USER MOD reduce.3.24.130724 H: found=0, std=0, add=684, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 684 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 1 MET N :NH3+ -134:sc= -1.31! (180deg=-1.1) USER MOD Set 1.2: A 85 SER OG : rot -110:sc= -0.546 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot -36:sc= -0.506! USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= -0.894 USER MOD Single : A 16 CYS SG : rot -35:sc= -2.52 USER MOD Single : A 22 SER OG : rot 180:sc= -0.732 USER MOD Single : A 39 TYR OH : rot 180:sc= 0.0563 USER MOD Single : A 41 SER OG : rot 72:sc= 1.23 USER MOD Single : A 46 ASN :FLIP amide:sc= -1.55 F(o=-3.3!,f=-1.6) USER MOD Single : A 47 THR OG1 : rot 69:sc=-0.00865 USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=-0.099) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= -0.0178 USER MOD Single : A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 THR OG1 : rot 83:sc= 1.16 USER MOD Single : A 78 ASN : amide:sc= -8.44! C(o=-8.4!,f=-11!) USER MOD Single : A 80 SER OG : rot 110:sc= -4.25! USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 61.058 12.061 4.684 1.00 0.00 N ATOM 2 CA MET A 1 62.066 13.150 4.547 1.00 0.00 C ATOM 3 C MET A 1 63.389 12.561 4.067 1.00 0.00 C ATOM 4 O MET A 1 63.878 11.571 4.611 1.00 0.00 O ATOM 5 CB MET A 1 62.271 13.829 5.903 1.00 0.00 C ATOM 6 CG MET A 1 62.621 12.776 6.956 1.00 0.00 C ATOM 7 SD MET A 1 62.733 13.562 8.582 1.00 0.00 S ATOM 8 CE MET A 1 63.699 12.265 9.394 1.00 0.00 C ATOM 0 H1 MET A 1 60.161 12.362 4.252 1.00 0.00 H new ATOM 0 H2 MET A 1 61.404 11.205 4.204 1.00 0.00 H new ATOM 0 H3 MET A 1 60.904 11.855 5.692 1.00 0.00 H new ATOM 0 HA MET A 1 61.712 13.884 3.823 1.00 0.00 H new ATOM 0 HB2 MET A 1 63.069 14.568 5.834 1.00 0.00 H new ATOM 0 HB3 MET A 1 61.366 14.363 6.194 1.00 0.00 H new ATOM 0 HG2 MET A 1 61.862 11.994 6.970 1.00 0.00 H new ATOM 0 HG3 MET A 1 63.568 12.297 6.706 1.00 0.00 H new ATOM 0 HE1 MET A 1 63.888 12.547 10.430 1.00 0.00 H new ATOM 0 HE2 MET A 1 63.143 11.328 9.369 1.00 0.00 H new ATOM 0 HE3 MET A 1 64.648 12.138 8.873 1.00 0.00 H new ATOM 20 N THR A 2 63.963 13.185 3.040 1.00 0.00 N ATOM 21 CA THR A 2 65.235 12.721 2.482 1.00 0.00 C ATOM 22 C THR A 2 65.081 11.325 1.888 1.00 0.00 C ATOM 23 O THR A 2 64.622 10.396 2.553 1.00 0.00 O ATOM 24 CB THR A 2 66.321 12.685 3.562 1.00 0.00 C ATOM 25 OG1 THR A 2 66.162 13.800 4.430 1.00 0.00 O ATOM 26 CG2 THR A 2 67.701 12.742 2.903 1.00 0.00 C ATOM 0 H THR A 2 63.572 14.007 2.579 1.00 0.00 H new ATOM 0 HA THR A 2 65.528 13.420 1.699 1.00 0.00 H new ATOM 0 HB THR A 2 66.232 11.762 4.136 1.00 0.00 H new ATOM 0 HG1 THR A 2 66.855 13.777 5.122 1.00 0.00 H new ATOM 0 HG21 THR A 2 68.473 12.716 3.672 1.00 0.00 H new ATOM 0 HG22 THR A 2 67.822 11.887 2.238 1.00 0.00 H new ATOM 0 HG23 THR A 2 67.792 13.664 2.328 1.00 0.00 H new ATOM 34 N LEU A 3 65.472 11.188 0.624 1.00 0.00 N ATOM 35 CA LEU A 3 65.377 9.900 -0.056 1.00 0.00 C ATOM 36 C LEU A 3 66.663 9.095 0.148 1.00 0.00 C ATOM 37 O LEU A 3 67.466 9.404 1.030 1.00 0.00 O ATOM 38 CB LEU A 3 65.108 10.103 -1.552 1.00 0.00 C ATOM 39 CG LEU A 3 66.283 10.634 -2.378 1.00 0.00 C ATOM 40 CD1 LEU A 3 66.108 10.211 -3.839 1.00 0.00 C ATOM 41 CD2 LEU A 3 66.315 12.161 -2.292 1.00 0.00 C ATOM 0 H LEU A 3 65.854 11.944 0.055 1.00 0.00 H new ATOM 0 HA LEU A 3 64.545 9.342 0.373 1.00 0.00 H new ATOM 0 HB2 LEU A 3 64.792 9.150 -1.977 1.00 0.00 H new ATOM 0 HB3 LEU A 3 64.272 10.794 -1.660 1.00 0.00 H new ATOM 0 HG LEU A 3 67.216 10.227 -1.989 1.00 0.00 H new ATOM 0 HD11 LEU A 3 66.943 10.588 -4.429 1.00 0.00 H new ATOM 0 HD12 LEU A 3 66.081 9.123 -3.902 1.00 0.00 H new ATOM 0 HD13 LEU A 3 65.175 10.621 -4.227 1.00 0.00 H new ATOM 0 HD21 LEU A 3 67.151 12.541 -2.879 1.00 0.00 H new ATOM 0 HD22 LEU A 3 65.382 12.567 -2.683 1.00 0.00 H new ATOM 0 HD23 LEU A 3 66.435 12.464 -1.252 1.00 0.00 H new ATOM 53 N LEU A 4 66.848 8.057 -0.664 1.00 0.00 N ATOM 54 CA LEU A 4 68.040 7.217 -0.544 1.00 0.00 C ATOM 55 C LEU A 4 68.701 7.035 -1.909 1.00 0.00 C ATOM 56 O LEU A 4 68.031 7.054 -2.941 1.00 0.00 O ATOM 57 CB LEU A 4 67.658 5.848 0.027 1.00 0.00 C ATOM 58 CG LEU A 4 68.836 4.921 0.372 1.00 0.00 C ATOM 59 CD1 LEU A 4 69.006 4.838 1.892 1.00 0.00 C ATOM 60 CD2 LEU A 4 68.566 3.518 -0.181 1.00 0.00 C ATOM 0 H LEU A 4 66.200 7.779 -1.401 1.00 0.00 H new ATOM 0 HA LEU A 4 68.744 7.707 0.129 1.00 0.00 H new ATOM 0 HB2 LEU A 4 67.064 6.003 0.928 1.00 0.00 H new ATOM 0 HB3 LEU A 4 67.017 5.339 -0.693 1.00 0.00 H new ATOM 0 HG LEU A 4 69.746 5.323 -0.074 1.00 0.00 H new ATOM 0 HD11 LEU A 4 69.842 4.180 2.129 1.00 0.00 H new ATOM 0 HD12 LEU A 4 69.203 5.833 2.291 1.00 0.00 H new ATOM 0 HD13 LEU A 4 68.094 4.442 2.339 1.00 0.00 H new ATOM 0 HD21 LEU A 4 69.402 2.863 0.065 1.00 0.00 H new ATOM 0 HD22 LEU A 4 67.652 3.122 0.262 1.00 0.00 H new ATOM 0 HD23 LEU A 4 68.451 3.570 -1.264 1.00 0.00 H new ATOM 72 N THR A 5 70.021 6.862 -1.910 1.00 0.00 N ATOM 73 CA THR A 5 70.748 6.682 -3.165 1.00 0.00 C ATOM 74 C THR A 5 71.529 5.373 -3.153 1.00 0.00 C ATOM 75 O THR A 5 71.707 4.747 -2.109 1.00 0.00 O ATOM 76 CB THR A 5 71.722 7.841 -3.392 1.00 0.00 C ATOM 77 OG1 THR A 5 72.250 8.266 -2.144 1.00 0.00 O ATOM 78 CG2 THR A 5 70.986 9.003 -4.060 1.00 0.00 C ATOM 0 H THR A 5 70.601 6.843 -1.071 1.00 0.00 H new ATOM 0 HA THR A 5 70.016 6.658 -3.972 1.00 0.00 H new ATOM 0 HB THR A 5 72.537 7.511 -4.037 1.00 0.00 H new ATOM 0 HG1 THR A 5 71.558 8.194 -1.454 1.00 0.00 H new ATOM 0 HG21 THR A 5 71.680 9.828 -4.222 1.00 0.00 H new ATOM 0 HG22 THR A 5 70.582 8.675 -5.018 1.00 0.00 H new ATOM 0 HG23 THR A 5 70.171 9.335 -3.417 1.00 0.00 H new ATOM 86 N LEU A 6 71.998 4.967 -4.332 1.00 0.00 N ATOM 87 CA LEU A 6 72.767 3.730 -4.450 1.00 0.00 C ATOM 88 C LEU A 6 74.047 3.829 -3.636 1.00 0.00 C ATOM 89 O LEU A 6 74.486 2.860 -3.017 1.00 0.00 O ATOM 90 CB LEU A 6 73.123 3.454 -5.912 1.00 0.00 C ATOM 91 CG LEU A 6 74.032 4.500 -6.568 1.00 0.00 C ATOM 92 CD1 LEU A 6 75.495 4.079 -6.412 1.00 0.00 C ATOM 93 CD2 LEU A 6 73.691 4.612 -8.056 1.00 0.00 C ATOM 0 H LEU A 6 71.861 5.470 -5.209 1.00 0.00 H new ATOM 0 HA LEU A 6 72.154 2.913 -4.071 1.00 0.00 H new ATOM 0 HB2 LEU A 6 73.611 2.481 -5.974 1.00 0.00 H new ATOM 0 HB3 LEU A 6 72.200 3.385 -6.488 1.00 0.00 H new ATOM 0 HG LEU A 6 73.879 5.465 -6.085 1.00 0.00 H new ATOM 0 HD11 LEU A 6 76.140 4.824 -6.879 1.00 0.00 H new ATOM 0 HD12 LEU A 6 75.740 4.000 -5.353 1.00 0.00 H new ATOM 0 HD13 LEU A 6 75.649 3.113 -6.893 1.00 0.00 H new ATOM 0 HD21 LEU A 6 74.337 5.356 -8.522 1.00 0.00 H new ATOM 0 HD22 LEU A 6 73.843 3.646 -8.538 1.00 0.00 H new ATOM 0 HD23 LEU A 6 72.650 4.914 -8.169 1.00 0.00 H new ATOM 105 N SER A 7 74.632 5.019 -3.635 1.00 0.00 N ATOM 106 CA SER A 7 75.862 5.255 -2.884 1.00 0.00 C ATOM 107 C SER A 7 75.615 5.040 -1.394 1.00 0.00 C ATOM 108 O SER A 7 76.497 4.595 -0.659 1.00 0.00 O ATOM 109 CB SER A 7 76.362 6.684 -3.114 1.00 0.00 C ATOM 110 OG SER A 7 77.771 6.663 -3.298 1.00 0.00 O ATOM 0 H SER A 7 74.280 5.832 -4.141 1.00 0.00 H new ATOM 0 HA SER A 7 76.618 4.551 -3.232 1.00 0.00 H new ATOM 0 HB2 SER A 7 75.876 7.116 -3.989 1.00 0.00 H new ATOM 0 HB3 SER A 7 76.104 7.314 -2.263 1.00 0.00 H new ATOM 0 HG SER A 7 78.095 7.576 -3.447 1.00 0.00 H new ATOM 116 N ASP A 8 74.399 5.362 -0.960 1.00 0.00 N ATOM 117 CA ASP A 8 74.030 5.203 0.440 1.00 0.00 C ATOM 118 C ASP A 8 73.916 3.726 0.798 1.00 0.00 C ATOM 119 O ASP A 8 74.557 3.246 1.728 1.00 0.00 O ATOM 120 CB ASP A 8 72.686 5.882 0.710 1.00 0.00 C ATOM 121 CG ASP A 8 72.861 7.397 0.713 1.00 0.00 C ATOM 122 OD1 ASP A 8 73.919 7.853 1.116 1.00 0.00 O ATOM 123 OD2 ASP A 8 71.931 8.079 0.313 1.00 0.00 O ATOM 0 H ASP A 8 73.658 5.732 -1.555 1.00 0.00 H new ATOM 0 HA ASP A 8 74.807 5.665 1.050 1.00 0.00 H new ATOM 0 HB2 ASP A 8 71.963 5.592 -0.052 1.00 0.00 H new ATOM 0 HB3 ASP A 8 72.288 5.551 1.669 1.00 0.00 H new ATOM 128 N LEU A 9 73.083 3.010 0.054 1.00 0.00 N ATOM 129 CA LEU A 9 72.883 1.587 0.308 1.00 0.00 C ATOM 130 C LEU A 9 74.180 0.803 0.113 1.00 0.00 C ATOM 131 O LEU A 9 74.447 -0.161 0.828 1.00 0.00 O ATOM 132 CB LEU A 9 71.819 1.022 -0.633 1.00 0.00 C ATOM 133 CG LEU A 9 71.508 -0.465 -0.443 1.00 0.00 C ATOM 134 CD1 LEU A 9 70.374 -0.625 0.572 1.00 0.00 C ATOM 135 CD2 LEU A 9 71.081 -1.073 -1.781 1.00 0.00 C ATOM 0 H LEU A 9 72.539 3.385 -0.723 1.00 0.00 H new ATOM 0 HA LEU A 9 72.556 1.483 1.343 1.00 0.00 H new ATOM 0 HB2 LEU A 9 70.898 1.590 -0.498 1.00 0.00 H new ATOM 0 HB3 LEU A 9 72.144 1.181 -1.661 1.00 0.00 H new ATOM 0 HG LEU A 9 72.398 -0.977 -0.078 1.00 0.00 H new ATOM 0 HD11 LEU A 9 70.153 -1.684 0.707 1.00 0.00 H new ATOM 0 HD12 LEU A 9 70.676 -0.193 1.526 1.00 0.00 H new ATOM 0 HD13 LEU A 9 69.484 -0.112 0.207 1.00 0.00 H new ATOM 0 HD21 LEU A 9 70.860 -2.132 -1.645 1.00 0.00 H new ATOM 0 HD22 LEU A 9 70.191 -0.560 -2.146 1.00 0.00 H new ATOM 0 HD23 LEU A 9 71.888 -0.961 -2.506 1.00 0.00 H new ATOM 147 N LEU A 10 74.971 1.214 -0.874 1.00 0.00 N ATOM 148 CA LEU A 10 76.229 0.526 -1.173 1.00 0.00 C ATOM 149 C LEU A 10 77.224 0.613 -0.014 1.00 0.00 C ATOM 150 O LEU A 10 77.712 -0.406 0.473 1.00 0.00 O ATOM 151 CB LEU A 10 76.871 1.113 -2.438 1.00 0.00 C ATOM 152 CG LEU A 10 76.549 0.364 -3.735 1.00 0.00 C ATOM 153 CD1 LEU A 10 75.034 0.329 -3.950 1.00 0.00 C ATOM 154 CD2 LEU A 10 77.213 1.078 -4.913 1.00 0.00 C ATOM 0 H LEU A 10 74.769 2.012 -1.477 1.00 0.00 H new ATOM 0 HA LEU A 10 75.987 -0.525 -1.332 1.00 0.00 H new ATOM 0 HB2 LEU A 10 76.548 2.148 -2.544 1.00 0.00 H new ATOM 0 HB3 LEU A 10 77.953 1.129 -2.304 1.00 0.00 H new ATOM 0 HG LEU A 10 76.927 -0.656 -3.665 1.00 0.00 H new ATOM 