USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=49 USER MOD reduce.3.24.130724 removed 839 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 73 TYR OH : rot 0:sc= 1.24 USER MOD Set 1.2: A 83 THR OG1 : rot 38:sc= 1.36 USER MOD Set 2.1: A 71 SER OG : rot 71:sc= 2.34 USER MOD Set 2.2: A 86 THR OG1 : rot -5:sc= 0.437 USER MOD Set 3.1: A 47 ASN : amide:sc= 0.898 K(o=1.7,f=-0.54) USER MOD Set 3.2: A 62 GLN : amide:sc= 0.792 K(o=1.7,f=-0.54) USER MOD Set 4.1: A 57 ASN : amide:sc= 0.815 K(o=2.9,f=0.95) USER MOD Set 4.2: A 72 GLN : amide:sc= 1.46 K(o=2.9,f=0.78) USER MOD Set 4.3: A 87 SER OG : rot 149:sc= 0.656 USER MOD Set 5.1: A 42 GLN : amide:sc= 0.189 K(o=0.32,f=-0.26) USER MOD Set 5.2: A 44 SER OG : rot 180:sc= 0.135 USER MOD Set 6.1: A 39 THR OG1 : rot 75:sc= 0.954 USER MOD Set 6.2: A 54 THR OG1 : rot 180:sc= 0 USER MOD Set 7.1: A 19 LYS NZ :NH3+ -156:sc= 1.82 (180deg=0.905) USER MOD Set 7.2: A 35 THR OG1 : rot 180:sc= 0.727 USER MOD Set 8.1: A 14 ASN : amide:sc= 1.02 K(o=3,f=0.8) USER MOD Set 8.2: A 29 ASN : amide:sc= 2.01 K(o=3,f=-0.38) USER MOD Set 9.1: A 12 THR OG1 : rot -82:sc= 1.7 USER MOD Set 9.2: A 15 SER OG : rot 95:sc= 1.78 USER MOD Set10.1: A 7 THR OG1 : rot 143:sc= 0.97 USER MOD Set10.2: A 23 THR OG1 : rot 180:sc= 0.841 USER MOD Single : A 1 ASP N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 THR OG1 : rot 180:sc=-0.00265 USER MOD Single : A 6 ASN : amide:sc= 0.965 K(o=0.96,f=-9.1!) USER MOD Single : A 8 ASN : amide:sc= -0.401 K(o=-0.4,f=-0.95) USER MOD Single : A 9 SER OG : rot -154:sc= 0.342 USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 GLN : amide:sc= -0.153 X(o=-0.15,f=-0.014) USER MOD Single : A 20 SER OG : rot 81:sc= 1.54 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= 1.12 K(o=1.1,f=-4.4!) USER MOD Single : A 26 TYR OH : rot 30:sc= 0.512 USER MOD Single : A 30 SER OG : rot 80:sc= 1.89 USER MOD Single : A 31 GLN : amide:sc= -0.791 X(o=-0.79,f=-1.2) USER MOD Single : A 36 SER OG : rot 70:sc= 1.4 USER MOD Single : A 41 SER OG : rot 70:sc= 2.04 USER MOD Single : A 43 TYR OH : rot 80:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 158:sc= 1.15 (180deg=0.835) USER MOD Single : A 50 LYS NZ :NH3+ 157:sc= 1.2 (180deg=0.254) USER MOD Single : A 51 SER OG : rot 63:sc= 1.67 USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.035 USER MOD Single : A 60 LYS NZ :NH3+ 169:sc= 0.736 (180deg=0.343) USER MOD Single : A 61 SER OG : rot 72:sc= 1.83 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 75:sc= 1.6 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= 1.17 K(o=1.2,f=-0.018) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 62:sc= 1.51 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 110:sc= 0.989 USER MOD Single : A 97 THR OG1 : rot 64:sc= 1.31 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 THR OG1 : rot 77:sc= 1.21 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 SER OG : rot 7:sc= 0.834 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 121 MET CE :methyl 173:sc= 0 (180deg=-0.072) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 1 11.550 -14.362 -2.774 1.00 0.00 N ATOM 2 CA ASP A 1 10.140 -14.002 -2.507 1.00 0.00 C ATOM 3 C ASP A 1 10.079 -12.765 -1.617 1.00 0.00 C ATOM 4 O ASP A 1 10.754 -12.715 -0.588 1.00 0.00 O ATOM 5 CB ASP A 1 9.375 -15.158 -1.847 1.00 0.00 C ATOM 6 CG ASP A 1 7.937 -14.728 -1.533 1.00 0.00 C ATOM 7 OD1 ASP A 1 7.196 -14.373 -2.477 1.00 0.00 O ATOM 8 OD2 ASP A 1 7.535 -14.753 -0.350 1.00 0.00 O ATOM 0 H1 ASP A 1 11.584 -15.206 -3.381 1.00 0.00 H new ATOM 0 H2 ASP A 1 12.025 -13.571 -3.254 1.00 0.00 H new ATOM 0 H3 ASP A 1 12.033 -14.563 -1.875 1.00 0.00 H new ATOM 0 HA ASP A 1 9.664 -13.789 -3.464 1.00 0.00 H new ATOM 0 HB2 ASP A 1 9.367 -16.024 -2.509 1.00 0.00 H new ATOM 0 HB3 ASP A 1 9.880 -15.462 -0.930 1.00 0.00 H new ATOM 15 N GLY A 2 9.298 -11.751 -1.994 1.00 0.00 N ATOM 16 CA GLY A 2 9.164 -10.529 -1.217 1.00 0.00 C ATOM 17 C GLY A 2 8.243 -9.531 -1.905 1.00 0.00 C ATOM 18 O GLY A 2 7.712 -9.791 -2.988 1.00 0.00 O ATOM 0 H GLY A 2 8.742 -11.759 -2.849 1.00 0.00 H new ATOM 0 HA2 GLY A 2 8.772 -10.766 -0.228 1.00 0.00 H new ATOM 0 HA3 GLY A 2 10.146 -10.079 -1.071 1.00 0.00 H new ATOM 22 N THR A 3 8.040 -8.387 -1.263 1.00 0.00 N ATOM 23 CA THR A 3 7.302 -7.231 -1.758 1.00 0.00 C ATOM 24 C THR A 3 7.920 -6.049 -1.008 1.00 0.00 C ATOM 25 O THR A 3 7.427 -5.639 0.042 1.00 0.00 O ATOM 26 CB THR A 3 5.787 -7.412 -1.512 1.00 0.00 C ATOM 27 OG1 THR A 3 5.315 -8.583 -2.155 1.00 0.00 O ATOM 28 CG2 THR A 3 4.950 -6.240 -2.035 1.00 0.00 C ATOM 0 H THR A 3 8.409 -8.232 -0.325 1.00 0.00 H new ATOM 0 HA THR A 3 7.379 -7.081 -2.835 1.00 0.00 H new ATOM 0 HB THR A 3 5.673 -7.475 -0.430 1.00 0.00 H new ATOM 0 HG1 THR A 3 4.355 -8.683 -1.988 1.00 0.00 H new ATOM 0 HG21 THR A 3 3.895 -6.427 -1.832 1.00 0.00 H new ATOM 0 HG22 THR A 3 5.258 -5.321 -1.536 1.00 0.00 H new ATOM 0 HG23 THR A 3 5.100 -6.137 -3.110 1.00 0.00 H new ATOM 36 N CYS A 4 9.074 -5.579 -1.482 1.00 0.00 N ATOM 37 CA CYS A 4 9.928 -4.619 -0.796 1.00 0.00 C ATOM 38 C CYS A 4 10.583 -3.686 -1.812 1.00 0.00 C ATOM 39 O CYS A 4 10.744 -4.037 -2.985 1.00 0.00 O ATOM 40 CB CYS A 4 11.006 -5.377 0.004 1.00 0.00 C ATOM 41 SG CYS A 4 11.521 -6.984 -0.685 1.00 0.00 S ATOM 0 H CYS A 4 9.450 -5.868 -2.385 1.00 0.00 H new ATOM 0 HA CYS A 4 9.327 -4.020 -0.111 1.00 0.00 H new ATOM 0 HB2 CYS A 4 11.886 -4.739 0.086 1.00 0.00 H new ATOM 0 HB3 CYS A 4 10.634 -5.539 1.016 1.00 0.00 H new ATOM 46 N VAL A 5 11.001 -2.510 -1.345 1.00 0.00 N ATOM 47 CA VAL A 5 11.773 -1.544 -2.113 1.00 0.00 C ATOM 48 C VAL A 5 13.232 -2.012 -2.051 1.00 0.00 C ATOM 49 O VAL A 5 14.040 -1.492 -1.280 1.00 0.00 O ATOM 50 CB VAL A 5 11.532 -0.110 -1.579 1.00 0.00 C ATOM 51 CG1 VAL A 5 12.221 0.942 -2.462 1.00 0.00 C ATOM 52 CG2 VAL A 5 10.030 0.229 -1.522 1.00 0.00 C ATOM 0 H VAL A 5 10.804 -2.198 -0.394 1.00 0.00 H new ATOM 0 HA VAL A 5 11.469 -1.495 -3.159 1.00 0.00 H new ATOM 0 HB VAL A 5 11.954 -0.086 -0.574 1.00 0.00 H new ATOM 0 HG11 VAL A 5 12.031 1.937 -2.058 1.00 0.00 H new ATOM 0 HG12 VAL A 5 13.295 0.756 -2.479 1.00 0.00 H new ATOM 0 HG13 VAL A 5 11.826 0.881 -3.476 1.00 0.00 H new ATOM 0 HG21 VAL A 5 9.900 1.243 -1.143 1.00 0.00 H new ATOM 0 HG22 VAL A 5 9.603 0.158 -2.522 1.00 0.00 H new ATOM 0 HG23 VAL A 5 9.523 -0.474 -0.861 1.00 0.00 H new ATOM 62 N ASN A 6 13.555 -3.061 -2.812 1.00 0.00 N ATOM 63 CA ASN A 6 14.934 -3.486 -3.006 1.00 0.00 C ATOM 64 C ASN A 6 15.587 -2.530 -4.006 1.00 0.00 C ATOM 65 O ASN A 6 15.373 -2.657 -5.214 1.00 0.00 O ATOM 66 CB ASN A 6 15.029 -4.941 -3.500 1.00 0.00 C ATOM 67 CG ASN A 6 16.492 -5.318 -3.724 1.00 0.00 C ATOM 68 OD1 ASN A 6 17.389 -4.639 -3.241 1.00 0.00 O ATOM 69 ND2 ASN A 6 16.788 -6.387 -4.443 1.00 0.00 N ATOM 0 H ASN A 6 12.870 -3.633 -3.306 1.00 0.00 H new ATOM 0 HA ASN A 6 15.455 -3.454 -2.049 1.00 0.00 H new ATOM 0 HB2 ASN A 6 14.579 -5.613 -2.769 1.00 0.00 H new ATOM 0 HB3 ASN A 6 14.468 -5.057 -4.427 1.00 0.00 H new ATOM 0 HD21 ASN A 6 17.763 -6.645 -4.595 1.00 0.00 H new ATOM 0 HD22 ASN A 6 16.041 -6.953 -4.846 1.00 0.00 H new ATOM 76 N THR A 7 16.344 -1.556 -3.511 1.00 0.00 N ATOM 77 CA THR A 7 17.038 -0.576 -4.330 1.00 0.00 C ATOM 78 C THR A 7 18.146 -1.260 -5.152 1.00 0.00 C ATOM 79 O THR A 7 18.173 -1.118 -6.376 1.00 0.00 O ATOM 80 CB THR A 7 17.605 0.527 -3.411 1.00 0.00 C ATOM 81 OG1 THR A 7 16.652 0.954 -2.456 1.00 0.00 O ATOM 82 CG2 THR A 7 18.093 1.740 -4.205 1.00 0.00 C ATOM 0 H THR A 7 16.493 -1.426 -2.510 1.00 0.00 H new ATOM 0 HA THR A 7 16.347 -0.118 -5.038 1.00 0.00 H new ATOM 0 HB THR A 7 18.454 0.080 -2.894 1.00 0.00 H new ATOM 0 HG1 THR A 7 17.103 1.146 -1.607 1.00 0.00 H new ATOM 0 HG21 THR A 7 18.484 2.491 -3.518 1.00 0.00 H new ATOM 0 HG22 THR A 7 18.881 1.432 -4.892 1.00 0.00 H new ATOM 0 HG23 THR A 7 17.263 2.163 -4.771 1.00 0.00 H new ATOM 90 N ASN A 8 19.061 -1.991 -4.493 1.00 0.00 N ATOM 91 CA ASN A 8 20.272 -2.561 -5.113 1.00 0.00 C ATOM 92 C ASN A 8 20.924 -3.642 -4.224 1.00 0.00 C ATOM 93 O ASN A 8 22.151 -3.757 -4.163 1.00 0.00 O ATOM 94 CB ASN A 8 21.278 -1.429 -5.425 1.00 0.00 C ATOM 95 CG ASN A 8 22.444 -1.902 -6.299 1.00 0.00 C ATOM 96 OD1 ASN A 8 22.286 -2.743 -7.181 1.00 0.00 O ATOM 97 ND2 ASN A 8 23.635 -1.364 -6.091 1.00 0.00 N ATOM 0 H ASN A 8 18.980 -2.206 -3.499 1.00 0.00 H new ATOM 0 HA ASN A 8 19.978 -3.050 -6.042 1.00 0.00 H new ATOM 0 HB2 ASN A 8 20.758 -0.614 -5.929 1.00 0.00 H new ATOM 0 HB3 ASN A 8 21.669 -1.027 -4.490 1.00 0.00 H new ATOM 0 HD21 ASN A 8 24.430 -1.647 -6.665 1.00 0.00 H new ATOM 0 HD22 ASN A 8 23.758 -0.667 -5.357 1.00 0.00 H new ATOM 104 N SER A 9 20.125 -4.362 -3.439 1.00 0.00 N ATOM 105 CA SER A 9 20.567 -5.343 -2.451 1.00 0.00 C ATOM 106 C SER A 9 20.439 -6.768 -2.980 1.00 0.00 C ATOM 107 O SER A 9 19.739 -7.026 -3.968 1.00 0.00 O ATOM 108 CB SER A 9 19.707 -5.228 -1.188 1.00 0.00 C ATOM 109 OG SER A 9 19.649 -3.882 -0.773 1.00 0.00 O ATOM 0 H SER A 9 19.109 -4.274 -3.476 1.00 0.00 H new ATOM 0 HA SER A 9 21.614 -5.136 -2.231 1.00 0.00 H new ATOM 0 HB2 SER A 9 18.702 -5.601 -1.386 1.00 0.00 H new ATOM 0 HB3 SER A 9 20.126 -5.846 -0.394 1.00 0.00 H new ATOM 0 HG SER A 9 19.480 -3.844 0.192 1.00 0.00 H new ATOM 115 N GLN A 10 21.063 -7.695 -2.255 1.00 0.00 N ATOM 116 CA GLN A 10 20.913 -9.123 -2.432 1.00 0.00 C ATOM 117 C GLN A 10 20.022 -9.612 -1.293 1.00 0.00 C ATOM 118 O GLN A 10 20.250 -9.288 -0.126 1.00 0.00 O ATOM 119 CB GLN A 10 22.306 -9.778 -2.443 1.00 0.00 C ATOM 120 CG GLN A 10 22.333 -11.216 -1.910 1.00 0.00 C ATOM 121 CD GLN A 10 23.707 -11.868 -2.068 1.00 0.00 C ATOM 122 OE1 GLN A 10 24.490 -11.935 -1.125 1.00 0.00 O ATOM 123 NE2 GLN A 10 24.036 -12.357 -3.253 1.00 0.00 N ATOM 0 H GLN A 10 21.709 -7.455 -1.503 1.00 0.00 H new ATOM 0 HA GLN A 10 20.445 -9.389 -3.380 1.00 0.00 H new ATOM 0 HB2 GLN A 10 22.688 -9.774 -3.464 1.00 0.00 H new ATOM 0 HB3 GLN A 10 22.985 -9.169 -1.846 1.00 0.00 H new ATOM 0 HG2 GLN A 10 22.052 -11.216 -0.857 1.00 0.00 H new ATOM 0 HG3 GLN A 10 21.588 -11.811 -2.438 1.00 0.00 H new ATOM 0 HE21 GLN A 10 23.378 -12.296 -4.030 1.00 0.00 H new ATOM 0 HE22 GLN A 10 24.947 -12.795 -3.389 1.00 0.00 H new ATOM 132 N ILE A 11 19.052 -10.442 -1.658 1.00 0.00 N ATOM 133 CA ILE A 11 18.140 -11.142 -0.765 1.00 0.00 C ATOM 134 C ILE A 11 18.162 -12.583 -1.264 1.00 0.00 C ATOM 135 O ILE A 11 17.837 -12.845 -2.425 1.00 0.00 O ATOM 136 CB ILE A 11 16.730 -10.492 -0.768 1.00 0.00 C ATOM 137 CG1 ILE A 11 16.773 -9.002 -0.351 1.00 0.00 C ATOM 138 CG2 ILE A 11 15.788 -11.233 0.197 1.00 0.00 C ATOM 139 CD1 ILE A 11 16.754 -8.033 -1.537 1.00 0.00 C ATOM 0 H ILE A 11 18.872 -10.655 -2.639 1.00 0.00 H new ATOM 0 HA ILE A 11 18.437 -11.092 0.283 1.00 0.00 H new ATOM 0 HB ILE A 11 16.361 -10.563 -1.791 1.00 0.00 H new ATOM 0 HG12 ILE A 11 15.921 -8.789 0.295 1.00 0.00 H new ATOM 0 HG13 ILE A 11 17.672 -8.824 0.239 1.00 0.00 H new ATOM 0 HG21 ILE A 11 14.805 -10.762 0.180 1.00 0.00 H new ATOM 0 HG22 ILE A 11 15.696 -12.274 -0.112 1.00 0.00 H new ATOM 0 HG23 ILE A 11 16.194 -11.189 1.208 1.00 0.00 H new ATOM 0 HD11 ILE A 11 16.786 -7.007 -1.169 1.00 0.00 H new ATOM 0 HD12 ILE A 11 17.620 -8.218 -2.172 1.00 0.00 H new ATOM 0 HD13 ILE A 11 15.842 -8.183 -2.115 1.00 0.00 H new ATOM 151 N THR A 12 18.652 -13.492 -0.421 1.00 0.00 N ATOM 152 CA THR A 12 18.869 -14.888 -0.802 1.00 0.00 C ATOM 153 C THR A 12 17.535 -15.618 -1.022 1.00 0.00 C ATOM 154 O THR A 12 16.469 -15.142 -0.618 1.00 0.00 O ATOM 155 CB THR A 12 19.765 -15.594 0.234 1.00 0.00 C ATOM 156 OG1 THR A 12 19.366 -15.272 1.549 1.00 0.00 O ATOM 157 CG2 THR A 12 21.235 -15.197 0.078 1.00 0.00 C ATOM 0 H THR A 12 18.909 -13.282 0.543 1.00 0.00 H new ATOM 0 HA THR A 12 19.395 -14.913 -1.756 1.00 0.00 H new ATOM 0 HB THR A 12 19.656 -16.664 0.056 1.00 0.00 H new ATOM 0 HG1 THR A 12 19.752 -14.408 1.806 1.00 0.00 H new ATOM 0 HG21 THR A 12 21.833 -15.716 0.827 1.00 0.00 H new ATOM 0 HG22 THR A 12 21.582 -15.471 -0.918 1.00 0.00 H new ATOM 0 HG23 THR A 12 21.338 -14.120 0.214 1.00 0.00 H new ATOM 165 N ALA A 13 17.602 -16.803 -1.641 1.00 0.00 N ATOM 166 CA ALA A 13 16.449 -17.595 -2.064 1.00 0.00 C ATOM 167 C ALA A 13 15.453 -17.906 -0.940 1.00 0.00 C ATOM 168 O ALA A 13 14.272 -18.115 -1.226 1.00 0.00 O ATOM 169 CB ALA A 13 