USER MOD reduce.3.24.130724 H: found=0, std=0, add=886, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 737 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 98 ASN : amide:sc= -0.647 K(o=-0.65,f=-3.2!) USER MOD Set 1.2: A 115 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 46 HIS : no HE2:sc= -4.49! C(o=-3.3!,f=-2.7!) USER MOD Set 2.2: A 49 THR OG1 : rot 1:sc= 1.24 USER MOD Single : A 16 SER OG : rot 180:sc= -0.309 USER MOD Single : A 18 MET CE :methyl 157:sc= 0 (180deg=-0.434) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 THR OG1 : rot 1:sc= 0.825 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc=-0.00545 X(o=-0.0055,f=0) USER MOD Single : A 30 HIS : no HD1:sc=-0.00773 X(o=-0.0077,f=0) USER MOD Single : A 31 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 33 SER OG : rot 19:sc= 1.2 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0.00851 USER MOD Single : A 39 THR OG1 : rot 180:sc= -1.6! USER MOD Single : A 43 GLN : amide:sc= -0.747 X(o=-0.75,f=-0.5) USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 ASN : amide:sc= -0.588 K(o=-0.59,f=-4.2!) USER MOD Single : A 54 SER OG : rot 37:sc= 0.481 USER MOD Single : A 57 TYR OH : rot 130:sc= -0.137 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -2.24 K(o=-2.2,f=-2.8!) USER MOD Single : A 62 THR OG1 : rot 73:sc= -1.32 USER MOD Single : A 63 THR OG1 : rot 24:sc= 0.258 USER MOD Single : A 66 GLN : amide:sc=-0.00144 K(o=-0.0014,f=-0.76) USER MOD Single : A 69 THR OG1 : rot -107:sc= -0.662 USER MOD Single : A 73 GLN : amide:sc= -6.01! C(o=-6!,f=-8.8!) USER MOD Single : A 74 SER OG : rot -13:sc= -1.77 USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= -3.77! C(o=-3.8!,f=-13!) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 TYR OH : rot -117:sc= 0.177 USER MOD Single : A 94 ASN : amide:sc= -1.68! K(o=-1.7!,f=0) USER MOD Single : A 95 THR OG1 : rot 42:sc= 0.357 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc=-0.00241 USER MOD Single : A 106 ASN : amide:sc= -0.0226 X(o=-0.023,f=-0.023) USER MOD Single : A 108 THR OG1 : rot -100:sc= -1.19 USER MOD Single : A 111 SER OG : rot 180:sc= -0.626 USER MOD Single : A 114 ASN : amide:sc= -0.141 X(o=-0.14,f=0) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 HIS : no HD1:sc= -0.163 X(o=-0.16,f=-0.4) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 GLN : amide:sc= -0.256 K(o=-0.26,f=-1.8!) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 HIS : no HD1:sc= -0.876 K(o=-0.88,f=-0.18) USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 15 -66.941 48.815 -26.975 1.00 0.00 N ATOM 2 CA GLY A 15 -65.730 48.569 -26.212 1.00 0.00 C ATOM 3 C GLY A 15 -64.762 47.677 -26.992 1.00 0.00 C ATOM 4 O GLY A 15 -64.860 47.567 -28.213 1.00 0.00 O ATOM 0 HA2 GLY A 15 -65.246 49.517 -25.975 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -65.983 48.095 -25.264 1.00 0.00 H new ATOM 8 N SER A 16 -63.849 47.062 -26.254 1.00 0.00 N ATOM 9 CA SER A 16 -62.864 46.183 -26.862 1.00 0.00 C ATOM 10 C SER A 16 -62.151 45.370 -25.780 1.00 0.00 C ATOM 11 O SER A 16 -62.245 45.688 -24.595 1.00 0.00 O ATOM 12 CB SER A 16 -61.848 46.979 -27.684 1.00 0.00 C ATOM 13 OG SER A 16 -60.781 46.158 -28.153 1.00 0.00 O ATOM 0 H SER A 16 -63.771 47.155 -25.241 1.00 0.00 H new ATOM 0 HA SER A 16 -63.383 45.502 -27.537 1.00 0.00 H new ATOM 0 HB2 SER A 16 -62.351 47.441 -28.534 1.00 0.00 H new ATOM 0 HB3 SER A 16 -61.443 47.788 -27.076 1.00 0.00 H new ATOM 0 HG SER A 16 -60.155 46.702 -28.675 1.00 0.00 H new ATOM 18 N GLY A 17 -61.451 44.336 -26.225 1.00 0.00 N ATOM 19 CA GLY A 17 -60.721 43.476 -25.311 1.00 0.00 C ATOM 20 C GLY A 17 -59.445 44.159 -24.815 1.00 0.00 C ATOM 21 O GLY A 17 -58.630 44.615 -25.615 1.00 0.00 O ATOM 0 H GLY A 17 -61.375 44.075 -27.208 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -61.355 43.221 -24.462 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -60.467 42.541 -25.811 1.00 0.00 H new ATOM 25 N MET A 18 -59.311 44.207 -23.497 1.00 0.00 N ATOM 26 CA MET A 18 -58.148 44.826 -22.886 1.00 0.00 C ATOM 27 C MET A 18 -58.220 44.741 -21.360 1.00 0.00 C ATOM 28 O MET A 18 -59.102 44.082 -20.812 1.00 0.00 O ATOM 29 CB MET A 18 -58.068 46.294 -23.312 1.00 0.00 C ATOM 30 CG MET A 18 -59.348 47.043 -22.941 1.00 0.00 C ATOM 31 SD MET A 18 -59.485 48.536 -23.911 1.00 0.00 S ATOM 32 CE MET A 18 -61.245 48.816 -23.802 1.00 0.00 C ATOM 0 H MET A 18 -59.989 43.827 -22.836 1.00 0.00 H new ATOM 0 HA MET A 18 -57.258 44.292 -23.220 1.00 0.00 H new ATOM 0 HB2 MET A 18 -57.212 46.769 -22.832 1.00 0.00 H new ATOM 0 HB3 MET A 18 -57.905 46.356 -24.388 1.00 0.00 H new ATOM 0 HG2 MET A 18 -60.215 46.406 -23.115 1.00 0.00 H new ATOM 0 HG3 MET A 18 -59.341 47.289 -21.879 1.00 0.00 H new ATOM 0 HE1 MET A 18 -61.457 49.870 -23.981 1.00 0.00 H new ATOM 0 HE2 MET A 18 -61.757 48.211 -24.550 1.00 0.00 H new ATOM 0 HE3 MET A 18 -61.597 48.538 -22.808 1.00 0.00 H new ATOM 40 N LYS A 19 -57.279 45.416 -20.716 1.00 0.00 N ATOM 41 CA LYS A 19 -57.226 45.425 -19.264 1.00 0.00 C ATOM 42 C LYS A 19 -57.007 43.998 -18.758 1.00 0.00 C ATOM 43 O LYS A 19 -56.844 43.072 -19.551 1.00 0.00 O ATOM 44 CB LYS A 19 -58.470 46.099 -18.686 1.00 0.00 C ATOM 45 CG LYS A 19 -58.331 47.624 -18.712 1.00 0.00 C ATOM 46 CD LYS A 19 -59.601 48.299 -18.191 1.00 0.00 C ATOM 47 CE LYS A 19 -59.347 49.775 -17.879 1.00 0.00 C ATOM 48 NZ LYS A 19 -60.579 50.415 -17.365 1.00 0.00 N ATOM 0 H LYS A 19 -56.547 45.960 -21.173 1.00 0.00 H new ATOM 0 HA LYS A 19 -56.381 46.020 -18.917 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -59.348 45.801 -19.258 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -58.627 45.762 -17.661 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -57.479 47.926 -18.103 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -58.129 47.957 -19.730 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -60.395 48.212 -18.933 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -59.947 47.788 -17.293 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -58.549 49.865 -17.142 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -59.010 50.290 -18.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -60.390 51.416 -17.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -61.331 50.345 -18.080 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -60.883 49.933 -16.495 1.00 0.00 H new ATOM 58 N GLU A 20 -57.012 43.864 -17.440 1.00 0.00 N ATOM 59 CA GLU A 20 -56.818 42.566 -16.818 1.00 0.00 C ATOM 60 C GLU A 20 -55.464 41.980 -17.227 1.00 0.00 C ATOM 61 O GLU A 20 -55.239 41.692 -18.402 1.00 0.00 O ATOM 62 CB GLU A 20 -57.959 41.611 -17.174 1.00 0.00 C ATOM 63 CG GLU A 20 -59.242 41.990 -16.431 1.00 0.00 C ATOM 64 CD GLU A 20 -60.356 40.980 -16.710 1.00 0.00 C ATOM 65 OE1 GLU A 20 -60.018 39.783 -16.841 1.00 0.00 O ATOM 66 OE2 GLU A 20 -61.521 41.427 -16.788 1.00 0.00 O ATOM 0 H GLU A 20 -57.148 44.634 -16.785 1.00 0.00 H new ATOM 0 HA GLU A 20 -56.824 42.698 -15.736 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -58.136 41.635 -18.249 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -57.676 40.589 -16.920 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -59.046 42.034 -15.360 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -59.564 42.985 -16.738 1.00 0.00 H new ATOM 71 N THR A 21 -54.601 41.819 -16.235 1.00 0.00 N ATOM 72 CA THR A 21 -53.277 41.272 -16.477 1.00 0.00 C ATOM 73 C THR A 21 -52.656 40.779 -15.169 1.00 0.00 C ATOM 74 O THR A 21 -52.999 41.265 -14.093 1.00 0.00 O ATOM 75 CB THR A 21 -52.442 42.346 -17.179 1.00 0.00 C ATOM 76 OG1 THR A 21 -52.880 42.297 -18.533 1.00 0.00 O ATOM 77 CG2 THR A 21 -50.959 41.979 -17.253 1.00 0.00 C ATOM 0 H THR A 21 -54.793 42.058 -15.262 1.00 0.00 H new ATOM 0 HA THR A 21 -53.323 40.399 -17.128 1.00 0.00 H new ATOM 0 HB THR A 21 -52.555 43.294 -16.654 1.00 0.00 H new ATOM 0 HG1 THR A 21 -53.579 41.617 -18.626 1.00 0.00 H new ATOM 0 HG21 THR A 21 -50.412 42.774 -17.760 1.00 0.00 H new ATOM 0 HG22 THR A 21 -50.565 41.853 -16.245 1.00 0.00 H new ATOM 0 HG23 THR A 21 -50.842 41.048 -17.807 1.00 0.00 H new ATOM 85 N ALA A 22 -51.755 39.817 -15.304 1.00 0.00 N ATOM 86 CA ALA A 22 -51.084 39.252 -14.146 1.00 0.00 C ATOM 87 C ALA A 22 -49.666 38.832 -14.539 1.00 0.00 C ATOM 88 O ALA A 22 -49.348 38.737 -15.723 1.00 0.00 O ATOM 89 CB ALA A 22 -51.906 38.084 -13.599 1.00 0.00 C ATOM 0 H ALA A 22 -51.474 39.414 -16.198 1.00 0.00 H new ATOM 0 HA ALA A 22 -51.001 39.993 -13.351 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -51.402 37.660 -12.730 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -52.894 38.440 -13.308 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -52.008 37.319 -14.369 1.00 0.00 H new ATOM 95 N ALA A 23 -48.851 38.591 -13.521 1.00 0.00 N ATOM 96 CA ALA A 23 -47.475 38.184 -13.745 1.00 0.00 C ATOM 97 C ALA A 23 -46.799 37.921 -12.397 1.00 0.00 C ATOM 98 O ALA A 23 -47.161 38.525 -11.388 1.00 0.00 O ATOM 99 CB ALA A 23 -46.750 39.258 -14.560 1.00 0.00 C ATOM 0 H ALA A 23 -49.118 38.670 -12.540 1.00 0.00 H new ATOM 0 HA ALA A 23 -47.438 37.258 -14.319 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -45.717 38.952 -14.728 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -47.251 39.387 -15.520 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -46.765 40.201 -14.014 1.00 0.00 H new ATOM 105 N ALA A 24 -45.831 37.017 -12.423 1.00 0.00 N ATOM 106 CA ALA A 24 -45.103 36.666 -11.216 1.00 0.00 C ATOM 107 C ALA A 24 -43.818 35.928 -11.597 1.00 0.00 C ATOM 108 O ALA A 24 -43.560 35.692 -12.777 1.00 0.00 O ATOM 109 CB ALA A 24 -46.003 35.834 -10.300 1.00 0.00 C ATOM 0 H ALA A 24 -45.534 36.517 -13.261 1.00 0.00 H new ATOM 0 HA ALA A 24 -44.818 37.563 -10.666 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -45.456 35.571 -9.394 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -46.887 36.413 -10.035 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -46.307 34.924 -10.818 1.00 0.00 H new ATOM 115 N LYS A 25 -43.045 35.584 -10.577 1.00 0.00 N ATOM 116 CA LYS A 25 -41.794 34.878 -10.790 1.00 0.00 C ATOM 117 C LYS A 25 -41.203 34.476 -9.438 1.00 0.00 C ATOM 118 O LYS A 25 -41.747 34.824 -8.391 1.00 0.00 O ATOM 119 CB LYS A 25 -40.846 35.715 -11.651 1.00 0.00 C ATOM 120 CG LYS A 25 -40.952 35.321 -13.126 1.00 0.00 C ATOM 121 CD LYS A 25 -41.341 36.523 -13.989 1.00 0.00 C ATOM 122 CE LYS A 25 -40.170 36.968 -14.867 1.00 0.00 C ATOM 123 NZ LYS A 25 -40.527 36.862 -16.300 1.00 0.00 N ATOM 0 H LYS A 25 -43.262 35.782 -9.600 1.00 0.00 H new ATOM 0 HA LYS A 25 -41.967 33.958 -11.349 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -41.083 36.773 -11.536 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -39.821 35.578 -11.307 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -39.999 34.917 -13.467 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -41.693 34.530 -13.242 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -42.193 36.264 -14.617 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -41.655 37.348 -13.350 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -39.899 37.997 -14.629 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -39.296 36.352 -14.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -39.721 37.168 -16.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -40.763 35.875 -16.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -41.348 37.469 -16.499 1.00 0.00 H new ATOM 133 N PHE A 26 -40.097 33.749 -9.503 1.00 0.00 N ATOM 134 CA PHE A 26 -39.427 33.297 -8.296 1.00 0.00 C ATOM 135 C PHE A 26 -38.015 32.797 -8.608 1.00 0.00 C ATOM 136 O PHE A 26 -37.611 32.751 -9.769 1.00 0.00 O ATOM 137 CB PHE A 26 -40.252 32.139 -7.733 1.00 0.00 C ATOM 138 CG PHE A 26 -40.112 30.834 -8.520 1.00 0.00 C ATOM 139 CD1 PHE A 26 -40.632 30.737 -9.773 1.00 0.00 C ATOM 140 CD2 PHE A 26 -39.468 29.772 -7.968 1.00 0.00 C ATOM 141 CE1 PHE A 26 -40.503 29.527 -10.505 1.00 0.00 C ATOM 142 CE2 PHE A 26 -39.339 28.562 -8.698 1.00 0.00 C ATOM 143 CZ PHE A 26 -39.859 28.464 -9.952 1.00 0.00 C ATOM 0 H PHE A 26 -39.648 33.462 -10.373 1.00 0.00 H new ATOM 0 HA PHE A 26 -39.344 34.120 -7.586 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -39.953 31.962 -6.700 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -41.302 32.430 -7.715 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -41.143 31.581 -10.212 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -39.054 29.849 -6.973 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -40.916 29.451 -11.500 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -38.828 27.718 -8.258 1.00 0.00 H new ATOM 0 HZ PHE A 26 -39.760 27.543 -10.508 1.00 0.00 H new ATOM 152 N GLU A 27 -37.302 32.434 -7.552 1.00 0.00 N ATOM 153 CA GLU A 27 -35.944 31.940 -7.698 1.00 0.00 C ATOM 154 C GLU A 27 -35.406 31.459 -6.349 1.00 0.00 C ATOM 155 O GLU A 27 -36.004 31.725 -5.307 1.00 0.00 O ATOM 156 CB GLU A 27 -35.032 33.009 -8.302 1.00 0.00 C ATOM 157 CG GLU A 27 -34.875 34.196 -7.349 1.00 0.00 C ATOM 158 CD GLU A 27 -34.513 35.470 -8.116 1.00 0.00 C ATOM 159 OE1 GLU A 27 -33.308 35.633 -8.410 1.00 0.00 O ATOM 160 OE2 GLU A 27 -35.449 36.252 -8.391 1.00 0.00 O ATOM 0 H GLU A 27 -37.640 32.472 -6.590 1.00 0.00 H new ATOM 0 HA GLU A 27 -35.959 31.093 -8.384 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -34.054 32.579 -8.517 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -35.445 33.351 -9.251 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -35.803 34.350 -6.798 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -34.100 33.977 -6.614 1.00 0.00 H new ATOM 165 N ARG A 28 -34.282 30.759 -6.411 1.00 0.00 N ATOM 166 CA ARG A 28 -33.657 30.238 -5.208 1.00 0.00 C ATOM 167 C ARG A 28 -32.296 29.624 -5.540 1.00 0.00 C ATOM 168 O ARG A 28 -31.974 29.414 -6.708 1.00 0.00 O ATOM 169 CB ARG A 28 -34.538 29.179 -4.543 1.00 0.00 C ATOM 170 CG ARG A 28 -34.804 28.011 -5.494 