USER MOD reduce.3.24.130724 H: found=0, std=0, add=721, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 720 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 64 SER OG : rot -91:sc= 0.569 USER MOD Set 1.2: A 65 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 48 TYR OH : rot -54:sc= 0.121! USER MOD Set 2.2: A 53 SER OG : rot 180:sc= 0.179 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 140:sc= -0.314 (180deg=-1.99!) USER MOD Single : A 4 THR OG1 : rot 56:sc= 0.124 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0.0626 USER MOD Single : A 9 GLN : amide:sc= 0.273 K(o=0.27,f=-0.74) USER MOD Single : A 13 SER OG : rot -108:sc= -1.51! USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 156:sc=-0.00919 (180deg=-0.756) USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 GLN : amide:sc= -1.2 K(o=-1.2,f=-3.4!) USER MOD Single : A 39 GLN : amide:sc= 0 K(o=0,f=-1.7!) USER MOD Single : A 40 TYR OH : rot -15:sc= -0.59 USER MOD Single : A 41 CYS SG : rot 78:sc= -0.194 USER MOD Single : A 43 LYS NZ :NH3+ -158:sc= -0.042 (180deg=-0.694) USER MOD Single : A 45 MET CE :methyl -145:sc= -5.87! (180deg=-13.1!) USER MOD Single : A 49 SER OG : rot -175:sc= -0.628 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot -9:sc= 0.62 USER MOD Single : B 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 THR OG1 : rot 180:sc= 0.0132 USER MOD Single : B 22 GLN : amide:sc= -0.11 K(o=-0.11,f=-4.1!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -4.942 -2.769 -2.841 1.00 0.00 N ATOM 2 CA MET A 1 -4.673 -1.503 -2.099 1.00 0.00 C ATOM 3 C MET A 1 -4.714 -1.755 -0.590 1.00 0.00 C ATOM 4 O MET A 1 -5.193 -0.938 0.172 1.00 0.00 O ATOM 5 CB MET A 1 -5.797 -0.554 -2.517 1.00 0.00 C ATOM 6 CG MET A 1 -7.149 -1.173 -2.155 1.00 0.00 C ATOM 7 SD MET A 1 -8.264 -1.053 -3.575 1.00 0.00 S ATOM 8 CE MET A 1 -9.419 -2.351 -3.066 1.00 0.00 C ATOM 0 H1 MET A 1 -5.550 -2.569 -3.660 1.00 0.00 H new ATOM 0 H2 MET A 1 -4.043 -3.177 -3.168 1.00 0.00 H new ATOM 0 H3 MET A 1 -5.420 -3.445 -2.212 1.00 0.00 H new ATOM 0 HA MET A 1 -3.689 -1.093 -2.324 1.00 0.00 H new ATOM 0 HB2 MET A 1 -5.680 0.408 -2.017 1.00 0.00 H new ATOM 0 HB3 MET A 1 -5.747 -0.364 -3.589 1.00 0.00 H new ATOM 0 HG2 MET A 1 -7.019 -2.216 -1.868 1.00 0.00 H new ATOM 0 HG3 MET A 1 -7.579 -0.658 -1.296 1.00 0.00 H new ATOM 0 HE1 MET A 1 -10.207 -2.450 -3.813 1.00 0.00 H new ATOM 0 HE2 MET A 1 -8.885 -3.297 -2.973 1.00 0.00 H new ATOM 0 HE3 MET A 1 -9.861 -2.088 -2.105 1.00 0.00 H new ATOM 18 N ALA A 2 -4.216 -2.879 -0.153 1.00 0.00 N ATOM 19 CA ALA A 2 -4.228 -3.182 1.308 1.00 0.00 C ATOM 20 C ALA A 2 -2.917 -3.860 1.718 1.00 0.00 C ATOM 21 O ALA A 2 -2.712 -5.033 1.476 1.00 0.00 O ATOM 22 CB ALA A 2 -5.408 -4.133 1.505 1.00 0.00 C ATOM 0 H ALA A 2 -3.802 -3.601 -0.743 1.00 0.00 H new ATOM 0 HA ALA A 2 -4.324 -2.282 1.916 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -5.485 -4.404 2.558 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -6.328 -3.642 1.189 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -5.254 -5.033 0.909 1.00 0.00 H new ATOM 28 N ASP A 3 -2.029 -3.131 2.336 1.00 0.00 N ATOM 29 CA ASP A 3 -0.732 -3.735 2.761 1.00 0.00 C ATOM 30 C ASP A 3 -0.541 -3.570 4.271 1.00 0.00 C ATOM 31 O ASP A 3 0.569 -3.507 4.763 1.00 0.00 O ATOM 32 CB ASP A 3 0.337 -2.955 1.996 1.00 0.00 C ATOM 33 CG ASP A 3 1.548 -3.857 1.747 1.00 0.00 C ATOM 34 OD1 ASP A 3 1.778 -4.743 2.554 1.00 0.00 O ATOM 35 OD2 ASP A 3 2.224 -3.647 0.754 1.00 0.00 O ATOM 0 H ASP A 3 -2.144 -2.144 2.566 1.00 0.00 H new ATOM 0 HA ASP A 3 -0.685 -4.804 2.551 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -0.066 -2.600 1.048 1.00 0.00 H new ATOM 0 HB3 ASP A 3 0.637 -2.075 2.565 1.00 0.00 H new ATOM 40 N THR A 4 -1.614 -3.497 5.010 1.00 0.00 N ATOM 41 CA THR A 4 -1.493 -3.333 6.488 1.00 0.00 C ATOM 42 C THR A 4 -1.474 -4.703 7.174 1.00 0.00 C ATOM 43 O THR A 4 -2.470 -5.157 7.703 1.00 0.00 O ATOM 44 CB THR A 4 -2.735 -2.543 6.902 1.00 0.00 C ATOM 45 OG1 THR A 4 -3.860 -3.014 6.172 1.00 0.00 O ATOM 46 CG2 THR A 4 -2.519 -1.058 6.607 1.00 0.00 C ATOM 0 H THR A 4 -2.569 -3.544 4.655 1.00 0.00 H new ATOM 0 HA THR A 4 -0.572 -2.824 6.772 1.00 0.00 H new ATOM 0 HB THR A 4 -2.912 -2.677 7.969 1.00 0.00 H new ATOM 0 HG1 THR A 4 -3.963 -3.978 6.316 1.00 0.00 H new ATOM 0 HG21 THR A 4 -3.405 -0.496 6.902 1.00 0.00 H new ATOM 0 HG22 THR A 4 -1.657 -0.697 7.168 1.00 0.00 H new ATOM 0 HG23 THR A 4 -2.341 -0.921 5.540 1.00 0.00 H new ATOM 54 N ASP A 5 -0.349 -5.364 7.170 1.00 0.00 N ATOM 55 CA ASP A 5 -0.268 -6.703 7.825 1.00 0.00 C ATOM 56 C ASP A 5 0.982 -6.787 8.705 1.00 0.00 C ATOM 57 O ASP A 5 1.769 -5.864 8.773 1.00 0.00 O ATOM 58 CB ASP A 5 -0.181 -7.702 6.671 1.00 0.00 C ATOM 59 CG ASP A 5 -1.061 -8.915 6.978 1.00 0.00 C ATOM 60 OD1 ASP A 5 -0.658 -9.722 7.799 1.00 0.00 O ATOM 61 OD2 ASP A 5 -2.123 -9.017 6.386 1.00 0.00 O ATOM 0 H ASP A 5 0.517 -5.036 6.742 1.00 0.00 H new ATOM 0 HA ASP A 5 -1.123 -6.900 8.471 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -0.504 -7.231 5.743 1.00 0.00 H new ATOM 0 HB3 ASP A 5 0.852 -8.017 6.526 1.00 0.00 H new ATOM 66 N THR A 6 1.171 -7.888 9.379 1.00 0.00 N ATOM 67 CA THR A 6 2.370 -8.030 10.257 1.00 0.00 C ATOM 68 C THR A 6 3.360 -9.024 9.643 1.00 0.00 C ATOM 69 O THR A 6 4.449 -8.663 9.243 1.00 0.00 O ATOM 70 CB THR A 6 1.831 -8.562 11.587 1.00 0.00 C ATOM 71 OG1 THR A 6 0.500 -9.024 11.409 1.00 0.00 O ATOM 72 CG2 THR A 6 1.851 -7.444 12.631 1.00 0.00 C ATOM 0 H THR A 6 0.548 -8.696 9.361 1.00 0.00 H new ATOM 0 HA THR A 6 2.902 -7.087 10.383 1.00 0.00 H new ATOM 0 HB THR A 6 2.457 -9.386 11.928 1.00 0.00 H new ATOM 0 HG1 THR A 6 0.156 -9.366 12.260 1.00 0.00 H new ATOM 0 HG21 THR A 6 1.467 -7.824 13.578 1.00 0.00 H new ATOM 0 HG22 THR A 6 2.874 -7.093 12.769 1.00 0.00 H new ATOM 0 HG23 THR A 6 1.227 -6.618 12.291 1.00 0.00 H new ATOM 80 N ALA A 7 2.991 -10.274 9.564 1.00 0.00 N ATOM 81 CA ALA A 7 3.911 -11.288 8.974 1.00 0.00 C ATOM 82 C ALA A 7 4.145 -10.979 7.494 1.00 0.00 C ATOM 83 O ALA A 7 5.265 -10.961 7.021 1.00 0.00 O ATOM 84 CB ALA A 7 3.186 -12.624 9.136 1.00 0.00 C ATOM 0 H ALA A 7 2.092 -10.637 9.882 1.00 0.00 H new ATOM 0 HA ALA A 7 4.887 -11.296 9.458 1.00 0.00 H new ATOM 0 HB1 ALA A 7 3.801 -13.424 8.724 1.00 0.00 H new ATOM 0 HB2 ALA A 7 3.005 -12.814 10.194 1.00 0.00 H new ATOM 0 HB3 ALA A 7 2.234 -12.588 8.606 1.00 0.00 H new ATOM 90 N GLU A 8 3.095 -10.728 6.764 1.00 0.00 N ATOM 91 CA GLU A 8 3.249 -10.410 5.317 1.00 0.00 C ATOM 92 C GLU A 8 4.220 -9.240 5.139 1.00 0.00 C ATOM 93 O GLU A 8 4.982 -9.191 4.195 1.00 0.00 O ATOM 94 CB GLU A 8 1.847 -10.024 4.844 1.00 0.00 C ATOM 95 CG GLU A 8 1.694 -10.373 3.362 1.00 0.00 C ATOM 96 CD GLU A 8 0.416 -11.186 3.156 1.00 0.00 C ATOM 97 OE1 GLU A 8 -0.497 -11.030 3.951 1.00 0.00 O ATOM 98 OE2 GLU A 8 0.370 -11.952 2.208 1.00 0.00 O ATOM 0 H GLU A 8 2.135 -10.729 7.107 1.00 0.00 H new ATOM 0 HA GLU A 8 3.652 -11.248 4.748 1.00 0.00 H new ATOM 0 HB2 GLU A 8 1.095 -10.551 5.432 1.00 0.00 H new ATOM 0 HB3 GLU A 8 1.681 -8.958 4.996 1.00 0.00 H new ATOM 0 HG2 GLU A 8 1.657 -9.462 2.765 1.00 0.00 H new ATOM 0 HG3 GLU A 8 2.558 -10.943 3.021 1.00 0.00 H new ATOM 105 N GLN A 9 4.191 -8.294 6.039 1.00 0.00 N ATOM 106 CA GLN A 9 5.108 -7.123 5.919 1.00 0.00 C ATOM 107 C GLN A 9 6.569 -7.582 5.972 1.00 0.00 C ATOM 108 O GLN A 9 7.393 -7.147 5.194 1.00 0.00 O ATOM 109 CB GLN A 9 4.783 -6.241 7.125 1.00 0.00 C ATOM 110 CG GLN A 9 4.937 -4.769 6.738 1.00 0.00 C ATOM 111 CD GLN A 9 3.590 -4.060 6.885 1.00 0.00 C ATOM 112 OE1 GLN A 9 3.360 -3.362 7.853 1.00 0.00 O ATOM 113 NE2 GLN A 9 2.683 -4.208 5.958 1.00 0.00 N ATOM 0 H GLN A 9 3.573 -8.281 6.851 1.00 0.00 H new ATOM 0 HA GLN A 9 4.976 -6.593 4.976 1.00 0.00 H new ATOM 0 HB2 GLN A 9 3.766 -6.434 7.466 1.00 0.00 H new ATOM 0 HB3 GLN A 9 5.448 -6.481 7.954 1.00 0.00 H new ATOM 0 HG2 GLN A 9 5.683 -4.291 7.373 1.00 0.00 H new ATOM 0 HG3 GLN A 9 5.293 -4.687 5.711 1.00 0.00 H new ATOM 0 HE21 GLN A 9 2.875 -4.794 5.145 1.00 0.00 H new ATOM 0 HE22 GLN A 9 1.782 -3.738 6.046 1.00 0.00 H new ATOM 122 N VAL A 10 6.894 -8.458 6.883 1.00 0.00 N ATOM 123 CA VAL A 10 8.302 -8.940 6.980 1.00 0.00 C ATOM 124 C VAL A 10 8.735 -9.565 5.650 1.00 0.00 C ATOM 125 O VAL A 10 9.837 -9.355 5.185 1.00 0.00 O ATOM 126 CB VAL A 10 8.284 -9.992 8.090 1.00 0.00 C ATOM 127 CG1 VAL A 10 9.663 -10.646 8.198 1.00 0.00 C ATOM 128 CG2 VAL A 10 7.933 -9.321 9.421 1.00 0.00 C ATOM 0 H VAL A 10 6.248 -8.860 7.563 1.00 0.00 H new ATOM 0 HA VAL A 10 9.004 -8.135 7.196 1.00 0.00 H new ATOM 0 HB VAL A 10 7.539 -10.753 7.857 1.00 0.00 H new ATOM 0 HG11 VAL A 10 9.649 -11.396 8.989 1.00 0.00 H new ATOM 0 HG12 VAL A 10 9.915 -11.123 7.251 1.00 0.00 H new ATOM 0 HG13 VAL A 10 10.409 -9.886 8.431 1.00 0.00 H new ATOM 0 HG21 VAL A 10 7.920 -10.069 10.213 1.00 0.00 H new ATOM 0 HG22 VAL A 10 8.679 -8.560 9.653 1.00 0.00 H new ATOM 0 HG23 VAL A 10 6.951 -8.855 9.346 1.00 0.00 H new ATOM 138 N ILE A 11 7.871 -10.323 5.033 1.00 0.00 N ATOM 139 CA ILE A 11 8.229 -10.954 3.731 1.00 0.00 C ATOM 140 C ILE A 11 8.472 -9.868 2.683 1.00 0.00 C ATOM 141 O ILE A 11 9.481 -9.860 2.005 1.00 0.00 O ATOM 142 CB ILE A 11 7.014 -11.801 3.352 1.00 0.00 C ATOM 143 CG1 ILE A 11 6.893 -12.980 4.321 1.00 0.00 C ATOM 144 CG2 ILE A 11 7.184 -12.329 1.928 1.00 0.00 C ATOM 145 CD1 ILE A 11 5.669 -13.819 3.953 1.00 0.00 C ATOM 0 H ILE A 11 6.933 -10.533 5.374 1.00 0.00 H new ATOM 0 HA ILE A 11 9.136 -11.555 3.793 1.00 0.00 H new ATOM 0 HB ILE A 11 6.113 -11.189 3.407 1.00 0.00 H new ATOM 0 HG12 ILE A 11 7.793 -13.593 4.279 1.00 0.00 H new ATOM 0 HG13 ILE A 11 6.803 -12.616 5.344 1.00 0.00 H new ATOM 0 HG21 ILE A 11 6.318 -12.933 1.658 1.00 0.00 H new ATOM 0 HG22 ILE A 11 7.271 -11.491 1.237 1.00 0.00 H new ATOM 0 HG23 ILE A 11 8.084 -12.941 1.872 1.00 0.00 H new ATOM 0 HD11 ILE A 11 5.583 -14.659 4.643 1.00 0.00 H new ATOM 0 HD12 ILE A 11 4.772 -13.202 4.018 1.00 0.00 H new ATOM 0 HD13 ILE A 11 5.778 -14.195 2.936 1.00 0.00 H new ATOM 157 N ALA A 12 7.563 -8.939 2.557 1.00 0.00 N ATOM 158 CA ALA A 12 7.755 -7.847 1.565 1.00 0.00 C ATOM 159 C ALA A 12 9.043 -7.095 1.895 1.00 0.00 C ATOM 160 O ALA A 12 9.828 -6.771 1.027 1.00 0.00 O ATOM 161 CB ALA A 12 6.537 -6.938 1.730 1.00 0.00 C ATOM 0 H ALA A 12 6.699 -8.890 