USER MOD reduce.3.24.130724 H: found=0, std=0, add=709, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 706 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 34 ASN : amide:sc= 0.344 K(o=0.34,f=-4.8!) USER MOD Set 1.2: A 35 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 20 LYS NZ :NH3+ 173:sc= 1.05 (180deg=0.996) USER MOD Set 2.2: A 88 THR OG1 : rot -83:sc= 1.17 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0.0235 USER MOD Single : A 24 SER OG : rot 180:sc= 0.0284 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= -0.0205 USER MOD Single : A 36 SER OG : rot -58:sc= 0.00577 USER MOD Single : A 39 HIS : no HD1:sc= -0.0843 X(o=-0.084,f=0) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot -80:sc= 0.92 USER MOD Single : A 60 HIS : no HD1:sc= 0 X(o=0,f=-0.0069) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 ASN : amide:sc= -0.0422 K(o=-0.042,f=-1.2!) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 180:sc= 0.00739 USER MOD Single : A 78 HIS : no HE2:sc= -0.165 K(o=-0.17,f=-0.8) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 THR OG1 : rot 82:sc= 1.22 USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 90 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 93 HIS : no HD1:sc= -0.0852 X(o=-0.085,f=0) USER MOD Single : A 98 LYS NZ :NH3+ 148:sc= 1.29 (180deg=0.63) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 9 26.463 44.220 22.390 1.00 0.00 N ATOM 2 CA LYS A 9 25.371 43.455 22.906 1.00 0.00 C ATOM 3 C LYS A 9 25.465 42.020 22.517 1.00 0.00 C ATOM 4 O LYS A 9 26.254 41.679 21.637 1.00 0.00 O ATOM 5 CB LYS A 9 24.019 44.072 22.509 1.00 0.00 C ATOM 6 CG LYS A 9 23.776 44.217 21.005 1.00 0.00 C ATOM 7 CD LYS A 9 22.370 44.754 20.729 1.00 0.00 C ATOM 8 CE LYS A 9 22.123 45.292 19.318 1.00 0.00 C ATOM 9 NZ LYS A 9 22.324 44.260 18.276 1.00 0.00 N ATOM 0 HA LYS A 9 25.435 43.488 23.994 1.00 0.00 H new ATOM 0 HB2 LYS A 9 23.222 43.459 22.930 1.00 0.00 H new ATOM 0 HB3 LYS A 9 23.940 45.057 22.969 1.00 0.00 H new ATOM 0 HG2 LYS A 9 24.518 44.891 20.576 1.00 0.00 H new ATOM 0 HG3 LYS A 9 23.903 43.251 20.517 1.00 0.00 H new ATOM 0 HD2 LYS A 9 21.653 43.956 20.923 1.00 0.00 H new ATOM 0 HD3 LYS A 9 22.160 45.551 21.442 1.00 0.00 H new ATOM 0 HE2 LYS A 9 21.105 45.677 19.252 1.00 0.00 H new ATOM 0 HE3 LYS A 9 22.794 46.130 19.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 22.145 44.674 17.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 23.302 43.910 18.319 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 21.666 43.471 18.438 1.00 0.00 H new ATOM 23 N PRO A 10 24.732 41.121 23.107 1.00 0.00 N ATOM 24 CA PRO A 10 24.724 39.751 22.686 1.00 0.00 C ATOM 25 C PRO A 10 24.049 39.471 21.387 1.00 0.00 C ATOM 26 O PRO A 10 23.509 40.370 20.745 1.00 0.00 O ATOM 27 CB PRO A 10 23.967 39.015 23.789 1.00 0.00 C ATOM 28 CG PRO A 10 24.236 39.855 25.047 1.00 0.00 C ATOM 29 CD PRO A 10 24.211 41.274 24.456 1.00 0.00 C ATOM 0 HA PRO A 10 25.756 39.438 22.528 1.00 0.00 H new ATOM 0 HB2 PRO A 10 22.901 38.954 23.570 1.00 0.00 H new ATOM 0 HB3 PRO A 10 24.327 37.993 23.907 1.00 0.00 H new ATOM 0 HG2 PRO A 10 23.472 39.712 25.811 1.00 0.00 H new ATOM 0 HG3 PRO A 10 25.195 39.616 25.507 1.00 0.00 H new ATOM 0 HD2 PRO A 10 23.200 41.681 24.446 1.00 0.00 H new ATOM 0 HD3 PRO A 10 24.825 41.958 25.042 1.00 0.00 H new ATOM 37 N GLY A 11 24.069 38.200 20.945 1.00 0.00 N ATOM 38 CA GLY A 11 23.485 37.789 19.706 1.00 0.00 C ATOM 39 C GLY A 11 24.460 37.867 18.582 1.00 0.00 C ATOM 40 O GLY A 11 24.122 37.649 17.420 1.00 0.00 O ATOM 0 H GLY A 11 24.504 37.437 21.464 1.00 0.00 H new ATOM 0 HA2 GLY A 11 23.118 36.767 19.799 1.00 0.00 H new ATOM 0 HA3 GLY A 11 22.623 38.418 19.484 1.00 0.00 H new ATOM 44 N ASP A 12 25.708 38.252 18.905 1.00 0.00 N ATOM 45 CA ASP A 12 26.765 38.570 17.996 1.00 0.00 C ATOM 46 C ASP A 12 27.602 37.360 17.764 1.00 0.00 C ATOM 47 O ASP A 12 27.868 36.611 18.701 1.00 0.00 O ATOM 48 CB ASP A 12 27.561 39.705 18.661 1.00 0.00 C ATOM 49 CG ASP A 12 28.293 40.605 17.676 1.00 0.00 C ATOM 50 OD1 ASP A 12 28.106 40.455 16.439 1.00 0.00 O ATOM 51 OD2 ASP A 12 29.024 41.516 18.149 1.00 0.00 O ATOM 0 H ASP A 12 25.999 38.348 19.878 1.00 0.00 H new ATOM 0 HA ASP A 12 26.400 38.888 17.019 1.00 0.00 H new ATOM 0 HB2 ASP A 12 26.880 40.313 19.256 1.00 0.00 H new ATOM 0 HB3 ASP A 12 28.286 39.272 19.350 1.00 0.00 H new ATOM 56 N THR A 13 28.037 37.097 16.518 1.00 0.00 N ATOM 57 CA THR A 13 28.808 35.941 16.178 1.00 0.00 C ATOM 58 C THR A 13 30.235 36.267 15.906 1.00 0.00 C ATOM 59 O THR A 13 30.578 37.337 15.406 1.00 0.00 O ATOM 60 CB THR A 13 28.279 35.124 15.037 1.00 0.00 C ATOM 61 OG1 THR A 13 27.968 35.898 13.888 1.00 0.00 O ATOM 62 CG2 THR A 13 26.979 34.426 15.470 1.00 0.00 C ATOM 0 H THR A 13 27.846 37.707 15.723 1.00 0.00 H new ATOM 0 HA THR A 13 28.723 35.328 17.075 1.00 0.00 H new ATOM 0 HB THR A 13 29.069 34.418 14.778 1.00 0.00 H new ATOM 0 HG1 THR A 13 27.630 35.311 13.180 1.00 0.00 H new ATOM 0 HG21 THR A 13 26.592 33.831 14.642 1.00 0.00 H new ATOM 0 HG22 THR A 13 27.181 33.775 16.321 1.00 0.00 H new ATOM 0 HG23 THR A 13 26.241 35.176 15.754 1.00 0.00 H new ATOM 70 N PHE A 14 31.143 35.316 16.195 1.00 0.00 N ATOM 71 CA PHE A 14 32.553 35.511 16.066 1.00 0.00 C ATOM 72 C PHE A 14 33.162 34.224 15.624 1.00 0.00 C ATOM 73 O PHE A 14 32.903 33.158 16.180 1.00 0.00 O ATOM 74 CB PHE A 14 33.314 35.915 17.339 1.00 0.00 C ATOM 75 CG PHE A 14 32.463 36.667 18.304 1.00 0.00 C ATOM 76 CD1 PHE A 14 32.320 38.033 18.241 1.00 0.00 C ATOM 77 CD2 PHE A 14 31.797 35.959 19.277 1.00 0.00 C ATOM 78 CE1 PHE A 14 31.513 38.682 19.144 1.00 0.00 C ATOM 79 CE2 PHE A 14 30.998 36.604 20.190 1.00 0.00 C ATOM 80 CZ PHE A 14 30.862 37.970 20.124 1.00 0.00 C ATOM 0 H PHE A 14 30.888 34.386 16.528 1.00 0.00 H new ATOM 0 HA PHE A 14 32.646 36.341 15.366 1.00 0.00 H new ATOM 0 HB2 PHE A 14 33.702 35.020 17.825 1.00 0.00 H new ATOM 0 HB3 PHE A 14 34.173 36.527 17.065 1.00 0.00 H new ATOM 0 HD1 PHE A 14 32.842 38.596 17.482 1.00 0.00 H new ATOM 0 HD2 PHE A 14 31.903 34.885 19.324 1.00 0.00 H new ATOM 0 HE1 PHE A 14 31.390 39.753 19.084 1.00 0.00 H new ATOM 0 HE2 PHE A 14 30.481 36.042 20.954 1.00 0.00 H new ATOM 0 HZ PHE A 14 30.243 38.485 20.843 1.00 0.00 H new ATOM 90 N GLU A 15 34.035 34.306 14.603 1.00 0.00 N ATOM 91 CA GLU A 15 34.895 33.252 14.162 1.00 0.00 C ATOM 92 C GLU A 15 36.160 33.321 14.949 1.00 0.00 C ATOM 93 O GLU A 15 36.852 34.337 14.957 1.00 0.00 O ATOM 94 CB GLU A 15 35.221 33.356 12.664 1.00 0.00 C ATOM 95 CG GLU A 15 34.139 33.982 11.781 1.00 0.00 C ATOM 96 CD GLU A 15 34.282 35.492 11.652 1.00 0.00 C ATOM 97 OE1 GLU A 15 33.932 36.240 12.604 1.00 0.00 O ATOM 98 OE2 GLU A 15 34.743 35.952 10.574 1.00 0.00 O ATOM 0 H GLU A 15 34.146 35.158 14.054 1.00 0.00 H new ATOM 0 HA GLU A 15 34.383 32.302 14.317 1.00 0.00 H new ATOM 0 HB2 GLU A 15 36.135 33.939 12.552 1.00 0.00 H new ATOM 0 HB3 GLU A 15 35.433 32.355 12.289 1.00 0.00 H new ATOM 0 HG2 GLU A 15 34.181 33.532 10.789 1.00 0.00 H new ATOM 0 HG3 GLU A 15 33.158 33.749 12.196 1.00 0.00 H new ATOM 105 N VAL A 16 36.486 32.245 15.688 1.00 0.00 N ATOM 106 CA VAL A 16 37.516 32.222 16.679 1.00 0.00 C ATOM 107 C VAL A 16 38.580 31.263 16.263 1.00 0.00 C ATOM 108 O VAL A 16 38.438 30.053 16.431 1.00 0.00 O ATOM 109 CB VAL A 16 36.949 31.815 18.006 1.00 0.00 C ATOM 110 CG1 VAL A 16 38.003 31.742 19.124 1.00 0.00 C ATOM 111 CG2 VAL A 16 35.783 32.745 18.381 1.00 0.00 C ATOM 0 H VAL A 16 36.008 31.349 15.589 1.00 0.00 H new ATOM 0 HA VAL A 16 37.944 33.220 16.776 1.00 0.00 H new ATOM 0 HB VAL A 16 36.574 30.797 17.901 1.00 0.00 H new ATOM 0 HG11 VAL A 16 37.524 31.442 20.056 1.00 0.00 H new ATOM 0 HG12 VAL A 16 38.767 31.012 18.857 1.00 0.00 H new ATOM 0 HG13 VAL A 16 38.466 32.721 19.252 1.00 0.00 H new ATOM 0 HG21 VAL A 16 35.374 32.445 19.346 1.00 0.00 H new ATOM 0 HG22 VAL A 16 36.142 33.772 18.442 1.00 0.00 H new ATOM 0 HG23 VAL A 16 35.005 32.678 17.621 1.00 0.00 H new ATOM 121 N GLU A 17 39.709 31.745 15.713 1.00 0.00 N ATOM 122 CA GLU A 17 40.851 30.917 15.477 1.00 0.00 C ATOM 123 C GLU A 17 41.732 30.952 16.678 1.00 0.00 C ATOM 124 O GLU A 17 42.414 31.936 16.961 1.00 0.00 O ATOM 125 CB GLU A 17 41.668 31.314 14.236 1.00 0.00 C ATOM 126 CG GLU A 17 40.993 30.960 12.909 1.00 0.00 C ATOM 127 CD GLU A 17 39.961 31.982 12.457 1.00 0.00 C ATOM 128 OE1 GLU A 17 40.330 33.179 12.320 1.00 0.00 O ATOM 129 OE2 GLU A 17 38.805 31.588 12.142 1.00 0.00 O ATOM 0 H GLU A 17 39.831 32.717 15.430 1.00 0.00 H new ATOM 0 HA GLU A 17 40.473 29.913 15.285 1.00 0.00 H new ATOM 0 HB2 GLU A 17 41.853 32.388 14.263 1.00 0.00 H new ATOM 0 HB3 GLU A 17 42.640 30.822 14.280 1.00 0.00 H new ATOM 0 HG2 GLU A 17 41.757 30.862 12.138 1.00 0.00 H new ATOM 0 HG3 GLU A 17 40.511 29.987 13.005 1.00 0.00 H new ATOM 136 N LEU A 18 41.706 29.855 17.457 1.00 0.00 N ATOM 137 CA LEU A 18 42.306 29.756 18.752 1.00 0.00 C ATOM 138 C LEU A 18 43.333 28.678 18.771 1.00 0.00 C ATOM 139 O LEU A 18 43.097 27.547 18.346 1.00 0.00 O ATOM 140 CB LEU A 18 41.196 29.400 19.755 1.00 0.00 C ATOM 141 CG LEU A 18 41.635 29.245 21.220 1.00 0.00 C ATOM 142 CD1 LEU A 18 42.132 30.578 21.806 1.00 0.00 C ATOM 143 CD2 LEU A 18 40.460 28.682 22.038 1.00 0.00 C ATOM 0 H LEU A 18 41.243 28.993 17.168 1.00 0.00 H new ATOM 0 HA LEU A 18 42.787 30.700 19.008 1.00 0.00 H new ATOM 0 HB2 LEU A 18 40.429 30.172 19.706 1.00 0.00 H new ATOM 0 HB3 LEU A 18 40.731 28.468 19.435 1.00 0.00 H new ATOM 0 HG LEU A 18 42.474 28.551 21.267 1.00 0.00 H new ATOM 0 HD11 LEU A 18 42.434 30.430 22.843 1.00 0.00 H new ATOM 0 HD12 LEU A 18 42.984 30.935 21.227 1.00 0.00 H new ATOM 0 HD13 LEU A 18 41.331 31.316 21.763 1.00 0.00 H new ATOM 0 HD21 LEU A 18 40.763 28.569 23.079 1.00 0.00 H new ATOM 0 HD22 LEU A 18 39.614 29.367 21.978 1.00 0.00 H new ATOM 0 HD23 LEU A 18 40.170 27.711 21.637 1.00 0.00 H new ATOM 155 N ALA A 19 44.548 28.961 19.276 1.00 0.00 N ATOM 156 CA ALA A 19 