USER MOD reduce.3.24.130724 H: found=0, std=0, add=833, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 833 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 28 ASN : amide:sc= -0.0519 X(o=-1,f=-1) USER MOD Set 1.2: A 48 MET CE :methyl -149:sc= -0.747 (180deg=-1.22) USER MOD Set 1.3: A 58 ASN : amide:sc= -0.202 K(o=-1,f=-7!) USER MOD Set 2.1: A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 55 SER OG : rot -170:sc= 0 USER MOD Set 3.1: A 16 SER OG : rot 180:sc= 0.00784 USER MOD Set 3.2: A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot 94:sc= 0.212 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot 109:sc= 0.0143 USER MOD Single : A 27 GLN : amide:sc= 0 X(o=0,f=-0.045) USER MOD Single : A 30 MET CE :methyl 166:sc=-0.00273 (180deg=-0.38) USER MOD Single : A 32 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 37 MET CE :methyl -166:sc= -0.502 (180deg=-1.37) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ -160:sc= 0.376 (180deg=0.212) USER MOD Single : A 46 LYS NZ :NH3+ 173:sc= 1.27 (180deg=1.12) USER MOD Single : A 53 GLN : amide:sc= -0.0212 X(o=-0.021,f=-0.021) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot -7:sc= 0.518 USER MOD Single : A 60 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0136) USER MOD Single : A 61 SER OG : rot 19:sc= 0.177 USER MOD Single : A 71 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 73 GLN : amide:sc= 1.16 K(o=1.2,f=-0.23) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot -104:sc= 0.174 USER MOD Single : A 77 MET CE :methyl -171:sc= 0 (180deg=-0.116) USER MOD Single : A 78 GLN : amide:sc= -0.661 K(o=-0.66,f=-1.7) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 83 GLN : amide:sc= -0.152 X(o=-0.15,f=-0.35) USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 87 GLN : amide:sc= -0.19 X(o=-0.19,f=-0.21) USER MOD Single : A 88 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00385) USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 GLN : amide:sc=-0.00165 X(o=-0.0016,f=-0.0016) USER MOD Single : A 100 GLN : amide:sc= -0.154 X(o=-0.15,f=-0.15) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 28.045 -1.516 -7.665 1.00 0.00 N ATOM 2 CA GLY A 1 26.572 -1.501 -7.526 1.00 0.00 C ATOM 3 C GLY A 1 26.138 -0.749 -6.278 1.00 0.00 C ATOM 4 O GLY A 1 25.986 -1.346 -5.212 1.00 0.00 O ATOM 0 H1 GLY A 1 28.307 -2.037 -8.526 1.00 0.00 H new ATOM 0 H2 GLY A 1 28.398 -0.540 -7.730 1.00 0.00 H new ATOM 0 H3 GLY A 1 28.467 -1.982 -6.837 1.00 0.00 H new ATOM 0 HA2 GLY A 1 26.127 -1.036 -8.406 1.00 0.00 H new ATOM 0 HA3 GLY A 1 26.199 -2.524 -7.484 1.00 0.00 H new ATOM 10 N SER A 2 25.930 0.566 -6.419 1.00 0.00 N ATOM 11 CA SER A 2 25.439 1.500 -5.385 1.00 0.00 C ATOM 12 C SER A 2 24.382 2.462 -5.962 1.00 0.00 C ATOM 13 O SER A 2 24.203 2.535 -7.182 1.00 0.00 O ATOM 14 CB SER A 2 26.604 2.314 -4.797 1.00 0.00 C ATOM 15 OG SER A 2 27.572 1.482 -4.174 1.00 0.00 O ATOM 0 H SER A 2 26.108 1.038 -7.305 1.00 0.00 H new ATOM 0 HA SER A 2 24.978 0.906 -4.596 1.00 0.00 H new ATOM 0 HB2 SER A 2 27.079 2.892 -5.590 1.00 0.00 H new ATOM 0 HB3 SER A 2 26.217 3.028 -4.070 1.00 0.00 H new ATOM 0 HG SER A 2 28.296 2.036 -3.815 1.00 0.00 H new ATOM 21 N ALA A 3 23.702 3.227 -5.099 1.00 0.00 N ATOM 22 CA ALA A 3 22.674 4.213 -5.462 1.00 0.00 C ATOM 23 C ALA A 3 23.011 5.634 -4.958 1.00 0.00 C ATOM 24 O ALA A 3 23.866 5.818 -4.087 1.00 0.00 O ATOM 25 CB ALA A 3 21.326 3.715 -4.920 1.00 0.00 C ATOM 0 H ALA A 3 23.857 3.175 -4.092 1.00 0.00 H new ATOM 0 HA ALA A 3 22.627 4.301 -6.547 1.00 0.00 H new ATOM 0 HB1 ALA A 3 20.544 4.430 -5.176 1.00 0.00 H new ATOM 0 HB2 ALA A 3 21.091 2.747 -5.362 1.00 0.00 H new ATOM 0 HB3 ALA A 3 21.384 3.614 -3.836 1.00 0.00 H new ATOM 31 N MET A 4 22.322 6.646 -5.498 1.00 0.00 N ATOM 32 CA MET A 4 22.536 8.072 -5.197 1.00 0.00 C ATOM 33 C MET A 4 22.191 8.453 -3.744 1.00 0.00 C ATOM 34 O MET A 4 22.947 9.183 -3.101 1.00 0.00 O ATOM 35 CB MET A 4 21.717 8.909 -6.201 1.00 0.00 C ATOM 36 CG MET A 4 21.847 10.426 -6.009 1.00 0.00 C ATOM 37 SD MET A 4 23.530 11.091 -6.157 1.00 0.00 S ATOM 38 CE MET A 4 23.187 12.834 -5.785 1.00 0.00 C ATOM 0 H MET A 4 21.577 6.494 -6.178 1.00 0.00 H new ATOM 0 HA MET A 4 23.600 8.283 -5.301 1.00 0.00 H new ATOM 0 HB2 MET A 4 22.033 8.654 -7.213 1.00 0.00 H new ATOM 0 HB3 MET A 4 20.666 8.632 -6.116 1.00 0.00 H new ATOM 0 HG2 MET A 4 21.213 10.923 -6.743 1.00 0.00 H new ATOM 0 HG3 MET A 4 21.458 10.685 -5.024 1.00 0.00 H new ATOM 0 HE1 MET A 4 24.114 13.405 -5.829 1.00 0.00 H new ATOM 0 HE2 MET A 4 22.482 13.230 -6.516 1.00 0.00 H new ATOM 0 HE3 MET A 4 22.758 12.915 -4.786 1.00 0.00 H new ATOM 48 N ALA A 5 21.056 7.970 -3.226 1.00 0.00 N ATOM 49 CA ALA A 5 20.470 8.375 -1.941 1.00 0.00 C ATOM 50 C ALA A 5 20.301 7.183 -0.973 1.00 0.00 C ATOM 51 O ALA A 5 19.220 6.923 -0.442 1.00 0.00 O ATOM 52 CB ALA A 5 19.172 9.149 -2.226 1.00 0.00 C ATOM 0 H ALA A 5 20.500 7.262 -3.706 1.00 0.00 H new ATOM 0 HA ALA A 5 21.150 9.042 -1.410 1.00 0.00 H new ATOM 0 HB1 ALA A 5 18.719 9.460 -1.284 1.00 0.00 H new ATOM 0 HB2 ALA A 5 19.398 10.029 -2.828 1.00 0.00 H new ATOM 0 HB3 ALA A 5 18.477 8.507 -2.768 1.00 0.00 H new ATOM 58 N ASP A 6 21.391 6.443 -0.741 1.00 0.00 N ATOM 59 CA ASP A 6 21.432 5.249 0.124 1.00 0.00 C ATOM 60 C ASP A 6 21.087 5.515 1.610 1.00 0.00 C ATOM 61 O ASP A 6 20.684 4.596 2.327 1.00 0.00 O ATOM 62 CB ASP A 6 22.807 4.571 -0.004 1.00 0.00 C ATOM 63 CG ASP A 6 23.933 5.347 0.707 1.00 0.00 C ATOM 64 OD1 ASP A 6 24.359 6.409 0.193 1.00 0.00 O ATOM 65 OD2 ASP A 6 24.398 4.894 1.779 1.00 0.00 O ATOM 0 H ASP A 6 22.296 6.660 -1.159 1.00 0.00 H new ATOM 0 HA ASP A 6 20.643 4.586 -0.232 1.00 0.00 H new ATOM 0 HB2 ASP A 6 22.749 3.565 0.411 1.00 0.00 H new ATOM 0 HB3 ASP A 6 23.057 4.466 -1.060 1.00 0.00 H new ATOM 70 N ILE A 7 21.203 6.768 2.070 1.00 0.00 N ATOM 71 CA ILE A 7 20.843 7.220 3.426 1.00 0.00 C ATOM 72 C ILE A 7 19.322 7.219 3.698 1.00 0.00 C ATOM 73 O ILE A 7 18.902 7.194 4.858 1.00 0.00 O ATOM 74 CB ILE A 7 21.487 8.607 3.689 1.00 0.00 C ATOM 75 CG1 ILE A 7 21.377 9.115 5.146 1.00 0.00 C ATOM 76 CG2 ILE A 7 20.931 9.698 2.753 1.00 0.00 C ATOM 77 CD1 ILE A 7 21.983 8.172 6.193 1.00 0.00 C ATOM 0 H ILE A 7 21.563 7.525 1.489 1.00 0.00 H new ATOM 0 HA ILE A 7 21.244 6.496 4.135 1.00 0.00 H new ATOM 0 HB ILE A 7 22.543 8.430 3.483 1.00 0.00 H new ATOM 0 HG12 ILE A 7 21.871 10.084 5.218 1.00 0.00 H new ATOM 0 HG13 ILE A 7 20.325 9.275 5.384 1.00 0.00 H new ATOM 0 HG21 ILE A 7 21.413 10.650 2.977 1.00 0.00 H new ATOM 0 HG22 ILE A 7 21.131 9.425 1.717 1.00 0.00 H new ATOM 0 HG23 ILE A 7 19.855 9.792 2.903 1.00 0.00 H new ATOM 0 HD11 ILE A 7 21.863 8.605 7.186 1.00 0.00 H new ATOM 0 HD12 ILE A 7 21.474 7.209 6.153 1.00 0.00 H new ATOM 0 HD13 ILE A 7 23.044 8.031 5.985 1.00 0.00 H new ATOM 89 N GLY A 8 18.478 7.215 2.657 1.00 0.00 N ATOM 90 CA GLY A 8 17.019 7.326 2.784 1.00 0.00 C ATOM 91 C GLY A 8 16.579 8.705 3.300 1.00 0.00 C ATOM 92 O GLY A 8 16.974 9.731 2.738 1.00 0.00 O ATOM 0 H GLY A 8 18.794 7.133 1.691 1.00 0.00 H new ATOM 0 HA2 GLY A 8 16.557 7.140 1.814 1.00 0.00 H new ATOM 0 HA3 GLY A 8 16.656 6.554 3.463 1.00 0.00 H new ATOM 96 N SER A 9 15.783 8.729 4.374 1.00 0.00 N ATOM 97 CA SER A 9 15.276 9.943 5.045 1.00 0.00 C ATOM 98 C SER A 9 15.447 9.883 6.571 1.00 0.00 C ATOM 99 O SER A 9 15.683 8.814 7.139 1.00 0.00 O ATOM 100 CB SER A 9 13.790 10.153 4.712 1.00 0.00 C ATOM 101 OG SER A 9 13.587 10.244 3.309 1.00 0.00 O ATOM 0 H SER A 9 15.458 7.872 4.822 1.00 0.00 H new ATOM 0 HA SER A 9 15.867 10.780 4.673 1.00 0.00 H new ATOM 0 HB2 SER A 9 13.204 9.327 5.114 1.00 0.00 H new ATOM 0 HB3 SER A 9 13.431 11.062 5.194 1.00 0.00 H new ATOM 0 HG SER A 9 12.634 10.376 3.124 1.00 0.00 H new ATOM 107 N GLU A 10 15.286 11.024 7.248 1.00 0.00 N ATOM 108 CA GLU A 10 15.343 11.163 8.717 1.00 0.00 C ATOM 109 C GLU A 10 14.154 11.962 9.308 1.00 0.00 C ATOM 110 O GLU A 10 14.265 12.574 10.375 1.00 0.00 O ATOM 111 CB GLU A 10 16.725 11.694 9.152 1.00 0.00 C ATOM 112 CG GLU A 10 17.074 13.106 8.656 1.00 0.00 C ATOM 113 CD GLU A 10 18.408 13.577 9.267 1.00 0.00 C ATOM 114 OE1 GLU A 10 19.487 13.271 8.701 1.00 0.00 O ATOM 115 OE2 GLU A 10 18.396 14.258 10.323 1.00 0.00 O ATOM 0 H GLU A 10 15.106 11.911 6.777 1.00 0.00 H new ATOM 0 HA GLU A 10 15.226 10.168 9.148 1.00 0.00 H new ATOM 0 HB2 GLU A 10 16.771 11.688 10.241 1.00 0.00 H new ATOM 0 HB3 GLU A 10 17.489 11.003 8.796 1.00 0.00 H new ATOM 0 HG2 GLU A 10 17.144 13.109 7.568 1.00 0.00 H new ATOM 0 HG3 GLU A 10 16.278 13.800 8.926 1.00 0.00 H new ATOM 122 N PHE A 11 13.013 11.980 8.605 1.00 0.00 N ATOM 123 CA PHE A 11 11.808 12.750 8.939 1.00 0.00 C ATOM 124 C PHE A 11 10.570 11.848 9.125 1.00 0.00 C ATOM 125 O PHE A 11 9.903 11.472 8.161 1.00 0.00 O ATOM 126 CB PHE A 11 11.603 13.835 7.868 1.00 0.00 C ATOM 127 CG PHE A 11 10.573 14.884 8.237 1.00 0.00 C ATOM 128 CD1 PHE A 11 10.866 15.820 9.249 1.00 0.00 C ATOM 129 CD2 PHE A 11 9.338 14.949 7.562 1.00 0.00 C ATOM 130 CE1 PHE A 11 9.935 16.820 9.579 1.00 0.00 C ATOM 131 CE2 PHE A 11 8.411 15.957 7.886 1.00 0.00 C ATOM 132 CZ PHE A 11 8.711 16.895 8.892 1.00 0.00 C ATOM 0 H PHE A 11 12.900 11.434 7.751 1.00 0.00 H new ATOM 0 HA PHE A 11 11.946 13.235 9.905 1.00 0.00 H new ATOM 0 HB2 PHE A 11 12.556 14.328 7.679 1.00 0.00 H new ATOM 0 HB3 PHE A 11 11.301 13.357 6.936 1.00 0.00 H new ATOM 0 HD1 PHE A 11 11.809 15.769 9.773 1.00 0.00 H new ATOM 0 HD2 PHE A 11 9.103 14.225 6.796 1.00 0.00 H new ATOM 0 HE1 PHE A 11 10.160 17.531 10.360 1.00 0.00 H new ATOM 0 HE2 PHE A 11 7.468 16.011 7.362 1.00 0.00 H new ATOM 0 HZ PHE A 11 8.001 17.672 9.136 1.00 0.00 H new ATOM 142 N GLU A 12 10.253 11.492 10.375 1.00 0.00 N ATOM 143 CA GLU A 12 9.125 10.615 10.745 1.00 0.00 C ATOM 144 C GLU A 12 7.875 11.427 11.160 1.00 0.00 C ATOM 145 O GLU A 12 7.353 11.283 12.271 1.00 0.00 O ATOM 146 CB GLU A 12 9.556 9.608 11.835 1.00 0.00 C ATOM 147 CG GLU A 12 10.578 8.558 11.370 1.00 0.00 C ATOM 148 CD GLU A 12 12.014 9.106 11.230 1.00 0.00 C ATOM 149 OE1 GLU A 12 12.597 9.557 12.246 1.00 0.00 O ATOM 150 OE2 GLU A 12 12.582 9.052 10.113 1.00 0.00 O ATOM 0 H GLU A 12 10.786 11.813 11.183 1.00 0.00 H new ATOM 0 HA GLU A 12 8.838 10.044 9.862 1.00 0.00 H new ATOM 0 HB2 GLU A 12 9.979 10.160 12.674 1.00 0.00 H new ATOM 0 HB3 GLU A 12 8.670 9.093 12.206 1.00 0.00 H new ATOM 0 HG2 GLU A 12 10.583 7.730 12.079 1.00 0.00 H new ATOM 0 HG3 GLU A 12 10.258 8.154 10.410 1.00 0.00 H new ATOM 157 N LYS A 13 7.392 12.300 10.264 1.00 0.00 N ATOM 158 CA LYS A 13 6.165 13.112 10.416 1.00 0.00 C ATOM 159 C LYS A 13 5.366 13.196 9.104 1.00 0.00 C ATOM 160 O LYS A 13 5.892 12.917 8.024 1.00 0.00 O ATOM 161 CB LYS A 13 6.517 14.531 10.912 1.00 0.00 C ATOM 162 CG LYS A 13 7.142 14.576 12.316 1.00 0.00 C ATOM 163 CD LYS A 13 7.324 16.030 12.783 1.00 0.00 C ATOM 164 CE LYS A 13 7.883 16.131 14.210 1.00 0.00 C ATOM 165 NZ LYS A 13 9.307 15.708 14.298 1.00 0.00 N ATOM 0 H LYS A 13 7.862 12.470 9.375 1.00 0.00 H new ATOM 0 HA LYS A 13 5.537 12.616 11.156 1.00 0.00 H new ATOM 0 HB2 LYS A 13 7.209 14.989 10.205 1.00 0.00 H new ATOM 0 HB3 LYS A 13 5.612 15.138 10.911 1.00 0.00 H new ATOM 0 HG2 LYS A 13 6.506 14.039 13.020 1.00 0.00 H new ATOM 0 HG3 LYS A 13 8.106 14.068 12.307 1.00 0.00 H new ATOM 0 HD2 LYS A 13 7.996 16.546 12.097 1.00 0.00 H new ATOM 0 HD3 LYS A 13 6.364 16.545 12.736 1.00 0.00 H new ATOM 0 HE2 LYS A 13 7.791 17.159 14.560 1.00 0.00 H new ATOM 0 HE3 LYS A 13 7.282 15.512 14.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 9.635 15.795 15.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 9.395 14.718 13.