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= -0.134! C(o=0.78!,f=-12!) USER MOD Set 1.2: A 100 TYR OH : rot -84:sc= 0.916 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 18 MET CE :methyl -146:sc= 0 (180deg=-0.00666) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= -0.172 K(o=-0.17,f=-2.2!) USER MOD Single : A 30 HIS : no HD1:sc= -0.581 K(o=-0.58,f=-0.0085) USER MOD Single : A 31 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0.00108 USER MOD Single : A 39 THR OG1 : rot -64:sc= 0.945 USER MOD Single : A 43 GLN : amide:sc= -4.72! K(o=-4.7!,f=-1.1) USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HE2:sc= -1.19 K(o=-1.2,f=-5.2!) USER MOD Single : A 48 THR OG1 : rot 180:sc= -0.242 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 ASN : amide:sc= -0.21 K(o=-0.21,f=-1.5!) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 150:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= -1.13 USER MOD Single : A 59 TYR OH : rot 180:sc= -0.056 USER MOD Single : A 61 ASN : amide:sc= -1.49 K(o=-1.5,f=-2.3) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0.273 USER MOD Single : A 63 THR OG1 : rot 24:sc= 0.0449 USER MOD Single : A 66 GLN : amide:sc= -0.212 K(o=-0.21,f=-1.9!) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 GLN : amide:sc= -3.3! C(o=-3.3!,f=-5!) USER MOD Single : A 74 SER OG : rot 160:sc= -0.399 USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= -4.77! K(o=-4.8!,f=-0.86) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 ASN : amide:sc= -4.61! K(o=-4.6!,f=-0.85) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 THR OG1 : rot -157:sc= 1.28 USER MOD Single : A 106 ASN : amide:sc= -0.669 K(o=-0.67,f=-0.13) USER MOD Single : A 108 THR OG1 : rot 180:sc= -0.732 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 114 ASN : amide:sc= -3.55! C(o=-3.5!,f=-4.1!) USER MOD Single : A 115 TYR OH : rot 180:sc= -1.61 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 HIS : no HD1:sc= -8.1! C(o=-8.1!,f=-6.4!) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 GLN : amide:sc= 0 X(o=0,f=-0.26) 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 X(o=0,f=-0.013) USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 15 30.541 50.017 -22.886 1.00 0.00 N ATOM 2 CA GLY A 15 30.753 50.901 -21.753 1.00 0.00 C ATOM 3 C GLY A 15 29.505 51.740 -21.470 1.00 0.00 C ATOM 4 O GLY A 15 29.279 52.760 -22.117 1.00 0.00 O ATOM 0 HA2 GLY A 15 31.008 50.313 -20.871 1.00 0.00 H new ATOM 0 HA3 GLY A 15 31.599 51.558 -21.953 1.00 0.00 H new ATOM 8 N SER A 16 28.727 51.276 -20.503 1.00 0.00 N ATOM 9 CA SER A 16 27.507 51.970 -20.126 1.00 0.00 C ATOM 10 C SER A 16 26.470 51.851 -21.245 1.00 0.00 C ATOM 11 O SER A 16 26.815 51.908 -22.424 1.00 0.00 O ATOM 12 CB SER A 16 27.784 53.442 -19.815 1.00 0.00 C ATOM 13 OG SER A 16 27.693 53.719 -18.420 1.00 0.00 O ATOM 0 H SER A 16 28.918 50.428 -19.969 1.00 0.00 H new ATOM 0 HA SER A 16 27.114 51.503 -19.223 1.00 0.00 H new ATOM 0 HB2 SER A 16 28.779 53.707 -20.173 1.00 0.00 H new ATOM 0 HB3 SER A 16 27.073 54.067 -20.356 1.00 0.00 H new ATOM 0 HG SER A 16 27.878 54.668 -18.262 1.00 0.00 H new ATOM 18 N GLY A 17 25.221 51.686 -20.836 1.00 0.00 N ATOM 19 CA GLY A 17 24.132 51.559 -21.789 1.00 0.00 C ATOM 20 C GLY A 17 22.896 52.326 -21.316 1.00 0.00 C ATOM 21 O GLY A 17 22.991 53.496 -20.945 1.00 0.00 O ATOM 0 H GLY A 17 24.939 51.637 -19.857 1.00 0.00 H new ATOM 0 HA2 GLY A 17 24.449 51.937 -22.761 1.00 0.00 H new ATOM 0 HA3 GLY A 17 23.882 50.506 -21.923 1.00 0.00 H new ATOM 25 N MET A 18 21.764 51.638 -21.345 1.00 0.00 N ATOM 26 CA MET A 18 20.510 52.241 -20.924 1.00 0.00 C ATOM 27 C MET A 18 19.702 51.275 -20.055 1.00 0.00 C ATOM 28 O MET A 18 20.067 50.107 -19.914 1.00 0.00 O ATOM 29 CB MET A 18 19.690 52.628 -22.156 1.00 0.00 C ATOM 30 CG MET A 18 19.292 51.389 -22.961 1.00 0.00 C ATOM 31 SD MET A 18 19.856 51.549 -24.647 1.00 0.00 S ATOM 32 CE MET A 18 18.717 52.790 -25.239 1.00 0.00 C ATOM 0 H MET A 18 21.689 50.669 -21.653 1.00 0.00 H new ATOM 0 HA MET A 18 20.736 53.129 -20.334 1.00 0.00 H new ATOM 0 HB2 MET A 18 18.795 53.168 -21.847 1.00 0.00 H new ATOM 0 HB3 MET A 18 20.269 53.304 -22.785 1.00 0.00 H new ATOM 0 HG2 MET A 18 19.724 50.497 -22.508 1.00 0.00 H new ATOM 0 HG3 MET A 18 18.209 51.265 -22.941 1.00 0.00 H new ATOM 0 HE1 MET A 18 18.488 52.603 -26.288 1.00 0.00 H new ATOM 0 HE2 MET A 18 17.798 52.749 -24.654 1.00 0.00 H new ATOM 0 HE3 MET A 18 19.168 53.777 -25.136 1.00 0.00 H new ATOM 40 N LYS A 19 18.620 51.796 -19.496 1.00 0.00 N ATOM 41 CA LYS A 19 17.757 50.994 -18.646 1.00 0.00 C ATOM 42 C LYS A 19 16.296 51.304 -18.973 1.00 0.00 C ATOM 43 O LYS A 19 16.009 52.191 -19.776 1.00 0.00 O ATOM 44 CB LYS A 19 18.116 51.200 -17.173 1.00 0.00 C ATOM 45 CG LYS A 19 18.190 49.863 -16.434 1.00 0.00 C ATOM 46 CD LYS A 19 18.696 50.054 -15.003 1.00 0.00 C ATOM 47 CE LYS A 19 17.714 49.461 -13.990 1.00 0.00 C ATOM 48 NZ LYS A 19 18.431 48.625 -13.001 1.00 0.00 N ATOM 0 H LYS A 19 18.321 52.764 -19.615 1.00 0.00 H new ATOM 0 HA LYS A 19 17.908 49.932 -18.841 1.00 0.00 H new ATOM 0 HB2 LYS A 19 19.074 51.715 -17.097 1.00 0.00 H new ATOM 0 HB3 LYS A 19 17.372 51.840 -16.700 1.00 0.00 H new ATOM 0 HG2 LYS A 19 17.204 49.399 -16.416 1.00 0.00 H new ATOM 0 HG3 LYS A 19 18.853 49.183 -16.970 1.00 0.00 H new ATOM 0 HD2 LYS A 19 19.670 49.578 -14.892 1.00 0.00 H new ATOM 0 HD3 LYS A 19 18.835 51.116 -14.801 1.00 0.00 H new ATOM 0 HE2 LYS A 19 17.181 50.263 -13.479 1.00 0.00 H new ATOM 0 HE3 LYS A 19 16.966 48.861 -14.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 17.750 48.230 -12.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 18.920 47.849 -13.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 19.128 49.207 -12.494 1.00 0.00 H new ATOM 58 N GLU A 20 15.407 50.558 -18.333 1.00 0.00 N ATOM 59 CA GLU A 20 13.982 50.742 -18.545 1.00 0.00 C ATOM 60 C GLU A 20 13.220 50.543 -17.234 1.00 0.00 C ATOM 61 O GLU A 20 13.804 50.148 -16.227 1.00 0.00 O ATOM 62 CB GLU A 20 13.463 49.797 -19.631 1.00 0.00 C ATOM 63 CG GLU A 20 12.554 50.538 -20.614 1.00 0.00 C ATOM 64 CD GLU A 20 13.372 51.426 -21.553 1.00 0.00 C ATOM 65 OE1 GLU A 20 14.349 50.897 -22.128 1.00 0.00 O ATOM 66 OE2 GLU A 20 13.002 52.614 -21.676 1.00 0.00 O ATOM 0 H GLU A 20 15.647 49.824 -17.667 1.00 0.00 H new ATOM 0 HA GLU A 20 13.814 51.763 -18.888 1.00 0.00 H new ATOM 0 HB2 GLU A 20 14.304 49.358 -20.168 1.00 0.00 H new ATOM 0 HB3 GLU A 20 12.914 48.975 -19.171 1.00 0.00 H new ATOM 0 HG2 GLU A 20 11.979 49.818 -21.197 1.00 0.00 H new ATOM 0 HG3 GLU A 20 11.837 51.147 -20.064 1.00 0.00 H new ATOM 71 N THR A 21 11.926 50.827 -17.290 1.00 0.00 N ATOM 72 CA THR A 21 11.078 50.684 -16.119 1.00 0.00 C ATOM 73 C THR A 21 10.037 49.586 -16.345 1.00 0.00 C ATOM 74 O THR A 21 9.119 49.751 -17.147 1.00 0.00 O ATOM 75 CB THR A 21 10.463 52.050 -15.810 1.00 0.00 C ATOM 76 OG1 THR A 21 9.889 51.888 -14.516 1.00 0.00 O ATOM 77 CG2 THR A 21 9.268 52.371 -16.711 1.00 0.00 C ATOM 0 H THR A 21 11.445 51.155 -18.128 1.00 0.00 H new ATOM 0 HA THR A 21 11.655 50.368 -15.250 1.00 0.00 H new ATOM 0 HB THR A 21 11.222 52.824 -15.924 1.00 0.00 H new ATOM 0 HG1 THR A 21 9.469 52.728 -14.237 1.00 0.00 H new ATOM 0 HG21 THR A 21 8.869 53.351 -16.450 1.00 0.00 H new ATOM 0 HG22 THR A 21 9.589 52.375 -17.753 1.00 0.00 H new ATOM 0 HG23 THR A 21 8.495 51.616 -16.572 1.00 0.00 H new ATOM 85 N ALA A 22 10.214 48.488 -15.625 1.00 0.00 N ATOM 86 CA ALA A 22 9.302 47.363 -15.737 1.00 0.00 C ATOM 87 C ALA A 22 7.863 47.883 -15.784 1.00 0.00 C ATOM 88 O ALA A 22 7.228 47.869 -16.837 1.00 0.00 O ATOM 89 CB ALA A 22 9.535 46.397 -14.574 1.00 0.00 C ATOM 0 H ALA A 22 10.977 48.354 -14.961 1.00 0.00 H new ATOM 0 HA ALA A 22 9.485 46.811 -16.659 1.00 0.00 H new ATOM 0 HB1 ALA A 22 8.850 45.553 -14.659 1.00 0.00 H new ATOM 0 HB2 ALA A 22 10.563 46.035 -14.602 1.00 0.00 H new ATOM 0 HB3 ALA A 22 9.358 46.914 -13.631 1.00 0.00 H new ATOM 95 N ALA A 23 7.390 48.327 -14.629 1.00 0.00 N ATOM 96 CA ALA A 23 6.038 48.850 -14.525 1.00 0.00 C ATOM 97 C ALA A 23 5.038 47.716 -14.761 1.00 0.00 C ATOM 98 O ALA A 23 5.431 46.591 -15.068 1.00 0.00 O ATOM 99 CB ALA A 23 5.859 50.002 -15.516 1.00 0.00 C ATOM 0 H ALA A 23 7.919 48.335 -13.757 1.00 0.00 H new ATOM 0 HA ALA A 23 5.855 49.248 -13.527 1.00 0.00 H new ATOM 0 HB1 ALA A 23 4.845 50.395 -15.438 1.00 0.00 H new ATOM 0 HB2 ALA A 23 6.573 50.793 -15.287 1.00 0.00 H new ATOM 0 HB3 ALA A 23 6.031 49.640 -16.530 1.00 0.00 H new ATOM 105 N ALA A 24 3.766 48.050 -14.609 1.00 0.00 N ATOM 106 CA ALA A 24 2.707 47.075 -14.801 1.00 0.00 C ATOM 107 C ALA A 24 2.737 46.062 -13.654 1.00 0.00 C ATOM 108 O ALA A 24 3.806 45.599 -13.259 1.00 0.00 O ATOM 109 CB ALA A 24 2.867 46.411 -16.169 1.00 0.00 C ATOM 0 H ALA A 24 3.444 48.984 -14.355 1.00 0.00 H new ATOM 0 HA ALA A 24 1.731 47.561 -14.786 1.00 0.00 H new ATOM 0 HB1 ALA A 24 2.072 45.679 -16.313 1.00 0.00 H new ATOM 0 HB2 ALA A 24 2.809 47.169 -16.950 1.00 0.00 H new ATOM 0 HB3 ALA A 24 3.834 45.911 -16.220 1.00 0.00 H new ATOM 115 N LYS A 25 1.552 45.749 -13.152 1.00 0.00 N ATOM 116 CA LYS A 25 1.429 44.800 -12.059 1.00 0.00 C ATOM 117 C LYS A 25 -0.049 44.471 -11.837 1.00 0.00 C ATOM 118 O LYS A 25 -0.847 45.358 -11.537 1.00 0.00 O ATOM 119 CB LYS A 25 2.136 45.328 -10.809 1.00 0.00 C ATOM 120 CG LYS A 25 1.415 46.557 -10.251 1.00 0.00 C ATOM 121 CD LYS A 25 2.167 47.134 -9.049 1.00 0.00 C ATOM 122 CE LYS A 25 2.974 48.370 -9.448 1.00 0.00 C ATOM 123 NZ LYS A 25 4.409 48.032 -9.582 1.00 0.00 N ATOM 0 H LYS A 25 0.668 46.136 -13.482 1.00 0.00 H new ATOM 0 HA LYS A 25 1.929 43.865 -12.309 1.00 0.00 H new ATOM 0 HB2 LYS A 25 2.172 44.547 -10.050 1.00 0.00 H new ATOM 0 HB3 LYS A 25 3.167 45.585 -11.051 1.00 0.00 H new ATOM 0 HG2 LYS A 25 1.327 47.316 -11.028 1.00 0.00 H new ATOM 0 HG3 LYS A 25 0.402 46.286 -9.955 1.00 0.00 H new ATOM 0 HD2 LYS A 25 1.458 47.396 -8.264 1.00 0.00 H new ATOM 0 HD3 LYS A 25 2.834 46.378 -8.636 1.00 0.00 H new ATOM 0 HE2 LYS A 25 2.599 48.768 -10.391 1.00 0.00 H new ATOM 0 HE3 LYS A 25 2.847 49.152 -8.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 4.942 48.883 -9.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 4.768 47.674 -8.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 4.527 47.302 -10.313 1.00 0.00 H new ATOM 133 N PHE A 26 -0.368 43.195 -11.994 1.00 0.00 N ATOM 134 CA PHE A 26 -1.736 42.738 -11.815 1.00 0.00 C ATOM 135 C PHE A 26 -1.815 41.211 -11.862 1.00 0.00 C ATOM 136 O PHE A 26 -0.806 40.540 -12.077 1.00 0.00 O ATOM 137 CB PHE A 26 -2.555 43.316 -12.971 1.00 0.00 C ATOM 138 CG PHE A 26 -3.614 44.330 -12.536 1.00 0.00 C ATOM 139 CD1 PHE A 26 -4.789 43.901 -12.003 1.00 0.00 C ATOM 140 CD2 PHE A 26 -3.381 45.663 -12.685 1.00 0.00 C ATOM 141 CE1 PHE A 26 -5.772 44.843 -11.600 1.00 0.00 C ATOM 142 CE2 PHE A 26 -4.365 46.604 -12.282 1.00 0.00 C ATOM 143 CZ PHE A 26 -5.540 46.175 -11.748 1.00 0.00 C ATOM 0 H PHE A 26 0.297 42.463 -12.243 1.00 0.00 H new ATOM 0 HA PHE A 26 -2.114 43.064 -10.846 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -1.878 43.794 -13.679 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -3.045 42.499 -13.500 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -4.975 42.844 -11.886 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -2.448 46.004 -13.109 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -6.705 44.502 -11.176 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -4.180 47.662 -12.400 1.00 0.00 H new ATOM 0 HZ PHE A 26 -6.288 46.891 -11.442 1.00 0.00 H new ATOM 152 N GLU A 27 -3.022 40.706 -11.658 1.00 0.00 N ATOM 153 CA GLU A 27 -3.246 39.271 -11.675 1.00 0.00 C ATOM 154 C GLU A 27 -2.472 38.600 -10.538 1.00 0.00 C ATOM 155 O GLU A 27 -1.313 38.929 -10.292 1.00 0.00 O ATOM 156 CB GLU A 27 -2.861 38.672 -13.028 1.00 0.00 C ATOM 157 CG GLU A 27 -3.999 38.825 -14.039 1.00 0.00 C ATOM 158 CD GLU A 27 -3.551 38.399 -15.438 1.00 0.00 C ATOM 159 OE1 GLU A 27 -2.821 37.387 -15.517 1.00 0.00 O ATOM 160 OE2 GLU A 27 -3.949 39.094 -16.398 1.00 0.00 O ATOM 0 H GLU A 27 -3.856 41.266 -11.480 1.00 0.00 H new ATOM 0 HA GLU A 27 -4.310 39.087 -11.523 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -1.965 39.165 -13.406 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -2.617 37.617 -12.906 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -4.851 38.221 -13.727 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -4.334 39.862 -14.061 1.00 0.00 H new ATOM 165 N ARG A 28 -3.145 37.671 -9.875 1.00 0.00 N ATOM 166 CA ARG A 28 -2.534 36.950 -8.771 1.00 0.00 C ATOM 167 C ARG A 28 -2.368 35.471 -9.128 1.00 0.00 C ATOM 168 O ARG A 28 -2.786 35.038 -10.201 1.00 0.00 O ATOM 169 CB ARG A 28 -3.379 37.069 -7.501 1.00 0.00 C ATOM 170 CG ARG A 28 -2.506 36.977 -6.249 1.00 0.00 C ATOM 171 CD ARG A 28 -2.847 38.091 -5.258 1.00 0.00 C ATOM 172 NE ARG A 28 -1.779 38.210 -4.241 1.00 0.00 N ATOM 173 CZ ARG A 28 -0.611 38.833 -4.447 1.00 0.00 C ATOM 174 NH1 ARG A 28 -0.354 39.398 -5.635 1.00 0.00 N ATOM 175 NH2 ARG A 28 0.299 38.893 -3.466 1.00 0.00 N ATOM 0 H ARG A 28 -4.107 37.401 -10.081 1.00 0.00 H new ATOM 0 HA ARG A 28 -1.556 37.394 -8.587 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -3.916 38.018 -7.505 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -4.129 36.278 -7.484 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -2.648 36.007 -5.773 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -1.455 37.044 -6.529 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -2.963 39.037 -5.787 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -3.800 