16.958 -18.910 -2.659 1.00 0.00 C ATOM 0 H ALA A 13 18.491 -17.248 -1.867 1.00 0.00 H new ATOM 0 HA ALA A 13 15.905 -16.996 -2.794 1.00 0.00 H new ATOM 0 HB1 ALA A 13 16.111 -19.516 -2.981 1.00 0.00 H new ATOM 0 HB2 ALA A 13 17.599 -18.698 -3.515 1.00 0.00 H new ATOM 0 HB3 ALA A 13 17.527 -19.454 -1.905 1.00 0.00 H new ATOM 175 N ASN A 14 15.911 -17.948 0.318 1.00 0.00 N ATOM 176 CA ASN A 14 15.075 -18.299 1.473 1.00 0.00 C ATOM 177 C ASN A 14 14.933 -17.138 2.467 1.00 0.00 C ATOM 178 O ASN A 14 14.371 -17.318 3.546 1.00 0.00 O ATOM 179 CB ASN A 14 15.586 -19.584 2.142 1.00 0.00 C ATOM 180 CG ASN A 14 14.498 -20.225 3.007 1.00 0.00 C ATOM 181 OD1 ASN A 14 13.423 -20.563 2.519 1.00 0.00 O ATOM 182 ND2 ASN A 14 14.743 -20.434 4.288 1.00 0.00 N ATOM 0 H ASN A 14 16.878 -17.738 0.564 1.00 0.00 H new ATOM 0 HA ASN A 14 14.068 -18.497 1.104 1.00 0.00 H new ATOM 0 HB2 ASN A 14 15.911 -20.291 1.378 1.00 0.00 H new ATOM 0 HB3 ASN A 14 16.457 -19.356 2.757 1.00 0.00 H new ATOM 0 HD21 ASN A 14 14.038 -20.878 4.876 1.00 0.00 H new ATOM 0 HD22 ASN A 14 15.637 -20.152 4.689 1.00 0.00 H new ATOM 189 N SER A 15 15.434 -15.953 2.112 1.00 0.00 N ATOM 190 CA SER A 15 15.188 -14.706 2.830 1.00 0.00 C ATOM 191 C SER A 15 13.873 -14.100 2.327 1.00 0.00 C ATOM 192 O SER A 15 13.362 -14.533 1.285 1.00 0.00 O ATOM 193 CB SER A 15 16.340 -13.756 2.527 1.00 0.00 C ATOM 194 OG SER A 15 17.510 -14.219 3.155 1.00 0.00 O ATOM 0 H SER A 15 16.036 -15.834 1.297 1.00 0.00 H new ATOM 0 HA SER A 15 15.118 -14.880 3.904 1.00 0.00 H new ATOM 0 HB2 SER A 15 16.495 -13.688 1.450 1.00 0.00 H new ATOM 0 HB3 SER A 15 16.099 -12.753 2.878 1.00 0.00 H new ATOM 0 HG SER A 15 18.033 -14.752 2.520 1.00 0.00 H new ATOM 200 N GLN A 16 13.317 -13.098 3.017 1.00 0.00 N ATOM 201 CA GLN A 16 12.153 -12.367 2.529 1.00 0.00 C ATOM 202 C GLN A 16 12.265 -10.917 2.971 1.00 0.00 C ATOM 203 O GLN A 16 12.801 -10.639 4.047 1.00 0.00 O ATOM 204 CB GLN A 16 10.829 -12.915 3.111 1.00 0.00 C ATOM 205 CG GLN A 16 10.362 -14.295 2.623 1.00 0.00 C ATOM 206 CD GLN A 16 10.905 -15.452 3.463 1.00 0.00 C ATOM 207 OE1 GLN A 16 10.536 -15.639 4.621 1.00 0.00 O ATOM 208 NE2 GLN A 16 11.778 -16.262 2.893 1.00 0.00 N ATOM 0 H GLN A 16 13.661 -12.776 3.922 1.00 0.00 H new ATOM 0 HA GLN A 16 12.136 -12.474 1.444 1.00 0.00 H new ATOM 0 HB2 GLN A 16 10.929 -12.957 4.196 1.00 0.00 H new ATOM 0 HB3 GLN A 16 10.041 -12.195 2.891 1.00 0.00 H new ATOM 0 HG2 GLN A 16 9.273 -14.327 2.635 1.00 0.00 H new ATOM 0 HG3 GLN A 16 10.673 -14.430 1.587 1.00 0.00 H new ATOM 0 HE21 GLN A 16 12.076 -16.096 1.932 1.00 0.00 H new ATOM 0 HE22 GLN A 16 12.155 -17.054 3.414 1.00 0.00 H new ATOM 217 N CYS A 17 11.711 -10.004 2.171 1.00 0.00 N ATOM 218 CA CYS A 17 11.519 -8.627 2.585 1.00 0.00 C ATOM 219 C CYS A 17 10.102 -8.202 2.212 1.00 0.00 C ATOM 220 O CYS A 17 9.596 -8.593 1.160 1.00 0.00 O ATOM 221 CB CYS A 17 12.642 -7.680 2.128 1.00 0.00 C ATOM 222 SG CYS A 17 13.150 -7.560 0.387 1.00 0.00 S ATOM 0 H CYS A 17 11.387 -10.204 1.225 1.00 0.00 H new ATOM 0 HA CYS A 17 11.606 -8.555 3.669 1.00 0.00 H new ATOM 0 HB2 CYS A 17 12.354 -6.677 2.442 1.00 0.00 H new ATOM 0 HB3 CYS A 17 13.532 -7.949 2.697 1.00 0.00 H new ATOM 227 N VAL A 18 9.426 -7.462 3.095 1.00 0.00 N ATOM 228 CA VAL A 18 7.999 -7.165 2.967 1.00 0.00 C ATOM 229 C VAL A 18 7.759 -5.753 3.499 1.00 0.00 C ATOM 230 O VAL A 18 8.196 -5.432 4.607 1.00 0.00 O ATOM 231 CB VAL A 18 7.142 -8.207 3.730 1.00 0.00 C ATOM 232 CG1 VAL A 18 5.648 -8.022 3.417 1.00 0.00 C ATOM 233 CG2 VAL A 18 7.503 -9.667 3.400 1.00 0.00 C ATOM 0 H VAL A 18 9.857 -7.050 3.923 1.00 0.00 H new ATOM 0 HA VAL A 18 7.700 -7.220 1.920 1.00 0.00 H new ATOM 0 HB VAL A 18 7.355 -8.027 4.784 1.00 0.00 H new ATOM 0 HG11 VAL A 18 5.067 -8.765 3.964 1.00 0.00 H new ATOM 0 HG12 VAL A 18 5.334 -7.022 3.718 1.00 0.00 H new ATOM 0 HG13 VAL A 18 5.482 -8.148 2.347 1.00 0.00 H new ATOM 0 HG21 VAL A 18 6.862 -10.338 3.971 1.00 0.00 H new ATOM 0 HG22 VAL A 18 7.358 -9.846 2.335 1.00 0.00 H new ATOM 0 HG23 VAL A 18 8.545 -9.852 3.660 1.00 0.00 H new ATOM 243 N LYS A 19 7.056 -4.922 2.719 1.00 0.00 N ATOM 244 CA LYS A 19 6.714 -3.520 2.992 1.00 0.00 C ATOM 245 C LYS A 19 7.869 -2.716 3.605 1.00 0.00 C ATOM 246 O LYS A 19 7.632 -1.850 4.443 1.00 0.00 O ATOM 247 CB LYS A 19 5.360 -3.410 3.738 1.00 0.00 C ATOM 248 CG LYS A 19 5.347 -3.983 5.167 1.00 0.00 C ATOM 249 CD LYS A 19 3.959 -3.999 5.830 1.00 0.00 C ATOM 250 CE LYS A 19 3.332 -2.626 6.126 1.00 0.00 C ATOM 251 NZ LYS A 19 3.984 -1.888 7.239 1.00 0.00 N ATOM 0 H LYS A 19 6.686 -5.232 1.820 1.00 0.00 H new ATOM 0 HA LYS A 19 6.560 -3.024 2.034 1.00 0.00 H new ATOM 0 HB2 LYS A 19 5.073 -2.359 3.783 1.00 0.00 H new ATOM 0 HB3 LYS A 19 4.598 -3.924 3.151 1.00 0.00 H new ATOM 0 HG2 LYS A 19 5.736 -5.001 5.141 1.00 0.00 H new ATOM 0 HG3 LYS A 19 6.026 -3.398 5.787 1.00 0.00 H new ATOM 0 HD2 LYS A 19 3.278 -4.555 5.186 1.00 0.00 H new ATOM 0 HD3 LYS A 19 4.033 -4.551 6.767 1.00 0.00 H new ATOM 0 HE2 LYS A 19 3.378 -2.016 5.224 1.00 0.00 H new ATOM 0 HE3 LYS A 19 2.277 -2.764 6.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 3.310 -1.209 7.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 4.285 -2.561 7.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 4.814 -1.377 6.877 1.00 0.00 H new ATOM 265 N SER A 20 9.108 -3.007 3.209 1.00 0.00 N ATOM 266 CA SER A 20 10.340 -2.487 3.797 1.00 0.00 C ATOM 267 C SER A 20 11.314 -2.124 2.674 1.00 0.00 C ATOM 268 O SER A 20 11.075 -2.462 1.510 1.00 0.00 O ATOM 269 CB SER A 20 10.938 -3.550 4.727 1.00 0.00 C ATOM 270 OG SER A 20 10.039 -3.827 5.780 1.00 0.00 O ATOM 0 H SER A 20 9.287 -3.643 2.432 1.00 0.00 H new ATOM 0 HA SER A 20 10.138 -1.590 4.383 1.00 0.00 H new ATOM 0 HB2 SER A 20 11.146 -4.461 4.166 1.00 0.00 H new ATOM 0 HB3 SER A 20 11.888 -3.200 5.131 1.00 0.00 H new ATOM 0 HG SER A 20 9.349 -4.448 5.466 1.00 0.00 H new ATOM 276 N THR A 21 12.417 -1.460 3.015 1.00 0.00 N ATOM 277 CA THR A 21 13.383 -0.928 2.058 1.00 0.00 C ATOM 278 C THR A 21 14.731 -1.619 2.280 1.00 0.00 C ATOM 279 O THR A 21 15.111 -1.875 3.422 1.00 0.00 O ATOM 280 CB THR A 21 13.451 0.602 2.249 1.00 0.00 C ATOM 281 OG1 THR A 21 12.159 1.167 2.106 1.00 0.00 O ATOM 282 CG2 THR A 21 14.370 1.290 1.234 1.00 0.00 C ATOM 0 H THR A 21 12.669 -1.273 3.986 1.00 0.00 H new ATOM 0 HA THR A 21 13.090 -1.124 1.027 1.00 0.00 H new ATOM 0 HB THR A 21 13.852 0.764 3.249 1.00 0.00 H new ATOM 0 HG1 THR A 21 12.211 2.138 2.230 1.00 0.00 H new ATOM 0 HG21 THR A 21 14.377 2.364 1.419 1.00 0.00 H new ATOM 0 HG22 THR A 21 15.382 0.898 1.335 1.00 0.00 H new ATOM 0 HG23 THR A 21 14.006 1.098 0.225 1.00 0.00 H new ATOM 290 N ALA A 22 15.481 -1.903 1.215 1.00 0.00 N ATOM 291 CA ALA A 22 16.806 -2.492 1.312 1.00 0.00 C ATOM 292 C ALA A 22 17.693 -1.851 0.258 1.00 0.00 C ATOM 293 O ALA A 22 17.437 -2.002 -0.938 1.00 0.00 O ATOM 294 CB ALA A 22 16.726 -4.015 1.129 1.00 0.00 C ATOM 0 H ALA A 22 15.179 -1.728 0.257 1.00 0.00 H new ATOM 0 HA ALA A 22 17.232 -2.308 2.298 1.00 0.00 H new ATOM 0 HB1 ALA A 22 17.725 -4.443 1.204 1.00 0.00 H new ATOM 0 HB2 ALA A 22 16.089 -4.442 1.904 1.00 0.00 H new ATOM 0 HB3 ALA A 22 16.306 -4.242 0.149 1.00 0.00 H new ATOM 300 N THR A 23 18.757 -1.182 0.694 1.00 0.00 N ATOM 301 CA THR A 23 19.679 -0.475 -0.182 1.00 0.00 C ATOM 302 C THR A 23 21.088 -1.045 -0.004 1.00 0.00 C ATOM 303 O THR A 23 21.720 -0.876 1.039 1.00 0.00 O ATOM 304 CB THR A 23 19.558 1.037 0.067 1.00 0.00 C ATOM 305 OG1 THR A 23 18.213 1.434 -0.149 1.00 0.00 O ATOM 306 CG2 THR A 23 20.440 1.864 -0.874 1.00 0.00 C ATOM 0 H THR A 23 19.004 -1.117 1.681 1.00 0.00 H new ATOM 0 HA THR A 23 19.430 -0.625 -1.233 1.00 0.00 H new ATOM 0 HB THR A 23 19.882 1.218 1.092 1.00 0.00 H new ATOM 0 HG1 THR A 23 18.127 2.397 0.009 1.00 0.00 H new ATOM 0 HG21 THR A 23 20.314 2.924 -0.653 1.00 0.00 H new ATOM 0 HG22 THR A 23 21.484 1.585 -0.733 1.00 0.00 H new ATOM 0 HG23 THR A 23 20.150 1.672 -1.907 1.00 0.00 H new ATOM 314 N ASN A 24 21.559 -1.718 -1.059 1.00 0.00 N ATOM 315 CA ASN A 24 22.828 -2.428 -1.185 1.00 0.00 C ATOM 316 C ASN A 24 23.224 -3.242 0.050 1.00 0.00 C ATOM 317 O ASN A 24 24.360 -3.175 0.521 1.00 0.00 O ATOM 318 CB ASN A 24 23.922 -1.497 -1.725 1.00 0.00 C ATOM 319 CG ASN A 24 25.114 -2.300 -2.233 1.00 0.00 C ATOM 320 OD1 ASN A 24 26.227 -2.147 -1.741 1.00 0.00 O ATOM 321 ND2 ASN A 24 24.919 -3.163 -3.221 1.00 0.00 N ATOM 0 H ASN A 24 21.012 -1.783 -1.918 1.00 0.00 H new ATOM 0 HA ASN A 24 22.687 -3.206 -1.935 1.00 0.00 H new ATOM 0 HB2 ASN A 24 23.519 -0.885 -2.532 1.00 0.00 H new ATOM 0 HB3 ASN A 24 24.246 -0.815 -0.939 1.00 0.00 H new ATOM 0 HD21 ASN A 24 25.700 -3.710 -3.582 1.00 0.00 H new ATOM 0 HD22 ASN A 24 23.988 -3.279 -3.620 1.00 0.00 H new ATOM 328 N CYS A 25 22.273 -4.011 0.578 1.00 0.00 N ATOM 329 CA CYS A 25 22.496 -4.933 1.678 1.00 0.00 C ATOM 330 C CYS A 25 22.749 -6.341 1.147 1.00 0.00 C ATOM 331 O CYS A 25 22.540 -6.622 -0.035 1.00 0.00 O ATOM 332 CB CYS A 25 21.278 -4.924 2.610 1.00 0.00 C ATOM 333 SG CYS A 25 21.202 -3.459 3.657 1.00 0.00 S ATOM 0 H CYS A 25 21.310 -4.007 0.243 1.00 0.00 H new ATOM 0 HA CYS A 25 23.376 -4.616 2.238 1.00 0.00 H new ATOM 0 HB2 CYS A 25 20.369 -4.983 2.011 1.00 0.00 H new ATOM 0 HB3 CYS A 25 21.303 -5.813 3.240 1.00 0.00 H new ATOM 338 N TYR A 26 23.126 -7.235 2.057 1.00 0.00 N ATOM 339 CA TYR A 26 23.256 -8.661 1.821 1.00 0.00 C ATOM 340 C TYR A 26 22.430 -9.328 2.915 1.00 0.00 C ATOM 341 O TYR A 26 22.634 -9.056 4.101 1.00 0.00 O ATOM 342 CB TYR A 26 24.733 -9.069 1.887 1.00 0.00 C ATOM 343 CG TYR A 26 25.662 -8.263 0.996 1.00 0.00 C ATOM 344 CD1 TYR A 26 25.821 -8.600 -0.362 1.00 0.00 C ATOM 345 CD2 TYR A 26 26.371 -7.169 1.531 1.00 0.00 C ATOM 346 CE1 TYR A 26 26.689 -7.855 -1.182 1.00 0.00 C ATOM 347 CE2 TYR A 26 27.240 -6.420 0.719 1.00 0.00 C ATOM 348 CZ TYR A 26 27.407 -6.762 -0.643 1.00 0.00 C ATOM 349 OH TYR A 26 28.262 -6.035 -1.421 1.00 0.00 O ATOM 0 H TYR A 26 23.357 -6.971 3.015 1.00 0.00 H new ATOM 0 HA TYR A 26 22.902 -8.959 0.834 1.00 0.00 H new ATOM 0 HB2 TYR A 26 25.074 -8.978 2.918 1.00 0.00 H new ATOM 0 HB3 TYR A 26 24.816 -10.121 1.616 1.00 0.00 H new ATOM 0 HD1 TYR A 26 25.274 -9.434 -0.776 1.00 0.00 H new ATOM 0 HD2 TYR A 26 26.246 -6.905 2.571 1.00 0.00 H new ATOM 0 HE1 TYR A 26 26.807 -8.118 -2.223 1.00 0.00 H new ATOM 0 HE2 TYR A 26 27.780 -5.583 1.135 1.00 0.00 H new ATOM 0 HH TYR A 26 27.947 -6.044 -2.349 1.00 0.00 H new ATOM 359 N ILE A 27 21.467 -10.157 2.522 1.00 0.00 N ATOM 360 CA ILE A 27 20.453 -10.703 3.409 1.00 0.00 C ATOM 361 C ILE A 27 20.484 -12.217 3.190 1.00 0.00 C ATOM 362 O ILE A 27 20.093 -12.705 2.124 1.00 0.00 O ATOM 363 CB ILE A 27 19.102 -9.997 3.105 1.00 0.00 C ATOM 364 CG1 ILE A 27 19.222 -8.468 3.351 1.00 0.00 C ATOM 365 CG2 ILE A 27 17.936 -10.600 3.899 1.00 0.00 C ATOM 366 CD1 ILE A 27 17.914 -7.666 3.273 1.00 0.00 C ATOM 0 H ILE A 27 21.371 -10.473 1.557 1.00 0.00 H new ATOM 0 HA ILE A 27 20.622 -10.524 4.471 1.00 0.00 H new ATOM 0 HB ILE A 27 18.877 -10.163 2.051 1.00 0.00 H new ATOM 0 HG12 ILE A 27 19.661 -8.313 4.336 1.00 0.00 H new ATOM 0 HG13 ILE A 27 19.920 -8.057 2.622 1.00 0.00 H new ATOM 0 HG21 ILE A 27 17.015 -10.072 3.651 1.00 0.00 H new ATOM 0 HG22 ILE A 27 17.829 -11.655 3.645 1.00 0.00 H new ATOM 0 HG23 ILE A 27 18.134 -10.503 4.966 1.00 0.00 H new ATOM 0 HD11 ILE A 27 18.121 -6.613 3.461 1.00 0.00 H new ATOM 0 HD12 ILE A 27 17.477 -7.778 2.281 1.00 0.00 H new ATOM 0 HD13 ILE A 27 17.214 -8.038 4.022 1.00 0.00 H new ATOM 378 N ASP A 28 21.010 -12.947 4.176 1.00 0.00 N ATOM 379 CA ASP A 28 21.260 -14.384 4.136 1.00 0.00 C ATOM 380 C ASP A 28 20.318 -15.066 5.120 1.00 0.00 C ATOM 381 O ASP A 28 20.386 -14.786 6.316 1.00 0.00 O ATOM 382 CB ASP A 28 22.721 -14.680 4.495 1.00 0.00 C ATOM 383 CG ASP A 28 22.941 -16.190 4.686 1.00 0.00 C ATOM 384 OD1 ASP A 28 22.698 -16.963 3.734 1.00 0.00 O ATOM 385 OD2 ASP A 28 23.390 -16.609 5.776 1.00 0.00 O ATOM 0 H ASP A 28 21.285 -12.529 5.065 1.00 0.00 H new ATOM 0 HA ASP A 28 21.079 -14.765 3.131 1.00 0.00 H new ATOM 0 HB2 ASP A 28 23.376 -14.309 3.707 1.00 0.00 H new ATOM 0 HB3 ASP A 28 22.990 -14.150 5.409 1.00 0.00 H new ATOM 390 N ASN A 29 19.427 -15.930 4.626 1.00 0.00 N ATOM 391 CA ASN A 29 18.329 -16.571 5.368 1.00 0.00 