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 68 TYR OH : rot 180:sc= -0.887 USER MOD Set 1.2: B 22 GLN : amide:sc= 0 X(o=-0.89,f=-0.89) USER MOD Set 2.1: A 4 THR OG1 : rot 180:sc= -0.135 USER MOD Set 2.2: A 9 GLN : amide:sc= -0.109 K(o=-0.24,f=-2.8!) USER MOD Single : A 1 MET CE :methyl -140:sc=-0.000247 (180deg=-0.0394) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot -101:sc= 0.123 USER MOD Single : A 13 SER OG : rot 103:sc= 0.865 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 TYR OH : rot 180:sc= -0.747 USER MOD Single : A 37 GLN : amide:sc= -3.28 K(o=-3.3,f=-6.2!) USER MOD Single : A 39 GLN : amide:sc= -0.268 K(o=-0.27,f=-2.4!) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 CYS SG : rot 92:sc= -0.121 USER MOD Single : A 43 LYS NZ :NH3+ -122:sc= 0 (180deg=-0.19) USER MOD Single : A 45 MET CE :methyl -131:sc= -5.59! (180deg=-14.2!) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 165:sc= -0.0739 USER MOD Single : A 60 TYR OH : rot -15:sc= 0 USER MOD Single : A 64 SER OG : rot -140:sc= 0.0502 USER MOD Single : A 65 SER OG : rot -18:sc= -0.619 USER MOD Single : A 71 SER OG : rot 180:sc= 0 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 82:sc= 0.424 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -9.017 -13.300 -1.461 1.00 0.00 N ATOM 2 CA MET A 1 -8.068 -13.466 -2.599 1.00 0.00 C ATOM 3 C MET A 1 -6.630 -13.248 -2.123 1.00 0.00 C ATOM 4 O MET A 1 -5.802 -14.136 -2.193 1.00 0.00 O ATOM 5 CB MET A 1 -8.468 -12.389 -3.608 1.00 0.00 C ATOM 6 CG MET A 1 -7.906 -12.747 -4.985 1.00 0.00 C ATOM 7 SD MET A 1 -8.701 -14.257 -5.587 1.00 0.00 S ATOM 8 CE MET A 1 -10.173 -13.474 -6.289 1.00 0.00 C ATOM 0 H1 MET A 1 -9.990 -13.450 -1.796 1.00 0.00 H new ATOM 0 H2 MET A 1 -8.795 -13.995 -0.720 1.00 0.00 H new ATOM 0 H3 MET A 1 -8.929 -12.339 -1.073 1.00 0.00 H new ATOM 0 HA MET A 1 -8.111 -14.466 -3.031 1.00 0.00 H new ATOM 0 HB2 MET A 1 -9.554 -12.306 -3.657 1.00 0.00 H new ATOM 0 HB3 MET A 1 -8.088 -11.418 -3.290 1.00 0.00 H new ATOM 0 HG2 MET A 1 -8.079 -11.929 -5.684 1.00 0.00 H new ATOM 0 HG3 MET A 1 -6.827 -12.891 -4.923 1.00 0.00 H new ATOM 0 HE1 MET A 1 -11.048 -14.088 -6.077 1.00 0.00 H new ATOM 0 HE2 MET A 1 -10.306 -12.487 -5.846 1.00 0.00 H new ATOM 0 HE3 MET A 1 -10.053 -13.374 -7.368 1.00 0.00 H new ATOM 18 N ALA A 2 -6.324 -12.075 -1.642 1.00 0.00 N ATOM 19 CA ALA A 2 -4.938 -11.803 -1.164 1.00 0.00 C ATOM 20 C ALA A 2 -4.870 -10.428 -0.494 1.00 0.00 C ATOM 21 O ALA A 2 -5.269 -9.431 -1.060 1.00 0.00 O ATOM 22 CB ALA A 2 -4.072 -11.831 -2.423 1.00 0.00 C ATOM 0 H ALA A 2 -6.973 -11.293 -1.559 1.00 0.00 H new ATOM 0 HA ALA A 2 -4.605 -12.532 -0.425 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -3.033 -11.639 -2.154 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -4.149 -12.810 -2.896 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -4.415 -11.064 -3.118 1.00 0.00 H new ATOM 28 N ASP A 3 -4.365 -10.368 0.709 1.00 0.00 N ATOM 29 CA ASP A 3 -4.272 -9.058 1.414 1.00 0.00 C ATOM 30 C ASP A 3 -2.951 -8.963 2.183 1.00 0.00 C ATOM 31 O ASP A 3 -2.172 -9.894 2.214 1.00 0.00 O ATOM 32 CB ASP A 3 -5.458 -9.044 2.378 1.00 0.00 C ATOM 33 CG ASP A 3 -6.457 -7.971 1.943 1.00 0.00 C ATOM 34 OD1 ASP A 3 -7.094 -8.162 0.920 1.00 0.00 O ATOM 35 OD2 ASP A 3 -6.570 -6.976 2.641 1.00 0.00 O ATOM 0 H ASP A 3 -4.013 -11.169 1.233 1.00 0.00 H new ATOM 0 HA ASP A 3 -4.297 -8.214 0.725 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -5.941 -10.021 2.391 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -5.113 -8.845 3.393 1.00 0.00 H new ATOM 40 N THR A 4 -2.695 -7.843 2.803 1.00 0.00 N ATOM 41 CA THR A 4 -1.425 -7.690 3.570 1.00 0.00 C ATOM 42 C THR A 4 -1.566 -8.321 4.958 1.00 0.00 C ATOM 43 O THR A 4 -2.599 -8.859 5.303 1.00 0.00 O ATOM 44 CB THR A 4 -1.212 -6.180 3.688 1.00 0.00 C ATOM 45 OG1 THR A 4 0.050 -5.929 4.291 1.00 0.00 O ATOM 46 CG2 THR A 4 -2.321 -5.573 4.547 1.00 0.00 C ATOM 0 H THR A 4 -3.309 -7.029 2.812 1.00 0.00 H new ATOM 0 HA THR A 4 -0.585 -8.183 3.080 1.00 0.00 H new ATOM 0 HB THR A 4 -1.237 -5.729 2.696 1.00 0.00 H new ATOM 0 HG1 THR A 4 0.190 -4.962 4.367 1.00 0.00 H new ATOM 0 HG21 THR A 4 -2.169 -4.497 4.631 1.00 0.00 H new ATOM 0 HG22 THR A 4 -3.288 -5.768 4.083 1.00 0.00 H new ATOM 0 HG23 THR A 4 -2.298 -6.021 5.540 1.00 0.00 H new ATOM 54 N ASP A 5 -0.536 -8.259 5.756 1.00 0.00 N ATOM 55 CA ASP A 5 -0.615 -8.856 7.121 1.00 0.00 C ATOM 56 C ASP A 5 0.734 -8.735 7.835 1.00 0.00 C ATOM 57 O ASP A 5 1.730 -8.372 7.243 1.00 0.00 O ATOM 58 CB ASP A 5 -0.969 -10.325 6.888 1.00 0.00 C ATOM 59 CG ASP A 5 -2.296 -10.647 7.579 1.00 0.00 C ATOM 60 OD1 ASP A 5 -3.329 -10.354 6.999 1.00 0.00 O ATOM 61 OD2 ASP A 5 -2.256 -11.181 8.676 1.00 0.00 O ATOM 0 H ASP A 5 0.356 -7.822 5.524 1.00 0.00 H new ATOM 0 HA ASP A 5 -1.350 -8.352 7.749 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -1.045 -10.527 5.819 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -0.179 -10.967 7.278 1.00 0.00 H new ATOM 66 N THR A 6 0.770 -9.037 9.104 1.00 0.00 N ATOM 67 CA THR A 6 2.052 -8.940 9.859 1.00 0.00 C ATOM 68 C THR A 6 3.151 -9.732 9.142 1.00 0.00 C ATOM 69 O THR A 6 4.232 -9.233 8.899 1.00 0.00 O ATOM 70 CB THR A 6 1.753 -9.555 11.226 1.00 0.00 C ATOM 71 OG1 THR A 6 0.702 -10.503 11.096 1.00 0.00 O ATOM 72 CG2 THR A 6 1.332 -8.455 12.202 1.00 0.00 C ATOM 0 H THR A 6 -0.033 -9.347 9.651 1.00 0.00 H new ATOM 0 HA THR A 6 2.405 -7.912 9.942 1.00 0.00 H new ATOM 0 HB THR A 6 2.647 -10.051 11.605 1.00 0.00 H new ATOM 0 HG1 THR A 6 -0.139 -10.103 11.401 1.00 0.00 H new ATOM 0 HG21 THR A 6 1.119 -8.895 13.176 1.00 0.00 H new ATOM 0 HG22 THR A 6 2.138 -7.728 12.301 1.00 0.00 H new ATOM 0 HG23 THR A 6 0.438 -7.957 11.826 1.00 0.00 H new ATOM 80 N ALA A 7 2.880 -10.962 8.800 1.00 0.00 N ATOM 81 CA ALA A 7 3.907 -11.784 8.097 1.00 0.00 C ATOM 82 C ALA A 7 4.195 -11.188 6.718 1.00 0.00 C ATOM 83 O ALA A 7 5.334 -11.014 6.331 1.00 0.00 O ATOM 84 CB ALA A 7 3.280 -13.173 7.966 1.00 0.00 C ATOM 0 H ALA A 7 1.993 -11.433 8.977 1.00 0.00 H new ATOM 0 HA ALA A 7 4.855 -11.818 8.634 1.00 0.00 H new ATOM 0 HB1 ALA A 7 3.976 -13.840 7.457 1.00 0.00 H new ATOM 0 HB2 ALA A 7 3.059 -13.567 8.958 1.00 0.00 H new ATOM 0 HB3 ALA A 7 2.358 -13.103 7.390 1.00 0.00 H new ATOM 90 N GLU A 8 3.170 -10.868 5.978 1.00 0.00 N ATOM 91 CA GLU A 8 3.380 -10.276 4.628 1.00 0.00 C ATOM 92 C GLU A 8 4.275 -9.039 4.737 1.00 0.00 C ATOM 93 O GLU A 8 5.090 -8.772 3.875 1.00 0.00 O ATOM 94 CB GLU A 8 1.982 -9.891 4.143 1.00 0.00 C ATOM 95 CG GLU A 8 1.787 -10.378 2.707 1.00 0.00 C ATOM 96 CD GLU A 8 1.672 -11.904 2.698 1.00 0.00 C ATOM 97 OE1 GLU A 8 1.512 -12.473 3.765 1.00 0.00 O ATOM 98 OE2 GLU A 8 1.746 -12.477 1.623 1.00 0.00 O ATOM 0 H GLU A 8 2.195 -10.991 6.251 1.00 0.00 H new ATOM 0 HA GLU A 8 3.870 -10.965 3.940 1.00 0.00 H new ATOM 0 HB2 GLU A 8 1.226 -10.331 4.793 1.00 0.00 H new ATOM 0 HB3 GLU A 8 1.854 -8.810 4.192 1.00 0.00 H new ATOM 0 HG2 GLU A 8 0.889 -9.932 2.279 1.00 0.00 H new ATOM 0 HG3 GLU A 8 2.626 -10.062 2.087 1.00 0.00 H new ATOM 105 N GLN A 9 4.128 -8.282 5.789 1.00 0.00 N ATOM 106 CA GLN A 9 4.970 -7.062 5.954 1.00 0.00 C ATOM 107 C GLN A 9 6.450 -7.449 6.033 1.00 0.00 C ATOM 108 O GLN A 9 7.288 -6.876 5.364 1.00 0.00 O ATOM 109 CB GLN A 9 4.507 -6.435 7.269 1.00 0.00 C ATOM 110 CG GLN A 9 4.639 -4.914 7.185 1.00 0.00 C ATOM 111 CD GLN A 9 3.383 -4.325 6.540 1.00 0.00 C ATOM 112 OE1 GLN A 9 2.442 -5.039 6.253 1.00 0.00 O ATOM 113 NE2 GLN A 9 3.328 -3.045 6.297 1.00 0.00 N ATOM 0 H GLN A 9 3.462 -8.455 6.542 1.00 0.00 H new ATOM 0 HA GLN A 9 4.867 -6.372 5.117 1.00 0.00 H new ATOM 0 HB2 GLN A 9 3.472 -6.710 7.470 1.00 0.00 H new ATOM 0 HB3 GLN A 9 5.105 -6.817 8.096 1.00 0.00 H new ATOM 0 HG2 GLN A 9 4.779 -4.495 8.182 1.00 0.00 H new ATOM 0 HG3 GLN A 9 5.520 -4.647 6.601 1.00 0.00 H new ATOM 0 HE21 GLN A 9 4.118 -2.446 6.538 1.00 0.00 H new ATOM 0 HE22 GLN A 9 2.495 -2.643 5.866 1.00 0.00 H new ATOM 122 N VAL A 10 6.780 -8.419 6.843 1.00 0.00 N ATOM 123 CA VAL A 10 8.208 -8.839 6.955 1.00 0.00 C ATOM 124 C VAL A 10 8.689 -9.410 5.620 1.00 0.00 C ATOM 125 O VAL A 10 9.775 -9.116 5.162 1.00 0.00 O ATOM 126 CB VAL A 10 8.221 -9.920 8.037 1.00 0.00 C ATOM 127 CG1 VAL A 10 9.666 -10.223 8.436 1.00 0.00 C ATOM 128 CG2 VAL A 10 7.447 -9.424 9.261 1.00 0.00 C ATOM 0 H VAL A 10 6.126 -8.937 7.430 1.00 0.00 H new ATOM 0 HA VAL A 10 8.867 -8.008 7.205 1.00 0.00 H new ATOM 0 HB VAL A 10 7.752 -10.826 7.653 1.00 0.00 H new ATOM 0 HG11 VAL A 10 9.677 -10.993 9.207 1.00 0.00 H new ATOM 0 HG12 VAL A 10 10.218 -10.574 7.564 1.00 0.00 H new ATOM 0 HG13 VAL A 10 10.135 -9.317 8.821 1.00 0.00 H new ATOM 0 HG21 VAL A 10 7.455 -10.193 10.033 1.00 0.00 H new ATOM 0 HG22 VAL A 10 7.916 -8.519 9.646 1.00 0.00 H new ATOM 0 HG23 VAL A 10 6.417 -9.206 8.977 1.00 0.00 H new ATOM 138 N ILE A 11 7.883 -10.218 4.987 1.00 0.00 N ATOM 139 CA ILE A 11 8.285 -10.801 3.678 1.00 0.00 C ATOM 140 C ILE A 11 8.491 -9.682 2.660 1.00 0.00 C ATOM 141 O ILE A 11 9.491 -9.629 1.973 1.00 0.00 O ATOM 142 CB ILE A 11 7.116 -11.695 3.266 1.00 0.00 C ATOM 143 CG1 ILE A 11 7.082 -12.936 4.161 1.00 0.00 C ATOM 144 CG2 ILE A 11 7.290 -12.123 1.808 1.00 0.00 C ATOM 145 CD1 ILE A 11 5.655 -13.484 4.223 1.00 0.00 C ATOM 0 H ILE A 11 6.962 -10.499 5.322 1.00 0.00 H new ATOM 0 HA ILE A 11 9.218 -11.361 3.737 1.00 0.00 H new ATOM 0 HB ILE A 11 6.182 -11.144 3.374 1.00 0.00 H new ATOM 0 HG12 ILE A 11 7.758 -13.697 3.771 1.00 0.00 H new ATOM 0 HG13 ILE A 11 7.430 -12.684 5.163 1.00 0.00 H new ATOM 0 HG21 ILE A 11 6.456 -12.761 1.514 1.00 0.00 H new ATOM 0 HG22 ILE A 11 7.314 -11.240 1.170 1.00 0.00 H new ATOM 0 HG23 ILE A 11 8.224 -12.674 1.700 1.00 0.00 H new ATOM 0 HD11 ILE A 11 5.632 -14.368 4.861 1.00 0.00 H new ATOM 0 HD12 ILE A 11 4.991 -12.723 4.633 1.00 0.00 H new ATOM 0 HD13 ILE A 11 5.324 -13.752 3.220 1.00 0.00 H new ATOM 157 N ALA A 12 7.555 -8.775 2.565 1.00 0.00 N ATOM 158 CA ALA A 12 7.711 -7.652 1.601 1.00 0.00 C ATOM 159 C ALA A 12 9.003 -6.901 1.917 1.00 0.00 C ATOM 160 O ALA A 12 9.748 -6.522 1.036 1.00 0.00 O ATOM 161 CB ALA A 12 6.493 -6.756 1.828 1.00 0.00 C ATOM 0 H ALA A 12 6.694 -8.765 3.111 1.00 0.00 H new ATOM 0 HA ALA A 12 7.768 -7.986 0.565 1.00 0.00 H new ATOM 0 HB1 