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 33 GLN : amide:sc= -0.47 K(o=-4.6,f=-6.4) USER MOD Set 1.2: A 38 GLN : amide:sc= -4.14! C(o=-4.6!,f=-12!) USER MOD Single : A 1 MET CE :methyl -133:sc=-0.00833 (180deg=-0.0793) USER MOD Single : A 1 MET N :NH3+ 175:sc= -1.03 (180deg=-1.3) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 29:sc= 0.0986 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 ASN : amide:sc= -0.0482 K(o=-0.048,f=-1.9!) USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0.0106 USER MOD Single : A 29 ASN : amide:sc= -2.09 K(o=-2.1,f=-3.9!) USER MOD Single : A 34 GLN : amide:sc= -1.29 K(o=-1.3,f=-0.16) USER MOD Single : A 35 THR OG1 : rot 180:sc= 0.0247 USER MOD Single : A 36 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 46 MET CE :methyl -173:sc= 0 (180deg=-0.0244) USER MOD Single : A 49 ASN : amide:sc= -0.168 K(o=-0.17,f=-1.8) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 GLN : amide:sc= 0.316 K(o=0.32,f=-0.9) USER MOD Single : A 59 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0411) USER MOD Single : A 61 SER OG : rot 180:sc= -0.374 USER MOD Single : A 71 GLN : amide:sc= -0.28 X(o=-0.28,f=-0.42) USER MOD Single : A 75 SER OG : rot 180:sc= 0.00369 USER MOD Single : A 76 GLN : amide:sc= -0.237 X(o=-0.24,f=-0.23) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ -161:sc= -0.0417 (180deg=-0.432) USER MOD Single : A 92 ASN : amide:sc=-0.00347 K(o=-0.0035,f=-1.1!) USER MOD Single : A 94 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0289) USER MOD Single : A 95 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 96 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 103 CYS SG : rot -42:sc= -0.553 USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot -17:sc= 0.0709 USER MOD Single : A 116 THR OG1 : rot -160:sc= -0.876 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -38.712 -45.107 28.070 1.00 0.00 N ATOM 2 CA MET A 1 -40.047 -45.258 27.424 1.00 0.00 C ATOM 3 C MET A 1 -41.026 -45.865 28.422 1.00 0.00 C ATOM 4 O MET A 1 -42.213 -45.537 28.420 1.00 0.00 O ATOM 5 CB MET A 1 -39.918 -46.167 26.201 1.00 0.00 C ATOM 6 CG MET A 1 -39.159 -47.439 26.586 1.00 0.00 C ATOM 7 SD MET A 1 -38.998 -48.514 25.138 1.00 0.00 S ATOM 8 CE MET A 1 -37.564 -47.696 24.395 1.00 0.00 C ATOM 0 H1 MET A 1 -38.022 -44.773 27.367 1.00 0.00 H new ATOM 0 H2 MET A 1 -38.778 -44.418 28.846 1.00 0.00 H new ATOM 0 H3 MET A 1 -38.403 -46.025 28.448 1.00 0.00 H new ATOM 0 HA MET A 1 -40.416 -44.282 27.108 1.00 0.00 H new ATOM 0 HB2 MET A 1 -40.906 -46.422 25.819 1.00 0.00 H new ATOM 0 HB3 MET A 1 -39.392 -45.645 25.401 1.00 0.00 H new ATOM 0 HG2 MET A 1 -38.173 -47.183 26.972 1.00 0.00 H new ATOM 0 HG3 MET A 1 -39.687 -47.962 27.383 1.00 0.00 H new ATOM 0 HE1 MET A 1 -37.745 -47.540 23.331 1.00 0.00 H new ATOM 0 HE2 MET A 1 -37.402 -46.733 24.880 1.00 0.00 H new ATOM 0 HE3 MET A 1 -36.681 -48.321 24.525 1.00 0.00 H new ATOM 18 N SER A 2 -40.523 -46.753 29.274 1.00 0.00 N ATOM 19 CA SER A 2 -41.363 -47.400 30.273 1.00 0.00 C ATOM 20 C SER A 2 -41.976 -46.364 31.208 1.00 0.00 C ATOM 21 O SER A 2 -43.152 -46.451 31.563 1.00 0.00 O ATOM 22 CB SER A 2 -40.535 -48.397 31.085 1.00 0.00 C ATOM 23 OG SER A 2 -39.971 -49.362 30.209 1.00 0.00 O ATOM 0 H SER A 2 -39.544 -47.039 29.292 1.00 0.00 H new ATOM 0 HA SER A 2 -42.165 -47.929 29.759 1.00 0.00 H new ATOM 0 HB2 SER A 2 -39.746 -47.876 31.627 1.00 0.00 H new ATOM 0 HB3 SER A 2 -41.162 -48.887 31.829 1.00 0.00 H new ATOM 0 HG SER A 2 -39.438 -50.002 30.726 1.00 0.00 H new ATOM 29 N ALA A 3 -41.172 -45.384 31.605 1.00 0.00 N ATOM 30 CA ALA A 3 -41.645 -44.335 32.500 1.00 0.00 C ATOM 31 C ALA A 3 -42.700 -43.478 31.808 1.00 0.00 C ATOM 32 O ALA A 3 -42.596 -43.194 30.616 1.00 0.00 O ATOM 33 CB ALA A 3 -40.475 -43.451 32.937 1.00 0.00 C ATOM 0 H ALA A 3 -40.196 -45.294 31.323 1.00 0.00 H new ATOM 0 HA ALA A 3 -42.090 -44.806 33.376 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -40.839 -42.670 33.605 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -39.735 -44.058 33.457 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -40.017 -42.994 32.060 1.00 0.00 H new ATOM 39 N THR A 4 -43.714 -43.070 32.565 1.00 0.00 N ATOM 40 CA THR A 4 -44.786 -42.243 32.016 1.00 0.00 C ATOM 41 C THR A 4 -44.424 -40.765 32.114 1.00 0.00 C ATOM 42 O THR A 4 -43.943 -40.302 33.148 1.00 0.00 O ATOM 43 CB THR A 4 -46.087 -42.501 32.780 1.00 0.00 C ATOM 44 OG1 THR A 4 -45.880 -42.252 34.162 1.00 0.00 O ATOM 45 CG2 THR A 4 -46.519 -43.955 32.578 1.00 0.00 C ATOM 0 H THR A 4 -43.817 -43.296 33.554 1.00 0.00 H new ATOM 0 HA THR A 4 -44.921 -42.505 30.967 1.00 0.00 H new ATOM 0 HB THR A 4 -46.867 -41.838 32.406 1.00 0.00 H new ATOM 0 HG1 THR A 4 -45.176 -41.579 34.271 1.00 0.00 H new ATOM 0 HG21 THR A 4 -47.445 -44.138 33.122 1.00 0.00 H new ATOM 0 HG22 THR A 4 -46.679 -44.143 31.516 1.00 0.00 H new ATOM 0 HG23 THR A 4 -45.741 -44.621 32.951 1.00 0.00 H new ATOM 53 N ALA A 5 -44.657 -40.031 31.031 1.00 0.00 N ATOM 54 CA ALA A 5 -44.352 -38.604 31.004 1.00 0.00 C ATOM 55 C ALA A 5 -45.212 -37.895 29.966 1.00 0.00 C ATOM 56 O ALA A 5 -45.610 -38.489 28.964 1.00 0.00 O ATOM 57 CB ALA A 5 -42.873 -38.393 30.676 1.00 0.00 C ATOM 0 H ALA A 5 -45.053 -40.397 30.165 1.00 0.00 H new ATOM 0 HA ALA A 5 -44.568 -38.185 31.987 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -42.653 -37.326 30.658 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -42.259 -38.877 31.436 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -42.651 -38.826 29.701 1.00 0.00 H new ATOM 63 N ALA A 6 -45.497 -36.621 30.211 1.00 0.00 N ATOM 64 CA ALA A 6 -46.313 -35.840 29.289 1.00 0.00 C ATOM 65 C ALA A 6 -46.084 -34.349 29.503 1.00 0.00 C ATOM 66 O ALA A 6 -47.036 -33.575 29.563 1.00 0.00 O ATOM 67 CB ALA A 6 -47.793 -36.159 29.501 1.00 0.00 C ATOM 0 H ALA A 6 -45.178 -36.110 31.034 1.00 0.00 H new ATOM 0 HA ALA A 6 -46.025 -36.102 28.271 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -48.395 -35.571 28.808 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -47.966 -37.220 29.322 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -48.075 -35.914 30.525 1.00 0.00 H new ATOM 73 N THR A 7 -44.815 -33.956 29.618 1.00 0.00 N ATOM 74 CA THR A 7 -44.462 -32.547 29.827 1.00 0.00 C ATOM 75 C THR A 7 -43.569 -32.048 28.703 1.00 0.00 C ATOM 76 O THR A 7 -42.551 -32.664 28.378 1.00 0.00 O ATOM 77 CB THR A 7 -43.738 -32.388 31.163 1.00 0.00 C ATOM 78 OG1 THR A 7 -44.598 -32.801 32.215 1.00 0.00 O ATOM 79 CG2 THR A 7 -43.353 -30.923 31.357 1.00 0.00 C ATOM 0 H THR A 7 -44.016 -34.588 29.571 1.00 0.00 H new ATOM 0 HA THR A 7 -45.379 -31.958 29.835 1.00 0.00 H new ATOM 0 HB THR A 7 -42.838 -33.002 31.170 1.00 0.00 H new ATOM 0 HG1 THR A 7 -44.136 -32.702 33.073 1.00 0.00 H new ATOM 0 HG21 THR A 7 -42.836 -30.806 32.309 1.00 0.00 H new ATOM 0 HG22 THR A 7 -42.696 -30.609 30.546 1.00 0.00 H new ATOM 0 HG23 THR A 7 -44.252 -30.307 31.354 1.00 0.00 H new ATOM 87 N VAL A 8 -43.965 -30.930 28.102 1.00 0.00 N ATOM 88 CA VAL A 8 -43.204 -30.363 27.006 1.00 0.00 C ATOM 89 C VAL A 8 -41.892 -29.769 27.513 1.00 0.00 C ATOM 90 O VAL A 8 -41.809 -29.304 28.654 1.00 0.00 O ATOM 91 CB VAL A 8 -44.016 -29.272 26.299 1.00 0.00 C ATOM 92 CG1 VAL A 8 -45.052 -29.919 25.380 1.00 0.00 C ATOM 93 CG2 VAL A 8 -44.723 -28.416 27.349 1.00 0.00 C ATOM 0 H VAL A 8 -44.802 -30.406 28.356 1.00 0.00 H new ATOM 0 HA VAL A 8 -42.984 -31.163 26.299 1.00 0.00 H new ATOM 0 HB VAL A 8 -43.351 -28.646 25.703 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -45.629 -29.142 24.878 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -44.545 -30.533 24.636 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -45.722 -30.544 25.970 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -45.303 -27.637 26.853 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -45.389 -29.043 27.941 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -43.982 -27.956 28.002 1.00 0.00 H new ATOM 103 N PRO A 9 -40.863 -29.772 26.697 1.00 0.00 N ATOM 104 CA PRO A 9 -39.542 -29.225 27.072 1.00 0.00 C ATOM 105 C PRO A 9 -39.652 -27.953 27.923 1.00 0.00 C ATOM 106 O PRO A 9 -40.714 -27.328 27.989 1.00 0.00 O ATOM 107 CB PRO A 9 -38.876 -28.929 25.721 1.00 0.00 C ATOM 108 CG PRO A 9 -39.493 -29.886 24.747 1.00 0.00 C ATOM 109 CD PRO A 9 -40.849 -30.310 25.330 1.00 0.00 C ATOM 0 HA PRO A 9 -38.975 -29.921 27.690 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -39.048 -27.896 25.418 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -37.797 -29.069 25.777 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -39.623 -29.414 23.773 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -38.849 -30.753 24.598 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -41.674 -29.910 24.740 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -40.955 -31.395 25.332 1.00 0.00 H new ATOM 117 N PRO A 10 -38.576 -27.547 28.555 1.00 0.00 N ATOM 118 CA PRO A 10 -38.558 -26.315 29.397 1.00 0.00 C ATOM 119 C PRO A 10 -39.127 -25.102 28.658 1.00 0.00 C ATOM 120 O PRO A 10 -39.840 -24.285 29.243 1.00 0.00 O ATOM 121 CB PRO A 10 -37.063 -26.112 29.705 1.00 0.00 C ATOM 122 CG PRO A 10 -36.447 -27.469 29.590 1.00 0.00 C ATOM 123 CD PRO A 10 -37.264 -28.223 28.546 1.00 0.00 C ATOM 0 HA PRO A 10 -39.176 -26.419 30.289 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -36.608 -25.413 29.003 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -36.920 -25.699 30.703 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -35.402 -27.397 29.288 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -36.467 -27.988 30.548 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -36.797 -28.173 27.562 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -37.358 -29.279 28.800 1.00 0.00 H new ATOM 131 N ALA A 11 -38.808 -24.992 27.373 1.00 0.00 N ATOM 132 CA ALA A 11 -39.291 -23.875 26.570 1.00 0.00 C ATOM 133 C ALA A 11 -38.817 -22.549 27.156 1.00 0.00 C ATOM 134 O ALA A 11 -38.709 -22.397 28.372 1.00 0.00 O ATOM 135 CB ALA A 11 -40.819 -23.896 26.519 1.00 0.00 C ATOM 0 H ALA A 11 -38.222 -25.657 26.868 1.00 0.00 H new ATOM 0 HA ALA A 11 -38.891 -23.975 25.561 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -41.175 -23.059 25.918 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -41.155 -24.832 26.073 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -41.218 -23.812 27.530 1.00 0.00 H new ATOM 141 N ALA A 12 -38.534 -21.588 26.280 1.00 0.00 N ATOM 142 CA ALA A 12 -38.074 -20.278 26.722 1.00 0.00 C ATOM 143 C ALA A 12 -38.255 -19.247 25.612 1.00 0.00 C ATOM 144 O ALA A 12 -37.283 -18.817 24.987 1.00 0.00 O ATOM 145 CB ALA A 12 -36.601 -20.347 27.121 1.00 0.00 C ATOM 0 H ALA A 12 -38.615 -21.692 25.269 1.00 0.00 H new ATOM 0 HA ALA A 12 -38.668 -19.977 27.585 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -36.267 -19.363 27.450 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -36.477 -21.063 27.934 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -36.007 -20.665 26.264 1.00 0.00 H new ATOM 151 N PRO A 13 -39.474 -18.849 25.361 1.00 0.00 N ATOM 152 CA PRO A 13 -39.796 -17.845 24.306 1.00 0.00 C ATOM 153 C PRO A 13 -39.105 -16.509 24.563 1.00 0.00 C ATOM 154 O PRO A 13 -38.942 -16.102 25.711 1.00 0.00 O ATOM 155 CB PRO A 13 -41.333 -17.702 24.388 1.00 0.00 C ATOM 156 CG PRO A 13 -41.802 -18.933 25.098 1.00 0.00 C ATOM 157 CD PRO A 13 -40.680 -19.316 26.057 1.00 0.00 C ATOM 0 HA PRO A 13 -39.451 -18.158 23.321 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -41.617 -16.801 24.932 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -41.775 -17.627 23.395 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -42.729 -18.743 25.638 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -42.004 -19.738 24.392 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -40.797 -18.834 27.028 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -40.652 -20.391 26.236 1.00 0.00 H new ATOM 165 N ALA A 14 -38.711 -15.834 23.488 1.00 0.00 N ATOM 166 CA ALA A 14 -38.043 -14.534 23.599 1.00 0.00 C ATOM 167 C ALA A 14 -38.900 -13.439 22.975 1.00 0.00 C ATOM 168 O ALA A 14 -39.558 -13.654 21.957 1.00 0.00 O ATOM 169 CB ALA A 14 -36.688 -14.588 22.898 1.00 0.00 C ATOM 0 H ALA A 14 -38.840 -16.161 22.531 1.00 0.00 H new ATOM 0 HA ALA A 14 -37.897 -14.306 24.655 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -36.195 -13.619 22.983 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -36.067 -15.353 23.364 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -36.832 -14.830 21.845 1.00 0.00 H new ATOM 175 N GLY A 15 -38.887 -12.265 23.595 1.00 0.00 N ATOM 176 CA GLY A 15 -39.666 -11.139 23.099 1.00 0.00 C ATOM 177 C GLY A 15 -39.352 -9.875 23.887 1.00 0.00 C ATOM 178 O GLY A 15 -39.257 -9.904 25.114 1.00 0.00 O ATOM 0 H GLY A 15 -38.348 -12.069 24.438 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -39.449 -10.978 22.043 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -40.730 -11.365 23.175 1.00 0.00 H new ATOM 182 N GLU A 16 -39.194 -8.763 23.175 1.00 0.00 N ATOM 183 CA GLU A 16 -38.894 -7.487 23.820 1.00 0.00 C ATOM 184 C GLU A 16 -40.178 -6.815 24.288 1.00 0.00 C ATOM 185 O GLU A 16 -41.200 -6.880 23.611 1.00 0.00 O ATOM 186 CB GLU A 16 -38.163 -6.568 22.840 1.00 0.00 C ATOM 187 CG GLU A 16 -39.040 -6.325 21.610 1.00 0.00 C ATOM 188 CD GLU A 16 -38.299 -5.446 20.608 1.00 0.00 C ATOM 189 OE1 GLU A 16 -37.240 -4.949 20.954 1.00 0.00 O ATOM 190 OE2 GLU A 16 -38.804 -5.283 19.510 1.00 0.00 O ATOM 0 H GLU A 16 -39.268 -8.718 22.159 1.00 0.00 H new ATOM 0 HA GLU A 16 -38.257 -7.675 24.685 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -37.926 -5.620 23.323 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -37.217 -7.018 22.541 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -39.304 -7.276 21.147 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -39.973 -5.846 21.907 1.00 0.00 H new ATOM 197 N GLY A 17 -40.114 -6.170 25.451 1.00 0.00 N ATOM 198 CA GLY A 17 -41.280 -5.480 26.013 1.00 0.00 C ATOM 199 C GLY A 17 -41.056 -3.975 26.036 1.00 0.00 C ATOM 200 O GLY A 17 -40.101 -3.470 25.449 1.00 0.00 O ATOM 0 H GLY A 17 -39.272 -6.109 26.023 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -42.166 -5.712 25.421 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -41.469 -5.840 27.024 1.00 0.00 H new ATOM 204 N GLY A 18 -41.946 -3.266 26.719 1.00 0.00 N ATOM 205 CA GLY A 18 -41.839 -1.816 26.815 1.00 0.00 C ATOM 206 C GLY A 18 -42.260 -1.150 25.514 1.00 0.00 C ATOM 207 O GLY A 18 -42.385 -1.815 24.482 1.00 0.00 O ATOM 0 H GLY A 18 -42.744 -3.668 27.211 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -42.465 -1.455 27.631 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -40.812 -1.539 27.054 1.00 0.00 H new ATOM 211 N PRO A 19 -42.488 0.143 25.550 1.00 0.00 N ATOM 212 CA PRO A 19 -42.917 0.921 24.357 1.00 0.00 C ATOM 213 C PRO A 19 -41.904 0.807 23.207 1.00 0.00 C ATOM 214 O PRO A 19 -40.787 1.319 23.301 1.00 0.00 O ATOM 215 CB PRO A 19 -43.025 2.371 24.861 1.00 0.00 C ATOM 216 CG PRO A 19 -42.255 2.398 26.140 1.00 0.00 C ATOM 217 CD PRO A 19 -42.362 0.995 26.730 1.00 0.00 C ATOM 0 HA PRO A 19 -43.857 0.551 23.948 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -42.610 3.072 24.137 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -44.065 2.656 25.021 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -41.214 2.667 25.962 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -42.664 3.141 26.825 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -41.482 0.738 27.319 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -43.225 0.900 27.389 1.00 0.00 H new ATOM 225 N PRO A 20 -42.260 0.155 22.125 1.00 0.00 N ATOM 226 CA PRO A 20 -41.351 -0.002 20.951 1.00 0.00 C ATOM 227 C PRO A 20 -40.755 1.332 20.499 1.00 0.00 C ATOM 228 O PRO A 20 -41.478 2.238 20.084 1.00 0.00 O ATOM 229 CB PRO A 20 -42.267 -0.591 19.861 1.00 0.00 C ATOM 230 CG PRO A 20 -43.375 -1.272 20.600 1.00 0.00 C ATOM 231 CD PRO A 20 -43.557 -0.504 21.900 1.00 0.00 C ATOM 0 HA PRO A 20 -40.491 -0.631 21.180 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -42.653 0.191 19.207 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -41.725 -1.295 19.230 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -44.294 -1.267 20.014 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -43.128 -2.315 20.796 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -44.364 0.225 21.821 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -43.811 -1.172 22.723 1.00 0.00 H new ATOM 239 N ALA A 21 -39.433 1.440 20.575 1.00 0.00 N ATOM 240 CA ALA A 21 -38.747 2.662 20.169 1.00 0.00 C ATOM 241 C ALA A 21 -39.476 3.891 20.710 1.00 0.00 C ATOM 242 O ALA A 21 -40.237 4.543 19.988 1.00 0.00 O ATOM 243 CB ALA A 21 -38.673 2.738 18.646 1.00 0.00 C ATOM 0 H ALA A 21 -38.817 0.700 20.912 1.00 0.00 H new ATOM 0 HA ALA A 21 -37.737 2.643 20.579 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -38.159 3.653 18.352 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -38.125 1.876 18.265 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -39.681 2.739 18.232 1.00 0.00 H new ATOM 249 N PRO A 22 -39.275 4.211 21.967 1.00 0.00 N ATOM 250 CA PRO A 22 -39.935 5.371 22.613 1.00 0.00 C ATOM 251 C PRO A 22 -39.239 6.689 22.280 1.00 0.00 C ATOM 252 O PRO A 22 -38.087 6.703 21.837 1.00 0.00 O ATOM 253 CB PRO A 22 -39.840 5.055 24.114 1.00 0.00 C ATOM 254 CG PRO A 22 -38.640 4.163 24.263 1.00 0.00 C ATOM 255 CD PRO A 22 -38.400 3.490 22.900 1.00 0.00 C ATOM 0 HA PRO A 22 -40.961 5.504 22.269 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -39.726 5.967 24.700 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -40.744 4.559 24.468 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -37.767 4.741 24.566 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -38.811 3.414 25.037 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -37.355 3.565 22.600 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -38.647 2.429 22.934 1.00 0.00 H new ATOM 263 N PRO A 23 -39.916 7.796 22.480 1.00 0.00 N ATOM 264 CA PRO A 23 -39.356 9.138 22.194 1.00 0.00 C ATOM 265 C PRO A 23 -37.885 9.257 22.616 1.00 0.00 C ATOM 266 O PRO A 23 -37.422 8.536 23.501 1.00 0.00 O ATOM 267 CB PRO A 23 -40.237 10.082 23.022 1.00 0.00 C ATOM 268 CG PRO A 23 -41.557 9.386 23.159 1.00 0.00 C ATOM 269 CD PRO A 23 -41.292 7.880 22.994 1.00 0.00 C ATOM 0 HA PRO A 23 -39.362 9.363 21.127 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -39.793 10.276 23.998 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -40.352 11.046 22.527 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -42.004 9.594 24.131 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -42.259 9.739 22.404 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -41.393 7.354 23.943 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -42.002 7.427 22.302 1.00 0.00 H new ATOM 277 N PRO A 24 -37.155 10.159 22.010 1.00 0.00 N ATOM 278 CA PRO A 24 -35.717 10.389 22.340 1.00 0.00 C ATOM 279 C PRO A 24 -35.538 10.954 23.750 1.00 0.00 C ATOM 280 O PRO A 24 -34.454 10.878 24.327 1.00 0.00 O ATOM 281 CB PRO A 24 -35.253 11.397 21.270 1.00 0.00 C ATOM 282 CG PRO A 24 -36.502 12.088 20.818 1.00 0.00 C ATOM 283 CD PRO A 24 -37.621 11.060 20.943 1.00 0.00 C ATOM 0 HA PRO A 24 -35.138 9.466 22.333 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -34.536 12.107 21.682 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -34.759 10.892 20.440 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -36.707 12.964 21.433 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -36.405 12.436 19.790 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -38.569 11.531 21.203 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -37.778 10.524 20.007 1.00 0.00 H new ATOM 291 N ASN A 25 -36.608 11.524 24.293 1.00 0.00 N ATOM 292 CA ASN A 25 -36.556 12.105 25.629 1.00 0.00 C ATOM 293 C ASN A 25 -36.370 11.016 26.678 1.00 0.00 C ATOM 294 O ASN A 25 -36.832 9.890 26.502 1.00 0.00 O ATOM 295 CB ASN A 25 -37.844 12.875 25.917 1.00 0.00 C ATOM 296 CG ASN A 25 -37.888 14.152 25.085 1.00 0.00 C ATOM 297 OD1 ASN A 25 -36.855 14.611 24.595 1.00 0.00 O ATOM 298 ND2 ASN A 25 -39.028 14.758 24.894 1.00 0.00 N ATOM 0 H ASN A 25 -37.515 11.596 23.833 1.00 0.00 H new ATOM 0 HA ASN A 25 -35.708 12.788 25.673 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -38.708 12.252 25.687 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -37.901 13.120 26.977 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -39.064 15.613 24.338 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -39.882 14.377 25.300 1.00 0.00 H new ATOM 305 N LEU A 26 -35.687 11.356 27.767 1.00 0.00 N ATOM 306 CA LEU A 26 -35.441 10.396 28.840 1.00 0.00 C ATOM 307 C LEU A 26 -36.607 10.384 29.820 1.00 0.00 C ATOM 308 O LEU A 26 -36.654 9.556 30.729 1.00 0.00 O ATOM 309 CB LEU A 26 -34.154 10.767 29.580 1.00 0.00 C ATOM 310 CG LEU A 26 -32.990 10.842 28.584 1.00 0.00 C ATOM 311 CD1 LEU A 26 -31.719 11.278 29.319 1.00 0.00 C ATOM 312 CD2 LEU A 26 -32.765 9.464 27.932 1.00 0.00 C ATOM 0 H LEU A 26 -35.296 12.284 27.930 1.00 0.00 H new ATOM 0 HA LEU A 26 -35.338 9.403 28.403 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -34.276 11.725 30.084 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -33.939 10.026 30.350 1.00 0.00 H new ATOM 0 HG LEU A 26 -33.229 11.567 27.806 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -30.891 11.332 28.613 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -31.877 12.258 29.769 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -31.484 10.555 30.100 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -31.937 9.526 27.226 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -32.530 8.731 28.703 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -33.669 9.159 27.405 1.00 0.00 H new ATOM 324 N THR A 27 -37.546 11.303 29.627 1.00 0.00 N ATOM 325 CA THR A 27 -38.708 11.387 30.503 1.00 0.00 C ATOM 326 C THR A 27 -39.535 10.108 30.417 1.00 0.00 C ATOM 327 O THR A 27 -39.951 9.557 31.436 1.00 0.00 O ATOM 328 CB THR A 27 -39.573 12.584 30.106 1.00 0.00 C ATOM 329 OG1 THR A 27 -38.751 13.735 29.970 1.00 0.00 O ATOM 330 CG2 THR A 27 -40.628 12.834 31.186 1.00 0.00 C ATOM 0 H THR A 27 -37.526 11.995 28.878 1.00 0.00 H new ATOM 0 HA THR A 27 -38.361 11.514 31.528 1.00 0.00 H new ATOM 0 HB THR A 27 -40.069 12.376 29.158 1.00 0.00 H new ATOM 0 HG1 THR A 27 -39.303 14.503 29.714 1.00 0.00 H new ATOM 0 HG21 THR A 27 -41.244 13.687 30.902 1.00 0.00 H new ATOM 0 HG22 THR A 27 -41.258 11.951 31.291 1.00 0.00 H new ATOM 0 HG23 THR A 27 -40.135 13.042 32.135 1.00 0.00 H new ATOM 338 N SER A 28 -39.770 9.641 29.196 1.00 0.00 N ATOM 339 CA SER A 28 -40.550 8.426 28.989 1.00 0.00 C ATOM 340 C SER A 28 -39.720 7.192 29.331 1.00 0.00 C ATOM 341 O SER A 28 -38.493 7.259 29.403 1.00 0.00 O ATOM 342 CB SER A 28 -41.012 8.342 27.534 1.00 0.00 C ATOM 343 OG SER A 28 -39.895 8.528 26.675 1.00 0.00 O ATOM 0 H SER A 28 -39.434 10.082 28.340 1.00 0.00 H new ATOM 0 HA SER A 28 -41.420 8.460 29.645 1.00 0.00 H new ATOM 0 HB2 SER A 28 -41.475 7.374 27.343 1.00 0.00 H new ATOM 0 HB3 SER A 28 -41.768 9.102 27.336 1.00 0.00 H new ATOM 0 HG SER A 28 -40.188 8.473 25.741 1.00 0.00 H new ATOM 349 N ASN A 29 -40.399 6.069 29.543 1.00 0.00 N ATOM 350 CA ASN A 29 -39.712 4.827 29.875 1.00 0.00 C ATOM 351 C ASN A 29 -38.813 5.019 31.094 1.00 0.00 C ATOM 352 O ASN A 29 -37.644 4.633 31.083 1.00 0.00 O ATOM 353 CB ASN A 29 -38.873 4.355 28.687 1.00 0.00 C ATOM 354 CG ASN A 29 -38.446 2.906 28.893 1.00 0.00 C ATOM 355 OD1 ASN A 29 -38.761 2.304 29.920 1.00 0.00 O ATOM 356 ND2 ASN A 29 -37.745 2.305 27.971 1.00 0.00 N ATOM 0 H ASN A 29 -41.415 5.994 29.491 1.00 0.00 H new ATOM 0 HA ASN A 29 -40.463 4.072 30.108 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -39.449 4.446 27.766 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -37.994 4.990 28.577 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -37.457 1.335 28.100 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -37.485 2.805 27.121 1.00 0.00 H new ATOM 363 N ARG A 30 -39.366 5.623 32.141 1.00 0.00 N ATOM 364 CA ARG A 30 -38.601 5.868 33.360 1.00 0.00 C ATOM 365 C ARG A 30 -38.143 4.547 33.978 1.00 0.00 C ATOM 366 O ARG A 30 -37.236 4.520 34.809 1.00 0.00 O ATOM 367 CB ARG A 30 -39.459 6.642 34.367 1.00 0.00 C ATOM 368 CG ARG A 30 -38.620 6.975 35.604 1.00 0.00 C ATOM 369 CD ARG A 30 -39.421 7.884 36.534 1.00 0.00 C ATOM 370 NE ARG A 30 -39.627 9.185 35.912 1.00 0.00 N ATOM 371 CZ ARG A 30 -40.349 10.127 36.511 1.00 0.00 C ATOM 372 NH1 ARG A 30 -40.886 9.892 37.677 1.00 0.00 N ATOM 373 NH2 ARG A 30 -40.521 11.284 35.934 1.00 0.00 N ATOM 0 H ARG A 30 -40.332 5.949 32.171 1.00 0.00 H new ATOM 0 HA ARG A 30 -37.721 6.459 33.106 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -39.835 7.558 33.912 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -40.328 6.049 34.653 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -38.341 6.059 36.125 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -37.694 7.467 35.307 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -40.383 7.426 36.762 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -38.893 8.005 37.480 1.00 0.00 H new ATOM 0 HE ARG A 30 -39.210 9.377 35.001 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -40.751 8.987 38.127 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -41.440 10.614 38.138 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -40.101 11.467 35.022 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -41.075 12.006 36.394 1.00 0.00 H new ATOM 387 N ARG A 31 -38.769 3.455 33.559 1.00 0.00 N ATOM 388 CA ARG A 31 -38.419 2.141 34.078 1.00 0.00 C ATOM 389 C ARG A 31 -36.933 1.862 33.860 1.00 0.00 C ATOM 390 O ARG A 31 -36.342 1.027 34.542 1.00 0.00 O ATOM 391 CB ARG A 31 -39.252 1.064 33.385 1.00 0.00 C ATOM 392 CG ARG A 31 -40.710 1.174 33.837 1.00 0.00 C ATOM 393 CD ARG A 31 -41.549 0.115 33.119 1.00 0.00 C ATOM 394 NE ARG A 31 -42.947 0.218 33.527 1.00 0.00 N ATOM 395 CZ ARG A 31 -43.391 -0.386 34.625 1.00 0.00 C ATOM 396 NH1 ARG A 31 -42.570 -1.085 35.361 1.00 0.00 N ATOM 397 NH2 ARG A 31 -44.646 -0.280 34.966 1.00 0.00 N ATOM 0 H ARG A 31 -39.517 3.453 32.866 1.00 0.00 H new ATOM 0 HA ARG A 31 -38.629 2.124 35.147 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -39.186 1.179 32.303 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -38.860 0.076 33.625 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -40.778 1.037 34.916 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -41.096 2.169 33.617 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -41.467 0.246 32.040 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -41.168 -0.880 33.350 1.00 0.00 H new ATOM 0 HE ARG A 31 -43.595 0.764 32.959 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -41.589 -1.167 35.093 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -42.909 -1.549 36.204 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -45.287 0.266 34.390 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -44.986 -0.743 35.808 1.00 0.00 H new ATOM 411 N LEU A 32 -36.340 2.564 32.901 1.00 0.00 N ATOM 412 CA LEU A 32 -34.928 2.389 32.598 