3.097 1.00 0.00 H new ATOM 0 HA ALA A 12 7.840 -8.212 0.541 1.00 0.00 H new ATOM 0 HB1 ALA A 12 6.606 -6.106 1.029 1.00 0.00 H new ATOM 0 HB2 ALA A 12 5.629 -7.506 1.529 1.00 0.00 H new ATOM 0 HB3 ALA A 12 6.506 -6.553 2.749 1.00 0.00 H new ATOM 167 N SER A 13 9.274 -6.832 3.154 1.00 0.00 N ATOM 168 CA SER A 13 10.521 -6.121 3.548 1.00 0.00 C ATOM 169 C SER A 13 11.729 -6.991 3.203 1.00 0.00 C ATOM 170 O SER A 13 12.744 -6.509 2.739 1.00 0.00 O ATOM 171 CB SER A 13 10.411 -5.924 5.059 1.00 0.00 C ATOM 172 OG SER A 13 10.556 -4.543 5.364 1.00 0.00 O ATOM 0 H SER A 13 8.653 -7.079 3.924 1.00 0.00 H new ATOM 0 HA SER A 13 10.645 -5.169 3.031 1.00 0.00 H new ATOM 0 HB2 SER A 13 9.447 -6.288 5.416 1.00 0.00 H new ATOM 0 HB3 SER A 13 11.180 -6.504 5.570 1.00 0.00 H new ATOM 0 HG SER A 13 11.423 -4.392 5.795 1.00 0.00 H new ATOM 178 N PHE A 14 11.622 -8.277 3.413 1.00 0.00 N ATOM 179 CA PHE A 14 12.761 -9.179 3.081 1.00 0.00 C ATOM 180 C PHE A 14 12.949 -9.227 1.565 1.00 0.00 C ATOM 181 O PHE A 14 14.056 -9.178 1.064 1.00 0.00 O ATOM 182 CB PHE A 14 12.356 -10.550 3.623 1.00 0.00 C ATOM 183 CG PHE A 14 12.971 -10.751 4.988 1.00 0.00 C ATOM 184 CD1 PHE A 14 14.363 -10.762 5.132 1.00 0.00 C ATOM 185 CD2 PHE A 14 12.150 -10.925 6.110 1.00 0.00 C ATOM 186 CE1 PHE A 14 14.935 -10.946 6.396 1.00 0.00 C ATOM 187 CE2 PHE A 14 12.722 -11.109 7.374 1.00 0.00 C ATOM 188 CZ PHE A 14 14.115 -11.119 7.517 1.00 0.00 C ATOM 0 H PHE A 14 10.798 -8.739 3.798 1.00 0.00 H new ATOM 0 HA PHE A 14 13.704 -8.843 3.512 1.00 0.00 H new ATOM 0 HB2 PHE A 14 11.270 -10.622 3.687 1.00 0.00 H new ATOM 0 HB3 PHE A 14 12.688 -11.335 2.943 1.00 0.00 H new ATOM 0 HD1 PHE A 14 14.996 -10.628 4.267 1.00 0.00 H new ATOM 0 HD2 PHE A 14 11.076 -10.917 5.999 1.00 0.00 H new ATOM 0 HE1 PHE A 14 16.009 -10.954 6.506 1.00 0.00 H new ATOM 0 HE2 PHE A 14 12.089 -11.243 8.239 1.00 0.00 H new ATOM 0 HZ PHE A 14 14.557 -11.260 8.492 1.00 0.00 H new ATOM 198 N ARG A 15 11.876 -9.307 0.826 1.00 0.00 N ATOM 199 CA ARG A 15 12.000 -9.339 -0.657 1.00 0.00 C ATOM 200 C ARG A 15 12.781 -8.111 -1.129 1.00 0.00 C ATOM 201 O ARG A 15 13.623 -8.194 -2.001 1.00 0.00 O ATOM 202 CB ARG A 15 10.564 -9.300 -1.181 1.00 0.00 C ATOM 203 CG ARG A 15 10.581 -9.183 -2.706 1.00 0.00 C ATOM 204 CD ARG A 15 10.164 -7.769 -3.114 1.00 0.00 C ATOM 205 NE ARG A 15 8.705 -7.865 -3.398 1.00 0.00 N ATOM 206 CZ ARG A 15 7.989 -6.781 -3.529 1.00 0.00 C ATOM 207 NH1 ARG A 15 8.549 -5.606 -3.413 1.00 0.00 N ATOM 208 NH2 ARG A 15 6.711 -6.871 -3.774 1.00 0.00 N ATOM 0 H ARG A 15 10.922 -9.351 1.185 1.00 0.00 H new ATOM 0 HA ARG A 15 12.531 -10.221 -1.015 1.00 0.00 H new ATOM 0 HB2 ARG A 15 10.031 -10.202 -0.881 1.00 0.00 H new ATOM 0 HB3 ARG A 15 10.030 -8.455 -0.747 1.00 0.00 H new ATOM 0 HG2 ARG A 15 11.578 -9.404 -3.087 1.00 0.00 H new ATOM 0 HG3 ARG A 15 9.903 -9.915 -3.145 1.00 0.00 H new ATOM 0 HD2 ARG A 15 10.365 -7.053 -2.317 1.00 0.00 H new ATOM 0 HD3 ARG A 15 10.716 -7.432 -3.992 1.00 0.00 H new ATOM 0 HE ARG A 15 8.264 -8.780 -3.490 1.00 0.00 H new ATOM 0 HH11 ARG A 15 9.548 -5.534 -3.220 1.00 0.00 H new ATOM 0 HH12 ARG A 15 7.987 -4.761 -3.516 1.00 0.00 H new ATOM 0 HH21 ARG A 15 6.272 -7.787 -3.863 1.00 0.00 H new ATOM 0 HH22 ARG A 15 6.151 -6.025 -3.877 1.00 0.00 H new ATOM 222 N ILE A 16 12.513 -6.973 -0.549 1.00 0.00 N ATOM 223 CA ILE A 16 13.246 -5.740 -0.951 1.00 0.00 C ATOM 224 C ILE A 16 14.745 -5.926 -0.703 1.00 0.00 C ATOM 225 O ILE A 16 15.568 -5.599 -1.535 1.00 0.00 O ATOM 226 CB ILE A 16 12.683 -4.635 -0.058 1.00 0.00 C ATOM 227 CG1 ILE A 16 11.204 -4.418 -0.390 1.00 0.00 C ATOM 228 CG2 ILE A 16 13.455 -3.338 -0.305 1.00 0.00 C ATOM 229 CD1 ILE A 16 10.576 -3.492 0.652 1.00 0.00 C ATOM 0 H ILE A 16 11.818 -6.844 0.186 1.00 0.00 H new ATOM 0 HA ILE A 16 13.122 -5.505 -2.008 1.00 0.00 H new ATOM 0 HB ILE A 16 12.784 -4.925 0.988 1.00 0.00 H new ATOM 0 HG12 ILE A 16 11.104 -3.984 -1.385 1.00 0.00 H new ATOM 0 HG13 ILE A 16 10.680 -5.374 -0.405 1.00 0.00 H new ATOM 0 HG21 ILE A 16 13.054 -2.549 0.331 1.00 0.00 H new ATOM 0 HG22 ILE A 16 14.509 -3.492 -0.072 1.00 0.00 H new ATOM 0 HG23 ILE A 16 13.353 -3.047 -1.351 1.00 0.00 H new ATOM 0 HD11 ILE A 16 9.523 -3.338 0.415 1.00 0.00 H new ATOM 0 HD12 ILE A 16 10.663 -3.944 1.640 1.00 0.00 H new ATOM 0 HD13 ILE A 16 11.093 -2.533 0.645 1.00 0.00 H new ATOM 241 N LEU A 17 15.104 -6.459 0.434 1.00 0.00 N ATOM 242 CA LEU A 17 16.549 -6.675 0.730 1.00 0.00 C ATOM 243 C LEU A 17 17.123 -7.701 -0.246 1.00 0.00 C ATOM 244 O LEU A 17 18.214 -7.549 -0.757 1.00 0.00 O ATOM 245 CB LEU A 17 16.587 -7.220 2.158 1.00 0.00 C ATOM 246 CG LEU A 17 15.926 -6.219 3.105 1.00 0.00 C ATOM 247 CD1 LEU A 17 16.075 -6.704 4.550 1.00 0.00 C ATOM 248 CD2 LEU A 17 16.601 -4.854 2.952 1.00 0.00 C ATOM 0 H LEU A 17 14.461 -6.753 1.169 1.00 0.00 H new ATOM 0 HA LEU A 17 17.137 -5.763 0.630 1.00 0.00 H new ATOM 0 HB2 LEU A 17 16.070 -8.178 2.206 1.00 0.00 H new ATOM 0 HB3 LEU A 17 17.618 -7.399 2.463 1.00 0.00 H new ATOM 0 HG LEU A 17 14.867 -6.132 2.861 1.00 0.00 H new ATOM 0 HD11 LEU A 17 15.603 -5.989 5.224 1.00 0.00 H new ATOM 0 HD12 LEU A 17 15.595 -7.677 4.659 1.00 0.00 H new ATOM 0 HD13 LEU A 17 17.133 -6.792 4.797 1.00 0.00 H new ATOM 0 HD21 LEU A 17 16.131 -4.138 3.627 1.00 0.00 H new ATOM 0 HD22 LEU A 17 17.660 -4.942 3.196 1.00 0.00 H new ATOM 0 HD23 LEU A 17 16.494 -4.508 1.924 1.00 0.00 H new ATOM 260 N ALA A 18 16.387 -8.745 -0.514 1.00 0.00 N ATOM 261 CA ALA A 18 16.880 -9.781 -1.463 1.00 0.00 C ATOM 262 C ALA A 18 16.871 -9.232 -2.892 1.00 0.00 C ATOM 263 O ALA A 18 17.477 -9.788 -3.787 1.00 0.00 O ATOM 264 CB ALA A 18 15.894 -10.941 -1.326 1.00 0.00 C ATOM 0 H ALA A 18 15.465 -8.925 -0.116 1.00 0.00 H new ATOM 0 HA ALA A 18 17.903 -10.089 -1.248 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.188 -11.749 -1.996 1.00 0.00 H new ATOM 0 HB2 ALA A 18 15.898 -11.302 -0.298 1.00 0.00 H new ATOM 0 HB3 ALA A 18 14.892 -10.600 -1.587 1.00 0.00 H new ATOM 270 N SER A 19 16.185 -8.143 -3.112 1.00 0.00 N ATOM 271 CA SER A 19 16.133 -7.554 -4.481 1.00 0.00 C ATOM 272 C SER A 19 15.353 -8.472 -5.426 1.00 0.00 C ATOM 273 O SER A 19 15.918 -9.114 -6.288 1.00 0.00 O ATOM 274 CB SER A 19 17.591 -7.445 -4.926 1.00 0.00 C ATOM 275 OG SER A 19 17.791 -6.195 -5.573 1.00 0.00 O ATOM 0 H SER A 19 15.658 -7.635 -2.402 1.00 0.00 H new ATOM 0 HA SER A 19 15.631 -6.587 -4.491 1.00 0.00 H new ATOM 0 HB2 SER A 19 18.254 -7.532 -4.065 1.00 0.00 H new ATOM 0 HB3 SER A 19 17.839 -8.262 -5.603 1.00 0.00 H new ATOM 0 HG SER A 19 18.725 -6.120 -5.859 1.00 0.00 H new ATOM 281 N ASP A 20 14.058 -8.535 -5.271 1.00 0.00 N ATOM 282 CA ASP A 20 13.239 -9.408 -6.161 1.00 0.00 C ATOM 283 C ASP A 20 13.737 -10.856 -6.093 1.00 0.00 C ATOM 284 O ASP A 20 14.171 -11.419 -7.078 1.00 0.00 O ATOM 285 CB ASP A 20 13.436 -8.838 -7.568 1.00 0.00 C ATOM 286 CG ASP A 20 12.816 -7.443 -7.644 1.00 0.00 C ATOM 287 OD1 ASP A 20 12.824 -6.756 -6.636 1.00 0.00 O ATOM 288 OD2 ASP A 20 12.342 -7.084 -8.710 1.00 0.00 O ATOM 0 H ASP A 20 13.531 -8.019 -4.566 1.00 0.00 H new ATOM 0 HA ASP A 20 12.189 -9.422 -5.870 1.00 0.00 H new ATOM 0 HB2 ASP A 20 14.498 -8.789 -7.807 1.00 0.00 H new ATOM 0 HB3 ASP A 20 12.974 -9.494 -8.306 1.00 0.00 H new ATOM 293 N LYS A 21 13.676 -11.461 -4.939 1.00 0.00 N ATOM 294 CA LYS A 21 14.142 -12.869 -4.809 1.00 0.00 C ATOM 295 C LYS A 21 13.414 -13.559 -3.654 1.00 0.00 C ATOM 296 O LYS A 21 13.162 -12.957 -2.631 1.00 0.00 O ATOM 297 CB LYS A 21 15.639 -12.765 -4.520 1.00 0.00 C ATOM 298 CG LYS A 21 16.358 -12.214 -5.754 1.00 0.00 C ATOM 299 CD LYS A 21 17.830 -12.632 -5.719 1.00 0.00 C ATOM 300 CE LYS A 21 18.403 -12.606 -7.138 1.00 0.00 C ATOM 301 NZ LYS A 21 18.134 -11.229 -7.637 1.00 0.00 N ATOM 0 H LYS A 21 13.323 -11.040 -4.080 1.00 0.00 H new ATOM 0 HA LYS A 21 13.943 -13.457 -5.705 1.00 0.00 H new ATOM 0 HB2 LYS A 21 15.811 -12.113 -3.664 1.00 0.00 H new ATOM 0 HB3 LYS A 21 16.039 -13.745 -4.260 1.00 0.00 H new ATOM 0 HG2 LYS A 21 15.884 -12.589 -6.661 1.00 0.00 H new ATOM 0 HG3 LYS A 21 16.278 -11.127 -5.779 1.00 0.00 H new ATOM 0 HD2 LYS A 21 18.395 -11.958 -5.075 1.00 0.00 H new ATOM 0 HD3 LYS A 21 17.925 -13.632 -5.295 1.00 0.00 H new ATOM 0 HE2 LYS A 21 19.471 -12.824 -7.136 1.00 0.00 H new ATOM 0 HE3 LYS A 21 17.926 -13.355 -7.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 18.813 -10.993 -8.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 17.167 -11.180 -8.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 18.234 -10.551 -6.855 1.00 0.00 H new ATOM 315 N PRO A 22 13.102 -14.808 -3.863 1.00 0.00 N ATOM 316 CA PRO A 22 12.394 -15.565 -2.798 1.00 0.00 C ATOM 317 C PRO A 22 13.374 -15.960 -1.690 1.00 0.00 C ATOM 318 O PRO A 22 13.021 -16.645 -0.750 1.00 0.00 O ATOM 319 CB PRO A 22 11.847 -16.808 -3.501 1.00 0.00 C ATOM 320 CG PRO A 22 12.574 -16.887 -4.805 1.00 0.00 C ATOM 321 CD PRO A 22 13.009 -15.493 -5.156 1.00 0.00 C ATOM 0 HA PRO A 22 11.604 -14.980 -2.327 1.00 0.00 H new ATOM 0 HB2 PRO A 22 12.017 -17.703 -2.903 1.00 0.00 H new ATOM 0 HB3 PRO A 22 10.771 -16.728 -3.657 1.00 0.00 H new ATOM 0 HG2 PRO A 22 13.435 -17.550 -4.726 1.00 0.00 H new ATOM 0 HG3 PRO A 22 11.928 -17.295 -5.582 1.00 0.00 H new ATOM 0 HD2 PRO A 22 13.967 -15.494 -5.676 1.00 0.00 H new ATOM 0 HD3 PRO A 22 12.290 -15.005 -5.814 1.00 0.00 H new ATOM 329 N TYR A 23 14.603 -15.531 -1.790 1.00 0.00 N ATOM 330 CA TYR A 23 15.603 -15.884 -0.740 1.00 0.00 C ATOM 331 C TYR A 23 16.590 -14.730 -0.547 1.00 0.00 C ATOM 332 O TYR A 23 16.787 -13.917 -1.427 1.00 0.00 O ATOM 333 CB TYR A 23 16.322 -17.123 -1.275 1.00 0.00 C ATOM 334 CG TYR A 23 16.921 -16.813 -2.625 1.00 0.00 C ATOM 335 CD1 TYR A 23 18.083 -16.034 -2.712 1.00 0.00 C ATOM 336 CD2 TYR A 23 16.316 -17.300 -3.789 1.00 0.00 C ATOM 337 CE1 TYR A 23 18.638 -15.745 -3.964 1.00 0.00 C ATOM 338 CE2 TYR A 23 16.872 -17.010 -5.041 1.00 0.00 C ATOM 339 CZ TYR A 23 18.033 -16.232 -5.128 1.00 0.00 C ATOM 340 OH TYR A 23 18.580 -15.946 -6.362 1.00 0.00 O ATOM 0 H TYR A 23 14.958 -14.953 -2.551 1.00 0.00 H new ATOM 0 HA TYR A 23 15.139 -16.072 0.228 1.00 0.00 H new ATOM 0 HB2 TYR A 23 17.104 -17.431 -0.581 1.00 0.00 H new ATOM 0 HB3 TYR A 23 15.623 -17.955 -1.358 1.00 0.00 H new ATOM 0 HD1 TYR A 23 18.550 -15.657 -1.814 1.00 0.00 H