C ATOM 392 C ASN A 29 17.598 -15.633 6.352 1.00 0.00 C ATOM 393 O ASN A 29 17.174 -16.061 7.431 1.00 0.00 O ATOM 394 CB ASN A 29 18.838 -17.851 6.058 1.00 0.00 C ATOM 395 CG ASN A 29 17.687 -18.813 6.341 1.00 0.00 C ATOM 396 OD1 ASN A 29 17.043 -19.284 5.410 1.00 0.00 O ATOM 397 ND2 ASN A 29 17.400 -19.166 7.583 1.00 0.00 N ATOM 0 H ASN A 29 19.450 -16.218 3.648 1.00 0.00 H new ATOM 0 HA ASN A 29 17.569 -16.839 4.634 1.00 0.00 H new ATOM 0 HB2 ASN A 29 19.578 -18.340 5.425 1.00 0.00 H new ATOM 0 HB3 ASN A 29 19.338 -17.591 6.991 1.00 0.00 H new ATOM 0 HD21 ASN A 29 16.645 -19.828 7.764 1.00 0.00 H new ATOM 0 HD22 ASN A 29 17.933 -18.776 8.360 1.00 0.00 H new ATOM 404 N SER A 30 17.469 -14.347 6.015 1.00 0.00 N ATOM 405 CA SER A 30 17.009 -13.314 6.930 1.00 0.00 C ATOM 406 C SER A 30 15.724 -12.644 6.448 1.00 0.00 C ATOM 407 O SER A 30 15.425 -12.574 5.255 1.00 0.00 O ATOM 408 CB SER A 30 18.128 -12.299 7.162 1.00 0.00 C ATOM 409 OG SER A 30 19.219 -12.903 7.821 1.00 0.00 O ATOM 0 H SER A 30 17.686 -13.995 5.083 1.00 0.00 H new ATOM 0 HA SER A 30 16.761 -13.785 7.881 1.00 0.00 H new ATOM 0 HB2 SER A 30 18.456 -11.887 6.208 1.00 0.00 H new ATOM 0 HB3 SER A 30 17.753 -11.466 7.757 1.00 0.00 H new ATOM 0 HG SER A 30 19.758 -13.402 7.172 1.00 0.00 H new ATOM 415 N GLN A 31 14.956 -12.148 7.414 1.00 0.00 N ATOM 416 CA GLN A 31 13.603 -11.663 7.239 1.00 0.00 C ATOM 417 C GLN A 31 13.592 -10.175 7.589 1.00 0.00 C ATOM 418 O GLN A 31 14.008 -9.797 8.687 1.00 0.00 O ATOM 419 CB GLN A 31 12.696 -12.478 8.178 1.00 0.00 C ATOM 420 CG GLN A 31 12.411 -13.923 7.725 1.00 0.00 C ATOM 421 CD GLN A 31 13.629 -14.811 7.429 1.00 0.00 C ATOM 422 OE1 GLN A 31 13.827 -15.245 6.300 1.00 0.00 O ATOM 423 NE2 GLN A 31 14.483 -15.093 8.404 1.00 0.00 N ATOM 0 H GLN A 31 15.279 -12.073 8.378 1.00 0.00 H new ATOM 0 HA GLN A 31 13.243 -11.779 6.217 1.00 0.00 H new ATOM 0 HB2 GLN A 31 13.156 -12.508 9.166 1.00 0.00 H new ATOM 0 HB3 GLN A 31 11.746 -11.954 8.285 1.00 0.00 H new ATOM 0 HG2 GLN A 31 11.816 -14.410 8.498 1.00 0.00 H new ATOM 0 HG3 GLN A 31 11.795 -13.882 6.827 1.00 0.00 H new ATOM 0 HE21 GLN A 31 14.320 -14.733 9.344 1.00 0.00 H new ATOM 0 HE22 GLN A 31 15.302 -15.670 8.213 1.00 0.00 H new ATOM 432 N LEU A 32 13.125 -9.336 6.663 1.00 0.00 N ATOM 433 CA LEU A 32 13.107 -7.878 6.819 1.00 0.00 C ATOM 434 C LEU A 32 11.689 -7.379 6.554 1.00 0.00 C ATOM 435 O LEU A 32 11.283 -7.284 5.396 1.00 0.00 O ATOM 436 CB LEU A 32 14.125 -7.265 5.839 1.00 0.00 C ATOM 437 CG LEU A 32 14.157 -5.726 5.862 1.00 0.00 C ATOM 438 CD1 LEU A 32 14.664 -5.215 7.213 1.00 0.00 C ATOM 439 CD2 LEU A 32 15.035 -5.202 4.720 1.00 0.00 C ATOM 0 H LEU A 32 12.743 -9.653 5.772 1.00 0.00 H new ATOM 0 HA LEU A 32 13.389 -7.581 7.829 1.00 0.00 H new ATOM 0 HB2 LEU A 32 15.119 -7.644 6.077 1.00 0.00 H new ATOM 0 HB3 LEU A 32 13.890 -7.600 4.829 1.00 0.00 H new ATOM 0 HG LEU A 32 13.142 -5.354 5.721 1.00 0.00 H new ATOM 0 HD11 LEU A 32 14.679 -4.125 7.208 1.00 0.00 H new ATOM 0 HD12 LEU A 32 14.003 -5.565 8.006 1.00 0.00 H new ATOM 0 HD13 LEU A 32 15.672 -5.590 7.389 1.00 0.00 H new ATOM 0 HD21 LEU A 32 15.052 -4.112 4.744 1.00 0.00 H new ATOM 0 HD22 LEU A 32 16.050 -5.583 4.837 1.00 0.00 H new ATOM 0 HD23 LEU A 32 14.629 -5.537 3.766 1.00 0.00 H new ATOM 451 N VAL A 33 10.927 -7.045 7.593 1.00 0.00 N ATOM 452 CA VAL A 33 9.498 -6.796 7.433 1.00 0.00 C ATOM 453 C VAL A 33 9.021 -5.513 8.115 1.00 0.00 C ATOM 454 O VAL A 33 9.713 -4.925 8.953 1.00 0.00 O ATOM 455 CB VAL A 33 8.709 -8.043 7.907 1.00 0.00 C ATOM 456 CG1 VAL A 33 9.092 -9.306 7.113 1.00 0.00 C ATOM 457 CG2 VAL A 33 8.874 -8.343 9.406 1.00 0.00 C ATOM 0 H VAL A 33 11.272 -6.941 8.547 1.00 0.00 H new ATOM 0 HA VAL A 33 9.303 -6.628 6.374 1.00 0.00 H new ATOM 0 HB VAL A 33 7.665 -7.789 7.722 1.00 0.00 H new ATOM 0 HG11 VAL A 33 8.515 -10.155 7.479 1.00 0.00 H new ATOM 0 HG12 VAL A 33 8.877 -9.150 6.056 1.00 0.00 H new ATOM 0 HG13 VAL A 33 10.155 -9.508 7.241 1.00 0.00 H new ATOM 0 HG21 VAL A 33 8.294 -9.229 9.666 1.00 0.00 H new ATOM 0 HG22 VAL A 33 9.926 -8.520 9.628 1.00 0.00 H new ATOM 0 HG23 VAL A 33 8.519 -7.493 9.988 1.00 0.00 H new ATOM 467 N ASP A 34 7.790 -5.130 7.765 1.00 0.00 N ATOM 468 CA ASP A 34 6.997 -4.088 8.405 1.00 0.00 C ATOM 469 C ASP A 34 7.698 -2.729 8.487 1.00 0.00 C ATOM 470 O ASP A 34 8.039 -2.267 9.569 1.00 0.00 O ATOM 471 CB ASP A 34 6.482 -4.598 9.754 1.00 0.00 C ATOM 472 CG ASP A 34 5.546 -3.595 10.427 1.00 0.00 C ATOM 473 OD1 ASP A 34 4.734 -2.951 9.721 1.00 0.00 O ATOM 474 OD2 ASP A 34 5.597 -3.514 11.678 1.00 0.00 O ATOM 0 H ASP A 34 7.297 -5.565 6.985 1.00 0.00 H new ATOM 0 HA ASP A 34 6.139 -3.881 7.766 1.00 0.00 H new ATOM 0 HB2 ASP A 34 5.957 -5.542 9.608 1.00 0.00 H new ATOM 0 HB3 ASP A 34 7.327 -4.802 10.411 1.00 0.00 H new ATOM 479 N THR A 35 7.909 -2.075 7.345 1.00 0.00 N ATOM 480 CA THR A 35 8.499 -0.753 7.230 1.00 0.00 C ATOM 481 C THR A 35 9.868 -0.625 7.915 1.00 0.00 C ATOM 482 O THR A 35 10.188 0.390 8.541 1.00 0.00 O ATOM 483 CB THR A 35 7.463 0.323 7.588 1.00 0.00 C ATOM 484 OG1 THR A 35 6.135 -0.063 7.251 1.00 0.00 O ATOM 485 CG2 THR A 35 7.761 1.606 6.808 1.00 0.00 C ATOM 0 H THR A 35 7.661 -2.474 6.440 1.00 0.00 H new ATOM 0 HA THR A 35 8.760 -0.579 6.186 1.00 0.00 H new ATOM 0 HB THR A 35 7.533 0.470 8.666 1.00 0.00 H new ATOM 0 HG1 THR A 35 5.513 0.653 7.499 1.00 0.00 H new ATOM 0 HG21 THR A 35 7.024 2.367 7.064 1.00 0.00 H new ATOM 0 HG22 THR A 35 8.758 1.965 7.065 1.00 0.00 H new ATOM 0 HG23 THR A 35 7.714 1.401 5.739 1.00 0.00 H new ATOM 493 N SER A 36 10.688 -1.668 7.803 1.00 0.00 N ATOM 494 CA SER A 36 12.084 -1.597 8.185 1.00 0.00 C ATOM 495 C SER A 36 12.872 -0.961 7.034 1.00 0.00 C ATOM 496 O SER A 36 12.366 -0.818 5.913 1.00 0.00 O ATOM 497 CB SER A 36 12.617 -3.003 8.447 1.00 0.00 C ATOM 498 OG SER A 36 11.986 -3.600 9.553 1.00 0.00 O ATOM 0 H SER A 36 10.399 -2.579 7.446 1.00 0.00 H new ATOM 0 HA SER A 36 12.192 -1.000 9.091 1.00 0.00 H new ATOM 0 HB2 SER A 36 12.463 -3.621 7.563 1.00 0.00 H new ATOM 0 HB3 SER A 36 13.692 -2.958 8.622 1.00 0.00 H new ATOM 0 HG SER A 36 11.054 -3.804 9.328 1.00 0.00 H new ATOM 504 N ILE A 37 14.139 -0.636 7.283 1.00 0.00 N ATOM 505 CA ILE A 37 15.067 -0.230 6.236 1.00 0.00 C ATOM 506 C ILE A 37 16.454 -0.801 6.509 1.00 0.00 C ATOM 507 O ILE A 37 16.911 -0.802 7.653 1.00 0.00 O ATOM 508 CB ILE A 37 15.055 1.298 6.017 1.00 0.00 C ATOM 509 CG1 ILE A 37 15.998 1.699 4.857 1.00 0.00 C ATOM 510 CG2 ILE A 37 15.361 2.103 7.280 1.00 0.00 C ATOM 511 CD1 ILE A 37 15.739 3.105 4.303 1.00 0.00 C ATOM 0 H ILE A 37 14.549 -0.648 8.217 1.00 0.00 H new ATOM 0 HA ILE A 37 14.735 -0.652 5.288 1.00 0.00 H new ATOM 0 HB ILE A 37 14.031 1.554 5.743 1.00 0.00 H new ATOM 0 HG12 ILE A 37 17.030 1.640 5.204 1.00 0.00 H new ATOM 0 HG13 ILE A 37 15.892 0.975 4.049 1.00 0.00 H new ATOM 0 HG21 ILE A 37 15.335 3.168 7.048 1.00 0.00 H new ATOM 0 HG22 ILE A 37 14.616 1.879 8.043 1.00 0.00 H new ATOM 0 HG23 ILE A 37 16.351 1.837 7.650 1.00 0.00 H new ATOM 0 HD11 ILE A 37 16.439 3.312 3.494 1.00 0.00 H new ATOM 0 HD12 ILE A 37 14.719 3.164 3.924 1.00 0.00 H new ATOM 0 HD13 ILE A 37 15.875 3.840 5.097 1.00 0.00 H new ATOM 523 N CYS A 38 17.124 -1.247 5.446 1.00 0.00 N ATOM 524 CA CYS A 38 18.480 -1.754 5.470 1.00 0.00 C ATOM 525 C CYS A 38 19.308 -0.867 4.546 1.00 0.00 C ATOM 526 O CYS A 38 18.849 -0.562 3.442 1.00 0.00 O ATOM 527 CB CYS A 38 18.470 -3.214 4.994 1.00 0.00 C ATOM 528 SG CYS A 38 20.040 -4.075 5.207 1.00 0.00 S ATOM 0 H CYS A 38 16.713 -1.262 4.512 1.00 0.00 H new ATOM 0 HA CYS A 38 18.910 -1.734 6.471 1.00 0.00 H new ATOM 0 HB2 CYS A 38 17.695 -3.756 5.537 1.00 0.00 H new ATOM 0 HB3 CYS A 38 18.196 -3.238 3.939 1.00 0.00 H new ATOM 533 N THR A 39 20.518 -0.487 4.959 1.00 0.00 N ATOM 534 CA THR A 39 21.385 0.398 4.194 1.00 0.00 C ATOM 535 C THR A 39 22.822 -0.100 4.363 1.00 0.00 C ATOM 536 O THR A 39 23.354 -0.062 5.475 1.00 0.00 O ATOM 537 CB THR A 39 21.220 1.860 4.677 1.00 0.00 C ATOM 538 OG1 THR A 39 19.928 2.128 5.196 1.00 0.00 O ATOM 539 CG2 THR A 39 21.502 2.851 3.543 1.00 0.00 C ATOM 0 H THR A 39 20.924 -0.791 5.844 1.00 0.00 H new ATOM 0 HA THR A 39 21.120 0.386 3.137 1.00 0.00 H new ATOM 0 HB THR A 39 21.946 1.987 5.480 1.00 0.00 H new ATOM 0 HG1 THR A 39 19.845 1.731 6.088 1.00 0.00 H new ATOM 0 HG21 THR A 39 21.379 3.870 3.911 1.00 0.00 H new ATOM 0 HG22 THR A 39 22.523 2.715 3.187 1.00 0.00 H new ATOM 0 HG23 THR A 39 20.805 2.674 2.724 1.00 0.00 H new ATOM 547 N ARG A 40 23.436 -0.597 3.283 1.00 0.00 N ATOM 548 CA ARG A 40 24.812 -1.110 3.217 1.00 0.00 C ATOM 549 C ARG A 40 25.171 -1.971 4.437 1.00 0.00 C ATOM 550 O ARG A 40 26.104 -1.662 5.175 1.00 0.00 O ATOM 551 CB ARG A 40 25.780 0.059 2.915 1.00 0.00 C ATOM 552 CG ARG A 40 27.234 -0.331 2.584 1.00 0.00 C ATOM 553 CD ARG A 40 27.393 -1.218 1.340 1.00 0.00 C ATOM 554 NE ARG A 40 28.777 -1.718 1.224 1.00 0.00 N ATOM 555 CZ ARG A 40 29.158 -2.779 0.500 1.00 0.00 C ATOM 556 NH1 ARG A 40 28.320 -3.341 -0.362 1.00 0.00 N ATOM 557 NH2 ARG A 40 30.378 -3.282 0.648 1.00 0.00 N ATOM 0 H ARG A 40 22.962 -0.656 2.382 1.00 0.00 H new ATOM 0 HA ARG A 40 24.911 -1.810 2.388 1.00 0.00 H new ATOM 0 HB2 ARG A 40 25.379 0.629 2.077 1.00 0.00 H new ATOM 0 HB3 ARG A 40 25.792 0.726 3.777 1.00 0.00 H new ATOM 0 HG2 ARG A 40 27.817 0.579 2.441 1.00 0.00 H new ATOM 0 HG3 ARG A 40 27.661 -0.851 3.442 1.00 0.00 H new ATOM 0 HD2 ARG A 40 26.702 -2.059 1.397 1.00 0.00 H new ATOM 0 HD3 ARG A 40 27.131 -0.650 0.447 1.00 0.00 H new ATOM 0 HE ARG A 40 29.502 -1.215 1.736 1.00 0.00 H new ATOM 0 HH11 ARG A 40 27.379 -2.965 -0.477 1.00 0.00 H new ATOM 0 HH12 ARG A 40 28.617 -4.149 -0.910 1.00 0.00 H new ATOM 0 HH21 ARG A 40 31.026 -2.861 1.313 1.00 0.00 H new ATOM 0 HH22 ARG A 40 30.667 -4.090 0.096 1.00 0.00 H new ATOM 571 N SER A 41 24.388 -3.025 4.682 1.00 0.00 N ATOM 572 CA SER A 41 24.461 -3.842 5.890 1.00 0.00 C ATOM 573 C SER A 41 24.363 -5.334 5.563 1.00 0.00 C ATOM 574 O SER A 41 24.059 -5.719 4.429 1.00 0.00 O ATOM 575 CB SER A 41 23.329 -3.425 6.832 1.00 0.00 C ATOM 576 OG SER A 41 23.482 -2.079 7.226 1.00 0.00 O ATOM 0 H SER A 41 23.670 -3.339 4.029 1.00 0.00 H new ATOM 0 HA SER A 41 25.426 -3.681 6.371 1.00 0.00 H new ATOM 0 HB2 SER A 41 22.368 -3.557 6.335 1.00 0.00 H new ATOM 0 HB3 SER A 41 23.325 -4.069 7.711 1.00 0.00 H new ATOM 0 HG SER A 41 23.309 -1.492 6.460 1.00 0.00 H new ATOM 582 N GLN A 42 24.597 -6.166 6.578 1.00 0.00 N ATOM 583 CA GLN A 42 24.592 -7.622 6.497 1.00 0.00 C ATOM 584 C GLN A 42 23.576 -8.151 7.505 1.00 0.00 C ATOM 585 O GLN A 42 23.624 -7.771 8.677 1.00 0.00 O ATOM 586 CB GLN A 42 26.006 -8.145 6.822 1.00 0.00 C ATOM 587 CG GLN A 42 26.143 -9.679 6.897 1.00 0.00 C ATOM 588 CD GLN A 42 25.970 -10.376 5.544 1.00 0.00 C ATOM 589 OE1 GLN A 42 26.671 -10.071 4.583 1.00 0.00 O ATOM 590 NE2 GLN A 42 25.059 -11.329 5.432 1.00 0.00 N ATOM 0 H GLN A 42 24.804 -5.827 7.517 1.00 0.00 H new ATOM 0 HA GLN A 42 24.318 -7.959 5.497 1.00 0.00 H new ATOM 0 HB2 GLN A 42 26.696 -7.772 6.065 1.00 0.00 H new ATOM 0 HB3 GLN A 42 26.321 -7.722 7.776 1.00 0.00 H new ATOM 0 HG2 GLN A 42 27.124 -9.929 7.302 1.00 0.00 H new ATOM 0 HG3 GLN A 42 25.401 -10.068 7.594 1.00 0.00 H new ATOM 0 HE21 GLN A 42 24.480 -11.578 6.234 1.00 0.00 H new ATOM 0 HE22 GLN A 42 24.936 -11.815 4.544 1.00 0.00 H new ATOM 599 N TYR A 43 22.720 -9.075 7.074 1.00 0.00 N ATOM 600 CA TYR A 43 21.836 -9.843 7.941 1.00 0.00 C ATOM 601 C TYR A 43 22.118 -11.313 7.652 1.00 0.00 C ATOM 602 O TYR A 43 22.220 -11.684 6.478 1.00 0.00 O ATOM 603 CB TYR A 43 20.357 -9.554 7.648 1.00 0.00 C ATOM 604 CG TYR A 43 19.846 -8.126 7.753 1.00 0.00 C ATOM 605 CD1 TYR A 43 20.403 -7.194 8.650 1.00 0.00 C ATOM 606 CD2 TYR A 43 18.736 -7.751 6.976 1.00 0.00 C ATOM 607 CE1 TYR A 43 19.845 -5.912 8.781 1.00 0.00 C ATOM 608 CE2 TYR A 43 18.188 -6.466 7.085 1.00 0.00 C ATOM 609 CZ TYR A 43 18.721 -5.543 8.014 1.00 0.00 C ATOM 610 OH TYR A 43 18.152 -4.318 8.194 1.00 0.00 O ATOM 0 H TYR A 43 22.621 -9.315 6.087 1.00 0.00 H new ATOM 0 HA TYR A 43 22.019 -9.577 8.982 1.00 0.00 H new ATOM 0 HB2 TYR A 43 20.148 -9.904 6.637 1.00 0.00 H new ATOM 0 HB3 TYR A 43 19.762 -10.166 8.326 1.00 0.00 H new ATOM 0 HD1 TYR A 43 21.265 -7.467 9.241 1.00 0.00 H new ATOM 0 HD2 TYR A 