USER MOD reduce.3.24.130724 H: found=0, std=0, add=925, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 923 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 52 LYS NZ :NH3+ -146:sc= -3.36! (180deg=-1.15) USER MOD Set 1.2: A 58 GLN : amide:sc= -1.31 K(o=-4.7,f=-1.4!) USER MOD Set 1.3: A 61 SER OG : rot 125:sc= 0.00861 USER MOD Set 2.1: A 29 ASN : amide:sc= -0.195 K(o=-0.35,f=-1.5) USER MOD Set 2.2: A 36 GLN : amide:sc= -0.157 K(o=-0.35,f=-6.7!) USER MOD Set 3.1: A 25 ASN : amide:sc= -4.53! K(o=-4.5!,f=-0.93) USER MOD Set 3.2: A 27 THR OG1 : rot 180:sc= 0.00182 USER MOD Set 3.3: A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 169:sc= -0.778 (180deg=-1.19) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -0.193 X(o=-0.19,f=-0.19) USER MOD Single : A 34 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 GLN : amide:sc= -0.0194 K(o=-0.019,f=-1.7!) USER MOD Single : A 46 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 49 ASN : amide:sc= -1.48! K(o=-1.5!,f=-0.017) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 75 SER OG : rot -67:sc= 0.805 USER MOD Single : A 76 GLN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : A 79 THR OG1 : rot -18:sc= -0.196 USER MOD Single : A 80 SER OG : rot -25:sc= 0.627 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 LYS NZ :NH3+ -147:sc= -1.63 (180deg=-1.85) USER MOD Single : A 87 LYS NZ :NH3+ -163:sc= -0.0126 (180deg=-0.32) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 ASN : amide:sc= -1.09 K(o=-1.1,f=-0.038) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 MET CE :methyl -134:sc= -0.137 (180deg=-0.936) USER MOD Single : A 96 MET CE :methyl -129:sc= -0.101 (180deg=-0.753) USER MOD Single : A 103 CYS SG : rot -42:sc= -1.06! USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot -19:sc= 0.936 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -17.850 84.210 16.752 1.00 0.00 N ATOM 2 CA MET A 1 -16.728 84.365 15.785 1.00 0.00 C ATOM 3 C MET A 1 -16.477 83.034 15.085 1.00 0.00 C ATOM 4 O MET A 1 -15.686 82.956 14.144 1.00 0.00 O ATOM 5 CB MET A 1 -15.468 84.807 16.535 1.00 0.00 C ATOM 6 CG MET A 1 -15.323 83.988 17.819 1.00 0.00 C ATOM 7 SD MET A 1 -13.791 84.456 18.664 1.00 0.00 S ATOM 8 CE MET A 1 -13.899 83.253 20.010 1.00 0.00 C ATOM 0 H1 MET A 1 -17.903 85.052 17.360 1.00 0.00 H new ATOM 0 H2 MET A 1 -18.744 84.102 16.232 1.00 0.00 H new ATOM 0 H3 MET A 1 -17.687 83.368 17.340 1.00 0.00 H new ATOM 0 HA MET A 1 -16.984 85.119 15.041 1.00 0.00 H new ATOM 0 HB2 MET A 1 -14.590 84.671 15.904 1.00 0.00 H new ATOM 0 HB3 MET A 1 -15.528 85.869 16.773 1.00 0.00 H new ATOM 0 HG2 MET A 1 -16.178 84.161 18.472 1.00 0.00 H new ATOM 0 HG3 MET A 1 -15.311 82.924 17.585 1.00 0.00 H new ATOM 0 HE1 MET A 1 -13.037 83.365 20.668 1.00 0.00 H new ATOM 0 HE2 MET A 1 -14.813 83.424 20.578 1.00 0.00 H new ATOM 0 HE3 MET A 1 -13.912 82.245 19.597 1.00 0.00 H new ATOM 18 N SER A 2 -17.153 81.989 15.550 1.00 0.00 N ATOM 19 CA SER A 2 -16.992 80.665 14.960 1.00 0.00 C ATOM 20 C SER A 2 -15.513 80.330 14.784 1.00 0.00 C ATOM 21 O SER A 2 -15.161 79.386 14.076 1.00 0.00 O ATOM 22 CB SER A 2 -17.698 80.609 13.604 1.00 0.00 C ATOM 23 OG SER A 2 -18.939 81.296 13.693 1.00 0.00 O ATOM 0 H SER A 2 -17.812 82.032 16.327 1.00 0.00 H new ATOM 0 HA SER A 2 -17.438 79.932 15.632 1.00 0.00 H new ATOM 0 HB2 SER A 2 -17.072 81.063 12.836 1.00 0.00 H new ATOM 0 HB3 SER A 2 -17.863 79.573 13.309 1.00 0.00 H new ATOM 0 HG SER A 2 -19.394 81.264 12.825 1.00 0.00 H new ATOM 29 N ALA A 3 -14.653 81.110 15.431 1.00 0.00 N ATOM 30 CA ALA A 3 -13.215 80.888 15.335 1.00 0.00 C ATOM 31 C ALA A 3 -12.843 79.525 15.910 1.00 0.00 C ATOM 32 O ALA A 3 -11.972 78.833 15.383 1.00 0.00 O ATOM 33 CB ALA A 3 -12.466 81.985 16.094 1.00 0.00 C ATOM 0 H ALA A 3 -14.924 81.895 16.023 1.00 0.00 H new ATOM 0 HA ALA A 3 -12.932 80.915 14.283 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -11.392 81.812 16.018 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -12.709 82.956 15.663 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -12.762 81.969 17.143 1.00 0.00 H new ATOM 39 N THR A 4 -13.513 79.146 16.994 1.00 0.00 N ATOM 40 CA THR A 4 -13.251 77.863 17.635 1.00 0.00 C ATOM 41 C THR A 4 -13.640 76.715 16.709 1.00 0.00 C ATOM 42 O THR A 4 -12.925 75.718 16.604 1.00 0.00 O ATOM 43 CB THR A 4 -14.041 77.757 18.946 1.00 0.00 C ATOM 44 OG1 THR A 4 -14.323 76.391 19.217 1.00 0.00 O ATOM 45 CG2 THR A 4 -15.356 78.531 18.819 1.00 0.00 C ATOM 0 H THR A 4 -14.237 79.706 17.444 1.00 0.00 H new ATOM 0 HA THR A 4 -12.185 77.798 17.851 1.00 0.00 H new ATOM 0 HB THR A 4 -13.450 78.178 19.759 1.00 0.00 H new ATOM 0 HG1 THR A 4 -14.826 76.321 20.055 1.00 0.00 H new ATOM 0 HG21 THR A 4 -15.915 78.454 19.752 1.00 0.00 H new ATOM 0 HG22 THR A 4 -15.142 79.579 18.609 1.00 0.00 H new ATOM 0 HG23 THR A 4 -15.948 78.112 18.005 1.00 0.00 H new ATOM 53 N ALA A 5 -14.778 76.862 16.040 1.00 0.00 N ATOM 54 CA ALA A 5 -15.253 75.831 15.125 1.00 0.00 C ATOM 55 C ALA A 5 -14.348 75.743 13.904 1.00 0.00 C ATOM 56 O ALA A 5 -14.533 76.471 12.927 1.00 0.00 O ATOM 57 CB ALA A 5 -16.682 76.144 14.678 1.00 0.00 C ATOM 0 H ALA A 5 -15.385 77.679 16.113 1.00 0.00 H new ATOM 0 HA ALA A 5 -15.237 74.875 15.648 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -17.028 75.368 13.995 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -17.336 76.178 15.549 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -16.702 77.109 14.171 1.00 0.00 H new ATOM 63 N ALA A 6 -13.367 74.846 13.963 1.00 0.00 N ATOM 64 CA ALA A 6 -12.432 74.663 12.854 1.00 0.00 C ATOM 65 C ALA A 6 -12.026 73.200 12.744 1.00 0.00 C ATOM 66 O ALA A 6 -11.796 72.531 13.752 1.00 0.00 O ATOM 67 CB ALA A 6 -11.186 75.523 13.076 1.00 0.00 C ATOM 0 H ALA A 6 -13.198 74.236 14.763 1.00 0.00 H new ATOM 0 HA ALA A 6 -12.923 74.968 11.930 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -10.494 75.382 12.246 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -11.474 76.573 13.134 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -10.701 75.228 14.007 1.00 0.00 H new ATOM 73 N THR A 7 -11.938 72.707 11.511 1.00 0.00 N ATOM 74 CA THR A 7 -11.556 71.317 11.266 1.00 0.00 C ATOM 75 C THR A 7 -10.433 71.254 10.245 1.00 0.00 C ATOM 76 O THR A 7 -10.507 71.883 9.188 1.00 0.00 O ATOM 77 CB THR A 7 -12.760 70.529 10.747 1.00 0.00 C ATOM 78 OG1 THR A 7 -13.807 70.583 11.706 1.00 0.00 O ATOM 79 CG2 THR A 7 -12.352 69.073 10.515 1.00 0.00 C ATOM 0 H THR A 7 -12.126 73.248 10.667 1.00 0.00 H new ATOM 0 HA THR A 7 -11.213 70.879 12.203 1.00 0.00 H new ATOM 0 HB THR A 7 -13.105 70.963 9.808 1.00 0.00 H new ATOM 0 HG1 THR A 7 -14.580 70.080 11.375 1.00 0.00 H new ATOM 0 HG21 THR A 7 -13.209 68.510 10.145 1.00 0.00 H new ATOM 0 HG22 THR A 7 -11.547 69.033 9.781 1.00 0.00 H new ATOM 0 HG23 THR A 7 -12.009 68.637 11.453 1.00 0.00 H new ATOM 87 N VAL A 8 -9.388 70.487 10.557 1.00 0.00 N ATOM 88 CA VAL A 8 -8.254 70.351 9.644 1.00 0.00 C ATOM 89 C VAL A 8 -7.738 68.910 9.636 1.00 0.00 C ATOM 90 O VAL A 8 -7.823 68.210 10.648 1.00 0.00 O ATOM 91 CB VAL A 8 -7.126 71.296 10.072 1.00 0.00 C ATOM 92 CG1 VAL A 8 -7.482 72.730 9.670 1.00 0.00 C ATOM 93 CG2 VAL A 8 -6.944 71.219 11.590 1.00 0.00 C ATOM 0 H VAL A 8 -9.303 69.957 11.424 1.00 0.00 H new ATOM 0 HA VAL A 8 -8.587 70.610 8.639 1.00 0.00 H new ATOM 0 HB VAL A 8 -6.198 71.002 9.581 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -6.680 73.403 9.974 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -7.610 72.784 8.589 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -8.409 73.026 10.160 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -6.142 71.891 11.895 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -7.871 71.513 12.083 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -6.690 70.198 11.875 1.00 0.00 H new ATOM 103 N PRO A 9 -7.204 68.455 8.525 1.00 0.00 N ATOM 104 CA PRO A 9 -6.667 67.071 8.401 1.00 0.00 C ATOM 105 C PRO A 9 -5.953 66.605 9.681 1.00 0.00 C ATOM 106 O PRO A 9 -5.464 67.424 10.459 1.00 0.00 O ATOM 107 CB PRO A 9 -5.679 67.180 7.231 1.00 0.00 C ATOM 108 CG PRO A 9 -6.198 68.293 6.366 1.00 0.00 C ATOM 109 CD PRO A 9 -7.058 69.204 7.262 1.00 0.00 C ATOM 0 HA PRO A 9 -7.455 66.336 8.239 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -4.672 67.397 7.587 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -5.625 66.244 6.675 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -5.374 68.854 5.926 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -6.790 67.895 5.541 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -6.576 70.168 7.426 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -8.028 69.406 6.807 1.00 0.00 H new ATOM 117 N PRO A 10 -5.875 65.312 9.897 1.00 0.00 N ATOM 118 CA PRO A 10 -5.195 64.736 11.097 1.00 0.00 C ATOM 119 C PRO A 10 -3.680 64.951 11.057 1.00 0.00 C ATOM 120 O PRO A 10 -3.102 65.549 11.964 1.00 0.00 O ATOM 121 CB PRO A 10 -5.547 63.238 11.031 1.00 0.00 C ATOM 122 CG PRO A 10 -5.838 62.971 9.588 1.00 0.00 C ATOM 123 CD PRO A 10 -6.432 64.263 9.029 1.00 0.00 C ATOM 0 HA PRO A 10 -5.520 65.210 12.023 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -4.721 62.623 11.387 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -6.409 63.007 11.657 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -4.930 62.696 9.052 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -6.537 62.142 9.478 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -6.150 64.415 7.987 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -7.521 64.251 9.066 1.00 0.00 H new ATOM 131 N ALA A 11 -3.045 64.453 10.000 1.00 0.00 N ATOM 132 CA ALA A 11 -1.601 64.590 9.855 1.00 0.00 C ATOM 133 C ALA A 11 -1.172 64.213 8.444 1.00 0.00 C ATOM 134 O ALA A 11 -1.886 63.502 7.735 1.00 0.00 O ATOM 135 CB ALA A 11 -0.887 63.697 10.867 1.00 0.00 C ATOM 0 H ALA A 11 -3.504 63.955 9.237 1.00 0.00 H new ATOM 0 HA ALA A 11 -1.330 65.630 10.040 1.00 0.00 H new ATOM 0 HB1 ALA A 11 0.191 63.806 10.751 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -1.175 63.989 11.877 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -1.167 62.658 10.696 1.00 0.00 H new ATOM 141 N ALA A 12 -0.002 64.697 8.039 1.00 0.00 N ATOM 142 CA ALA A 12 0.511 64.413 6.705 1.00 0.00 C ATOM 143 C ALA A 12 0.320 62.928 6.357 1.00 0.00 C ATOM 144 O ALA A 12 -0.032 62.121 7.218 1.00 0.00 O ATOM 145 CB ALA A 12 2.007 64.799 6.626 1.00 0.00 C ATOM 0 H ALA A 12 0.605 65.284 8.612 1.00 0.00 H new ATOM 0 HA ALA A 12 -0.047 65.006 5.980 1.00 0.00 H new ATOM 0 HB1 ALA A 12 2.386 64.585 5.627 1.00 0.00 H new ATOM 0 HB2 ALA A 12 2.120 65.862 6.837 1.00 0.00 H new ATOM 0 HB3 ALA A 12 2.571 64.222 7.359 1.00 0.00 H new ATOM 151 N PRO A 13 0.557 62.560 5.123 1.00 0.00 N ATOM 152 CA PRO A 13 0.421 61.141 4.670 1.00 0.00 C ATOM 153 C PRO A 13 1.181 60.170 5.578 1.00 0.00 C ATOM 154 O PRO A 13 0.666 59.112 5.935 1.00 0.00 O ATOM 155 CB PRO A 13 1.032 61.150 3.258 1.00 0.00 C ATOM 156 CG PRO A 13 0.889 62.559 2.776 1.00 0.00 C ATOM 157 CD PRO A 13 0.966 63.450 4.019 1.00 0.00 C ATOM 0 HA PRO A 13 -0.615 60.804 4.693 1.00 0.00 H new ATOM 0 HB2 PRO A 13 2.079 60.846 3.280 1.00 0.00 H new ATOM 0 HB3 PRO A 13 0.512 60.454 2.600 1.00 0.00 H new ATOM 0 HG2 PRO A 13 1.679 62.810 2.069 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -0.059 62.698 2.257 1.00 0.00 H new ATOM 0 HD2 PRO A 13 1.974 63.837 4.171 1.00 0.00 H new ATOM 0 HD3 PRO A 13 0.303 64.311 3.934 1.00 0.00 H new ATOM 165 N ALA A 14 2.405 60.541 5.945 1.00 0.00 N ATOM 166 CA ALA A 14 3.225 59.697 6.807 1.00 0.00 C ATOM 167 C ALA A 14 4.594 60.338 7.041 1.00 0.00 C ATOM 168 O ALA A 14 4.732 61.253 7.853 1.00 0.00 O ATOM 169 CB ALA A 14 3.403 58.313 6.169 1.00 0.00 C ATOM 0 H ALA A 14 2.848 61.415 5.661 1.00 0.00 H new ATOM 0 HA ALA A 14 2.720 59.589 7.767 1.00 0.00 H new ATOM 0 HB1 ALA A 14 4.016 57.689 6.819 1.00 0.00 H new ATOM 0 HB2 ALA A 14 2.427 57.847 6.034 1.00 0.00 H new ATOM 0 HB3 ALA A 14 3.892 58.419 5.201 1.00 0.00 H new ATOM 175 N GLY A 15 5.601 59.850 6.322 1.00 0.00 N ATOM 176 CA GLY A 15 6.952 60.379 6.457 1.00 0.00 C ATOM 177 C GLY A 15 7.881 59.759 5.419 1.00 0.00 C ATOM 178 O GLY A 15 7.511 58.811 4.728 1.00 0.00 O ATOM 0 H GLY A 15 5.507 59.094 5.644 1.00 0.00 H new ATOM 0 HA2 GLY A 15 6.937 61.462 6.338 1.00 0.00 H new ATOM 0 HA3 GLY A 15 7.330 60.174 7.459 1.00 0.00 H new ATOM 182 N GLU A 16 9.091 60.303 5.317 1.00 0.00 N ATOM 183 CA GLU A 16 10.070 59.798 4.361 1.00 0.00 C ATOM 184 C GLU A 16 11.482 60.181 4.792 1.00 0.00 C ATOM 185 O GLU A 16 11.670 61.117 5.570 1.00 0.00 O ATOM 186 CB GLU A 16 9.780 60.367 2.970 1.00 0.00 C ATOM 187 CG GLU A 16 9.889 61.894 3.006 1.00 0.00 C ATOM 188 CD GLU A 16 9.495 62.475 1.654 1.00 0.00 C ATOM 189 OE1 GLU A 16 8.561 61.962 1.060 1.00 0.00 O ATOM 190 OE2 GLU A 16 10.132 63.426 1.231 1.00 0.00 O ATOM 0 H GLU A 16 9.415 61.089 5.881 1.00 0.00 H new ATOM 0 HA GLU A 16 9.997 58.711 4.328 1.00 0.00 H new ATOM 0 HB2 GLU A 16 10.485 59.959 2.245 1.00 0.00 H new ATOM 0 HB3 GLU A 16 8.782 60.071 2.646 1.00 0.00 H new ATOM 0 HG2 GLU A 16 9.242 62.295 3.786 1.00 0.00 H new ATOM 0 HG3 GLU A 16 10.909 62.189 3.255 1.00 0.00 H new ATOM 197 N