USER MOD reduce.3.24.130724 H: found=0, std=0, add=721, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 720 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 23 TYR OH : rot 15:sc= -0.435 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -143:sc= -0.168 (180deg=-1.03) USER MOD Single : A 4 THR OG1 : rot -38:sc= 0.207 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= -0.223 K(o=-0.22,f=-3.2!) USER MOD Single : A 13 SER OG : rot -74:sc= 0.856 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 37 GLN : amide:sc= -0.519 X(o=-0.52,f=-0.22) USER MOD Single : A 39 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 CYS SG : rot 85:sc= 0.988 USER MOD Single : A 43 LYS NZ :NH3+ -134:sc= 0 (180deg=-0.0899) USER MOD Single : A 45 MET CE :methyl -176:sc= -11.1! (180deg=-11.7!) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot -66:sc= 1.18 USER MOD Single : A 53 SER OG : rot 130:sc= -0.482 USER MOD Single : A 60 TYR OH : rot 165:sc= -0.616 USER MOD Single : A 64 SER OG : rot -81:sc= 0.0691 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot 180:sc= -1.91 USER MOD Single : A 71 SER OG : rot 21:sc= 0.996 USER MOD Single : B 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 THR OG1 : rot 180:sc= 0.00417 USER MOD Single : B 22 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -7.207 4.212 5.137 1.00 0.00 N ATOM 2 CA MET A 1 -6.647 4.046 6.509 1.00 0.00 C ATOM 3 C MET A 1 -7.047 2.684 7.082 1.00 0.00 C ATOM 4 O MET A 1 -8.193 2.452 7.412 1.00 0.00 O ATOM 5 CB MET A 1 -7.270 5.177 7.328 1.00 0.00 C ATOM 6 CG MET A 1 -6.732 6.521 6.836 1.00 0.00 C ATOM 7 SD MET A 1 -8.066 7.745 6.843 1.00 0.00 S ATOM 8 CE MET A 1 -7.374 8.842 5.581 1.00 0.00 C ATOM 0 H1 MET A 1 -6.523 4.721 4.542 1.00 0.00 H new ATOM 0 H2 MET A 1 -7.396 3.277 4.724 1.00 0.00 H new ATOM 0 H3 MET A 1 -8.093 4.754 5.187 1.00 0.00 H new ATOM 0 HA MET A 1 -5.558 4.086 6.520 1.00 0.00 H new ATOM 0 HB2 MET A 1 -8.356 5.152 7.235 1.00 0.00 H new ATOM 0 HB3 MET A 1 -7.038 5.045 8.385 1.00 0.00 H new ATOM 0 HG2 MET A 1 -5.915 6.854 7.476 1.00 0.00 H new ATOM 0 HG3 MET A 1 -6.326 6.416 5.830 1.00 0.00 H new ATOM 0 HE1 MET A 1 -8.048 9.684 5.422 1.00 0.00 H new ATOM 0 HE2 MET A 1 -6.404 9.211 5.912 1.00 0.00 H new ATOM 0 HE3 MET A 1 -7.253 8.292 4.648 1.00 0.00 H new ATOM 18 N ALA A 2 -6.111 1.783 7.204 1.00 0.00 N ATOM 19 CA ALA A 2 -6.442 0.438 7.756 1.00 0.00 C ATOM 20 C ALA A 2 -5.177 -0.248 8.283 1.00 0.00 C ATOM 21 O ALA A 2 -4.089 0.286 8.201 1.00 0.00 O ATOM 22 CB ALA A 2 -7.022 -0.344 6.577 1.00 0.00 C ATOM 0 H ALA A 2 -5.134 1.919 6.946 1.00 0.00 H new ATOM 0 HA ALA A 2 -7.141 0.498 8.590 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -7.291 -1.348 6.904 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -7.910 0.166 6.203 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -6.279 -0.408 5.782 1.00 0.00 H new ATOM 28 N ASP A 3 -5.315 -1.428 8.822 1.00 0.00 N ATOM 29 CA ASP A 3 -4.125 -2.151 9.354 1.00 0.00 C ATOM 30 C ASP A 3 -4.510 -3.586 9.729 1.00 0.00 C ATOM 31 O ASP A 3 -4.778 -3.887 10.875 1.00 0.00 O ATOM 32 CB ASP A 3 -3.707 -1.365 10.597 1.00 0.00 C ATOM 33 CG ASP A 3 -2.231 -1.633 10.898 1.00 0.00 C ATOM 34 OD1 ASP A 3 -1.639 -2.436 10.195 1.00 0.00 O ATOM 35 OD2 ASP A 3 -1.717 -1.030 11.826 1.00 0.00 O ATOM 0 H ASP A 3 -6.201 -1.924 8.917 1.00 0.00 H new ATOM 0 HA ASP A 3 -3.317 -2.216 8.625 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -3.869 -0.299 10.438 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -4.322 -1.657 11.449 1.00 0.00 H new ATOM 40 N THR A 4 -4.543 -4.470 8.770 1.00 0.00 N ATOM 41 CA THR A 4 -4.916 -5.883 9.071 1.00 0.00 C ATOM 42 C THR A 4 -3.837 -6.842 8.565 1.00 0.00 C ATOM 43 O THR A 4 -4.050 -8.032 8.460 1.00 0.00 O ATOM 44 CB THR A 4 -6.229 -6.112 8.319 1.00 0.00 C ATOM 45 OG1 THR A 4 -6.835 -7.310 8.783 1.00 0.00 O ATOM 46 CG2 THR A 4 -5.950 -6.226 6.820 1.00 0.00 C ATOM 0 H THR A 4 -4.328 -4.276 7.792 1.00 0.00 H new ATOM 0 HA THR A 4 -5.018 -6.061 10.142 1.00 0.00 H new ATOM 0 HB THR A 4 -6.900 -5.272 8.497 1.00 0.00 H new ATOM 0 HG1 THR A 4 -6.143 -7.984 8.947 1.00 0.00 H new ATOM 0 HG21 THR A 4 -6.887 -6.389 6.287 1.00 0.00 H new ATOM 0 HG22 THR A 4 -5.486 -5.306 6.465 1.00 0.00 H new ATOM 0 HG23 THR A 4 -5.278 -7.065 6.638 1.00 0.00 H new ATOM 54 N ASP A 5 -2.679 -6.333 8.246 1.00 0.00 N ATOM 55 CA ASP A 5 -1.591 -7.220 7.744 1.00 0.00 C ATOM 56 C ASP A 5 -0.239 -6.790 8.320 1.00 0.00 C ATOM 57 O ASP A 5 0.306 -5.767 7.954 1.00 0.00 O ATOM 58 CB ASP A 5 -1.607 -7.045 6.226 1.00 0.00 C ATOM 59 CG ASP A 5 -1.908 -8.388 5.559 1.00 0.00 C ATOM 60 OD1 ASP A 5 -1.203 -9.341 5.847 1.00 0.00 O ATOM 61 OD2 ASP A 5 -2.839 -8.441 4.773 1.00 0.00 O ATOM 0 H ASP A 5 -2.439 -5.344 8.311 1.00 0.00 H new ATOM 0 HA ASP A 5 -1.741 -8.259 8.038 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -2.360 -6.310 5.942 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -0.645 -6.665 5.883 1.00 0.00 H new ATOM 66 N THR A 6 0.308 -7.566 9.216 1.00 0.00 N ATOM 67 CA THR A 6 1.627 -7.205 9.811 1.00 0.00 C ATOM 68 C THR A 6 2.700 -8.193 9.344 1.00 0.00 C ATOM 69 O THR A 6 3.790 -7.811 8.968 1.00 0.00 O ATOM 70 CB THR A 6 1.423 -7.309 11.323 1.00 0.00 C ATOM 71 OG1 THR A 6 0.285 -6.545 11.698 1.00 0.00 O ATOM 72 CG2 THR A 6 2.661 -6.775 12.045 1.00 0.00 C ATOM 0 H THR A 6 -0.101 -8.434 9.562 1.00 0.00 H new ATOM 0 HA THR A 6 1.958 -6.210 9.514 1.00 0.00 H new ATOM 0 HB THR A 6 1.268 -8.352 11.599 1.00 0.00 H new ATOM 0 HG1 THR A 6 0.151 -6.611 12.667 1.00 0.00 H new ATOM 0 HG21 THR A 6 2.514 -6.850 13.122 1.00 0.00 H new ATOM 0 HG22 THR A 6 3.532 -7.362 11.756 1.00 0.00 H new ATOM 0 HG23 THR A 6 2.820 -5.732 11.772 1.00 0.00 H new ATOM 80 N ALA A 7 2.395 -9.462 9.360 1.00 0.00 N ATOM 81 CA ALA A 7 3.393 -10.475 8.910 1.00 0.00 C ATOM 82 C ALA A 7 3.656 -10.313 7.413 1.00 0.00 C ATOM 83 O ALA A 7 4.785 -10.309 6.965 1.00 0.00 O ATOM 84 CB ALA A 7 2.743 -11.828 9.200 1.00 0.00 C ATOM 0 H ALA A 7 1.499 -9.841 9.665 1.00 0.00 H new ATOM 0 HA ALA A 7 4.352 -10.371 9.417 1.00 0.00 H new ATOM 0 HB1 ALA A 7 3.417 -12.628 8.896 1.00 0.00 H new ATOM 0 HB2 ALA A 7 2.538 -11.912 10.267 1.00 0.00 H new ATOM 0 HB3 ALA A 7 1.809 -11.910 8.644 1.00 0.00 H new ATOM 90 N GLU A 8 2.617 -10.168 6.637 1.00 0.00 N ATOM 91 CA GLU A 8 2.798 -9.995 5.169 1.00 0.00 C ATOM 92 C GLU A 8 3.741 -8.821 4.899 1.00 0.00 C ATOM 93 O GLU A 8 4.538 -8.848 3.981 1.00 0.00 O ATOM 94 CB GLU A 8 1.401 -9.698 4.625 1.00 0.00 C ATOM 95 CG GLU A 8 1.399 -9.858 3.104 1.00 0.00 C ATOM 96 CD GLU A 8 0.013 -9.512 2.555 1.00 0.00 C ATOM 97 OE1 GLU A 8 -0.473 -8.438 2.866 1.00 0.00 O ATOM 98 OE2 GLU A 8 -0.537 -10.328 1.834 1.00 0.00 O ATOM 0 H GLU A 8 1.649 -10.162 6.958 1.00 0.00 H new ATOM 0 HA GLU A 8 3.234 -10.875 4.697 1.00 0.00 H new ATOM 0 HB2 GLU A 8 0.674 -10.375 5.073 1.00 0.00 H new ATOM 0 HB3 GLU A 8 1.102 -8.685 4.895 1.00 0.00 H new ATOM 0 HG2 GLU A 8 2.151 -9.207 2.658 1.00 0.00 H new ATOM 0 HG3 GLU A 8 1.663 -10.881 2.835 1.00 0.00 H new ATOM 105 N GLN A 9 3.657 -7.790 5.695 1.00 0.00 N ATOM 106 CA GLN A 9 4.549 -6.613 5.485 1.00 0.00 C ATOM 107 C GLN A 9 6.014 -7.031 5.637 1.00 0.00 C ATOM 108 O GLN A 9 6.872 -6.599 4.894 1.00 0.00 O ATOM 109 CB GLN A 9 4.158 -5.619 6.580 1.00 0.00 C ATOM 110 CG GLN A 9 4.191 -4.197 6.016 1.00 0.00 C ATOM 111 CD GLN A 9 3.143 -3.341 6.729 1.00 0.00 C ATOM 112 OE1 GLN A 9 2.267 -3.861 7.392 1.00 0.00 O ATOM 113 NE2 GLN A 9 3.194 -2.041 6.622 1.00 0.00 N ATOM 0 H GLN A 9 3.011 -7.711 6.480 1.00 0.00 H new ATOM 0 HA GLN A 9 4.441 -6.183 4.489 1.00 0.00 H new ATOM 0 HB2 GLN A 9 3.161 -5.849 6.955 1.00 0.00 H new ATOM 0 HB3 GLN A 9 4.843 -5.703 7.423 1.00 0.00 H new ATOM 0 HG2 GLN A 9 5.182 -3.764 6.150 1.00 0.00 H new ATOM 0 HG3 GLN A 9 3.994 -4.215 4.944 1.00 0.00 H new ATOM 0 HE21 GLN A 9 3.929 -1.603 6.066 1.00 0.00 H new ATOM 0 HE22 GLN A 9 2.499 -1.463 7.095 1.00 0.00 H new ATOM 122 N VAL A 10 6.307 -7.874 6.590 1.00 0.00 N ATOM 123 CA VAL A 10 7.716 -8.321 6.780 1.00 0.00 C ATOM 124 C VAL A 10 8.233 -8.977 5.497 1.00 0.00 C ATOM 125 O VAL A 10 9.269 -8.616 4.976 1.00 0.00 O ATOM 126 CB VAL A 10 7.660 -9.337 7.921 1.00 0.00 C ATOM 127 CG1 VAL A 10 9.043 -9.955 8.124 1.00 0.00 C ATOM 128 CG2 VAL A 10 7.224 -8.632 9.208 1.00 0.00 C ATOM 0 H VAL A 10 5.633 -8.272 7.244 1.00 0.00 H new ATOM 0 HA VAL A 10 8.388 -7.494 7.009 1.00 0.00 H new ATOM 0 HB VAL A 10 6.945 -10.122 7.674 1.00 0.00 H new ATOM 0 HG11 VAL A 10 9.002 -10.679 8.938 1.00 0.00 H new ATOM 0 HG12 VAL A 10 9.356 -10.456 7.208 1.00 0.00 H new ATOM 0 HG13 VAL A 10 9.759 -9.171 8.372 1.00 0.00 H new ATOM 0 HG21 VAL A 10 7.183 -9.355 10.023 1.00 0.00 H new ATOM 0 HG22 VAL A 10 7.940 -7.848 9.454 1.00 0.00 H new ATOM 0 HG23 VAL A 10 6.238 -8.191 9.065 1.00 0.00 H new ATOM 138 N ILE A 11 7.512 -9.934 4.979 1.00 0.00 N ATOM 139 CA ILE A 11 7.956 -10.607 3.726 1.00 0.00 C ATOM 140 C ILE A 11 8.170 -9.560 2.633 1.00 0.00 C ATOM 141 O ILE A 11 9.197 -9.524 1.986 1.00 0.00 O ATOM 142 CB ILE A 11 6.816 -11.554 3.353 1.00 0.00 C ATOM 143 CG1 ILE A 11 6.747 -12.692 4.374 1.00 0.00 C ATOM 144 CG2 ILE A 11 7.067 -12.136 1.960 1.00 0.00 C ATOM 145 CD1 ILE A 11 5.592 -13.631 4.017 1.00 0.00 C ATOM 0 H ILE A 11 6.635 -10.279 5.370 1.00 0.00 H new ATOM 0 HA ILE A 11 8.896 -11.145 3.849 1.00 0.00 H new ATOM 0 HB ILE A 11 5.874 -11.005 3.352 1.00 0.00 H new ATOM 0 HG12 ILE A 11 7.687 -13.243 4.384 1.00 0.00 H new ATOM 0 HG13 ILE A 11 6.604 -12.287 5.376 1.00 0.00 H new ATOM 0 HG21 ILE A 11 6.253 -12.811 1.696 1.00 0.00 H new ATOM 0 HG22 ILE A 11 7.118 -11.327 1.231 1.00 0.00 H new ATOM 0 HG23 ILE A 11 8.009 -12.685 1.959 1.00 0.00 H new ATOM 0 HD11 ILE A 11 5.544 -14.441 4.745 1.00 0.00 H new ATOM 0 HD12 ILE A 11 4.654 -13.075 4.030 1.00 0.00 H new ATOM 0 HD13 ILE A 11 5.755 -14.046 3.022 1.00 0.00 H new ATOM 157 N ALA A 12 7.212 -8.694 2.435 1.00 0.00 N ATOM 158 CA ALA A 12 7.375 -7.640 1.397 1.00 0.00 C ATOM 159 C ALA A 12 8.625 -6.824 1.714 1.00 0.00 C ATOM 160 O ALA A 12 9.394 -6.475 0.839 1.00 0.00 O ATOM 161 CB ALA A 12 6.119 -6.774 1.503 1.00 0.00 C ATOM 0 H ALA A 12 6.329 -8.672 2.945 1.00 0.00 H new ATOM 0 HA ALA A 12 7.490 -8.045 0.392 1.00 0.00 H new ATOM 0 HB1 ALA A 12 6.167 -5.972 0.766 1.00 0.00 H new ATOM 