USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 903 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 123 HIS : no HD1:sc= -0.815 K(o=-0.82,f=-5.7) USER MOD Set 1.2: A 124 HIS : no HD1:sc= -0.0054 X(o=-0.82,f=-0.82) USER MOD Set 2.1: A 2 SER OG : rot 180:sc= 0.229 USER MOD Set 2.2: A 108 LYS NZ :NH3+ -150:sc= 0.253 (180deg=-0.077) USER MOD Set 3.1: A 68 LYS NZ :NH3+ -157:sc= 1.2 (180deg=0.429) USER MOD Set 3.2: A 80 HIS : no HE2:sc= -0.39 K(o=0.81,f=-2.1) USER MOD Set 4.1: A 76 ASN : amide:sc= -0.705 K(o=-0.37,f=-3.3!) USER MOD Set 4.2: A 100 SER OG : rot -30:sc= 0.336 USER MOD Set 5.1: A 39 HIS : no HD1:sc= 0 X(o=1.2,f=1.1) USER MOD Set 5.2: A 41 SER OG : rot 28:sc= 1.19 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 CYS SG : rot 180:sc= -0.0692 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 13 GLN :FLIP amide:sc= 0.031 F(o=-0.93,f=0.031) USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 HIS : no HE2:sc= 0.985 K(o=0.98,f=-5!) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 SER OG : rot -4:sc= 0.222 USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0.141 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 34 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 35 SER OG : rot 160:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 165:sc= 1.21 (180deg=1.04) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 HIS : no HD1:sc= -0.28 K(o=-0.28,f=-1.6) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ -173:sc= -0.0283 (180deg=-0.107) USER MOD Single : A 58 CYS SG : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 ASN : amide:sc= -0.241 X(o=-0.24,f=-0.3) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 ASN : amide:sc= 0.011 X(o=0.011,f=-0.011) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= 1.51 K(o=1.5,f=-4!) USER MOD Single : A 92 SER OG : rot -163:sc= 1.19 USER MOD Single : A 95 CYS SG : rot 68:sc= 0.0911 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot -42:sc= 0.158 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 114 GLN : amide:sc= 0.0378 K(o=0.038,f=-3.2!) USER MOD Single : A 116 HIS : no HD1:sc= -0.265 X(o=-0.26,f=-0.0021) USER MOD Single : A 119 HIS : no HD1:sc= -0.303 X(o=-0.3,f=0) USER MOD Single : A 120 HIS : no HD1:sc= -0.123 X(o=-0.12,f=-0.36) USER MOD Single : A 121 HIS : no HE2:sc= 0.00225 X(o=0.0023,f=-0.12) USER MOD Single : A 122 HIS : no HD1:sc= -0.556! C(o=-0.56!,f=-0.52!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 64.404 48.797 63.689 1.00 0.00 N ATOM 2 CA MET A 1 64.261 49.357 62.328 1.00 0.00 C ATOM 3 C MET A 1 63.619 48.364 61.360 1.00 0.00 C ATOM 4 O MET A 1 62.689 48.746 60.657 1.00 0.00 O ATOM 5 CB MET A 1 65.591 49.910 61.801 1.00 0.00 C ATOM 6 CG MET A 1 65.382 50.686 60.493 1.00 0.00 C ATOM 7 SD MET A 1 66.799 51.670 59.930 1.00 0.00 S ATOM 8 CE MET A 1 68.052 50.386 59.662 1.00 0.00 C ATOM 0 H1 MET A 1 64.844 49.505 64.311 1.00 0.00 H new ATOM 0 H2 MET A 1 63.466 48.544 64.061 1.00 0.00 H new ATOM 0 H3 MET A 1 65.003 47.947 63.654 1.00 0.00 H new ATOM 0 HA MET A 1 63.574 50.201 62.399 1.00 0.00 H new ATOM 0 HB2 MET A 1 66.039 50.564 62.549 1.00 0.00 H new ATOM 0 HB3 MET A 1 66.290 49.090 61.634 1.00 0.00 H new ATOM 0 HG2 MET A 1 65.121 49.976 59.708 1.00 0.00 H new ATOM 0 HG3 MET A 1 64.528 51.351 60.619 1.00 0.00 H new ATOM 0 HE1 MET A 1 68.976 50.847 59.314 1.00 0.00 H new ATOM 0 HE2 MET A 1 68.239 49.859 60.598 1.00 0.00 H new ATOM 0 HE3 MET A 1 67.694 49.679 58.913 1.00 0.00 H new ATOM 20 N SER A 2 64.079 47.108 61.285 1.00 0.00 N ATOM 21 CA SER A 2 63.350 46.026 60.606 1.00 0.00 C ATOM 22 C SER A 2 63.699 44.654 61.203 1.00 0.00 C ATOM 23 O SER A 2 64.870 44.278 61.226 1.00 0.00 O ATOM 24 CB SER A 2 63.666 46.046 59.103 1.00 0.00 C ATOM 25 OG SER A 2 62.764 45.218 58.388 1.00 0.00 O ATOM 0 H SER A 2 64.966 46.813 61.693 1.00 0.00 H new ATOM 0 HA SER A 2 62.283 46.192 60.753 1.00 0.00 H new ATOM 0 HB2 SER A 2 63.605 47.067 58.727 1.00 0.00 H new ATOM 0 HB3 SER A 2 64.688 45.706 58.937 1.00 0.00 H new ATOM 0 HG SER A 2 62.981 45.246 57.433 1.00 0.00 H new ATOM 31 N PHE A 3 62.687 43.895 61.637 1.00 0.00 N ATOM 32 CA PHE A 3 62.799 42.506 62.109 1.00 0.00 C ATOM 33 C PHE A 3 61.503 41.714 61.831 1.00 0.00 C ATOM 34 O PHE A 3 60.471 42.310 61.523 1.00 0.00 O ATOM 35 CB PHE A 3 63.190 42.479 63.602 1.00 0.00 C ATOM 36 CG PHE A 3 62.309 43.265 64.565 1.00 0.00 C ATOM 37 CD1 PHE A 3 61.037 42.783 64.934 1.00 0.00 C ATOM 38 CD2 PHE A 3 62.785 44.460 65.141 1.00 0.00 C ATOM 39 CE1 PHE A 3 60.244 43.501 65.850 1.00 0.00 C ATOM 40 CE2 PHE A 3 61.997 45.174 66.062 1.00 0.00 C ATOM 41 CZ PHE A 3 60.720 44.698 66.410 1.00 0.00 C ATOM 0 H PHE A 3 61.729 44.243 61.671 1.00 0.00 H new ATOM 0 HA PHE A 3 63.593 42.010 61.550 1.00 0.00 H new ATOM 0 HB2 PHE A 3 63.205 41.439 63.929 1.00 0.00 H new ATOM 0 HB3 PHE A 3 64.209 42.856 63.692 1.00 0.00 H new ATOM 0 HD1 PHE A 3 60.669 41.859 64.513 1.00 0.00 H new ATOM 0 HD2 PHE A 3 63.763 44.831 64.873 1.00 0.00 H new ATOM 0 HE1 PHE A 3 59.267 43.130 66.123 1.00 0.00 H new ATOM 0 HE2 PHE A 3 62.372 46.087 66.501 1.00 0.00 H new ATOM 0 HZ PHE A 3 60.107 45.251 67.106 1.00 0.00 H new ATOM 51 N CYS A 4 61.570 40.383 61.979 1.00 0.00 N ATOM 52 CA CYS A 4 60.587 39.377 61.547 1.00 0.00 C ATOM 53 C CYS A 4 60.413 39.262 60.016 1.00 0.00 C ATOM 54 O CYS A 4 60.294 40.255 59.298 1.00 0.00 O ATOM 55 CB CYS A 4 59.252 39.546 62.289 1.00 0.00 C ATOM 56 SG CYS A 4 58.199 38.097 61.969 1.00 0.00 S ATOM 0 H CYS A 4 62.371 39.949 62.437 1.00 0.00 H new ATOM 0 HA CYS A 4 61.007 38.413 61.834 1.00 0.00 H new ATOM 0 HB2 CYS A 4 59.429 39.652 63.359 1.00 0.00 H new ATOM 0 HB3 CYS A 4 58.751 40.455 61.957 1.00 0.00 H new ATOM 0 HG CYS A 4 57.069 38.235 62.597 1.00 0.00 H new ATOM 62 N SER A 5 60.344 38.018 59.528 1.00 0.00 N ATOM 63 CA SER A 5 60.142 37.662 58.115 1.00 0.00 C ATOM 64 C SER A 5 59.208 36.446 58.035 1.00 0.00 C ATOM 65 O SER A 5 59.594 35.350 58.443 1.00 0.00 O ATOM 66 CB SER A 5 61.485 37.335 57.434 1.00 0.00 C ATOM 67 OG SER A 5 62.485 38.302 57.709 1.00 0.00 O ATOM 0 H SER A 5 60.431 37.198 60.129 1.00 0.00 H new ATOM 0 HA SER A 5 59.696 38.510 57.596 1.00 0.00 H new ATOM 0 HB2 SER A 5 61.829 36.356 57.769 1.00 0.00 H new ATOM 0 HB3 SER A 5 61.335 37.269 56.356 1.00 0.00 H new ATOM 0 HG SER A 5 63.317 38.050 57.257 1.00 0.00 H new ATOM 73 N PHE A 6 57.973 36.619 57.560 1.00 0.00 N ATOM 74 CA PHE A 6 56.943 35.566 57.516 1.00 0.00 C ATOM 75 C PHE A 6 56.698 35.022 56.096 1.00 0.00 C ATOM 76 O PHE A 6 57.065 35.650 55.103 1.00 0.00 O ATOM 77 CB PHE A 6 55.668 36.043 58.232 1.00 0.00 C ATOM 78 CG PHE A 6 55.025 37.308 57.693 1.00 0.00 C ATOM 79 CD1 PHE A 6 55.419 38.567 58.189 1.00 0.00 C ATOM 80 CD2 PHE A 6 53.996 37.227 56.736 1.00 0.00 C ATOM 81 CE1 PHE A 6 54.785 39.737 57.732 1.00 0.00 C ATOM 82 CE2 PHE A 6 53.359 38.398 56.287 1.00 0.00 C ATOM 83 CZ PHE A 6 53.752 39.652 56.783 1.00 0.00 C ATOM 0 H PHE A 6 57.649 37.511 57.186 1.00 0.00 H new ATOM 0 HA PHE A 6 57.315 34.701 58.065 1.00 0.00 H new ATOM 0 HB2 PHE A 6 54.932 35.240 58.189 1.00 0.00 H new ATOM 0 HB3 PHE A 6 55.906 36.202 59.284 1.00 0.00 H new ATOM 0 HD1 PHE A 6 56.210 38.634 58.922 1.00 0.00 H new ATOM 0 HD2 PHE A 6 53.695 36.266 56.346 1.00 0.00 H new ATOM 0 HE1 PHE A 6 55.092 40.701 58.111 1.00 0.00 H new ATOM 0 HE2 PHE A 6 52.565 38.333 55.558 1.00 0.00 H new ATOM 0 HZ PHE A 6 53.261 40.549 56.436 1.00 0.00 H new ATOM 93 N PHE A 7 56.145 33.810 56.004 1.00 0.00 N ATOM 94 CA PHE A 7 56.082 33.003 54.774 1.00 0.00 C ATOM 95 C PHE A 7 55.029 31.881 54.885 1.00 0.00 C ATOM 96 O PHE A 7 54.496 31.637 55.966 1.00 0.00 O ATOM 97 CB PHE A 7 57.482 32.408 54.511 1.00 0.00 C ATOM 98 CG PHE A 7 58.135 31.720 55.704 1.00 0.00 C ATOM 99 CD1 PHE A 7 57.797 30.395 56.040 1.00 0.00 C ATOM 100 CD2 PHE A 7 59.078 32.416 56.489 1.00 0.00 C ATOM 101 CE1 PHE A 7 58.395 29.771 57.152 1.00 0.00 C ATOM 102 CE2 PHE A 7 59.676 31.793 57.599 1.00 0.00 C ATOM 103 CZ PHE A 7 59.335 30.469 57.931 1.00 0.00 C ATOM 0 H PHE A 7 55.715 33.346 56.804 1.00 0.00 H new ATOM 0 HA PHE A 7 55.781 33.640 53.943 1.00 0.00 H new ATOM 0 HB2 PHE A 7 57.405 31.689 53.696 1.00 0.00 H new ATOM 0 HB3 PHE A 7 58.140 33.207 54.170 1.00 0.00 H new ATOM 0 HD1 PHE A 7 57.077 29.855 55.443 1.00 0.00 H new ATOM 0 HD2 PHE A 7 59.342 33.432 56.236 1.00 0.00 H new ATOM 0 HE1 PHE A 7 58.131 28.755 57.407 1.00 0.00 H new ATOM 0 HE2 PHE A 7 60.397 32.331 58.197 1.00 0.00 H new ATOM 0 HZ PHE A 7 59.794 29.989 58.783 1.00 0.00 H new ATOM 113 N GLY A 8 54.751 31.163 53.790 1.00 0.00 N ATOM 114 CA GLY A 8 53.931 29.941 53.809 1.00 0.00 C ATOM 115 C GLY A 8 52.426 30.162 53.612 1.00 0.00 C ATOM 116 O GLY A 8 51.620 29.386 54.132 1.00 0.00 O ATOM 0 H GLY A 8 55.089 31.413 52.861 1.00 0.00 H new ATOM 0 HA2 GLY A 8 54.289 29.270 53.028 1.00 0.00 H new ATOM 0 HA3 GLY A 8 54.086 29.433 54.761 1.00 0.00 H new ATOM 120 N GLY A 9 52.050 31.222 52.890 1.00 0.00 N ATOM 121 CA GLY A 9 50.669 31.547 52.507 1.00 0.00 C ATOM 122 C GLY A 9 50.438 33.017 52.121 1.00 0.00 C ATOM 123 O GLY A 9 49.329 33.516 52.308 1.00 0.00 O ATOM 0 H GLY A 9 52.724 31.904 52.542 1.00 0.00 H new ATOM 0 HA2 GLY A 9 50.381 30.915 51.666 1.00 0.00 H new ATOM 0 HA3 GLY A 9 50.008 31.295 53.336 1.00 0.00 H new ATOM 127 N GLU A 10 51.462 33.756 51.678 1.00 0.00 N ATOM 128 CA GLU A 10 51.417 35.220 51.601 1.00 0.00 C ATOM 129 C GLU A 10 50.657 35.792 50.398 1.00 0.00 C ATOM 130 O GLU A 10 50.637 35.244 49.295 1.00 0.00 O ATOM 131 CB GLU A 10 52.828 35.830 51.719 1.00 0.00 C ATOM 132 CG GLU A 10 52.999 36.794 52.892 1.00 0.00 C ATOM 133 CD GLU A 10 51.868 37.821 52.951 1.00 0.00 C ATOM 134 OE1 GLU A 10 51.863 38.770 52.141 1.00 0.00 O ATOM 135 OE2 GLU A 10 50.892 37.573 53.690 1.00 0.00 O ATOM 0 H GLU A 10 52.345 33.355 51.363 1.00 0.00 H new ATOM 0 HA GLU A 10 50.824 35.522 52.464 1.00 0.00 H new ATOM 0 HB2 GLU A 10 53.553 35.022 51.819 1.00 0.00 H new ATOM 0 HB3 GLU A 10 53.062 36.357 50.794 1.00 0.00 H new ATOM 0 HG2 GLU A 10 53.028 36.231 53.825 1.00 0.00 H new ATOM 0 HG3 GLU A 10 53.955 37.310 52.802 1.00 0.00 H new ATOM 142 N VAL A 11 50.060 36.954 50.645 1.00 0.00 N ATOM 143 CA VAL A 11 49.029 37.618 49.838 1.00 0.00 C ATOM 144 C VAL A 11 49.478 38.936 49.181 1.00 0.00 C ATOM 145 O VAL A 11 48.818 39.399 48.252 1.00 0.00 O ATOM 146 CB VAL A 11 47.754 37.787 50.697 1.00 0.00 C ATOM 147 CG1 VAL A 11 47.890 38.876 51.769 1.00 0.00 C ATOM 148 CG2 VAL A 11 46.496 38.052 49.864 1.00 0.00 C ATOM 0 H VAL A 11 50.298 37.500 51.473 1.00 0.00 H new ATOM 0 HA VAL A 11 48.816 36.973 48.985 1.00 0.00 H new ATOM 0 HB VAL A 11 47.640 36.824 51.195 1.00 0.00 H new ATOM 0 HG11 VAL A 11 46.962 38.945 52.337 1.00 0.00 H new ATOM 0 HG12 VAL A 11 48.710 38.624 52.442 1.00 0.00 H new ATOM 0 HG13 VAL A 11 48.095 39.834 51.291 1.00 0.00 H new ATOM 0 HG21 VAL A 11 45.637 38.161 50.526 1.00 0.00 H new ATOM 0 HG22 VAL A 11 46.628 38.967 49.287 1.00 0.00 H new ATOM 0 HG23 VAL A 11 46.327 37.216 49.185 1.00 0.00 H new ATOM 158 N PHE A 12 50.622 39.508 49.583 1.00 0.00 N ATOM 159 CA PHE A 12 51.078 40.868 49.205 1.00 0.00 C ATOM 160 C PHE A 12 51.115 41.219 47.702 1.00 0.00 C ATOM 161 O PHE A 12 51.198 42.387 47.340 1.00 0.00 O ATOM 162 CB PHE A 12 52.497 41.094 49.757 1.00 0.00 C ATOM 163 CG PHE A 12 53.578 40.329 49.007 1.00 0.00 C ATOM 164 CD1 PHE A 12 53.894 39.007 49.366 1.00 0.00 C ATOM 165 CD2 PHE A 12 54.231 40.923 47.908 1.00 0.00 C ATOM 166 CE1 PHE A 12 54.839 38.274 48.626 1.00 0.00 C ATOM 167 CE2 PHE A 12 55.174 40.191 47.164 1.00 0.00 C ATOM 168 CZ PHE A 12 55.476 38.866 47.522 1.00 0.00 C ATOM 0 H PHE A 12 51.280 39.029 50.198 1.00 0.00 H new ATOM 0 HA PHE A 12 50.315 41.517 49.635 1.00 0.00 H new ATOM 0 HB2 PHE A 12 52.726 42.159 49.719 1.00 0.00 H new ATOM 0 HB3 PHE A 12 52.519 40.801 50.807 1.00 0.00 H new ATOM 0 HD1 PHE A 12 53.408 38.551 50.216 1.00 0.00 H new ATOM 0 HD2 PHE A 12 54.006 41.944 47.636 1.00 0.00 H new ATOM 0 HE1 PHE A 12 55.075 37.258 48.906 1.00 0.00 H new ATOM 0 HE2 PHE A 12 55.666 40.647 46.318 1.00 0.00 H new ATOM 0 HZ PHE A 12 56.198 38.303 46.949 1.00 0.00 H new ATOM 178 N GLN A 13 51.065 40.227 46.811 1.00 0.00 N ATOM 179 CA GLN A 13 51.321 40.350 45.366 1.00 0.00 C ATOM 180 C GLN A 13 50.377 41.296 44.596 1.00 0.00 C ATOM 181 O GLN A 13 50.624 41.617 43.434 1.00 0.00 O ATOM 182 CB GLN A 13 51.285 38.951 44.733 1.00 0.00 C ATOM 183 CG GLN A 13 50.051 38.094 45.087 1.00 0.00 C ATOM 184 CD GLN A 13 50.317 36.926 46.043 1.00 0.00 C ATOM 185 OE1 GLN A 13 51.158 37.054 47.051 1.00 0.00 O flip ATOM 186 NE2 GLN A 13 49.737 35.859 45.903 1.00 0.00 N flip ATOM 0 H GLN A 13 50.835 39.272 47.084 1.00 0.00 H new ATOM 0 HA GLN A 13 52.304 40.813 45.281 1.00 0.00 H new ATOM 0 HB2 GLN A 13 51.331 39.060 43.649 1.00 0.00 H new ATOM 0 HB3 GLN A 13 52.181 38.410 45.038 1.00 0.00 H new ATOM 0 HG2 GLN A 13 49.295 38.741 45.532 1.00 0.00 H new ATOM 0 HG3 GLN A 13 49.628 37.697 44.164 1.00 0.00 H new ATOM 0 HE21 GLN A 13 49.081 35.732 45.132 1.00 0.00 H new ATOM 0 HE22 GLN A 13 49.909 35.095 46.557 1.00 0.00 H new ATOM 195 N ASN A 14 49.281 41.708 45.228 1.00 0.00 N ATOM 196 CA ASN A 14 48.317 42.676 44.719 1.00 0.00 C ATOM 197 C ASN A 14 48.546 44.139 45.182 1.00 0.00 C ATOM 198 O ASN A 14 47.748 45.005 44.814 1.00 0.00 O ATOM 199 CB ASN A 14 46.902 42.136 45.009 1.00 0.00 C ATOM 200 CG ASN A 14 46.174 41.759 43.729 1.00 0.00 C ATOM 201 OD1 ASN A 14 45.690 42.595 42.979 1.00 0.00 O ATOM 202 ND2 ASN A 14 46.136 40.493 43.388 1.00 0.00 N ATOM 0 H ASN