1.00 0.00 C ATOM 171 CD ARG A 28 -36.158 28.168 -6.191 1.00 0.00 C ATOM 172 NE ARG A 28 -36.075 27.661 -7.578 1.00 0.00 N ATOM 173 CZ ARG A 28 -35.922 26.368 -7.897 1.00 0.00 C ATOM 174 NH1 ARG A 28 -35.833 25.445 -6.931 1.00 0.00 N ATOM 175 NH2 ARG A 28 -35.857 25.999 -9.185 1.00 0.00 N ATOM 0 H ARG A 28 -33.788 30.541 -7.277 1.00 0.00 H new ATOM 0 HA ARG A 28 -33.525 31.070 -4.517 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -34.052 28.813 -3.638 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -35.484 29.627 -4.238 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -34.011 27.957 -6.240 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -34.783 27.073 -4.939 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -36.925 27.622 -5.641 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -36.454 29.217 -6.196 1.00 0.00 H new ATOM 0 HE ARG A 28 -36.138 28.337 -8.339 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -35.882 25.726 -5.952 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -35.717 24.461 -7.175 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -35.924 26.702 -9.921 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -35.741 25.015 -9.428 1.00 0.00 H new ATOM 186 N GLN A 29 -31.533 29.353 -4.492 1.00 0.00 N ATOM 187 CA GLN A 29 -30.214 28.766 -4.657 1.00 0.00 C ATOM 188 C GLN A 29 -30.188 27.347 -4.086 1.00 0.00 C ATOM 189 O GLN A 29 -29.969 26.383 -4.818 1.00 0.00 O ATOM 190 CB GLN A 29 -29.140 29.640 -4.005 1.00 0.00 C ATOM 191 CG GLN A 29 -27.883 29.704 -4.875 1.00 0.00 C ATOM 192 CD GLN A 29 -26.628 29.420 -4.047 1.00 0.00 C ATOM 193 OE1 GLN A 29 -26.190 30.225 -3.241 1.00 0.00 O ATOM 194 NE2 GLN A 29 -26.075 28.235 -4.288 1.00 0.00 N ATOM 0 H GLN A 29 -31.803 29.529 -3.524 1.00 0.00 H new ATOM 0 HA GLN A 29 -29.993 28.711 -5.723 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -29.530 30.646 -3.849 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -28.887 29.240 -3.023 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -27.960 28.979 -5.685 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -27.804 30.689 -5.335 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -26.492 27.608 -4.976 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -25.234 27.953 -3.785 1.00 0.00 H new ATOM 201 N HIS A 30 -30.415 27.264 -2.783 1.00 0.00 N ATOM 202 CA HIS A 30 -30.420 25.979 -2.105 1.00 0.00 C ATOM 203 C HIS A 30 -29.084 25.271 -2.337 1.00 0.00 C ATOM 204 O HIS A 30 -28.240 25.759 -3.086 1.00 0.00 O ATOM 205 CB HIS A 30 -31.621 25.138 -2.543 1.00 0.00 C ATOM 206 CG HIS A 30 -32.470 24.637 -1.400 1.00 0.00 C ATOM 207 ND1 HIS A 30 -33.703 25.182 -1.086 1.00 0.00 N ATOM 208 CD2 HIS A 30 -32.252 23.636 -0.500 1.00 0.00 C ATOM 209 CE1 HIS A 30 -34.194 24.531 -0.042 1.00 0.00 C ATOM 210 NE2 HIS A 30 -33.294 23.574 0.319 1.00 0.00 N ATOM 0 H HIS A 30 -30.597 28.066 -2.179 1.00 0.00 H new ATOM 0 HA HIS A 30 -30.529 26.131 -1.031 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -32.244 25.733 -3.211 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -31.263 24.284 -3.118 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -31.379 23.001 -0.461 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -35.142 24.725 0.439 1.00 0.00 H new ATOM 0 HE2 HIS A 30 -33.403 22.918 1.092 1.00 0.00 H new ATOM 217 N MET A 31 -28.934 24.130 -1.680 1.00 0.00 N ATOM 218 CA MET A 31 -27.715 23.349 -1.805 1.00 0.00 C ATOM 219 C MET A 31 -26.499 24.152 -1.337 1.00 0.00 C ATOM 220 O MET A 31 -26.216 25.224 -1.871 1.00 0.00 O ATOM 221 CB MET A 31 -27.522 22.934 -3.266 1.00 0.00 C ATOM 222 CG MET A 31 -28.595 21.933 -3.698 1.00 0.00 C ATOM 223 SD MET A 31 -28.023 20.992 -5.102 1.00 0.00 S ATOM 224 CE MET A 31 -28.582 19.363 -4.632 1.00 0.00 C ATOM 0 H MET A 31 -29.637 23.728 -1.059 1.00 0.00 H new ATOM 0 HA MET A 31 -27.806 22.464 -1.176 1.00 0.00 H new ATOM 0 HB2 MET A 31 -27.563 23.815 -3.906 1.00 0.00 H new ATOM 0 HB3 MET A 31 -26.534 22.492 -3.395 1.00 0.00 H new ATOM 0 HG2 MET A 31 -28.831 21.262 -2.872 1.00 0.00 H new ATOM 0 HG3 MET A 31 -29.514 22.460 -3.953 1.00 0.00 H new ATOM 0 HE1 MET A 31 -28.305 18.646 -5.405 1.00 0.00 H new ATOM 0 HE2 MET A 31 -28.117 19.077 -3.688 1.00 0.00 H new ATOM 0 HE3 MET A 31 -29.666 19.370 -4.515 1.00 0.00 H new ATOM 232 N ASP A 32 -25.813 23.602 -0.347 1.00 0.00 N ATOM 233 CA ASP A 32 -24.633 24.253 0.199 1.00 0.00 C ATOM 234 C ASP A 32 -24.079 23.412 1.350 1.00 0.00 C ATOM 235 O ASP A 32 -24.793 22.595 1.928 1.00 0.00 O ATOM 236 CB ASP A 32 -24.976 25.640 0.748 1.00 0.00 C ATOM 237 CG ASP A 32 -23.830 26.654 0.704 1.00 0.00 C ATOM 238 OD1 ASP A 32 -22.816 26.393 1.386 1.00 0.00 O ATOM 239 OD2 ASP A 32 -23.996 27.665 -0.011 1.00 0.00 O ATOM 0 H ASP A 32 -26.051 22.713 0.092 1.00 0.00 H new ATOM 0 HA ASP A 32 -23.900 24.353 -0.602 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -25.817 26.040 0.182 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -25.308 25.534 1.781 1.00 0.00 H new ATOM 243 N SER A 33 -22.807 23.641 1.648 1.00 0.00 N ATOM 244 CA SER A 33 -22.148 22.915 2.720 1.00 0.00 C ATOM 245 C SER A 33 -20.807 23.573 3.050 1.00 0.00 C ATOM 246 O SER A 33 -20.173 24.169 2.181 1.00 0.00 O ATOM 247 CB SER A 33 -21.940 21.446 2.342 1.00 0.00 C ATOM 248 OG SER A 33 -23.110 20.665 2.571 1.00 0.00 O ATOM 0 H SER A 33 -22.217 24.319 1.166 1.00 0.00 H new ATOM 0 HA SER A 33 -22.788 22.949 3.601 1.00 0.00 H new ATOM 0 HB2 SER A 33 -21.659 21.378 1.291 1.00 0.00 H new ATOM 0 HB3 SER A 33 -21.112 21.037 2.920 1.00 0.00 H new ATOM 0 HG SER A 33 -23.889 21.255 2.639 1.00 0.00 H new ATOM 253 N PRO A 34 -20.404 23.438 4.342 1.00 0.00 N ATOM 254 CA PRO A 34 -19.150 24.013 4.797 1.00 0.00 C ATOM 255 C PRO A 34 -17.958 23.191 4.304 1.00 0.00 C ATOM 256 O PRO A 34 -18.089 22.401 3.371 1.00 0.00 O ATOM 257 CB PRO A 34 -19.260 24.047 6.313 1.00 0.00 C ATOM 258 CG PRO A 34 -20.367 23.070 6.672 1.00 0.00 C ATOM 259 CD PRO A 34 -21.128 22.738 5.399 1.00 0.00 C ATOM 0 HA PRO A 34 -18.978 25.013 4.400 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -18.318 23.759 6.780 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -19.496 25.051 6.665 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -19.949 22.165 7.114 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -21.036 23.507 7.413 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -21.150 21.663 5.219 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -22.164 23.072 5.458 1.00 0.00 H new ATOM 264 N ASP A 35 -16.823 23.405 4.952 1.00 0.00 N ATOM 265 CA ASP A 35 -15.608 22.693 4.590 1.00 0.00 C ATOM 266 C ASP A 35 -15.193 21.782 5.748 1.00 0.00 C ATOM 267 O ASP A 35 -15.316 22.157 6.912 1.00 0.00 O ATOM 268 CB ASP A 35 -14.459 23.667 4.320 1.00 0.00 C ATOM 269 CG ASP A 35 -14.854 24.939 3.565 1.00 0.00 C ATOM 270 OD1 ASP A 35 -15.270 25.898 4.249 1.00 0.00 O ATOM 271 OD2 ASP A 35 -14.730 24.922 2.322 1.00 0.00 O ATOM 0 H ASP A 35 -16.718 24.061 5.726 1.00 0.00 H new ATOM 0 HA ASP A 35 -15.811 22.115 3.688 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -14.012 23.952 5.273 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -13.689 23.148 3.749 1.00 0.00 H new ATOM 275 N LEU A 36 -14.708 20.604 5.385 1.00 0.00 N ATOM 276 CA LEU A 36 -14.274 19.636 6.378 1.00 0.00 C ATOM 277 C LEU A 36 -13.160 18.769 5.787 1.00 0.00 C ATOM 278 O LEU A 36 -13.421 17.688 5.265 1.00 0.00 O ATOM 279 CB LEU A 36 -15.467 18.832 6.901 1.00 0.00 C ATOM 280 CG LEU A 36 -15.594 18.734 8.422 1.00 0.00 C ATOM 281 CD1 LEU A 36 -16.953 18.155 8.822 1.00 0.00 C ATOM 282 CD2 LEU A 36 -14.434 17.936 9.019 1.00 0.00 C ATOM 0 H LEU A 36 -14.606 20.298 4.417 1.00 0.00 H new ATOM 0 HA LEU A 36 -13.856 20.144 7.247 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -16.381 19.278 6.508 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -15.405 17.822 6.496 1.00 0.00 H new ATOM 0 HG LEU A 36 -15.538 19.741 8.835 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -17.018 18.096 9.908 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -17.748 18.799 8.446 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -17.063 17.157 8.397 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -14.549 17.882 10.102 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -14.433 16.928 8.603 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -13.492 18.428 8.778 1.00 0.00 H new ATOM 293 N GLY A 37 -11.941 19.280 5.889 1.00 0.00 N ATOM 294 CA GLY A 37 -10.786 18.566 5.370 1.00 0.00 C ATOM 295 C GLY A 37 -9.504 19.013 6.076 1.00 0.00 C ATOM 296 O GLY A 37 -8.471 19.201 5.434 1.00 0.00 O ATOM 0 H GLY A 37 -11.728 20.178 6.323 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -10.925 17.494 5.506 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -10.696 18.743 4.298 1.00 0.00 H new ATOM 300 N THR A 38 -9.612 19.170 7.387 1.00 0.00 N ATOM 301 CA THR A 38 -8.473 19.592 8.186 1.00 0.00 C ATOM 302 C THR A 38 -7.551 18.404 8.468 1.00 0.00 C ATOM 303 O THR A 38 -7.187 18.155 9.616 1.00 0.00 O ATOM 304 CB THR A 38 -9.007 20.260 9.454 1.00 0.00 C ATOM 305 OG1 THR A 38 -9.752 19.232 10.101 1.00 0.00 O ATOM 306 CG2 THR A 38 -10.048 21.341 9.152 1.00 0.00 C ATOM 0 H THR A 38 -10.470 19.013 7.916 1.00 0.00 H new ATOM 0 HA THR A 38 -7.862 20.319 7.651 1.00 0.00 H new ATOM 0 HB THR A 38 -8.178 20.699 10.010 1.00 0.00 H new ATOM 0 HG1 THR A 38 -10.133 19.579 10.935 1.00 0.00 H new ATOM 0 HG21 THR A 38 -10.395 21.783 10.086 1.00 0.00 H new ATOM 0 HG22 THR A 38 -9.599 22.114 8.529 1.00 0.00 H new ATOM 0 HG23 THR A 38 -10.893 20.896 8.626 1.00 0.00 H new ATOM 314 N THR A 39 -7.198 17.704 7.400 1.00 0.00 N ATOM 315 CA THR A 39 -6.325 16.548 7.518 1.00 0.00 C ATOM 316 C THR A 39 -5.570 16.315 6.207 1.00 0.00 C ATOM 317 O THR A 39 -5.095 17.262 5.584 1.00 0.00 O ATOM 318 CB THR A 39 -7.178 15.353 7.949 1.00 0.00 C ATOM 319 OG1 THR A 39 -8.098 15.903 8.887 1.00 0.00 O ATOM 320 CG2 THR A 39 -6.383 14.329 8.762 1.00 0.00 C ATOM 0 H THR A 39 -7.501 17.915 6.449 1.00 0.00 H new ATOM 0 HA THR A 39 -5.557 16.707 8.275 1.00 0.00 H new ATOM 0 HB THR A 39 -7.597 14.869 7.067 1.00 0.00 H new ATOM 0 HG1 THR A 39 -8.691 15.196 9.217 1.00 0.00 H new ATOM 0 HG21 THR A 39 -7.035 13.502 9.042 1.00 0.00 H new ATOM 0 HG22 THR A 39 -5.555 13.951 8.162 1.00 0.00 H new ATOM 0 HG23 THR A 39 -5.992 14.804 9.662 1.00 0.00 H new ATOM 328 N LEU A 40 -5.481 15.048 5.831 1.00 0.00 N ATOM 329 CA LEU A 40 -4.792 14.677 4.607 1.00 0.00 C ATOM 330 C LEU A 40 -5.798 14.084 3.619 1.00 0.00 C ATOM 331 O LEU A 40 -5.873 14.515 2.469 1.00 0.00 O ATOM 332 CB LEU A 40 -3.614 13.751 4.915 1.00 0.00 C ATOM 333 CG LEU A 40 -3.686 12.990 6.240 1.00 0.00 C ATOM 334 CD1 LEU A 40 -2.845 11.713 6.187 1.00 0.00 C ATOM 335 CD2 LEU A 40 -3.288 13.890 7.412 1.00 0.00 C ATOM 0 H LEU A 40 -5.875 14.265 6.353 1.00 0.00 H new ATOM 0 HA LEU A 40 -4.360 15.558 4.132 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -3.527 13.025 4.106 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -2.700 14.345 4.909 1.00 0.00 H new ATOM 0 HG LEU A 40 -4.720 12.687 6.403 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -2.914 11.192 7.142 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -3.216 11.066 5.392 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -1.805 11.971 5.989 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -3.348 13.324 8.342 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -2.267 14.245 7.268 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -3.965 14.743 7.462 1.00 0.00 H new ATOM 346 N LEU A 41 -6.547 13.104 4.102 1.00 0.00 N ATOM 347 CA LEU A 41 -7.545 12.447 3.276 1.00 0.00 C ATOM 348 C LEU A 41 -6.847 11.705 2.135 1.00 0.00 C ATOM 349 O LEU A 41 -6.891 12.143 0.987 1.00 0.00 O ATOM 350 CB LEU A 41 -8.595 13.452 2.804 1.00 0.00 C ATOM 351 CG LEU A 41 -9.629 13.882 3.847 1.00 0.00 C ATOM 352 CD1 LEU A 41 -9.533 15.382 4.129 1.00 0.00 C ATOM 353 CD2 LEU A 41 -11.040 13.467 3.424 1.00 0.00 C ATOM 0 H LEU A 41 -6.483 12.749 5.056 1.00 0.00 H new ATOM 0 HA LEU A 41 -8.089 11.702 3.856 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -8.080 14.342 2.443 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -9.124 13.022 1.953 1.00 0.00 H new ATOM 0 HG LEU A 41 -9.408 13.365 4.780 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -10.279 15.661 4.873 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -8.538 15.618 4.506 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -9.714 15.938 3.209 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -11.755 13.785 4.183 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -11.288 13.937 2.472 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -11.083 12.383 3.315 1.00 0.00 H new ATOM 364 N GLU A 42 -6.221 10.592 2.490 1.00 0.00 N ATOM 365 CA GLU A 42 -5.516 9.784 1.509 1.00 0.00 C ATOM 366 C GLU A 42 -4.399 10.600 0.855 1.00 0.00 C ATOM 367 O GLU A 42 -4.266 10.610 -0.368 1.00 0.00 O ATOM 368 CB GLU A 42 -6.480 9.233 0.457 1.00 0.00 C ATOM 369 CG GLU A 42 -7.403 8.174 1.061 1.00 0.00 C ATOM 370 CD GLU A 42 -8.841 8.356 0.572 1.00 0.00 C ATOM 371 OE1 GLU A 42 -9.386 9.457 0.806 1.00 0.00 O ATOM 372 OE2 GLU A 42 -9.364 7.391 -0.027 1.00 0.00 O ATOM 0 H GLU A 42 -6.187 10.231 3.443 1.00 0.00 H new ATOM 0 HA GLU A 42 -5.067 8.934 2.022 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -7.076 10.046 0.043 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -5.915 8.800 -0.368 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -7.047 7.180 0.792 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -7.374 8.239 2.149 1.00 0.00 H new ATOM 377 N GLN A 43 -3.623 11.265 1.699 1.00 0.00 N ATOM 378 CA GLN A 43 -2.521 12.081 1.219 1.00 0.00 C ATOM 379 C GLN A 43 -3.010 13.052 0.142 1.00 0.00 C ATOM 380 O GLN A 43 -3.539 14.117 0.457 1.00 0.00 O ATOM 381 CB GLN A 43 -1.381 11.208 0.691 1.00 0.00 C ATOM 382 CG GLN A 43 -0.506 10.698 1.838 