USER MOD reduce.3.24.130724 H: found=0, std=0, add=924, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 924 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 106 LYS NZ :NH3+ 137:sc= -0.0114 (180deg=-0.121) USER MOD Set 1.2: A 107 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 67 SER OG : rot 31:sc= -1.08 USER MOD Set 2.2: A 68 HIS : no HD1:sc= -9! C(o=-10!,f=-13!) USER MOD Set 3.1: A 9 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 35 TYR OH : rot 180:sc= -3.03! USER MOD Single : A 0 GLY N :NH3+ 154:sc=0.000955 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 3 MET CE :methyl 154:sc= -0.163 (180deg=-0.833) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= -0.192 K(o=-0.19,f=-2.3!) USER MOD Single : A 13 LYS NZ :NH3+ -152:sc= 0 (180deg=-0.258) USER MOD Single : A 16 LYS NZ :NH3+ 152:sc= -0.0621 (180deg=-0.48) USER MOD Single : A 18 GLN : amide:sc= -2.94! C(o=-2.9!,f=-3.2!) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 MET CE :methyl -108:sc= -2.85! (180deg=-6.05!) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= -5.59! C(o=-5.6!,f=-12!) USER MOD Single : A 38 MET CE :methyl 162:sc= -0.458 (180deg=-1.3) USER MOD Single : A 42 SER OG : rot 89:sc= 0.465 USER MOD Single : A 44 TYR OH : rot -60:sc= -0.982 USER MOD Single : A 45 LYS NZ :NH3+ -170:sc= -0.0234 (180deg=-0.217) USER MOD Single : A 47 TYR OH : rot 15:sc= -1.71 USER MOD Single : A 49 SER OG : rot 5:sc= 1.09 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0.277 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= -0.5 K(o=-0.5,f=-3.4!) USER MOD Single : A 76 THR OG1 : rot -64:sc= 0.812 USER MOD Single : A 77 LYS NZ :NH3+ 162:sc=-0.00898 (180deg=-0.0986) USER MOD Single : A 79 HIS : no HD1:sc= -0.0101 X(o=-0.01,f=-0.15) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot -48:sc= 0.913 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= -0.661 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.0627 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= -1.17 K(o=-1.2,f=-0.54) USER MOD Single : A 108 LYS NZ :NH3+ -168:sc= -0.604 (180deg=-0.843) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= -0.282 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 0 14.667 -8.886 25.191 1.00 0.00 N ATOM 2 CA GLY A 0 14.112 -7.615 25.732 1.00 0.00 C ATOM 3 C GLY A 0 13.359 -6.818 24.685 1.00 0.00 C ATOM 4 O GLY A 0 13.732 -6.812 23.513 1.00 0.00 O ATOM 0 H1 GLY A 0 15.497 -9.168 25.750 1.00 0.00 H new ATOM 0 H2 GLY A 0 13.944 -9.631 25.245 1.00 0.00 H new ATOM 0 H3 GLY A 0 14.948 -8.748 24.199 1.00 0.00 H new ATOM 0 HA2 GLY A 0 13.444 -7.839 26.563 1.00 0.00 H new ATOM 0 HA3 GLY A 0 14.925 -7.008 26.131 1.00 0.00 H new ATOM 10 N SER A 1 12.295 -6.144 25.110 1.00 0.00 N ATOM 11 CA SER A 1 11.487 -5.340 24.201 1.00 0.00 C ATOM 12 C SER A 1 12.260 -4.114 23.725 1.00 0.00 C ATOM 13 O SER A 1 13.418 -3.918 24.090 1.00 0.00 O ATOM 14 CB SER A 1 10.191 -4.905 24.887 1.00 0.00 C ATOM 15 OG SER A 1 9.107 -4.901 23.975 1.00 0.00 O ATOM 0 H SER A 1 11.973 -6.139 26.078 1.00 0.00 H new ATOM 0 HA SER A 1 11.243 -5.953 23.333 1.00 0.00 H new ATOM 0 HB2 SER A 1 9.971 -5.578 25.715 1.00 0.00 H new ATOM 0 HB3 SER A 1 10.317 -3.909 25.311 1.00 0.00 H new ATOM 0 HG SER A 1 8.290 -4.621 24.439 1.00 0.00 H new ATOM 21 N MET A 2 11.609 -3.291 22.909 1.00 0.00 N ATOM 22 CA MET A 2 12.234 -2.083 22.382 1.00 0.00 C ATOM 23 C MET A 2 13.468 -2.427 21.552 1.00 0.00 C ATOM 24 O MET A 2 13.977 -3.546 21.613 1.00 0.00 O ATOM 25 CB MET A 2 12.618 -1.143 23.528 1.00 0.00 C ATOM 26 CG MET A 2 11.666 0.029 23.698 1.00 0.00 C ATOM 27 SD MET A 2 12.305 1.555 22.976 1.00 0.00 S ATOM 28 CE MET A 2 11.400 1.603 21.431 1.00 0.00 C ATOM 0 H MET A 2 10.649 -3.439 22.598 1.00 0.00 H new ATOM 0 HA MET A 2 11.514 -1.581 21.736 1.00 0.00 H new ATOM 0 HB2 MET A 2 12.651 -1.711 24.458 1.00 0.00 H new ATOM 0 HB3 MET A 2 13.624 -0.761 23.352 1.00 0.00 H new ATOM 0 HG2 MET A 2 10.710 -0.215 23.235 1.00 0.00 H new ATOM 0 HG3 MET A 2 11.475 0.186 24.760 1.00 0.00 H new ATOM 0 HE1 MET A 2 11.686 2.492 20.869 1.00 0.00 H new ATOM 0 HE2 MET A 2 11.632 0.713 20.846 1.00 0.00 H new ATOM 0 HE3 MET A 2 10.330 1.633 21.637 1.00 0.00 H new ATOM 38 N MET A 3 13.943 -1.456 20.779 1.00 0.00 N ATOM 39 CA MET A 3 15.117 -1.654 19.937 1.00 0.00 C ATOM 40 C MET A 3 16.304 -0.855 20.462 1.00 0.00 C ATOM 41 O MET A 3 16.174 0.324 20.793 1.00 0.00 O ATOM 42 CB MET A 3 14.810 -1.247 18.494 1.00 0.00 C ATOM 43 CG MET A 3 14.485 0.230 18.336 1.00 0.00 C ATOM 44 SD MET A 3 13.578 0.582 16.818 1.00 0.00 S ATOM 45 CE MET A 3 12.021 -0.236 17.157 1.00 0.00 C ATOM 0 H MET A 3 13.533 -0.524 20.718 1.00 0.00 H new ATOM 0 HA MET A 3 15.376 -2.712 19.961 1.00 0.00 H new ATOM 0 HB2 MET A 3 15.667 -1.492 17.866 1.00 0.00 H new ATOM 0 HB3 MET A 3 13.969 -1.837 18.130 1.00 0.00 H new ATOM 0 HG2 MET A 3 13.897 0.562 19.192 1.00 0.00 H new ATOM 0 HG3 MET A 3 15.411 0.805 18.343 1.00 0.00 H new ATOM 0 HE1 MET A 3 11.227 0.242 16.584 1.00 0.00 H new ATOM 0 HE2 MET A 3 12.092 -1.286 16.873 1.00 0.00 H new ATOM 0 HE3 MET A 3 11.795 -0.162 18.221 1.00 0.00 H new ATOM 55 N MET A 4 17.462 -1.503 20.536 1.00 0.00 N ATOM 56 CA MET A 4 18.674 -0.851 21.022 1.00 0.00 C ATOM 57 C MET A 4 19.703 -0.711 19.905 1.00 0.00 C ATOM 58 O MET A 4 20.437 0.275 19.845 1.00 0.00 O ATOM 59 CB MET A 4 19.272 -1.645 22.185 1.00 0.00 C ATOM 60 CG MET A 4 18.352 -1.743 23.391 1.00 0.00 C ATOM 61 SD MET A 4 18.689 -3.195 24.405 1.00 0.00 S ATOM 62 CE MET A 4 17.243 -3.214 25.461 1.00 0.00 C ATOM 0 H MET A 4 17.587 -2.479 20.266 1.00 0.00 H new ATOM 0 HA MET A 4 18.406 0.146 21.370 1.00 0.00 H new ATOM 0 HB2 MET A 4 19.515 -2.650 21.841 1.00 0.00 H new ATOM 0 HB3 MET A 4 20.208 -1.178 22.490 1.00 0.00 H new ATOM 0 HG2 MET A 4 18.461 -0.846 24.000 1.00 0.00 H new ATOM 0 HG3 MET A 4 17.317 -1.774 23.052 1.00 0.00 H new ATOM 0 HE1 MET A 4 17.305 -4.059 26.147 1.00 0.00 H new ATOM 0 HE2 MET A 4 17.196 -2.286 26.031 1.00 0.00 H new ATOM 0 HE3 MET A 4 16.346 -3.309 24.849 1.00 0.00 H new ATOM 72 N ALA A 5 19.750 -1.703 19.024 1.00 0.00 N ATOM 73 CA ALA A 5 20.690 -1.689 17.909 1.00 0.00 C ATOM 74 C ALA A 5 19.999 -2.067 16.604 1.00 0.00 C ATOM 75 O ALA A 5 19.297 -3.076 16.530 1.00 0.00 O ATOM 76 CB ALA A 5 21.850 -2.634 18.186 1.00 0.00 C ATOM 0 H ALA A 5 19.149 -2.526 19.060 1.00 0.00 H new ATOM 0 HA ALA A 5 21.077 -0.675 17.805 1.00 0.00 H new ATOM 0 HB1 ALA A 5 22.544 -2.614 17.346 1.00 0.00 H new ATOM 0 HB2 ALA A 5 22.368 -2.319 19.092 1.00 0.00 H new ATOM 0 HB3 ALA A 5 21.470 -3.647 18.319 1.00 0.00 H new ATOM 82 N LEU A 6 20.203 -1.251 15.574 1.00 0.00 N ATOM 83 CA LEU A 6 19.600 -1.500 14.270 1.00 0.00 C ATOM 84 C LEU A 6 18.078 -1.517 14.367 1.00 0.00 C ATOM 85 O LEU A 6 17.517 -1.694 15.449 1.00 0.00 O ATOM 86 CB LEU A 6 20.101 -2.827 13.697 1.00 0.00 C ATOM 87 CG LEU A 6 21.581 -2.847 13.308 1.00 0.00 C ATOM 88 CD1 LEU A 6 22.457 -2.945 14.546 1.00 0.00 C ATOM 89 CD2 LEU A 6 21.864 -4.001 12.359 1.00 0.00 C ATOM 0 H LEU A 6 20.781 -0.412 15.618 1.00 0.00 H new ATOM 0 HA LEU A 6 19.894 -0.690 13.602 1.00 0.00 H new ATOM 0 HB2 LEU A 6 19.923 -3.613 14.432 1.00 0.00 H new ATOM 0 HB3 LEU A 6 19.506 -3.073 12.817 1.00 0.00 H new ATOM 0 HG LEU A 6 21.817 -1.914 12.796 1.00 0.00 H new ATOM 0 HD11 LEU A 6 23.506 -2.958 14.249 1.00 0.00 H new ATOM 0 HD12 LEU A 6 22.273 -2.086 15.191 1.00 0.00 H new ATOM 0 HD13 LEU A 6 22.221 -3.862 15.087 1.00 0.00 H new ATOM 0 HD21 LEU A 6 22.921 -4.001 12.092 1.00 0.00 H new ATOM 0 HD22 LEU A 6 21.613 -4.943 12.846 1.00 0.00 H new ATOM 0 HD23 LEU A 6 21.262 -3.887 11.458 1.00 0.00 H new ATOM 101 N SER A 7 17.415 -1.334 13.230 1.00 0.00 N ATOM 102 CA SER A 7 15.958 -1.328 13.186 1.00 0.00 C ATOM 103 C SER A 7 15.450 -2.059 11.947 1.00 0.00 C ATOM 104 O SER A 7 16.113 -2.080 10.911 1.00 0.00 O ATOM 105 CB SER A 7 15.431 0.108 13.198 1.00 0.00 C ATOM 106 OG SER A 7 15.497 0.686 11.905 1.00 0.00 O ATOM 0 H SER A 7 17.864 -1.188 12.326 1.00 0.00 H new ATOM 0 HA SER A 7 15.590 -1.848 14.070 1.00 0.00 H new ATOM 0 HB2 SER A 7 14.400 0.118 13.552 1.00 0.00 H new ATOM 0 HB3 SER A 7 16.014 0.707 13.898 1.00 0.00 H new ATOM 0 HG SER A 7 15.153 1.603 11.939 1.00 0.00 H new ATOM 112 N LYS A 8 14.269 -2.658 12.062 1.00 0.00 N ATOM 113 CA LYS A 8 13.672 -3.389 10.951 1.00 0.00 C ATOM 114 C LYS A 8 12.562 -2.575 10.296 1.00 0.00 C ATOM 115 O LYS A 8 12.366 -2.638 9.082 1.00 0.00 O ATOM 116 CB LYS A 8 13.121 -4.732 11.433 1.00 0.00 C ATOM 117 CG LYS A 8 14.175 -5.633 12.058 1.00 0.00 C ATOM 118 CD LYS A 8 15.238 -6.036 11.048 1.00 0.00 C ATOM 119 CE LYS A 8 15.132 -7.507 10.680 1.00 0.00 C ATOM 120 NZ LYS A 8 16.431 -8.056 10.201 1.00 0.00 N ATOM 0 H LYS A 8 13.707 -2.651 12.913 1.00 0.00 H new ATOM 0 HA LYS A 8 14.450 -3.569 10.209 1.00 0.00 H new ATOM 0 HB2 LYS A 8 12.331 -4.551 12.162 1.00 0.00 H new ATOM 0 HB3 LYS A 8 12.664 -5.251 10.591 1.00 0.00 H new ATOM 0 HG2 LYS A 8 14.645 -5.117 12.895 1.00 0.00 H new ATOM 0 HG3 LYS A 8 13.698 -6.526 12.461 1.00 0.00 H new ATOM 0 HD2 LYS A 8 15.136 -5.427 10.149 1.00 0.00 H new ATOM 0 HD3 LYS A 8 16.227 -5.834 11.460 1.00 0.00 H new ATOM 0 HE2 LYS A 8 14.796 -8.075 11.548 1.00 0.00 H new ATOM 0 HE3 LYS A 8 14.377 -7.633 9.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 16.316 -9.061 9.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 16.740 -7.531 9.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 17.146 -7.959 10.950 1.00 0.00 H new ATOM 134 N THR A 9 11.839 -1.810 11.107 1.00 0.00 N ATOM 135 CA THR A 9 10.748 -0.982 10.604 1.00 0.00 C ATOM 136 C THR A 9 10.522 0.228 11.495 1.00 0.00 C ATOM 137 O THR A 9 11.117 0.344 12.566 1.00 0.00 O ATOM 138 CB THR A 9 9.456 -1.787 10.522 1.00 0.00 C ATOM 139 OG1 THR A 9 9.360 -2.692 11.608 1.00 0.00 O ATOM 140 CG2 THR A 9 9.328 -2.587 9.243 1.00 0.00 C ATOM 0 H THR A 9 11.988 -1.746 12.114 1.00 0.00 H new ATOM 0 HA THR A 9 11.030 -0.642 9.608 1.00 0.00 H new ATOM 0 HB THR A 9 8.654 -1.050 10.550 1.00 0.00 H new ATOM 0 HG1 THR A 9 8.524 -3.198 11.539 1.00 0.00 H new ATOM 0 HG21 THR A 9 8.386 -3.136 9.250 1.00 0.00 H new ATOM 0 HG22 THR A 9 9.348 -1.911 8.388 1.00 0.00 H new ATOM 0 HG23 THR A 9 10.157 -3.290 9.169 1.00 0.00 H new ATOM 148 N PHE A 10 9.653 1.129 11.048 1.00 0.00 N ATOM 149 CA PHE A 10 9.348 2.328 11.816 1.00 0.00 C ATOM 150 C PHE A 10 7.852 2.623 11.785 1.00 0.00 C ATOM 151 O PHE A 10 7.264 2.759 10.711 1.00 0.00 O ATOM 152 CB PHE A 10 10.082 3.542 11.235 1.00 0.00 C ATOM 153 CG PHE A 10 11.170 3.205 10.256 1.00 0.00 C ATOM 154 CD1 PHE A 10 12.255 2.430 10.626 1.00 0.00 C ATOM 155 CD2 PHE A 10 11.094 3.667 8.954 1.00 0.00 C ATOM 156 CE1 PHE A 10 13.245 2.120 9.711 1.00 0.00 C ATOM 157 CE2 PHE A 10 12.078 3.366 8.036 1.00 0.00 C ATOM 158 CZ PHE A 10 13.155 2.591 8.412 1.00 0.00 C ATOM 0 H PHE A 10 9.151 1.052 10.163 1.00 0.00 H new ATOM 0 HA PHE A 10 9.672 2.149 12.841 1.00 0.00 H new ATOM 0 HB2 PHE A 10 9.355 4.188 10.742 1.00 0.00 H new ATOM 0 HB3 PHE A 10 10.514 4.116 12.055 1.00 0.00 H new ATOM 0 HD1 PHE A 10 12.330 2.064 11.639 1.00 0.00 H new ATOM 0 HD2 PHE A 10 10.252 4.272 8.652 1.00 0.00 H new ATOM 0 HE1 PHE A 10 14.086 1.512 10.009 1.00 0.00 H new ATOM 0 HE2 PHE A 10 12.005 3.737 7.024 1.00 0.00 H new ATOM 0 HZ PHE A 10 13.926 2.352 7.695 1.00 0.00 H new ATOM 168 N GLY A 11 7.248 2.773 12.957 1.00 0.00 N ATOM 169 CA GLY A 11 5.838 3.109 13.008 1.00 0.00 C ATOM 170 C GLY A 11 4.915 1.915 13.161 1.00 0.00 C ATOM 171 O GLY A 11 5.355 0.783 13.367 1.00 0.00 O ATOM 0 H GLY A 11 7.703 2.669 13.864 1.00 0.00 H new ATOM 0 HA2 GLY A 11 5.670 3.792 13.840 1.00 0.00 H new ATOM 0 HA3 GLY A 11 5.571 3.645 12.097 1.00 0.00 H new ATOM 175 N GLN A 12 3.621 2.193 13.033 1.00 0.00 N ATOM 176 CA GLN A 12 2.569 1.185 13.124 1.00 0.00 C ATOM 177 C GLN A 12 2.369 0.508 11.771 1.00 0.00 C ATOM 178 O GLN A 12 2.741 1.059 10.736 1.00 0.00 O ATOM 179 CB GLN A 12 1.259 1.823 13.595 1.00 0.00 C ATOM 180 CG GLN A 12 0.869 1.434 15.012 1.00 0.00 C ATOM 181 CD GLN A 12 -0.621 1.206 15.165 1.00 0.00 C ATOM 182 OE1 GLN A 12 -1.394 1.432 14.235 1.00 0.00 O ATOM 183 NE2 GLN A 12 -1.033 0.754 16.344 1.00 0.00 N ATOM 0 H GLN A 12 3.269 3.135 12.861 1.00 0.00 H new ATOM 0 HA GLN A 12 2.871 0.432 13.852 1.00 0.00 H new ATOM 0 HB2 GLN A 12 1.351 2.908 13.537 1.00 0.00 H new ATOM 0 HB3 GLN A 12 0.458 1.534 12.914 1.00 0.00 H new ATOM 0 HG2 GLN A 12 1.403 0.527 15.296 1.00 0.00 H new ATOM 0 HG3 GLN A 12 1.185 2.218 15.700 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -0.357 0.580 17.088 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -2.025 0.581 16.505 1.00 0.00 H new ATOM 192 N LYS A 13 1.794 -0.693 11.777 1.00 0.00 N ATOM 193 CA LYS A 13 1.574 -1.424 10.534 1.00 0.00 C ATOM 194 C LYS A 13 0.528 -0.705 9.685 1.00 0.00 C ATOM 195 O LYS A 13 -0.507 -0.275 10.194 1.00 0.00 O ATOM 196 CB LYS A 13 1.108 -2.857 10.835 1.00 0.00 C ATOM 197 CG LYS A 13 0.640 -3.634 9.608 1.00 0.00 C ATOM 198 CD LYS A 13 1.816 -4.139 8.789 1.00 0.00 C ATOM 199 CE LYS A 13 2.353 -5.452 9.335 1.00 0.00 C ATOM 200 NZ LYS A 13 3.406 -6.029 8.456 1.00 0.00 N ATOM 0 H LYS A 13 1.476 -1.175 12.618 1.00 0.00 H new ATOM 0 HA LYS A 13 2.513 -1.468 9.982 1.00 0.00 H new ATOM 0 HB2 LYS A 13 1.926 -3.402 11.306 1.00 0.00 H new ATOM 0 HB3 LYS A 13 0.294 -2.818 11.558 1.00 0.00 H new ATOM 0 HG2 LYS A 13 0.025 -4.477 9.922 1.00 0.00 H new ATOM 0 HG3 LYS A 13 0.011 -2.994 8.989 1.00 0.00 H new ATOM 0 HD2 LYS A 13 1.507 -4.274 7.752 1.00 0.00 H new ATOM 0 HD3 LYS A 13 2.609 -3.392 8.791 1.00 0.00 H new ATOM 0 HE2 LYS A 13 2.761 -5.290 10.333 1.00 0.00 H new ATOM 0 HE3 LYS A 13 1.535 -6.165 9.