1.00 0.00 C ATOM 413 C LEU A 32 -34.069 2.789 33.789 1.00 0.00 C ATOM 414 O LEU A 32 -33.064 2.146 34.084 1.00 0.00 O ATOM 415 CB LEU A 32 -34.547 3.231 31.379 1.00 0.00 C ATOM 416 CG LEU A 32 -35.247 2.673 30.133 1.00 0.00 C ATOM 417 CD1 LEU A 32 -35.149 3.699 28.997 1.00 0.00 C ATOM 418 CD2 LEU A 32 -34.590 1.349 29.686 1.00 0.00 C ATOM 0 H LEU A 32 -36.815 3.257 32.323 1.00 0.00 H new ATOM 0 HA LEU A 32 -34.751 1.336 32.379 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -34.836 4.270 31.537 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -33.466 3.218 31.238 1.00 0.00 H new ATOM 0 HG LEU A 32 -36.292 2.479 30.374 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -35.645 3.307 28.109 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -35.632 4.627 29.302 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -34.100 3.893 28.771 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -35.101 0.970 28.801 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -33.540 1.525 29.451 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -34.664 0.616 30.490 1.00 0.00 H new ATOM 430 N GLN A 33 -34.469 3.859 34.463 1.00 0.00 N ATOM 431 CA GLN A 33 -33.725 4.341 35.617 1.00 0.00 C ATOM 432 C GLN A 33 -33.610 3.246 36.671 1.00 0.00 C ATOM 433 O GLN A 33 -32.640 3.199 37.427 1.00 0.00 O ATOM 434 CB GLN A 33 -34.426 5.565 36.219 1.00 0.00 C ATOM 435 CG GLN A 33 -33.567 6.158 37.341 1.00 0.00 C ATOM 436 CD GLN A 33 -32.269 6.711 36.764 1.00 0.00 C ATOM 437 OE1 GLN A 33 -32.291 7.448 35.778 1.00 0.00 O ATOM 438 NE2 GLN A 33 -31.131 6.388 37.315 1.00 0.00 N ATOM 0 H GLN A 33 -35.299 4.406 34.232 1.00 0.00 H new ATOM 0 HA GLN A 33 -32.724 4.623 35.291 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -34.597 6.314 35.446 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -35.403 5.280 36.609 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -34.115 6.950 37.850 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -33.347 5.393 38.086 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -31.115 5.777 38.132 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -30.258 6.746 36.929 1.00 0.00 H new ATOM 447 N GLN A 34 -34.608 2.374 36.721 1.00 0.00 N ATOM 448 CA GLN A 34 -34.610 1.291 37.688 1.00 0.00 C ATOM 449 C GLN A 34 -33.454 0.332 37.425 1.00 0.00 C ATOM 450 O GLN A 34 -32.857 -0.202 38.358 1.00 0.00 O ATOM 451 CB GLN A 34 -35.936 0.527 37.621 1.00 0.00 C ATOM 452 CG GLN A 34 -36.005 -0.502 38.755 1.00 0.00 C ATOM 453 CD GLN A 34 -36.051 0.208 40.103 1.00 0.00 C ATOM 454 OE1 GLN A 34 -35.547 -0.314 41.099 1.00 0.00 O ATOM 455 NE2 GLN A 34 -36.624 1.377 40.197 1.00 0.00 N ATOM 0 H GLN A 34 -35.421 2.397 36.106 1.00 0.00 H new ATOM 0 HA GLN A 34 -34.490 1.721 38.682 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -36.771 1.223 37.699 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -36.028 0.026 36.658 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -36.889 -1.129 38.635 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -35.138 -1.161 38.712 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -37.041 1.808 39.372 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -36.655 1.859 41.095 1.00 0.00 H new ATOM 464 N THR A 35 -33.151 0.103 36.148 1.00 0.00 N ATOM 465 CA THR A 35 -32.076 -0.804 35.788 1.00 0.00 C ATOM 466 C THR A 35 -30.730 -0.092 35.872 1.00 0.00 C ATOM 467 O THR A 35 -30.666 1.126 36.042 1.00 0.00 O ATOM 468 CB THR A 35 -32.301 -1.333 34.359 1.00 0.00 C ATOM 469 OG1 THR A 35 -33.687 -1.262 34.047 1.00 0.00 O ATOM 470 CG2 THR A 35 -31.829 -2.786 34.249 1.00 0.00 C ATOM 0 H THR A 35 -33.632 0.531 35.357 1.00 0.00 H new ATOM 0 HA THR A 35 -32.072 -1.641 36.487 1.00 0.00 H new ATOM 0 HB THR A 35 -31.729 -0.723 33.660 1.00 0.00 H new ATOM 0 HG1 THR A 35 -33.835 -1.596 33.138 1.00 0.00 H new ATOM 0 HG21 THR A 35 -31.994 -3.146 33.234 1.00 0.00 H new ATOM 0 HG22 THR A 35 -30.766 -2.842 34.486 1.00 0.00 H new ATOM 0 HG23 THR A 35 -32.390 -3.405 34.949 1.00 0.00 H new ATOM 478 N GLN A 36 -29.658 -0.863 35.743 1.00 0.00 N ATOM 479 CA GLN A 36 -28.305 -0.314 35.800 1.00 0.00 C ATOM 480 C GLN A 36 -27.778 -0.025 34.396 1.00 0.00 C ATOM 481 O GLN A 36 -26.736 0.611 34.233 1.00 0.00 O ATOM 482 CB GLN A 36 -27.370 -1.289 36.509 1.00 0.00 C ATOM 483 CG GLN A 36 -27.319 -2.608 35.740 1.00 0.00 C ATOM 484 CD GLN A 36 -26.474 -3.622 36.503 1.00 0.00 C ATOM 485 OE1 GLN A 36 -26.471 -3.628 37.734 1.00 0.00 O ATOM 486 NE2 GLN A 36 -25.753 -4.485 35.840 1.00 0.00 N ATOM 0 H GLN A 36 -29.697 -1.872 35.598 1.00 0.00 H new ATOM 0 HA GLN A 36 -28.341 0.621 36.359 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -26.370 -0.861 36.582 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -27.717 -1.464 37.527 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -28.328 -2.996 35.599 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -26.898 -2.444 34.748 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -25.758 -4.477 34.820 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -25.185 -5.167 36.342 1.00 0.00 H new ATOM 495 N ALA A 37 -28.496 -0.512 33.388 1.00 0.00 N ATOM 496 CA ALA A 37 -28.087 -0.310 32.005 1.00 0.00 C ATOM 497 C ALA A 37 -28.110 1.169 31.638 1.00 0.00 C ATOM 498 O ALA A 37 -27.266 1.644 30.877 1.00 0.00 O ATOM 499 CB ALA A 37 -29.014 -1.084 31.065 1.00 0.00 C ATOM 0 H ALA A 37 -29.358 -1.045 33.503 1.00 0.00 H new ATOM 0 HA ALA A 37 -27.067 -0.679 31.898 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -28.700 -0.926 30.033 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -28.966 -2.147 31.301 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -30.037 -0.730 31.191 1.00 0.00 H new ATOM 505 N GLN A 38 -29.087 1.892 32.174 1.00 0.00 N ATOM 506 CA GLN A 38 -29.215 3.315 31.887 1.00 0.00 C ATOM 507 C GLN A 38 -27.971 4.075 32.335 1.00 0.00 C ATOM 508 O GLN A 38 -27.363 4.807 31.554 1.00 0.00 O ATOM 509 CB GLN A 38 -30.441 3.881 32.605 1.00 0.00 C ATOM 510 CG GLN A 38 -30.589 5.366 32.272 1.00 0.00 C ATOM 511 CD GLN A 38 -31.921 5.890 32.799 1.00 0.00 C ATOM 512 OE1 GLN A 38 -32.847 5.111 33.024 1.00 0.00 O ATOM 513 NE2 GLN A 38 -32.073 7.169 33.008 1.00 0.00 N ATOM 0 H GLN A 38 -29.797 1.519 32.805 1.00 0.00 H new ATOM 0 HA GLN A 38 -29.329 3.436 30.810 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -31.336 3.339 32.301 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -30.338 3.748 33.682 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -29.767 5.930 32.714 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -30.533 5.512 31.193 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -31.303 7.811 32.820 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -32.962 7.526 33.359 1.00 0.00 H new ATOM 522 N VAL A 39 -27.596 3.892 33.595 1.00 0.00 N ATOM 523 CA VAL A 39 -26.419 4.563 34.136 1.00 0.00 C ATOM 524 C VAL A 39 -25.147 3.998 33.521 1.00 0.00 C ATOM 525 O VAL A 39 -24.125 4.679 33.450 1.00 0.00 O ATOM 526 CB VAL A 39 -26.372 4.400 35.655 1.00 0.00 C ATOM 527 CG1 VAL A 39 -27.565 5.121 36.284 1.00 0.00 C ATOM 528 CG2 VAL A 39 -26.437 2.914 36.004 1.00 0.00 C ATOM 0 H VAL A 39 -28.085 3.290 34.257 1.00 0.00 H new ATOM 0 HA VAL A 39 -26.487 5.622 33.889 1.00 0.00 H new ATOM 0 HB VAL A 39 -25.446 4.828 36.039 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -27.531 5.004 37.367 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -27.524 6.181 36.032 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -28.492 4.693 35.902 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -26.404 2.793 37.087 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -27.365 2.490 35.620 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -25.589 2.397 35.555 1.00 0.00 H new ATOM 538 N ASP A 40 -25.215 2.748 33.078 1.00 0.00 N ATOM 539 CA ASP A 40 -24.061 2.094 32.468 1.00 0.00 C ATOM 540 C ASP A 40 -23.654 2.810 31.184 1.00 0.00 C ATOM 541 O ASP A 40 -22.473 2.871 30.843 1.00 0.00 O ATOM 542 CB ASP A 40 -24.389 0.633 32.160 1.00 0.00 C ATOM 543 CG ASP A 40 -23.143 -0.086 31.652 1.00 0.00 C ATOM 544 OD1 ASP A 40 -22.147 0.584 31.433 1.00 0.00 O ATOM 545 OD2 ASP A 40 -23.203 -1.293 31.494 1.00 0.00 O ATOM 0 H ASP A 40 -26.053 2.168 33.129 1.00 0.00 H new ATOM 0 HA ASP A 40 -23.230 2.137 33.172 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -24.764 0.139 33.057 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -25.180 0.579 31.412 1.00 0.00 H new ATOM 550 N GLU A 41 -24.641 3.341 30.472 1.00 0.00 N ATOM 551 CA GLU A 41 -24.377 4.046 29.222 1.00 0.00 C ATOM 552 C GLU A 41 -23.302 5.110 29.422 1.00 0.00 C ATOM 553 O GLU A 41 -22.674 5.562 28.465 1.00 0.00 O ATOM 554 CB GLU A 41 -25.663 4.703 28.711 1.00 0.00 C ATOM 555 CG GLU A 41 -25.401 5.347 27.348 1.00 0.00 C ATOM 556 CD GLU A 41 -26.699 5.900 26.774 1.00 0.00 C ATOM 557 OE1 GLU A 41 -27.663 5.987 27.516 1.00 0.00 O ATOM 558 OE2 GLU A 41 -26.710 6.230 25.599 1.00 0.00 O ATOM 0 H GLU A 41 -25.625 3.298 30.736 1.00 0.00 H new ATOM 0 HA GLU A 41 -24.022 3.323 28.487 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -26.455 3.959 28.627 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -26.006 5.456 29.421 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -24.669 6.148 27.450 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -24.976 4.612 26.665 1.00 0.00 H new ATOM 565 N VAL A 42 -23.094 5.507 30.672 1.00 0.00 N ATOM 566 CA VAL A 42 -22.096 6.523 30.979 1.00 0.00 C ATOM 567 C VAL A 42 -20.721 6.089 30.479 1.00 0.00 C ATOM 568 O VAL A 42 -19.876 6.926 30.167 1.00 0.00 O ATOM 569 CB VAL A 42 -22.037 6.751 32.493 1.00 0.00 C ATOM 570 CG1 VAL A 42 -21.472 5.504 33.185 1.00 0.00 C ATOM 571 CG2 VAL A 42 -21.137 7.954 32.792 1.00 0.00 C ATOM 0 H VAL A 42 -23.598 5.145 31.482 1.00 0.00 H new ATOM 0 HA VAL A 42 -22.379 7.449 30.479 1.00 0.00 H new ATOM 0 HB VAL A 42 -23.042 6.944 32.868 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -21.432 5.672 34.261 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -22.114 4.649 32.974 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -20.468 5.304 32.812 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -21.094 8.118 33.869 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -20.133 7.760 32.414 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -21.543 8.841 32.306 1.00 0.00 H new ATOM 581 N VAL A 43 -20.505 4.781 30.403 1.00 0.00 N ATOM 582 CA VAL A 43 -19.223 4.257 29.944 1.00 0.00 C ATOM 583 C VAL A 43 -18.930 4.723 28.523 1.00 0.00 C ATOM 584 O VAL A 43 -17.820 5.151 28.211 1.00 0.00 O ATOM 585 CB VAL A 43 -19.251 2.728 29.976 1.00 0.00 C ATOM 586 CG1 VAL A 43 -20.188 2.190 28.892 1.00 0.00 C ATOM 587 CG2 VAL A 43 -17.835 2.187 29.751 1.00 0.00 C ATOM 0 H VAL A 43 -21.193 4.070 30.650 1.00 0.00 H new ATOM 0 HA VAL A 43 -18.441 4.628 30.606 1.00 0.00 H new ATOM 0 HB VAL A 43 -19.618 2.400 30.949 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -20.197 1.101 28.927 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -21.196 2.567 29.063 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -19.838 2.518 27.913 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -17.854 1.097 29.774 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -17.467 2.523 28.782 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -17.176 2.555 30.537 1.00 0.00 H new ATOM 597 N ASP A 44 -19.938 4.633 27.671 1.00 0.00 N ATOM 598 CA ASP A 44 -19.789 5.045 26.276 1.00 0.00 C ATOM 599 C ASP A 44 -19.458 6.534 26.193 1.00 0.00 C ATOM 600 O ASP A 44 -18.692 6.963 25.332 1.00 0.00 O ATOM 601 CB ASP A 44 -21.075 4.763 25.494 1.00 0.00 C ATOM 602 CG ASP A 44 -20.927 5.243 24.052 1.00 0.00 C ATOM 603 OD1 ASP A 44 -19.815 5.568 23.666 1.00 0.00 O ATOM 604 OD2 ASP A 44 -21.928 5.279 23.354 1.00 0.00 O ATOM 0 H ASP A 44 -20.864 4.281 27.914 1.00 0.00 H new ATOM 0 HA ASP A 44 -18.972 4.472 25.838 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -21.293 3.695 25.510 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -21.917 5.267 25.969 1.00 0.00 H new ATOM 609 N ILE A 45 -20.047 7.314 27.089 1.00 0.00 N ATOM 610 CA ILE A 45 -19.811 8.755 27.112 1.00 0.00 C ATOM 611 C ILE A 45 -18.345 9.053 27.392 1.00 0.00 C ATOM 612 O ILE A 45 -17.750 9.928 26.768 1.00 0.00 O ATOM 613 CB ILE A 45 -20.686 9.412 28.182 1.00 0.00 C ATOM 614 CG1 ILE A 45 -22.146 8.980 27.987 1.00 0.00 C ATOM 615 CG2 ILE A 45 -20.586 10.933 28.069 1.00 0.00 C ATOM 616 CD1 ILE A 45 -22.608 9.279 26.550 1.00 0.00 C ATOM 0 H ILE A 45 -20.689 6.978 27.807 1.00 0.00 H new ATOM 0 HA ILE A 45 -20.070 9.162 26.135 1.00 0.00 H new ATOM 0 HB ILE A 45 -20.342 9.100 29.168 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -22.247 7.915 28.194 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -22.785 9.505 28.697 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -21.211 11.396 28.833 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -19.550 11.241 28.211 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -20.926 11.248 27.082 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -23.645 8.967 26.429 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -22.526 10.349 26.357 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -21.980 8.734 25.845 1.00 0.00 H new ATOM 628 N MET A 46 -17.774 8.329 28.347 1.00 0.00 N ATOM 629 CA MET A 46 -16.376 8.524 28.701 1.00 0.00 C ATOM 630 C MET A 46 -15.470 8.221 27.514 1.00 0.00 C ATOM 631 O MET A 46 -14.480 8.913 27.284 1.00 0.00 O ATOM 632 CB MET A 46 -16.005 7.619 29.877 1.00 0.00 C ATOM 633 CG MET A 46 -16.851 7.991 31.096 1.00 0.00 C ATOM 634 SD MET A 46 -16.400 9.648 31.672 1.00 0.00 S ATOM 635 CE MET A 46 -14.979 9.171 32.689 1.00 