1.00 0.00 C ATOM 383 CD GLN A 43 0.090 11.861 2.633 1.00 0.00 C ATOM 384 OE1 GLN A 43 0.842 12.674 2.124 1.00 0.00 O ATOM 385 NE2 GLN A 43 -0.288 11.895 3.908 1.00 0.00 N ATOM 0 H GLN A 43 -3.736 11.255 2.713 1.00 0.00 H new ATOM 0 HA GLN A 43 -2.133 12.661 2.056 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -1.791 10.363 0.138 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -0.773 11.782 -0.008 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -1.099 10.067 2.500 1.00 0.00 H new ATOM 0 HG3 GLN A 43 0.296 10.077 1.440 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -0.921 11.183 4.271 1.00 0.00 H new ATOM 0 HE22 GLN A 43 0.055 12.634 4.522 1.00 0.00 H new ATOM 392 N TYR A 44 -2.816 12.650 -1.106 1.00 0.00 N ATOM 393 CA TYR A 44 -3.231 13.472 -2.229 1.00 0.00 C ATOM 394 C TYR A 44 -2.961 12.761 -3.557 1.00 0.00 C ATOM 395 O TYR A 44 -1.987 13.066 -4.242 1.00 0.00 O ATOM 396 CB TYR A 44 -2.379 14.740 -2.162 1.00 0.00 C ATOM 397 CG TYR A 44 -3.106 15.948 -1.568 1.00 0.00 C ATOM 398 CD1 TYR A 44 -4.228 16.455 -2.195 1.00 0.00 C ATOM 399 CD2 TYR A 44 -2.642 16.531 -0.407 1.00 0.00 C ATOM 400 CE1 TYR A 44 -4.912 17.591 -1.636 1.00 0.00 C ATOM 401 CE2 TYR A 44 -3.327 17.668 0.151 1.00 0.00 C ATOM 402 CZ TYR A 44 -4.429 18.143 -0.491 1.00 0.00 C ATOM 403 OH TYR A 44 -5.075 19.216 0.037 1.00 0.00 O ATOM 0 H TYR A 44 -2.377 11.766 -1.363 1.00 0.00 H new ATOM 0 HA TYR A 44 -4.299 13.683 -2.176 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -1.489 14.536 -1.567 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -2.040 14.991 -3.167 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -4.591 15.999 -3.104 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -1.765 16.135 0.083 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -5.790 17.997 -2.116 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -2.974 18.134 1.059 1.00 0.00 H new ATOM 0 HH TYR A 44 -4.618 19.503 0.855 1.00 0.00 H new ATOM 412 N CYS A 45 -3.843 11.826 -3.881 1.00 0.00 N ATOM 413 CA CYS A 45 -3.712 11.069 -5.114 1.00 0.00 C ATOM 414 C CYS A 45 -5.104 10.907 -5.728 1.00 0.00 C ATOM 415 O CYS A 45 -5.681 9.821 -5.688 1.00 0.00 O ATOM 416 CB CYS A 45 -3.031 9.720 -4.881 1.00 0.00 C ATOM 417 SG CYS A 45 -3.993 8.538 -3.866 1.00 0.00 S ATOM 0 H CYS A 45 -4.651 11.576 -3.311 1.00 0.00 H new ATOM 0 HA CYS A 45 -3.070 11.610 -5.809 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -2.824 9.262 -5.848 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -2.069 9.893 -4.398 1.00 0.00 H new ATOM 421 N HIS A 46 -5.605 12.002 -6.280 1.00 0.00 N ATOM 422 CA HIS A 46 -6.919 11.994 -6.900 1.00 0.00 C ATOM 423 C HIS A 46 -7.064 10.750 -7.779 1.00 0.00 C ATOM 424 O HIS A 46 -6.068 10.145 -8.175 1.00 0.00 O ATOM 425 CB HIS A 46 -7.164 13.295 -7.669 1.00 0.00 C ATOM 426 CG HIS A 46 -8.584 13.462 -8.155 1.00 0.00 C ATOM 427 ND1 HIS A 46 -9.424 14.458 -7.688 1.00 0.00 N ATOM 428 CD2 HIS A 46 -9.302 12.751 -9.071 1.00 0.00 C ATOM 429 CE1 HIS A 46 -10.592 14.342 -8.302 1.00 0.00 C ATOM 430 NE2 HIS A 46 -10.515 13.283 -9.158 1.00 0.00 N ATOM 0 H HIS A 46 -5.124 12.901 -6.311 1.00 0.00 H new ATOM 0 HA HIS A 46 -7.689 11.944 -6.130 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -6.909 14.138 -7.027 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -6.491 13.331 -8.526 1.00 0.00 H new ATOM 0 HD1 HIS A 46 -9.184 15.162 -6.990 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -8.944 11.899 -9.631 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -11.454 14.975 -8.151 1.00 0.00 H new ATOM 437 N ARG A 47 -8.313 10.404 -8.058 1.00 0.00 N ATOM 438 CA ARG A 47 -8.600 9.244 -8.882 1.00 0.00 C ATOM 439 C ARG A 47 -8.444 9.592 -10.364 1.00 0.00 C ATOM 440 O ARG A 47 -7.353 9.482 -10.920 1.00 0.00 O ATOM 441 CB ARG A 47 -10.020 8.730 -8.634 1.00 0.00 C ATOM 442 CG ARG A 47 -10.423 7.696 -9.687 1.00 0.00 C ATOM 443 CD ARG A 47 -10.851 6.383 -9.030 1.00 0.00 C ATOM 444 NE ARG A 47 -12.325 6.330 -8.917 1.00 0.00 N ATOM 445 CZ ARG A 47 -13.138 5.878 -9.881 1.00 0.00 C ATOM 446 NH1 ARG A 47 -12.625 5.436 -11.037 1.00 0.00 N ATOM 447 NH2 ARG A 47 -14.464 5.868 -9.689 1.00 0.00 N ATOM 0 H ARG A 47 -9.136 10.907 -7.728 1.00 0.00 H new ATOM 0 HA ARG A 47 -7.889 8.463 -8.612 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -10.081 8.285 -7.641 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -10.721 9.565 -8.653 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -11.241 8.088 -10.292 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -9.586 7.514 -10.362 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -10.493 5.539 -9.619 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -10.399 6.297 -8.042 1.00 0.00 H new ATOM 0 HE ARG A 47 -12.749 6.659 -8.050 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -11.616 5.444 -11.183 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -13.244 5.092 -11.771 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -14.854 6.205 -8.809 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -15.083 5.524 -10.423 1.00 0.00 H new ATOM 458 N THR A 48 -9.552 10.006 -10.961 1.00 0.00 N ATOM 459 CA THR A 48 -9.552 10.372 -12.368 1.00 0.00 C ATOM 460 C THR A 48 -10.918 10.929 -12.774 1.00 0.00 C ATOM 461 O THR A 48 -10.998 11.908 -13.515 1.00 0.00 O ATOM 462 CB THR A 48 -9.133 9.143 -13.175 1.00 0.00 C ATOM 463 OG1 THR A 48 -8.925 9.647 -14.493 1.00 0.00 O ATOM 464 CG2 THR A 48 -10.269 8.133 -13.338 1.00 0.00 C ATOM 0 H THR A 48 -10.456 10.096 -10.497 1.00 0.00 H new ATOM 0 HA THR A 48 -8.838 11.170 -12.570 1.00 0.00 H new ATOM 0 HB THR A 48 -8.286 8.661 -12.686 1.00 0.00 H new ATOM 0 HG1 THR A 48 -8.649 8.915 -15.083 1.00 0.00 H new ATOM 0 HG21 THR A 48 -9.917 7.280 -13.919 1.00 0.00 H new ATOM 0 HG22 THR A 48 -10.597 7.793 -12.356 1.00 0.00 H new ATOM 0 HG23 THR A 48 -11.104 8.605 -13.856 1.00 0.00 H new ATOM 472 N THR A 49 -11.959 10.281 -12.271 1.00 0.00 N ATOM 473 CA THR A 49 -13.318 10.698 -12.573 1.00 0.00 C ATOM 474 C THR A 49 -13.426 11.148 -14.031 1.00 0.00 C ATOM 475 O THR A 49 -13.220 12.321 -14.339 1.00 0.00 O ATOM 476 CB THR A 49 -13.711 11.786 -11.571 1.00 0.00 C ATOM 477 OG1 THR A 49 -13.032 12.949 -12.035 1.00 0.00 O ATOM 478 CG2 THR A 49 -13.123 11.541 -10.180 1.00 0.00 C ATOM 0 H THR A 49 -11.888 9.470 -11.656 1.00 0.00 H new ATOM 0 HA THR A 49 -14.019 9.870 -12.469 1.00 0.00 H new ATOM 0 HB THR A 49 -14.798 11.839 -11.502 1.00 0.00 H new ATOM 0 HG1 THR A 49 -12.533 12.733 -12.850 1.00 0.00 H new ATOM 0 HG21 THR A 49 -13.432 12.342 -9.508 1.00 0.00 H new ATOM 0 HG22 THR A 49 -13.482 10.586 -9.796 1.00 0.00 H new ATOM 0 HG23 THR A 49 -12.035 11.521 -10.243 1.00 0.00 H new ATOM 486 N ILE A 50 -13.750 10.193 -14.889 1.00 0.00 N ATOM 487 CA ILE A 50 -13.888 10.477 -16.307 1.00 0.00 C ATOM 488 C ILE A 50 -15.006 11.501 -16.512 1.00 0.00 C ATOM 489 O ILE A 50 -15.039 12.194 -17.527 1.00 0.00 O ATOM 490 CB ILE A 50 -14.090 9.181 -17.095 1.00 0.00 C ATOM 491 CG1 ILE A 50 -13.280 9.195 -18.393 1.00 0.00 C ATOM 492 CG2 ILE A 50 -15.576 8.920 -17.351 1.00 0.00 C ATOM 493 CD1 ILE A 50 -13.189 7.793 -18.999 1.00 0.00 C ATOM 0 H ILE A 50 -13.921 9.221 -14.630 1.00 0.00 H new ATOM 0 HA ILE A 50 -12.973 10.922 -16.697 1.00 0.00 H new ATOM 0 HB ILE A 50 -13.716 8.354 -16.491 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -13.744 9.874 -19.108 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -12.278 9.575 -18.196 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -15.691 7.993 -17.913 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -16.100 8.835 -16.399 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -15.997 9.746 -17.924 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -12.608 7.832 -19.920 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -12.702 7.122 -18.291 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -14.192 7.425 -19.217 1.00 0.00 H new ATOM 504 N GLY A 51 -15.894 11.564 -15.530 1.00 0.00 N ATOM 505 CA GLY A 51 -17.010 12.492 -15.590 1.00 0.00 C ATOM 506 C GLY A 51 -18.344 11.758 -15.429 1.00 0.00 C ATOM 507 O GLY A 51 -18.580 10.743 -16.083 1.00 0.00 O ATOM 0 H GLY A 51 -15.863 10.988 -14.689 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -16.907 13.242 -14.806 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -16.995 13.023 -16.542 1.00 0.00 H new ATOM 511 N ASN A 52 -19.178 12.299 -14.554 1.00 0.00 N ATOM 512 CA ASN A 52 -20.481 11.708 -14.299 1.00 0.00 C ATOM 513 C ASN A 52 -20.296 10.284 -13.773 1.00 0.00 C ATOM 514 O ASN A 52 -19.788 9.418 -14.485 1.00 0.00 O ATOM 515 CB ASN A 52 -21.314 11.636 -15.580 1.00 0.00 C ATOM 516 CG ASN A 52 -22.750 11.205 -15.278 1.00 0.00 C ATOM 517 OD1 ASN A 52 -23.001 10.226 -14.594 1.00 0.00 O ATOM 518 ND2 ASN A 52 -23.676 11.988 -15.824 1.00 0.00 N ATOM 0 H ASN A 52 -18.977 13.140 -14.013 1.00 0.00 H new ATOM 0 HA ASN A 52 -20.997 12.332 -13.569 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -21.318 12.610 -16.070 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -20.858 10.931 -16.275 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -24.665 11.784 -15.681 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -23.397 12.792 -16.386 1.00 0.00 H new ATOM 524 N PHE A 53 -20.718 10.085 -12.534 1.00 0.00 N ATOM 525 CA PHE A 53 -20.605 8.780 -11.905 1.00 0.00 C ATOM 526 C PHE A 53 -19.144 8.332 -11.831 1.00 0.00 C ATOM 527 O PHE A 53 -18.621 7.750 -12.781 1.00 0.00 O ATOM 528 CB PHE A 53 -21.385 7.794 -12.777 1.00 0.00 C ATOM 529 CG PHE A 53 -21.601 6.425 -12.130 1.00 0.00 C ATOM 530 CD1 PHE A 53 -20.664 5.449 -12.274 1.00 0.00 C ATOM 531 CD2 PHE A 53 -22.728 6.184 -11.409 1.00 0.00 C ATOM 532 CE1 PHE A 53 -20.864 4.179 -11.673 1.00 0.00 C ATOM 533 CE2 PHE A 53 -22.928 4.912 -10.807 1.00 0.00 C ATOM 534 CZ PHE A 53 -21.992 3.937 -10.952 1.00 0.00 C ATOM 0 H PHE A 53 -21.139 10.806 -11.948 1.00 0.00 H new ATOM 0 HA PHE A 53 -20.996 8.822 -10.889 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -22.356 8.227 -13.018 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -20.853 7.659 -13.719 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -19.768 5.641 -12.846 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -23.471 6.959 -11.294 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -20.120 3.404 -11.788 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -23.823 4.720 -10.234 1.00 0.00 H new ATOM 0 HZ PHE A 53 -22.144 2.970 -10.495 1.00 0.00 H new ATOM 543 N SER A 54 -18.527 8.619 -10.695 1.00 0.00 N ATOM 544 CA SER A 54 -17.137 8.252 -10.485 1.00 0.00 C ATOM 545 C SER A 54 -16.855 6.886 -11.113 1.00 0.00 C ATOM 546 O SER A 54 -17.298 5.860 -10.600 1.00 0.00 O ATOM 547 CB SER A 54 -16.792 8.232 -8.995 1.00 0.00 C ATOM 548 OG SER A 54 -17.650 7.364 -8.259 1.00 0.00 O ATOM 0 H SER A 54 -18.964 9.102 -9.910 1.00 0.00 H new ATOM 0 HA SER A 54 -16.509 9.002 -10.966 1.00 0.00 H new ATOM 0 HB2 SER A 54 -15.758 7.913 -8.867 1.00 0.00 H new ATOM 0 HB3 SER A 54 -16.866 9.242 -8.592 1.00 0.00 H new ATOM 0 HG SER A 54 -17.858 6.574 -8.800 1.00 0.00 H new ATOM 553 N GLY A 55 -16.120 6.917 -12.215 1.00 0.00 N ATOM 554 CA GLY A 55 -15.774 5.694 -12.919 1.00 0.00 C ATOM 555 C GLY A 55 -17.024 4.874 -13.240 1.00 0.00 C ATOM 556 O GLY A 55 -17.603 4.245 -12.354 1.00 0.00 O ATOM 0 H GLY A 55 -15.754 7.770 -12.638 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -15.248 5.938 -13.842 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -15.092 5.100 -12.310 1.00 0.00 H new ATOM 560 N PRO A 56 -17.415 4.907 -14.541 1.00 0.00 N ATOM 561 CA PRO A 56 -18.587 4.175 -14.990 1.00 0.00 C ATOM 562 C PRO A 56 -18.295 2.675 -15.081 1.00 0.00 C ATOM 563 O PRO A 56 -18.789 1.893 -14.271 1.00 0.00 O ATOM 564 CB PRO A 56 -18.948 4.791 -16.332 1.00 0.00 C ATOM 565 CG PRO A 56 -17.702 5.524 -16.801 1.00 0.00 C ATOM 566 CD PRO A 56 -16.755 5.641 -15.617 1.00 0.00 C ATOM 0 HA PRO A 56 -19.422 4.253 -14.294 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -19.243 4.024 -17.048 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -19.791 5.476 -16.234 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -17.226 4.983 -17.618 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -17.961 6.512 -17.181 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -15.779 5.214 -15.847 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -16.591 6.683 -15.343 1.00 0.00 H new ATOM 571 N TYR A 57 -17.493 2.320 -16.073 1.00 0.00 N ATOM 572 CA TYR A 57 -17.128 0.929 -16.281 1.00 0.00 C ATOM 573 C TYR A 57 -16.552 0.317 -15.002 1.00 0.00 C ATOM 574 O TYR A 57 -16.581 0.941 -13.942 1.00 0.00 O ATOM 575 CB TYR A 57 -16.046 0.933 -17.362 1.00 0.00 C ATOM 576 CG TYR A 57 -15.037 2.076 -17.229 1.00 0.00 C ATOM 577 CD1 TYR A 57 -14.362 2.266 -16.041 1.00 0.00 C ATOM 578 CD2 TYR A 57 -14.802 2.916 -18.298 1.00 0.00 C ATOM 579 CE1 TYR A 57 -13.414 3.342 -15.916 1.00 0.00 C ATOM 580 CE2 TYR A 57 -13.853 3.991 -18.173 1.00 0.00 C ATOM 581 CZ TYR A 57 -13.206 4.151 -16.988 1.00 0.00 C ATOM 582 OH TYR A 57 -12.309 5.167 -16.870 1.00 0.00 O ATOM 0 H TYR A 57 -17.085 2.972 -16.743 1.00 0.00 H new ATOM 0 HA TYR A 57 -18.001 0.342 -16.566 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -15.511 -0.016 -17.329 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -16.524 0.996 -18.340 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -14.545 1.607 -15.205 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -15.330 2.767 -19.228 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -12.880 3.503 -14.991 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -13.659 4.656 -19.002 1.00 0.00 H new ATOM 0 HH TYR A 57 -11.686 5.143 -17.626 1.00 0.00 H new ATOM 591 N THR A 58 -16.044 -0.898 -15.143 1.00 0.00 N ATOM 592 CA THR A 58 -15.462 -1.602 -14.012 1.00 0.00 C ATOM 593 C THR A 58 -13.961 -1.314 -13.920 1.00 0.00 C ATOM 594 O THR A 58 -13.150 -2.037 -14.496 1.00 0.00 O ATOM 595 CB THR A 58 -15.787 -3.089 -14.164 1.00 0.00 C ATOM 596 OG1 THR A 58 -15.043 -3.714 -13.121 1.00 0.00 O ATOM 597 CG2 THR A 58 -15.206 -3.689 -15.446 1.00 0.00 C ATOM 0 H THR A 58 -16.023 -1.413 -16.023 1.00 0.00 H new ATOM 0 HA THR A 58 -15.886 -1.256 -13.069 1.00 0.00 H new ATOM 0 HB THR A 58 -16.868 -3.226 -14.157 1.00 0.00 H new ATOM 0 HG1 THR A 58 -15.196 -4.682 -13.144 1.00 0.00 H new ATOM 0 HG21 THR A 58 -15.466 -4.746 -15.504 1.00 0.00 H new ATOM 0 HG22 THR A 58 -15.616 -3.167 -16.310 1.00 0.00 H new ATOM 0 HG23 THR A 58 -14.121 -3.582 -15.438 1.00 0.00 H new ATOM 605 N TYR A 59 -13.639 -0.257 -13.190 1.00 0.00 N ATOM 606 CA TYR A 59 -12.250 0.135 -13.014 1.00 0.00 C ATOM 607 C TYR A 59 -11.851 0.091 -11.537 1.00 0.00 C ATOM 608 O TYR A 59 -12.692 -0.139 -10.669 1.00 0.00 O ATOM 609 CB TYR A 59 -12.153 1.579 -13.513 1.00 0.00 C ATOM 610 CG TYR A 59 -11.199 1.765 -14.694 1.00 0.00 C ATOM 611 CD1 TYR A 59 -11.556 1.310 -15.948 1.00 0.00 C ATOM 612 CD2 TYR A 59 -9.983 2.390 -14.507 1.00 0.00 C ATOM 613 CE1 TYR A 59 -10.658 1.486 -17.060 1.00 0.00 C ATOM 614 CE2 TYR A 59 -9.085 2.565 -15.618 1.00 0.00 C ATOM 615 CZ TYR A 59 -9.466 2.106 -16.840 1.00 0.00 C ATOM 616 OH TYR A 59 -8.619 2.271 -17.890 1.00 0.00 O ATOM 0 H TYR A 59 -14.315 0.340 -12.714 1.00 0.00 H new ATOM 0 HA TYR A 59 -11.589 -0.541 -13.557 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -13.147 1.920 -13.804 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -11.826 2.216 -12.691 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -12.508 0.822 -16.095 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -9.705 2.748 -13.527 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -10.924 1.134 -18.046 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -8.129 3.050 -15.484 1.00 0.00 H new ATOM 0 HH TYR A 59 -7.808 2.729 -17.587 1.00 0.00 H new ATOM 625 N CYS A 60 -10.567 0.315 -11.298 1.00 0.00 N ATOM 626 CA CYS A 60 -10.046 0.304 -9.941 1.00 0.00 C ATOM 627 C CYS A 60 -10.178 1.715 -9.364 1.00 0.00 C ATOM 628 O CYS A 60 -10.124 2.698 -10.101 1.00 0.00 O ATOM 629 CB CYS A 60 -8.602 -0.200 -9.895 1.00 0.00 C ATOM 630 SG CYS A 60 -8.383 -1.950 -10.381 1.00 0.00 S ATOM 0 H CYS A 60 -9.872 0.505 -12.020 1.00 0.00 H new ATOM 0 HA CYS A 60 -10.624 -0.391 -9.332 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -7.994 0.423 -10.551 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -8.218 -0.068 -8.883 1.00 0.00 H new ATOM 634 N ASN A 61 -10.347 1.769 -8.051 1.00 0.00 N ATOM 635 CA ASN A 61 -10.488 3.042 -7.367 1.00 0.00 C ATOM 636 C ASN A 61 -9.201 3.347 -6.597 1.00 0.00 C ATOM 637 O ASN A 61 -8.409 2.445 -6.324 1.00 0.00 O ATOM 638 CB ASN A 61 -11.642 3.005 -6.364 1.00 0.00 C ATOM 639 CG ASN A 61 -11.834 4.369 -5.698 1.00 0.00 C ATOM 640 OD1 ASN A 61 -11.166 4.720 -4.738 1.00 0.00 O ATOM 641 ND2 ASN A 61 -12.782 5.116 -6.257 1.00 0.00 N ATOM 0 H ASN A 61 -10.389 0.951 -7.443 1.00 0.00 H new ATOM 0 HA ASN A 61 -10.688 3.807 -8.117 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -12.561 2.712 -6.872 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -11.443 2.250 -5.604 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -12.987 6.043 -5.884 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -13.304 4.762 -7.059 1.00 0.00 H new ATOM 647 N THR A 62 -9.033 4.619 -6.268 1.00 0.00 N ATOM 648 CA THR A 62 -7.856 5.053 -5.534 1.00 0.00 C ATOM 649 C THR A 62 -7.922 4.567 -4.085 1.00 0.00 C ATOM 650 O THR A 62 -8.869 4.878 -3.364 1.00 0.00 O ATOM 651 CB THR A 62 -7.754 6.574 -5.661 1.00 0.00 C ATOM 652 OG1 THR A 62 -7.141 6.776 -6.931 1.00 0.00 O ATOM 653 CG2 THR A 62 -6.761 7.179 -4.666 1.00 0.00 C ATOM 0 H THR A 62 -9.692 5.363 -6.496 1.00 0.00 H new ATOM 0 HA THR A 62 -6.948 4.616 -5.949 1.00 0.00 H new ATOM 0 HB THR A 62 -8.737 7.018 -5.507 1.00 0.00 H new ATOM 0 HG1 THR A 62 -7.786 6.575 -7.641 1.00 0.00 H new ATOM 0 HG21 THR A 62 -6.727 8.260 -4.798 1.00 0.00 H new ATOM 0 HG22 THR A 62 -7.078 6.948 -3.649 1.00 0.00 H new ATOM 0 HG23 THR A 62 -5.770 6.760 -4.841 1.00 0.00 H new ATOM 661 N THR A 63 -6.904 3.812 -3.700 1.00 0.00 N ATOM 662 CA THR A 63 -6.835 3.279 -2.350 1.00 0.00 C ATOM 663 C THR A 63 -5.387 3.271 -1.854 1.00 0.00 C ATOM 664 O THR A 63 -4.454 3.190 -2.652 1.00 0.00 O ATOM 665 CB THR A 63 -7.483 1.894 -2.354 1.00 0.00 C ATOM 666 OG1 THR A 63 -8.855 2.153 -2.064 1.00 0.00 O ATOM 667 CG2 THR A 63 -7.014 1.024 -1.186 1.00 0.00 C ATOM 0 H THR A 63 -6.120 3.556 -4.300 1.00 0.00 H new ATOM 0 HA THR A 63 -7.383 3.907 -1.648 1.00 0.00 H new ATOM 0 HB THR A 63 -7.258 1.391 -3.294 1.00 0.00 H new ATOM 0 HG1 THR A 63 -9.077 3.072 -2.324 1.00 0.00 H new ATOM 0 HG21 THR A 63 -7.505 0.052 -1.236 1.00 0.00 H new ATOM 0 HG22 THR A 63 -5.934 0.889 -1.244 1.00 0.00 H new ATOM 0 HG23 THR A 63 -7.269 1.511 -0.245 1.00 0.00 H new ATOM 675 N LEU A 64 -5.245 3.355 -0.540 1.00 0.00 N ATOM 676 CA LEU A 64 -3.926 3.358 0.072 1.00 0.00 C ATOM 677 C LEU A 64 -3.776 2.117 0.955 1.00 0.00 C ATOM 678 O LEU A 64 -4.679 1.782 1.720 1.00 0.00 O ATOM 679 CB LEU A 64 -3.683 4.673 0.814 1.00 0.00 C ATOM 680 CG LEU A 64 -4.727 5.053 1.866 1.00 0.00 C ATOM 681 CD1 LEU A 64 -4.488 4.297 3.175 1.00 0.00 C ATOM 682 CD2 LEU A 64 -4.765 6.568 2.078 1.00 0.00 C ATOM 0 H LEU A 64 -6.021 3.422 0.119 1.00 0.00 H new ATOM 0 HA LEU A 64 -3.151 3.302 -0.692 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -2.709 4.618 1.301 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -3.627 5.477 0.080 1.00 0.00 H new ATOM 0 HG LEU A 64 -5.708 4.754 1.497 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -5.244 4.586 3.905 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -4.551 3.224 2.992 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -3.498 4.542 3.561 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -5.515 6.811 2.830 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -3.788 6.913 2.415 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -5.019 7.060 1.139 1.00 0.00 H new ATOM 693 N ASP A 65 -2.629 1.468 0.819 1.00 0.00 N ATOM 694 CA ASP A 65 -2.349 0.273 1.594 1.00 0.00 C ATOM 695 C ASP A 65 -1.518 0.649 2.823 1.00 0.00 C ATOM 696 O ASP A 65 -1.225 1.823 3.043 1.00 0.00 O ATOM 697 CB ASP A 65 -1.547 -0.740 0.774 1.00 0.00 C ATOM 698 CG ASP A 65 -1.690 -2.196 1.225 1.00 0.00 C ATOM 699 OD1 ASP A 65 -2.464 -2.420 2.181 1.00 0.00 O ATOM 700 OD2 ASP A 65 -1.022 -3.049 0.605 1.00 0.00 O ATOM 0 H ASP A 65 -1.883 1.748 0.183 1.00 0.00 H new ATOM 0 HA ASP A 65 -3.301 -0.170 1.885 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -1.856 -0.666 -0.269 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -0.493 -0.465 0.815 1.00 0.00 H new ATOM 704 N GLN A 66 -1.162 -0.369 3.592 1.00 0.00 N ATOM 705 CA GLN A 66 -0.372 -0.160 4.793 1.00 0.00 C ATOM 706 C GLN A 66 1.015 0.375 4.429 1.00 0.00 C ATOM 707 O GLN A 66 1.763 0.815 5.301 1.00 0.00 O ATOM 708 CB GLN A 66 -0.265 -1.448 5.611 1.00 0.00 C ATOM 709 CG GLN A 66 -1.444 -1.584 6.577 1.00 0.00 C ATOM 710 CD GLN A 66 -1.608 -3.032 7.041 1.00 0.00 C ATOM 711 OE1 GLN A 66 -0.739 -3.870 6.866 1.00 0.00 O ATOM 712 NE2 GLN A 66 -2.769 -3.279 7.641 1.00 0.00 N ATOM 0 H GLN A 66 -1.406 -1.342 3.406 1.00 0.00 H new ATOM 0 HA GLN A 66 -0.876 0.583 5.411 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -0.238 -2.307 4.941 1.00 0.00 H new ATOM 0 HB3 GLN A 66 0.670 -1.451 6.171 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -1.288 -0.937 7.440 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -2.359 -1.249 6.089 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -3.453 -2.531 7.755 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -2.975 -4.216 7.987 1.00 0.00 H new ATOM 719 N ILE A 67 1.316 0.320 3.140 1.00 0.00 N ATOM 720 CA ILE A 67 2.599 0.793 2.650 1.00 0.00 C ATOM 721 C ILE A 67 2.419 2.169 2.006 1.00 0.00 C ATOM 722 O ILE A 67 3.040 2.469 0.988 1.00 0.00 O ATOM 723 CB ILE A 67 3.231 -0.243 1.718 1.00 0.00 C ATOM 724 CG1 ILE A 67 2.955 -1.665 2.210 1.00 0.00 C ATOM 725 CG2 ILE A 67 4.729 0.021 1.541 1.00 0.00 C ATOM 726 CD1 ILE A 67 3.420 -2.701 1.184 1.00 0.00 C ATOM 0 H ILE A 67 0.693 -0.045 2.420 1.00 0.00 H new ATOM 0 HA ILE A 67 3.300 0.916 3.476 1.00 0.00 H new ATOM 0 HB ILE A 67 2.768 -0.147 0.736 1.00 0.00 H new ATOM 0 HG12 ILE A 67 3.467 -1.831 3.158 1.00 0.00 H new ATOM 0 HG13 ILE A 67 1.888 -1.788 2.398 1.00 0.00 H new ATOM 0 HG21 ILE A 67 5.154 -0.729 0.874 1.00 0.00 H new ATOM 0 HG22 ILE A 67 4.876 1.012 1.112 1.00 0.00 H new ATOM 0 HG23 ILE A 67 5.225 -0.032 2.510 1.00 0.00 H new ATOM 0 HD11 ILE A 67 3.212 -3.703 1.559 1.00 0.00 H new ATOM 0 HD12 ILE A 67 2.888 -2.547 0.245 1.00 0.00 H new ATOM 0 HD13 ILE A 67 4.491 -2.592 1.016 1.00 0.00 H new ATOM 737 N GLY A 68 1.564 2.970 2.627 1.00 0.00 N ATOM 738 CA GLY A 68 1.295 4.307 2.128 1.00 0.00 C ATOM 739 C GLY A 68 1.338 4.341 0.599 1.00 0.00 C ATOM 740 O GLY A 68 1.818 5.308 0.009 1.00 0.00 O ATOM 0 H GLY A 68 1.049 2.718 3.471 1.00 0.00 H new ATOM 0 HA2 GLY A 68 0.316 4.638 2.475 1.00 0.00 H new ATOM 0 HA3 GLY A 68 2.029 5.004 2.532 1.00 0.00 H new ATOM 744 N THR A 69 0.831 3.273 0.000 1.00 0.00 N ATOM 745 CA THR A 69 0.806 3.169 -1.449 1.00 0.00 C ATOM 746 C THR A 69 -0.474 3.793 -2.006 1.00 0.00 C ATOM 747 O THR A 69 -1.502 3.124 -2.110 1.00 0.00 O ATOM 748 CB THR A 69 0.975 1.694 -1.819 1.00 0.00 C ATOM 749 OG1 THR A 69 0.308 0.994 -0.772 1.00 0.00 O ATOM 750 CG2 THR A 69 2.427 1.226 -1.713 1.00 0.00 C ATOM 0 H THR A 69 0.434 2.472 0.492 1.00 0.00 H new ATOM 0 HA THR A 69 1.625 3.728 -1.901 1.00 0.00 H new ATOM 0 HB THR A 69 0.615 1.532 -2.835 1.00 0.00 H new ATOM 0 HG1 THR A 69 0.971 0.568 -0.190 1.00 0.00 H new ATOM 0 HG21 THR A 69 2.491 0.173 -1.986 1.00 0.00 H new ATOM 0 HG22 THR A 69 3.049 1.814 -2.388 1.00 0.00 H new ATOM 0 HG23 THR A 69 2.778 1.357 -0.689 1.00 0.00 H new ATOM 758 N CYS A 70 -0.372 5.067 -2.352 1.00 0.00 N ATOM 759 CA CYS A 70 -1.509 5.790 -2.897 1.00 0.00 C ATOM 760 C CYS A 70 -1.578 5.512 -4.400 1.00 0.00 C ATOM 761 O CYS A 70 -0.935 6.199 -5.191 1.00 0.00 O ATOM 762 CB CYS A 70 -1.426 7.287 -2.596 1.00 0.00 C ATOM 763 SG CYS A 70 -3.027 8.084 -2.212 1.00 0.00 S ATOM 0 H CYS A 70 0.482 5.619 -2.266 1.00 0.00 H new ATOM 0 HA CYS A 70 -2.426 5.443 -2.421 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -0.751 7.437 -1.754 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -0.982 7.791 -3.454 1.00 0.00 H new ATOM 767 N TRP A 71 -2.365 4.505 -4.748 1.00 0.00 N ATOM 768 CA TRP A 71 -2.527 4.129 -6.142 1.00 0.00 C ATOM 769 C TRP A 71 -3.681 4.949 -6.722 1.00 0.00 C ATOM 770 O TRP A 71 -4.832 4.774 -6.325 1.00 0.00 O ATOM 771 CB TRP A 71 -2.738 2.620 -6.282 1.00 0.00 C ATOM 772 CG TRP A 71 -1.580 1.777 -5.740 1.00 0.00 C ATOM 773 CD1 TRP A 71 -1.607 0.885 -4.740 1.00 0.00 C ATOM 774 CD2 TRP A 71 -0.216 1.785 -6.212 1.00 0.00 C ATOM 775 NE1 TRP A 71 -0.365 0.319 -4.534 1.00 0.00 N ATOM 776 CE2 TRP A 71 0.508 0.884 -5.458 1.00 0.00 C ATOM 777 CE3 TRP A 71 0.386 2.528 -7.242 1.00 0.00 C ATOM 778 CZ2 TRP A 71 1.873 0.642 -5.654 1.00 0.00 C ATOM 779 CZ3 TRP A 71 1.751 2.275 -7.425 1.00 0.00 C ATOM 780 CH2 TRP A 71 2.493 1.372 -6.674 1.00 0.00 C ATOM 0 H TRP A 71 -2.898 3.938 -4.089 1.00 0.00 H new ATOM 0 HA TRP A 71 -1.622 4.351 -6.708 1.00 0.00 H new ATOM 0 HB2 TRP A 71 -3.653 2.341 -5.759 1.00 0.00 H new ATOM 0 HB3 TRP A 71 -2.887 2.380 -7.335 1.00 0.00 H new ATOM 0 HD1 TRP A 71 -2.489 0.640 -4.167 1.00 0.00 H new ATOM 0 HE1 TRP A 71 -0.131 -0.384 -3.833 1.00 0.00 H new ATOM 0 HE3 TRP A 71 -0.161 3.238 -7.845 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 2.418 -0.069 -5.051 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 2.263 2.820 -8.204 1.00 0.00 H new ATOM 0 HH2 TRP A 71 3.545 1.234 -6.877 1.00 0.00 H new ATOM 790 N PRO A 72 -3.323 5.849 -7.677 1.00 0.00 N ATOM 791 CA PRO A 72 -4.315 6.697 -8.315 1.00 0.00 C ATOM 792 C PRO A 72 -5.146 5.903 -9.326 1.00 0.00 C ATOM 793 O PRO A 72 -4.878 5.946 -10.526 1.00 0.00 O ATOM 794 CB PRO A 72 -3.518 7.822 -8.955 1.00 0.00 C ATOM 795 CG PRO A 72 -2.087 7.318 -9.050 1.00 0.00 C ATOM 796 CD PRO A 72 -1.970 6.083 -8.172 1.00 0.00 C ATOM 0 HA PRO A 72 -5.045 7.095 -7.610 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -3.912 8.067 -9.941 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -3.573 8.730 -8.355 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -1.834 7.078 -10.083 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -1.388 8.088 -8.722 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -1.603 5.228 -8.739 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -1.271 6.245 -7.352 1.00 0.00 H new ATOM 801 N GLN A 73 -6.137 5.196 -8.804 1.00 0.00 N ATOM 802 CA GLN A 73 -7.009 4.393 -9.645 1.00 0.00 C ATOM 803 C GLN A 73 -6.181 3.450 -10.519 1.00 0.00 C ATOM 804 O GLN A 73 -4.959 3.577 -10.592 1.00 0.00 O ATOM 805 CB GLN A 73 -7.913 5.282 -10.502 1.00 0.00 C ATOM 806 CG GLN A 73 -7.324 5.476 -11.901 1.00 0.00 C ATOM 807 CD GLN A 73 -8.080 4.640 -12.936 1.00 0.00 C ATOM 808 OE1 GLN A 73 -7.601 3.631 -13.426 1.00 0.00 O ATOM 809 NE2 GLN A 73 -9.285 5.115 -13.238 1.00 0.00 N ATOM 0 H GLN A 73 -6.356 5.162 -7.808 1.00 0.00 H new ATOM 0 HA GLN A 73 -7.650 3.791 -9.001 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -8.903 4.833 -10.579 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -8.040 6.251 -10.019 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -7.370 6.530 -12.176 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -6.271 5.193 -11.899 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -9.625 5.966 -12.790 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -9.869 4.628 -13.918 1.00 0.00 H new ATOM 816 N SER A 74 -6.879 2.523 -11.159 1.00 0.00 N ATOM 817 CA SER A 74 -6.222 1.557 -12.025 1.00 0.00 C ATOM 818 C SER A 74 -7.268 0.775 -12.822 1.00 0.00 C ATOM 819 O SER