.024 1.00 0.00 H new ATOM 0 HG22 VAL A 168 138.638 -5.806 5.804 1.00 0.00 H new ATOM 0 HG23 VAL A 168 138.785 -7.342 4.918 1.00 0.00 H new ATOM 2314 N PHE A 169 134.104 -7.616 5.371 1.00 0.00 N ATOM 2315 CA PHE A 169 132.652 -7.520 5.473 1.00 0.00 C ATOM 2316 C PHE A 169 132.203 -7.972 6.860 1.00 0.00 C ATOM 2317 O PHE A 169 131.363 -7.331 7.493 1.00 0.00 O ATOM 2318 CB PHE A 169 131.981 -8.382 4.403 1.00 0.00 C ATOM 2319 CG PHE A 169 132.014 -7.654 3.082 1.00 0.00 C ATOM 2320 CD1 PHE A 169 133.151 -7.725 2.273 1.00 0.00 C ATOM 2321 CD2 PHE A 169 130.905 -6.906 2.668 1.00 0.00 C ATOM 2322 CE1 PHE A 169 133.183 -7.048 1.048 1.00 0.00 C ATOM 2323 CE2 PHE A 169 130.934 -6.230 1.444 1.00 0.00 C ATOM 2324 CZ PHE A 169 132.074 -6.300 0.633 1.00 0.00 C ATOM 0 H PHE A 169 134.452 -8.091 4.538 1.00 0.00 H new ATOM 0 HA PHE A 169 132.358 -6.482 5.317 1.00 0.00 H new ATOM 0 HB2 PHE A 169 132.495 -9.339 4.316 1.00 0.00 H new ATOM 0 HB3 PHE A 169 130.951 -8.597 4.687 1.00 0.00 H new ATOM 0 HD1 PHE A 169 134.006 -8.303 2.593 1.00 0.00 H new ATOM 0 HD2 PHE A 169 130.027 -6.851 3.294 1.00 0.00 H new ATOM 0 HE1 PHE A 169 134.062 -7.103 0.423 1.00 0.00 H new ATOM 0 HE2 PHE A 169 130.078 -5.654 1.124 1.00 0.00 H new ATOM 0 HZ PHE A 169 132.098 -5.777 -0.312 1.00 0.00 H new ATOM 2334 N ASP A 170 132.782 -9.070 7.339 1.00 0.00 N ATOM 2335 CA ASP A 170 132.442 -9.575 8.664 1.00 0.00 C ATOM 2336 C ASP A 170 132.923 -8.596 9.733 1.00 0.00 C ATOM 2337 O ASP A 170 132.166 -8.199 10.624 1.00 0.00 O ATOM 2338 CB ASP A 170 133.094 -10.941 8.888 1.00 0.00 C ATOM 2339 CG ASP A 170 132.600 -11.543 10.199 1.00 0.00 C ATOM 2340 OD1 ASP A 170 131.772 -10.918 10.841 1.00 0.00 O ATOM 2341 OD2 ASP A 170 133.059 -12.622 10.543 1.00 0.00 O ATOM 0 H ASP A 170 133.479 -9.620 6.837 1.00 0.00 H new ATOM 0 HA ASP A 170 131.359 -9.680 8.733 1.00 0.00 H new ATOM 0 HB2 ASP A 170 132.856 -11.608 8.059 1.00 0.00 H new ATOM 0 HB3 ASP A 170 134.179 -10.836 8.912 1.00 0.00 H new ATOM 2346 N GLU A 171 134.185 -8.189 9.628 1.00 0.00 N ATOM 2347 CA GLU A 171 134.742 -7.244 10.582 1.00 0.00 C ATOM 2348 C GLU A 171 133.930 -5.961 10.554 1.00 0.00 C ATOM 2349 O GLU A 171 133.869 -5.228 11.539 1.00 0.00 O ATOM 2350 CB GLU A 171 136.206 -6.950 10.256 1.00 0.00 C ATOM 2351 CG GLU A 171 136.801 -6.056 11.345 1.00 0.00 C ATOM 2352 CD GLU A 171 138.251 -5.734 11.009 1.00 0.00 C ATOM 2353 OE1 GLU A 171 138.726 -6.228 10.002 1.00 0.00 O ATOM 2354 OE2 GLU A 171 138.867 -5.002 11.768 1.00 0.00 O ATOM 0 H GLU A 171 134.831 -8.496 8.901 1.00 0.00 H new ATOM 0 HA GLU A 171 134.697 -7.679 11.580 1.00 0.00 H new ATOM 0 HB2 GLU A 171 136.768 -7.881 10.187 1.00 0.00 H new ATOM 0 HB3 GLU A 171 136.282 -6.459 9.286 1.00 0.00 H new ATOM 0 HG2 GLU A 171 136.224 -5.135 11.429 1.00 0.00 H new ATOM 0 HG3 GLU A 171 136.744 -6.557 12.311 1.00 0.00 H new ATOM 2361 N ALA A 172 133.289 -5.707 9.419 1.00 0.00 N ATOM 2362 CA ALA A 172 