USER MOD reduce.3.24.130724 H: found=0, std=0, add=643, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 641 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 51 ASN : amide:sc= -2.14! C(o=-2.4!,f=-7.6!) USER MOD Set 1.2: A 53 GLN : amide:sc= -0.246 X(o=-2.4,f=-2.1) USER MOD Set 2.1: A 28 CYS SG : rot -125:sc= 1.62 USER MOD Set 2.2: A 30 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 12 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 14 ASN : amide:sc= 0 X(o=0,f=0.0027) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 14:sc= 0.676! USER MOD Single : A 3 SER OG : rot 22:sc= 0.493! USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 13 GLN : amide:sc= -0.0181 X(o=-0.018,f=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 GLN : amide:sc= -1.1 K(o=-1.1,f=-4.8!) USER MOD Single : A 24 LYS NZ :NH3+ -145:sc= -0.0152 (180deg=-0.754) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 MET CE :methyl -169:sc= -0.036 (180deg=-0.223) USER MOD Single : A 49 ASN : amide:sc= 0.704 K(o=0.7,f=0) USER MOD Single : A 59 ASN : amide:sc= -0.109 X(o=-0.11,f=-0.078) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0.0293 USER MOD Single : A 69 HIS : no HD1:sc= -1.63! C(o=-1.6!,f=-2.8!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=-0.054) USER MOD Single : A 77 ASN : amide:sc= -3.02! C(o=-3!,f=-4.3!) USER MOD Single : A 81 ASN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 83 SER OG : rot 23:sc= 0.728 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 108:sc= -0.698 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -31.514 -17.740 14.475 1.00 0.00 N ATOM 2 CA GLY A 1 -30.438 -17.923 13.518 1.00 0.00 C ATOM 3 C GLY A 1 -29.092 -18.115 14.188 1.00 0.00 C ATOM 4 O GLY A 1 -28.132 -17.408 13.882 1.00 0.00 O ATOM 0 H1 GLY A 1 -32.413 -17.613 13.967 1.00 0.00 H new ATOM 0 H2 GLY A 1 -31.579 -18.577 15.089 1.00 0.00 H new ATOM 0 H3 GLY A 1 -31.323 -16.899 15.056 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -30.656 -18.789 12.893 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -30.392 -17.057 12.858 1.00 0.00 H new ATOM 8 N SER A 2 -29.022 -19.073 15.107 1.00 0.00 N ATOM 9 CA SER A 2 -27.784 -19.353 15.827 1.00 0.00 C ATOM 10 C SER A 2 -26.572 -19.136 14.926 1.00 0.00 C ATOM 11 O SER A 2 -26.423 -19.796 13.898 1.00 0.00 O ATOM 12 CB SER A 2 -27.791 -20.788 16.357 1.00 0.00 C ATOM 13 OG SER A 2 -27.600 -21.720 15.307 1.00 0.00 O ATOM 0 H SER A 2 -29.807 -19.668 15.371 1.00 0.00 H new ATOM 0 HA SER A 2 -27.717 -18.664 16.669 1.00 0.00 H new ATOM 0 HB2 SER A 2 -27.004 -20.908 17.102 1.00 0.00 H new ATOM 0 HB3 SER A 2 -28.738 -20.989 16.858 1.00 0.00 H new ATOM 0 HG SER A 2 -27.278 -21.252 14.508 1.00 0.00 H new ATOM 19 N SER A 3 -25.708 -18.207 15.322 1.00 0.00 N ATOM 20 CA SER A 3 -24.509 -17.900 14.550 1.00 0.00 C ATOM 21 C SER A 3 -23.262 -18.432 15.248 1.00 0.00 C ATOM 22 O SER A 3 -23.003 -18.116 16.408 1.00 0.00 O ATOM 23 CB SER A 3 -24.385 -16.389 14.341 1.00 0.00 C ATOM 24 OG SER A 3 -24.008 -15.738 15.541 1.00 0.00 O ATOM 0 H SER A 3 -25.815 -17.654 16.172 1.00 0.00 H new ATOM 0 HA SER A 3 -24.597 -18.388 13.579 1.00 0.00 H new ATOM 0 HB2 SER A 3 -23.647 -16.185 13.566 1.00 0.00 H new ATOM 0 HB3 SER A 3 -25.336 -15.988 13.989 1.00 0.00 H new ATOM 0 HG SER A 3 -23.573 -16.381 16.139 1.00 0.00 H new ATOM 30 N GLY A 4 -22.491 -19.244 14.531 1.00 0.00 N ATOM 31 CA GLY A 4 -21.280 -19.809 15.097 1.00 0.00 C ATOM 32 C GLY A 4 -20.088 -19.673 14.169 1.00 0.00 C ATOM 33 O GLY A 4 -20.112 -18.878 13.230 1.00 0.00 O ATOM 0 H GLY A 4 -22.684 -19.521 13.568 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -21.059 -19.314 16.042 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -21.444 -20.863 15.320 1.00 0.00 H new ATOM 37 N SER A 5 -19.043 -20.450 14.434 1.00 0.00 N ATOM 38 CA SER A 5 -17.834 -20.409 13.619 1.00 0.00 C ATOM 39 C SER A 5 -18.023 -21.198 12.326 1.00 0.00 C ATOM 40 O SER A 5 -18.601 -22.285 12.328 1.00 0.00 O ATOM 41 CB SER A 5 -16.646 -20.970 14.402 1.00 0.00 C ATOM 42 OG SER A 5 -16.401 -20.208 15.572 1.00 0.00 O ATOM 0 H SER A 5 -19.009 -21.115 15.206 1.00 0.00 H new ATOM 0 HA SER A 5 -17.633 -19.368 13.364 1.00 0.00 H new ATOM 0 HB2 SER A 5 -16.843 -22.007 14.674 1.00 0.00 H new ATOM 0 HB3 SER A 5 -15.757 -20.969 13.771 1.00 0.00 H new ATOM 0 HG SER A 5 -15.638 -20.588 16.056 1.00 0.00 H new ATOM 48 N SER A 6 -17.532 -20.641 11.224 1.00 0.00 N ATOM 49 CA SER A 6 -17.650 -21.289 9.923 1.00 0.00 C ATOM 50 C SER A 6 -16.281 -21.720 9.405 1.00 0.00 C ATOM 51 O SER A 6 -16.098 -22.857 8.973 1.00 0.00 O ATOM 52 CB SER A 6 -18.315 -20.346 8.918 1.00 0.00 C ATOM 53 OG SER A 6 -19.706 -20.240 9.162 1.00 0.00 O ATOM 0 H SER A 6 -17.049 -19.743 11.206 1.00 0.00 H new ATOM 0 HA SER A 6 -18.270 -22.177 10.042 1.00 0.00 H new ATOM 0 HB2 SER A 6 -17.855 -19.360 8.981 1.00 0.00 H new ATOM 0 HB3 SER A 6 -18.147 -20.712 7.905 1.00 0.00 H new ATOM 0 HG SER A 6 -20.107 -19.631 8.508 1.00 0.00 H new ATOM 59 N GLY A 7 -15.321 -20.801 9.451 1.00 0.00 N ATOM 60 CA GLY A 7 -13.981 -21.103 8.984 1.00 0.00 C ATOM 61 C GLY A 7 -13.319 -19.916 8.313 1.00 0.00 C ATOM 62 O GLY A 7 -13.972 -19.100 7.662 1.00 0.00 O ATOM 0 H GLY A 7 -15.448 -19.852 9.804 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -13.370 -21.427 9.827 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -14.023 -21.936 8.282 1.00 0.00 H new ATOM 66 N PRO A 8 -11.992 -19.806 8.471 1.00 0.00 N ATOM 67 CA PRO A 8 -11.212 -18.712 7.885 1.00 0.00 C ATOM 68 C PRO A 8 -11.122 -18.815 6.366 1.00 0.00 C ATOM 69 O PRO A 8 -11.540 -19.811 5.775 1.00 0.00 O ATOM 70 CB PRO A 8 -9.829 -18.884 8.516 1.00 0.00 C ATOM 71 CG PRO A 8 -9.751 -20.329 8.870 1.00 0.00 C ATOM 72 CD PRO A 8 -11.150 -20.742 9.235 1.00 0.00 C ATOM 0 HA PRO A 8 -11.664 -17.739 8.078 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -9.039 -18.604 7.820 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -9.715 -18.254 9.398 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -9.377 -20.917 8.032 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -9.067 -20.490 9.703 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -11.348 -21.778 8.959 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -11.327 -20.658 10.307 1.00 0.00 H new ATOM 80 N LEU A 9 -10.572 -17.780 5.740 1.00 0.00 N ATOM 81 CA LEU A 9 -10.426 -17.754 4.288 1.00 0.00 C ATOM 82 C LEU A 9 -9.811 -19.054 3.780 1.00 0.00 C ATOM 83 O LEU A 9 -9.079 -19.743 4.491 1.00 0.00 O ATOM 84 CB LEU A 9 -9.559 -16.567 3.865 1.00 0.00 C ATOM 85 CG LEU A 9 -10.257 -15.207 3.825 1.00 0.00 C ATOM 86 CD1 LEU A 9 -10.911 -14.982 2.471 1.00 0.00 C ATOM 87 CD2 LEU A 9 -11.286 -15.103 4.941 1.00 0.00 C ATOM 0 H LEU A 9 -10.220 -16.948 6.214 1.00 0.00 H new ATOM 0 HA LEU A 9 -11.418 -17.647 3.849 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -8.713 -16.499 4.549 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -9.153 -16.774 2.875 1.00 0.00 H new ATOM 0 HG LEU A 9 -9.507 -14.431 3.976 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -11.403 -14.009 2.462 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -10.151 -15.012 1.690 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -11.649 -15.763 2.289 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -11.773 -14.129 4.897 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -12.033 -15.888 4.821 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -10.790 -15.218 5.905 1.00 0.00 H new ATOM 99 N PRO A 10 -10.112 -19.398 2.519 1.00 0.00 N ATOM 100 CA PRO A 10 -9.597 -20.615 1.886 1.00 0.00 C ATOM 101 C PRO A 10 -8.099 -20.537 1.610 1.00 0.00 C ATOM 102 O PRO A 10 -7.570 -19.469 1.302 1.00 0.00 O ATOM 103 CB PRO A 10 -10.379 -20.690 0.572 1.00 0.00 C ATOM 104 CG PRO A 10 -10.762 -19.281 0.278 1.00 0.00 C ATOM 105 CD PRO A 10 -10.978 -18.624 1.614 1.00 0.00 C ATOM 0 HA PRO A 10 -9.723 -21.490 2.524 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -9.769 -21.110 -0.228 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -11.258 -21.327 0.670 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -9.979 -18.773 -0.285 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -11.667 -19.241 -0.328 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -10.698 -17.571 1.594 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -12.023 -18.671 1.920 1.00 0.00 H new ATOM 113 N SER A 11 -7.421 -21.674 1.724 1.00 0.00 N ATOM 114 CA SER A 11 -5.983 -21.733 1.490 1.00 0.00 C ATOM 115 C SER A 11 -5.649 -21.343 0.054 1.00 0.00 C ATOM 116 O SER A 11 -5.638 -22.185 -0.845 1.00 0.00 O ATOM 117 CB SER A 11 -5.454 -23.138 1.785 1.00 0.00 C ATOM 118 OG SER A 11 -5.106 -23.276 3.152 1.00 0.00 O ATOM 0 H SER A 11 -7.844 -22.567 1.977 1.00 0.00 H new ATOM 0 HA SER A 11 -5.502 -21.022 2.162 1.00 0.00 H new ATOM 0 HB2 SER A 11 -6.211 -23.877 1.523 1.00 0.00 H new ATOM 0 HB3 SER A 11 -4.582 -23.340 1.163 1.00 0.00 H new ATOM 0 HG SER A 11 -4.773 -24.183 3.315 1.00 0.00 H new ATOM 124 N THR A 12 -5.378 -20.059 -0.157 1.00 0.00 N ATOM 125 CA THR A 12 -5.045 -19.555 -1.483 1.00 0.00 C ATOM 126 C THR A 12 -3.703 -18.833 -1.476 1.00 0.00 C ATOM 127 O THR A 12 -3.120 -18.598 -0.418 1.00 0.00 O ATOM 128 CB THR A 12 -6.129 -18.594 -2.007 1.00 0.00 C ATOM 129 OG1 THR A 12 -6.260 -17.474 -1.124 1.00 0.00 O ATOM 130 CG2 THR A 12 -7.468 -19.305 -2.134 1.00 0.00 C ATOM 0 H THR A 12 -5.383 -19.348 0.575 1.00 0.00 H new ATOM 0 HA THR A 12 -4.986 -20.420 -2.144 1.00 0.00 H new ATOM 0 HB THR A 12 -5.826 -18.245 -2.994 1.00 0.00 H new ATOM 0 HG1 THR A 12 -6.950 -16.867 -1.465 1.00 0.00 H new ATOM 0 HG21 THR A 12 -8.217 -18.606 -2.506 1.00 0.00 H new ATOM 0 HG22 THR A 12 -7.373 -20.139 -2.830 1.00 0.00 H new ATOM 0 HG23 THR A 12 -7.775 -19.680 -1.158 1.00 0.00 H new ATOM 138 N GLN A 13 -3.218 -18.484 -2.664 1.00 0.00 N ATOM 139 CA GLN A 13 -1.943 -17.788 -2.793 1.00 0.00 C ATOM 140 C GLN A 13 -2.022 -16.701 -3.859 1.00 0.00 C ATOM 141 O GLN A 13 -2.054 -16.991 -5.054 1.00 0.00 O ATOM 142 CB GLN A 13 -0.830 -18.779 -3.140 1.00 0.00 C ATOM 143 CG GLN A 13 -0.145 -19.376 -1.921 1.00 0.00 C ATOM 144 CD GLN A 13 0.915 -18.461 -1.341 1.00 0.00 C ATOM 145 OE1 GLN A 13 0.764 -17.941 -0.235 1.00 0.00 O ATOM 146 NE2 GLN A 13 1.995 -18.260 -2.085 1.00 0.00 N ATOM 0 H GLN A 13 -3.688 -18.672 -3.550 1.00 0.00 H new ATOM 0 HA GLN A 13 -1.716 -17.318 -1.836 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -1.248 -19.585 -3.743 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -0.084 -18.275 -3.755 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -0.893 -19.590 -1.157 1.00 0.00 H new ATOM 0 HG3 GLN A 13 0.312 -20.327 -2.195 1.00 0.00 H new ATOM 0 HE21 GLN A 13 2.078 -18.712 -2.996 1.00 0.00 H new ATOM 0 HE22 GLN A 13 2.742 -17.654 -1.746 1.00 0.00 H new ATOM 155 N ASN A 14 -2.054 -15.448 -3.418 1.00 0.00 N ATOM 156 CA ASN A 14 -2.130 -14.316 -4.334 1.00 0.00 C ATOM 157 C ASN A 14 -0.970 -13.351 -4.106 1.00 0.00 C ATOM 158 O ASN A 14 -0.404 -13.293 -3.016 1.00 0.00 O ATOM 159 CB ASN A 14 -3.461 -13.581 -4.161 1.00 0.00 C ATOM 160 CG ASN A 14 -4.652 -14.517 -4.231 1.00 0.00 C ATOM 161 OD1 ASN A 14 -5.201 -14.761 -5.306 1.00 0.00 O ATOM 162 ND2 ASN A 14 -5.057 -15.046 -3.082 1.00 0.00 N ATOM 0 H ASN A 14 -2.028 -15.191 -2.431 1.00 0.00 H new ATOM 0 HA ASN A 14 -2.064 -14.700 -5.352 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -3.465 -13.063 -3.202 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -3.555 -12.819 -4.935 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -5.853 -15.683 -3.067 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -4.572 -14.815 -2.215 1.00 0.00 H new ATOM 169 N GLY A 15 -0.623 -12.596 -5.144 1.00 0.00 N ATOM 170 CA GLY A 15 0.467 -11.644 -5.036 1.00 0.00 C ATOM 171 C GLY A 15 0.005 -10.285 -4.548 1.00 0.00 C ATOM 172 O GLY A 15 -1.104 -9.840 -4.846 1.00 0.00 O ATOM 0 H GLY A 15 -1.077 -12.627 -6.057 1.00 0.00 H new ATOM 0 HA2 GLY A 15 1.220 -12.035 -4.352 1.00 0.00 H new ATOM 0 HA3 GLY A 15 0.946 -11.533 -6.009 1.00 0.00 H new ATOM 176 N PRO A 16 0.866 -9.604 -3.777 1.00 0.00 N ATOM 177 CA PRO A 16 0.560 -8.279 -3.230 1.00 0.00 C ATOM 178 C PRO A 16 0.520 -7.201 -4.308 1.00 0.00 C ATOM 179 O PRO A 16 1.182 -7.316 -5.340 1.00 0.00 O ATOM 180 CB PRO A 16 1.715 -8.022 -2.259 1.00 0.00 C ATOM 181 CG PRO A 16 2.838 -8.853 -2.777 1.00 0.00 C ATOM 182 CD PRO A 16 2.204 -10.075 -3.382 1.00 0.00 C ATOM 0 HA PRO A 16 -0.424 -8.248 -2.762 1.00 0.00 H new ATOM 0 HB2 PRO A 16 1.983 -6.966 -2.234 1.00 0.00 H new ATOM 0 HB3 PRO A 16 1.448 -8.308 -1.242 1.00 0.00 H new ATOM 0 HG2 PRO A 16 3.418 -8.306 -3.520 1.00 0.00 H new ATOM 0 HG3 PRO A 16 3.524 -9.126 -1.975 1.00 0.00 H new ATOM 0 HD2 PRO A 16 2.771 -10.440 -4.239 1.00 0.00 H new ATOM 0 HD3 PRO A 16 2.146 -10.894 -2.666 1.00 0.00 H new ATOM 190 N VAL A 17 -0.260 -6.154 -4.062 1.00 0.00 N ATOM 191 CA VAL A 17 -0.385 -5.054 -5.011 1.00 0.00 C ATOM 192 C VAL A 17 0.535 -3.897 -4.637 1.00 0.00 C ATOM 193 O VAL A 17 0.483 -3.386 -3.518 1.00 0.00 O ATOM 194 CB VAL A 17 -1.834 -4.539 -5.086 1.00 0.00 C ATOM 195 CG1 VAL A 17 -1.902 -3.248 -5.887 1.00 0.00 C ATOM 196 CG2 VAL A 17 -2.745 -5.598 -5.689 1.00 0.00 C ATOM 0 H VAL A 17 -0.815 -6.044 -3.213 1.00 0.00 H new ATOM 0 HA VAL A 17 -0.095 -5.444 -5.987 1.00 0.00 H new ATOM 0 HB VAL A 17 -2.179 -4.329 -4.074 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -2.934 -2.900 -5.929 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -1.282 -2.490 -5.408 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -1.539 -3.428 -6.899 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -3.765 -5.217 -5.734 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -2.403 -5.842 -6.695 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -2.720 -6.495 -5.070 1.00 0.00 H new ATOM 206 N PHE A 18 1.377 -3.489 -5.580 1.00 0.00 N ATOM 207 CA PHE A 18 2.310 -2.392 -5.349 1.00 0.00 C ATOM 208 C PHE A 18 1.726 -1.070 -5.838 1.00 0.00 C ATOM 209 O PHE A 18 1.193 -0.985 -6.944 1.00 0.00 O ATOM 210 CB PHE A 18 3.639 -2.667 -6.056 1.00 0.00 C ATOM 211 CG PHE A 18 4.486 -3.694 -5.360 1.00 0.00 C ATOM 212 CD1 PHE A 18 5.224 -3.356 -4.236 1.00 0.00 C ATOM 213 CD2 PHE A 18 4.546 -4.996 -5.830 1.00 0.00 C ATOM 214 CE1 PHE A 18 6.004 -4.298 -3.593 1.00 0.00 C ATOM 215 CE2 PHE A 18 5.325 -5.942 -5.191 1.00 0.00 C ATOM 216 CZ PHE A 18 6.056 -5.593 -4.072 1.00 0.00 C ATOM 0 H PHE A 18 1.433 -3.901 -6.511 1.00 0.00 H new ATOM 0 HA PHE A 18 2.486 -2.317 -4.276 1.00 0.00 H new ATOM 0 HB2 PHE A 18 3.438 -3.002 -7.073 1.00 0.00 H new ATOM 0 HB3 PHE A 18 4.200 -1.736 -6.133 1.00 0.00 H new ATOM 0 HD1 PHE A 18 5.189 -2.345 -3.859 1.00 0.00 H new ATOM 0 HD2 PHE A 18 3.978 -5.275 -6.705 1.00 0.00 H new ATOM 0 HE1 PHE A 18 6.572 -4.022 -2.717 1.00 0.00 H new ATOM 0 HE2 PHE A 18 5.362 -6.954 -5.566 1.00 0.00 H new ATOM 0 HZ PHE A 18 6.667 -6.331 -3.573 1.00 0.00 H new ATOM 226 N ALA A 19 1.830 -0.040 -5.004 1.00 0.00 N ATOM 227 CA ALA A 19 1.314 1.279 -5.350 1.00 0.00 C ATOM 228 C ALA A 19 2.259 2.379 -4.879 1.00 0.00 C ATOM 229 O ALA A 19 2.776 2.332 -3.763 1.00 0.00 O ATOM 230 CB ALA A 19 -0.071 1.477 -4.751 1.00 0.00 C ATOM 0 H ALA A 19 2.267 -0.094 -4.084 1.00 0.00 H new ATOM 0 HA ALA A 19 1.240 1.340 -6.436 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -0.444 2.466 -5.017 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -0.748 0.717 -5.140 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -0.014 1.391 -3.666 1.00 0.00 H new ATOM 236 N LYS A 20 2.481 3.369 -5.737 1.00 0.00 N ATOM 237 CA LYS A 20 3.364 4.482 -5.410 1.00 0.00 C ATOM 238 C LYS A 20 2.561 5.698 -4.957 1.00 0.00 C ATOM 239 O LYS A 20 1.506 5.999 -5.515 1.00 0.00 O ATOM 240 CB LYS A 20 4.226 4.849 -6.620 1.00 0.00 C ATOM 241 CG LYS A 20 5.161 6.019 -6.368 1.00 0.00 C ATOM 242 CD LYS A 20 6.426 5.913 -7.203 1.00 0.00 C ATOM 243 CE LYS A 20 6.185 6.358 -8.638 1.00 0.00 C ATOM 244 NZ LYS A 20 7.424 6.895 -9.266 1.00 0.00 N ATOM 0 H LYS A 20 2.061 3.423 -6.665 1.00 0.00 H new ATOM 0 HA LYS A 20 4.012 4.170 -4.591 1.00 0.00 H new ATOM 0 HB2 LYS A 20 4.816 3.980 -6.913 1.00 0.00 H new ATOM 0 HB3 LYS A 20 3.575 5.090 -7.460 1.00 0.00 H new ATOM 0 HG2 LYS A 20 4.648 6.952 -6.600 1.00 0.00 H new ATOM 0 HG3 LYS A 20 5.424 6.054 -5.311 1.00 0.00 H new ATOM 0 HD2 LYS A 20 7.210 6.526 -6.758 1.00 0.00 H new ATOM 0 HD3 LYS A 20 6.783 4.883 -7.195 1.00 0.00 H new ATOM 0 HE2 LYS A 20 5.817 5.515 -9.223 1.00 0.00 H new ATOM 0 HE3 LYS A 20 5.408 7.122 -8.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 7.219 7.188 -10.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 7.761 7.715 -8.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 8.158 6.158 -9.272 1.00 0.00 H new ATOM 258 N ALA A 21 3.069 6.392 -3.944 1.00 0.00 N ATOM 259 CA ALA A 21 2.400 7.577 -3.420 1.00 0.00 C ATOM 260 C ALA A 21 2.668 8.793 -4.300 1.00 0.00 C ATOM 261 O ALA A 21 3.774 9.334 -4.308 1.00 0.00 O ATOM 262 CB ALA A 21 2.850 7.848 -1.992 1.00 0.00 C ATOM 0 H ALA A 21 3.941 6.155 -3.470 1.00 0.00 H new ATOM 0 HA ALA A 21 1.326 7.389 -3.422 1.00 0.00 H new ATOM 0 HB1 ALA A 21 2.343 8.735 -1.613 1.00 0.00 H new ATOM 0 HB2 ALA A 21 2.602 6.992 -1.364 1.00 0.00 H new ATOM 0 HB3 ALA A 21 3.928 8.011 -1.975 1.00 0.00 H new ATOM 268 N ILE A 22 1.650 9.217 -5.040 1.00 0.00 N ATOM 269 CA ILE A 22 1.776 10.370 -5.924 1.00 0.00 C ATOM 270 C ILE A 22 1.537 11.672 -5.166 1.00 0.00 C ATOM 271 O ILE A 22 1.767 12.759 -5.695 1.00 0.00 O ATOM 272 CB ILE A 22 0.789 10.287 -7.103 1.00 0.00 C ATOM 273 CG1 ILE A 22 -0.653 10.313 -6.592 1.00 0.00 C ATOM 274 CG2 ILE A 22 1.044 9.029 -7.919 1.00 0.00 C ATOM 275 CD1 ILE A 22 -1.667 10.658 -7.660 1.00 0.00 C ATOM 0 H ILE A 22 0.728 8.780 -5.046 1.00 0.00 H new ATOM 0 HA ILE A 22 2.794 10.360 -6.313 1.00 0.00 H new ATOM 0 HB ILE A 22 0.942 11.153 -7.748 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -0.898 9.338 -6.171 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -0.730 11.038 -5.782 1.00 0.00 H new ATOM 0 HG21 ILE A 22 0.339 8.984 -8.749 1.00 0.00 H new ATOM 0 HG22 ILE A 22 2.062 9.048 -8.309 1.00 0.00 H new ATOM 0 HG23 ILE A 22 0.915 8.152 -7.285 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -2.667 10.658 -7.226 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -1.447 11.646 -8.065 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -1.619 9.919 -8.460 1.00 0.00 H new ATOM 287 N GLN A 23 1.076 11.552 -3.925 1.00 0.00 N ATOM 288 CA GLN A 23 0.808 12.720 -3.095 1.00 0.00 C ATOM 289 C GLN A 23 1.370 12.530 -1.690 1.00 0.00 C ATOM 290 O GLN A 23 1.685 11.412 -1.282 1.00 0.00 O ATOM 291 CB GLN A 23 -0.697 12.986 -3.023 1.00 0.00 C ATOM 292 CG GLN A 23 -1.046 14.448 -2.796 1.00 0.00 C ATOM 293 CD GLN A 23 -1.143 14.803 -1.325 1.00 0.00 C ATOM 294 OE1 GLN A 23 -0.307 15.534 -0.795 1.00 0.00 O ATOM 295 NE2 GLN A 23 -2.168 14.285 -0.657 1.00 0.00 N ATOM 0 H GLN A 23 0.881 10.659 -3.473 1.00 0.00 H new ATOM 0 HA GLN A 23 1.301 13.579 -3.551 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -1.162 12.650 -3.950 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -1.125 12.390 -2.217 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -0.290 15.076 -3.268 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -1.995 14.671 -3.283 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -2.838 13.684 -1.137 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -2.285 14.489 0.336 1.00 0.00 H new ATOM 304 N LYS A 24 1.494 13.629 -0.954 1.00 0.00 N ATOM 305 CA LYS A 24 2.017 13.585 0.406 1.00 0.00 C ATOM 306 C LYS A 24 0.898 13.333 1.412 1.00 0.00 C ATOM 307 O LYS A 24 0.012 14.169 1.591 1.00 0.00 O ATOM 308 CB LYS A 24 2.734 14.895 0.742 1.00 0.00 C ATOM 309 CG LYS A 24 3.417 14.884 2.099 1.00 0.00 C ATOM 310 CD LYS A 24 4.520 15.926 2.176 1.00 0.00 C ATOM 311 CE LYS A 24 3.952 17.326 2.353 1.00 0.00 C ATOM 312 NZ LYS A 24 3.622 17.960 1.047 1.00 0.00 N ATOM 0 H LYS A 24 1.239 14.562 -1.277 1.00 0.00 H new ATOM 0 HA LYS A 24 2.729 12.762 0.468 1.00 0.00 H new ATOM 0 HB2 LYS A 24 3.478 15.100 -0.028 1.00 0.00 H new ATOM 0 HB3 LYS A 24 2.013 15.712 0.714 1.00 0.00 H new ATOM 0 HG2 LYS A 24 2.680 15.074 2.880 1.00 0.00 H new ATOM 0 HG3 LYS A 24 3.835 13.895 2.289 1.00 0.00 H new ATOM 0 HD2 LYS A 24 5.184 15.694 3.008 1.00 0.00 H new ATOM 0 HD3 LYS A 24 5.122 15.888 1.268 1.00 0.00 H new ATOM 0 HE2 LYS A 24 3.055 17.279 2.971 1.00 0.00 H new ATOM 0 HE3 LYS A 24 4.673 17.946 2.