USER MOD reduce.3.24.130724 H: found=0, std=0, add=740, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 738 hydrogens (10 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 14 SER OG : rot 180:sc= 0.565 USER MOD Set 1.2: A 113 ASN : amide:sc= 1.3 K(o=1.9,f=0.76) USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 THR OG1 : rot 180:sc= -0.0918 USER MOD Single : A 6 THR OG1 : rot 56:sc= 1.32 USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 177:sc= -0.861 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 84:sc= 1.29 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 GLN : amide:sc= -0.389 X(o=-0.39,f=-0.075) USER MOD Single : A 30 THR OG1 : rot 73:sc= -0.497 USER MOD Single : A 32 TYR OH : rot 180:sc= 0.256 USER MOD Single : A 36 GLN : amide:sc= -1.86! C(o=-1.9!,f=-7.2!) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0.0855 USER MOD Single : A 48 ASN : amide:sc= -2.87! C(o=-2.9!,f=-10!) USER MOD Single : A 53 SER OG : rot 180:sc= -0.0319 USER MOD Single : A 54 SER OG : rot -71:sc= 1.3 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 ASN : amide:sc= 1.19 K(o=1.2,f=-0.16) USER MOD Single : A 62 SER OG : rot 57:sc= 1.28 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 180:sc=-0.00325 USER MOD Single : A 66 SER OG : rot 180:sc= -0.0127 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot -89:sc= 1.23 USER MOD Single : A 81 THR OG1 : rot 180:sc= -0.229 USER MOD Single : A 85 THR OG1 : rot 180:sc= 0.00998 USER MOD Single : A 89 THR OG1 : rot 180:sc= -0.0549 USER MOD Single : A 90 THR OG1 : rot -38:sc= 0.759 USER MOD Single : A 94 GLN :FLIP amide:sc= -0.813 F(o=-1.5,f=-0.81) USER MOD Single : A 98 SER OG : rot 124:sc= 0.0813 USER MOD Single : A 103 ASN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 111 SER OG : rot 2:sc= 0.432 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -16.729 4.473 16.483 1.00 0.00 N ATOM 2 CA ALA A 1 -16.902 3.873 15.145 1.00 0.00 C ATOM 3 C ALA A 1 -15.753 2.932 14.822 1.00 0.00 C ATOM 4 O ALA A 1 -14.645 3.370 14.504 1.00 0.00 O ATOM 5 CB ALA A 1 -17.001 4.959 14.087 1.00 0.00 C ATOM 0 H1 ALA A 1 -17.525 5.112 16.683 1.00 0.00 H new ATOM 0 H2 ALA A 1 -16.701 3.720 17.200 1.00 0.00 H new ATOM 0 H3 ALA A 1 -15.839 5.010 16.510 1.00 0.00 H new ATOM 0 HA ALA A 1 -17.828 3.298 15.148 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -17.128 4.501 13.106 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -17.856 5.600 14.302 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -16.090 5.557 14.093 1.00 0.00 H new ATOM 11 N ALA A 2 -16.015 1.638 14.912 1.00 0.00 N ATOM 12 CA ALA A 2 -15.003 0.637 14.618 1.00 0.00 C ATOM 13 C ALA A 2 -15.149 0.153 13.181 1.00 0.00 C ATOM 14 O ALA A 2 -16.134 -0.503 12.839 1.00 0.00 O ATOM 15 CB ALA A 2 -15.110 -0.525 15.594 1.00 0.00 C ATOM 0 H ALA A 2 -16.920 1.256 15.186 1.00 0.00 H new ATOM 0 HA ALA A 2 -14.016 1.086 14.732 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -14.346 -1.267 15.362 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -14.965 -0.161 16.611 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -16.096 -0.981 15.510 1.00 0.00 H new ATOM 21 N PRO A 3 -14.177 0.489 12.316 1.00 0.00 N ATOM 22 CA PRO A 3 -14.202 0.092 10.906 1.00 0.00 C ATOM 23 C PRO A 3 -13.862 -1.383 10.713 1.00 0.00 C ATOM 24 O PRO A 3 -13.521 -2.084 11.670 1.00 0.00 O ATOM 25 CB PRO A 3 -13.129 0.980 10.276 1.00 0.00 C ATOM 26 CG PRO A 3 -12.163 1.244 11.377 1.00 0.00 C ATOM 27 CD PRO A 3 -12.974 1.280 12.645 1.00 0.00 C ATOM 0 HA PRO A 3 -15.190 0.212 10.461 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -12.645 0.481 9.436 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -13.556 1.907 9.893 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -11.402 0.465 11.423 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -11.642 2.189 11.220 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -12.427 0.847 13.482 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -13.231 2.301 12.927 1.00 0.00 H new ATOM 35 N THR A 4 -13.953 -1.848 9.477 1.00 0.00 N ATOM 36 CA THR A 4 -13.652 -3.232 9.163 1.00 0.00 C ATOM 37 C THR A 4 -12.490 -3.328 8.175 1.00 0.00 C ATOM 38 O THR A 4 -12.686 -3.280 6.958 1.00 0.00 O ATOM 39 CB THR A 4 -14.881 -3.950 8.572 1.00 0.00 C ATOM 40 OG1 THR A 4 -16.013 -3.067 8.561 1.00 0.00 O ATOM 41 CG2 THR A 4 -15.218 -5.198 9.374 1.00 0.00 C ATOM 0 H THR A 4 -14.234 -1.284 8.675 1.00 0.00 H new ATOM 0 HA THR A 4 -13.371 -3.720 10.096 1.00 0.00 H new ATOM 0 HB THR A 4 -14.641 -4.245 7.551 1.00 0.00 H new ATOM 0 HG1 THR A 4 -16.788 -3.533 8.182 1.00 0.00 H new ATOM 0 HG21 THR A 4 -16.089 -5.687 8.937 1.00 0.00 H new ATOM 0 HG22 THR A 4 -14.370 -5.883 9.355 1.00 0.00 H new ATOM 0 HG23 THR A 4 -15.437 -4.920 10.405 1.00 0.00 H new ATOM 49 N ALA A 5 -11.278 -3.438 8.702 1.00 0.00 N ATOM 50 CA ALA A 5 -10.091 -3.550 7.865 1.00 0.00 C ATOM 51 C ALA A 5 -9.872 -5.006 7.460 1.00 0.00 C ATOM 52 O ALA A 5 -9.089 -5.728 8.082 1.00 0.00 O ATOM 53 CB ALA A 5 -8.870 -2.999 8.589 1.00 0.00 C ATOM 0 H ALA A 5 -11.091 -3.452 9.705 1.00 0.00 H new ATOM 0 HA ALA A 5 -10.241 -2.958 6.962 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -7.994 -3.092 7.947 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -9.033 -1.949 8.830 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -8.708 -3.562 9.508 1.00 0.00 H new ATOM 59 N THR A 6 -10.578 -5.431 6.423 1.00 0.00 N ATOM 60 CA THR A 6 -10.485 -6.799 5.936 1.00 0.00 C ATOM 61 C THR A 6 -9.493 -6.923 4.780 1.00 0.00 C ATOM 62 O THR A 6 -9.877 -6.934 3.608 1.00 0.00 O ATOM 63 CB THR A 6 -11.870 -7.305 5.494 1.00 0.00 C ATOM 64 OG1 THR A 6 -12.711 -6.184 5.175 1.00 0.00 O ATOM 65 CG2 THR A 6 -12.522 -8.137 6.587 1.00 0.00 C ATOM 0 H THR A 6 -11.226 -4.843 5.899 1.00 0.00 H new ATOM 0 HA THR A 6 -10.120 -7.414 6.758 1.00 0.00 H new ATOM 0 HB THR A 6 -11.742 -7.935 4.614 1.00 0.00 H new ATOM 0 HG1 THR A 6 -12.272 -5.628 4.498 1.00 0.00 H new ATOM 0 HG21 THR A 6 -13.499 -8.482 6.248 1.00 0.00 H new ATOM 0 HG22 THR A 6 -11.892 -8.997 6.814 1.00 0.00 H new ATOM 0 HG23 THR A 6 -12.643 -7.529 7.484 1.00 0.00 H new ATOM 73 N VAL A 7 -8.216 -7.004 5.116 1.00 0.00 N ATOM 74 CA VAL A 7 -7.170 -7.131 4.111 1.00 0.00 C ATOM 75 C VAL A 7 -6.632 -8.558 4.082 1.00 0.00 C ATOM 76 O VAL A 7 -6.782 -9.303 5.050 1.00 0.00 O ATOM 77 CB VAL A 7 -6.006 -6.145 4.368 1.00 0.00 C ATOM 78 CG1 VAL A 7 -6.502 -4.707 4.311 1.00 0.00 C ATOM 79 CG2 VAL A 7 -5.341 -6.425 5.709 1.00 0.00 C ATOM 0 H VAL A 7 -7.877 -6.984 6.078 1.00 0.00 H new ATOM 0 HA VAL A 7 -7.616 -6.888 3.146 1.00 0.00 H new ATOM 0 HB VAL A 7 -5.263 -6.288 3.584 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -5.670 -4.027 4.494 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -6.924 -4.507 3.326 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -7.268 -4.556 5.072 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -4.526 -5.718 5.866 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -6.074 -6.317 6.508 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -4.946 -7.441 5.714 1.00 0.00 H new ATOM 89 N THR A 8 -6.019 -8.940 2.973 1.00 0.00 N ATOM 90 CA THR A 8 -5.464 -10.280 2.835 1.00 0.00 C ATOM 91 C THR A 8 -3.995 -10.217 2.425 1.00 0.00 C ATOM 92 O THR A 8 -3.679 -10.228 1.235 1.00 0.00 O ATOM 93 CB THR A 8 -6.245 -11.110 1.795 1.00 0.00 C ATOM 94 OG1 THR A 8 -7.654 -10.895 1.955 1.00 0.00 O ATOM 95 CG2 THR A 8 -5.939 -12.592 1.945 1.00 0.00 C ATOM 0 H THR A 8 -5.892 -8.343 2.156 1.00 0.00 H new ATOM 0 HA THR A 8 -5.550 -10.765 3.807 1.00 0.00 H new ATOM 0 HB THR A 8 -5.936 -10.788 0.801 1.00 0.00 H new ATOM 0 HG1 THR A 8 -8.143 -11.424 1.290 1.00 0.00 H new ATOM 0 HG21 THR A 8 -6.501 -13.157 1.201 1.00 0.00 H new ATOM 0 HG22 THR A 8 -4.872 -12.760 1.798 1.00 0.00 H new ATOM 0 HG23 THR A 8 -6.224 -12.923 2.944 1.00 0.00 H new ATOM 103 N PRO A 9 -3.080 -10.125 3.403 1.00 0.00 N ATOM 104 CA PRO A 9 -1.640 -10.058 3.132 1.00 0.00 C ATOM 105 C PRO A 9 -1.082 -11.387 2.627 1.00 0.00 C ATOM 106 O PRO A 9 -1.626 -12.450 2.922 1.00 0.00 O ATOM 107 CB PRO A 9 -1.040 -9.706 4.494 1.00 0.00 C ATOM 108 CG PRO A 9 -2.022 -10.222 5.489 1.00 0.00 C ATOM 109 CD PRO A 9 -3.374 -10.075 4.849 1.00 0.00 C ATOM 0 HA PRO A 9 -1.404 -9.337 2.349 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -0.062 -10.169 4.627 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -0.900 -8.630 4.598 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -1.818 -11.264 5.735 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -1.967 -9.658 6.420 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -4.049 -10.877 5.149 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -3.850 -9.135 5.129 1.00 0.00 H new ATOM 117 N SER A 10 -0.007 -11.325 1.855 1.00 0.00 N ATOM 118 CA SER A 10 0.615 -12.526 1.320 1.00 0.00 C ATOM 119 C SER A 10 1.903 -12.844 2.078 1.00 0.00 C ATOM 120 O SER A 10 2.900 -12.128 1.959 1.00 0.00 O ATOM 121 CB SER A 10 0.906 -12.345 -0.170 1.00 0.00 C ATOM 122 OG SER A 10 -0.235 -11.850 -0.853 1.00 0.00 O ATOM 0 H SER A 10 0.452 -10.455 1.585 1.00 0.00 H new ATOM 0 HA SER A 10 -0.073 -13.362 1.446 1.00 0.00 H new ATOM 0 HB2 SER A 10 1.740 -11.656 -0.300 1.00 0.00 H new ATOM 0 HB3 SER A 10 1.209 -13.298 -0.604 1.00 0.00 H new ATOM 0 HG SER A 10 -0.011 -11.695 -1.794 1.00 0.00 H new ATOM 128 N SER A 11 1.874 -13.910 2.863 1.00 0.00 N ATOM 129 CA SER A 11 3.037 -14.314 3.635 1.00 0.00 C ATOM 130 C SER A 11 3.446 -15.736 3.274 1.00 0.00 C ATOM 131 O SER A 11 2.700 -16.686 3.507 1.00 0.00 O ATOM 132 CB SER A 11 2.733 -14.206 5.128 1.00 0.00 C ATOM 133 OG SER A 11 1.982 -13.033 5.401 1.00 0.00 O ATOM 0 H SER A 11 1.058 -14.510 2.982 1.00 0.00 H new ATOM 0 HA SER A 11 3.867 -13.649 3.397 1.00 0.00 H new ATOM 0 HB2 SER A 11 2.178 -15.085 5.456 1.00 0.00 H new ATOM 0 HB3 SER A 11 3.664 -14.188 5.694 1.00 0.00 H new ATOM 0 HG SER A 11 1.795 -12.981 6.362 1.00 0.00 H new ATOM 139 N GLY A 12 4.618 -15.868 2.674 1.00 0.00 N ATOM 140 CA GLY A 12 5.114 -17.172 2.286 1.00 0.00 C ATOM 141 C GLY A 12 4.982 -17.409 0.798 1.00 0.00 C ATOM 142 O GLY A 12 5.490 -18.394 0.268 1.00 0.00 O ATOM 0 H GLY A 12 5.238 -15.091 2.447 1.00 0.00 H new ATOM 0 HA2 GLY A 12 6.161 -17.263 2.576 1.00 0.00 H new ATOM 0 HA3 GLY A 12 4.566 -17.944 2.826 1.00 0.00 H new ATOM 146 N LEU A 13 4.301 -16.499 0.126 1.00 0.00 N ATOM 147 CA LEU A 13 4.103 -16.606 -1.309 1.00 0.00 C ATOM 148 C LEU A 13 5.180 -15.819 -2.038 1.00 0.00 C ATOM 149 O LEU A 13 5.736 -14.870 -1.490 1.00 0.00 O ATOM 150 CB LEU A 13 2.715 -16.090 -1.697 1.00 0.00 C ATOM 151 CG LEU A 13 1.542 -16.784 -0.993 1.00 0.00 C ATOM 152 CD1 LEU A 13 0.220 -16.131 -1.362 1.00 0.00 C ATOM 153 CD2 LEU A 13 1.510 -18.268 -1.335 1.00 0.00 C ATOM 0 H LEU A 13 3.875 -15.676 0.551 1.00 0.00 H new ATOM 0 HA LEU A 13 4.173 -17.655 -1.597 1.00 0.00 H new ATOM 0 HB2 LEU A 13 2.668 -15.023 -1.481 1.00 0.00 H new ATOM 0 HB3 LEU A 13 2.590 -16.203 -2.774 1.00 0.00 H new ATOM 0 HG LEU A 13 1.688 -16.677 0.082 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -0.594 -16.643 -0.849 1.00 0.00 H new ATOM 0 HD12 LEU A 13 0.236 -15.083 -1.063 1.00 0.00 H new ATOM 0 HD13 LEU A 13 0.069 -16.198 -2.439 1.00 0.00 H new ATOM 0 HD21 LEU A 13 0.671 -18.741 -0.825 1.00 0.00 H new ATOM 0 HD22 LEU A 13 1.396 -18.391 -2.412 1.00 0.00 H new ATOM 0 HD23 LEU A 13 2.440 -18.736 -1.013 1.00 0.00 H new ATOM 165 N SER A 14 5.479 -16.222 -3.262 1.00 0.00 N ATOM 166 CA SER A 14 6.498 -15.558 -4.066 1.00 0.00 C ATOM 167 C SER A 14 6.034 -14.178 -4.539 1.00 0.00 C ATOM 168 O SER A 14 4.890 -13.774 -4.304 1.00 0.00 O ATOM 169 CB SER A 14 6.859 -16.443 -5.261 1.00 0.00 C ATOM 170 OG SER A 14 7.272 -17.731 -4.825 1.00 0.00 O ATOM 0 H SER A 14 5.028 -17.011 -3.725 1.00 0.00 H new ATOM 0 HA SER A 14 7.381 -15.406 -3.445 1.00 0.00 H new ATOM 0 HB2 SER A 14 5.999 -16.536 -5.924 1.00 0.00 H new ATOM 0 HB3 SER A 14 7.657 -15.976 -5.838 1.00 0.00 H new ATOM 0 HG SER A 14 7.497 -18.283 -5.603 1.00 0.00 H new ATOM 176 N ASP A 15 6.930 -13.455 -5.198 1.00 0.00 N ATOM 177 CA ASP A 15 6.616 -12.128 -5.698 1.00 0.00 C ATOM 178 C ASP A 15 5.736 -12.218 -6.938 1.00 0.00 C ATOM 179 O ASP A 15 5.723 -13.235 -7.638 1.00 0.00 O ATOM 180 CB ASP A 15 7.894 -11.342 -6.011 1.00 0.00 C ATOM 181 CG ASP A 15 8.710 -11.947 -7.137 1.00 0.00 C ATOM 182 OD1 ASP A 15 9.373 -12.985 -6.915 1.00 0.00 O ATOM 183 OD2 ASP A 15 8.709 -11.378 -8.244 1.00 0.00 O ATOM 0 H ASP A 15 7.880 -13.768 -5.398 1.00 0.00 H new ATOM 0 HA ASP A 15 6.070 -11.596 -4.919 1.00 0.00 H new ATOM 0 HB2 ASP A 15 7.627 -10.318 -6.274 1.00 0.00 H new ATOM 0 HB3 ASP A 15 8.509 -11.290 -5.113 1.00 0.00 H new ATOM 188 N GLY A 16 5.003 -11.149 -7.203 1.00 0.00 N ATOM 189 CA GLY A 16 4.114 -11.123 -8.343 1.00 0.00 C ATOM 190 C GLY A 16 2.712 -11.546 -7.950 1.00 0.00 C ATOM 191 O GLY A 16 1.812 -11.634 -8.789 1.00 0.00 O ATOM 0 H GLY A 16 5.008 -10.295 -6.646 1.00 0.00 H new ATOM 0 HA2 GLY A 16 4.089 -10.119 -8.766 1.00 0.00 H new ATOM 0 HA3 GLY A 16 4.494 -11.787 -9.120 1.00 0.00 H new ATOM 195 N THR A 17 2.539 -11.816 -6.663 1.00 0.00 N ATOM 196 CA THR A 17 1.255 -12.226 -6.123 1.00 0.00 C ATOM 197 C THR A 17 0.363 -11.010 -5.885 1.00 0.00 C ATOM 198 O THR A 17 0.851 -9.927 -5.550 1.00 0.00 O ATOM 199 CB THR A 17 1.447 -13.011 -4.811 1.00 0.00 C ATOM 200 OG1 THR A 17 2.377 -14.083 -5.032 1.00 0.00 O ATOM 201 CG2 THR A 17 0.127 -13.580 -4.309 1.00 0.00 C ATOM 0 H THR A 17 3.283 -11.757 -5.968 1.00 0.00 H new ATOM 0 HA THR A 17 0.769 -12.877 -6.850 1.00 0.00 H new ATOM 0 HB THR A 17 1.832 -12.327 -4.055 1.00 0.00 H new ATOM 0 HG1 THR A 17 3.293 -13.746 -4.941 1.00 0.00 H new ATOM 0 HG21 THR A 17 0.296 -14.128 -3.382 1.00 0.00 H new ATOM 0 HG22 THR A 17 -0.574 -12.766 -4.126 1.00 0.00 H new ATOM 0 HG23 THR A 17 -0.287 -14.254 -5.059 1.00 0.00 H new ATOM 209 N VAL A 18 -0.935 -11.188 -6.080 1.00 0.00 N ATOM 210 CA VAL A 18 -1.894 -10.113 -5.897 1.00 0.00 C ATOM 211 C VAL A 18 -2.427 -10.093 -4.466 1.00 0.00 C ATOM 212 O VAL A 18 -3.042 -11.055 -4.003 1.00 0.00 O ATOM 213 CB VAL A 18 -3.069 -10.243 -6.890 1.00 0.00 C ATOM 214 CG1 VAL A 18 -4.073 -9.121 -6.695 1.00 0.00 C ATOM 215 CG2 VAL A 18 -2.561 -10.263 -8.326 1.00 0.00 C ATOM 0 H VAL A 18 -1.349 -12.075 -6.367 1.00 0.00 H new ATOM 0 HA VAL A 18 -1.374 -9.175 -6.091 1.00 0.00 H new ATOM 0 HB VAL A 18 -3.574 -11.188 -6.690 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -4.890 -9.236 -7.407 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -4.468 -9.159 -5.680 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -3.582 -8.161 -6.858 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -3.405 -10.355 -9.009 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -2.024 -9.338 -8.535 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -1.889 -11.111 -8.463 1.00 0.00 H new ATOM 225 N VAL A 19 -2.173 -8.994 -3.774 1.00 0.00 N ATOM 226 CA VAL A 19 -2.618 -8.807 -2.401 1.00 0.00 C ATOM 227 C VAL A 19 -3.952 -8.063 -2.385 1.00 0.00 C ATOM 228 O VAL A 19 -4.077 -6.991 -2.978 1.00 0.00 O ATOM 229 CB VAL A 19 -1.578 -8.006 -1.583 1.00 0.00 C ATOM 230 CG1 VAL A 19 -1.979 -7.925 -0.119 1.00 0.00 C ATOM 231 CG2 VAL A 19 -0.197 -8.622 -1.723 1.00 0.00 C ATOM 0 H VAL A 19 -1.650 -8.203 -4.150 1.00 0.00 H new ATOM 0 HA VAL A 19 -2.736 -9.791 -1.947 1.00 0.00 H new ATOM 0 HB VAL A 19 -1.547 -6.992 -1.982 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -1.230 -7.356 0.432 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -2.946 -7.430 -0.034 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -2.049 -8.931 0.295 1.00 0.00 H new ATOM 0 HG21 VAL A 19 0.520 -8.044 -1.140 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -0.218 -9.649 -1.358 1.00 0.00 H new ATOM 0 HG23 VAL A 19 0.099 -8.616 -2.772 1.00 0.00 H new ATOM 241 N LYS A 20 -4.947 -8.627 -1.715 1.00 0.00 N ATOM 242 CA LYS A 20 -6.261 -8.001 -1.654 1.00 0.00 C ATOM 243 C LYS A 20 -6.385 -7.080 -0.445 1.00 0.00 C ATOM 244 O LYS A 20 -6.022 -7.444 0.674 1.00 0.00 O ATOM 245 CB LYS A 20 -7.369 -9.054 -1.610 1.00 0.00 C ATOM 246 CG LYS A 20 -8.766 -8.457 -1.716 1.00 0.00 C ATOM 247 CD LYS A 20 -9.849 -9.506 -1.520 1.00 0.00 C ATOM 248 CE LYS A 20 -9.879 -10.508 -2.662 1.00 0.00 C ATOM 249 NZ LYS A 20 -10.850 -11.605 -2.413 1.00 0.00 N ATOM 0 H LYS A 20 -4.871 -9.510 -1.210 1.00 0.00 H new ATOM 0 HA LYS A 20 -6.373 -7.404 -2.559 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -7.221 -9.763 -2.425 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -7.291 -9.617 -0.680 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -8.882 -7.672 -0.969 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -8.887 -7.989 -2.693 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -9.680 -10.031 -0.580 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -10.819 -9.016 -1.441 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -10.140 -9.995 -3.588 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -8.883 -10.929 -2.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -10.840 -12.267 -3.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -10.587 -12.111 -1.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -11.804 -11.206 -2.306 1.00 0.00 H new ATOM 263 N VAL A 21 -6.903 -5.889 -0.688 1.00 0.00 N ATOM 264 CA VAL A 21 -7.105 -4.899 0.354 1.00 0.00 C ATOM 265 C VAL A 21 -8.531 -4.368 0.279 1.00 0.00 C ATOM 266 O VAL A 21 -8.871 -3.618 -0.635 1.00 0.00 O ATOM 267 CB VAL A 21 -6.108 -3.723 0.222 1.00 0.00 C ATOM 268 CG1 VAL A 21 -6.432 -2.610 1.212 1.00 0.00 C ATOM 269 CG2 VAL A 21 -4.676 -4.206 0.418 1.00 0.00 C ATOM 0 H VAL A 21 -7.196 -5.581 -1.615 1.00 0.00 H new ATOM 0 HA VAL A 21 -6.933 -5.381 1.317 1.00 0.00 H new ATOM 0 HB VAL A 21 -6.205 -3.318 -0.785 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -5.714 -1.798 1.095 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -7.438 -2.235 1.022 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -6.376 -3.000 2.228 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -3.991 -3.363 0.321 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -4.573 -4.645 1.410 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -4.438 -4.955 -0.337 1.00 0.00 H new ATOM 279 N ALA A 22 -9.372 -4.784 1.213 1.00 0.00 N ATOM 280 CA ALA A 22 -10.755 -4.340 1.235 1.00 0.00 C ATOM 281 C ALA A 22 -11.109 -3.745 2.587 1.00 0.00 C ATOM 282 O ALA A 22 -11.349 -4.468 3.559 1.00 0.00 O ATOM 283 CB ALA A 22 -11.690 -5.489 0.893 1.00 0.00 C ATOM 0 H ALA A 22 -9.121 -5.427 1.964 1.00 0.00 H new ATOM 0 HA ALA A 22 -10.876 -3.563 0.481 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -12.722 -5.137 0.914 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -11.455 -5.865 -0.103 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -11.564 -6.290 1.622 1.00 0.00 H new ATOM 289 N GLY A 23 -11.133 -2.425 2.650 1.00 0.00 N ATOM 290 CA GLY A 23 -11.450 -1.752 3.888 1.00 0.00 C ATOM 291 C GLY A 23 -12.869 -1.231 3.909 1.00 0.00 C ATOM 292 O GLY A 23 -13.298 -0.543 2.982 1.00 0.00 O ATOM 0 H GLY A 23 -10.938 -1.806 1.863 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -11.305 -2.440 4.721 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -10.758 -0.923 4.036 1.00 0.00 H new ATOM 296 N ALA A 24 -13.607 -1.574 4.950 1.00 0.00 N ATOM 297 CA ALA A 24 -14.977 -1.122 5.092 1.00 0.00 C ATOM 298 C ALA A 24 -15.097 -0.187 6.286 1.00 0.00 C ATOM 299 O ALA A 24 -14.284 -0.242 7.211 1.00 0.00 O ATOM 300 CB ALA A 24 -15.914 -2.311 5.240 1.00 0.00 C ATOM 0 H ALA A 24 -13.277 -2.167 5.712 1.00 0.00 H new ATOM 0 HA ALA A 24 -15.263 -0.574 4.194 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -16.939 -1.956 5.346 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -15.839 -2.945 4.357 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -15.636 -2.885 6.124 1.00 0.00 H new ATOM 306 N GLY A 25 -16.105 0.669 6.263 1.00 0.00 N ATOM 307 CA GLY A 25 -16.299 1.616 7.342 1.00 0.00 C ATOM 308 C GLY A 25 -15.441 2.850 7.166 1.00 0.00 C ATOM 309 O GLY A 25 -15.109 3.537 8.135 1.00 0.00 O ATOM 0 H GLY A 25 -16.795 0.726 5.514 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -17.349 1.906 7.387 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -16.059 1.139 8.292 1.00 0.00 H new ATOM 313 N LEU A 26 -15.087 3.126 5.919 1.00 0.00 N ATOM 314 CA LEU A 26 -14.262 4.277 5.588 1.00 0.00 C ATOM 315 C LEU A 26 -15.144 5.468 5.225 1.00 0.00 C ATOM 316 O LEU A 26 -16.369 5.404 5.346 1.00 0.00 O ATOM 317 CB LEU A 26 -13.325 3.935 4.427 1.00 0.00 C ATOM 318 CG LEU A 26 -12.353 2.782 4.692 1.00 0.00 C ATOM 319 CD1 LEU A 26 -11.540 2.470 3.446 1.00 0.00 C ATOM 320 CD2 LEU A 26 -11.435 3.114 5.859 1.00 0.00 C ATOM 0 H LEU A 26 -15.362 2.563 5.114 1.00 0.00 H new ATOM 0 HA LEU A 26 -13.659 4.542 6.457 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -13.929 3.686 3.555 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -12.748 4.824 4.173 1.00 0.00 H new ATOM 0 HG LEU A 26 -12.934 1.898 4.953 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -10.855 1.648 3.655 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -12.211 2.186 2.635 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -10.970 3.352 3.153 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -10.752 2.283 6.032 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -10.863 4.012 5.628 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -12.032 3.285 6.755 1.00 0.00 H new ATOM 332 N GLN A 27 -14.529 6.548 4.769 1.00 0.00 N ATOM 333 CA GLN A 27 -15.273 7.742 4.400 1.00 0.00 C ATOM 334 C GLN A 27 -15.659 7.699 2.925 1.00 0.00 C ATOM 335 O GLN A 27 -14.807 7.825 2.044 1.00 0.00 O ATOM 336 CB GLN A 27 -14.445 8.989 4.701 1.00 0.00 C ATOM 337 CG GLN A 27 -15.258 10.137 5.272 1.00 0.00 C ATOM 338 CD GLN A 27 -15.684 9.888 6.706 1.00 0.00 C ATOM 339 OE1 GLN A 27 -14.952 10.215 7.643 1.00 0.00 O ATOM 340 NE2 GLN A 27 -16.863 9.314 6.890 1.00 0.00 N ATOM 0 H GLN A 27 -13.519 6.622 4.646 1.00 0.00 H new ATOM 0 HA GLN A 27 -16.189 7.779 4.990 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -13.655 8.729 5.406 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -13.958 9.321 3.784 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -14.670 11.054 5.225 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -16.143 10.294 4.655 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -17.437 9.059 6.086 