new ATOM 0 HD2 TYR A 23 15.420 -17.900 -3.722 1.00 0.00 H new ATOM 0 HE1 TYR A 23 19.534 -15.146 -4.032 1.00 0.00 H new ATOM 0 HE2 TYR A 23 16.405 -17.386 -5.939 1.00 0.00 H new ATOM 0 HH TYR A 23 18.037 -16.361 -7.065 1.00 0.00 H new ATOM 350 N ILE A 24 17.213 -14.651 0.598 1.00 0.00 N ATOM 351 CA ILE A 24 18.185 -13.547 0.839 1.00 0.00 C ATOM 352 C ILE A 24 19.535 -14.131 1.271 1.00 0.00 C ATOM 353 O ILE A 24 19.596 -15.109 1.989 1.00 0.00 O ATOM 354 CB ILE A 24 17.548 -12.697 1.950 1.00 0.00 C ATOM 355 CG1 ILE A 24 18.036 -11.250 1.834 1.00 0.00 C ATOM 356 CG2 ILE A 24 17.922 -13.253 3.329 1.00 0.00 C ATOM 357 CD1 ILE A 24 19.558 -11.207 1.983 1.00 0.00 C ATOM 0 H ILE A 24 17.091 -15.301 1.374 1.00 0.00 H new ATOM 0 HA ILE A 24 18.381 -12.947 -0.050 1.00 0.00 H new ATOM 0 HB ILE A 24 16.464 -12.729 1.838 1.00 0.00 H new ATOM 0 HG12 ILE A 24 17.743 -10.833 0.870 1.00 0.00 H new ATOM 0 HG13 ILE A 24 17.568 -10.635 2.603 1.00 0.00 H new ATOM 0 HG21 ILE A 24 17.463 -12.640 4.105 1.00 0.00 H new ATOM 0 HG22 ILE A 24 17.564 -14.279 3.417 1.00 0.00 H new ATOM 0 HG23 ILE A 24 19.006 -13.236 3.446 1.00 0.00 H new ATOM 0 HD11 ILE A 24 19.903 -10.176 1.900 1.00 0.00 H new ATOM 0 HD12 ILE A 24 19.840 -11.607 2.957 1.00 0.00 H new ATOM 0 HD13 ILE A 24 20.018 -11.808 1.198 1.00 0.00 H new ATOM 369 N LEU A 25 20.616 -13.544 0.838 1.00 0.00 N ATOM 370 CA LEU A 25 21.951 -14.076 1.224 1.00 0.00 C ATOM 371 C LEU A 25 22.313 -13.603 2.633 1.00 0.00 C ATOM 372 O LEU A 25 21.965 -12.514 3.043 1.00 0.00 O ATOM 373 CB LEU A 25 22.923 -13.498 0.196 1.00 0.00 C ATOM 374 CG LEU A 25 22.708 -14.187 -1.153 1.00 0.00 C ATOM 375 CD1 LEU A 25 21.584 -13.482 -1.913 1.00 0.00 C ATOM 376 CD2 LEU A 25 23.999 -14.117 -1.972 1.00 0.00 C ATOM 0 H LEU A 25 20.632 -12.721 0.235 1.00 0.00 H new ATOM 0 HA LEU A 25 21.977 -15.166 1.235 1.00 0.00 H new ATOM 0 HB2 LEU A 25 22.768 -12.424 0.097 1.00 0.00 H new ATOM 0 HB3 LEU A 25 23.950 -13.642 0.530 1.00 0.00 H new ATOM 0 HG LEU A 25 22.437 -15.230 -0.989 1.00 0.00 H new ATOM 0 HD11 LEU A 25 21.431 -13.973 -2.874 1.00 0.00 H new ATOM 0 HD12 LEU A 25 20.664 -13.531 -1.330 1.00 0.00 H new ATOM 0 HD13 LEU A 25 21.854 -12.439 -2.077 1.00 0.00 H new ATOM 0 HD21 LEU A 25 23.847 -14.608 -2.933 1.00 0.00 H new ATOM 0 HD22 LEU A 25 24.270 -13.074 -2.136 1.00 0.00 H new ATOM 0 HD23 LEU A 25 24.801 -14.619 -1.431 1.00 0.00 H new ATOM 388 N ALA A 26 23.003 -14.419 3.379 1.00 0.00 N ATOM 389 CA ALA A 26 23.382 -14.023 4.766 1.00 0.00 C ATOM 390 C ALA A 26 24.210 -12.737 4.745 1.00 0.00 C ATOM 391 O ALA A 26 23.990 -11.831 5.524 1.00 0.00 O ATOM 392 CB ALA A 26 24.216 -15.189 5.296 1.00 0.00 C ATOM 0 H ALA A 26 23.322 -15.344 3.089 1.00 0.00 H new ATOM 0 HA ALA A 26 22.511 -13.827 5.391 1.00 0.00 H new ATOM 0 HB1 ALA A 26 24.535 -14.974 6.316 1.00 0.00 H new ATOM 0 HB2 ALA A 26 23.616 -16.099 5.287 1.00 0.00 H new ATOM 0 HB3 ALA A 26 25.093 -15.326 4.663 1.00 0.00 H new ATOM 398 N GLU A 27 25.161 -12.650 3.860 1.00 0.00 N ATOM 399 CA GLU A 27 26.002 -11.424 3.789 1.00 0.00 C ATOM 400 C GLU A 27 25.153 -10.219 3.382 1.00 0.00 C ATOM 401 O GLU A 27 25.390 -9.108 3.813 1.00 0.00 O ATOM 402 CB GLU A 27 27.043 -11.729 2.716 1.00 0.00 C ATOM 403 CG GLU A 27 28.363 -12.126 3.381 1.00 0.00 C ATOM 404 CD GLU A 27 29.385 -11.003 3.195 1.00 0.00 C ATOM 405 OE1 GLU A 27 28.967 -9.866 3.057 1.00 0.00 O ATOM 406 OE2 GLU A 27 30.569 -11.300 3.197 1.00 0.00 O ATOM 0 H GLU A 27 25.393 -13.376 3.182 1.00 0.00 H new ATOM 0 HA GLU A 27 26.458 -11.179 4.748 1.00 0.00 H new ATOM 0 HB2 GLU A 27 26.691 -12.535 2.072 1.00 0.00 H new ATOM 0 HB3 GLU A 27 27.192 -10.856 2.081 1.00 0.00 H new ATOM 0 HG2 GLU A 27 28.205 -12.316 4.443 1.00 0.00 H new ATOM 0 HG3 GLU A 27 28.739 -13.051 2.944 1.00 0.00 H new ATOM 413 N GLU A 28 24.168 -10.424 2.549 1.00 0.00 N ATOM 414 CA GLU A 28 23.316 -9.280 2.117 1.00 0.00 C ATOM 415 C GLU A 28 22.558 -8.702 3.313 1.00 0.00 C ATOM 416 O GLU A 28 22.589 -7.512 3.560 1.00 0.00 O ATOM 417 CB GLU A 28 22.343 -9.872 1.097 1.00 0.00 C ATOM 418 CG GLU A 28 22.806 -9.512 -0.316 1.00 0.00 C ATOM 419 CD GLU A 28 23.974 -10.415 -0.718 1.00 0.00 C ATOM 420 OE1 GLU A 28 24.777 -10.729 0.146 1.00 0.00 O ATOM 421 OE2 GLU A 28 24.046 -10.775 -1.881 1.00 0.00 O ATOM 0 H GLU A 28 23.918 -11.329 2.151 1.00 0.00 H new ATOM 0 HA GLU A 28 23.903 -8.466 1.693 1.00 0.00 H new ATOM 0 HB2 GLU A 28 22.294 -10.955 1.211 1.00 0.00 H new ATOM 0 HB3 GLU A 28 21.338 -9.488 1.271 1.00 0.00 H new ATOM 0 HG2 GLU A 28 21.983 -9.630 -1.021 1.00 0.00 H new ATOM 0 HG3 GLU A 28 23.111 -8.466 -0.354 1.00 0.00 H new ATOM 428 N LEU A 29 21.886 -9.530 4.065 1.00 0.00 N ATOM 429 CA LEU A 29 21.144 -9.013 5.248 1.00 0.00 C ATOM 430 C LEU A 29 22.138 -8.505 6.295 1.00 0.00 C ATOM 431 O LEU A 29 21.878 -7.558 7.010 1.00 0.00 O ATOM 432 CB LEU A 29 20.329 -10.205 5.772 1.00 0.00 C ATOM 433 CG LEU A 29 21.177 -11.072 6.706 1.00 0.00 C ATOM 434 CD1 LEU A 29 21.203 -10.445 8.101 1.00 0.00 C ATOM 435 CD2 LEU A 29 20.565 -12.471 6.793 1.00 0.00 C ATOM 0 H LEU A 29 21.819 -10.536 3.912 1.00 0.00 H new ATOM 0 HA LEU A 29 20.491 -8.175 5.004 1.00 0.00 H new ATOM 0 HB2 LEU A 29 19.448 -9.844 6.303 1.00 0.00 H new ATOM 0 HB3 LEU A 29 19.973 -10.805 4.934 1.00 0.00 H new ATOM 0 HG LEU A 29 22.193 -11.139 6.317 1.00 0.00 H new ATOM 0 HD11 LEU A 29 21.807 -11.062 8.766 1.00 0.00 H new ATOM 0 HD12 LEU A 29 21.634 -9.446 8.043 1.00 0.00 H new ATOM 0 HD13 LEU A 29 20.187 -10.380 8.490 1.00 0.00 H new ATOM 0 HD21 LEU A 29 21.167 -13.091 7.458 1.00 0.00 H new ATOM 0 HD22 LEU A 29 19.550 -12.400 7.183 1.00 0.00 H new ATOM 0 HD23 LEU A 29 20.542 -12.920 5.800 1.00 0.00 H new ATOM 447 N ARG A 30 23.276 -9.135 6.385 1.00 0.00 N ATOM 448 CA ARG A 30 24.298 -8.703 7.380 1.00 0.00 C ATOM 449 C ARG A 30 24.741 -7.264 7.098 1.00 0.00 C ATOM 450 O ARG A 30 25.021 -6.503 8.003 1.00 0.00 O ATOM 451 CB ARG A 30 25.468 -9.667 7.186 1.00 0.00 C ATOM 452 CG ARG A 30 25.718 -10.439 8.483 1.00 0.00 C ATOM 453 CD ARG A 30 27.224 -10.622 8.686 1.00 0.00 C ATOM 454 NE ARG A 30 27.421 -10.571 10.161 1.00 0.00 N ATOM 455 CZ ARG A 30 28.558 -10.941 10.686 1.00 0.00 C ATOM 456 NH1 ARG A 30 29.530 -11.357 9.918 1.00 0.00 N ATOM 457 NH2 ARG A 30 28.724 -10.895 11.979 1.00 0.00 N ATOM 0 H ARG A 30 23.544 -9.934 5.810 1.00 0.00 H new ATOM 0 HA ARG A 30 23.914 -8.723 8.400 1.00 0.00 H new ATOM 0 HB2 ARG A 30 25.250 -10.361 6.374 1.00 0.00 H new ATOM 0 HB3 ARG A 30 26.364 -9.115 6.901 1.00 0.00 H new ATOM 0 HG2 ARG A 30 25.289 -9.900 9.328 1.00 0.00 H new ATOM 0 HG3 ARG A 30 25.225 -11.410 8.441 1.00 0.00 H new ATOM 0 HD2 ARG A 30 27.566 -11.572 8.274 1.00 0.00 H new ATOM 0 HD3 ARG A 30 27.789 -9.836 8.185 1.00 0.00 H new ATOM 0 HE ARG A 30 26.665 -10.246 10.764 1.00 0.00 H new ATOM 0 HH11 ARG A 30 29.401 -11.393 8.907 1.00 0.00 H new ATOM 0 HH12 ARG A 30 30.417 -11.646 10.330 1.00 0.00 H new ATOM 0 HH21 ARG A 30 27.966 -10.570 12.579 1.00 0.00 H new ATOM 0 HH22 ARG A 30 29.612 -11.184 12.390 1.00 0.00 H new ATOM 471 N ARG A 31 24.806 -6.885 5.851 1.00 0.00 N ATOM 472 CA ARG A 31 25.232 -5.496 5.515 1.00 0.00 C ATOM 473 C ARG A 31 24.009 -4.590 5.358 1.00 0.00 C ATOM 474 O ARG A 31 24.110 -3.381 5.402 1.00 0.00 O ATOM 475 CB ARG A 31 25.980 -5.621 4.188 1.00 0.00 C ATOM 476 CG ARG A 31 27.262 -4.789 4.245 1.00 0.00 C ATOM 477 CD ARG A 31 27.871 -4.688 2.845 1.00 0.00 C ATOM 478 NE ARG A 31 29.310 -4.384 3.074 1.00 0.00 N ATOM 479 CZ ARG A 31 30.132 -4.291 2.063 1.00 0.00 C ATOM 480 NH1 ARG A 31 29.697 -4.470 0.845 1.00 0.00 N ATOM 481 NH2 ARG A 31 31.392 -4.019 2.271 1.00 0.00 N ATOM 0 H ARG A 31 24.583 -7.476 5.050 1.00 0.00 H new ATOM 0 HA ARG A 31 25.854 -5.056 6.294 1.00 0.00 H new ATOM 0 HB2 ARG A 31 26.220 -6.666 3.991 1.00 0.00 H new ATOM 0 HB3 ARG A 31 25.348 -5.279 3.368 1.00 0.00 H new ATOM 0 HG2 ARG A 31 27.044 -3.793 4.631 1.00 0.00 H new ATOM 0 HG3 ARG A 31 27.975 -5.247 4.930 1.00 0.00 H new ATOM 0 HD2 ARG A 31 27.747 -5.619 2.292 1.00 0.00 H new ATOM 0 HD3 ARG A 31 27.390 -3.904 2.260 1.00 0.00 H new ATOM 0 HE ARG A 31 29.656 -4.248 4.024 1.00 0.00 H new ATOM 0 HH11 ARG A 31 28.713 -4.683 0.681 1.00 0.00 H new ATOM 0 HH12 ARG A 31 30.341 -4.397 0.057 1.00 0.00 H new ATOM 0 HH21 ARG A 31 31.733 -3.879 3.222 1.00 0.00 H new ATOM 0 HH22 ARG A 31 32.035 -3.946 1.482 1.00 0.00 H new ATOM 495 N GLU A 32 22.853 -5.167 5.174 1.00 0.00 N ATOM 496 CA GLU A 32 21.625 -4.338 5.015 1.00 0.00 C ATOM 497 C GLU A 32 20.979 -4.081 6.379 1.00 0.00 C ATOM 498 O GLU A 32 20.221 -3.147 6.551 1.00 0.00 O ATOM 499 CB GLU A 32 20.699 -5.173 4.129 1.00 0.00 C ATOM 500 CG GLU A 32 21.079 -4.973 2.661 1.00 0.00 C ATOM 501 CD GLU A 32 20.169 -5.828 1.776 1.00 0.00 C ATOM 502 OE1 GLU A 32 19.910 -6.961 2.146 1.00 0.00 O ATOM 503 OE2 GLU A 32 19.746 -5.334 0.744 1.00 0.00 O ATOM 0 H GLU A 32 22.706 -6.175 5.127 1.00 0.00 H new ATOM 0 HA GLU A 32 21.837 -3.362 4.578 1.00 0.00 H new ATOM 0 HB2 GLU A 32 20.777 -6.227 4.395 1.00 0.00 H new ATOM 0 HB3 GLU A 32 19.662 -4.879 4.290 1.00 0.00 H new ATOM 0 HG2 GLU A 32 20.984 -3.922 2.390 1.00 0.00 H new ATOM 0 HG3 GLU A 32 22.121 -5.250 2.503 1.00 0.00 H new ATOM 510 N LEU A 33 21.269 -4.906 7.349 1.00 0.00 N ATOM 511 CA LEU A 33 20.669 -4.715 8.696 1.00 0.00 C ATOM 512 C LEU A 33 21.765 -4.445 9.731 1.00 0.00 C ATOM 513 O LEU A 33 22.897 -4.852 9.559 1.00 0.00 O ATOM 514 CB LEU A 33 19.974 -6.041 8.990 1.00 0.00 C ATOM 515 CG LEU A 33 18.522 -5.975 8.517 1.00 0.00 C ATOM 516 CD1 LEU A 33 17.889 -7.364 8.617 1.00 0.00 C ATOM 517 CD2 LEU A 33 17.740 -4.996 9.396 1.00 0.00 C ATOM 0 H LEU A 33 21.897 -5.705 7.264 1.00 0.00 H new ATOM 0 HA LEU A 33 19.984 -3.868 8.735 1.00 0.00 H new ATOM 0 HB2 LEU A 33 20.494 -6.855 8.486 1.00 0.00 H new ATOM 0 HB3 LEU A 33 20.010 -6.253 10.059 1.00 0.00 H new ATOM 0 HG LEU A 33 18.495 -5.635 7.482 1.00 0.00 H new ATOM 0 HD11 LEU A 33 16.854 -7.317 8.280 1.00 0.00 H new ATOM 0 HD12 LEU A 33 18.443 -8.063 7.990 1.00 0.00 H new ATOM 0 HD13 LEU A 33 17.918 -7.704 9.652 1.00 0.00 H new ATOM 0 HD21 LEU A 33 16.705 -4.950 9.057 1.00 0.00 H new ATOM 0 HD22 LEU A 33 17.768 -5.334 10.432 1.00 0.00 H new ATOM 0 HD23 LEU A 33 18.189 -4.005 9.326 1.00 0.00 H new ATOM 529 N PRO A 34 21.387 -3.767 10.781 1.00 0.00 N ATOM 530 CA PRO A 34 22.387 -3.464 11.839 