ALA A 12 6.537 -5.903 1.151 1.00 0.00 H new ATOM 0 HB2 ALA A 12 5.583 -7.324 1.637 1.00 0.00 H new ATOM 0 HB3 ALA A 12 6.489 -6.401 2.859 1.00 0.00 H new ATOM 167 N SER A 13 9.281 -6.701 3.176 1.00 0.00 N ATOM 168 CA SER A 13 10.532 -5.993 3.560 1.00 0.00 C ATOM 169 C SER A 13 11.738 -6.870 3.215 1.00 0.00 C ATOM 170 O SER A 13 12.755 -6.392 2.755 1.00 0.00 O ATOM 171 CB SER A 13 10.429 -5.789 5.070 1.00 0.00 C ATOM 172 OG SER A 13 9.113 -5.362 5.396 1.00 0.00 O ATOM 0 H SER A 13 8.694 -6.998 3.956 1.00 0.00 H new ATOM 0 HA SER A 13 10.657 -5.045 3.037 1.00 0.00 H new ATOM 0 HB2 SER A 13 10.662 -6.718 5.591 1.00 0.00 H new ATOM 0 HB3 SER A 13 11.157 -5.047 5.399 1.00 0.00 H new ATOM 0 HG SER A 13 8.610 -6.113 5.775 1.00 0.00 H new ATOM 178 N PHE A 14 11.625 -8.155 3.427 1.00 0.00 N ATOM 179 CA PHE A 14 12.761 -9.063 3.100 1.00 0.00 C ATOM 180 C PHE A 14 12.951 -9.127 1.583 1.00 0.00 C ATOM 181 O PHE A 14 14.055 -9.035 1.082 1.00 0.00 O ATOM 182 CB PHE A 14 12.354 -10.429 3.654 1.00 0.00 C ATOM 183 CG PHE A 14 12.995 -10.635 5.006 1.00 0.00 C ATOM 184 CD1 PHE A 14 14.385 -10.762 5.112 1.00 0.00 C ATOM 185 CD2 PHE A 14 12.197 -10.698 6.155 1.00 0.00 C ATOM 186 CE1 PHE A 14 14.977 -10.952 6.367 1.00 0.00 C ATOM 187 CE2 PHE A 14 12.789 -10.888 7.410 1.00 0.00 C ATOM 188 CZ PHE A 14 14.179 -11.016 7.516 1.00 0.00 C ATOM 0 H PHE A 14 10.798 -8.613 3.811 1.00 0.00 H new ATOM 0 HA PHE A 14 13.704 -8.723 3.527 1.00 0.00 H new ATOM 0 HB2 PHE A 14 11.269 -10.490 3.741 1.00 0.00 H new ATOM 0 HB3 PHE A 14 12.663 -11.218 2.969 1.00 0.00 H new ATOM 0 HD1 PHE A 14 15.001 -10.713 4.226 1.00 0.00 H new ATOM 0 HD2 PHE A 14 11.125 -10.600 6.073 1.00 0.00 H new ATOM 0 HE1 PHE A 14 16.050 -11.049 6.449 1.00 0.00 H new ATOM 0 HE2 PHE A 14 12.173 -10.936 8.296 1.00 0.00 H new ATOM 0 HZ PHE A 14 14.636 -11.164 8.483 1.00 0.00 H new ATOM 198 N ARG A 15 11.883 -9.275 0.849 1.00 0.00 N ATOM 199 CA ARG A 15 12.002 -9.332 -0.635 1.00 0.00 C ATOM 200 C ARG A 15 12.766 -8.104 -1.135 1.00 0.00 C ATOM 201 O ARG A 15 13.600 -8.192 -2.014 1.00 0.00 O ATOM 202 CB ARG A 15 10.563 -9.320 -1.152 1.00 0.00 C ATOM 203 CG ARG A 15 10.535 -9.794 -2.606 1.00 0.00 C ATOM 204 CD ARG A 15 10.730 -11.312 -2.655 1.00 0.00 C ATOM 205 NE ARG A 15 9.405 -11.880 -2.282 1.00 0.00 N ATOM 206 CZ ARG A 15 8.433 -11.907 -3.154 1.00 0.00 C ATOM 207 NH1 ARG A 15 8.616 -11.435 -4.358 1.00 0.00 N ATOM 208 NH2 ARG A 15 7.273 -12.407 -2.822 1.00 0.00 N ATOM 0 H ARG A 15 10.934 -9.359 1.212 1.00 0.00 H new ATOM 0 HA ARG A 15 12.544 -10.213 -0.979 1.00 0.00 H new ATOM 0 HB2 ARG A 15 9.939 -9.968 -0.536 1.00 0.00 H new ATOM 0 HB3 ARG A 15 10.148 -8.315 -1.079 1.00 0.00 H new ATOM 0 HG2 ARG A 15 9.586 -9.524 -3.069 1.00 0.00 H new ATOM 0 HG3 ARG A 15 11.320 -9.298 -3.176 1.00 0.00 H new ATOM 0 HD2 ARG A 15 11.035 -11.639 -3.649 1.00 0.00 H new ATOM 0 HD3 ARG A 15 11.507 -11.633 -1.961 1.00 0.00 H new ATOM 0 HE ARG A 15 9.256 -12.249 -1.343 1.00 0.00 H new ATOM 0 HH11 ARG A 15 9.521 -11.043 -4.620 1.00 0.00 H new ATOM 0 HH12 ARG A 15 7.854 -11.458 -5.036 1.00 0.00 H new ATOM 0 HH21 ARG A 15 7.127 -12.776 -1.882 1.00 0.00 H new ATOM 0 HH22 ARG A 15 6.513 -12.428 -3.502 1.00 0.00 H new ATOM 222 N ILE A 16 12.486 -6.958 -0.575 1.00 0.00 N ATOM 223 CA ILE A 16 13.197 -5.721 -1.011 1.00 0.00 C ATOM 224 C ILE A 16 14.696 -5.854 -0.729 1.00 0.00 C ATOM 225 O ILE A 16 15.522 -5.524 -1.557 1.00 0.00 O ATOM 226 CB ILE A 16 12.589 -4.598 -0.170 1.00 0.00 C ATOM 227 CG1 ILE A 16 11.199 -4.254 -0.710 1.00 0.00 C ATOM 228 CG2 ILE A 16 13.485 -3.360 -0.246 1.00 0.00 C ATOM 229 CD1 ILE A 16 10.538 -3.223 0.207 1.00 0.00 C ATOM 0 H ILE A 16 11.797 -6.825 0.165 1.00 0.00 H new ATOM 0 HA ILE A 16 13.088 -5.532 -2.079 1.00 0.00 H new ATOM 0 HB ILE A 16 12.507 -4.924 0.867 1.00 0.00 H new ATOM 0 HG12 ILE A 16 11.278 -3.859 -1.723 1.00 0.00 H new ATOM 0 HG13 ILE A 16 10.586 -5.153 -0.766 1.00 0.00 H new ATOM 0 HG21 ILE A 16 13.051 -2.560 0.354 1.00 0.00 H new ATOM 0 HG22 ILE A 16 14.476 -3.604 0.137 1.00 0.00 H new ATOM 0 HG23 ILE A 16 13.567 -3.033 -1.283 1.00 0.00 H new ATOM 0 HD11 ILE A 16 9.548 -2.977 -0.176 1.00 0.00 H new ATOM 0 HD12 ILE A 16 10.446 -3.636 1.212 1.00 0.00 H new ATOM 0 HD13 ILE A 16 11.149 -2.321 0.240 1.00 0.00 H new ATOM 241 N LEU A 17 15.052 -6.337 0.430 1.00 0.00 N ATOM 242 CA LEU A 17 16.499 -6.493 0.757 1.00 0.00 C ATOM 243 C LEU A 17 17.134 -7.527 -0.175 1.00 0.00 C ATOM 244 O LEU A 17 18.233 -7.348 -0.662 1.00 0.00 O ATOM 245 CB LEU A 17 16.529 -6.989 2.204 1.00 0.00 C ATOM 246 CG LEU A 17 15.988 -5.900 3.130 1.00 0.00 C ATOM 247 CD1 LEU A 17 16.129 -6.350 4.585 1.00 0.00 C ATOM 248 CD2 LEU A 17 16.785 -4.610 2.919 1.00 0.00 C ATOM 0 H LEU A 17 14.406 -6.630 1.163 1.00 0.00 H new ATOM 0 HA LEU A 17 17.055 -5.563 0.635 1.00 0.00 H new ATOM 0 HB2 LEU A 17 15.930 -7.894 2.301 1.00 0.00 H new ATOM 0 HB3 LEU A 17 17.548 -7.249 2.489 1.00 0.00 H new ATOM 0 HG LEU A 17 14.937 -5.722 2.904 1.00 0.00 H new ATOM 0 HD11 LEU A 17 15.743 -5.573 5.245 1.00 0.00 H new ATOM 0 HD12 LEU A 17 15.564 -7.270 4.738 1.00 0.00 H new ATOM 0 HD13 LEU A 17 17.180 -6.528 4.810 1.00 0.00 H new ATOM 0 HD21 LEU A 17 16.400 -3.832 3.579 1.00 0.00 H new ATOM 0 HD22 LEU A 17 17.836 -4.790 3.145 1.00 0.00 H new ATOM 0 HD23 LEU A 17 16.687 -4.287 1.882 1.00 0.00 H new ATOM 260 N ALA A 18 16.447 -8.607 -0.430 1.00 0.00 N ATOM 261 CA ALA A 18 17.008 -9.652 -1.333 1.00 0.00 C ATOM 262 C ALA A 18 17.093 -9.119 -2.766 1.00 0.00 C ATOM 263 O ALA A 18 17.652 -9.750 -3.642 1.00 0.00 O ATOM 264 CB ALA A 18 16.021 -10.818 -1.252 1.00 0.00 C ATOM 0 H ALA A 18 15.522 -8.811 -0.052 1.00 0.00 H new ATOM 0 HA ALA A 18 18.015 -9.951 -1.044 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.365 -11.631 -1.892 1.00 0.00 H new ATOM 0 HB2 ALA A 18 15.957 -11.169 -0.222 1.00 0.00 H new ATOM 0 HB3 ALA A 18 15.037 -10.486 -1.584 1.00 0.00 H new ATOM 270 N SER A 19 16.543 -7.960 -3.011 1.00 0.00 N ATOM 271 CA SER A 19 16.590 -7.385 -4.386 1.00 0.00 C ATOM 272 C SER A 19 15.845 -8.293 -5.367 1.00 0.00 C ATOM 273 O SER A 19 16.436 -8.916 -6.226 1.00 0.00 O ATOM 274 CB SER A 19 18.076 -7.320 -4.738 1.00 0.00 C ATOM 275 OG SER A 19 18.286 -6.290 -5.696 1.00 0.00 O ATOM 0 H SER A 19 16.063 -7.386 -2.318 1.00 0.00 H new ATOM 0 HA SER A 19 16.115 -6.405 -4.439 1.00 0.00 H new ATOM 0 HB2 SER A 19 18.666 -7.125 -3.842 1.00 0.00 H new ATOM 0 HB3 SER A 19 18.409 -8.278 -5.137 1.00 0.00 H new ATOM 0 HG SER A 19 19.238 -6.244 -5.923 1.00 0.00 H new ATOM 281 N ASP A 20 14.548 -8.373 -5.244 1.00 0.00 N ATOM 282 CA ASP A 20 13.763 -9.240 -6.170 1.00 0.00 C ATOM 283 C ASP A 20 14.252 -10.688 -6.080 1.00 0.00 C ATOM 284 O ASP A 20 14.593 -11.302 -7.072 1.00 0.00 O ATOM 285 CB ASP A 20 14.025 -8.671 -7.564 1.00 0.00 C ATOM 286 CG ASP A 20 12.698 -8.506 -8.307 1.00 0.00 C ATOM 287 OD1 ASP A 20 11.854 -9.378 -8.173 1.00 0.00 O ATOM 288 OD2 ASP A 20 12.547 -7.512 -8.998 1.00 0.00 O ATOM 0 H ASP A 20 13.998 -7.876 -4.543 1.00 0.00 H new ATOM 0 HA ASP A 20 12.700 -9.248 -5.927 1.00 0.00 H new ATOM 0 HB2 ASP A 20 14.532 -7.709 -7.486 1.00 0.00 H new ATOM 0 HB3 ASP A 20 14.685 -9.335 -8.121 1.00 0.00 H new ATOM 293 N LYS A 21 14.290 -11.239 -4.897 1.00 0.00 N ATOM 294 CA LYS A 21 14.756 -12.645 -4.743 1.00 0.00 C ATOM 295 C LYS A 21 13.922 -13.361 -3.680 1.00 0.00 C ATOM 296 O LYS A 21 13.545 -12.773 -2.686 1.00 0.00 O ATOM 297 CB LYS A 21 16.214 -12.533 -4.293 1.00 0.00 C ATOM 298 CG LYS A 21 17.096 -12.191 -5.496 1.00 0.00 C ATOM 299 CD LYS A 21 18.518 -12.696 -5.247 1.00 0.00 C ATOM 300 CE LYS A 21 19.452 -11.505 -5.017 1.00 0.00 C ATOM 301 NZ LYS A 21 20.825 -12.083 -5.043 1.00 0.00 N ATOM 0 H LYS A 21 14.018 -10.775 -4.030 1.00 0.00 H new ATOM 0 HA LYS A 21 14.657 -13.217 -5.666 1.00 0.00 H new ATOM 0 HB2 LYS A 21 16.311 -11.763 -3.527 1.00 0.00 H new ATOM 0 HB3 LYS A 21 16.540 -13.471 -3.845 1.00 0.00 H new ATOM 0 HG2 LYS A 21 16.690 -12.647 -6.399 1.00 0.00 H new ATOM 0 HG3 LYS A 21 17.105 -11.113 -5.659 1.00 0.00 H new ATOM 0 HD2 LYS A 21 18.534 -13.356 -4.380 1.00 0.00 H new ATOM 0 HD3 LYS A 21 18.862 -13.281 -6.100 1.00 0.00 H new ATOM 0 HE2 LYS A 21 19.327 -10.749 -5.793 1.00 0.00 H new ATOM 0 HE3 LYS A 21 19.246 -11.020 -4.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 21.523 -11.327 -4.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 20.917 -12.794 -4.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 20.995 -12.532 -5.965 1.00 0.00 H new ATOM 315 N PRO A 22 13.668 -14.616 -3.927 1.00 0.00 N ATOM 316 CA PRO A 22 12.869 -15.396 -2.946 1.00 0.00 C ATOM 317 C PRO A 22 13.751 -15.811 -1.766 1.00 0.00 C ATOM 318 O PRO A 22 13.331 -16.541 -0.889 1.00 0.00 O ATOM 319 CB PRO A 22 12.390 -16.623 -3.722 1.00 0.00 C ATOM 320 CG PRO A 22 13.230 -16.672 -4.957 1.00 0.00 C ATOM 321 CD PRO A 22 13.681 -15.267 -5.240 1.00 0.00 C ATOM 0 HA PRO A 22 12.037 -14.825 -2.534 1.00 0.00 H new ATOM 0 HB2 PRO A 22 12.509 -17.531 -3.131 1.00 0.00 H new ATOM 0 HB3 PRO A 22 11.332 -16.541 -3.971 1.00 0.00 H new ATOM 0 HG2 PRO A 22 14.087 -17.330 -4.814 1.00 0.00 H new ATOM 0 HG3 PRO A 22 12.659 -17.070 -5.796 1.00 0.00 H new ATOM 0 HD2 PRO A 22 14.676 -15.250 -5.684 1.00 0.00 H new ATOM 0 HD3 PRO A 22 13.011 -14.767 -5.940 1.00 0.00 H new ATOM 329 N TYR A 23 14.973 -15.351 -1.738 1.00 0.00 N ATOM 330 CA TYR A 23 15.884 -15.715 -0.616 1.00 0.00 C ATOM 331 C TYR A 23 16.807 -14.539 -0.290 1.00 0.00 C ATOM 332 O TYR A 23 17.008 -13.654 -1.098 1.00 0.00 O ATOM 333 CB TYR A 23 16.695 -16.904 -1.132 1.00 0.00 C ATOM 334 CG TYR A 23 17.320 -16.547 -2.459 1.00 0.00 C ATOM 335 CD1 TYR A 23 16.577 -16.672 -3.639 1.00 0.00 C ATOM 336 CD2 TYR A 23 18.642 -16.088 -2.511 1.00 0.00 C ATOM 337 CE1 TYR A 23 17.155 -16.340 -4.870 1.00 0.00 C ATOM 338 CE2 TYR A 23 19.220 -15.755 -3.741 1.00 0.00 C ATOM 339 CZ TYR A 23 18.476 -15.881 -4.920 1.00 0.00 C ATOM 340 OH TYR A 23 19.046 -15.554 -6.134 1.00 0.00 O ATOM 0 H TYR A 23 15.380 -14.738 -2.445 1.00 0.00 H new ATOM 0 HA TYR A 23 15.341 -15.960 0.297 1.00 0.00 H new ATOM 0 HB2 TYR A 23 17.470 -17.170 -0.413 1.00 0.00 H new ATOM 0 HB3 TYR A 23 16.051 -17.776 -1.244 1.00 0.00 H new ATOM 0 HD1 TYR A 23 15.557 -17.025 -3.600 1.00 0.00 H new ATOM 0 HD2 TYR A 23 19.216 -15.991 -1.601 