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 9.888 16.314 13.684 1.00 0.00 H new ATOM 179 N THR A 14 4.104 13.615 9.196 1.00 0.00 N ATOM 180 CA THR A 14 3.176 13.855 8.070 1.00 0.00 C ATOM 181 C THR A 14 3.106 15.340 7.664 1.00 0.00 C ATOM 182 O THR A 14 3.454 16.214 8.469 1.00 0.00 O ATOM 183 CB THR A 14 1.759 13.376 8.437 1.00 0.00 C ATOM 184 OG1 THR A 14 1.388 13.780 9.741 1.00 0.00 O ATOM 185 CG2 THR A 14 1.672 11.851 8.367 1.00 0.00 C ATOM 0 H THR A 14 3.671 13.808 10.099 1.00 0.00 H new ATOM 0 HA THR A 14 3.565 13.291 7.222 1.00 0.00 H new ATOM 0 HB THR A 14 1.079 13.829 7.716 1.00 0.00 H new ATOM 0 HG1 THR A 14 0.889 14.622 9.693 1.00 0.00 H new ATOM 0 HG21 THR A 14 0.663 11.532 8.630 1.00 0.00 H new ATOM 0 HG22 THR A 14 1.906 11.519 7.355 1.00 0.00 H new ATOM 0 HG23 THR A 14 2.385 11.413 9.066 1.00 0.00 H new ATOM 193 N PRO A 15 2.627 15.663 6.441 1.00 0.00 N ATOM 194 CA PRO A 15 2.440 17.047 5.995 1.00 0.00 C ATOM 195 C PRO A 15 1.262 17.749 6.699 1.00 0.00 C ATOM 196 O PRO A 15 1.398 18.895 7.135 1.00 0.00 O ATOM 197 CB PRO A 15 2.237 16.962 4.478 1.00 0.00 C ATOM 198 CG PRO A 15 1.662 15.563 4.257 1.00 0.00 C ATOM 199 CD PRO A 15 2.329 14.736 5.353 1.00 0.00 C ATOM 0 HA PRO A 15 3.305 17.659 6.252 1.00 0.00 H new ATOM 0 HB2 PRO A 15 1.554 17.734 4.123 1.00 0.00 H new ATOM 0 HB3 PRO A 15 3.177 17.096 3.942 1.00 0.00 H new ATOM 0 HG2 PRO A 15 0.576 15.554 4.350 1.00 0.00 H new ATOM 0 HG3 PRO A 15 1.900 15.182 3.264 1.00 0.00 H new ATOM 0 HD2 PRO A 15 1.670 13.937 5.693 1.00 0.00 H new ATOM 0 HD3 PRO A 15 3.239 14.264 4.984 1.00 0.00 H new ATOM 207 N SER A 16 0.108 17.083 6.818 1.00 0.00 N ATOM 208 CA SER A 16 -1.077 17.570 7.542 1.00 0.00 C ATOM 209 C SER A 16 -0.984 17.332 9.059 1.00 0.00 C ATOM 210 O SER A 16 -0.254 16.449 9.523 1.00 0.00 O ATOM 211 CB SER A 16 -2.342 16.918 6.965 1.00 0.00 C ATOM 212 OG SER A 16 -2.227 15.504 6.875 1.00 0.00 O ATOM 0 H SER A 16 -0.034 16.163 6.402 1.00 0.00 H new ATOM 0 HA SER A 16 -1.127 18.650 7.402 1.00 0.00 H new ATOM 0 HB2 SER A 16 -3.197 17.172 7.592 1.00 0.00 H new ATOM 0 HB3 SER A 16 -2.540 17.328 5.975 1.00 0.00 H new ATOM 0 HG SER A 16 -3.054 15.131 6.505 1.00 0.00 H new ATOM 218 N LEU A 17 -1.736 18.124 9.836 1.00 0.00 N ATOM 219 CA LEU A 17 -1.824 18.037 11.303 1.00 0.00 C ATOM 220 C LEU A 17 -2.693 16.841 11.743 1.00 0.00 C ATOM 221 O LEU A 17 -2.175 15.777 12.088 1.00 0.00 O ATOM 222 CB LEU A 17 -2.368 19.368 11.876 1.00 0.00 C ATOM 223 CG LEU A 17 -1.452 20.597 11.722 1.00 0.00 C ATOM 224 CD1 LEU A 17 -2.184 21.834 12.247 1.00 0.00 C ATOM 225 CD2 LEU A 17 -0.145 20.453 12.501 1.00 0.00 C ATOM 0 H LEU A 17 -2.319 18.867 9.450 1.00 0.00 H new ATOM 0 HA LEU A 17 -0.824 17.869 11.702 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -3.320 19.587 11.391 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -2.576 19.226 12.937 1.00 0.00 H new ATOM 0 HG LEU A 17 -1.210 20.690 10.663 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -1.542 22.709 12.142 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -3.100 21.985 11.675 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -2.432 21.691 13.299 1.00 0.00 H new ATOM 0 HD21 LEU A 17 0.464 21.346 12.359 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -0.365 20.329 13.561 1.00 0.00 H new ATOM 0 HD23 LEU A 17 0.400 19.581 12.139 1.00 0.00 H new ATOM 237 N THR A 18 -4.018 17.023 11.720 1.00 0.00 N ATOM 238 CA THR A 18 -5.043 16.079 12.201 1.00 0.00 C ATOM 239 C THR A 18 -6.320 16.217 11.354 1.00 0.00 C ATOM 240 O THR A 18 -6.558 17.261 10.738 1.00 0.00 O ATOM 241 CB THR A 18 -5.375 16.323 13.697 1.00 0.00 C ATOM 242 OG1 THR A 18 -4.229 16.678 14.451 1.00 0.00 O ATOM 243 CG2 THR A 18 -5.939 15.078 14.391 1.00 0.00 C ATOM 0 H THR A 18 -4.430 17.878 11.346 1.00 0.00 H new ATOM 0 HA THR A 18 -4.646 15.069 12.102 1.00 0.00 H new ATOM 0 HB THR A 18 -6.109 17.129 13.674 1.00 0.00 H new ATOM 0 HG1 THR A 18 -4.485 16.824 15.386 1.00 0.00 H new ATOM 0 HG21 THR A 18 -6.152 15.309 15.435 1.00 0.00 H new ATOM 0 HG22 THR A 18 -6.858 14.768 13.893 1.00 0.00 H new ATOM 0 HG23 THR A 18 -5.209 14.271 14.340 1.00 0.00 H new ATOM 251 N ARG A 19 -7.163 15.181 11.344 1.00 0.00 N ATOM 252 CA ARG A 19 -8.491 15.122 10.695 1.00 0.00 C ATOM 253 C ARG A 19 -9.584 14.733 11.708 1.00 0.00 C ATOM 254 O ARG A 19 -9.296 14.524 12.889 1.00 0.00 O ATOM 255 CB ARG A 19 -8.410 14.149 9.492 1.00 0.00 C ATOM 256 CG ARG A 19 -8.018 14.819 8.162 1.00 0.00 C ATOM 257 CD ARG A 19 -9.147 15.709 7.613 1.00 0.00 C ATOM 258 NE ARG A 19 -8.900 16.117 6.214 1.00 0.00 N ATOM 259 CZ ARG A 19 -9.247 15.478 5.109 1.00 0.00 C ATOM 260 NH1 ARG A 19 -9.822 14.308 5.129 1.00 0.00 N ATOM 261 NH2 ARG A 19 -9.021 16.010 3.941 1.00 0.00 N ATOM 0 H ARG A 19 -6.931 14.306 11.814 1.00 0.00 H new ATOM 0 HA ARG A 19 -8.772 16.106 10.320 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -7.685 13.368 9.720 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -9.377 13.661 9.369 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -7.121 15.420 8.309 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -7.771 14.052 7.428 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -10.093 15.172 7.672 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -9.245 16.597 8.238 1.00 0.00 H new ATOM 0 HE ARG A 19 -8.402 16.998 6.085 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -10.020 13.852 6.020 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -10.074 13.849 4.254 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -8.574 16.924 3.875 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -9.291 15.512 3.093 1.00 0.00 H new ATOM 275 N ARG A 20 -10.836 14.627 11.244 1.00 0.00 N ATOM 276 CA ARG A 20 -11.983 14.069 11.992 1.00 0.00 C ATOM 277 C ARG A 20 -11.683 12.698 12.622 1.00 0.00 C ATOM 278 O ARG A 20 -10.784 11.977 12.174 1.00 0.00 O ATOM 279 CB ARG A 20 -13.224 13.993 11.074 1.00 0.00 C ATOM 280 CG ARG A 20 -13.022 13.085 9.842 1.00 0.00 C ATOM 281 CD ARG A 20 -14.306 12.896 9.026 1.00 0.00 C ATOM 282 NE ARG A 20 -15.258 11.983 9.692 1.00 0.00 N ATOM 283 CZ ARG A 20 -16.361 11.472 9.173 1.00 0.00 C ATOM 284 NH1 ARG A 20 -16.750 11.751 7.959 1.00 0.00 N ATOM 285 NH2 ARG A 20 -17.102 10.658 9.867 1.00 0.00 N ATOM 0 H ARG A 20 -11.093 14.936 10.307 1.00 0.00 H new ATOM 0 HA ARG A 20 -12.185 14.746 12.822 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -14.072 13.625 11.652 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -13.480 14.998 10.737 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -12.251 13.514 9.203 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -12.659 12.111 10.170 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -14.782 13.864 8.870 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -14.055 12.502 8.041 1.00 0.00 H new ATOM 0 HE ARG A 20 -15.041 11.719 10.653 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -16.197 12.382 7.379 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -17.607 11.338 7.591 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -16.833 10.410 10.819 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -17.952 10.268 9.459 1.00 0.00 H new ATOM 299 N ILE A 21 -12.489 12.317 13.616 1.00 0.00 N ATOM 300 CA ILE A 21 -12.443 10.990 14.254 1.00 0.00 C ATOM 301 C ILE A 21 -12.670 9.860 13.236 1.00 0.00 C ATOM 302 O ILE A 21 -13.225 10.073 12.154 1.00 0.00 O ATOM 303 CB ILE A 21 -13.446 10.885 15.432 1.00 0.00 C ATOM 304 CG1 ILE A 21 -14.920 10.846 14.962 1.00 0.00 C ATOM 305 CG2 ILE A 21 -13.196 12.012 16.454 1.00 0.00 C ATOM 306 CD1 ILE A 21 -15.931 10.647 16.097 1.00 0.00 C ATOM 0 H ILE A 21 -13.205 12.928 14.010 1.00 0.00 H new ATOM 0 HA ILE A 21 -11.439 10.871 14.662 1.00 0.00 H new ATOM 0 HB ILE A 21 -13.269 9.930 15.927 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -15.150 11.777 14.443 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -15.039 10.040 14.238 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -13.908 11.924 17.274 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -12.181 11.931 16.844 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -13.321 12.979 15.967 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -16.941 10.631 15.686 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -15.730 9.702 16.602 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -15.843 11.466 16.811 1.00 0.00 H new ATOM 318 N ASP A 22 -12.293 8.639 13.611 1.00 0.00 N ATOM 319 CA ASP A 22 -12.458 7.436 12.793 1.00 0.00 C ATOM 320 C ASP A 22 -12.952 6.272 13.655 1.00 0.00 C ATOM 321 O ASP A 22 -12.297 5.897 14.628 1.00 0.00 O ATOM 322 CB ASP A 22 -11.125 7.106 12.114 1.00 0.00 C ATOM 323 CG ASP A 22 -11.297 6.149 10.925 1.00 0.00 C ATOM 324 OD1 ASP A 22 -12.107 6.451 10.018 1.00 0.00 O ATOM 325 OD2 ASP A 22 -10.609 5.105 10.890 1.00 0.00 O ATOM 0 H ASP A 22 -11.854 8.453 14.513 1.00 0.00 H new ATOM 0 HA ASP A 22 -13.208 7.611 12.022 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -10.657 8.028 11.770 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -10.450 6.658 12.843 1.00 0.00 H new ATOM 330 N ASP A 23 -14.114 5.706 13.323 1.00 0.00 N ATOM 331 CA ASP A 23 -14.745 4.639 14.117 1.00 0.00 C ATOM 332 C ASP A 23 -13.819 3.430 14.331 1.00 0.00 C ATOM 333 O ASP A 23 -13.861 2.797 15.386 1.00 0.00 O ATOM 334 CB ASP A 23 -16.058 4.201 13.453 1.00 0.00 C ATOM 335 CG ASP A 23 -17.092 5.338 13.408 1.00 0.00 C ATOM 336 OD1 ASP A 23 -17.635 5.709 14.477 1.00 0.00 O ATOM 337 OD2 ASP A 23 -17.367 5.864 12.301 1.00 0.00 O ATOM 0 H ASP A 23 -14.648 5.972 12.496 1.00 0.00 H new ATOM 0 HA ASP A 23 -14.953 5.050 15.105 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -15.854 3.857 12.439 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -16.475 3.354 13.999 1.00 0.00 H new ATOM 342 N THR A 24 -12.926 3.150 13.375 1.00 0.00 N ATOM 343 CA THR A 24 -11.903 2.091 13.418 1.00 0.00 C ATOM 344 C THR A 24 -10.987 2.168 14.649 1.00 0.00 C ATOM 345 O THR A 24 -10.536 1.127 15.125 1.00 0.00 O ATOM 346 CB THR A 24 -11.057 2.100 12.133 1.00 0.00 C ATOM 347 OG1 THR A 24 -11.896 2.202 10.998 1.00 0.00 O ATOM 348 CG2 THR A 24 -10.229 0.829 11.951 1.00 0.00 C ATOM 0 H THR A 24 -12.893 3.681 12.505 1.00 0.00 H new ATOM 0 HA THR A 24 -12.451 1.152 13.495 1.00 0.00 H new ATOM 0 HB THR A 24 -10.387 2.954 12.229 1.00 0.00 H new ATOM 0 HG1 THR A 24 -11.794 3.089 10.595 1.00 0.00 H new ATOM 0 HG21 THR A 24 -9.655 0.898 11.027 1.00 0.00 H new ATOM 0 HG22 THR A 24 -9.547 0.715 12.794 1.00 0.00 H new ATOM 0 HG23 THR A 24 -10.893 -0.034 11.902 1.00 0.00 H new ATOM 356 N ILE A 25 -10.771 3.360 15.228 1.00 0.00 N ATOM 357 CA ILE A 25 -10.063 3.551 16.510 1.00 0.00 C ATOM 358 C ILE A 25 -10.723 2.724 17.627 1.00 0.00 C ATOM 359 O ILE A 25 -10.037 2.058 18.405 1.00 0.00 O ATOM 360 CB ILE A 25 -10.011 5.056 16.888 1.00 0.00 C ATOM 361 CG1 ILE A 25 -9.150 5.871 15.889 1.00 0.00 C ATOM 362 CG2 ILE A 25 -9.473 5.233 18.321 1.00 0.00 C ATOM 363 CD1 ILE A 25 -9.363 7.389 15.967 1.00 0.00 C ATOM 0 H ILE A 25 -11.088 4.236 14.813 1.00 0.00 H new ATOM 0 HA ILE A 25 -9.039 3.197 16.391 1.00 0.00 H new ATOM 0 HB ILE A 25 -11.030 5.441 16.839 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -8.098 5.653 16.072 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -9.374 5.536 14.876 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -9.443 6.294 18.570 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -10.127 4.714 19.022 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -8.468 4.816 18.386 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -8.724 7.884 15.236 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -10.406 7.621 15.753 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -9.111 7.741 16.967 1.00 0.00 H new ATOM 375 N PHE A 26 -12.056 2.767 17.707 1.00 0.00 N ATOM 376 CA PHE A 26 -12.863 2.033 18.684 1.00 0.00 C ATOM 377 C PHE A 26 -13.142 0.589 18.223 1.00 0.00 C ATOM 378 O PHE A 26 -13.064 -0.344 19.023 1.00 0.00 O ATOM 379 CB PHE A 26 -14.176 2.803 18.943 1.00 0.00 C ATOM 380 CG PHE A 26 -14.543 2.994 20.408 1.00 0.00 C ATOM 381 CD1 PHE A 26 -14.496 1.915 21.316 1.00 0.00 C ATOM 382 CD2 PHE A 26 -14.948 4.264 20.869 1.00 0.00 C ATOM 383 CE1 PHE A 26 -14.830 2.110 22.669 1.00 0.00 C ATOM 384 CE2 PHE A 26 -15.289 4.456 22.220 1.00 0.00 C ATOM 385 CZ PHE A 26 -15.226 3.380 23.122 1.00 0.00 C ATOM 0 H PHE A 26 -12.621 3.332 17.073 1.00 0.00 H new ATOM 0 HA PHE A 26 -12.302 1.959 19.616 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -14.101 3.784 18.474 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -14.991 2.275 18.448 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -14.202 0.935 20.971 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -14.997 5.094 20.180 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -14.782 1.282 