0 HD11 LEU A 10 74.810 -0.205 -4.874 1.00 0.00 H new ATOM 0 HD12 LEU A 10 74.559 -0.181 -3.112 1.00 0.00 H new ATOM 0 HD13 LEU A 10 74.653 1.348 -4.018 1.00 0.00 H new ATOM 0 HD21 LEU A 10 76.985 0.546 -5.837 1.00 0.00 H new ATOM 0 HD22 LEU A 10 76.836 2.099 -4.979 1.00 0.00 H new ATOM 0 HD23 LEU A 10 78.293 1.099 -4.764 1.00 0.00 H new ATOM 166 N THR A 11 77.540 1.835 0.405 1.00 0.00 N ATOM 167 CA THR A 11 78.506 2.031 1.493 1.00 0.00 C ATOM 168 C THR A 11 78.080 1.279 2.751 1.00 0.00 C ATOM 169 O THR A 11 78.878 0.589 3.376 1.00 0.00 O ATOM 170 CB THR A 11 78.693 3.536 1.789 1.00 0.00 C ATOM 171 OG1 THR A 11 79.926 3.732 2.465 1.00 0.00 O ATOM 172 CG2 THR A 11 77.553 4.100 2.650 1.00 0.00 C ATOM 0 H THR A 11 77.151 2.695 0.018 1.00 0.00 H new ATOM 0 HA THR A 11 79.464 1.623 1.171 1.00 0.00 H new ATOM 0 HB THR A 11 78.687 4.065 0.836 1.00 0.00 H new ATOM 0 HG1 THR A 11 80.048 4.686 2.653 1.00 0.00 H new ATOM 0 HG21 THR A 11 77.726 5.161 2.833 1.00 0.00 H new ATOM 0 HG22 THR A 11 76.605 3.972 2.128 1.00 0.00 H new ATOM 0 HG23 THR A 11 77.518 3.569 3.601 1.00 0.00 H new ATOM 180 N LEU A 12 76.809 1.420 3.105 1.00 0.00 N ATOM 181 CA LEU A 12 76.277 0.740 4.290 1.00 0.00 C ATOM 182 C LEU A 12 76.481 -0.758 4.159 1.00 0.00 C ATOM 183 O LEU A 12 76.994 -1.418 5.062 1.00 0.00 O ATOM 184 CB LEU A 12 74.788 1.024 4.454 1.00 0.00 C ATOM 185 CG LEU A 12 74.426 2.502 4.490 1.00 0.00 C ATOM 186 CD1 LEU A 12 72.990 2.694 4.001 1.00 0.00 C ATOM 187 CD2 LEU A 12 74.555 3.010 5.922 1.00 0.00 C ATOM 0 H LEU A 12 76.131 1.990 2.599 1.00 0.00 H new ATOM 0 HA LEU A 12 76.809 1.114 5.164 1.00 0.00 H new ATOM 0 HB2 LEU A 12 74.249 0.551 3.633 1.00 0.00 H new ATOM 0 HB3 LEU A 12 74.441 0.556 5.375 1.00 0.00 H new ATOM 0 HG LEU A 12 75.099 3.061 3.840 1.00 0.00 H new ATOM 0 HD11 LEU A 12 72.735 3.753 4.028 1.00 0.00 H new ATOM 0 HD12 LEU A 12 72.901 2.326 2.979 1.00 0.00 H new ATOM 0 HD13 LEU A 12 72.309 2.140 4.647 1.00 0.00 H new ATOM 0 HD21 LEU A 12 74.297 4.069 5.957 1.00 0.00 H new ATOM 0 HD22 LEU A 12 73.879 2.450 6.569 1.00 0.00 H new ATOM 0 HD23 LEU A 12 75.581 2.875 6.265 1.00 0.00 H new ATOM 199 N LEU A 13 76.089 -1.280 3.004 1.00 0.00 N ATOM 200 CA LEU A 13 76.249 -2.708 2.731 1.00 0.00 C ATOM 201 C LEU A 13 77.726 -3.068 2.809 1.00 0.00 C ATOM 202 O LEU A 13 78.101 -4.118 3.331 1.00 0.00 O ATOM 203 CB LEU A 13 75.696 -3.070 1.346 1.00 0.00 C ATOM 204 CG LEU A 13 74.474 -3.991 1.363 1.00 0.00 C ATOM 205 CD1 LEU A 13 74.008 -4.255 -0.070 1.00 0.00 C ATOM 206 CD2 LEU A 13 74.846 -5.319 2.030 1.00 0.00 C ATOM 0 H LEU A 13 75.662 -0.746 2.247 1.00 0.00 H new ATOM 0 HA LEU A 13 75.688 -3.273 3.476 1.00 0.00 H new ATOM 0 HB2 LEU A 13 75.433 -2.150 0.824 1.00 0.00 H new ATOM 0 HB3 LEU A 13 76.487 -3.549 0.769 1.00 0.00 H new ATOM 0 HG LEU A 13 73.670 -3.513 1.922 1.00 0.00 H new ATOM 0 HD11 LEU A 13 73.138 -4.911 -0.055 1.00 0.00 H new ATOM 0 HD12 LEU A 13 73.742 -3.311 -0.546 1.00 0.00 H new ATOM 0 HD13 LEU A 13 74.811 -4.731 -0.632 1.00 0.00 H new ATOM 0 HD21 LEU A 13 73.976 -5.976 2.043 1.00 0.00 H new ATOM 0 HD22 LEU A 13 75.652 -5.794 1.470 1.00 0.00 H new ATOM 0 HD23 LEU A 13 75.175 -5.133 3.052 1.00 0.00 H new ATOM 218 N ARG A 14 78.560 -2.166 2.303 1.00 0.00 N ATOM 219 CA ARG A 14 79.993 -2.381 2.342 1.00 0.00 C ATOM 220 C ARG A 14 80.473 -2.349 3.790 1.00 0.00 C ATOM 221 O ARG A 14 81.319 -3.143 4.200 1.00 0.00 O ATOM 222 CB ARG A 14 80.722 -1.300 1.545 1.00 0.00 C ATOM 223 CG ARG A 14 82.213 -1.645 1.463 1.00 0.00 C ATOM 224 CD ARG A 14 82.585 -2.067 0.035 1.00 0.00 C ATOM 225 NE ARG A 14 82.838 -3.510 -0.033 1.00 0.00 N ATOM 226 CZ ARG A 14 81.854 -4.406 -0.197 1.00 0.00 C ATOM 227 NH1 ARG A 14 80.599 -4.036 -0.285 1.00 0.00 N ATOM 228 NH2 ARG A 14 82.150 -5.675 -0.266 1.00 0.00 N ATOM 0 H ARG A 14 78.269 -1.291 1.867 1.00 0.00 H new ATOM 0 HA ARG A 14 80.211 -3.352 1.898 1.00 0.00 H new ATOM 0 HB2 ARG A 14 80.299 -1.224 0.543 1.00 0.00 H new ATOM 0 HB3 ARG A 14 80.588 -0.329 2.022 1.00 0.00 H new ATOM 0 HG2 ARG A 14 82.810 -0.783 1.762 1.00 0.00 H new ATOM 0 HG3 ARG A 14 82.446 -2.450 2.160 1.00 0.00 H new ATOM 0 HD2 ARG A 14 81.779 -1.802 -0.649 1.00 0.00 H new ATOM 0 HD3 ARG A 14 83.471 -1.522 -0.291 1.00 0.00 H new ATOM 0 HE ARG A 14 83.798 -3.844 0.047 1.00 0.00 H new ATOM 0 HH11 ARG A 14 80.354 -3.048 -0.229 1.00 0.00 H new ATOM 0 HH12 ARG A 14 79.868 -4.737 -0.410 1.00 0.00 H new ATOM 0 HH21 ARG A 14 83.122 -5.977 -0.195 1.00 0.00 H new ATOM 0 HH22 ARG A 14 81.410 -6.365 -0.391 1.00 0.00 H new ATOM 242 N GLU A 15 79.906 -1.421 4.565 1.00 0.00 N ATOM 243 CA GLU A 15 80.263 -1.287 5.976 1.00 0.00 C ATOM 244 C GLU A 15 79.968 -2.589 6.712 1.00 0.00 C ATOM 245 O GLU A 15 80.806 -3.113 7.445 1.00 0.00 O ATOM 246 CB GLU A 15 79.463 -0.151 6.622 1.00 0.00 C ATOM 247 CG GLU A 15 79.936 0.068 8.069 1.00 0.00 C ATOM 248 CD GLU A 15 80.617 1.429 8.193 1.00 0.00 C ATOM 249 OE1 GLU A 15 81.272 1.830 7.245 1.00 0.00 O ATOM 250 OE2 GLU A 15 80.474 2.049 9.234 1.00 0.00 O ATOM 0 H GLU A 15 79.203 -0.757 4.241 1.00 0.00 H new ATOM 0 HA GLU A 15 81.327 -1.060 6.044 1.00 0.00 H new ATOM 0 HB2 GLU A 15 79.589 0.766 6.047 1.00 0.00 H new ATOM 0 HB3 GLU A 15 78.400 -0.391 6.611 1.00 0.00 H new ATOM 0 HG2 GLU A 15 79.087 0.013 8.751 1.00 0.00 H new ATOM 0 HG3 GLU A 15 80.629 -0.723 8.358 1.00 0.00 H new ATOM 257 N CYS A 16 78.767 -3.111 6.486 1.00 0.00 N ATOM 258 CA CYS A 16 78.360 -4.368 7.109 1.00 0.00 C ATOM 259 C CYS A 16 79.272 -5.489 6.638 1.00 0.00 C ATOM 260 O CYS A 16 79.664 -6.366 7.408 1.00 0.00 O ATOM 261 CB CYS A 16 76.927 -4.708 6.724 1.00 0.00 C ATOM 262 SG CYS A 16 76.215 -5.775 7.996 1.00 0.00 S ATOM 0 H CYS A 16 78.063 -2.688 5.881 1.00 0.00 H new ATOM 0 HA CYS A 16 78.429 -4.258 8.191 1.00 0.00 H new ATOM 0 HB2 CYS A 16 76.338 -3.797 6.624 1.00 0.00 H new ATOM 0 HB3 CYS A 16 76.906 -5.210 5.756 1.00 0.00 H new ATOM 0 HG CYS A 16 77.132 -6.573 8.457 1.00 0.00 H new ATOM 268 N ALA A 17 79.611 -5.437 5.352 1.00 0.00 N ATOM 269 CA ALA A 17 80.493 -6.440 4.750 1.00 0.00 C ATOM 270 C ALA A 17 81.794 -6.568 5.542 1.00 0.00 C ATOM 271 O ALA A 17 82.403 -7.636 5.595 1.00 0.00 O ATOM 272 CB ALA A 17 80.831 -6.058 3.309 1.00 0.00 C ATOM 0 H ALA A 17 79.291 -4.715 4.707 1.00 0.00 H new ATOM 0 HA ALA A 17 79.966 -7.394 4.765 1.00 0.00 H new ATOM 0 HB1 ALA A 17 81.487 -6.814 2.877 1.00 0.00 H new ATOM 0 HB2 ALA A 17 79.913 -5.996 2.724 1.00 0.00 H new ATOM 0 HB3 ALA A 17 81.334 -5.091 3.297 1.00 0.00 H new ATOM 278 N GLY A 18 82.210 -5.465 6.162 1.00 0.00 N ATOM 279 CA GLY A 18 83.439 -5.472 6.954 1.00 0.00 C ATOM 280 C GLY A 18 84.342 -4.296 6.591 1.00 0.00 C ATOM 281 O GLY A 18 84.702 -3.487 7.446 1.00 0.00 O ATOM 0 H GLY A 18 81.724 -4.569 6.133 1.00 0.00 H new ATOM 0 HA2 GLY A 18 83.191 -5.428 8.014 1.00 0.00 H new ATOM 0 HA3 GLY A 18 83.974 -6.408 6.790 1.00 0.00 H new ATOM 285 N GLU A 19 84.710 -4.213 5.314 1.00 0.00 N ATOM 286 CA GLU A 19 85.581 -3.134 4.849 1.00 0.00 C ATOM 287 C GLU A 19 84.929 -1.776 5.090 1.00 0.00 C ATOM 288 O GLU A 19 83.826 -1.687 5.631 1.00 0.00 O ATOM 289 CB GLU A 19 85.896 -3.286 3.354 1.00 0.00 C ATOM 290 CG GLU A 19 84.610 -3.583 2.567 1.00 0.00 C ATOM 291 CD GLU A 19 84.636 -5.019 2.050 1.00 0.00 C ATOM 292 OE1 GLU A 19 85.706 -5.476 1.682 1.00 0.00 O ATOM 293 OE2 GLU A 19 83.586 -5.640 2.031 1.00 0.00 O ATOM 0 H GLU A 19 84.423 -4.871 4.590 1.00 0.00 H new ATOM 0 HA GLU A 19 86.511 -3.195 5.415 1.00 0.00 H new ATOM 0 HB2 GLU A 19 86.358 -2.373 2.978 1.00 0.00 H new ATOM 0 HB3 GLU A 19 86.615 -4.092 3.207 1.00 0.00 H new ATOM 0 HG2 GLU A 19 83.740 -3.433 3.206 1.00 0.00 H new ATOM 0 HG3 GLU A 19 84.516 -2.889 1.732 1.00 0.00 H new ATOM 300 N GLU A 20 85.628 -0.719 4.690 1.00 0.00 N ATOM 301 CA GLU A 20 85.116 0.636 4.876 1.00 0.00 C ATOM 302 C GLU A 20 85.248 1.454 3.591 1.00 0.00 C ATOM 303 O GLU A 20 85.583 2.639 3.622 1.00 0.00 O ATOM 304 CB GLU A 20 85.878 1.341 6.002 1.00 0.00 C ATOM 305 CG GLU A 20 85.185 2.662 6.338 1.00 0.00 C ATOM 306 CD GLU A 20 85.396 2.987 7.813 1.00 0.00 C ATOM 307 OE1 GLU A 20 85.336 2.070 8.615 1.00 0.00 O ATOM 308 OE2 GLU A 20 85.615 4.147 8.118 1.00 0.00 O ATOM 0 H GLU A 20 86.542 -0.772 4.239 1.00 0.00 H new ATOM 0 HA GLU A 20 84.061 0.560 5.139 1.00 0.00 H new ATOM 0 HB2 GLU A 20 85.916 0.703 6.885 1.00 0.00 H new ATOM 0 HB3 GLU A 20 86.908 1.526 5.698 1.00 0.00 H new ATOM 0 HG2 GLU A 20 85.586 3.463 5.717 1.00 0.00 H new ATOM 0 HG3 GLU A 20 84.120 2.592 6.119 1.00 0.00 H new ATOM 315 N GLU A 21 84.968 0.813 2.462 1.00 0.00 N ATOM 316 CA GLU A 21 85.044 1.487 1.173 1.00 0.00 C ATOM 317 C GLU A 21 83.650 1.604 0.565 1.00 0.00 C ATOM 318 O GLU A 21 83.087 0.624 0.085 1.00 0.00 O ATOM 319 CB GLU A 21 85.953 0.718 0.213 1.00 0.00 C ATOM 320 CG GLU A 21 87.409 1.124 0.454 1.00 0.00 C ATOM 321 CD GLU A 21 87.915 0.472 1.736 1.00 0.00 C ATOM 322 OE1 GLU A 21 87.941 -0.747 1.786 1.00 0.00 O ATOM 323 OE2 GLU A 21 88.268 1.201 2.648 1.00 0.00 O ATOM 0 H GLU A 21 84.688 -0.167 2.414 1.00 0.00 H new ATOM 0 HA GLU A 21 85.460 2.482 1.331 1.00 0.00 H new ATOM 0 HB2 GLU A 21 85.834 -0.355 0.363 1.00 0.00 H new ATOM 0 HB3 GLU A 21 85.671 0.929 -0.819 1.00 0.00 H new ATOM 0 HG2 GLU A 21 88.027 0.818 -0.390 1.00 0.00 H new ATOM 0 HG3 GLU A 21 87.487 2.209 0.530 1.00 0.00 H new ATOM 330 N SER A 22 83.093 2.817 0.607 1.00 0.00 N ATOM 331 CA SER A 22 81.743 3.077 0.080 1.00 0.00 C ATOM 332 C SER A 22 81.478 2.356 -1.243 1.00 0.00 C ATOM 333 O SER A 22 80.469 1.668 -1.396 1.00 0.00 O ATOM 334 CB SER A 22 81.535 4.577 -0.126 1.00 0.00 C ATOM 335 OG SER A 22 80.240 4.801 -0.669 1.00 0.00 O ATOM 0 H SER A 22 83.553 3.638 1.000 1.00 0.00 H