1.00 0.00 H new ATOM 0 HE1 TYR A 23 16.582 -16.438 -5.780 1.00 0.00 H new ATOM 0 HE2 TYR A 23 20.240 -15.401 -3.781 1.00 0.00 H new ATOM 0 HH TYR A 23 19.967 -15.252 -5.992 1.00 0.00 H new ATOM 350 N ILE A 24 17.372 -14.521 0.884 1.00 0.00 N ATOM 351 CA ILE A 24 18.283 -13.401 1.251 1.00 0.00 C ATOM 352 C ILE A 24 19.629 -13.959 1.730 1.00 0.00 C ATOM 353 O ILE A 24 19.691 -14.981 2.383 1.00 0.00 O ATOM 354 CB ILE A 24 17.534 -12.634 2.358 1.00 0.00 C ATOM 355 CG1 ILE A 24 17.624 -11.131 2.079 1.00 0.00 C ATOM 356 CG2 ILE A 24 18.131 -12.930 3.740 1.00 0.00 C ATOM 357 CD1 ILE A 24 19.080 -10.747 1.812 1.00 0.00 C ATOM 0 H ILE A 24 17.243 -15.232 1.604 1.00 0.00 H new ATOM 0 HA ILE A 24 18.518 -12.742 0.415 1.00 0.00 H new ATOM 0 HB ILE A 24 16.493 -12.958 2.358 1.00 0.00 H new ATOM 0 HG12 ILE A 24 17.005 -10.872 1.220 1.00 0.00 H new ATOM 0 HG13 ILE A 24 17.239 -10.569 2.930 1.00 0.00 H new ATOM 0 HG21 ILE A 24 17.582 -12.375 4.500 1.00 0.00 H new ATOM 0 HG22 ILE A 24 18.058 -13.998 3.947 1.00 0.00 H new ATOM 0 HG23 ILE A 24 19.178 -12.628 3.756 1.00 0.00 H new ATOM 0 HD11 ILE A 24 19.144 -9.677 1.613 1.00 0.00 H new ATOM 0 HD12 ILE A 24 19.686 -10.991 2.684 1.00 0.00 H new ATOM 0 HD13 ILE A 24 19.449 -11.299 0.948 1.00 0.00 H new ATOM 369 N LEU A 25 20.703 -13.297 1.406 1.00 0.00 N ATOM 370 CA LEU A 25 22.042 -13.791 1.837 1.00 0.00 C ATOM 371 C LEU A 25 22.531 -13.010 3.058 1.00 0.00 C ATOM 372 O LEU A 25 22.200 -11.855 3.242 1.00 0.00 O ATOM 373 CB LEU A 25 22.960 -13.541 0.641 1.00 0.00 C ATOM 374 CG LEU A 25 23.481 -14.877 0.106 1.00 0.00 C ATOM 375 CD1 LEU A 25 22.833 -15.174 -1.247 1.00 0.00 C ATOM 376 CD2 LEU A 25 25.000 -14.797 -0.064 1.00 0.00 C ATOM 0 H LEU A 25 20.713 -12.435 0.861 1.00 0.00 H new ATOM 0 HA LEU A 25 22.019 -14.843 2.123 1.00 0.00 H new ATOM 0 HB2 LEU A 25 22.418 -13.011 -0.142 1.00 0.00 H new ATOM 0 HB3 LEU A 25 23.795 -12.906 0.937 1.00 0.00 H new ATOM 0 HG LEU A 25 23.233 -15.672 0.809 1.00 0.00 H new ATOM 0 HD11 LEU A 25 23.205 -16.126 -1.627 1.00 0.00 H new ATOM 0 HD12 LEU A 25 21.751 -15.228 -1.128 1.00 0.00 H new ATOM 0 HD13 LEU A 25 23.081 -14.380 -1.951 1.00 0.00 H new ATOM 0 HD21 LEU A 25 25.374 -15.747 -0.445 1.00 0.00 H new ATOM 0 HD22 LEU A 25 25.246 -14.002 -0.768 1.00 0.00 H new ATOM 0 HD23 LEU A 25 25.463 -14.585 0.900 1.00 0.00 H new ATOM 388 N ALA A 26 23.320 -13.629 3.891 1.00 0.00 N ATOM 389 CA ALA A 26 23.832 -12.919 5.097 1.00 0.00 C ATOM 390 C ALA A 26 24.577 -11.651 4.673 1.00 0.00 C ATOM 391 O ALA A 26 24.561 -10.650 5.362 1.00 0.00 O ATOM 392 CB ALA A 26 24.787 -13.905 5.766 1.00 0.00 C ATOM 0 H ALA A 26 23.632 -14.595 3.790 1.00 0.00 H new ATOM 0 HA ALA A 26 23.032 -12.613 5.772 1.00 0.00 H new ATOM 0 HB1 ALA A 26 25.206 -13.453 6.665 1.00 0.00 H new ATOM 0 HB2 ALA A 26 24.245 -14.811 6.035 1.00 0.00 H new ATOM 0 HB3 ALA A 26 25.593 -14.156 5.076 1.00 0.00 H new ATOM 398 N GLU A 27 25.224 -11.685 3.541 1.00 0.00 N ATOM 399 CA GLU A 27 25.963 -10.482 3.069 1.00 0.00 C ATOM 400 C GLU A 27 24.984 -9.324 2.863 1.00 0.00 C ATOM 401 O GLU A 27 25.273 -8.189 3.187 1.00 0.00 O ATOM 402 CB GLU A 27 26.585 -10.905 1.739 1.00 0.00 C ATOM 403 CG GLU A 27 27.914 -11.618 1.997 1.00 0.00 C ATOM 404 CD GLU A 27 28.371 -12.326 0.721 1.00 0.00 C ATOM 405 OE1 GLU A 27 28.757 -11.637 -0.210 1.00 0.00 O ATOM 406 OE2 GLU A 27 28.328 -13.544 0.693 1.00 0.00 O ATOM 0 H GLU A 27 25.273 -12.495 2.923 1.00 0.00 H new ATOM 0 HA GLU A 27 26.716 -10.143 3.780 1.00 0.00 H new ATOM 0 HB2 GLU A 27 25.905 -11.566 1.202 1.00 0.00 H new ATOM 0 HB3 GLU A 27 26.746 -10.031 1.107 1.00 0.00 H new ATOM 0 HG2 GLU A 27 28.668 -10.899 2.316 1.00 0.00 H new ATOM 0 HG3 GLU A 27 27.800 -12.340 2.805 1.00 0.00 H new ATOM 413 N GLU A 28 23.826 -9.605 2.331 1.00 0.00 N ATOM 414 CA GLU A 28 22.824 -8.522 2.113 1.00 0.00 C ATOM 415 C GLU A 28 22.305 -8.018 3.460 1.00 0.00 C ATOM 416 O GLU A 28 22.256 -6.831 3.715 1.00 0.00 O ATOM 417 CB GLU A 28 21.699 -9.175 1.311 1.00 0.00 C ATOM 418 CG GLU A 28 21.928 -8.933 -0.182 1.00 0.00 C ATOM 419 CD GLU A 28 22.565 -10.174 -0.810 1.00 0.00 C ATOM 420 OE1 GLU A 28 23.548 -10.651 -0.265 1.00 0.00 O ATOM 421 OE2 GLU A 28 22.062 -10.626 -1.824 1.00 0.00 O ATOM 0 H GLU A 28 23.530 -10.536 2.038 1.00 0.00 H new ATOM 0 HA GLU A 28 23.245 -7.664 1.590 1.00 0.00 H new ATOM 0 HB2 GLU A 28 21.666 -10.245 1.516 1.00 0.00 H new ATOM 0 HB3 GLU A 28 20.736 -8.763 1.613 1.00 0.00 H new ATOM 0 HG2 GLU A 28 20.982 -8.709 -0.674 1.00 0.00 H new ATOM 0 HG3 GLU A 28 22.575 -8.067 -0.326 1.00 0.00 H new ATOM 428 N LEU A 29 21.922 -8.913 4.330 1.00 0.00 N ATOM 429 CA LEU A 29 21.415 -8.486 5.663 1.00 0.00 C ATOM 430 C LEU A 29 22.507 -7.717 6.409 1.00 0.00 C ATOM 431 O LEU A 29 22.236 -6.791 7.148 1.00 0.00 O ATOM 432 CB LEU A 29 21.072 -9.784 6.396 1.00 0.00 C ATOM 433 CG LEU A 29 19.621 -10.166 6.105 1.00 0.00 C ATOM 434 CD1 LEU A 29 18.682 -9.148 6.757 1.00 0.00 C ATOM 435 CD2 LEU A 29 19.392 -10.173 4.592 1.00 0.00 C ATOM 0 H LEU A 29 21.939 -9.921 4.174 1.00 0.00 H new ATOM 0 HA LEU A 29 20.550 -7.827 5.589 1.00 0.00 H new ATOM 0 HB2 LEU A 29 21.741 -10.583 6.075 1.00 0.00 H new ATOM 0 HB3 LEU A 29 21.218 -9.658 7.469 1.00 0.00 H new ATOM 0 HG LEU A 29 19.418 -11.157 6.510 1.00 0.00 H new ATOM 0 HD11 LEU A 29 17.648 -9.422 6.549 1.00 0.00 H new ATOM 0 HD12 LEU A 29 18.845 -9.140 7.835 1.00 0.00 H new ATOM 0 HD13 LEU A 29 18.883 -8.156 6.353 1.00 0.00 H new ATOM 0 HD21 LEU A 29 18.358 -10.445 4.382 1.00 0.00 H new ATOM 0 HD22 LEU A 29 19.595 -9.181 4.189 1.00 0.00 H new ATOM 0 HD23 LEU A 29 20.060 -10.898 4.126 1.00 0.00 H new ATOM 447 N ARG A 30 23.742 -8.094 6.217 1.00 0.00 N ATOM 448 CA ARG A 30 24.853 -7.383 6.910 1.00 0.00 C ATOM 449 C ARG A 30 25.003 -5.966 6.348 1.00 0.00 C ATOM 450 O ARG A 30 25.335 -5.037 7.058 1.00 0.00 O ATOM 451 CB ARG A 30 26.103 -8.213 6.612 1.00 0.00 C ATOM 452 CG ARG A 30 26.270 -9.288 7.686 1.00 0.00 C ATOM 453 CD ARG A 30 26.978 -8.691 8.905 1.00 0.00 C ATOM 454 NE ARG A 30 28.389 -8.490 8.473 1.00 0.00 N ATOM 455 CZ ARG A 30 29.178 -9.518 8.308 1.00 0.00 C ATOM 456 NH1 ARG A 30 28.733 -10.728 8.518 1.00 0.00 N ATOM 457 NH2 ARG A 30 30.414 -9.335 7.931 1.00 0.00 N ATOM 0 H ARG A 30 24.029 -8.863 5.611 1.00 0.00 H new ATOM 0 HA ARG A 30 24.676 -7.284 7.981 1.00 0.00 H new ATOM 0 HB2 ARG A 30 26.019 -8.676 5.629 1.00 0.00 H new ATOM 0 HB3 ARG A 30 26.982 -7.569 6.587 1.00 0.00 H new ATOM 0 HG2 ARG A 30 25.296 -9.682 7.975 1.00 0.00 H new ATOM 0 HG3 ARG A 30 26.847 -10.124 7.291 1.00 0.00 H new ATOM 0 HD2 ARG A 30 26.519 -7.749 9.205 1.00 0.00 H new ATOM 0 HD3 ARG A 30 26.920 -9.361 9.762 1.00 0.00 H new ATOM 0 HE ARG A 30 28.740 -7.547 8.306 1.00 0.00 H new ATOM 0 HH11 ARG A 30 27.767 -10.872 8.812 1.00 0.00 H new ATOM 0 HH12 ARG A 30 29.352 -11.529 8.388 1.00 0.00 H new ATOM 0 HH21 ARG A 30 30.762 -8.391 7.766 1.00 0.00 H new ATOM 0 HH22 ARG A 30 31.032 -10.136 7.802 1.00 0.00 H new ATOM 471 N ARG A 31 24.765 -5.797 5.076 1.00 0.00 N ATOM 472 CA ARG A 31 24.898 -4.444 4.462 1.00 0.00 C ATOM 473 C ARG A 31 23.552 -3.712 4.475 1.00 0.00 C ATOM 474 O ARG A 31 23.485 -2.517 4.264 1.00 0.00 O ATOM 475 CB ARG A 31 25.346 -4.710 3.024 1.00 0.00 C ATOM 476 CG ARG A 31 26.712 -4.066 2.782 1.00 0.00 C ATOM 477 CD ARG A 31 26.541 -2.559 2.584 1.00 0.00 C ATOM 478 NE ARG A 31 27.740 -1.948 3.223 1.00 0.00 N ATOM 479 CZ ARG A 31 27.932 -0.658 3.163 1.00 0.00 C ATOM 480 NH1 ARG A 31 27.073 0.107 2.543 1.00 0.00 N ATOM 481 NH2 ARG A 31 28.985 -0.129 3.726 1.00 0.00 N ATOM 0 H ARG A 31 24.484 -6.538 4.434 1.00 0.00 H new ATOM 0 HA ARG A 31 25.603 -3.814 5.005 1.00 0.00 H new ATOM 0 HB2 ARG A 31 25.402 -5.783 2.843 1.00 0.00 H new ATOM 0 HB3 ARG A 31 24.614 -4.307 2.324 1.00 0.00 H new ATOM 0 HG2 ARG A 31 27.371 -4.259 3.628 1.00 0.00 H new ATOM 0 HG3 ARG A 31 27.183 -4.507 1.904 1.00 0.00 H new ATOM 0 HD2 ARG A 31 26.484 -2.304 1.526 1.00 0.00 H new ATOM 0 HD3 ARG A 31 25.621 -2.202 3.048 1.00 0.00 H new ATOM 0 HE ARG A 31 28.414 -2.540 3.709 1.00 0.00 H new ATOM 0 HH11 ARG A 31 26.249 -0.303 2.104 1.00 0.00 H new ATOM 0 HH12 ARG A 31 27.227 1.114 2.498 1.00 0.00 H new ATOM 0 HH21 ARG A 31 29.656 -0.724 4.212 1.00 0.00 H new ATOM 0 HH22 ARG A 31 29.136 0.879 3.680 1.00 0.00 H new ATOM 495 N GLU A 32 22.479 -4.415 4.714 1.00 0.00 N ATOM 496 CA GLU A 32 21.145 -3.749 4.731 1.00 0.00 C ATOM 497 C GLU A 32 20.621 -3.624 6.164 1.00 0.00 C ATOM 498 O GLU A 32 19.800 -2.779 6.462 1.00 0.00 O ATOM 499 CB GLU A 32 20.236 -4.665 3.909 1.00 0.00 C ATOM 500 CG GLU A 32 20.755 -4.748 2.473 1.00 0.00 C ATOM 501 CD GLU A 32 20.111 -3.644 1.633 1.00 0.00 C ATOM 502 OE1 GLU A 32 19.501 -2.762 2.216 1.00 0.00 O ATOM 503 OE2 GLU A 32 20.237 -3.699 0.421 1.00 0.00 O ATOM 0 H GLU A 32 22.468 -5.418 4.898 1.00 0.00 H new ATOM 0 HA GLU A 32 21.189 -2.738 4.325 1.00 0.00 H new ATOM 0 HB2 GLU A 32 20.207 -5.660 4.354 1.00 0.00 H new ATOM 0 HB3 GLU A 32 19.215 -4.283 3.916 1.00 0.00 H new ATOM 0 HG2 GLU A 32 21.840 -4.643 2.461 1.00 0.00 H new ATOM 0 HG3 GLU A 32 20.524 -5.725 2.048 1.00 0.00 H new ATOM 510 N LEU A 33 21.083 -4.458 7.055 1.00 0.00 N ATOM 511 CA LEU A 33 20.603 -4.382 8.461 1.00 0.00 C ATOM 512 C LEU A 33 21.783 -4.174 9.413 1.00 0.00 C ATOM 513 O LEU A 33 22.923 -4.375 9.043 1.00 0.00 O ATOM 514 CB LEU A 33 19.945 -5.735 8.719 1.00 0.00 C ATOM 515 CG LEU A 33 18.432 -5.610 8.536 1.00 0.00 C ATOM 516 CD1 LEU A 33 17.796 -7.001 8.573 1.00 0.00 C ATOM 517 CD2 LEU A 33 17.851 -4.756 9.665 1.00 0.00 C ATOM 0 H LEU A 33 21.771 -5.187 6.869 1.00 0.00 H new ATOM 0 HA LEU A 33 19.916 -3.551 8.621 1.00 0.00 H new ATOM 0 HB2 LEU A 33 20.344 -6.482 8.033 1.00 0.00 H new ATOM 0 HB3 LEU A 33 20.173 -6.075 9.729 1.00 0.00 H new ATOM 0 HG LEU A 33 18.221 -5.139 7.576 1.00 0.00 H new ATOM 0 HD11 LEU A 33 16.718 -6.912 8.443 1.00 0.00 H new ATOM 0 HD12 LEU A 33 18.209 -7.611 7.770 1.00 0.00 H new ATOM 0 HD13 LEU A 33 18.007 -7.472 9.533 1.00 0.00 H new ATOM 0 HD21 LEU A 33 16.772 -4.666 9.535 1.00 0.00 H new ATOM 0 HD22 LEU A 33 18.063 -5.228 10.624 1.00 0.00 H new ATOM 0 HD23 LEU A 33 18.303 -3.764 9.641 1.00 0.00 H new ATOM 529 N PRO A 34 21.464 -3.783 10.616 1.00 0.00 N ATOM 530 CA PRO A 34 22.547 -3.561 11.610 1.00 0.00 C ATOM 531 C PRO A 