23.361 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -15.600 5.431 22.565 1.00 0.00 H new ATOM 0 HZ PHE A 26 -15.481 3.529 24.161 1.00 0.00 H new ATOM 395 N GLN A 27 -13.457 0.392 16.935 1.00 0.00 N ATOM 396 CA GLN A 27 -13.837 -0.912 16.367 1.00 0.00 C ATOM 397 C GLN A 27 -12.682 -1.933 16.340 1.00 0.00 C ATOM 398 O GLN A 27 -12.944 -3.139 16.340 1.00 0.00 O ATOM 399 CB GLN A 27 -14.396 -0.747 14.940 1.00 0.00 C ATOM 400 CG GLN A 27 -15.606 0.204 14.816 1.00 0.00 C ATOM 401 CD GLN A 27 -16.853 -0.451 14.220 1.00 0.00 C ATOM 402 OE1 GLN A 27 -17.296 -1.518 14.627 1.00 0.00 O ATOM 403 NE2 GLN A 27 -17.484 0.165 13.239 1.00 0.00 N ATOM 0 H GLN A 27 -13.455 1.145 16.247 1.00 0.00 H new ATOM 0 HA GLN A 27 -14.606 -1.306 17.032 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -13.598 -0.381 14.294 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -14.685 -1.728 14.564 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -15.850 0.595 15.804 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -15.324 1.055 14.197 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -17.132 1.055 12.885 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -18.324 -0.248 12.834 1.00 0.00 H new ATOM 412 N ASN A 28 -11.419 -1.483 16.315 1.00 0.00 N ATOM 413 CA ASN A 28 -10.235 -2.337 16.184 1.00 0.00 C ATOM 414 C ASN A 28 -9.138 -1.979 17.221 1.00 0.00 C ATOM 415 O ASN A 28 -8.439 -0.976 17.051 1.00 0.00 O ATOM 416 CB ASN A 28 -9.737 -2.267 14.729 1.00 0.00 C ATOM 417 CG ASN A 28 -8.799 -3.421 14.426 1.00 0.00 C ATOM 418 OD1 ASN A 28 -9.156 -4.585 14.520 1.00 0.00 O ATOM 419 ND2 ASN A 28 -7.567 -3.148 14.082 1.00 0.00 N ATOM 0 H ASN A 28 -11.190 -0.492 16.387 1.00 0.00 H new ATOM 0 HA ASN A 28 -10.503 -3.369 16.409 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -10.587 -2.294 14.047 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -9.223 -1.321 14.561 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -6.910 -3.905 13.894 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -7.263 -2.178 14.002 1.00 0.00 H new ATOM 426 N PRO A 29 -8.948 -2.774 18.297 1.00 0.00 N ATOM 427 CA PRO A 29 -8.096 -2.406 19.439 1.00 0.00 C ATOM 428 C PRO A 29 -6.590 -2.348 19.128 1.00 0.00 C ATOM 429 O PRO A 29 -5.824 -1.771 19.903 1.00 0.00 O ATOM 430 CB PRO A 29 -8.406 -3.442 20.525 1.00 0.00 C ATOM 431 CG PRO A 29 -8.832 -4.673 19.729 1.00 0.00 C ATOM 432 CD PRO A 29 -9.575 -4.067 18.541 1.00 0.00 C ATOM 0 HA PRO A 29 -8.323 -1.386 19.749 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -7.534 -3.647 21.145 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -9.198 -3.101 21.191 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -7.974 -5.265 19.410 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -9.474 -5.331 20.315 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -9.500 -4.710 17.664 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -10.636 -3.951 18.761 1.00 0.00 H new ATOM 440 N MET A 30 -6.154 -2.879 17.978 1.00 0.00 N ATOM 441 CA MET A 30 -4.775 -2.760 17.481 1.00 0.00 C ATOM 442 C MET A 30 -4.346 -1.297 17.278 1.00 0.00 C ATOM 443 O MET A 30 -3.153 -0.999 17.346 1.00 0.00 O ATOM 444 CB MET A 30 -4.620 -3.518 16.154 1.00 0.00 C ATOM 445 CG MET A 30 -4.932 -5.018 16.252 1.00 0.00 C ATOM 446 SD MET A 30 -5.100 -5.873 14.658 1.00 0.00 S ATOM 447 CE MET A 30 -3.496 -5.521 13.887 1.00 0.00 C ATOM 0 H MET A 30 -6.760 -3.413 17.355 1.00 0.00 H new ATOM 0 HA MET A 30 -4.129 -3.196 18.243 1.00 0.00 H new ATOM 0 HB2 MET A 30 -5.279 -3.068 15.411 1.00 0.00 H new ATOM 0 HB3 MET A 30 -3.599 -3.392 15.793 1.00 0.00 H new ATOM 0 HG2 MET A 30 -4.141 -5.502 16.825 1.00 0.00 H new ATOM 0 HG3 MET A 30 -5.857 -5.145 16.815 1.00 0.00 H new ATOM 0 HE1 MET A 30 -3.354 -6.176 13.027 1.00 0.00 H new ATOM 0 HE2 MET A 30 -3.470 -4.481 13.560 1.00 0.00 H new ATOM 0 HE3 MET A 30 -2.699 -5.694 14.610 1.00 0.00 H new ATOM 457 N VAL A 31 -5.300 -0.375 17.072 1.00 0.00 N ATOM 458 CA VAL A 31 -5.025 1.067 16.997 1.00 0.00 C ATOM 459 C VAL A 31 -4.386 1.577 18.289 1.00 0.00 C ATOM 460 O VAL A 31 -3.264 2.072 18.253 1.00 0.00 O ATOM 461 CB VAL A 31 -6.275 1.886 16.606 1.00 0.00 C ATOM 462 CG1 VAL A 31 -5.983 3.392 16.647 1.00 0.00 C ATOM 463 CG2 VAL A 31 -6.748 1.507 15.193 1.00 0.00 C ATOM 0 H VAL A 31 -6.285 -0.610 16.953 1.00 0.00 H new ATOM 0 HA VAL A 31 -4.303 1.213 16.194 1.00 0.00 H new ATOM 0 HB VAL A 31 -7.057 1.655 17.329 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -6.880 3.944 16.367 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -5.681 3.677 17.655 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -5.180 3.626 15.948 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -7.629 2.094 14.935 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -5.953 1.712 14.476 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -6.998 0.446 15.165 1.00 0.00 H new ATOM 473 N GLN A 32 -5.053 1.416 19.436 1.00 0.00 N ATOM 474 CA GLN A 32 -4.563 1.863 20.751 1.00 0.00 C ATOM 475 C GLN A 32 -3.127 1.379 21.035 1.00 0.00 C ATOM 476 O GLN A 32 -2.268 2.158 21.454 1.00 0.00 O ATOM 477 CB GLN A 32 -5.522 1.362 21.848 1.00 0.00 C ATOM 478 CG GLN A 32 -6.929 1.988 21.795 1.00 0.00 C ATOM 479 CD GLN A 32 -6.977 3.468 22.188 1.00 0.00 C ATOM 480 OE1 GLN A 32 -6.146 3.993 22.918 1.00 0.00 O ATOM 481 NE2 GLN A 32 -7.966 4.204 21.726 1.00 0.00 N ATOM 0 H GLN A 32 -5.966 0.963 19.481 1.00 0.00 H new ATOM 0 HA GLN A 32 -4.536 2.953 20.747 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -5.616 0.279 21.765 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -5.081 1.570 22.823 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -7.324 1.880 20.785 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -7.588 1.427 22.457 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -8.670 3.788 21.116 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -8.028 5.190 21.978 1.00 0.00 H new ATOM 490 N GLU A 33 -2.849 0.103 20.751 1.00 0.00 N ATOM 491 CA GLU A 33 -1.528 -0.522 20.892 1.00 0.00 C ATOM 492 C GLU A 33 -0.447 0.106 19.988 1.00 0.00 C ATOM 493 O GLU A 33 0.701 0.237 20.413 1.00 0.00 O ATOM 494 CB GLU A 33 -1.681 -2.030 20.629 1.00 0.00 C ATOM 495 CG GLU A 33 -0.381 -2.849 20.701 1.00 0.00 C ATOM 496 CD GLU A 33 0.362 -2.760 22.053 1.00 0.00 C ATOM 497 OE1 GLU A 33 -0.276 -2.520 23.108 1.00 0.00 O ATOM 498 OE2 GLU A 33 1.598 -2.974 22.074 1.00 0.00 O ATOM 0 H GLU A 33 -3.558 -0.544 20.406 1.00 0.00 H new ATOM 0 HA GLU A 33 -1.173 -0.346 21.907 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -2.387 -2.438 21.352 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -2.122 -2.166 19.641 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -0.614 -3.894 20.498 1.00 0.00 H new ATOM 0 HG3 GLU A 33 0.289 -2.512 19.910 1.00 0.00 H new ATOM 505 N ALA A 34 -0.788 0.534 18.767 1.00 0.00 N ATOM 506 CA ALA A 34 0.137 1.251 17.889 1.00 0.00 C ATOM 507 C ALA A 34 0.531 2.626 18.471 1.00 0.00 C ATOM 508 O ALA A 34 1.721 2.874 18.666 1.00 0.00 O ATOM 509 CB ALA A 34 -0.457 1.340 16.479 1.00 0.00 C ATOM 0 H ALA A 34 -1.713 0.392 18.362 1.00 0.00 H new ATOM 0 HA ALA A 34 1.070 0.692 17.819 1.00 0.00 H new ATOM 0 HB1 ALA A 34 0.233 1.874 15.826 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -0.621 0.335 16.089 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -1.407 1.874 16.517 1.00 0.00 H new ATOM 515 N ILE A 35 -0.428 3.501 18.819 1.00 0.00 N ATOM 516 CA ILE A 35 -0.119 4.798 19.467 1.00 0.00 C ATOM 517 C ILE A 35 0.735 4.612 20.732 1.00 0.00 C ATOM 518 O ILE A 35 1.683 5.370 20.948 1.00 0.00 O ATOM 519 CB ILE A 35 -1.390 5.636 19.764 1.00 0.00 C ATOM 520 CG1 ILE A 35 -2.046 6.158 18.463 1.00 0.00 C ATOM 521 CG2 ILE A 35 -1.080 6.859 20.651 1.00 0.00 C ATOM 522 CD1 ILE A 35 -3.255 5.322 18.048 1.00 0.00 C ATOM 0 H ILE A 35 -1.423 3.339 18.665 1.00 0.00 H new ATOM 0 HA ILE A 35 0.470 5.366 18.747 1.00 0.00 H new ATOM 0 HB ILE A 35 -2.071 4.963 20.285 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -2.355 7.194 18.605 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -1.310 6.152 17.659 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -1.998 7.418 20.834 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -0.664 6.523 21.601 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -0.359 7.502 20.146 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -3.680 5.728 17.130 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -2.944 4.291 17.879 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -4.005 5.349 18.838 1.00 0.00 H new ATOM 534 N ARG A 36 0.461 3.578 21.542 1.00 0.00 N ATOM 535 CA ARG A 36 1.215 3.250 22.766 1.00 0.00 C ATOM 536 C ARG A 36 2.727 3.056 22.543 1.00 0.00 C ATOM 537 O ARG A 36 3.507 3.379 23.440 1.00 0.00 O ATOM 538 CB ARG A 36 0.560 2.025 23.427 1.00 0.00 C ATOM 539 CG ARG A 36 1.148 1.672 24.799 1.00 0.00 C ATOM 540 CD ARG A 36 0.428 0.452 25.377 1.00 0.00 C ATOM 541 NE ARG A 36 1.057 0.002 26.633 1.00 0.00 N ATOM 542 CZ ARG A 36 0.845 -1.143 27.257 1.00 0.00 C ATOM 543 NH1 ARG A 36 0.007 -2.032 26.804 1.00 0.00 N ATOM 544 NH2 ARG A 36 1.481 -1.418 28.361 1.00 0.00 N ATOM 0 H ARG A 36 -0.307 2.931 21.362 1.00 0.00 H new ATOM 0 HA ARG A 36 1.161 4.109 23.435 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -0.508 2.211 23.537 1.00 0.00 H new ATOM 0 HB3 ARG A 36 0.667 1.166 22.765 1.00 0.00 H new ATOM 0 HG2 ARG A 36 2.214 1.465 24.705 1.00 0.00 H new ATOM 0 HG3 ARG A 36 1.046 2.520 25.477 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -0.618 0.698 25.560 1.00 0.00 H new ATOM 0 HD3 ARG A 36 0.443 -0.360 24.650 1.00 0.00 H new ATOM 0 HE ARG A 36 1.725 0.641 27.064 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -0.509 -1.854 25.942 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -0.133 -2.906 27.311 1.00 0.00 H new ATOM 0 HH21 ARG A 36 2.146 -0.748 28.747 1.00 0.00 H new ATOM 0 HH22 ARG A 36 1.314 -2.303 28.839 1.00 0.00 H new ATOM 558 N MET A 37 3.164 2.595 21.364 1.00 0.00 N ATOM 559 CA MET A 37 4.595 2.487 21.017 1.00 0.00 C ATOM 560 C MET A 37 5.269 3.829 20.654 1.00 0.00 C ATOM 561 O MET A 37 6.492 3.874 20.492 1.00 0.00 O ATOM 562 CB MET A 37 4.816 1.489 19.869 1.00 0.00 C ATOM 563 CG MET A 37 4.318 0.071 20.179 1.00 0.00 C ATOM 564 SD MET A 37 5.298 -1.271 19.437 1.00 0.00 S ATOM 565 CE MET A 37 5.515 -0.655 17.744 1.00 0.00 C ATOM 0 H MET A 37 2.538 2.285 20.620 1.00 0.00 H new ATOM 0 HA MET A 37 5.071 2.129 21.930 1.00 0.00 H new ATOM 0 HB2 MET A 37 4.308 1.856 18.977 1.00 0.00 H new ATOM 0 HB3 MET A 37 5.880 1.448 19.635 1.00 0.00 H new ATOM 0 HG2 MET A 37 4.305 -0.065 21.260 1.00 0.00 H new ATOM 0 HG3 MET A 37 3.288 -0.019 19.834 1.00 0.00 H new ATOM 0 HE1 MET A 37 5.873 -1.463 17.106 1.00 0.00 H new ATOM 0 HE2 MET A 37 4.561 -0.289 17.365 1.00 0.00 H new ATOM 0 HE3 MET A 37 6.242 0.157 17.743 1.00 0.00 H new ATOM 575 N GLY A 38 4.504 4.919 20.519 1.00 0.00 N ATOM 576 CA GLY A 38 4.984 6.273 20.203 1.00 0.00 C ATOM 577 C GLY A 38 4.506 6.838 18.856 1.00 0.00 C ATOM 578 O GLY A 38 4.851 7.975 18.522 1.00 0.00 O ATOM 0 H GLY A 38 3.491 4.882 20.631 1.00 0.00 H new ATOM 0 HA2 GLY A 38 4.665 6.949 20.996 1.00 0.00 H new ATOM 0 HA3 GLY A 38 6.074 6.266 20.210 1.00 0.00 H new ATOM 582 N PHE A 39 3.725 6.079 18.075 1.00 0.00 N ATOM 583 CA PHE A 39 3.082 6.566 16.846 1.00 0.00 C ATOM 584 C PHE A 39 1.983 7.620 17.124 1.00 0.00 C ATOM 585 O PHE A 39 1.499 7.767 18.249 1.00 0.00 O ATOM 586 CB PHE A 39 2.492 5.379 16.071 1.00 0.00 C ATOM 587 CG PHE A 39 3.494 4.440 15.418 1.00 0.00 C ATOM 588 CD1 PHE A 39 4.147 4.830 14.234 1.00 0.00 C ATOM 589 CD2 PHE A 39 3.733 3.155 15.944 1.00 0.00 C ATOM 590 CE1 PHE A 39 5.036 3.949 13.590 1.00 0.00 C ATOM 591 CE2 PHE A 39 4.607 2.268 15.292 1.00 0.00 C ATOM 592 CZ PHE A 39 5.257 2.664 14.113 1.00 0.00 C ATOM 0 H PHE A 39 3.520 5.101 18.280 1.00 0.00 H new ATOM 0 HA PHE A 39 3.849 7.060 16.250 1.00 0.00 H new ATOM 0 HB2 PHE A 39 1.872 4.798 16.754 1.00 0.00 H new ATOM 0 HB3 PHE A 39 1.833 5.769 15.296 1.00 0.00 H new ATOM 0 HD1 PHE A 39 3.965 5.810 13.818 1.00 0.00 H new ATOM 0 HD2 PHE A 39 3.241 2.849 16.855 1.00 0.00 H new ATOM 0 HE1 PHE A 39 5.549 4.261 12.692 1.00 0.00 H new ATOM 0 HE2 PHE A 39 4.778 1.282 15.698 1.00 