USER MOD reduce.3.24.130724 H: found=0, std=0, add=871, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 872 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 116 GLN : amide:sc= 0.652 X(o=1.3,f=0.85) USER MOD Set 1.2: A 120 THR OG1 : rot -109:sc= 0.623 USER MOD Set 2.1: A 56 THR OG1 : rot 170:sc= 1.72 USER MOD Set 2.2: A 92 SER OG : rot 180:sc= 1.01 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -169:sc= 1.16 (180deg=1.04) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 82:sc= 0.819 USER MOD Single : A 10 SER OG : rot 38:sc= 1 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 HIS : no HE2:sc= -0.0623 K(o=-0.062,f=-1) USER MOD Single : A 25 LYS NZ :NH3+ 171:sc= 1.3 (180deg=1.23) USER MOD Single : A 32 THR OG1 : rot 180:sc=-0.00658 USER MOD Single : A 33 THR OG1 : rot -156:sc= 0.894 USER MOD Single : A 35 THR OG1 : rot 150:sc= -0.0267 USER MOD Single : A 37 HIS : no HE2:sc= -0.0409 K(o=-0.041,f=-0.83) USER MOD Single : A 47 SER OG : rot 2:sc= 0.485 USER MOD Single : A 54 SER OG : rot 180:sc= 0.687 USER MOD Single : A 55 SER OG : rot 180:sc= 0.0922 USER MOD Single : A 65 ASN : amide:sc= -0.298 X(o=-0.3,f=-0.011) USER MOD Single : A 67 SER OG : rot 180:sc= 0.0383 USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= 1.03 K(o=1,f=-0.016) USER MOD Single : A 76 GLN : amide:sc= 1.02 K(o=1,f=-0.42) USER MOD Single : A 77 LYS NZ :NH3+ 162:sc= 0.816 (180deg=0.201) USER MOD Single : A 81 SER OG : rot 116:sc= 1.27 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 ASN : amide:sc= -0.0544 X(o=-0.054,f=0) USER MOD Single : A 112 SER OG : rot 72:sc= 1.25 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 100:sc= 0.868 USER MOD Single : A 122 LYS NZ :NH3+ 174:sc= 0.692 (180deg=0.672) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 144 ASN : amide:sc= 0.759 K(o=0.76,f=0) USER MOD Single : A 147 LYS NZ :NH3+ -161:sc= 1.1 (180deg=0.884) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.675 -2.129 1.728 1.00 0.00 N ATOM 2 CA MET A 1 2.879 -1.350 0.487 1.00 0.00 C ATOM 3 C MET A 1 4.016 -0.351 0.703 1.00 0.00 C ATOM 4 O MET A 1 4.049 0.349 1.720 1.00 0.00 O ATOM 5 CB MET A 1 1.583 -0.658 0.016 1.00 0.00 C ATOM 6 CG MET A 1 1.772 0.101 -1.305 1.00 0.00 C ATOM 7 SD MET A 1 2.446 -0.892 -2.670 1.00 0.00 S ATOM 8 CE MET A 1 2.676 0.412 -3.909 1.00 0.00 C ATOM 0 H1 MET A 1 2.039 -2.929 1.535 1.00 0.00 H new ATOM 0 H2 MET A 1 3.590 -2.488 2.067 1.00 0.00 H new ATOM 0 H3 MET A 1 2.252 -1.518 2.456 1.00 0.00 H new ATOM 0 HA MET A 1 3.157 -2.034 -0.315 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.799 -1.405 -0.106 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.244 0.036 0.785 1.00 0.00 H new ATOM 0 HG2 MET A 1 0.810 0.509 -1.613 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.436 0.947 -1.129 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.086 -0.021 -4.821 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.716 0.878 -4.129 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.364 1.164 -3.523 1.00 0.00 H new ATOM 20 N ALA A 2 4.955 -0.285 -0.245 1.00 0.00 N ATOM 21 CA ALA A 2 6.189 0.474 -0.126 1.00 0.00 C ATOM 22 C ALA A 2 6.668 0.915 -1.512 1.00 0.00 C ATOM 23 O ALA A 2 6.200 0.407 -2.533 1.00 0.00 O ATOM 24 CB ALA A 2 7.244 -0.421 0.532 1.00 0.00 C ATOM 0 H ALA A 2 4.869 -0.773 -1.137 1.00 0.00 H new ATOM 0 HA ALA A 2 6.023 1.364 0.481 1.00 0.00 H new ATOM 0 HB1 ALA A 2 8.179 0.131 0.631 1.00 0.00 H new ATOM 0 HB2 ALA A 2 6.897 -0.727 1.519 1.00 0.00 H new ATOM 0 HB3 ALA A 2 7.407 -1.305 -0.085 1.00 0.00 H new ATOM 30 N ASP A 3 7.653 1.810 -1.529 1.00 0.00 N ATOM 31 CA ASP A 3 8.405 2.224 -2.708 1.00 0.00 C ATOM 32 C ASP A 3 9.771 1.539 -2.762 1.00 0.00 C ATOM 33 O ASP A 3 10.334 1.379 -3.846 1.00 0.00 O ATOM 34 CB ASP A 3 8.631 3.737 -2.671 1.00 0.00 C ATOM 35 CG ASP A 3 9.215 4.243 -4.001 1.00 0.00 C ATOM 36 OD1 ASP A 3 8.508 4.178 -5.033 1.00 0.00 O ATOM 37 OD2 ASP A 3 10.354 4.755 -4.008 1.00 0.00 O ATOM 0 H ASP A 3 7.962 2.287 -0.682 1.00 0.00 H new ATOM 0 HA ASP A 3 7.826 1.941 -3.587 1.00 0.00 H new ATOM 0 HB2 ASP A 3 7.687 4.244 -2.469 1.00 0.00 H new ATOM 0 HB3 ASP A 3 9.309 3.987 -1.854 1.00 0.00 H new ATOM 42 N ILE A 4 10.286 1.105 -1.603 1.00 0.00 N ATOM 43 CA ILE A 4 11.594 0.477 -1.466 1.00 0.00 C ATOM 44 C ILE A 4 11.407 -0.814 -0.667 1.00 0.00 C ATOM 45 O ILE A 4 10.914 -0.778 0.464 1.00 0.00 O ATOM 46 CB ILE A 4 12.599 1.429 -0.765 1.00 0.00 C ATOM 47 CG1 ILE A 4 12.626 2.859 -1.361 1.00 0.00 C ATOM 48 CG2 ILE A 4 14.002 0.801 -0.825 1.00 0.00 C ATOM 49 CD1 ILE A 4 13.493 3.870 -0.599 1.00 0.00 C ATOM 0 H ILE A 4 9.787 1.186 -0.717 1.00 0.00 H new ATOM 0 HA ILE A 4 12.009 0.253 -2.449 1.00 0.00 H new ATOM 0 HB ILE A 4 12.267 1.546 0.267 1.00 0.00 H new ATOM 0 HG12 ILE A 4 12.984 2.800 -2.389 1.00 0.00 H new ATOM 0 HG13 ILE A 4 11.605 3.238 -1.401 1.00 0.00 H new ATOM 0 HG21 ILE A 4 14.718 1.461 -0.335 1.00 0.00 H new ATOM 0 HG22 ILE A 4 13.991 -0.163 -0.317 1.00 0.00 H new ATOM 0 HG23 ILE A 4 14.293 0.659 -1.866 1.00 0.00 H new ATOM 0 HD11 ILE A 4 13.444 4.839 -1.096 1.00 0.00 H new ATOM 0 HD12 ILE A 4 13.125 3.968 0.422 1.00 0.00 H new ATOM 0 HD13 ILE A 4 14.526 3.523 -0.581 1.00 0.00 H new ATOM 61 N THR A 5 11.794 -1.951 -1.247 1.00 0.00 N ATOM 62 CA THR A 5 11.887 -3.213 -0.526 1.00 0.00 C ATOM 63 C THR A 5 13.281 -3.210 0.130 1.00 0.00 C ATOM 64 O THR A 5 14.267 -2.849 -0.523 1.00 0.00 O ATOM 65 CB THR A 5 11.634 -4.398 -1.503 1.00 0.00 C ATOM 66 OG1 THR A 5 11.605 -5.629 -0.820 1.00 0.00 O ATOM 67 CG2 THR A 5 12.639 -4.516 -2.651 1.00 0.00 C ATOM 0 H THR A 5 12.051 -2.019 -2.232 1.00 0.00 H new ATOM 0 HA THR A 5 11.131 -3.332 0.250 1.00 0.00 H new ATOM 0 HB THR A 5 10.664 -4.167 -1.943 1.00 0.00 H new ATOM 0 HG1 THR A 5 11.443 -6.354 -1.459 1.00 0.00 H new ATOM 0 HG21 THR A 5 12.379 -5.370 -3.276 1.00 0.00 H new ATOM 0 HG22 THR A 5 12.614 -3.606 -3.251 1.00 0.00 H new ATOM 0 HG23 THR A 5 13.641 -4.655 -2.245 1.00 0.00 H new ATOM 75 N LEU A 6 13.377 -3.573 1.414 1.00 0.00 N ATOM 76 CA LEU A 6 14.639 -3.734 2.135 1.00 0.00 C ATOM 77 C LEU A 6 14.778 -5.215 2.416 1.00 0.00 C ATOM 78 O LEU A 6 14.192 -5.739 3.364 1.00 0.00 O ATOM 79 CB LEU A 6 14.697 -2.949 3.455 1.00 0.00 C ATOM 80 CG LEU A 6 15.115 -1.481 3.287 1.00 0.00 C ATOM 81 CD1 LEU A 6 13.898 -0.611 2.965 1.00 0.00 C ATOM 82 CD2 LEU A 6 15.843 -0.998 4.545 1.00 0.00 C ATOM 0 H LEU A 6 12.559 -3.767 1.992 1.00 0.00 H new ATOM 0 HA LEU A 6 15.451 -3.338 1.525 1.00 0.00 H new ATOM 0 HB2 LEU A 6 13.717 -2.986 3.932 1.00 0.00 H new ATOM 0 HB3 LEU A 6 15.398 -3.441 4.129 1.00 0.00 H new ATOM 0 HG LEU A 6 15.805 -1.397 2.448 1.00 0.00 H new ATOM 0 HD11 LEU A 6 14.213 0.426 2.849 1.00 0.00 H new ATOM 0 HD12 LEU A 6 13.439 -0.956 2.039 1.00 0.00 H new ATOM 0 HD13 LEU A 6 13.175 -0.682 3.777 1.00 0.00 H new ATOM 0 HD21 LEU A 6 16.136 0.044 4.418 1.00 0.00 H new ATOM 0 HD22 LEU A 6 15.180 -1.086 5.406 1.00 0.00 H new ATOM 0 HD23 LEU A 6 16.732 -1.608 4.708 1.00 0.00 H new ATOM 94 N ILE A 7 15.520 -5.887 1.551 1.00 0.00 N ATOM 95 CA ILE A 7 15.628 -7.332 1.538 1.00 0.00 C ATOM 96 C ILE A 7 16.838 -7.716 2.386 1.00 0.00 C ATOM 97 O ILE A 7 17.981 -7.522 1.967 1.00 0.00 O ATOM 98 CB ILE A 7 15.707 -7.830 0.077 1.00 0.00 C ATOM 99 CG1 ILE A 7 14.387 -7.482 -0.653 1.00 0.00 C ATOM 100 CG2 ILE A 7 15.980 -9.342 0.025 1.00 0.00 C ATOM 101 CD1 ILE A 7 14.319 -7.952 -2.109 1.00 0.00 C ATOM 0 H ILE A 7 16.074 -5.432 0.825 1.00 0.00 H new ATOM 0 HA ILE A 7 14.752 -7.814 1.972 1.00 0.00 H new ATOM 0 HB ILE A 7 16.536 -7.332 -0.425 1.00 0.00 H new ATOM 0 HG12 ILE A 7 13.556 -7.924 -0.103 1.00 0.00 H new ATOM 0 HG13 ILE A 7 14.247 -6.401 -0.627 1.00 0.00 H new ATOM 0 HG21 ILE A 7 16.031 -9.667 -1.014 1.00 0.00 H new ATOM 0 HG22 ILE A 7 16.927 -9.558 0.520 1.00 0.00 H new ATOM 0 HG23 ILE A 7 15.176 -9.875 0.533 1.00 0.00 H new ATOM 0 HD11 ILE A 7 13.360 -7.665 -2.540 1.00 0.00 H new ATOM 0 HD12 ILE A 7 15.125 -7.490 -2.679 1.00 0.00 H new ATOM 0 HD13 ILE A 7 14.423 -9.036 -2.147 1.00 0.00 H new ATOM 113 N SER A 8 16.588 -8.268 3.572 1.00 0.00 N ATOM 114 CA SER A 8 17.615 -8.887 4.397 1.00 0.00 C ATOM 115 C SER A 8 17.625 -10.373 4.021 1.00 0.00 C ATOM 116 O SER A 8 16.779 -11.132 4.493 1.00 0.00 O ATOM 117 CB SER A 8 17.333 -8.640 5.889 1.00 0.00 C ATOM 118 OG SER A 8 16.837 -7.333 6.125 1.00 0.00 O ATOM 0 H SER A 8 15.657 -8.297 3.988 1.00 0.00 H new ATOM 0 HA SER A 8 18.601 -8.458 4.221 1.00 0.00 H new ATOM 0 HB2 SER A 8 16.610 -9.373 6.248 1.00 0.00 H new ATOM 0 HB3 SER A 8 18.249 -8.789 6.461 1.00 0.00 H new ATOM 0 HG SER A 8 15.875 -7.310 5.939 1.00 0.00 H new ATOM 124 N GLY A 9 18.505 -10.788 3.107 1.00 0.00 N ATOM 125 CA GLY A 9 18.466 -12.121 2.506 1.00 0.00 C ATOM 126 C GLY A 9 19.654 -13.012 2.849 1.00 0.00 C ATOM 127 O GLY A 9 19.670 -14.161 2.404 1.00 0.00 O ATOM 0 H GLY A 9 19.268 -10.205 2.762 1.00 0.00 H new ATOM 0 HA2 GLY A 9 17.551 -12.621 2.824 1.00 0.00 H new ATOM 0 HA3 GLY A 9 18.411 -12.014 1.423 1.00 0.00 H new ATOM 131 N SER A 10 20.617 -12.544 3.648 1.00 0.00 N ATOM 132 CA SER A 10 21.699 -13.372 4.178 1.00 0.00 C ATOM 133 C SER A 10 21.109 -14.542 4.979 1.00 0.00 C ATOM 134 O SER A 10 20.591 -14.344 6.077 1.00 0.00 O ATOM 135 CB SER A 10 22.680 -12.534 5.014 1.00 0.00 C ATOM 136 OG SER A 10 22.073 -11.403 5.616 1.00 0.00 O ATOM 0 H SER A 10 20.666 -11.570 3.947 1.00 0.00 H new ATOM 0 HA SER A 10 22.273 -13.785 3.348 1.00 0.00 H new ATOM 0 HB2 SER A 10 23.114 -13.163 5.791 1.00 0.00 H new ATOM 0 HB3 SER A 10 23.500 -12.203 4.377 1.00 0.00 H new ATOM 0 HG SER A 10 21.167 -11.635 5.908 1.00 0.00 H new ATOM 142 N THR A 11 21.154 -15.753 4.419 1.00 0.00 N ATOM 143 CA THR A 11 20.479 -16.944 4.936 1.00 0.00 C ATOM 144 C THR A 11 19.011 -16.614 5.305 1.00 0.00 C ATOM 145 O THR A 11 18.515 -16.999 6.366 1.00 0.00 O ATOM 146 CB THR A 11 21.333 -17.564 6.069 1.00 0.00 C ATOM 147 OG1 THR A 11 22.715 -17.507 5.747 1.00 0.00 O ATOM 148 CG2 THR A 11 21.012 -19.043 6.316 1.00 0.00 C ATOM 0 H THR A 11 21.679 -15.937 3.564 1.00 0.00 H new ATOM 0 HA THR A 11 20.398 -17.719 4.173 1.00 0.00 H new ATOM 0 HB THR A 11 21.096 -16.980 6.958 1.00 0.00 H new ATOM 0 HG1 THR A 11 23.237 -17.902 6.476 1.00 0.00 H new ATOM 0 HG21 THR A 11 21.642 -19.422 7.121 1.00 0.00 H new ATOM 0 HG22 THR A 11 19.964 -19.146 6.596 1.00 0.00 H new ATOM 0 HG23 THR A 11 21.202 -19.613 5.407 1.00 0.00 H new ATOM 156 N LEU A 12 18.317 -15.874 4.420 1.00 0.00 N ATOM 157 CA LEU A 12 16.928 -15.422 4.584 1.00 0.00 C ATOM 158 C LEU A 12 16.727 -14.646 5.893 1.00 0.00 C ATOM 159 O LEU A 12 15.821 -14.915 6.683 1.00 0.00 O ATOM 160 CB LEU A 12 15.978 -16.615 4.407 1.00 0.00 C ATOM 161 CG LEU A 12 14.524 -16.243 4.051 1.00 0.00 C ATOM 162 CD1 LEU A 12 14.410 -15.720 2.613 1.00 0.00 C ATOM 163 CD2 LEU A 12 13.625 -17.476 4.191 1.00 0.00 C ATOM 0 H LEU A 12 18.727 -15.564 3.539 1.00 0.00 H new ATOM 0 HA LEU A 12 16.685 -14.701 3.804 1.00 0.00 H new ATOM 0 HB2 LEU A 12 16.374 -17.262 3.624 1.00 0.00 H new ATOM 0 HB3 LEU A 12 15.973 -17.196 5.329 1.00 0.00 H new ATOM 0 HG LEU A 12 14.210 -15.457 4.737 1.00 0.00 H new ATOM 0 HD11 LEU A 12 13.371 -15.468 2.399 1.00 0.00 H new ATOM 0 HD12 LEU A 12 15.030 -14.831 2.499 1.00 0.00 H new ATOM 0 HD13 LEU A 12 14.748 -16.489 1.918 1.00 0.00 H new ATOM 0 HD21 LEU A 12 12.599 -17.209 3.939 1.00 0.00 H new ATOM 0 HD22 LEU A 12 13.973 -18.258 3.516 1.00 0.00 H new ATOM 0 HD23 LEU A 12 13.663 -17.839 5.218 1.00 0.00 H new ATOM 175 N GLY A 13 17.632 -13.702 6.132 1.00 0.00 N ATOM 176 CA GLY A 13 17.693 -12.871 7.326 1.00 0.00 C ATOM 177 C GLY A 13 18.794 -11.819 7.197 1.00 0.00 C ATOM 178 O GLY A 13 19.397 -11.661 6.134 1.00 0.00 O ATOM 0 H GLY A 13 18.376 -13.487 5.468 1.00 0.00 H new ATOM 0 HA2 GLY A 13 16.732 -12.381 7.484 1.00 0.00 H new ATOM 0 HA3 GLY A 13 17.880 -13.495 8.200 1.00 0.00 H new ATOM 182 N GLY A 14 19.060 -11.076 8.268 1.00 0.00 N ATOM 183 CA GLY A 14 20.116 -10.073 8.306 1.00 0.00 C ATOM 184 C GLY A 14 19.976 -9.200 9.548 1.00 0.00 C ATOM 185 O GLY A 14 19.232 -9.541 10.473 1.00 0.00 O ATOM 0 H GLY A 14 18.542 -11.156 9.143 1.00 0.00 H new ATOM 0 HA2 GLY A 14 21.090 -10.562 8.305 1.00 0.00 H new ATOM 0 HA3 GLY A 14 20.070 -9.453 7.411 1.00 0.00 H new ATOM 189 N ALA A 15 20.687 -8.071 9.562 1.00 0.00 N ATOM 190 CA ALA A 15 20.666 -7.062 10.620 1.00 0.00 C ATOM 191 C ALA A 15 19.374 -6.227 10.568 1.00 0.00 C ATOM 192 O ALA A 15 19.411 -4.998 10.460 1.00 0.00 O ATOM 193 CB ALA A 15 