A 14 49.030 41.358 46.153 1.00 0.00 H new ATOM 0 HA ASN A 14 48.457 42.768 43.642 1.00 0.00 H new ATOM 0 HB2 ASN A 14 46.971 41.264 45.659 1.00 0.00 H new ATOM 0 HB3 ASN A 14 46.327 42.890 45.547 1.00 0.00 H new ATOM 0 HD21 ASN A 14 45.706 40.215 42.506 1.00 0.00 H new ATOM 0 HD22 ASN A 14 46.536 39.786 44.005 1.00 0.00 H new ATOM 209 N HIS A 15 49.596 44.455 45.952 1.00 0.00 N ATOM 210 CA HIS A 15 50.086 45.808 46.198 1.00 0.00 C ATOM 211 C HIS A 15 51.593 45.946 45.896 1.00 0.00 C ATOM 212 O HIS A 15 52.291 44.954 45.691 1.00 0.00 O ATOM 213 CB HIS A 15 49.713 46.240 47.614 1.00 0.00 C ATOM 214 CG HIS A 15 50.026 45.279 48.729 1.00 0.00 C ATOM 215 ND1 HIS A 15 51.207 45.196 49.422 1.00 0.00 N ATOM 216 CD2 HIS A 15 49.131 44.452 49.351 1.00 0.00 C ATOM 217 CE1 HIS A 15 51.035 44.342 50.443 1.00 0.00 C ATOM 218 NE2 HIS A 15 49.771 43.884 50.460 1.00 0.00 N ATOM 0 H HIS A 15 50.145 43.745 46.437 1.00 0.00 H new ATOM 0 HA HIS A 15 49.597 46.491 45.504 1.00 0.00 H new ATOM 0 HB2 HIS A 15 50.221 47.181 47.826 1.00 0.00 H new ATOM 0 HB3 HIS A 15 48.643 46.445 47.634 1.00 0.00 H new ATOM 0 HD1 HIS A 15 52.067 45.697 49.200 1.00 0.00 H new ATOM 0 HD2 HIS A 15 48.112 44.270 49.042 1.00 0.00 H new ATOM 0 HE1 HIS A 15 51.802 44.063 51.150 1.00 0.00 H new ATOM 226 N PHE A 16 52.062 47.191 45.752 1.00 0.00 N ATOM 227 CA PHE A 16 53.292 47.535 45.029 1.00 0.00 C ATOM 228 C PHE A 16 54.104 48.630 45.756 1.00 0.00 C ATOM 229 O PHE A 16 54.387 49.693 45.199 1.00 0.00 O ATOM 230 CB PHE A 16 52.934 47.938 43.576 1.00 0.00 C ATOM 231 CG PHE A 16 51.929 47.051 42.847 1.00 0.00 C ATOM 232 CD1 PHE A 16 52.137 45.662 42.742 1.00 0.00 C ATOM 233 CD2 PHE A 16 50.759 47.616 42.299 1.00 0.00 C ATOM 234 CE1 PHE A 16 51.159 44.841 42.152 1.00 0.00 C ATOM 235 CE2 PHE A 16 49.788 46.796 41.694 1.00 0.00 C ATOM 236 CZ PHE A 16 49.981 45.406 41.635 1.00 0.00 C ATOM 0 H PHE A 16 51.587 48.005 46.143 1.00 0.00 H new ATOM 0 HA PHE A 16 53.940 46.659 44.998 1.00 0.00 H new ATOM 0 HB2 PHE A 16 52.542 48.955 43.592 1.00 0.00 H new ATOM 0 HB3 PHE A 16 53.854 47.960 42.992 1.00 0.00 H new ATOM 0 HD1 PHE A 16 53.051 45.225 43.116 1.00 0.00 H new ATOM 0 HD2 PHE A 16 50.607 48.684 42.344 1.00 0.00 H new ATOM 0 HE1 PHE A 16 51.314 43.774 42.096 1.00 0.00 H new ATOM 0 HE2 PHE A 16 48.895 47.236 41.275 1.00 0.00 H new ATOM 0 HZ PHE A 16 49.226 44.773 41.193 1.00 0.00 H new ATOM 246 N GLU A 17 54.447 48.420 47.030 1.00 0.00 N ATOM 247 CA GLU A 17 55.231 49.398 47.798 1.00 0.00 C ATOM 248 C GLU A 17 56.725 49.463 47.408 1.00 0.00 C ATOM 249 O GLU A 17 57.346 48.440 47.112 1.00 0.00 O ATOM 250 CB GLU A 17 55.033 49.244 49.312 1.00 0.00 C ATOM 251 CG GLU A 17 55.388 47.875 49.899 1.00 0.00 C ATOM 252 CD GLU A 17 54.137 47.002 50.053 1.00 0.00 C ATOM 253 OE1 GLU A 17 53.545 46.611 49.026 1.00 0.00 O ATOM 254 OE2 GLU A 17 53.706 46.770 51.209 1.00 0.00 O ATOM 0 H GLU A 17 54.195 47.582 47.554 1.00 0.00 H new ATOM 0 HA GLU A 17 54.823 50.368 47.514 1.00 0.00 H new ATOM 0 HB2 GLU A 17 55.635 50.000 49.816 1.00 0.00 H new ATOM 0 HB3 GLU A 17 53.990 49.458 49.546 1.00 0.00 H new ATOM 0 HG2 GLU A 17 56.108 47.374 49.252 1.00 0.00 H new ATOM 0 HG3 GLU A 17 55.867 48.005 50.869 1.00 0.00 H new ATOM 261 N PRO A 18 57.338 50.665 47.417 1.00 0.00 N ATOM 262 CA PRO A 18 58.733 50.851 47.035 1.00 0.00 C ATOM 263 C PRO A 18 59.674 50.419 48.168 1.00 0.00 C ATOM 264 O PRO A 18 59.327 50.473 49.347 1.00 0.00 O ATOM 265 CB PRO A 18 58.854 52.338 46.692 1.00 0.00 C ATOM 266 CG PRO A 18 57.838 53.001 47.623 1.00 0.00 C ATOM 267 CD PRO A 18 56.747 51.942 47.797 1.00 0.00 C ATOM 0 HA PRO A 18 59.023 50.234 46.184 1.00 0.00 H new ATOM 0 HB2 PRO A 18 59.863 52.710 46.869 1.00 0.00 H new ATOM 0 HB3 PRO A 18 58.623 52.529 45.644 1.00 0.00 H new ATOM 0 HG2 PRO A 18 58.289 53.270 48.578 1.00 0.00 H new ATOM 0 HG3 PRO A 18 57.439 53.918 47.189 1.00 0.00 H new ATOM 0 HD2 PRO A 18 56.396 51.914 48.828 1.00 0.00 H new ATOM 0 HD3 PRO A 18 55.883 52.170 47.172 1.00 0.00 H new ATOM 275 N GLY A 19 60.904 50.035 47.839 1.00 0.00 N ATOM 276 CA GLY A 19 61.830 49.459 48.812 1.00 0.00 C ATOM 277 C GLY A 19 63.184 49.099 48.213 1.00 0.00 C ATOM 278 O GLY A 19 63.489 49.482 47.084 1.00 0.00 O ATOM 0 H GLY A 19 61.286 50.113 46.897 1.00 0.00 H new ATOM 0 HA2 GLY A 19 61.977 50.168 49.627 1.00 0.00 H new ATOM 0 HA3 GLY A 19 61.382 48.564 49.245 1.00 0.00 H new ATOM 282 N VAL A 20 63.992 48.365 48.976 1.00 0.00 N ATOM 283 CA VAL A 20 65.324 47.886 48.570 1.00 0.00 C ATOM 284 C VAL A 20 65.447 46.382 48.824 1.00 0.00 C ATOM 285 O VAL A 20 64.732 45.810 49.647 1.00 0.00 O ATOM 286 CB VAL A 20 66.455 48.630 49.302 1.00 0.00 C ATOM 287 CG1 VAL A 20 67.805 48.564 48.570 1.00 0.00 C ATOM 288 CG2 VAL A 20 66.169 50.116 49.573 1.00 0.00 C ATOM 0 H VAL A 20 63.737 48.076 49.920 1.00 0.00 H new ATOM 0 HA VAL A 20 65.428 48.088 47.504 1.00 0.00 H new ATOM 0 HB VAL A 20 66.507 48.093 50.249 1.00 0.00 H new ATOM 0 HG11 VAL A 20 68.556 49.109 49.142 1.00 0.00 H new ATOM 0 HG12 VAL A 20 68.112 47.523 48.467 1.00 0.00 H new ATOM 0 HG13 VAL A 20 67.705 49.013 47.582 1.00 0.00 H new ATOM 0 HG21 VAL A 20 67.018 50.561 50.092 1.00 0.00 H new ATOM 0 HG22 VAL A 20 66.009 50.634 48.627 1.00 0.00 H new ATOM 0 HG23 VAL A 20 65.277 50.208 50.192 1.00 0.00 H new ATOM 298 N TYR A 21 66.400 45.749 48.147 1.00 0.00 N ATOM 299 CA TYR A 21 66.716 44.327 48.287 1.00 0.00 C ATOM 300 C TYR A 21 68.157 44.155 48.768 1.00 0.00 C ATOM 301 O TYR A 21 69.030 44.937 48.387 1.00 0.00 O ATOM 302 CB TYR A 21 66.481 43.613 46.955 1.00 0.00 C ATOM 303 CG TYR A 21 65.031 43.625 46.508 1.00 0.00 C ATOM 304 CD1 TYR A 21 64.147 42.625 46.957 1.00 0.00 C ATOM 305 CD2 TYR A 21 64.557 44.660 45.680 1.00 0.00 C ATOM 306 CE1 TYR A 21 62.790 42.658 46.575 1.00 0.00 C ATOM 307 CE2 TYR A 21 63.204 44.697 45.296 1.00 0.00 C ATOM 308 CZ TYR A 21 62.317 43.698 45.745 1.00 0.00 C ATOM 309 OH TYR A 21 61.008 43.761 45.392 1.00 0.00 O ATOM 0 H TYR A 21 66.992 46.223 47.465 1.00 0.00 H new ATOM 0 HA TYR A 21 66.060 43.878 49.033 1.00 0.00 H new ATOM 0 HB2 TYR A 21 67.094 44.084 46.186 1.00 0.00 H new ATOM 0 HB3 TYR A 21 66.817 42.580 47.042 1.00 0.00 H new ATOM 0 HD1 TYR A 21 64.509 41.832 47.595 1.00 0.00 H new ATOM 0 HD2 TYR A 21 65.234 45.429 45.338 1.00 0.00 H new ATOM 0 HE1 TYR A 21 62.113 41.889 46.917 1.00 0.00 H new ATOM 0 HE2 TYR A 21 62.845 45.491 44.657 1.00 0.00 H new ATOM 0 HH TYR A 21 60.861 44.542 44.819 1.00 0.00 H new ATOM 319 N VAL A 22 68.403 43.159 49.621 1.00 0.00 N ATOM 320 CA VAL A 22 69.701 42.974 50.294 1.00 0.00 C ATOM 321 C VAL A 22 70.073 41.499 50.403 1.00 0.00 C ATOM 322 O VAL A 22 69.184 40.653 50.461 1.00 0.00 O ATOM 323 CB VAL A 22 69.743 43.645 51.685 1.00 0.00 C ATOM 324 CG1 VAL A 22 68.990 44.986 51.751 1.00 0.00 C ATOM 325 CG2 VAL A 22 69.131 42.809 52.818 1.00 0.00 C ATOM 0 H VAL A 22 67.709 42.453 49.869 1.00 0.00 H new ATOM 0 HA VAL A 22 70.443 43.469 49.667 1.00 0.00 H new ATOM 0 HB VAL A 22 70.817 43.771 51.825 1.00 0.00 H new ATOM 0 HG11 VAL A 22 69.064 45.396 52.758 1.00 0.00 H new ATOM 0 HG12 VAL A 22 69.431 45.686 51.041 1.00 0.00 H new ATOM 0 HG13 VAL A 22 67.941 44.827 51.500 1.00 0.00 H new ATOM 0 HG21 VAL A 22 69.205 43.359 53.756 1.00 0.00 H new ATOM 0 HG22 VAL A 22 68.083 42.608 52.597 1.00 0.00 H new ATOM 0 HG23 VAL A 22 69.670 41.866 52.907 1.00 0.00 H new ATOM 335 N CYS A 23 71.367 41.182 50.500 1.00 0.00 N ATOM 336 CA CYS A 23 71.813 39.787 50.587 1.00 0.00 C ATOM 337 C CYS A 23 71.200 39.092 51.824 1.00 0.00 C ATOM 338 O CYS A 23 71.131 39.675 52.908 1.00 0.00 O ATOM 339 CB CYS A 23 73.354 39.706 50.526 1.00 0.00 C ATOM 340 SG CYS A 23 73.877 37.977 50.645 1.00 0.00 S ATOM 0 H CYS A 23 72.122 41.868 50.520 1.00 0.00 H new ATOM 0 HA CYS A 23 71.447 39.234 49.722 1.00 0.00 H new ATOM 0 HB2 CYS A 23 73.714 40.142 49.594 1.00 0.00 H new ATOM 0 HB3 CYS A 23 73.791 40.285 51.339 1.00 0.00 H new ATOM 345 N ALA A 24 70.788 37.831 51.678 1.00 0.00 N ATOM 346 CA ALA A 24 70.254 37.084 52.818 1.00 0.00 C ATOM 347 C ALA A 24 71.320 36.873 53.911 1.00 0.00 C ATOM 348 O ALA A 24 70.979 36.694 55.080 1.00 0.00 O ATOM 349 CB ALA A 24 69.659 35.739 52.402 1.00 0.00 C ATOM 0 H ALA A 24 70.813 37.314 50.799 1.00 0.00 H new ATOM 0 HA ALA A 24 69.450 37.694 53.230 1.00 0.00 H new ATOM 0 HB1 ALA A 24 69.276 35.223 53.282 1.00 0.00 H new ATOM 0 HB2 ALA A 24 68.845 35.904 51.696 1.00 0.00 H new ATOM 0 HB3 ALA A 24 70.431 35.130 51.931 1.00 0.00 H new ATOM 355 N LYS A 25 72.602 36.878 53.520 1.00 0.00 N ATOM 356 CA LYS A 25 73.772 36.627 54.365 1.00 0.00 C ATOM 357 C LYS A 25 74.529 37.907 54.697 1.00 0.00 C ATOM 358 O LYS A 25 74.703 38.234 55.869 1.00 0.00 O ATOM 359 CB LYS A 25 74.663 35.598 53.658 1.00 0.00 C ATOM 360 CG LYS A 25 75.067 34.430 54.560 1.00 0.00 C ATOM 361 CD LYS A 25 75.979 34.819 55.720 1.00 0.00 C ATOM 362 CE LYS A 25 76.779 33.596 56.184 1.00 0.00 C ATOM 363 NZ LYS A 25 77.765 33.946 57.231 1.00 0.00 N ATOM 0 H LYS A 25 72.862 37.068 52.552 1.00 0.00 H new ATOM 0 HA LYS A 25 73.445 36.228 55.325 1.00 0.00 H new ATOM 0 HB2 LYS A 25 74.137 35.210 52.786 1.00 0.00 H new ATOM 0 HB3 LYS A 25 75.562 36.095 53.293 1.00 0.00 H new ATOM 0 HG2 LYS A 25 74.165 33.967 54.961 1.00 0.00 H new ATOM 0 HG3 LYS A 25 75.570 33.676 53.955 1.00 0.00 H new ATOM 0 HD2 LYS A 25 76.658 35.613 55.410 1.00 0.00 H new ATOM 0 HD3 LYS A 25 75.385 35.211 56.546 1.00 0.00 H new ATOM 0 HE2 LYS A 25 76.095 32.839 56.568 1.00 0.00 H new ATOM 0 HE3 LYS A 25 77.296 33.155 55.331 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 78.285 33.092 57.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 78.434 34.649 56.857 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 77.270 34.343 58.055 1.00 0.00 H new ATOM 377 N CYS A 26 74.934 38.623 53.654 1.00 0.00 N ATOM 378 CA CYS A 26 75.777 39.803 53.724 1.00 0.00 C ATOM 379 C CYS A 26 74.970 41.088 54.016 1.00 0.00 C ATOM 380 O CYS A 26 75.534 42.088 54.457 1.00 0.00 O ATOM 381 CB CYS A 26 76.566 39.897 52.401 1.00 0.00 C ATOM 382 SG CYS A 26 77.181 38.322 51.758 1.00 0.00 S ATOM 0 H CYS A 26 74.671 38.384 52.698 1.00 0.00 H new ATOM 0 HA CYS A 26 76.468 39.710 54.561 1.00 0.00 H new ATOM 0 HB2 CYS A 26 75.926 40.354 51.646 1.00 0.00 H new ATOM 0 HB3 CYS A 26 77.413 40.567 52.549 1.00 0.00 H new ATOM 387 N SER A 27 73.684 41.088 53.641 1.00 0.00 N ATOM 388 CA SER A 27 72.767 42.234 53.694 1.00 0.00 C ATOM 389 C SER A 27 73.298 43.519 53.044 1.00 0.00 C ATOM 390 O SER A 27 72.835 44.618 53.346 1.00 0.00 O ATOM 391 CB SER A 27 72.148 42.419 55.087 1.00 0.00 C ATOM 392 OG SER A 27 73.108 42.779 56.057 1.00 0.00 O ATOM 0 H SER A 27 73.234 40.249 53.275 1.00 0.00 H new ATOM 0 HA SER A 27 71.936 41.974 53.038 1.00 0.00 H new ATOM 0 HB2 SER A 27 71.377 43.188 55.040 1.00 0.00 H new ATOM 0 HB3 SER A 27 71.658 41.494 55.390 1.00 0.00 H new ATOM 0 HG SER A 27 74.001 42.769 55.653 1.00 0.00 H new ATOM 398 N TYR A 28 74.237 43.389 52.099 1.00 0.00 N ATOM 399 CA TYR A 28 74.663 44.479 51.235 1.00 0.00 C ATOM 400 C TYR A 28 73.503 44.857 50.298 1.00 0.00 C ATOM 401 O TYR A 28 72.878 43.978 49.701 1.00 0.00 O ATOM 402 CB TYR A 28 75.945 44.085 50.506 1.00 0.00 C ATOM 403 CG TYR A 28 76.826 45.247 50.069 1.00 0.00 C ATOM 404 CD1 TYR A 28 76.406 46.140 49.061 1.00 0.00 C ATOM 405 CD2 TYR A 28 78.082 45.437 50.682 1.00 0.00 C ATOM 406 CE1 TYR A 28 77.226 47.222 48.681 1.00 0.00 C ATOM 407 CE2 TYR A 28 78.915 46.502 50.286 1.00 0.00 C ATOM 408 CZ TYR A 28 78.486 47.405 49.292 1.00 0.00 C ATOM 409 OH TYR A 28 79.286 48.448 48.936 1.00 0.00 O ATOM 0 H TYR A 28 74.723 42.511 51.917 1.00 0.00 H new ATOM 0 HA TYR A 28 74.906 45.371 51.812 1.00 0.00 H new ATOM 0 HB2 TYR A 28 76.528 43.433 51.156 1.00 0.00 H new ATOM 0 HB3 TYR A 28 75.678 43.501 49.625 1.00 0.00 H new ATOM 0 HD1 TYR A 28 75.451 45.994 48.578 1.00 0.00 H new ATOM 0 HD2 TYR A 28 78.407 44.762 51.460 1.00 0.00 H new ATOM 0 HE1 TYR A 28 76.890 47.912 47.921 1.00 0.00 H new ATOM 0 HE2 TYR A 28 79.885 46.627 50.745 1.00 0.00 H new ATOM 0 HH TYR A 28 80.114 48.419 49.459 1.00 0.00 H new ATOM 419 N GLU A 29 73.172 46.145 50.212 1.00 0.00 N ATOM 420 CA GLU A 29 71.860 46.607 49.739 1.00 0.00 C ATOM 421 C GLU A 29 71.900 47.061 48.277 1.00 0.00 C ATOM 422 O GLU A 29 72.472 48.113 47.980 1.00 0.00 O ATOM 423 CB GLU A 29 71.363 47.758 50.630 1.00 0.00 C ATOM 424 CG GLU A 29 71.505 47.524 52.137 1.00 0.00 C ATOM 425 CD GLU A 29 70.962 48.751 52.867 1.00 0.00 C ATOM 426 OE1 GLU A 29 71.719 49.741 53.002 1.00 0.00 O ATOM 427 OE2 GLU A 29 69.774 48.787 53.256 1.00 0.00 O ATOM 0 H GLU A 29 73.805 46.902 50.468 1.00 0.00 H new ATOM 0 HA GLU A 29 71.172 45.764 49.801 1.00 0.00 H new ATOM 0 HB2 GLU A 29 71.910 48.663 50.366 1.00 0.00 H new ATOM 0 HB3 GLU A 29 70.313 47.943 50.405 1.00 0.00 H new ATOM 0 HG2 GLU A 29 70.956 46.631 52.436 1.00 0.00 H new ATOM 0 HG3 GLU A 29 72.550 47.358 52.399 1.00 0.00 H new ATOM 434 N LEU A 30 71.333 46.282 47.348 1.00 0.00 N ATOM 435 CA LEU A 30 71.423 46.553 45.915 1.00 0.00 C ATOM 436 C LEU A 30 70.427 45.761 45.035 1.00 0.00 C ATOM 437 O LEU A 30 70.214 44.555 45.145 1.00 0.00 O ATOM 438 CB LEU A 30 72.886 46.429 45.428 1.00 0.00 C ATOM 439 CG LEU A 30 73.729 45.293 46.037 1.00 0.00 C ATOM 440 CD1 LEU A 30 73.157 43.934 45.659 1.00 0.00 C ATOM 441 CD2 LEU A 30 75.173 45.400 45.556 1.00 0.00 C ATOM 0 H LEU A 30 70.798 45.444 47.574 1.00 0.00 H new ATOM 0 HA LEU A 30 71.103 47.587 45.786 1.00 0.00 H new ATOM 0 HB2 LEU A 30 72.873 46.300 44.346 1.00 0.00 H new ATOM 0 HB3 