0.00 H new ATOM 0 HZ PHE A 39 5.926 1.982 13.609 1.00 0.00 H new ATOM 602 N SER A 40 1.555 8.337 16.079 1.00 0.00 N ATOM 603 CA SER A 40 0.521 9.387 16.128 1.00 0.00 C ATOM 604 C SER A 40 -0.864 8.841 15.757 1.00 0.00 C ATOM 605 O SER A 40 -0.985 8.098 14.785 1.00 0.00 O ATOM 606 CB SER A 40 0.883 10.498 15.132 1.00 0.00 C ATOM 607 OG SER A 40 2.184 11.018 15.381 1.00 0.00 O ATOM 0 H SER A 40 1.930 8.200 15.140 1.00 0.00 H new ATOM 0 HA SER A 40 0.483 9.768 17.149 1.00 0.00 H new ATOM 0 HB2 SER A 40 0.835 10.107 14.116 1.00 0.00 H new ATOM 0 HB3 SER A 40 0.150 11.302 15.199 1.00 0.00 H new ATOM 0 HG SER A 40 2.385 11.722 14.729 1.00 0.00 H new ATOM 613 N PHE A 41 -1.926 9.252 16.465 1.00 0.00 N ATOM 614 CA PHE A 41 -3.315 8.820 16.200 1.00 0.00 C ATOM 615 C PHE A 41 -3.731 8.981 14.730 1.00 0.00 C ATOM 616 O PHE A 41 -4.242 8.032 14.129 1.00 0.00 O ATOM 617 CB PHE A 41 -4.301 9.550 17.135 1.00 0.00 C ATOM 618 CG PHE A 41 -4.783 8.713 18.306 1.00 0.00 C ATOM 619 CD1 PHE A 41 -5.743 7.705 18.092 1.00 0.00 C ATOM 620 CD2 PHE A 41 -4.273 8.927 19.602 1.00 0.00 C ATOM 621 CE1 PHE A 41 -6.173 6.903 19.165 1.00 0.00 C ATOM 622 CE2 PHE A 41 -4.709 8.125 20.674 1.00 0.00 C ATOM 623 CZ PHE A 41 -5.653 7.108 20.454 1.00 0.00 C ATOM 0 H PHE A 41 -1.849 9.901 17.248 1.00 0.00 H new ATOM 0 HA PHE A 41 -3.351 7.751 16.411 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -3.821 10.450 17.519 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -5.165 9.873 16.553 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -6.149 7.548 17.104 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -3.546 9.707 19.773 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -6.905 6.127 18.997 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -4.317 8.292 21.667 1.00 0.00 H new ATOM 0 HZ PHE A 41 -5.978 6.485 21.274 1.00 0.00 H new ATOM 633 N LYS A 42 -3.462 10.158 14.148 1.00 0.00 N ATOM 634 CA LYS A 42 -3.691 10.506 12.733 1.00 0.00 C ATOM 635 C LYS A 42 -3.060 9.502 11.764 1.00 0.00 C ATOM 636 O LYS A 42 -3.703 9.099 10.799 1.00 0.00 O ATOM 637 CB LYS A 42 -3.210 11.952 12.506 1.00 0.00 C ATOM 638 CG LYS A 42 -3.284 12.448 11.049 1.00 0.00 C ATOM 639 CD LYS A 42 -1.940 12.318 10.313 1.00 0.00 C ATOM 640 CE LYS A 42 -1.935 13.076 8.980 1.00 0.00 C ATOM 641 NZ LYS A 42 -2.736 12.392 7.931 1.00 0.00 N ATOM 0 H LYS A 42 -3.059 10.933 14.674 1.00 0.00 H new ATOM 0 HA LYS A 42 -4.758 10.449 12.516 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -3.806 12.618 13.130 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -2.178 12.032 12.848 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -4.044 11.879 10.513 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -3.600 13.491 11.039 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -1.141 12.699 10.949 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -1.728 11.265 10.131 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -2.329 14.080 9.136 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -0.908 13.187 8.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -2.700 12.945 7.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -2.346 11.443 7.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -3.723 12.309 8.247 1.00 0.00 H new ATOM 655 N ASP A 43 -1.826 9.076 12.020 1.00 0.00 N ATOM 656 CA ASP A 43 -1.109 8.096 11.195 1.00 0.00 C ATOM 657 C ASP A 43 -1.783 6.719 11.257 1.00 0.00 C ATOM 658 O ASP A 43 -1.969 6.082 10.218 1.00 0.00 O ATOM 659 CB ASP A 43 0.362 7.982 11.626 1.00 0.00 C ATOM 660 CG ASP A 43 1.209 9.217 11.275 1.00 0.00 C ATOM 661 OD1 ASP A 43 0.790 10.362 11.556 1.00 0.00 O ATOM 662 OD2 ASP A 43 2.331 9.027 10.748 1.00 0.00 O ATOM 0 H ASP A 43 -1.283 9.405 12.819 1.00 0.00 H new ATOM 0 HA ASP A 43 -1.143 8.451 10.165 1.00 0.00 H new ATOM 0 HB2 ASP A 43 0.404 7.818 12.703 1.00 0.00 H new ATOM 0 HB3 ASP A 43 0.803 7.104 11.153 1.00 0.00 H new ATOM 667 N ILE A 44 -2.187 6.266 12.453 1.00 0.00 N ATOM 668 CA ILE A 44 -2.836 4.958 12.614 1.00 0.00 C ATOM 669 C ILE A 44 -4.201 4.924 11.924 1.00 0.00 C ATOM 670 O ILE A 44 -4.463 4.021 11.130 1.00 0.00 O ATOM 671 CB ILE A 44 -2.972 4.508 14.083 1.00 0.00 C ATOM 672 CG1 ILE A 44 -1.730 4.746 14.964 1.00 0.00 C ATOM 673 CG2 ILE A 44 -3.309 3.005 14.080 1.00 0.00 C ATOM 674 CD1 ILE A 44 -0.414 4.303 14.338 1.00 0.00 C ATOM 0 H ILE A 44 -2.075 6.787 13.323 1.00 0.00 H new ATOM 0 HA ILE A 44 -2.169 4.245 12.129 1.00 0.00 H new ATOM 0 HB ILE A 44 -3.755 5.122 14.527 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -1.666 5.808 15.199 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -1.864 4.218 15.908 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -3.412 2.653 15.106 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -4.245 2.843 13.545 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -2.509 2.454 13.586 1.00 0.00 H new ATOM 0 HD11 ILE A 44 0.404 4.509 15.028 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -0.452 3.234 14.129 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -0.251 4.849 13.409 1.00 0.00 H new ATOM 686 N LYS A 45 -5.074 5.907 12.182 1.00 0.00 N ATOM 687 CA LYS A 45 -6.382 5.976 11.505 1.00 0.00 C ATOM 688 C LYS A 45 -6.241 6.096 9.985 1.00 0.00 C ATOM 689 O LYS A 45 -6.965 5.407 9.269 1.00 0.00 O ATOM 690 CB LYS A 45 -7.306 7.027 12.148 1.00 0.00 C ATOM 691 CG LYS A 45 -6.846 8.497 12.108 1.00 0.00 C ATOM 692 CD LYS A 45 -7.237 9.329 10.875 1.00 0.00 C ATOM 693 CE LYS A 45 -8.758 9.405 10.715 1.00 0.00 C ATOM 694 NZ LYS A 45 -9.167 10.290 9.599 1.00 0.00 N ATOM 0 H LYS A 45 -4.903 6.661 12.848 1.00 0.00 H new ATOM 0 HA LYS A 45 -6.888 5.023 11.660 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -8.278 6.965 11.659 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -7.456 6.750 13.191 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -7.242 8.998 12.991 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -5.759 8.512 12.193 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -6.828 10.335 10.968 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -6.797 8.887 9.981 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -9.153 8.404 10.544 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -9.200 9.768 11.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -10.157 10.580 9.731 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -8.558 11.133 9.583 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -9.073 9.779 8.698 1.00 0.00 H new ATOM 708 N LYS A 46 -5.260 6.868 9.490 1.00 0.00 N ATOM 709 CA LYS A 46 -4.956 6.998 8.054 1.00 0.00 C ATOM 710 C LYS A 46 -4.532 5.667 7.430 1.00 0.00 C ATOM 711 O LYS A 46 -5.065 5.297 6.384 1.00 0.00 O ATOM 712 CB LYS A 46 -3.912 8.109 7.822 1.00 0.00 C ATOM 713 CG LYS A 46 -3.529 8.322 6.344 1.00 0.00 C ATOM 714 CD LYS A 46 -4.699 8.782 5.446 1.00 0.00 C ATOM 715 CE LYS A 46 -4.848 7.905 4.195 1.00 0.00 C ATOM 716 NZ LYS A 46 -3.774 8.155 3.199 1.00 0.00 N ATOM 0 H LYS A 46 -4.647 7.427 10.083 1.00 0.00 H new ATOM 0 HA LYS A 46 -5.874 7.290 7.543 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -4.300 9.045 8.223 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -3.012 7.869 8.387 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -2.732 9.063 6.290 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -3.126 7.390 5.947 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -5.626 8.756 6.018 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -4.539 9.817 5.145 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -4.833 6.855 4.486 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -5.818 8.094 3.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -3.847 7.461 2.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -3.876 9.115 2.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -2.846 8.065 3.659 1.00 0.00 H new ATOM 730 N ILE A 47 -3.589 4.944 8.039 1.00 0.00 N ATOM 731 CA ILE A 47 -3.142 3.657 7.490 1.00 0.00 C ATOM 732 C ILE A 47 -4.237 2.584 7.570 1.00 0.00 C ATOM 733 O ILE A 47 -4.403 1.822 6.622 1.00 0.00 O ATOM 734 CB ILE A 47 -1.793 3.205 8.092 1.00 0.00 C ATOM 735 CG1 ILE A 47 -1.061 2.353 7.040 1.00 0.00 C ATOM 736 CG2 ILE A 47 -1.920 2.462 9.435 1.00 0.00 C ATOM 737 CD1 ILE A 47 0.374 2.001 7.431 1.00 0.00 C ATOM 0 H ILE A 47 -3.123 5.222 8.903 1.00 0.00 H new ATOM 0 HA ILE A 47 -2.954 3.807 6.427 1.00 0.00 H new ATOM 0 HB ILE A 47 -1.216 4.098 8.334 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -1.621 1.432 6.876 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -1.049 2.891 6.092 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -0.929 2.179 9.789 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -2.395 3.114 10.168 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -2.526 1.566 9.299 1.00 0.00 H new ATOM 0 HD11 ILE A 47 0.829 1.400 6.644 1.00 0.00 H new ATOM 0 HD12 ILE A 47 0.949 2.917 7.566 1.00 0.00 H new ATOM 0 HD13 ILE A 47 0.369 1.435 8.362 1.00 0.00 H new ATOM 749 N MET A 48 -5.030 2.559 8.648 1.00 0.00 N ATOM 750 CA MET A 48 -6.182 1.667 8.813 1.00 0.00 C ATOM 751 C MET A 48 -7.253 1.903 7.738 1.00 0.00 C ATOM 752 O MET A 48 -7.615 0.965 7.028 1.00 0.00 O ATOM 753 CB MET A 48 -6.778 1.827 10.219 1.00 0.00 C ATOM 754 CG MET A 48 -5.911 1.163 11.297 1.00 0.00 C ATOM 755 SD MET A 48 -6.643 -0.346 11.987 1.00 0.00 S ATOM 756 CE MET A 48 -5.158 -1.132 12.655 1.00 0.00 C ATOM 0 H MET A 48 -4.884 3.174 9.449 1.00 0.00 H new ATOM 0 HA MET A 48 -5.828 0.643 8.691 1.00 0.00 H new ATOM 0 HB2 MET A 48 -6.888 2.887 10.446 1.00 0.00 H new ATOM 0 HB3 MET A 48 -7.777 1.391 10.240 1.00 0.00 H new ATOM 0 HG2 MET A 48 -4.937 0.923 10.871 1.00 0.00 H new ATOM 0 HG3 MET A 48 -5.739 1.876 12.104 1.00 0.00 H new ATOM 0 HE1 MET A 48 -5.269 -2.215 12.612 1.00 0.00 H new ATOM 0 HE2 MET A 48 -4.291 -0.832 12.066 1.00 0.00 H new ATOM 0 HE3 MET A 48 -5.017 -0.823 13.691 1.00 0.00 H new ATOM 766 N GLU A 49 -7.757 3.136 7.592 1.00 0.00 N ATOM 767 CA GLU A 49 -8.783 3.453 6.587 1.00 0.00 C ATOM 768 C GLU A 49 -8.300 3.165 5.154 1.00 0.00 C ATOM 769 O GLU A 49 -9.047 2.592 4.361 1.00 0.00 O ATOM 770 CB GLU A 49 -9.341 4.885 6.760 1.00 0.00 C ATOM 771 CG GLU A 49 -8.418 6.034 6.323 1.00 0.00 C ATOM 772 CD GLU A 49 -9.021 7.424 6.637 1.00 0.00 C ATOM 773 OE1 GLU A 49 -9.942 7.859 5.902 1.00 0.00 O ATOM 774 OE2 GLU A 49 -8.564 8.113 7.585 1.00 0.00 O ATOM 0 H GLU A 49 -7.470 3.934 8.159 1.00 0.00 H new ATOM 0 HA GLU A 49 -9.621 2.779 6.762 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -10.271 4.960 6.196 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -9.593 5.029 7.811 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -7.456 5.936 6.826 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -8.227 5.957 5.253 1.00 0.00 H new ATOM 781 N GLU A 50 -7.041 3.483 4.828 1.00 0.00 N ATOM 782 CA GLU A 50 -6.440 3.182 3.524 1.00 0.00 C ATOM 783 C GLU A 50 -6.277 1.673 3.282 1.00 0.00 C ATOM 784 O GLU A 50 -6.709 1.177 2.241 1.00 0.00 O ATOM 785 CB GLU A 50 -5.111 3.937 3.385 1.00 0.00 C ATOM 786 CG GLU A 50 -4.511 3.819 1.979 1.00 0.00 C ATOM 787 CD GLU A 50 -3.399 4.864 1.777 1.00 0.00 C ATOM 788 OE1 GLU A 50 -3.721 6.029 1.432 1.00 0.00 O ATOM 789 OE2 GLU A 50 -2.202 4.546 1.981 1.00 0.00 O ATOM 0 H GLU A 50 -6.406 3.960 5.468 1.00 0.00 H new ATOM 0 HA GLU A 50 -7.122 3.527 2.747 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -5.269 4.989 3.622 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -4.399 3.549 4.114 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -4.107 2.817 1.833 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -5.291 3.961 1.231 1.00 0.00 H new ATOM 796 N LYS A 51 -5.717 0.920 4.241 1.00 0.00 N ATOM 797 CA LYS A 51 -5.584 -0.548 4.178 1.00 0.00 C ATOM 798 C LYS A 51 -6.929 -1.217 3.905 1.00 0.00 C ATOM 799 O LYS A 51 -7.031 -2.002 2.966 1.00 0.00 O ATOM 800 CB LYS A 51 -4.936 -1.074 5.473 1.00 0.00 C ATOM 801 CG LYS A 51 -4.786 -2.604 5.554 1.00 0.00 C ATOM 802 CD LYS A 51 -3.894 -3.190 4.450 1.00 0.00 C ATOM 803 CE LYS A 51 -3.530 -4.641 4.793 1.00 0.00 C ATOM 804 NZ LYS A 51 -2.878 -5.329 3.647 1.00 0.00 N ATOM 0 H LYS A 51 -5.336 1.319 5.099 1.00 0.00 H new ATOM 0 HA LYS A 51 -4.932 -0.803 3.343 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -3.950 -0.622 5.577 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -5.532 -0.738 6.322 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -4.370 -2.870 6.526 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -5.773 -3.062 5.494 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -4.413 -3.152 3.492 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -2.988 -2.593 4.346 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -2.862 -4.655 5.654 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -4.430 -5.184 5.