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 3.813 18.981 1.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 4.206 17.536 0.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 2.616 17.806 0.831 1.00 0.00 H new ATOM 326 N ARG A 25 0.946 12.178 2.067 1.00 0.00 N ATOM 327 CA ARG A 25 -0.064 11.818 3.055 1.00 0.00 C ATOM 328 C ARG A 25 0.544 11.747 4.453 1.00 0.00 C ATOM 329 O ARG A 25 1.446 10.950 4.710 1.00 0.00 O ATOM 330 CB ARG A 25 -0.702 10.474 2.697 1.00 0.00 C ATOM 331 CG ARG A 25 -1.581 9.904 3.798 1.00 0.00 C ATOM 332 CD ARG A 25 -2.952 10.562 3.813 1.00 0.00 C ATOM 333 NE ARG A 25 -3.981 9.671 4.342 1.00 0.00 N ATOM 334 CZ ARG A 25 -5.276 9.965 4.345 1.00 0.00 C ATOM 335 NH1 ARG A 25 -5.699 11.120 3.850 1.00 0.00 N ATOM 336 NH2 ARG A 25 -6.152 9.102 4.843 1.00 0.00 N ATOM 0 H ARG A 25 1.673 11.476 1.932 1.00 0.00 H new ATOM 0 HA ARG A 25 -0.833 12.591 3.050 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -1.299 10.594 1.793 1.00 0.00 H new ATOM 0 HB3 ARG A 25 0.086 9.758 2.466 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -1.694 8.829 3.655 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -1.096 10.048 4.764 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -2.912 11.469 4.417 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -3.220 10.865 2.801 1.00 0.00 H new ATOM 0 HE ARG A 25 -3.689 8.774 4.730 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -5.029 11.786 3.465 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -6.694 11.343 3.854 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -5.831 8.212 5.224 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -7.147 9.329 4.845 1.00 0.00 H new ATOM 350 N VAL A 26 0.044 12.588 5.353 1.00 0.00 N ATOM 351 CA VAL A 26 0.537 12.622 6.725 1.00 0.00 C ATOM 352 C VAL A 26 -0.597 12.408 7.721 1.00 0.00 C ATOM 353 O VAL A 26 -1.668 13.005 7.618 1.00 0.00 O ATOM 354 CB VAL A 26 1.236 13.958 7.038 1.00 0.00 C ATOM 355 CG1 VAL A 26 2.476 14.127 6.174 1.00 0.00 C ATOM 356 CG2 VAL A 26 0.275 15.121 6.839 1.00 0.00 C ATOM 0 H VAL A 26 -0.702 13.255 5.157 1.00 0.00 H new ATOM 0 HA VAL A 26 1.260 11.812 6.822 1.00 0.00 H new ATOM 0 HB VAL A 26 1.549 13.949 8.082 1.00 0.00 H new ATOM 0 HG11 VAL A 26 2.957 15.077 6.409 1.00 0.00 H new ATOM 0 HG12 VAL A 26 3.171 13.310 6.371 1.00 0.00 H new ATOM 0 HG13 VAL A 26 2.191 14.115 5.122 1.00 0.00 H new ATOM 0 HG21 VAL A 26 0.785 16.057 7.065 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -0.070 15.135 5.805 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -0.580 15.004 7.505 1.00 0.00 H new ATOM 366 N PRO A 27 -0.358 11.535 8.712 1.00 0.00 N ATOM 367 CA PRO A 27 -1.347 11.223 9.748 1.00 0.00 C ATOM 368 C PRO A 27 -1.577 12.391 10.700 1.00 0.00 C ATOM 369 O PRO A 27 -0.626 13.012 11.178 1.00 0.00 O ATOM 370 CB PRO A 27 -0.720 10.042 10.492 1.00 0.00 C ATOM 371 CG PRO A 27 0.746 10.187 10.267 1.00 0.00 C ATOM 372 CD PRO A 27 0.897 10.787 8.897 1.00 0.00 C ATOM 0 HA PRO A 27 -2.327 11.005 9.324 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -0.962 10.070 11.554 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -1.088 9.091 10.106 1.00 0.00 H new ATOM 0 HG2 PRO A 27 1.196 10.828 11.025 1.00 0.00 H new ATOM 0 HG3 PRO A 27 1.248 9.221 10.328 1.00 0.00 H new ATOM 0 HD2 PRO A 27 1.767 11.441 8.838 1.00 0.00 H new ATOM 0 HD3 PRO A 27 1.023 10.019 8.134 1.00 0.00 H new ATOM 380 N CYS A 28 -2.843 12.685 10.973 1.00 0.00 N ATOM 381 CA CYS A 28 -3.198 13.780 11.869 1.00 0.00 C ATOM 382 C CYS A 28 -2.587 13.571 13.251 1.00 0.00 C ATOM 383 O CYS A 28 -2.292 12.444 13.646 1.00 0.00 O ATOM 384 CB CYS A 28 -4.718 13.901 11.983 1.00 0.00 C ATOM 385 SG CYS A 28 -5.302 15.579 12.321 1.00 0.00 S ATOM 0 H CYS A 28 -3.641 12.181 10.587 1.00 0.00 H new ATOM 0 HA CYS A 28 -2.798 14.704 11.451 1.00 0.00 H new ATOM 0 HB2 CYS A 28 -5.170 13.550 11.055 1.00 0.00 H new ATOM 0 HB3 CYS A 28 -5.066 13.240 12.777 1.00 0.00 H new ATOM 0 HG CYS A 28 -6.051 15.572 13.384 1.00 0.00 H new ATOM 391 N ALA A 29 -2.399 14.666 13.981 1.00 0.00 N ATOM 392 CA ALA A 29 -1.824 14.602 15.319 1.00 0.00 C ATOM 393 C ALA A 29 -2.504 13.526 16.159 1.00 0.00 C ATOM 394 O ALA A 29 -1.893 12.949 17.059 1.00 0.00 O ATOM 395 CB ALA A 29 -1.932 15.956 16.005 1.00 0.00 C ATOM 0 H ALA A 29 -2.636 15.607 13.668 1.00 0.00 H new ATOM 0 HA ALA A 29 -0.771 14.338 15.222 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -1.499 15.894 17.003 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -1.394 16.703 15.422 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -2.981 16.242 16.082 1.00 0.00 H new ATOM 401 N TYR A 30 -3.771 13.261 15.859 1.00 0.00 N ATOM 402 CA TYR A 30 -4.534 12.256 16.588 1.00 0.00 C ATOM 403 C TYR A 30 -4.869 11.069 15.691 1.00 0.00 C ATOM 404 O TYR A 30 -5.931 10.458 15.820 1.00 0.00 O ATOM 405 CB TYR A 30 -5.821 12.868 17.145 1.00 0.00 C ATOM 406 CG TYR A 30 -6.563 13.729 16.148 1.00 0.00 C ATOM 407 CD1 TYR A 30 -6.230 15.067 15.973 1.00 0.00 C ATOM 408 CD2 TYR A 30 -7.595 13.205 15.380 1.00 0.00 C ATOM 409 CE1 TYR A 30 -6.906 15.857 15.064 1.00 0.00 C ATOM 410 CE2 TYR A 30 -8.275 13.988 14.468 1.00 0.00 C ATOM 411 CZ TYR A 30 -7.927 15.314 14.313 1.00 0.00 C ATOM 412 OH TYR A 30 -8.602 16.098 13.405 1.00 0.00 O ATOM 0 H TYR A 30 -4.291 13.728 15.116 1.00 0.00 H new ATOM 0 HA TYR A 30 -3.920 11.900 17.416 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -6.479 12.066 17.481 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -5.578 13.469 18.021 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -5.429 15.496 16.557 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -7.870 12.167 15.498 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -6.636 16.896 14.942 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -9.075 13.564 13.879 1.00 0.00 H new ATOM 0 HH TYR A 30 -9.290 15.562 12.958 1.00 0.00 H new ATOM 422 N ASP A 31 -3.956 10.747 14.782 1.00 0.00 N ATOM 423 CA ASP A 31 -4.152 9.632 13.863 1.00 0.00 C ATOM 424 C ASP A 31 -2.932 8.715 13.853 1.00 0.00 C ATOM 425 O ASP A 31 -1.909 9.031 13.245 1.00 0.00 O ATOM 426 CB ASP A 31 -4.427 10.149 12.450 1.00 0.00 C ATOM 427 CG ASP A 31 -5.215 9.160 11.614 1.00 0.00 C ATOM 428 OD1 ASP A 31 -5.248 7.967 11.982 1.00 0.00 O ATOM 429 OD2 ASP A 31 -5.798 9.578 10.592 1.00 0.00 O ATOM 0 H ASP A 31 -3.073 11.242 14.662 1.00 0.00 H new ATOM 0 HA ASP A 31 -5.013 9.059 14.206 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -4.977 11.088 12.511 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -3.480 10.365 11.955 1.00 0.00 H new ATOM 434 N LYS A 32 -3.048 7.578 14.531 1.00 0.00 N ATOM 435 CA LYS A 32 -1.956 6.615 14.602 1.00 0.00 C ATOM 436 C LYS A 32 -2.089 5.561 13.507 1.00 0.00 C ATOM 437 O LYS A 32 -1.099 5.156 12.896 1.00 0.00 O ATOM 438 CB LYS A 32 -1.932 5.939 15.975 1.00 0.00 C ATOM 439 CG LYS A 32 -1.344 6.810 17.071 1.00 0.00 C ATOM 440 CD LYS A 32 -2.408 7.672 17.729 1.00 0.00 C ATOM 441 CE LYS A 32 -3.178 6.897 18.787 1.00 0.00 C ATOM 442 NZ LYS A 32 -4.447 7.582 19.162 1.00 0.00 N ATOM 0 H LYS A 32 -3.888 7.301 15.039 1.00 0.00 H new ATOM 0 HA LYS A 32 -1.020 7.153 14.453 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -2.949 5.659 16.251 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -1.355 5.017 15.907 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -0.869 6.179 17.823 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -0.566 7.448 16.652 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -1.940 8.545 18.184 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -3.099 8.040 16.971 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -3.401 5.897 18.414 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -2.555 6.775 19.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -4.943 7.023 19.885 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -4.233 8.526 19.