LEU A 30 73.392 47.373 45.630 1.00 0.00 H new ATOM 0 HG LEU A 30 73.703 45.389 47.122 1.00 0.00 H new ATOM 0 HD11 LEU A 30 73.768 43.147 46.100 1.00 0.00 H new ATOM 0 HD12 LEU A 30 72.136 43.853 46.032 1.00 0.00 H new ATOM 0 HD13 LEU A 30 73.157 43.828 44.574 1.00 0.00 H new ATOM 0 HD21 LEU A 30 75.762 44.593 45.991 1.00 0.00 H new ATOM 0 HD22 LEU A 30 75.201 45.324 44.469 1.00 0.00 H new ATOM 0 HD23 LEU A 30 75.589 46.359 45.864 1.00 0.00 H new ATOM 453 N PHE A 31 69.842 46.510 44.114 1.00 0.00 N ATOM 454 CA PHE A 31 68.999 46.108 42.977 1.00 0.00 C ATOM 455 C PHE A 31 68.927 47.228 41.912 1.00 0.00 C ATOM 456 O PHE A 31 69.326 48.360 42.176 1.00 0.00 O ATOM 457 CB PHE A 31 67.576 45.779 43.462 1.00 0.00 C ATOM 458 CG PHE A 31 66.680 46.988 43.695 1.00 0.00 C ATOM 459 CD1 PHE A 31 66.932 47.872 44.763 1.00 0.00 C ATOM 460 CD2 PHE A 31 65.607 47.246 42.818 1.00 0.00 C ATOM 461 CE1 PHE A 31 66.124 49.009 44.943 1.00 0.00 C ATOM 462 CE2 PHE A 31 64.799 48.382 43.001 1.00 0.00 C ATOM 463 CZ PHE A 31 65.056 49.261 44.067 1.00 0.00 C ATOM 0 H PHE A 31 69.952 47.524 44.139 1.00 0.00 H new ATOM 0 HA PHE A 31 69.449 45.224 42.526 1.00 0.00 H new ATOM 0 HB2 PHE A 31 67.100 45.129 42.728 1.00 0.00 H new ATOM 0 HB3 PHE A 31 67.647 45.214 44.391 1.00 0.00 H new ATOM 0 HD1 PHE A 31 67.747 47.676 45.444 1.00 0.00 H new ATOM 0 HD2 PHE A 31 65.405 46.568 42.002 1.00 0.00 H new ATOM 0 HE1 PHE A 31 66.325 49.690 45.757 1.00 0.00 H new ATOM 0 HE2 PHE A 31 63.982 48.579 42.323 1.00 0.00 H new ATOM 0 HZ PHE A 31 64.432 50.130 44.212 1.00 0.00 H new ATOM 473 N SER A 32 68.377 46.937 40.724 1.00 0.00 N ATOM 474 CA SER A 32 68.090 47.941 39.678 1.00 0.00 C ATOM 475 C SER A 32 66.596 48.068 39.371 1.00 0.00 C ATOM 476 O SER A 32 65.839 47.097 39.422 1.00 0.00 O ATOM 477 CB SER A 32 68.874 47.639 38.395 1.00 0.00 C ATOM 478 OG SER A 32 68.574 48.582 37.379 1.00 0.00 O ATOM 0 H SER A 32 68.114 45.989 40.455 1.00 0.00 H new ATOM 0 HA SER A 32 68.418 48.901 40.077 1.00 0.00 H new ATOM 0 HB2 SER A 32 69.943 47.655 38.606 1.00 0.00 H new ATOM 0 HB3 SER A 32 68.633 46.635 38.046 1.00 0.00 H new ATOM 0 HG SER A 32 69.088 48.368 36.572 1.00 0.00 H new ATOM 484 N SER A 33 66.169 49.270 38.977 1.00 0.00 N ATOM 485 CA SER A 33 64.807 49.516 38.496 1.00 0.00 C ATOM 486 C SER A 33 64.532 48.940 37.101 1.00 0.00 C ATOM 487 O SER A 33 63.362 48.752 36.773 1.00 0.00 O ATOM 488 CB SER A 33 64.481 51.012 38.519 1.00 0.00 C ATOM 489 OG SER A 33 64.387 51.424 39.865 1.00 0.00 O ATOM 0 H SER A 33 66.759 50.102 38.982 1.00 0.00 H new ATOM 0 HA SER A 33 64.151 48.987 39.187 1.00 0.00 H new ATOM 0 HB2 SER A 33 65.256 51.578 38.002 1.00 0.00 H new ATOM 0 HB3 SER A 33 63.544 51.205 37.997 1.00 0.00 H new ATOM 0 HG SER A 33 64.180 52.381 39.900 1.00 0.00 H new ATOM 495 N HIS A 34 65.557 48.633 36.296 1.00 0.00 N ATOM 496 CA HIS A 34 65.387 48.168 34.907 1.00 0.00 C ATOM 497 C HIS A 34 65.381 46.645 34.724 1.00 0.00 C ATOM 498 O HIS A 34 64.934 46.147 33.698 1.00 0.00 O ATOM 499 CB HIS A 34 66.492 48.766 34.025 1.00 0.00 C ATOM 500 CG HIS A 34 66.553 50.273 33.942 1.00 0.00 C ATOM 501 ND1 HIS A 34 65.523 51.173 34.119 1.00 0.00 N ATOM 502 CD2 HIS A 34 67.656 50.997 33.579 1.00 0.00 C ATOM 503 CE1 HIS A 34 66.001 52.409 33.895 1.00 0.00 C ATOM 504 NE2 HIS A 34 67.300 52.351 33.555 1.00 0.00 N ATOM 0 H HIS A 34 66.532 48.699 36.587 1.00 0.00 H new ATOM 0 HA HIS A 34 64.396 48.511 34.611 1.00 0.00 H new ATOM 0 HB2 HIS A 34 67.453 48.406 34.393 1.00 0.00 H new ATOM 0 HB3 HIS A 34 66.371 48.374 33.015 1.00 0.00 H new ATOM 0 HD2 HIS A 34 68.632 50.594 33.351 1.00 0.00 H new ATOM 0 HE1 HIS A 34 65.424 53.318 33.977 1.00 0.00 H new ATOM 0 HE2 HIS A 34 67.907 53.138 33.325 1.00 0.00 H new ATOM 512 N SER A 35 65.894 45.897 35.697 1.00 0.00 N ATOM 513 CA SER A 35 66.323 44.521 35.553 1.00 0.00 C ATOM 514 C SER A 35 65.203 43.496 35.707 1.00 0.00 C ATOM 515 O SER A 35 65.386 42.322 35.398 1.00 0.00 O ATOM 516 CB SER A 35 67.410 44.277 36.589 1.00 0.00 C ATOM 517 OG SER A 35 66.937 44.472 37.908 1.00 0.00 O ATOM 0 H SER A 35 66.025 46.254 36.644 1.00 0.00 H new ATOM 0 HA SER A 35 66.688 44.385 34.535 1.00 0.00 H new ATOM 0 HB2 SER A 35 67.788 43.260 36.486 1.00 0.00 H new ATOM 0 HB3 SER A 35 68.248 44.949 36.401 1.00 0.00 H new ATOM 0 HG SER A 35 67.530 44.013 38.539 1.00 0.00 H new ATOM 523 N LYS A 36 64.062 43.939 36.239 1.00 0.00 N ATOM 524 CA LYS A 36 62.874 43.117 36.535 1.00 0.00 C ATOM 525 C LYS A 36 61.673 43.443 35.641 1.00 0.00 C ATOM 526 O LYS A 36 61.419 44.606 35.318 1.00 0.00 O ATOM 527 CB LYS A 36 62.524 43.143 38.040 1.00 0.00 C ATOM 528 CG LYS A 36 62.759 44.453 38.821 1.00 0.00 C ATOM 529 CD LYS A 36 61.989 45.674 38.299 1.00 0.00 C ATOM 530 CE LYS A 36 62.170 46.845 39.271 1.00 0.00 C ATOM 531 NZ LYS A 36 61.514 48.072 38.762 1.00 0.00 N ATOM 0 H LYS A 36 63.929 44.919 36.488 1.00 0.00 H new ATOM 0 HA LYS A 36 63.141 42.090 36.287 1.00 0.00 H new ATOM 0 HB2 LYS A 36 61.471 42.879 38.142 1.00 0.00 H new ATOM 0 HB3 LYS A 36 63.098 42.356 38.529 1.00 0.00 H new ATOM 0 HG2 LYS A 36 62.485 44.290 39.863 1.00 0.00 H new ATOM 0 HG3 LYS A 36 63.825 44.681 38.803 1.00 0.00 H new ATOM 0 HD2 LYS A 36 62.351 45.950 37.309 1.00 0.00 H new ATOM 0 HD3 LYS A 36 60.931 45.433 38.196 1.00 0.00 H new ATOM 0 HE2 LYS A 36 61.751 46.582 40.243 1.00 0.00 H new ATOM 0 HE3 LYS A 36 63.233 47.034 39.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 61.429 48.765 39.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 62.085 48.477 37.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 60.567 47.836 38.403 1.00 0.00 H new ATOM 545 N TYR A 37 60.908 42.409 35.287 1.00 0.00 N ATOM 546 CA TYR A 37 59.688 42.497 34.487 1.00 0.00 C ATOM 547 C TYR A 37 58.520 41.742 35.123 1.00 0.00 C ATOM 548 O TYR A 37 58.698 40.811 35.907 1.00 0.00 O ATOM 549 CB TYR A 37 59.956 42.046 33.048 1.00 0.00 C ATOM 550 CG TYR A 37 60.759 40.765 32.852 1.00 0.00 C ATOM 551 CD1 TYR A 37 60.099 39.522 32.771 1.00 0.00 C ATOM 552 CD2 TYR A 37 62.151 40.824 32.631 1.00 0.00 C ATOM 553 CE1 TYR A 37 60.807 38.357 32.404 1.00 0.00 C ATOM 554 CE2 TYR A 37 62.865 39.657 32.288 1.00 0.00 C ATOM 555 CZ TYR A 37 62.193 38.425 32.145 1.00 0.00 C ATOM 556 OH TYR A 37 62.873 37.332 31.696 1.00 0.00 O ATOM 0 H TYR A 37 61.131 41.452 35.561 1.00 0.00 H new ATOM 0 HA TYR A 37 59.385 43.544 34.458 1.00 0.00 H new ATOM 0 HB2 TYR A 37 58.995 41.920 32.550 1.00 0.00 H new ATOM 0 HB3 TYR A 37 60.478 42.853 32.534 1.00 0.00 H new ATOM 0 HD1 TYR A 37 59.044 39.460 32.991 1.00 0.00 H new ATOM 0 HD2 TYR A 37 62.672 41.766 32.725 1.00 0.00 H new ATOM 0 HE1 TYR A 37 60.288 37.413 32.321 1.00 0.00 H new ATOM 0 HE2 TYR A 37 63.933 39.707 32.134 1.00 0.00 H new ATOM 0 HH TYR A 37 63.817 37.563 31.571 1.00 0.00 H new ATOM 566 N ALA A 38 57.312 42.197 34.801 1.00 0.00 N ATOM 567 CA ALA A 38 56.077 41.734 35.432 1.00 0.00 C ATOM 568 C ALA A 38 55.503 40.477 34.753 1.00 0.00 C ATOM 569 O ALA A 38 55.032 40.545 33.616 1.00 0.00 O ATOM 570 CB ALA A 38 55.074 42.896 35.451 1.00 0.00 C ATOM 0 H ALA A 38 57.160 42.907 34.085 1.00 0.00 H new ATOM 0 HA ALA A 38 56.293 41.428 36.456 1.00 0.00 H new ATOM 0 HB1 ALA A 38 54.146 42.568 35.919 1.00 0.00 H new ATOM 0 HB2 ALA A 38 55.492 43.728 36.018 1.00 0.00 H new ATOM 0 HB3 ALA A 38 54.871 43.218 34.430 1.00 0.00 H new ATOM 576 N HIS A 39 55.507 39.340 35.456 1.00 0.00 N ATOM 577 CA HIS A 39 54.728 38.152 35.111 1.00 0.00 C ATOM 578 C HIS A 39 54.403 37.311 36.357 1.00 0.00 C ATOM 579 O HIS A 39 55.287 37.025 37.162 1.00 0.00 O ATOM 580 CB HIS A 39 55.484 37.301 34.079 1.00 0.00 C ATOM 581 CG HIS A 39 54.686 36.092 33.652 1.00 0.00 C ATOM 582 ND1 HIS A 39 55.045 34.774 33.809 1.00 0.00 N ATOM 583 CD2 HIS A 39 53.431 36.107 33.111 1.00 0.00 C ATOM 584 CE1 HIS A 39 54.032 34.014 33.366 1.00 0.00 C ATOM 585 NE2 HIS A 39 53.008 34.781 32.951 1.00 0.00 N ATOM 0 H HIS A 39 56.066 39.220 36.301 1.00 0.00 H new ATOM 0 HA HIS A 39 53.785 38.486 34.677 1.00 0.00 H new ATOM 0 HB2 HIS A 39 55.715 37.910 33.205 1.00 0.00 H new ATOM 0 HB3 HIS A 39 56.435 36.977 34.502 1.00 0.00 H new ATOM 0 HD2 HIS A 39 52.864 36.989 32.852 1.00 0.00 H new ATOM 0 HE1 HIS A 39 54.038 32.934 33.345 1.00 0.00 H new ATOM 0 HE2 HIS A 39 52.108 34.462 32.593 1.00 0.00 H new ATOM 593 N SER A 40 53.149 36.874 36.498 1.00 0.00 N ATOM 594 CA SER A 40 52.716 35.968 37.557 1.00 0.00 C ATOM 595 C SER A 40 52.959 34.504 37.187 1.00 0.00 C ATOM 596 O SER A 40 52.166 33.867 36.487 1.00 0.00 O ATOM 597 CB SER A 40 51.278 36.228 37.961 1.00 0.00 C ATOM 598 OG SER A 40 50.972 35.502 39.137 1.00 0.00 O ATOM 0 H SER A 40 52.395 37.146 35.867 1.00 0.00 H new ATOM 0 HA SER A 40 53.332 36.174 38.433 1.00 0.00 H new ATOM 0 HB2 SER A 40 51.125 37.294 38.130 1.00 0.00 H new ATOM 0 HB3 SER A 40 50.605 35.934 37.155 1.00 0.00 H new ATOM 0 HG SER A 40 50.042 35.674 39.395 1.00 0.00 H new ATOM 604 N SER A 41 54.081 33.972 37.663 1.00 0.00 N ATOM 605 CA SER A 41 54.401 32.538 37.756 1.00 0.00 C ATOM 606 C SER A 41 55.546 32.311 38.755 1.00 0.00 C ATOM 607 O SER A 41 56.354 33.220 38.952 1.00 0.00 O ATOM 608 CB SER A 41 54.817 31.974 36.392 1.00 0.00 C ATOM 609 OG SER A 41 53.663 31.790 35.601 1.00 0.00 O ATOM 0 H SER A 41 54.838 34.557 38.016 1.00 0.00 H new ATOM 0 HA SER A 41 53.503 32.023 38.096 1.00 0.00 H new ATOM 0 HB2 SER A 41 55.508 32.656 35.897 1.00 0.00 H new ATOM 0 HB3 SER A 41 55.341 31.027 36.520 1.00 0.00 H new ATOM 0 HG SER A 41 52.976 32.435 35.869 1.00 0.00 H new ATOM 615 N PRO A 42 55.656 31.125 39.385 1.00 0.00 N ATOM 616 CA PRO A 42 56.781 30.793 40.257 1.00 0.00 C ATOM 617 C PRO A 42 58.093 30.673 39.465 1.00 0.00 C ATOM 618 O PRO A 42 58.108 30.181 38.336 1.00 0.00 O ATOM 619 CB PRO A 42 56.393 29.487 40.955 1.00 0.00 C ATOM 620 CG PRO A 42 55.441 28.829 39.957 1.00 0.00 C ATOM 621 CD PRO A 42 54.727 30.009 39.307 1.00 0.00 C ATOM 0 HA PRO A 42 56.970 31.578 40.989 1.00 0.00 H new ATOM 0 HB2 PRO A 42 57.264 28.862 41.153 1.00 0.00 H new ATOM 0 HB3 PRO A 42 55.908 29.671 41.913 1.00 0.00 H new ATOM 0 HG2 PRO A 42 55.981 28.233 39.221 1.00 0.00 H new ATOM 0 HG3 PRO A 42 54.738 28.161 40.455 1.00 0.00 H new ATOM 0 HD2 PRO A 42 54.468 29.787 38.272 1.00 0.00 H new ATOM 0 HD3 PRO A 42 53.796 30.238 39.827 1.00 0.00 H new ATOM 629 N TRP A 43 59.193 31.096 40.097 1.00 0.00 N ATOM 630 CA TRP A 43 60.527 31.300 39.519 1.00 0.00 C ATOM 631 C TRP A 43 60.556 32.215 38.268 1.00 0.00 C ATOM 632 O TRP A 43 60.979 31.782 37.190 1.00 0.00 O ATOM 633 CB TRP A 43 61.207 29.940 39.339 1.00 0.00 C ATOM 634 CG TRP A 43 61.096 28.997 40.505 1.00 0.00 C ATOM 635 CD1 TRP A 43 60.632 27.732 40.413 1.00 0.00 C ATOM 636 CD2 TRP A 43 61.361 29.219 41.929 1.00 0.00 C ATOM 637 NE1 TRP A 43 60.604 27.149 41.662 1.00 0.00 N ATOM 638 CE2 TRP A 43 61.004 28.033 42.641 1.00 0.00 C ATOM 639 CE3 TRP A 43 61.839 30.305 42.700 1.00 0.00 C ATOM 640 CZ2 TRP A 43 61.086 27.938 44.039 1.00 0.00 C ATOM 641 CZ3 TRP A 43 61.920 30.222 44.104 1.00 0.00 C ATOM 642 CH2 TRP A 43 61.538 29.045 44.774 1.00 0.00 C ATOM 0 H TRP A 43 59.174 31.320 41.092 1.00 0.00 H new ATOM 0 HA TRP A 43 61.120 31.881 40.225 1.00 0.00 H new ATOM 0 HB2 TRP A 43 60.781 29.455 38.461 1.00 0.00 H new ATOM 0 HB3 TRP A 43 62.264 30.107 39.130 1.00 0.00 H new ATOM 0 HD1 TRP A 43 60.328 27.249 39.496 1.00 0.00 H new ATOM 0 HE1 TRP A 43 60.323 26.185 41.839 1.00 0.00 H new ATOM 0 HE3 TRP A 43 62.147 31.213 42.203 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 60.805 27.025 44.543 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 62.278 31.069 44.671 1.00 0.00 H new ATOM 0 HH2 TRP A 43 61.592 28.994 45.851 1.00 0.00 H new ATOM 653 N PRO A 44 60.127 33.490 38.393 1.00 0.00 N ATOM 654 CA PRO A 44 60.319 34.507 37.360 1.00 0.00 C ATOM 655 C PRO A 44 61.786 34.975 37.314 1.00 0.00 C ATOM 656 O PRO A 44 62.526 34.825 38.287 1.00 0.00 O ATOM 657 CB PRO A 44 59.367 35.641 37.748 1.00 0.00 C ATOM 658 CG PRO A 44 59.420 35.606 39.275 1.00 0.00 C ATOM 659 CD PRO A 44 59.581 34.118 39.593 1.00 0.00 C ATOM 0 HA PRO A 44 60.105 34.131 36.359 1.00 0.00 H new ATOM 0 HB2 PRO A 44 59.697 36.602 37.352 1.00 0.00 H new ATOM 0 HB3 PRO A 44 58.358 35.471 37.373 1.00 0.00 H new ATOM 0 HG2 PRO A 44 60.254 36.191 39.661 1.00 0.00 H new ATOM 0 HG3 PRO A 44 58.512 36.015 39.718 1.00 0.00 H new ATOM 0 HD2 PRO A 44 60.248 33.974 40.443 1.00 0.00 H new ATOM 0 HD3 PRO A 44 58.622 33.673 39.861 1.00 0.00 H new ATOM 667 N ALA A 45 62.200 35.570 36.194 1.00 0.00 N ATOM 668 CA ALA A 45 63.590 35.951 35.938 1.00 0.00 C ATOM 669 C ALA A 45 63.816 37.474 35.862 1.00 0.00 C ATOM 670 O ALA A 45 62.904 38.262 35.612 1.00 0.00 O ATOM 671 CB ALA A 45 64.054 35.241 34.661 1.00 0.00 C ATOM 0 H ALA A 45 61.569 35.804 35.427 1.00 0.00 H new ATOM 0 HA ALA A 45 64.192 35.633 36.789 1.00 0.00 H new ATOM 0 HB1 ALA A 45 65.089 35.511 34.450 1.00 0.00 H new ATOM 0 HB2 ALA A 45 63.981 34.162 34.797 1.00 0.00 H new ATOM 0 HB3 ALA A 45 63.423 35.545 33.826 1.00 0.00 H new ATOM 677 N PHE A 46 65.074 37.860 36.053 1.00 0.00 N ATOM 678 CA PHE A 46 65.644 39.171 35.758 1.00 0.00 C ATOM 679 C PHE A 46 66.390 39.118 34.419 1.00 0.00 C ATOM 680 O PHE A 46 66.819 38.052 33.968 1.00 0.00 O ATOM 681 CB PHE A 46 66.630 39.566 36.873 1.00 0.00 C ATOM 682 CG PHE A 46 66.044 39.664 38.269 1.00 0.00 C ATOM 683 CD1 PHE A 46 65.994 38.525 39.098 1.00 0.00 C ATOM 684 CD2 PHE A 46 65.580 40.901 38.756 1.00 0.00 C ATOM 685 CE1 PHE A 46 65.476 38.622 40.401 1.00 0.00 C ATOM 686 CE2 PHE A 46 65.073 41.001 40.064 1.00 