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -2.646 -6.307 3.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -3.525 -5.337 2.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -2.006 -4.825 3.390 1.00 0.00 H new ATOM 818 N ILE A 52 -7.960 -0.892 4.686 1.00 0.00 N ATOM 819 CA ILE A 52 -9.310 -1.453 4.523 1.00 0.00 C ATOM 820 C ILE A 52 -9.911 -1.071 3.159 1.00 0.00 C ATOM 821 O ILE A 52 -10.431 -1.943 2.466 1.00 0.00 O ATOM 822 CB ILE A 52 -10.215 -1.046 5.708 1.00 0.00 C ATOM 823 CG1 ILE A 52 -9.683 -1.634 7.037 1.00 0.00 C ATOM 824 CG2 ILE A 52 -11.654 -1.560 5.492 1.00 0.00 C ATOM 825 CD1 ILE A 52 -10.263 -0.956 8.288 1.00 0.00 C ATOM 0 H ILE A 52 -7.885 -0.228 5.456 1.00 0.00 H new ATOM 0 HA ILE A 52 -9.239 -2.541 4.534 1.00 0.00 H new ATOM 0 HB ILE A 52 -10.211 0.043 5.761 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -9.914 -2.699 7.071 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -8.597 -1.543 7.056 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -12.277 -1.264 6.336 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -12.059 -1.133 4.575 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -11.644 -2.647 5.412 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -9.845 -1.421 9.181 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -10.010 0.104 8.278 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -11.347 -1.070 8.294 1.00 0.00 H new ATOM 837 N GLN A 53 -9.814 0.197 2.736 1.00 0.00 N ATOM 838 CA GLN A 53 -10.335 0.669 1.444 1.00 0.00 C ATOM 839 C GLN A 53 -9.671 -0.033 0.239 1.00 0.00 C ATOM 840 O GLN A 53 -10.366 -0.466 -0.682 1.00 0.00 O ATOM 841 CB GLN A 53 -10.176 2.202 1.375 1.00 0.00 C ATOM 842 CG GLN A 53 -10.811 2.866 0.142 1.00 0.00 C ATOM 843 CD GLN A 53 -12.334 2.726 0.104 1.00 0.00 C ATOM 844 OE1 GLN A 53 -12.894 1.844 -0.533 1.00 0.00 O ATOM 845 NE2 GLN A 53 -13.070 3.583 0.782 1.00 0.00 N ATOM 0 H GLN A 53 -9.368 0.931 3.286 1.00 0.00 H new ATOM 0 HA GLN A 53 -11.392 0.409 1.380 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -10.616 2.639 2.271 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -9.113 2.443 1.392 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -10.549 3.924 0.131 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -10.389 2.423 -0.760 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -12.623 4.326 1.320 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -14.087 3.504 0.769 1.00 0.00 H new ATOM 854 N ILE A 54 -8.339 -0.154 0.233 1.00 0.00 N ATOM 855 CA ILE A 54 -7.557 -0.767 -0.856 1.00 0.00 C ATOM 856 C ILE A 54 -7.642 -2.307 -0.835 1.00 0.00 C ATOM 857 O ILE A 54 -7.936 -2.922 -1.863 1.00 0.00 O ATOM 858 CB ILE A 54 -6.092 -0.261 -0.800 1.00 0.00 C ATOM 859 CG1 ILE A 54 -5.985 1.273 -1.003 1.00 0.00 C ATOM 860 CG2 ILE A 54 -5.179 -0.976 -1.814 1.00 0.00 C ATOM 861 CD1 ILE A 54 -6.460 1.825 -2.359 1.00 0.00 C ATOM 0 H ILE A 54 -7.757 0.178 1.002 1.00 0.00 H new ATOM 0 HA ILE A 54 -7.990 -0.458 -1.807 1.00 0.00 H new ATOM 0 HB ILE A 54 -5.747 -0.503 0.205 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -6.560 1.761 -0.216 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -4.944 1.563 -0.863 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -4.166 -0.583 -1.731 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -5.171 -2.046 -1.605 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -5.553 -0.806 -2.824 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -6.334 2.908 -2.376 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -5.871 1.379 -3.160 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -7.512 1.580 -2.503 1.00 0.00 H new ATOM 873 N SER A 55 -7.373 -2.941 0.312 1.00 0.00 N ATOM 874 CA SER A 55 -7.238 -4.404 0.464 1.00 0.00 C ATOM 875 C SER A 55 -8.575 -5.135 0.677 1.00 0.00 C ATOM 876 O SER A 55 -8.738 -6.270 0.224 1.00 0.00 O ATOM 877 CB SER A 55 -6.306 -4.692 1.651 1.00 0.00 C ATOM 878 OG SER A 55 -5.772 -6.006 1.625 1.00 0.00 O ATOM 0 H SER A 55 -7.238 -2.440 1.190 1.00 0.00 H new ATOM 0 HA SER A 55 -6.828 -4.784 -0.472 1.00 0.00 H new ATOM 0 HB2 SER A 55 -5.488 -3.972 1.647 1.00 0.00 H new ATOM 0 HB3 SER A 55 -6.855 -4.546 2.581 1.00 0.00 H new ATOM 0 HG SER A 55 -5.318 -6.191 2.473 1.00 0.00 H new ATOM 884 N GLY A 56 -9.531 -4.501 1.365 1.00 0.00 N ATOM 885 CA GLY A 56 -10.875 -5.020 1.674 1.00 0.00 C ATOM 886 C GLY A 56 -11.098 -5.431 3.141 1.00 0.00 C ATOM 887 O GLY A 56 -12.249 -5.507 3.580 1.00 0.00 O ATOM 0 H GLY A 56 -9.384 -3.565 1.742 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -11.610 -4.259 1.411 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -11.068 -5.884 1.038 1.00 0.00 H new ATOM 891 N SER A 57 -10.024 -5.653 3.911 1.00 0.00 N ATOM 892 CA SER A 57 -10.042 -6.052 5.333 1.00 0.00 C ATOM 893 C SER A 57 -8.950 -5.341 6.147 1.00 0.00 C ATOM 894 O SER A 57 -8.020 -4.755 5.588 1.00 0.00 O ATOM 895 CB SER A 57 -9.866 -7.576 5.468 1.00 0.00 C ATOM 896 OG SER A 57 -10.949 -8.277 4.870 1.00 0.00 O ATOM 0 H SER A 57 -9.076 -5.556 3.548 1.00 0.00 H new ATOM 0 HA SER A 57 -11.011 -5.755 5.733 1.00 0.00 H new ATOM 0 HB2 SER A 57 -8.930 -7.879 4.998 1.00 0.00 H new ATOM 0 HB3 SER A 57 -9.795 -7.844 6.522 1.00 0.00 H new ATOM 0 HG SER A 57 -10.809 -9.242 4.970 1.00 0.00 H new ATOM 902 N ASN A 58 -9.057 -5.392 7.480 1.00 0.00 N ATOM 903 CA ASN A 58 -8.098 -4.790 8.417 1.00 0.00 C ATOM 904 C ASN A 58 -6.776 -5.601 8.516 1.00 0.00 C ATOM 905 O ASN A 58 -6.671 -6.722 8.008 1.00 0.00 O ATOM 906 CB ASN A 58 -8.815 -4.618 9.778 1.00 0.00 C ATOM 907 CG ASN A 58 -8.306 -3.430 10.580 1.00 0.00 C ATOM 908 OD1 ASN A 58 -7.120 -3.157 10.653 1.00 0.00 O ATOM 909 ND2 ASN A 58 -9.175 -2.653 11.180 1.00 0.00 N ATOM 0 H ASN A 58 -9.830 -5.864 7.949 1.00 0.00 H new ATOM 0 HA ASN A 58 -7.782 -3.812 8.053 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -9.885 -4.499 9.605 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -8.686 -5.527 10.366 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -8.855 -1.835 11.698 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -10.171 -2.867 11.129 1.00 0.00 H new ATOM 916 N TYR A 59 -5.765 -5.041 9.186 1.00 0.00 N ATOM 917 CA TYR A 59 -4.473 -5.666 9.486 1.00 0.00 C ATOM 918 C TYR A 59 -4.600 -6.960 10.314 1.00 0.00 C ATOM 919 O TYR A 59 -5.488 -7.101 11.161 1.00 0.00 O ATOM 920 CB TYR A 59 -3.575 -4.637 10.200 1.00 0.00 C ATOM 921 CG TYR A 59 -2.920 -3.659 9.244 1.00 0.00 C ATOM 922 CD1 TYR A 59 -1.864 -4.116 8.436 1.00 0.00 C ATOM 923 CD2 TYR A 59 -3.368 -2.327 9.130 1.00 0.00 C ATOM 924 CE1 TYR A 59 -1.266 -3.257 7.500 1.00 0.00 C ATOM 925 CE2 TYR A 59 -2.755 -1.455 8.206 1.00 0.00 C ATOM 926 CZ TYR A 59 -1.712 -1.926 7.377 1.00 0.00 C ATOM 927 OH TYR A 59 -1.166 -1.123 6.428 1.00 0.00 O ATOM 0 H TYR A 59 -5.828 -4.091 9.553 1.00 0.00 H new ATOM 0 HA TYR A 59 -4.021 -5.968 8.541 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -4.171 -4.084 10.925 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -2.802 -5.164 10.759 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -1.511 -5.132 8.536 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -4.180 -1.975 9.749 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -0.463 -3.617 6.874 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -3.082 -0.428 8.132 1.00 0.00 H new ATOM 0 HH TYR A 59 -0.414 -1.585 6.002 1.00 0.00 H new ATOM 937 N LYS A 60 -3.683 -7.907 10.070 1.00 0.00 N ATOM 938 CA LYS A 60 -3.664 -9.260 10.662 1.00 0.00 C ATOM 939 C LYS A 60 -3.165 -9.280 12.111 1.00 0.00 C ATOM 940 O LYS A 60 -3.793 -9.887 12.979 1.00 0.00 O ATOM 941 CB LYS A 60 -2.791 -10.190 9.794 1.00 0.00 C ATOM 942 CG LYS A 60 -3.251 -10.339 8.333 1.00 0.00 C ATOM 943 CD LYS A 60 -4.655 -10.952 8.199 1.00 0.00 C ATOM 944 CE LYS A 60 -5.092 -11.116 6.736 1.00 0.00 C ATOM 945 NZ LYS A 60 -4.278 -12.124 6.003 1.00 0.00 N ATOM 0 H LYS A 60 -2.903 -7.750 9.432 1.00 0.00 H new ATOM 0 HA LYS A 60 -4.695 -9.612 10.683 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -1.768 -9.813 9.800 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -2.770 -11.178 10.255 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -3.242 -9.360 7.854 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -2.537 -10.963 7.796 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -4.671 -11.925 8.690 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -5.374 -10.320 8.720 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -6.141 -11.410 6.705 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -5.016 -10.155 6.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -4.657 -12.244 5.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -3.291 -11.800 5.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -4.316 -13.033 6.506 1.00 0.00 H new ATOM 959 N SER A 61 -2.018 -8.649 12.356 1.00 0.00 N ATOM 960 CA SER A 61 -1.324 -8.524 13.647 1.00 0.00 C ATOM 961 C SER A 61 -0.475 -7.250 13.671 1.00 0.00 C ATOM 962 O SER A 61 -0.240 -6.632 12.627 1.00 0.00 O ATOM 963 CB SER A 61 -0.416 -9.745 13.882 1.00 0.00 C ATOM 964 OG SER A 61 -1.175 -10.879 14.271 1.00 0.00 O ATOM 0 H SER A 61 -1.509 -8.177 11.609 1.00 0.00 H new ATOM 0 HA SER A 61 -2.073 -8.473 14.437 1.00 0.00 H new ATOM 0 HB2 SER A 61 0.139 -9.970 12.971 1.00 0.00 H new ATOM 0 HB3 SER A 61 0.318 -9.513 14.653 1.00 0.00 H new ATOM 0 HG SER A 61 -2.114 -10.745 14.023 1.00 0.00 H new ATOM 970 N LEU A 62 0.011 -6.862 14.855 1.00 0.00 N ATOM 971 CA LEU A 62 0.799 -5.639 15.045 1.00 0.00 C ATOM 972 C LEU A 62 2.069 -5.621 14.184 1.00 0.00 C ATOM 973 O LEU A 62 2.420 -4.558 13.689 1.00 0.00 O ATOM 974 CB LEU A 62 1.153 -5.419 16.532 1.00 0.00 C ATOM 975 CG LEU A 62 0.027 -4.971 17.487 1.00 0.00 C ATOM 976 CD1 LEU A 62 -0.700 -3.717 16.996 1.00 0.00 C ATOM 977 CD2 LEU A 62 -1.014 -6.057 17.765 1.00 0.00 C ATOM 0 H LEU A 62 -0.132 -7.392 15.715 1.00 0.00 H new ATOM 0 HA LEU A 62 0.168 -4.814 14.714 1.00 0.00 H new ATOM 0 HB2 LEU A 62 1.567 -6.351 16.918 1.00 0.00 H new ATOM 0 HB3 LEU A 62 1.947 -4.674 16.579 1.00 0.00 H new ATOM 0 HG LEU A 62 0.550 -4.749 18.417 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -1.481 -3.448 17.707 1.00 0.00 H new ATOM 0 HD12 LEU A 62 0.011 -2.895 16.909 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -1.148 -3.914 16.022 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -1.773 -5.668 18.444 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -1.484 -6.358 16.829 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -0.527 -6.919 18.221 1.00 0.00 H new ATOM 989 N GLU A 63 2.720 -6.763 13.936 1.00 0.00 N ATOM 990 CA GLU A 63 3.908 -6.860 13.066 1.00 0.00 C ATOM 991 C GLU A 63 3.689 -6.216 11.687 1.00 0.00 C ATOM 992 O GLU A 63 4.484 -5.375 11.263 1.00 0.00 O ATOM 993 CB GLU A 63 4.337 -8.325 12.878 1.00 0.00 C ATOM 994 CG GLU A 63 4.942 -8.940 14.144 1.00 0.00 C ATOM 995 CD GLU A 63 5.524 -10.335 13.846 1.00 0.00 C ATOM 996 OE1 GLU A 63 4.788 -11.346 13.961 1.00 0.00 O ATOM 997 OE2 GLU A 63 6.726 -10.436 13.494 1.00 0.00 O ATOM 0 H GLU A 63 2.438 -7.658 14.336 1.00 0.00 H new ATOM 0 HA GLU A 63 4.698 -6.307 13.574 1.00 0.00 H new ATOM 0 HB2 GLU A 63 3.473 -8.914 12.572 1.00 0.00 H new ATOM 0 HB3 GLU A 63 5.065 -8.383 12.069 1.00 0.00 H new ATOM 0 HG2 GLU A 63 5.725 -8.289 14.532 1.00 0.00 H new ATOM 0 HG3 GLU A 63 4.178 -9.017 14.918 1.00 0.00 H new ATOM 1004 N VAL A 64 2.606 -6.588 10.994 1.00 0.00 N ATOM 1005 CA VAL A 64 2.256 -6.033 9.674 1.00 0.00 C ATOM 1006 C VAL A 64 1.890 -4.548 9.796 1.00 0.00 C ATOM 1007 O VAL A 64 2.345 -3.733 8.994 1.00 0.00 O ATOM 1008 CB VAL A 64 1.106 -6.813 9.001 1.00 0.00 C ATOM 1009 CG1 VAL A 64 0.996 -6.433 7.519 1.00 0.00 C ATOM 1010 CG2 VAL A 