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -5.052 7.676 18.322 1.00 0.00 H new ATOM 456 N THR A 33 -3.319 5.121 13.262 1.00 0.00 N ATOM 457 CA THR A 33 -3.582 4.115 12.240 1.00 0.00 C ATOM 458 C THR A 33 -3.258 4.646 10.849 1.00 0.00 C ATOM 459 O THR A 33 -2.932 3.881 9.942 1.00 0.00 O ATOM 460 CB THR A 33 -5.050 3.652 12.272 1.00 0.00 C ATOM 461 OG1 THR A 33 -5.923 4.785 12.206 1.00 0.00 O ATOM 462 CG2 THR A 33 -5.340 2.856 13.536 1.00 0.00 C ATOM 0 H THR A 33 -4.149 5.446 13.758 1.00 0.00 H new ATOM 0 HA THR A 33 -2.936 3.265 12.460 1.00 0.00 H new ATOM 0 HB THR A 33 -5.223 3.009 11.409 1.00 0.00 H new ATOM 0 HG1 THR A 33 -6.855 4.482 12.225 1.00 0.00 H new ATOM 0 HG21 THR A 33 -6.383 2.540 13.536 1.00 0.00 H new ATOM 0 HG22 THR A 33 -4.695 1.978 13.569 1.00 0.00 H new ATOM 0 HG23 THR A 33 -5.150 3.479 14.410 1.00 0.00 H new ATOM 470 N ALA A 34 -3.351 5.962 10.687 1.00 0.00 N ATOM 471 CA ALA A 34 -3.065 6.597 9.406 1.00 0.00 C ATOM 472 C ALA A 34 -1.582 6.502 9.065 1.00 0.00 C ATOM 473 O ALA A 34 -0.729 6.963 9.825 1.00 0.00 O ATOM 474 CB ALA A 34 -3.512 8.051 9.426 1.00 0.00 C ATOM 0 H ALA A 34 -3.622 6.609 11.427 1.00 0.00 H new ATOM 0 HA ALA A 34 -3.623 6.068 8.634 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -3.292 8.512 8.463 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -4.584 8.099 9.615 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -2.980 8.584 10.214 1.00 0.00 H new ATOM 480 N LEU A 35 -1.280 5.901 7.920 1.00 0.00 N ATOM 481 CA LEU A 35 0.102 5.745 7.478 1.00 0.00 C ATOM 482 C LEU A 35 0.580 6.989 6.737 1.00 0.00 C ATOM 483 O LEU A 35 -0.154 7.568 5.936 1.00 0.00 O ATOM 484 CB LEU A 35 0.234 4.517 6.576 1.00 0.00 C ATOM 485 CG LEU A 35 1.584 3.801 6.611 1.00 0.00 C ATOM 486 CD1 LEU A 35 1.606 2.653 5.614 1.00 0.00 C ATOM 487 CD2 LEU A 35 2.715 4.779 6.326 1.00 0.00 C ATOM 0 H LEU A 35 -1.973 5.513 7.280 1.00 0.00 H new ATOM 0 HA LEU A 35 0.727 5.608 8.361 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -0.541 3.802 6.853 1.00 0.00 H new ATOM 0 HB3 LEU A 35 0.034 4.822 5.549 1.00 0.00 H new ATOM 0 HG LEU A 35 1.729 3.390 7.610 1.00 0.00 H new ATOM 0 HD11 LEU A 35 2.575 2.155 5.653 1.00 0.00 H new ATOM 0 HD12 LEU A 35 0.821 1.939 5.864 1.00 0.00 H new ATOM 0 HD13 LEU A 35 1.438 3.040 4.609 1.00 0.00 H new ATOM 0 HD21 LEU A 35 3.668 4.251 6.355 1.00 0.00 H new ATOM 0 HD22 LEU A 35 2.574 5.220 5.339 1.00 0.00 H new ATOM 0 HD23 LEU A 35 2.713 5.567 7.079 1.00 0.00 H new ATOM 499 N ALA A 36 1.817 7.394 7.007 1.00 0.00 N ATOM 500 CA ALA A 36 2.395 8.567 6.363 1.00 0.00 C ATOM 501 C ALA A 36 3.229 8.171 5.149 1.00 0.00 C ATOM 502 O ALA A 36 4.086 7.290 5.233 1.00 0.00 O ATOM 503 CB ALA A 36 3.241 9.351 7.355 1.00 0.00 C ATOM 0 H ALA A 36 2.438 6.927 7.668 1.00 0.00 H new ATOM 0 HA ALA A 36 1.578 9.202 6.019 1.00 0.00 H new ATOM 0 HB1 ALA A 36 3.666 10.224 6.860 1.00 0.00 H new ATOM 0 HB2 ALA A 36 2.618 9.674 8.189 1.00 0.00 H new ATOM 0 HB3 ALA A 36 4.046 8.717 7.728 1.00 0.00 H new ATOM 509 N LEU A 37 2.974 8.827 4.022 1.00 0.00 N ATOM 510 CA LEU A 37 3.702 8.542 2.790 1.00 0.00 C ATOM 511 C LEU A 37 4.105 9.834 2.086 1.00 0.00 C ATOM 512 O LEU A 37 3.473 10.874 2.267 1.00 0.00 O ATOM 513 CB LEU A 37 2.848 7.684 1.857 1.00 0.00 C ATOM 514 CG LEU A 37 2.286 6.394 2.457 1.00 0.00 C ATOM 515 CD1 LEU A 37 1.060 5.935 1.682 1.00 0.00 C ATOM 516 CD2 LEU A 37 3.349 5.306 2.472 1.00 0.00 C ATOM 0 H LEU A 37 2.269 9.559 3.936 1.00 0.00 H new ATOM 0 HA LEU A 37 4.607 7.993 3.050 1.00 0.00 H new ATOM 0 HB2 LEU A 37 2.014 8.289 1.502 1.00 0.00 H new ATOM 0 HB3 LEU A 37 3.448 7.424 0.985 1.00 0.00 H new ATOM 0 HG LEU A 37 1.986 6.594 3.486 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.674 5.016 2.123 1.00 0.00 H new ATOM 0 HD12 LEU A 37 0.293 6.708 1.724 1.00 0.00 H new ATOM 0 HD13 LEU A 37 1.334 5.752 0.643 1.00 0.00 H new ATOM 0 HD21 LEU A 37 2.932 4.396 2.902 1.00 0.00 H new ATOM 0 HD22 LEU A 37 3.680 5.107 1.453 1.00 0.00 H new ATOM 0 HD23 LEU A 37 4.198 5.635 3.072 1.00 0.00 H new ATOM 528 N GLU A 38 5.160 9.758 1.280 1.00 0.00 N ATOM 529 CA GLU A 38 5.645 10.921 0.547 1.00 0.00 C ATOM 530 C GLU A 38 5.652 10.654 -0.955 1.00 0.00 C ATOM 531 O GLU A 38 5.497 9.515 -1.395 1.00 0.00 O ATOM 532 CB GLU A 38 7.053 11.296 1.016 1.00 0.00 C ATOM 533 CG GLU A 38 8.115 10.281 0.624 1.00 0.00 C ATOM 534 CD GLU A 38 9.522 10.829 0.757 1.00 0.00 C ATOM 535 OE1 GLU A 38 9.697 12.058 0.619 1.00 0.00 O ATOM 536 OE2 GLU A 38 10.450 10.029 0.999 1.00 0.00 O ATOM 0 H GLU A 38 5.694 8.904 1.119 1.00 0.00 H new ATOM 0 HA GLU A 38 4.969 11.752 0.747 1.00 0.00 H new ATOM 0 HB2 GLU A 38 7.319 12.267 0.599 1.00 0.00 H new ATOM 0 HB3 GLU A 38 7.049 11.405 2.101 1.00 0.00 H new ATOM 0 HG2 GLU A 38 8.014 9.394 1.250 1.00 0.00 H new ATOM 0 HG3 GLU A 38 7.948 9.965 -0.406 1.00 0.00 H new ATOM 543 N VAL A 39 5.831 11.714 -1.738 1.00 0.00 N ATOM 544 CA VAL A 39 5.857 11.595 -3.191 1.00 0.00 C ATOM 545 C VAL A 39 7.045 10.757 -3.652 1.00 0.00 C ATOM 546 O VAL A 39 8.193 11.191 -3.570 1.00 0.00 O ATOM 547 CB VAL A 39 5.926 12.978 -3.866 1.00 0.00 C ATOM 548 CG1 VAL A 39 5.919 12.834 -5.380 1.00 0.00 C ATOM 549 CG2 VAL A 39 4.774 13.855 -3.400 1.00 0.00 C ATOM 0 H VAL A 39 5.960 12.664 -1.390 1.00 0.00 H new ATOM 0 HA VAL A 39 4.931 11.101 -3.485 1.00 0.00 H new ATOM 0 HB VAL A 39 6.860 13.459 -3.576 1.00 0.00 H new ATOM 0 HG11 VAL A 39 5.968 13.821 -5.840 1.00 0.00 H new ATOM 0 HG12 VAL A 39 6.781 12.244 -5.693 1.00 0.00 H new ATOM 0 HG13 VAL A 39 5.003 12.333 -5.694 1.00 0.00 H new ATOM 0 HG21 VAL A 39 4.838 14.828 -3.886 1.00 0.00 H new ATOM 0 HG22 VAL A 39 3.828 13.381 -3.660 1.00 0.00 H new ATOM 0 HG23 VAL A 39 4.830 13.985 -2.319 1.00 0.00 H new ATOM 559 N GLY A 40 6.759 9.553 -4.137 1.00 0.00 N ATOM 560 CA GLY A 40 7.814 8.672 -4.605 1.00 0.00 C ATOM 561 C GLY A 40 8.125 7.565 -3.618 1.00 0.00 C ATOM 562 O GLY A 40 9.289 7.228 -3.399 1.00 0.00 O ATOM 0 H GLY A 40 5.816 9.172 -4.214 1.00 0.00 H new ATOM 0 HA2 GLY A 40 7.520 8.233 -5.558 1.00 0.00 H new ATOM 0 HA3 GLY A 40 8.716 9.256 -4.788 1.00 0.00 H new ATOM 566 N ASP A 41 7.084 6.999 -3.018 1.00 0.00 N ATOM 567 CA ASP A 41 7.252 5.923 -2.048 1.00 0.00 C ATOM 568 C ASP A 41 6.429 4.701 -2.444 1.00 0.00 C ATOM 569 O ASP A 41 5.321 4.829 -2.965 1.00 0.00 O ATOM 570 CB ASP A 41 6.843 6.398 -0.653 1.00 0.00 C ATOM 571 CG ASP A 41 7.589 5.671 0.448 1.00 0.00 C ATOM 572 OD1 ASP A 41 7.754 4.438 0.338 1.00 0.00 O ATOM 573 OD2 ASP A 41 8.007 6.334 1.421 1.00 0.00 O ATOM 0 H ASP A 41 6.114 7.267 -3.186 1.00 0.00 H new ATOM 0 HA ASP A 41 8.305 5.641 -2.034 1.00 0.00 H new ATOM 0 HB2 ASP A 41 7.029 7.469 -0.568 1.00 0.00 H new ATOM 0 HB3 ASP A 41 5.771 6.249 -0.521 1.00 0.00 H new ATOM 578 N ILE A 42 6.980 3.518 -2.195 1.00 0.00 N ATOM 579 CA ILE A 42 6.297 2.273 -2.525 1.00 0.00 C ATOM 580 C ILE A 42 5.578 1.701 -1.309 1.00 0.00 C ATOM 581 O ILE A 42 6.210 1.305 -0.329 1.00 0.00 O ATOM 582 CB ILE A 42 7.280 1.220 -3.069 1.00 0.00 C ATOM 583 CG1 ILE A 42 8.145 1.822 -4.178 1.00 0.00 C ATOM 584 CG2 ILE A 42 6.523 0.004 -3.582 1.00 0.00 C ATOM 585 CD1 ILE A 42 7.344 2.383 -5.332 1.00 0.00 C ATOM 0 H ILE A 42 7.897 3.395 -1.766 1.00 0.00 H new ATOM 0 HA ILE A 42 5.565 2.509 -3.298 1.00 0.00 H new ATOM 0 HB ILE A 42 7.934 0.901 -2.257 1.00 0.00 H new ATOM 0 HG12 ILE A 42 8.763 2.615 -3.756 1.00 0.00 H new ATOM 0 HG13 ILE A 42 8.823 1.056 -4.555 1.00 0.00 H new ATOM 0 HG21 ILE A 42 7.231 -0.731 -3.963 1.00 0.00 H new ATOM 0 HG22 ILE A 42 5.946 -0.436 -2.768 1.00 0.00 H new ATOM 0 HG23 ILE A 42 5.848 0.307 -4.383 1.00 0.00 H new ATOM 0 HD11 ILE A 42 8.022 2.793 -6.080 1.00 0.00 H new ATOM 0 HD12 ILE A 42 6.746 1.589 -5.780 1.00 0.00 H new ATOM 0 HD13 ILE A 42 6.685 3.172 -4.968 1.00 0.00 H new ATOM 597 N VAL A 43 4.251 1.658 -1.378 1.00 0.00 N ATOM 598 CA VAL A 43 3.445 1.130 -0.284 1.00 0.00 C ATOM 599 C VAL A 43 3.072 -0.327 -0.529 1.00 0.00 C ATOM 600 O VAL A 43 2.163 -0.626 -1.304 1.00 0.00 O ATOM 601 CB VAL A 43 2.157 1.953 -0.089 1.00 0.00 C ATOM 602 CG1 VAL A 43 1.456 1.550 1.199 1.00 0.00 C ATOM 603 CG2 VAL A 43 2.471 3.441 -0.092 1.00 0.00 C ATOM 0 H VAL A 43 3.712 1.983 -2.180 1.00 0.00 H new ATOM 0 HA VAL A 43 4.052 1.199 0.619 1.00 0.00 H new ATOM 0 HB VAL A 43 1.484 1.745 -0.921 1.00 0.00 H new ATOM 0 HG11 VAL A 43 0.549 2.142 1.320 1.00 0.00 H new ATOM 0 HG12 VAL A 43 1.196 0.492 1.156 1.00 0.00 H new ATOM 0 HG13 VAL A 43 2.120 1.727 2.045 1.00 0.00 H new ATOM 0 HG21 VAL A 43 1.550 4.007 0.047 1.00 0.00 H new ATOM 0 HG22 VAL A 43 3.163 3.669 0.719 1.00 0.00 H new ATOM 0 HG23 VAL A 43 2.925 3.715 -1.044 1.00 0.00 H new ATOM 613 N LYS A 44 3.780 -1.233 0.137 1.00 0.00 N ATOM 614 CA LYS A 44 3.523 -2.661 -0.005 1.00 0.00 C ATOM 615 C LYS A 44 2.335 -3.089 0.850 1.00 0.00 C ATOM 616 O LYS A 44 2.430 -3.149 2.076 1.00 0.00 O ATOM 617 CB LYS A 44 4.764 -3.465 0.388 1.00 0.00 C ATOM 618 CG LYS A 44 4.584 -4.968 0.254 1.00 0.00 C ATOM 619 CD LYS A 44 5.471 -5.725 1.228 1.00 0.00 C ATOM 620 CE LYS A 44 4.949 -7.131 1.479 1.00 0.00 C ATOM 621 NZ LYS A 44 5.985 -8.005 2.097 1.00 0.00 N ATOM 0 H LYS A 44 4.537 -1.003 0.781 1.00 0.00 H new ATOM 0 HA LYS A 44 3.285 -2.859 -1.050 1.00 0.00 H new ATOM 0 HB2 LYS A 44 5.602 -3.151 -0.234 1.00 0.00 H new ATOM 0 HB3 LYS A 44 5.027 -3.230 1.419 1.00 0.00 H new ATOM 0 HG2 LYS A 44 3.541 -5.228 0.433 1.00 0.00 H new ATOM 0 HG3 LYS A 44 4.818 -5.274 -0.766 1.00 0.00 H new ATOM 0 HD2 LYS A 44 6.485 -5.777 0.833 1.00 0.00 H new ATOM 0 HD3 LYS A 44 5.524 -5.182 2.171 1.00 0.00 H new ATOM 0 HE2 LYS A 44 4.077 -7.084 2.132 1.00 0.00 H new ATOM 0 HE3 LYS A 44 4.619 -7.569 0.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 5.590 -8.955 2.