1.00 0.00 C ATOM 531 C PRO A 34 22.968 -4.765 12.404 1.00 0.00 C ATOM 532 O PRO A 34 22.331 -5.798 12.364 1.00 0.00 O ATOM 533 CB PRO A 34 21.593 -2.716 12.907 1.00 0.00 C ATOM 534 CG PRO A 34 20.402 -2.169 12.193 1.00 0.00 C ATOM 535 CD PRO A 34 20.107 -3.100 11.051 1.00 0.00 C ATOM 0 HA PRO A 34 23.230 -2.881 11.469 1.00 0.00 H new ATOM 0 HB2 PRO A 34 21.296 -3.383 13.717 1.00 0.00 H new ATOM 0 HB3 PRO A 34 22.186 -1.918 13.353 1.00 0.00 H new ATOM 0 HG2 PRO A 34 19.547 -2.101 12.866 1.00 0.00 H new ATOM 0 HG3 PRO A 34 20.601 -1.162 11.827 1.00 0.00 H new ATOM 0 HD2 PRO A 34 19.332 -3.820 11.316 1.00 0.00 H new ATOM 0 HD3 PRO A 34 19.751 -2.555 10.177 1.00 0.00 H new ATOM 543 N PRO A 35 24.167 -4.664 12.910 1.00 0.00 N ATOM 544 CA PRO A 35 24.818 -5.875 13.481 1.00 0.00 C ATOM 545 C PRO A 35 23.825 -6.665 14.339 1.00 0.00 C ATOM 546 O PRO A 35 23.751 -7.875 14.262 1.00 0.00 O ATOM 547 CB PRO A 35 25.955 -5.326 14.342 1.00 0.00 C ATOM 548 CG PRO A 35 25.604 -3.898 14.597 1.00 0.00 C ATOM 549 CD PRO A 35 24.776 -3.435 13.431 1.00 0.00 C ATOM 0 HA PRO A 35 25.174 -6.559 12.710 1.00 0.00 H new ATOM 0 HB2 PRO A 35 26.044 -5.881 15.276 1.00 0.00 H new ATOM 0 HB3 PRO A 35 26.913 -5.410 13.828 1.00 0.00 H new ATOM 0 HG2 PRO A 35 25.048 -3.798 15.529 1.00 0.00 H new ATOM 0 HG3 PRO A 35 26.504 -3.291 14.696 1.00 0.00 H new ATOM 0 HD2 PRO A 35 24.018 -2.716 13.742 1.00 0.00 H new ATOM 0 HD3 PRO A 35 25.391 -2.944 12.676 1.00 0.00 H new ATOM 557 N ASP A 36 23.066 -5.991 15.158 1.00 0.00 N ATOM 558 CA ASP A 36 22.083 -6.707 16.021 1.00 0.00 C ATOM 559 C ASP A 36 20.999 -7.366 15.162 1.00 0.00 C ATOM 560 O ASP A 36 20.660 -8.518 15.351 1.00 0.00 O ATOM 561 CB ASP A 36 21.476 -5.623 16.912 1.00 0.00 C ATOM 562 CG ASP A 36 21.535 -6.070 18.374 1.00 0.00 C ATOM 563 OD1 ASP A 36 20.606 -6.731 18.809 1.00 0.00 O ATOM 564 OD2 ASP A 36 22.508 -5.745 19.034 1.00 0.00 O ATOM 0 H ASP A 36 23.083 -4.977 15.267 1.00 0.00 H new ATOM 0 HA ASP A 36 22.549 -7.502 16.604 1.00 0.00 H new ATOM 0 HB2 ASP A 36 22.020 -4.687 16.785 1.00 0.00 H new ATOM 0 HB3 ASP A 36 20.443 -5.434 16.620 1.00 0.00 H new ATOM 569 N GLN A 37 20.452 -6.646 14.221 1.00 0.00 N ATOM 570 CA GLN A 37 19.391 -7.234 13.355 1.00 0.00 C ATOM 571 C GLN A 37 19.988 -8.294 12.426 1.00 0.00 C ATOM 572 O GLN A 37 19.413 -9.343 12.213 1.00 0.00 O ATOM 573 CB GLN A 37 18.843 -6.057 12.549 1.00 0.00 C ATOM 574 CG GLN A 37 17.615 -5.482 13.257 1.00 0.00 C ATOM 575 CD GLN A 37 18.038 -4.865 14.592 1.00 0.00 C ATOM 576 OE1 GLN A 37 18.600 -3.788 14.628 1.00 0.00 O ATOM 577 NE2 GLN A 37 17.788 -5.507 15.701 1.00 0.00 N ATOM 0 H GLN A 37 20.694 -5.677 14.015 1.00 0.00 H new ATOM 0 HA GLN A 37 18.612 -7.729 13.935 1.00 0.00 H new ATOM 0 HB2 GLN A 37 19.608 -5.288 12.442 1.00 0.00 H new ATOM 0 HB3 GLN A 37 18.577 -6.383 11.544 1.00 0.00 H new ATOM 0 HG2 GLN A 37 17.140 -4.728 12.630 1.00 0.00 H new ATOM 0 HG3 GLN A 37 16.878 -6.267 13.424 1.00 0.00 H new ATOM 0 HE21 GLN A 37 17.316 -6.411 15.672 1.00 0.00 H new ATOM 0 HE22 GLN A 37 18.064 -5.105 16.597 1.00 0.00 H new ATOM 586 N ALA A 38 21.137 -8.028 11.868 1.00 0.00 N ATOM 587 CA ALA A 38 21.769 -9.019 10.949 1.00 0.00 C ATOM 588 C ALA A 38 22.011 -10.343 11.678 1.00 0.00 C ATOM 589 O ALA A 38 21.680 -11.403 11.185 1.00 0.00 O ATOM 590 CB ALA A 38 23.096 -8.383 10.536 1.00 0.00 C ATOM 0 H ALA A 38 21.666 -7.167 12.008 1.00 0.00 H new ATOM 0 HA ALA A 38 21.138 -9.244 10.089 1.00 0.00 H new ATOM 0 HB1 ALA A 38 23.624 -9.052 9.857 1.00 0.00 H new ATOM 0 HB2 ALA A 38 22.904 -7.434 10.035 1.00 0.00 H new ATOM 0 HB3 ALA A 38 23.707 -8.208 11.422 1.00 0.00 H new ATOM 596 N GLN A 39 22.588 -10.291 12.848 1.00 0.00 N ATOM 597 CA GLN A 39 22.852 -11.550 13.605 1.00 0.00 C ATOM 598 C GLN A 39 21.533 -12.208 14.022 1.00 0.00 C ATOM 599 O GLN A 39 21.367 -13.407 13.920 1.00 0.00 O ATOM 600 CB GLN A 39 23.646 -11.114 14.836 1.00 0.00 C ATOM 601 CG GLN A 39 24.392 -12.317 15.414 1.00 0.00 C ATOM 602 CD GLN A 39 25.067 -11.919 16.727 1.00 0.00 C ATOM 603 OE1 GLN A 39 24.801 -10.862 17.265 1.00 0.00 O ATOM 604 NE2 GLN A 39 25.934 -12.728 17.271 1.00 0.00 N ATOM 0 H GLN A 39 22.888 -9.434 13.312 1.00 0.00 H new ATOM 0 HA GLN A 39 23.395 -12.282 13.008 1.00 0.00 H new ATOM 0 HB2 GLN A 39 24.353 -10.329 14.567 1.00 0.00 H new ATOM 0 HB3 GLN A 39 22.975 -10.695 15.585 1.00 0.00 H new ATOM 0 HG2 GLN A 39 23.698 -13.140 15.585 1.00 0.00 H new ATOM 0 HG3 GLN A 39 25.138 -12.671 14.703 1.00 0.00 H new ATOM 0 HE21 GLN A 39 26.157 -13.615 16.819 1.00 0.00 H new ATOM 0 HE22 GLN A 39 26.389 -12.474 18.148 1.00 0.00 H new ATOM 613 N TYR A 40 20.598 -11.432 14.498 1.00 0.00 N ATOM 614 CA TYR A 40 19.292 -12.013 14.927 1.00 0.00 C ATOM 615 C TYR A 40 18.577 -12.664 13.739 1.00 0.00 C ATOM 616 O TYR A 40 18.086 -13.772 13.831 1.00 0.00 O ATOM 617 CB TYR A 40 18.486 -10.823 15.449 1.00 0.00 C ATOM 618 CG TYR A 40 17.720 -11.235 16.684 1.00 0.00 C ATOM 619 CD1 TYR A 40 16.430 -11.766 16.564 1.00 0.00 C ATOM 620 CD2 TYR A 40 18.299 -11.083 17.950 1.00 0.00 C ATOM 621 CE1 TYR A 40 15.721 -12.145 17.709 1.00 0.00 C ATOM 622 CE2 TYR A 40 17.589 -11.462 19.095 1.00 0.00 C ATOM 623 CZ TYR A 40 16.300 -11.993 18.975 1.00 0.00 C ATOM 624 OH TYR A 40 15.599 -12.368 20.104 1.00 0.00 O ATOM 0 H TYR A 40 20.681 -10.421 14.609 1.00 0.00 H new ATOM 0 HA TYR A 40 19.416 -12.790 15.682 1.00 0.00 H new ATOM 0 HB2 TYR A 40 19.153 -9.993 15.682 1.00 0.00 H new ATOM 0 HB3 TYR A 40 17.797 -10.472 14.681 1.00 0.00 H new ATOM 0 HD1 TYR A 40 15.983 -11.883 15.588 1.00 0.00 H new ATOM 0 HD2 TYR A 40 19.294 -10.673 18.043 1.00 0.00 H new ATOM 0 HE1 TYR A 40 14.726 -12.555 17.616 1.00 0.00 H new ATOM 0 HE2 TYR A 40 18.036 -11.345 20.071 1.00 0.00 H new ATOM 0 HH TYR A 40 14.653 -12.488 19.877 1.00 0.00 H new ATOM 634 N CYS A 41 18.510 -11.984 12.629 1.00 0.00 N ATOM 635 CA CYS A 41 17.819 -12.565 11.441 1.00 0.00 C ATOM 636 C CYS A 41 18.529 -13.841 10.978 1.00 0.00 C ATOM 637 O CYS A 41 17.913 -14.872 10.797 1.00 0.00 O ATOM 638 CB CYS A 41 17.908 -11.481 10.366 1.00 0.00 C ATOM 639 SG CYS A 41 17.013 -10.008 10.920 1.00 0.00 S ATOM 0 H CYS A 41 18.903 -11.053 12.491 1.00 0.00 H new ATOM 0 HA CYS A 41 16.788 -12.843 11.660 1.00 0.00 H new ATOM 0 HB2 CYS A 41 18.951 -11.233 10.169 1.00 0.00 H new ATOM 0 HB3 CYS A 41 17.485 -11.846 9.430 1.00 0.00 H new ATOM 0 HG CYS A 41 17.743 -9.352 11.772 1.00 0.00 H new ATOM 645 N ILE A 42 19.818 -13.780 10.785 1.00 0.00 N ATOM 646 CA ILE A 42 20.560 -14.993 10.333 1.00 0.00 C ATOM 647 C ILE A 42 20.381 -16.132 11.340 1.00 0.00 C ATOM 648 O ILE A 42 20.602 -17.287 11.031 1.00 0.00 O ATOM 649 CB ILE A 42 22.026 -14.561 10.271 1.00 0.00 C ATOM 650 CG1 ILE A 42 22.245 -13.677 9.041 1.00 0.00 C ATOM 651 CG2 ILE A 42 22.918 -15.799 10.173 1.00 0.00 C ATOM 652 CD1 ILE A 42 23.644 -13.063 9.099 1.00 0.00 C ATOM 0 H ILE A 42 20.389 -12.946 10.920 1.00 0.00 H new ATOM 0 HA ILE A 42 20.200 -15.360 9.372 1.00 0.00 H new ATOM 0 HB ILE A 42 22.278 -14.001 11.171 1.00 0.00 H new ATOM 0 HG12 ILE A 42 22.132 -14.267 8.131 1.00 0.00 H new ATOM 0 HG13 ILE A 42 21.492 -12.890 9.006 1.00 0.00 H new ATOM 0 HG21 ILE A 42 23.963 -15.492 10.129 1.00 0.00 H new ATOM 0 HG22 ILE A 42 22.762 -16.430 11.048 1.00 0.00 H new ATOM 0 HG23 ILE A 42 22.666 -16.359 9.272 1.00 0.00 H new ATOM 0 HD11 ILE A 42 23.801 -12.433 8.223 1.00 0.00 H new ATOM 0 HD12 ILE A 42 23.739 -12.460 10.002 1.00 0.00 H new ATOM 0 HD13 ILE A 42 24.390 -13.858 9.113 1.00 0.00 H new ATOM 664 N LYS A 43 19.990 -15.815 12.543 1.00 0.00 N ATOM 665 CA LYS A 43 19.803 -16.877 13.572 1.00 0.00 C ATOM 666 C LYS A 43 18.406 -17.493 13.460 1.00 0.00 C ATOM 667 O LYS A 43 18.158 -18.582 13.939 1.00 0.00 O ATOM 668 CB LYS A 43 19.964 -16.159 14.912 1.00 0.00 C ATOM 669 CG LYS A 43 20.644 -17.094 15.914 1.00 0.00 C ATOM 670 CD LYS A 43 19.772 -17.224 17.164 1.00 0.00 C ATOM 671 CE LYS A 43 20.530 -18.012 18.234 1.00 0.00 C ATOM 672 NZ LYS A 43 20.661 -19.388 17.676 1.00 0.00 N ATOM 0 H LYS A 43 19.792 -14.866 12.859 1.00 0.00 H new ATOM 0 HA LYS A 43 20.516 -17.693 13.454 1.00 0.00 H new ATOM 0 HB2 LYS A 43 20.557 -15.254 14.783 1.00 0.00 H new ATOM 0 HB3 LYS A 43 18.990 -15.850 15.290 1.00 0.00 H new ATOM 0 HG2 LYS A 43 20.801 -18.074 15.464 1.00 0.00 H new ATOM 0 HG3 LYS A 43 21.626 -16.705 16.182 1.00 0.00 H new ATOM 0 HD2 LYS A 43 19.510 -16.236 17.542 1.00 0.00 H new ATOM 0 HD3 LYS A 43 18.838 -17.729 16.918 1.00 0.00 H new ATOM 0 HE2 LYS A 43 21.507 -17.571 18.431 1.00 0.00 H new ATOM 0 HE3 LYS A 43 19.987 -18.019 19.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 20.818 -20.063 18.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 19.790 -19.641 17.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 21.467 -19.421 17.020 1.00 0.00 H new ATOM 686 N ARG A 44 17.489 -16.804 12.838 1.00 0.00 N ATOM 687 CA ARG A 44 16.109 -17.351 12.708 1.00 0.00 C ATOM 688 C ARG A 44 15.894 -17.957 11.318 1.00 0.00 C ATOM 689 O ARG A 44 15.831 -19.160 11.160 1.00 0.00 O ATOM 690 CB ARG A 44 15.188 -16.150 12.918 1.00 0.00 C ATOM 691 CG ARG A 44 15.254 -15.704 14.379 1.00 0.00 C ATOM 692 CD ARG A 44 14.901 -16.885 15.287 1.00 0.00 C ATOM 693 NE ARG A 44 14.425 -16.268 16.557 1.00 0.00 N ATOM 694 CZ ARG A 44 13.252 -15.695 16.608 1.00 0.00 C ATOM 695 NH1 ARG A 44 12.492 -15.657 15.546 1.00 0.00 N ATOM 696 NH2 ARG A 44 12.837 -15.161 17.724 1.00 0.00 N ATOM 0 H ARG A 44 17.635 -15.888 12.415 1.00 0.00 H new ATOM 0 HA ARG A 44 15.917 -18.148 13.426 1.00 0.00 H new ATOM 0 HB2 ARG A 44 15.486 -15.331 12.263 1.00 0.00 H new ATOM 0 HB3 ARG A 44 14.164 -16.413 12.653 1.00 0.00 H new ATOM 0 HG2 ARG A 44 16.253 -15.336 14.614 1.00 0.00 H new ATOM 0 HG3 ARG A 44 14.562 -14.879 14.551 1.00 0.00 H new ATOM 0 HD2 ARG A 44 14.129 -17.510 14.839 1.00 0.00 H new ATOM 0 HD3 ARG A 44 15.768 -17.523 15.459 1.00 0.00 H new ATOM 0 HE ARG A 44 15.016 -16.293 17.388 1.00 0.00 H new ATOM 0 HH11 ARG A 44 12.814 -16.076 14.673 1.00 0.00 H new ATOM 0 HH12 ARG A 44 11.577 -15.209 15.590 1.00 0.00 H new ATOM 0 HH21 ARG A 44 13.428 -15.191 18.555 1.00 0.00 H new ATOM 0 HH22 ARG A 44 11.921 -14.713 17.766 1.00 0.00 H new ATOM 710 N MET A 45 15.776 -17.137 10.310 1.00 0.00 N ATOM 711 CA MET A 45 15.559 -17.671 8.939 1.00 0.00 C ATOM 712 C MET A 45 16.511 -18.839 8.668 1.00 0.00 C ATOM 713 O MET A 45 17.707 -18.721 8.846 1.00 0.00 O ATOM 714 CB MET A 45 15.864 -16.497 8.012 1.00 0.00 C ATOM 715 CG MET A 45 17.349 -16.144 8.099 1.00 0.00 C ATOM 716 SD MET A 45 17.540 -14.344 8.131 1.00 0.00 S ATOM 717 CE MET A 45 16.268 -13.954 6.904 1.00 0.00 C ATOM 0 H MET A 45 15.821 -16.120 10.378 1.00 0.00 H new ATOM 0 HA MET A 45 14.548 -18.053 8.795 1.00 0.00 H new ATOM 0 HB2 MET A 45 15.601 -16.754 6.986 1.00 0.00 H new ATOM 0 HB3 MET A 45 15.258 -15.635 8.290 1.00 0.00 H new ATOM 0 HG2 MET A 45 17.786 -16.583 8.996 1.00 0.00 H new ATOM 0 HG3 MET A 45 17.884 -16.562 7.246 1.00 0.00 H new ATOM 0 HE1 MET A 45 16.581 -13.090 6.317 1.00 0.00 H new ATOM 0 HE2 MET A 45 16.125 -14.809 6.243 1.00 0.00 H new ATOM 0 HE3 MET A 45 15.330 -13.727 7.411 1.00 0.00 H new ATOM 727 N PRO A 46 15.939 -19.933 8.245 1.00 0.00 N ATOM 728 CA PRO A 46 16.779 -21.124 7.955 1.00 0.00 C ATOM 729 C PRO A 46 17.919 -20.751 7.004 1.00 0.00 C ATOM 730 O PRO A 46 18.156 -19.591 6.730 1.00 0.00 O ATOM 731 CB PRO A 46 15.825 -22.123 7.291 1.00 0.00 C ATOM 732 CG PRO A 46 14.575 -21.359 6.992 1.00 0.00 C ATOM 733 CD PRO A 46 14.532 -20.191 7.936 1.00 0.00 C ATOM 0 HA PRO A 46 17.242 -21.535 8.852 1.00 0.00 H new ATOM 0 HB2 PRO A 46 16.260 -22.532 6.379 1.00 0.00 H new ATOM 0 HB3 PRO A 46 15.619 -22.965 7.952 1.00 0.00 H new ATOM 0 HG2 PRO A 46 14.571 -21.017 5.957 1.00 0.00 H new ATOM 0 HG3 PRO A 46 13.697 -21.992 7.122 1.00 0.00 H new ATOM 0 HD2 PRO A 46 14.059 -19.323 7.476 1.00 0.00 H new ATOM 0 HD3 PRO A 46 13.962 -20.425 8.835 1.00 0.00 H new ATOM 741 N ALA A 47 18.628 -21.723 6.502 1.00 0.00 N ATOM 742 CA ALA A 47 19.755 -21.419 5.575 1.00 0.00 C ATOM 743 C ALA A 47 19.394 -21.822 4.143 1.00 0.00 C ATOM 744 O ALA A 47 20.225 -22.302 3.401 1.00 0.00 O ATOM 745 CB ALA A 47 20.924 -22.259 6.087 1.00 0.00 C ATOM 0 H ALA A 47 18.477 -22.714 6.693 1.00 0.00 H new ATOM 0 HA ALA A 47 19.992 -20.355 5.552 1.00 0.00 H new ATOM 0 HB1 ALA A 47 21.797 -22.091 5.456 1.00 0.00 H new ATOM 0 HB2 ALA A 47 21.157 -21.971 7.112 1.00 0.00 H new ATOM 0 HB3 ALA A 47 20.653 -23.314 6.059 1.00 0.00 H new ATOM 751 N TYR A 48 18.164 -21.623 3.747 1.00 0.00 N ATOM 752 CA TYR A 48 17.756 -21.992 2.359 1.00 0.00 C ATOM 753 C TYR A 48 16.271 -21.680 2.144 1.00 0.00 C ATOM 754 O TYR A 48 15.571 -21.291 3.058 1.00 0.00 O ATOM 755 CB TYR A 48 18.003 -23.497 2.268 1.00 0.00 C ATOM 756 CG TYR A 48 17.626 -24.002 0.895 1.00 0.00 C ATOM 757 CD1 TYR A 48 18.457 -23.739 -0.200 1.00 0.00 C ATOM 758 CD2 TYR A 48 16.451 -24.741 0.722 1.00 0.00 C ATOM 759 CE1 TYR A 48 18.113 -24.217 -1.469 1.00 0.00 C ATOM 760 CE2 TYR A 48 16.104 -25.218 -0.548 1.00 0.00 C ATOM 761 CZ TYR A 48 16.936 -24.957 -1.644 1.00 0.00 C ATOM 762 OH TYR A 48 16.599 -25.430 -2.895 1.00 0.00 O ATOM 0 H TYR A 48 17.425 -21.221 4.324 1.00 0.00 H new ATOM 0 HA TYR A 48 18.310 -21.438 1.602 1.00 0.00 H new ATOM 0 HB2 TYR A 48 19.052 -23.714 2.469 1.00 0.00 H new ATOM 0 HB3 TYR A 48 17.419 -24.016 3.028 1.00 0.00 H new ATOM 0 HD1 TYR A 48 19.363 -23.167 -0.065 1.00 0.00 H new ATOM 0 HD2 TYR A 48 15.811 -24.944 1.568 1.00 0.00 H new ATOM 0 HE1 TYR A 48 18.755 -24.016 -2.314 1.00 0.00 H new ATOM 0 HE2 TYR A 48 15.196 -25.787 -0.682 1.00 0.00 H new ATOM 0 HH TYR A 48 16.586 -24.686 -3.533 1.00 0.00 H new ATOM 772 N SER A 49 15.786 -21.848 0.944 1.00 0.00 N ATOM 773 CA SER A 49 14.347 -21.559 0.676 1.00 0.00 C ATOM 774 C SER A 49 13.742 -22.649 -0.214 1.00 0.00 C ATOM 775 O SER A 49 12.764 -23.278 0.137 1.00 0.00 O ATOM 776 CB SER A 49 14.340 -20.212 -0.043 1.00 0.00 C ATOM 777 OG SER A 49 13.460 -19.325 0.632 1.00 0.00 O ATOM 0 H SER A 49 16.322 -22.172 0.139 1.00 0.00 H new ATOM 0 HA SER A 49 13.755 -21.535 1.591 1.00 0.00 H new ATOM 0 HB2 SER A 49 15.347 -19.795 -0.068 1.00 0.00 H new ATOM 0 HB3 SER A 49 14.022 -20.341 -1.078 1.00 0.00 H new ATOM 0 HG SER A 49 13.391 -18.487 0.129 1.00 0.00 H new ATOM 783 N GLY A 50 14.314 -22.877 -1.366 1.00 0.00 N ATOM 784 CA GLY A 50 13.767 -23.927 -2.273 1.00 0.00 C ATOM 785 C GLY A 50 14.340 -23.746 -3.681 1.00 0.00 C ATOM 786 O GLY A 50 14.872 -24.673 -4.257 1.00 0.00 O ATOM 0 H GLY A 50 15.134 -22.383 -1.717 1.00 0.00 H new ATOM 0 HA2 GLY A 50 14.019 -24.917 -1.892 1.00 0.00 H new ATOM 0 HA3 GLY A 50 12.679 -23.864 -2.302 1.00 0.00 H new ATOM 790 N PRO A 51 14.209 -22.551 -4.189 1.00 0.00 N ATOM 791 CA PRO A 51 14.737 -22.288 -5.554 1.00 0.00 C ATOM 792 C PRO A 51 16.157 -22.847 -5.694 1.00 0.00 C ATOM 793 O PRO A 51 16.749 -23.308 -4.739 1.00 0.00 O ATOM 794 CB PRO A 51 14.739 -20.765 -5.671 1.00 0.00 C ATOM 795 CG PRO A 51 13.756 -20.296 -4.650 1.00 0.00 C ATOM 796 CD PRO A 51 13.752 -21.315 -3.545 1.00 0.00 C ATOM 0 HA PRO A 51 14.141 -22.762 -6.334 1.00 0.00 H new ATOM 0 HB2 PRO A 51 15.731 -20.356 -5.480 1.00 0.00 H new ATOM 0 HB3 PRO A 51 14.450 -20.446 -6.672 1.00 0.00 H new ATOM 0 HG2 PRO A 51 14.035 -19.314 -4.268 1.00 0.00 H new ATOM 0 HG3 PRO A 51 12.763 -20.197 -5.088 1.00 0.00 H new ATOM 0 HD2 PRO A 51 14.415 -21.022 -2.731 1.00 0.00 H new ATOM 0 HD3 PRO A 51 12.756 -21.434 -3.117 1.00 0.00 H new ATOM 804 N GLY A 52 16.704 -22.812 -6.879 1.00 0.00 N ATOM 805 CA GLY A 52 18.082 -23.344 -7.081 1.00 0.00 C ATOM 806 C GLY A 52 19.019 -22.766 -6.019 1.00 0.00 C ATOM 807 O GLY A 52 19.435 -21.627 -6.101 1.00 0.00 O ATOM 0 H GLY A 52 16.256 -22.438 -7.716 1.00 0.00 H new ATOM 0 HA2 GLY A 52 18.075 -24.432 -7.020 1.00 0.00 H new ATOM 0 HA3 GLY A 52 18.440 -23.083 -8.077 1.00 0.00 H new ATOM 811 N SER A 53 19.346 -23.543 -5.019 1.00 0.00 N ATOM 812 CA SER A 53 20.244 -23.060 -3.945 1.00 0.00 C ATOM 813 C SER A 53 21.344 -22.173 -4.518 1.00 0.00 C ATOM 814 O SER A 53 21.900 -22.442 -5.565 1.00 0.00 O ATOM 815 CB SER A 53 20.848 -24.317 -3.321 1.00 0.00 C ATOM 816 OG SER A 53 20.264 -25.473 -3.911 1.00 0.00 O ATOM 0 H SER A 53 19.021 -24.503 -4.906 1.00 0.00 H new ATOM 0 HA SER A 53 19.704 -22.460 -3.212 1.00 0.00 H new ATOM 0 HB2 SER A 53 21.928 -24.326 -3.471 1.00 0.00 H new ATOM 0 HB3 SER A 53 20.675 -24.319 -2.245 1.00 0.00 H new ATOM 0 HG SER A 53 20.654 -26.278 -3.510 1.00 0.00 H new ATOM 822 N VAL A 54 21.655 -21.119 -3.834 1.00 0.00 N ATOM 823 CA VAL A 54 22.718 -20.193 -4.320 1.00 0.00 C ATOM 824 C VAL A 54 23.748 -19.942 -3.215 1.00 0.00 C ATOM 825 O VAL A 54 23.481 -20.171 -2.052 1.00 0.00 O ATOM 826 CB VAL A 54 21.986 -18.899 -4.674 1.00 0.00 C ATOM 827 CG1 VAL A 54 20.968 -19.175 -5.782 1.00 0.00 C ATOM 828 CG2 VAL A 54 21.260 -18.371 -3.434 1.00 0.00 C ATOM 0 H VAL A 54 21.219 -20.851 -2.952 1.00 0.00 H new ATOM 0 HA VAL A 54 23.261 -20.600 -5.173 1.00 0.00 H new ATOM 0 HB VAL A 54 22.705 -18.156 -5.019 1.00 0.00 H new ATOM 0 HG11 VAL A 54 20.446 -18.252 -6.035 1.00 0.00 H new ATOM 0 HG12 VAL A 54 21.484 -19.553 -6.664 1.00 0.00 H new ATOM 0 HG13 VAL A 54 20.248 -19.917 -5.438 1.00 0.00 H new ATOM 0 HG21 VAL A 54 20.737 -17.448 -3.684 1.00 0.00 H new ATOM 0 HG22 VAL A 54 20.540 -19.114 -3.090 1.00 0.00 H new ATOM 0 HG23 VAL A 54 21.985 -18.175 -2.644 1.00 0.00 H new ATOM 838 N PRO A 55 24.897 -19.477 -3.623 1.00 0.00 N ATOM 839 CA PRO A 55 25.964 -19.200 -2.624 1.00 0.00 C ATOM 840 C PRO A 55 25.383 -18.457 -1.417 1.00 0.00 C ATOM 841 O PRO A 55 25.234 -17.252 -1.432 1.00 0.00 O ATOM 842 CB PRO A 55 26.966 -18.319 -3.368 1.00 0.00 C ATOM 843 CG PRO A 55 26.686 -18.536 -4.819 1.00 0.00 C ATOM 844 CD PRO A 55 25.240 -18.926 -4.940 1.00 0.00 C ATOM 0 HA PRO A 55 26.422 -20.111 -2.239 1.00 0.00 H new ATOM 0 HB2 PRO A 55 26.844 -17.270 -3.097 1.00 0.00 H new ATOM 0 HB3 PRO A 55 27.991 -18.595 -3.120 1.00 0.00 H new ATOM 0 HG2 PRO A 55 26.889 -17.630 -5.390 1.00 0.00 H new ATOM 0 HG3 PRO A 55 27.330 -19.317 -5.222 1.00 0.00 H new ATOM 0 HD2 PRO A 55 24.616 -18.067 -5.185 1.00 0.00 H new ATOM 0 HD3 PRO A 55 25.092 -19.663 -5.729 1.00 0.00 H new ATOM 852 N GLY A 56 25.057 -19.168 -0.372 1.00 0.00 N ATOM 853 CA GLY A 56 24.490 -18.501 0.834 1.00 0.00 C ATOM 854 C GLY A 56 23.021 -18.152 0.585 1.00 0.00 C ATOM 855 O GLY A 56 22.682 -17.019 0.303 1.00 0.00 O ATOM 0 H GLY A 56 25.159 -20.180 -0.301 1.00 0.00 H new ATOM 0 HA2 GLY A 56 24.576 -19.158 1.700 1.00 0.00 H new ATOM 0 HA3 GLY A 56 25.055 -17.597 1.062 1.00 0.00 H new ATOM 859 N ALA A 57 22.147 -19.114 0.689 1.00 0.00 N ATOM 860 CA ALA A 57 20.700 -18.837 0.461 1.00 0.00 C ATOM 861 C ALA A 57 19.905 -19.103 1.736 1.00 0.00 C ATOM 862 O ALA A 57 19.911 -20.195 2.260 1.00 0.00 O ATOM 863 CB ALA A 57 20.274 -19.816 -0.633 1.00 0.00 C ATOM 0 H ALA A 57 22.372 -20.081 0.922 1.00 0.00 H new ATOM 0 HA ALA A 57 20.523 -17.799 0.178 1.00 0.00 H new ATOM 0 HB1 ALA A 57 19.217 -19.673 -0.857 1.00 0.00 H new ATOM 0 HB2 ALA A 57 20.863 -19.636 -1.532 1.00 0.00 H new ATOM 0 HB3 ALA A 57 20.438 -20.838 -0.291 1.00 0.00 H new ATOM 869 N LEU A 58 19.215 -18.118 2.236 1.00 0.00 N ATOM 870 CA LEU A 58 18.415 -18.329 3.474 1.00 0.00 C ATOM 871 C LEU A 58 16.983 -17.844 3.262 1.00 0.00 C ATOM 872 O LEU A 58 16.742 -16.859 2.594 1.00 0.00 O ATOM 873 CB LEU A 58 19.100 -17.486 4.547 1.00 0.00 C ATOM 874 CG LEU A 58 20.606 -17.745 4.521 1.00 0.00 C ATOM 875 CD1 LEU A 58 21.292 -16.687 3.654 1.00 0.00 C ATOM 876 CD2 LEU A 58 21.157 -17.669 5.947 1.00 0.00 C ATOM 0 H LEU A 58 19.170 -17.178 1.843 1.00 0.00 H new ATOM 0 HA LEU A 58 18.365 -19.382 3.752 1.00 0.00 H new ATOM 0 HB2 LEU A 58 18.900 -16.428 4.375 1.00 0.00 H new ATOM 0 HB3 LEU A 58 18.696 -17.731 5.529 1.00 0.00 H new ATOM 0 HG LEU A 58 20.798 -18.734 4.106 1.00 0.00 H new ATOM 0 HD11 LEU A 58 22.366 -16.872 3.636 1.00 0.00 H new ATOM 0 HD12 LEU A 58 20.898 -16.737 2.639 1.00 0.00 H new ATOM 0 HD13 LEU A 58 21.101 -15.697 4.069 1.00 0.00 H new ATOM 0 HD21 LEU A 58 22.231 -17.853 5.932 1.00 0.00 H new ATOM 0 HD22 LEU A 58 20.964 -16.678 6.359 1.00 0.00 H new ATOM 0 HD23 LEU A 58 20.668 -18.421 6.566 1.00 0.00 H new ATOM 888 N ASP A 59 16.029 -18.524 3.828 1.00 0.00 N ATOM 889 CA ASP A 59 14.613 -18.091 3.658 1.00 0.00 C ATOM 890 C ASP A 59 14.185 -17.210 4.831 1.00 0.00 C ATOM 891 O ASP A 59 14.037 -17.672 5.945 1.00 0.00 O ATOM 892 CB ASP A 59 13.793 -19.381 3.643 1.00 0.00 C ATOM 893 CG ASP A 59 12.307 -19.039 3.766 1.00 0.00 C ATOM 894 OD1 ASP A 59 11.912 -18.006 3.251 1.00 0.00 O ATOM 895 OD2 ASP A 59 11.589 -19.816 4.374 1.00 0.00 