43 18.301 -8.461 6.288 1.00 0.00 H new ATOM 0 HE1 TYR A 43 20.279 -5.205 9.473 1.00 0.00 H new ATOM 0 HE2 TYR A 43 17.357 -6.180 6.458 1.00 0.00 H new ATOM 0 HH TYR A 43 18.674 -3.641 7.714 1.00 0.00 H new ATOM 620 N SER A 44 22.230 -12.135 8.691 1.00 0.00 N ATOM 621 CA SER A 44 22.565 -13.540 8.573 1.00 0.00 C ATOM 622 C SER A 44 21.723 -14.322 9.584 1.00 0.00 C ATOM 623 O SER A 44 21.871 -14.149 10.796 1.00 0.00 O ATOM 624 CB SER A 44 24.069 -13.725 8.816 1.00 0.00 C ATOM 625 OG SER A 44 24.839 -12.894 7.955 1.00 0.00 O ATOM 0 H SER A 44 22.087 -11.832 9.654 1.00 0.00 H new ATOM 0 HA SER A 44 22.344 -13.915 7.574 1.00 0.00 H new ATOM 0 HB2 SER A 44 24.303 -13.492 9.855 1.00 0.00 H new ATOM 0 HB3 SER A 44 24.340 -14.769 8.655 1.00 0.00 H new ATOM 0 HG SER A 44 25.793 -13.032 8.134 1.00 0.00 H new ATOM 631 N ASP A 45 20.840 -15.180 9.071 1.00 0.00 N ATOM 632 CA ASP A 45 19.841 -15.962 9.799 1.00 0.00 C ATOM 633 C ASP A 45 19.097 -15.151 10.874 1.00 0.00 C ATOM 634 O ASP A 45 18.935 -15.595 12.013 1.00 0.00 O ATOM 635 CB ASP A 45 20.469 -17.263 10.321 1.00 0.00 C ATOM 636 CG ASP A 45 19.397 -18.247 10.820 1.00 0.00 C ATOM 637 OD1 ASP A 45 18.401 -18.459 10.094 1.00 0.00 O ATOM 638 OD2 ASP A 45 19.581 -18.873 11.889 1.00 0.00 O ATOM 0 H ASP A 45 20.802 -15.359 8.067 1.00 0.00 H new ATOM 0 HA ASP A 45 19.053 -16.240 9.099 1.00 0.00 H new ATOM 0 HB2 ASP A 45 21.052 -17.730 9.528 1.00 0.00 H new ATOM 0 HB3 ASP A 45 21.160 -17.034 11.132 1.00 0.00 H new ATOM 643 N ALA A 46 18.673 -13.931 10.526 1.00 0.00 N ATOM 644 CA ALA A 46 18.144 -12.934 11.453 1.00 0.00 C ATOM 645 C ALA A 46 16.726 -12.490 11.070 1.00 0.00 C ATOM 646 O ALA A 46 16.224 -12.813 9.991 1.00 0.00 O ATOM 647 CB ALA A 46 19.108 -11.740 11.471 1.00 0.00 C ATOM 0 H ALA A 46 18.691 -13.604 9.560 1.00 0.00 H new ATOM 0 HA ALA A 46 18.068 -13.373 12.448 1.00 0.00 H new ATOM 0 HB1 ALA A 46 18.734 -10.981 12.157 1.00 0.00 H new ATOM 0 HB2 ALA A 46 20.093 -12.072 11.799 1.00 0.00 H new ATOM 0 HB3 ALA A 46 19.183 -11.318 10.469 1.00 0.00 H new ATOM 653 N ASN A 47 16.077 -11.716 11.943 1.00 0.00 N ATOM 654 CA ASN A 47 14.752 -11.147 11.696 1.00 0.00 C ATOM 655 C ASN A 47 14.726 -9.700 12.163 1.00 0.00 C ATOM 656 O ASN A 47 15.296 -9.367 13.201 1.00 0.00 O ATOM 657 CB ASN A 47 13.679 -11.953 12.432 1.00 0.00 C ATOM 658 CG ASN A 47 12.269 -11.395 12.260 1.00 0.00 C ATOM 659 OD1 ASN A 47 11.912 -10.866 11.212 1.00 0.00 O ATOM 660 ND2 ASN A 47 11.438 -11.509 13.282 1.00 0.00 N ATOM 0 H ASN A 47 16.463 -11.464 12.853 1.00 0.00 H new ATOM 0 HA ASN A 47 14.542 -11.187 10.627 1.00 0.00 H new ATOM 0 HB2 ASN A 47 13.700 -12.982 12.073 1.00 0.00 H new ATOM 0 HB3 ASN A 47 13.922 -11.981 13.494 1.00 0.00 H new ATOM 0 HD21 ASN A 47 10.485 -11.155 13.206 1.00 0.00 H new ATOM 0 HD22 ASN A 47 11.750 -11.951 14.146 1.00 0.00 H new ATOM 667 N VAL A 48 14.068 -8.846 11.395 1.00 0.00 N ATOM 668 CA VAL A 48 14.080 -7.400 11.561 1.00 0.00 C ATOM 669 C VAL A 48 12.661 -6.890 11.296 1.00 0.00 C ATOM 670 O VAL A 48 12.076 -7.220 10.261 1.00 0.00 O ATOM 671 CB VAL A 48 15.132 -6.785 10.604 1.00 0.00 C ATOM 672 CG1 VAL A 48 15.260 -5.274 10.826 1.00 0.00 C ATOM 673 CG2 VAL A 48 16.536 -7.400 10.762 1.00 0.00 C ATOM 0 H VAL A 48 13.491 -9.151 10.611 1.00 0.00 H new ATOM 0 HA VAL A 48 14.366 -7.106 12.571 1.00 0.00 H new ATOM 0 HB VAL A 48 14.766 -7.005 9.601 1.00 0.00 H new ATOM 0 HG11 VAL A 48 16.005 -4.868 10.142 1.00 0.00 H new ATOM 0 HG12 VAL A 48 14.298 -4.796 10.641 1.00 0.00 H new ATOM 0 HG13 VAL A 48 15.568 -5.082 11.854 1.00 0.00 H new ATOM 0 HG21 VAL A 48 17.223 -6.924 10.062 1.00 0.00 H new ATOM 0 HG22 VAL A 48 16.889 -7.243 11.781 1.00 0.00 H new ATOM 0 HG23 VAL A 48 16.490 -8.469 10.554 1.00 0.00 H new ATOM 683 N LYS A 49 12.110 -6.091 12.219 1.00 0.00 N ATOM 684 CA LYS A 49 10.739 -5.577 12.159 1.00 0.00 C ATOM 685 C LYS A 49 10.751 -4.094 12.500 1.00 0.00 C ATOM 686 O LYS A 49 11.305 -3.720 13.537 1.00 0.00 O ATOM 687 CB LYS A 49 9.850 -6.371 13.135 1.00 0.00 C ATOM 688 CG LYS A 49 8.422 -5.806 13.247 1.00 0.00 C ATOM 689 CD LYS A 49 7.539 -6.655 14.173 1.00 0.00 C ATOM 690 CE LYS A 49 6.205 -5.975 14.531 1.00 0.00 C ATOM 691 NZ LYS A 49 5.318 -5.726 13.365 1.00 0.00 N ATOM 0 H LYS A 49 12.618 -5.778 13.046 1.00 0.00 H new ATOM 0 HA LYS A 49 10.330 -5.698 11.156 1.00 0.00 H new ATOM 0 HB2 LYS A 49 9.799 -7.409 12.808 1.00 0.00 H new ATOM 0 HB3 LYS A 49 10.313 -6.370 14.122 1.00 0.00 H new ATOM 0 HG2 LYS A 49 8.465 -4.784 13.624 1.00 0.00 H new ATOM 0 HG3 LYS A 49 7.971 -5.762 12.256 1.00 0.00 H new ATOM 0 HD2 LYS A 49 7.334 -7.612 13.692 1.00 0.00 H new ATOM 0 HD3 LYS A 49 8.087 -6.870 15.090 1.00 0.00 H new ATOM 0 HE2 LYS A 49 5.674 -6.598 15.251 1.00 0.00 H new ATOM 0 HE3 LYS A 49 6.414 -5.026 15.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 4.336 -5.626 13.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 5.614 -4.853 12.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 5.383 -6.525 12.703 1.00 0.00 H new ATOM 705 N LYS A 50 10.105 -3.270 11.671 1.00 0.00 N ATOM 706 CA LYS A 50 10.055 -1.806 11.738 1.00 0.00 C ATOM 707 C LYS A 50 11.338 -1.177 12.295 1.00 0.00 C ATOM 708 O LYS A 50 11.274 -0.355 13.208 1.00 0.00 O ATOM 709 CB LYS A 50 8.765 -1.368 12.468 1.00 0.00 C ATOM 710 CG LYS A 50 8.351 0.064 12.084 1.00 0.00 C ATOM 711 CD LYS A 50 7.196 0.634 12.925 1.00 0.00 C ATOM 712 CE LYS A 50 5.783 0.230 12.469 1.00 0.00 C ATOM 713 NZ LYS A 50 5.342 -1.106 12.940 1.00 0.00 N ATOM 0 H LYS A 50 9.567 -3.631 10.883 1.00 0.00 H new ATOM 0 HA LYS A 50 10.009 -1.414 10.722 1.00 0.00 H new ATOM 0 HB2 LYS A 50 7.957 -2.058 12.224 1.00 0.00 H new ATOM 0 HB3 LYS A 50 8.919 -1.426 13.545 1.00 0.00 H new ATOM 0 HG2 LYS A 50 9.216 0.719 12.184 1.00 0.00 H new ATOM 0 HG3 LYS A 50 8.061 0.077 11.033 1.00 0.00 H new ATOM 0 HD2 LYS A 50 7.330 0.315 13.959 1.00 0.00 H new ATOM 0 HD3 LYS A 50 7.265 1.722 12.915 1.00 0.00 H new ATOM 0 HE2 LYS A 50 5.073 0.978 12.822 1.00 0.00 H new ATOM 0 HE3 LYS A 50 5.748 0.247 11.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 4.303 -1.148 12.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 5.718 -1.839 12.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 5.696 -1.268 13.904 1.00 0.00 H new ATOM 727 N SER A 51 12.508 -1.569 11.789 1.00 0.00 N ATOM 728 CA SER A 51 13.787 -1.159 12.354 1.00 0.00 C ATOM 729 C SER A 51 14.635 -0.516 11.267 1.00 0.00 C ATOM 730 O SER A 51 14.429 -0.764 10.080 1.00 0.00 O ATOM 731 CB SER A 51 14.480 -2.366 12.987 1.00 0.00 C ATOM 732 OG SER A 51 13.753 -2.822 14.112 1.00 0.00 O ATOM 0 H SER A 51 12.592 -2.179 10.976 1.00 0.00 H new ATOM 0 HA SER A 51 13.635 -0.419 13.140 1.00 0.00 H new ATOM 0 HB2 SER A 51 14.568 -3.168 12.254 1.00 0.00 H new ATOM 0 HB3 SER A 51 15.493 -2.096 13.286 1.00 0.00 H new ATOM 0 HG SER A 51 12.869 -3.133 13.826 1.00 0.00 H new ATOM 738 N VAL A 52 15.585 0.320 11.670 1.00 0.00 N ATOM 739 CA VAL A 52 16.346 1.182 10.781 1.00 0.00 C ATOM 740 C VAL A 52 17.798 0.751 10.914 1.00 0.00 C ATOM 741 O VAL A 52 18.318 0.705 12.030 1.00 0.00 O ATOM 742 CB VAL A 52 16.115 2.654 11.197 1.00 0.00 C ATOM 743 CG1 VAL A 52 16.937 3.640 10.353 1.00 0.00 C ATOM 744 CG2 VAL A 52 14.630 3.048 11.104 1.00 0.00 C ATOM 0 H VAL A 52 15.852 0.418 12.650 1.00 0.00 H new ATOM 0 HA VAL A 52 16.042 1.101 9.737 1.00 0.00 H new ATOM 0 HB VAL A 52 16.446 2.717 12.234 1.00 0.00 H new ATOM 0 HG11 VAL A 52 16.738 4.658 10.686 1.00 0.00 H new ATOM 0 HG12 VAL A 52 17.999 3.421 10.469 1.00 0.00 H new ATOM 0 HG13 VAL A 52 16.659 3.541 9.304 1.00 0.00 H new ATOM 0 HG21 VAL A 52 14.510 4.089 11.404 1.00 0.00 H new ATOM 0 HG22 VAL A 52 14.284 2.924 10.078 1.00 0.00 H new ATOM 0 HG23 VAL A 52 14.042 2.410 11.764 1.00 0.00 H new ATOM 754 N THR A 53 18.462 0.431 9.805 1.00 0.00 N ATOM 755 CA THR A 53 19.806 -0.085 9.854 1.00 0.00 C ATOM 756 C THR A 53 20.638 0.676 8.820 1.00 0.00 C ATOM 757 O THR A 53 20.226 0.823 7.663 1.00 0.00 O ATOM 758 CB THR A 53 19.685 -1.609 9.651 1.00 0.00 C ATOM 759 OG1 THR A 53 19.774 -2.278 10.893 1.00 0.00 O ATOM 760 CG2 THR A 53 20.741 -2.151 8.710 1.00 0.00 C ATOM 0 H THR A 53 18.080 0.525 8.864 1.00 0.00 H new ATOM 0 HA THR A 53 20.331 0.064 10.798 1.00 0.00 H new ATOM 0 HB THR A 53 18.710 -1.792 9.199 1.00 0.00 H new ATOM 0 HG1 THR A 53 19.694 -3.244 10.751 1.00 0.00 H new ATOM 0 HG21 THR A 53 20.613 -3.228 8.600 1.00 0.00 H new ATOM 0 HG22 THR A 53 20.640 -1.673 7.736 1.00 0.00 H new ATOM 0 HG23 THR A 53 21.731 -1.943 9.116 1.00 0.00 H new ATOM 768 N THR A 54 21.814 1.141 9.244 1.00 0.00 N ATOM 769 CA THR A 54 22.842 1.699 8.383 1.00 0.00 C ATOM 770 C THR A 54 24.175 1.128 8.871 1.00 0.00 C ATOM 771 O THR A 54 24.511 1.285 10.048 1.00 0.00 O ATOM 772 CB THR A 54 22.811 3.238 8.442 1.00 0.00 C ATOM 773 OG1 THR A 54 21.519 3.737 8.145 1.00 0.00 O ATOM 774 CG2 THR A 54 23.791 3.869 7.445 1.00 0.00 C ATOM 0 H THR A 54 22.080 1.137 10.229 1.00 0.00 H new ATOM 0 HA THR A 54 22.684 1.433 7.338 1.00 0.00 H new ATOM 0 HB THR A 54 23.098 3.505 9.459 1.00 0.00 H new ATOM 0 HG1 THR A 54 21.528 4.716 8.191 1.00 0.00 H new ATOM 0 HG21 THR A 54 23.737 4.955 7.520 1.00 0.00 H new ATOM 0 HG22 THR A 54 24.805 3.540 7.673 1.00 0.00 H new ATOM 0 HG23 THR A 54 23.529 3.561 6.433 1.00 0.00 H new ATOM 782 N ASP A 55 24.931 0.487 7.975 1.00 0.00 N ATOM 783 CA ASP A 55 26.179 -0.220 8.275 1.00 0.00 C ATOM 784 C ASP A 55 26.067 -1.090 9.534 1.00 0.00 C ATOM 785 O ASP A 55 26.701 -0.831 10.558 1.00 0.00 O ATOM 786 CB ASP A 55 27.372 0.748 8.301 1.00 0.00 C ATOM 787 CG ASP A 55 28.707 0.019 8.553 1.00 0.00 C ATOM 788 OD1 ASP A 55 28.905 -1.112 8.053 1.00 0.00 O ATOM 789 OD2 ASP A 55 29.602 0.610 9.199 1.00 0.00 O ATOM 0 H ASP A 55 24.682 0.445 6.987 1.00 0.00 H new ATOM 0 HA ASP A 55 26.369 -0.921 7.462 1.00 0.00 H new ATOM 0 HB2 ASP A 55 27.425 1.282 7.352 1.00 0.00 H new ATOM 0 HB3 ASP A 55 27.215 1.495 9.079 1.00 0.00 H new ATOM 794 N CYS A 56 25.208 -2.109 9.470 1.00 0.00 N ATOM 795 CA CYS A 56 24.939 -3.029 10.562 1.00 0.00 C ATOM 796 C CYS A 56 25.387 -4.431 10.146 1.00 0.00 C ATOM 797 O CYS A 56 25.449 -4.735 8.951 1.00 0.00 O ATOM 798 CB CYS A 56 23.450 -2.991 10.926 1.00 0.00 C ATOM 799 SG CYS A 56 23.058 -3.624 12.578 1.00 0.00 S ATOM 0 H CYS A 56 24.668 -2.318 8.630 1.00 0.00 H new ATOM 0 HA CYS A 56 25.497 -2.736 11.451 1.00 0.00 H new ATOM 0 HB2 CYS A 56 23.098 -1.962 10.853 1.00 0.00 H new ATOM 0 HB3 CYS A 56 22.895 -3.571 10.189 1.00 0.00 H new ATOM 804 N ASN A 57 25.650 -5.310 11.112 1.00 0.00 N ATOM 805 CA ASN A 57 25.986 -6.706 10.867 1.00 0.00 C ATOM 806 C ASN A 57 25.208 -7.493 11.901 1.00 0.00 C ATOM 807 O ASN A 57 25.508 -7.381 13.087 1.00 0.00 O ATOM 808 CB ASN A 57 27.498 -6.931 11.012 1.00 0.00 C ATOM 809 CG ASN A 57 27.868 -8.413 11.015 1.00 0.00 C ATOM 810 OD1 ASN A 57 27.200 -9.240 10.401 1.00 0.00 O ATOM 811 ND2 ASN A 57 28.940 -8.779 11.698 1.00 0.00 N ATOM 0 H ASN A 57 25.635 -5.065 12.102 1.00 0.00 H new ATOM 0 HA ASN A 57 25.729 -7.019 9.855 1.00 0.00 H new ATOM 0 HB2 ASN A 57 28.017 -6.431 10.194 1.00 0.00 H new ATOM 0 HB3 ASN A 57 27.844 -6.471 11.938 1.00 0.00 H new ATOM 0 HD21 ASN A 57 29.221 -9.759 11.719 1.00 0.00 H new ATOM 0 HD22 ASN A 57 29.486 -8.081 12.203 1.00 0.00 H new ATOM 818 N ILE A 58 24.188 -8.231 11.479 1.00 0.00 N ATOM 819 CA ILE A 58 23.229 -8.855 12.378 1.00 0.00 C ATOM 820 C ILE A 58 23.323 -10.350 12.144 1.00 0.00 C ATOM 821 O ILE A 58 23.035 -10.817 11.043 1.00 0.00 O ATOM 822 CB ILE A 58 21.804 -8.307 12.123 1.00 0.00 C ATOM 823 CG1 ILE A 58 21.802 -6.762 12.188 1.00 0.00 C ATOM 824 CG2 ILE A 58 20.809 -8.936 13.114 1.00 0.00 C ATOM 825 CD1 ILE A 58 20.418 -6.108 12.148 1.00 0.00 C ATOM 0 H ILE A 58 24.003 -8.414 10.493 1.00 0.00 H new ATOM 0 HA ILE A 58 23.451 -8.629 13.421 1.00 0.00 H new ATOM 0 HB ILE A 58 21.482 -8.586 11.120 1.00 0.00 H new ATOM 0 HG12 ILE A 58 22.306 -6.452 13.104 1.00 0.00 H new ATOM 0 HG13 ILE A 58 22.391 -6.379 11.355 1.00 0.00 H new ATOM 0 HG21 ILE A 58 19.810 -8.543 12.925 1.00 0.00 H new ATOM 0 HG22 ILE A 58 20.803 -10.018 12.986 1.00 0.00 H new ATOM 0 HG23 ILE A 58 21.108 -8.693 14.134 1.00 0.00 H new ATOM 0 HD11 ILE A 58 20.526 -5.025 12.199 1.00 0.00 H new ATOM 0 HD12 ILE A 58 19.914 -6.379 11.220 1.00 0.00 H new ATOM 0 HD13 ILE A 58 19.827 -6.454 12.996 1.00 0.00 H new ATOM 837 N ASP A 59 23.701 -11.097 13.177 1.00 0.00 N ATOM 838 CA ASP A 59 23.862 -12.540 13.099 1.00 0.00 C ATOM 839 C ASP A 59 22.937 -13.194 14.120 1.00 0.00 C ATOM 840 O ASP A 59 22.957 -12.819 15.294 1.00 0.00 O ATOM 841 CB ASP A 59 25.327 -12.889 13.375 1.00 0.00 C ATOM 842 CG ASP A 59 25.484 -14.379 13.677 1.00 0.00 C ATOM 843 OD1 ASP A 59 25.421 -15.210 12.747 1.00 0.00 O ATOM 844 OD2 ASP A 59 25.679 -14.734 14.858 1.00 0.00 O ATOM 0 H ASP A 59 23.905 -10.711 14.099 1.00 0.00 H new ATOM 0 HA ASP A 59 23.599 -12.908 12.107 1.00 0.00 H new ATOM 0 HB2 ASP A 59 25.938 -12.622 12.512 1.00 0.00 H new ATOM 0 HB3 ASP A 59 25.692 -12.302 14.218 1.00 0.00 H new ATOM 849 N LYS A 60 22.129 -14.163 13.676 1.00 0.00 N ATOM 850 CA LYS A 60 21.269 -15.010 14.512 1.00 0.00 C ATOM 851 C LYS A 60 20.478 -14.225 15.571 1.00 0.00 C ATOM 852 O LYS A 60 20.342 -14.682 16.707 1.00 0.00 O ATOM 853 CB LYS A 60 22.098 -16.177 15.092 1.00 0.00 C ATOM 854 CG LYS A 60 22.581 -17.140 13.994 1.00 0.00 C ATOM 855 CD LYS A 60 23.330 -18.362 14.553 1.00 0.00 C ATOM 856 CE LYS A 60 24.671 -18.033 15.230 1.00 0.00 C ATOM 857 NZ LYS A 60 25.704 -17.568 14.275 1.00 0.00 N ATOM 0 H LYS A 60 22.053 -14.388 12.684 1.00 0.00 H new ATOM 0 HA LYS A 60 20.491 -15.435 13.878 1.00 0.00 H new ATOM 0 HB2 LYS A 60 22.959 -15.779 15.630 1.00 0.00 H new ATOM 0 HB3 LYS A 60 21.496 -16.725 15.816 1.00 0.00 H new ATOM 0 HG2 LYS A 60 21.723 -17.481 13.414 1.00 0.00 H new ATOM 0 HG3 LYS A 60 23.236 -16.602 13.309 1.00 0.00 H new ATOM 0 HD2 LYS A 60 22.688 -18.867 15.274 1.00 0.00 H new ATOM 0 HD3 LYS A 60 23.511 -19.065 13.740 1.00 0.00 H new ATOM 0 HE2 LYS A 60 24.511 -17.264 15.986 1.00 0.00 H new ATOM 0 HE3 LYS A 60 25.037 -18.919 15.