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 6.807 -8.071 1.463 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 6.282 -7.600 3.008 1.00 0.00 H new ATOM 635 N VAL A 45 1.217 -3.387 0.196 1.00 0.00 N ATOM 636 CA VAL A 45 0.011 -3.811 0.897 1.00 0.00 C ATOM 637 C VAL A 45 -0.269 -5.291 0.662 1.00 0.00 C ATOM 638 O VAL A 45 -0.136 -5.791 -0.456 1.00 0.00 O ATOM 639 CB VAL A 45 -1.215 -2.991 0.453 1.00 0.00 C ATOM 640 CG1 VAL A 45 -1.315 -2.960 -1.065 1.00 0.00 C ATOM 641 CG2 VAL A 45 -2.486 -3.558 1.068 1.00 0.00 C ATOM 0 H VAL A 45 1.121 -3.343 -0.819 1.00 0.00 H new ATOM 0 HA VAL A 45 0.186 -3.641 1.959 1.00 0.00 H new ATOM 0 HB VAL A 45 -1.093 -1.967 0.806 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -2.187 -2.376 -1.360 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -0.416 -2.504 -1.480 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -1.414 -3.977 -1.444 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -3.342 -2.967 0.744 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -2.616 -4.591 0.747 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -2.411 -3.523 2.155 1.00 0.00 H new ATOM 651 N THR A 46 -0.659 -5.990 1.724 1.00 0.00 N ATOM 652 CA THR A 46 -0.957 -7.414 1.634 1.00 0.00 C ATOM 653 C THR A 46 -2.434 -7.684 1.899 1.00 0.00 C ATOM 654 O THR A 46 -3.023 -8.593 1.314 1.00 0.00 O ATOM 655 CB THR A 46 -0.111 -8.229 2.630 1.00 0.00 C ATOM 656 OG1 THR A 46 -0.581 -8.010 3.965 1.00 0.00 O ATOM 657 CG2 THR A 46 1.357 -7.845 2.534 1.00 0.00 C ATOM 0 H THR A 46 -0.776 -5.593 2.656 1.00 0.00 H new ATOM 0 HA THR A 46 -0.710 -7.725 0.619 1.00 0.00 H new ATOM 0 HB THR A 46 -0.210 -9.285 2.379 1.00 0.00 H new ATOM 0 HG1 THR A 46 -0.039 -8.533 4.592 1.00 0.00 H new ATOM 0 HG21 THR A 46 1.934 -8.434 3.247 1.00 0.00 H new ATOM 0 HG22 THR A 46 1.719 -8.040 1.525 1.00 0.00 H new ATOM 0 HG23 THR A 46 1.472 -6.785 2.762 1.00 0.00 H new ATOM 665 N ARG A 47 -3.027 -6.888 2.783 1.00 0.00 N ATOM 666 CA ARG A 47 -4.436 -7.042 3.125 1.00 0.00 C ATOM 667 C ARG A 47 -5.252 -5.859 2.615 1.00 0.00 C ATOM 668 O ARG A 47 -5.193 -4.764 3.174 1.00 0.00 O ATOM 669 CB ARG A 47 -4.603 -7.176 4.640 1.00 0.00 C ATOM 670 CG ARG A 47 -4.401 -8.592 5.153 1.00 0.00 C ATOM 671 CD ARG A 47 -5.703 -9.378 5.143 1.00 0.00 C ATOM 672 NE ARG A 47 -6.540 -9.064 6.298 1.00 0.00 N ATOM 673 CZ ARG A 47 -6.350 -9.581 7.506 1.00 0.00 C ATOM 674 NH1 ARG A 47 -5.356 -10.433 7.718 1.00 0.00 N ATOM 675 NH2 ARG A 47 -7.155 -9.246 8.507 1.00 0.00 N ATOM 0 H ARG A 47 -2.554 -6.130 3.275 1.00 0.00 H new ATOM 0 HA ARG A 47 -4.804 -7.948 2.644 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -3.892 -6.515 5.135 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -5.601 -6.837 4.918 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -3.662 -9.102 4.535 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -4.002 -8.560 6.167 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -6.252 -9.159 4.227 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -5.482 -10.445 5.135 1.00 0.00 H new ATOM 0 HE ARG A 47 -7.313 -8.411 6.169 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -4.735 -10.693 6.952 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -5.213 -10.828 8.647 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -7.920 -8.591 8.348 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -7.008 -9.644 9.435 1.00 0.00 H new ATOM 689 N MET A 48 -6.012 -6.086 1.549 1.00 0.00 N ATOM 690 CA MET A 48 -6.841 -5.039 0.963 1.00 0.00 C ATOM 691 C MET A 48 -8.301 -5.208 1.372 1.00 0.00 C ATOM 692 O MET A 48 -8.921 -6.230 1.082 1.00 0.00 O ATOM 693 CB MET A 48 -6.720 -5.056 -0.562 1.00 0.00 C ATOM 694 CG MET A 48 -5.443 -4.414 -1.078 1.00 0.00 C ATOM 695 SD MET A 48 -5.202 -4.670 -2.846 1.00 0.00 S ATOM 696 CE MET A 48 -4.744 -3.019 -3.368 1.00 0.00 C ATOM 0 H MET A 48 -6.071 -6.986 1.073 1.00 0.00 H new ATOM 0 HA MET A 48 -6.487 -4.078 1.337 1.00 0.00 H new ATOM 0 HB2 MET A 48 -6.764 -6.088 -0.910 1.00 0.00 H new ATOM 0 HB3 MET A 48 -7.577 -4.537 -0.992 1.00 0.00 H new ATOM 0 HG2 MET A 48 -5.469 -3.344 -0.870 1.00 0.00 H new ATOM 0 HG3 MET A 48 -4.590 -4.823 -0.536 1.00 0.00 H new ATOM 0 HE1 MET A 48 -4.752 -2.966 -4.457 1.00 0.00 H new ATOM 0 HE2 MET A 48 -5.456 -2.299 -2.964 1.00 0.00 H new ATOM 0 HE3 MET A 48 -3.745 -2.785 -3.001 1.00 0.00 H new ATOM 706 N ASN A 49 -8.843 -4.199 2.047 1.00 0.00 N ATOM 707 CA ASN A 49 -10.230 -4.238 2.495 1.00 0.00 C ATOM 708 C ASN A 49 -11.159 -3.638 1.444 1.00 0.00 C ATOM 709 O ASN A 49 -10.922 -2.536 0.949 1.00 0.00 O ATOM 710 CB ASN A 49 -10.381 -3.482 3.817 1.00 0.00 C ATOM 711 CG ASN A 49 -9.396 -3.953 4.869 1.00 0.00 C ATOM 712 OD1 ASN A 49 -9.294 -5.147 5.149 1.00 0.00 O ATOM 713 ND2 ASN A 49 -8.665 -3.014 5.458 1.00 0.00 N ATOM 0 H ASN A 49 -8.343 -3.345 2.295 1.00 0.00 H new ATOM 0 HA ASN A 49 -10.508 -5.281 2.646 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -10.238 -2.416 3.641 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -11.397 -3.610 4.191 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -7.986 -3.271 6.174 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -8.783 -2.036 5.194 1.00 0.00 H new ATOM 720 N ILE A 50 -12.215 -4.371 1.109 1.00 0.00 N ATOM 721 CA ILE A 50 -13.180 -3.911 0.118 1.00 0.00 C ATOM 722 C ILE A 50 -13.686 -2.512 0.452 1.00 0.00 C ATOM 723 O ILE A 50 -13.897 -1.689 -0.438 1.00 0.00 O ATOM 724 CB ILE A 50 -14.382 -4.869 0.016 1.00 0.00 C ATOM 725 CG1 ILE A 50 -13.907 -6.284 -0.319 1.00 0.00 C ATOM 726 CG2 ILE A 50 -15.367 -4.372 -1.032 1.00 0.00 C ATOM 727 CD1 ILE A 50 -14.896 -7.361 0.069 1.00 0.00 C ATOM 0 H ILE A 50 -12.424 -5.286 1.509 1.00 0.00 H new ATOM 0 HA ILE A 50 -12.662 -3.888 -0.841 1.00 0.00 H new ATOM 0 HB ILE A 50 -14.890 -4.896 0.980 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -13.712 -6.349 -1.389 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -12.961 -6.471 0.189 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -16.211 -5.059 -1.093 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -15.725 -3.381 -0.754 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -14.871 -4.320 -2.001 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -14.493 -8.338 -0.198 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -15.073 -7.323 1.144 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -15.836 -7.199 -0.459 1.00 0.00 H new ATOM 739 N ASN A 51 -13.876 -2.249 1.741 1.00 0.00 N ATOM 740 CA ASN A 51 -14.356 -0.949 2.193 1.00 0.00 C ATOM 741 C ASN A 51 -13.627 0.181 1.472 1.00 0.00 C ATOM 742 O ASN A 51 -14.253 1.083 0.916 1.00 0.00 O ATOM 743 CB ASN A 51 -14.167 -0.809 3.705 1.00 0.00 C ATOM 744 CG ASN A 51 -12.804 -0.253 4.068 1.00 0.00 C ATOM 745 OD1 ASN A 51 -11.777 -0.884 3.817 1.00 0.00 O ATOM 746 ND2 ASN A 51 -12.789 0.934 4.663 1.00 0.00 N ATOM 0 H ASN A 51 -13.705 -2.919 2.491 1.00 0.00 H new ATOM 0 HA ASN A 51 -15.418 -0.881 1.958 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -14.942 -0.155 4.106 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -14.296 -1.783 4.176 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -11.901 1.359 4.932 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -13.665 1.421 4.851 1.00 0.00 H new ATOM 753 N GLY A 52 -12.299 0.125 1.486 1.00 0.00 N ATOM 754 CA GLY A 52 -11.506 1.148 0.830 1.00 0.00 C ATOM 755 C GLY A 52 -10.099 1.239 1.388 1.00 0.00 C ATOM 756 O GLY A 52 -9.124 1.167 0.642 1.00 0.00 O ATOM 0 H GLY A 52 -11.758 -0.611 1.940 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -11.457 0.936 -0.238 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -12.000 2.113 0.941 1.00 0.00 H new ATOM 760 N GLN A 53 -9.996 1.398 2.703 1.00 0.00 N ATOM 761 CA GLN A 53 -8.698 1.501 3.360 1.00 0.00 C ATOM 762 C GLN A 53 -7.980 0.156 3.361 1.00 0.00 C ATOM 763 O GLN A 53 -8.579 -0.878 3.656 1.00 0.00 O ATOM 764 CB GLN A 53 -8.867 2.003 4.795 1.00 0.00 C ATOM 765 CG GLN A 53 -8.841 3.518 4.917 1.00 0.00 C ATOM 766 CD GLN A 53 -9.678 4.025 6.075 1.00 0.00 C ATOM 767 OE1 GLN A 53 -9.176 4.710 6.966 1.00 0.00 O ATOM 768 NE2 GLN A 53 -10.963 3.691 6.067 1.00 0.00 N ATOM 0 H GLN A 53 -10.795 1.458 3.334 1.00 0.00 H new ATOM 0 HA GLN A 53 -8.093 2.215 2.802 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -9.811 1.631 5.192 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -8.074 1.583 5.414 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -7.811 3.851 5.045 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -9.205 3.960 3.990 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -11.337 3.121 5.308 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -11.576 4.004 6.820 1.00 0.00 H new ATOM 777 N TRP A 54 -6.694 0.177 3.028 1.00 0.00 N ATOM 778 CA TRP A 54 -5.895 -1.042 2.990 1.00 0.00 C ATOM 779 C TRP A 54 -4.812 -1.016 4.063 1.00 0.00 C ATOM 780 O TRP A 54 -4.522 0.032 4.639 1.00 0.00 O ATOM 781 CB TRP A 54 -5.258 -1.216 1.610 1.00 0.00 C ATOM 782 CG TRP A 54 -6.221 -1.003 0.481 1.00 0.00 C ATOM 783 CD1 TRP A 54 -7.550 -1.315 0.467 1.00 0.00 C ATOM 784 CD2 TRP A 54 -5.928 -0.433 -0.800 1.00 0.00 C ATOM 785 NE1 TRP A 54 -8.101 -0.973 -0.744 1.00 0.00 N ATOM 786 CE2 TRP A 54 -7.127 -0.430 -1.539 1.00 0.00 C ATOM 787 CE3 TRP A 54 -4.769 0.077 -1.393 1.00 0.00 C ATOM 788 CZ2 TRP A 54 -7.198 0.062 -2.839 1.00 0.00 C ATOM 789 CZ3 TRP A 54 -4.841 0.564 -2.684 1.00 0.00 C ATOM 790 CH2 TRP A 54 -6.049 0.555 -3.395 1.00 0.00 C ATOM 0 H TRP A 54 -6.183 1.024 2.781 1.00 0.00 H new ATOM 0 HA TRP A 54 -6.556 -1.886 3.187 1.00 0.00 H new ATOM 0 HB2 TRP A 54 -4.430 -0.515 1.509 1.00 0.00 H new ATOM 0 HB3 TRP A 54 -4.838 -2.219 1.535 1.00 0.00 H new ATOM 0 HD1 TRP A 54 -8.089 -1.765 1.288 1.00 0.00 H new ATOM 0 HE1 TRP A 54 -9.078 -1.103 -1.008 1.00 0.00 H new ATOM 