45.576 27.990 19.485 1.00 0.00 C ATOM 157 C ALA A 19 45.645 27.637 20.931 1.00 0.00 C ATOM 158 O ALA A 19 45.386 28.468 21.799 1.00 0.00 O ATOM 159 CB ALA A 19 46.924 28.531 18.983 1.00 0.00 C ATOM 0 H ALA A 19 44.824 29.904 19.549 1.00 0.00 H new ATOM 0 HA ALA A 19 45.344 27.087 18.920 1.00 0.00 H new ATOM 0 HB1 ALA A 19 47.700 27.783 19.147 1.00 0.00 H new ATOM 0 HB2 ALA A 19 46.853 28.753 17.918 1.00 0.00 H new ATOM 0 HB3 ALA A 19 47.176 29.441 19.527 1.00 0.00 H new ATOM 165 N LYS A 20 45.972 26.373 21.257 1.00 0.00 N ATOM 166 CA LYS A 20 46.049 25.889 22.600 1.00 0.00 C ATOM 167 C LYS A 20 47.153 26.446 23.431 1.00 0.00 C ATOM 168 O LYS A 20 48.105 27.040 22.930 1.00 0.00 O ATOM 169 CB LYS A 20 46.265 24.367 22.571 1.00 0.00 C ATOM 170 CG LYS A 20 45.068 23.541 22.095 1.00 0.00 C ATOM 171 CD LYS A 20 45.485 22.093 21.832 1.00 0.00 C ATOM 172 CE LYS A 20 44.323 21.098 21.784 1.00 0.00 C ATOM 173 NZ LYS A 20 44.796 19.814 21.221 1.00 0.00 N ATOM 0 H LYS A 20 46.191 25.662 20.559 1.00 0.00 H new ATOM 0 HA LYS A 20 45.110 26.204 23.055 1.00 0.00 H new ATOM 0 HB2 LYS A 20 47.114 24.150 21.923 1.00 0.00 H new ATOM 0 HB3 LYS A 20 46.536 24.037 23.574 1.00 0.00 H new ATOM 0 HG2 LYS A 20 44.279 23.567 22.847 1.00 0.00 H new ATOM 0 HG3 LYS A 20 44.656 23.978 21.185 1.00 0.00 H new ATOM 0 HD2 LYS A 20 46.024 22.049 20.885 1.00 0.00 H new ATOM 0 HD3 LYS A 20 46.182 21.782 22.610 1.00 0.00 H new ATOM 0 HE2 LYS A 20 43.922 20.942 22.785 1.00 0.00 H new ATOM 0 HE3 LYS A 20 43.513 21.498 21.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 44.041 19.102 21.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 45.048 19.945 20.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 45.632 19.490 21.749 1.00 0.00 H new ATOM 187 N THR A 21 47.078 26.237 24.759 1.00 0.00 N ATOM 188 CA THR A 21 48.123 26.484 25.702 1.00 0.00 C ATOM 189 C THR A 21 48.250 25.286 26.579 1.00 0.00 C ATOM 190 O THR A 21 47.258 24.766 27.089 1.00 0.00 O ATOM 191 CB THR A 21 47.972 27.700 26.566 1.00 0.00 C ATOM 192 OG1 THR A 21 46.705 27.765 27.206 1.00 0.00 O ATOM 193 CG2 THR A 21 48.116 28.969 25.710 1.00 0.00 C ATOM 0 H THR A 21 46.233 25.873 25.200 1.00 0.00 H new ATOM 0 HA THR A 21 49.011 26.681 25.101 1.00 0.00 H new ATOM 0 HB THR A 21 48.749 27.633 27.327 1.00 0.00 H new ATOM 0 HG1 THR A 21 46.658 28.574 27.758 1.00 0.00 H new ATOM 0 HG21 THR A 21 48.005 29.849 26.343 1.00 0.00 H new ATOM 0 HG22 THR A 21 49.099 28.981 25.240 1.00 0.00 H new ATOM 0 HG23 THR A 21 47.345 28.977 24.939 1.00 0.00 H new ATOM 201 N ASP A 22 49.477 24.770 26.768 1.00 0.00 N ATOM 202 CA ASP A 22 49.808 23.586 27.499 1.00 0.00 C ATOM 203 C ASP A 22 48.956 22.401 27.194 1.00 0.00 C ATOM 204 O ASP A 22 48.472 21.678 28.063 1.00 0.00 O ATOM 205 CB ASP A 22 49.935 23.927 28.993 1.00 0.00 C ATOM 206 CG ASP A 22 50.738 22.909 29.791 1.00 0.00 C ATOM 207 OD1 ASP A 22 51.941 22.710 29.474 1.00 0.00 O ATOM 208 OD2 ASP A 22 50.202 22.329 30.773 1.00 0.00 O ATOM 0 H ASP A 22 50.305 25.219 26.377 1.00 0.00 H new ATOM 0 HA ASP A 22 50.782 23.241 27.153 1.00 0.00 H new ATOM 0 HB2 ASP A 22 50.405 24.905 29.094 1.00 0.00 H new ATOM 0 HB3 ASP A 22 48.937 24.006 29.424 1.00 0.00 H new ATOM 213 N GLY A 23 48.695 22.156 25.897 1.00 0.00 N ATOM 214 CA GLY A 23 47.915 21.048 25.444 1.00 0.00 C ATOM 215 C GLY A 23 46.433 21.200 25.487 1.00 0.00 C ATOM 216 O GLY A 23 45.722 20.392 24.891 1.00 0.00 O ATOM 0 H GLY A 23 49.038 22.748 25.141 1.00 0.00 H new ATOM 0 HA2 GLY A 23 48.203 20.829 24.416 1.00 0.00 H new ATOM 0 HA3 GLY A 23 48.184 20.178 26.043 1.00 0.00 H new ATOM 220 N SER A 24 45.886 22.201 26.199 1.00 0.00 N ATOM 221 CA SER A 24 44.476 22.353 26.388 1.00 0.00 C ATOM 222 C SER A 24 43.982 23.668 25.891 1.00 0.00 C ATOM 223 O SER A 24 44.744 24.527 25.450 1.00 0.00 O ATOM 224 CB SER A 24 44.063 22.177 27.858 1.00 0.00 C ATOM 225 OG SER A 24 42.689 21.842 27.986 1.00 0.00 O ATOM 0 H SER A 24 46.439 22.925 26.656 1.00 0.00 H new ATOM 0 HA SER A 24 44.014 21.560 25.800 1.00 0.00 H new ATOM 0 HB2 SER A 24 44.671 21.396 28.315 1.00 0.00 H new ATOM 0 HB3 SER A 24 44.264 23.098 28.404 1.00 0.00 H new ATOM 0 HG SER A 24 42.465 21.737 28.934 1.00 0.00 H new ATOM 231 N LEU A 25 42.653 23.870 25.931 1.00 0.00 N ATOM 232 CA LEU A 25 42.000 25.074 25.521 1.00 0.00 C ATOM 233 C LEU A 25 41.662 25.913 26.706 1.00 0.00 C ATOM 234 O LEU A 25 42.133 27.042 26.828 1.00 0.00 O ATOM 235 CB LEU A 25 40.741 24.766 24.694 1.00 0.00 C ATOM 236 CG LEU A 25 41.029 24.143 23.318 1.00 0.00 C ATOM 237 CD1 LEU A 25 39.710 23.739 22.635 1.00 0.00 C ATOM 238 CD2 LEU A 25 41.813 25.093 22.397 1.00 0.00 C ATOM 0 H LEU A 25 42.003 23.159 26.266 1.00 0.00 H new ATOM 0 HA LEU A 25 42.687 25.634 24.886 1.00 0.00 H new ATOM 0 HB2 LEU A 25 40.104 24.088 25.262 1.00 0.00 H new ATOM 0 HB3 LEU A 25 40.178 25.689 24.552 1.00 0.00 H new ATOM 0 HG LEU A 25 41.648 23.262 23.489 1.00 0.00 H new ATOM 0 HD11 LEU A 25 39.924 23.299 21.661 1.00 0.00 H new ATOM 0 HD12 LEU A 25 39.187 23.011 23.255 1.00 0.00 H new ATOM 0 HD13 LEU A 25 39.083 24.621 22.504 1.00 0.00 H new ATOM 0 HD21 LEU A 25 41.991 24.606 21.438 1.00 0.00 H new ATOM 0 HD22 LEU A 25 41.237 26.005 22.239 1.00 0.00 H new ATOM 0 HD23 LEU A 25 42.768 25.343 22.860 1.00 0.00 H new ATOM 250 N GLY A 26 40.839 25.419 27.648 1.00 0.00 N ATOM 251 CA GLY A 26 40.534 26.075 28.881 1.00 0.00 C ATOM 252 C GLY A 26 39.068 26.300 29.024 1.00 0.00 C ATOM 253 O GLY A 26 38.632 27.371 29.446 1.00 0.00 O ATOM 0 H GLY A 26 40.365 24.522 27.545 1.00 0.00 H new ATOM 0 HA2 GLY A 26 40.895 25.473 29.715 1.00 0.00 H new ATOM 0 HA3 GLY A 26 41.057 27.030 28.927 1.00 0.00 H new ATOM 257 N ILE A 27 38.249 25.285 28.695 1.00 0.00 N ATOM 258 CA ILE A 27 36.824 25.399 28.640 1.00 0.00 C ATOM 259 C ILE A 27 36.170 24.143 29.103 1.00 0.00 C ATOM 260 O ILE A 27 36.667 23.030 28.944 1.00 0.00 O ATOM 261 CB ILE A 27 36.360 25.807 27.272 1.00 0.00 C ATOM 262 CG1 ILE A 27 34.836 25.863 27.075 1.00 0.00 C ATOM 263 CG2 ILE A 27 37.042 24.951 26.192 1.00 0.00 C ATOM 264 CD1 ILE A 27 34.415 26.555 25.780 1.00 0.00 C ATOM 0 H ILE A 27 38.590 24.353 28.459 1.00 0.00 H new ATOM 0 HA ILE A 27 36.522 26.192 29.325 1.00 0.00 H new ATOM 0 HB ILE A 27 36.673 26.846 27.166 1.00 0.00 H new ATOM 0 HG12 ILE A 27 34.439 24.848 27.081 1.00 0.00 H new ATOM 0 HG13 ILE A 27 34.387 26.386 27.920 1.00 0.00 H new ATOM 0 HG21 ILE A 27 36.693 25.262 25.207 1.00 0.00 H new ATOM 0 HG22 ILE A 27 38.122 25.082 26.252 1.00 0.00 H new ATOM 0 HG23 ILE A 27 36.795 23.901 26.350 1.00 0.00 H new ATOM 0 HD11 ILE A 27 33.328 26.558 25.706 1.00 0.00 H new ATOM 0 HD12 ILE A 27 34.782 27.581 25.780 1.00 0.00 H new ATOM 0 HD13 ILE A 27 34.835 26.020 24.928 1.00 0.00 H new ATOM 276 N SER A 28 34.988 24.319 29.721 1.00 0.00 N ATOM 277 CA SER A 28 34.082 23.270 30.077 1.00 0.00 C ATOM 278 C SER A 28 32.754 23.566 29.472 1.00 0.00 C ATOM 279 O SER A 28 32.132 24.583 29.777 1.00 0.00 O ATOM 280 CB SER A 28 33.891 23.128 31.596 1.00 0.00 C ATOM 281 OG SER A 28 35.088 22.654 32.196 1.00 0.00 O ATOM 0 H SER A 28 34.646 25.243 29.986 1.00 0.00 H new ATOM 0 HA SER A 28 34.508 22.337 29.707 1.00 0.00 H new ATOM 0 HB2 SER A 28 33.615 24.090 32.027 1.00 0.00 H new ATOM 0 HB3 SER A 28 33.073 22.439 31.805 1.00 0.00 H new ATOM 0 HG SER A 28 34.957 22.568 33.163 1.00 0.00 H new ATOM 287 N VAL A 29 32.263 22.697 28.571 1.00 0.00 N ATOM 288 CA VAL A 29 31.016 22.856 27.888 1.00 0.00 C ATOM 289 C VAL A 29 29.901 22.118 28.546 1.00 0.00 C ATOM 290 O VAL A 29 30.109 21.298 29.437 1.00 0.00 O ATOM 291 CB VAL A 29 31.106 22.474 26.441 1.00 0.00 C ATOM 292 CG1 VAL A 29 31.914 23.550 25.697 1.00 0.00 C ATOM 293 CG2 VAL A 29 31.752 21.089 26.266 1.00 0.00 C ATOM 0 H VAL A 29 32.757 21.845 28.306 1.00 0.00 H new ATOM 0 HA VAL A 29 30.789 23.921 27.945 1.00 0.00 H new ATOM 0 HB VAL A 29 30.101 22.412 26.024 1.00 0.00 H new ATOM 0 HG11 VAL A 29 31.988 23.285 24.642 1.00 0.00 H new ATOM 0 HG12 VAL A 29 31.414 24.513 25.795 1.00 0.00 H new ATOM 0 HG13 VAL A 29 32.914 23.615 26.126 1.00 0.00 H new ATOM 0 HG21 VAL A 29 31.802 20.842 25.205 1.00 0.00 H new ATOM 0 HG22 VAL A 29 32.759 21.102 26.684 1.00 0.00 H new ATOM 0 HG23 VAL A 29 31.153 20.340 26.785 1.00 0.00 H new ATOM 303 N THR A 30 28.654 22.435 28.151 1.00 0.00 N ATOM 304 CA THR A 30 27.451 21.842 28.646 1.00 0.00 C ATOM 305 C THR A 30 26.387 21.889 27.605 1.00 0.00 C ATOM 306 O THR A 30 26.551 22.532 26.570 1.00 0.00 O ATOM 307 CB THR A 30 26.962 22.496 29.904 1.00 0.00 C ATOM 308 OG1 THR A 30 25.994 21.729 30.605 1.00 0.00 O ATOM 309 CG2 THR A 30 26.404 23.913 29.692 1.00 0.00 C ATOM 0 H THR A 30 28.477 23.148 27.444 1.00 0.00 H new ATOM 0 HA THR A 30 27.685 20.805 28.889 1.00 0.00 H new ATOM 0 HB THR A 30 27.865 22.565 30.511 1.00 0.00 H new ATOM 0 HG1 THR A 30 25.719 22.209 31.414 1.00 0.00 H new ATOM 0 HG21 THR A 30 26.071 24.319 30.647 1.00 0.00 H new ATOM 0 HG22 THR A 30 27.183 24.553 29.278 1.00 0.00 H new ATOM 0 HG23 THR A 30 25.562 23.873 29.001 1.00 0.00 H new ATOM 317 N GLY A 31 25.236 21.236 27.846 1.00 0.00 N ATOM 318 CA GLY A 31 24.075 21.321 27.015 1.00 0.00 C ATOM 319 C GLY A 31 23.921 20.171 26.080 1.00 0.00 C ATOM 320 O GLY A 31 24.225 19.028 26.416 1.00 0.00 O ATOM 0 H GLY A 31 25.109 20.624 28.652 1.00 0.00 H new ATOM 0 HA2 GLY A 31 23.190 21.384 27.648 1.00 0.00 H new ATOM 0 HA3 GLY A 31 24.120 22.244 26.437 1.00 0.00 H new ATOM 324 N GLY A 32 23.409 20.449 24.867 1.00 0.00 N ATOM 325 CA GLY A 32 23.146 19.464 23.864 1.00 0.00 C ATOM 326 C GLY A 32 21.693 19.175 23.710 1.00 0.00 C ATOM 327 O GLY A 32 20.867 19.465 24.573 1.00 0.00 O ATOM 0 H GLY A 32 23.169 21.396 24.574 1.00 0.00 H new ATOM 0 HA2 GLY A 32 23.547 19.806 22.910 1.00 0.00 H new ATOM 0 HA3 GLY A 32 23.671 18.543 24.118 1.00 0.00 H new ATOM 331 N VAL A 33 21.315 18.555 22.577 1.00 0.00 N ATOM 332 CA VAL A 33 19.966 18.283 22.190 1.00 0.00 C ATOM 333 C VAL A 33 19.256 17.308 23.066 1.00 0.00 C ATOM 334 