0.00 C ATOM 0 H MET A 46 -18.254 7.608 28.885 1.00 0.00 H new ATOM 0 HA MET A 46 -16.237 9.567 28.987 1.00 0.00 H new ATOM 0 HB2 MET A 46 -16.170 6.575 29.612 1.00 0.00 H new ATOM 0 HB3 MET A 46 -14.946 7.725 30.111 1.00 0.00 H new ATOM 0 HG2 MET A 46 -17.910 7.961 30.838 1.00 0.00 H new ATOM 0 HG3 MET A 46 -16.696 7.264 31.893 1.00 0.00 H new ATOM 0 HE1 MET A 46 -14.620 10.039 33.243 1.00 0.00 H new ATOM 0 HE2 MET A 46 -15.278 8.392 33.390 1.00 0.00 H new ATOM 0 HE3 MET A 46 -14.182 8.795 32.047 1.00 0.00 H new ATOM 645 N ARG A 47 -15.816 7.182 26.762 1.00 0.00 N ATOM 646 CA ARG A 47 -15.020 6.795 25.602 1.00 0.00 C ATOM 647 C ARG A 47 -14.978 7.926 24.580 1.00 0.00 C ATOM 648 O ARG A 47 -13.936 8.202 23.986 1.00 0.00 O ATOM 649 CB ARG A 47 -15.619 5.545 24.954 1.00 0.00 C ATOM 650 CG ARG A 47 -15.376 4.333 25.858 1.00 0.00 C ATOM 651 CD ARG A 47 -16.039 3.099 25.243 1.00 0.00 C ATOM 652 NE ARG A 47 -15.407 2.771 23.969 1.00 0.00 N ATOM 653 CZ ARG A 47 -15.920 1.846 23.166 1.00 0.00 C ATOM 654 NH1 ARG A 47 -17.007 1.212 23.512 1.00 0.00 N ATOM 655 NH2 ARG A 47 -15.336 1.569 22.030 1.00 0.00 N ATOM 0 H ARG A 47 -16.634 6.597 26.932 1.00 0.00 H new ATOM 0 HA ARG A 47 -14.004 6.583 25.936 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -16.688 5.683 24.793 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -15.168 5.378 23.976 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -14.306 4.163 25.977 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -15.782 4.520 26.852 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -15.957 2.254 25.927 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -17.102 3.285 25.093 1.00 0.00 H new ATOM 0 HE ARG A 47 -14.557 3.261 23.691 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -17.462 1.427 24.399 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -17.401 0.502 22.895 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -14.486 2.063 21.760 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -15.731 0.858 21.414 1.00 0.00 H new ATOM 669 N VAL A 48 -16.119 8.579 24.379 1.00 0.00 N ATOM 670 CA VAL A 48 -16.201 9.678 23.429 1.00 0.00 C ATOM 671 C VAL A 48 -15.314 10.837 23.873 1.00 0.00 C ATOM 672 O VAL A 48 -14.622 11.448 23.060 1.00 0.00 O ATOM 673 CB VAL A 48 -17.652 10.153 23.299 1.00 0.00 C ATOM 674 CG1 VAL A 48 -17.716 11.373 22.375 1.00 0.00 C ATOM 675 CG2 VAL A 48 -18.505 9.026 22.709 1.00 0.00 C ATOM 0 H VAL A 48 -16.993 8.366 24.859 1.00 0.00 H new ATOM 0 HA VAL A 48 -15.852 9.323 22.459 1.00 0.00 H new ATOM 0 HB VAL A 48 -18.032 10.425 24.284 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -18.749 11.708 22.285 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -17.109 12.177 22.791 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -17.335 11.104 21.390 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -19.538 9.362 22.616 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -18.121 8.756 21.725 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -18.464 8.157 23.366 1.00 0.00 H new ATOM 685 N ASN A 49 -15.346 11.140 25.167 1.00 0.00 N ATOM 686 CA ASN A 49 -14.544 12.233 25.704 1.00 0.00 C ATOM 687 C ASN A 49 -13.064 11.983 25.438 1.00 0.00 C ATOM 688 O ASN A 49 -12.321 12.901 25.090 1.00 0.00 O ATOM 689 CB ASN A 49 -14.786 12.363 27.210 1.00 0.00 C ATOM 690 CG ASN A 49 -13.929 13.488 27.777 1.00 0.00 C ATOM 691 OD1 ASN A 49 -13.516 14.385 27.042 1.00 0.00 O ATOM 692 ND2 ASN A 49 -13.638 13.496 29.049 1.00 0.00 N ATOM 0 H ASN A 49 -15.913 10.649 25.858 1.00 0.00 H new ATOM 0 HA ASN A 49 -14.838 13.160 25.211 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -15.840 12.565 27.402 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -14.545 11.424 27.708 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -13.067 14.247 29.437 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -13.982 12.751 29.655 1.00 0.00 H new ATOM 699 N VAL A 50 -12.646 10.733 25.593 1.00 0.00 N ATOM 700 CA VAL A 50 -11.256 10.365 25.358 1.00 0.00 C ATOM 701 C VAL A 50 -10.881 10.582 23.900 1.00 0.00 C ATOM 702 O VAL A 50 -9.778 11.029 23.588 1.00 0.00 O ATOM 703 CB VAL A 50 -11.020 8.901 25.742 1.00 0.00 C ATOM 704 CG1 VAL A 50 -9.588 8.497 25.379 1.00 0.00 C ATOM 705 CG2 VAL A 50 -11.229 8.726 27.248 1.00 0.00 C ATOM 0 H VAL A 50 -13.247 9.960 25.879 1.00 0.00 H new ATOM 0 HA VAL A 50 -10.627 11.002 25.979 1.00 0.00 H new ATOM 0 HB VAL A 50 -11.724 8.270 25.200 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -9.423 7.455 25.653 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -9.437 8.618 24.306 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -8.884 9.130 25.919 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -11.061 7.684 27.520 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -10.527 9.360 27.789 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -12.249 9.009 27.509 1.00 0.00 H new ATOM 715 N ASP A 51 -11.800 10.249 23.018 1.00 0.00 N ATOM 716 CA ASP A 51 -11.564 10.396 21.584 1.00 0.00 C ATOM 717 C ASP A 51 -11.277 11.852 21.231 1.00 0.00 C ATOM 718 O ASP A 51 -10.425 12.137 20.392 1.00 0.00 O ATOM 719 CB ASP A 51 -12.780 9.907 20.791 1.00 0.00 C ATOM 720 CG ASP A 51 -12.869 8.387 20.854 1.00 0.00 C ATOM 721 OD1 ASP A 51 -11.920 7.775 21.316 1.00 0.00 O ATOM 722 OD2 ASP A 51 -13.887 7.855 20.442 1.00 0.00 O ATOM 0 H ASP A 51 -12.717 9.875 23.261 1.00 0.00 H new ATOM 0 HA ASP A 51 -10.696 9.791 21.321 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -13.690 10.350 21.196 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -12.702 10.232 19.753 1.00 0.00 H new ATOM 727 N LYS A 52 -11.985 12.767 21.881 1.00 0.00 N ATOM 728 CA LYS A 52 -11.795 14.191 21.638 1.00 0.00 C ATOM 729 C LYS A 52 -10.392 14.618 22.049 1.00 0.00 C ATOM 730 O LYS A 52 -9.788 15.492 21.426 1.00 0.00 O ATOM 731 CB LYS A 52 -12.835 14.998 22.413 1.00 0.00 C ATOM 732 CG LYS A 52 -14.217 14.782 21.794 1.00 0.00 C ATOM 733 CD LYS A 52 -15.257 15.585 22.578 1.00 0.00 C ATOM 734 CE LYS A 52 -16.634 15.400 21.938 1.00 0.00 C ATOM 735 NZ LYS A 52 -17.648 16.177 22.708 1.00 0.00 N ATOM 0 H LYS A 52 -12.695 12.549 22.580 1.00 0.00 H new ATOM 0 HA LYS A 52 -11.919 14.381 20.572 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -12.842 14.692 23.459 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -12.578 16.057 22.392 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -14.212 15.094 20.750 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -14.473 13.723 21.809 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -15.280 15.255 23.616 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -14.987 16.641 22.585 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -16.613 15.736 20.901 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -16.902 14.344 21.926 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -18.585 16.052 22.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -17.674 15.836 23.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -17.394 17.185 22.698 1.00 0.00 H new ATOM 749 N VAL A 53 -9.885 14.008 23.110 1.00 0.00 N ATOM 750 CA VAL A 53 -8.557 14.335 23.605 1.00 0.00 C ATOM 751 C VAL A 53 -7.496 13.991 22.565 1.00 0.00 C ATOM 752 O VAL A 53 -6.530 14.732 22.378 1.00 0.00 O ATOM 753 CB VAL A 53 -8.271 13.576 24.902 1.00 0.00 C ATOM 754 CG1 VAL A 53 -6.852 13.892 25.381 1.00 0.00 C ATOM 755 CG2 VAL A 53 -9.278 14.001 25.971 1.00 0.00 C ATOM 0 H VAL A 53 -10.371 13.287 23.643 1.00 0.00 H new ATOM 0 HA VAL A 53 -8.523 15.406 23.802 1.00 0.00 H new ATOM 0 HB VAL A 53 -8.360 12.505 24.722 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -6.651 13.350 26.305 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -6.135 13.588 24.619 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -6.759 14.963 25.561 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -9.076 13.461 26.896 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -9.189 15.073 26.149 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -10.288 13.773 25.631 1.00 0.00 H new ATOM 765 N LEU A 54 -7.672 12.852 21.905 1.00 0.00 N ATOM 766 CA LEU A 54 -6.717 12.406 20.896 1.00 0.00 C ATOM 767 C LEU A 54 -6.821 13.256 19.637 1.00 0.00 C ATOM 768 O LEU A 54 -6.016 13.120 18.721 1.00 0.00 O ATOM 769 CB LEU A 54 -6.981 10.942 20.545 1.00 0.00 C ATOM 770 CG LEU A 54 -6.954 10.097 21.823 1.00 0.00 C ATOM 771 CD1 LEU A 54 -7.287 8.642 21.479 1.00 0.00 C ATOM 772 CD2 LEU A 54 -5.559 10.169 22.474 1.00 0.00 C ATOM 0 H LEU A 54 -8.462 12.223 22.049 1.00 0.00 H new ATOM 0 HA LEU A 54 -5.712 12.511 21.305 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -7.948 10.844 20.052 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -6.228 10.584 19.843 1.00 0.00 H new ATOM 0 HG LEU A 54 -7.693 10.485 22.524 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -7.268 8.040 22.387 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -8.279 8.592 21.031 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -6.551 8.257 20.773 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -5.549 9.565 23.382 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -4.812 9.788 21.777 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -5.327 11.204 22.724 1.00 0.00 H new ATOM 784 N GLU A 55 -7.816 14.134 19.600 1.00 0.00 N ATOM 785 CA GLU A 55 -8.013 15.015 18.447 1.00 0.00 C ATOM 786 C GLU A 55 -7.356 16.369 18.686 1.00 0.00 C ATOM 787 O GLU A 55 -6.179 16.562 18.375 1.00 0.00 O ATOM 788 CB GLU A 55 -9.506 15.206 18.185 1.00 0.00 C ATOM 789 CG GLU A 55 -10.104 13.904 17.656 1.00 0.00 C ATOM 790 CD GLU A 55 -11.614 14.046 17.505 1.00 0.00 C ATOM 791 OE1 GLU A 55 -12.122 15.109 17.820 1.00 0.00 O ATOM 792 OE2 GLU A 55 -12.240 13.092 17.075 1.00 0.00 O ATOM 0 H GLU A 55 -8.498 14.258 20.349 1.00 0.00 H new ATOM 0 HA GLU A 55 -7.549 14.551 17.576 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -10.012 15.503 19.104 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -9.659 16.008 17.463 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -9.656 13.653 16.694 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -9.874 13.085 18.338 1.00 0.00 H new ATOM 799 N ARG A 56 -8.122 17.306 19.235 1.00 0.00 N ATOM 800 CA ARG A 56 -7.604 18.641 19.506 1.00 0.00 C ATOM 801 C ARG A 56 -6.368 18.573 20.397 1.00 0.00 C ATOM 802 O ARG A 56 -5.267 18.290 19.926 1.00 0.00 O ATOM 803 CB ARG A 56 -8.679 19.490 20.186 1.00 0.00 C ATOM 804 CG ARG A 56 -9.776 19.833 19.175 1.00 0.00 C ATOM 805 CD ARG A 56 -10.856 20.672 19.859 1.00 0.00 C ATOM 806 NE ARG A 56 -11.552 19.878 20.865 1.00 0.00 N ATOM 807 CZ ARG A 56 -12.544 19.059 20.527 1.00 0.00 C ATOM 808 NH1 ARG A 56 -12.909 18.957 19.280 1.00 0.00 N ATOM 809 NH2 ARG A 56 -13.152 18.360 21.445 1.00 0.00 N ATOM 0 H ARG A 56 -9.097 17.167 19.499 1.00 0.00 H new ATOM 0 HA ARG A 56 -7.325 19.098 18.557 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -9.105 18.948 21.030 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -8.238 20.404 20.584 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -9.352 20.382 18.334 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -10.212 18.919 18.771 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -10.405 21.548 20.325 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -11.567 21.036 19.118 1.00 0.00 H new ATOM 0 HE ARG A 56 -11.274 19.952 21.843 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -12.434 19.505 18.563 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -13.670 18.329 19.021 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -12.867 18.442 22.421 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -13.913 17.732 21.187 1.00 0.00 H new ATOM 823 N ASP A 57 -6.559 18.832 21.686 1.00 0.00 N ATOM 824 CA ASP A 57 -5.449 18.798 22.633 1.00 0.00 C ATOM 825 C ASP A 57 -5.109 17.358 23.003 1.00 0.00 C ATOM 826 O ASP A 57 -5.916 16.657 23.611 1.00 0.00 O ATOM 827 CB ASP A 57 -5.819 19.576 23.897 1.00 0.00 C ATOM 828 CG ASP A 57 -4.592 19.736 24.786 1.00 0.00 C ATOM 829 OD1 ASP A 57 -3.541 20.051 24.257 1.00 0.00 O ATOM 830 OD2 ASP A 57 -4.721 19.536 25.983 1.00 0.00 O ATOM 0 H ASP A 57 -7.463 19.066 22.097 1.00 0.00 H new ATOM 0 HA ASP A 57 -4.579 19.258 22.164 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -6.215 20.556 23.629 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -6.606 19.052 24.440 1.00 0.00 H new ATOM 835 N GLN A 58 -3.911 16.922 22.625 1.00 0.00 N ATOM 836 CA GLN A 58 -3.477 15.563 22.915 1.00 0.00 C ATOM 837 C GLN A 58 -3.395 15.334 24.420 1.00 0.00 C ATOM 838 O GLN A 58 -3.871 14.320 24.929 1.00 0.00 O ATOM 839 CB GLN A 58 -2.104 15.312 22.285 1.00 0.00 C ATOM 840 CG GLN A 58 -2.205 15.436 20.763 1.00 0.00 C ATOM 841 CD GLN A 58 -3.089 14.327 20.206 1.00 0.00 C ATOM 842 OE1 GLN A 58 -2.876 13.152 20.504 1.00 0.00 O ATOM 843 NE2 GLN A 58 -4.075 14.631 19.409 1.00 0.00 N ATOM 0 H GLN A 58 -3.228 17.488 22.120 1.00 0.00 H new ATOM 0 HA GLN A 58 -4.206 14.871 22.494 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -1.379 16.029 22.671 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -1.745 14.319 22.556 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -2.617 16.409 20.496 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -1.211 15.378 20.319 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -4.250 15.605 19.163 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -4.671 13.895 19.031 1.00 0.00 H new ATOM 852 N LYS A 59 -2.796 16.285 25.127 1.00 0.00 N ATOM 853 CA LYS A 59 -2.661 16.180 26.574 1.00 0.00 C ATOM 854 C LYS A 59 -2.109 17.478 27.156 1.00 0.00 C ATOM 855 O LYS A 59 -2.860 18.410 27.442 1.00 0.00 O ATOM 856 CB LYS A 59 -1.738 15.010 26.931 1.00 0.00 C ATOM 857 CG LYS A 59 -1.685 14.849 28.453 1.00 0.00 C ATOM 858 CD LYS A 59 -0.807 13.651 28.809 1.00 0.00 C ATOM 859 CE LYS A 59 -0.767 13.478 30.329 1.00 0.00 C ATOM 860 NZ LYS A 59 -2.038 12.850 30.788 1.00 0.00 N ATOM 0 H LYS A 59 -2.398 17.133 24.724 1.00 0.00 H new ATOM 0 HA LYS A 59 -3.647 16.000 27.002 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -2.102 14.092 26.470 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -0.737 15.189 26.538 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -1.287 15.754 28.911 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -2.690 14.707 28.849 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -1.199 12.748 28.340 1.00 0.00 H new ATOM 0 HD3 LYS A 59 0.202 13.799 28.423 1.00 0.00 H new ATOM 0 HE2 LYS A 59 0.082 12.857 30.613 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -0.631 14.445 30.