0 HE3 TRP A 54 -3.834 0.090 -0.852 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 -8.127 0.055 -3.389 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 -3.952 0.958 -3.153 1.00 0.00 H new ATOM 0 HH2 TRP A 54 -6.073 0.945 -4.402 1.00 0.00 H new ATOM 801 N GLU A 55 -4.217 -2.176 4.325 1.00 0.00 N ATOM 802 CA GLU A 55 -3.166 -2.284 5.330 1.00 0.00 C ATOM 803 C GLU A 55 -1.805 -2.494 4.674 1.00 0.00 C ATOM 804 O GLU A 55 -1.498 -3.583 4.189 1.00 0.00 O ATOM 805 CB GLU A 55 -3.465 -3.438 6.290 1.00 0.00 C ATOM 806 CG GLU A 55 -2.872 -3.246 7.676 1.00 0.00 C ATOM 807 CD GLU A 55 -3.328 -4.307 8.658 1.00 0.00 C ATOM 808 OE1 GLU A 55 -3.513 -5.467 8.234 1.00 0.00 O ATOM 809 OE2 GLU A 55 -3.501 -3.978 9.850 1.00 0.00 O ATOM 0 H GLU A 55 -4.445 -3.053 3.856 1.00 0.00 H new ATOM 0 HA GLU A 55 -3.139 -1.350 5.892 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -4.545 -3.555 6.379 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -3.078 -4.364 5.864 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -1.784 -3.263 7.607 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -3.152 -2.263 8.054 1.00 0.00 H new ATOM 816 N GLY A 56 -0.991 -1.443 4.662 1.00 0.00 N ATOM 817 CA GLY A 56 0.327 -1.531 4.062 1.00 0.00 C ATOM 818 C GLY A 56 1.419 -1.028 4.985 1.00 0.00 C ATOM 819 O GLY A 56 1.183 -0.150 5.814 1.00 0.00 O ATOM 0 H GLY A 56 -1.221 -0.531 5.058 1.00 0.00 H new ATOM 0 HA2 GLY A 56 0.532 -2.567 3.793 1.00 0.00 H new ATOM 0 HA3 GLY A 56 0.342 -0.953 3.138 1.00 0.00 H new ATOM 823 N GLU A 57 2.617 -1.586 4.842 1.00 0.00 N ATOM 824 CA GLU A 57 3.748 -1.189 5.672 1.00 0.00 C ATOM 825 C GLU A 57 4.772 -0.403 4.858 1.00 0.00 C ATOM 826 O GLU A 57 5.184 -0.831 3.779 1.00 0.00 O ATOM 827 CB GLU A 57 4.411 -2.421 6.292 1.00 0.00 C ATOM 828 CG GLU A 57 5.218 -2.113 7.542 1.00 0.00 C ATOM 829 CD GLU A 57 6.665 -1.779 7.235 1.00 0.00 C ATOM 830 OE1 GLU A 57 6.950 -0.600 6.936 1.00 0.00 O ATOM 831 OE2 GLU A 57 7.511 -2.695 7.293 1.00 0.00 O ATOM 0 H GLU A 57 2.829 -2.314 4.160 1.00 0.00 H new ATOM 0 HA GLU A 57 3.373 -0.547 6.469 1.00 0.00 H new ATOM 0 HB2 GLU A 57 3.641 -3.153 6.538 1.00 0.00 H new ATOM 0 HB3 GLU A 57 5.065 -2.883 5.552 1.00 0.00 H new ATOM 0 HG2 GLU A 57 4.760 -1.276 8.069 1.00 0.00 H new ATOM 0 HG3 GLU A 57 5.182 -2.971 8.214 1.00 0.00 H new ATOM 838 N VAL A 58 5.177 0.749 5.381 1.00 0.00 N ATOM 839 CA VAL A 58 6.152 1.596 4.705 1.00 0.00 C ATOM 840 C VAL A 58 7.131 2.210 5.699 1.00 0.00 C ATOM 841 O VAL A 58 6.728 2.873 6.654 1.00 0.00 O ATOM 842 CB VAL A 58 5.464 2.725 3.915 1.00 0.00 C ATOM 843 CG1 VAL A 58 6.481 3.765 3.473 1.00 0.00 C ATOM 844 CG2 VAL A 58 4.715 2.157 2.718 1.00 0.00 C ATOM 0 H VAL A 58 4.845 1.118 6.272 1.00 0.00 H new ATOM 0 HA VAL A 58 6.697 0.957 4.010 1.00 0.00 H new ATOM 0 HB VAL A 58 4.742 3.214 4.569 1.00 0.00 H new ATOM 0 HG11 VAL A 58 5.976 4.554 2.916 1.00 0.00 H new ATOM 0 HG12 VAL A 58 6.968 4.193 4.349 1.00 0.00 H new ATOM 0 HG13 VAL A 58 7.230 3.294 2.836 1.00 0.00 H new ATOM 0 HG21 VAL A 58 4.235 2.968 2.171 1.00 0.00 H new ATOM 0 HG22 VAL A 58 5.416 1.642 2.061 1.00 0.00 H new ATOM 0 HG23 VAL A 58 3.957 1.454 3.063 1.00 0.00 H new ATOM 854 N ASN A 59 8.421 1.985 5.468 1.00 0.00 N ATOM 855 CA ASN A 59 9.458 2.517 6.344 1.00 0.00 C ATOM 856 C ASN A 59 9.176 2.160 7.800 1.00 0.00 C ATOM 857 O ASN A 59 9.181 3.025 8.674 1.00 0.00 O ATOM 858 CB ASN A 59 9.557 4.036 6.189 1.00 0.00 C ATOM 859 CG ASN A 59 10.043 4.446 4.812 1.00 0.00 C ATOM 860 OD1 ASN A 59 11.068 3.959 4.333 1.00 0.00 O ATOM 861 ND2 ASN A 59 9.309 5.347 4.170 1.00 0.00 N ATOM 0 H ASN A 59 8.772 1.438 4.682 1.00 0.00 H new ATOM 0 HA ASN A 59 10.408 2.067 6.056 1.00 0.00 H new ATOM 0 HB2 ASN A 59 8.580 4.482 6.374 1.00 0.00 H new ATOM 0 HB3 ASN A 59 10.236 4.432 6.944 1.00 0.00 H new ATOM 0 HD21 ASN A 59 9.587 5.663 3.241 1.00 0.00 H new ATOM 0 HD22 ASN A 59 8.467 5.723 4.606 1.00 0.00 H new ATOM 868 N GLY A 60 8.931 0.878 8.053 1.00 0.00 N ATOM 869 CA GLY A 60 8.651 0.428 9.404 1.00 0.00 C ATOM 870 C GLY A 60 7.439 1.114 10.003 1.00 0.00 C ATOM 871 O GLY A 60 7.457 1.515 11.167 1.00 0.00 O ATOM 0 H GLY A 60 8.921 0.143 7.346 1.00 0.00 H new ATOM 0 HA2 GLY A 60 8.489 -0.650 9.399 1.00 0.00 H new ATOM 0 HA3 GLY A 60 9.520 0.617 10.034 1.00 0.00 H new ATOM 875 N ARG A 61 6.384 1.252 9.206 1.00 0.00 N ATOM 876 CA ARG A 61 5.160 1.897 9.664 1.00 0.00 C ATOM 877 C ARG A 61 3.954 1.398 8.873 1.00 0.00 C ATOM 878 O ARG A 61 3.790 1.726 7.698 1.00 0.00 O ATOM 879 CB ARG A 61 5.278 3.416 9.531 1.00 0.00 C ATOM 880 CG ARG A 61 6.484 3.998 10.250 1.00 0.00 C ATOM 881 CD ARG A 61 6.628 5.488 9.979 1.00 0.00 C ATOM 882 NE ARG A 61 5.851 6.292 10.919 1.00 0.00 N ATOM 883 CZ ARG A 61 4.563 6.571 10.758 1.00 0.00 C ATOM 884 NH1 ARG A 61 3.909 6.112 9.699 1.00 0.00 N ATOM 885 NH2 ARG A 61 3.925 7.309 11.657 1.00 0.00 N ATOM 0 H ARG A 61 6.353 0.926 8.240 1.00 0.00 H new ATOM 0 HA ARG A 61 5.015 1.642 10.714 1.00 0.00 H new ATOM 0 HB2 ARG A 61 5.335 3.676 8.474 1.00 0.00 H new ATOM 0 HB3 ARG A 61 4.373 3.878 9.925 1.00 0.00 H new ATOM 0 HG2 ARG A 61 6.386 3.830 11.322 1.00 0.00 H new ATOM 0 HG3 ARG A 61 7.387 3.479 9.927 1.00 0.00 H new ATOM 0 HD2 ARG A 61 7.679 5.769 10.044 1.00 0.00 H new ATOM 0 HD3 ARG A 61 6.303 5.705 8.961 1.00 0.00 H new ATOM 0 HE ARG A 61 6.324 6.659 11.745 1.00 0.00 H new ATOM 0 HH11 ARG A 61 4.396 5.543 9.006 1.00 0.00 H new ATOM 0 HH12 ARG A 61 2.919 6.328 9.578 1.00 0.00 H new ATOM 0 HH21 ARG A 61 4.424 7.663 12.473 1.00 0.00 H new ATOM 0 HH22 ARG A 61 2.935 7.523 11.532 1.00 0.00 H new ATOM 899 N LYS A 62 3.113 0.603 9.525 1.00 0.00 N ATOM 900 CA LYS A 62 1.921 0.059 8.884 1.00 0.00 C ATOM 901 C LYS A 62 0.682 0.859 9.272 1.00 0.00 C ATOM 902 O LYS A 62 0.348 0.973 10.450 1.00 0.00 O ATOM 903 CB LYS A 62 1.735 -1.410 9.271 1.00 0.00 C ATOM 904 CG LYS A 62 1.939 -1.680 10.751 1.00 0.00 C ATOM 905 CD LYS A 62 1.665 -3.134 11.096 1.00 0.00 C ATOM 906 CE LYS A 62 2.260 -3.509 12.445 1.00 0.00 C ATOM 907 NZ LYS A 62 1.537 -2.856 13.571 1.00 0.00 N ATOM 0 H LYS A 62 3.235 0.321 10.498 1.00 0.00 H new ATOM 0 HA LYS A 62 2.054 0.130 7.805 1.00 0.00 H new ATOM 0 HB2 LYS A 62 0.732 -1.727 8.987 1.00 0.00 H new ATOM 0 HB3 LYS A 62 2.435 -2.019 8.699 1.00 0.00 H new ATOM 0 HG2 LYS A 62 2.961 -1.425 11.031 1.00 0.00 H new ATOM 0 HG3 LYS A 62 1.280 -1.037 11.333 1.00 0.00 H new ATOM 0 HD2 LYS A 62 0.589 -3.309 11.110 1.00 0.00 H new ATOM 0 HD3 LYS A 62 2.082 -3.778 10.322 1.00 0.00 H new ATOM 0 HE2 LYS A 62 2.224 -4.591 12.569 1.00 0.00 H new ATOM 0 HE3 LYS A 62 3.311 -3.220 12.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 1.973 -3.137 14.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 1.593 -1.823 13.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 0.540 -3.152 13.561 1.00 0.00 H new ATOM 921 N GLY A 63 0.002 1.410 8.271 1.00 0.00 N ATOM 922 CA GLY A 63 -1.194 2.191 8.528 1.00 0.00 C ATOM 923 C GLY A 63 -2.154 2.187 7.355 1.00 0.00 C ATOM 924 O GLY A 63 -1.810 1.728 6.264 1.00 0.00 O ATOM 0 H GLY A 63 0.258 1.329 7.287 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -1.700 1.795 9.409 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -0.911 3.218 8.758 1.00 0.00 H new ATOM 928 N LEU A 64 -3.360 2.696 7.577 1.00 0.00 N ATOM 929 CA LEU A 64 -4.374 2.747 6.529 1.00 0.00 C ATOM 930 C LEU A 64 -4.187 3.980 5.650 1.00 0.00 C ATOM 931 O LEU A 64 -4.081 5.101 6.150 1.00 0.00 O ATOM 932 CB LEU A 64 -5.773 2.754 7.146 1.00 0.00 C ATOM 933 CG LEU A 64 -6.162 1.508 7.942 1.00 0.00 C ATOM 934 CD1 LEU A 64 -7.604 1.606 8.417 1.00 0.00 C ATOM 935 CD2 LEU A 64 -5.958 0.255 7.104 1.00 0.00 C ATOM 0 H LEU A 64 -3.660 3.079 8.473 1.00 0.00 H new ATOM 0 HA LEU A 64 -4.263 1.859 5.906 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -5.854 3.620 7.803 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -6.500 2.891 6.346 1.00 0.00 H new ATOM 0 HG LEU A 64 -5.517 1.444 8.818 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -7.863 0.710 8.982 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -7.718 2.483 9.055 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -8.266 1.696 7.555 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -6.240 -0.622 7.686 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -6.578 0.311 6.209 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -4.910 0.177 6.815 1.00 0.00 H new ATOM 947 N PHE A 65 -4.149 3.766 4.339 1.00 0.00 N ATOM 948 CA PHE A 65 -3.976 4.860 3.391 1.00 0.00 C ATOM 949 C PHE A 65 -5.050 4.816 2.308 1.00 0.00 C ATOM 950 O PHE A 65 -5.474 3.749 1.862 1.00 0.00 O ATOM 951 CB PHE A 65 -2.587 4.794 2.751 1.00 0.00 C ATOM 952 CG PHE A 65 -2.326 3.510 2.018 1.00 0.00 C ATOM 953 CD1 PHE A 65 -1.880 2.387 2.696 1.00 0.00 C ATOM 954 CD2 PHE A 65 -2.526 3.425 0.649 1.00 0.00 C ATOM 955 CE1 PHE A 65 -1.639 1.204 2.024 1.00 0.00 C ATOM 956 CE2 PHE A 65 -2.287 2.245 -0.028 1.00 0.00 C ATOM 957 CZ PHE A 65 -1.841 1.133 0.660 1.00 0.00 C ATOM 0 H PHE A 65 -4.236 2.845 3.909 1.00 0.00 H new ATOM 0 HA PHE A 65 -4.073 5.799 3.936 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -2.475 5.628 2.058 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -1.832 4.920 3.527 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -1.719 2.437 3.763 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -2.873 4.291 0.105 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -1.293 0.336 2.565 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -2.449 2.192 -1.094 1.00 0.00 H new ATOM 0 HZ PHE A 65 -1.651 0.210 0.132 1.00 0.00 H new