0 HB2 ALA A 12 5.237 -7.387 1.316 1.00 0.00 H new ATOM 0 HB3 ALA A 12 6.056 -6.345 2.503 1.00 0.00 H new ATOM 167 N SER A 13 8.844 -6.534 2.968 1.00 0.00 N ATOM 168 CA SER A 13 10.057 -5.761 3.352 1.00 0.00 C ATOM 169 C SER A 13 11.298 -6.609 3.079 1.00 0.00 C ATOM 170 O SER A 13 12.320 -6.115 2.642 1.00 0.00 O ATOM 171 CB SER A 13 9.903 -5.495 4.849 1.00 0.00 C ATOM 172 OG SER A 13 10.540 -6.535 5.579 1.00 0.00 O ATOM 0 H SER A 13 8.235 -6.799 3.742 1.00 0.00 H new ATOM 0 HA SER A 13 10.163 -4.832 2.792 1.00 0.00 H new ATOM 0 HB2 SER A 13 10.344 -4.532 5.106 1.00 0.00 H new ATOM 0 HB3 SER A 13 8.847 -5.443 5.114 1.00 0.00 H new ATOM 0 HG SER A 13 9.994 -7.348 5.535 1.00 0.00 H new ATOM 178 N PHE A 14 11.213 -7.891 3.323 1.00 0.00 N ATOM 179 CA PHE A 14 12.384 -8.780 3.065 1.00 0.00 C ATOM 180 C PHE A 14 12.637 -8.876 1.559 1.00 0.00 C ATOM 181 O PHE A 14 13.760 -8.799 1.102 1.00 0.00 O ATOM 182 CB PHE A 14 11.983 -10.142 3.632 1.00 0.00 C ATOM 183 CG PHE A 14 12.533 -10.284 5.031 1.00 0.00 C ATOM 184 CD1 PHE A 14 13.916 -10.242 5.246 1.00 0.00 C ATOM 185 CD2 PHE A 14 11.661 -10.459 6.114 1.00 0.00 C ATOM 186 CE1 PHE A 14 14.427 -10.374 6.543 1.00 0.00 C ATOM 187 CE2 PHE A 14 12.173 -10.590 7.410 1.00 0.00 C ATOM 188 CZ PHE A 14 13.556 -10.548 7.625 1.00 0.00 C ATOM 0 H PHE A 14 10.385 -8.360 3.689 1.00 0.00 H new ATOM 0 HA PHE A 14 13.300 -8.408 3.523 1.00 0.00 H new ATOM 0 HB2 PHE A 14 10.897 -10.238 3.645 1.00 0.00 H new ATOM 0 HB3 PHE A 14 12.366 -10.940 2.996 1.00 0.00 H new ATOM 0 HD1 PHE A 14 14.588 -10.108 4.412 1.00 0.00 H new ATOM 0 HD2 PHE A 14 10.594 -10.493 5.949 1.00 0.00 H new ATOM 0 HE1 PHE A 14 15.494 -10.342 6.709 1.00 0.00 H new ATOM 0 HE2 PHE A 14 11.501 -10.724 8.245 1.00 0.00 H new ATOM 0 HZ PHE A 14 13.951 -10.650 8.625 1.00 0.00 H new ATOM 198 N ARG A 15 11.598 -9.034 0.784 1.00 0.00 N ATOM 199 CA ARG A 15 11.782 -9.123 -0.692 1.00 0.00 C ATOM 200 C ARG A 15 12.583 -7.913 -1.178 1.00 0.00 C ATOM 201 O ARG A 15 13.540 -8.043 -1.914 1.00 0.00 O ATOM 202 CB ARG A 15 10.367 -9.104 -1.271 1.00 0.00 C ATOM 203 CG ARG A 15 10.301 -10.019 -2.494 1.00 0.00 C ATOM 204 CD ARG A 15 9.825 -11.409 -2.068 1.00 0.00 C ATOM 205 NE ARG A 15 8.368 -11.429 -2.374 1.00 0.00 N ATOM 206 CZ ARG A 15 7.615 -12.392 -1.914 1.00 0.00 C ATOM 207 NH1 ARG A 15 8.133 -13.333 -1.170 1.00 0.00 N ATOM 208 NH2 ARG A 15 6.341 -12.414 -2.194 1.00 0.00 N ATOM 0 H ARG A 15 10.633 -9.105 1.108 1.00 0.00 H new ATOM 0 HA ARG A 15 12.326 -10.017 -0.997 1.00 0.00 H new ATOM 0 HB2 ARG A 15 9.651 -9.434 -0.518 1.00 0.00 H new ATOM 0 HB3 ARG A 15 10.091 -8.087 -1.550 1.00 0.00 H new ATOM 0 HG2 ARG A 15 9.621 -9.602 -3.237 1.00 0.00 H new ATOM 0 HG3 ARG A 15 11.282 -10.087 -2.963 1.00 0.00 H new ATOM 0 HD2 ARG A 15 10.353 -12.191 -2.613 1.00 0.00 H new ATOM 0 HD3 ARG A 15 10.008 -11.581 -1.007 1.00 0.00 H new ATOM 0 HE ARG A 15 7.957 -10.689 -2.944 1.00 0.00 H new ATOM 0 HH11 ARG A 15 9.128 -13.317 -0.947 1.00 0.00 H new ATOM 0 HH12 ARG A 15 7.542 -14.084 -0.812 1.00 0.00 H new ATOM 0 HH21 ARG A 15 5.933 -11.679 -2.772 1.00 0.00 H new ATOM 0 HH22 ARG A 15 5.753 -13.166 -1.835 1.00 0.00 H new ATOM 222 N ILE A 16 12.204 -6.738 -0.757 1.00 0.00 N ATOM 223 CA ILE A 16 12.951 -5.521 -1.180 1.00 0.00 C ATOM 224 C ILE A 16 14.412 -5.636 -0.739 1.00 0.00 C ATOM 225 O ILE A 16 15.323 -5.313 -1.475 1.00 0.00 O ATOM 226 CB ILE A 16 12.264 -4.361 -0.458 1.00 0.00 C ATOM 227 CG1 ILE A 16 10.871 -4.143 -1.053 1.00 0.00 C ATOM 228 CG2 ILE A 16 13.097 -3.090 -0.629 1.00 0.00 C ATOM 229 CD1 ILE A 16 10.140 -3.059 -0.259 1.00 0.00 C ATOM 0 H ILE A 16 11.410 -6.568 -0.139 1.00 0.00 H new ATOM 0 HA ILE A 16 12.947 -5.382 -2.261 1.00 0.00 H new ATOM 0 HB ILE A 16 12.173 -4.596 0.603 1.00 0.00 H new ATOM 0 HG12 ILE A 16 10.953 -3.849 -2.099 1.00 0.00 H new ATOM 0 HG13 ILE A 16 10.303 -5.073 -1.027 1.00 0.00 H new ATOM 0 HG21 ILE A 16 12.608 -2.263 -0.115 1.00 0.00 H new ATOM 0 HG22 ILE A 16 14.089 -3.245 -0.205 1.00 0.00 H new ATOM 0 HG23 ILE A 16 13.188 -2.855 -1.689 1.00 0.00 H new ATOM 0 HD11 ILE A 16 9.148 -2.904 -0.683 1.00 0.00 H new ATOM 0 HD12 ILE A 16 10.045 -3.371 0.781 1.00 0.00 H new ATOM 0 HD13 ILE A 16 10.705 -2.128 -0.308 1.00 0.00 H new ATOM 241 N LEU A 17 14.638 -6.103 0.459 1.00 0.00 N ATOM 242 CA LEU A 17 16.038 -6.249 0.955 1.00 0.00 C ATOM 243 C LEU A 17 16.784 -7.291 0.117 1.00 0.00 C ATOM 244 O LEU A 17 17.948 -7.135 -0.194 1.00 0.00 O ATOM 245 CB LEU A 17 15.896 -6.726 2.401 1.00 0.00 C ATOM 246 CG LEU A 17 16.083 -5.544 3.352 1.00 0.00 C ATOM 247 CD1 LEU A 17 17.474 -4.941 3.149 1.00 0.00 C ATOM 248 CD2 LEU A 17 15.019 -4.482 3.063 1.00 0.00 C ATOM 0 H LEU A 17 13.913 -6.390 1.117 1.00 0.00 H new ATOM 0 HA LEU A 17 16.603 -5.319 0.886 1.00 0.00 H new ATOM 0 HB2 LEU A 17 14.914 -7.175 2.552 1.00 0.00 H new ATOM 0 HB3 LEU A 17 16.636 -7.498 2.614 1.00 0.00 H new ATOM 0 HG LEU A 17 15.983 -5.887 4.382 1.00 0.00 H new ATOM 0 HD11 LEU A 17 17.608 -4.098 3.827 1.00 0.00 H new ATOM 0 HD12 LEU A 17 18.232 -5.697 3.356 1.00 0.00 H new ATOM 0 HD13 LEU A 17 17.575 -4.598 2.119 1.00 0.00 H new ATOM 0 HD21 LEU A 17 15.152 -3.639 3.741 1.00 0.00 H new ATOM 0 HD22 LEU A 17 15.118 -4.138 2.033 1.00 0.00 H new ATOM 0 HD23 LEU A 17 14.028 -4.911 3.208 1.00 0.00 H new ATOM 260 N ALA A 18 16.120 -8.355 -0.249 1.00 0.00 N ATOM 261 CA ALA A 18 16.789 -9.408 -1.066 1.00 0.00 C ATOM 262 C ALA A 18 16.767 -9.023 -2.547 1.00 0.00 C ATOM 263 O ALA A 18 17.083 -9.818 -3.410 1.00 0.00 O ATOM 264 CB ALA A 18 15.965 -10.674 -0.831 1.00 0.00 C ATOM 0 H ALA A 18 15.144 -8.540 -0.018 1.00 0.00 H new ATOM 0 HA ALA A 18 17.834 -9.543 -0.788 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.394 -11.498 -1.400 1.00 0.00 H new ATOM 0 HB2 ALA A 18 15.974 -10.922 0.230 1.00 0.00 H new ATOM 0 HB3 ALA A 18 14.938 -10.505 -1.155 1.00 0.00 H new ATOM 270 N SER A 19 16.394 -7.809 -2.847 1.00 0.00 N ATOM 271 CA SER A 19 16.350 -7.372 -4.272 1.00 0.00 C ATOM 272 C SER A 19 15.352 -8.226 -5.057 1.00 0.00 C ATOM 273 O SER A 19 15.692 -8.839 -6.050 1.00 0.00 O ATOM 274 CB SER A 19 17.768 -7.587 -4.797 1.00 0.00 C ATOM 275 OG SER A 19 18.060 -6.602 -5.779 1.00 0.00 O ATOM 0 H SER A 19 16.118 -7.101 -2.167 1.00 0.00 H new ATOM 0 HA SER A 19 16.030 -6.335 -4.375 1.00 0.00 H new ATOM 0 HB2 SER A 19 18.485 -7.524 -3.978 1.00 0.00 H new ATOM 0 HB3 SER A 19 17.862 -8.584 -5.227 1.00 0.00 H new ATOM 0 HG SER A 19 18.970 -6.736 -6.117 1.00 0.00 H new ATOM 281 N ASP A 20 14.122 -8.271 -4.622 1.00 0.00 N ATOM 282 CA ASP A 20 13.105 -9.086 -5.348 1.00 0.00 C ATOM 283 C ASP A 20 13.566 -10.543 -5.446 1.00 0.00 C ATOM 284 O ASP A 20 13.718 -11.085 -6.522 1.00 0.00 O ATOM 285 CB ASP A 20 13.017 -8.457 -6.739 1.00 0.00 C ATOM 286 CG ASP A 20 11.778 -8.985 -7.464 1.00 0.00 C ATOM 287 OD1 ASP A 20 11.430 -10.133 -7.242 1.00 0.00 O ATOM 288 OD2 ASP A 20 11.198 -8.232 -8.230 1.00 0.00 O ATOM 0 H ASP A 20 13.777 -7.780 -3.797 1.00 0.00 H new ATOM 0 HA ASP A 20 12.140 -9.092 -4.840 1.00 0.00 H new ATOM 0 HB2 ASP A 20 12.967 -7.371 -6.656 1.00 0.00 H new ATOM 0 HB3 ASP A 20 13.914 -8.692 -7.313 1.00 0.00 H new ATOM 293 N LYS A 21 13.788 -11.181 -4.329 1.00 0.00 N ATOM 294 CA LYS A 21 14.239 -12.601 -4.360 1.00 0.00 C ATOM 295 C LYS A 21 13.555 -13.396 -3.247 1.00 0.00 C ATOM 296 O LYS A 21 13.327 -12.886 -2.168 1.00 0.00 O ATOM 297 CB LYS A 21 15.749 -12.543 -4.128 1.00 0.00 C ATOM 298 CG LYS A 21 16.421 -11.854 -5.317 1.00 0.00 C ATOM 299 CD LYS A 21 17.871 -12.331 -5.434 1.00 0.00 C ATOM 300 CE LYS A 21 18.655 -11.368 -6.328 1.00 0.00 C ATOM 301 NZ LYS A 21 18.700 -12.034 -7.660 1.00 0.00 N ATOM 0 H LYS A 21 13.677 -10.781 -3.397 1.00 0.00 H new ATOM 0 HA LYS A 21 13.991 -13.093 -5.300 1.00 0.00 H new ATOM 0 HB2 LYS A 21 15.966 -11.999 -3.209 1.00 0.00 H new ATOM 0 HB3 LYS A 21 16.148 -13.550 -4.004 1.00 0.00 H new ATOM 0 HG2 LYS A 21 15.878 -12.079 -6.235 1.00 0.00 H new ATOM 0 HG3 LYS A 21 16.393 -10.772 -5.187 1.00 0.00 H new ATOM 0 HD2 LYS A 21 18.329 -12.381 -4.446 1.00 0.00 H new ATOM 0 HD3 LYS A 21 17.901 -13.338 -5.851 1.00 0.00 H new ATOM 0 HE2 LYS A 21 18.164 -10.396 -6.388 1.00 0.00 H new ATOM 0 HE3 LYS A 21 19.658 -11.195 -5.938 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 19.222 -11.435 -8.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 19.178 -12.953 -7.572 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 17.731 -12.180 -8.008 1.00 0.00 H new ATOM 315 N PRO A 22 13.258 -14.629 -3.550 1.00 0.00 N ATOM 316 CA PRO A 22 12.599 -15.484 -2.527 1.00 0.00 C ATOM 317 C PRO A 22 13.618 -15.914 -1.469 1.00 0.00 C ATOM 318 O PRO A 22 13.302 -16.636 -0.544 1.00 0.00 O ATOM 319 CB PRO A 22 12.088 -16.694 -3.309 1.00 0.00 C ATOM 320 CG PRO A 22 12.076 -16.267 -4.739 1.00 0.00 C ATOM 321 CD PRO A 22 13.128 -15.206 -4.893 1.00 0.00 C ATOM 0 HA PRO A 22 11.796 -14.968 -2.000 1.00 0.00 H new ATOM 0 HB2 PRO A 22 12.736 -17.558 -3.163 1.00 0.00 H new ATOM 0 HB3 PRO A 22 11.091 -16.983 -2.977 1.00 0.00 H new ATOM 0 HG2 PRO A 22 12.283 -17.113 -5.395 1.00 0.00 H new ATOM 0 HG3 PRO A 22 11.096 -15.880 -5.017 1.00 0.00 H new ATOM 0 HD2 PRO A 22 14.072 -15.628 -5.238 1.00 0.00 H new ATOM 0 HD3 PRO A 22 12.830 -14.453 -5.623 1.00 0.00 H new ATOM 329 N TYR A 23 14.842 -15.475 -1.598 1.00 0.00 N ATOM 330 CA TYR A 23 15.882 -15.857 -0.600 1.00 0.00 C ATOM 331 C TYR A 23 16.810 -14.671 -0.324 1.00 0.00 C ATOM 332 O TYR A 23 17.030 -13.832 -1.174 1.00 0.00 O ATOM 333 CB TYR A 23 16.655 -17.001 -1.257 1.00 0.00 C ATOM 334 CG TYR A 23 17.026 -16.612 -2.668 1.00 0.00 C ATOM 335 CD1 TYR A 23 18.019 -15.651 -2.892 1.00 0.00 C ATOM 336 CD2 TYR A 23 16.376 -17.212 -3.754 1.00 0.00 C ATOM 337 CE1 TYR A 23 18.362 -15.290 -4.200 1.00 0.00 C ATOM 338 CE2 TYR A 23 16.719 -16.852 -5.061 1.00 0.00 C ATOM 339 CZ TYR A 23 17.712 -15.890 -5.285 1.00 0.00 C ATOM 340 OH TYR A 23 18.050 -15.534 -6.575 1.00 0.00 O ATOM 0 H TYR A 23 15.166 -14.869 -2.351 1.00 0.00 H new ATOM 0 HA TYR A 23 15.451 -16.151 0.357 1.00 0.00 H new ATOM 0 HB2 TYR A 23 17.553 -17.225 -0.682 1.00 0.00 H new ATOM 0 HB3 TYR A 23 16.048 -17.907 -1.265 1.00 0.00 H new ATOM 0 HD1 TYR A 23 18.521 -15.188 -2.055 1.00 0.00 H new ATOM 0 HD2 TYR A 23 15.609 -17.953 -3.582 1.00 0.00 H new ATOM 0 HE1 TYR A 23 19.128 -14.549 -4.372 1.00 0.00 H new ATOM 0 HE2 TYR A 23 16.218 -17.316 -5.898 1.00 0.00 H new ATOM 0 HH TYR A 23 18.900 -15.046 -6.568 1.00 0.00 H new ATOM 350 N ILE A 24 17.356 -14.594 0.859 1.00 0.00 N ATOM 351 CA ILE A 24 18.268 -13.460 1.184 1.00 0.00 C ATOM 352 C ILE A 24 19.649 -13.996 1.589 1.00 0.00 C ATOM 353 O ILE A 24 19.763 -15.027 2.222 1.00 0.00 O ATOM 354 CB ILE A 24 17.572 -12.719 2.342 1.00 0.00 C ATOM 355 CG1 ILE A 24 17.712 -11.208 2.135 1.00 0.00 C ATOM 356 CG2 ILE A 24 18.185 -13.107 3.693 1.00 0.00 C ATOM 357 CD1 ILE A 24 19.192 -10.830 2.111 1.00 0.00 C ATOM 0 H ILE A 24 17.211 -15.265 1.613 1.00 0.00 H new ATOM 0 HA ILE A 24 18.442 -12.794 0.339 1.00 0.00 H new ATOM 0 HB ILE A 24 16.519 -13.001 2.348 1.00 0.00 H new ATOM 0 HG12 ILE A 24 17.236 -10.913 1.200 1.00 0.00 H new ATOM 0 HG13 ILE A 24 17.202 -10.672 2.936 1.00 0.00 H new ATOM 0 HG21 ILE A 24 17.675 -12.569 4.492 1.00 0.00 H new ATOM 0 HG22 ILE A 24 18.073 -14.180 3.849 1.00 0.00 H new ATOM 0 HG23 ILE A 24 19.244 -12.848 3.700 1.00 0.00 H new ATOM 0 HD11 ILE A 24 19.290 -9.755 1.964 1.00 0.00 H new ATOM 0 HD12 ILE A 24 19.655 -11.110 3.057 1.00 0.00 H new ATOM 0 HD13 ILE A 24 19.688 -11.355 1.295 1.00 0.00 H new ATOM 369 N LEU A 25 20.695 -13.305 1.228 1.00 0.00 N ATOM 370 CA LEU A 25 22.061 -13.778 1.591 1.00 0.00 C ATOM 371 C LEU A 25 22.437 -13.290 2.991 1.00 0.00 C ATOM 372 O LEU A 25 22.070 -12.207 3.403 1.00 0.00 O ATOM 373 CB LEU A 25 22.989 -13.159 0.545 1.00 0.00 C ATOM 374 CG LEU A 25 22.984 -14.022 -0.717 1.00 0.00 C ATOM 375 CD1 LEU A 25 23.634 -15.373 -0.417 1.00 0.00 C ATOM 376 CD2 LEU A 25 21.541 -14.242 -1.177 1.00 0.00 C ATOM 0 H LEU A 25 20.663 -12.434 0.698 1.00 0.00 H new ATOM 0 HA LEU A 25 22.128 -14.866 1.604 1.00 0.00 H new ATOM 0 HB2 LEU A 25 22.662 -12.147 0.307 1.00 0.00 H new ATOM 0 HB3 LEU A 25 24.001 -13.082 0.942 1.00 0.00 H new ATOM 0 HG LEU A 25 23.545 -13.517 -1.503 1.00 0.00 H new ATOM 0 HD11 LEU A 25 23.630 -15.987 -1.318 1.00 0.00 H new ATOM 0 HD12 LEU A 25 24.662 -15.217 -0.089 1.00 0.00 H new ATOM 0 HD13 LEU A 25 23.075 -15.879 0.370 1.00 0.00 H new ATOM 0 HD21 LEU A 25 21.536 -14.857 -2.077 1.00 0.00 H new ATOM 0 HD22 LEU A 25 20.981 -14.746 -0.389 1.00 0.00 H new ATOM 0 HD23 LEU A 25 21.077 -13.280 -1.393 1.00 0.00 H new ATOM 388 N ALA A 26 23.168 -14.081 3.725 1.00 0.00 N ATOM 389 CA ALA A 26 23.572 -13.665 5.099 1.00 0.00 C ATOM 390 C ALA A 26 24.425 -12.398 5.037 1.00 0.00 C ATOM 391 O ALA A 26 24.226 -11.465 5.789 1.00 0.00 O ATOM 392 CB ALA A 26 24.391 -14.835 5.643 1.00 0.00 C ATOM 0 H ALA A 26 23.504 -14.999 3.434 1.00 0.00 H new ATOM 0 HA ALA A 26 22.713 -13.440 5.731 1.00 0.00 H new ATOM 0 HB1 ALA A 26 24.726 -14.605 6.654 1.00 0.00 H new ATOM 0 HB2 ALA A 26 23.775 -15.734 5.660 1.00 0.00 H new ATOM 0 HB3 ALA A 26 25.257 -15.002 5.003 1.00 0.00 H new ATOM 398 N GLU A 27 25.374 -12.355 4.142 1.00 0.00 N ATOM 399 CA GLU A 27 26.236 -11.145 4.033 1.00 0.00 C ATOM 400 C GLU A 27 25.381 -9.929 3.678 1.00 0.00 C ATOM 401 O GLU A 27 25.626 -8.830 4.136 1.00 0.00 O ATOM 402 CB GLU A 27 27.220 -11.462 2.910 1.00 0.00 C ATOM 403 CG GLU A 27 27.970 -10.189 2.511 1.00 0.00 C ATOM 404 CD GLU A 27 29.100 -10.545 1.542 1.00 0.00 C ATOM 405 OE1 GLU A 27 28.827 -11.226 0.568 1.00 0.00 O ATOM 406 OE2 GLU A 27 30.220 -10.129 1.791 1.00 0.00 O ATOM 0 H GLU A 27 25.589 -13.104 3.483 1.00 0.00 H new ATOM 0 HA GLU A 27 26.750 -10.911 4.965 1.00 0.00 H new ATOM 0 HB2 GLU A 27 27.926 -12.225 3.236 1.00 0.00 H new ATOM 0 HB3 GLU A 27 26.687 -11.867 2.050 1.00 0.00 H new ATOM 0 HG2 GLU A 27 27.285 -9.482 2.043 1.00 0.00 H new ATOM 0 HG3 GLU A 27 28.376 -9.701 3.397 1.00 0.00 H new ATOM 413 N GLU A 28 24.370 -10.118 2.875 1.00 0.00 N ATOM 414 CA GLU A 28 23.494 -8.972 2.507 1.00 0.00 C ATOM 415 C GLU A 28 22.821 -8.433 3.768 1.00 0.00 C ATOM 416 O GLU A 28 22.810 -7.244 4.021 1.00 0.00 O ATOM 417 CB GLU A 28 22.460 -9.552 1.542 1.00 0.00 C ATOM 418 CG GLU A 28 22.476 -8.754 0.237 1.00 0.00 C ATOM 419 CD GLU A 28 22.609 -9.714 -0.947 1.00 0.00 C ATOM 420 OE1 GLU A 28 23.639 -10.361 -1.046 1.00 0.00 O ATOM 421 OE2 GLU A 28 21.680 -9.785 -1.734 1.00 0.00 O ATOM 0 H GLU A 28 24.114 -11.014 2.459 1.00 0.00 H new ATOM 0 HA GLU A 28 24.041 -8.147 2.050 1.00 0.00 H new ATOM 0 HB2 GLU A 28 22.681 -10.600 1.342 1.00 0.00 H new ATOM 0 HB3 GLU A 28 21.467 -9.516 1.991 1.00 0.00 H new ATOM 0 HG2 GLU A 28 21.560 -8.170 0.144 1.00 0.00 H new ATOM 0 HG3 GLU A 28 23.306 -8.047 0.241 1.00 0.00 H new ATOM 428 N LEU A 29 22.278 -9.305 4.573 1.00 0.00 N ATOM 429 CA LEU A 29 21.625 -8.851 5.832 1.00 0.00 C ATOM 430 C LEU A 29 22.647 -8.104 6.688 1.00 0.00 C ATOM 431 O LEU A 29 22.322 -7.169 7.393 1.00 0.00 O ATOM 432 CB LEU A 29 21.171 -10.133 6.534 1.00 0.00 C ATOM 433 CG LEU A 29 20.147 -10.861 5.662 1.00 0.00 C ATOM 434 CD1 LEU A 29 19.534 -12.019 6.451 1.00 0.00 C ATOM 435 CD2 LEU A 29 19.043 -9.885 5.250 1.00 0.00 C ATOM 0 H LEU A 29 22.259 -10.312 4.413 1.00 0.00 H new ATOM 0 HA LEU A 29 20.788 -8.176 5.653 1.00 0.00 H new ATOM 0 HB2 LEU A 29 22.028 -10.779 6.722 1.00 0.00 H new ATOM 0 HB3 LEU A 29 20.733 -9.893 7.503 1.00 0.00 H new ATOM 0 HG LEU A 29 20.641 -11.250 4.771 1.00 0.00 H new ATOM 0 HD11 LEU A 29 18.804 -12.537 5.829 1.00 0.00 H new ATOM 0 HD12 LEU A 29 20.320 -12.715 6.745 1.00 0.00 H new ATOM 0 HD13 LEU A 29 19.041 -11.631 7.342 1.00 0.00 H new ATOM 0 HD21 LEU A 29 18.313 -10.403 4.628 1.00 0.00 H new ATOM 0 HD22 LEU A 29 18.550 -9.496 6.141 1.00 0.00 H new ATOM 0 HD23 LEU A 29 19.479 -9.060 4.687 1.00 0.00 H new ATOM 447 N ARG A 30 23.888 -8.511 6.627 1.00 0.00 N ATOM 448 CA ARG A 30 24.938 -7.830 7.434 1.00 0.00 C ATOM 449 C ARG A 30 25.128 -6.390 6.949 1.00 0.00 C ATOM 450 O ARG A 30 25.402 -5.495 7.724 1.00 0.00 O ATOM 451 CB ARG A 30 26.210 -8.649 7.201 1.00 0.00 C ATOM 452 CG ARG A 30 26.664 -9.275 8.521 1.00 0.00 C ATOM 453 CD ARG A 30 27.945 -8.588 8.998 1.00 0.00 C ATOM 454 NE ARG A 30 28.993 -9.646 8.947 1.00 0.00 N ATOM 455 CZ ARG A 30 28.938 -10.665 9.763 1.00 0.00 C ATOM 456 NH1 ARG A 30 27.957 -10.770 10.618 1.00 0.00 N ATOM 457 NH2 ARG A 30 29.865 -11.582 9.721 1.00 0.00 N ATOM 0 H ARG A 30 24.218 -9.286 6.052 1.00 0.00 H new ATOM 0 HA ARG A 30 24.677 -7.776 8.491 1.00 0.00 H new ATOM 0 HB2 ARG A 30 26.023 -9.428 6.462 1.00 0.00 H new ATOM 0 HB3 ARG A 30 26.997 -8.011 6.799 1.00 0.00 H new ATOM 0 HG2 ARG A 30 25.882 -9.171 9.273 1.00 0.00 H new ATOM 0 HG3 ARG A 30 26.839 -10.343 8.388 1.00 0.00 H new ATOM 0 HD2 ARG A 30 28.203 -7.746 8.356 1.00 0.00 H new ATOM 0 HD3 ARG A 30 27.829 -8.195 10.008 1.00 0.00 H new ATOM 0 HE ARG A 30 29.755 -9.575 8.273 1.00 0.00 H new ATOM 0 HH11 ARG A 30 27.230 -10.055 10.651 1.00 0.00 H new ATOM 0 HH12 ARG A 30 27.917 -11.567 11.253 1.00 0.00 H new ATOM 0 HH21 ARG A 30 30.631 -11.503 9.052 1.00 0.00 H new ATOM 0 HH22 ARG A 30 29.824 -12.378 10.357 1.00 0.00 H new ATOM 471 N ARG A 31 24.991 -6.157 5.670 1.00 0.00 N ATOM 472 CA ARG A 31 25.171 -4.773 5.143 1.00 0.00 C ATOM 473 C ARG A 31 23.818 -4.067 4.991 1.00 0.00 C ATOM 474 O ARG A 31 23.718 -2.865 5.138 1.00 0.00 O ATOM 475 CB ARG A 31 25.837 -4.951 3.779 1.00 0.00 C ATOM 476 CG ARG A 31 26.926 -3.891 3.603 1.00 0.00 C ATOM 477 CD ARG A 31 27.039 -3.512 2.125 1.00 0.00 C ATOM 478 NE ARG A 31 28.180 -2.557 2.061 1.00 0.00 N ATOM 479 CZ ARG A 31 28.595 -2.106 0.907 1.00 0.00 C ATOM 480 NH1 ARG A 31 28.023 -2.504 -0.198 1.00 0.00 N ATOM 481 NH2 ARG A 31 29.586 -1.259 0.858 1.00 0.00 N ATOM 0 H ARG A 31 24.763 -6.863 4.970 1.00 0.00 H new ATOM 0 HA ARG A 31 25.769 -4.158 5.816 1.00 0.00 H new ATOM 0 HB2 ARG A 31 26.269 -5.949 3.700 1.00 0.00 H new ATOM 0 HB3 ARG A 31 25.095 -4.861 2.985 1.00 0.00 H new ATOM 0 HG2 ARG A 31 26.689 -3.009 4.198 1.00 0.00 H new ATOM 0 HG3 ARG A 31 27.881 -4.272 3.965 1.00 0.00 H new ATOM 0 HD2 ARG A 31 27.223 -4.389 1.505 1.00 0.00 H new ATOM 0 HD3 ARG A 31 26.119 -3.053 1.763 1.00 0.00 H new ATOM 0 HE ARG A 31 28.639 -2.254 2.920 1.00 0.00 H new ATOM 0 HH11 ARG A 31 27.250 -3.169 -0.161 1.00 0.00 H new ATOM 0 HH12 ARG A 31 28.349 -2.150 -1.097 1.00 0.00 H new ATOM 0 HH21 ARG A 31 30.036 -0.950 1.720 1.00 0.00 H new ATOM 0 HH22 ARG A 31 29.911 -0.906 -0.042 1.00 0.00 H new ATOM 495 N GLU A 32 22.778 -4.798 4.693 1.00 0.00 N ATOM 496 CA GLU A 32 21.442 -4.154 4.529 1.00 0.00 C ATOM 497 C GLU A 32 20.844 -3.800 5.893 1.00 0.00 C ATOM 498 O GLU A 32 20.001 -2.932 6.005 1.00 0.00 O ATOM 499 CB GLU A 32 20.577 -5.201 3.828 1.00 0.00 C ATOM 500 CG GLU A 32 20.533 -4.906 2.327 1.00 0.00 C ATOM 501 CD GLU A 32 21.930 -5.086 1.731 1.00 0.00 C ATOM 502 OE1 GLU A 32 22.797 -4.287 2.048 1.00 0.00 O ATOM 503 OE2 GLU A 32 22.111 -6.020 0.967 1.00 0.00 O ATOM 0 H GLU A 32 22.795 -5.809 4.556 1.00 0.00 H new ATOM 0 HA GLU A 32 21.506 -3.226 3.961 1.00 0.00 H new ATOM 0 HB2 GLU A 32 20.982 -6.198 4.002 1.00 0.00 H new ATOM 0 HB3 GLU A 32 19.568 -5.190 4.241 1.00 0.00 H new ATOM 0 HG2 GLU A 32 19.827 -5.575 1.835 1.00 0.00 H new ATOM 0 HG3 GLU A 32 20.181 -3.889 2.156 1.00 0.00 H new ATOM 510 N LEU A 33 21.266 -4.468 6.932 1.00 0.00 N ATOM 511 CA LEU A 33 20.714 -4.172 8.279 1.00 0.00 C ATOM 512 C LEU A 33 21.845 -4.044 9.303 1.00 0.00 C ATOM 513 O LEU A 33 22.931 -4.547 9.096 1.00 0.00 O ATOM 514 CB LEU A 33 19.838 -5.377 8.601 1.00 0.00 C ATOM 515 CG LEU A 33 18.373 -5.037 8.319 1.00 0.00 C ATOM 516 CD1 LEU A 33 17.721 -6.192 7.558 1.00 0.00 C ATOM 517 CD2 LEU A 33 17.634 -4.818 9.641 1.00 0.00 C ATOM 0 H LEU A 33 21.970 -5.206 6.903 1.00 0.00 H new ATOM 0 HA LEU A 33 20.160 -3.234 8.307 1.00 0.00 H new ATOM 0 HB2 LEU A 33 20.145 -6.233 8.001 1.00 0.00 H new ATOM 0 HB3 LEU A 33 19.961 -5.660 9.646 1.00 0.00 H new ATOM 0 HG LEU A 33 18.321 -4.128 7.719 1.00 0.00 H new ATOM 0 HD11 LEU A 33 16.677 -5.952 7.356 1.00 0.00 H new ATOM 0 HD12 LEU A 33 18.246 -6.349 6.616 1.00 0.00 H new ATOM 0 HD13 LEU A 33 17.775 -7.100 8.159 1.00 0.00 H new ATOM 0 HD21 LEU A 33 16.591 -4.576 9.439 1.00 0.00 H new ATOM 0 HD22 LEU A 33 17.686 -5.726 10.242 1.00 0.00 H new ATOM 0 HD23 LEU A 33 18.098 -3.996 10.186 1.00 0.00 H new ATOM 529 N PRO A 34 21.544 -3.373 10.381 1.00 0.00 N ATOM 530 CA PRO A 34 22.572 -3.199 11.434 1.00 0.00 C ATOM 531 C PRO A 34 23.190 -4.554 11.794 1.00 0.00 C ATOM 532 O