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -17.197 9.126 7.835 1.00 0.00 H new ATOM 349 N ALA A 28 -16.950 7.532 2.670 1.00 0.00 N ATOM 350 CA ALA A 28 -17.474 7.455 1.312 1.00 0.00 C ATOM 351 C ALA A 28 -17.179 8.724 0.522 1.00 0.00 C ATOM 352 O ALA A 28 -17.356 9.837 1.025 1.00 0.00 O ATOM 353 CB ALA A 28 -18.970 7.199 1.354 1.00 0.00 C ATOM 0 H ALA A 28 -17.662 7.446 3.396 1.00 0.00 H new ATOM 0 HA ALA A 28 -16.976 6.629 0.804 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -19.358 7.142 0.337 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -19.164 6.258 1.870 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -19.464 8.013 1.886 1.00 0.00 H new ATOM 359 N GLY A 29 -16.725 8.550 -0.712 1.00 0.00 N ATOM 360 CA GLY A 29 -16.415 9.689 -1.555 1.00 0.00 C ATOM 361 C GLY A 29 -14.934 10.002 -1.584 1.00 0.00 C ATOM 362 O GLY A 29 -14.439 10.616 -2.530 1.00 0.00 O ATOM 0 H GLY A 29 -16.566 7.640 -1.145 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -16.761 9.491 -2.569 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -16.961 10.562 -1.196 1.00 0.00 H new ATOM 366 N THR A 30 -14.228 9.578 -0.550 1.00 0.00 N ATOM 367 CA THR A 30 -12.799 9.825 -0.448 1.00 0.00 C ATOM 368 C THR A 30 -12.000 8.738 -1.163 1.00 0.00 C ATOM 369 O THR A 30 -12.434 7.585 -1.244 1.00 0.00 O ATOM 370 CB THR A 30 -12.362 9.882 1.026 1.00 0.00 C ATOM 371 OG1 THR A 30 -13.488 10.214 1.847 1.00 0.00 O ATOM 372 CG2 THR A 30 -11.256 10.907 1.236 1.00 0.00 C ATOM 0 H THR A 30 -14.623 9.059 0.234 1.00 0.00 H new ATOM 0 HA THR A 30 -12.600 10.785 -0.925 1.00 0.00 H new ATOM 0 HB THR A 30 -11.974 8.902 1.305 1.00 0.00 H new ATOM 0 HG1 THR A 30 -14.090 9.443 1.904 1.00 0.00 H new ATOM 0 HG21 THR A 30 -10.970 10.923 2.288 1.00 0.00 H new ATOM 0 HG22 THR A 30 -10.392 10.639 0.629 1.00 0.00 H new ATOM 0 HG23 THR A 30 -11.614 11.894 0.942 1.00 0.00 H new ATOM 380 N ALA A 31 -10.842 9.115 -1.688 1.00 0.00 N ATOM 381 CA ALA A 31 -9.975 8.176 -2.378 1.00 0.00 C ATOM 382 C ALA A 31 -8.905 7.657 -1.432 1.00 0.00 C ATOM 383 O ALA A 31 -8.375 8.408 -0.611 1.00 0.00 O ATOM 384 CB ALA A 31 -9.339 8.832 -3.591 1.00 0.00 C ATOM 0 H ALA A 31 -10.482 10.069 -1.648 1.00 0.00 H new ATOM 0 HA ALA A 31 -10.576 7.334 -2.720 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -8.693 8.114 -4.096 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -10.119 9.163 -4.277 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -8.748 9.691 -3.272 1.00 0.00 H new ATOM 390 N TYR A 32 -8.603 6.376 -1.533 1.00 0.00 N ATOM 391 CA TYR A 32 -7.597 5.765 -0.686 1.00 0.00 C ATOM 392 C TYR A 32 -6.486 5.167 -1.536 1.00 0.00 C ATOM 393 O TYR A 32 -6.703 4.224 -2.304 1.00 0.00 O ATOM 394 CB TYR A 32 -8.232 4.700 0.213 1.00 0.00 C ATOM 395 CG TYR A 32 -9.136 5.282 1.279 1.00 0.00 C ATOM 396 CD1 TYR A 32 -10.481 5.525 1.017 1.00 0.00 C ATOM 397 CD2 TYR A 32 -8.647 5.599 2.543 1.00 0.00 C ATOM 398 CE1 TYR A 32 -11.309 6.066 1.981 1.00 0.00 C ATOM 399 CE2 TYR A 32 -9.471 6.142 3.511 1.00 0.00 C ATOM 400 CZ TYR A 32 -10.800 6.373 3.225 1.00 0.00 C ATOM 401 OH TYR A 32 -11.624 6.917 4.185 1.00 0.00 O ATOM 0 H TYR A 32 -9.042 5.737 -2.196 1.00 0.00 H new ATOM 0 HA TYR A 32 -7.162 6.533 -0.046 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -8.806 4.009 -0.404 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -7.443 4.120 0.692 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -10.884 5.287 0.044 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -7.607 5.418 2.771 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -12.351 6.248 1.761 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -9.076 6.384 4.487 1.00 0.00 H new ATOM 0 HH TYR A 32 -11.111 7.074 5.005 1.00 0.00 H new ATOM 411 N ASP A 33 -5.298 5.738 -1.408 1.00 0.00 N ATOM 412 CA ASP A 33 -4.138 5.283 -2.159 1.00 0.00 C ATOM 413 C ASP A 33 -3.520 4.067 -1.483 1.00 0.00 C ATOM 414 O ASP A 33 -3.017 4.151 -0.360 1.00 0.00 O ATOM 415 CB ASP A 33 -3.105 6.406 -2.290 1.00 0.00 C ATOM 416 CG ASP A 33 -3.282 7.213 -3.563 1.00 0.00 C ATOM 417 OD1 ASP A 33 -2.877 6.732 -4.642 1.00 0.00 O ATOM 418 OD2 ASP A 33 -3.819 8.339 -3.492 1.00 0.00 O ATOM 0 H ASP A 33 -5.111 6.524 -0.785 1.00 0.00 H new ATOM 0 HA ASP A 33 -4.462 5.000 -3.160 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -3.184 7.070 -1.429 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -2.103 5.977 -2.272 1.00 0.00 H new ATOM 423 N VAL A 34 -3.583 2.933 -2.164 1.00 0.00 N ATOM 424 CA VAL A 34 -3.042 1.691 -1.635 1.00 0.00 C ATOM 425 C VAL A 34 -2.000 1.106 -2.580 1.00 0.00 C ATOM 426 O VAL A 34 -2.250 0.957 -3.783 1.00 0.00 O ATOM 427 CB VAL A 34 -4.151 0.641 -1.410 1.00 0.00 C ATOM 428 CG1 VAL A 34 -3.609 -0.560 -0.653 1.00 0.00 C ATOM 429 CG2 VAL A 34 -5.338 1.245 -0.674 1.00 0.00 C ATOM 0 H VAL A 34 -4.006 2.848 -3.088 1.00 0.00 H new ATOM 0 HA VAL A 34 -2.578 1.931 -0.678 1.00 0.00 H new ATOM 0 HB VAL A 34 -4.496 0.306 -2.388 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -4.407 -1.287 -0.505 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -2.802 -1.018 -1.226 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -3.228 -0.238 0.316 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -6.103 0.482 -0.530 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -5.012 1.620 0.296 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -5.750 2.066 -1.260 1.00 0.00 H new ATOM 439 N GLY A 35 -0.832 0.789 -2.040 1.00 0.00 N ATOM 440 CA GLY A 35 0.221 0.208 -2.840 1.00 0.00 C ATOM 441 C GLY A 35 1.197 -0.583 -1.997 1.00 0.00 C ATOM 442 O GLY A 35 1.104 -0.581 -0.770 1.00 0.00 O ATOM 0 H GLY A 35 -0.596 0.926 -1.057 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -0.215 -0.443 -3.598 1.00 0.00 H new ATOM 0 HA3 GLY A 35 0.754 0.998 -3.368 1.00 0.00 H new ATOM 446 N GLN A 36 2.120 -1.280 -2.646 1.00 0.00 N ATOM 447 CA GLN A 36 3.119 -2.055 -1.930 1.00 0.00 C ATOM 448 C GLN A 36 4.257 -1.129 -1.523 1.00 0.00 C ATOM 449 O GLN A 36 4.741 -0.337 -2.333 1.00 0.00 O ATOM 450 CB GLN A 36 3.641 -3.205 -2.792 1.00 0.00 C ATOM 451 CG GLN A 36 4.234 -2.752 -4.111 1.00 0.00 C ATOM 452 CD GLN A 36 5.341 -3.664 -4.599 1.00 0.00 C ATOM 453 OE1 GLN A 36 5.508 -3.857 -5.796 1.00 0.00 O ATOM 454 NE2 GLN A 36 6.110 -4.228 -3.678 1.00 0.00 N ATOM 0 H GLN A 36 2.196 -1.324 -3.662 1.00 0.00 H new ATOM 0 HA GLN A 36 2.667 -2.494 -1.041 1.00 0.00 H new ATOM 0 HB2 GLN A 36 4.398 -3.754 -2.232 1.00 0.00 H new ATOM 0 HB3 GLN A 36 2.825 -3.900 -2.989 1.00 0.00 H new ATOM 0 HG2 GLN A 36 3.446 -2.709 -4.863 1.00 0.00 H new ATOM 0 HG3 GLN A 36 4.625 -1.740 -4.001 1.00 0.00 H new ATOM 0 HE21 GLN A 36 5.940 -4.043 -2.689 1.00 0.00 H new ATOM 0 HE22 GLN A 36 6.871 -4.846 -3.958 1.00 0.00 H new ATOM 463 N CYS A 37 4.674 -1.213 -0.273 1.00 0.00 N ATOM 464 CA CYS A 37 5.730 -0.348 0.231 1.00 0.00 C ATOM 465 C CYS A 37 6.732 -1.129 1.071 1.00 0.00 C ATOM 466 O CYS A 37 6.533 -2.309 1.352 1.00 0.00 O ATOM 467 CB CYS A 37 5.102 0.777 1.057 1.00 0.00 C ATOM 468 SG CYS A 37 3.320 1.025 0.731 1.00 0.00 S ATOM 0 H CYS A 37 4.300 -1.869 0.412 1.00 0.00 H new ATOM 0 HA CYS A 37 6.273 0.074 -0.615 1.00 0.00 H new ATOM 0 HB2 CYS A 37 5.241 0.559 2.116 1.00 0.00 H new ATOM 0 HB3 CYS A 37 5.632 1.707 0.850 1.00 0.00 H new ATOM 473 N ALA A 38 7.817 -0.470 1.457 1.00 0.00 N ATOM 474 CA ALA A 38 8.844 -1.102 2.271 1.00 0.00 C ATOM 475 C ALA A 38 9.716 -0.052 2.940 1.00 0.00 C ATOM 476 O ALA A 38 9.541 1.150 2.714 1.00 0.00 O ATOM 477 CB ALA A 38 9.698 -2.037 1.428 1.00 0.00 C ATOM 0 H ALA A 38 8.008 0.503 1.218 1.00 0.00 H new ATOM 0 HA ALA A 38 8.350 -1.689 3.045 1.00 0.00 H new ATOM 0 HB1 ALA A 38 10.460 -2.499 2.056 1.00 0.00 H new ATOM 0 HB2 ALA A 38 9.067 -2.812 0.992 1.00 0.00 H new ATOM 0 HB3 ALA A 38 10.180 -1.471 0.631 1.00 0.00 H new ATOM 483 N TRP A 39 10.646 -0.514 3.761 1.00 0.00 N ATOM 484 CA TRP A 39 11.561 0.368 4.464 1.00 0.00 C ATOM 485 C TRP A 39 12.614 0.904 3.497 1.00 0.00 C ATOM 486 O TRP A 39 13.592 0.221 3.186 1.00 0.00 O ATOM 487 CB TRP A 39 12.226 -0.397 5.610 1.00 0.00 C ATOM 488 CG TRP A 39 12.708 0.476 6.725 1.00 0.00 C ATOM 489 CD1 TRP A 39 11.940 1.162 7.621 1.00 0.00 C ATOM 490 CD2 TRP A 39 14.072 0.742 7.079 1.00 0.00 C ATOM 491 NE1 TRP A 39 12.740 1.840 8.508 1.00 0.00 N ATOM 492 CE2 TRP A 39 14.053 1.598 8.195 1.00 0.00 C ATOM 493 CE3 TRP A 39 15.304 0.339 6.558 1.00 0.00 C ATOM 494 CZ2 TRP A 39 15.219 2.057 8.800 1.00 0.00 C ATOM 495 CZ3 TRP A 39 16.461 0.797 7.161 1.00 0.00 C ATOM 496 CH2 TRP A 39 16.409 1.648 8.270 1.00 0.00 C ATOM 0 H TRP A 39 10.787 -1.505 3.957 1.00 0.00 H new ATOM 0 HA TRP A 39 11.009 1.213 4.876 1.00 0.00 H new ATOM 0 HB2 TRP A 39 11.516 -1.121 6.010 1.00 0.00 H new ATOM 0 HB3 TRP A 39 13.070 -0.963 5.214 1.00 0.00 H new ATOM 0 HD1 TRP A 39 10.860 1.170 7.631 1.00 0.00 H new ATOM 0 HE1 TRP A 39 12.411 2.427 9.274 1.00 0.00 H new ATOM 0 HE3 TRP A 39 15.352 -0.317 5.701 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 15.184 2.713 9.657 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 17.420 0.493 6.769 1.00 0.00 H new ATOM 0 HH2 TRP A 39 17.331 1.989 8.717 1.00 0.00 H new ATOM 507 N VAL A 40 12.407 2.117 3.005 1.00 0.00 N ATOM 508 CA VAL A 40 13.340 2.716 2.063 1.00 0.00 C ATOM 509 C VAL A 40 14.413 3.538 2.782 1.00 0.00 C ATOM 510 O VAL A 40 15.589 3.483 2.421 1.00 0.00 O ATOM 511 CB VAL A 40 12.608 3.579 1.001 1.00 0.00 C ATOM 512 CG1 VAL A 40 11.822 4.714 1.640 1.00 0.00 C ATOM 513 CG2 VAL A 40 13.589 4.117 -0.029 1.00 0.00 C ATOM 0 H VAL A 40 11.606 2.703 3.241 1.00 0.00 H new ATOM 0 HA VAL A 40 13.836 1.897 1.542 1.00 0.00 H new ATOM 0 HB VAL A 40 11.894 2.932 0.493 1.00 0.00 H new ATOM 0 HG11 VAL A 40 11.324 5.294 0.863 1.00 0.00 H new ATOM 0 HG12 VAL A 40 11.076 4.302 2.320 1.00 0.00 H new ATOM 0 HG13 VAL A 40 12.502 5.360 2.196 1.00 0.00 H new ATOM 0 HG21 VAL A 40 13.053 4.719 -0.763 1.00 0.00 H new ATOM 0 HG22 VAL A 40 14.337 4.734 0.469 1.00 0.00 H new ATOM 0 HG23 VAL A 40 14.081 3.285 -0.532 1.00 0.00 H new ATOM 523 N ASP A 41 14.017 4.274 3.811 1.00 0.00 N ATOM 524 CA ASP A 41 14.958 5.099 4.561 1.00 0.00 C ATOM 525 C ASP A 41 14.714 4.946 6.054 1.00 0.00 C ATOM 526 O ASP A 41 13.784 4.252 6.465 1.00 0.00 O ATOM 527 CB ASP A 41 14.824 6.568 4.163 1.00 0.00 C ATOM 528 CG ASP A 41 16.153 7.301 4.156 1.00 0.00 C ATOM 529 OD1 ASP A 41 16.864 7.267 5.183 1.00 0.00 O ATOM 530 OD2 ASP A 41 16.481 7.930 3.130 1.00 0.00 O ATOM 0 H ASP A 41 13.055 4.318 4.146 1.00 0.00 H new ATOM 0 HA ASP A 41 15.969 4.765 4.326 1.00 0.00 H new ATOM 0 HB2 ASP A 41 14.375 6.631 3.172 1.00 0.00 H new ATOM 0 HB3 ASP A 41 14.144 7.066 4.854 1.00 0.00 H new ATOM 535 N THR A 42 15.529 5.613 6.854 1.00 0.00 N ATOM 536 CA THR A 42 15.408 5.544 8.299 1.00 0.00 C ATOM 537 C THR A 42 14.165 6.282 8.781 1.00 0.00 C ATOM 538 O THR A 42 14.191 7.492 8.998 1.00 0.00 O ATOM 539 CB THR A 42 16.647 6.140 8.985 1.00 0.00 C ATOM 540 OG1 THR A 42 17.741 6.194 8.060 1.00 0.00 O ATOM 541 CG2 THR A 42 17.044 5.310 10.189 1.00 0.00 C ATOM 0 H THR A 42 16.286 6.212 6.524 1.00 0.00 H new ATOM 0 HA THR A 42 15.323 4.490 8.565 1.00 0.00 H new ATOM 0 HB THR A 42 16.401 7.148 9.319 1.00 0.00 H new ATOM 0 HG1 THR A 42 18.526 6.577 8.504 