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 3.413 -7.064 8.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 3.208 -5.778 7.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 4.334 -5.648 8.730 1.00 0.00 H new ATOM 214 N PRO A 14 0.794 -0.550 8.373 1.00 0.00 N ATOM 215 CA PRO A 14 -0.121 0.139 7.461 1.00 0.00 C ATOM 216 C PRO A 14 -1.473 -0.547 7.383 1.00 0.00 C ATOM 217 O PRO A 14 -1.593 -1.740 7.660 1.00 0.00 O ATOM 218 CB PRO A 14 0.591 0.075 6.104 1.00 0.00 C ATOM 219 CG PRO A 14 2.020 -0.194 6.427 1.00 0.00 C ATOM 220 CD PRO A 14 2.005 -1.020 7.680 1.00 0.00 C ATOM 0 HA PRO A 14 -0.331 1.156 7.791 1.00 0.00 H new ATOM 0 HB2 PRO A 14 0.174 -0.713 5.477 1.00 0.00 H new ATOM 0 HB3 PRO A 14 0.480 1.011 5.556 1.00 0.00 H new ATOM 0 HG2 PRO A 14 2.512 -0.727 5.613 1.00 0.00 H new ATOM 0 HG3 PRO A 14 2.569 0.736 6.577 1.00 0.00 H new ATOM 0 HD2 PRO A 14 1.956 -2.086 7.460 1.00 0.00 H new ATOM 0 HD3 PRO A 14 2.901 -0.860 8.280 1.00 0.00 H new ATOM 228 N VAL A 15 -2.492 0.213 7.008 1.00 0.00 N ATOM 229 CA VAL A 15 -3.833 -0.331 6.899 1.00 0.00 C ATOM 230 C VAL A 15 -3.957 -1.234 5.679 1.00 0.00 C ATOM 231 O VAL A 15 -3.798 -0.789 4.531 1.00 0.00 O ATOM 232 CB VAL A 15 -4.899 0.777 6.836 1.00 0.00 C ATOM 233 CG1 VAL A 15 -4.777 1.697 8.040 1.00 0.00 C ATOM 234 CG2 VAL A 15 -4.792 1.563 5.540 1.00 0.00 C ATOM 0 H VAL A 15 -2.414 1.203 6.776 1.00 0.00 H new ATOM 0 HA VAL A 15 -4.009 -0.920 7.799 1.00 0.00 H new ATOM 0 HB VAL A 15 -5.883 0.308 6.859 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -5.538 2.476 7.981 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -4.918 1.120 8.954 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -3.788 2.156 8.049 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -5.557 2.340 5.521 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -3.806 2.023 5.474 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -4.936 0.891 4.694 1.00 0.00 H new ATOM 244 N LYS A 16 -4.238 -2.506 5.945 1.00 0.00 N ATOM 245 CA LYS A 16 -4.395 -3.499 4.897 1.00 0.00 C ATOM 246 C LYS A 16 -5.855 -3.910 4.782 1.00 0.00 C ATOM 247 O LYS A 16 -6.633 -3.736 5.721 1.00 0.00 O ATOM 248 CB LYS A 16 -3.529 -4.728 5.187 1.00 0.00 C ATOM 249 CG LYS A 16 -3.766 -5.339 6.559 1.00 0.00 C ATOM 250 CD LYS A 16 -3.508 -6.838 6.554 1.00 0.00 C ATOM 251 CE LYS A 16 -2.328 -7.206 7.441 1.00 0.00 C ATOM 252 NZ LYS A 16 -2.552 -6.804 8.858 1.00 0.00 N ATOM 0 H LYS A 16 -4.362 -2.872 6.889 1.00 0.00 H new ATOM 0 HA LYS A 16 -4.072 -3.060 3.953 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -3.721 -5.484 4.425 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -2.479 -4.449 5.101 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -3.115 -4.859 7.290 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -4.792 -5.146 6.872 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -4.400 -7.362 6.898 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -3.315 -7.171 5.534 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -2.158 -8.281 7.391 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -1.426 -6.723 7.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -2.021 -7.439 9.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -2.226 -5.826 8.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -3.566 -6.866 9.080 1.00 0.00 H new ATOM 266 N PHE A 17 -6.227 -4.453 3.633 1.00 0.00 N ATOM 267 CA PHE A 17 -7.601 -4.882 3.414 1.00 0.00 C ATOM 268 C PHE A 17 -7.682 -5.893 2.280 1.00 0.00 C ATOM 269 O PHE A 17 -6.721 -6.088 1.537 1.00 0.00 O ATOM 270 CB PHE A 17 -8.490 -3.677 3.103 1.00 0.00 C ATOM 271 CG PHE A 17 -7.921 -2.766 2.053 1.00 0.00 C ATOM 272 CD1 PHE A 17 -8.023 -3.086 0.709 1.00 0.00 C ATOM 273 CD2 PHE A 17 -7.288 -1.588 2.411 1.00 0.00 C ATOM 274 CE1 PHE A 17 -7.503 -2.250 -0.259 1.00 0.00 C ATOM 275 CE2 PHE A 17 -6.765 -0.746 1.449 1.00 0.00 C ATOM 276 CZ PHE A 17 -6.871 -1.075 0.112 1.00 0.00 C ATOM 0 H PHE A 17 -5.602 -4.607 2.842 1.00 0.00 H new ATOM 0 HA PHE A 17 -7.955 -5.360 4.327 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -9.467 -4.032 2.774 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -8.650 -3.108 4.019 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -8.516 -4.001 0.415 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -7.202 -1.324 3.455 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -7.589 -2.512 -1.303 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -6.273 0.170 1.742 1.00 0.00 H new ATOM 0 HZ PHE A 17 -6.462 -0.418 -0.642 1.00 0.00 H new ATOM 286 N GLN A 18 -8.837 -6.531 2.150 1.00 0.00 N ATOM 287 CA GLN A 18 -9.050 -7.519 1.103 1.00 0.00 C ATOM 288 C GLN A 18 -9.882 -6.921 -0.024 1.00 0.00 C ATOM 289 O GLN A 18 -10.950 -6.358 0.215 1.00 0.00 O ATOM 290 CB GLN A 18 -9.751 -8.753 1.672 1.00 0.00 C ATOM 291 CG GLN A 18 -9.320 -10.051 1.015 1.00 0.00 C ATOM 292 CD GLN A 18 -10.493 -10.914 0.600 1.00 0.00 C ATOM 293 OE1 GLN A 18 -11.448 -10.431 -0.009 1.00 0.00 O ATOM 294 NE2 GLN A 18 -10.429 -12.196 0.929 1.00 0.00 N ATOM 0 H GLN A 18 -9.642 -6.381 2.758 1.00 0.00 H new ATOM 0 HA GLN A 18 -8.080 -7.818 0.706 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -9.552 -8.813 2.742 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -10.828 -8.636 1.554 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -8.712 -9.825 0.139 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -8.689 -10.611 1.705 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -9.618 -12.553 1.434 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -11.191 -12.826 0.677 1.00 0.00 H new ATOM 303 N LEU A 19 -9.389 -7.039 -1.252 1.00 0.00 N ATOM 304 CA LEU A 19 -10.102 -6.495 -2.404 1.00 0.00 C ATOM 305 C LEU A 19 -10.687 -7.606 -3.272 1.00 0.00 C ATOM 306 O LEU A 19 -11.623 -7.375 -4.038 1.00 0.00 O ATOM 307 CB LEU A 19 -9.177 -5.599 -3.236 1.00 0.00 C ATOM 308 CG LEU A 19 -9.424 -4.092 -3.094 1.00 0.00 C ATOM 309 CD1 LEU A 19 -8.671 -3.325 -4.171 1.00 0.00 C ATOM 310 CD2 LEU A 19 -10.911 -3.776 -3.167 1.00 0.00 C ATOM 0 H LEU A 19 -8.508 -7.501 -1.475 1.00 0.00 H new ATOM 0 HA LEU A 19 -10.929 -5.893 -2.028 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -8.145 -5.810 -2.955 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -9.283 -5.871 -4.286 1.00 0.00 H new ATOM 0 HG LEU A 19 -9.054 -3.780 -2.117 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -8.858 -2.257 -4.055 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -7.603 -3.519 -4.076 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -9.013 -3.648 -5.154 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -11.060 -2.701 -3.064 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -11.307 -4.107 -4.127 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -11.433 -4.294 -2.362 1.00 0.00 H new ATOM 322 N GLU A 20 -10.138 -8.811 -3.153 1.00 0.00 N ATOM 323 CA GLU A 20 -10.619 -9.945 -3.933 1.00 0.00 C ATOM 324 C GLU A 20 -10.966 -11.126 -3.030 1.00 0.00 C ATOM 325 O GLU A 20 -10.301 -11.372 -2.025 1.00 0.00 O ATOM 326 CB GLU A 20 -9.570 -10.363 -4.964 1.00 0.00 C ATOM 327 CG GLU A 20 -9.713 -9.649 -6.298 1.00 0.00 C ATOM 328 CD GLU A 20 -9.957 -10.603 -7.450 1.00 0.00 C ATOM 329 OE1 GLU A 20 -9.533 -10.288 -8.581 1.00 0.00 O ATOM 330 OE2 GLU A 20 -10.570 -11.667 -7.221 1.00 0.00 O ATOM 0 H GLU A 20 -9.363 -9.026 -2.526 1.00 0.00 H new ATOM 0 HA GLU A 20 -11.526 -9.636 -4.453 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -8.577 -10.166 -4.560 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -9.641 -11.438 -5.127 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -10.538 -8.939 -6.239 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -8.810 -9.072 -6.495 1.00 0.00 H new ATOM 337 N ASP A 21 -12.015 -11.852 -3.402 1.00 0.00 N ATOM 338 CA ASP A 21 -12.471 -13.012 -2.639 1.00 0.00 C ATOM 339 C ASP A 21 -11.420 -14.123 -2.602 1.00 0.00 C ATOM 340 O ASP A 21 -11.552 -15.081 -1.841 1.00 0.00 O ATOM 341 CB ASP A 21 -13.774 -13.552 -3.232 1.00 0.00 C ATOM 342 CG ASP A 21 -15.001 -12.941 -2.583 1.00 0.00 C ATOM 343 OD1 ASP A 21 -16.046 -13.623 -2.529 1.00 0.00 O ATOM 344 OD2 ASP A 21 -14.916 -11.781 -2.128 1.00 0.00 O ATOM 0 H ASP A 21 -12.571 -11.656 -4.235 1.00 0.00 H new ATOM 0 HA ASP A 21 -12.642 -12.682 -1.614 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -13.794 -13.350 -4.303 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -13.804 -14.635 -3.111 1.00 0.00 H new ATOM 349 N ASP A 22 -10.390 -14.005 -3.435 1.00 0.00 N ATOM 350 CA ASP A 22 -9.339 -15.016 -3.498 1.00 0.00 C ATOM 351 C ASP A 22 -8.311 -14.839 -2.379 1.00 0.00 C ATOM 352 O ASP A 22 -7.338 -15.591 -2.302 1.00 0.00 O ATOM 353 CB ASP A 22 -8.642 -14.967 -4.859 1.00 0.00 C ATOM 354 CG ASP A 22 -9.050 -16.116 -5.760 1.00 0.00 C ATOM 355 OD1 ASP A 22 -10.244 -16.482 -5.752 1.00 0.00 O ATOM 356 OD2 ASP A 22 -8.176 -16.650 -6.474 1.00 0.00 O ATOM 0 H ASP A 22 -10.261 -13.221 -4.075 1.00 0.00 H new ATOM 0 HA ASP A 22 -9.811 -15.989 -3.365 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -8.877 -14.023 -5.350 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -7.562 -14.990 -4.712 1.00 0.00 H new ATOM 361 N GLY A 23 -8.530 -13.857 -1.509 1.00 0.00 N ATOM 362 CA GLY A 23 -7.610 -13.631 -0.408 1.00 0.00 C ATOM 363 C GLY A 23 -6.578 -12.557 -0.701 1.00 0.00 C ATOM 364 O GLY A 23 -5.610 -12.406 0.045 1.00 0.00 O ATOM 0 H GLY A 23 -9.323 -13.217 -1.546 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -8.177 -13.348 0.479 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -7.097 -14.564 -0.174 1.00 0.00 H new ATOM 368 N GLU A 24 -6.776 -11.807 -1.780 1.00 0.00 N ATOM 369 CA GLU A 24 -5.842 -10.750 -2.144 1.00 0.00 C ATOM 370 C GLU A 24 -5.927 -9.592 -1.154 1.00 0.00 C ATOM 371 O GLU A 24 -6.966 -8.937 -1.028 1.00 0.00 O ATOM 372 CB GLU A 24 -6.125 -10.258 -3.564 1.00 0.00 C ATOM 373 CG GLU A 24 -4.950 -10.432 -4.510 1.00 0.00 C ATOM 374 CD GLU A 24 -5.337 -10.233 -5.963 1.00 0.00 C ATOM 375 OE1 GLU A 24 -6.531 -10.404 -6.289 1.00 0.00 O ATOM 376 OE2 GLU A 24 -4.446 -9.904 -6.774 1.00 0.00 O ATOM 0 H GLU A 24 -7.569 -11.911 -2.413 1.00 0.00 H new ATOM 0 HA GLU A 24 -4.831 -11.157 -2.110 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -6.985 -10.797 -3.962 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -6.399 -9.204 -3.527 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -4.167 -9.721 -4.246 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -4.531 -11.430 -4.383 1.00 0.00 H new ATOM 383 N PHE A 25 -4.825 -9.351 -0.449 1.00 0.00 N ATOM 384 CA PHE A 25 -4.764 -8.281 0.538 1.00 0.00 C ATOM 385 C PHE A 25 -3.867 -7.144 0.067 1.00 0.00 C ATOM 386 O PHE A 25 -2.733 -7.365 -0.360 1.00 0.00 O ATOM 387 CB PHE A 25 -4.255 -8.822 1.876 1.00 0.00 C ATOM 388 CG PHE A 25 -5.354 -9.214 2.821 1.00 0.00 C ATOM 389 CD1 PHE A 25 -6.043 -10.400 2.643 1.00 0.00 C ATOM 390 CD2 PHE A 25 -5.697 -8.393 3.884 1.00 0.00 C ATOM 391 CE1 PHE A 25 -7.057 -10.764 3.508 1.00 0.00 C ATOM 392 CE2 PHE A 25 -6.710 -8.753 4.753 1.00 0.00 C ATOM 393 CZ PHE A 25 -7.392 -9.940 4.563 1.00 0.00 C ATOM 0 H PHE A 25 -3.961 -9.885 -0.544 1.00 0.00 H new ATOM 0 HA PHE A 25 -5.773 -7.890 0.667 1.00 0.00 H new ATOM 0 HB2 PHE A 25 -3.620 -9.688 1.691 1.00 0.00 H new ATOM 0 HB3 PHE A 25 -3.631 -8.065 2.351 1.00 0.00 H new ATOM 0 HD1 PHE A 25 -5.786 -11.049 1.819 1.00 0.00 H new ATOM 0 HD2 PHE A 25 -5.168 -7.464 4.035 1.00 0.00 H new ATOM 0 HE1 PHE A 25 -7.587 -11.693 3.359 1.00 0.00 H new ATOM 0 HE2 PHE A 25 -6.968 -8.107 5.579 1.00 0.00 H new ATOM 0 HZ PHE A 25 -8.186 -10.222 5.239 1.00 0.00 H new ATOM 403 N TYR A 26 -4.381 -5.925 0.158 1.00 0.00 N ATOM 404 CA TYR A 26 -3.632 -4.746 -0.246 1.00 0.00 C ATOM 405 C TYR A 26 -3.487 -3.778 0.916 1.00 0.00 C ATOM 406 O TYR A 26 -4.164 -3.903 1.935 1.00 0.00 O ATOM 407 CB TYR A 26 -4.312 -4.046 -1.418 1.00 0.00 C ATOM 408 CG TYR A 26 -4.315 -4.862 -2.689 1.00 0.00 C ATOM 409 CD1 TYR A 26 -5.263 -5.855 -2.900 1.00 0.00 C ATOM 410 CD2 TYR A 26 -3.364 -4.643 -3.676 1.00 0.00 C ATOM 411 CE1 TYR A 26 -5.263 -6.605 -4.061 1.00 0.00 C ATOM 412 CE2 TYR A 26 -3.355 -5.386 -4.839 1.00 0.00 C ATOM 413 CZ TYR A 26 -4.307 -6.368 -5.027 1.00 0.00 C ATOM 414 OH TYR A 26 -4.302 -7.112 -6.184 1.00 0.00 O ATOM 0 H TYR A 26 -5.318 -5.728 0.510 1.00 0.00 H new ATOM 0 HA TYR A 26 -2.641 -5.073 -0.560 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -5.341 -3.812 -1.144 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -3.809 -3.098 -1.606 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -6.012 -6.044 -2.145 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -2.617 -3.877 -3.531 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -6.008 -7.373 -4.211 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -2.608 -5.200 -5.597 1.00 0.00 H new ATOM 0 HH TYR A 26 -3.565 -6.818 -6.759 1.00 0.00 H new ATOM 424 N MET A 27 -2.598 -2.814 0.748 1.00 0.00 N ATOM 425 CA MET A 27 -2.350 -1.811 1.774 1.00 0.00 C ATOM 426 C MET A 27 -2.330 -0.421 1.157 1.00 0.00 C ATOM 427 O MET A 27 -2.023 -0.265 -0.028 1.00 0.00 O ATOM 428 CB MET A 27 -1.020 -2.086 2.475 1.00 0.00 C ATOM 429 CG MET A 27 -0.995 -3.400 3.235 1.00 0.00 C ATOM 430 SD MET A 27 -0.210 -3.250 4.852 1.00 0.00 S ATOM 431 CE MET A 27 1.231 -4.282 4.618 1.00 0.00 C ATOM 0 H MET A 27 -2.032 -2.703 -0.093 1.00 0.00 H new ATOM 0 HA MET A 27 -3.154 -1.862 