37.878 -4.773 1.00 0.00 H new ATOM 0 HE ARG A 28 -1.942 37.791 -3.325 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -1.048 39.354 -6.382 1.00 0.00 H new ATOM 0 HH12 ARG A 28 0.535 39.872 -5.792 1.00 0.00 H new ATOM 0 HH21 ARG A 28 0.103 38.464 -2.562 1.00 0.00 H new ATOM 0 HH22 ARG A 28 1.188 39.367 -3.623 1.00 0.00 H new ATOM 186 N GLN A 29 -1.756 34.739 -8.210 1.00 0.00 N ATOM 187 CA GLN A 29 -1.529 33.319 -8.415 1.00 0.00 C ATOM 188 C GLN A 29 -2.591 32.499 -7.679 1.00 0.00 C ATOM 189 O GLN A 29 -3.314 31.718 -8.295 1.00 0.00 O ATOM 190 CB GLN A 29 -0.122 32.918 -7.968 1.00 0.00 C ATOM 191 CG GLN A 29 0.588 32.107 -9.053 1.00 0.00 C ATOM 192 CD GLN A 29 1.464 33.008 -9.926 1.00 0.00 C ATOM 193 OE1 GLN A 29 1.547 34.210 -9.735 1.00 0.00 O ATOM 194 NE2 GLN A 29 2.111 32.362 -10.892 1.00 0.00 N ATOM 0 H GLN A 29 -1.410 35.102 -7.322 1.00 0.00 H new ATOM 0 HA GLN A 29 -1.610 33.109 -9.482 1.00 0.00 H new ATOM 0 HB2 GLN A 29 0.459 33.811 -7.738 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -0.181 32.332 -7.051 1.00 0.00 H new ATOM 0 HG2 GLN A 29 1.202 31.334 -8.591 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -0.150 31.599 -9.674 1.00 0.00 H new ATOM 0 HE21 GLN A 29 1.997 31.354 -10.996 1.00 0.00 H new ATOM 0 HE22 GLN A 29 2.721 32.875 -11.528 1.00 0.00 H new ATOM 201 N HIS A 30 -2.653 32.708 -6.372 1.00 0.00 N ATOM 202 CA HIS A 30 -3.615 31.998 -5.545 1.00 0.00 C ATOM 203 C HIS A 30 -3.384 30.490 -5.668 1.00 0.00 C ATOM 204 O HIS A 30 -2.827 30.023 -6.660 1.00 0.00 O ATOM 205 CB HIS A 30 -5.045 32.410 -5.902 1.00 0.00 C ATOM 206 CG HIS A 30 -6.044 32.184 -4.792 1.00 0.00 C ATOM 207 ND1 HIS A 30 -6.573 33.217 -4.038 1.00 0.00 N ATOM 208 CD2 HIS A 30 -6.605 31.034 -4.319 1.00 0.00 C ATOM 209 CE1 HIS A 30 -7.412 32.700 -3.152 1.00 0.00 C ATOM 210 NE2 HIS A 30 -7.430 31.348 -3.327 1.00 0.00 N ATOM 0 H HIS A 30 -2.053 33.359 -5.865 1.00 0.00 H new ATOM 0 HA HIS A 30 -3.471 32.268 -4.499 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -5.051 33.466 -6.173 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -5.364 31.853 -6.783 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -6.411 30.038 -4.688 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -7.982 33.253 -2.420 1.00 0.00 H new ATOM 0 HE2 HIS A 30 -7.986 30.686 -2.785 1.00 0.00 H new ATOM 217 N MET A 31 -3.825 29.772 -4.646 1.00 0.00 N ATOM 218 CA MET A 31 -3.673 28.327 -4.627 1.00 0.00 C ATOM 219 C MET A 31 -4.362 27.720 -3.403 1.00 0.00 C ATOM 220 O MET A 31 -5.076 26.724 -3.519 1.00 0.00 O ATOM 221 CB MET A 31 -2.186 27.969 -4.605 1.00 0.00 C ATOM 222 CG MET A 31 -1.757 27.324 -5.924 1.00 0.00 C ATOM 223 SD MET A 31 -0.415 26.182 -5.637 1.00 0.00 S ATOM 224 CE MET A 31 0.899 27.023 -6.503 1.00 0.00 C ATOM 0 H MET A 31 -4.287 30.163 -3.825 1.00 0.00 H new ATOM 0 HA MET A 31 -4.140 27.920 -5.524 1.00 0.00 H new ATOM 0 HB2 MET A 31 -1.595 28.867 -4.426 1.00 0.00 H new ATOM 0 HB3 MET A 31 -1.985 27.286 -3.780 1.00 0.00 H new ATOM 0 HG2 MET A 31 -2.601 26.801 -6.374 1.00 0.00 H new ATOM 0 HG3 MET A 31 -1.446 28.094 -6.630 1.00 0.00 H new ATOM 0 HE1 MET A 31 1.818 26.441 -6.424 1.00 0.00 H new ATOM 0 HE2 MET A 31 0.630 27.134 -7.553 1.00 0.00 H new ATOM 0 HE3 MET A 31 1.054 28.008 -6.062 1.00 0.00 H new ATOM 232 N ASP A 32 -4.125 28.344 -2.259 1.00 0.00 N ATOM 233 CA ASP A 32 -4.714 27.877 -1.016 1.00 0.00 C ATOM 234 C ASP A 32 -4.320 26.417 -0.785 1.00 0.00 C ATOM 235 O ASP A 32 -3.824 25.754 -1.694 1.00 0.00 O ATOM 236 CB ASP A 32 -6.241 27.951 -1.069 1.00 0.00 C ATOM 237 CG ASP A 32 -6.965 27.202 0.053 1.00 0.00 C ATOM 238 OD1 ASP A 32 -6.990 27.750 1.176 1.00 0.00 O ATOM 239 OD2 ASP A 32 -7.474 26.099 -0.238 1.00 0.00 O ATOM 0 H ASP A 32 -3.533 29.169 -2.167 1.00 0.00 H new ATOM 0 HA ASP A 32 -4.349 28.514 -0.210 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -6.540 28.999 -1.038 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -6.576 27.552 -2.027 1.00 0.00 H new ATOM 243 N SER A 33 -4.554 25.959 0.435 1.00 0.00 N ATOM 244 CA SER A 33 -4.229 24.591 0.797 1.00 0.00 C ATOM 245 C SER A 33 -5.468 23.887 1.352 1.00 0.00 C ATOM 246 O SER A 33 -6.219 24.468 2.133 1.00 0.00 O ATOM 247 CB SER A 33 -3.092 24.546 1.819 1.00 0.00 C ATOM 248 OG SER A 33 -2.390 25.785 1.892 1.00 0.00 O ATOM 0 H SER A 33 -4.966 26.512 1.187 1.00 0.00 H new ATOM 0 HA SER A 33 -3.895 24.071 -0.101 1.00 0.00 H new ATOM 0 HB2 SER A 33 -3.497 24.300 2.801 1.00 0.00 H new ATOM 0 HB3 SER A 33 -2.396 23.750 1.553 1.00 0.00 H new ATOM 0 HG SER A 33 -1.673 25.716 2.557 1.00 0.00 H new ATOM 253 N PRO A 34 -5.651 22.612 0.915 1.00 0.00 N ATOM 254 CA PRO A 34 -6.787 21.823 1.359 1.00 0.00 C ATOM 255 C PRO A 34 -6.589 21.338 2.797 1.00 0.00 C ATOM 256 O PRO A 34 -5.506 21.485 3.361 1.00 0.00 O ATOM 257 CB PRO A 34 -6.891 20.685 0.357 1.00 0.00 C ATOM 258 CG PRO A 34 -5.540 20.614 -0.335 1.00 0.00 C ATOM 259 CD PRO A 34 -4.782 21.891 -0.012 1.00 0.00 C ATOM 0 HA PRO A 34 -7.713 22.397 1.387 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -7.124 19.745 0.857 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -7.689 20.870 -0.362 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -4.982 19.742 0.006 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -5.668 20.509 -1.412 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -3.814 21.674 0.440 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -4.590 22.476 -0.911 1.00 0.00 H new ATOM 264 N ASP A 35 -7.652 20.770 3.348 1.00 0.00 N ATOM 265 CA ASP A 35 -7.609 20.263 4.708 1.00 0.00 C ATOM 266 C ASP A 35 -8.945 20.549 5.397 1.00 0.00 C ATOM 267 O ASP A 35 -10.000 20.466 4.771 1.00 0.00 O ATOM 268 CB ASP A 35 -6.504 20.947 5.516 1.00 0.00 C ATOM 269 CG ASP A 35 -6.594 22.474 5.572 1.00 0.00 C ATOM 270 OD1 ASP A 35 -7.657 22.994 5.167 1.00 0.00 O ATOM 271 OD2 ASP A 35 -5.600 23.085 6.017 1.00 0.00 O ATOM 0 H ASP A 35 -8.548 20.650 2.876 1.00 0.00 H new ATOM 0 HA ASP A 35 -7.412 19.192 4.663 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -6.526 20.559 6.534 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -5.539 20.670 5.091 1.00 0.00 H new ATOM 275 N LEU A 36 -8.855 20.878 6.677 1.00 0.00 N ATOM 276 CA LEU A 36 -10.043 21.176 7.458 1.00 0.00 C ATOM 277 C LEU A 36 -11.075 20.065 7.252 1.00 0.00 C ATOM 278 O LEU A 36 -11.985 20.201 6.436 1.00 0.00 O ATOM 279 CB LEU A 36 -10.569 22.574 7.122 1.00 0.00 C ATOM 280 CG LEU A 36 -10.748 23.526 8.306 1.00 0.00 C ATOM 281 CD1 LEU A 36 -10.438 24.968 7.901 1.00 0.00 C ATOM 282 CD2 LEU A 36 -12.146 23.389 8.913 1.00 0.00 C ATOM 0 H LEU A 36 -7.978 20.945 7.193 1.00 0.00 H new ATOM 0 HA LEU A 36 -9.804 21.197 8.521 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -9.885 23.036 6.410 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -11.530 22.468 6.618 1.00 0.00 H new ATOM 0 HG LEU A 36 -10.032 23.248 9.080 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -10.573 25.624 8.761 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -9.408 25.034 7.552 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -11.112 25.274 7.101 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -12.247 24.077 9.753 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -12.895 23.626 8.158 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -12.293 22.367 9.261 1.00 0.00 H new ATOM 293 N GLY A 37 -10.899 18.991 8.007 1.00 0.00 N ATOM 294 CA GLY A 37 -11.803 17.858 7.919 1.00 0.00 C ATOM 295 C GLY A 37 -11.217 16.632 8.624 1.00 0.00 C ATOM 296 O GLY A 37 -10.108 16.687 9.152 1.00 0.00 O ATOM 0 H GLY A 37 -10.143 18.882 8.683 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -12.761 18.117 8.369 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -11.996 17.622 6.872 1.00 0.00 H new ATOM 300 N THR A 38 -11.990 15.556 8.608 1.00 0.00 N ATOM 301 CA THR A 38 -11.562 14.318 9.240 1.00 0.00 C ATOM 302 C THR A 38 -10.268 13.813 8.598 1.00 0.00 C ATOM 303 O THR A 38 -9.259 14.516 8.588 1.00 0.00 O ATOM 304 CB THR A 38 -12.715 13.318 9.151 1.00 0.00 C ATOM 305 OG1 THR A 38 -13.810 13.995 9.763 1.00 0.00 O ATOM 306 CG2 THR A 38 -12.495 12.090 10.037 1.00 0.00 C ATOM 0 H THR A 38 -12.909 15.515 8.168 1.00 0.00 H new ATOM 0 HA THR A 38 -11.328 14.471 10.293 1.00 0.00 H new ATOM 0 HB THR A 38 -12.841 13.001 8.116 1.00 0.00 H new ATOM 0 HG1 THR A 38 -14.602 13.418 9.747 1.00 0.00 H new ATOM 0 HG21 THR A 38 -13.343 11.412 9.936 1.00 0.00 H new ATOM 0 HG22 THR A 38 -11.583 11.578 9.730 1.00 0.00 H new ATOM 0 HG23 THR A 38 -12.402 12.403 11.077 1.00 0.00 H new ATOM 314 N THR A 39 -10.339 12.597 8.077 1.00 0.00 N ATOM 315 CA THR A 39 -9.187 11.988 7.434 1.00 0.00 C ATOM 316 C THR A 39 -9.625 10.819 6.550 1.00 0.00 C ATOM 317 O THR A 39 -9.230 9.677 6.784 1.00 0.00 O ATOM 318 CB THR A 39 -8.195 11.585 8.527 1.00 0.00 C ATOM 319 OG1 THR A 39 -7.211 10.820 7.838 1.00 0.00 O ATOM 320 CG2 THR A 39 -8.797 10.600 9.531 1.00 0.00 C ATOM 0 H THR A 39 -11.178 12.016 8.087 1.00 0.00 H new ATOM 0 HA THR A 39 -8.690 12.691 6.765 1.00 0.00 H new ATOM 0 HB THR A 39 -7.854 12.476 9.053 1.00 0.00 H new ATOM 0 HG1 THR A 39 -7.621 10.005 7.481 1.00 0.00 H new ATOM 0 HG21 THR A 39 -8.051 10.347 10.285 1.00 0.00 H new ATOM 0 HG22 THR A 39 -9.661 11.056 10.014 1.00 0.00 H new ATOM 0 HG23 THR A 39 -9.108 9.694 9.010 1.00 0.00 H new ATOM 328 N LEU A 40 -10.435 11.144 5.553 1.00 0.00 N ATOM 329 CA LEU A 40 -10.930 10.135 4.633 1.00 0.00 C ATOM 330 C LEU A 40 -9.745 9.436 3.962 1.00 0.00 C ATOM 331 O LEU A 40 -8.606 9.578 4.404 1.00 0.00 O ATOM 332 CB LEU A 40 -11.919 10.753 3.642 1.00 0.00 C ATOM 333 CG LEU A 40 -12.694 11.974 4.141 1.00 0.00 C ATOM 334 CD1 LEU A 40 -13.031 11.839 5.628 1.00 0.00 C ATOM 335 CD2 LEU A 40 -11.933 13.267 3.841 1.00 0.00 C ATOM 0 H LEU A 40 -10.761 12.092 5.363 1.00 0.00 H new ATOM 0 HA LEU A 40 -11.489 9.370 5.172 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -11.372 11.037 2.743 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -12.637 9.986 3.350 1.00 0.00 H new ATOM 0 HG LEU A 40 -13.639 12.024 3.600 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -13.582 12.720 5.958 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -13.642 10.950 5.783 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -12.109 11.751 6.203 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -12.506 14.119 4.206 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -10.963 13.242 4.338 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -11.787 13.362 2.765 1.00 0.00 H new ATOM 346 N LEU A 41 -10.054 8.695 2.908 1.00 0.00 N ATOM 347 CA LEU A 41 -9.030 7.974 2.173 1.00 0.00 C ATOM 348 C LEU A 41 -9.088 8.375 0.698 1.00 0.00 C ATOM 349 O LEU A 41 -8.326 7.861 -0.119 1.00 0.00 O ATOM 350 CB LEU A 41 -9.162 6.468 2.407 1.00 0.00 C ATOM 351 CG LEU A 41 -9.409 6.033 3.854 1.00 0.00 C ATOM 352 CD1 LEU A 41 -10.103 4.670 3.905 1.00 0.00 C ATOM 353 CD2 LEU A 41 -8.107 6.045 4.658 1.00 0.00 C ATOM 0 H LEU A 41 -11.000 8.579 2.546 1.00 0.00 H new ATOM 0 HA LEU A 41 -8.039 8.244 2.538 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -9.981 6.095 1.792 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -8.252 5.984 2.053 1.00 0.00 H new ATOM 0 HG LEU A 41 -10.082 6.754 4.319 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -10.267 4.384 4.944 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -11.062 4.730 3.390 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -9.475 3.924 3.418 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -8.309 5.732 5.682 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -7.392 5.359 4.203 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -7.691 7.052 4.662 1.00 0.00 H new ATOM 364 N GLU A 42 -10.002 9.289 0.402 1.00 0.00 N ATOM 365 CA GLU A 42 -10.169 9.764 -0.961 1.00 0.00 C ATOM 366 C GLU A 42 -9.963 11.278 -1.023 1.00 0.00 C ATOM 367 O GLU A 42 -10.233 11.903 -2.048 1.00 0.00 O ATOM 368 CB GLU A 42 -11.543 9.374 -1.512 1.00 0.00 C ATOM 369 CG GLU A 42 -11.424 8.809 -2.930 1.00 0.00 C ATOM 370 CD GLU A 42 -12.214 7.505 -3.068 1.00 0.00 C ATOM 371 OE1 GLU A 42 -13.417 7.534 -2.735 1.00 0.00 O ATOM 372 OE2 GLU A 42 -11.595 6.511 -3.504 1.00 0.00 O ATOM 0 H GLU A 42 -10.633 9.712 1.082 1.00 0.00 H new ATOM 0 HA GLU A 42 -9.414 9.288 -1.587 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -12.004 8.633 -0.859 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -12.198 10.246 -1.517 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -11.793 9.540 -3.649 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -10.375 8.630 -3.167 1.00 0.00 H new ATOM 377 N GLN A 43 -9.488 11.825 0.085 1.00 0.00 N ATOM 378 CA GLN A 43 -9.241 13.255 0.169 1.00 0.00 C ATOM 379 C GLN A 43 -8.381 13.715 -1.008 1.00 0.00 C ATOM 380 O GLN A 43 -8.729 14.671 -1.700 1.00 0.00 O ATOM 381 CB GLN A 43 -8.588 13.621 1.503 1.00 0.00 C ATOM 382 CG GLN A 43 -7.349 12.761 1.761 1.00 0.00 C ATOM 383 CD GLN A 43 -7.183 12.474 3.255 1.00 0.00 C ATOM 384 OE1 GLN A 43 -6.134 12.687 3.841 1.00 0.00 O ATOM 385 NE2 GLN A 43 -8.272 11.980 3.835 1.00 0.00 N ATOM 0 H GLN A 43 -9.267 11.304 0.934 1.00 0.00 H new ATOM 0 HA GLN A 43 -10.199 13.773 0.117 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -8.309 14.675 1.499 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -9.305 13.484 2.313 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -7.433 11.822 1.214 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -6.463 13.271 1.384 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -9.117 11.826 3.285 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -8.262 11.755 4.830 1.00 0.00 H new ATOM 392 N TYR