21.928 -6.197 10.504 1.00 0.00 C ATOM 0 H ALA A 15 21.321 -7.825 8.802 1.00 0.00 H new ATOM 0 HA ALA A 15 20.669 -7.549 11.595 1.00 0.00 H new ATOM 0 HB1 ALA A 15 21.924 -5.440 11.288 1.00 0.00 H new ATOM 0 HB2 ALA A 15 22.812 -6.826 10.612 1.00 0.00 H new ATOM 0 HB3 ALA A 15 21.947 -5.709 9.529 1.00 0.00 H new ATOM 199 N GLU A 16 18.218 -6.895 10.618 1.00 0.00 N ATOM 200 CA GLU A 16 16.893 -6.292 10.488 1.00 0.00 C ATOM 201 C GLU A 16 16.678 -5.149 11.489 1.00 0.00 C ATOM 202 O GLU A 16 15.991 -4.181 11.167 1.00 0.00 O ATOM 203 CB GLU A 16 15.804 -7.357 10.674 1.00 0.00 C ATOM 204 CG GLU A 16 15.723 -8.348 9.504 1.00 0.00 C ATOM 205 CD GLU A 16 14.693 -9.452 9.796 1.00 0.00 C ATOM 206 OE1 GLU A 16 13.474 -9.205 9.656 1.00 0.00 O ATOM 207 OE2 GLU A 16 15.097 -10.574 10.179 1.00 0.00 O ATOM 0 H GLU A 16 18.180 -7.905 10.755 1.00 0.00 H new ATOM 0 HA GLU A 16 16.827 -5.871 9.485 1.00 0.00 H new ATOM 0 HB2 GLU A 16 15.996 -7.907 11.595 1.00 0.00 H new ATOM 0 HB3 GLU A 16 14.839 -6.864 10.792 1.00 0.00 H new ATOM 0 HG2 GLU A 16 15.448 -7.819 8.592 1.00 0.00 H new ATOM 0 HG3 GLU A 16 16.702 -8.794 9.331 1.00 0.00 H new ATOM 214 N TYR A 17 17.296 -5.227 12.673 1.00 0.00 N ATOM 215 CA TYR A 17 17.224 -4.190 13.698 1.00 0.00 C ATOM 216 C TYR A 17 17.672 -2.826 13.158 1.00 0.00 C ATOM 217 O TYR A 17 17.037 -1.811 13.449 1.00 0.00 O ATOM 218 CB TYR A 17 18.079 -4.618 14.901 1.00 0.00 C ATOM 219 CG TYR A 17 18.099 -3.619 16.045 1.00 0.00 C ATOM 220 CD1 TYR A 17 16.969 -3.480 16.875 1.00 0.00 C ATOM 221 CD2 TYR A 17 19.241 -2.827 16.278 1.00 0.00 C ATOM 222 CE1 TYR A 17 16.977 -2.552 17.932 1.00 0.00 C ATOM 223 CE2 TYR A 17 19.256 -1.896 17.333 1.00 0.00 C ATOM 224 CZ TYR A 17 18.121 -1.754 18.167 1.00 0.00 C ATOM 225 OH TYR A 17 18.116 -0.859 19.194 1.00 0.00 O ATOM 0 H TYR A 17 17.868 -6.026 12.946 1.00 0.00 H new ATOM 0 HA TYR A 17 16.186 -4.075 14.012 1.00 0.00 H new ATOM 0 HB2 TYR A 17 17.707 -5.572 15.275 1.00 0.00 H new ATOM 0 HB3 TYR A 17 19.102 -4.785 14.563 1.00 0.00 H new ATOM 0 HD1 TYR A 17 16.094 -4.088 16.699 1.00 0.00 H new ATOM 0 HD2 TYR A 17 20.109 -2.935 15.644 1.00 0.00 H new ATOM 0 HE1 TYR A 17 16.108 -2.449 18.565 1.00 0.00 H new ATOM 0 HE2 TYR A 17 20.133 -1.290 17.506 1.00 0.00 H new ATOM 0 HH TYR A 17 18.976 -0.390 19.223 1.00 0.00 H new ATOM 235 N VAL A 18 18.734 -2.789 12.343 1.00 0.00 N ATOM 236 CA VAL A 18 19.243 -1.547 11.774 1.00 0.00 C ATOM 237 C VAL A 18 18.580 -1.297 10.413 1.00 0.00 C ATOM 238 O VAL A 18 18.352 -0.140 10.060 1.00 0.00 O ATOM 239 CB VAL A 18 20.783 -1.587 11.680 1.00 0.00 C ATOM 240 CG1 VAL A 18 21.329 -0.177 11.388 1.00 0.00 C ATOM 241 CG2 VAL A 18 21.461 -2.092 12.967 1.00 0.00 C ATOM 0 H VAL A 18 19.258 -3.618 12.064 1.00 0.00 H new ATOM 0 HA VAL A 18 18.990 -0.711 12.426 1.00 0.00 H new ATOM 0 HB VAL A 18 21.014 -2.285 10.875 1.00 0.00 H new ATOM 0 HG11 VAL A 18 22.416 -0.214 11.323 1.00 0.00 H new ATOM 0 HG12 VAL A 18 20.921 0.183 10.443 1.00 0.00 H new ATOM 0 HG13 VAL A 18 21.036 0.500 12.191 1.00 0.00 H new ATOM 0 HG21 VAL A 18 22.543 -2.095 12.832 1.00 0.00 H new ATOM 0 HG22 VAL A 18 21.201 -1.435 13.797 1.00 0.00 H new ATOM 0 HG23 VAL A 18 21.120 -3.104 13.185 1.00 0.00 H new ATOM 251 N ALA A 19 18.196 -2.347 9.672 1.00 0.00 N ATOM 252 CA ALA A 19 17.431 -2.183 8.440 1.00 0.00 C ATOM 253 C ALA A 19 16.118 -1.440 8.714 1.00 0.00 C ATOM 254 O ALA A 19 15.724 -0.599 7.912 1.00 0.00 O ATOM 255 CB ALA A 19 17.166 -3.533 7.770 1.00 0.00 C ATOM 0 H ALA A 19 18.406 -3.317 9.910 1.00 0.00 H new ATOM 0 HA ALA A 19 18.026 -1.583 7.751 1.00 0.00 H new ATOM 0 HB1 ALA A 19 16.594 -3.379 6.855 1.00 0.00 H new ATOM 0 HB2 ALA A 19 18.115 -4.012 7.529 1.00 0.00 H new ATOM 0 HB3 ALA A 19 16.600 -4.171 8.448 1.00 0.00 H new ATOM 261 N GLU A 20 15.468 -1.691 9.854 1.00 0.00 N ATOM 262 CA GLU A 20 14.259 -0.977 10.244 1.00 0.00 C ATOM 263 C GLU A 20 14.546 0.518 10.444 1.00 0.00 C ATOM 264 O GLU A 20 13.741 1.358 10.046 1.00 0.00 O ATOM 265 CB GLU A 20 13.673 -1.621 11.510 1.00 0.00 C ATOM 266 CG GLU A 20 12.265 -1.096 11.813 1.00 0.00 C ATOM 267 CD GLU A 20 11.662 -1.778 13.053 1.00 0.00 C ATOM 268 OE1 GLU A 20 11.895 -1.307 14.189 1.00 0.00 O ATOM 269 OE2 GLU A 20 10.925 -2.780 12.906 1.00 0.00 O ATOM 0 H GLU A 20 15.768 -2.395 10.528 1.00 0.00 H new ATOM 0 HA GLU A 20 13.521 -1.052 9.446 1.00 0.00 H new ATOM 0 HB2 GLU A 20 13.639 -2.703 11.385 1.00 0.00 H new ATOM 0 HB3 GLU A 20 14.327 -1.418 12.358 1.00 0.00 H new ATOM 0 HG2 GLU A 20 12.304 -0.018 11.972 1.00 0.00 H new ATOM 0 HG3 GLU A 20 11.619 -1.268 10.952 1.00 0.00 H new ATOM 276 N HIS A 21 15.700 0.869 11.022 1.00 0.00 N ATOM 277 CA HIS A 21 16.083 2.263 11.217 1.00 0.00 C ATOM 278 C HIS A 21 16.337 2.939 9.864 1.00 0.00 C ATOM 279 O HIS A 21 15.912 4.076 9.653 1.00 0.00 O ATOM 280 CB HIS A 21 17.319 2.349 12.122 1.00 0.00 C ATOM 281 CG HIS A 21 17.548 3.731 12.685 1.00 0.00 C ATOM 282 ND1 HIS A 21 17.552 4.921 11.990 1.00 0.00 N ATOM 283 CD2 HIS A 21 17.753 4.036 14.002 1.00 0.00 C ATOM 284 CE1 HIS A 21 17.765 5.916 12.868 1.00 0.00 C ATOM 285 NE2 HIS A 21 17.899 5.426 14.115 1.00 0.00 N ATOM 0 H HIS A 21 16.387 0.197 11.364 1.00 0.00 H new ATOM 0 HA HIS A 21 15.266 2.792 11.708 1.00 0.00 H new ATOM 0 HB2 HIS A 21 17.209 1.642 12.944 1.00 0.00 H new ATOM 0 HB3 HIS A 21 18.199 2.044 11.555 1.00 0.00 H new ATOM 0 HD1 HIS A 21 17.417 5.028 10.985 1.00 0.00 H new ATOM 0 HD2 HIS A 21 17.795 3.327 14.816 1.00 0.00 H new ATOM 0 HE1 HIS A 21 17.821 6.963 12.609 1.00 0.00 H new ATOM 293 N LEU A 22 17.020 2.250 8.945 1.00 0.00 N ATOM 294 CA LEU A 22 17.278 2.738 7.592 1.00 0.00 C ATOM 295 C LEU A 22 15.957 3.006 6.875 1.00 0.00 C ATOM 296 O LEU A 22 15.733 4.100 6.354 1.00 0.00 O ATOM 297 CB LEU A 22 18.071 1.682 6.802 1.00 0.00 C ATOM 298 CG LEU A 22 19.577 1.602 7.115 1.00 0.00 C ATOM 299 CD1 LEU A 22 20.163 0.399 6.368 1.00 0.00 C ATOM 300 CD2 LEU A 22 20.343 2.863 6.705 1.00 0.00 C ATOM 0 H LEU A 22 17.413 1.326 9.125 1.00 0.00 H new ATOM 0 HA LEU A 22 17.854 3.661 7.654 1.00 0.00 H new ATOM 0 HB2 LEU A 22 17.627 0.705 6.992 1.00 0.00 H new ATOM 0 HB3 LEU A 22 17.951 1.885 5.738 1.00 0.00 H new ATOM 0 HG LEU A 22 19.684 1.500 8.195 1.00 0.00 H new ATOM 0 HD11 LEU A 22 21.230 0.325 6.577 1.00 0.00 H new ATOM 0 HD12 LEU A 22 19.665 -0.512 6.698 1.00 0.00 H new ATOM 0 HD13 LEU A 22 20.011 0.527 5.296 1.00 0.00 H new ATOM 0 HD21 LEU A 22 21.398 2.744 6.952 1.00 0.00 H new ATOM 0 HD22 LEU A 22 20.237 3.020 5.632 1.00 0.00 H new ATOM 0 HD23 LEU A 22 19.940 3.723 7.239 1.00 0.00 H new ATOM 312 N ALA A 23 15.087 1.996 6.876 1.00 0.00 N ATOM 313 CA ALA A 23 13.750 2.043 6.310 1.00 0.00 C ATOM 314 C ALA A 23 12.974 3.245 6.843 1.00 0.00 C ATOM 315 O ALA A 23 12.414 3.990 6.041 1.00 0.00 O ATOM 316 CB ALA A 23 13.013 0.741 6.638 1.00 0.00 C ATOM 0 H ALA A 23 15.309 1.090 7.289 1.00 0.00 H new ATOM 0 HA ALA A 23 13.828 2.151 5.228 1.00 0.00 H new ATOM 0 HB1 ALA A 23 12.009 0.774 6.214 1.00 0.00 H new ATOM 0 HB2 ALA A 23 13.558 -0.102 6.214 1.00 0.00 H new ATOM 0 HB3 ALA A 23 12.946 0.623 7.720 1.00 0.00 H new ATOM 322 N GLU A 24 12.954 3.445 8.164 1.00 0.00 N ATOM 323 CA GLU A 24 12.199 4.512 8.812 1.00 0.00 C ATOM 324 C GLU A 24 12.635 5.870 8.280 1.00 0.00 C ATOM 325 O GLU A 24 11.822 6.649 7.786 1.00 0.00 O ATOM 326 CB GLU A 24 12.425 4.452 10.330 1.00 0.00 C ATOM 327 CG GLU A 24 11.445 5.346 11.092 1.00 0.00 C ATOM 328 CD GLU A 24 11.607 5.200 12.615 1.00 0.00 C ATOM 329 OE1 GLU A 24 12.450 5.905 13.215 1.00 0.00 O ATOM 330 OE2 GLU A 24 10.871 4.398 13.236 1.00 0.00 O ATOM 0 H GLU A 24 13.471 2.859 8.820 1.00 0.00 H new ATOM 0 HA GLU A 24 11.139 4.376 8.595 1.00 0.00 H new ATOM 0 HB2 GLU A 24 12.317 3.423 10.672 1.00 0.00 H new ATOM 0 HB3 GLU A 24 13.446 4.758 10.557 1.00 0.00 H new ATOM 0 HG2 GLU A 24 11.604 6.386 10.807 1.00 0.00 H new ATOM 0 HG3 GLU A 24 10.424 5.091 10.809 1.00 0.00 H new ATOM 337 N LYS A 25 13.939 6.139 8.349 1.00 0.00 N ATOM 338 CA LYS A 25 14.512 7.377 7.845 1.00 0.00 C ATOM 339 C LYS A 25 14.192 7.604 6.374 1.00 0.00 C ATOM 340 O LYS A 25 13.917 8.733 5.977 1.00 0.00 O ATOM 341 CB LYS A 25 16.022 7.323 8.063 1.00 0.00 C ATOM 342 CG LYS A 25 16.388 7.417 9.553 1.00 0.00 C ATOM 343 CD LYS A 25 15.907 8.675 10.291 1.00 0.00 C ATOM 344 CE LYS A 25 16.129 9.974 9.501 1.00 0.00 C ATOM 345 NZ LYS A 25 15.686 11.166 10.257 1.00 0.00 N ATOM 0 H LYS A 25 14.623 5.502 8.757 1.00 0.00 H new ATOM 0 HA LYS A 25 14.074 8.215 8.387 1.00 0.00 H new ATOM 0 HB2 LYS A 25 16.416 6.394 7.650 1.00 0.00 H new ATOM 0 HB3 LYS A 25 16.497 8.140 7.520 1.00 0.00 H new ATOM 0 HG2 LYS A 25 15.979 6.544 10.062 1.00 0.00 H new ATOM 0 HG3 LYS A 25 17.473 7.360 9.644 1.00 0.00 H new ATOM 0 HD2 LYS A 25 14.845 8.572 10.513 1.00 0.00 H new ATOM 0 HD3 LYS A 25 16.427 8.747 11.246 1.00 0.00 H new ATOM 0 HE2 LYS A 25 17.186 10.073 9.256 1.00 0.00 H new ATOM 0 HE3 LYS A 25 15.586 9.921 8.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 15.990 12.026 9.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 14.649 11.161 10.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 16.107 11.150 11.208 1.00 0.00 H new ATOM 359 N LEU A 26 14.213 6.551 5.566 1.00 0.00 N ATOM 360 CA LEU A 26 13.859 6.646 4.157 1.00 0.00 C ATOM 361 C LEU A 26 12.378 6.970 3.950 1.00 0.00 C ATOM 362 O LEU A 26 12.049 7.566 2.925 1.00 0.00 O ATOM 363 CB LEU A 26 14.255 5.367 3.412 1.00 0.00 C ATOM 364 CG LEU A 26 15.739 5.341 3.009 1.00 0.00 C ATOM 365 CD1 LEU A 26 16.109 3.933 2.539 1.00 0.00 C ATOM 366 CD2 LEU A 26 16.032 6.359 1.895 1.00 0.00 C ATOM 0 H LEU A 26 14.475 5.612 5.868 1.00 0.00 H new ATOM 0 HA LEU A 26 14.423 7.479 3.738 1.00 0.00 H new ATOM 0 HB2 LEU A 26 14.040 4.504 4.043 1.00 0.00 H new ATOM 0 HB3 LEU A 26 13.640 5.269 2.518 1.00 0.00 H new ATOM 0 HG LEU A 26 16.339 5.613 3.877 1.00 0.00 H new ATOM 0 HD11 LEU A 26 17.160 3.910 2.252 1.00 0.00 H new ATOM 0 HD12 LEU A 26 15.938 3.223 3.348 1.00 0.00 H new ATOM 0 HD13 LEU A 26 15.493 3.662 1.682 1.00 0.00 H new ATOM 0 HD21 LEU A 26 17.089 6.317 1.632 1.00 0.00 H new ATOM 0 HD22 LEU A 26 15.430 6.122 1.018 1.00 0.00 H new ATOM 0 HD23 LEU A 26 15.785 7.362 2.244 1.00 0.00 H new ATOM 378 N GLU A 27 11.474 6.657 4.882 1.00 0.00 N ATOM 379 CA GLU A 27 10.115 7.139 4.780 1.00 0.00 C ATOM 380 C GLU A 27 10.101 8.658 4.968 1.00 0.00 C ATOM 381 O GLU A 27 9.483 9.368 4.173 1.00 0.00 O ATOM 382 CB GLU A 27 9.195 6.425 5.774 1.00 0.00 C ATOM 383 CG GLU A 27 9.172 4.902 5.576 1.00 0.00 C ATOM 384 CD GLU A 27 7.855 4.237 6.007 1.00 0.00 C ATOM 385 OE1 GLU A 27 7.461 4.351 7.192 1.00 0.00 O ATOM 386 OE2 GLU A 27 7.213 3.581 5.156 1.00 0.00 O ATOM 0 H GLU A 27 11.665 6.080 5.701 1.00 0.00 H new ATOM 0 HA GLU A 27 9.726 6.912 3.787 1.00 0.00 H new ATOM 0 HB2 GLU A 27 9.521 6.650 6.790 1.00 0.00 H new ATOM 0 HB3 GLU A 27 8.183 6.816 5.670 1.00 0.00 H new ATOM 0 HG2 GLU A 27 9.353 4.680 4.524 1.00 0.00 H new ATOM 0 HG3 GLU A 27 9.993 4.460 6.141 1.00 0.00 H new ATOM 393 N GLU A 28 10.852 9.183 5.946 1.00 0.00 N ATOM 394 CA GLU A 28 10.976 10.614 6.171 1.00 0.00 C ATOM 395 C GLU A 28 11.623 11.322 4.969 1.00 0.00 C ATOM 396 O GLU A 28 11.362 12.504 4.738 1.00 0.00 O ATOM 397 CB GLU A 28 11.791 10.888 7.445 1.00 0.00 C ATOM 398 CG GLU A 28 11.379 10.075 8.681 1.00 0.00 C ATOM 399 CD GLU A 28 11.745 10.798 9.988 1.00 0.00 C ATOM 400 OE1 GLU A 28 12.948 10.894 10.316 1.00 0.00 O ATOM 401 OE2 GLU A 28 10.829 11.271 10.702 1.00 0.00 O ATOM 0 H GLU A 28 11.390 8.617 6.602 1.00 0.00 H new ATOM 0 HA GLU A 28 9.970 11.015 6.296 1.00 0.00 H new ATOM 0 HB2 GLU A 28 12.841 10.688 7.234 1.00 0.00 H new ATOM 0 HB3 GLU A 28 11.711 11.948 7.686 1.00 0.00 H new ATOM 0 HG2 GLU A 28 10.305 9.893 8.655 1.00 0.00 H new ATOM 0 HG3 GLU A 28 11.868 9.101 8.655 1.00 0.00 H new ATOM 408 N ALA A 29 12.439 10.604 4.185 1.00 0.00 N ATOM 409 CA ALA A 29 13.069 11.121 2.974 1.00 0.00 C ATOM 410 C ALA A 29 12.060 11.352 1.837 1.00 0.00 C ATOM 411 O ALA A 29 12.409 12.019 0.859 1.00 0.00 O ATOM 412 CB ALA A 29 14.196 10.184 2.521 1.00 0.00 C ATOM 0 H ALA A 29 12.680 9.633 4.382 1.00 0.00 H new ATOM 0 HA ALA A 29 13.491 12.095 3.219 1.00 0.00 H new ATOM 0 HB1 ALA A 29 14.658 10.581 1.617 1.00 0.00 H new ATOM 0 HB2 ALA A 29 14.946 10.109 3.309 1.00 0.00 H new ATOM 0 HB3 ALA A 29 13.786 9.195 2.315 1.00 0.00 H new ATOM 418 N GLY A 30 10.830 10.835 1.950 1.00 0.00 N ATOM 419 CA GLY A 30 9.730 11.160 1.048 1.00 0.00 C ATOM 420 C GLY A 30 9.107 9.946 0.362 1.00 