0.00 C ATOM 687 CZ PHE A 46 65.017 39.860 40.885 1.00 0.00 C ATOM 0 H PHE A 46 65.768 37.223 36.444 1.00 0.00 H new ATOM 0 HA PHE A 46 64.842 39.907 35.700 1.00 0.00 H new ATOM 0 HB2 PHE A 46 67.441 38.837 36.890 1.00 0.00 H new ATOM 0 HB3 PHE A 46 67.072 40.529 36.617 1.00 0.00 H new ATOM 0 HD1 PHE A 46 66.355 37.575 38.731 1.00 0.00 H new ATOM 0 HD2 PHE A 46 65.614 41.776 38.123 1.00 0.00 H new ATOM 0 HE1 PHE A 46 65.430 37.746 41.031 1.00 0.00 H new ATOM 0 HE2 PHE A 46 64.727 41.953 40.438 1.00 0.00 H new ATOM 0 HZ PHE A 46 64.621 39.935 41.887 1.00 0.00 H new ATOM 697 N THR A 47 66.636 40.282 33.821 1.00 0.00 N ATOM 698 CA THR A 47 67.712 40.432 32.836 1.00 0.00 C ATOM 699 C THR A 47 69.067 40.573 33.528 1.00 0.00 C ATOM 700 O THR A 47 69.948 39.730 33.361 1.00 0.00 O ATOM 701 CB THR A 47 67.467 41.602 31.873 1.00 0.00 C ATOM 702 OG1 THR A 47 67.131 42.780 32.573 1.00 0.00 O ATOM 703 CG2 THR A 47 66.316 41.323 30.908 1.00 0.00 C ATOM 0 H THR A 47 66.107 41.136 33.999 1.00 0.00 H new ATOM 0 HA THR A 47 67.720 39.523 32.235 1.00 0.00 H new ATOM 0 HB THR A 47 68.399 41.725 31.322 1.00 0.00 H new ATOM 0 HG1 THR A 47 66.982 43.509 31.935 1.00 0.00 H new ATOM 0 HG21 THR A 47 66.180 42.179 30.247 1.00 0.00 H new ATOM 0 HG22 THR A 47 66.545 40.438 30.314 1.00 0.00 H new ATOM 0 HG23 THR A 47 65.400 41.153 31.474 1.00 0.00 H new ATOM 711 N GLU A 48 69.217 41.605 34.363 1.00 0.00 N ATOM 712 CA GLU A 48 70.487 42.050 34.899 1.00 0.00 C ATOM 713 C GLU A 48 70.785 41.544 36.308 1.00 0.00 C ATOM 714 O GLU A 48 69.929 41.122 37.086 1.00 0.00 O ATOM 715 CB GLU A 48 70.560 43.588 34.940 1.00 0.00 C ATOM 716 CG GLU A 48 70.038 44.407 33.776 1.00 0.00 C ATOM 717 CD GLU A 48 70.613 44.074 32.393 1.00 0.00 C ATOM 718 OE1 GLU A 48 71.531 43.222 32.288 1.00 0.00 O ATOM 719 OE2 GLU A 48 70.127 44.688 31.419 1.00 0.00 O ATOM 0 H GLU A 48 68.429 42.164 34.689 1.00 0.00 H new ATOM 0 HA GLU A 48 71.229 41.629 34.221 1.00 0.00 H new ATOM 0 HB2 GLU A 48 70.023 43.913 35.831 1.00 0.00 H new ATOM 0 HB3 GLU A 48 71.606 43.858 35.082 1.00 0.00 H new ATOM 0 HG2 GLU A 48 68.955 44.288 33.733 1.00 0.00 H new ATOM 0 HG3 GLU A 48 70.235 45.459 33.983 1.00 0.00 H new ATOM 726 N THR A 49 72.043 41.760 36.645 1.00 0.00 N ATOM 727 CA THR A 49 72.666 41.534 37.958 1.00 0.00 C ATOM 728 C THR A 49 73.245 42.828 38.540 1.00 0.00 C ATOM 729 O THR A 49 73.839 43.641 37.828 1.00 0.00 O ATOM 730 CB THR A 49 73.765 40.462 37.888 1.00 0.00 C ATOM 731 OG1 THR A 49 74.700 40.774 36.884 1.00 0.00 O ATOM 732 CG2 THR A 49 73.206 39.077 37.579 1.00 0.00 C ATOM 0 H THR A 49 72.713 42.124 35.968 1.00 0.00 H new ATOM 0 HA THR A 49 71.875 41.179 38.618 1.00 0.00 H new ATOM 0 HB THR A 49 74.236 40.449 38.871 1.00 0.00 H new ATOM 0 HG1 THR A 49 75.393 40.081 36.856 1.00 0.00 H new ATOM 0 HG21 THR A 49 74.022 38.356 37.540 1.00 0.00 H new ATOM 0 HG22 THR A 49 72.502 38.787 38.359 1.00 0.00 H new ATOM 0 HG23 THR A 49 72.694 39.098 36.617 1.00 0.00 H new ATOM 740 N ILE A 50 73.057 43.047 39.848 1.00 0.00 N ATOM 741 CA ILE A 50 73.603 44.216 40.566 1.00 0.00 C ATOM 742 C ILE A 50 74.564 43.818 41.697 1.00 0.00 C ATOM 743 O ILE A 50 75.435 44.588 42.090 1.00 0.00 O ATOM 744 CB ILE A 50 72.467 45.156 41.024 1.00 0.00 C ATOM 745 CG1 ILE A 50 71.390 45.415 39.938 1.00 0.00 C ATOM 746 CG2 ILE A 50 73.030 46.531 41.429 1.00 0.00 C ATOM 747 CD1 ILE A 50 70.295 44.340 39.797 1.00 0.00 C ATOM 0 H ILE A 50 72.520 42.418 40.445 1.00 0.00 H new ATOM 0 HA ILE A 50 74.218 44.782 39.866 1.00 0.00 H new ATOM 0 HB ILE A 50 72.001 44.640 41.864 1.00 0.00 H new ATOM 0 HG12 ILE A 50 70.908 46.369 40.154 1.00 0.00 H new ATOM 0 HG13 ILE A 50 71.892 45.521 38.976 1.00 0.00 H new ATOM 0 HG21 ILE A 50 72.214 47.179 41.749 1.00 0.00 H new ATOM 0 HG22 ILE A 50 73.737 46.407 42.249 1.00 0.00 H new ATOM 0 HG23 ILE A 50 73.538 46.982 40.576 1.00 0.00 H new ATOM 0 HD11 ILE A 50 69.600 44.629 39.008 1.00 0.00 H new ATOM 0 HD12 ILE A 50 70.754 43.384 39.544 1.00 0.00 H new ATOM 0 HD13 ILE A 50 69.755 44.245 40.739 1.00 0.00 H new ATOM 759 N HIS A 51 74.464 42.581 42.167 1.00 0.00 N ATOM 760 CA HIS A 51 75.280 41.973 43.217 1.00 0.00 C ATOM 761 C HIS A 51 76.791 41.981 42.875 1.00 0.00 C ATOM 762 O HIS A 51 77.139 41.922 41.692 1.00 0.00 O ATOM 763 CB HIS A 51 74.735 40.552 43.440 1.00 0.00 C ATOM 764 CG HIS A 51 73.224 40.460 43.374 1.00 0.00 C ATOM 765 ND1 HIS A 51 72.321 41.175 44.132 1.00 0.00 N ATOM 766 CD2 HIS A 51 72.505 39.811 42.405 1.00 0.00 C ATOM 767 CE1 HIS A 51 71.093 40.966 43.631 1.00 0.00 C ATOM 768 NE2 HIS A 51 71.159 40.153 42.564 1.00 0.00 N ATOM 0 H HIS A 51 73.767 41.932 41.803 1.00 0.00 H new ATOM 0 HA HIS A 51 75.207 42.555 44.136 1.00 0.00 H new ATOM 0 HB2 HIS A 51 75.163 39.887 42.690 1.00 0.00 H new ATOM 0 HB3 HIS A 51 75.070 40.193 44.413 1.00 0.00 H new ATOM 0 HD2 HIS A 51 72.907 39.151 41.651 1.00 0.00 H new ATOM 0 HE1 HIS A 51 70.183 41.391 44.029 1.00 0.00 H new ATOM 0 HE2 HIS A 51 70.379 39.845 41.983 1.00 0.00 H new ATOM 776 N PRO A 52 77.700 42.077 43.867 1.00 0.00 N ATOM 777 CA PRO A 52 79.125 42.291 43.616 1.00 0.00 C ATOM 778 C PRO A 52 79.806 41.047 43.037 1.00 0.00 C ATOM 779 O PRO A 52 79.448 39.916 43.342 1.00 0.00 O ATOM 780 CB PRO A 52 79.727 42.693 44.964 1.00 0.00 C ATOM 781 CG PRO A 52 78.834 41.955 45.962 1.00 0.00 C ATOM 782 CD PRO A 52 77.454 42.019 45.301 1.00 0.00 C ATOM 0 HA PRO A 52 79.277 43.066 42.865 1.00 0.00 H new ATOM 0 HB2 PRO A 52 80.770 42.387 45.050 1.00 0.00 H new ATOM 0 HB3 PRO A 52 79.698 43.772 45.115 1.00 0.00 H new ATOM 0 HG2 PRO A 52 79.162 40.927 46.113 1.00 0.00 H new ATOM 0 HG3 PRO A 52 78.836 42.437 46.939 1.00 0.00 H new ATOM 0 HD2 PRO A 52 76.856 41.145 45.560 1.00 0.00 H new ATOM 0 HD3 PRO A 52 76.900 42.895 45.638 1.00 0.00 H new ATOM 790 N ASP A 53 80.860 41.250 42.256 1.00 0.00 N ATOM 791 CA ASP A 53 81.530 40.249 41.429 1.00 0.00 C ATOM 792 C ASP A 53 82.496 39.331 42.198 1.00 0.00 C ATOM 793 O ASP A 53 83.143 38.468 41.612 1.00 0.00 O ATOM 794 CB ASP A 53 82.174 40.943 40.223 1.00 0.00 C ATOM 795 CG ASP A 53 83.248 41.981 40.558 1.00 0.00 C ATOM 796 OD1 ASP A 53 83.627 42.154 41.736 1.00 0.00 O ATOM 797 OD2 ASP A 53 83.743 42.649 39.618 1.00 0.00 O ATOM 0 H ASP A 53 81.296 42.169 42.177 1.00 0.00 H new ATOM 0 HA ASP A 53 80.772 39.553 41.070 1.00 0.00 H new ATOM 0 HB2 ASP A 53 82.617 40.181 39.581 1.00 0.00 H new ATOM 0 HB3 ASP A 53 81.389 41.431 39.645 1.00 0.00 H new ATOM 802 N SER A 54 82.508 39.451 43.527 1.00 0.00 N ATOM 803 CA SER A 54 83.046 38.449 44.460 1.00 0.00 C ATOM 804 C SER A 54 82.233 37.153 44.528 1.00 0.00 C ATOM 805 O SER A 54 82.687 36.146 45.077 1.00 0.00 O ATOM 806 CB SER A 54 83.138 39.042 45.867 1.00 0.00 C ATOM 807 OG SER A 54 84.468 39.395 46.178 1.00 0.00 O ATOM 0 H SER A 54 82.133 40.272 44.002 1.00 0.00 H new ATOM 0 HA SER A 54 84.030 38.187 44.072 1.00 0.00 H new ATOM 0 HB2 SER A 54 82.498 39.921 45.938 1.00 0.00 H new ATOM 0 HB3 SER A 54 82.769 38.320 46.595 1.00 0.00 H new ATOM 0 HG SER A 54 84.503 39.774 47.081 1.00 0.00 H new ATOM 813 N VAL A 55 81.036 37.160 43.953 1.00 0.00 N ATOM 814 CA VAL A 55 80.239 35.952 43.715 1.00 0.00 C ATOM 815 C VAL A 55 80.908 35.067 42.661 1.00 0.00 C ATOM 816 O VAL A 55 81.655 35.520 41.792 1.00 0.00 O ATOM 817 CB VAL A 55 78.762 36.245 43.374 1.00 0.00 C ATOM 818 CG1 VAL A 55 78.069 37.029 44.495 1.00 0.00 C ATOM 819 CG2 VAL A 55 78.564 36.944 42.028 1.00 0.00 C ATOM 0 H VAL A 55 80.581 38.015 43.633 1.00 0.00 H new ATOM 0 HA VAL A 55 80.209 35.404 44.657 1.00 0.00 H new ATOM 0 HB VAL A 55 78.290 35.267 43.284 1.00 0.00 H new ATOM 0 HG11 VAL A 55 77.031 37.217 44.220 1.00 0.00 H new ATOM 0 HG12 VAL A 55 78.100 36.449 45.418 1.00 0.00 H new ATOM 0 HG13 VAL A 55 78.582 37.979 44.646 1.00 0.00 H new ATOM 0 HG21 VAL A 55 77.501 37.116 41.860 1.00 0.00 H new ATOM 0 HG22 VAL A 55 79.089 37.899 42.033 1.00 0.00 H new ATOM 0 HG23 VAL A 55 78.961 36.316 41.230 1.00 0.00 H new ATOM 829 N THR A 56 80.639 33.776 42.758 1.00 0.00 N ATOM 830 CA THR A 56 81.209 32.717 41.907 1.00 0.00 C ATOM 831 C THR A 56 80.126 31.850 41.295 1.00 0.00 C ATOM 832 O THR A 56 79.110 31.586 41.918 1.00 0.00 O ATOM 833 CB THR A 56 82.208 31.838 42.668 1.00 0.00 C ATOM 834 OG1 THR A 56 82.682 30.802 41.834 1.00 0.00 O ATOM 835 CG2 THR A 56 81.665 31.193 43.945 1.00 0.00 C ATOM 0 H THR A 56 79.992 33.411 43.457 1.00 0.00 H new ATOM 0 HA THR A 56 81.746 33.226 41.106 1.00 0.00 H new ATOM 0 HB THR A 56 83.000 32.525 42.966 1.00 0.00 H new ATOM 0 HG1 THR A 56 83.320 30.249 42.331 1.00 0.00 H new ATOM 0 HG21 THR A 56 82.447 30.592 44.410 1.00 0.00 H new ATOM 0 HG22 THR A 56 81.345 31.971 44.638 1.00 0.00 H new ATOM 0 HG23 THR A 56 80.816 30.556 43.698 1.00 0.00 H new ATOM 843 N LYS A 57 80.330 31.381 40.070 1.00 0.00 N ATOM 844 CA LYS A 57 79.369 30.560 39.343 1.00 0.00 C ATOM 845 C LYS A 57 79.951 29.253 38.803 1.00 0.00 C ATOM 846 O LYS A 57 81.158 29.130 38.573 1.00 0.00 O ATOM 847 CB LYS A 57 78.687 31.383 38.260 1.00 0.00 C ATOM 848 CG LYS A 57 79.517 32.348 37.443 1.00 0.00 C ATOM 849 CD LYS A 57 80.675 31.674 36.694 1.00 0.00 C ATOM 850 CE LYS A 57 81.315 32.565 35.632 1.00 0.00 C ATOM 851 NZ LYS A 57 80.404 32.841 34.493 1.00 0.00 N ATOM 0 H LYS A 57 81.184 31.564 39.544 1.00 0.00 H new ATOM 0 HA LYS A 57 78.616 30.243 40.064 1.00 0.00 H new ATOM 0 HB2 LYS A 57 78.213 30.688 37.567 1.00 0.00 H new ATOM 0 HB3 LYS A 57 77.889 31.954 38.734 1.00 0.00 H new ATOM 0 HG2 LYS A 57 78.872 32.851 36.722 1.00 0.00 H new ATOM 0 HG3 LYS A 57 79.919 33.118 38.102 1.00 0.00 H new ATOM 0 HD2 LYS A 57 81.437 31.375 37.413 1.00 0.00 H new ATOM 0 HD3 LYS A 57 80.309 30.763 36.220 1.00 0.00 H new ATOM 0 HE2 LYS A 57 81.616 33.508 36.088 1.00 0.00 H new ATOM 0 HE3 LYS A 57 82.221 32.087 35.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 80.923 33.348 33.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 80.042 31.943 34.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 79.608 33.425 34.819 1.00 0.00 H new ATOM 865 N CYS A 58 79.063 28.307 38.528 1.00 0.00 N ATOM 866 CA CYS A 58 79.400 26.980 38.009 1.00 0.00 C ATOM 867 C CYS A 58 78.397 26.443 36.965 1.00 0.00 C ATOM 868 O CYS A 58 77.193 26.628 37.106 1.00 0.00 O ATOM 869 CB CYS A 58 79.554 26.027 39.195 1.00 0.00 C ATOM 870 SG CYS A 58 78.149 26.100 40.350 1.00 0.00 S ATOM 0 H CYS A 58 78.061 28.441 38.662 1.00 0.00 H new ATOM 0 HA CYS A 58 80.339 27.058 37.462 1.00 0.00 H new ATOM 0 HB2 CYS A 58 79.660 25.008 38.824 1.00 0.00 H new ATOM 0 HB3 CYS A 58 80.472 26.268 39.731 1.00 0.00 H new ATOM 0 HG CYS A 58 78.347 25.266 41.327 1.00 0.00 H new ATOM 876 N PRO A 59 78.859 25.766 35.900 1.00 0.00 N ATOM 877 CA PRO A 59 77.990 25.343 34.806 1.00 0.00 C ATOM 878 C PRO A 59 77.104 24.148 35.154 1.00 0.00 C ATOM 879 O PRO A 59 77.443 23.305 35.986 1.00 0.00 O ATOM 880 CB PRO A 59 78.915 25.084 33.625 1.00 0.00 C ATOM 881 CG PRO A 59 80.221 24.646 34.294 1.00 0.00 C ATOM 882 CD PRO A 59 80.245 25.439 35.605 1.00 0.00 C ATOM 0 HA PRO A 59 77.261 26.118 34.570 1.00 0.00 H new ATOM 0 HB2 PRO A 59 78.520 24.310 32.967 1.00 0.00 H new ATOM 0 HB3 PRO A 59 79.054 25.979 33.018 1.00 0.00 H new ATOM 0 HG2 PRO A 59 80.236 23.571 34.476 1.00 0.00 H new ATOM 0 HG3 PRO A 59 81.086 24.876 33.672 1.00 0.00 H new ATOM 0 HD2 PRO A 59 80.687 24.851 36.409 1.00 0.00 H new ATOM 0 HD3 PRO A 59 80.846 26.343 35.504 1.00 0.00 H new ATOM 890 N GLU A 60 75.962 24.064 34.472 1.00 0.00 N ATOM 891 CA GLU A 60 75.134 22.865 34.500 1.00 0.00 C ATOM 892 C GLU A 60 75.832 21.672 33.837 1.00 0.00 C ATOM 893 O GLU A 60 76.640 21.819 32.918 1.00 0.00 O ATOM 894 CB GLU A 60 73.830 23.073 33.749 1.00 0.00 C ATOM 895 CG GLU A 60 72.932 24.222 34.219 1.00 0.00 C ATOM 896 CD GLU A 60 72.055 23.861 35.418 1.00 0.00 C ATOM 897 OE1 GLU A 60 71.821 22.664 35.694 1.00 0.00 O ATOM 898 OE2 GLU A 60 71.506 24.767 36.076 1.00 0.00 O ATOM 0 H GLU A 60 75.591 24.817 33.892 1.00 0.00 H new ATOM 0 HA GLU A 60 74.950 22.663 35.555 1.00 0.00 H new ATOM 0 HB2 GLU A 60 74.067 23.237 32.698 1.00 0.00 H new ATOM 0 HB3 GLU A 60 73.255 22.149 33.806 1.00 0.00 H new ATOM 0 HG2 GLU A 60 73.556 25.077 34.480 1.00 0.00 H new ATOM 0 HG3 GLU A 60 72.293 24.534 33.393 1.00 0.00 H new ATOM 905 N LYS A 61 75.445 20.469 34.261 1.00 0.00 N ATOM 906 CA LYS A 61 76.060 19.209 33.828 1.00 0.00 C ATOM 907 C LYS A 61 75.260 18.425 32.807 1.00 0.00 C ATOM 908 O LYS A 61 75.774 18.004 31.780 1.00 0.00 O ATOM 909 CB LYS A 61 76.450 18.392 35.053 1.00 0.00 C ATOM 910 CG LYS A 61 77.626 17.426 34.869 1.00 0.00 C ATOM 911 CD LYS A 61 78.925 18.238 34.747 1.00 0.00 C ATOM 912 CE LYS A 61 80.222 17.410 34.755 1.00 0.00 C ATOM 913 NZ LYS A 61 80.418 16.636 33.506 1.00 0.00 N ATOM 0 H LYS A 61 74.683 20.338 34.926 1.00 0.00 H new ATOM 0 HA LYS A 61 76.962 19.464 33.272 1.00 0.00 H new ATOM 0 HB2 LYS A 61 76.694 19.081 35.862 1.00 0.00 H new ATOM 0 HB3 LYS A 61 75.581 17.818 35.374 1.00 0.00 H new ATOM 0 HG2 LYS A 61 77.688 16.742 35.715 1.00 0.00 H new ATOM 0 HG3 LYS A 61 77.477 16.817 33.977 1.00 0.00 H new ATOM 0 HD2 LYS A 61 78.888 18.815 33.823 1.00 0.00 H new ATOM 0 HD3 LYS A 61 78.965 18.953 35.568 1.00 0.00 H new ATOM 0 HE2 LYS A 61 81.072 18.076 34.901 1.00 0.00 H new ATOM 0 HE3 LYS A 61 80.205 16.725 35.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 81.306 16.098 33.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 79.623 15.978 33.