64 1.302 -8.335 9.059 1.00 0.00 C ATOM 0 H VAL A 64 1.943 -7.285 11.332 1.00 0.00 H new ATOM 0 HA VAL A 64 3.136 -6.135 9.038 1.00 0.00 H new ATOM 0 HB VAL A 64 0.206 -6.545 9.555 1.00 0.00 H new ATOM 0 HG11 VAL A 64 0.181 -6.992 7.060 1.00 0.00 H new ATOM 0 HG12 VAL A 64 0.799 -5.365 7.431 1.00 0.00 H new ATOM 0 HG13 VAL A 64 1.931 -6.672 7.012 1.00 0.00 H new ATOM 0 HG21 VAL A 64 0.462 -8.829 8.570 1.00 0.00 H new ATOM 0 HG22 VAL A 64 2.227 -8.602 8.549 1.00 0.00 H new ATOM 0 HG23 VAL A 64 1.356 -8.656 10.099 1.00 0.00 H new ATOM 1020 N LEU A 65 1.115 -4.187 10.827 1.00 0.00 N ATOM 1021 CA LEU A 65 0.683 -2.815 11.103 1.00 0.00 C ATOM 1022 C LEU A 65 1.892 -1.865 11.271 1.00 0.00 C ATOM 1023 O LEU A 65 2.008 -0.872 10.555 1.00 0.00 O ATOM 1024 CB LEU A 65 -0.244 -2.805 12.342 1.00 0.00 C ATOM 1025 CG LEU A 65 -1.431 -1.817 12.296 1.00 0.00 C ATOM 1026 CD1 LEU A 65 -1.943 -1.589 13.721 1.00 0.00 C ATOM 1027 CD2 LEU A 65 -1.124 -0.450 11.689 1.00 0.00 C ATOM 0 H LEU A 65 0.763 -4.860 11.508 1.00 0.00 H new ATOM 0 HA LEU A 65 0.118 -2.441 10.250 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -0.640 -3.811 12.482 1.00 0.00 H new ATOM 0 HB3 LEU A 65 0.360 -2.575 13.220 1.00 0.00 H new ATOM 0 HG LEU A 65 -2.167 -2.286 11.643 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -2.781 -0.893 13.699 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -2.270 -2.538 14.146 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -1.142 -1.174 14.333 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -2.023 0.165 11.705 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -0.340 0.038 12.269 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -0.789 -0.576 10.660 1.00 0.00 H new ATOM 1039 N VAL A 66 2.810 -2.171 12.199 1.00 0.00 N ATOM 1040 CA VAL A 66 3.974 -1.329 12.545 1.00 0.00 C ATOM 1041 C VAL A 66 5.032 -1.286 11.442 1.00 0.00 C ATOM 1042 O VAL A 66 5.635 -0.234 11.227 1.00 0.00 O ATOM 1043 CB VAL A 66 4.598 -1.688 13.910 1.00 0.00 C ATOM 1044 CG1 VAL A 66 3.533 -1.679 15.019 1.00 0.00 C ATOM 1045 CG2 VAL A 66 5.375 -3.010 13.921 1.00 0.00 C ATOM 0 H VAL A 66 2.766 -3.031 12.746 1.00 0.00 H new ATOM 0 HA VAL A 66 3.572 -0.320 12.638 1.00 0.00 H new ATOM 0 HB VAL A 66 5.335 -0.909 14.105 1.00 0.00 H new ATOM 0 HG11 VAL A 66 3.997 -1.935 15.971 1.00 0.00 H new ATOM 0 HG12 VAL A 66 3.088 -0.687 15.088 1.00 0.00 H new ATOM 0 HG13 VAL A 66 2.758 -2.409 14.785 1.00 0.00 H new ATOM 0 HG21 VAL A 66 5.780 -3.186 14.918 1.00 0.00 H new ATOM 0 HG22 VAL A 66 4.706 -3.827 13.652 1.00 0.00 H new ATOM 0 HG23 VAL A 66 6.192 -2.958 13.201 1.00 0.00 H new ATOM 1055 N ALA A 67 5.223 -2.382 10.700 1.00 0.00 N ATOM 1056 CA ALA A 67 6.066 -2.410 9.506 1.00 0.00 C ATOM 1057 C ALA A 67 5.526 -1.465 8.418 1.00 0.00 C ATOM 1058 O ALA A 67 6.260 -0.611 7.914 1.00 0.00 O ATOM 1059 CB ALA A 67 6.171 -3.853 8.997 1.00 0.00 C ATOM 0 H ALA A 67 4.792 -3.281 10.915 1.00 0.00 H new ATOM 0 HA ALA A 67 7.063 -2.053 9.764 1.00 0.00 H new ATOM 0 HB1 ALA A 67 6.799 -3.880 8.106 1.00 0.00 H new ATOM 0 HB2 ALA A 67 6.612 -4.481 9.771 1.00 0.00 H new ATOM 0 HB3 ALA A 67 5.176 -4.225 8.751 1.00 0.00 H new ATOM 1065 N ASP A 68 4.239 -1.580 8.078 1.00 0.00 N ATOM 1066 CA ASP A 68 3.592 -0.706 7.097 1.00 0.00 C ATOM 1067 C ASP A 68 3.553 0.763 7.559 1.00 0.00 C ATOM 1068 O ASP A 68 3.741 1.651 6.729 1.00 0.00 O ATOM 1069 CB ASP A 68 2.186 -1.217 6.750 1.00 0.00 C ATOM 1070 CG ASP A 68 2.157 -2.386 5.745 1.00 0.00 C ATOM 1071 OD1 ASP A 68 3.182 -3.075 5.523 1.00 0.00 O ATOM 1072 OD2 ASP A 68 1.084 -2.589 5.126 1.00 0.00 O ATOM 0 H ASP A 68 3.616 -2.283 8.476 1.00 0.00 H new ATOM 0 HA ASP A 68 4.199 -0.735 6.192 1.00 0.00 H new ATOM 0 HB2 ASP A 68 1.692 -1.533 7.669 1.00 0.00 H new ATOM 0 HB3 ASP A 68 1.604 -0.391 6.343 1.00 0.00 H new ATOM 1077 N LEU A 69 3.390 1.042 8.860 1.00 0.00 N ATOM 1078 CA LEU A 69 3.498 2.389 9.438 1.00 0.00 C ATOM 1079 C LEU A 69 4.859 3.034 9.156 1.00 0.00 C ATOM 1080 O LEU A 69 4.899 4.072 8.497 1.00 0.00 O ATOM 1081 CB LEU A 69 3.216 2.368 10.949 1.00 0.00 C ATOM 1082 CG LEU A 69 1.726 2.338 11.317 1.00 0.00 C ATOM 1083 CD1 LEU A 69 1.578 1.913 12.777 1.00 0.00 C ATOM 1084 CD2 LEU A 69 1.084 3.720 11.153 1.00 0.00 C ATOM 0 H LEU A 69 3.175 0.325 9.553 1.00 0.00 H new ATOM 0 HA LEU A 69 2.739 3.001 8.950 1.00 0.00 H new ATOM 0 HB2 LEU A 69 3.703 1.495 11.385 1.00 0.00 H new ATOM 0 HB3 LEU A 69 3.672 3.248 11.403 1.00 0.00 H new ATOM 0 HG LEU A 69 1.228 1.634 10.650 1.00 0.00 H new ATOM 0 HD11 LEU A 69 0.521 1.890 13.044 1.00 0.00 H new ATOM 0 HD12 LEU A 69 2.008 0.921 12.912 1.00 0.00 H new ATOM 0 HD13 LEU A 69 2.099 2.625 13.418 1.00 0.00 H new ATOM 0 HD21 LEU A 69 0.029 3.665 11.421 1.00 0.00 H new ATOM 0 HD22 LEU A 69 1.587 4.435 11.804 1.00 0.00 H new ATOM 0 HD23 LEU A 69 1.178 4.044 10.117 1.00 0.00 H new ATOM 1096 N VAL A 70 5.972 2.454 9.628 1.00 0.00 N ATOM 1097 CA VAL A 70 7.306 3.049 9.394 1.00 0.00 C ATOM 1098 C VAL A 70 7.640 3.152 7.899 1.00 0.00 C ATOM 1099 O VAL A 70 8.258 4.127 7.472 1.00 0.00 O ATOM 1100 CB VAL A 70 8.443 2.351 10.170 1.00 0.00 C ATOM 1101 CG1 VAL A 70 8.180 2.378 11.679 1.00 0.00 C ATOM 1102 CG2 VAL A 70 8.702 0.900 9.751 1.00 0.00 C ATOM 0 H VAL A 70 5.982 1.588 10.166 1.00 0.00 H new ATOM 0 HA VAL A 70 7.239 4.060 9.796 1.00 0.00 H new ATOM 0 HB VAL A 70 9.334 2.926 9.918 1.00 0.00 H new ATOM 0 HG11 VAL A 70 8.997 1.879 12.200 1.00 0.00 H new ATOM 0 HG12 VAL A 70 8.111 3.412 12.018 1.00 0.00 H new ATOM 0 HG13 VAL A 70 7.244 1.862 11.895 1.00 0.00 H new ATOM 0 HG21 VAL A 70 9.516 0.489 10.348 1.00 0.00 H new ATOM 0 HG22 VAL A 70 7.800 0.309 9.911 1.00 0.00 H new ATOM 0 HG23 VAL A 70 8.974 0.869 8.696 1.00 0.00 H new ATOM 1112 N ASN A 71 7.177 2.200 7.082 1.00 0.00 N ATOM 1113 CA ASN A 71 7.296 2.235 5.623 1.00 0.00 C ATOM 1114 C ASN A 71 6.531 3.417 4.989 1.00 0.00 C ATOM 1115 O ASN A 71 7.090 4.131 4.158 1.00 0.00 O ATOM 1116 CB ASN A 71 6.833 0.880 5.066 1.00 0.00 C ATOM 1117 CG ASN A 71 7.008 0.796 3.561 1.00 0.00 C ATOM 1118 OD1 ASN A 71 8.112 0.683 3.046 1.00 0.00 O ATOM 1119 ND2 ASN A 71 5.934 0.860 2.805 1.00 0.00 N ATOM 0 H ASN A 71 6.699 1.367 7.425 1.00 0.00 H new ATOM 0 HA ASN A 71 8.340 2.402 5.358 1.00 0.00 H new ATOM 0 HB2 ASN A 71 7.399 0.079 5.542 1.00 0.00 H new ATOM 0 HB3 ASN A 71 5.784 0.723 5.319 1.00 0.00 H new ATOM 0 HD21 ASN A 71 6.022 0.815 1.790 1.00 0.00 H new ATOM 0 HD22 ASN A 71 5.013 0.954 3.234 1.00 0.00 H new ATOM 1126 N ALA A 72 5.269 3.638 5.376 1.00 0.00 N ATOM 1127 CA ALA A 72 4.427 4.735 4.887 1.00 0.00 C ATOM 1128 C ALA A 72 4.859 6.123 5.411 1.00 0.00 C ATOM 1129 O ALA A 72 4.676 7.128 4.720 1.00 0.00 O ATOM 1130 CB ALA A 72 2.971 4.434 5.269 1.00 0.00 C ATOM 0 H ALA A 72 4.794 3.044 6.055 1.00 0.00 H new ATOM 0 HA ALA A 72 4.539 4.789 3.804 1.00 0.00 H new ATOM 0 HB1 ALA A 72 2.328 5.239 4.914 1.00 0.00 H new ATOM 0 HB2 ALA A 72 2.662 3.494 4.812 1.00 0.00 H new ATOM 0 HB3 ALA A 72 2.888 4.355 6.353 1.00 0.00 H new ATOM 1136 N GLN A 73 5.440 6.190 6.616 1.00 0.00 N ATOM 1137 CA GLN A 73 6.033 7.408 7.184 1.00 0.00 C ATOM 1138 C GLN A 73 7.317 7.835 6.458 1.00 0.00 C ATOM 1139 O GLN A 73 7.534 9.031 6.263 1.00 0.00 O ATOM 1140 CB GLN A 73 6.330 7.210 8.677 1.00 0.00 C ATOM 1141 CG GLN A 73 5.054 7.254 9.529 1.00 0.00 C ATOM 1142 CD GLN A 73 5.349 7.130 11.023 1.00 0.00 C ATOM 1143 OE1 GLN A 73 6.297 6.491 11.464 1.00 0.00 O ATOM 1144 NE2 GLN A 73 4.559 7.759 11.863 1.00 0.00 N ATOM 0 H GLN A 73 5.512 5.383 7.236 1.00 0.00 H new ATOM 0 HA GLN A 73 5.300 8.204 7.052 1.00 0.00 H new ATOM 0 HB2 GLN A 73 6.830 6.253 8.823 1.00 0.00 H new ATOM 0 HB3 GLN A 73 7.018 7.984 9.015 1.00 0.00 H new ATOM 0 HG2 GLN A 73 4.527 8.189 9.342 1.00 0.00 H new ATOM 0 HG3 GLN A 73 4.388 6.446 9.224 1.00 0.00 H new ATOM 0 HE21 GLN A 73 3.765 8.295 11.512 1.00 0.00 H new ATOM 0 HE22 GLN A 73 4.739 7.711 12.866 1.00 0.00 H new ATOM 1153 N LYS A 74 8.166 6.886 6.037 1.00 0.00 N ATOM 1154 CA LYS A 74 9.316 7.160 5.154 1.00 0.00 C ATOM 1155 C LYS A 74 8.866 7.659 3.772 1.00 0.00 C ATOM 1156 O LYS A 74 7.761 7.366 3.310 1.00 0.00 O ATOM 1157 CB LYS A 74 10.195 5.900 5.032 1.00 0.00 C ATOM 1158 CG LYS A 74 11.078 5.711 6.276 1.00 0.00 C ATOM 1159 CD LYS A 74 11.976 4.470 6.176 1.00 0.00 C ATOM 1160 CE LYS A 74 11.193 3.170 6.407 1.00 0.00 C ATOM 1161 NZ LYS A 74 12.056 1.970 6.229 1.00 0.00 N ATOM 0 H LYS A 74 8.077 5.904 6.298 1.00 0.00 H new ATOM 0 HA LYS A 74 9.907 7.959 5.602 1.00 0.00 H new ATOM 0 HB2 LYS A 74 9.561 5.024 4.897 1.00 0.00 H new ATOM 0 HB3 LYS A 74 10.824 5.978 4.145 1.00 0.00 H new ATOM 0 HG2 LYS A 74 11.700 6.595 6.414 1.00 0.00 H new ATOM 0 HG3 LYS A 74 10.444 5.627 7.158 1.00 0.00 H new ATOM 0 HD2 LYS A 74 12.444 4.440 5.192 1.00 0.00 H new ATOM 0 HD3 LYS A 74 12.779 4.544 6.909 1.00 0.00 H new ATOM 0 HE2 LYS A 74 10.774 3.171 7.413 1.00 0.00 H new ATOM 0 HE3 LYS A 74 10.354 3.122 5.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 11.494 1.111 6.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 12.436 1.956 5.261 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 12.842 2.004 6.909 1.00 0.00 H new ATOM 1175 N ASP A 75 9.752 8.396 3.096 1.00 0.00 N ATOM 1176 CA ASP A 75 9.555 8.994 1.760 1.00 0.00 C ATOM 1177 C ASP A 75 8.335 9.952 1.643 1.00 0.00 C ATOM 1178 O ASP A 75 7.864 10.257 0.544 1.00 0.00 O ATOM 1179 CB ASP A 75 9.574 7.875 0.690 1.00 0.00 C ATOM 1180 CG ASP A 75 10.408 8.224 -0.559 1.00 0.00 C ATOM 1181 OD1 ASP A 75 10.350 9.371 -1.064 1.00 0.00 O ATOM 1182 OD2 ASP A 75 11.142 7.334 -1.053 1.00 0.00 O ATOM 0 H ASP A 75 10.674 8.606 3.479 1.00 0.00 H new ATOM 0 HA ASP A 75 10.394 9.666 1.578 1.00 0.00 H new ATOM 0 HB2 ASP A 75 9.971 6.964 1.137 1.00 0.00 H new ATOM 0 HB3 ASP A 75 8.550 7.660 0.384 1.00 0.00 H new ATOM 1187 N SER A 76 7.794 10.426 2.772 1.00 0.00 N ATOM 1188 CA SER A 76 6.641 11.337 2.860 1.00 0.00 C ATOM 1189 C SER A 76 6.934 12.735 2.290 1.00 0.00 C ATOM 1190 O SER A 76 6.204 13.228 1.427 1.00 0.00 O ATOM 1191 CB SER A 76 6.187 11.450 4.324 1.00 0.00 C ATOM 1192 OG SER A 76 7.259 11.874 5.155 1.00 0.00 O ATOM 0 H SER A 76 8.162 10.176 3.690 1.00 0.00 H new ATOM 0 HA SER A 76 5.846 10.911 2.248 1.00 0.00 H new ATOM 0 HB2 SER A 76 5.361 12.157 4.399 1.00 0.00 H new ATOM 0 HB3 SER A 76 5.813 10.486 4.669 1.00 0.00 H new ATOM 0 HG SER A 76 7.597 11.111 5.668 1.00 0.00 H new ATOM 1198 N MET A 77 8.009 13.363 2.773 1.00 0.00 N ATOM 1199 CA MET A 77 8.490 14.713 2.453 1.00 0.00 C ATOM 1200 C MET A 77 10.022 14.730 2.304 1.00 0.00 C ATOM 1201 O MET A 77 10.716 13.796 2.720 1.00 0.00 O ATOM 1202 CB MET A 77 8.072 15.685 3.576 1.00 0.00 C ATOM 1203 CG MET A 77 6.555 15.901 3.695 1.00 0.00 C ATOM 1204 SD MET A 77 5.736 16.673 2.266 1.00 0.00 S ATOM 1205 CE MET A 77 6.513 18.312 2.266 1.00 0.00 C ATOM 0 H MET A 77 8.616 12.905 3.453 1.00 0.00 H new ATOM 0 HA MET A 77 8.048 15.023 1.506 1.00 0.00 H new ATOM 0 HB2 MET A 77 8.449 15.307 4.526 1.00 0.00 H new ATOM 0 HB3 MET A 77 8.552 16.648 3.404 1.00 0.00 H new ATOM 0 HG2 MET A 77 6.085 14.935 3.878 1.00 0.00 H new ATOM 0 HG3 MET A 77 6.365 16.519 4.573 1.00 0.00 H new ATOM 0 HE1 MET A 77 6.003 18.957 1.550 1.00 0.00 H new ATOM 0 HE2 MET A 77 6.442 18.748 3.262 1.00 0.00 H new ATOM 0 HE3 MET A 77 7.562 18.217 1.985 1.00 0.00 H new ATOM 1215 N GLN A 78 10.564 15.808 1.731 1.00 0.00 N ATOM 1216 CA GLN A 78 12.008 16.040 1.596 1.00 0.00 C ATOM 1217 C GLN A 78 12.673 16.321 2.959 1.00 0.00 C ATOM 1218 O GLN A 78 12.049 16.845 3.885 1.00 0.00 O ATOM 1219 CB GLN A 78 12.263 17.213 0.627 1.00 0.00 C ATOM 1220 CG GLN A 78 11.934 16.897 -0.845 1.00 0.00 C ATOM 1221 CD GLN A 78 10.446 16.677 -1.131 1.00 0.00 C ATOM 1222 OE1 GLN A 78 9.572 17.380 -0.642 1.00 0.00 O ATOM 1223 NE2 GLN A 78 10.089 15.673 -1.907 1.00 0.00 N ATOM 0 H GLN A 78 10.000 16.562 1.339 1.00 0.00 H new ATOM 0 HA GLN A 78 12.456 15.131 1.194 1.00 0.00 H new ATOM 0 HB2 GLN A 78 11.668 18.069 0.945 1.00 0.00 H new ATOM 0 HB3 GLN A 78 13.310 17.508 0.699 1.00 0.00 H new ATOM 0 HG2 GLN A 78 12.293 17.716 -1.468 1.00 0.00 H new ATOM 0 HG3 GLN A 78 12.484 16.004 -1.143 1.00 0.00 H new ATOM 0 HE21 GLN A 78 10.801 15.074 -2.325 1.00 0.00 H new ATOM 0 HE22 GLN A 78 9.101 15.495 -2.089 1.00 0.00 