GLY A 17 12.472 59.452 4.282 1.00 0.00 N ATOM 198 CA GLY A 17 13.869 59.723 4.617 1.00 0.00 C ATOM 199 C GLY A 17 14.779 59.416 3.435 1.00 0.00 C ATOM 200 O GLY A 17 15.998 59.324 3.585 1.00 0.00 O ATOM 0 H GLY A 17 12.335 58.673 3.638 1.00 0.00 H new ATOM 0 HA2 GLY A 17 13.982 60.768 4.907 1.00 0.00 H new ATOM 0 HA3 GLY A 17 14.165 59.120 5.476 1.00 0.00 H new ATOM 204 N GLY A 18 14.184 59.261 2.259 1.00 0.00 N ATOM 205 CA GLY A 18 14.957 58.966 1.059 1.00 0.00 C ATOM 206 C GLY A 18 14.042 58.610 -0.106 1.00 0.00 C ATOM 207 O GLY A 18 12.843 58.395 0.076 1.00 0.00 O ATOM 0 H GLY A 18 13.177 59.334 2.111 1.00 0.00 H new ATOM 0 HA2 GLY A 18 15.569 59.829 0.795 1.00 0.00 H new ATOM 0 HA3 GLY A 18 15.640 58.139 1.256 1.00 0.00 H new ATOM 211 N PRO A 19 14.584 58.548 -1.292 1.00 0.00 N ATOM 212 CA PRO A 19 13.798 58.215 -2.518 1.00 0.00 C ATOM 213 C PRO A 19 13.276 56.772 -2.495 1.00 0.00 C ATOM 214 O PRO A 19 13.758 55.947 -1.718 1.00 0.00 O ATOM 215 CB PRO A 19 14.799 58.435 -3.669 1.00 0.00 C ATOM 216 CG PRO A 19 16.151 58.316 -3.041 1.00 0.00 C ATOM 217 CD PRO A 19 16.004 58.789 -1.595 1.00 0.00 C ATOM 0 HA PRO A 19 12.903 58.830 -2.613 1.00 0.00 H new ATOM 0 HB2 PRO A 19 14.664 57.693 -4.456 1.00 0.00 H new ATOM 0 HB3 PRO A 19 14.663 59.414 -4.128 1.00 0.00 H new ATOM 0 HG2 PRO A 19 16.506 57.286 -3.078 1.00 0.00 H new ATOM 0 HG3 PRO A 19 16.881 58.924 -3.575 1.00 0.00 H new ATOM 0 HD2 PRO A 19 16.657 58.232 -0.923 1.00 0.00 H new ATOM 0 HD3 PRO A 19 16.263 59.843 -1.490 1.00 0.00 H new ATOM 225 N PRO A 20 12.315 56.458 -3.334 1.00 0.00 N ATOM 226 CA PRO A 20 11.728 55.084 -3.414 1.00 0.00 C ATOM 227 C PRO A 20 12.799 53.987 -3.378 1.00 0.00 C ATOM 228 O PRO A 20 13.202 53.464 -4.419 1.00 0.00 O ATOM 229 CB PRO A 20 10.981 55.090 -4.760 1.00 0.00 C ATOM 230 CG PRO A 20 10.623 56.523 -5.010 1.00 0.00 C ATOM 231 CD PRO A 20 11.676 57.382 -4.290 1.00 0.00 C ATOM 0 HA PRO A 20 11.083 54.863 -2.564 1.00 0.00 H new ATOM 0 HB2 PRO A 20 11.609 54.697 -5.559 1.00 0.00 H new ATOM 0 HB3 PRO A 20 10.090 54.464 -4.717 1.00 0.00 H new ATOM 0 HG2 PRO A 20 10.615 56.738 -6.079 1.00 0.00 H new ATOM 0 HG3 PRO A 20 9.624 56.742 -4.634 1.00 0.00 H new ATOM 0 HD2 PRO A 20 12.402 57.791 -4.992 1.00 0.00 H new ATOM 0 HD3 PRO A 20 11.216 58.227 -3.778 1.00 0.00 H new ATOM 239 N ALA A 21 13.250 53.641 -2.173 1.00 0.00 N ATOM 240 CA ALA A 21 14.268 52.603 -2.006 1.00 0.00 C ATOM 241 C ALA A 21 15.319 52.694 -3.118 1.00 0.00 C ATOM 242 O ALA A 21 15.147 52.094 -4.180 1.00 0.00 O ATOM 243 CB ALA A 21 13.609 51.224 -2.045 1.00 0.00 C ATOM 0 H ALA A 21 12.929 54.062 -1.301 1.00 0.00 H new ATOM 0 HA ALA A 21 14.758 52.751 -1.044 1.00 0.00 H new ATOM 0 HB1 ALA A 21 14.370 50.453 -1.920 1.00 0.00 H new ATOM 0 HB2 ALA A 21 12.879 51.147 -1.239 1.00 0.00 H new ATOM 0 HB3 ALA A 21 13.108 51.087 -3.003 1.00 0.00 H new ATOM 249 N PRO A 22 16.387 53.431 -2.917 1.00 0.00 N ATOM 250 CA PRO A 22 17.442 53.583 -3.954 1.00 0.00 C ATOM 251 C PRO A 22 18.359 52.350 -4.023 1.00 0.00 C ATOM 252 O PRO A 22 19.078 52.063 -3.063 1.00 0.00 O ATOM 253 CB PRO A 22 18.216 54.837 -3.509 1.00 0.00 C ATOM 254 CG PRO A 22 18.002 54.951 -2.027 1.00 0.00 C ATOM 255 CD PRO A 22 16.708 54.188 -1.691 1.00 0.00 C ATOM 0 HA PRO A 22 17.027 53.678 -4.957 1.00 0.00 H new ATOM 0 HB2 PRO A 22 19.276 54.745 -3.744 1.00 0.00 H new ATOM 0 HB3 PRO A 22 17.851 55.725 -4.025 1.00 0.00 H new ATOM 0 HG2 PRO A 22 18.848 54.531 -1.483 1.00 0.00 H new ATOM 0 HG3 PRO A 22 17.920 55.997 -1.730 1.00 0.00 H new ATOM 0 HD2 PRO A 22 16.851 53.521 -0.841 1.00 0.00 H new ATOM 0 HD3 PRO A 22 15.902 54.873 -1.427 1.00 0.00 H new ATOM 263 N PRO A 23 18.371 51.620 -5.129 1.00 0.00 N ATOM 264 CA PRO A 23 19.254 50.425 -5.268 1.00 0.00 C ATOM 265 C PRO A 23 20.711 50.742 -4.906 1.00 0.00 C ATOM 266 O PRO A 23 21.360 49.954 -4.219 1.00 0.00 O ATOM 267 CB PRO A 23 19.116 49.993 -6.746 1.00 0.00 C ATOM 268 CG PRO A 23 17.847 50.628 -7.239 1.00 0.00 C ATOM 269 CD PRO A 23 17.548 51.836 -6.336 1.00 0.00 C ATOM 0 HA PRO A 23 18.961 49.630 -4.583 1.00 0.00 H new ATOM 0 HB2 PRO A 23 19.973 50.325 -7.332 1.00 0.00 H new ATOM 0 HB3 PRO A 23 19.070 48.908 -6.834 1.00 0.00 H new ATOM 0 HG2 PRO A 23 17.955 50.944 -8.277 1.00 0.00 H new ATOM 0 HG3 PRO A 23 17.024 49.914 -7.207 1.00 0.00 H new ATOM 0 HD2 PRO A 23 17.808 52.772 -6.829 1.00 0.00 H new ATOM 0 HD3 PRO A 23 16.488 51.891 -6.087 1.00 0.00 H new ATOM 277 N PRO A 24 21.238 51.867 -5.345 1.00 0.00 N ATOM 278 CA PRO A 24 22.650 52.249 -5.037 1.00 0.00 C ATOM 279 C PRO A 24 22.925 52.294 -3.532 1.00 0.00 C ATOM 280 O PRO A 24 23.802 51.591 -3.028 1.00 0.00 O ATOM 281 CB PRO A 24 22.801 53.648 -5.676 1.00 0.00 C ATOM 282 CG PRO A 24 21.720 53.737 -6.701 1.00 0.00 C ATOM 283 CD PRO A 24 20.568 52.897 -6.169 1.00 0.00 C ATOM 0 HA PRO A 24 23.364 51.523 -5.426 1.00 0.00 H new ATOM 0 HB2 PRO A 24 22.698 54.434 -4.928 1.00 0.00 H new ATOM 0 HB3 PRO A 24 23.784 53.768 -6.131 1.00 0.00 H new ATOM 0 HG2 PRO A 24 21.411 54.771 -6.854 1.00 0.00 H new ATOM 0 HG3 PRO A 24 22.064 53.362 -7.665 1.00 0.00 H new ATOM 0 HD2 PRO A 24 19.876 53.496 -5.577 1.00 0.00 H new ATOM 0 HD3 PRO A 24 19.991 52.450 -6.978 1.00 0.00 H new ATOM 291 N ASN A 25 22.172 53.129 -2.826 1.00 0.00 N ATOM 292 CA ASN A 25 22.337 53.267 -1.384 1.00 0.00 C ATOM 293 C ASN A 25 23.775 53.655 -1.037 1.00 0.00 C ATOM 294 O ASN A 25 24.269 53.337 0.045 1.00 0.00 O ATOM 295 CB ASN A 25 21.980 51.953 -0.689 1.00 0.00 C ATOM 296 CG ASN A 25 21.893 52.162 0.820 1.00 0.00 C ATOM 297 OD1 ASN A 25 21.773 51.196 1.574 1.00 0.00 O ATOM 298 ND2 ASN A 25 21.955 53.371 1.310 1.00 0.00 N ATOM 0 H ASN A 25 21.443 53.719 -3.227 1.00 0.00 H new ATOM 0 HA ASN A 25 21.669 54.056 -1.038 1.00 0.00 H new ATOM 0 HB2 ASN A 25 21.028 51.580 -1.067 1.00 0.00 H new ATOM 0 HB3 ASN A 25 22.732 51.197 -0.916 1.00 0.00 H new ATOM 0 HD21 ASN A 25 21.904 53.516 2.318 1.00 0.00 H new ATOM 0 HD22 ASN A 25 22.054 54.170 0.684 1.00 0.00 H new ATOM 305 N LEU A 26 24.437 54.353 -1.957 1.00 0.00 N ATOM 306 CA LEU A 26 25.815 54.790 -1.733 1.00 0.00 C ATOM 307 C LEU A 26 25.877 55.787 -0.580 1.00 0.00 C ATOM 308 O LEU A 26 26.803 55.755 0.230 1.00 0.00 O ATOM 309 CB LEU A 26 26.388 55.424 -3.014 1.00 0.00 C ATOM 310 CG LEU A 26 26.989 54.334 -3.911 1.00 0.00 C ATOM 311 CD1 LEU A 26 25.951 53.232 -4.150 1.00 0.00 C ATOM 312 CD2 LEU A 26 27.407 54.958 -5.247 1.00 0.00 C ATOM 0 H LEU A 26 24.046 54.627 -2.858 1.00 0.00 H new ATOM 0 HA LEU A 26 26.416 53.919 -1.473 1.00 0.00 H new ATOM 0 HB2 LEU A 26 25.602 55.956 -3.550 1.00 0.00 H new ATOM 0 HB3 LEU A 26 27.152 56.158 -2.757 1.00 0.00 H new ATOM 0 HG LEU A 26 27.862 53.897 -3.425 1.00 0.00 H new ATOM 0 HD11 LEU A 26 26.381 52.459 -4.787 1.00 0.00 H new ATOM 0 HD12 LEU A 26 25.659 52.794 -3.196 1.00 0.00 H new ATOM 0 HD13 LEU A 26 25.074 53.658 -4.637 1.00 0.00 H new ATOM 0 HD21 LEU A 26 27.835 54.189 -5.890 1.00 0.00 H new ATOM 0 HD22 LEU A 26 26.534 55.393 -5.734 1.00 0.00 H new ATOM 0 HD23 LEU A 26 28.149 55.736 -5.069 1.00 0.00 H new ATOM 324 N THR A 27 24.895 56.677 -0.519 1.00 0.00 N ATOM 325 CA THR A 27 24.858 57.687 0.533 1.00 0.00 C ATOM 326 C THR A 27 25.223 57.078 1.885 1.00 0.00 C ATOM 327 O THR A 27 26.241 57.433 2.480 1.00 0.00 O ATOM 328 CB THR A 27 23.459 58.300 0.613 1.00 0.00 C ATOM 329 OG1 THR A 27 22.497 57.261 0.744 1.00 0.00 O ATOM 330 CG2 THR A 27 23.176 59.101 -0.657 1.00 0.00 C ATOM 0 H THR A 27 24.119 56.721 -1.179 1.00 0.00 H new ATOM 0 HA THR A 27 25.587 58.461 0.290 1.00 0.00 H new ATOM 0 HB THR A 27 23.401 58.963 1.477 1.00 0.00 H new ATOM 0 HG1 THR A 27 21.600 57.651 0.797 1.00 0.00 H new ATOM 0 HG21 THR A 27 22.179 59.537 -0.598 1.00 0.00 H new ATOM 0 HG22 THR A 27 23.914 59.897 -0.757 1.00 0.00 H new ATOM 0 HG23 THR A 27 23.233 58.442 -1.523 1.00 0.00 H new ATOM 338 N SER A 28 24.388 56.164 2.365 1.00 0.00 N ATOM 339 CA SER A 28 24.637 55.519 3.648 1.00 0.00 C ATOM 340 C SER A 28 25.960 54.756 3.626 1.00 0.00 C ATOM 341 O SER A 28 26.738 54.819 4.578 1.00 0.00 O ATOM 342 CB SER A 28 23.500 54.551 3.971 1.00 0.00 C ATOM 343 OG SER A 28 22.279 55.276 4.062 1.00 0.00 O ATOM 0 H SER A 28 23.540 55.855 1.890 1.00 0.00 H new ATOM 0 HA SER A 28 24.692 56.293 4.414 1.00 0.00 H new ATOM 0 HB2 SER A 28 23.426 53.787 3.197 1.00 0.00 H new ATOM 0 HB3 SER A 28 23.701 54.035 4.910 1.00 0.00 H new ATOM 0 HG SER A 28 21.546 54.658 4.267 1.00 0.00 H new ATOM 349 N ASN A 29 26.205 54.036 2.537 1.00 0.00 N ATOM 350 CA ASN A 29 27.435 53.262 2.406 1.00 0.00 C ATOM 351 C ASN A 29 28.612 54.176 2.079 1.00 0.00 C ATOM 352 O ASN A 29 28.442 55.380 1.888 1.00 0.00 O ATOM 353 CB ASN A 29 27.280 52.211 1.306 1.00 0.00 C ATOM 354 CG ASN A 29 26.248 51.167 1.719 1.00 0.00 C ATOM 355 OD1 ASN A 29 26.127 50.845 2.900 1.00 0.00 O ATOM 356 ND2 ASN A 29 25.494 50.615 0.807 1.00 0.00 N ATOM 0 H ASN A 29 25.574 53.972 1.738 1.00 0.00 H new ATOM 0 HA ASN A 29 27.630 52.764 3.356 1.00 0.00 H new ATOM 0 HB2 ASN A 29 26.972 52.689 0.376 1.00 0.00 H new ATOM 0 HB3 ASN A 29 28.239 51.730 1.115 1.00 0.00 H new ATOM 0 HD21 ASN A 29 24.802 49.914 1.073 1.00 0.00 H new ATOM 0 HD22 ASN A 29 25.597 50.884 -0.171 1.00 0.00 H new ATOM 363 N ARG A 30 29.807 53.597 2.026 1.00 0.00 N ATOM 364 CA ARG A 30 31.008 54.371 1.730 1.00 0.00 C ATOM 365 C ARG A 30 32.201 53.446 1.471 1.00 0.00 C ATOM 366 O ARG A 30 32.154 52.597 0.584 1.00 0.00 O ATOM 367 CB ARG A 30 31.305 55.317 2.896 1.00 0.00 C ATOM 368 CG ARG A 30 31.253 54.541 4.218 1.00 0.00 C ATOM 369 CD ARG A 30 31.611 55.474 5.374 1.00 0.00 C ATOM 370 NE ARG A 30 31.624 54.733 6.628 1.00 0.00 N ATOM 371 CZ ARG A 30 31.962 55.323 7.769 1.00 0.00 C ATOM 372 NH1 ARG A 30 32.287 56.584 7.776 1.00 0.00 N ATOM 373 NH2 ARG A 30 31.971 54.638 8.879 1.00 0.00 N ATOM 0 H ARG A 30 29.970 52.602 2.183 1.00 0.00 H new ATOM 0 HA ARG A 30 30.838 54.957 0.827 1.00 0.00 H new ATOM 0 HB2 ARG A 30 32.288 55.770 2.768 1.00 0.00 H new ATOM 0 HB3 ARG A 30 30.579 56.130 2.911 1.00 0.00 H new ATOM 0 HG2 ARG A 30 30.257 54.125 4.368 1.00 0.00 H new ATOM 0 HG3 ARG A 30 31.948 53.702 4.186 1.00 0.00 H new ATOM 0 HD2 ARG A 30 32.588 55.925 5.199 1.00 0.00 H new ATOM 0 HD3 ARG A 30 30.889 56.289 5.431 1.00 0.00 H new ATOM 0 HE ARG A 30 31.369 53.745 6.630 1.00 0.00 H new ATOM 0 HH11 ARG A 30 32.282 57.117 6.906 1.00 0.00 H new ATOM 0 HH12 ARG A 30 32.547 57.039 8.651 1.00 0.00 H new ATOM 0 HH21 ARG A 30 31.719 53.650 8.870 1.00 0.00 H new ATOM 0 HH22 ARG A 30 32.231 55.091 9.755 1.00 0.00 H new ATOM 387 N ARG A 31 33.263 53.615 2.250 1.00 0.00 N ATOM 388 CA ARG A 31 34.455 52.794 2.098 1.00 0.00 C ATOM 389 C ARG A 31 34.111 51.317 2.264 1.00 0.00 C ATOM 390 O ARG A 31 34.883 50.443 1.878 1.00 0.00 O ATOM 391 CB ARG A 31 35.499 53.200 3.141 1.00 0.00 C ATOM 392 CG ARG A 31 35.984 54.621 2.850 1.00 0.00 C ATOM 393 CD ARG A 31 36.970 55.062 3.935 1.00 0.00 C ATOM 394 NE ARG A 31 38.173 54.239 3.886 1.00 0.00 N ATOM 395 CZ ARG A 31 39.146 54.388 4.779 1.00 0.00 C ATOM 396 NH1 ARG A 31 39.036 55.286 5.719 1.00 0.00 N ATOM 397 NH2 ARG A 31 40.211 53.637 4.714 1.00 0.00 N ATOM 0 H ARG A 31 33.322 54.313 2.992 1.00 0.00 H new ATOM 0 HA ARG A 31 34.860 52.949 1.098 1.00 0.00 H new ATOM 0 HB2 ARG A 31 35.069 53.149 4.141 1.00 0.00 H new ATOM 0 HB3 ARG A 31 36.339 52.506 3.120 1.00 0.00 H new ATOM 0 HG2 ARG A 31 36.464 54.659 1.872 1.00 0.00 H new ATOM 0 HG3 ARG A 31 35.136 55.305 2.816 1.00 0.00 H new ATOM 0 HD2 ARG A 31 37.232 56.111 3.794 1.00 0.00 H new ATOM 0 HD3 ARG A 31 36.503 54.979 4.917 1.00 0.00 H new ATOM 0 HE ARG A 31 38.269 53.536 3.153 1.00 0.00 H new ATOM 0 HH11 ARG A 31 38.204 55.873 5.768 1.00 0.00 H new ATOM 0 HH12 ARG A 31 39.782 55.401 6.405 1.00 0.00 H new ATOM 0 HH21 ARG A 31 40.297 52.936 3.978 1.00 0.00 H new ATOM 0 HH22 ARG A 31 40.958 53.751 5.399 1.00 0.00 H new ATOM 411 N LEU A 32 32.945 51.047 2.846 1.00 0.00 N ATOM 412 CA LEU A 32 32.505 49.677 3.063 1.00 0.00 C ATOM 413 C LEU A 32 31.893 49.103 1.789 1.00 0.00 C ATOM 414 O LEU A 32 31.437 47.960 1.766 1.00 0.00 O ATOM 415 CB LEU A 32 31.469 49.634 4.189 1.00 0.00 C ATOM 416 CG LEU A 32 32.075 50.209 5.475 1.00 0.00 C ATOM 417 CD1 LEU A 32 30.998 50.263 6.563 1.00 0.00 C ATOM 418 CD2 LEU A 32 33.248 49.329 5.950 1.00 0.00 C ATOM 0 H LEU A 32 32.292 51.758 3.174 1.00 0.00 H new ATOM 0 HA LEU A 32 33.372 49.077 3.341 1.00 0.00 H new ATOM 0 HB2 LEU A 32 30.586 50.206 3.905 1.00 0.00 H new ATOM 0 HB3 LEU A 32 31.143 48.607 4.357 1.00 0.00 H new ATOM 0 HG LEU A 32 32.447 51.214 5.277 1.00 0.00 H new ATOM 0 HD11 LEU A 32 31.426 50.671 7.479 1.00 0.00 H new ATOM 0 HD12 LEU A 32 30.177 50.899 6.231 1.00 0.00 H new ATOM 0 HD13 LEU A 32 30.624 49.257 6.755 1.00 0.00 H new ATOM 0 HD21 LEU A 32 33.670 49.747 6.864 1.00 0.00 H new ATOM 0 HD22 LEU A 32 32.889 48.319 6.146 1.00 0.00 H new ATOM 0 HD23 LEU A 32 34.016 49.298 5.177 1.00 0.00 H new ATOM 430 N GLN A 33 31.887 49.906 0.730 1.00 0.00 N ATOM 431 CA GLN A 33 31.326 49.466 -0.543 1.00 0.00 C ATOM 432 C GLN A 33 32.022 48.194 -1.015 1.00 0.00 C ATOM 433 O GLN A 33 31.378 47.271 -1.511 1.00 0.00 O ATOM 434 CB GLN A 33 31.496 50.567 -1.595 1.00 0.00 C ATOM 435 CG GLN A 33 30.743 50.187 -2.874 1.00 