PRO A 34 22.488 -5.528 11.977 1.00 0.00 O ATOM 533 CB PRO A 34 21.811 -2.612 12.627 1.00 0.00 C ATOM 534 CG PRO A 34 20.392 -2.421 12.176 1.00 0.00 C ATOM 535 CD PRO A 34 20.358 -2.576 10.681 1.00 0.00 C ATOM 0 HA PRO A 34 23.392 -2.554 11.118 1.00 0.00 H new ATOM 0 HB2 PRO A 34 21.858 -3.283 13.485 1.00 0.00 H new ATOM 0 HB3 PRO A 34 22.250 -1.664 12.939 1.00 0.00 H new ATOM 0 HG2 PRO A 34 19.739 -3.153 12.651 1.00 0.00 H new ATOM 0 HG3 PRO A 34 20.029 -1.435 12.466 1.00 0.00 H new ATOM 0 HD2 PRO A 34 19.447 -3.077 10.352 1.00 0.00 H new ATOM 0 HD3 PRO A 34 20.389 -1.609 10.179 1.00 0.00 H new ATOM 543 N PRO A 35 24.493 -4.564 11.877 1.00 0.00 N ATOM 544 CA PRO A 35 25.194 -5.832 12.213 1.00 0.00 C ATOM 545 C PRO A 35 24.418 -6.615 13.278 1.00 0.00 C ATOM 546 O PRO A 35 24.388 -7.829 13.269 1.00 0.00 O ATOM 547 CB PRO A 35 26.547 -5.380 12.759 1.00 0.00 C ATOM 548 CG PRO A 35 26.335 -3.972 13.208 1.00 0.00 C ATOM 549 CD PRO A 35 25.242 -3.394 12.353 1.00 0.00 C ATOM 0 HA PRO A 35 25.289 -6.495 11.353 1.00 0.00 H new ATOM 0 HB2 PRO A 35 26.870 -6.013 13.586 1.00 0.00 H new ATOM 0 HB3 PRO A 35 27.320 -5.437 11.993 1.00 0.00 H new ATOM 0 HG2 PRO A 35 26.056 -3.942 14.261 1.00 0.00 H new ATOM 0 HG3 PRO A 35 27.252 -3.392 13.104 1.00 0.00 H new ATOM 0 HD2 PRO A 35 24.604 -2.720 12.925 1.00 0.00 H new ATOM 0 HD3 PRO A 35 25.650 -2.818 11.522 1.00 0.00 H new ATOM 557 N ASP A 36 23.795 -5.931 14.198 1.00 0.00 N ATOM 558 CA ASP A 36 23.029 -6.641 15.263 1.00 0.00 C ATOM 559 C ASP A 36 21.838 -7.392 14.660 1.00 0.00 C ATOM 560 O ASP A 36 21.575 -8.529 14.999 1.00 0.00 O ATOM 561 CB ASP A 36 22.545 -5.537 16.205 1.00 0.00 C ATOM 562 CG ASP A 36 22.455 -6.087 17.630 1.00 0.00 C ATOM 563 OD1 ASP A 36 23.444 -6.003 18.339 1.00 0.00 O ATOM 564 OD2 ASP A 36 21.399 -6.581 17.988 1.00 0.00 O ATOM 0 H ASP A 36 23.783 -4.913 14.259 1.00 0.00 H new ATOM 0 HA ASP A 36 23.638 -7.383 15.779 1.00 0.00 H new ATOM 0 HB2 ASP A 36 23.231 -4.690 16.173 1.00 0.00 H new ATOM 0 HB3 ASP A 36 21.570 -5.170 15.883 1.00 0.00 H new ATOM 569 N GLN A 37 21.111 -6.766 13.776 1.00 0.00 N ATOM 570 CA GLN A 37 19.934 -7.446 13.161 1.00 0.00 C ATOM 571 C GLN A 37 20.390 -8.577 12.235 1.00 0.00 C ATOM 572 O GLN A 37 19.775 -9.623 12.170 1.00 0.00 O ATOM 573 CB GLN A 37 19.221 -6.352 12.367 1.00 0.00 C ATOM 574 CG GLN A 37 18.832 -5.212 13.311 1.00 0.00 C ATOM 575 CD GLN A 37 18.058 -5.778 14.503 1.00 0.00 C ATOM 576 OE1 GLN A 37 18.498 -5.677 15.631 1.00 0.00 O ATOM 577 NE2 GLN A 37 16.914 -6.373 14.301 1.00 0.00 N ATOM 0 H GLN A 37 21.280 -5.814 13.452 1.00 0.00 H new ATOM 0 HA GLN A 37 19.283 -7.900 13.908 1.00 0.00 H new ATOM 0 HB2 GLN A 37 19.871 -5.978 11.576 1.00 0.00 H new ATOM 0 HB3 GLN A 37 18.332 -6.758 11.884 1.00 0.00 H new ATOM 0 HG2 GLN A 37 19.725 -4.692 13.658 1.00 0.00 H new ATOM 0 HG3 GLN A 37 18.222 -4.480 12.782 1.00 0.00 H new ATOM 0 HE21 GLN A 37 16.544 -6.458 13.354 1.00 0.00 H new ATOM 0 HE22 GLN A 37 16.390 -6.753 15.090 1.00 0.00 H new ATOM 586 N ALA A 38 21.460 -8.376 11.516 1.00 0.00 N ATOM 587 CA ALA A 38 21.950 -9.442 10.594 1.00 0.00 C ATOM 588 C ALA A 38 22.199 -10.743 11.361 1.00 0.00 C ATOM 589 O ALA A 38 21.863 -11.817 10.905 1.00 0.00 O ATOM 590 CB ALA A 38 23.260 -8.898 10.022 1.00 0.00 C ATOM 0 H ALA A 38 22.016 -7.521 11.526 1.00 0.00 H new ATOM 0 HA ALA A 38 21.226 -9.673 9.813 1.00 0.00 H new ATOM 0 HB1 ALA A 38 23.686 -9.626 9.331 1.00 0.00 H new ATOM 0 HB2 ALA A 38 23.066 -7.965 9.492 1.00 0.00 H new ATOM 0 HB3 ALA A 38 23.963 -8.714 10.834 1.00 0.00 H new ATOM 596 N GLN A 39 22.788 -10.658 12.522 1.00 0.00 N ATOM 597 CA GLN A 39 23.062 -11.892 13.313 1.00 0.00 C ATOM 598 C GLN A 39 21.748 -12.566 13.723 1.00 0.00 C ATOM 599 O GLN A 39 21.598 -13.767 13.615 1.00 0.00 O ATOM 600 CB GLN A 39 23.826 -11.413 14.548 1.00 0.00 C ATOM 601 CG GLN A 39 24.545 -12.598 15.195 1.00 0.00 C ATOM 602 CD GLN A 39 25.329 -12.117 16.417 1.00 0.00 C ATOM 603 OE1 GLN A 39 25.779 -10.989 16.459 1.00 0.00 O ATOM 604 NE2 GLN A 39 25.512 -12.930 17.422 1.00 0.00 N ATOM 0 H GLN A 39 23.092 -9.787 12.958 1.00 0.00 H new ATOM 0 HA GLN A 39 23.630 -12.627 12.742 1.00 0.00 H new ATOM 0 HB2 GLN A 39 24.547 -10.646 14.267 1.00 0.00 H new ATOM 0 HB3 GLN A 39 23.138 -10.958 15.261 1.00 0.00 H new ATOM 0 HG2 GLN A 39 23.822 -13.358 15.490 1.00 0.00 H new ATOM 0 HG3 GLN A 39 25.220 -13.063 14.477 1.00 0.00 H new ATOM 0 HE21 GLN A 39 25.134 -13.877 17.387 1.00 0.00 H new ATOM 0 HE22 GLN A 39 26.032 -12.618 18.242 1.00 0.00 H new ATOM 613 N TYR A 40 20.797 -11.807 14.193 1.00 0.00 N ATOM 614 CA TYR A 40 19.499 -12.411 14.610 1.00 0.00 C ATOM 615 C TYR A 40 18.764 -12.988 13.396 1.00 0.00 C ATOM 616 O TYR A 40 18.294 -14.107 13.418 1.00 0.00 O ATOM 617 CB TYR A 40 18.703 -11.255 15.217 1.00 0.00 C ATOM 618 CG TYR A 40 18.084 -11.697 16.521 1.00 0.00 C ATOM 619 CD1 TYR A 40 17.152 -12.741 16.536 1.00 0.00 C ATOM 620 CD2 TYR A 40 18.443 -11.062 17.716 1.00 0.00 C ATOM 621 CE1 TYR A 40 16.579 -13.151 17.746 1.00 0.00 C ATOM 622 CE2 TYR A 40 17.869 -11.471 18.926 1.00 0.00 C ATOM 623 CZ TYR A 40 16.936 -12.516 18.941 1.00 0.00 C ATOM 624 OH TYR A 40 16.371 -12.919 20.134 1.00 0.00 O ATOM 0 H TYR A 40 20.862 -10.795 14.307 1.00 0.00 H new ATOM 0 HA TYR A 40 19.635 -13.231 15.316 1.00 0.00 H new ATOM 0 HB2 TYR A 40 19.356 -10.399 15.385 1.00 0.00 H new ATOM 0 HB3 TYR A 40 17.926 -10.932 14.525 1.00 0.00 H new ATOM 0 HD1 TYR A 40 16.875 -13.230 15.614 1.00 0.00 H new ATOM 0 HD2 TYR A 40 19.163 -10.257 17.705 1.00 0.00 H new ATOM 0 HE1 TYR A 40 15.861 -13.958 17.757 1.00 0.00 H new ATOM 0 HE2 TYR A 40 18.146 -10.981 19.848 1.00 0.00 H new ATOM 0 HH TYR A 40 16.729 -12.375 20.866 1.00 0.00 H new ATOM 634 N CYS A 41 18.660 -12.230 12.341 1.00 0.00 N ATOM 635 CA CYS A 41 17.952 -12.733 11.126 1.00 0.00 C ATOM 636 C CYS A 41 18.717 -13.906 10.506 1.00 0.00 C ATOM 637 O CYS A 41 18.136 -14.897 10.109 1.00 0.00 O ATOM 638 CB CYS A 41 17.927 -11.544 10.165 1.00 0.00 C ATOM 639 SG CYS A 41 17.213 -10.105 11.002 1.00 0.00 S ATOM 0 H CYS A 41 19.034 -11.284 12.265 1.00 0.00 H new ATOM 0 HA CYS A 41 16.951 -13.098 11.356 1.00 0.00 H new ATOM 0 HB2 CYS A 41 18.937 -11.316 9.825 1.00 0.00 H new ATOM 0 HB3 CYS A 41 17.341 -11.791 9.280 1.00 0.00 H new ATOM 0 HG CYS A 41 18.141 -9.488 11.672 1.00 0.00 H new ATOM 645 N ILE A 42 20.013 -13.798 10.410 1.00 0.00 N ATOM 646 CA ILE A 42 20.814 -14.903 9.806 1.00 0.00 C ATOM 647 C ILE A 42 20.637 -16.201 10.602 1.00 0.00 C ATOM 648 O ILE A 42 20.851 -17.284 10.094 1.00 0.00 O ATOM 649 CB ILE A 42 22.265 -14.427 9.885 1.00 0.00 C ATOM 650 CG1 ILE A 42 22.503 -13.332 8.842 1.00 0.00 C ATOM 651 CG2 ILE A 42 23.203 -15.603 9.609 1.00 0.00 C ATOM 652 CD1 ILE A 42 23.853 -12.662 9.104 1.00 0.00 C ATOM 0 H ILE A 42 20.554 -12.992 10.724 1.00 0.00 H new ATOM 0 HA ILE A 42 20.503 -15.118 8.784 1.00 0.00 H new ATOM 0 HB ILE A 42 22.461 -14.029 10.881 1.00 0.00 H new ATOM 0 HG12 ILE A 42 22.486 -13.760 7.840 1.00 0.00 H new ATOM 0 HG13 ILE A 42 21.703 -12.593 8.887 1.00 0.00 H new ATOM 0 HG21 ILE A 42 24.237 -15.264 9.665 1.00 0.00 H new ATOM 0 HG22 ILE A 42 23.036 -16.384 10.351 1.00 0.00 H new ATOM 0 HG23 ILE A 42 23.005 -16.001 8.614 1.00 0.00 H new ATOM 0 HD11 ILE A 42 24.022 -11.882 8.361 1.00 0.00 H new ATOM 0 HD12 ILE A 42 23.853 -12.220 10.100 1.00 0.00 H new ATOM 0 HD13 ILE A 42 24.647 -13.406 9.037 1.00 0.00 H new ATOM 664 N LYS A 43 20.259 -16.103 11.847 1.00 0.00 N ATOM 665 CA LYS A 43 20.082 -17.334 12.671 1.00 0.00 C ATOM 666 C LYS A 43 18.685 -17.932 12.465 1.00 0.00 C ATOM 667 O LYS A 43 18.496 -19.129 12.550 1.00 0.00 O ATOM 668 CB LYS A 43 20.254 -16.868 14.118 1.00 0.00 C ATOM 669 CG LYS A 43 20.609 -18.066 15.002 1.00 0.00 C ATOM 670 CD LYS A 43 19.346 -18.582 15.694 1.00 0.00 C ATOM 671 CE LYS A 43 19.568 -18.613 17.207 1.00 0.00 C ATOM 672 NZ LYS A 43 20.497 -19.755 17.433 1.00 0.00 N ATOM 0 H LYS A 43 20.065 -15.225 12.329 1.00 0.00 H new ATOM 0 HA LYS A 43 20.796 -18.111 12.399 1.00 0.00 H new ATOM 0 HB2 LYS A 43 21.039 -16.114 14.177 1.00 0.00 H new ATOM 0 HB3 LYS A 43 19.335 -16.401 14.472 1.00 0.00 H new ATOM 0 HG2 LYS A 43 21.055 -18.857 14.399 1.00 0.00 H new ATOM 0 HG3 LYS A 43 21.351 -17.775 15.746 1.00 0.00 H new ATOM 0 HD2 LYS A 43 18.499 -17.940 15.453 1.00 0.00 H new ATOM 0 HD3 LYS A 43 19.102 -19.581 15.331 1.00 0.00 H new ATOM 0 HE2 LYS A 43 19.998 -17.677 17.563 1.00 0.00 H new ATOM 0 HE3 LYS A 43 18.629 -18.756 17.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 20.152 -20.331 18.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 20.543 -20.340 16.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 21.446 -19.392 17.655 1.00 0.00 H new ATOM 686 N ARG A 44 17.707 -17.110 12.201 1.00 0.00 N ATOM 687 CA ARG A 44 16.326 -17.637 11.998 1.00 0.00 C ATOM 688 C ARG A 44 16.193 -18.280 10.615 1.00 0.00 C ATOM 689 O ARG A 44 15.979 -19.469 10.493 1.00 0.00 O ATOM 690 CB ARG A 44 15.418 -16.412 12.113 1.00 0.00 C ATOM 691 CG ARG A 44 15.454 -15.885 13.549 1.00 0.00 C ATOM 692 CD ARG A 44 14.877 -16.939 14.496 1.00 0.00 C ATOM 693 NE ARG A 44 13.656 -16.309 15.074 1.00 0.00 N ATOM 694 CZ ARG A 44 12.945 -16.947 15.965 1.00 0.00 C ATOM 695 NH1 ARG A 44 13.299 -18.142 16.355 1.00 0.00 N ATOM 696 NH2 ARG A 44 11.876 -16.389 16.465 1.00 0.00 N ATOM 0 H ARG A 44 17.803 -16.098 12.117 1.00 0.00 H new ATOM 0 HA ARG A 44 16.069 -18.408 12.725 1.00 0.00 H new ATOM 0 HB2 ARG A 44 15.746 -15.636 11.421 1.00 0.00 H new ATOM 0 HB3 ARG A 44 14.397 -16.675 11.836 1.00 0.00 H new ATOM 0 HG2 ARG A 44 16.479 -15.647 13.834 1.00 0.00 H new ATOM 0 HG3 ARG A 44 14.880 -14.961 13.623 1.00 0.00 H new ATOM 0 HD2 ARG A 44 14.633 -17.858 13.963 1.00 0.00 H new ATOM 0 HD3 ARG A 44 15.592 -17.203 15.275 1.00 0.00 H new ATOM 0 HE ARG A 44 13.375 -15.376 14.773 1.00 0.00 H new ATOM 0 HH11 ARG A 44 14.133 -18.580 15.964 1.00 0.00 H new ATOM 0 HH12 ARG A 44 12.742 -18.637 17.051 1.00 0.00 H new ATOM 0 HH21 ARG A 44 11.597 -15.456 16.160 1.00 0.00 H new ATOM 0 HH22 ARG A 44 11.319 -16.886 17.161 1.00 0.00 H new ATOM 710 N MET A 45 16.312 -17.500 9.574 1.00 0.00 N ATOM 711 CA MET A 45 16.188 -18.057 8.196 1.00 0.00 C ATOM 712 C MET A 45 16.867 -19.426 8.098 1.00 0.00 C ATOM 713 O MET A 45 18.076 -19.527 