USER MOD reduce.3.24.130724 H: found=0, std=0, add=983, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 982 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HD1:sc= -0.0735 X(o=-0.074,f=-0.32) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ -159:sc= -0.0109 (180deg=-0.157) USER MOD Single : A 7 THR OG1 : rot 180:sc= -6.77! USER MOD Single : A 9 CYS SG : rot 180:sc= -1.13 USER MOD Single : A 13 GLN :FLIP amide:sc= -1.79 F(o=-3.3,f=-1.8) USER MOD Single : A 14 ASN : amide:sc= -1.24 K(o=-1.2,f=-9.1!) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 TYR OH : rot 150:sc= -0.188 USER MOD Single : A 26 SER OG : rot 49:sc= -1.38 USER MOD Single : A 28 HIS : no HD1:sc= -3.4! C(o=-3.4!,f=-3.2!) USER MOD Single : A 32 ASN : amide:sc= -0.318 K(o=-0.32,f=-2.9!) USER MOD Single : A 33 SER OG : rot 180:sc= 0.0479 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -8.13! C(o=-8.1!,f=-15!) USER MOD Single : A 44 GLN : amide:sc= -0.223 X(o=-0.22,f=0) USER MOD Single : A 46 LYS NZ :NH3+ -162:sc= -0.306 (180deg=-0.65) USER MOD Single : A 54 GLN : amide:sc= -1.22 K(o=-1.2,f=-2.6!) USER MOD Single : A 56 THR OG1 : rot 49:sc= 0.00129 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 GLN : amide:sc= -0.141 X(o=-0.14,f=0) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 77 GLN : amide:sc= -0.244 X(o=-0.24,f=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 GLN : amide:sc= -0.0132 X(o=-0.013,f=-0.4) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 ASN : amide:sc= 0 X(o=0,f=-0.042) USER MOD Single : A 91 THR OG1 : rot 63:sc= 1.35 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= -0.0909 X(o=-0.091,f=0) USER MOD Single : A 98 LYS NZ :NH3+ 175:sc= -5.18! (180deg=-6.21!) USER MOD Single : A 100 GLN : amide:sc= -0.245 X(o=-0.24,f=-0.5) USER MOD Single : A 102 THR OG1 : rot 180:sc= -0.157 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0.0488 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 113 THR OG1 : rot 180:sc= -0.0615 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 25.940 11.189 17.038 1.00 0.00 N ATOM 2 CA GLY A 1 26.142 9.717 16.948 1.00 0.00 C ATOM 3 C GLY A 1 26.158 9.049 18.308 1.00 0.00 C ATOM 4 O GLY A 1 27.210 8.628 18.788 1.00 0.00 O ATOM 0 H1 GLY A 1 25.937 11.598 16.082 1.00 0.00 H new ATOM 0 H2 GLY A 1 25.031 11.387 17.502 1.00 0.00 H new ATOM 0 H3 GLY A 1 26.711 11.612 17.593 1.00 0.00 H new ATOM 0 HA2 GLY A 1 25.348 9.281 16.342 1.00 0.00 H new ATOM 0 HA3 GLY A 1 27.082 9.513 16.436 1.00 0.00 H new ATOM 10 N SER A 2 24.988 8.952 18.931 1.00 0.00 N ATOM 11 CA SER A 2 24.870 8.330 20.244 1.00 0.00 C ATOM 12 C SER A 2 24.960 6.811 20.137 1.00 0.00 C ATOM 13 O SER A 2 25.926 6.201 20.600 1.00 0.00 O ATOM 14 CB SER A 2 23.549 8.728 20.905 1.00 0.00 C ATOM 15 OG SER A 2 23.408 8.115 22.175 1.00 0.00 O ATOM 0 H SER A 2 24.108 9.296 18.547 1.00 0.00 H new ATOM 0 HA SER A 2 25.697 8.683 20.860 1.00 0.00 H new ATOM 0 HB2 SER A 2 23.506 9.812 21.014 1.00 0.00 H new ATOM 0 HB3 SER A 2 22.716 8.439 20.264 1.00 0.00 H new ATOM 0 HG SER A 2 22.557 8.387 22.577 1.00 0.00 H new ATOM 21 N HIS A 3 23.949 6.205 19.523 1.00 0.00 N ATOM 22 CA HIS A 3 23.915 4.757 19.355 1.00 0.00 C ATOM 23 C HIS A 3 22.888 4.356 18.302 1.00 0.00 C ATOM 24 O HIS A 3 21.708 4.177 18.607 1.00 0.00 O ATOM 25 CB HIS A 3 23.591 4.076 20.685 1.00 0.00 C ATOM 26 CG HIS A 3 23.928 2.617 20.708 1.00 0.00 C ATOM 27 ND1 HIS A 3 24.998 2.081 20.023 1.00 0.00 N ATOM 28 CD2 HIS A 3 23.329 1.580 21.339 1.00 0.00 C ATOM 29 CE1 HIS A 3 25.041 0.777 20.231 1.00 0.00 C ATOM 30 NE2 HIS A 3 24.041 0.447 21.026 1.00 0.00 N ATOM 0 H HIS A 3 23.143 6.694 19.134 1.00 0.00 H new ATOM 0 HA HIS A 3 24.900 4.432 19.019 1.00 0.00 H new ATOM 0 HB2 HIS A 3 24.136 4.579 21.484 1.00 0.00 H new ATOM 0 HB3 HIS A 3 22.529 4.199 20.897 1.00 0.00 H new ATOM 0 HD2 HIS A 3 22.455 1.633 21.971 1.00 0.00 H new ATOM 0 HE1 HIS A 3 25.771 0.096 19.820 1.00 0.00 H new ATOM 0 HE2 HIS A 3 23.831 -0.495 21.355 1.00 0.00 H new ATOM 39 N MET A 4 23.342 4.216 17.061 1.00 0.00 N ATOM 40 CA MET A 4 22.461 3.835 15.962 1.00 0.00 C ATOM 41 C MET A 4 22.231 2.327 15.951 1.00 0.00 C ATOM 42 O MET A 4 23.160 1.545 16.155 1.00 0.00 O ATOM 43 CB MET A 4 23.056 4.282 14.626 1.00 0.00 C ATOM 44 CG MET A 4 22.132 4.050 13.441 1.00 0.00 C ATOM 45 SD MET A 4 23.013 3.494 11.970 1.00 0.00 S ATOM 46 CE MET A 4 22.876 4.941 10.924 1.00 0.00 C ATOM 0 H MET A 4 24.315 4.361 16.791 1.00 0.00 H new ATOM 0 HA MET A 4 21.501 4.331 16.107 1.00 0.00 H new ATOM 0 HB2 MET A 4 23.301 5.343 14.683 1.00 0.00 H new ATOM 0 HB3 MET A 4 23.991 3.748 14.457 1.00 0.00 H new ATOM 0 HG2 MET A 4 21.380 3.308 13.711 1.00 0.00 H new ATOM 0 HG3 MET A 4 21.601 4.974 13.214 1.00 0.00 H new ATOM 0 HE1 MET A 4 23.375 4.751 9.974 1.00 0.00 H new ATOM 0 HE2 MET A 4 21.824 5.161 10.744 1.00 0.00 H new ATOM 0 HE3 MET A 4 23.346 5.792 11.417 1.00 0.00 H new ATOM 56 N ASP A 5 20.987 1.925 15.712 1.00 0.00 N ATOM 57 CA ASP A 5 20.635 0.511 15.675 1.00 0.00 C ATOM 58 C ASP A 5 19.183 0.318 15.249 1.00 0.00 C ATOM 59 O ASP A 5 18.865 -0.594 14.486 1.00 0.00 O ATOM 60 CB ASP A 5 20.866 -0.129 17.047 1.00 0.00 C ATOM 61 CG ASP A 5 22.210 -0.822 17.144 1.00 0.00 C ATOM 62 OD1 ASP A 5 22.713 -1.292 16.102 1.00 0.00 O ATOM 63 OD2 ASP A 5 22.761 -0.894 18.263 1.00 0.00 O ATOM 0 H ASP A 5 20.206 2.559 15.541 1.00 0.00 H new ATOM 0 HA ASP A 5 21.276 0.024 14.940 1.00 0.00 H new ATOM 0 HB2 ASP A 5 20.800 0.638 17.818 1.00 0.00 H new ATOM 0 HB3 ASP A 5 20.073 -0.850 17.246 1.00 0.00 H new ATOM 68 N LYS A 6 18.304 1.182 15.748 1.00 0.00 N ATOM 69 CA LYS A 6 16.885 1.104 15.422 1.00 0.00 C ATOM 70 C LYS A 6 16.612 1.645 14.021 1.00 0.00 C ATOM 71 O LYS A 6 16.118 2.762 13.861 1.00 0.00 O ATOM 72 CB LYS A 6 16.061 1.881 16.450 1.00 0.00 C ATOM 73 CG LYS A 6 14.560 1.680 16.303 1.00 0.00 C ATOM 74 CD LYS A 6 13.929 1.186 17.596 1.00 0.00 C ATOM 75 CE LYS A 6 13.581 -0.292 17.519 1.00 0.00 C ATOM 76 NZ LYS A 6 12.468 -0.552 16.566 1.00 0.00 N ATOM 0 H LYS A 6 18.550 1.944 16.380 1.00 0.00 H new ATOM 0 HA LYS A 6 16.592 0.054 15.447 1.00 0.00 H new ATOM 0 HB2 LYS A 6 16.364 1.576 17.452 1.00 0.00 H new ATOM 0 HB3 LYS A 6 16.288 2.943 16.358 1.00 0.00 H new ATOM 0 HG2 LYS A 6 14.094 2.620 16.007 1.00 0.00 H new ATOM 0 HG3 LYS A 6 14.365 0.963 15.506 1.00 0.00 H new ATOM 0 HD2 LYS A 6 14.616 1.356 18.425 1.00 0.00 H new ATOM 0 HD3 LYS A 6 13.028 1.762 17.805 1.00 0.00 H new ATOM 0 HE2 LYS A 6 14.461 -0.857 17.212 1.00 0.00 H new ATOM 0 HE3 LYS A 6 13.302 -0.651 18.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 12.026 -1.466 16.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 11.759 0.205 16.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 12.841 -0.576 15.595 1.00 0.00 H new ATOM 90 N THR A 7 16.931 0.843 13.009 1.00 0.00 N ATOM 91 CA THR A 7 16.713 1.238 11.623 1.00 0.00 C ATOM 92 C THR A 7 16.740 0.021 10.707 1.00 0.00 C ATOM 93 O THR A 7 17.658 -0.797 10.771 1.00 0.00 O ATOM 94 CB THR A 7 17.790 2.229 11.199 1.00 0.00 C ATOM 95 OG1 THR A 7 17.580 2.668 9.872 1.00 0.00 O ATOM 96 CG2 THR A 7 19.184 1.650 11.284 1.00 0.00 C ATOM 0 H THR A 7 17.341 -0.084 13.124 1.00 0.00 H new ATOM 0 HA THR A 7 15.733 1.708 11.543 1.00 0.00 H new ATOM 0 HB THR A 7 17.713 3.063 11.896 1.00 0.00 H new ATOM 0 HG1 THR A 7 18.282 3.304 9.623 1.00 0.00 H new ATOM 0 HG21 THR A 7 19.909 2.401 10.970 1.00 0.00 H new ATOM 0 HG22 THR A 7 19.392 1.352 12.312 1.00 0.00 H new ATOM 0 HG23 THR A 7 19.257 0.780 10.632 1.00 0.00 H new ATOM 104 N PHE A 8 15.725 -0.098 9.863 1.00 0.00 N ATOM 105 CA PHE A 8 15.634 -1.229 8.940 1.00 0.00 C ATOM 106 C PHE A 8 14.974 -0.851 7.620 1.00 0.00 C ATOM 107 O PHE A 8 14.042 -0.047 7.587 1.00 0.00 O ATOM 108 CB PHE A 8 14.856 -2.375 9.584 1.00 0.00 C ATOM 109 CG PHE A 8 13.983 -1.938 10.721 1.00 0.00 C ATOM 110 CD1 PHE A 8 14.512 -1.787 11.993 1.00 0.00 C ATOM 111 CD2 PHE A 8 12.636 -1.683 10.519 1.00 0.00 C ATOM 112 CE1 PHE A 8 13.713 -1.389 13.046 1.00 0.00 C ATOM 113 CE2 PHE A 8 11.832 -1.285 11.573 1.00 0.00 C ATOM 114 CZ PHE A 8 12.372 -1.139 12.836 1.00 0.00 C ATOM 0 H PHE A 8 14.956 0.568 9.795 1.00 0.00 H new ATOM 0 HA PHE A 8 16.655 -1.543 8.724 1.00 0.00 H new ATOM 0 HB2 PHE A 8 14.238 -2.856 8.826 1.00 0.00 H new ATOM 0 HB3 PHE A 8 15.560 -3.125 9.944 1.00 0.00 H new ATOM 0 HD1 PHE A 8 15.561 -1.983 12.162 1.00 0.00 H new ATOM 0 HD2 PHE A 8 12.211 -1.796 9.533 1.00 0.00 H new ATOM 0 HE1 PHE A 8 14.137 -1.273 14.033 1.00 0.00 H new ATOM 0 HE2 PHE A 8 10.783 -1.089 11.408 1.00 0.00 H new ATOM 0 HZ PHE A 8 11.745 -0.829 13.659 1.00 0.00 H new ATOM 124 N CYS A 9 15.429 -1.478 6.542 1.00 0.00 N ATOM 125 CA CYS A 9 14.852 -1.247 5.224 1.00 0.00 C ATOM 126 C CYS A 9 13.792 -2.314 4.958 1.00 0.00 C ATOM 127 O CYS A 9 14.105 -3.504 4.906 1.00 0.00 O ATOM 128 CB CYS A 9 15.937 -1.297 4.141 1.00 0.00 C ATOM 129 SG CYS A 9 17.517 -0.566 4.633 1.00 0.00 S ATOM 0 H CYS A 9 16.196 -2.150 6.555 1.00 0.00 H new ATOM 0 HA CYS A 9 14.397 -0.257 5.197 1.00 0.00 H new ATOM 0 HB2 CYS A 9 16.104 -2.336 3.858 1.00 0.00 H new ATOM 0 HB3 CYS A 9 15.572 -0.780 3.254 1.00 0.00 H new ATOM 0 HG CYS A 9 18.364 -0.661 3.651 1.00 0.00 H new ATOM 135 N VAL A 10 12.536 -1.899 4.825 1.00 0.00 N ATOM 136 CA VAL A 10 11.446 -2.848 4.605 1.00 0.00 C ATOM 137 C VAL A 10 10.874 -2.745 3.200 1.00 0.00 C ATOM 138 O VAL A 10 10.902 -1.689 2.581 1.00 0.00 O ATOM 139 CB VAL A 10 10.311 -2.634 5.635 1.00 0.00 C ATOM 140 CG1 VAL A 10 9.084 -1.988 4.998 1.00 0.00 C ATOM 141 CG2 VAL A 10 9.939 -3.945 6.302 1.00 0.00 C ATOM 0 H VAL A 10 12.248 -0.921 4.865 1.00 0.00 H new ATOM 0 HA VAL A 10 11.870 -3.844 4.731 1.00 0.00 H new ATOM 0 HB VAL A 10 10.685 -1.949 6.396 1.00 0.00 H new ATOM 0 HG11 VAL A 10 8.310 -1.854 5.753 1.00 0.00 H new ATOM 0 HG12 VAL A 10 9.358 -1.018 4.583 1.00 0.00 H new ATOM 0 HG13 VAL A 10 8.707 -2.630 4.202 1.00 0.00 H new ATOM 0 HG21 VAL A 10 9.139 -3.773 7.022 1.00 0.00 H new ATOM 0 HG22 VAL A 10 9.600 -4.654 5.547 1.00 0.00 H new ATOM 0 HG23 VAL A 10 10.810 -4.351 6.817 1.00 0.00 H new ATOM 151 N VAL A 11 10.343 -3.854 2.707 1.00 0.00 N ATOM 152 CA VAL A 11 9.757 -3.890 1.382 1.00 0.00 C ATOM 153 C VAL A 11 8.455 -4.687 1.377 1.00 0.00 C ATOM 154 O VAL A 11 8.404 -5.818 1.859 1.00 0.00 O ATOM 155 CB VAL A 11 10.746 -4.483 0.368 1.00 0.00 C ATOM 156 CG1 VAL A 11 11.149 -5.888 0.775 1.00 0.00 C ATOM 157 CG2 VAL A 11 10.169 -4.463 -1.041 1.00 0.00 C ATOM 0 H VAL A 11 10.308 -4.741 3.209 1.00 0.00 H new ATOM 0 HA VAL A 11 9.530 -2.864 1.091 1.00 0.00 H new ATOM 0 HB VAL A 11 11.641 -3.861 0.364 1.00 0.00 H new ATOM 0 HG11 VAL A 11 11.850 -6.291 0.044 1.00 0.00 H new ATOM 0 HG12 VAL A 11 11.623 -5.861 1.756 1.00 0.00 H new ATOM 0 HG13 VAL A 11 10.264 -6.523 0.817 1.00 0.00 H new ATOM 0 HG21 VAL A 11 10.892 -4.889 -1.736 1.00 0.00 H new ATOM 0 HG22 VAL A 11 9.251 -5.050 -1.067 1.00 0.00 H new ATOM 0 HG23 VAL A 11 9.950 -3.435 -1.330 1.00 0.00 H new ATOM 167 N VAL A 12 7.401 -4.078 0.843 1.00 0.00 N ATOM 168 CA VAL A 12 6.089 -4.713 0.788 1.00 0.00 C ATOM 169 C VAL A 12 5.833 -5.373 -0.560 1.00 0.00 C ATOM 170 O VAL A 12 5.543 -4.697 -1.546 1.00 0.00 O ATOM 171 CB VAL A 12 4.969 -3.691 1.046 1.00 0.00 C ATOM 172 CG1 VAL A 12 5.033 -3.182 2.475 1.00 0.00 C ATOM 173 CG2 VAL A 12 5.057 -2.537 0.055 1.00 0.00 C ATOM 0 H VAL A 12 7.431 -3.141 0.441 1.00 0.00 H new ATOM 0 HA VAL A 12 6.085 -5.476 1.566 1.00 0.00 H new ATOM 0 HB VAL A 12 4.009 -4.187 0.903 1.00 0.00 H new ATOM 0 HG11 VAL A 12 4.233 -2.460 2.640 1.00 0.00 H new ATOM 0 HG12 VAL A 12 4.915 -4.018 3.165 1.00 0.00 H new ATOM 0 HG13 VAL A 12 5.996 -2.702 2.648 1.00 0.00 H new ATOM 0 HG21 VAL A 12 4.256 -1.825 0.254 1.00 0.00 H new ATOM 0 HG22 VAL A 12 6.021 -2.039 0.161 1.00 0.00 H new ATOM 0 HG23 VAL A 12 4.957 -2.921 -0.960 1.00 0.00 H new ATOM 183 N GLN A 13 5.918 -6.696 -0.589 1.00 0.00 N ATOM 184 CA GLN A 13 5.671 -7.447 -1.814 1.00 0.00 C ATOM 185 C GLN A 13 4.210 -7.875 -1.878 1.00 0.00 C ATOM 186 O GLN A 13 3.786 -8.771 -1.146 1.00 0.00 O ATOM 187 CB GLN A 13 6.583 -8.674 -1.882 1.00 0.00 C ATOM 188 CG GLN A 13 6.782 -9.210 -3.290 1.00 0.00 C ATOM 189 CD GLN A 13 5.557 -9.933 -3.817 1.00 0.00 C ATOM 190 OE1 GLN A 13 4.628 -9.181 -4.393 1.00 0.00 O flip ATOM 191 NE2 GLN A 13 5.449 -11.155 -3.706 1.00 0.00 N flip ATOM 0 H GLN A 13 6.155 -7.271 0.219 1.00 0.00 H new ATOM 0 HA GLN A 13 5.890 -6.805 -2.667 1.00 0.00 H new ATOM 0 HB2 GLN A 13 7.555 -8.417 -1.460 1.00 0.00 H new ATOM 0 HB3 GLN A 13 6.163 -9.463 -1.258 1.00 0.00 H new ATOM 0 HG2 GLN A 13 7.027 -8.384 -3.958 1.00 0.00 H new ATOM 0 HG3 GLN A 13 7.633 -9.891 -3.299 1.00 0.00 H new ATOM 0 HE21 GLN A 13 6.189 -11.694 -3.255 1.00 0.00 H new ATOM 0 HE22 GLN A 13 4.620 -11.628 -4.065 1.00 0.00 H new ATOM 200 N ASN A 14 3.434 -7.225 -2.742 1.00 0.00 N ATOM 201 CA ASN A 14 2.017 -7.543 -2.871 1.00 0.00 C ATOM 202 C ASN A 14 1.717 -8.323 -4.141 1.00 0.00 C ATOM 203 O ASN A 14 1.960 -7.849 -5.250 1.00 0.00 O ATOM 204 CB ASN A 14 1.163 -6.270 -2.858 1.00 0.00 C ATOM 205 CG ASN A 14 1.444 -5.365 -4.042 1.00 0.00 C ATOM 206 OD1 ASN A 14 2.597 -5.143 -4.411 1.00 0.00 O ATOM 207 ND2 ASN A 14 0.383 -4.837 -4.642 1.00 0.00 N ATOM 0 H ASN A 14 3.761 -6.481 -3.358 1.00 0.00 H new ATOM 0 HA ASN A 14 1.764 -8.165 -2.013 1.00 0.00 H new ATOM 0 HB2 ASN A 14 0.108 -6.545 -2.858 1.00 0.00 H new ATOM 0 HB3 ASN A 14 1.349 -5.722 -1.935 1.00 0.00 H new ATOM 0 HD21 ASN A 14 0.506 -4.219 -5.444 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -0.554 -5.050 -4.301 1.00 0.00 H new ATOM 214 N ARG A 15 1.141 -9.503 -3.965 1.00 0.00 N ATOM 215 CA ARG A 15 0.747 -10.338 -5.087 1.00 0.00 C ATOM 216 C ARG A 15 -0.771 -10.276 -5.232 1.00 0.00 C ATOM 217 O ARG A 15 -1.407 -11.203 -5.732 1.00 0.00 O ATOM 218 CB ARG A 15 1.206 -11.783 -4.874 1.00 0.00 C ATOM 219 CG ARG A 15 2.250 -12.244 -5.879 1.00 0.00 C ATOM 220 CD ARG A 15 2.995 -13.473 -5.385 1.00 0.00 C ATOM 221 NE ARG A 15 2.084 -14.520 -4.929 1.00 0.00 N ATOM 222 CZ ARG A 15 2.481 -15.629 -4.308 1.00 0.00 C ATOM 223 NH1 ARG A 15 3.769 -15.839 -4.067 1.00 0.00 N ATOM 224 NH2 ARG A 15 1.586 -16.530 -3.928 1.00 0.00 N ATOM 0 H ARG A 15 0.936 -9.904 -3.050 1.00 0.00 H new ATOM 0 HA ARG A 15 1.220 -9.971 -5.998 1.00 0.00 H new ATOM 0 HB2 ARG A 15 1.614 -11.881 -3.868 1.00 0.00 H new ATOM 0 HB3 ARG A 15 0.340 -12.443 -4.933 1.00 