new ATOM 0 HA SER A 22 81.042 2.692 0.820 1.00 0.00 H new ATOM 0 HB2 SER A 22 81.641 5.104 0.822 1.00 0.00 H new ATOM 0 HB3 SER A 22 82.297 4.973 -0.797 1.00 0.00 H new ATOM 0 HG SER A 22 80.102 5.762 -0.801 1.00 0.00 H new ATOM 341 N ILE A 23 82.389 2.520 -2.192 1.00 0.00 N ATOM 342 CA ILE A 23 82.231 1.879 -3.489 1.00 0.00 C ATOM 343 C ILE A 23 83.498 1.121 -3.868 1.00 0.00 C ATOM 344 O ILE A 23 84.311 1.588 -4.668 1.00 0.00 O ATOM 345 CB ILE A 23 81.917 2.920 -4.564 1.00 0.00 C ATOM 346 CG1 ILE A 23 80.745 3.810 -4.111 1.00 0.00 C ATOM 347 CG2 ILE A 23 81.546 2.206 -5.861 1.00 0.00 C ATOM 348 CD1 ILE A 23 79.502 2.956 -3.812 1.00 0.00 C ATOM 0 H ILE A 23 83.233 3.083 -2.091 1.00 0.00 H new ATOM 0 HA ILE A 23 81.402 1.175 -3.421 1.00 0.00 H new ATOM 0 HB ILE A 23 82.794 3.547 -4.726 1.00 0.00 H new ATOM 0 HG12 ILE A 23 81.030 4.371 -3.221 1.00 0.00 H new ATOM 0 HG13 ILE A 23 80.514 4.539 -4.887 1.00 0.00 H new ATOM 0 HG21 ILE A 23 81.321 2.944 -6.631 1.00 0.00 H new ATOM 0 HG22 ILE A 23 82.381 1.585 -6.186 1.00 0.00 H new ATOM 0 HG23 ILE A 23 80.671 1.578 -5.693 1.00 0.00 H new ATOM 0 HD11 ILE A 23 78.684 3.603 -3.493 1.00 0.00 H new ATOM 0 HD12 ILE A 23 79.207 2.415 -4.711 1.00 0.00 H new ATOM 0 HD13 ILE A 23 79.732 2.244 -3.019 1.00 0.00 H new ATOM 360 N ASP A 24 83.653 -0.060 -3.279 1.00 0.00 N ATOM 361 CA ASP A 24 84.820 -0.895 -3.550 1.00 0.00 C ATOM 362 C ASP A 24 84.502 -1.922 -4.633 1.00 0.00 C ATOM 363 O ASP A 24 85.372 -2.316 -5.409 1.00 0.00 O ATOM 364 CB ASP A 24 85.256 -1.633 -2.283 1.00 0.00 C ATOM 365 CG ASP A 24 86.706 -2.081 -2.428 1.00 0.00 C ATOM 366 OD1 ASP A 24 87.551 -1.228 -2.639 1.00 0.00 O ATOM 367 OD2 ASP A 24 86.950 -3.272 -2.325 1.00 0.00 O ATOM 0 H ASP A 24 82.990 -0.460 -2.615 1.00 0.00 H new ATOM 0 HA ASP A 24 85.626 -0.244 -3.889 1.00 0.00 H new ATOM 0 HB2 ASP A 24 85.151 -0.981 -1.416 1.00 0.00 H new ATOM 0 HB3 ASP A 24 84.613 -2.496 -2.113 1.00 0.00 H new ATOM 372 N LEU A 25 83.243 -2.356 -4.672 1.00 0.00 N ATOM 373 CA LEU A 25 82.813 -3.344 -5.660 1.00 0.00 C ATOM 374 C LEU A 25 83.049 -2.830 -7.079 1.00 0.00 C ATOM 375 O LEU A 25 83.316 -3.605 -7.998 1.00 0.00 O ATOM 376 CB LEU A 25 81.327 -3.661 -5.487 1.00 0.00 C ATOM 377 CG LEU A 25 80.931 -4.178 -4.101 1.00 0.00 C ATOM 378 CD1 LEU A 25 79.409 -4.156 -3.962 1.00 0.00 C ATOM 379 CD2 LEU A 25 81.437 -5.612 -3.932 1.00 0.00 C ATOM 0 H LEU A 25 82.509 -2.042 -4.037 1.00 0.00 H new ATOM 0 HA LEU A 25 83.401 -4.248 -5.503 1.00 0.00 H new ATOM 0 HB2 LEU A 25 80.752 -2.760 -5.700 1.00 0.00 H new ATOM 0 HB3 LEU A 25 81.041 -4.405 -6.231 1.00 0.00 H new ATOM 0 HG LEU A 25 81.373 -3.541 -3.335 1.00 0.00 H new ATOM 0 HD11 LEU A 25 79.128 -4.524 -2.975 1.00 0.00 H new ATOM 0 HD12 LEU A 25 79.047 -3.135 -4.085 1.00 0.00 H new ATOM 0 HD13 LEU A 25 78.965 -4.793 -4.727 1.00 0.00 H new ATOM 0 HD21 LEU A 25 81.157 -5.983 -2.946 1.00 0.00 H new ATOM 0 HD22 LEU A 25 80.993 -6.247 -4.698 1.00 0.00 H new ATOM 0 HD23 LEU A 25 82.522 -5.629 -4.031 1.00 0.00 H new ATOM 391 N GLY A 26 82.948 -1.514 -7.245 1.00 0.00 N ATOM 392 CA GLY A 26 83.154 -0.907 -8.557 1.00 0.00 C ATOM 393 C GLY A 26 82.012 0.040 -8.905 1.00 0.00 C ATOM 394 O GLY A 26 82.200 1.028 -9.615 1.00 0.00 O ATOM 0 H GLY A 26 82.728 -0.855 -6.498 1.00 0.00 H new ATOM 0 HA2 GLY A 26 84.098 -0.363 -8.566 1.00 0.00 H new ATOM 0 HA3 GLY A 26 83.229 -1.687 -9.315 1.00 0.00 H new ATOM 398 N GLY A 27 80.821 -0.270 -8.397 1.00 0.00 N ATOM 399 CA GLY A 27 79.655 0.560 -8.658 1.00 0.00 C ATOM 400 C GLY A 27 78.765 -0.062 -9.733 1.00 0.00 C ATOM 401 O GLY A 27 77.558 0.177 -9.770 1.00 0.00 O ATOM 0 H GLY A 27 80.642 -1.083 -7.808 1.00 0.00 H new ATOM 0 HA2 GLY A 27 79.084 0.689 -7.739 1.00 0.00 H new ATOM 0 HA3 GLY A 27 79.975 1.552 -8.976 1.00 0.00 H new ATOM 405 N ASP A 28 79.372 -0.862 -10.608 1.00 0.00 N ATOM 406 CA ASP A 28 78.630 -1.511 -11.678 1.00 0.00 C ATOM 407 C ASP A 28 77.952 -2.784 -11.169 1.00 0.00 C ATOM 408 O ASP A 28 78.200 -3.886 -11.663 1.00 0.00 O ATOM 409 CB ASP A 28 79.571 -1.859 -12.833 1.00 0.00 C ATOM 410 CG ASP A 28 80.722 -2.716 -12.315 1.00 0.00 C ATOM 411 OD1 ASP A 28 81.527 -2.197 -11.559 1.00 0.00 O ATOM 412 OD2 ASP A 28 80.782 -3.878 -12.682 1.00 0.00 O ATOM 0 H ASP A 28 80.370 -1.073 -10.595 1.00 0.00 H new ATOM 0 HA ASP A 28 77.863 -0.821 -12.030 1.00 0.00 H new ATOM 0 HB2 ASP A 28 79.026 -2.395 -13.610 1.00 0.00 H new ATOM 0 HB3 ASP A 28 79.959 -0.947 -13.287 1.00 0.00 H new ATOM 417 N VAL A 29 77.088 -2.617 -10.173 1.00 0.00 N ATOM 418 CA VAL A 29 76.371 -3.753 -9.597 1.00 0.00 C ATOM 419 C VAL A 29 75.031 -3.298 -9.025 1.00 0.00 C ATOM 420 O VAL A 29 74.547 -3.840 -8.032 1.00 0.00 O ATOM 421 CB VAL A 29 77.196 -4.400 -8.484 1.00 0.00 C ATOM 422 CG1 VAL A 29 78.457 -5.028 -9.080 1.00 0.00 C ATOM 423 CG2 VAL A 29 77.594 -3.333 -7.460 1.00 0.00 C ATOM 0 H VAL A 29 76.867 -1.715 -9.750 1.00 0.00 H new ATOM 0 HA VAL A 29 76.201 -4.482 -10.389 1.00 0.00 H new ATOM 0 HB VAL A 29 76.603 -5.173 -7.995 1.00 0.00 H new ATOM 0 HG11 VAL A 29 79.044 -5.489 -8.286 1.00 0.00 H new ATOM 0 HG12 VAL A 29 78.175 -5.787 -9.810 1.00 0.00 H new ATOM 0 HG13 VAL A 29 79.051 -4.256 -9.570 1.00 0.00 H new ATOM 0 HG21 VAL A 29 78.182 -3.792 -6.666 1.00 0.00 H new ATOM 0 HG22 VAL A 29 78.187 -2.561 -7.951 1.00 0.00 H new ATOM 0 HG23 VAL A 29 76.696 -2.885 -7.034 1.00 0.00 H new ATOM 433 N GLU A 30 74.443 -2.293 -9.665 1.00 0.00 N ATOM 434 CA GLU A 30 73.161 -1.760 -9.222 1.00 0.00 C ATOM 435 C GLU A 30 72.018 -2.710 -9.586 1.00 0.00 C ATOM 436 O GLU A 30 70.983 -2.742 -8.922 1.00 0.00 O ATOM 437 CB GLU A 30 72.915 -0.397 -9.870 1.00 0.00 C ATOM 438 CG GLU A 30 72.883 -0.537 -11.398 1.00 0.00 C ATOM 439 CD GLU A 30 73.606 0.644 -12.041 1.00 0.00 C ATOM 440 OE1 GLU A 30 73.111 1.752 -11.923 1.00 0.00 O ATOM 441 OE2 GLU A 30 74.646 0.421 -12.641 1.00 0.00 O ATOM 0 H GLU A 30 74.832 -1.833 -10.488 1.00 0.00 H new ATOM 0 HA GLU A 30 73.193 -1.653 -8.138 1.00 0.00 H new ATOM 0 HB2 GLU A 30 71.972 0.018 -9.515 1.00 0.00 H new ATOM 0 HB3 GLU A 30 73.700 0.300 -9.577 1.00 0.00 H new ATOM 0 HG2 GLU A 30 73.357 -1.472 -11.697 1.00 0.00 H new ATOM 0 HG3 GLU A 30 71.851 -0.577 -11.747 1.00 0.00 H new ATOM 448 N ASP A 31 72.221 -3.479 -10.651 1.00 0.00 N ATOM 449 CA ASP A 31 71.209 -4.426 -11.103 1.00 0.00 C ATOM 450 C ASP A 31 71.703 -5.862 -10.938 1.00 0.00 C ATOM 451 O ASP A 31 71.271 -6.767 -11.652 1.00 0.00 O ATOM 452 CB ASP A 31 70.865 -4.176 -12.573 1.00 0.00 C ATOM 453 CG ASP A 31 69.893 -3.006 -12.676 1.00 0.00 C ATOM 454 OD1 ASP A 31 70.085 -2.037 -11.959 1.00 0.00 O ATOM 455 OD2 ASP A 31 68.971 -3.095 -13.471 1.00 0.00 O ATOM 0 H ASP A 31 73.072 -3.465 -11.214 1.00 0.00 H new ATOM 0 HA ASP A 31 70.317 -4.283 -10.493 1.00 0.00 H new ATOM 0 HB2 ASP A 31 71.772 -3.960 -13.138 1.00 0.00 H new ATOM 0 HB3 ASP A 31 70.422 -5.070 -13.011 1.00 0.00 H new ATOM 460 N VAL A 32 72.604 -6.062 -9.976 1.00 0.00 N ATOM 461 CA VAL A 32 73.142 -7.390 -9.708 1.00 0.00 C ATOM 462 C VAL A 32 72.608 -7.891 -8.369 1.00 0.00 C ATOM 463 O VAL A 32 72.840 -7.281 -7.326 1.00 0.00 O ATOM 464 CB VAL A 32 74.671 -7.351 -9.660 1.00 0.00 C ATOM 465 CG1 VAL A 32 75.217 -8.773 -9.543 1.00 0.00 C ATOM 466 CG2 VAL A 32 75.203 -6.707 -10.942 1.00 0.00 C ATOM 0 H VAL A 32 72.973 -5.325 -9.375 1.00 0.00 H new ATOM 0 HA VAL A 32 72.833 -8.062 -10.509 1.00 0.00 H new ATOM 0 HB VAL A 32 74.991 -6.768 -8.797 1.00 0.00 H new ATOM 0 HG11 VAL A 32 76.306 -8.743 -9.509 1.00 0.00 H new ATOM 0 HG12 VAL A 32 74.838 -9.234 -8.631 1.00 0.00 H new ATOM 0 HG13 VAL A 32 74.897 -9.358 -10.405 1.00 0.00 H new ATOM 0 HG21 VAL A 32 76.292 -6.678 -10.910 1.00 0.00 H new ATOM 0 HG22 VAL A 32 74.881 -7.292 -11.804 1.00 0.00 H new ATOM 0 HG23 VAL A 32 74.816 -5.692 -11.027 1.00 0.00 H new ATOM 476 N ALA A 33 71.871 -9.004 -8.410 1.00 0.00 N ATOM 477 CA ALA A 33 71.281 -9.577 -7.192 1.00 0.00 C ATOM 478 C ALA A 33 72.314 -9.699 -6.072 1.00 0.00 C ATOM 479 O ALA A 33 73.504 -9.890 -6.320 1.00 0.00 O ATOM 480 CB ALA A 33 70.699 -10.962 -7.478 1.00 0.00 C ATOM 0 H ALA A 33 71.668 -9.524 -9.264 1.00 0.00 H new ATOM 0 HA ALA A 33 70.489 -8.900 -6.870 1.00 0.00 H new ATOM 0 HB1 ALA A 33 70.267 -11.371 -6.565 1.00 0.00 H new ATOM 0 HB2 ALA A 33 69.925 -10.881 -8.241 1.00 0.00 H new ATOM 0 HB3 ALA A 33 71.490 -11.623 -7.832 1.00 0.00 H new ATOM 486 N PHE A 34 71.834 -9.584 -4.833 1.00 0.00 N ATOM 487 CA PHE A 34 72.711 -9.676 -3.662 1.00 0.00 C ATOM 488 C PHE A 34 73.516 -10.974 -3.684 1.00 0.00 C ATOM 489 O PHE A 34 74.648 -11.027 -3.203 1.00 0.00 O ATOM 490 CB PHE A 34 71.886 -9.629 -2.374 1.00 0.00 C ATOM 491 CG PHE A 34 71.134 -8.320 -2.298 1.00 0.00 C ATOM 492 CD1 PHE A 34 71.834 -7.107 -2.288 1.00 0.00 C ATOM 493 CD2 PHE A 34 69.735 -8.320 -2.233 1.00 0.00 C ATOM 494 CE1 PHE A 34 71.136 -5.897 -2.213 1.00 0.00 C ATOM 495 CE2 PHE A 34 69.038 -7.109 -2.157 1.00 0.00 C ATOM 496 CZ PHE A 34 69.739 -5.898 -2.148 1.00 0.00 C ATOM 0 H PHE A 34 70.850 -9.428 -4.614 1.00 0.00 H new ATOM 0 HA PHE A 34 73.395 -8.828 -3.694 1.00 0.00 H new ATOM 0 HB2 PHE A 34 71.186 -10.464 -2.349 1.00 0.00 H new ATOM 0 HB3 PHE A 34 72.540 -9.735 -1.508 1.00 0.00 H new ATOM 0 HD1 PHE A 34 72.913 -7.106 -2.338 1.00 0.00 H new ATOM 0 HD2 PHE A 34 69.194 -9.255 -2.242 1.00 0.00 H new ATOM 0 HE1 PHE A 34 71.676 -4.962 -2.205 1.00 0.00 H new ATOM 0 HE2 PHE A 34 67.959 -7.109 -2.105 1.00 0.00 H new ATOM 0 HZ PHE A 34 69.201 -4.963 -2.091 1.00 0.00 H new ATOM 506 N ASP A 35 72.919 -12.018 -4.249 1.00 0.00 N ATOM 507 CA ASP A 35 73.584 -13.311 -4.332 1.00 0.00 C ATOM 508 C ASP A 35 74.841 -13.210 -5.189 1.00 0.00 C ATOM 509 O ASP A 35 75.845 -13.871 -4.926 1.00 0.00 O ATOM 510 CB ASP A 35 72.642 -14.347 -4.944 1.00 0.00 C ATOM 511 CG ASP A 35 71.340 -14.387 -4.150 1.00 0.00 C ATOM 512 OD1 ASP A 35 71.354 -14.926 -3.055 1.00 0.00 O ATOM 513 OD2 ASP A 35 70.349 -13.877 -4.647 1.00 0.00 O ATOM 0 H ASP A 35 71.983 -11.994 -4.653 1.00 0.00 H new ATOM 0 HA ASP A 35 73.861 -13.618 -3.324 1.00 0.00 H new ATOM 0 HB2 ASP A 35 72.437 -14.097 -5.985 1.00 0.00 H new ATOM 0 HB3 ASP A 35 73.113 -15.330 -4.939 1.00 0.00 H new ATOM 518 N ALA A 36 74.772 -12.375 -6.222 1.00 0.00 N ATOM 519 CA ALA A 36 75.905 -12.192 -7.120 1.00 0.00 C ATOM 520 C ALA A 36 76.969 -11.310 -6.471 1.00 0.00 C ATOM 521 O ALA A 36 78.167 -11.549 -6.621 1.00 0.00 O ATOM 522 CB ALA A 36 75.450 -11.545 -8.429 1.00 0.00 C ATOM 0 H ALA A 36 73.950 -11.819 -6.456 1.00 0.00 H new ATOM 0 HA ALA A 36 76.329 -13.174 -7.328 1.00 0.00 H new ATOM 0 HB1 ALA A 36 76.308 -11.415 -9.088 1.00 0.00 H new ATOM 0 HB2 ALA A 36 74.713 -12.185 -8.914 1.00 0.00 H new ATOM 0 HB3 ALA A 36 75.004 -10.573 -8.219 1.00 0.00 H new ATOM 528 N LEU A 37 76.518 -10.289 -5.747 1.00 0.00 N ATOM 529 CA LEU A 37 77.444 -9.375 -5.077 1.00 0.00 C ATOM 530 C LEU A 37 78.303 -10.132 -4.070 1.00 0.00 C ATOM 531 O LEU A 37 79.465 -9.796 -3.844 1.00 0.00 O ATOM 532 CB LEU A 37 76.677 -8.272 -4.345 1.00 0.00 C ATOM 533 CG LEU A 37 75.559 -7.608 -5.153 1.00 0.00 C ATOM 534 CD1 LEU A 37 74.973 -6.444 -4.354 1.00 0.00 C ATOM 535 CD2 LEU A 37 76.126 -7.083 -6.474 1.00 0.00 C ATOM 0 H LEU A 37 75.531 -10.074 -5.609 1.00 0.00 H new ATOM 0 HA LEU A 37 78.082 -8.928 -5.839 1.00 0.00 H new ATOM 0 HB2 LEU A 37 76.246 -8.693 -3.437 1.00 0.00 H new ATOM 0 HB3 LEU A 37 77.385 -7.503 -4.035 1.00 0.00 H new ATOM 0 HG LEU A 37 74.777 -8.339 -5.357 1.00 0.00 H new ATOM 0 HD11 LEU A 37 74.177 -5.972 -4.930 1.00 0.00 H new ATOM 0 HD12 LEU A 37 74.568 -6.816 -3.413 1.00 0.00 H new ATOM 0 HD13 LEU A 37 75.755 -5.713 -4.149 1.00 0.00 H new ATOM 0 HD21 LEU A 37 75.330 -6.610 -7.049 1.00 0.00 H new ATOM 0 HD22 LEU A 37 76.909 -6.353 -6.269 1.00 0.00 H new ATOM 0 HD23 LEU A 37 76.544 -7.912 -7.046 1.00 0.00 H new ATOM 547 N GLY A 38 77.716 -11.163 -3.470 1.00 0.00 N ATOM 548 CA GLY A 38 78.434 -11.972 -2.490 1.00 0.00 C ATOM 549 C GLY A 38 77.841 -11.811 -1.090 1.00 0.00 C ATOM 550 O GLY A 38 78.513 -12.061 -0.090 1.00 0.00 O ATOM 0 H GLY A 38 76.754 -11.456 -3.643 1.00 0.00 H new ATOM 0 HA2 GLY A 38 78.396 -13.021 -2.784 1.00 0.00 H new ATOM 0 HA3 GLY A 38 79.485 -11.682 -2.477 1.00 0.00 H new ATOM 554 N TYR A 39 76.575 -11.399 -1.024 1.00 0.00 N ATOM 555 CA TYR A 39 75.917 -11.221 0.267 1.00 0.00 C ATOM 556 C TYR A 39 75.147 -12.480 0.647 1.00 0.00 C ATOM 557 O TYR A 39 74.460 -13.079 -0.180 1.00 0.00 O ATOM 558 CB TYR A 39 74.938 -10.044 0.221 1.00 0.00 C ATOM 559 CG TYR A 39 75.692 -8.752 0.011 1.00 0.00 C ATOM 560 CD1 TYR A 39 76.771 -8.420 0.840 1.00 0.00 C ATOM 561 CD2 TYR A 39 75.305 -7.881 -1.014 1.00 0.00 C ATOM 562 CE1 TYR A 39 77.462 -7.218 0.642 1.00 0.00 C ATOM 563 CE2 TYR A 39 75.995 -6.680 -1.212 1.00 0.00 C ATOM 564 CZ TYR A 39 77.073 -6.348 -0.383 1.00 0.00 C ATOM 565 OH TYR A 39 77.754 -5.163 -0.578 1.00 0.00 O ATOM 0 H TYR A 39 75.994 -11.186 -1.835 1.00 0.00 H new ATOM 0 HA TYR A 39 76.690 -11.021 1.008 1.00 0.00 H new ATOM 0 HB2 TYR A 39 74.219 -10.190 -0.585 1.00 0.00 H new ATOM 0 HB3 TYR A 39 74.370 -9.996 1.150 1.00 0.00 H new ATOM 0 HD1 TYR A 39 77.070 -9.091 1.632 1.00 0.00 H new ATOM 0 HD2 TYR A 39 74.473 -8.136 -1.653 1.00 0.00 H new ATOM 0 HE1 TYR A 39 78.295 -6.962 1.280 1.00 0.00 H new ATOM 0 HE2 TYR A 39 75.696 -6.009 -2.004 1.00 0.00 H new ATOM 0 HH TYR A 39 77.357 -4.677 -1.331 1.00 0.00 H new ATOM 575 N ASP A 40 75.261 -12.870 1.912 1.00 0.00 N ATOM 576 CA ASP A 40 74.562 -14.056 2.398 1.00 0.00 C ATOM 577 C ASP A 40 73.125 -13.700 2.745 1.00 0.00 C ATOM 578 O ASP A 40 72.177 -14.163 2.111 1.00 0.00 O ATOM 579 CB ASP A 40 75.254 -14.617 3.642 1.00 0.00 C ATOM 580 CG ASP A 40 76.307 -15.636 3.223 1.00 0.00 C ATOM 581 OD1 ASP A 40 76.061 -16.356 2.268 1.00 0.00 O ATOM 582 OD2 ASP A 40 77.345 -15.684 3.864 1.00 0.00 O ATOM 0 H ASP A 40 75.824 -12.389 2.613 1.00 0.00 H new ATOM 0 HA ASP A 40 74.578 -14.811 1.612 1.00 0.00 H new ATOM 0 HB2 ASP A 40 75.719 -13.810 4.208 1.00 0.00 H new ATOM 0 HB3 ASP A 40 74.521 -15.085 4.299 1.00 0.00 H new ATOM 587 N SER A 41 72.984 -12.864 3.765 1.00 0.00 N ATOM 588 CA SER A 41 71.670 -12.417 4.224 1.00 0.00 C ATOM 589 C SER A 41 71.834 -11.612 5.502 1.00 0.00 C ATOM 590 O SER A 41 71.190 -10.582 5.699 1.00 0.00 O ATOM 591 CB SER A 41 70.744 -13.608 4.501 1.00 0.00 C ATOM 592 OG SER A 41 70.012 -13.916 3.321 1.00 0.00 O ATOM 0 H SER A 41 73.766 -12.479 4.294 1.00 0.00 H new ATOM 0 HA SER A 41 71.224 -11.805 3.440 1.00 0.00 H new ATOM 0 HB2 SER A 41 71.328 -14.472 4.817 1.00 0.00 H new ATOM 0 HB3 SER A 41 70.060 -13.370 5.316 1.00 0.00 H new ATOM 0 HG SER A 41 70.611 -14.325 2.662 1.00 0.00 H new ATOM 598 N LEU A 42 72.721 -12.101 6.367 1.00 0.00 N ATOM 599 CA LEU A 42 72.994 -11.439 7.642 1.00 0.00 C ATOM 600 C LEU A 42 73.408 -9.986 7.422 1.00 0.00 C ATOM 601 O LEU A 42 72.989 -9.083 8.148 1.00 0.00 O ATOM 602 CB LEU A 42 74.111 -12.176 8.389 1.00 0.00 C ATOM 603 CG LEU A 42 73.898 -12.310 9.899 1.00 0.00 C ATOM 604 CD1 LEU A 42 74.573 -13.589 10.400 1.00 0.00 C ATOM 605 CD2 LEU A 42 74.508 -11.099 10.609 1.00 0.00 C ATOM 0 H LEU A 42 73.262 -12.951 6.209 1.00 0.00 H new ATOM 0 HA LEU A 42 72.080 -11.459 8.236 1.00 0.00 H new ATOM 0 HB2 LEU A 42 74.217 -13.173 7.962 1.00 0.00 H new ATOM 0 HB3 LEU A 42 75.051 -11.653 8.215 1.00 0.00 H new ATOM 0 HG LEU A 42 72.830 -12.357 10.112 1.00 0.00 H new ATOM 0 HD11 LEU A 42 74.421 -13.684 11.475 1.00 0.00 H new ATOM 0 HD12 LEU A 42 74.139 -14.452 9.895 1.00 0.00 H new ATOM 0 HD13 LEU A 42 75.641 -13.544 10.187 1.00 0.00 H new ATOM 0 HD21 LEU A 42 74.357 -11.193 11.684 1.00 0.00 H new ATOM 0 HD22 LEU A 42 75.576 -11.052 10.395 1.00 0.00 H new ATOM 0 HD23 LEU A 42 74.026 -10.188 10.254 1.00 0.00 H new ATOM 617 N ALA A 43 74.238 -9.771 6.412 1.00 0.00 N ATOM 618 CA ALA A 43 74.705 -8.427 6.107 1.00 0.00 C ATOM 619 C ALA A 43 73.562 -7.554 5.611 1.00 0.00 C ATOM 620 O ALA A 43 73.453 -6.391 5.986 1.00 0.00 O ATOM 621 CB ALA A 43 75.803 -8.467 5.042 1.00 0.00 C ATOM 0 H ALA A 43 74.598 -10.500 5.796 1.00 0.00 H new ATOM 0 HA ALA A 43 75.106 -8.001 7.027 1.00 0.00 H new ATOM 0 HB1 ALA A 43 76.139 -7.453 4.828 1.00 0.00 H new ATOM 0 HB2 ALA A 43 76.643 -9.058 5.407 1.00 0.00 H new ATOM 0 HB3 ALA A 43 75.410 -8.919 4.131 1.00 0.00 H new ATOM 627 N LEU A 44 72.714 -8.122 4.763 1.00 0.00 N ATOM 628 CA LEU A 44 71.590 -7.368 4.216 1.00 0.00 C ATOM 629 C LEU A 44 70.625 -6.942 5.320 1.00 0.00 C ATOM 630 O LEU A 44 70.272 -5.767 5.425 1.00 0.00 O ATOM 631 CB LEU A 44 70.847 -8.192 3.164 1.00 0.00 C ATOM 632 CG LEU A 44 71.407 -8.067 1.745 1.00 0.00 C ATOM 633 CD1 LEU A 44 70.556 -8.885 0.775 1.00 0.00 C ATOM 634 CD2 LEU A 44 71.388 -6.596 1.320 1.00 0.00 C ATOM 0 H LEU A 44 72.779 -9.088 4.442 1.00 0.00 H new ATOM 0 HA LEU A 44 71.992 -6.472 3.743 1.00 0.00 H new ATOM 0 HB2 LEU A 44 70.872 -9.241 3.459 1.00 0.00 H new ATOM 0 HB3 LEU A 44 69.800 -7.888 3.156 1.00 0.00 H new ATOM 0 HG LEU A 44 72.430 -8.443 1.729 1.00 0.00 H new ATOM 0 HD11 LEU A 44 70.961 -8.791 -0.233 1.00 0.00 H new ATOM 0 HD12 LEU A 44 70.568 -9.933 1.075 1.00 0.00 H new ATOM 0 HD13 LEU A 44 69.531 -8.516 0.790 1.00 0.00 H new ATOM 0 HD21 LEU A 44 71.786 -6.504 0.310 1.00 0.00 H new ATOM 0 HD22 LEU A 44 70.364 -6.224 1.341 1.00 0.00 H new ATOM 0 HD23 LEU A 44 72.001 -6.011 2.006 1.00 0.00 H new ATOM 646 N LEU A 45 70.195 -7.899 6.146 1.00 0.00 N ATOM 647 CA LEU A 45 69.263 -7.579 7.238 1.00 0.00 C ATOM 648 C LEU A 45 69.813 -6.456 8.113 1.00 0.00 C ATOM 649 O LEU A 45 69.067 -5.610 8.605 1.00 0.00 O ATOM 650 CB LEU A 45 68.971 -8.797 8.124 1.00 0.00 C ATOM 651 CG LEU A 45 70.162 -9.699 8.472 1.00 0.00 C ATOM 652 CD1 LEU A 45 70.768 -9.265 9.809 1.00 0.00 C ATOM 653 CD2 LEU A 45 69.677 -11.148 8.590 1.00 0.00 C ATOM 0 H LEU A 45 70.467 -8.880 6.086 1.00 0.00 H new ATOM 0 HA LEU A 45 68.334 -7.260 6.766 1.00 0.00 H new ATOM 0 HB2 LEU A 45 68.530 -8.442 9.055 1.00 0.00 H new ATOM 0 HB3 LEU A 45 68.217 -9.407 7.626 1.00 0.00 H new ATOM 0 HG LEU A 45 70.916 -9.619 7.689 1.00 0.00 H new ATOM 0 HD11 LEU A 45 71.613 -9.909 10.051 1.00 0.00 H new ATOM 0 HD12 LEU A 45 71.108 -8.232 9.736 1.00 0.00 H new ATOM 0 HD13 LEU A 45 70.015 -9.345 10.593 1.00 0.00 H new ATOM 0 HD21 LEU A 45 70.519 -11.795 8.837 1.00 0.00 H new ATOM 0 HD22 LEU A 45 68.924 -11.217 9.375 1.00 0.00 H new ATOM 0 HD23 LEU A 45 69.243 -11.465 7.642 1.00 0.00 H new ATOM 665 N ASN A 46 71.127 -6.457 8.299 1.00 0.00 N ATOM 666 CA ASN A 46 71.769 -5.432 9.114 1.00 0.00 C ATOM 667 C ASN A 46 71.685 -4.074 8.430 1.00 0.00 C ATOM 668 O ASN A 46 71.208 -3.099 9.010 1.00 0.00 O ATOM 669 CB ASN A 46 73.237 -5.774 9.331 1.00 0.00 C ATOM 670 CG ASN A 46 73.365 -6.803 10.441 1.00 0.00 C ATOM 671 OD1 ASN A 46 74.001 -7.912 10.201 1.00 0.00 O flip ATOM 672 ND2 ASN A 46 72.877 -6.598 11.552 1.00 0.00 N flip ATOM 0 H ASN A 46 71.764 -7.148 7.902 1.00 0.00 H new ATOM 0 HA ASN A 46 71.250 -5.393 10.072 1.00 0.00 H new ATOM 0 HB2 ASN A 46 73.670 -6.164 8.409 1.00 0.00 H new ATOM 0 HB3 ASN A 46 73.795 -4.874 9.590 1.00 0.00 H new ATOM 0 HD21 ASN A 46 72.379 -5.727 11.737 1.00 0.00 H new ATOM 0 HD22 ASN A 46 72.971 -7.299 12.287 1.00 0.00 H new ATOM 679 N THR A 47 72.168 -4.018 7.190 1.00 0.00 N ATOM 680 CA THR A 47 72.157 -2.764 6.432 1.00 0.00 C ATOM 681 C THR A 47 70.737 -2.212 6.317 1.00 0.00 C ATOM 682 O THR A 47 70.523 -1.001 6.353 1.00 0.00 O ATOM 683 CB THR A 47 72.736 -2.965 5.021 1.00 0.00 C ATOM 684 OG1 THR A 47 73.469 -4.178 4.972 1.00 0.00 O ATOM 685 CG2 THR A 47 73.667 -1.806 4.675 1.00 0.00 C ATOM 0 H THR A 47 72.567 -4.814 6.692 1.00 0.00 H new ATOM 0 HA THR A 47 72.779 -2.051 6.974 1.00 0.00 H new ATOM 0 HB THR A 47 71.916 -3.003 4.304 1.00 0.00 H new ATOM 0 HG1 THR A 47 72.852 -4.936 5.042 1.00 0.00 H new ATOM 0 HG21 THR A 47 74.075 -1.953 3.675 1.00 0.00 H new ATOM 0 HG22 THR A 47 73.110 -0.870 4.706 1.00 0.00 H new ATOM 0 HG23 THR A 47 74.483 -1.766 5.397 1.00 0.00 H new ATOM 693 N VAL A 48 69.773 -3.115 6.181 1.00 0.00 N ATOM 694 CA VAL A 48 68.376 -2.707 6.066 1.00 0.00 C ATOM 695 C VAL A 48 67.887 -2.134 7.394 1.00 0.00 C ATOM 696 O VAL A 48 67.136 -1.159 7.427 1.00 0.00 O ATOM 697 CB VAL A 48 67.496 -3.901 5.673 1.00 0.00 C ATOM 698 CG1 VAL A 48 66.060 -3.426 5.430 1.00 0.00 C ATOM 699 CG2 VAL A 48 68.043 -4.542 4.392 1.00 0.00 C ATOM 0 H VAL A 48 69.928 -4.123 6.148 1.00 0.00 H new ATOM 0 HA VAL A 48 68.305 -1.944 5.291 1.00 0.00 H new ATOM 0 HB VAL A 48 67.504 -4.634 6.480 1.00 0.00 H new ATOM 0 HG11 VAL A 48 65.438 -4.276 5.151 1.00 0.00 H new ATOM 0 HG12 VAL A 48 65.668 -2.972 6.340 1.00 0.00 H new ATOM 0 HG13 VAL A 48 66.051 -2.691 4.625 1.00 0.00 H new ATOM 0 HG21 VAL A 48 67.417 -5.390 4.114 1.00 0.00 H new ATOM 0 HG22 VAL A 48 68.038 -3.807 3.587 1.00 0.00 H new ATOM 0 HG23 VAL A 48 69.063 -4.885 4.564 1.00 0.00 H new ATOM 709 N GLY A 49 68.323 -2.753 8.488 1.00 0.00 N ATOM 710 CA GLY A 49 67.927 -2.301 9.820 1.00 0.00 C ATOM 711 C GLY A 49 68.403 -0.874 10.076 1.00 0.00 C ATOM 712 O GLY A 49 67.721 -0.078 10.724 1.00 0.00 O ATOM 0 H GLY A 49 68.945 -3.562 8.480 1.00 0.00 H new ATOM 0 HA2 GLY A 49 66.842 -2.350 9.917 1.00 0.00 H new ATOM 0 HA3 GLY A 49 68.345 -2.968 10.574 1.00 0.00 H new ATOM 716 N ARG A 50 69.588 -0.557 9.563 1.00 0.00 N ATOM 717 CA ARG A 50 70.147 0.774 9.747 1.00 0.00 C ATOM 718 C ARG A 50 69.399 1.794 8.900 1.00 0.00 C ATOM 719 O ARG A 50 69.103 2.897 9.355 1.00 0.00 O ATOM 720 CB ARG A 50 71.628 0.794 9.364 1.00 0.00 C ATOM 721 CG ARG A 50 72.252 2.119 9.805 1.00 0.00 C ATOM 722 CD ARG A 50 73.775 2.022 9.710 1.00 0.00 C ATOM 723 NE ARG A 50 74.406 3.197 10.315 1.00 0.00 N ATOM 724 CZ ARG A 50 75.715 3.452 10.177 1.00 0.00 C ATOM 725 NH1 ARG A 50 76.496 2.653 9.488 1.00 0.00 N ATOM 726 NH2 ARG A 50 76.222 4.515 10.739 1.00 0.00 N ATOM 0 H ARG A 50 70.172 -1.196 9.023 1.00 0.00 H new ATOM 0 HA ARG A 50 70.043 1.035 10.800 1.00 0.00 H new ATOM 0 HB2 ARG A 50 72.148 -0.040 9.836 1.00 0.00 H new ATOM 0 HB3 ARG A 50 71.738 0.669 8.287 1.00 0.00 H new ATOM 0 HG2 ARG A 50 71.889 2.932 9.176 1.00 0.00 H new ATOM 0 HG3 ARG A 50 71.955 2.351 10.828 1.00 0.00 H new ATOM 0 HD2 ARG A 50 74.119 1.118 10.213 1.00 0.00 H new ATOM 0 HD3 ARG A 50 74.075 1.939 8.665 1.00 0.00 H new ATOM 0 HE ARG A 50 73.832 3.841 10.858 1.00 0.00 H new ATOM 0 HH11 ARG A 50 76.110 1.819 9.045 1.00 0.00 H new ATOM 0 HH12 ARG A 50 77.489 2.866 9.396 1.00 0.00 H new ATOM 0 HH21 ARG A 50 75.624 5.142 11.277 1.00 0.00 H new ATOM 0 HH22 ARG A 50 77.217 4.719 10.641 1.00 0.00 H new ATOM 740 N ILE A 51 69.094 1.415 7.663 1.00 0.00 N ATOM 741 CA ILE A 51 68.377 2.315 6.768 1.00 0.00 C ATOM 742 C ILE A 51 66.941 2.500 7.245 1.00 0.00 C ATOM 743 O ILE A 51 66.447 3.621 7.333 1.00 0.00 O ATOM 744 CB ILE A 51 68.368 1.769 5.335 1.00 0.00 C ATOM 745 CG1 ILE A 51 69.805 1.493 4.884 1.00 0.00 C ATOM 746 CG2 ILE A 51 67.734 2.800 4.395 1.00 0.00 C ATOM 747 CD1 ILE A 51 69.821 0.302 3.924 1.00 0.00 C ATOM 0 H ILE A 51 69.328 0.506 7.263 1.00 0.00 H new ATOM 0 HA ILE A 51 68.891 3.276 6.777 1.00 0.00 H new ATOM 0 HB ILE A 51 67.790 0.845 5.306 1.00 0.00 H new ATOM 0 HG12 ILE A 51 70.219 2.374 4.393 1.00 0.00 H new ATOM 0 HG13 ILE A 51 70.435 1.285 5.749 1.00 0.00 H new ATOM 0 HG21 ILE A 51 67.729 2.410 3.377 1.00 0.00 H new ATOM 0 HG22 ILE A 51 66.711 3.001 4.712 1.00 0.00 H new ATOM 0 HG23 ILE A 51 68.311 3.724 4.426 1.00 0.00 H new ATOM 0 HD11 ILE A 51 70.844 0.107 3.604 1.00 0.00 H new ATOM 0 HD12 ILE A 51 69.425 -0.578 4.430 1.00 0.00 H new ATOM 0 HD13 ILE A 51 69.205 0.528 3.053 1.00 0.00 H new ATOM 759 N GLU A 52 66.272 1.394 7.550 1.00 0.00 N ATOM 760 CA GLU A 52 64.891 1.473 8.013 1.00 0.00 C ATOM 761 C GLU A 52 64.802 2.241 9.331 1.00 0.00 C ATOM 762 O GLU A 52 63.750 2.776 9.671 1.00 0.00 O ATOM 763 CB GLU A 52 64.284 0.076 8.190 1.00 0.00 C ATOM 764 CG GLU A 52 65.101 -0.720 9.208 1.00 0.00 C ATOM 765 CD GLU A 52 64.466 -0.592 10.588 1.00 0.00 C ATOM 766 OE1 GLU A 52 63.560 -1.358 10.874 1.00 0.00 O ATOM 767 OE2 GLU A 52 64.894 0.268 11.340 1.00 0.00 O ATOM 0 H GLU A 52 66.653 0.450 7.487 1.00 0.00 H new ATOM 0 HA GLU A 52 64.323 2.007 7.251 1.00 0.00 H new ATOM 0 HB2 GLU A 52 63.250 0.159 8.525 1.00 0.00 H new ATOM 0 HB3 GLU A 52 64.268 -0.447 7.234 1.00 0.00 H new ATOM 0 HG2 GLU A 52 65.146 -1.768 8.913 1.00 0.00 H new ATOM 0 HG3 GLU A 52 66.127 -0.352 9.233 1.00 0.00 H new ATOM 774 N ARG A 53 65.908 2.295 10.076 1.00 0.00 N ATOM 775 CA ARG A 53 65.905 3.012 11.348 1.00 0.00 C ATOM 776 C ARG A 53 66.407 4.442 11.163 1.00 0.00 C ATOM 777 O ARG A 53 65.909 5.375 11.792 1.00 0.00 O ATOM 778 CB ARG A 53 66.787 2.301 12.375 1.00 0.00 C ATOM 779 CG ARG A 53 66.322 2.666 13.787 1.00 0.00 C ATOM 780 CD ARG A 53 66.612 1.507 14.747 1.00 0.00 C ATOM 781 NE ARG A 53 67.751 1.827 15.611 1.00 0.00 N ATOM 782 CZ ARG A 53 67.646 2.681 16.640 1.00 0.00 C ATOM 783 NH1 ARG A 53 66.509 3.272 16.921 1.00 0.00 N ATOM 784 NH2 ARG A 53 68.696 2.927 17.376 1.00 0.00 N ATOM 0 H ARG A 53 66.797 1.861 9.827 1.00 0.00 H new ATOM 0 HA ARG A 53 64.877 3.034 11.711 1.00 0.00 H new ATOM 0 HB2 ARG A 53 66.734 1.222 12.231 1.00 0.00 H new ATOM 0 HB3 ARG A 53 67.829 2.590 12.238 1.00 0.00 H new ATOM 0 HG2 ARG A 53 66.833 3.567 14.126 1.00 0.00 H new ATOM 0 HG3 ARG A 53 65.255 2.887 13.782 1.00 0.00 H new ATOM 0 HD2 ARG A 53 65.732 1.304 15.357 1.00 0.00 H new ATOM 0 HD3 ARG A 53 66.823 0.601 14.179 1.00 0.00 H new ATOM 0 HE ARG A 53 68.652 1.387 15.424 1.00 0.00 H new ATOM 0 HH11 ARG A 53 65.683 3.085 16.352 1.00 0.00 H new ATOM 0 HH12 ARG A 53 66.451 3.918 17.708 1.00 0.00 H new ATOM 0 HH21 ARG A 53 69.584 2.472 17.166 1.00 0.00 H new ATOM 0 HH22 ARG A 53 68.628 3.575 18.161 1.00 0.00 H new ATOM 798 N ASP A 54 67.400 4.603 10.296 1.00 0.00 N ATOM 799 CA ASP A 54 67.966 5.920 10.037 1.00 0.00 C ATOM 800 C ASP A 54 67.040 6.734 9.137 1.00 0.00 C ATOM 801 O ASP A 54 66.891 7.943 9.306 1.00 0.00 O ATOM 802 CB ASP A 54 69.329 5.790 9.359 1.00 0.00 C ATOM 803 CG ASP A 54 70.389 5.461 10.404 1.00 0.00 C ATOM 804 OD1 ASP A 54 70.133 4.597 11.227 1.00 0.00 O ATOM 805 OD2 ASP A 54 71.442 6.077 10.367 1.00 0.00 O ATOM 0 H ASP A 54 67.827 3.844 9.765 1.00 0.00 H new ATOM 0 HA ASP A 54 68.081 6.430 10.994 1.00 0.00 H new ATOM 0 HB2 ASP A 54 69.296 5.008 8.600 1.00 0.00 H new ATOM 0 HB3 ASP A 54 69.583 6.719 8.848 1.00 0.00 H new ATOM 810 N TYR A 55 66.422 6.053 8.176 1.00 0.00 N ATOM 811 CA TYR A 55 65.512 6.716 7.248 1.00 0.00 C ATOM 812 C TYR A 55 64.067 6.588 7.725 1.00 0.00 C ATOM 813 O TYR A 55 63.230 7.442 7.435 1.00 0.00 O ATOM 814 CB TYR A 55 65.636 6.111 5.846 1.00 0.00 C ATOM 815 CG TYR A 55 66.999 6.430 5.278 1.00 0.00 C ATOM 816 CD1 TYR A 55 68.147 5.877 5.858 1.00 0.00 C ATOM 817 CD2 TYR A 55 67.115 7.281 4.172 1.00 0.00 C ATOM 818 CE1 TYR A 55 69.410 6.174 5.331 1.00 0.00 C ATOM 819 CE2 TYR A 55 68.378 7.578 3.645 1.00 0.00 C ATOM 820 CZ TYR A 55 69.525 7.024 4.225 1.00 0.00 C ATOM 821 OH TYR A 55 70.771 7.316 3.707 1.00 0.00 O ATOM 0 H TYR A 55 66.533 5.051 8.020 1.00 0.00 H new ATOM 0 HA TYR A 55 65.785 7.771 7.210 1.00 0.00 H new ATOM 0 HB2 TYR A 55 65.492 5.031 5.890 1.00 0.00 H new ATOM 0 HB3 TYR A 55 64.857 6.510 5.196 1.00 0.00 H new ATOM 0 HD1 TYR A 55 68.059 5.221 6.712 1.00 0.00 H new ATOM 0 HD2 TYR A 55 66.230 7.709 3.725 1.00 0.00 H new ATOM 0 HE1 TYR A 55 70.296 5.747 5.778 1.00 0.00 H new ATOM 0 HE2 TYR A 55 68.467 8.234 2.792 1.00 0.00 H new ATOM 0 HH TYR A 55 70.674 7.919 2.941 1.00 0.00 H new ATOM 831 N GLY A 56 63.779 5.515 8.463 1.00 0.00 N ATOM 832 CA GLY A 56 62.424 5.306 8.969 1.00 0.00 C ATOM 833 C GLY A 56 61.489 4.850 7.854 1.00 0.00 C ATOM 834 O GLY A 56 60.324 5.246 7.802 1.00 0.00 O ATOM 0 H GLY A 56 64.451 4.791 8.719 1.00 0.00 H new ATOM 0 HA2 GLY A 56 62.440 4.560 9.763 1.00 0.00 H new ATOM 0 HA3 GLY A 56 62.049 6.231 9.408 1.00 0.00 H new ATOM 838 N VAL A 57 62.009 4.013 6.960 1.00 0.00 N ATOM 839 CA VAL A 57 61.205 3.512 5.847 1.00 0.00 C ATOM 840 C VAL A 57 60.138 2.540 6.353 1.00 0.00 C ATOM 841 O VAL A 57 60.397 1.706 7.221 1.00 0.00 O ATOM 842 CB VAL A 57 62.099 2.813 4.805 1.00 0.00 C ATOM 843 CG1 VAL A 57 62.744 1.553 5.405 1.00 0.00 C ATOM 844 CG2 VAL A 57 61.258 2.428 3.581 1.00 0.00 C ATOM 0 H VAL A 57 62.970 3.671 6.982 1.00 0.00 H new ATOM 0 HA VAL A 57 60.713 4.361 5.374 1.00 0.00 H new ATOM 0 HB VAL A 57 62.890 3.501 4.505 1.00 0.00 H new ATOM 0 HG11 VAL A 57 63.372 1.073 4.654 1.00 0.00 H new ATOM 0 HG12 VAL A 57 63.354 1.831 6.264 1.00 0.00 H new ATOM 0 HG13 VAL A 57 61.964 0.861 5.722 1.00 0.00 H new ATOM 0 HG21 VAL A 57 61.892 1.934 2.845 1.00 0.00 H new ATOM 0 HG22 VAL A 57 60.460 1.751 3.886 1.00 0.00 H new ATOM 0 HG23 VAL A 57 60.823 3.326 3.141 1.00 0.00 H new ATOM 854 N GLN A 58 58.935 2.657 5.796 1.00 0.00 N ATOM 855 CA GLN A 58 57.835 1.785 6.193 1.00 0.00 C ATOM 856 C GLN A 58 56.756 1.764 5.111 1.00 0.00 C ATOM 857 O GLN A 58 55.718 2.414 5.231 1.00 0.00 O ATOM 858 CB GLN A 58 57.218 2.261 7.510 1.00 0.00 C ATOM 859 CG GLN A 58 56.436 1.112 8.151 