H new ATOM 1232 N ASP A 79 13.966 16.006 3.071 1.00 0.00 N ATOM 1233 CA ASP A 79 14.788 16.226 4.267 1.00 0.00 C ATOM 1234 C ASP A 79 15.260 17.692 4.360 1.00 0.00 C ATOM 1235 O ASP A 79 16.281 18.078 3.785 1.00 0.00 O ATOM 1236 CB ASP A 79 15.967 15.240 4.273 1.00 0.00 C ATOM 1237 CG ASP A 79 15.477 13.788 4.377 1.00 0.00 C ATOM 1238 OD1 ASP A 79 15.174 13.330 5.505 1.00 0.00 O ATOM 1239 OD2 ASP A 79 15.393 13.105 3.328 1.00 0.00 O ATOM 0 H ASP A 79 14.488 15.577 2.307 1.00 0.00 H new ATOM 0 HA ASP A 79 14.182 16.039 5.154 1.00 0.00 H new ATOM 0 HB2 ASP A 79 16.553 15.364 3.362 1.00 0.00 H new ATOM 0 HB3 ASP A 79 16.628 15.464 5.110 1.00 0.00 H new ATOM 1244 N GLU A 80 14.486 18.535 5.051 1.00 0.00 N ATOM 1245 CA GLU A 80 14.781 19.959 5.267 1.00 0.00 C ATOM 1246 C GLU A 80 15.933 20.160 6.278 1.00 0.00 C ATOM 1247 O GLU A 80 15.716 20.256 7.491 1.00 0.00 O ATOM 1248 CB GLU A 80 13.495 20.699 5.681 1.00 0.00 C ATOM 1249 CG GLU A 80 13.683 22.223 5.663 1.00 0.00 C ATOM 1250 CD GLU A 80 12.383 22.943 6.069 1.00 0.00 C ATOM 1251 OE1 GLU A 80 11.490 23.122 5.207 1.00 0.00 O ATOM 1252 OE2 GLU A 80 12.248 23.345 7.251 1.00 0.00 O ATOM 0 H GLU A 80 13.613 18.240 5.488 1.00 0.00 H new ATOM 0 HA GLU A 80 15.132 20.392 4.330 1.00 0.00 H new ATOM 0 HB2 GLU A 80 12.684 20.425 5.006 1.00 0.00 H new ATOM 0 HB3 GLU A 80 13.198 20.381 6.681 1.00 0.00 H new ATOM 0 HG2 GLU A 80 14.486 22.502 6.345 1.00 0.00 H new ATOM 0 HG3 GLU A 80 13.985 22.544 4.666 1.00 0.00 H new ATOM 1259 N SER A 81 17.168 20.222 5.771 1.00 0.00 N ATOM 1260 CA SER A 81 18.408 20.397 6.545 1.00 0.00 C ATOM 1261 C SER A 81 19.360 21.367 5.833 1.00 0.00 C ATOM 1262 O SER A 81 19.839 21.079 4.733 1.00 0.00 O ATOM 1263 CB SER A 81 19.114 19.047 6.760 1.00 0.00 C ATOM 1264 OG SER A 81 18.280 18.113 7.434 1.00 0.00 O ATOM 0 H SER A 81 17.342 20.149 4.769 1.00 0.00 H new ATOM 0 HA SER A 81 18.137 20.813 7.516 1.00 0.00 H new ATOM 0 HB2 SER A 81 19.413 18.636 5.796 1.00 0.00 H new ATOM 0 HB3 SER A 81 20.026 19.202 7.337 1.00 0.00 H new ATOM 0 HG SER A 81 18.763 17.268 7.550 1.00 0.00 H new ATOM 1270 N SER A 82 19.627 22.527 6.444 1.00 0.00 N ATOM 1271 CA SER A 82 20.601 23.511 5.943 1.00 0.00 C ATOM 1272 C SER A 82 22.010 22.902 5.855 1.00 0.00 C ATOM 1273 O SER A 82 22.503 22.316 6.824 1.00 0.00 O ATOM 1274 CB SER A 82 20.611 24.754 6.839 1.00 0.00 C ATOM 1275 OG SER A 82 21.424 25.763 6.259 1.00 0.00 O ATOM 0 H SER A 82 19.170 22.814 7.309 1.00 0.00 H new ATOM 0 HA SER A 82 20.298 23.804 4.938 1.00 0.00 H new ATOM 0 HB2 SER A 82 19.595 25.125 6.971 1.00 0.00 H new ATOM 0 HB3 SER A 82 20.988 24.496 7.829 1.00 0.00 H new ATOM 0 HG SER A 82 21.424 26.555 6.836 1.00 0.00 H new ATOM 1281 N GLN A 83 22.648 23.010 4.685 1.00 0.00 N ATOM 1282 CA GLN A 83 23.952 22.413 4.374 1.00 0.00 C ATOM 1283 C GLN A 83 24.789 23.350 3.481 1.00 0.00 C ATOM 1284 O GLN A 83 24.237 24.140 2.710 1.00 0.00 O ATOM 1285 CB GLN A 83 23.699 21.047 3.699 1.00 0.00 C ATOM 1286 CG GLN A 83 24.909 20.101 3.671 1.00 0.00 C ATOM 1287 CD GLN A 83 25.377 19.713 5.073 1.00 0.00 C ATOM 1288 OE1 GLN A 83 26.304 20.291 5.625 1.00 0.00 O ATOM 1289 NE2 GLN A 83 24.750 18.744 5.709 1.00 0.00 N ATOM 0 H GLN A 83 22.258 23.533 3.901 1.00 0.00 H new ATOM 0 HA GLN A 83 24.530 22.265 5.286 1.00 0.00 H new ATOM 0 HB2 GLN A 83 22.880 20.549 4.218 1.00 0.00 H new ATOM 0 HB3 GLN A 83 23.369 21.221 2.675 1.00 0.00 H new ATOM 0 HG2 GLN A 83 24.650 19.200 3.115 1.00 0.00 H new ATOM 0 HG3 GLN A 83 25.729 20.580 3.137 1.00 0.00 H new ATOM 0 HE21 GLN A 83 23.976 18.256 5.259 1.00 0.00 H new ATOM 0 HE22 GLN A 83 25.039 18.482 6.652 1.00 0.00 H new ATOM 1298 N THR A 84 26.121 23.252 3.554 1.00 0.00 N ATOM 1299 CA THR A 84 27.056 24.057 2.740 1.00 0.00 C ATOM 1300 C THR A 84 27.160 23.491 1.313 1.00 0.00 C ATOM 1301 O THR A 84 28.097 22.767 0.970 1.00 0.00 O ATOM 1302 CB THR A 84 28.434 24.186 3.426 1.00 0.00 C ATOM 1303 OG1 THR A 84 28.276 24.697 4.738 1.00 0.00 O ATOM 1304 CG2 THR A 84 29.367 25.173 2.718 1.00 0.00 C ATOM 0 H THR A 84 26.592 22.605 4.186 1.00 0.00 H new ATOM 0 HA THR A 84 26.657 25.068 2.658 1.00 0.00 H new ATOM 0 HB THR A 84 28.863 23.184 3.405 1.00 0.00 H new ATOM 0 HG1 THR A 84 29.154 24.774 5.167 1.00 0.00 H new ATOM 0 HG21 THR A 84 30.318 25.219 3.248 1.00 0.00 H new ATOM 0 HG22 THR A 84 29.538 24.841 1.694 1.00 0.00 H new ATOM 0 HG23 THR A 84 28.910 26.162 2.707 1.00 0.00 H new ATOM 1312 N SER A 85 26.156 23.789 0.482 1.00 0.00 N ATOM 1313 CA SER A 85 26.047 23.409 -0.937 1.00 0.00 C ATOM 1314 C SER A 85 25.168 24.412 -1.714 1.00 0.00 C ATOM 1315 O SER A 85 24.392 25.160 -1.111 1.00 0.00 O ATOM 1316 CB SER A 85 25.453 21.995 -1.028 1.00 0.00 C ATOM 1317 OG SER A 85 25.514 21.493 -2.355 1.00 0.00 O ATOM 0 H SER A 85 25.351 24.332 0.795 1.00 0.00 H new ATOM 0 HA SER A 85 27.039 23.423 -1.388 1.00 0.00 H new ATOM 0 HB2 SER A 85 25.995 21.327 -0.359 1.00 0.00 H new ATOM 0 HB3 SER A 85 24.417 22.011 -0.691 1.00 0.00 H new ATOM 0 HG SER A 85 25.131 20.591 -2.382 1.00 0.00 H new ATOM 1323 N LEU A 86 25.264 24.423 -3.049 1.00 0.00 N ATOM 1324 CA LEU A 86 24.531 25.323 -3.954 1.00 0.00 C ATOM 1325 C LEU A 86 23.490 24.533 -4.772 1.00 0.00 C ATOM 1326 O LEU A 86 23.724 24.170 -5.930 1.00 0.00 O ATOM 1327 CB LEU A 86 25.497 26.122 -4.859 1.00 0.00 C ATOM 1328 CG LEU A 86 26.556 26.977 -4.132 1.00 0.00 C ATOM 1329 CD1 LEU A 86 27.877 26.222 -3.942 1.00 0.00 C ATOM 1330 CD2 LEU A 86 26.873 28.231 -4.953 1.00 0.00 C ATOM 0 H LEU A 86 25.878 23.781 -3.550 1.00 0.00 H new ATOM 0 HA LEU A 86 23.992 26.054 -3.351 1.00 0.00 H new ATOM 0 HB2 LEU A 86 26.013 25.420 -5.514 1.00 0.00 H new ATOM 0 HB3 LEU A 86 24.906 26.778 -5.498 1.00 0.00 H new ATOM 0 HG LEU A 86 26.135 27.228 -3.159 1.00 0.00 H new ATOM 0 HD11 LEU A 86 28.592 26.863 -3.426 1.00 0.00 H new ATOM 0 HD12 LEU A 86 27.701 25.324 -3.349 1.00 0.00 H new ATOM 0 HD13 LEU A 86 28.279 25.941 -4.916 1.00 0.00 H new ATOM 0 HD21 LEU A 86 27.621 28.828 -4.431 1.00 0.00 H new ATOM 0 HD22 LEU A 86 27.258 27.939 -5.930 1.00 0.00 H new ATOM 0 HD23 LEU A 86 25.965 28.820 -5.083 1.00 0.00 H new ATOM 1342 N GLN A 87 22.345 24.222 -4.156 1.00 0.00 N ATOM 1343 CA GLN A 87 21.278 23.421 -4.775 1.00 0.00 C ATOM 1344 C GLN A 87 20.366 24.255 -5.706 1.00 0.00 C ATOM 1345 O GLN A 87 20.240 25.474 -5.548 1.00 0.00 O ATOM 1346 CB GLN A 87 20.465 22.723 -3.661 1.00 0.00 C ATOM 1347 CG GLN A 87 20.019 21.296 -4.028 1.00 0.00 C ATOM 1348 CD GLN A 87 21.203 20.344 -4.216 1.00 0.00 C ATOM 1349 OE1 GLN A 87 21.597 20.016 -5.327 1.00 0.00 O ATOM 1350 NE2 GLN A 87 21.827 19.884 -3.152 1.00 0.00 N ATOM 0 H GLN A 87 22.129 24.521 -3.205 1.00 0.00 H new ATOM 0 HA GLN A 87 21.741 22.671 -5.416 1.00 0.00 H new ATOM 0 HB2 GLN A 87 21.067 22.685 -2.753 1.00 0.00 H new ATOM 0 HB3 GLN A 87 19.584 23.324 -3.435 1.00 0.00 H new ATOM 0 HG2 GLN A 87 19.367 20.910 -3.245 1.00 0.00 H new ATOM 0 HG3 GLN A 87 19.432 21.327 -4.946 1.00 0.00 H new ATOM 0 HE21 GLN A 87 21.509 20.149 -2.220 1.00 0.00 H new ATOM 0 HE22 GLN A 87 22.628 19.262 -3.260 1.00 0.00 H new ATOM 1359 N LYS A 88 19.686 23.580 -6.646 1.00 0.00 N ATOM 1360 CA LYS A 88 18.775 24.160 -7.662 1.00 0.00 C ATOM 1361 C LYS A 88 17.303 23.716 -7.552 1.00 0.00 C ATOM 1362 O LYS A 88 16.447 24.263 -8.246 1.00 0.00 O ATOM 1363 CB LYS A 88 19.337 23.911 -9.080 1.00 0.00 C ATOM 1364 CG LYS A 88 19.782 22.459 -9.337 1.00 0.00 C ATOM 1365 CD LYS A 88 19.996 22.185 -10.835 1.00 0.00 C ATOM 1366 CE LYS A 88 20.913 20.979 -11.100 1.00 0.00 C ATOM 1367 NZ LYS A 88 20.414 19.716 -10.491 1.00 0.00 N ATOM 0 H LYS A 88 19.755 22.566 -6.728 1.00 0.00 H new ATOM 0 HA LYS A 88 18.746 25.230 -7.457 1.00 0.00 H new ATOM 0 HB2 LYS A 88 18.576 24.181 -9.813 1.00 0.00 H new ATOM 0 HB3 LYS A 88 20.187 24.574 -9.243 1.00 0.00 H new ATOM 0 HG2 LYS A 88 20.707 22.261 -8.795 1.00 0.00 H new ATOM 0 HG3 LYS A 88 19.030 21.774 -8.946 1.00 0.00 H new ATOM 0 HD2 LYS A 88 19.030 22.011 -11.309 1.00 0.00 H new ATOM 0 HD3 LYS A 88 20.425 23.071 -11.303 1.00 0.00 H new ATOM 0 HE2 LYS A 88 21.017 20.839 -12.176 1.00 0.00 H new ATOM 0 HE3 LYS A 88 21.908 21.195 -10.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 21.057 18.936 -10.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 20.373 19.822 -9.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 19.463 19.507 -10.856 1.00 0.00 H new ATOM 1381 N GLU A 89 16.993 22.764 -6.671 1.00 0.00 N ATOM 1382 CA GLU A 89 15.658 22.181 -6.460 1.00 0.00 C ATOM 1383 C GLU A 89 15.222 22.347 -4.993 1.00 0.00 C ATOM 1384 O GLU A 89 15.661 21.601 -4.113 1.00 0.00 O ATOM 1385 CB GLU A 89 15.655 20.697 -6.877 1.00 0.00 C ATOM 1386 CG GLU A 89 15.681 20.473 -8.397 1.00 0.00 C ATOM 1387 CD GLU A 89 14.366 20.909 -9.077 1.00 0.00 C ATOM 1388 OE1 GLU A 89 13.297 20.317 -8.783 1.00 0.00 O ATOM 1389 OE2 GLU A 89 14.388 21.833 -9.926 1.00 0.00 O ATOM 0 H GLU A 89 17.695 22.356 -6.054 1.00 0.00 H new ATOM 0 HA GLU A 89 14.939 22.712 -7.084 1.00 0.00 H new ATOM 0 HB2 GLU A 89 16.520 20.204 -6.433 1.00 0.00 H new ATOM 0 HB3 GLU A 89 14.768 20.217 -6.465 1.00 0.00 H new ATOM 0 HG2 GLU A 89 16.513 21.029 -8.830 1.00 0.00 H new ATOM 0 HG3 GLU A 89 15.861 19.418 -8.603 1.00 0.00 H new ATOM 1396 N ILE A 90 14.382 23.354 -4.719 1.00 0.00 N ATOM 1397 CA ILE A 90 13.833 23.657 -3.385 1.00 0.00 C ATOM 1398 C ILE A 90 12.436 24.300 -3.472 1.00 0.00 C ATOM 1399 O ILE A 90 12.148 25.068 -4.393 1.00 0.00 O ATOM 1400 CB ILE A 90 14.842 24.533 -2.597 1.00 0.00 C ATOM 1401 CG1 ILE A 90 14.444 24.636 -1.108 1.00 0.00 C ATOM 1402 CG2 ILE A 90 15.039 25.928 -3.223 1.00 0.00 C ATOM 1403 CD1 ILE A 90 15.591 25.107 -0.204 1.00 0.00 C ATOM 0 H ILE A 90 14.055 24.000 -5.437 1.00 0.00 H new ATOM 0 HA ILE A 90 13.694 22.723 -2.840 1.00 0.00 H new ATOM 0 HB ILE A 90 15.807 24.030 -2.659 1.00 0.00 H new ATOM 0 HG12 ILE A 90 13.606 25.327 -1.010 1.00 0.00 H new ATOM 0 HG13 ILE A 90 14.096 23.662 -0.764 1.00 0.00 H new ATOM 0 HG21 ILE A 90 15.755 26.496 -2.629 1.00 0.00 H new ATOM 0 HG22 ILE A 90 15.416 25.820 -4.240 1.00 0.00 H new ATOM 0 HG23 ILE A 90 14.085 26.456 -3.243 1.00 0.00 H new ATOM 0 HD11 ILE A 90 15.244 25.157 0.828 1.00 0.00 H new ATOM 0 HD12 ILE A 90 16.421 24.404 -0.274 1.00 0.00 H new ATOM 0 HD13 ILE A 90 15.924 26.095 -0.523 1.00 0.00 H new ATOM 1415 N SER A 91 11.565 24.012 -2.498 1.00 0.00 N ATOM 1416 CA SER A 91 10.208 24.577 -2.364 1.00 0.00 C ATOM 1417 C SER A 91 10.224 26.019 -1.826 1.00 0.00 C ATOM 1418 O SER A 91 9.722 26.306 -0.736 1.00 0.00 O ATOM 1419 CB SER A 91 9.345 23.671 -1.469 1.00 0.00 C ATOM 1420 OG SER A 91 9.216 22.374 -2.037 1.00 0.00 O ATOM 0 H SER A 91 11.790 23.355 -1.751 1.00 0.00 H new ATOM 0 HA SER A 91 9.770 24.618 -3.361 1.00 0.00 H new ATOM 0 HB2 SER A 91 9.795 23.596 -0.479 1.00 0.00 H new ATOM 0 HB3 SER A 91 8.358 24.115 -1.338 1.00 0.00 H new ATOM 0 HG SER A 91 8.665 21.814 -1.451 1.00 0.00 H new ATOM 1426 N THR A 92 10.795 26.952 -2.595 1.00 0.00 N ATOM 1427 CA THR A 92 10.880 28.382 -2.233 1.00 0.00 C ATOM 1428 C THR A 92 9.503 29.023 -1.994 1.00 0.00 C ATOM 1429 O THR A 92 9.346 29.852 -1.099 1.00 0.00 O ATOM 1430 CB THR A 92 11.704 29.162 -3.277 1.00 0.00 C ATOM 1431 OG1 THR A 92 12.025 30.444 -2.785 1.00 0.00 O ATOM 1432 CG2 THR A 92 11.012 29.339 -4.633 1.00 0.00 C ATOM 0 H THR A 92 11.218 26.739 -3.498 1.00 0.00 H new ATOM 0 HA THR A 92 11.402 28.438 -1.278 1.00 0.00 H new ATOM 0 HB THR A 92 12.593 28.554 -3.443 1.00 0.00 H new ATOM 0 HG1 THR A 92 12.549 30.930 -3.455 1.00 0.00 H new ATOM 0 HG21 THR A 92 11.664 29.898 -5.304 1.00 0.00 H new ATOM 0 HG22 THR A 92 10.801 28.360 -5.064 1.00 0.00 H new ATOM 0 HG23 THR A 92 10.078 29.884 -4.496 1.00 0.00 H new ATOM 1440 N GLU A 93 8.465 28.580 -2.714 1.00 0.00 N ATOM 1441 CA GLU A 93 7.079 29.052 -2.547 1.00 0.00 C ATOM 1442 C GLU A 93 6.504 28.749 -1.151 1.00 0.00 C ATOM 1443 O GLU A 93 5.732 29.541 -0.611 1.00 0.00 O ATOM 1444 CB GLU A 93 6.171 28.420 -3.616 1.00 0.00 C ATOM 1445 CG GLU A 93 6.578 28.797 -5.047 1.00 0.00 C ATOM 1446 CD GLU A 93 5.541 28.300 -6.076 1.00 0.00 C ATOM 1447 OE1 GLU A 93 5.332 27.068 -6.196 1.00 0.00 O ATOM 1448 OE2 GLU A 93 4.933 29.140 -6.786 1.00 0.00 O ATOM 0 H GLU A 93 8.563 27.872 -3.442 1.00 0.00 H new ATOM 0 