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 26.517 -17.187 14.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 26.016 -18.366 13.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 25.305 -16.824 13.667 1.00 0.00 H new ATOM 871 N SER A 61 19.964 -13.046 15.216 1.00 0.00 N ATOM 872 CA SER A 61 19.313 -12.130 16.149 1.00 0.00 C ATOM 873 C SER A 61 17.911 -11.765 15.661 1.00 0.00 C ATOM 874 O SER A 61 17.598 -11.925 14.476 1.00 0.00 O ATOM 875 CB SER A 61 20.172 -10.869 16.301 1.00 0.00 C ATOM 876 OG SER A 61 21.464 -11.166 16.804 1.00 0.00 O ATOM 0 H SER A 61 19.990 -12.697 14.258 1.00 0.00 H new ATOM 0 HA SER A 61 19.213 -12.620 17.118 1.00 0.00 H new ATOM 0 HB2 SER A 61 20.264 -10.374 15.334 1.00 0.00 H new ATOM 0 HB3 SER A 61 19.674 -10.169 16.972 1.00 0.00 H new ATOM 0 HG SER A 61 21.992 -11.610 16.108 1.00 0.00 H new ATOM 882 N GLN A 62 17.084 -11.222 16.558 1.00 0.00 N ATOM 883 CA GLN A 62 15.800 -10.627 16.214 1.00 0.00 C ATOM 884 C GLN A 62 15.791 -9.179 16.691 1.00 0.00 C ATOM 885 O GLN A 62 16.310 -8.859 17.765 1.00 0.00 O ATOM 886 CB GLN A 62 14.612 -11.421 16.769 1.00 0.00 C ATOM 887 CG GLN A 62 14.603 -12.887 16.309 1.00 0.00 C ATOM 888 CD GLN A 62 13.188 -13.470 16.320 1.00 0.00 C ATOM 889 OE1 GLN A 62 12.352 -13.105 15.495 1.00 0.00 O ATOM 890 NE2 GLN A 62 12.888 -14.387 17.226 1.00 0.00 N ATOM 0 H GLN A 62 17.295 -11.185 17.555 1.00 0.00 H new ATOM 0 HA GLN A 62 15.680 -10.655 15.131 1.00 0.00 H new ATOM 0 HB2 GLN A 62 14.637 -11.388 17.858 1.00 0.00 H new ATOM 0 HB3 GLN A 62 13.684 -10.942 16.457 1.00 0.00 H new ATOM 0 HG2 GLN A 62 15.018 -12.956 15.304 1.00 0.00 H new ATOM 0 HG3 GLN A 62 15.246 -13.478 16.961 1.00 0.00 H new ATOM 0 HE21 GLN A 62 13.590 -14.682 17.905 1.00 0.00 H new ATOM 0 HE22 GLN A 62 11.955 -14.799 17.245 1.00 0.00 H new ATOM 899 N VAL A 63 15.195 -8.309 15.885 1.00 0.00 N ATOM 900 CA VAL A 63 15.274 -6.868 16.036 1.00 0.00 C ATOM 901 C VAL A 63 13.876 -6.307 15.800 1.00 0.00 C ATOM 902 O VAL A 63 13.241 -6.649 14.798 1.00 0.00 O ATOM 903 CB VAL A 63 16.290 -6.347 14.994 1.00 0.00 C ATOM 904 CG1 VAL A 63 16.498 -4.835 15.091 1.00 0.00 C ATOM 905 CG2 VAL A 63 17.657 -7.043 15.094 1.00 0.00 C ATOM 0 H VAL A 63 14.629 -8.598 15.087 1.00 0.00 H new ATOM 0 HA VAL A 63 15.608 -6.562 17.027 1.00 0.00 H new ATOM 0 HB VAL A 63 15.847 -6.587 14.027 1.00 0.00 H new ATOM 0 HG11 VAL A 63 17.220 -4.518 14.339 1.00 0.00 H new ATOM 0 HG12 VAL A 63 15.549 -4.326 14.921 1.00 0.00 H new ATOM 0 HG13 VAL A 63 16.873 -4.582 16.083 1.00 0.00 H new ATOM 0 HG21 VAL A 63 18.329 -6.636 14.338 1.00 0.00 H new ATOM 0 HG22 VAL A 63 18.080 -6.874 16.084 1.00 0.00 H new ATOM 0 HG23 VAL A 63 17.533 -8.114 14.931 1.00 0.00 H new ATOM 915 N TYR A 64 13.403 -5.442 16.697 1.00 0.00 N ATOM 916 CA TYR A 64 12.067 -4.865 16.637 1.00 0.00 C ATOM 917 C TYR A 64 12.176 -3.386 16.997 1.00 0.00 C ATOM 918 O TYR A 64 12.773 -3.061 18.023 1.00 0.00 O ATOM 919 CB TYR A 64 11.125 -5.582 17.626 1.00 0.00 C ATOM 920 CG TYR A 64 11.316 -7.084 17.793 1.00 0.00 C ATOM 921 CD1 TYR A 64 10.752 -7.991 16.875 1.00 0.00 C ATOM 922 CD2 TYR A 64 12.041 -7.576 18.896 1.00 0.00 C ATOM 923 CE1 TYR A 64 10.894 -9.377 17.067 1.00 0.00 C ATOM 924 CE2 TYR A 64 12.184 -8.959 19.100 1.00 0.00 C ATOM 925 CZ TYR A 64 11.597 -9.869 18.191 1.00 0.00 C ATOM 926 OH TYR A 64 11.690 -11.212 18.395 1.00 0.00 O ATOM 0 H TYR A 64 13.948 -5.120 17.497 1.00 0.00 H new ATOM 0 HA TYR A 64 11.654 -4.983 15.635 1.00 0.00 H new ATOM 0 HB2 TYR A 64 11.240 -5.114 18.604 1.00 0.00 H new ATOM 0 HB3 TYR A 64 10.098 -5.404 17.306 1.00 0.00 H new ATOM 0 HD1 TYR A 64 10.208 -7.620 16.019 1.00 0.00 H new ATOM 0 HD2 TYR A 64 12.491 -6.884 19.592 1.00 0.00 H new ATOM 0 HE1 TYR A 64 10.465 -10.067 16.355 1.00 0.00 H new ATOM 0 HE2 TYR A 64 12.741 -9.326 19.949 1.00 0.00 H new ATOM 0 HH TYR A 64 12.206 -11.384 19.210 1.00 0.00 H new ATOM 936 N LEU A 65 11.579 -2.492 16.204 1.00 0.00 N ATOM 937 CA LEU A 65 11.469 -1.048 16.463 1.00 0.00 C ATOM 938 C LEU A 65 12.814 -0.384 16.844 1.00 0.00 C ATOM 939 O LEU A 65 12.833 0.643 17.526 1.00 0.00 O ATOM 940 CB LEU A 65 10.333 -0.774 17.479 1.00 0.00 C ATOM 941 CG LEU A 65 8.904 -0.868 16.904 1.00 0.00 C ATOM 942 CD1 LEU A 65 8.476 -2.287 16.496 1.00 0.00 C ATOM 943 CD2 LEU A 65 7.904 -0.344 17.941 1.00 0.00 C ATOM 0 H LEU A 65 11.139 -2.764 15.325 1.00 0.00 H new ATOM 0 HA LEU A 65 11.198 -0.563 15.525 1.00 0.00 H new ATOM 0 HB2 LEU A 65 10.424 -1.483 18.302 1.00 0.00 H new ATOM 0 HB3 LEU A 65 10.474 0.222 17.899 1.00 0.00 H new ATOM 0 HG LEU A 65 8.910 -0.265 15.996 1.00 0.00 H new ATOM 0 HD11 LEU A 65 7.460 -2.262 16.103 1.00 0.00 H new ATOM 0 HD12 LEU A 65 9.152 -2.665 15.729 1.00 0.00 H new ATOM 0 HD13 LEU A 65 8.512 -2.942 17.366 1.00 0.00 H new ATOM 0 HD21 LEU A 65 6.894 -0.409 17.537 1.00 0.00 H new ATOM 0 HD22 LEU A 65 7.972 -0.945 18.848 1.00 0.00 H new ATOM 0 HD23 LEU A 65 8.134 0.695 18.176 1.00 0.00 H new ATOM 955 N THR A 66 13.943 -0.940 16.405 1.00 0.00 N ATOM 956 CA THR A 66 15.280 -0.572 16.859 1.00 0.00 C ATOM 957 C THR A 66 16.061 0.160 15.755 1.00 0.00 C ATOM 958 O THR A 66 15.697 0.109 14.576 1.00 0.00 O ATOM 959 CB THR A 66 15.928 -1.874 17.371 1.00 0.00 C ATOM 960 OG1 THR A 66 15.299 -2.239 18.587 1.00 0.00 O ATOM 961 CG2 THR A 66 17.434 -1.856 17.630 1.00 0.00 C ATOM 0 H THR A 66 13.951 -1.680 15.703 1.00 0.00 H new ATOM 0 HA THR A 66 15.266 0.153 17.673 1.00 0.00 H new ATOM 0 HB THR A 66 15.785 -2.579 16.552 1.00 0.00 H new ATOM 0 HG1 THR A 66 14.413 -2.612 18.398 1.00 0.00 H new ATOM 0 HG21 THR A 66 17.754 -2.835 17.986 1.00 0.00 H new ATOM 0 HG22 THR A 66 17.959 -1.616 16.705 1.00 0.00 H new ATOM 0 HG23 THR A 66 17.665 -1.103 18.384 1.00 0.00 H new ATOM 969 N THR A 67 17.146 0.842 16.131 1.00 0.00 N ATOM 970 CA THR A 67 18.022 1.569 15.224 1.00 0.00 C ATOM 971 C THR A 67 19.458 1.062 15.415 1.00 0.00 C ATOM 972 O THR A 67 19.983 1.082 16.533 1.00 0.00 O ATOM 973 CB THR A 67 17.888 3.080 15.481 1.00 0.00 C ATOM 974 OG1 THR A 67 16.530 3.481 15.397 1.00 0.00 O ATOM 975 CG2 THR A 67 18.685 3.910 14.468 1.00 0.00 C ATOM 0 H THR A 67 17.443 0.902 17.105 1.00 0.00 H new ATOM 0 HA THR A 67 17.742 1.396 14.185 1.00 0.00 H new ATOM 0 HB THR A 67 18.283 3.258 16.481 1.00 0.00 H new ATOM 0 HG1 THR A 67 16.462 4.444 15.565 1.00 0.00 H new ATOM 0 HG21 THR A 67 18.561 4.970 14.688 1.00 0.00 H new ATOM 0 HG22 THR A 67 19.741 3.647 14.533 1.00 0.00 H new ATOM 0 HG23 THR A 67 18.321 3.703 13.462 1.00 0.00 H new ATOM 983 N CYS A 68 20.094 0.635 14.321 1.00 0.00 N ATOM 984 CA CYS A 68 21.473 0.173 14.283 1.00 0.00 C ATOM 985 C CYS A 68 22.252 1.106 13.362 1.00 0.00 C ATOM 986 O CYS A 68 21.889 1.259 12.190 1.00 0.00 O ATOM 987 CB CYS A 68 21.537 -1.255 13.729 1.00 0.00 C ATOM 988 SG CYS A 68 23.193 -1.993 13.780 1.00 0.00 S ATOM 0 H CYS A 68 19.641 0.603 13.407 1.00 0.00 H new ATOM 0 HA CYS A 68 21.896 0.175 15.288 1.00 0.00 H new ATOM 0 HB2 CYS A 68 20.852 -1.885 14.297 1.00 0.00 H new ATOM 0 HB3 CYS A 68 21.184 -1.250 12.698 1.00 0.00 H new ATOM 993 N THR A 69 23.337 1.683 13.868 1.00 0.00 N ATOM 994 CA THR A 69 24.162 2.625 13.133 1.00 0.00 C ATOM 995 C THR A 69 25.617 2.244 13.392 1.00 0.00 C ATOM 996 O THR A 69 26.083 2.331 14.531 1.00 0.00 O ATOM 997 CB THR A 69 23.828 4.057 13.597 1.00 0.00 C ATOM 998 OG1 THR A 69 22.431 4.297 13.523 1.00 0.00 O ATOM 999 CG2 THR A 69 24.542 5.107 12.739 1.00 0.00 C ATOM 0 H THR A 69 23.670 1.504 14.815 1.00 0.00 H new ATOM 0 HA THR A 69 23.977 2.592 12.059 1.00 0.00 H new ATOM 0 HB THR A 69 24.169 4.141 14.629 1.00 0.00 H new ATOM 0 HG1 THR A 69 22.240 5.210 13.823 1.00 0.00 H new ATOM 0 HG21 THR A 69 24.283 6.104 13.095 1.00 0.00 H new ATOM 0 HG22 THR A 69 25.620 4.964 12.811 1.00 0.00 H new ATOM 0 HG23 THR A 69 24.231 5.000 11.700 1.00 0.00 H new ATOM 1007 N GLY A 70 26.334 1.788 12.359 1.00 0.00 N ATOM 1008 CA GLY A 70 27.744 1.421 12.470 1.00 0.00 C ATOM 1009 C GLY A 70 27.979 0.413 13.597 1.00 0.00 C ATOM 1010 O GLY A 70 28.904 0.599 14.388 1.00 0.00 O ATOM 0 H GLY A 70 25.949 1.664 11.422 1.00 0.00 H new ATOM 0 HA2 GLY A 70 28.085 0.997 11.526 1.00 0.00 H new ATOM 0 HA3 GLY A 70 28.340 2.316 12.652 1.00 0.00 H new ATOM 1014 N SER A 71 27.108 -0.593 13.728 1.00 0.00 N ATOM 1015 CA SER A 71 27.083 -1.491 14.879 1.00 0.00 C ATOM 1016 C SER A 71 26.864 -2.951 14.472 1.00 0.00 C ATOM 1017 O SER A 71 26.657 -3.249 13.295 1.00 0.00 O ATOM 1018 CB SER A 71 26.012 -1.008 15.872 1.00 0.00 C ATOM 1019 OG SER A 71 26.331 0.275 16.384 1.00 0.00 O ATOM 0 H SER A 71 26.396 -0.806 13.030 1.00 0.00 H new ATOM 0 HA SER A 71 28.059 -1.462 15.364 1.00 0.00 H new ATOM 0 HB2 SER A 71 25.042 -0.974 15.377 1.00 0.00 H new ATOM 0 HB3 SER A 71 25.926 -1.719 16.693 1.00 0.00 H new ATOM 0 HG SER A 71 26.223 0.945 15.677 1.00 0.00 H new ATOM 1025 N GLN A 72 26.925 -3.887 15.424 1.00 0.00 N ATOM 1026 CA GLN A 72 26.815 -5.316 15.155 1.00 0.00 C ATOM 1027 C GLN A 72 25.972 -5.993 16.231 1.00 0.00 C ATOM 1028 O GLN A 72 26.067 -5.616 17.401 1.00 0.00 O ATOM 1029 CB GLN A 72 28.201 -5.981 15.131 1.00 0.00 C ATOM 1030 CG GLN A 72 29.258 -5.258 14.287 1.00 0.00 C ATOM 1031 CD GLN A 72 30.491 -6.140 14.127 1.00 0.00 C ATOM 1032 OE1 GLN A 72 30.613 -6.883 13.154 1.00 0.00 O ATOM 1033 NE2 GLN A 72 31.401 -6.108 15.086 1.00 0.00 N ATOM 0 H GLN A 72 27.054 -3.667 16.412 1.00 0.00 H new ATOM 0 HA GLN A 72 26.342 -5.432 14.180 1.00 0.00 H new ATOM 0 HB2 GLN A 72 28.567 -6.058 16.155 1.00 0.00 H new ATOM 0 HB3 GLN A 72 28.092 -6.998 14.754 1.00 0.00 H new ATOM 0 HG2 GLN A 72 28.847 -5.012 13.308 1.00 0.00 H new ATOM 0 HG3 GLN A 72 29.533 -4.317 14.763 1.00 0.00 H new ATOM 0 HE21 GLN A 72 31.279 -5.484 15.884 1.00 0.00 H new ATOM 0 HE22 GLN A 72 32.224 -6.707 15.028 1.00 0.00 H new ATOM 1042 N TYR A 73 25.231 -7.038 15.861 1.00 0.00 N ATOM 1043 CA TYR A 73 24.465 -7.874 16.777 1.00 0.00 C ATOM 1044 C TYR A 73 24.843 -9.329 16.503 1.00 0.00 C ATOM 1045 O TYR A 73 24.944 -9.722 15.339 1.00 0.00 O ATOM 1046 CB TYR A 73 22.956 -7.713 16.527 1.00 0.00 C ATOM 1047 CG TYR A 73 22.326 -6.327 16.593 1.00 0.00 C ATOM 1048 CD1 TYR A 73 22.850 -5.297 17.399 1.00 0.00 C ATOM 1049 CD2 TYR A 73 21.150 -6.088 15.856 1.00 0.00 C ATOM 1050 CE1 TYR A 73 22.237 -4.032 17.428 1.00 0.00 C ATOM 1051 CE2 TYR A 73 20.526 -4.832 15.881 1.00 0.00 C ATOM 1052 CZ TYR A 73 21.071 -3.796 16.666 1.00 0.00 C ATOM 1053 OH TYR A 73 20.449 -2.591 16.688 1.00 0.00 O ATOM 0 H TYR A 73 25.147 -7.332 14.888 1.00 0.00 H new ATOM 0 HA TYR A 73 24.685 -7.584 17.804 1.00 0.00 H new ATOM 0 HB2 TYR A 73 22.744 -8.121 15.539 1.00 0.00 H new ATOM 0 HB3 TYR A 73 22.437 -8.342 17.250 1.00 0.00 H new ATOM 0 HD1 TYR A 73 23.729 -5.481 17.999 1.00 0.00 H new ATOM 0 HD2 TYR A 73 20.723 -6.883 15.263 1.00 0.00 H new ATOM 0 HE1 TYR A 73 22.657 -3.242 18.032 1.00 0.00 H new ATOM 0 HE2 TYR A 73 19.631 -4.659 15.301 1.00 0.00 H new ATOM 0 HH TYR A 73 20.934 -1.983 17.284 1.00 0.00 H new ATOM 1063 N ASN A 74 25.007 -10.143 17.546 1.00 0.00 N ATOM 1064 CA ASN A 74 25.208 -11.585 17.438 1.00 0.00 C ATOM 1065 C ASN A 74 24.395 -12.270 18.538 1.00 0.00 C ATOM 1066 O ASN A 74 24.682 -12.084 19.721 1.00 0.00 O ATOM 1067 CB ASN A 74 26.706 -11.923 17.572 1.00 0.00 C ATOM 1068 CG ASN A 74 26.958 -13.323 18.142 1.00 0.00 C ATOM 1069 OD1 ASN A 74 27.473 -13.465 19.249 1.00 0.00 O ATOM 1070 ND2 ASN A 74 26.611 -14.386 17.437 1.00 0.00 N ATOM 0 H ASN A 74 25.003 -9.809 18.510 1.00 0.00 H new ATOM 0 HA ASN A 74 24.873 -11.940 16.463 1.00 0.00 H new ATOM 0 HB2 ASN A 74 27.179 -11.845 16.593 1.00 0.00 H new ATOM 0 HB3 ASN A 74 27.183 -11.184 18.216 1.00 0.00 H new ATOM 0 HD21 ASN A 74 26.771 -15.321 17.812 1.00 0.00 H new ATOM 0 HD22 ASN A 74 26.183 -14.271 16.518 1.00 0.00 H new ATOM 1077 N GLY A 75 23.410 -13.086 18.161 1.00 0.00 N ATOM 1078 CA GLY A 75 22.632 -13.883 19.101 1.00 0.00 C ATOM 1079 C GLY A 75 21.832 -13.039 20.094 1.00 0.00 C ATOM 1080 O GLY A 75 21.854 -13.352 21.287 1.00 0.00 O ATOM 0 H GLY A 75 23.130 -13.211 17.188 1.00 0.00 H new ATOM 0 HA2 GLY A 75 21.947 -14.522 18.544 1.00 0.00 H new ATOM 0 HA3 GLY A 75 23.304 -14.540 19.653 1.00 0.00 H new ATOM 1084 N ILE A 76 21.161 -11.970 19.649 1.00 0.00 N ATOM 1085 CA ILE A 76 20.441 -11.056 20.542 1.00 0.00 C ATOM 1086 C ILE A 76 18.961 -10.951 20.160 1.00 0.00 C ATOM 1087 O ILE A 76 18.564 -11.267 19.038 1.00 0.00 O ATOM 1088 CB ILE A 76 21.132 -9.666 20.641 1.00 0.00 C ATOM 1089 CG1 ILE A 76 20.629 -8.633 19.605 1.00 0.00 C ATOM 1090 CG2 ILE A 76 22.671 -9.774 20.583 1.00 0.00 C ATOM 1091 CD1 ILE A 76 21.255 -7.244 19.769 1.00 0.00 C ATOM 0 H ILE A 76 21.102 -11.715 18.663 1.00 0.00 H new ATOM 0 HA ILE A 76 20.480 -11.483 21.544 1.00 0.00 H new ATOM 0 HB ILE A 76 20.843 -9.289 21.622 1.00 0.00 H new ATOM 0 HG12 ILE A 76 20.843 -9.003 18.602 1.00 0.00 H new ATOM 0 HG13 ILE A 76 19.546 -8.546 19.688 1.00 0.00 H new ATOM 0 HG21 ILE A 76 23.109 -8.778 20.656 1.00 0.00 H new ATOM 0 HG22 ILE A 76 23.024 -10.387 21.412 1.00 0.00 H new ATOM 0 HG23 ILE A 76 22.968 -10.233 19.640 1.00 0.00 H new ATOM 0 HD11 ILE A 76 20.855 -6.573 19.009 1.00 0.00 H new ATOM 0 HD12 ILE A 76 21.019 -6.853 20.759 1.00 0.00 H new ATOM 0 HD13 ILE A 76 22.337 -7.317 19.656 1.00 0.00 H new ATOM 1103 N TYR A 77 18.164 -10.414 21.076 1.00 0.00 N ATOM 1104 CA TYR A 77 16.785 -10.020 20.876 1.00 0.00 C ATOM 1105 C TYR A 77 16.729 -8.576 21.366 1.00 0.00 C ATOM 1106 O TYR A 77 17.013 -8.326 22.540 1.00 0.00 O ATOM 1107 CB TYR A 77 15.846 -10.952 21.665 1.00 0.00 C ATOM 1108 CG TYR A 77 16.161 -12.437 21.543 1.00 0.00 C ATOM 1109 CD1 TYR A 77 16.110 -13.076 20.289 1.00 0.00 C ATOM 1110 CD2 TYR A 77 16.548 -13.170 22.683 1.00 0.00 C ATOM 1111 CE1 TYR A 77 16.445 -14.436 20.168 1.00 0.00 C ATOM 1112 CE2 TYR A 77 16.875 -14.533 22.574 1.00 0.00 C ATOM 1113 CZ TYR A 77 16.829 -15.173 21.314 1.00 0.00 C ATOM 1114 OH TYR A 77 17.160 -16.492 21.219 1.00 0.00 O ATOM 0 H TYR A 77 18.485 -10.234 22.027 1.00 0.00 H new ATOM 0 HA TYR A 77 16.458 -10.094 19.839 1.00 0.00 H new ATOM 0 HB2 TYR A 77 15.883 -10.673 22.718 1.00 0.00 H new ATOM 0 HB3 TYR A 77 14.824 -10.784 21.327 1.00 0.00 H new ATOM 0 HD1 TYR A 77 15.811 -12.517 19.414 1.00 0.00 H new ATOM 0 HD2 TYR A 77 16.594 -12.682 23.645 1.00 0.00 H new ATOM 0 HE1 TYR A 77 16.409 -14.918 19.202 1.00 0.00 H new ATOM 0 HE2 TYR A 77 17.161 -15.091 23.453 1.00 0.00 H new ATOM 0 HH TYR A 77 17.398 -16.834 22.106 1.00 0.00 H new ATOM 1124 N ILE A 78 16.444 -7.618 20.484 1.00 0.00 N ATOM 1125 CA ILE A 78 16.545 -6.196 20.809 1.00 0.00 C ATOM 1126 C ILE A 78 15.268 -5.484 20.369 1.00 0.00 C ATOM 1127 O ILE A 78 14.778 -5.702 19.258 1.00 0.00 O ATOM 1128 CB ILE A 78 17.852 -5.598 20.238 1.00 0.00 C ATOM 1129 CG1 ILE A 78 17.984 -4.114 20.641 1.00 0.00 C ATOM 1130 CG2 ILE A 78 17.978 -5.783 18.716 1.00 0.00 C ATOM 1131 CD1 ILE A 78 19.394 -3.541 20.435 1.00 0.00 C ATOM 0 H ILE A 78 16.138 -7.805 19.529 1.00 0.00 H new ATOM 0 HA ILE A 78 16.619 -6.050 21.887 1.00 0.00 H new ATOM 0 HB ILE A 78 18.681 -6.154 20.677 1.00 0.00 H new ATOM 0 HG12 ILE A 78 17.274 -3.525 20.061 1.00 0.00 H new ATOM 0 HG13 ILE A 78 17.707 -4.005 21.690 1.00 0.00 H new ATOM 0 HG21 ILE A 78 18.914 -5.344 18.372 1.00 0.00 H new ATOM 0 HG22 ILE A 78 17.967 -6.846 18.477 1.00 0.00 H new ATOM 0 HG23 ILE A 78 17.142 -5.290 18.219 1.00 0.00 H new ATOM 0 HD11 ILE A 78 19.410 -2.495 20.740 1.00 0.00 H new ATOM 0 HD12 ILE A 78 20.107 -4.105 21.036 1.00 0.00 H new ATOM 0 HD13 ILE A 78 19.667 -3.616 19.382 1.00 0.00 H new ATOM 1143 N ARG A 79 14.712 -4.656 21.257 1.00 0.00 N ATOM 1144 CA ARG A 79 13.396 -4.061 21.097 1.00 0.00 C ATOM 1145 C ARG A 79 13.481 -2.574 21.405 1.00 0.00 C ATOM 1146 O ARG A 79 14.018 -2.194 22.448 1.00 0.00 O ATOM 1147 CB ARG A 79 12.444 -4.801 22.051 1.00 0.00 C ATOM 1148 CG ARG A 79 11.025 -4.214 22.098 1.00 0.00 C ATOM 1149 CD ARG A 79 10.067 -5.122 22.878 1.00 0.00 C ATOM 1150 NE ARG A 79 10.514 -5.358 24.265 1.00 0.00 N ATOM 1151 CZ ARG A 79 9.793 -5.910 25.246 1.00 0.00 C ATOM 1152 NH1 ARG A 79 8.526 -6.269 25.052 1.00 0.00 N ATOM 1153 NH2 ARG A 79 10.370 -6.097 26.426 1.00 0.00 N ATOM 0 H ARG A 79 15.178 -4.379 22.121 1.00 0.00 H new ATOM 0 HA ARG A 79 13.022 -4.156 20.078 1.00 0.00 H new ATOM 0 HB2 ARG A 79 12.384 -5.847 21.749 1.00 0.00 H new ATOM 0 HB3 ARG A 79 12.867 -4.783 23.056 1.00 0.00 H new ATOM 0 HG2 ARG A 79 11.053 -3.228 22.563 1.00 0.00 H new ATOM 0 HG3 ARG A 79 10.653 -4.077 21.083 1.00 0.00 H new ATOM 0 HD2 ARG A 79 9.075 -4.671 22.891 1.00 0.00 H new ATOM 0 HD3 ARG A 79 9.976 -6.078 22.362 1.00 0.00 H new ATOM 0 HE ARG A 79 11.465 -5.072 24.497 1.00 0.00 H new ATOM 0 HH11 ARG A 79 8.089 -6.124 24.142 1.00 0.00 H new ATOM 0 HH12 ARG A 79 7.993 -6.689 25.813 1.00 0.00 H new ATOM 0 HH21 ARG A 79 11.342 -5.821 26.568 1.00 0.00 H new ATOM 0 HH22 ARG A 79 9.842 -6.516 27.191 1.00 0.00 H new ATOM 1167 N SER A 80 12.912 -1.743 20.537 1.00 0.00 N ATOM 1168 CA SER A 80 12.704 -0.317 20.756 1.00 0.00 C ATOM 1169 C SER A 80 13.975 0.435 21.196 1.00 0.00 C ATOM 1170 O SER A 80 13.882 1.397 21.962 1.00 0.00 O ATOM 1171 CB SER A 80 11.530 -0.157 21.731 1.00 0.00 C ATOM 1172 OG SER A 80 10.384 -0.842 21.244 1.00 0.00 O ATOM 0 H SER A 80 12.571 -2.057 19.628 1.00 0.00 H new ATOM 0 HA SER A 80 12.455 0.158 19.807 1.00 0.00 H new ATOM 0 HB2 SER A 80 11.806 -0.548 22.710 1.00 0.00 H new ATOM 0 HB3 SER A 80 11.301 0.900 21.863 1.00 0.00 H new ATOM 0 HG SER A 80 9.644 -0.733 21.877 1.00 0.00 H new ATOM 1178 N SER A 81 15.158 0.004 20.745 1.00 0.00 N ATOM 1179 CA SER A 81 16.445 0.485 21.248 1.00 0.00 C ATOM 1180 C SER A 81 17.256 1.197 20.158 1.00 0.00 C ATOM 1181 O SER A 81 16.874 1.209 18.987 1.00 0.00 O ATOM 1182 CB SER A 81 17.209 -0.706 21.835 1.00 0.00 C ATOM 1183 OG SER A 81 16.519 -1.254 22.947 1.00 0.00 O ATOM 0 H SER A 81 15.247 -0.698 20.011 1.00 0.00 H new ATOM 0 HA SER A 81 16.274 1.229 22.026 1.00 0.00 H new ATOM 0 HB2 SER A 81 17.340 -1.472 21.070 1.00 0.00 H new ATOM 0 HB3 SER A 81 18.206 -0.388 22.141 1.00 0.00 H new ATOM 0 HG SER A 81 15.645 -1.590 22.657 1.00 0.00 H new ATOM 1189 N THR A 82 18.392 1.785 20.533 1.00 0.00 N ATOM 1190 CA THR A 82 19.302 2.479 19.630 1.00 0.00 C ATOM 1191 C THR A 82 20.728 2.031 19.960 1.00 0.00 C ATOM 1192 O THR A 82 21.080 1.885 21.133 1.00 0.00 O ATOM 1193 CB THR A 82 19.110 4.001 19.789 1.00 0.00 C ATOM 1194 OG1 THR A 82 17.760 4.365 19.557 1.00 0.00 O ATOM 1195 CG2 THR A 82 19.977 4.815 18.823 1.00 0.00 C ATOM 0 H THR A 82 18.711 1.790 21.502 1.00 0.00 H new ATOM 0 HA THR A 82 19.099 2.236 18.587 1.00 0.00 H new ATOM 0 HB THR A 82 19.409 4.228 20.812 1.00 0.00 H new ATOM 0 HG1 THR A 82 17.659 5.334 19.664 1.00 0.00 H new ATOM 0 HG21 THR A 82 19.799 5.878 18.982 1.00 0.00 H new ATOM 0 HG22 THR A 82 21.029 4.593 19.003 1.00 0.00 H new ATOM 0 HG23 THR A 82 19.721 4.554 17.796 1.00 0.00 H new ATOM 1203 N THR A 83 21.548 1.830 18.931 1.00 0.00 N ATOM 1204 CA THR A 83 22.883 1.253 19.035 1.00 0.00 C ATOM 1205 C THR A 83 23.759 1.946 17.991 1.00 0.00 C ATOM 1206 O THR A 83 23.439 1.905 16.797 1.00 0.00 O ATOM 1207 CB THR A 83 22.819 -0.278 18.838 1.00 0.00 C ATOM 1208 OG1 THR A 83 21.680 -0.695 18.100 1.00 0.00 O ATOM 1209 CG2 THR A 83 22.755 -1.011 20.181 1.00 0.00 C ATOM 0 H THR A 83 21.293 2.072 17.974 1.00 0.00 H new ATOM 0 HA THR A 83 23.314 1.412 20.024 1.00 0.00 H new ATOM 0 HB THR A 83 23.728 -0.525 18.289 1.00 0.00 H new ATOM 0 HG1 THR A 83 21.501 -0.051 17.383 1.00 0.00 H new ATOM 0 HG21 THR A 83 22.711 -2.086 20.007 1.00 0.00 H new ATOM 0 HG22 THR A 83 23.643 -0.774 20.767 1.00 0.00 H new ATOM 0 HG23 THR A 83 21.866 -0.695 20.726 1.00 0.00 H new ATOM 1217 N THR A 84 24.815 2.628 18.444 1.00 0.00 N ATOM 1218 CA THR A 84 25.629 3.513 17.623 1.00 0.00 C ATOM 1219 C THR A 84 27.104 3.267 17.948 1.00 0.00 C ATOM 1220 O THR A 84 27.544 3.530 19.068 1.00 0.00 O ATOM 1221 CB THR A 84 25.218 4.977 17.883 1.00 0.00 C ATOM 1222 OG1 THR A 84 23.814 5.144 17.787 1.00 0.00 O ATOM 1223 CG2 THR A 84 25.872 5.938 16.884 1.00 0.00 C ATOM 0 H THR A 84 25.130 2.575 19.413 1.00 0.00 H new ATOM 0 HA THR A 84 25.474 3.311 16.563 1.00 0.00 H new ATOM 0 HB THR A 84 25.556 5.209 18.893 1.00 0.00 H new ATOM 0 HG1 THR A 84 23.584 6.081 17.958 1.00 0.00 H new ATOM 0 HG21 THR A 84 25.557 6.959 17.101 1.00 0.00 H new ATOM 0 HG22 THR A 84 26.956 5.867 16.968 1.00 0.00 H new ATOM 0 HG23 THR A 84 25.568 5.672 15.871 1.00 0.00 H new ATOM 1231 N GLY A 85 27.887 2.781 16.982 1.00 0.00 N ATOM 1232 CA GLY A 85 29.290 2.451 17.203 1.00 0.00 C ATOM 1233 C GLY A 85 29.449 1.348 18.252 1.00 0.00 C ATOM 1234 O GLY A 85 30.257 1.489 19.172 1.00 0.00 O ATOM 0 H GLY A 85 27.565 2.607 16.030 1.00 0.00 H new ATOM 0 HA2 GLY A 85 29.741 2.129 16.264 1.00 0.00 H new ATOM 0 HA3 GLY A 85 29.828 3.342 17.526 1.00 0.00 H new ATOM 1238 N THR A 86 28.668 0.271 18.158 1.00 0.00 N ATOM 1239 CA THR A 86 28.558 -0.746 19.202 1.00 0.00 C ATOM 1240 C THR A 86 28.603 -2.159 18.615 1.00 0.00 C ATOM 1241 O THR A 86 28.251 -2.368 17.460 1.00 0.00 O ATOM 1242 CB THR A 86 27.245 -0.518 19.982 1.00 0.00 C ATOM 1243 OG1 THR A 86 26.124 -0.207 19.170 1.00 0.00 O ATOM 1244 CG2 THR A 86 27.352 0.605 21.011 1.00 0.00 C ATOM 0 H THR A 86 28.086 0.079 17.343 1.00 0.00 H new ATOM 0 HA THR A 86 29.408 -0.655 19.878 1.00 0.00 H new ATOM 0 HB THR A 86 27.089 -1.483 20.465 1.00 0.00 H new ATOM 0 HG1 THR A 86 26.412 -0.109 18.238 1.00 0.00 H new ATOM 0 HG21 THR A 86 26.398 0.718 21.527 1.00 0.00 H new ATOM 0 HG22 THR A 86 28.130 0.362 21.735 1.00 0.00 H new ATOM 0 HG23 THR A 86 27.604 1.538 20.507 1.00 0.00 H new ATOM 1252 N SER A 87 29.000 -3.153 19.402 1.00 0.00 N ATOM 1253 CA SER A 87 28.879 -4.559 19.051 1.00 0.00 C ATOM 1254 C SER A 87 28.252 -5.240 20.262 1.00 0.00 C ATOM 1255 O SER A 87 28.682 -5.007 21.397 1.00 0.00 O ATOM 1256 CB SER A 87 30.241 -5.143 18.666 1.00 0.00 C ATOM 1257 OG SER A 87 30.714 -4.548 17.467 1.00 0.00 O ATOM 0 H SER A 87 29.422 -2.999 20.318 1.00 0.00 H new ATOM 0 HA SER A 87 28.251 -4.714 18.174 1.00 0.00 H new ATOM 0 HB2 SER A 87 30.957 -4.974 19.470 1.00 0.00 H new ATOM 0 HB3 SER A 87 30.157 -6.222 18.536 1.00 0.00 H new ATOM 0 HG SER A 87 31.693 -4.517 17.482 1.00 0.00 H new ATOM 1263 N ILE A 88 27.211 -6.033 20.022 1.00 0.00 N ATOM 1264 CA ILE A 88 26.349 -6.601 21.046 1.00 0.00 C ATOM 1265 C ILE A 88 26.348 -8.113 20.822 1.00 0.00 C ATOM 1266 O ILE A 88 26.095 -8.570 19.703 1.00 0.00 O ATOM 1267 CB ILE A 88 24.913 -6.034 20.922 1.00 0.00 C ATOM 1268 CG1 ILE A 88 24.777 -4.523 20.608 1.00 0.00 C ATOM 1269 CG2 ILE A 88 24.113 -6.392 22.182 1.00 0.00 C ATOM 1270 CD1 ILE A 88 25.276 -3.564 21.691 1.00 0.00 C ATOM 0 H ILE A 88 26.938 -6.305 19.077 1.00 0.00 H new ATOM 0 HA ILE A 88 26.708 -6.352 22.044 1.00 0.00 H new ATOM 0 HB ILE A 88 24.507 -6.514 20.031 