A 44 -7.272 13.014 -1.201 1.00 0.00 N ATOM 393 CA TYR A 44 -6.359 13.340 -2.282 1.00 0.00 C ATOM 394 C TYR A 44 -6.189 12.152 -3.233 1.00 0.00 C ATOM 395 O TYR A 44 -6.714 11.069 -2.978 1.00 0.00 O ATOM 396 CB TYR A 44 -5.014 13.645 -1.621 1.00 0.00 C ATOM 397 CG TYR A 44 -5.122 14.492 -0.352 1.00 0.00 C ATOM 398 CD1 TYR A 44 -5.997 15.558 -0.306 1.00 0.00 C ATOM 399 CD2 TYR A 44 -4.344 14.190 0.748 1.00 0.00 C ATOM 400 CE1 TYR A 44 -6.099 16.354 0.889 1.00 0.00 C ATOM 401 CE2 TYR A 44 -4.446 14.987 1.942 1.00 0.00 C ATOM 402 CZ TYR A 44 -5.319 16.031 1.955 1.00 0.00 C ATOM 403 OH TYR A 44 -5.415 16.783 3.082 1.00 0.00 O ATOM 0 H TYR A 44 -6.986 12.221 -0.626 1.00 0.00 H new ATOM 0 HA TYR A 44 -6.738 14.180 -2.864 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -4.519 12.705 -1.377 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -4.378 14.163 -2.338 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -6.605 15.795 -1.166 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -3.659 13.356 0.712 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -6.781 17.190 0.938 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -3.843 14.761 2.809 1.00 0.00 H new ATOM 0 HH TYR A 44 -4.800 16.435 3.761 1.00 0.00 H new ATOM 412 N CYS A 45 -5.455 12.396 -4.307 1.00 0.00 N ATOM 413 CA CYS A 45 -5.209 11.359 -5.296 1.00 0.00 C ATOM 414 C CYS A 45 -6.494 11.150 -6.100 1.00 0.00 C ATOM 415 O CYS A 45 -7.382 10.414 -5.674 1.00 0.00 O ATOM 416 CB CYS A 45 -4.722 10.063 -4.648 1.00 0.00 C ATOM 417 SG CYS A 45 -3.355 10.269 -3.450 1.00 0.00 S ATOM 0 H CYS A 45 -5.022 13.296 -4.515 1.00 0.00 H new ATOM 0 HA CYS A 45 -4.409 11.673 -5.966 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -5.562 9.589 -4.141 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -4.398 9.380 -5.433 1.00 0.00 H new ATOM 421 N HIS A 46 -6.549 11.808 -7.248 1.00 0.00 N ATOM 422 CA HIS A 46 -7.710 11.702 -8.115 1.00 0.00 C ATOM 423 C HIS A 46 -7.430 12.418 -9.439 1.00 0.00 C ATOM 424 O HIS A 46 -6.857 13.506 -9.451 1.00 0.00 O ATOM 425 CB HIS A 46 -8.964 12.228 -7.413 1.00 0.00 C ATOM 426 CG HIS A 46 -10.221 11.461 -7.746 1.00 0.00 C ATOM 427 ND1 HIS A 46 -11.417 11.656 -7.077 1.00 0.00 N ATOM 428 CD2 HIS A 46 -10.457 10.498 -8.683 1.00 0.00 C ATOM 429 CE1 HIS A 46 -12.324 10.842 -7.596 1.00 0.00 C ATOM 430 NE2 HIS A 46 -11.726 10.124 -8.591 1.00 0.00 N ATOM 0 H HIS A 46 -5.809 12.416 -7.598 1.00 0.00 H new ATOM 0 HA HIS A 46 -7.903 10.653 -8.341 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -8.805 12.195 -6.335 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -9.107 13.274 -7.682 1.00 0.00 H new ATOM 0 HD1 HIS A 46 -11.573 12.315 -6.314 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -9.733 10.106 -9.382 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -13.355 10.761 -7.286 1.00 0.00 H new ATOM 437 N ARG A 47 -7.845 11.777 -10.521 1.00 0.00 N ATOM 438 CA ARG A 47 -7.646 12.338 -11.846 1.00 0.00 C ATOM 439 C ARG A 47 -8.990 12.515 -12.556 1.00 0.00 C ATOM 440 O ARG A 47 -9.297 13.598 -13.050 1.00 0.00 O ATOM 441 CB ARG A 47 -6.742 11.441 -12.695 1.00 0.00 C ATOM 442 CG ARG A 47 -7.312 10.024 -12.791 1.00 0.00 C ATOM 443 CD ARG A 47 -6.268 9.050 -13.340 1.00 0.00 C ATOM 444 NE ARG A 47 -5.106 8.986 -12.426 1.00 0.00 N ATOM 445 CZ ARG A 47 -4.028 9.777 -12.525 1.00 0.00 C ATOM 446 NH1 ARG A 47 -3.958 10.695 -13.498 1.00 0.00 N ATOM 447 NH2 ARG A 47 -3.020 9.648 -11.652 1.00 0.00 N ATOM 0 H ARG A 47 -8.319 10.874 -10.507 1.00 0.00 H new ATOM 0 HA ARG A 47 -7.165 13.309 -11.725 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -6.639 11.864 -13.694 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -5.744 11.407 -12.258 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -7.641 9.693 -11.806 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -8.190 10.024 -13.437 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -6.707 8.059 -13.453 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -5.945 9.370 -14.330 1.00 0.00 H new ATOM 0 HE ARG A 47 -5.126 8.297 -11.674 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -4.725 10.792 -14.164 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -3.138 11.297 -13.573 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -3.073 8.948 -10.912 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -2.200 10.250 -11.727 1.00 0.00 H new ATOM 458 N THR A 48 -9.754 11.432 -12.585 1.00 0.00 N ATOM 459 CA THR A 48 -11.058 11.453 -13.226 1.00 0.00 C ATOM 460 C THR A 48 -11.730 10.084 -13.113 1.00 0.00 C ATOM 461 O THR A 48 -11.067 9.083 -12.849 1.00 0.00 O ATOM 462 CB THR A 48 -10.867 11.919 -14.670 1.00 0.00 C ATOM 463 OG1 THR A 48 -12.167 11.817 -15.244 1.00 0.00 O ATOM 464 CG2 THR A 48 -10.020 10.944 -15.492 1.00 0.00 C ATOM 0 H THR A 48 -9.495 10.535 -12.175 1.00 0.00 H new ATOM 0 HA THR A 48 -11.731 12.152 -12.730 1.00 0.00 H new ATOM 0 HB THR A 48 -10.397 12.903 -14.674 1.00 0.00 H new ATOM 0 HG1 THR A 48 -12.134 12.102 -16.181 1.00 0.00 H new ATOM 0 HG21 THR A 48 -9.915 11.322 -16.509 1.00 0.00 H new ATOM 0 HG22 THR A 48 -9.034 10.846 -15.038 1.00 0.00 H new ATOM 0 HG23 THR A 48 -10.507 9.969 -15.515 1.00 0.00 H new ATOM 472 N THR A 49 -13.039 10.084 -13.317 1.00 0.00 N ATOM 473 CA THR A 49 -13.809 8.854 -13.241 1.00 0.00 C ATOM 474 C THR A 49 -14.827 8.791 -14.381 1.00 0.00 C ATOM 475 O THR A 49 -15.494 9.781 -14.678 1.00 0.00 O ATOM 476 CB THR A 49 -14.445 8.779 -11.852 1.00 0.00 C ATOM 477 OG1 THR A 49 -15.175 9.999 -11.739 1.00 0.00 O ATOM 478 CG2 THR A 49 -13.411 8.859 -10.728 1.00 0.00 C ATOM 0 H THR A 49 -13.586 10.917 -13.535 1.00 0.00 H new ATOM 0 HA THR A 49 -13.171 7.979 -13.369 1.00 0.00 H new ATOM 0 HB THR A 49 -15.008 7.850 -11.761 1.00 0.00 H new ATOM 0 HG1 THR A 49 -15.621 10.034 -10.867 1.00 0.00 H new ATOM 0 HG21 THR A 49 -13.916 8.801 -9.764 1.00 0.00 H new ATOM 0 HG22 THR A 49 -12.709 8.030 -10.820 1.00 0.00 H new ATOM 0 HG23 THR A 49 -12.870 9.803 -10.798 1.00 0.00 H new ATOM 486 N ILE A 50 -14.916 7.618 -14.988 1.00 0.00 N ATOM 487 CA ILE A 50 -15.842 7.413 -16.089 1.00 0.00 C ATOM 488 C ILE A 50 -17.130 8.192 -15.818 1.00 0.00 C ATOM 489 O ILE A 50 -17.915 7.818 -14.948 1.00 0.00 O ATOM 490 CB ILE A 50 -16.067 5.918 -16.328 1.00 0.00 C ATOM 491 CG1 ILE A 50 -14.772 5.233 -16.770 1.00 0.00 C ATOM 492 CG2 ILE A 50 -17.205 5.688 -17.324 1.00 0.00 C ATOM 493 CD1 ILE A 50 -14.790 3.745 -16.413 1.00 0.00 C ATOM 0 H ILE A 50 -14.362 6.799 -14.739 1.00 0.00 H new ATOM 0 HA ILE A 50 -15.423 7.802 -17.017 1.00 0.00 H new ATOM 0 HB ILE A 50 -16.367 5.462 -15.385 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -14.643 5.351 -17.846 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -13.920 5.715 -16.292 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -17.344 4.618 -17.476 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -18.125 6.122 -16.932 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -16.958 6.161 -18.275 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -13.858 3.282 -16.738 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -14.895 3.631 -15.334 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -15.629 3.261 -16.912 1.00 0.00 H new ATOM 504 N GLY A 51 -17.308 9.262 -16.579 1.00 0.00 N ATOM 505 CA GLY A 51 -18.488 10.098 -16.432 1.00 0.00 C ATOM 506 C GLY A 51 -18.547 10.720 -15.036 1.00 0.00 C ATOM 507 O GLY A 51 -18.064 10.133 -14.069 1.00 0.00 O ATOM 0 H GLY A 51 -16.655 9.569 -17.300 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -18.476 10.886 -17.185 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -19.384 9.503 -16.607 1.00 0.00 H new ATOM 511 N ASN A 52 -19.144 11.902 -14.974 1.00 0.00 N ATOM 512 CA ASN A 52 -19.274 12.611 -13.713 1.00 0.00 C ATOM 513 C ASN A 52 -20.525 12.120 -12.982 1.00 0.00 C ATOM 514 O ASN A 52 -21.543 12.808 -12.955 1.00 0.00 O ATOM 515 CB ASN A 52 -19.420 14.117 -13.940 1.00 0.00 C ATOM 516 CG ASN A 52 -18.103 14.844 -13.656 1.00 0.00 C ATOM 517 OD1 ASN A 52 -17.304 14.436 -12.830 1.00 0.00 O ATOM 518 ND2 ASN A 52 -17.923 15.941 -14.386 1.00 0.00 N ATOM 0 H ASN A 52 -19.543 12.386 -15.778 1.00 0.00 H new ATOM 0 HA ASN A 52 -18.376 12.420 -13.126 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -19.729 14.305 -14.968 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -20.204 14.512 -13.294 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -17.075 16.497 -14.271 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -18.633 16.227 -15.061 1.00 0.00 H new ATOM 524 N PHE A 53 -20.407 10.931 -12.407 1.00 0.00 N ATOM 525 CA PHE A 53 -21.516 10.340 -11.679 1.00 0.00 C ATOM 526 C PHE A 53 -21.092 9.037 -10.999 1.00 0.00 C ATOM 527 O PHE A 53 -21.732 8.002 -11.179 1.00 0.00 O ATOM 528 CB PHE A 53 -22.612 10.034 -12.702 1.00 0.00 C ATOM 529 CG PHE A 53 -22.331 8.804 -13.566 1.00 0.00 C ATOM 530 CD1 PHE A 53 -21.170 8.717 -14.268 1.00 0.00 C ATOM 531 CD2 PHE A 53 -23.242 7.796 -13.632 1.00 0.00 C ATOM 532 CE1 PHE A 53 -20.910 7.574 -15.071 1.00 0.00 C ATOM 533 CE2 PHE A 53 -22.982 6.654 -14.433 1.00 0.00 C ATOM 534 CZ PHE A 53 -21.821 6.567 -15.136 1.00 0.00 C ATOM 0 H PHE A 53 -19.561 10.362 -12.431 1.00 0.00 H new ATOM 0 HA PHE A 53 -21.862 11.027 -10.906 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -23.555 9.888 -12.176 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -22.740 10.900 -13.352 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -20.446 9.516 -14.215 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -24.164 7.865 -13.074 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -19.988 7.505 -15.630 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -23.706 5.854 -14.484 1.00 0.00 H new ATOM 0 HZ PHE A 53 -21.623 5.698 -15.746 1.00 0.00 H new ATOM 543 N SER A 54 -20.016 9.129 -10.231 1.00 0.00 N ATOM 544 CA SER A 54 -19.499 7.970 -9.524 1.00 0.00 C ATOM 545 C SER A 54 -18.916 6.966 -10.521 1.00 0.00 C ATOM 546 O SER A 54 -19.173 7.055 -11.720 1.00 0.00 O ATOM 547 CB SER A 54 -20.591 7.307 -8.681 1.00 0.00 C ATOM 548 OG SER A 54 -20.386 7.511 -7.286 1.00 0.00 O ATOM 0 H SER A 54 -19.488 9.989 -10.083 1.00 0.00 H new ATOM 0 HA SER A 54 -18.710 8.304 -8.851 1.00 0.00 H new ATOM 0 HB2 SER A 54 -21.563 7.708 -8.967 1.00 0.00 H new ATOM 0 HB3 SER A 54 -20.613 6.238 -8.892 1.00 0.00 H new ATOM 0 HG SER A 54 -21.104 7.074 -6.782 1.00 0.00 H new ATOM 553 N GLY A 55 -18.140 6.034 -9.986 1.00 0.00 N ATOM 554 CA GLY A 55 -17.517 5.014 -10.814 1.00 0.00 C ATOM 555 C GLY A 55 -18.549 3.991 -11.292 1.00 0.00 C ATOM 556 O GLY A 55 -19.107 3.244 -10.490 1.00 0.00 O ATOM 0 H GLY A 55 -17.929 5.964 -8.991 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -17.038 5.481 -11.674 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -16.734 4.509 -10.248 1.00 0.00 H new ATOM 560 N PRO A 56 -18.778 3.990 -12.634 1.00 0.00 N ATOM 561 CA PRO A 56 -19.733 3.071 -13.228 1.00 0.00 C ATOM 562 C PRO A 56 -19.164 1.652 -13.290 1.00 0.00 C ATOM 563 O PRO A 56 -19.630 0.761 -12.580 1.00 0.00 O ATOM 564 CB PRO A 56 -20.033 3.650 -14.602 1.00 0.00 C ATOM 565 CG PRO A 56 -18.894 4.609 -14.907 1.00 0.00 C ATOM 566 CD PRO A 56 -18.136 4.860 -13.614 1.00 0.00 C ATOM 0 HA PRO A 56 -20.646 2.977 -12.641 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -20.092 2.863 -15.353 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -20.992 4.168 -14.607 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -18.231 4.186 -15.662 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -19.281 5.545 -15.310 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -17.078 4.621 -13.722 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -18.198 5.906 -13.315 1.00 0.00 H new ATOM 571 N TYR A 57 -18.165 1.486 -14.143 1.00 0.00 N ATOM 572 CA TYR A 57 -17.528 0.190 -14.306 1.00 0.00 C ATOM 573 C TYR A 57 -16.728 -0.188 -13.057 1.00 0.00 C ATOM 574 O TYR A 57 -16.501 0.648 -12.184 1.00 0.00 O ATOM 575 CB TYR A 57 -16.567 0.339 -15.487 1.00 0.00 C ATOM 576 CG TYR A 57 -15.668 -0.878 -15.715 1.00 0.00 C ATOM 577 CD1 TYR A 57 -16.229 -2.106 -16.002 1.00 0.00 C ATOM 578 CD2 TYR A 57 -14.296 -0.749 -15.634 1.00 0.00 C ATOM 579 CE1 TYR A 57 -15.384 -3.253 -16.216 1.00 0.00 C ATOM 580 CE2 TYR A 57 -13.450 -1.895 -15.849 1.00 0.00 C ATOM 581 CZ TYR A 57 -14.037 -3.090 -16.129 1.00 0.00 C ATOM 582 OH TYR A 57 -13.238 -4.171 -16.332 1.00 0.00 O ATOM 0 H TYR A 57 -17.781 2.227 -14.729 1.00 0.00 H new ATOM 0 HA TYR A 57 -18.274 -0.587 -14.470 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -17.146 0.525 -16.392 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -15.940 1.216 -15.324 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -17.302 -2.207 -16.066 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -13.857 0.212 -15.409 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -15.810 -4.220 -16.440 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -12.375 -1.808 -15.789 1.00 0.00 H new ATOM 0 HH TYR A 57 -12.382 -3.879 -16.710 1.00 0.00 H new ATOM 591 N THR A 58 -16.321 -1.448 -13.013 1.00 0.00 N ATOM 592 CA THR A 58 -15.551 -1.947 -11.887 1.00 0.00 C ATOM 593 C THR A 58 -14.060 -1.973 -12.229 1.00 0.00 C ATOM 594 O THR A 58 -13.546 -2.986 -12.701 1.00 0.00 O ATOM 595 CB THR A 58 -16.110 -3.318 -11.502 1.00 0.00 C ATOM 596 OG1 THR A 58 -15.398 -3.663 -10.316 1.00 0.00 O ATOM 597 CG2 THR A 58 -15.722 -4.410 -12.500 1.00 0.00 C ATOM 0 H THR A 58 -16.510 -2.138 -13.740 1.00 0.00 H new ATOM 0 HA THR A 58 -15.642 -1.288 -11.023 1.00 0.00 H new ATOM 0 HB THR A 58 -17.196 -3.260 -11.432 1.00 0.00 H new ATOM 0 HG1 THR A 58 -15.700 -4.539 -9.997 