0.00 C ATOM 421 O GLY A 30 8.455 10.116 -0.671 1.00 0.00 O ATOM 0 H GLY A 30 10.573 10.172 2.681 1.00 0.00 H new ATOM 0 HA2 GLY A 30 8.956 11.683 1.610 1.00 0.00 H new ATOM 0 HA3 GLY A 30 10.091 11.849 0.285 1.00 0.00 H new ATOM 425 N PHE A 31 9.311 8.738 0.891 1.00 0.00 N ATOM 426 CA PHE A 31 8.858 7.490 0.274 1.00 0.00 C ATOM 427 C PHE A 31 8.146 6.621 1.319 1.00 0.00 C ATOM 428 O PHE A 31 7.800 7.094 2.403 1.00 0.00 O ATOM 429 CB PHE A 31 10.052 6.752 -0.364 1.00 0.00 C ATOM 430 CG PHE A 31 11.041 7.607 -1.139 1.00 0.00 C ATOM 431 CD1 PHE A 31 10.755 8.001 -2.460 1.00 0.00 C ATOM 432 CD2 PHE A 31 12.260 7.990 -0.546 1.00 0.00 C ATOM 433 CE1 PHE A 31 11.688 8.761 -3.187 1.00 0.00 C ATOM 434 CE2 PHE A 31 13.187 8.759 -1.269 1.00 0.00 C ATOM 435 CZ PHE A 31 12.907 9.134 -2.594 1.00 0.00 C ATOM 0 H PHE A 31 9.803 8.597 1.773 1.00 0.00 H new ATOM 0 HA PHE A 31 8.144 7.712 -0.519 1.00 0.00 H new ATOM 0 HB2 PHE A 31 10.595 6.234 0.427 1.00 0.00 H new ATOM 0 HB3 PHE A 31 9.661 5.988 -1.036 1.00 0.00 H new ATOM 0 HD1 PHE A 31 9.817 7.719 -2.916 1.00 0.00 H new ATOM 0 HD2 PHE A 31 12.483 7.691 0.468 1.00 0.00 H new ATOM 0 HE1 PHE A 31 11.468 9.058 -4.202 1.00 0.00 H new ATOM 0 HE2 PHE A 31 14.115 9.062 -0.807 1.00 0.00 H new ATOM 0 HZ PHE A 31 13.628 9.709 -3.157 1.00 0.00 H new ATOM 445 N THR A 32 7.938 5.344 1.006 1.00 0.00 N ATOM 446 CA THR A 32 7.486 4.330 1.948 1.00 0.00 C ATOM 447 C THR A 32 8.399 3.128 1.759 1.00 0.00 C ATOM 448 O THR A 32 8.938 2.923 0.666 1.00 0.00 O ATOM 449 CB THR A 32 6.009 3.968 1.737 1.00 0.00 C ATOM 450 OG1 THR A 32 5.680 3.885 0.359 1.00 0.00 O ATOM 451 CG2 THR A 32 5.082 4.978 2.414 1.00 0.00 C ATOM 0 H THR A 32 8.084 4.979 0.065 1.00 0.00 H new ATOM 0 HA THR A 32 7.544 4.701 2.971 1.00 0.00 H new ATOM 0 HB THR A 32 5.864 2.989 2.194 1.00 0.00 H new ATOM 0 HG1 THR A 32 4.733 3.651 0.262 1.00 0.00 H new ATOM 0 HG21 THR A 32 4.044 4.690 2.244 1.00 0.00 H new ATOM 0 HG22 THR A 32 5.283 4.995 3.485 1.00 0.00 H new ATOM 0 HG23 THR A 32 5.257 5.969 1.996 1.00 0.00 H new ATOM 459 N THR A 33 8.599 2.332 2.801 1.00 0.00 N ATOM 460 CA THR A 33 9.621 1.297 2.784 1.00 0.00 C ATOM 461 C THR A 33 9.143 0.025 3.493 1.00 0.00 C ATOM 462 O THR A 33 8.256 0.072 4.352 1.00 0.00 O ATOM 463 CB THR A 33 10.899 1.874 3.409 1.00 0.00 C ATOM 464 OG1 THR A 33 10.645 2.249 4.745 1.00 0.00 O ATOM 465 CG2 THR A 33 11.408 3.125 2.687 1.00 0.00 C ATOM 0 H THR A 33 8.066 2.384 3.669 1.00 0.00 H new ATOM 0 HA THR A 33 9.833 0.997 1.758 1.00 0.00 H new ATOM 0 HB THR A 33 11.653 1.090 3.333 1.00 0.00 H new ATOM 0 HG1 THR A 33 11.284 2.940 5.018 1.00 0.00 H new ATOM 0 HG21 THR A 33 12.313 3.485 3.176 1.00 0.00 H new ATOM 0 HG22 THR A 33 11.630 2.881 1.648 1.00 0.00 H new ATOM 0 HG23 THR A 33 10.644 3.901 2.722 1.00 0.00 H new ATOM 473 N GLU A 34 9.718 -1.123 3.125 1.00 0.00 N ATOM 474 CA GLU A 34 9.305 -2.430 3.584 1.00 0.00 C ATOM 475 C GLU A 34 10.521 -3.147 4.179 1.00 0.00 C ATOM 476 O GLU A 34 11.326 -3.715 3.439 1.00 0.00 O ATOM 477 CB GLU A 34 8.697 -3.154 2.380 1.00 0.00 C ATOM 478 CG GLU A 34 7.448 -3.923 2.761 1.00 0.00 C ATOM 479 CD GLU A 34 6.212 -3.074 3.122 1.00 0.00 C ATOM 480 OE1 GLU A 34 6.048 -2.719 4.310 1.00 0.00 O ATOM 481 OE2 GLU A 34 5.356 -2.832 2.241 1.00 0.00 O ATOM 0 H GLU A 34 10.507 -1.158 2.479 1.00 0.00 H new ATOM 0 HA GLU A 34 8.553 -2.389 4.372 1.00 0.00 H new ATOM 0 HB2 GLU A 34 8.455 -2.429 1.603 1.00 0.00 H new ATOM 0 HB3 GLU A 34 9.432 -3.840 1.958 1.00 0.00 H new ATOM 0 HG2 GLU A 34 7.183 -4.579 1.932 1.00 0.00 H new ATOM 0 HG3 GLU A 34 7.685 -4.563 3.611 1.00 0.00 H new ATOM 488 N THR A 35 10.698 -3.081 5.502 1.00 0.00 N ATOM 489 CA THR A 35 11.738 -3.851 6.183 1.00 0.00 C ATOM 490 C THR A 35 11.342 -5.327 6.143 1.00 0.00 C ATOM 491 O THR A 35 10.262 -5.684 6.625 1.00 0.00 O ATOM 492 CB THR A 35 11.942 -3.392 7.637 1.00 0.00 C ATOM 493 OG1 THR A 35 11.905 -1.984 7.750 1.00 0.00 O ATOM 494 CG2 THR A 35 13.312 -3.875 8.126 1.00 0.00 C ATOM 0 H THR A 35 10.133 -2.501 6.122 1.00 0.00 H new ATOM 0 HA THR A 35 12.686 -3.692 5.670 1.00 0.00 H new ATOM 0 HB THR A 35 11.135 -3.813 8.237 1.00 0.00 H new ATOM 0 HG1 THR A 35 11.561 -1.736 8.633 1.00 0.00 H new ATOM 0 HG21 THR A 35 13.465 -3.554 9.156 1.00 0.00 H new ATOM 0 HG22 THR A 35 13.354 -4.963 8.075 1.00 0.00 H new ATOM 0 HG23 THR A 35 14.093 -3.452 7.495 1.00 0.00 H new ATOM 502 N LEU A 36 12.187 -6.181 5.561 1.00 0.00 N ATOM 503 CA LEU A 36 11.849 -7.577 5.288 1.00 0.00 C ATOM 504 C LEU A 36 13.065 -8.486 5.440 1.00 0.00 C ATOM 505 O LEU A 36 14.213 -8.040 5.373 1.00 0.00 O ATOM 506 CB LEU A 36 11.348 -7.693 3.835 1.00 0.00 C ATOM 507 CG LEU A 36 10.022 -6.978 3.534 1.00 0.00 C ATOM 508 CD1 LEU A 36 9.856 -6.897 2.021 1.00 0.00 C ATOM 509 CD2 LEU A 36 8.816 -7.698 4.150 1.00 0.00 C ATOM 0 H LEU A 36 13.128 -5.921 5.265 1.00 0.00 H new ATOM 0 HA LEU A 36 11.085 -7.885 6.001 1.00 0.00 H new ATOM 0 HB2 LEU A 36 12.115 -7.293 3.172 1.00 0.00 H new ATOM 0 HB3 LEU A 36 11.235 -8.749 3.591 1.00 0.00 H new ATOM 0 HG LEU A 36 10.058 -5.984 3.979 1.00 0.00 H new ATOM 0 HD11 LEU A 36 8.919 -6.392 1.784 1.00 0.00 H new ATOM 0 HD12 LEU A 36 10.688 -6.338 1.593 1.00 0.00 H new ATOM 0 HD13 LEU A 36 9.842 -7.903 1.602 1.00 0.00 H new ATOM 0 HD21 LEU A 36 7.904 -7.152 3.908 1.00 0.00 H new ATOM 0 HD22 LEU A 36 8.752 -8.709 3.748 1.00 0.00 H new ATOM 0 HD23 LEU A 36 8.934 -7.745 5.233 1.00 0.00 H new ATOM 521 N HIS A 37 12.797 -9.793 5.519 1.00 0.00 N ATOM 522 CA HIS A 37 13.799 -10.854 5.447 1.00 0.00 C ATOM 523 C HIS A 37 13.698 -11.590 4.095 1.00 0.00 C ATOM 524 O HIS A 37 13.916 -12.798 3.999 1.00 0.00 O ATOM 525 CB HIS A 37 13.707 -11.764 6.682 1.00 0.00 C ATOM 526 CG HIS A 37 12.430 -12.558 6.814 1.00 0.00 C ATOM 527 ND1 HIS A 37 12.082 -13.655 6.060 1.00 0.00 N ATOM 528 CD2 HIS A 37 11.451 -12.389 7.755 1.00 0.00 C ATOM 529 CE1 HIS A 37 10.925 -14.141 6.535 1.00 0.00 C ATOM 530 NE2 HIS A 37 10.490 -13.396 7.570 1.00 0.00 N ATOM 0 H HIS A 37 11.849 -10.149 5.638 1.00 0.00 H new ATOM 0 HA HIS A 37 14.803 -10.430 5.476 1.00 0.00 H new ATOM 0 HB2 HIS A 37 14.546 -12.460 6.662 1.00 0.00 H new ATOM 0 HB3 HIS A 37 13.825 -11.149 7.574 1.00 0.00 H new ATOM 0 HD1 HIS A 37 12.612 -14.034 5.275 1.00 0.00 H new ATOM 0 HD2 HIS A 37 11.422 -11.616 8.509 1.00 0.00 H new ATOM 0 HE1 HIS A 37 10.414 -15.008 6.143 1.00 0.00 H new ATOM 538 N GLY A 38 13.288 -10.857 3.051 1.00 0.00 N ATOM 539 CA GLY A 38 13.006 -11.374 1.714 1.00 0.00 C ATOM 540 C GLY A 38 12.006 -12.539 1.663 1.00 0.00 C ATOM 541 O GLY A 38 12.278 -13.499 0.943 1.00 0.00 O ATOM 0 H GLY A 38 13.139 -9.850 3.122 1.00 0.00 H new ATOM 0 HA2 GLY A 38 12.622 -10.559 1.100 1.00 0.00 H new ATOM 0 HA3 GLY A 38 13.943 -11.700 1.262 1.00 0.00 H new ATOM 545 N PRO A 39 10.856 -12.503 2.372 1.00 0.00 N ATOM 546 CA PRO A 39 9.971 -13.661 2.518 1.00 0.00 C ATOM 547 C PRO A 39 9.339 -14.137 1.203 1.00 0.00 C ATOM 548 O PRO A 39 8.918 -15.292 1.113 1.00 0.00 O ATOM 549 CB PRO A 39 8.888 -13.231 3.513 1.00 0.00 C ATOM 550 CG PRO A 39 8.831 -11.715 3.354 1.00 0.00 C ATOM 551 CD PRO A 39 10.284 -11.353 3.058 1.00 0.00 C ATOM 0 HA PRO A 39 10.550 -14.517 2.864 1.00 0.00 H new ATOM 0 HB2 PRO A 39 7.928 -13.694 3.284 1.00 0.00 H new ATOM 0 HB3 PRO A 39 9.145 -13.517 4.533 1.00 0.00 H new ATOM 0 HG2 PRO A 39 8.166 -11.418 2.543 1.00 0.00 H new ATOM 0 HG3 PRO A 39 8.468 -11.226 4.258 1.00 0.00 H new ATOM 0 HD2 PRO A 39 10.344 -10.459 2.437 1.00 0.00 H new ATOM 0 HD3 PRO A 39 10.827 -11.139 3.978 1.00 0.00 H new ATOM 559 N LEU A 40 9.271 -13.269 0.189 1.00 0.00 N ATOM 560 CA LEU A 40 8.653 -13.523 -1.097 1.00 0.00 C ATOM 561 C LEU A 40 9.711 -13.463 -2.205 1.00 0.00 C ATOM 562 O LEU A 40 9.347 -13.370 -3.375 1.00 0.00 O ATOM 563 CB LEU A 40 7.567 -12.450 -1.300 1.00 0.00 C ATOM 564 CG LEU A 40 6.342 -12.561 -0.370 1.00 0.00 C ATOM 565 CD1 LEU A 40 5.388 -11.395 -0.648 1.00 0.00 C ATOM 566 CD2 LEU A 40 5.585 -13.884 -0.542 1.00 0.00 C ATOM 0 H LEU A 40 9.666 -12.331 0.255 1.00 0.00 H new ATOM 0 HA LEU A 40 8.205 -14.516 -1.133 1.00 0.00 H new ATOM 0 HB2 LEU A 40 8.020 -11.469 -1.160 1.00 0.00 H new ATOM 0 HB3 LEU A 40 7.223 -12.498 -2.333 1.00 0.00 H new ATOM 0 HG LEU A 40 6.710 -12.527 0.655 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.521 -11.470 0.008 1.00 0.00 H new ATOM 0 HD12 LEU A 40 5.902 -10.452 -0.463 1.00 0.00 H new ATOM 0 HD13 LEU A 40 5.061 -11.432 -1.687 1.00 0.00 H new ATOM 0 HD21 LEU A 40 4.733 -13.907 0.137 1.00 0.00 H new ATOM 0 HD22 LEU A 40 5.232 -13.970 -1.570 1.00 0.00 H new ATOM 0 HD23 LEU A 40 6.251 -14.716 -0.316 1.00 0.00 H new ATOM 578 N LEU A 41 11.008 -13.441 -1.848 1.00 0.00 N ATOM 579 CA LEU A 41 12.173 -13.179 -2.704 1.00 0.00 C ATOM 580 C LEU A 41 12.196 -11.751 -3.291 1.00 0.00 C ATOM 581 O LEU A 41 13.263 -11.239 -3.619 1.00 0.00 O ATOM 582 CB LEU A 41 12.268 -14.254 -3.808 1.00 0.00 C ATOM 583 CG LEU A 41 13.641 -14.350 -4.498 1.00 0.00 C ATOM 584 CD1 LEU A 41 14.648 -15.133 -3.650 1.00 0.00 C ATOM 585 CD2 LEU A 41 13.489 -15.059 -5.846 1.00 0.00 C ATOM 0 H LEU A 41 11.286 -13.619 -0.883 1.00 0.00 H new ATOM 0 HA LEU A 41 13.058 -13.241 -2.071 1.00 0.00 H new ATOM 0 HB2 LEU A 41 12.027 -15.224 -3.373 1.00 0.00 H new ATOM 0 HB3 LEU A 41 11.511 -14.047 -4.564 1.00 0.00 H new ATOM 0 HG LEU A 41 14.013 -13.334 -4.633 1.00 0.00 H new ATOM 0 HD11 LEU A 41 15.604 -15.179 -4.171 1.00 0.00 H new ATOM 0 HD12 LEU A 41 14.781 -14.634 -2.690 1.00 0.00 H new ATOM 0 HD13 LEU A 41 14.276 -16.144 -3.485 1.00 0.00 H new ATOM 0 HD21 LEU A 41 14.462 -15.126 -6.333 1.00 0.00 H new ATOM 0 HD22 LEU A 41 13.093 -16.062 -5.687 1.00 0.00 H new ATOM 0 HD23 LEU A 41 12.804 -14.494 -6.479 1.00 0.00 H new ATOM 597 N GLU A 42 11.043 -11.088 -3.391 1.00 0.00 N ATOM 598 CA GLU A 42 10.834 -9.837 -4.111 1.00 0.00 C ATOM 599 C GLU A 42 9.439 -9.340 -3.730 1.00 0.00 C ATOM 600 O GLU A 42 8.453 -9.628 -4.410 1.00 0.00 O ATOM 601 CB GLU A 42 11.040 -10.051 -5.635 1.00 0.00 C ATOM 602 CG GLU A 42 10.390 -11.293 -6.283 1.00 0.00 C ATOM 603 CD GLU A 42 10.833 -11.469 -7.748 1.00 0.00 C ATOM 604 OE1 GLU A 42 10.278 -10.784 -8.639 1.00 0.00 O ATOM 605 OE2 GLU A 42 11.713 -12.319 -8.022 1.00 0.00 O ATOM 0 H GLU A 42 10.189 -11.428 -2.949 1.00 0.00 H new ATOM 0 HA GLU A 42 11.560 -9.071 -3.838 1.00 0.00 H new ATOM 0 HB2 GLU A 42 10.663 -9.168 -6.151 1.00 0.00 H new ATOM 0 HB3 GLU A 42 12.112 -10.097 -5.825 1.00 0.00 H new ATOM 0 HG2 GLU A 42 10.657 -12.183 -5.713 1.00 0.00 H new ATOM 0 HG3 GLU A 42 9.305 -11.200 -6.240 1.00 0.00 H new ATOM 612 N ASP A 43 9.331 -8.663 -2.576 1.00 0.00 N ATOM 613 CA ASP A 43 8.053 -8.079 -2.169 1.00 0.00 C ATOM 614 C ASP A 43 7.634 -7.008 -3.174 1.00 0.00 C ATOM 615 O ASP A 43 6.475 -7.004 -3.597 1.00 0.00 O ATOM 616 CB ASP A 43 8.119 -7.490 -0.765 1.00 0.00 C ATOM 617 CG ASP A 43 6.786 -6.810 -0.410 1.00 0.00 C ATOM 618 OD1 ASP A 43 5.864 -7.504 0.074 1.00 0.00 O ATOM 619 OD2 ASP A 43 6.660 -5.584 -0.616 1.00 0.00 O ATOM 0 H ASP A 43 10.099 -8.511 -1.923 1.00 0.00 H new ATOM 0 HA ASP A 43 7.309 -8.876 -2.152 1.00 0.00 H new ATOM 0 HB2 ASP A 43 8.338 -8.277 -0.043 1.00 0.00 H new ATOM 0 HB3 ASP A 43 8.932 -6.766 -0.704 1.00 0.00 H new ATOM 624 N LEU A 44 8.574 -6.149 -3.601 1.00 0.00 N ATOM 625 CA LEU A 44 8.316 -5.254 -4.731 1.00 0.00 C ATOM 626 C LEU A 44 8.880 -5.913 -5.997 1.00 0.00 C ATOM 627 O LEU A 44 9.848 -6.675 -5.902 1.00 0.00 O ATOM 628 CB LEU A 44 8.909 -3.852 -4.520 1.00 0.00 C ATOM 629 CG LEU A 44 8.368 -3.115 -3.279 1.00 0.00 C ATOM 630 CD1 LEU A 44 9.000 -1.724 -3.208 1.00 0.00 C ATOM 631 CD2 LEU A 44 6.842 -2.960 -3.286 1.00 0.00 C ATOM 0 H LEU A 44 9.502 -6.059 -3.187 1.00 0.00 H new ATOM 0 HA LEU A 44 7.241 -5.106 -4.828 1.00 0.00 H new ATOM 0 HB2 LEU A 44 9.992 -3.938 -4.434 1.00 0.00 H new ATOM 0 HB3 LEU A 44 8.706 -3.248 -5.404 1.00 0.00 H new ATOM 0 HG LEU A 44 8.630 -3.720 -2.411 1.00 0.00 H new ATOM 0 HD11 LEU A 44 8.622 -1.197 -2.332 1.00 0.00 H new ATOM 0 HD12 LEU A 44 10.083 -1.820 -3.134 1.00 0.00 H new ATOM 0 HD13 LEU A 44 8.746 -1.163 -4.107 1.00 0.00 H new ATOM 0 HD21 LEU A 44 6.526 -2.433 -2.386 1.00 0.00 H new ATOM 0 HD22 LEU A 44 6.538 -2.391 -4.165 1.00 0.00 H new ATOM 0 HD23 LEU A 44 6.376 -3.945 -3.312 1.00 0.00 H new ATOM 643 N PRO A 45 8.291 -5.638 -7.174 1.00 0.00 N ATOM 644 CA PRO A 45 8.670 -6.263 -8.434 1.00 0.00 C ATOM 645 C PRO A 45 10.066 -5.864 -8.906 1.00 0.00 C ATOM 646 O PRO A 45 10.776 -5.065 -8.288 1.00 0.00 O ATOM 647 CB PRO