0.00 H new ATOM 0 HG2 ARG A 15 1.767 -12.468 -6.830 1.00 0.00 H new ATOM 0 HG3 ARG A 15 2.959 -11.437 -6.064 1.00 0.00 H new ATOM 0 HD2 ARG A 15 3.623 -13.863 -6.186 1.00 0.00 H new ATOM 0 HD3 ARG A 15 3.660 -13.190 -4.569 1.00 0.00 H new ATOM 0 HE ARG A 15 1.086 -14.394 -5.096 1.00 0.00 H new ATOM 0 HH11 ARG A 15 4.461 -15.149 -4.358 1.00 0.00 H new ATOM 0 HH12 ARG A 15 4.067 -16.691 -3.591 1.00 0.00 H new ATOM 0 HH21 ARG A 15 0.595 -16.373 -4.111 1.00 0.00 H new ATOM 0 HH22 ARG A 15 1.888 -17.380 -3.452 1.00 0.00 H new ATOM 238 N ILE A 16 -1.337 -9.165 -4.759 1.00 0.00 N ATOM 239 CA ILE A 16 -2.773 -8.937 -4.790 1.00 0.00 C ATOM 240 C ILE A 16 -3.213 -8.302 -6.109 1.00 0.00 C ATOM 241 O ILE A 16 -4.022 -8.873 -6.841 1.00 0.00 O ATOM 242 CB ILE A 16 -3.193 -8.036 -3.605 1.00 0.00 C ATOM 243 CG1 ILE A 16 -2.923 -8.750 -2.279 1.00 0.00 C ATOM 244 CG2 ILE A 16 -4.657 -7.633 -3.704 1.00 0.00 C ATOM 245 CD1 ILE A 16 -2.318 -7.851 -1.223 1.00 0.00 C ATOM 0 H ILE A 16 -0.807 -8.399 -4.344 1.00 0.00 H new ATOM 0 HA ILE A 16 -3.266 -9.905 -4.703 1.00 0.00 H new ATOM 0 HB ILE A 16 -2.596 -7.125 -3.646 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -3.858 -9.163 -1.901 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -2.252 -9.590 -2.458 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -4.918 -7.001 -2.856 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -4.821 -7.083 -4.631 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -5.282 -8.526 -3.697 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -2.153 -8.422 -0.310 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -1.367 -7.458 -1.582 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -2.998 -7.024 -1.016 1.00 0.00 H new ATOM 257 N LYS A 17 -2.683 -7.119 -6.407 1.00 0.00 N ATOM 258 CA LYS A 17 -3.036 -6.419 -7.637 1.00 0.00 C ATOM 259 C LYS A 17 -2.234 -5.125 -7.784 1.00 0.00 C ATOM 260 O LYS A 17 -1.326 -4.856 -6.997 1.00 0.00 O ATOM 261 CB LYS A 17 -4.533 -6.104 -7.649 1.00 0.00 C ATOM 262 CG LYS A 17 -4.970 -5.192 -6.515 1.00 0.00 C ATOM 263 CD LYS A 17 -6.398 -4.708 -6.705 1.00 0.00 C ATOM 264 CE LYS A 17 -6.904 -3.972 -5.475 1.00 0.00 C ATOM 265 NZ LYS A 17 -8.385 -4.061 -5.345 1.00 0.00 N ATOM 0 H LYS A 17 -2.011 -6.628 -5.817 1.00 0.00 H new ATOM 0 HA LYS A 17 -2.795 -7.069 -8.478 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -4.790 -5.637 -8.600 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -5.093 -7.037 -7.590 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -4.889 -5.724 -5.567 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -4.299 -4.335 -6.458 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -6.448 -4.048 -7.571 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -7.047 -5.558 -6.914 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -6.436 -4.390 -4.584 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -6.607 -2.925 -5.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -8.690 -3.547 -4.494 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -8.833 -3.640 -6.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -8.667 -5.059 -5.266 1.00 0.00 H new ATOM 279 N GLU A 18 -2.580 -4.324 -8.793 1.00 0.00 N ATOM 280 CA GLU A 18 -1.895 -3.057 -9.036 1.00 0.00 C ATOM 281 C GLU A 18 -2.832 -1.875 -8.797 1.00 0.00 C ATOM 282 O GLU A 18 -2.528 -0.743 -9.177 1.00 0.00 O ATOM 283 CB GLU A 18 -1.352 -3.010 -10.466 1.00 0.00 C ATOM 284 CG GLU A 18 -2.437 -3.029 -11.530 1.00 0.00 C ATOM 285 CD GLU A 18 -1.901 -3.386 -12.903 1.00 0.00 C ATOM 286 OE1 GLU A 18 -1.063 -2.623 -13.429 1.00 0.00 O ATOM 287 OE2 GLU A 18 -2.319 -4.426 -13.451 1.00 0.00 O ATOM 0 H GLU A 18 -3.329 -4.531 -9.453 1.00 0.00 H new ATOM 0 HA GLU A 18 -1.062 -2.985 -8.336 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -0.751 -2.109 -10.588 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -0.687 -3.860 -10.621 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -3.206 -3.747 -11.246 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -2.915 -2.050 -11.574 1.00 0.00 H new ATOM 294 N GLY A 19 -3.971 -2.144 -8.165 1.00 0.00 N ATOM 295 CA GLY A 19 -4.934 -1.096 -7.886 1.00 0.00 C ATOM 296 C GLY A 19 -4.925 -0.677 -6.429 1.00 0.00 C ATOM 297 O GLY A 19 -5.373 0.419 -6.090 1.00 0.00 O ATOM 0 H GLY A 19 -4.244 -3.072 -7.841 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -4.717 -0.230 -8.512 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -5.932 -1.442 -8.156 1.00 0.00 H new ATOM 301 N TYR A 20 -4.406 -1.545 -5.564 1.00 0.00 N ATOM 302 CA TYR A 20 -4.334 -1.252 -4.144 1.00 0.00 C ATOM 303 C TYR A 20 -3.328 -0.153 -3.898 1.00 0.00 C ATOM 304 O TYR A 20 -2.120 -0.386 -3.885 1.00 0.00 O ATOM 305 CB TYR A 20 -3.973 -2.509 -3.350 1.00 0.00 C ATOM 306 CG TYR A 20 -4.451 -2.480 -1.917 1.00 0.00 C ATOM 307 CD1 TYR A 20 -5.725 -2.026 -1.596 1.00 0.00 C ATOM 308 CD2 TYR A 20 -3.628 -2.908 -0.883 1.00 0.00 C ATOM 309 CE1 TYR A 20 -6.163 -1.999 -0.285 1.00 0.00 C ATOM 310 CE2 TYR A 20 -4.059 -2.884 0.430 1.00 0.00 C ATOM 311 CZ TYR A 20 -5.327 -2.427 0.723 1.00 0.00 C ATOM 312 OH TYR A 20 -5.760 -2.402 2.028 1.00 0.00 O ATOM 0 H TYR A 20 -4.030 -2.456 -5.827 1.00 0.00 H new ATOM 0 HA TYR A 20 -5.312 -0.913 -3.804 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -4.401 -3.379 -3.849 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -2.890 -2.636 -3.360 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -6.383 -1.689 -2.383 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -2.634 -3.266 -1.109 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -7.156 -1.644 -0.052 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -3.407 -3.221 1.222 1.00 0.00 H new ATOM 0 HH TYR A 20 -5.324 -3.121 2.531 1.00 0.00 H new ATOM 322 N ARG A 21 -3.847 1.054 -3.746 1.00 0.00 N ATOM 323 CA ARG A 21 -3.016 2.226 -3.544 1.00 0.00 C ATOM 324 C ARG A 21 -3.876 3.463 -3.310 1.00 0.00 C ATOM 325 O ARG A 21 -5.104 3.379 -3.287 1.00 0.00 O ATOM 326 CB ARG A 21 -2.157 2.412 -4.783 1.00 0.00 C ATOM 327 CG ARG A 21 -2.967 2.701 -6.035 1.00 0.00 C ATOM 328 CD ARG A 21 -2.139 2.507 -7.295 1.00 0.00 C ATOM 329 NE ARG A 21 -2.799 3.063 -8.474 1.00 0.00 N ATOM 330 CZ ARG A 21 -2.493 2.723 -9.724 1.00 0.00 C ATOM 331 NH1 ARG A 21 -1.542 1.828 -9.963 1.00 0.00 N ATOM 332 NH2 ARG A 21 -3.141 3.278 -10.739 1.00 0.00 N ATOM 0 H ARG A 21 -4.848 1.247 -3.759 1.00 0.00 H new ATOM 0 HA ARG A 21 -2.388 2.088 -2.664 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -1.458 3.231 -4.613 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -1.562 1.513 -4.943 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -3.837 2.045 -6.066 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -3.341 3.724 -5.999 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -1.166 2.982 -7.166 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -1.957 1.443 -7.449 1.00 0.00 H new ATOM 0 HE ARG A 21 -3.537 3.752 -8.331 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -1.041 1.396 -9.186 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -1.312 1.572 -10.923 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -3.874 3.965 -10.562 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -2.907 3.018 -11.697 1.00 0.00 H new ATOM 346 N ARG A 22 -3.232 4.613 -3.148 1.00 0.00 N ATOM 347 CA ARG A 22 -3.957 5.856 -2.931 1.00 0.00 C ATOM 348 C ARG A 22 -4.544 6.359 -4.243 1.00 0.00 C ATOM 349 O ARG A 22 -5.733 6.667 -4.330 1.00 0.00 O ATOM 350 CB ARG A 22 -3.045 6.923 -2.323 1.00 0.00 C ATOM 351 CG ARG A 22 -2.864 6.782 -0.819 1.00 0.00 C ATOM 352 CD ARG A 22 -3.546 7.913 -0.064 1.00 0.00 C ATOM 353 NE ARG A 22 -2.900 9.200 -0.307 1.00 0.00 N ATOM 354 CZ ARG A 22 -3.033 10.259 0.488 1.00 0.00 C ATOM 355 NH1 ARG A 22 -3.788 10.190 1.577 1.00 0.00 N ATOM 356 NH2 ARG A 22 -2.407 11.390 0.195 1.00 0.00 N ATOM 0 H ARG A 22 -2.217 4.709 -3.163 1.00 0.00 H new ATOM 0 HA ARG A 22 -4.768 5.657 -2.230 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -2.069 6.872 -2.805 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -3.457 7.908 -2.541 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -3.273 5.826 -0.491 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -1.801 6.773 -0.579 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -4.592 7.970 -0.364 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -3.532 7.696 1.004 1.00 0.00 H new ATOM 0 HE ARG A 22 -2.312 9.293 -1.135 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -4.270 9.322 1.809 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -3.886 11.005 2.182 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -1.824 11.449 -0.640 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -2.509 12.202 0.804 1.00 0.00 H new ATOM 370 N ALA A 23 -3.696 6.429 -5.262 1.00 0.00 N ATOM 371 CA ALA A 23 -4.112 6.884 -6.583 1.00 0.00 C ATOM 372 C ALA A 23 -2.948 6.816 -7.564 1.00 0.00 C ATOM 373 O ALA A 23 -2.819 7.662 -8.449 1.00 0.00 O ATOM 374 CB ALA A 23 -4.662 8.301 -6.510 1.00 0.00 C ATOM 0 H ALA A 23 -2.710 6.175 -5.198 1.00 0.00 H new ATOM 0 HA ALA A 23 -4.903 6.224 -6.940 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -4.968 8.624 -7.505 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -5.522 8.323 -5.841 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -3.891 8.972 -6.132 1.00 0.00 H new ATOM 380 N GLY A 24 -2.095 5.809 -7.396 1.00 0.00 N ATOM 381 CA GLY A 24 -0.948 5.659 -8.268 1.00 0.00 C ATOM 382 C GLY A 24 0.295 6.316 -7.700 1.00 0.00 C ATOM 383 O GLY A 24 1.272 6.534 -8.418 1.00 0.00 O ATOM 0 H GLY A 24 -2.179 5.096 -6.672 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -0.754 4.599 -8.431 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -1.174 6.095 -9.241 1.00 0.00 H new ATOM 387 N PHE A 25 0.261 6.630 -6.407 1.00 0.00 N ATOM 388 CA PHE A 25 1.395 7.262 -5.746 1.00 0.00 C ATOM 389 C PHE A 25 1.481 6.822 -4.290 1.00 0.00 C ATOM 390 O PHE A 25 1.697 7.639 -3.393 1.00 0.00 O ATOM 391 CB PHE A 25 1.283 8.788 -5.835 1.00 0.00 C ATOM 392 CG PHE A 25 0.204 9.369 -4.966 1.00 0.00 C ATOM 393 CD1 PHE A 25 -1.116 8.975 -5.118 1.00 0.00 C ATOM 394 CD2 PHE A 25 0.511 10.310 -3.996 1.00 0.00 C ATOM 395 CE1 PHE A 25 -2.110 9.508 -4.318 1.00 0.00 C ATOM 396 CE2 PHE A 25 -0.478 10.848 -3.194 1.00 0.00 C ATOM 397 CZ PHE A 25 -1.790 10.446 -3.355 1.00 0.00 C ATOM 0 H PHE A 25 -0.539 6.457 -5.799 1.00 0.00 H new ATOM 0 HA PHE A 25 2.307 6.949 -6.255 1.00 0.00 H new ATOM 0 HB2 PHE A 25 2.239 9.230 -5.555 1.00 0.00 H new ATOM 0 HB3 PHE A 25 1.093 9.069 -6.871 1.00 0.00 H new ATOM 0 HD1 PHE A 25 -1.371 8.243 -5.870 1.00 0.00 H new ATOM 0 HD2 PHE A 25 1.535 10.627 -3.865 1.00 0.00 H new ATOM 0 HE1 PHE A 25 -3.135 9.192 -4.446 1.00 0.00 H new ATOM 0 HE2 PHE A 25 -0.225 11.582 -2.443 1.00 0.00 H new ATOM 0 HZ PHE A 25 -2.564 10.864 -2.729 1.00 0.00 H new ATOM 407 N SER A 26 1.303 5.526 -4.062 1.00 0.00 N ATOM 408 CA SER A 26 1.355 4.974 -2.715 1.00 0.00 C ATOM 409 C SER A 26 1.610 3.473 -2.736 1.00 0.00 C ATOM 410 O SER A 26 2.333 2.949 -1.889 1.00 0.00 O ATOM 411 CB SER A 26 0.052 5.269 -1.972 1.00 0.00 C ATOM 412 OG SER A 26 0.261 6.210 -0.934 1.00 0.00 O ATOM 0 H SER A 26 1.121 4.838 -4.793 1.00 0.00 H new ATOM 0 HA SER A 26 2.185 5.451 -2.194 1.00 0.00 H new ATOM 0 HB2 SER A 26 -0.691 5.653 -2.671 1.00 0.00 H new ATOM 0 HB3 SER A 26 -0.350 4.346 -1.555 1.00 0.00 H new ATOM 0 HG SER A 26 0.764 6.975 -1.283 1.00 0.00 H new ATOM 418 N PHE A 27 1.010 2.781 -3.698 1.00 0.00 N ATOM 419 CA PHE A 27 1.177 1.340 -3.798 1.00 0.00 C ATOM 420 C PHE A 27 0.928 0.841 -5.219 1.00 0.00 C ATOM 421 O PHE A 27 0.274 1.508 -6.020 1.00 0.00 O ATOM 422 CB PHE A 27 0.230 0.647 -2.820 1.00 0.00 C ATOM 423 CG PHE A 27 0.513 0.977 -1.382 1.00 0.00 C ATOM 424 CD1 PHE A 27 1.678 0.540 -0.774 1.00 0.00 C ATOM 425 CD2 PHE A 27 -0.386 1.728 -0.638 1.00 0.00 C ATOM 426 CE1 PHE A 27 1.944 0.843 0.547 1.00 0.00 C ATOM 427 CE2 PHE A 27 -0.125 2.034 0.684 1.00 0.00 C ATOM 428 CZ PHE A 27 1.041 1.591 1.278 1.00 0.00 C ATOM 0 H PHE A 27 0.409 3.192 -4.413 1.00 0.00 H new ATOM 0 HA PHE A 27 2.209 1.098 -3.543 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -0.796 0.931 -3.055 1.00 0.00 H new ATOM 0 HB3 PHE A 27 0.302 -0.432 -2.959 1.00 0.00 H new ATOM 0 HD1 PHE A 27 2.388 -0.045 -1.340 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -1.299 2.077 -1.097 1.00 0.00 H new ATOM 0 HE1 PHE A 27 2.857 0.496 1.008 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -0.832 2.619 1.253 1.00 0.00 H new ATOM 0 HZ PHE A 27 1.246 1.829 2.311 1.00 0.00 H new ATOM 438 N HIS A 28 1.459 -0.342 -5.520 1.00 0.00 N ATOM 439 CA HIS A 28 1.307 -0.952 -6.838 1.00 0.00 C ATOM 440 C HIS A 28 1.570 -2.452 -6.762 1.00 0.00 C ATOM 441 O HIS A 28 1.980 -2.964 -5.721 1.00 0.00 O ATOM 442 CB HIS A 28 2.274 -0.317 -7.843 1.00 0.00 C ATOM 443 CG HIS A 28 2.350 1.176 -7.755 1.00 0.00 C ATOM 444 ND1 HIS A 28 1.577 2.018 -8.528 1.00 0.00 N ATOM 445 CD2 HIS A 28 3.113 1.980 -6.976 1.00 0.00 C ATOM 446 CE1 HIS A 28 1.863 3.273 -8.230 1.00 0.00 C ATOM 447 NE2 HIS A 28 2.791 3.277 -7.290 1.00 0.00 N ATOM 0 H HIS A 28 2.003 -0.901 -4.862 1.00 0.00 H new ATOM 0 HA HIS A 28 0.284 -0.781 -7.172 1.00 0.00 H new ATOM 0 HB2 HIS A 28 3.270 -0.731 -7.685 1.00 0.00 H new ATOM 0 HB3 HIS A 28 1.969 -0.596 -8.851 1.00 0.00 H new ATOM 0 HD2 HIS A 28 3.840 1.660 -6.244 1.00 0.00 H new ATOM 0 HE1 HIS A 28 1.414 4.147 -8.679 1.00 0.00 H new ATOM 0 HE2 HIS A 28 3.202 4.109 -6.866 1.00 0.00 H new ATOM 456 N LEU A 29 1.338 -3.150 -7.868 1.00 0.00 N ATOM 457 CA LEU A 29 1.561 -4.589 -7.917 1.00 0.00 C ATOM 458 C LEU A 29 3.048 -4.899 -8.013 1.00 0.00 C ATOM 459 O LEU A 29 3.644 -4.820 -9.087 1.00 0.00 O ATOM 460 CB LEU A 29 0.826 -5.205 -9.107 1.00 0.00 C ATOM 461 CG LEU A 29 0.855 -6.733 -9.168 1.00 0.00 C ATOM 462 CD1 LEU A 29 0.417 -7.332 -7.842 1.00 0.00 C ATOM 463 CD2 LEU A 29 -0.032 -7.233 -10.295 1.00 0.00 C ATOM 0 H LEU A 29 0.997 -2.744 -8.739 1.00 0.00 H new ATOM 0 HA LEU A 29 1.170 -5.023 -6.997 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -0.213 -4.878 -9.081 1.00 0.00 H new ATOM 0 HB3 LEU A 29 1.261 -4.812 -10.026 1.00 0.00 H new ATOM 0 HG LEU A 29 1.879 -7.050 -9.364 1.00 0.00 H new ATOM 0 HD11 LEU A 29 0.445 -8.420 -7.907 1.00 0.00 H new ATOM 0 HD12 LEU A 29 1.090 -6.998 -7.052 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -0.599 -7.008 -7.614 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -0.001 -8.322 -10.326 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -1.057 -6.904 -10.125 1.00 0.00 H new ATOM 0 HD23 LEU A 29 0.325 -6.833 -11.244 1.00 0.00 H new ATOM 475 N GLY A 30 3.641 -5.247 -6.880 1.00 0.00 N ATOM 476 CA GLY A 30 5.055 -5.562 -6.847 1.00 0.00 C ATOM 477 C GLY A 30 5.635 -5.448 -5.453 1.00 0.00 C ATOM 478 O GLY A 30 5.001 -5.843 -4.475 1.00 0.00 O ATOM 0 H GLY A 30 3.166 -5.317 -5.980 1.00 0.00 H new ATOM 0 HA2 GLY A 30 5.209 -6.574 -7.221 1.00 0.00 H new ATOM 0 HA3 GLY A 30 5.591 -4.890 -7.517 1.00 0.00 H new ATOM 482 N ASP A 31 6.844 -4.909 -5.362 1.00 0.00 N ATOM 483 CA ASP A 31 7.509 -4.746 -4.075 1.00 0.00 C ATOM 484 C ASP A 31 8.169 -3.378 -3.968 1.00 0.00 C ATOM 485 O ASP A 31 9.013 -3.015 -4.788 1.00 0.00 O ATOM 486 CB ASP A 31 8.553 -5.844 -3.865 1.00 0.00 C ATOM 487 CG ASP A 31 9.308 -6.185 -5.137 1.00 0.00 C ATOM 488 OD1 ASP A 31 8.676 -6.703 -6.081 1.00 0.00 O ATOM 489 OD2 ASP A 31 10.530 -5.932 -5.188 1.00 0.00 O ATOM 0 H ASP A 31 7.383 -4.578 -6.162 1.00 0.00 H new ATOM 0 HA ASP A 31 6.749 -4.825 -3.297 1.00 0.00 H new ATOM 0 HB2 ASP A 31 9.262 -5.524 -3.101 1.00 0.00 H new ATOM 0 HB3 ASP A 31 8.061 -6.740 -3.488 1.00 0.00 H new ATOM 494 N ASN A 32 7.785 -2.626 -2.943 1.00 0.00 N ATOM 495 CA ASN A 32 8.344 -1.301 -2.713 1.00 0.00 C ATOM 496 C ASN A 32 9.285 -1.337 -1.518 1.00 0.00 C ATOM 497 O ASN A 32 8.880 -1.714 -0.421 1.00 0.00 O ATOM 498 CB ASN A 32 7.225 -0.285 -2.471 1.00 0.00 C ATOM 499 CG ASN A 32 7.478 1.034 -3.173 1.00 0.00 C ATOM 500 OD1 ASN A 32 8.376 1.145 -4.007 1.00 0.00 O ATOM 501 ND2 ASN A 32 6.685 2.044 -2.836 1.00 0.00 N ATOM 0 H ASN A 32 7.087 -2.913 -2.257 1.00 0.00 H new ATOM 0 HA ASN A 32 8.903 -0.997 -3.598 1.00 0.00 H new ATOM 0 HB2 ASN A 32 6.279 -0.702 -2.817 1.00 0.00 H new ATOM 0 HB3 ASN A 32 7.123 -0.109 -1.400 1.00 0.00 H new ATOM 0 HD21 ASN A 32 6.808 2.957 -3.274 1.00 0.00 H new ATOM 0 HD22 ASN A 32 5.953 1.907 -2.139 1.00 0.00 H new ATOM 508 N SER A 33 10.540 -0.956 -1.731 1.00 0.00 N ATOM 509 CA SER A 33 11.522 -0.970 -0.654 1.00 0.00 C ATOM 510 C SER A 33 11.495 0.321 0.141 1.00 0.00 C ATOM 511 O SER A 33 11.258 1.403 -0.396 1.00 0.00 O ATOM 512 CB SER A 33 12.932 -1.202 -1.188 1.00 0.00 C ATOM 513 OG SER A 33 13.085 -0.662 -2.489 1.00 0.00 O ATOM 0 H SER A 33 10.899 -0.637 -2.631 1.00 0.00 H new ATOM 0 HA SER A 33 11.251 -1.796 0.004 1.00 0.00 H new ATOM 0 HB2 SER A 33 13.658 -0.746 -0.515 1.00 0.00 H new ATOM 0 HB3 SER A 33 13.144 -2.271 -1.208 1.00 0.00 H new ATOM 0 HG SER A 33 13.998 -0.824 -2.805 1.00 0.00 H new ATOM 519 N LEU A 34 11.744 0.183 1.432 1.00 0.00 N ATOM 520 CA LEU A 34 11.757 1.312 2.343 1.00 0.00 C ATOM 521 C LEU A 34 13.149 1.486 2.950 1.00 0.00 C ATOM 522 O LEU A 34 13.803 0.509 3.307 1.00 0.00 O ATOM 523 CB LEU A 34 10.698 1.097 3.441 1.00 0.00 C ATOM 524 CG LEU A 34 10.726 2.066 4.611 1.00 0.00 C ATOM 525 CD1 LEU A 34 11.671 1.531 5.667 1.00 0.00 C ATOM 526 CD2 LEU A 34 11.119 3.474 4.180 1.00 0.00 C ATOM 0 H LEU A 34 11.942 -0.713 1.876 1.00 0.00 H new ATOM 0 HA LEU A 34 11.514 2.223 1.797 1.00 0.00 H new ATOM 0 HB2 LEU A 34 9.712 1.149 2.979 1.00 0.00 H new ATOM 0 HB3 LEU A 34 10.813 0.086 3.833 1.00 0.00 H new ATOM 0 HG LEU A 34 9.721 2.144 5.025 1.00 0.00 H new ATOM 0 HD11 LEU A 34 11.699 2.219 6.512 1.00 0.00 H new ATOM 0 HD12 LEU A 34 11.324 0.555 6.005 1.00 0.00 H new ATOM 0 HD13 LEU A 34 12.671 1.434 5.245 1.00 0.00 H new ATOM 0 HD21 LEU A 34 11.126 4.132 5.049 1.00 0.00 H new ATOM 0 HD22 LEU A 34 12.113 3.454 3.733 1.00 0.00 H new ATOM 0 HD23 LEU A 34 10.400 3.845 3.450 1.00 0.00 H new ATOM 538 N ALA A 35 13.592 2.735 3.068 1.00 0.00 N ATOM 539 CA ALA A 35 14.893 3.045 3.635 1.00 0.00 C ATOM 540 C ALA A 35 14.887 2.781 5.129 1.00 0.00 C ATOM 541 O ALA A 35 13.839 2.756 5.756 1.00 0.00 O ATOM 542 CB ALA A 35 15.268 4.486 3.352 1.00 0.00 C ATOM 0 H ALA A 35 13.059 3.554 2.774 1.00 0.00 H new ATOM 0 HA ALA A 35 15.639 2.401 3.169 1.00 0.00 H new ATOM 0 HB1 ALA A 35 16.246 4.699 3.785 1.00 0.00 H new ATOM 0 HB2 ALA A 35 15.305 4.648 2.275 1.00 0.00 H new ATOM 0 HB3 ALA A 35 14.524 5.149 3.793 1.00 0.00 H new ATOM 548 N ALA A 36 16.054 2.560 5.692 1.00 0.00 N ATOM 549 CA ALA A 36 16.152 2.252 7.111 1.00 0.00 C ATOM 550 C ALA A 36 15.827 3.467 7.971 1.00 0.00 C ATOM 551 O ALA A 36 16.604 4.418 8.060 1.00 0.00 O ATOM 552 CB ALA A 36 17.540 1.722 7.433 1.00 0.00 C ATOM 0 H ALA A 36 16.946 2.586 5.198 1.00 0.00 H new ATOM 0 HA ALA A 36 15.415 1.483 7.343 1.00 0.00 H new ATOM 0 HB1 ALA A 36 17.605 1.494 8.497 1.00 0.00 H new ATOM 0 HB2 ALA A 36 17.727 0.816 6.856 1.00 0.00 H new ATOM 0 HB3 ALA A 36 18.285 2.475 7.177 1.00 0.00 H new ATOM 558 N VAL A 37 14.645 3.416 8.593 1.00 0.00 N ATOM 559 CA VAL A 37 14.161 4.497 9.449 1.00 0.00 C ATOM 560 C VAL A 37 13.808 3.984 10.845 1.00 0.00 C ATOM 561 O VAL A 37 14.005 2.812 11.157 1.00 0.00 O ATOM 562 CB VAL A 37 12.921 5.205 8.826 1.00 0.00 C ATOM 563 CG1 VAL A 37 12.874 5.003 7.319 1.00 0.00 C ATOM 564 CG2 VAL A 37 11.615 4.719 9.449 1.00 0.00 C ATOM 0 H VAL A 37 14.002 2.628 8.516 1.00 0.00 H new ATOM 0 HA VAL A 37 14.972 5.221 9.533 1.00 0.00 H new ATOM 0 HB VAL A 37 13.027 6.268 9.040 1.00 0.00 H new ATOM 0 HG11 VAL A 37 11.998 5.508 6.911 1.00 0.00 H new ATOM 0 HG12 VAL A 37 13.775 5.418 6.868 1.00 0.00 H new ATOM 0 HG13 VAL A 37 12.815 3.938 7.096 1.00 0.00 H new ATOM 0 HG21 VAL A 37 10.776 5.238 8.986 1.00 0.00 H new ATOM 0 HG22 VAL A 37 11.512 3.646 9.287 1.00 0.00 H new ATOM 0 HG23 VAL A 37 11.623 4.925 10.519 1.00 0.00 H new ATOM 574 N SER A 38 13.277 4.877 11.676 1.00 0.00 N ATOM 575 CA SER A 38 12.886 4.529 13.039 1.00 0.00 C ATOM 576 C SER A 38 11.983 3.296 13.066 1.00 0.00 C ATOM 577 O SER A 38 12.381 2.240 13.558 1.00 0.00 O ATOM 578 CB SER A 38 12.172 5.709 13.700 1.00 0.00 C ATOM 579 OG SER A 38 12.943 6.893 13.601 1.00 0.00 O ATOM 0 H SER A 38 13.107 5.852 11.428 1.00 0.00 H new ATOM 0 HA SER A 38 13.794 4.295 13.595 1.00 0.00 H new ATOM 0 HB2 SER A 38 11.202 5.862 13.227 1.00 0.00 H new ATOM 0 HB3 SER A 38 11.982 5.482 14.749 1.00 0.00 H new ATOM 0 HG SER A 38 12.463 7.632 14.030 1.00 0.00 H new ATOM 585 N GLU A 39 10.765 3.435 12.543 1.00 0.00 N ATOM 586 CA GLU A 39 9.816 2.322 12.525 1.00 0.00 C ATOM 587 C GLU A 39 8.518 2.676 11.794 1.00 0.00 C ATOM 588 O GLU A 39 7.793 1.785 11.353 1.00 0.00 O ATOM 589 CB GLU A 39 9.495 1.882 13.954 1.00 0.00 C ATOM 590 CG GLU A 39 8.873 0.498 14.040 1.00 0.00 C ATOM 591 CD GLU A 39 7.962 0.341 15.241 1.00 0.00 C ATOM 592 OE1 GLU A 39 8.456 0.461 16.381 1.00 0.00 O ATOM 593 OE2 GLU A 39 6.752 0.099 15.040 1.00 0.00 O ATOM 0 H GLU A 39 10.414 4.299 12.130 1.00 0.00 H new ATOM 0 HA GLU A 39 10.290 1.505 11.981 1.00 0.00 H new ATOM 0 HB2 GLU A 39 10.411 1.897 14.544 1.00 0.00 H new ATOM 0 HB3 GLU A 39 8.815 2.605 14.404 1.00 0.00 H new ATOM 0 HG2 GLU A 39 8.306 0.302 13.130 1.00 0.00 H new ATOM 0 HG3 GLU A 39 9.665 -0.250 14.089 1.00 0.00 H new ATOM 600 N SER A 40 8.222 3.972 11.675 1.00 0.00 N ATOM 601 CA SER A 40 7.002 4.425 11.003 1.00 0.00 C ATOM 602 C SER A 40 6.740 3.631 9.724 1.00 0.00 C ATOM 603 O SER A 40 5.591 3.357 9.374 1.00 0.00 O ATOM 604 CB SER A 40 7.104 5.916 10.677 1.00 0.00 C ATOM 605 OG SER A 40 5.857 6.565 10.860 1.00 0.00 O ATOM 0 H SER A 40 8.809 4.725 12.034 1.00 0.00 H new ATOM 0 HA SER A 40 6.166 4.258 11.682 1.00 0.00 H new ATOM 0 HB2 SER A 40 7.856 6.380 11.315 1.00 0.00 H new ATOM 0 HB3 SER A 40 7.437 6.044 9.647 1.00 0.00 H new ATOM 0 HG SER A 40 5.949 7.517 10.647 1.00 0.00 H new ATOM 611 N GLN A 41 7.814 3.261 9.034 1.00 0.00 N ATOM 612 CA GLN A 41 7.706 2.494 7.795 1.00 0.00 C ATOM 613 C GLN A 41 6.910 1.213 7.999 1.00 0.00 C ATOM 614 O GLN A 41 6.131 0.809 7.136 1.00 0.00 O ATOM 615 CB GLN A 41 9.089 2.143 7.259 1.00 0.00 C ATOM 616 CG GLN A 41 10.082 1.680 8.316 1.00 0.00 C ATOM 617 CD GLN A 41 9.794 0.283 8.821 1.00 0.00 C ATOM 618 OE1 GLN A 41 9.700 0.056 10.025 1.00 0.00 O ATOM 619 NE2 GLN A 41 9.641 -0.659 7.901 1.00 0.00 N ATOM 0 H GLN A 41 8.771 3.480 9.311 1.00 0.00 H new ATOM 0 HA GLN A 41 7.181 3.120 7.073 1.00 0.00 H new ATOM 0 HB2 GLN A 41 8.985 1.359 6.509 1.00 0.00 H new ATOM 0 HB3 GLN A 41 9.500 3.016 6.752 1.00 0.00 H new ATOM 0 HG2 GLN A 41 11.089 1.710 7.900 1.00 0.00 H new ATOM 0 HG3 GLN A 41 10.063 2.376 9.155 1.00 0.00 H new ATOM 0 HE21 GLN A 41 9.728 -0.425 6.912 1.00 0.00 H new ATOM 0 HE22 GLN A 41 9.436 -1.618 8.182 1.00 0.00 H new ATOM 628 N LEU A 42 7.120 0.573 9.139 1.00 0.00 N ATOM 629 CA LEU A 42 6.432 -0.672 9.450 1.00 0.00 C ATOM 630 C LEU A 42 4.958 -0.420 9.722 1.00 0.00 C ATOM 631 O LEU A 42 4.096 -1.196 9.310 1.00 0.00 O ATOM 632 CB LEU A 42 7.080 -1.356 10.655 1.00 0.00 C ATOM 633 CG LEU A 42 6.486 -2.716 11.025 1.00 0.00 C ATOM 634 CD1 LEU A 42 7.212 -3.832 10.291 1.00 0.00 C ATOM 635 CD2 LEU A 42 6.551 -2.934 12.528 1.00 0.00 C ATOM 0 H LEU A 42 7.761 0.894 9.864 1.00 0.00 H new ATOM 0 HA LEU A 42 6.517 -1.331 8.586 1.00 0.00 H new ATOM 0 HB2 LEU A 42 8.143 -1.484 10.452 1.00 0.00 H new ATOM 0 HB3 LEU A 42 6.997 -0.694 11.517 1.00 0.00 H new ATOM 0 HG LEU A 42 5.439 -2.729 10.721 1.00 0.00 H new ATOM 0 HD11 LEU A 42 6.776 -4.792 10.566 1.00 0.00 H new ATOM 0 HD12 LEU A 42 7.114 -3.684 9.216 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.267 -3.821 10.564 1.00 0.00 H new ATOM 0 HD21 LEU A 42 6.124 -3.906 12.773 1.00 0.00 H new ATOM 0 HD22 LEU A 42 7.590 -2.901 12.856 1.00 0.00 H new ATOM 0 HD23 LEU A 42 5.986 -2.151 13.034 1.00 0.00 H new ATOM 647 N ALA A 43 4.677 0.673 10.417 1.00 0.00 N ATOM 648 CA ALA A 43 3.306 1.033 10.745 1.00 0.00 C ATOM 649 C ALA A 43 2.589 1.621 9.535 1.00 0.00 C ATOM 650 O ALA A 43 1.367 1.524 9.420 1.00 0.00 O ATOM 651 CB ALA A 43 3.284 2.010 11.904 1.00 0.00 C ATOM 0 H ALA A 43 5.380 1.325 10.764 1.00 0.00 H new ATOM 0 HA ALA A 43 2.776 0.127 11.040 1.00 0.00 H new ATOM 0 HB1 ALA A 43 2.252 2.272 12.140 1.00 0.00 H new ATOM 0 HB2 ALA A 43 3.750 1.551 12.776 1.00 0.00 H new ATOM 0 HB3 ALA A 43 3.833 2.911 11.631 1.00 0.00 H new ATOM 657 N GLN A 44 3.354 2.228 8.630 1.00 0.00 N ATOM 658 CA GLN A 44 2.780 2.821 7.429 1.00 0.00 C ATOM 659 C GLN A 44 2.292 1.734 6.478 1.00 0.00 C ATOM 660 O GLN A 44 1.193 1.818 5.929 1.00 0.00 O ATOM 661 CB GLN A 44 3.812 3.709 6.729 1.00 0.00 C ATOM 662 CG GLN A 44 3.676 5.185 7.069 1.00 0.00 C ATOM 663 CD GLN A 44 2.626 5.883 6.226 1.00 0.00 C ATOM 664 OE1 GLN A 44 2.939 6.497 5.205 1.00 0.00 O ATOM 665 NE2 GLN A 44 1.370 5.794 6.649 1.00 0.00 N ATOM 0 H GLN A 44 4.367 2.321 8.706 1.00 0.00 H new ATOM 0 HA GLN A 44 1.929 3.436 7.721 1.00 0.00 H new ATOM 0 HB2 GLN A 44 4.812 3.373 7.001 1.00 0.00 H new ATOM 0 HB3 GLN A 44 3.716 3.583 5.651 1.00 0.00 H new ATOM 0 HG2 GLN A 44 3.419 5.289 8.123 1.00 0.00 H new ATOM 0 HG3 GLN A 44 4.638 5.677 6.926 1.00 0.00 H new ATOM 0 HE21 GLN A 44 1.154 5.275 7.500 1.00 0.00 H new ATOM 0 HE22 GLN A 44 0.621 6.244 6.122 1.00 0.00 H new ATOM 674 N LEU A 45 3.120 0.711 6.291 1.00 0.00 N ATOM 675 CA LEU A 45 2.783 -0.402 5.413 1.00 0.00 C ATOM 676 C LEU A 45 1.826 -1.370 6.100 1.00 0.00 C ATOM 677 O LEU A 45 1.004 -2.016 5.450 1.00 0.00 O ATOM 678 CB LEU A 45 4.054 -1.134 4.985 1.00 0.00 C ATOM 679 CG LEU A 45 5.146 -0.230 4.413 1.00 0.00 C ATOM 680 CD1 LEU A 45 6.389 -1.031 4.062 1.00 0.00 C ATOM 681 CD2 LEU A 45 4.628 0.523 3.200 1.00 0.00 C ATOM 0 H LEU A 45 4.033 0.631 6.738 1.00 0.00 H new ATOM 0 HA LEU A 45 2.285 -0.002 4.530 1.00 0.00 H new ATOM 0 HB2 LEU A 45 4.457 -1.669 5.845 1.00 0.00 H new ATOM 0 HB3 LEU A 45 3.792 -1.883 4.238 1.00 0.00 H new ATOM 0 HG LEU A 45 5.423 0.496 5.177 1.00 0.00 H new ATOM 0 HD11 LEU A 45 7.150 -0.363 3.657 1.00 0.00 H new ATOM 0 HD12 LEU A 45 6.773 -1.518 4.958 1.00 0.00 H new ATOM 0 HD13 LEU A 45 6.137 -1.787 3.318 1.00 0.00 H new ATOM 0 HD21 LEU A 45 5.417 1.162 2.804 1.00 0.00 H new ATOM 0 HD22 LEU A 45 4.319 -0.189 2.434 1.00 0.00 H new ATOM 0 HD23 LEU A 45 3.775 1.137 3.490 1.00 0.00 H new ATOM 692 N LYS A 46 1.940 -1.464 7.420 1.00 0.00 N ATOM 693 CA LYS A 46 1.087 -2.353 8.203 1.00 0.00 C ATOM 694 C LYS A 46 -0.354 -1.849 8.236 1.00 0.00 C ATOM 695 O LYS A 46 -1.278 -2.610 8.524 1.00 0.00 O ATOM 696 CB LYS A 46 1.627 -2.483 9.629 1.00 0.00 C ATOM 697 CG LYS A 46 0.801 -3.404 10.512 1.00 0.00 C ATOM 698 CD LYS A 46 1.526 -3.736 11.806 1.00 0.00 C ATOM 699 CE LYS A 46 2.576 -4.815 11.595 1.00 0.00 C ATOM 700 NZ LYS A 46 3.714 -4.676 12.546 1.00 0.00 N ATOM 0 H LYS A 46 2.615 -0.935 7.972 1.00 0.00 H new ATOM 0 HA LYS A 46 1.094 -3.332 7.725 1.00 0.00 H new ATOM 0 HB2 LYS A 46 2.651 -2.855 9.588 1.00 0.00 H new ATOM 0 HB3 LYS A 46 1.665 -1.494 10.086 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -0.154 -2.930 10.740 1.00 0.00 H new ATOM 0 HG3 LYS A 46 0.579 -4.324 9.972 1.00 0.00 H new ATOM 0 HD2 LYS A 46 2.000 -2.837 12.199 1.00 0.00 H new ATOM 0 HD3 LYS A 46 0.805 -4.069 12.553 1.00 0.00 H new ATOM 0 HE2 LYS A 46 2.118 -5.796 11.718 1.00 0.00 H new ATOM 0 HE3 LYS A 46 2.949 -4.763 10.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 4.531 -5.213 12.