1.00 0.00 C ATOM 860 CD GLN A 58 57.322 0.392 9.162 1.00 0.00 C ATOM 861 OE1 GLN A 58 57.756 0.985 10.150 1.00 0.00 O ATOM 862 NE2 GLN A 58 57.621 -0.864 8.971 1.00 0.00 N ATOM 0 H GLN A 58 58.699 3.340 5.076 1.00 0.00 H new ATOM 0 HA GLN A 58 58.234 0.780 6.327 1.00 0.00 H new ATOM 0 HB2 GLN A 58 58.000 2.605 8.187 1.00 0.00 H new ATOM 0 HB3 GLN A 58 56.557 3.109 7.329 1.00 0.00 H new ATOM 0 HG2 GLN A 58 55.543 1.497 8.644 1.00 0.00 H new ATOM 0 HG3 GLN A 58 56.101 0.414 7.384 1.00 0.00 H new ATOM 0 HE21 GLN A 58 57.261 -1.355 8.153 1.00 0.00 H new ATOM 0 HE22 GLN A 58 58.214 -1.354 9.640 1.00 0.00 H new ATOM 871 N LEU A 59 57.022 1.011 4.048 1.00 0.00 N ATOM 872 CA LEU A 59 56.073 0.910 2.940 1.00 0.00 C ATOM 873 C LEU A 59 55.569 -0.525 2.783 1.00 0.00 C ATOM 874 O LEU A 59 54.411 -0.755 2.431 1.00 0.00 O ATOM 875 CB LEU A 59 56.722 1.367 1.630 1.00 0.00 C ATOM 876 CG LEU A 59 57.810 0.445 1.068 1.00 0.00 C ATOM 877 CD1 LEU A 59 58.050 0.782 -0.405 1.00 0.00 C ATOM 878 CD2 LEU A 59 59.109 0.643 1.855 1.00 0.00 C ATOM 0 H LEU A 59 57.876 0.467 3.929 1.00 0.00 H new ATOM 0 HA LEU A 59 55.228 1.560 3.168 1.00 0.00 H new ATOM 0 HB2 LEU A 59 55.941 1.476 0.878 1.00 0.00 H new ATOM 0 HB3 LEU A 59 57.155 2.355 1.786 1.00 0.00 H new ATOM 0 HG LEU A 59 57.488 -0.592 1.158 1.00 0.00 H new ATOM 0 HD11 LEU A 59 58.823 0.127 -0.807 1.00 0.00 H new ATOM 0 HD12 LEU A 59 57.126 0.639 -0.966 1.00 0.00 H new ATOM 0 HD13 LEU A 59 58.371 1.820 -0.493 1.00 0.00 H new ATOM 0 HD21 LEU A 59 59.881 -0.013 1.454 1.00 0.00 H new ATOM 0 HD22 LEU A 59 59.433 1.680 1.767 1.00 0.00 H new ATOM 0 HD23 LEU A 59 58.939 0.403 2.905 1.00 0.00 H new ATOM 890 N GLY A 60 56.449 -1.490 3.045 1.00 0.00 N ATOM 891 CA GLY A 60 56.079 -2.896 2.928 1.00 0.00 C ATOM 892 C GLY A 60 57.149 -3.791 3.545 1.00 0.00 C ATOM 893 O GLY A 60 58.322 -3.723 3.180 1.00 0.00 O ATOM 0 H GLY A 60 57.412 -1.325 3.336 1.00 0.00 H new ATOM 0 HA2 GLY A 60 55.124 -3.068 3.425 1.00 0.00 H new ATOM 0 HA3 GLY A 60 55.943 -3.155 1.878 1.00 0.00 H new ATOM 897 N ASP A 61 56.726 -4.631 4.487 1.00 0.00 N ATOM 898 CA ASP A 61 57.653 -5.539 5.156 1.00 0.00 C ATOM 899 C ASP A 61 58.243 -6.536 4.163 1.00 0.00 C ATOM 900 O ASP A 61 59.376 -6.994 4.321 1.00 0.00 O ATOM 901 CB ASP A 61 56.936 -6.309 6.267 1.00 0.00 C ATOM 902 CG ASP A 61 56.645 -5.370 7.432 1.00 0.00 C ATOM 903 OD1 ASP A 61 55.784 -4.519 7.282 1.00 0.00 O ATOM 904 OD2 ASP A 61 57.288 -5.515 8.459 1.00 0.00 O ATOM 0 H ASP A 61 55.758 -4.702 4.801 1.00 0.00 H new ATOM 0 HA ASP A 61 58.456 -4.940 5.585 1.00 0.00 H new ATOM 0 HB2 ASP A 61 56.007 -6.734 5.888 1.00 0.00 H new ATOM 0 HB3 ASP A 61 57.553 -7.142 6.603 1.00 0.00 H new ATOM 909 N ASP A 62 57.464 -6.870 3.137 1.00 0.00 N ATOM 910 CA ASP A 62 57.924 -7.819 2.128 1.00 0.00 C ATOM 911 C ASP A 62 58.877 -7.167 1.124 1.00 0.00 C ATOM 912 O ASP A 62 59.390 -7.834 0.225 1.00 0.00 O ATOM 913 CB ASP A 62 56.738 -8.415 1.370 1.00 0.00 C ATOM 914 CG ASP A 62 55.883 -7.290 0.797 1.00 0.00 C ATOM 915 OD1 ASP A 62 56.237 -6.779 -0.253 1.00 0.00 O ATOM 916 OD2 ASP A 62 54.887 -6.955 1.416 1.00 0.00 O ATOM 0 H ASP A 62 56.525 -6.504 2.984 1.00 0.00 H new ATOM 0 HA ASP A 62 58.461 -8.606 2.657 1.00 0.00 H new ATOM 0 HB2 ASP A 62 57.093 -9.061 0.567 1.00 0.00 H new ATOM 0 HB3 ASP A 62 56.141 -9.036 2.038 1.00 0.00 H new ATOM 921 N ALA A 63 59.133 -5.865 1.286 1.00 0.00 N ATOM 922 CA ALA A 63 60.048 -5.163 0.387 1.00 0.00 C ATOM 923 C ALA A 63 61.416 -5.834 0.410 1.00 0.00 C ATOM 924 O ALA A 63 62.129 -5.872 -0.594 1.00 0.00 O ATOM 925 CB ALA A 63 60.208 -3.710 0.824 1.00 0.00 C ATOM 0 H ALA A 63 58.726 -5.285 2.020 1.00 0.00 H new ATOM 0 HA ALA A 63 59.634 -5.198 -0.621 1.00 0.00 H new ATOM 0 HB1 ALA A 63 60.892 -3.199 0.146 1.00 0.00 H new ATOM 0 HB2 ALA A 63 59.237 -3.214 0.802 1.00 0.00 H new ATOM 0 HB3 ALA A 63 60.609 -3.677 1.837 1.00 0.00 H new ATOM 931 N VAL A 64 61.765 -6.373 1.575 1.00 0.00 N ATOM 932 CA VAL A 64 63.043 -7.057 1.735 1.00 0.00 C ATOM 933 C VAL A 64 63.039 -8.379 0.968 1.00 0.00 C ATOM 934 O VAL A 64 64.085 -8.867 0.542 1.00 0.00 O ATOM 935 CB VAL A 64 63.321 -7.339 3.216 1.00 0.00 C ATOM 936 CG1 VAL A 64 64.744 -7.878 3.377 1.00 0.00 C ATOM 937 CG2 VAL A 64 63.176 -6.044 4.019 1.00 0.00 C ATOM 0 H VAL A 64 61.186 -6.350 2.415 1.00 0.00 H new ATOM 0 HA VAL A 64 63.824 -6.408 1.338 1.00 0.00 H new ATOM 0 HB VAL A 64 62.608 -8.078 3.582 1.00 0.00 H new ATOM 0 HG11 VAL A 64 64.940 -8.078 4.430 1.00 0.00 H new ATOM 0 HG12 VAL A 64 64.850 -8.801 2.806 1.00 0.00 H new ATOM 0 HG13 VAL A 64 65.457 -7.140 3.009 1.00 0.00 H new ATOM 0 HG21 VAL A 64 63.374 -6.245 5.072 1.00 0.00 H new ATOM 0 HG22 VAL A 64 63.888 -5.306 3.650 1.00 0.00 H new ATOM 0 HG23 VAL A 64 62.163 -5.658 3.907 1.00 0.00 H new ATOM 947 N GLU A 65 61.847 -8.955 0.795 1.00 0.00 N ATOM 948 CA GLU A 65 61.722 -10.218 0.078 1.00 0.00 C ATOM 949 C GLU A 65 62.025 -10.020 -1.403 1.00 0.00 C ATOM 950 O GLU A 65 62.977 -10.585 -1.940 1.00 0.00 O ATOM 951 CB GLU A 65 60.308 -10.781 0.228 1.00 0.00 C ATOM 952 CG GLU A 65 60.262 -12.203 -0.333 1.00 0.00 C ATOM 953 CD GLU A 65 58.855 -12.769 -0.170 1.00 0.00 C ATOM 954 OE1 GLU A 65 58.327 -12.682 0.927 1.00 0.00 O ATOM 955 OE2 GLU A 65 58.327 -13.281 -1.143 1.00 0.00 O ATOM 0 H GLU A 65 60.967 -8.570 1.138 1.00 0.00 H new ATOM 0 HA GLU A 65 62.438 -10.921 0.505 1.00 0.00 H new ATOM 0 HB2 GLU A 65 60.016 -10.784 1.278 1.00 0.00 H new ATOM 0 HB3 GLU A 65 59.595 -10.147 -0.300 1.00 0.00 H new ATOM 0 HG2 GLU A 65 60.544 -12.199 -1.386 1.00 0.00 H new ATOM 0 HG3 GLU A 65 60.982 -12.834 0.188 1.00 0.00 H new ATOM 962 N LYS A 66 61.200 -9.208 -2.057 1.00 0.00 N ATOM 963 CA LYS A 66 61.381 -8.936 -3.481 1.00 0.00 C ATOM 964 C LYS A 66 62.725 -8.255 -3.736 1.00 0.00 C ATOM 965 O LYS A 66 63.308 -8.389 -4.811 1.00 0.00 O ATOM 966 CB LYS A 66 60.261 -8.032 -4.000 1.00 0.00 C ATOM 967 CG LYS A 66 58.911 -8.721 -3.795 1.00 0.00 C ATOM 968 CD LYS A 66 57.801 -7.857 -4.399 1.00 0.00 C ATOM 969 CE LYS A 66 56.606 -8.741 -4.765 1.00 0.00 C ATOM 970 NZ LYS A 66 55.616 -8.722 -3.651 1.00 0.00 N ATOM 0 H LYS A 66 60.406 -8.730 -1.630 1.00 0.00 H new ATOM 0 HA LYS A 66 61.354 -9.890 -4.007 1.00 0.00 H new ATOM 0 HB2 LYS A 66 60.277 -7.077 -3.474 1.00 0.00 H new ATOM 0 HB3 LYS A 66 60.414 -7.816 -5.057 1.00 0.00 H new ATOM 0 HG2 LYS A 66 58.917 -9.705 -4.265 1.00 0.00 H new ATOM 0 HG3 LYS A 66 58.728 -8.877 -2.732 1.00 0.00 H new ATOM 0 HD2 LYS A 66 57.495 -7.090 -3.687 1.00 0.00 H new ATOM 0 HD3 LYS A 66 58.169 -7.341 -5.285 1.00 0.00 H new ATOM 0 HE2 LYS A 66 56.143 -8.383 -5.684 1.00 0.00 H new ATOM 0 HE3 LYS A 66 56.939 -9.762 -4.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 54.804 -9.322 -3.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 56.062 -9.083 -2.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 55.291 -7.747 -3.492 1.00 0.00 H new ATOM 984 N ALA A 67 63.206 -7.516 -2.738 1.00 0.00 N ATOM 985 CA ALA A 67 64.480 -6.811 -2.867 1.00 0.00 C ATOM 986 C ALA A 67 65.620 -7.784 -3.150 1.00 0.00 C ATOM 987 O ALA A 67 66.153 -8.422 -2.242 1.00 0.00 O ATOM 988 CB ALA A 67 64.796 -6.038 -1.586 1.00 0.00 C ATOM 0 H ALA A 67 62.739 -7.390 -1.840 1.00 0.00 H new ATOM 0 HA ALA A 67 64.387 -6.117 -3.703 1.00 0.00 H new ATOM 0 HB1 ALA A 67 65.748 -5.519 -1.700 1.00 0.00 H new ATOM 0 HB2 ALA A 67 64.007 -5.311 -1.396 1.00 0.00 H new ATOM 0 HB3 ALA A 67 64.859 -6.732 -0.748 1.00 0.00 H new ATOM 994 N THR A 68 65.997 -7.880 -4.423 1.00 0.00 N ATOM 995 CA THR A 68 67.089 -8.765 -4.824 1.00 0.00 C ATOM 996 C THR A 68 68.322 -7.938 -5.184 1.00 0.00 C ATOM 997 O THR A 68 69.458 -8.352 -4.955 1.00 0.00 O ATOM 998 CB THR A 68 66.682 -9.622 -6.028 1.00 0.00 C ATOM 999 OG1 THR A 68 67.783 -10.429 -6.424 1.00 0.00 O ATOM 1000 CG2 THR A 68 66.267 -8.720 -7.192 1.00 0.00 C ATOM 0 H THR A 68 65.567 -7.361 -5.189 1.00 0.00 H new ATOM 0 HA THR A 68 67.319 -9.424 -3.987 1.00 0.00 H new ATOM 0 HB THR A 68 65.841 -10.257 -5.750 1.00 0.00 H new ATOM 0 HG1 THR A 68 67.525 -10.979 -7.193 1.00 0.00 H new ATOM 0 HG21 THR A 68 65.979 -9.335 -8.044 1.00 0.00 H new ATOM 0 HG22 THR A 68 65.422 -8.101 -6.889 1.00 0.00 H new ATOM 0 HG23 THR A 68 67.104 -8.080 -7.473 1.00 0.00 H new ATOM 1008 N THR A 69 68.076 -6.753 -5.740 1.00 0.00 N ATOM 1009 CA THR A 69 69.159 -5.850 -6.121 1.00 0.00 C ATOM 1010 C THR A 69 69.161 -4.644 -5.179 1.00 0.00 C ATOM 1011 O THR A 69 68.200 -4.433 -4.440 1.00 0.00 O ATOM 1012 CB THR A 69 68.974 -5.352 -7.571 1.00 0.00 C ATOM 1013 OG1 THR A 69 67.672 -5.691 -8.032 1.00 0.00 O ATOM 1014 CG2 THR A 69 70.017 -5.999 -8.485 1.00 0.00 C ATOM 0 H THR A 69 67.140 -6.397 -5.936 1.00 0.00 H new ATOM 0 HA THR A 69 70.103 -6.390 -6.052 1.00 0.00 H new ATOM 0 HB THR A 69 69.100 -4.269 -7.590 1.00 0.00 H new ATOM 0 HG1 THR A 69 67.557 -5.372 -8.952 1.00 0.00 H new ATOM 0 HG21 THR A 69 69.878 -5.642 -9.505 1.00 0.00 H new ATOM 0 HG22 THR A 69 71.017 -5.735 -8.141 1.00 0.00 H new ATOM 0 HG23 THR A 69 69.900 -7.082 -8.461 1.00 0.00 H new ATOM 1022 N PRO A 70 70.216 -3.817 -5.203 1.00 0.00 N ATOM 1023 CA PRO A 70 70.270 -2.629 -4.337 1.00 0.00 C ATOM 1024 C PRO A 70 69.257 -1.586 -4.786 1.00 0.00 C ATOM 1025 O PRO A 70 68.684 -0.861 -3.974 1.00 0.00 O ATOM 1026 CB PRO A 70 71.704 -2.147 -4.510 1.00 0.00 C ATOM 1027 CG PRO A 70 72.190 -2.705 -5.837 1.00 0.00 C ATOM 1028 CD PRO A 70 71.395 -3.989 -6.085 1.00 0.00 C ATOM 0 HA PRO A 70 70.020 -2.832 -3.296 1.00 0.00 H new ATOM 0 HB2 PRO A 70 71.750 -1.058 -4.507 1.00 0.00 H new ATOM 0 HB3 PRO A 70 72.332 -2.495 -3.690 1.00 0.00 H new ATOM 0 HG2 PRO A 70 72.029 -1.988 -6.642 1.00 0.00 H new ATOM 0 HG3 PRO