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -1.955 12.592 31.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -2.821 13.523 30.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -2.226 11.996 30.225 1.00 0.00 H new ATOM 874 N LEU A 60 -0.791 17.530 27.335 1.00 0.00 N ATOM 875 CA LEU A 60 -0.149 18.707 27.886 1.00 0.00 C ATOM 876 C LEU A 60 -0.346 19.902 26.966 1.00 0.00 C ATOM 877 O LEU A 60 -0.607 21.011 27.424 1.00 0.00 O ATOM 878 CB LEU A 60 1.348 18.443 28.069 1.00 0.00 C ATOM 879 CG LEU A 60 1.556 17.376 29.156 1.00 0.00 C ATOM 880 CD1 LEU A 60 3.031 16.962 29.190 1.00 0.00 C ATOM 881 CD2 LEU A 60 1.136 17.925 30.541 1.00 0.00 C ATOM 0 H LEU A 60 -0.153 16.768 27.105 1.00 0.00 H new ATOM 0 HA LEU A 60 -0.602 18.929 28.852 1.00 0.00 H new ATOM 0 HB2 LEU A 60 1.786 18.108 27.129 1.00 0.00 H new ATOM 0 HB3 LEU A 60 1.858 19.365 28.348 1.00 0.00 H new ATOM 0 HG LEU A 60 0.937 16.510 28.922 1.00 0.00 H new ATOM 0 HD11 LEU A 60 3.179 16.205 29.961 1.00 0.00 H new ATOM 0 HD12 LEU A 60 3.317 16.553 28.221 1.00 0.00 H new ATOM 0 HD13 LEU A 60 3.648 17.832 29.413 1.00 0.00 H new ATOM 0 HD21 LEU A 60 1.290 17.157 31.299 1.00 0.00 H new ATOM 0 HD22 LEU A 60 1.739 18.800 30.784 1.00 0.00 H new ATOM 0 HD23 LEU A 60 0.083 18.205 30.517 1.00 0.00 H new ATOM 893 N SER A 61 -0.219 19.665 25.664 1.00 0.00 N ATOM 894 CA SER A 61 -0.386 20.731 24.686 1.00 0.00 C ATOM 895 C SER A 61 0.070 20.267 23.305 1.00 0.00 C ATOM 896 O SER A 61 -0.753 19.930 22.453 1.00 0.00 O ATOM 897 CB SER A 61 0.426 21.961 25.112 1.00 0.00 C ATOM 898 OG SER A 61 0.865 22.660 23.954 1.00 0.00 O ATOM 0 H SER A 61 -0.003 18.751 25.265 1.00 0.00 H new ATOM 0 HA SER A 61 -1.443 20.994 24.636 1.00 0.00 H new ATOM 0 HB2 SER A 61 -0.183 22.615 25.736 1.00 0.00 H new ATOM 0 HB3 SER A 61 1.283 21.655 25.712 1.00 0.00 H new ATOM 0 HG SER A 61 1.383 23.447 24.224 1.00 0.00 H new ATOM 904 N GLU A 62 1.382 20.253 23.093 1.00 0.00 N ATOM 905 CA GLU A 62 1.934 19.833 21.817 1.00 0.00 C ATOM 906 C GLU A 62 3.430 19.548 21.949 1.00 0.00 C ATOM 907 O GLU A 62 3.829 18.461 22.365 1.00 0.00 O ATOM 908 CB GLU A 62 1.694 20.919 20.760 1.00 0.00 C ATOM 909 CG GLU A 62 2.149 20.415 19.385 1.00 0.00 C ATOM 910 CD GLU A 62 1.205 19.323 18.898 1.00 0.00 C ATOM 911 OE1 GLU A 62 0.180 19.126 19.530 1.00 0.00 O ATOM 912 OE2 GLU A 62 1.524 18.694 17.902 1.00 0.00 O ATOM 0 H GLU A 62 2.077 20.527 23.787 1.00 0.00 H new ATOM 0 HA GLU A 62 1.434 18.916 21.505 1.00 0.00 H new ATOM 0 HB2 GLU A 62 0.637 21.182 20.729 1.00 0.00 H new ATOM 0 HB3 GLU A 62 2.240 21.824 21.025 1.00 0.00 H new ATOM 0 HG2 GLU A 62 2.165 21.239 18.672 1.00 0.00 H new ATOM 0 HG3 GLU A 62 3.166 20.028 19.447 1.00 0.00 H new ATOM 919 N LEU A 63 4.252 20.530 21.586 1.00 0.00 N ATOM 920 CA LEU A 63 5.693 20.374 21.658 1.00 0.00 C ATOM 921 C LEU A 63 6.134 20.157 23.098 1.00 0.00 C ATOM 922 O LEU A 63 7.019 19.348 23.367 1.00 0.00 O ATOM 923 CB LEU A 63 6.378 21.622 21.091 1.00 0.00 C ATOM 924 CG LEU A 63 5.821 21.930 19.697 1.00 0.00 C ATOM 925 CD1 LEU A 63 6.473 23.208 19.157 1.00 0.00 C ATOM 926 CD2 LEU A 63 6.125 20.760 18.744 1.00 0.00 C ATOM 0 H LEU A 63 3.941 21.438 21.241 1.00 0.00 H new ATOM 0 HA LEU A 63 5.979 19.503 21.069 1.00 0.00 H new ATOM 0 HB2 LEU A 63 6.214 22.471 21.754 1.00 0.00 H new ATOM 0 HB3 LEU A 63 7.455 21.464 21.036 1.00 0.00 H new ATOM 0 HG LEU A 63 4.742 22.069 19.764 1.00 0.00 H new ATOM 0 HD11 LEU A 63 6.077 23.427 18.165 1.00 0.00 H new ATOM 0 HD12 LEU A 63 6.254 24.039 19.827 1.00 0.00 H new ATOM 0 HD13 LEU A 63 7.552 23.067 19.094 1.00 0.00 H new ATOM 0 HD21 LEU A 63 5.727 20.984 17.754 1.00 0.00 H new ATOM 0 HD22 LEU A 63 7.203 20.616 18.677 1.00 0.00 H new ATOM 0 HD23 LEU A 63 5.660 19.850 19.125 1.00 0.00 H new ATOM 938 N ASP A 64 5.509 20.881 24.019 1.00 0.00 N ATOM 939 CA ASP A 64 5.843 20.763 25.429 1.00 0.00 C ATOM 940 C ASP A 64 7.316 21.075 25.660 1.00 0.00 C ATOM 941 O ASP A 64 7.818 20.970 26.779 1.00 0.00 O ATOM 942 CB ASP A 64 5.537 19.353 25.910 1.00 0.00 C ATOM 943 CG ASP A 64 5.593 19.295 27.434 1.00 0.00 C ATOM 944 OD1 ASP A 64 5.550 20.348 28.049 1.00 0.00 O ATOM 945 OD2 ASP A 64 5.679 18.200 27.967 1.00 0.00 O ATOM 0 H ASP A 64 4.770 21.554 23.813 1.00 0.00 H new ATOM 0 HA ASP A 64 5.244 21.480 25.990 1.00 0.00 H new ATOM 0 HB2 ASP A 64 4.550 19.048 25.563 1.00 0.00 H new ATOM 0 HB3 ASP A 64 6.255 18.652 25.485 1.00 0.00 H new ATOM 950 N ASP A 65 8.003 21.461 24.592 1.00 0.00 N ATOM 951 CA ASP A 65 9.422 21.789 24.682 1.00 0.00 C ATOM 952 C ASP A 65 10.196 20.650 25.332 1.00 0.00 C ATOM 953 O ASP A 65 11.354 20.813 25.708 1.00 0.00 O ATOM 954 CB ASP A 65 9.610 23.065 25.505 1.00 0.00 C ATOM 955 CG ASP A 65 9.093 24.268 24.724 1.00 0.00 C ATOM 956 OD1 ASP A 65 8.899 24.134 23.527 1.00 0.00 O ATOM 957 OD2 ASP A 65 8.899 25.306 25.334 1.00 0.00 O ATOM 0 H ASP A 65 7.604 21.555 23.658 1.00 0.00 H new ATOM 0 HA ASP A 65 9.803 21.944 23.673 1.00 0.00 H new ATOM 0 HB2 ASP A 65 9.077 22.979 26.452 1.00 0.00 H new ATOM 0 HB3 ASP A 65 10.665 23.202 25.744 1.00 0.00 H new ATOM 962 N ARG A 66 9.545 19.494 25.458 1.00 0.00 N ATOM 963 CA ARG A 66 10.173 18.320 26.067 1.00 0.00 C ATOM 964 C ARG A 66 9.943 17.083 25.214 1.00 0.00 C ATOM 965 O ARG A 66 9.445 17.175 24.093 1.00 0.00 O ATOM 966 CB ARG A 66 9.598 18.094 27.468 1.00 0.00 C ATOM 967 CG ARG A 66 10.101 19.187 28.429 1.00 0.00 C ATOM 968 CD ARG A 66 11.492 18.820 28.967 1.00 0.00 C ATOM 969 NE ARG A 66 11.917 19.796 29.959 1.00 0.00 N ATOM 970 CZ ARG A 66 12.577 20.894 29.608 1.00 0.00 C ATOM 971 NH1 ARG A 66 12.850 21.120 28.350 1.00 0.00 N ATOM 972 NH2 ARG A 66 12.953 21.744 30.520 1.00 0.00 N ATOM 0 H ARG A 66 8.585 19.345 25.147 1.00 0.00 H new ATOM 0 HA ARG A 66 11.246 18.499 26.137 1.00 0.00 H new ATOM 0 HB2 ARG A 66 8.509 18.106 27.429 1.00 0.00 H new ATOM 0 HB3 ARG A 66 9.893 17.111 27.836 1.00 0.00 H new ATOM 0 HG2 ARG A 66 10.144 20.145 27.911 1.00 0.00 H new ATOM 0 HG3 ARG A 66 9.402 19.304 29.257 1.00 0.00 H new ATOM 0 HD2 ARG A 66 11.468 17.825 29.411 1.00 0.00 H new ATOM 0 HD3 ARG A 66 12.210 18.786 28.148 1.00 0.00 H new ATOM 0 HE ARG A 66 11.704 19.634 30.943 1.00 0.00 H new ATOM 0 HH11 ARG A 66 12.556 20.453 27.637 1.00 0.00 H new ATOM 0 HH12 ARG A 66 13.357 21.964 28.082 1.00 0.00 H new ATOM 0 HH21 ARG A 66 12.741 21.566 31.502 1.00 0.00 H new ATOM 0 HH22 ARG A 66 13.460 22.588 30.253 1.00 0.00 H new ATOM 986 N ALA A 67 10.322 15.930 25.750 1.00 0.00 N ATOM 987 CA ALA A 67 10.162 14.676 25.026 1.00 0.00 C ATOM 988 C ALA A 67 11.003 14.681 23.754 1.00 0.00 C ATOM 989 O ALA A 67 10.841 15.547 22.894 1.00 0.00 O ATOM 990 CB ALA A 67 8.689 14.468 24.671 1.00 0.00 C ATOM 0 H ALA A 67 10.739 15.837 26.676 1.00 0.00 H new ATOM 0 HA ALA A 67 10.500 13.860 25.664 1.00 0.00 H new ATOM 0 HB1 ALA A 67 8.574 13.529 24.130 1.00 0.00 H new ATOM 0 HB2 ALA A 67 8.096 14.435 25.585 1.00 0.00 H new ATOM 0 HB3 ALA A 67 8.346 15.292 24.045 1.00 0.00 H new ATOM 996 N ASP A 68 11.901 13.710 23.641 1.00 0.00 N ATOM 997 CA ASP A 68 12.761 13.610 22.472 1.00 0.00 C ATOM 998 C ASP A 68 11.933 13.382 21.214 1.00 0.00 C ATOM 999 O ASP A 68 12.212 13.961 20.166 1.00 0.00 O ATOM 1000 CB ASP A 68 13.753 12.459 22.646 1.00 0.00 C ATOM 1001 CG ASP A 68 14.814 12.836 23.674 1.00 0.00 C ATOM 1002 OD1 ASP A 68 14.834 13.986 24.081 1.00 0.00 O ATOM 1003 OD2 ASP A 68 15.590 11.969 24.040 1.00 0.00 O ATOM 0 H ASP A 68 12.051 12.984 24.342 1.00 0.00 H new ATOM 0 HA ASP A 68 13.308 14.547 22.369 1.00 0.00 H new ATOM 0 HB2 ASP A 68 13.227 11.560 22.967 1.00 0.00 H new ATOM 0 HB3 ASP A 68 14.226 12.228 21.691 1.00 0.00 H new ATOM 1008 N ALA A 69 10.912 12.535 21.327 1.00 0.00 N ATOM 1009 CA ALA A 69 10.045 12.236 20.190 1.00 0.00 C ATOM 1010 C ALA A 69 10.750 11.294 19.216 1.00 0.00 C ATOM 1011 O ALA A 69 10.108 10.505 18.522 1.00 0.00 O ATOM 1012 CB ALA A 69 9.648 13.538 19.473 1.00 0.00 C ATOM 0 H ALA A 69 10.666 12.047 22.188 1.00 0.00 H new ATOM 0 HA ALA A 69 9.144 11.745 20.558 1.00 0.00 H new ATOM 0 HB1 ALA A 69 9.002 13.305 18.627 1.00 0.00 H new ATOM 0 HB2 ALA A 69 9.116 14.188 20.168 1.00 0.00 H new ATOM 0 HB3 ALA A 69 10.545 14.045 19.116 1.00 0.00 H new ATOM 1018 N LEU A 70 12.073 11.389 19.170 1.00 0.00 N ATOM 1019 CA LEU A 70 12.858 10.548 18.275 1.00 0.00 C ATOM 1020 C LEU A 70 12.697 9.082 18.638 1.00 0.00 C ATOM 1021 O LEU A 70 12.607 8.223 17.764 1.00 0.00 O ATOM 1022 CB LEU A 70 14.335 10.941 18.350 1.00 0.00 C ATOM 1023 CG LEU A 70 14.481 12.449 18.121 1.00 0.00 C ATOM 1024 CD1 LEU A 70 15.955 12.845 18.248 1.00 0.00 C ATOM 1025 CD2 LEU A 70 13.970 12.816 16.715 1.00 0.00 C ATOM 0 H LEU A 70 12.622 12.035 19.737 1.00 0.00 H new ATOM 0 HA LEU A 70 12.496 10.696 17.257 1.00 0.00 H new ATOM 0 HB2 LEU A 70 14.744 10.670 19.323 1.00 0.00 H new ATOM 0 HB3 LEU A 70 14.906 10.393 17.600 1.00 0.00 H new ATOM 0 HG LEU A 70 13.894 12.984 18.867 1.00 0.00 H new ATOM 0 HD11 LEU A 70 16.059 13.918 18.085 1.00 0.00 H new ATOM 0 HD12 LEU A 70 16.315 12.593 19.246 1.00 0.00 H new ATOM 0 HD13 LEU A 70 16.542 12.307 17.504 1.00 0.00 H new ATOM 0 HD21 LEU A 70 14.076 13.889 16.558 1.00 0.00 H new ATOM 0 HD22 LEU A 70 14.552 12.280 15.965 1.00 0.00 H new ATOM 0 HD23 LEU A 70 12.920 12.539 16.626 1.00 0.00 H new ATOM 1037 N GLN A 71 12.662 8.807 19.931 1.00 0.00 N ATOM 1038 CA GLN A 71 12.510 7.436 20.411 1.00 0.00 C ATOM 1039 C GLN A 71 13.381 6.485 19.594 1.00 0.00 C ATOM 1040 O GLN A 71 14.570 6.324 19.874 1.00 0.00 O ATOM 1041 CB GLN A 71 11.044 7.006 20.308 1.00 0.00 C ATOM 1042 CG GLN A 71 10.191 7.843 21.262 1.00 0.00 C ATOM 1043 CD GLN A 71 10.555 7.525 22.707 1.00 0.00 C ATOM 1044 OE1 GLN A 71 10.577 6.358 23.100 1.00 0.00 O ATOM 1045 NE2 GLN A 71 10.845 8.496 23.529 1.00 0.00 N ATOM 0 H GLN A 71 12.736 9.509 20.668 1.00 0.00 H new ATOM 0 HA GLN A 71 12.827 7.397 21.453 1.00 0.00 H new ATOM 0 HB2 GLN A 71 10.690 7.130 19.285 1.00 0.00 H new ATOM 0 HB3 GLN A 71 10.948 5.948 20.552 1.00 0.00 H new ATOM 0 HG2 GLN A 71 10.346 8.904 21.065 1.00 0.00 H new ATOM 0 HG3 GLN A 71 9.134 7.638 21.092 1.00 0.00 H new ATOM 0 HE21 GLN A 71 10.827 9.462 23.203 1.00 0.00 H new ATOM 0 HE22 GLN A 71 11.090 8.289 24.497 1.00 0.00 H new ATOM 1054 N ALA A 72 12.784 5.863 18.581 1.00 0.00 N ATOM 1055 CA ALA A 72 13.520 4.938 17.732 1.00 0.00 C ATOM 1056 C ALA A 72 14.425 5.702 16.769 1.00 0.00 C ATOM 1057 O ALA A 72 13.973 6.598 16.057 1.00 0.00 O ATOM 1058 CB ALA A 72 12.540 4.072 16.938 1.00 0.00 C ATOM 0 H ALA A 72 11.802 5.982 18.331 1.00 0.00 H new ATOM 0 HA ALA A 72 14.138 4.301 18.365 1.00 0.00 H new ATOM 0 HB1 ALA A 72 13.096 3.381 16.304 1.00 0.00 H new ATOM 0 HB2 ALA A 72 11.913 3.507 17.627 1.00 0.00 H new ATOM 0 HB3 ALA A 72 11.912 4.710 16.316 1.00 0.00 H new ATOM 1064 N GLY A 73 15.702 5.338 16.752 1.00 0.00 N ATOM 1065 CA GLY A 73 16.661 5.996 15.873 1.00 0.00 C ATOM 1066 C GLY A 73 16.318 5.751 14.409 1.00 0.00 C ATOM 1067 O GLY A 73 16.468 6.638 13.567 1.00 0.00 O ATOM 0 H GLY A 73 16.095 4.597 17.332 1.00 0.00 H new ATOM 0 HA2 GLY A 73 16.668 7.067 16.074 1.00 0.00 H new ATOM 0 HA3 GLY A 73 17.665 5.626 16.082 1.00 0.00 H new ATOM 1071 N ALA A 74 15.854 4.543 14.110 1.00 0.00 N ATOM 1072 CA ALA A 74 15.492 4.189 12.741 1.00 0.00 C ATOM 1073 C ALA A 74 14.481 5.185 12.181 1.00 0.00 C ATOM 1074 O ALA A 74 13.670 5.741 12.921 1.00 0.00 O ATOM 1075 CB ALA A 74 14.896 2.782 12.706 1.00 0.00 C ATOM 0 H ALA A 74 15.720 3.796 14.792 1.00 0.00 H new ATOM 0 HA ALA A 74 16.393 4.217 12.128 1.00 0.00 H new ATOM 0 HB1 ALA A 74 14.629 2.526 11.681 1.00 0.00 H new ATOM 0 HB2 ALA A 74 15.629 2.067 13.079 1.00 0.00 H new ATOM 0 HB3 ALA A 74 14.005 2.749 13.333 1.00 0.00 H new ATOM 1081 N SER A 75 14.541 5.410 10.871 1.00 0.00 N ATOM 1082 CA SER A 75 13.632 6.343 10.225 1.00 0.00 C ATOM 1083 C SER A 75 12.206 5.810 10.261 1.00 0.00 C ATOM 1084 O SER A 75 11.988 4.610 10.428 1.00 0.00 O ATOM 1085 CB SER A 75 14.055 6.562 8.773 1.00 0.00 C ATOM 1086 OG SER A 75 14.229 5.302 8.137 1.00 0.00 O ATOM 0 H SER A 75 15.206 4.960 10.242 1.00 0.00 H new ATOM 0 HA SER A 75 13.670 7.290 10.763 1.00 0.00 H new ATOM 0 HB2 SER A 75 13.300 7.146 8.247 1.00 0.00 H new ATOM 0 HB3 SER A 75 14.983 7.132 8.735 1.00 0.00 H new ATOM 0 HG SER A 75 14.499 5.440 7.205 1.00 0.00 H new ATOM 1092 N GLN A 76 11.235 6.705 10.107 1.00 0.00 N ATOM 1093 CA GLN A 76 9.828 6.307 10.123 1.00 0.00 C ATOM 1094 C GLN A 76 9.032 7.160 9.151 1.00 0.00 C ATOM 1095 O GLN A 76 9.344 8.330 8.949 1.00 0.00 O ATOM 1096 CB GLN A 76 9.257 6.474 11.534 1.00 0.00 C ATOM 1097 CG GLN A 76 7.856 5.859 11.602 1.00 0.00 C ATOM 1098 CD GLN A 76 7.949 4.344 11.448 1.00 0.00 C ATOM 1099 OE1 GLN A 76 8.620 3.680 12.237 1.00 0.00 O ATOM 1100 NE2 GLN A 76 7.318 3.757 10.469 1.00 0.00 