1.00 0.00 H new ATOM 0 HG21 THR A 42 17.923 5.749 10.660 1.00 0.00 H new ATOM 0 HG22 THR A 42 16.222 5.289 10.904 1.00 0.00 H new ATOM 0 HG23 THR A 42 17.273 4.293 9.870 1.00 0.00 H new ATOM 549 N GLY A 43 13.072 5.551 8.924 1.00 0.00 N ATOM 550 CA GLY A 43 11.837 6.148 9.381 1.00 0.00 C ATOM 551 C GLY A 43 10.957 6.594 8.234 1.00 0.00 C ATOM 552 O GLY A 43 9.791 6.935 8.429 1.00 0.00 O ATOM 0 H GLY A 43 13.018 4.551 8.731 1.00 0.00 H new ATOM 0 HA2 GLY A 43 11.294 5.429 9.995 1.00 0.00 H new ATOM 0 HA3 GLY A 43 12.063 7.004 10.017 1.00 0.00 H new ATOM 556 N VAL A 44 11.513 6.586 7.033 1.00 0.00 N ATOM 557 CA VAL A 44 10.773 6.992 5.850 1.00 0.00 C ATOM 558 C VAL A 44 10.363 5.768 5.051 1.00 0.00 C ATOM 559 O VAL A 44 11.205 4.953 4.670 1.00 0.00 O ATOM 560 CB VAL A 44 11.594 7.929 4.941 1.00 0.00 C ATOM 561 CG1 VAL A 44 10.694 8.582 3.903 1.00 0.00 C ATOM 562 CG2 VAL A 44 12.319 8.986 5.760 1.00 0.00 C ATOM 0 H VAL A 44 12.476 6.302 6.852 1.00 0.00 H new ATOM 0 HA VAL A 44 9.894 7.537 6.194 1.00 0.00 H new ATOM 0 HB VAL A 44 12.344 7.330 4.425 1.00 0.00 H new ATOM 0 HG11 VAL A 44 11.288 9.240 3.269 1.00 0.00 H new ATOM 0 HG12 VAL A 44 10.227 7.811 3.289 1.00 0.00 H new ATOM 0 HG13 VAL A 44 9.921 9.163 4.406 1.00 0.00 H new ATOM 0 HG21 VAL A 44 12.890 9.633 5.095 1.00 0.00 H new ATOM 0 HG22 VAL A 44 11.591 9.583 6.310 1.00 0.00 H new ATOM 0 HG23 VAL A 44 12.996 8.501 6.463 1.00 0.00 H new ATOM 572 N LEU A 45 9.072 5.636 4.823 1.00 0.00 N ATOM 573 CA LEU A 45 8.536 4.521 4.068 1.00 0.00 C ATOM 574 C LEU A 45 8.042 5.024 2.722 1.00 0.00 C ATOM 575 O LEU A 45 7.693 6.195 2.590 1.00 0.00 O ATOM 576 CB LEU A 45 7.399 3.861 4.853 1.00 0.00 C ATOM 577 CG LEU A 45 7.686 3.644 6.342 1.00 0.00 C ATOM 578 CD1 LEU A 45 6.387 3.527 7.126 1.00 0.00 C ATOM 579 CD2 LEU A 45 8.554 2.410 6.550 1.00 0.00 C ATOM 0 H LEU A 45 8.367 6.295 5.154 1.00 0.00 H new ATOM 0 HA LEU A 45 9.314 3.775 3.903 1.00 0.00 H new ATOM 0 HB2 LEU A 45 6.505 4.477 4.756 1.00 0.00 H new ATOM 0 HB3 LEU A 45 7.174 2.897 4.397 1.00 0.00 H new ATOM 0 HG LEU A 45 8.233 4.510 6.714 1.00 0.00 H new ATOM 0 HD11 LEU A 45 6.612 3.373 8.181 1.00 0.00 H new ATOM 0 HD12 LEU A 45 5.807 4.442 7.008 1.00 0.00 H new ATOM 0 HD13 LEU A 45 5.810 2.681 6.751 1.00 0.00 H new ATOM 0 HD21 LEU A 45 8.745 2.275 7.615 1.00 0.00 H new ATOM 0 HD22 LEU A 45 8.038 1.532 6.160 1.00 0.00 H new ATOM 0 HD23 LEU A 45 9.500 2.538 6.025 1.00 0.00 H new ATOM 591 N ALA A 46 8.027 4.156 1.724 1.00 0.00 N ATOM 592 CA ALA A 46 7.585 4.549 0.393 1.00 0.00 C ATOM 593 C ALA A 46 6.982 3.371 -0.362 1.00 0.00 C ATOM 594 O ALA A 46 7.442 2.240 -0.217 1.00 0.00 O ATOM 595 CB ALA A 46 8.751 5.138 -0.379 1.00 0.00 C ATOM 0 H ALA A 46 8.313 3.181 1.807 1.00 0.00 H new ATOM 0 HA ALA A 46 6.806 5.304 0.497 1.00 0.00 H new ATOM 0 HB1 ALA A 46 8.417 5.431 -1.374 1.00 0.00 H new ATOM 0 HB2 ALA A 46 9.132 6.013 0.148 1.00 0.00 H new ATOM 0 HB3 ALA A 46 9.543 4.394 -0.466 1.00 0.00 H new ATOM 601 N CYS A 47 5.959 3.644 -1.167 1.00 0.00 N ATOM 602 CA CYS A 47 5.293 2.602 -1.944 1.00 0.00 C ATOM 603 C CYS A 47 5.666 2.706 -3.414 1.00 0.00 C ATOM 604 O CYS A 47 6.278 3.679 -3.840 1.00 0.00 O ATOM 605 CB CYS A 47 3.773 2.699 -1.800 1.00 0.00 C ATOM 606 SG CYS A 47 3.184 2.880 -0.087 1.00 0.00 S ATOM 0 H CYS A 47 5.573 4.579 -1.299 1.00 0.00 H new ATOM 0 HA CYS A 47 5.626 1.639 -1.556 1.00 0.00 H new ATOM 0 HB2 CYS A 47 3.419 3.549 -2.384 1.00 0.00 H new ATOM 0 HB3 CYS A 47 3.322 1.806 -2.233 1.00 0.00 H new ATOM 611 N ASN A 48 5.293 1.699 -4.186 1.00 0.00 N ATOM 612 CA ASN A 48 5.594 1.678 -5.609 1.00 0.00 C ATOM 613 C ASN A 48 4.420 2.199 -6.435 1.00 0.00 C ATOM 614 O ASN A 48 3.295 1.724 -6.290 1.00 0.00 O ATOM 615 CB ASN A 48 5.942 0.261 -6.051 1.00 0.00 C ATOM 616 CG ASN A 48 6.394 0.209 -7.494 1.00 0.00 C ATOM 617 OD1 ASN A 48 5.697 -0.326 -8.351 1.00 0.00 O ATOM 618 ND2 ASN A 48 7.549 0.794 -7.772 1.00 0.00 N ATOM 0 H ASN A 48 4.780 0.883 -3.851 1.00 0.00 H new ATOM 0 HA ASN A 48 6.448 2.334 -5.777 1.00 0.00 H new ATOM 0 HB2 ASN A 48 6.730 -0.135 -5.410 1.00 0.00 H new ATOM 0 HB3 ASN A 48 5.072 -0.383 -5.921 1.00 0.00 H new ATOM 0 HD21 ASN A 48 7.893 0.813 -8.732 1.00 0.00 H new ATOM 0 HD22 ASN A 48 8.094 1.226 -7.026 1.00 0.00 H new ATOM 625 N PRO A 49 4.671 3.179 -7.318 1.00 0.00 N ATOM 626 CA PRO A 49 3.640 3.762 -8.174 1.00 0.00 C ATOM 627 C PRO A 49 3.464 3.013 -9.496 1.00 0.00 C ATOM 628 O PRO A 49 2.593 3.350 -10.300 1.00 0.00 O ATOM 629 CB PRO A 49 4.187 5.159 -8.429 1.00 0.00 C ATOM 630 CG PRO A 49 5.662 4.961 -8.484 1.00 0.00 C ATOM 631 CD PRO A 49 5.978 3.829 -7.533 1.00 0.00 C ATOM 0 HA PRO A 49 2.654 3.731 -7.711 1.00 0.00 H new ATOM 0 HB2 PRO A 49 3.804 5.574 -9.362 1.00 0.00 H new ATOM 0 HB3 PRO A 49 3.906 5.850 -7.634 1.00 0.00 H new ATOM 0 HG2 PRO A 49 5.983 4.718 -9.497 1.00 0.00 H new ATOM 0 HG3 PRO A 49 6.187 5.871 -8.192 1.00 0.00 H new ATOM 0 HD2 PRO A 49 6.704 3.137 -7.961 1.00 0.00 H new ATOM 0 HD3 PRO A 49 6.401 4.197 -6.598 1.00 0.00 H new ATOM 639 N ALA A 50 4.295 2.005 -9.722 1.00 0.00 N ATOM 640 CA ALA A 50 4.217 1.225 -10.947 1.00 0.00 C ATOM 641 C ALA A 50 3.170 0.133 -10.806 1.00 0.00 C ATOM 642 O ALA A 50 2.493 -0.224 -11.771 1.00 0.00 O ATOM 643 CB ALA A 50 5.573 0.627 -11.295 1.00 0.00 C ATOM 0 H ALA A 50 5.027 1.710 -9.076 1.00 0.00 H new ATOM 0 HA ALA A 50 3.923 1.888 -11.761 1.00 0.00 H new ATOM 0 HB1 ALA A 50 5.490 0.048 -12.215 1.00 0.00 H new ATOM 0 HB2 ALA A 50 6.299 1.428 -11.435 1.00 0.00 H new ATOM 0 HB3 ALA A 50 5.902 -0.024 -10.485 1.00 0.00 H new ATOM 649 N ASP A 51 3.030 -0.386 -9.592 1.00 0.00 N ATOM 650 CA ASP A 51 2.059 -1.437 -9.315 1.00 0.00 C ATOM 651 C ASP A 51 1.160 -1.054 -8.143 1.00 0.00 C ATOM 652 O ASP A 51 1.196 -1.680 -7.080 1.00 0.00 O ATOM 653 CB ASP A 51 2.769 -2.762 -9.017 1.00 0.00 C ATOM 654 CG ASP A 51 2.301 -3.882 -9.924 1.00 0.00 C ATOM 655 OD1 ASP A 51 1.074 -4.107 -10.019 1.00 0.00 O ATOM 656 OD2 ASP A 51 3.154 -4.532 -10.561 1.00 0.00 O ATOM 0 H ASP A 51 3.578 -0.095 -8.782 1.00 0.00 H new ATOM 0 HA ASP A 51 1.438 -1.561 -10.202 1.00 0.00 H new ATOM 0 HB2 ASP A 51 3.845 -2.629 -9.133 1.00 0.00 H new ATOM 0 HB3 ASP A 51 2.592 -3.041 -7.978 1.00 0.00 H new ATOM 661 N PHE A 52 0.346 -0.024 -8.339 1.00 0.00 N ATOM 662 CA PHE A 52 -0.564 0.436 -7.296 1.00 0.00 C ATOM 663 C PHE A 52 -1.919 0.797 -7.900 1.00 0.00 C ATOM 664 O PHE A 52 -2.071 0.822 -9.123 1.00 0.00 O ATOM 665 CB PHE A 52 0.031 1.641 -6.544 1.00 0.00 C ATOM 666 CG PHE A 52 -0.271 2.982 -7.167 1.00 0.00 C ATOM 667 CD1 PHE A 52 0.192 3.298 -8.436 1.00 0.00 C ATOM 668 CD2 PHE A 52 -1.020 3.926 -6.480 1.00 0.00 C ATOM 669 CE1 PHE A 52 -0.087 4.526 -9.005 1.00 0.00 C ATOM 670 CE2 PHE A 52 -1.302 5.155 -7.047 1.00 0.00 C ATOM 671 CZ PHE A 52 -0.834 5.454 -8.311 1.00 0.00 C ATOM 0 H PHE A 52 0.297 0.508 -9.208 1.00 0.00 H new ATOM 0 HA PHE A 52 -0.705 -0.374 -6.580 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -0.347 1.637 -5.521 1.00 0.00 H new ATOM 0 HB3 PHE A 52 1.112 1.518 -6.485 1.00 0.00 H new ATOM 0 HD1 PHE A 52 0.777 2.576 -8.986 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -1.387 3.698 -5.490 1.00 0.00 H new ATOM 0 HE1 PHE A 52 0.280 4.759 -9.994 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -1.888 5.880 -6.502 1.00 0.00 H new ATOM 0 HZ PHE A 52 -1.053 6.414 -8.756 1.00 0.00 H new ATOM 681 N SER A 53 -2.900 1.059 -7.046 1.00 0.00 N ATOM 682 CA SER A 53 -4.236 1.431 -7.496 1.00 0.00 C ATOM 683 C SER A 53 -4.933 2.288 -6.443 1.00 0.00 C ATOM 684 O SER A 53 -5.113 1.863 -5.301 1.00 0.00 O ATOM 685 CB SER A 53 -5.075 0.181 -7.787 1.00 0.00 C ATOM 686 OG SER A 53 -4.460 -0.631 -8.774 1.00 0.00 O ATOM 0 H SER A 53 -2.795 1.021 -6.032 1.00 0.00 H new ATOM 0 HA SER A 53 -4.137 2.009 -8.415 1.00 0.00 H new ATOM 0 HB2 SER A 53 -5.207 -0.393 -6.870 1.00 0.00 H new ATOM 0 HB3 SER A 53 -6.069 0.477 -8.123 1.00 0.00 H new ATOM 0 HG SER A 53 -5.015 -1.422 -8.939 1.00 0.00 H new ATOM 692 N SER A 54 -5.296 3.504 -6.819 1.00 0.00 N ATOM 693 CA SER A 54 -5.982 4.404 -5.911 1.00 0.00 C ATOM 694 C SER A 54 -7.473 4.098 -5.913 1.00 0.00 C ATOM 695 O SER A 54 -8.225 4.604 -6.749 1.00 0.00 O ATOM 696 CB SER A 54 -5.725 5.851 -6.320 1.00 0.00 C ATOM 697 OG SER A 54 -4.371 6.031 -6.701 1.00 0.00 O ATOM 0 H SER A 54 -5.126 3.889 -7.748 1.00 0.00 H new ATOM 0 HA SER A 54 -5.600 4.260 -4.900 1.00 0.00 H new ATOM 0 HB2 SER A 54 -6.380 6.122 -7.148 1.00 0.00 H new ATOM 0 HB3 SER A 54 -5.966 6.517 -5.491 1.00 0.00 H new ATOM 0 HG SER A 54 -3.798 5.974 -5.908 1.00 0.00 H new ATOM 703 N VAL A 55 -7.886 3.255 -4.984 1.00 0.00 N ATOM 704 CA VAL A 55 -9.278 2.853 -4.880 1.00 0.00 C ATOM 705 C VAL A 55 -10.104 3.909 -4.149 1.00 0.00 C ATOM 706 O VAL A 55 -9.676 4.466 -3.139 1.00 0.00 O ATOM 707 CB VAL A 55 -9.414 1.484 -4.170 1.00 0.00 C ATOM 708 CG1 VAL A 55 -8.789 1.522 -2.781 1.00 0.00 C ATOM 709 CG2 VAL A 55 -10.872 1.044 -4.092 1.00 0.00 C ATOM 0 H VAL A 55 -7.273 2.833 -4.286 1.00 0.00 H new ATOM 0 HA VAL A 55 -9.664 2.755 -5.895 1.00 0.00 H new ATOM 0 HB VAL A 55 -8.872 0.750 -4.766 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -8.899 0.547 -2.306 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -7.730 1.767 -2.865 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -9.290 2.279 -2.177 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -10.935 0.079 -3.588 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -11.446 1.783 -3.533 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -11.279 0.954 -5.099 1.00 0.00 H new ATOM 719 N THR A 56 -11.277 4.198 -4.677 1.00 0.00 N ATOM 720 CA THR A 56 -12.157 5.176 -4.071 1.00 0.00 C ATOM 721 C THR A 56 -13.234 4.470 -3.247 1.00 0.00 C ATOM 722 O THR A 56 -13.657 3.358 -3.583 1.00 0.00 O ATOM 723 CB THR A 56 -12.794 6.095 -5.143 1.00 0.00 C ATOM 724 OG1 THR A 56 -13.355 7.260 -4.528 1.00 0.00 O ATOM 725 CG2 THR A 56 -13.871 5.372 -5.943 1.00 0.00 C ATOM 0 H THR A 56 -11.643 3.768 -5.526 1.00 0.00 H new ATOM 0 HA THR A 56 -11.567 5.808 -3.407 1.00 0.00 H new ATOM 0 HB THR A 56 -12.001 6.388 -5.831 1.00 0.00 H new ATOM 0 HG1 THR A 56 -13.753 7.834 -5.216 1.00 0.00 H new ATOM 0 HG21 THR A 56 -14.292 6.052 -6.684 1.00 0.00 H new ATOM 0 HG22 THR A 56 -13.433 4.511 -6.448 1.00 0.00 H new ATOM 0 HG23 THR A 56 -14.660 5.035 -5.270 1.00 0.00 H new ATOM 733 N ALA A 57 -13.653 5.094 -2.158 1.00 0.00 N ATOM 734 CA ALA A 57 -14.673 4.511 -1.300 1.00 0.00 C ATOM 735 C ALA A 57 -16.051 4.689 -1.916 1.00 0.00 C ATOM 736 O ALA A 57 -16.418 5.793 -2.331 1.00 0.00 O ATOM 737 CB ALA A 57 -14.620 5.132 0.083 1.00 0.00 C ATOM 0 H ALA A 57 -13.304 6.001 -1.848 1.00 0.00 H new ATOM 0 HA ALA A 57 -14.477 3.443 -1.204 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -15.389 4.685 0.712 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -13.640 4.952 0.525 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -14.792 6.206 0.007 1.00 0.00 H new ATOM 743 N ASP A 58 -16.809 3.602 -1.974 1.00 0.00 N ATOM 744 CA ASP A 58 -18.149 3.627 -2.547 1.00 0.00 C ATOM 745 C ASP A 58 -19.134 4.277 -1.576 1.00 0.00 C ATOM 746 O ASP A 58 -18.751 4.681 -0.477 1.00 0.00 O ATOM 747 CB ASP A 58 -18.600 2.205 -2.896 1.00 0.00 C ATOM 748 