1.00 0.00 H new ATOM 0 HG21 THR A 58 -16.144 -5.362 -12.180 1.00 0.00 H new ATOM 0 HG22 THR A 58 -16.109 -4.155 -13.487 1.00 0.00 H new ATOM 0 HG23 THR A 58 -14.636 -4.492 -12.546 1.00 0.00 H new ATOM 605 N TYR A 59 -13.407 -0.848 -11.977 1.00 0.00 N ATOM 606 CA TYR A 59 -11.986 -0.729 -12.254 1.00 0.00 C ATOM 607 C TYR A 59 -11.221 -0.279 -11.007 1.00 0.00 C ATOM 608 O TYR A 59 -11.791 0.353 -10.119 1.00 0.00 O ATOM 609 CB TYR A 59 -11.854 0.347 -13.334 1.00 0.00 C ATOM 610 CG TYR A 59 -12.598 1.645 -13.014 1.00 0.00 C ATOM 611 CD1 TYR A 59 -13.975 1.690 -13.099 1.00 0.00 C ATOM 612 CD2 TYR A 59 -11.892 2.770 -12.639 1.00 0.00 C ATOM 613 CE1 TYR A 59 -14.675 2.911 -12.797 1.00 0.00 C ATOM 614 CE2 TYR A 59 -12.592 3.992 -12.338 1.00 0.00 C ATOM 615 CZ TYR A 59 -13.949 4.003 -12.432 1.00 0.00 C ATOM 616 OH TYR A 59 -14.610 5.156 -12.147 1.00 0.00 O ATOM 0 H TYR A 59 -13.836 -0.010 -11.584 1.00 0.00 H new ATOM 0 HA TYR A 59 -11.575 -1.688 -12.568 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -10.798 0.572 -13.480 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -12.229 -0.051 -14.277 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -14.527 0.809 -13.392 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -10.815 2.734 -12.571 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -15.752 2.960 -12.859 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -12.052 4.880 -12.044 1.00 0.00 H new ATOM 0 HH TYR A 59 -13.964 5.851 -11.901 1.00 0.00 H new ATOM 625 N CYS A 60 -9.942 -0.622 -10.981 1.00 0.00 N ATOM 626 CA CYS A 60 -9.093 -0.262 -9.857 1.00 0.00 C ATOM 627 C CYS A 60 -9.310 1.221 -9.549 1.00 0.00 C ATOM 628 O CYS A 60 -9.297 2.056 -10.452 1.00 0.00 O ATOM 629 CB CYS A 60 -7.622 -0.577 -10.136 1.00 0.00 C ATOM 630 SG CYS A 60 -7.321 -2.202 -10.922 1.00 0.00 S ATOM 0 H CYS A 60 -9.472 -1.145 -11.720 1.00 0.00 H new ATOM 0 HA CYS A 60 -9.365 -0.858 -8.986 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -7.214 0.203 -10.779 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -7.072 -0.536 -9.196 1.00 0.00 H new ATOM 634 N ASN A 61 -9.504 1.503 -8.269 1.00 0.00 N ATOM 635 CA ASN A 61 -9.724 2.871 -7.828 1.00 0.00 C ATOM 636 C ASN A 61 -8.525 3.334 -7.000 1.00 0.00 C ATOM 637 O ASN A 61 -7.638 2.540 -6.686 1.00 0.00 O ATOM 638 CB ASN A 61 -10.974 2.973 -6.952 1.00 0.00 C ATOM 639 CG ASN A 61 -11.454 4.422 -6.849 1.00 0.00 C ATOM 640 OD1 ASN A 61 -11.417 5.184 -7.801 1.00 0.00 O ATOM 641 ND2 ASN A 61 -11.906 4.759 -5.644 1.00 0.00 N ATOM 0 H ASN A 61 -9.513 0.808 -7.523 1.00 0.00 H new ATOM 0 HA ASN A 61 -9.853 3.494 -8.713 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -11.767 2.352 -7.370 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -10.757 2.586 -5.956 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -12.249 5.704 -5.474 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -11.909 4.072 -4.890 1.00 0.00 H new ATOM 647 N THR A 62 -8.535 4.617 -6.668 1.00 0.00 N ATOM 648 CA THR A 62 -7.460 5.194 -5.881 1.00 0.00 C ATOM 649 C THR A 62 -7.585 4.774 -4.415 1.00 0.00 C ATOM 650 O THR A 62 -8.464 5.255 -3.700 1.00 0.00 O ATOM 651 CB THR A 62 -7.489 6.711 -6.083 1.00 0.00 C ATOM 652 OG1 THR A 62 -6.810 6.909 -7.320 1.00 0.00 O ATOM 653 CG2 THR A 62 -6.624 7.454 -5.061 1.00 0.00 C ATOM 0 H THR A 62 -9.271 5.273 -6.930 1.00 0.00 H new ATOM 0 HA THR A 62 -6.488 4.825 -6.209 1.00 0.00 H new ATOM 0 HB THR A 62 -8.517 7.067 -6.016 1.00 0.00 H new ATOM 0 HG1 THR A 62 -6.784 7.866 -7.529 1.00 0.00 H new ATOM 0 HG21 THR A 62 -6.680 8.526 -5.248 1.00 0.00 H new ATOM 0 HG22 THR A 62 -6.986 7.242 -4.055 1.00 0.00 H new ATOM 0 HG23 THR A 62 -5.589 7.123 -5.151 1.00 0.00 H new ATOM 661 N THR A 63 -6.694 3.881 -4.010 1.00 0.00 N ATOM 662 CA THR A 63 -6.695 3.391 -2.642 1.00 0.00 C ATOM 663 C THR A 63 -5.267 3.331 -2.097 1.00 0.00 C ATOM 664 O THR A 63 -4.304 3.395 -2.859 1.00 0.00 O ATOM 665 CB THR A 63 -7.409 2.038 -2.625 1.00 0.00 C ATOM 666 OG1 THR A 63 -8.772 2.368 -2.372 1.00 0.00 O ATOM 667 CG2 THR A 63 -7.004 1.177 -1.426 1.00 0.00 C ATOM 0 H THR A 63 -5.967 3.484 -4.605 1.00 0.00 H new ATOM 0 HA THR A 63 -7.235 4.068 -1.979 1.00 0.00 H new ATOM 0 HB THR A 63 -7.190 1.500 -3.548 1.00 0.00 H new ATOM 0 HG1 THR A 63 -8.945 3.288 -2.661 1.00 0.00 H new ATOM 0 HG21 THR A 63 -7.539 0.228 -1.462 1.00 0.00 H new ATOM 0 HG22 THR A 63 -5.931 0.990 -1.459 1.00 0.00 H new ATOM 0 HG23 THR A 63 -7.253 1.699 -0.502 1.00 0.00 H new ATOM 675 N LEU A 64 -5.174 3.210 -0.780 1.00 0.00 N ATOM 676 CA LEU A 64 -3.880 3.141 -0.123 1.00 0.00 C ATOM 677 C LEU A 64 -3.797 1.851 0.695 1.00 0.00 C ATOM 678 O LEU A 64 -4.623 1.616 1.576 1.00 0.00 O ATOM 679 CB LEU A 64 -3.627 4.407 0.697 1.00 0.00 C ATOM 680 CG LEU A 64 -4.774 4.859 1.603 1.00 0.00 C ATOM 681 CD1 LEU A 64 -4.358 4.819 3.075 1.00 0.00 C ATOM 682 CD2 LEU A 64 -5.288 6.241 1.190 1.00 0.00 C ATOM 0 H LEU A 64 -5.975 3.158 -0.150 1.00 0.00 H new ATOM 0 HA LEU A 64 -3.079 3.103 -0.861 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -2.744 4.245 1.315 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -3.391 5.220 0.010 1.00 0.00 H new ATOM 0 HG LEU A 64 -5.601 4.159 1.482 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -5.191 5.145 3.698 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -4.079 3.801 3.347 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -3.507 5.483 3.231 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -6.103 6.538 1.850 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -4.478 6.967 1.263 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -5.649 6.203 0.162 1.00 0.00 H new ATOM 693 N ASP A 65 -2.792 1.049 0.375 1.00 0.00 N ATOM 694 CA ASP A 65 -2.589 -0.211 1.070 1.00 0.00 C ATOM 695 C ASP A 65 -1.673 0.016 2.273 1.00 0.00 C ATOM 696 O ASP A 65 -1.418 1.157 2.657 1.00 0.00 O ATOM 697 CB ASP A 65 -1.925 -1.243 0.157 1.00 0.00 C ATOM 698 CG ASP A 65 -2.784 -2.466 -0.170 1.00 0.00 C ATOM 699 OD1 ASP A 65 -3.189 -3.150 0.794 1.00 0.00 O ATOM 700 OD2 ASP A 65 -3.016 -2.689 -1.378 1.00 0.00 O ATOM 0 H ASP A 65 -2.109 1.247 -0.356 1.00 0.00 H new ATOM 0 HA ASP A 65 -3.564 -0.583 1.385 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -1.646 -0.754 -0.776 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -1.002 -1.582 0.628 1.00 0.00 H new ATOM 704 N GLN A 66 -1.203 -1.088 2.835 1.00 0.00 N ATOM 705 CA GLN A 66 -0.319 -1.023 3.987 1.00 0.00 C ATOM 706 C GLN A 66 0.656 0.148 3.843 1.00 0.00 C ATOM 707 O GLN A 66 1.086 0.729 4.839 1.00 0.00 O ATOM 708 CB GLN A 66 0.432 -2.341 4.177 1.00 0.00 C ATOM 709 CG GLN A 66 1.169 -2.366 5.518 1.00 0.00 C ATOM 710 CD GLN A 66 0.445 -3.258 6.527 1.00 0.00 C ATOM 711 OE1 GLN A 66 -0.698 -3.646 6.343 1.00 0.00 O ATOM 712 NE2 GLN A 66 1.169 -3.560 7.600 1.00 0.00 N ATOM 0 H GLN A 66 -1.417 -2.032 2.514 1.00 0.00 H new ATOM 0 HA GLN A 66 -0.926 -0.858 4.877 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -0.270 -3.173 4.129 1.00 0.00 H new ATOM 0 HB3 GLN A 66 1.145 -2.478 3.364 1.00 0.00 H new ATOM 0 HG2 GLN A 66 2.186 -2.729 5.371 1.00 0.00 H new ATOM 0 HG3 GLN A 66 1.246 -1.353 5.913 1.00 0.00 H new ATOM 0 HE21 GLN A 66 2.120 -3.202 7.691 1.00 0.00 H new ATOM 0 HE22 GLN A 66 0.774 -4.150 8.332 1.00 0.00 H new ATOM 719 N ILE A 67 0.977 0.460 2.596 1.00 0.00 N ATOM 720 CA ILE A 67 1.893 1.549 2.309 1.00 0.00 C ATOM 721 C ILE A 67 1.097 2.845 2.126 1.00 0.00 C ATOM 722 O ILE A 67 0.476 3.054 1.086 1.00 0.00 O ATOM 723 CB ILE A 67 2.783 1.202 1.115 1.00 0.00 C ATOM 724 CG1 ILE A 67 1.941 0.771 -0.089 1.00 0.00 C ATOM 725 CG2 ILE A 67 3.823 0.146 1.495 1.00 0.00 C ATOM 726 CD1 ILE A 67 2.789 0.725 -1.362 1.00 0.00 C ATOM 0 H ILE A 67 0.618 -0.023 1.773 1.00 0.00 H new ATOM 0 HA ILE A 67 2.572 1.705 3.148 1.00 0.00 H new ATOM 0 HB ILE A 67 3.328 2.099 0.822 1.00 0.00 H new ATOM 0 HG12 ILE A 67 1.507 -0.211 0.099 1.00 0.00 H new ATOM 0 HG13 ILE A 67 1.112 1.465 -0.225 1.00 0.00 H new ATOM 0 HG21 ILE A 67 4.443 -0.083 0.628 1.00 0.00 H new ATOM 0 HG22 ILE A 67 4.451 0.527 2.300 1.00 0.00 H new ATOM 0 HG23 ILE A 67 3.317 -0.760 1.828 1.00 0.00 H new ATOM 0 HD11 ILE A 67 2.167 0.416 -2.202 1.00 0.00 H new ATOM 0 HD12 ILE A 67 3.202 1.714 -1.560 1.00 0.00 H new ATOM 0 HD13 ILE A 67 3.603 0.012 -1.231 1.00 0.00 H new ATOM 737 N GLY A 68 1.142 3.678 3.154 1.00 0.00 N ATOM 738 CA GLY A 68 0.433 4.946 3.121 1.00 0.00 C ATOM 739 C GLY A 68 0.379 5.506 1.698 1.00 0.00 C ATOM 740 O GLY A 68 -0.633 6.073 1.288 1.00 0.00 O ATOM 0 H GLY A 68 1.658 3.500 4.015 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -0.580 4.811 3.501 1.00 0.00 H new ATOM 0 HA3 GLY A 68 0.928 5.661 3.779 1.00 0.00 H new ATOM 744 N THR A 69 1.480 5.329 0.984 1.00 0.00 N ATOM 745 CA THR A 69 1.572 5.810 -0.384 1.00 0.00 C ATOM 746 C THR A 69 0.294 5.470 -1.155 1.00 0.00 C ATOM 747 O THR A 69 0.031 4.303 -1.442 1.00 0.00 O ATOM 748 CB THR A 69 2.835 5.217 -1.010 1.00 0.00 C ATOM 749 OG1 THR A 69 3.881 6.072 -0.557 1.00 0.00 O ATOM 750 CG2 THR A 69 2.862 5.370 -2.532 1.00 0.00 C ATOM 0 H THR A 69 2.317 4.859 1.327 1.00 0.00 H new ATOM 0 HA THR A 69 1.655 6.896 -0.417 1.00 0.00 H new ATOM 0 HB THR A 69 2.907 4.161 -0.750 1.00 0.00 H new ATOM 0 HG1 THR A 69 4.738 5.759 -0.915 1.00 0.00 H new ATOM 0 HG21 THR A 69 3.780 4.932 -2.925 1.00 0.00 H new ATOM 0 HG22 THR A 69 2.002 4.859 -2.964 1.00 0.00 H new ATOM 0 HG23 THR A 69 2.824 6.428 -2.792 1.00 0.00 H new ATOM 758 N CYS A 70 -0.465 6.509 -1.468 1.00 0.00 N ATOM 759 CA CYS A 70 -1.708 6.335 -2.199 1.00 0.00 C ATOM 760 C CYS A 70 -1.376 5.767 -3.581 1.00 0.00 C ATOM 761 O CYS A 70 -0.281 5.980 -4.097 1.00 0.00 O ATOM 762 CB CYS A 70 -2.497 7.642 -2.293 1.00 0.00 C ATOM 763 SG CYS A 70 -2.087 8.683 -3.741 1.00 0.00 S ATOM 0 H CYS A 70 -0.243 7.475 -1.229 1.00 0.00 H new ATOM 0 HA CYS A 70 -2.353 5.637 -1.665 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -3.561 7.407 -2.322 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -2.323 8.221 -1.386 1.00 0.00 H new ATOM 767 N TRP A 71 -2.345 5.056 -4.141 1.00 0.00 N ATOM 768 CA TRP A 71 -2.169 4.456 -5.453 1.00 0.00 C ATOM 769 C TRP A 71 -3.211 5.064 -6.394 1.00 0.00 C ATOM 770 O TRP A 71 -4.377 5.203 -6.027 1.00 0.00 O ATOM 771 CB TRP A 71 -2.252 2.931 -5.374 1.00 0.00 C ATOM 772 CG TRP A 71 -1.060 2.278 -4.669 1.00 0.00 C ATOM 773 CD1 TRP A 71 -0.969 1.895 -3.389 1.00 0.00 C ATOM 774 CD2 TRP A 71 0.213 1.946 -5.262 1.00 0.00 C ATOM 775 NE1 TRP A 71 0.266 1.343 -3.114 1.00 0.00 N ATOM 776 CE2 TRP A 71 1.006 1.373 -4.289 1.00 0.00 C ATOM 777 CE3 TRP A 71 0.677 2.122 -6.577 1.00 0.00 C ATOM 778 CZ2 TRP A 71 2.313 0.932 -4.528 1.00 0.00 C ATOM 779 CZ3 TRP A 71 1.986 1.675 -6.800 1.00 0.00 C ATOM 780 CH2 TRP A 71 2.798 1.098 -5.830 1.00 0.00 C ATOM 0 H TRP A 71 -3.253 4.882 -3.710 1.00 0.00 H new ATOM 0 HA TRP A 71 -1.176 4.673 -5.847 1.00 0.00 H new ATOM 0 HB2 TRP A 71 -3.167 2.654 -4.850 1.00 0.00 H new ATOM 0 HB3 TRP A 71 -2.328 2.529 -6.384 1.00 0.00 H new ATOM 0 HD1 TRP A 71 -1.762 2.004 -2.664 1.00 0.00 H new ATOM 0 HE1 TRP A 71 0.578 0.980 -2.213 1.00 0.00 H new ATOM 0 HE3 TRP A 71 0.073 2.566 -7.354 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 2.915 0.487 -3.749 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 2.393 1.786 -7.794 1.00 0.00 H new ATOM 0 HH2 TRP A 71 3.799 0.779 -6.080 1.00 0.00 H new ATOM 790 N PRO A 72 -2.742 5.420 -7.620 1.00 0.00 N ATOM 791 CA PRO A 72 -3.620 6.010 -8.615 1.00 0.00 C ATOM 792 C PRO A 72 -4.535 4.952 -9.235 1.00 0.00 C ATOM 793 O PRO A 72 -4.094 3.842 -9.533 1.00 0.00 O ATOM 794 CB PRO A 72 -2.690 6.656 -9.628 1.00 0.00 C ATOM 795 CG PRO A 72 -1.329 6.011 -9.415 1.00 0.00 C ATOM 796 CD PRO A 72 -1.367 5.271 -8.088 1.00 0.00 C ATOM 0 HA PRO A 72 -4.300 6.749 -8.190 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -3.045 6.491 -10.645 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -2.639 7.735 -9.479 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -1.101 5.323 -10.229 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -0.545 6.768 -9.408 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -1.103 4.221 -8.212 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -0.658 5.696 -7.377 1.00 0.00 H new ATOM 801 N GLN A 73 -5.792 5.331 -9.410 1.00 0.00 N ATOM 802 CA GLN A 73 -6.773 4.429 -9.989 1.00 0.00 C ATOM 803 C GLN A 73 -6.257 3.862 -11.313 1.00 0.00 C ATOM 804 O GLN A 73 -5.323 4.405 -11.902 1.00 0.00 O ATOM 805 CB GLN A 73 -8.119 5.131 -10.180 1.00 0.00 C ATOM 806 CG GLN A 73 -7.998 6.287 -11.175 1.00 0.00 C ATOM 807 CD GLN A 73 -8.028 5.774 -12.617 1.00 0.00 C ATOM 808 OE1 GLN A 73 -7.038 5.791 -13.330 1.00 0.00 O ATOM 809 NE2 GLN A 73 -9.215 5.317 -13.004 1.00 0.00 N ATOM 0 H GLN A 73 -6.154 6.251 -9.161 1.00 0.00 H new ATOM 0 HA GLN A 73 -6.928 3.601 -9.298 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -8.859 4.415 -10.537 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -8.476 5.507 -9.221 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -8.814 6.993 -11.019 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -7.069 6.829 -10.997 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -10.003 5.332 -12.356 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -9.338 4.952 -13.948 1.00 0.00 H new ATOM 816 N SER A 74 -6.888 2.780 -11.743 1.00 0.00 N ATOM 817 CA SER A 74 -6.504 2.134 -12.987 1.00 0.00 C ATOM 818 C SER A 74 -7.499 1.023 -13.328 1.00 0.00 C ATOM 819 O SER A 74 -8.465 0.804 -12.599 1.00 0.00 O ATOM 820 CB SER A 74 -5.086 1.568 -12.898 1.00 0.00 C ATOM 821 OG SER A 74 -4.574 1.616 -11.570 1.00 0.00 O ATOM 0 H SER A 74 -7.663 2.334 -11.252 