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 3.972 -3.672 12.635 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 3.435 -5.045 13.477 1.00 0.00 H new ATOM 714 N ALA A 47 -0.542 -0.565 7.943 1.00 0.00 N ATOM 715 CA ALA A 47 -1.872 0.036 7.945 1.00 0.00 C ATOM 716 C ALA A 47 -2.841 -0.754 7.069 1.00 0.00 C ATOM 717 O ALA A 47 -3.903 -1.176 7.526 1.00 0.00 O ATOM 718 CB ALA A 47 -1.798 1.481 7.477 1.00 0.00 C ATOM 0 H ALA A 47 0.211 0.079 7.701 1.00 0.00 H new ATOM 0 HA ALA A 47 -2.249 0.012 8.968 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -2.797 1.917 7.483 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -1.150 2.048 8.146 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -1.393 1.516 6.465 1.00 0.00 H new ATOM 724 N ASP A 48 -2.469 -0.950 5.809 1.00 0.00 N ATOM 725 CA ASP A 48 -3.307 -1.688 4.871 1.00 0.00 C ATOM 726 C ASP A 48 -3.360 -3.171 5.234 1.00 0.00 C ATOM 727 O ASP A 48 -2.334 -3.851 5.239 1.00 0.00 O ATOM 728 CB ASP A 48 -2.783 -1.520 3.444 1.00 0.00 C ATOM 729 CG ASP A 48 -2.556 -0.066 3.079 1.00 0.00 C ATOM 730 OD1 ASP A 48 -3.528 0.601 2.668 1.00 0.00 O ATOM 731 OD2 ASP A 48 -1.406 0.406 3.204 1.00 0.00 O ATOM 0 H ASP A 48 -1.593 -0.608 5.414 1.00 0.00 H new ATOM 0 HA ASP A 48 -4.317 -1.282 4.931 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -1.848 -2.069 3.336 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -3.494 -1.961 2.745 1.00 0.00 H new ATOM 736 N PRO A 49 -4.560 -3.697 5.542 1.00 0.00 N ATOM 737 CA PRO A 49 -4.735 -5.102 5.905 1.00 0.00 C ATOM 738 C PRO A 49 -4.812 -6.013 4.683 1.00 0.00 C ATOM 739 O PRO A 49 -5.766 -6.774 4.521 1.00 0.00 O ATOM 740 CB PRO A 49 -6.065 -5.093 6.650 1.00 0.00 C ATOM 741 CG PRO A 49 -6.845 -4.000 6.003 1.00 0.00 C ATOM 742 CD PRO A 49 -5.843 -2.962 5.564 1.00 0.00 C ATOM 0 HA PRO A 49 -3.899 -5.487 6.488 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -6.576 -6.052 6.562 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -5.923 -4.904 7.714 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -7.410 -4.378 5.151 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -7.566 -3.573 6.700 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -6.090 -2.558 4.582 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -5.810 -2.120 6.256 1.00 0.00 H new ATOM 750 N ARG A 50 -3.800 -5.930 3.825 1.00 0.00 N ATOM 751 CA ARG A 50 -3.753 -6.747 2.618 1.00 0.00 C ATOM 752 C ARG A 50 -2.311 -7.061 2.235 1.00 0.00 C ATOM 753 O ARG A 50 -1.897 -8.220 2.232 1.00 0.00 O ATOM 754 CB ARG A 50 -4.457 -6.032 1.464 1.00 0.00 C ATOM 755 CG ARG A 50 -4.864 -6.962 0.332 1.00 0.00 C ATOM 756 CD ARG A 50 -6.339 -7.325 0.412 1.00 0.00 C ATOM 757 NE ARG A 50 -6.586 -8.706 0.004 1.00 0.00 N ATOM 758 CZ ARG A 50 -7.717 -9.361 0.255 1.00 0.00 C ATOM 759 NH1 ARG A 50 -8.706 -8.766 0.911 1.00 0.00 N ATOM 760 NH2 ARG A 50 -7.863 -10.615 -0.152 1.00 0.00 N ATOM 0 H ARG A 50 -3.002 -5.306 3.943 1.00 0.00 H new ATOM 0 HA ARG A 50 -4.270 -7.685 2.821 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -5.345 -5.528 1.847 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -3.797 -5.259 1.069 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -4.657 -6.484 -0.625 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -4.262 -7.870 0.371 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -6.693 -7.180 1.433 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -6.913 -6.651 -0.224 1.00 0.00 H new ATOM 0 HE ARG A 50 -5.849 -9.197 -0.503 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -8.602 -7.801 1.226 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -9.570 -9.273 1.100 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -7.108 -11.078 -0.658 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -8.730 -11.116 0.041 1.00 0.00 H new ATOM 774 N LEU A 51 -1.548 -6.020 1.915 1.00 0.00 N ATOM 775 CA LEU A 51 -0.151 -6.187 1.533 1.00 0.00 C ATOM 776 C LEU A 51 0.657 -6.755 2.697 1.00 0.00 C ATOM 777 O LEU A 51 0.125 -6.958 3.788 1.00 0.00 O ATOM 778 CB LEU A 51 0.429 -4.851 1.065 1.00 0.00 C ATOM 779 CG LEU A 51 -0.451 -4.085 0.073 1.00 0.00 C ATOM 780 CD1 LEU A 51 0.275 -2.858 -0.456 1.00 0.00 C ATOM 781 CD2 LEU A 51 -0.876 -4.992 -1.076 1.00 0.00 C ATOM 0 H LEU A 51 -1.874 -5.053 1.913 1.00 0.00 H new ATOM 0 HA LEU A 51 -0.094 -6.895 0.706 1.00 0.00 H new ATOM 0 HB2 LEU A 51 0.604 -4.221 1.937 1.00 0.00 H new ATOM 0 HB3 LEU A 51 1.400 -5.033 0.604 1.00 0.00 H new ATOM 0 HG LEU A 51 -1.346 -3.751 0.598 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -0.369 -2.329 -1.159 1.00 0.00 H new ATOM 0 HD12 LEU A 51 0.526 -2.198 0.374 1.00 0.00 H new ATOM 0 HD13 LEU A 51 1.189 -3.167 -0.963 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -1.501 -4.431 -1.771 1.00 0.00 H new ATOM 0 HD22 LEU A 51 0.009 -5.358 -1.597 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -1.440 -5.837 -0.683 1.00 0.00 H new ATOM 793 N VAL A 52 1.935 -7.036 2.457 1.00 0.00 N ATOM 794 CA VAL A 52 2.789 -7.610 3.493 1.00 0.00 C ATOM 795 C VAL A 52 3.994 -6.730 3.809 1.00 0.00 C ATOM 796 O VAL A 52 4.800 -6.426 2.932 1.00 0.00 O ATOM 797 CB VAL A 52 3.288 -9.014 3.080 1.00 0.00 C ATOM 798 CG1 VAL A 52 2.140 -9.840 2.529 1.00 0.00 C ATOM 799 CG2 VAL A 52 4.411 -8.923 2.055 1.00 0.00 C ATOM 0 H VAL A 52 2.399 -6.877 1.563 1.00 0.00 H new ATOM 0 HA VAL A 52 2.174 -7.682 4.390 1.00 0.00 H new ATOM 0 HB VAL A 52 3.683 -9.504 3.970 1.00 0.00 H new ATOM 0 HG11 VAL A 52 2.506 -10.826 2.242 1.00 0.00 H new ATOM 0 HG12 VAL A 52 1.369 -9.947 3.292 1.00 0.00 H new ATOM 0 HG13 VAL A 52 1.719 -9.341 1.656 1.00 0.00 H new ATOM 0 HG21 VAL A 52 4.740 -9.927 1.785 1.00 0.00 H new ATOM 0 HG22 VAL A 52 4.050 -8.408 1.165 1.00 0.00 H new ATOM 0 HG23 VAL A 52 5.248 -8.369 2.480 1.00 0.00 H new ATOM 809 N VAL A 53 4.128 -6.347 5.074 1.00 0.00 N ATOM 810 CA VAL A 53 5.259 -5.529 5.501 1.00 0.00 C ATOM 811 C VAL A 53 6.112 -6.291 6.511 1.00 0.00 C ATOM 812 O VAL A 53 5.721 -6.467 7.665 1.00 0.00 O ATOM 813 CB VAL A 53 4.805 -4.182 6.099 1.00 0.00 C ATOM 814 CG1 VAL A 53 3.650 -4.377 7.071 1.00 0.00 C ATOM 815 CG2 VAL A 53 5.961 -3.456 6.777 1.00 0.00 C ATOM 0 H VAL A 53 3.473 -6.587 5.818 1.00 0.00 H new ATOM 0 HA VAL A 53 5.856 -5.311 4.615 1.00 0.00 H new ATOM 0 HB VAL A 53 4.457 -3.560 5.275 1.00 0.00 H new ATOM 0 HG11 VAL A 53 3.350 -3.411 7.478 1.00 0.00 H new ATOM 0 HG12 VAL A 53 2.807 -4.828 6.548 1.00 0.00 H new ATOM 0 HG13 VAL A 53 3.965 -5.031 7.884 1.00 0.00 H new ATOM 0 HG21 VAL A 53 5.606 -2.511 7.187 1.00 0.00 H new ATOM 0 HG22 VAL A 53 6.357 -4.075 7.582 1.00 0.00 H new ATOM 0 HG23 VAL A 53 6.747 -3.262 6.047 1.00 0.00 H new ATOM 825 N GLN A 54 7.275 -6.745 6.060 1.00 0.00 N ATOM 826 CA GLN A 54 8.190 -7.501 6.912 1.00 0.00 C ATOM 827 C GLN A 54 9.586 -6.893 6.889 1.00 0.00 C ATOM 828 O GLN A 54 10.130 -6.613 5.822 1.00 0.00 O ATOM 829 CB GLN A 54 8.251 -8.961 6.463 1.00 0.00 C ATOM 830 CG GLN A 54 6.885 -9.618 6.347 1.00 0.00 C ATOM 831 CD GLN A 54 6.722 -10.402 5.059 1.00 0.00 C ATOM 832 OE1 GLN A 54 7.687 -10.619 4.325 1.00 0.00 O ATOM 833 NE2 GLN A 54 5.498 -10.829 4.776 1.00 0.00 N ATOM 0 H GLN A 54 7.609 -6.603 5.107 1.00 0.00 H new ATOM 0 HA GLN A 54 7.812 -7.457 7.933 1.00 0.00 H new ATOM 0 HB2 GLN A 54 8.754 -9.015 5.498 1.00 0.00 H new ATOM 0 HB3 GLN A 54 8.858 -9.525 7.171 1.00 0.00 H new ATOM 0 HG2 GLN A 54 6.734 -10.285 7.196 1.00 0.00 H new ATOM 0 HG3 GLN A 54 6.112 -8.852 6.402 1.00 0.00 H new ATOM 0 HE21 GLN A 54 4.727 -10.627 5.413 1.00 0.00 H new ATOM 0 HE22 GLN A 54 5.328 -11.360 3.922 1.00 0.00 H new ATOM 842 N ILE A 55 10.160 -6.691 8.072 1.00 0.00 N ATOM 843 CA ILE A 55 11.493 -6.105 8.187 1.00 0.00 C ATOM 844 C ILE A 55 12.585 -7.173 8.126 1.00 0.00 C ATOM 845 O ILE A 55 12.643 -8.076 8.961 1.00 0.00 O ATOM 846 CB ILE A 55 11.640 -5.266 9.485 1.00 0.00 C ATOM 847 CG1 ILE A 55 11.915 -6.151 10.705 1.00 0.00 C ATOM 848 CG2 ILE A 55 10.392 -4.426 9.722 1.00 0.00 C ATOM 849 CD1 ILE A 55 10.828 -7.167 10.982 1.00 0.00 C ATOM 0 H ILE A 55 9.724 -6.924 8.964 1.00 0.00 H new ATOM 0 HA ILE A 55 11.616 -5.439 7.333 1.00 0.00 H new ATOM 0 HB ILE A 55 12.497 -4.606 9.350 1.00 0.00 H new ATOM 0 HG12 ILE A 55 12.859 -6.675 10.556 1.00 0.00 H new ATOM 0 HG13 ILE A 55 12.037 -5.516 11.582 1.00 0.00 H new ATOM 0 HG21 ILE A 55 10.513 -3.845 10.636 1.00 0.00 H new ATOM 0 HG22 ILE A 55 10.243 -3.751 8.880 1.00 0.00 H new ATOM 0 HG23 ILE A 55 9.526 -5.081 9.820 1.00 0.00 H new ATOM 0 HD11 ILE A 55 11.095 -7.755 11.860 1.00 0.00 H new ATOM 0 HD12 ILE A 55 9.885 -6.651 11.164 1.00 0.00 H new ATOM 0 HD13 ILE A 55 10.720 -7.828 10.122 1.00 0.00 H new ATOM 861 N THR A 56 13.448 -7.056 7.123 1.00 0.00 N ATOM 862 CA THR A 56 14.545 -7.995 6.937 1.00 0.00 C ATOM 863 C THR A 56 15.880 -7.260 6.929 1.00 0.00 C ATOM 864 O THR A 56 16.232 -6.606 5.947 1.00 0.00 O ATOM 865 CB THR A 56 14.367 -8.771 5.632 1.00 0.00 C ATOM 866 OG1 THR A 56 13.830 -7.937 4.622 1.00 0.00 O ATOM 867 CG2 THR A 56 13.457 -9.972 5.768 1.00 0.00 C ATOM 0 H THR A 56 13.407 -6.315 6.423 1.00 0.00 H new ATOM 0 HA THR A 56 14.538 -8.700 7.769 1.00 0.00 H new ATOM 0 HB THR A 56 15.365 -9.121 5.366 1.00 0.00 H new ATOM 0 HG1 THR A 56 14.341 -7.102 4.582 1.00 0.00 H new ATOM 0 HG21 THR A 56 13.375 -10.477 4.805 1.00 0.00 H new ATOM 0 HG22 THR A 56 13.871 -10.661 6.505 1.00 0.00 H new ATOM 0 HG23 THR A 56 12.469 -9.645 6.092 1.00 0.00 H new ATOM 875 N GLU A 57 16.620 -7.368 8.025 1.00 0.00 N ATOM 876 CA GLU A 57 17.916 -6.708 8.137 1.00 0.00 C ATOM 877 C GLU A 57 18.973 -7.430 7.303 1.00 0.00 C ATOM 878 O GLU A 57 19.967 -7.925 7.836 1.00 0.00 O ATOM 879 CB GLU A 57 18.354 -6.644 9.602 1.00 0.00 C ATOM 880 CG GLU A 57 19.044 -5.342 9.974 1.00 0.00 C ATOM 881 CD GLU A 57 19.218 -5.182 11.471 1.00 0.00 C ATOM 882 OE1 GLU A 57 20.048 -5.910 12.054 1.00 0.00 O ATOM 883 OE2 GLU A 57 18.524 -4.327 12.061 1.00 0.00 O ATOM 0 H GLU A 57 16.346 -7.905 8.848 1.00 0.00 H new ATOM 0 HA GLU A 57 17.813 -5.693 7.753 1.00 0.00 H new ATOM 0 HB2 GLU A 57 17.480 -6.778 10.240 1.00 0.00 H new ATOM 0 HB3 GLU A 57 19.029 -7.475 9.807 1.00 0.00 H new ATOM 0 HG2 GLU A 57 20.021 -5.302 9.492 1.00 0.00 H new ATOM 0 HG3 GLU A 57 18.464 -4.504 9.588 1.00 0.00 H new ATOM 890 N THR A 58 18.751 -7.482 5.992 1.00 0.00 N ATOM 891 CA THR A 58 19.680 -8.138 5.077 1.00 0.00 C ATOM 892 C THR A 58 19.771 -9.635 5.365 1.00 0.00 C ATOM 893 O THR A 58 19.233 -10.453 4.618 1.00 0.00 O ATOM 894 CB THR A 58 21.066 -7.497 5.175 1.00 0.00 C ATOM 895 OG1 THR A 58 20.997 -6.111 4.890 1.00 0.00 O ATOM 896 CG2 THR A 58 22.078 -8.109 4.231 1.00 0.00 C ATOM 0 H THR A 58 17.932 -7.076 5.539 1.00 0.00 H new ATOM 0 HA THR A 58 19.301 -8.009 4.063 1.00 0.00 H new ATOM 0 HB THR A 58 21.395 -7.675 6.199 1.00 0.00 H new ATOM 0 HG1 THR A 58 21.892 -5.718 4.959 1.00 0.00 H new ATOM 0 HG21 THR A 58 23.038 -7.608 4.352 1.00 0.00 H new ATOM 0 HG22 THR A 58 22.191 -9.169 4.456 1.00 0.00 H new ATOM 0 HG23 THR A 58 21.735 -7.991 3.203 1.00 0.00 H new ATOM 904 N GLY A 59 20.455 -9.986 6.448 1.00 0.00 N ATOM 905 CA GLY A 59 20.606 -11.382 6.812 1.00 0.00 C ATOM 906 C GLY A 59 22.032 -11.725 7.195 1.00 0.00 C ATOM 907 O GLY A 59 22.809 -12.194 6.364 1.00 0.00 O ATOM 0 H GLY A 59 20.908 -9.327 7.081 1.00 0.00 H new ATOM 0 HA2 GLY A 59 19.943 -11.612 7.646 1.00 0.00 H new ATOM 0 HA3 GLY A 59 20.296 -12.009 5.976 1.00 0.00 H new ATOM 911 N SER A 60 22.377 -11.487 8.456 1.00 0.00 N ATOM 912 CA SER A 60 23.721 -11.771 8.947 1.00 0.00 C ATOM 913 C SER A 60 24.752 -10.907 8.227 1.00 0.00 C ATOM 914 O SER A 60 24.919 -11.008 7.011 1.00 0.00 O ATOM 915 CB SER A 60 24.057 -13.252 8.760 1.00 0.00 C ATOM 916 OG SER A 60 23.107 -14.077 9.413 1.00 0.00 O ATOM 0 H SER A 60 21.745 -11.098 9.156 1.00 0.00 H new ATOM 0 HA SER A 60 23.751 -11.535 10.011 1.00 0.00 H new ATOM 0 HB2 SER A 60 24.081 -13.491 7.697 1.00 0.00 H new ATOM 0 HB3 SER A 60 25.052 -13.455 9.155 1.00 0.00 H new ATOM 0 HG SER A 60 23.343 -15.018 9.277 1.00 0.00 H new ATOM 922 N GLN A 61 25.437 -10.056 8.984 1.00 0.00 N ATOM 923 CA GLN A 61 26.449 -9.170 8.419 1.00 0.00 C ATOM 924 C GLN A 61 25.830 -8.215 7.405 1.00 0.00 C ATOM 925 O GLN A 61 24.835 -8.539 6.758 1.00 0.00 O ATOM 926 CB GLN A 61 27.563 -9.986 7.755 1.00 0.00 C ATOM 927 CG GLN A 61 28.521 -10.624 8.747 1.00 0.00 C ATOM 928 CD GLN A 61 29.609 -11.432 8.068 1.00 0.00 C ATOM 929 OE1 GLN A 61 29.833 -12.596 8.399 1.00 0.00 O ATOM 930 NE2 GLN A 61 30.294 -10.817 7.110 1.00 0.00 N ATOM 0 H GLN A 61 25.310 -9.961 9.992 1.00 0.00 H new ATOM 0 HA GLN A 61 26.875 -8.583 9.232 1.00 0.00 H new ATOM 0 HB2 GLN A 61 27.114 -10.767 7.142 1.00 0.00 H new ATOM 0 HB3 GLN A 61 28.126 -9.338 7.083 1.00 0.00 H new ATOM 0 HG2 GLN A 61 28.979 -9.845 9.357 1.00 0.00 H new ATOM 0 HG3 GLN A 61 27.961 -11.271 9.423 1.00 0.00 H new ATOM 0 HE21 GLN A 61 30.076 -9.851 6.867 1.00 0.00 H new ATOM 0 HE22 GLN A 61 31.038 -11.311 6.618 1.00 0.00 H new ATOM 939 N GLU A 62 26.426 -7.034 7.271 1.00 0.00 N ATOM 940 CA GLU A 62 25.932 -6.030 6.335 1.00 0.00 C ATOM 941 C GLU A 62 26.995 -5.684 5.297 1.00 0.00 C ATOM 942 O GLU A 62 28.162 -6.049 5.442 1.00 0.00 O ATOM 943 CB GLU A 62 25.504 -4.768 7.089 1.00 0.00 C ATOM 944 CG GLU A 62 24.168 -4.209 6.628 1.00 0.00 C ATOM 945 CD GLU A 62 23.974 -2.759 7.024 1.00 0.00 C ATOM 946 OE1 GLU A 62 24.526 -2.350 8.067 1.00 0.00 O ATOM 947 OE2 GLU A 62 23.270 -2.033 6.293 1.00 0.00 O ATOM 0 H GLU A 62 27.251 -6.749 7.798 1.00 0.00 H new ATOM 0 HA GLU A 62 25.068 -6.445 5.816 1.00 0.00 H new ATOM 0 HB2 GLU A 62 25.447 -4.993 8.154 1.00 0.00 H new ATOM 0 HB3 GLU A 62 26.271 -4.003 6.966 1.00 0.00 H new ATOM 0 HG2 GLU A 62 24.096 -4.298 5.544 1.00 0.00 H new ATOM 0 HG3 GLU A 62 23.362 -4.808 7.052 1.00 0.00 H new ATOM 954 N GLY A 63 26.584 -4.976 4.248 1.00 0.00 N ATOM 955 CA GLY A 63 27.513 -4.592 3.202 1.00 0.00 C ATOM 956 C GLY A 63 27.240 -5.308 1.893 1.00 0.00 C ATOM 957 O GLY A 63 26.240 -5.039 1.227 1.00 0.00 O ATOM 0 H GLY A 63 25.624 -4.662 4.105 1.00 0.00 H new ATOM 0 HA2 GLY A 63 27.452 -3.515 3.043 1.00 0.00 H new ATOM 0 HA3 GLY A 63 28.531 -4.809 3.526 1.00 0.00 H new ATOM 961 N GLY A 64 28.132 -6.223 1.524 1.00 0.00 N ATOM 962 CA GLY A 64 27.965 -6.966 0.289 1.00 0.00 C ATOM 963 C GLY A 64 28.037 -8.465 0.499 1.00 0.00 C ATOM 964 O GLY A 64 28.780 -8.943 1.356 1.00 0.00 O ATOM 0 H GLY A 64 28.967 -6.463 2.059 1.00 0.00 H new ATOM 0 HA2 GLY A 64 27.004 -6.711 -0.158 1.00 0.00 H new ATOM 0 HA3 GLY A 64 28.736 -6.664 -0.420 1.00 0.00 H new ATOM 968 N GLU A 65 27.264 -9.209 -0.285 1.00 0.00 N ATOM 969 CA GLU A 65 27.243 -10.663 -0.180 1.00 0.00 C ATOM 970 C GLU A 65 27.299 -11.309 -1.561 1.00 0.00 C ATOM 971 O GLU A 65 26.676 -12.344 -1.800 1.00 0.00 O ATOM 972 CB GLU A 65 25.988 -11.124 0.561 1.00 0.00 C ATOM 973 CG GLU A 65 26.082 -12.545 1.092 1.00 0.00 C ATOM 974 CD GLU A 65 24.821 -13.349 0.838 1.00 0.00 C ATOM 975 OE1 GLU A 65 24.487 -13.571 -0.345 1.00 0.00 O ATOM 976 OE2 GLU A 65 24.167 -13.754 1.822 1.00 0.00 O ATOM 0 H GLU A 65 26.644 -8.829 -1.000 1.00 0.00 H new ATOM 0 HA GLU A 65 28.123 -10.974 0.383 1.00 0.00 H new ATOM 0 HB2 GLU A 65 25.798 -10.446 1.393 1.00 0.00 H new ATOM 0 HB3 GLU A 65 25.133 -11.052 -0.111 1.00 0.00 H new ATOM 0 HG2 GLU A 65 26.929 -13.048 0.625 1.00 0.00 H new ATOM 0 HG3 GLU A 65 26.280 -12.516 2.163 1.00 0.00 H new ATOM 983 N GLY A 66 28.051 -10.693 -2.467 1.00 0.00 N ATOM 984 CA GLY A 66 28.174 -11.223 -3.813 1.00 0.00 C ATOM 985 C GLY A 66 28.459 -10.144 -4.838 1.00 0.00 C ATOM 986 O GLY A 66 27.589 -9.331 -5.153 1.00 0.00 O ATOM 0 H GLY A 66 28.577 -9.837 -2.294 1.00 0.00 H new ATOM 