CG ASP A 58 -19.272 1.495 -1.738 1.00 0.00 C ATOM 749 OD1 ASP A 58 -18.622 1.299 -0.690 1.00 0.00 O ATOM 750 OD2 ASP A 58 -20.460 1.142 -1.870 1.00 0.00 O ATOM 0 H ASP A 58 -16.517 2.687 -1.629 1.00 0.00 H new ATOM 0 HA ASP A 58 -18.127 4.221 -3.461 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -19.289 2.245 -3.739 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -17.736 1.625 -3.218 1.00 0.00 H new ATOM 755 N ALA A 59 -20.400 4.355 -1.981 1.00 0.00 N ATOM 756 CA ALA A 59 -21.444 4.966 -1.158 1.00 0.00 C ATOM 757 C ALA A 59 -21.609 4.250 0.183 1.00 0.00 C ATOM 758 O ALA A 59 -21.945 4.874 1.191 1.00 0.00 O ATOM 759 CB ALA A 59 -22.762 4.977 -1.915 1.00 0.00 C ATOM 0 H ALA A 59 -20.730 4.001 -2.879 1.00 0.00 H new ATOM 0 HA ALA A 59 -21.139 5.990 -0.944 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -23.534 5.433 -1.295 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -22.649 5.551 -2.835 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -23.050 3.954 -2.159 1.00 0.00 H new ATOM 765 N ASN A 60 -21.364 2.945 0.191 1.00 0.00 N ATOM 766 CA ASN A 60 -21.489 2.149 1.411 1.00 0.00 C ATOM 767 C ASN A 60 -20.329 2.433 2.359 1.00 0.00 C ATOM 768 O ASN A 60 -20.429 2.204 3.567 1.00 0.00 O ATOM 769 CB ASN A 60 -21.535 0.653 1.080 1.00 0.00 C ATOM 770 CG ASN A 60 -22.819 0.246 0.381 1.00 0.00 C ATOM 771 OD1 ASN A 60 -23.796 -0.139 1.022 1.00 0.00 O ATOM 772 ND2 ASN A 60 -22.824 0.325 -0.938 1.00 0.00 N ATOM 0 H ASN A 60 -21.078 2.414 -0.631 1.00 0.00 H new ATOM 0 HA ASN A 60 -22.422 2.429 1.901 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -20.685 0.399 0.446 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -21.429 0.078 2.000 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -23.659 0.062 -1.462 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -21.993 0.649 -1.433 1.00 0.00 H new ATOM 779 N GLY A 61 -19.233 2.936 1.805 1.00 0.00 N ATOM 780 CA GLY A 61 -18.068 3.248 2.607 1.00 0.00 C ATOM 781 C GLY A 61 -17.050 2.129 2.593 1.00 0.00 C ATOM 782 O GLY A 61 -16.308 1.938 3.560 1.00 0.00 O ATOM 0 H GLY A 61 -19.131 3.134 0.810 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -17.606 4.162 2.234 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -18.377 3.443 3.634 1.00 0.00 H new ATOM 786 N SER A 62 -17.016 1.381 1.499 1.00 0.00 N ATOM 787 CA SER A 62 -16.083 0.273 1.362 1.00 0.00 C ATOM 788 C SER A 62 -15.140 0.499 0.182 1.00 0.00 C ATOM 789 O SER A 62 -15.545 1.013 -0.864 1.00 0.00 O ATOM 790 CB SER A 62 -16.854 -1.037 1.185 1.00 0.00 C ATOM 791 OG SER A 62 -18.216 -0.790 0.864 1.00 0.00 O ATOM 0 H SER A 62 -17.625 1.522 0.693 1.00 0.00 H new ATOM 0 HA SER A 62 -15.481 0.212 2.268 1.00 0.00 H new ATOM 0 HB2 SER A 62 -16.393 -1.630 0.395 1.00 0.00 H new ATOM 0 HB3 SER A 62 -16.794 -1.625 2.101 1.00 0.00 H new ATOM 0 HG SER A 62 -18.267 -0.241 0.054 1.00 0.00 H new ATOM 797 N ALA A 63 -13.882 0.127 0.361 1.00 0.00 N ATOM 798 CA ALA A 63 -12.879 0.275 -0.683 1.00 0.00 C ATOM 799 C ALA A 63 -12.134 -1.036 -0.892 1.00 0.00 C ATOM 800 O ALA A 63 -11.223 -1.372 -0.133 1.00 0.00 O ATOM 801 CB ALA A 63 -11.906 1.390 -0.331 1.00 0.00 C ATOM 0 H ALA A 63 -13.529 -0.283 1.226 1.00 0.00 H new ATOM 0 HA ALA A 63 -13.383 0.538 -1.613 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -11.163 1.487 -1.122 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -12.450 2.329 -0.227 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -11.407 1.154 0.609 1.00 0.00 H new ATOM 807 N SER A 64 -12.540 -1.784 -1.907 1.00 0.00 N ATOM 808 CA SER A 64 -11.910 -3.059 -2.218 1.00 0.00 C ATOM 809 C SER A 64 -10.963 -2.918 -3.407 1.00 0.00 C ATOM 810 O SER A 64 -11.350 -2.419 -4.464 1.00 0.00 O ATOM 811 CB SER A 64 -12.980 -4.111 -2.520 1.00 0.00 C ATOM 812 OG SER A 64 -14.104 -3.962 -1.664 1.00 0.00 O ATOM 0 H SER A 64 -13.305 -1.529 -2.531 1.00 0.00 H new ATOM 0 HA SER A 64 -11.329 -3.378 -1.352 1.00 0.00 H new ATOM 0 HB2 SER A 64 -13.297 -4.023 -3.559 1.00 0.00 H new ATOM 0 HB3 SER A 64 -12.557 -5.108 -2.399 1.00 0.00 H new ATOM 0 HG SER A 64 -14.772 -4.645 -1.880 1.00 0.00 H new ATOM 818 N THR A 65 -9.723 -3.341 -3.224 1.00 0.00 N ATOM 819 CA THR A 65 -8.726 -3.268 -4.277 1.00 0.00 C ATOM 820 C THR A 65 -7.751 -4.446 -4.179 1.00 0.00 C ATOM 821 O THR A 65 -7.817 -5.243 -3.240 1.00 0.00 O ATOM 822 CB THR A 65 -7.963 -1.923 -4.215 1.00 0.00 C ATOM 823 OG1 THR A 65 -7.215 -1.712 -5.423 1.00 0.00 O ATOM 824 CG2 THR A 65 -7.028 -1.871 -3.017 1.00 0.00 C ATOM 0 H THR A 65 -9.382 -3.741 -2.350 1.00 0.00 H new ATOM 0 HA THR A 65 -9.239 -3.326 -5.237 1.00 0.00 H new ATOM 0 HB THR A 65 -8.703 -1.130 -4.108 1.00 0.00 H new ATOM 0 HG1 THR A 65 -6.740 -0.857 -5.368 1.00 0.00 H new ATOM 0 HG21 THR A 65 -6.508 -0.913 -3.003 1.00 0.00 H new ATOM 0 HG22 THR A 65 -7.606 -1.984 -2.100 1.00 0.00 H new ATOM 0 HG23 THR A 65 -6.300 -2.679 -3.089 1.00 0.00 H new ATOM 832 N SER A 66 -6.871 -4.571 -5.160 1.00 0.00 N ATOM 833 CA SER A 66 -5.888 -5.644 -5.189 1.00 0.00 C ATOM 834 C SER A 66 -4.596 -5.137 -5.816 1.00 0.00 C ATOM 835 O SER A 66 -4.616 -4.580 -6.911 1.00 0.00 O ATOM 836 CB SER A 66 -6.450 -6.835 -5.964 1.00 0.00 C ATOM 837 OG SER A 66 -7.676 -7.263 -5.393 1.00 0.00 O ATOM 0 H SER A 66 -6.817 -3.935 -5.956 1.00 0.00 H new ATOM 0 HA SER A 66 -5.668 -5.972 -4.173 1.00 0.00 H new ATOM 0 HB2 SER A 66 -6.604 -6.558 -7.007 1.00 0.00 H new ATOM 0 HB3 SER A 66 -5.732 -7.655 -5.955 1.00 0.00 H new ATOM 0 HG SER A 66 -8.025 -8.025 -5.901 1.00 0.00 H new ATOM 843 N LEU A 67 -3.480 -5.312 -5.113 1.00 0.00 N ATOM 844 CA LEU A 67 -2.189 -4.833 -5.596 1.00 0.00 C ATOM 845 C LEU A 67 -1.195 -5.977 -5.761 1.00 0.00 C ATOM 846 O LEU A 67 -1.140 -6.882 -4.935 1.00 0.00 O ATOM 847 CB LEU A 67 -1.585 -3.800 -4.625 1.00 0.00 C ATOM 848 CG LEU A 67 -2.453 -2.580 -4.279 1.00 0.00 C ATOM 849 CD1 LEU A 67 -3.126 -2.012 -5.519 1.00 0.00 C ATOM 850 CD2 LEU A 67 -3.485 -2.932 -3.218 1.00 0.00 C ATOM 0 H LEU A 67 -3.444 -5.781 -4.208 1.00 0.00 H new ATOM 0 HA LEU A 67 -2.370 -4.369 -6.565 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -1.335 -4.313 -3.696 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -0.649 -3.440 -5.052 1.00 0.00 H new ATOM 0 HG LEU A 67 -1.796 -1.810 -3.874 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -3.733 -1.150 -5.241 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -2.366 -1.704 -6.237 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -3.762 -2.774 -5.969 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -4.087 -2.052 -2.990 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -4.131 -3.728 -3.589 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -2.977 -3.268 -2.314 1.00 0.00 H new ATOM 862 N THR A 68 -0.412 -5.922 -6.825 1.00 0.00 N ATOM 863 CA THR A 68 0.599 -6.934 -7.095 1.00 0.00 C ATOM 864 C THR A 68 1.909 -6.557 -6.401 1.00 0.00 C ATOM 865 O THR A 68 2.491 -5.509 -6.687 1.00 0.00 O ATOM 866 CB THR A 68 0.838 -7.078 -8.613 1.00 0.00 C ATOM 867 OG1 THR A 68 -0.413 -7.265 -9.294 1.00 0.00 O ATOM 868 CG2 THR A 68 1.759 -8.251 -8.916 1.00 0.00 C ATOM 0 H THR A 68 -0.457 -5.180 -7.523 1.00 0.00 H new ATOM 0 HA THR A 68 0.243 -7.888 -6.708 1.00 0.00 H new ATOM 0 HB THR A 68 1.314 -6.163 -8.965 1.00 0.00 H new ATOM 0 HG1 THR A 68 -0.251 -7.354 -10.257 1.00 0.00 H new ATOM 0 HG21 THR A 68 1.909 -8.327 -9.993 1.00 0.00 H new ATOM 0 HG22 THR A 68 2.720 -8.095 -8.426 1.00 0.00 H new ATOM 0 HG23 THR A 68 1.309 -9.172 -8.546 1.00 0.00 H new ATOM 876 N VAL A 69 2.369 -7.403 -5.486 1.00 0.00 N ATOM 877 CA VAL A 69 3.598 -7.126 -4.756 1.00 0.00 C ATOM 878 C VAL A 69 4.835 -7.607 -5.520 1.00 0.00 C ATOM 879 O VAL A 69 4.976 -8.791 -5.838 1.00 0.00 O ATOM 880 CB VAL A 69 3.576 -7.742 -3.335 1.00 0.00 C ATOM 881 CG1 VAL A 69 3.285 -9.237 -3.374 1.00 0.00 C ATOM 882 CG2 VAL A 69 4.885 -7.465 -2.612 1.00 0.00 C ATOM 0 H VAL A 69 1.913 -8.280 -5.234 1.00 0.00 H new ATOM 0 HA VAL A 69 3.659 -6.042 -4.656 1.00 0.00 H new ATOM 0 HB VAL A 69 2.766 -7.267 -2.781 1.00 0.00 H new ATOM 0 HG11 VAL A 69 3.278 -9.633 -2.358 1.00 0.00 H new ATOM 0 HG12 VAL A 69 2.313 -9.406 -3.836 1.00 0.00 H new ATOM 0 HG13 VAL A 69 4.056 -9.743 -3.955 1.00 0.00 H new ATOM 0 HG21 VAL A 69 4.851 -7.905 -1.616 1.00 0.00 H new ATOM 0 HG22 VAL A 69 5.710 -7.902 -3.174 1.00 0.00 H new ATOM 0 HG23 VAL A 69 5.033 -6.388 -2.528 1.00 0.00 H new ATOM 892 N ARG A 70 5.716 -6.668 -5.838 1.00 0.00 N ATOM 893 CA ARG A 70 6.949 -6.976 -6.540 1.00 0.00 C ATOM 894 C ARG A 70 8.082 -7.145 -5.533 1.00 0.00 C ATOM 895 O ARG A 70 7.995 -6.651 -4.408 1.00 0.00 O ATOM 896 CB ARG A 70 7.289 -5.863 -7.536 1.00 0.00 C ATOM 897 CG ARG A 70 6.189 -5.596 -8.555 1.00 0.00 C ATOM 898 CD ARG A 70 6.091 -6.710 -9.581 1.00 0.00 C ATOM 899 NE ARG A 70 4.908 -6.576 -10.426 1.00 0.00 N ATOM 900 CZ ARG A 70 4.518 -7.487 -11.311 1.00 0.00 C ATOM 901 NH1 ARG A 70 5.239 -8.586 -11.505 1.00 0.00 N ATOM 902 NH2 ARG A 70 3.406 -7.296 -12.003 1.00 0.00 N ATOM 0 H ARG A 70 5.595 -5.679 -5.618 1.00 0.00 H new ATOM 0 HA ARG A 70 6.819 -7.906 -7.094 1.00 0.00 H new ATOM 0 HB2 ARG A 70 7.493 -4.945 -6.985 1.00 0.00 H new ATOM 0 HB3 ARG A 70 8.205 -6.128 -8.064 1.00 0.00 H new ATOM 0 HG2 ARG A 70 5.234 -5.491 -8.040 1.00 0.00 H new ATOM 0 HG3 ARG A 70 6.384 -4.651 -9.062 1.00 0.00 H new ATOM 0 HD2 ARG A 70 6.984 -6.707 -10.206 1.00 0.00 H new ATOM 0 HD3 ARG A 70 6.063 -7.672 -9.069 1.00 0.00 H new ATOM 0 HE ARG A 70 4.346 -5.730 -10.331 1.00 0.00 H new ATOM 0 HH11 ARG A 70 6.097 -8.734 -10.973 1.00 0.00 H new ATOM 0 HH12 ARG A 70 4.935 -9.282 -12.186 1.00 0.00 H new ATOM 0 HH21 ARG A 70 2.852 -6.452 -11.856 1.00 0.00 H new ATOM 0 HH22 ARG A 70 3.103 -7.993 -12.683 1.00 0.00 H new ATOM 916 N ARG A 71 9.138 -7.836 -5.940 1.00 0.00 N ATOM 917 CA ARG A 71 10.286 -8.077 -5.066 1.00 0.00 C ATOM 918 C ARG A 71 11.200 -6.854 -5.018 1.00 0.00 C ATOM 919 O ARG A 71 11.719 -6.494 -3.964 1.00 0.00 O ATOM 920 CB ARG A 71 11.068 -9.305 -5.548 1.00 0.00 C ATOM 921 CG ARG A 71 11.954 -9.926 -4.477 1.00 0.00 C ATOM 922 CD ARG A 71 11.204 -10.971 -3.665 1.00 0.00 C ATOM 923 NE ARG A 71 10.826 -12.128 -4.477 1.00 0.00 N ATOM 924 CZ ARG A 71 10.896 -13.394 -4.067 1.00 0.00 C ATOM 925 NH1 ARG A 71 11.344 -13.687 -2.851 1.00 0.00 N ATOM 926 NH2 ARG A 71 10.511 -14.369 -4.879 1.00 0.00 N ATOM 0 H ARG A 71 9.227 -8.242 -6.872 1.00 0.00 H new ATOM 0 HA ARG A 71 9.916 -8.265 -4.058 1.00 0.00 H new ATOM 0 HB2 ARG A 71 10.363 -10.056 -5.905 1.00 0.00 H new ATOM 0 HB3 ARG A 71 11.687 -9.020 -6.398 1.00 0.00 H new ATOM 0 HG2 ARG A 71 12.825 -10.385 -4.946 1.00 0.00 H new ATOM 0 HG3 ARG A 71 12.324 -9.145 -3.813 1.00 0.00 H new ATOM 0 HD2 ARG A 71 11.827 -11.300 -2.833 1.00 0.00 H new ATOM 0 HD3 ARG A 71 10.309 -10.522 -3.235 1.00 0.00 H new ATOM 0 HE ARG A 71 10.485 -11.953 -5.422 1.00 0.00 H new ATOM 0 HH11 ARG A 71 11.638 -12.940 -2.222 1.00 0.00 H new ATOM 0 HH12 ARG A 71 11.394 -14.659 -2.546 1.00 0.00 H new ATOM 0 HH21 ARG A 71 10.163 -14.148 -5.812 1.00 0.00 H new ATOM 0 HH22 ARG A 71 10.562 -15.340 -4.570 1.00 0.00 H new ATOM 940 N SER A 72 11.392 -6.224 -6.166 1.00 0.00 N ATOM 941 CA SER A 72 12.230 -5.039 -6.267 1.00 0.00 C ATOM 942 C SER A 72 11.440 -3.919 -6.939 1.00 