2.509 1.00 0.00 H new ATOM 0 HB2 MET A 27 -0.222 -2.090 1.733 1.00 0.00 H new ATOM 0 HB3 MET A 27 -0.808 -1.271 3.167 1.00 0.00 H new ATOM 0 HG2 MET A 27 -2.015 -3.761 3.363 1.00 0.00 H new ATOM 0 HG3 MET A 27 -0.464 -4.147 2.645 1.00 0.00 H new ATOM 0 HE1 MET A 27 1.113 -5.206 5.184 1.00 0.00 H new ATOM 0 HE2 MET A 27 1.342 -4.517 3.559 1.00 0.00 H new ATOM 0 HE3 MET A 27 2.118 -3.753 4.967 1.00 0.00 H new ATOM 441 N ILE A 28 -2.658 0.588 1.958 1.00 0.00 N ATOM 442 CA ILE A 28 -2.667 1.960 1.461 1.00 0.00 C ATOM 443 C ILE A 28 -1.254 2.548 1.429 1.00 0.00 C ATOM 444 O ILE A 28 -0.557 2.603 2.450 1.00 0.00 O ATOM 445 CB ILE A 28 -3.594 2.868 2.290 1.00 0.00 C ATOM 446 CG1 ILE A 28 -4.947 2.186 2.499 1.00 0.00 C ATOM 447 CG2 ILE A 28 -3.779 4.203 1.587 1.00 0.00 C ATOM 448 CD1 ILE A 28 -5.970 3.061 3.193 1.00 0.00 C ATOM 0 H ILE A 28 -2.917 0.485 2.939 1.00 0.00 H new ATOM 0 HA ILE A 28 -3.055 1.920 0.443 1.00 0.00 H new ATOM 0 HB ILE A 28 -3.138 3.045 3.264 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -5.342 1.879 1.531 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -4.800 1.279 3.086 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -4.436 4.839 2.180 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -2.811 4.690 1.471 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -4.223 4.039 0.605 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -6.903 2.510 3.306 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -5.597 3.348 4.176 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -6.147 3.956 2.597 1.00 0.00 H new ATOM 460 N GLY A 29 -0.837 2.979 0.240 1.00 0.00 N ATOM 461 CA GLY A 29 0.492 3.539 0.069 1.00 0.00 C ATOM 462 C GLY A 29 0.777 4.685 1.014 1.00 0.00 C ATOM 463 O GLY A 29 1.903 4.836 1.485 1.00 0.00 O ATOM 0 H GLY A 29 -1.399 2.950 -0.611 1.00 0.00 H new ATOM 0 HA2 GLY A 29 1.233 2.755 0.224 1.00 0.00 H new ATOM 0 HA3 GLY A 29 0.605 3.886 -0.958 1.00 0.00 H new ATOM 467 N SER A 30 -0.238 5.487 1.309 1.00 0.00 N ATOM 468 CA SER A 30 -0.068 6.606 2.224 1.00 0.00 C ATOM 469 C SER A 30 0.417 6.098 3.577 1.00 0.00 C ATOM 470 O SER A 30 1.288 6.703 4.215 1.00 0.00 O ATOM 471 CB SER A 30 -1.384 7.369 2.389 1.00 0.00 C ATOM 472 OG SER A 30 -1.551 8.327 1.358 1.00 0.00 O ATOM 0 H SER A 30 -1.180 5.384 0.931 1.00 0.00 H new ATOM 0 HA SER A 30 0.676 7.287 1.810 1.00 0.00 H new ATOM 0 HB2 SER A 30 -2.218 6.668 2.377 1.00 0.00 H new ATOM 0 HB3 SER A 30 -1.400 7.867 3.358 1.00 0.00 H new ATOM 0 HG SER A 30 -2.400 8.800 1.485 1.00 0.00 H new ATOM 478 N GLU A 31 -0.138 4.963 3.999 1.00 0.00 N ATOM 479 CA GLU A 31 0.246 4.357 5.262 1.00 0.00 C ATOM 480 C GLU A 31 1.682 3.872 5.180 1.00 0.00 C ATOM 481 O GLU A 31 2.473 4.068 6.104 1.00 0.00 O ATOM 482 CB GLU A 31 -0.689 3.199 5.606 1.00 0.00 C ATOM 483 CG GLU A 31 -2.105 3.643 5.933 1.00 0.00 C ATOM 484 CD GLU A 31 -2.416 3.566 7.415 1.00 0.00 C ATOM 485 OE1 GLU A 31 -1.806 2.724 8.106 1.00 0.00 O ATOM 486 OE2 GLU A 31 -3.268 4.350 7.885 1.00 0.00 O ATOM 0 H GLU A 31 -0.853 4.450 3.483 1.00 0.00 H new ATOM 0 HA GLU A 31 0.167 5.104 6.052 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -0.719 2.504 4.767 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -0.282 2.653 6.457 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -2.249 4.667 5.589 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -2.812 3.020 5.385 1.00 0.00 H new ATOM 493 N VAL A 32 2.018 3.256 4.054 1.00 0.00 N ATOM 494 CA VAL A 32 3.369 2.761 3.834 1.00 0.00 C ATOM 495 C VAL A 32 4.363 3.918 3.839 1.00 0.00 C ATOM 496 O VAL A 32 5.457 3.815 4.400 1.00 0.00 O ATOM 497 CB VAL A 32 3.483 2.002 2.498 1.00 0.00 C ATOM 498 CG1 VAL A 32 4.856 1.365 2.359 1.00 0.00 C ATOM 499 CG2 VAL A 32 2.387 0.952 2.384 1.00 0.00 C ATOM 0 H VAL A 32 1.374 3.088 3.281 1.00 0.00 H new ATOM 0 HA VAL A 32 3.600 2.071 4.646 1.00 0.00 H new ATOM 0 HB VAL A 32 3.356 2.717 1.685 1.00 0.00 H new ATOM 0 HG11 VAL A 32 4.916 0.834 1.409 1.00 0.00 H new ATOM 0 HG12 VAL A 32 5.622 2.140 2.390 1.00 0.00 H new ATOM 0 HG13 VAL A 32 5.016 0.663 3.178 1.00 0.00 H new ATOM 0 HG21 VAL A 32 2.484 0.426 1.434 1.00 0.00 H new ATOM 0 HG22 VAL A 32 2.479 0.240 3.204 1.00 0.00 H new ATOM 0 HG23 VAL A 32 1.412 1.437 2.432 1.00 0.00 H new ATOM 509 N GLY A 33 3.966 5.025 3.218 1.00 0.00 N ATOM 510 CA GLY A 33 4.823 6.193 3.163 1.00 0.00 C ATOM 511 C GLY A 33 5.186 6.696 4.543 1.00 0.00 C ATOM 512 O GLY A 33 6.363 6.891 4.849 1.00 0.00 O ATOM 0 H GLY A 33 3.065 5.133 2.752 1.00 0.00 H new ATOM 0 HA2 GLY A 33 5.733 5.949 2.615 1.00 0.00 H new ATOM 0 HA3 GLY A 33 4.320 6.986 2.609 1.00 0.00 H new ATOM 516 N ASN A 34 4.182 6.886 5.394 1.00 0.00 N ATOM 517 CA ASN A 34 4.436 7.344 6.754 1.00 0.00 C ATOM 518 C ASN A 34 5.273 6.307 7.500 1.00 0.00 C ATOM 519 O ASN A 34 6.090 6.646 8.356 1.00 0.00 O ATOM 520 CB ASN A 34 3.126 7.642 7.498 1.00 0.00 C ATOM 521 CG ASN A 34 2.317 6.400 7.831 1.00 0.00 C ATOM 522 OD1 ASN A 34 2.859 5.379 8.252 1.00 0.00 O ATOM 523 ND2 ASN A 34 1.004 6.490 7.655 1.00 0.00 N ATOM 0 H ASN A 34 3.199 6.732 5.170 1.00 0.00 H new ATOM 0 HA ASN A 34 4.996 8.278 6.708 1.00 0.00 H new ATOM 0 HB2 ASN A 34 3.356 8.174 8.421 1.00 0.00 H new ATOM 0 HB3 ASN A 34 2.516 8.310 6.889 1.00 0.00 H new ATOM 0 HD21 ASN A 34 0.405 5.693 7.871 1.00 0.00 H new ATOM 0 HD22 ASN A 34 0.595 7.356 7.304 1.00 0.00 H new ATOM 530 N TYR A 35 5.059 5.041 7.156 1.00 0.00 N ATOM 531 CA TYR A 35 5.781 3.932 7.769 1.00 0.00 C ATOM 532 C TYR A 35 7.285 4.062 7.551 1.00 0.00 C ATOM 533 O TYR A 35 8.071 3.834 8.472 1.00 0.00 O ATOM 534 CB TYR A 35 5.284 2.618 7.177 1.00 0.00 C ATOM 535 CG TYR A 35 5.670 1.423 7.999 1.00 0.00 C ATOM 536 CD1 TYR A 35 6.996 1.049 8.114 1.00 0.00 C ATOM 537 CD2 TYR A 35 4.712 0.676 8.666 1.00 0.00 C ATOM 538 CE1 TYR A 35 7.363 -0.041 8.868 1.00 0.00 C ATOM 539 CE2 TYR A 35 5.068 -0.418 9.426 1.00 0.00 C ATOM 540 CZ TYR A 35 6.393 -0.775 9.525 1.00 0.00 C ATOM 541 OH TYR A 35 6.745 -1.868 10.282 1.00 0.00 O ATOM 0 H TYR A 35 4.383 4.756 6.447 1.00 0.00 H new ATOM 0 HA TYR A 35 5.595 3.950 8.843 1.00 0.00 H new ATOM 0 HB2 TYR A 35 4.198 2.654 7.086 1.00 0.00 H new ATOM 0 HB3 TYR A 35 5.685 2.505 6.170 1.00 0.00 H new ATOM 0 HD1 TYR A 35 7.756 1.622 7.603 1.00 0.00 H new ATOM 0 HD2 TYR A 35 3.671 0.955 8.589 1.00 0.00 H new ATOM 0 HE1 TYR A 35 8.403 -0.322 8.946 1.00 0.00 H new ATOM 0 HE2 TYR A 35 4.311 -0.991 9.941 1.00 0.00 H new ATOM 0 HH TYR A 35 5.940 -2.267 10.674 1.00 0.00 H new ATOM 551 N LEU A 36 7.688 4.437 6.341 1.00 0.00 N ATOM 552 CA LEU A 36 9.109 4.600 6.039 1.00 0.00 C ATOM 553 C LEU A 36 9.509 6.076 6.033 1.00 0.00 C ATOM 554 O LEU A 36 10.661 6.413 5.756 1.00 0.00 O ATOM 555 CB LEU A 36 9.461 3.955 4.696 1.00 0.00 C ATOM 556 CG LEU A 36 8.828 2.583 4.450 1.00 0.00 C ATOM 557 CD1 LEU A 36 7.730 2.679 3.402 1.00 0.00 C ATOM 558 CD2 LEU A 36 9.885 1.574 4.024 1.00 0.00 C ATOM 0 H LEU A 36 7.061 4.632 5.561 1.00 0.00 H new ATOM 0 HA LEU A 36 9.670 4.096 6.826 1.00 0.00 H new ATOM 0 HB2 LEU A 36 9.154 4.628 3.896 1.00 0.00 H new ATOM 0 HB3 LEU A 36 10.544 3.855 4.631 1.00 0.00 H new ATOM 0 HG LEU A 36 8.382 2.241 5.384 1.00 0.00 H new ATOM 0 HD11 LEU A 36 7.293 1.693 3.242 1.00 0.00 H new ATOM 0 HD12 LEU A 36 6.958 3.367 3.746 1.00 0.00 H new ATOM 0 HD13 LEU A 36 8.151 3.046 2.466 1.00 0.00 H new ATOM 0 HD21 LEU A 36 9.416 0.605 3.854 1.00 0.00 H new ATOM 0 HD22 LEU A 36 10.362 1.913 3.104 1.00 0.00 H new ATOM 0 HD23 LEU A 36 10.636 1.481 4.809 1.00 0.00 H new ATOM 570 N ARG A 37 8.555 6.952 6.346 1.00 0.00 N ATOM 571 CA ARG A 37 8.809 8.388 6.382 1.00 0.00 C ATOM 572 C ARG A 37 9.068 8.942 4.986 1.00 0.00 C ATOM 573 O ARG A 37 9.771 9.940 4.828 1.00 0.00 O ATOM 574 CB ARG A 37 9.996 8.702 7.295 1.00 0.00 C ATOM 575 CG ARG A 37 9.868 10.028 8.027 1.00 0.00 C ATOM 576 CD ARG A 37 11.096 10.317 8.875 1.00 0.00 C ATOM 577 NE ARG A 37 10.785 11.184 10.010 1.00 0.00 N ATOM 578 CZ ARG A 37 10.569 12.494 9.904 1.00 0.00 C ATOM 579 NH1 ARG A 37 10.628 13.091 8.720 1.00 0.00 N ATOM 580 NH2 ARG A 37 10.293 13.209 10.987 1.00 0.00 N ATOM 0 H ARG A 37 7.597 6.689 6.579 1.00 0.00 H new ATOM 0 HA ARG A 37 7.916 8.869 6.780 1.00 0.00 H new ATOM 0 HB2 ARG A 37 10.102 7.901 8.027 1.00 0.00 H new ATOM 0 HB3 ARG A 37 10.909 8.712 6.699 1.00 0.00 H new ATOM 0 HG2 ARG A 37 9.726 10.832 7.304 1.00 0.00 H new ATOM 0 HG3 ARG A 37 8.982 10.010 8.662 1.00 0.00 H new ATOM 0 HD2 ARG A 37 11.514 9.379 9.239 1.00 0.00 H new ATOM 0 HD3 ARG A 37 11.861 10.788 8.257 1.00 0.00 H new ATOM 0 HE ARG A 37 10.730 10.761 10.937 1.00 0.00 H new ATOM 0 HH11 ARG A 37 10.840 12.546 7.884 1.00 0.00 H new ATOM 0 HH12 ARG A 37 10.461 14.095 8.646 1.00 0.00 H new ATOM 0 HH21 ARG A 37 10.246 12.755 11.899 1.00 0.00 H new ATOM 0 HH22 ARG A 37 10.127 14.212 10.907 1.00 0.00 H new ATOM 594 N MET A 38 8.489 8.301 3.976 1.00 0.00 N ATOM 595 CA MET A 38 8.656 8.752 2.601 1.00 0.00 C ATOM 596 C MET A 38 7.425 9.528 2.149 1.00 0.00 C ATOM 597 O MET A 38 6.301 9.037 2.244 1.00 0.00 O ATOM 598 CB MET A 38 8.895 7.558 1.673 1.00 0.00 C ATOM 599 CG MET A 38 10.316 7.023 1.724 1.00 0.00 C ATOM 600 SD MET A 38 10.491 5.434 0.890 1.00 0.00 S ATOM 601 CE MET A 38 12.221 5.481 0.430 1.00 0.00 C ATOM 0 H MET A 38 7.904 7.473 4.083 1.00 0.00 H new ATOM 0 HA MET A 38 9.524 9.409 2.554 1.00 0.00 H new ATOM 0 HB2 MET A 38 8.205 6.758 1.939 1.00 0.00 H new ATOM 0 HB3 MET A 38 8.663 7.852 0.649 1.00 0.00 H new ATOM 0 HG2 MET A 38 10.989 7.746 1.264 1.00 0.00 H new ATOM 0 HG3 MET A 38 10.624 6.919 2.764 1.00 0.00 H new ATOM 0 HE1 MET A 38 12.564 4.472 0.201 1.00 0.00 H new ATOM 0 HE2 MET A 38 12.347 6.115 -0.447 1.00 0.00 H new ATOM 0 HE3 MET A 38 12.806 5.884 1.256 1.00 0.00 H new ATOM 611 N PHE A 39 7.645 10.744 1.664 1.00 0.00 N ATOM 612 CA PHE A 39 6.550 11.590 1.204 1.00 0.00 C ATOM 613 C PHE A 39 6.799 12.086 -0.217 1.00 0.00 C ATOM 614 O PHE A 39 7.861 11.841 -0.792 1.00 0.00 O ATOM 615 CB PHE A 39 6.365 12.776 2.156 1.00 0.00 C ATOM 616 CG PHE A 39 6.558 12.414 3.603 1.00 0.00 C ATOM 617 CD1 PHE A 39 7.812 12.489 4.188 1.00 0.00 C ATOM 618 CD2 PHE A 39 5.487 11.992 4.377 1.00 0.00 C ATOM 619 CE1 PHE A 39 7.996 12.152 5.515 1.00 0.00 C ATOM 620 CE2 PHE A 39 5.665 11.655 5.706 1.00 0.00 C ATOM 621 CZ PHE A 39 6.921 11.735 6.275 1.00 0.00 C ATOM 0 H PHE A 39 8.570 11.166 1.579 1.00 0.00 H new ATOM 0 HA PHE A 39 5.638 10.993 1.198 1.00 0.00 H new ATOM 0 HB2 PHE A 39 7.072 13.562 1.888 1.00 0.00 H new ATOM 0 HB3 PHE A 39 5.365 13.188 2.022 1.00 0.00 H new ATOM 0 HD1 PHE A 39 8.656 12.815 3.599 1.00 0.00 H new ATOM 0 HD2 PHE A 39 4.503 11.926 3.937 1.00 0.00 H new ATOM 0 HE1 PHE A 39 8.979 12.215 5.957 1.00 0.00 H new ATOM 0 HE2 PHE A 39 4.823 11.330 6.299 1.00 0.00 H new ATOM 0 HZ PHE A 39 7.062 11.472 7.313 1.00 0.00 H new ATOM 631 N ARG A 40 5.817 12.783 -0.778 1.00 0.00 N ATOM 632 CA ARG A 40 5.932 13.315 -2.132 1.00 0.00 C ATOM 633 C ARG A 40 6.236 12.204 -3.132 1.00 0.00 C ATOM 634 O ARG A 40 6.986 12.403 -4.087 1.00 0.00 O ATOM 635 CB ARG A 40 7.025 14.384 -2.190 1.00 0.00 C ATOM 636 CG ARG A 40 6.768 15.569 -1.273 1.00 0.00 C ATOM 637 CD ARG A 40 6.252 16.774 -2.045 1.00 0.00 C ATOM 638 NE ARG A 40 5.206 16.412 -3.001 1.00 0.00 N ATOM 639 CZ ARG A 40 5.416 16.219 -4.303 1.00 0.00 C ATOM 640 NH1 ARG A 40 6.634 16.339 -4.817 1.00 0.00 N ATOM 641 NH2 ARG A 40 4.400 15.901 -5.094 1.00 0.00 N ATOM 0 H ARG A 40 4.932 12.993 -0.316 1.00 0.00 H new ATOM 0 HA ARG A 40 4.977 13.766 -2.400 1.00 0.00 H new ATOM 0 HB2 ARG A 40 7.980 13.930 -1.924 1.00 0.00 H new ATOM 0 HB3 ARG A 40 7.117 14.742 -3.215 1.00 0.00 H new ATOM 0 HG2 ARG A 40 6.043 15.288 -0.509 1.00 0.00 H new ATOM 0 HG3 ARG A 40 7.689 15.835 -0.755 1.00 0.00 H new ATOM 0 HD2 ARG A 40 5.862 17.512 -1.344 1.00 0.00 H new ATOM 0 HD3 ARG A 40 7.080 17.245 -2.576 1.00 0.00 H new ATOM 0 HE ARG A 40 4.255 16.300 -2.649 1.00 0.00 H new ATOM 0 HH11 ARG A 40 7.420 16.581 -4.214 1.00 0.00 H new ATOM 0 HH12 ARG A 40 6.784 16.189 -5.815 1.00 0.00 H new ATOM 0 HH21 ARG A 40 3.462 15.805 -4.705 1.00 0.00 H new ATOM 0 HH22 ARG A 40 4.557 15.753 -6.091 1.00 0.00 H new ATOM 655 N GLY A 41 5.649 11.034 -2.904 1.00 0.00 N ATOM 656 CA GLY A 41 5.872 9.908 -3.791 1.00 0.00 C ATOM 657 C GLY A 41 7.258 9.312 -3.638 1.00 0.00 C ATOM 658 O GLY A 41 7.750 8.630 -4.538 1.00 0.00 O ATOM 0 H GLY A 41 5.023 10.846 -2.121 1.00 0.00 H new ATOM 0 HA2 GLY A 41 5.126 9.139 -3.591 1.00 0.00 H new ATOM 0 HA3 GLY A 41 5.730 10.229 -4.823 1.00 0.00 H new ATOM 662 N SER A 42 7.890 9.568 -2.497 1.00 0.00 N ATOM 663 CA SER A 42 9.227 9.050 -2.230 1.00 0.00 C ATOM 664 C SER A 42 9.236 7.525 -2.266 1.00 0.00 C ATOM 665 O SER A 42 10.219 6.909 -2.677 1.00 0.00 O ATOM 666 CB SER A 42 9.726 9.543 -0.871 1.00 0.00 C ATOM 667 OG SER A 42 10.464 10.745 -1.004 1.00 0.00 O ATOM 0 H SER A 42 7.498 10.131 -1.742 1.00 0.00 H new ATOM 0 HA SER A 42 9.895 9.418 -3.009 1.00 0.00 H new ATOM 0 HB2 SER A 42 8.878 9.705 -0.206 1.00 0.00 H new ATOM 0 HB3 SER A 42 10.351 8.778 -0.410 1.00 0.00 H new ATOM 0 HG SER A 42 9.855 11.511 -0.948 1.00 0.00 H new ATOM 673 N LEU A 43 8.133 6.924 -1.832 1.00 0.00 N ATOM 674 CA LEU A 43 8.012 5.472 -1.812 1.00 0.00 C ATOM 675 C LEU A 43 8.041 4.905 -3.228 1.00 0.00 C ATOM 676 O LEU A 43 8.816 3.997 -3.527 1.00 0.00 O ATOM 677 CB LEU A 43 6.716 5.058 -1.111 1.00 0.00 C ATOM 678 CG LEU A 43 6.423 3.557 -1.115 1.00 0.00 C ATOM 679 CD1 LEU A 43 7.217 2.856 -0.022 1.00 0.00 C ATOM 680 CD2 LEU A 43 4.934 3.304 -0.938 1.00 0.00 C ATOM 0 H LEU A 43 