A 74 -8.456 1.089 -12.771 1.00 0.00 O ATOM 820 CB SER A 74 -5.345 0.599 -11.216 1.00 0.00 C ATOM 821 OG SER A 74 -4.306 1.284 -10.522 1.00 0.00 O ATOM 0 H SER A 74 -7.892 2.420 -11.096 1.00 0.00 H new ATOM 0 HA SER A 74 -5.577 2.099 -12.717 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.964 0.058 -10.500 1.00 0.00 H new ATOM 0 HB3 SER A 74 -4.907 -0.143 -11.884 1.00 0.00 H new ATOM 0 HG SER A 74 -4.234 2.200 -10.863 1.00 0.00 H new ATOM 826 N ALA A 75 -6.787 -0.229 -13.541 1.00 0.00 N ATOM 827 CA ALA A 75 -7.665 -1.058 -14.349 1.00 0.00 C ATOM 828 C ALA A 75 -7.565 -2.511 -13.876 1.00 0.00 C ATOM 829 O ALA A 75 -6.573 -2.900 -13.264 1.00 0.00 O ATOM 830 CB ALA A 75 -7.301 -0.900 -15.826 1.00 0.00 C ATOM 0 H ALA A 75 -5.801 -0.487 -13.581 1.00 0.00 H new ATOM 0 HA ALA A 75 -8.702 -0.744 -14.234 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -7.960 -1.522 -16.432 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -7.416 0.143 -16.119 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -6.267 -1.209 -15.981 1.00 0.00 H new ATOM 836 N PRO A 76 -8.635 -3.290 -14.186 1.00 0.00 N ATOM 837 CA PRO A 76 -8.678 -4.690 -13.799 1.00 0.00 C ATOM 838 C PRO A 76 -7.761 -5.533 -14.690 1.00 0.00 C ATOM 839 O PRO A 76 -7.615 -5.251 -15.878 1.00 0.00 O ATOM 840 CB PRO A 76 -10.141 -5.086 -13.910 1.00 0.00 C ATOM 841 CG PRO A 76 -10.790 -4.034 -14.795 1.00 0.00 C ATOM 842 CD PRO A 76 -9.829 -2.863 -14.910 1.00 0.00 C ATOM 0 HA PRO A 76 -8.311 -4.858 -12.787 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -10.245 -6.080 -14.344 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -10.613 -5.116 -12.928 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -11.009 -4.446 -15.780 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -11.739 -3.709 -14.368 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -9.601 -2.639 -15.952 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -10.253 -1.958 -14.475 1.00 0.00 H new ATOM 847 N GLY A 77 -7.169 -6.550 -14.080 1.00 0.00 N ATOM 848 CA GLY A 77 -6.272 -7.435 -14.803 1.00 0.00 C ATOM 849 C GLY A 77 -5.113 -6.652 -15.425 1.00 0.00 C ATOM 850 O GLY A 77 -4.819 -6.810 -16.609 1.00 0.00 O ATOM 0 H GLY A 77 -7.293 -6.780 -13.094 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -5.881 -8.194 -14.126 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -6.823 -7.958 -15.584 1.00 0.00 H new ATOM 854 N ALA A 78 -4.489 -5.825 -14.600 1.00 0.00 N ATOM 855 CA ALA A 78 -3.370 -5.019 -15.055 1.00 0.00 C ATOM 856 C ALA A 78 -2.166 -5.263 -14.142 1.00 0.00 C ATOM 857 O ALA A 78 -2.117 -6.262 -13.428 1.00 0.00 O ATOM 858 CB ALA A 78 -3.783 -3.546 -15.092 1.00 0.00 C ATOM 0 H ALA A 78 -4.737 -5.696 -13.619 1.00 0.00 H new ATOM 0 HA ALA A 78 -3.080 -5.302 -16.067 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -2.943 -2.941 -15.434 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -4.622 -3.421 -15.776 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -4.078 -3.226 -14.093 1.00 0.00 H new ATOM 864 N LEU A 79 -1.224 -4.332 -14.197 1.00 0.00 N ATOM 865 CA LEU A 79 -0.024 -4.434 -13.384 1.00 0.00 C ATOM 866 C LEU A 79 0.378 -3.039 -12.900 1.00 0.00 C ATOM 867 O LEU A 79 0.815 -2.206 -13.693 1.00 0.00 O ATOM 868 CB LEU A 79 1.082 -5.162 -14.151 1.00 0.00 C ATOM 869 CG LEU A 79 1.413 -6.576 -13.669 1.00 0.00 C ATOM 870 CD1 LEU A 79 1.918 -6.560 -12.225 1.00 0.00 C ATOM 871 CD2 LEU A 79 0.214 -7.511 -13.846 1.00 0.00 C ATOM 0 H LEU A 79 -1.268 -3.504 -14.792 1.00 0.00 H new ATOM 0 HA LEU A 79 -0.214 -5.037 -12.496 1.00 0.00 H new ATOM 0 HB2 LEU A 79 0.794 -5.215 -15.201 1.00 0.00 H new ATOM 0 HB3 LEU A 79 1.989 -4.560 -14.099 1.00 0.00 H new ATOM 0 HG LEU A 79 2.221 -6.967 -14.288 1.00 0.00 H new ATOM 0 HD11 LEU A 79 2.146 -7.578 -11.908 1.00 0.00 H new ATOM 0 HD12 LEU A 79 2.819 -5.950 -12.161 1.00 0.00 H new ATOM 0 HD13 LEU A 79 1.150 -6.141 -11.575 1.00 0.00 H new ATOM 0 HD21 LEU A 79 0.476 -8.509 -13.496 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -0.630 -7.134 -13.268 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -0.059 -7.557 -14.900 1.00 0.00 H new ATOM 882 N VAL A 80 0.219 -2.830 -11.602 1.00 0.00 N ATOM 883 CA VAL A 80 0.560 -1.551 -11.002 1.00 0.00 C ATOM 884 C VAL A 80 1.800 -1.720 -10.122 1.00 0.00 C ATOM 885 O VAL A 80 1.810 -1.290 -8.969 1.00 0.00 O ATOM 886 CB VAL A 80 -0.643 -0.992 -10.241 1.00 0.00 C ATOM 887 CG1 VAL A 80 -0.244 0.224 -9.403 1.00 0.00 C ATOM 888 CG2 VAL A 80 -1.786 -0.647 -11.198 1.00 0.00 C ATOM 0 H VAL A 80 -0.142 -3.525 -10.948 1.00 0.00 H new ATOM 0 HA VAL A 80 0.806 -0.821 -11.773 1.00 0.00 H new ATOM 0 HB VAL A 80 -0.998 -1.766 -9.561 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -1.117 0.602 -8.872 1.00 0.00 H new ATOM 0 HG12 VAL A 80 0.521 -0.066 -8.683 1.00 0.00 H new ATOM 0 HG13 VAL A 80 0.149 1.003 -10.056 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -2.629 -0.252 -10.631 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -1.447 0.102 -11.914 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -2.097 -1.545 -11.732 1.00 0.00 H new ATOM 898 N GLU A 81 2.815 -2.347 -10.698 1.00 0.00 N ATOM 899 CA GLU A 81 4.056 -2.579 -9.980 1.00 0.00 C ATOM 900 C GLU A 81 5.126 -1.584 -10.435 1.00 0.00 C ATOM 901 O GLU A 81 5.000 -0.974 -11.495 1.00 0.00 O ATOM 902 CB GLU A 81 4.535 -4.020 -10.162 1.00 0.00 C ATOM 903 CG GLU A 81 4.956 -4.279 -11.610 1.00 0.00 C ATOM 904 CD GLU A 81 6.447 -3.997 -11.807 1.00 0.00 C ATOM 905 OE1 GLU A 81 7.237 -4.939 -11.580 1.00 0.00 O ATOM 906 OE2 GLU A 81 6.763 -2.847 -12.177 1.00 0.00 O ATOM 0 H GLU A 81 2.803 -2.702 -11.654 1.00 0.00 H new ATOM 0 HA GLU A 81 3.872 -2.425 -8.917 1.00 0.00 H new ATOM 0 HB2 GLU A 81 5.375 -4.215 -9.495 1.00 0.00 H new ATOM 0 HB3 GLU A 81 3.739 -4.710 -9.882 1.00 0.00 H new ATOM 0 HG2 GLU A 81 4.740 -5.314 -11.876 1.00 0.00 H new ATOM 0 HG3 GLU A 81 4.371 -3.649 -12.281 1.00 0.00 H new ATOM 911 N ARG A 82 6.155 -1.451 -9.609 1.00 0.00 N ATOM 912 CA ARG A 82 7.246 -0.541 -9.915 1.00 0.00 C ATOM 913 C ARG A 82 8.390 -0.730 -8.916 1.00 0.00 C ATOM 914 O ARG A 82 8.716 0.184 -8.160 1.00 0.00 O ATOM 915 CB ARG A 82 6.777 0.915 -9.872 1.00 0.00 C ATOM 916 CG ARG A 82 6.041 1.216 -8.565 1.00 0.00 C ATOM 917 CD ARG A 82 5.119 2.428 -8.721 1.00 0.00 C ATOM 918 NE ARG A 82 4.082 2.147 -9.738 1.00 0.00 N ATOM 919 CZ ARG A 82 4.188 2.478 -11.032 1.00 0.00 C ATOM 920 NH1 ARG A 82 5.288 3.104 -11.474 1.00 0.00 N ATOM 921 NH2 ARG A 82 3.196 2.184 -11.883 1.00 0.00 N ATOM 0 H ARG A 82 6.256 -1.958 -8.730 1.00 0.00 H new ATOM 0 HA ARG A 82 7.596 -0.769 -10.922 1.00 0.00 H new ATOM 0 HB2 ARG A 82 7.635 1.580 -9.972 1.00 0.00 H new ATOM 0 HB3 ARG A 82 6.119 1.114 -10.718 1.00 0.00 H new ATOM 0 HG2 ARG A 82 5.457 0.346 -8.264 1.00 0.00 H new ATOM 0 HG3 ARG A 82 6.764 1.404 -7.771 1.00 0.00 H new ATOM 0 HD2 ARG A 82 4.649 2.663 -7.766 1.00 0.00 H new ATOM 0 HD3 ARG A 82 5.700 3.302 -9.014 1.00 0.00 H new ATOM 0 HE ARG A 82 3.232 1.671 -9.435 1.00 0.00 H new ATOM 0 HH11 ARG A 82 6.043 3.328 -10.825 1.00 0.00 H new ATOM 0 HH12 ARG A 82 5.370 3.357 -12.459 1.00 0.00 H new ATOM 0 HH21 ARG A 82 2.359 1.708 -11.546 1.00 0.00 H new ATOM 0 HH22 ARG A 82 3.277 2.436 -12.868 1.00 0.00 H new ATOM 932 N PRO A 83 8.982 -1.954 -8.946 1.00 0.00 N ATOM 933 CA PRO A 83 10.082 -2.275 -8.052 1.00 0.00 C ATOM 934 C PRO A 83 11.376 -1.599 -8.510 1.00 0.00 C ATOM 935 O PRO A 83 11.733 -1.665 -9.686 1.00 0.00 O ATOM 936 CB PRO A 83 10.169 -3.792 -8.064 1.00 0.00 C ATOM 937 CG PRO A 83 9.426 -4.243 -9.311 1.00 0.00 C ATOM 938 CD PRO A 83 8.622 -3.060 -9.827 1.00 0.00 C ATOM 0 HA PRO A 83 9.922 -1.906 -7.039 1.00 0.00 H new ATOM 0 HB2 PRO A 83 11.207 -4.123 -8.087 1.00 0.00 H new ATOM 0 HB3 PRO A 83 9.719 -4.216 -7.166 1.00 0.00 H new ATOM 0 HG2 PRO A 83 10.128 -4.588 -10.070 1.00 0.00 H new ATOM 0 HG3 PRO A 83 8.768 -5.081 -9.081 1.00 0.00 H new ATOM 0 HD2 PRO A 83 8.869 -2.836 -10.865 1.00 0.00 H new ATOM 0 HD3 PRO A 83 7.552 -3.263 -9.791 1.00 0.00 H new ATOM 943 N CYS A 84 12.042 -0.962 -7.559 1.00 0.00 N ATOM 944 CA CYS A 84 13.289 -0.274 -7.850 1.00 0.00 C ATOM 945 C CYS A 84 12.978 0.920 -8.756 1.00 0.00 C ATOM 946 O CYS A 84 12.577 0.744 -9.905 1.00 0.00 O ATOM 947 CB CYS A 84 14.320 -1.213 -8.479 1.00 0.00 C ATOM 948 SG CYS A 84 14.555 -2.797 -7.594 1.00 0.00 S ATOM 0 H CYS A 84 11.742 -0.907 -6.586 1.00 0.00 H new ATOM 0 HA CYS A 84 13.737 0.081 -6.922 1.00 0.00 H new ATOM 0 HB2 CYS A 84 14.018 -1.427 -9.504 1.00 0.00 H new ATOM 0 HB3 CYS A 84 15.278 -0.696 -8.530 1.00 0.00 H new ATOM 952 N PRO A 85 13.180 2.140 -8.189 1.00 0.00 N ATOM 953 CA PRO A 85 12.926 3.361 -8.931 1.00 0.00 C ATOM 954 C PRO A 85 14.031 3.618 -9.959 1.00 0.00 C ATOM 955 O PRO A 85 14.829 2.730 -10.253 1.00 0.00 O ATOM 956 CB PRO A 85 12.832 4.451 -7.875 1.00 0.00 C ATOM 957 CG PRO A 85 13.494 3.884 -6.631 1.00 0.00 C ATOM 958 CD PRO A 85 13.654 2.385 -6.830 1.00 0.00 C ATOM 0 HA PRO A 85 12.009 3.313 -9.518 1.00 0.00 H new ATOM 0 HB2 PRO A 85 13.335 5.360 -8.206 1.00 0.00 H new ATOM 0 HB3 PRO A 85 11.793 4.716 -7.678 1.00 0.00 H new ATOM 0 HG2 PRO A 85 14.464 4.353 -6.467 1.00 0.00 H new ATOM 0 HG3 PRO A 85 12.888 4.089 -5.749 1.00 0.00 H new ATOM 0 HD2 PRO A 85 14.693 2.078 -6.712 1.00 0.00 H new ATOM 0 HD3 PRO A 85 13.071 1.824 -6.100 1.00 0.00 H new ATOM 963 N GLU A 86 14.040 4.838 -10.477 1.00 0.00 N ATOM 964 CA GLU A 86 15.033 5.222 -11.465 1.00 0.00 C ATOM 965 C GLU A 86 15.020 4.242 -12.640 1.00 0.00 C ATOM 966 O GLU A 86 14.169 3.357 -12.706 1.00 0.00 O ATOM 967 CB GLU A 86 16.426 5.310 -10.839 1.00 0.00 C ATOM 968 CG GLU A 86 16.648 6.673 -10.181 1.00 0.00 C ATOM 969 CD GLU A 86 18.075 6.797 -9.645 1.00 0.00 C ATOM 970 OE1 GLU A 86 18.300 6.315 -8.514 1.00 0.00 O ATOM 971 OE2 GLU A 86 18.909 7.374 -10.377 1.00 0.00 O ATOM 0 H GLU A 86 13.376 5.572 -10.231 1.00 0.00 H new ATOM 0 HA GLU A 86 14.778 6.213 -11.841 1.00 0.00 H new ATOM 0 HB2 GLU A 86 16.545 4.521 -10.097 1.00 0.00 H new ATOM 0 HB3 GLU A 86 17.184 5.145 -11.605 1.00 0.00 H new ATOM 0 HG2 GLU A 86 16.457 7.466 -10.905 1.00 0.00 H new ATOM 0 HG3 GLU A 86 15.937 6.808 -9.366 1.00 0.00 H new ATOM 976 N TYR A 87 15.976 4.433 -13.539 1.00 0.00 N ATOM 977 CA TYR A 87 16.085 3.576 -14.707 1.00 0.00 C ATOM 978 C TYR A 87 17.427 2.842 -14.725 1.00 0.00 C ATOM 979 O TYR A 87 18.463 3.441 -15.008 1.00 0.00 O ATOM 980 CB TYR A 87 16.010 4.506 -15.921 1.00 0.00 C ATOM 981 CG TYR A 87 16.602 5.895 -15.677 1.00 0.00 C ATOM 982 CD1 TYR A 87 15.843 6.871 -15.065 1.00 0.00 C ATOM 983 CD2 TYR A 87 17.897 6.172 -16.070 1.00 0.00 C ATOM 984 CE1 TYR A 87 16.401 8.179 -14.836 1.00 0.00 C ATOM 985 CE2 TYR A 87 18.454 7.480 -15.841 1.00 0.00 C ATOM 986 CZ TYR A 87 17.679 8.419 -15.235 1.00 0.00 C ATOM 987 OH TYR A 87 18.206 9.654 -15.018 1.00 0.00 O ATOM 0 H TYR A 87 16.681 5.168 -13.481 1.00 0.00 H new ATOM 0 HA TYR A 87 15.296 2.824 -14.706 1.00 0.00 H new ATOM 0 HB2 TYR A 87 16.534 4.040 -16.756 1.00 0.00 H new ATOM 0 HB3 TYR A 87 14.967 4.614 -16.220 1.00 0.00 H new ATOM 0 HD1 TYR A 87 14.831 6.654 -14.758 1.00 0.00 H new ATOM 0 HD2 TYR A 87 18.491 5.408 -16.549 1.00 0.00 H new ATOM 0 HE1 TYR A 87 15.818 8.952 -14.358 1.00 0.00 H new ATOM 0 HE2 TYR A 87 19.465 7.710 -16.144 1.00 0.00 H new ATOM 0 HH TYR A 87 19.126 9.680 -15.353 1.00 0.00 H new ATOM 996 N PHE A 88 17.365 1.554 -14.418 1.00 0.00 N ATOM 997 CA PHE A 88 18.563 0.732 -14.394 1.00 0.00 C ATOM 998 C PHE A 88 18.511 -0.344 -15.482 1.00 0.00 C ATOM 999 O PHE A 88 19.545 -0.865 -15.894 1.00 0.00 O ATOM 1000 CB PHE A 88 18.614 0.053 -13.024 1.00 0.00 C ATOM 1001 CG PHE A 88 17.278 -0.541 -12.575 1.00 0.00 C ATOM 1002 CD1 PHE A 88 16.317 0.265 -12.048 1.00 0.00 C ATOM 1003 CD2 PHE A 88 17.049 -1.875 -12.703 1.00 0.00 C ATOM 1004 CE1 PHE A 88 15.078 -0.287 -11.630 1.00 0.00 C ATOM 1005 CE2 PHE A 88 15.809 -2.428 -12.286 1.00 0.00 C ATOM 1006 CZ PHE A 88 14.849 -1.621 -11.758 1.00 0.00 C ATOM 0 H PHE A 88 16.504 1.060 -14.184 1.00 0.00 H new ATOM 0 HA PHE A 88 19.442 1.351 -14.573 1.00 0.00 H new ATOM 0 HB2 PHE A 88 19.362 -0.739 -13.050 1.00 0.00 H new ATOM 0 HB3 PHE A 88 18.945 0.779 -12.282 1.00 0.00 H new ATOM 0 HD1 PHE A 88 16.497 1.325 -11.948 1.00 0.00 H new ATOM 0 HD2 PHE A 88 17.811 -2.515 -13.122 1.00 0.00 H new ATOM 0 HE1 PHE A 88 14.316 0.353 -11.210 1.00 0.00 H new ATOM 0 HE2 PHE A 88 15.628 -3.488 -12.388 1.00 0.00 H new ATOM 0 HZ PHE A 88 13.906 -2.040 -11.441 1.00 0.00 H new ATOM 1015 N ASN A 89 17.294 -0.643 -15.915 1.00 0.00 N ATOM 1016 CA ASN A 89 17.093 -1.648 -16.945 1.00 0.00 C ATOM 1017 C ASN A 89 16.559 -0.973 -18.211 1.00 0.00 C ATOM 1018 O ASN A 89 17.227 -0.967 -19.244 1.00 0.00 O ATOM 1019 CB ASN A 89 16.072 -2.696 -16.501 1.00 0.00 C ATOM 1020 CG ASN A 89 15.018 -2.079 -15.581 1.00 0.00 C ATOM 1021 OD1 ASN A 89 14.600 -0.945 -15.744 1.00 0.00 O ATOM 1022 ND2 ASN A 89 14.613 -2.887 -14.604 1.00 0.00 N ATOM 0 H ASN A 89 16.438 -0.207 -15.571 1.00 0.00 H new ATOM 0 HA ASN A 89 18.050 -2.135 -17.133 1.00 0.00 H new ATOM 0 HB2 ASN A 89 15.587 -3.130 -17.376 1.00 0.00 H new ATOM 0 HB3 ASN A 89 16.581 -3.508 -15.983 1.00 0.00 H new ATOM 0 HD21 ASN A 89 13.912 -2.567 -13.936 1.00 0.00 H new ATOM 0 HD22 ASN A 89 15.004 -3.826 -14.524 1.00 0.00 H new ATOM 1028 N GLY A 90 15.361 -0.423 -18.088 1.00 0.00 N ATOM 1029 CA GLY A 90 14.730 0.253 -19.209 1.00 0.00 C ATOM 1030 C GLY A 90 13.348 0.785 -18.821 1.00 0.00 C ATOM 1031 O GLY A 90 12.421 0.762 -19.630 1.00 0.00 O ATOM 0 H GLY A 90 14.810 -0.431 -17.230 1.00 0.00 H new ATOM 0 HA2 GLY A 90 15.360 1.077 -19.543 1.00 0.00 H new ATOM 0 HA3 GLY A 90 14.636 -0.436 -20.048 1.00 0.00 H new ATOM 1035 N ILE A 91 13.256 1.253 -17.585 1.00 0.00 N ATOM 1036 CA ILE A 91 12.004 1.790 -17.081 1.00 0.00 C ATOM 1037 C ILE A 91 12.285 3.066 -16.284 1.00 0.00 C ATOM 1038 O ILE A 91 13.357 3.210 -15.695 1.00 0.00 O ATOM 1039 CB ILE A 91 11.244 0.725 -16.288 1.00 0.00 C ATOM 1040 CG1 ILE A 91 10.853 -0.452 -17.185 1.00 0.00 C ATOM 1041 CG2 ILE A 91 10.034 1.331 -15.576 1.00 0.00 C ATOM 1042 CD1 ILE A 91 9.760 -0.044 -18.177 1.00 0.00 C ATOM 0 H ILE A 91 14.028 1.271 -16.918 1.00 0.00 H new ATOM 0 HA ILE A 91 11.349 2.067 -17.907 1.00 0.00 H new ATOM 0 HB ILE A 91 11.908 0.334 -15.517 1.00 0.00 H new ATOM 0 HG12 ILE A 91 11.729 -0.807 -17.728 1.00 0.00 H new ATOM 0 HG13 ILE A 91 10.501 -1.281 -16.571 1.00 0.00 H new ATOM 0 HG21 ILE A 91 9.512 0.553 -15.020 1.00 0.00 H new ATOM 0 HG22 ILE A 91 10.368 2.107 -14.887 1.00 0.00 H new ATOM 0 HG23 ILE A 91 9.359 1.766 -16.313 1.00 0.00 H new ATOM 0 HD11 ILE A 91 9.500 -0.898 -18.803 1.00 0.00 H new ATOM 0 HD12 ILE A 91 8.877 0.287 -17.630 1.00 0.00 H new ATOM 0 HD13 ILE A 91 10.124 0.769 -18.805 1.00 0.00 H new ATOM 1053 N LYS A 92 11.306 3.957 -16.290 1.00 0.00 N ATOM 1054 CA LYS A 92 11.435 5.216 -15.575 1.00 0.00 C ATOM 1055 C LYS A 92 10.448 5.237 -14.406 1.00 0.00 C ATOM 1056 O LYS A 92 9.244 5.387 -14.609 1.00 0.00 O ATOM 1057 CB LYS A 92 11.277 6.396 -16.535 1.00 0.00 C ATOM 1058 CG LYS A 92 9.867 6.436 -17.127 1.00 0.00 C ATOM 1059 CD LYS A 92 9.909 6.761 -18.622 1.00 0.00 C ATOM 1060 CE LYS A 92 9.897 8.274 -18.854 1.00 0.00 C ATOM 1061 NZ LYS A 92 8.530 8.737 -19.179 1.00 0.00 N ATOM 0 H LYS A 92 10.419 3.833 -16.779 1.00 0.00 H new ATOM 0 HA LYS A 92 12.434 5.313 -15.151 1.00 0.00 H new ATOM 0 HB2 LYS A 92 11.481 7.328 -16.008 1.00 0.00 H new ATOM 0 HB3 LYS A 92 12.010 6.317 -17.338 1.00 0.00 H new ATOM 0 HG2 LYS A 92 9.377 5.474 -16.974 1.00 0.00 H new ATOM 0 HG3 LYS A 92 9.271 7.184 -16.605 1.00 0.00 H new ATOM 0 HD2 LYS A 92 10.805 6.328 -19.067 1.00 0.00 H new ATOM 0 HD3 LYS A 92 9.053 6.306 -19.121 1.00 0.00 H new ATOM 0 HE2 LYS A 92 10.259 8.787 -17.963 1.00 0.00 H new ATOM 0 HE3 LYS A 92 10.577 8.529 -19.