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 80.463 17.288 32.697 1.00 0.00 H new ATOM 927 N ASN A 62 73.975 18.306 33.094 1.00 0.00 N ATOM 928 CA ASN A 62 72.954 17.698 32.253 1.00 0.00 C ATOM 929 C ASN A 62 72.038 18.767 31.629 1.00 0.00 C ATOM 930 O ASN A 62 71.031 18.433 31.006 1.00 0.00 O ATOM 931 CB ASN A 62 72.262 16.613 33.100 1.00 0.00 C ATOM 932 CG ASN A 62 71.854 17.096 34.454 1.00 0.00 C ATOM 933 OD1 ASN A 62 70.876 17.797 34.649 1.00 0.00 O ATOM 934 ND2 ASN A 62 72.629 16.672 35.407 1.00 0.00 N ATOM 0 H ASN A 62 73.592 18.652 33.974 1.00 0.00 H new ATOM 0 HA ASN A 62 73.370 17.203 31.376 1.00 0.00 H new ATOM 0 HB2 ASN A 62 71.381 16.253 32.569 1.00 0.00 H new ATOM 0 HB3 ASN A 62 72.936 15.764 33.212 1.00 0.00 H new ATOM 0 HD21 ASN A 62 72.431 16.924 36.375 1.00 0.00 H new ATOM 0 HD22 ASN A 62 73.435 16.087 35.187 1.00 0.00 H new ATOM 941 N ARG A 63 72.393 20.063 31.772 1.00 0.00 N ATOM 942 CA ARG A 63 71.623 21.183 31.223 1.00 0.00 C ATOM 943 C ARG A 63 72.477 22.283 30.564 1.00 0.00 C ATOM 944 O ARG A 63 72.391 23.435 30.976 1.00 0.00 O ATOM 945 CB ARG A 63 70.657 21.754 32.275 1.00 0.00 C ATOM 946 CG ARG A 63 69.938 20.717 33.140 1.00 0.00 C ATOM 947 CD ARG A 63 68.744 21.322 33.870 1.00 0.00 C ATOM 948 NE ARG A 63 69.139 22.370 34.834 1.00 0.00 N ATOM 949 CZ ARG A 63 68.334 23.250 35.398 1.00 0.00 C ATOM 950 NH1 ARG A 63 67.044 23.169 35.250 1.00 0.00 N ATOM 951 NH2 ARG A 63 68.803 24.233 36.106 1.00 0.00 N ATOM 0 H ARG A 63 73.230 20.355 32.277 1.00 0.00 H new ATOM 0 HA ARG A 63 71.037 20.766 30.404 1.00 0.00 H new ATOM 0 HB2 ARG A 63 71.215 22.424 32.930 1.00 0.00 H new ATOM 0 HB3 ARG A 63 69.907 22.358 31.764 1.00 0.00 H new ATOM 0 HG2 ARG A 63 69.601 19.891 32.514 1.00 0.00 H new ATOM 0 HG3 ARG A 63 70.636 20.302 33.866 1.00 0.00 H new ATOM 0 HD2 ARG A 63 68.054 21.746 33.141 1.00 0.00 H new ATOM 0 HD3 ARG A 63 68.207 20.533 34.396 1.00 0.00 H new ATOM 0 HE ARG A 63 70.126 22.417 35.087 1.00 0.00 H new ATOM 0 HH11 ARG A 63 66.641 22.417 34.691 1.00 0.00 H new ATOM 0 HH12 ARG A 63 66.436 23.858 35.693 1.00 0.00 H new ATOM 0 HH21 ARG A 63 69.810 24.335 36.234 1.00 0.00 H new ATOM 0 HH22 ARG A 63 68.164 24.903 36.534 1.00 0.00 H new ATOM 965 N PRO A 64 73.320 21.969 29.561 1.00 0.00 N ATOM 966 CA PRO A 64 74.478 22.783 29.146 1.00 0.00 C ATOM 967 C PRO A 64 74.161 24.056 28.331 1.00 0.00 C ATOM 968 O PRO A 64 74.963 24.533 27.534 1.00 0.00 O ATOM 969 CB PRO A 64 75.395 21.791 28.420 1.00 0.00 C ATOM 970 CG PRO A 64 74.388 20.853 27.754 1.00 0.00 C ATOM 971 CD PRO A 64 73.287 20.726 28.804 1.00 0.00 C ATOM 0 HA PRO A 64 74.953 23.236 30.017 1.00 0.00 H new ATOM 0 HB2 PRO A 64 76.035 22.287 27.690 1.00 0.00 H new ATOM 0 HB3 PRO A 64 76.051 21.261 29.111 1.00 0.00 H new ATOM 0 HG2 PRO A 64 74.008 21.267 26.820 1.00 0.00 H new ATOM 0 HG3 PRO A 64 74.833 19.886 27.517 1.00 0.00 H new ATOM 0 HD2 PRO A 64 72.314 20.579 28.335 1.00 0.00 H new ATOM 0 HD3 PRO A 64 73.462 19.868 29.453 1.00 0.00 H new ATOM 979 N GLU A 65 72.984 24.618 28.576 1.00 0.00 N ATOM 980 CA GLU A 65 72.381 25.809 27.992 1.00 0.00 C ATOM 981 C GLU A 65 72.306 26.987 28.981 1.00 0.00 C ATOM 982 O GLU A 65 71.750 28.043 28.688 1.00 0.00 O ATOM 983 CB GLU A 65 70.985 25.456 27.438 1.00 0.00 C ATOM 984 CG GLU A 65 70.892 24.119 26.731 1.00 0.00 C ATOM 985 CD GLU A 65 69.566 23.936 25.988 1.00 0.00 C ATOM 986 OE1 GLU A 65 69.485 24.318 24.795 1.00 0.00 O ATOM 987 OE2 GLU A 65 68.612 23.384 26.581 1.00 0.00 O ATOM 0 H GLU A 65 72.359 24.203 29.267 1.00 0.00 H new ATOM 0 HA GLU A 65 73.024 26.144 27.178 1.00 0.00 H new ATOM 0 HB2 GLU A 65 70.272 25.464 28.262 1.00 0.00 H new ATOM 0 HB3 GLU A 65 70.678 26.238 26.744 1.00 0.00 H new ATOM 0 HG2 GLU A 65 71.716 24.028 26.023 1.00 0.00 H new ATOM 0 HG3 GLU A 65 71.009 23.318 27.461 1.00 0.00 H new ATOM 994 N ALA A 66 72.830 26.772 30.187 1.00 0.00 N ATOM 995 CA ALA A 66 72.743 27.641 31.342 1.00 0.00 C ATOM 996 C ALA A 66 73.837 27.274 32.350 1.00 0.00 C ATOM 997 O ALA A 66 74.493 26.230 32.258 1.00 0.00 O ATOM 998 CB ALA A 66 71.356 27.465 31.979 1.00 0.00 C ATOM 0 H ALA A 66 73.362 25.925 30.388 1.00 0.00 H new ATOM 0 HA ALA A 66 72.883 28.680 31.043 1.00 0.00 H new ATOM 0 HB1 ALA A 66 71.272 28.113 32.852 1.00 0.00 H new ATOM 0 HB2 ALA A 66 70.586 27.731 31.254 1.00 0.00 H new ATOM 0 HB3 ALA A 66 71.225 26.427 32.284 1.00 0.00 H new ATOM 1004 N LEU A 67 74.017 28.143 33.337 1.00 0.00 N ATOM 1005 CA LEU A 67 74.867 27.910 34.493 1.00 0.00 C ATOM 1006 C LEU A 67 74.261 28.361 35.825 1.00 0.00 C ATOM 1007 O LEU A 67 73.414 29.248 35.877 1.00 0.00 O ATOM 1008 CB LEU A 67 76.228 28.520 34.182 1.00 0.00 C ATOM 1009 CG LEU A 67 76.408 30.044 34.182 1.00 0.00 C ATOM 1010 CD1 LEU A 67 77.867 30.349 34.529 1.00 0.00 C ATOM 1011 CD2 LEU A 67 76.175 30.643 32.793 1.00 0.00 C ATOM 0 H LEU A 67 73.561 29.055 33.354 1.00 0.00 H new ATOM 0 HA LEU A 67 74.976 26.838 34.655 1.00 0.00 H new ATOM 0 HB2 LEU A 67 76.938 28.111 34.901 1.00 0.00 H new ATOM 0 HB3 LEU A 67 76.527 28.159 33.198 1.00 0.00 H new ATOM 0 HG LEU A 67 75.695 30.464 34.892 1.00 0.00 H new ATOM 0 HD11 LEU A 67 78.022 31.428 34.536 1.00 0.00 H new ATOM 0 HD12 LEU A 67 78.099 29.943 35.514 1.00 0.00 H new ATOM 0 HD13 LEU A 67 78.521 29.893 33.785 1.00 0.00 H new ATOM 0 HD21 LEU A 67 76.312 31.724 32.835 1.00 0.00 H new ATOM 0 HD22 LEU A 67 76.887 30.214 32.088 1.00 0.00 H new ATOM 0 HD23 LEU A 67 75.160 30.418 32.465 1.00 0.00 H new ATOM 1023 N LYS A 68 74.698 27.748 36.922 1.00 0.00 N ATOM 1024 CA LYS A 68 74.331 28.103 38.287 1.00 0.00 C ATOM 1025 C LYS A 68 75.255 29.186 38.822 1.00 0.00 C ATOM 1026 O LYS A 68 76.435 29.212 38.489 1.00 0.00 O ATOM 1027 CB LYS A 68 74.396 26.838 39.138 1.00 0.00 C ATOM 1028 CG LYS A 68 73.528 25.758 38.501 1.00 0.00 C ATOM 1029 CD LYS A 68 73.662 24.525 39.347 1.00 0.00 C ATOM 1030 CE LYS A 68 72.882 23.368 38.730 1.00 0.00 C ATOM 1031 NZ LYS A 68 71.435 23.672 38.595 1.00 0.00 N ATOM 0 H LYS A 68 75.343 26.959 36.881 1.00 0.00 H new ATOM 0 HA LYS A 68 73.319 28.507 38.317 1.00 0.00 H new ATOM 0 HB2 LYS A 68 75.427 26.492 39.218 1.00 0.00 H new ATOM 0 HB3 LYS A 68 74.051 27.048 40.150 1.00 0.00 H new ATOM 0 HG2 LYS A 68 72.488 26.080 38.452 1.00 0.00 H new ATOM 0 HG3 LYS A 68 73.849 25.560 37.478 1.00 0.00 H new ATOM 0 HD2 LYS A 68 74.713 24.254 39.441 1.00 0.00 H new ATOM 0 HD3 LYS A 68 73.293 24.725 40.353 1.00 0.00 H new ATOM 0 HE2 LYS A 68 73.295 23.137 37.748 1.00 0.00 H new ATOM 0 HE3 LYS A 68 73.008 22.478 39.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 70.896 22.784 38.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 71.119 24.229 39.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 71.275 24.217 37.724 1.00 0.00 H new ATOM 1045 N VAL A 69 74.761 30.076 39.671 1.00 0.00 N ATOM 1046 CA VAL A 69 75.571 31.097 40.328 1.00 0.00 C ATOM 1047 C VAL A 69 75.383 31.077 41.857 1.00 0.00 C ATOM 1048 O VAL A 69 74.275 30.900 42.377 1.00 0.00 O ATOM 1049 CB VAL A 69 75.229 32.485 39.775 1.00 0.00 C ATOM 1050 CG1 VAL A 69 76.241 33.506 40.310 1.00 0.00 C ATOM 1051 CG2 VAL A 69 75.145 32.567 38.244 1.00 0.00 C ATOM 0 H VAL A 69 73.774 30.111 39.927 1.00 0.00 H new ATOM 0 HA VAL A 69 76.617 30.873 40.117 1.00 0.00 H new ATOM 0 HB VAL A 69 74.222 32.712 40.125 1.00 0.00 H new ATOM 0 HG11 VAL A 69 76.001 34.495 39.919 1.00 0.00 H new ATOM 0 HG12 VAL A 69 76.197 33.526 41.399 1.00 0.00 H new ATOM 0 HG13 VAL A 69 77.245 33.224 39.993 1.00 0.00 H new ATOM 0 HG21 VAL A 69 74.898 33.586 37.947 1.00 0.00 H new ATOM 0 HG22 VAL A 69 76.105 32.285 37.811 1.00 0.00 H new ATOM 0 HG23 VAL A 69 74.372 31.888 37.885 1.00 0.00 H new ATOM 1061 N SER A 70 76.486 31.315 42.559 1.00 0.00 N ATOM 1062 CA SER A 70 76.628 31.181 44.014 1.00 0.00 C ATOM 1063 C SER A 70 77.236 32.414 44.706 1.00 0.00 C ATOM 1064 O SER A 70 78.202 33.015 44.228 1.00 0.00 O ATOM 1065 CB SER A 70 77.511 29.976 44.324 1.00 0.00 C ATOM 1066 OG SER A 70 77.273 28.869 43.470 1.00 0.00 O ATOM 0 H SER A 70 77.350 31.622 42.112 1.00 0.00 H new ATOM 0 HA SER A 70 75.617 31.063 44.404 1.00 0.00 H new ATOM 0 HB2 SER A 70 78.557 30.271 44.242 1.00 0.00 H new ATOM 0 HB3 SER A 70 77.346 29.670 45.357 1.00 0.00 H new ATOM 0 HG SER A 70 77.869 28.131 43.717 1.00 0.00 H new ATOM 1072 N CYS A 71 76.754 32.726 45.910 1.00 0.00 N ATOM 1073 CA CYS A 71 77.365 33.717 46.785 1.00 0.00 C ATOM 1074 C CYS A 71 78.460 33.033 47.629 1.00 0.00 C ATOM 1075 O CYS A 71 78.250 32.641 48.773 1.00 0.00 O ATOM 1076 CB CYS A 71 76.273 34.423 47.611 1.00 0.00 C ATOM 1077 SG CYS A 71 77.036 35.790 48.525 1.00 0.00 S ATOM 0 H CYS A 71 75.920 32.291 46.305 1.00 0.00 H new ATOM 0 HA CYS A 71 77.859 34.503 46.215 1.00 0.00 H new ATOM 0 HB2 CYS A 71 75.486 34.798 46.957 1.00 0.00 H new ATOM 0 HB3 CYS A 71 75.806 33.720 48.301 1.00 0.00 H new ATOM 1082 N GLY A 72 79.646 32.858 47.045 1.00 0.00 N ATOM 1083 CA GLY A 72 80.838 32.399 47.774 1.00 0.00 C ATOM 1084 C GLY A 72 81.550 33.518 48.560 1.00 0.00 C ATOM 1085 O GLY A 72 82.648 33.297 49.079 1.00 0.00 O ATOM 0 H GLY A 72 79.812 33.029 46.053 1.00 0.00 H new ATOM 0 HA2 GLY A 72 80.548 31.608 48.466 1.00 0.00 H new ATOM 0 HA3 GLY A 72 81.541 31.961 47.065 1.00 0.00 H new ATOM 1089 N LYS A 73 80.941 34.710 48.647 1.00 0.00 N ATOM 1090 CA LYS A 73 81.242 35.748 49.644 1.00 0.00 C ATOM 1091 C LYS A 73 81.021 35.228 51.063 1.00 0.00 C ATOM 1092 O LYS A 73 81.850 35.445 51.942 1.00 0.00 O ATOM 1093 CB LYS A 73 80.325 36.950 49.414 1.00 0.00 C ATOM 1094 CG LYS A 73 81.080 38.269 49.184 1.00 0.00 C ATOM 1095 CD LYS A 73 80.343 39.406 49.897 1.00 0.00 C ATOM 1096 CE LYS A 73 80.898 40.799 49.572 1.00 0.00 C ATOM 1097 NZ LYS A 73 82.243 41.036 50.147 1.00 0.00 N ATOM 0 H LYS A 73 80.200 34.987 48.003 1.00 0.00 H new ATOM 0 HA LYS A 73 82.288 36.035 49.533 1.00 0.00 H new ATOM 0 HB2 LYS A 73 79.689 36.751 48.551 1.00 0.00 H new ATOM 0 HB3 LYS A 73 79.667 37.064 50.276 1.00 0.00 H new ATOM 0 HG2 LYS A 73 82.099 38.188 49.561 1.00 0.00 H new ATOM 0 HG3 LYS A 73 81.151 38.479 48.117 1.00 0.00 H new ATOM 0 HD2 LYS A 73 79.288 39.372 49.623 1.00 0.00 H new ATOM 0 HD3 LYS A 73 80.398 39.244 50.974 1.00 0.00 H new ATOM 0 HE2 LYS A 73 80.945 40.922 48.490 1.00 0.00 H new ATOM 0 HE3 LYS A 73 80.209 41.555 49.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 82.565 41.992 49.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 82.198 40.948 51.182 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 82.911 40.334 49.768 1.00 0.00 H new ATOM 1111 N CYS A 74 79.883 34.569 51.237 1.00 0.00 N ATOM 1112 CA CYS A 74 79.239 34.287 52.502 1.00 0.00 C ATOM 1113 C CYS A 74 78.788 32.811 52.644 1.00 0.00 C ATOM 1114 O CYS A 74 78.755 32.267 53.753 1.00 0.00 O ATOM 1115 CB CYS A 74 78.106 35.308 52.515 1.00 0.00 C ATOM 1116 SG CYS A 74 77.042 35.206 51.039 1.00 0.00 S ATOM 0 H CYS A 74 79.357 34.196 50.446 1.00 0.00 H new ATOM 0 HA CYS A 74 79.896 34.385 53.366 1.00 0.00 H new ATOM 0 HB2 CYS A 74 77.497 35.156 53.406 1.00 0.00 H new ATOM 0 HB3 CYS A 74 78.528 36.311 52.584 1.00 0.00 H new ATOM 1121 N GLY A 75 78.516 32.159 51.512 1.00 0.00 N ATOM 1122 CA GLY A 75 78.345 30.716 51.358 1.00 0.00 C ATOM 1123 C GLY A 75 76.897 30.314 51.067 1.00 0.00 C ATOM 1124 O GLY A 75 76.254 29.611 51.848 1.00 0.00 O ATOM 0 H GLY A 75 78.403 32.654 50.628 1.00 0.00 H new ATOM 0 HA2 GLY A 75 78.984 30.364 50.548 1.00 0.00 H new ATOM 0 HA3 GLY A 75 78.679 30.217 52.267 1.00 0.00 H new ATOM 1128 N ASN A 76 76.356 30.744 49.927 1.00 0.00 N ATOM 1129 CA ASN A 76 75.154 30.238 49.316 1.00 0.00 C ATOM 1130 C ASN A 76 75.485 29.883 47.855 1.00 0.00 C ATOM 1131 O ASN A 76 76.532 30.264 47.349 1.00 0.00 O ATOM 1132 CB ASN A 76 74.086 31.303 49.492 1.00 0.00 C ATOM 1133 CG ASN A 76 72.669 30.769 49.414 1.00 0.00 C ATOM 1134 OD1 ASN A 76 72.437 29.566 49.442 1.00 0.00 O ATOM 1135 ND2 ASN A 76 71.684 31.630 49.312 1.00 0.00 N ATOM 0 H ASN A 76 76.778 31.498 49.385 1.00 0.00 H new ATOM 0 HA ASN A 76 74.769 29.325 49.770 1.00 0.00 H new ATOM 0 HB2 ASN A 76 74.228 31.790 50.457 1.00 0.00 H new ATOM 0 HB3 ASN A 76 74.219 32.067 48.726 1.00 0.00 H new ATOM 0 HD21 ASN A 76 70.721 31.299 49.256 1.00 0.00 H new ATOM 0 HD22 ASN A 76 71.881 32.630 49.289 1.00 0.00 H new ATOM 1142 N GLY A 77 74.605 29.177 47.161 1.00 0.00 N ATOM 1143 CA GLY A 77 74.869 28.522 45.886 1.00 0.00 C ATOM 1144 C GLY A 77 73.686 27.742 45.341 1.00 0.00 C ATOM 1145 O GLY A 77 73.574 26.528 45.505 1.00 0.00 O ATOM 0 H GLY A 77 73.647 29.038 47.483 1.00 0.00 H new ATOM 0 HA2 GLY A 77 75.163 29.275 45.155 1.00 0.00 H new ATOM 0 HA3 GLY A 77 75.715 27.845 46.004 1.00 0.00 H new ATOM 1149 N LEU A 78 72.763 28.512 44.772 1.00 0.00 N ATOM 1150 CA LEU A 78 71.407 28.085 44.400 1.00 0.00 C ATOM 1151 C LEU A 78 70.762 28.775 43.187 1.00 0.00 C ATOM 1152 O LEU A 78 69.756 28.304 42.664 1.00 0.00 O ATOM 1153 CB LEU A 78 70.528 28.339 45.628 1.00 0.00 C ATOM 1154 CG LEU A 78 70.166 29.791 46.013 1.00 0.00 C ATOM 1155 CD1 LEU A 78 69.473 29.751 47.376 1.00 0.00 C ATOM 1156 CD2 LEU A 78 71.349 30.752 46.131 1.00 0.00 C ATOM 0 H LEU A 78 72.941 29.491 44.546 1.00 0.00 H new ATOM 0 HA LEU A 78 71.489 27.042 44.094 1.00 0.00 H new ATOM 0 HB2 LEU A 78 69.594 27.797 45.480 1.00 0.00 H new ATOM 0 HB3 LEU A 78 71.026 27.887 46.486 1.00 0.00 H new ATOM 0 HG LEU A 78 69.542 30.170 45.204 1.00 0.00 H new ATOM 0 HD11 LEU A 78 69.204 30.763 47.677 1.00 0.00 H new ATOM 0 HD12 LEU A 78 68.572 29.141 47.308 1.00 0.00 H new ATOM 0 HD13 LEU A 78 70.148 29.320 48.115 1.00 0.00 H new ATOM 0 HD21 LEU A 78 70.987 31.743 46.405 1.00 0.00 H new ATOM 0 HD22 LEU A 78 72.035 30.392 46.897 1.00 0.00 H new ATOM 