7.310 7.421 -1.490 1.00 0.00 H new ATOM 0 HA LEU A 43 8.861 5.068 -1.260 1.00 0.00 H new ATOM 0 HB2 LEU A 43 6.756 5.401 -0.077 1.00 0.00 H new ATOM 0 HB3 LEU A 43 5.883 5.576 -1.587 1.00 0.00 H new ATOM 0 HG LEU A 43 6.729 3.149 -2.078 1.00 0.00 H new ATOM 0 HD11 LEU A 43 6.996 1.789 -0.039 1.00 0.00 H new ATOM 0 HD12 LEU A 43 8.283 3.009 -0.192 1.00 0.00 H new ATOM 0 HD13 LEU A 43 6.941 3.268 0.949 1.00 0.00 H new ATOM 0 HD21 LEU A 43 4.744 2.231 -0.943 1.00 0.00 H new ATOM 0 HD22 LEU A 43 4.603 3.726 0.011 1.00 0.00 H new ATOM 0 HD23 LEU A 43 4.386 3.773 -1.755 1.00 0.00 H new ATOM 692 N TYR A 44 7.191 5.444 -4.095 1.00 0.00 N ATOM 693 CA TYR A 44 7.119 4.991 -5.478 1.00 0.00 C ATOM 694 C TYR A 44 8.411 5.305 -6.224 1.00 0.00 C ATOM 695 O TYR A 44 8.850 4.533 -7.077 1.00 0.00 O ATOM 696 CB TYR A 44 5.931 5.642 -6.187 1.00 0.00 C ATOM 697 CG TYR A 44 4.606 5.367 -5.513 1.00 0.00 C ATOM 698 CD1 TYR A 44 3.735 6.403 -5.200 1.00 0.00 C ATOM 699 CD2 TYR A 44 4.229 4.071 -5.188 1.00 0.00 C ATOM 700 CE1 TYR A 44 2.525 6.154 -4.580 1.00 0.00 C ATOM 701 CE2 TYR A 44 3.021 3.814 -4.570 1.00 0.00 C ATOM 702 CZ TYR A 44 2.174 4.858 -4.267 1.00 0.00 C ATOM 703 OH TYR A 44 0.970 4.605 -3.650 1.00 0.00 O ATOM 0 H TYR A 44 6.542 6.196 -3.864 1.00 0.00 H new ATOM 0 HA TYR A 44 6.981 3.910 -5.474 1.00 0.00 H new ATOM 0 HB2 TYR A 44 6.090 6.719 -6.233 1.00 0.00 H new ATOM 0 HB3 TYR A 44 5.889 5.282 -7.215 1.00 0.00 H new ATOM 0 HD1 TYR A 44 4.008 7.419 -5.445 1.00 0.00 H new ATOM 0 HD2 TYR A 44 4.891 3.251 -5.422 1.00 0.00 H new ATOM 0 HE1 TYR A 44 1.858 6.970 -4.342 1.00 0.00 H new ATOM 0 HE2 TYR A 44 2.741 2.800 -4.325 1.00 0.00 H new ATOM 0 HH TYR A 44 0.938 5.074 -2.790 1.00 0.00 H new ATOM 713 N LYS A 45 9.018 6.441 -5.897 1.00 0.00 N ATOM 714 CA LYS A 45 10.261 6.853 -6.535 1.00 0.00 C ATOM 715 C LYS A 45 11.411 5.938 -6.122 1.00 0.00 C ATOM 716 O LYS A 45 12.320 5.671 -6.907 1.00 0.00 O ATOM 717 CB LYS A 45 10.590 8.304 -6.174 1.00 0.00 C ATOM 718 CG LYS A 45 10.163 9.305 -7.236 1.00 0.00 C ATOM 719 CD LYS A 45 8.857 9.988 -6.865 1.00 0.00 C ATOM 720 CE LYS A 45 8.363 10.891 -7.985 1.00 0.00 C ATOM 721 NZ LYS A 45 9.381 11.909 -8.366 1.00 0.00 N ATOM 0 H LYS A 45 8.669 7.092 -5.194 1.00 0.00 H new ATOM 0 HA LYS A 45 10.130 6.778 -7.614 1.00 0.00 H new ATOM 0 HB2 LYS A 45 10.102 8.555 -5.232 1.00 0.00 H new ATOM 0 HB3 LYS A 45 11.664 8.395 -6.011 1.00 0.00 H new ATOM 0 HG2 LYS A 45 10.943 10.055 -7.365 1.00 0.00 H new ATOM 0 HG3 LYS A 45 10.049 8.796 -8.193 1.00 0.00 H new ATOM 0 HD2 LYS A 45 8.101 9.235 -6.643 1.00 0.00 H new ATOM 0 HD3 LYS A 45 8.997 10.575 -5.958 1.00 0.00 H new ATOM 0 HE2 LYS A 45 8.111 10.285 -8.856 1.00 0.00 H new ATOM 0 HE3 LYS A 45 7.448 11.393 -7.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 8.951 12.607 -9.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 9.727 12.390 -7.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 10.176 11.442 -8.846 1.00 0.00 H new ATOM 735 N ARG A 46 11.362 5.460 -4.882 1.00 0.00 N ATOM 736 CA ARG A 46 12.397 4.574 -4.361 1.00 0.00 C ATOM 737 C ARG A 46 12.034 3.106 -4.582 1.00 0.00 C ATOM 738 O ARG A 46 12.870 2.219 -4.406 1.00 0.00 O ATOM 739 CB ARG A 46 12.618 4.835 -2.871 1.00 0.00 C ATOM 740 CG ARG A 46 13.787 4.059 -2.284 1.00 0.00 C ATOM 741 CD ARG A 46 14.874 4.989 -1.768 1.00 0.00 C ATOM 742 NE ARG A 46 15.843 5.328 -2.808 1.00 0.00 N ATOM 743 CZ ARG A 46 17.056 5.817 -2.560 1.00 0.00 C ATOM 744 NH1 ARG A 46 17.452 6.025 -1.310 1.00 0.00 N ATOM 745 NH2 ARG A 46 17.876 6.098 -3.564 1.00 0.00 N ATOM 0 H ARG A 46 10.616 5.672 -4.219 1.00 0.00 H new ATOM 0 HA ARG A 46 13.319 4.783 -4.904 1.00 0.00 H new ATOM 0 HB2 ARG A 46 12.787 5.901 -2.719 1.00 0.00 H new ATOM 0 HB3 ARG A 46 11.710 4.575 -2.327 1.00 0.00 H new ATOM 0 HG2 ARG A 46 13.432 3.426 -1.470 1.00 0.00 H new ATOM 0 HG3 ARG A 46 14.204 3.398 -3.044 1.00 0.00 H new ATOM 0 HD2 ARG A 46 14.418 5.902 -1.385 1.00 0.00 H new ATOM 0 HD3 ARG A 46 15.390 4.516 -0.932 1.00 0.00 H new ATOM 0 HE ARG A 46 15.574 5.181 -3.781 1.00 0.00 H new ATOM 0 HH11 ARG A 46 16.826 5.810 -0.534 1.00 0.00 H new ATOM 0 HH12 ARG A 46 18.383 6.400 -1.125 1.00 0.00 H new ATOM 0 HH21 ARG A 46 17.577 5.939 -4.526 1.00 0.00 H new ATOM 0 HH22 ARG A 46 18.805 6.473 -3.374 1.00 0.00 H new ATOM 759 N TYR A 47 10.785 2.852 -4.968 1.00 0.00 N ATOM 760 CA TYR A 47 10.320 1.490 -5.209 1.00 0.00 C ATOM 761 C TYR A 47 9.534 1.406 -6.520 1.00 0.00 C ATOM 762 O TYR A 47 8.332 1.136 -6.518 1.00 0.00 O ATOM 763 CB TYR A 47 9.445 1.021 -4.044 1.00 0.00 C ATOM 764 CG TYR A 47 10.219 0.693 -2.787 1.00 0.00 C ATOM 765 CD1 TYR A 47 10.280 1.591 -1.729 1.00 0.00 C ATOM 766 CD2 TYR A 47 10.881 -0.519 -2.657 1.00 0.00 C ATOM 767 CE1 TYR A 47 10.984 1.289 -0.578 1.00 0.00 C ATOM 768 CE2 TYR A 47 11.586 -0.831 -1.511 1.00 0.00 C ATOM 769 CZ TYR A 47 11.634 0.077 -0.473 1.00 0.00 C ATOM 770 OH TYR A 47 12.337 -0.225 0.670 1.00 0.00 O ATOM 0 H TYR A 47 10.078 3.572 -5.120 1.00 0.00 H new ATOM 0 HA TYR A 47 11.191 0.840 -5.288 1.00 0.00 H new ATOM 0 HB2 TYR A 47 8.714 1.797 -3.816 1.00 0.00 H new ATOM 0 HB3 TYR A 47 8.886 0.138 -4.355 1.00 0.00 H new ATOM 0 HD1 TYR A 47 9.770 2.540 -1.807 1.00 0.00 H new ATOM 0 HD2 TYR A 47 10.844 -1.232 -3.467 1.00 0.00 H new ATOM 0 HE1 TYR A 47 11.025 1.999 0.235 1.00 0.00 H new ATOM 0 HE2 TYR A 47 12.096 -1.779 -1.428 1.00 0.00 H new ATOM 0 HH TYR A 47 12.085 0.398 1.383 1.00 0.00 H new ATOM 780 N PRO A 48 10.204 1.643 -7.664 1.00 0.00 N ATOM 781 CA PRO A 48 9.562 1.602 -8.985 1.00 0.00 C ATOM 782 C PRO A 48 9.002 0.224 -9.331 1.00 0.00 C ATOM 783 O PRO A 48 8.053 0.109 -10.107 1.00 0.00 O ATOM 784 CB PRO A 48 10.692 1.970 -9.955 1.00 0.00 C ATOM 785 CG PRO A 48 11.736 2.620 -9.113 1.00 0.00 C ATOM 786 CD PRO A 48 11.633 1.978 -7.762 1.00 0.00 C ATOM 0 HA PRO A 48 8.706 2.275 -9.028 1.00 0.00 H new ATOM 0 HB2 PRO A 48 11.085 1.085 -10.455 1.00 0.00 H new ATOM 0 HB3 PRO A 48 10.338 2.645 -10.734 1.00 0.00 H new ATOM 0 HG2 PRO A 48 12.728 2.475 -9.540 1.00 0.00 H new ATOM 0 HG3 PRO A 48 11.571 3.696 -9.048 1.00 0.00 H new ATOM 0 HD2 PRO A 48 12.262 1.091 -7.688 1.00 0.00 H new ATOM 0 HD3 PRO A 48 11.944 2.657 -6.968 1.00 0.00 H new ATOM 794 N SER A 49 9.598 -0.820 -8.762 1.00 0.00 N ATOM 795 CA SER A 49 9.156 -2.186 -9.026 1.00 0.00 C ATOM 796 C SER A 49 8.029 -2.606 -8.083 1.00 0.00 C ATOM 797 O SER A 49 7.636 -3.773 -8.059 1.00 0.00 O ATOM 798 CB SER A 49 10.331 -3.157 -8.896 1.00 0.00 C ATOM 799 OG SER A 49 9.881 -4.498 -8.823 1.00 0.00 O ATOM 0 H SER A 49 10.385 -0.747 -8.118 1.00 0.00 H new ATOM 0 HA SER A 49 8.771 -2.216 -10.045 1.00 0.00 H new ATOM 0 HB2 SER A 49 10.999 -3.041 -9.750 1.00 0.00 H new ATOM 0 HB3 SER A 49 10.909 -2.915 -8.004 1.00 0.00 H new ATOM 0 HG SER A 49 8.910 -4.525 -8.951 1.00 0.00 H new ATOM 805 N LEU A 50 7.514 -1.659 -7.304 1.00 0.00 N ATOM 806 CA LEU A 50 6.438 -1.952 -6.364 1.00 0.00 C ATOM 807 C LEU A 50 5.070 -1.823 -7.025 1.00 0.00 C ATOM 808 O LEU A 50 4.813 -0.881 -7.774 1.00 0.00 O ATOM 809 CB LEU A 50 6.519 -1.013 -5.161 1.00 0.00 C ATOM 810 CG LEU A 50 5.945 -1.573 -3.860 1.00 0.00 C ATOM 811 CD1 LEU A 50 6.883 -2.611 -3.266 1.00 0.00 C ATOM 812 CD2 LEU A 50 5.692 -0.449 -2.867 1.00 0.00 C ATOM 0 H LEU A 50 7.823 -0.687 -7.305 1.00 0.00 H new ATOM 0 HA LEU A 50 6.560 -2.983 -6.031 1.00 0.00 H new ATOM 0 HB2 LEU A 50 7.564 -0.750 -4.995 1.00 0.00 H new ATOM 0 HB3 LEU A 50 5.993 -0.090 -5.404 1.00 0.00 H new ATOM 0 HG LEU A 50 4.995 -2.059 -4.081 1.00 0.00 H new ATOM 0 HD11 LEU A 50 6.458 -2.998 -2.340 1.00 0.00 H new ATOM 0 HD12 LEU A 50 7.016 -3.429 -3.974 1.00 0.00 H new ATOM 0 HD13 LEU A 50 7.849 -2.151 -3.057 1.00 0.00 H new ATOM 0 HD21 LEU A 50 5.283 -0.863 -1.945 1.00 0.00 H new ATOM 0 HD22 LEU A 50 6.630 0.063 -2.650 1.00 0.00 H new ATOM 0 HD23 LEU A 50 4.982 0.260 -3.293 1.00 0.00 H new ATOM 824 N TRP A 51 4.194 -2.776 -6.728 1.00 0.00 N ATOM 825 CA TRP A 51 2.843 -2.778 -7.274 1.00 0.00 C ATOM 826 C TRP A 51 2.020 -1.645 -6.670 1.00 0.00 C ATOM 827 O TRP A 51 1.762 -1.630 -5.466 1.00 0.00 O ATOM 828 CB TRP A 51 2.155 -4.118 -6.990 1.00 0.00 C ATOM 829 CG TRP A 51 0.807 -4.236 -7.632 1.00 0.00 C ATOM 830 CD1 TRP A 51 0.510 -4.828 -8.827 1.00 0.00 C ATOM 831 CD2 TRP A 51 -0.429 -3.743 -7.110 1.00 0.00 C ATOM 832 NE1 TRP A 51 -0.838 -4.731 -9.077 1.00 0.00 N ATOM 833 CE2 TRP A 51 -1.435 -4.067 -8.036 1.00 0.00 C ATOM 834 CE3 TRP A 51 -0.778 -3.058 -5.946 1.00 0.00 C ATOM 835 CZ2 TRP A 51 -2.770 -3.726 -7.831 1.00 0.00 C ATOM 836 CZ3 TRP A 51 -2.099 -2.718 -5.741 1.00 0.00 C ATOM 837 CH2 TRP A 51 -3.083 -3.053 -6.680 1.00 0.00 C ATOM 0 H TRP A 51 4.397 -3.561 -6.109 1.00 0.00 H new ATOM 0 HA TRP A 51 2.912 -2.632 -8.352 1.00 0.00 H new ATOM 0 HB2 TRP A 51 2.792 -4.928 -7.345 1.00 0.00 H new ATOM 0 HB3 TRP A 51 2.050 -4.244 -5.912 1.00 0.00 H new ATOM 0 HD1 TRP A 51 1.229 -5.302 -9.479 1.00 0.00 H new ATOM 0 HE1 TRP A 51 -1.316 -5.094 -9.902 1.00 0.00 H new ATOM 0 HE3 TRP A 51 -0.025 -2.798 -5.216 1.00 0.00 H new ATOM 0 HZ2 TRP A 51 -3.531 -3.983 -8.553 1.00 0.00 H new ATOM 0 HZ3 TRP A 51 -2.379 -2.186 -4.844 1.00 0.00 H new ATOM 0 HH2 TRP A 51 -4.110 -2.775 -6.492 1.00 0.00 H new ATOM 848 N ARG A 52 1.609 -0.701 -7.506 1.00 0.00 N ATOM 849 CA ARG A 52 0.812 0.429 -7.044 1.00 0.00 C ATOM 850 C ARG A 52 -0.293 0.757 -8.041 1.00 0.00 C ATOM 851 O ARG A 52 -0.071 0.743 -9.252 1.00 0.00 O ATOM 852 CB ARG A 52 1.702 1.655 -6.828 1.00 0.00 C ATOM 853 CG ARG A 52 2.617 1.956 -8.005 1.00 0.00 C ATOM 854 CD ARG A 52 2.035 3.038 -8.900 1.00 0.00 C ATOM 855 NE ARG A 52 1.874 4.307 -8.192 1.00 0.00 N ATOM 856 CZ ARG A 52 1.727 5.482 -8.801 1.00 0.00 C ATOM 857 NH1 ARG A 52 1.721 5.555 -10.126 1.00 0.00 N ATOM 858 NH2 ARG A 52 1.585 6.587 -8.082 1.00 0.00 N ATOM 0 H ARG A 52 1.813 -0.694 -8.505 1.00 0.00 H new ATOM 0 HA ARG A 52 0.351 0.153 -6.095 1.00 0.00 H new ATOM 0 HB2 ARG A 52 1.071 2.523 -6.637 1.00 0.00 H new ATOM 0 HB3 ARG A 52 2.309 1.501 -5.936 1.00 0.00 H new ATOM 0 HG2 ARG A 52 3.593 2.273 -7.637 1.00 0.00 H new ATOM 0 HG3 ARG A 52 2.775 1.047 -8.586 1.00 0.00 H new ATOM 0 HD2 ARG A 52 2.686 3.184 -9.762 1.00 0.00 H new ATOM 0 HD3 ARG A 52 1.068 2.711 -9.282 1.00 0.00 H new ATOM 0 HE ARG A 52 1.874 4.291 -7.172 1.00 0.00 H new ATOM 0 HH11 ARG A 52 1.829 4.708 -10.684 1.00 0.00 H new ATOM 0 HH12 ARG A 52 1.608 6.458 -10.587 1.00 0.00 H new ATOM 0 HH21 ARG A 52 1.588 6.537 -7.063 1.00 0.00 H new ATOM 0 HH22 ARG A 52 1.472 7.487 -8.548 1.00 0.00 H new ATOM 872 N ARG A 53 -1.483 1.057 -7.531 1.00 0.00 N ATOM 873 CA ARG A 53 -2.613 1.393 -8.391 1.00 0.00 C ATOM 874 C ARG A 53 -3.621 2.279 -7.664 1.00 0.00 C ATOM 875 O ARG A 53 -3.692 2.275 -6.437 1.00 0.00 O ATOM 876 CB ARG A 53 -3.293 0.114 -8.909 1.00 0.00 C ATOM 877 CG ARG A 53 -4.422 -0.404 -8.025 1.00 0.00 C ATOM 878 CD ARG A 53 -5.219 -1.493 -8.725 1.00 0.00 C ATOM 879 NE ARG A 53 -6.422 -1.854 -7.979 1.00 0.00 N ATOM 880 CZ ARG A 53 -7.165 -2.926 -8.243 1.00 0.00 C ATOM 881 NH1 ARG A 53 -6.832 -3.745 -9.232 1.00 0.00 N ATOM 882 NH2 ARG A 53 -8.245 -3.179 -7.516 1.00 0.00 N ATOM 0 H ARG A 53 -1.690 1.075 -6.532 1.00 0.00 H new ATOM 0 HA ARG A 53 -2.230 1.955 -9.243 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -3.688 0.306 -9.906 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -2.540 -0.667 -9.010 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -4.008 -0.794 -7.095 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -5.084 0.419 -7.758 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -5.499 -1.154 -9.722 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -4.593 -2.376 -8.853 1.00 0.00 H new ATOM 0 HE ARG A 53 -6.710 -1.248 -7.210 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -6.003 -3.555 -9.795 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -7.405 -4.565 -9.430 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -8.506 -2.552 -6.755 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -8.815 -4.001 -7.718 1.00 0.00 H new ATOM 896 N LEU A 54 -4.409 3.024 -8.432 1.00 0.00 N ATOM 897 CA LEU A 54 -5.423 3.901 -7.861 1.00 0.00 C ATOM 898 C LEU A 54 -6.744 3.155 -7.713 1.00 0.00 C ATOM 899 O LEU A 54 -7.207 2.504 -8.649 1.00 0.00 O ATOM 900 CB LEU A 54 -5.614 5.140 -8.736 1.00 0.00 C ATOM 901 CG LEU A 54 -4.687 6.309 -8.407 1.00 0.00 C ATOM 902 CD1 LEU A 54 -3.882 6.723 -9.630 1.00 0.00 C ATOM 903 CD2 LEU A 54 -5.481 7.490 -7.867 1.00 0.00 C ATOM 0 H LEU A 54 -4.365 3.038 -9.451 1.00 0.00 H new ATOM 0 HA LEU A 54 -5.087 4.220 -6.875 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -5.463 4.858 -9.778 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -6.647 5.477 -8.643 1.00 0.00 H new ATOM 0 HG LEU A 54 -3.991 5.980 -7.635 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -3.230 7.557 -9.371 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -3.278 5.882 -9.970 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -4.561 7.028 -10.426 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -4.802 8.311 -7.639 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -6.205 7.814 -8.615 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -6.006 7.191 -6.960 1.00 0.00 H new ATOM 915 N ALA A 55 -7.342 3.246 -6.531 1.00 0.00 N ATOM 916 CA ALA A 55 -8.606 2.571 -6.263 1.00 0.00 C ATOM 917 C ALA A 55 -9.787 3.351 -6.830 1.00 0.00 C ATOM 918 O ALA A 55 -9.801 4.581 -6.804 1.00 0.00 O ATOM 919 CB ALA A 55 -8.782 2.360 -4.767 1.00 0.00 C ATOM 0 H ALA A 55 -6.973 3.780 -5.744 1.00 0.00 H new ATOM 