USER MOD reduce.3.24.130724 H: found=0, std=0, add=1155, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1158 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 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot 147:sc= -0.743 USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 ASN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= -0.556 K(o=-0.56,f=-3.3!) USER MOD Single : A 56 SER OG : rot -142:sc= 0.182 USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 LYS NZ :NH3+ -131:sc= -0.0733 (180deg=-2.84!) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 75 SER OG : rot 180:sc= 0.0143 USER MOD Single : A 80 HIS : no HE2:sc= -3.11! K(o=-3.1!,f=-1.6) USER MOD Single : A 92 SER OG : rot 180:sc= -0.148 USER MOD Single : B 109 THR OG1 : rot 180:sc= -0.622 USER MOD Single : B 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 125 SER OG : rot 170:sc= 0 USER MOD Single : B 138 THR OG1 : rot 147:sc= -0.878 USER MOD Single : B 145 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 148 ASN : amide:sc= 0 X(o=0,f=-0.085) USER MOD Single : B 149 TYR OH : rot 180:sc= 0 USER MOD Single : B 152 SER OG : rot 180:sc= 0 USER MOD Single : B 155 GLN : amide:sc= -0.548 K(o=-0.55,f=-3.2!) USER MOD Single : B 156 SER OG : rot -119:sc= 0.225 USER MOD Single : B 158 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 159 LYS NZ :NH3+ -131:sc= -0.0692 (180deg=-2.86!) USER MOD Single : B 163 SER OG : rot 180:sc= 0 USER MOD Single : B 175 SER OG : rot 180:sc= 0.0131 USER MOD Single : B 180 HIS : no HE2:sc= -3.45! C(o=-3.5!,f=-1.8!) USER MOD Single : B 192 SER OG : rot 180:sc= -0.143 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 10.892 37.417 7.561 1.00 9.95 N ATOM 2 CA ALA A 1 11.376 36.379 6.611 1.00 9.34 C ATOM 3 C ALA A 1 12.659 35.700 7.119 1.00 8.30 C ATOM 4 O ALA A 1 12.592 34.629 7.706 1.00 8.16 O ATOM 5 CB ALA A 1 11.598 37.001 5.235 1.00 9.73 C ATOM 0 H1 ALA A 1 10.026 37.854 7.186 1.00 9.95 H new ATOM 0 H2 ALA A 1 10.688 36.977 8.481 1.00 9.95 H new ATOM 0 H3 ALA A 1 11.624 38.146 7.680 1.00 9.95 H new ATOM 0 HA ALA A 1 10.613 35.605 6.533 1.00 9.34 H new ATOM 0 HB1 ALA A 1 11.952 36.237 4.543 1.00 9.73 H new ATOM 0 HB2 ALA A 1 10.659 37.416 4.868 1.00 9.73 H new ATOM 0 HB3 ALA A 1 12.341 37.795 5.310 1.00 9.73 H new ATOM 13 N VAL A 2 13.799 36.363 6.867 1.00 7.83 N ATOM 14 CA VAL A 2 15.132 35.865 7.279 1.00 7.06 C ATOM 15 C VAL A 2 15.664 34.793 6.302 1.00 5.87 C ATOM 16 O VAL A 2 16.233 33.775 6.686 1.00 5.74 O ATOM 17 CB VAL A 2 15.180 35.349 8.773 1.00 7.48 C ATOM 18 CG1 VAL A 2 14.313 36.218 9.672 1.00 8.02 C ATOM 19 CG2 VAL A 2 14.786 33.874 8.950 1.00 7.83 C ATOM 0 H VAL A 2 13.829 37.256 6.375 1.00 7.83 H new ATOM 0 HA VAL A 2 15.795 36.729 7.236 1.00 7.06 H new ATOM 0 HB VAL A 2 16.227 35.425 9.065 1.00 7.48 H new ATOM 0 HG11 VAL A 2 14.361 35.845 10.695 1.00 8.02 H new ATOM 0 HG12 VAL A 2 14.675 37.246 9.643 1.00 8.02 H new ATOM 0 HG13 VAL A 2 13.281 36.187 9.323 1.00 8.02 H new ATOM 0 HG21 VAL A 2 14.847 33.605 10.005 1.00 7.83 H new ATOM 0 HG22 VAL A 2 13.766 33.725 8.596 1.00 7.83 H new ATOM 0 HG23 VAL A 2 15.465 33.244 8.375 1.00 7.83 H new ATOM 29 N LEU A 3 15.493 35.090 5.010 1.00 5.32 N ATOM 30 CA LEU A 3 15.954 34.240 3.911 1.00 4.36 C ATOM 31 C LEU A 3 17.419 34.466 3.586 1.00 4.03 C ATOM 32 O LEU A 3 17.778 35.429 2.906 1.00 4.40 O ATOM 33 CB LEU A 3 15.141 34.539 2.651 1.00 4.40 C ATOM 34 CG LEU A 3 15.591 33.827 1.364 1.00 5.00 C ATOM 35 CD1 LEU A 3 16.746 34.579 0.737 1.00 5.26 C ATOM 36 CD2 LEU A 3 15.981 32.371 1.618 1.00 5.86 C ATOM 0 H LEU A 3 15.024 35.939 4.695 1.00 5.32 H new ATOM 0 HA LEU A 3 15.821 33.207 4.232 1.00 4.36 H new ATOM 0 HB2 LEU A 3 14.102 34.273 2.843 1.00 4.40 H new ATOM 0 HB3 LEU A 3 15.167 35.614 2.474 1.00 4.40 H new ATOM 0 HG LEU A 3 14.745 33.819 0.677 1.00 5.00 H new ATOM 0 HD11 LEU A 3 17.060 34.070 -0.174 1.00 5.26 H new ATOM 0 HD12 LEU A 3 16.431 35.594 0.495 1.00 5.26 H new ATOM 0 HD13 LEU A 3 17.580 34.615 1.438 1.00 5.26 H new ATOM 0 HD21 LEU A 3 16.292 31.909 0.681 1.00 5.86 H new ATOM 0 HD22 LEU A 3 16.804 32.334 2.331 1.00 5.86 H new ATOM 0 HD23 LEU A 3 15.125 31.830 2.023 1.00 5.86 H new ATOM 48 N ASP A 4 18.257 33.548 4.055 1.00 3.91 N ATOM 49 CA ASP A 4 19.668 33.664 3.739 1.00 4.19 C ATOM 50 C ASP A 4 19.839 33.075 2.348 1.00 3.97 C ATOM 51 O ASP A 4 20.190 31.893 2.248 1.00 4.06 O ATOM 52 CB ASP A 4 20.528 32.937 4.777 1.00 4.92 C ATOM 53 CG ASP A 4 20.923 33.844 5.930 1.00 5.74 C ATOM 54 OD1 ASP A 4 21.859 34.652 5.757 1.00 6.19 O ATOM 55 OD2 ASP A 4 20.293 33.748 7.004 1.00 6.22 O ATOM 0 H ASP A 4 17.996 32.748 4.631 1.00 3.91 H new ATOM 0 HA ASP A 4 19.997 34.703 3.760 1.00 4.19 H new ATOM 0 HB2 ASP A 4 19.980 32.078 5.164 1.00 4.92 H new ATOM 0 HB3 ASP A 4 21.427 32.551 4.296 1.00 4.92 H new ATOM 60 N LEU A 5 19.566 33.824 1.270 1.00 4.28 N ATOM 61 CA LEU A 5 19.694 33.219 -0.066 1.00 4.71 C ATOM 62 C LEU A 5 19.977 34.278 -1.060 1.00 5.46 C ATOM 63 O LEU A 5 21.086 34.453 -1.569 1.00 6.27 O ATOM 64 CB LEU A 5 18.453 32.407 -0.441 1.00 5.36 C ATOM 65 CG LEU A 5 18.512 31.637 -1.781 1.00 6.10 C ATOM 66 CD1 LEU A 5 18.788 32.584 -2.937 1.00 5.79 C ATOM 67 CD2 LEU A 5 19.561 30.527 -1.744 1.00 7.09 C ATOM 0 H LEU A 5 19.270 34.800 1.288 1.00 4.28 H new ATOM 0 HA LEU A 5 20.527 32.517 -0.055 1.00 4.71 H new ATOM 0 HB2 LEU A 5 18.261 31.690 0.357 1.00 5.36 H new ATOM 0 HB3 LEU A 5 17.599 33.084 -0.474 1.00 5.36 H new ATOM 0 HG LEU A 5 17.537 31.174 -1.934 1.00 6.10 H new ATOM 0 HD11 LEU A 5 18.825 32.020 -3.869 1.00 5.79 H new ATOM 0 HD12 LEU A 5 17.994 33.329 -2.995 1.00 5.79 H new ATOM 0 HD13 LEU A 5 19.743 33.084 -2.778 1.00 5.79 H new ATOM 0 HD21 LEU A 5 19.575 30.007 -2.702 1.00 7.09 H new ATOM 0 HD22 LEU A 5 20.543 30.960 -1.552 1.00 7.09 H new ATOM 0 HD23 LEU A 5 19.315 29.820 -0.951 1.00 7.09 H new ATOM 79 N ASP A 6 18.930 35.049 -1.218 1.00 5.46 N ATOM 80 CA ASP A 6 18.848 36.290 -2.051 1.00 6.41 C ATOM 81 C ASP A 6 17.390 36.588 -2.496 1.00 6.28 C ATOM 82 O ASP A 6 17.019 37.713 -2.831 1.00 6.48 O ATOM 83 CB ASP A 6 19.782 36.196 -3.244 1.00 7.20 C ATOM 84 CG ASP A 6 20.584 37.468 -3.455 1.00 8.21 C ATOM 85 OD1 ASP A 6 21.217 37.939 -2.485 1.00 8.78 O ATOM 86 OD2 ASP A 6 20.579 37.994 -4.588 1.00 8.64 O ATOM 0 H ASP A 6 18.045 34.842 -0.755 1.00 5.46 H new ATOM 0 HA ASP A 6 19.170 37.128 -1.433 1.00 6.41 H new ATOM 0 HB2 ASP A 6 20.465 35.359 -3.102 1.00 7.20 H new ATOM 0 HB3 ASP A 6 19.200 35.984 -4.141 1.00 7.20 H new ATOM 91 N VAL A 7 16.628 35.512 -2.506 1.00 6.22 N ATOM 92 CA VAL A 7 15.273 35.466 -2.888 1.00 6.28 C ATOM 93 C VAL A 7 14.396 35.721 -1.684 1.00 5.52 C ATOM 94 O VAL A 7 14.862 35.902 -0.570 1.00 5.69 O ATOM 95 CB VAL A 7 14.933 34.139 -3.615 1.00 7.22 C ATOM 96 CG1 VAL A 7 14.734 32.979 -2.648 1.00 7.36 C ATOM 97 CG2 VAL A 7 13.718 34.325 -4.508 1.00 7.51 C ATOM 0 H VAL A 7 16.984 34.598 -2.225 1.00 6.22 H new ATOM 0 HA VAL A 7 15.077 36.257 -3.612 1.00 6.28 H new ATOM 0 HB VAL A 7 15.790 33.878 -4.236 1.00 7.22 H new ATOM 0 HG11 VAL A 7 14.498 32.074 -3.209 1.00 7.36 H new ATOM 0 HG12 VAL A 7 15.648 32.823 -2.074 1.00 7.36 H new ATOM 0 HG13 VAL A 7 13.914 33.209 -1.968 1.00 7.36 H new ATOM 0 HG21 VAL A 7 13.490 33.386 -5.012 1.00 7.51 H new ATOM 0 HG22 VAL A 7 12.864 34.628 -3.902 1.00 7.51 H new ATOM 0 HG23 VAL A 7 13.927 35.095 -5.251 1.00 7.51 H new ATOM 107 N ARG A 8 13.110 35.728 -1.951 1.00 5.09 N ATOM 108 CA ARG A 8 12.165 35.907 -0.926 1.00 4.80 C ATOM 109 C ARG A 8 12.049 34.572 -0.295 1.00 4.48 C ATOM 110 O ARG A 8 11.675 33.614 -0.971 1.00 4.96 O ATOM 111 CB ARG A 8 10.817 36.405 -1.464 1.00 5.24 C ATOM 112 CG ARG A 8 10.272 37.610 -0.708 1.00 6.15 C ATOM 113 CD ARG A 8 9.116 38.271 -1.446 1.00 6.93 C ATOM 114 NE ARG A 8 7.894 37.470 -1.388 1.00 7.61 N ATOM 115 CZ ARG A 8 6.987 37.554 -0.411 1.00 8.32 C ATOM 116 NH1 ARG A 8 7.154 38.402 0.597 1.00 8.49 N ATOM 117 NH2 ARG A 8 5.907 36.785 -0.447 1.00 9.08 N ATOM 0 H ARG A 8 12.714 35.609 -2.883 1.00 5.09 H new ATOM 0 HA ARG A 8 12.474 36.673 -0.215 1.00 4.80 H new ATOM 0 HB2 ARG A 8 10.928 36.666 -2.517 1.00 5.24 H new ATOM 0 HB3 ARG A 8 10.091 35.594 -1.411 1.00 5.24 H new ATOM 0 HG2 ARG A 8 9.939 37.297 0.281 1.00 6.15 H new ATOM 0 HG3 ARG A 8 11.071 38.337 -0.560 1.00 6.15 H new ATOM 0 HD2 ARG A 8 8.925 39.253 -1.014 1.00 6.93 H new ATOM 0 HD3 ARG A 8 9.395 38.430 -2.488 1.00 6.93 H new ATOM 0 HE ARG A 8 7.723 36.804 -2.142 1.00 7.61 H new ATOM 0 HH11 ARG A 8 7.981 38.998 0.631 1.00 8.49 H new ATOM 0 HH12 ARG A 8 6.455 38.458 1.338 1.00 8.49 H new ATOM 0 HH21 ARG A 8 5.771 36.132 -1.219 1.00 9.08 H new ATOM 0 HH22 ARG A 8 5.212 36.846 0.297 1.00 9.08 H new ATOM 131 N THR A 9 12.463 34.475 0.944 1.00 4.05 N ATOM 132 CA THR A 9 12.501 33.178 1.631 1.00 4.08 C ATOM 133 C THR A 9 11.281 32.315 1.305 1.00 3.18 C ATOM 134 O THR A 9 10.130 32.634 1.609 1.00 3.47 O ATOM 135 CB THR A 9 12.494 33.405 3.153 1.00 4.95 C ATOM 136 OG1 THR A 9 12.739 32.180 3.863 1.00 5.55 O ATOM 137 CG2 THR A 9 11.224 33.996 3.681 1.00 5.66 C ATOM 0 H THR A 9 12.780 35.265 1.507 1.00 4.05 H new ATOM 0 HA THR A 9 13.404 32.669 1.295 1.00 4.08 H new ATOM 0 HB THR A 9 13.295 34.125 3.322 1.00 4.95 H new ATOM 0 HG1 THR A 9 12.731 32.354 4.827 1.00 5.55 H new ATOM 0 HG21 THR A 9 11.303 34.123 4.761 1.00 5.66 H new ATOM 0 HG22 THR A 9 11.052 34.965 3.213 1.00 5.66 H new ATOM 0 HG23 THR A 9 10.391 33.331 3.454 1.00 5.66 H new ATOM 145 N CYS A 10 11.629 31.247 0.579 1.00 2.54 N ATOM 146 CA CYS A 10 10.699 30.246 0.009 1.00 1.93 C ATOM 147 C CYS A 10 9.315 30.230 0.665 1.00 1.72 C ATOM 148 O CYS A 10 9.216 30.047 1.877 1.00 1.97 O ATOM 149 CB CYS A 10 11.240 28.824 0.192 1.00 2.28 C ATOM 150 SG CYS A 10 12.805 28.485 -0.640 1.00 2.68 S ATOM 0 H CYS A 10 12.604 31.041 0.359 1.00 2.54 H new ATOM 0 HA CYS A 10 10.612 30.540 -1.037 1.00 1.93 H new ATOM 0 HB2 CYS A 10 11.365 28.634 1.258 1.00 2.28 H new ATOM 0 HB3 CYS A 10 10.493 28.119 -0.172 1.00 2.28 H new ATOM 155 N LEU A 11 8.254 30.411 -0.157 1.00 1.49 N ATOM 156 CA LEU A 11 6.844 30.423 0.309 1.00 1.39 C ATOM 157 C LEU A 11 6.614 29.548 1.564 1.00 1.20 C ATOM 158 O LEU A 11 6.901 28.343 1.557 1.00 1.16 O ATOM 159 CB LEU A 11 5.901 29.995 -0.818 1.00 1.55 C ATOM 160 CG LEU A 11 4.775 30.989 -1.135 1.00 1.91 C ATOM 161 CD1 LEU A 11 3.856 31.160 0.065 1.00 2.48 C ATOM 162 CD2 LEU A 11 5.347 32.334 -1.562 1.00 2.29 C ATOM 0 H LEU A 11 8.350 30.553 -1.162 1.00 1.49 H new ATOM 0 HA LEU A 11 6.622 31.451 0.597 1.00 1.39 H new ATOM 0 HB2 LEU A 11 6.489 29.835 -1.722 1.00 1.55 H new ATOM 0 HB3 LEU A 11 5.455 29.036 -0.554 1.00 1.55 H new ATOM 0 HG LEU A 11 4.191 30.586 -1.962 1.00 1.91 H new ATOM 0 HD11 LEU A 11 3.065 31.868 -0.181 1.00 2.48 H new ATOM 0 HD12 LEU A 11 3.414 30.198 0.325 1.00 2.48 H new ATOM 0 HD13 LEU A 11 4.430 31.536 0.912 1.00 2.48 H new ATOM 0 HD21 LEU A 11 4.531 33.023 -1.782 1.00 2.29 H new ATOM 0 HD22 LEU A 11 5.959 32.741 -0.757 1.00 2.29 H new ATOM 0 HD23 LEU A 11 5.961 32.202 -2.453 1.00 2.29 H new ATOM 174 N PRO A 12 6.146 30.182 2.670 1.00 1.19 N ATOM 175 CA PRO A 12 5.925 29.529 3.982 1.00 1.11 C ATOM 176 C PRO A 12 4.730 28.572 4.075 1.00 1.01 C ATOM 177 O PRO A 12 3.763 28.693 3.321 1.00 1.05 O ATOM 178 CB PRO A 12 5.713 30.717 4.908 1.00 1.29 C ATOM 179 CG PRO A 12 5.091 31.741 4.045 1.00 1.49 C ATOM 180 CD PRO A 12 5.839 31.638 2.756 1.00 1.39 C ATOM 0 HA PRO A 12 6.765 28.876 4.218 1.00 1.11 H new ATOM 0 HB2 PRO A 12 5.068 30.458 5.747 1.00 1.29 H new ATOM 0 HB3 PRO A 12 6.656 31.068 5.327 1.00 1.29 H new ATOM 0 HG2 PRO A 12 4.027 31.550 3.904 1.00 1.49 H new ATOM 0 HG3 PRO A 12 5.182 32.737 4.480 1.00 1.49 H new ATOM 0 HD2 PRO A 12 5.238 31.976 1.911 1.00 1.39 H new ATOM 0 HD3 PRO A 12 6.746 32.243 2.765 1.00 1.39 H new ATOM 188 N CYS A 13 4.804 27.619 5.037 1.00 0.93 N ATOM 189 CA CYS A 13 3.709 26.666 5.241 1.00 0.89 C ATOM 190 C CYS A 13 3.792 26.056 6.633 1.00 0.90 C ATOM 191 O CYS A 13 4.680 26.444 7.451 1.00 1.00 O ATOM 192 CB CYS A 13 3.707 25.569 4.144 1.00 0.82 C ATOM 193 SG CYS A 13 5.024 24.302 4.273 1.00 0.86 S ATOM 0 H CYS A 13 5.597 27.499 5.667 1.00 0.93 H new ATOM 0 HA CYS A 13 2.765 27.206 5.160 1.00 0.89 H new ATOM 