8.162 1.00 0.00 O ATOM 714 CB MET A 45 16.906 -17.048 7.300 1.00 0.00 C ATOM 715 CG MET A 45 16.376 -15.644 7.582 1.00 0.00 C ATOM 716 SD MET A 45 16.503 -14.637 6.085 1.00 0.00 S ATOM 717 CE MET A 45 15.680 -13.170 6.745 1.00 0.00 C ATOM 0 H MET A 45 16.491 -16.497 9.619 1.00 0.00 H new ATOM 0 HA MET A 45 15.146 -18.203 7.910 1.00 0.00 H new ATOM 0 HB2 MET A 45 17.980 -17.085 7.481 1.00 0.00 H new ATOM 0 HB3 MET A 45 16.751 -17.302 6.252 1.00 0.00 H new ATOM 0 HG2 MET A 45 15.338 -15.695 7.911 1.00 0.00 H new ATOM 0 HG3 MET A 45 16.945 -15.185 8.391 1.00 0.00 H new ATOM 0 HE1 MET A 45 15.579 -12.424 5.957 1.00 0.00 H new ATOM 0 HE2 MET A 45 14.692 -13.443 7.115 1.00 0.00 H new ATOM 0 HE3 MET A 45 16.272 -12.757 7.562 1.00 0.00 H new ATOM 727 N PRO A 46 16.058 -20.436 7.935 1.00 0.00 N ATOM 728 CA PRO A 46 16.627 -21.804 7.818 1.00 0.00 C ATOM 729 C PRO A 46 17.423 -21.927 6.515 1.00 0.00 C ATOM 730 O PRO A 46 17.895 -20.947 5.972 1.00 0.00 O ATOM 731 CB PRO A 46 15.409 -22.733 7.801 1.00 0.00 C ATOM 732 CG PRO A 46 14.214 -21.840 7.679 1.00 0.00 C ATOM 733 CD PRO A 46 14.619 -20.488 8.189 1.00 0.00 C ATOM 0 HA PRO A 46 17.311 -22.047 8.631 1.00 0.00 H new ATOM 0 HB2 PRO A 46 15.462 -23.431 6.966 1.00 0.00 H new ATOM 0 HB3 PRO A 46 15.360 -23.329 8.712 1.00 0.00 H new ATOM 0 HG2 PRO A 46 13.884 -21.777 6.642 1.00 0.00 H new ATOM 0 HG3 PRO A 46 13.378 -22.235 8.256 1.00 0.00 H new ATOM 0 HD2 PRO A 46 14.092 -19.689 7.667 1.00 0.00 H new ATOM 0 HD3 PRO A 46 14.396 -20.377 9.250 1.00 0.00 H new ATOM 741 N ALA A 47 17.577 -23.119 6.007 1.00 0.00 N ATOM 742 CA ALA A 47 18.342 -23.292 4.739 1.00 0.00 C ATOM 743 C ALA A 47 17.388 -23.301 3.541 1.00 0.00 C ATOM 744 O ALA A 47 16.489 -24.115 3.456 1.00 0.00 O ATOM 745 CB ALA A 47 19.044 -24.644 4.879 1.00 0.00 C ATOM 0 H ALA A 47 17.208 -23.978 6.413 1.00 0.00 H new ATOM 0 HA ALA A 47 19.051 -22.482 4.572 1.00 0.00 H new ATOM 0 HB1 ALA A 47 19.630 -24.844 3.982 1.00 0.00 H new ATOM 0 HB2 ALA A 47 19.704 -24.623 5.746 1.00 0.00 H new ATOM 0 HB3 ALA A 47 18.299 -25.429 5.009 1.00 0.00 H new ATOM 751 N TYR A 48 17.578 -22.400 2.617 1.00 0.00 N ATOM 752 CA TYR A 48 16.684 -22.352 1.422 1.00 0.00 C ATOM 753 C TYR A 48 16.579 -23.738 0.780 1.00 0.00 C ATOM 754 O TYR A 48 15.506 -24.295 0.655 1.00 0.00 O ATOM 755 CB TYR A 48 17.358 -21.366 0.467 1.00 0.00 C ATOM 756 CG TYR A 48 16.698 -21.442 -0.888 1.00 0.00 C ATOM 757 CD1 TYR A 48 15.305 -21.355 -0.997 1.00 0.00 C ATOM 758 CD2 TYR A 48 17.481 -21.597 -2.039 1.00 0.00 C ATOM 759 CE1 TYR A 48 14.695 -21.424 -2.255 1.00 0.00 C ATOM 760 CE2 TYR A 48 16.871 -21.665 -3.298 1.00 0.00 C ATOM 761 CZ TYR A 48 15.477 -21.579 -3.405 1.00 0.00 C ATOM 762 OH TYR A 48 14.876 -21.646 -4.645 1.00 0.00 O ATOM 0 H TYR A 48 18.314 -21.694 2.636 1.00 0.00 H new ATOM 0 HA TYR A 48 15.669 -22.046 1.677 1.00 0.00 H new ATOM 0 HB2 TYR A 48 17.284 -20.353 0.862 1.00 0.00 H new ATOM 0 HB3 TYR A 48 18.420 -21.597 0.379 1.00 0.00 H new ATOM 0 HD1 TYR A 48 14.701 -21.235 -0.110 1.00 0.00 H new ATOM 0 HD2 TYR A 48 18.556 -21.664 -1.956 1.00 0.00 H new ATOM 0 HE1 TYR A 48 13.620 -21.358 -2.338 1.00 0.00 H new ATOM 0 HE2 TYR A 48 17.475 -21.784 -4.185 1.00 0.00 H new ATOM 0 HH TYR A 48 15.563 -21.753 -5.336 1.00 0.00 H new ATOM 772 N SER A 49 17.684 -24.300 0.371 1.00 0.00 N ATOM 773 CA SER A 49 17.644 -25.649 -0.263 1.00 0.00 C ATOM 774 C SER A 49 16.733 -25.629 -1.494 1.00 0.00 C ATOM 775 O SER A 49 15.919 -24.742 -1.661 1.00 0.00 O ATOM 776 CB SER A 49 17.075 -26.575 0.811 1.00 0.00 C ATOM 777 OG SER A 49 15.696 -26.803 0.549 1.00 0.00 O ATOM 0 H SER A 49 18.612 -23.884 0.448 1.00 0.00 H new ATOM 0 HA SER A 49 18.627 -25.975 -0.602 1.00 0.00 H new ATOM 0 HB2 SER A 49 17.617 -27.520 0.818 1.00 0.00 H new ATOM 0 HB3 SER A 49 17.201 -26.128 1.797 1.00 0.00 H new ATOM 0 HG SER A 49 15.200 -25.964 0.654 1.00 0.00 H new ATOM 783 N GLY A 50 16.862 -26.601 -2.356 1.00 0.00 N ATOM 784 CA GLY A 50 16.002 -26.636 -3.574 1.00 0.00 C ATOM 785 C GLY A 50 16.585 -27.628 -4.584 1.00 0.00 C ATOM 786 O GLY A 50 16.872 -28.760 -4.248 1.00 0.00 O ATOM 0 H GLY A 50 17.525 -27.372 -2.270 1.00 0.00 H new ATOM 0 HA2 GLY A 50 14.986 -26.928 -3.307 1.00 0.00 H new ATOM 0 HA3 GLY A 50 15.942 -25.642 -4.018 1.00 0.00 H new ATOM 790 N PRO A 51 16.740 -27.164 -5.794 1.00 0.00 N ATOM 791 CA PRO A 51 17.301 -28.054 -6.844 1.00 0.00 C ATOM 792 C PRO A 51 18.821 -27.892 -6.920 1.00 0.00 C ATOM 793 O PRO A 51 19.480 -28.496 -7.744 1.00 0.00 O ATOM 794 CB PRO A 51 16.642 -27.578 -8.139 1.00 0.00 C ATOM 795 CG PRO A 51 16.162 -26.194 -7.852 1.00 0.00 C ATOM 796 CD PRO A 51 15.889 -26.118 -6.375 1.00 0.00 C ATOM 0 HA PRO A 51 17.109 -29.109 -6.647 1.00 0.00 H new ATOM 0 HB2 PRO A 51 17.351 -27.584 -8.967 1.00 0.00 H new ATOM 0 HB3 PRO A 51 15.816 -28.230 -8.422 1.00 0.00 H new ATOM 0 HG2 PRO A 51 16.911 -25.458 -8.144 1.00 0.00 H new ATOM 0 HG3 PRO A 51 15.260 -25.973 -8.422 1.00 0.00 H new ATOM 0 HD2 PRO A 51 16.138 -25.135 -5.975 1.00 0.00 H new ATOM 0 HD3 PRO A 51 14.836 -26.295 -6.156 1.00 0.00 H new ATOM 804 N GLY A 52 19.383 -27.081 -6.066 1.00 0.00 N ATOM 805 CA GLY A 52 20.860 -26.882 -6.089 1.00 0.00 C ATOM 806 C GLY A 52 21.196 -25.486 -5.561 1.00 0.00 C ATOM 807 O GLY A 52 22.037 -24.795 -6.101 1.00 0.00 O ATOM 0 H GLY A 52 18.884 -26.548 -5.354 1.00 0.00 H new ATOM 0 HA2 GLY A 52 21.349 -27.641 -5.478 1.00 0.00 H new ATOM 0 HA3 GLY A 52 21.237 -26.999 -7.105 1.00 0.00 H new ATOM 811 N SER A 53 20.536 -25.063 -4.516 1.00 0.00 N ATOM 812 CA SER A 53 20.801 -23.720 -3.954 1.00 0.00 C ATOM 813 C SER A 53 22.289 -23.551 -3.639 1.00 0.00 C ATOM 814 O SER A 53 23.129 -24.281 -4.127 1.00 0.00 O ATOM 815 CB SER A 53 19.971 -23.662 -2.673 1.00 0.00 C ATOM 816 OG SER A 53 20.186 -24.847 -1.920 1.00 0.00 O ATOM 0 H SER A 53 19.819 -25.600 -4.028 1.00 0.00 H new ATOM 0 HA SER A 53 20.539 -22.924 -4.651 1.00 0.00 H new ATOM 0 HB2 SER A 53 20.250 -22.788 -2.085 1.00 0.00 H new ATOM 0 HB3 SER A 53 18.913 -23.559 -2.916 1.00 0.00 H new ATOM 0 HG SER A 53 20.404 -24.611 -0.994 1.00 0.00 H new ATOM 822 N VAL A 54 22.619 -22.593 -2.821 1.00 0.00 N ATOM 823 CA VAL A 54 24.052 -22.373 -2.468 1.00 0.00 C ATOM 824 C VAL A 54 24.200 -22.175 -0.956 1.00 0.00 C ATOM 825 O VAL A 54 23.276 -21.751 -0.291 1.00 0.00 O ATOM 826 CB VAL A 54 24.452 -21.103 -3.219 1.00 0.00 C ATOM 827 CG1 VAL A 54 24.342 -21.343 -4.726 1.00 0.00 C ATOM 828 CG2 VAL A 54 23.519 -19.959 -2.815 1.00 0.00 C ATOM 0 H VAL A 54 21.960 -21.951 -2.380 1.00 0.00 H new ATOM 0 HA VAL A 54 24.681 -23.221 -2.738 1.00 0.00 H new ATOM 0 HB VAL A 54 25.480 -20.841 -2.969 1.00 0.00 H new ATOM 0 HG11 VAL A 54 24.627 -20.437 -5.261 1.00 0.00 H new ATOM 0 HG12 VAL A 54 25.006 -22.158 -5.014 1.00 0.00 H new ATOM 0 HG13 VAL A 54 23.315 -21.605 -4.979 1.00 0.00 H new ATOM 0 HG21 VAL A 54 23.803 -19.052 -3.349 1.00 0.00 H new ATOM 0 HG22 VAL A 54 22.491 -20.222 -3.066 1.00 0.00 H new ATOM 0 HG23 VAL A 54 23.598 -19.787 -1.742 1.00 0.00 H new ATOM 838 N PRO A 55 25.368 -22.492 -0.467 1.00 0.00 N ATOM 839 CA PRO A 55 25.609 -22.335 0.993 1.00 0.00 C ATOM 840 C PRO A 55 25.603 -20.853 1.377 1.00 0.00 C ATOM 841 O PRO A 55 26.628 -20.202 1.397 1.00 0.00 O ATOM 842 CB PRO A 55 26.993 -22.945 1.225 1.00 0.00 C ATOM 843 CG PRO A 55 27.288 -23.746 -0.001 1.00 0.00 C ATOM 844 CD PRO A 55 26.511 -23.128 -1.129 1.00 0.00 C ATOM 0 HA PRO A 55 24.840 -22.818 1.596 1.00 0.00 H new ATOM 0 HB2 PRO A 55 27.743 -22.169 1.376 1.00 0.00 H new ATOM 0 HB3 PRO A 55 27.000 -23.574 2.115 1.00 0.00 H new ATOM 0 HG2 PRO A 55 28.356 -23.738 -0.219 1.00 0.00 H new ATOM 0 HG3 PRO A 55 26.999 -24.788 0.140 1.00 0.00 H new ATOM 0 HD2 PRO A 55 27.111 -22.400 -1.675 1.00 0.00 H new ATOM 0 HD3 PRO A 55 26.187 -23.879 -1.849 1.00 0.00 H new ATOM 852 N GLY A 56 24.454 -20.315 1.679 1.00 0.00 N ATOM 853 CA GLY A 56 24.382 -18.875 2.060 1.00 0.00 C ATOM 854 C GLY A 56 22.960 -18.358 1.830 1.00 0.00 C ATOM 855 O GLY A 56 22.510 -17.441 2.488 1.00 0.00 O ATOM 0 H GLY A 56 23.562 -20.809 1.679 1.00 0.00 H new ATOM 0 HA2 GLY A 56 24.661 -18.750 3.106 1.00 0.00 H new ATOM 0 HA3 GLY A 56 25.091 -18.295 1.469 1.00 0.00 H new ATOM 859 N ALA A 57 22.252 -18.939 0.902 1.00 0.00 N ATOM 860 CA ALA A 57 20.858 -18.480 0.631 1.00 0.00 C ATOM 861 C ALA A 57 19.933 -18.899 1.776 1.00 0.00 C ATOM 862 O ALA A 57 19.602 -20.058 1.928 1.00 0.00 O ATOM 863 CB ALA A 57 20.458 -19.179 -0.668 1.00 0.00 C ATOM 0 H ALA A 57 22.576 -19.711 0.319 1.00 0.00 H new ATOM 0 HA ALA A 57 20.787 -17.396 0.548 1.00 0.00 H new ATOM 0 HB1 ALA A 57 19.441 -18.893 -0.937 1.00 0.00 H new ATOM 0 HB2 ALA A 57 21.141 -18.884 -1.465 1.00 0.00 H new ATOM 0 HB3 ALA A 57 20.506 -20.259 -0.530 1.00 0.00 H new ATOM 869 N LEU A 58 19.513 -17.965 2.583 1.00 0.00 N ATOM 870 CA LEU A 58 18.609 -18.308 3.718 1.00 0.00 C ATOM 871 C LEU A 58 17.173 -17.884 3.399 1.00 0.00 C ATOM 872 O LEU A 58 16.941 -16.997 2.601 1.00 0.00 O ATOM 873 CB LEU A 58 19.153 -17.516 4.907 1.00 0.00 C ATOM 874 CG LEU A 58 20.614 -17.900 5.150 1.00 0.00 C ATOM 875 CD1 LEU A 58 21.154 -17.123 6.351 1.00 0.00 C ATOM 876 CD2 LEU A 58 20.706 -19.401 5.434 1.00 0.00 C ATOM 0 H LEU A 58 19.757 -16.978 2.506 1.00 0.00 H new ATOM 0 HA LEU A 58 18.584 -19.379 3.918 1.00 0.00 H new ATOM 0 HB2 LEU A 58 19.075 -16.447 4.712 1.00 0.00 H new ATOM 0 HB3 LEU A 58 18.559 -17.722 5.797 1.00 0.00 H new ATOM 0 HG LEU A 58 21.204 -17.659 4.266 1.00 0.00 H new ATOM 0 HD11 LEU A 58 22.195 -17.397 6.524 1.00 0.00 H new ATOM 0 HD12 LEU A 58 21.089 -16.053 6.152 1.00 0.00 H new ATOM 0 HD13 LEU A 58 20.564 -17.364 7.235 1.00 0.00 H new ATOM 0 HD21 LEU A 58 21.747 -19.675 5.607 1.00 0.00 H new ATOM 0 HD22 LEU A 58 20.115 -19.641 6.318 1.00 0.00 H new ATOM 0 HD23 LEU A 58 20.322 -19.957 4.579 1.00 0.00 H new ATOM 888 N ASP A 59 16.207 -18.510 4.016 1.00 0.00 N ATOM 889 CA ASP A 59 14.789 -18.139 3.740 1.00 0.00 C ATOM 890 C ASP A 59 14.256 -17.204 4.830 1.00 0.00 C ATOM 891 O ASP A 59 14.064 -17.598 5.963 1.00 0.00 O ATOM 892 CB ASP A 59 14.026 -19.465 3.751 1.00 0.00 C ATOM 893 CG ASP A 59 14.001 -20.052 2.338 1.00 0.00 C ATOM 894 OD1 ASP A 59 15.005 -19.941 1.654 1.00 0.00 O ATOM 895 OD2 ASP A 59 12.978 -20.602 1.966 1.00 0.00 O ATOM 0 H ASP A 59 16.337 -19.259 4.696 