O VAL A 33 18.029 17.275 23.147 1.00 0.00 O ATOM 335 CB VAL A 33 19.902 17.915 20.738 1.00 0.00 C ATOM 336 CG1 VAL A 33 20.399 16.485 20.468 1.00 0.00 C ATOM 337 CG2 VAL A 33 18.487 18.130 20.173 1.00 0.00 C ATOM 0 H VAL A 33 21.993 18.224 21.891 1.00 0.00 H new ATOM 0 HA VAL A 33 19.411 19.210 22.334 1.00 0.00 H new ATOM 0 HB VAL A 33 20.583 18.585 20.214 1.00 0.00 H new ATOM 0 HG11 VAL A 33 20.331 16.271 19.401 1.00 0.00 H new ATOM 0 HG12 VAL A 33 21.436 16.393 20.791 1.00 0.00 H new ATOM 0 HG13 VAL A 33 19.783 15.775 21.020 1.00 0.00 H new ATOM 0 HG21 VAL A 33 18.471 17.855 19.118 1.00 0.00 H new ATOM 0 HG22 VAL A 33 17.778 17.509 20.721 1.00 0.00 H new ATOM 0 HG23 VAL A 33 18.208 19.178 20.279 1.00 0.00 H new ATOM 347 N ASN A 34 20.018 16.483 23.806 1.00 0.00 N ATOM 348 CA ASN A 34 19.543 15.555 24.784 1.00 0.00 C ATOM 349 C ASN A 34 18.996 16.185 26.019 1.00 0.00 C ATOM 350 O ASN A 34 18.130 15.607 26.675 1.00 0.00 O ATOM 351 CB ASN A 34 20.637 14.528 25.120 1.00 0.00 C ATOM 352 CG ASN A 34 21.970 15.170 25.472 1.00 0.00 C ATOM 353 OD1 ASN A 34 22.665 15.718 24.618 1.00 0.00 O ATOM 354 ND2 ASN A 34 22.362 15.104 26.773 1.00 0.00 N ATOM 0 H ASN A 34 21.034 16.464 23.714 1.00 0.00 H new ATOM 0 HA ASN A 34 18.693 15.047 24.328 1.00 0.00 H new ATOM 0 HB2 ASN A 34 20.305 13.913 25.956 1.00 0.00 H new ATOM 0 HB3 ASN A 34 20.775 13.861 24.269 1.00 0.00 H new ATOM 0 HD21 ASN A 34 23.251 15.515 27.059 1.00 0.00 H new ATOM 0 HD22 ASN A 34 21.767 14.644 27.462 1.00 0.00 H new ATOM 361 N THR A 35 19.444 17.393 26.404 1.00 0.00 N ATOM 362 CA THR A 35 19.058 18.006 27.637 1.00 0.00 C ATOM 363 C THR A 35 18.131 19.134 27.342 1.00 0.00 C ATOM 364 O THR A 35 18.225 19.777 26.298 1.00 0.00 O ATOM 365 CB THR A 35 20.229 18.496 28.438 1.00 0.00 C ATOM 366 OG1 THR A 35 21.209 17.475 28.556 1.00 0.00 O ATOM 367 CG2 THR A 35 19.825 18.819 29.885 1.00 0.00 C ATOM 0 H THR A 35 20.088 17.956 25.848 1.00 0.00 H new ATOM 0 HA THR A 35 18.564 17.249 28.246 1.00 0.00 H new ATOM 0 HB THR A 35 20.602 19.379 27.919 1.00 0.00 H new ATOM 0 HG1 THR A 35 21.968 17.809 29.079 1.00 0.00 H new ATOM 0 HG21 THR A 35 20.697 19.171 30.436 1.00 0.00 H new ATOM 0 HG22 THR A 35 19.059 19.594 29.884 1.00 0.00 H new ATOM 0 HG23 THR A 35 19.432 17.921 30.362 1.00 0.00 H new ATOM 375 N SER A 36 17.163 19.443 28.224 1.00 0.00 N ATOM 376 CA SER A 36 16.195 20.476 28.022 1.00 0.00 C ATOM 377 C SER A 36 16.712 21.849 28.284 1.00 0.00 C ATOM 378 O SER A 36 16.192 22.583 29.123 1.00 0.00 O ATOM 379 CB SER A 36 14.947 20.217 28.882 1.00 0.00 C ATOM 380 OG SER A 36 13.814 20.961 28.456 1.00 0.00 O ATOM 0 H SER A 36 17.051 18.954 29.112 1.00 0.00 H new ATOM 0 HA SER A 36 15.939 20.439 26.963 1.00 0.00 H new ATOM 0 HB2 SER A 36 14.708 19.154 28.854 1.00 0.00 H new ATOM 0 HB3 SER A 36 15.169 20.467 29.919 1.00 0.00 H new ATOM 0 HG SER A 36 14.025 21.918 28.476 1.00 0.00 H new ATOM 386 N VAL A 37 17.769 22.268 27.566 1.00 0.00 N ATOM 387 CA VAL A 37 18.496 23.482 27.770 1.00 0.00 C ATOM 388 C VAL A 37 18.124 24.589 26.846 1.00 0.00 C ATOM 389 O VAL A 37 18.905 25.522 26.665 1.00 0.00 O ATOM 390 CB VAL A 37 19.978 23.259 27.699 1.00 0.00 C ATOM 391 CG1 VAL A 37 20.412 22.393 28.893 1.00 0.00 C ATOM 392 CG2 VAL A 37 20.397 22.629 26.361 1.00 0.00 C ATOM 0 H VAL A 37 18.140 21.720 26.790 1.00 0.00 H new ATOM 0 HA VAL A 37 18.212 23.797 28.774 1.00 0.00 H new ATOM 0 HB VAL A 37 20.484 24.223 27.753 1.00 0.00 H new ATOM 0 HG11 VAL A 37 21.488 22.226 28.849 1.00 0.00 H new ATOM 0 HG12 VAL A 37 20.162 22.904 29.823 1.00 0.00 H new ATOM 0 HG13 VAL A 37 19.894 21.435 28.855 1.00 0.00 H new ATOM 0 HG21 VAL A 37 21.477 22.484 26.350 1.00 0.00 H new ATOM 0 HG22 VAL A 37 19.900 21.666 26.241 1.00 0.00 H new ATOM 0 HG23 VAL A 37 20.111 23.290 25.542 1.00 0.00 H new ATOM 402 N ARG A 38 16.917 24.552 26.251 1.00 0.00 N ATOM 403 CA ARG A 38 16.379 25.502 25.329 1.00 0.00 C ATOM 404 C ARG A 38 16.878 25.232 23.951 1.00 0.00 C ATOM 405 O ARG A 38 18.003 25.572 23.586 1.00 0.00 O ATOM 406 CB ARG A 38 16.480 26.981 25.738 1.00 0.00 C ATOM 407 CG ARG A 38 15.841 27.246 27.103 1.00 0.00 C ATOM 408 CD ARG A 38 16.325 28.505 27.825 1.00 0.00 C ATOM 409 NE ARG A 38 15.742 28.428 29.195 1.00 0.00 N ATOM 410 CZ ARG A 38 16.130 29.217 30.240 1.00 0.00 C ATOM 411 NH1 ARG A 38 17.224 30.032 30.187 1.00 0.00 N ATOM 412 NH2 ARG A 38 15.442 29.178 31.418 1.00 0.00 N ATOM 0 H ARG A 38 16.264 23.790 26.433 1.00 0.00 H new ATOM 0 HA ARG A 38 15.301 25.341 25.348 1.00 0.00 H new ATOM 0 HB2 ARG A 38 17.528 27.278 25.765 1.00 0.00 H new ATOM 0 HB3 ARG A 38 15.993 27.599 24.984 1.00 0.00 H new ATOM 0 HG2 ARG A 38 14.761 27.316 26.971 1.00 0.00 H new ATOM 0 HG3 ARG A 38 16.028 26.386 27.745 1.00 0.00 H new ATOM 0 HD2 ARG A 38 17.414 28.541 27.863 1.00 0.00 H new ATOM 0 HD3 ARG A 38 15.994 29.406 27.308 1.00 0.00 H new ATOM 0 HE ARG A 38 15.006 27.742 29.363 1.00 0.00 H new ATOM 0 HH11 ARG A 38 17.791 30.070 29.340 1.00 0.00 H new ATOM 0 HH12 ARG A 38 17.474 30.603 30.994 1.00 0.00 H new ATOM 0 HH21 ARG A 38 14.637 28.559 31.518 1.00 0.00 H new ATOM 0 HH22 ARG A 38 15.732 29.768 32.198 1.00 0.00 H new ATOM 426 N HIS A 39 16.049 24.535 23.153 1.00 0.00 N ATOM 427 CA HIS A 39 16.376 23.912 21.909 1.00 0.00 C ATOM 428 C HIS A 39 17.327 22.774 22.056 1.00 0.00 C ATOM 429 O HIS A 39 16.947 21.609 21.955 1.00 0.00 O ATOM 430 CB HIS A 39 16.776 24.891 20.792 1.00 0.00 C ATOM 431 CG HIS A 39 15.669 25.827 20.405 1.00 0.00 C ATOM 432 ND1 HIS A 39 15.894 27.087 19.887 1.00 0.00 N ATOM 433 CD2 HIS A 39 14.320 25.658 20.372 1.00 0.00 C ATOM 434 CE1 HIS A 39 14.682 27.613 19.569 1.00 0.00 C ATOM 435 NE2 HIS A 39 13.701 26.778 19.856 1.00 0.00 N ATOM 0 H HIS A 39 15.069 24.397 23.401 1.00 0.00 H new ATOM 0 HA HIS A 39 15.436 23.478 21.568 1.00 0.00 H new ATOM 0 HB2 HIS A 39 17.638 25.473 21.118 1.00 0.00 H new ATOM 0 HB3 HIS A 39 17.088 24.324 19.915 1.00 0.00 H new ATOM 0 HD2 HIS A 39 13.804 24.769 20.704 1.00 0.00 H new ATOM 0 HE1 HIS A 39 14.539 28.592 19.136 1.00 0.00 H new ATOM 0 HE2 HIS A 39 12.701 26.928 19.725 1.00 0.00 H new ATOM 443 N GLY A 40 18.614 23.056 22.325 1.00 0.00 N ATOM 444 CA GLY A 40 19.593 22.031 22.515 1.00 0.00 C ATOM 445 C GLY A 40 20.971 22.548 22.289 1.00 0.00 C ATOM 446 O GLY A 40 21.808 21.872 21.693 1.00 0.00 O ATOM 0 H GLY A 40 18.980 24.004 22.412 1.00 0.00 H new ATOM 0 HA2 GLY A 40 19.513 21.633 23.526 1.00 0.00 H new ATOM 0 HA3 GLY A 40 19.396 21.206 21.831 1.00 0.00 H new ATOM 450 N GLY A 41 21.261 23.773 22.763 1.00 0.00 N ATOM 451 CA GLY A 41 22.507 24.421 22.492 1.00 0.00 C ATOM 452 C GLY A 41 23.645 23.882 23.290 1.00 0.00 C ATOM 453 O GLY A 41 23.472 23.396 24.406 1.00 0.00 O ATOM 0 H GLY A 41 20.624 24.321 23.341 1.00 0.00 H new ATOM 0 HA2 GLY A 41 22.737 24.319 21.431 1.00 0.00 H new ATOM 0 HA3 GLY A 41 22.404 25.487 22.695 1.00 0.00 H new ATOM 457 N ILE A 42 24.864 23.981 22.729 1.00 0.00 N ATOM 458 CA ILE A 42 26.091 23.693 23.402 1.00 0.00 C ATOM 459 C ILE A 42 26.554 24.973 24.008 1.00 0.00 C ATOM 460 O ILE A 42 26.855 25.941 23.312 1.00 0.00 O ATOM 461 CB ILE A 42 27.128 23.113 22.486 1.00 0.00 C ATOM 462 CG1 ILE A 42 26.629 21.823 21.815 1.00 0.00 C ATOM 463 CG2 ILE A 42 28.453 22.871 23.229 1.00 0.00 C ATOM 464 CD1 ILE A 42 26.423 20.640 22.760 1.00 0.00 C ATOM 0 H ILE A 42 24.999 24.275 21.762 1.00 0.00 H new ATOM 0 HA ILE A 42 25.929 22.931 24.165 1.00 0.00 H new ATOM 0 HB ILE A 42 27.313 23.844 21.699 1.00 0.00 H new ATOM 0 HG12 ILE A 42 25.686 22.035 21.312 1.00 0.00 H new ATOM 0 HG13 ILE A 42 27.343 21.533 21.044 1.00 0.00 H new ATOM 0 HG21 ILE A 42 29.185 22.450 22.540 1.00 0.00 H new ATOM 0 HG22 ILE A 42 28.827 23.816 23.623 1.00 0.00 H new ATOM 0 HG23 ILE A 42 28.287 22.175 24.051 1.00 0.00 H new ATOM 0 HD11 ILE A 42 26.071 19.778 22.193 1.00 0.00 H new ATOM 0 HD12 ILE A 42 27.367 20.393 23.245 1.00 0.00 H new ATOM 0 HD13 ILE A 42 25.684 20.903 23.517 1.00 0.00 H new ATOM 476 N TYR A 43 26.586 25.043 25.351 1.00 0.00 N ATOM 477 CA TYR A 43 26.828 26.254 26.071 1.00 0.00 C ATOM 478 C TYR A 43 28.124 26.163 26.801 1.00 0.00 C ATOM 479 O TYR A 43 28.582 25.092 27.197 1.00 0.00 O ATOM 480 CB TYR A 43 25.712 26.549 27.086 1.00 0.00 C ATOM 481 CG TYR A 43 24.509 27.110 26.409 1.00 0.00 C ATOM 482 CD1 TYR A 43 24.483 28.447 26.088 1.00 0.00 C ATOM 483 CD2 TYR A 43 23.413 26.330 26.128 1.00 0.00 C ATOM 484 CE1 TYR A 43 23.372 29.004 25.501 1.00 0.00 C ATOM 485 CE2 TYR A 43 22.301 26.879 25.534 1.00 0.00 C ATOM 486 CZ TYR A 43 22.280 28.217 25.220 1.00 0.00 C ATOM 487 OH TYR A 43 21.151 28.785 24.593 1.00 0.00 O ATOM 0 H TYR A 43 26.439 24.233 25.953 1.00 0.00 H new ATOM 0 HA TYR A 43 26.857 27.063 25.341 1.00 0.00 H new ATOM 0 HB2 TYR A 43 25.443 25.633 27.613 1.00 0.00 H new ATOM 0 HB3 TYR A 43 26.074 27.253 27.835 1.00 0.00 H new ATOM 0 HD1 TYR A 43 25.343 29.065 26.299 1.00 0.00 H new ATOM 0 HD2 TYR A 43 23.425 25.279 26.375 1.00 0.00 H new ATOM 0 HE1 TYR A 43 23.357 30.057 25.261 1.00 0.00 H new ATOM 0 HE2 TYR A 43 21.444 26.259 25.314 1.00 0.00 H new ATOM 0 HH TYR A 43 20.467 28.095 24.464 1.00 0.00 H new ATOM 497 N VAL A 44 28.780 27.315 27.029 1.00 0.00 N ATOM 498 CA VAL A 44 29.913 27.420 27.896 1.00 0.00 C ATOM 499 C VAL A 44 29.479 27.394 29.322 1.00 0.00 C ATOM 500 O VAL A 44 28.704 28.237 29.770 1.00 0.00 O ATOM 501 CB VAL A 44 30.734 28.644 27.624 1.00 0.00 C ATOM 502 CG1 VAL A 44 32.020 28.639 28.469 1.00 0.00 C ATOM 503 CG2 VAL A 44 31.096 28.690 26.131 1.00 0.00 C ATOM 0 H VAL A 44 28.514 28.200 26.597 1.00 0.00 H new ATOM 0 HA VAL A 44 30.549 26.558 27.695 1.00 0.00 H new ATOM 0 HB VAL A 44 30.150 29.525 27.892 1.00 0.00 H new ATOM 0 HG11 VAL A 44 32.600 29.537 28.255 1.00 0.00 H new ATOM 0 HG12 VAL A 44 31.760 28.619 29.527 1.00 0.00 H new ATOM 0 HG13 VAL A 44 32.613 27.758 28.224 1.00 0.00 H new ATOM 0 HG21 VAL A 44 31.693 29.579 25.929 1.00 0.00 H new ATOM 0 HG22 VAL A 44 31.668 27.801 25.868 1.00 0.00 H new ATOM 0 HG23 VAL A 44 30.183 28.723 25.536 1.00 0.00 H new ATOM 513 N LYS A 45 29.959 26.416 30.109 1.00 0.00 N ATOM 514 CA LYS A 45 29.615 26.269 31.490 1.00 0.00 C ATOM 515 C LYS A 45 30.616 26.954 32.355 1.00 0.00 C ATOM 516 O LYS A 45 30.265 27.729 33.243 1.00 0.00 O ATOM 517 CB LYS A 45 29.540 24.773 31.835 1.00 0.00 C ATOM 518 CG LYS A 45 29.088 24.441 33.259 1.00 0.00 C ATOM 519 CD LYS A 45 28.763 22.958 33.445 1.00 0.00 C ATOM 520 CE LYS A 45 29.931 22.015 33.151 1.00 0.00 C ATOM 521 NZ LYS A 45 29.526 20.605 33.348 1.00 0.00 N ATOM 0 H LYS A 45 30.608 25.704 29.774 1.00 0.00 H new ATOM 0 HA LYS A 45 28.644 26.731 31.670 1.00 0.00 H new ATOM 0 HB2 LYS A 45 28.857 24.292 31.135 1.00 0.00 H new ATOM 0 HB3 LYS A 45 30.524 24.332 31.674 1.00 0.00 H new ATOM 0 HG2 LYS A 45 29.871 24.728 33.961 1.00 0.00 H new ATOM 0 HG3 LYS A 45 28.208 25.035 33.504 1.00 0.00 H new ATOM 0 HD2 LYS A 45 28.431 22.797 34.471 1.00 0.00 H new ATOM 0 HD3 LYS A 45 27.928 22.697 32.795 1.00 0.00 H new ATOM 0 HE2 LYS A 45 30.274 22.161 32.127 1.00 0.00 H new ATOM 0 HE3 LYS A 45 30.770 22.252 33.