1.00 0.00 H new ATOM 0 HG12 ILE A 88 25.321 -4.313 19.687 1.00 0.00 H new ATOM 0 HG13 ILE A 88 23.727 -4.306 20.415 1.00 0.00 H new ATOM 0 HG21 ILE A 88 23.102 -5.994 22.096 1.00 0.00 H new ATOM 0 HG22 ILE A 88 24.068 -7.476 22.289 1.00 0.00 H new ATOM 0 HG23 ILE A 88 24.600 -5.961 23.057 1.00 0.00 H new ATOM 0 HD11 ILE A 88 25.130 -2.535 21.361 1.00 0.00 H new ATOM 0 HD12 ILE A 88 24.717 -3.732 22.612 1.00 0.00 H new ATOM 0 HD13 ILE A 88 26.336 -3.740 21.873 1.00 0.00 H new ATOM 1282 N SER A 89 26.587 -8.879 21.884 1.00 0.00 N ATOM 1283 CA SER A 89 26.703 -10.330 21.831 1.00 0.00 C ATOM 1284 C SER A 89 25.983 -10.946 23.033 1.00 0.00 C ATOM 1285 O SER A 89 25.665 -10.241 23.994 1.00 0.00 O ATOM 1286 CB SER A 89 28.189 -10.724 21.811 1.00 0.00 C ATOM 1287 OG SER A 89 28.891 -10.074 20.760 1.00 0.00 O ATOM 0 H SER A 89 26.707 -8.499 22.823 1.00 0.00 H new ATOM 0 HA SER A 89 26.235 -10.709 20.922 1.00 0.00 H new ATOM 0 HB2 SER A 89 28.646 -10.468 22.767 1.00 0.00 H new ATOM 0 HB3 SER A 89 28.278 -11.804 21.694 1.00 0.00 H new ATOM 0 HG SER A 89 29.832 -10.346 20.778 1.00 0.00 H new ATOM 1293 N GLY A 90 25.753 -12.261 23.004 1.00 0.00 N ATOM 1294 CA GLY A 90 25.273 -13.025 24.150 1.00 0.00 C ATOM 1295 C GLY A 90 25.917 -14.413 24.125 1.00 0.00 C ATOM 1296 O GLY A 90 26.994 -14.563 24.708 1.00 0.00 O ATOM 0 H GLY A 90 25.898 -12.830 22.170 1.00 0.00 H new ATOM 0 HA2 GLY A 90 25.523 -12.510 25.078 1.00 0.00 H new ATOM 0 HA3 GLY A 90 24.187 -13.113 24.117 1.00 0.00 H new ATOM 1300 N PRO A 91 25.354 -15.403 23.407 1.00 0.00 N ATOM 1301 CA PRO A 91 24.037 -15.374 22.776 1.00 0.00 C ATOM 1302 C PRO A 91 22.915 -15.460 23.828 1.00 0.00 C ATOM 1303 O PRO A 91 23.166 -15.715 25.009 1.00 0.00 O ATOM 1304 CB PRO A 91 24.027 -16.584 21.834 1.00 0.00 C ATOM 1305 CG PRO A 91 24.921 -17.593 22.552 1.00 0.00 C ATOM 1306 CD PRO A 91 25.979 -16.705 23.208 1.00 0.00 C ATOM 0 HA PRO A 91 23.858 -14.444 22.237 1.00 0.00 H new ATOM 0 HB2 PRO A 91 23.019 -16.972 21.688 1.00 0.00 H new ATOM 0 HB3 PRO A 91 24.417 -16.330 20.848 1.00 0.00 H new ATOM 0 HG2 PRO A 91 24.365 -18.172 23.290 1.00 0.00 H new ATOM 0 HG3 PRO A 91 25.366 -18.305 21.857 1.00 0.00 H new ATOM 0 HD2 PRO A 91 26.307 -17.128 24.157 1.00 0.00 H new ATOM 0 HD3 PRO A 91 26.862 -16.620 22.575 1.00 0.00 H new ATOM 1314 N GLY A 92 21.670 -15.237 23.398 1.00 0.00 N ATOM 1315 CA GLY A 92 20.508 -15.153 24.279 1.00 0.00 C ATOM 1316 C GLY A 92 20.405 -13.778 24.948 1.00 0.00 C ATOM 1317 O GLY A 92 19.680 -13.620 25.933 1.00 0.00 O ATOM 0 H GLY A 92 21.440 -15.108 22.413 1.00 0.00 H new ATOM 0 HA2 GLY A 92 19.602 -15.348 23.706 1.00 0.00 H new ATOM 0 HA3 GLY A 92 20.574 -15.926 25.044 1.00 0.00 H new ATOM 1321 N CYS A 93 21.150 -12.792 24.439 1.00 0.00 N ATOM 1322 CA CYS A 93 21.116 -11.419 24.912 1.00 0.00 C ATOM 1323 C CYS A 93 19.731 -10.837 24.644 1.00 0.00 C ATOM 1324 O CYS A 93 19.139 -11.096 23.598 1.00 0.00 O ATOM 1325 CB CYS A 93 22.229 -10.647 24.192 1.00 0.00 C ATOM 1326 SG CYS A 93 22.163 -8.840 24.232 1.00 0.00 S ATOM 0 H CYS A 93 21.805 -12.937 23.671 1.00 0.00 H new ATOM 0 HA CYS A 93 21.291 -11.352 25.986 1.00 0.00 H new ATOM 0 HB2 CYS A 93 23.182 -10.957 24.620 1.00 0.00 H new ATOM 0 HB3 CYS A 93 22.232 -10.959 23.148 1.00 0.00 H new ATOM 1331 N SER A 94 19.233 -10.038 25.578 1.00 0.00 N ATOM 1332 CA SER A 94 17.891 -9.492 25.581 1.00 0.00 C ATOM 1333 C SER A 94 18.005 -8.019 25.964 1.00 0.00 C ATOM 1334 O SER A 94 18.613 -7.702 26.989 1.00 0.00 O ATOM 1335 CB SER A 94 17.068 -10.281 26.602 1.00 0.00 C ATOM 1336 OG SER A 94 16.928 -11.640 26.213 1.00 0.00 O ATOM 0 H SER A 94 19.780 -9.743 26.387 1.00 0.00 H new ATOM 0 HA SER A 94 17.400 -9.569 24.611 1.00 0.00 H new ATOM 0 HB2 SER A 94 17.549 -10.228 27.579 1.00 0.00 H new ATOM 0 HB3 SER A 94 16.083 -9.827 26.707 1.00 0.00 H new ATOM 0 HG SER A 94 16.400 -12.120 26.885 1.00 0.00 H new ATOM 1342 N ILE A 95 17.463 -7.123 25.135 1.00 0.00 N ATOM 1343 CA ILE A 95 17.582 -5.675 25.279 1.00 0.00 C ATOM 1344 C ILE A 95 16.214 -5.065 24.970 1.00 0.00 C ATOM 1345 O ILE A 95 15.594 -5.413 23.961 1.00 0.00 O ATOM 1346 CB ILE A 95 18.686 -5.135 24.330 1.00 0.00 C ATOM 1347 CG1 ILE A 95 20.056 -5.750 24.683 1.00 0.00 C ATOM 1348 CG2 ILE A 95 18.780 -3.600 24.382 1.00 0.00 C ATOM 1349 CD1 ILE A 95 21.256 -5.204 23.905 1.00 0.00 C ATOM 0 H ILE A 95 16.913 -7.397 24.321 1.00 0.00 H new ATOM 0 HA ILE A 95 17.877 -5.403 26.292 1.00 0.00 H new ATOM 0 HB ILE A 95 18.410 -5.426 23.317 1.00 0.00 H new ATOM 0 HG12 ILE A 95 20.238 -5.597 25.747 1.00 0.00 H new ATOM 0 HG13 ILE A 95 20.002 -6.826 24.520 1.00 0.00 H new ATOM 0 HG21 ILE A 95 19.564 -3.260 23.705 1.00 0.00 H new ATOM 0 HG22 ILE A 95 17.826 -3.167 24.080 1.00 0.00 H new ATOM 0 HG23 ILE A 95 19.017 -3.284 25.398 1.00 0.00 H new ATOM 0 HD11 ILE A 95 22.164 -5.708 24.236 1.00 0.00 H new ATOM 0 HD12 ILE A 95 21.110 -5.381 22.839 1.00 0.00 H new ATOM 0 HD13 ILE A 95 21.350 -4.133 24.085 1.00 0.00 H new ATOM 1361 N SER A 96 15.764 -4.123 25.797 1.00 0.00 N ATOM 1362 CA SER A 96 14.583 -3.312 25.544 1.00 0.00 C ATOM 1363 C SER A 96 14.865 -1.863 25.938 1.00 0.00 C ATOM 1364 O SER A 96 15.465 -1.607 26.986 1.00 0.00 O ATOM 1365 CB SER A 96 13.385 -3.860 26.325 1.00 0.00 C ATOM 1366 OG SER A 96 13.012 -5.141 25.844 1.00 0.00 O ATOM 0 H SER A 96 16.223 -3.900 26.680 1.00 0.00 H new ATOM 0 HA SER A 96 14.341 -3.349 24.482 1.00 0.00 H new ATOM 0 HB2 SER A 96 13.634 -3.923 27.384 1.00 0.00 H new ATOM 0 HB3 SER A 96 12.543 -3.174 26.236 1.00 0.00 H new ATOM 0 HG SER A 96 13.235 -5.820 26.515 1.00 0.00 H new ATOM 1372 N THR A 97 14.388 -0.939 25.098 1.00 0.00 N ATOM 1373 CA THR A 97 14.383 0.510 25.300 1.00 0.00 C ATOM 1374 C THR A 97 15.733 1.103 25.758 1.00 0.00 C ATOM 1375 O THR A 97 15.770 2.121 26.455 1.00 0.00 O ATOM 1376 CB THR A 97 13.141 0.920 26.133 1.00 0.00 C ATOM 1377 OG1 THR A 97 12.887 0.057 27.224 1.00 0.00 O ATOM 1378 CG2 THR A 97 11.873 0.887 25.273 1.00 0.00 C ATOM 0 H THR A 97 13.970 -1.201 24.205 1.00 0.00 H new ATOM 0 HA THR A 97 14.276 0.988 24.327 1.00 0.00 H new ATOM 0 HB THR A 97 13.371 1.921 26.498 1.00 0.00 H new ATOM 0 HG1 THR A 97 13.630 0.108 27.861 1.00 0.00 H new ATOM 0 HG21 THR A 97 11.015 1.178 25.879 1.00 0.00 H new ATOM 0 HG22 THR A 97 11.981 1.581 24.439 1.00 0.00 H new ATOM 0 HG23 THR A 97 11.720 -0.121 24.889 1.00 0.00 H new ATOM 1386 N CYS A 98 16.855 0.496 25.354 1.00 0.00 N ATOM 1387 CA CYS A 98 18.194 0.993 25.653 1.00 0.00 C ATOM 1388 C CYS A 98 18.678 1.951 24.564 1.00 0.00 C ATOM 1389 O CYS A 98 18.228 1.901 23.420 1.00 0.00 O ATOM 1390 CB CYS A 98 19.169 -0.186 25.763 1.00 0.00 C ATOM 1391 SG CYS A 98 18.923 -1.252 27.208 1.00 0.00 S ATOM 0 H CYS A 98 16.854 -0.363 24.804 1.00 0.00 H new ATOM 0 HA CYS A 98 18.155 1.533 26.599 1.00 0.00 H new ATOM 0 HB2 CYS A 98 19.083 -0.794 24.863 1.00 0.00 H new ATOM 0 HB3 CYS A 98 20.186 0.205 25.788 1.00 0.00 H new ATOM 1396 N THR A 99 19.666 2.772 24.909 1.00 0.00 N ATOM 1397 CA THR A 99 20.417 3.599 23.978 1.00 0.00 C ATOM 1398 C THR A 99 21.872 3.305 24.325 1.00 0.00 C ATOM 1399 O THR A 99 22.248 3.398 25.496 1.00 0.00 O ATOM 1400 CB THR A 99 20.028 5.079 24.147 1.00 0.00 C ATOM 1401 OG1 THR A 99 18.644 5.250 23.905 1.00 0.00 O ATOM 1402 CG2 THR A 99 20.792 5.997 23.186 1.00 0.00 C ATOM 0 H THR A 99 19.973 2.881 25.875 1.00 0.00 H new ATOM 0 HA THR A 99 20.218 3.384 22.928 1.00 0.00 H new ATOM 0 HB THR A 99 20.284 5.352 25.171 1.00 0.00 H new ATOM 0 HG1 THR A 99 18.407 6.194 24.017 1.00 0.00 H new ATOM 0 HG21 THR A 99 20.482 7.030 23.345 1.00 0.00 H new ATOM 0 HG22 THR A 99 21.862 5.907 23.371 1.00 0.00 H new ATOM 0 HG23 THR A 99 20.576 5.708 22.158 1.00 0.00 H new ATOM 1410 N ILE A 100 22.671 2.882 23.350 1.00 0.00 N ATOM 1411 CA ILE A 100 24.017 2.375 23.573 1.00 0.00 C ATOM 1412 C ILE A 100 24.896 3.051 22.523 1.00 0.00 C ATOM 1413 O ILE A 100 24.556 3.052 21.336 1.00 0.00 O ATOM 1414 CB ILE A 100 24.042 0.825 23.473 1.00 0.00 C ATOM 1415 CG1 ILE A 100 22.870 0.145 24.227 1.00 0.00 C ATOM 1416 CG2 ILE A 100 25.386 0.264 23.978 1.00 0.00 C ATOM 1417 CD1 ILE A 100 22.883 -1.390 24.202 1.00 0.00 C ATOM 0 H ILE A 100 22.395 2.883 22.368 1.00 0.00 H new ATOM 0 HA ILE A 100 24.385 2.604 24.573 1.00 0.00 H new ATOM 0 HB ILE A 100 23.922 0.590 22.416 1.00 0.00 H new ATOM 0 HG12 ILE A 100 22.886 0.476 25.265 1.00 0.00 H new ATOM 0 HG13 ILE A 100 21.931 0.492 23.796 1.00 0.00 H new ATOM 0 HG21 ILE A 100 25.380 -0.823 23.898 1.00 0.00 H new ATOM 0 HG22 ILE A 100 26.199 0.667 23.374 1.00 0.00 H new ATOM 0 HG23 ILE A 100 25.531 0.550 25.020 1.00 0.00 H new ATOM 0 HD11 ILE A 100 22.024 -1.770 24.756 1.00 0.00 H new ATOM 0 HD12 ILE A 100 22.832 -1.738 23.170 1.00 0.00 H new ATOM 0 HD13 ILE A 100 23.802 -1.754 24.662 1.00 0.00 H new ATOM 1429 N THR A 101 26.019 3.620 22.955 1.00 0.00 N ATOM 1430 CA THR A 101 26.854 4.477 22.130 1.00 0.00 C ATOM 1431 C THR A 101 28.313 4.157 22.452 1.00 0.00 C ATOM 1432 O THR A 101 28.675 4.089 23.627 1.00 0.00 O ATOM 1433 CB THR A 101 26.506 5.952 22.419 1.00 0.00 C ATOM 1434 OG1 THR A 101 25.108 6.171 22.305 1.00 0.00 O ATOM 1435 CG2 THR A 101 27.219 6.905 21.455 1.00 0.00 C ATOM 0 H THR A 101 26.376 3.494 23.902 1.00 0.00 H new ATOM 0 HA THR A 101 26.684 4.304 21.067 1.00 0.00 H new ATOM 0 HB THR A 101 26.839 6.156 23.437 1.00 0.00 H new ATOM 0 HG1 THR A 101 24.908 7.112 22.493 1.00 0.00 H new ATOM 0 HG21 THR A 101 26.947 7.933 21.692 1.00 0.00 H new ATOM 0 HG22 THR A 101 28.298 6.783 21.554 1.00 0.00 H new ATOM 0 HG23 THR A 101 26.920 6.678 20.432 1.00 0.00 H new ATOM 1443 N ARG A 102 29.153 3.957 21.425 1.00 0.00 N ATOM 1444 CA ARG A 102 30.597 3.700 21.554 1.00 0.00 C ATOM 1445 C ARG A 102 30.908 2.645 22.631 1.00 0.00 C ATOM 1446 O ARG A 102 31.842 2.797 23.417 1.00 0.00 O ATOM 1447 CB ARG A 102 31.351 5.030 21.758 1.00 0.00 C ATOM 1448 CG ARG A 102 31.251 5.959 20.534 1.00 0.00 C ATOM 1449 CD ARG A 102 32.011 7.276 20.746 1.00 0.00 C ATOM 1450 NE ARG A 102 31.407 8.109 21.804 1.00 0.00 N ATOM 1451 CZ ARG A 102 30.422 9.006 21.649 1.00 0.00 C ATOM 1452 NH1 ARG A 102 29.880 9.224 20.452 1.00 0.00 N ATOM 1453 NH2 ARG A 102 29.975 9.679 22.704 1.00 0.00 N ATOM 0 H ARG A 102 28.839 3.970 20.455 1.00 0.00 H new ATOM 0 HA ARG A 102 30.959 3.261 20.624 1.00 0.00 H new ATOM 0 HB2 ARG A 102 30.948 5.542 22.632 1.00 0.00 H new ATOM 0 HB3 ARG A 102 32.400 4.821 21.966 1.00 0.00 H new ATOM 0 HG2 ARG A 102 31.650 5.448 19.658 1.00 0.00 H new ATOM 0 HG3 ARG A 102 30.203 6.175 20.328 1.00 0.00 H new ATOM 0 HD2 ARG A 102 33.047 7.057 21.006 1.00 0.00 H new ATOM 0 HD3 ARG A 102 32.029 7.837 19.811 1.00 0.00 H new ATOM 0 HE ARG A 102 31.776 7.991 22.748 1.00 0.00 H new ATOM 0 HH11 ARG A 102 30.213 8.706 19.639 1.00 0.00 H new ATOM 0 HH12 ARG A 102 29.131 9.909 20.348 1.00 0.00 H new ATOM 0 HH21 ARG A 102 30.381 9.512 23.625 1.00 0.00 H new ATOM 0 HH22 ARG A 102 29.226 10.363 22.593 1.00 0.00 H new ATOM 1467 N GLY A 103 30.103 1.578 22.685 1.00 0.00 N ATOM 1468 CA GLY A 103 30.309 0.448 23.586 1.00 0.00 C ATOM 1469 C GLY A 103 29.796 0.660 25.012 1.00 0.00 C ATOM 1470 O GLY A 103 30.087 -0.178 25.867 1.00 0.00 O ATOM 0 H GLY A 103 29.278 1.478 22.093 1.00 0.00 H new ATOM 0 HA2 GLY A 103 29.817 -0.428 23.165 1.00 0.00 H new ATOM 0 HA3 GLY A 103 31.375 0.225 23.628 1.00 0.00 H new ATOM 1474 N VAL A 104 29.042 1.729 25.293 1.00 0.00 N ATOM 1475 CA VAL A 104 28.576 2.064 26.639 1.00 0.00 C ATOM 1476 C VAL A 104 27.061 2.280 26.573 1.00 0.00 C ATOM 1477 O VAL A 104 26.575 3.055 25.746 1.00 0.00 O ATOM 1478 CB VAL A 104 29.341 3.307 27.159 1.00 0.00 C ATOM 1479 CG1 VAL A 104 28.948 3.650 28.604 1.00 0.00 C ATOM 1480 CG2 VAL A 104 30.867 3.107 27.126 1.00 0.00 C ATOM 0 H VAL A 104 28.736 2.393 24.581 1.00 0.00 H new ATOM 0 HA VAL A 104 28.775 1.259 27.346 1.00 0.00 H new ATOM 0 HB VAL A 104 29.063 4.121 26.489 1.00 0.00 H new ATOM 0 HG11 VAL A 104 29.505 4.527 28.934 1.00 0.00 H new ATOM 0 HG12 VAL A 104 27.879 3.860 28.650 1.00 0.00 H new ATOM 0 HG13 VAL A 104 29.181 2.807 29.254 1.00 0.00 H new ATOM 0 HG21 VAL A 104 31.360 4.005 27.500 1.00 0.00 H new ATOM 0 HG22 VAL A 104 31.136 2.257 27.753 1.00 0.00 H new ATOM 0 HG23 VAL A 104 31.187 2.917 26.101 1.00 0.00 H new ATOM 1490 N ALA A 105 26.305 1.571 27.418 1.00 0.00 N