N ATOM 0 H GLN A 76 11.393 7.703 9.971 1.00 0.00 H new ATOM 0 HA GLN A 76 9.756 5.262 9.823 1.00 0.00 H new ATOM 0 HB2 GLN A 76 9.911 5.992 12.261 1.00 0.00 H new ATOM 0 HB3 GLN A 76 9.213 7.531 11.796 1.00 0.00 H new ATOM 0 HG2 GLN A 76 7.385 6.109 12.553 1.00 0.00 H new ATOM 0 HG3 GLN A 76 7.227 6.276 10.815 1.00 0.00 H new ATOM 0 HE21 GLN A 76 6.762 4.310 9.816 1.00 0.00 H new ATOM 0 HE22 GLN A 76 7.380 2.745 10.356 1.00 0.00 H new ATOM 1109 N PHE A 77 8.002 6.561 8.554 1.00 0.00 N ATOM 1110 CA PHE A 77 7.154 7.269 7.599 1.00 0.00 C ATOM 1111 C PHE A 77 7.936 7.611 6.332 1.00 0.00 C ATOM 1112 O PHE A 77 7.348 7.875 5.284 1.00 0.00 O ATOM 1113 CB PHE A 77 6.611 8.555 8.233 1.00 0.00 C ATOM 1114 CG PHE A 77 5.458 9.078 7.416 1.00 0.00 C ATOM 1115 CD1 PHE A 77 4.166 8.595 7.645 1.00 0.00 C ATOM 1116 CD2 PHE A 77 5.682 10.045 6.431 1.00 0.00 C ATOM 1117 CE1 PHE A 77 3.096 9.081 6.889 1.00 0.00 C ATOM 1118 CE2 PHE A 77 4.613 10.532 5.673 1.00 0.00 C ATOM 1119 CZ PHE A 77 3.320 10.049 5.901 1.00 0.00 C ATOM 0 H PHE A 77 7.736 5.590 8.715 1.00 0.00 H new ATOM 0 HA PHE A 77 6.322 6.618 7.331 1.00 0.00 H new ATOM 0 HB2 PHE A 77 6.286 8.359 9.255 1.00 0.00 H new ATOM 0 HB3 PHE A 77 7.400 9.305 8.288 1.00 0.00 H new ATOM 0 HD1 PHE A 77 3.995 7.847 8.405 1.00 0.00 H new ATOM 0 HD2 PHE A 77 6.681 10.416 6.256 1.00 0.00 H new ATOM 0 HE1 PHE A 77 2.097 8.711 7.066 1.00 0.00 H new ATOM 0 HE2 PHE A 77 4.785 11.280 4.913 1.00 0.00 H new ATOM 0 HZ PHE A 77 2.493 10.423 5.315 1.00 0.00 H new ATOM 1129 N GLU A 78 9.262 7.600 6.435 1.00 0.00 N ATOM 1130 CA GLU A 78 10.111 7.909 5.297 1.00 0.00 C ATOM 1131 C GLU A 78 9.953 6.851 4.210 1.00 0.00 C ATOM 1132 O GLU A 78 10.255 7.099 3.045 1.00 0.00 O ATOM 1133 CB GLU A 78 11.574 7.971 5.744 1.00 0.00 C ATOM 1134 CG GLU A 78 11.770 9.146 6.708 1.00 0.00 C ATOM 1135 CD GLU A 78 11.564 10.465 5.970 1.00 0.00 C ATOM 1136 OE1 GLU A 78 11.671 10.464 4.754 1.00 0.00 O ATOM 1137 OE2 GLU A 78 11.301 11.455 6.631 1.00 0.00 O ATOM 0 H GLU A 78 9.767 7.381 7.294 1.00 0.00 H new ATOM 0 HA GLU A 78 9.812 8.876 4.892 1.00 0.00 H new ATOM 0 HB2 GLU A 78 11.855 7.037 6.231 1.00 0.00 H new ATOM 0 HB3 GLU A 78 12.225 8.087 4.877 1.00 0.00 H new ATOM 0 HG2 GLU A 78 11.066 9.069 7.536 1.00 0.00 H new ATOM 0 HG3 GLU A 78 12.771 9.112 7.137 1.00 0.00 H new ATOM 1144 N THR A 79 9.478 5.672 4.601 1.00 0.00 N ATOM 1145 CA THR A 79 9.287 4.586 3.648 1.00 0.00 C ATOM 1146 C THR A 79 8.258 4.974 2.592 1.00 0.00 C ATOM 1147 O THR A 79 8.438 4.695 1.406 1.00 0.00 O ATOM 1148 CB THR A 79 8.816 3.327 4.380 1.00 0.00 C ATOM 1149 OG1 THR A 79 7.698 3.645 5.197 1.00 0.00 O ATOM 1150 CG2 THR A 79 9.951 2.786 5.251 1.00 0.00 C ATOM 0 H THR A 79 9.221 5.446 5.562 1.00 0.00 H new ATOM 0 HA THR A 79 10.239 4.388 3.156 1.00 0.00 H new ATOM 0 HB THR A 79 8.528 2.569 3.651 1.00 0.00 H new ATOM 0 HG1 THR A 79 7.395 2.839 5.665 1.00 0.00 H new ATOM 0 HG21 THR A 79 9.614 1.890 5.772 1.00 0.00 H new ATOM 0 HG22 THR A 79 10.807 2.541 4.622 1.00 0.00 H new ATOM 0 HG23 THR A 79 10.242 3.542 5.981 1.00 0.00 H new ATOM 1158 N SER A 80 7.183 5.621 3.027 1.00 0.00 N ATOM 1159 CA SER A 80 6.133 6.043 2.107 1.00 0.00 C ATOM 1160 C SER A 80 6.687 7.012 1.072 1.00 0.00 C ATOM 1161 O SER A 80 6.384 6.902 -0.115 1.00 0.00 O ATOM 1162 CB SER A 80 4.997 6.714 2.882 1.00 0.00 C ATOM 1163 OG SER A 80 4.159 7.414 1.971 1.00 0.00 O ATOM 0 H SER A 80 7.016 5.864 4.004 1.00 0.00 H new ATOM 0 HA SER A 80 5.750 5.161 1.594 1.00 0.00 H new ATOM 0 HB2 SER A 80 4.419 5.966 3.425 1.00 0.00 H new ATOM 0 HB3 SER A 80 5.403 7.402 3.623 1.00 0.00 H new ATOM 0 HG SER A 80 3.429 7.844 2.463 1.00 0.00 H new ATOM 1169 N ALA A 81 7.501 7.960 1.527 1.00 0.00 N ATOM 1170 CA ALA A 81 8.091 8.945 0.626 1.00 0.00 C ATOM 1171 C ALA A 81 9.016 8.271 -0.380 1.00 0.00 C ATOM 1172 O ALA A 81 9.073 8.662 -1.546 1.00 0.00 O ATOM 1173 CB ALA A 81 8.879 9.980 1.432 1.00 0.00 C ATOM 0 H ALA A 81 7.766 8.067 2.506 1.00 0.00 H new ATOM 0 HA ALA A 81 7.286 9.440 0.083 1.00 0.00 H new ATOM 0 HB1 ALA A 81 9.317 10.712 0.754 1.00 0.00 H new ATOM 0 HB2 ALA A 81 8.210 10.485 2.129 1.00 0.00 H new ATOM 0 HB3 ALA A 81 9.672 9.481 1.988 1.00 0.00 H new ATOM 1179 N ALA A 82 9.739 7.254 0.076 1.00 0.00 N ATOM 1180 CA ALA A 82 10.660 6.531 -0.794 1.00 0.00 C ATOM 1181 C ALA A 82 9.907 5.914 -1.968 1.00 0.00 C ATOM 1182 O ALA A 82 10.448 5.794 -3.068 1.00 0.00 O ATOM 1183 CB ALA A 82 11.373 5.431 -0.004 1.00 0.00 C ATOM 0 H ALA A 82 9.706 6.913 1.037 1.00 0.00 H new ATOM 0 HA ALA A 82 11.399 7.234 -1.178 1.00 0.00 H new ATOM 0 HB1 ALA A 82 12.058 4.897 -0.662 1.00 0.00 H new ATOM 0 HB2 ALA A 82 11.933 5.878 0.818 1.00 0.00 H new ATOM 0 HB3 ALA A 82 10.636 4.734 0.396 1.00 0.00 H new ATOM 1189 N LYS A 83 8.661 5.520 -1.729 1.00 0.00 N ATOM 1190 CA LYS A 83 7.848 4.915 -2.773 1.00 0.00 C ATOM 1191 C LYS A 83 7.642 5.893 -3.926 1.00 0.00 C ATOM 1192 O LYS A 83 7.763 5.525 -5.094 1.00 0.00 O ATOM 1193 CB LYS A 83 6.490 4.499 -2.203 1.00 0.00 C ATOM 1194 CG LYS A 83 5.691 3.754 -3.273 1.00 0.00 C ATOM 1195 CD LYS A 83 4.363 3.279 -2.680 1.00 0.00 C ATOM 1196 CE LYS A 83 3.574 2.512 -3.743 1.00 0.00 C ATOM 1197 NZ LYS A 83 2.290 2.031 -3.160 1.00 0.00 N ATOM 0 H LYS A 83 8.195 5.609 -0.826 1.00 0.00 H new ATOM 0 HA LYS A 83 8.368 4.034 -3.148 1.00 0.00 H new ATOM 0 HB2 LYS A 83 6.631 3.862 -1.330 1.00 0.00 H new ATOM 0 HB3 LYS A 83 5.939 5.379 -1.870 1.00 0.00 H new ATOM 0 HG2 LYS A 83 5.508 4.408 -4.126 1.00 0.00 H new ATOM 0 HG3 LYS A 83 6.262 2.902 -3.641 1.00 0.00 H new ATOM 0 HD2 LYS A 83 4.546 2.640 -1.816 1.00 0.00 H new ATOM 0 HD3 LYS A 83 3.784 4.133 -2.328 1.00 0.00 H new ATOM 0 HE2 LYS A 83 3.378 3.156 -4.600 1.00 0.00 H new ATOM 0 HE3 LYS A 83 4.159 1.667 -4.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 1.754 1.510 -3.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 2.488 1.402 -2.355 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 1.730 2.845 -2.834 1.00 0.00 H new ATOM 1211 N LEU A 84 7.325 7.138 -3.589 1.00 0.00 N ATOM 1212 CA LEU A 84 7.101 8.161 -4.606 1.00 0.00 C ATOM 1213 C LEU A 84 8.376 8.403 -5.406 1.00 0.00 C ATOM 1214 O LEU A 84 8.337 8.545 -6.628 1.00 0.00 O ATOM 1215 CB LEU A 84 6.647 9.468 -3.940 1.00 0.00 C ATOM 1216 CG LEU A 84 5.153 9.392 -3.616 1.00 0.00 C ATOM 1217 CD1 LEU A 84 4.896 8.223 -2.664 1.00 0.00 C ATOM 1218 CD2 LEU A 84 4.712 10.698 -2.952 1.00 0.00 C ATOM 0 H LEU A 84 7.218 7.463 -2.628 1.00 0.00 H new ATOM 0 HA LEU A 84 6.322 7.814 -5.285 1.00 0.00 H new ATOM 0 HB2 LEU A 84 7.218 9.640 -3.028 1.00 0.00 H new ATOM 0 HB3 LEU A 84 6.843 10.312 -4.602 1.00 0.00 H new ATOM 0 HG LEU A 84 4.587 9.241 -4.535 1.00 0.00 H new ATOM 0 HD11 LEU A 84 3.832 8.169 -2.433 1.00 0.00 H new ATOM 0 HD12 LEU A 84 5.213 7.293 -3.136 1.00 0.00 H new ATOM 0 HD13 LEU A 84 5.460 8.373 -1.743 1.00 0.00 H new ATOM 0 HD21 LEU A 84 3.648 10.647 -2.720 1.00 0.00 H new ATOM 0 HD22 LEU A 84 5.277 10.847 -2.032 1.00 0.00 H new ATOM 0 HD23 LEU A 84 4.896 11.531 -3.630 1.00 0.00 H new ATOM 1230 N LYS A 85 9.503 8.456 -4.708 1.00 0.00 N ATOM 1231 CA LYS A 85 10.781 8.685 -5.368 1.00 0.00 C ATOM 1232 C LYS A 85 11.097 7.554 -6.338 1.00 0.00 C ATOM 1233 O LYS A 85 11.549 7.791 -7.457 1.00 0.00 O ATOM 1234 CB LYS A 85 11.891 8.789 -4.323 1.00 0.00 C ATOM 1235 CG LYS A 85 13.123 9.456 -4.946 1.00 0.00 C ATOM 1236 CD LYS A 85 14.213 9.641 -3.883 1.00 0.00 C ATOM 1237 CE LYS A 85 13.867 10.821 -2.963 1.00 0.00 C ATOM 1238 NZ LYS A 85 15.060 11.188 -2.161 1.00 0.00 N ATOM 0 H LYS A 85 9.559 8.345 -3.696 1.00 0.00 H new ATOM 0 HA LYS A 85 10.718 9.618 -5.929 1.00 0.00 H new ATOM 0 HB2 LYS A 85 11.545 9.368 -3.467 1.00 0.00 H new ATOM 0 HB3 LYS A 85 12.150 7.797 -3.953 1.00 0.00 H new ATOM 0 HG2 LYS A 85 13.502 8.845 -5.765 1.00 0.00 H new ATOM 0 HG3 LYS A 85 12.849 10.422 -5.369 1.00 0.00 H new ATOM 0 HD2 LYS A 85 14.314 8.730 -3.294 1.00 0.00 H new ATOM 0 HD3 LYS A 85 15.174 9.817 -4.365 1.00 0.00 H new ATOM 0 HE2 LYS A 85 13.538 11.674 -3.556 1.00 0.00 H new ATOM 0 HE3 LYS A 85 13.041 10.553 -2.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 14.827 11.987 -1.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 15.355 10.374 -1.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 15.836 11.461 -2.798 1.00 0.00 H new ATOM 1252 N ARG A 86 10.860 6.324 -5.895 1.00 0.00 N ATOM 1253 CA ARG A 86 11.123 5.162 -6.728 1.00 0.00 C ATOM 1254 C ARG A 86 10.214 5.163 -7.948 1.00 0.00 C ATOM 1255 O ARG A 86 10.633 4.815 -9.046 1.00 0.00 O ATOM 1256 CB ARG A 86 10.906 3.878 -5.923 1.00 0.00 C ATOM 1257 CG ARG A 86 12.030 3.720 -4.896 1.00 0.00 C ATOM 1258 CD ARG A 86 11.749 2.501 -4.016 1.00 0.00 C ATOM 1259 NE ARG A 86 11.771 1.283 -4.817 1.00 0.00 N ATOM 1260 CZ ARG A 86 11.456 0.105 -4.286 1.00 0.00 C ATOM 1261 NH1 ARG A 86 11.121 0.027 -3.026 1.00 0.00 N ATOM 1262 NH2 ARG A 86 11.483 -0.971 -5.023 1.00 0.00 N ATOM 0 H ARG A 86 10.489 6.109 -4.970 1.00 0.00 H new ATOM 0 HA ARG A 86 12.159 5.206 -7.062 1.00 0.00 H new ATOM 0 HB2 ARG A 86 9.941 3.912 -5.418 1.00 0.00 H new ATOM 0 HB3 ARG A 86 10.886 3.017 -6.591 1.00 0.00 H new ATOM 0 HG2 ARG A 86 12.987 3.602 -5.404 1.00 0.00 H new ATOM 0 HG3 ARG A 86 12.104 4.617 -4.281 1.00 0.00 H new ATOM 0 HD2 ARG A 86 12.494 2.437 -3.223 1.00 0.00 H new ATOM 0 HD3 ARG A 86 10.778 2.609 -3.533 1.00 0.00 H new ATOM 0 HE ARG A 86 12.032 1.335 -5.802 1.00 0.00 H new ATOM 0 HH11 ARG A 86 11.101 0.869 -2.451 1.00 0.00 H new ATOM 0 HH12 ARG A 86 10.879 -0.876 -2.618 1.00 0.00 H new ATOM 0 HH21 ARG A 86 11.746 -0.909 -6.007 1.00 0.00 H new ATOM 0 HH22 ARG A 86 11.241 -1.874 -4.616 1.00 0.00 H new ATOM 1276 N LYS A 87 8.972 5.563 -7.746 1.00 0.00 N ATOM 1277 CA LYS A 87 8.005 5.610 -8.840 1.00 0.00 C ATOM 1278 C LYS A 87 8.450 6.594 -9.918 1.00 0.00 C ATOM 1279 O LYS A 87 8.356 6.305 -11.111 1.00 0.00 O ATOM 1280 CB LYS A 87 6.629 6.021 -8.310 1.00 0.00 C ATOM 1281 CG LYS A 87 5.600 5.959 -9.443 1.00 0.00 C ATOM 1282 CD LYS A 87 4.216 6.308 -8.896 1.00 0.00 C ATOM 1283 CE LYS A 87 3.187 6.231 -10.026 1.00 0.00 C ATOM 1284 NZ LYS A 87 1.836 6.556 -9.489 1.00 0.00 N ATOM 0 H LYS A 87 8.605 5.860 -6.842 1.00 0.00 H new ATOM 0 HA LYS A 87 7.943 4.614 -9.279 1.00 0.00 H new ATOM 0 HB2 LYS A 87 6.329 5.360 -7.497 1.00 0.00 H new ATOM 0 HB3 LYS A 87 6.673 7.030 -7.900 1.00 0.00 H new ATOM 0 HG2 LYS A 87 5.875 6.654 -10.236 1.00 0.00 H new ATOM 0 HG3 LYS A 87 5.588 4.962 -9.883 1.00 0.00 H new ATOM 0 HD2 LYS A 87 3.945 5.619 -8.096 1.00 0.00 H new ATOM 0 HD3 LYS A 87 4.225 7.309 -8.466 1.00 0.00 H new ATOM 0 HE2 LYS A 87 3.451 6.928 -10.821 1.00 0.00 H new ATOM 0 HE3 LYS A 87 3.186 5.233 -10.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 1.136 6.504 -10.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 1.585 5.875 -8.744 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 1.843 7.517 -9.091 1.00 0.00 H new ATOM 1298 N TYR A 88 8.930 7.756 -9.492 1.00 0.00 N ATOM 1299 CA TYR A 88 9.381 8.780 -10.425 1.00 0.00 C ATOM 1300 C TYR A 88 10.798 8.482 -10.893 1.00 0.00 C ATOM 1301 O TYR A 88 11.692 8.247 -10.081 1.00 0.00 O ATOM 1302 CB TYR A 88 9.340 10.152 -9.751 1.00 0.00 C ATOM 1303 CG TYR A 88 9.798 11.206 -10.731 1.00 0.00 C ATOM 1304 CD1 TYR A 88 8.917 11.680 -11.710 1.00 0.00 C ATOM 1305 CD2 TYR A 88 11.105 11.705 -10.664 1.00 0.00 C ATOM 1306 CE1 TYR A 88 9.340 12.658 -12.619 1.00 0.00 C ATOM 1307 CE2 TYR A 88 11.528 12.683 -11.572 1.00 0.00 C ATOM 1308 CZ TYR A 88 10.646 13.157 -12.552 1.00 0.00 C ATOM 1309 OH TYR A 88 11.064 14.119 -13.447 1.00 0.00 O ATOM 0 H TYR A 88 9.017 8.012 -8.508 1.00 0.00 H new ATOM 0 HA TYR A 88 8.717 8.782 -11.289 1.00 0.00 H new ATOM 0 HB2 TYR A 88 8.328 10.372 -9.410 1.00 0.00 H new ATOM 0 HB3 TYR A 88 9.981 10.156 -8.870 1.00 0.00 H new ATOM 0 HD1 TYR A 88 7.911 11.291 -11.764 1.00 0.00 H new ATOM 0 HD2 TYR A 88 11.786 11.335 -9.912 1.00 0.00 H new ATOM 0 HE1 TYR A 88 8.659 13.027 -13.371 1.00 0.00 H new ATOM 0 HE2 TYR A 88 12.534 13.072 -11.517 1.00 0.00 H new ATOM 0 HH TYR A 88 11.997 14.356 -13.261 1.00 0.00 H new ATOM 1319 N TRP A 89 10.994 8.496 -12.205 1.00 0.00 N ATOM 1320 CA TRP A 89 12.306 8.224 -12.773 1.00 0.00 C ATOM 1321 C TRP A 89 12.920 6.975 -12.148 1.00 0.00 C ATOM 1322 O TRP A 89 13.455 7.023 -11.042 1.00 0.00 O ATOM 1323 CB TRP A 89 13.233 9.420 -12.547 1.00 0.00 C ATOM 1324 CG TRP A 89 14.469 9.265 -13.375 1.00 0.00 C ATOM 1325 CD1 TRP A 89 15.695 8.962 -12.890 1.00 0.00 C ATOM 1326 CD2 TRP A 89 14.620 9.400 -14.817 1.00 0.00 C ATOM 1327 NE1 TRP A 89 16.590 8.901 -13.943 1.00 0.00 N ATOM 1328 CE2 TRP A 89 15.974 9.159 -15.153 1.00 0.00 C ATOM 1329 CE3 TRP A 89 13.722 9.693 -15.859 1.00 0.00 C ATOM 1330 CZ2 TRP A 89 16.424 9.223 -16.472 1.00 0.00 C ATOM 1331 CZ3 TRP A 89 14.172 9.758 -17.188 1.00 0.00 C ATOM 1332 CH2 TRP A 89 15.517 9.515 -17.494 1.00 0.00 C ATOM 0 H TRP A 89 10.265 8.692 -12.892 1.00 0.00 H new ATOM 0 HA TRP A 89 12.185 8.055 -13.843 1.00 0.00 H new ATOM 0 HB2 TRP A 89 12.720 10.345 -12.812 1.00 0.00 H new ATOM 0 HB3 TRP A 89 13.497 9.493 -11.492 1.00 0.00 H new ATOM 0 HD1 TRP A 89 15.936 8.795 -11.850 1.00 0.00 H new ATOM 0 HE1 TRP A 89 17.583 8.691 -13.839 1.00 0.00 H new ATOM 0 HE3 TRP A 89 12.680 9.869 -15.636 1.00 0.00 H new ATOM 0 HZ2 TRP A 89 17.465 9.048 -16.701 1.00 0.00 H new ATOM 0 HZ3 TRP A 89 13.476 9.997 -17.979 1.00 0.00 H new ATOM 0 HH2 TRP A 89 15.853 9.553 -18.520 1.00 0.00 H new ATOM 1343 N TRP A 90 12.842 5.858 -12.867 1.00 0.00 N ATOM 1344 CA TRP A 90 13.393 4.602 -12.370 1.00 0.00 C ATOM 1345 C TRP A 90 14.890 4.533 -12.644 1.00 0.00 C ATOM 1346 O TRP A 90 15.349 4.892 -13.727 1.00 0.00 O ATOM 1347 CB TRP A 90 