0 HA ALA A 55 -8.579 1.601 -6.759 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -9.730 1.855 -4.580 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -7.964 1.748 -4.387 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -8.779 3.325 -4.261 1.00 0.00 H new ATOM 925 N THR A 56 -10.780 2.626 -7.337 1.00 0.00 N ATOM 926 CA THR A 56 -11.971 3.249 -7.903 1.00 0.00 C ATOM 927 C THR A 56 -12.833 3.842 -6.798 1.00 0.00 C ATOM 928 O THR A 56 -12.624 3.556 -5.621 1.00 0.00 O ATOM 929 CB THR A 56 -12.791 2.228 -8.695 1.00 0.00 C ATOM 930 OG1 THR A 56 -13.589 1.446 -7.821 1.00 0.00 O ATOM 931 CG2 THR A 56 -11.946 1.280 -9.519 1.00 0.00 C ATOM 0 H THR A 56 -10.783 1.606 -7.367 1.00 0.00 H new ATOM 0 HA THR A 56 -11.649 4.044 -8.576 1.00 0.00 H new ATOM 0 HB THR A 56 -13.405 2.818 -9.376 1.00 0.00 H new ATOM 0 HG1 THR A 56 -14.108 0.799 -8.343 1.00 0.00 H new ATOM 0 HG21 THR A 56 -12.594 0.585 -10.053 1.00 0.00 H new ATOM 0 HG22 THR A 56 -11.355 1.849 -10.237 1.00 0.00 H new ATOM 0 HG23 THR A 56 -11.279 0.722 -8.862 1.00 0.00 H new ATOM 939 N VAL A 57 -13.813 4.655 -7.180 1.00 0.00 N ATOM 940 CA VAL A 57 -14.709 5.271 -6.209 1.00 0.00 C ATOM 941 C VAL A 57 -15.331 4.209 -5.310 1.00 0.00 C ATOM 942 O VAL A 57 -15.332 4.337 -4.084 1.00 0.00 O ATOM 943 CB VAL A 57 -15.829 6.069 -6.904 1.00 0.00 C ATOM 944 CG1 VAL A 57 -16.758 6.698 -5.878 1.00 0.00 C ATOM 945 CG2 VAL A 57 -15.238 7.131 -7.819 1.00 0.00 C ATOM 0 H VAL A 57 -14.006 4.901 -8.151 1.00 0.00 H new ATOM 0 HA VAL A 57 -14.115 5.958 -5.607 1.00 0.00 H new ATOM 0 HB VAL A 57 -16.414 5.380 -7.513 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -17.541 7.257 -6.390 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -17.210 5.916 -5.268 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -16.190 7.373 -5.238 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -16.043 7.685 -8.301 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -14.626 7.817 -7.233 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -14.620 6.653 -8.579 1.00 0.00 H new ATOM 955 N GLU A 58 -15.844 3.151 -5.928 1.00 0.00 N ATOM 956 CA GLU A 58 -16.452 2.059 -5.183 1.00 0.00 C ATOM 957 C GLU A 58 -15.414 1.398 -4.286 1.00 0.00 C ATOM 958 O GLU A 58 -15.703 1.030 -3.146 1.00 0.00 O ATOM 959 CB GLU A 58 -17.054 1.027 -6.140 1.00 0.00 C ATOM 960 CG GLU A 58 -18.474 1.354 -6.573 1.00 0.00 C ATOM 961 CD GLU A 58 -19.489 1.099 -5.476 1.00 0.00 C ATOM 962 OE1 GLU A 58 -19.481 1.845 -4.475 1.00 0.00 O ATOM 963 OE2 GLU A 58 -20.293 0.154 -5.620 1.00 0.00 O ATOM 0 H GLU A 58 -15.850 3.028 -6.941 1.00 0.00 H new ATOM 0 HA GLU A 58 -17.251 2.464 -4.563 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -16.422 0.952 -7.025 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -17.046 0.049 -5.658 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -18.526 2.400 -6.876 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -18.731 0.756 -7.447 1.00 0.00 H new ATOM 970 N GLU A 59 -14.198 1.255 -4.807 1.00 0.00 N ATOM 971 CA GLU A 59 -13.114 0.645 -4.052 1.00 0.00 C ATOM 972 C GLU A 59 -12.783 1.472 -2.814 1.00 0.00 C ATOM 973 O GLU A 59 -12.574 0.925 -1.733 1.00 0.00 O ATOM 974 CB GLU A 59 -11.871 0.487 -4.930 1.00 0.00 C ATOM 975 CG GLU A 59 -11.817 -0.844 -5.664 1.00 0.00 C ATOM 976 CD GLU A 59 -10.931 -0.800 -6.893 1.00 0.00 C ATOM 977 OE1 GLU A 59 -9.842 -0.196 -6.818 1.00 0.00 O ATOM 978 OE2 GLU A 59 -11.327 -1.373 -7.930 1.00 0.00 O ATOM 0 H GLU A 59 -13.942 1.554 -5.748 1.00 0.00 H new ATOM 0 HA GLU A 59 -13.441 -0.343 -3.728 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -11.844 1.297 -5.659 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -10.981 0.588 -4.309 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -11.451 -1.614 -4.985 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -12.826 -1.133 -5.959 1.00 0.00 H new ATOM 985 N ARG A 60 -12.746 2.795 -2.970 1.00 0.00 N ATOM 986 CA ARG A 60 -12.450 3.678 -1.848 1.00 0.00 C ATOM 987 C ARG A 60 -13.518 3.537 -0.774 1.00 0.00 C ATOM 988 O ARG A 60 -13.211 3.481 0.416 1.00 0.00 O ATOM 989 CB ARG A 60 -12.362 5.136 -2.309 1.00 0.00 C ATOM 990 CG ARG A 60 -11.497 5.340 -3.542 1.00 0.00 C ATOM 991 CD ARG A 60 -10.948 6.756 -3.611 1.00 0.00 C ATOM 992 NE ARG A 60 -11.675 7.575 -4.579 1.00 0.00 N ATOM 993 CZ ARG A 60 -11.334 7.697 -5.861 1.00 0.00 C ATOM 994 NH1 ARG A 60 -10.274 7.057 -6.340 1.00 0.00 N ATOM 995 NH2 ARG A 60 -12.056 8.462 -6.668 1.00 0.00 N ATOM 0 H ARG A 60 -12.916 3.273 -3.855 1.00 0.00 H new ATOM 0 HA ARG A 60 -11.484 3.389 -1.433 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -13.367 5.502 -2.518 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -11.965 5.741 -1.494 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -10.671 4.629 -3.530 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -12.083 5.132 -4.437 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -11.010 7.218 -2.626 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -9.893 6.724 -3.882 1.00 0.00 H new ATOM 0 HE ARG A 60 -12.495 8.085 -4.252 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -9.714 6.467 -5.725 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -10.020 7.156 -7.323 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -12.872 8.957 -6.307 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -11.796 8.556 -7.650 1.00 0.00 H new ATOM 1009 N LYS A 61 -14.776 3.460 -1.203 1.00 0.00 N ATOM 1010 CA LYS A 61 -15.883 3.302 -0.269 1.00 0.00 C ATOM 1011 C LYS A 61 -15.677 2.040 0.558 1.00 0.00 C ATOM 1012 O LYS A 61 -15.819 2.052 1.780 1.00 0.00 O ATOM 1013 CB LYS A 61 -17.214 3.235 -1.022 1.00 0.00 C ATOM 1014 CG LYS A 61 -18.132 4.416 -0.738 1.00 0.00 C ATOM 1015 CD LYS A 61 -18.399 5.233 -1.993 1.00 0.00 C ATOM 1016 CE LYS A 61 -18.387 6.724 -1.699 1.00 0.00 C ATOM 1017 NZ LYS A 61 -18.889 7.522 -2.852 1.00 0.00 N ATOM 0 H LYS A 61 -15.051 3.504 -2.184 1.00 0.00 H new ATOM 0 HA LYS A 61 -15.912 4.164 0.397 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -17.015 3.189 -2.093 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -17.728 2.312 -0.753 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -19.076 4.054 -0.331 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -17.681 5.053 0.023 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -17.645 5.003 -2.745 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -19.365 4.952 -2.413 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -19.003 6.926 -0.822 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -17.372 7.038 -1.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -18.865 8.533 -2.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -18.287 7.349 -3.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -19.867 7.241 -3.069 1.00 0.00 H new ATOM 1031 N LYS A 62 -15.314 0.956 -0.122 1.00 0.00 N ATOM 1032 CA LYS A 62 -15.057 -0.312 0.545 1.00 0.00 C ATOM 1033 C LYS A 62 -13.802 -0.202 1.403 1.00 0.00 C ATOM 1034 O LYS A 62 -13.714 -0.797 2.477 1.00 0.00 O ATOM 1035 CB LYS A 62 -14.896 -1.435 -0.481 1.00 0.00 C ATOM 1036 CG LYS A 62 -16.195 -1.819 -1.171 1.00 0.00 C ATOM 1037 CD LYS A 62 -15.939 -2.447 -2.532 1.00 0.00 C ATOM 1038 CE LYS A 62 -17.054 -2.127 -3.515 1.00 0.00 C ATOM 1039 NZ LYS A 62 -17.641 -3.360 -4.109 1.00 0.00 N ATOM 0 H LYS A 62 -15.192 0.933 -1.134 1.00 0.00 H new ATOM 0 HA LYS A 62 -15.907 -0.548 1.185 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -14.171 -1.126 -1.235 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -14.485 -2.314 0.016 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -16.748 -2.519 -0.544 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -16.821 -0.934 -1.289 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -14.990 -2.085 -2.927 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -15.848 -3.528 -2.423 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -17.835 -1.562 -3.007 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -16.666 -1.490 -4.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -18.397 -3.099 -4.773 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -16.902 -3.887 -4.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -18.035 -3.956 -3.353 1.00 0.00 H new ATOM 1053 N ILE A 63 -12.833 0.574 0.919 1.00 0.00 N ATOM 1054 CA ILE A 63 -11.582 0.776 1.637 1.00 0.00 C ATOM 1055 C ILE A 63 -11.841 1.397 3.006 1.00 0.00 C ATOM 1056 O ILE A 63 -11.293 0.955 4.012 1.00 0.00 O ATOM 1057 CB ILE A 63 -10.609 1.672 0.835 1.00 0.00 C ATOM 1058 CG1 ILE A 63 -10.030 0.894 -0.349 1.00 0.00 C ATOM 1059 CG2 ILE A 63 -9.485 2.192 1.724 1.00 0.00 C ATOM 1060 CD1 ILE A 63 -9.614 1.773 -1.508 1.00 0.00 C ATOM 0 H ILE A 63 -12.894 1.072 0.031 1.00 0.00 H new ATOM 0 HA ILE A 63 -11.121 -0.203 1.769 1.00 0.00 H new ATOM 0 HB ILE A 63 -11.168 2.529 0.458 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -9.166 0.322 -0.009 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -10.771 0.175 -0.697 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -8.816 2.819 1.135 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -9.908 2.779 2.539 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -8.927 1.351 2.134 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -9.213 1.153 -2.310 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -10.479 2.325 -1.875 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -8.849 2.475 -1.176 1.00 0.00 H new ATOM 1072 N VAL A 64 -12.679 2.426 3.034 1.00 0.00 N ATOM 1073 CA VAL A 64 -13.007 3.108 4.278 1.00 0.00 C ATOM 1074 C VAL A 64 -13.611 2.148 5.300 1.00 0.00 C ATOM 1075 O VAL A 64 -13.187 2.106 6.453 1.00 0.00 O ATOM 1076 CB VAL A 64 -13.994 4.267 4.036 1.00 0.00 C ATOM 1077 CG1 VAL A 64 -14.181 5.085 5.305 1.00 0.00 C ATOM 1078 CG2 VAL A 64 -13.514 5.145 2.888 1.00 0.00 C ATOM 0 H VAL A 64 -13.143 2.806 2.209 1.00 0.00 H new ATOM 0 HA VAL A 64 -12.072 3.506 4.672 1.00 0.00 H new ATOM 0 HB VAL A 64 -14.961 3.846 3.760 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -14.881 5.898 5.114 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -14.574 4.446 6.095 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -13.222 5.498 5.616 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -14.223 5.958 2.731 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -12.535 5.559 3.131 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -13.440 4.548 1.979 1.00 0.00 H new ATOM 1088 N ALA A 65 -14.608 1.383 4.869 1.00 0.00 N ATOM 1089 CA ALA A 65 -15.278 0.430 5.747 1.00 0.00 C ATOM 1090 C ALA A 65 -14.401 -0.783 6.053 1.00 0.00 C ATOM 1091 O ALA A 65 -14.321 -1.227 7.198 1.00 0.00 O ATOM 1092 CB ALA A 65 -16.594 -0.016 5.128 1.00 0.00 C ATOM 0 H ALA A 65 -14.971 1.404 3.916 1.00 0.00 H new ATOM 0 HA ALA A 65 -15.475 0.937 6.692 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -17.086 -0.727 5.792 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -17.239 0.850 4.982 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -16.401 -0.491 4.166 1.00 0.00 H new ATOM 1098 N SER A 66 -13.765 -1.327 5.021 1.00 0.00 N ATOM 1099 CA SER A 66 -12.916 -2.505 5.181 1.00 0.00 C ATOM 1100 C SER A 66 -11.605 -2.177 5.893 1.00 0.00 C ATOM 1101 O SER A 66 -11.232 -2.842 6.858 1.00 0.00 O ATOM 1102 CB SER A 66 -12.618 -3.128 3.815 1.00 0.00 C ATOM 1103 OG SER A 66 -12.462 -4.533 3.918 1.00 0.00 O ATOM 0 H SER A 66 -13.820 -0.973 4.066 1.00 0.00 H new ATOM 0 HA SER A 66 -13.462 -3.216 5.801 1.00 0.00 H new ATOM 0 HB2 SER A 66 -13.428 -2.899 3.123 1.00 0.00 H new ATOM 0 HB3 SER A 66 -11.711 -2.688 3.401 1.00 0.00 H new ATOM 0 HG SER A 66 -12.274 -4.907 3.032 1.00 0.00 H new ATOM 1109 N SER A 67 -10.902 -1.159 5.408 1.00 0.00 N ATOM 1110 CA SER A 67 -9.627 -0.763 5.999 1.00 0.00 C ATOM 1111 C SER A 67 -9.806 -0.275 7.433 1.00 0.00 C ATOM 1112 O SER A 67 -9.174 -0.791 8.355 1.00 0.00 O ATOM 1113 CB SER A 67 -8.961 0.327 5.158 1.00 0.00 C ATOM 1114 OG SER A 67 -7.566 0.378 5.401 1.00 0.00 O ATOM 0 H SER A 67 -11.192 -0.594 4.610 1.00 0.00 H new ATOM 0 HA SER A 67 -8.985 -1.644 6.016 1.00 0.00 H new ATOM 0 HB2 SER A 67 -9.142 0.136 4.100 1.00 0.00 H new ATOM 0 HB3 SER A 67 -9.409 1.293 5.389 1.00 0.00 H new ATOM 0 HG SER A 67 -7.240 -0.518 5.628 1.00 0.00 H new ATOM 1120 N HIS A 68 -10.661 0.725 7.617 1.00 0.00 N ATOM 1121 CA HIS A 68 -10.905 1.280 8.944 1.00 0.00 C ATOM 1122 C HIS A 68 -12.096 2.241 8.931 1.00 0.00 C ATOM 1123 O HIS A 68 -13.238 1.823 9.121 1.00 0.00 O ATOM 1124 CB HIS A 68 -9.647 1.988 9.464 1.00 0.00 C ATOM 1125 CG HIS A 68 -8.804 2.602 8.385 1.00 0.00 C ATOM 1126 ND1 HIS A 68 -9.308 2.985 7.158 1.00 0.00 N ATOM 1127 CD2 HIS A 68 -7.484 2.899 8.355 1.00 0.00 C ATOM 1128 CE1 HIS A 68 -8.334 3.491 6.423 1.00 0.00 C ATOM 1129 NE2 HIS A 68 -7.218 3.452 7.126 1.00 0.00 N ATOM 0 H HIS A 68 -11.195 1.166 6.868 1.00 0.00 H new ATOM 0 HA HIS A 68 -11.148 0.457 9.616 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -9.945 2.767 10.166 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -9.042 1.271 10.020 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -6.772 2.732 9.150 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -8.434 3.872 5.417 1.00 0.00 H new ATOM 0 HE2 HIS A 68 -6.306 3.779 6.808 1.00 0.00 H new ATOM 1138 N GLY A 69 -11.829 3.526 8.706 1.00 0.00 N ATOM 1139 CA GLY A 69 -12.892 4.509 8.673 1.00 0.00 C ATOM 1140 C GLY A 69 -13.190 5.090 10.041 1.00 0.00 C ATOM 1141 O GLY A 69 -12.808 6.222 10.340 1.00 0.00 O ATOM 0 H GLY A 69 -10.894 3.901 8.546 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -12.616 5.314 7.992 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -13.795 4.049 8.273 1.00 0.00 H new ATOM 1145 N LYS A 70 -13.874 4.314 10.876 1.00 0.00 N ATOM 1146 CA LYS A 70 -14.224 4.758 12.220 1.00 0.00 C ATOM 1147 C LYS A 70 -13.063 4.538 13.185 1.00 0.00 C ATOM 1148 O LYS A 70 -12.633 3.406 13.407 1.00 0.00 O ATOM 1149 CB LYS A 70 -15.466 4.016 12.718 1.00 0.00 C ATOM 1150 CG LYS A 70 -16.754 4.808 12.556 1.00 0.00 C ATOM 1151 CD LYS A 70 -16.962 5.249 11.115 1.00 0.00 C ATOM 1152 CE LYS A 70 -16.603 6.713 10.921 1.00 0.00 C ATOM 1153 NZ LYS A 70 -17.812 7.565 10.749 1.00 0.00 N ATOM 0 H LYS A 70 -14.197 3.374 10.645 1.00 0.00 H new ATOM 0 HA LYS A 70 -14.440 5.825 12.179 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -15.558 3.074 12.177 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -15.332 3.767 13.771 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -17.599 4.199 12.876 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -16.728 5.683 13.205 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -16.352 4.633 10.454 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -18.002 5.088 10.831 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -16.032 7.063 11.781 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -15.959 6.816 10.