34 23.230 -4.891 11.943 1.00 0.00 C ATOM 532 O PRO A 34 22.592 -5.924 11.983 1.00 0.00 O ATOM 533 CB PRO A 34 21.831 -2.998 12.835 1.00 0.00 C ATOM 534 CG PRO A 34 20.530 -2.471 12.324 1.00 0.00 C ATOM 535 CD PRO A 34 20.176 -3.276 11.104 1.00 0.00 C ATOM 0 HA PRO A 34 23.325 -2.890 11.246 1.00 0.00 H new ATOM 0 HB2 PRO A 34 21.674 -3.770 13.588 1.00 0.00 H new ATOM 0 HB3 PRO A 34 22.418 -2.209 13.305 1.00 0.00 H new ATOM 0 HG2 PRO A 34 19.753 -2.560 13.083 1.00 0.00 H new ATOM 0 HG3 PRO A 34 20.613 -1.413 12.076 1.00 0.00 H new ATOM 0 HD2 PRO A 34 19.495 -4.091 11.349 1.00 0.00 H new ATOM 0 HD3 PRO A 34 19.680 -2.662 10.352 1.00 0.00 H new ATOM 543 N PRO A 35 24.512 -4.816 12.168 1.00 0.00 N ATOM 544 CA PRO A 35 25.264 -6.057 12.498 1.00 0.00 C ATOM 545 C PRO A 35 24.445 -6.943 13.442 1.00 0.00 C ATOM 546 O PRO A 35 24.353 -8.140 13.261 1.00 0.00 O ATOM 547 CB PRO A 35 26.535 -5.563 13.189 1.00 0.00 C ATOM 548 CG PRO A 35 26.243 -4.158 13.603 1.00 0.00 C ATOM 549 CD PRO A 35 25.220 -3.622 12.643 1.00 0.00 C ATOM 0 HA PRO A 35 25.481 -6.660 11.616 1.00 0.00 H new ATOM 0 HB2 PRO A 35 26.780 -6.183 14.051 1.00 0.00 H new ATOM 0 HB3 PRO A 35 27.390 -5.604 12.514 1.00 0.00 H new ATOM 0 HG2 PRO A 35 25.866 -4.127 14.625 1.00 0.00 H new ATOM 0 HG3 PRO A 35 27.149 -3.553 13.579 1.00 0.00 H new ATOM 0 HD2 PRO A 35 24.541 -2.925 13.133 1.00 0.00 H new ATOM 0 HD3 PRO A 35 25.690 -3.084 11.820 1.00 0.00 H new ATOM 557 N ASP A 36 23.855 -6.364 14.451 1.00 0.00 N ATOM 558 CA ASP A 36 23.047 -7.172 15.409 1.00 0.00 C ATOM 559 C ASP A 36 21.813 -7.759 14.717 1.00 0.00 C ATOM 560 O ASP A 36 21.407 -8.871 14.993 1.00 0.00 O ATOM 561 CB ASP A 36 22.630 -6.187 16.502 1.00 0.00 C ATOM 562 CG ASP A 36 23.670 -6.198 17.623 1.00 0.00 C ATOM 563 OD1 ASP A 36 24.847 -6.107 17.315 1.00 0.00 O ATOM 564 OD2 ASP A 36 23.272 -6.298 18.773 1.00 0.00 O ATOM 0 H ASP A 36 23.897 -5.365 14.654 1.00 0.00 H new ATOM 0 HA ASP A 36 23.611 -8.015 15.808 1.00 0.00 H new ATOM 0 HB2 ASP A 36 22.539 -5.184 16.086 1.00 0.00 H new ATOM 0 HB3 ASP A 36 21.651 -6.459 16.897 1.00 0.00 H new ATOM 569 N GLN A 37 21.206 -7.020 13.828 1.00 0.00 N ATOM 570 CA GLN A 37 19.993 -7.537 13.129 1.00 0.00 C ATOM 571 C GLN A 37 20.366 -8.677 12.177 1.00 0.00 C ATOM 572 O GLN A 37 19.714 -9.703 12.135 1.00 0.00 O ATOM 573 CB GLN A 37 19.448 -6.343 12.347 1.00 0.00 C ATOM 574 CG GLN A 37 18.254 -5.742 13.093 1.00 0.00 C ATOM 575 CD GLN A 37 18.727 -5.143 14.419 1.00 0.00 C ATOM 576 OE1 GLN A 37 19.322 -5.826 15.229 1.00 0.00 O ATOM 577 NE2 GLN A 37 18.486 -3.886 14.678 1.00 0.00 N ATOM 0 H GLN A 37 21.497 -6.081 13.555 1.00 0.00 H new ATOM 0 HA GLN A 37 19.259 -7.939 13.827 1.00 0.00 H new ATOM 0 HB2 GLN A 37 20.227 -5.591 12.222 1.00 0.00 H new ATOM 0 HB3 GLN A 37 19.145 -6.657 11.348 1.00 0.00 H new ATOM 0 HG2 GLN A 37 17.781 -4.973 12.483 1.00 0.00 H new ATOM 0 HG3 GLN A 37 17.503 -6.510 13.277 1.00 0.00 H new ATOM 0 HE21 GLN A 37 17.987 -3.312 13.999 1.00 0.00 H new ATOM 0 HE22 GLN A 37 18.797 -3.478 15.560 1.00 0.00 H new ATOM 586 N ALA A 38 21.404 -8.505 11.406 1.00 0.00 N ATOM 587 CA ALA A 38 21.812 -9.577 10.452 1.00 0.00 C ATOM 588 C ALA A 38 22.157 -10.865 11.205 1.00 0.00 C ATOM 589 O ALA A 38 21.767 -11.948 10.813 1.00 0.00 O ATOM 590 CB ALA A 38 23.047 -9.024 9.744 1.00 0.00 C ATOM 0 H ALA A 38 21.988 -7.669 11.395 1.00 0.00 H new ATOM 0 HA ALA A 38 21.015 -9.828 9.752 1.00 0.00 H new ATOM 0 HB1 ALA A 38 23.411 -9.755 9.022 1.00 0.00 H new ATOM 0 HB2 ALA A 38 22.787 -8.101 9.226 1.00 0.00 H new ATOM 0 HB3 ALA A 38 23.826 -8.820 10.478 1.00 0.00 H new ATOM 596 N GLN A 39 22.889 -10.761 12.281 1.00 0.00 N ATOM 597 CA GLN A 39 23.260 -11.984 13.050 1.00 0.00 C ATOM 598 C GLN A 39 22.015 -12.624 13.672 1.00 0.00 C ATOM 599 O GLN A 39 21.817 -13.821 13.595 1.00 0.00 O ATOM 600 CB GLN A 39 24.212 -11.493 14.141 1.00 0.00 C ATOM 601 CG GLN A 39 24.728 -12.690 14.942 1.00 0.00 C ATOM 602 CD GLN A 39 26.185 -12.967 14.565 1.00 0.00 C ATOM 603 OE1 GLN A 39 26.674 -12.465 13.573 1.00 0.00 O ATOM 604 NE2 GLN A 39 26.903 -13.750 15.323 1.00 0.00 N ATOM 0 H GLN A 39 23.246 -9.884 12.660 1.00 0.00 H new ATOM 0 HA GLN A 39 23.720 -12.742 12.417 1.00 0.00 H new ATOM 0 HB2 GLN A 39 25.047 -10.953 13.694 1.00 0.00 H new ATOM 0 HB3 GLN A 39 23.697 -10.795 14.801 1.00 0.00 H new ATOM 0 HG2 GLN A 39 24.650 -12.487 16.010 1.00 0.00 H new ATOM 0 HG3 GLN A 39 24.115 -13.568 14.739 1.00 0.00 H new ATOM 0 HE21 GLN A 39 26.491 -14.171 16.156 1.00 0.00 H new ATOM 0 HE22 GLN A 39 27.876 -13.941 15.083 1.00 0.00 H new ATOM 613 N TYR A 40 21.177 -11.838 14.290 1.00 0.00 N ATOM 614 CA TYR A 40 19.949 -12.406 14.921 1.00 0.00 C ATOM 615 C TYR A 40 19.040 -13.024 13.855 1.00 0.00 C ATOM 616 O TYR A 40 18.536 -14.119 14.016 1.00 0.00 O ATOM 617 CB TYR A 40 19.260 -11.214 15.585 1.00 0.00 C ATOM 618 CG TYR A 40 18.192 -11.711 16.531 1.00 0.00 C ATOM 619 CD1 TYR A 40 17.063 -12.370 16.028 1.00 0.00 C ATOM 620 CD2 TYR A 40 18.330 -11.511 17.909 1.00 0.00 C ATOM 621 CE1 TYR A 40 16.073 -12.830 16.905 1.00 0.00 C ATOM 622 CE2 TYR A 40 17.340 -11.971 18.786 1.00 0.00 C ATOM 623 CZ TYR A 40 16.212 -12.631 18.283 1.00 0.00 C ATOM 624 OH TYR A 40 15.236 -13.084 19.148 1.00 0.00 O ATOM 0 H TYR A 40 21.288 -10.829 14.386 1.00 0.00 H new ATOM 0 HA TYR A 40 20.181 -13.196 15.636 1.00 0.00 H new ATOM 0 HB2 TYR A 40 19.991 -10.614 16.128 1.00 0.00 H new ATOM 0 HB3 TYR A 40 18.817 -10.568 14.827 1.00 0.00 H new ATOM 0 HD1 TYR A 40 16.956 -12.523 14.964 1.00 0.00 H new ATOM 0 HD2 TYR A 40 19.200 -11.002 18.296 1.00 0.00 H new ATOM 0 HE1 TYR A 40 15.202 -13.338 16.518 1.00 0.00 H new ATOM 0 HE2 TYR A 40 17.446 -11.817 19.850 1.00 0.00 H new ATOM 0 HH TYR A 40 15.488 -12.865 20.069 1.00 0.00 H new ATOM 634 N CYS A 41 18.823 -12.332 12.771 1.00 0.00 N ATOM 635 CA CYS A 41 17.941 -12.879 11.700 1.00 0.00 C ATOM 636 C CYS A 41 18.512 -14.190 11.151 1.00 0.00 C ATOM 637 O CYS A 41 17.797 -15.153 10.953 1.00 0.00 O ATOM 638 CB CYS A 41 17.927 -11.804 10.613 1.00 0.00 C ATOM 639 SG CYS A 41 17.177 -10.293 11.269 1.00 0.00 S ATOM 0 H CYS A 41 19.218 -11.411 12.580 1.00 0.00 H new ATOM 0 HA CYS A 41 16.940 -13.103 12.068 1.00 0.00 H new ATOM 0 HB2 CYS A 41 18.943 -11.601 10.274 1.00 0.00 H new ATOM 0 HB3 CYS A 41 17.366 -12.155 9.747 1.00 0.00 H new ATOM 0 HG CYS A 41 18.104 -9.527 11.762 1.00 0.00 H new ATOM 645 N ILE A 42 19.793 -14.236 10.902 1.00 0.00 N ATOM 646 CA ILE A 42 20.403 -15.487 10.363 1.00 0.00 C ATOM 647 C ILE A 42 20.058 -16.677 11.263 1.00 0.00 C ATOM 648 O ILE A 42 20.059 -17.813 10.833 1.00 0.00 O ATOM 649 CB ILE A 42 21.911 -15.222 10.364 1.00 0.00 C ATOM 650 CG1 ILE A 42 22.274 -14.352 9.159 1.00 0.00 C ATOM 651 CG2 ILE A 42 22.668 -16.550 10.274 1.00 0.00 C ATOM 652 CD1 ILE A 42 23.633 -13.692 9.395 1.00 0.00 C ATOM 0 H ILE A 42 20.443 -13.463 11.048 1.00 0.00 H new ATOM 0 HA ILE A 42 20.035 -15.733 9.367 1.00 0.00 H new ATOM 0 HB ILE A 42 22.187 -14.709 11.285 1.00 0.00 H new ATOM 0 HG12 ILE A 42 22.306 -14.960 8.255 1.00 0.00 H new ATOM 0 HG13 ILE A 42 21.510 -13.590 9.004 1.00 0.00 H new ATOM 0 HG21 ILE A 42 23.741 -16.358 10.275 1.00 0.00 H new ATOM 0 HG22 ILE A 42 22.410 -17.174 11.130 1.00 0.00 H new ATOM 0 HG23 ILE A 42 22.392 -17.064 9.353 1.00 0.00 H new ATOM 0 HD11 ILE A 42 23.891 -13.072 8.536 1.00 0.00 H new ATOM 0 HD12 ILE A 42 23.585 -13.071 10.289 1.00 0.00 H new ATOM 0 HD13 ILE A 42 24.393 -14.462 9.528 1.00 0.00 H new ATOM 664 N LYS A 43 19.765 -16.428 12.510 1.00 0.00 N ATOM 665 CA LYS A 43 19.421 -17.549 13.432 1.00 0.00 C ATOM 666 C LYS A 43 17.958 -17.959 13.244 1.00 0.00 C ATOM 667 O LYS A 43 17.555 -19.043 13.617 1.00 0.00 O ATOM 668 CB LYS A 43 19.645 -16.991 14.838 1.00 0.00 C ATOM 669 CG LYS A 43 20.143 -18.107 15.758 1.00 0.00 C ATOM 670 CD LYS A 43 19.168 -18.282 16.925 1.00 0.00 C ATOM 671 CE LYS A 43 19.614 -19.461 17.793 1.00 0.00 C ATOM 672 NZ LYS A 43 19.137 -20.672 17.070 1.00 0.00 N ATOM 0 H LYS A 43 19.749 -15.499 12.930 1.00 0.00 H new ATOM 0 HA LYS A 43 20.026 -18.436 13.245 1.00 0.00 H new ATOM 0 HB2 LYS A 43 20.372 -16.180 14.807 1.00 0.00 H new ATOM 0 HB3 LYS A 43 18.717 -16.572 15.227 1.00 0.00 H new ATOM 0 HG2 LYS A 43 20.231 -19.040 15.201 1.00 0.00 H new ATOM 0 HG3 LYS A 43 21.137 -17.866 16.134 1.00 0.00 H new ATOM 0 HD2 LYS A 43 19.132 -17.371 17.522 1.00 0.00 H new ATOM 0 HD3 LYS A 43 18.160 -18.456 16.547 1.00 0.00 H new ATOM 0 HE2 LYS A 43 20.697 -19.475 17.914 1.00 0.00 H new ATOM 0 HE3 LYS A 43 19.182 -19.402 18.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 18.508 -21.221 17.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 18.617 -20.384 16.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 19.952 -21.257 16.798 1.00 0.00 H new ATOM 686 N ARG A 44 17.160 -17.100 12.671 1.00 0.00 N ATOM 687 CA ARG A 44 15.724 -17.443 12.462 1.00 0.00 C ATOM 688 C ARG A 44 15.524 -18.073 11.082 1.00 0.00 C ATOM 689 O ARG A 44 15.223 -19.245 10.962 1.00 0.00 O ATOM 690 CB ARG A 44 14.983 -16.107 12.556 1.00 0.00 C ATOM 691 CG ARG A 44 14.870 -15.690 14.024 1.00 0.00 C ATOM 692 CD ARG A 44 14.048 -16.729 14.790 1.00 0.00 C ATOM 693 NE ARG A 44 13.605 -16.030 16.029 1.00 0.00 N ATOM 694 CZ ARG A 44 12.803 -16.629 16.868 1.00 0.00 C ATOM 695 NH1 ARG A 44 12.399 -17.849 16.635 1.00 0.00 N ATOM 696 NH2 ARG A 44 12.406 -16.007 17.945 1.00 0.00 N ATOM 0 H ARG A 44 17.439 -16.177 12.339 1.00 0.00 H new ATOM 0 HA ARG A 44 15.360 -18.165 13.193 1.00 0.00 H new ATOM 0 HB2 ARG A 44 15.515 -15.343 11.989 1.00 0.00 H new ATOM 0 HB3 ARG A 44 13.990 -16.197 12.115 1.00 0.00 H new ATOM 0 HG2 ARG A 44 15.863 -15.600 14.465 1.00 0.00 H new ATOM 0 HG3 ARG A 44 14.398 -14.710 14.099 1.00 0.00 H new ATOM 0 HD2 ARG A 44 13.196 -17.070 14.202 1.00 0.00 H new ATOM 0 HD3 ARG A 44 14.645 -17.610 15.025 1.00 0.00 H new ATOM 0 HE ARG A 44 13.929 -15.082 16.222 1.00 0.00 H new ATOM 0 HH11 ARG A 44 12.710 -18.338 15.795 1.00 0.00 H new ATOM 0 HH12 ARG A 44 11.773 -18.313 17.293 1.00 0.00 H new ATOM 0 HH21 ARG A 44 12.722 -15.055 18.130 1.00 0.00 H new ATOM 0 HH22 ARG A 44 11.780 -16.473 18.601 1.00 0.00 H new ATOM 710 N MET A 45 15.688 -17.307 10.038 1.00 0.00 N ATOM 711 CA MET A 45 15.509 -17.864 8.669 1.00 0.00 C ATOM 712 C MET A 45 