0.00 C ATOM 943 O SER A 72 10.868 -4.117 -8.011 1.00 0.00 O ATOM 944 CB SER A 72 13.495 -5.363 -7.060 1.00 0.00 C ATOM 945 OG SER A 72 14.143 -6.504 -6.520 1.00 0.00 O ATOM 0 H SER A 72 10.974 -6.517 -7.049 1.00 0.00 H new ATOM 0 HA SER A 72 12.527 -4.711 -5.271 1.00 0.00 H new ATOM 0 HB2 SER A 72 13.240 -5.543 -8.104 1.00 0.00 H new ATOM 0 HB3 SER A 72 14.172 -4.509 -7.040 1.00 0.00 H new ATOM 0 HG SER A 72 14.768 -6.224 -5.819 1.00 0.00 H new ATOM 951 N PHE A 73 11.411 -2.742 -6.324 1.00 0.00 N ATOM 952 CA PHE A 73 10.641 -1.629 -6.871 1.00 0.00 C ATOM 953 C PHE A 73 11.182 -0.281 -6.413 1.00 0.00 C ATOM 954 O PHE A 73 12.036 -0.205 -5.535 1.00 0.00 O ATOM 955 CB PHE A 73 9.176 -1.762 -6.433 1.00 0.00 C ATOM 956 CG PHE A 73 9.002 -1.828 -4.934 1.00 0.00 C ATOM 957 CD1 PHE A 73 9.136 -3.031 -4.258 1.00 0.00 C ATOM 958 CD2 PHE A 73 8.713 -0.686 -4.202 1.00 0.00 C ATOM 959 CE1 PHE A 73 8.986 -3.093 -2.886 1.00 0.00 C ATOM 960 CE2 PHE A 73 8.560 -0.743 -2.828 1.00 0.00 C ATOM 961 CZ PHE A 73 8.698 -1.950 -2.171 1.00 0.00 C ATOM 0 H PHE A 73 11.905 -2.534 -5.456 1.00 0.00 H new ATOM 0 HA PHE A 73 10.722 -1.670 -7.957 1.00 0.00 H new ATOM 0 HB2 PHE A 73 8.610 -0.914 -6.820 1.00 0.00 H new ATOM 0 HB3 PHE A 73 8.751 -2.660 -6.881 1.00 0.00 H new ATOM 0 HD1 PHE A 73 9.361 -3.931 -4.811 1.00 0.00 H new ATOM 0 HD2 PHE A 73 8.606 0.260 -4.711 1.00 0.00 H new ATOM 0 HE1 PHE A 73 9.094 -4.037 -2.373 1.00 0.00 H new ATOM 0 HE2 PHE A 73 8.333 0.154 -2.271 1.00 0.00 H new ATOM 0 HZ PHE A 73 8.580 -1.998 -1.099 1.00 0.00 H new ATOM 971 N GLU A 74 10.687 0.779 -7.032 1.00 0.00 N ATOM 972 CA GLU A 74 11.080 2.129 -6.671 1.00 0.00 C ATOM 973 C GLU A 74 10.143 2.653 -5.588 1.00 0.00 C ATOM 974 O GLU A 74 8.927 2.465 -5.675 1.00 0.00 O ATOM 975 CB GLU A 74 11.038 3.058 -7.888 1.00 0.00 C ATOM 976 CG GLU A 74 11.380 2.379 -9.203 1.00 0.00 C ATOM 977 CD GLU A 74 10.148 1.904 -9.949 1.00 0.00 C ATOM 978 OE1 GLU A 74 9.585 0.854 -9.571 1.00 0.00 O ATOM 979 OE2 GLU A 74 9.736 2.578 -10.917 1.00 0.00 O ATOM 0 H GLU A 74 10.008 0.728 -7.791 1.00 0.00 H new ATOM 0 HA GLU A 74 12.104 2.106 -6.297 1.00 0.00 H new ATOM 0 HB2 GLU A 74 10.041 3.492 -7.965 1.00 0.00 H new ATOM 0 HB3 GLU A 74 11.733 3.882 -7.726 1.00 0.00 H new ATOM 0 HG2 GLU A 74 11.937 3.073 -9.833 1.00 0.00 H new ATOM 0 HG3 GLU A 74 12.034 1.529 -9.010 1.00 0.00 H new ATOM 986 N GLY A 75 10.705 3.290 -4.574 1.00 0.00 N ATOM 987 CA GLY A 75 9.900 3.820 -3.490 1.00 0.00 C ATOM 988 C GLY A 75 9.494 5.258 -3.729 1.00 0.00 C ATOM 989 O GLY A 75 10.340 6.113 -4.003 1.00 0.00 O ATOM 0 H GLY A 75 11.708 3.451 -4.480 1.00 0.00 H new ATOM 0 HA2 GLY A 75 9.007 3.207 -3.370 1.00 0.00 H new ATOM 0 HA3 GLY A 75 10.460 3.753 -2.557 1.00 0.00 H new ATOM 993 N PHE A 76 8.202 5.522 -3.622 1.00 0.00 N ATOM 994 CA PHE A 76 7.663 6.852 -3.836 1.00 0.00 C ATOM 995 C PHE A 76 6.835 7.282 -2.642 1.00 0.00 C ATOM 996 O PHE A 76 6.201 6.452 -1.984 1.00 0.00 O ATOM 997 CB PHE A 76 6.785 6.883 -5.092 1.00 0.00 C ATOM 998 CG PHE A 76 7.538 7.012 -6.387 1.00 0.00 C ATOM 999 CD1 PHE A 76 8.504 6.085 -6.751 1.00 0.00 C ATOM 1000 CD2 PHE A 76 7.268 8.061 -7.248 1.00 0.00 C ATOM 1001 CE1 PHE A 76 9.184 6.204 -7.950 1.00 0.00 C ATOM 1002 CE2 PHE A 76 7.942 8.184 -8.447 1.00 0.00 C ATOM 1003 CZ PHE A 76 8.902 7.257 -8.796 1.00 0.00 C ATOM 0 H PHE A 76 7.500 4.821 -3.385 1.00 0.00 H new ATOM 0 HA PHE A 76 8.500 7.538 -3.966 1.00 0.00 H new ATOM 0 HB2 PHE A 76 6.189 5.971 -5.124 1.00 0.00 H new ATOM 0 HB3 PHE A 76 6.087 7.716 -5.010 1.00 0.00 H new ATOM 0 HD1 PHE A 76 8.728 5.260 -6.090 1.00 0.00 H new ATOM 0 HD2 PHE A 76 6.521 8.793 -6.979 1.00 0.00 H new ATOM 0 HE1 PHE A 76 9.933 5.475 -8.223 1.00 0.00 H new ATOM 0 HE2 PHE A 76 7.718 9.006 -9.111 1.00 0.00 H new ATOM 0 HZ PHE A 76 9.433 7.355 -9.731 1.00 0.00 H new ATOM 1013 N LEU A 77 6.850 8.569 -2.360 1.00 0.00 N ATOM 1014 CA LEU A 77 6.086 9.113 -1.253 1.00 0.00 C ATOM 1015 C LEU A 77 4.628 9.270 -1.664 1.00 0.00 C ATOM 1016 O LEU A 77 4.301 9.174 -2.847 1.00 0.00 O ATOM 1017 CB LEU A 77 6.653 10.467 -0.816 1.00 0.00 C ATOM 1018 CG LEU A 77 8.131 10.467 -0.424 1.00 0.00 C ATOM 1019 CD1 LEU A 77 8.572 11.870 -0.044 1.00 0.00 C ATOM 1020 CD2 LEU A 77 8.380 9.496 0.720 1.00 0.00 C ATOM 0 H LEU A 77 7.385 9.261 -2.884 1.00 0.00 H new ATOM 0 HA LEU A 77 6.154 8.424 -0.411 1.00 0.00 H new ATOM 0 HB2 LEU A 77 6.511 11.180 -1.628 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.070 10.829 0.031 1.00 0.00 H new ATOM 0 HG LEU A 77 8.720 10.139 -1.281 1.00 0.00 H new ATOM 0 HD11 LEU A 77 9.626 11.858 0.233 1.00 0.00 H new ATOM 0 HD12 LEU A 77 8.428 12.539 -0.892 1.00 0.00 H new ATOM 0 HD13 LEU A 77 7.979 12.222 0.800 1.00 0.00 H new ATOM 0 HD21 LEU A 77 9.437 9.510 0.985 1.00 0.00 H new ATOM 0 HD22 LEU A 77 7.785 9.792 1.584 1.00 0.00 H new ATOM 0 HD23 LEU A 77 8.096 8.490 0.411 1.00 0.00 H new ATOM 1032 N PHE A 78 3.758 9.530 -0.698 1.00 0.00 N ATOM 1033 CA PHE A 78 2.336 9.694 -0.980 1.00 0.00 C ATOM 1034 C PHE A 78 2.100 10.903 -1.878 1.00 0.00 C ATOM 1035 O PHE A 78 1.142 10.939 -2.649 1.00 0.00 O ATOM 1036 CB PHE A 78 1.530 9.848 0.312 1.00 0.00 C ATOM 1037 CG PHE A 78 1.137 8.539 0.943 1.00 0.00 C ATOM 1038 CD1 PHE A 78 0.590 7.519 0.177 1.00 0.00 C ATOM 1039 CD2 PHE A 78 1.312 8.330 2.300 1.00 0.00 C ATOM 1040 CE1 PHE A 78 0.227 6.317 0.753 1.00 0.00 C ATOM 1041 CE2 PHE A 78 0.950 7.127 2.883 1.00 0.00 C ATOM 1042 CZ PHE A 78 0.408 6.120 2.107 1.00 0.00 C ATOM 0 H PHE A 78 4.009 9.632 0.285 1.00 0.00 H new ATOM 0 HA PHE A 78 1.999 8.795 -1.496 1.00 0.00 H new ATOM 0 HB2 PHE A 78 2.116 10.424 1.028 1.00 0.00 H new ATOM 0 HB3 PHE A 78 0.629 10.424 0.101 1.00 0.00 H new ATOM 0 HD1 PHE A 78 0.446 7.667 -0.883 1.00 0.00 H new ATOM 0 HD2 PHE A 78 1.735 9.114 2.911 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -0.198 5.532 0.145 1.00 0.00 H new ATOM 0 HE2 PHE A 78 1.091 6.976 3.943 1.00 0.00 H new ATOM 0 HZ PHE A 78 0.127 5.181 2.559 1.00 0.00 H new ATOM 1052 N ASP A 79 2.976 11.894 -1.769 1.00 0.00 N ATOM 1053 CA ASP A 79 2.867 13.103 -2.576 1.00 0.00 C ATOM 1054 C ASP A 79 3.168 12.804 -4.045 1.00 0.00 C ATOM 1055 O ASP A 79 2.702 13.512 -4.933 1.00 0.00 O ATOM 1056 CB ASP A 79 3.797 14.200 -2.037 1.00 0.00 C ATOM 1057 CG ASP A 79 5.060 14.385 -2.861 1.00 0.00 C ATOM 1058 OD1 ASP A 79 6.032 13.636 -2.645 1.00 0.00 O ATOM 1059 OD2 ASP A 79 5.091 15.289 -3.727 1.00 0.00 O ATOM 0 H ASP A 79 3.770 11.884 -1.129 1.00 0.00 H new ATOM 0 HA ASP A 79 1.841 13.466 -2.510 1.00 0.00 H new ATOM 0 HB2 ASP A 79 3.252 15.144 -2.006 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.075 13.958 -1.011 1.00 0.00 H new ATOM 1064 N GLY A 80 3.935 11.749 -4.297 1.00 0.00 N ATOM 1065 CA GLY A 80 4.256 11.384 -5.664 1.00 0.00 C ATOM 1066 C GLY A 80 5.730 11.518 -5.993 1.00 0.00 C ATOM 1067 O GLY A 80 6.154 11.181 -7.097 1.00 0.00 O ATOM 0 H GLY A 80 4.338 11.143 -3.583 1.00 0.00 H new ATOM 0 HA2 GLY A 80 3.944 10.354 -5.840 1.00 0.00 H new ATOM 0 HA3 GLY A 80 3.681 12.012 -6.344 1.00 0.00 H new ATOM 1071 N THR A 81 6.516 12.023 -5.052 1.00 0.00 N ATOM 1072 CA THR A 81 7.945 12.180 -5.275 1.00 0.00 C ATOM 1073 C THR A 81 8.691 10.879 -4.996 1.00 0.00 C ATOM 1074 O THR A 81 8.380 10.161 -4.044 1.00 0.00 O ATOM 1075 CB THR A 81 8.533 13.298 -4.394 1.00 0.00 C ATOM 1076 OG1 THR A 81 7.727 14.476 -4.498 1.00 0.00 O ATOM 1077 CG2 THR A 81 9.962 13.625 -4.805 1.00 0.00 C ATOM 0 H THR A 81 6.191 12.328 -4.135 1.00 0.00 H new ATOM 0 HA THR A 81 8.074 12.451 -6.323 1.00 0.00 H new ATOM 0 HB THR A 81 8.540 12.946 -3.362 1.00 0.00 H new ATOM 0 HG1 THR A 81 8.106 15.182 -3.934 1.00 0.00 H new ATOM 0 HG21 THR A 81 10.352 14.417 -4.166 1.00 0.00 H new ATOM 0 HG22 THR A 81 10.583 12.736 -4.700 1.00 0.00 H new ATOM 0 HG23 THR A 81 9.975 13.956 -5.843 1.00 0.00 H new ATOM 1085 N ARG A 82 9.668 10.582 -5.838 1.00 0.00 N ATOM 1086 CA ARG A 82 10.472 9.379 -5.687 1.00 0.00 C ATOM 1087 C ARG A 82 11.511 9.576 -4.593 1.00 0.00 C ATOM 1088 O ARG A 82 12.113 10.646 -4.484 1.00 0.00 O ATOM 1089 CB ARG A 82 11.165 9.007 -7.007 1.00 0.00 C ATOM 1090 CG ARG A 82 11.985 10.131 -7.629 1.00 0.00 C ATOM 1091 CD ARG A 82 11.193 10.894 -8.682 1.00 0.00 C ATOM 1092 NE ARG A 82 10.875 10.065 -9.844 1.00 0.00 N ATOM 1093 CZ ARG A 82 9.754 10.173 -10.557 1.00 0.00 C ATOM 1094 NH1 ARG A 82 8.850 11.098 -10.254 1.00 0.00 N ATOM 1095 NH2 ARG A 82 9.542 9.359 -11.584 1.00 0.00 N ATOM 0 H ARG A 82 9.925 11.161 -6.638 1.00 0.00 H new ATOM 0 HA ARG A 82 9.807 8.562 -5.408 1.00 0.00 H new ATOM 0 HB2 ARG A 82 11.818 8.152 -6.831 1.00 0.00 H new ATOM 0 HB3 ARG A 82 10.408 8.688 -7.723 1.00 0.00 H new ATOM 0 HG2 ARG A 82 12.309 10.819 -6.848 1.00 0.00 H new ATOM 0 HG3 ARG A 82 12.886 9.716 -8.082 1.00 0.00 H new ATOM 0 HD2 ARG A 82 10.269 11.266 -8.240 1.00 0.00 H new ATOM 0 HD3 ARG A 82 11.765 11.764 -9.004 1.00 0.00 H new ATOM 0 HE ARG A 82 11.555 9.359 -10.127 1.00 0.00 H new ATOM 0 HH11 ARG A 82 9.011 11.732 -9.471 1.00 0.00 H new ATOM 0 HH12 ARG A 82 7.995 11.175 -10.804 1.00 0.00 H new ATOM 0 HH21 ARG A 82 10.236 8.652 -11.826 1.00 0.00 H new ATOM 0 HH22 ARG A 82 8.685 9.440 -12.131 1.00 0.00 H new ATOM 1109 N TRP A 83 11.700 8.559 -3.770 1.00 0.00 N ATOM 1110 CA TRP A 83 12.679 8.632 -2.697 1.00 0.00 C ATOM 1111 C TRP A 83 13.927 7.853 -3.085 1.00 0.00 C ATOM 1112 O TRP A 83 15.050 8.322 -2.904 1.00 0.00 O ATOM 1113 CB TRP A 83 12.099 8.084 -1.392 1.00 0.00 C ATOM 1114 CG TRP A 83 12.881 8.499 -0.184 1.00 0.00 C ATOM 1115 CD1 TRP A 83 13.857 7.785 0.451 1.00 0.00 C ATOM 1116 CD2 TRP A 83 12.757 9.732 0.534 1.00 0.00 C ATOM 1117 NE1 TRP A 83 14.343 8.497 1.520 1.00 0.00 N ATOM 1118 CE2 TRP A 83 13.683 9.695 1.592 1.00 0.00 C ATOM 1119 CE3 TRP A 83 11.947 10.861 0.387 1.00 0.00 C ATOM 1120 CZ2 TRP A 83 13.824 10.746 2.494 1.00 0.00 C ATOM 1121 CZ3 TRP A 83 12.089 11.904 1.281 1.00 0.00 C ATOM 1122 CH2 TRP A 83 13.019 11.839 2.322 1.00 0.00 C ATOM 0 H TRP A 83 11.192 7.676 -3.823 1.00 0.00 H new ATOM 0 HA TRP A 83 12.943 9.678 -2.538 1.00 0.00 H new ATOM 0 HB2 TRP A 83 11.069 8.426 -1.287 1.00 0.00 H new ATOM 0 HB3 TRP A 83 12.070 6.996 -1.443 1.00 0.00 H new ATOM 0 HD1 TRP A 83 14.197 6.803 0.155 1.00 0.00 H new ATOM 0 HE1 TRP A 83 15.076 8.185 2.157 1.00 0.00 H new ATOM 0 HE3 TRP A 83 11.222 10.917 -0.412 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 14.542 10.700 3.299 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 11.472 12.784 1.174 1.00 0.00 H new ATOM 0 HH2 TRP A 83 13.104 12.670 3.006 1.00 0.00 H new ATOM 1133 N GLY A 84 13.719 6.662 -3.625 1.00 0.00 N ATOM 1134 CA GLY A 84 14.825 5.831 -4.042 1.00 0.00 C ATOM 1135 C GLY A 84 14.379 4.413 -4.313 1.00 0.00 C ATOM 1136 O GLY A 84 13.225 4.071 -4.078 1.00 0.00 O ATOM 0 H GLY A 84 12.797 6.255 -3.782 1.00 0.00 H new ATOM 0 HA2 GLY A 84 15.278 6.250 -4.941 1.00 0.00 H new ATOM 0 HA3 GLY A 84 15.593 5.831 -3.269 1.00 0.00 H new ATOM 1140 N THR A 85 15.285 3.593 -4.811 1.00 0.00 N ATOM 1141 CA THR A 85 14.976 2.206 -5.118 1.00 0.00 C ATOM 1142 C THR A 85 14.953 1.356 -3.847 1.00 0.00 C ATOM 1143 O THR A 85 15.782 1.543 -2.953 1.00 0.00 O ATOM 1144 CB THR A 85 16.005 1.633 -6.107 1.00 0.00 C ATOM 1145 OG1 THR A 85 