0 HA2 GLY A 66 28.974 -11.963 -3.837 1.00 0.00 H new ATOM 0 HA3 GLY A 66 27.253 -11.741 -4.082 1.00 0.00 H new ATOM 990 N LEU A 67 29.681 -10.136 -5.362 1.00 0.00 N ATOM 991 CA LEU A 67 30.079 -9.149 -6.358 1.00 0.00 C ATOM 992 C LEU A 67 29.751 -9.637 -7.766 1.00 0.00 C ATOM 993 O LEU A 67 28.819 -9.145 -8.403 1.00 0.00 O ATOM 994 CB LEU A 67 31.576 -8.853 -6.243 1.00 0.00 C ATOM 995 CG LEU A 67 31.934 -7.664 -5.348 1.00 0.00 C ATOM 996 CD1 LEU A 67 31.425 -6.366 -5.956 1.00 0.00 C ATOM 997 CD2 LEU A 67 31.364 -7.859 -3.951 1.00 0.00 C ATOM 0 H LEU A 67 30.412 -10.802 -5.113 1.00 0.00 H new ATOM 0 HA LEU A 67 29.520 -8.232 -6.171 1.00 0.00 H new ATOM 0 HB2 LEU A 67 32.078 -9.741 -5.859 1.00 0.00 H new ATOM 0 HB3 LEU A 67 31.972 -8.669 -7.242 1.00 0.00 H new ATOM 0 HG LEU A 67 33.020 -7.605 -5.272 1.00 0.00 H new ATOM 0 HD11 LEU A 67 31.689 -5.532 -5.306 1.00 0.00 H new ATOM 0 HD12 LEU A 67 31.880 -6.220 -6.936 1.00 0.00 H new ATOM 0 HD13 LEU A 67 30.341 -6.414 -6.062 1.00 0.00 H new ATOM 0 HD21 LEU A 67 31.628 -7.005 -3.328 1.00 0.00 H new ATOM 0 HD22 LEU A 67 30.279 -7.944 -4.009 1.00 0.00 H new ATOM 0 HD23 LEU A 67 31.776 -8.768 -3.513 1.00 0.00 H new ATOM 1009 N SER A 68 30.523 -10.607 -8.245 1.00 0.00 N ATOM 1010 CA SER A 68 30.314 -11.161 -9.578 1.00 0.00 C ATOM 1011 C SER A 68 29.421 -12.397 -9.519 1.00 0.00 C ATOM 1012 O SER A 68 29.456 -13.154 -8.550 1.00 0.00 O ATOM 1013 CB SER A 68 31.655 -11.517 -10.221 1.00 0.00 C ATOM 1014 OG SER A 68 32.640 -10.545 -9.919 1.00 0.00 O ATOM 0 H SER A 68 31.298 -11.025 -7.731 1.00 0.00 H new ATOM 0 HA SER A 68 29.817 -10.404 -10.185 1.00 0.00 H new ATOM 0 HB2 SER A 68 31.983 -12.494 -9.867 1.00 0.00 H new ATOM 0 HB3 SER A 68 31.535 -11.594 -11.302 1.00 0.00 H new ATOM 0 HG SER A 68 33.488 -10.797 -10.340 1.00 0.00 H new ATOM 1020 N LYS A 69 28.622 -12.593 -10.562 1.00 0.00 N ATOM 1021 CA LYS A 69 27.718 -13.736 -10.628 1.00 0.00 C ATOM 1022 C LYS A 69 27.195 -13.937 -12.047 1.00 0.00 C ATOM 1023 O LYS A 69 26.593 -13.034 -12.630 1.00 0.00 O ATOM 1024 CB LYS A 69 26.549 -13.545 -9.662 1.00 0.00 C ATOM 1025 CG LYS A 69 25.725 -12.297 -9.944 1.00 0.00 C ATOM 1026 CD LYS A 69 24.320 -12.646 -10.405 1.00 0.00 C ATOM 1027 CE LYS A 69 23.401 -11.436 -10.364 1.00 0.00 C ATOM 1028 NZ LYS A 69 22.052 -11.781 -9.835 1.00 0.00 N ATOM 0 H LYS A 69 28.582 -11.976 -11.373 1.00 0.00 H new ATOM 0 HA LYS A 69 28.277 -14.626 -10.338 1.00 0.00 H new ATOM 0 HB2 LYS A 69 25.899 -14.419 -9.713 1.00 0.00 H new ATOM 0 HB3 LYS A 69 26.934 -13.494 -8.644 1.00 0.00 H new ATOM 0 HG2 LYS A 69 25.671 -11.685 -9.044 1.00 0.00 H new ATOM 0 HG3 LYS A 69 26.221 -11.698 -10.708 1.00 0.00 H new ATOM 0 HD2 LYS A 69 24.357 -13.041 -11.420 1.00 0.00 H new ATOM 0 HD3 LYS A 69 23.914 -13.434 -9.771 1.00 0.00 H new ATOM 0 HE2 LYS A 69 23.848 -10.661 -9.741 1.00 0.00 H new ATOM 0 HE3 LYS A 69 23.302 -11.021 -11.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 21.456 -10.929 -9.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 21.614 -12.502 -10.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 22.143 -12.153 -8.868 1.00 0.00 H new ATOM 1042 N GLU A 70 27.427 -15.124 -12.597 1.00 0.00 N ATOM 1043 CA GLU A 70 26.978 -15.444 -13.947 1.00 0.00 C ATOM 1044 C GLU A 70 27.079 -16.944 -14.212 1.00 0.00 C ATOM 1045 O GLU A 70 27.715 -17.676 -13.454 1.00 0.00 O ATOM 1046 CB GLU A 70 27.807 -14.675 -14.978 1.00 0.00 C ATOM 1047 CG GLU A 70 29.293 -14.991 -14.923 1.00 0.00 C ATOM 1048 CD GLU A 70 30.108 -14.128 -15.865 1.00 0.00 C ATOM 1049 OE1 GLU A 70 29.838 -14.161 -17.085 1.00 0.00 O ATOM 1050 OE2 GLU A 70 31.016 -13.419 -15.385 1.00 0.00 O ATOM 0 H GLU A 70 27.924 -15.881 -12.128 1.00 0.00 H new ATOM 0 HA GLU A 70 25.933 -15.147 -14.036 1.00 0.00 H new ATOM 0 HB2 GLU A 70 27.432 -14.903 -15.976 1.00 0.00 H new ATOM 0 HB3 GLU A 70 27.666 -13.606 -14.821 1.00 0.00 H new ATOM 0 HG2 GLU A 70 29.653 -14.850 -13.904 1.00 0.00 H new ATOM 0 HG3 GLU A 70 29.447 -16.041 -15.173 1.00 0.00 H new ATOM 1057 N PRO A 71 26.442 -17.425 -15.296 1.00 0.00 N ATOM 1058 CA PRO A 71 26.450 -18.838 -15.664 1.00 0.00 C ATOM 1059 C PRO A 71 27.693 -19.233 -16.461 1.00 0.00 C ATOM 1060 O PRO A 71 27.602 -19.974 -17.440 1.00 0.00 O ATOM 1061 CB PRO A 71 25.188 -18.991 -16.533 1.00 0.00 C ATOM 1062 CG PRO A 71 24.596 -17.618 -16.670 1.00 0.00 C ATOM 1063 CD PRO A 71 25.655 -16.641 -16.245 1.00 0.00 C ATOM 0 HA PRO A 71 26.462 -19.482 -14.784 1.00 0.00 H new ATOM 0 HB2 PRO A 71 25.438 -19.405 -17.510 1.00 0.00 H new ATOM 0 HB3 PRO A 71 24.478 -19.675 -16.069 1.00 0.00 H new ATOM 0 HG2 PRO A 71 24.289 -17.431 -17.699 1.00 0.00 H new ATOM 0 HG3 PRO A 71 23.706 -17.517 -16.048 1.00 0.00 H new ATOM 0 HD2 PRO A 71 26.256 -16.301 -17.088 1.00 0.00 H new ATOM 0 HD3 PRO A 71 25.226 -15.753 -15.781 1.00 0.00 H new ATOM 1071 N ALA A 72 28.853 -18.740 -16.035 1.00 0.00 N ATOM 1072 CA ALA A 72 30.110 -19.047 -16.711 1.00 0.00 C ATOM 1073 C ALA A 72 30.037 -18.715 -18.198 1.00 0.00 C ATOM 1074 O ALA A 72 29.471 -19.472 -18.986 1.00 0.00 O ATOM 1075 CB ALA A 72 30.470 -20.512 -16.513 1.00 0.00 C ATOM 0 H ALA A 72 28.948 -18.127 -15.226 1.00 0.00 H new ATOM 0 HA ALA A 72 30.889 -18.427 -16.268 1.00 0.00 H new ATOM 0 HB1 ALA A 72 31.409 -20.728 -17.022 1.00 0.00 H new ATOM 0 HB2 ALA A 72 30.578 -20.719 -15.448 1.00 0.00 H new ATOM 0 HB3 ALA A 72 29.681 -21.140 -16.927 1.00 0.00 H new ATOM 1081 N GLY A 73 30.616 -17.580 -18.575 1.00 0.00 N ATOM 1082 CA GLY A 73 30.607 -17.170 -19.967 1.00 0.00 C ATOM 1083 C GLY A 73 31.565 -17.982 -20.816 1.00 0.00 C ATOM 1084 O GLY A 73 32.675 -17.538 -21.108 1.00 0.00 O ATOM 0 H GLY A 73 31.091 -16.937 -17.942 1.00 0.00 H new ATOM 0 HA2 GLY A 73 29.598 -17.271 -20.366 1.00 0.00 H new ATOM 0 HA3 GLY A 73 30.872 -16.115 -20.034 1.00 0.00 H new ATOM 1088 N SER A 74 31.135 -19.175 -21.214 1.00 0.00 N ATOM 1089 CA SER A 74 31.963 -20.052 -22.034 1.00 0.00 C ATOM 1090 C SER A 74 31.389 -20.184 -23.441 1.00 0.00 C ATOM 1091 O SER A 74 32.063 -19.885 -24.426 1.00 0.00 O ATOM 1092 CB SER A 74 32.076 -21.433 -21.386 1.00 0.00 C ATOM 1093 OG SER A 74 33.275 -22.082 -21.773 1.00 0.00 O ATOM 0 H SER A 74 30.218 -19.557 -20.982 1.00 0.00 H new ATOM 0 HA SER A 74 32.956 -19.609 -22.106 1.00 0.00 H new ATOM 0 HB2 SER A 74 32.047 -21.332 -20.301 1.00 0.00 H new ATOM 0 HB3 SER A 74 31.220 -22.044 -21.672 1.00 0.00 H new ATOM 0 HG SER A 74 33.324 -22.962 -21.344 1.00 0.00 H new ATOM 1099 N ASP A 75 30.142 -20.633 -23.527 1.00 0.00 N ATOM 1100 CA ASP A 75 29.478 -20.805 -24.815 1.00 0.00 C ATOM 1101 C ASP A 75 28.122 -20.107 -24.825 1.00 0.00 C ATOM 1102 O ASP A 75 27.752 -19.433 -23.864 1.00 0.00 O ATOM 1103 CB ASP A 75 29.304 -22.292 -25.128 1.00 0.00 C ATOM 1104 CG ASP A 75 29.554 -22.608 -26.589 1.00 0.00 C ATOM 1105 OD1 ASP A 75 28.736 -22.191 -27.436 1.00 0.00 O ATOM 1106 OD2 ASP A 75 30.569 -23.272 -26.887 1.00 0.00 O ATOM 0 H ASP A 75 29.570 -20.885 -22.721 1.00 0.00 H new ATOM 0 HA ASP A 75 30.105 -20.351 -25.583 1.00 0.00 H new ATOM 0 HB2 ASP A 75 29.989 -22.873 -24.511 1.00 0.00 H new ATOM 0 HB3 ASP A 75 28.294 -22.601 -24.860 1.00 0.00 H new ATOM 1111 N GLU A 76 27.385 -20.273 -25.918 1.00 0.00 N ATOM 1112 CA GLU A 76 26.070 -19.659 -26.055 1.00 0.00 C ATOM 1113 C GLU A 76 24.965 -20.664 -25.745 1.00 0.00 C ATOM 1114 O GLU A 76 24.357 -20.623 -24.675 1.00 0.00 O ATOM 1115 CB GLU A 76 25.888 -19.102 -27.468 1.00 0.00 C ATOM 1116 CG GLU A 76 26.344 -17.661 -27.618 1.00 0.00 C ATOM 1117 CD GLU A 76 25.184 -16.687 -27.704 1.00 0.00 C ATOM 1118 OE1 GLU A 76 24.112 -17.085 -28.204 1.00 0.00 O ATOM 1119 OE2 GLU A 76 25.349 -15.528 -27.270 1.00 0.00 O ATOM 0 H GLU A 76 27.677 -20.828 -26.722 1.00 0.00 H new ATOM 0 HA GLU A 76 26.003 -18.840 -25.339 1.00 0.00 H new ATOM 0 HB2 GLU A 76 26.444 -19.725 -28.169 1.00 0.00 H new ATOM 0 HB3 GLU A 76 24.836 -19.172 -27.744 1.00 0.00 H new ATOM 0 HG2 GLU A 76 26.976 -17.394 -26.771 1.00 0.00 H new ATOM 0 HG3 GLU A 76 26.957 -17.570 -28.514 1.00 0.00 H new ATOM 1126 N GLN A 77 24.709 -21.565 -26.688 1.00 0.00 N ATOM 1127 CA GLN A 77 23.676 -22.580 -26.518 1.00 0.00 C ATOM 1128 C GLN A 77 24.265 -23.983 -26.632 1.00 0.00 C ATOM 1129 O GLN A 77 23.894 -24.886 -25.882 1.00 0.00 O ATOM 1130 CB GLN A 77 22.569 -22.391 -27.557 1.00 0.00 C ATOM 1131 CG GLN A 77 21.168 -22.538 -26.986 1.00 0.00 C ATOM 1132 CD GLN A 77 20.659 -21.258 -26.354 1.00 0.00 C ATOM 1133 OE1 GLN A 77 19.927 -20.490 -26.979 1.00 0.00 O ATOM 1134 NE2 GLN A 77 21.044 -21.021 -25.105 1.00 0.00 N ATOM 0 H GLN A 77 25.204 -21.613 -27.579 1.00 0.00 H new ATOM 0 HA GLN A 77 23.251 -22.466 -25.521 1.00 0.00 H new ATOM 0 HB2 GLN A 77 22.668 -21.402 -28.005 1.00 0.00 H new ATOM 0 HB3 GLN A 77 22.705 -23.119 -28.357 1.00 0.00 H new ATOM 0 HG2 GLN A 77 20.486 -22.843 -27.780 1.00 0.00 H new ATOM 0 HG3 GLN A 77 21.165 -23.333 -26.240 1.00 0.00 H new ATOM 0 HE21 GLN A 77 21.651 -21.684 -24.624 1.00 0.00 H new ATOM 0 HE22 GLN A 77 20.732 -20.176 -24.627 1.00 0.00 H new ATOM 1143 N LYS A 78 25.184 -24.160 -27.577 1.00 0.00 N ATOM 1144 CA LYS A 78 25.823 -25.453 -27.790 1.00 0.00 C ATOM 1145 C LYS A 78 24.801 -26.499 -28.225 1.00 0.00 C ATOM 1146 O LYS A 78 24.840 -27.645 -27.775 1.00 0.00 O ATOM 1147 CB LYS A 78 26.534 -25.912 -26.513 1.00 0.00 C ATOM 1148 CG LYS A 78 27.437 -24.851 -25.906 1.00 0.00 C ATOM 1149 CD LYS A 78 27.651 -25.083 -24.417 1.00 0.00 C ATOM 1150 CE LYS A 78 29.114 -25.352 -24.098 1.00 0.00 C ATOM 1151 NZ LYS A 78 29.438 -26.805 -24.159 1.00 0.00 N ATOM 0 H LYS A 78 25.502 -23.424 -28.207 1.00 0.00 H new ATOM 0 HA LYS A 78 26.560 -25.340 -28.585 1.00 0.00 H new ATOM 0 HB2 LYS A 78 25.786 -26.206 -25.776 1.00 0.00 H new ATOM 0 HB3 LYS A 78 27.128 -26.799 -26.736 1.00 0.00 H new ATOM 0 HG2 LYS A 78 28.399 -24.855 -26.418 1.00 0.00 H new ATOM 0 HG3 LYS A 78 26.998 -23.866 -26.062 1.00 0.00 H new ATOM 0 HD2 LYS A 78 27.311 -24.210 -23.859 1.00 0.00 H new ATOM 0 HD3 LYS A 78 27.045 -25.927 -24.089 1.00 0.00 H new ATOM 0 HE2 LYS A 78 29.745 -24.810 -24.802 1.00 0.00 H new ATOM 0 HE3 LYS A 78 29.345 -24.970 -23.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 30.444 -26.946 -23.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 28.855 -27.320 -23.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 29.242 -27.165 -25.115 1.00 0.00 H new ATOM 1165 N GLN A 79 23.887 -26.095 -29.101 1.00 0.00 N ATOM 1166 CA GLN A 79 22.853 -26.997 -29.598 1.00 0.00 C ATOM 1167 C GLN A 79 22.338 -26.536 -30.958 1.00 0.00 C ATOM 1168 O GLN A 79 22.867 -25.592 -31.544 1.00 0.00 O ATOM 1169 CB GLN A 79 21.696 -27.077 -28.598 1.00 0.00 C ATOM 1170 CG GLN A 79 21.764 -28.289 -27.684 1.00 0.00 C ATOM 1171 CD GLN A 79 21.231 -28.001 -26.295 1.00 0.00 C ATOM 1172 OE1 GLN A 79 20.372 -27.139 -26.112 1.00 0.00 O ATOM 1173 NE2 GLN A 79 21.740 -28.725 -25.304 1.00 0.00 N ATOM 0 H GLN A 79 23.841 -25.150 -29.481 1.00 0.00 H new ATOM 0 HA GLN A 79 23.292 -27.988 -29.715 1.00 0.00 H new ATOM 0 HB2 GLN A 79 21.690 -26.173 -27.989 1.00 0.00 H new ATOM 0 HB3 GLN A 79 20.754 -27.098 -29.146 1.00 0.00 H new ATOM 0 HG2 GLN A 79 21.193 -29.106 -28.126 1.00 0.00 H new ATOM 0 HG3 GLN A 79 22.798 -28.626 -27.610 1.00 0.00 H new ATOM 0 HE21 GLN A 79 22.451 -29.430 -25.500 1.00 0.00 H new ATOM 0 HE22 GLN A 79 21.420 -28.576 -24.347 1.00 0.00 H new ATOM 1182 N LEU A 80 21.303 -27.212 -31.453 1.00 0.00 N ATOM 1183 CA LEU A 80 20.706 -26.880 -32.747 1.00 0.00 C ATOM 1184 C LEU A 80 21.776 -26.671 -33.816 1.00 0.00 C ATOM 1185 O LEU A 80 22.950 -26.973 -33.602 1.00 0.00 O ATOM 1186 CB LEU A 80 19.827 -25.630 -32.626 1.00 0.00 C ATOM 1187 CG LEU A 80 20.581 -24.312 -32.432 1.00 0.00 C ATOM 1188 CD1 LEU A 80 19.863 -23.177 -33.146 1.00 0.00 C ATOM 1189 CD2 LEU A 80 20.735 -23.998 -30.950 1.00 0.00 C ATOM 0 H LEU A 80 20.858 -27.996 -30.976 1.00 0.00 H new ATOM 0 HA LEU A 80 20.085 -27.722 -33.052 1.00 0.00 H new ATOM 0 HB2 LEU A 80 19.214 -25.549 -33.524 1.00 0.00 H new ATOM 0 HB3 LEU A 80 19.146 -25.766 -31.786 1.00 0.00 H new ATOM 0 HG LEU A 80 21.575 -24.417 -32.866 1.00 0.00 H new ATOM 0 HD11 LEU A 80 20.413 -22.248 -32.997 1.00 0.00 H new ATOM 0 HD12 LEU A 80 19.804 -23.397 -34.212 1.00 0.00 H new ATOM 0 HD13 LEU A 80 18.856 -23.071 -32.741 1.00 0.00 H new ATOM 0 HD21 LEU A 80 21.273 -23.058 -30.831 1.00 0.00 H new ATOM 0 HD22 LEU A 80 19.750 -23.912 -30.492 1.00 0.00 H new ATOM 0 HD23 LEU A 80 21.292 -24.799 -30.464 1.00 0.00 H new ATOM 1201 N ARG A 81 21.361 -26.153 -34.969 1.00 0.00 N ATOM 1202 CA ARG A 81 22.283 -25.904 -36.072 1.00 0.00 C ATOM 1203 C ARG A 81 22.391 -24.411 -36.365 1.00 0.00 C ATOM 1204 O ARG A 81 21.662 -23.602 -35.792 1.00 0.00 O ATOM 1205 CB ARG A 81 21.823 -26.649 -37.326 1.00 0.00 C ATOM 1206 CG ARG A 81 22.957 -26.995 -38.279 1.00 0.00 C ATOM 1207 CD ARG A 81 22.838 -26.240 -39.593 1.00 0.00 C ATOM 1208 NE ARG A 81 23.200 -27.074 -40.737 1.00 0.00 N ATOM 1209 CZ ARG A 81 22.851 -26.803 -41.993 1.00 0.00 C ATOM 1210 NH1 ARG A 81 22.136 -25.720 -42.272 1.00 0.00 N ATOM 1211 NH2 ARG A 81 23.219 -27.617 -42.972 1.00 0.00 N ATOM 0 H ARG A 81 20.393 -25.898 -35.163 1.00 0.00 H new ATOM 0 HA ARG A 81 23.267 -26.271 -35.780 1.00 0.00 H new ATOM 0 HB2 ARG A 81 21.317 -27.567 -37.028 1.00 0.00 H new ATOM 0 HB3 ARG A 81 21.090 -26.038 -37.853 1.00 0.00 H new ATOM 0 HG2 ARG A 81 23.912 -26.759 -37.809 1.00 0.00 H new ATOM 0 HG3 ARG A 81 22.954 -28.067 -38.474 1.00 0.00 H new ATOM 0 HD2 ARG A 81 21.816 -25.882 -39.714 1.00 0.00 H new ATOM 0 HD3 ARG A 81 23.483 -25.361 -39.566 1.00 0.00 H new ATOM 0 HE ARG A 81 23.753 -27.913 -40.563 1.00 0.00 H new ATOM 0 HH11 ARG A 81 21.851 -25.090 -41.522 1.00 0.00 H new ATOM 0 HH12 ARG A 81 21.872 -25.518 -43.236 1.00 0.00 H new ATOM 0 HH21 ARG A 81 23.769 -28.450 -42.763 1.00 0.00 H new ATOM 0 HH22 ARG A 81 22.952 -27.410 -43.935 1.00 0.00 H new ATOM 1225 N ALA A 82 23.305 -24.055 -37.261 1.00 0.00 N ATOM 1226 CA ALA A 82 23.509 -22.660 -37.631 1.00 0.00 C ATOM 1227 C ALA A 82 24.105 -22.544 -39.030 1.00 0.00 C ATOM 1228 O ALA A 82 24.805 -23.443 -39.493 1.00 0.00 O ATOM 1229 CB ALA A 82 24.406 -21.970 -36.614 1.00 0.00 C ATOM 0 H ALA A 82 23.916 -24.713 -37.744 1.00 0.00 H new ATOM 0 HA ALA A 82 22.537 -22.166 -37.637 1.00 0.00 H new ATOM 0 HB1 ALA A 82 24.550 -20.929 -36.903 1.00 0.00 H new ATOM 0 HB2 ALA A 82 23.940 -22.012 -35.630 1.00 