12.697 3.422 -13.050 1.00 0.00 C ATOM 1348 CG TRP A 90 11.247 3.425 -12.694 1.00 0.00 C ATOM 1349 CD1 TRP A 90 10.759 3.327 -11.439 1.00 0.00 C ATOM 1350 CD2 TRP A 90 10.091 3.522 -13.577 1.00 0.00 C ATOM 1351 NE1 TRP A 90 9.375 3.369 -11.491 1.00 0.00 N ATOM 1352 CE2 TRP A 90 8.918 3.485 -12.788 1.00 0.00 C ATOM 1353 CE3 TRP A 90 9.951 3.640 -14.971 1.00 0.00 C ATOM 1354 CZ2 TRP A 90 7.649 3.562 -13.363 1.00 0.00 C ATOM 1355 CZ3 TRP A 90 8.676 3.717 -15.553 1.00 0.00 C ATOM 1356 CH2 TRP A 90 7.527 3.679 -14.750 1.00 0.00 C ATOM 0 H TRP A 90 12.407 5.797 -13.787 1.00 0.00 H new ATOM 0 HA TRP A 90 13.226 4.553 -11.294 1.00 0.00 H new ATOM 0 HB2 TRP A 90 12.817 3.490 -14.131 1.00 0.00 H new ATOM 0 HB3 TRP A 90 13.157 2.485 -12.736 1.00 0.00 H new ATOM 0 HD1 TRP A 90 11.351 3.231 -10.541 1.00 0.00 H new ATOM 0 HE1 TRP A 90 8.769 3.320 -10.672 1.00 0.00 H new ATOM 0 HE3 TRP A 90 10.830 3.672 -15.598 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 6.767 3.531 -12.740 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 8.579 3.806 -16.625 1.00 0.00 H new ATOM 0 HH2 TRP A 90 6.549 3.740 -15.203 1.00 0.00 H new ATOM 1367 N LYS A 91 15.649 4.069 -11.655 1.00 0.00 N ATOM 1368 CA LYS A 91 17.102 3.956 -11.795 1.00 0.00 C ATOM 1369 C LYS A 91 17.487 2.543 -12.202 1.00 0.00 C ATOM 1370 O LYS A 91 16.880 1.570 -11.755 1.00 0.00 O ATOM 1371 CB LYS A 91 17.782 4.308 -10.472 1.00 0.00 C ATOM 1372 CG LYS A 91 17.387 5.744 -10.046 1.00 0.00 C ATOM 1373 CD LYS A 91 16.202 5.691 -9.079 1.00 0.00 C ATOM 1374 CE LYS A 91 15.793 7.110 -8.697 1.00 0.00 C ATOM 1375 NZ LYS A 91 16.902 7.753 -7.941 1.00 0.00 N ATOM 0 H LYS A 91 15.286 3.766 -10.751 1.00 0.00 H new ATOM 0 HA LYS A 91 17.430 4.650 -12.569 1.00 0.00 H new ATOM 0 HB2 LYS A 91 17.488 3.596 -9.701 1.00 0.00 H new ATOM 0 HB3 LYS A 91 18.864 4.235 -10.578 1.00 0.00 H new ATOM 0 HG2 LYS A 91 18.234 6.238 -9.570 1.00 0.00 H new ATOM 0 HG3 LYS A 91 17.125 6.335 -10.924 1.00 0.00 H new ATOM 0 HD2 LYS A 91 15.363 5.172 -9.543 1.00 0.00 H new ATOM 0 HD3 LYS A 91 16.472 5.126 -8.187 1.00 0.00 H new ATOM 0 HE2 LYS A 91 15.564 7.688 -9.592 1.00 0.00 H new ATOM 0 HE3 LYS A 91 14.888 7.089 -8.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 16.533 8.567 -7.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 17.315 7.066 -7.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 17.634 8.076 -8.606 1.00 0.00 H new ATOM 1389 N ASN A 92 18.501 2.437 -13.055 1.00 0.00 N ATOM 1390 CA ASN A 92 18.966 1.133 -13.520 1.00 0.00 C ATOM 1391 C ASN A 92 20.104 0.626 -12.640 1.00 0.00 C ATOM 1392 O ASN A 92 20.582 -0.494 -12.813 1.00 0.00 O ATOM 1393 CB ASN A 92 19.451 1.243 -14.966 1.00 0.00 C ATOM 1394 CG ASN A 92 18.275 1.551 -15.888 1.00 0.00 C ATOM 1395 OD1 ASN A 92 17.156 1.105 -15.638 1.00 0.00 O ATOM 1396 ND2 ASN A 92 18.463 2.293 -16.945 1.00 0.00 N ATOM 0 H ASN A 92 19.014 3.232 -13.437 1.00 0.00 H new ATOM 0 HA ASN A 92 18.136 0.428 -13.464 1.00 0.00 H new ATOM 0 HB2 ASN A 92 20.203 2.028 -15.047 1.00 0.00 H new ATOM 0 HB3 ASN A 92 19.928 0.311 -15.270 1.00 0.00 H new ATOM 0 HD21 ASN A 92 17.681 2.504 -17.566 1.00 0.00 H new ATOM 0 HD22 ASN A 92 19.391 2.662 -17.151 1.00 0.00 H new ATOM 1403 N LEU A 93 20.526 1.454 -11.690 1.00 0.00 N ATOM 1404 CA LEU A 93 21.608 1.077 -10.786 1.00 0.00 C ATOM 1405 C LEU A 93 21.204 -0.130 -9.949 1.00 0.00 C ATOM 1406 O LEU A 93 22.008 -1.032 -9.720 1.00 0.00 O ATOM 1407 CB LEU A 93 21.952 2.248 -9.864 1.00 0.00 C ATOM 1408 CG LEU A 93 22.206 3.504 -10.705 1.00 0.00 C ATOM 1409 CD1 LEU A 93 22.513 4.684 -9.777 1.00 0.00 C ATOM 1410 CD2 LEU A 93 23.398 3.267 -11.649 1.00 0.00 C ATOM 0 H LEU A 93 20.139 2.384 -11.526 1.00 0.00 H new ATOM 0 HA LEU A 93 22.483 0.818 -11.382 1.00 0.00 H new ATOM 0 HB2 LEU A 93 21.136 2.425 -9.164 1.00 0.00 H new ATOM 0 HB3 LEU A 93 22.835 2.010 -9.271 1.00 0.00 H new ATOM 0 HG LEU A 93 21.319 3.727 -11.298 1.00 0.00 H new ATOM 0 HD11 LEU A 93 22.694 5.578 -10.373 1.00 0.00 H new ATOM 0 HD12 LEU A 93 21.665 4.855 -9.114 1.00 0.00 H new ATOM 0 HD13 LEU A 93 23.399 4.459 -9.183 1.00 0.00 H new ATOM 0 HD21 LEU A 93 23.574 4.163 -12.244 1.00 0.00 H new ATOM 0 HD22 LEU A 93 24.288 3.041 -11.062 1.00 0.00 H new ATOM 0 HD23 LEU A 93 23.177 2.429 -12.310 1.00 0.00 H new ATOM 1422 N LYS A 94 19.956 -0.139 -9.494 1.00 0.00 N ATOM 1423 CA LYS A 94 19.457 -1.241 -8.680 1.00 0.00 C ATOM 1424 C LYS A 94 19.495 -2.548 -9.466 1.00 0.00 C ATOM 1425 O LYS A 94 19.843 -3.599 -8.926 1.00 0.00 O ATOM 1426 CB LYS A 94 18.024 -0.953 -8.236 1.00 0.00 C ATOM 1427 CG LYS A 94 18.017 0.223 -7.258 1.00 0.00 C ATOM 1428 CD LYS A 94 16.583 0.514 -6.816 1.00 0.00 C ATOM 1429 CE LYS A 94 16.583 1.651 -5.790 1.00 0.00 C ATOM 1430 NZ LYS A 94 16.784 2.951 -6.491 1.00 0.00 N ATOM 0 H LYS A 94 19.275 0.599 -9.673 1.00 0.00 H new ATOM 0 HA LYS A 94 20.097 -1.339 -7.803 1.00 0.00 H new ATOM 0 HB2 LYS A 94 17.403 -0.723 -9.102 1.00 0.00 H new ATOM 0 HB3 LYS A 94 17.595 -1.836 -7.762 1.00 0.00 H new ATOM 0 HG2 LYS A 94 18.636 -0.008 -6.391 1.00 0.00 H new ATOM 0 HG3 LYS A 94 18.448 1.105 -7.731 1.00 0.00 H new ATOM 0 HD2 LYS A 94 15.975 0.788 -7.678 1.00 0.00 H new ATOM 0 HD3 LYS A 94 16.137 -0.381 -6.382 1.00 0.00 H new ATOM 0 HE2 LYS A 94 15.640 1.662 -5.243 1.00 0.00 H new ATOM 0 HE3 LYS A 94 17.375 1.494 -5.057 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 16.700 3.731 -5.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 17.730 2.970 -6.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 16.063 3.061 -7.232 1.00 0.00 H new ATOM 1444 N MET A 95 19.136 -2.477 -10.741 1.00 0.00 N ATOM 1445 CA MET A 95 19.131 -3.659 -11.594 1.00 0.00 C ATOM 1446 C MET A 95 20.543 -4.216 -11.741 1.00 0.00 C ATOM 1447 O MET A 95 20.736 -5.429 -11.815 1.00 0.00 O ATOM 1448 CB MET A 95 18.571 -3.306 -12.973 1.00 0.00 C ATOM 1449 CG MET A 95 17.113 -2.866 -12.838 1.00 0.00 C ATOM 1450 SD MET A 95 16.098 -4.271 -12.303 1.00 0.00 S ATOM 1451 CE MET A 95 14.755 -4.069 -13.498 1.00 0.00 C ATOM 0 H MET A 95 18.845 -1.617 -11.206 1.00 0.00 H new ATOM 0 HA MET A 95 18.499 -4.417 -11.131 1.00 0.00 H new ATOM 0 HB2 MET A 95 19.162 -2.508 -13.423 1.00 0.00 H new ATOM 0 HB3 MET A 95 18.641 -4.168 -13.637 1.00 0.00 H new ATOM 0 HG2 MET A 95 17.034 -2.052 -12.117 1.00 0.00 H new ATOM 0 HG3 MET A 95 16.749 -2.484 -13.791 1.00 0.00 H new ATOM 0 HE1 MET A 95 14.008 -4.847 -13.341 1.00 0.00 H new ATOM 0 HE2 MET A 95 14.294 -3.091 -13.365 1.00 0.00 H new ATOM 0 HE3 MET A 95 15.153 -4.148 -14.510 1.00 0.00 H new ATOM 1461 N MET A 96 21.523 -3.322 -11.795 1.00 0.00 N ATOM 1462 CA MET A 96 22.910 -3.740 -11.946 1.00 0.00 C ATOM 1463 C MET A 96 23.321 -4.643 -10.784 1.00 0.00 C ATOM 1464 O MET A 96 24.047 -5.618 -10.973 1.00 0.00 O ATOM 1465 CB MET A 96 23.827 -2.512 -11.990 1.00 0.00 C ATOM 1466 CG MET A 96 25.267 -2.945 -12.290 1.00 0.00 C ATOM 1467 SD MET A 96 25.356 -3.613 -13.971 1.00 0.00 S ATOM 1468 CE MET A 96 25.840 -2.079 -14.802 1.00 0.00 C ATOM 0 H MET A 96 21.385 -2.313 -11.737 1.00 0.00 H new ATOM 0 HA MET A 96 23.005 -4.295 -12.879 1.00 0.00 H new ATOM 0 HB2 MET A 96 23.481 -1.816 -12.754 1.00 0.00 H new ATOM 0 HB3 MET A 96 23.788 -1.984 -11.037 1.00 0.00 H new ATOM 0 HG2 MET A 96 25.943 -2.096 -12.188 1.00 0.00 H new ATOM 0 HG3 MET A 96 25.590 -3.697 -11.570 1.00 0.00 H new ATOM 0 HE1 MET A 96 25.953 -2.264 -15.870 1.00 0.00 H new ATOM 0 HE2 MET A 96 25.072 -1.322 -14.644 1.00 0.00 H new ATOM 0 HE3 MET A 96 26.787 -1.726 -14.393 1.00 0.00 H new ATOM 1478 N ILE A 97 22.859 -4.308 -9.586 1.00 0.00 N ATOM 1479 CA ILE A 97 23.193 -5.095 -8.405 1.00 0.00 C ATOM 1480 C ILE A 97 22.651 -6.511 -8.540 1.00 0.00 C ATOM 1481 O ILE A 97 23.341 -7.479 -8.220 1.00 0.00 O ATOM 1482 CB ILE A 97 22.605 -4.433 -7.154 1.00 0.00 C ATOM 1483 CG1 ILE A 97 23.028 -2.959 -7.109 1.00 0.00 C ATOM 1484 CG2 ILE A 97 23.113 -5.149 -5.902 1.00 0.00 C ATOM 1485 CD1 ILE A 97 24.558 -2.835 -7.206 1.00 0.00 C ATOM 0 H ILE A 97 22.257 -3.504 -9.407 1.00 0.00 H new ATOM 0 HA ILE A 97 24.278 -5.141 -8.313 1.00 0.00 H new ATOM 0 HB ILE A 97 21.518 -4.499 -7.189 1.00 0.00 H new ATOM 0 HG12 ILE A 97 22.560 -2.415 -7.930 1.00 0.00 H new ATOM 0 HG13 ILE A 97 22.678 -2.502 -6.183 1.00 0.00 H new ATOM 0 HG21 ILE A 97 22.692 -4.675 -5.016 1.00 0.00 H new ATOM 0 HG22 ILE A 97 22.809 -6.195 -5.933 1.00 0.00 H new ATOM 0 HG23 ILE A 97 24.201 -5.088 -5.864 1.00 0.00 H new ATOM 0 HD11 ILE A 97 24.841 -1.783 -7.173 1.00 0.00 H new ATOM 0 HD12 ILE A 97 25.019 -3.361 -6.370 1.00 0.00 H new ATOM 0 HD13 ILE A 97 24.900 -3.273 -8.144 1.00 0.00 H new ATOM 1497 N ILE A 98 21.420 -6.625 -9.009 1.00 0.00 N ATOM 1498 CA ILE A 98 20.796 -7.932 -9.180 1.00 0.00 C ATOM 1499 C ILE A 98 21.553 -8.751 -10.215 1.00 0.00 C ATOM 1500 O ILE A 98 21.795 -9.941 -10.025 1.00 0.00 O ATOM 1501 CB ILE A 98 19.342 -7.762 -9.622 1.00 0.00 C ATOM 1502 CG1 ILE A 98 18.621 -6.805 -8.661 1.00 0.00 C ATOM 1503 CG2 ILE A 98 18.637 -9.119 -9.615 1.00 0.00 C ATOM 1504 CD1 ILE A 98 18.765 -7.294 -7.210 1.00 0.00 C ATOM 0 H ILE A 98 20.833 -5.835 -9.278 1.00 0.00 H new ATOM 0 HA ILE A 98 20.824 -8.458 -8.225 1.00 0.00 H new ATOM 0 HB ILE A 98 19.320 -7.350 -10.631 1.00 0.00 H new ATOM 0 HG12 ILE A 98 19.037 -5.802 -8.756 1.00 0.00 H new ATOM 0 HG13 ILE A 98 17.566 -6.739 -8.926 1.00 0.00 H new ATOM 0 HG21 ILE A 98 17.601 -8.993 -9.931 1.00 0.00 H new ATOM 0 HG22 ILE A 98 19.145 -9.797 -10.301 1.00 0.00 H new ATOM 0 HG23 ILE A 98 18.661 -9.536 -8.608 1.00 0.00 H new ATOM 0 HD11 ILE A 98 18.249 -6.605 -6.541 1.00 0.00 H new ATOM 0 HD12 ILE A 98 18.327 -8.288 -7.116 1.00 0.00 H new ATOM 0 HD13 ILE A 98 19.821 -7.336 -6.943 1.00 0.00 H new ATOM 1516 N LEU A 99 21.917 -8.112 -11.314 1.00 0.00 N ATOM 1517 CA LEU A 99 22.635 -8.799 -12.374 1.00 0.00 C ATOM 1518 C LEU A 99 23.971 -9.326 -11.864 1.00 0.00 C ATOM 1519 O LEU A 99 24.398 -10.422 -12.229 1.00 0.00 O ATOM 1520 CB LEU A 99 22.872 -7.850 -13.552 1.00 0.00 C ATOM 1521 CG LEU A 99 23.574 -8.599 -14.698 1.00 0.00 C ATOM 1522 CD1 LEU A 99 22.682 -9.751 -15.204 1.00 0.00 C ATOM 1523 CD2 LEU A 99 23.859 -7.621 -15.840 1.00 0.00 C ATOM 0 H LEU A 99 21.729 -7.126 -11.495 1.00 0.00 H new ATOM 0 HA LEU A 99 22.029 -9.642 -12.707 1.00 0.00 H new ATOM 0 HB2 LEU A 99 21.922 -7.444 -13.900 1.00 0.00 H new ATOM 0 HB3 LEU A 99 23.481 -7.005 -13.232 1.00 0.00 H new ATOM 0 HG LEU A 99 24.512 -9.018 -14.334 1.00 0.00 H new ATOM 0 HD11 LEU A 99 23.189 -10.274 -16.015 1.00 0.00 H new ATOM 0 HD12 LEU A 99 22.489 -10.447 -14.388 1.00 0.00 H new ATOM 0 HD13 LEU A 99 21.737 -9.347 -15.567 1.00 0.00 H new ATOM 0 HD21 LEU A 99 24.357 -8.148 -16.654 1.00 0.00 H new ATOM 0 HD22 LEU A 99 22.921 -7.199 -16.200 1.00 0.00 H new ATOM 0 HD23 LEU A 99 24.503 -6.819 -15.480 1.00 0.00 H new ATOM 1535 N GLY A 100 24.636 -8.534 -11.036 1.00 0.00 N ATOM 1536 CA GLY A 100 25.930 -8.925 -10.498 1.00 0.00 C ATOM 1537 C GLY A 100 25.822 -10.219 -9.699 1.00 0.00 C ATOM 1538 O GLY A 100 26.753 -11.023 -9.673 1.00 0.00 O ATOM 0 H GLY A 100 24.303 -7.622 -10.724 1.00 0.00 H new ATOM 0 HA2 GLY A 100 26.642 -9.055 -11.313 1.00 0.00 H new ATOM 0 HA3 GLY A 100 26.317 -8.131 -9.860 1.00 0.00 H new ATOM 1542 N VAL A 101 24.685 -10.415 -9.044 1.00 0.00 N ATOM 1543 CA VAL A 101 24.480 -11.616 -8.247 1.00 0.00 C ATOM 1544 C VAL A 101 24.540 -12.862 -9.127 1.00 0.00 C ATOM 1545 O VAL A 101 25.225 -13.837 -8.801 1.00 0.00 O ATOM 1546 CB VAL A 101 23.117 -11.552 -7.552 1.00 0.00 C ATOM 1547 CG1 VAL A 101 22.851 -12.859 -6.807 1.00 0.00 C ATOM 1548 CG2 VAL A 101 23.103 -10.384 -6.562 1.00 0.00 C ATOM 0 H VAL A 101 23.899 -9.765 -9.048 1.00 0.00 H new ATOM 0 HA VAL A 101 25.272 -11.672 -7.500 1.00 0.00 H new ATOM 0 HB VAL A 101 22.339 -11.404 -8.301 1.00 0.00 H new ATOM 0 HG11 VAL A 101 21.880 -12.806 -6.315 1.00 0.00 H new ATOM 0 HG12 VAL A 101 22.855 -13.688 -7.514 1.00 0.00 H new ATOM 0 HG13 VAL A 101 23.628 -13.016 -6.059 1.00 0.00 H new ATOM 0 HG21 VAL A 101 22.133 -10.338 -6.067 1.00 0.00 H new ATOM 0 HG22 VAL A 101 23.884 -10.530 -5.816 1.00 0.00 H new ATOM 0 HG23 VAL A 101 23.282 -9.451 -7.097 1.00 0.00 H new ATOM 1558 N ILE A 102 23.830 -12.826 -10.246 1.00 0.00 N ATOM 1559 CA ILE A 102 23.811 -13.967 -11.152 1.00 0.00 C ATOM 1560 C ILE A 102 25.206 -14.234 -11.700 1.00 0.00 C ATOM 1561 O ILE A 102 25.659 -15.377 -11.741 1.00 0.00 O ATOM 1562 CB ILE A 102 22.828 -13.701 -12.310 1.00 0.00 C ATOM 1563 CG1 ILE A 102 21.390 -13.955 -11.833 1.00 0.00 C ATOM 1564 CG2 ILE A 102 23.138 -14.631 -13.495 1.00 0.00 C ATOM 1565 CD1 ILE A 102 21.122 -13.162 -10.554 1.00 0.00 C ATOM 0 H ILE A 102 23.266 -12.031 -10.546 1.00 0.00 H new ATOM 0 HA ILE A 102 23.482 -14.847 -10.600 1.00 0.00 H new ATOM 0 HB ILE A 102 22.935 -12.664 -12.630 1.00 0.00 H new ATOM 0 HG12 ILE A 102 20.683 -13.662 -12.609 1.00 0.00 H new ATOM 0 HG13 ILE A 102 21.240 -15.019 -11.650 1.00 0.00 H new ATOM 0 HG21 ILE A 102 22.437 -14.433 -14.306 1.00 0.00 H new ATOM 0 HG22 ILE A 102 24.155 -14.451 -13.843 1.00 0.00 H new ATOM 0 HG23 ILE A 102 23.042 -15.669 -13.178 1.00 0.00 H new ATOM 0 HD11 ILE A 102 20.101 -13.345 -10.219 1.00 0.00 H new ATOM 0 HD12 ILE A 102 21.820 -13.476 -9.778 1.00 0.00 H new ATOM 0 HD13 ILE A 102 21.254 -12.098 -10.751 1.00 0.00 H new ATOM 1577 N CYS A 103 25.874 -13.180 -12.119 1.00 0.00 N ATOM 1578 CA CYS A 103 27.217 -13.310 -12.669 1.00 0.00 C ATOM 1579 C CYS A 103 28.166 -13.901 -11.632 1.00 0.00 C ATOM 1580 O CYS A 103 29.129 -14.590 -11.973 1.00 0.00 O ATOM 1581 CB CYS A 103 27.728 -11.936 -13.134 1.00 0.00 C ATOM 1582 SG CYS A 103 28.470 -11.031 -11.750 1.00 0.00 S ATOM 0 H CYS A 103 25.516 -12.225 -12.092 1.00 0.00 H new ATOM 