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -17.523 8.556 10.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -18.344 7.248 9.914 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -18.414 7.488 11.593 1.00 0.00 H new ATOM 1167 N LYS A 71 -12.560 5.627 13.758 1.00 0.00 N ATOM 1168 CA LYS A 71 -11.449 5.554 14.700 1.00 0.00 C ATOM 1169 C LYS A 71 -11.868 6.068 16.073 1.00 0.00 C ATOM 1170 O LYS A 71 -12.636 7.024 16.181 1.00 0.00 O ATOM 1171 CB LYS A 71 -10.258 6.360 14.183 1.00 0.00 C ATOM 1172 CG LYS A 71 -9.610 5.762 12.943 1.00 0.00 C ATOM 1173 CD LYS A 71 -9.904 6.589 11.703 1.00 0.00 C ATOM 1174 CE LYS A 71 -8.792 7.588 11.424 1.00 0.00 C ATOM 1175 NZ LYS A 71 -8.989 8.862 12.171 1.00 0.00 N ATOM 0 H LYS A 71 -12.905 6.571 13.586 1.00 0.00 H new ATOM 0 HA LYS A 71 -11.155 4.509 14.796 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -10.587 7.374 13.957 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -9.511 6.435 14.973 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -8.532 5.697 13.091 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -9.973 4.745 12.797 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -10.026 5.929 10.844 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -10.847 7.120 11.833 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -7.833 7.150 11.700 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -8.751 7.797 10.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -8.210 9.516 11.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -9.892 9.294 11.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -9.002 8.667 13.192 1.00 0.00 H new ATOM 1189 N THR A 72 -11.358 5.429 17.121 1.00 0.00 N ATOM 1190 CA THR A 72 -11.681 5.823 18.488 1.00 0.00 C ATOM 1191 C THR A 72 -10.492 6.513 19.150 1.00 0.00 C ATOM 1192 O THR A 72 -9.920 6.003 20.115 1.00 0.00 O ATOM 1193 CB THR A 72 -12.101 4.601 19.307 1.00 0.00 C ATOM 1194 OG1 THR A 72 -12.507 4.987 20.609 1.00 0.00 O ATOM 1195 CG2 THR A 72 -11.002 3.571 19.455 1.00 0.00 C ATOM 0 H THR A 72 -10.720 4.637 17.050 1.00 0.00 H new ATOM 0 HA THR A 72 -12.511 6.528 18.451 1.00 0.00 H new ATOM 0 HB THR A 72 -12.924 4.151 18.752 1.00 0.00 H new ATOM 0 HG1 THR A 72 -12.773 4.193 21.118 1.00 0.00 H new ATOM 0 HG21 THR A 72 -11.367 2.731 20.046 1.00 0.00 H new ATOM 0 HG22 THR A 72 -10.700 3.217 18.469 1.00 0.00 H new ATOM 0 HG23 THR A 72 -10.146 4.022 19.956 1.00 0.00 H new ATOM 1203 N LYS A 73 -10.123 7.678 18.627 1.00 0.00 N ATOM 1204 CA LYS A 73 -9.004 8.440 19.167 1.00 0.00 C ATOM 1205 C LYS A 73 -9.126 9.919 18.800 1.00 0.00 C ATOM 1206 O LYS A 73 -9.339 10.259 17.637 1.00 0.00 O ATOM 1207 CB LYS A 73 -7.679 7.880 18.643 1.00 0.00 C ATOM 1208 CG LYS A 73 -7.041 6.856 19.569 1.00 0.00 C ATOM 1209 CD LYS A 73 -5.805 7.416 20.254 1.00 0.00 C ATOM 1210 CE LYS A 73 -4.662 7.608 19.270 1.00 0.00 C ATOM 1211 NZ LYS A 73 -3.808 8.773 19.631 1.00 0.00 N ATOM 0 H LYS A 73 -10.584 8.115 17.829 1.00 0.00 H new ATOM 0 HA LYS A 73 -9.024 8.350 20.253 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -7.848 7.421 17.669 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -6.981 8.703 18.490 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -7.765 6.544 20.322 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -6.771 5.967 18.999 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -6.048 8.370 20.722 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -5.492 6.741 21.050 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -4.052 6.705 19.242 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -5.066 7.751 18.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -3.041 8.870 18.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -4.384 9.639 19.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -3.402 8.626 20.577 1.00 0.00 H new ATOM 1225 N PRO A 74 -8.992 10.823 19.789 1.00 0.00 N ATOM 1226 CA PRO A 74 -9.091 12.267 19.552 1.00 0.00 C ATOM 1227 C PRO A 74 -8.142 12.738 18.455 1.00 0.00 C ATOM 1228 O PRO A 74 -6.946 12.916 18.689 1.00 0.00 O ATOM 1229 CB PRO A 74 -8.696 12.881 20.898 1.00 0.00 C ATOM 1230 CG PRO A 74 -8.993 11.821 21.901 1.00 0.00 C ATOM 1231 CD PRO A 74 -8.736 10.513 21.209 1.00 0.00 C ATOM 0 HA PRO A 74 -10.086 12.556 19.215 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -7.641 13.156 20.913 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -9.265 13.788 21.101 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -8.359 11.928 22.781 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -10.026 11.885 22.243 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -7.714 10.168 21.367 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -9.398 9.728 21.575 1.00 0.00 H new ATOM 1239 N ASN A 75 -8.683 12.941 17.258 1.00 0.00 N ATOM 1240 CA ASN A 75 -7.884 13.392 16.126 1.00 0.00 C ATOM 1241 C ASN A 75 -8.727 14.222 15.161 1.00 0.00 C ATOM 1242 O ASN A 75 -9.908 13.944 14.956 1.00 0.00 O ATOM 1243 CB ASN A 75 -7.278 12.194 15.391 1.00 0.00 C ATOM 1244 CG ASN A 75 -5.885 11.857 15.888 1.00 0.00 C ATOM 1245 OD1 ASN A 75 -5.288 12.611 16.655 1.00 0.00 O ATOM 1246 ND2 ASN A 75 -5.360 10.718 15.449 1.00 0.00 N ATOM 0 H ASN A 75 -9.671 12.800 17.048 1.00 0.00 H new ATOM 0 HA ASN A 75 -7.079 14.019 16.509 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -7.926 11.327 15.518 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -7.238 12.408 14.323 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -4.426 10.439 15.748 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -5.891 10.123 14.813 1.00 0.00 H new ATOM 1253 N THR A 76 -8.108 15.241 14.571 1.00 0.00 N ATOM 1254 CA THR A 76 -8.798 16.115 13.626 1.00 0.00 C ATOM 1255 C THR A 76 -10.049 16.723 14.255 1.00 0.00 C ATOM 1256 O THR A 76 -10.369 16.451 15.411 1.00 0.00 O ATOM 1257 CB THR A 76 -9.174 15.341 12.361 1.00 0.00 C ATOM 1258 OG1 THR A 76 -10.314 14.532 12.586 1.00 0.00 O ATOM 1259 CG2 THR A 76 -8.065 14.442 11.856 1.00 0.00 C ATOM 0 H THR A 76 -7.130 15.482 14.730 1.00 0.00 H new ATOM 0 HA THR A 76 -8.118 16.924 13.360 1.00 0.00 H new ATOM 0 HB THR A 76 -9.374 16.103 11.607 1.00 0.00 H new ATOM 0 HG1 THR A 76 -10.105 13.852 13.259 1.00 0.00 H new ATOM 0 HG21 THR A 76 -8.398 13.923 10.957 1.00 0.00 H new ATOM 0 HG22 THR A 76 -7.187 15.044 11.623 1.00 0.00 H new ATOM 0 HG23 THR A 76 -7.811 13.711 12.624 1.00 0.00 H new ATOM 1267 N LYS A 77 -10.750 17.546 13.483 1.00 0.00 N ATOM 1268 CA LYS A 77 -11.967 18.193 13.963 1.00 0.00 C ATOM 1269 C LYS A 77 -13.196 17.635 13.255 1.00 0.00 C ATOM 1270 O LYS A 77 -14.273 17.539 13.844 1.00 0.00 O ATOM 1271 CB LYS A 77 -11.883 19.707 13.747 1.00 0.00 C ATOM 1272 CG LYS A 77 -11.344 20.465 14.950 1.00 0.00 C ATOM 1273 CD LYS A 77 -12.448 20.793 15.944 1.00 0.00 C ATOM 1274 CE LYS A 77 -12.376 22.242 16.398 1.00 0.00 C ATOM 1275 NZ LYS A 77 -12.731 23.187 15.303 1.00 0.00 N ATOM 0 H LYS A 77 -10.497 17.781 12.523 1.00 0.00 H new ATOM 0 HA LYS A 77 -12.061 17.989 15.030 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -11.245 19.908 12.886 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -12.875 20.086 13.504 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -10.575 19.869 15.442 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -10.868 21.387 14.617 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -13.419 20.601 15.487 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -12.367 20.135 16.809 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -13.052 22.392 17.240 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -11.369 22.461 16.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -12.967 24.115 15.708 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -11.923 23.287 14.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -13.551 22.819 14.779 1.00 0.00 H new ATOM 1289 N ASP A 78 -13.028 17.265 11.990 1.00 0.00 N ATOM 1290 CA ASP A 78 -14.125 16.716 11.202 1.00 0.00 C ATOM 1291 C ASP A 78 -14.238 15.208 11.405 1.00 0.00 C ATOM 1292 O ASP A 78 -13.241 14.488 11.346 1.00 0.00 O ATOM 1293 CB ASP A 78 -13.921 17.029 9.719 1.00 0.00 C ATOM 1294 CG ASP A 78 -15.229 17.295 8.999 1.00 0.00 C ATOM 1295 OD1 ASP A 78 -15.263 17.158 7.758 1.00 0.00 O ATOM 1296 OD2 ASP A 78 -16.221 17.638 9.677 1.00 0.00 O ATOM 0 H ASP A 78 -12.143 17.335 11.489 1.00 0.00 H new ATOM 0 HA ASP A 78 -15.051 17.181 11.540 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -13.272 17.899 9.620 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -13.410 16.193 9.241 1.00 0.00 H new ATOM 1301 N HIS A 79 -15.458 14.738 11.643 1.00 0.00 N ATOM 1302 CA HIS A 79 -15.702 13.317 11.855 1.00 0.00 C ATOM 1303 C HIS A 79 -15.826 12.582 10.523 1.00 0.00 C ATOM 1304 O HIS A 79 -15.405 11.431 10.396 1.00 0.00 O ATOM 1305 CB HIS A 79 -16.970 13.113 12.687 1.00 0.00 C ATOM 1306 CG HIS A 79 -16.715 12.473 14.017 1.00 0.00 C ATOM 1307 ND1 HIS A 79 -16.014 11.294 14.163 1.00 0.00 N ATOM 1308 CD2 HIS A 79 -17.071 12.855 15.267 1.00 0.00 C ATOM 1309 CE1 HIS A 79 -15.951 10.978 15.445 1.00 0.00 C ATOM 1310 NE2 HIS A 79 -16.583 11.909 16.135 1.00 0.00 N ATOM 0 H HIS A 79 -16.293 15.321 11.694 1.00 0.00 H new ATOM 0 HA HIS A 79 -14.852 12.904 12.398 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -17.452 14.078 12.843 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -17.669 12.495 12.124 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -17.633 13.738 15.532 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -15.465 10.106 15.858 1.00 0.00 H new ATOM 0 HE2 HIS A 79 -16.691 11.924 17.149 1.00 0.00 H new ATOM 1319 N GLY A 80 -16.405 13.254 9.533 1.00 0.00 N ATOM 1320 CA GLY A 80 -16.572 12.650 8.226 1.00 0.00 C ATOM 1321 C GLY A 80 -15.248 12.319 7.566 1.00 0.00 C ATOM 1322 O GLY A 80 -14.297 13.095 7.645 1.00 0.00 O ATOM 0 H GLY A 80 -16.761 14.206 9.614 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -17.164 11.740 8.323 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -17.134 13.329 7.585 1.00 0.00 H new ATOM 1326 N TYR A 81 -15.187 11.162 6.914 1.00 0.00 N ATOM 1327 CA TYR A 81 -13.969 10.731 6.238 1.00 0.00 C ATOM 1328 C TYR A 81 -13.839 11.394 4.871 1.00 0.00 C ATOM 1329 O TYR A 81 -14.811 11.491 4.122 1.00 0.00 O ATOM 1330 CB TYR A 81 -13.957 9.209 6.084 1.00 0.00 C ATOM 1331 CG TYR A 81 -15.052 8.681 5.185 1.00 0.00 C ATOM 1332 CD1 TYR A 81 -16.223 8.157 5.718 1.00 0.00 C ATOM 1333 CD2 TYR A 81 -14.916 8.708 3.803 1.00 0.00 C ATOM 1334 CE1 TYR A 81 -17.226 7.673 4.899 1.00 0.00 C ATOM 1335 CE2 TYR A 81 -15.914 8.226 2.977 1.00 0.00 C ATOM 1336 CZ TYR A 81 -17.066 7.710 3.530 1.00 0.00 C ATOM 1337 OH TYR A 81 -18.063 7.230 2.712 1.00 0.00 O ATOM 0 H TYR A 81 -15.966 10.507 6.840 1.00 0.00 H new ATOM 0 HA TYR A 81 -13.119 11.034 6.849 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -12.991 8.901 5.685 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -14.055 8.752 7.069 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -16.352 8.127 6.790 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -14.015 9.113 3.366 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -18.130 7.268 5.329 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -15.792 8.254 1.904 1.00 0.00 H new ATOM 0 HH TYR A 81 -17.794 7.330 1.775 1.00 0.00 H new ATOM 1347 N THR A 82 -12.632 11.849 4.553 1.00 0.00 N ATOM 1348 CA THR A 82 -12.372 12.503 3.276 1.00 0.00 C ATOM 1349 C THR A 82 -10.881 12.493 2.955 1.00 0.00 C ATOM 1350 O THR A 82 -10.367 13.412 2.317 1.00 0.00 O ATOM 1351 CB THR A 82 -12.892 13.941 3.299 1.00 0.00 C ATOM 1352 OG1 THR A 82 -12.726 14.554 2.033 1.00 0.00 O ATOM 1353 CG2 THR A 82 -12.198 14.812 4.324 1.00 0.00 C ATOM 0 H THR A 82 -11.818 11.777 5.163 1.00 0.00 H new ATOM 0 HA THR A 82 -12.897 11.948 2.498 1.00 0.00 H new ATOM 0 HB THR A 82 -13.946 13.863 3.566 1.00 0.00 H new ATOM 0 HG1 THR A 82 -11.812 14.403 1.714 1.00 0.00 H new ATOM 0 HG21 THR A 82 -12.614 15.819 4.288 1.00 0.00 H new ATOM 0 HG22 THR A 82 -12.348 14.393 5.319 1.00 0.00 H new ATOM 0 HG23 THR A 82 -11.131 14.852 4.105 1.00 0.00 H new ATOM 1361 N THR A 83 -10.192 11.448 3.403 1.00 0.00 N ATOM 1362 CA THR A 83 -8.759 11.317 3.167 1.00 0.00 C ATOM 1363 