A 45 7.597 -5.846 -9.451 1.00 0.00 C ATOM 648 CG PRO A 45 6.977 -4.581 -8.862 1.00 0.00 C ATOM 649 CD PRO A 45 7.172 -4.733 -7.357 1.00 0.00 C ATOM 0 HA PRO A 45 8.720 -7.345 -8.314 1.00 0.00 H new ATOM 0 HB2 PRO A 45 8.033 -5.654 -10.431 1.00 0.00 H new ATOM 0 HB3 PRO A 45 6.850 -6.629 -9.583 1.00 0.00 H new ATOM 0 HG2 PRO A 45 7.469 -3.684 -9.239 1.00 0.00 H new ATOM 0 HG3 PRO A 45 5.921 -4.498 -9.120 1.00 0.00 H new ATOM 0 HD2 PRO A 45 7.374 -3.768 -6.893 1.00 0.00 H new ATOM 0 HD3 PRO A 45 6.272 -5.130 -6.888 1.00 0.00 H new ATOM 657 N ALA A 46 10.415 -6.384 -10.082 1.00 0.00 N ATOM 658 CA ALA A 46 11.601 -6.024 -10.856 1.00 0.00 C ATOM 659 C ALA A 46 11.484 -4.613 -11.473 1.00 0.00 C ATOM 660 O ALA A 46 11.892 -4.377 -12.610 1.00 0.00 O ATOM 661 CB ALA A 46 11.829 -7.104 -11.924 1.00 0.00 C ATOM 0 H ALA A 46 9.853 -7.100 -10.542 1.00 0.00 H new ATOM 0 HA ALA A 46 12.466 -5.982 -10.194 1.00 0.00 H new ATOM 0 HB1 ALA A 46 12.711 -6.853 -12.513 1.00 0.00 H new ATOM 0 HB2 ALA A 46 11.979 -8.069 -11.440 1.00 0.00 H new ATOM 0 HB3 ALA A 46 10.959 -7.158 -12.579 1.00 0.00 H new ATOM 667 N SER A 47 10.859 -3.675 -10.770 1.00 0.00 N ATOM 668 CA SER A 47 10.614 -2.299 -11.165 1.00 0.00 C ATOM 669 C SER A 47 10.329 -1.534 -9.873 1.00 0.00 C ATOM 670 O SER A 47 9.534 -1.999 -9.054 1.00 0.00 O ATOM 671 CB SER A 47 9.415 -2.217 -12.115 1.00 0.00 C ATOM 672 OG SER A 47 9.630 -2.967 -13.296 1.00 0.00 O ATOM 0 H SER A 47 10.485 -3.874 -9.842 1.00 0.00 H new ATOM 0 HA SER A 47 11.468 -1.879 -11.696 1.00 0.00 H new ATOM 0 HB2 SER A 47 8.523 -2.585 -11.608 1.00 0.00 H new ATOM 0 HB3 SER A 47 9.227 -1.175 -12.375 1.00 0.00 H new ATOM 0 HG SER A 47 10.500 -3.416 -13.245 1.00 0.00 H new ATOM 678 N GLY A 48 10.997 -0.399 -9.659 1.00 0.00 N ATOM 679 CA GLY A 48 10.925 0.340 -8.405 1.00 0.00 C ATOM 680 C GLY A 48 12.334 0.633 -7.920 1.00 0.00 C ATOM 681 O GLY A 48 13.236 0.864 -8.729 1.00 0.00 O ATOM 0 H GLY A 48 11.605 0.032 -10.356 1.00 0.00 H new ATOM 0 HA2 GLY A 48 10.375 1.270 -8.548 1.00 0.00 H new ATOM 0 HA3 GLY A 48 10.383 -0.239 -7.658 1.00 0.00 H new ATOM 685 N ILE A 49 12.522 0.584 -6.605 1.00 0.00 N ATOM 686 CA ILE A 49 13.798 0.770 -5.931 1.00 0.00 C ATOM 687 C ILE A 49 13.970 -0.451 -5.017 1.00 0.00 C ATOM 688 O ILE A 49 13.003 -0.908 -4.399 1.00 0.00 O ATOM 689 CB ILE A 49 13.754 2.090 -5.126 1.00 0.00 C ATOM 690 CG1 ILE A 49 13.250 3.337 -5.895 1.00 0.00 C ATOM 691 CG2 ILE A 49 15.121 2.392 -4.492 1.00 0.00 C ATOM 692 CD1 ILE A 49 14.143 3.825 -7.041 1.00 0.00 C ATOM 0 H ILE A 49 11.756 0.406 -5.955 1.00 0.00 H new ATOM 0 HA ILE A 49 14.638 0.844 -6.622 1.00 0.00 H new ATOM 0 HB ILE A 49 13.002 1.902 -4.359 1.00 0.00 H new ATOM 0 HG12 ILE A 49 12.262 3.115 -6.299 1.00 0.00 H new ATOM 0 HG13 ILE A 49 13.127 4.153 -5.183 1.00 0.00 H new ATOM 0 HG21 ILE A 49 15.064 3.325 -3.931 1.00 0.00 H new ATOM 0 HG22 ILE A 49 15.397 1.580 -3.819 1.00 0.00 H new ATOM 0 HG23 ILE A 49 15.873 2.485 -5.276 1.00 0.00 H new ATOM 0 HD11 ILE A 49 13.692 4.701 -7.506 1.00 0.00 H new ATOM 0 HD12 ILE A 49 15.126 4.088 -6.650 1.00 0.00 H new ATOM 0 HD13 ILE A 49 14.247 3.034 -7.783 1.00 0.00 H new ATOM 704 N TRP A 50 15.188 -0.979 -4.908 1.00 0.00 N ATOM 705 CA TRP A 50 15.512 -2.125 -4.068 1.00 0.00 C ATOM 706 C TRP A 50 16.710 -1.738 -3.209 1.00 0.00 C ATOM 707 O TRP A 50 17.605 -1.023 -3.664 1.00 0.00 O ATOM 708 CB TRP A 50 15.869 -3.339 -4.944 1.00 0.00 C ATOM 709 CG TRP A 50 14.770 -4.266 -5.397 1.00 0.00 C ATOM 710 CD1 TRP A 50 13.550 -3.921 -5.874 1.00 0.00 C ATOM 711 CD2 TRP A 50 14.817 -5.724 -5.500 1.00 0.00 C ATOM 712 NE1 TRP A 50 12.883 -5.038 -6.335 1.00 0.00 N ATOM 713 CE2 TRP A 50 13.628 -6.180 -6.148 1.00 0.00 C ATOM 714 CE3 TRP A 50 15.762 -6.709 -5.142 1.00 0.00 C ATOM 715 CZ2 TRP A 50 13.420 -7.527 -6.475 1.00 0.00 C ATOM 716 CZ3 TRP A 50 15.560 -8.068 -5.453 1.00 0.00 C ATOM 717 CH2 TRP A 50 14.397 -8.476 -6.129 1.00 0.00 C ATOM 0 H TRP A 50 15.994 -0.612 -5.414 1.00 0.00 H new ATOM 0 HA TRP A 50 14.660 -2.394 -3.444 1.00 0.00 H new ATOM 0 HB2 TRP A 50 16.371 -2.964 -5.836 1.00 0.00 H new ATOM 0 HB3 TRP A 50 16.597 -3.937 -4.396 1.00 0.00 H new ATOM 0 HD1 TRP A 50 13.156 -2.916 -5.891 1.00 0.00 H new ATOM 0 HE1 TRP A 50 11.956 -5.019 -6.760 1.00 0.00 H new ATOM 0 HE3 TRP A 50 16.659 -6.415 -4.618 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 12.519 -7.832 -6.987 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 16.302 -8.800 -5.171 1.00 0.00 H new ATOM 0 HH2 TRP A 50 14.255 -9.516 -6.382 1.00 0.00 H new ATOM 728 N LEU A 51 16.760 -2.265 -1.989 1.00 0.00 N ATOM 729 CA LEU A 51 17.915 -2.185 -1.107 1.00 0.00 C ATOM 730 C LEU A 51 18.144 -3.591 -0.571 1.00 0.00 C ATOM 731 O LEU A 51 17.184 -4.299 -0.256 1.00 0.00 O ATOM 732 CB LEU A 51 17.659 -1.205 0.048 1.00 0.00 C ATOM 733 CG LEU A 51 17.664 0.286 -0.337 1.00 0.00 C ATOM 734 CD1 LEU A 51 17.380 1.126 0.911 1.00 0.00 C ATOM 735 CD2 LEU A 51 19.000 0.721 -0.949 1.00 0.00 C ATOM 0 H LEU A 51 15.976 -2.772 -1.578 1.00 0.00 H new ATOM 0 HA LEU A 51 18.789 -1.817 -1.645 1.00 0.00 H new ATOM 0 HB2 LEU A 51 16.695 -1.443 0.497 1.00 0.00 H new ATOM 0 HB3 LEU A 51 18.417 -1.367 0.814 1.00 0.00 H new ATOM 0 HG LEU A 51 16.891 0.440 -1.090 1.00 0.00 H new ATOM 0 HD11 LEU A 51 17.382 2.183 0.646 1.00 0.00 H new ATOM 0 HD12 LEU A 51 16.405 0.856 1.318 1.00 0.00 H new ATOM 0 HD13 LEU A 51 18.150 0.938 1.659 1.00 0.00 H new ATOM 0 HD21 LEU A 51 18.956 1.780 -1.204 1.00 0.00 H new ATOM 0 HD22 LEU A 51 19.801 0.555 -0.229 1.00 0.00 H new ATOM 0 HD23 LEU A 51 19.195 0.138 -1.849 1.00 0.00 H new ATOM 747 N VAL A 52 19.409 -3.992 -0.468 1.00 0.00 N ATOM 748 CA VAL A 52 19.782 -5.362 -0.139 1.00 0.00 C ATOM 749 C VAL A 52 20.744 -5.297 1.045 1.00 0.00 C ATOM 750 O VAL A 52 21.785 -4.642 0.967 1.00 0.00 O ATOM 751 CB VAL A 52 20.371 -6.063 -1.383 1.00 0.00 C ATOM 752 CG1 VAL A 52 20.698 -7.532 -1.086 1.00 0.00 C ATOM 753 CG2 VAL A 52 19.399 -6.024 -2.579 1.00 0.00 C ATOM 0 H VAL A 52 20.206 -3.372 -0.611 1.00 0.00 H new ATOM 0 HA VAL A 52 18.921 -5.964 0.152 1.00 0.00 H new ATOM 0 HB VAL A 52 21.280 -5.518 -1.637 1.00 0.00 H new ATOM 0 HG11 VAL A 52 21.111 -8.001 -1.979 1.00 0.00 H new ATOM 0 HG12 VAL A 52 21.427 -7.586 -0.278 1.00 0.00 H new ATOM 0 HG13 VAL A 52 19.788 -8.055 -0.790 1.00 0.00 H new ATOM 0 HG21 VAL A 52 19.852 -6.528 -3.433 1.00 0.00 H new ATOM 0 HG22 VAL A 52 18.471 -6.529 -2.310 1.00 0.00 H new ATOM 0 HG23 VAL A 52 19.185 -4.988 -2.841 1.00 0.00 H new ATOM 763 N ILE A 53 20.375 -5.964 2.139 1.00 0.00 N ATOM 764 CA ILE A 53 21.005 -5.895 3.453 1.00 0.00 C ATOM 765 C ILE A 53 21.355 -7.342 3.811 1.00 0.00 C ATOM 766 O ILE A 53 20.868 -7.916 4.786 1.00 0.00 O ATOM 767 CB ILE A 53 20.107 -5.160 4.493 1.00 0.00 C ATOM 768 CG1 ILE A 53 19.438 -3.866 3.970 1.00 0.00 C ATOM 769 CG2 ILE A 53 20.963 -4.801 5.725 1.00 0.00 C ATOM 770 CD1 ILE A 53 18.067 -4.102 3.332 1.00 0.00 C ATOM 0 H ILE A 53 19.581 -6.604 2.128 1.00 0.00 H new ATOM 0 HA ILE A 53 21.911 -5.290 3.452 1.00 0.00 H new ATOM 0 HB ILE A 53 19.298 -5.851 4.732 1.00 0.00 H new ATOM 0 HG12 ILE A 53 19.329 -3.163 4.796 1.00 0.00 H new ATOM 0 HG13 ILE A 53 20.095 -3.397 3.237 1.00 0.00 H new ATOM 0 HG21 ILE A 53 20.345 -4.286 6.460 1.00 0.00 H new ATOM 0 HG22 ILE A 53 21.367 -5.713 6.166 1.00 0.00 H new ATOM 0 HG23 ILE A 53 21.783 -4.151 5.421 1.00 0.00 H new ATOM 0 HD11 ILE A 53 17.657 -3.152 2.988 1.00 0.00 H new ATOM 0 HD12 ILE A 53 18.172 -4.780 2.485 1.00 0.00 H new ATOM 0 HD13 ILE A 53 17.394 -4.542 4.068 1.00 0.00 H new ATOM 782 N SER A 54 22.187 -7.939 2.960 1.00 0.00 N ATOM 783 CA SER A 54 22.484 -9.368 2.959 1.00 0.00 C ATOM 784 C SER A 54 23.977 -9.624 3.167 1.00 0.00 C ATOM 785 O SER A 54 24.572 -10.446 2.469 1.00 0.00 O ATOM 786 CB SER A 54 21.948 -9.981 1.664 1.00 0.00 C ATOM 787 OG SER A 54 20.581 -9.649 1.489 1.00 0.00 O ATOM 0 H SER A 54 22.686 -7.427 2.233 1.00 0.00 H new ATOM 0 HA SER A 54 21.985 -9.853 3.798 1.00 0.00 H new ATOM 0 HB2 SER A 54 22.528 -9.619 0.815 1.00 0.00 H new ATOM 0 HB3 SER A 54 22.065 -11.064 1.691 1.00 0.00 H new ATOM 0 HG SER A 54 20.252 -10.046 0.656 1.00 0.00 H new ATOM 793 N SER A 55 24.579 -8.856 4.080 1.00 0.00 N ATOM 794 CA SER A 55 25.998 -8.758 4.391 1.00 0.00 C ATOM 795 C SER A 55 26.794 -10.026 4.066 1.00 0.00 C ATOM 796 O SER A 55 26.652 -11.054 4.735 1.00 0.00 O ATOM 797 CB SER A 55 26.128 -8.356 5.865 1.00 0.00 C ATOM 798 OG SER A 55 25.251 -7.274 6.152 1.00 0.00 O ATOM 0 H SER A 55 24.030 -8.232 4.671 1.00 0.00 H new ATOM 0 HA SER A 55 26.442 -7.998 3.748 1.00 0.00 H new ATOM 0 HB2 SER A 55 25.892 -9.206 6.505 1.00 0.00 H new ATOM 0 HB3 SER A 55 27.157 -8.069 6.083 1.00 0.00 H new ATOM 0 HG SER A 55 25.338 -7.024 7.095 1.00 0.00 H new ATOM 804 N THR A 56 27.612 -9.964 3.010 1.00 0.00 N ATOM 805 CA THR A 56 28.433 -11.083 2.575 1.00 0.00 C ATOM 806 C THR A 56 29.701 -11.215 3.417 1.00 0.00 C ATOM 807 O THR A 56 30.298 -12.283 3.421 1.00 0.00 O ATOM 808 CB THR A 56 28.760 -10.906 1.085 1.00 0.00 C ATOM 809 OG1 THR A 56 29.280 -9.610 0.857 1.00 0.00 O ATOM 810 CG2 THR A 56 27.512 -11.085 0.219 1.00 0.00 C ATOM 0 H THR A 56 27.719 -9.129 2.435 1.00 0.00 H new ATOM 0 HA THR A 56 27.877 -12.010 2.714 1.00 0.00 H new ATOM 0 HB THR A 56 29.494 -11.665 0.815 1.00 0.00 H new ATOM 0 HG1 THR A 56 29.640 -9.557 -0.053 1.00 0.00 H new ATOM 0 HG21 THR A 56 27.776 -10.954 -0.830 1.00 0.00 H new ATOM 0 HG22 THR A 56 27.106 -12.085 0.369 1.00 0.00 H new ATOM 0 HG23 THR A 56 26.764 -10.344 0.501 1.00 0.00 H new ATOM 916 N ASN A 65 26.144 -17.930 1.606 1.00 0.00 N ATOM 917 CA ASN A 65 25.586 -16.854 2.436 1.00 0.00 C ATOM 918 C ASN A 65 24.174 -16.389 2.078 1.00 0.00 C ATOM 919 O ASN A 65 23.501 -15.807 2.920 1.00 0.00 O ATOM 920 CB ASN A 65 26.531 -15.648 2.374 1.00 0.00 C ATOM 921 CG ASN A 65 26.290 -14.651 3.504 1.00 0.00 C ATOM 922 OD1 ASN A 65 26.590 -14.951 4.652 1.00 0.00 O ATOM 923 ND2 ASN A 65 25.843 -13.438 3.223 1.00 0.00 N ATOM 0 HA ASN A 65 25.499 -17.280 3.435 1.00 0.00 H new ATOM 0 HB2 ASN A 65 27.563 -15.998 2.417 1.00 0.00 H new ATOM 0 HB3 ASN A 65 26.406 -15.143 1.416 1.00 0.00 H new ATOM 0 HD21 ASN A 65 25.746 -12.745 3.966 1.00 0.00 H new ATOM 0 HD22 ASN A 65 25.595 -13.195 2.264 1.00 0.00 H new ATOM 930 N LEU A 66 23.725 -16.593 0.840 1.00 0.00 N ATOM 931 CA LEU A 66 22.383 -16.270 0.356 1.00 0.00 C ATOM 932 C LEU A 66 21.899 -17.573 -0.264 1.00 0.00 C ATOM 933 O LEU A 66 21.855 -17.716 -1.484 1.00 0.00 O ATOM 934 CB LEU A 66 22.400 -15.098 -0.649 1.00 0.00 C ATOM 935 CG LEU A 66 22.431 -13.701 0.002 1.00 0.00 C ATOM 936 CD1 LEU A 66 23.867 -13.257 0.292 1.00 0.00 C ATOM 937 CD2 LEU A 66 21.749 -12.681 -0.914 1.00 0.00 C ATOM 0 H LEU A 66 24.312 -17.006 0.115 1.00 0.00 H new ATOM 0 HA LEU A 66 21.719 -15.924 1.148 1.00 0.00 H new ATOM 0 HB2 LEU A 66 23.271 -15.203 -1.296 1.00 0.00 H new ATOM 0 HB3 LEU A 66 21.519 -15.169 -1.286 1.00 0.00 H new ATOM 0 HG LEU A 66 21.893 -13.758 0.948 1.00 0.00 H new ATOM 0 HD11 LEU A 66 23.857 -12.268 0.751 1.00 0.00 H new ATOM 0 HD12 LEU A 66 24.337 -13.968 0.972 1.00 0.00 H new ATOM 0 HD13 LEU A 66 24.431 -13.219 -0.640 1.00 0.00 H new ATOM 0 HD21 LEU A 66 21.776 -11.697 -0.446 1.00 0.00 H new ATOM 0 HD22 LEU A 66 22.272 -12.643 -1.869 1.00 0.00 H new ATOM 0 HD23 LEU A 66 20.713 -12.976 -1.080 1.00 0.00 H new ATOM 949 N SER A 67 21.586 -18.546 0.586 1.00 0.00 N ATOM 950 CA SER A 67 21.347 -19.922 0.179 1.00 0.00 C ATOM 951 C SER A 67 20.116 -20.060 -0.725 1.00 0.00 C ATOM 952 O SER A 67 20.245 -20.602 -1.824 1.00 0.00 O ATOM 953 CB SER A 67 21.304 -20.840 1.416 1.00 0.00 C ATOM 954 OG SER A 67 22.038 -20.304 2.507 1.00 0.00 O ATOM 0 H SER A 67 21.490 -18.396 1.590 1.00 0.00 H new ATOM 0 HA SER A 67 22.183 -20.248 -0.440 1.00 0.00 H new ATOM 0 HB2 SER A 67 20.268 -20.993 1.717 1.00 0.00 H new ATOM 0 HB3 SER A 67 21.707 -21.818 1.155 1.00 0.00 H new ATOM 0 HG SER A 67 21.983 -20.916 3.270 1.00 0.00 H new ATOM 960 N PRO A 68 18.937 -19.538 -0.339 1.00 0.00 N ATOM 961 CA PRO A 68 17.766 -19.569 -1.208 1.00 0.00 C ATOM 962 C PRO A 68 17.890 -18.521 -2.310 1.00 0.00 C ATOM 963 O PRO A 68 17.523 -18.773 -3.458 1.00 0.00 O ATOM 964 CB PRO A 68 16.589 -19.274 -0.272 1.00 0.00 C ATOM 965 CG PRO A 68 17.196 -18.420 0.845 1.00 0.00 C ATOM 966 CD PRO A 68 18.623 -18.916 0.943 1.00 0.00 C ATOM 0 HA PRO A 68 17.643 -20.523 -1.721 1.00 0.00 H new ATOM 0 HB2 PRO A 68 15.792 -18.741 -0.791 1.00 0.00 H new ATOM 0 HB3 PRO A 68 