0.00 C ATOM 436 CD GLN A 33 29.241 50.187 -2.612 1.00 0.00 C ATOM 437 OE1 GLN A 33 28.612 49.130 -2.604 1.00 0.00 O ATOM 438 NE2 GLN A 33 28.629 51.319 -2.394 1.00 0.00 N ATOM 0 H GLN A 33 32.260 50.855 0.727 1.00 0.00 H new ATOM 0 HA GLN A 33 30.265 49.259 -0.405 1.00 0.00 H new ATOM 0 HB2 GLN A 33 31.118 51.513 -1.208 1.00 0.00 H new ATOM 0 HB3 GLN A 33 32.554 50.712 -1.815 1.00 0.00 H new ATOM 0 HG2 GLN A 33 30.982 50.892 -3.670 1.00 0.00 H new ATOM 0 HG3 GLN A 33 31.061 49.202 -3.215 1.00 0.00 H new ATOM 0 HE21 GLN A 33 29.155 52.193 -2.402 1.00 0.00 H new ATOM 0 HE22 GLN A 33 27.625 51.330 -2.216 1.00 0.00 H new ATOM 447 N GLN A 34 33.341 48.152 -0.858 1.00 0.00 N ATOM 448 CA GLN A 34 34.112 46.989 -1.271 1.00 0.00 C ATOM 449 C GLN A 34 33.718 45.762 -0.454 1.00 0.00 C ATOM 450 O GLN A 34 33.633 44.654 -0.984 1.00 0.00 O ATOM 451 CB GLN A 34 35.607 47.267 -1.100 1.00 0.00 C ATOM 452 CG GLN A 34 35.886 47.692 0.342 1.00 0.00 C ATOM 453 CD GLN A 34 37.334 48.144 0.484 1.00 0.00 C ATOM 454 OE1 GLN A 34 38.141 47.944 -0.423 1.00 0.00 O ATOM 455 NE2 GLN A 34 37.714 48.749 1.576 1.00 0.00 N ATOM 0 H GLN A 34 33.894 48.906 -0.450 1.00 0.00 H new ATOM 0 HA GLN A 34 33.899 46.790 -2.321 1.00 0.00 H new ATOM 0 HB2 GLN A 34 36.184 46.375 -1.345 1.00 0.00 H new ATOM 0 HB3 GLN A 34 35.923 48.051 -1.789 1.00 0.00 H new ATOM 0 HG2 GLN A 34 35.215 48.502 0.627 1.00 0.00 H new ATOM 0 HG3 GLN A 34 35.688 46.861 1.019 1.00 0.00 H new ATOM 0 HE21 GLN A 34 37.044 48.914 2.327 1.00 0.00 H new ATOM 0 HE22 GLN A 34 38.681 49.057 1.678 1.00 0.00 H new ATOM 464 N THR A 35 33.486 45.967 0.837 1.00 0.00 N ATOM 465 CA THR A 35 33.107 44.868 1.718 1.00 0.00 C ATOM 466 C THR A 35 31.776 44.263 1.284 1.00 0.00 C ATOM 467 O THR A 35 31.631 43.042 1.221 1.00 0.00 O ATOM 468 CB THR A 35 32.995 45.370 3.159 1.00 0.00 C ATOM 469 OG1 THR A 35 34.159 46.113 3.491 1.00 0.00 O ATOM 470 CG2 THR A 35 32.863 44.178 4.107 1.00 0.00 C ATOM 0 H THR A 35 33.553 46.876 1.295 1.00 0.00 H new ATOM 0 HA THR A 35 33.877 44.099 1.658 1.00 0.00 H new ATOM 0 HB THR A 35 32.116 46.007 3.255 1.00 0.00 H new ATOM 0 HG1 THR A 35 34.088 46.437 4.413 1.00 0.00 H new ATOM 0 HG21 THR A 35 32.783 44.536 5.133 1.00 0.00 H new ATOM 0 HG22 THR A 35 31.970 43.607 3.852 1.00 0.00 H new ATOM 0 HG23 THR A 35 33.741 43.539 4.013 1.00 0.00 H new ATOM 478 N GLN A 36 30.807 45.123 0.989 1.00 0.00 N ATOM 479 CA GLN A 36 29.491 44.660 0.566 1.00 0.00 C ATOM 480 C GLN A 36 29.586 43.911 -0.759 1.00 0.00 C ATOM 481 O GLN A 36 28.913 42.903 -0.961 1.00 0.00 O ATOM 482 CB GLN A 36 28.540 45.848 0.416 1.00 0.00 C ATOM 483 CG GLN A 36 28.278 46.471 1.787 1.00 0.00 C ATOM 484 CD GLN A 36 27.375 47.690 1.643 1.00 0.00 C ATOM 485 OE1 GLN A 36 27.745 48.664 0.986 1.00 0.00 O ATOM 486 NE2 GLN A 36 26.206 47.696 2.224 1.00 0.00 N ATOM 0 H GLN A 36 30.907 46.137 1.035 1.00 0.00 H new ATOM 0 HA GLN A 36 29.105 43.982 1.327 1.00 0.00 H new ATOM 0 HB2 GLN A 36 28.972 46.590 -0.255 1.00 0.00 H new ATOM 0 HB3 GLN A 36 27.601 45.521 -0.032 1.00 0.00 H new ATOM 0 HG2 GLN A 36 27.811 45.738 2.445 1.00 0.00 H new ATOM 0 HG3 GLN A 36 29.221 46.760 2.250 1.00 0.00 H new ATOM 0 HE21 GLN A 36 25.902 46.888 2.767 1.00 0.00 H new ATOM 0 HE22 GLN A 36 25.596 48.509 2.135 1.00 0.00 H new ATOM 495 N ALA A 37 30.425 44.415 -1.657 1.00 0.00 N ATOM 496 CA ALA A 37 30.602 43.788 -2.962 1.00 0.00 C ATOM 497 C ALA A 37 30.961 42.315 -2.806 1.00 0.00 C ATOM 498 O ALA A 37 30.955 41.558 -3.777 1.00 0.00 O ATOM 499 CB ALA A 37 31.706 44.505 -3.742 1.00 0.00 C ATOM 0 H ALA A 37 30.990 45.251 -1.507 1.00 0.00 H new ATOM 0 HA ALA A 37 29.663 43.864 -3.510 1.00 0.00 H new ATOM 0 HB1 ALA A 37 31.831 44.030 -4.715 1.00 0.00 H new ATOM 0 HB2 ALA A 37 31.433 45.551 -3.881 1.00 0.00 H new ATOM 0 HB3 ALA A 37 32.642 44.445 -3.186 1.00 0.00 H new ATOM 505 N GLN A 38 31.274 41.914 -1.578 1.00 0.00 N ATOM 506 CA GLN A 38 31.636 40.528 -1.306 1.00 0.00 C ATOM 507 C GLN A 38 30.540 39.584 -1.791 1.00 0.00 C ATOM 508 O GLN A 38 30.822 38.515 -2.328 1.00 0.00 O ATOM 509 CB GLN A 38 31.855 40.331 0.196 1.00 0.00 C ATOM 510 CG GLN A 38 32.280 38.887 0.466 1.00 0.00 C ATOM 511 CD GLN A 38 32.678 38.725 1.929 1.00 0.00 C ATOM 512 OE1 GLN A 38 32.957 39.712 2.609 1.00 0.00 O ATOM 513 NE2 GLN A 38 32.718 37.533 2.457 1.00 0.00 N ATOM 0 H GLN A 38 31.284 42.524 -0.761 1.00 0.00 H new ATOM 0 HA GLN A 38 32.559 40.301 -1.840 1.00 0.00 H new ATOM 0 HB2 GLN A 38 32.620 41.019 0.556 1.00 0.00 H new ATOM 0 HB3 GLN A 38 30.939 40.559 0.741 1.00 0.00 H new ATOM 0 HG2 GLN A 38 31.462 38.208 0.226 1.00 0.00 H new ATOM 0 HG3 GLN A 38 33.117 38.619 -0.179 1.00 0.00 H new ATOM 0 HE21 GLN A 38 32.486 36.717 1.891 1.00 0.00 H new ATOM 0 HE22 GLN A 38 32.981 37.417 3.436 1.00 0.00 H new ATOM 522 N VAL A 39 29.290 39.982 -1.595 1.00 0.00 N ATOM 523 CA VAL A 39 28.163 39.158 -2.018 1.00 0.00 C ATOM 524 C VAL A 39 28.141 39.021 -3.539 1.00 0.00 C ATOM 525 O VAL A 39 27.847 37.951 -4.070 1.00 0.00 O ATOM 526 CB VAL A 39 26.850 39.783 -1.542 1.00 0.00 C ATOM 527 CG1 VAL A 39 26.596 41.094 -2.293 1.00 0.00 C ATOM 528 CG2 VAL A 39 25.697 38.809 -1.803 1.00 0.00 C ATOM 0 H VAL A 39 29.031 40.862 -1.150 1.00 0.00 H new ATOM 0 HA VAL A 39 28.275 38.168 -1.576 1.00 0.00 H new ATOM 0 HB VAL A 39 26.916 39.990 -0.474 1.00 0.00 H new ATOM 0 HG11 VAL A 39 25.660 41.534 -1.950 1.00 0.00 H new ATOM 0 HG12 VAL A 39 27.415 41.788 -2.102 1.00 0.00 H new ATOM 0 HG13 VAL A 39 26.532 40.894 -3.363 1.00 0.00 H new ATOM 0 HG21 VAL A 39 24.761 39.254 -1.464 1.00 0.00 H new ATOM 0 HG22 VAL A 39 25.633 38.599 -2.871 1.00 0.00 H new ATOM 0 HG23 VAL A 39 25.875 37.881 -1.260 1.00 0.00 H new ATOM 538 N ASP A 40 28.449 40.114 -4.229 1.00 0.00 N ATOM 539 CA ASP A 40 28.457 40.110 -5.687 1.00 0.00 C ATOM 540 C ASP A 40 29.605 39.258 -6.220 1.00 0.00 C ATOM 541 O ASP A 40 29.581 38.817 -7.368 1.00 0.00 O ATOM 542 CB ASP A 40 28.599 41.540 -6.214 1.00 0.00 C ATOM 543 CG ASP A 40 27.315 42.322 -5.958 1.00 0.00 C ATOM 544 OD1 ASP A 40 26.335 41.705 -5.579 1.00 0.00 O ATOM 545 OD2 ASP A 40 27.332 43.527 -6.147 1.00 0.00 O ATOM 0 H ASP A 40 28.695 41.009 -3.805 1.00 0.00 H new ATOM 0 HA ASP A 40 27.514 39.685 -6.031 1.00 0.00 H new ATOM 0 HB2 ASP A 40 29.439 42.034 -5.726 1.00 0.00 H new ATOM 0 HB3 ASP A 40 28.817 41.523 -7.282 1.00 0.00 H new ATOM 550 N GLU A 41 30.610 39.034 -5.380 1.00 0.00 N ATOM 551 CA GLU A 41 31.762 38.235 -5.782 1.00 0.00 C ATOM 552 C GLU A 41 31.350 36.787 -6.027 1.00 0.00 C ATOM 553 O GLU A 41 31.811 36.152 -6.974 1.00 0.00 O ATOM 554 CB GLU A 41 32.837 38.285 -4.695 1.00 0.00 C ATOM 555 CG GLU A 41 34.100 37.578 -5.189 1.00 0.00 C ATOM 556 CD GLU A 41 35.186 37.648 -4.120 1.00 0.00 C ATOM 557 OE1 GLU A 41 34.862 37.997 -2.997 1.00 0.00 O ATOM 558 OE2 GLU A 41 36.324 37.351 -4.440 1.00 0.00 O ATOM 0 H GLU A 41 30.651 39.391 -4.425 1.00 0.00 H new ATOM 0 HA GLU A 41 32.162 38.648 -6.708 1.00 0.00 H new ATOM 0 HB2 GLU A 41 33.064 39.320 -4.441 1.00 0.00 H new ATOM 0 HB3 GLU A 41 32.472 37.806 -3.786 1.00 0.00 H new ATOM 0 HG2 GLU A 41 33.876 36.538 -5.425 1.00 0.00 H new ATOM 0 HG3 GLU A 41 34.452 38.045 -6.109 1.00 0.00 H new ATOM 565 N VAL A 42 30.479 36.272 -5.165 1.00 0.00 N ATOM 566 CA VAL A 42 30.012 34.897 -5.295 1.00 0.00 C ATOM 567 C VAL A 42 29.230 34.722 -6.591 1.00 0.00 C ATOM 568 O VAL A 42 29.413 33.742 -7.309 1.00 0.00 O ATOM 569 CB VAL A 42 29.125 34.528 -4.101 1.00 0.00 C ATOM 570 CG1 VAL A 42 28.540 33.127 -4.306 1.00 0.00 C ATOM 571 CG2 VAL A 42 29.959 34.547 -2.818 1.00 0.00 C ATOM 0 H VAL A 42 30.085 36.782 -4.374 1.00 0.00 H new ATOM 0 HA VAL A 42 30.879 34.237 -5.315 1.00 0.00 H new ATOM 0 HB VAL A 42 28.314 35.251 -4.019 1.00 0.00 H new ATOM 0 HG11 VAL A 42 27.910 32.868 -3.455 1.00 0.00 H new ATOM 0 HG12 VAL A 42 27.943 33.112 -5.218 1.00 0.00 H new ATOM 0 HG13 VAL A 42 29.350 32.403 -4.391 1.00 0.00 H new ATOM 0 HG21 VAL A 42 29.327 34.284 -1.969 1.00 0.00 H new ATOM 0 HG22 VAL A 42 30.772 33.826 -2.902 1.00 0.00 H new ATOM 0 HG23 VAL A 42 30.373 35.544 -2.668 1.00 0.00 H new ATOM 581 N VAL A 43 28.361 35.680 -6.885 1.00 0.00 N ATOM 582 CA VAL A 43 27.556 35.621 -8.098 1.00 0.00 C ATOM 583 C VAL A 43 28.457 35.598 -9.328 1.00 0.00 C ATOM 584 O VAL A 43 28.212 34.850 -10.274 1.00 0.00 O ATOM 585 CB VAL A 43 26.617 36.827 -8.163 1.00 0.00 C ATOM 586 CG1 VAL A 43 25.853 36.810 -9.490 1.00 0.00 C ATOM 587 CG2 VAL A 43 25.624 36.759 -7.000 1.00 0.00 C ATOM 0 H VAL A 43 28.196 36.502 -6.304 1.00 0.00 H new ATOM 0 HA VAL A 43 26.962 34.708 -8.079 1.00 0.00 H new ATOM 0 HB VAL A 43 27.199 37.746 -8.093 1.00 0.00 H new ATOM 0 HG11 VAL A 43 25.184 37.669 -9.536 1.00 0.00 H new ATOM 0 HG12 VAL A 43 26.561 36.856 -10.318 1.00 0.00 H new ATOM 0 HG13 VAL A 43 25.270 35.892 -9.562 1.00 0.00 H new ATOM 0 HG21 VAL A 43 24.953 37.617 -7.044 1.00 0.00 H new ATOM 0 HG22 VAL A 43 25.042 35.840 -7.071 1.00 0.00 H new ATOM 0 HG23 VAL A 43 26.168 36.771 -6.056 1.00 0.00 H new ATOM 597 N ASP A 44 29.495 36.425 -9.308 1.00 0.00 N ATOM 598 CA ASP A 44 30.422 36.493 -10.431 1.00 0.00 C ATOM 599 C ASP A 44 31.095 35.140 -10.655 1.00 0.00 C ATOM 600 O ASP A 44 31.272 34.711 -11.796 1.00 0.00 O ATOM 601 CB ASP A 44 31.492 37.552 -10.160 1.00 0.00 C ATOM 602 CG ASP A 44 30.885 38.947 -10.259 1.00 0.00 C ATOM 603 OD1 ASP A 44 29.786 39.058 -10.778 1.00 0.00 O ATOM 604 OD2 ASP A 44 31.528 39.885 -9.816 1.00 0.00 O ATOM 0 H ASP A 44 29.715 37.052 -8.535 1.00 0.00 H new ATOM 0 HA ASP A 44 29.859 36.761 -11.325 1.00 0.00 H new ATOM 0 HB2 ASP A 44 31.920 37.403 -9.169 1.00 0.00 H new ATOM 0 HB3 ASP A 44 32.306 37.449 -10.877 1.00 0.00 H new ATOM 609 N ILE A 45 31.467 34.471 -9.566 1.00 0.00 N ATOM 610 CA ILE A 45 32.118 33.170 -9.675 1.00 0.00 C ATOM 611 C ILE A 45 31.177 32.147 -10.304 1.00 0.00 C ATOM 612 O ILE A 45 31.579 31.370 -11.172 1.00 0.00 O ATOM 613 CB ILE A 45 32.551 32.687 -8.286 1.00 0.00 C ATOM 614 CG1 ILE A 45 33.671 33.590 -7.765 1.00 0.00 C ATOM 615 CG2 ILE A 45 33.058 31.243 -8.373 1.00 0.00 C ATOM 616 CD1 ILE A 45 33.932 33.284 -6.289 1.00 0.00 C ATOM 0 H ILE A 45 31.331 34.803 -8.611 1.00 0.00 H new ATOM 0 HA ILE A 45 32.995 33.275 -10.314 1.00 0.00 H new ATOM 0 HB ILE A 45 31.699 32.727 -7.607 1.00 0.00 H new ATOM 0 HG12 ILE A 45 34.580 33.431 -8.346 1.00 0.00 H new ATOM 0 HG13 ILE A 45 33.394 34.637 -7.886 1.00 0.00 H new ATOM 0 HG21 ILE A 45 33.364 30.905 -7.383 1.00 0.00 H new ATOM 0 HG22 ILE A 45 32.261 30.599 -8.746 1.00 0.00 H new ATOM 0 HG23 ILE A 45 33.909 31.197 -9.052 1.00 0.00 H new ATOM 0 HD11 ILE A 45 34.730 33.928 -5.919 1.00 0.00 H new ATOM 0 HD12 ILE A 45 33.024 33.465 -5.714 1.00 0.00 H new ATOM 0 HD13 ILE A 45 34.228 32.241 -6.181 1.00 0.00 H new ATOM 628 N MET A 46 29.924 32.151 -9.865 1.00 0.00 N ATOM 629 CA MET A 46 28.936 31.215 -10.388 1.00 0.00 C ATOM 630 C MET A 46 28.683 31.479 -11.871 1.00 0.00 C ATOM 631 O MET A 46 28.537 30.547 -12.660 1.00 0.00 O ATOM 632 CB MET A 46 27.625 31.352 -9.612 1.00 0.00 C ATOM 633 CG MET A 46 27.855 30.989 -8.142 1.00 0.00 C ATOM 634 SD MET A 46 28.275 29.234 -8.001 1.00 0.00 S ATOM 635 CE MET A 46 26.592 28.619 -7.754 1.00 0.00 C ATOM 0 H MET A 46 29.569 32.788 -9.152 1.00 0.00 H new ATOM 0 HA MET A 46 29.322 30.203 -10.271 1.00 0.00 H new ATOM 0 HB2 MET A 46 27.250 32.372 -9.690 1.00 0.00 H new ATOM 0 HB3 MET A 46 26.866 30.699 -10.043 1.00 0.00 H new ATOM 0 HG2 MET A 46 28.659 31.599 -7.729 1.00 0.00 H new ATOM 0 HG3 MET A 46 26.959 31.206 -7.560 1.00 0.00 H new ATOM 0 HE1 MET A 46 26.614 27.535 -7.641 1.00 0.00 H new ATOM 0 HE2 MET A 46 26.168 29.069 -6.856 1.00 0.00 H new ATOM 0 HE3 MET A 46 25.978 28.882 -8.616 1.00 0.00 H new ATOM 645 N ARG A 47 28.630 32.752 -12.241 1.00 0.00 N ATOM 646 CA ARG A 47 28.392 33.123 -13.629 1.00 0.00 C ATOM 647 C ARG A 47 29.510 32.599 -14.524 1.00 0.00 C ATOM 648 O ARG A 47 29.258 32.081 -15.611 1.00 0.00 O ATOM 649 CB ARG A 47 28.301 34.646 -13.755 1.00 0.00 C ATOM 650 CG ARG A 47 27.958 35.024 -15.197 1.00 0.00 C ATOM 651 CD ARG A 47 27.805 36.542 -15.302 1.00 0.00 C ATOM 652 NE ARG A 47 26.648 36.985 -14.534 1.00 0.00 N ATOM 653 CZ ARG A 47 26.397 38.277 -14.355 1.00 0.00 C ATOM 654 NH1 ARG A 47 27.193 39.173 -14.868 1.00 0.00 N ATOM 655 NH2 ARG A 47 25.353 38.648 -13.665 1.00 0.00 N ATOM 0 H ARG A 47 28.748 33.540 -11.604 1.00 0.00 H new ATOM 0 HA ARG A 47 27.450 32.677 -13.948 1.00 0.00 H new ATOM 0 HB2 ARG A 47 27.540 35.032 -13.077 1.00 0.00 H new ATOM 0 HB3 ARG A 47 29.248 35.102 -13.465 1.00 0.00 H new ATOM 0 HG2 ARG A 47 28.742 34.679 -15.871 1.00 0.00 H new ATOM 0 HG3 ARG A 47 27.035 34.532 -15.504 1.00 0.00 H new ATOM 0 HD2 ARG A 47 28.706 37.032 -14.932 1.00 0.00 H new ATOM 0 HD3 ARG A 47 27.690 36.832 -16.346 1.00 0.00 H new ATOM 0 HE ARG A 47 26.021 36.291 -14.127 1.00 0.00 H new ATOM 0 HH11 ARG A 47 28.009 38.882 -15.407 1.00 0.00 H new ATOM 0 HH12 ARG A 47 27.000 40.165 -14.730 1.00 0.00 H new ATOM 0 HH21 ARG A 47 24.731 37.946 -13.264 1.00 0.00 H new ATOM 0 HH22 ARG A 47 25.159 39.640 -13.527 1.00 0.00 H new ATOM 669 N VAL A 48 30.747 32.736 -14.059 1.00 0.00 N ATOM 670 CA VAL A 48 31.899 32.276 -14.822 1.00 0.00 C ATOM 671 C VAL A 48 31.859 30.762 -14.992 