0 HB2 CYS A 13 2.741 25.064 4.165 1.00 0.82 H new ATOM 0 HB3 CYS A 13 3.792 26.055 3.172 1.00 0.82 H new ATOM 198 N GLY A 14 2.940 25.067 6.899 1.00 0.91 N ATOM 199 CA GLY A 14 2.964 24.376 8.183 1.00 0.98 C ATOM 200 C GLY A 14 2.332 25.160 9.334 1.00 1.10 C ATOM 201 O GLY A 14 1.547 26.079 9.103 1.00 1.15 O ATOM 0 H GLY A 14 2.231 24.730 6.248 1.00 0.91 H new ATOM 0 HA2 GLY A 14 2.444 23.424 8.079 1.00 0.98 H new ATOM 0 HA3 GLY A 14 3.998 24.148 8.440 1.00 0.98 H new ATOM 205 N PRO A 15 2.684 24.820 10.603 1.00 1.19 N ATOM 206 CA PRO A 15 2.183 25.494 11.834 1.00 1.33 C ATOM 207 C PRO A 15 2.666 26.940 11.954 1.00 1.40 C ATOM 208 O PRO A 15 3.810 27.218 12.311 1.00 1.57 O ATOM 209 CB PRO A 15 2.810 24.650 12.928 1.00 1.46 C ATOM 210 CG PRO A 15 4.087 24.412 12.280 1.00 1.39 C ATOM 211 CD PRO A 15 3.668 23.797 10.992 1.00 1.21 C ATOM 0 HA PRO A 15 1.095 25.558 11.861 1.00 1.33 H new ATOM 0 HB2 PRO A 15 2.904 25.181 13.875 1.00 1.46 H new ATOM 0 HB3 PRO A 15 2.256 23.733 13.130 1.00 1.46 H new ATOM 0 HG2 PRO A 15 4.647 25.335 12.129 1.00 1.39 H new ATOM 0 HG3 PRO A 15 4.723 23.746 12.863 1.00 1.39 H new ATOM 0 HD2 PRO A 15 4.487 23.698 10.279 1.00 1.21 H new ATOM 0 HD3 PRO A 15 3.230 22.806 11.114 1.00 1.21 H new ATOM 219 N GLY A 16 1.803 27.800 11.577 1.00 1.34 N ATOM 220 CA GLY A 16 2.088 29.231 11.550 1.00 1.47 C ATOM 221 C GLY A 16 2.784 29.626 10.261 1.00 1.43 C ATOM 222 O GLY A 16 3.087 30.796 10.022 1.00 1.68 O ATOM 0 H GLY A 16 0.861 27.557 11.270 1.00 1.34 H new ATOM 0 HA2 GLY A 16 1.159 29.792 11.652 1.00 1.47 H new ATOM 0 HA3 GLY A 16 2.715 29.496 12.401 1.00 1.47 H new ATOM 226 N GLY A 17 2.845 28.638 9.371 1.00 1.28 N ATOM 227 CA GLY A 17 3.311 28.834 8.049 1.00 1.25 C ATOM 228 C GLY A 17 4.672 29.422 8.057 1.00 1.24 C ATOM 229 O GLY A 17 4.940 30.413 7.406 1.00 1.36 O ATOM 0 H GLY A 17 2.564 27.679 9.574 1.00 1.28 H new ATOM 0 HA2 GLY A 17 3.323 27.883 7.517 1.00 1.25 H new ATOM 0 HA3 GLY A 17 2.628 29.491 7.511 1.00 1.25 H new ATOM 233 N LYS A 18 5.575 28.725 8.744 1.00 1.18 N ATOM 234 CA LYS A 18 6.978 29.099 8.769 1.00 1.23 C ATOM 235 C LYS A 18 7.546 28.271 7.615 1.00 1.13 C ATOM 236 O LYS A 18 8.439 28.699 6.892 1.00 1.22 O ATOM 237 CB LYS A 18 7.574 28.789 10.158 1.00 1.28 C ATOM 238 CG LYS A 18 6.525 28.581 11.263 1.00 1.34 C ATOM 239 CD LYS A 18 6.644 29.613 12.379 1.00 1.73 C ATOM 240 CE LYS A 18 5.447 29.563 13.320 1.00 1.91 C ATOM 241 NZ LYS A 18 5.797 28.988 14.649 1.00 2.50 N ATOM 0 H LYS A 18 5.353 27.894 9.292 1.00 1.18 H new ATOM 0 HA LYS A 18 7.199 30.158 8.633 1.00 1.23 H new ATOM 0 HB2 LYS A 18 8.190 27.893 10.085 1.00 1.28 H new ATOM 0 HB3 LYS A 18 8.234 29.607 10.448 1.00 1.28 H new ATOM 0 HG2 LYS A 18 5.527 28.634 10.828 1.00 1.34 H new ATOM 0 HG3 LYS A 18 6.637 27.581 11.683 1.00 1.34 H new ATOM 0 HD2 LYS A 18 7.559 29.435 12.944 1.00 1.73 H new ATOM 0 HD3 LYS A 18 6.726 30.610 11.946 1.00 1.73 H new ATOM 0 HE2 LYS A 18 5.051 30.570 13.455 1.00 1.91 H new ATOM 0 HE3 LYS A 18 4.655 28.967 12.866 1.00 1.91 H new ATOM 0 HZ1 LYS A 18 4.952 28.974 15.255 1.00 2.50 H new ATOM 0 HZ2 LYS A 18 6.150 28.018 14.525 1.00 2.50 H new ATOM 0 HZ3 LYS A 18 6.534 29.570 15.096 1.00 2.50 H new ATOM 255 N GLY A 19 7.227 26.978 7.710 1.00 1.02 N ATOM 256 CA GLY A 19 7.905 26.009 6.831 1.00 0.95 C ATOM 257 C GLY A 19 7.721 26.383 5.356 1.00 0.91 C ATOM 258 O GLY A 19 7.313 27.497 5.069 1.00 1.00 O ATOM 0 H GLY A 19 6.538 26.586 8.352 1.00 1.02 H new ATOM 0 HA2 GLY A 19 8.968 25.976 7.072 1.00 0.95 H new ATOM 0 HA3 GLY A 19 7.507 25.010 7.009 1.00 0.95 H new ATOM 262 N ARG A 20 8.249 25.611 4.421 1.00 0.86 N ATOM 263 CA ARG A 20 8.246 26.034 3.020 1.00 0.86 C ATOM 264 C ARG A 20 7.763 24.932 2.088 1.00 0.80 C ATOM 265 O ARG A 20 7.513 23.811 2.523 1.00 0.78 O ATOM 266 CB ARG A 20 9.661 26.446 2.659 1.00 0.94 C ATOM 267 CG ARG A 20 10.077 27.793 3.224 1.00 1.13 C ATOM 268 CD ARG A 20 11.590 27.969 3.179 1.00 1.55 C ATOM 269 NE ARG A 20 12.269 27.213 4.234 1.00 1.82 N ATOM 270 CZ ARG A 20 12.625 27.727 5.414 1.00 2.25 C ATOM 271 NH1 ARG A 20 12.358 28.993 5.709 1.00 2.59 N ATOM 272 NH2 ARG A 20 13.250 26.966 6.304 1.00 2.92 N ATOM 0 H ARG A 20 8.679 24.703 4.596 1.00 0.86 H new ATOM 0 HA ARG A 20 7.553 26.867 2.900 1.00 0.86 H new ATOM 0 HB2 ARG A 20 10.353 25.684 3.018 1.00 0.94 H new ATOM 0 HB3 ARG A 20 9.754 26.475 1.573 1.00 0.94 H new ATOM 0 HG2 ARG A 20 9.599 28.591 2.656 1.00 1.13 H new ATOM 0 HG3 ARG A 20 9.729 27.881 4.253 1.00 1.13 H new ATOM 0 HD2 ARG A 20 11.962 27.646 2.207 1.00 1.55 H new ATOM 0 HD3 ARG A 20 11.834 29.027 3.279 1.00 1.55 H new ATOM 0 HE ARG A 20 12.483 26.232 4.056 1.00 1.82 H new ATOM 0 HH11 ARG A 20 11.876 29.584 5.031 1.00 2.59 H new ATOM 0 HH12 ARG A 20 12.635 29.375 6.613 1.00 2.59 H new ATOM 0 HH21 ARG A 20 13.457 25.991 6.086 1.00 2.92 H new ATOM 0 HH22 ARG A 20 13.523 27.356 7.206 1.00 2.92 H new ATOM 286 N CYS A 21 7.612 25.259 0.807 1.00 0.82 N ATOM 287 CA CYS A 21 7.129 24.275 -0.160 1.00 0.81 C ATOM 288 C CYS A 21 8.243 23.743 -1.058 1.00 0.84 C ATOM 289 O CYS A 21 9.074 24.493 -1.571 1.00 1.04 O ATOM 290 CB CYS A 21 6.023 24.875 -1.024 1.00 0.91 C ATOM 291 SG CYS A 21 4.355 24.630 -0.344 1.00 1.10 S ATOM 0 H CYS A 21 7.813 26.181 0.419 1.00 0.82 H new ATOM 0 HA CYS A 21 6.737 23.436 0.416 1.00 0.81 H new ATOM 0 HB2 CYS A 21 6.205 25.943 -1.142 1.00 0.91 H new ATOM 0 HB3 CYS A 21 6.070 24.432 -2.019 1.00 0.91 H new ATOM 296 N PHE A 22 8.232 22.422 -1.229 1.00 0.76 N ATOM 297 CA PHE A 22 9.211 21.722 -2.050 1.00 0.83 C ATOM 298 C PHE A 22 8.545 20.538 -2.751 1.00 0.94 C ATOM 299 O PHE A 22 9.121 19.454 -2.857 1.00 1.43 O ATOM 300 CB PHE A 22 10.374 21.237 -1.180 1.00 0.85 C ATOM 301 CG PHE A 22 11.349 22.322 -0.824 1.00 0.84 C ATOM 302 CD1 PHE A 22 11.169 23.090 0.317 1.00 1.40 C ATOM 303 CD2 PHE A 22 12.446 22.574 -1.632 1.00 1.42 C ATOM 304 CE1 PHE A 22 12.067 24.090 0.643 1.00 1.51 C ATOM 305 CE2 PHE A 22 13.346 23.572 -1.311 1.00 1.50 C ATOM 306 CZ PHE A 22 13.157 24.331 -0.173 1.00 1.14 C ATOM 0 H PHE A 22 7.540 21.808 -0.799 1.00 0.76 H new ATOM 0 HA PHE A 22 9.601 