16.154 -20.193 0.122 1.00 0.00 H new ATOM 0 HG2 PRO A 68 17.157 -17.358 0.603 1.00 0.00 H new ATOM 0 HG3 PRO A 68 16.661 -18.552 1.785 1.00 0.00 H new ATOM 0 HD2 PRO A 68 19.306 -18.093 1.152 1.00 0.00 H new ATOM 0 HD3 PRO A 68 18.729 -19.632 1.758 1.00 0.00 H new ATOM 974 N PHE A 69 18.411 -17.348 -1.948 1.00 0.00 N ATOM 975 CA PHE A 69 18.404 -16.182 -2.814 1.00 0.00 C ATOM 976 C PHE A 69 19.268 -16.421 -4.046 1.00 0.00 C ATOM 977 O PHE A 69 18.784 -16.235 -5.155 1.00 0.00 O ATOM 978 CB PHE A 69 18.836 -14.926 -2.041 1.00 0.00 C ATOM 979 CG PHE A 69 17.681 -13.999 -1.729 1.00 0.00 C ATOM 980 CD1 PHE A 69 16.938 -14.164 -0.543 1.00 0.00 C ATOM 981 CD2 PHE A 69 17.321 -12.998 -2.651 1.00 0.00 C ATOM 982 CE1 PHE A 69 15.825 -13.342 -0.293 1.00 0.00 C ATOM 983 CE2 PHE A 69 16.213 -12.173 -2.396 1.00 0.00 C ATOM 984 CZ PHE A 69 15.460 -12.352 -1.223 1.00 0.00 C ATOM 0 H PHE A 69 18.850 -17.186 -1.042 1.00 0.00 H new ATOM 0 HA PHE A 69 17.385 -16.012 -3.161 1.00 0.00 H new ATOM 0 HB2 PHE A 69 19.316 -15.226 -1.110 1.00 0.00 H new ATOM 0 HB3 PHE A 69 19.582 -14.385 -2.624 1.00 0.00 H new ATOM 0 HD1 PHE A 69 17.223 -14.921 0.173 1.00 0.00 H new ATOM 0 HD2 PHE A 69 17.897 -12.864 -3.555 1.00 0.00 H new ATOM 0 HE1 PHE A 69 15.251 -13.471 0.613 1.00 0.00 H new ATOM 0 HE2 PHE A 69 15.940 -11.402 -3.101 1.00 0.00 H new ATOM 0 HZ PHE A 69 14.599 -11.728 -1.035 1.00 0.00 H new ATOM 994 N TYR A 70 20.519 -16.857 -3.873 1.00 0.00 N ATOM 995 CA TYR A 70 21.444 -17.049 -4.980 1.00 0.00 C ATOM 996 C TYR A 70 20.886 -18.073 -5.963 1.00 0.00 C ATOM 997 O TYR A 70 20.805 -17.778 -7.152 1.00 0.00 O ATOM 998 CB TYR A 70 22.828 -17.463 -4.466 1.00 0.00 C ATOM 999 CG TYR A 70 23.936 -17.567 -5.508 1.00 0.00 C ATOM 1000 CD1 TYR A 70 24.093 -16.593 -6.520 1.00 0.00 C ATOM 1001 CD2 TYR A 70 24.857 -18.629 -5.427 1.00 0.00 C ATOM 1002 CE1 TYR A 70 25.162 -16.675 -7.430 1.00 0.00 C ATOM 1003 CE2 TYR A 70 25.923 -18.724 -6.338 1.00 0.00 C ATOM 1004 CZ TYR A 70 26.083 -17.744 -7.345 1.00 0.00 C ATOM 1005 OH TYR A 70 27.120 -17.817 -8.226 1.00 0.00 O ATOM 0 H TYR A 70 20.913 -17.085 -2.960 1.00 0.00 H new ATOM 0 HA TYR A 70 21.560 -16.102 -5.508 1.00 0.00 H new ATOM 0 HB2 TYR A 70 23.139 -16.745 -3.707 1.00 0.00 H new ATOM 0 HB3 TYR A 70 22.733 -18.429 -3.971 1.00 0.00 H new ATOM 0 HD1 TYR A 70 23.387 -15.780 -6.595 1.00 0.00 H new ATOM 0 HD2 TYR A 70 24.743 -19.378 -4.657 1.00 0.00 H new ATOM 0 HE1 TYR A 70 25.279 -15.921 -8.194 1.00 0.00 H new ATOM 0 HE2 TYR A 70 26.620 -19.546 -6.269 1.00 0.00 H new ATOM 0 HH TYR A 70 27.660 -18.611 -8.030 1.00 0.00 H new ATOM 1015 N GLU A 71 20.444 -19.242 -5.486 1.00 0.00 N ATOM 1016 CA GLU A 71 19.938 -20.282 -6.371 1.00 0.00 C ATOM 1017 C GLU A 71 18.698 -19.789 -7.118 1.00 0.00 C ATOM 1018 O GLU A 71 18.623 -19.955 -8.336 1.00 0.00 O ATOM 1019 CB GLU A 71 19.648 -21.571 -5.589 1.00 0.00 C ATOM 1020 CG GLU A 71 20.918 -22.120 -4.930 1.00 0.00 C ATOM 1021 CD GLU A 71 20.783 -23.609 -4.558 1.00 0.00 C ATOM 1022 OE1 GLU A 71 20.029 -23.955 -3.621 1.00 0.00 O ATOM 1023 OE2 GLU A 71 21.442 -24.460 -5.203 1.00 0.00 O ATOM 0 H GLU A 71 20.429 -19.485 -4.496 1.00 0.00 H new ATOM 0 HA GLU A 71 20.705 -20.514 -7.110 1.00 0.00 H new ATOM 0 HB2 GLU A 71 18.895 -21.374 -4.825 1.00 0.00 H new ATOM 0 HB3 GLU A 71 19.231 -22.321 -6.261 1.00 0.00 H new ATOM 0 HG2 GLU A 71 21.762 -21.992 -5.608 1.00 0.00 H new ATOM 0 HG3 GLU A 71 21.139 -21.542 -4.033 1.00 0.00 H new ATOM 1030 N ALA A 72 17.760 -19.131 -6.423 1.00 0.00 N ATOM 1031 CA ALA A 72 16.584 -18.570 -7.080 1.00 0.00 C ATOM 1032 C ALA A 72 16.960 -17.495 -8.106 1.00 0.00 C ATOM 1033 O ALA A 72 16.358 -17.448 -9.177 1.00 0.00 O ATOM 1034 CB ALA A 72 15.617 -17.992 -6.045 1.00 0.00 C ATOM 0 H ALA A 72 17.796 -18.978 -5.415 1.00 0.00 H new ATOM 0 HA ALA A 72 16.094 -19.383 -7.615 1.00 0.00 H new ATOM 0 HB1 ALA A 72 14.746 -17.578 -6.552 1.00 0.00 H new ATOM 0 HB2 ALA A 72 15.299 -18.781 -5.364 1.00 0.00 H new ATOM 0 HB3 ALA A 72 16.116 -17.205 -5.480 1.00 0.00 H new ATOM 1040 N LEU A 73 17.951 -16.645 -7.819 1.00 0.00 N ATOM 1041 CA LEU A 73 18.391 -15.595 -8.724 1.00 0.00 C ATOM 1042 C LEU A 73 18.840 -16.206 -10.038 1.00 0.00 C ATOM 1043 O LEU A 73 18.293 -15.852 -11.080 1.00 0.00 O ATOM 1044 CB LEU A 73 19.541 -14.784 -8.103 1.00 0.00 C ATOM 1045 CG LEU A 73 19.085 -13.674 -7.139 1.00 0.00 C ATOM 1046 CD1 LEU A 73 20.318 -13.023 -6.506 1.00 0.00 C ATOM 1047 CD2 LEU A 73 18.227 -12.601 -7.825 1.00 0.00 C ATOM 0 H LEU A 73 18.471 -16.672 -6.942 1.00 0.00 H new ATOM 0 HA LEU A 73 17.554 -14.920 -8.905 1.00 0.00 H new ATOM 0 HB2 LEU A 73 20.202 -15.465 -7.567 1.00 0.00 H new ATOM 0 HB3 LEU A 73 20.127 -14.335 -8.905 1.00 0.00 H new ATOM 0 HG LEU A 73 18.459 -14.139 -6.378 1.00 0.00 H new ATOM 0 HD11 LEU A 73 20.003 -12.235 -5.822 1.00 0.00 H new ATOM 0 HD12 LEU A 73 20.885 -13.775 -5.957 1.00 0.00 H new ATOM 0 HD13 LEU A 73 20.945 -12.595 -7.288 1.00 0.00 H new ATOM 0 HD21 LEU A 73 17.936 -11.846 -7.095 1.00 0.00 H new ATOM 0 HD22 LEU A 73 18.802 -12.131 -8.623 1.00 0.00 H new ATOM 0 HD23 LEU A 73 17.333 -13.063 -8.245 1.00 0.00 H new ATOM 1059 N GLN A 74 19.787 -17.143 -9.999 1.00 0.00 N ATOM 1060 CA GLN A 74 20.292 -17.750 -11.233 1.00 0.00 C ATOM 1061 C GLN A 74 19.219 -18.570 -11.957 1.00 0.00 C ATOM 1062 O GLN A 74 19.351 -18.815 -13.157 1.00 0.00 O ATOM 1063 CB GLN A 74 21.590 -18.566 -11.052 1.00 0.00 C ATOM 1064 CG GLN A 74 22.511 -18.111 -9.920 1.00 0.00 C ATOM 1065 CD GLN A 74 23.893 -18.721 -10.098 1.00 0.00 C ATOM 1066 OE1 GLN A 74 24.275 -19.683 -9.436 1.00 0.00 O ATOM 1067 NE2 GLN A 74 24.637 -18.201 -11.050 1.00 0.00 N ATOM 0 H GLN A 74 20.215 -17.495 -9.142 1.00 0.00 H new ATOM 0 HA GLN A 74 20.558 -16.904 -11.867 1.00 0.00 H new ATOM 0 HB2 GLN A 74 21.320 -19.608 -10.879 1.00 0.00 H new ATOM 0 HB3 GLN A 74 22.151 -18.533 -11.986 1.00 0.00 H new ATOM 0 HG2 GLN A 74 22.583 -17.023 -9.913 1.00 0.00 H new ATOM 0 HG3 GLN A 74 22.094 -18.409 -8.958 1.00 0.00 H new ATOM 0 HE21 GLN A 74 24.296 -17.402 -11.585 1.00 0.00 H new ATOM 0 HE22 GLN A 74 25.555 -18.597 -11.253 1.00 0.00 H new ATOM 1076 N GLU A 75 18.158 -18.984 -11.259 1.00 0.00 N ATOM 1077 CA GLU A 75 17.084 -19.770 -11.849 1.00 0.00 C ATOM 1078 C GLU A 75 16.197 -18.916 -12.767 1.00 0.00 C ATOM 1079 O GLU A 75 15.728 -19.424 -13.788 1.00 0.00 O ATOM 1080 CB GLU A 75 16.262 -20.456 -10.748 1.00 0.00 C ATOM 1081 CG GLU A 75 15.306 -21.524 -11.295 1.00 0.00 C ATOM 1082 CD GLU A 75 14.593 -22.281 -10.159 1.00 0.00 C ATOM 1083 OE1 GLU A 75 13.530 -21.819 -9.685 1.00 0.00 O ATOM 1084 OE2 GLU A 75 15.071 -23.362 -9.746 1.00 0.00 O ATOM 0 H GLU A 75 18.024 -18.781 -10.268 1.00 0.00 H new ATOM 0 HA GLU A 75 17.531 -20.543 -12.474 1.00 0.00 H new ATOM 0 HB2 GLU A 75 16.940 -20.916 -10.029 1.00 0.00 H new ATOM 0 HB3 GLU A 75 15.687 -19.703 -10.208 1.00 0.00 H new ATOM 0 HG2 GLU A 75 14.565 -21.053 -11.941 1.00 0.00 H new ATOM 0 HG3 GLU A 75 15.863 -22.231 -11.911 1.00 0.00 H new ATOM 1091 N GLN A 76 15.988 -17.631 -12.443 1.00 0.00 N ATOM 1092 CA GLN A 76 15.033 -16.774 -13.159 1.00 0.00 C ATOM 1093 C GLN A 76 15.634 -15.496 -13.760 1.00 0.00 C ATOM 1094 O GLN A 76 15.041 -14.964 -14.698 1.00 0.00 O ATOM 1095 CB GLN A 76 13.795 -16.456 -12.292 1.00 0.00 C ATOM 1096 CG GLN A 76 14.094 -15.969 -10.860 1.00 0.00 C ATOM 1097 CD GLN A 76 13.034 -15.027 -10.267 1.00 0.00 C ATOM 1098 OE1 GLN A 76 11.909 -14.915 -10.750 1.00 0.00 O ATOM 1099 NE2 GLN A 76 13.379 -14.317 -9.204 1.00 0.00 N ATOM 0 H GLN A 76 16.474 -17.159 -11.681 1.00 0.00 H new ATOM 0 HA GLN A 76 14.720 -17.369 -14.017 1.00 0.00 H new ATOM 0 HB2 GLN A 76 13.204 -15.694 -12.800 1.00 0.00 H new ATOM 0 HB3 GLN A 76 13.176 -17.351 -12.231 1.00 0.00 H new ATOM 0 HG2 GLN A 76 14.193 -16.838 -10.209 1.00 0.00 H new ATOM 0 HG3 GLN A 76 15.057 -15.458 -10.858 1.00 0.00 H new ATOM 0 HE21 GLN A 76 14.314 -14.414 -8.807 1.00 0.00 H new ATOM 0 HE22 GLN A 76 12.710 -13.673 -8.782 1.00 0.00 H new ATOM 1108 N LYS A 77 16.787 -15.023 -13.265 1.00 0.00 N ATOM 1109 CA LYS A 77 17.475 -13.776 -13.650 1.00 0.00 C ATOM 1110 C LYS A 77 16.507 -12.678 -14.136 1.00 0.00 C ATOM 1111 O LYS A 77 16.498 -12.369 -15.334 1.00 0.00 O ATOM 1112 CB LYS A 77 18.600 -14.050 -14.661 1.00 0.00 C ATOM 1113 CG LYS A 77 19.568 -15.155 -14.224 1.00 0.00 C ATOM 1114 CD LYS A 77 20.890 -15.061 -14.990 1.00 0.00 C ATOM 1115 CE LYS A 77 21.611 -16.411 -14.984 1.00 0.00 C ATOM 1116 NZ LYS A 77 23.042 -16.282 -15.340 1.00 0.00 N ATOM 0 H LYS A 77 17.297 -15.529 -12.541 1.00 0.00 H new ATOM 0 HA LYS A 77 17.935 -13.380 -12.745 1.00 0.00 H new ATOM 0 HB2 LYS A 77 18.157 -14.326 -15.618 1.00 0.00 H new ATOM 0 HB3 LYS A 77 19.162 -13.130 -14.823 1.00 0.00 H new ATOM 0 HG2 LYS A 77 19.757 -15.075 -13.154 1.00 0.00 H new ATOM 0 HG3 LYS A 77 19.113 -16.131 -14.395 1.00 0.00 H new ATOM 0 HD2 LYS A 77 20.701 -14.748 -16.017 1.00 0.00 H new ATOM 0 HD3 LYS A 77 21.526 -14.300 -14.537 1.00 0.00 H new ATOM 0 HE2 LYS A 77 21.523 -16.863 -13.996 1.00 0.00 H new ATOM 0 HE3 LYS A 77 21.123 -17.085 -15.688 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 23.554 -17.135 -15.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 23.135 -16.172 -16.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 23.444 -15.449 -14.865 1.00 0.00 H new ATOM 1130 N PRO A 78 15.633 -12.149 -13.256 1.00 0.00 N ATOM 1131 CA PRO A 78 14.546 -11.270 -13.664 1.00 0.00 C ATOM 1132 C PRO A 78 15.042 -9.982 -14.317 1.00 0.00 C ATOM 1133 O PRO A 78 16.208 -9.603 -14.213 1.00 0.00 O ATOM 1134 CB PRO A 78 13.706 -10.995 -12.416 1.00 0.00 C ATOM 1135 CG PRO A 78 14.617 -11.368 -11.248 1.00 0.00 C ATOM 1136 CD PRO A 78 15.577 -12.404 -11.826 1.00 0.00 C ATOM 0 HA PRO A 78 13.945 -11.753 -14.434 1.00 0.00 H new ATOM 0 HB2 PRO A 78 13.404 -9.949 -12.364 1.00 0.00 H new ATOM 0 HB3 PRO A 78 12.794 -11.591 -12.413 1.00 0.00 H new ATOM 0 HG2 PRO A 78 15.153 -10.498 -10.870 1.00 0.00 H new ATOM 0 HG3 PRO A 78 14.046 -11.778 -10.415 1.00 0.00 H new ATOM 0 HD2 PRO A 78 16.565 -12.314 -11.375 1.00 0.00 H new ATOM 0 HD3 PRO A 78 15.226 -13.416 -11.624 1.00 0.00 H new ATOM 1144 N ASP A 79 14.117 -9.290 -14.978 1.00 0.00 N ATOM 1145 CA ASP A 79 14.397 -8.097 -15.777 1.00 0.00 C ATOM 1146 C ASP A 79 14.519 -6.857 -14.889 1.00 0.00 C ATOM 1147 O ASP A 79 13.706 -5.935 -14.948 1.00 0.00 O ATOM 1148 CB ASP A 79 13.347 -7.938 -16.886 1.00 0.00 C ATOM 1149 CG ASP A 79 13.632 -6.719 -17.781 1.00 0.00 C ATOM 1150 OD1 ASP A 79 14.818 -6.416 -18.039 1.00 0.00 O ATOM 1151 OD2 ASP A 79 12.667 -6.092 -18.277 1.00 0.00 O ATOM 0 H ASP A 79 13.130 -9.548 -14.974 1.00 0.00 H new ATOM 0 HA ASP A 79 15.363 -8.217 -16.268 1.00 0.00 H new ATOM 0 HB2 ASP A 79 13.327 -8.840 -17.498 1.00 0.00 H new ATOM 0 HB3 ASP A 79 12.359 -7.835 -16.437 1.00 0.00 H new ATOM 1156 N LEU A 80 15.532 -6.855 -14.017 1.00 0.00 N ATOM 1157 CA LEU A 80 15.780 -5.785 -13.047 1.00 0.00 C ATOM 1158 C LEU A 80 16.220 -4.467 -13.712 1.00 0.00 C ATOM 1159 O LEU A 80 16.541 -3.504 -13.028 1.00 0.00 O ATOM 1160 CB LEU A 80 16.839 -6.196 -12.005 1.00 0.00 C ATOM 1161 CG LEU A 80 16.545 -7.237 -10.899 1.00 0.00 C ATOM 1162 CD1 LEU A 80 15.064 -7.564 -10.711 1.00 0.00 C ATOM 1163 CD2 LEU A 80 17.369 -8.513 -11.067 1.00 0.00 C ATOM 0 H LEU A 80 16.215 -7.611 -13.965 1.00 0.00 H new ATOM 0 HA LEU A 80 14.824 -5.617 -12.550 1.00 0.00 H new ATOM 0 HB2 LEU A 80 17.700 -6.565 -12.562 1.00 0.00 H new ATOM 0 HB3 LEU A 80 17.153 -5.282 -11.500 1.00 0.00 H new ATOM 0 HG LEU A 80 16.859 -6.744 -9.979 1.00 0.00 H new ATOM 0 HD11 LEU A 80 14.952 -8.302 -9.916 1.00 0.00 H new ATOM 0 HD12 LEU A 80 14.522 -6.657 -10.443 1.00 0.00 H new ATOM 0 HD13 LEU A 80 14.660 -7.967 -11.640 1.00 0.00 H new ATOM 0 HD21 LEU A 80 17.126 -9.211 -10.266 1.00 0.00 H new ATOM 0 HD22 LEU A 80 17.139 -8.970 -12.029 1.00 0.00 H new ATOM 0 HD23 LEU A 80 18.430 -8.269 -11.026 1.00 0.00 H new ATOM 1175 N SER A 81 16.247 -4.378 -15.035 1.00 0.00 N ATOM 1176 CA SER A 81 16.638 -3.260 -15.858 1.00 0.00 C ATOM 1177 C SER A 81 15.751 -2.023 -15.655 1.00 0.00 C ATOM 1178 O SER A 81 16.055 -0.949 -16.177 1.00 0.00 O ATOM 1179 CB SER A 81 16.533 -3.771 -17.298 1.00 0.00 C ATOM 1180 OG SER A 81 16.963 -5.116 -17.446 1.00 0.00 O ATOM 0 H SER A 81 15.965 -5.173 -15.609 1.00 0.00 H new ATOM 0 HA SER A 81 17.643 -2.928 -15.598 1.00 0.00 H new ATOM 0 HB2 SER A 81 15.499 -3.688 -17.632 1.00 0.00 H new ATOM 0 HB3 SER A 81 17.130 -3.132 -17.948 1.00 0.00 H new