0 HD23 LEU A 78 71.870 30.807 45.175 1.00 0.00 H new ATOM 1168 N GLY A 79 71.281 29.938 42.808 1.00 0.00 N ATOM 1169 CA GLY A 79 70.772 30.723 41.683 1.00 0.00 C ATOM 1170 C GLY A 79 71.376 30.292 40.350 1.00 0.00 C ATOM 1171 O GLY A 79 72.154 29.347 40.272 1.00 0.00 O ATOM 0 H GLY A 79 72.077 30.370 43.278 1.00 0.00 H new ATOM 0 HA2 GLY A 79 69.688 30.624 41.636 1.00 0.00 H new ATOM 0 HA3 GLY A 79 70.989 31.778 41.852 1.00 0.00 H new ATOM 1175 N HIS A 80 70.993 30.992 39.292 1.00 0.00 N ATOM 1176 CA HIS A 80 71.255 30.674 37.902 1.00 0.00 C ATOM 1177 C HIS A 80 71.436 31.927 37.023 1.00 0.00 C ATOM 1178 O HIS A 80 70.868 32.987 37.273 1.00 0.00 O ATOM 1179 CB HIS A 80 70.074 29.870 37.376 1.00 0.00 C ATOM 1180 CG HIS A 80 69.812 28.533 38.036 1.00 0.00 C ATOM 1181 ND1 HIS A 80 69.072 28.321 39.179 1.00 0.00 N ATOM 1182 CD2 HIS A 80 70.239 27.304 37.610 1.00 0.00 C ATOM 1183 CE1 HIS A 80 69.079 27.007 39.450 1.00 0.00 C ATOM 1184 NE2 HIS A 80 69.764 26.334 38.509 1.00 0.00 N ATOM 0 H HIS A 80 70.456 31.853 39.392 1.00 0.00 H new ATOM 0 HA HIS A 80 72.188 30.113 37.854 1.00 0.00 H new ATOM 0 HB2 HIS A 80 69.176 30.480 37.475 1.00 0.00 H new ATOM 0 HB3 HIS A 80 70.227 29.699 36.310 1.00 0.00 H new ATOM 0 HD1 HIS A 80 68.599 29.041 39.726 1.00 0.00 H new ATOM 0 HD2 HIS A 80 70.839 27.113 36.732 1.00 0.00 H new ATOM 0 HE1 HIS A 80 68.601 26.553 40.305 1.00 0.00 H new ATOM 1192 N GLU A 81 72.164 31.757 35.928 1.00 0.00 N ATOM 1193 CA GLU A 81 72.441 32.668 34.836 1.00 0.00 C ATOM 1194 C GLU A 81 72.318 31.833 33.560 1.00 0.00 C ATOM 1195 O GLU A 81 72.951 30.788 33.418 1.00 0.00 O ATOM 1196 CB GLU A 81 73.864 33.199 35.003 1.00 0.00 C ATOM 1197 CG GLU A 81 74.303 34.164 33.892 1.00 0.00 C ATOM 1198 CD GLU A 81 75.792 34.545 33.960 1.00 0.00 C ATOM 1199 OE1 GLU A 81 76.589 33.911 34.692 1.00 0.00 O ATOM 1200 OE2 GLU A 81 76.186 35.491 33.237 1.00 0.00 O ATOM 0 H GLU A 81 72.630 30.864 35.770 1.00 0.00 H new ATOM 0 HA GLU A 81 71.762 33.520 34.806 1.00 0.00 H new ATOM 0 HB2 GLU A 81 73.941 33.708 35.964 1.00 0.00 H new ATOM 0 HB3 GLU A 81 74.555 32.356 35.032 1.00 0.00 H new ATOM 0 HG2 GLU A 81 74.097 33.708 32.924 1.00 0.00 H new ATOM 0 HG3 GLU A 81 73.701 35.071 33.951 1.00 0.00 H new ATOM 1207 N PHE A 82 71.467 32.249 32.639 1.00 0.00 N ATOM 1208 CA PHE A 82 71.202 31.474 31.422 1.00 0.00 C ATOM 1209 C PHE A 82 72.034 32.039 30.262 1.00 0.00 C ATOM 1210 O PHE A 82 71.887 33.207 29.895 1.00 0.00 O ATOM 1211 CB PHE A 82 69.687 31.469 31.166 1.00 0.00 C ATOM 1212 CG PHE A 82 69.225 30.634 29.988 1.00 0.00 C ATOM 1213 CD1 PHE A 82 69.265 31.167 28.686 1.00 0.00 C ATOM 1214 CD2 PHE A 82 68.728 29.334 30.194 1.00 0.00 C ATOM 1215 CE1 PHE A 82 68.834 30.392 27.595 1.00 0.00 C ATOM 1216 CE2 PHE A 82 68.315 28.551 29.102 1.00 0.00 C ATOM 1217 CZ PHE A 82 68.374 29.079 27.801 1.00 0.00 C ATOM 0 H PHE A 82 70.942 33.121 32.704 1.00 0.00 H new ATOM 0 HA PHE A 82 71.509 30.434 31.530 1.00 0.00 H new ATOM 0 HB2 PHE A 82 69.186 31.107 32.064 1.00 0.00 H new ATOM 0 HB3 PHE A 82 69.359 32.497 31.011 1.00 0.00 H new ATOM 0 HD1 PHE A 82 69.627 32.172 28.525 1.00 0.00 H new ATOM 0 HD2 PHE A 82 68.663 28.936 31.196 1.00 0.00 H new ATOM 0 HE1 PHE A 82 68.856 30.805 26.598 1.00 0.00 H new ATOM 0 HE2 PHE A 82 67.953 27.546 29.262 1.00 0.00 H new ATOM 0 HZ PHE A 82 68.066 28.476 26.959 1.00 0.00 H new ATOM 1227 N LEU A 83 72.962 31.237 29.726 1.00 0.00 N ATOM 1228 CA LEU A 83 74.047 31.703 28.859 1.00 0.00 C ATOM 1229 C LEU A 83 74.597 30.572 27.976 1.00 0.00 C ATOM 1230 O LEU A 83 74.425 29.390 28.255 1.00 0.00 O ATOM 1231 CB LEU A 83 75.171 32.286 29.748 1.00 0.00 C ATOM 1232 CG LEU A 83 76.169 33.250 29.076 1.00 0.00 C ATOM 1233 CD1 LEU A 83 75.488 34.502 28.519 1.00 0.00 C ATOM 1234 CD2 LEU A 83 77.223 33.684 30.092 1.00 0.00 C ATOM 0 H LEU A 83 72.979 30.230 29.886 1.00 0.00 H new ATOM 0 HA LEU A 83 73.658 32.470 28.189 1.00 0.00 H new ATOM 0 HB2 LEU A 83 74.705 32.809 30.583 1.00 0.00 H new ATOM 0 HB3 LEU A 83 75.735 31.454 30.169 1.00 0.00 H new ATOM 0 HG LEU A 83 76.623 32.712 28.244 1.00 0.00 H new ATOM 0 HD11 LEU A 83 76.235 35.147 28.057 1.00 0.00 H new ATOM 0 HD12 LEU A 83 74.747 34.212 27.774 1.00 0.00 H new ATOM 0 HD13 LEU A 83 74.996 35.040 29.330 1.00 0.00 H new ATOM 0 HD21 LEU A 83 77.928 34.365 29.616 1.00 0.00 H new ATOM 0 HD22 LEU A 83 76.737 34.189 30.927 1.00 0.00 H new ATOM 0 HD23 LEU A 83 77.757 32.808 30.459 1.00 0.00 H new ATOM 1246 N ASN A 84 75.321 30.956 26.925 1.00 0.00 N ATOM 1247 CA ASN A 84 75.899 30.130 25.855 1.00 0.00 C ATOM 1248 C ASN A 84 74.876 29.553 24.861 1.00 0.00 C ATOM 1249 O ASN A 84 75.234 29.135 23.767 1.00 0.00 O ATOM 1250 CB ASN A 84 76.896 29.098 26.393 1.00 0.00 C ATOM 1251 CG ASN A 84 77.748 29.537 27.542 1.00 0.00 C ATOM 1252 OD1 ASN A 84 78.800 30.142 27.424 1.00 0.00 O ATOM 1253 ND2 ASN A 84 77.317 29.145 28.707 1.00 0.00 N ATOM 0 H ASN A 84 75.540 31.942 26.784 1.00 0.00 H new ATOM 0 HA ASN A 84 76.477 30.820 25.241 1.00 0.00 H new ATOM 0 HB2 ASN A 84 76.340 28.212 26.698 1.00 0.00 H new ATOM 0 HB3 ASN A 84 77.552 28.797 25.576 1.00 0.00 H new ATOM 0 HD21 ASN A 84 77.863 29.343 29.546 1.00 0.00 H new ATOM 0 HD22 ASN A 84 76.434 28.640 28.781 1.00 0.00 H new ATOM 1260 N ASP A 85 73.596 29.678 25.198 1.00 0.00 N ATOM 1261 CA ASP A 85 72.440 29.477 24.311 1.00 0.00 C ATOM 1262 C ASP A 85 72.022 30.769 23.582 1.00 0.00 C ATOM 1263 O ASP A 85 71.330 30.736 22.566 1.00 0.00 O ATOM 1264 CB ASP A 85 71.272 28.939 25.150 1.00 0.00 C ATOM 1265 CG ASP A 85 70.016 28.671 24.311 1.00 0.00 C ATOM 1266 OD1 ASP A 85 70.008 27.686 23.539 1.00 0.00 O ATOM 1267 OD2 ASP A 85 69.030 29.437 24.401 1.00 0.00 O ATOM 0 H ASP A 85 73.316 29.935 26.144 1.00 0.00 H new ATOM 0 HA ASP A 85 72.721 28.763 23.537 1.00 0.00 H new ATOM 0 HB2 ASP A 85 71.579 28.016 25.643 1.00 0.00 H new ATOM 0 HB3 ASP A 85 71.033 29.656 25.935 1.00 0.00 H new ATOM 1272 N GLY A 86 72.431 31.925 24.118 1.00 0.00 N ATOM 1273 CA GLY A 86 71.915 33.245 23.797 1.00 0.00 C ATOM 1274 C GLY A 86 72.941 34.175 23.139 1.00 0.00 C ATOM 1275 O GLY A 86 73.370 35.132 23.784 1.00 0.00 O ATOM 0 H GLY A 86 73.168 31.958 24.822 1.00 0.00 H new ATOM 0 HA2 GLY A 86 71.059 33.137 23.131 1.00 0.00 H new ATOM 0 HA3 GLY A 86 71.550 33.713 24.711 1.00 0.00 H new ATOM 1279 N PRO A 87 73.312 33.960 21.862 1.00 0.00 N ATOM 1280 CA PRO A 87 74.093 34.929 21.085 1.00 0.00 C ATOM 1281 C PRO A 87 73.257 36.167 20.690 1.00 0.00 C ATOM 1282 O PRO A 87 73.798 37.188 20.267 1.00 0.00 O ATOM 1283 CB PRO A 87 74.562 34.119 19.874 1.00 0.00 C ATOM 1284 CG PRO A 87 73.402 33.166 19.608 1.00 0.00 C ATOM 1285 CD PRO A 87 72.932 32.829 21.021 1.00 0.00 C ATOM 0 HA PRO A 87 74.926 35.351 21.647 1.00 0.00 H new ATOM 0 HB2 PRO A 87 74.759 34.760 19.015 1.00 0.00 H new ATOM 0 HB3 PRO A 87 75.484 33.578 20.086 1.00 0.00 H new ATOM 0 HG2 PRO A 87 72.615 33.637 19.018 1.00 0.00 H new ATOM 0 HG3 PRO A 87 73.721 32.278 19.062 1.00 0.00 H new ATOM 0 HD2 PRO A 87 71.854 32.672 21.045 1.00 0.00 H new ATOM 0 HD3 PRO A 87 73.396 31.908 21.375 1.00 0.00 H new ATOM 1293 N LYS A 88 71.935 36.063 20.863 1.00 0.00 N ATOM 1294 CA LYS A 88 70.877 37.050 20.669 1.00 0.00 C ATOM 1295 C LYS A 88 70.909 38.062 21.810 1.00 0.00 C ATOM 1296 O LYS A 88 70.310 37.856 22.863 1.00 0.00 O ATOM 1297 CB LYS A 88 69.530 36.308 20.577 1.00 0.00 C ATOM 1298 CG LYS A 88 69.440 35.493 19.283 1.00 0.00 C ATOM 1299 CD LYS A 88 68.283 34.491 19.253 1.00 0.00 C ATOM 1300 CE LYS A 88 68.549 33.336 20.227 1.00 0.00 C ATOM 1301 NZ LYS A 88 67.669 32.176 19.974 1.00 0.00 N ATOM 0 H LYS A 88 71.539 35.178 21.180 1.00 0.00 H new ATOM 0 HA LYS A 88 71.022 37.607 19.743 1.00 0.00 H new ATOM 0 HB2 LYS A 88 69.415 35.647 21.436 1.00 0.00 H new ATOM 0 HB3 LYS A 88 68.711 37.027 20.616 1.00 0.00 H new ATOM 0 HG2 LYS A 88 69.335 36.178 18.442 1.00 0.00 H new ATOM 0 HG3 LYS A 88 70.377 34.954 19.140 1.00 0.00 H new ATOM 0 HD2 LYS A 88 67.353 34.992 19.519 1.00 0.00 H new ATOM 0 HD3 LYS A 88 68.157 34.101 18.243 1.00 0.00 H new ATOM 0 HE2 LYS A 88 69.590 33.025 20.143 1.00 0.00 H new ATOM 0 HE3 LYS A 88 68.402 33.685 21.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 67.885 31.421 20.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 66.675 32.464 20.080 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 67.826 31.825 19.008 1.00 0.00 H new ATOM 1315 N ARG A 89 71.704 39.107 21.603 1.00 0.00 N ATOM 1316 CA ARG A 89 71.892 40.258 22.493 1.00 0.00 C ATOM 1317 C ARG A 89 70.687 41.221 22.532 1.00 0.00 C ATOM 1318 O ARG A 89 69.544 40.821 22.334 1.00 0.00 O ATOM 1319 CB ARG A 89 73.260 40.917 22.219 1.00 0.00 C ATOM 1320 CG ARG A 89 74.374 40.318 23.058 1.00 0.00 C ATOM 1321 CD ARG A 89 74.904 41.278 24.131 1.00 0.00 C ATOM 1322 NE ARG A 89 75.957 40.647 24.945 1.00 0.00 N ATOM 1323 CZ ARG A 89 77.191 41.074 25.160 1.00 0.00 C ATOM 1324 NH1 ARG A 89 77.693 42.163 24.651 1.00 0.00 N ATOM 1325 NH2 ARG A 89 77.984 40.385 25.920 1.00 0.00 N ATOM 0 H ARG A 89 72.271 39.182 20.759 1.00 0.00 H new ATOM 0 HA ARG A 89 71.922 39.897 23.521 1.00 0.00 H new ATOM 0 HB2 ARG A 89 73.507 40.808 21.163 1.00 0.00 H new ATOM 0 HB3 ARG A 89 73.192 41.986 22.422 1.00 0.00 H new ATOM 0 HG2 ARG A 89 74.010 39.410 23.539 1.00 0.00 H new ATOM 0 HG3 ARG A 89 75.195 40.025 22.404 1.00 0.00 H new ATOM 0 HD2 ARG A 89 75.299 42.176 23.655 1.00 0.00 H new ATOM 0 HD3 ARG A 89 74.084 41.594 24.776 1.00 0.00 H new ATOM 0 HE ARG A 89 75.703 39.770 25.400 1.00 0.00 H new ATOM 0 HH11 ARG A 89 77.124 42.750 24.041 1.00 0.00 H new ATOM 0 HH12 ARG A 89 78.655 42.429 24.862 1.00 0.00 H new ATOM 0 HH21 ARG A 89 77.656 39.519 26.348 1.00 0.00 H new ATOM 0 HH22 ARG A 89 78.936 40.709 26.090 1.00 0.00 H new ATOM 1339 N GLY A 90 70.965 42.434 23.021 1.00 0.00 N ATOM 1340 CA GLY A 90 70.068 43.311 23.754 1.00 0.00 C ATOM 1341 C GLY A 90 69.924 42.880 25.217 1.00 0.00 C ATOM 1342 O GLY A 90 69.152 43.467 25.973 1.00 0.00 O ATOM 0 H GLY A 90 71.889 42.851 22.903 1.00 0.00 H new ATOM 0 HA2 GLY A 90 70.443 44.333 23.711 1.00 0.00 H new ATOM 0 HA3 GLY A 90 69.088 43.311 23.276 1.00 0.00 H new ATOM 1346 N GLN A 91 70.630 41.800 25.579 1.00 0.00 N ATOM 1347 CA GLN A 91 70.119 40.815 26.513 1.00 0.00 C ATOM 1348 C GLN A 91 71.136 40.190 27.483 1.00 0.00 C ATOM 1349 O GLN A 91 72.344 40.190 27.248 1.00 0.00 O ATOM 1350 CB GLN A 91 69.398 39.735 25.698 1.00 0.00 C ATOM 1351 CG GLN A 91 67.993 40.161 25.282 1.00 0.00 C ATOM 1352 CD GLN A 91 67.279 39.063 24.514 1.00 0.00 C ATOM 1353 OE1 GLN A 91 66.685 38.170 25.105 1.00 0.00 O ATOM 1354 NE2 GLN A 91 67.326 39.083 23.203 1.00 0.00 N ATOM 0 H GLN A 91 71.566 41.595 25.229 1.00 0.00 H new ATOM 0 HA GLN A 91 69.448 41.348 27.186 1.00 0.00 H new ATOM 0 HB2 GLN A 91 69.983 39.504 24.808 1.00 0.00 H new ATOM 0 HB3 GLN A 91 69.338 38.819 26.286 1.00 0.00 H new ATOM 0 HG2 GLN A 91 67.414 40.421 26.168 1.00 0.00 H new ATOM 0 HG3 GLN A 91 68.052 41.058 24.665 1.00 0.00 H new ATOM 0 HE21 GLN A 91 67.824 39.832 22.722 1.00 0.00 H new ATOM 0 HE22 GLN A 91 66.865 38.350 22.665 1.00 0.00 H new ATOM 1363 N SER A 92 70.593 39.620 28.557 1.00 0.00 N ATOM 1364 CA SER A 92 71.161 39.089 29.784 1.00 0.00 C ATOM 1365 C SER A 92 69.959 38.399 30.463 1.00 0.00 C ATOM 1366 O SER A 92 68.819 38.831 30.271 1.00 0.00 O ATOM 1367 CB SER A 92 71.693 40.238 30.661 1.00 0.00 C ATOM 1368 OG SER A 92 70.770 41.312 30.686 1.00 0.00 O ATOM 0 H SER A 92 69.580 39.506 28.582 1.00 0.00 H new ATOM 0 HA SER A 92 72.000 38.413 29.617 1.00 0.00 H new ATOM 0 HB2 SER A 92 71.869 39.878 31.675 1.00 0.00 H new ATOM 0 HB3 SER A 92 72.652 40.584 30.275 1.00 0.00 H new ATOM 0 HG SER A 92 71.218 42.121 31.009 1.00 0.00 H new ATOM 1374 N ARG A 93 70.163 37.268 31.140 1.00 0.00 N ATOM 1375 CA ARG A 93 69.125 36.521 31.889 1.00 0.00 C ATOM 1376 C ARG A 93 69.673 35.929 33.198 1.00 0.00 C ATOM 1377 O ARG A 93 70.652 35.180 33.172 1.00 0.00 O ATOM 1378 CB ARG A 93 68.542 35.387 31.020 1.00 0.00 C ATOM 1379 CG ARG A 93 67.866 35.802 29.701 1.00 0.00 C ATOM 1380 CD ARG A 93 66.587 36.640 29.857 1.00 0.00 C ATOM 1381 NE ARG A 93 66.088 37.038 28.523 1.00 0.00 N ATOM 1382 CZ ARG A 93 64.996 36.610 27.918 1.00 0.00 C ATOM 1383 NH1 ARG A 93 64.051 35.973 28.544 1.00 0.00 N ATOM 1384 NH2 ARG A 93 64.833 36.805 26.648 1.00 0.00 N ATOM 0 H ARG A 93 71.080 36.824 31.190 1.00 0.00 H new ATOM 0 HA ARG A 93 68.339 37.234 32.140 1.00 0.00 H new ATOM 0 HB2 ARG A 93 69.347 34.691 30.785 1.00 0.00 H new ATOM 0 HB3 ARG A 93 67.813 34.841 31.618 1.00 0.00 H new ATOM 0 HG2 ARG A 93 68.583 36.369 29.107 1.00 0.00 H new ATOM 0 HG3 ARG A 93 67.625 34.902 29.136 1.00 0.00 H new ATOM 0 HD2 ARG A 93 65.826 36.065 30.384 1.00 0.00 H new ATOM 0 HD3 ARG A 93 66.792 37.525 30.459 1.00 0.00 H new ATOM 0 HE ARG A 93 66.651 37.719 28.014 1.00 0.00 H new ATOM 0 HH11 ARG A 93 64.137 35.786 29.543 1.00 0.00 H new ATOM 0 HH12 ARG A 93 63.224 35.660 28.036 1.00 0.00 H new ATOM 0 HH21 ARG A 93 65.551 37.291 26.110 1.00 0.00 H new ATOM 0 HH22 ARG A 93 63.987 36.472 26.185 1.00 0.00 H new ATOM 1398 N PHE A 94 69.011 36.206 34.322 1.00 0.00 N ATOM 1399 CA PHE A 94 69.406 35.792 35.678 1.00 0.00 C ATOM 1400 C PHE A 94 68.192 35.356 36.520 1.00 0.00 C ATOM 1401 O PHE A 94 67.148 36.005 36.487 1.00 0.00 O ATOM 1402 CB PHE A 94 70.150 36.971 36.324 1.00 0.00 C ATOM 1403 CG PHE A 94 70.604 36.753 37.757 1.00 0.00 C ATOM 1404 CD1 PHE A 94 71.667 35.873 38.031 1.00 0.00 C ATOM 1405 CD2 PHE A 94 69.998 37.465 38.812 1.00 0.00 C ATOM 1406 CE1 PHE A 94 72.123 35.701 