0.00 H new ATOM 0 HB3 ALA A 82 25.372 -22.474 -36.580 1.00 0.00 H new ATOM 1235 N ASP A 83 23.823 -21.430 -39.696 1.00 0.00 N ATOM 1236 CA ASP A 83 24.332 -21.194 -41.043 1.00 0.00 C ATOM 1237 C ASP A 83 25.314 -20.022 -41.054 1.00 0.00 C ATOM 1238 O ASP A 83 25.066 -18.993 -40.425 1.00 0.00 O ATOM 1239 CB ASP A 83 23.173 -20.916 -42.004 1.00 0.00 C ATOM 1240 CG ASP A 83 22.884 -22.092 -42.916 1.00 0.00 C ATOM 1241 OD1 ASP A 83 23.849 -22.733 -43.381 1.00 0.00 O ATOM 1242 OD2 ASP A 83 21.692 -22.370 -43.165 1.00 0.00 O ATOM 0 H ASP A 83 23.245 -20.676 -39.326 1.00 0.00 H new ATOM 0 HA ASP A 83 24.860 -22.089 -41.371 1.00 0.00 H new ATOM 0 HB2 ASP A 83 22.278 -20.676 -41.430 1.00 0.00 H new ATOM 0 HB3 ASP A 83 23.408 -20.040 -42.609 1.00 0.00 H new ATOM 1247 N PRO A 84 26.445 -20.158 -41.771 1.00 0.00 N ATOM 1248 CA PRO A 84 27.455 -19.096 -41.850 1.00 0.00 C ATOM 1249 C PRO A 84 26.882 -17.785 -42.389 1.00 0.00 C ATOM 1250 O PRO A 84 27.125 -16.718 -41.824 1.00 0.00 O ATOM 1251 CB PRO A 84 28.508 -19.657 -42.813 1.00 0.00 C ATOM 1252 CG PRO A 84 28.296 -21.132 -42.807 1.00 0.00 C ATOM 1253 CD PRO A 84 26.830 -21.345 -42.554 1.00 0.00 C ATOM 0 HA PRO A 84 27.854 -18.850 -40.866 1.00 0.00 H new ATOM 0 HB2 PRO A 84 28.385 -19.245 -43.815 1.00 0.00 H new ATOM 0 HB3 PRO A 84 29.516 -19.403 -42.486 1.00 0.00 H new ATOM 0 HG2 PRO A 84 28.595 -21.572 -43.759 1.00 0.00 H new ATOM 0 HG3 PRO A 84 28.898 -21.608 -42.033 1.00 0.00 H new ATOM 0 HD2 PRO A 84 26.267 -21.413 -43.485 1.00 0.00 H new ATOM 0 HD3 PRO A 84 26.647 -22.267 -42.003 1.00 0.00 H new ATOM 1261 N PRO A 85 26.108 -17.840 -43.491 1.00 0.00 N ATOM 1262 CA PRO A 85 25.507 -16.643 -44.090 1.00 0.00 C ATOM 1263 C PRO A 85 24.642 -15.873 -43.098 1.00 0.00 C ATOM 1264 O PRO A 85 24.635 -14.642 -43.088 1.00 0.00 O ATOM 1265 CB PRO A 85 24.644 -17.198 -45.227 1.00 0.00 C ATOM 1266 CG PRO A 85 25.228 -18.532 -45.538 1.00 0.00 C ATOM 1267 CD PRO A 85 25.757 -19.063 -44.236 1.00 0.00 C ATOM 0 HA PRO A 85 26.266 -15.935 -44.423 1.00 0.00 H new ATOM 0 HB2 PRO A 85 23.601 -17.285 -44.924 1.00 0.00 H new ATOM 0 HB3 PRO A 85 24.670 -16.543 -46.098 1.00 0.00 H new ATOM 0 HG2 PRO A 85 24.475 -19.200 -45.955 1.00 0.00 H new ATOM 0 HG3 PRO A 85 26.024 -18.447 -46.278 1.00 0.00 H new ATOM 0 HD2 PRO A 85 25.009 -19.655 -43.709 1.00 0.00 H new ATOM 0 HD3 PRO A 85 26.624 -19.706 -44.386 1.00 0.00 H new ATOM 1275 N SER A 86 23.911 -16.607 -42.263 1.00 0.00 N ATOM 1276 CA SER A 86 23.040 -15.994 -41.269 1.00 0.00 C ATOM 1277 C SER A 86 23.753 -15.858 -39.928 1.00 0.00 C ATOM 1278 O SER A 86 24.833 -16.414 -39.728 1.00 0.00 O ATOM 1279 CB SER A 86 21.764 -16.820 -41.099 1.00 0.00 C ATOM 1280 OG SER A 86 21.184 -17.129 -42.354 1.00 0.00 O ATOM 0 H SER A 86 23.906 -17.627 -42.256 1.00 0.00 H new ATOM 0 HA SER A 86 22.776 -14.997 -41.622 1.00 0.00 H new ATOM 0 HB2 SER A 86 21.993 -17.742 -40.564 1.00 0.00 H new ATOM 0 HB3 SER A 86 21.048 -16.267 -40.490 1.00 0.00 H new ATOM 0 HG SER A 86 20.371 -17.659 -42.217 1.00 0.00 H new ATOM 1286 N THR A 87 23.142 -15.113 -39.013 1.00 0.00 N ATOM 1287 CA THR A 87 23.715 -14.899 -37.688 1.00 0.00 C ATOM 1288 C THR A 87 22.790 -14.040 -36.833 1.00 0.00 C ATOM 1289 O THR A 87 22.619 -14.288 -35.639 1.00 0.00 O ATOM 1290 CB THR A 87 25.086 -14.232 -37.804 1.00 0.00 C ATOM 1291 OG1 THR A 87 25.650 -14.019 -36.523 1.00 0.00 O ATOM 1292 CG2 THR A 87 25.042 -12.897 -38.515 1.00 0.00 C ATOM 0 H THR A 87 22.248 -14.646 -39.165 1.00 0.00 H new ATOM 0 HA THR A 87 23.832 -15.870 -37.207 1.00 0.00 H new ATOM 0 HB THR A 87 25.694 -14.919 -38.393 1.00 0.00 H new ATOM 0 HG1 THR A 87 26.527 -13.593 -36.619 1.00 0.00 H new ATOM 0 HG21 THR A 87 26.047 -12.477 -38.564 1.00 0.00 H new ATOM 0 HG22 THR A 87 24.657 -13.035 -39.525 1.00 0.00 H new ATOM 0 HG23 THR A 87 24.390 -12.215 -37.969 1.00 0.00 H new ATOM 1300 N ASP A 88 22.195 -13.028 -37.455 1.00 0.00 N ATOM 1301 CA ASP A 88 21.284 -12.127 -36.759 1.00 0.00 C ATOM 1302 C ASP A 88 20.505 -11.274 -37.755 1.00 0.00 C ATOM 1303 O ASP A 88 20.987 -10.992 -38.853 1.00 0.00 O ATOM 1304 CB ASP A 88 22.059 -11.228 -35.794 1.00 0.00 C ATOM 1305 CG ASP A 88 23.232 -10.538 -36.463 1.00 0.00 C ATOM 1306 OD1 ASP A 88 23.214 -10.405 -37.704 1.00 0.00 O ATOM 1307 OD2 ASP A 88 24.168 -10.129 -35.744 1.00 0.00 O ATOM 0 H ASP A 88 22.328 -12.811 -38.443 1.00 0.00 H new ATOM 0 HA ASP A 88 20.577 -12.730 -36.190 1.00 0.00 H new ATOM 0 HB2 ASP A 88 21.386 -10.476 -35.382 1.00 0.00 H new ATOM 0 HB3 ASP A 88 22.421 -11.825 -34.957 1.00 0.00 H new ATOM 1312 N LEU A 89 19.296 -10.869 -37.366 1.00 0.00 N ATOM 1313 CA LEU A 89 18.437 -10.047 -38.221 1.00 0.00 C ATOM 1314 C LEU A 89 17.716 -10.899 -39.264 1.00 0.00 C ATOM 1315 O LEU A 89 16.501 -10.790 -39.434 1.00 0.00 O ATOM 1316 CB LEU A 89 19.243 -8.942 -38.913 1.00 0.00 C ATOM 1317 CG LEU A 89 18.454 -7.673 -39.241 1.00 0.00 C ATOM 1318 CD1 LEU A 89 18.675 -6.614 -38.171 1.00 0.00 C ATOM 1319 CD2 LEU A 89 18.845 -7.137 -40.610 1.00 0.00 C ATOM 0 H LEU A 89 18.887 -11.098 -36.460 1.00 0.00 H new ATOM 0 HA LEU A 89 17.689 -9.582 -37.578 1.00 0.00 H new ATOM 0 HB2 LEU A 89 20.085 -8.673 -38.275 1.00 0.00 H new ATOM 0 HB3 LEU A 89 19.659 -9.342 -39.838 1.00 0.00 H new ATOM 0 HG LEU A 89 17.394 -7.926 -39.261 1.00 0.00 H new ATOM 0 HD11 LEU A 89 18.106 -5.719 -38.422 1.00 0.00 H new ATOM 0 HD12 LEU A 89 18.343 -6.997 -37.206 1.00 0.00 H new ATOM 0 HD13 LEU A 89 19.735 -6.367 -38.117 1.00 0.00 H new ATOM 0 HD21 LEU A 89 18.273 -6.234 -40.824 1.00 0.00 H new ATOM 0 HD22 LEU A 89 19.909 -6.902 -40.618 1.00 0.00 H new ATOM 0 HD23 LEU A 89 18.633 -7.890 -41.369 1.00 0.00 H new ATOM 1331 N ASN A 90 18.468 -11.744 -39.967 1.00 0.00 N ATOM 1332 CA ASN A 90 17.897 -12.609 -40.998 1.00 0.00 C ATOM 1333 C ASN A 90 16.659 -13.347 -40.487 1.00 0.00 C ATOM 1334 O ASN A 90 15.632 -13.390 -41.164 1.00 0.00 O ATOM 1335 CB ASN A 90 18.943 -13.618 -41.478 1.00 0.00 C ATOM 1336 CG ASN A 90 18.926 -13.795 -42.984 1.00 0.00 C ATOM 1337 OD1 ASN A 90 17.864 -13.905 -43.597 1.00 0.00 O ATOM 1338 ND2 ASN A 90 20.108 -13.823 -43.589 1.00 0.00 N ATOM 0 H ASN A 90 19.475 -11.848 -39.841 1.00 0.00 H new ATOM 0 HA ASN A 90 17.593 -11.977 -41.832 1.00 0.00 H new ATOM 0 HB2 ASN A 90 19.933 -13.288 -41.165 1.00 0.00 H new ATOM 0 HB3 ASN A 90 18.762 -14.581 -41.000 1.00 0.00 H new ATOM 0 HD21 ASN A 90 20.160 -13.939 -44.601 1.00 0.00 H new ATOM 0 HD22 ASN A 90 20.963 -13.728 -43.042 1.00 0.00 H new ATOM 1345 N THR A 91 16.765 -13.934 -39.298 1.00 0.00 N ATOM 1346 CA THR A 91 15.652 -14.679 -38.713 1.00 0.00 C ATOM 1347 C THR A 91 14.428 -13.790 -38.459 1.00 0.00 C ATOM 1348 O THR A 91 13.337 -14.299 -38.196 1.00 0.00 O ATOM 1349 CB THR A 91 16.091 -15.337 -37.404 1.00 0.00 C ATOM 1350 OG1 THR A 91 16.782 -14.411 -36.585 1.00 0.00 O ATOM 1351 CG2 THR A 91 16.995 -16.533 -37.610 1.00 0.00 C ATOM 0 H THR A 91 17.606 -13.909 -38.722 1.00 0.00 H new ATOM 0 HA THR A 91 15.361 -15.443 -39.434 1.00 0.00 H new ATOM 0 HB THR A 91 15.171 -15.676 -36.927 1.00 0.00 H new ATOM 0 HG1 THR A 91 16.178 -13.680 -36.337 1.00 0.00 H new ATOM 0 HG21 THR A 91 17.270 -16.953 -36.642 1.00 0.00 H new ATOM 0 HG22 THR A 91 16.472 -17.288 -38.197 1.00 0.00 H new ATOM 0 HG23 THR A 91 17.896 -16.221 -38.139 1.00 0.00 H new ATOM 1359 N PHE A 92 14.599 -12.470 -38.538 1.00 0.00 N ATOM 1360 CA PHE A 92 13.494 -11.545 -38.316 1.00 0.00 C ATOM 1361 C PHE A 92 13.182 -10.769 -39.596 1.00 0.00 C ATOM 1362 O PHE A 92 14.053 -10.102 -40.154 1.00 0.00 O ATOM 1363 CB PHE A 92 13.829 -10.580 -37.172 1.00 0.00 C ATOM 1364 CG PHE A 92 14.507 -11.238 -36.005 1.00 0.00 C ATOM 1365 CD1 PHE A 92 15.843 -11.597 -36.071 1.00 0.00 C ATOM 1366 CD2 PHE A 92 13.803 -11.495 -34.840 1.00 0.00 C ATOM 1367 CE1 PHE A 92 16.465 -12.199 -34.995 1.00 0.00 C ATOM 1368 CE2 PHE A 92 14.419 -12.097 -33.761 1.00 0.00 C ATOM 1369 CZ PHE A 92 15.753 -12.450 -33.838 1.00 0.00 C ATOM 0 H PHE A 92 15.489 -12.021 -38.753 1.00 0.00 H new ATOM 0 HA PHE A 92 12.611 -12.120 -38.037 1.00 0.00 H new ATOM 0 HB2 PHE A 92 14.472 -9.787 -37.554 1.00 0.00 H new ATOM 0 HB3 PHE A 92 12.910 -10.107 -36.827 1.00 0.00 H new ATOM 0 HD1 PHE A 92 16.404 -11.404 -36.973 1.00 0.00 H new ATOM 0 HD2 PHE A 92 12.760 -11.221 -34.775 1.00 0.00 H new ATOM 0 HE1 PHE A 92 17.508 -12.473 -35.058 1.00 0.00 H new ATOM 0 HE2 PHE A 92 13.859 -12.292 -32.858 1.00 0.00 H new ATOM 0 HZ PHE A 92 16.238 -12.921 -32.996 1.00 0.00 H new ATOM 1379 N THR A 93 11.938 -10.872 -40.062 1.00 0.00 N ATOM 1380 CA THR A 93 11.518 -10.190 -41.285 1.00 0.00 C ATOM 1381 C THR A 93 11.096 -8.741 -41.004 1.00 0.00 C ATOM 1382 O THR A 93 11.948 -7.858 -40.901 1.00 0.00 O ATOM 1383 CB THR A 93 10.383 -10.971 -41.959 1.00 0.00 C ATOM 1384 OG1 THR A 93 10.809 -12.281 -42.291 1.00 0.00 O ATOM 1385 CG2 THR A 93 9.874 -10.320 -43.227 1.00 0.00 C ATOM 0 H THR A 93 11.205 -11.420 -39.612 1.00 0.00 H new ATOM 0 HA THR A 93 12.370 -10.153 -41.964 1.00 0.00 H new ATOM 0 HB THR A 93 9.572 -10.988 -41.231 1.00 0.00 H new ATOM 0 HG1 THR A 93 10.072 -12.766 -42.718 1.00 0.00 H new ATOM 0 HG21 THR A 93 9.073 -10.926 -43.651 1.00 0.00 H new ATOM 0 HG22 THR A 93 9.494 -9.324 -42.998 1.00 0.00 H new ATOM 0 HG23 THR A 93 10.688 -10.240 -43.947 1.00 0.00 H new ATOM 1393 N VAL A 94 9.789 -8.491 -40.885 1.00 0.00 N ATOM 1394 CA VAL A 94 9.291 -7.144 -40.623 1.00 0.00 C ATOM 1395 C VAL A 94 8.095 -7.168 -39.674 1.00 0.00 C ATOM 1396 O VAL A 94 8.118 -6.542 -38.615 1.00 0.00 O ATOM 1397 CB VAL A 94 8.890 -6.430 -41.932 1.00 0.00 C ATOM 1398 CG1 VAL A 94 8.468 -4.993 -41.656 1.00 0.00 C ATOM 1399 CG2 VAL A 94 10.035 -6.473 -42.933 1.00 0.00 C ATOM 0 H VAL A 94 9.062 -9.202 -40.966 1.00 0.00 H new ATOM 0 HA VAL A 94 10.105 -6.592 -40.153 1.00 0.00 H new ATOM 0 HB VAL A 94 8.037 -6.955 -42.362 1.00 0.00 H new ATOM 0 HG11 VAL A 94 8.190 -4.509 -42.592 1.00 0.00 H new ATOM 0 HG12 VAL A 94 7.615 -4.988 -40.978 1.00 0.00 H new ATOM 0 HG13 VAL A 94 9.297 -4.452 -41.200 1.00 0.00 H new ATOM 0 HG21 VAL A 94 9.736 -5.965 -43.850 1.00 0.00 H new ATOM 0 HG22 VAL A 94 10.907 -5.974 -42.510 1.00 0.00 H new ATOM 0 HG23 VAL A 94 10.284 -7.510 -43.157 1.00 0.00 H new ATOM 1409 N GLU A 95 7.059 -7.903 -40.057 1.00 0.00 N ATOM 1410 CA GLU A 95 5.853 -8.025 -39.244 1.00 0.00 C ATOM 1411 C GLU A 95 6.114 -8.889 -38.012 1.00 0.00 C ATOM 1412 O GLU A 95 5.378 -8.825 -37.027 1.00 0.00 O ATOM 1413 CB GLU A 95 4.714 -8.625 -40.069 1.00 0.00 C ATOM 1414 CG GLU A 95 4.995 -10.037 -40.556 1.00 0.00 C ATOM 1415 CD GLU A 95 5.579 -10.067 -41.955 1.00 0.00 C ATOM 1416 OE1 GLU A 95 6.803 -9.863 -42.092 1.00 0.00 O ATOM 1417 OE2 GLU A 95 4.810 -10.293 -42.914 1.00 0.00 O ATOM 0 H GLU A 95 7.029 -8.427 -40.931 1.00 0.00 H new ATOM 0 HA GLU A 95 5.565 -7.027 -38.913 1.00 0.00 H new ATOM 0 HB2 GLU A 95 3.805 -8.631 -39.468 1.00 0.00 H new ATOM 0 HB3 GLU A 95 4.523 -7.984 -40.930 1.00 0.00 H new ATOM 0 HG2 GLU A 95 5.686 -10.524 -39.868 1.00 0.00 H new ATOM 0 HG3 GLU A 95 4.070 -10.613 -40.540 1.00 0.00 H new ATOM 1424 N GLN A 96 7.168 -9.693 -38.080 1.00 0.00 N ATOM 1425 CA GLN A 96 7.543 -10.573 -36.983 1.00 0.00 C ATOM 1426 C GLN A 96 8.324 -9.801 -35.941 1.00 0.00 C ATOM 1427 O GLN A 96 8.417 -10.207 -34.783 1.00 0.00 O ATOM 1428 CB GLN A 96 8.388 -11.739 -37.503 1.00 0.00 C ATOM 1429 CG GLN A 96 7.979 -13.088 -36.934 1.00 0.00 C ATOM 1430 CD GLN A 96 9.158 -14.022 -36.746 1.00 0.00 C ATOM 1431 OE1 GLN A 96 9.272 -14.700 -35.725 1.00 0.00 O ATOM 1432 NE2 GLN A 96 10.044 -14.061 -37.734 1.00 0.00 N ATOM 0 H GLN A 96 7.783 -9.753 -38.892 1.00 0.00 H new ATOM 0 HA GLN A 96 6.635 -10.969 -36.529 1.00 0.00 H new ATOM 0 HB2 GLN A 96 8.313 -11.775 -38.590 1.00 0.00 H new ATOM 0 HB3 GLN A 96 9.435 -11.554 -37.261 1.00 0.00 H new ATOM 0 HG2 GLN A 96 7.482 -12.938 -35.975 1.00 0.00 H new ATOM 0 HG3 GLN A 96 7.253 -13.554 -37.600 1.00 0.00 H new ATOM 0 HE21 GLN A 96 9.910 -13.482 -38.563 1.00 0.00 H new ATOM 0 HE22 GLN A 96 10.859 -14.670 -37.664 1.00 0.00 H new ATOM 1441 N LEU A 97 8.889 -8.684 -36.368 1.00 0.00 N ATOM 1442 CA LEU A 97 9.669 -7.846 -35.488 1.00 0.00 C ATOM 1443 C LEU A 97 8.739 -7.078 -34.571 1.00 0.00 C ATOM 1444 O LEU A 97 8.805 -7.191 -33.347 1.00 0.00 O ATOM 1445 CB LEU A 97 10.514 -6.857 -36.298 1.00 0.00 C ATOM 1446 CG LEU A 97 11.510 -7.437 -37.309 1.00 0.00 C ATOM 1447 CD1 LEU A 97 10.998 -8.712 -37.964 1.00 0.00 C ATOM 1448 CD2 LEU A 97 11.795 -6.394 -38.367 1.00 0.00 C ATOM 0 H LEU A 97 8.818 -8.339 -37.325 1.00 0.00 H new ATOM 0 HA LEU A 97 10.334 -8.478 -34.900 1.00 0.00 H new ATOM 0 HB2 LEU A 97 9.834 -6.197 -36.837 1.00 0.00 H new ATOM 0 HB3 LEU A 97 11.071 -6.237 -35.596 1.00 0.00 H new ATOM 0 HG LEU A 97 12.421 -7.700 -36.772 1.00 0.00 H new ATOM 0 HD11 LEU A 97 11.741 -9.081 -38.671 1.00 0.00 H new ATOM 0 HD12 LEU A 97 10.818 -9.467 -37.199 1.00 0.00 H new ATOM 0 HD13 LEU A 97 10.068 -8.502 -38.492 1.00 0.00 H new ATOM 0 HD21 LEU A 97 12.503 -6.795 -39.092 1.00 0.00 H new ATOM 0 HD22 LEU A 97 10.868 -6.127 -38.874 1.00 0.00 H new ATOM 0 HD23 LEU A 97 12.220 -5.507 -37.898 1.00 0.00 H new ATOM 1460 N LYS A 98 7.862 -6.307 -35.190 1.00 0.00 N ATOM 1461 CA LYS A 98 6.884 -5.514 -34.458 1.00 0.00 C ATOM 1462 C LYS A 98 6.015 -6.402 -33.571 1.00 0.00 C ATOM 1463 O LYS A 98 5.497 -5.952 -32.552 1.00 0.00 O ATOM 1464 CB LYS A 98 6.007 -4.729 -35.434 1.00 0.00 C ATOM 1465 CG LYS A 98 5.283 -5.604 -36.444 1.00 0.00 C ATOM 1466 CD LYS A 98 4.933 -4.828 -37.706 1.00 0.00 C ATOM 1467 CE LYS A 98 6.174 -4.249 -38.369 1.00 0.00 C ATOM 1468 NZ LYS A 98 6.146 -4.419 -39.847 1.00 0.00 N ATOM 0 H LYS A 98 7.806 -6.212 -36.204 1.00 0.00 H new ATOM 0 HA LYS A 98 7.422 -4.814 -33.819 1.00 0.00 H new ATOM 0 HB2 LYS A 98 5.271 -4.157 -34.868 1.00 0.00 H new ATOM 0 HB3 LYS A 98 6.627 -4.010 -35.968 1.00 0.00 H new ATOM 0 HG2 LYS A 98 5.910 -6.457 -36.703 1.00 0.00 H new ATOM 0 HG3 LYS A 98 4.372 -6.001 -35.996 1.00 0.00 H new ATOM 0 HD2 LYS A 98 4.418 -5.485 -38.407 1.00 0.00 H new ATOM 0 HD3 LYS A 98 4.242 -4.022 -37.459 1.00 0.00 H new ATOM 0 HE2 LYS A 98 6.253 -3.189 -38.127 1.00 0.00 H new ATOM 0 HE3 LYS A 98 7.062 -4.735 -37.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 6.966 -3.938 -40.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 6.182 -5.432 -40.