ATOM 0 HG SER A 81 16.205 -5.674 -17.720 1.00 0.00 H new ATOM 1186 N ALA A 82 14.661 -2.177 -14.898 1.00 0.00 N ATOM 1187 CA ALA A 82 13.710 -1.130 -14.555 1.00 0.00 C ATOM 1188 C ALA A 82 13.770 -0.811 -13.055 1.00 0.00 C ATOM 1189 O ALA A 82 12.908 -0.088 -12.550 1.00 0.00 O ATOM 1190 CB ALA A 82 12.312 -1.563 -15.010 1.00 0.00 C ATOM 0 H ALA A 82 14.411 -3.079 -14.492 1.00 0.00 H new ATOM 0 HA ALA A 82 13.966 -0.206 -15.073 1.00 0.00 H new ATOM 0 HB1 ALA A 82 11.590 -0.786 -14.758 1.00 0.00 H new ATOM 0 HB2 ALA A 82 12.313 -1.721 -16.088 1.00 0.00 H new ATOM 0 HB3 ALA A 82 12.037 -2.490 -14.507 1.00 0.00 H new ATOM 1196 N VAL A 83 14.770 -1.331 -12.332 1.00 0.00 N ATOM 1197 CA VAL A 83 14.984 -1.012 -10.923 1.00 0.00 C ATOM 1198 C VAL A 83 16.455 -0.665 -10.660 1.00 0.00 C ATOM 1199 O VAL A 83 17.356 -1.110 -11.374 1.00 0.00 O ATOM 1200 CB VAL A 83 14.379 -2.125 -10.029 1.00 0.00 C ATOM 1201 CG1 VAL A 83 14.663 -3.556 -10.500 1.00 0.00 C ATOM 1202 CG2 VAL A 83 14.801 -2.072 -8.560 1.00 0.00 C ATOM 0 H VAL A 83 15.453 -1.986 -12.713 1.00 0.00 H new ATOM 0 HA VAL A 83 14.445 -0.106 -10.646 1.00 0.00 H new ATOM 0 HB VAL A 83 13.317 -1.899 -10.125 1.00 0.00 H new ATOM 0 HG11 VAL A 83 14.200 -4.264 -9.812 1.00 0.00 H new ATOM 0 HG12 VAL A 83 14.251 -3.699 -11.499 1.00 0.00 H new ATOM 0 HG13 VAL A 83 15.740 -3.724 -10.524 1.00 0.00 H new ATOM 0 HG21 VAL A 83 14.328 -2.889 -8.016 1.00 0.00 H new ATOM 0 HG22 VAL A 83 15.884 -2.168 -8.489 1.00 0.00 H new ATOM 0 HG23 VAL A 83 14.492 -1.121 -8.127 1.00 0.00 H new ATOM 1212 N ARG A 84 16.700 0.150 -9.627 1.00 0.00 N ATOM 1213 CA ARG A 84 18.040 0.446 -9.121 1.00 0.00 C ATOM 1214 C ARG A 84 18.213 -0.271 -7.791 1.00 0.00 C ATOM 1215 O ARG A 84 17.228 -0.479 -7.075 1.00 0.00 O ATOM 1216 CB ARG A 84 18.254 1.965 -8.997 1.00 0.00 C ATOM 1217 CG ARG A 84 17.687 2.583 -7.701 1.00 0.00 C ATOM 1218 CD ARG A 84 17.721 4.113 -7.694 1.00 0.00 C ATOM 1219 NE ARG A 84 19.047 4.626 -8.078 1.00 0.00 N ATOM 1220 CZ ARG A 84 19.307 5.424 -9.126 1.00 0.00 C ATOM 1221 NH1 ARG A 84 18.333 6.052 -9.784 1.00 0.00 N ATOM 1222 NH2 ARG A 84 20.562 5.575 -9.525 1.00 0.00 N ATOM 0 H ARG A 84 15.960 0.628 -9.113 1.00 0.00 H new ATOM 0 HA ARG A 84 18.798 0.088 -9.817 1.00 0.00 H new ATOM 0 HB2 ARG A 84 19.322 2.175 -9.049 1.00 0.00 H new ATOM 0 HB3 ARG A 84 17.791 2.456 -9.853 1.00 0.00 H new ATOM 0 HG2 ARG A 84 16.658 2.249 -7.567 1.00 0.00 H new ATOM 0 HG3 ARG A 84 18.256 2.210 -6.850 1.00 0.00 H new ATOM 0 HD2 ARG A 84 16.968 4.498 -8.382 1.00 0.00 H new ATOM 0 HD3 ARG A 84 17.462 4.479 -6.701 1.00 0.00 H new ATOM 0 HE ARG A 84 19.838 4.351 -7.496 1.00 0.00 H new ATOM 0 HH11 ARG A 84 17.362 5.932 -9.495 1.00 0.00 H new ATOM 0 HH12 ARG A 84 18.558 6.653 -10.577 1.00 0.00 H new ATOM 0 HH21 ARG A 84 21.314 5.088 -9.037 1.00 0.00 H new ATOM 0 HH22 ARG A 84 20.775 6.178 -10.320 1.00 0.00 H new ATOM 1236 N PHE A 85 19.449 -0.610 -7.443 1.00 0.00 N ATOM 1237 CA PHE A 85 19.776 -1.338 -6.231 1.00 0.00 C ATOM 1238 C PHE A 85 20.709 -0.467 -5.398 1.00 0.00 C ATOM 1239 O PHE A 85 21.440 0.374 -5.933 1.00 0.00 O ATOM 1240 CB PHE A 85 20.467 -2.662 -6.604 1.00 0.00 C ATOM 1241 CG PHE A 85 19.549 -3.855 -6.827 1.00 0.00 C ATOM 1242 CD1 PHE A 85 18.460 -3.780 -7.720 1.00 0.00 C ATOM 1243 CD2 PHE A 85 19.802 -5.066 -6.154 1.00 0.00 C ATOM 1244 CE1 PHE A 85 17.648 -4.900 -7.950 1.00 0.00 C ATOM 1245 CE2 PHE A 85 18.987 -6.188 -6.385 1.00 0.00 C ATOM 1246 CZ PHE A 85 17.923 -6.111 -7.297 1.00 0.00 C ATOM 0 H PHE A 85 20.265 -0.380 -8.009 1.00 0.00 H new ATOM 0 HA PHE A 85 18.877 -1.567 -5.660 1.00 0.00 H new ATOM 0 HB2 PHE A 85 21.049 -2.502 -7.512 1.00 0.00 H new ATOM 0 HB3 PHE A 85 21.173 -2.915 -5.813 1.00 0.00 H new ATOM 0 HD1 PHE A 85 18.250 -2.852 -8.231 1.00 0.00 H new ATOM 0 HD2 PHE A 85 20.625 -5.133 -5.458 1.00 0.00 H new ATOM 0 HE1 PHE A 85 16.811 -4.830 -8.629 1.00 0.00 H new ATOM 0 HE2 PHE A 85 19.180 -7.111 -5.859 1.00 0.00 H new ATOM 0 HZ PHE A 85 17.317 -6.983 -7.496 1.00 0.00 H new ATOM 1256 N GLY A 86 20.733 -0.716 -4.093 1.00 0.00 N ATOM 1257 CA GLY A 86 21.708 -0.153 -3.177 1.00 0.00 C ATOM 1258 C GLY A 86 22.137 -1.285 -2.251 1.00 0.00 C ATOM 1259 O GLY A 86 21.284 -1.983 -1.692 1.00 0.00 O ATOM 0 H GLY A 86 20.058 -1.329 -3.636 1.00 0.00 H new ATOM 0 HA2 GLY A 86 22.563 0.249 -3.720 1.00 0.00 H new ATOM 0 HA3 GLY A 86 21.276 0.670 -2.608 1.00 0.00 H new ATOM 1263 N ALA A 87 23.445 -1.520 -2.151 1.00 0.00 N ATOM 1264 CA ALA A 87 24.012 -2.613 -1.372 1.00 0.00 C ATOM 1265 C ALA A 87 24.363 -2.084 0.014 1.00 0.00 C ATOM 1266 O ALA A 87 24.899 -0.979 0.132 1.00 0.00 O ATOM 1267 CB ALA A 87 25.263 -3.137 -2.085 1.00 0.00 C ATOM 0 H ALA A 87 24.148 -0.946 -2.617 1.00 0.00 H new ATOM 0 HA ALA A 87 23.299 -3.432 -1.274 1.00 0.00 H new ATOM 0 HB1 ALA A 87 25.694 -3.956 -1.509 1.00 0.00 H new ATOM 0 HB2 ALA A 87 24.992 -3.495 -3.078 1.00 0.00 H new ATOM 0 HB3 ALA A 87 25.994 -2.333 -2.176 1.00 0.00 H new ATOM 1273 N ILE A 88 24.092 -2.866 1.057 1.00 0.00 N ATOM 1274 CA ILE A 88 24.179 -2.439 2.447 1.00 0.00 C ATOM 1275 C ILE A 88 24.801 -3.607 3.218 1.00 0.00 C ATOM 1276 O ILE A 88 24.314 -4.734 3.135 1.00 0.00 O ATOM 1277 CB ILE A 88 22.759 -2.073 2.956 1.00 0.00 C ATOM 1278 CG1 ILE A 88 22.063 -1.040 2.032 1.00 0.00 C ATOM 1279 CG2 ILE A 88 22.783 -1.617 4.424 1.00 0.00 C ATOM 1280 CD1 ILE A 88 20.806 -0.365 2.589 1.00 0.00 C ATOM 0 H ILE A 88 23.799 -3.837 0.954 1.00 0.00 H new ATOM 0 HA ILE A 88 24.795 -1.550 2.580 1.00 0.00 H new ATOM 0 HB ILE A 88 22.157 -2.981 2.917 1.00 0.00 H new ATOM 0 HG12 ILE A 88 22.786 -0.263 1.783 1.00 0.00 H new ATOM 0 HG13 ILE A 88 21.798 -1.539 1.100 1.00 0.00 H new ATOM 0 HG21 ILE A 88 21.771 -1.369 4.745 1.00 0.00 H new ATOM 0 HG22 ILE A 88 23.175 -2.420 5.048 1.00 0.00 H new ATOM 0 HG23 ILE A 88 23.420 -0.738 4.522 1.00 0.00 H new ATOM 0 HD11 ILE A 88 20.412 0.335 1.852 1.00 0.00 H new ATOM 0 HD12 ILE A 88 20.054 -1.122 2.809 1.00 0.00 H new ATOM 0 HD13 ILE A 88 21.057 0.174 3.503 1.00 0.00 H new ATOM 1292 N GLY A 89 25.905 -3.360 3.929 1.00 0.00 N ATOM 1293 CA GLY A 89 26.613 -4.368 4.722 1.00 0.00 C ATOM 1294 C GLY A 89 27.372 -5.410 3.889 1.00 0.00 C ATOM 1295 O GLY A 89 28.183 -6.157 4.436 1.00 0.00 O ATOM 0 H GLY A 89 26.339 -2.438 3.970 1.00 0.00 H new ATOM 0 HA2 GLY A 89 27.319 -3.864 5.382 1.00 0.00 H new ATOM 0 HA3 GLY A 89 25.894 -4.883 5.359 1.00 0.00 H new ATOM 1299 N ILE A 90 27.133 -5.468 2.575 1.00 0.00 N ATOM 1300 CA ILE A 90 27.860 -6.302 1.623 1.00 0.00 C ATOM 1301 C ILE A 90 29.358 -5.973 1.755 1.00 0.00 C ATOM 1302 O ILE A 90 29.739 -4.805 1.806 1.00 0.00 O ATOM 1303 CB ILE A 90 27.277 -6.065 0.203 1.00 0.00 C ATOM 1304 CG1 ILE A 90 25.748 -6.318 0.111 1.00 0.00 C ATOM 1305 CG2 ILE A 90 27.991 -6.891 -0.879 1.00 0.00 C ATOM 1306 CD1 ILE A 90 25.277 -7.733 0.456 1.00 0.00 C ATOM 0 H ILE A 90 26.400 -4.913 2.133 1.00 0.00 H new ATOM 0 HA ILE A 90 27.747 -7.367 1.823 1.00 0.00 H new ATOM 0 HB ILE A 90 27.457 -5.006 0.016 1.00 0.00 H new ATOM 0 HG12 ILE A 90 25.244 -5.617 0.776 1.00 0.00 H new ATOM 0 HG13 ILE A 90 25.422 -6.086 -0.903 1.00 0.00 H new ATOM 0 HG21 ILE A 90 27.541 -6.685 -1.850 1.00 0.00 H new ATOM 0 HG22 ILE A 90 29.047 -6.623 -0.904 1.00 0.00 H new ATOM 0 HG23 ILE A 90 27.892 -7.952 -0.651 1.00 0.00 H new ATOM 0 HD11 ILE A 90 24.193 -7.790 0.357 1.00 0.00 H new ATOM 0 HD12 ILE A 90 25.742 -8.447 -0.224 1.00 0.00 H new ATOM 0 HD13 ILE A 90 25.560 -7.971 1.481 1.00 0.00 H new ATOM 1318 N GLY A 91 30.208 -7.003 1.818 1.00 0.00 N ATOM 1319 CA GLY A 91 31.660 -6.839 1.912 1.00 0.00 C ATOM 1320 C GLY A 91 32.332 -6.979 0.550 1.00 0.00 C ATOM 1321 O GLY A 91 33.429 -6.470 0.342 1.00 0.00 O ATOM 0 H GLY A 91 29.906 -7.977 1.805 1.00 0.00 H new ATOM 0 HA2 GLY A 91 31.889 -5.860 2.332 1.00 0.00 H new ATOM 0 HA3 GLY A 91 32.067 -7.583 2.597 1.00 0.00 H new ATOM 1325 N SER A 92 31.666 -7.638 -0.396 1.00 0.00 N ATOM 1326 CA SER A 92 32.224 -8.054 -1.673 1.00 0.00 C ATOM 1327 C SER A 92 32.770 -6.913 -2.541 1.00 0.00 C ATOM 1328 O SER A 92 33.719 -7.113 -3.300 1.00 0.00 O ATOM 1329 CB SER A 92 31.150 -8.862 -2.399 1.00 0.00 C ATOM 1330 OG SER A 92 30.611 -9.851 -1.530 1.00 0.00 O ATOM 0 H SER A 92 30.688 -7.905 -0.286 1.00 0.00 H new ATOM 0 HA SER A 92 33.108 -8.660 -1.476 1.00 0.00 H new ATOM 0 HB2 SER A 92 30.357 -8.199 -2.745 1.00 0.00 H new ATOM 0 HB3 SER A 92 31.576 -9.337 -3.283 1.00 0.00 H new ATOM 0 HG SER A 92 29.922 -10.363 -2.004 1.00 0.00 H new ATOM 1501 N LYS A 104 30.002 -13.015 -6.875 1.00 0.00 N ATOM 1502 CA LYS A 104 29.141 -13.599 -7.905 1.00 0.00 C ATOM 1503 C LYS A 104 27.655 -13.330 -7.653 1.00 0.00 C ATOM 1504 O LYS A 104 26.893 -13.266 -8.617 1.00 0.00 O ATOM 1505 CB LYS A 104 29.393 -15.110 -8.040 1.00 0.00 C ATOM 1506 CG LYS A 104 30.832 -15.432 -8.459 1.00 0.00 C ATOM 1507 CD LYS A 104 31.081 -16.929 -8.697 1.00 0.00 C ATOM 1508 CE LYS A 104 30.309 -17.461 -9.915 1.00 0.00 C ATOM 1509 NZ LYS A 104 30.622 -18.884 -10.200 1.00 0.00 N ATOM 0 HA LYS A 104 29.404 -13.109 -8.843 1.00 0.00 H new ATOM 0 HB2 LYS A 104 29.178 -15.597 -7.089 1.00 0.00 H new ATOM 0 HB3 LYS A 104 28.703 -15.526 -8.774 1.00 0.00 H new ATOM 0 HG2 LYS A 104 31.068 -14.883 -9.371 1.00 0.00 H new ATOM 0 HG3 LYS A 104 31.515 -15.076 -7.687 1.00 0.00 H new ATOM 0 HD2 LYS A 104 32.148 -17.099 -8.843 1.00 0.00 H new ATOM 0 HD3 LYS A 104 30.787 -17.490 -7.810 1.00 0.00 H new ATOM 0 HE2 LYS A 104 29.239 -17.354 -9.739 1.00 0.00 H new ATOM 0 HE3 LYS A 104 30.550 -16.856 -10.789 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 30.079 -19.200 -11.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 31.639 -18.984 -10.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 30.368 -19.467 -9.377 1.00 0.00 H new ATOM 1523 N LEU A 105 27.240 -13.147 -6.394 1.00 0.00 N ATOM 1524 CA LEU A 105 25.870 -12.779 -6.058 1.00 0.00 C ATOM 1525 C LEU A 105 25.524 -11.429 -6.696 1.00 0.00 C ATOM 1526 O LEU A 105 24.586 -11.338 -7.490 1.00 0.00 O ATOM 1527 CB LEU A 105 25.722 -12.759 -4.524 1.00 0.00 C ATOM 1528 CG LEU A 105 24.289 -12.620 -3.971 1.00 0.00 C ATOM 1529 CD1 LEU A 105 23.633 -11.260 -4.223 1.00 0.00 C ATOM 1530 CD2 LEU A 105 23.377 -13.730 -4.500 1.00 0.00 C ATOM 0 H LEU A 105 27.849 -13.251 -5.583 1.00 0.00 H new ATOM 0 HA LEU A 105 25.166 -13.510 -6.455 1.00 0.00 H new ATOM 0 HB2 LEU A 105 26.152 -13.679 -4.128 1.00 0.00 H new ATOM 0 HB3 LEU A 105 26.319 -11.934 -4.135 1.00 0.00 H new ATOM 0 HG LEU A 105 24.407 -12.711 -2.891 1.00 0.00 H new ATOM 0 HD11 LEU A 105 22.629 -11.256 -3.799 1.00 0.00 H new ATOM 0 HD12 LEU A 105 24.228 -10.477 -3.754 1.00 0.00 H new ATOM 0 HD13 LEU A 105 23.574 -11.078 -5.296 1.00 0.00 H new ATOM 0 HD21 LEU A 105 22.375 -13.603 -4.091 1.00 0.00 H new ATOM 0 HD22 LEU A 105 23.334 -13.678 -5.588 1.00 0.00 H new ATOM 0 HD23 LEU A 105 23.772 -14.700 -4.198 1.00 0.00 H new ATOM 1542 N GLU A 106 26.301 -10.387 -6.384 1.00 0.00 N ATOM 1543 CA GLU A 106 26.121 -9.069 -6.981 1.00 0.00 C ATOM 1544 C GLU A 106 26.343 -9.131 -8.492 1.00 0.00 C ATOM 1545 O GLU A 106 25.636 -8.452 -9.231 1.00 0.00 O ATOM 1546 CB GLU A 106 27.043 -8.026 -6.357 1.00 0.00 C ATOM 1547 CG GLU A 106 26.636 -7.715 -4.914 1.00 0.00 C ATOM 1548 CD GLU A 106 25.206 -7.160 -4.748 1.00 0.00 C ATOM 1549 OE1 GLU A 106 24.798 -6.267 -5.525 1.00 0.00 O ATOM 1550 OE2 GLU A 106 24.501 -7.596 -3.813 1.00 0.00 O ATOM 0 H GLU A 106 27.068 -10.437 -5.713 1.00 0.00 H new ATOM 0 HA GLU A 106 25.094 -8.762 -6.781 1.00 0.00 H new ATOM 0 HB2 GLU A 106 28.071 -8.388 -6.377 1.00 0.00 H new ATOM 0 HB3 GLU A 106 27.015 -7.112 -6.950 1.00 0.00 H new ATOM 0 HG2 GLU A 106 26.728 -8.625 -4.322 1.00 0.00 H new ATOM 0 HG3 GLU A 106 27.341 -6.993 -4.501 1.00 0.00 H new ATOM 1557 N ALA A 107 27.286 -9.955 -8.962 1.00 0.00 N ATOM 1558 CA ALA A 107 27.584 -10.057 -10.379 1.00 0.00 C ATOM 1559 C ALA A 107 26.334 -10.502 -11.129 1.00 0.00 C ATOM 1560 O ALA A 107 25.943 -9.825 -12.074 1.00 0.00 O ATOM 1561 CB ALA A 107 28.754 -11.011 -10.637 1.00 0.00 C ATOM 0 H ALA A 107 27.855 -10.561 -8.370 1.00 0.00 H new ATOM 0 HA ALA A 107 27.888 -9.076 -10.745 1.00 0.00 H new ATOM 0 HB1 ALA A 107 28.951 -11.064 -11.708 1.00 0.00 H new ATOM 0 HB2 ALA A 107 29.642 -10.645 -10.123 1.00 0.00 H new ATOM 0 HB3 ALA A 107 28.503 -12.004 -10.264 1.00 0.00 H new ATOM 1567 N GLU A 108 25.672 -11.578 -10.682 1.00 0.00 N ATOM 1568 CA GLU A 108 24.445 -12.065 -11.299 1.00 0.00 C ATOM 1569 C GLU A 108 23.361 -10.993 -11.257 1.00 0.00 C ATOM 1570 O GLU A 108 22.680 -10.799 -12.264 1.00 0.00 O ATOM 1571 CB GLU A 108 23.944 -13.329 -10.586 1.00 0.00 C ATOM 1572 CG GLU A 108 24.542 -14.647 -11.091 1.00 0.00 C ATOM 1573 CD GLU A 108 23.973 -15.101 -12.444 1.00 0.00 C ATOM 1574 OE1 GLU A 108 24.123 -14.419 -13.482 1.00 0.00 O ATOM 1575 OE2 GLU A 108 23.397 -16.205 -12.496 1.00 0.00 O ATOM 0 H GLU A 108 25.978 -12.131 -9.881 1.00 0.00 H new ATOM 0 HA GLU A 108 24.666 -12.308 -12.338 1.00 0.00 H new ATOM 0 HB2 GLU A 108 24.160 -13.235 -9.522 1.00 0.00 H new ATOM 0 HB3 GLU A 108 22.860 -13.378 -10.688 1.00 0.00 H new ATOM 0 HG2 GLU A 108 25.623 -14.536 -11.179 1.00 0.00 H new ATOM 0 HG3 GLU A 108 24.361 -15.426 -10.350 1.00 0.00 H new ATOM 1582 N LEU A 109 23.207 -10.275 -10.140 1.00 0.00 N ATOM 1583 CA LEU A 109 22.194 -9.227 -10.001 1.00 0.00 C ATOM 1584 C LEU A 109 22.398 -8.121 -11.037 1.00 0.00 C ATOM 1585 O LEU A 109 21.454 -7.734 -11.731 1.00 0.00 O ATOM 1586 CB LEU A 109 22.240 -8.635 -8.579 1.00 0.00 C ATOM 1587 CG LEU A 109 21.458 -9.443 -7.530 1.00 0.00 C ATOM 1588 CD1 LEU A 109 21.717 -8.849 -6.143 1.00 0.00 C ATOM 1589 CD2 LEU A 109 19.949 -9.439 -7.811 1.00 0.00 C ATOM 0 H LEU A 109 23.782 -10.405 -9.307 1.00 0.00 H new ATOM 0 HA LEU A 109 21.215 -9.675 -10.173 1.00 0.00 H new ATOM 0 HB2 LEU A 109 23.280 -8.562 -8.262 1.00 0.00 H new ATOM 0 HB3 LEU A 109 21.844 -7.620 -8.608 1.00 0.00 H new ATOM 0 HG LEU A 109 21.802 -10.476 -7.576 1.00 0.00 H new ATOM 0 HD11 LEU A 109 21.165 -9.418 -5.395 1.00 0.00 H new ATOM 0 HD12 LEU A 109 22.783 -8.895 -5.921 1.00 0.00 H new ATOM 0 HD13 LEU A 109 21.388 -7.810 -6.125 1.00 0.00 H new ATOM 0 HD21 LEU A 109 19.435 -10.021 -7.046 1.00 0.00 H new ATOM 0 HD22 LEU A 109 19.579 -8.414 -7.797 1.00 0.00 H new ATOM 0 HD23 LEU A 109 19.760 -9.879 -8.790 1.00 0.00 H new ATOM 1601 N LYS A 110 23.629 -7.629 -11.179 1.00 0.00 N ATOM 1602 CA LYS A 110 23.954 -6.545 -12.097 1.00 0.00 C ATOM 1603 C LYS A 110 23.798 -7.023 -13.542 1.00 0.00 C ATOM 1604 O LYS A 110 23.311 -6.283 -14.394 1.00 0.00 O ATOM 1605 CB LYS A 110 25.376 -6.041 -11.788 1.00 0.00 C ATOM 1606 CG LYS A 110 25.473 -5.455 -10.361 1.00 0.00 C ATOM 1607 CD LYS A 110 26.921 -5.243 -9.883 1.00 0.00 C ATOM 1608 CE LYS A 110 27.448 -3.852 -10.267 1.00 0.00 C ATOM 1609 NZ LYS A 110 28.887 -3.687 -9.942 1.00 0.00 N ATOM 0 H LYS A 110 24.432 -7.976 -10.655 1.00 0.00 H new ATOM 0 HA LYS A 110 23.267 -5.709 -11.966 1.00 0.00 H new ATOM 0 HB2 LYS A 110 26.085 -6.862 -11.894 1.00 0.00 H new ATOM 0 HB3 LYS A 110 25.659 -5.280 -12.515 1.00 0.00 H new ATOM 0 HG2 LYS A 110 24.945 -4.502 -10.331 1.00 0.00 H new ATOM 0 HG3 LYS A 110 24.963 -6.123 -9.667 1.00 0.00 H new ATOM 0 HD2 LYS A 110 26.968 -5.364 -8.801 1.00 0.00 H new ATOM 0 HD3 LYS A 110 27.564 -6.008 -10.318 1.00 0.00 H new ATOM 0 HE2 LYS A 110 27.298 -3.691 -11.334 1.00 0.00 H new ATOM 0 HE3 LYS A 110 26.870 -3.090 -9.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 29.198 -2.734 -10.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 29.029 -3.815 -8.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 29.443 -4.397 -10.460 1.00 0.00 H new ATOM 1623 N ASN A 111 24.144 -8.286 -13.810 1.00 0.00 N ATOM 1624 CA ASN A 111 23.953 -8.944 -15.098 1.00 0.00 C ATOM 1625 C ASN A 111 22.469 -9.138 -15.423 1.00 0.00 C ATOM 1626 O ASN A 111 22.096 -9.101 -16.594 1.00 0.00 O ATOM 1627 CB ASN A 111 24.721 -10.278 -15.073 1.00 0.00 C ATOM 1628 CG ASN A 111 24.000 -11.488 -15.648 1.00 0.00 C ATOM 1629 OD1 ASN A 111 24.233 -11.909 -16.778 1.00 0.00 O ATOM 1630 ND2 ASN A 111 23.179 -12.112 -14.823 1.00 0.00 N ATOM 0 H ASN A 111 24.577 -8.893 -13.114 1.00 0.00 H new ATOM 0 HA ASN A 111 24.347 -8.314 -15.896 1.00 0.00 H new ATOM 0 HB2 ASN A 111 25.654 -10.145 -15.621 1.00 0.00 H new ATOM 0 HB3 ASN A 111 24.987 -10.499 -14.039 1.00 0.00 H new ATOM 0 HD21 ASN A 111 22.716 -12.972 -15.118 1.00 0.00 H new ATOM 0 HD22 ASN A 111 23.008 -11.734 -13.891 1.00 0.00 H new ATOM 1637 N SER A 112 21.628 -9.337 -14.404 1.00 0.00 N ATOM 1638 CA SER A 112 20.201 -9.563 -14.591 1.00 0.00 C ATOM 1639 C SER A 112 19.512 -8.279 -15.081 1.00 0.00 C ATOM 1640 O SER A 112 18.591 -8.363 -15.894 1.00 0.00 O ATOM 1641 CB SER A 112 19.564 -10.098 -13.308 1.00 0.00 C ATOM 1642 OG SER A 112 20.139 -11.333 -12.921 1.00 0.00 O ATOM 0 H SER A 112 21.922 -9.345 -13.427 1.00 0.00 H new ATOM 0 HA SER A 112 20.065 -10.323 -15.361 1.00 0.00 H new ATOM 0 HB2 SER A 112 19.689 -9.370 -12.507 1.00 0.00 H new ATOM 0 HB3 SER A 112 18.492 -10.225 -13.458 1.00 0.00 H new ATOM 0 HG SER A 112 21.045 -11.180 -12.580 1.00 0.00 H new ATOM 1648 N GLY A 113 19.977 -7.093 -14.653 1.00 0.00 N ATOM 1649 CA GLY A 113 19.522 -5.838 -15.247 1.00 0.00 C ATOM 1650 C GLY A 113 19.838 -4.575 -14.444 1.00 0.00 C ATOM 1651 O GLY A 113 20.143 -3.543 -15.047 1.00 0.00 O ATOM 0 H GLY A 113 20.661 -6.984 -13.905 1.00 0.00 H new ATOM 0 HA2 GLY A 113 19.971 -5.741 -16.235 1.00 0.00 H new ATOM 0 HA3 GLY A 113 18.443 -5.895 -15.391 1.00 0.00 H new ATOM 1655 N ALA A 114 19.742 -4.627 -13.111 1.00 0.00 N ATOM 1656 CA ALA A 114 19.900 -3.448 -12.259 1.00 0.00 C ATOM 1657 C ALA A 114 21.356 -2.968 -12.221 1.00 0.00 C ATOM 1658 O ALA A 114 22.268 -3.641 -12.705 1.00 0.00 O ATOM 1659 CB ALA A 114 19.391 -3.740 -10.839 1.00 0.00 C ATOM 0 H ALA A 114 19.553 -5.487 -12.595 1.00 0.00 H new ATOM 0 HA ALA A 114 19.301 -2.646 -12.690 1.00 0.00 H new ATOM 0 HB1 ALA A 114 19.516 -2.853 -10.218 1.00 0.00 H new ATOM 0 HB2 ALA A 114 18.336 -4.009 -10.879 1.00 0.00 H new ATOM 0 HB3 ALA A 114 19.960 -4.565 -10.411 1.00 0.00 H new ATOM 1665 N LYS A 115 21.583 -1.826 -11.568 1.00 0.00 N ATOM 1666 CA LYS A 115 22.907 -1.316 -11.238 1.00 0.00 C ATOM 1667 C LYS A 115 22.897 -0.907 -9.771 1.00 0.00 C ATOM 1668 O LYS A 115 21.869 -0.446 -9.262 1.00 0.00 O ATOM 1669 CB LYS A 115 23.297 -0.159 -12.177 1.00 0.00 C ATOM 1670 CG LYS A 115 22.284 1.000 -12.213 1.00 0.00 C ATOM 1671 CD LYS A 115 22.788 2.140 -13.109 1.00 0.00 C ATOM 1672 CE LYS A 115 21.752 3.271 -13.162 1.00 0.00 C ATOM 1673 NZ LYS A 115 22.184 4.384 -14.044 1.00 0.00 N ATOM 0 H LYS A 115 20.829 -1.218 -11.248 1.00 0.00 H new ATOM 0 HA LYS A 115 23.667 -2.084 -11.384 1.00 0.00 H new ATOM 0 HB2 LYS A 115 24.267 0.232 -11.869 1.00 0.00 H new ATOM 0 HB3 LYS A 115 23.418 -0.552 -13.187 1.00 0.00 H new ATOM 0 HG2 LYS A 115 21.325 0.638 -12.583 1.00 0.00 H new ATOM 0 HG3 LYS A 115 22.116 1.373 -11.203 1.00 0.00 H new ATOM 0 HD2 LYS A 115 23.734 2.522 -12.726 1.00 0.00 H new ATOM 0 HD3 LYS A 115 22.979 1.765 -14.114 1.00 0.00 H new ATOM 0 HE2 LYS A 115 20.801 2.875 -13.519 1.00 0.00 H new ATOM 0 HE3 LYS A 115 21.581 3.652 -12.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 21.455 5.125 -14.050 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 23.078 4.781 -13.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 22.323 4.027 -15.011 1.00 0.00 H new ATOM 1687 N GLN A 116 24.033 -1.086 -9.100 1.00 0.00 N ATOM 1688 CA GLN A 116 24.245 -0.550 -7.767 1.00 0.00 C ATOM 1689 C GLN A 116 24.461 0.956 -7.929 1.00 0.00 C ATOM 1690 O GLN A 116 25.339 1.376 -8.688 1.00 0.00 O ATOM 1691 CB GLN A 116 25.438 -1.251 -7.101 1.00 0.00 C ATOM 1692 CG GLN A 116 25.734 -0.663 -5.709 1.00 0.00 C ATOM 1693 CD GLN A 116 26.895 -1.324 -4.961 1.00 0.00 C ATOM 1694 OE1 GLN A 116 27.431 -2.360 -5.347 1.00 0.00 O ATOM 1695 NE2 GLN A 116 27.304 -0.715 -3.857 1.00 0.00 N ATOM 0 H GLN A 116 24.829 -1.607 -9.469 1.00 0.00 H new ATOM 0 HA GLN A 116 23.390 -0.726 -7.114 1.00 0.00 H new ATOM 0 HB2 GLN A 116 25.230 -2.317 -7.010 1.00 0.00 H new ATOM 0 HB3 GLN A 116 26.320 -1.151 -7.734 1.00 0.00 H new ATOM 0 HG2 GLN A 116 25.950 0.400 -5.819 1.00 0.00 H new ATOM 0 HG3 GLN A 116 24.835 -0.744 -5.098 1.00 0.00 H new ATOM 0 HE21 GLN A 116 26.848 0.144 -3.550 1.00 0.00 H new ATOM 0 HE22 GLN A 116 28.074 -1.106 -3.314 1.00 0.00 H new ATOM 1704 N THR A 117 23.683 1.764 -7.213 1.00 0.00 N ATOM 1705 CA THR A 117 23.901 3.205 -7.129 1.00 0.00 C ATOM 1706 C THR A 117 24.857 3.514 -5.967 1.00 0.00 C ATOM 1707 O THR A 117 24.951 2.740 -5.008 1.00 0.00 O ATOM 1708 CB THR A 117 22.541 3.883 -6.934 1.00 0.00 C ATOM 1709 OG1 THR A 117 21.660 3.476 -7.960 1.00 0.00 O ATOM 1710 CG2 THR A 117 22.596 5.414 -6.977 1.00 0.00 C ATOM 0 H THR A 117 22.882 1.437 -6.673 1.00 0.00 H new ATOM 0 HA THR A 117 24.359 3.585 -8.042 1.00 0.00 H new ATOM 0 HB THR A 117 22.204 3.581 -5.942 1.00 0.00 H new ATOM 0 HG1 THR A 117 21.067 2.773 -7.622 1.00 0.00 H new ATOM 0 HG21 THR A 117 21.594 5.818 -6.831 1.00 0.00 H new ATOM 0 HG22 THR A 117 23.252 5.777 -6.186 1.00 0.00 H new ATOM 0 HG23 THR A 117 22.980 5.737 -7.944 1.00 0.00 H new ATOM 1718 N GLY A 118 25.512 4.678 -6.019 1.00 0.00 N ATOM 1719 CA GLY A 118 26.282 5.213 -4.913 1.00 0.00 C ATOM 1720 C GLY A 118 27.500 4.335 -4.667 1.00 0.00 C ATOM 1721 O GLY A 118 28.204 3.945 -5.602 1.00 0.00 O ATOM 0 H GLY A 118 25.517 5.276 -6.845 1.00 0.00 H new ATOM 0 HA2 GLY A 118 26.595 6.233 -5.135 1.00 0.00 H new ATOM 0 HA3 GLY A 118 25.666 5.257 -4.015 1.00 0.00 H new ATOM 1725 N GLU A 119 27.718 4.007 -3.399 1.00 0.00 N ATOM 1726 CA GLU A 119 28.687 3.013 -2.961 1.00 0.00 C ATOM 1727 C GLU A 119 28.112 2.281 -1.748 1.00 0.00 C ATOM 1728 O GLU A 119 27.173 2.774 -1.118 1.00 0.00 O ATOM 1729 CB GLU A 119 30.056 3.652 -2.680 1.00 0.00 C ATOM 1730 CG GLU A 119 30.177 4.414 -1.353 1.00 0.00 C ATOM 1731 CD GLU A 119 31.610 4.937 -1.153 1.00 0.00 C ATOM 1732 OE1 GLU A 119 32.533 4.108 -0.972 1.00 0.00 O ATOM 1733 OE2 GLU A 119 31.823 6.172 -1.167 1.00 0.00 O ATOM 0 H GLU A 119 27.211 4.438 -2.626 1.00 0.00 H new ATOM 0 HA GLU A 119 28.864 2.286 -3.753 1.00 0.00 H new ATOM 0 HB2 GLU A 119 30.813 2.868 -2.697 1.00 0.00 H new ATOM 0 HB3 GLU A 119 30.290 4.338 -3.494 1.00 0.00 H new ATOM 0 HG2 GLU A 119 29.476 5.248 -1.342 1.00 0.00 H new ATOM 0 HG3 GLU A 119 29.905 3.758 -0.526 1.00 0.00 H new ATOM 1740 N THR A 120 28.659 1.108 -1.434 1.00 0.00 N ATOM 1741 CA THR A 120 28.101 0.190 -0.451 1.00 0.00 C ATOM 1742 C THR A 120 27.953 0.855 0.924 1.00 0.00 C ATOM 1743 O THR A 120 28.921 1.377 1.492 1.00 0.00 O ATOM 1744 CB THR A 120 28.963 -1.076 -0.422 1.00 0.00 C ATOM 1745 OG1 THR A 120 29.178 -1.496 -1.760 1.00 0.00 O ATOM 1746 CG2 THR A 120 28.283 -2.219 0.325 1.00 0.00 C ATOM 0 H THR A 120 29.518 0.766 -1.865 1.00 0.00 H new ATOM 0 HA THR A 120 27.088 -0.093 -0.737 1.00 0.00 H new ATOM 0 HB THR A 120 29.895 -0.838 0.091 1.00 0.00 H new ATOM 0 HG1 THR A 120 28.670 -2.317 -1.931 1.00 0.00 H new ATOM 0 HG21 THR A 120 28.932 -3.095 0.319 1.00 0.00 H new ATOM 0 HG22 THR A 120 28.090 -1.917 1.355 1.00 0.00 H new ATOM 0 HG23 THR A 120 27.340 -2.463 -0.164 1.00 0.00 H new ATOM 1754 N LEU A 121 26.720 0.823 1.431 1.00 0.00 N ATOM 1755 CA LEU A 121 26.315 1.324 2.735 1.00 0.00 C ATOM 1756 C LEU A 121 26.729 0.300 3.792 1.00 0.00 C ATOM 1757 O LEU A 121 27.115 -0.824 3.459 1.00 0.00 O ATOM 1758 CB LEU A 121 24.783 1.512 2.731 1.00 0.00 C ATOM 1759 CG LEU A 121 24.287 2.859 3.271 1.00 0.00 C ATOM 1760 CD1 LEU A 121 22.759 2.919 3.194 1.00 0.00 C ATOM 1761 CD2 LEU A 121 24.718 3.170 4.709 1.00 0.00 C ATOM 0 H LEU A 121 25.938 0.424 0.911 1.00 0.00 H new ATOM 0 HA LEU A 121 26.790 2.280 2.957 1.00 0.00 H new ATOM 0 HB2 LEU A 121 24.422 1.393 1.710 1.00 0.00 H new ATOM 0 HB3 LEU A 121 24.334 0.714 3.323 1.00 0.00 H new ATOM 0 HG LEU A 121 24.753 3.613 2.636 1.00 0.00 H new ATOM 0 HD11 LEU A 121 22.413 3.878 3.579 1.00 0.00 H new ATOM 0 HD12 LEU A 121 22.442 2.809 2.157 1.00 0.00 H new ATOM 0 HD13 LEU A 121 22.333 2.113 3.791 1.00 0.00 H new ATOM 0 HD21 LEU A 121 24.322 4.141 5.006 1.00 0.00 H new ATOM 0 HD22 LEU A 121 24.333 2.401 5.379 1.00 0.00 H new ATOM 0 HD23 LEU A 121 25.806 3.189 4.767 1.00 0.00 H new ATOM 1773 N LYS A 122 26.616 0.637 5.074 1.00 0.00 N ATOM 1774 CA LYS A 122 26.962 -0.253 6.176 1.00 0.00 C ATOM 1775 C LYS A 122 25.905 -0.138 7.257 1.00 0.00 C ATOM 1776 O LYS A 122 25.243 0.893 7.371 1.00 0.00 O ATOM 1777 CB LYS A 122 28.345 0.106 6.757 1.00 0.00 C ATOM 1778 CG LYS A 122 29.516 -0.418 5.911 1.00 0.00 C ATOM 1779 CD LYS A 122 29.980 0.581 4.842 1.00 0.00 C ATOM 1780 CE LYS A 122 30.952 -0.103 3.879 1.00 0.00 C ATOM 1781 NZ LYS A 122 31.470 0.841 2.873 1.00 0.00 N ATOM 0 H LYS A 122 26.277 1.549 5.380 1.00 0.00 H new ATOM 0 HA LYS A 122 27.004 -1.277 5.804 1.00 0.00 H new ATOM 0 HB2 LYS A 122 28.425 1.190 6.843 1.00 0.00 H new ATOM 0 HB3 LYS A 122 28.424 -0.300 7.765 1.00 0.00 H new ATOM 0 HG2 LYS A 122 30.354 -0.654 6.567 1.00 0.00 H new ATOM 0 HG3 LYS A 122 29.219 -1.348 5.426 1.00 0.00 H new ATOM 0 HD2 LYS A 122 29.120 0.965 4.293 1.00 0.00 H new ATOM 0 HD3 LYS A 122 30.464 1.435 5.315 1.00 0.00 H new ATOM 0 HE2 LYS A 122 31.783 -0.529 4.441 1.00 0.00 H new ATOM 0 HE3 LYS A 122 30.448 -0.930 3.