1.00 0.00 H new ATOM 0 HA ASP A 59 14.680 -17.610 2.793 1.00 0.00 H new ATOM 0 HB2 ASP A 59 14.502 -20.165 4.438 1.00 0.00 H new ATOM 0 HB3 ASP A 59 13.008 -19.308 4.109 1.00 0.00 H new ATOM 900 N TYR A 60 14.012 -15.966 4.492 1.00 0.00 N ATOM 901 CA TYR A 60 13.486 -15.000 5.496 1.00 0.00 C ATOM 902 C TYR A 60 11.998 -15.253 5.746 1.00 0.00 C ATOM 903 O TYR A 60 11.482 -14.985 6.814 1.00 0.00 O ATOM 904 CB TYR A 60 13.686 -13.628 4.854 1.00 0.00 C ATOM 905 CG TYR A 60 12.901 -13.554 3.567 1.00 0.00 C ATOM 906 CD1 TYR A 60 11.523 -13.310 3.600 1.00 0.00 C ATOM 907 CD2 TYR A 60 13.551 -13.731 2.340 1.00 0.00 C ATOM 908 CE1 TYR A 60 10.795 -13.242 2.405 1.00 0.00 C ATOM 909 CE2 TYR A 60 12.824 -13.662 1.145 1.00 0.00 C ATOM 910 CZ TYR A 60 11.447 -13.418 1.178 1.00 0.00 C ATOM 911 OH TYR A 60 10.729 -13.350 0.001 1.00 0.00 O ATOM 0 H TYR A 60 14.156 -15.582 3.558 1.00 0.00 H new ATOM 0 HA TYR A 60 13.991 -15.087 6.458 1.00 0.00 H new ATOM 0 HB2 TYR A 60 13.359 -12.844 5.537 1.00 0.00 H new ATOM 0 HB3 TYR A 60 14.744 -13.458 4.657 1.00 0.00 H new ATOM 0 HD1 TYR A 60 11.021 -13.174 4.547 1.00 0.00 H new ATOM 0 HD2 TYR A 60 14.614 -13.921 2.315 1.00 0.00 H new ATOM 0 HE1 TYR A 60 9.732 -13.054 2.430 1.00 0.00 H new ATOM 0 HE2 TYR A 60 13.326 -13.797 0.198 1.00 0.00 H new ATOM 0 HH TYR A 60 11.346 -13.252 -0.754 1.00 0.00 H new ATOM 921 N ALA A 61 11.301 -15.761 4.766 1.00 0.00 N ATOM 922 CA ALA A 61 9.844 -16.024 4.945 1.00 0.00 C ATOM 923 C ALA A 61 9.618 -16.935 6.152 1.00 0.00 C ATOM 924 O ALA A 61 8.708 -16.732 6.932 1.00 0.00 O ATOM 925 CB ALA A 61 9.403 -16.718 3.656 1.00 0.00 C ATOM 0 H ALA A 61 11.677 -16.005 3.850 1.00 0.00 H new ATOM 0 HA ALA A 61 9.278 -15.110 5.127 1.00 0.00 H new ATOM 0 HB1 ALA A 61 8.338 -16.945 3.711 1.00 0.00 H new ATOM 0 HB2 ALA A 61 9.591 -16.061 2.807 1.00 0.00 H new ATOM 0 HB3 ALA A 61 9.965 -17.643 3.530 1.00 0.00 H new ATOM 931 N ALA A 62 10.439 -17.935 6.316 1.00 0.00 N ATOM 932 CA ALA A 62 10.265 -18.850 7.478 1.00 0.00 C ATOM 933 C ALA A 62 10.520 -18.090 8.777 1.00 0.00 C ATOM 934 O ALA A 62 9.885 -18.323 9.786 1.00 0.00 O ATOM 935 CB ALA A 62 11.307 -19.952 7.282 1.00 0.00 C ATOM 0 H ALA A 62 11.220 -18.157 5.698 1.00 0.00 H new ATOM 0 HA ALA A 62 9.257 -19.259 7.538 1.00 0.00 H new ATOM 0 HB1 ALA A 62 11.240 -20.667 8.102 1.00 0.00 H new ATOM 0 HB2 ALA A 62 11.121 -20.465 6.338 1.00 0.00 H new ATOM 0 HB3 ALA A 62 12.304 -19.511 7.266 1.00 0.00 H new ATOM 941 N PHE A 63 11.444 -17.179 8.750 1.00 0.00 N ATOM 942 CA PHE A 63 11.754 -16.387 9.974 1.00 0.00 C ATOM 943 C PHE A 63 10.626 -15.392 10.261 1.00 0.00 C ATOM 944 O PHE A 63 10.293 -15.129 11.400 1.00 0.00 O ATOM 945 CB PHE A 63 13.052 -15.647 9.646 1.00 0.00 C ATOM 946 CG PHE A 63 13.308 -14.583 10.688 1.00 0.00 C ATOM 947 CD1 PHE A 63 12.772 -14.716 11.976 1.00 0.00 C ATOM 948 CD2 PHE A 63 14.081 -13.462 10.365 1.00 0.00 C ATOM 949 CE1 PHE A 63 13.011 -13.729 12.939 1.00 0.00 C ATOM 950 CE2 PHE A 63 14.321 -12.475 11.329 1.00 0.00 C ATOM 951 CZ PHE A 63 13.785 -12.609 12.615 1.00 0.00 C ATOM 0 H PHE A 63 12.004 -16.944 7.930 1.00 0.00 H new ATOM 0 HA PHE A 63 11.854 -17.015 10.859 1.00 0.00 H new ATOM 0 HB2 PHE A 63 13.885 -16.349 9.617 1.00 0.00 H new ATOM 0 HB3 PHE A 63 12.983 -15.193 8.658 1.00 0.00 H new ATOM 0 HD1 PHE A 63 12.174 -15.580 12.226 1.00 0.00 H new ATOM 0 HD2 PHE A 63 14.493 -13.358 9.372 1.00 0.00 H new ATOM 0 HE1 PHE A 63 12.598 -13.832 13.932 1.00 0.00 H new ATOM 0 HE2 PHE A 63 14.919 -11.611 11.080 1.00 0.00 H new ATOM 0 HZ PHE A 63 13.969 -11.847 13.358 1.00 0.00 H new ATOM 961 N SER A 64 10.038 -14.833 9.238 1.00 0.00 N ATOM 962 CA SER A 64 8.937 -13.850 9.453 1.00 0.00 C ATOM 963 C SER A 64 7.742 -14.525 10.131 1.00 0.00 C ATOM 964 O SER A 64 7.217 -14.038 11.113 1.00 0.00 O ATOM 965 CB SER A 64 8.559 -13.370 8.054 1.00 0.00 C ATOM 966 OG SER A 64 7.525 -14.196 7.537 1.00 0.00 O ATOM 0 H SER A 64 10.272 -15.015 8.262 1.00 0.00 H new ATOM 0 HA SER A 64 9.241 -13.027 10.100 1.00 0.00 H new ATOM 0 HB2 SER A 64 8.227 -12.332 8.090 1.00 0.00 H new ATOM 0 HB3 SER A 64 9.429 -13.404 7.398 1.00 0.00 H new ATOM 0 HG SER A 64 7.913 -15.023 7.182 1.00 0.00 H new ATOM 972 N SER A 65 7.305 -15.641 9.615 1.00 0.00 N ATOM 973 CA SER A 65 6.141 -16.341 10.233 1.00 0.00 C ATOM 974 C SER A 65 6.458 -16.719 11.682 1.00 0.00 C ATOM 975 O SER A 65 5.674 -16.486 12.580 1.00 0.00 O ATOM 976 CB SER A 65 5.938 -17.594 9.383 1.00 0.00 C ATOM 977 OG SER A 65 5.422 -17.220 8.113 1.00 0.00 O ATOM 0 H SER A 65 7.702 -16.098 8.794 1.00 0.00 H new ATOM 0 HA SER A 65 5.248 -15.716 10.258 1.00 0.00 H new ATOM 0 HB2 SER A 65 6.883 -18.123 9.263 1.00 0.00 H new ATOM 0 HB3 SER A 65 5.251 -18.278 9.881 1.00 0.00 H new ATOM 0 HG SER A 65 5.292 -18.021 7.564 1.00 0.00 H new ATOM 983 N ALA A 66 7.603 -17.299 11.918 1.00 0.00 N ATOM 984 CA ALA A 66 7.969 -17.692 13.310 1.00 0.00 C ATOM 985 C ALA A 66 7.903 -16.475 14.238 1.00 0.00 C ATOM 986 O ALA A 66 7.513 -16.577 15.384 1.00 0.00 O ATOM 987 CB ALA A 66 9.404 -18.211 13.210 1.00 0.00 C ATOM 0 H ALA A 66 8.301 -17.518 11.208 1.00 0.00 H new ATOM 0 HA ALA A 66 7.291 -18.441 13.719 1.00 0.00 H new ATOM 0 HB1 ALA A 66 9.748 -18.521 14.197 1.00 0.00 H new ATOM 0 HB2 ALA A 66 9.436 -19.062 12.530 1.00 0.00 H new ATOM 0 HB3 ALA A 66 10.052 -17.420 12.832 1.00 0.00 H new ATOM 993 N LEU A 67 8.283 -15.327 13.752 1.00 0.00 N ATOM 994 CA LEU A 67 8.244 -14.104 14.604 1.00 0.00 C ATOM 995 C LEU A 67 6.840 -13.907 15.184 1.00 0.00 C ATOM 996 O LEU A 67 6.674 -13.402 16.278 1.00 0.00 O ATOM 997 CB LEU A 67 8.598 -12.954 13.661 1.00 0.00 C ATOM 998 CG LEU A 67 9.725 -12.120 14.269 1.00 0.00 C ATOM 999 CD1 LEU A 67 10.582 -11.522 13.151 1.00 0.00 C ATOM 1000 CD2 LEU A 67 9.124 -10.990 15.108 1.00 0.00 C ATOM 0 H LEU A 67 8.620 -15.182 12.800 1.00 0.00 H new ATOM 0 HA LEU A 67 8.931 -14.167 15.448 1.00 0.00 H new ATOM 0 HB2 LEU A 67 8.905 -13.347 12.692 1.00 0.00 H new ATOM 0 HB3 LEU A 67 7.722 -12.329 13.489 1.00 0.00 H new ATOM 0 HG LEU A 67 10.346 -12.755 14.901 1.00 0.00 H new ATOM 0 HD11 LEU A 67 11.385 -10.928 13.587 1.00 0.00 H new ATOM 0 HD12 LEU A 67 11.009 -12.325 12.551 1.00 0.00 H new ATOM 0 HD13 LEU A 67 9.963 -10.887 12.518 1.00 0.00 H new ATOM 0 HD21 LEU A 67 9.926 -10.394 15.543 1.00 0.00 H new ATOM 0 HD22 LEU A 67 8.504 -10.357 14.474 1.00 0.00 H new ATOM 0 HD23 LEU A 67 8.514 -11.414 15.906 1.00 0.00 H new ATOM 1012 N TYR A 68 5.829 -14.295 14.458 1.00 0.00 N ATOM 1013 CA TYR A 68 4.436 -14.125 14.962 1.00 0.00 C ATOM 1014 C TYR A 68 4.048 -15.308 15.853 1.00 0.00 C ATOM 1015 O TYR A 68 3.279 -15.171 16.784 1.00 0.00 O ATOM 1016 CB TYR A 68 3.553 -14.091 13.708 1.00 0.00 C ATOM 1017 CG TYR A 68 4.268 -13.382 12.580 1.00 0.00 C ATOM 1018 CD1 TYR A 68 4.953 -12.185 12.823 1.00 0.00 C ATOM 1019 CD2 TYR A 68 4.246 -13.926 11.289 1.00 0.00 C ATOM 1020 CE1 TYR A 68 5.617 -11.534 11.776 1.00 0.00 C ATOM 1021 CE2 TYR A 68 4.909 -13.274 10.243 1.00 0.00 C ATOM 1022 CZ TYR A 68 5.594 -12.077 10.486 1.00 0.00 C ATOM 1023 OH TYR A 68 6.248 -11.435 9.455 1.00 0.00 O ATOM 0 H TYR A 68 5.907 -14.723 13.536 1.00 0.00 H new ATOM 0 HA TYR A 68 4.326 -13.221 15.561 1.00 0.00 H new ATOM 0 HB2 TYR A 68 3.301 -15.107 13.405 1.00 0.00 H new ATOM 0 HB3 TYR A 68 2.615 -13.582 13.929 1.00 0.00 H new ATOM 0 HD1 TYR A 68 4.969 -11.764 13.817 1.00 0.00 H new ATOM 0 HD2 TYR A 68 3.717 -14.849 11.101 1.00 0.00 H new ATOM 0 HE1 TYR A 68 6.147 -10.612 11.964 1.00 0.00 H new ATOM 0 HE2 TYR A 68 4.892 -13.694 9.248 1.00 0.00 H new ATOM 0 HH TYR A 68 6.133 -11.946 8.626 1.00 0.00 H new ATOM 1033 N GLY A 69 4.570 -16.471 15.573 1.00 0.00 N ATOM 1034 CA GLY A 69 4.227 -17.662 16.402 1.00 0.00 C ATOM 1035 C GLY A 69 5.079 -17.671 17.672 1.00 0.00 C ATOM 1036 O GLY A 69 5.996 -16.889 17.823 1.00 0.00 O ATOM 0 H GLY A 69 5.219 -16.648 14.806 1.00 0.00 H new ATOM 0 HA2 GLY A 69 3.169 -17.643 16.663 1.00 0.00 H new ATOM 0 HA3 GLY A 69 4.398 -18.575 15.832 1.00 0.00 H new ATOM 1040 N GLU A 70 4.783 -18.553 18.589 1.00 0.00 N ATOM 1041 CA GLU A 70 5.577 -18.615 19.851 1.00 0.00 C ATOM 1042 C GLU A 70 6.321 -19.950 19.943 1.00 0.00 C ATOM 1043 O GLU A 70 6.935 -20.262 20.945 1.00 0.00 O ATOM 1044 CB GLU A 70 4.546 -18.497 20.974 1.00 0.00 C ATOM 1045 CG GLU A 70 3.572 -19.675 20.899 1.00 0.00 C ATOM 1046 CD GLU A 70 3.400 -20.285 22.291 1.00 0.00 C ATOM 1047 OE1 GLU A 70 3.703 -19.605 23.256 1.00 0.00 O ATOM 1048 OE2 GLU A 70 2.968 -21.423 22.367 1.00 0.00 O ATOM 0 H GLU A 70 4.026 -19.233 18.519 1.00 0.00 H new ATOM 0 HA GLU A 70 6.329 -17.828 19.904 1.00 0.00 H new ATOM 0 HB2 GLU A 70 5.047 -18.487 21.942 1.00 0.00 H new ATOM 0 HB3 GLU A 70 4.003 -17.556 20.886 1.00 0.00 H new ATOM 0 HG2 GLU A 70 2.608 -19.340 20.516 1.00 0.00 H new ATOM 0 HG3 GLU A 70 3.947 -20.427 20.205 1.00 0.00 H new ATOM 1055 N SER A 71 6.271 -20.741 18.906 1.00 0.00 N ATOM 1056 CA SER A 71 6.975 -22.055 18.936 1.00 0.00 C ATOM 1057 C SER A 71 7.248 -22.541 17.510 1.00 0.00 C ATOM 1058 O SER A 71 6.344 -22.900 16.782 1.00 0.00 O ATOM 1059 CB SER A 71 6.012 -23.004 19.649 1.00 0.00 C ATOM 1060 OG SER A 71 6.167 -22.862 21.054 1.00 0.00 O ATOM 0 H SER A 71 5.774 -20.535 18.040 1.00 0.00 H new ATOM 0 HA SER A 71 7.939 -21.996 19.442 1.00 0.00 H new ATOM 0 HB2 SER A 71 4.985 -22.782 19.361 1.00 0.00 H new ATOM 0 HB3 SER A 71 6.211 -24.034 19.352 1.00 0.00 H new ATOM 0 HG SER A 71 6.578 -21.995 21.252 1.00 0.00 H new ATOM 1066 N ASP A 72 8.488 -22.552 17.104 1.00 0.00 N ATOM 1067 CA ASP A 72 8.818 -23.013 15.725 1.00 0.00 C ATOM 1068 C ASP A 72 9.138 -24.511 15.729 1.00 0.00 C ATOM 1069 O ASP A 72 9.801 -25.011 16.617 1.00 0.00 O ATOM 1070 CB ASP A 72 10.049 -22.203 15.322 1.00 0.00 C ATOM 1071 CG ASP A 72 11.166 -22.432 16.341 1.00 0.00 C ATOM 1072 OD1 ASP A 72 11.928 -23.367 16.157 1.00 0.00 O ATOM 1073 OD2 ASP A 72 11.241 -21.668 17.290 1.00 0.00 O ATOM 0 H ASP A 72 9.287 -22.262 17.667 1.00 0.00 H new ATOM 0 HA ASP A 72 7.989 -22.868 15.032 1.00 0.00 H new ATOM 0 HB2 ASP A 72 10.383 -22.499 14.328 1.00 0.00 H new ATOM 0 HB3 ASP A 72 9.800 -21.143 15.272 1.00 0.00 H new ATOM 1078 N LEU A 73 8.675 -25.229 14.742 1.00 0.00 N ATOM 1079 CA LEU A 73 8.955 -26.693 14.690 1.00 0.00 C ATOM 1080 C LEU A 73 8.674 -27.235 13.287 