A 70 73.260 -2.911 -5.803 1.00 0.00 H new ATOM 0 HD2 PRO A 70 71.107 -4.091 -7.131 1.00 0.00 H new ATOM 0 HD3 PRO A 70 71.970 -4.878 -5.824 1.00 0.00 H new ATOM 1036 N ARG A 71 69.016 -1.548 -6.095 1.00 0.00 N ATOM 1037 CA ARG A 71 68.041 -0.621 -6.651 1.00 0.00 C ATOM 1038 C ARG A 71 66.651 -0.931 -6.096 1.00 0.00 C ATOM 1039 O ARG A 71 65.805 -0.045 -5.976 1.00 0.00 O ATOM 1040 CB ARG A 71 68.004 -0.731 -8.177 1.00 0.00 C ATOM 1041 CG ARG A 71 69.361 -0.321 -8.750 1.00 0.00 C ATOM 1042 CD ARG A 71 69.465 1.205 -8.780 1.00 0.00 C ATOM 1043 NE ARG A 71 70.223 1.645 -9.952 1.00 0.00 N ATOM 1044 CZ ARG A 71 70.428 2.943 -10.222 1.00 0.00 C ATOM 1045 NH1 ARG A 71 69.954 3.884 -9.442 1.00 0.00 N ATOM 1046 NH2 ARG A 71 71.114 3.275 -11.282 1.00 0.00 N ATOM 0 H ARG A 71 69.479 -2.143 -6.782 1.00 0.00 H new ATOM 0 HA ARG A 71 68.334 0.391 -6.371 1.00 0.00 H new ATOM 0 HB2 ARG A 71 67.766 -1.753 -8.473 1.00 0.00 H new ATOM 0 HB3 ARG A 71 67.219 -0.091 -8.580 1.00 0.00 H new ATOM 0 HG2 ARG A 71 70.165 -0.739 -8.143 1.00 0.00 H new ATOM 0 HG3 ARG A 71 69.479 -0.724 -9.756 1.00 0.00 H new ATOM 0 HD2 ARG A 71 68.467 1.643 -8.800 1.00 0.00 H new ATOM 0 HD3 ARG A 71 69.951 1.560 -7.871 1.00 0.00 H new ATOM 0 HE ARG A 71 70.608 0.942 -10.584 1.00 0.00 H new ATOM 0 HH11 ARG A 71 69.417 3.635 -8.611 1.00 0.00 H new ATOM 0 HH12 ARG A 71 70.122 4.865 -9.666 1.00 0.00 H new ATOM 0 HH21 ARG A 71 71.488 2.551 -11.895 1.00 0.00 H new ATOM 0 HH22 ARG A 71 71.276 4.259 -11.497 1.00 0.00 H new ATOM 1060 N ALA A 72 66.429 -2.202 -5.747 1.00 0.00 N ATOM 1061 CA ALA A 72 65.142 -2.611 -5.195 1.00 0.00 C ATOM 1062 C ALA A 72 64.930 -1.948 -3.843 1.00 0.00 C ATOM 1063 O ALA A 72 63.954 -1.227 -3.631 1.00 0.00 O ATOM 1064 CB ALA A 72 65.084 -4.128 -5.023 1.00 0.00 C ATOM 0 H ALA A 72 67.114 -2.952 -5.836 1.00 0.00 H new ATOM 0 HA ALA A 72 64.359 -2.304 -5.888 1.00 0.00 H new ATOM 0 HB1 ALA A 72 64.116 -4.411 -4.610 1.00 0.00 H new ATOM 0 HB2 ALA A 72 65.220 -4.609 -5.991 1.00 0.00 H new ATOM 0 HB3 ALA A 72 65.875 -4.448 -4.345 1.00 0.00 H new ATOM 1070 N LEU A 73 65.871 -2.190 -2.930 1.00 0.00 N ATOM 1071 CA LEU A 73 65.802 -1.599 -1.591 1.00 0.00 C ATOM 1072 C LEU A 73 65.667 -0.083 -1.691 1.00 0.00 C ATOM 1073 O LEU A 73 64.830 0.528 -1.027 1.00 0.00 O ATOM 1074 CB LEU A 73 67.064 -1.922 -0.789 1.00 0.00 C ATOM 1075 CG LEU A 73 67.418 -3.407 -0.701 1.00 0.00 C ATOM 1076 CD1 LEU A 73 68.800 -3.563 -0.063 1.00 0.00 C ATOM 1077 CD2 LEU A 73 66.377 -4.128 0.158 1.00 0.00 C ATOM 0 H LEU A 73 66.684 -2.786 -3.090 1.00 0.00 H new ATOM 0 HA LEU A 73 64.933 -2.020 -1.086 1.00 0.00 H new ATOM 0 HB2 LEU A 73 67.905 -1.391 -1.235 1.00 0.00 H new ATOM 0 HB3 LEU A 73 66.942 -1.534 0.222 1.00 0.00 H new ATOM 0 HG LEU A 73 67.427 -3.839 -1.702 1.00 0.00 H new ATOM 0 HD11 LEU A 73 69.054 -4.621 0.001 1.00 0.00 H new ATOM 0 HD12 LEU A 73 69.542 -3.048 -0.672 1.00 0.00 H new ATOM 0 HD13 LEU A 73 68.789 -3.132 0.938 1.00 0.00 H new ATOM 0 HD21 LEU A 73 66.628 -5.187 0.222 1.00 0.00 H new ATOM 0 HD22 LEU A 73 66.369 -3.696 1.159 1.00 0.00 H new ATOM 0 HD23 LEU A 73 65.391 -4.015 -0.294 1.00 0.00 H new ATOM 1089 N ILE A 74 66.496 0.511 -2.547 1.00 0.00 N ATOM 1090 CA ILE A 74 66.458 1.958 -2.749 1.00 0.00 C ATOM 1091 C ILE A 74 65.094 2.364 -3.301 1.00 0.00 C ATOM 1092 O ILE A 74 64.545 3.401 -2.937 1.00 0.00 O ATOM 1093 CB ILE A 74 67.557 2.399 -3.728 1.00 0.00 C ATOM 1094 CG1 ILE A 74 68.925 1.972 -3.191 1.00 0.00 C ATOM 1095 CG2 ILE A 74 67.538 3.924 -3.886 1.00 0.00 C ATOM 1096 CD1 ILE A 74 69.939 1.945 -4.338 1.00 0.00 C ATOM 0 H ILE A 74 67.194 0.020 -3.106 1.00 0.00 H new ATOM 0 HA ILE A 74 66.628 2.446 -1.789 1.00 0.00 H new ATOM 0 HB ILE A 74 67.375 1.931 -4.695 1.00 0.00 H new ATOM 0 HG12 ILE A 74 69.255 2.664 -2.416 1.00 0.00 H new ATOM 0 HG13 ILE A 74 68.855 0.987 -2.730 1.00 0.00 H new ATOM 0 HG21 ILE A 74 68.320 4.227 -4.582 1.00 0.00 H new ATOM 0 HG22 ILE A 74 66.568 4.238 -4.271 1.00 0.00 H new ATOM 0 HG23 ILE A 74 67.712 4.392 -2.917 1.00 0.00 H new ATOM 0 HD11 ILE A 74 70.913 1.641 -3.955 1.00 0.00 H new ATOM 0 HD12 ILE A 74 69.610 1.236 -5.098 1.00 0.00 H new ATOM 0 HD13 ILE A 74 70.016 2.939 -4.779 1.00 0.00 H new ATOM 1108 N GLU A 75 64.551 1.528 -4.179 1.00 0.00 N ATOM 1109 CA GLU A 75 63.247 1.810 -4.769 1.00 0.00 C ATOM 1110 C GLU A 75 62.179 1.841 -3.685 1.00 0.00 C ATOM 1111 O GLU A 75 61.340 2.741 -3.642 1.00 0.00 O ATOM 1112 CB GLU A 75 62.882 0.742 -5.802 1.00 0.00 C ATOM 1113 CG GLU A 75 63.374 1.179 -7.184 1.00 0.00 C ATOM 1114 CD GLU A 75 62.523 2.341 -7.684 1.00 0.00 C ATOM 1115 OE1 GLU A 75 61.510 2.080 -8.312 1.00 0.00 O ATOM 1116 OE2 GLU A 75 62.896 3.475 -7.432 1.00 0.00 O ATOM 0 H GLU A 75 64.986 0.661 -4.495 1.00 0.00 H new ATOM 0 HA GLU A 75 63.299 2.781 -5.261 1.00 0.00 H new ATOM 0 HB2 GLU A 75 63.332 -0.212 -5.529 1.00 0.00 H new ATOM 0 HB3 GLU A 75 61.803 0.592 -5.819 1.00 0.00 H new ATOM 0 HG2 GLU A 75 64.421 1.478 -7.131 1.00 0.00 H new ATOM 0 HG3 GLU A 75 63.316 0.345 -7.883 1.00 0.00 H new ATOM 1123 N MET A 76 62.228 0.850 -2.805 1.00 0.00 N ATOM 1124 CA MET A 76 61.271 0.764 -1.715 1.00 0.00 C ATOM 1125 C MET A 76 61.544 1.856 -0.684 1.00 0.00 C ATOM 1126 O MET A 76 60.621 2.425 -0.100 1.00 0.00 O ATOM 1127 CB MET A 76 61.369 -0.600 -1.035 1.00 0.00 C ATOM 1128 CG MET A 76 61.130 -1.704 -2.068 1.00 0.00 C ATOM 1129 SD MET A 76 59.377 -1.735 -2.521 1.00 0.00 S ATOM 1130 CE MET A 76 59.481 -3.075 -3.733 1.00 0.00 C ATOM 0 H MET A 76 62.918 0.099 -2.826 1.00 0.00 H new ATOM 0 HA MET A 76 60.270 0.896 -2.126 1.00 0.00 H new ATOM 0 HB2 MET A 76 62.351 -0.721 -0.579 1.00 0.00 H new ATOM 0 HB3 MET A 76 60.634 -0.672 -0.233 1.00 0.00 H new ATOM 0 HG2 MET A 76 61.742 -1.528 -2.952 1.00 0.00 H new ATOM 0 HG3 MET A 76 61.429 -2.670 -1.660 1.00 0.00 H new ATOM 0 HE1 MET A 76 58.492 -3.267 -4.149 1.00 0.00 H new ATOM 0 HE2 MET A 76 60.163 -2.789 -4.534 1.00 0.00 H new ATOM 0 HE3 MET A 76 59.851 -3.978 -3.247 1.00 0.00 H new ATOM 1140 N THR A 77 62.828 2.141 -0.467 1.00 0.00 N ATOM 1141 CA THR A 77 63.213 3.165 0.497 1.00 0.00 C ATOM 1142 C THR A 77 62.888 4.558 -0.036 1.00 0.00 C ATOM 1143 O THR A 77 62.561 5.465 0.724 1.00 0.00 O ATOM 1144 CB THR A 77 64.713 3.085 0.801 1.00 0.00 C ATOM 1145 OG1 THR A 77 65.054 1.745 1.127 1.00 0.00 O ATOM 1146 CG2 THR A 77 65.056 3.998 1.983 1.00 0.00 C ATOM 0 H THR A 77 63.607 1.683 -0.939 1.00 0.00 H new ATOM 0 HA THR A 77 62.648 2.987 1.412 1.00 0.00 H new ATOM 0 HB THR A 77 65.275 3.407 -0.075 1.00 0.00 H new ATOM 0 HG1 THR A 77 65.193 1.233 0.303 1.00 0.00 H new ATOM 0 HG21 THR A 77 66.124 3.936 2.193 1.00 0.00 H new ATOM 0 HG22 THR A 77 64.794 5.027 1.736 1.00 0.00 H new ATOM 0 HG23 THR A 77 64.494 3.682 2.862 1.00 0.00 H new ATOM 1154 N ASN A 78 62.980 4.719 -1.352 1.00 0.00 N ATOM 1155 CA ASN A 78 62.691 6.010 -1.967 1.00 0.00 C ATOM 1156 C ASN A 78 61.189 6.187 -2.152 1.00 0.00 C ATOM 1157 O ASN A 78 60.664 7.292 -2.049 1.00 0.00 O ATOM 1158 CB ASN A 78 63.364 6.119 -3.335 1.00 0.00 C ATOM 1159 CG ASN A 78 64.820 6.530 -3.157 1.00 0.00 C ATOM 1160 OD1 ASN A 78 65.212 7.637 -3.522 1.00 0.00 O ATOM 1161 ND2 ASN A 78 65.653 5.700 -2.607 1.00 0.00 N ATOM 0 H ASN A 78 63.248 3.983 -2.006 1.00 0.00 H new ATOM 0 HA ASN A 78 63.077 6.785 -1.306 1.00 0.00 H new ATOM 0 HB2 ASN A 78 63.306 5.164 -3.857 1.00 0.00 H new ATOM 0 HB3 ASN A 78 62.842 6.851 -3.951 1.00 0.00 H new ATOM 0 HD21 ASN A 78 66.629 5.967 -2.479 1.00 0.00 H new ATOM 0 HD22 ASN A 78 65.331 4.781 -2.303 1.00 0.00 H new ATOM 1168 N ALA A 79 60.514 5.079 -2.434 1.00 0.00 N ATOM 1169 CA ALA A 79 59.071 5.100 -2.647 1.00 0.00 C ATOM 1170 C ALA A 79 58.341 5.542 -1.387 1.00 0.00 C ATOM 1171 O ALA A 79 57.349 6.269 -1.447 1.00 0.00 O ATOM 1172 CB ALA A 79 58.573 3.711 -3.046 1.00 0.00 C ATOM 0 H ALA A 79 60.941 4.157 -2.520 1.00 0.00 H new ATOM 0 HA ALA A 79 58.865 5.810 -3.448 1.00 0.00 H new ATOM 0 HB1 ALA A 79 57.495 3.742 -3.202 1.00 0.00 H new ATOM 0 HB2 ALA A 79 59.064 3.399 -3.968 1.00 0.00 H new ATOM 0 HB3 ALA A 79 58.805 3.000 -2.253 1.00 0.00 H new ATOM 1178 N SER A 80 58.839 5.092 -0.243 1.00 0.00 N ATOM 1179 CA SER A 80 58.223 5.444 1.024 1.00 0.00 C ATOM 1180 C SER A 80 58.621 6.861 1.422 1.00 0.00 C ATOM 1181 O SER A 80 57.794 7.647 1.886 1.00 0.00 O ATOM 1182 CB SER A 80 58.632 4.443 2.113 1.00 0.00 C ATOM 1183 OG SER A 80 59.818 4.879 2.766 1.00 0.00 O ATOM 0 H SER A 80 59.659 4.489 -0.168 1.00 0.00 H new ATOM 0 HA SER A 80 57.139 5.404 0.912 1.00 0.00 H new ATOM 0 HB2 SER A 80 57.827 4.337 2.840 1.00 0.00 H new ATOM 0 HB3 SER A 80 58.793 3.460 1.671 1.00 0.00 H new ATOM 0 HG SER A 80 59.604 5.160 3.680 1.00 0.00 H new ATOM 1189 N LEU A 81 59.896 7.181 1.226 1.00 0.00 N ATOM 1190 CA LEU A 81 60.394 8.507 1.556 1.00 0.00 C ATOM 1191 C LEU A 81 59.731 9.561 0.677 1.00 0.00 C ATOM 1192 O LEU A 81 59.231 10.572 1.171 1.00 0.00 O ATOM 1193 CB LEU A 81 61.911 8.560 1.355 1.00 0.00 C ATOM 1194 CG LEU A 81 62.777 7.994 2.499 1.00 0.00 C ATOM 1195 CD1 LEU A 81 62.061 6.858 3.247 1.00 0.00 C ATOM 1196 CD2 LEU A 81 64.090 7.464 1.920 1.00 0.00 C ATOM 0 H LEU A 81 60.596 6.545 0.844 1.00 0.00 H new ATOM 0 HA LEU A 81 60.156 8.714 2.599 1.00 0.00 H new ATOM 0 HB2 LEU A 81 62.153 8.016 0.442 1.00 0.00 H new ATOM 0 HB3 LEU A 81 62.197 9.599 1.192 1.00 0.00 H new ATOM 0 HG LEU A 81 62.966 8.799 3.209 1.00 0.00 H new ATOM 0 HD11 LEU A 81 62.704 6.486 4.045 1.00 0.00 H new ATOM 0 HD12 LEU A 81 61.131 7.233 3.675 1.00 0.00 H new ATOM 0 HD13 LEU A 81 61.840 6.048 2.552 1.00 0.00 H new ATOM 0 HD21 LEU A 81 64.707 7.063 2.724 1.00 0.00 H new ATOM 0 HD22 LEU A 81 63.877 6.676 1.198 1.00 0.00 H new