16.419 -19.080 8.466 1.00 0.00 C ATOM 713 O MET A 45 17.623 -18.945 8.379 1.00 0.00 O ATOM 714 CB MET A 45 15.916 -16.728 7.735 1.00 0.00 C ATOM 715 CG MET A 45 17.277 -16.178 8.163 1.00 0.00 C ATOM 716 SD MET A 45 17.175 -14.379 8.342 1.00 0.00 S ATOM 717 CE MET A 45 16.202 -14.059 6.851 1.00 0.00 C ATOM 0 H MET A 45 15.938 -16.319 10.075 1.00 0.00 H new ATOM 0 HA MET A 45 14.489 -18.202 8.487 1.00 0.00 H new ATOM 0 HB2 MET A 45 15.964 -17.088 6.707 1.00 0.00 H new ATOM 0 HB3 MET A 45 15.167 -15.936 7.761 1.00 0.00 H new ATOM 0 HG2 MET A 45 17.583 -16.631 9.106 1.00 0.00 H new ATOM 0 HG3 MET A 45 18.035 -16.438 7.424 1.00 0.00 H new ATOM 0 HE1 MET A 45 16.667 -13.257 6.278 1.00 0.00 H new ATOM 0 HE2 MET A 45 16.161 -14.963 6.243 1.00 0.00 H new ATOM 0 HE3 MET A 45 15.191 -13.765 7.133 1.00 0.00 H new ATOM 727 N PRO A 46 15.806 -20.229 8.400 1.00 0.00 N ATOM 728 CA PRO A 46 16.611 -21.465 8.206 1.00 0.00 C ATOM 729 C PRO A 46 17.265 -21.459 6.820 1.00 0.00 C ATOM 730 O PRO A 46 17.426 -20.424 6.204 1.00 0.00 O ATOM 731 CB PRO A 46 15.601 -22.607 8.321 1.00 0.00 C ATOM 732 CG PRO A 46 14.380 -22.004 8.936 1.00 0.00 C ATOM 733 CD PRO A 46 14.387 -20.544 8.584 1.00 0.00 C ATOM 0 HA PRO A 46 17.418 -21.556 8.933 1.00 0.00 H new ATOM 0 HB2 PRO A 46 15.378 -23.033 7.343 1.00 0.00 H new ATOM 0 HB3 PRO A 46 15.992 -23.416 8.938 1.00 0.00 H new ATOM 0 HG2 PRO A 46 13.479 -22.487 8.558 1.00 0.00 H new ATOM 0 HG3 PRO A 46 14.385 -22.140 10.017 1.00 0.00 H new ATOM 0 HD2 PRO A 46 13.814 -20.350 7.677 1.00 0.00 H new ATOM 0 HD3 PRO A 46 13.944 -19.941 9.376 1.00 0.00 H new ATOM 741 N ALA A 47 17.645 -22.606 6.328 1.00 0.00 N ATOM 742 CA ALA A 47 18.291 -22.664 4.985 1.00 0.00 C ATOM 743 C ALA A 47 17.268 -22.358 3.886 1.00 0.00 C ATOM 744 O ALA A 47 16.085 -22.588 4.045 1.00 0.00 O ATOM 745 CB ALA A 47 18.806 -24.098 4.852 1.00 0.00 C ATOM 0 H ALA A 47 17.537 -23.505 6.797 1.00 0.00 H new ATOM 0 HA ALA A 47 19.092 -21.931 4.884 1.00 0.00 H new ATOM 0 HB1 ALA A 47 19.296 -24.220 3.886 1.00 0.00 H new ATOM 0 HB2 ALA A 47 19.520 -24.304 5.650 1.00 0.00 H new ATOM 0 HB3 ALA A 47 17.970 -24.793 4.925 1.00 0.00 H new ATOM 751 N TYR A 48 17.716 -21.842 2.774 1.00 0.00 N ATOM 752 CA TYR A 48 16.771 -21.522 1.665 1.00 0.00 C ATOM 753 C TYR A 48 16.016 -22.778 1.216 1.00 0.00 C ATOM 754 O TYR A 48 16.183 -23.846 1.771 1.00 0.00 O ATOM 755 CB TYR A 48 17.648 -20.969 0.534 1.00 0.00 C ATOM 756 CG TYR A 48 18.498 -22.062 -0.089 1.00 0.00 C ATOM 757 CD1 TYR A 48 18.687 -23.291 0.562 1.00 0.00 C ATOM 758 CD2 TYR A 48 19.109 -21.832 -1.329 1.00 0.00 C ATOM 759 CE1 TYR A 48 19.480 -24.283 -0.029 1.00 0.00 C ATOM 760 CE2 TYR A 48 19.902 -22.826 -1.918 1.00 0.00 C ATOM 761 CZ TYR A 48 20.088 -24.050 -1.268 1.00 0.00 C ATOM 762 OH TYR A 48 20.869 -25.028 -1.850 1.00 0.00 O ATOM 0 H TYR A 48 18.695 -21.628 2.585 1.00 0.00 H new ATOM 0 HA TYR A 48 16.011 -20.803 1.971 1.00 0.00 H new ATOM 0 HB2 TYR A 48 17.017 -20.516 -0.230 1.00 0.00 H new ATOM 0 HB3 TYR A 48 18.293 -20.181 0.923 1.00 0.00 H new ATOM 0 HD1 TYR A 48 18.221 -23.472 1.519 1.00 0.00 H new ATOM 0 HD2 TYR A 48 18.968 -20.887 -1.832 1.00 0.00 H new ATOM 0 HE1 TYR A 48 19.622 -25.229 0.472 1.00 0.00 H new ATOM 0 HE2 TYR A 48 20.370 -22.647 -2.875 1.00 0.00 H new ATOM 0 HH TYR A 48 21.214 -24.704 -2.708 1.00 0.00 H new ATOM 772 N SER A 49 15.181 -22.656 0.220 1.00 0.00 N ATOM 773 CA SER A 49 14.411 -23.842 -0.258 1.00 0.00 C ATOM 774 C SER A 49 13.947 -23.629 -1.702 1.00 0.00 C ATOM 775 O SER A 49 12.845 -23.986 -2.066 1.00 0.00 O ATOM 776 CB SER A 49 13.210 -23.939 0.680 1.00 0.00 C ATOM 777 OG SER A 49 12.415 -22.767 0.548 1.00 0.00 O ATOM 0 H SER A 49 14.998 -21.788 -0.283 1.00 0.00 H new ATOM 0 HA SER A 49 15.011 -24.752 -0.249 1.00 0.00 H new ATOM 0 HB2 SER A 49 12.618 -24.823 0.441 1.00 0.00 H new ATOM 0 HB3 SER A 49 13.547 -24.050 1.711 1.00 0.00 H new ATOM 0 HG SER A 49 11.642 -22.827 1.148 1.00 0.00 H new ATOM 783 N GLY A 50 14.779 -23.052 -2.524 1.00 0.00 N ATOM 784 CA GLY A 50 14.381 -22.820 -3.942 1.00 0.00 C ATOM 785 C GLY A 50 14.806 -24.018 -4.792 1.00 0.00 C ATOM 786 O GLY A 50 15.089 -25.078 -4.272 1.00 0.00 O ATOM 0 H GLY A 50 15.715 -22.732 -2.277 1.00 0.00 H new ATOM 0 HA2 GLY A 50 13.303 -22.677 -4.010 1.00 0.00 H new ATOM 0 HA3 GLY A 50 14.848 -21.910 -4.318 1.00 0.00 H new ATOM 790 N PRO A 51 14.836 -23.804 -6.079 1.00 0.00 N ATOM 791 CA PRO A 51 15.239 -24.912 -6.985 1.00 0.00 C ATOM 792 C PRO A 51 16.740 -24.835 -7.273 1.00 0.00 C ATOM 793 O PRO A 51 17.458 -25.806 -7.144 1.00 0.00 O ATOM 794 CB PRO A 51 14.432 -24.679 -8.263 1.00 0.00 C ATOM 795 CG PRO A 51 13.343 -23.731 -7.882 1.00 0.00 C ATOM 796 CD PRO A 51 13.842 -22.932 -6.712 1.00 0.00 C ATOM 0 HA PRO A 51 15.050 -25.896 -6.555 1.00 0.00 H new ATOM 0 HB2 PRO A 51 15.058 -24.261 -9.051 1.00 0.00 H new ATOM 0 HB3 PRO A 51 14.022 -25.614 -8.644 1.00 0.00 H new ATOM 0 HG2 PRO A 51 13.093 -23.076 -8.717 1.00 0.00 H new ATOM 0 HG3 PRO A 51 12.435 -24.273 -7.619 1.00 0.00 H new ATOM 0 HD2 PRO A 51 14.286 -21.990 -7.033 1.00 0.00 H new ATOM 0 HD3 PRO A 51 13.033 -22.685 -6.024 1.00 0.00 H new ATOM 804 N GLY A 52 17.219 -23.686 -7.662 1.00 0.00 N ATOM 805 CA GLY A 52 18.672 -23.545 -7.956 1.00 0.00 C ATOM 806 C GLY A 52 19.316 -22.620 -6.922 1.00 0.00 C ATOM 807 O GLY A 52 20.391 -22.893 -6.428 1.00 0.00 O ATOM 0 H GLY A 52 16.666 -22.838 -7.789 1.00 0.00 H new ATOM 0 HA2 GLY A 52 19.154 -24.522 -7.935 1.00 0.00 H new ATOM 0 HA3 GLY A 52 18.813 -23.141 -8.958 1.00 0.00 H new ATOM 811 N SER A 53 18.648 -21.540 -6.588 1.00 0.00 N ATOM 812 CA SER A 53 19.172 -20.576 -5.587 1.00 0.00 C ATOM 813 C SER A 53 20.695 -20.616 -5.511 1.00 0.00 C ATOM 814 O SER A 53 21.376 -20.779 -6.503 1.00 0.00 O ATOM 815 CB SER A 53 18.537 -21.022 -4.281 1.00 0.00 C ATOM 816 OG SER A 53 17.304 -21.673 -4.557 1.00 0.00 O ATOM 0 H SER A 53 17.741 -21.288 -6.981 1.00 0.00 H new ATOM 0 HA SER A 53 18.929 -19.543 -5.838 1.00 0.00 H new ATOM 0 HB2 SER A 53 19.207 -21.698 -3.749 1.00 0.00 H new ATOM 0 HB3 SER A 53 18.370 -20.162 -3.632 1.00 0.00 H new ATOM 0 HG SER A 53 17.011 -22.168 -3.764 1.00 0.00 H new ATOM 822 N VAL A 54 21.229 -20.463 -4.342 1.00 0.00 N ATOM 823 CA VAL A 54 22.713 -20.483 -4.191 1.00 0.00 C ATOM 824 C VAL A 54 23.104 -20.942 -2.785 1.00 0.00 C ATOM 825 O VAL A 54 22.327 -20.841 -1.857 1.00 0.00 O ATOM 826 CB VAL A 54 23.152 -19.038 -4.426 1.00 0.00 C ATOM 827 CG1 VAL A 54 22.684 -18.580 -5.808 1.00 0.00 C ATOM 828 CG2 VAL A 54 22.532 -18.137 -3.355 1.00 0.00 C ATOM 0 H VAL A 54 20.706 -20.324 -3.477 1.00 0.00 H new ATOM 0 HA VAL A 54 23.187 -21.174 -4.888 1.00 0.00 H new ATOM 0 HB VAL A 54 24.239 -18.976 -4.371 1.00 0.00 H new ATOM 0 HG11 VAL A 54 22.997 -17.549 -5.975 1.00 0.00 H new ATOM 0 HG12 VAL A 54 23.123 -19.221 -6.572 1.00 0.00 H new ATOM 0 HG13 VAL A 54 21.597 -18.642 -5.863 1.00 0.00 H new ATOM 0 HG21 VAL A 54 22.844 -17.106 -3.521 1.00 0.00 H new ATOM 0 HG22 VAL A 54 21.445 -18.200 -3.411 1.00 0.00 H new ATOM 0 HG23 VAL A 54 22.864 -18.462 -2.369 1.00 0.00 H new ATOM 838 N PRO A 55 24.309 -21.435 -2.682 1.00 0.00 N ATOM 839 CA PRO A 55 24.790 -21.909 -1.357 1.00 0.00 C ATOM 840 C PRO A 55 24.969 -20.724 -0.404 1.00 0.00 C ATOM 841 O PRO A 55 25.688 -19.788 -0.691 1.00 0.00 O ATOM 842 CB PRO A 55 26.135 -22.573 -1.652 1.00 0.00 C ATOM 843 CG PRO A 55 26.544 -22.065 -2.995 1.00 0.00 C ATOM 844 CD PRO A 55 25.284 -21.721 -3.739 1.00 0.00 C ATOM 0 HA PRO A 55 24.090 -22.593 -0.877 1.00 0.00 H new ATOM 0 HB2 PRO A 55 26.874 -22.316 -0.893 1.00 0.00 H new ATOM 0 HB3 PRO A 55 26.044 -23.659 -1.654 1.00 0.00 H new ATOM 0 HG2 PRO A 55 27.185 -21.189 -2.897 1.00 0.00 H new ATOM 0 HG3 PRO A 55 27.116 -22.820 -3.535 1.00 0.00 H new ATOM 0 HD2 PRO A 55 25.429 -20.859 -4.391 1.00 0.00 H new ATOM 0 HD3 PRO A 55 24.956 -22.547 -4.370 1.00 0.00 H new ATOM 852 N GLY A 56 24.319 -20.757 0.727 1.00 0.00 N ATOM 853 CA GLY A 56 24.451 -19.634 1.697 1.00 0.00 C ATOM 854 C GLY A 56 23.130 -18.866 1.772 1.00 0.00 C ATOM 855 O GLY A 56 22.863 -18.163 2.726 1.00 0.00 O ATOM 0 H GLY A 56 23.702 -21.514 1.021 1.00 0.00 H new ATOM 0 HA2 GLY A 56 24.716 -20.019 2.682 1.00 0.00 H new ATOM 0 HA3 GLY A 56 25.255 -18.966 1.389 1.00 0.00 H new ATOM 859 N ALA A 57 22.302 -18.995 0.772 1.00 0.00 N ATOM 860 CA ALA A 57 20.997 -18.274 0.785 1.00 0.00 C ATOM 861 C ALA A 57 20.112 -18.799 1.918 1.00 0.00 C ATOM 862 O ALA A 57 20.067 -19.984 2.186 1.00 0.00 O ATOM 863 CB ALA A 57 20.362 -18.579 -0.572 1.00 0.00 C ATOM 0 H ALA A 57 22.472 -19.569 -0.054 1.00 0.00 H new ATOM 0 HA ALA A 57 21.120 -17.203 0.948 1.00 0.00 H new ATOM 0 HB1 ALA A 57 19.394 -18.082 -0.641 1.00 0.00 H new ATOM 0 HB2 ALA A 57 21.013 -18.217 -1.368 1.00 0.00 H new ATOM 0 HB3 ALA A 57 20.225 -19.655 -0.676 1.00 0.00 H new ATOM 869 N LEU A 58 19.405 -17.927 2.584 1.00 0.00 N ATOM 870 CA LEU A 58 18.521 -18.377 3.697 1.00 0.00 C ATOM 871 C LEU A 58 17.074 -17.965 3.416 1.00 0.00 C ATOM 872 O LEU A 58 16.814 -17.080 2.625 1.00 0.00 O ATOM 873 CB LEU A 58 19.050 -17.665 4.941 1.00 0.00 C ATOM 874 CG LEU A 58 20.437 -18.209 5.290 1.00 0.00 C ATOM 875 CD1 LEU A 58 21.437 -17.054 5.354 1.00 0.00 C ATOM 876 CD2 LEU A 58 20.381 -18.912 6.648 1.00 0.00 C ATOM 0 H LEU A 58 19.401 -16.923 2.406 1.00 0.00 H new ATOM 0 HA LEU A 58 18.528 -19.460 3.818 1.00 0.00 H new ATOM 0 HB2 LEU A 58 19.103 -16.591 4.763 1.00 0.00 H new ATOM 0 HB3 LEU A 58 18.367 -17.816 5.777 1.00 0.00 H new ATOM 0 HG LEU A 58 20.752 -18.919 4.526 1.00 0.00 H new ATOM 0 HD11 LEU A 58 22.425 -17.441 5.603 1.00 0.00 H new ATOM 0 HD12 LEU A 58 21.477 -16.553 4.387 1.00 0.00 H new ATOM 0 HD13 LEU A 58 21.123 -16.343 6.118 1.00 0.00 H new ATOM 0 HD21 LEU A 58 21.368 -19.300 6.898 1.00 0.00 H new ATOM 0 HD22 LEU A 58 20.066 -18.202 7.413 1.00 0.00 H new ATOM 0 HD23 LEU A 58 19.668 -19.736 6.602 1.00 0.00 H new ATOM 888 N ASP A 59 16.131 -18.599 4.056 1.00 0.00 N ATOM 889 CA ASP A 59 14.705 -18.238 3.820 1.00 0.00 C ATOM 890 C ASP A 59 14.210 -17.284 4.910 1.00 0.00 C ATOM 891 O ASP A 59 14.063 -17.658 6.056 1.00 0.00 O ATOM 892 CB ASP A 59 13.944 -19.565 3.885 1.00 0.00 C ATOM 893 CG ASP A 59 12.453 -19.299 4.096 1.00 0.00 C ATOM 894 OD1 ASP A 59 12.029 -18.182 3.850 1.00 0.00 O ATOM 