16.471 2.676 -6.978 1.00 0.00 O ATOM 1146 CG2 THR A 85 15.396 0.507 -6.931 1.00 0.00 C ATOM 0 H THR A 85 16.247 3.864 -5.013 1.00 0.00 H new ATOM 0 HA THR A 85 13.986 2.177 -5.574 1.00 0.00 H new ATOM 0 HB THR A 85 16.843 1.229 -5.539 1.00 0.00 H new ATOM 0 HG1 THR A 85 17.128 2.309 -7.606 1.00 0.00 H new ATOM 0 HG21 THR A 85 16.143 0.118 -7.623 1.00 0.00 H new ATOM 0 HG22 THR A 85 15.065 -0.292 -6.267 1.00 0.00 H new ATOM 0 HG23 THR A 85 14.543 0.888 -7.493 1.00 0.00 H new ATOM 1154 N VAL A 86 13.997 0.439 -3.762 1.00 0.00 N ATOM 1155 CA VAL A 86 13.872 -0.437 -2.604 1.00 0.00 C ATOM 1156 C VAL A 86 13.929 -1.892 -3.051 1.00 0.00 C ATOM 1157 O VAL A 86 13.565 -2.212 -4.184 1.00 0.00 O ATOM 1158 CB VAL A 86 12.549 -0.204 -1.839 1.00 0.00 C ATOM 1159 CG1 VAL A 86 12.692 -0.609 -0.377 1.00 0.00 C ATOM 1160 CG2 VAL A 86 12.095 1.244 -1.952 1.00 0.00 C ATOM 0 H VAL A 86 13.294 0.283 -4.485 1.00 0.00 H new ATOM 0 HA VAL A 86 14.700 -0.207 -1.934 1.00 0.00 H new ATOM 0 HB VAL A 86 11.785 -0.832 -2.297 1.00 0.00 H new ATOM 0 HG11 VAL A 86 11.749 -0.437 0.142 1.00 0.00 H new ATOM 0 HG12 VAL A 86 12.952 -1.666 -0.316 1.00 0.00 H new ATOM 0 HG13 VAL A 86 13.477 -0.015 0.090 1.00 0.00 H new ATOM 0 HG21 VAL A 86 11.162 1.377 -1.404 1.00 0.00 H new ATOM 0 HG22 VAL A 86 12.859 1.899 -1.532 1.00 0.00 H new ATOM 0 HG23 VAL A 86 11.938 1.495 -3.001 1.00 0.00 H new ATOM 1170 N ASP A 87 14.380 -2.770 -2.171 1.00 0.00 N ATOM 1171 CA ASP A 87 14.475 -4.185 -2.495 1.00 0.00 C ATOM 1172 C ASP A 87 13.941 -5.032 -1.353 1.00 0.00 C ATOM 1173 O ASP A 87 14.336 -4.859 -0.203 1.00 0.00 O ATOM 1174 CB ASP A 87 15.923 -4.565 -2.797 1.00 0.00 C ATOM 1175 CG ASP A 87 16.044 -5.984 -3.305 1.00 0.00 C ATOM 1176 OD1 ASP A 87 15.966 -6.192 -4.533 1.00 0.00 O ATOM 1177 OD2 ASP A 87 16.211 -6.904 -2.477 1.00 0.00 O ATOM 0 H ASP A 87 14.686 -2.529 -1.228 1.00 0.00 H new ATOM 0 HA ASP A 87 13.869 -4.375 -3.381 1.00 0.00 H new ATOM 0 HB2 ASP A 87 16.330 -3.879 -3.539 1.00 0.00 H new ATOM 0 HB3 ASP A 87 16.523 -4.451 -1.894 1.00 0.00 H new ATOM 1182 N CYS A 88 13.035 -5.940 -1.673 1.00 0.00 N ATOM 1183 CA CYS A 88 12.442 -6.812 -0.672 1.00 0.00 C ATOM 1184 C CYS A 88 12.900 -8.254 -0.862 1.00 0.00 C ATOM 1185 O CYS A 88 12.238 -9.188 -0.410 1.00 0.00 O ATOM 1186 CB CYS A 88 10.914 -6.734 -0.733 1.00 0.00 C ATOM 1187 SG CYS A 88 10.235 -5.091 -0.331 1.00 0.00 S ATOM 0 H CYS A 88 12.693 -6.093 -2.622 1.00 0.00 H new ATOM 0 HA CYS A 88 12.775 -6.473 0.309 1.00 0.00 H new ATOM 0 HB2 CYS A 88 10.586 -7.016 -1.734 1.00 0.00 H new ATOM 0 HB3 CYS A 88 10.496 -7.467 -0.043 1.00 0.00 H new ATOM 1192 N THR A 89 14.033 -8.436 -1.531 1.00 0.00 N ATOM 1193 CA THR A 89 14.566 -9.769 -1.748 1.00 0.00 C ATOM 1194 C THR A 89 15.319 -10.224 -0.503 1.00 0.00 C ATOM 1195 O THR A 89 15.301 -11.400 -0.141 1.00 0.00 O ATOM 1196 CB THR A 89 15.509 -9.822 -2.965 1.00 0.00 C ATOM 1197 OG1 THR A 89 15.074 -8.889 -3.966 1.00 0.00 O ATOM 1198 CG2 THR A 89 15.547 -11.223 -3.557 1.00 0.00 C ATOM 0 H THR A 89 14.594 -7.682 -1.928 1.00 0.00 H new ATOM 0 HA THR A 89 13.726 -10.434 -1.948 1.00 0.00 H new ATOM 0 HB THR A 89 16.512 -9.555 -2.631 1.00 0.00 H new ATOM 0 HG1 THR A 89 15.680 -8.928 -4.735 1.00 0.00 H new ATOM 0 HG21 THR A 89 16.219 -11.237 -4.415 1.00 0.00 H new ATOM 0 HG22 THR A 89 15.904 -11.926 -2.805 1.00 0.00 H new ATOM 0 HG23 THR A 89 14.545 -11.511 -3.876 1.00 0.00 H new ATOM 1206 N THR A 90 15.973 -9.272 0.156 1.00 0.00 N ATOM 1207 CA THR A 90 16.720 -9.550 1.374 1.00 0.00 C ATOM 1208 C THR A 90 16.197 -8.685 2.523 1.00 0.00 C ATOM 1209 O THR A 90 16.819 -8.591 3.581 1.00 0.00 O ATOM 1210 CB THR A 90 18.240 -9.309 1.175 1.00 0.00 C ATOM 1211 OG1 THR A 90 18.966 -9.722 2.343 1.00 0.00 O ATOM 1212 CG2 THR A 90 18.531 -7.841 0.885 1.00 0.00 C ATOM 0 H THR A 90 15.999 -8.295 -0.137 1.00 0.00 H new ATOM 0 HA THR A 90 16.576 -10.602 1.621 1.00 0.00 H new ATOM 0 HB THR A 90 18.562 -9.902 0.319 1.00 0.00 H new ATOM 0 HG1 THR A 90 18.451 -9.495 3.145 1.00 0.00 H new ATOM 0 HG21 THR A 90 19.604 -7.702 0.750 1.00 0.00 H new ATOM 0 HG22 THR A 90 18.009 -7.539 -0.023 1.00 0.00 H new ATOM 0 HG23 THR A 90 18.188 -7.230 1.720 1.00 0.00 H new ATOM 1220 N ALA A 91 15.041 -8.069 2.304 1.00 0.00 N ATOM 1221 CA ALA A 91 14.422 -7.209 3.305 1.00 0.00 C ATOM 1222 C ALA A 91 12.931 -7.500 3.415 1.00 0.00 C ATOM 1223 O ALA A 91 12.354 -8.152 2.543 1.00 0.00 O ATOM 1224 CB ALA A 91 14.655 -5.747 2.961 1.00 0.00 C ATOM 0 H ALA A 91 14.511 -8.150 1.436 1.00 0.00 H new ATOM 0 HA ALA A 91 14.883 -7.417 4.271 1.00 0.00 H new ATOM 0 HB1 ALA A 91 14.187 -5.116 3.717 1.00 0.00 H new ATOM 0 HB2 ALA A 91 15.726 -5.546 2.933 1.00 0.00 H new ATOM 0 HB3 ALA A 91 14.219 -5.529 1.986 1.00 0.00 H new ATOM 1230 N ALA A 92 12.310 -7.008 4.477 1.00 0.00 N ATOM 1231 CA ALA A 92 10.890 -7.227 4.706 1.00 0.00 C ATOM 1232 C ALA A 92 10.043 -6.209 3.950 1.00 0.00 C ATOM 1233 O ALA A 92 10.270 -5.003 4.038 1.00 0.00 O ATOM 1234 CB ALA A 92 10.583 -7.172 6.196 1.00 0.00 C ATOM 0 H ALA A 92 12.771 -6.452 5.197 1.00 0.00 H new ATOM 0 HA ALA A 92 10.636 -8.218 4.328 1.00 0.00 H new ATOM 0 HB1 ALA A 92 9.517 -7.337 6.354 1.00 0.00 H new ATOM 0 HB2 ALA A 92 11.151 -7.945 6.713 1.00 0.00 H new ATOM 0 HB3 ALA A 92 10.861 -6.194 6.589 1.00 0.00 H new ATOM 1240 N CYS A 93 9.064 -6.710 3.209 1.00 0.00 N ATOM 1241 CA CYS A 93 8.169 -5.861 2.435 1.00 0.00 C ATOM 1242 C CYS A 93 6.853 -5.679 3.189 1.00 0.00 C ATOM 1243 O CYS A 93 6.566 -6.421 4.130 1.00 0.00 O ATOM 1244 CB CYS A 93 7.914 -6.488 1.060 1.00 0.00 C ATOM 1245 SG CYS A 93 8.222 -5.371 -0.348 1.00 0.00 S ATOM 0 H CYS A 93 8.869 -7.708 3.128 1.00 0.00 H new ATOM 0 HA CYS A 93 8.631 -4.884 2.292 1.00 0.00 H new ATOM 0 HB2 CYS A 93 8.546 -7.369 0.954 1.00 0.00 H new ATOM 0 HB3 CYS A 93 6.880 -6.830 1.017 1.00 0.00 H new ATOM 1250 N GLN A 94 6.057 -4.699 2.791 1.00 0.00 N ATOM 1251 CA GLN A 94 4.783 -4.447 3.444 1.00 0.00 C ATOM 1252 C GLN A 94 3.803 -3.788 2.478 1.00 0.00 C ATOM 1253 O GLN A 94 4.119 -3.571 1.308 1.00 0.00 O ATOM 1254 CB GLN A 94 4.982 -3.573 4.688 1.00 0.00 C ATOM 1255 CG GLN A 94 5.643 -2.234 4.409 1.00 0.00 C ATOM 1256 CD GLN A 94 6.899 -2.009 5.233 1.00 0.00 C ATOM 1257 OE1 GLN A 94 7.643 -3.075 5.494 1.00 0.00 O flip ATOM 1258 NE2 GLN A 94 7.204 -0.881 5.623 1.00 0.00 N flip ATOM 0 H GLN A 94 6.271 -4.066 2.020 1.00 0.00 H new ATOM 0 HA GLN A 94 4.363 -5.403 3.757 1.00 0.00 H new ATOM 0 HB2 GLN A 94 4.012 -3.397 5.153 1.00 0.00 H new ATOM 0 HB3 GLN A 94 5.587 -4.121 5.410 1.00 0.00 H new ATOM 0 HG2 GLN A 94 5.894 -2.173 3.350 1.00 0.00 H new ATOM 0 HG3 GLN A 94 4.932 -1.434 4.615 1.00 0.00 H new ATOM 0 HE21 GLN A 94 6.605 -0.086 5.402 1.00 0.00 H new ATOM 0 HE22 GLN A 94 8.055 -0.742 6.167 1.00 0.00 H new ATOM 1267 N VAL A 95 2.606 -3.496 2.964 1.00 0.00 N ATOM 1268 CA VAL A 95 1.581 -2.856 2.153 1.00 0.00 C ATOM 1269 C VAL A 95 1.044 -1.619 2.868 1.00 0.00 C ATOM 1270 O VAL A 95 0.829 -1.641 4.082 1.00 0.00 O ATOM 1271 CB VAL A 95 0.422 -3.831 1.826 1.00 0.00 C ATOM 1272 CG1 VAL A 95 -0.241 -4.356 3.092 1.00 0.00 C ATOM 1273 CG2 VAL A 95 -0.603 -3.172 0.911 1.00 0.00 C ATOM 0 H VAL A 95 2.319 -3.694 3.923 1.00 0.00 H new ATOM 0 HA VAL A 95 2.039 -2.557 1.210 1.00 0.00 H new ATOM 0 HB VAL A 95 0.851 -4.684 1.300 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -1.049 -5.037 2.824 1.00 0.00 H new ATOM 0 HG12 VAL A 95 0.496 -4.887 3.695 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -0.645 -3.521 3.664 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -1.406 -3.877 0.697 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -1.016 -2.291 1.402 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -0.122 -2.876 -0.021 1.00 0.00 H new ATOM 1283 N GLY A 96 0.848 -0.543 2.120 1.00 0.00 N ATOM 1284 CA GLY A 96 0.350 0.682 2.706 1.00 0.00 C ATOM 1285 C GLY A 96 -0.976 1.108 2.116 1.00 0.00 C ATOM 1286 O GLY A 96 -1.149 1.105 0.895 1.00 0.00 O ATOM 0 H GLY A 96 1.026 -0.498 1.117 1.00 0.00 H new ATOM 0 HA2 GLY A 96 0.239 0.548 3.782 1.00 0.00 H new ATOM 0 HA3 GLY A 96 1.082 1.476 2.558 1.00 0.00 H new ATOM 1290 N LEU A 97 -1.914 1.465 2.983 1.00 0.00 N ATOM 1291 CA LEU A 97 -3.239 1.897 2.563 1.00 0.00 C ATOM 1292 C LEU A 97 -3.666 3.112 3.379 1.00 0.00 C ATOM 1293 O LEU A 97 -3.989 2.999 4.561 1.00 0.00 O ATOM 1294 CB LEU A 97 -4.262 0.756 2.710 1.00 0.00 C ATOM 1295 CG LEU A 97 -4.331 0.083 4.087 1.00 0.00 C ATOM 1296 CD1 LEU A 97 -5.736 -0.434 4.343 1.00 0.00 C ATOM 1297 CD2 LEU A 97 -3.328 -1.061 4.192 1.00 0.00 C ATOM 0 H LEU A 97 -1.778 1.463 3.994 1.00 0.00 H new ATOM 0 HA LEU A 97 -3.200 2.173 1.509 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -5.250 1.149 2.470 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -4.033 -0.007 1.966 1.00 0.00 H new ATOM 0 HG LEU A 97 -4.077 0.828 4.841 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -5.776 -0.910 5.323 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -6.440 0.397 4.315 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -6.002 -1.161 3.575 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -3.400 -1.519 5.179 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -3.547 -1.808 3.429 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -2.319 -0.675 4.044 1.00 0.00 H new ATOM 1309 N SER A 98 -3.637 4.284 2.762 1.00 0.00 N ATOM 1310 CA SER A 98 -4.006 5.508 3.459 1.00 0.00 C ATOM 1311 C SER A 98 -4.812 6.440 2.561 1.00 0.00 C ATOM 1312 O SER A 98 -4.929 6.213 1.358 1.00 0.00 O ATOM 1313 CB SER A 98 -2.747 6.219 3.954 1.00 0.00 C ATOM 1314 OG SER A 98 -1.863 5.302 4.578 1.00 0.00 O ATOM 0 H SER A 98 -3.364 4.414 1.788 1.00 0.00 H new ATOM 0 HA SER A 98 -4.633 5.238 4.309 1.00 0.00 H new ATOM 0 HB2 SER A 98 -2.244 6.703 3.117 1.00 0.00 H new ATOM 0 HB3 SER A 98 -3.021 7.004 4.659 1.00 0.00 H new ATOM 0 HG SER A 98 -0.987 5.344 4.142 1.00 0.00 H new ATOM 1320 N ASP A 99 -5.370 7.485 3.163 1.00 0.00 N ATOM 1321 CA ASP A 99 -6.159 8.471 2.435 1.00 0.00 C ATOM 1322 C ASP A 99 -5.251 9.547 1.833 1.00 0.00 C ATOM 1323 O ASP A 99 -4.048 9.335 1.667 1.00 0.00 O ATOM 1324 CB ASP A 99 -7.193 9.111 3.374 1.00 0.00 C ATOM 1325 CG ASP A 99 -6.585 10.158 4.293 1.00 0.00 C ATOM 1326 OD1 ASP A 99 -5.555 9.873 4.930 1.00 0.00 O ATOM 1327 OD2 ASP A 99 -7.130 11.278 4.371 1.00 0.00 O ATOM 0 H ASP A 99 -5.289 7.671 4.163 1.00 0.00 H new ATOM 0 HA ASP A 99 -6.682 7.969 1.621 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -7.982 9.571 2.779 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -7.661 8.333 3.977 1.00 0.00 H new ATOM 1332 N ALA A 100 -5.833 10.697 1.511 1.00 0.00 N ATOM 1333 CA ALA A 100 -5.087 11.803 0.928 1.00 0.00 C ATOM 1334 C ALA A 100 -4.126 12.419 1.943 1.00 0.00 C ATOM 1335 O ALA A 100 -3.034 12.868 1.586 1.00 0.00 O ATOM 1336 CB ALA A 100 -6.044 12.856 0.396 1.00 0.00 C ATOM 0 H ALA A 100 -6.826 10.887 1.646 1.00 0.00 H new ATOM 0 HA ALA A 100 -4.493 11.413 0.101 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -5.475 13.679 -0.038 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -6.683 12.414 -0.368 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -6.661 13.232 1.212 1.00 0.00 H new ATOM 1342 N ALA A 101 -4.532 12.439 3.207 