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 30.332 19.980 33.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 29.221 20.466 34.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 28.740 20.377 32.706 1.00 0.00 H new ATOM 535 N ALA A 46 31.916 26.707 32.111 1.00 0.00 N ATOM 536 CA ALA A 46 32.962 27.360 32.836 1.00 0.00 C ATOM 537 C ALA A 46 34.124 27.591 31.933 1.00 0.00 C ATOM 538 O ALA A 46 34.284 26.921 30.913 1.00 0.00 O ATOM 539 CB ALA A 46 33.402 26.528 34.052 1.00 0.00 C ATOM 0 H ALA A 46 32.245 26.049 31.405 1.00 0.00 H new ATOM 0 HA ALA A 46 32.583 28.314 33.201 1.00 0.00 H new ATOM 0 HB1 ALA A 46 34.198 27.051 34.582 1.00 0.00 H new ATOM 0 HB2 ALA A 46 32.554 26.385 34.721 1.00 0.00 H new ATOM 0 HB3 ALA A 46 33.767 25.557 33.716 1.00 0.00 H new ATOM 545 N ILE A 47 34.975 28.566 32.299 1.00 0.00 N ATOM 546 CA ILE A 47 36.170 28.890 31.584 1.00 0.00 C ATOM 547 C ILE A 47 37.291 28.799 32.560 1.00 0.00 C ATOM 548 O ILE A 47 37.250 29.363 33.653 1.00 0.00 O ATOM 549 CB ILE A 47 36.020 30.189 30.849 1.00 0.00 C ATOM 550 CG1 ILE A 47 36.626 30.098 29.438 1.00 0.00 C ATOM 551 CG2 ILE A 47 36.575 31.412 31.598 1.00 0.00 C ATOM 552 CD1 ILE A 47 35.796 29.283 28.447 1.00 0.00 C ATOM 0 H ILE A 47 34.826 29.150 33.122 1.00 0.00 H new ATOM 0 HA ILE A 47 36.392 28.190 30.778 1.00 0.00 H new ATOM 0 HB ILE A 47 34.945 30.352 30.774 1.00 0.00 H new ATOM 0 HG12 ILE A 47 36.753 31.106 29.044 1.00 0.00 H new ATOM 0 HG13 ILE A 47 37.620 29.657 29.510 1.00 0.00 H new ATOM 0 HG21 ILE A 47 36.425 32.307 30.995 1.00 0.00 H new ATOM 0 HG22 ILE A 47 36.054 31.524 32.549 1.00 0.00 H new ATOM 0 HG23 ILE A 47 37.640 31.273 31.782 1.00 0.00 H new ATOM 0 HD11 ILE A 47 36.295 29.270 27.478 1.00 0.00 H new ATOM 0 HD12 ILE A 47 35.690 28.262 28.814 1.00 0.00 H new ATOM 0 HD13 ILE A 47 34.810 29.734 28.341 1.00 0.00 H new ATOM 564 N ILE A 48 38.308 27.974 32.254 1.00 0.00 N ATOM 565 CA ILE A 48 39.372 27.597 33.132 1.00 0.00 C ATOM 566 C ILE A 48 40.404 28.662 33.280 1.00 0.00 C ATOM 567 O ILE A 48 40.969 29.024 32.250 1.00 0.00 O ATOM 568 CB ILE A 48 40.025 26.312 32.714 1.00 0.00 C ATOM 569 CG1 ILE A 48 38.979 25.241 32.358 1.00 0.00 C ATOM 570 CG2 ILE A 48 40.982 25.808 33.807 1.00 0.00 C ATOM 571 CD1 ILE A 48 38.059 24.802 33.496 1.00 0.00 C ATOM 0 H ILE A 48 38.392 27.543 31.333 1.00 0.00 H new ATOM 0 HA ILE A 48 38.902 27.447 34.104 1.00 0.00 H new ATOM 0 HB ILE A 48 40.609 26.511 31.815 1.00 0.00 H new ATOM 0 HG12 ILE A 48 38.362 25.620 31.544 1.00 0.00 H new ATOM 0 HG13 ILE A 48 39.501 24.362 31.980 1.00 0.00 H new ATOM 0 HG21 ILE A 48 41.445 24.876 33.484 1.00 0.00 H new ATOM 0 HG22 ILE A 48 41.756 26.554 33.985 1.00 0.00 H new ATOM 0 HG23 ILE A 48 40.425 25.636 34.728 1.00 0.00 H new ATOM 0 HD11 ILE A 48 37.364 24.046 33.131 1.00 0.00 H new ATOM 0 HD12 ILE A 48 38.656 24.385 34.306 1.00 0.00 H new ATOM 0 HD13 ILE A 48 37.499 25.662 33.864 1.00 0.00 H new ATOM 583 N PRO A 49 40.753 29.194 34.414 1.00 0.00 N ATOM 584 CA PRO A 49 41.672 30.291 34.508 1.00 0.00 C ATOM 585 C PRO A 49 43.022 30.058 33.922 1.00 0.00 C ATOM 586 O PRO A 49 43.657 29.045 34.209 1.00 0.00 O ATOM 587 CB PRO A 49 41.781 30.575 36.005 1.00 0.00 C ATOM 588 CG PRO A 49 40.382 30.213 36.531 1.00 0.00 C ATOM 589 CD PRO A 49 40.038 28.991 35.665 1.00 0.00 C ATOM 0 HA PRO A 49 41.291 31.124 33.918 1.00 0.00 H new ATOM 0 HB2 PRO A 49 42.557 29.971 36.475 1.00 0.00 H new ATOM 0 HB3 PRO A 49 42.028 31.619 36.200 1.00 0.00 H new ATOM 0 HG2 PRO A 49 40.393 29.973 37.594 1.00 0.00 H new ATOM 0 HG3 PRO A 49 39.669 31.026 36.395 1.00 0.00 H new ATOM 0 HD2 PRO A 49 40.348 28.065 36.150 1.00 0.00 H new ATOM 0 HD3 PRO A 49 38.964 28.918 35.497 1.00 0.00 H new ATOM 597 N LYS A 50 43.465 30.986 33.055 1.00 0.00 N ATOM 598 CA LYS A 50 44.722 31.005 32.374 1.00 0.00 C ATOM 599 C LYS A 50 44.798 30.049 31.234 1.00 0.00 C ATOM 600 O LYS A 50 45.879 29.772 30.717 1.00 0.00 O ATOM 601 CB LYS A 50 45.941 30.988 33.311 1.00 0.00 C ATOM 602 CG LYS A 50 45.978 32.227 34.209 1.00 0.00 C ATOM 603 CD LYS A 50 47.137 32.273 35.208 1.00 0.00 C ATOM 604 CE LYS A 50 46.918 31.401 36.445 1.00 0.00 C ATOM 605 NZ LYS A 50 48.016 31.595 37.420 1.00 0.00 N ATOM 0 H LYS A 50 42.891 31.793 32.811 1.00 0.00 H new ATOM 0 HA LYS A 50 44.774 31.986 31.902 1.00 0.00 H new ATOM 0 HB2 LYS A 50 45.913 30.091 33.929 1.00 0.00 H new ATOM 0 HB3 LYS A 50 46.855 30.939 32.719 1.00 0.00 H new ATOM 0 HG2 LYS A 50 46.029 33.113 33.576 1.00 0.00 H new ATOM 0 HG3 LYS A 50 45.040 32.284 34.762 1.00 0.00 H new ATOM 0 HD2 LYS A 50 48.050 31.953 34.706 1.00 0.00 H new ATOM 0 HD3 LYS A 50 47.291 33.305 35.524 1.00 0.00 H new ATOM 0 HE2 LYS A 50 45.964 31.651 36.909 1.00 0.00 H new ATOM 0 HE3 LYS A 50 46.865 30.352 36.153 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 47.850 30.995 38.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 48.921 31.334 36.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 48.048 32.592 37.713 1.00 0.00 H new ATOM 619 N GLY A 51 43.655 29.553 30.728 1.00 0.00 N ATOM 620 CA GLY A 51 43.633 28.790 29.519 1.00 0.00 C ATOM 621 C GLY A 51 43.613 29.667 28.314 1.00 0.00 C ATOM 622 O GLY A 51 43.237 30.836 28.380 1.00 0.00 O ATOM 0 H GLY A 51 42.740 29.682 31.160 1.00 0.00 H new ATOM 0 HA2 GLY A 51 44.508 28.141 29.482 1.00 0.00 H new ATOM 0 HA3 GLY A 51 42.756 28.143 29.513 1.00 0.00 H new ATOM 626 N ALA A 52 43.991 29.145 27.134 1.00 0.00 N ATOM 627 CA ALA A 52 43.820 29.763 25.856 1.00 0.00 C ATOM 628 C ALA A 52 42.460 30.302 25.572 1.00 0.00 C ATOM 629 O ALA A 52 42.292 31.489 25.300 1.00 0.00 O ATOM 630 CB ALA A 52 44.209 28.751 24.765 1.00 0.00 C ATOM 0 H ALA A 52 44.445 28.234 27.069 1.00 0.00 H new ATOM 0 HA ALA A 52 44.469 30.639 25.863 1.00 0.00 H new ATOM 0 HB1 ALA A 52 44.084 29.208 23.783 1.00 0.00 H new ATOM 0 HB2 ALA A 52 45.250 28.455 24.897 1.00 0.00 H new ATOM 0 HB3 ALA A 52 43.570 27.871 24.840 1.00 0.00 H new ATOM 636 N ALA A 53 41.427 29.444 25.661 1.00 0.00 N ATOM 637 CA ALA A 53 40.053 29.733 25.387 1.00 0.00 C ATOM 638 C ALA A 53 39.494 30.759 26.310 1.00 0.00 C ATOM 639 O ALA A 53 38.835 31.712 25.898 1.00 0.00 O ATOM 640 CB ALA A 53 39.220 28.446 25.508 1.00 0.00 C ATOM 0 H ALA A 53 41.565 28.475 25.946 1.00 0.00 H new ATOM 0 HA ALA A 53 40.004 30.131 24.374 1.00 0.00 H new ATOM 0 HB1 ALA A 53 38.174 28.669 25.299 1.00 0.00 H new ATOM 0 HB2 ALA A 53 39.584 27.708 24.793 1.00 0.00 H new ATOM 0 HB3 ALA A 53 39.311 28.047 26.518 1.00 0.00 H new ATOM 646 N GLU A 54 39.811 30.592 27.608 1.00 0.00 N ATOM 647 CA GLU A 54 39.601 31.567 28.632 1.00 0.00 C ATOM 648 C GLU A 54 40.131 32.928 28.334 1.00 0.00 C ATOM 649 O GLU A 54 39.407 33.914 28.210 1.00 0.00 O ATOM 650 CB GLU A 54 40.245 31.063 29.934 1.00 0.00 C ATOM 651 CG GLU A 54 39.917 31.896 31.175 1.00 0.00 C ATOM 652 CD GLU A 54 40.837 33.046 31.559 1.00 0.00 C ATOM 653 OE1 GLU A 54 42.081 32.860 31.646 1.00 0.00 O ATOM 654 OE2 GLU A 54 40.285 34.139 31.857 1.00 0.00 O ATOM 0 H GLU A 54 40.235 29.733 27.959 1.00 0.00 H new ATOM 0 HA GLU A 54 38.520 31.681 28.713 1.00 0.00 H new ATOM 0 HB2 GLU A 54 39.924 30.036 30.108 1.00 0.00 H new ATOM 0 HB3 GLU A 54 41.327 31.041 29.803 1.00 0.00 H new ATOM 0 HG2 GLU A 54 38.916 32.307 31.040 1.00 0.00 H new ATOM 0 HG3 GLU A 54 39.870 31.215 32.025 1.00 0.00 H new ATOM 661 N SER A 55 41.470 32.996 28.230 1.00 0.00 N ATOM 662 CA SER A 55 42.227 34.208 28.168 1.00 0.00 C ATOM 663 C SER A 55 41.996 35.034 26.951 1.00 0.00 C ATOM 664 O SER A 55 42.162 36.253 26.982 1.00 0.00 O ATOM 665 CB SER A 55 43.733 33.914 28.279 1.00 0.00 C ATOM 666 OG SER A 55 44.227 33.134 27.200 1.00 0.00 O ATOM 0 H SER A 55 42.055 32.162 28.187 1.00 0.00 H new ATOM 0 HA SER A 55 41.871 34.793 29.016 1.00 0.00 H new ATOM 0 HB2 SER A 55 44.280 34.856 28.319 1.00 0.00 H new ATOM 0 HB3 SER A 55 43.928 33.392 29.216 1.00 0.00 H new ATOM 0 HG SER A 55 44.009 32.191 27.352 1.00 0.00 H new ATOM 672 N ASP A 56 41.600 34.414 25.826 1.00 0.00 N ATOM 673 CA ASP A 56 41.266 35.050 24.589 1.00 0.00 C ATOM 674 C ASP A 56 40.205 36.087 24.729 1.00 0.00 C ATOM 675 O ASP A 56 40.414 37.261 24.429 1.00 0.00 O ATOM 676 CB ASP A 56 40.875 33.983 23.552 1.00 0.00 C ATOM 677 CG ASP A 56 40.980 34.563 22.149 1.00 0.00 C ATOM 678 OD1 ASP A 56 42.130 34.711 21.655 1.00 0.00 O ATOM 679 OD2 ASP A 56 39.934 34.937 21.556 1.00 0.00 O ATOM 0 H ASP A 56 41.507 33.399 25.778 1.00 0.00 H new ATOM 0 HA ASP A 56 42.151 35.585 24.245 1.00 0.00 H new ATOM 0 HB2 ASP A 56 41.528 33.115 23.646 1.00 0.00 H new ATOM 0 HB3 ASP A 56 39.858 33.638 23.737 1.00 0.00 H new ATOM 684 N GLY A 57 39.021 35.707 25.242 1.00 0.00 N ATOM 685 CA GLY A 57 38.106 36.650 25.806 1.00 0.00 C ATOM 686 C GLY A 57 36.841 36.825 25.037 1.00 0.00 C ATOM 687 O GLY A 57 35.884 37.423 25.526 1.00 0.00 O ATOM 0 H GLY A 57 38.696 34.740 25.266 1.00 0.00 H new