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 32.201 0.372 2.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 30.693 1.151 2.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 31.882 1.667 3.352 1.00 0.00 H new ATOM 1795 N ILE A 123 25.803 -1.184 8.071 1.00 0.00 N ATOM 1796 CA ILE A 123 25.017 -1.209 9.295 1.00 0.00 C ATOM 1797 C ILE A 123 25.861 -1.894 10.366 1.00 0.00 C ATOM 1798 O ILE A 123 26.546 -2.879 10.076 1.00 0.00 O ATOM 1799 CB ILE A 123 23.646 -1.901 9.100 1.00 0.00 C ATOM 1800 CG1 ILE A 123 23.633 -3.425 8.845 1.00 0.00 C ATOM 1801 CG2 ILE A 123 22.794 -1.161 8.062 1.00 0.00 C ATOM 1802 CD1 ILE A 123 24.410 -3.957 7.636 1.00 0.00 C ATOM 0 H ILE A 123 26.282 -2.066 7.889 1.00 0.00 H new ATOM 0 HA ILE A 123 24.776 -0.191 9.602 1.00 0.00 H new ATOM 0 HB ILE A 123 23.201 -1.823 10.092 1.00 0.00 H new ATOM 0 HG12 ILE A 123 24.024 -3.916 9.736 1.00 0.00 H new ATOM 0 HG13 ILE A 123 22.594 -3.737 8.738 1.00 0.00 H new ATOM 0 HG21 ILE A 123 21.837 -1.670 7.947 1.00 0.00 H new ATOM 0 HG22 ILE A 123 22.622 -0.137 8.395 1.00 0.00 H new ATOM 0 HG23 ILE A 123 23.316 -1.148 7.105 1.00 0.00 H new ATOM 0 HD11 ILE A 123 24.309 -5.041 7.587 1.00 0.00 H new ATOM 0 HD12 ILE A 123 24.012 -3.513 6.724 1.00 0.00 H new ATOM 0 HD13 ILE A 123 25.463 -3.695 7.737 1.00 0.00 H new ATOM 2006 N GLU A 137 24.648 10.436 5.594 1.00 0.00 N ATOM 2007 CA GLU A 137 25.134 11.029 4.350 1.00 0.00 C ATOM 2008 C GLU A 137 25.009 10.064 3.165 1.00 0.00 C ATOM 2009 O GLU A 137 24.745 10.517 2.050 1.00 0.00 O ATOM 2010 CB GLU A 137 26.590 11.491 4.516 1.00 0.00 C ATOM 2011 CG GLU A 137 26.736 12.614 5.554 1.00 0.00 C ATOM 2012 CD GLU A 137 28.183 13.135 5.623 1.00 0.00 C ATOM 2013 OE1 GLU A 137 28.531 14.081 4.880 1.00 0.00 O ATOM 2014 OE2 GLU A 137 28.986 12.620 6.435 1.00 0.00 O ATOM 0 HA GLU A 137 24.507 11.893 4.131 1.00 0.00 H new ATOM 0 HB2 GLU A 137 27.205 10.642 4.815 1.00 0.00 H new ATOM 0 HB3 GLU A 137 26.970 11.837 3.555 1.00 0.00 H new ATOM 0 HG2 GLU A 137 26.065 13.434 5.301 1.00 0.00 H new ATOM 0 HG3 GLU A 137 26.434 12.246 6.534 1.00 0.00 H new ATOM 2021 N TRP A 138 25.140 8.748 3.386 1.00 0.00 N ATOM 2022 CA TRP A 138 24.904 7.756 2.344 1.00 0.00 C ATOM 2023 C TRP A 138 23.472 7.854 1.821 1.00 0.00 C ATOM 2024 O TRP A 138 23.271 7.921 0.609 1.00 0.00 O ATOM 2025 CB TRP A 138 25.138 6.334 2.866 1.00 0.00 C ATOM 2026 CG TRP A 138 26.450 5.691 2.538 1.00 0.00 C ATOM 2027 CD1 TRP A 138 26.793 5.207 1.323 1.00 0.00 C ATOM 2028 CD2 TRP A 138 27.558 5.347 3.424 1.00 0.00 C ATOM 2029 NE1 TRP A 138 28.026 4.594 1.393 1.00 0.00 N ATOM 2030 CE2 TRP A 138 28.549 4.652 2.667 1.00 0.00 C ATOM 2031 CE3 TRP A 138 27.813 5.530 4.799 1.00 0.00 C ATOM 2032 CZ2 TRP A 138 29.737 4.182 3.245 1.00 0.00 C ATOM 2033 CZ3 TRP A 138 28.998 5.056 5.392 1.00 0.00 C ATOM 2034 CH2 TRP A 138 29.962 4.385 4.616 1.00 0.00 C ATOM 0 H TRP A 138 25.410 8.351 4.286 1.00 0.00 H new ATOM 0 HA TRP A 138 25.608 7.963 1.538 1.00 0.00 H new ATOM 0 HB2 TRP A 138 25.032 6.351 3.951 1.00 0.00 H new ATOM 0 HB3 TRP A 138 24.343 5.697 2.478 1.00 0.00 H new ATOM 0 HD1 TRP A 138 26.191 5.288 0.430 1.00 0.00 H new ATOM 0 HE1 TRP A 138 28.493 4.153 0.601 1.00 0.00 H new ATOM 0 HE3 TRP A 138 27.085 6.044 5.409 1.00 0.00 H new ATOM 0 HZ2 TRP A 138 30.471 3.669 2.642 1.00 0.00 H new ATOM 0 HZ3 TRP A 138 29.169 5.208 6.448 1.00 0.00 H new ATOM 0 HH2 TRP A 138 30.872 4.027 5.074 1.00 0.00 H new ATOM 2045 N LEU A 139 22.487 7.853 2.726 1.00 0.00 N ATOM 2046 CA LEU A 139 21.079 7.903 2.374 1.00 0.00 C ATOM 2047 C LEU A 139 20.797 9.220 1.675 1.00 0.00 C ATOM 2048 O LEU A 139 20.261 9.202 0.575 1.00 0.00 O ATOM 2049 CB LEU A 139 20.208 7.787 3.636 1.00 0.00 C ATOM 2050 CG LEU A 139 20.134 6.392 4.285 1.00 0.00 C ATOM 2051 CD1 LEU A 139 19.142 6.442 5.454 1.00 0.00 C ATOM 2052 CD2 LEU A 139 19.704 5.300 3.298 1.00 0.00 C ATOM 0 H LEU A 139 22.655 7.817 3.731 1.00 0.00 H new ATOM 0 HA LEU A 139 20.840 7.070 1.712 1.00 0.00 H new ATOM 0 HB2 LEU A 139 20.585 8.491 4.378 1.00 0.00 H new ATOM 0 HB3 LEU A 139 19.195 8.102 3.384 1.00 0.00 H new ATOM 0 HG LEU A 139 21.135 6.134 4.630 1.00 0.00 H new ATOM 0 HD11 LEU A 139 19.081 5.459 5.922 1.00 0.00 H new ATOM 0 HD12 LEU A 139 19.481 7.173 6.188 1.00 0.00 H new ATOM 0 HD13 LEU A 139 18.158 6.729 5.084 1.00 0.00 H new ATOM 0 HD21 LEU A 139 19.669 4.339 3.811 1.00 0.00 H new ATOM 0 HD22 LEU A 139 18.716 5.536 2.902 1.00 0.00 H new ATOM 0 HD23 LEU A 139 20.420 5.248 2.478 1.00 0.00 H new ATOM 2064 N GLY A 140 21.186 10.343 2.280 1.00 0.00 N ATOM 2065 CA GLY A 140 20.977 11.672 1.715 1.00 0.00 C ATOM 2066 C GLY A 140 21.526 11.778 0.290 1.00 0.00 C ATOM 2067 O GLY A 140 20.818 12.232 -0.614 1.00 0.00 O ATOM 0 H GLY A 140 21.659 10.353 3.184 1.00 0.00 H new ATOM 0 HA2 GLY A 140 19.912 11.902 1.712 1.00 0.00 H new ATOM 0 HA3 GLY A 140 21.462 12.416 2.347 1.00 0.00 H new ATOM 2071 N SER A 141 22.759 11.310 0.072 1.00 0.00 N ATOM 2072 CA SER A 141 23.378 11.302 -1.243 1.00 0.00 C ATOM 2073 C SER A 141 22.554 10.423 -2.188 1.00 0.00 C ATOM 2074 O SER A 141 22.043 10.916 -3.193 1.00 0.00 O ATOM 2075 CB SER A 141 24.836 10.836 -1.114 1.00 0.00 C ATOM 2076 OG SER A 141 25.539 11.008 -2.332 1.00 0.00 O ATOM 0 H SER A 141 23.351 10.927 0.809 1.00 0.00 H new ATOM 0 HA SER A 141 23.395 12.305 -1.670 1.00 0.00 H new ATOM 0 HB2 SER A 141 25.332 11.398 -0.323 1.00 0.00 H new ATOM 0 HB3 SER A 141 24.860 9.786 -0.822 1.00 0.00 H new ATOM 0 HG SER A 141 26.464 10.705 -2.221 1.00 0.00 H new ATOM 2082 N TRP A 142 22.353 9.150 -1.848 1.00 0.00 N ATOM 2083 CA TRP A 142 21.679 8.184 -2.704 1.00 0.00 C ATOM 2084 C TRP A 142 20.266 8.645 -3.086 1.00 0.00 C ATOM 2085 O TRP A 142 19.884 8.576 -4.255 1.00 0.00 O ATOM 2086 CB TRP A 142 21.677 6.843 -1.974 1.00 0.00 C ATOM 2087 CG TRP A 142 20.928 5.747 -2.653 1.00 0.00 C ATOM 2088 CD1 TRP A 142 21.329 5.082 -3.755 1.00 0.00 C ATOM 2089 CD2 TRP A 142 19.640 5.182 -2.288 1.00 0.00 C ATOM 2090 NE1 TRP A 142 20.354 4.180 -4.135 1.00 0.00 N ATOM 2091 CE2 TRP A 142 19.309 4.166 -3.235 1.00 0.00 C ATOM 2092 CE3 TRP A 142 18.730 5.424 -1.237 1.00 0.00 C ATOM 2093 CZ2 TRP A 142 18.137 3.406 -3.130 1.00 0.00 C ATOM 2094 CZ3 TRP A 142 17.548 4.666 -1.129 1.00 0.00 C ATOM 2095 CH2 TRP A 142 17.257 3.656 -2.064 1.00 0.00 C ATOM 0 H TRP A 142 22.659 8.759 -0.957 1.00 0.00 H new ATOM 0 HA TRP A 142 22.211 8.085 -3.650 1.00 0.00 H new ATOM 0 HB2 TRP A 142 22.710 6.523 -1.835 1.00 0.00 H new ATOM 0 HB3 TRP A 142 21.252 6.990 -0.981 1.00 0.00 H new ATOM 0 HD1 TRP A 142 22.270 5.232 -4.264 1.00 0.00 H new ATOM 0 HE1 TRP A 142 20.401 3.600 -4.973 1.00 0.00 H new ATOM 0 HE3 TRP A 142 18.941 6.195 -0.511 1.00 0.00 H new ATOM 0 HZ2 TRP A 142 17.913 2.640 -3.857 1.00 0.00 H new ATOM 0 HZ3 TRP A 142 16.859 4.862 -0.321 1.00 0.00 H new ATOM 0 HH2 TRP A 142 16.355 3.071 -1.962 1.00 0.00 H new ATOM 2106 N VAL A 143 19.514 9.176 -2.123 1.00 0.00 N ATOM 2107 CA VAL A 143 18.195 9.751 -2.325 1.00 0.00 C ATOM 2108 C VAL A 143 18.276 10.905 -3.321 1.00 0.00 C ATOM 2109 O VAL A 143 17.577 10.876 -4.329 1.00 0.00 O ATOM 2110 CB VAL A 143 17.610 10.170 -0.960 1.00 0.00 C ATOM 2111 CG1 VAL A 143 16.440 11.151 -1.094 1.00 0.00 C ATOM 2112 CG2 VAL A 143 17.140 8.931 -0.187 1.00 0.00 C ATOM 0 H VAL A 143 19.821 9.217 -1.151 1.00 0.00 H new ATOM 0 HA VAL A 143 17.517 9.015 -2.757 1.00 0.00 H new ATOM 0 HB VAL A 143 18.408 10.678 -0.419 1.00 0.00 H new ATOM 0 HG11 VAL A 143 16.068 11.411 -0.103 1.00 0.00 H new ATOM 0 HG12 VAL A 143 16.778 12.053 -1.603 1.00 0.00 H new ATOM 0 HG13 VAL A 143 15.640 10.687 -1.671 1.00 0.00 H new ATOM 0 HG21 VAL A 143 16.729 9.237 0.775 1.00 0.00 H new ATOM 0 HG22 VAL A 143 16.372 8.413 -0.762 1.00 0.00 H new ATOM 0 HG23 VAL A 143 17.985 8.262 -0.024 1.00 0.00 H new ATOM 2122 N ASN A 144 19.110 11.924 -3.085 1.00 0.00 N ATOM 2123 CA ASN A 144 19.122 13.087 -3.975 1.00 0.00 C ATOM 2124 C ASN A 144 19.687 12.749 -5.367 1.00 0.00 C ATOM 2125 O ASN A 144 19.509 13.535 -6.297 1.00 0.00 O ATOM 2126 CB ASN A 144 19.779 14.320 -3.325 1.00 0.00 C ATOM 2127 CG ASN A 144 21.197 14.598 -3.807 1.00 0.00 C ATOM 2128 OD1 ASN A 144 21.485 15.646 -4.378 1.00 0.00 O ATOM 2129 ND2 ASN A 144 22.109 13.674 -3.583 1.00 0.00 N ATOM 0 H ASN A 144 19.768 11.968 -2.307 1.00 0.00 H new ATOM 0 HA ASN A 144 18.082 13.370 -4.141 1.00 0.00 H new ATOM 0 HB2 ASN A 144 19.161 15.195 -3.525 1.00 0.00 H new ATOM 0 HB3 ASN A 144 19.795 14.182 -2.244 1.00 0.00 H new ATOM 0 HD21 ASN A 144 23.072 13.824 -3.885 1.00 0.00 H new ATOM 0 HD22 ASN A 144 21.852 12.809 -3.107 1.00 0.00 H new ATOM 2136 N LEU A 145 20.340 11.589 -5.522 1.00 0.00 N ATOM 2137 CA LEU A 145 20.744 11.044 -6.816 1.00 0.00 C ATOM 2138 C LEU A 145 19.565 10.360 -7.510 1.00 0.00 C ATOM 2139 O LEU A 145 19.351 10.603 -8.698 1.00 0.00 O ATOM 2140 CB LEU A 145 21.909 10.044 -6.651 1.00 0.00 C ATOM 2141 CG LEU A 145 23.291 10.638 -6.984 1.00 0.00 C ATOM 2142 CD1 LEU A 145 23.666 11.827 -6.093 1.00 0.00 C ATOM 2143 CD2 LEU A 145 24.361 9.549 -6.845 1.00 0.00 C ATOM 0 H LEU A 145 20.605 10.996 -4.735 1.00 0.00 H new ATOM 0 HA LEU A 145 21.081 11.875 -7.436 1.00 0.00 H new ATOM 0 HB2 LEU A 145 21.919 9.679 -5.624 1.00 0.00 H new ATOM 0 HB3 LEU A 145 21.730 9.182 -7.294 1.00 0.00 H new ATOM 0 HG LEU A 145 23.238 11.007 -8.008 1.00 0.00 H new ATOM 0 HD11 LEU A 145 24.650 12.199 -6.378 1.00 0.00 H new ATOM 0 HD12 LEU A 145 22.928 12.620 -6.215 1.00 0.00 H new ATOM 0 HD13 LEU A 145 23.687 11.508 -5.051 1.00 0.00 H new ATOM 0 HD21 LEU A 145 25.339 9.968 -7.080 1.00 0.00 H new ATOM 0 HD22 LEU A 145 24.365 9.171 -5.823 1.00 0.00 H new ATOM 0 HD23 LEU A 145 24.141 8.733 -7.533 1.00 0.00 H new ATOM 2155 N LEU A 146 18.816 9.494 -6.812 1.00 0.00 N ATOM 2156 CA LEU A 146 17.717 8.752 -7.415 1.00 0.00 C ATOM 2157 C LEU A 146 16.517 9.648 -7.725 1.00 0.00 C ATOM 2158 O LEU A 146 15.814 9.413 -8.709 1.00 0.00 O ATOM 2159 CB LEU A 146 17.352 7.541 -6.541 1.00 0.00 C ATOM 2160 CG LEU A 146 16.450 7.737 -5.300 1.00 0.00 C ATOM 2161 CD1 LEU A 146 14.950 7.661 -5.623 1.00 0.00 C ATOM 2162 CD2 LEU A 146 16.754 6.653 -4.259 1.00 0.00 C ATOM 0 H LEU A 146 18.959 9.294 -5.822 1.00 0.00 H new ATOM 0 HA LEU A 146 18.049 8.371 -8.381 1.00 0.00 H new ATOM 0 HB2 LEU A 146 16.865 6.809 -7.185 1.00 0.00 H new ATOM 0 HB3 LEU A 146 18.285 7.093 -6.198 1.00 0.00 H new ATOM 0 HG LEU A 146 16.670 8.736 -4.923 1.00 0.00 H new ATOM 0 HD11 LEU A 146 14.373 7.806 -4.710 1.00 0.00 H new ATOM 0 HD12 LEU A 146 14.693 8.439 -6.342 1.00 0.00 H new ATOM 0 HD13 LEU A 146 14.718 6.684 -6.047 1.00 0.00 H new ATOM 0 HD21 LEU A 146 16.116 6.796 -3.387 1.00 0.00 H new ATOM 0 HD22 LEU A 146 16.563 5.670 -4.691 1.00 0.00 H new ATOM 0 HD23 LEU A 146 17.799 6.721 -3.958 1.00 0.00 H new ATOM 2174 N LYS A 147 16.291 10.661 -6.890 1.00 0.00 N ATOM 2175 CA LYS A 147 15.288 11.695 -7.085 1.00 0.00 C ATOM 2176 C LYS A 147 15.541 12.406 -8.411 1.00 0.00 C ATOM 2177 O LYS A 147 16.678 12.859 -8.657 1.00 0.00 O ATOM 2178 CB LYS A 147 15.303 12.674 -5.899 1.00 0.00 C ATOM 2179 CG LYS A 147 14.481 12.144 -4.712 1.00 0.00 C ATOM 2180 CD LYS A 147 14.385 13.175 -3.577 1.00 0.00 C ATOM 2181 CE LYS A 147 13.495 12.649 -2.447 1.00 0.00 C ATOM 2182 NZ LYS A 147 13.380 13.592 -1.307 1.00 0.00 N ATOM 2183 OXT LYS A 147 14.587 12.533 -9.207 1.00 0.00 O ATOM 0 H LYS A 147 16.823 10.784 -6.029 1.00 0.00 H new ATOM 0 HA LYS A 147 14.295 11.246 -7.127 1.00 0.00 H new ATOM 0 HB2 LYS A 147 16.332 12.845 -5.582 1.00 0.00 H new ATOM 0 HB3 LYS A 147 14.903 13.637 -6.217 1.00 0.00 H new ATOM 0 HG2 LYS A 147 13.479 11.884 -5.052 1.00 0.00 H new ATOM 0 HG3 LYS A 147 14.937 11.229 -4.334 1.00 0.00 H new ATOM 0 HD2 LYS A 147 15.381 13.394 -3.191 1.00 0.00 H new ATOM 0 HD3 LYS A 147 13.979 14.111 -3.961 1.00 0.00 H new ATOM 0 HE2 LYS A 147 12.500 12.444 -2.842 1.00 0.00 H new ATOM 0 HE3 LYS A 147 13.897 11.702 -2.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 13.052 13.079 -0.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 14.309 14.018 -1.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 12.698 14.341 -1.543 1.00 0.00 H new