1.00 0.00 C ATOM 1081 O LEU A 73 9.490 -27.915 12.698 1.00 0.00 O ATOM 1082 CB LEU A 73 7.999 -27.317 15.707 1.00 0.00 C ATOM 1083 CG LEU A 73 6.560 -26.945 15.350 1.00 0.00 C ATOM 1084 CD1 LEU A 73 5.702 -28.210 15.308 1.00 0.00 C ATOM 1085 CD2 LEU A 73 6.005 -25.987 16.407 1.00 0.00 C ATOM 0 H LEU A 73 8.116 -24.866 13.970 1.00 0.00 H new ATOM 0 HA LEU A 73 9.996 -26.922 14.917 1.00 0.00 H new ATOM 0 HB2 LEU A 73 8.115 -28.401 15.713 1.00 0.00 H new ATOM 0 HB3 LEU A 73 8.238 -26.965 16.710 1.00 0.00 H new ATOM 0 HG LEU A 73 6.541 -26.461 14.374 1.00 0.00 H new ATOM 0 HD11 LEU A 73 4.676 -27.945 15.053 1.00 0.00 H new ATOM 0 HD12 LEU A 73 6.098 -28.893 14.556 1.00 0.00 H new ATOM 0 HD13 LEU A 73 5.720 -28.695 16.284 1.00 0.00 H new ATOM 0 HD21 LEU A 73 4.979 -25.721 16.154 1.00 0.00 H new ATOM 0 HD22 LEU A 73 6.024 -26.472 17.383 1.00 0.00 H new ATOM 0 HD23 LEU A 73 6.617 -25.085 16.438 1.00 0.00 H new TER 1097 LEU A 73 ATOM 1098 N GLY B 7 10.629 3.142 -4.675 1.00 0.00 N ATOM 1099 CA GLY B 7 11.826 2.481 -4.081 1.00 0.00 C ATOM 1100 C GLY B 7 11.845 2.720 -2.570 1.00 0.00 C ATOM 1101 O GLY B 7 12.620 3.506 -2.065 1.00 0.00 O ATOM 0 HA2 GLY B 7 11.805 1.411 -4.290 1.00 0.00 H new ATOM 0 HA3 GLY B 7 12.735 2.877 -4.534 1.00 0.00 H new ATOM 1105 N LYS B 8 10.995 2.045 -1.843 1.00 0.00 N ATOM 1106 CA LYS B 8 10.965 2.235 -0.364 1.00 0.00 C ATOM 1107 C LYS B 8 11.844 1.184 0.322 1.00 0.00 C ATOM 1108 O LYS B 8 11.422 0.514 1.243 1.00 0.00 O ATOM 1109 CB LYS B 8 9.499 2.046 0.030 1.00 0.00 C ATOM 1110 CG LYS B 8 9.039 0.642 -0.367 1.00 0.00 C ATOM 1111 CD LYS B 8 7.974 0.157 0.618 1.00 0.00 C ATOM 1112 CE LYS B 8 6.795 -0.438 -0.155 1.00 0.00 C ATOM 1113 NZ LYS B 8 6.018 -1.201 0.861 1.00 0.00 N ATOM 0 H LYS B 8 10.322 1.372 -2.209 1.00 0.00 H new ATOM 0 HA LYS B 8 11.345 3.212 -0.065 1.00 0.00 H new ATOM 0 HB2 LYS B 8 9.379 2.189 1.104 1.00 0.00 H new ATOM 0 HB3 LYS B 8 8.880 2.796 -0.463 1.00 0.00 H new ATOM 0 HG2 LYS B 8 8.635 0.653 -1.379 1.00 0.00 H new ATOM 0 HG3 LYS B 8 9.887 -0.043 -0.369 1.00 0.00 H new ATOM 0 HD2 LYS B 8 8.397 -0.591 1.288 1.00 0.00 H new ATOM 0 HD3 LYS B 8 7.634 0.986 1.239 1.00 0.00 H new ATOM 0 HE2 LYS B 8 6.188 0.343 -0.612 1.00 0.00 H new ATOM 0 HE3 LYS B 8 7.138 -1.088 -0.960 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 5.191 -1.640 0.408 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 6.620 -1.941 1.274 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 5.699 -0.555 1.611 1.00 0.00 H new ATOM 1127 N LYS B 9 13.063 1.035 -0.121 1.00 0.00 N ATOM 1128 CA LYS B 9 13.966 0.027 0.507 1.00 0.00 C ATOM 1129 C LYS B 9 14.225 0.390 1.971 1.00 0.00 C ATOM 1130 O LYS B 9 14.108 -0.434 2.856 1.00 0.00 O ATOM 1131 CB LYS B 9 15.264 0.097 -0.298 1.00 0.00 C ATOM 1132 CG LYS B 9 16.015 -1.231 -0.172 1.00 0.00 C ATOM 1133 CD LYS B 9 17.522 -0.968 -0.165 1.00 0.00 C ATOM 1134 CE LYS B 9 18.105 -1.367 1.194 1.00 0.00 C ATOM 1135 NZ LYS B 9 18.806 -0.148 1.684 1.00 0.00 N ATOM 0 H LYS B 9 13.473 1.566 -0.889 1.00 0.00 H new ATOM 0 HA LYS B 9 13.535 -0.974 0.497 1.00 0.00 H new ATOM 0 HB2 LYS B 9 15.044 0.305 -1.345 1.00 0.00 H new ATOM 0 HB3 LYS B 9 15.886 0.915 0.065 1.00 0.00 H new ATOM 0 HG2 LYS B 9 15.720 -1.742 0.745 1.00 0.00 H new ATOM 0 HG3 LYS B 9 15.754 -1.888 -1.001 1.00 0.00 H new ATOM 0 HD2 LYS B 9 18.005 -1.536 -0.960 1.00 0.00 H new ATOM 0 HD3 LYS B 9 17.719 0.086 -0.362 1.00 0.00 H new ATOM 0 HE2 LYS B 9 17.321 -1.676 1.885 1.00 0.00 H new ATOM 0 HE3 LYS B 9 18.793 -2.206 1.097 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 19.232 -0.342 2.612 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 19.551 0.119 1.010 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 18.124 0.632 1.773 1.00 0.00 H new ATOM 1149 N ALA B 10 14.577 1.620 2.234 1.00 0.00 N ATOM 1150 CA ALA B 10 14.841 2.034 3.642 1.00 0.00 C ATOM 1151 C ALA B 10 13.625 1.720 4.517 1.00 0.00 C ATOM 1152 O ALA B 10 13.754 1.286 5.645 1.00 0.00 O ATOM 1153 CB ALA B 10 15.082 3.542 3.573 1.00 0.00 C ATOM 0 H ALA B 10 14.693 2.355 1.536 1.00 0.00 H new ATOM 0 HA ALA B 10 15.690 1.508 4.078 1.00 0.00 H new ATOM 0 HB1 ALA B 10 15.284 3.924 4.574 1.00 0.00 H new ATOM 0 HB2 ALA B 10 15.937 3.745 2.927 1.00 0.00 H new ATOM 0 HB3 ALA B 10 14.197 4.034 3.169 1.00 0.00 H new ATOM 1159 N GLU B 11 12.445 1.932 4.003 1.00 0.00 N ATOM 1160 CA GLU B 11 11.220 1.643 4.802 1.00 0.00 C ATOM 1161 C GLU B 11 11.137 0.148 5.117 1.00 0.00 C ATOM 1162 O GLU B 11 10.763 -0.249 6.202 1.00 0.00 O ATOM 1163 CB GLU B 11 10.054 2.073 3.913 1.00 0.00 C ATOM 1164 CG GLU B 11 9.165 3.054 4.681 1.00 0.00 C ATOM 1165 CD GLU B 11 8.820 2.466 6.051 1.00 0.00 C ATOM 1166 OE1 GLU B 11 8.411 1.318 6.096 1.00 0.00 O ATOM 1167 OE2 GLU B 11 8.972 3.175 7.032 1.00 0.00 O ATOM 0 H GLU B 11 12.276 2.293 3.064 1.00 0.00 H new ATOM 0 HA GLU B 11 11.215 2.169 5.757 1.00 0.00 H new ATOM 0 HB2 GLU B 11 10.429 2.541 3.003 1.00 0.00 H new ATOM 0 HB3 GLU B 11 9.474 1.202 3.608 1.00 0.00 H new ATOM 0 HG2 GLU B 11 9.678 4.008 4.802 1.00 0.00 H new ATOM 0 HG3 GLU B 11 8.253 3.252 4.118 1.00 0.00 H new ATOM 1174 N ALA B 12 11.484 -0.687 4.174 1.00 0.00 N ATOM 1175 CA ALA B 12 11.423 -2.156 4.424 1.00 0.00 C ATOM 1176 C ALA B 12 12.381 -2.533 5.554 1.00 0.00 C ATOM 1177 O ALA B 12 12.053 -3.316 6.424 1.00 0.00 O ATOM 1178 CB ALA B 12 11.865 -2.801 3.109 1.00 0.00 C ATOM 0 H ALA B 12 11.806 -0.416 3.245 1.00 0.00 H new ATOM 0 HA ALA B 12 10.428 -2.486 4.724 1.00 0.00 H new ATOM 0 HB1 ALA B 12 11.847 -3.886 3.212 1.00 0.00 H new ATOM 0 HB2 ALA B 12 11.187 -2.501 2.310 1.00 0.00 H new ATOM 0 HB3 ALA B 12 12.877 -2.476 2.867 1.00 0.00 H new ATOM 1184 N VAL B 13 13.560 -1.976 5.557 1.00 0.00 N ATOM 1185 CA VAL B 13 14.531 -2.298 6.641 1.00 0.00 C ATOM 1186 C VAL B 13 13.934 -1.919 7.998 1.00 0.00 C ATOM 1187 O VAL B 13 14.075 -2.633 8.972 1.00 0.00 O ATOM 1188 CB VAL B 13 15.764 -1.449 6.336 1.00 0.00 C ATOM 1189 CG1 VAL B 13 16.820 -1.674 7.420 1.00 0.00 C ATOM 1190 CG2 VAL B 13 16.337 -1.853 4.976 1.00 0.00 C ATOM 0 H VAL B 13 13.893 -1.313 4.857 1.00 0.00 H new ATOM 0 HA VAL B 13 14.775 -3.359 6.683 1.00 0.00 H new ATOM 0 HB VAL B 13 15.483 -0.396 6.315 1.00 0.00 H new ATOM 0 HG11 VAL B 13 17.700 -1.068 7.202 1.00 0.00 H new ATOM 0 HG12 VAL B 13 16.413 -1.387 8.390 1.00 0.00 H new ATOM 0 HG13 VAL B 13 17.101 -2.727 7.441 1.00 0.00 H new ATOM 0 HG21 VAL B 13 17.217 -1.248 4.758 1.00 0.00 H new ATOM 0 HG22 VAL B 13 16.617 -2.906 4.998 1.00 0.00 H new ATOM 0 HG23 VAL B 13 15.586 -1.693 4.203 1.00 0.00 H new ATOM 1200 N ALA B 14 13.262 -0.802 8.068 1.00 0.00 N ATOM 1201 CA ALA B 14 12.649 -0.376 9.359 1.00 0.00 C ATOM 1202 C ALA B 14 11.656 -1.438 9.840 1.00 0.00 C ATOM 1203 O ALA B 14 11.535 -1.702 11.020 1.00 0.00 O ATOM 1204 CB ALA B 14 11.925 0.933 9.040 1.00 0.00 C ATOM 0 H ALA B 14 13.111 -0.165 7.286 1.00 0.00 H new ATOM 0 HA ALA B 14 13.388 -0.248 10.150 1.00 0.00 H new ATOM 0 HB1 ALA B 14 11.446 1.313 9.942 1.00 0.00 H new ATOM 0 HB2 ALA B 14 12.644 1.667 8.675 1.00 0.00 H new ATOM 0 HB3 ALA B 14 11.169 0.754 8.276 1.00 0.00 H new ATOM 1210 N THR B 15 10.945 -2.049 8.933 1.00 0.00 N ATOM 1211 CA THR B 15 9.961 -3.095 9.333 1.00 0.00 C ATOM 1212 C THR B 15 10.691 -4.321 9.887 1.00 0.00 C ATOM 1213 O THR B 15 10.293 -4.898 10.879 1.00 0.00 O ATOM 1214 CB THR B 15 9.218 -3.450 8.044 1.00 0.00 C ATOM 1215 OG1 THR B 15 8.748 -2.260 7.427 1.00 0.00 O ATOM 1216 CG2 THR B 15 8.034 -4.361 8.367 1.00 0.00 C ATOM 0 H THR B 15 11.003 -1.869 7.931 1.00 0.00 H new ATOM 0 HA THR B 15 9.283 -2.750 10.113 1.00 0.00 H new ATOM 0 HB THR B 15 9.896 -3.968 7.366 1.00 0.00 H new ATOM 0 HG1 THR B 15 8.273 -2.486 6.600 1.00 0.00 H new ATOM 0 HG21 THR B 15 7.507 -4.612 7.447 1.00 0.00 H new ATOM 0 HG22 THR B 15 8.396 -5.275 8.839 1.00 0.00 H new ATOM 0 HG23 THR B 15 7.354 -3.847 9.046 1.00 0.00 H new ATOM 1224 N VAL B 16 11.756 -4.723 9.251 1.00 0.00 N ATOM 1225 CA VAL B 16 12.515 -5.912 9.739 1.00 0.00 C ATOM 1226 C VAL B 16 13.117 -5.628 11.118 1.00 0.00 C ATOM 1227 O VAL B 16 13.125 -6.476 11.989 1.00 0.00 O ATOM 1228 CB VAL B 16 13.622 -6.123 8.706 1.00 0.00 C ATOM 1229 CG1 VAL B 16 14.520 -7.280 9.148 1.00 0.00 C ATOM 1230 CG2 VAL B 16 12.995 -6.454 7.349 1.00 0.00 C ATOM 0 H VAL B 16 12.135 -4.280 8.414 1.00 0.00 H new ATOM 0 HA VAL B 16 11.880 -6.792 9.845 1.00 0.00 H new ATOM 0 HB VAL B 16 14.217 -5.214 8.621 1.00 0.00 H new ATOM 0 HG11 VAL B 16 15.309 -7.430 8.411 1.00 0.00 H new ATOM 0 HG12 VAL B 16 14.966 -7.046 10.115 1.00 0.00 H new ATOM 0 HG13 VAL B 16 13.926 -8.190 9.234 1.00 0.00 H new ATOM 0 HG21 VAL B 16 13.783 -6.605 6.611 1.00 0.00 H new ATOM 0 HG22 VAL B 16 12.400 -7.363 7.435 1.00 0.00 H new ATOM 0 HG23 VAL B 16 12.355 -5.630 7.033 1.00 0.00 H new ATOM 1240 N VAL B 17 13.626 -4.445 11.320 1.00 0.00 N ATOM 1241 CA VAL B 17 14.235 -4.106 12.640 1.00 0.00 C ATOM 1242 C VAL B 17 13.179 -4.163 13.749 1.00 0.00 C ATOM 1243 O VAL B 17 13.376 -4.782 14.775 1.00 0.00 O ATOM 1244 CB VAL B 17 14.760 -2.680 12.477 1.00 0.00 C ATOM 1245 CG1 VAL B 17 15.222 -2.146 13.834 1.00 0.00 C ATOM 1246 CG2 VAL B 17 15.941 -2.680 11.503 1.00 0.00 C ATOM 0 H VAL B 17 13.647 -3.696 10.628 1.00 0.00 H new ATOM 0 HA VAL B 17 15.023 -4.805 12.919 1.00 0.00 H new ATOM 0 HB VAL B 17 13.965 -2.044 12.088 1.00 0.00 H new ATOM 0 HG11 VAL B 17 15.596 -1.129 13.717 1.00 0.00 H new ATOM 0 HG12 VAL B 17 14.383 -2.146 14.530 1.00 0.00 H new ATOM 0 HG13 VAL B 17 16.017 -2.782 14.224 1.00 0.00 H new ATOM 0 HG21 VAL B 17 16.316 -1.663 11.386 1.00 0.00 H new ATOM 0 HG22 VAL B 17 16.735 -3.317 11.893 1.00 0.00 H new ATOM 0 HG23 VAL B 17 15.614 -3.060 10.535 1.00 0.00 H new ATOM 1256 N ALA B 18 12.062 -3.517 13.553 1.00 0.00 N ATOM 1257 CA ALA B 18 10.997 -3.526 14.599 1.00 0.00 C ATOM 1258 C ALA B 18 10.451 -4.942 14.804 1.00 0.00 C ATOM 1259 O ALA B 18 10.179 -5.356 15.913 1.00 0.00 O ATOM 1260 CB ALA B 18 9.904 -2.605 14.057 1.00 0.00 C ATOM 0 H ALA B 18 11.840 -2.983 12.713 1.00 0.00 H new ATOM 0 HA ALA B 18 11.373 -3.194 15.567 1.00 0.00 H new ATOM 0 HB1 ALA B 18 9.081 -2.558 14.770 1.00 0.00 H new ATOM 0 HB2 ALA B 18 10.312 -1.605 13.907 1.00 0.00 H new ATOM 0 HB3 ALA B 18 9.538 -2.994 13.107 1.00 0.00 H new ATOM 1266 N ALA B 19 10.279 -5.684 13.745 1.00 0.00 N ATOM 