O ATOM 0 H ASP A 59 16.165 -19.358 4.399 1.00 0.00 H new ATOM 0 HA ASP A 59 14.474 -17.508 2.747 1.00 0.00 H new ATOM 0 HB2 ASP A 59 13.976 -19.931 2.720 1.00 0.00 H new ATOM 0 HB3 ASP A 59 14.098 -20.028 4.465 1.00 0.00 H new ATOM 900 N TYR A 60 13.966 -15.948 4.589 1.00 0.00 N ATOM 901 CA TYR A 60 13.528 -15.050 5.692 1.00 0.00 C ATOM 902 C TYR A 60 12.046 -15.295 5.970 1.00 0.00 C ATOM 903 O TYR A 60 11.559 -15.070 7.061 1.00 0.00 O ATOM 904 CB TYR A 60 13.755 -13.629 5.173 1.00 0.00 C ATOM 905 CG TYR A 60 13.040 -13.455 3.855 1.00 0.00 C ATOM 906 CD1 TYR A 60 11.651 -13.276 3.830 1.00 0.00 C ATOM 907 CD2 TYR A 60 13.764 -13.471 2.658 1.00 0.00 C ATOM 908 CE1 TYR A 60 10.988 -13.114 2.608 1.00 0.00 C ATOM 909 CE2 TYR A 60 13.102 -13.309 1.436 1.00 0.00 C ATOM 910 CZ TYR A 60 11.713 -13.131 1.410 1.00 0.00 C ATOM 911 OH TYR A 60 11.060 -12.971 0.205 1.00 0.00 O ATOM 0 H TYR A 60 14.071 -15.501 3.678 1.00 0.00 H new ATOM 0 HA TYR A 60 14.073 -15.221 6.620 1.00 0.00 H new ATOM 0 HB2 TYR A 60 13.387 -12.903 5.897 1.00 0.00 H new ATOM 0 HB3 TYR A 60 14.822 -13.442 5.048 1.00 0.00 H new ATOM 0 HD1 TYR A 60 11.092 -13.263 4.754 1.00 0.00 H new ATOM 0 HD2 TYR A 60 14.835 -13.609 2.677 1.00 0.00 H new ATOM 0 HE1 TYR A 60 9.917 -12.976 2.589 1.00 0.00 H new ATOM 0 HE2 TYR A 60 13.662 -13.321 0.513 1.00 0.00 H new ATOM 0 HH TYR A 60 11.711 -13.007 -0.527 1.00 0.00 H new ATOM 921 N ALA A 61 11.329 -15.769 4.987 1.00 0.00 N ATOM 922 CA ALA A 61 9.881 -16.047 5.188 1.00 0.00 C ATOM 923 C ALA A 61 9.706 -17.013 6.360 1.00 0.00 C ATOM 924 O ALA A 61 8.870 -16.816 7.219 1.00 0.00 O ATOM 925 CB ALA A 61 9.414 -16.695 3.884 1.00 0.00 C ATOM 0 H ALA A 61 11.685 -15.975 4.054 1.00 0.00 H new ATOM 0 HA ALA A 61 9.309 -15.148 5.417 1.00 0.00 H new ATOM 0 HB1 ALA A 61 8.352 -16.930 3.955 1.00 0.00 H new ATOM 0 HB2 ALA A 61 9.579 -16.006 3.056 1.00 0.00 H new ATOM 0 HB3 ALA A 61 9.978 -17.612 3.711 1.00 0.00 H new ATOM 931 N ALA A 62 10.496 -18.053 6.406 1.00 0.00 N ATOM 932 CA ALA A 62 10.375 -19.021 7.532 1.00 0.00 C ATOM 933 C ALA A 62 10.559 -18.290 8.859 1.00 0.00 C ATOM 934 O ALA A 62 9.922 -18.593 9.848 1.00 0.00 O ATOM 935 CB ALA A 62 11.498 -20.035 7.313 1.00 0.00 C ATOM 0 H ALA A 62 11.215 -18.272 5.717 1.00 0.00 H new ATOM 0 HA ALA A 62 9.399 -19.506 7.563 1.00 0.00 H new ATOM 0 HB1 ALA A 62 11.473 -20.782 8.106 1.00 0.00 H new ATOM 0 HB2 ALA A 62 11.363 -20.525 6.348 1.00 0.00 H new ATOM 0 HB3 ALA A 62 12.460 -19.522 7.328 1.00 0.00 H new ATOM 941 N PHE A 63 11.424 -17.322 8.876 1.00 0.00 N ATOM 942 CA PHE A 63 11.662 -16.547 10.126 1.00 0.00 C ATOM 943 C PHE A 63 10.461 -15.644 10.419 1.00 0.00 C ATOM 944 O PHE A 63 10.072 -15.459 11.556 1.00 0.00 O ATOM 945 CB PHE A 63 12.906 -15.706 9.836 1.00 0.00 C ATOM 946 CG PHE A 63 13.030 -14.614 10.871 1.00 0.00 C ATOM 947 CD1 PHE A 63 12.550 -14.821 12.169 1.00 0.00 C ATOM 948 CD2 PHE A 63 13.626 -13.394 10.531 1.00 0.00 C ATOM 949 CE1 PHE A 63 12.667 -13.808 13.128 1.00 0.00 C ATOM 950 CE2 PHE A 63 13.741 -12.380 11.490 1.00 0.00 C ATOM 951 CZ PHE A 63 13.263 -12.587 12.789 1.00 0.00 C ATOM 0 H PHE A 63 11.982 -17.029 8.074 1.00 0.00 H new ATOM 0 HA PHE A 63 11.798 -17.190 10.995 1.00 0.00 H new ATOM 0 HB2 PHE A 63 13.795 -16.336 9.849 1.00 0.00 H new ATOM 0 HB3 PHE A 63 12.839 -15.270 8.839 1.00 0.00 H new ATOM 0 HD1 PHE A 63 12.089 -15.762 12.431 1.00 0.00 H new ATOM 0 HD2 PHE A 63 13.997 -13.235 9.529 1.00 0.00 H new ATOM 0 HE1 PHE A 63 12.297 -13.968 14.130 1.00 0.00 H new ATOM 0 HE2 PHE A 63 14.199 -11.438 11.227 1.00 0.00 H new ATOM 0 HZ PHE A 63 13.354 -11.806 13.529 1.00 0.00 H new ATOM 961 N SER A 64 9.873 -15.079 9.401 1.00 0.00 N ATOM 962 CA SER A 64 8.699 -14.186 9.618 1.00 0.00 C ATOM 963 C SER A 64 7.605 -14.928 10.388 1.00 0.00 C ATOM 964 O SER A 64 7.084 -14.439 11.371 1.00 0.00 O ATOM 965 CB SER A 64 8.215 -13.823 8.215 1.00 0.00 C ATOM 966 OG SER A 64 7.275 -14.795 7.777 1.00 0.00 O ATOM 0 H SER A 64 10.154 -15.197 8.428 1.00 0.00 H new ATOM 0 HA SER A 64 8.954 -13.302 10.203 1.00 0.00 H new ATOM 0 HB2 SER A 64 7.757 -12.834 8.220 1.00 0.00 H new ATOM 0 HB3 SER A 64 9.059 -13.780 7.526 1.00 0.00 H new ATOM 0 HG SER A 64 7.743 -15.510 7.297 1.00 0.00 H new ATOM 972 N SER A 65 7.253 -16.107 9.953 1.00 0.00 N ATOM 973 CA SER A 65 6.194 -16.877 10.665 1.00 0.00 C ATOM 974 C SER A 65 6.642 -17.187 12.095 1.00 0.00 C ATOM 975 O SER A 65 5.857 -17.165 13.022 1.00 0.00 O ATOM 976 CB SER A 65 6.032 -18.167 9.861 1.00 0.00 C ATOM 977 OG SER A 65 5.720 -17.843 8.513 1.00 0.00 O ATOM 0 H SER A 65 7.652 -16.570 9.136 1.00 0.00 H new ATOM 0 HA SER A 65 5.257 -16.324 10.737 1.00 0.00 H new ATOM 0 HB2 SER A 65 6.950 -18.753 9.903 1.00 0.00 H new ATOM 0 HB3 SER A 65 5.241 -18.781 10.292 1.00 0.00 H new ATOM 0 HG SER A 65 5.617 -18.668 7.994 1.00 0.00 H new ATOM 983 N ALA A 66 7.903 -17.471 12.282 1.00 0.00 N ATOM 984 CA ALA A 66 8.405 -17.777 13.652 1.00 0.00 C ATOM 985 C ALA A 66 8.487 -16.494 14.481 1.00 0.00 C ATOM 986 O ALA A 66 8.178 -16.481 15.656 1.00 0.00 O ATOM 987 CB ALA A 66 9.797 -18.372 13.440 1.00 0.00 C ATOM 0 H ALA A 66 8.607 -17.504 11.545 1.00 0.00 H new ATOM 0 HA ALA A 66 7.749 -18.461 14.191 1.00 0.00 H new ATOM 0 HB1 ALA A 66 10.236 -18.625 14.405 1.00 0.00 H new ATOM 0 HB2 ALA A 66 9.719 -19.272 12.830 1.00 0.00 H new ATOM 0 HB3 ALA A 66 10.430 -17.644 12.933 1.00 0.00 H new ATOM 993 N LEU A 67 8.900 -15.412 13.877 1.00 0.00 N ATOM 994 CA LEU A 67 8.999 -14.130 14.631 1.00 0.00 C ATOM 995 C LEU A 67 7.617 -13.741 15.167 1.00 0.00 C ATOM 996 O LEU A 67 7.464 -13.347 16.306 1.00 0.00 O ATOM 997 CB LEU A 67 9.535 -13.119 13.595 1.00 0.00 C ATOM 998 CG LEU A 67 8.539 -11.980 13.333 1.00 0.00 C ATOM 999 CD1 LEU A 67 8.394 -11.120 14.591 1.00 0.00 C ATOM 1000 CD2 LEU A 67 9.060 -11.111 12.186 1.00 0.00 C ATOM 0 H LEU A 67 9.173 -15.361 12.895 1.00 0.00 H new ATOM 0 HA LEU A 67 9.653 -14.181 15.502 1.00 0.00 H new ATOM 0 HB2 LEU A 67 10.477 -12.702 13.950 1.00 0.00 H new ATOM 0 HB3 LEU A 67 9.748 -13.637 12.660 1.00 0.00 H new ATOM 0 HG LEU A 67 7.569 -12.401 13.069 1.00 0.00 H new ATOM 0 HD11 LEU A 67 7.686 -10.313 14.401 1.00 0.00 H new ATOM 0 HD12 LEU A 67 8.029 -11.736 15.413 1.00 0.00 H new ATOM 0 HD13 LEU A 67 9.363 -10.698 14.857 1.00 0.00 H new ATOM 0 HD21 LEU A 67 8.357 -10.300 11.995 1.00 0.00 H new ATOM 0 HD22 LEU A 67 10.030 -10.694 12.457 1.00 0.00 H new ATOM 0 HD23 LEU A 67 9.165 -11.719 11.288 1.00 0.00 H new ATOM 1012 N TYR A 68 6.616 -13.852 14.345 1.00 0.00 N ATOM 1013 CA TYR A 68 5.237 -13.494 14.788 1.00 0.00 C ATOM 1014 C TYR A 68 4.490 -14.745 15.257 1.00 0.00 C ATOM 1015 O TYR A 68 3.319 -14.698 15.575 1.00 0.00 O ATOM 1016 CB TYR A 68 4.568 -12.899 13.549 1.00 0.00 C ATOM 1017 CG TYR A 68 4.879 -11.424 13.469 1.00 0.00 C ATOM 1018 CD1 TYR A 68 4.764 -10.622 14.612 1.00 0.00 C ATOM 1019 CD2 TYR A 68 5.285 -10.857 12.255 1.00 0.00 C ATOM 1020 CE1 TYR A 68 5.054 -9.255 14.539 1.00 0.00 C ATOM 1021 CE2 TYR A 68 5.575 -9.489 12.183 1.00 0.00 C ATOM 1022 CZ TYR A 68 5.459 -8.688 13.325 1.00 0.00 C ATOM 1023 OH TYR A 68 5.746 -7.339 13.255 1.00 0.00 O ATOM 0 H TYR A 68 6.690 -14.176 13.381 1.00 0.00 H new ATOM 0 HA TYR A 68 5.238 -12.796 15.625 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.924 -13.406 12.652 1.00 0.00 H new ATOM 0 HB3 TYR A 68 3.490 -13.052 13.596 1.00 0.00 H new ATOM 0 HD1 TYR A 68 4.452 -11.059 15.549 1.00 0.00 H new ATOM 0 HD2 TYR A 68 5.375 -11.475 11.374 1.00 0.00 H new ATOM 0 HE1 TYR A 68 4.965 -8.637 15.420 1.00 0.00 H new ATOM 0 HE2 TYR A 68 5.888 -9.052 11.246 1.00 0.00 H new ATOM 0 HH TYR A 68 6.013 -7.108 12.341 1.00 0.00 H new ATOM 1033 N GLY A 69 5.160 -15.865 15.303 1.00 0.00 N ATOM 1034 CA GLY A 69 4.488 -17.117 15.753 1.00 0.00 C ATOM 1035 C GLY A 69 3.773 -17.771 14.569 1.00 0.00 C ATOM 1036 O GLY A 69 3.136 -17.110 13.774 1.00 0.00 O ATOM 0 H GLY A 69 6.143 -15.967 15.049 1.00 0.00 H new ATOM 0 HA2 GLY A 69 5.222 -17.805 16.172 1.00 0.00 H new ATOM 0 HA3 GLY A 69 3.772 -16.893 16.544 1.00 0.00 H new ATOM 1040 N GLU A 70 3.875 -19.066 14.445 1.00 0.00 N ATOM 1041 CA GLU A 70 3.201 -19.763 13.312 1.00 0.00 C ATOM 1042 C GLU A 70 1.847 -20.316 13.763 1.00 0.00 C ATOM 1043 O GLU A 70 0.837 -20.115 13.119 1.00 0.00 O ATOM 1044 CB GLU A 70 4.146 -20.902 12.929 1.00 0.00 C ATOM 1045 CG GLU A 70 3.850 -21.349 11.496 1.00 0.00 C ATOM 1046 CD GLU A 70 4.727 -22.552 11.145 1.00 0.00 C ATOM 1047 OE1 GLU A 70 5.854 -22.595 11.610 1.00 0.00 O ATOM 1048 OE2 GLU A 70 4.256 -23.411 10.419 1.00 0.00 O ATOM 0 H GLU A 70 4.396 -19.672 15.079 1.00 0.00 H new ATOM 0 HA GLU A 70 3.007 -19.096 12.472 1.00 0.00 H new ATOM 0 HB2 GLU A 70 5.182 -20.573 13.012 1.00 0.00 H new ATOM 0 HB3 GLU A 70 4.021 -21.739 13.616 1.00 0.00 H new ATOM 0 HG2 GLU A 70 2.797 -21.612 11.396 1.00 0.00 H new ATOM 0 HG3 GLU A 70 4.042 -20.531 10.802 1.00 0.00 H new ATOM 1055 N SER A 71 1.817 -21.008 14.869 1.00 0.00 N ATOM 1056 CA SER A 71 0.528 -21.572 15.363 1.00 0.00 C ATOM 1057 C SER A 71 0.656 -21.966 16.837 1.00 0.00 C ATOM 1058 O SER A 71 0.319 -21.208 17.723 1.00 0.00 O ATOM 1059 CB SER A 71 0.276 -22.806 14.498 1.00 0.00 C ATOM 1060 OG SER A 71 -0.025 -22.396 13.172 1.00 0.00 O ATOM 0 H SER A 71 2.630 -21.207 15.452 1.00 0.00 H new ATOM 0 HA SER A 71 -0.290 -20.855 15.295 1.00 0.00 H new ATOM 0 HB2 SER A 71 1.154 -23.452 14.501 1.00 0.00 H new ATOM 0 HB3 SER A 71 -0.549 -23.389 14.907 1.00 0.00 H new ATOM 0 HG SER A 71 -0.147 -21.424 13.150 1.00 0.00 H new ATOM 1066 N ASP A 72 1.144 -23.146 17.105 1.00 0.00 N ATOM 1067 CA ASP A 72 1.295 -23.584 18.521 1.00 0.00 C ATOM 1068 C ASP A 72 2.726 -23.331 19.000 1.00 0.00 C ATOM 1069 O ASP A 72 3.640 -24.060 18.669 1.00 0.00 O ATOM 1070 CB ASP A 72 0.990 -25.081 18.508 1.00 0.00 C ATOM 1071 CG ASP A 72 1.926 -25.785 17.522 1.00 0.00 C ATOM 1072 OD1 ASP A 72 2.575 -25.092 16.756 1.00 0.00 O ATOM 1073 OD2 ASP A 72 1.978 -27.003 17.553 1.00 0.00 O ATOM 0 H ASP A 72 1.444 -23.825 16.406 1.00 0.00 H new ATOM 0 HA ASP A 72 0.633 -23.041 19.195 1.00 0.00 H new ATOM 0 HB2 ASP A 72 1.117 -25.497 19.507 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -0.049 -25.249 18.223 1.00 0.00 H new ATOM 1078 N LEU A 73 2.928 -22.301 19.775 1.00 0.00 N ATOM 1079 CA LEU A 73 4.302 -21.999 20.273 1.00 0.00 C