ATOM 1491 CA ALA A 105 24.869 1.782 27.567 1.00 0.00 C ATOM 1492 C ALA A 105 24.623 3.078 28.344 1.00 0.00 C ATOM 1493 O ALA A 105 25.353 3.391 29.290 1.00 0.00 O ATOM 1494 CB ALA A 105 24.235 0.587 28.288 1.00 0.00 C ATOM 0 H ALA A 105 26.677 0.834 28.017 1.00 0.00 H new ATOM 0 HA ALA A 105 24.408 1.869 26.583 1.00 0.00 H new ATOM 0 HB1 ALA A 105 23.163 0.753 28.395 1.00 0.00 H new ATOM 0 HB2 ALA A 105 24.405 -0.320 27.708 1.00 0.00 H new ATOM 0 HB3 ALA A 105 24.685 0.477 29.275 1.00 0.00 H new ATOM 1500 N THR A 106 23.584 3.818 27.966 1.00 0.00 N ATOM 1501 CA THR A 106 23.182 5.043 28.648 1.00 0.00 C ATOM 1502 C THR A 106 22.678 4.679 30.059 1.00 0.00 C ATOM 1503 O THR A 106 21.892 3.734 30.186 1.00 0.00 O ATOM 1504 CB THR A 106 22.099 5.757 27.816 1.00 0.00 C ATOM 1505 OG1 THR A 106 22.554 5.942 26.488 1.00 0.00 O ATOM 1506 CG2 THR A 106 21.732 7.139 28.367 1.00 0.00 C ATOM 0 H THR A 106 22.992 3.581 27.170 1.00 0.00 H new ATOM 0 HA THR A 106 24.024 5.727 28.751 1.00 0.00 H new ATOM 0 HB THR A 106 21.217 5.117 27.859 1.00 0.00 H new ATOM 0 HG1 THR A 106 22.486 5.096 25.998 1.00 0.00 H new ATOM 0 HG21 THR A 106 20.965 7.590 27.737 1.00 0.00 H new ATOM 0 HG22 THR A 106 21.353 7.036 29.384 1.00 0.00 H new ATOM 0 HG23 THR A 106 22.617 7.775 28.372 1.00 0.00 H new ATOM 1514 N PRO A 107 23.085 5.404 31.119 1.00 0.00 N ATOM 1515 CA PRO A 107 22.582 5.212 32.472 1.00 0.00 C ATOM 1516 C PRO A 107 21.159 5.785 32.593 1.00 0.00 C ATOM 1517 O PRO A 107 20.959 6.890 33.106 1.00 0.00 O ATOM 1518 CB PRO A 107 23.615 5.882 33.388 1.00 0.00 C ATOM 1519 CG PRO A 107 24.159 7.020 32.527 1.00 0.00 C ATOM 1520 CD PRO A 107 24.111 6.439 31.113 1.00 0.00 C ATOM 0 HA PRO A 107 22.478 4.164 32.754 1.00 0.00 H new ATOM 0 HB2 PRO A 107 23.159 6.254 34.305 1.00 0.00 H new ATOM 0 HB3 PRO A 107 24.402 5.188 33.682 1.00 0.00 H new ATOM 0 HG2 PRO A 107 23.549 7.919 32.614 1.00 0.00 H new ATOM 0 HG3 PRO A 107 25.174 7.294 32.816 1.00 0.00 H new ATOM 0 HD2 PRO A 107 23.874 7.214 30.384 1.00 0.00 H new ATOM 0 HD3 PRO A 107 25.079 6.023 30.833 1.00 0.00 H new ATOM 1528 N ALA A 108 20.166 5.050 32.087 1.00 0.00 N ATOM 1529 CA ALA A 108 18.759 5.426 32.100 1.00 0.00 C ATOM 1530 C ALA A 108 17.928 4.201 32.467 1.00 0.00 C ATOM 1531 O ALA A 108 18.160 3.115 31.930 1.00 0.00 O ATOM 1532 CB ALA A 108 18.349 5.941 30.714 1.00 0.00 C ATOM 0 H ALA A 108 20.330 4.147 31.643 1.00 0.00 H new ATOM 0 HA ALA A 108 18.591 6.217 32.831 1.00 0.00 H new ATOM 0 HB1 ALA A 108 17.296 6.221 30.727 1.00 0.00 H new ATOM 0 HB2 ALA A 108 18.953 6.811 30.456 1.00 0.00 H new ATOM 0 HB3 ALA A 108 18.507 5.157 29.973 1.00 0.00 H new ATOM 1538 N ALA A 109 16.928 4.384 33.334 1.00 0.00 N ATOM 1539 CA ALA A 109 16.051 3.309 33.792 1.00 0.00 C ATOM 1540 C ALA A 109 15.226 2.695 32.652 1.00 0.00 C ATOM 1541 O ALA A 109 14.766 1.559 32.775 1.00 0.00 O ATOM 1542 CB ALA A 109 15.126 3.838 34.894 1.00 0.00 C ATOM 0 H ALA A 109 16.704 5.293 33.740 1.00 0.00 H new ATOM 0 HA ALA A 109 16.683 2.513 34.186 1.00 0.00 H new ATOM 0 HB1 ALA A 109 14.472 3.036 35.236 1.00 0.00 H new ATOM 0 HB2 ALA A 109 15.725 4.199 35.730 1.00 0.00 H new ATOM 0 HB3 ALA A 109 14.522 4.656 34.501 1.00 0.00 H new ATOM 1548 N ALA A 110 15.041 3.427 31.544 1.00 0.00 N ATOM 1549 CA ALA A 110 14.378 2.910 30.353 1.00 0.00 C ATOM 1550 C ALA A 110 15.159 1.749 29.725 1.00 0.00 C ATOM 1551 O ALA A 110 14.546 0.884 29.106 1.00 0.00 O ATOM 1552 CB ALA A 110 14.200 4.038 29.330 1.00 0.00 C ATOM 0 H ALA A 110 15.350 4.395 31.455 1.00 0.00 H new ATOM 0 HA ALA A 110 13.402 2.526 30.652 1.00 0.00 H new ATOM 0 HB1 ALA A 110 13.704 3.648 28.441 1.00 0.00 H new ATOM 0 HB2 ALA A 110 13.593 4.832 29.765 1.00 0.00 H new ATOM 0 HB3 ALA A 110 15.176 4.437 29.055 1.00 0.00 H new ATOM 1558 N CYS A 111 16.485 1.694 29.888 1.00 0.00 N ATOM 1559 CA CYS A 111 17.268 0.578 29.385 1.00 0.00 C ATOM 1560 C CYS A 111 17.036 -0.641 30.280 1.00 0.00 C ATOM 1561 O CYS A 111 17.291 -0.581 31.487 1.00 0.00 O ATOM 1562 CB CYS A 111 18.753 0.965 29.343 1.00 0.00 C ATOM 1563 SG CYS A 111 19.891 -0.316 28.741 1.00 0.00 S ATOM 0 H CYS A 111 17.031 2.412 30.365 1.00 0.00 H new ATOM 0 HA CYS A 111 16.957 0.327 28.371 1.00 0.00 H new ATOM 0 HB2 CYS A 111 18.861 1.846 28.710 1.00 0.00 H new ATOM 0 HB3 CYS A 111 19.061 1.254 30.348 1.00 0.00 H new ATOM 1568 N LYS A 112 16.593 -1.755 29.691 1.00 0.00 N ATOM 1569 CA LYS A 112 16.522 -3.061 30.342 1.00 0.00 C ATOM 1570 C LYS A 112 17.392 -3.991 29.504 1.00 0.00 C ATOM 1571 O LYS A 112 17.242 -4.029 28.283 1.00 0.00 O ATOM 1572 CB LYS A 112 15.079 -3.599 30.411 1.00 0.00 C ATOM 1573 CG LYS A 112 14.207 -3.022 31.544 1.00 0.00 C ATOM 1574 CD LYS A 112 13.678 -1.591 31.342 1.00 0.00 C ATOM 1575 CE LYS A 112 12.833 -1.393 30.073 1.00 0.00 C ATOM 1576 NZ LYS A 112 11.538 -2.121 30.105 1.00 0.00 N ATOM 0 H LYS A 112 16.266 -1.772 28.725 1.00 0.00 H new ATOM 0 HA LYS A 112 16.866 -2.990 31.374 1.00 0.00 H new ATOM 0 HB2 LYS A 112 14.588 -3.395 29.459 1.00 0.00 H new ATOM 0 HB3 LYS A 112 15.119 -4.682 30.523 1.00 0.00 H new ATOM 0 HG2 LYS A 112 13.353 -3.684 31.689 1.00 0.00 H new ATOM 0 HG3 LYS A 112 14.787 -3.044 32.466 1.00 0.00 H new ATOM 0 HD2 LYS A 112 13.078 -1.314 32.209 1.00 0.00 H new ATOM 0 HD3 LYS A 112 14.525 -0.906 31.309 1.00 0.00 H new ATOM 0 HE2 LYS A 112 12.640 -0.329 29.937 1.00 0.00 H new ATOM 0 HE3 LYS A 112 13.407 -1.726 29.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 11.019 -1.945 29.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 11.715 -3.141 30.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 10.972 -1.787 30.911 1.00 0.00 H new ATOM 1590 N ILE A 113 18.294 -4.729 30.148 1.00 0.00 N ATOM 1591 CA ILE A 113 19.268 -5.591 29.498 1.00 0.00 C ATOM 1592 C ILE A 113 19.451 -6.855 30.343 1.00 0.00 C ATOM 1593 O ILE A 113 19.367 -6.792 31.573 1.00 0.00 O ATOM 1594 CB ILE A 113 20.566 -4.777 29.295 1.00 0.00 C ATOM 1595 CG1 ILE A 113 21.577 -5.558 28.434 1.00 0.00 C ATOM 1596 CG2 ILE A 113 21.230 -4.308 30.606 1.00 0.00 C ATOM 1597 CD1 ILE A 113 22.600 -4.656 27.731 1.00 0.00 C ATOM 0 H ILE A 113 18.366 -4.741 31.165 1.00 0.00 H new ATOM 0 HA ILE A 113 18.940 -5.925 28.514 1.00 0.00 H new ATOM 0 HB ILE A 113 20.260 -3.872 28.771 1.00 0.00 H new ATOM 0 HG12 ILE A 113 22.106 -6.272 29.065 1.00 0.00 H new ATOM 0 HG13 ILE A 113 21.036 -6.135 27.684 1.00 0.00 H new ATOM 0 HG21 ILE A 113 22.134 -3.745 30.375 1.00 0.00 H new ATOM 0 HG22 ILE A 113 20.537 -3.672 31.158 1.00 0.00 H new ATOM 0 HG23 ILE A 113 21.489 -5.175 31.213 1.00 0.00 H new ATOM 0 HD11 ILE A 113 23.282 -5.269 27.142 1.00 0.00 H new ATOM 0 HD12 ILE A 113 22.080 -3.959 27.074 1.00 0.00 H new ATOM 0 HD13 ILE A 113 23.166 -4.098 28.477 1.00 0.00 H new ATOM 1609 N SER A 114 19.686 -8.007 29.711 1.00 0.00 N ATOM 1610 CA SER A 114 20.017 -9.264 30.380 1.00 0.00 C ATOM 1611 C SER A 114 20.744 -10.187 29.400 1.00 0.00 C ATOM 1612 O SER A 114 20.424 -10.204 28.209 1.00 0.00 O ATOM 1613 CB SER A 114 18.729 -9.947 30.873 1.00 0.00 C ATOM 1614 OG SER A 114 18.091 -9.184 31.883 1.00 0.00 O ATOM 0 H SER A 114 19.650 -8.092 28.695 1.00 0.00 H new ATOM 0 HA SER A 114 20.663 -9.058 31.234 1.00 0.00 H new ATOM 0 HB2 SER A 114 18.046 -10.087 30.035 1.00 0.00 H new ATOM 0 HB3 SER A 114 18.966 -10.938 31.259 1.00 0.00 H new ATOM 0 HG SER A 114 18.545 -8.320 31.976 1.00 0.00 H new ATOM 1620 N GLY A 115 21.697 -10.977 29.903 1.00 0.00 N ATOM 1621 CA GLY A 115 22.381 -12.017 29.137 1.00 0.00 C ATOM 1622 C GLY A 115 23.271 -11.474 28.017 1.00 0.00 C ATOM 1623 O GLY A 115 23.500 -12.186 27.037 1.00 0.00 O ATOM 0 H GLY A 115 22.018 -10.909 30.869 1.00 0.00 H new ATOM 0 HA2 GLY A 115 22.990 -12.614 29.816 1.00 0.00 H new ATOM 0 HA3 GLY A 115 21.637 -12.686 28.705 1.00 0.00 H new ATOM 1627 N CYS A 116 23.748 -10.230 28.126 1.00 0.00 N ATOM 1628 CA CYS A 116 24.455 -9.541 27.050 1.00 0.00 C ATOM 1629 C CYS A 116 25.910 -9.253 27.411 1.00 0.00 C ATOM 1630 O CYS A 116 26.274 -9.160 28.587 1.00 0.00 O ATOM 1631 CB CYS A 116 23.755 -8.213 26.745 1.00 0.00 C ATOM 1632 SG CYS A 116 22.039 -8.342 26.196 1.00 0.00 S ATOM 0 H CYS A 116 23.651 -9.670 28.973 1.00 0.00 H new ATOM 0 HA CYS A 116 24.441 -10.197 26.180 1.00 0.00 H new ATOM 0 HB2 CYS A 116 23.785 -7.593 27.641 1.00 0.00 H new ATOM 0 HB3 CYS A 116 24.325 -7.691 25.977 1.00 0.00 H new ATOM 1637 N SER A 117 26.701 -9.021 26.369 1.00 0.00 N ATOM 1638 CA SER A 117 28.063 -8.516 26.407 1.00 0.00 C ATOM 1639 C SER A 117 28.124 -7.360 25.403 1.00 0.00 C ATOM 1640 O SER A 117 27.439 -7.399 24.374 1.00 0.00 O ATOM 1641 CB SER A 117 29.046 -9.639 26.048 1.00 0.00 C ATOM 1642 OG SER A 117 28.889 -10.756 26.913 1.00 0.00 O ATOM 0 H SER A 117 26.384 -9.193 25.415 1.00 0.00 H new ATOM 0 HA SER A 117 28.342 -8.164 27.400 1.00 0.00 H new ATOM 0 HB2 SER A 117 28.886 -9.950 25.016 1.00 0.00 H new ATOM 0 HB3 SER A 117 30.068 -9.266 26.113 1.00 0.00 H new ATOM 0 HG SER A 117 29.526 -11.457 26.661 1.00 0.00 H new ATOM 1648 N LEU A 118 28.915 -6.329 25.710 1.00 0.00 N ATOM 1649 CA LEU A 118 28.969 -5.078 24.957 1.00 0.00 C ATOM 1650 C LEU A 118 30.426 -4.769 24.628 1.00 0.00 C ATOM 1651 O LEU A 118 31.302 -4.944 25.482 1.00 0.00 O ATOM 1652 CB LEU A 118 28.390 -3.914 25.792 1.00 0.00 C ATOM 1653 CG LEU A 118 26.916 -4.042 26.222 1.00 0.00 C ATOM 1654 CD1 LEU A 118 26.525 -2.848 27.102 1.00 0.00 C ATOM 1655 CD2 LEU A 118 25.970 -4.096 25.023 1.00 0.00 C ATOM 0 H LEU A 118 29.550 -6.343 26.508 1.00 0.00 H new ATOM 0 HA LEU A 118 28.380 -5.186 24.046 1.00 0.00 H new ATOM 0 HB2 LEU A 118 28.999 -3.802 26.689 1.00 0.00 H new ATOM 0 HB3 LEU A 118 28.499 -2.995 25.217 1.00 0.00 H new ATOM 0 HG LEU A 118 26.822 -4.976 26.776 1.00 0.00 H new ATOM 0 HD11 LEU A 118 25.482 -2.944 27.403 1.00 0.00 H new ATOM 0 HD12 LEU A 118 27.158 -2.827 27.989 1.00 0.00 H new ATOM 0 HD13 LEU A 118 26.657 -1.923 26.540 1.00 0.00 H new ATOM 0 HD21 LEU A 118 24.942 -4.186 25.374 1.00 0.00 H new ATOM 0 HD22 LEU A 118 26.074 -3.183 24.436 1.00 0.00 H new ATOM 0 HD23 LEU A 118 26.218 -4.957 24.402 1.00 0.00 H new ATOM 1667 N SER A 119 30.664 -4.239 23.430 1.00 0.00 N ATOM 1668 CA SER A 119 31.953 -3.740 22.973 1.00 0.00 C ATOM 1669 C SER A 119 31.713 -2.498 22.111 1.00 0.00 C ATOM 1670 O SER A 119 30.617 -2.309 21.571 1.00 0.00 O ATOM 1671 CB SER A 119 32.683 -4.827 22.166 1.00 0.00 C ATOM 1672 OG SER A 119 32.854 -6.024 22.912 1.00 0.00 O ATOM 0 H SER A 119 29.933 -4.143 22.725 1.00 0.00 H new ATOM 0 HA SER A 119 32.579 -3.478 23.826 1.00 0.00 H new ATOM 0 HB2 SER A 119 32.119 -5.044 21.258 1.00 0.00 H new ATOM 0 HB3 SER A 119 33.658 -4.453 21.854 1.00 0.00 H new ATOM 0 HG SER A 119 33.320 -6.688 22.362 1.00 0.00 H new ATOM 1678 N ALA A 120 32.725 -1.640 21.984 1.00 0.00 N ATOM 1679 CA ALA A 120 32.691 -0.513 21.060 1.00 0.00 C ATOM 1680 C ALA A 120 33.032 -0.985 19.643 1.00 0.00 C ATOM 1681 O ALA A 120 33.672 -2.025 19.457 1.00 0.00 O ATOM 1682 CB ALA A 120 33.702 0.545 21.515 1.00 0.00 C ATOM 0 H ALA A 120 33.590 -1.709 22.520 1.00 0.00 H new ATOM 0 HA ALA A 120 31.690 -0.081 21.054 1.00 0.00 H new ATOM 0 HB1 ALA A 120 33.680 1.390 20.826 1.00 0.00 H new ATOM 0 HB2 ALA A 120 33.444 0.887 22.517 1.00 0.00 H new ATOM 0 HB3 ALA A 120 34.702 0.112 21.525 1.00 0.00 H new ATOM 1688 N MET A 121 32.622 -0.192 18.651 1.00 0.00 N ATOM 1689 CA MET A 121 33.036 -0.340 17.261 1.00 0.00 C ATOM 1690 C MET A 121 34.564 -0.288 17.198 1.00 0.00 C ATOM 1691 O MET A 121 35.163 0.638 17.786 1.00 0.00 O ATOM 1692 CB MET A 121 32.375 0.765 16.425 1.00 0.00 C ATOM 1693 CG MET A 121 32.906 0.843 14.989 1.00 0.00 C ATOM 1694 SD MET A 121 32.059 2.043 13.920 1.00 0.00 S ATOM 1695 CE MET A 121 32.522 3.606 14.719 1.00 0.00 C ATOM 1696 OXT MET A 121 35.166 -1.174 16.559 1.00 0.00 O ATOM 0 H MET A 121 31.979 0.586 18.798 1.00 0.00 H new ATOM 0 HA MET A 121 32.718 -1.298 16.849 1.00 0.00 H new ATOM 0 HB2 MET A 121 31.299 0.595 16.398 1.00 0.00 H new ATOM 0 HB3 MET A 121 32.533 1.725 16.916 1.00 0.00 H new ATOM 0 HG2 MET A 121 33.966 1.094 15.023 1.00 0.00 H new ATOM 0 HG3 MET A 121 32.827 -0.145 14.535 1.00 0.00 H new ATOM 0 HE1 MET A 121 32.182 4.442 14.108 1.00 0.00 H new ATOM 0 HE2 MET A 121 32.057 3.663 15.703 1.00 0.00 H new ATOM 0 HE3 MET A 121 33.606 3.653 14.826 1.00 0.00 H new TER 1706 MET A 121