22.406 -2.804 1.00 0.83 H new ATOM 0 HB2 PHE A 22 9.975 20.803 -0.263 1.00 0.85 H new ATOM 0 HB3 PHE A 22 10.903 20.442 -1.705 1.00 0.85 H new ATOM 0 HD1 PHE A 22 10.319 22.905 0.957 1.00 1.40 H new ATOM 0 HD2 PHE A 22 12.599 21.983 -2.523 1.00 1.42 H new ATOM 0 HE1 PHE A 22 11.917 24.682 1.534 1.00 1.51 H new ATOM 0 HE2 PHE A 22 14.197 23.758 -1.950 1.00 1.50 H new ATOM 0 HZ PHE A 22 13.859 25.112 0.079 1.00 1.14 H new ATOM 316 N GLY A 23 7.316 20.760 -3.213 1.00 0.83 N ATOM 317 CA GLY A 23 6.559 19.717 -3.887 1.00 0.88 C ATOM 318 C GLY A 23 5.081 19.768 -3.519 1.00 0.88 C ATOM 319 O GLY A 23 4.715 20.450 -2.563 1.00 0.90 O ATOM 0 H GLY A 23 6.828 21.652 -3.131 1.00 0.83 H new ATOM 0 HA2 GLY A 23 6.670 19.826 -4.966 1.00 0.88 H new ATOM 0 HA3 GLY A 23 6.967 18.742 -3.622 1.00 0.88 H new ATOM 323 N PRO A 24 4.193 19.063 -4.254 1.00 1.01 N ATOM 324 CA PRO A 24 2.755 19.070 -3.957 1.00 1.07 C ATOM 325 C PRO A 24 2.442 18.421 -2.610 1.00 0.96 C ATOM 326 O PRO A 24 2.035 19.100 -1.668 1.00 1.03 O ATOM 327 CB PRO A 24 2.132 18.266 -5.108 1.00 1.32 C ATOM 328 CG PRO A 24 3.192 18.197 -6.156 1.00 1.50 C ATOM 329 CD PRO A 24 4.500 18.217 -5.417 1.00 1.24 C ATOM 0 HA PRO A 24 2.363 20.084 -3.883 1.00 1.07 H new ATOM 0 HB2 PRO A 24 1.839 17.269 -4.778 1.00 1.32 H new ATOM 0 HB3 PRO A 24 1.234 18.753 -5.488 1.00 1.32 H new ATOM 0 HG2 PRO A 24 3.094 17.290 -6.752 1.00 1.50 H new ATOM 0 HG3 PRO A 24 3.118 19.040 -6.843 1.00 1.50 H new ATOM 0 HD2 PRO A 24 4.814 17.216 -5.120 1.00 1.24 H new ATOM 0 HD3 PRO A 24 5.303 18.636 -6.024 1.00 1.24 H new ATOM 337 N SER A 25 2.651 17.109 -2.515 1.00 0.97 N ATOM 338 CA SER A 25 2.405 16.391 -1.266 1.00 0.92 C ATOM 339 C SER A 25 3.666 16.405 -0.412 1.00 0.78 C ATOM 340 O SER A 25 4.030 15.400 0.187 1.00 0.81 O ATOM 341 CB SER A 25 1.966 14.935 -1.537 1.00 1.12 C ATOM 342 OG SER A 25 0.566 14.855 -1.740 1.00 1.26 O ATOM 0 H SER A 25 2.987 16.526 -3.281 1.00 0.97 H new ATOM 0 HA SER A 25 1.597 16.893 -0.733 1.00 0.92 H new ATOM 0 HB2 SER A 25 2.487 14.552 -2.415 1.00 1.12 H new ATOM 0 HB3 SER A 25 2.252 14.303 -0.696 1.00 1.12 H new ATOM 0 HG SER A 25 0.313 13.924 -1.911 1.00 1.26 H new ATOM 348 N ILE A 26 4.374 17.539 -0.398 1.00 0.70 N ATOM 349 CA ILE A 26 5.602 17.654 0.365 1.00 0.61 C ATOM 350 C ILE A 26 5.926 19.117 0.728 1.00 0.58 C ATOM 351 O ILE A 26 6.114 19.954 -0.155 1.00 0.73 O ATOM 352 CB ILE A 26 6.813 17.024 -0.364 1.00 0.60 C ATOM 353 CG1 ILE A 26 6.409 15.852 -1.264 1.00 0.79 C ATOM 354 CG2 ILE A 26 7.802 16.567 0.664 1.00 0.74 C ATOM 355 CD1 ILE A 26 7.019 15.908 -2.651 1.00 0.83 C ATOM 0 H ILE A 26 4.112 18.383 -0.907 1.00 0.70 H new ATOM 0 HA ILE A 26 5.426 17.096 1.284 1.00 0.61 H new ATOM 0 HB ILE A 26 7.253 17.780 -1.014 1.00 0.60 H new ATOM 0 HG12 ILE A 26 6.705 14.919 -0.784 1.00 0.79 H new ATOM 0 HG13 ILE A 26 5.323 15.833 -1.355 1.00 0.79 H new ATOM 0 HG21 ILE A 26 8.663 16.120 0.167 1.00 0.74 H new ATOM 0 HG22 ILE A 26 8.129 17.420 1.259 1.00 0.74 H new ATOM 0 HG23 ILE A 26 7.335 15.828 1.315 1.00 0.74 H new ATOM 0 HD11 ILE A 26 6.687 15.046 -3.229 1.00 0.83 H new ATOM 0 HD12 ILE A 26 6.703 16.824 -3.151 1.00 0.83 H new ATOM 0 HD13 ILE A 26 8.106 15.895 -2.571 1.00 0.83 H new ATOM 367 N CYS A 27 6.025 19.404 2.031 1.00 0.56 N ATOM 368 CA CYS A 27 6.371 20.751 2.521 1.00 0.56 C ATOM 369 C CYS A 27 7.580 20.633 3.460 1.00 0.55 C ATOM 370 O CYS A 27 7.509 19.937 4.464 1.00 0.59 O ATOM 371 CB CYS A 27 5.192 21.392 3.278 1.00 0.60 C ATOM 372 SG CYS A 27 4.696 23.056 2.686 1.00 0.92 S ATOM 0 H CYS A 27 5.870 18.720 2.772 1.00 0.56 H new ATOM 0 HA CYS A 27 6.606 21.387 1.668 1.00 0.56 H new ATOM 0 HB2 CYS A 27 4.331 20.727 3.207 1.00 0.60 H new ATOM 0 HB3 CYS A 27 5.454 21.463 4.334 1.00 0.60 H new ATOM 377 N CYS A 28 8.697 21.278 3.128 1.00 0.56 N ATOM 378 CA CYS A 28 9.903 21.182 3.956 1.00 0.58 C ATOM 379 C CYS A 28 10.171 22.478 4.778 1.00 0.61 C ATOM 380 O CYS A 28 9.873 23.584 4.317 1.00 0.76 O ATOM 381 CB CYS A 28 11.143 20.857 3.086 1.00 0.65 C ATOM 382 SG CYS A 28 11.402 19.098 2.620 1.00 1.28 S ATOM 0 H CYS A 28 8.795 21.867 2.301 1.00 0.56 H new ATOM 0 HA CYS A 28 9.726 20.371 4.662 1.00 0.58 H new ATOM 0 HB2 CYS A 28 11.076 21.443 2.170 1.00 0.65 H new ATOM 0 HB3 CYS A 28 12.030 21.200 3.620 1.00 0.65 H new ATOM 387 N GLY A 29 10.875 22.347 5.949 1.00 0.62 N ATOM 388 CA GLY A 29 11.261 23.476 6.714 1.00 0.65 C ATOM 389 C GLY A 29 12.636 23.232 7.327 1.00 0.67 C ATOM 390 O GLY A 29 13.144 22.105 7.343 1.00 0.66 O ATOM 0 H GLY A 29 11.164 21.452 6.343 1.00 0.62 H new ATOM 0 HA2 GLY A 29 11.285 24.364 6.083 1.00 0.65 H new ATOM 0 HA3 GLY A 29 10.529 23.663 7.500 1.00 0.65 H new ATOM 394 N ASP A 30 13.202 24.294 7.837 1.00 0.72 N ATOM 395 CA ASP A 30 14.500 24.311 8.496 1.00 0.76 C ATOM 396 C ASP A 30 14.424 23.510 9.784 1.00 0.77 C ATOM 397 O ASP A 30 15.354 22.806 10.176 1.00 0.80 O ATOM 398 CB ASP A 30 14.955 25.743 8.762 1.00 0.84 C ATOM 399 CG ASP A 30 13.919 26.553 9.511 1.00 1.41 C ATOM 400 OD1 ASP A 30 12.808 26.747 8.974 1.00 1.92 O ATOM 401 OD2 ASP A 30 14.222 26.994 10.638 1.00 2.27 O ATOM 0 H ASP A 30 12.761 25.213 7.808 1.00 0.72 H new ATOM 0 HA ASP A 30 15.240 23.852 7.841 1.00 0.76 H new ATOM 0 HB2 ASP A 30 15.881 25.725 9.336 1.00 0.84 H new ATOM 0 HB3 ASP A 30 15.177 26.232 7.813 1.00 0.84 H new ATOM 406 N GLU A 31 13.301 23.678 10.440 1.00 0.78 N ATOM 407 CA GLU A 31 13.049 22.978 11.703 1.00 0.83 C ATOM 408 C GLU A 31 11.769 22.188 11.635 1.00 0.87 C ATOM 409 O GLU A 31 11.270 21.694 12.641 1.00 1.00 O ATOM 410 CB GLU A 31 13.040 23.898 12.923 1.00 0.90 C ATOM 411 CG GLU A 31 12.832 25.368 12.625 1.00 0.99 C ATOM 412 CD GLU A 31 12.850 26.203 13.886 1.00 1.14 C ATOM 413 OE1 GLU A 31 12.000 25.961 14.769 1.00 1.66 O ATOM 414 OE2 GLU A 31 13.717 27.094 13.996 1.00 1.64 O ATOM 0 H GLU A 31 12.543 24.287 10.133 1.00 0.78 H new ATOM 0 HA GLU A 31 13.889 22.296 11.836 1.00 0.83 H new ATOM 0 HB2 GLU A 31 12.253 23.567 13.601 1.00 0.90 H new ATOM 0 HB3 GLU A 31 13.986 23.782 13.452 1.00 0.90 H new ATOM 0 HG2 GLU A 31 13.612 25.716 11.947 1.00 0.99 H new ATOM 0 HG3 GLU