132.466 -4.520 9.279 1.00 0.00 C ATOM 2363 C ALA A 172 131.431 -4.490 10.396 1.00 0.00 C ATOM 2364 O ALA A 172 131.054 -3.422 10.878 1.00 0.00 O ATOM 2365 CB ALA A 172 131.766 -4.524 7.920 1.00 0.00 C ATOM 0 H ALA A 172 133.325 -6.303 8.592 1.00 0.00 H new ATOM 0 HA ALA A 172 133.097 -3.634 9.344 1.00 0.00 H new ATOM 0 HB1 ALA A 172 131.151 -3.629 7.825 1.00 0.00 H new ATOM 0 HB2 ALA A 172 132.513 -4.537 7.126 1.00 0.00 H new ATOM 0 HB3 ALA A 172 131.134 -5.409 7.839 1.00 0.00 H new ATOM 2371 N ILE A 173 130.993 -5.674 10.822 1.00 0.00 N ATOM 2372 CA ILE A 173 130.022 -5.763 11.904 1.00 0.00 C ATOM 2373 C ILE A 173 130.595 -5.104 13.148 1.00 0.00 C ATOM 2374 O ILE A 173 129.864 -4.557 13.974 1.00 0.00 O ATOM 2375 CB ILE A 173 129.689 -7.225 12.215 1.00 0.00 C ATOM 2376 CG1 ILE A 173 128.441 -7.277 13.102 1.00 0.00 C ATOM 2377 CG2 ILE A 173 130.860 -7.886 12.950 1.00 0.00 C ATOM 2378 CD1 ILE A 173 128.258 -8.692 13.655 1.00 0.00 C ATOM 0 H ILE A 173 131.292 -6.571 10.439 1.00 0.00 H new ATOM 0 HA ILE A 173 129.109 -5.254 11.596 1.00 0.00 H new ATOM 0 HB ILE A 173 129.507 -7.759 11.282 1.00 0.00 H new ATOM 0 HG12 ILE A 173 128.536 -6.565 13.922 1.00 0.00 H new ATOM 0 HG13 ILE A 173 127.562 -6.985 12.527 1.00 0.00 H new ATOM 0 HG21 ILE A 173 130.613 -8.925 13.167 1.00 0.00 H new ATOM 0 HG22 ILE A 173 131.751 -7.847 12.323 1.00 0.00 H new ATOM 0 HG23 ILE A 173 131.050 -7.356 13.883 1.00 0.00 H new ATOM 0 HD11 ILE A 173 127.369 -8.724 14.285 1.00 0.00 H new ATOM 0 HD12 ILE A 173 128.143 -9.393 12.829 1.00 0.00 H new ATOM 0 HD13 ILE A 173 129.132 -8.968 14.246 1.00 0.00 H new ATOM 2382 N LEU A 174 131.917 -5.156 13.268 1.00 0.00 N ATOM 2383 CA LEU A 174 132.588 -4.555 14.414 1.00 0.00 C ATOM 2384 C LEU A 174 132.243 -3.072 14.505 1.00 0.00 C ATOM 2385 O LEU A 174 132.056 -2.532 15.596 1.00 0.00 O ATOM 2386 CB LEU A 174 134.104 -4.721 14.283 1.00 0.00 C ATOM 2387 CG LEU A 174 134.793 -4.235 15.563 1.00 0.00 C ATOM 2388 CD1 LEU A 174 134.538 -5.224 16.704 1.00 0.00 C ATOM 2389 CD2 LEU A 174 136.299 -4.124 15.315 1.00 0.00 C ATOM 0 H LEU A 174 132.539 -5.603 12.594 1.00 0.00 H new ATOM 0 HA LEU A 174 132.249 -5.058 15.319 1.00 0.00 H new ATOM 0 HB2 LEU A 174 134.350 -5.767 14.102 1.00 0.00 H new ATOM 0 HB3 LEU A 174 134.468 -4.155 13.426 1.00 0.00 H new ATOM 0 HG LEU A 174 134.390 -3.260 15.839 1.00 0.00 H new ATOM 0 HD11 LEU A 174 135.031 -4.870 17.609 1.00 0.00 H new ATOM 0 HD12 LEU A 174 133.466 -5.304 16.883 1.00 0.00 H new ATOM 0 HD13 LEU A 174 134.935 -6.202 16.433 1.00 0.00 H new ATOM 0 HD21 LEU A 174 136.793 -3.779 16.223 1.00 0.00 H new ATOM 0 HD22 LEU A 174 136.695 -5.101 15.036 1.00 0.00 H new ATOM 0 HD23 LEU A 174 136.484 -3.414 14.509 1.00 0.00 H new ATOM 2395 N ALA A 175 132.162 -2.420 13.349 1.00 0.00 N ATOM 2396 CA ALA A 175 131.839 -1.000 13.300 1.00 0.00 C ATOM 2397 C ALA A 175 130.373 -0.757 13.647 1.00 0.00 C ATOM 2398 O ALA A 175 129.977 