C THR A 83 -8.441 10.060 2.355 1.00 0.00 C ATOM 1364 O THR A 83 -7.286 9.814 2.009 1.00 0.00 O ATOM 1365 CB THR A 83 -8.006 11.279 4.496 1.00 0.00 C ATOM 1366 OG1 THR A 83 -8.462 12.305 5.360 1.00 0.00 O ATOM 1367 CG2 THR A 83 -6.508 11.441 4.341 1.00 0.00 C ATOM 0 H THR A 83 -10.604 10.679 3.932 1.00 0.00 H new ATOM 0 HA THR A 83 -8.435 12.185 2.592 1.00 0.00 H new ATOM 0 HB THR A 83 -8.207 10.292 4.914 1.00 0.00 H new ATOM 0 HG1 THR A 83 -7.969 12.263 6.206 1.00 0.00 H new ATOM 0 HG21 THR A 83 -6.035 11.405 5.322 1.00 0.00 H new ATOM 0 HG22 THR A 83 -6.117 10.635 3.720 1.00 0.00 H new ATOM 0 HG23 THR A 83 -6.293 12.400 3.869 1.00 0.00 H new ATOM 1375 N LEU A 84 -9.468 9.269 2.052 1.00 0.00 N ATOM 1376 CA LEU A 84 -9.286 8.049 1.283 1.00 0.00 C ATOM 1377 C LEU A 84 -10.553 7.691 0.513 1.00 0.00 C ATOM 1378 O LEU A 84 -10.862 6.517 0.317 1.00 0.00 O ATOM 1379 CB LEU A 84 -8.882 6.889 2.199 1.00 0.00 C ATOM 1380 CG LEU A 84 -9.601 6.835 3.550 1.00 0.00 C ATOM 1381 CD1 LEU A 84 -9.066 7.908 4.485 1.00 0.00 C ATOM 1382 CD2 LEU A 84 -11.104 6.985 3.366 1.00 0.00 C ATOM 0 H LEU A 84 -10.432 9.454 2.329 1.00 0.00 H new ATOM 0 HA LEU A 84 -8.486 8.225 0.564 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -9.065 5.952 1.672 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -7.809 6.949 2.380 1.00 0.00 H new ATOM 0 HG LEU A 84 -9.408 5.861 4.000 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -9.590 7.853 5.439 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -8.000 7.751 4.647 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -9.225 8.890 4.040 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -11.595 6.944 4.338 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -11.319 7.942 2.891 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -11.476 6.176 2.737 1.00 0.00 H new ATOM 1394 N ALA A 85 -11.283 8.713 0.076 1.00 0.00 N ATOM 1395 CA ALA A 85 -12.515 8.503 -0.676 1.00 0.00 C ATOM 1396 C ALA A 85 -12.446 9.159 -2.055 1.00 0.00 C ATOM 1397 O ALA A 85 -13.239 8.840 -2.941 1.00 0.00 O ATOM 1398 CB ALA A 85 -13.708 9.031 0.102 1.00 0.00 C ATOM 0 H ALA A 85 -11.043 9.692 0.229 1.00 0.00 H new ATOM 0 HA ALA A 85 -12.637 7.430 -0.822 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -14.619 8.866 -0.473 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -13.781 8.508 1.055 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -13.581 10.098 0.283 1.00 0.00 H new ATOM 1404 N THR A 86 -11.496 10.074 -2.236 1.00 0.00 N ATOM 1405 CA THR A 86 -11.332 10.761 -3.511 1.00 0.00 C ATOM 1406 C THR A 86 -10.161 10.174 -4.294 1.00 0.00 C ATOM 1407 O THR A 86 -10.175 10.143 -5.524 1.00 0.00 O ATOM 1408 CB THR A 86 -11.110 12.258 -3.283 1.00 0.00 C ATOM 1409 OG1 THR A 86 -11.917 12.728 -2.218 1.00 0.00 O ATOM 1410 CG2 THR A 86 -11.422 13.100 -4.501 1.00 0.00 C ATOM 0 H THR A 86 -10.830 10.355 -1.516 1.00 0.00 H new ATOM 0 HA THR A 86 -12.243 10.622 -4.093 1.00 0.00 H new ATOM 0 HB THR A 86 -10.050 12.361 -3.051 1.00 0.00 H new ATOM 0 HG1 THR A 86 -11.760 13.686 -2.087 1.00 0.00 H new ATOM 0 HG21 THR A 86 -11.244 14.151 -4.272 1.00 0.00 H new ATOM 0 HG22 THR A 86 -10.781 12.795 -5.328 1.00 0.00 H new ATOM 0 HG23 THR A 86 -12.466 12.962 -4.781 1.00 0.00 H new ATOM 1418 N SER A 87 -9.150 9.707 -3.568 1.00 0.00 N ATOM 1419 CA SER A 87 -7.970 9.114 -4.188 1.00 0.00 C ATOM 1420 C SER A 87 -7.231 8.222 -3.196 1.00 0.00 C ATOM 1421 O SER A 87 -6.609 8.710 -2.251 1.00 0.00 O ATOM 1422 CB SER A 87 -7.035 10.206 -4.708 1.00 0.00 C ATOM 1423 OG SER A 87 -7.766 11.321 -5.186 1.00 0.00 O ATOM 0 H SER A 87 -9.124 9.728 -2.549 1.00 0.00 H new ATOM 0 HA SER A 87 -8.298 8.502 -5.028 1.00 0.00 H new ATOM 0 HB2 SER A 87 -6.363 10.523 -3.911 1.00 0.00 H new ATOM 0 HB3 SER A 87 -6.413 9.805 -5.508 1.00 0.00 H new ATOM 0 HG SER A 87 -7.144 12.005 -5.511 1.00 0.00 H new ATOM 1429 N VAL A 88 -7.303 6.913 -3.414 1.00 0.00 N ATOM 1430 CA VAL A 88 -6.642 5.954 -2.538 1.00 0.00 C ATOM 1431 C VAL A 88 -5.582 5.157 -3.290 1.00 0.00 C ATOM 1432 O VAL A 88 -5.852 4.584 -4.344 1.00 0.00 O ATOM 1433 CB VAL A 88 -7.654 4.974 -1.912 1.00 0.00 C ATOM 1434 CG1 VAL A 88 -6.971 4.070 -0.897 1.00 0.00 C ATOM 1435 CG2 VAL A 88 -8.807 5.733 -1.271 1.00 0.00 C ATOM 0 H VAL A 88 -7.813 6.492 -4.191 1.00 0.00 H new ATOM 0 HA VAL A 88 -6.164 6.530 -1.746 1.00 0.00 H new ATOM 0 HB VAL A 88 -8.059 4.346 -2.706 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -7.703 3.387 -0.468 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -6.186 3.497 -1.390 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -6.534 4.678 -0.105 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -9.511 5.025 -0.835 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -8.422 6.389 -0.491 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -9.315 6.330 -2.028 1.00 0.00 H new ATOM 1445 N THR A 89 -4.375 5.122 -2.734 1.00 0.00 N ATOM 1446 CA THR A 89 -3.275 4.389 -3.347 1.00 0.00 C ATOM 1447 C THR A 89 -3.227 2.958 -2.824 1.00 0.00 C ATOM 1448 O THR A 89 -3.072 2.731 -1.624 1.00 0.00 O ATOM 1449 CB THR A 89 -1.947 5.094 -3.067 1.00 0.00 C ATOM 1450 OG1 THR A 89 -1.969 5.719 -1.796 1.00 0.00 O ATOM 1451 CG2 THR A 89 -1.603 6.151 -4.094 1.00 0.00 C ATOM 0 H THR A 89 -4.135 5.592 -1.861 1.00 0.00 H new ATOM 0 HA THR A 89 -3.440 4.360 -4.424 1.00 0.00 H new ATOM 0 HB THR A 89 -1.190 4.311 -3.108 1.00 0.00 H new ATOM 0 HG1 THR A 89 -1.110 6.163 -1.635 1.00 0.00 H new ATOM 0 HG21 THR A 89 -0.650 6.612 -3.836 1.00 0.00 H new ATOM 0 HG22 THR A 89 -1.529 5.691 -5.079 1.00 0.00 H new ATOM 0 HG23 THR A 89 -2.383 6.913 -4.107 1.00 0.00 H new ATOM 1459 N LEU A 90 -3.370 1.998 -3.729 1.00 0.00 N ATOM 1460 CA LEU A 90 -3.352 0.589 -3.354 1.00 0.00 C ATOM 1461 C LEU A 90 -1.983 -0.034 -3.606 1.00 0.00 C ATOM 1462 O LEU A 90 -1.301 0.305 -4.576 1.00 0.00 O ATOM 1463 CB LEU A 90 -4.422 -0.171 -4.141 1.00 0.00 C ATOM 1464 CG LEU A 90 -5.719 -0.441 -3.375 1.00 0.00 C ATOM 1465 CD1 LEU A 90 -6.928 -0.159 -4.255 1.00 0.00 C ATOM 1466 CD2 LEU A 90 -5.750 -1.876 -2.869 1.00 0.00 C ATOM 0 H LEU A 90 -3.500 2.168 -4.726 1.00 0.00 H new ATOM 0 HA LEU A 90 -3.564 0.519 -2.287 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -4.661 0.396 -5.041 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -4.004 -1.124 -4.466 1.00 0.00 H new ATOM 0 HG LEU A 90 -5.757 0.228 -2.515 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -7.841 -0.357 -3.693 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -6.914 0.885 -4.569 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -6.896 -0.803 -5.134 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -6.679 -2.051 -2.327 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -5.689 -2.561 -3.714 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -4.904 -2.045 -2.203 1.00 0.00 H new ATOM 1478 N LEU A 91 -1.593 -0.952 -2.724 1.00 0.00 N ATOM 1479 CA LEU A 91 -0.309 -1.636 -2.840 1.00 0.00 C ATOM 1480 C LEU A 91 -0.446 -3.110 -2.462 1.00 0.00 C ATOM 1481 O LEU A 91 -1.368 -3.488 -1.740 1.00 0.00 O ATOM 1482 CB LEU A 91 0.722 -0.960 -1.941 1.00 0.00 C ATOM 1483 CG LEU A 91 1.670 0.008 -2.652 1.00 0.00 C ATOM 1484 CD1 LEU A 91 0.922 1.254 -3.101 1.00 0.00 C ATOM 1485 CD2 LEU A 91 2.833 0.376 -1.743 1.00 0.00 C ATOM 0 H LEU A 91 -2.150 -1.239 -1.919 1.00 0.00 H new ATOM 0 HA LEU A 91 0.023 -1.576 -3.876 1.00 0.00 H new ATOM 0 HB2 LEU A 91 0.196 -0.417 -1.156 1.00 0.00 H new ATOM 0 HB3 LEU A 91 1.316 -1.732 -1.452 1.00 0.00 H new ATOM 0 HG LEU A 91 2.070 -0.486 -3.537 1.00 0.00 H new ATOM 0 HD11 LEU A 91 1.612 1.931 -3.605 1.00 0.00 H new ATOM 0 HD12 LEU A 91 0.124 0.972 -3.788 1.00 0.00 H new ATOM 0 HD13 LEU A 91 0.493 1.754 -2.232 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.498 1.065 -2.264 1.00 0.00 H new ATOM 0 HD22 LEU A 91 2.452 0.852 -0.840 1.00 0.00 H new ATOM 0 HD23 LEU A 91 3.383 -0.525 -1.473 1.00 0.00 H new ATOM 1497 N LYS A 92 0.470 -3.942 -2.953 1.00 0.00 N ATOM 1498 CA LYS A 92 0.432 -5.372 -2.658 1.00 0.00 C ATOM 1499 C LYS A 92 0.902 -5.646 -1.231 1.00 0.00 C ATOM 1500 O LYS A 92 2.028 -5.309 -0.857 1.00 0.00 O ATOM 1501 CB LYS A 92 1.306 -6.137 -3.655 1.00 0.00 C ATOM 1502 CG LYS A 92 0.750 -6.146 -5.069 1.00 0.00 C ATOM 1503 CD LYS A 92 -0.372 -7.162 -5.224 1.00 0.00 C ATOM 1504 CE LYS A 92 -0.103 -8.120 -6.373 1.00 0.00 C ATOM 1505 NZ LYS A 92 -0.585 -9.497 -6.075 1.00 0.00 N ATOM 0 H LYS A 92 1.243 -3.653 -3.553 1.00 0.00 H new ATOM 0 HA LYS A 92 -0.599 -5.714 -2.750 1.00 0.00 H new ATOM 0 HB2 LYS A 92 2.302 -5.693 -3.668 1.00 0.00 H new ATOM 0 HB3 LYS A 92 1.420 -7.165 -3.312 1.00 0.00 H new ATOM 0 HG2 LYS A 92 0.379 -5.152 -5.321 1.00 0.00 H new ATOM 0 HG3 LYS A 92 1.549 -6.376 -5.773 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -0.484 -7.726 -4.298 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -1.314 -6.641 -5.396 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -0.593 -7.752 -7.274 1.00 0.00 H new ATOM 0 HE3 LYS A 92 0.967 -8.147 -6.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -0.382 -10.118 -6.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -0.100 -9.859 -5.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -1.610 -9.476 -5.903 1.00 0.00 H new ATOM 1519 N ALA A 93 0.032 -6.269 -0.438 1.00 0.00 N ATOM 1520 CA ALA A 93 0.346 -6.590 0.952 1.00 0.00 C ATOM 1521 C ALA A 93 1.696 -7.285 1.079 1.00 0.00 C ATOM 1522 O ALA A 93 2.552 -6.863 1.856 1.00 0.00 O ATOM 1523 CB ALA A 93 -0.752 -7.458 1.549 1.00 0.00 C ATOM 0 H ALA A 93 -0.898 -6.562 -0.736 1.00 0.00 H new ATOM 0 HA ALA A 93 0.405 -5.653 1.505 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -0.508 -7.692 2.585 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -1.700 -6.922 1.511 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -0.835 -8.383 0.979 1.00 0.00 H new ATOM 1529 N SER A 94 1.877 -8.356 0.316 1.00 0.00 N ATOM 1530 CA SER A 94 3.120 -9.115 0.347 1.00 0.00 C ATOM 1531 C SER A 94 4.324 -8.222 0.063 1.00 0.00 C ATOM 1532 O SER A 94 5.410 -8.439 0.604 1.00 0.00 O ATOM 1533 CB SER A 94 3.067 -10.256 -0.672 1.00 0.00 C ATOM 1534 OG SER A 94 3.798 -11.381 -0.217 1.00 0.00 O ATOM 0 H SER A 94 1.178 -8.718 -0.332 1.00 0.00 H new ATOM 0 HA SER A 94 3.233 -9.529 1.349 1.00 0.00 H new ATOM 0 HB2 SER A 94 2.030 -10.540 -0.851 1.00 0.00 H new ATOM 0 HB3 SER A 94 3.473 -9.916 -1.625 1.00 0.00 H new ATOM 0 HG SER A 94 3.747 -12.096 -0.885 1.00 0.00 H new ATOM 1540 N GLU A 95 4.134 -7.218 -0.789 1.00 0.00 N ATOM 1541 CA GLU A 95 5.218 -6.309 -1.136 1.00 0.00 C ATOM 1542 C GLU A 95 5.612 -5.450 0.056 1.00 0.00 C ATOM 1543 O GLU A 95 6.791 -5.344 0.394 1.00 0.00 O ATOM 1544 CB GLU A 95 4.817 -5.428 -2.315 1.00 0.00 C ATOM 1545 CG GLU A 95 4.853 -6.155 -3.648 1.00 0.00 C ATOM 1546 CD GLU A 95 4.435 -5.270 -4.800 1.00 0.00 C ATOM 1547 OE1 GLU A 95 4.790 -5.585 -5.954 1.00 0.00 O ATOM 1548 OE2 GLU A 95 3.756 -4.252 -4.548 1.00 0.00 O ATOM 0 H GLU A 95 3.246 -7.016 -1.248 1.00 0.00 H new ATOM 0 HA GLU A 95 6.082 -6.908 -1.424 1.00 0.00 H new ATOM 0 HB2 GLU A 95 3.811 -5.043 -2.146 1.00 0.00 H new ATOM 0 HB3 GLU A 95 5.485 -4.568 -2.360 1.00 0.00 H new ATOM 0 HG2 GLU A 95 5.861 -6.528 -3.828 1.00 0.00 H new ATOM 0 HG3 GLU A 95 4.195 -7.023 -3.603 1.00 0.00 H new ATOM 1555 N VAL A 96 4.621 -4.845 0.699 1.00 0.00 N ATOM 1556 CA VAL A 96 4.877 -4.007 1.859 1.00 0.00 C ATOM 1557 C VAL A 96 5.520 -4.824 2.969 1.00 0.00 C ATOM 1558 O VAL A 96 6.545 -4.437 3.529 1.00 0.00 O ATOM 1559 CB VAL A 96 3.583 -3.360 2.390 1.00 0.00 C ATOM 1560 CG1 VAL A 96 3.902 -2.332 3.465 1.00 0.00 C ATOM 1561 CG2 VAL A 96 2.798 -2.727 1.252 1.00 0.00 C ATOM 0 H VAL A 96 3.638 -4.920 0.437 1.00 0.00 H new ATOM 0 HA VAL A 96 5.555 -3.214 1.543 1.00 0.00 H new ATOM 0 HB VAL A 96 2.965 -4.139 2.838 1.00 0.00 H new ATOM 0 HG11 VAL A 96 2.976 -1.886 3.828 1.00 0.00 H new ATOM 0 HG12 VAL A 96 4.419 -2.819 4.292 1.00 0.00 H new ATOM 0 HG13 VAL A 96 4.540 -1.554 3.046 1.00 0.00 H new ATOM 0 HG21 VAL A 96 1.887 -2.275 1.645 1.00 0.00 H new ATOM 0 HG22 VAL A 96 3.406 -1.960 0.773 1.00 0.00 H new ATOM 0 HG23 VAL A 96 2.537 -3.492 0.521 1.00 0.00 H new ATOM 1571 N GLU A 97 4.913 -5.962 3.273 1.00 0.00 N ATOM 1572 CA GLU A 97 5.422 -6.851 4.310 1.00 0.00 C ATOM 1573 C GLU A 97 6.877 -7.221 4.045 1.00 0.00 C ATOM 1574 O GLU A 97 7.683 -7.306 4.971 1.00 0.00 O ATOM 1575 CB GLU A 97 4.567 -8.117 4.392 1.00 0.00 C ATOM 1576 CG GLU A 97 3.197 -7.889 5.008 1.00 0.00 C ATOM 1577 CD GLU A 97 2.651 -9.127 5.690 1.00 0.00 C ATOM 1578 OE1 GLU A 97 3.273 -9.587 6.672 1.00 0.00 O ATOM 1579 OE2 GLU A 97 1.603 -9.638 5.244 1.00 0.00 O ATOM 0 H GLU A 97 4.064 -6.293 2.815 1.00 0.00 H new ATOM 0 HA GLU A 97 5.369 -6.324 5.263 1.00 0.00 H new ATOM 0 HB2 GLU A 97 4.441 -8.526 3.389 1.00 0.00 H new ATOM 0 HB3 GLU A 97 5.099 -8.867 4.978 1.00 0.00 H new ATOM 0 HG2 GLU A 97 3.259 -7.077 5.733 1.00 0.00 H new ATOM 0 HG3 GLU A 97 2.502 -7.570 4.231 1.00 0.00 H new ATOM 1586 N GLU A 98 7.210 -7.444 2.776 1.00 0.00 N ATOM 1587 CA GLU A 98 8.573 -7.806 2.403 1.00 0.00 C ATOM 1588 C GLU A 98 9.545 -6.672 2.720 1.00 0.00 C ATOM 1589 O GLU A 98 10.589 -6.881 3.350 1.00 0.00 O ATOM 1590 CB GLU A 98 8.635 -8.121 0.907 1.00 0.00 C ATOM 1591 CG GLU A 98 8.298 -9.556 0.552 1.00 0.00 C ATOM 1592 CD GLU A 98 9.073 -10.565 1.378 1.00 0.00 C ATOM 1593 OE1 GLU A 98 10.190 -10.940 0.961 1.00 0.00 O ATOM 1594 OE2 GLU A 98 8.564 -10.980 2.439 1.00 0.00 O ATOM 0 H GLU A 98 6.559 -7.381 1.994 1.00 0.00 H new ATOM 0 HA GLU A 98 8.861 -8.685 2.979 