A 31 11.880 25.504 12.112 1.00 0.99 H new ATOM 421 N LEU A 32 11.184 22.154 10.435 1.00 0.82 N ATOM 422 CA LEU A 32 9.947 21.498 10.179 1.00 0.88 C ATOM 423 C LEU A 32 10.164 20.262 9.329 1.00 0.82 C ATOM 424 O LEU A 32 9.278 19.416 9.190 1.00 0.90 O ATOM 425 CB LEU A 32 9.059 22.505 9.499 1.00 0.93 C ATOM 426 CG LEU A 32 7.746 22.838 10.226 1.00 1.15 C ATOM 427 CD1 LEU A 32 7.028 23.982 9.530 1.00 1.24 C ATOM 428 CD2 LEU A 32 6.839 21.622 10.344 1.00 1.37 C ATOM 0 H LEU A 32 11.586 22.599 9.610 1.00 0.82 H new ATOM 0 HA LEU A 32 9.480 21.150 11.100 1.00 0.88 H new ATOM 0 HB2 LEU A 32 9.623 23.428 9.367 1.00 0.93 H new ATOM 0 HB3 LEU A 32 8.817 22.134 8.503 1.00 0.93 H new ATOM 0 HG LEU A 32 8.001 23.150 11.239 1.00 1.15 H new ATOM 0 HD11 LEU A 32 6.101 24.204 10.058 1.00 1.24 H new ATOM 0 HD12 LEU A 32 7.666 24.866 9.530 1.00 1.24 H new ATOM 0 HD13 LEU A 32 6.801 23.698 8.502 1.00 1.24 H new ATOM 0 HD21 LEU A 32 5.922 21.901 10.864 1.00 1.37 H new ATOM 0 HD22 LEU A 32 6.594 21.253 9.348 1.00 1.37 H new ATOM 0 HD23 LEU A 32 7.350 20.840 10.905 1.00 1.37 H new ATOM 440 N GLY A 33 11.368 20.165 8.771 1.00 0.73 N ATOM 441 CA GLY A 33 11.720 19.048 7.954 1.00 0.71 C ATOM 442 C GLY A 33 10.816 18.926 6.748 1.00 0.67 C ATOM 443 O GLY A 33 10.848 19.802 5.924 1.00 0.65 O ATOM 0 H GLY A 33 12.107 20.859 8.881 1.00 0.73 H new ATOM 0 HA2 GLY A 33 12.754 19.151 7.624 1.00 0.71 H new ATOM 0 HA3 GLY A 33 11.663 18.134 8.545 1.00 0.71 H new ATOM 447 N CYS A 34 10.016 17.863 6.620 1.00 0.70 N ATOM 448 CA CYS A 34 9.134 17.745 5.468 1.00 0.69 C ATOM 449 C CYS A 34 7.863 17.042 5.797 1.00 0.65 C ATOM 450 O CYS A 34 7.867 15.902 6.243 1.00 0.62 O ATOM 451 CB CYS A 34 9.820 17.118 4.289 1.00 0.73 C ATOM 452 SG CYS A 34 9.624 18.130 2.782 1.00 1.08 S ATOM 0 H CYS A 34 9.964 17.092 7.285 1.00 0.70 H new ATOM 0 HA CYS A 34 8.870 18.763 5.182 1.00 0.69 H new ATOM 0 HB2 CYS A 34 10.880 16.993 4.508 1.00 0.73 H new ATOM 0 HB3 CYS A 34 9.410 16.123 4.116 1.00 0.73 H new ATOM 457 N PHE A 35 6.765 17.699 5.453 1.00 0.68 N ATOM 458 CA PHE A 35 5.489 17.090 5.607 1.00 0.67 C ATOM 459 C PHE A 35 5.158 16.645 4.224 1.00 0.64 C ATOM 460 O PHE A 35 4.740 17.441 3.380 1.00 0.63 O ATOM 461 CB PHE A 35 4.393 18.041 6.147 1.00 0.69 C ATOM 462 CG PHE A 35 4.809 19.469 6.427 1.00 0.73 C ATOM 463 CD1 PHE A 35 5.932 19.756 7.190 1.00 0.98 C ATOM 464 CD2 PHE A 35 4.055 20.522 5.933 1.00 1.16 C ATOM 465 CE1 PHE A 35 6.292 21.066 7.450 1.00 1.21 C ATOM 466 CE2 PHE A 35 4.412 21.833 6.191 1.00 1.38 C ATOM 467 CZ PHE A 35 5.531 22.104 6.950 1.00 1.26 C ATOM 0 H PHE A 35 6.750 18.644 5.070 1.00 0.68 H new ATOM 0 HA PHE A 35 5.524 16.290 6.347 1.00 0.67 H new ATOM 0 HB2 PHE A 35 3.574 18.060 5.427 1.00 0.69 H new ATOM 0 HB3 PHE A 35 3.997 17.615 7.069 1.00 0.69 H new ATOM 0 HD1 PHE A 35 6.531 18.949 7.585 1.00 0.98 H new ATOM 0 HD2 PHE A 35 3.177 20.316 5.339 1.00 1.16 H new ATOM 0 HE1 PHE A 35 7.169 21.277 8.044 1.00 1.21 H new ATOM 0 HE2 PHE A 35 3.815 22.643 5.799 1.00 1.38 H new ATOM 0 HZ PHE A 35 5.812 23.127 7.153 1.00 1.26 H new ATOM 477 N VAL A 36 5.366 15.375 3.987 1.00 0.67 N ATOM 478 CA VAL A 36 5.114 14.830 2.694 1.00 0.68 C ATOM 479 C VAL A 36 3.692 14.313 2.676 1.00 0.71 C ATOM 480 O VAL A 36 3.389 13.144 2.949 1.00 0.74 O ATOM 481 CB VAL A 36 6.164 13.762 2.273 1.00 0.74 C ATOM 482 CG1 VAL A 36 6.213 13.669 0.754 1.00 0.75 C ATOM 483 CG2 VAL A 36 7.569 14.104 2.818 1.00 0.76 C ATOM 0 H VAL A 36 5.709 14.706 4.677 1.00 0.67 H new ATOM 0 HA VAL A 36 5.220 15.610 1.940 1.00 0.68 H new ATOM 0 HB VAL A 36 5.863 12.804 2.697 1.00 0.74 H new ATOM 0 HG11 VAL A 36 6.949 12.921 0.459 1.00 0.75 H new ATOM 0 HG12 VAL A 36 5.232 13.383 0.375 1.00 0.75 H new ATOM 0 HG13 VAL A 36 6.494 14.637 0.339 1.00 0.75 H new ATOM 0 HG21 VAL A 36 8.277 13.337 2.505 1.00 0.76 H new ATOM 0 HG22 VAL A 36 7.885 15.071 2.427 1.00 0.76 H new ATOM 0 HG23 VAL A 36 7.537 14.145 3.907 1.00 0.76 H new ATOM 493 N GLY A 37 2.820 15.254 2.366 1.00 0.71 N ATOM 494 CA GLY A 37 1.393 14.979 2.299 1.00 0.76 C ATOM 495 C GLY A 37 0.673 15.187 3.622 1.00 0.72 C ATOM 496 O GLY A 37 0.425 14.236 4.360 1.00 0.81 O ATOM 0 H GLY A 37 3.074 16.219 2.156 1.00 0.71 H new ATOM 0 HA2 GLY A 37 0.942 15.623 1.544 1.00 0.76 H new ATOM 0 HA3 GLY A 37 1.244 13.950 1.971 1.00 0.76 H new ATOM 500 N THR A 38 0.324 16.436 3.906 1.00 0.68 N ATOM 501 CA THR A 38 -0.388 16.796 5.135 1.00 0.68 C ATOM 502 C THR A 38 -1.138 18.093 4.912 1.00 0.72 C ATOM 503 O THR A 38 -0.897 18.758 3.905 1.00 0.77 O ATOM 504 CB THR A 38 0.612 17.018 6.276 1.00 0.72 C ATOM 505 OG1 THR A 38 1.426 18.152 6.011 1.00 0.77 O ATOM 506 CG2 THR A 38 1.534 15.845 6.516 1.00 0.76 C ATOM 0 H THR A 38 0.524 17.228 3.296 1.00 0.68 H new ATOM 0 HA THR A 38 -1.074 15.990 5.393 1.00 0.68 H new ATOM 0 HB THR A 38 -0.000 17.160 7.166 1.00 0.72 H new ATOM 0 HG1 THR A 38 1.658 18.593 6.855 1.00 0.77 H new ATOM 0 HG21 THR A 38 2.212 16.077 7.337 1.00 0.76 H new ATOM 0 HG22 THR A 38 0.944 14.964 6.770 1.00 0.76 H new ATOM 0 HG23 THR A 38 2.112 15.646 5.614 1.00 0.76 H new ATOM 514 N ALA A 39 -2.119 18.448 5.756 1.00 0.77 N ATOM 515 CA ALA A 39 -2.887 19.673 5.544 1.00 0.86 C ATOM 516 C ALA A 39 -2.000 20.895 5.320 1.00 0.82 C ATOM 517 O ALA A 39 -2.317 21.748 4.491 1.00 0.86 O ATOM 518 CB ALA A 39 -3.792 19.919 6.748 1.00 1.02 C ATOM 0 H ALA A 39 -2.392 17.910 6.578 1.00 0.77 H new ATOM 0 HA ALA A 39 -3.478 19.531 4.639 1.00 0.86 H new ATOM 0 HB1 ALA A 39 -4.366 20.833 6.591 1.00 1.02 H new ATOM 0 HB2 ALA A 39 -4.475 19.078 6.868 1.00 1.02 H new ATOM 0 HB3 ALA A 39 -3.183 20.023 7.646 1.00 1.02 H new ATOM 524 N GLU A 40 -0.857 20.951 6.010 1.00 0.78 N ATOM 525 CA GLU A 40 0.082 22.057 5.836 1.00 0.79 C ATOM 526 C GLU A 40 0.531 22.133 4.380 1.00 0.74 C ATOM 527 O GLU A 40 0.961 23.186 3.903 1.00 0.79 O ATOM 528 CB GLU A 40 1.286 21.884 6.762 1.00 0.82 C ATOM 529 CG GLU A 40 0.903 21.651 8.215 1.00 1.25 C ATOM 530 CD GLU A 40 1.931 20.827 8.964 1.00 1.55 C ATOM 531 OE1 GLU A 40 2.342 19.771 8.439 1.00 2.32 O ATOM 532 OE2 GLU A 40 2.326 21.238 10.075 1.00 1.91 O ATOM 0 H