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 8.539 9.765 -19.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 8.198 8.260 -20.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 7.890 8.511 -18.391 1.00 0.00 H new ATOM 1071 N TYR A 93 10.994 5.084 -13.209 1.00 0.00 N ATOM 1072 CA TYR A 93 10.176 5.083 -12.007 1.00 0.00 C ATOM 1073 C TYR A 93 10.674 6.127 -11.006 1.00 0.00 C ATOM 1074 O TYR A 93 11.320 5.785 -10.017 1.00 0.00 O ATOM 1075 CB TYR A 93 10.330 3.691 -11.394 1.00 0.00 C ATOM 1076 CG TYR A 93 9.504 2.609 -12.092 1.00 0.00 C ATOM 1077 CD1 TYR A 93 8.207 2.873 -12.480 1.00 0.00 C ATOM 1078 CD2 TYR A 93 10.057 1.368 -12.335 1.00 0.00 C ATOM 1079 CE1 TYR A 93 7.429 1.855 -13.137 1.00 0.00 C ATOM 1080 CE2 TYR A 93 9.280 0.349 -12.992 1.00 0.00 C ATOM 1081 CZ TYR A 93 8.004 0.643 -13.361 1.00 0.00 C ATOM 1082 OH TYR A 93 7.270 -0.319 -13.982 1.00 0.00 O ATOM 0 H TYR A 93 11.993 4.960 -13.045 1.00 0.00 H new ATOM 0 HA TYR A 93 9.140 5.321 -12.247 1.00 0.00 H new ATOM 0 HB2 TYR A 93 11.382 3.406 -11.424 1.00 0.00 H new ATOM 0 HB3 TYR A 93 10.041 3.734 -10.344 1.00 0.00 H new ATOM 0 HD1 TYR A 93 7.775 3.844 -12.291 1.00 0.00 H new ATOM 0 HD2 TYR A 93 11.073 1.161 -12.032 1.00 0.00 H new ATOM 0 HE1 TYR A 93 6.412 2.049 -13.445 1.00 0.00 H new ATOM 0 HE2 TYR A 93 9.701 -0.626 -13.187 1.00 0.00 H new ATOM 0 HH TYR A 93 7.145 -1.078 -13.375 1.00 0.00 H new ATOM 1091 N ASN A 94 10.354 7.379 -11.296 1.00 0.00 N ATOM 1092 CA ASN A 94 10.760 8.476 -10.432 1.00 0.00 C ATOM 1093 C ASN A 94 10.229 8.230 -9.019 1.00 0.00 C ATOM 1094 O ASN A 94 10.820 8.687 -8.042 1.00 0.00 O ATOM 1095 CB ASN A 94 10.191 9.807 -10.927 1.00 0.00 C ATOM 1096 CG ASN A 94 11.098 10.430 -11.990 1.00 0.00 C ATOM 1097 OD1 ASN A 94 11.271 11.635 -12.067 1.00 0.00 O ATOM 1098 ND2 ASN A 94 11.664 9.544 -12.804 1.00 0.00 N ATOM 0 H ASN A 94 9.818 7.659 -12.117 1.00 0.00 H new ATOM 0 HA ASN A 94 11.849 8.525 -10.439 1.00 0.00 H new ATOM 0 HB2 ASN A 94 9.195 9.649 -11.341 1.00 0.00 H new ATOM 0 HB3 ASN A 94 10.082 10.495 -10.088 1.00 0.00 H new ATOM 0 HD21 ASN A 94 12.286 9.860 -13.548 1.00 0.00 H new ATOM 0 HD22 ASN A 94 11.476 8.549 -12.684 1.00 0.00 H new ATOM 1104 N THR A 95 9.119 7.509 -8.956 1.00 0.00 N ATOM 1105 CA THR A 95 8.502 7.196 -7.678 1.00 0.00 C ATOM 1106 C THR A 95 9.518 6.546 -6.739 1.00 0.00 C ATOM 1107 O THR A 95 9.846 5.370 -6.892 1.00 0.00 O ATOM 1108 CB THR A 95 7.275 6.321 -7.947 1.00 0.00 C ATOM 1109 OG1 THR A 95 7.755 5.316 -8.836 1.00 0.00 O ATOM 1110 CG2 THR A 95 6.201 7.051 -8.755 1.00 0.00 C ATOM 0 H THR A 95 8.631 7.133 -9.769 1.00 0.00 H new ATOM 0 HA THR A 95 8.169 8.100 -7.168 1.00 0.00 H new ATOM 0 HB THR A 95 6.852 5.988 -6.999 1.00 0.00 H new ATOM 0 HG1 THR A 95 8.638 5.011 -8.539 1.00 0.00 H new ATOM 0 HG21 THR A 95 5.353 6.386 -8.918 1.00 0.00 H new ATOM 0 HG22 THR A 95 5.870 7.933 -8.207 1.00 0.00 H new ATOM 0 HG23 THR A 95 6.613 7.355 -9.717 1.00 0.00 H new ATOM 1118 N THR A 96 9.990 7.338 -5.788 1.00 0.00 N ATOM 1119 CA THR A 96 10.964 6.855 -4.824 1.00 0.00 C ATOM 1120 C THR A 96 10.502 5.526 -4.222 1.00 0.00 C ATOM 1121 O THR A 96 11.097 4.481 -4.483 1.00 0.00 O ATOM 1122 CB THR A 96 11.182 7.952 -3.781 1.00 0.00 C ATOM 1123 OG1 THR A 96 11.942 8.940 -4.469 1.00 0.00 O ATOM 1124 CG2 THR A 96 12.099 7.502 -2.642 1.00 0.00 C ATOM 0 H THR A 96 9.716 8.313 -5.664 1.00 0.00 H new ATOM 0 HA THR A 96 11.922 6.646 -5.300 1.00 0.00 H new ATOM 0 HB THR A 96 10.220 8.260 -3.372 1.00 0.00 H new ATOM 0 HG1 THR A 96 12.127 9.690 -3.865 1.00 0.00 H new ATOM 0 HG21 THR A 96 12.221 8.318 -1.929 1.00 0.00 H new ATOM 0 HG22 THR A 96 11.658 6.642 -2.138 1.00 0.00 H new ATOM 0 HG23 THR A 96 13.073 7.225 -3.046 1.00 0.00 H new ATOM 1132 N ARG A 97 9.444 5.609 -3.428 1.00 0.00 N ATOM 1133 CA ARG A 97 8.897 4.425 -2.786 1.00 0.00 C ATOM 1134 C ARG A 97 8.439 3.415 -3.839 1.00 0.00 C ATOM 1135 O ARG A 97 7.531 3.694 -4.621 1.00 0.00 O ATOM 1136 CB ARG A 97 7.712 4.785 -1.887 1.00 0.00 C ATOM 1137 CG ARG A 97 6.755 5.745 -2.598 1.00 0.00 C ATOM 1138 CD ARG A 97 5.361 5.693 -1.972 1.00 0.00 C ATOM 1139 NE ARG A 97 4.929 7.054 -1.581 1.00 0.00 N ATOM 1140 CZ ARG A 97 4.542 7.998 -2.450 1.00 0.00 C ATOM 1141 NH1 ARG A 97 4.530 7.734 -3.763 1.00 0.00 N ATOM 1142 NH2 ARG A 97 4.168 9.205 -2.005 1.00 0.00 N ATOM 0 H ARG A 97 8.952 6.476 -3.215 1.00 0.00 H new ATOM 0 HA ARG A 97 9.684 3.986 -2.173 1.00 0.00 H new ATOM 0 HB2 ARG A 97 7.178 3.878 -1.603 1.00 0.00 H new ATOM 0 HB3 ARG A 97 8.075 5.243 -0.967 1.00 0.00 H new ATOM 0 HG2 ARG A 97 7.145 6.761 -2.542 1.00 0.00 H new ATOM 0 HG3 ARG A 97 6.693 5.486 -3.655 1.00 0.00 H new ATOM 0 HD2 ARG A 97 4.651 5.267 -2.681 1.00 0.00 H new ATOM 0 HD3 ARG A 97 5.370 5.041 -1.099 1.00 0.00 H new ATOM 0 HE ARG A 97 4.926 7.288 -0.588 1.00 0.00 H new ATOM 0 HH11 ARG A 97 4.815 6.815 -4.101 1.00 0.00 H new ATOM 0 HH12 ARG A 97 4.236 8.452 -4.425 1.00 0.00 H new ATOM 0 HH21 ARG A 97 4.178 9.405 -1.005 1.00 0.00 H new ATOM 0 HH22 ARG A 97 3.873 9.924 -2.666 1.00 0.00 H new ATOM 1153 N ASN A 98 9.090 2.260 -3.826 1.00 0.00 N ATOM 1154 CA ASN A 98 8.761 1.205 -4.771 1.00 0.00 C ATOM 1155 C ASN A 98 7.763 0.241 -4.126 1.00 0.00 C ATOM 1156 O ASN A 98 7.595 0.239 -2.907 1.00 0.00 O ATOM 1157 CB ASN A 98 10.007 0.407 -5.160 1.00 0.00 C ATOM 1158 CG ASN A 98 10.835 0.049 -3.924 1.00 0.00 C ATOM 1159 OD1 ASN A 98 10.325 -0.113 -2.828 1.00 0.00 O ATOM 1160 ND2 ASN A 98 12.139 -0.066 -4.163 1.00 0.00 N ATOM 0 H ASN A 98 9.843 2.032 -3.177 1.00 0.00 H new ATOM 0 HA ASN A 98 8.338 1.669 -5.662 1.00 0.00 H new ATOM 0 HB2 ASN A 98 9.712 -0.504 -5.681 1.00 0.00 H new ATOM 0 HB3 ASN A 98 10.614 0.989 -5.853 1.00 0.00 H new ATOM 0 HD21 ASN A 98 12.778 -0.303 -3.404 1.00 0.00 H new ATOM 0 HD22 ASN A 98 12.500 0.083 -5.105 1.00 0.00 H new ATOM 1166 N ALA A 99 7.126 -0.554 -4.972 1.00 0.00 N ATOM 1167 CA ALA A 99 6.149 -1.520 -4.500 1.00 0.00 C ATOM 1168 C ALA A 99 5.565 -2.275 -5.696 1.00 0.00 C ATOM 1169 O ALA A 99 5.812 -1.911 -6.845 1.00 0.00 O ATOM 1170 CB ALA A 99 5.074 -0.802 -3.682 1.00 0.00 C ATOM 0 H ALA A 99 7.267 -0.549 -5.982 1.00 0.00 H new ATOM 0 HA ALA A 99 6.620 -2.253 -3.846 1.00 0.00 H new ATOM 0 HB1 ALA A 99 4.341 -1.527 -3.328 1.00 0.00 H new ATOM 0 HB2 ALA A 99 5.537 -0.307 -2.828 1.00 0.00 H new ATOM 0 HB3 ALA A 99 4.577 -0.059 -4.306 1.00 0.00 H new ATOM 1176 N TYR A 100 4.799 -3.310 -5.385 1.00 0.00 N ATOM 1177 CA TYR A 100 4.177 -4.119 -6.421 1.00 0.00 C ATOM 1178 C TYR A 100 2.707 -4.389 -6.095 1.00 0.00 C ATOM 1179 O TYR A 100 2.400 -5.150 -5.179 1.00 0.00 O ATOM 1180 CB TYR A 100 4.937 -5.446 -6.432 1.00 0.00 C ATOM 1181 CG TYR A 100 5.108 -6.053 -7.826 1.00 0.00 C ATOM 1182 CD1 TYR A 100 4.021 -6.591 -8.484 1.00 0.00 C ATOM 1183 CD2 TYR A 100 6.352 -6.063 -8.427 1.00 0.00 C ATOM 1184 CE1 TYR A 100 4.182 -7.162 -9.796 1.00 0.00 C ATOM 1185 CE2 TYR A 100 6.513 -6.634 -9.738 1.00 0.00 C ATOM 1186 CZ TYR A 100 5.419 -7.156 -10.358 1.00 0.00 C ATOM 1187 OH TYR A 100 5.572 -7.695 -11.598 1.00 0.00 O ATOM 0 H TYR A 100 4.595 -3.608 -4.431 1.00 0.00 H new ATOM 0 HA TYR A 100 4.215 -3.608 -7.383 1.00 0.00 H new ATOM 0 HB2 TYR A 100 5.922 -5.293 -5.990 1.00 0.00 H new ATOM 0 HB3 TYR A 100 4.411 -6.160 -5.798 1.00 0.00 H new ATOM 0 HD1 TYR A 100 3.048 -6.584 -8.014 1.00 0.00 H new ATOM 0 HD2 TYR A 100 7.204 -5.642 -7.913 1.00 0.00 H new ATOM 0 HE1 TYR A 100 3.339 -7.585 -10.321 1.00 0.00 H new ATOM 0 HE2 TYR A 100 7.480 -6.648 -10.219 1.00 0.00 H new ATOM 0 HH TYR A 100 6.509 -7.620 -11.874 1.00 0.00 H new ATOM 1196 N ARG A 101 1.838 -3.752 -6.866 1.00 0.00 N ATOM 1197 CA ARG A 101 0.407 -3.913 -6.671 1.00 0.00 C ATOM 1198 C ARG A 101 -0.272 -4.268 -7.996 1.00 0.00 C ATOM 1199 O ARG A 101 0.007 -3.655 -9.024 1.00 0.00 O ATOM 1200 CB ARG A 101 -0.221 -2.636 -6.110 1.00 0.00 C ATOM 1201 CG ARG A 101 -0.954 -2.916 -4.797 1.00 0.00 C ATOM 1202 CD ARG A 101 -2.416 -2.476 -4.880 1.00 0.00 C ATOM 1203 NE ARG A 101 -2.888 -2.029 -3.550 1.00 0.00 N ATOM 1204 CZ ARG A 101 -3.055 -2.845 -2.500 1.00 0.00 C ATOM 1205 NH1 ARG A 101 -2.791 -4.153 -2.618 1.00 0.00 N ATOM 1206 NH2 ARG A 101 -3.486 -2.351 -1.331 1.00 0.00 N ATOM 0 H ARG A 101 2.097 -3.124 -7.627 1.00 0.00 H new ATOM 0 HA ARG A 101 0.259 -4.721 -5.954 1.00 0.00 H new ATOM 0 HB2 ARG A 101 0.554 -1.887 -5.945 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -0.917 -2.219 -6.838 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -0.903 -3.981 -4.568 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -0.458 -2.391 -3.981 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -2.520 -1.667 -5.603 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -3.033 -3.301 -5.235 1.00 0.00 H new ATOM 0 HE ARG A 101 -3.099 -1.039 -3.425 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -2.463 -4.529 -3.508 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -2.918 -4.773 -1.818 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -3.687 -1.355 -1.241 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -3.613 -2.971 -0.531 1.00 0.00 H new ATOM 1217 N GLU A 102 -1.152 -5.257 -7.927 1.00 0.00 N ATOM 1218 CA GLU A 102 -1.872 -5.702 -9.108 1.00 0.00 C ATOM 1219 C GLU A 102 -3.379 -5.539 -8.902 1.00 0.00 C ATOM 1220 O GLU A 102 -3.862 -5.573 -7.771 1.00 0.00 O ATOM 1221 CB GLU A 102 -1.518 -7.149 -9.454 1.00 0.00 C ATOM 1222 CG GLU A 102 -1.437 -8.010 -8.192 1.00 0.00 C ATOM 1223 CD GLU A 102 -1.038 -9.448 -8.534 1.00 0.00 C ATOM 1224 OE1 GLU A 102 -1.852 -10.118 -9.205 1.00 0.00 O ATOM 1225 OE2 GLU A 102 0.072 -9.843 -8.117 1.00 0.00 O ATOM 0 H GLU A 102 -1.382 -5.762 -7.071 1.00 0.00 H new ATOM 0 HA GLU A 102 -1.571 -5.079 -9.950 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -2.268 -7.559 -10.131 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -0.564 -7.178 -9.980 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -0.711 -7.582 -7.501 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -2.401 -8.007 -7.683 1.00 0.00 H new ATOM 1230 N CYS A 103 -4.081 -5.367 -10.012 1.00 0.00 N ATOM 1231 CA CYS A 103 -5.523 -5.199 -9.968 1.00 0.00 C ATOM 1232 C CYS A 103 -6.169 -6.422 -10.623 1.00 0.00 C ATOM 1233 O CYS A 103 -6.025 -6.635 -11.825 1.00 0.00 O ATOM 1234 CB CYS A 103 -5.962 -3.895 -10.636 1.00 0.00 C ATOM 1235 SG CYS A 103 -6.746 -2.682 -9.512 1.00 0.00 S ATOM 0 H CYS A 103 -3.677 -5.340 -10.948 1.00 0.00 H new ATOM 0 HA CYS A 103 -5.852 -5.127 -8.931 1.00 0.00 H new ATOM 0 HB2 CYS A 103 -5.092 -3.430 -11.100 1.00 0.00 H new ATOM 0 HB3 CYS A 103 -6.662 -4.132 -11.437 1.00 0.00 H new ATOM 1239 N LEU A 104 -6.869 -7.193 -9.803 1.00 0.00 N ATOM 1240 CA LEU A 104 -7.537 -8.388 -10.288 1.00 0.00 C ATOM 1241 C LEU A 104 -8.421 -8.024 -11.482 1.00 0.00 C ATOM 1242 O LEU A 104 -8.607 -6.846 -11.785 1.00 0.00 O ATOM 1243 CB LEU A 104 -8.293 -9.077 -9.150 1.00 0.00 C ATOM 1244 CG LEU A 104 -7.494 -10.094 -8.332 1.00 0.00 C ATOM 1245 CD1 LEU A 104 -7.747 -9.913 -6.835 1.00 0.00 C ATOM 1246 CD2 LEU A 104 -7.787 -11.523 -8.796 1.00 0.00 C ATOM 0 H LEU A 104 -6.988 -7.013 -8.806 1.00 0.00 H new ATOM 0 HA LEU A 104 -6.807 -9.116 -10.642 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -8.668 -8.310 -8.473 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -9.162 -9.582 -9.571 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.433 -9.912 -8.503 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -7.167 -10.648 -6.277 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -7.447 -8.909 -6.534 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -8.808 -10.052 -6.626 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -7.206 -12.226 -8.198 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -8.849 -11.734 -8.674 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -7.514 -11.628 -9.846 1.00 0.00 H new ATOM 1257 N GLU A 105 -8.944 -9.057 -12.128 1.00 0.00 N ATOM 1258 CA GLU A 105 -9.804 -8.859 -13.282 1.00 0.00 C ATOM 1259 C GLU A 105 -11.210 -8.456 -12.833 1.00 0.00 C ATOM 1260 O GLU A 105 -12.098 -8.265 -13.662 1.00 0.00 O ATOM 1261 CB GLU A 105 -9.846 -10.116 -14.155 1.00 0.00 C ATOM 1262 CG GLU A 105 -8.680 -10.134 -15.145 1.00 0.00 C ATOM 1263 CD GLU A 105 -8.538 -11.510 -15.799 1.00 0.00 C ATOM 1264 OE1 GLU A 105 -8.632 -12.506 -15.052 1.00 0.00 O ATOM 1265 OE2 GLU A 105 -8.337 -11.534 -17.033 1.00 0.00 O ATOM 0 H GLU A 105 -8.788 -10.033 -11.874 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.391 -8.050 -13.885 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -9.805 -11.003 -13.523 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -10.790 -10.154 -14.699 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -8.838 -9.377 -15.913 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -7.756 -9.876 -14.629 1.00 0.00 H new ATOM 1270 N ASN A 106 -11.368 -8.340 -11.524 1.00 0.00 N ATOM 1271 CA ASN A 106 -12.650 -7.963 -10.954 1.00 0.00 C ATOM 1272 C ASN A 106 -12.645 -6.465 -10.645 1.00 0.00 C ATOM 1273 O ASN A 106 -13.652 -5.917 -10.198 1.00 0.00 O ATOM 1274 CB ASN A 106 -12.917 -8.715 -9.649 1.00 0.00 C ATOM 1275 CG ASN A 106 -14.410 -8.724 -9.316 1.00 0.00 C ATOM 1276 OD1 ASN A 106 -14.885 -7.997 -8.459 1.00 0.00 O ATOM 1277 ND2 ASN A 106 -15.120 -9.585 -10.039 1.00 0.00 N ATOM 0 H ASN A 106 -10.628 -8.501 -10.840 1.00 0.00 H new ATOM 0 HA ASN A 106 -13.426 -8.212 -11.677 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -12.554 -9.739 -9.735 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -12.362 -8.247 -8.836 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -16.126 -9.666 -9.892 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -14.659 -10.164 -10.741 1.00 0.00 H new ATOM 1283 N GLY A 107 -11.502 -5.845 -10.894 1.00 0.00 N ATOM 1284 CA GLY A 107 -11.352 -4.421 -10.647 1.00 0.00 C ATOM 1285 C GLY A 107 -11.060 -4.148 -9.169 1.00 0.00 C ATOM 1286 O GLY A 107 -11.455 -3.113 -8.635 1.00 0.00 O ATOM 0 H GLY A 107 -10.669 -6.303 -11.265 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -10.543 -4.025 -11.260 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -12.262 -3.899 -10.944 1.00 0.00 H new ATOM 1290 N THR A 108 -10.370 -5.096 -8.552 1.00 0.00 N ATOM 1291 CA THR A 108 -10.020 -4.971 -7.146 1.00 0.00 C ATOM 1292 C THR A 108 -8.506 -4.828 -6.985 1.00 0.00 C ATOM 1293 O THR A 108 -7.761 -4.936 -7.958 1.00 0.00 O ATOM 1294 CB THR A 108 -10.599 -6.178 -6.406 1.00 0.00 C ATOM 1295 OG1 THR A 108 -9.938 -7.296 -6.995 1.00 0.00 O ATOM 1296 CG2 THR A 108 -12.077 -6.409 -6.726 1.00 0.00 C ATOM 0 H THR A 108 -10.044 -5.953 -8.999 1.00 0.00 H new ATOM 0 HA THR A 108 -10.448 -4.069 -6.710 1.00 0.00 H new ATOM 0 HB THR A 108 -10.478 -6.036 -5.332 1.00 0.00 H new ATOM 0 HG1 THR A 108 -10.530 -7.716 -7.654 1.00 0.00 H new ATOM 0 HG21 THR A 108 -12.437 -7.277 -6.175 1.00 0.00 H new ATOM 0 HG22 THR A 108 -12.654 -5.530 -6.436 1.00 0.00 H new ATOM 0 HG23 THR A 108 -12.195 -6.584 -7.795 1.00 0.00 H new ATOM 1304 N TRP A 109 -8.095 -4.585 -5.749 1.00 0.00 N ATOM 1305 CA TRP A 109 -6.682 -4.424 -5.448 1.00 0.00 C ATOM 1306 C TRP A 109 -6.176 -5.736 -4.843 1.00 0.00 C ATOM 1307 O TRP A 109 -6.919 -6.714 -4.763 1.00 0.00 O ATOM 1308 CB TRP A 109 -6.450 -3.217 -4.537 1.00 0.00 C ATOM 1309 CG TRP A 109 -6.262 -1.898 -5.289 1.00 0.00 C ATOM 1310 CD1 TRP A 109 -6.890 -0.733 -5.081 1.00 0.00 C ATOM 1311 CD2 TRP A 109 -5.355 -1.655 -6.385 1.00 0.00 C ATOM 1312 NE1 TRP A 109 -6.456 0.240 -5.959 1.00 0.00 N ATOM 1313 CE2 TRP A 109 -5.493 -0.339 -6.777 1.00 0.00 C ATOM 1314 CE3 TRP A 109 -4.448 -2.518 -7.024 1.00 0.00 C ATOM 1315 CZ2 TRP A 109 -4.756 0.231 -7.822 1.00 0.00 C ATOM 1316 CZ3 TRP A 109 -3.719 -1.934 -8.067 1.00 0.00 C ATOM 1317 CH2 TRP A 109 -3.847 -0.610 -8.473 1.00 0.00 C ATOM 0 H TRP A 109 -8.715 -4.496 -4.944 1.00 0.00 H new ATOM 0 HA TRP A 109 -6.115 -4.217 -6.355 1.00 0.00 H new ATOM 0 HB2 TRP A 109 -7.297 -3.119 -3.858 1.00 0.00 H new ATOM 0 HB3 TRP A 109 -5.569 -3.402 -3.923 1.00 0.00 H new ATOM 0 HD1 TRP A 109 -7.642 -0.575 -4.322 1.00 0.00 H new ATOM 0 HE1 TRP A 109 -6.782 1.206 -6.000 1.00 0.00 H new ATOM 0 HE3 TRP A 109 -4.323 -3.551 -6.733 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 -4.882 1.264 -8.110 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 -3.008 -2.555 -8.593 1.00 0.00 H new ATOM 0 HH2 TRP A 109 -3.247 -0.232 -9.288 1.00 0.00 H new ATOM 1327 N ALA A 110 -4.917 -5.713 -4.431 1.00 0.00 N ATOM 1328 CA ALA A 110 -4.304 -6.888 -3.836 1.00 0.00 C ATOM 1329 C ALA A 110 -4.442 -6.815 -2.315 1.00 0.00 C ATOM 1330 O ALA A 110 -5.332 -6.140 -1.800 1.00 0.00 O ATOM 1331 CB ALA A 110 -2.845 -6.986 -4.285 1.00 0.00 C ATOM 0 H ALA A 110 -4.305 -4.900 -4.497 1.00 0.00 H new ATOM 0 HA ALA A 110 -4.809 -7.794 -4.170 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -2.385 -7.868 -3.838 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -2.803 -7.066 -5.371 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -2.305 -6.094 -3.966 1.00 0.00 H new ATOM 1337 N SER A 111 -3.546 -7.518 -1.636 1.00 0.00 N ATOM 1338 CA SER A 111 -3.557 -7.540 -0.183 1.00 0.00 C ATOM 1339 C SER A 111 -2.331 -6.806 0.361 1.00 0.00 C ATOM 1340 O SER A 111 -2.443 -6.003 1.285 1.00 0.00 O ATOM 1341 CB SER A 111 -3.594 -8.977 0.344 1.00 0.00 C ATOM 1342 OG SER A 111 -2.311 -9.595 0.300 1.00 0.00 O ATOM 0 H SER A 111 -2.808 -8.076 -2.065 1.00 0.00 H new ATOM 0 HA SER A 111 -4.458 -7.031 0.161 1.00 0.00 H new ATOM 0 HB2 SER A 111 -3.962 -8.977 1.370 1.00 0.00 H new ATOM 0 HB3 SER A 111 -4.299 -9.562 -0.247 1.00 0.00 H new ATOM 0 HG SER A 111 -2.376 -10.510 0.646 1.00 0.00 H new ATOM 1347 N ARG A 112 -1.187 -7.108 -0.237 1.00 0.00 N ATOM 1348 CA ARG A 112 0.060 -6.487 0.176 1.00 0.00 C ATOM 1349 C ARG A 112 0.893 -6.103 -1.048 1.00 0.00 C ATOM 1350 O ARG A 112 1.062 -6.906 -1.966 1.00 0.00 O ATOM 1351 CB ARG A 112 0.877 -7.427 1.065 1.00 0.00 C ATOM 1352 CG ARG A 112 1.077 -8.785 0.389 1.00 0.00 C ATOM 1353 CD ARG A 112 0.600 -9.923 1.294 1.00 0.00 C ATOM 1354 NE ARG A 112 1.514 -10.068 2.449 1.00 0.00 N ATOM 1355 CZ ARG A 112 1.305 -10.907 3.472 1.00 0.00 C ATOM 1356 NH1 ARG A 112 0.212 -11.681 3.491 1.00 0.00 N ATOM 1357 NH2 ARG A 112 2.188 -10.971 4.478 1.00 0.00 N ATOM 0 H ARG A 112 -1.098 -7.774 -1.004 1.00 0.00 H new ATOM 0 HA ARG A 112 -0.189 -5.592 0.746 1.00 0.00 H new ATOM 0 HB2 ARG A 112 1.846 -6.978 1.281 1.00 0.00 H new ATOM 0 HB3 ARG A 112 0.369 -7.563 2.020 1.00 0.00 H new ATOM 0 HG2 ARG A 112 0.529 -8.811 -0.553 1.00 0.00 H new ATOM 0 HG3 ARG A 112 2.131 -8.924 0.149 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -0.412 -9.720 1.644 1.00 0.00 H new ATOM 0 HD3 ARG A 112 0.562 -10.855 0.731 1.00 0.00 H new ATOM 0 HE ARG A 112 2.356 -9.493 2.467 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -0.461 -11.632 2.726 1.00 0.00 H new ATOM 0 HH12 ARG A 112 0.053 -12.320 4.270 1.00 0.00 H new ATOM 0 HH21 ARG A 112 3.020 -10.381 4.465 1.00 0.00 H new ATOM 0 HH22 ARG A 112 2.028 -11.610 5.257 1.00 0.00 H new ATOM 1368 N VAL A 113 1.391 -4.876 -1.024 1.00 0.00 N ATOM 1369 CA VAL A 113 2.202 -4.376 -2.122 1.00 0.00 C ATOM 1370 C VAL A 113 3.681 -4.603 -1.802 1.00 0.00 C ATOM 1371 O VAL A 113 4.408 -3.657 -1.502 1.00 0.00 O ATOM 1372 CB VAL A 113 1.869 -2.907 -2.392 1.00 0.00 C ATOM 1373 CG1 VAL A 113 1.913 -2.602 -3.891 1.00 0.00 C ATOM 1374 CG2 VAL A 113 0.510 -2.535 -1.797 1.00 0.00 C ATOM 0 H VAL A 113 1.249 -4.213 -0.262 1.00 0.00 H new ATOM 0 HA VAL A 113 1.979 -4.921 -3.040 1.00 0.00 H new ATOM 0 HB VAL A 113 2.628 -2.296 -1.903 1.00 0.00 H new ATOM 0 HG11 VAL A 113 1.673 -1.552 -4.056 1.00 0.00 H new ATOM 0 HG12 VAL A 113 2.911 -2.810 -4.276 1.00 0.00 H new ATOM 0 HG13 VAL A 113 1.186 -3.226 -4.411 1.00 0.00 H new ATOM 0 HG21 VAL A 113 0.298 -1.486 -2.003 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -0.265 -3.157 -2.244 1.00 0.00 H new ATOM 0 HG23 VAL A 113 0.528 -2.697 -0.719 1.00 0.00 H new ATOM 1384 N ASN A 114 4.082 -5.863 -1.876 1.00 0.00 N ATOM 1385 CA ASN A 114 5.462 -6.227 -1.598 1.00 0.00 C ATOM 1386 C ASN A 114 6.237 -6.317 -2.915 1.00 0.00 C ATOM 1387 O ASN A 114 5.658 -6.174 -3.991 1.00 0.00 O ATOM 1388 CB ASN A 114 5.544 -7.590 -0.907 1.00 0.00 C ATOM 1389 CG ASN A 114 5.797 -7.430 0.592 1.00 0.00 C ATOM 1390 OD1 ASN A 114 6.655 -8.073 1.176 1.00 0.00 O ATOM 1391 ND2 ASN A 114 5.006 -6.539 1.183 1.00 0.00 N ATOM 0 H ASN A 114 3.476 -6.645 -2.124 1.00 0.00 H new ATOM 0 HA ASN A 114 5.886 -5.465 -0.944 1.00 0.00 H new ATOM 0 HB2 ASN A 114 4.616 -8.139 -1.066 1.00 0.00 H new ATOM 0 HB3 ASN A 114 6.344 -8.181 -1.353 1.00 0.00 H new ATOM 0 HD21 ASN A 114 5.097 -6.360 2.183 1.00 0.00 H new ATOM 0 HD22 ASN A 114 4.308 -6.035 0.636 1.00 0.00 H new ATOM 1397 N TYR A 115 7.533 -6.554 -2.786 1.00 0.00 N ATOM 1398 CA TYR A 115 8.393 -6.664 -3.952 1.00 0.00 C ATOM 1399 C TYR A 115 9.706 -7.369 -3.601 1.00 0.00 C ATOM 1400 O TYR A 115 10.578 -6.782 -2.963 1.00 0.00 O ATOM 1401 CB TYR A 115 8.699 -5.230 -4.389 1.00 0.00 C ATOM 1402 CG TYR A 115 8.953 -4.267 -3.227 1.00 0.00 C ATOM 1403 CD1 TYR A 115 7.890 -3.738 -2.525 1.00 0.00 C ATOM 1404 CD2 TYR A 115 10.245 -3.928 -2.883 1.00 0.00 C ATOM 1405 CE1 TYR A 115 8.130 -2.832 -1.431 1.00 0.00 C ATOM 1406 CE2 TYR A 115 10.485 -3.022 -1.790 1.00 0.00 C ATOM 1407 CZ TYR A 115 9.416 -2.519 -1.118 1.00 0.00 C ATOM 1408 OH TYR A 115 9.642 -1.663 -0.085 1.00 0.00 O ATOM 0 H TYR A 115 8.009 -6.673 -1.892 1.00 0.00 H new ATOM 0 HA TYR A 115 7.904 -7.244 -4.735 1.00 0.00 H new ATOM 0 HB2 TYR A 115 9.574 -5.238 -5.039 1.00 0.00 H new ATOM 0 HB3 TYR A 115 7.865 -4.856 -4.982 1.00 0.00 H new ATOM 0 HD1 TYR A 115 6.878 -4.003 -2.795 1.00 0.00 H new ATOM 0 HD2 TYR A 115 11.077 -4.342 -3.434 1.00 0.00 H new ATOM 0 HE1 TYR A 115 7.307 -2.411 -0.872 1.00 0.00 H new ATOM 0 HE2 TYR A 115 11.492 -2.748 -1.510 1.00 0.00 H new ATOM 0 HH TYR A 115 10.607 -1.531 0.026 1.00 0.00 H new ATOM 1417 N SER A 116 9.804 -8.617 -4.034 1.00 0.00 N ATOM 1418 CA SER A 116 10.995 -9.407 -3.773 1.00 0.00 C ATOM 1419 C SER A 116 11.839 -9.517 -5.045 1.00 0.00 C ATOM 1420 O SER A 116 12.885 -10.164 -5.046 1.00 0.00 O ATOM 1421 CB SER A 116 10.630 -10.801 -3.257 1.00 0.00 C ATOM 1422 OG SER A 116 10.618 -10.857 -1.833 1.00 0.00 O ATOM 0 H SER A 116 9.079 -9.100 -4.564 1.00 0.00 H new ATOM 0 HA SER A 116 11.576 -8.904 -3.000 1.00 0.00 H new ATOM 0 HB2 SER A 116 9.649 -11.084 -3.639 1.00 0.00 H new ATOM 0 HB3 SER A 116 11.344 -11.529 -3.642 1.00 0.00 H new ATOM 0 HG SER A 116 10.379 -11.762 -1.543 1.00 0.00 H new ATOM 1427 N HIS A 117 11.353 -8.873 -6.096 1.00 0.00 N ATOM 1428 CA HIS A 117 12.050 -8.890 -7.371 1.00 0.00 C ATOM 1429 C HIS A 117 12.661 -7.513 -7.640 1.00 0.00 C ATOM 1430 O HIS A 117 12.772 -7.094 -8.791 1.00 0.00 O ATOM 1431 CB HIS A 117 11.119 -9.356 -8.493 1.00 0.00 C ATOM 1432 CG HIS A 117 11.689 -10.466 -9.343 1.00 0.00 C ATOM 1433 ND1 HIS A 117 12.265 -11.603 -8.804 1.00 0.00 N ATOM 1434 CD2 HIS A 117 11.766 -10.601 -10.699 1.00 0.00 C ATOM 1435 CE1 HIS A 117 12.667 -12.380 -9.799 1.00 0.00 C ATOM 1436 NE2 HIS A 117 12.357 -11.757 -10.972 1.00 0.00 N ATOM 0 H HIS A 117 10.486 -8.336 -6.091 1.00 0.00 H new ATOM 0 HA HIS A 117 12.867 -9.610 -7.334 1.00 0.00 H new ATOM 0 HB2 HIS A 117 10.180 -9.694 -8.055 1.00 0.00 H new ATOM 0 HB3 HIS A 117 10.885 -8.506 -9.133 1.00 0.00 H new ATOM 0 HD2 HIS A 117 11.407 -9.888 -11.426 1.00 0.00 H new ATOM 0 HE1 HIS A 117 13.155 -13.338 -9.699 1.00 0.00 H new ATOM 0 HE2 HIS A 117 12.548 -12.120 -11.906 1.00 0.00 H new ATOM 1443 N CYS A 118 13.040 -6.848 -6.559 1.00 0.00 N ATOM 1444 CA CYS A 118 13.636 -5.527 -6.664 1.00 0.00 C ATOM 1445 C CYS A 118 15.145 -5.663 -6.449 1.00 0.00 C ATOM 1446 O CYS A 118 15.937 -5.219 -7.278 1.00 0.00 O ATOM 1447 CB CYS A 118 13.005 -4.542 -5.679 1.00 0.00 C ATOM 1448 SG CYS A 118 13.528 -2.801 -5.894 1.00 0.00 S ATOM 0 H CYS A 118 12.946 -7.199 -5.606 1.00 0.00 H new ATOM 0 HA CYS A 118 13.447 -5.117 -7.656 1.00 0.00 H new ATOM 0 HB2 CYS A 118 11.921 -4.596 -5.777 1.00 0.00 H new ATOM 0 HB3 CYS A 118 13.249 -4.857 -4.665 1.00 0.00 H new ATOM 1452 N GLU A 119 15.498 -6.278 -5.330 1.00 0.00 N ATOM 1453 CA GLU A 119 16.897 -6.477 -4.995 1.00 0.00 C ATOM 1454 C GLU A 119 17.670 -6.978 -6.217 1.00 0.00 C ATOM 1455 O GLU A 119 18.676 -6.387 -6.604 1.00 0.00 O ATOM 1456 CB GLU A 119 17.047 -7.444 -3.818 1.00 0.00 C ATOM 1457 CG GLU A 119 17.684 -6.747 -2.613 1.00 0.00 C ATOM 1458 CD GLU A 119 17.180 -7.351 -1.301 1.00 0.00 C ATOM 1459 OE1 GLU A 119 16.085 -6.933 -0.868 1.00 0.00 O ATOM 1460 OE2 GLU A 119 17.902 -8.217 -0.760 1.00 0.00 O ATOM 0 H GLU A 119 14.839 -6.645 -4.644 1.00 0.00 H new ATOM 0 HA GLU A 119 17.317 -5.518 -4.691 1.00 0.00 H new ATOM 0 HB2 GLU A 119 16.070 -7.838 -3.540 1.00 0.00 H new ATOM 0 HB3 GLU A 119 17.660 -8.294 -4.117 1.00 0.00 H new ATOM 0 HG2 GLU A 119 18.769 -6.839 -2.667 1.00 0.00 H new ATOM 0 HG3 GLU A 119 17.453 -5.682 -2.640 1.00 0.00 H new ATOM 1465 N PRO A 120 17.156 -8.091 -6.805 1.00 0.00 N ATOM 1466 CA PRO A 120 17.787 -8.678 -7.975 1.00 0.00 C ATOM 1467 C PRO A 120 17.503 -7.843 -9.227 1.00 0.00 C ATOM 1468 O PRO A 120 16.348 -7.567 -9.544 1.00 0.00 O ATOM 1469 CB PRO A 120 17.223 -10.087 -8.061 1.00 0.00 C ATOM 1470 CG PRO A 120 15.959 -10.082 -7.218 1.00 0.00 C ATOM 1471 CD PRO A 120 15.965 -8.818 -6.373 1.00 0.00 C ATOM 0 HA PRO A 120 18.874 -8.702 -7.899 1.00 0.00 H new ATOM 0 HB2 PRO A 120 17.003 -10.357 -9.094 1.00 0.00 H new ATOM 0 HB3 PRO A 120 17.939 -10.818 -7.686 1.00 0.00 H new ATOM 0 HG2 PRO A 120 15.075 -10.110 -7.855 1.00 0.00 H new ATOM 0 HG3 PRO A 120 15.921 -10.966 -6.582 1.00 0.00 H new ATOM 0 HD2 PRO A 120 15.062 -8.230 -6.534 1.00 0.00 H new ATOM 0 HD3 PRO A 120 16.008 -9.052 -5.309 1.00 0.00 H new ATOM 1476 N ILE A 121 18.579 -7.466 -9.902 1.00 0.00 N ATOM 1477 CA ILE A 121 18.461 -6.669 -11.112 1.00 0.00 C ATOM 1478 C ILE A 121 17.980 -7.559 -12.260 1.00 0.00 C ATOM 1479 O ILE A 121 18.481 -8.668 -12.441 1.00 