1.00 0.00 H new ATOM 0 HB2 GLU A 98 7.948 -7.459 0.380 1.00 0.00 H new ATOM 0 HB3 GLU A 98 9.637 -7.896 0.542 1.00 0.00 H new ATOM 0 HG2 GLU A 98 7.230 -9.720 0.696 1.00 0.00 H new ATOM 0 HG3 GLU A 98 8.506 -9.722 -0.505 1.00 0.00 H new ATOM 1601 N ILE A 99 9.192 -5.462 2.301 1.00 0.00 N ATOM 1602 CA ILE A 99 10.037 -4.307 2.556 1.00 0.00 C ATOM 1603 C ILE A 99 10.156 -4.074 4.054 1.00 0.00 C ATOM 1604 O ILE A 99 11.232 -3.759 4.562 1.00 0.00 O ATOM 1605 CB ILE A 99 9.515 -3.029 1.861 1.00 0.00 C ATOM 1606 CG1 ILE A 99 9.063 -3.334 0.430 1.00 0.00 C ATOM 1607 CG2 ILE A 99 10.603 -1.965 1.845 1.00 0.00 C ATOM 1608 CD1 ILE A 99 7.867 -2.521 -0.013 1.00 0.00 C ATOM 0 H ILE A 99 8.334 -5.259 1.788 1.00 0.00 H new ATOM 0 HA ILE A 99 11.019 -4.524 2.136 1.00 0.00 H new ATOM 0 HB ILE A 99 8.657 -2.659 2.422 1.00 0.00 H new ATOM 0 HG12 ILE A 99 9.892 -3.146 -0.252 1.00 0.00 H new ATOM 0 HG13 ILE A 99 8.820 -4.394 0.353 1.00 0.00 H new ATOM 0 HG21 ILE A 99 10.227 -1.068 1.354 1.00 0.00 H new ATOM 0 HG22 ILE A 99 10.892 -1.724 2.868 1.00 0.00 H new ATOM 0 HG23 ILE A 99 11.471 -2.340 1.302 1.00 0.00 H new ATOM 0 HD11 ILE A 99 7.603 -2.790 -1.036 1.00 0.00 H new ATOM 0 HD12 ILE A 99 7.023 -2.727 0.646 1.00 0.00 H new ATOM 0 HD13 ILE A 99 8.112 -1.460 0.032 1.00 0.00 H new ATOM 1620 N LEU A 100 9.046 -4.263 4.761 1.00 0.00 N ATOM 1621 CA LEU A 100 9.033 -4.105 6.208 1.00 0.00 C ATOM 1622 C LEU A 100 9.872 -5.202 6.855 1.00 0.00 C ATOM 1623 O LEU A 100 10.513 -4.988 7.884 1.00 0.00 O ATOM 1624 CB LEU A 100 7.600 -4.160 6.745 1.00 0.00 C ATOM 1625 CG LEU A 100 6.679 -3.034 6.270 1.00 0.00 C ATOM 1626 CD1 LEU A 100 5.379 -3.049 7.058 1.00 0.00 C ATOM 1627 CD2 LEU A 100 7.367 -1.683 6.397 1.00 0.00 C ATOM 0 H LEU A 100 8.148 -4.525 4.355 1.00 0.00 H new ATOM 0 HA LEU A 100 9.457 -3.132 6.455 1.00 0.00 H new ATOM 0 HB2 LEU A 100 7.158 -5.114 6.457 1.00 0.00 H new ATOM 0 HB3 LEU A 100 7.637 -4.142 7.834 1.00 0.00 H new ATOM 0 HG LEU A 100 6.449 -3.198 5.217 1.00 0.00 H new ATOM 0 HD11 LEU A 100 4.733 -2.243 6.710 1.00 0.00 H new ATOM 0 HD12 LEU A 100 4.876 -4.005 6.912 1.00 0.00 H new ATOM 0 HD13 LEU A 100 5.594 -2.910 8.117 1.00 0.00 H new ATOM 0 HD21 LEU A 100 6.693 -0.898 6.054 1.00 0.00 H new ATOM 0 HD22 LEU A 100 7.630 -1.505 7.440 1.00 0.00 H new ATOM 0 HD23 LEU A 100 8.271 -1.677 5.789 1.00 0.00 H new ATOM 1639 N ASP A 101 9.876 -6.376 6.225 1.00 0.00 N ATOM 1640 CA ASP A 101 10.649 -7.510 6.718 1.00 0.00 C ATOM 1641 C ASP A 101 12.123 -7.339 6.360 1.00 0.00 C ATOM 1642 O ASP A 101 12.991 -8.029 6.894 1.00 0.00 O ATOM 1643 CB ASP A 101 10.115 -8.817 6.130 1.00 0.00 C ATOM 1644 CG ASP A 101 9.001 -9.415 6.967 1.00 0.00 C ATOM 1645 OD1 ASP A 101 8.285 -8.644 7.639 1.00 0.00 O ATOM 1646 OD2 ASP A 101 8.845 -10.654 6.950 1.00 0.00 O ATOM 0 H ASP A 101 9.351 -6.565 5.371 1.00 0.00 H new ATOM 0 HA ASP A 101 10.551 -7.550 7.803 1.00 0.00 H new ATOM 0 HB2 ASP A 101 9.749 -8.635 5.120 1.00 0.00 H new ATOM 0 HB3 ASP A 101 10.931 -9.536 6.049 1.00 0.00 H new ATOM 1651 N GLY A 102 12.392 -6.410 5.446 1.00 0.00 N ATOM 1652 CA GLY A 102 13.752 -6.148 5.016 1.00 0.00 C ATOM 1653 C GLY A 102 14.071 -6.778 3.678 1.00 0.00 C ATOM 1654 O GLY A 102 15.196 -6.682 3.190 1.00 0.00 O ATOM 0 H GLY A 102 11.685 -5.831 4.993 1.00 0.00 H new ATOM 0 HA2 GLY A 102 13.908 -5.071 4.953 1.00 0.00 H new ATOM 0 HA3 GLY A 102 14.446 -6.527 5.766 1.00 0.00 H new ATOM 1658 N ASN A 103 13.066 -7.391 3.064 1.00 0.00 N ATOM 1659 CA ASN A 103 13.231 -7.997 1.754 1.00 0.00 C ATOM 1660 C ASN A 103 12.589 -7.099 0.705 1.00 0.00 C ATOM 1661 O ASN A 103 11.372 -6.941 0.684 1.00 0.00 O ATOM 1662 CB ASN A 103 12.596 -9.389 1.720 1.00 0.00 C ATOM 1663 CG ASN A 103 13.036 -10.196 0.514 1.00 0.00 C ATOM 1664 OD1 ASN A 103 14.112 -10.791 0.510 1.00 0.00 O ATOM 1665 ND2 ASN A 103 12.201 -10.217 -0.518 1.00 0.00 N ATOM 0 H ASN A 103 12.128 -7.480 3.455 1.00 0.00 H new ATOM 0 HA ASN A 103 14.294 -8.106 1.541 1.00 0.00 H new ATOM 0 HB2 ASN A 103 12.860 -9.928 2.630 1.00 0.00 H new ATOM 0 HB3 ASN A 103 11.511 -9.290 1.711 1.00 0.00 H new ATOM 0 HD21 ASN A 103 12.442 -10.742 -1.359 1.00 0.00 H new ATOM 0 HD22 ASN A 103 11.318 -9.708 -0.470 1.00 0.00 H new ATOM 1672 N ASP A 104 13.401 -6.491 -0.147 1.00 0.00 N ATOM 1673 CA ASP A 104 12.862 -5.595 -1.166 1.00 0.00 C ATOM 1674 C ASP A 104 13.907 -5.202 -2.205 1.00 0.00 C ATOM 1675 O ASP A 104 13.743 -4.204 -2.911 1.00 0.00 O ATOM 1676 CB ASP A 104 12.309 -4.340 -0.495 1.00 0.00 C ATOM 1677 CG ASP A 104 13.297 -3.726 0.479 1.00 0.00 C ATOM 1678 OD1 ASP A 104 12.896 -3.424 1.622 1.00 0.00 O ATOM 1679 OD2 ASP A 104 14.474 -3.554 0.099 1.00 0.00 O ATOM 0 H ASP A 104 14.416 -6.596 -0.157 1.00 0.00 H new ATOM 0 HA ASP A 104 12.069 -6.129 -1.689 1.00 0.00 H new ATOM 0 HB2 ASP A 104 12.051 -3.606 -1.258 1.00 0.00 H new ATOM 0 HB3 ASP A 104 11.388 -4.588 0.033 1.00 0.00 H new ATOM 1684 N GLU A 105 14.971 -5.987 -2.300 1.00 0.00 N ATOM 1685 CA GLU A 105 16.046 -5.720 -3.251 1.00 0.00 C ATOM 1686 C GLU A 105 15.501 -5.522 -4.661 1.00 0.00 C ATOM 1687 O GLU A 105 15.900 -4.597 -5.370 1.00 0.00 O ATOM 1688 CB GLU A 105 17.055 -6.869 -3.244 1.00 0.00 C ATOM 1689 CG GLU A 105 17.677 -7.124 -1.881 1.00 0.00 C ATOM 1690 CD GLU A 105 18.657 -8.280 -1.894 1.00 0.00 C ATOM 1691 OE1 GLU A 105 19.739 -8.136 -2.500 1.00 0.00 O ATOM 1692 OE2 GLU A 105 18.342 -9.331 -1.296 1.00 0.00 O ATOM 0 H GLU A 105 15.115 -6.819 -1.728 1.00 0.00 H new ATOM 0 HA GLU A 105 16.543 -4.800 -2.943 1.00 0.00 H new ATOM 0 HB2 GLU A 105 16.560 -7.779 -3.584 1.00 0.00 H new ATOM 0 HB3 GLU A 105 17.847 -6.650 -3.960 1.00 0.00 H new ATOM 0 HG2 GLU A 105 18.189 -6.222 -1.545 1.00 0.00 H new ATOM 0 HG3 GLU A 105 16.887 -7.330 -1.158 1.00 0.00 H new ATOM 1699 N LYS A 106 14.590 -6.398 -5.059 1.00 0.00 N ATOM 1700 CA LYS A 106 13.988 -6.331 -6.385 1.00 0.00 C ATOM 1701 C LYS A 106 12.970 -5.198 -6.484 1.00 0.00 C ATOM 1702 O LYS A 106 12.611 -4.773 -7.582 1.00 0.00 O ATOM 1703 CB LYS A 106 13.316 -7.663 -6.728 1.00 0.00 C ATOM 1704 CG LYS A 106 12.205 -8.049 -5.766 1.00 0.00 C ATOM 1705 CD LYS A 106 11.425 -9.256 -6.267 1.00 0.00 C ATOM 1706 CE LYS A 106 11.369 -10.359 -5.221 1.00 0.00 C ATOM 1707 NZ LYS A 106 10.689 -9.909 -3.975 1.00 0.00 N ATOM 0 H LYS A 106 14.250 -7.167 -4.481 1.00 0.00 H new ATOM 0 HA LYS A 106 14.786 -6.131 -7.100 1.00 0.00 H new ATOM 0 HB2 LYS A 106 12.908 -7.605 -7.737 1.00 0.00 H new ATOM 0 HB3 LYS A 106 14.070 -8.450 -6.734 1.00 0.00 H new ATOM 0 HG2 LYS A 106 12.631 -8.271 -4.787 1.00 0.00 H new ATOM 0 HG3 LYS A 106 11.527 -7.206 -5.635 1.00 0.00 H new ATOM 0 HD2 LYS A 106 10.412 -8.952 -6.531 1.00 0.00 H new ATOM 0 HD3 LYS A 106 11.889 -9.639 -7.176 1.00 0.00 H new ATOM 0 HE2 LYS A 106 10.843 -11.221 -5.631 1.00 0.00 H new ATOM 0 HE3 LYS A 106 12.381 -10.686 -4.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 10.047 -10.656 -3.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 11.401 -9.712 -3.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 10.144 -9.045 -4.170 1.00 0.00 H new ATOM 1721 N TYR A 107 12.489 -4.724 -5.337 1.00 0.00 N ATOM 1722 CA TYR A 107 11.499 -3.661 -5.313 1.00 0.00 C ATOM 1723 C TYR A 107 12.117 -2.294 -5.607 1.00 0.00 C ATOM 1724 O TYR A 107 11.576 -1.531 -6.408 1.00 0.00 O ATOM 1725 CB TYR A 107 10.790 -3.647 -3.962 1.00 0.00 C ATOM 1726 CG TYR A 107 9.956 -4.882 -3.698 1.00 0.00 C ATOM 1727 CD1 TYR A 107 9.910 -5.449 -2.434 1.00 0.00 C ATOM 1728 CD2 TYR A 107 9.213 -5.476 -4.710 1.00 0.00 C ATOM 1729 CE1 TYR A 107 9.151 -6.572 -2.181 1.00 0.00 C ATOM 1730 CE2 TYR A 107 8.449 -6.602 -4.466 1.00 0.00 C ATOM 1731 CZ TYR A 107 8.421 -7.147 -3.200 1.00 0.00 C ATOM 1732 OH TYR A 107 7.662 -8.269 -2.953 1.00 0.00 O ATOM 0 H TYR A 107 12.771 -5.061 -4.416 1.00 0.00 H new ATOM 0 HA TYR A 107 10.774 -3.861 -6.102 1.00 0.00 H new ATOM 0 HB2 TYR A 107 11.535 -3.547 -3.172 1.00 0.00 H new ATOM 0 HB3 TYR A 107 10.148 -2.768 -3.908 1.00 0.00 H new ATOM 0 HD1 TYR A 107 10.479 -5.003 -1.632 1.00 0.00 H new ATOM 0 HD2 TYR A 107 9.232 -5.052 -5.703 1.00 0.00 H new ATOM 0 HE1 TYR A 107 9.128 -6.999 -1.189 1.00 0.00 H new ATOM 0 HE2 TYR A 107 7.877 -7.053 -5.263 1.00 0.00 H new ATOM 0 HH TYR A 107 7.210 -8.546 -3.777 1.00 0.00 H new ATOM 1742 N LYS A 108 13.246 -1.977 -4.972 1.00 0.00 N ATOM 1743 CA LYS A 108 13.891 -0.682 -5.213 1.00 0.00 C ATOM 1744 C LYS A 108 14.812 -0.740 -6.431 1.00 0.00 C ATOM 1745 O LYS A 108 15.304 0.290 -6.892 1.00 0.00 O ATOM 1746 CB LYS A 108 14.687 -0.181 -4.000 1.00 0.00 C ATOM 1747 CG LYS A 108 14.237 -0.734 -2.668 1.00 0.00 C ATOM 1748 CD LYS A 108 15.398 -1.395 -1.982 1.00 0.00 C ATOM 1749 CE LYS A 108 15.886 -2.553 -2.811 1.00 0.00 C ATOM 1750 NZ LYS A 108 17.369 -2.569 -2.941 1.00 0.00 N ATOM 0 H LYS A 108 13.724 -2.580 -4.303 1.00 0.00 H new ATOM 0 HA LYS A 108 13.082 0.024 -5.400 1.00 0.00 H new ATOM 0 HB2 LYS A 108 15.738 -0.433 -4.145 1.00 0.00 H new ATOM 0 HB3 LYS A 108 14.622 0.907 -3.966 1.00 0.00 H new ATOM 0 HG2 LYS A 108 13.841 0.068 -2.045 1.00 0.00 H new ATOM 0 HG3 LYS A 108 13.430 -1.452 -2.814 1.00 0.00 H new ATOM 0 HD2 LYS A 108 16.204 -0.676 -1.835 1.00 0.00 H new ATOM 0 HD3 LYS A 108 15.098 -1.744 -0.994 1.00 0.00 H new ATOM 0 HE2 LYS A 108 15.553 -3.487 -2.358 1.00 0.00 H new ATOM 0 HE3 LYS A 108 15.437 -2.502 -3.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 17.646 -3.251 -3.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 17.705 -1.621 -3.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 17.794 -2.847 -2.033 1.00 0.00 H new ATOM 1764 N ALA A 109 15.044 -1.944 -6.949 1.00 0.00 N ATOM 1765 CA ALA A 109 15.908 -2.118 -8.111 1.00 0.00 C ATOM 1766 C ALA A 109 15.102 -2.140 -9.408 1.00 0.00 C ATOM 1767 O ALA A 109 15.579 -2.629 -10.433 1.00 0.00 O ATOM 1768 CB ALA A 109 16.722 -3.395 -7.973 1.00 0.00 C ATOM 0 H ALA A 109 14.647 -2.809 -6.583 1.00 0.00 H new ATOM 0 HA ALA A 109 16.586 -1.266 -8.155 1.00 0.00 H new ATOM 0 HB1 ALA A 109 17.363 -3.514 -8.846 1.00 0.00 H new ATOM 0 HB2 ALA A 109 17.338 -3.339 -7.076 1.00 0.00 H new ATOM 0 HB3 ALA A 109 16.049 -4.249 -7.898 1.00 0.00 H new ATOM 1774 N VAL A 110 13.880 -1.610 -9.359 1.00 0.00 N ATOM 1775 CA VAL A 110 13.004 -1.564 -10.529 1.00 0.00 C ATOM 1776 C VAL A 110 13.034 -2.881 -11.306 1.00 0.00 C ATOM 1777 O VAL A 110 12.980 -2.891 -12.536 1.00 0.00 O ATOM 1778 CB VAL A 110 13.387 -0.404 -11.473 1.00 0.00 C ATOM 1779 CG1 VAL A 110 14.770 -0.621 -12.069 1.00 0.00 C ATOM 1780 CG2 VAL A 110 12.345 -0.244 -12.571 1.00 0.00 C ATOM 0 H VAL A 110 13.473 -1.204 -8.516 1.00 0.00 H new ATOM 0 HA VAL A 110 11.993 -1.399 -10.156 1.00 0.00 H new ATOM 0 HB VAL A 110 13.415 0.516 -10.888 1.00 0.00 H new ATOM 0 HG11 VAL A 110 15.016 0.210 -12.730 1.00 0.00 H new ATOM 0 HG12 VAL A 110 15.507 -0.677 -11.268 1.00 0.00 H new ATOM 0 HG13 VAL A 110 14.780 -1.551 -12.637 1.00 0.00 H new ATOM 0 HG21 VAL A 110 12.631 0.578 -13.227 1.00 0.00 H new ATOM 0 HG22 VAL A 110 12.282 -1.165 -13.150 1.00 0.00 H new ATOM 0 HG23 VAL A 110 11.375 -0.030 -12.123 1.00 0.00 H new ATOM 1790 N SER A 111 13.122 -3.989 -10.578 1.00 0.00 N ATOM 1791 CA SER A 111 13.161 -5.310 -11.197 1.00 0.00 C ATOM 1792 C SER A 111 11.796 -5.689 -11.761 1.00 0.00 C ATOM 1793 O SER A 111 11.041 -6.434 -11.138 1.00 0.00 O ATOM 1794 CB SER A 111 13.615 -6.359 -10.180 1.00 0.00 C ATOM 1795 OG SER A 111 14.334 -7.404 -10.812 1.00 0.00 O ATOM 0 H SER A 111 13.168 -3.999 -9.559 1.00 0.00 H new ATOM 0 HA SER A 111 13.876 -5.277 -12.019 1.00 0.00 H new ATOM 0 HB2 SER A 111 14.242 -5.888 -9.423 1.00 0.00 H new ATOM 0 HB3 SER A 111 12.747 -6.770 -9.665 1.00 0.00 H new ATOM 0 HG SER A 111 14.615 -8.061 -10.141 1.00 0.00 H new ATOM 1801 N ILE A 112 11.486 -5.173 -12.946 1.00 0.00 N ATOM 1802 CA ILE A 112 10.213 -5.459 -13.596 1.00 0.00 C ATOM 1803 C ILE A 112 10.424 -6.058 -14.982 1.00 0.00 C ATOM 1804 O ILE A 112 9.734 -6.997 -15.377 1.00 0.00 O ATOM 1805 CB ILE A 112 9.344 -4.190 -13.717 1.00 0.00 C ATOM 1806 CG1 ILE A 112 7.964 -4.538 -14.281 1.00 0.00 C ATOM 1807 CG2 ILE A 112 10.035 -3.152 -14.590 1.00 0.00 C ATOM 1808 CD1 ILE A 112 6.884 -4.624 -13.225 1.00 0.00 C ATOM 0 H ILE A 112 12.100 -4.554 -13.476 1.00 0.00 H new ATOM 0 HA ILE A 112 9.694 -6.184 -12.969 1.00 0.00 H new ATOM 0 HB ILE A 112 9.211 -3.766 -12.722 1.00 0.00 H new ATOM 0 HG12 ILE A 112 7.681 -3.786 -15.018 1.00 0.00 H new ATOM 0 HG13 ILE A 112 8.025 -5.491 -14.806 1.00 0.00 H new ATOM 0 HG21 ILE A 112 9.408 -2.264 -14.664 1.00 0.00 H new ATOM 0 HG22 ILE A 112 10.994 -2.883 -14.146 1.00 0.00 H new ATOM 0 HG23 ILE A 112 10.199 -3.565 -15.585 1.00 0.00 H new ATOM 0 HD11 ILE A 112 5.933 -4.874 -13.696 1.00 0.00 H new ATOM 0 HD12 ILE A 112 7.144 -5.396 -12.501 1.00 0.00 H new ATOM 0 HD13 ILE A 112 6.795 -3.664 -12.716 1.00 0.00 H new ATOM 1820 N SER A 113 11.385 -5.506 -15.714 1.00 0.00 N ATOM 1821 CA SER A 113 11.691 -5.983 -17.058 1.00 0.00 C ATOM 1822 C SER A 113 13.022 -6.729 -17.081 1.00 0.00 C ATOM 1823 O SER A 113 13.000 -7.975 -17.159 1.00 0.00 O ATOM 1824 CB SER A 113 11.734 -4.810 -18.039 1.00 0.00 C ATOM 1825 OG SER A 113 10.582 -3.994 -17.910 1.00 0.00 O ATOM 1826 OXT SER A 113 14.075 -6.060 -17.021 1.00 0.00 O ATOM 0 H SER A 113 11.965 -4.728 -15.400 1.00 0.00 H new ATOM 0 HA SER A 113 10.903 -6.673 -17.360 1.00 0.00 H new ATOM 0 HB2 SER A 113 12.628 -4.213 -17.858 1.00 0.00 H new ATOM 0 HB3 SER A 113 11.804 -5.187 -19.059 1.00 0.00 H new ATOM 0 HG SER A 113 10.635 -3.251 -18.547 1.00 0.00 H new TER 1832 SER A 113