GLU A 40 -0.563 20.248 6.688 1.00 0.78 H new ATOM 0 HA GLU A 40 -0.418 22.990 6.097 1.00 0.79 H new ATOM 0 HB2 GLU A 40 1.885 21.043 6.413 1.00 0.82 H new ATOM 0 HB3 GLU A 40 1.915 22.772 6.698 1.00 0.82 H new ATOM 0 HG2 GLU A 40 0.781 22.613 8.713 1.00 1.25 H new ATOM 0 HG3 GLU A 40 -0.062 21.146 8.256 1.00 1.25 H new ATOM 539 N ALA A 41 0.455 20.995 3.679 1.00 0.70 N ATOM 540 CA ALA A 41 0.852 20.913 2.306 1.00 0.71 C ATOM 541 C ALA A 41 -0.237 21.486 1.431 1.00 0.78 C ATOM 542 O ALA A 41 0.033 21.875 0.313 1.00 0.87 O ATOM 543 CB ALA A 41 1.169 19.475 1.928 1.00 0.77 C ATOM 0 H ALA A 41 0.113 20.115 4.067 1.00 0.70 H new ATOM 0 HA ALA A 41 1.759 21.498 2.156 1.00 0.71 H new ATOM 0 HB1 ALA A 41 1.469 19.432 0.881 1.00 0.77 H new ATOM 0 HB2 ALA A 41 1.981 19.105 2.554 1.00 0.77 H new ATOM 0 HB3 ALA A 41 0.284 18.856 2.078 1.00 0.77 H new ATOM 549 N LEU A 42 -1.500 21.526 1.896 1.00 0.81 N ATOM 550 CA LEU A 42 -2.587 22.098 1.091 1.00 0.94 C ATOM 551 C LEU A 42 -2.187 23.493 0.593 1.00 1.05 C ATOM 552 O LEU A 42 -2.442 23.861 -0.554 1.00 1.23 O ATOM 553 CB LEU A 42 -3.862 22.197 1.943 1.00 0.98 C ATOM 554 CG LEU A 42 -4.763 20.959 1.925 1.00 1.02 C ATOM 555 CD1 LEU A 42 -5.262 20.637 3.328 1.00 1.11 C ATOM 556 CD2 LEU A 42 -5.935 21.173 0.980 1.00 1.16 C ATOM 0 H LEU A 42 -1.786 21.175 2.810 1.00 0.81 H new ATOM 0 HA LEU A 42 -2.776 21.453 0.233 1.00 0.94 H new ATOM 0 HB2 LEU A 42 -3.574 22.401 2.974 1.00 0.98 H new ATOM 0 HB3 LEU A 42 -4.443 23.053 1.599 1.00 0.98 H new ATOM 0 HG LEU A 42 -4.178 20.112 1.568 1.00 1.02 H new ATOM 0 HD11 LEU A 42 -5.900 19.754 3.293 1.00 1.11 H new ATOM 0 HD12 LEU A 42 -4.411 20.444 3.981 1.00 1.11 H new ATOM 0 HD13 LEU A 42 -5.832 21.482 3.714 1.00 1.11 H new ATOM 0 HD21 LEU A 42 -6.567 20.285 0.977 1.00 1.16 H new ATOM 0 HD22 LEU A 42 -6.518 22.032 1.312 1.00 1.16 H new ATOM 0 HD23 LEU A 42 -5.561 21.355 -0.028 1.00 1.16 H new ATOM 568 N ARG A 43 -1.507 24.237 1.470 1.00 1.04 N ATOM 569 CA ARG A 43 -0.996 25.574 1.142 1.00 1.23 C ATOM 570 C ARG A 43 0.108 25.468 0.076 1.00 1.24 C ATOM 571 O ARG A 43 0.550 26.459 -0.487 1.00 1.46 O ATOM 572 CB ARG A 43 -0.427 26.229 2.416 1.00 1.32 C ATOM 573 CG ARG A 43 0.238 27.591 2.205 1.00 1.34 C ATOM 574 CD ARG A 43 1.727 27.468 1.897 1.00 1.50 C ATOM 575 NE ARG A 43 2.074 28.088 0.617 1.00 1.88 N ATOM 576 CZ ARG A 43 3.279 28.028 0.056 1.00 2.20 C ATOM 577 NH1 ARG A 43 4.316 27.546 0.728 1.00 2.39 N ATOM 578 NH2 ARG A 43 3.449 28.475 -1.181 1.00 2.92 N ATOM 0 H ARG A 43 -1.296 23.934 2.421 1.00 1.04 H new ATOM 0 HA ARG A 43 -1.809 26.184 0.749 1.00 1.23 H new ATOM 0 HB2 ARG A 43 -1.235 26.345 3.138 1.00 1.32 H new ATOM 0 HB3 ARG A 43 0.302 25.551 2.860 1.00 1.32 H new ATOM 0 HG2 ARG A 43 -0.258 28.112 1.386 1.00 1.34 H new ATOM 0 HG3 ARG A 43 0.103 28.201 3.098 1.00 1.34 H new ATOM 0 HD2 ARG A 43 2.302 27.937 2.695 1.00 1.50 H new ATOM 0 HD3 ARG A 43 2.008 26.415 1.878 1.00 1.50 H new ATOM 0 HE ARG A 43 1.343 28.600 0.122 1.00 1.88 H new ATOM 0 HH11 ARG A 43 4.195 27.216 1.686 1.00 2.39 H new ATOM 0 HH12 ARG A 43 5.235 27.505 0.287 1.00 2.39 H new ATOM 0 HH21 ARG A 43 2.659 28.862 -1.697 1.00 2.92 H new ATOM 0 HH22 ARG A 43 4.370 28.432 -1.617 1.00 2.92 H new ATOM 592 N CYS A 44 0.457 24.235 -0.250 1.00 1.08 N ATOM 593 CA CYS A 44 1.448 23.988 -1.293 1.00 1.15 C ATOM 594 C CYS A 44 0.871 24.215 -2.684 1.00 1.41 C ATOM 595 O CYS A 44 1.575 24.024 -3.678 1.00 1.57 O ATOM 596 CB CYS A 44 2.130 22.627 -1.183 1.00 1.04 C ATOM 597 SG CYS A 44 3.929 22.692 -0.818 1.00 1.28 S ATOM 0 H CYS A 44 0.076 23.395 0.185 1.00 1.08 H new ATOM 0 HA CYS A 44 2.234 24.726 -1.130 1.00 1.15 H new ATOM 0 HB2 CYS A 44 1.636 22.051 -0.401 1.00 1.04 H new ATOM 0 HB3 CYS A 44 1.983 22.086 -2.118 1.00 1.04 H new ATOM 602 N GLN A 45 -0.415 24.575 -2.797 1.00 1.55 N ATOM 603 CA GLN A 45 -1.016 24.806 -4.099 1.00 1.86 C ATOM 604 C GLN A 45 -0.437 26.065 -4.742 1.00 2.09 C ATOM 605 O GLN A 45 -0.413 26.195 -5.970 1.00 2.35 O ATOM 606 CB GLN A 45 -2.533 24.962 -3.937 1.00 1.97 C ATOM 607 CG GLN A 45 -3.314 24.712 -5.214 1.00 2.40 C ATOM 608 CD GLN A 45 -4.116 23.428 -5.162 1.00 2.73 C ATOM 609 OE1 GLN A 45 -3.734 22.421 -5.755 1.00 3.31 O ATOM 610 NE2 GLN A 45 -5.238 23.456 -4.450 1.00 3.02 N ATOM 0 H GLN A 45 -1.046 24.709 -2.007 1.00 1.55 H new ATOM 0 HA GLN A 45 -0.798 23.955 -4.744 1.00 1.86 H new ATOM 0 HB2 GLN A 45 -2.880 24.271 -3.169 1.00 1.97 H new ATOM 0 HB3 GLN A 45 -2.749 25.969 -3.581 1.00 1.97 H new ATOM 0 HG2 GLN A 45 -3.987 25.550 -5.394 1.00 2.40 H new ATOM 0 HG3 GLN A 45 -2.623 24.671 -6.056 1.00 2.40 H new ATOM 0 HE21 GLN A 45 -5.518 24.313 -3.973 1.00 3.02 H new ATOM 0 HE22 GLN A 45 -5.819 22.620 -4.380 1.00 3.02 H new ATOM 619 N GLU A 46 0.063 26.985 -3.916 1.00 2.07 N ATOM 620 CA GLU A 46 0.646 28.212 -4.451 1.00 2.35 C ATOM 621 C GLU A 46 2.104 27.980 -4.839 1.00 2.34 C ATOM 622 O GLU A 46 2.782 28.889 -5.323 1.00 2.50 O ATOM 623 CB GLU A 46 0.550 29.345 -3.427 1.00 2.41 C ATOM 624 CG GLU A 46 -0.877 29.771 -3.122 1.00 2.80 C ATOM 625 CD GLU A 46 -1.011 30.429 -1.763 1.00 3.19 C ATOM 626 OE1 GLU A 46 -0.859 29.724 -0.744 1.00 3.69 O ATOM 627 OE2 GLU A 46 -1.267 31.652 -1.718 1.00 3.53 O ATOM 0 H GLU A 46 0.076 26.907 -2.899 1.00 2.07 H new ATOM 0 HA GLU A 46 0.085 28.499 -5.340 1.00 2.35 H new ATOM 0 HB2 GLU A 46 1.031 29.029 -2.502 1.00 2.41 H new ATOM 0 HB3 GLU A 46 1.106 30.206 -3.797 1.00 2.41 H new ATOM 0 HG2 GLU A 46 -1.218 30.463 -3.892 1.00 2.80 H new ATOM 0 HG3 GLU A 46 -1.530 28.899 -3.165 1.00 2.80 H new ATOM 634 N GLU A 47 2.559 26.736 -4.692 1.00 2.22 N ATOM 635 CA GLU A 47 3.910 26.373 -5.081 1.00 2.31 C ATOM 636 C GLU A 47 3.957 26.112 -6.587 1.00 2.34 C ATOM 637 O GLU A 47 5.001 25.757 -7.135 1.00 2.42 O ATOM 638 CB GLU A 47 4.370 25.128 -4.318 1.00 2.37 C ATOM 639 CG GLU A 47 5.880 24.984 -4.236 1.00 2.96 C ATOM 640 CD GLU A 47 6.406 23.861 -5.109 1.00 3.45 C ATOM 641 OE1 GLU A 47 6.003 22.699 -4.890 1.00 3.68 O ATOM 642 OE2 GLU A 47 7.222 24.143 -6.012 1.00 3.99 O ATOM 0 H GLU A 47 2.009 25.968 -4.307 1.00 2.22 H new ATOM 0 HA GLU A 47 4.582 27.196 -4.836 1.00 2.31 H new ATOM 0 HB2 GLU A 47 3.962 25.161 -3.308 1.00 2.37 H new ATOM 0 HB3 GLU A 47 3.955 24.243 -4.801 1.00 2.37 H new ATOM 0 HG2 GLU A 47 6.348 25.922 -4.536 1.00 2.96 H new ATOM 0 HG3 GLU A 47 6.168 24.800 -3.201 1.00 2.96 H new ATOM 649 N ASN A 48 2.817 26.317 -7.254 1.00 2.53 N ATOM 650 CA ASN A 48 2.722 26.135 -8.691 1.00 2.96 C ATOM 651 C ASN A 48 2.929 27.471 -9.400 1.00 3.29 C ATOM 652 O ASN A 48 3.371 27.513 -10.549 1.00 3.76 O ATOM 653 CB ASN A 48 1.362 25.543 -9.066 1.00 3.12 C ATOM 654 CG ASN A 48 1.386 24.828 -10.403 1.00 3.42 C ATOM 655 OD1 ASN A 48 2.182 23.913 -10.616 1.00 3.86 O ATOM 656 ND2 ASN A 48 0.511 25.242 -11.313 1.00 3.75 N ATOM 0 H ASN A 48 1.946 26.611 -6.811 1.00 2.53 H new ATOM 0 HA ASN A 48 3.500 25.441 -9.008 1.00 2.96 H new ATOM 0 HB2 ASN A 48 1.047 24.845 -8.290 1.00 3.12 H new ATOM 0 HB3 ASN A 48 0.619 26.340 -9.098 1.00 3.12 H new ATOM 0 HD21 ASN A 48 0.481 24.798 -12.231 1.00 3.75 H new ATOM 0 HD22 ASN A 48 -0.131 26.004 -11.094 1.00 3.75 H new ATOM 663 N TYR A 49 2.602 28.567 -8.709 1.00 3.15 N ATOM 664 CA TYR A 49 2.751 29.902 -9.282 1.00 3.51 C ATOM 665 C TYR A 49 3.877 30.692 -8.608 1.00 3.62 C ATOM 666 O TYR A 49 4.021 31.893 -8.839 1.00 4.04 O ATOM 667 CB TYR A 49 1.433 30.672 -9.169 1.00 3.61 C ATOM 668 CG TYR A 49 0.267 29.979 -9.838 1.00 3.97 C ATOM 669 CD1 TYR A 49 0.150 29.948 -11.222 1.00 4.19 C ATOM 670 CD2 TYR A 49 -0.720 29.353 -9.084 1.00 4.52 C ATOM 671 CE1 TYR A 49 -0.914 29.314 -11.836 1.00 4.70 C ATOM 672 CE2 TYR A 49 -1.786 28.718 -9.691 1.00 5.05 C ATOM 673 CZ TYR A 49 -1.879 28.701 -11.067 1.00 5.03 C ATOM 674 OH TYR A 49 -2.939 28.068 -11.674 1.00 5.68 O ATOM 0 H TYR A 49 2.235 28.554 -7.758 1.00 3.15 H new ATOM 0 HA TYR A 49 3.015 29.781 -10.332 1.00 3.51 H new ATOM 0 HB2 TYR A 49 1.199 30.823 -8.115 1.00 3.61 H new ATOM 0 HB3 TYR A 49 1.560 31.660 -9.612 1.00 3.61 H new ATOM 0 HD1 TYR A 49 0.904 30.428 -11.829 1.00 4.19 H new ATOM 0 HD2 TYR A 49 -0.652 29.364 -8.006 1.00 4.52 H new ATOM 0 HE1 TYR A 49 -0.988 29.299 -12.913 1.00 4.70 H new ATOM 0 HE2 TYR A 49 -2.544 28.237 -9.090 1.00 5.05 H new ATOM 0 HH TYR A 49 -3.528 27.687 -10.990 1.00 5.68 H new ATOM 684 N LEU A 50 4.674 30.020 -7.777 1.00 3.50 N ATOM 685 CA LEU A 50 5.779 30.678 -7.082 1.00 3.67 C ATOM 686 C LEU A 50 6.979 29.733 -6.923 1.00 3.63 C ATOM 687 O LEU A 50 7.171 29.145 -5.859 1.00 3.79 O ATOM 688 CB LEU A 50 5.318 31.177 -5.708 1.00 4.02 C ATOM 689 CG LEU A 50 5.510 32.676 -5.463 1.00 4.66 C ATOM 690 CD1 LEU A 50 4.218 33.308 -4.967 1.00 4.84 C ATOM 691 CD2 LEU A 50 6.636 32.913 -4.467 1.00 5.40 C ATOM 0 H LEU A 50 4.576 29.026 -7.570 1.00 3.50 H new ATOM 0 HA LEU A 50 6.096 31.529 -7.685 1.00 3.67 H new ATOM 0 HB2 LEU A 50 4.261 30.937 -5.588 1.00 4.02 H new ATOM 0 HB3 LEU A 50 5.859 30.627 -4.939 1.00 4.02 H new ATOM 0 HG LEU A 50 5.781 33.146 -6.408 1.00 4.66 H new ATOM 0 HD11 LEU A 50 4.375 34.373 -4.799 1.00 4.84 H new ATOM 0 HD12 LEU A 50 3.436 33.170 -5.713 1.00 4.84 H new ATOM 0 HD13 LEU A 50 3.916 32.834 -4.033 1.00 4.84 H new ATOM 0 HD21 LEU A 50 6.759 33.984 -4.305 1.00 5.40 H new ATOM 0 HD22 LEU A 50 6.393 32.428 -3.521 1.00 5.40 H new ATOM 0 HD23 LEU A 50 7.563 32.497 -4.861 1.00 5.40 H new ATOM 703 N PRO A 51 7.804 29.564 -7.983 1.00 3.88 N ATOM 704 CA PRO A 51 8.968 28.686 -7.953 1.00 4.25 C ATOM 705 C PRO A 51 10.264 29.429 -7.618 1.00 4.32 C ATOM 706 O PRO A 51 11.261 29.310 -8.331 1.00 4.70 O ATOM 707 CB PRO A 51 8.999 28.165 -9.386 1.00 4.88 C ATOM 708 CG PRO A 51 8.475 29.295 -10.221 1.00 4.92 C ATOM 709 CD PRO A 51 7.672 30.199 -9.307 1.00 4.30 C ATOM 0 HA PRO A 51 8.897 27.915 -7.186 1.00 4.25 H new ATOM 0 HB2 PRO A 51 10.011 27.890 -9.684 1.00 4.88 H new ATOM 0 HB3 PRO A 51 8.381 27.274 -9.495 1.00 4.88 H new ATOM 0 HG2 PRO A 51 9.296 29.845 -10.681 1.00 4.92 H new ATOM 0 HG3 PRO A 51 7.852 28.917 -11.031 1.00 4.92 H new ATOM 0 HD2 PRO A 51 8.064 31.216 -9.304 1.00 4.30 H new ATOM 0 HD3 PRO A 51 6.630 30.260 -9.620 1.00 4.30 H new ATOM 717 N SER A 52 10.239 30.204 -6.537 1.00 4.18 N ATOM 718 CA SER A 52 11.407 30.978 -6.117 1.00 4.35 C ATOM 719 C SER A 52 12.379 30.138 -5.277 1.00 3.79 C ATOM 720 O SER A 52 12.022 29.672 -4.194 1.00 3.48 O ATOM 721 CB SER A 52 10.960 32.200 -5.312 1.00 4.83 C ATOM 722 OG SER A 52 10.135 33.051 -6.088 1.00 5.64 O ATOM 0 H SER A 52 9.423 30.314 -5.935 1.00 4.18 H new ATOM 0 HA SER A 52 11.931 31.296 -7.018 1.00 4.35 H new ATOM 0 HB2 SER A 52 10.418 31.875 -4.424 1.00 4.83 H new ATOM 0 HB3 SER A 52 11.835 32.752 -4.968 1.00 4.83 H new ATOM 0 HG SER A 52 9.862 33.823 -5.549 1.00 5.64 H new ATOM 728 N PRO A 53 13.634 29.944 -5.750 1.00 3.98 N ATOM 729 CA PRO A 53 14.643 29.175 -5.015 1.00 3.75 C ATOM 730 C PRO A 53 15.323 30.021 -3.937 1.00 2.89 C ATOM 731 O PRO A 53 15.902 31.064 -4.237 1.00 2.99 O ATOM 732 CB PRO A 53 15.641 28.798 -6.108 1.00 4.57 C ATOM 733 CG PRO A 53 15.591 29.940 -7.064 1.00 5.04 C ATOM 734 CD PRO A 53 14.176 30.467 -7.027 1.00 4.80 C ATOM 0 HA PRO A 53 14.221 28.320 -4.487 1.00 3.75 H new ATOM 0 HB2 PRO A 53 16.643 28.663 -5.702 1.00 4.57 H new ATOM 0 HB3 PRO A 53 15.365 27.861 -6.593 1.00 4.57 H new ATOM 0 HG2 PRO A 53 16.302 30.716 -6.779 1.00 5.04 H new ATOM 0 HG3 PRO A 53 15.858 29.616 -8.070 1.00 5.04 H new ATOM 0 HD2 PRO A 53 14.155 31.556 -7.054 1.00 4.80 H new ATOM 0 HD3 PRO A 53 13.596 30.116 -7.881 1.00 4.80 H new ATOM 742 N CYS A 54 15.234 29.582 -2.681 1.00 2.53 N ATOM 743 CA CYS A 54 15.828 30.326 -1.565 1.00 2.00 C ATOM 744 C CYS A 54 16.869 29.488 -0.808 1.00 2.22 C ATOM 745 O CYS A 54 17.371 28.489 -1.323 1.00 2.72 O ATOM 746 CB CYS A 54 14.715 30.791 -0.607 1.00 2.36 C ATOM 747 SG CYS A 54 14.095 29.502 0.526 1.00 2.74 S ATOM 0 H CYS A 54 14.760 28.721 -2.410 1.00 2.53 H new ATOM 0 HA CYS A 54 16.347 31.193 -1.974 1.00 2.00 H new ATOM 0 HB2 CYS A 54 15.090 31.626 -0.015 1.00 2.36 H new ATOM 0 HB3 CYS A 54 13.880 31.168 -1.198 1.00 2.36 H new ATOM 752 N GLN A 55 17.162 29.895 0.436 1.00 2.24 N ATOM 753 CA GLN A 55 18.122 29.149 1.264 1.00 2.74 C ATOM 754 C GLN A 55 17.631 27.714 1.513 1.00 