ATOM 0 HA2 GLY A 57 37.859 36.335 26.820 1.00 0.00 H new ATOM 0 HA3 GLY A 57 38.604 37.616 25.885 1.00 0.00 H new ATOM 691 N ARG A 58 36.782 36.255 23.821 1.00 0.00 N ATOM 692 CA ARG A 58 35.588 36.101 23.050 1.00 0.00 C ATOM 693 C ARG A 58 34.620 35.189 23.721 1.00 0.00 C ATOM 694 O ARG A 58 33.405 35.359 23.626 1.00 0.00 O ATOM 695 CB ARG A 58 35.918 35.551 21.651 1.00 0.00 C ATOM 696 CG ARG A 58 36.771 36.480 20.786 1.00 0.00 C ATOM 697 CD ARG A 58 37.163 35.824 19.460 1.00 0.00 C ATOM 698 NE ARG A 58 38.181 36.645 18.746 1.00 0.00 N ATOM 699 CZ ARG A 58 39.363 36.113 18.315 1.00 0.00 C ATOM 700 NH1 ARG A 58 39.900 34.998 18.891 1.00 0.00 N ATOM 701 NH2 ARG A 58 40.081 36.714 17.322 1.00 0.00 N ATOM 0 H ARG A 58 37.608 35.883 23.352 1.00 0.00 H new ATOM 0 HA ARG A 58 35.131 37.086 22.958 1.00 0.00 H new ATOM 0 HB2 ARG A 58 36.439 34.600 21.763 1.00 0.00 H new ATOM 0 HB3 ARG A 58 34.985 35.344 21.127 1.00 0.00 H new ATOM 0 HG2 ARG A 58 36.220 37.399 20.587 1.00 0.00 H new ATOM 0 HG3 ARG A 58 37.671 36.760 21.333 1.00 0.00 H new ATOM 0 HD2 ARG A 58 37.559 34.826 19.646 1.00 0.00 H new ATOM 0 HD3 ARG A 58 36.280 35.705 18.833 1.00 0.00 H new ATOM 0 HE ARG A 58 37.990 37.632 18.574 1.00 0.00 H new ATOM 0 HH11 ARG A 58 39.417 34.540 19.664 1.00 0.00 H new ATOM 0 HH12 ARG A 58 40.784 34.623 18.548 1.00 0.00 H new ATOM 0 HH21 ARG A 58 39.737 37.572 16.891 1.00 0.00 H new ATOM 0 HH22 ARG A 58 40.962 36.305 17.011 1.00 0.00 H new ATOM 715 N ILE A 59 35.142 34.190 24.455 1.00 0.00 N ATOM 716 CA ILE A 59 34.401 33.169 25.132 1.00 0.00 C ATOM 717 C ILE A 59 34.206 33.521 26.566 1.00 0.00 C ATOM 718 O ILE A 59 35.151 33.792 27.305 1.00 0.00 O ATOM 719 CB ILE A 59 35.098 31.844 25.038 1.00 0.00 C ATOM 720 CG1 ILE A 59 35.548 31.544 23.598 1.00 0.00 C ATOM 721 CG2 ILE A 59 34.147 30.744 25.539 1.00 0.00 C ATOM 722 CD1 ILE A 59 36.367 30.261 23.451 1.00 0.00 C ATOM 0 H ILE A 59 36.149 34.089 24.584 1.00 0.00 H new ATOM 0 HA ILE A 59 33.429 33.093 24.644 1.00 0.00 H new ATOM 0 HB ILE A 59 35.994 31.875 25.659 1.00 0.00 H new ATOM 0 HG12 ILE A 59 34.666 31.474 22.961 1.00 0.00 H new ATOM 0 HG13 ILE A 59 36.140 32.383 23.232 1.00 0.00 H new ATOM 0 HG21 ILE A 59 34.644 29.776 25.475 1.00 0.00 H new ATOM 0 HG22 ILE A 59 33.874 30.944 26.575 1.00 0.00 H new ATOM 0 HG23 ILE A 59 33.248 30.732 24.923 1.00 0.00 H new ATOM 0 HD11 ILE A 59 36.644 30.124 22.406 1.00 0.00 H new ATOM 0 HD12 ILE A 59 37.269 30.333 24.059 1.00 0.00 H new ATOM 0 HD13 ILE A 59 35.773 29.410 23.784 1.00 0.00 H new ATOM 734 N HIS A 60 32.943 33.544 27.028 1.00 0.00 N ATOM 735 CA HIS A 60 32.566 33.661 28.402 1.00 0.00 C ATOM 736 C HIS A 60 31.602 32.578 28.747 1.00 0.00 C ATOM 737 O HIS A 60 31.037 31.902 27.888 1.00 0.00 O ATOM 738 CB HIS A 60 31.906 35.016 28.704 1.00 0.00 C ATOM 739 CG HIS A 60 32.887 36.118 28.981 1.00 0.00 C ATOM 740 ND1 HIS A 60 33.909 36.512 28.141 1.00 0.00 N ATOM 741 CD2 HIS A 60 33.022 36.872 30.105 1.00 0.00 C ATOM 742 CE1 HIS A 60 34.604 37.479 28.797 1.00 0.00 C ATOM 743 NE2 HIS A 60 34.097 37.730 29.990 1.00 0.00 N ATOM 0 H HIS A 60 32.138 33.477 26.405 1.00 0.00 H new ATOM 0 HA HIS A 60 33.475 33.579 28.998 1.00 0.00 H new ATOM 0 HB2 HIS A 60 31.281 35.302 27.858 1.00 0.00 H new ATOM 0 HB3 HIS A 60 31.246 34.905 29.564 1.00 0.00 H new ATOM 0 HD2 HIS A 60 32.377 36.808 30.969 1.00 0.00 H new ATOM 0 HE1 HIS A 60 35.469 37.982 28.390 1.00 0.00 H new ATOM 0 HE2 HIS A 60 34.427 38.409 30.676 1.00 0.00 H new ATOM 751 N LYS A 61 31.347 32.364 30.050 1.00 0.00 N ATOM 752 CA LYS A 61 30.356 31.432 30.493 1.00 0.00 C ATOM 753 C LYS A 61 28.979 31.889 30.151 1.00 0.00 C ATOM 754 O LYS A 61 28.622 33.056 30.302 1.00 0.00 O ATOM 755 CB LYS A 61 30.525 31.072 31.979 1.00 0.00 C ATOM 756 CG LYS A 61 29.894 32.047 32.976 1.00 0.00 C ATOM 757 CD LYS A 61 30.466 31.960 34.393 1.00 0.00 C ATOM 758 CE LYS A 61 31.825 32.651 34.520 1.00 0.00 C ATOM 759 NZ LYS A 61 32.265 32.724 35.931 1.00 0.00 N ATOM 0 H LYS A 61 31.835 32.844 30.807 1.00 0.00 H new ATOM 0 HA LYS A 61 30.512 30.503 29.945 1.00 0.00 H new ATOM 0 HB2 LYS A 61 30.096 30.084 32.145 1.00 0.00 H new ATOM 0 HB3 LYS A 61 31.590 30.998 32.197 1.00 0.00 H new ATOM 0 HG2 LYS A 61 30.027 33.063 32.605 1.00 0.00 H new ATOM 0 HG3 LYS A 61 28.821 31.861 33.018 1.00 0.00 H new ATOM 0 HD2 LYS A 61 29.764 32.414 35.093 1.00 0.00 H new ATOM 0 HD3 LYS A 61 30.567 30.912 34.677 1.00 0.00 H new ATOM 0 HE2 LYS A 61 32.567 32.108 33.934 1.00 0.00 H new ATOM 0 HE3 LYS A 61 31.764 33.657 34.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 33.189 33.198 35.982 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 31.569 33.263 36.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 32.347 31.763 36.319 1.00 0.00 H new ATOM 773 N GLY A 62 28.161 30.981 29.590 1.00 0.00 N ATOM 774 CA GLY A 62 26.881 31.304 29.039 1.00 0.00 C ATOM 775 C GLY A 62 26.866 31.455 27.557 1.00 0.00 C ATOM 776 O GLY A 62 25.791 31.579 26.973 1.00 0.00 O ATOM 0 H GLY A 62 28.397 29.991 29.517 1.00 0.00 H new ATOM 0 HA2 GLY A 62 26.172 30.525 29.319 1.00 0.00 H new ATOM 0 HA3 GLY A 62 26.529 32.232 29.490 1.00 0.00 H new ATOM 780 N ASP A 63 28.026 31.445 26.877 1.00 0.00 N ATOM 781 CA ASP A 63 28.078 31.627 25.459 1.00 0.00 C ATOM 782 C ASP A 63 27.720 30.388 24.714 1.00 0.00 C ATOM 783 O ASP A 63 27.826 29.275 25.227 1.00 0.00 O ATOM 784 CB ASP A 63 29.454 32.139 24.999 1.00 0.00 C ATOM 785 CG ASP A 63 29.695 33.574 25.445 1.00 0.00 C ATOM 786 OD1 ASP A 63 28.718 34.293 25.788 1.00 0.00 O ATOM 787 OD2 ASP A 63 30.872 34.019 25.372 1.00 0.00 O ATOM 0 H ASP A 63 28.937 31.309 27.315 1.00 0.00 H new ATOM 0 HA ASP A 63 27.330 32.385 25.227 1.00 0.00 H new ATOM 0 HB2 ASP A 63 30.236 31.496 25.403 1.00 0.00 H new ATOM 0 HB3 ASP A 63 29.521 32.079 23.913 1.00 0.00 H new ATOM 792 N ARG A 64 27.260 30.525 23.457 1.00 0.00 N ATOM 793 CA ARG A 64 26.666 29.462 22.708 1.00 0.00 C ATOM 794 C ARG A 64 27.512 29.107 21.535 1.00 0.00 C ATOM 795 O ARG A 64 27.870 29.955 20.720 1.00 0.00 O ATOM 796 CB ARG A 64 25.257 29.910 22.283 1.00 0.00 C ATOM 797 CG ARG A 64 24.432 28.902 21.480 1.00 0.00 C ATOM 798 CD ARG A 64 22.953 29.293 21.433 1.00 0.00 C ATOM 799 NE ARG A 64 22.281 28.482 20.380 1.00 0.00 N ATOM 800 CZ ARG A 64 22.138 28.893 19.086 1.00 0.00 C ATOM 801 NH1 ARG A 64 22.550 30.124 18.666 1.00 0.00 N ATOM 802 NH2 ARG A 64 21.568 28.041 18.184 1.00 0.00 N ATOM 0 H ARG A 64 27.303 31.406 22.945 1.00 0.00 H new ATOM 0 HA ARG A 64 26.590 28.562 23.318 1.00 0.00 H new ATOM 0 HB2 ARG A 64 24.697 30.171 23.181 1.00 0.00 H new ATOM 0 HB3 ARG A 64 25.353 30.820 21.691 1.00 0.00 H new ATOM 0 HG2 ARG A 64 24.824 28.837 20.465 1.00 0.00 H new ATOM 0 HG3 ARG A 64 24.533 27.912 21.925 1.00 0.00 H new ATOM 0 HD2 ARG A 64 22.484 29.119 22.402 1.00 0.00 H new ATOM 0 HD3 ARG A 64 22.849 30.356 21.216 1.00 0.00 H new ATOM 0 HE ARG A 64 21.907 27.569 20.640 1.00 0.00 H new ATOM 0 HH11 ARG A 64 22.981 30.771 19.327 1.00 0.00 H new ATOM 0 HH12 ARG A 64 22.427 30.398 17.691 1.00 0.00 H new ATOM 0 HH21 ARG A 64 21.258 27.116 18.482 1.00 0.00 H new ATOM 0 HH22 ARG A 64 21.452 28.330 17.213 1.00 0.00 H new ATOM 816 N VAL A 65 27.915 27.830 21.407 1.00 0.00 N ATOM 817 CA VAL A 65 28.814 27.386 20.388 1.00 0.00 C ATOM 818 C VAL A 65 28.056 27.022 19.157 1.00 0.00 C ATOM 819 O VAL A 65 27.061 26.302 19.218 1.00 0.00 O ATOM 820 CB VAL A 65 29.628 26.200 20.815 1.00 0.00 C ATOM 821 CG1 VAL A 65 30.776 25.960 19.819 1.00 0.00 C ATOM 822 CG2 VAL A 65 30.204 26.430 22.223 1.00 0.00 C ATOM 0 H VAL A 65 27.606 27.085 22.031 1.00 0.00 H new ATOM 0 HA VAL A 65 29.495 28.214 20.192 1.00 0.00 H new ATOM 0 HB VAL A 65 28.981 25.323 20.834 1.00 0.00 H new ATOM 0 HG11 VAL A 65 31.360 25.097 20.138 1.00 0.00 H new ATOM 0 HG12 VAL A 65 30.364 25.772 18.827 1.00 0.00 H new ATOM 0 HG13 VAL A 65 31.418 26.840 19.785 1.00 0.00 H new ATOM 0 HG21 VAL A 65 30.793 25.562 22.522 1.00 0.00 H new ATOM 0 HG22 VAL A 65 30.840 27.315 22.216 1.00 0.00 H new ATOM 0 HG23 VAL A 65 29.388 26.576 22.931 1.00 0.00 H new ATOM 832 N LEU A 66 28.477 27.512 17.978 1.00 0.00 N ATOM 833 CA LEU A 66 27.790 27.284 16.744 1.00 0.00 C ATOM 834 C LEU A 66 28.479 26.223 15.957 1.00 0.00 C ATOM 835 O LEU A 66 27.832 25.324 15.425 1.00 0.00 O ATOM 836 CB LEU A 66 27.671 28.583 15.931 1.00 0.00 C ATOM 837 CG LEU A 66 26.387 29.391 16.188 1.00 0.00 C ATOM 838 CD1 LEU A 66 26.046 29.586 17.674 1.00 0.00 C ATOM 839 CD2 LEU A 66 26.487 30.761 15.496 1.00 0.00 C ATOM 0 H LEU A 66 29.317 28.082 17.879 1.00 0.00 H new ATOM 0 HA LEU A 66 26.780 26.943 16.971 1.00 0.00 H new ATOM 0 HB2 LEU A 66 28.531 29.214 16.154 1.00 0.00 H new ATOM 0 HB3 LEU A 66 27.722 28.337 14.870 1.00 0.00 H new ATOM 0 HG LEU A 66 25.573 28.800 15.768 1.00 0.00 H new ATOM 0 HD11 LEU A 66 25.127 30.166 17.763 1.00 0.00 H new ATOM 0 HD12 LEU A 66 25.909 28.613 18.147 1.00 0.00 H new ATOM 0 HD13 LEU A 66 26.860 30.118 18.167 1.00 0.00 H new ATOM 0 HD21 LEU A 66 25.575 31.329 15.681 1.00 0.00 H new ATOM 0 HD22 LEU A 66 27.342 31.308 15.893 1.00 0.00 H new ATOM 0 HD23 LEU A 66 26.614 30.618 14.423 1.00 0.00 H new ATOM 851 N ALA A 67 29.820 26.277 15.863 1.00 0.00 N ATOM 852 CA ALA A 67 30.585 25.344 15.096 1.00 0.00 C ATOM 853 C ALA A 67 31.933 25.142 15.699 1.00 0.00 C ATOM 854 O ALA A 67 32.537 26.068 16.236 1.00 0.00 O ATOM 855 CB ALA A 67 30.754 25.824 13.644 1.00 0.00 C ATOM 0 H ALA A 67 30.385 26.985 16.331 1.00 0.00 H new ATOM 0 HA ALA A 67 30.040 24.400 15.099 1.00 0.00 H new ATOM 0 HB1 ALA A 67 31.340 25.094 13.085 1.00 0.00 H new ATOM 0 HB2 ALA A 67 29.774 25.934 13.181 1.00 0.00 H new ATOM 0 HB3 ALA A 67 31.269 26.785 13.636 1.00 0.00 H new ATOM 861 N VAL A 68 32.450 23.901 15.647 1.00 0.00 N ATOM 862 CA VAL A 68 33.782 23.594 16.068 1.00 0.00 C ATOM 863 C VAL A 68 34.467 22.924 14.928 1.00 0.00 C ATOM 864 O VAL A 68 33.995 21.912 14.409 1.00 0.00 O ATOM 865 CB VAL A 68 33.861 22.687 17.261 1.00 0.00 C ATOM 