0 HA CYS A 103 27.180 -13.984 -13.525 1.00 0.00 H new ATOM 0 HB2 CYS A 103 28.464 -12.065 -13.928 1.00 0.00 H new ATOM 0 HB3 CYS A 103 26.904 -11.358 -13.554 1.00 0.00 H new ATOM 0 HG CYS A 103 27.735 -11.183 -10.688 1.00 0.00 H new ATOM 1588 N ALA A 104 27.888 -13.610 -10.371 1.00 0.00 N ATOM 1589 CA ALA A 104 28.720 -14.100 -9.283 1.00 0.00 C ATOM 1590 C ALA A 104 28.840 -15.617 -9.347 1.00 0.00 C ATOM 1591 O ALA A 104 29.932 -16.168 -9.229 1.00 0.00 O ATOM 1592 CB ALA A 104 28.122 -13.698 -7.935 1.00 0.00 C ATOM 0 H ALA A 104 27.096 -13.039 -10.076 1.00 0.00 H new ATOM 0 HA ALA A 104 29.710 -13.656 -9.386 1.00 0.00 H new ATOM 0 HB1 ALA A 104 28.755 -14.071 -7.130 1.00 0.00 H new ATOM 0 HB2 ALA A 104 28.060 -12.611 -7.874 1.00 0.00 H new ATOM 0 HB3 ALA A 104 27.123 -14.124 -7.838 1.00 0.00 H new ATOM 1598 N ILE A 105 27.712 -16.285 -9.541 1.00 0.00 N ATOM 1599 CA ILE A 105 27.712 -17.742 -9.619 1.00 0.00 C ATOM 1600 C ILE A 105 28.534 -18.212 -10.822 1.00 0.00 C ATOM 1601 O ILE A 105 29.307 -19.166 -10.724 1.00 0.00 O ATOM 1602 CB ILE A 105 26.266 -18.262 -9.735 1.00 0.00 C ATOM 1603 CG1 ILE A 105 25.610 -18.251 -8.351 1.00 0.00 C ATOM 1604 CG2 ILE A 105 26.258 -19.699 -10.284 1.00 0.00 C ATOM 1605 CD1 ILE A 105 25.632 -16.831 -7.783 1.00 0.00 C ATOM 0 H ILE A 105 26.795 -15.850 -9.646 1.00 0.00 H new ATOM 0 HA ILE A 105 28.164 -18.140 -8.710 1.00 0.00 H new ATOM 0 HB ILE A 105 25.713 -17.616 -10.417 1.00 0.00 H new ATOM 0 HG12 ILE A 105 24.583 -18.609 -8.422 1.00 0.00 H new ATOM 0 HG13 ILE A 105 26.139 -18.929 -7.682 1.00 0.00 H new ATOM 0 HG21 ILE A 105 25.230 -20.053 -10.361 1.00 0.00 H new ATOM 0 HG22 ILE A 105 26.722 -19.714 -11.270 1.00 0.00 H new ATOM 0 HG23 ILE A 105 26.817 -20.349 -9.610 1.00 0.00 H new ATOM 0 HD11 ILE A 105 25.165 -16.826 -6.798 1.00 0.00 H new ATOM 0 HD12 ILE A 105 26.664 -16.489 -7.697 1.00 0.00 H new ATOM 0 HD13 ILE A 105 25.083 -16.164 -8.448 1.00 0.00 H new ATOM 1617 N ILE A 106 28.346 -17.552 -11.956 1.00 0.00 N ATOM 1618 CA ILE A 106 29.065 -17.921 -13.167 1.00 0.00 C ATOM 1619 C ILE A 106 30.567 -17.842 -12.933 1.00 0.00 C ATOM 1620 O ILE A 106 31.339 -18.582 -13.535 1.00 0.00 O ATOM 1621 CB ILE A 106 28.671 -16.993 -14.316 1.00 0.00 C ATOM 1622 CG1 ILE A 106 27.143 -16.904 -14.400 1.00 0.00 C ATOM 1623 CG2 ILE A 106 29.223 -17.534 -15.635 1.00 0.00 C ATOM 1624 CD1 ILE A 106 26.529 -18.309 -14.494 1.00 0.00 C ATOM 0 H ILE A 106 27.707 -16.764 -12.063 1.00 0.00 H new ATOM 0 HA ILE A 106 28.801 -18.945 -13.430 1.00 0.00 H new ATOM 0 HB ILE A 106 29.086 -16.002 -14.134 1.00 0.00 H new ATOM 0 HG12 ILE A 106 26.754 -16.388 -13.522 1.00 0.00 H new ATOM 0 HG13 ILE A 106 26.854 -16.315 -15.270 1.00 0.00 H new ATOM 0 HG21 ILE A 106 28.938 -16.868 -16.449 1.00 0.00 H new ATOM 0 HG22 ILE A 106 30.310 -17.593 -15.578 1.00 0.00 H new ATOM 0 HG23 ILE A 106 28.815 -18.528 -15.820 1.00 0.00 H new ATOM 0 HD11 ILE A 106 25.444 -18.229 -14.553 1.00 0.00 H new ATOM 0 HD12 ILE A 106 26.905 -18.811 -15.385 1.00 0.00 H new ATOM 0 HD13 ILE A 106 26.803 -18.886 -13.610 1.00 0.00 H new ATOM 1636 N LEU A 107 30.975 -16.934 -12.060 1.00 0.00 N ATOM 1637 CA LEU A 107 32.392 -16.770 -11.751 1.00 0.00 C ATOM 1638 C LEU A 107 32.838 -17.782 -10.705 1.00 0.00 C ATOM 1639 O LEU A 107 33.902 -18.386 -10.831 1.00 0.00 O ATOM 1640 CB LEU A 107 32.646 -15.355 -11.241 1.00 0.00 C ATOM 1641 CG LEU A 107 32.384 -14.346 -12.367 1.00 0.00 C ATOM 1642 CD1 LEU A 107 32.379 -12.927 -11.790 1.00 0.00 C ATOM 1643 CD2 LEU A 107 33.472 -14.458 -13.458 1.00 0.00 C ATOM 0 H LEU A 107 30.353 -16.303 -11.555 1.00 0.00 H new ATOM 0 HA LEU A 107 32.967 -16.939 -12.661 1.00 0.00 H new ATOM 0 HB2 LEU A 107 31.998 -15.142 -10.391 1.00 0.00 H new ATOM 0 HB3 LEU A 107 33.674 -15.264 -10.889 1.00 0.00 H new ATOM 0 HG LEU A 107 31.415 -14.564 -12.816 1.00 0.00 H new ATOM 0 HD11 LEU A 107 32.193 -12.210 -12.589 1.00 0.00 H new ATOM 0 HD12 LEU A 107 31.595 -12.843 -11.037 1.00 0.00 H new ATOM 0 HD13 LEU A 107 33.346 -12.717 -11.332 1.00 0.00 H new ATOM 0 HD21 LEU A 107 33.270 -13.735 -14.249 1.00 0.00 H new ATOM 0 HD22 LEU A 107 34.449 -14.253 -13.020 1.00 0.00 H new ATOM 0 HD23 LEU A 107 33.466 -15.464 -13.876 1.00 0.00 H new ATOM 1655 N ILE A 108 32.029 -17.950 -9.671 1.00 0.00 N ATOM 1656 CA ILE A 108 32.356 -18.883 -8.600 1.00 0.00 C ATOM 1657 C ILE A 108 32.396 -20.315 -9.124 1.00 0.00 C ATOM 1658 O ILE A 108 33.295 -21.084 -8.788 1.00 0.00 O ATOM 1659 CB ILE A 108 31.321 -18.775 -7.479 1.00 0.00 C ATOM 1660 CG1 ILE A 108 31.446 -17.409 -6.800 1.00 0.00 C ATOM 1661 CG2 ILE A 108 31.565 -19.877 -6.442 1.00 0.00 C ATOM 1662 CD1 ILE A 108 30.229 -17.173 -5.901 1.00 0.00 C ATOM 0 H ILE A 108 31.145 -17.456 -9.549 1.00 0.00 H new ATOM 0 HA ILE A 108 33.341 -18.626 -8.211 1.00 0.00 H new ATOM 0 HB ILE A 108 30.322 -18.887 -7.901 1.00 0.00 H new ATOM 0 HG12 ILE A 108 32.361 -17.367 -6.210 1.00 0.00 H new ATOM 0 HG13 ILE A 108 31.515 -16.622 -7.551 1.00 0.00 H new ATOM 0 HG21 ILE A 108 30.826 -19.797 -5.645 1.00 0.00 H new ATOM 0 HG22 ILE A 108 31.478 -20.853 -6.920 1.00 0.00 H new ATOM 0 HG23 ILE A 108 32.565 -19.766 -6.022 1.00 0.00 H new ATOM 0 HD11 ILE A 108 30.317 -16.200 -5.417 1.00 0.00 H new ATOM 0 HD12 ILE A 108 29.321 -17.197 -6.504 1.00 0.00 H new ATOM 0 HD13 ILE A 108 30.181 -17.953 -5.141 1.00 0.00 H new ATOM 1674 N ILE A 109 31.411 -20.671 -9.937 1.00 0.00 N ATOM 1675 CA ILE A 109 31.340 -22.021 -10.484 1.00 0.00 C ATOM 1676 C ILE A 109 32.547 -22.304 -11.372 1.00 0.00 C ATOM 1677 O ILE A 109 33.097 -23.405 -11.353 1.00 0.00 O ATOM 1678 CB ILE A 109 30.050 -22.188 -11.293 1.00 0.00 C ATOM 1679 CG1 ILE A 109 29.866 -23.662 -11.665 1.00 0.00 C ATOM 1680 CG2 ILE A 109 30.131 -21.347 -12.566 1.00 0.00 C ATOM 1681 CD1 ILE A 109 28.461 -23.872 -12.228 1.00 0.00 C ATOM 0 H ILE A 109 30.656 -20.051 -10.231 1.00 0.00 H new ATOM 0 HA ILE A 109 31.342 -22.731 -9.657 1.00 0.00 H new ATOM 0 HB ILE A 109 29.202 -21.856 -10.694 1.00 0.00 H new ATOM 0 HG12 ILE A 109 30.613 -23.959 -12.401 1.00 0.00 H new ATOM 0 HG13 ILE A 109 30.016 -24.291 -10.788 1.00 0.00 H new ATOM 0 HG21 ILE A 109 29.212 -21.467 -13.140 1.00 0.00 H new ATOM 0 HG22 ILE A 109 30.259 -20.297 -12.301 1.00 0.00 H new ATOM 0 HG23 ILE A 109 30.980 -21.676 -13.166 1.00 0.00 H new ATOM 0 HD11 ILE A 109 28.328 -24.921 -12.493 1.00 0.00 H new ATOM 0 HD12 ILE A 109 27.722 -23.591 -11.477 1.00 0.00 H new ATOM 0 HD13 ILE A 109 28.329 -23.254 -13.116 1.00 0.00 H new ATOM 1693 N ILE A 110 32.951 -21.306 -12.150 1.00 0.00 N ATOM 1694 CA ILE A 110 34.094 -21.475 -13.037 1.00 0.00 C ATOM 1695 C ILE A 110 35.358 -21.748 -12.231 1.00 0.00 C ATOM 1696 O ILE A 110 36.149 -22.626 -12.574 1.00 0.00 O ATOM 1697 CB ILE A 110 34.280 -20.209 -13.890 1.00 0.00 C ATOM 1698 CG1 ILE A 110 33.126 -20.103 -14.920 1.00 0.00 C ATOM 1699 CG2 ILE A 110 35.636 -20.256 -14.616 1.00 0.00 C ATOM 1700 CD1 ILE A 110 33.468 -20.898 -16.189 1.00 0.00 C ATOM 0 H ILE A 110 32.512 -20.386 -12.185 1.00 0.00 H new ATOM 0 HA ILE A 110 33.908 -22.327 -13.691 1.00 0.00 H new ATOM 0 HB ILE A 110 34.262 -19.333 -13.242 1.00 0.00 H new ATOM 0 HG12 ILE A 110 32.203 -20.483 -14.482 1.00 0.00 H new ATOM 0 HG13 ILE A 110 32.951 -19.057 -15.174 1.00 0.00 H new ATOM 0 HG21 ILE A 110 35.758 -19.355 -15.217 1.00 0.00 H new ATOM 0 HG22 ILE A 110 36.440 -20.314 -13.882 1.00 0.00 H new ATOM 0 HG23 ILE A 110 35.672 -21.132 -15.264 1.00 0.00 H new ATOM 0 HD11 ILE A 110 32.648 -20.814 -16.903 1.00 0.00 H new ATOM 0 HD12 ILE A 110 34.379 -20.498 -16.634 1.00 0.00 H new ATOM 0 HD13 ILE A 110 33.619 -21.946 -15.932 1.00 0.00 H new ATOM 1712 N ILE A 111 35.546 -20.992 -11.166 1.00 0.00 N ATOM 1713 CA ILE A 111 36.721 -21.167 -10.327 1.00 0.00 C ATOM 1714 C ILE A 111 36.692 -22.527 -9.648 1.00 0.00 C ATOM 1715 O ILE A 111 37.705 -23.217 -9.581 1.00 0.00 O ATOM 1716 CB ILE A 111 36.782 -20.056 -9.273 1.00 0.00 C ATOM 1717 CG1 ILE A 111 37.035 -18.702 -9.963 1.00 0.00 C ATOM 1718 CG2 ILE A 111 37.910 -20.340 -8.279 1.00 0.00 C ATOM 1719 CD1 ILE A 111 38.383 -18.701 -10.718 1.00 0.00 C ATOM 0 H ILE A 111 34.908 -20.257 -10.861 1.00 0.00 H new ATOM 0 HA ILE A 111 37.609 -21.111 -10.956 1.00 0.00 H new ATOM 0 HB ILE A 111 35.833 -20.021 -8.738 1.00 0.00 H new ATOM 0 HG12 ILE A 111 36.225 -18.490 -10.660 1.00 0.00 H new ATOM 0 HG13 ILE A 111 37.032 -17.906 -9.219 1.00 0.00 H new ATOM 0 HG21 ILE A 111 37.946 -19.546 -7.533 1.00 0.00 H new ATOM 0 HG22 ILE A 111 37.727 -21.294 -7.784 1.00 0.00 H new ATOM 0 HG23 ILE A 111 38.861 -20.383 -8.810 1.00 0.00 H new ATOM 0 HD11 ILE A 111 38.533 -17.732 -11.194 1.00 0.00 H new ATOM 0 HD12 ILE A 111 39.194 -18.889 -10.015 1.00 0.00 H new ATOM 0 HD13 ILE A 111 38.375 -19.482 -11.479 1.00 0.00 H new ATOM 1731 N VAL A 112 35.527 -22.894 -9.137 1.00 0.00 N ATOM 1732 CA VAL A 112 35.373 -24.171 -8.458 1.00 0.00 C ATOM 1733 C VAL A 112 35.439 -25.320 -9.456 1.00 0.00 C ATOM 1734 O VAL A 112 35.792 -26.444 -9.101 1.00 0.00 O ATOM 1735 CB VAL A 112 34.039 -24.206 -7.710 1.00 0.00 C ATOM 1736 CG1 VAL A 112 33.835 -25.590 -7.093 1.00 0.00 C ATOM 1737 CG2 VAL A 112 34.049 -23.152 -6.600 1.00 0.00 C ATOM 0 H VAL A 112 34.679 -22.329 -9.179 1.00 0.00 H new ATOM 0 HA VAL A 112 36.189 -24.285 -7.744 1.00 0.00 H new ATOM 0 HB VAL A 112 33.228 -23.995 -8.407 1.00 0.00 H new ATOM 0 HG11 VAL A 112 32.884 -25.614 -6.560 1.00 0.00 H new ATOM 0 HG12 VAL A 112 33.828 -26.343 -7.882 1.00 0.00 H new ATOM 0 HG13 VAL A 112 34.647 -25.801 -6.397 1.00 0.00 H new ATOM 0 HG21 VAL A 112 33.099 -23.176 -6.067 1.00 0.00 H new ATOM 0 HG22 VAL A 112 34.861 -23.364 -5.904 1.00 0.00 H new ATOM 0 HG23 VAL A 112 34.194 -22.164 -7.037 1.00 0.00 H new ATOM 1747 N TYR A 113 35.085 -25.032 -10.704 1.00 0.00 N ATOM 1748 CA TYR A 113 35.100 -26.052 -11.744 1.00 0.00 C ATOM 1749 C TYR A 113 36.499 -26.621 -11.922 1.00 0.00 C ATOM 1750 O TYR A 113 36.684 -27.835 -12.022 1.00 0.00 O ATOM 1751 CB TYR A 113 34.603 -25.463 -13.067 1.00 0.00 C ATOM 1752 CG TYR A 113 34.708 -26.503 -14.156 1.00 0.00 C ATOM 1753 CD1 TYR A 113 33.747 -27.515 -14.254 1.00 0.00 C ATOM 1754 CD2 TYR A 113 35.773 -26.458 -15.065 1.00 0.00 C ATOM 1755 CE1 TYR A 113 33.846 -28.479 -15.264 1.00 0.00 C ATOM 1756 CE2 TYR A 113 35.873 -27.421 -16.075 1.00 0.00 C ATOM 1757 CZ TYR A 113 34.911 -28.434 -16.173 1.00 0.00 C ATOM 1758 OH TYR A 113 35.010 -29.383 -17.169 1.00 0.00 O ATOM 0 H TYR A 113 34.787 -24.108 -11.017 1.00 0.00 H new ATOM 0 HA TYR A 113 34.435 -26.860 -11.440 1.00 0.00 H new ATOM 0 HB2 TYR A 113 33.569 -25.133 -12.964 1.00 0.00 H new ATOM 0 HB3 TYR A 113 35.193 -24.585 -13.330 1.00 0.00 H new ATOM 0 HD1 TYR A 113 32.929 -27.552 -13.550 1.00 0.00 H new ATOM 0 HD2 TYR A 113 36.517 -25.679 -14.986 1.00 0.00 H new ATOM 0 HE1 TYR A 113 33.101 -29.257 -15.343 1.00 0.00 H new ATOM 0 HE2 TYR A 113 36.692 -27.383 -16.779 1.00 0.00 H new ATOM 0 HH TYR A 113 35.806 -29.205 -17.712 1.00 0.00 H new ATOM 1768 N PHE A 114 37.479 -25.739 -11.959 1.00 0.00 N ATOM 1769 CA PHE A 114 38.867 -26.155 -12.123 1.00 0.00 C ATOM 1770 C PHE A 114 39.315 -27.016 -10.948 1.00 0.00 C ATOM 1771 O PHE A 114 40.076 -27.967 -11.113 1.00 0.00 O ATOM 1772 CB PHE A 114 39.779 -24.933 -12.245 1.00 0.00 C ATOM 1773 CG PHE A 114 39.537 -24.249 -13.573 1.00 0.00 C ATOM 1774 CD1 PHE A 114 39.946 -24.867 -14.762 1.00 0.00 C ATOM 1775 CD2 PHE A 114 38.900 -23.002 -13.617 1.00 0.00 C ATOM 1776 CE1 PHE A 114 39.723 -24.237 -15.992 1.00 0.00 C ATOM 1777 CE2 PHE A 114 38.678 -22.373 -14.848 1.00 0.00 C ATOM 1778 CZ PHE A 114 39.088 -22.991 -16.036 1.00 0.00 C ATOM 0 H PHE A 114 37.345 -24.731 -11.878 1.00 0.00 H new ATOM 0 HA PHE A 114 38.937 -26.745 -13.037 1.00 0.00 H new ATOM 0 HB2 PHE A 114 39.586 -24.239 -11.427 1.00 0.00 H new ATOM 0 HB3 PHE A 114 40.823 -25.236 -12.166 1.00 0.00 H new ATOM 0 HD1 PHE A 114 40.434 -25.830 -14.730 1.00 0.00 H new ATOM 0 HD2 PHE A 114 38.580 -22.526 -12.702 1.00 0.00 H new ATOM 0 HE1 PHE A 114 40.041 -24.713 -16.908 1.00 0.00 H new ATOM 0 HE2 PHE A 114 38.190 -21.410 -14.881 1.00 0.00 H new ATOM 0 HZ PHE A 114 38.914 -22.506 -16.985 1.00 0.00 H new ATOM 1788 N SER A 115 38.839 -26.668 -9.763 1.00 0.00 N ATOM 1789 CA SER A 115 39.189 -27.405 -8.559 1.00 0.00 C ATOM 1790 C SER A 115 38.522 -28.772 -8.552 1.00 0.00 C ATOM 1791 O SER A 115 38.955 -29.683 -7.844 1.00 0.00 O ATOM 1792 CB SER A 115 38.771 -26.619 -7.314 1.00 0.00 C ATOM 1793 OG SER A 115 39.170 -27.335 -6.152 1.00 0.00 O ATOM 0 H SER A 115 38.210 -25.880 -9.609 1.00 0.00 H new ATOM 0 HA SER A 115 40.270 -27.543 -8.548 1.00 0.00 H new ATOM 0 HB2 SER A 115 39.231 -25.631 -7.322 1.00 0.00 H new ATOM 0 HB3 SER A 115 37.691 -26.468 -7.310 1.00 0.00 H new ATOM 0 HG SER A 115 39.369 -28.264 -6.393 1.00 0.00 H new ATOM 1799 N THR A 116 37.464 -28.907 -9.339 1.00 0.00 N ATOM 1800 CA THR A 116 36.738 -30.167 -9.416 1.00 0.00 C ATOM 1801 C THR A 116 37.686 -31.314 -9.758 1.00 0.00 C ATOM 1802 O THR A 116 38.116 -31.995 -8.843 1.00 0.00 O ATOM 1803 CB THR A 116 35.640 -30.077 -10.476 1.00 0.00 C ATOM 1804 OG1 THR A 116 34.954 -28.841 -10.342 1.00 0.00 O ATOM 1805 CG2 THR A 116 34.652 -31.228 -10.293 1.00 0.00 C ATOM 1806 OXT THR A 116 37.964 -31.494 -10.933 1.00 0.00 O ATOM 0 H THR A 116 37.091 -28.164 -9.930 1.00 0.00 H new ATOM 0 HA THR A 116 36.286 -30.362 -8.443 1.00 0.00 H new ATOM 0 HB THR A 116 36.089 -30.141 -11.467 1.00 0.00 H new ATOM 0 HG1 THR A 116 34.079 -28.903 -10.780 1.00 0.00 H new ATOM 0 HG21 THR A 116 33.871 -31.161 -11.050 1.00 0.00 H new ATOM 0 HG22 THR A 116 35.177 -32.178 -10.396 1.00 0.00 H new ATOM 0 HG23 THR A 116 34.203 -31.168 -9.302 1.00 0.00 H new TER 1814 THR A 116