1267 CA ALA B 19 9.739 -7.069 13.885 1.00 0.00 C ATOM 1268 C ALA B 19 10.744 -7.969 14.612 1.00 0.00 C ATOM 1269 O ALA B 19 10.378 -8.771 15.448 1.00 0.00 O ATOM 1270 CB ALA B 19 9.521 -7.556 12.453 1.00 0.00 C ATOM 0 H ALA B 19 10.488 -5.393 12.790 1.00 0.00 H new ATOM 0 HA ALA B 19 8.819 -7.092 14.470 1.00 0.00 H new ATOM 0 HB1 ALA B 19 9.124 -8.571 12.470 1.00 0.00 H new ATOM 0 HB2 ALA B 19 8.813 -6.898 11.949 1.00 0.00 H new ATOM 0 HB3 ALA B 19 10.470 -7.547 11.917 1.00 0.00 H new ATOM 1276 N VAL B 20 12.003 -7.850 14.295 1.00 0.00 N ATOM 1277 CA VAL B 20 13.024 -8.708 14.963 1.00 0.00 C ATOM 1278 C VAL B 20 13.150 -8.344 16.447 1.00 0.00 C ATOM 1279 O VAL B 20 13.308 -9.201 17.293 1.00 0.00 O ATOM 1280 CB VAL B 20 14.329 -8.411 14.226 1.00 0.00 C ATOM 1281 CG1 VAL B 20 15.461 -9.242 14.833 1.00 0.00 C ATOM 1282 CG2 VAL B 20 14.169 -8.770 12.748 1.00 0.00 C ATOM 0 H VAL B 20 12.370 -7.197 13.603 1.00 0.00 H new ATOM 0 HA VAL B 20 12.760 -9.765 14.923 1.00 0.00 H new ATOM 0 HB VAL B 20 14.567 -7.352 14.321 1.00 0.00 H new ATOM 0 HG11 VAL B 20 16.391 -9.029 14.306 1.00 0.00 H new ATOM 0 HG12 VAL B 20 15.574 -8.988 15.887 1.00 0.00 H new ATOM 0 HG13 VAL B 20 15.225 -10.302 14.739 1.00 0.00 H new ATOM 0 HG21 VAL B 20 15.099 -8.559 12.220 1.00 0.00 H new ATOM 0 HG22 VAL B 20 13.931 -9.830 12.655 1.00 0.00 H new ATOM 0 HG23 VAL B 20 13.363 -8.178 12.315 1.00 0.00 H new ATOM 1292 N ASP B 21 13.086 -7.082 16.767 1.00 0.00 N ATOM 1293 CA ASP B 21 13.208 -6.666 18.195 1.00 0.00 C ATOM 1294 C ASP B 21 12.026 -7.197 19.011 1.00 0.00 C ATOM 1295 O ASP B 21 12.156 -7.510 20.177 1.00 0.00 O ATOM 1296 CB ASP B 21 13.189 -5.137 18.160 1.00 0.00 C ATOM 1297 CG ASP B 21 14.398 -4.592 18.923 1.00 0.00 C ATOM 1298 OD1 ASP B 21 14.841 -5.257 19.844 1.00 0.00 O ATOM 1299 OD2 ASP B 21 14.859 -3.519 18.572 1.00 0.00 O ATOM 0 H ASP B 21 12.955 -6.319 16.103 1.00 0.00 H new ATOM 0 HA ASP B 21 14.112 -7.057 18.662 1.00 0.00 H new ATOM 0 HB2 ASP B 21 13.209 -4.786 17.128 1.00 0.00 H new ATOM 0 HB3 ASP B 21 12.267 -4.764 18.605 1.00 0.00 H new ATOM 1304 N GLN B 22 10.874 -7.294 18.409 1.00 0.00 N ATOM 1305 CA GLN B 22 9.683 -7.798 19.152 1.00 0.00 C ATOM 1306 C GLN B 22 9.967 -9.182 19.743 1.00 0.00 C ATOM 1307 O GLN B 22 9.662 -9.452 20.888 1.00 0.00 O ATOM 1308 CB GLN B 22 8.572 -7.879 18.105 1.00 0.00 C ATOM 1309 CG GLN B 22 7.249 -7.431 18.729 1.00 0.00 C ATOM 1310 CD GLN B 22 6.379 -6.769 17.660 1.00 0.00 C ATOM 1311 OE1 GLN B 22 5.760 -7.442 16.861 1.00 0.00 O ATOM 1312 NE2 GLN B 22 6.306 -5.467 17.612 1.00 0.00 N ATOM 0 H GLN B 22 10.704 -7.046 17.434 1.00 0.00 H new ATOM 0 HA GLN B 22 9.414 -7.150 19.986 1.00 0.00 H new ATOM 0 HB2 GLN B 22 8.816 -7.247 17.251 1.00 0.00 H new ATOM 0 HB3 GLN B 22 8.483 -8.899 17.732 1.00 0.00 H new ATOM 0 HG2 GLN B 22 6.728 -8.287 19.158 1.00 0.00 H new ATOM 0 HG3 GLN B 22 7.437 -6.732 19.544 1.00 0.00 H new ATOM 0 HE21 GLN B 22 6.826 -4.902 18.283 1.00 0.00 H new ATOM 0 HE22 GLN B 22 5.729 -5.014 16.903 1.00 0.00 H new ATOM 1321 N ALA B 23 10.544 -10.062 18.972 1.00 0.00 N ATOM 1322 CA ALA B 23 10.840 -11.429 19.494 1.00 0.00 C ATOM 1323 C ALA B 23 11.888 -11.360 20.609 1.00 0.00 C ATOM 1324 O ALA B 23 11.815 -12.078 21.586 1.00 0.00 O ATOM 1325 CB ALA B 23 11.383 -12.202 18.293 1.00 0.00 C ATOM 0 H ALA B 23 10.823 -9.896 18.005 1.00 0.00 H new ATOM 0 HA ALA B 23 9.958 -11.906 19.921 1.00 0.00 H new ATOM 0 HB1 ALA B 23 11.625 -13.221 18.595 1.00 0.00 H new ATOM 0 HB2 ALA B 23 10.630 -12.227 17.505 1.00 0.00 H new ATOM 0 HB3 ALA B 23 12.282 -11.711 17.920 1.00 0.00 H new ATOM 1331 N ARG B 24 12.864 -10.505 20.470 1.00 0.00 N ATOM 1332 CA ARG B 24 13.915 -10.397 21.524 1.00 0.00 C ATOM 1333 C ARG B 24 13.313 -9.837 22.816 1.00 0.00 C ATOM 1334 O ARG B 24 13.529 -10.361 23.890 1.00 0.00 O ATOM 1335 CB ARG B 24 14.951 -9.428 20.955 1.00 0.00 C ATOM 1336 CG ARG B 24 16.150 -9.349 21.901 1.00 0.00 C ATOM 1337 CD ARG B 24 17.146 -8.310 21.382 1.00 0.00 C ATOM 1338 NE ARG B 24 17.627 -7.600 22.600 1.00 0.00 N ATOM 1339 CZ ARG B 24 16.872 -6.707 23.180 1.00 0.00 C ATOM 1340 NH1 ARG B 24 15.693 -6.426 22.693 1.00 0.00 N ATOM 1341 NH2 ARG B 24 17.297 -6.092 24.250 1.00 0.00 N ATOM 0 H ARG B 24 12.980 -9.877 19.674 1.00 0.00 H new ATOM 0 HA ARG B 24 14.353 -11.365 21.769 1.00 0.00 H new ATOM 0 HB2 ARG B 24 15.274 -9.762 19.969 1.00 0.00 H new ATOM 0 HB3 ARG B 24 14.509 -8.440 20.828 1.00 0.00 H new ATOM 0 HG2 ARG B 24 15.818 -9.080 22.904 1.00 0.00 H new ATOM 0 HG3 ARG B 24 16.632 -10.324 21.976 1.00 0.00 H new ATOM 0 HD2 ARG B 24 17.970 -8.784 20.849 1.00 0.00 H new ATOM 0 HD3 ARG B 24 16.671 -7.621 20.684 1.00 0.00 H new ATOM 0 HE ARG B 24 18.549 -7.812 22.982 1.00 0.00 H new ATOM 0 HH11 ARG B 24 15.359 -6.905 21.857 1.00 0.00 H new ATOM 0 HH12 ARG B 24 15.106 -5.728 23.149 1.00 0.00 H new ATOM 0 HH21 ARG B 24 18.218 -6.310 24.631 1.00 0.00 H new ATOM 0 HH22 ARG B 24 16.708 -5.394 24.705 1.00 0.00 H new ATOM 1355 N VAL B 25 12.564 -8.776 22.719 1.00 0.00 N ATOM 1356 CA VAL B 25 11.950 -8.179 23.940 1.00 0.00 C ATOM 1357 C VAL B 25 10.957 -9.158 24.567 1.00 0.00 C ATOM 1358 O VAL B 25 10.630 -9.066 25.734 1.00 0.00 O ATOM 1359 CB VAL B 25 11.231 -6.924 23.449 1.00 0.00 C ATOM 1360 CG1 VAL B 25 10.462 -6.290 24.609 1.00 0.00 C ATOM 1361 CG2 VAL B 25 12.260 -5.926 22.916 1.00 0.00 C ATOM 0 H VAL B 25 12.349 -8.294 21.846 1.00 0.00 H new ATOM 0 HA VAL B 25 12.692 -7.950 24.705 1.00 0.00 H new ATOM 0 HB VAL B 25 10.535 -7.191 22.654 1.00 0.00 H new ATOM 0 HG11 VAL B 25 9.949 -5.394 24.259 1.00 0.00 H new ATOM 0 HG12 VAL B 25 9.730 -7.001 24.992 1.00 0.00 H new ATOM 0 HG13 VAL B 25 11.158 -6.022 25.404 1.00 0.00 H new ATOM 0 HG21 VAL B 25 11.749 -5.029 22.565 1.00 0.00 H new ATOM 0 HG22 VAL B 25 12.955 -5.660 23.712 1.00 0.00 H new ATOM 0 HG23 VAL B 25 12.810 -6.377 22.090 1.00 0.00 H new ATOM 1371 N ARG B 26 10.477 -10.095 23.802 1.00 0.00 N ATOM 1372 CA ARG B 26 9.506 -11.082 24.350 1.00 0.00 C ATOM 1373 C ARG B 26 10.247 -12.262 24.964 1.00 0.00 C ATOM 1374 O ARG B 26 10.542 -12.290 26.142 1.00 0.00 O ATOM 1375 CB ARG B 26 8.667 -11.523 23.148 1.00 0.00 C ATOM 1376 CG ARG B 26 7.750 -12.678 23.560 1.00 0.00 C ATOM 1377 CD ARG B 26 6.501 -12.678 22.676 1.00 0.00 C ATOM 1378 NE ARG B 26 5.711 -13.860 23.125 1.00 0.00 N ATOM 1379 CZ ARG B 26 4.998 -13.798 24.217 1.00 0.00 C ATOM 1380 NH1 ARG B 26 4.975 -12.701 24.926 1.00 0.00 N ATOM 1381 NH2 ARG B 26 4.308 -14.836 24.603 1.00 0.00 N ATOM 0 H ARG B 26 10.715 -10.221 22.818 1.00 0.00 H new ATOM 0 HA ARG B 26 8.884 -10.661 25.140 1.00 0.00 H new ATOM 0 HB2 ARG B 26 8.073 -10.687 22.780 1.00 0.00 H new ATOM 0 HB3 ARG B 26 9.318 -11.835 22.332 1.00 0.00 H new ATOM 0 HG2 ARG B 26 8.277 -13.627 23.463 1.00 0.00 H new ATOM 0 HG3 ARG B 26 7.467 -12.576 24.608 1.00 0.00 H new ATOM 0 HD2 ARG B 26 5.933 -11.755 22.795 1.00 0.00 H new ATOM 0 HD3 ARG B 26 6.764 -12.757 21.621 1.00 0.00 H new ATOM 0 HE ARG B 26 5.728 -14.720 22.577 1.00 0.00 H new ATOM 0 HH11 ARG B 26 5.515 -11.889 24.627 1.00 0.00 H new ATOM 0 HH12 ARG B 26 4.417 -12.656 25.779 1.00 0.00 H new ATOM 0 HH21 ARG B 26 4.326 -15.694 24.052 1.00 0.00 H new ATOM 0 HH22 ARG B 26 3.750 -14.789 25.456 1.00 0.00 H new ATOM 1395 N GLU B 27 10.548 -13.230 24.167 1.00 0.00 N ATOM 1396 CA GLU B 27 11.274 -14.430 24.674 1.00 0.00 C ATOM 1397 C GLU B 27 12.763 -14.339 24.317 1.00 0.00 C ATOM 1398 O GLU B 27 13.115 -14.007 23.203 1.00 0.00 O ATOM 1399 CB GLU B 27 10.626 -15.618 23.963 1.00 0.00 C ATOM 1400 CG GLU B 27 10.866 -15.503 22.456 1.00 0.00 C ATOM 1401 CD GLU B 27 9.558 -15.764 21.709 1.00 0.00 C ATOM 1402 OE1 GLU B 27 8.517 -15.407 22.235 1.00 0.00 O ATOM 1403 OE2 GLU B 27 9.618 -16.316 20.622 1.00 0.00 O ATOM 0 H GLU B 27 10.324 -13.251 23.172 1.00 0.00 H new ATOM 0 HA GLU B 27 11.211 -14.521 25.758 1.00 0.00 H new ATOM 0 HB2 GLU B 27 11.044 -16.552 24.338 1.00 0.00 H new ATOM 0 HB3 GLU B 27 9.556 -15.641 24.171 1.00 0.00 H new ATOM 0 HG2 GLU B 27 11.244 -14.510 22.212 1.00 0.00 H new ATOM 0 HG3 GLU B 27 11.625 -16.219 22.142 1.00 0.00 H new ATOM 1410 N PRO B 28 13.587 -14.639 25.285 1.00 0.00 N ATOM 1411 CA PRO B 28 15.053 -14.579 25.030 1.00 0.00 C ATOM 1412 C PRO B 28 15.562 -15.930 24.521 1.00 0.00 C ATOM 1413 O PRO B 28 15.907 -16.804 25.291 1.00 0.00 O ATOM 1414 CB PRO B 28 15.665 -14.253 26.393 1.00 0.00 C ATOM 1415 CG PRO B 28 14.541 -13.727 27.223 1.00 0.00 C ATOM 1416 CD PRO B 28 13.275 -14.331 26.685 1.00 0.00 C ATOM 0 HA PRO B 28 15.315 -13.841 24.271 1.00 0.00 H new ATOM 0 HB2 PRO B 28 16.105 -15.141 26.847 1.00 0.00 H new ATOM 0 HB3 PRO B 28 16.461 -13.515 26.299 1.00 0.00 H new ATOM 0 HG2 PRO B 28 14.679 -13.992 28.271 1.00 0.00 H new ATOM 0 HG3 PRO B 28 14.501 -12.639 27.172 1.00 0.00 H new ATOM 0 HD2 PRO B 28 12.996 -15.229 27.237 1.00 0.00 H new ATOM 0 HD3 PRO B 28 12.439 -13.636 26.763 1.00 0.00 H new ATOM 1424 N ARG B 29 15.617 -16.108 23.228 1.00 0.00 N ATOM 1425 CA ARG B 29 16.108 -17.403 22.676 1.00 0.00 C ATOM 1426 C ARG B 29 17.604 -17.312 22.367 1.00 0.00 C ATOM 1427 O ARG B 29 18.432 -17.793 23.114 1.00 0.00 O ATOM 1428 CB ARG B 29 15.308 -17.619 21.390 1.00 0.00 C ATOM 1429 CG ARG B 29 14.798 -19.062 21.343 1.00 0.00 C ATOM 1430 CD ARG B 29 15.305 -19.744 20.070 1.00 0.00 C ATOM 1431 NE ARG B 29 16.023 -20.961 20.541 1.00 0.00 N ATOM 1432 CZ ARG B 29 16.856 -21.580 19.748 1.00 0.00 C ATOM 1433 NH1 ARG B 29 17.077 -21.127 18.545 1.00 0.00 N ATOM 1434 NH2 ARG B 29 17.473 -22.655 20.161 1.00 0.00 N ATOM 0 H ARG B 29 15.344 -15.414 22.532 1.00 0.00 H new ATOM 0 HA ARG B 29 15.977 -18.226 23.379 1.00 0.00 H new ATOM 0 HB2 ARG B 29 14.469 -16.924 21.350 1.00 0.00 H new ATOM 0 HB3 ARG B 29 15.934 -17.414 20.521 1.00 0.00 H new ATOM 0 HG2 ARG B 29 15.141 -19.608 22.222 1.00 0.00 H new ATOM 0 HG3 ARG B 29 13.708 -19.074 21.365 1.00 0.00 H new ATOM 0 HD2 ARG B 29 14.480 -20.005 19.407 1.00 0.00 H new ATOM 0 HD3 ARG B 29 15.969 -19.087 19.509 1.00 0.00 H new ATOM 0 HE ARG B 29 15.864 -21.312 21.485 1.00 0.00 H new ATOM 0 HH11 ARG B 29 16.599 -20.287 18.221 1.00 0.00 H new ATOM 0 HH12 ARG B 29 17.728 -21.613 17.929 1.00 0.00 H new ATOM 0 HH21 ARG B 29 17.304 -23.010 21.102 1.00 0.00 H new ATOM 0 HH22 ARG B 29 18.124 -23.139 19.542 1.00 0.00 H new TER 1448 ARG B 29