866 CG1 VAL A 68 35.315 22.505 17.724 1.00 0.00 C ATOM 867 CG2 VAL A 68 33.025 23.229 18.432 1.00 0.00 C ATOM 0 H VAL A 68 31.931 23.093 15.305 1.00 0.00 H new ATOM 0 HA VAL A 68 34.250 24.533 16.364 1.00 0.00 H new ATOM 0 HB VAL A 68 33.458 21.722 16.953 1.00 0.00 H new ATOM 0 HG11 VAL A 68 35.341 21.843 18.590 1.00 0.00 H new ATOM 0 HG12 VAL A 68 35.902 22.069 16.916 1.00 0.00 H new ATOM 0 HG13 VAL A 68 35.734 23.474 17.995 1.00 0.00 H new ATOM 0 HG21 VAL A 68 33.103 22.549 19.280 1.00 0.00 H new ATOM 0 HG22 VAL A 68 33.396 24.213 18.720 1.00 0.00 H new ATOM 0 HG23 VAL A 68 31.982 23.310 18.127 1.00 0.00 H new ATOM 877 N ASN A 69 35.616 23.459 14.480 1.00 0.00 N ATOM 878 CA ASN A 69 36.506 22.864 13.532 1.00 0.00 C ATOM 879 C ASN A 69 35.917 22.675 12.175 1.00 0.00 C ATOM 880 O ASN A 69 36.220 21.725 11.457 1.00 0.00 O ATOM 881 CB ASN A 69 37.122 21.588 14.127 1.00 0.00 C ATOM 882 CG ASN A 69 38.497 21.256 13.564 1.00 0.00 C ATOM 883 OD1 ASN A 69 39.103 21.996 12.792 1.00 0.00 O ATOM 884 ND2 ASN A 69 39.046 20.089 13.995 1.00 0.00 N ATOM 0 H ASN A 69 35.945 24.369 14.802 1.00 0.00 H new ATOM 0 HA ASN A 69 37.314 23.573 13.348 1.00 0.00 H new ATOM 0 HB2 ASN A 69 37.199 21.702 15.208 1.00 0.00 H new ATOM 0 HB3 ASN A 69 36.450 20.750 13.942 1.00 0.00 H new ATOM 0 HD21 ASN A 69 39.976 19.815 13.678 1.00 0.00 H new ATOM 0 HD22 ASN A 69 38.528 19.488 14.636 1.00 0.00 H new ATOM 891 N GLY A 70 35.034 23.599 11.755 1.00 0.00 N ATOM 892 CA GLY A 70 34.367 23.574 10.490 1.00 0.00 C ATOM 893 C GLY A 70 33.018 22.945 10.537 1.00 0.00 C ATOM 894 O GLY A 70 32.221 23.109 9.615 1.00 0.00 O ATOM 0 H GLY A 70 34.773 24.403 12.326 1.00 0.00 H new ATOM 0 HA2 GLY A 70 34.270 24.595 10.120 1.00 0.00 H new ATOM 0 HA3 GLY A 70 34.986 23.033 9.774 1.00 0.00 H new ATOM 898 N VAL A 71 32.706 22.201 11.613 1.00 0.00 N ATOM 899 CA VAL A 71 31.508 21.429 11.734 1.00 0.00 C ATOM 900 C VAL A 71 30.501 22.166 12.548 1.00 0.00 C ATOM 901 O VAL A 71 30.697 22.422 13.735 1.00 0.00 O ATOM 902 CB VAL A 71 31.759 20.070 12.318 1.00 0.00 C ATOM 903 CG1 VAL A 71 30.468 19.238 12.374 1.00 0.00 C ATOM 904 CG2 VAL A 71 32.817 19.334 11.479 1.00 0.00 C ATOM 0 H VAL A 71 33.312 22.134 12.431 1.00 0.00 H new ATOM 0 HA VAL A 71 31.119 21.277 10.727 1.00 0.00 H new ATOM 0 HB VAL A 71 32.121 20.200 13.338 1.00 0.00 H new ATOM 0 HG11 VAL A 71 30.684 18.259 12.802 1.00 0.00 H new ATOM 0 HG12 VAL A 71 29.732 19.750 12.993 1.00 0.00 H new ATOM 0 HG13 VAL A 71 30.071 19.114 11.366 1.00 0.00 H new ATOM 0 HG21 VAL A 71 32.997 18.347 11.905 1.00 0.00 H new ATOM 0 HG22 VAL A 71 32.459 19.227 10.455 1.00 0.00 H new ATOM 0 HG23 VAL A 71 33.745 19.905 11.481 1.00 0.00 H new ATOM 914 N SER A 72 29.357 22.535 11.944 1.00 0.00 N ATOM 915 CA SER A 72 28.284 23.183 12.632 1.00 0.00 C ATOM 916 C SER A 72 27.552 22.218 13.501 1.00 0.00 C ATOM 917 O SER A 72 27.193 21.122 13.072 1.00 0.00 O ATOM 918 CB SER A 72 27.245 23.857 11.721 1.00 0.00 C ATOM 919 OG SER A 72 27.869 24.743 10.805 1.00 0.00 O ATOM 0 H SER A 72 29.174 22.379 10.953 1.00 0.00 H new ATOM 0 HA SER A 72 28.776 23.965 13.211 1.00 0.00 H new ATOM 0 HB2 SER A 72 26.688 23.096 11.174 1.00 0.00 H new ATOM 0 HB3 SER A 72 26.525 24.405 12.328 1.00 0.00 H new ATOM 0 HG SER A 72 27.188 25.158 10.236 1.00 0.00 H new ATOM 925 N LEU A 73 27.319 22.569 14.778 1.00 0.00 N ATOM 926 CA LEU A 73 26.900 21.642 15.782 1.00 0.00 C ATOM 927 C LEU A 73 25.427 21.423 15.830 1.00 0.00 C ATOM 928 O LEU A 73 24.828 21.394 16.904 1.00 0.00 O ATOM 929 CB LEU A 73 27.352 22.114 17.175 1.00 0.00 C ATOM 930 CG LEU A 73 28.866 22.287 17.382 1.00 0.00 C ATOM 931 CD1 LEU A 73 29.106 22.798 18.813 1.00 0.00 C ATOM 932 CD2 LEU A 73 29.666 20.996 17.141 1.00 0.00 C ATOM 0 H LEU A 73 27.425 23.524 15.122 1.00 0.00 H new ATOM 0 HA LEU A 73 27.369 20.697 15.507 1.00 0.00 H new ATOM 0 HB2 LEU A 73 26.867 23.067 17.386 1.00 0.00 H new ATOM 0 HB3 LEU A 73 26.986 21.400 17.913 1.00 0.00 H new ATOM 0 HG LEU A 73 29.223 23.004 16.643 1.00 0.00 H new ATOM 0 HD11 LEU A 73 30.176 22.927 18.979 1.00 0.00 H new ATOM 0 HD12 LEU A 73 28.600 23.754 18.948 1.00 0.00 H new ATOM 0 HD13 LEU A 73 28.713 22.076 19.528 1.00 0.00 H new ATOM 0 HD21 LEU A 73 30.726 21.189 17.304 1.00 0.00 H new ATOM 0 HD22 LEU A 73 29.327 20.224 17.832 1.00 0.00 H new ATOM 0 HD23 LEU A 73 29.512 20.659 16.116 1.00 0.00 H new ATOM 944 N GLU A 74 24.732 21.253 14.691 1.00 0.00 N ATOM 945 CA GLU A 74 23.312 21.088 14.668 1.00 0.00 C ATOM 946 C GLU A 74 22.906 19.689 14.985 1.00 0.00 C ATOM 947 O GLU A 74 23.472 18.717 14.487 1.00 0.00 O ATOM 948 CB GLU A 74 22.676 21.535 13.342 1.00 0.00 C ATOM 949 CG GLU A 74 22.717 23.052 13.139 1.00 0.00 C ATOM 950 CD GLU A 74 21.925 23.494 11.917 1.00 0.00 C ATOM 951 OE1 GLU A 74 20.714 23.161 11.822 1.00 0.00 O ATOM 952 OE2 GLU A 74 22.503 24.179 11.030 1.00 0.00 O ATOM 0 H GLU A 74 25.165 21.230 13.768 1.00 0.00 H new ATOM 0 HA GLU A 74 22.933 21.745 15.451 1.00 0.00 H new ATOM 0 HB2 GLU A 74 23.194 21.049 12.515 1.00 0.00 H new ATOM 0 HB3 GLU A 74 21.640 21.198 13.311 1.00 0.00 H new ATOM 0 HG2 GLU A 74 22.318 23.546 14.025 1.00 0.00 H new ATOM 0 HG3 GLU A 74 23.753 23.374 13.034 1.00 0.00 H new ATOM 959 N GLY A 75 21.917 19.518 15.880 1.00 0.00 N ATOM 960 CA GLY A 75 21.480 18.250 16.376 1.00 0.00 C ATOM 961 C GLY A 75 22.453 17.559 17.268 1.00 0.00 C ATOM 962 O GLY A 75 22.331 16.364 17.531 1.00 0.00 O ATOM 0 H GLY A 75 21.397 20.301 16.277 1.00 0.00 H new ATOM 0 HA2 GLY A 75 20.546 18.391 16.920 1.00 0.00 H new ATOM 0 HA3 GLY A 75 21.260 17.600 15.529 1.00 0.00 H new ATOM 966 N ALA A 76 23.493 18.273 17.735 1.00 0.00 N ATOM 967 CA ALA A 76 24.528 17.755 18.574 1.00 0.00 C ATOM 968 C ALA A 76 24.113 17.477 19.978 1.00 0.00 C ATOM 969 O ALA A 76 23.343 18.215 20.592 1.00 0.00 O ATOM 970 CB ALA A 76 25.744 18.697 18.578 1.00 0.00 C ATOM 0 H ALA A 76 23.618 19.261 17.516 1.00 0.00 H new ATOM 0 HA ALA A 76 24.787 16.791 18.136 1.00 0.00 H new ATOM 0 HB1 ALA A 76 26.521 18.285 19.222 1.00 0.00 H new ATOM 0 HB2 ALA A 76 26.130 18.798 17.563 1.00 0.00 H new ATOM 0 HB3 ALA A 76 25.444 19.676 18.951 1.00 0.00 H new ATOM 976 N THR A 77 24.652 16.385 20.546 1.00 0.00 N ATOM 977 CA THR A 77 24.544 16.013 21.923 1.00 0.00 C ATOM 978 C THR A 77 25.676 16.592 22.699 1.00 0.00 C ATOM 979 O THR A 77 26.575 17.226 22.150 1.00 0.00 O ATOM 980 CB THR A 77 24.551 14.523 22.097 1.00 0.00 C ATOM 981 OG1 THR A 77 25.670 13.940 21.445 1.00 0.00 O ATOM 982 CG2 THR A 77 23.289 13.927 21.452 1.00 0.00 C ATOM 0 H THR A 77 25.201 15.716 20.006 1.00 0.00 H new ATOM 0 HA THR A 77 23.595 16.402 22.291 1.00 0.00 H new ATOM 0 HB THR A 77 24.591 14.313 23.166 1.00 0.00 H new ATOM 0 HG1 THR A 77 25.654 12.969 21.574 1.00 0.00 H new ATOM 0 HG21 THR A 77 23.293 12.844 21.578 1.00 0.00 H new ATOM 0 HG22 THR A 77 22.404 14.345 21.931 1.00 0.00 H new ATOM 0 HG23 THR A 77 23.275 14.169 20.389 1.00 0.00 H new ATOM 990 N HIS A 78 25.702 16.366 24.025 1.00 0.00 N ATOM 991 CA HIS A 78 26.769 16.764 24.890 1.00 0.00 C ATOM 992 C HIS A 78 28.075 16.149 24.523 1.00 0.00 C ATOM 993 O HIS A 78 29.088 16.833 24.384 1.00 0.00 O ATOM 994 CB HIS A 78 26.430 16.425 26.351 1.00 0.00 C ATOM 995 CG HIS A 78 27.386 16.991 27.359 1.00 0.00 C ATOM 996 ND1 HIS A 78 28.565 16.399 27.764 1.00 0.00 N ATOM 997 CD2 HIS A 78 27.293 18.150 28.066 1.00 0.00 C ATOM 998 CE1 HIS A 78 29.127 17.223 28.688 1.00 0.00 C ATOM 999 NE2 HIS A 78 28.385 18.295 28.897 1.00 0.00 N ATOM 0 H HIS A 78 24.947 15.885 24.515 1.00 0.00 H new ATOM 0 HA HIS A 78 26.875 17.842 24.773 1.00 0.00 H new ATOM 0 HB2 HIS A 78 25.428 16.793 26.573 1.00 0.00 H new ATOM 0 HB3 HIS A 78 26.404 15.341 26.463 1.00 0.00 H new ATOM 0 HD1 HIS A 78 28.943 15.511 27.433 1.00 0.00 H new ATOM 0 HD2 HIS A 78 26.480 18.856 27.988 1.00 0.00 H new ATOM 0 HE1 HIS A 78 30.063 17.025 29.189 1.00 0.00 H new ATOM 1007 N LYS A 79 28.082 14.820 24.317 1.00 0.00 N ATOM 1008 CA LYS A 79 29.194 14.036 23.875 1.00 0.00 C ATOM 1009 C LYS A 79 29.833 14.486 22.606 1.00 0.00 C ATOM 1010 O LYS A 79 31.058 14.492 22.485 1.00 0.00 O ATOM 1011 CB LYS A 79 28.764 12.568 23.720 1.00 0.00 C ATOM 1012 CG LYS A 79 29.267 11.669 24.852 1.00 0.00 C ATOM 1013 CD LYS A 79 30.754 11.341 24.703 1.00 0.00 C ATOM 1014 CE LYS A 79 31.242 10.328 25.741 1.00 0.00 C ATOM 1015 NZ LYS A 79 32.630 9.906 25.450 1.00 0.00 N ATOM 0 H LYS A 79 27.249 14.253 24.471 1.00 0.00 H new ATOM 0 HA LYS A 79 29.950 14.162 24.650 1.00 0.00 H new ATOM 0 HB2 LYS A 79 27.676 12.517 23.681 1.00 0.00 H new ATOM 0 HB3 LYS A 79 29.135 12.186 22.769 1.00 0.00 H new ATOM 0 HG2 LYS A 79 29.098 12.162 25.809 1.00 0.00 H new ATOM 0 HG3 LYS A 79 28.691 10.744 24.864 1.00 0.00 H new ATOM 0 HD2 LYS A 79 30.937 10.947 23.703 1.00 0.00 H new ATOM 0 HD3 LYS A 79 31.335 12.258 24.795 1.00 0.00 H new ATOM 0 HE2 LYS A 79 31.192 10.768 26.737 1.00 0.00 H new ATOM 0 HE3 LYS A 79 30.585 9.458 25.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 32.941 9.219 26.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 32.669 9.466 24.