1.00 0.00 H new ATOM 0 HA SER A 74 -6.518 2.882 -13.780 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.085 0.536 -13.250 1.00 0.00 H new ATOM 0 HB3 SER A 74 -4.429 2.131 -13.560 1.00 0.00 H new ATOM 0 HG SER A 74 -3.834 0.980 -11.482 1.00 0.00 H new ATOM 826 N ALA A 75 -7.229 0.351 -14.438 1.00 0.00 N ATOM 827 CA ALA A 75 -8.088 -0.733 -14.885 1.00 0.00 C ATOM 828 C ALA A 75 -7.700 -2.020 -14.154 1.00 0.00 C ATOM 829 O ALA A 75 -6.577 -2.149 -13.672 1.00 0.00 O ATOM 830 CB ALA A 75 -7.986 -0.871 -16.405 1.00 0.00 C ATOM 0 H ALA A 75 -6.428 0.536 -15.041 1.00 0.00 H new ATOM 0 HA ALA A 75 -9.130 -0.521 -14.647 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -8.630 -1.684 -16.741 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -8.301 0.060 -16.877 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -6.954 -1.087 -16.682 1.00 0.00 H new ATOM 836 N PRO A 76 -8.678 -2.963 -14.095 1.00 0.00 N ATOM 837 CA PRO A 76 -8.450 -4.236 -13.432 1.00 0.00 C ATOM 838 C PRO A 76 -7.571 -5.151 -14.288 1.00 0.00 C ATOM 839 O PRO A 76 -7.287 -4.841 -15.443 1.00 0.00 O ATOM 840 CB PRO A 76 -9.837 -4.805 -13.187 1.00 0.00 C ATOM 841 CG PRO A 76 -10.767 -4.060 -14.130 1.00 0.00 C ATOM 842 CD PRO A 76 -10.020 -2.844 -14.656 1.00 0.00 C ATOM 0 HA PRO A 76 -7.906 -4.130 -12.494 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -9.859 -5.877 -13.383 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -10.139 -4.664 -12.149 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -11.073 -4.705 -14.953 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -11.675 -3.755 -13.609 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -9.994 -2.836 -15.746 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -10.500 -1.917 -14.341 1.00 0.00 H new ATOM 847 N GLY A 77 -7.163 -6.258 -13.686 1.00 0.00 N ATOM 848 CA GLY A 77 -6.323 -7.220 -14.378 1.00 0.00 C ATOM 849 C GLY A 77 -5.099 -6.537 -14.990 1.00 0.00 C ATOM 850 O GLY A 77 -4.965 -6.471 -16.211 1.00 0.00 O ATOM 0 H GLY A 77 -7.399 -6.510 -12.726 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -6.002 -7.995 -13.682 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -6.898 -7.714 -15.161 1.00 0.00 H new ATOM 854 N ALA A 78 -4.235 -6.045 -14.113 1.00 0.00 N ATOM 855 CA ALA A 78 -3.025 -5.370 -14.553 1.00 0.00 C ATOM 856 C ALA A 78 -1.986 -5.414 -13.430 1.00 0.00 C ATOM 857 O ALA A 78 -1.936 -6.374 -12.663 1.00 0.00 O ATOM 858 CB ALA A 78 -3.365 -3.940 -14.977 1.00 0.00 C ATOM 0 H ALA A 78 -4.349 -6.100 -13.101 1.00 0.00 H new ATOM 0 HA ALA A 78 -2.596 -5.874 -15.419 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -2.458 -3.433 -15.307 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -4.085 -3.964 -15.795 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -3.794 -3.402 -14.132 1.00 0.00 H new ATOM 864 N LEU A 79 -1.181 -4.363 -13.370 1.00 0.00 N ATOM 865 CA LEU A 79 -0.146 -4.270 -12.356 1.00 0.00 C ATOM 866 C LEU A 79 0.450 -2.861 -12.368 1.00 0.00 C ATOM 867 O LEU A 79 0.766 -2.327 -13.430 1.00 0.00 O ATOM 868 CB LEU A 79 0.891 -5.378 -12.544 1.00 0.00 C ATOM 869 CG LEU A 79 1.671 -5.350 -13.861 1.00 0.00 C ATOM 870 CD1 LEU A 79 2.704 -6.476 -13.911 1.00 0.00 C ATOM 871 CD2 LEU A 79 0.722 -5.389 -15.061 1.00 0.00 C ATOM 0 H LEU A 79 -1.225 -3.568 -14.008 1.00 0.00 H new ATOM 0 HA LEU A 79 -0.570 -4.428 -11.365 1.00 0.00 H new ATOM 0 HB2 LEU A 79 1.604 -5.325 -11.721 1.00 0.00 H new ATOM 0 HB3 LEU A 79 0.384 -6.340 -12.465 1.00 0.00 H new ATOM 0 HG LEU A 79 2.218 -4.409 -13.913 1.00 0.00 H new ATOM 0 HD11 LEU A 79 3.244 -6.433 -14.857 1.00 0.00 H new ATOM 0 HD12 LEU A 79 3.407 -6.361 -13.086 1.00 0.00 H new ATOM 0 HD13 LEU A 79 2.198 -7.438 -13.825 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.301 -5.368 -15.984 1.00 0.00 H new ATOM 0 HD22 LEU A 79 0.128 -6.302 -15.026 1.00 0.00 H new ATOM 0 HD23 LEU A 79 0.059 -4.524 -15.029 1.00 0.00 H new ATOM 882 N VAL A 80 0.584 -2.299 -11.177 1.00 0.00 N ATOM 883 CA VAL A 80 1.136 -0.961 -11.037 1.00 0.00 C ATOM 884 C VAL A 80 2.472 -1.041 -10.296 1.00 0.00 C ATOM 885 O VAL A 80 2.609 -0.500 -9.200 1.00 0.00 O ATOM 886 CB VAL A 80 0.122 -0.046 -10.349 1.00 0.00 C ATOM 887 CG1 VAL A 80 0.782 1.258 -9.895 1.00 0.00 C ATOM 888 CG2 VAL A 80 -1.074 0.232 -11.261 1.00 0.00 C ATOM 0 H VAL A 80 0.320 -2.745 -10.299 1.00 0.00 H new ATOM 0 HA VAL A 80 1.334 -0.524 -12.016 1.00 0.00 H new ATOM 0 HB VAL A 80 -0.248 -0.561 -9.462 1.00 0.00 H new ATOM 0 HG11 VAL A 80 0.040 1.891 -9.409 1.00 0.00 H new ATOM 0 HG12 VAL A 80 1.585 1.034 -9.192 1.00 0.00 H new ATOM 0 HG13 VAL A 80 1.192 1.779 -10.760 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -1.779 0.885 -10.747 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -0.730 0.717 -12.175 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -1.566 -0.708 -11.512 1.00 0.00 H new ATOM 898 N GLU A 81 3.422 -1.719 -10.923 1.00 0.00 N ATOM 899 CA GLU A 81 4.741 -1.875 -10.335 1.00 0.00 C ATOM 900 C GLU A 81 5.551 -0.588 -10.498 1.00 0.00 C ATOM 901 O GLU A 81 5.592 -0.009 -11.583 1.00 0.00 O ATOM 902 CB GLU A 81 5.477 -3.068 -10.952 1.00 0.00 C ATOM 903 CG GLU A 81 4.566 -4.294 -11.029 1.00 0.00 C ATOM 904 CD GLU A 81 5.361 -5.545 -11.406 1.00 0.00 C ATOM 905 OE1 GLU A 81 6.592 -5.405 -11.578 1.00 0.00 O ATOM 906 OE2 GLU A 81 4.722 -6.614 -11.513 1.00 0.00 O ATOM 0 H GLU A 81 3.304 -2.166 -11.832 1.00 0.00 H new ATOM 0 HA GLU A 81 4.622 -2.073 -9.270 1.00 0.00 H new ATOM 0 HB2 GLU A 81 5.827 -2.807 -11.951 1.00 0.00 H new ATOM 0 HB3 GLU A 81 6.359 -3.303 -10.357 1.00 0.00 H new ATOM 0 HG2 GLU A 81 4.074 -4.447 -10.068 1.00 0.00 H new ATOM 0 HG3 GLU A 81 3.781 -4.122 -11.765 1.00 0.00 H new ATOM 911 N ARG A 82 6.175 -0.177 -9.404 1.00 0.00 N ATOM 912 CA ARG A 82 6.981 1.032 -9.412 1.00 0.00 C ATOM 913 C ARG A 82 7.808 1.127 -8.128 1.00 0.00 C ATOM 914 O ARG A 82 7.463 0.518 -7.117 1.00 0.00 O ATOM 915 CB ARG A 82 6.104 2.279 -9.538 1.00 0.00 C ATOM 916 CG ARG A 82 5.218 2.453 -8.303 1.00 0.00 C ATOM 917 CD ARG A 82 4.984 3.935 -8.001 1.00 0.00 C ATOM 918 NE ARG A 82 3.589 4.305 -8.333 1.00 0.00 N ATOM 919 CZ ARG A 82 3.178 5.560 -8.560 1.00 0.00 C ATOM 920 NH1 ARG A 82 4.053 6.573 -8.493 1.00 0.00 N ATOM 921 NH2 ARG A 82 1.894 5.801 -8.854 1.00 0.00 N ATOM 0 H ARG A 82 6.139 -0.660 -8.506 1.00 0.00 H new ATOM 0 HA ARG A 82 7.646 0.981 -10.274 1.00 0.00 H new ATOM 0 HB2 ARG A 82 6.734 3.160 -9.665 1.00 0.00 H new ATOM 0 HB3 ARG A 82 5.481 2.201 -10.429 1.00 0.00 H new ATOM 0 HG2 ARG A 82 4.262 1.955 -8.464 1.00 0.00 H new ATOM 0 HG3 ARG A 82 5.687 1.973 -7.444 1.00 0.00 H new ATOM 0 HD2 ARG A 82 5.181 4.136 -6.948 1.00 0.00 H new ATOM 0 HD3 ARG A 82 5.678 4.546 -8.578 1.00 0.00 H new ATOM 0 HE ARG A 82 2.898 3.557 -8.393 1.00 0.00 H new ATOM 0 HH11 ARG A 82 5.031 6.388 -8.269 1.00 0.00 H new ATOM 0 HH12 ARG A 82 3.741 7.529 -8.666 1.00 0.00 H new ATOM 0 HH21 ARG A 82 1.229 5.029 -8.905 1.00 0.00 H new ATOM 0 HH22 ARG A 82 1.581 6.756 -9.027 1.00 0.00 H new ATOM 932 N PRO A 83 8.912 1.915 -8.212 1.00 0.00 N ATOM 933 CA PRO A 83 9.791 2.098 -7.070 1.00 0.00 C ATOM 934 C PRO A 83 9.160 3.033 -6.036 1.00 0.00 C ATOM 935 O PRO A 83 8.724 4.133 -6.373 1.00 0.00 O ATOM 936 CB PRO A 83 11.086 2.644 -7.651 1.00 0.00 C ATOM 937 CG PRO A 83 10.730 3.183 -9.027 1.00 0.00 C ATOM 938 CD PRO A 83 9.353 2.653 -9.394 1.00 0.00 C ATOM 0 HA PRO A 83 9.973 1.170 -6.528 1.00 0.00 H new ATOM 0 HB2 PRO A 83 11.497 3.430 -7.018 1.00 0.00 H new ATOM 0 HB3 PRO A 83 11.843 1.863 -7.721 1.00 0.00 H new ATOM 0 HG2 PRO A 83 10.730 4.273 -9.022 1.00 0.00 H new ATOM 0 HG3 PRO A 83 11.469 2.868 -9.763 1.00 0.00 H new ATOM 0 HD2 PRO A 83 8.667 3.466 -9.632 1.00 0.00 H new ATOM 0 HD3 PRO A 83 9.398 2.006 -10.270 1.00 0.00 H new ATOM 943 N CYS A 84 9.129 2.561 -4.799 1.00 0.00 N ATOM 944 CA CYS A 84 8.558 3.341 -3.714 1.00 0.00 C ATOM 945 C CYS A 84 9.129 4.759 -3.789 1.00 0.00 C ATOM 946 O CYS A 84 10.340 4.950 -3.705 1.00 0.00 O ATOM 947 CB CYS A 84 8.820 2.693 -2.352 1.00 0.00 C ATOM 948 SG CYS A 84 8.600 0.877 -2.312 1.00 0.00 S ATOM 0 H CYS A 84 9.490 1.648 -4.523 1.00 0.00 H new ATOM 0 HA CYS A 84 7.474 3.380 -3.823 1.00 0.00 H new ATOM 0 HB2 CYS A 84 9.838 2.928 -2.043 1.00 0.00 H new ATOM 0 HB3 CYS A 84 8.152 3.142 -1.617 1.00 0.00 H new ATOM 952 N PRO A 85 8.204 5.742 -3.952 1.00 0.00 N ATOM 953 CA PRO A 85 8.601 7.137 -4.041 1.00 0.00 C ATOM 954 C PRO A 85 8.991 7.684 -2.667 1.00 0.00 C ATOM 955 O PRO A 85 8.157 7.760 -1.766 1.00 0.00 O ATOM 956 CB PRO A 85 7.402 7.850 -4.647 1.00 0.00 C ATOM 957 CG PRO A 85 6.218 6.919 -4.444 1.00 0.00 C ATOM 958 CD PRO A 85 6.759 5.553 -4.057 1.00 0.00 C ATOM 0 HA PRO A 85 9.488 7.284 -4.658 1.00 0.00 H new ATOM 0 HB2 PRO A 85 7.232 8.810 -4.160 1.00 0.00 H new ATOM 0 HB3 PRO A 85 7.562 8.053 -5.706 1.00 0.00 H new ATOM 0 HG2 PRO A 85 5.560 7.303 -3.665 1.00 0.00 H new ATOM 0 HG3 PRO A 85 5.626 6.850 -5.357 1.00 0.00 H new ATOM 0 HD2 PRO A 85 6.335 5.212 -3.113 1.00 0.00 H new ATOM 0 HD3 PRO A 85 6.511 4.802 -4.807 1.00 0.00 H new ATOM 963 N GLU A 86 10.258 8.050 -2.548 1.00 0.00 N ATOM 964 CA GLU A 86 10.769 8.589 -1.300 1.00 0.00 C ATOM 965 C GLU A 86 9.688 9.411 -0.595 1.00 0.00 C ATOM 966 O GLU A 86 9.487 10.582 -0.914 1.00 0.00 O ATOM 967 CB GLU A 86 12.028 9.426 -1.536 1.00 0.00 C ATOM 968 CG GLU A 86 11.873 10.308 -2.776 1.00 0.00 C ATOM 969 CD GLU A 86 13.001 11.339 -2.859 1.00 0.00 C ATOM 970 OE1 GLU A 86 14.149 10.907 -3.098 1.00 0.00 O ATOM 971 OE2 GLU A 86 12.689 12.536 -2.680 1.00 0.00 O ATOM 0 H GLU A 86 10.947 7.984 -3.297 1.00 0.00 H new ATOM 0 HA GLU A 86 11.044 7.755 -0.654 1.00 0.00 H new ATOM 0 HB2 GLU A 86 12.224 10.049 -0.664 1.00 0.00 H new ATOM 0 HB3 GLU A 86 12.889 8.769 -1.658 1.00 0.00 H new ATOM 0 HG2 GLU A 86 11.877 9.687 -3.672 1.00 0.00 H new ATOM 0 HG3 GLU A 86 10.910 10.818 -2.746 1.00 0.00 H new ATOM 976 N TYR A 87 9.021 8.766 0.351 1.00 0.00 N ATOM 977 CA TYR A 87 7.966 9.424 1.104 1.00 0.00 C ATOM 978 C TYR A 87 7.285 8.445 2.062 1.00 0.00 C ATOM 979 O TYR A 87 6.076 8.520 2.277 1.00 0.00 O ATOM 980 CB TYR A 87 6.944 9.901 0.070 1.00 0.00 C ATOM 981 CG TYR A 87 6.388 11.298 0.344 1.00 0.00 C ATOM 982 CD1 TYR A 87 7.246 12.337 0.643 1.00 0.00 C ATOM 983 CD2 TYR A 87 5.026 11.520 0.294 1.00 0.00 C ATOM 984 CE1 TYR A 87 6.721 13.653 0.901 1.00 0.00 C ATOM 985 CE2 TYR A 87 4.501 12.836 0.552 1.00 0.00 C ATOM 986 CZ TYR A 87 5.375 13.837 0.843 1.00 0.00 C ATOM 987 OH TYR A 87 4.879 15.080 1.088 1.00 0.00 O ATOM 0 H TYR A 87 9.190 7.795 0.613 1.00 0.00 H new ATOM 0 HA TYR A 87 8.372 10.242 1.699 1.00 0.00 H new ATOM 0 HB2 TYR A 87 7.409 9.893 -0.916 1.00 0.00 H new ATOM 0 HB3 TYR A 87 6.117 9.192 0.038 1.00 0.00 H new ATOM 0 HD1 TYR A 87 8.311 12.163 0.683 1.00 0.00 H new ATOM 0 HD2 TYR A 87 4.354 10.707 0.061 1.00 0.00 H new ATOM 0 HE1 TYR A 87 7.381 14.475 1.135 1.00 0.00 H new ATOM 0 HE2 TYR A 87 3.438 13.024 0.515 1.00 0.00 H new ATOM 0 HH TYR A 87 3.902 15.063 1.011 1.00 0.00 H new ATOM 996 N PHE A 88 8.090 7.547 2.613 1.00 0.00 N ATOM 997 CA PHE A 88 7.580 6.554 3.543 1.00 0.00 C ATOM 998 C PHE A 88 8.322 6.624 4.879 1.00 0.00 C ATOM 999 O PHE A 88 7.704 6.795 5.929 1.00 0.00 O ATOM 1000 CB PHE A 88 7.820 5.183 2.910 1.00 0.00 C ATOM 1001 CG PHE A 88 8.657 5.227 1.630 1.00 0.00 C ATOM 1002 CD1 PHE A 88 8.049 5.401 0.425 1.00 0.00 C ATOM 1003 CD2 PHE A 88 10.009 5.091 1.696 1.00 0.00 C ATOM 1004 CE1 PHE A 88 8.827 5.441 -0.763 1.00 0.00 C ATOM 1005 CE2 PHE A 88 10.786 5.132 0.508 1.00 0.00 C ATOM 1006 CZ PHE A 88 10.178 5.306 -0.697 1.00 0.00 C ATOM 0 H PHE A 88 9.092 7.487 2.433 1.00 0.00 H new ATOM 0 HA PHE A 88 6.522 6.732 3.736 1.00 0.00 H new ATOM 0 HB2 PHE A 88 8.319 4.541 3.636 1.00 0.00 H new ATOM 0 HB3 PHE A 88 6.857 4.724 2.687 1.00 0.00 H new ATOM 0 HD1 PHE A 88 6.976 5.509 0.372 1.00 0.00 H new ATOM 0 HD2 PHE A 88 10.492 4.952 2.652 1.00 0.00 H new ATOM 0 HE1 PHE A 88 8.345 5.579 -1.719 1.00 0.00 H new ATOM 0 HE2 PHE A 88 11.859 5.025 0.561 1.00 0.00 H new ATOM 0 HZ PHE A 88 10.769 5.337 -1.601 1.00 0.00 H new ATOM 1015 N ASN A 89 9.637 6.487 4.797 1.00 0.00 N ATOM 1016 CA ASN A 89 10.470 6.531 5.987 1.00 0.00 C ATOM 1017 C ASN A 89 11.934 6.332 5.587 1.00 0.00 C ATOM 1018 O ASN A 89 12.693 5.680 6.302 1.00 0.00 O ATOM 1019 CB ASN A 89 10.092 5.418 6.966 1.00 0.00 C ATOM 1020 CG ASN A 89 10.557 4.053 6.451 1.00 0.00 C ATOM 1021 OD1 ASN A 89 11.037 3.213 7.192 1.00 0.00 O ATOM 1022 ND2 ASN A 89 10.388 3.883 5.143 1.00 0.00 N ATOM 0 H ASN A 89 10.147 6.345 3.925 1.00 0.00 H new ATOM 0 HA ASN A 89 10.322 7.498 6.467 1.00 0.00 H new ATOM 0 HB2 ASN A 89 10.542 5.616 7.939 1.00 0.00 H new ATOM 0 HB3 ASN A 89 9.012 5.407 7.111 1.00 0.00 H new ATOM 0 HD21 ASN A 89 10.667 3.007 4.702 1.00 0.00 H new ATOM 0 HD22 ASN A 89 9.979 4.629 4.580 1.00 0.00 H new ATOM 1028 N GLY A 90 12.286 6.908 4.448 1.00 0.00 N ATOM 1029 CA GLY A 90 13.645 6.803 3.945 1.00 0.00 C ATOM 1030 C GLY A 90 13.697 7.086 2.442 1.00 0.00 C ATOM 1031 O GLY A 90 13.331 6.233 1.633 1.00 0.00 O ATOM 0 H GLY A 90 11.654 7.449 3.858 1.00 0.00 H new ATOM 0 HA2 GLY A 90 14.288 7.507 4.474 1.00 0.00 H new ATOM 0 HA3 GLY A 90 14.034 5.805 4.144 1.00 0.00 H new ATOM 1035 N ILE A 91 14.154 8.285 2.113 1.00 0.00 N ATOM 1036 CA ILE A 91 14.259 8.690 0.722 1.00 0.00 C ATOM 1037 C ILE A 91 15.479 8.017 0.089 1.00 0.00 C ATOM 1038 O ILE A 91 16.549 7.969 0.694 1.00 0.00 O ATOM 1039 CB ILE A 91 14.269 10.215 0.607 1.00 0.00 C ATOM 1040 CG1 ILE A 91 15.620 10.789 1.042 1.00 0.00 C ATOM 1041 CG2 ILE A 91 13.106 10.832 1.388 1.00 0.00 C ATOM 1042 CD1 ILE A 91 15.933 12.084 0.291 1.00 0.00 C ATOM 0 H ILE A 91 14.456 8.989 2.786 1.00 0.00 H new ATOM 0 HA ILE A 91 13.385 8.357 0.162 1.00 0.00 H new ATOM 0 HB ILE A 91 14.129 10.479 -0.441 1.00 0.00 H new ATOM 0 HG12 ILE A 91 15.609 10.980 2.115 1.00 0.00 H new ATOM 0 HG13 ILE A 91 16.407 10.058 0.856 1.00 0.00 H new ATOM 0 HG21 ILE A 91 13.137 11.917 1.290 1.00 0.00 H new ATOM 0 HG22 ILE A 91 12.162 10.458 0.991 1.00 0.00 H new ATOM 0 HG23 ILE A 91 13.190 10.561 2.440 1.00 0.00 H new ATOM 0 HD11 ILE A 91 16.898 12.471 0.619 1.00 0.00 H new ATOM 0 HD12 ILE A 91 15.967 11.884 -0.780 1.00 0.00 H new ATOM 0 HD13 ILE A 91 15.157 12.821 0.498 1.00 0.00 H new ATOM 1053 N LYS A 92 15.278 7.516 -1.120 1.00 0.00 N ATOM 1054 CA LYS A 92 16.349 6.848 -1.842 1.00 0.00 C ATOM 1055 C LYS A 92 15.747 5.949 -2.922 1.00 0.00 C ATOM 1056 O LYS A 92 16.206 4.827 -3.128 1.00 0.00 O ATOM 1057 CB LYS A 92 17.270 6.109 -0.869 1.00 0.00 C ATOM 1058 CG LYS A 92 18.529 6.928 -0.575 1.00 0.00 C ATOM 1059 CD LYS A 92 19.682 6.506 -1.486 1.00 0.00 C ATOM 1060 CE LYS A 92 20.993 7.165 -1.052 1.00 0.00 C ATOM 1061 NZ LYS A 92 21.383 8.223 -2.011 1.00 0.00 N ATOM 0 H LYS A 92 14.389 7.559 -1.619 1.00 0.00 H new ATOM 0 HA LYS A 92 16.979 7.578 -2.350 1.00 0.00 H new ATOM 0 HB2 LYS A 92 16.737 5.909 0.060 1.00 0.00 H new ATOM 0 HB3 LYS A 92 17.550 5.144 -1.290 1.00 0.00 H new ATOM 0 HG2 LYS A 92 18.319 7.988 -0.716 1.00 0.00 H new ATOM 0 HG3 LYS A 92 18.818 6.796 0.468 1.00 0.00 H new ATOM 0 HD2 LYS A 92 19.791 5.422 -1.462 1.00 0.00 H new ATOM 0 HD3 LYS A 92 19.456 6.781 -2.516 1.00 0.00 H new ATOM 0 HE2 LYS A 92 20.880 7.593 -0.056 1.00 0.00 H new ATOM 0 HE3 LYS A 92 21.781 6.414 -0.