1.00 0.00 C ATOM 672 O VAL A 48 32.143 30.242 -16.071 1.00 0.00 O ATOM 673 CB VAL A 48 33.196 32.688 -14.116 1.00 0.00 C ATOM 674 CG1 VAL A 48 34.399 32.073 -14.841 1.00 0.00 C ATOM 675 CG2 VAL A 48 33.325 34.216 -14.122 1.00 0.00 C ATOM 0 H VAL A 48 30.976 33.161 -13.160 1.00 0.00 H new ATOM 0 HA VAL A 48 31.867 32.738 -15.809 1.00 0.00 H new ATOM 0 HB VAL A 48 33.171 32.329 -13.087 1.00 0.00 H new ATOM 0 HG11 VAL A 48 35.318 32.369 -14.336 1.00 0.00 H new ATOM 0 HG12 VAL A 48 34.313 30.986 -14.832 1.00 0.00 H new ATOM 0 HG13 VAL A 48 34.422 32.426 -15.872 1.00 0.00 H new ATOM 0 HG21 VAL A 48 34.248 34.505 -13.619 1.00 0.00 H new ATOM 0 HG22 VAL A 48 33.344 34.575 -15.151 1.00 0.00 H new ATOM 0 HG23 VAL A 48 32.475 34.655 -13.600 1.00 0.00 H new ATOM 685 N ASN A 49 31.514 30.060 -13.922 1.00 0.00 N ATOM 686 CA ASN A 49 31.451 28.606 -13.970 1.00 0.00 C ATOM 687 C ASN A 49 30.434 28.159 -15.013 1.00 0.00 C ATOM 688 O ASN A 49 30.669 27.206 -15.756 1.00 0.00 O ATOM 689 CB ASN A 49 31.056 28.058 -12.598 1.00 0.00 C ATOM 690 CG ASN A 49 32.188 28.280 -11.598 1.00 0.00 C ATOM 691 OD1 ASN A 49 32.000 28.085 -10.396 1.00 0.00 O ATOM 692 ND2 ASN A 49 33.355 28.686 -12.019 1.00 0.00 N ATOM 0 H ASN A 49 31.276 30.468 -13.018 1.00 0.00 H new ATOM 0 HA ASN A 49 32.433 28.220 -14.243 1.00 0.00 H new ATOM 0 HB2 ASN A 49 30.149 28.552 -12.248 1.00 0.00 H new ATOM 0 HB3 ASN A 49 30.831 26.994 -12.674 1.00 0.00 H new ATOM 0 HD21 ASN A 49 34.112 28.842 -11.353 1.00 0.00 H new ATOM 0 HD22 ASN A 49 33.510 28.847 -13.014 1.00 0.00 H new ATOM 699 N VAL A 50 29.306 28.858 -15.069 1.00 0.00 N ATOM 700 CA VAL A 50 28.264 28.527 -16.033 1.00 0.00 C ATOM 701 C VAL A 50 28.758 28.755 -17.454 1.00 0.00 C ATOM 702 O VAL A 50 28.514 27.946 -18.349 1.00 0.00 O ATOM 703 CB VAL A 50 27.012 29.369 -15.770 1.00 0.00 C ATOM 704 CG1 VAL A 50 25.979 29.122 -16.872 1.00 0.00 C ATOM 705 CG2 VAL A 50 26.413 28.979 -14.416 1.00 0.00 C ATOM 0 H VAL A 50 29.091 29.651 -14.464 1.00 0.00 H new ATOM 0 HA VAL A 50 28.011 27.473 -15.918 1.00 0.00 H new ATOM 0 HB VAL A 50 27.284 30.425 -15.762 1.00 0.00 H new ATOM 0 HG11 VAL A 50 25.091 29.724 -16.679 1.00 0.00 H new ATOM 0 HG12 VAL A 50 26.403 29.399 -17.837 1.00 0.00 H new ATOM 0 HG13 VAL A 50 25.707 28.067 -16.885 1.00 0.00 H new ATOM 0 HG21 VAL A 50 25.522 29.577 -14.227 1.00 0.00 H new ATOM 0 HG22 VAL A 50 26.145 27.922 -14.427 1.00 0.00 H new ATOM 0 HG23 VAL A 50 27.145 29.159 -13.629 1.00 0.00 H new ATOM 715 N ASP A 51 29.443 29.867 -17.650 1.00 0.00 N ATOM 716 CA ASP A 51 29.966 30.210 -18.969 1.00 0.00 C ATOM 717 C ASP A 51 31.052 29.226 -19.391 1.00 0.00 C ATOM 718 O ASP A 51 31.262 28.991 -20.581 1.00 0.00 O ATOM 719 CB ASP A 51 30.540 31.628 -18.955 1.00 0.00 C ATOM 720 CG ASP A 51 29.411 32.649 -18.850 1.00 0.00 C ATOM 721 OD1 ASP A 51 28.271 32.264 -19.051 1.00 0.00 O ATOM 722 OD2 ASP A 51 29.705 33.800 -18.575 1.00 0.00 O ATOM 0 H ASP A 51 29.652 30.548 -16.920 1.00 0.00 H new ATOM 0 HA ASP A 51 29.146 30.157 -19.685 1.00 0.00 H new ATOM 0 HB2 ASP A 51 31.225 31.743 -18.115 1.00 0.00 H new ATOM 0 HB3 ASP A 51 31.117 31.804 -19.863 1.00 0.00 H new ATOM 727 N LYS A 52 31.738 28.650 -18.410 1.00 0.00 N ATOM 728 CA LYS A 52 32.798 27.693 -18.687 1.00 0.00 C ATOM 729 C LYS A 52 32.223 26.431 -19.313 1.00 0.00 C ATOM 730 O LYS A 52 32.848 25.806 -20.169 1.00 0.00 O ATOM 731 CB LYS A 52 33.536 27.343 -17.395 1.00 0.00 C ATOM 732 CG LYS A 52 34.733 26.447 -17.716 1.00 0.00 C ATOM 733 CD LYS A 52 35.513 26.157 -16.432 1.00 0.00 C ATOM 734 CE LYS A 52 36.719 25.274 -16.758 1.00 0.00 C ATOM 735 NZ LYS A 52 37.489 25.008 -15.510 1.00 0.00 N ATOM 0 H LYS A 52 31.578 28.830 -17.419 1.00 0.00 H new ATOM 0 HA LYS A 52 33.500 28.143 -19.389 1.00 0.00 H new ATOM 0 HB2 LYS A 52 33.873 28.253 -16.898 1.00 0.00 H new ATOM 0 HB3 LYS A 52 32.862 26.834 -16.706 1.00 0.00 H new ATOM 0 HG2 LYS A 52 34.392 25.514 -18.166 1.00 0.00 H new ATOM 0 HG3 LYS A 52 35.380 26.934 -18.445 1.00 0.00 H new ATOM 0 HD2 LYS A 52 35.844 27.090 -15.976 1.00 0.00 H new ATOM 0 HD3 LYS A 52 34.869 25.659 -15.707 1.00 0.00 H new ATOM 0 HE2 LYS A 52 36.387 24.335 -17.201 1.00 0.00 H new ATOM 0 HE3 LYS A 52 37.356 25.766 -17.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 38.503 24.947 -15.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 37.330 25.781 -14.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 37.173 24.110 -15.092 1.00 0.00 H new ATOM 749 N VAL A 53 31.030 26.055 -18.870 1.00 0.00 N ATOM 750 CA VAL A 53 30.383 24.859 -19.387 1.00 0.00 C ATOM 751 C VAL A 53 30.100 25.010 -20.877 1.00 0.00 C ATOM 752 O VAL A 53 30.341 24.093 -21.660 1.00 0.00 O ATOM 753 CB VAL A 53 29.075 24.603 -18.640 1.00 0.00 C ATOM 754 CG1 VAL A 53 28.370 23.382 -19.241 1.00 0.00 C ATOM 755 CG2 VAL A 53 29.380 24.343 -17.164 1.00 0.00 C ATOM 0 H VAL A 53 30.496 26.557 -18.160 1.00 0.00 H new ATOM 0 HA VAL A 53 31.053 24.013 -19.237 1.00 0.00 H new ATOM 0 HB VAL A 53 28.426 25.474 -18.732 1.00 0.00 H new ATOM 0 HG11 VAL A 53 27.437 23.201 -18.707 1.00 0.00 H new ATOM 0 HG12 VAL A 53 28.155 23.567 -20.293 1.00 0.00 H new ATOM 0 HG13 VAL A 53 29.015 22.508 -19.151 1.00 0.00 H new ATOM 0 HG21 VAL A 53 28.449 24.160 -16.627 1.00 0.00 H new ATOM 0 HG22 VAL A 53 30.028 23.471 -17.074 1.00 0.00 H new ATOM 0 HG23 VAL A 53 29.880 25.212 -16.737 1.00 0.00 H new ATOM 765 N LEU A 54 29.586 26.173 -21.260 1.00 0.00 N ATOM 766 CA LEU A 54 29.274 26.429 -22.662 1.00 0.00 C ATOM 767 C LEU A 54 30.535 26.379 -23.511 1.00 0.00 C ATOM 768 O LEU A 54 30.536 25.823 -24.609 1.00 0.00 O ATOM 769 CB LEU A 54 28.600 27.802 -22.808 1.00 0.00 C ATOM 770 CG LEU A 54 28.321 28.107 -24.291 1.00 0.00 C ATOM 771 CD1 LEU A 54 27.448 27.000 -24.908 1.00 0.00 C ATOM 772 CD2 LEU A 54 27.602 29.457 -24.400 1.00 0.00 C ATOM 0 H LEU A 54 29.378 26.946 -20.628 1.00 0.00 H new ATOM 0 HA LEU A 54 28.591 25.654 -23.010 1.00 0.00 H new ATOM 0 HB2 LEU A 54 27.667 27.818 -22.245 1.00 0.00 H new ATOM 0 HB3 LEU A 54 29.241 28.576 -22.385 1.00 0.00 H new ATOM 0 HG LEU A 54 29.265 28.148 -24.834 1.00 0.00 H new ATOM 0 HD11 LEU A 54 27.258 27.228 -25.957 1.00 0.00 H new ATOM 0 HD12 LEU A 54 27.966 26.044 -24.833 1.00 0.00 H new ATOM 0 HD13 LEU A 54 26.501 26.943 -24.372 1.00 0.00 H new ATOM 0 HD21 LEU A 54 27.402 29.679 -25.448 1.00 0.00 H new ATOM 0 HD22 LEU A 54 26.661 29.413 -23.852 1.00 0.00 H new ATOM 0 HD23 LEU A 54 28.232 30.240 -23.977 1.00 0.00 H new ATOM 784 N GLU A 55 31.598 26.974 -22.999 1.00 0.00 N ATOM 785 CA GLU A 55 32.867 27.007 -23.718 1.00 0.00 C ATOM 786 C GLU A 55 33.993 27.480 -22.805 1.00 0.00 C ATOM 787 O GLU A 55 33.903 27.372 -21.584 1.00 0.00 O ATOM 788 CB GLU A 55 32.746 27.943 -24.927 1.00 0.00 C ATOM 789 CG GLU A 55 32.488 29.377 -24.453 1.00 0.00 C ATOM 790 CD GLU A 55 32.260 30.291 -25.653 1.00 0.00 C ATOM 791 OE1 GLU A 55 32.461 29.835 -26.766 1.00 0.00 O ATOM 792 OE2 GLU A 55 31.889 31.434 -25.440 1.00 0.00 O ATOM 0 H GLU A 55 31.612 27.440 -22.092 1.00 0.00 H new ATOM 0 HA GLU A 55 33.103 25.999 -24.059 1.00 0.00 H new ATOM 0 HB2 GLU A 55 33.660 27.906 -25.520 1.00 0.00 H new ATOM 0 HB3 GLU A 55 31.933 27.613 -25.574 1.00 0.00 H new ATOM 0 HG2 GLU A 55 31.618 29.401 -23.797 1.00 0.00 H new ATOM 0 HG3 GLU A 55 33.337 29.734 -23.870 1.00 0.00 H new ATOM 799 N ARG A 56 35.052 28.010 -23.409 1.00 0.00 N ATOM 800 CA ARG A 56 36.190 28.500 -22.643 1.00 0.00 C ATOM 801 C ARG A 56 36.750 27.395 -21.753 1.00 0.00 C ATOM 802 O ARG A 56 36.472 27.349 -20.555 1.00 0.00 O ATOM 803 CB ARG A 56 35.765 29.690 -21.778 1.00 0.00 C ATOM 804 CG ARG A 56 36.990 30.274 -21.068 1.00 0.00 C ATOM 805 CD ARG A 56 36.563 31.469 -20.215 1.00 0.00 C ATOM 806 NE ARG A 56 35.673 31.030 -19.144 1.00 0.00 N ATOM 807 CZ ARG A 56 36.153 30.581 -17.987 1.00 0.00 C ATOM 808 NH1 ARG A 56 37.442 30.523 -17.793 1.00 0.00 N ATOM 809 NH2 ARG A 56 35.334 30.196 -17.046 1.00 0.00 N ATOM 0 H ARG A 56 35.145 28.110 -24.420 1.00 0.00 H new ATOM 0 HA ARG A 56 36.965 28.818 -23.340 1.00 0.00 H new ATOM 0 HB2 ARG A 56 35.294 30.453 -22.398 1.00 0.00 H new ATOM 0 HB3 ARG A 56 35.024 29.373 -21.044 1.00 0.00 H new ATOM 0 HG2 ARG A 56 37.457 29.514 -20.441 1.00 0.00 H new ATOM 0 HG3 ARG A 56 37.735 30.584 -21.801 1.00 0.00 H new ATOM 0 HD2 ARG A 56 37.442 31.956 -19.791 1.00 0.00 H new ATOM 0 HD3 ARG A 56 36.058 32.208 -20.837 1.00 0.00 H new ATOM 0 HE ARG A 56 34.664 31.068 -19.285 1.00 0.00 H new ATOM 0 HH11 ARG A 56 38.082 30.822 -18.528 1.00 0.00 H new ATOM 0 HH12 ARG A 56 37.809 30.179 -16.906 1.00 0.00 H new ATOM 0 HH21 ARG A 56 34.326 30.239 -17.198 1.00 0.00 H new ATOM 0 HH22 ARG A 56 35.702 29.852 -16.159 1.00 0.00 H new ATOM 823 N ASP A 57 37.541 26.508 -22.347 1.00 0.00 N ATOM 824 CA ASP A 57 38.135 25.406 -21.599 1.00 0.00 C ATOM 825 C ASP A 57 39.343 25.889 -20.802 1.00 0.00 C ATOM 826 O ASP A 57 39.811 27.013 -20.987 1.00 0.00 O ATOM 827 CB ASP A 57 38.565 24.294 -22.556 1.00 0.00 C ATOM 828 CG ASP A 57 37.336 23.588 -23.120 1.00 0.00 C ATOM 829 OD1 ASP A 57 36.254 23.827 -22.609 1.00 0.00 O ATOM 830 OD2 ASP A 57 37.497 22.815 -24.049 1.00 0.00 O ATOM 0 H ASP A 57 37.784 26.530 -23.337 1.00 0.00 H new ATOM 0 HA ASP A 57 37.387 25.019 -20.907 1.00 0.00 H new ATOM 0 HB2 ASP A 57 39.160 24.712 -23.368 1.00 0.00 H new ATOM 0 HB3 ASP A 57 39.198 23.577 -22.033 1.00 0.00 H new ATOM 835 N GLN A 58 39.837 25.036 -19.911 1.00 0.00 N ATOM 836 CA GLN A 58 40.985 25.386 -19.087 1.00 0.00 C ATOM 837 C GLN A 58 42.206 25.649 -19.962 1.00 0.00 C ATOM 838 O GLN A 58 42.497 24.889 -20.886 1.00 0.00 O ATOM 839 CB GLN A 58 41.291 24.256 -18.105 1.00 0.00 C ATOM 840 CG GLN A 58 40.134 24.117 -17.113 1.00 0.00 C ATOM 841 CD GLN A 58 40.416 22.977 -16.140 1.00 0.00 C ATOM 842 OE1 GLN A 58 41.486 22.370 -16.188 1.00 0.00 O ATOM 843 NE2 GLN A 58 39.516 22.650 -15.254 1.00 0.00 N ATOM 0 H GLN A 58 39.462 24.103 -19.742 1.00 0.00 H new ATOM 0 HA GLN A 58 40.747 26.292 -18.529 1.00 0.00 H new ATOM 0 HB2 GLN A 58 41.436 23.320 -18.644 1.00 0.00 H new ATOM 0 HB3 GLN A 58 42.219 24.464 -17.572 1.00 0.00 H new ATOM 0 HG2 GLN A 58 40.000 25.049 -16.565 1.00 0.00 H new ATOM 0 HG3 GLN A 58 39.205 23.927 -17.650 1.00 0.00 H new ATOM 0 HE21 GLN A 58 38.630 23.155 -15.216 1.00 0.00 H new ATOM 0 HE22 GLN A 58 39.698 21.890 -14.599 1.00 0.00 H new ATOM 852 N LYS A 59 42.913 26.733 -19.668 1.00 0.00 N ATOM 853 CA LYS A 59 44.099 27.093 -20.436 1.00 0.00 C ATOM 854 C LYS A 59 45.168 26.021 -20.303 1.00 0.00 C ATOM 855 O LYS A 59 45.806 25.644 -21.287 1.00 0.00 O ATOM 856 CB LYS A 59 44.652 28.429 -19.933 1.00 0.00 C ATOM 857 CG LYS A 59 43.612 29.545 -20.128 1.00 0.00 C ATOM 858 CD LYS A 59 43.611 30.031 -21.581 1.00 0.00 C ATOM 859 CE LYS A 59 42.598 31.163 -21.735 1.00 0.00 C ATOM 860 NZ LYS A 59 42.624 31.649 -23.142 1.00 0.00 N ATOM 0 H LYS A 59 42.688 27.375 -18.908 1.00 0.00 H new ATOM 0 HA LYS A 59 43.819 27.182 -21.486 1.00 0.00 H new ATOM 0 HB2 LYS A 59 44.915 28.348 -18.878 1.00 0.00 H new ATOM 0 HB3 LYS A 59 45.567 28.677 -20.471 1.00 0.00 H new ATOM 0 HG2 LYS A 59 42.621 29.177 -19.861 1.00 0.00 H new ATOM 0 HG3 LYS A 59 43.834 30.377 -19.460 1.00 0.00 H new ATOM 0 HD2 LYS A 59 44.606 30.377 -21.861 1.00 0.00 H new ATOM 0 HD3 LYS A 59 43.359 29.209 -22.251 1.00 0.00 H new ATOM 0 HE2 LYS A 59 41.599 30.812 -21.476 1.00 0.00 H new ATOM 0 HE3 LYS A 59 42.837 31.977 -21.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 41.936 32.421 -23.255 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 43.577 31.998 -23.