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 33.257 10.736 25.471 1.00 0.00 H new ATOM 1029 N GLN A 80 29.026 14.939 21.631 1.00 0.00 N ATOM 1030 CA GLN A 80 29.433 15.372 20.330 1.00 0.00 C ATOM 1031 C GLN A 80 30.414 16.492 20.365 1.00 0.00 C ATOM 1032 O GLN A 80 31.502 16.430 19.794 1.00 0.00 O ATOM 1033 CB GLN A 80 28.181 15.781 19.537 1.00 0.00 C ATOM 1034 CG GLN A 80 28.054 15.238 18.113 1.00 0.00 C ATOM 1035 CD GLN A 80 29.089 15.789 17.144 1.00 0.00 C ATOM 1036 OE1 GLN A 80 30.240 15.355 17.104 1.00 0.00 O ATOM 1037 NE2 GLN A 80 28.668 16.762 16.292 1.00 0.00 N ATOM 0 H GLN A 80 28.017 15.007 21.762 1.00 0.00 H new ATOM 0 HA GLN A 80 29.945 14.541 19.845 1.00 0.00 H new ATOM 0 HB2 GLN A 80 27.304 15.463 20.101 1.00 0.00 H new ATOM 0 HB3 GLN A 80 28.151 16.870 19.489 1.00 0.00 H new ATOM 0 HG2 GLN A 80 28.140 14.152 18.141 1.00 0.00 H new ATOM 0 HG3 GLN A 80 27.058 15.469 17.735 1.00 0.00 H new ATOM 0 HE21 GLN A 80 27.709 17.106 16.344 1.00 0.00 H new ATOM 0 HE22 GLN A 80 29.311 17.148 15.601 1.00 0.00 H new ATOM 1046 N ALA A 81 30.097 17.561 21.117 1.00 0.00 N ATOM 1047 CA ALA A 81 30.929 18.704 21.328 1.00 0.00 C ATOM 1048 C ALA A 81 32.129 18.416 22.163 1.00 0.00 C ATOM 1049 O ALA A 81 33.194 18.979 21.918 1.00 0.00 O ATOM 1050 CB ALA A 81 30.089 19.790 22.022 1.00 0.00 C ATOM 0 H ALA A 81 29.205 17.631 21.607 1.00 0.00 H new ATOM 0 HA ALA A 81 31.293 19.028 20.353 1.00 0.00 H new ATOM 0 HB1 ALA A 81 30.705 20.673 22.193 1.00 0.00 H new ATOM 0 HB2 ALA A 81 29.243 20.055 21.389 1.00 0.00 H new ATOM 0 HB3 ALA A 81 29.723 19.412 22.977 1.00 0.00 H new ATOM 1056 N VAL A 82 32.039 17.509 23.152 1.00 0.00 N ATOM 1057 CA VAL A 82 33.122 17.119 24.003 1.00 0.00 C ATOM 1058 C VAL A 82 34.167 16.410 23.211 1.00 0.00 C ATOM 1059 O VAL A 82 35.325 16.825 23.213 1.00 0.00 O ATOM 1060 CB VAL A 82 32.697 16.274 25.166 1.00 0.00 C ATOM 1061 CG1 VAL A 82 33.895 15.669 25.918 1.00 0.00 C ATOM 1062 CG2 VAL A 82 31.902 17.156 26.143 1.00 0.00 C ATOM 0 H VAL A 82 31.169 17.024 23.369 1.00 0.00 H new ATOM 0 HA VAL A 82 33.529 18.039 24.423 1.00 0.00 H new ATOM 0 HB VAL A 82 32.094 15.452 24.781 1.00 0.00 H new ATOM 0 HG11 VAL A 82 33.535 15.066 26.751 1.00 0.00 H new ATOM 0 HG12 VAL A 82 34.472 15.041 25.239 1.00 0.00 H new ATOM 0 HG13 VAL A 82 34.529 16.471 26.298 1.00 0.00 H new ATOM 0 HG21 VAL A 82 31.584 16.558 26.997 1.00 0.00 H new ATOM 0 HG22 VAL A 82 32.532 17.975 26.489 1.00 0.00 H new ATOM 0 HG23 VAL A 82 31.026 17.561 25.637 1.00 0.00 H new ATOM 1072 N GLU A 83 33.805 15.358 22.456 1.00 0.00 N ATOM 1073 CA GLU A 83 34.716 14.630 21.628 1.00 0.00 C ATOM 1074 C GLU A 83 35.344 15.474 20.574 1.00 0.00 C ATOM 1075 O GLU A 83 36.538 15.380 20.294 1.00 0.00 O ATOM 1076 CB GLU A 83 34.035 13.432 20.944 1.00 0.00 C ATOM 1077 CG GLU A 83 33.804 12.238 21.874 1.00 0.00 C ATOM 1078 CD GLU A 83 35.050 11.395 22.109 1.00 0.00 C ATOM 1079 OE1 GLU A 83 35.933 11.768 22.926 1.00 0.00 O ATOM 1080 OE2 GLU A 83 35.131 10.291 21.506 1.00 0.00 O ATOM 0 H GLU A 83 32.850 15.003 22.420 1.00 0.00 H new ATOM 0 HA GLU A 83 35.494 14.279 22.306 1.00 0.00 H new ATOM 0 HB2 GLU A 83 33.076 13.755 20.537 1.00 0.00 H new ATOM 0 HB3 GLU A 83 34.647 13.111 20.101 1.00 0.00 H new ATOM 0 HG2 GLU A 83 33.436 12.602 22.833 1.00 0.00 H new ATOM 0 HG3 GLU A 83 33.023 11.606 21.452 1.00 0.00 H new ATOM 1087 N THR A 84 34.553 16.384 19.976 1.00 0.00 N ATOM 1088 CA THR A 84 34.992 17.332 19.002 1.00 0.00 C ATOM 1089 C THR A 84 35.987 18.310 19.527 1.00 0.00 C ATOM 1090 O THR A 84 36.969 18.604 18.847 1.00 0.00 O ATOM 1091 CB THR A 84 33.825 18.041 18.378 1.00 0.00 C ATOM 1092 OG1 THR A 84 33.016 17.110 17.675 1.00 0.00 O ATOM 1093 CG2 THR A 84 34.244 19.094 17.340 1.00 0.00 C ATOM 0 H THR A 84 33.557 16.461 20.184 1.00 0.00 H new ATOM 0 HA THR A 84 35.509 16.756 18.235 1.00 0.00 H new ATOM 0 HB THR A 84 33.301 18.525 19.202 1.00 0.00 H new ATOM 0 HG1 THR A 84 32.413 16.660 18.303 1.00 0.00 H new ATOM 0 HG21 THR A 84 33.355 19.570 16.926 1.00 0.00 H new ATOM 0 HG22 THR A 84 34.870 19.847 17.818 1.00 0.00 H new ATOM 0 HG23 THR A 84 34.804 18.612 16.539 1.00 0.00 H new ATOM 1101 N LEU A 85 35.824 18.825 20.759 1.00 0.00 N ATOM 1102 CA LEU A 85 36.809 19.636 21.406 1.00 0.00 C ATOM 1103 C LEU A 85 38.010 18.877 21.856 1.00 0.00 C ATOM 1104 O LEU A 85 39.133 19.376 21.796 1.00 0.00 O ATOM 1105 CB LEU A 85 36.251 20.362 22.642 1.00 0.00 C ATOM 1106 CG LEU A 85 35.305 21.542 22.365 1.00 0.00 C ATOM 1107 CD1 LEU A 85 34.769 22.076 23.705 1.00 0.00 C ATOM 1108 CD2 LEU A 85 36.002 22.682 21.605 1.00 0.00 C ATOM 0 H LEU A 85 34.986 18.674 21.320 1.00 0.00 H new ATOM 0 HA LEU A 85 37.099 20.350 20.635 1.00 0.00 H new ATOM 0 HB2 LEU A 85 35.721 19.635 23.257 1.00 0.00 H new ATOM 0 HB3 LEU A 85 37.091 20.727 23.233 1.00 0.00 H new ATOM 0 HG LEU A 85 34.492 21.179 21.737 1.00 0.00 H new ATOM 0 HD11 LEU A 85 34.097 22.914 23.520 1.00 0.00 H new ATOM 0 HD12 LEU A 85 34.228 21.284 24.222 1.00 0.00 H new ATOM 0 HD13 LEU A 85 35.602 22.409 24.323 1.00 0.00 H new ATOM 0 HD21 LEU A 85 35.293 23.492 21.433 1.00 0.00 H new ATOM 0 HD22 LEU A 85 36.840 23.053 22.194 1.00 0.00 H new ATOM 0 HD23 LEU A 85 36.368 22.311 20.648 1.00 0.00 H new ATOM 1120 N ARG A 86 37.848 17.633 22.339 1.00 0.00 N ATOM 1121 CA ARG A 86 38.938 16.795 22.735 1.00 0.00 C ATOM 1122 C ARG A 86 39.833 16.438 21.600 1.00 0.00 C ATOM 1123 O ARG A 86 41.050 16.593 21.693 1.00 0.00 O ATOM 1124 CB ARG A 86 38.489 15.533 23.490 1.00 0.00 C ATOM 1125 CG ARG A 86 37.944 15.810 24.893 1.00 0.00 C ATOM 1126 CD ARG A 86 37.893 14.593 25.819 1.00 0.00 C ATOM 1127 NE ARG A 86 39.295 14.368 26.270 1.00 0.00 N ATOM 1128 CZ ARG A 86 39.655 13.688 27.397 1.00 0.00 C ATOM 1129 NH1 ARG A 86 38.790 12.929 28.131 1.00 0.00 N ATOM 1130 NH2 ARG A 86 40.949 13.800 27.818 1.00 0.00 N ATOM 0 H ARG A 86 36.934 17.197 22.458 1.00 0.00 H new ATOM 0 HA ARG A 86 39.515 17.400 23.434 1.00 0.00 H new ATOM 0 HB2 ARG A 86 37.721 15.026 22.906 1.00 0.00 H new ATOM 0 HB3 ARG A 86 39.334 14.848 23.568 1.00 0.00 H new ATOM 0 HG2 ARG A 86 38.560 16.578 25.361 1.00 0.00 H new ATOM 0 HG3 ARG A 86 36.938 16.220 24.801 1.00 0.00 H new ATOM 0 HD2 ARG A 86 37.233 14.775 26.668 1.00 0.00 H new ATOM 0 HD3 ARG A 86 37.505 13.719 25.295 1.00 0.00 H new ATOM 0 HE ARG A 86 40.043 14.752 25.692 1.00 0.00 H new ATOM 0 HH11 ARG A 86 37.814 12.847 27.845 1.00 0.00 H new ATOM 0 HH12 ARG A 86 39.119 12.444 28.965 1.00 0.00 H new ATOM 0 HH21 ARG A 86 41.608 14.377 27.294 1.00 0.00 H new ATOM 0 HH22 ARG A 86 41.257 13.307 28.656 1.00 0.00 H new ATOM 1144 N ASN A 87 39.279 16.007 20.452 1.00 0.00 N ATOM 1145 CA ASN A 87 40.033 15.627 19.298 1.00 0.00 C ATOM 1146 C ASN A 87 40.309 16.793 18.411 1.00 0.00 C ATOM 1147 O ASN A 87 39.941 16.838 17.239 1.00 0.00 O ATOM 1148 CB ASN A 87 39.279 14.490 18.588 1.00 0.00 C ATOM 1149 CG ASN A 87 40.166 13.701 17.636 1.00 0.00 C ATOM 1150 OD1 ASN A 87 41.248 13.232 17.983 1.00 0.00 O ATOM 1151 ND2 ASN A 87 39.683 13.517 16.377 1.00 0.00 N ATOM 0 H ASN A 87 38.271 15.920 20.323 1.00 0.00 H new ATOM 0 HA ASN A 87 41.017 15.262 19.593 1.00 0.00 H new ATOM 0 HB2 ASN A 87 38.863 13.814 19.335 1.00 0.00 H new ATOM 0 HB3 ASN A 87 38.439 14.908 18.033 1.00 0.00 H new ATOM 0 HD21 ASN A 87 40.222 12.980 15.698 1.00 0.00 H new ATOM 0 HD22 ASN A 87 38.782 13.916 16.113 1.00 0.00 H new ATOM 1158 N THR A 88 40.990 17.815 18.959 1.00 0.00 N ATOM 1159 CA THR A 88 41.432 19.004 18.299 1.00 0.00 C ATOM 1160 C THR A 88 42.901 18.940 18.061 1.00 0.00 C ATOM 1161 O THR A 88 43.644 18.232 18.738 1.00 0.00 O ATOM 1162 CB THR A 88 41.128 20.268 19.048 1.00 0.00 C ATOM 1163 OG1 THR A 88 41.403 20.155 20.437 1.00 0.00 O ATOM 1164 CG2 THR A 88 39.638 20.619 18.897 1.00 0.00 C ATOM 0 H THR A 88 41.252 17.807 19.945 1.00 0.00 H new ATOM 0 HA THR A 88 40.877 19.041 17.362 1.00 0.00 H new ATOM 0 HB THR A 88 41.767 21.042 18.623 1.00 0.00 H new ATOM 0 HG1 THR A 88 40.644 19.729 20.887 1.00 0.00 H new ATOM 0 HG21 THR A 88 39.423 21.538 19.443 1.00 0.00 H new ATOM 0 HG22 THR A 88 39.403 20.760 17.842 1.00 0.00 H new ATOM 0 HG23 THR A 88 39.031 19.808 19.299 1.00 0.00 H new ATOM 1172 N GLY A 89 43.400 19.704 17.071 1.00 0.00 N ATOM 1173 CA GLY A 89 44.789 19.789 16.741 1.00 0.00 C ATOM 1174 C GLY A 89 45.490 20.814 17.564 1.00 0.00 C ATOM 1175 O GLY A 89 45.164 21.010 18.734 1.00 0.00 O ATOM 0 H GLY A 89 42.810 20.286 16.476 1.00 0.00 H new ATOM 0 HA2 GLY A 89 45.259 18.817 16.893 1.00 0.00 H new ATOM 0 HA3 GLY A 89 44.898 20.034 15.685 1.00 0.00 H new ATOM 1179 N GLN A 90 46.500 21.508 17.009 1.00 0.00 N ATOM 1180 CA GLN A 90 47.094 22.638 17.655 1.00 0.00 C ATOM 1181 C GLN A 90 46.210 23.838 17.666 1.00 0.00 C ATOM 1182 O GLN A 90 45.911 24.417 18.709 1.00 0.00 O ATOM 1183 CB GLN A 90 48.466 23.012 17.071 1.00 0.00 C ATOM 1184 CG GLN A 90 49.138 24.155 17.835 1.00 0.00 C ATOM 1185 CD GLN A 90 50.585 24.390 17.426 1.00 0.00 C ATOM 1186 OE1 GLN A 90 51.508 24.217 18.220 1.00 0.00 O ATOM 1187 NE2 GLN A 90 50.806 24.853 16.167 1.00 0.00 N ATOM 0 H GLN A 90 46.909 21.283 16.102 1.00 0.00 H new ATOM 0 HA GLN A 90 47.239 22.315 18.686 1.00 0.00 H new ATOM 0 HB2 GLN A 90 49.115 22.137 17.089 1.00 0.00 H new ATOM 0 HB3 GLN A 90 48.346 23.299 16.026 1.00 0.00 H new ATOM 0 HG2 GLN A 90 48.570 25.072 17.675 1.00 0.00 H new ATOM 0 HG3 GLN A 90 49.101 23.939 18.903 1.00 0.00 H new ATOM 0 HE21 GLN A 90 50.022 24.988 15.528 1.00 0.00 H new ATOM 0 HE22 GLN A 90 51.756 25.066 15.861 1.00 0.00 H new ATOM 1196 N VAL A 91 45.785 24.267 16.464 1.00 0.00 N ATOM 1197 CA VAL A 91 44.921 25.387 16.252 1.00 0.00 C ATOM 1198 C VAL A 91 43.533 24.901 16.018 1.00 0.00 C ATOM 1199 O VAL A 91 43.286 23.862 15.409 1.00 0.00 O ATOM 1200 CB VAL A 91 45.426 26.283 15.159 1.00 0.00 C ATOM 1201 CG1 VAL A 91 45.432 25.581 13.791 1.00 0.00 C ATOM 1202 CG2 VAL A 91 44.640 27.604 15.104 1.00 0.00 C ATOM 0 H VAL A 91 46.059 23.808 15.595 1.00 0.00 H new ATOM 0 HA VAL A 91 44.911 26.009 17.147 1.00 0.00 H new ATOM 0 HB VAL A 91 46.462 26.522 15.401 1.00 0.00 H new ATOM 0 HG11 VAL A 91 45.805 26.268 13.031 1.00 0.00 H new ATOM 0 HG12 VAL A 91 46.077 24.704 13.835 1.00 0.00 H new ATOM 0 HG13 VAL A 91 44.418 25.273 13.536 1.00 0.00 H new ATOM 0 HG21 VAL A 91 45.033 28.228 14.301 1.00 0.00 H new ATOM 0 HG22 VAL A 91 43.587 27.393 14.918 1.00 0.00 H new ATOM 0 HG23 VAL A 91 44.743 28.128 16.054 1.00 0.00 H new ATOM 1212 N VAL A 92 42.555 25.622 16.596 1.00 0.00 N ATOM 1213 CA VAL A 92 41.169 25.283 16.701 1.00 0.00 C ATOM 1214 C VAL A 92 40.371 26.389 16.102 1.00 0.00 C ATOM 1215 O VAL A 92 40.473 27.547 16.505 1.00 0.00 O ATOM 1216 CB VAL A 92 40.832 25.123 18.155 1.00 0.00 C ATOM 1217 CG1 VAL A 92 39.325 24.907 18.369 1.00 0.00 C ATOM 1218 CG2 VAL A 92 41.583 23.884 18.671 1.00 0.00 C ATOM 0 H VAL A 92 42.755 26.524 17.029 1.00 