39.349 1.00 0.00 C ATOM 1407 CE2 PHE A 94 70.460 37.300 40.131 1.00 0.00 C ATOM 1408 CZ PHE A 94 71.525 36.421 40.398 1.00 0.00 C ATOM 0 H PHE A 94 68.147 36.748 34.317 1.00 0.00 H new ATOM 0 HA PHE A 94 70.058 34.920 35.626 1.00 0.00 H new ATOM 0 HB2 PHE A 94 71.024 37.203 35.716 1.00 0.00 H new ATOM 0 HB3 PHE A 94 69.501 37.846 36.296 1.00 0.00 H new ATOM 0 HD1 PHE A 94 72.135 35.327 37.225 1.00 0.00 H new ATOM 0 HD2 PHE A 94 69.178 38.138 38.608 1.00 0.00 H new ATOM 0 HE1 PHE A 94 72.932 35.016 39.556 1.00 0.00 H new ATOM 0 HE2 PHE A 94 69.997 37.848 40.938 1.00 0.00 H new ATOM 0 HZ PHE A 94 71.884 36.299 41.409 1.00 0.00 H new ATOM 1418 N CYS A 95 68.299 34.263 37.283 1.00 0.00 N ATOM 1419 CA CYS A 95 67.215 33.737 38.122 1.00 0.00 C ATOM 1420 C CYS A 95 67.720 33.154 39.455 1.00 0.00 C ATOM 1421 O CYS A 95 68.552 32.251 39.469 1.00 0.00 O ATOM 1422 CB CYS A 95 66.454 32.691 37.302 1.00 0.00 C ATOM 1423 SG CYS A 95 64.928 32.233 38.175 1.00 0.00 S ATOM 0 H CYS A 95 69.154 33.710 37.336 1.00 0.00 H new ATOM 0 HA CYS A 95 66.552 34.556 38.403 1.00 0.00 H new ATOM 0 HB2 CYS A 95 66.216 33.089 36.315 1.00 0.00 H new ATOM 0 HB3 CYS A 95 67.077 31.810 37.149 1.00 0.00 H new ATOM 0 HG CYS A 95 64.115 33.247 38.188 1.00 0.00 H new ATOM 1429 N ILE A 96 67.209 33.640 40.589 1.00 0.00 N ATOM 1430 CA ILE A 96 67.628 33.240 41.940 1.00 0.00 C ATOM 1431 C ILE A 96 66.440 32.803 42.809 1.00 0.00 C ATOM 1432 O ILE A 96 65.294 33.180 42.568 1.00 0.00 O ATOM 1433 CB ILE A 96 68.415 34.409 42.563 1.00 0.00 C ATOM 1434 CG1 ILE A 96 69.335 33.944 43.712 1.00 0.00 C ATOM 1435 CG2 ILE A 96 67.514 35.584 42.986 1.00 0.00 C ATOM 1436 CD1 ILE A 96 70.367 35.000 44.123 1.00 0.00 C ATOM 0 H ILE A 96 66.470 34.343 40.596 1.00 0.00 H new ATOM 0 HA ILE A 96 68.272 32.363 41.880 1.00 0.00 H new ATOM 0 HB ILE A 96 69.059 34.791 41.771 1.00 0.00 H new ATOM 0 HG12 ILE A 96 68.724 33.687 44.577 1.00 0.00 H new ATOM 0 HG13 ILE A 96 69.855 33.036 43.408 1.00 0.00 H new ATOM 0 HG21 ILE A 96 68.127 36.375 43.417 1.00 0.00 H new ATOM 0 HG22 ILE A 96 66.985 35.969 42.114 1.00 0.00 H new ATOM 0 HG23 ILE A 96 66.791 35.240 43.726 1.00 0.00 H new ATOM 0 HD11 ILE A 96 70.982 34.611 44.935 1.00 0.00 H new ATOM 0 HD12 ILE A 96 71.001 35.240 43.270 1.00 0.00 H new ATOM 0 HD13 ILE A 96 69.852 35.901 44.457 1.00 0.00 H new ATOM 1448 N PHE A 97 66.721 32.051 43.873 1.00 0.00 N ATOM 1449 CA PHE A 97 65.728 31.761 44.909 1.00 0.00 C ATOM 1450 C PHE A 97 65.416 33.011 45.733 1.00 0.00 C ATOM 1451 O PHE A 97 66.329 33.688 46.204 1.00 0.00 O ATOM 1452 CB PHE A 97 66.223 30.664 45.849 1.00 0.00 C ATOM 1453 CG PHE A 97 66.028 29.250 45.337 1.00 0.00 C ATOM 1454 CD1 PHE A 97 66.955 28.671 44.452 1.00 0.00 C ATOM 1455 CD2 PHE A 97 64.906 28.506 45.748 1.00 0.00 C ATOM 1456 CE1 PHE A 97 66.779 27.350 44.004 1.00 0.00 C ATOM 1457 CE2 PHE A 97 64.720 27.190 45.287 1.00 0.00 C ATOM 1458 CZ PHE A 97 65.662 26.607 44.423 1.00 0.00 C ATOM 0 H PHE A 97 67.634 31.629 44.041 1.00 0.00 H new ATOM 0 HA PHE A 97 64.823 31.424 44.403 1.00 0.00 H new ATOM 0 HB2 PHE A 97 67.284 30.822 46.042 1.00 0.00 H new ATOM 0 HB3 PHE A 97 65.707 30.764 46.804 1.00 0.00 H new ATOM 0 HD1 PHE A 97 67.806 29.244 44.115 1.00 0.00 H new ATOM 0 HD2 PHE A 97 64.185 28.947 46.420 1.00 0.00 H new ATOM 0 HE1 PHE A 97 67.503 26.906 43.337 1.00 0.00 H new ATOM 0 HE2 PHE A 97 63.852 26.627 45.598 1.00 0.00 H new ATOM 0 HZ PHE A 97 65.528 25.591 44.082 1.00 0.00 H new ATOM 1468 N SER A 98 64.134 33.240 46.018 1.00 0.00 N ATOM 1469 CA SER A 98 63.655 34.361 46.838 1.00 0.00 C ATOM 1470 C SER A 98 64.328 34.466 48.209 1.00 0.00 C ATOM 1471 O SER A 98 64.680 35.561 48.624 1.00 0.00 O ATOM 1472 CB SER A 98 62.142 34.258 47.008 1.00 0.00 C ATOM 1473 OG SER A 98 61.792 32.989 47.536 1.00 0.00 O ATOM 0 H SER A 98 63.381 32.641 45.680 1.00 0.00 H new ATOM 0 HA SER A 98 63.925 35.271 46.302 1.00 0.00 H new ATOM 0 HB2 SER A 98 61.789 35.046 47.673 1.00 0.00 H new ATOM 0 HB3 SER A 98 61.650 34.408 46.047 1.00 0.00 H new ATOM 0 HG SER A 98 60.819 32.936 47.642 1.00 0.00 H new ATOM 1479 N SER A 99 64.588 33.343 48.886 1.00 0.00 N ATOM 1480 CA SER A 99 65.205 33.345 50.227 1.00 0.00 C ATOM 1481 C SER A 99 66.744 33.459 50.209 1.00 0.00 C ATOM 1482 O SER A 99 67.383 33.543 51.255 1.00 0.00 O ATOM 1483 CB SER A 99 64.673 32.193 51.077 1.00 0.00 C ATOM 1484 OG SER A 99 64.881 32.481 52.445 1.00 0.00 O ATOM 0 H SER A 99 64.381 32.411 48.528 1.00 0.00 H new ATOM 0 HA SER A 99 64.893 34.267 50.718 1.00 0.00 H new ATOM 0 HB2 SER A 99 63.611 32.044 50.883 1.00 0.00 H new ATOM 0 HB3 SER A 99 65.179 31.265 50.809 1.00 0.00 H new ATOM 0 HG SER A 99 65.770 32.876 52.565 1.00 0.00 H new ATOM 1490 N SER A 100 67.360 33.538 49.018 1.00 0.00 N ATOM 1491 CA SER A 100 68.754 33.980 48.864 1.00 0.00 C ATOM 1492 C SER A 100 68.966 35.456 49.199 1.00 0.00 C ATOM 1493 O SER A 100 70.105 35.897 49.360 1.00 0.00 O ATOM 1494 CB SER A 100 69.195 33.829 47.427 1.00 0.00 C ATOM 1495 OG SER A 100 70.598 34.009 47.361 1.00 0.00 O ATOM 0 H SER A 100 66.906 33.298 48.137 1.00 0.00 H new ATOM 0 HA SER A 100 69.323 33.358 49.554 1.00 0.00 H new ATOM 0 HB2 SER A 100 68.922 32.843 47.050 1.00 0.00 H new ATOM 0 HB3 SER A 100 68.690 34.562 46.798 1.00 0.00 H new ATOM 0 HG SER A 100 70.883 34.624 48.069 1.00 0.00 H new ATOM 1501 N LEU A 101 67.879 36.222 49.234 1.00 0.00 N ATOM 1502 CA LEU A 101 67.874 37.627 49.616 1.00 0.00 C ATOM 1503 C LEU A 101 66.727 38.014 50.562 1.00 0.00 C ATOM 1504 O LEU A 101 65.864 37.204 50.906 1.00 0.00 O ATOM 1505 CB LEU A 101 68.027 38.513 48.367 1.00 0.00 C ATOM 1506 CG LEU A 101 66.993 38.514 47.220 1.00 0.00 C ATOM 1507 CD1 LEU A 101 66.955 37.221 46.404 1.00 0.00 C ATOM 1508 CD2 LEU A 101 65.581 38.866 47.684 1.00 0.00 C ATOM 0 H LEU A 101 66.953 35.871 48.990 1.00 0.00 H new ATOM 0 HA LEU A 101 68.749 37.814 50.239 1.00 0.00 H new ATOM 0 HB2 LEU A 101 68.101 39.541 48.721 1.00 0.00 H new ATOM 0 HB3 LEU A 101 68.988 38.259 47.920 1.00 0.00 H new ATOM 0 HG LEU A 101 67.352 39.305 46.561 1.00 0.00 H new ATOM 0 HD11 LEU A 101 66.202 37.307 45.620 1.00 0.00 H new ATOM 0 HD12 LEU A 101 67.931 37.047 45.952 1.00 0.00 H new ATOM 0 HD13 LEU A 101 66.704 36.386 47.058 1.00 0.00 H new ATOM 0 HD21 LEU A 101 64.903 38.849 46.831 1.00 0.00 H new ATOM 0 HD22 LEU A 101 65.250 38.139 48.425 1.00 0.00 H new ATOM 0 HD23 LEU A 101 65.581 39.862 48.128 1.00 0.00 H new ATOM 1520 N LYS A 102 66.761 39.261 51.033 1.00 0.00 N ATOM 1521 CA LYS A 102 65.748 39.918 51.847 1.00 0.00 C ATOM 1522 C LYS A 102 65.229 41.175 51.155 1.00 0.00 C ATOM 1523 O LYS A 102 65.885 41.745 50.283 1.00 0.00 O ATOM 1524 CB LYS A 102 66.287 40.243 53.247 1.00 0.00 C ATOM 1525 CG LYS A 102 67.539 39.472 53.706 1.00 0.00 C ATOM 1526 CD LYS A 102 67.993 39.791 55.136 1.00 0.00 C ATOM 1527 CE LYS A 102 66.995 39.283 56.183 1.00 0.00 C ATOM 1528 NZ LYS A 102 67.487 39.542 57.554 1.00 0.00 N ATOM 0 H LYS A 102 67.551 39.876 50.841 1.00 0.00 H new ATOM 0 HA LYS A 102 64.913 39.228 51.966 1.00 0.00 H new ATOM 0 HB2 LYS A 102 66.512 41.309 53.285 1.00 0.00 H new ATOM 0 HB3 LYS A 102 65.491 40.059 53.969 1.00 0.00 H new ATOM 0 HG2 LYS A 102 67.340 38.403 53.631 1.00 0.00 H new ATOM 0 HG3 LYS A 102 68.358 39.692 53.021 1.00 0.00 H new ATOM 0 HD2 LYS A 102 68.968 39.339 55.316 1.00 0.00 H new ATOM 0 HD3 LYS A 102 68.116 40.869 55.245 1.00 0.00 H new ATOM 0 HE2 LYS A 102 66.032 39.773 56.040 1.00 0.00 H new ATOM 0 HE3 LYS A 102 66.832 38.214 56.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 66.794 39.189 58.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 68.395 39.055 57.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 67.619 40.565 57.688 1.00 0.00 H new ATOM 1542 N PHE A 103 64.068 41.630 51.604 1.00 0.00 N ATOM 1543 CA PHE A 103 63.403 42.853 51.202 1.00 0.00 C ATOM 1544 C PHE A 103 63.265 43.773 52.410 1.00 0.00 C ATOM 1545 O PHE A 103 62.772 43.372 53.469 1.00 0.00 O ATOM 1546 CB PHE A 103 62.039 42.483 50.620 1.00 0.00 C ATOM 1547 CG PHE A 103 61.229 43.613 50.000 1.00 0.00 C ATOM 1548 CD1 PHE A 103 61.813 44.509 49.085 1.00 0.00 C ATOM 1549 CD2 PHE A 103 59.857 43.735 50.299 1.00 0.00 C ATOM 1550 CE1 PHE A 103 61.043 45.522 48.483 1.00 0.00 C ATOM 1551 CE2 PHE A 103 59.082 44.737 49.684 1.00 0.00 C ATOM 1552 CZ PHE A 103 59.675 45.635 48.781 1.00 0.00 C ATOM 0 H PHE A 103 63.533 41.118 52.305 1.00 0.00 H new ATOM 0 HA PHE A 103 63.979 43.384 50.444 1.00 0.00 H new ATOM 0 HB2 PHE A 103 62.190 41.717 49.860 1.00 0.00 H new ATOM 0 HB3 PHE A 103 61.442 42.032 51.413 1.00 0.00 H new ATOM 0 HD1 PHE A 103 62.862 44.418 48.843 1.00 0.00 H new ATOM 0 HD2 PHE A 103 59.398 43.057 51.003 1.00 0.00 H new ATOM 0 HE1 PHE A 103 61.504 46.212 47.792 1.00 0.00 H new ATOM 0 HE2 PHE A 103 58.028 44.815 49.907 1.00 0.00 H new ATOM 0 HZ PHE A 103 59.081 46.409 48.318 1.00 0.00 H new ATOM 1562 N VAL A 104 63.702 45.009 52.228 1.00 0.00 N ATOM 1563 CA VAL A 104 63.527 46.122 53.160 1.00 0.00 C ATOM 1564 C VAL A 104 62.677 47.214 52.493 1.00 0.00 C ATOM 1565 O VAL A 104 63.193 48.045 51.741 1.00 0.00 O ATOM 1566 CB VAL A 104 64.879 46.569 53.746 1.00 0.00 C ATOM 1567 CG1 VAL A 104 65.909 47.129 52.760 1.00 0.00 C ATOM 1568 CG2 VAL A 104 64.665 47.570 54.888 1.00 0.00 C ATOM 0 H VAL A 104 64.213 45.281 51.388 1.00 0.00 H new ATOM 0 HA VAL A 104 62.961 45.816 54.040 1.00 0.00 H new ATOM 0 HB VAL A 104 65.320 45.639 54.103 1.00 0.00 H new ATOM 0 HG11 VAL A 104 66.815 47.406 53.299 1.00 0.00 H new ATOM 0 HG12 VAL A 104 66.148 46.371 52.014 1.00 0.00 H new ATOM 0 HG13 VAL A 104 65.498 48.009 52.265 1.00 0.00 H new ATOM 0 HG21 VAL A 104 65.631 47.875 55.290 1.00 0.00 H new ATOM 0 HG22 VAL A 104 64.136 48.445 54.510 1.00 0.00 H new ATOM 0 HG23 VAL A 104 64.075 47.102 55.676 1.00 0.00 H new ATOM 1578 N PRO A 105 61.344 47.191 52.685 1.00 0.00 N ATOM 1579 CA PRO A 105 60.464 48.166 52.060 1.00 0.00 C ATOM 1580 C PRO A 105 60.517 49.530 52.756 1.00 0.00 C ATOM 1581 O PRO A 105 61.070 49.691 53.846 1.00 0.00 O ATOM 1582 CB PRO A 105 59.063 47.546 52.108 1.00 0.00 C ATOM 1583 CG PRO A 105 59.111 46.685 53.365 1.00 0.00 C ATOM 1584 CD PRO A 105 60.558 46.188 53.394 1.00 0.00 C ATOM 0 HA PRO A 105 60.771 48.373 51.035 1.00 0.00 H new ATOM 0 HB2 PRO A 105 58.286 48.308 52.171 1.00 0.00 H new ATOM 0 HB3 PRO A 105 58.855 46.951 51.219 1.00 0.00 H new ATOM 0 HG2 PRO A 105 58.865 47.261 54.257 1.00 0.00 H new ATOM 0 HG3 PRO A 105 58.402 45.858 53.314 1.00 0.00 H new ATOM 0 HD2 PRO A 105 60.909 46.071 54.419 1.00 0.00 H new ATOM 0 HD3 PRO A 105 60.645 45.213 52.914 1.00 0.00 H new ATOM 1592 N LYS A 106 59.868 50.519 52.135 1.00 0.00 N ATOM 1593 CA LYS A 106 59.399 51.726 52.812 1.00 0.00 C ATOM 1594 C LYS A 106 58.465 51.422 53.997 1.00 0.00 C ATOM 1595 O LYS A 106 58.164 50.280 54.332 1.00 0.00 O ATOM 1596 CB LYS A 106 58.775 52.710 51.815 1.00 0.00 C ATOM 1597 CG LYS A 106 59.301 54.146 51.927 1.00 0.00 C ATOM 1598 CD LYS A 106 60.729 54.306 51.385 1.00 0.00 C ATOM 1599 CE LYS A 106 60.793 54.233 49.853 1.00 0.00 C ATOM 1600 NZ LYS A 106 62.179 54.419 49.366 1.00 0.00 N ATOM 0 H LYS A 106 59.652 50.502 51.138 1.00 0.00 H new ATOM 0 HA LYS A 106 60.275 52.209 53.246 1.00 0.00 H new ATOM 0 HB2 LYS A 106 58.957 52.347 50.803 1.00 0.00 H new ATOM 0 HB3 LYS A 106 57.695 52.720 51.961 1.00 0.00 H new ATOM 0 HG2 LYS A 106 58.635 54.815 51.382 1.00 0.00 H new ATOM 0 HG3 LYS A 106 59.278 54.455 52.972 1.00 0.00 H new ATOM 0 HD2 LYS A 106 61.134 55.262 51.716 1.00 0.00 H new ATOM 0 HD3 LYS A 106 61.363 53.527 51.809 1.00 0.00 H new ATOM 0 HE2 LYS A 106 60.413 53.269 49.516 1.00 0.00 H new ATOM 0 HE3 LYS A 106 60.148 54.999 49.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 62.192 54.365 48.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 62.531 55.349 49.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 62.788 53.673 49.759 1.00 0.00 H new ATOM 1614 N GLY A 107 58.018 52.486 54.651 1.00 0.00 N ATOM 1615 CA GLY A 107 57.107 52.423 55.798 1.00 0.00 C ATOM 1616 C GLY A 107 57.634 51.628 56.997 1.00 0.00 C ATOM 1617 O GLY A 107 56.909 50.835 57.596 1.00 0.00 O ATOM 0 H GLY A 107 58.281 53.438 54.398 1.00 0.00 H new ATOM 0 HA2 GLY A 107 56.885 53.439 56.124 1.00 0.00 H new ATOM 0 HA3 GLY A 107 56.166 51.980 55.472 1.00 0.00 H new ATOM 1621 N LYS A 108 58.917 51.825 57.317 1.00 0.00 N ATOM 1622 CA LYS A 108 59.624 51.249 58.471 1.00 0.00 C ATOM 1623 C LYS A 108 59.838 52.227 59.623 1.00 0.00 C ATOM 1624 O LYS A 108 59.759 51.858 60.788 1.00 0.00 O ATOM 1625 CB LYS A 108 60.964 50.686 57.997 1.00 0.00 C ATOM 1626 CG LYS A 108 60.971 49.157 58.028 1.00 0.00 C ATOM 1627 CD LYS A 108 60.140 48.602 56.866 1.00 0.00 C ATOM 1628 CE LYS A 108 59.382 47.318 57.196 1.00 0.00 C ATOM 1629 NZ LYS A 108 60.181 46.310 57.928 1.00 0.00 N ATOM 0 H LYS A 108 59.523 52.420 56.752 1.00 0.00 H new ATOM 0 HA LYS A 108 58.988 50.461 58.874 1.00 0.00 H new ATOM 0 HB2 LYS A 108 61.167 51.031 56.983 1.00 0.00 H new ATOM 0 HB3 LYS A 108 61.765 51.068 58.630 1.00 0.00 H new ATOM 0 HG2 LYS A 108 61.995 48.789 57.961 1.00 0.00 H new ATOM 0 HG3 LYS A 108 60.566 48.803 58.976 1.00 0.00 H new ATOM 0 HD2 LYS A 108 59.425 49.362 56.550 1.00 0.00 H new ATOM 0 HD3 LYS A 108 60.800 48.414 56.019 1.00 0.00 H new ATOM 0 HE2 LYS A 108 58.504 47.571 57.791 1.00 0.00 H new ATOM 0 HE3 LYS A 108 59.021 46.874 56.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 59.844 45.357 57.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 61.182 46.401 57.