1.00 0.00 N ATOM 1343 CA ALA A 101 -3.694 12.998 4.259 1.00 0.00 C ATOM 1344 C ALA A 101 -2.596 12.016 4.654 1.00 0.00 C ATOM 1345 O ALA A 101 -1.476 12.415 4.984 1.00 0.00 O ATOM 1346 CB ALA A 101 -4.535 13.372 5.472 1.00 0.00 C ATOM 0 H ALA A 101 -5.431 12.077 3.526 1.00 0.00 H new ATOM 0 HA ALA A 101 -3.223 13.902 3.874 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -3.891 13.788 6.247 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -5.280 14.113 5.183 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -5.036 12.483 5.855 1.00 0.00 H new ATOM 1352 N GLY A 102 -2.920 10.731 4.613 1.00 0.00 N ATOM 1353 CA GLY A 102 -1.957 9.711 4.964 1.00 0.00 C ATOM 1354 C GLY A 102 -2.340 8.983 6.236 1.00 0.00 C ATOM 1355 O GLY A 102 -1.478 8.480 6.960 1.00 0.00 O ATOM 0 H GLY A 102 -3.837 10.377 4.341 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -1.874 8.994 4.147 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -0.975 10.167 5.089 1.00 0.00 H new ATOM 1359 N ASN A 103 -3.640 8.926 6.501 1.00 0.00 N ATOM 1360 CA ASN A 103 -4.161 8.262 7.688 1.00 0.00 C ATOM 1361 C ASN A 103 -5.027 7.078 7.285 1.00 0.00 C ATOM 1362 O ASN A 103 -5.284 6.867 6.097 1.00 0.00 O ATOM 1363 CB ASN A 103 -4.983 9.243 8.530 1.00 0.00 C ATOM 1364 CG ASN A 103 -4.169 10.428 9.011 1.00 0.00 C ATOM 1365 OD1 ASN A 103 -3.024 10.280 9.441 1.00 0.00 O ATOM 1366 ND2 ASN A 103 -4.749 11.615 8.938 1.00 0.00 N ATOM 0 H ASN A 103 -4.358 9.336 5.903 1.00 0.00 H new ATOM 0 HA ASN A 103 -3.321 7.905 8.284 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -5.827 9.602 7.941 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -5.396 8.718 9.391 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -4.246 12.448 9.244 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -5.699 11.697 8.576 1.00 0.00 H new ATOM 1373 N GLY A 104 -5.473 6.311 8.267 1.00 0.00 N ATOM 1374 CA GLY A 104 -6.307 5.161 7.988 1.00 0.00 C ATOM 1375 C GLY A 104 -5.870 3.941 8.773 1.00 0.00 C ATOM 1376 O GLY A 104 -5.258 4.075 9.833 1.00 0.00 O ATOM 0 H GLY A 104 -5.272 6.465 9.255 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -7.343 5.397 8.231 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -6.272 4.938 6.922 1.00 0.00 H new ATOM 1380 N PRO A 105 -6.171 2.735 8.275 1.00 0.00 N ATOM 1381 CA PRO A 105 -5.796 1.482 8.941 1.00 0.00 C ATOM 1382 C PRO A 105 -4.280 1.306 9.022 1.00 0.00 C ATOM 1383 O PRO A 105 -3.533 1.877 8.221 1.00 0.00 O ATOM 1384 CB PRO A 105 -6.412 0.393 8.053 1.00 0.00 C ATOM 1385 CG PRO A 105 -7.429 1.098 7.219 1.00 0.00 C ATOM 1386 CD PRO A 105 -6.905 2.490 7.026 1.00 0.00 C ATOM 0 HA PRO A 105 -6.149 1.452 9.972 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -5.654 -0.083 7.431 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -6.871 -0.392 8.654 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -7.566 0.595 6.262 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -8.400 1.111 7.714 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -6.255 2.561 6.154 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -7.711 3.210 6.882 1.00 0.00 H new ATOM 1394 N GLU A 106 -3.839 0.516 9.991 1.00 0.00 N ATOM 1395 CA GLU A 106 -2.419 0.256 10.192 1.00 0.00 C ATOM 1396 C GLU A 106 -1.855 -0.593 9.057 1.00 0.00 C ATOM 1397 O GLU A 106 -2.537 -1.478 8.534 1.00 0.00 O ATOM 1398 CB GLU A 106 -2.204 -0.446 11.536 1.00 0.00 C ATOM 1399 CG GLU A 106 -0.744 -0.707 11.868 1.00 0.00 C ATOM 1400 CD GLU A 106 -0.563 -1.306 13.243 1.00 0.00 C ATOM 1401 OE1 GLU A 106 -0.639 -2.548 13.372 1.00 0.00 O ATOM 1402 OE2 GLU A 106 -0.342 -0.538 14.202 1.00 0.00 O ATOM 0 H GLU A 106 -4.449 0.040 10.656 1.00 0.00 H new ATOM 0 HA GLU A 106 -1.890 1.209 10.197 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -2.643 0.162 12.327 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -2.740 -1.395 11.529 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -0.320 -1.380 11.123 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -0.188 0.228 11.806 1.00 0.00 H new ATOM 1409 N GLY A 107 -0.614 -0.311 8.675 1.00 0.00 N ATOM 1410 CA GLY A 107 0.028 -1.058 7.612 1.00 0.00 C ATOM 1411 C GLY A 107 0.285 -2.500 8.002 1.00 0.00 C ATOM 1412 O GLY A 107 0.367 -2.824 9.188 1.00 0.00 O ATOM 0 H GLY A 107 -0.040 0.425 9.086 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -0.599 -1.030 6.721 1.00 0.00 H new ATOM 0 HA3 GLY A 107 0.972 -0.579 7.353 1.00 0.00 H new ATOM 1416 N VAL A 108 0.407 -3.367 7.009 1.00 0.00 N ATOM 1417 CA VAL A 108 0.644 -4.782 7.258 1.00 0.00 C ATOM 1418 C VAL A 108 1.907 -5.249 6.545 1.00 0.00 C ATOM 1419 O VAL A 108 2.129 -4.914 5.380 1.00 0.00 O ATOM 1420 CB VAL A 108 -0.549 -5.645 6.787 1.00 0.00 C ATOM 1421 CG1 VAL A 108 -0.304 -7.117 7.073 1.00 0.00 C ATOM 1422 CG2 VAL A 108 -1.837 -5.191 7.453 1.00 0.00 C ATOM 0 H VAL A 108 0.346 -3.116 6.022 1.00 0.00 H new ATOM 0 HA VAL A 108 0.764 -4.904 8.334 1.00 0.00 H new ATOM 0 HB VAL A 108 -0.648 -5.516 5.709 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -1.159 -7.701 6.732 1.00 0.00 H new ATOM 0 HG12 VAL A 108 0.593 -7.445 6.548 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -0.170 -7.262 8.145 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -2.664 -5.812 7.107 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -1.740 -5.285 8.535 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -2.032 -4.150 7.195 1.00 0.00 H new ATOM 1432 N ALA A 109 2.730 -6.014 7.244 1.00 0.00 N ATOM 1433 CA ALA A 109 3.961 -6.529 6.672 1.00 0.00 C ATOM 1434 C ALA A 109 3.712 -7.860 5.979 1.00 0.00 C ATOM 1435 O ALA A 109 2.837 -8.627 6.381 1.00 0.00 O ATOM 1436 CB ALA A 109 5.024 -6.683 7.748 1.00 0.00 C ATOM 0 H ALA A 109 2.566 -6.292 8.212 1.00 0.00 H new ATOM 0 HA ALA A 109 4.320 -5.815 5.930 1.00 0.00 H new ATOM 0 HB1 ALA A 109 5.940 -7.070 7.302 1.00 0.00 H new ATOM 0 HB2 ALA A 109 5.224 -5.713 8.203 1.00 0.00 H new ATOM 0 HB3 ALA A 109 4.671 -7.376 8.511 1.00 0.00 H new ATOM 1442 N ILE A 110 4.476 -8.128 4.933 1.00 0.00 N ATOM 1443 CA ILE A 110 4.344 -9.365 4.183 1.00 0.00 C ATOM 1444 C ILE A 110 5.712 -9.999 3.976 1.00 0.00 C ATOM 1445 O ILE A 110 6.742 -9.373 4.232 1.00 0.00 O ATOM 1446 CB ILE A 110 3.657 -9.144 2.817 1.00 0.00 C ATOM 1447 CG1 ILE A 110 4.313 -7.989 2.060 1.00 0.00 C ATOM 1448 CG2 ILE A 110 2.172 -8.876 3.011 1.00 0.00 C ATOM 1449 CD1 ILE A 110 3.712 -7.738 0.696 1.00 0.00 C ATOM 0 H ILE A 110 5.199 -7.500 4.582 1.00 0.00 H new ATOM 0 HA ILE A 110 3.713 -10.035 4.767 1.00 0.00 H new ATOM 0 HB ILE A 110 3.775 -10.050 2.223 1.00 0.00 H new ATOM 0 HG12 ILE A 110 4.229 -7.081 2.657 1.00 0.00 H new ATOM 0 HG13 ILE A 110 5.377 -8.199 1.946 1.00 0.00 H new ATOM 0 HG21 ILE A 110 1.700 -8.722 2.041 1.00 0.00 H new ATOM 0 HG22 ILE A 110 1.710 -9.729 3.508 1.00 0.00 H new ATOM 0 HG23 ILE A 110 2.040 -7.984 3.624 1.00 0.00 H new ATOM 0 HD11 ILE A 110 4.228 -6.905 0.219 1.00 0.00 H new ATOM 0 HD12 ILE A 110 3.820 -8.631 0.081 1.00 0.00 H new ATOM 0 HD13 ILE A 110 2.655 -7.496 0.803 1.00 0.00 H new ATOM 1461 N SER A 111 5.727 -11.236 3.523 1.00 0.00 N ATOM 1462 CA SER A 111 6.977 -11.942 3.304 1.00 0.00 C ATOM 1463 C SER A 111 6.820 -12.998 2.224 1.00 0.00 C ATOM 1464 O SER A 111 5.722 -13.492 1.981 1.00 0.00 O ATOM 1465 CB SER A 111 7.448 -12.584 4.612 1.00 0.00 C ATOM 1466 OG SER A 111 7.788 -11.593 5.570 1.00 0.00 O ATOM 0 H SER A 111 4.890 -11.774 3.299 1.00 0.00 H new ATOM 0 HA SER A 111 7.726 -11.225 2.969 1.00 0.00 H new ATOM 0 HB2 SER A 111 6.662 -13.226 5.010 1.00 0.00 H new ATOM 0 HB3 SER A 111 8.312 -13.220 4.419 1.00 0.00 H new ATOM 0 HG SER A 111 7.619 -10.704 5.195 1.00 0.00 H new ATOM 1472 N PHE A 112 7.924 -13.329 1.576 1.00 0.00 N ATOM 1473 CA PHE A 112 7.926 -14.325 0.518 1.00 0.00 C ATOM 1474 C PHE A 112 8.575 -15.601 1.034 1.00 0.00 C ATOM 1475 O PHE A 112 9.007 -15.655 2.184 1.00 0.00 O ATOM 1476 CB PHE A 112 8.688 -13.797 -0.703 1.00 0.00 C ATOM 1477 CG PHE A 112 8.319 -12.389 -1.091 1.00 0.00 C ATOM 1478 CD1 PHE A 112 7.165 -12.134 -1.811 1.00 0.00 C ATOM 1479 CD2 PHE A 112 9.130 -11.324 -0.731 1.00 0.00 C ATOM 1480 CE1 PHE A 112 6.825 -10.843 -2.167 1.00 0.00 C ATOM 1481 CE2 PHE A 112 8.795 -10.030 -1.084 1.00 0.00 C ATOM 1482 CZ PHE A 112 7.642 -9.790 -1.802 1.00 0.00 C ATOM 0 H PHE A 112 8.838 -12.918 1.766 1.00 0.00 H new ATOM 0 HA PHE A 112 6.900 -14.538 0.217 1.00 0.00 H new ATOM 0 HB2 PHE A 112 9.758 -13.838 -0.497 1.00 0.00 H new ATOM 0 HB3 PHE A 112 8.501 -14.458 -1.550 1.00 0.00 H new ATOM 0 HD1 PHE A 112 6.523 -12.954 -2.098 1.00 0.00 H new ATOM 0 HD2 PHE A 112 10.034 -11.507 -0.169 1.00 0.00 H new ATOM 0 HE1 PHE A 112 5.922 -10.657 -2.730 1.00 0.00 H new ATOM 0 HE2 PHE A 112 9.435 -9.208 -0.798 1.00 0.00 H new ATOM 0 HZ PHE A 112 7.378 -8.780 -2.079 1.00 0.00 H new ATOM 1492 N ASN A 113 8.627 -16.628 0.203 1.00 0.00 N ATOM 1493 CA ASN A 113 9.244 -17.886 0.600 1.00 0.00 C ATOM 1494 C ASN A 113 10.728 -17.858 0.279 1.00 0.00 C ATOM 1495 O ASN A 113 11.505 -18.542 0.970 1.00 0.00 O ATOM 1496 CB ASN A 113 8.575 -19.089 -0.081 1.00 0.00 C ATOM 1497 CG ASN A 113 8.419 -18.924 -1.580 1.00 0.00 C ATOM 1498 OD1 ASN A 113 9.358 -19.134 -2.345 1.00 0.00 O ATOM 1499 ND2 ASN A 113 7.222 -18.569 -2.012 1.00 0.00 N ATOM 1500 OXT ASN A 113 11.117 -17.125 -0.653 1.00 0.00 O ATOM 0 H ASN A 113 8.252 -16.618 -0.746 1.00 0.00 H new ATOM 0 HA ASN A 113 9.107 -18.001 1.675 1.00 0.00 H new ATOM 0 HB2 ASN A 113 9.164 -19.984 0.119 1.00 0.00 H new ATOM 0 HB3 ASN A 113 7.593 -19.248 0.363 1.00 0.00 H new ATOM 0 HD21 ASN A 113 7.052 -18.460 -3.012 1.00 0.00 H new ATOM 0 HD22 ASN A 113 6.468 -18.404 -1.346 1.00 0.00 H new TER 1507 ASN A 113 HETATM 1508 O1 FLN A 114 4.070 5.632 4.491 1.00 20.00 O HETATM 1509 C8A FLN A 114 4.448 6.909 4.103 1.00 20.00 C HETATM 1510 C4A FLN A 114 4.672 7.241 2.755 1.00 20.00 C HETATM 1511 C4 FLN A 114 4.495 6.185 1.720 1.00 20.00 C HETATM 1512 C3 FLN A 114 4.099 4.865 2.206 1.00 20.00 C HETATM 1513 C2 FLN A 114 3.903 4.637 3.529 1.00 20.00 C HETATM 1514 C1' FLN A 114 3.499 3.377 4.248 1.00 20.00 C HETATM 1515 C2' FLN A 114 4.358 2.281 4.293 1.00 20.00 C HETATM 1516 C3' FLN A 114 3.972 1.122 4.966 1.00 20.00 C HETATM 1517 C4' FLN A 114 2.737 0.997 5.618 1.00 20.00 C HETATM 1518 C5' FLN A 114 1.906 2.123 5.551 1.00 20.00 C HETATM 1519 C6' FLN A 114 2.263 3.292 4.886 1.00 20.00 C HETATM 1520 O4 FLN A 114 4.676 6.424 0.519 1.00 20.00 O HETATM 1521 C5 FLN A 114 5.054 8.563 2.422 1.00 20.00 C HETATM 1522 C6 FLN A 114 5.203 9.520 3.439 1.00 20.00 C HETATM 1523 C7 FLN A 114 4.970 9.150 4.782 1.00 20.00 C HETATM 1524 C8 FLN A 114 4.596 7.848 5.118 1.00 20.00 C HETATM 0 H8 FLN A 114 4.423 7.572 6.158 1.00 20.00 H new HETATM 0 H7 FLN A 114 5.084 9.894 5.570 1.00 20.00 H new HETATM 0 H6' FLN A 114 1.578 4.139 4.864 1.00 20.00 H new HETATM 0 H6 FLN A 114 5.496 10.541 3.194 1.00 20.00 H new HETATM 0 H5' FLN A 114 0.934 2.081 6.043 1.00 20.00 H new HETATM 0 H5 FLN A 114 5.231 8.837 1.382 1.00 20.00 H new HETATM 0 H4' FLN A 114 2.444 0.087 6.141 1.00 20.00 H new HETATM 0 H3' FLN A 114 4.660 0.277 4.986 1.00 20.00 H new HETATM 0 H3 FLN A 114 3.959 4.051 1.495 1.00 20.00 H new HETATM 0 H2' FLN A 114 5.330 2.329 3.803 1.00 20.00 H new