895 OD2 ASP A 59 11.758 -20.218 4.500 1.00 0.00 O ATOM 0 H ASP A 59 16.285 -19.349 4.730 1.00 0.00 H new ATOM 0 HA ASP A 59 14.562 -17.730 2.866 1.00 0.00 H new ATOM 0 HB2 ASP A 59 14.095 -20.127 2.963 1.00 0.00 H new ATOM 0 HB3 ASP A 59 14.332 -20.177 4.699 1.00 0.00 H new ATOM 900 N TYR A 60 13.943 -16.057 4.559 1.00 0.00 N ATOM 901 CA TYR A 60 13.444 -15.088 5.575 1.00 0.00 C ATOM 902 C TYR A 60 11.951 -15.321 5.804 1.00 0.00 C ATOM 903 O TYR A 60 11.409 -14.988 6.839 1.00 0.00 O ATOM 904 CB TYR A 60 13.689 -13.707 4.967 1.00 0.00 C ATOM 905 CG TYR A 60 12.963 -13.603 3.648 1.00 0.00 C ATOM 906 CD1 TYR A 60 11.565 -13.515 3.625 1.00 0.00 C ATOM 907 CD2 TYR A 60 13.685 -13.594 2.449 1.00 0.00 C ATOM 908 CE1 TYR A 60 10.891 -13.419 2.401 1.00 0.00 C ATOM 909 CE2 TYR A 60 13.011 -13.497 1.227 1.00 0.00 C ATOM 910 CZ TYR A 60 11.614 -13.409 1.202 1.00 0.00 C ATOM 911 OH TYR A 60 10.950 -13.314 -0.004 1.00 0.00 O ATOM 0 H TYR A 60 14.048 -15.684 3.616 1.00 0.00 H new ATOM 0 HA TYR A 60 13.943 -15.192 6.538 1.00 0.00 H new ATOM 0 HB2 TYR A 60 13.341 -12.931 5.648 1.00 0.00 H new ATOM 0 HB3 TYR A 60 14.757 -13.547 4.820 1.00 0.00 H new ATOM 0 HD1 TYR A 60 11.008 -13.521 4.550 1.00 0.00 H new ATOM 0 HD2 TYR A 60 14.763 -13.662 2.467 1.00 0.00 H new ATOM 0 HE1 TYR A 60 9.813 -13.353 2.382 1.00 0.00 H new ATOM 0 HE2 TYR A 60 13.569 -13.490 0.302 1.00 0.00 H new ATOM 0 HH TYR A 60 9.998 -13.503 0.131 1.00 0.00 H new ATOM 921 N ALA A 61 11.284 -15.902 4.843 1.00 0.00 N ATOM 922 CA ALA A 61 9.828 -16.169 5.001 1.00 0.00 C ATOM 923 C ALA A 61 9.600 -17.082 6.208 1.00 0.00 C ATOM 924 O ALA A 61 8.703 -16.869 6.999 1.00 0.00 O ATOM 925 CB ALA A 61 9.409 -16.869 3.709 1.00 0.00 C ATOM 0 H ALA A 61 11.686 -16.203 3.955 1.00 0.00 H new ATOM 0 HA ALA A 61 9.252 -15.260 5.170 1.00 0.00 H new ATOM 0 HB1 ALA A 61 8.344 -17.100 3.749 1.00 0.00 H new ATOM 0 HB2 ALA A 61 9.607 -16.215 2.860 1.00 0.00 H new ATOM 0 HB3 ALA A 61 9.976 -17.793 3.595 1.00 0.00 H new ATOM 931 N ALA A 62 10.411 -18.094 6.360 1.00 0.00 N ATOM 932 CA ALA A 62 10.242 -19.013 7.522 1.00 0.00 C ATOM 933 C ALA A 62 10.405 -18.236 8.826 1.00 0.00 C ATOM 934 O ALA A 62 9.785 -18.534 9.826 1.00 0.00 O ATOM 935 CB ALA A 62 11.350 -20.056 7.372 1.00 0.00 C ATOM 0 H ALA A 62 11.181 -18.324 5.732 1.00 0.00 H new ATOM 0 HA ALA A 62 9.255 -19.476 7.546 1.00 0.00 H new ATOM 0 HB1 ALA A 62 11.291 -20.770 8.193 1.00 0.00 H new ATOM 0 HB2 ALA A 62 11.229 -20.582 6.425 1.00 0.00 H new ATOM 0 HB3 ALA A 62 12.321 -19.561 7.391 1.00 0.00 H new ATOM 941 N PHE A 63 11.240 -17.241 8.812 1.00 0.00 N ATOM 942 CA PHE A 63 11.462 -16.426 10.042 1.00 0.00 C ATOM 943 C PHE A 63 10.238 -15.553 10.331 1.00 0.00 C ATOM 944 O PHE A 63 9.871 -15.338 11.470 1.00 0.00 O ATOM 945 CB PHE A 63 12.680 -15.559 9.721 1.00 0.00 C ATOM 946 CG PHE A 63 12.798 -14.449 10.738 1.00 0.00 C ATOM 947 CD1 PHE A 63 12.279 -14.620 12.028 1.00 0.00 C ATOM 948 CD2 PHE A 63 13.429 -13.248 10.392 1.00 0.00 C ATOM 949 CE1 PHE A 63 12.390 -13.590 12.970 1.00 0.00 C ATOM 950 CE2 PHE A 63 13.540 -12.218 11.333 1.00 0.00 C ATOM 951 CZ PHE A 63 13.021 -12.390 12.622 1.00 0.00 C ATOM 0 H PHE A 63 11.784 -16.952 7.999 1.00 0.00 H new ATOM 0 HA PHE A 63 11.621 -17.044 10.926 1.00 0.00 H new ATOM 0 HB2 PHE A 63 13.584 -16.168 9.727 1.00 0.00 H new ATOM 0 HB3 PHE A 63 12.586 -15.139 8.720 1.00 0.00 H new ATOM 0 HD1 PHE A 63 11.793 -15.547 12.296 1.00 0.00 H new ATOM 0 HD2 PHE A 63 13.830 -13.116 9.398 1.00 0.00 H new ATOM 0 HE1 PHE A 63 11.989 -13.721 13.964 1.00 0.00 H new ATOM 0 HE2 PHE A 63 14.026 -11.291 11.065 1.00 0.00 H new ATOM 0 HZ PHE A 63 13.108 -11.596 13.349 1.00 0.00 H new ATOM 961 N SER A 64 9.603 -15.044 9.309 1.00 0.00 N ATOM 962 CA SER A 64 8.405 -14.181 9.529 1.00 0.00 C ATOM 963 C SER A 64 7.301 -14.969 10.239 1.00 0.00 C ATOM 964 O SER A 64 6.608 -14.454 11.093 1.00 0.00 O ATOM 965 CB SER A 64 7.951 -13.770 8.128 1.00 0.00 C ATOM 966 OG SER A 64 9.091 -13.605 7.295 1.00 0.00 O ATOM 0 H SER A 64 9.861 -15.188 8.333 1.00 0.00 H new ATOM 0 HA SER A 64 8.630 -13.319 10.157 1.00 0.00 H new ATOM 0 HB2 SER A 64 7.288 -14.528 7.711 1.00 0.00 H new ATOM 0 HB3 SER A 64 7.383 -12.841 8.175 1.00 0.00 H new ATOM 0 HG SER A 64 8.964 -12.824 6.717 1.00 0.00 H new ATOM 972 N SER A 65 7.129 -16.214 9.889 1.00 0.00 N ATOM 973 CA SER A 65 6.067 -17.032 10.542 1.00 0.00 C ATOM 974 C SER A 65 6.420 -17.293 12.009 1.00 0.00 C ATOM 975 O SER A 65 5.579 -17.218 12.881 1.00 0.00 O ATOM 976 CB SER A 65 6.041 -18.343 9.757 1.00 0.00 C ATOM 977 OG SER A 65 7.350 -18.898 9.728 1.00 0.00 O ATOM 0 H SER A 65 7.677 -16.700 9.180 1.00 0.00 H new ATOM 0 HA SER A 65 5.099 -16.531 10.535 1.00 0.00 H new ATOM 0 HB2 SER A 65 5.346 -19.044 10.220 1.00 0.00 H new ATOM 0 HB3 SER A 65 5.686 -18.166 8.742 1.00 0.00 H new ATOM 0 HG SER A 65 8.005 -18.203 9.948 1.00 0.00 H new ATOM 983 N ALA A 66 7.656 -17.601 12.287 1.00 0.00 N ATOM 984 CA ALA A 66 8.060 -17.871 13.698 1.00 0.00 C ATOM 985 C ALA A 66 7.883 -16.617 14.559 1.00 0.00 C ATOM 986 O ALA A 66 7.486 -16.691 15.705 1.00 0.00 O ATOM 987 CB ALA A 66 9.537 -18.260 13.618 1.00 0.00 C ATOM 0 H ALA A 66 8.405 -17.678 11.599 1.00 0.00 H new ATOM 0 HA ALA A 66 7.453 -18.652 14.155 1.00 0.00 H new ATOM 0 HB1 ALA A 66 9.911 -18.475 14.619 1.00 0.00 H new ATOM 0 HB2 ALA A 66 9.647 -19.145 12.991 1.00 0.00 H new ATOM 0 HB3 ALA A 66 10.107 -17.437 13.187 1.00 0.00 H new ATOM 993 N LEU A 67 8.178 -15.466 14.020 1.00 0.00 N ATOM 994 CA LEU A 67 8.031 -14.210 14.812 1.00 0.00 C ATOM 995 C LEU A 67 6.584 -14.041 15.288 1.00 0.00 C ATOM 996 O LEU A 67 6.334 -13.659 16.414 1.00 0.00 O ATOM 997 CB LEU A 67 8.414 -13.085 13.852 1.00 0.00 C ATOM 998 CG LEU A 67 9.437 -12.168 14.523 1.00 0.00 C ATOM 999 CD1 LEU A 67 9.881 -11.086 13.537 1.00 0.00 C ATOM 1000 CD2 LEU A 67 8.803 -11.509 15.750 1.00 0.00 C ATOM 0 H LEU A 67 8.515 -15.340 13.065 1.00 0.00 H new ATOM 0 HA LEU A 67 8.657 -14.215 15.705 1.00 0.00 H new ATOM 0 HB2 LEU A 67 8.830 -13.501 12.934 1.00 0.00 H new ATOM 0 HB3 LEU A 67 7.528 -12.515 13.571 1.00 0.00 H new ATOM 0 HG LEU A 67 10.302 -12.755 14.830 1.00 0.00 H new ATOM 0 HD11 LEU A 67 10.610 -10.433 14.017 1.00 0.00 H new ATOM 0 HD12 LEU A 67 10.333 -11.554 12.663 1.00 0.00 H new ATOM 0 HD13 LEU A 67 9.016 -10.499 13.228 1.00 0.00 H new ATOM 0 HD21 LEU A 67 9.532 -10.855 16.229 1.00 0.00 H new ATOM 0 HD22 LEU A 67 7.937 -10.923 15.442 1.00 0.00 H new ATOM 0 HD23 LEU A 67 8.488 -12.279 16.454 1.00 0.00 H new ATOM 1012 N TYR A 68 5.631 -14.316 14.441 1.00 0.00 N ATOM 1013 CA TYR A 68 4.205 -14.162 14.851 1.00 0.00 C ATOM 1014 C TYR A 68 3.622 -15.513 15.276 1.00 0.00 C ATOM 1015 O TYR A 68 2.797 -15.591 16.165 1.00 0.00 O ATOM 1016 CB TYR A 68 3.492 -13.635 13.606 1.00 0.00 C ATOM 1017 CG TYR A 68 3.655 -12.135 13.534 1.00 0.00 C ATOM 1018 CD1 TYR A 68 2.736 -11.299 14.179 1.00 0.00 C ATOM 1019 CD2 TYR A 68 4.727 -11.580 12.825 1.00 0.00 C ATOM 1020 CE1 TYR A 68 2.887 -9.908 14.114 1.00 0.00 C ATOM 1021 CE2 TYR A 68 4.879 -10.190 12.759 1.00 0.00 C ATOM 1022 CZ TYR A 68 3.959 -9.354 13.404 1.00 0.00 C ATOM 1023 OH TYR A 68 4.110 -7.983 13.340 1.00 0.00 O ATOM 0 H TYR A 68 5.776 -14.640 13.485 1.00 0.00 H new ATOM 0 HA TYR A 68 4.091 -13.491 15.702 1.00 0.00 H new ATOM 0 HB2 TYR A 68 3.906 -14.101 12.712 1.00 0.00 H new ATOM 0 HB3 TYR A 68 2.434 -13.896 13.641 1.00 0.00 H new ATOM 0 HD1 TYR A 68 1.910 -11.727 14.727 1.00 0.00 H new ATOM 0 HD2 TYR A 68 5.437 -12.225 12.329 1.00 0.00 H new ATOM 0 HE1 TYR A 68 2.177 -9.263 14.611 1.00 0.00 H new ATOM 0 HE2 TYR A 68 5.705 -9.762 12.211 1.00 0.00 H new ATOM 0 HH TYR A 68 4.905 -7.766 12.810 1.00 0.00 H new ATOM 1033 N GLY A 69 4.043 -16.578 14.650 1.00 0.00 N ATOM 1034 CA GLY A 69 3.510 -17.919 15.024 1.00 0.00 C ATOM 1035 C GLY A 69 3.136 -18.694 13.759 1.00 0.00 C ATOM 1036 O GLY A 69 3.946 -18.885 12.873 1.00 0.00 O ATOM 0 H GLY A 69 4.731 -16.578 13.897 1.00 0.00 H new ATOM 0 HA2 GLY A 69 4.256 -18.472 15.594 1.00 0.00 H new ATOM 0 HA3 GLY A 69 2.636 -17.808 15.666 1.00 0.00 H new ATOM 1040 N GLU A 70 1.916 -19.146 13.668 1.00 0.00 N ATOM 1041 CA GLU A 70 1.492 -19.910 12.459 1.00 0.00 C ATOM 1042 C GLU A 70 2.490 -21.034 12.167 1.00 0.00 C ATOM 1043 O GLU A 70 3.099 -21.080 11.116 1.00 0.00 O ATOM 1044 CB GLU A 70 1.491 -18.886 11.323 1.00 0.00 C ATOM 1045 CG GLU A 70 1.018 -19.557 10.032 1.00 0.00 C ATOM 1046 CD GLU A 70 0.750 -18.488 8.971 1.00 0.00 C ATOM 1047 OE1 GLU A 70 0.084 -17.517 9.292 1.00 0.00 O ATOM 1048 OE2 GLU A 70 1.214 -18.659 7.855 1.00 0.00 O ATOM 0 H GLU A 70 1.194 -19.020 14.377 1.00 0.00 H new ATOM 0 HA GLU A 70 0.516 -20.377 12.587 1.00 0.00 H new ATOM 0 HB2 GLU A 70 0.836 -18.051 11.572 1.00 0.00 H new ATOM 0 HB3 GLU A 70 2.492 -18.477 11.187 1.00 0.00 H new ATOM 0 HG2 GLU A 70 1.773 -20.257 9.675 1.00 0.00 H new ATOM 0 HG3 GLU A 70 0.112 -20.134 10.220 1.00 0.00 H new ATOM 1055 N SER A 71 2.663 -21.941 13.089 1.00 0.00 N ATOM 1056 CA SER A 71 3.623 -23.060 12.863 1.00 0.00 C ATOM 1057 C SER A 71 3.104 -24.342 13.520 1.00 0.00 C ATOM 1058 O SER A 71 2.995 -24.433 14.727 1.00 0.00 O ATOM 1059 CB SER A 71 4.922 -22.608 13.525 1.00 0.00 C ATOM 1060 OG SER A 71 5.997 -23.404 13.042 1.00 0.00 O ATOM 0 H SER A 71 2.182 -21.956 13.988 1.00 0.00 H new ATOM 0 HA SER A 71 3.760 -23.278 11.804 1.00 0.00 H new ATOM 0 HB2 SER A 71 5.107 -21.556 13.308 1.00 0.00 H new ATOM 0 HB3 SER A 71 4.843 -22.701 14.608 1.00 0.00 H new ATOM 0 HG SER A 71 6.833 -23.115 13.464 1.00 0.00 H new ATOM 1066 N ASP A 72 2.782 -25.334 12.735 1.00 0.00 N ATOM 1067 CA ASP A 72 2.270 -26.609 13.316 1.00 0.00 C ATOM 1068 C ASP A 72 3.437 -27.503 13.742 1.00 0.00 C ATOM 1069 O ASP A 72 4.334 -27.780 12.971 1.00 0.00 O ATOM 1070 CB ASP A 72 1.475 -27.266 12.188 1.00 0.00 C ATOM 1071 CG ASP A 72 0.150 -26.526 11.999 1.00 0.00 C ATOM 1072 OD1 ASP A 72 -0.812 -26.898 12.651 1.00 0.00 O ATOM 1073 OD2 ASP A 72 0.119 -25.601 11.205 1.00 0.00 O ATOM 0 H ASP A 72 2.851 -25.317 11.717 1.00 0.00 H new ATOM 0 HA ASP A 72 1.658 -26.443 14.203 1.00 0.00 H new ATOM 0 HB2 ASP A 72 2.051 -27.245 11.263 1.00 0.00 H new ATOM 0 HB3 ASP A 72 1.288 -28.314 12.423 1.00 0.00 H new ATOM 1078 N LEU A 73 3.433 -27.955 14.966 1.00 0.00 N ATOM 1079 