0.369 13.947 1.00 0.00 O ATOM 2399 CB ALA A 175 132.129 -0.444 11.905 1.00 0.00 C ATOM 0 H ALA A 175 132.315 -2.851 12.437 1.00 0.00 H new ATOM 0 HA ALA A 175 132.460 -0.489 14.036 1.00 0.00 H new ATOM 0 HB1 ALA A 175 131.884 0.618 11.878 1.00 0.00 H new ATOM 0 HB2 ALA A 175 133.185 -0.579 11.672 1.00 0.00 H new ATOM 0 HB3 ALA A 175 131.524 -0.974 11.169 1.00 0.00 H new ATOM 2405 N ALA A 176 129.571 -1.818 13.611 1.00 0.00 N ATOM 2406 CA ALA A 176 128.152 -1.701 13.928 1.00 0.00 C ATOM 2407 C ALA A 176 127.961 -1.271 15.378 1.00 0.00 C ATOM 2408 O ALA A 176 127.002 -0.572 15.708 1.00 0.00 O ATOM 2409 CB ALA A 176 127.454 -3.044 13.700 1.00 0.00 C ATOM 0 H ALA A 176 129.877 -2.760 13.368 1.00 0.00 H new ATOM 0 HA ALA A 176 127.715 -0.946 13.274 1.00 0.00 H new ATOM 0 HB1 ALA A 176 126.395 -2.949 13.939 1.00 0.00 H new ATOM 0 HB2 ALA A 176 127.566 -3.340 12.657 1.00 0.00 H new ATOM 0 HB3 ALA A 176 127.904 -3.801 14.342 1.00 0.00 H new ATOM 2415 N LEU A 177 128.877 -1.696 16.241 1.00 0.00 N ATOM 2416 CA LEU A 177 128.797 -1.351 17.655 1.00 0.00 C ATOM 2417 C LEU A 177 128.815 0.163 17.836 1.00 0.00 C ATOM 2418 O LEU A 177 128.178 0.698 18.743 1.00 0.00 O ATOM 2419 CB LEU A 177 129.973 -1.973 18.411 1.00 0.00 C ATOM 2420 CG LEU A 177 129.995 -3.485 18.179 1.00 0.00 C ATOM 2421 CD1 LEU A 177 131.124 -4.110 19.000 1.00 0.00 C ATOM 2422 CD2 LEU A 177 128.658 -4.090 18.612 1.00 0.00 C ATOM 0 H LEU A 177 129.678 -2.276 15.989 1.00 0.00 H new ATOM 0 HA LEU A 177 127.862 -1.743 18.055 1.00 0.00 H new ATOM 0 HB2 LEU A 177 130.910 -1.530 18.073 1.00 0.00 H new ATOM 0 HB3 LEU A 177 129.886 -1.760 19.476 1.00 0.00 H new ATOM 0 HG LEU A 177 130.159 -3.686 17.120 1.00 0.00 H new ATOM 0 HD11 LEU A 177 131.140 -5.187 18.835 1.00 0.00 H new ATOM 0 HD12 LEU A 177 132.078 -3.681 18.692 1.00 0.00 H new ATOM 0 HD13 LEU A 177 130.960 -3.907 20.058 1.00 0.00 H new ATOM 0 HD21 LEU A 177 128.675 -5.167 18.446 1.00 0.00 H new ATOM 0 HD22 LEU A 177 128.493 -3.888 19.670 1.00 0.00 H new ATOM 0 HD23 LEU A 177 127.852 -3.646 18.028 1.00 0.00 H new ATOM 2428 N GLU A 178 129.551 0.848 16.966 1.00 0.00 N ATOM 2429 CA GLU A 178 129.647 2.301 17.039 1.00 0.00 C ATOM 2430 C GLU A 178 130.116 2.738 18.423 1.00 0.00 C ATOM 2431 O GLU A 178 131.048 3.530 18.542 1.00 99.99 O ATOM 2432 CB GLU A 178 128.287 2.933 16.733 1.00 0.00 C ATOM 2433 CG GLU A 178 127.880 2.599 15.297 1.00 0.00 C ATOM 2434 CD GLU A 178 126.555 3.274 14.962 1.00 0.00 C ATOM 2435 OE1 GLU A 178 125.932 3.794 15.872 1.00 0.00 O ATOM 2436 OE2 GLU A 178 126.183 3.262 13.800 1.00 0.00 O ATOM 0 H GLU A 178 130.086 0.424 16.208 1.00 0.00 H new ATOM 0 HA GLU A 178 130.375 2.635 16.300 1.00 0.00 H new ATOM 0 HB2 GLU A 178 127.536 2.562 17.431 1.00 0.00 H new ATOM 0 HB3 GLU A 178 128.338 4.014 16.866 1.00 0.00 H new ATOM 0 HG2 GLU A 178 128.653 2.932 14.604 1.00 0.00 H new ATOM 0 HG3 GLU A 178 127.788 1.519 15.178 1.00 0.00 H new