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 22.275 8.660 -1.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 21.511 7.806 -2.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 20.638 8.947 -2.051 1.00 0.00 H new ATOM 1071 N TYR A 93 14.727 6.476 -3.585 1.00 0.00 N ATOM 1072 CA TYR A 93 14.057 5.735 -4.640 1.00 0.00 C ATOM 1073 C TYR A 93 14.878 5.755 -5.931 1.00 0.00 C ATOM 1074 O TYR A 93 14.365 6.112 -6.991 1.00 0.00 O ATOM 1075 CB TYR A 93 12.729 6.453 -4.883 1.00 0.00 C ATOM 1076 CG TYR A 93 12.852 7.719 -5.734 1.00 0.00 C ATOM 1077 CD1 TYR A 93 14.000 8.482 -5.673 1.00 0.00 C ATOM 1078 CD2 TYR A 93 11.815 8.095 -6.563 1.00 0.00 C ATOM 1079 CE1 TYR A 93 14.116 9.672 -6.475 1.00 0.00 C ATOM 1080 CE2 TYR A 93 11.931 9.286 -7.364 1.00 0.00 C ATOM 1081 CZ TYR A 93 13.076 10.016 -7.282 1.00 0.00 C ATOM 1082 OH TYR A 93 13.185 11.140 -8.039 1.00 0.00 O ATOM 0 H TYR A 93 14.349 7.407 -3.412 1.00 0.00 H new ATOM 0 HA TYR A 93 13.921 4.693 -4.350 1.00 0.00 H new ATOM 0 HB2 TYR A 93 12.040 5.765 -5.372 1.00 0.00 H new ATOM 0 HB3 TYR A 93 12.288 6.716 -3.921 1.00 0.00 H new ATOM 0 HD1 TYR A 93 14.811 8.187 -5.024 1.00 0.00 H new ATOM 0 HD2 TYR A 93 10.917 7.497 -6.611 1.00 0.00 H new ATOM 0 HE1 TYR A 93 15.009 10.278 -6.437 1.00 0.00 H new ATOM 0 HE2 TYR A 93 11.126 9.593 -8.016 1.00 0.00 H new ATOM 0 HH TYR A 93 12.367 11.260 -8.566 1.00 0.00 H new ATOM 1091 N ASN A 94 16.139 5.369 -5.800 1.00 0.00 N ATOM 1092 CA ASN A 94 17.035 5.339 -6.943 1.00 0.00 C ATOM 1093 C ASN A 94 17.523 3.906 -7.166 1.00 0.00 C ATOM 1094 O ASN A 94 17.135 3.259 -8.137 1.00 0.00 O ATOM 1095 CB ASN A 94 18.260 6.223 -6.705 1.00 0.00 C ATOM 1096 CG ASN A 94 17.876 7.704 -6.702 1.00 0.00 C ATOM 1097 OD1 ASN A 94 18.418 8.515 -7.435 1.00 0.00 O ATOM 1098 ND2 ASN A 94 16.911 8.010 -5.839 1.00 0.00 N ATOM 0 H ASN A 94 16.561 5.074 -4.919 1.00 0.00 H new ATOM 0 HA ASN A 94 16.487 5.707 -7.811 1.00 0.00 H new ATOM 0 HB2 ASN A 94 18.722 5.962 -5.753 1.00 0.00 H new ATOM 0 HB3 ASN A 94 19.003 6.038 -7.481 1.00 0.00 H new ATOM 0 HD21 ASN A 94 16.582 8.972 -5.762 1.00 0.00 H new ATOM 0 HD22 ASN A 94 16.500 7.282 -5.255 1.00 0.00 H new ATOM 1104 N THR A 95 18.366 3.452 -6.250 1.00 0.00 N ATOM 1105 CA THR A 95 18.911 2.108 -6.335 1.00 0.00 C ATOM 1106 C THR A 95 18.729 1.374 -5.005 1.00 0.00 C ATOM 1107 O THR A 95 19.706 1.008 -4.356 1.00 0.00 O ATOM 1108 CB THR A 95 20.373 2.217 -6.774 1.00 0.00 C ATOM 1109 OG1 THR A 95 20.910 3.241 -5.941 1.00 0.00 O ATOM 1110 CG2 THR A 95 20.520 2.774 -8.191 1.00 0.00 C ATOM 0 H THR A 95 18.685 3.991 -5.445 1.00 0.00 H new ATOM 0 HA THR A 95 18.378 1.511 -7.075 1.00 0.00 H new ATOM 0 HB THR A 95 20.842 1.234 -6.721 1.00 0.00 H new ATOM 0 HG1 THR A 95 21.856 3.376 -6.157 1.00 0.00 H new ATOM 0 HG21 THR A 95 21.577 2.830 -8.452 1.00 0.00 H new ATOM 0 HG22 THR A 95 20.007 2.118 -8.895 1.00 0.00 H new ATOM 0 HG23 THR A 95 20.081 3.771 -8.238 1.00 0.00 H new ATOM 1118 N THR A 96 17.469 1.183 -4.640 1.00 0.00 N ATOM 1119 CA THR A 96 17.147 0.499 -3.400 1.00 0.00 C ATOM 1120 C THR A 96 16.204 -0.677 -3.668 1.00 0.00 C ATOM 1121 O THR A 96 16.638 -1.826 -3.713 1.00 0.00 O ATOM 1122 CB THR A 96 16.569 1.530 -2.428 1.00 0.00 C ATOM 1123 OG1 THR A 96 15.784 2.385 -3.255 1.00 0.00 O ATOM 1124 CG2 THR A 96 17.642 2.454 -1.849 1.00 0.00 C ATOM 0 H THR A 96 16.661 1.490 -5.181 1.00 0.00 H new ATOM 0 HA THR A 96 18.038 0.065 -2.946 1.00 0.00 H new ATOM 0 HB THR A 96 16.056 1.015 -1.615 1.00 0.00 H new ATOM 0 HG1 THR A 96 15.675 3.255 -2.817 1.00 0.00 H new ATOM 0 HG21 THR A 96 17.179 3.166 -1.166 1.00 0.00 H new ATOM 0 HG22 THR A 96 18.380 1.861 -1.309 1.00 0.00 H new ATOM 0 HG23 THR A 96 18.132 2.994 -2.659 1.00 0.00 H new ATOM 1132 N ARG A 97 14.933 -0.348 -3.838 1.00 0.00 N ATOM 1133 CA ARG A 97 13.926 -1.362 -4.102 1.00 0.00 C ATOM 1134 C ARG A 97 12.654 -0.716 -4.656 1.00 0.00 C ATOM 1135 O ARG A 97 12.551 0.508 -4.718 1.00 0.00 O ATOM 1136 CB ARG A 97 13.582 -2.139 -2.829 1.00 0.00 C ATOM 1137 CG ARG A 97 14.218 -3.530 -2.848 1.00 0.00 C ATOM 1138 CD ARG A 97 13.622 -4.391 -3.963 1.00 0.00 C ATOM 1139 NE ARG A 97 14.205 -5.751 -3.919 1.00 0.00 N ATOM 1140 CZ ARG A 97 14.020 -6.678 -4.869 1.00 0.00 C ATOM 1141 NH1 ARG A 97 13.269 -6.398 -5.942 1.00 0.00 N ATOM 1142 NH2 ARG A 97 14.587 -7.886 -4.746 1.00 0.00 N ATOM 0 H ARG A 97 14.576 0.607 -3.798 1.00 0.00 H new ATOM 0 HA ARG A 97 14.336 -2.054 -4.838 1.00 0.00 H new ATOM 0 HB2 ARG A 97 13.931 -1.587 -1.956 1.00 0.00 H new ATOM 0 HB3 ARG A 97 12.500 -2.231 -2.736 1.00 0.00 H new ATOM 0 HG2 ARG A 97 15.295 -3.439 -2.990 1.00 0.00 H new ATOM 0 HG3 ARG A 97 14.063 -4.017 -1.885 1.00 0.00 H new ATOM 0 HD2 ARG A 97 12.539 -4.447 -3.851 1.00 0.00 H new ATOM 0 HD3 ARG A 97 13.819 -3.933 -4.932 1.00 0.00 H new ATOM 0 HE ARG A 97 14.783 -5.998 -3.116 1.00 0.00 H new ATOM 0 HH11 ARG A 97 12.837 -5.479 -6.037 1.00 0.00 H new ATOM 0 HH12 ARG A 97 13.129 -7.104 -6.665 1.00 0.00 H new ATOM 0 HH21 ARG A 97 15.159 -8.100 -3.929 1.00 0.00 H new ATOM 0 HH22 ARG A 97 14.446 -8.592 -5.469 1.00 0.00 H new ATOM 1153 N ASN A 98 11.718 -1.569 -5.046 1.00 0.00 N ATOM 1154 CA ASN A 98 10.457 -1.097 -5.594 1.00 0.00 C ATOM 1155 C ASN A 98 9.342 -2.068 -5.204 1.00 0.00 C ATOM 1156 O ASN A 98 9.602 -3.237 -4.922 1.00 0.00 O ATOM 1157 CB ASN A 98 10.512 -1.027 -7.121 1.00 0.00 C ATOM 1158 CG ASN A 98 11.090 -2.315 -7.708 1.00 0.00 C ATOM 1159 OD1 ASN A 98 11.791 -3.067 -7.052 1.00 0.00 O ATOM 1160 ND2 ASN A 98 10.757 -2.528 -8.978 1.00 0.00 N ATOM 0 H ASN A 98 11.807 -2.584 -4.994 1.00 0.00 H new ATOM 0 HA ASN A 98 10.267 -0.101 -5.195 1.00 0.00 H new ATOM 0 HB2 ASN A 98 9.510 -0.860 -7.517 1.00 0.00 H new ATOM 0 HB3 ASN A 98 11.122 -0.177 -7.428 1.00 0.00 H new ATOM 0 HD21 ASN A 98 11.093 -3.362 -9.460 1.00 0.00 H new ATOM 0 HD22 ASN A 98 10.166 -1.858 -9.470 1.00 0.00 H new ATOM 1166 N ALA A 99 8.122 -1.550 -5.202 1.00 0.00 N ATOM 1167 CA ALA A 99 6.966 -2.357 -4.851 1.00 0.00 C ATOM 1168 C ALA A 99 6.227 -2.763 -6.129 1.00 0.00 C ATOM 1169 O ALA A 99 6.473 -2.203 -7.196 1.00 0.00 O ATOM 1170 CB ALA A 99 6.073 -1.578 -3.884 1.00 0.00 C ATOM 0 H ALA A 99 7.909 -0.581 -5.438 1.00 0.00 H new ATOM 0 HA ALA A 99 7.275 -3.271 -4.344 1.00 0.00 H new ATOM 0 HB1 ALA A 99 5.206 -2.184 -3.621 1.00 0.00 H new ATOM 0 HB2 ALA A 99 6.636 -1.339 -2.982 1.00 0.00 H new ATOM 0 HB3 ALA A 99 5.740 -0.655 -4.359 1.00 0.00 H new ATOM 1176 N TYR A 100 5.337 -3.731 -5.977 1.00 0.00 N ATOM 1177 CA TYR A 100 4.561 -4.218 -7.105 1.00 0.00 C ATOM 1178 C TYR A 100 3.154 -4.630 -6.665 1.00 0.00 C ATOM 1179 O TYR A 100 2.996 -5.410 -5.727 1.00 0.00 O ATOM 1180 CB TYR A 100 5.301 -5.452 -7.625 1.00 0.00 C ATOM 1181 CG TYR A 100 6.813 -5.414 -7.394 1.00 0.00 C ATOM 1182 CD1 TYR A 100 7.316 -5.462 -6.109 1.00 0.00 C ATOM 1183 CD2 TYR A 100 7.674 -5.332 -8.469 1.00 0.00 C ATOM 1184 CE1 TYR A 100 8.739 -5.427 -5.891 1.00 0.00 C ATOM 1185 CE2 TYR A 100 9.097 -5.296 -8.251 1.00 0.00 C ATOM 1186 CZ TYR A 100 9.560 -5.345 -6.973 1.00 0.00 C ATOM 1187 OH TYR A 100 10.903 -5.311 -6.767 1.00 0.00 O ATOM 0 H TYR A 100 5.135 -4.192 -5.090 1.00 0.00 H new ATOM 0 HA TYR A 100 4.458 -3.442 -7.863 1.00 0.00 H new ATOM 0 HB2 TYR A 100 4.892 -6.339 -7.141 1.00 0.00 H new ATOM 0 HB3 TYR A 100 5.109 -5.555 -8.693 1.00 0.00 H new ATOM 0 HD1 TYR A 100 6.642 -5.526 -5.267 1.00 0.00 H new ATOM 0 HD2 TYR A 100 7.281 -5.295 -9.474 1.00 0.00 H new ATOM 0 HE1 TYR A 100 9.145 -5.465 -4.891 1.00 0.00 H new ATOM 0 HE2 TYR A 100 9.781 -5.232 -9.084 1.00 0.00 H new ATOM 0 HH TYR A 100 11.181 -4.392 -6.572 1.00 0.00 H new ATOM 1196 N ARG A 101 2.167 -4.088 -7.364 1.00 0.00 N ATOM 1197 CA ARG A 101 0.780 -4.389 -7.058 1.00 0.00 C ATOM 1198 C ARG A 101 0.041 -4.830 -8.324 1.00 0.00 C ATOM 1199 O ARG A 101 0.128 -4.172 -9.359 1.00 0.00 O ATOM 1200 CB ARG A 101 0.071 -3.172 -6.460 1.00 0.00 C ATOM 1201 CG ARG A 101 -0.933 -3.596 -5.385 1.00 0.00 C ATOM 1202 CD ARG A 101 -1.855 -2.435 -5.010 1.00 0.00 C ATOM 1203 NE ARG A 101 -2.979 -2.929 -4.183 1.00 0.00 N ATOM 1204 CZ ARG A 101 -3.978 -2.157 -3.734 1.00 0.00 C ATOM 1205 NH1 ARG A 101 -4.001 -0.850 -4.032 1.00 0.00 N ATOM 1206 NH2 ARG A 101 -4.956 -2.691 -2.989 1.00 0.00 N ATOM 0 H ARG A 101 2.301 -3.442 -8.142 1.00 0.00 H new ATOM 0 HA ARG A 101 0.770 -5.197 -6.326 1.00 0.00 H new ATOM 0 HB2 ARG A 101 0.807 -2.494 -6.028 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -0.445 -2.623 -7.248 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -1.527 -4.435 -5.747 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -0.399 -3.942 -4.500 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -1.295 -1.677 -4.462 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -2.238 -1.958 -5.912 1.00 0.00 H new ATOM 0 HE ARG A 101 -2.994 -3.919 -3.940 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -3.258 -0.443 -4.600 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -4.761 -0.262 -3.690 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -4.940 -3.686 -2.763 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -5.716 -2.103 -2.648 1.00 0.00 H new ATOM 1217 N GLU A 102 -0.671 -5.940 -8.198 1.00 0.00 N ATOM 1218 CA GLU A 102 -1.425 -6.476 -9.318 1.00 0.00 C ATOM 1219 C GLU A 102 -2.904 -6.107 -9.188 1.00 0.00 C ATOM 1220 O GLU A 102 -3.417 -5.967 -8.079 1.00 0.00 O ATOM 1221 CB GLU A 102 -1.246 -7.991 -9.425 1.00 0.00 C ATOM 1222 CG GLU A 102 0.230 -8.358 -9.603 1.00 0.00 C ATOM 1223 CD GLU A 102 0.462 -9.845 -9.326 1.00 0.00 C ATOM 1224 OE1 GLU A 102 0.047 -10.653 -10.184 1.00 0.00 O ATOM 1225 OE2 GLU A 102 1.051 -10.138 -8.263 1.00 0.00 O ATOM 0 H GLU A 102 -0.742 -6.483 -7.337 1.00 0.00 H new ATOM 0 HA GLU A 102 -1.039 -6.032 -10.236 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -1.638 -8.471 -8.529 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -1.823 -8.370 -10.268 1.00 0.00 H new ATOM 0 HG2 GLU A 102 0.548 -8.119 -10.618 1.00 0.00 H new ATOM 0 HG3 GLU A 102 0.841 -7.759 -8.928 1.00 0.00 H new ATOM 1230 N CYS A 103 -3.547 -5.960 -10.338 1.00 0.00 N ATOM 1231 CA CYS A 103 -4.958 -5.609 -10.366 1.00 0.00 C ATOM 1232 C CYS A 103 -5.758 -6.865 -10.719 1.00 0.00 C ATOM 1233 O CYS A 103 -5.385 -7.608 -11.625 1.00 0.00 O ATOM 1234 CB CYS A 103 -5.236 -4.462 -11.339 1.00 0.00 C ATOM 1235 SG CYS A 103 -5.479 -2.829 -10.552 1.00 0.00 S ATOM 0 H CYS A 103 -3.118 -6.077 -11.256 1.00 0.00 H new ATOM 0 HA CYS A 103 -5.266 -5.248 -9.385 1.00 0.00 H new ATOM 0 HB2 CYS A 103 -4.406 -4.391 -12.041 1.00 0.00 H new ATOM 0 HB3 CYS A 103 -6.125 -4.705 -11.920 1.00 0.00 H new ATOM 1239 N LEU A 104 -6.843 -7.062 -9.985 1.00 0.00 N ATOM 1240 CA LEU A 104 -7.698 -8.214 -10.210 1.00 0.00 C ATOM 1241 C LEU A 104 -8.728 -7.877 -11.290 1.00 0.00 C ATOM 1242 O LEU A 104 -9.102 -6.717 -11.456 1.00 0.00 O ATOM 1243 CB LEU A 104 -8.320 -8.685 -8.893 1.00 0.00 C ATOM 1244 CG LEU A 104 -8.102 -10.157 -8.535 1.00 0.00 C ATOM 1245 CD1 LEU A 104 -6.622 -10.442 -8.267 1.00 0.00 C ATOM 1246 CD2 LEU A 104 -8.988 -10.573 -7.360 1.00 0.00 C ATOM 0 H LEU A 104 -7.149 -6.443 -9.234 1.00 0.00 H new ATOM 0 HA LEU A 104 -7.113 -9.056 -10.579 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -7.919 -8.072 -8.086 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -9.393 -8.497 -8.933 1.00 0.00 H new ATOM 0 HG LEU A 104 -8.397 -10.764 -9.391 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -6.494 -11.495 -8.015 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -6.039 -10.209 -9.158 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -6.277 -9.826 -7.437 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -8.813 -11.623 -7.126 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -8.748 -9.963 -6.489 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -10.035 -10.430 -7.626 1.00 0.00 H new ATOM 1257 N GLU A 105 -9.157 -8.913 -11.996 1.00 0.00 N ATOM 1258 CA GLU A 105 -10.137 -8.742 -13.055 1.00 0.00 C ATOM 1259 C GLU A 105 -11.526 -8.503 -12.461 1.00 0.00 C ATOM 1260 O GLU A 105 -12.498 -8.332 -13.195 1.00 0.00 O ATOM 1261 CB GLU A 105 -10.142 -9.947 -13.997 1.00 0.00 C ATOM 1262 CG GLU A 105 -10.435 -11.239 -13.232 1.00 0.00 C ATOM 1263 CD GLU A 105 -9.470 -12.351 -13.645 1.00 0.00 C ATOM 1264 OE1 GLU A 105 -8.387 -12.422 -13.025 1.00 0.00 O ATOM 1265 OE2 GLU A 105 -9.836 -13.106 -14.572 1.00 0.00 O ATOM 0 H GLU A 105 -8.844 -9.874 -11.855 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.860 -7.866 -13.641 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -10.892 -9.802 -14.774 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -9.176 -10.027 -14.497 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -10.350 -11.059 -12.160 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -11.461 -11.554 -13.422 1.00 0.00 H new ATOM 1270 N ASN A 106 -11.576 -8.500 -11.137 1.00 0.00 N ATOM 1271 CA ASN A 106 -12.831 -8.286 -10.436 1.00 0.00 C ATOM 1272 C ASN A 106 -13.125 -6.785 -10.372 1.00 0.00 C ATOM 1273 O ASN A 106 -14.216 -6.380 -9.975 1.00 0.00 O ATOM 1274 CB ASN A 106 -12.757 -8.814 -9.001 1.00 0.00 C ATOM 1275 CG ASN A 106 -13.837 -9.868 -8.750 1.00 0.00 C ATOM 1276 OD1 ASN A 106 -13.609 -10.890 -8.124 1.00 0.00 O ATOM 1277 ND2 ASN A 106 -15.022 -9.562 -9.269 1.00 0.00 N ATOM 0 H ASN A 106 -10.768 -8.642 -10.531 1.00 0.00 H new ATOM 0 HA ASN A 106 -13.614 -8.817 -10.977 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -11.773 -9.246 -8.818 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -12.878 -7.989 -8.299 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -15.809 -10.200 -9.154 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -15.144 -8.689 -9.782 1.00 0.00 H new ATOM 1283 N GLY A 107 -12.132 -6.004 -10.770 1.00 0.00 N ATOM 1284 CA GLY A 107 -12.271 -4.557 -10.762 1.00 0.00 C ATOM 1285 C GLY A 107 -11.569 -3.945 -9.549 1.00 0.00 C ATOM 1286 O GLY A 107 -11.713 -2.753 -9.280 1.00 0.00 O ATOM 0 H GLY A 107 -11.229 -6.345 -11.100 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -11.849 -4.143 -11.678 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -13.328 -4.290 -10.748 1.00 0.00 H new ATOM 1290 N THR A 108 -10.824 -4.787 -8.849 1.00 0.00 N ATOM 1291 CA THR A 108 -10.099 -4.343 -7.670 1.00 0.00 C ATOM 1292 C THR A 108 -8.674 -4.901 -7.678 1.00 0.00 C ATOM 1293 O THR A 108 -8.323 -5.704 -8.542 1.00 0.00 O ATOM 1294 CB THR A 108 -10.905 -4.754 -6.436 1.00 0.00 C ATOM 1295 OG1 THR A 108 -9.934 -5.317 -5.559 1.00 0.00 O ATOM 1296 CG2 THR A 108 -11.863 -5.913 -6.723 1.00 0.00 C ATOM 0 H THR A 108 -10.706 -5.775 -9.075 1.00 0.00 H new ATOM 0 HA THR A 108 -9.990 -3.259 -7.659 1.00 0.00 H new ATOM 0 HB THR A 108 -11.470 -3.897 -6.069 1.00 0.00 H new ATOM 0 HG1 THR A 108 -10.371 -5.609 -4.732 1.00 0.00 H new ATOM 0 HG21 THR A 108 -12.411 -6.166 -5.815 1.00 0.00 H new ATOM 0 HG22 THR A 108 -12.567 -5.619 -7.501 1.00 0.00 H new ATOM 0 HG23 THR A 108 -11.294 -6.781 -7.057 1.00 0.00 H new ATOM 1304 N TRP A 109 -7.893 -4.454 -6.707 1.00 0.00 N ATOM 1305 CA TRP A 109 -6.514 -4.898 -6.592 1.00 0.00 C ATOM 1306 C TRP A 109 -6.519 -6.304 -5.986 1.00 0.00 C ATOM 1307 O TRP A 109 -7.551 -6.972 -5.971 1.00 0.00 O ATOM 1308 CB TRP A 109 -5.683 -3.901 -5.782 1.00 0.00 C ATOM 1309 CG TRP A 109 -5.722 -2.472 -6.325 1.00 0.00 C ATOM 1310 CD1 TRP A 109 -6.642 -1.526 -6.091 1.00 0.00 C ATOM 1311 CD2 TRP A 109 -4.759 -1.859 -7.209 1.00 0.00 C ATOM 1312 NE1 TRP A 109 -6.344 -0.354 -6.756 1.00 0.00 N ATOM 1313 CE2 TRP A 109 -5.162 -0.564 -7.458 1.00 0.00 C ATOM 1314 CE3 TRP A 109 -3.586 -2.385 -7.779 1.00 0.00 C ATOM 1315 CZ2 TRP A 109 -4.449 0.316 -8.282 1.00 0.00 C ATOM 1316 CZ3 TRP A 109 -2.885 -1.493 -8.600 1.00 0.00 C ATOM 1317 CH2 TRP A 109 -3.277 -0.185 -8.861 1.00 0.00 C ATOM 0 H TRP A 109 -8.188 -3.789 -5.992 1.00 0.00 H new ATOM 0 HA TRP A 109 -6.040 -4.943 -7.573 1.00 0.00 H new ATOM 0 HB2 TRP A 109 -6.041 -3.897 -4.752 1.00 0.00 H new ATOM 0 HB3 TRP A 109 -4.648 -4.241 -5.758 1.00 0.00 H new ATOM 0 HD1 TRP A 109 -7.508 -1.664 -5.461 1.00 0.00 H new ATOM 0 HE1 TRP A 109 -6.890 0.507 -6.736 1.00 0.00 H new ATOM 0 HE3 TRP A 109 -3.252 -3.396 -7.598 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 -4.785 1.327 -8.461 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 -1.976 -1.846 -9.063 1.00 0.00 H new ATOM 0 HH2 TRP A 109 -2.680 0.442 -9.507 1.00 0.00 H new ATOM 1327 N ALA A 110 -5.354 -6.709 -5.502 1.00 0.00 N ATOM 1328 CA ALA A 110 -5.211 -8.022 -4.897 1.00 0.00 C ATOM 1329 C ALA A 110 -5.451 -7.913 -3.390 1.00 0.00 C ATOM 1330 O ALA A 110 -6.584 -7.723 -2.950 1.00 0.00 O ATOM 1331 CB ALA A 110 -3.830 -8.590 -5.229 1.00 0.00 C ATOM 0 H ALA A 110 -4.500 -6.151 -5.517 1.00 0.00 H new ATOM 0 HA ALA A 110 -5.952 -8.713 -5.299 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -3.723 -9.575 -4.775 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -3.722 -8.675 -6.310 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -3.060 -7.925 -4.839 1.00 0.00 H new ATOM 1337 N SER A 111 -4.366 -8.038 -2.640 1.00 0.00 N ATOM 1338 CA SER A 111 -4.443 -7.955 -1.192 1.00 0.00 C ATOM 1339 C SER A 111 -3.571 -6.805 -0.685 1.00 0.00 C ATOM 1340 O SER A 111 -3.947 -6.101 0.251 1.00 0.00 O ATOM 1341 CB SER A 111 -4.015 -9.272 -0.541 1.00 0.00 C ATOM 1342 OG SER A 111 -5.000 -9.767 0.361 1.00 0.00 O ATOM 0 H SER A 111 -3.428 -8.196 -3.009 1.00 0.00 H new ATOM 0 HA SER A 111 -5.480 -7.764 -0.916 1.00 0.00 H new ATOM 0 HB2 SER A 111 -3.827 -10.015 -1.316 1.00 0.00 H new ATOM 0 HB3 SER A 111 -3.076 -9.124 -0.007 1.00 0.00 H new ATOM 0 HG SER A 111 -4.690 -10.609 0.754 1.00 0.00 H new ATOM 1347 N ARG A 112 -2.422 -6.649 -1.326 1.00 0.00 N ATOM 1348 CA ARG A 112 -1.493 -5.597 -0.953 1.00 0.00 C ATOM 1349 C ARG A 112 -0.265 -5.624 -1.865 1.00 0.00 C ATOM 1350 O ARG A 112 0.064 -6.661 -2.439 1.00 0.00 O ATOM 1351 CB ARG A 112 -1.042 -5.750 0.502 1.00 0.00 C ATOM 1352 CG ARG A 112 -0.368 -7.105 0.726 1.00 0.00 C ATOM 1353 CD ARG A 112 -0.284 -7.435 2.218 1.00 0.00 C ATOM 1354 NE ARG A 112 0.456 -8.701 2.416 1.00 0.00 N ATOM 1355 CZ ARG A 112 -0.051 -9.915 2.163 1.00 0.00 C ATOM 1356 NH1 ARG A 112 -1.304 -10.035 1.700 1.00 0.00 N ATOM 1357 NH2 ARG A 112 0.693 -11.009 2.371 1.00 0.00 N ATOM 0 H ARG A 112 -2.113 -7.235 -2.102 1.00 0.00 H new ATOM 0 HA ARG A 112 -2.011 -4.644 -1.063 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -0.349 -4.948 0.758 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -1.901 -5.653 1.165 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -0.928 -7.884 0.208 1.00 0.00 H new ATOM 0 HG3 ARG A 112 0.633 -7.093 0.296 1.00 0.00 H new ATOM 0 HD2 ARG A 112 0.215 -6.625 2.750 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -1.287 -7.521 2.637 1.00 0.00 H new ATOM 0 HE ARG A 112 1.412 -8.646 2.767 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -1.871 -9.202 1.541 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -1.690 -10.959 1.507 1.00 0.00 H new ATOM 0 HH21 ARG A 112 1.646 -10.918 2.722 1.00 0.00 H new ATOM 0 HH22 ARG A 112 0.306 -11.933 2.178 1.00 0.00 H new ATOM 1368 N VAL A 113 0.379 -4.470 -1.971 1.00 0.00 N ATOM 1369 CA VAL A 113 1.563 -4.349 -2.804 1.00 0.00 C ATOM 1370 C VAL A 113 2.677 -5.230 -2.233 1.00 0.00 C ATOM 1371 O VAL A 113 2.762 -5.420 -1.020 1.00 0.00 O ATOM 1372 CB VAL A 113 1.968 -2.878 -2.926 1.00 0.00 C ATOM 1373 CG1 VAL A 113 2.980 -2.680 -4.057 1.00 0.00 C ATOM 1374 CG2 VAL A 113 0.741 -1.986 -3.126 1.00 0.00 C ATOM 0 H VAL A 113 0.103 -3.612 -1.494 1.00 0.00 H new ATOM 0 HA VAL A 113 1.356 -4.701 -3.815 1.00 0.00 H new ATOM 0 HB VAL A 113 2.447 -2.584 -1.992 1.00 0.00 H new ATOM 0 HG11 VAL A 113 3.251 -1.626 -4.122 1.00 0.00 H new ATOM 0 HG12 VAL A 113 3.872 -3.272 -3.855 1.00 0.00 H new ATOM 0 HG13 VAL A 113 2.538 -3.000 -5.001 1.00 0.00 H new ATOM 0 HG21 VAL A 113 1.057 -0.946 -3.210 1.00 0.00 H new ATOM 0 HG22 VAL A 113 0.221 -2.282 -4.037 1.00 0.00 H new ATOM 0 HG23 VAL A 113 0.070 -2.094 -2.274 1.00 0.00 H new ATOM 1384 N ASN A 114 3.501 -5.744 -3.133 1.00 0.00 N ATOM 1385 CA ASN A 114 4.605 -6.600 -2.734 1.00 0.00 C ATOM 1386 C ASN A 114 5.829 -5.736 -2.422 1.00 0.00 C ATOM 1387 O ASN A 114 6.200 -4.870 -3.213 1.00 0.00 O ATOM 1388 CB ASN A 114 4.985 -7.570 -3.855 1.00 0.00 C ATOM 1389 CG ASN A 114 3.781 -7.868 -4.751 1.00 0.00 C ATOM 1390 OD1 ASN A 114 2.637 -7.825 -4.332 1.00 0.00 O ATOM 1391 ND2 ASN A 114 4.103 -8.175 -6.005 1.00 0.00 N ATOM 0 H ASN A 114 3.427 -5.584 -4.138 1.00 0.00 H new ATOM 0 HA ASN A 114 4.291 -7.167 -1.858 1.00 0.00 H new ATOM 0 HB2 ASN A 114 5.791 -7.144 -4.452 1.00 0.00 H new ATOM 0 HB3 ASN A 114 5.362 -8.498 -3.426 1.00 0.00 H new ATOM 0 HD21 ASN A 114 3.371 -8.393 -6.681 1.00 0.00 H new ATOM 0 HD22 ASN A 114 5.082 -8.193 -6.290 1.00 0.00 H new ATOM 1397 N TYR A 115 6.421 -5.999 -1.267 1.00 0.00 N ATOM 1398 CA TYR A 115 7.595 -5.257 -0.841 1.00 0.00 C ATOM 1399 C TYR A 115 8.752 -6.202 -0.510 1.00 0.00 C ATOM 1400 O TYR A 115 9.161 -6.307 0.645 1.00 0.00 O ATOM 1401 CB TYR A 115 7.183 -4.510 0.429 1.00 0.00 C ATOM 1402 CG TYR A 115 5.769 -3.926 0.377 1.00 0.00 C ATOM 1403 CD1 TYR A 115 5.504 -2.831 -0.421 1.00 0.00 C ATOM 1404 CD2 TYR A 115 4.760 -4.494 1.127 1.00 0.00 C ATOM 1405 CE1 TYR A 115 4.174 -2.283 -0.470 1.00 0.00 C ATOM 1406 CE2 TYR A 115 3.430 -3.945 1.078 1.00 0.00 C ATOM 1407 CZ TYR A 115 3.203 -2.865 0.282 1.00 0.00 C ATOM 1408 OH TYR A 115 1.946 -2.347 0.235 1.00 0.00 O ATOM 0 H TYR A 115 6.109 -6.716 -0.612 1.00 0.00 H new ATOM 0 HA TYR A 115 7.932 -4.586 -1.631 1.00 0.00 H new ATOM 0 HB2 TYR A 115 7.253 -5.191 1.277 1.00 0.00 H new ATOM 0 HB3 TYR A 115 7.892 -3.702 0.609 1.00 0.00 H new ATOM 0 HD1 TYR A 115 6.294 -2.386 -1.008 1.00 0.00 H new ATOM 0 HD2 TYR A 115 4.968 -5.351 1.751 1.00 0.00 H new ATOM 0 HE1 TYR A 115 3.952 -1.428 -1.091 1.00 0.00 H new ATOM 0 HE2 TYR A 115 2.631 -4.380 1.660 1.00 0.00 H new ATOM 0 HH TYR A 115 1.357 -2.865 0.822 1.00 0.00 H new ATOM 1417 N SER A 116 9.246 -6.866 -1.544 1.00 0.00 N ATOM 1418 CA SER A 116 10.347 -7.799 -1.378 1.00 0.00 C ATOM 1419 C SER A 116 11.341 -7.257 -0.347 1.00 0.00 C ATOM 1420 O SER A 116 11.693 -7.951 0.605 1.00 0.00 O ATOM 1421 CB SER A 116 11.054 -8.061 -2.709 1.00 0.00 C ATOM 1422 OG SER A 116 10.141 -8.462 -3.727 1.00 0.00 O ATOM 0 H SER A 116 8.904 -6.776 -2.501 1.00 0.00 H new ATOM 0 HA SER A 116 9.941 -8.746 -1.021 1.00 0.00 H new ATOM 0 HB2 SER A 116 11.577 -7.159 -3.026 1.00 0.00 H new ATOM 0 HB3 SER A 116 11.809 -8.836 -2.573 1.00 0.00 H new ATOM 0 HG SER A 116 10.630 -8.618 -4.562 1.00 0.00 H new ATOM 1427 N HIS A 117 11.764 -6.023 -0.573 1.00 0.00 N ATOM 1428 CA HIS A 117 12.710 -5.379 0.324 1.00 0.00 C ATOM 1429 C HIS A 117 12.680 -3.866 0.101 1.00 0.00 C ATOM 1430 O HIS A 117 13.720 -3.210 0.132 1.00 0.00 O ATOM 1431 CB HIS A 117 14.108 -5.976 0.156 1.00 0.00 C ATOM 1432 CG HIS A 117 14.112 -7.419 -0.290 1.00 0.00 C ATOM 1433 ND1 HIS A 117 14.365 -8.469 0.574 1.00 0.00 N ATOM 1434 CD2 HIS A 117 13.890 -7.974 -1.516 1.00 0.00 C ATOM 1435 CE1 HIS A 117 14.296 -9.601 -0.112 1.00 0.00 C ATOM 1436 NE2 HIS A 117 14.002 -9.291 -1.407 1.00 0.00 N ATOM 0 H HIS A 117 11.470 -5.451 -1.364 1.00 0.00 H new ATOM 0 HA HIS A 117 12.421 -5.564 1.359 1.00 0.00 H new ATOM 0 HB2 HIS A 117 14.661 -5.381 -0.571 1.00 0.00 H new ATOM 0 HB3 HIS A 117 14.641 -5.898 1.104 1.00 0.00 H new ATOM 0 HD2 HIS A 117 13.662 -7.433 -2.422 1.00 0.00 H new ATOM 0 HE1 HIS A 117 14.446 -10.594 0.285 1.00 0.00 H new ATOM 0 HE2 HIS A 117 13.887 -9.962 -2.167 1.00 0.00 H new ATOM 1443 N CYS A 118 11.477 -3.356 -0.117 1.00 0.00 N ATOM 1444 CA CYS A 118 11.298 -1.931 -0.345 1.00 0.00 C ATOM 1445 C CYS A 118 10.963 -1.270 0.993 1.00 0.00 C ATOM 1446 O CYS A 118 11.574 -0.268 1.364 1.00 0.00 O ATOM 1447 CB CYS A 118 10.226 -1.658 -1.401 1.00 0.00 C ATOM 1448 SG CYS A 118 10.350 -0.023 -2.215 1.00 0.00 S ATOM 0 H CYS A 118 10.617 -3.903 -0.141 1.00 0.00 H new ATOM 0 HA CYS A 118 12.220 -1.504 -0.740 1.00 0.00 H new ATOM 0 HB2 CYS A 118 10.282 -2.434 -2.165 1.00 0.00 H new ATOM 0 HB3 CYS A 118 9.245 -1.742 -0.933 1.00 0.00 H new ATOM 1452 N GLU A 119 9.995 -1.857 1.682 1.00 0.00 N ATOM 1453 CA GLU A 119 9.572 -1.336 2.970 1.00 0.00 C ATOM 1454 C GLU A 119 10.754 -1.296 3.941 1.00 0.00 C ATOM 1455 O GLU A 119 11.029 -0.261 4.547 1.00 0.00 O ATOM 1456 CB GLU A 119 8.420 -2.164 3.544 1.00 0.00 C ATOM 1457 CG GLU A 119 7.257 -1.265 3.969 1.00 0.00 C ATOM 1458 CD GLU A 119 7.383 -0.864 5.441 1.00 0.00 C ATOM 1459 OE1 GLU A 119 7.474 -1.790 6.275 1.00 0.00 O ATOM 1460 OE2 GLU A 119 7.384 0.360 5.696 1.00 0.00 O ATOM 0 H GLU A 119 9.492 -2.688 1.372 1.00 0.00 H new ATOM 0 HA GLU A 119 9.210 -0.318 2.827 1.00 0.00 H new ATOM 0 HB2 GLU A 119 8.076 -2.881 2.799 1.00 0.00 H new ATOM 0 HB3 GLU A 119 8.772 -2.739 4.401 1.00 0.00 H new ATOM 0 HG2 GLU A 119 7.237 -0.371 3.345 1.00 0.00 H new ATOM 0 HG3 GLU A 119 6.313 -1.786 3.810 1.00 0.00 H new ATOM 1465 N PRO A 120 11.440 -2.464 4.060 1.00 0.00 N ATOM 1466 CA PRO A 120 12.587 -2.571 4.946 1.00 0.00 C ATOM 1467 C PRO A 120 13.810 -1.875 4.347 1.00 0.00 C ATOM 1468 O PRO A 120 14.829 -2.514 4.090 1.00 0.00 O ATOM 1469 CB PRO A 120 12.792 -4.065 5.145 1.00 0.00 C ATOM 1470 CG PRO A 120 12.052 -4.743 4.003 1.00 0.00 C ATOM 1471 CD PRO A 120 11.143 -3.709 3.358 1.00 0.00 C ATOM 0 HA PRO A 120 12.427 -2.073 5.902 1.00 0.00 H new ATOM 0 HB2 PRO A 120 13.852 -4.319 5.129 1.00 0.00 H new ATOM 0 HB3 PRO A 120 12.401 -4.388 6.110 1.00 0.00 H new ATOM 0 HG2 PRO A 120 12.758 -5.139 3.273 1.00 0.00 H new ATOM 0 HG3 PRO A 120 11.469 -5.586 4.373 1.00 0.00 H new ATOM 0 HD2 PRO A 120 11.342 -3.618 2.290 1.00 0.00 H new ATOM 0 HD3 PRO A 120 10.093 -3.983 3.465 1.00 0.00 H new ATOM 1476 N ILE A 121 13.668 -0.574 4.142 1.00 0.00 N ATOM 1477 CA ILE A 121 14.749 0.217 3.577 1.00 0.00 C ATOM 1478 C ILE A 121 15.755 0.557 4.679 1.00 0.00 C ATOM 1479 O ILE A 121 15.432 0.488 5.863 1.00 0.00 O ATOM 1480 CB ILE A 121 14.194 1.444 2.852 1.00 0.00 C ATOM 1481 CG1 ILE A 121 15.222 2.016 1.874 1.00 0.00 C ATOM 1482 CG2 ILE A 121 13.704 2.495 3.849 1.00 0.00 C ATOM 1483 CD1 ILE A 121 14.540 2.566 0.621 1.00 0.00 C ATOM 0 H ILE A 121 12.821 -0.047 4.357 1.00 0.00 H new ATOM 0 HA ILE A 121 15.285 -0.356 2.820 1.00 0.00 H new ATOM 0 HB ILE A 121 13.331 1.131 2.264 1.00 0.00 H new ATOM 0 HG12 ILE A 121 15.790 2.809 2.361 1.00 0.00 H new ATOM 0 HG13 ILE A 121 15.934 1.240 1.594 1.00 0.00 H new ATOM 0 HG21 ILE A 121 13.314 3.357 3.307 1.00 0.00 H new ATOM 0 HG22 ILE A 121 12.915 2.069 4.468 1.00 0.00 H new ATOM 0 HG23 ILE A 121 14.533 2.809 4.483 1.00 0.00 H new ATOM 0 HD11 ILE A 121 15.293 2.966 -0.057 1.00 0.00 H new ATOM 0 HD12 ILE A 121 13.993 1.765 0.124 1.00 0.00 H new ATOM 0 HD13 ILE A 121 13.847 3.359 0.902 1.00 0.00 H new ATOM 1494 N LEU A 122 16.956 0.918 4.248 1.00 0.00 N ATOM 1495 CA LEU A 122 18.011 1.269 5.183 1.00 0.00 C ATOM 1496 C LEU A 122 18.350 2.753 5.030 1.00 0.00 C ATOM 1497 O LEU A 122 18.412 3.267 3.913 1.00 0.00 O ATOM 1498 CB LEU A 122 19.216 0.342 5.005 1.00 0.00 C ATOM 1499 CG LEU A 122 20.187 0.713 3.883 1.00 0.00 C ATOM 1500 CD1 LEU A 122 21.606 0.891 4.425 1.00 0.00 C ATOM 1501 CD2 LEU A 122 20.131 -0.312 2.749 1.00 0.00 C ATOM 0 H LEU A 122 17.221 0.975 3.265 1.00 0.00 H new ATOM 0 HA LEU A 122 17.674 1.122 6.209 1.00 0.00 H new ATOM 0 HB2 LEU A 122 19.770 0.314 5.943 1.00 0.00 H new ATOM 0 HB3 LEU A 122 18.849 -0.668 4.822 1.00 0.00 H new ATOM 0 HG LEU A 122 19.878 1.672 3.466 1.00 0.00 H new ATOM 0 HD11 LEU A 122 22.277 1.154 3.608 1.00 0.00 H new ATOM 0 HD12 LEU A 122 21.613 1.686 5.171 1.00 0.00 H new ATOM 0 HD13 LEU A 122 21.940 -0.040 4.883 1.00 0.00 H new ATOM 0 HD21 LEU A 122 20.831 -0.025 1.964 1.00 0.00 H new ATOM 0 HD22 LEU A 122 20.401 -1.295 3.134 1.00 0.00 H new ATOM 0 HD23 LEU A 122 19.121 -0.347 2.340 1.00 0.00 H new ATOM 1512 N ASP A 123 18.559 3.400 6.166 1.00 0.00 N ATOM 1513 CA ASP A 123 18.890 4.816 6.171 1.00 0.00 C ATOM 1514 C ASP A 123 19.141 5.270 7.611 1.00 0.00 C ATOM 1515 O ASP A 123 18.208 5.649 8.317 1.00 0.00 O ATOM 1516 CB ASP A 123 17.742 5.652 5.605 1.00 0.00 C ATOM 1517 CG ASP A 123 16.378 5.401 6.253 1.00 0.00 C ATOM 1518 OD1 ASP A 123 16.012 4.212 6.364 1.00 0.00 O ATOM 1519 OD2 ASP A 123 15.733 6.406 6.622 1.00 0.00 O ATOM 0 H ASP A 123 18.506 2.971 7.090 1.00 0.00 H new ATOM 0 HA ASP A 123 19.777 4.958 5.553 1.00 0.00 H new ATOM 0 HB2 ASP A 123 17.992 6.707 5.716 1.00 0.00 H new ATOM 0 HB3 ASP A 123 17.661 5.455 4.536 1.00 0.00 H new ATOM 1523 N ASP A 124 20.406 5.218 8.003 1.00 0.00 N ATOM 1524 CA ASP A 124 20.791 5.621 9.344 1.00 0.00 C ATOM 1525 C ASP A 124 22.316 5.704 9.429 1.00 0.00 C ATOM 1526 O ASP A 124 22.981 4.710 9.716 1.00 0.00 O ATOM 1527 CB ASP A 124 20.315 4.601 10.383 1.00 0.00 C ATOM 1528 CG ASP A 124 20.042 5.176 11.774 1.00 0.00 C ATOM 1529 OD1 ASP A 124 20.947 5.866 12.291 1.00 0.00 O ATOM 1530 OD2 ASP A 124 18.934 4.913 12.290 1.00 0.00 O ATOM 0 H ASP A 124 21.177 4.903 7.415 1.00 0.00 H new ATOM 0 HA ASP A 124 20.333 6.588 9.550 1.00 0.00 H new ATOM 0 HB2 ASP A 124 19.404 4.129 10.016 1.00 0.00 H new ATOM 0 HB3 ASP A 124 21.067 3.817 10.471 1.00 0.00 H new ATOM 1534 N LYS A 125 22.826 6.900 9.175 1.00 0.00 N ATOM 1535 CA LYS A 125 24.260 7.127 9.219 1.00 0.00 C ATOM 1536 C LYS A 125 24.534 8.536 9.746 1.00 0.00 C ATOM 1537 O LYS A 125 25.125 9.360 9.050 1.00 0.00 O ATOM 1538 CB LYS A 125 24.889 6.850 7.852 1.00 0.00 C ATOM 1539 CG LYS A 125 26.416 6.852 7.939 1.00 0.00 C ATOM 1540 CD LYS A 125 26.988 5.477 7.592 1.00 0.00 C ATOM 1541 CE LYS A 125 28.518 5.504 7.587 1.00 0.00 C ATOM 1542 NZ LYS A 125 29.043 4.823 6.382 1.00 0.00 N ATOM 0 H LYS A 125 22.271 7.722 8.938 1.00 0.00 H new ATOM 0 HA LYS A 125 24.734 6.430 9.910 1.00 0.00 H new ATOM 0 HB2 LYS A 125 24.544 5.886 7.478 1.00 0.00 H new ATOM 0 HB3 LYS A 125 24.561 7.605 7.137 1.00 0.00 H new ATOM 0 HG2 LYS A 125 26.821 7.600 7.258 1.00 0.00 H new ATOM 0 HG3 LYS A 125 26.726 7.135 8.945 1.00 0.00 H new ATOM 0 HD2 LYS A 125 26.636 4.740 8.314 1.00 0.00 H new ATOM 0 HD3 LYS A 125 26.623 5.164 6.614 1.00 0.00 H new ATOM 0 HE2 LYS A 125 28.870 6.535 7.612 1.00 0.00 H new ATOM 0 HE3 LYS A 125 28.899 5.016 8.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 30.083 4.850 6.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 28.722 3.834 6.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 28.694 5.306 5.530 1.00 0.00 H new ATOM 1552 N GLN A 126 24.090 8.771 10.973 1.00 0.00 N ATOM 1553 CA GLN A 126 24.280 10.066 11.602 1.00 0.00 C ATOM 1554 C GLN A 126 25.301 9.961 12.736 1.00 0.00 C ATOM 1555 O GLN A 126 25.809 8.878 13.021 1.00 0.00 O ATOM 1556 CB GLN A 126 22.951 10.629 12.112 1.00 0.00 C ATOM 1557 CG GLN A 126 22.308 9.680 13.127 1.00 0.00 C ATOM 1558 CD GLN A 126 21.210 10.390 13.922 1.00 0.00 C ATOM 1559 OE1 GLN A 126 21.321 10.618 15.115 1.00 0.00 O ATOM 1560 NE2 GLN A 126 20.147 10.724 13.195 1.00 0.00 N ATOM 0 H GLN A 126 23.599 8.086 11.547 1.00 0.00 H new ATOM 0 HA GLN A 126 24.667 10.758 10.854 1.00 0.00 H new ATOM 0 HB2 GLN A 126 23.117 11.603 12.573 1.00 0.00 H new ATOM 0 HB3 GLN A 126 22.272 10.785 11.274 1.00 0.00 H new ATOM 0 HG2 GLN A 126 21.887 8.818 12.609 1.00 0.00 H new ATOM 0 HG3 GLN A 126 23.069 9.301 13.809 1.00 0.00 H new ATOM 0 HE21 GLN A 126 20.120 10.503 12.200 1.00 0.00 H new ATOM 0 HE22 GLN A 126 19.359 11.201 13.633 1.00 0.00 H new ATOM 1567 N ARG A 127 25.573 11.103 13.354 1.00 0.00 N ATOM 1568 CA ARG A 127 26.525 11.153 14.449 1.00 0.00 C ATOM 1569 C ARG A 127 27.920 10.756 13.960 1.00 0.00 C ATOM 1570 O ARG A 127 28.063 9.823 13.173 1.00 0.00 O ATOM 1571 CB ARG A 127 26.106 10.218 15.585 1.00 0.00 C ATOM 1572 CG ARG A 127 25.842 11.002 16.872 1.00 0.00 C ATOM 1573 CD ARG A 127 24.540 10.546 17.535 1.00 0.00 C ATOM 1574 NE ARG A 127 24.766 9.289 18.283 1.00 0.00 N ATOM 1575 CZ ARG A 127 23.837 8.689 19.040 1.00 0.00 C ATOM 1576 NH1 ARG A 127 22.615 9.228 19.155 1.00 0.00 N ATOM 1577 NH2 ARG A 127 24.131 7.551 19.683 1.00 0.00 N ATOM 0 H ARG A 127 25.150 12.000 13.116 1.00 0.00 H new ATOM 0 HA ARG A 127 26.546 12.176 14.823 1.00 0.00 H new ATOM 0 HB2 ARG A 127 25.208 9.671 15.298 1.00 0.00 H new ATOM 0 HB3 ARG A 127 26.888 9.479 15.759 1.00 0.00 H new ATOM 0 HG2 ARG A 127 26.674 10.864 17.563 1.00 0.00 H new ATOM 0 HG3 ARG A 127 25.787 12.067 16.648 1.00 0.00 H new ATOM 0 HD2 ARG A 127 24.176 11.320 18.210 1.00 0.00 H new ATOM 0 HD3 ARG A 127 23.770 10.395 16.778 1.00 0.00 H new ATOM 0 HE ARG A 127 25.686 8.852 18.218 1.00 0.00 H new ATOM 0 HH11 ARG A 127 22.392 10.095 18.666 1.00 0.00 H new ATOM 0 HH12 ARG A 127 21.908 8.771 19.731 1.00 0.00 H new ATOM 0 HH21 ARG A 127 25.061 7.142 19.596 1.00 0.00 H new ATOM 0 HH22 ARG A 127 23.425 7.094 20.259 1.00 0.00 H new ATOM 1588 N LYS A 128 28.912 11.488 14.446 1.00 0.00 N ATOM 1589 CA LYS A 128 30.290 11.225 14.069 1.00 0.00 C ATOM 1590 C LYS A 128 31.226 11.989 15.006 1.00 0.00 C ATOM 1591 O LYS A 128 31.867 12.956 14.597 1.00 0.00 O ATOM 1592 CB LYS A 128 30.509 11.542 12.587 1.00 0.00 C ATOM 1593 CG LYS A 128 31.858 11.006 12.106 1.00 0.00 C ATOM 1594 CD LYS A 128 32.179 11.511 10.698 1.00 0.00 C ATOM 1595 CE LYS A 128 32.908 12.855 10.751 1.00 0.00 C ATOM 1596 NZ LYS A 128 32.074 13.922 10.157 1.00 0.00 N ATOM 0 H LYS A 128 28.788 12.263 15.098 1.00 0.00 H new ATOM 0 HA LYS A 128 30.521 10.166 14.183 1.00 0.00 H new ATOM 0 HB2 LYS A 128 29.707 11.102 11.995 1.00 0.00 H new ATOM 0 HB3 LYS A 128 30.466 12.620 12.432 1.00 0.00 H new ATOM 0 HG2 LYS A 128 32.643 11.317 12.795 1.00 0.00 H new ATOM 0 HG3 LYS A 128 31.843 9.916 12.110 1.00 0.00 H new ATOM 0 HD2 LYS A 128 32.796 10.779 10.177 1.00 0.00 H new ATOM 0 HD3 LYS A 128 31.257 11.616 10.126 1.00 0.00 H new ATOM 0 HE2 LYS A 128 33.147 13.105 11.785 1.00 0.00 H new ATOM 0 HE3 LYS A 128 33.854 12.784 10.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 32.585 14.827 10.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 31.868 13.689 9.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 31.182 14.001 10.687 1.00 0.00 H new ATOM 1606 N TYR A 129 31.277 11.525 16.247 1.00 0.00 N ATOM 1607 CA TYR A 129 32.124 12.153 17.246 1.00 0.00 C ATOM 1608 C TYR A 129 33.540 11.576 17.204 1.00 0.00 C ATOM 1609 O TYR A 129 33.722 10.384 16.964 1.00 0.00 O ATOM 1610 CB TYR A 129 31.493 11.827 18.601 1.00 0.00 C ATOM 1611 CG TYR A 129 31.505 10.337 18.950 1.00 0.00 C ATOM 1612 CD1 TYR A 129 32.681 9.732 19.348 1.00 0.00 C ATOM 1613 CD2 TYR A 129 30.343 9.598 18.868 1.00 0.00 C ATOM 1614 CE1 TYR A 129 32.694 8.330 19.676 1.00 0.00 C ATOM 1615 CE2 TYR A 129 30.356 8.196 19.197 1.00 0.00 C ATOM 1616 CZ TYR A 129 31.530 7.632 19.584 1.00 0.00 C ATOM 1617 OH TYR A 129 31.543 6.307 19.895 1.00 0.00 O ATOM 0 H TYR A 129 30.745 10.722 16.582 1.00 0.00 H new ATOM 0 HA TYR A 129 32.197 13.226 17.067 1.00 0.00 H new ATOM 0 HB2 TYR A 129 32.023 12.376 19.379 1.00 0.00 H new ATOM 0 HB3 TYR A 129 30.463 12.183 18.606 1.00 0.00 H new ATOM 0 HD1 TYR A 129 33.591 10.310 19.413 1.00 0.00 H new ATOM 0 HD2 TYR A 129 29.423 10.071 18.557 1.00 0.00 H new ATOM 0 HE1 TYR A 129 33.607 7.844 19.988 1.00 0.00 H new ATOM 0 HE2 TYR A 129 29.453 7.606 19.137 1.00 0.00 H new ATOM 0 HH TYR A 129 30.642 5.936 19.786 1.00 0.00 H new ATOM 1626 N ASP A 130 34.509 12.450 17.443 1.00 0.00 N ATOM 1627 CA ASP A 130 35.903 12.042 17.436 1.00 0.00 C ATOM 1628 C ASP A 130 36.793 13.281 17.539 1.00 0.00 C ATOM 1629 O ASP A 130 36.507 14.308 16.925 1.00 0.00 O ATOM 1630 CB ASP A 130 36.257 11.312 16.139 1.00 0.00 C ATOM 1631 CG ASP A 130 35.644 11.913 14.871 1.00 0.00 C ATOM 1632 OD1 ASP A 130 34.402 11.837 14.751 1.00 0.00 O ATOM 1633 OD2 ASP A 130 36.432 12.431 14.052 1.00 0.00 O ATOM 0 H ASP A 130 34.355 13.438 17.642 1.00 0.00 H new ATOM 0 HA ASP A 130 36.062 11.373 18.281 1.00 0.00 H new ATOM 0 HB2 ASP A 130 37.342 11.301 16.030 1.00 0.00 H new ATOM 0 HB3 ASP A 130 35.934 10.274 16.224 1.00 0.00 H new ATOM 1637 N LEU A 131 37.854 13.146 18.320 1.00 0.00 N ATOM 1638 CA LEU A 131 38.788 14.242 18.512 1.00 0.00 C ATOM 1639 C LEU A 131 38.106 15.353 19.313 1.00 0.00 C ATOM 1640 O LEU A 131 36.925 15.250 19.643 1.00 0.00 O ATOM 1641 CB LEU A 131 39.349 14.709 17.168 1.00 0.00 C ATOM 1642 CG LEU A 131 40.871 14.845 17.087 1.00 0.00 C ATOM 1643 CD1 LEU A 131 41.541 13.472 17.009 1.00 0.00 C ATOM 1644 CD2 LEU A 131 41.279 15.749 15.922 1.00 0.00 C ATOM 0 H LEU A 131 38.088 12.293 18.828 1.00 0.00 H new ATOM 0 HA LEU A 131 39.649 13.912 19.093 1.00 0.00 H new ATOM 0 HB2 LEU A 131 39.025 14.008 16.398 1.00 0.00 H new ATOM 0 HB3 LEU A 131 38.905 15.675 16.927 1.00 0.00 H new ATOM 0 HG LEU A 131 41.221 15.322 18.003 1.00 0.00 H new ATOM 0 HD11 LEU A 131 42.622 13.597 16.952 1.00 0.00 H new ATOM 0 HD12 LEU A 131 41.289 12.893 17.898 1.00 0.00 H new ATOM 0 HD13 LEU A 131 41.190 12.946 16.121 1.00 0.00 H new ATOM 0 HD21 LEU A 131 42.365 15.829 15.887 1.00 0.00 H new ATOM 0 HD22 LEU A 131 40.916 15.323 14.987 1.00 0.00 H new ATOM 0 HD23 LEU A 131 40.847 16.740 16.062 1.00 0.00 H new ATOM 1655 N HIS A 132 38.879 16.390 19.602 1.00 0.00 N ATOM 1656 CA HIS A 132 38.364 17.519 20.358 1.00 0.00 C ATOM 1657 C HIS A 132 38.877 18.824 19.745 1.00 0.00 C ATOM 1658 O HIS A 132 40.056 19.150 19.868 1.00 0.00 O ATOM 1659 CB HIS A 132 38.711 17.384 21.842 1.00 0.00 C ATOM 1660 CG HIS A 132 37.534 17.572 22.768 1.00 0.00 C ATOM 1661 ND1 HIS A 132 36.770 18.727 22.785 1.00 0.00 N ATOM 1662 CD2 HIS A 132 36.996 16.742 23.707 1.00 0.00 C ATOM 1663 CE1 HIS A 132 35.821 18.587 23.698 1.00 0.00 C ATOM 1664 NE2 HIS A 132 35.962 17.357 24.268 1.00 0.00 N ATOM 0 H HIS A 132 39.858 16.472 19.326 1.00 0.00 H new ATOM 0 HA HIS A 132 37.276 17.534 20.300 1.00 0.00 H new ATOM 0 HB2 HIS A 132 39.142 16.398 22.015 1.00 0.00 H new ATOM 0 HB3 HIS A 132 39.478 18.116 22.093 1.00 0.00 H new ATOM 0 HD2 HIS A 132 37.351 15.752 23.953 1.00 0.00 H new ATOM 0 HE1 HIS A 132 35.067 19.319 23.947 1.00 0.00 H new ATOM 0 HE2 HIS A 132 35.370 16.972 25.004 1.00 0.00 H new ATOM 1672 N TYR A 133 37.965 19.535 19.098 1.00 0.00 N ATOM 1673 CA TYR A 133 38.310 20.797 18.466 1.00 0.00 C ATOM 1674 C TYR A 133 39.765 20.791 17.989 1.00 0.00 C ATOM 1675 O TYR A 133 40.033 20.580 16.808 1.00 0.00 O ATOM 1676 CB TYR A 133 38.144 21.869 19.544 1.00 0.00 C ATOM 1677 CG TYR A 133 39.005 23.113 19.324 1.00 0.00 C ATOM 1678 CD1 TYR A 133 38.587 24.096 18.449 1.00 0.00 C ATOM 1679 CD2 TYR A 133 40.201 23.253 19.998 1.00 0.00 C ATOM 1680 CE1 TYR A 133 39.399 25.268 18.242 1.00 0.00 C ATOM 1681 CE2 TYR A 133 41.012 24.424 19.790 1.00 0.00 C ATOM 1682 CZ TYR A 133 40.571 25.373 18.922 1.00 0.00 C ATOM 1683 OH TYR A 133 41.338 26.481 18.726 1.00 0.00 O ATOM 0 H TYR A 133 36.988 19.261 18.998 1.00 0.00 H new ATOM 0 HA TYR A 133 37.676 20.977 17.597 1.00 0.00 H new ATOM 0 HB2 TYR A 133 37.097 22.168 19.586 1.00 0.00 H new ATOM 0 HB3 TYR A 133 38.391 21.436 20.513 1.00 0.00 H new ATOM 0 HD1 TYR A 133 37.652 23.986 17.920 1.00 0.00 H new ATOM 0 HD2 TYR A 133 40.529 22.484 20.682 1.00 0.00 H new ATOM 0 HE1 TYR A 133 39.084 26.045 17.562 1.00 0.00 H new ATOM 0 HE2 TYR A 133 41.950 24.546 20.312 1.00 0.00 H new ATOM 0 HH TYR A 133 42.146 26.421 19.278 1.00 0.00 H new TER 1692 TYR A 133