0.00 H new ATOM 0 HA VAL A 92 40.947 24.354 16.176 1.00 0.00 H new ATOM 0 HB VAL A 92 41.121 26.029 18.688 1.00 0.00 H new ATOM 0 HG11 VAL A 92 39.121 24.795 19.434 1.00 0.00 H new ATOM 0 HG12 VAL A 92 38.776 25.766 17.982 1.00 0.00 H new ATOM 0 HG13 VAL A 92 39.008 24.007 17.843 1.00 0.00 H new ATOM 0 HG21 VAL A 92 41.360 23.738 19.728 1.00 0.00 H new ATOM 0 HG22 VAL A 92 41.266 23.006 18.108 1.00 0.00 H new ATOM 0 HG23 VAL A 92 42.656 24.029 18.543 1.00 0.00 H new ATOM 1228 N HIS A 93 39.529 26.098 15.093 1.00 0.00 N ATOM 1229 CA HIS A 93 38.680 27.079 14.495 1.00 0.00 C ATOM 1230 C HIS A 93 37.292 26.963 15.025 1.00 0.00 C ATOM 1231 O HIS A 93 36.537 26.085 14.609 1.00 0.00 O ATOM 1232 CB HIS A 93 38.622 26.913 12.966 1.00 0.00 C ATOM 1233 CG HIS A 93 39.935 27.006 12.247 1.00 0.00 C ATOM 1234 ND1 HIS A 93 40.022 26.771 10.890 1.00 0.00 N ATOM 1235 CD2 HIS A 93 41.200 27.299 12.650 1.00 0.00 C ATOM 1236 CE1 HIS A 93 41.325 26.932 10.541 1.00 0.00 C ATOM 1237 NE2 HIS A 93 42.073 27.242 11.584 1.00 0.00 N ATOM 0 H HIS A 93 39.437 25.167 14.687 1.00 0.00 H new ATOM 0 HA HIS A 93 39.099 28.055 14.740 1.00 0.00 H new ATOM 0 HB2 HIS A 93 38.175 25.945 12.742 1.00 0.00 H new ATOM 0 HB3 HIS A 93 37.954 27.674 12.562 1.00 0.00 H new ATOM 0 HD2 HIS A 93 41.482 27.542 13.664 1.00 0.00 H new ATOM 0 HE1 HIS A 93 41.702 26.820 9.535 1.00 0.00 H new ATOM 0 HE2 HIS A 93 43.080 27.404 11.598 1.00 0.00 H new ATOM 1245 N LEU A 94 36.865 27.822 15.967 1.00 0.00 N ATOM 1246 CA LEU A 94 35.506 27.867 16.410 1.00 0.00 C ATOM 1247 C LEU A 94 34.711 28.867 15.644 1.00 0.00 C ATOM 1248 O LEU A 94 35.233 29.811 15.052 1.00 0.00 O ATOM 1249 CB LEU A 94 35.291 28.238 17.887 1.00 0.00 C ATOM 1250 CG LEU A 94 36.300 27.660 18.894 1.00 0.00 C ATOM 1251 CD1 LEU A 94 36.091 28.318 20.267 1.00 0.00 C ATOM 1252 CD2 LEU A 94 36.123 26.135 18.989 1.00 0.00 C ATOM 0 H LEU A 94 37.474 28.497 16.429 1.00 0.00 H new ATOM 0 HA LEU A 94 35.183 26.838 16.251 1.00 0.00 H new ATOM 0 HB2 LEU A 94 35.309 29.325 17.972 1.00 0.00 H new ATOM 0 HB3 LEU A 94 34.293 27.912 18.179 1.00 0.00 H new ATOM 0 HG LEU A 94 37.315 27.870 18.558 1.00 0.00 H new ATOM 0 HD11 LEU A 94 36.806 27.908 20.980 1.00 0.00 H new ATOM 0 HD12 LEU A 94 36.241 29.394 20.181 1.00 0.00 H new ATOM 0 HD13 LEU A 94 35.077 28.119 20.615 1.00 0.00 H new ATOM 0 HD21 LEU A 94 36.840 25.729 19.703 1.00 0.00 H new ATOM 0 HD22 LEU A 94 35.110 25.906 19.321 1.00 0.00 H new ATOM 0 HD23 LEU A 94 36.294 25.687 18.010 1.00 0.00 H new ATOM 1264 N LEU A 95 33.377 28.705 15.687 1.00 0.00 N ATOM 1265 CA LEU A 95 32.442 29.760 15.446 1.00 0.00 C ATOM 1266 C LEU A 95 31.479 29.757 16.582 1.00 0.00 C ATOM 1267 O LEU A 95 30.961 28.709 16.965 1.00 0.00 O ATOM 1268 CB LEU A 95 31.763 29.567 14.079 1.00 0.00 C ATOM 1269 CG LEU A 95 31.123 30.817 13.450 1.00 0.00 C ATOM 1270 CD1 LEU A 95 31.077 30.627 11.924 1.00 0.00 C ATOM 1271 CD2 LEU A 95 29.706 31.097 13.977 1.00 0.00 C ATOM 0 H LEU A 95 32.934 27.810 15.896 1.00 0.00 H new ATOM 0 HA LEU A 95 32.930 30.733 15.398 1.00 0.00 H new ATOM 0 HB2 LEU A 95 32.504 29.175 13.382 1.00 0.00 H new ATOM 0 HB3 LEU A 95 30.991 28.805 14.186 1.00 0.00 H new ATOM 0 HG LEU A 95 31.734 31.677 13.724 1.00 0.00 H new ATOM 0 HD11 LEU A 95 30.626 31.505 11.461 1.00 0.00 H new ATOM 0 HD12 LEU A 95 32.090 30.496 11.543 1.00 0.00 H new ATOM 0 HD13 LEU A 95 30.483 29.745 11.685 1.00 0.00 H new ATOM 0 HD21 LEU A 95 29.309 31.991 13.496 1.00 0.00 H new ATOM 0 HD22 LEU A 95 29.060 30.247 13.754 1.00 0.00 H new ATOM 0 HD23 LEU A 95 29.743 31.252 15.055 1.00 0.00 H new ATOM 1283 N LEU A 96 31.198 30.914 17.208 1.00 0.00 N ATOM 1284 CA LEU A 96 30.275 30.958 18.299 1.00 0.00 C ATOM 1285 C LEU A 96 29.455 32.201 18.296 1.00 0.00 C ATOM 1286 O LEU A 96 29.742 33.160 17.580 1.00 0.00 O ATOM 1287 CB LEU A 96 30.961 30.763 19.662 1.00 0.00 C ATOM 1288 CG LEU A 96 31.967 31.852 20.068 1.00 0.00 C ATOM 1289 CD1 LEU A 96 31.368 32.867 21.056 1.00 0.00 C ATOM 1290 CD2 LEU A 96 33.233 31.214 20.666 1.00 0.00 C ATOM 0 H LEU A 96 31.608 31.815 16.960 1.00 0.00 H new ATOM 0 HA LEU A 96 29.601 30.114 18.148 1.00 0.00 H new ATOM 0 HB2 LEU A 96 30.190 30.703 20.430 1.00 0.00 H new ATOM 0 HB3 LEU A 96 31.477 29.803 19.653 1.00 0.00 H new ATOM 0 HG LEU A 96 32.228 32.399 19.162 1.00 0.00 H new ATOM 0 HD11 LEU A 96 32.120 33.614 21.310 1.00 0.00 H new ATOM 0 HD12 LEU A 96 30.509 33.357 20.598 1.00 0.00 H new ATOM 0 HD13 LEU A 96 31.050 32.350 21.961 1.00 0.00 H new ATOM 0 HD21 LEU A 96 33.936 31.997 20.949 1.00 0.00 H new ATOM 0 HD22 LEU A 96 32.965 30.631 21.547 1.00 0.00 H new ATOM 0 HD23 LEU A 96 33.696 30.561 19.926 1.00 0.00 H new ATOM 1302 N GLU A 97 28.387 32.199 19.113 1.00 0.00 N ATOM 1303 CA GLU A 97 27.502 33.295 19.355 1.00 0.00 C ATOM 1304 C GLU A 97 27.673 33.741 20.767 1.00 0.00 C ATOM 1305 O GLU A 97 27.900 32.952 21.683 1.00 0.00 O ATOM 1306 CB GLU A 97 26.044 32.862 19.126 1.00 0.00 C ATOM 1307 CG GLU A 97 24.982 33.948 19.309 1.00 0.00 C ATOM 1308 CD GLU A 97 23.568 33.382 19.298 1.00 0.00 C ATOM 1309 OE1 GLU A 97 23.296 32.411 20.052 1.00 0.00 O ATOM 1310 OE2 GLU A 97 22.692 33.942 18.587 1.00 0.00 O ATOM 0 H GLU A 97 28.124 31.368 19.643 1.00 0.00 H new ATOM 0 HA GLU A 97 27.735 34.110 18.670 1.00 0.00 H new ATOM 0 HB2 GLU A 97 25.959 32.466 18.114 1.00 0.00 H new ATOM 0 HB3 GLU A 97 25.818 32.043 19.809 1.00 0.00 H new ATOM 0 HG2 GLU A 97 25.156 34.468 20.251 1.00 0.00 H new ATOM 0 HG3 GLU A 97 25.081 34.687 18.514 1.00 0.00 H new ATOM 1317 N LYS A 98 27.528 35.056 21.011 1.00 0.00 N ATOM 1318 CA LYS A 98 27.588 35.641 22.315 1.00 0.00 C ATOM 1319 C LYS A 98 26.331 35.373 23.067 1.00 0.00 C ATOM 1320 O LYS A 98 25.222 35.611 22.591 1.00 0.00 O ATOM 1321 CB LYS A 98 27.793 37.159 22.181 1.00 0.00 C ATOM 1322 CG LYS A 98 28.064 37.966 23.452 1.00 0.00 C ATOM 1323 CD LYS A 98 29.523 38.067 23.903 1.00 0.00 C ATOM 1324 CE LYS A 98 30.199 36.709 24.100 1.00 0.00 C ATOM 1325 NZ LYS A 98 31.244 36.689 25.147 1.00 0.00 N ATOM 0 H LYS A 98 27.363 35.738 20.271 1.00 0.00 H new ATOM 0 HA LYS A 98 28.422 35.200 22.862 1.00 0.00 H new ATOM 0 HB2 LYS A 98 28.626 37.324 21.498 1.00 0.00 H new ATOM 0 HB3 LYS A 98 26.904 37.574 21.706 1.00 0.00 H new ATOM 0 HG2 LYS A 98 27.684 38.976 23.301 1.00 0.00 H new ATOM 0 HG3 LYS A 98 27.486 37.526 24.265 1.00 0.00 H new ATOM 0 HD2 LYS A 98 30.084 38.639 23.164 1.00 0.00 H new ATOM 0 HD3 LYS A 98 29.568 38.625 24.838 1.00 0.00 H new ATOM 0 HE2 LYS A 98 29.437 35.971 24.351 1.00 0.00 H new ATOM 0 HE3 LYS A 98 30.644 36.398 23.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 31.267 35.751 25.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 32.170 36.890 24.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 31.031 37.411 25.864 1.00 0.00 H new ATOM 1339 N GLY A 99 26.471 34.823 24.287 1.00 0.00 N ATOM 1340 CA GLY A 99 25.403 34.396 25.137 1.00 0.00 C ATOM 1341 C GLY A 99 24.522 35.511 25.585 1.00 0.00 C ATOM 1342 O GLY A 99 25.000 36.568 25.991 1.00 0.00 O ATOM 0 H GLY A 99 27.388 34.667 24.705 1.00 0.00 H new ATOM 0 HA2 GLY A 99 24.801 33.657 24.608 1.00 0.00 H new ATOM 0 HA3 GLY A 99 25.821 33.899 26.012 1.00 0.00 H new ATOM 1346 N GLN A 100 23.199 35.285 25.488 1.00 0.00 N ATOM 1347 CA GLN A 100 22.176 36.278 25.591 1.00 0.00 C ATOM 1348 C GLN A 100 21.988 36.865 26.948 1.00 0.00 C ATOM 1349 O GLN A 100 21.666 38.045 27.075 1.00 0.00 O ATOM 1350 CB GLN A 100 20.855 35.716 25.038 1.00 0.00 C ATOM 1351 CG GLN A 100 20.330 34.460 25.737 1.00 0.00 C ATOM 1352 CD GLN A 100 19.143 33.855 25.000 1.00 0.00 C ATOM 1353 OE1 GLN A 100 19.214 32.728 24.512 1.00 0.00 O ATOM 1354 NE2 GLN A 100 18.012 34.606 24.914 1.00 0.00 N ATOM 0 H GLN A 100 22.822 34.351 25.328 1.00 0.00 H new ATOM 0 HA GLN A 100 22.516 37.119 24.986 1.00 0.00 H new ATOM 0 HB2 GLN A 100 20.094 36.493 25.105 1.00 0.00 H new ATOM 0 HB3 GLN A 100 20.990 35.492 23.980 1.00 0.00 H new ATOM 0 HG2 GLN A 100 21.129 33.722 25.806 1.00 0.00 H new ATOM 0 HG3 GLN A 100 20.036 34.708 26.757 1.00 0.00 H new ATOM 0 HE21 GLN A 100 17.985 35.537 25.329 1.00 0.00 H new ATOM 0 HE22 GLN A 100 17.191 34.238 24.434 1.00 0.00 H new ATOM 1363 N VAL A 101 22.170 36.068 28.016 1.00 0.00 N ATOM 1364 CA VAL A 101 21.925 36.485 29.361 1.00 0.00 C ATOM 1365 C VAL A 101 23.080 36.098 30.218 1.00 0.00 C ATOM 1366 O VAL A 101 23.863 35.245 29.804 1.00 0.00 O ATOM 1367 CB VAL A 101 20.639 35.932 29.899 1.00 0.00 C ATOM 1368 CG1 VAL A 101 19.450 36.552 29.147 1.00 0.00 C ATOM 1369 CG2 VAL A 101 20.603 34.396 29.829 1.00 0.00 C ATOM 0 H VAL A 101 22.497 35.105 27.941 1.00 0.00 H new ATOM 0 HA VAL A 101 21.820 37.570 29.369 1.00 0.00 H new ATOM 0 HB VAL A 101 20.567 36.199 30.953 1.00 0.00 H new ATOM 0 HG11 VAL A 101 18.518 36.147 29.542 1.00 0.00 H new ATOM 0 HG12 VAL A 101 19.460 37.634 29.279 1.00 0.00 H new ATOM 0 HG13 VAL A 101 19.527 36.316 28.086 1.00 0.00 H new ATOM 0 HG21 VAL A 101 19.655 34.036 30.228 1.00 0.00 H new ATOM 0 HG22 VAL A 101 20.705 34.077 28.792 1.00 0.00 H new ATOM 0 HG23 VAL A 101 21.424 33.986 30.417 1.00 0.00 H new ATOM 1379 N PRO A 102 23.305 36.657 31.371 1.00 0.00 N ATOM 1380 CA PRO A 102 24.285 36.162 32.294 1.00 0.00 C ATOM 1381 C PRO A 102 23.719 35.110 33.184 1.00 0.00 C ATOM 1382 O PRO A 102 24.189 34.961 34.344 1.00 0.00 O ATOM 1383 CB PRO A 102 24.680 37.427 33.052 1.00 0.00 C ATOM 1384 CG PRO A 102 23.359 38.202 33.177 1.00 0.00 C ATOM 1385 CD PRO A 102 22.716 37.912 31.811 1.00 0.00 C ATOM 1386 OXT PRO A 102 22.808 34.344 32.770 1.00 0.00 O ATOM 0 HA PRO A 102 25.133 35.669 31.819 1.00 0.00 H new ATOM 0 HB2 PRO A 102 25.101 37.193 34.030 1.00 0.00 H new ATOM 0 HB3 PRO A 102 25.432 38.001 32.510 1.00 0.00 H new ATOM 0 HG2 PRO A 102 22.747 37.843 34.005 1.00 0.00 H new ATOM 0 HG3 PRO A 102 23.520 39.268 33.339 1.00 0.00 H new ATOM 0 HD2 PRO A 102 21.632 37.830 31.895 1.00 0.00 H new ATOM 0 HD3 PRO A 102 22.921 38.713 31.101 1.00 0.00 H new TER 1394 PRO A 102