ATOM 967 N PRO A 66 -5.501 6.002 1.874 1.00 0.00 N ATOM 968 CA PRO A 66 -6.531 6.126 0.839 1.00 0.00 C ATOM 969 C PRO A 66 -6.024 5.706 -0.537 1.00 0.00 C ATOM 970 O PRO A 66 -4.882 5.987 -0.901 1.00 0.00 O ATOM 971 CB PRO A 66 -6.868 7.619 0.851 1.00 0.00 C ATOM 972 CG PRO A 66 -5.642 8.280 1.379 1.00 0.00 C ATOM 973 CD PRO A 66 -5.041 7.313 2.361 1.00 0.00 C ATOM 0 HA PRO A 66 -7.386 5.480 1.036 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -7.112 7.978 -0.149 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -7.732 7.825 1.483 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -4.942 8.504 0.574 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -5.886 9.226 1.862 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -3.953 7.378 2.374 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -5.384 7.507 3.377 1.00 0.00 H new ATOM 981 N PHE A 67 -6.880 5.032 -1.298 1.00 0.00 N ATOM 982 CA PHE A 67 -6.518 4.573 -2.633 1.00 0.00 C ATOM 983 C PHE A 67 -6.485 5.738 -3.619 1.00 0.00 C ATOM 984 O PHE A 67 -5.820 5.673 -4.653 1.00 0.00 O ATOM 985 CB PHE A 67 -7.507 3.510 -3.116 1.00 0.00 C ATOM 986 CG PHE A 67 -8.922 4.006 -3.210 1.00 0.00 C ATOM 987 CD1 PHE A 67 -9.772 3.929 -2.118 1.00 0.00 C ATOM 988 CD2 PHE A 67 -9.402 4.550 -4.390 1.00 0.00 C ATOM 989 CE1 PHE A 67 -11.074 4.385 -2.201 1.00 0.00 C ATOM 990 CE2 PHE A 67 -10.703 5.008 -4.479 1.00 0.00 C ATOM 991 CZ PHE A 67 -11.540 4.924 -3.384 1.00 0.00 C ATOM 0 H PHE A 67 -7.829 4.792 -1.012 1.00 0.00 H new ATOM 0 HA PHE A 67 -5.521 4.135 -2.581 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -7.191 3.149 -4.095 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -7.473 2.658 -2.436 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -9.413 3.508 -1.191 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -8.752 4.617 -5.250 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -11.726 4.320 -1.342 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -11.065 5.431 -5.404 1.00 0.00 H new ATOM 0 HZ PHE A 67 -12.558 5.279 -3.453 1.00 0.00 H new ATOM 1001 N THR A 68 -7.209 6.803 -3.290 1.00 0.00 N ATOM 1002 CA THR A 68 -7.265 7.982 -4.146 1.00 0.00 C ATOM 1003 C THR A 68 -6.009 8.832 -3.993 1.00 0.00 C ATOM 1004 O THR A 68 -5.932 9.943 -4.520 1.00 0.00 O ATOM 1005 CB THR A 68 -8.499 8.848 -3.829 1.00 0.00 C ATOM 1006 OG1 THR A 68 -8.672 8.954 -2.411 1.00 0.00 O ATOM 1007 CG2 THR A 68 -9.752 8.254 -4.454 1.00 0.00 C ATOM 0 H THR A 68 -7.765 6.874 -2.437 1.00 0.00 H new ATOM 0 HA THR A 68 -7.336 7.624 -5.173 1.00 0.00 H new ATOM 0 HB THR A 68 -8.337 9.840 -4.250 1.00 0.00 H new ATOM 0 HG1 THR A 68 -9.457 9.507 -2.218 1.00 0.00 H new ATOM 0 HG21 THR A 68 -10.610 8.883 -4.217 1.00 0.00 H new ATOM 0 HG22 THR A 68 -9.629 8.201 -5.536 1.00 0.00 H new ATOM 0 HG23 THR A 68 -9.916 7.252 -4.058 1.00 0.00 H new ATOM 1015 N HIS A 69 -5.027 8.304 -3.270 1.00 0.00 N ATOM 1016 CA HIS A 69 -3.773 9.015 -3.050 1.00 0.00 C ATOM 1017 C HIS A 69 -2.620 8.320 -3.768 1.00 0.00 C ATOM 1018 O HIS A 69 -1.643 8.958 -4.159 1.00 0.00 O ATOM 1019 CB HIS A 69 -3.472 9.111 -1.553 1.00 0.00 C ATOM 1020 CG HIS A 69 -4.116 10.288 -0.888 1.00 0.00 C ATOM 1021 ND1 HIS A 69 -3.490 11.037 0.087 1.00 0.00 N ATOM 1022 CD2 HIS A 69 -5.337 10.846 -1.062 1.00 0.00 C ATOM 1023 CE1 HIS A 69 -4.298 12.003 0.484 1.00 0.00 C ATOM 1024 NE2 HIS A 69 -5.426 11.910 -0.198 1.00 0.00 N ATOM 0 H HIS A 69 -5.075 7.387 -2.827 1.00 0.00 H new ATOM 0 HA HIS A 69 -3.879 10.020 -3.458 1.00 0.00 H new ATOM 0 HB2 HIS A 69 -3.810 8.198 -1.063 1.00 0.00 H new ATOM 0 HB3 HIS A 69 -2.393 9.169 -1.411 1.00 0.00 H new ATOM 0 HD2 HIS A 69 -6.099 10.516 -1.752 1.00 0.00 H new ATOM 0 HE1 HIS A 69 -4.075 12.743 1.238 1.00 0.00 H new ATOM 0 HE2 HIS A 69 -6.232 12.528 -0.099 1.00 0.00 H new ATOM 1033 N VAL A 70 -2.741 7.007 -3.938 1.00 0.00 N ATOM 1034 CA VAL A 70 -1.710 6.224 -4.610 1.00 0.00 C ATOM 1035 C VAL A 70 -2.169 5.786 -5.996 1.00 0.00 C ATOM 1036 O VAL A 70 -3.366 5.736 -6.279 1.00 0.00 O ATOM 1037 CB VAL A 70 -1.328 4.978 -3.789 1.00 0.00 C ATOM 1038 CG1 VAL A 70 -0.943 5.370 -2.371 1.00 0.00 C ATOM 1039 CG2 VAL A 70 -2.470 3.974 -3.782 1.00 0.00 C ATOM 0 H VAL A 70 -3.543 6.463 -3.620 1.00 0.00 H new ATOM 0 HA VAL A 70 -0.836 6.868 -4.707 1.00 0.00 H new ATOM 0 HB VAL A 70 -0.464 4.507 -4.257 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -0.676 4.477 -1.806 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -0.091 6.049 -2.400 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -1.786 5.866 -1.889 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -2.183 3.100 -3.197 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -3.354 4.432 -3.339 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -2.693 3.669 -4.805 1.00 0.00 H new ATOM 1049 N LYS A 71 -1.209 5.467 -6.857 1.00 0.00 N ATOM 1050 CA LYS A 71 -1.512 5.030 -8.215 1.00 0.00 C ATOM 1051 C LYS A 71 -0.958 3.632 -8.473 1.00 0.00 C ATOM 1052 O LYS A 71 0.225 3.373 -8.249 1.00 0.00 O ATOM 1053 CB LYS A 71 -0.933 6.016 -9.231 1.00 0.00 C ATOM 1054 CG LYS A 71 -1.483 5.834 -10.636 1.00 0.00 C ATOM 1055 CD LYS A 71 -2.756 6.637 -10.844 1.00 0.00 C ATOM 1056 CE LYS A 71 -2.451 8.068 -11.258 1.00 0.00 C ATOM 1057 NZ LYS A 71 -3.526 8.638 -12.117 1.00 0.00 N ATOM 0 H LYS A 71 -0.213 5.503 -6.638 1.00 0.00 H new ATOM 0 HA LYS A 71 -2.596 4.998 -8.327 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -1.141 7.033 -8.897 1.00 0.00 H new ATOM 0 HB3 LYS A 71 0.151 5.904 -9.257 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -0.733 6.143 -11.364 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -1.684 4.778 -10.815 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -3.368 6.159 -11.608 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -3.340 6.640 -9.924 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -2.331 8.686 -10.368 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -1.503 8.096 -11.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -3.281 9.614 -12.378 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -3.623 8.063 -12.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -4.426 8.635 -11.595 1.00 0.00 H new ATOM 1071 N ILE A 72 -1.818 2.738 -8.947 1.00 0.00 N ATOM 1072 CA ILE A 72 -1.413 1.368 -9.238 1.00 0.00 C ATOM 1073 C ILE A 72 -0.590 1.299 -10.520 1.00 0.00 C ATOM 1074 O ILE A 72 -1.041 1.726 -11.583 1.00 0.00 O ATOM 1075 CB ILE A 72 -2.632 0.437 -9.373 1.00 0.00 C ATOM 1076 CG1 ILE A 72 -3.429 0.411 -8.067 1.00 0.00 C ATOM 1077 CG2 ILE A 72 -2.186 -0.967 -9.755 1.00 0.00 C ATOM 1078 CD1 ILE A 72 -2.819 -0.476 -7.004 1.00 0.00 C ATOM 0 H ILE A 72 -2.800 2.937 -9.138 1.00 0.00 H new ATOM 0 HA ILE A 72 -0.803 1.034 -8.399 1.00 0.00 H new ATOM 0 HB ILE A 72 -3.278 0.820 -10.163 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -3.509 1.427 -7.679 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -4.443 0.069 -8.276 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -3.059 -1.614 -9.847 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -1.657 -0.934 -10.707 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -1.522 -1.360 -8.985 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -3.437 -0.446 -6.106 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -2.764 -1.500 -7.372 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -1.816 -0.122 -6.766 1.00 0.00 H new ATOM 1090 N PHE A 73 0.618 0.757 -10.413 1.00 0.00 N ATOM 1091 CA PHE A 73 1.505 0.631 -11.564 1.00 0.00 C ATOM 1092 C PHE A 73 2.334 -0.647 -11.474 1.00 0.00 C ATOM 1093 O PHE A 73 2.208 -1.416 -10.521 1.00 0.00 O ATOM 1094 CB PHE A 73 2.429 1.846 -11.658 1.00 0.00 C ATOM 1095 CG PHE A 73 3.489 1.877 -10.595 1.00 0.00 C ATOM 1096 CD1 PHE A 73 3.144 1.905 -9.254 1.00 0.00 C ATOM 1097 CD2 PHE A 73 4.832 1.878 -10.937 1.00 0.00 C ATOM 1098 CE1 PHE A 73 4.117 1.933 -8.273 1.00 0.00 C ATOM 1099 CE2 PHE A 73 5.810 1.906 -9.961 1.00 0.00 C ATOM 1100 CZ PHE A 73 5.452 1.934 -8.627 1.00 0.00 C ATOM 0 H PHE A 73 1.006 0.398 -9.541 1.00 0.00 H new ATOM 0 HA PHE A 73 0.889 0.581 -12.462 1.00 0.00 H new ATOM 0 HB2 PHE A 73 2.908 1.853 -12.637 1.00 0.00 H new ATOM 0 HB3 PHE A 73 1.830 2.754 -11.589 1.00 0.00 H new ATOM 0 HD1 PHE A 73 2.102 1.905 -8.971 1.00 0.00 H new ATOM 0 HD2 PHE A 73 5.118 1.857 -11.978 1.00 0.00 H new ATOM 0 HE1 PHE A 73 3.834 1.954 -7.231 1.00 0.00 H new ATOM 0 HE2 PHE A 73 6.853 1.906 -10.241 1.00 0.00 H new ATOM 0 HZ PHE A 73 6.215 1.957 -7.862 1.00 0.00 H new ATOM 1110 N ASP A 74 3.181 -0.866 -12.474 1.00 0.00 N ATOM 1111 CA ASP A 74 4.032 -2.050 -12.509 1.00 0.00 C ATOM 1112 C ASP A 74 5.483 -1.685 -12.213 1.00 0.00 C ATOM 1113 O ASP A 74 6.299 -1.502 -13.116 1.00 0.00 O ATOM 1114 CB ASP A 74 3.933 -2.735 -13.873 1.00 0.00 C ATOM 1115 CG ASP A 74 4.198 -4.226 -13.793 1.00 0.00 C ATOM 1116 OD1 ASP A 74 3.877 -4.829 -12.748 1.00 0.00 O ATOM 1117 OD2 ASP A 74 4.726 -4.789 -14.775 1.00 0.00 O ATOM 0 H ASP A 74 3.297 -0.240 -13.271 1.00 0.00 H new ATOM 0 HA ASP A 74 3.686 -2.739 -11.739 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.940 -2.567 -14.289 1.00 0.00 H new ATOM 0 HB3 ASP A 74 4.647 -2.278 -14.558 1.00 0.00 H new ATOM 1122 N PRO A 75 5.814 -1.576 -10.917 1.00 0.00 N ATOM 1123 CA PRO A 75 7.167 -1.232 -10.472 1.00 0.00 C ATOM 1124 C PRO A 75 8.166 -2.353 -10.733 1.00 0.00 C ATOM 1125 O PRO A 75 9.365 -2.194 -10.503 1.00 0.00 O ATOM 1126 CB PRO A 75 6.999 -1.005 -8.967 1.00 0.00 C ATOM 1127 CG PRO A 75 5.805 -1.815 -8.594 1.00 0.00 C ATOM 1128 CD PRO A 75 4.892 -1.781 -9.787 1.00 0.00 C ATOM 0 HA PRO A 75 