0.00 O ATOM 1480 CB ILE A 121 19.775 -5.944 -11.406 1.00 0.00 C ATOM 1481 CG1 ILE A 121 20.153 -5.007 -10.256 1.00 0.00 C ATOM 1482 CG2 ILE A 121 19.708 -5.208 -12.746 1.00 0.00 C ATOM 1483 CD1 ILE A 121 19.170 -3.840 -10.153 1.00 0.00 C ATOM 0 H ILE A 121 19.536 -7.697 -9.635 1.00 0.00 H new ATOM 0 HA ILE A 121 17.714 -5.886 -10.981 1.00 0.00 H new ATOM 0 HB ILE A 121 20.566 -6.690 -11.488 1.00 0.00 H new ATOM 0 HG12 ILE A 121 20.163 -5.562 -9.318 1.00 0.00 H new ATOM 0 HG13 ILE A 121 21.162 -4.625 -10.411 1.00 0.00 H new ATOM 0 HG21 ILE A 121 20.655 -4.701 -12.930 1.00 0.00 H new ATOM 0 HG22 ILE A 121 19.518 -5.924 -13.545 1.00 0.00 H new ATOM 0 HG23 ILE A 121 18.903 -4.474 -12.718 1.00 0.00 H new ATOM 0 HD11 ILE A 121 19.462 -3.190 -9.328 1.00 0.00 H new ATOM 0 HD12 ILE A 121 19.180 -3.272 -11.083 1.00 0.00 H new ATOM 0 HD13 ILE A 121 18.166 -4.225 -9.974 1.00 0.00 H new ATOM 1494 N LEU A 122 17.014 -7.041 -13.003 1.00 0.00 N ATOM 1495 CA LEU A 122 16.460 -7.776 -14.128 1.00 0.00 C ATOM 1496 C LEU A 122 16.849 -7.074 -15.430 1.00 0.00 C ATOM 1497 O LEU A 122 17.532 -6.051 -15.409 1.00 0.00 O ATOM 1498 CB LEU A 122 14.951 -7.961 -13.956 1.00 0.00 C ATOM 1499 CG LEU A 122 14.076 -6.790 -14.408 1.00 0.00 C ATOM 1500 CD1 LEU A 122 12.937 -7.273 -15.309 1.00 0.00 C ATOM 1501 CD2 LEU A 122 13.560 -5.995 -13.207 1.00 0.00 C ATOM 0 H LEU A 122 16.600 -6.121 -12.849 1.00 0.00 H new ATOM 0 HA LEU A 122 16.878 -8.782 -14.170 1.00 0.00 H new ATOM 0 HB2 LEU A 122 14.648 -8.850 -14.510 1.00 0.00 H new ATOM 0 HB3 LEU A 122 14.747 -8.156 -12.903 1.00 0.00 H new ATOM 0 HG LEU A 122 14.691 -6.113 -15.001 1.00 0.00 H new ATOM 0 HD11 LEU A 122 12.330 -6.421 -15.616 1.00 0.00 H new ATOM 0 HD12 LEU A 122 13.352 -7.760 -16.191 1.00 0.00 H new ATOM 0 HD13 LEU A 122 12.316 -7.982 -14.762 1.00 0.00 H new ATOM 0 HD21 LEU A 122 12.941 -5.169 -13.556 1.00 0.00 H new ATOM 0 HD22 LEU A 122 12.966 -6.647 -12.567 1.00 0.00 H new ATOM 0 HD23 LEU A 122 14.404 -5.602 -12.641 1.00 0.00 H new ATOM 1512 N ASP A 123 16.397 -7.651 -16.535 1.00 0.00 N ATOM 1513 CA ASP A 123 16.690 -7.094 -17.844 1.00 0.00 C ATOM 1514 C ASP A 123 18.191 -7.204 -18.117 1.00 0.00 C ATOM 1515 O ASP A 123 18.956 -7.612 -17.244 1.00 0.00 O ATOM 1516 CB ASP A 123 16.304 -5.615 -17.912 1.00 0.00 C ATOM 1517 CG ASP A 123 15.459 -5.222 -19.125 1.00 0.00 C ATOM 1518 OD1 ASP A 123 16.073 -4.937 -20.176 1.00 0.00 O ATOM 1519 OD2 ASP A 123 14.218 -5.215 -18.975 1.00 0.00 O ATOM 0 H ASP A 123 15.830 -8.499 -16.550 1.00 0.00 H new ATOM 0 HA ASP A 123 16.115 -7.651 -18.584 1.00 0.00 H new ATOM 0 HB2 ASP A 123 15.755 -5.356 -17.007 1.00 0.00 H new ATOM 0 HB3 ASP A 123 17.215 -5.017 -17.914 1.00 0.00 H new ATOM 1523 N ASP A 124 18.568 -6.833 -19.332 1.00 0.00 N ATOM 1524 CA ASP A 124 19.964 -6.884 -19.730 1.00 0.00 C ATOM 1525 C ASP A 124 20.394 -8.346 -19.875 1.00 0.00 C ATOM 1526 O ASP A 124 19.622 -9.256 -19.583 1.00 0.00 O ATOM 1527 CB ASP A 124 20.862 -6.230 -18.678 1.00 0.00 C ATOM 1528 CG ASP A 124 21.750 -5.098 -19.200 1.00 0.00 C ATOM 1529 OD1 ASP A 124 21.378 -4.519 -20.244 1.00 0.00 O ATOM 1530 OD2 ASP A 124 22.782 -4.837 -18.544 1.00 0.00 O ATOM 0 H ASP A 124 17.931 -6.496 -20.054 1.00 0.00 H new ATOM 0 HA ASP A 124 20.066 -6.348 -20.674 1.00 0.00 H new ATOM 0 HB2 ASP A 124 20.234 -5.839 -17.878 1.00 0.00 H new ATOM 0 HB3 ASP A 124 21.499 -6.997 -18.237 1.00 0.00 H new ATOM 1534 N LYS A 125 21.628 -8.524 -20.329 1.00 0.00 N ATOM 1535 CA LYS A 125 22.170 -9.858 -20.516 1.00 0.00 C ATOM 1536 C LYS A 125 21.802 -10.728 -19.313 1.00 0.00 C ATOM 1537 O LYS A 125 21.956 -10.306 -18.168 1.00 0.00 O ATOM 1538 CB LYS A 125 23.674 -9.792 -20.790 1.00 0.00 C ATOM 1539 CG LYS A 125 24.031 -10.545 -22.073 1.00 0.00 C ATOM 1540 CD LYS A 125 25.278 -11.409 -21.871 1.00 0.00 C ATOM 1541 CE LYS A 125 26.542 -10.548 -21.840 1.00 0.00 C ATOM 1542 NZ LYS A 125 27.149 -10.569 -20.490 1.00 0.00 N ATOM 0 H LYS A 125 22.266 -7.766 -20.572 1.00 0.00 H new ATOM 0 HA LYS A 125 21.729 -10.328 -21.395 1.00 0.00 H new ATOM 0 HB2 LYS A 125 23.986 -8.751 -20.876 1.00 0.00 H new ATOM 0 HB3 LYS A 125 24.220 -10.220 -19.949 1.00 0.00 H new ATOM 0 HG2 LYS A 125 23.193 -11.174 -22.375 1.00 0.00 H new ATOM 0 HG3 LYS A 125 24.204 -9.834 -22.881 1.00 0.00 H new ATOM 0 HD2 LYS A 125 25.191 -11.967 -20.939 1.00 0.00 H new ATOM 0 HD3 LYS A 125 25.352 -12.141 -22.675 1.00 0.00 H new ATOM 0 HE2 LYS A 125 27.259 -10.917 -22.574 1.00 0.00 H new ATOM 0 HE3 LYS A 125 26.298 -9.523 -22.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 28.006 -9.980 -20.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 26.469 -10.196 -19.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 27.399 -11.546 -20.237 1.00 0.00 H new ATOM 1552 N GLN A 126 21.322 -11.926 -19.614 1.00 0.00 N ATOM 1553 CA GLN A 126 20.931 -12.858 -18.570 1.00 0.00 C ATOM 1554 C GLN A 126 21.987 -13.955 -18.416 1.00 0.00 C ATOM 1555 O GLN A 126 22.951 -14.004 -19.176 1.00 0.00 O ATOM 1556 CB GLN A 126 19.555 -13.460 -18.860 1.00 0.00 C ATOM 1557 CG GLN A 126 18.438 -12.515 -18.412 1.00 0.00 C ATOM 1558 CD GLN A 126 17.259 -13.297 -17.829 1.00 0.00 C ATOM 1559 OE1 GLN A 126 17.402 -14.391 -17.309 1.00 0.00 O ATOM 1560 NE2 GLN A 126 16.088 -12.676 -17.944 1.00 0.00 N ATOM 0 H GLN A 126 21.195 -12.272 -20.565 1.00 0.00 H new ATOM 0 HA GLN A 126 20.862 -12.312 -17.629 1.00 0.00 H new ATOM 0 HB2 GLN A 126 19.460 -13.661 -19.927 1.00 0.00 H new ATOM 0 HB3 GLN A 126 19.456 -14.416 -18.345 1.00 0.00 H new ATOM 0 HG2 GLN A 126 18.822 -11.820 -17.666 1.00 0.00 H new ATOM 0 HG3 GLN A 126 18.100 -11.918 -19.259 1.00 0.00 H new ATOM 0 HE21 GLN A 126 16.038 -11.760 -18.391 1.00 0.00 H new ATOM 0 HE22 GLN A 126 15.240 -13.116 -17.585 1.00 0.00 H new ATOM 1567 N ARG A 127 21.768 -14.807 -17.425 1.00 0.00 N ATOM 1568 CA ARG A 127 22.688 -15.900 -17.160 1.00 0.00 C ATOM 1569 C ARG A 127 23.176 -16.514 -18.475 1.00 0.00 C ATOM 1570 O ARG A 127 22.382 -17.053 -19.244 1.00 0.00 O ATOM 1571 CB ARG A 127 22.024 -16.988 -16.313 1.00 0.00 C ATOM 1572 CG ARG A 127 23.068 -17.934 -15.719 1.00 0.00 C ATOM 1573 CD ARG A 127 22.441 -18.852 -14.668 1.00 0.00 C ATOM 1574 NE ARG A 127 21.820 -20.024 -15.324 1.00 0.00 N ATOM 1575 CZ ARG A 127 20.580 -20.032 -15.832 1.00 0.00 C ATOM 1576 NH1 ARG A 127 19.821 -18.931 -15.761 1.00 0.00 N ATOM 1577 NH2 ARG A 127 20.101 -21.141 -16.410 1.00 0.00 N ATOM 0 H ARG A 127 20.966 -14.762 -16.796 1.00 0.00 H new ATOM 0 HA ARG A 127 23.535 -15.493 -16.608 1.00 0.00 H new ATOM 0 HB2 ARG A 127 21.447 -16.528 -15.511 1.00 0.00 H new ATOM 0 HB3 ARG A 127 21.323 -17.554 -16.926 1.00 0.00 H new ATOM 0 HG2 ARG A 127 23.513 -18.534 -16.512 1.00 0.00 H new ATOM 0 HG3 ARG A 127 23.873 -17.355 -15.267 1.00 0.00 H new ATOM 0 HD2 ARG A 127 23.202 -19.182 -13.961 1.00 0.00 H new ATOM 0 HD3 ARG A 127 21.691 -18.305 -14.097 1.00 0.00 H new ATOM 0 HE ARG A 127 22.371 -20.880 -15.394 1.00 0.00 H new ATOM 0 HH11 ARG A 127 20.187 -18.087 -15.320 1.00 0.00 H new ATOM 0 HH12 ARG A 127 18.877 -18.936 -16.148 1.00 0.00 H new ATOM 0 HH21 ARG A 127 20.680 -21.979 -16.463 1.00 0.00 H new ATOM 0 HH22 ARG A 127 19.157 -21.148 -16.797 1.00 0.00 H new ATOM 1588 N LYS A 128 24.479 -16.409 -18.692 1.00 0.00 N ATOM 1589 CA LYS A 128 25.082 -16.947 -19.900 1.00 0.00 C ATOM 1590 C LYS A 128 24.446 -18.300 -20.223 1.00 0.00 C ATOM 1591 O LYS A 128 23.755 -18.441 -21.231 1.00 0.00 O ATOM 1592 CB LYS A 128 26.604 -17.000 -19.760 1.00 0.00 C ATOM 1593 CG LYS A 128 27.251 -17.571 -21.025 1.00 0.00 C ATOM 1594 CD LYS A 128 28.394 -18.525 -20.671 1.00 0.00 C ATOM 1595 CE LYS A 128 28.950 -19.202 -21.926 1.00 0.00 C ATOM 1596 NZ LYS A 128 30.376 -19.549 -21.739 1.00 0.00 N ATOM 0 H LYS A 128 25.134 -15.960 -18.052 1.00 0.00 H new ATOM 0 HA LYS A 128 24.886 -16.292 -20.749 1.00 0.00 H new ATOM 0 HB2 LYS A 128 26.990 -15.999 -19.570 1.00 0.00 H new ATOM 0 HB3 LYS A 128 26.873 -17.614 -18.901 1.00 0.00 H new ATOM 0 HG2 LYS A 128 26.502 -18.098 -21.615 1.00 0.00 H new ATOM 0 HG3 LYS A 128 27.630 -16.757 -21.644 1.00 0.00 H new ATOM 0 HD2 LYS A 128 29.189 -17.975 -20.167 1.00 0.00 H new ATOM 0 HD3 LYS A 128 28.038 -19.282 -19.972 1.00 0.00 H new ATOM 0 HE2 LYS A 128 28.376 -20.102 -22.145 1.00 0.00 H new ATOM 0 HE3 LYS A 128 28.841 -18.538 -22.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 30.737 -20.007 -22.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 30.922 -18.684 -21.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 30.472 -20.200 -20.934 1.00 0.00 H new ATOM 1606 N TYR A 129 24.701 -19.262 -19.348 1.00 0.00 N ATOM 1607 CA TYR A 129 24.164 -20.600 -19.528 1.00 0.00 C ATOM 1608 C TYR A 129 24.559 -21.171 -20.891 1.00 0.00 C ATOM 1609 O TYR A 129 25.140 -20.470 -21.718 1.00 0.00 O ATOM 1610 CB TYR A 129 22.642 -20.453 -19.472 1.00 0.00 C ATOM 1611 CG TYR A 129 21.894 -21.778 -19.311 1.00 0.00 C ATOM 1612 CD1 TYR A 129 22.104 -22.557 -18.190 1.00 0.00 C ATOM 1613 CD2 TYR A 129 21.009 -22.194 -20.284 1.00 0.00 C ATOM 1614 CE1 TYR A 129 21.401 -23.803 -18.038 1.00 0.00 C ATOM 1615 CE2 TYR A 129 20.306 -23.441 -20.132 1.00 0.00 C ATOM 1616 CZ TYR A 129 20.536 -24.183 -19.016 1.00 0.00 C ATOM 1617 OH TYR A 129 19.870 -25.362 -18.873 1.00 0.00 O ATOM 0 H TYR A 129 25.273 -19.141 -18.512 1.00 0.00 H new ATOM 0 HA TYR A 129 24.548 -21.274 -18.763 1.00 0.00 H new ATOM 0 HB2 TYR A 129 22.381 -19.797 -18.641 1.00 0.00 H new ATOM 0 HB3 TYR A 129 22.301 -19.964 -20.384 1.00 0.00 H new ATOM 0 HD1 TYR A 129 22.796 -22.231 -17.428 1.00 0.00 H new ATOM 0 HD2 TYR A 129 20.844 -21.584 -21.160 1.00 0.00 H new ATOM 0 HE1 TYR A 129 21.557 -24.422 -17.167 1.00 0.00 H new ATOM 0 HE2 TYR A 129 19.612 -23.779 -20.887 1.00 0.00 H new ATOM 0 HH TYR A 129 19.286 -25.504 -19.647 1.00 0.00 H new ATOM 1626 N ASP A 130 24.228 -22.440 -21.083 1.00 0.00 N ATOM 1627 CA ASP A 130 24.541 -23.115 -22.332 1.00 0.00 C ATOM 1628 C ASP A 130 23.499 -24.202 -22.594 1.00 0.00 C ATOM 1629 O ASP A 130 22.698 -24.524 -21.718 1.00 0.00 O ATOM 1630 CB ASP A 130 25.916 -23.782 -22.268 1.00 0.00 C ATOM 1631 CG ASP A 130 26.410 -24.374 -23.588 1.00 0.00 C ATOM 1632 OD1 ASP A 130 26.761 -23.567 -24.476 1.00 0.00 O ATOM 1633 OD2 ASP A 130 26.424 -25.621 -23.681 1.00 0.00 O ATOM 0 H ASP A 130 23.746 -23.018 -20.395 1.00 0.00 H new ATOM 0 HA ASP A 130 24.539 -22.370 -23.128 1.00 0.00 H new ATOM 0 HB2 ASP A 130 26.643 -23.048 -21.922 1.00 0.00 H new ATOM 0 HB3 ASP A 130 25.884 -24.575 -21.521 1.00 0.00 H new ATOM 1637 N LEU A 131 23.542 -24.740 -23.805 1.00 0.00 N ATOM 1638 CA LEU A 131 22.612 -25.786 -24.193 1.00 0.00 C ATOM 1639 C LEU A 131 23.387 -27.075 -24.471 1.00 0.00 C ATOM 1640 O LEU A 131 24.600 -27.129 -24.273 1.00 0.00 O ATOM 1641 CB LEU A 131 21.746 -25.324 -25.368 1.00 0.00 C ATOM 1642 CG LEU A 131 20.269 -25.079 -25.055 1.00 0.00 C ATOM 1643 CD1 LEU A 131 19.565 -26.382 -24.675 1.00 0.00 C ATOM 1644 CD2 LEU A 131 20.106 -24.004 -23.979 1.00 0.00 C ATOM 0 H LEU A 131 24.207 -24.470 -24.530 1.00 0.00 H new ATOM 0 HA LEU A 131 21.919 -26.000 -23.380 1.00 0.00 H new ATOM 0 HB2 LEU A 131 22.170 -24.403 -25.767 1.00 0.00 H new ATOM 0 HB3 LEU A 131 21.811 -26.072 -26.158 1.00 0.00 H new ATOM 0 HG LEU A 131 19.787 -24.705 -25.958 1.00 0.00 H new ATOM 0 HD11 LEU A 131 18.516 -26.179 -24.457 1.00 0.00 H new ATOM 0 HD12 LEU A 131 19.634 -27.088 -25.503 1.00 0.00 H new ATOM 0 HD13 LEU A 131 20.042 -26.810 -23.793 1.00 0.00 H new ATOM 0 HD21 LEU A 131 19.046 -23.850 -23.776 1.00 0.00 H new ATOM 0 HD22 LEU A 131 20.607 -24.324 -23.066 1.00 0.00 H new ATOM 0 HD23 LEU A 131 20.548 -23.071 -24.327 1.00 0.00 H new ATOM 1655 N HIS A 132 22.655 -28.082 -24.925 1.00 0.00 N ATOM 1656 CA HIS A 132 23.259 -29.368 -25.232 1.00 0.00 C ATOM 1657 C HIS A 132 22.300 -30.193 -26.091 1.00 0.00 C ATOM 1658 O HIS A 132 21.084 -30.093 -25.941 1.00 0.00 O ATOM 1659 CB HIS A 132 23.678 -30.091 -23.950 1.00 0.00 C ATOM 1660 CG HIS A 132 22.651 -31.069 -23.432 1.00 0.00 C ATOM 1661 ND1 HIS A 132 21.650 -30.706 -22.548 1.00 0.00 N ATOM 1662 CD2 HIS A 132 22.480 -32.398 -23.684 1.00 0.00 C ATOM 1663 CE1 HIS A 132 20.916 -31.778 -22.286 1.00 0.00 C ATOM 1664 NE2 HIS A 132 21.432 -32.825 -22.990 1.00 0.00 N ATOM 0 H HIS A 132 21.649 -28.034 -25.088 1.00 0.00 H new ATOM 0 HA HIS A 132 24.171 -29.217 -25.810 1.00 0.00 H new ATOM 0 HB2 HIS A 132 24.611 -30.623 -24.134 1.00 0.00 H new ATOM 0 HB3 HIS A 132 23.881 -29.350 -23.177 1.00 0.00 H new ATOM 0 HD2 HIS A 132 23.093 -33.001 -24.337 1.00 0.00 H new ATOM 0 HE1 HIS A 132 20.059 -31.815 -21.630 1.00 0.00 H new ATOM 0 HE2 HIS A 132 21.072 -33.779 -22.984 1.00 0.00 H new ATOM 1672 N TYR A 133 22.884 -30.991 -26.974 1.00 0.00 N ATOM 1673 CA TYR A 133 22.096 -31.834 -27.857 1.00 0.00 C ATOM 1674 C TYR A 133 21.097 -32.678 -27.063 1.00 0.00 C ATOM 1675 O TYR A 133 21.478 -33.381 -26.128 1.00 0.00 O ATOM 1676 CB TYR A 133 23.093 -32.763 -28.552 1.00 0.00 C ATOM 1677 CG TYR A 133 22.439 -33.812 -29.454 1.00 0.00 C ATOM 1678 CD1 TYR A 133 21.798 -33.422 -30.613 1.00 0.00 C ATOM 1679 CD2 TYR A 133 22.492 -35.147 -29.111 1.00 0.00 C ATOM 1680 CE1 TYR A 133 21.183 -34.409 -31.463 1.00 0.00 C ATOM 1681 CE2 TYR A 133 21.877 -36.134 -29.961 1.00 0.00 C ATOM 1682 CZ TYR A 133 21.254 -35.716 -31.095 1.00 0.00 C ATOM 1683 OH TYR A 133 20.673 -36.649 -31.896 1.00 0.00 O ATOM 0 H TYR A 133 23.893 -31.071 -27.096 1.00 0.00 H new ATOM 0 HA TYR A 133 21.528 -31.227 -28.562 1.00 0.00 H new ATOM 0 HB2 TYR A 133 23.779 -32.162 -29.149 1.00 0.00 H new ATOM 0 HB3 TYR A 133 23.690 -33.271 -27.795 1.00 0.00 H new ATOM 0 HD1 TYR A 133 21.758 -32.377 -30.882 1.00 0.00 H new ATOM 0 HD2 TYR A 133 22.995 -35.452 -28.205 1.00 0.00 H new ATOM 0 HE1 TYR A 133 20.677 -34.118 -32.372 1.00 0.00 H new ATOM 0 HE2 TYR A 133 21.910 -37.182 -29.703 1.00 0.00 H new ATOM 0 HH TYR A 133 20.804 -37.540 -31.509 1.00 0.00 H new TER 1692 TYR A 133