ATOM 0 HD23 LEU A 81 64.623 8.276 1.425 1.00 0.00 H new ATOM 1208 N THR A 82 59.730 9.317 -0.630 1.00 0.00 N ATOM 1209 CA THR A 82 59.121 10.264 -1.565 1.00 0.00 C ATOM 1210 C THR A 82 57.627 10.422 -1.269 1.00 0.00 C ATOM 1211 O THR A 82 57.064 11.508 -1.404 1.00 0.00 O ATOM 1212 CB THR A 82 59.315 9.809 -3.022 1.00 0.00 C ATOM 1213 OG1 THR A 82 58.823 10.814 -3.895 1.00 0.00 O ATOM 1214 CG2 THR A 82 58.563 8.498 -3.284 1.00 0.00 C ATOM 0 H THR A 82 60.136 8.487 -1.063 1.00 0.00 H new ATOM 0 HA THR A 82 59.617 11.225 -1.434 1.00 0.00 H new ATOM 0 HB THR A 82 60.378 9.644 -3.200 1.00 0.00 H new ATOM 0 HG1 THR A 82 58.946 10.529 -4.824 1.00 0.00 H new ATOM 0 HG21 THR A 82 58.713 8.193 -4.320 1.00 0.00 H new ATOM 0 HG22 THR A 82 58.942 7.722 -2.619 1.00 0.00 H new ATOM 0 HG23 THR A 82 57.499 8.646 -3.100 1.00 0.00 H new ATOM 1222 N GLY A 83 56.997 9.322 -0.864 1.00 0.00 N ATOM 1223 CA GLY A 83 55.570 9.346 -0.551 1.00 0.00 C ATOM 1224 C GLY A 83 55.285 10.279 0.621 1.00 0.00 C ATOM 1225 O GLY A 83 54.574 11.275 0.482 1.00 0.00 O ATOM 0 H GLY A 83 57.445 8.413 -0.746 1.00 0.00 H new ATOM 0 HA2 GLY A 83 55.007 9.672 -1.426 1.00 0.00 H new ATOM 0 HA3 GLY A 83 55.230 8.339 -0.310 1.00 0.00 H new ATOM 1229 N ALA A 84 55.849 9.945 1.778 1.00 0.00 N ATOM 1230 CA ALA A 84 55.650 10.759 2.975 1.00 0.00 C ATOM 1231 C ALA A 84 56.196 12.167 2.763 1.00 0.00 C ATOM 1232 O ALA A 84 55.629 13.148 3.243 1.00 0.00 O ATOM 1233 CB ALA A 84 56.356 10.126 4.175 1.00 0.00 C ATOM 0 H ALA A 84 56.441 9.126 1.913 1.00 0.00 H new ATOM 0 HA ALA A 84 54.579 10.812 3.170 1.00 0.00 H new ATOM 0 HB1 ALA A 84 56.198 10.745 5.058 1.00 0.00 H new ATOM 0 HB2 ALA A 84 55.950 9.130 4.352 1.00 0.00 H new ATOM 0 HB3 ALA A 84 57.424 10.051 3.971 1.00 0.00 H new ATOM 1239 N SER A 85 57.307 12.253 2.038 1.00 0.00 N ATOM 1240 CA SER A 85 57.929 13.546 1.764 1.00 0.00 C ATOM 1241 C SER A 85 57.854 13.871 0.268 1.00 0.00 C ATOM 1242 O SER A 85 58.731 13.472 -0.499 1.00 0.00 O ATOM 1243 CB SER A 85 59.395 13.534 2.195 1.00 0.00 C ATOM 1244 OG SER A 85 59.488 13.932 3.557 1.00 0.00 O ATOM 0 H SER A 85 57.792 11.452 1.633 1.00 0.00 H new ATOM 0 HA SER A 85 57.388 14.306 2.329 1.00 0.00 H new ATOM 0 HB2 SER A 85 59.816 12.537 2.066 1.00 0.00 H new ATOM 0 HB3 SER A 85 59.976 14.209 1.567 1.00 0.00 H new ATOM 0 HG SER A 85 59.904 14.817 3.611 1.00 0.00 H new ATOM 1250 N PRO A 86 56.812 14.598 -0.176 1.00 0.00 N ATOM 1251 CA PRO A 86 56.665 14.956 -1.598 1.00 0.00 C ATOM 1252 C PRO A 86 57.518 16.160 -1.990 1.00 0.00 C ATOM 1253 O PRO A 86 57.928 16.300 -3.142 1.00 0.00 O ATOM 1254 CB PRO A 86 55.180 15.286 -1.701 1.00 0.00 C ATOM 1255 CG PRO A 86 54.712 15.676 -0.304 1.00 0.00 C ATOM 1256 CD PRO A 86 55.725 15.108 0.695 1.00 0.00 C ATOM 0 HA PRO A 86 56.994 14.161 -2.267 1.00 0.00 H new ATOM 0 HB2 PRO A 86 55.014 16.102 -2.405 1.00 0.00 H new ATOM 0 HB3 PRO A 86 54.619 14.427 -2.070 1.00 0.00 H new ATOM 0 HG2 PRO A 86 54.647 16.760 -0.210 1.00 0.00 H new ATOM 0 HG3 PRO A 86 53.716 15.279 -0.108 1.00 0.00 H new ATOM 0 HD2 PRO A 86 56.085 15.874 1.382 1.00 0.00 H new ATOM 0 HD3 PRO A 86 55.290 14.314 1.302 1.00 0.00 H new ATOM 1264 N SER A 87 57.781 17.027 -1.016 1.00 0.00 N ATOM 1265 CA SER A 87 58.589 18.217 -1.266 1.00 0.00 C ATOM 1266 C SER A 87 60.014 17.822 -1.641 1.00 0.00 C ATOM 1267 O SER A 87 60.672 18.496 -2.433 1.00 0.00 O ATOM 1268 CB SER A 87 58.629 19.107 -0.024 1.00 0.00 C ATOM 1269 OG SER A 87 57.530 20.009 -0.057 1.00 0.00 O ATOM 0 H SER A 87 57.450 16.930 -0.056 1.00 0.00 H new ATOM 0 HA SER A 87 58.135 18.766 -2.090 1.00 0.00 H new ATOM 0 HB2 SER A 87 58.586 18.496 0.877 1.00 0.00 H new ATOM 0 HB3 SER A 87 59.568 19.660 0.011 1.00 0.00 H new ATOM 0 HG SER A 87 57.552 20.580 0.739 1.00 0.00 H new ATOM 1275 N ALA A 88 60.480 16.718 -1.062 1.00 0.00 N ATOM 1276 CA ALA A 88 61.832 16.233 -1.339 1.00 0.00 C ATOM 1277 C ALA A 88 62.869 17.273 -0.928 1.00 0.00 C ATOM 1278 O ALA A 88 62.567 18.462 -0.816 1.00 0.00 O ATOM 1279 CB ALA A 88 61.999 15.923 -2.827 1.00 0.00 C ATOM 0 H ALA A 88 59.949 16.147 -0.405 1.00 0.00 H new ATOM 0 HA ALA A 88 61.984 15.322 -0.761 1.00 0.00 H new ATOM 0 HB1 ALA A 88 63.011 15.564 -3.012 1.00 0.00 H new ATOM 0 HB2 ALA A 88 61.282 15.157 -3.122 1.00 0.00 H new ATOM 0 HB3 ALA A 88 61.823 16.828 -3.409 1.00 0.00 H new ATOM 1285 N GLY A 89 64.096 16.812 -0.706 1.00 0.00 N ATOM 1286 CA GLY A 89 65.177 17.708 -0.308 1.00 0.00 C ATOM 1287 C GLY A 89 66.013 18.116 -1.516 1.00 0.00 C ATOM 1288 O GLY A 89 66.550 19.223 -1.573 1.00 0.00 O ATOM 0 H GLY A 89 64.366 15.832 -0.794 1.00 0.00 H new ATOM 0 HA2 GLY A 89 64.763 18.596 0.170 1.00 0.00 H new ATOM 0 HA3 GLY A 89 65.811 17.216 0.429 1.00 0.00 H new ATOM 1292 N GLY A 90 66.118 17.208 -2.482 1.00 0.00 N ATOM 1293 CA GLY A 90 66.893 17.481 -3.689 1.00 0.00 C ATOM 1294 C GLY A 90 66.113 18.382 -4.641 1.00 0.00 C ATOM 1295 O GLY A 90 66.185 19.608 -4.556 1.00 0.00 O ATOM 0 H GLY A 90 65.682 16.286 -2.454 1.00 0.00 H new ATOM 0 HA2 GLY A 90 67.836 17.957 -3.421 1.00 0.00 H new ATOM 0 HA3 GLY A 90 67.140 16.544 -4.188 1.00 0.00 H new ATOM 1299 N ALA A 91 65.367 17.760 -5.548 1.00 0.00 N ATOM 1300 CA ALA A 91 64.574 18.514 -6.515 1.00 0.00 C ATOM 1301 C ALA A 91 63.668 17.576 -7.308 1.00 0.00 C ATOM 1302 O ALA A 91 64.022 16.429 -7.578 1.00 0.00 O ATOM 1303 CB ALA A 91 65.485 19.265 -7.486 1.00 0.00 C ATOM 0 H ALA A 91 65.294 16.746 -5.635 1.00 0.00 H new ATOM 0 HA ALA A 91 63.964 19.230 -5.964 1.00 0.00 H new ATOM 0 HB1 ALA A 91 64.877 19.821 -8.199 1.00 0.00 H new ATOM 0 HB2 ALA A 91 66.117 19.958 -6.930 1.00 0.00 H new ATOM 0 HB3 ALA A 91 66.112 18.552 -8.022 1.00 0.00 H new ATOM 1309 N ALA A 92 62.494 18.081 -7.678 1.00 0.00 N ATOM 1310 CA ALA A 92 61.540 17.281 -8.441 1.00 0.00 C ATOM 1311 C ALA A 92 60.485 18.180 -9.081 1.00 0.00 C ATOM 1312 O ALA A 92 60.240 19.296 -8.623 1.00 0.00 O ATOM 1313 CB ALA A 92 60.845 16.265 -7.534 1.00 0.00 C ATOM 0 H ALA A 92 62.183 19.029 -7.465 1.00 0.00 H new ATOM 0 HA ALA A 92 62.090 16.753 -9.220 1.00 0.00 H new ATOM 0 HB1 ALA A 92 60.138 15.678 -8.120 1.00 0.00 H new ATOM 0 HB2 ALA A 92 61.589 15.602 -7.093 1.00 0.00 H new ATOM 0 HB3 ALA A 92 60.312 16.790 -6.741 1.00 0.00 H new ATOM 1319 N ARG A 93 59.864 17.677 -10.143 1.00 0.00 N ATOM 1320 CA ARG A 93 58.834 18.440 -10.842 1.00 0.00 C ATOM 1321 C ARG A 93 57.449 17.891 -10.516 1.00 0.00 C ATOM 1322 O ARG A 93 56.953 16.980 -11.179 1.00 0.00 O ATOM 1323 CB ARG A 93 59.051 18.373 -12.356 1.00 0.00 C ATOM 1324 CG ARG A 93 60.419 18.964 -12.702 1.00 0.00 C ATOM 1325 CD ARG A 93 61.477 17.859 -12.663 1.00 0.00 C ATOM 1326 NE ARG A 93 62.605 18.194 -13.536 1.00 0.00 N ATOM 1327 CZ ARG A 93 62.531 18.086 -14.870 1.00 0.00 C ATOM 1328 NH1 ARG A 93 61.434 17.673 -15.460 1.00 0.00 N ATOM 1329 NH2 ARG A 93 63.569 18.398 -15.596 1.00 0.00 N ATOM 0 H ARG A 93 60.052 16.755 -10.536 1.00 0.00 H new ATOM 0 HA ARG A 93 58.902 19.476 -10.510 1.00 0.00 H new ATOM 0 HB2 ARG A 93 58.993 17.339 -12.697 1.00 0.00 H new ATOM 0 HB3 ARG A 93 58.264 18.924 -12.872 1.00 0.00 H new ATOM 0 HG2 ARG A 93 60.390 19.420 -13.692 1.00 0.00 H new ATOM 0 HG3 ARG A 93 60.676 19.753 -11.995 1.00 0.00 H new ATOM 0 HD2 ARG A 93 61.830 17.722 -11.641 1.00 0.00 H new ATOM 0 HD3 ARG A 93 61.035 16.914 -12.978 1.00 0.00 H new ATOM 0 HE ARG A 93 63.475 18.520 -13.115 1.00 0.00 H new ATOM 0 HH11 ARG A 93 60.616 17.427 -14.902 1.00 0.00 H new ATOM 0 HH12 ARG A 93 61.399 17.598 -16.477 1.00 0.00 H new ATOM 0 HH21 ARG A 93 64.427 18.721 -15.148 1.00 0.00 H new ATOM 0 HH22 ARG A 93 63.523 18.319 -16.612 1.00 0.00 H new ATOM 1343 N ASP A 94 56.830 18.455 -9.481 1.00 0.00 N ATOM 1344 CA ASP A 94 55.500 18.016 -9.070 1.00 0.00 C ATOM 1345 C ASP A 94 54.436 18.966 -9.607 1.00 0.00 C ATOM 1346 O ASP A 94 53.365 18.542 -10.040 1.00 0.00 O ATOM 1347 CB ASP A 94 55.401 17.969 -7.543 1.00 0.00 C ATOM 1348 CG ASP A 94 54.119 17.250 -7.139 1.00 0.00 C ATOM 1349 OD1 ASP A 94 53.856 16.193 -7.689 1.00 0.00 O ATOM 1350 OD2 ASP A 94 53.418 17.767 -6.285 1.00 0.00 O ATOM 0 H ASP A 94 57.223 19.209 -8.917 1.00 0.00 H new ATOM 0 HA ASP A 94 55.334 17.018 -9.476 1.00 0.00 H new ATOM 0 HB2 ASP A 94 56.266 17.453 -7.127 1.00 0.00 H new ATOM 0 HB3 ASP A 94 55.407 18.980 -7.136 1.00 0.00 H new ATOM 1355 N LYS A 95 54.744 20.260 -9.574 1.00 0.00 N ATOM 1356 CA LYS A 95 53.806 21.269 -10.060 1.00 0.00 C ATOM 1357 C LYS A 95 54.560 22.493 -10.572 1.00 0.00 C ATOM 1358 O LYS A 95 54.158 23.027 -11.592 1.00 0.00 O ATOM 1359 CB LYS A 95 52.856 21.702 -8.942 1.00 0.00 C ATOM 1360 CG LYS A 95 51.541 22.191 -9.549 1.00 0.00 C ATOM 1361 CD LYS A 95 50.466 22.250 -8.461 1.00 0.00 C ATOM 1362 CE LYS A 95 49.172 22.813 -9.051 1.00 0.00 C ATOM 1363 NZ LYS A 95 48.413 21.718 -9.717 1.00 0.00 N ATOM 1364 OXT LYS A 95 55.529 22.875 -9.937 1.00 0.00 O ATOM 0 H LYS A 95 55.625 20.632 -9.220 1.00 0.00 H new ATOM 0 HA LYS A 95 53.230 20.828 -10.874 1.00 0.00 H new ATOM 0 HB2 LYS A 95 52.669 20.867 -8.266 1.00 0.00 H new ATOM 0 HB3 LYS A 95 53.312 22.495 -8.350 1.00 0.00 H new ATOM 0 HG2 LYS A 95 51.678 23.177 -9.993 1.00 0.00 H new ATOM 0 HG3 LYS A 95 51.227 21.521 -10.350 1.00 0.00 H new ATOM 0 HD2 LYS A 95 50.290 21.254 -8.055 1.00 0.00 H new ATOM 0 HD3 LYS A 95 50.804 22.876 -7.635 1.00 0.00 H new ATOM 0 HE2 LYS A 95 48.567 23.263 -8.264 1.00 0.00 H new ATOM 0 HE3 LYS A 95 49.400 23.601 -9.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 47.533 22.100 -10.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 48.991 21.308 -10.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 48.184 20.981 -9.020 1.00 0.00 H new TER 1378 LYS A 95