7.564 -0.368 -11.006 1.00 0.00 H new ATOM 0 HB2 PRO A 75 7.883 -1.326 -8.417 1.00 0.00 H new ATOM 0 HB3 PRO A 75 6.848 0.050 -8.740 1.00 0.00 H new ATOM 0 HG2 PRO A 75 6.089 -2.838 -8.349 1.00 0.00 H new ATOM 0 HG3 PRO A 75 5.312 -1.402 -7.714 1.00 0.00 H new ATOM 0 HD2 PRO A 75 4.331 -2.710 -9.890 1.00 0.00 H new ATOM 0 HD3 PRO A 75 4.163 -0.974 -9.712 1.00 0.00 H new ATOM 1136 N GLN A 76 7.665 -3.486 -11.216 1.00 0.00 N ATOM 1137 CA GLN A 76 8.515 -4.634 -11.508 1.00 0.00 C ATOM 1138 C GLN A 76 8.688 -4.814 -13.012 1.00 0.00 C ATOM 1139 O GLN A 76 8.517 -5.913 -13.539 1.00 0.00 O ATOM 1140 CB GLN A 76 7.923 -5.903 -10.894 1.00 0.00 C ATOM 1141 CG GLN A 76 6.535 -6.240 -11.415 1.00 0.00 C ATOM 1142 CD GLN A 76 6.054 -7.602 -10.955 1.00 0.00 C ATOM 1143 OE1 GLN A 76 6.214 -7.969 -9.790 1.00 0.00 O ATOM 1144 NE2 GLN A 76 5.460 -8.361 -11.869 1.00 0.00 N ATOM 0 H GLN A 76 6.675 -3.633 -11.413 1.00 0.00 H new ATOM 0 HA GLN A 76 9.495 -4.450 -11.068 1.00 0.00 H new ATOM 0 HB2 GLN A 76 8.591 -6.740 -11.096 1.00 0.00 H new ATOM 0 HB3 GLN A 76 7.877 -5.786 -9.811 1.00 0.00 H new ATOM 0 HG2 GLN A 76 5.831 -5.478 -11.081 1.00 0.00 H new ATOM 0 HG3 GLN A 76 6.543 -6.211 -12.505 1.00 0.00 H new ATOM 0 HE21 GLN A 76 5.348 -8.017 -12.823 1.00 0.00 H new ATOM 0 HE22 GLN A 76 5.116 -9.287 -11.617 1.00 0.00 H new ATOM 1153 N ASN A 77 9.027 -3.728 -13.699 1.00 0.00 N ATOM 1154 CA ASN A 77 9.221 -3.767 -15.144 1.00 0.00 C ATOM 1155 C ASN A 77 10.637 -3.335 -15.514 1.00 0.00 C ATOM 1156 O ASN A 77 11.174 -2.361 -14.986 1.00 0.00 O ATOM 1157 CB ASN A 77 8.202 -2.863 -15.841 1.00 0.00 C ATOM 1158 CG ASN A 77 6.924 -3.599 -16.195 1.00 0.00 C ATOM 1159 OD1 ASN A 77 6.910 -4.826 -16.299 1.00 0.00 O ATOM 1160 ND2 ASN A 77 5.843 -2.851 -16.383 1.00 0.00 N ATOM 0 H ASN A 77 9.173 -2.810 -13.278 1.00 0.00 H new ATOM 0 HA ASN A 77 9.074 -4.794 -15.478 1.00 0.00 H new ATOM 0 HB2 ASN A 77 7.965 -2.020 -15.192 1.00 0.00 H new ATOM 0 HB3 ASN A 77 8.645 -2.453 -16.748 1.00 0.00 H new ATOM 0 HD21 ASN A 77 4.955 -3.290 -16.624 1.00 0.00 H new ATOM 0 HD22 ASN A 77 5.901 -1.837 -16.286 1.00 0.00 H new ATOM 1167 N PRO A 78 11.258 -4.076 -16.444 1.00 0.00 N ATOM 1168 CA PRO A 78 12.619 -3.789 -16.907 1.00 0.00 C ATOM 1169 C PRO A 78 12.691 -2.511 -17.735 1.00 0.00 C ATOM 1170 O PRO A 78 13.777 -2.006 -18.022 1.00 0.00 O ATOM 1171 CB PRO A 78 12.965 -5.006 -17.768 1.00 0.00 C ATOM 1172 CG PRO A 78 11.648 -5.529 -18.230 1.00 0.00 C ATOM 1173 CD PRO A 78 10.678 -5.251 -17.116 1.00 0.00 C ATOM 0 HA PRO A 78 13.307 -3.629 -16.077 1.00 0.00 H new ATOM 0 HB2 PRO A 78 13.598 -4.728 -18.610 1.00 0.00 H new ATOM 0 HB3 PRO A 78 13.509 -5.756 -17.194 1.00 0.00 H new ATOM 0 HG2 PRO A 78 11.335 -5.038 -19.152 1.00 0.00 H new ATOM 0 HG3 PRO A 78 11.704 -6.597 -18.441 1.00 0.00 H new ATOM 0 HD2 PRO A 78 9.678 -5.043 -17.496 1.00 0.00 H new ATOM 0 HD3 PRO A 78 10.591 -6.100 -16.438 1.00 0.00 H new ATOM 1181 N ASP A 79 11.530 -1.992 -18.118 1.00 0.00 N ATOM 1182 CA ASP A 79 11.462 -0.772 -18.913 1.00 0.00 C ATOM 1183 C ASP A 79 12.234 0.359 -18.240 1.00 0.00 C ATOM 1184 O ASP A 79 12.333 0.411 -17.014 1.00 0.00 O ATOM 1185 CB ASP A 79 10.005 -0.356 -19.125 1.00 0.00 C ATOM 1186 CG ASP A 79 9.801 0.394 -20.426 1.00 0.00 C ATOM 1187 OD1 ASP A 79 10.748 1.073 -20.874 1.00 0.00 O ATOM 1188 OD2 ASP A 79 8.693 0.302 -20.996 1.00 0.00 O ATOM 0 H ASP A 79 10.622 -2.398 -17.890 1.00 0.00 H new ATOM 0 HA ASP A 79 11.919 -0.973 -19.882 1.00 0.00 H new ATOM 0 HB2 ASP A 79 9.372 -1.243 -19.117 1.00 0.00 H new ATOM 0 HB3 ASP A 79 9.685 0.271 -18.293 1.00 0.00 H new ATOM 1193 N GLU A 80 12.779 1.260 -19.050 1.00 0.00 N ATOM 1194 CA GLU A 80 13.544 2.389 -18.532 1.00 0.00 C ATOM 1195 C GLU A 80 14.455 1.949 -17.389 1.00 0.00 C ATOM 1196 O GLU A 80 14.505 2.589 -16.340 1.00 0.00 O ATOM 1197 CB GLU A 80 12.602 3.494 -18.051 1.00 0.00 C ATOM 1198 CG GLU A 80 11.742 4.084 -19.156 1.00 0.00 C ATOM 1199 CD GLU A 80 12.455 5.176 -19.930 1.00 0.00 C ATOM 1200 OE1 GLU A 80 12.598 6.292 -19.388 1.00 0.00 O ATOM 1201 OE2 GLU A 80 12.871 4.914 -21.078 1.00 0.00 O ATOM 0 H GLU A 80 12.706 1.231 -20.067 1.00 0.00 H new ATOM 0 HA GLU A 80 14.164 2.777 -19.340 1.00 0.00 H new ATOM 0 HB2 GLU A 80 11.953 3.093 -17.272 1.00 0.00 H new ATOM 0 HB3 GLU A 80 13.192 4.290 -17.597 1.00 0.00 H new ATOM 0 HG2 GLU A 80 11.445 3.291 -19.843 1.00 0.00 H new ATOM 0 HG3 GLU A 80 10.827 4.489 -18.723 1.00 0.00 H new ATOM 1208 N ASN A 81 15.174 0.852 -17.602 1.00 0.00 N ATOM 1209 CA ASN A 81 16.083 0.326 -16.590 1.00 0.00 C ATOM 1210 C ASN A 81 17.216 -0.466 -17.236 1.00 0.00 C ATOM 1211 O ASN A 81 16.990 -1.518 -17.833 1.00 0.00 O ATOM 1212 CB ASN A 81 15.322 -0.564 -15.604 1.00 0.00 C ATOM 1213 CG ASN A 81 15.985 -0.615 -14.241 1.00 0.00 C ATOM 1214 OD1 ASN A 81 17.175 -0.907 -14.128 1.00 0.00 O ATOM 1215 ND2 ASN A 81 15.214 -0.330 -13.198 1.00 0.00 N ATOM 0 H ASN A 81 15.145 0.310 -18.466 1.00 0.00 H new ATOM 0 HA ASN A 81 16.514 1.169 -16.051 1.00 0.00 H new ATOM 0 HB2 ASN A 81 14.303 -0.193 -15.496 1.00 0.00 H new ATOM 0 HB3 ASN A 81 15.252 -1.574 -16.009 1.00 0.00 H new ATOM 0 HD21 ASN A 81 15.604 -0.348 -12.256 1.00 0.00 H new ATOM 0 HD22 ASN A 81 14.232 -0.093 -13.339 1.00 0.00 H new ATOM 1222 N GLU A 82 18.436 0.048 -17.110 1.00 0.00 N ATOM 1223 CA GLU A 82 19.604 -0.611 -17.682 1.00 0.00 C ATOM 1224 C GLU A 82 20.020 -1.812 -16.837 1.00 0.00 C ATOM 1225 O GLU A 82 19.848 -1.815 -15.618 1.00 0.00 O ATOM 1226 CB GLU A 82 20.769 0.375 -17.795 1.00 0.00 C ATOM 1227 CG GLU A 82 21.294 0.853 -16.451 1.00 0.00 C ATOM 1228 CD GLU A 82 22.766 1.215 -16.495 1.00 0.00 C ATOM 1229 OE1 GLU A 82 23.606 0.305 -16.334 1.00 0.00 O ATOM 1230 OE2 GLU A 82 23.077 2.408 -16.691 1.00 0.00 O ATOM 0 H GLU A 82 18.641 0.918 -16.618 1.00 0.00 H new ATOM 0 HA GLU A 82 19.338 -0.964 -18.678 1.00 0.00 H new ATOM 0 HB2 GLU A 82 21.582 -0.098 -18.346 1.00 0.00 H new ATOM 0 HB3 GLU A 82 20.448 1.238 -18.378 1.00 0.00 H new ATOM 0 HG2 GLU A 82 20.720 1.722 -16.129 1.00 0.00 H new ATOM 0 HG3 GLU A 82 21.138 0.073 -15.706 1.00 0.00 H new ATOM 1237 N SER A 83 20.566 -2.830 -17.494 1.00 0.00 N ATOM 1238 CA SER A 83 21.002 -4.039 -16.804 1.00 0.00 C ATOM 1239 C SER A 83 22.517 -4.194 -16.885 1.00 0.00 C ATOM 1240 O SER A 83 23.083 -4.311 -17.971 1.00 0.00 O ATOM 1241 CB SER A 83 20.319 -5.269 -17.406 1.00 0.00 C ATOM 1242 OG SER A 83 20.788 -5.521 -18.719 1.00 0.00 O ATOM 0 H SER A 83 20.717 -2.842 -18.503 1.00 0.00 H new ATOM 0 HA SER A 83 20.719 -3.952 -15.755 1.00 0.00 H new ATOM 0 HB2 SER A 83 20.507 -6.138 -16.776 1.00 0.00 H new ATOM 0 HB3 SER A 83 19.240 -5.117 -17.425 1.00 0.00 H new ATOM 0 HG SER A 83 21.673 -5.116 -18.833 1.00 0.00 H new ATOM 1248 N GLY A 84 23.169 -4.193 -15.726 1.00 0.00 N ATOM 1249 CA GLY A 84 24.613 -4.333 -15.687 1.00 0.00 C ATOM 1250 C GLY A 84 25.144 -4.474 -14.274 1.00 0.00 C ATOM 1251 O GLY A 84 24.569 -3.953 -13.318 1.00 0.00 O ATOM 0 H GLY A 84 22.723 -4.098 -14.814 1.00 0.00 H new ATOM 0 HA2 GLY A 84 24.906 -5.206 -16.271 1.00 0.00 H new ATOM 0 HA3 GLY A 84 25.072 -3.465 -16.159 1.00 0.00 H new ATOM 1255 N PRO A 85 26.265 -5.195 -14.128 1.00 0.00 N ATOM 1256 CA PRO A 85 26.897 -5.420 -12.825 1.00 0.00 C ATOM 1257 C PRO A 85 27.522 -4.151 -12.256 1.00 0.00 C ATOM 1258 O PRO A 85 28.339 -3.503 -12.911 1.00 0.00 O ATOM 1259 CB PRO A 85 27.980 -6.459 -13.131 1.00 0.00 C ATOM 1260 CG PRO A 85 28.292 -6.266 -14.574 1.00 0.00 C ATOM 1261 CD PRO A 85 27.004 -5.844 -15.224 1.00 0.00 C ATOM 0 HA PRO A 85 26.177 -5.743 -12.073 1.00 0.00 H new ATOM 0 HB2 PRO A 85 28.863 -6.305 -12.511 1.00 0.00 H new ATOM 0 HB3 PRO A 85 27.625 -7.471 -12.934 1.00 0.00 H new ATOM 0 HG2 PRO A 85 29.063 -5.508 -14.708 1.00 0.00 H new ATOM 0 HG3 PRO A 85 28.670 -7.187 -15.018 1.00 0.00 H new ATOM 0 HD2 PRO A 85 27.178 -5.158 -16.053 1.00 0.00 H new ATOM 0 HD3 PRO A 85 26.458 -6.698 -15.626 1.00 0.00 H new ATOM 1269 N SER A 86 27.133 -3.802 -11.034 1.00 0.00 N ATOM 1270 CA SER A 86 27.653 -2.608 -10.378 1.00 0.00 C ATOM 1271 C SER A 86 27.443 -1.374 -11.251 1.00 0.00 C ATOM 1272 O SER A 86 28.337 -0.539 -11.390 1.00 0.00 O ATOM 1273 CB SER A 86 29.141 -2.778 -10.066 1.00 0.00 C ATOM 1274 OG SER A 86 29.545 -1.916 -9.017 1.00 0.00 O ATOM 0 H SER A 86 26.459 -4.329 -10.478 1.00 0.00 H new ATOM 0 HA SER A 86 27.107 -2.470 -9.445 1.00 0.00 H new ATOM 0 HB2 SER A 86 29.341 -3.813 -9.788 1.00 0.00 H new ATOM 0 HB3 SER A 86 29.729 -2.569 -10.960 1.00 0.00 H new ATOM 0 HG SER A 86 30.499 -2.046 -8.836 1.00 0.00 H new ATOM 1280 N SER A 87 26.255 -1.267 -11.837 1.00 0.00 N ATOM 1281 CA SER A 87 25.928 -0.137 -12.700 1.00 0.00 C ATOM 1282 C SER A 87 24.460 0.253 -12.550 1.00 0.00 C ATOM 1283 O SER A 87 23.606 -0.591 -12.281 1.00 0.00 O ATOM 1284 CB SER A 87 26.230 -0.480 -14.160 1.00 0.00 C ATOM 1285 OG SER A 87 25.532 -1.644 -14.566 1.00 0.00 O ATOM 0 H SER A 87 25.503 -1.948 -11.730 1.00 0.00 H new ATOM 0 HA SER A 87 26.544 0.710 -12.398 1.00 0.00 H new ATOM 0 HB2 SER A 87 25.949 0.357 -14.799 1.00 0.00 H new ATOM 0 HB3 SER A 87 27.302 -0.632 -14.287 1.00 0.00 H new ATOM 0 HG SER A 87 24.803 -1.394 -15.172 1.00 0.00 H new ATOM 1291 N GLY A 88 24.175 1.539 -12.727 1.00 0.00 N ATOM 1292 CA GLY A 88 22.811 2.020 -12.608 1.00 0.00 C ATOM 1293 C GLY A 88 22.742 3.514 -12.363 1.00 0.00 C ATOM 1294 O GLY A 88 22.770 3.964 -11.218 1.00 0.00 O ATOM 0 H GLY A 88 24.864 2.257 -12.951 1.00 0.00 H new ATOM 0 HA2 GLY A 88 22.263 1.779 -13.519 1.00 0.00 H new ATOM 0 HA3 GLY A 88 22.315 1.498 -11.790 1.00 0.00 H new TER 1298 GLY A 88