CA LEU A 73 4.543 -28.830 15.442 1.00 0.00 C ATOM 1080 C LEU A 73 5.892 -28.138 15.228 1.00 0.00 C ATOM 1081 O LEU A 73 6.136 -27.062 15.739 1.00 0.00 O ATOM 1082 CB LEU A 73 4.447 -30.093 14.584 1.00 0.00 C ATOM 1083 CG LEU A 73 3.959 -31.258 15.446 1.00 0.00 C ATOM 1084 CD1 LEU A 73 2.453 -31.126 15.680 1.00 0.00 C ATOM 1085 CD2 LEU A 73 4.249 -32.578 14.727 1.00 0.00 C ATOM 0 H LEU A 73 2.710 -27.757 15.657 1.00 0.00 H new ATOM 0 HA LEU A 73 4.466 -29.052 16.506 1.00 0.00 H new ATOM 0 HB2 LEU A 73 3.761 -29.930 13.752 1.00 0.00 H new ATOM 0 HB3 LEU A 73 5.420 -30.328 14.153 1.00 0.00 H new ATOM 0 HG LEU A 73 4.477 -31.243 16.405 1.00 0.00 H new ATOM 0 HD11 LEU A 73 2.106 -31.957 16.294 1.00 0.00 H new ATOM 0 HD12 LEU A 73 2.245 -30.186 16.190 1.00 0.00 H new ATOM 0 HD13 LEU A 73 1.933 -31.141 14.722 1.00 0.00 H new ATOM 0 HD21 LEU A 73 3.902 -33.410 15.340 1.00 0.00 H new ATOM 0 HD22 LEU A 73 3.730 -32.592 13.769 1.00 0.00 H new ATOM 0 HD23 LEU A 73 5.322 -32.673 14.560 1.00 0.00 H new TER 1097 LEU A 73 ATOM 1098 N GLY B 7 11.854 6.474 0.062 1.00 0.00 N ATOM 1099 CA GLY B 7 12.617 5.590 0.988 1.00 0.00 C ATOM 1100 C GLY B 7 11.977 4.200 1.009 1.00 0.00 C ATOM 1101 O GLY B 7 11.635 3.680 2.053 1.00 0.00 O ATOM 0 HA2 GLY B 7 13.656 5.519 0.666 1.00 0.00 H new ATOM 0 HA3 GLY B 7 12.622 6.015 1.992 1.00 0.00 H new ATOM 1105 N LYS B 8 11.813 3.594 -0.134 1.00 0.00 N ATOM 1106 CA LYS B 8 11.196 2.237 -0.176 1.00 0.00 C ATOM 1107 C LYS B 8 12.081 1.232 0.563 1.00 0.00 C ATOM 1108 O LYS B 8 11.632 0.522 1.441 1.00 0.00 O ATOM 1109 CB LYS B 8 11.109 1.887 -1.661 1.00 0.00 C ATOM 1110 CG LYS B 8 9.700 2.188 -2.174 1.00 0.00 C ATOM 1111 CD LYS B 8 8.981 0.877 -2.497 1.00 0.00 C ATOM 1112 CE LYS B 8 8.104 1.069 -3.736 1.00 0.00 C ATOM 1113 NZ LYS B 8 6.742 1.350 -3.203 1.00 0.00 N ATOM 0 H LYS B 8 12.079 3.979 -1.041 1.00 0.00 H new ATOM 0 HA LYS B 8 10.218 2.212 0.305 1.00 0.00 H new ATOM 0 HB2 LYS B 8 11.843 2.462 -2.225 1.00 0.00 H new ATOM 0 HB3 LYS B 8 11.345 0.834 -1.812 1.00 0.00 H new ATOM 0 HG2 LYS B 8 9.140 2.746 -1.424 1.00 0.00 H new ATOM 0 HG3 LYS B 8 9.752 2.815 -3.064 1.00 0.00 H new ATOM 0 HD2 LYS B 8 9.708 0.084 -2.672 1.00 0.00 H new ATOM 0 HD3 LYS B 8 8.369 0.567 -1.650 1.00 0.00 H new ATOM 0 HE2 LYS B 8 8.465 1.893 -4.351 1.00 0.00 H new ATOM 0 HE3 LYS B 8 8.106 0.178 -4.363 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 6.082 1.493 -3.994 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 6.422 0.546 -2.627 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 6.769 2.208 -2.615 1.00 0.00 H new ATOM 1127 N LYS B 9 13.338 1.169 0.217 1.00 0.00 N ATOM 1128 CA LYS B 9 14.251 0.211 0.904 1.00 0.00 C ATOM 1129 C LYS B 9 14.419 0.608 2.372 1.00 0.00 C ATOM 1130 O LYS B 9 14.297 -0.209 3.263 1.00 0.00 O ATOM 1131 CB LYS B 9 15.582 0.329 0.161 1.00 0.00 C ATOM 1132 CG LYS B 9 16.408 -0.938 0.388 1.00 0.00 C ATOM 1133 CD LYS B 9 17.877 -0.560 0.590 1.00 0.00 C ATOM 1134 CE LYS B 9 18.010 0.323 1.832 1.00 0.00 C ATOM 1135 NZ LYS B 9 18.811 1.496 1.385 1.00 0.00 N ATOM 0 H LYS B 9 13.772 1.738 -0.510 1.00 0.00 H new ATOM 0 HA LYS B 9 13.868 -0.809 0.891 1.00 0.00 H new ATOM 0 HB2 LYS B 9 15.404 0.474 -0.905 1.00 0.00 H new ATOM 0 HB3 LYS B 9 16.131 1.202 0.514 1.00 0.00 H new ATOM 0 HG2 LYS B 9 16.037 -1.476 1.260 1.00 0.00 H new ATOM 0 HG3 LYS B 9 16.308 -1.608 -0.466 1.00 0.00 H new ATOM 0 HD2 LYS B 9 18.483 -1.459 0.703 1.00 0.00 H new ATOM 0 HD3 LYS B 9 18.252 -0.032 -0.287 1.00 0.00 H new ATOM 0 HE2 LYS B 9 17.033 0.631 2.204 1.00 0.00 H new ATOM 0 HE3 LYS B 9 18.507 -0.209 2.643 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 18.945 2.149 2.183 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 19.738 1.173 1.042 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 18.310 1.986 0.617 1.00 0.00 H new ATOM 1149 N ALA B 10 14.695 1.857 2.631 1.00 0.00 N ATOM 1150 CA ALA B 10 14.867 2.303 4.043 1.00 0.00 C ATOM 1151 C ALA B 10 13.627 1.934 4.860 1.00 0.00 C ATOM 1152 O ALA B 10 13.719 1.555 6.009 1.00 0.00 O ATOM 1153 CB ALA B 10 15.029 3.821 3.965 1.00 0.00 C ATOM 0 H ALA B 10 14.809 2.587 1.927 1.00 0.00 H new ATOM 0 HA ALA B 10 15.722 1.831 4.527 1.00 0.00 H new ATOM 0 HB1 ALA B 10 15.161 4.225 4.969 1.00 0.00 H new ATOM 0 HB2 ALA B 10 15.902 4.063 3.359 1.00 0.00 H new ATOM 0 HB3 ALA B 10 14.140 4.259 3.512 1.00 0.00 H new ATOM 1159 N GLU B 11 12.466 2.037 4.271 1.00 0.00 N ATOM 1160 CA GLU B 11 11.223 1.684 5.013 1.00 0.00 C ATOM 1161 C GLU B 11 11.210 0.185 5.319 1.00 0.00 C ATOM 1162 O GLU B 11 10.823 -0.237 6.391 1.00 0.00 O ATOM 1163 CB GLU B 11 10.076 2.050 4.072 1.00 0.00 C ATOM 1164 CG GLU B 11 8.741 1.775 4.767 1.00 0.00 C ATOM 1165 CD GLU B 11 8.462 2.876 5.793 1.00 0.00 C ATOM 1166 OE1 GLU B 11 8.052 3.950 5.384 1.00 0.00 O ATOM 1167 OE2 GLU B 11 8.664 2.627 6.970 1.00 0.00 O ATOM 0 H GLU B 11 12.325 2.350 3.310 1.00 0.00 H new ATOM 0 HA GLU B 11 11.145 2.209 5.965 1.00 0.00 H new ATOM 0 HB2 GLU B 11 10.143 3.101 3.791 1.00 0.00 H new ATOM 0 HB3 GLU B 11 10.146 1.469 3.152 1.00 0.00 H new ATOM 0 HG2 GLU B 11 7.937 1.737 4.032 1.00 0.00 H new ATOM 0 HG3 GLU B 11 8.769 0.803 5.260 1.00 0.00 H new ATOM 1174 N ALA B 12 11.637 -0.624 4.386 1.00 0.00 N ATOM 1175 CA ALA B 12 11.654 -2.094 4.627 1.00 0.00 C ATOM 1176 C ALA B 12 12.598 -2.414 5.786 1.00 0.00 C ATOM 1177 O ALA B 12 12.282 -3.197 6.661 1.00 0.00 O ATOM 1178 CB ALA B 12 12.176 -2.704 3.326 1.00 0.00 C ATOM 0 H ALA B 12 11.974 -0.330 3.469 1.00 0.00 H new ATOM 0 HA ALA B 12 10.672 -2.486 4.891 1.00 0.00 H new ATOM 0 HB1 ALA B 12 12.218 -3.789 3.424 1.00 0.00 H new ATOM 0 HB2 ALA B 12 11.508 -2.439 2.506 1.00 0.00 H new ATOM 0 HB3 ALA B 12 13.175 -2.320 3.119 1.00 0.00 H new ATOM 1184 N VAL B 13 13.752 -1.804 5.809 1.00 0.00 N ATOM 1185 CA VAL B 13 14.708 -2.063 6.922 1.00 0.00 C ATOM 1186 C VAL B 13 14.048 -1.706 8.255 1.00 0.00 C ATOM 1187 O VAL B 13 14.198 -2.398 9.241 1.00 0.00 O ATOM 1188 CB VAL B 13 15.900 -1.145 6.646 1.00 0.00 C ATOM 1189 CG1 VAL B 13 16.944 -1.318 7.750 1.00 0.00 C ATOM 1190 CG2 VAL B 13 16.520 -1.509 5.295 1.00 0.00 C ATOM 0 H VAL B 13 14.073 -1.138 5.106 1.00 0.00 H new ATOM 0 HA VAL B 13 15.013 -3.108 6.980 1.00 0.00 H new ATOM 0 HB VAL B 13 15.564 -0.108 6.625 1.00 0.00 H new ATOM 0 HG11 VAL B 13 17.793 -0.664 7.553 1.00 0.00 H new ATOM 0 HG12 VAL B 13 16.502 -1.060 8.712 1.00 0.00 H new ATOM 0 HG13 VAL B 13 17.282 -2.354 7.772 1.00 0.00 H new ATOM 0 HG21 VAL B 13 17.370 -0.856 5.097 1.00 0.00 H new ATOM 0 HG22 VAL B 13 16.857 -2.546 5.317 1.00 0.00 H new ATOM 0 HG23 VAL B 13 15.776 -1.385 4.508 1.00 0.00 H new ATOM 1200 N ALA B 14 13.313 -0.627 8.285 1.00 0.00 N ATOM 1201 CA ALA B 14 12.631 -0.220 9.547 1.00 0.00 C ATOM 1202 C ALA B 14 11.615 -1.288 9.960 1.00 0.00 C ATOM 1203 O ALA B 14 11.459 -1.593 11.124 1.00 0.00 O ATOM 1204 CB ALA B 14 11.921 1.092 9.206 1.00 0.00 C ATOM 0 H ALA B 14 13.155 -0.009 7.489 1.00 0.00 H new ATOM 0 HA ALA B 14 13.327 -0.102 10.377 1.00 0.00 H new ATOM 0 HB1 ALA B 14 11.393 1.459 10.086 1.00 0.00 H new ATOM 0 HB2 ALA B 14 12.656 1.832 8.889 1.00 0.00 H new ATOM 0 HB3 ALA B 14 11.208 0.921 8.400 1.00 0.00 H new ATOM 1210 N THR B 15 10.925 -1.858 9.009 1.00 0.00 N ATOM 1211 CA THR B 15 9.919 -2.907 9.342 1.00 0.00 C ATOM 1212 C THR B 15 10.621 -4.173 9.837 1.00 0.00 C ATOM 1213 O THR B 15 10.233 -4.764 10.825 1.00 0.00 O ATOM 1214 CB THR B 15 9.183 -3.179 8.028 1.00 0.00 C ATOM 1215 OG1 THR B 15 8.650 -1.961 7.527 1.00 0.00 O ATOM 1216 CG2 THR B 15 8.046 -4.173 8.272 1.00 0.00 C ATOM 0 H THR B 15 11.015 -1.642 8.016 1.00 0.00 H new ATOM 0 HA THR B 15 9.238 -2.592 10.133 1.00 0.00 H new ATOM 0 HB THR B 15 9.879 -3.599 7.302 1.00 0.00 H new ATOM 0 HG1 THR B 15 9.350 -1.469 7.050 1.00 0.00 H new ATOM 0 HG21 THR B 15 7.523 -4.365 7.335 1.00 0.00 H new ATOM 0 HG22 THR B 15 8.455 -5.107 8.657 1.00 0.00 H new ATOM 0 HG23 THR B 15 7.348 -3.756 8.998 1.00 0.00 H new ATOM 1224 N VAL B 16 11.655 -4.593 9.160 1.00 0.00 N ATOM 1225 CA VAL B 16 12.383 -5.820 9.595 1.00 0.00 C ATOM 1226 C VAL B 16 12.984 -5.606 10.986 1.00 0.00 C ATOM 1227 O VAL B 16 12.860 -6.438 11.863 1.00 0.00 O ATOM 1228 CB VAL B 16 13.488 -6.017 8.557 1.00 0.00 C ATOM 1229 CG1 VAL B 16 14.401 -7.164 8.993 1.00 0.00 C ATOM 1230 CG2 VAL B 16 12.858 -6.354 7.203 1.00 0.00 C ATOM 0 H VAL B 16 12.027 -4.140 8.325 1.00 0.00 H new ATOM 0 HA VAL B 16 11.729 -6.689 9.659 1.00 0.00 H new ATOM 0 HB VAL B 16 14.073 -5.101 8.470 1.00 0.00 H new ATOM 0 HG11 VAL B 16 15.188 -7.304 8.252 1.00 0.00 H new ATOM 0 HG12 VAL B 16 14.848 -6.926 9.958 1.00 0.00 H new ATOM 0 HG13 VAL B 16 13.818 -8.081 9.080 1.00 0.00 H new ATOM 0 HG21 VAL B 16 13.644 -6.495 6.461 1.00 0.00 H new ATOM 0 HG22 VAL B 16 12.274 -7.270 7.291 1.00 0.00 H new ATOM 0 HG23 VAL B 16 12.207 -5.537 6.891 1.00 0.00 H new ATOM 1240 N VAL B 17 13.633 -4.493 11.197 1.00 0.00 N ATOM 1241 CA VAL B 17 14.240 -4.224 12.532 1.00 0.00 C ATOM 1242 C VAL B 17 13.151 -4.203 13.608 1.00 0.00 C ATOM 1243 O VAL B 17 13.268 -4.840 14.635 1.00 0.00 O ATOM 1244 CB VAL B 17 14.892 -2.847 12.404 1.00 0.00 C ATOM 1245 CG1 VAL B 17 15.427 -2.406 13.768 1.00 0.00 C ATOM 1246 CG2 VAL B 17 16.046 -2.922 11.403 1.00 0.00 C ATOM 0 H VAL B 17 13.769 -3.758 10.503 1.00 0.00 H new ATOM 0 HA VAL B 17 14.961 -4.989 12.820 1.00 0.00 H new ATOM 0 HB VAL B 17 14.153 -2.126 12.054 1.00 0.00 H new ATOM 0 HG11 VAL B 17 15.892 -1.424 13.676 1.00 0.00 H new ATOM 0 HG12 VAL B 17 14.605 -2.353 14.482 1.00 0.00 H new ATOM 0 HG13 VAL B 17 16.166 -3.126 14.119 1.00 0.00 H new ATOM 0 HG21 VAL B 17 16.512 -1.941 11.311 1.00 0.00 H new ATOM 0 HG22 VAL B 17 16.785 -3.643 11.753 1.00 0.00 H new ATOM 0 HG23 VAL B 17 15.665 -3.236 10.431 1.00 0.00 H new ATOM 1256 N ALA B 18 12.092 -3.476 13.378 1.00 0.00 N ATOM 1257 CA ALA B 18 10.996 -3.414 14.386 1.00 0.00 C ATOM 1258 C ALA B 18 10.466 -4.822 14.675 1.00 0.00 C ATOM 1259 O ALA B 18 10.164 -5.163 15.801 1.00 0.00 O ATOM 1260 CB ALA B 18 9.911 -2.555 13.739 1.00 0.00 C ATOM 0 H ALA B 18 11.938 -2.922 12.535 1.00 0.00 H new ATOM 0 HA ALA B 18 11.331 -2.998 15.336 1.00 0.00 H new ATOM 0 HB1 ALA B 18 9.066 -2.461 14.421 1.00 0.00 H new ATOM 0 HB2 ALA B 18 10.312 -1.565 13.520 1.00 0.00 H new ATOM 0 HB3 ALA B 18 