HA GLU A 93 7.106 30.136 -2.662 1.00 0.00 H new ATOM 0 HB2 GLU A 93 6.196 27.335 -3.511 1.00 0.00 H new ATOM 0 HB3 GLU A 93 5.142 28.734 -3.442 1.00 0.00 H new ATOM 0 HG2 GLU A 93 6.680 29.879 -5.125 1.00 0.00 H new ATOM 0 HG3 GLU A 93 7.554 28.368 -5.275 1.00 0.00 H new ATOM 1455 N GLU A 94 6.893 27.624 -0.541 1.00 0.00 N ATOM 1456 CA GLU A 94 6.489 27.248 0.821 1.00 0.00 C ATOM 1457 C GLU A 94 7.211 28.109 1.875 1.00 0.00 C ATOM 1458 O GLU A 94 6.598 28.527 2.858 1.00 0.00 O ATOM 1459 CB GLU A 94 6.739 25.741 1.016 1.00 0.00 C ATOM 1460 CG GLU A 94 5.950 25.106 2.175 1.00 0.00 C ATOM 1461 CD GLU A 94 6.477 25.451 3.586 1.00 0.00 C ATOM 1462 OE1 GLU A 94 7.713 25.533 3.791 1.00 0.00 O ATOM 1463 OE2 GLU A 94 5.643 25.584 4.518 1.00 0.00 O ATOM 0 H GLU A 94 7.505 26.939 -0.984 1.00 0.00 H new ATOM 0 HA GLU A 94 5.425 27.440 0.957 1.00 0.00 H new ATOM 0 HB2 GLU A 94 6.484 25.221 0.092 1.00 0.00 H new ATOM 0 HB3 GLU A 94 7.803 25.582 1.188 1.00 0.00 H new ATOM 0 HG2 GLU A 94 4.910 25.423 2.104 1.00 0.00 H new ATOM 0 HG3 GLU A 94 5.962 24.023 2.053 1.00 0.00 H new ATOM 1470 N GLN A 95 8.483 28.457 1.642 1.00 0.00 N ATOM 1471 CA GLN A 95 9.258 29.356 2.509 1.00 0.00 C ATOM 1472 C GLN A 95 8.641 30.765 2.608 1.00 0.00 C ATOM 1473 O GLN A 95 8.639 31.346 3.695 1.00 0.00 O ATOM 1474 CB GLN A 95 10.722 29.429 2.037 1.00 0.00 C ATOM 1475 CG GLN A 95 11.492 28.106 2.201 1.00 0.00 C ATOM 1476 CD GLN A 95 11.872 27.836 3.657 1.00 0.00 C ATOM 1477 OE1 GLN A 95 12.880 28.312 4.163 1.00 0.00 O ATOM 1478 NE2 GLN A 95 11.092 27.073 4.395 1.00 0.00 N ATOM 0 H GLN A 95 9.010 28.119 0.837 1.00 0.00 H new ATOM 0 HA GLN A 95 9.230 28.934 3.513 1.00 0.00 H new ATOM 0 HB2 GLN A 95 10.742 29.723 0.988 1.00 0.00 H new ATOM 0 HB3 GLN A 95 11.236 30.210 2.597 1.00 0.00 H new ATOM 0 HG2 GLN A 95 10.882 27.284 1.828 1.00 0.00 H new ATOM 0 HG3 GLN A 95 12.395 28.135 1.591 1.00 0.00 H new ATOM 0 HE21 GLN A 95 10.247 26.667 3.993 1.00 0.00 H new ATOM 0 HE22 GLN A 95 11.333 26.889 5.369 1.00 0.00 H new ATOM 1487 N LEU A 96 8.041 31.296 1.532 1.00 0.00 N ATOM 1488 CA LEU A 96 7.329 32.590 1.555 1.00 0.00 C ATOM 1489 C LEU A 96 6.227 32.638 2.633 1.00 0.00 C ATOM 1490 O LEU A 96 6.046 33.662 3.298 1.00 0.00 O ATOM 1491 CB LEU A 96 6.712 32.908 0.178 1.00 0.00 C ATOM 1492 CG LEU A 96 7.682 32.985 -1.016 1.00 0.00 C ATOM 1493 CD1 LEU A 96 6.906 33.333 -2.287 1.00 0.00 C ATOM 1494 CD2 LEU A 96 8.786 34.025 -0.822 1.00 0.00 C ATOM 0 H LEU A 96 8.034 30.842 0.618 1.00 0.00 H new ATOM 0 HA LEU A 96 8.076 33.344 1.802 1.00 0.00 H new ATOM 0 HB2 LEU A 96 5.962 32.148 -0.042 1.00 0.00 H new ATOM 0 HB3 LEU A 96 6.188 33.861 0.252 1.00 0.00 H new ATOM 0 HG LEU A 96 8.156 32.007 -1.097 1.00 0.00 H new ATOM 0 HD11 LEU A 96 7.594 33.387 -3.130 1.00 0.00 H new ATOM 0 HD12 LEU A 96 6.157 32.564 -2.478 1.00 0.00 H new ATOM 0 HD13 LEU A 96 6.412 34.296 -2.160 1.00 0.00 H new ATOM 0 HD21 LEU A 96 9.437 34.032 -1.696 1.00 0.00 H new ATOM 0 HD22 LEU A 96 8.339 35.011 -0.695 1.00 0.00 H new ATOM 0 HD23 LEU A 96 9.370 33.775 0.063 1.00 0.00 H new ATOM 1506 N ARG A 97 5.519 31.520 2.845 1.00 0.00 N ATOM 1507 CA ARG A 97 4.473 31.372 3.871 1.00 0.00 C ATOM 1508 C ARG A 97 5.025 31.463 5.300 1.00 0.00 C ATOM 1509 O ARG A 97 4.337 31.980 6.182 1.00 0.00 O ATOM 1510 CB ARG A 97 3.721 30.049 3.633 1.00 0.00 C ATOM 1511 CG ARG A 97 2.345 30.029 4.316 1.00 0.00 C ATOM 1512 CD ARG A 97 1.613 28.719 4.006 1.00 0.00 C ATOM 1513 NE ARG A 97 0.233 28.738 4.527 1.00 0.00 N ATOM 1514 CZ ARG A 97 -0.652 27.758 4.471 1.00 0.00 C ATOM 1515 NH1 ARG A 97 -0.365 26.595 3.958 1.00 0.00 N ATOM 1516 NH2 ARG A 97 -1.858 27.931 4.933 1.00 0.00 N ATOM 0 H ARG A 97 5.660 30.672 2.296 1.00 0.00 H new ATOM 0 HA ARG A 97 3.778 32.207 3.776 1.00 0.00 H new ATOM 0 HB2 ARG A 97 3.595 29.893 2.562 1.00 0.00 H new ATOM 0 HB3 ARG A 97 4.322 29.220 4.007 1.00 0.00 H new ATOM 0 HG2 ARG A 97 2.465 30.139 5.394 1.00 0.00 H new ATOM 0 HG3 ARG A 97 1.750 30.875 3.973 1.00 0.00 H new ATOM 0 HD2 ARG A 97 1.595 28.557 2.928 1.00 0.00 H new ATOM 0 HD3 ARG A 97 2.158 27.883 4.445 1.00 0.00 H new ATOM 0 HE ARG A 97 -0.071 29.600 4.979 1.00 0.00 H new ATOM 0 HH11 ARG A 97 0.567 26.419 3.584 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -1.073 25.861 3.931 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -2.124 28.827 5.341 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -2.536 27.170 4.887 1.00 0.00 H new ATOM 1530 N ARG A 98 6.271 31.020 5.533 1.00 0.00 N ATOM 1531 CA ARG A 98 6.988 31.188 6.815 1.00 0.00 C ATOM 1532 C ARG A 98 7.358 32.650 7.062 1.00 0.00 C ATOM 1533 O ARG A 98 7.169 33.135 8.178 1.00 0.00 O ATOM 1534 CB ARG A 98 8.218 30.254 6.876 1.00 0.00 C ATOM 1535 CG ARG A 98 8.723 30.016 8.313 1.00 0.00 C ATOM 1536 CD ARG A 98 9.658 31.104 8.874 1.00 0.00 C ATOM 1537 NE ARG A 98 9.706 31.069 10.350 1.00 0.00 N ATOM 1538 CZ ARG A 98 8.826 31.567 11.209 1.00 0.00 C ATOM 1539 NH1 ARG A 98 7.773 32.244 10.843 1.00 0.00 N ATOM 1540 NH2 ARG A 98 8.993 31.380 12.488 1.00 0.00 N ATOM 0 H ARG A 98 6.820 30.527 4.828 1.00 0.00 H new ATOM 0 HA ARG A 98 6.317 30.898 7.623 1.00 0.00 H new ATOM 0 HB2 ARG A 98 7.963 29.296 6.423 1.00 0.00 H new ATOM 0 HB3 ARG A 98 9.023 30.684 6.280 1.00 0.00 H new ATOM 0 HG2 ARG A 98 7.860 29.927 8.973 1.00 0.00 H new ATOM 0 HG3 ARG A 98 9.247 29.061 8.342 1.00 0.00 H new ATOM 0 HD2 ARG A 98 10.662 30.964 8.473 1.00 0.00 H new ATOM 0 HD3 ARG A 98 9.316 32.085 8.543 1.00 0.00 H new ATOM 0 HE ARG A 98 10.516 30.604 10.760 1.00 0.00 H new ATOM 0 HH11 ARG A 98 7.594 32.413 9.853 1.00 0.00 H new ATOM 0 HH12 ARG A 98 7.128 32.604 11.547 1.00 0.00 H new ATOM 0 HH21 ARG A 98 9.798 30.852 12.825 1.00 0.00 H new ATOM 0 HH22 ARG A 98 8.319 31.761 13.152 1.00 0.00 H new ATOM 1554 N LEU A 99 7.885 33.343 6.048 1.00 0.00 N ATOM 1555 CA LEU A 99 8.273 34.761 6.124 1.00 0.00 C ATOM 1556 C LEU A 99 7.083 35.677 6.480 1.00 0.00 C ATOM 1557 O LEU A 99 7.231 36.588 7.299 1.00 0.00 O ATOM 1558 CB LEU A 99 8.930 35.205 4.795 1.00 0.00 C ATOM 1559 CG LEU A 99 10.461 35.045 4.670 1.00 0.00 C ATOM 1560 CD1 LEU A 99 11.220 35.927 5.664 1.00 0.00 C ATOM 1561 CD2 LEU A 99 10.948 33.607 4.833 1.00 0.00 C ATOM 0 H LEU A 99 8.059 32.929 5.132 1.00 0.00 H new ATOM 0 HA LEU A 99 8.998 34.859 6.932 1.00 0.00 H new ATOM 0 HB2 LEU A 99 8.465 34.642 3.985 1.00 0.00 H new ATOM 0 HB3 LEU A 99 8.687 36.255 4.634 1.00 0.00 H new ATOM 0 HG LEU A 99 10.676 35.364 3.650 1.00 0.00 H new ATOM 0 HD11 LEU A 99 12.292 35.779 5.537 1.00 0.00 H new ATOM 0 HD12 LEU A 99 10.974 36.973 5.483 1.00 0.00 H new ATOM 0 HD13 LEU A 99 10.935 35.658 6.681 1.00 0.00 H new ATOM 0 HD21 LEU A 99 12.033 33.577 4.732 1.00 0.00 H new ATOM 0 HD22 LEU A 99 10.665 33.236 5.818 1.00 0.00 H new ATOM 0 HD23 LEU A 99 10.495 32.980 4.065 1.00 0.00 H new ATOM 1573 N GLN A 100 5.908 35.447 5.884 1.00 0.00 N ATOM 1574 CA GLN A 100 4.690 36.239 6.109 1.00 0.00 C ATOM 1575 C GLN A 100 3.963 35.854 7.421 1.00 0.00 C ATOM 1576 O GLN A 100 2.943 35.161 7.421 1.00 0.00 O ATOM 1577 CB GLN A 100 3.792 36.140 4.858 1.00 0.00 C ATOM 1578 CG GLN A 100 2.649 37.172 4.846 1.00 0.00 C ATOM 1579 CD GLN A 100 3.143 38.621 4.801 1.00 0.00 C ATOM 1580 OE1 GLN A 100 3.969 39.008 3.984 1.00 0.00 O ATOM 1581 NE2 GLN A 100 2.673 39.480 5.682 1.00 0.00 N ATOM 0 H GLN A 100 5.773 34.688 5.216 1.00 0.00 H new ATOM 0 HA GLN A 100 4.964 37.284 6.252 1.00 0.00 H new ATOM 0 HB2 GLN A 100 4.405 36.277 3.967 1.00 0.00 H new ATOM 0 HB3 GLN A 100 3.368 35.137 4.802 1.00 0.00 H new ATOM 0 HG2 GLN A 100 2.010 36.986 3.983 1.00 0.00 H new ATOM 0 HG3 GLN A 100 2.033 37.033 5.735 1.00 0.00 H new ATOM 0 HE21 GLN A 100 1.984 39.178 6.371 1.00 0.00 H new ATOM 0 HE22 GLN A 100 2.998 40.447 5.675 1.00 0.00 H new ATOM 1590 N GLU A 101 4.485 36.314 8.560 1.00 0.00 N ATOM 1591 CA GLU A 101 3.916 36.105 9.902 1.00 0.00 C ATOM 1592 C GLU A 101 2.870 37.189 10.256 1.00 0.00 C ATOM 1593 O GLU A 101 3.214 38.294 10.684 1.00 0.00 O ATOM 1594 CB GLU A 101 5.067 36.046 10.926 1.00 0.00 C ATOM 1595 CG GLU A 101 4.639 35.522 12.306 1.00 0.00 C ATOM 1596 CD GLU A 101 4.395 33.999 12.275 1.00 0.00 C ATOM 1597 OE1 GLU A 101 5.386 33.224 12.308 1.00 0.00 O ATOM 1598 OE2 GLU A 101 3.216 33.574 12.206 1.00 0.00 O ATOM 0 H GLU A 101 5.345 36.862 8.579 1.00 0.00 H new ATOM 0 HA GLU A 101 3.378 35.158 9.924 1.00 0.00 H new ATOM 0 HB2 GLU A 101 5.858 35.407 10.534 1.00 0.00 H new ATOM 0 HB3 GLU A 101 5.491 37.044 11.041 1.00 0.00 H new ATOM 0 HG2 GLU A 101 5.410 35.754 13.041 1.00 0.00 H new ATOM 0 HG3 GLU A 101 3.730 36.032 12.625 1.00 0.00 H new ATOM 1605 N GLU A 102 1.580 36.902 10.051 1.00 0.00 N ATOM 1606 CA GLU A 102 0.460 37.785 10.437 1.00 0.00 C ATOM 1607 C GLU A 102 0.276 37.863 11.974 1.00 0.00 C ATOM 1608 O GLU A 102 0.623 36.929 12.705 1.00 0.00 O ATOM 1609 CB GLU A 102 -0.818 37.293 9.727 1.00 0.00 C ATOM 1610 CG GLU A 102 -1.980 38.296 9.787 1.00 0.00 C ATOM 1611 CD GLU A 102 -3.106 37.894 8.810 1.00 0.00 C ATOM 1612 OE1 GLU A 102 -3.934 37.013 9.145 1.00 0.00 O ATOM 1613 OE2 GLU A 102 -3.173 38.463 7.692 1.00 0.00 O ATOM 0 H GLU A 102 1.274 36.037 9.605 1.00 0.00 H new ATOM 0 HA GLU A 102 0.682 38.804 10.119 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -0.585 37.081 8.683 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -1.136 36.354 10.179 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -2.374 38.342 10.802 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -1.618 39.294 9.540 1.00 0.00 H new ATOM 1620 N LYS A 103 -0.282 38.976 12.484 1.00 0.00 N ATOM 1621 CA LYS A 103 -0.461 39.239 13.928 1.00 0.00 C ATOM 1622 C LYS A 103 -1.459 38.297 14.632 1.00 0.00 C ATOM 1623 O LYS A 103 -1.294 38.026 15.825 1.00 0.00 O ATOM 1624 CB LYS A 103 -0.844 40.722 14.125 1.00 0.00 C ATOM 1625 CG LYS A 103 -0.942 41.120 15.609 1.00 0.00 C ATOM 1626 CD LYS A 103 -1.069 42.640 15.801 1.00 0.00 C ATOM 1627 CE LYS A 103 -1.349 43.023 17.262 1.00 0.00 C ATOM 1628 NZ LYS A 103 -0.237 42.655 18.181 1.00 0.00 N ATOM 0 H LYS A 103 -0.628 39.733 11.895 1.00 0.00 H new ATOM 0 HA LYS A 103 0.493 39.027 14.412 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -0.104 41.352 13.632 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -1.800 40.913 13.638 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -1.804 40.627 16.059 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -0.058 40.762 16.137 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -0.149 43.123 15.471 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -1.872 43.018 15.169 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -1.524 44.097 17.324 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -2.264 42.531 17.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -0.481 42.937 19.152 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -0.084 41.627 18.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 0.633 43.144 17.887 1.00 0.00 H new ATOM 1642 N LEU A 104 -2.477 37.802 13.914 1.00 0.00 N ATOM 1643 CA LEU A 104 -3.596 36.984 14.430 1.00 0.00 C ATOM 1644 C LEU A 104 -3.618 35.539 13.889 1.00 0.00 C ATOM 1645 O LEU A 104 -3.020 35.271 12.822 1.00 0.00 O ATOM 1646 CB LEU A 104 -4.919 37.777 14.265 1.00 0.00 C ATOM 1647 CG LEU A 104 -5.433 38.008 12.827 1.00 0.00 C ATOM 1648 CD1 LEU A 104 -6.234 36.824 12.285 1.00 0.00 C ATOM 1649 CD2 LEU A 104 -6.367 39.219 12.817 1.00 0.00 C ATOM 1650 OXT LEU A 104 -4.216 34.671 14.565 1.00 0.00 O ATOM 0 H LEU A 104 -2.551 37.966 12.910 1.00 0.00 H new ATOM 0 HA LEU A 104 -3.450 36.815 15.497 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -5.697 37.254 14.821 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -4.789 38.751 14.737 1.00 0.00 H new ATOM 0 HG LEU A 104 -4.553 38.153 12.201 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -6.569 37.045 11.271 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -5.605 35.934 12.274 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -7.100 36.648 12.923 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -6.733 39.388 11.804 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -7.211 39.033 13.482 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -5.824 40.100 13.158 1.00 0.00 H new TER 1662 LEU A 104