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 60.079 46.463 58.952 1.00 0.00 H new ATOM 1643 N GLU A 109 60.150 53.468 59.269 1.00 0.00 N ATOM 1644 CA GLU A 109 60.352 54.577 60.181 1.00 0.00 C ATOM 1645 C GLU A 109 59.204 55.582 60.028 1.00 0.00 C ATOM 1646 O GLU A 109 58.110 55.342 60.535 1.00 0.00 O ATOM 1647 CB GLU A 109 61.767 55.149 60.000 1.00 0.00 C ATOM 1648 CG GLU A 109 62.212 56.114 61.081 1.00 0.00 C ATOM 1649 CD GLU A 109 63.386 55.590 61.921 1.00 0.00 C ATOM 1650 OE1 GLU A 109 63.147 54.824 62.888 1.00 0.00 O ATOM 1651 OE2 GLU A 109 64.548 55.939 61.617 1.00 0.00 O ATOM 0 H GLU A 109 60.274 53.736 58.293 1.00 0.00 H new ATOM 0 HA GLU A 109 60.312 54.254 61.221 1.00 0.00 H new ATOM 0 HB2 GLU A 109 62.475 54.321 59.960 1.00 0.00 H new ATOM 0 HB3 GLU A 109 61.816 55.658 59.037 1.00 0.00 H new ATOM 0 HG2 GLU A 109 62.499 57.059 60.619 1.00 0.00 H new ATOM 0 HG3 GLU A 109 61.369 56.324 61.739 1.00 0.00 H new ATOM 1658 N ALA A 110 59.446 56.652 59.270 1.00 0.00 N ATOM 1659 CA ALA A 110 58.564 57.821 59.124 1.00 0.00 C ATOM 1660 C ALA A 110 58.110 58.441 60.473 1.00 0.00 C ATOM 1661 O ALA A 110 58.596 58.060 61.540 1.00 0.00 O ATOM 1662 CB ALA A 110 57.407 57.455 58.179 1.00 0.00 C ATOM 0 H ALA A 110 60.298 56.736 58.715 1.00 0.00 H new ATOM 0 HA ALA A 110 59.134 58.632 58.671 1.00 0.00 H new ATOM 0 HB1 ALA A 110 56.746 58.314 58.063 1.00 0.00 H new ATOM 0 HB2 ALA A 110 57.808 57.172 57.206 1.00 0.00 H new ATOM 0 HB3 ALA A 110 56.846 56.620 58.598 1.00 0.00 H new ATOM 1668 N ALA A 111 57.210 59.433 60.424 1.00 0.00 N ATOM 1669 CA ALA A 111 56.780 60.240 61.573 1.00 0.00 C ATOM 1670 C ALA A 111 57.960 60.950 62.278 1.00 0.00 C ATOM 1671 O ALA A 111 58.117 60.853 63.495 1.00 0.00 O ATOM 1672 CB ALA A 111 55.866 59.413 62.492 1.00 0.00 C ATOM 0 H ALA A 111 56.747 59.704 59.556 1.00 0.00 H new ATOM 0 HA ALA A 111 56.171 61.070 61.215 1.00 0.00 H new ATOM 0 HB1 ALA A 111 55.554 60.023 63.340 1.00 0.00 H new ATOM 0 HB2 ALA A 111 54.987 59.090 61.935 1.00 0.00 H new ATOM 0 HB3 ALA A 111 56.408 58.539 62.854 1.00 0.00 H new ATOM 1678 N ALA A 112 58.782 61.653 61.486 1.00 0.00 N ATOM 1679 CA ALA A 112 60.110 62.169 61.844 1.00 0.00 C ATOM 1680 C ALA A 112 61.146 61.074 62.183 1.00 0.00 C ATOM 1681 O ALA A 112 60.809 59.940 62.516 1.00 0.00 O ATOM 1682 CB ALA A 112 59.997 63.283 62.897 1.00 0.00 C ATOM 0 H ALA A 112 58.524 61.889 60.528 1.00 0.00 H new ATOM 0 HA ALA A 112 60.527 62.625 60.946 1.00 0.00 H new ATOM 0 HB1 ALA A 112 60.993 63.650 63.147 1.00 0.00 H new ATOM 0 HB2 ALA A 112 59.398 64.102 62.498 1.00 0.00 H new ATOM 0 HB3 ALA A 112 59.520 62.889 63.794 1.00 0.00 H new ATOM 1688 N SER A 113 62.436 61.395 62.043 1.00 0.00 N ATOM 1689 CA SER A 113 63.534 60.424 62.096 1.00 0.00 C ATOM 1690 C SER A 113 64.839 61.042 62.602 1.00 0.00 C ATOM 1691 O SER A 113 65.922 60.888 62.028 1.00 0.00 O ATOM 1692 CB SER A 113 63.677 59.699 60.751 1.00 0.00 C ATOM 1693 OG SER A 113 63.887 60.592 59.674 1.00 0.00 O ATOM 0 H SER A 113 62.752 62.352 61.887 1.00 0.00 H new ATOM 0 HA SER A 113 63.282 59.667 62.838 1.00 0.00 H new ATOM 0 HB2 SER A 113 64.511 58.999 60.806 1.00 0.00 H new ATOM 0 HB3 SER A 113 62.779 59.111 60.561 1.00 0.00 H new ATOM 0 HG SER A 113 63.974 60.084 58.840 1.00 0.00 H new ATOM 1699 N GLN A 114 64.730 61.795 63.696 1.00 0.00 N ATOM 1700 CA GLN A 114 65.790 62.599 64.262 1.00 0.00 C ATOM 1701 C GLN A 114 66.761 61.734 65.084 1.00 0.00 C ATOM 1702 O GLN A 114 66.544 61.457 66.267 1.00 0.00 O ATOM 1703 CB GLN A 114 65.142 63.730 65.055 1.00 0.00 C ATOM 1704 CG GLN A 114 65.163 65.096 64.354 1.00 0.00 C ATOM 1705 CD GLN A 114 64.121 65.264 63.247 1.00 0.00 C ATOM 1706 OE1 GLN A 114 63.457 64.336 62.803 1.00 0.00 O ATOM 1707 NE2 GLN A 114 63.944 66.469 62.761 1.00 0.00 N ATOM 0 H GLN A 114 63.861 61.858 64.227 1.00 0.00 H new ATOM 0 HA GLN A 114 66.410 63.043 63.483 1.00 0.00 H new ATOM 0 HB2 GLN A 114 64.107 63.461 65.267 1.00 0.00 H new ATOM 0 HB3 GLN A 114 65.651 63.821 66.015 1.00 0.00 H new ATOM 0 HG2 GLN A 114 65.008 65.875 65.101 1.00 0.00 H new ATOM 0 HG3 GLN A 114 66.154 65.255 63.928 1.00 0.00 H new ATOM 0 HE21 GLN A 114 64.491 67.250 63.123 1.00 0.00 H new ATOM 0 HE22 GLN A 114 63.259 66.625 62.021 1.00 0.00 H new ATOM 1716 N GLY A 115 67.841 61.305 64.435 1.00 0.00 N ATOM 1717 CA GLY A 115 68.918 60.507 65.025 1.00 0.00 C ATOM 1718 C GLY A 115 69.941 60.041 63.983 1.00 0.00 C ATOM 1719 O GLY A 115 69.582 59.679 62.863 1.00 0.00 O ATOM 0 H GLY A 115 67.998 61.510 63.448 1.00 0.00 H new ATOM 0 HA2 GLY A 115 69.425 61.096 65.790 1.00 0.00 H new ATOM 0 HA3 GLY A 115 68.490 59.637 65.524 1.00 0.00 H new ATOM 1723 N HIS A 116 71.221 60.045 64.350 1.00 0.00 N ATOM 1724 CA HIS A 116 72.344 59.541 63.551 1.00 0.00 C ATOM 1725 C HIS A 116 73.476 59.068 64.476 1.00 0.00 C ATOM 1726 O HIS A 116 73.441 59.343 65.675 1.00 0.00 O ATOM 1727 CB HIS A 116 72.816 60.614 62.547 1.00 0.00 C ATOM 1728 CG HIS A 116 73.140 61.983 63.110 1.00 0.00 C ATOM 1729 ND1 HIS A 116 72.819 63.186 62.518 1.00 0.00 N ATOM 1730 CD2 HIS A 116 73.836 62.282 64.254 1.00 0.00 C ATOM 1731 CE1 HIS A 116 73.278 64.181 63.293 1.00 0.00 C ATOM 1732 NE2 HIS A 116 73.922 63.676 64.355 1.00 0.00 N ATOM 0 H HIS A 116 71.520 60.415 65.252 1.00 0.00 H new ATOM 0 HA HIS A 116 72.017 58.681 62.967 1.00 0.00 H new ATOM 0 HB2 HIS A 116 73.704 60.237 62.040 1.00 0.00 H new ATOM 0 HB3 HIS A 116 72.042 60.733 61.789 1.00 0.00 H new ATOM 0 HD2 HIS A 116 74.245 61.568 64.953 1.00 0.00 H new ATOM 0 HE1 HIS A 116 73.148 65.234 63.091 1.00 0.00 H new ATOM 0 HE2 HIS A 116 74.385 64.205 65.094 1.00 0.00 H new ATOM 1740 N LEU A 117 74.473 58.371 63.926 1.00 0.00 N ATOM 1741 CA LEU A 117 75.676 57.935 64.621 1.00 0.00 C ATOM 1742 C LEU A 117 76.928 58.567 63.994 1.00 0.00 C ATOM 1743 O LEU A 117 76.991 58.786 62.780 1.00 0.00 O ATOM 1744 CB LEU A 117 75.774 56.396 64.585 1.00 0.00 C ATOM 1745 CG LEU A 117 74.846 55.570 65.501 1.00 0.00 C ATOM 1746 CD1 LEU A 117 74.970 55.966 66.973 1.00 0.00 C ATOM 1747 CD2 LEU A 117 73.369 55.606 65.104 1.00 0.00 C ATOM 0 H LEU A 117 74.459 58.086 62.947 1.00 0.00 H new ATOM 0 HA LEU A 117 75.616 58.263 65.659 1.00 0.00 H new ATOM 0 HB2 LEU A 117 75.593 56.078 63.558 1.00 0.00 H new ATOM 0 HB3 LEU A 117 76.802 56.125 64.826 1.00 0.00 H new ATOM 0 HG LEU A 117 75.200 54.548 65.364 1.00 0.00 H new ATOM 0 HD11 LEU A 117 74.296 55.354 67.572 1.00 0.00 H new ATOM 0 HD12 LEU A 117 75.996 55.809 67.307 1.00 0.00 H new ATOM 0 HD13 LEU A 117 74.707 57.017 67.090 1.00 0.00 H new ATOM 0 HD21 LEU A 117 72.790 55.000 65.801 1.00 0.00 H new ATOM 0 HD22 LEU A 117 73.009 56.635 65.133 1.00 0.00 H new ATOM 0 HD23 LEU A 117 73.254 55.210 64.095 1.00 0.00 H new ATOM 1759 N GLU A 118 77.949 58.797 64.818 1.00 0.00 N ATOM 1760 CA GLU A 118 79.313 59.131 64.396 1.00 0.00 C ATOM 1761 C GLU A 118 80.356 58.564 65.381 1.00 0.00 C ATOM 1762 O GLU A 118 80.222 58.711 66.596 1.00 0.00 O ATOM 1763 CB GLU A 118 79.465 60.634 64.107 1.00 0.00 C ATOM 1764 CG GLU A 118 79.375 61.543 65.327 1.00 0.00 C ATOM 1765 CD GLU A 118 77.964 61.662 65.918 1.00 0.00 C ATOM 1766 OE1 GLU A 118 77.103 62.333 65.302 1.00 0.00 O ATOM 1767 OE2 GLU A 118 77.724 61.090 67.008 1.00 0.00 O ATOM 0 H GLU A 118 77.849 58.755 65.832 1.00 0.00 H new ATOM 0 HA GLU A 118 79.513 58.639 63.444 1.00 0.00 H new ATOM 0 HB2 GLU A 118 80.427 60.799 63.622 1.00 0.00 H new ATOM 0 HB3 GLU A 118 78.694 60.930 63.396 1.00 0.00 H new ATOM 0 HG2 GLU A 118 80.049 61.167 66.097 1.00 0.00 H new ATOM 0 HG3 GLU A 118 79.727 62.537 65.052 1.00 0.00 H new ATOM 1774 N HIS A 119 81.394 57.889 64.876 1.00 0.00 N ATOM 1775 CA HIS A 119 82.540 57.414 65.670 1.00 0.00 C ATOM 1776 C HIS A 119 83.765 57.189 64.770 1.00 0.00 C ATOM 1777 O HIS A 119 83.602 56.948 63.576 1.00 0.00 O ATOM 1778 CB HIS A 119 82.186 56.149 66.482 1.00 0.00 C ATOM 1779 CG HIS A 119 82.191 54.824 65.748 1.00 0.00 C ATOM 1780 ND1 HIS A 119 82.514 53.605 66.305 1.00 0.00 N ATOM 1781 CD2 HIS A 119 81.900 54.587 64.429 1.00 0.00 C ATOM 1782 CE1 HIS A 119 82.456 52.670 65.344 1.00 0.00 C ATOM 1783 NE2 HIS A 119 82.078 53.222 64.181 1.00 0.00 N ATOM 0 H HIS A 119 81.466 57.652 63.887 1.00 0.00 H new ATOM 0 HA HIS A 119 82.793 58.190 66.393 1.00 0.00 H new ATOM 0 HB2 HIS A 119 82.887 56.076 67.314 1.00 0.00 H new ATOM 0 HB3 HIS A 119 81.195 56.292 66.912 1.00 0.00 H new ATOM 0 HD2 HIS A 119 81.587 55.326 63.707 1.00 0.00 H new ATOM 0 HE1 HIS A 119 82.681 51.623 65.486 1.00 0.00 H new ATOM 0 HE2 HIS A 119 81.946 52.741 63.291 1.00 0.00 H new ATOM 1791 N HIS A 120 84.976 57.312 65.324 1.00 0.00 N ATOM 1792 CA HIS A 120 86.269 56.980 64.694 1.00 0.00 C ATOM 1793 C HIS A 120 87.413 57.231 65.703 1.00 0.00 C ATOM 1794 O HIS A 120 87.169 57.540 66.872 1.00 0.00 O ATOM 1795 CB HIS A 120 86.477 57.781 63.382 1.00 0.00 C ATOM 1796 CG HIS A 120 86.132 59.248 63.441 1.00 0.00 C ATOM 1797 ND1 HIS A 120 84.886 59.787 63.212 1.00 0.00 N ATOM 1798 CD2 HIS A 120 86.998 60.298 63.577 1.00 0.00 C ATOM 1799 CE1 HIS A 120 84.984 61.123 63.283 1.00 0.00 C ATOM 1800 NE2 HIS A 120 86.261 61.481 63.496 1.00 0.00 N ATOM 0 H HIS A 120 85.092 57.664 66.274 1.00 0.00 H new ATOM 0 HA HIS A 120 86.271 55.925 64.421 1.00 0.00 H new ATOM 0 HB2 HIS A 120 87.521 57.685 63.083 1.00 0.00 H new ATOM 0 HB3 HIS A 120 85.877 57.318 62.598 1.00 0.00 H new ATOM 0 HD2 HIS A 120 88.066 60.225 63.722 1.00 0.00 H new ATOM 0 HE1 HIS A 120 84.157 61.810 63.183 1.00 0.00 H new ATOM 0 HE2 HIS A 120 86.622 62.431 63.582 1.00 0.00 H new ATOM 1808 N HIS A 121 88.667 57.126 65.248 1.00 0.00 N ATOM 1809 CA HIS A 121 89.878 57.603 65.939 1.00 0.00 C ATOM 1810 C HIS A 121 90.225 56.940 67.287 1.00 0.00 C ATOM 1811 O HIS A 121 91.046 57.464 68.035 1.00 0.00 O ATOM 1812 CB HIS A 121 89.874 59.141 66.020 1.00 0.00 C ATOM 1813 CG HIS A 121 91.219 59.744 65.723 1.00 0.00 C ATOM 1814 ND1 HIS A 121 92.312 59.757 66.559 1.00 0.00 N ATOM 1815 CD2 HIS A 121 91.601 60.330 64.548 1.00 0.00 C ATOM 1816 CE1 HIS A 121 93.328 60.348 65.907 1.00 0.00 C ATOM 1817 NE2 HIS A 121 92.943 60.703 64.667 1.00 0.00 N ATOM 0 H HIS A 121 88.878 56.689 64.351 1.00 0.00 H new ATOM 0 HA HIS A 121 90.702 57.266 65.310 1.00 0.00 H new ATOM 0 HB2 HIS A 121 89.141 59.535 65.316 1.00 0.00 H new ATOM 0 HB3 HIS A 121 89.556 59.447 67.017 1.00 0.00 H new ATOM 0 HD1 HIS A 121 92.345 59.383 67.508 1.00 0.00 H new ATOM 0 HD2 HIS A 121 90.976 60.479 63.680 1.00 0.00 H new ATOM 0 HE1 HIS A 121 94.312 60.514 66.319 1.00 0.00 H new ATOM 1825 N HIS A 122 89.646 55.772 67.585 1.00 0.00 N ATOM 1826 CA HIS A 122 89.879 55.030 68.836 1.00 0.00 C ATOM 1827 C HIS A 122 91.367 54.671 69.029 1.00 0.00 C ATOM 1828 O HIS A 122 91.878 54.760 70.144 1.00 0.00 O ATOM 1829 CB HIS A 122 88.989 53.766 68.885 1.00 0.00 C ATOM 1830 CG HIS A 122 87.883 53.720 67.856 1.00 0.00 C ATOM 1831 ND1 HIS A 122 86.684 54.398 67.891 1.00 0.00 N ATOM 1832 CD2 HIS A 122 87.961 53.107 66.633 1.00 0.00 C ATOM 1833 CE1 HIS A 122 86.053 54.184 66.724 1.00 0.00 C ATOM 1834 NE2 HIS A 122 86.815 53.442 65.906 1.00 0.00 N ATOM 0 H HIS A 122 88.992 55.306 66.957 1.00 0.00 H new ATOM 0 HA HIS A 122 89.603 55.683 69.664 1.00 0.00 H new ATOM 0 HB2 HIS A 122 89.623 52.889 68.754 1.00 0.00 H new ATOM 0 HB3 HIS A 122 88.544 53.692 69.877 1.00 0.00 H new ATOM 0 HD2 HIS A 122 88.767 52.475 66.290 1.00 0.00 H new ATOM 0 HE1 HIS A 122 85.070 54.557 66.479 1.00 0.00 H new ATOM 0 HE2 HIS A 122 86.601 53.175 64.945 1.00 0.00 H new ATOM 1842 N HIS A 123 92.065 54.351 67.926 1.00 0.00 N ATOM 1843 CA HIS A 123 93.531 54.253 67.835 1.00 0.00 C ATOM 1844 C HIS A 123 94.160 53.290 68.875 1.00 0.00 C ATOM 1845 O HIS A 123 93.471 52.403 69.379 1.00 0.00 O ATOM 1846 CB HIS A 123 94.072 55.700 67.861 1.00 0.00 C ATOM 1847 CG HIS A 123 95.448 55.874 67.277 1.00 0.00 C ATOM 1848 ND1 HIS A 123 96.597 56.164 67.977 1.00 0.00 N ATOM 1849 CD2 HIS A 123 95.783 55.821 65.952 1.00 0.00 C ATOM 1850 CE1 HIS A 123 97.606 56.265 67.093 1.00 0.00 C ATOM 1851 NE2 HIS A 123 97.154 56.077 65.841 1.00 0.00 N ATOM 0 H HIS A 123 91.605 54.146 67.039 1.00 0.00 H new ATOM 0 HA HIS A 123 93.830 53.777 66.901 1.00 0.00 H new ATOM 0 HB2 HIS A 123 93.379 56.341 67.317 1.00 0.00 H new ATOM 0 HB3 HIS A 123 94.085 56.049 68.894 1.00 0.00 H new ATOM 0 HD2 HIS A 123 95.107 55.617 65.134 1.00 0.00 H new ATOM 0 HE1 HIS A 123 98.634 56.468 67.353 1.00 0.00 H new ATOM 0 HE2 HIS A 123 97.702 56.114 64.981 1.00 0.00 H new ATOM 1859 N HIS A 124 95.457 53.455 69.167 1.00 0.00 N ATOM 1860 CA HIS A 124 96.205 52.930 70.328 1.00 0.00 C ATOM 1861 C HIS A 124 96.144 51.410 70.584 1.00 0.00 C ATOM 1862 O HIS A 124 95.358 50.947 71.442 1.00 0.00 O ATOM 1863 CB HIS A 124 95.866 53.771 71.576 1.00 0.00 C ATOM 1864 CG HIS A 124 96.065 55.260 71.414 1.00 0.00 C ATOM 1865 ND1 HIS A 124 97.252 55.903 71.143 1.00 0.00 N ATOM 1866 CD2 HIS A 124 95.107 56.230 71.539 1.00 0.00 C ATOM 1867 CE1 HIS A 124 97.021 57.226 71.113 1.00 0.00 C ATOM 1868 NE2 HIS A 124 95.723 57.476 71.346 1.00 0.00 N ATOM 1869 OXT HIS A 124 97.070 50.703 70.121 1.00 0.00 O ATOM 0 H HIS A 124 96.062 54.001 68.553 1.00 0.00 H new ATOM 0 HA HIS A 124 97.257 53.047 70.068 1.00 0.00 H new ATOM 0 HB2 HIS A 124 94.827 53.586 71.850 1.00 0.00 H new ATOM 0 HB3 HIS A 124 96.481 53.425 72.407 1.00 0.00 H new ATOM 0 HD2 HIS A 124 94.061 56.065 71.749 1.00 0.00 H new ATOM 0 HE1 HIS A 124 97.772 57.980 70.928 1.00 0.00 H new ATOM 0 HE2 HIS A 124 95.273 58.391 71.377 1.00 0.00 H new TER 1877 HIS A 124 HETATM 1878 ZN ZN A 125 75.943 37.086 50.138 1.00 0.00 ZN