9.579 -3.025 12.813 1.00 0.00 H new ATOM 1266 N ALA B 19 10.353 -5.641 13.665 1.00 0.00 N ATOM 1267 CA ALA B 19 9.845 -7.026 13.883 1.00 0.00 C ATOM 1268 C ALA B 19 10.848 -7.830 14.716 1.00 0.00 C ATOM 1269 O ALA B 19 10.486 -8.519 15.648 1.00 0.00 O ATOM 1270 CB ALA B 19 9.707 -7.624 12.483 1.00 0.00 C ATOM 0 H ALA B 19 10.590 -5.412 12.700 1.00 0.00 H new ATOM 0 HA ALA B 19 8.899 -7.039 14.425 1.00 0.00 H new ATOM 0 HB1 ALA B 19 9.337 -8.646 12.559 1.00 0.00 H new ATOM 0 HB2 ALA B 19 9.006 -7.027 11.900 1.00 0.00 H new ATOM 0 HB3 ALA B 19 10.680 -7.626 11.991 1.00 0.00 H new ATOM 1276 N VAL B 20 12.108 -7.743 14.386 1.00 0.00 N ATOM 1277 CA VAL B 20 13.135 -8.500 15.158 1.00 0.00 C ATOM 1278 C VAL B 20 13.149 -8.032 16.617 1.00 0.00 C ATOM 1279 O VAL B 20 13.248 -8.825 17.532 1.00 0.00 O ATOM 1280 CB VAL B 20 14.463 -8.171 14.476 1.00 0.00 C ATOM 1281 CG1 VAL B 20 15.620 -8.701 15.326 1.00 0.00 C ATOM 1282 CG2 VAL B 20 14.504 -8.832 13.096 1.00 0.00 C ATOM 0 H VAL B 20 12.471 -7.181 13.616 1.00 0.00 H new ATOM 0 HA VAL B 20 12.938 -9.572 15.170 1.00 0.00 H new ATOM 0 HB VAL B 20 14.556 -7.090 14.367 1.00 0.00 H new ATOM 0 HG11 VAL B 20 16.567 -8.466 14.839 1.00 0.00 H new ATOM 0 HG12 VAL B 20 15.592 -8.233 16.310 1.00 0.00 H new ATOM 0 HG13 VAL B 20 15.526 -9.781 15.435 1.00 0.00 H new ATOM 0 HG21 VAL B 20 15.450 -8.598 12.609 1.00 0.00 H new ATOM 0 HG22 VAL B 20 14.410 -9.912 13.207 1.00 0.00 H new ATOM 0 HG23 VAL B 20 13.681 -8.457 12.488 1.00 0.00 H new ATOM 1292 N ASP B 21 13.049 -6.749 16.839 1.00 0.00 N ATOM 1293 CA ASP B 21 13.056 -6.233 18.239 1.00 0.00 C ATOM 1294 C ASP B 21 11.842 -6.766 19.004 1.00 0.00 C ATOM 1295 O ASP B 21 11.925 -7.095 20.170 1.00 0.00 O ATOM 1296 CB ASP B 21 12.976 -4.712 18.101 1.00 0.00 C ATOM 1297 CG ASP B 21 13.943 -4.058 19.090 1.00 0.00 C ATOM 1298 OD1 ASP B 21 15.005 -4.619 19.308 1.00 0.00 O ATOM 1299 OD2 ASP B 21 13.607 -3.008 19.611 1.00 0.00 O ATOM 0 H ASP B 21 12.963 -6.037 16.114 1.00 0.00 H new ATOM 0 HA ASP B 21 13.942 -6.546 18.790 1.00 0.00 H new ATOM 0 HB2 ASP B 21 13.225 -4.415 17.082 1.00 0.00 H new ATOM 0 HB3 ASP B 21 11.958 -4.372 18.292 1.00 0.00 H new ATOM 1304 N GLN B 22 10.712 -6.852 18.356 1.00 0.00 N ATOM 1305 CA GLN B 22 9.491 -7.361 19.045 1.00 0.00 C ATOM 1306 C GLN B 22 9.755 -8.749 19.638 1.00 0.00 C ATOM 1307 O GLN B 22 9.340 -9.053 20.739 1.00 0.00 O ATOM 1308 CB GLN B 22 8.425 -7.437 17.952 1.00 0.00 C ATOM 1309 CG GLN B 22 7.113 -6.845 18.475 1.00 0.00 C ATOM 1310 CD GLN B 22 6.115 -6.719 17.322 1.00 0.00 C ATOM 1311 OE1 GLN B 22 5.753 -7.702 16.707 1.00 0.00 O ATOM 1312 NE2 GLN B 22 5.651 -5.542 17.002 1.00 0.00 N ATOM 0 H GLN B 22 10.581 -6.592 17.378 1.00 0.00 H new ATOM 0 HA GLN B 22 9.184 -6.719 19.871 1.00 0.00 H new ATOM 0 HB2 GLN B 22 8.756 -6.891 17.068 1.00 0.00 H new ATOM 0 HB3 GLN B 22 8.273 -8.473 17.649 1.00 0.00 H new ATOM 0 HG2 GLN B 22 6.701 -7.481 19.259 1.00 0.00 H new ATOM 0 HG3 GLN B 22 7.295 -5.867 18.921 1.00 0.00 H new ATOM 0 HE21 GLN B 22 5.955 -4.716 17.518 1.00 0.00 H new ATOM 0 HE22 GLN B 22 4.985 -5.448 16.236 1.00 0.00 H new ATOM 1321 N ALA B 23 10.439 -9.594 18.916 1.00 0.00 N ATOM 1322 CA ALA B 23 10.726 -10.961 19.443 1.00 0.00 C ATOM 1323 C ALA B 23 11.622 -10.875 20.682 1.00 0.00 C ATOM 1324 O ALA B 23 11.415 -11.566 21.659 1.00 0.00 O ATOM 1325 CB ALA B 23 11.453 -11.680 18.306 1.00 0.00 C ATOM 0 H ALA B 23 10.811 -9.399 17.987 1.00 0.00 H new ATOM 0 HA ALA B 23 9.819 -11.485 19.743 1.00 0.00 H new ATOM 0 HB1 ALA B 23 11.699 -12.695 18.616 1.00 0.00 H new ATOM 0 HB2 ALA B 23 10.809 -11.715 17.427 1.00 0.00 H new ATOM 0 HB3 ALA B 23 12.370 -11.143 18.063 1.00 0.00 H new ATOM 1331 N ARG B 24 12.618 -10.033 20.646 1.00 0.00 N ATOM 1332 CA ARG B 24 13.529 -9.904 21.818 1.00 0.00 C ATOM 1333 C ARG B 24 12.802 -9.228 22.985 1.00 0.00 C ATOM 1334 O ARG B 24 12.834 -9.698 24.105 1.00 0.00 O ATOM 1335 CB ARG B 24 14.682 -9.027 21.327 1.00 0.00 C ATOM 1336 CG ARG B 24 15.942 -9.881 21.166 1.00 0.00 C ATOM 1337 CD ARG B 24 16.337 -10.471 22.522 1.00 0.00 C ATOM 1338 NE ARG B 24 17.250 -9.464 23.129 1.00 0.00 N ATOM 1339 CZ ARG B 24 18.436 -9.263 22.619 1.00 0.00 C ATOM 1340 NH1 ARG B 24 18.823 -9.935 21.568 1.00 0.00 N ATOM 1341 NH2 ARG B 24 19.237 -8.386 23.162 1.00 0.00 N ATOM 0 H ARG B 24 12.840 -9.428 19.855 1.00 0.00 H new ATOM 0 HA ARG B 24 13.876 -10.872 22.179 1.00 0.00 H new ATOM 0 HB2 ARG B 24 14.420 -8.563 20.376 1.00 0.00 H new ATOM 0 HB3 ARG B 24 14.866 -8.219 22.036 1.00 0.00 H new ATOM 0 HG2 ARG B 24 15.762 -10.681 20.448 1.00 0.00 H new ATOM 0 HG3 ARG B 24 16.757 -9.275 20.770 1.00 0.00 H new ATOM 0 HD2 ARG B 24 15.462 -10.639 23.149 1.00 0.00 H new ATOM 0 HD3 ARG B 24 16.834 -11.434 22.404 1.00 0.00 H new ATOM 0 HE ARG B 24 16.949 -8.930 23.944 1.00 0.00 H new ATOM 0 HH11 ARG B 24 18.198 -10.620 21.142 1.00 0.00 H new ATOM 0 HH12 ARG B 24 19.750 -9.775 21.173 1.00 0.00 H new ATOM 0 HH21 ARG B 24 18.936 -7.860 23.982 1.00 0.00 H new ATOM 0 HH22 ARG B 24 20.163 -8.227 22.766 1.00 0.00 H new ATOM 1355 N VAL B 25 12.153 -8.127 22.730 1.00 0.00 N ATOM 1356 CA VAL B 25 11.431 -7.414 23.823 1.00 0.00 C ATOM 1357 C VAL B 25 10.251 -8.252 24.323 1.00 0.00 C ATOM 1358 O VAL B 25 9.811 -8.115 25.447 1.00 0.00 O ATOM 1359 CB VAL B 25 10.947 -6.109 23.183 1.00 0.00 C ATOM 1360 CG1 VAL B 25 9.688 -6.371 22.353 1.00 0.00 C ATOM 1361 CG2 VAL B 25 10.631 -5.092 24.281 1.00 0.00 C ATOM 0 H VAL B 25 12.090 -7.688 21.811 1.00 0.00 H new ATOM 0 HA VAL B 25 12.065 -7.231 24.690 1.00 0.00 H new ATOM 0 HB VAL B 25 11.729 -5.716 22.533 1.00 0.00 H new ATOM 0 HG11 VAL B 25 9.350 -5.439 21.901 1.00 0.00 H new ATOM 0 HG12 VAL B 25 9.913 -7.094 21.569 1.00 0.00 H new ATOM 0 HG13 VAL B 25 8.903 -6.768 22.997 1.00 0.00 H new ATOM 0 HG21 VAL B 25 10.286 -4.163 23.828 1.00 0.00 H new ATOM 0 HG22 VAL B 25 9.852 -5.489 24.932 1.00 0.00 H new ATOM 0 HG23 VAL B 25 11.529 -4.899 24.867 1.00 0.00 H new ATOM 1371 N ARG B 26 9.743 -9.117 23.496 1.00 0.00 N ATOM 1372 CA ARG B 26 8.594 -9.968 23.918 1.00 0.00 C ATOM 1373 C ARG B 26 7.393 -9.092 24.283 1.00 0.00 C ATOM 1374 O ARG B 26 6.979 -9.030 25.424 1.00 0.00 O ATOM 1375 CB ARG B 26 9.099 -10.729 25.145 1.00 0.00 C ATOM 1376 CG ARG B 26 8.202 -11.941 25.403 1.00 0.00 C ATOM 1377 CD ARG B 26 9.031 -13.064 26.032 1.00 0.00 C ATOM 1378 NE ARG B 26 8.052 -14.150 26.322 1.00 0.00 N ATOM 1379 CZ ARG B 26 7.204 -14.024 27.307 1.00 0.00 C ATOM 1380 NH1 ARG B 26 7.204 -12.941 28.039 1.00 0.00 N ATOM 1381 NH2 ARG B 26 6.356 -14.982 27.562 1.00 0.00 N ATOM 0 H ARG B 26 10.072 -9.274 22.543 1.00 0.00 H new ATOM 0 HA ARG B 26 8.264 -10.642 23.127 1.00 0.00 H new ATOM 0 HB2 ARG B 26 10.128 -11.053 24.987 1.00 0.00 H new ATOM 0 HB3 ARG B 26 9.101 -10.074 26.016 1.00 0.00 H new ATOM 0 HG2 ARG B 26 7.381 -11.665 26.065 1.00 0.00 H new ATOM 0 HG3 ARG B 26 7.756 -12.283 24.469 1.00 0.00 H new ATOM 0 HD2 ARG B 26 9.811 -13.407 25.352 1.00 0.00 H new ATOM 0 HD3 ARG B 26 9.527 -12.726 26.942 1.00 0.00 H new ATOM 0 HE ARG B 26 8.044 -14.994 25.749 1.00 0.00 H new ATOM 0 HH11 ARG B 26 7.867 -12.192 27.841 1.00 0.00 H new ATOM 0 HH12 ARG B 26 6.541 -12.845 28.808 1.00 0.00 H new ATOM 0 HH21 ARG B 26 6.356 -15.828 26.992 1.00 0.00 H new ATOM 0 HH22 ARG B 26 5.693 -14.885 28.331 1.00 0.00 H new ATOM 1395 N GLU B 27 6.830 -8.411 23.321 1.00 0.00 N ATOM 1396 CA GLU B 27 5.656 -7.536 23.611 1.00 0.00 C ATOM 1397 C GLU B 27 4.372 -8.175 23.071 1.00 0.00 C ATOM 1398 O GLU B 27 4.317 -8.595 21.932 1.00 0.00 O ATOM 1399 CB GLU B 27 5.948 -6.223 22.884 1.00 0.00 C ATOM 1400 CG GLU B 27 4.726 -5.307 22.976 1.00 0.00 C ATOM 1401 CD GLU B 27 5.183 -3.852 23.091 1.00 0.00 C ATOM 1402 OE1 GLU B 27 5.496 -3.267 22.066 1.00 0.00 O ATOM 1403 OE2 GLU B 27 5.214 -3.347 24.200 1.00 0.00 O ATOM 0 H GLU B 27 7.132 -8.422 22.347 1.00 0.00 H new ATOM 0 HA GLU B 27 5.510 -7.385 24.681 1.00 0.00 H new ATOM 0 HB2 GLU B 27 6.816 -5.735 23.327 1.00 0.00 H new ATOM 0 HB3 GLU B 27 6.191 -6.419 21.840 1.00 0.00 H new ATOM 0 HG2 GLU B 27 4.097 -5.433 22.094 1.00 0.00 H new ATOM 0 HG3 GLU B 27 4.120 -5.578 23.841 1.00 0.00 H new ATOM 1410 N PRO B 28 3.377 -8.222 23.917 1.00 0.00 N ATOM 1411 CA PRO B 28 2.087 -8.824 23.487 1.00 0.00 C ATOM 1412 C PRO B 28 1.279 -7.819 22.660 1.00 0.00 C ATOM 1413 O PRO B 28 1.545 -6.634 22.673 1.00 0.00 O ATOM 1414 CB PRO B 28 1.371 -9.143 24.798 1.00 0.00 C ATOM 1415 CG PRO B 28 1.982 -8.229 25.807 1.00 0.00 C ATOM 1416 CD PRO B 28 3.396 -7.968 25.364 1.00 0.00 C ATOM 0 HA PRO B 28 2.220 -9.705 22.859 1.00 0.00 H new ATOM 0 HB2 PRO B 28 0.298 -8.974 24.712 1.00 0.00 H new ATOM 0 HB3 PRO B 28 1.508 -10.187 25.078 1.00 0.00 H new ATOM 0 HG2 PRO B 28 1.420 -7.297 25.873 1.00 0.00 H new ATOM 0 HG3 PRO B 28 1.966 -8.682 26.798 1.00 0.00 H new ATOM 0 HD2 PRO B 28 3.699 -6.944 25.584 1.00 0.00 H new ATOM 0 HD3 PRO B 28 4.100 -8.625 25.874 1.00 0.00 H new ATOM 1424 N ARG B 29 0.293 -8.283 21.940 1.00 0.00 N ATOM 1425 CA ARG B 29 -0.530 -7.354 21.115 1.00 0.00 C ATOM 1426 C ARG B 29 -1.844 -8.030 20.710 1.00 0.00 C ATOM 1427 O ARG B 29 -2.906 -7.447 20.800 1.00 0.00 O ATOM 1428 CB ARG B 29 0.322 -7.058 19.881 1.00 0.00 C ATOM 1429 CG ARG B 29 -0.285 -5.882 19.112 1.00 0.00 C ATOM 1430 CD ARG B 29 0.829 -5.095 18.418 1.00 0.00 C ATOM 1431 NE ARG B 29 0.474 -5.121 16.972 1.00 0.00 N ATOM 1432 CZ ARG B 29 1.328 -4.698 16.077 1.00 0.00 C ATOM 1433 NH1 ARG B 29 2.496 -4.247 16.447 1.00 0.00 N ATOM 1434 NH2 ARG B 29 1.010 -4.726 14.812 1.00 0.00 N ATOM 0 H ARG B 29 0.022 -9.265 21.888 1.00 0.00 H new ATOM 0 HA ARG B 29 -0.793 -6.445 21.656 1.00 0.00 H new ATOM 0 HB2 ARG B 29 1.344 -6.823 20.179 1.00 0.00 H new ATOM 0 HB3 ARG B 29 0.372 -7.938 19.240 1.00 0.00 H new ATOM 0 HG2 ARG B 29 -1.001 -6.246 18.375 1.00 0.00 H new ATOM 0 HG3 ARG B 29 -0.833 -5.232 19.794 1.00 0.00 H new ATOM 0 HD2 ARG B 29 0.883 -4.073 18.793 1.00 0.00 H new ATOM 0 HD3 ARG B 29 1.803 -5.551 18.594 1.00 0.00 H new ATOM 0 HE ARG B 29 -0.439 -5.470 16.679 1.00 0.00 H new ATOM 0 HH11 ARG B 29 2.744 -4.224 17.436 1.00 0.00 H new ATOM 0 HH12 ARG B 29 3.161 -3.918 15.747 1.00 0.00 H new ATOM 0 HH21 ARG B 29 0.097 -5.077 14.523 1.00 0.00 H new ATOM 0 HH22 ARG B 29 1.674 -4.397 14.112 1.00 0.00 H new TER 1448 ARG B 29