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 42.377 30.868 -23.784 1.00 0.00 H new ATOM 874 N LEU A 60 45.361 25.524 -19.080 1.00 0.00 N ATOM 875 CA LEU A 60 46.355 24.486 -18.823 1.00 0.00 C ATOM 876 C LEU A 60 45.699 23.271 -18.178 1.00 0.00 C ATOM 877 O LEU A 60 45.023 23.386 -17.155 1.00 0.00 O ATOM 878 CB LEU A 60 47.459 25.028 -17.905 1.00 0.00 C ATOM 879 CG LEU A 60 48.503 23.934 -17.621 1.00 0.00 C ATOM 880 CD1 LEU A 60 49.115 23.424 -18.939 1.00 0.00 C ATOM 881 CD2 LEU A 60 49.606 24.513 -16.728 1.00 0.00 C ATOM 0 H LEU A 60 44.842 25.824 -18.255 1.00 0.00 H new ATOM 0 HA LEU A 60 46.796 24.186 -19.774 1.00 0.00 H new ATOM 0 HB2 LEU A 60 47.941 25.887 -18.372 1.00 0.00 H new ATOM 0 HB3 LEU A 60 47.024 25.377 -16.968 1.00 0.00 H new ATOM 0 HG LEU A 60 48.019 23.098 -17.116 1.00 0.00 H new ATOM 0 HD11 LEU A 60 49.852 22.650 -18.723 1.00 0.00 H new ATOM 0 HD12 LEU A 60 48.328 23.010 -19.569 1.00 0.00 H new ATOM 0 HD13 LEU A 60 49.599 24.251 -19.459 1.00 0.00 H new ATOM 0 HD21 LEU A 60 50.350 23.743 -16.523 1.00 0.00 H new ATOM 0 HD22 LEU A 60 50.083 25.351 -17.236 1.00 0.00 H new ATOM 0 HD23 LEU A 60 49.171 24.857 -15.790 1.00 0.00 H new ATOM 893 N SER A 61 45.911 22.108 -18.781 1.00 0.00 N ATOM 894 CA SER A 61 45.346 20.875 -18.256 1.00 0.00 C ATOM 895 C SER A 61 45.882 19.666 -19.017 1.00 0.00 C ATOM 896 O SER A 61 46.031 18.583 -18.454 1.00 0.00 O ATOM 897 CB SER A 61 43.818 20.915 -18.360 1.00 0.00 C ATOM 898 OG SER A 61 43.264 19.981 -17.443 1.00 0.00 O ATOM 0 H SER A 61 46.467 21.994 -19.629 1.00 0.00 H new ATOM 0 HA SER A 61 45.637 20.783 -17.209 1.00 0.00 H new ATOM 0 HB2 SER A 61 43.453 21.918 -18.141 1.00 0.00 H new ATOM 0 HB3 SER A 61 43.504 20.676 -19.376 1.00 0.00 H new ATOM 0 HG SER A 61 42.622 20.437 -16.860 1.00 0.00 H new ATOM 904 N GLU A 62 46.167 19.860 -20.298 1.00 0.00 N ATOM 905 CA GLU A 62 46.683 18.782 -21.127 1.00 0.00 C ATOM 906 C GLU A 62 47.122 19.312 -22.486 1.00 0.00 C ATOM 907 O GLU A 62 48.057 18.791 -23.094 1.00 0.00 O ATOM 908 CB GLU A 62 45.608 17.710 -21.317 1.00 0.00 C ATOM 909 CG GLU A 62 44.363 18.342 -21.943 1.00 0.00 C ATOM 910 CD GLU A 62 43.269 17.291 -22.099 1.00 0.00 C ATOM 911 OE1 GLU A 62 43.139 16.462 -21.214 1.00 0.00 O ATOM 912 OE2 GLU A 62 42.575 17.332 -23.102 1.00 0.00 O ATOM 0 H GLU A 62 46.050 20.750 -20.783 1.00 0.00 H new ATOM 0 HA GLU A 62 47.547 18.346 -20.626 1.00 0.00 H new ATOM 0 HB2 GLU A 62 45.984 16.912 -21.957 1.00 0.00 H new ATOM 0 HB3 GLU A 62 45.356 17.258 -20.358 1.00 0.00 H new ATOM 0 HG2 GLU A 62 44.006 19.160 -21.317 1.00 0.00 H new ATOM 0 HG3 GLU A 62 44.611 18.768 -22.915 1.00 0.00 H new ATOM 919 N LEU A 63 46.439 20.348 -22.962 1.00 0.00 N ATOM 920 CA LEU A 63 46.771 20.928 -24.253 1.00 0.00 C ATOM 921 C LEU A 63 48.233 21.353 -24.286 1.00 0.00 C ATOM 922 O LEU A 63 48.592 22.417 -23.779 1.00 0.00 O ATOM 923 CB LEU A 63 45.874 22.143 -24.532 1.00 0.00 C ATOM 924 CG LEU A 63 46.244 22.783 -25.882 1.00 0.00 C ATOM 925 CD1 LEU A 63 46.115 21.753 -27.017 1.00 0.00 C ATOM 926 CD2 LEU A 63 45.307 23.969 -26.148 1.00 0.00 C ATOM 0 H LEU A 63 45.662 20.797 -22.478 1.00 0.00 H new ATOM 0 HA LEU A 63 46.605 20.174 -25.022 1.00 0.00 H new ATOM 0 HB2 LEU A 63 44.828 21.836 -24.542 1.00 0.00 H new ATOM 0 HB3 LEU A 63 45.984 22.876 -23.732 1.00 0.00 H new ATOM 0 HG LEU A 63 47.277 23.129 -25.844 1.00 0.00 H new ATOM 0 HD11 LEU A 63 46.380 22.221 -27.965 1.00 0.00 H new ATOM 0 HD12 LEU A 63 46.786 20.915 -26.826 1.00 0.00 H new ATOM 0 HD13 LEU A 63 45.088 21.392 -27.065 1.00 0.00 H new ATOM 0 HD21 LEU A 63 45.563 24.428 -27.103 1.00 0.00 H new ATOM 0 HD22 LEU A 63 44.276 23.618 -26.179 1.00 0.00 H new ATOM 0 HD23 LEU A 63 45.416 24.705 -25.351 1.00 0.00 H new ATOM 938 N ASP A 64 49.071 20.521 -24.891 1.00 0.00 N ATOM 939 CA ASP A 64 50.492 20.823 -24.991 1.00 0.00 C ATOM 940 C ASP A 64 51.134 20.022 -26.120 1.00 0.00 C ATOM 941 O ASP A 64 51.042 20.395 -27.289 1.00 0.00 O ATOM 942 CB ASP A 64 51.184 20.501 -23.669 1.00 0.00 C ATOM 943 CG ASP A 64 52.680 20.779 -23.778 1.00 0.00 C ATOM 944 OD1 ASP A 64 53.117 21.158 -24.853 1.00 0.00 O ATOM 945 OD2 ASP A 64 53.368 20.617 -22.784 1.00 0.00 O ATOM 0 H ASP A 64 48.793 19.637 -25.317 1.00 0.00 H new ATOM 0 HA ASP A 64 50.607 21.885 -25.210 1.00 0.00 H new ATOM 0 HB2 ASP A 64 50.752 21.101 -22.868 1.00 0.00 H new ATOM 0 HB3 ASP A 64 51.019 19.456 -23.408 1.00 0.00 H new ATOM 950 N ASP A 65 51.787 18.922 -25.761 1.00 0.00 N ATOM 951 CA ASP A 65 52.444 18.077 -26.750 1.00 0.00 C ATOM 952 C ASP A 65 51.426 17.492 -27.722 1.00 0.00 C ATOM 953 O ASP A 65 51.648 17.472 -28.933 1.00 0.00 O ATOM 954 CB ASP A 65 53.188 16.940 -26.047 1.00 0.00 C ATOM 955 CG ASP A 65 54.419 17.487 -25.331 1.00 0.00 C ATOM 956 OD1 ASP A 65 54.775 18.625 -25.590 1.00 0.00 O ATOM 957 OD2 ASP A 65 54.989 16.757 -24.537 1.00 0.00 O ATOM 0 H ASP A 65 51.875 18.596 -24.798 1.00 0.00 H new ATOM 0 HA ASP A 65 53.151 18.689 -27.310 1.00 0.00 H new ATOM 0 HB2 ASP A 65 52.528 16.450 -25.331 1.00 0.00 H new ATOM 0 HB3 ASP A 65 53.486 16.185 -26.774 1.00 0.00 H new ATOM 962 N ARG A 66 50.306 17.016 -27.185 1.00 0.00 N ATOM 963 CA ARG A 66 49.256 16.428 -28.016 1.00 0.00 C ATOM 964 C ARG A 66 47.900 16.535 -27.327 1.00 0.00 C ATOM 965 O ARG A 66 47.816 16.556 -26.099 1.00 0.00 O ATOM 966 CB ARG A 66 49.575 14.957 -28.296 1.00 0.00 C ATOM 967 CG ARG A 66 48.529 14.380 -29.251 1.00 0.00 C ATOM 968 CD ARG A 66 48.901 12.940 -29.606 1.00 0.00 C ATOM 969 NE ARG A 66 48.814 12.089 -28.424 1.00 0.00 N ATOM 970 CZ ARG A 66 49.208 10.822 -28.462 1.00 0.00 C ATOM 971 NH1 ARG A 66 49.688 10.319 -29.567 1.00 0.00 N ATOM 972 NH2 ARG A 66 49.116 10.078 -27.393 1.00 0.00 N ATOM 0 H ARG A 66 50.101 17.025 -26.186 1.00 0.00 H new ATOM 0 HA ARG A 66 49.214 16.977 -28.957 1.00 0.00 H new ATOM 0 HB2 ARG A 66 50.570 14.866 -28.732 1.00 0.00 H new ATOM 0 HB3 ARG A 66 49.583 14.392 -27.364 1.00 0.00 H new ATOM 0 HG2 ARG A 66 47.543 14.408 -28.787 1.00 0.00 H new ATOM 0 HG3 ARG A 66 48.473 14.986 -30.155 1.00 0.00 H new ATOM 0 HD2 ARG A 66 48.234 12.565 -30.382 1.00 0.00 H new ATOM 0 HD3 ARG A 66 49.912 12.908 -30.012 1.00 0.00 H new ATOM 0 HE ARG A 66 48.445 12.474 -27.555 1.00 0.00 H new ATOM 0 HH11 ARG A 66 49.761 10.900 -30.402 1.00 0.00 H new ATOM 0 HH12 ARG A 66 49.990 9.345 -29.595 1.00 0.00 H new ATOM 0 HH21 ARG A 66 48.741 10.470 -26.529 1.00 0.00 H new ATOM 0 HH22 ARG A 66 49.419 9.104 -27.422 1.00 0.00 H new ATOM 986 N ALA A 67 46.841 16.600 -28.127 1.00 0.00 N ATOM 987 CA ALA A 67 45.491 16.701 -27.584 1.00 0.00 C ATOM 988 C ALA A 67 44.458 16.370 -28.655 1.00 0.00 C ATOM 989 O ALA A 67 43.322 16.010 -28.346 1.00 0.00 O ATOM 990 CB ALA A 67 45.247 18.114 -27.053 1.00 0.00 C ATOM 0 H ALA A 67 46.890 16.585 -29.146 1.00 0.00 H new ATOM 0 HA ALA A 67 45.392 15.986 -26.768 1.00 0.00 H new ATOM 0 HB1 ALA A 67 44.237 18.182 -26.649 1.00 0.00 H new ATOM 0 HB2 ALA A 67 45.968 18.337 -26.266 1.00 0.00 H new ATOM 0 HB3 ALA A 67 45.362 18.833 -27.864 1.00 0.00 H new ATOM 996 N ASP A 68 44.858 16.496 -29.917 1.00 0.00 N ATOM 997 CA ASP A 68 43.958 16.210 -31.025 1.00 0.00 C ATOM 998 C ASP A 68 43.524 14.748 -30.999 1.00 0.00 C ATOM 999 O ASP A 68 42.349 14.437 -31.198 1.00 0.00 O ATOM 1000 CB ASP A 68 44.650 16.516 -32.353 1.00 0.00 C ATOM 1001 CG ASP A 68 44.779 18.025 -32.542 1.00 0.00 C ATOM 1002 OD1 ASP A 68 44.112 18.752 -31.824 1.00 0.00 O ATOM 1003 OD2 ASP A 68 45.545 18.432 -33.402 1.00 0.00 O ATOM 0 H ASP A 68 45.794 16.792 -30.195 1.00 0.00 H new ATOM 0 HA ASP A 68 43.075 16.841 -30.923 1.00 0.00 H new ATOM 0 HB2 ASP A 68 45.637 16.054 -32.373 1.00 0.00 H new ATOM 0 HB3 ASP A 68 44.080 16.086 -33.177 1.00 0.00 H new ATOM 1008 N ALA A 69 44.476 13.853 -30.749 1.00 0.00 N ATOM 1009 CA ALA A 69 44.179 12.427 -30.697 1.00 0.00 C ATOM 1010 C ALA A 69 43.821 11.908 -32.086 1.00 0.00 C ATOM 1011 O ALA A 69 42.736 12.179 -32.600 1.00 0.00 O ATOM 1012 CB ALA A 69 43.018 12.166 -29.728 1.00 0.00 C ATOM 0 H ALA A 69 45.454 14.089 -30.580 1.00 0.00 H new ATOM 0 HA ALA A 69 45.065 11.900 -30.343 1.00 0.00 H new ATOM 0 HB1 ALA A 69 42.804 11.098 -29.696 1.00 0.00 H new ATOM 0 HB2 ALA A 69 43.292 12.511 -28.731 1.00 0.00 H new ATOM 0 HB3 ALA A 69 42.133 12.704 -30.068 1.00 0.00 H new ATOM 1018 N LEU A 70 44.743 11.162 -32.689 1.00 0.00 N ATOM 1019 CA LEU A 70 44.523 10.608 -34.022 1.00 0.00 C ATOM 1020 C LEU A 70 43.994 9.180 -33.919 1.00 0.00 C ATOM 1021 O LEU A 70 44.245 8.484 -32.935 1.00 0.00 O ATOM 1022 CB LEU A 70 45.840 10.615 -34.813 1.00 0.00 C ATOM 1023 CG LEU A 70 47.020 10.236 -33.884 1.00 0.00 C ATOM 1024 CD1 LEU A 70 48.080 9.454 -34.672 1.00 0.00 C ATOM 1025 CD2 LEU A 70 47.665 11.504 -33.303 1.00 0.00 C ATOM 0 H LEU A 70 45.646 10.928 -32.278 1.00 0.00 H new ATOM 0 HA LEU A 70 43.787 11.222 -34.540 1.00 0.00 H new ATOM 0 HB2 LEU A 70 45.779 9.910 -35.642 1.00 0.00 H new ATOM 0 HB3 LEU A 70 46.009 11.602 -35.245 1.00 0.00 H new ATOM 0 HG LEU A 70 46.635 9.618 -33.073 1.00 0.00 H new ATOM 0 HD11 LEU A 70 48.906 9.192 -34.010 1.00 0.00 H new ATOM 0 HD12 LEU A 70 47.636 8.544 -35.076 1.00 0.00 H new ATOM 0 HD13 LEU A 70 48.453 10.070 -35.491 1.00 0.00 H new ATOM 0 HD21 LEU A 70 48.493 11.225 -32.652 1.00 0.00 H new ATOM 0 HD22 LEU A 70 48.037 12.128 -34.116 1.00 0.00 H new ATOM 0 HD23 LEU A 70 46.923 12.059 -32.729 1.00 0.00 H new ATOM 1037 N GLN A 71 43.263 8.754 -34.942 1.00 0.00 N ATOM 1038 CA GLN A 71 42.703 7.410 -34.959 1.00 0.00 C ATOM 1039 C GLN A 71 41.921 7.138 -33.678 1.00 0.00 C ATOM 1040 O GLN A 71 40.743 7.475 -33.579 1.00 0.00 O ATOM 1041 CB GLN A 71 43.823 6.378 -35.105 1.00 0.00 C ATOM 1042 CG GLN A 71 44.445 6.489 -36.498 1.00 0.00 C ATOM 1043 CD GLN A 71 45.580 5.480 -36.645 1.00 0.00 C ATOM 1044 OE1 GLN A 71 45.803 4.661 -35.753 1.00 0.00 O ATOM 1045 NE2 GLN A 71 46.317 5.492 -37.722 1.00 0.00 N ATOM 0 H GLN A 71 43.046 9.316 -35.765 1.00 0.00 H new ATOM 0 HA GLN A 71 42.025 7.331 -35.808 1.00 0.00 H new ATOM 0 HB2 GLN A 71 44.584 6.542 -34.342 1.00 0.00 H new ATOM 0 HB3 GLN A 71 43.428 5.374 -34.951 1.00 0.00 H new ATOM 0 HG2 GLN A 71 43.686 6.309 -37.259 1.00 0.00 H new ATOM 0 HG3 GLN A 71 44.823 7.499 -36.657 1.00 0.00 H new ATOM 0 HE21 GLN A 71 46.131 6.171 -38.460 1.00 0.00 H new ATOM 0 HE22 GLN A 71 47.079 4.822 -37.826 1.00 0.00 H new ATOM 1054 N ALA A 72 42.588 6.530 -32.701 1.00 0.00 N ATOM 1055 CA ALA A 72 41.944 6.222 -31.430 1.00 0.00 C ATOM 1056 C ALA A 72 40.643 5.456 -31.660 1.00 0.00 C ATOM 1057 O ALA A 72 40.620 4.226 -31.615 1.00 0.00 O ATOM 1058 CB ALA A 72 41.655 7.515 -30.664 1.00 0.00 C ATOM 0 H ALA A 72 43.565 6.244 -32.764 1.00 0.00 H new ATOM 0 HA ALA A 72 42.618 5.598 -30.843 1.00 0.00 H new ATOM 0 HB1 ALA A 72 41.174 7.276 -29.716 1.00 0.00 H new ATOM 0 HB2 ALA A 72 42.590 8.042 -30.474 1.00 0.00 H new ATOM 0 HB3 ALA A 72 40.995 8.149 -31.256 1.00 0.00 H new ATOM 1064 N GLY A 73 39.562 6.191 -31.905 1.00 0.00 N ATOM 1065 CA GLY A 73 38.265 5.570 -32.142 1.00 0.00 C ATOM 1066 C GLY A 73 37.655 5.069 -30.840 1.00 0.00 C ATOM 1067 O GLY A 73 36.800 4.182 -30.843 1.00 0.00 O ATOM 0 H GLY A 73 39.559 7.210 -31.944 1.00 0.00 H new ATOM 0 HA2 GLY A 73 37.593 6.290 -32.610 1.00 0.00 H new ATOM 0 HA3 GLY A 73 38.377 4.739 -32.839 1.00 0.00 H new ATOM 1071 N ALA A 74 38.102 5.640 -29.731 1.00 0.00 N ATOM 1072 CA ALA A 74 37.597 5.245 -28.420 1.00 0.00 C ATOM 1073 C ALA A 74 36.211 5.837 -28.179 1.00 0.00 C ATOM 1074 O ALA A 74 35.516 5.451 -27.240 1.00 0.00 O ATOM 1075 CB ALA A 74 38.553 5.717 -27.324 1.00 0.00 C ATOM 0 H ALA A 74 38.809 6.375 -29.710 1.00 0.00 H new ATOM 0 HA ALA A 74 37.526 4.158 -28.393 1.00 0.00 H new ATOM 0 HB1 ALA A 74 38.166 5.417 -26.350 1.00 0.00 H new ATOM 0 HB2 ALA A 74 39.534 5.268 -27.479 1.00 0.00 H new ATOM 0 HB3 ALA A 74 38.641 6.803 -27.361 1.00 0.00 H new ATOM 1081 N SER A 75 35.817 6.778 -29.032 1.00 0.00 N ATOM 1082 CA SER A 75 34.514 7.418 -28.902 1.00 0.00 C ATOM 1083 C SER A 75 34.347 8.020 -27.511 1.00 0.00 C ATOM 1084 O SER A 75 33.680 7.445 -26.652 1.00 0.00 O ATOM 1085 CB SER A 75 33.401 6.398 -29.155 1.00 0.00 C ATOM 1086 OG SER A 75 32.185 6.882 -28.600 1.00 0.00 O ATOM 0 H SER A 75 36.378 7.112 -29.816 1.00 0.00 H new ATOM 0 HA SER A 75 34.450 8.217 -29.641 1.00 0.00 H new ATOM 0 HB2 SER A 75 33.284 6.229 -30.225 1.00 0.00 H new ATOM 0 HB3 SER A 75 33.662 5.439 -28.707 1.00 0.00 H new ATOM 0 HG SER A 75 32.260 6.912 -27.623 1.00 0.00 H new ATOM 1092 N GLN A 76 34.958 9.181 -27.297 1.00 0.00 N ATOM 1093 CA GLN A 76 34.868 9.853 -26.005 1.00 0.00 C ATOM 1094 C GLN A 76 33.546 10.602 -25.881 1.00 0.00 C ATOM 1095 O GLN A 76 33.139 10.986 -24.785 1.00 0.00 O ATOM 1096 CB GLN A 76 36.034 10.834 -25.847 1.00 0.00 C ATOM 1097 CG GLN A 76 35.969 11.892 -26.952 1.00 0.00 C ATOM 1098 CD GLN A 76 37.179 12.817 -26.858 1.00 0.00 C ATOM 1099 OE1 GLN A 76 37.717 13.029 -25.772 1.00 0.00 O ATOM 1100 NE2 GLN A 76 37.636 13.387 -27.939 1.00 0.00 N ATOM 0 H GLN A 76 35.516 9.673 -27.995 1.00 0.00 H new ATOM 0 HA GLN A 76 34.918 9.100 -25.218 1.00 0.00 H new ATOM 0 HB2 GLN A 76 35.990 11.312 -24.869 1.00 0.00 H new ATOM 0 HB3 GLN A 76 36.982 10.299 -25.898 1.00 0.00 H new ATOM 0 HG2 GLN A 76 35.945 11.409 -27.929 1.00 0.00 H new ATOM 0 HG3 GLN A 76 35.050 12.471 -26.860 1.00 0.00 H new ATOM 0 HE21 GLN A 76 37.188 13.209 -28.838 1.00 0.00 H new ATOM 0 HE22 GLN A 76 38.442 14.010 -27.885 1.00 0.00 H new ATOM 1109 N PHE A 77 32.880 10.807 -27.013 1.00 0.00 N ATOM 1110 CA PHE A 77 31.604 11.513 -27.018 1.00 0.00 C ATOM 1111 C PHE A 77 30.567 10.758 -26.193 1.00 0.00 C ATOM 1112 O PHE A 77 29.840 11.353 -25.398 1.00 0.00 O ATOM 1113 CB PHE A 77 31.099 11.670 -28.453 1.00 0.00 C ATOM 1114 CG PHE A 77 31.997 12.623 -29.205 1.00 0.00 C ATOM 1115 CD1 PHE A 77 31.832 14.005 -29.052 1.00 0.00 C ATOM 1116 CD2 PHE A 77 32.993 12.125 -30.053 1.00 0.00 C ATOM 1117 CE1 PHE A 77 32.665 14.890 -29.748 1.00 0.00 C ATOM 1118 CE2 PHE A 77 33.826 13.011 -30.749 1.00 0.00 C ATOM 1119 CZ PHE A 77 33.661 14.392 -30.596 1.00 0.00 C ATOM 0 H PHE A 77 33.199 10.497 -27.931 1.00 0.00 H new ATOM 0 HA PHE A 77 31.756 12.498 -26.576 1.00 0.00 H new ATOM 0 HB2 PHE A 77 31.082 10.701 -28.951 1.00 0.00 H new ATOM 0 HB3 PHE A 77 30.075 12.045 -28.450 1.00 0.00 H new ATOM 0 HD1 PHE A 77 31.063 14.388 -28.398 1.00 0.00 H new ATOM 0 HD2 PHE A 77 33.119 11.059 -30.171 1.00 0.00 H new ATOM 0 HE1 PHE A 77 32.539 15.956 -29.630 1.00 0.00 H new ATOM 0 HE2 PHE A 77 34.595 12.628 -31.403 1.00 0.00 H new ATOM 0 HZ PHE A 77 34.303 15.075 -31.133 1.00 0.00 H new ATOM 1129 N GLU A 78 30.506 9.446 -26.389 1.00 0.00 N ATOM 1130 CA GLU A 78 29.554 8.619 -25.658 1.00 0.00 C ATOM 1131 C GLU A 78 29.890 8.605 -24.170 1.00 0.00 C ATOM 1132 O GLU A 78 28.998 8.625 -23.321 1.00 0.00 O ATOM 1133 CB GLU A 78 29.578 7.190 -26.202 1.00 0.00 C ATOM 1134 CG GLU A 78 29.017 