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 5.270 -4.007 -40.227 1.00 0.00 H new ATOM 1482 N ALA A 99 5.855 -7.665 -33.962 1.00 0.00 N ATOM 1483 CA ALA A 99 5.042 -8.601 -33.191 1.00 0.00 C ATOM 1484 C ALA A 99 5.839 -9.241 -32.064 1.00 0.00 C ATOM 1485 O ALA A 99 5.275 -9.720 -31.080 1.00 0.00 O ATOM 1486 CB ALA A 99 4.451 -9.667 -34.100 1.00 0.00 C ATOM 0 H ALA A 99 6.275 -8.061 -34.803 1.00 0.00 H new ATOM 0 HA ALA A 99 4.228 -8.036 -32.738 1.00 0.00 H new ATOM 0 HB1 ALA A 99 3.848 -10.356 -33.509 1.00 0.00 H new ATOM 0 HB2 ALA A 99 3.825 -9.194 -34.856 1.00 0.00 H new ATOM 0 HB3 ALA A 99 5.256 -10.216 -34.588 1.00 0.00 H new ATOM 1492 N GLN A 100 7.149 -9.238 -32.215 1.00 0.00 N ATOM 1493 CA GLN A 100 8.039 -9.812 -31.212 1.00 0.00 C ATOM 1494 C GLN A 100 8.378 -8.783 -30.139 1.00 0.00 C ATOM 1495 O GLN A 100 8.469 -9.112 -28.956 1.00 0.00 O ATOM 1496 CB GLN A 100 9.318 -10.334 -31.869 1.00 0.00 C ATOM 1497 CG GLN A 100 9.347 -11.846 -32.025 1.00 0.00 C ATOM 1498 CD GLN A 100 10.355 -12.309 -33.059 1.00 0.00 C ATOM 1499 OE1 GLN A 100 10.548 -11.661 -34.088 1.00 0.00 O ATOM 1500 NE2 GLN A 100 11.003 -13.437 -32.790 1.00 0.00 N ATOM 0 H GLN A 100 7.627 -8.844 -33.025 1.00 0.00 H new ATOM 0 HA GLN A 100 7.524 -10.647 -30.737 1.00 0.00 H new ATOM 0 HB2 GLN A 100 9.426 -9.873 -32.851 1.00 0.00 H new ATOM 0 HB3 GLN A 100 10.176 -10.022 -31.274 1.00 0.00 H new ATOM 0 HG2 GLN A 100 9.584 -12.302 -31.064 1.00 0.00 H new ATOM 0 HG3 GLN A 100 8.355 -12.197 -32.308 1.00 0.00 H new ATOM 0 HE21 GLN A 100 10.811 -13.941 -31.924 1.00 0.00 H new ATOM 0 HE22 GLN A 100 11.692 -13.799 -33.449 1.00 0.00 H new ATOM 1509 N LEU A 101 8.562 -7.535 -30.559 1.00 0.00 N ATOM 1510 CA LEU A 101 8.889 -6.461 -29.631 1.00 0.00 C ATOM 1511 C LEU A 101 7.747 -6.234 -28.647 1.00 0.00 C ATOM 1512 O LEU A 101 7.973 -6.058 -27.449 1.00 0.00 O ATOM 1513 CB LEU A 101 9.187 -5.168 -30.395 1.00 0.00 C ATOM 1514 CG LEU A 101 10.575 -5.102 -31.036 1.00 0.00 C ATOM 1515 CD1 LEU A 101 10.787 -3.754 -31.708 1.00 0.00 C ATOM 1516 CD2 LEU A 101 11.654 -5.357 -29.995 1.00 0.00 C ATOM 0 H LEU A 101 8.490 -7.244 -31.534 1.00 0.00 H new ATOM 0 HA LEU A 101 9.778 -6.753 -29.071 1.00 0.00 H new ATOM 0 HB2 LEU A 101 8.436 -5.043 -31.175 1.00 0.00 H new ATOM 0 HB3 LEU A 101 9.079 -4.326 -29.711 1.00 0.00 H new ATOM 0 HG LEU A 101 10.642 -5.879 -31.797 1.00 0.00 H new ATOM 0 HD11 LEU A 101 11.779 -3.724 -32.159 1.00 0.00 H new ATOM 0 HD12 LEU A 101 10.033 -3.610 -32.481 1.00 0.00 H new ATOM 0 HD13 LEU A 101 10.702 -2.960 -30.966 1.00 0.00 H new ATOM 0 HD21 LEU A 101 12.635 -5.306 -30.468 1.00 0.00 H new ATOM 0 HD22 LEU A 101 11.589 -4.602 -29.212 1.00 0.00 H new ATOM 0 HD23 LEU A 101 11.512 -6.346 -29.559 1.00 0.00 H new ATOM 1528 N THR A 102 6.518 -6.251 -29.155 1.00 0.00 N ATOM 1529 CA THR A 102 5.347 -6.059 -28.308 1.00 0.00 C ATOM 1530 C THR A 102 5.215 -7.218 -27.339 1.00 0.00 C ATOM 1531 O THR A 102 4.888 -7.033 -26.167 1.00 0.00 O ATOM 1532 CB THR A 102 4.073 -5.961 -29.147 1.00 0.00 C ATOM 1533 OG1 THR A 102 3.674 -7.241 -29.601 1.00 0.00 O ATOM 1534 CG2 THR A 102 4.217 -5.073 -30.357 1.00 0.00 C ATOM 0 H THR A 102 6.309 -6.395 -30.143 1.00 0.00 H new ATOM 0 HA THR A 102 5.478 -5.127 -27.758 1.00 0.00 H new ATOM 0 HB THR A 102 3.326 -5.523 -28.484 1.00 0.00 H new ATOM 0 HG1 THR A 102 2.856 -7.159 -30.135 1.00 0.00 H new ATOM 0 HG21 THR A 102 3.275 -5.050 -30.906 1.00 0.00 H new ATOM 0 HG22 THR A 102 4.476 -4.063 -30.039 1.00 0.00 H new ATOM 0 HG23 THR A 102 5.004 -5.463 -31.003 1.00 0.00 H new ATOM 1542 N GLU A 103 5.471 -8.418 -27.844 1.00 0.00 N ATOM 1543 CA GLU A 103 5.378 -9.613 -27.026 1.00 0.00 C ATOM 1544 C GLU A 103 6.557 -9.721 -26.065 1.00 0.00 C ATOM 1545 O GLU A 103 6.590 -10.598 -25.202 1.00 0.00 O ATOM 1546 CB GLU A 103 5.293 -10.863 -27.905 1.00 0.00 C ATOM 1547 CG GLU A 103 4.261 -11.872 -27.427 1.00 0.00 C ATOM 1548 CD GLU A 103 4.873 -12.978 -26.590 1.00 0.00 C ATOM 1549 OE1 GLU A 103 5.504 -13.885 -27.173 1.00 0.00 O ATOM 1550 OE2 GLU A 103 4.720 -12.938 -25.350 1.00 0.00 O ATOM 0 H GLU A 103 5.743 -8.586 -28.813 1.00 0.00 H new ATOM 0 HA GLU A 103 4.466 -9.538 -26.434 1.00 0.00 H new ATOM 0 HB2 GLU A 103 5.052 -10.564 -28.925 1.00 0.00 H new ATOM 0 HB3 GLU A 103 6.271 -11.343 -27.936 1.00 0.00 H new ATOM 0 HG2 GLU A 103 3.499 -11.358 -26.842 1.00 0.00 H new ATOM 0 HG3 GLU A 103 3.759 -12.310 -28.290 1.00 0.00 H new ATOM 1557 N ARG A 104 7.521 -8.824 -26.219 1.00 0.00 N ATOM 1558 CA ARG A 104 8.703 -8.810 -25.365 1.00 0.00 C ATOM 1559 C ARG A 104 8.648 -7.655 -24.366 1.00 0.00 C ATOM 1560 O ARG A 104 9.397 -7.634 -23.389 1.00 0.00 O ATOM 1561 CB ARG A 104 9.970 -8.703 -26.214 1.00 0.00 C ATOM 1562 CG ARG A 104 10.451 -10.038 -26.760 1.00 0.00 C ATOM 1563 CD ARG A 104 11.943 -10.014 -27.050 1.00 0.00 C ATOM 1564 NE ARG A 104 12.482 -11.357 -27.258 1.00 0.00 N ATOM 1565 CZ ARG A 104 13.775 -11.658 -27.175 1.00 0.00 C ATOM 1566 NH1 ARG A 104 14.666 -10.715 -26.891 1.00 0.00 N ATOM 1567 NH2 ARG A 104 14.181 -12.904 -27.377 1.00 0.00 N ATOM 0 H ARG A 104 7.508 -8.093 -26.930 1.00 0.00 H new ATOM 0 HA ARG A 104 8.723 -9.746 -24.806 1.00 0.00 H new ATOM 0 HB2 ARG A 104 9.783 -8.025 -27.047 1.00 0.00 H new ATOM 0 HB3 ARG A 104 10.763 -8.258 -25.613 1.00 0.00 H new ATOM 0 HG2 ARG A 104 10.231 -10.827 -26.041 1.00 0.00 H new ATOM 0 HG3 ARG A 104 9.905 -10.277 -27.673 1.00 0.00 H new ATOM 0 HD2 ARG A 104 12.130 -9.407 -27.936 1.00 0.00 H new ATOM 0 HD3 ARG A 104 12.466 -9.538 -26.221 1.00 0.00 H new ATOM 0 HE ARG A 104 11.828 -12.108 -27.480 1.00 0.00 H new ATOM 0 HH11 ARG A 104 14.360 -9.755 -26.735 1.00 0.00 H new ATOM 0 HH12 ARG A 104 15.656 -10.951 -26.829 1.00 0.00 H new ATOM 0 HH21 ARG A 104 13.502 -13.633 -27.596 1.00 0.00 H new ATOM 0 HH22 ARG A 104 15.173 -13.134 -27.313 1.00 0.00 H new ATOM 1581 N GLY A 105 7.759 -6.696 -24.614 1.00 0.00 N ATOM 1582 CA GLY A 105 7.630 -5.557 -23.725 1.00 0.00 C ATOM 1583 C GLY A 105 8.546 -4.413 -24.108 1.00 0.00 C ATOM 1584 O GLY A 105 9.163 -3.789 -23.245 1.00 0.00 O ATOM 0 H GLY A 105 7.127 -6.689 -25.414 1.00 0.00 H new ATOM 0 HA2 GLY A 105 6.597 -5.209 -23.734 1.00 0.00 H new ATOM 0 HA3 GLY A 105 7.852 -5.870 -22.705 1.00 0.00 H new ATOM 1588 N ILE A 106 8.637 -4.137 -25.405 1.00 0.00 N ATOM 1589 CA ILE A 106 9.487 -3.061 -25.899 1.00 0.00 C ATOM 1590 C ILE A 106 8.712 -2.125 -26.822 1.00 0.00 C ATOM 1591 O ILE A 106 8.629 -2.358 -28.029 1.00 0.00 O ATOM 1592 CB ILE A 106 10.708 -3.615 -26.660 1.00 0.00 C ATOM 1593 CG1 ILE A 106 11.416 -4.684 -25.826 1.00 0.00 C ATOM 1594 CG2 ILE A 106 11.668 -2.490 -27.016 1.00 0.00 C ATOM 1595 CD1 ILE A 106 12.062 -4.143 -24.569 1.00 0.00 C ATOM 0 H ILE A 106 8.132 -4.644 -26.132 1.00 0.00 H new ATOM 0 HA ILE A 106 9.830 -2.505 -25.027 1.00 0.00 H new ATOM 0 HB ILE A 106 10.361 -4.075 -27.585 1.00 0.00 H new ATOM 0 HG12 ILE A 106 10.696 -5.455 -25.551 1.00 0.00 H new ATOM 0 HG13 ILE A 106 12.179 -5.164 -26.439 1.00 0.00 H new ATOM 0 HG21 ILE A 106 12.524 -2.899 -27.553 1.00 0.00 H new ATOM 0 HG22 ILE A 106 11.158 -1.762 -27.647 1.00 0.00 H new ATOM 0 HG23 ILE A 106 12.011 -2.002 -26.104 1.00 0.00 H new ATOM 0 HD11 ILE A 106 12.545 -4.957 -24.029 1.00 0.00 H new ATOM 0 HD12 ILE A 106 12.807 -3.393 -24.836 1.00 0.00 H new ATOM 0 HD13 ILE A 106 11.301 -3.688 -23.935 1.00 0.00 H new ATOM 1607 N THR A 107 8.145 -1.065 -26.251 1.00 0.00 N ATOM 1608 CA THR A 107 7.378 -0.097 -27.030 1.00 0.00 C ATOM 1609 C THR A 107 8.231 0.502 -28.144 1.00 0.00 C ATOM 1610 O THR A 107 9.451 0.602 -28.020 1.00 0.00 O ATOM 1611 CB THR A 107 6.851 1.017 -26.124 1.00 0.00 C ATOM 1612 OG1 THR A 107 7.776 1.304 -25.090 1.00 0.00 O ATOM 1613 CG2 THR A 107 5.526 0.683 -25.473 1.00 0.00 C ATOM 0 H THR A 107 8.202 -0.855 -25.254 1.00 0.00 H new ATOM 0 HA THR A 107 6.534 -0.619 -27.481 1.00 0.00 H new ATOM 0 HB THR A 107 6.710 1.877 -26.778 1.00 0.00 H new ATOM 0 HG1 THR A 107 7.421 2.020 -24.523 1.00 0.00 H new ATOM 0 HG21 THR A 107 5.210 1.515 -24.844 1.00 0.00 H new ATOM 0 HG22 THR A 107 4.776 0.505 -26.244 1.00 0.00 H new ATOM 0 HG23 THR A 107 5.637 -0.212 -24.861 1.00 0.00 H new ATOM 1621 N PHE A 108 7.580 0.897 -29.234 1.00 0.00 N ATOM 1622 CA PHE A 108 8.280 1.486 -30.370 1.00 0.00 C ATOM 1623 C PHE A 108 7.361 2.412 -31.158 1.00 0.00 C ATOM 1624 O PHE A 108 7.436 2.480 -32.386 1.00 0.00 O ATOM 1625 CB PHE A 108 8.822 0.386 -31.286 1.00 0.00 C ATOM 1626 CG PHE A 108 7.776 -0.596 -31.727 1.00 0.00 C ATOM 1627 CD1 PHE A 108 7.167 -1.439 -30.809 1.00 0.00 C ATOM 1628 CD2 PHE A 108 7.399 -0.678 -33.057 1.00 0.00 C ATOM 1629 CE1 PHE A 108 6.205 -2.344 -31.211 1.00 0.00 C ATOM 1630 CE2 PHE A 108 6.437 -1.582 -33.465 1.00 0.00 C ATOM 1631 CZ PHE A 108 5.838 -2.416 -32.540 1.00 0.00 C ATOM 0 H PHE A 108 6.570 0.820 -29.354 1.00 0.00 H new ATOM 0 HA PHE A 108 9.113 2.075 -29.985 1.00 0.00 H new ATOM 0 HB2 PHE A 108 9.271 0.846 -32.166 1.00 0.00 H new ATOM 0 HB3 PHE A 108 9.616 -0.150 -30.766 1.00 0.00 H new ATOM 0 HD1 PHE A 108 7.449 -1.387 -29.768 1.00 0.00 H new ATOM 0 HD2 PHE A 108 7.862 -0.028 -33.784 1.00 0.00 H new ATOM 0 HE1 PHE A 108 5.740 -2.995 -30.486 1.00 0.00 H new ATOM 0 HE2 PHE A 108 6.153 -1.637 -34.506 1.00 0.00 H new ATOM 0 HZ PHE A 108 5.085 -3.122 -32.856 1.00 0.00 H new ATOM 1641 N LYS A 109 6.495 3.126 -30.446 1.00 0.00 N ATOM 1642 CA LYS A 109 5.563 4.049 -31.081 1.00 0.00 C ATOM 1643 C LYS A 109 6.313 5.146 -31.829 1.00 0.00 C ATOM 1644 O LYS A 109 5.982 5.473 -32.969 1.00 0.00 O ATOM 1645 CB LYS A 109 4.635 4.671 -30.035 1.00 0.00 C ATOM 1646 CG LYS A 109 3.938 3.645 -29.155 1.00 0.00 C ATOM 1647 CD LYS A 109 2.429 3.824 -29.173 1.00 0.00 C ATOM 1648 CE LYS A 109 1.766 2.871 -30.155 1.00 0.00 C ATOM 1649 NZ LYS A 109 0.579 3.484 -30.810 1.00 0.00 N ATOM 0 H LYS A 109 6.420 3.083 -29.430 1.00 0.00 H new ATOM 0 HA LYS A 109 4.964 3.487 -31.798 1.00 0.00 H new ATOM 0 HB2 LYS A 109 5.213 5.346 -29.404 1.00 0.00 H new ATOM 0 HB3 LYS A 109 3.882 5.274 -30.542 1.00 0.00 H new ATOM 0 HG2 LYS A 109 4.190 2.641 -29.497 1.00 0.00 H new ATOM 0 HG3 LYS A 109 4.303 3.734 -28.132 1.00 0.00 H new ATOM 0 HD2 LYS A 109 2.030 3.654 -28.173 1.00 0.00 H new ATOM 0 HD3 LYS A 109 2.187 4.852 -29.442 1.00 0.00 H new ATOM 0 HE2 LYS A 109 2.488 2.575 -30.916 1.00 0.00 H new ATOM 0 HE3 LYS A 109 1.464 1.964 -29.632 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 0.156 2.802 -31.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -0.121 3.744 -30.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 0.871 4.336 -31.331 1.00 0.00 H new ATOM 1663 N GLN A 110 7.327 5.708 -31.181 1.00 0.00 N ATOM 1664 CA GLN A 110 8.129 6.766 -31.785 1.00 0.00 C ATOM 1665 C GLN A 110 9.618 6.518 -31.563 1.00 0.00 C ATOM 1666 O GLN A 110 10.422 7.450 -31.577 1.00 0.00 O ATOM 1667 CB GLN A 110 7.737 8.127 -31.206 1.00 0.00 C ATOM 1668 CG GLN A 110 7.919 9.278 -32.180 1.00 0.00 C ATOM 1669 CD GLN A 110 7.060 10.477 -31.833 1.00 0.00 C ATOM 1670 OE1 GLN A 110 7.256 11.118 -30.799 1.00 0.00 O ATOM 1671 NE2 GLN A 110 6.101 10.789 -32.697 1.00 0.00 N ATOM 0 H GLN A 110 7.613 5.449 -30.237 1.00 0.00 H new ATOM 0 HA GLN A 110 7.935 6.764 -32.858 1.00 0.00 H new ATOM 0 HB2 GLN A 110 6.694 8.091 -30.890 1.00 0.00 H new ATOM 0 HB3 GLN A 110 8.334 8.319 -30.314 1.00 0.00 H new ATOM 0 HG2 GLN A 110 8.967 9.578 -32.191 1.00 0.00 H new ATOM 0 HG3 GLN A 110 7.674 8.939 -33.187 1.00 0.00 H new ATOM 0 HE21 GLN A 110 5.974 10.231 -33.541 1.00 0.00 H new ATOM 0 HE22 GLN A 110 5.492 11.587 -32.516 1.00 0.00 H new ATOM 1680 N SER A 111 9.980 5.254 -31.357 1.00 0.00 N ATOM 1681 CA SER A 111 11.373 4.886 -31.131 1.00 0.00 C ATOM 1682 C SER A 111 11.880 3.960 -32.234 1.00 0.00 C ATOM 1683 O SER A 111 13.051 4.010 -32.608 1.00 0.00 O ATOM 1684 CB SER A 111 11.530 4.208 -29.769 1.00 0.00 C ATOM 1685 OG SER A 111 12.745 4.589 -29.145 1.00 0.00 O ATOM 0 H SER A 111 9.328 4.469 -31.342 1.00 0.00 H new ATOM 0 HA SER A 111 11.969 5.799 -31.146 1.00 0.00 H new ATOM 0 HB2 SER A 111 10.690 4.474 -29.128 1.00 0.00 H new ATOM 0 HB3 SER A 111 11.506 3.125 -29.893 1.00 0.00 H new ATOM 0 HG SER A 111 12.820 4.143 -28.276 1.00 0.00 H new ATOM 1691 N ALA A 112 10.991 3.115 -32.751 1.00 0.00 N ATOM 1692 CA ALA A 112 11.354 2.181 -33.809 1.00 0.00 C ATOM 1693 C ALA A 112 10.247 2.075 -34.853 1.00 0.00 C ATOM 1694 O ALA A 112 9.120 1.691 -34.540 1.00 0.00 O ATOM 1695 CB ALA A 112 11.663 0.812 -33.221 1.00 0.00 C ATOM 0 H ALA A 112 10.017 3.059 -32.454 1.00 0.00 H new ATOM 0 HA ALA A 112 12.247 2.561 -34.304 1.00 0.00 H new ATOM 0 HB1 ALA A 112 11.933 0.124 -34.022 1.00 0.00 H new ATOM 0 HB2 ALA A 112 12.494 0.896 -32.520 1.00 0.00 H new ATOM 0 HB3 ALA A 112 10.784 0.434 -32.699 1.00 0.00 H new ATOM 1701 N THR A 113 10.576 2.420 -36.094 1.00 0.00 N ATOM 1702 CA THR A 113 9.611 2.365 -37.185 1.00 0.00 C ATOM 1703 C THR A 113 9.668 1.023 -37.902 1.00 0.00 C ATOM 1704 O THR A 113 8.775 0.190 -37.749 1.00 0.00 O ATOM 1705 CB THR A 113 9.868 3.500 -38.173 1.00 0.00 C ATOM 1706 OG1 THR A 113 11.130 3.349 -38.797 1.00 0.00 O ATOM 1707 CG2 THR A 113 9.837 4.864 -37.525 1.00 0.00 C ATOM 0 H THR A 113 11.504 2.741 -36.369 1.00 0.00 H new ATOM 0 HA THR A 113 8.614 2.480 -36.760 1.00 0.00 H new ATOM 0 HB THR A 113 9.061 3.439 -38.903 1.00 0.00 H new ATOM 0 HG1 THR A 113 11.274 4.086 -39.427 1.00 0.00 H new ATOM 0 HG21 THR A 113 10.026 5.629 -38.278 1.00 0.00 H new ATOM 0 HG22 THR A 113 8.858 5.031 -37.076 1.00 0.00 H new ATOM 0 HG23 THR A 113 10.604 4.917 -36.753 1.00 0.00 H new ATOM 1715 N LYS A 114 10.720 0.814 -38.688 1.00 0.00 N ATOM 1716 CA LYS A 114 10.874 -0.436 -39.421 1.00 0.00 C ATOM 1717 C LYS A 114 12.331 -0.850 -39.533 1.00 0.00 C ATOM 1718 O LYS A 114 12.657 -2.027 -39.395 1.00 0.00 O ATOM 1719 CB LYS A 114 10.244 -0.330 -40.811 1.00 0.00 C ATOM 1720 CG LYS A 114 10.567 0.968 -41.533 1.00 0.00 C ATOM 1721 CD LYS A 114 9.315 1.612 -42.110 1.00 0.00 C ATOM 1722 CE LYS A 114 9.536 3.084 -42.421 1.00 0.00 C ATOM 1723 NZ LYS A 114 9.761 3.318 -43.874 1.00 0.00 N ATOM 0 H LYS A 114 11.472 1.488 -38.832 1.00 0.00 H new ATOM 0 HA LYS A 114 10.353 -1.208 -38.855 1.00 0.00 H new ATOM 0 HB2 LYS A 114 10.585 -1.168 -41.419 1.00 0.00 H new ATOM 0 HB3 LYS A 114 9.162 -0.423 -40.718 1.00 0.00 H new ATOM 0 HG2 LYS A 114 11.048 1.660 -40.842 1.00 0.00 H new ATOM 0 HG3 LYS A 114 11.279 0.772 -42.335 1.00 0.00 H new ATOM 0 HD2 LYS A 114 9.021 1.087 -43.019 1.00 0.00 H new ATOM 0 HD3 LYS A 114 8.493 1.508 -41.402 1.00 0.00 H new ATOM 0 HE2 LYS A 114 8.671 3.658 -42.091 1.00 0.00 H new ATOM 0 HE3 LYS A 114 10.395 3.449 -41.