ATOM 1080 C LEU A 73 4.886 -23.213 21.001 1.00 0.00 C ATOM 1081 O LEU A 73 5.277 -24.188 20.389 1.00 0.00 O ATOM 1082 CB LEU A 73 4.137 -20.802 21.222 1.00 0.00 C ATOM 1083 CG LEU A 73 3.540 -21.236 22.572 1.00 0.00 C ATOM 1084 CD1 LEU A 73 2.383 -22.217 22.360 1.00 0.00 C ATOM 1085 CD2 LEU A 73 4.625 -21.897 23.428 1.00 0.00 C ATOM 0 H LEU A 73 2.202 -21.655 20.085 1.00 0.00 H new ATOM 0 HA LEU A 73 4.993 -21.768 19.462 1.00 0.00 H new ATOM 0 HB2 LEU A 73 5.105 -20.329 21.386 1.00 0.00 H new ATOM 0 HB3 LEU A 73 3.491 -20.055 20.760 1.00 0.00 H new ATOM 0 HG LEU A 73 3.159 -20.352 23.083 1.00 0.00 H new ATOM 0 HD11 LEU A 73 1.974 -22.512 23.326 1.00 0.00 H new ATOM 0 HD12 LEU A 73 1.604 -21.738 21.767 1.00 0.00 H new ATOM 0 HD13 LEU A 73 2.747 -23.100 21.835 1.00 0.00 H new ATOM 0 HD21 LEU A 73 4.199 -22.203 24.383 1.00 0.00 H new ATOM 0 HD22 LEU A 73 5.016 -22.772 22.908 1.00 0.00 H new ATOM 0 HD23 LEU A 73 5.434 -21.187 23.602 1.00 0.00 H new TER 1097 LEU A 73 ATOM 1098 N GLY B 7 15.013 4.948 -2.449 1.00 0.00 N ATOM 1099 CA GLY B 7 13.761 4.248 -2.851 1.00 0.00 C ATOM 1100 C GLY B 7 13.005 3.792 -1.601 1.00 0.00 C ATOM 1101 O GLY B 7 13.002 4.462 -0.587 1.00 0.00 O ATOM 0 HA2 GLY B 7 13.135 4.914 -3.445 1.00 0.00 H new ATOM 0 HA3 GLY B 7 13.998 3.389 -3.479 1.00 0.00 H new ATOM 1105 N LYS B 8 12.363 2.658 -1.666 1.00 0.00 N ATOM 1106 CA LYS B 8 11.606 2.160 -0.480 1.00 0.00 C ATOM 1107 C LYS B 8 12.451 1.147 0.298 1.00 0.00 C ATOM 1108 O LYS B 8 11.986 0.528 1.235 1.00 0.00 O ATOM 1109 CB LYS B 8 10.362 1.487 -1.058 1.00 0.00 C ATOM 1110 CG LYS B 8 9.276 1.412 0.016 1.00 0.00 C ATOM 1111 CD LYS B 8 8.106 0.573 -0.499 1.00 0.00 C ATOM 1112 CE LYS B 8 7.134 1.467 -1.271 1.00 0.00 C ATOM 1113 NZ LYS B 8 5.910 0.639 -1.452 1.00 0.00 N ATOM 0 H LYS B 8 12.329 2.054 -2.488 1.00 0.00 H new ATOM 0 HA LYS B 8 11.351 2.961 0.213 1.00 0.00 H new ATOM 0 HB2 LYS B 8 9.999 2.048 -1.919 1.00 0.00 H new ATOM 0 HB3 LYS B 8 10.608 0.486 -1.411 1.00 0.00 H new ATOM 0 HG2 LYS B 8 9.680 0.971 0.927 1.00 0.00 H new ATOM 0 HG3 LYS B 8 8.933 2.414 0.272 1.00 0.00 H new ATOM 0 HD2 LYS B 8 8.474 -0.224 -1.145 1.00 0.00 H new ATOM 0 HD3 LYS B 8 7.592 0.096 0.336 1.00 0.00 H new ATOM 0 HE2 LYS B 8 6.914 2.381 -0.719 1.00 0.00 H new ATOM 0 HE3 LYS B 8 7.552 1.768 -2.231 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 5.196 1.185 -1.974 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 6.148 -0.220 -1.987 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 5.530 0.373 -0.521 1.00 0.00 H new ATOM 1127 N LYS B 9 13.686 0.972 -0.083 1.00 0.00 N ATOM 1128 CA LYS B 9 14.557 -0.002 0.635 1.00 0.00 C ATOM 1129 C LYS B 9 14.737 0.426 2.093 1.00 0.00 C ATOM 1130 O LYS B 9 14.581 -0.362 3.005 1.00 0.00 O ATOM 1131 CB LYS B 9 15.892 0.039 -0.106 1.00 0.00 C ATOM 1132 CG LYS B 9 16.497 -1.367 -0.143 1.00 0.00 C ATOM 1133 CD LYS B 9 17.974 -1.279 -0.529 1.00 0.00 C ATOM 1134 CE LYS B 9 18.781 -0.748 0.659 1.00 0.00 C ATOM 1135 NZ LYS B 9 20.152 -1.297 0.467 1.00 0.00 N ATOM 0 H LYS B 9 14.130 1.461 -0.860 1.00 0.00 H new ATOM 0 HA LYS B 9 14.131 -1.005 0.649 1.00 0.00 H new ATOM 0 HB2 LYS B 9 15.746 0.411 -1.120 1.00 0.00 H new ATOM 0 HB3 LYS B 9 16.575 0.728 0.391 1.00 0.00 H new ATOM 0 HG2 LYS B 9 16.393 -1.844 0.831 1.00 0.00 H new ATOM 0 HG3 LYS B 9 15.959 -1.987 -0.861 1.00 0.00 H new ATOM 0 HD2 LYS B 9 18.343 -2.261 -0.823 1.00 0.00 H new ATOM 0 HD3 LYS B 9 18.098 -0.621 -1.389 1.00 0.00 H new ATOM 0 HE2 LYS B 9 18.790 0.342 0.675 1.00 0.00 H new ATOM 0 HE3 LYS B 9 18.353 -1.077 1.606 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 20.766 -0.977 1.243 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 20.112 -2.336 0.463 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 20.536 -0.962 -0.439 1.00 0.00 H new ATOM 1149 N ALA B 10 15.062 1.670 2.322 1.00 0.00 N ATOM 1150 CA ALA B 10 15.249 2.145 3.722 1.00 0.00 C ATOM 1151 C ALA B 10 13.990 1.861 4.543 1.00 0.00 C ATOM 1152 O ALA B 10 14.061 1.462 5.690 1.00 0.00 O ATOM 1153 CB ALA B 10 15.484 3.652 3.602 1.00 0.00 C ATOM 0 H ALA B 10 15.206 2.377 1.601 1.00 0.00 H new ATOM 0 HA ALA B 10 16.077 1.644 4.223 1.00 0.00 H new ATOM 0 HB1 ALA B 10 15.631 4.078 4.595 1.00 0.00 H new ATOM 0 HB2 ALA B 10 16.370 3.835 2.994 1.00 0.00 H new ATOM 0 HB3 ALA B 10 14.619 4.119 3.132 1.00 0.00 H new ATOM 1159 N GLU B 11 12.837 2.058 3.966 1.00 0.00 N ATOM 1160 CA GLU B 11 11.575 1.796 4.713 1.00 0.00 C ATOM 1161 C GLU B 11 11.478 0.311 5.071 1.00 0.00 C ATOM 1162 O GLU B 11 11.080 -0.050 6.161 1.00 0.00 O ATOM 1163 CB GLU B 11 10.454 2.192 3.751 1.00 0.00 C ATOM 1164 CG GLU B 11 9.869 3.541 4.175 1.00 0.00 C ATOM 1165 CD GLU B 11 10.255 4.609 3.152 1.00 0.00 C ATOM 1166 OE1 GLU B 11 9.762 4.539 2.038 1.00 0.00 O ATOM 1167 OE2 GLU B 11 11.035 5.480 3.499 1.00 0.00 O ATOM 0 H GLU B 11 12.714 2.389 3.009 1.00 0.00 H new ATOM 0 HA GLU B 11 11.522 2.354 5.648 1.00 0.00 H new ATOM 0 HB2 GLU B 11 10.839 2.255 2.733 1.00 0.00 H new ATOM 0 HB3 GLU B 11 9.675 1.430 3.751 1.00 0.00 H new ATOM 0 HG2 GLU B 11 8.784 3.471 4.251 1.00 0.00 H new ATOM 0 HG3 GLU B 11 10.241 3.816 5.162 1.00 0.00 H new ATOM 1174 N ALA B 12 11.839 -0.552 4.162 1.00 0.00 N ATOM 1175 CA ALA B 12 11.769 -2.013 4.452 1.00 0.00 C ATOM 1176 C ALA B 12 12.716 -2.366 5.602 1.00 0.00 C ATOM 1177 O ALA B 12 12.374 -3.124 6.489 1.00 0.00 O ATOM 1178 CB ALA B 12 12.217 -2.695 3.160 1.00 0.00 C ATOM 0 H ALA B 12 12.179 -0.310 3.231 1.00 0.00 H new ATOM 0 HA ALA B 12 10.770 -2.329 4.753 1.00 0.00 H new ATOM 0 HB1 ALA B 12 12.193 -3.777 3.292 1.00 0.00 H new ATOM 0 HB2 ALA B 12 11.546 -2.414 2.348 1.00 0.00 H new ATOM 0 HB3 ALA B 12 13.232 -2.382 2.916 1.00 0.00 H new ATOM 1184 N VAL B 13 13.902 -1.822 5.596 1.00 0.00 N ATOM 1185 CA VAL B 13 14.867 -2.125 6.692 1.00 0.00 C ATOM 1186 C VAL B 13 14.257 -1.754 8.046 1.00 0.00 C ATOM 1187 O VAL B 13 14.368 -2.488 9.009 1.00 0.00 O ATOM 1188 CB VAL B 13 16.088 -1.254 6.398 1.00 0.00 C ATOM 1189 CG1 VAL B 13 17.094 -1.382 7.544 1.00 0.00 C ATOM 1190 CG2 VAL B 13 16.741 -1.717 5.091 1.00 0.00 C ATOM 0 H VAL B 13 14.245 -1.181 4.880 1.00 0.00 H new ATOM 0 HA VAL B 13 15.124 -3.183 6.736 1.00 0.00 H new ATOM 0 HB VAL B 13 15.778 -0.213 6.302 1.00 0.00 H new ATOM 0 HG11 VAL B 13 17.965 -0.761 7.335 1.00 0.00 H new ATOM 0 HG12 VAL B 13 16.630 -1.054 8.474 1.00 0.00 H new ATOM 0 HG13 VAL B 13 17.405 -2.422 7.641 1.00 0.00 H new ATOM 0 HG21 VAL B 13 17.612 -1.097 4.880 1.00 0.00 H new ATOM 0 HG22 VAL B 13 17.051 -2.757 5.188 1.00 0.00 H new ATOM 0 HG23 VAL B 13 16.025 -1.627 4.274 1.00 0.00 H new ATOM 1200 N ALA B 14 13.613 -0.623 8.126 1.00 0.00 N ATOM 1201 CA ALA B 14 12.993 -0.206 9.416 1.00 0.00 C ATOM 1202 C ALA B 14 11.923 -1.218 9.833 1.00 0.00 C ATOM 1203 O ALA B 14 11.765 -1.525 10.998 1.00 0.00 O ATOM 1204 CB ALA B 14 12.362 1.157 9.132 1.00 0.00 C ATOM 0 H ALA B 14 13.489 0.031 7.354 1.00 0.00 H new ATOM 0 HA ALA B 14 13.719 -0.155 10.228 1.00 0.00 H new ATOM 0 HB1 ALA B 14 11.884 1.532 10.037 1.00 0.00 H new ATOM 0 HB2 ALA B 14 13.135 1.857 8.814 1.00 0.00 H new ATOM 0 HB3 ALA B 14 11.617 1.056 8.343 1.00 0.00 H new ATOM 1210 N THR B 15 11.189 -1.740 8.889 1.00 0.00 N ATOM 1211 CA THR B 15 10.130 -2.734 9.228 1.00 0.00 C ATOM 1212 C THR B 15 10.769 -3.998 9.807 1.00 0.00 C ATOM 1213 O THR B 15 10.308 -4.543 10.791 1.00 0.00 O ATOM 1214 CB THR B 15 9.434 -3.040 7.901 1.00 0.00 C ATOM 1215 OG1 THR B 15 9.139 -1.821 7.232 1.00 0.00 O ATOM 1216 CG2 THR B 15 8.137 -3.805 8.169 1.00 0.00 C ATOM 0 H THR B 15 11.276 -1.521 7.897 1.00 0.00 H new ATOM 0 HA THR B 15 9.429 -2.359 9.974 1.00 0.00 H new ATOM 0 HB THR B 15 10.089 -3.648 7.277 1.00 0.00 H new ATOM 0 HG1 THR B 15 8.694 -2.015 6.380 1.00 0.00 H new ATOM 0 HG21 THR B 15 7.641 -4.023 7.223 1.00 0.00 H new ATOM 0 HG22 THR B 15 8.365 -4.739 8.683 1.00 0.00 H new ATOM 0 HG23 THR B 15 7.479 -3.199 8.792 1.00 0.00 H new ATOM 1224 N VAL B 16 11.827 -4.468 9.205 1.00 0.00 N ATOM 1225 CA VAL B 16 12.495 -5.696 9.723 1.00 0.00 C ATOM 1226 C VAL B 16 13.094 -5.424 11.106 1.00 0.00 C ATOM 1227 O VAL B 16 12.948 -6.208 12.022 1.00 0.00 O ATOM 1228 CB VAL B 16 13.596 -6.005 8.710 1.00 0.00 C ATOM 1229 CG1 VAL B 16 14.463 -7.153 9.231 1.00 0.00 C ATOM 1230 CG2 VAL B 16 12.962 -6.412 7.378 1.00 0.00 C ATOM 0 H VAL B 16 12.258 -4.055 8.378 1.00 0.00 H new ATOM 0 HA VAL B 16 11.802 -6.530 9.835 1.00 0.00 H new ATOM 0 HB VAL B 16 14.214 -5.119 8.565 1.00 0.00 H new ATOM 0 HG11 VAL B 16 15.248 -7.373 8.508 1.00 0.00 H new ATOM 0 HG12 VAL B 16 14.914 -6.866 10.181 1.00 0.00 H new ATOM 0 HG13 VAL B 16 13.845 -8.039 9.376 1.00 0.00 H new ATOM 0 HG21 VAL B 16 13.746 -6.633 6.654 1.00 0.00 H new ATOM 0 HG22 VAL B 16 12.344 -7.298 7.525 1.00 0.00 H new ATOM 0 HG23 VAL B 16 12.343 -5.596 7.005 1.00 0.00 H new ATOM 1240 N VAL B 17 13.767 -4.317 11.263 1.00 0.00 N ATOM 1241 CA VAL B 17 14.373 -3.994 12.586 1.00 0.00 C ATOM 1242 C VAL B 17 13.287 -3.945 13.665 1.00 0.00 C ATOM 1243 O VAL B 17 13.438 -4.494 14.737 1.00 0.00 O ATOM 1244 CB VAL B 17 15.011 -2.618 12.407 1.00 0.00 C ATOM 1245 CG1 VAL B 17 15.675 -2.188 13.716 1.00 0.00 C ATOM 1246 CG2 VAL B 17 16.065 -2.685 11.300 1.00 0.00 C ATOM 0 H VAL B 17 13.923 -3.622 10.533 1.00 0.00 H new ATOM 0 HA VAL B 17 15.101 -4.742 12.900 1.00 0.00 H new ATOM 0 HB VAL B 17 14.242 -1.895 12.135 1.00 0.00 H new ATOM 0 HG11 VAL B 17 16.130 -1.206 13.588 1.00 0.00 H new ATOM 0 HG12 VAL B 17 14.925 -2.140 14.506 1.00 0.00 H new ATOM 0 HG13 VAL B 17 16.444 -2.911 13.989 1.00 0.00 H new ATOM 0 HG21 VAL B 17 16.521 -1.703 11.172 1.00 0.00 H new ATOM 0 HG22 VAL B 17 16.833 -3.409 11.572 1.00 0.00 H new ATOM 0 HG23 VAL B 17 15.593 -2.991 10.366 1.00 0.00 H new ATOM 1256 N ALA B 18 12.192 -3.292 13.386 1.00 0.00 N ATOM 1257 CA ALA B 18 11.096 -3.207 14.394 1.00 0.00 C ATOM 1258 C ALA B 18 10.521 -4.598 14.670 1.00 0.00 C ATOM 1259 O ALA B 18 10.278 -4.966 15.803 1.00 0.00 O ATOM 1260 CB ALA B 18 10.039 -2.308 13.751 1.00 0.00 C ATOM 0 H ALA B 18 12.008 -2.814 12.504 1.00 0.00 H new ATOM 0 HA ALA B 18 11.442 -2.813 15.349 1.00 0.00 H new ATOM 0 HB1 ALA B 18 9.195 -2.194 14.432 1.00 0.00 H new ATOM 0 HB2 ALA B 18 10.472 -1.329 13.543 1.00 0.00 H new ATOM 0 HB3 ALA B 18 9.696 -2.759 12.820 1.00 0.00 H new ATOM 1266 N ALA B 19 10.300 -5.373 13.644 1.00 0.00 N ATOM 1267 CA ALA B 19 9.740 -6.738 13.850 1.00 0.00 C ATOM 1268 C ALA B 19 10.740 -7.610 14.616 1.00 0.00 C ATOM 1269 O ALA B 19 10.387 -8.300 15.551 1.00 0.00 O ATOM 1270 CB ALA B 19 9.514 -7.291 12.443 1.00 0.00 C ATOM 0 H ALA B 19 10.483 -5.120 12.673 1.00 0.00 H new ATOM 0 HA ALA B 19 8.820 -6.723 14.434 1.00 0.00 H new ATOM 0 HB1 ALA B 19 9.101 -8.298 12.510 1.00 0.00 H new ATOM 0 HB2 ALA B 19 8.817 -6.647 11.907 1.00 0.00 H new ATOM 0 HB3 ALA B 19 10.463 -7.323 11.908 1.00 0.00 H new ATOM 1276 N VAL B 20 11.986 -7.581 14.228 1.00 0.00 N ATOM 1277 CA VAL B 20 13.006 -8.406 14.938 1.00 0.00 C ATOM 1278 C VAL B 20 13.081 -7.995 16.411 1.00 0.00 C ATOM 1279 O VAL B 20 13.187 -8.825 17.292 1.00 0.00 O ATOM 1280 CB VAL B 20 14.325 -8.102 14.229 1.00 0.00 C ATOM 1281 CG1 VAL B 20 15.482 -8.714 15.019 1.00 0.00 C ATOM 1282 CG2 VAL B 20 14.295 -8.702 12.822 1.00 0.00 C ATOM 0 H VAL B 20 12.342 -7.023 13.452 1.00 0.00 H new ATOM 0 HA VAL B 20 12.768 -9.469 14.915 1.00 0.00 H new ATOM 0 HB VAL B 20 14.462 -7.023 14.163 1.00 0.00 H new ATOM 0 HG11 VAL B 20 16.423 -8.497 14.513 1.00 0.00 H new ATOM 0 HG12 VAL B 20 15.503 -8.288 16.022 1.00 0.00 H new ATOM 0 HG13 VAL B 20 15.346 -9.793 15.086 1.00 0.00 H new ATOM 0 HG21 VAL B 20 15.235 -8.486 12.314 1.00 0.00 H new ATOM 0 HG22 VAL B 20 14.158 -9.781 12.890 1.00 0.00 H new ATOM 0 HG23 VAL B 20 13.470 -8.266 12.258 1.00 0.00 H new ATOM 1292 N ASP B 21 13.027 -6.721 16.682 1.00 0.00 N ATOM 1293 CA ASP B 21 13.095 -6.257 18.097 1.00 0.00 C ATOM 1294 C ASP B 21 11.869 -6.747 18.872 1.00 0.00 C ATOM 1295 O ASP B 21 11.942 -7.033 20.051 1.00 0.00 O ATOM 1296 CB ASP B 21 13.101 -4.730 18.014 1.00 0.00 C ATOM 1297 CG ASP B 21 13.355 -4.143 19.403 1.00 0.00 C ATOM 1298 OD1 ASP B 21 12.426 -4.118 20.193 1.00 0.00 O ATOM 1299 OD2 ASP B 21 14.475 -3.729 19.654 1.00 0.00 O ATOM 0 H ASP B 21 12.939 -5.981 15.986 1.00 0.00 H new ATOM 0 HA ASP B 21 13.974 -6.640 18.616 1.00 0.00 H new ATOM 0 HB2 ASP B 21 13.873 -4.396 17.320 1.00 0.00 H new ATOM 0 HB3 ASP B 21 12.147 -4.373 17.626 1.00 0.00 H new ATOM 1304 N GLN B 22 10.744 -6.850 18.220 1.00 0.00 N ATOM 1305 CA GLN B 22 9.516 -7.324 18.919 1.00 0.00 C ATOM 1306 C GLN B 22 9.745 -8.726 19.488 1.00 0.00 C ATOM 1307 O GLN B 22 9.486 -8.987 20.646 1.00 0.00 O ATOM 1308 CB GLN B 22 8.434 -7.347 17.840 1.00 0.00 C ATOM 1309 CG GLN B 22 7.220 -6.548 18.316 1.00 0.00 C ATOM 1310 CD GLN B 22 7.491 -5.053 18.140 1.00 0.00 C ATOM 1311 OE1 GLN B 22 8.626 -4.643 17.994 1.00 0.00 O ATOM 1312 NE2 GLN B 22 6.491 -4.215 18.148 1.00 0.00 N ATOM 0 H GLN B 22 10.622 -6.626 17.232 1.00 0.00 H new ATOM 0 HA GLN B 22 9.239 -6.684 19.757 1.00 0.00 H new ATOM 0 HB2 GLN B 22 8.821 -6.923 16.913 1.00 0.00 H new ATOM 0 HB3 GLN B 22 8.144 -8.375 17.623 1.00 0.00 H new ATOM 0 HG2 GLN B 22 6.336 -6.837 17.748 1.00 0.00 H new ATOM 0 HG3 GLN B 22 7.013 -6.770 19.363 1.00 0.00 H new ATOM 0 HE21 GLN B 22 5.539 -4.559 18.270 1.00 0.00 H new ATOM 0 HE22 GLN B 22 6.662 -3.216 18.032 1.00 0.00 H new ATOM 1321 N ALA B 23 10.235 -9.630 18.683 1.00 0.00 N ATOM 1322 CA ALA B 23 10.485 -11.015 19.180 1.00 0.00 C ATOM 1323 C ALA B 23 11.548 -10.992 20.281 1.00 0.00 C ATOM 1324 O ALA B 23 11.449 -11.688 21.272 1.00 0.00 O ATOM 1325 CB ALA B 23 10.995 -11.786 17.961 1.00 0.00 C ATOM 0 H ALA B 23 10.473 -9.470 17.704 1.00 0.00 H new ATOM 0 HA ALA B 23 9.591 -11.471 19.606 1.00 0.00 H new ATOM 0 HB1 ALA B 23 11.203 -12.818 18.244 1.00 0.00 H new ATOM 0 HB2 ALA B 23 10.237 -11.770 17.177 1.00 0.00 H new ATOM 0 HB3 ALA B 23 11.909 -11.320 17.592 1.00 0.00 H new ATOM 1331 N ARG B 24 12.567 -10.194 20.110 1.00 0.00 N ATOM 1332 CA ARG B 24 13.644 -10.117 21.139 1.00 0.00 C ATOM 1333 C ARG B 24 13.069 -9.639 22.476 1.00 0.00 C ATOM 1334 O ARG B 24 13.529 -10.023 23.534 1.00 0.00 O ATOM 1335 CB ARG B 24 14.634 -9.093 20.583 1.00 0.00 C ATOM 1336 CG ARG B 24 15.728 -8.817 21.615 1.00 0.00 C ATOM 1337 CD ARG B 24 16.676 -7.744 21.074 1.00 0.00 C ATOM 1338 NE ARG B 24 16.489 -6.575 21.977 1.00 0.00 N ATOM 1339 CZ ARG B 24 17.043 -6.562 23.160 1.00 0.00 C ATOM 1340 NH1 ARG B 24 17.767 -7.575 23.556 1.00 0.00 N ATOM 1341 NH2 ARG B 24 16.873 -5.537 23.948 1.00 0.00 N ATOM 0 H ARG B 24 12.701 -9.590 19.299 1.00 0.00 H new ATOM 0 HA ARG B 24 14.112 -11.084 21.327 1.00 0.00 H new ATOM 0 HB2 ARG B 24 15.078 -9.466 19.660 1.00 0.00 H new ATOM 0 HB3 ARG B 24 14.114 -8.168 20.335 1.00 0.00 H new ATOM 0 HG2 ARG B 24 15.283 -8.486 22.553 1.00 0.00 H new ATOM 0 HG3 ARG B 24 16.280 -9.732 21.830 1.00 0.00 H new ATOM 0 HD2 ARG B 24 17.710 -8.089 21.084 1.00 0.00 H new ATOM 0 HD3 ARG B 24 16.435 -7.488 20.042 1.00 0.00 H new ATOM 0 HE ARG B 24 15.926 -5.781 21.671 1.00 0.00 H new ATOM 0 HH11 ARG B 24 17.900 -8.378 22.941 1.00 0.00 H new ATOM 0 HH12 ARG B 24 18.199 -7.563 24.480 1.00 0.00 H new ATOM 0 HH21 ARG B 24 16.308 -4.746 23.641 1.00 0.00 H new ATOM 0 HH22 ARG B 24 17.305 -5.527 24.872 1.00 0.00 H new ATOM 1355 N VAL B 25 12.070 -8.801 22.438 1.00 0.00 N ATOM 1356 CA VAL B 25 11.470 -8.294 23.705 1.00 0.00 C ATOM 1357 C VAL B 25 10.686 -9.406 24.408 1.00 0.00 C ATOM 1358 O VAL B 25 10.437 -9.349 25.595 1.00 0.00 O ATOM 1359 CB VAL B 25 10.534 -7.164 23.276 1.00 0.00 C ATOM 1360 CG1 VAL B 25 9.733 -6.674 24.484 1.00 0.00 C ATOM 1361 CG2 VAL B 25 11.361 -6.006 22.710 1.00 0.00 C ATOM 0 H VAL B 25 11.642 -8.445 21.583 1.00 0.00 H new ATOM 0 HA VAL B 25 12.227 -7.951 24.410 1.00 0.00 H new ATOM 0 HB VAL B 25 9.849 -7.532 22.512 1.00 0.00 H new ATOM 0 HG11 VAL B 25 9.066 -5.868 24.176 1.00 0.00 H new ATOM 0 HG12 VAL B 25 9.144 -7.497 24.889 1.00 0.00 H new ATOM 0 HG13 VAL B 25 10.417 -6.307 25.249 1.00 0.00 H new ATOM 0 HG21 VAL B 25 10.695 -5.199 22.403 1.00 0.00 H new ATOM 0 HG22 VAL B 25 12.046 -5.640 23.475 1.00 0.00 H new ATOM 0 HG23 VAL B 25 11.931 -6.353 21.848 1.00 0.00 H new ATOM 1371 N ARG B 26 10.293 -10.413 23.682 1.00 0.00 N ATOM 1372 CA ARG B 26 9.518 -11.526 24.306 1.00 0.00 C ATOM 1373 C ARG B 26 10.355 -12.808 24.343 1.00 0.00 C ATOM 1374 O ARG B 26 9.876 -13.881 24.034 1.00 0.00 O ATOM 1375 CB ARG B 26 8.298 -11.708 23.404 1.00 0.00 C ATOM 1376 CG ARG B 26 7.029 -11.735 24.259 1.00 0.00 C ATOM 1377 CD ARG B 26 5.826 -11.346 23.398 1.00 0.00 C ATOM 1378 NE ARG B 26 4.844 -12.449 23.593 1.00 0.00 N ATOM 1379 CZ ARG B 26 3.733 -12.469 22.906 1.00 0.00 C ATOM 1380 NH1 ARG B 26 3.470 -11.514 22.054 1.00 0.00 N ATOM 1381 NH2 ARG B 26 2.882 -13.445 23.074 1.00 0.00 N ATOM 0 H ARG B 26 10.473 -10.516 22.683 1.00 0.00 H new ATOM 0 HA ARG B 26 9.238 -11.305 25.336 1.00 0.00 H new ATOM 0 HB2 ARG B 26 8.244 -10.895 22.680 1.00 0.00 H new ATOM 0 HB3 ARG B 26 8.387 -12.635 22.837 1.00 0.00 H new ATOM 0 HG2 ARG B 26 6.882 -12.730 24.680 1.00 0.00 H new ATOM 0 HG3 ARG B 26 7.128 -11.046 25.098 1.00 0.00 H new ATOM 0 HD2 ARG B 26 5.411 -10.387 23.709 1.00 0.00 H new ATOM 0 HD3 ARG B 26 6.106 -11.247 22.349 1.00 0.00 H new ATOM 0 HE ARG B 26 5.040 -13.191 24.265 1.00 0.00 H new ATOM 0 HH11 ARG B 26 4.133 -10.750 21.924 1.00 0.00 H new ATOM 0 HH12 ARG B 26 2.602 -11.533 21.519 1.00 0.00 H new ATOM 0 HH21 ARG B 26 3.085 -14.190 23.741 1.00 0.00 H new ATOM 0 HH22 ARG B 26 2.014 -13.463 22.539 1.00 0.00 H new ATOM 1395 N GLU B 27 11.600 -12.709 24.724 1.00 0.00 N ATOM 1396 CA GLU B 27 12.461 -13.927 24.784 1.00 0.00 C ATOM 1397 C GLU B 27 12.790 -14.267 26.240 1.00 0.00 C ATOM 1398 O GLU B 27 13.313 -13.447 26.966 1.00 0.00 O ATOM 1399 CB GLU B 27 13.731 -13.555 24.020 1.00 0.00 C ATOM 1400 CG GLU B 27 14.747 -14.692 24.134 1.00 0.00 C ATOM 1401 CD GLU B 27 15.478 -14.861 22.801 1.00 0.00 C ATOM 1402 OE1 GLU B 27 14.992 -15.613 21.972 1.00 0.00 O ATOM 1403 OE2 GLU B 27 16.513 -14.238 22.632 1.00 0.00 O ATOM 0 H GLU B 27 12.058 -11.839 24.996 1.00 0.00 H new ATOM 0 HA GLU B 27 11.971 -14.801 24.355 1.00 0.00 H new ATOM 0 HB2 GLU B 27 13.496 -13.367 22.972 1.00 0.00 H new ATOM 0 HB3 GLU B 27 14.153 -12.634 24.422 1.00 0.00 H new ATOM 0 HG2 GLU B 27 15.462 -14.476 24.928 1.00 0.00 H new ATOM 0 HG3 GLU B 27 14.242 -15.619 24.404 1.00 0.00 H new ATOM 1410 N PRO B 28 12.468 -15.476 26.617 1.00 0.00 N ATOM 1411 CA PRO B 28 12.749 -15.895 28.018 1.00 0.00 C ATOM 1412 C PRO B 28 14.257 -15.894 28.281 1.00 0.00 C ATOM 1413 O PRO B 28 14.868 -16.932 28.452 1.00 0.00 O ATOM 1414 CB PRO B 28 12.189 -17.314 28.117 1.00 0.00 C ATOM 1415 CG PRO B 28 11.298 -17.477 26.929 1.00 0.00 C ATOM 1416 CD PRO B 28 11.816 -16.553 25.865 1.00 0.00 C ATOM 0 HA PRO B 28 12.302 -15.223 28.750 1.00 0.00 H new ATOM 0 HB2 PRO B 28 12.990 -18.053 28.111 1.00 0.00 H new ATOM 0 HB3 PRO B 28 11.635 -17.453 29.045 1.00 0.00 H new ATOM 0 HG2 PRO B 28 11.305 -18.510 26.580 1.00 0.00 H new ATOM 0 HG3 PRO B 28 10.267 -17.233 27.184 1.00 0.00 H new ATOM 0 HD2 PRO B 28 12.519 -17.060 25.204 1.00 0.00 H new ATOM 0 HD3 PRO B 28 11.009 -16.171 25.240 1.00 0.00 H new ATOM 1424 N ARG B 29 14.863 -14.740 28.317 1.00 0.00 N ATOM 1425 CA ARG B 29 16.331 -14.680 28.572 1.00 0.00 C ATOM 1426 C ARG B 29 16.794 -13.223 28.656 1.00 0.00 C ATOM 1427 O ARG B 29 16.876 -12.649 29.724 1.00 0.00 O ATOM 1428 CB ARG B 29 16.969 -15.378 27.371 1.00 0.00 C ATOM 1429 CG ARG B 29 18.104 -16.282 27.855 1.00 0.00 C ATOM 1430 CD ARG B 29 19.421 -15.834 27.219 1.00 0.00 C ATOM 1431 NE ARG B 29 20.363 -16.966 27.447 1.00 0.00 N ATOM 1432 CZ ARG B 29 21.444 -17.074 26.723 1.00 0.00 C ATOM 1433 NH1 ARG B 29 21.709 -16.188 25.801 1.00 0.00 N ATOM 1434 NH2 ARG B 29 22.264 -18.070 26.923 1.00 0.00 N ATOM 0 H ARG B 29 14.407 -13.838 28.181 1.00 0.00 H new ATOM 0 HA ARG B 29 16.607 -15.155 29.513 1.00 0.00 H new ATOM 0 HB2 ARG B 29 16.222 -15.967 26.839 1.00 0.00 H new ATOM 0 HB3 ARG B 29 17.352 -14.639 26.668 1.00 0.00 H new ATOM 0 HG2 ARG B 29 18.179 -16.238 28.942 1.00 0.00 H new ATOM 0 HG3 ARG B 29 17.895 -17.319 27.591 1.00 0.00 H new ATOM 0 HD2 ARG B 29 19.297 -15.632 26.155 1.00 0.00 H new ATOM 0 HD3 ARG B 29 19.789 -14.916 27.677 1.00 0.00 H new ATOM 0 HE ARG B 29 20.163 -17.657 28.170 1.00 0.00 H new ATOM 0 HH11 ARG B 29 21.070 -15.408 25.645 1.00 0.00 H new ATOM 0 HH12 ARG B 29 22.555 -16.276 25.237 1.00 0.00 H new ATOM 0 HH21 ARG B 29 22.060 -18.762 27.644 1.00 0.00 H new ATOM 0 HH22 ARG B 29 23.109 -18.156 26.358 1.00 0.00 H new TER 1448 ARG B 29