7.177 -27.626 1.00 0.00 C ATOM 1135 CD GLU A 78 29.116 5.773 -28.212 1.00 0.00 C ATOM 1136 OE1 GLU A 78 29.585 4.892 -27.513 1.00 0.00 O ATOM 1137 OE2 GLU A 78 28.722 5.599 -29.354 1.00 0.00 O ATOM 0 H GLU A 78 31.100 8.935 -27.043 1.00 0.00 H new ATOM 0 HA GLU A 78 28.558 9.041 -25.790 1.00 0.00 H new ATOM 0 HB2 GLU A 78 30.598 6.805 -26.198 1.00 0.00 H new ATOM 0 HB3 GLU A 78 28.987 6.535 -25.561 1.00 0.00 H new ATOM 0 HG2 GLU A 78 27.977 7.505 -27.619 1.00 0.00 H new ATOM 0 HG3 GLU A 78 29.569 7.880 -28.250 1.00 0.00 H new ATOM 1144 N THR A 79 31.184 8.569 -23.860 1.00 0.00 N ATOM 1145 CA THR A 79 31.624 8.549 -22.470 1.00 0.00 C ATOM 1146 C THR A 79 31.231 9.843 -21.764 1.00 0.00 C ATOM 1147 O THR A 79 30.787 9.825 -20.617 1.00 0.00 O ATOM 1148 CB THR A 79 33.144 8.375 -22.406 1.00 0.00 C ATOM 1149 OG1 THR A 79 33.769 9.447 -23.098 1.00 0.00 O ATOM 1150 CG2 THR A 79 33.534 7.049 -23.056 1.00 0.00 C ATOM 0 H THR A 79 31.939 8.553 -24.546 1.00 0.00 H new ATOM 0 HA THR A 79 31.139 7.712 -21.968 1.00 0.00 H new ATOM 0 HB THR A 79 33.468 8.375 -21.365 1.00 0.00 H new ATOM 0 HG1 THR A 79 33.119 9.876 -23.693 1.00 0.00 H new ATOM 0 HG21 THR A 79 34.616 6.926 -23.010 1.00 0.00 H new ATOM 0 HG22 THR A 79 33.052 6.228 -22.525 1.00 0.00 H new ATOM 0 HG23 THR A 79 33.212 7.046 -24.097 1.00 0.00 H new ATOM 1158 N SER A 80 31.399 10.965 -22.456 1.00 0.00 N ATOM 1159 CA SER A 80 31.057 12.262 -21.884 1.00 0.00 C ATOM 1160 C SER A 80 29.568 12.332 -21.567 1.00 0.00 C ATOM 1161 O SER A 80 29.166 12.875 -20.538 1.00 0.00 O ATOM 1162 CB SER A 80 31.429 13.377 -22.861 1.00 0.00 C ATOM 1163 OG SER A 80 30.727 13.185 -24.081 1.00 0.00 O ATOM 0 H SER A 80 31.767 11.003 -23.407 1.00 0.00 H new ATOM 0 HA SER A 80 31.618 12.390 -20.958 1.00 0.00 H new ATOM 0 HB2 SER A 80 31.180 14.349 -22.434 1.00 0.00 H new ATOM 0 HB3 SER A 80 32.504 13.374 -23.042 1.00 0.00 H new ATOM 0 HG SER A 80 30.502 12.237 -24.183 1.00 0.00 H new ATOM 1169 N ALA A 81 28.751 11.781 -22.459 1.00 0.00 N ATOM 1170 CA ALA A 81 27.307 11.788 -22.264 1.00 0.00 C ATOM 1171 C ALA A 81 26.896 10.735 -21.240 1.00 0.00 C ATOM 1172 O ALA A 81 25.810 10.807 -20.665 1.00 0.00 O ATOM 1173 CB ALA A 81 26.600 11.512 -23.593 1.00 0.00 C ATOM 0 H ALA A 81 29.062 11.327 -23.318 1.00 0.00 H new ATOM 0 HA ALA A 81 27.016 12.771 -21.893 1.00 0.00 H new ATOM 0 HB1 ALA A 81 25.521 11.519 -23.439 1.00 0.00 H new ATOM 0 HB2 ALA A 81 26.869 12.283 -24.315 1.00 0.00 H new ATOM 0 HB3 ALA A 81 26.906 10.537 -23.973 1.00 0.00 H new ATOM 1179 N ALA A 82 27.768 9.757 -21.018 1.00 0.00 N ATOM 1180 CA ALA A 82 27.480 8.694 -20.062 1.00 0.00 C ATOM 1181 C ALA A 82 27.355 9.259 -18.651 1.00 0.00 C ATOM 1182 O ALA A 82 26.482 8.854 -17.885 1.00 0.00 O ATOM 1183 CB ALA A 82 28.591 7.643 -20.098 1.00 0.00 C ATOM 0 H ALA A 82 28.673 9.678 -21.483 1.00 0.00 H new ATOM 0 HA ALA A 82 26.533 8.230 -20.339 1.00 0.00 H new ATOM 0 HB1 ALA A 82 28.368 6.853 -19.381 1.00 0.00 H new ATOM 0 HB2 ALA A 82 28.656 7.217 -21.099 1.00 0.00 H new ATOM 0 HB3 ALA A 82 29.542 8.109 -19.840 1.00 0.00 H new ATOM 1189 N LYS A 83 28.235 10.195 -18.314 1.00 0.00 N ATOM 1190 CA LYS A 83 28.215 10.808 -16.994 1.00 0.00 C ATOM 1191 C LYS A 83 26.919 11.582 -16.778 1.00 0.00 C ATOM 1192 O LYS A 83 26.296 11.487 -15.722 1.00 0.00 O ATOM 1193 CB LYS A 83 29.410 11.753 -16.839 1.00 0.00 C ATOM 1194 CG LYS A 83 29.451 12.297 -15.408 1.00 0.00 C ATOM 1195 CD LYS A 83 30.675 13.199 -15.239 1.00 0.00 C ATOM 1196 CE LYS A 83 30.724 13.728 -13.804 1.00 0.00 C ATOM 1197 NZ LYS A 83 31.917 14.606 -13.640 1.00 0.00 N ATOM 0 H LYS A 83 28.967 10.543 -18.933 1.00 0.00 H new ATOM 0 HA LYS A 83 28.278 10.017 -16.247 1.00 0.00 H new ATOM 0 HB2 LYS A 83 30.336 11.225 -17.065 1.00 0.00 H new ATOM 0 HB3 LYS A 83 29.331 12.576 -17.550 1.00 0.00 H new ATOM 0 HG2 LYS A 83 28.541 12.858 -15.195 1.00 0.00 H new ATOM 0 HG3 LYS A 83 29.492 11.473 -14.696 1.00 0.00 H new ATOM 0 HD2 LYS A 83 31.584 12.642 -15.464 1.00 0.00 H new ATOM 0 HD3 LYS A 83 30.628 14.030 -15.943 1.00 0.00 H new ATOM 0 HE2 LYS A 83 29.815 14.286 -13.579 1.00 0.00 H new ATOM 0 HE3 LYS A 83 30.771 12.897 -13.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 31.952 14.966 -12.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 32.780 14.060 -13.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 31.853 15.405 -14.302 1.00 0.00 H new ATOM 1211 N LEU A 84 26.526 12.352 -17.786 1.00 0.00 N ATOM 1212 CA LEU A 84 25.306 13.148 -17.702 1.00 0.00 C ATOM 1213 C LEU A 84 24.093 12.246 -17.559 1.00 0.00 C ATOM 1214 O LEU A 84 23.192 12.522 -16.768 1.00 0.00 O ATOM 1215 CB LEU A 84 25.158 14.010 -18.958 1.00 0.00 C ATOM 1216 CG LEU A 84 26.446 14.804 -19.196 1.00 0.00 C ATOM 1217 CD1 LEU A 84 26.308 15.618 -20.486 1.00 0.00 C ATOM 1218 CD2 LEU A 84 26.703 15.751 -18.013 1.00 0.00 C ATOM 0 H LEU A 84 27.031 12.442 -18.667 1.00 0.00 H new ATOM 0 HA LEU A 84 25.372 13.792 -16.825 1.00 0.00 H new ATOM 0 HB2 LEU A 84 24.944 13.379 -19.821 1.00 0.00 H new ATOM 0 HB3 LEU A 84 24.315 14.692 -18.845 1.00 0.00 H new ATOM 0 HG LEU A 84 27.284 14.113 -19.287 1.00 0.00 H new ATOM 0 HD11 LEU A 84 27.223 16.184 -20.658 1.00 0.00 H new ATOM 0 HD12 LEU A 84 26.135 14.944 -21.325 1.00 0.00 H new ATOM 0 HD13 LEU A 84 25.467 16.306 -20.394 1.00 0.00 H new ATOM 0 HD21 LEU A 84 27.621 16.312 -18.189 1.00 0.00 H new ATOM 0 HD22 LEU A 84 25.867 16.444 -17.913 1.00 0.00 H new ATOM 0 HD23 LEU A 84 26.804 15.169 -17.097 1.00 0.00 H new ATOM 1230 N LYS A 85 24.079 11.162 -18.320 1.00 0.00 N ATOM 1231 CA LYS A 85 22.970 10.223 -18.263 1.00 0.00 C ATOM 1232 C LYS A 85 22.831 9.643 -16.862 1.00 0.00 C ATOM 1233 O LYS A 85 21.722 9.512 -16.343 1.00 0.00 O ATOM 1234 CB LYS A 85 23.192 9.094 -19.278 1.00 0.00 C ATOM 1235 CG LYS A 85 22.077 8.025 -19.154 1.00 0.00 C ATOM 1236 CD LYS A 85 22.600 6.798 -18.393 1.00 0.00 C ATOM 1237 CE LYS A 85 21.494 5.751 -18.288 1.00 0.00 C ATOM 1238 NZ LYS A 85 22.036 4.525 -17.641 1.00 0.00 N ATOM 0 H LYS A 85 24.817 10.912 -18.979 1.00 0.00 H new ATOM 0 HA LYS A 85 22.051 10.754 -18.510 1.00 0.00 H new ATOM 0 HB2 LYS A 85 23.202 9.502 -20.289 1.00 0.00 H new ATOM 0 HB3 LYS A 85 24.166 8.633 -19.111 1.00 0.00 H new ATOM 0 HG2 LYS A 85 21.217 8.445 -18.633 1.00 0.00 H new ATOM 0 HG3 LYS A 85 21.736 7.728 -20.146 1.00 0.00 H new ATOM 0 HD2 LYS A 85 23.464 6.379 -18.909 1.00 0.00 H new ATOM 0 HD3 LYS A 85 22.934 7.090 -17.397 1.00 0.00 H new ATOM 0 HE2 LYS A 85 20.660 6.144 -17.707 1.00 0.00 H new ATOM 0 HE3 LYS A 85 21.108 5.513 -19.279 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 21.563 3.687 -18.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 23.059 4.461 -17.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 21.866 4.569 -16.616 1.00 0.00 H new ATOM 1252 N ARG A 86 23.960 9.300 -16.254 1.00 0.00 N ATOM 1253 CA ARG A 86 23.948 8.736 -14.909 1.00 0.00 C ATOM 1254 C ARG A 86 23.771 9.831 -13.867 1.00 0.00 C ATOM 1255 O ARG A 86 23.237 9.595 -12.784 1.00 0.00 O ATOM 1256 CB ARG A 86 25.257 7.996 -14.657 1.00 0.00 C ATOM 1257 CG ARG A 86 25.209 7.313 -13.284 1.00 0.00 C ATOM 1258 CD ARG A 86 26.517 6.565 -13.031 1.00 0.00 C ATOM 1259 NE ARG A 86 26.422 5.790 -11.796 1.00 0.00 N ATOM 1260 CZ ARG A 86 26.681 6.341 -10.612 1.00 0.00 C ATOM 1261 NH1 ARG A 86 27.027 7.597 -10.541 1.00 0.00 N ATOM 1262 NH2 ARG A 86 26.588 5.627 -9.524 1.00 0.00 N ATOM 0 H ARG A 86 24.888 9.401 -16.666 1.00 0.00 H new ATOM 0 HA ARG A 86 23.110 8.043 -14.828 1.00 0.00 H new ATOM 0 HB2 ARG A 86 25.422 7.253 -15.438 1.00 0.00 H new ATOM 0 HB3 ARG A 86 26.094 8.693 -14.698 1.00 0.00 H new ATOM 0 HG2 ARG A 86 25.048 8.057 -12.503 1.00 0.00 H new ATOM 0 HG3 ARG A 86 24.369 6.620 -13.242 1.00 0.00 H new ATOM 0 HD2 ARG A 86 26.734 5.903 -13.869 1.00 0.00 H new ATOM 0 HD3 ARG A 86 27.343 7.273 -12.962 1.00 0.00 H new ATOM 0 HE ARG A 86 26.152 4.807 -11.842 1.00 0.00 H new ATOM 0 HH11 ARG A 86 27.099 8.155 -11.392 1.00 0.00 H new ATOM 0 HH12 ARG A 86 27.226 8.021 -9.635 1.00 0.00 H new ATOM 0 HH21 ARG A 86 26.317 4.645 -9.580 1.00 0.00 H new ATOM 0 HH22 ARG A 86 26.787 6.050 -8.618 1.00 0.00 H new ATOM 1276 N LYS A 87 24.229 11.026 -14.204 1.00 0.00 N ATOM 1277 CA LYS A 87 24.126 12.160 -13.290 1.00 0.00 C ATOM 1278 C LYS A 87 22.673 12.394 -12.896 1.00 0.00 C ATOM 1279 O LYS A 87 22.368 12.622 -11.726 1.00 0.00 O ATOM 1280 CB LYS A 87 24.685 13.424 -13.949 1.00 0.00 C ATOM 1281 CG LYS A 87 24.679 14.575 -12.940 1.00 0.00 C ATOM 1282 CD LYS A 87 25.323 15.813 -13.569 1.00 0.00 C ATOM 1283 CE LYS A 87 25.346 16.954 -12.550 1.00 0.00 C ATOM 1284 NZ LYS A 87 23.949 17.400 -12.274 1.00 0.00 N ATOM 0 H LYS A 87 24.674 11.239 -15.097 1.00 0.00 H new ATOM 0 HA LYS A 87 24.707 11.933 -12.396 1.00 0.00 H new ATOM 0 HB2 LYS A 87 25.700 13.243 -14.303 1.00 0.00 H new ATOM 0 HB3 LYS A 87 24.085 13.688 -14.820 1.00 0.00 H new ATOM 0 HG2 LYS A 87 23.657 14.800 -12.635 1.00 0.00 H new ATOM 0 HG3 LYS A 87 25.223 14.287 -12.041 1.00 0.00 H new ATOM 0 HD2 LYS A 87 26.337 15.582 -13.894 1.00 0.00 H new ATOM 0 HD3 LYS A 87 24.765 16.115 -14.455 1.00 0.00 H new ATOM 0 HE2 LYS A 87 25.823 16.623 -11.627 1.00 0.00 H new ATOM 0 HE3 LYS A 87 25.936 17.786 -12.933 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 23.966 18.337 -11.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 23.420 17.456 -13.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 23.486 16.718 -11.639 1.00 0.00 H new ATOM 1298 N TYR A 88 21.780 12.335 -13.877 1.00 0.00 N ATOM 1299 CA TYR A 88 20.361 12.540 -13.613 1.00 0.00 C ATOM 1300 C TYR A 88 19.766 11.323 -12.910 1.00 0.00 C ATOM 1301 O TYR A 88 20.091 11.040 -11.757 1.00 0.00 O ATOM 1302 CB TYR A 88 19.613 12.795 -14.925 1.00 0.00 C ATOM 1303 CG TYR A 88 20.154 14.044 -15.582 1.00 0.00 C ATOM 1304 CD1 TYR A 88 19.979 15.288 -14.966 1.00 0.00 C ATOM 1305 CD2 TYR A 88 20.836 13.959 -16.804 1.00 0.00 C ATOM 1306 CE1 TYR A 88 20.483 16.446 -15.569 1.00 0.00 C ATOM 1307 CE2 TYR A 88 21.339 15.117 -17.406 1.00 0.00 C ATOM 1308 CZ TYR A 88 21.162 16.361 -16.790 1.00 0.00 C ATOM 1309 OH TYR A 88 21.659 17.503 -17.384 1.00 0.00 O ATOM 0 H TYR A 88 22.010 12.149 -14.853 1.00 0.00 H new ATOM 0 HA TYR A 88 20.254 13.409 -12.963 1.00 0.00 H new ATOM 0 HB2 TYR A 88 19.728 11.941 -15.593 1.00 0.00 H new ATOM 0 HB3 TYR A 88 18.546 12.907 -14.731 1.00 0.00 H new ATOM 0 HD1 TYR A 88 19.454 15.355 -14.024 1.00 0.00 H new ATOM 0 HD2 TYR A 88 20.973 12.999 -17.280 1.00 0.00 H new ATOM 0 HE1 TYR A 88 20.348 17.406 -15.092 1.00 0.00 H new ATOM 0 HE2 TYR A 88 21.865 15.051 -18.347 1.00 0.00 H new ATOM 0 HH TYR A 88 22.103 17.267 -18.225 1.00 0.00 H new ATOM 1319 N TRP A 89 18.894 10.605 -13.612 1.00 0.00 N ATOM 1320 CA TRP A 89 18.258 9.421 -13.046 1.00 0.00 C ATOM 1321 C TRP A 89 17.435 8.701 -14.108 1.00 0.00 C ATOM 1322 O TRP A 89 16.363 8.167 -13.820 1.00 0.00 O ATOM 1323 CB TRP A 89 17.349 9.827 -11.884 1.00 0.00 C ATOM 1324 CG TRP A 89 16.247 10.702 -12.392 1.00 0.00 C ATOM 1325 CD1 TRP A 89 16.378 12.012 -12.705 1.00 0.00 C ATOM 1326 CD2 TRP A 89 14.852 10.361 -12.640 1.00 0.00 C ATOM 1327 NE1 TRP A 89 15.156 12.495 -13.135 1.00 0.00 N ATOM 1328 CE2 TRP A 89 14.182 11.515 -13.112 1.00 0.00 C ATOM 1329 CE3 TRP A 89 14.111 9.173 -12.505 1.00 0.00 C ATOM 1330 CZ2 TRP A 89 12.826 11.492 -13.437 1.00 0.00 C ATOM 1331 CZ3 TRP A 89 12.744 9.147 -12.831 1.00 0.00 C ATOM 1332 CH2 TRP A 89 12.104 10.304 -13.298 1.00 0.00 C ATOM 0 H TRP A 89 18.613 10.821 -14.568 1.00 0.00 H new ATOM 0 HA TRP A 89 19.035 8.748 -12.684 1.00 0.00 H new ATOM 0 HB2 TRP A 89 16.932 8.940 -11.408 1.00 0.00 H new ATOM 0 HB3 TRP A 89 17.926 10.355 -11.125 1.00 0.00 H new ATOM 0 HD1 TRP A 89 17.289 12.587 -12.631 1.00 0.00 H new ATOM 0 HE1 TRP A 89 14.993 13.457 -13.433 1.00 0.00 H new ATOM 0 HE3 TRP A 89 14.595 8.276 -12.149 1.00 0.00 H new ATOM 0 HZ2 TRP A 89 12.337 12.387 -13.794 1.00 0.00 H new ATOM 0 HZ3 TRP A 89 12.183 8.231 -12.721 1.00 0.00 H new ATOM 0 HH2 TRP A 89 11.054 10.277 -13.550 1.00 0.00 H new ATOM 1343 N TRP A 90 17.940 8.692 -15.338 1.00 0.00 N ATOM 1344 CA TRP A 90 17.234 8.037 -16.432 1.00 0.00 C ATOM 1345 C TRP A 90 17.076 6.547 -16.145 1.00 0.00 C ATOM 1346 O TRP A 90 16.007 5.974 -16.357 1.00 0.00 O ATOM 1347 CB TRP A 90 17.997 8.249 -17.752 1.00 0.00 C ATOM 1348 CG TRP A 90 17.060 8.120 -18.917 1.00 0.00 C ATOM 1349 CD1 TRP A 90 15.924 8.837 -19.085 1.00 0.00 C ATOM 1350 CD2 TRP A 90 17.164 7.245 -20.077 1.00 0.00 C ATOM 1351 NE1 TRP A 90 15.319 8.448 -20.265 1.00 0.00 N ATOM 1352 CE2 TRP A 90 16.046 7.472 -20.914 1.00 0.00 C ATOM 1353 CE3 TRP A 90 18.107 6.284 -20.481 1.00 0.00 C ATOM 1354 CZ2 TRP A 90 15.870 6.772 -22.108 1.00 0.00 C ATOM 1355 CZ3 TRP A 90 17.934 5.578 -21.684 1.00 0.00 C ATOM 1356 CH2 TRP A 90 16.818 5.821 -22.494 1.00 0.00 C ATOM 0 H TRP A 90 18.825 9.126 -15.600 1.00 0.00 H new ATOM 0 HA TRP A 90 16.241 8.478 -16.524 1.00 0.00 H new ATOM 0 HB2 TRP A 90 18.463 9.235 -17.757 1.00 0.00 H new ATOM 0 HB3 TRP A 90 18.800 7.517 -17.838 1.00 0.00 H new ATOM 0 HD1 TRP A 90 15.551 9.591 -18.407 1.00 0.00 H new ATOM 0 HE1 TRP A 90 14.442 8.835 -20.613 1.00 0.00 H new ATOM 0 HE3 TRP A 90 18.970 6.087 -19.863 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 15.008 6.964 -22.729 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 18.666 4.844 -21.985 1.00 0.00 H new ATOM 0 HH2 TRP A 90 16.690 5.274 -23.416 1.00 0.00 H new ATOM 1367 N LYS A 91 18.148 5.926 -15.655 1.00 0.00 N ATOM 1368 CA LYS A 91 18.129 4.498 -15.327 1.00 0.00 C ATOM 1369 C LYS A 91 18.648 4.270 -13.912 1.00 0.00 C ATOM 1370 O LYS A 91 19.550 4.969 -13.448 1.00 0.00 O ATOM 1371 CB LYS A 91 18.986 3.716 -16.329 1.00 0.00 C ATOM 1372 CG LYS A 91 18.212 3.523 -17.635 1.00 0.00 C ATOM 1373 CD LYS A 91 19.086 2.766 -18.637 1.00 0.00 C ATOM 1374 CE LYS A 91 18.265 2.446 -19.886 1.00 0.00 C ATOM 1375 NZ LYS A 91 19.113 1.703 -20.860 1.00 0.00 N ATOM 0 H LYS A 91 19.040 6.387 -15.476 1.00 0.00 H new ATOM 0 HA LYS A 91 17.100 4.143 -15.384 1.00 0.00 H new ATOM 0 HB2 LYS A 91 19.915 4.252 -16.522 1.00 0.00 H new ATOM 0 HB3 LYS A 91 19.258 2.747 -15.910 1.00 0.00 H new ATOM 0 HG2 LYS A 91 17.292 2.969 -17.447 1.00 0.00 H new ATOM 0 HG3 LYS A 91 17.923 4.490 -18.046 1.00 0.00 H new ATOM 0 HD2 LYS A 91 19.956 3.366 -18.904 1.00 0.00 H new ATOM 0 HD3 LYS A 91 19.459 1.846 -18.188 1.00 0.00 H new ATOM 0 HE2 LYS A 91 17.393 1.850 -19.618 1.00 0.00 H new ATOM 0 HE3 LYS A 91 17.896 3.367 -20.337 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 18.555 1.485 -21.