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 9.907 4.334 -44.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 10.602 2.790 -44.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 8.931 2.994 -44.410 1.00 0.00 H new ATOM 1737 N ALA A 115 13.207 0.110 -39.774 1.00 0.00 N ATOM 1738 CA ALA A 115 14.623 -0.187 -39.884 1.00 0.00 C ATOM 1739 C ALA A 115 15.263 -0.251 -38.504 1.00 0.00 C ATOM 1740 O ALA A 115 16.295 -0.895 -38.313 1.00 0.00 O ATOM 1741 CB ALA A 115 15.320 0.850 -40.752 1.00 0.00 C ATOM 0 H ALA A 115 12.965 1.093 -39.896 1.00 0.00 H new ATOM 0 HA ALA A 115 14.735 -1.162 -40.359 1.00 0.00 H new ATOM 0 HB1 ALA A 115 16.381 0.611 -40.823 1.00 0.00 H new ATOM 0 HB2 ALA A 115 14.879 0.845 -41.749 1.00 0.00 H new ATOM 0 HB3 ALA A 115 15.200 1.838 -40.307 1.00 0.00 H new ATOM 1747 N GLU A 116 14.639 0.423 -37.543 1.00 0.00 N ATOM 1748 CA GLU A 116 15.144 0.443 -36.177 1.00 0.00 C ATOM 1749 C GLU A 116 14.638 -0.754 -35.378 1.00 0.00 C ATOM 1750 O GLU A 116 15.369 -1.319 -34.568 1.00 0.00 O ATOM 1751 CB GLU A 116 14.747 1.743 -35.473 1.00 0.00 C ATOM 1752 CG GLU A 116 14.813 2.971 -36.367 1.00 0.00 C ATOM 1753 CD GLU A 116 16.236 3.367 -36.710 1.00 0.00 C ATOM 1754 OE1 GLU A 116 17.090 2.464 -36.830 1.00 0.00 O ATOM 1755 OE2 GLU A 116 16.496 4.580 -36.857 1.00 0.00 O ATOM 0 H GLU A 116 13.784 0.961 -37.686 1.00 0.00 H new ATOM 0 HA GLU A 116 16.231 0.384 -36.230 1.00 0.00 H new ATOM 0 HB2 GLU A 116 13.733 1.641 -35.087 1.00 0.00 H new ATOM 0 HB3 GLU A 116 15.401 1.895 -34.615 1.00 0.00 H new ATOM 0 HG2 GLU A 116 14.262 2.776 -37.287 1.00 0.00 H new ATOM 0 HG3 GLU A 116 14.318 3.805 -35.870 1.00 0.00 H new ATOM 1762 N LEU A 117 13.379 -1.131 -35.601 1.00 0.00 N ATOM 1763 CA LEU A 117 12.791 -2.256 -34.878 1.00 0.00 C ATOM 1764 C LEU A 117 13.291 -3.583 -35.425 1.00 0.00 C ATOM 1765 O LEU A 117 13.245 -4.600 -34.733 1.00 0.00 O ATOM 1766 CB LEU A 117 11.252 -2.163 -34.867 1.00 0.00 C ATOM 1767 CG LEU A 117 10.473 -2.893 -35.966 1.00 0.00 C ATOM 1768 CD1 LEU A 117 9.075 -2.303 -36.061 1.00 0.00 C ATOM 1769 CD2 LEU A 117 11.171 -2.799 -37.307 1.00 0.00 C ATOM 0 H LEU A 117 12.754 -0.679 -36.269 1.00 0.00 H new ATOM 0 HA LEU A 117 13.118 -2.204 -33.839 1.00 0.00 H new ATOM 0 HB2 LEU A 117 10.903 -2.540 -33.906 1.00 0.00 H new ATOM 0 HB3 LEU A 117 10.982 -1.108 -34.913 1.00 0.00 H new ATOM 0 HG LEU A 117 10.416 -3.949 -35.703 1.00 0.00 H new ATOM 0 HD11 LEU A 117 8.515 -2.818 -36.841 1.00 0.00 H new ATOM 0 HD12 LEU A 117 8.563 -2.425 -35.106 1.00 0.00 H new ATOM 0 HD13 LEU A 117 9.143 -1.242 -36.303 1.00 0.00 H new ATOM 0 HD21 LEU A 117 10.587 -3.329 -38.059 1.00 0.00 H new ATOM 0 HD22 LEU A 117 11.268 -1.752 -37.594 1.00 0.00 H new ATOM 0 HD23 LEU A 117 12.161 -3.248 -37.234 1.00 0.00 H new ATOM 1781 N ILE A 118 13.804 -3.570 -36.649 1.00 0.00 N ATOM 1782 CA ILE A 118 14.345 -4.786 -37.228 1.00 0.00 C ATOM 1783 C ILE A 118 15.770 -5.008 -36.716 1.00 0.00 C ATOM 1784 O ILE A 118 16.207 -6.143 -36.527 1.00 0.00 O ATOM 1785 CB ILE A 118 14.344 -4.772 -38.787 1.00 0.00 C ATOM 1786 CG1 ILE A 118 15.095 -5.989 -39.356 1.00 0.00 C ATOM 1787 CG2 ILE A 118 14.950 -3.490 -39.348 1.00 0.00 C ATOM 1788 CD1 ILE A 118 14.852 -7.290 -38.613 1.00 0.00 C ATOM 0 H ILE A 118 13.855 -2.746 -37.248 1.00 0.00 H new ATOM 0 HA ILE A 118 13.695 -5.604 -36.917 1.00 0.00 H new ATOM 0 HB ILE A 118 13.300 -4.820 -39.096 1.00 0.00 H new ATOM 0 HG12 ILE A 118 14.805 -6.122 -40.398 1.00 0.00 H new ATOM 0 HG13 ILE A 118 16.164 -5.776 -39.347 1.00 0.00 H new ATOM 0 HG21 ILE A 118 14.929 -3.524 -40.437 1.00 0.00 H new ATOM 0 HG22 ILE A 118 14.374 -2.633 -39.000 1.00 0.00 H new ATOM 0 HG23 ILE A 118 15.981 -3.396 -39.008 1.00 0.00 H new ATOM 0 HD11 ILE A 118 15.422 -8.090 -39.085 1.00 0.00 H new ATOM 0 HD12 ILE A 118 15.170 -7.182 -37.576 1.00 0.00 H new ATOM 0 HD13 ILE A 118 13.790 -7.534 -38.644 1.00 0.00 H new ATOM 1800 N ALA A 119 16.481 -3.904 -36.483 1.00 0.00 N ATOM 1801 CA ALA A 119 17.849 -3.949 -35.983 1.00 0.00 C ATOM 1802 C ALA A 119 17.885 -3.998 -34.459 1.00 0.00 C ATOM 1803 O ALA A 119 18.827 -4.522 -33.866 1.00 0.00 O ATOM 1804 CB ALA A 119 18.637 -2.751 -36.491 1.00 0.00 C ATOM 0 H ALA A 119 16.125 -2.961 -36.636 1.00 0.00 H new ATOM 0 HA ALA A 119 18.311 -4.863 -36.357 1.00 0.00 H new ATOM 0 HB1 ALA A 119 19.657 -2.798 -36.109 1.00 0.00 H new ATOM 0 HB2 ALA A 119 18.656 -2.764 -37.581 1.00 0.00 H new ATOM 0 HB3 ALA A 119 18.163 -1.832 -36.147 1.00 0.00 H new ATOM 1810 N LEU A 120 16.858 -3.429 -33.828 1.00 0.00 N ATOM 1811 CA LEU A 120 16.778 -3.387 -32.370 1.00 0.00 C ATOM 1812 C LEU A 120 17.046 -4.757 -31.763 1.00 0.00 C ATOM 1813 O LEU A 120 17.774 -4.873 -30.778 1.00 0.00 O ATOM 1814 CB LEU A 120 15.406 -2.882 -31.921 1.00 0.00 C ATOM 1815 CG LEU A 120 15.327 -2.436 -30.461 1.00 0.00 C ATOM 1816 CD1 LEU A 120 16.266 -1.266 -30.210 1.00 0.00 C ATOM 1817 CD2 LEU A 120 13.898 -2.062 -30.096 1.00 0.00 C ATOM 0 H LEU A 120 16.070 -2.991 -34.305 1.00 0.00 H new ATOM 0 HA LEU A 120 17.545 -2.698 -32.018 1.00 0.00 H new ATOM 0 HB2 LEU A 120 15.118 -2.045 -32.557 1.00 0.00 H new ATOM 0 HB3 LEU A 120 14.674 -3.673 -32.084 1.00 0.00 H new ATOM 0 HG LEU A 120 15.638 -3.268 -29.828 1.00 0.00 H new ATOM 0 HD11 LEU A 120 16.197 -0.961 -29.166 1.00 0.00 H new ATOM 0 HD12 LEU A 120 17.290 -1.567 -30.433 1.00 0.00 H new ATOM 0 HD13 LEU A 120 15.985 -0.430 -30.851 1.00 0.00 H new ATOM 0 HD21 LEU A 120 13.859 -1.747 -29.053 1.00 0.00 H new ATOM 0 HD22 LEU A 120 13.561 -1.245 -30.735 1.00 0.00 H new ATOM 0 HD23 LEU A 120 13.248 -2.926 -30.238 1.00 0.00 H new ATOM 1829 N PHE A 121 16.454 -5.791 -32.355 1.00 0.00 N ATOM 1830 CA PHE A 121 16.631 -7.160 -31.869 1.00 0.00 C ATOM 1831 C PHE A 121 18.095 -7.461 -31.564 1.00 0.00 C ATOM 1832 O PHE A 121 18.841 -7.917 -32.431 1.00 0.00 O ATOM 1833 CB PHE A 121 16.108 -8.161 -32.893 1.00 0.00 C ATOM 1834 CG PHE A 121 14.614 -8.271 -32.923 1.00 0.00 C ATOM 1835 CD1 PHE A 121 13.872 -8.241 -31.750 1.00 0.00 C ATOM 1836 CD2 PHE A 121 13.951 -8.401 -34.129 1.00 0.00 C ATOM 1837 CE1 PHE A 121 12.495 -8.338 -31.786 1.00 0.00 C ATOM 1838 CE2 PHE A 121 12.579 -8.500 -34.170 1.00 0.00 C ATOM 1839 CZ PHE A 121 11.848 -8.469 -32.997 1.00 0.00 C ATOM 0 H PHE A 121 15.848 -5.709 -33.171 1.00 0.00 H new ATOM 0 HA PHE A 121 16.061 -7.254 -30.945 1.00 0.00 H new ATOM 0 HB2 PHE A 121 16.462 -7.872 -33.883 1.00 0.00 H new ATOM 0 HB3 PHE A 121 16.531 -9.142 -32.677 1.00 0.00 H new ATOM 0 HD1 PHE A 121 14.377 -8.141 -30.800 1.00 0.00 H new ATOM 0 HD2 PHE A 121 14.516 -8.425 -35.049 1.00 0.00 H new ATOM 0 HE1 PHE A 121 11.926 -8.311 -30.868 1.00 0.00 H new ATOM 0 HE2 PHE A 121 12.073 -8.602 -35.119 1.00 0.00 H new ATOM 0 HZ PHE A 121 10.771 -8.547 -33.029 1.00 0.00 H new ATOM 1849 N ALA A 122 18.491 -7.206 -30.327 1.00 0.00 N ATOM 1850 CA ALA A 122 19.861 -7.450 -29.894 1.00 0.00 C ATOM 1851 C ALA A 122 19.908 -8.521 -28.807 1.00 0.00 C ATOM 1852 O ALA A 122 18.932 -8.726 -28.085 1.00 0.00 O ATOM 1853 CB ALA A 122 20.494 -6.159 -29.394 1.00 0.00 C ATOM 0 H ALA A 122 17.882 -6.829 -29.601 1.00 0.00 H new ATOM 0 HA ALA A 122 20.430 -7.812 -30.751 1.00 0.00 H new ATOM 0 HB1 ALA A 122 21.517 -6.356 -29.074 1.00 0.00 H new ATOM 0 HB2 ALA A 122 20.501 -5.422 -30.197 1.00 0.00 H new ATOM 0 HB3 ALA A 122 19.918 -5.774 -28.553 1.00 0.00 H new ATOM 1859 N PRO A 123 21.048 -9.219 -28.674 1.00 0.00 N ATOM 1860 CA PRO A 123 21.216 -10.272 -27.667 1.00 0.00 C ATOM 1861 C PRO A 123 21.164 -9.723 -26.245 1.00 0.00 C ATOM 1862 O PRO A 123 20.952 -8.529 -26.038 1.00 0.00 O ATOM 1863 CB PRO A 123 22.603 -10.847 -27.969 1.00 0.00 C ATOM 1864 CG PRO A 123 23.315 -9.764 -28.705 1.00 0.00 C ATOM 1865 CD PRO A 123 22.261 -9.037 -29.491 1.00 0.00 C ATOM 0 HA PRO A 123 20.418 -11.013 -27.718 1.00 0.00 H new ATOM 0 HB2 PRO A 123 23.129 -11.113 -27.052 1.00 0.00 H new ATOM 0 HB3 PRO A 123 22.533 -11.753 -28.570 1.00 0.00 H new ATOM 0 HG2 PRO A 123 23.821 -9.090 -28.014 1.00 0.00 H new ATOM 0 HG3 PRO A 123 24.079 -10.177 -29.364 1.00 0.00 H new ATOM 0 HD2 PRO A 123 22.508 -7.983 -29.617 1.00 0.00 H new ATOM 0 HD3 PRO A 123 22.141 -9.458 -30.489 1.00 0.00 H new ATOM 1873 N ALA A 124 21.358 -10.603 -25.269 1.00 0.00 N ATOM 1874 CA ALA A 124 21.333 -10.206 -23.866 1.00 0.00 C ATOM 1875 C ALA A 124 22.380 -9.135 -23.581 1.00 0.00 C ATOM 1876 O ALA A 124 23.582 -9.400 -23.625 1.00 0.00 O ATOM 1877 CB ALA A 124 21.555 -11.416 -22.972 1.00 0.00 C ATOM 0 H ALA A 124 21.534 -11.596 -25.423 1.00 0.00 H new ATOM 0 HA ALA A 124 20.352 -9.784 -23.650 1.00 0.00 H new ATOM 0 HB1 ALA A 124 21.534 -11.105 -21.927 1.00 0.00 H new ATOM 0 HB2 ALA A 124 20.767 -12.148 -23.149 1.00 0.00 H new ATOM 0 HB3 ALA A 124 22.523 -11.863 -23.198 1.00 0.00 H new ATOM 1883 N ASP A 125 21.917 -7.925 -23.285 1.00 0.00 N ATOM 1884 CA ASP A 125 22.813 -6.813 -22.992 1.00 0.00 C ATOM 1885 C ASP A 125 22.667 -6.365 -21.541 1.00 0.00 C ATOM 1886 O ASP A 125 21.874 -6.926 -20.785 1.00 0.00 O ATOM 1887 CB ASP A 125 22.527 -5.639 -23.931 1.00 0.00 C ATOM 1888 CG ASP A 125 22.695 -6.013 -25.390 1.00 0.00 C ATOM 1889 OD1 ASP A 125 23.499 -6.923 -25.682 1.00 0.00 O ATOM 1890 OD2 ASP A 125 22.021 -5.396 -26.242 1.00 0.00 O ATOM 0 H ASP A 125 20.925 -7.690 -23.242 1.00 0.00 H new ATOM 0 HA ASP A 125 23.837 -7.153 -23.148 1.00 0.00 H new ATOM 0 HB2 ASP A 125 21.510 -5.283 -23.765 1.00 0.00 H new ATOM 0 HB3 ASP A 125 23.197 -4.813 -23.691 1.00 0.00 H new ATOM 1895 N GLY A 126 23.438 -5.352 -21.159 1.00 0.00 N ATOM 1896 CA GLY A 126 23.381 -4.846 -19.801 1.00 0.00 C ATOM 1897 C GLY A 126 24.756 -4.649 -19.195 1.00 0.00 C ATOM 1898 O GLY A 126 25.769 -4.770 -19.885 1.00 0.00 O ATOM 0 H GLY A 126 24.102 -4.872 -21.767 1.00 0.00 H new ATOM 0 HA2 GLY A 126 22.845 -3.897 -19.793 1.00 0.00 H new ATOM 0 HA3 GLY A 126 22.811 -5.539 -19.182 1.00 0.00 H new ATOM 1902 N GLU A 127 24.794 -4.343 -17.903 1.00 0.00 N ATOM 1903 CA GLU A 127 26.055 -4.129 -17.203 1.00 0.00 C ATOM 1904 C GLU A 127 26.157 -5.029 -15.976 1.00 0.00 C ATOM 1905 O GLU A 127 26.189 -4.550 -14.842 1.00 0.00 O ATOM 1906 CB GLU A 127 26.191 -2.662 -16.791 1.00 0.00 C ATOM 1907 CG GLU A 127 26.896 -1.802 -17.828 1.00 0.00 C ATOM 1908 CD GLU A 127 27.104 -0.376 -17.358 1.00 0.00 C ATOM 1909 OE1 GLU A 127 27.615 -0.190 -16.233 1.00 0.00 O ATOM 1910 OE2 GLU A 127 26.759 0.556 -18.114 1.00 0.00 O ATOM 0 H GLU A 127 23.965 -4.237 -17.318 1.00 0.00 H new ATOM 0 HA GLU A 127 26.868 -4.383 -17.883 1.00 0.00 H new ATOM 0 HB2 GLU A 127 25.198 -2.252 -16.605 1.00 0.00 H new ATOM 0 HB3 GLU A 127 26.740 -2.607 -15.851 1.00 0.00 H new ATOM 0 HG2 GLU A 127 27.862 -2.246 -18.067 1.00 0.00 H new ATOM 0 HG3 GLU A 127 26.311 -1.796 -18.748 1.00 0.00 H new ATOM 1917 N LYS A 128 26.206 -6.336 -16.209 1.00 0.00 N ATOM 1918 CA LYS A 128 26.304 -7.303 -15.122 1.00 0.00 C ATOM 1919 C LYS A 128 25.107 -7.189 -14.184 1.00 0.00 C ATOM 1920 O LYS A 128 24.424 -6.166 -14.156 1.00 0.00 O ATOM 1921 CB LYS A 128 27.601 -7.095 -14.339 1.00 0.00 C ATOM 1922 CG LYS A 128 28.802 -7.796 -14.954 1.00 0.00 C ATOM 1923 CD LYS A 128 30.101 -7.094 -14.595 1.00 0.00 C ATOM 1924 CE LYS A 128 31.311 -7.902 -15.035 1.00 0.00 C ATOM 1925 NZ LYS A 128 32.516 -7.588 -14.217 1.00 0.00 N ATOM 0 H LYS A 128 26.179 -6.750 -17.141 1.00 0.00 H new ATOM 0 HA LYS A 128 26.309 -8.302 -15.558 1.00 0.00 H new ATOM 0 HB2 LYS A 128 27.809 -6.027 -14.273 1.00 0.00 H new ATOM 0 HB3 LYS A 128 27.462 -7.456 -13.320 1.00 0.00 H new ATOM 0 HG2 LYS A 128 28.838 -8.829 -14.608 1.00 0.00 H new ATOM 0 HG3 LYS A 128 28.691 -7.826 -16.038 1.00 0.00 H new ATOM 0 HD2 LYS A 128 30.127 -6.112 -15.066 1.00 0.00 H new ATOM 0 HD3 LYS A 128 30.143 -6.932 -13.518 1.00 0.00 H new ATOM 0 HE2 LYS A 128 31.086 -8.966 -14.956 1.00 0.00 H new ATOM 0 HE3 LYS A 128 31.522 -7.698 -16.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 33.319 -8.159 -14.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 32.747 -6.578 -14.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 32.324 -7.807 -13.218 1.00 0.00 H new ATOM 1939 N SER A 129 24.859 -8.247 -13.416 1.00 0.00 N ATOM 1940 CA SER A 129 23.744 -8.269 -12.474 1.00 0.00 C ATOM 1941 C SER A 129 22.408 -8.243 -13.210 1.00 0.00 C ATOM 1942 O SER A 129 21.707 -9.253 -13.279 1.00 0.00 O ATOM 1943 CB SER A 129 23.834 -7.083 -11.509 1.00 0.00 C ATOM 1944 OG SER A 129 24.342 -7.488 -10.250 1.00 0.00 O ATOM 0 H SER A 129 25.416 -9.101 -13.428 1.00 0.00 H new ATOM 0 HA SER A 129 23.805 -9.195 -11.902 1.00 0.00 H new ATOM 0 HB2 SER A 129 24.478 -6.313 -11.934 1.00 0.00 H new ATOM 0 HB3 SER A 129 22.847 -6.639 -11.381 1.00 0.00 H new ATOM 0 HG SER A 129 24.391 -6.713 -9.652 1.00 0.00 H new ATOM 1950 N GLU A 130 22.060 -7.084 -13.759 1.00 0.00 N ATOM 1951 CA GLU A 130 20.809 -6.926 -14.491 1.00 0.00 C ATOM 1952 C GLU A 130 19.610 -7.144 -13.572 1.00 0.00 C ATOM 1953 O GLU A 130 19.234 -8.281 -13.284 1.00 0.00 O ATOM 1954 CB GLU A 130 20.754 -7.906 -15.667 1.00 0.00 C ATOM 1955 CG GLU A 130 20.519 -7.230 -17.009 1.00 0.00 C ATOM 1956 CD GLU A 130 19.528 -7.984 -17.876 1.00 0.00 C ATOM 1957 OE1 GLU A 130 19.491 -9.230 -17.787 1.00 0.00 O ATOM 1958 OE2 GLU A 130 18.791 -7.329 -18.641 1.00 0.00 O ATOM 0 H GLU A 130 22.628 -6.238 -13.711 1.00 0.00 H new ATOM 0 HA GLU A 130 20.767 -5.907 -14.876 1.00 0.00 H new ATOM 0 HB2 GLU A 130 21.689 -8.464 -15.709 1.00 0.00 H new ATOM 0 HB3 GLU A 130 19.959 -8.630 -15.490 1.00 0.00 H new ATOM 0 HG2 GLU A 130 20.153 -6.217 -16.842 1.00 0.00 H new ATOM 0 HG3 GLU A 130 21.467 -7.143 -17.539 1.00 0.00 H new ATOM 1965 N ALA A 131 19.016 -6.048 -13.113 1.00 0.00 N ATOM 1966 CA ALA A 131 17.860 -6.118 -12.227 1.00 0.00 C ATOM 1967 C ALA A 131 16.567 -5.862 -12.991 1.00 0.00 C ATOM 1968 O ALA A 131 16.572 -4.996 -13.890 1.00 0.00 O ATOM 1969 CB ALA A 131 18.009 -5.122 -11.087 1.00 0.00 C ATOM 1970 OXT ALA A 131 15.557 -6.530 -12.684 1.00 0.00 O ATOM 0 H ALA A 131 19.316 -5.100 -13.340 1.00 0.00 H new ATOM 0 HA ALA A 131 17.811 -7.124 -11.811 1.00 0.00 H new ATOM 0 HB1 ALA A 131 17.139 -5.185 -10.433 1.00 0.00 H new ATOM 0 HB2 ALA A 131 18.909 -5.353 -10.517 1.00 0.00 H new ATOM 0 HB3 ALA A 131 18.086 -4.113 -11.493 1.00 0.00 H new TER 1976 ALA A 131