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 19.932 2.287 -21.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 19.445 0.818 -20.427 1.00 0.00 H new ATOM 1389 N ASN A 92 18.071 3.284 -13.235 1.00 0.00 N ATOM 1390 CA ASN A 92 18.472 2.956 -11.871 1.00 0.00 C ATOM 1391 C ASN A 92 19.583 1.914 -11.887 1.00 0.00 C ATOM 1392 O ASN A 92 19.630 1.053 -12.764 1.00 0.00 O ATOM 1393 CB ASN A 92 17.271 2.416 -11.092 1.00 0.00 C ATOM 1394 CG ASN A 92 16.266 3.535 -10.828 1.00 0.00 C ATOM 1395 OD1 ASN A 92 15.060 3.298 -10.823 1.00 0.00 O ATOM 1396 ND2 ASN A 92 16.696 4.748 -10.600 1.00 0.00 N ATOM 0 H ASN A 92 17.324 2.698 -13.608 1.00 0.00 H new ATOM 0 HA ASN A 92 18.840 3.860 -11.386 1.00 0.00 H new ATOM 0 HB2 ASN A 92 16.794 1.614 -11.656 1.00 0.00 H new ATOM 0 HB3 ASN A 92 17.605 1.987 -10.147 1.00 0.00 H new ATOM 0 HD21 ASN A 92 16.030 5.499 -10.418 1.00 0.00 H new ATOM 0 HD22 ASN A 92 17.697 4.943 -10.604 1.00 0.00 H new ATOM 1403 N LEU A 93 20.480 2.006 -10.912 1.00 0.00 N ATOM 1404 CA LEU A 93 21.598 1.075 -10.817 1.00 0.00 C ATOM 1405 C LEU A 93 21.152 -0.210 -10.124 1.00 0.00 C ATOM 1406 O LEU A 93 21.942 -1.138 -9.944 1.00 0.00 O ATOM 1407 CB LEU A 93 22.750 1.722 -10.022 1.00 0.00 C ATOM 1408 CG LEU A 93 22.179 2.653 -8.923 1.00 0.00 C ATOM 1409 CD1 LEU A 93 23.112 2.660 -7.705 1.00 0.00 C ATOM 1410 CD2 LEU A 93 22.045 4.086 -9.458 1.00 0.00 C ATOM 0 H LEU A 93 20.455 2.714 -10.178 1.00 0.00 H new ATOM 0 HA LEU A 93 21.945 0.835 -11.822 1.00 0.00 H new ATOM 0 HB2 LEU A 93 23.369 0.948 -9.569 1.00 0.00 H new ATOM 0 HB3 LEU A 93 23.392 2.291 -10.694 1.00 0.00 H new ATOM 0 HG LEU A 93 21.197 2.281 -8.632 1.00 0.00 H new ATOM 0 HD11 LEU A 93 22.703 3.317 -6.937 1.00 0.00 H new ATOM 0 HD12 LEU A 93 23.200 1.649 -7.308 1.00 0.00 H new ATOM 0 HD13 LEU A 93 24.097 3.019 -8.003 1.00 0.00 H new ATOM 0 HD21 LEU A 93 21.643 4.730 -8.676 1.00 0.00 H new ATOM 0 HD22 LEU A 93 23.025 4.454 -9.763 1.00 0.00 H new ATOM 0 HD23 LEU A 93 21.372 4.093 -10.316 1.00 0.00 H new ATOM 1422 N LYS A 94 19.885 -0.257 -9.736 1.00 0.00 N ATOM 1423 CA LYS A 94 19.350 -1.432 -9.060 1.00 0.00 C ATOM 1424 C LYS A 94 19.469 -2.659 -9.954 1.00 0.00 C ATOM 1425 O LYS A 94 19.739 -3.759 -9.476 1.00 0.00 O ATOM 1426 CB LYS A 94 17.884 -1.204 -8.689 1.00 0.00 C ATOM 1427 CG LYS A 94 17.375 -2.392 -7.870 1.00 0.00 C ATOM 1428 CD LYS A 94 15.928 -2.136 -7.448 1.00 0.00 C ATOM 1429 CE LYS A 94 15.422 -3.317 -6.615 1.00 0.00 C ATOM 1430 NZ LYS A 94 14.018 -3.056 -6.187 1.00 0.00 N ATOM 0 H LYS A 94 19.213 0.498 -9.876 1.00 0.00 H new ATOM 0 HA LYS A 94 19.927 -1.600 -8.151 1.00 0.00 H new ATOM 0 HB2 LYS A 94 17.782 -0.283 -8.116 1.00 0.00 H new ATOM 0 HB3 LYS A 94 17.283 -1.086 -9.591 1.00 0.00 H new ATOM 0 HG2 LYS A 94 17.437 -3.307 -8.459 1.00 0.00 H new ATOM 0 HG3 LYS A 94 18.002 -2.536 -6.990 1.00 0.00 H new ATOM 0 HD2 LYS A 94 15.865 -1.215 -6.869 1.00 0.00 H new ATOM 0 HD3 LYS A 94 15.299 -2.003 -8.328 1.00 0.00 H new ATOM 0 HE2 LYS A 94 15.471 -4.236 -7.199 1.00 0.00 H new ATOM 0 HE3 LYS A 94 16.059 -3.460 -5.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 13.673 -3.857 -5.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 13.985 -2.188 -5.615 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 13.415 -2.940 -7.026 1.00 0.00 H new ATOM 1444 N MET A 95 19.271 -2.459 -11.251 1.00 0.00 N ATOM 1445 CA MET A 95 19.361 -3.557 -12.206 1.00 0.00 C ATOM 1446 C MET A 95 20.778 -4.127 -12.231 1.00 0.00 C ATOM 1447 O MET A 95 20.973 -5.337 -12.339 1.00 0.00 O ATOM 1448 CB MET A 95 18.978 -3.066 -13.605 1.00 0.00 C ATOM 1449 CG MET A 95 17.460 -2.890 -13.689 1.00 0.00 C ATOM 1450 SD MET A 95 17.001 -2.377 -15.364 1.00 0.00 S ATOM 1451 CE MET A 95 17.723 -0.718 -15.314 1.00 0.00 C ATOM 0 H MET A 95 19.049 -1.553 -11.664 1.00 0.00 H new ATOM 0 HA MET A 95 18.671 -4.342 -11.898 1.00 0.00 H new ATOM 0 HB2 MET A 95 19.476 -2.120 -13.819 1.00 0.00 H new ATOM 0 HB3 MET A 95 19.314 -3.780 -14.357 1.00 0.00 H new ATOM 0 HG2 MET A 95 16.961 -3.825 -13.434 1.00 0.00 H new ATOM 0 HG3 MET A 95 17.129 -2.144 -12.966 1.00 0.00 H new ATOM 0 HE1 MET A 95 17.009 0.002 -15.715 1.00 0.00 H new ATOM 0 HE2 MET A 95 17.962 -0.456 -14.283 1.00 0.00 H new ATOM 0 HE3 MET A 95 18.633 -0.699 -15.914 1.00 0.00 H new ATOM 1461 N MET A 96 21.765 -3.247 -12.141 1.00 0.00 N ATOM 1462 CA MET A 96 23.159 -3.672 -12.156 1.00 0.00 C ATOM 1463 C MET A 96 23.495 -4.485 -10.907 1.00 0.00 C ATOM 1464 O MET A 96 24.242 -5.460 -10.975 1.00 0.00 O ATOM 1465 CB MET A 96 24.076 -2.451 -12.232 1.00 0.00 C ATOM 1466 CG MET A 96 23.682 -1.594 -13.436 1.00 0.00 C ATOM 1467 SD MET A 96 23.920 -2.536 -14.968 1.00 0.00 S ATOM 1468 CE MET A 96 25.733 -2.548 -14.980 1.00 0.00 C ATOM 0 H MET A 96 21.629 -2.240 -12.057 1.00 0.00 H new ATOM 0 HA MET A 96 23.313 -4.301 -13.033 1.00 0.00 H new ATOM 0 HB2 MET A 96 23.999 -1.867 -11.315 1.00 0.00 H new ATOM 0 HB3 MET A 96 25.115 -2.768 -12.322 1.00 0.00 H new ATOM 0 HG2 MET A 96 22.641 -1.284 -13.348 1.00 0.00 H new ATOM 0 HG3 MET A 96 24.284 -0.686 -13.460 1.00 0.00 H new ATOM 0 HE1 MET A 96 26.093 -2.209 -15.951 1.00 0.00 H new ATOM 0 HE2 MET A 96 26.106 -1.882 -14.202 1.00 0.00 H new ATOM 0 HE3 MET A 96 26.091 -3.560 -14.794 1.00 0.00 H new ATOM 1478 N ILE A 97 22.955 -4.064 -9.763 1.00 0.00 N ATOM 1479 CA ILE A 97 23.226 -4.756 -8.505 1.00 0.00 C ATOM 1480 C ILE A 97 22.739 -6.202 -8.557 1.00 0.00 C ATOM 1481 O ILE A 97 23.478 -7.126 -8.226 1.00 0.00 O ATOM 1482 CB ILE A 97 22.524 -4.030 -7.350 1.00 0.00 C ATOM 1483 CG1 ILE A 97 23.133 -2.630 -7.185 1.00 0.00 C ATOM 1484 CG2 ILE A 97 22.702 -4.825 -6.051 1.00 0.00 C ATOM 1485 CD1 ILE A 97 22.325 -1.822 -6.163 1.00 0.00 C ATOM 0 H ILE A 97 22.335 -3.258 -9.682 1.00 0.00 H new ATOM 0 HA ILE A 97 24.304 -4.756 -8.346 1.00 0.00 H new ATOM 0 HB ILE A 97 21.460 -3.942 -7.571 1.00 0.00 H new ATOM 0 HG12 ILE A 97 24.170 -2.712 -6.858 1.00 0.00 H new ATOM 0 HG13 ILE A 97 23.141 -2.113 -8.145 1.00 0.00 H new ATOM 0 HG21 ILE A 97 22.201 -4.305 -5.234 1.00 0.00 H new ATOM 0 HG22 ILE A 97 22.267 -5.818 -6.169 1.00 0.00 H new ATOM 0 HG23 ILE A 97 23.764 -4.919 -5.824 1.00 0.00 H new ATOM 0 HD11 ILE A 97 22.765 -0.831 -6.053 1.00 0.00 H new ATOM 0 HD12 ILE A 97 21.295 -1.726 -6.507 1.00 0.00 H new ATOM 0 HD13 ILE A 97 22.340 -2.334 -5.201 1.00 0.00 H new ATOM 1497 N ILE A 98 21.494 -6.389 -8.982 1.00 0.00 N ATOM 1498 CA ILE A 98 20.923 -7.727 -9.074 1.00 0.00 C ATOM 1499 C ILE A 98 21.632 -8.542 -10.150 1.00 0.00 C ATOM 1500 O ILE A 98 21.858 -9.739 -9.988 1.00 0.00 O ATOM 1501 CB ILE A 98 19.427 -7.642 -9.381 1.00 0.00 C ATOM 1502 CG1 ILE A 98 18.860 -9.048 -9.583 1.00 0.00 C ATOM 1503 CG2 ILE A 98 19.215 -6.815 -10.643 1.00 0.00 C ATOM 1504 CD1 ILE A 98 17.331 -8.985 -9.573 1.00 0.00 C ATOM 0 H ILE A 98 20.866 -5.637 -9.266 1.00 0.00 H new ATOM 0 HA ILE A 98 21.061 -8.226 -8.115 1.00 0.00 H new ATOM 0 HB ILE A 98 18.912 -7.167 -8.546 1.00 0.00 H new ATOM 0 HG12 ILE A 98 19.212 -9.462 -10.528 1.00 0.00 H new ATOM 0 HG13 ILE A 98 19.213 -9.711 -8.793 1.00 0.00 H new ATOM 0 HG21 ILE A 98 18.149 -6.754 -10.863 1.00 0.00 H new ATOM 0 HG22 ILE A 98 19.613 -5.811 -10.491 1.00 0.00 H new ATOM 0 HG23 ILE A 98 19.731 -7.287 -11.479 1.00 0.00 H new ATOM 0 HD11 ILE A 98 16.925 -9.986 -9.717 1.00 0.00 H new ATOM 0 HD12 ILE A 98 16.989 -8.589 -8.617 1.00 0.00 H new ATOM 0 HD13 ILE A 98 16.988 -8.335 -10.378 1.00 0.00 H new ATOM 1516 N LEU A 99 21.979 -7.883 -11.246 1.00 0.00 N ATOM 1517 CA LEU A 99 22.662 -8.552 -12.345 1.00 0.00 C ATOM 1518 C LEU A 99 24.022 -9.071 -11.887 1.00 0.00 C ATOM 1519 O LEU A 99 24.439 -10.166 -12.267 1.00 0.00 O ATOM 1520 CB LEU A 99 22.834 -7.580 -13.520 1.00 0.00 C ATOM 1521 CG LEU A 99 21.514 -7.455 -14.302 1.00 0.00 C ATOM 1522 CD1 LEU A 99 21.582 -6.224 -15.211 1.00 0.00 C ATOM 1523 CD2 LEU A 99 21.268 -8.713 -15.161 1.00 0.00 C ATOM 0 H LEU A 99 21.800 -6.890 -11.398 1.00 0.00 H new ATOM 0 HA LEU A 99 22.060 -9.400 -12.671 1.00 0.00 H new ATOM 0 HB2 LEU A 99 23.141 -6.601 -13.150 1.00 0.00 H new ATOM 0 HB3 LEU A 99 23.625 -7.933 -14.181 1.00 0.00 H new ATOM 0 HG LEU A 99 20.693 -7.352 -13.592 1.00 0.00 H new ATOM 0 HD11 LEU A 99 20.649 -6.131 -15.767 1.00 0.00 H new ATOM 0 HD12 LEU A 99 21.733 -5.331 -14.604 1.00 0.00 H new ATOM 0 HD13 LEU A 99 22.412 -6.333 -15.909 1.00 0.00 H new ATOM 0 HD21 LEU A 99 20.330 -8.604 -15.705 1.00 0.00 H new ATOM 0 HD22 LEU A 99 22.087 -8.835 -15.870 1.00 0.00 H new ATOM 0 HD23 LEU A 99 21.213 -9.589 -14.515 1.00 0.00 H new ATOM 1535 N GLY A 100 24.710 -8.278 -11.076 1.00 0.00 N ATOM 1536 CA GLY A 100 26.022 -8.674 -10.580 1.00 0.00 C ATOM 1537 C GLY A 100 25.928 -9.955 -9.758 1.00 0.00 C ATOM 1538 O GLY A 100 26.844 -10.776 -9.766 1.00 0.00 O ATOM 0 H GLY A 100 24.387 -7.367 -10.750 1.00 0.00 H new ATOM 0 HA2 GLY A 100 26.702 -8.824 -11.418 1.00 0.00 H new ATOM 0 HA3 GLY A 100 26.441 -7.875 -9.969 1.00 0.00 H new ATOM 1542 N VAL A 101 24.818 -10.119 -9.051 1.00 0.00 N ATOM 1543 CA VAL A 101 24.621 -11.307 -8.227 1.00 0.00 C ATOM 1544 C VAL A 101 24.588 -12.567 -9.093 1.00 0.00 C ATOM 1545 O VAL A 101 25.185 -13.585 -8.747 1.00 0.00 O ATOM 1546 CB VAL A 101 23.310 -11.190 -7.442 1.00 0.00 C ATOM 1547 CG1 VAL A 101 23.046 -12.490 -6.677 1.00 0.00 C ATOM 1548 CG2 VAL A 101 23.412 -10.032 -6.450 1.00 0.00 C ATOM 0 H VAL A 101 24.046 -9.452 -9.030 1.00 0.00 H new ATOM 0 HA VAL A 101 25.456 -11.382 -7.531 1.00 0.00 H new ATOM 0 HB VAL A 101 22.491 -11.007 -8.137 1.00 0.00 H new ATOM 0 HG11 VAL A 101 22.113 -12.402 -6.121 1.00 0.00 H new ATOM 0 HG12 VAL A 101 22.971 -13.318 -7.382 1.00 0.00 H new ATOM 0 HG13 VAL A 101 23.866 -12.677 -5.983 1.00 0.00 H new ATOM 0 HG21 VAL A 101 22.480 -9.948 -5.891 1.00 0.00 H new ATOM 0 HG22 VAL A 101 24.234 -10.217 -5.759 1.00 0.00 H new ATOM 0 HG23 VAL A 101 23.595 -9.104 -6.992 1.00 0.00 H new ATOM 1558 N ILE A 102 23.867 -12.495 -10.209 1.00 0.00 N ATOM 1559 CA ILE A 102 23.743 -13.642 -11.104 1.00 0.00 C ATOM 1560 C ILE A 102 25.096 -14.014 -11.686 1.00 0.00 C ATOM 1561 O ILE A 102 25.469 -15.187 -11.735 1.00 0.00 O ATOM 1562 CB ILE A 102 22.774 -13.301 -12.242 1.00 0.00 C ATOM 1563 CG1 ILE A 102 21.498 -12.665 -11.670 1.00 0.00 C ATOM 1564 CG2 ILE A 102 22.395 -14.583 -12.985 1.00 0.00 C ATOM 1565 CD1 ILE A 102 20.985 -13.490 -10.491 1.00 0.00 C ATOM 0 H ILE A 102 23.364 -11.662 -10.513 1.00 0.00 H new ATOM 0 HA ILE A 102 23.361 -14.490 -10.535 1.00 0.00 H new ATOM 0 HB ILE A 102 23.257 -12.601 -12.923 1.00 0.00 H new ATOM 0 HG12 ILE A 102 21.704 -11.644 -11.348 1.00 0.00 H new ATOM 0 HG13 ILE A 102 20.733 -12.607 -12.444 1.00 0.00 H new ATOM 0 HG21 ILE A 102 21.706 -14.344 -13.795 1.00 0.00 H new ATOM 0 HG22 ILE A 102 23.293 -15.044 -13.397 1.00 0.00 H new ATOM 0 HG23 ILE A 102 21.916 -15.276 -12.294 1.00 0.00 H new ATOM 0 HD11 ILE A 102 20.080 -13.031 -10.092 1.00 0.00 H new ATOM 0 HD12 ILE A 102 20.761 -14.503 -10.826 1.00 0.00 H new ATOM 0 HD13 ILE A 102 21.747 -13.525 -9.713 1.00 0.00 H new ATOM 1577 N CYS A 103 25.817 -13.004 -12.123 1.00 0.00 N ATOM 1578 CA CYS A 103 27.141 -13.212 -12.710 1.00 0.00 C ATOM 1579 C CYS A 103 28.103 -13.782 -11.673 1.00 0.00 C ATOM 1580 O CYS A 103 28.943 -14.624 -11.984 1.00 0.00 O ATOM 1581 CB CYS A 103 27.694 -11.896 -13.272 1.00 0.00 C ATOM 1582 SG CYS A 103 28.427 -10.898 -11.945 1.00 0.00 S ATOM 0 H CYS A 103 25.518 -12.030 -12.087 1.00 0.00 H new ATOM 0 HA CYS A 103 27.042 -13.927 -13.527 1.00 0.00 H new ATOM 0 HB2 CYS A 103 28.444 -12.106 -14.034 1.00 0.00 H new ATOM 0 HB3 CYS A 103 26.894 -11.336 -13.757 1.00 0.00 H new ATOM 0 HG CYS A 103 27.662 -10.943 -10.895 1.00 0.00 H new ATOM 1588 N ALA A 104 27.973 -13.306 -10.441 1.00 0.00 N ATOM 1589 CA ALA A 104 28.836 -13.762 -9.359 1.00 0.00 C ATOM 1590 C ALA A 104 28.690 -15.267 -9.154 1.00 0.00 C ATOM 1591 O ALA A 104 29.668 -15.962 -8.873 1.00 0.00 O ATOM 1592 CB ALA A 104 28.475 -13.033 -8.063 1.00 0.00 C ATOM 0 H ALA A 104 27.282 -12.608 -10.167 1.00 0.00 H new ATOM 0 HA ALA A 104 29.870 -13.542 -9.626 1.00 0.00 H new ATOM 0 HB1 ALA A 104 29.124 -13.379 -7.258 1.00 0.00 H new ATOM 0 HB2 ALA A 104 28.607 -11.960 -8.200 1.00 0.00 H new ATOM 0 HB3 ALA A 104 27.436 -13.241 -7.806 1.00 0.00 H new ATOM 1598 N ILE A 105 27.467 -15.765 -9.298 1.00 0.00 N ATOM 1599 CA ILE A 105 27.206 -17.190 -9.125 1.00 0.00 C ATOM 1600 C ILE A 105 27.957 -18.003 -10.177 1.00 0.00 C ATOM 1601 O ILE A 105 28.547 -19.040 -9.872 1.00 0.00 O ATOM 1602 CB ILE A 105 25.704 -17.464 -9.237 1.00 0.00 C ATOM 1603 CG1 ILE A 105 24.985 -16.828 -8.045 1.00 0.00 C ATOM 1604 CG2 ILE A 105 25.453 -18.976 -9.228 1.00 0.00 C ATOM 1605 CD1 ILE A 105 23.472 -16.866 -8.277 1.00 0.00 C ATOM 0 H ILE A 105 26.645 -15.208 -9.532 1.00 0.00 H new ATOM 0 HA ILE A 105 27.555 -17.488 -8.136 1.00 0.00 H new ATOM 0 HB ILE A 105 25.327 -17.039 -10.167 1.00 0.00 H new ATOM 0 HG12 ILE A 105 25.236 -17.362 -7.129 1.00 0.00 H new ATOM 0 HG13 ILE A 105 25.317 -15.798 -7.914 1.00 0.00 H new ATOM 0 HG21 ILE A 105 24.383 -19.168 -9.308 1.00 0.00 H new ATOM 0 HG22 ILE A 105 25.968 -19.435 -10.072 1.00 0.00 H new ATOM 0 HG23 ILE A 105 25.829 -19.402 -8.298 1.00 0.00 H new ATOM 0 HD11 ILE A 105 22.962 -16.413 -7.427 1.00 0.00 H new ATOM 0 HD12 ILE A 105 23.229 -16.312 -9.184 1.00 0.00 H new ATOM 0 HD13 ILE A 105 23.146 -17.901 -8.386 1.00 0.00 H new ATOM 1617 N ILE A 106 27.926 -17.526 -11.418 1.00 0.00 N ATOM 1618 CA ILE A 106 28.602 -18.220 -12.507 1.00 0.00 C ATOM 1619 C ILE A 106 30.084 -18.372 -12.192 1.00 0.00 C ATOM 1620 O ILE A 106 30.724 -19.335 -12.611 1.00 0.00 O ATOM 1621 CB ILE A 106 28.429 -17.439 -13.814 1.00 0.00 C ATOM 1622 CG1 ILE A 106 26.938 -17.213 -14.073 1.00 0.00 C ATOM 1623 CG2 ILE A 106 29.027 -18.236 -14.977 1.00 0.00 C ATOM 1624 CD1 ILE A 106 26.762 -16.316 -15.300 1.00 0.00 C ATOM 0 H ILE A 106 27.444 -16.670 -11.692 1.00 0.00 H new ATOM 0 HA ILE A 106 28.159 -19.210 -12.620 1.00 0.00 H new ATOM 0 HB ILE A 106 28.941 -16.480 -13.732 1.00 0.00 H new ATOM 0 HG12 ILE A 106 26.437 -18.168 -14.233 1.00 0.00 H new ATOM 0 HG13 ILE A 106 26.473 -16.751 -13.202 1.00 0.00 H new ATOM 0 HG21 ILE A 106 28.901 -17.677 -15.904 1.00 0.00 H new ATOM 0 HG22 ILE A 106 30.089 -18.404 -14.795 1.00 0.00 H new ATOM 0 HG23 ILE A 106 28.517 -19.196 -15.061 1.00 0.00 H new ATOM 0 HD11 ILE A 106 25.700 -16.155 -15.484 1.00 0.00 H new ATOM 0 HD12 ILE A 106 27.249 -15.357 -15.122 1.00 0.00 H new ATOM 0 HD13 ILE A 106 27.212 -16.796 -16.169 1.00 0.00 H new ATOM 1636 N LEU A 107 30.628 -17.418 -11.454 1.00 0.00 N ATOM 1637 CA LEU A 107 32.038 -17.463 -11.091 1.00 0.00 C ATOM 1638 C LEU A 107 32.310 -18.608 -10.116 1.00 0.00 C ATOM 1639 O LEU A 107 33.374 -19.227 -10.155 1.00 0.00 O ATOM 1640 CB LEU A 107 32.471 -16.134 -10.463 1.00 0.00 C ATOM 1641 CG LEU A 107 33.980 -16.154 -10.168 1.00 0.00 C ATOM 1642 CD1 LEU A 107 34.783 -16.313 -11.476 1.00 0.00 C ATOM 1643 CD2 LEU A 107 34.369 -14.842 -9.475 1.00 0.00 C ATOM 0 H LEU A 107 30.121 -16.609 -11.096 1.00 0.00 H new ATOM 0 HA LEU A 107 32.615 -17.633 -12.000 1.00 0.00 H new ATOM 0 HB2 LEU A 107 32.236 -15.311 -11.137 1.00 0.00 H new ATOM 0 HB3 LEU A 107 31.915 -15.960 -9.542 1.00 0.00 H new ATOM 0 HG LEU A 107 34.209 -16.999 -9.519 1.00 0.00 H new ATOM 0 HD11 LEU A 107 35.849 -16.325 -11.249 1.00 0.00 H new ATOM 0 HD12 LEU A 107 34.505 -17.248 -11.962 1.00 0.00 H new ATOM 0 HD13 LEU A 107 34.563 -15.478 -12.142 1.00 0.00 H new ATOM 0 HD21 LEU A 107 35.438 -14.846 -9.261 1.00 0.00 H new ATOM 0 HD22 LEU A 107 34.133 -14.002 -10.128 1.00 0.00 H new ATOM 0 HD23 LEU A 107 33.813 -14.744 -8.543 1.00 0.00 H new ATOM 1655 N ILE A 108 31.360 -18.860 -9.220 1.00 0.00 N ATOM 1656 CA ILE A 108 31.530 -19.910 -8.217 1.00 0.00 C ATOM 1657 C ILE A 108 31.734 -21.272 -8.873 1.00 0.00 C ATOM 1658 O ILE A 108 32.653 -22.007 -8.517 1.00 0.00 O ATOM 1659 CB ILE A 108 30.292 -19.965 -7.322 1.00 0.00 C ATOM 1660 CG1 ILE A 108 30.007 -18.571 -6.745 1.00 0.00 C ATOM 1661 CG2 ILE A 108 30.514 -20.965 -6.185 1.00 0.00 C ATOM 1662 CD1 ILE A 108 31.229 -18.028 -5.989 1.00 0.00 C ATOM 0 H ILE A 108 30.473 -18.359 -9.166 1.00 0.00 H new ATOM 0 HA ILE A 108 32.414 -19.675 -7.625 1.00 0.00 H new ATOM 0 HB ILE A 108 29.436 -20.288 -7.915 1.00 0.00 H new ATOM 0 HG12 ILE A 108 29.740 -17.887 -7.551 1.00 0.00 H new ATOM 0 HG13 ILE A 108 29.151 -18.620 -6.072 1.00 0.00 H new ATOM 0 HG21 ILE A 108 29.628 -20.998 -5.552 1.00 0.00 H new ATOM 0 HG22 ILE A 108 30.700 -21.955 -6.602 1.00 0.00 H new ATOM 0 HG23 ILE A 108 31.373 -20.655 -5.590 1.00 0.00 H new ATOM 0 HD11 ILE A 108 31.001 -17.040 -5.590 1.00 0.00 H new ATOM 0 HD12 ILE A 108 31.478 -18.701 -5.169 1.00 0.00 H new ATOM 0 HD13 ILE A 108 32.077 -17.957 -6.671 1.00 0.00 H new ATOM 1674 N ILE A 109 30.878 -21.602 -9.831 1.00 0.00 N ATOM 1675 CA ILE A 109 30.982 -22.878 -10.528 1.00 0.00 C ATOM 1676 C ILE A 109 32.275 -22.951 -11.338 1.00 0.00 C ATOM 1677 O ILE A 109 32.928 -23.993 -11.384 1.00 0.00 O ATOM 1678 CB ILE A 109 29.770 -23.075 -11.441 1.00 0.00 C ATOM 1679 CG1 ILE A 109 29.574 -21.832 -12.305 1.00 0.00 C ATOM 1680 CG2 ILE A 109 28.521 -23.305 -10.589 1.00 0.00 C ATOM 1681 CD1 ILE A 109 28.407 -22.046 -13.266 1.00 0.00 C ATOM 0 H ILE A 109 30.109 -21.009 -10.142 1.00 0.00 H new ATOM 0 HA ILE A 109 31.001 -23.677 -9.787 1.00 0.00 H new ATOM 0 HB ILE A 109 29.937 -23.940 -12.083 1.00 0.00 H new ATOM 0 HG12 ILE A 109 29.381 -20.965 -11.672 1.00 0.00 H new ATOM 0 HG13 ILE A 109 30.484 -21.621 -12.866 1.00 0.00 H new ATOM 0 HG21 ILE A 109 27.658 -23.445 -11.239 1.00 0.00 H new ATOM 0 HG22 ILE A 109 28.659 -24.193 -9.973 1.00 0.00 H new ATOM 0 HG23 ILE A 109 28.355 -22.440 -9.947 1.00 0.00 H new ATOM 0 HD11 ILE A 109 28.273 -21.155 -13.879 1.00 0.00 H new ATOM 0 HD12 ILE A 109 28.617 -22.901 -13.909 1.00 0.00 H new ATOM 0 HD13 ILE A 109 27.497 -22.235 -12.697 1.00 0.00 H new ATOM 1693 N ILE A 110 32.646 -21.838 -11.965 1.00 0.00 N ATOM 1694 CA ILE A 110 33.867 -21.784 -12.763 1.00 0.00 C ATOM 1695 C ILE A 110 35.087 -22.078 -11.894 1.00 0.00 C ATOM 1696 O ILE A 110 35.993 -22.798 -12.308 1.00 0.00 O ATOM 1697 CB ILE A 110 34.010 -20.404 -13.422 1.00 0.00 C ATOM 1698 CG1 ILE A 110 32.960 -20.253 -14.529 1.00 0.00 C ATOM 1699 CG2 ILE A 110 35.410 -20.247 -14.023 1.00 0.00 C ATOM 1700 CD1 ILE A 110 32.894 -18.793 -14.981 1.00 0.00 C ATOM 0 H ILE A 110 32.121 -20.964 -11.936 1.00 0.00 H new ATOM 0 HA ILE A 110 33.804 -22.543 -13.543 1.00 0.00 H new ATOM 0 HB ILE A 110 33.860 -19.634 -12.665 1.00 0.00 H new ATOM 0 HG12 ILE A 110 33.213 -20.894 -15.373 1.00 0.00 H new ATOM 0 HG13 ILE A 110 31.985 -20.576 -14.165 1.00 0.00 H new ATOM 0 HG21 ILE A 110 35.499 -19.265 -14.487 1.00 0.00 H new ATOM 0 HG22 ILE A 110 36.157 -20.345 -13.235 1.00 0.00 H new ATOM 0 HG23 ILE A 110 35.572 -21.019 -14.775 1.00 0.00 H new ATOM 0 HD11 ILE A 110 32.147 -18.689 -15.768 1.00 0.00 H new ATOM 0 HD12 ILE A 110 32.620 -18.162 -14.135 1.00 0.00 H new ATOM 0 HD13 ILE A 110 33.868 -18.486 -15.363 1.00 0.00 H new ATOM 1712 N ILE A 111 35.106 -21.510 -10.699 1.00 0.00 N ATOM 1713 CA ILE A 111 36.227 -21.713 -9.792 1.00 0.00 C ATOM 1714 C ILE A 111 36.363 -23.193 -9.439 1.00 0.00 C ATOM 1715 O ILE A 111 37.471 -23.726 -9.385 1.00 0.00 O ATOM 1716 CB ILE A 111 36.021 -20.887 -8.514 1.00 0.00 C ATOM 1717 CG1 ILE A 111 36.146 -19.379 -8.830 1.00 0.00 C ATOM 1718 CG2 ILE A 111 37.056 -21.297 -7.456 1.00 0.00 C ATOM 1719 CD1 ILE A 111 37.616 -18.924 -8.808 1.00 0.00 C ATOM 0 H ILE A 111 34.366 -20.910 -10.336 1.00 0.00 H new ATOM 0 HA ILE A 111 37.142 -21.386 -10.286 1.00 0.00 H new ATOM 0 HB ILE A 111 35.022 -21.079 -8.123 1.00 0.00 H new ATOM 0 HG12 ILE A 111 35.714 -19.173 -9.809 1.00 0.00 H new ATOM 0 HG13 ILE A 111 35.574 -18.804 -8.102 1.00 0.00 H new ATOM 0 HG21 ILE A 111 36.905 -20.708 -6.552 1.00 0.00 H new ATOM 0 HG22 ILE A 111 36.939 -22.355 -7.223 1.00 0.00 H new ATOM 0 HG23 ILE A 111 38.060 -21.119 -7.841 1.00 0.00 H new ATOM 0 HD11 ILE A 111 37.671 -17.859 -9.034 1.00 0.00 H new ATOM 0 HD12 ILE A 111 38.039 -19.108 -7.820 1.00 0.00 H new ATOM 0 HD13 ILE A 111 38.181 -19.483 -9.554 1.00 0.00 H new ATOM 1731 N VAL A 112 35.239 -23.848 -9.190 1.00 0.00 N ATOM 1732 CA VAL A 112 35.257 -25.256 -8.836 1.00 0.00 C ATOM 1733 C VAL A 112 35.868 -26.071 -9.964 1.00 0.00 C ATOM 1734 O VAL A 112 36.704 -26.946 -9.730 1.00 0.00 O ATOM 1735 CB VAL A 112 33.831 -25.736 -8.565 1.00 0.00 C ATOM 1736 CG1 VAL A 112 33.834 -27.249 -8.324 1.00 0.00 C ATOM 1737 CG2 VAL A 112 33.280 -25.022 -7.328 1.00 0.00 C ATOM 0 H VAL A 112 34.310 -23.429 -9.227 1.00 0.00 H new ATOM 0 HA VAL A 112 35.860 -25.389 -7.938 1.00 0.00 H new ATOM 0 HB VAL A 112 33.203 -25.510 -9.426 1.00 0.00 H new ATOM 0 HG11 VAL A 112 32.816 -27.589 -8.131 1.00 0.00 H new ATOM 0 HG12 VAL A 112 34.225 -27.757 -9.205 1.00 0.00 H new ATOM 0 HG13 VAL A 112 34.463 -27.479 -7.464 1.00 0.00 H new ATOM 0 HG21 VAL A 112 32.263 -25.363 -7.134 1.00 0.00 H new ATOM 0 HG22 VAL A 112 33.909 -25.248 -6.467 1.00 0.00 H new ATOM 0 HG23 VAL A 112 33.275 -23.946 -7.501 1.00 0.00 H new ATOM 1747 N TYR A 113 35.449 -25.784 -11.191 1.00 0.00 N ATOM 1748 CA TYR A 113 35.966 -26.505 -12.341 1.00 0.00 C ATOM 1749 C TYR A 113 37.459 -26.261 -12.508 1.00 0.00 C ATOM 1750 O TYR A 113 38.211 -27.165 -12.871 1.00 0.00 O ATOM 1751 CB TYR A 113 35.225 -26.090 -13.621 1.00 0.00 C ATOM 1752 CG TYR A 113 33.854 -26.735 -13.655 1.00 0.00 C ATOM 1753 CD1 TYR A 113 33.743 -28.130 -13.741 1.00 0.00 C ATOM 1754 CD2 TYR A 113 32.698 -25.946 -13.598 1.00 0.00 C ATOM 1755 CE1 TYR A 113 32.479 -28.731 -13.770 1.00 0.00 C ATOM 1756 CE2 TYR A 113 31.435 -26.550 -13.623 1.00 0.00 C ATOM 1757 CZ TYR A 113 31.326 -27.943 -13.709 1.00 0.00 C ATOM 1758 OH TYR A 113 30.081 -28.539 -13.735 1.00 0.00 O ATOM 0 H TYR A 113 34.760 -25.065 -11.411 1.00 0.00 H new ATOM 0 HA TYR A 113 35.802 -27.569 -12.167 1.00 0.00 H new ATOM 0 HB2 TYR A 113 35.127 -25.005 -13.660 1.00 0.00 H new ATOM 0 HB3 TYR A 113 35.799 -26.390 -14.498 1.00 0.00 H new ATOM 0 HD1 TYR A 113 34.633 -28.741 -13.785 1.00 0.00 H new ATOM 0 HD2 TYR A 113 32.781 -24.871 -13.535 1.00 0.00 H new ATOM 0 HE1 TYR A 113 32.394 -29.805 -13.840 1.00 0.00 H new ATOM 0 HE2 TYR A 113 30.544 -25.941 -13.576 1.00 0.00 H new ATOM 0 HH TYR A 113 29.387 -27.849 -13.683 1.00 0.00 H new ATOM 1768 N PHE A 114 37.875 -25.034 -12.252 1.00 0.00 N ATOM 1769 CA PHE A 114 39.279 -24.669 -12.383 1.00 0.00 C ATOM 1770 C PHE A 114 40.144 -25.504 -11.450 1.00 0.00 C ATOM 1771 O PHE A 114 41.197 -26.007 -11.844 1.00 0.00 O ATOM 1772 CB PHE A 114 39.466 -23.184 -12.070 1.00 0.00 C ATOM 1773 CG PHE A 114 40.918 -22.810 -12.247 1.00 0.00 C ATOM 1774 CD1 PHE A 114 41.412 -22.502 -13.521 1.00 0.00 C ATOM 1775 CD2 PHE A 114 41.770 -22.770 -11.138 1.00 0.00 C ATOM 1776 CE1 PHE A 114 42.758 -22.156 -13.685 1.00 0.00 C ATOM 1777 CE2 PHE A 114 43.117 -22.421 -11.302 1.00 0.00 C ATOM 1778 CZ PHE A 114 43.612 -22.115 -12.576 1.00 0.00 C ATOM 0 H PHE A 114 37.265 -24.273 -11.953 1.00 0.00 H new ATOM 0 HA PHE A 114 39.588 -24.863 -13.410 1.00 0.00 H new ATOM 0 HB2 PHE A 114 38.841 -22.581 -12.729 1.00 0.00 H new ATOM 0 HB3 PHE A 114 39.147 -22.974 -11.049 1.00 0.00 H new ATOM 0 HD1 PHE A 114 40.754 -22.532 -14.377 1.00 0.00 H new ATOM 0 HD2 PHE A 114 41.389 -23.008 -10.156 1.00 0.00 H new ATOM 0 HE1 PHE A 114 43.139 -21.920 -14.668 1.00 0.00 H new ATOM 0 HE2 PHE A 114 43.774 -22.388 -10.445 1.00 0.00 H new ATOM 0 HZ PHE A 114 44.651 -21.848 -12.703 1.00 0.00 H new ATOM 1788 N SER A 115 39.693 -25.641 -10.211 1.00 0.00 N ATOM 1789 CA SER A 115 40.425 -26.411 -9.210 1.00 0.00 C ATOM 1790 C SER A 115 39.992 -27.869 -9.225 1.00 0.00 C ATOM 1791 O SER A 115 40.672 -28.736 -8.678 1.00 0.00 O ATOM 1792 CB SER A 115 40.184 -25.824 -7.819 1.00 0.00 C ATOM 1793 OG SER A 115 40.623 -24.472 -7.793 1.00 0.00 O ATOM 0 H SER A 115 38.823 -25.229 -9.873 1.00 0.00 H new ATOM 0 HA SER A 115 41.487 -26.358 -9.451 1.00 0.00 H new ATOM 0 HB2 SER A 115 39.125 -25.879 -7.568 1.00 0.00 H new ATOM 0 HB3 SER A 115 40.720 -26.406 -7.069 1.00 0.00 H new ATOM 0 HG SER A 115 40.467 -24.095 -6.902 1.00 0.00 H new ATOM 1799 N THR A 116 38.855 -28.131 -9.858 1.00 0.00 N ATOM 1800 CA THR A 116 38.325 -29.485 -9.946 1.00 0.00 C ATOM 1801 C THR A 116 38.537 -30.245 -8.638 1.00 0.00 C ATOM 1802 O THR A 116 39.340 -31.165 -8.631 1.00 0.00 O ATOM 1803 CB THR A 116 39.010 -30.223 -11.090 1.00 0.00 C ATOM 1804 OG1 THR A 116 38.986 -29.413 -12.258 1.00 0.00 O ATOM 1805 CG2 THR A 116 38.273 -31.530 -11.363 1.00 0.00 C ATOM 1806 OXT THR A 116 37.898 -29.893 -7.660 1.00 0.00 O ATOM 0 H THR A 116 38.282 -27.423 -10.318 1.00 0.00 H new ATOM 0 HA THR A 116 37.253 -29.426 -10.133 1.00 0.00 H new ATOM 0 HB THR A 116 40.043 -30.437 -10.818 1.00 0.00 H new ATOM 0 HG1 THR A 116 38.299 -28.720 -12.162 1.00 0.00 H new ATOM 0 HG21 THR A 116 38.762 -32.059 -12.181 1.00 0.00 H new ATOM 0 HG22 THR A 116 38.290 -32.151 -10.467 1.00 0.00 H new ATOM 0 HG23 THR A 116 37.240 -31.315 -11.636 1.00 0.00 H new TER 1814 THR A 116