2.26 C ATOM 755 O GLN A 55 16.512 27.508 1.983 1.00 2.47 O ATOM 756 CB GLN A 55 18.346 29.860 2.602 1.00 3.51 C ATOM 757 CG GLN A 55 17.102 29.939 3.474 1.00 4.44 C ATOM 758 CD GLN A 55 17.138 28.961 4.633 1.00 5.23 C ATOM 759 OE1 GLN A 55 17.376 27.768 4.446 1.00 5.71 O ATOM 760 NE2 GLN A 55 16.900 29.464 5.840 1.00 5.75 N ATOM 0 H GLN A 55 16.759 30.718 0.884 1.00 2.24 H new ATOM 0 HA GLN A 55 19.067 29.106 0.723 1.00 2.74 H new ATOM 0 HB2 GLN A 55 19.131 29.340 3.152 1.00 3.51 H new ATOM 0 HB3 GLN A 55 18.708 30.870 2.409 1.00 3.51 H new ATOM 0 HG2 GLN A 55 16.999 30.952 3.862 1.00 4.44 H new ATOM 0 HG3 GLN A 55 16.221 29.740 2.863 1.00 4.44 H new ATOM 0 HE21 GLN A 55 16.707 30.460 5.949 1.00 5.75 H new ATOM 0 HE22 GLN A 55 16.910 28.854 6.658 1.00 5.75 H new ATOM 769 N SER A 56 18.473 26.721 1.194 1.00 2.28 N ATOM 770 CA SER A 56 18.117 25.308 1.383 1.00 2.07 C ATOM 771 C SER A 56 19.381 24.443 1.543 1.00 1.82 C ATOM 772 O SER A 56 20.441 24.956 1.899 1.00 2.22 O ATOM 773 CB SER A 56 17.291 24.815 0.186 1.00 2.60 C ATOM 774 OG SER A 56 15.945 25.247 0.274 1.00 3.12 O ATOM 0 H SER A 56 19.404 26.870 0.805 1.00 2.28 H new ATOM 0 HA SER A 56 17.523 25.219 2.293 1.00 2.07 H new ATOM 0 HB2 SER A 56 17.733 25.183 -0.740 1.00 2.60 H new ATOM 0 HB3 SER A 56 17.323 23.726 0.143 1.00 2.60 H new ATOM 0 HG SER A 56 15.352 24.538 -0.052 1.00 3.12 H new ATOM 780 N GLY A 57 19.250 23.126 1.318 1.00 1.58 N ATOM 781 CA GLY A 57 20.365 22.234 1.459 1.00 1.86 C ATOM 782 C GLY A 57 20.632 21.508 0.171 1.00 1.68 C ATOM 783 O GLY A 57 19.713 20.973 -0.448 1.00 2.10 O ATOM 0 H GLY A 57 18.378 22.676 1.039 1.00 1.58 H new ATOM 0 HA2 GLY A 57 21.251 22.796 1.756 1.00 1.86 H new ATOM 0 HA3 GLY A 57 20.163 21.514 2.252 1.00 1.86 H new ATOM 787 N GLN A 58 21.885 21.467 -0.222 1.00 1.37 N ATOM 788 CA GLN A 58 22.266 20.779 -1.428 1.00 1.46 C ATOM 789 C GLN A 58 23.014 19.536 -1.036 1.00 1.08 C ATOM 790 O GLN A 58 24.235 19.445 -1.155 1.00 1.00 O ATOM 791 CB GLN A 58 23.122 21.670 -2.334 1.00 1.97 C ATOM 792 CG GLN A 58 22.830 21.489 -3.818 1.00 2.80 C ATOM 793 CD GLN A 58 22.411 22.782 -4.493 1.00 3.61 C ATOM 794 OE1 GLN A 58 21.231 22.996 -4.773 1.00 3.96 O ATOM 795 NE2 GLN A 58 23.379 23.652 -4.761 1.00 4.36 N ATOM 0 H GLN A 58 22.658 21.904 0.280 1.00 1.37 H new ATOM 0 HA GLN A 58 21.375 20.518 -1.999 1.00 1.46 H new ATOM 0 HB2 GLN A 58 22.957 22.713 -2.064 1.00 1.97 H new ATOM 0 HB3 GLN A 58 24.175 21.456 -2.151 1.00 1.97 H new ATOM 0 HG2 GLN A 58 23.718 21.096 -4.314 1.00 2.80 H new ATOM 0 HG3 GLN A 58 22.041 20.747 -3.941 1.00 2.80 H new ATOM 0 HE21 GLN A 58 24.344 23.434 -4.512 1.00 4.36 H new ATOM 0 HE22 GLN A 58 23.157 24.538 -5.216 1.00 4.36 H new ATOM 804 N LYS A 59 22.249 18.562 -0.609 1.00 1.17 N ATOM 805 CA LYS A 59 22.824 17.293 -0.177 1.00 1.13 C ATOM 806 C LYS A 59 22.063 16.179 -0.867 1.00 0.95 C ATOM 807 O LYS A 59 21.267 15.462 -0.268 1.00 0.88 O ATOM 808 CB LYS A 59 22.707 17.133 1.355 1.00 1.54 C ATOM 809 CG LYS A 59 24.034 16.872 2.055 1.00 1.90 C ATOM 810 CD LYS A 59 24.054 15.515 2.747 1.00 2.17 C ATOM 811 CE LYS A 59 25.478 15.058 3.027 1.00 2.82 C ATOM 812 NZ LYS A 59 25.528 13.649 3.508 1.00 3.55 N ATOM 0 H LYS A 59 21.232 18.613 -0.548 1.00 1.17 H new ATOM 0 HA LYS A 59 23.882 17.259 -0.438 1.00 1.13 H new ATOM 0 HB2 LYS A 59 22.260 18.036 1.771 1.00 1.54 H new ATOM 0 HB3 LYS A 59 22.025 16.311 1.573 1.00 1.54 H new ATOM 0 HG2 LYS A 59 24.844 16.920 1.327 1.00 1.90 H new ATOM 0 HG3 LYS A 59 24.218 17.657 2.789 1.00 1.90 H new ATOM 0 HD2 LYS A 59 23.498 15.573 3.683 1.00 2.17 H new ATOM 0 HD3 LYS A 59 23.550 14.778 2.122 1.00 2.17 H new ATOM 0 HE2 LYS A 59 26.074 15.152 2.119 1.00 2.82 H new ATOM 0 HE3 LYS A 59 25.928 15.712 3.774 1.00 2.82 H new ATOM 0 HZ1 LYS A 59 26.119 13.595 4.362 1.00 3.55 H new ATOM 0 HZ2 LYS A 59 24.566 13.324 3.731 1.00 3.55 H new ATOM 0 HZ3 LYS A 59 25.935 13.043 2.767 1.00 3.55 H new ATOM 826 N PRO A 60 22.303 16.049 -2.202 1.00 1.06 N ATOM 827 CA PRO A 60 21.635 15.050 -3.020 1.00 1.15 C ATOM 828 C PRO A 60 21.988 13.622 -2.646 1.00 1.10 C ATOM 829 O PRO A 60 22.741 12.934 -3.339 1.00 1.23 O ATOM 830 CB PRO A 60 22.092 15.351 -4.443 1.00 1.48 C ATOM 831 CG PRO A 60 23.370 16.095 -4.287 1.00 1.54 C ATOM 832 CD PRO A 60 23.221 16.885 -3.021 1.00 1.30 C ATOM 0 HA PRO A 60 20.555 15.111 -2.885 1.00 1.15 H new ATOM 0 HB2 PRO A 60 22.236 14.434 -5.014 1.00 1.48 H new ATOM 0 HB3 PRO A 60 21.352 15.946 -4.978 1.00 1.48 H new ATOM 0 HG2 PRO A 60 24.217 15.412 -4.226 1.00 1.54 H new ATOM 0 HG3 PRO A 60 23.550 16.750 -5.140 1.00 1.54 H new ATOM 0 HD2 PRO A 60 24.180 17.034 -2.525 1.00 1.30 H new ATOM 0 HD3 PRO A 60 22.803 17.874 -3.211 1.00 1.30 H new ATOM 840 N CYS A 61 21.369 13.175 -1.584 1.00 1.08 N ATOM 841 CA CYS A 61 21.506 11.812 -1.111 1.00 1.13 C ATOM 842 C CYS A 61 20.320 11.042 -1.694 1.00 1.36 C ATOM 843 O CYS A 61 19.590 11.599 -2.525 1.00 1.54 O ATOM 844 CB CYS A 61 21.587 11.760 0.439 1.00 1.30 C ATOM 845 SG CYS A 61 20.029 11.448 1.353 1.00 1.59 S ATOM 0 H CYS A 61 20.748 13.749 -1.014 1.00 1.08 H new ATOM 0 HA CYS A 61 22.437 11.352 -1.442 1.00 1.13 H new ATOM 0 HB2 CYS A 61 22.300 10.983 0.713 1.00 1.30 H new ATOM 0 HB3 CYS A 61 21.998 12.708 0.787 1.00 1.30 H new ATOM 850 N GLY A 62 20.115 9.789 -1.309 1.00 1.60 N ATOM 851 CA GLY A 62 18.985 9.074 -1.857 1.00 1.92 C ATOM 852 C GLY A 62 19.097 8.835 -3.348 1.00 2.10 C ATOM 853 O GLY A 62 20.166 8.951 -3.945 1.00 2.43 O ATOM 0 H GLY A 62 20.692 9.270 -0.648 1.00 1.60 H new ATOM 0 HA2 GLY A 62 18.888 8.115 -1.348 1.00 1.92 H new ATOM 0 HA3 GLY A 62 18.074 9.636 -1.653 1.00 1.92 H new ATOM 857 N SER A 63 17.975 8.447 -3.915 1.00 2.43 N ATOM 858 CA SER A 63 17.837 8.096 -5.350 1.00 2.98 C ATOM 859 C SER A 63 17.526 9.328 -6.175 1.00 2.74 C ATOM 860 O SER A 63 16.665 9.338 -7.055 1.00 3.32 O ATOM 861 CB SER A 63 16.725 7.059 -5.542 1.00 3.86 C ATOM 862 OG SER A 63 17.194 5.745 -5.292 1.00 4.11 O ATOM 0 H SER A 63 17.101 8.358 -3.396 1.00 2.43 H new ATOM 0 HA SER A 63 18.784 7.674 -5.686 1.00 2.98 H new ATOM 0 HB2 SER A 63 15.896 7.284 -4.872 1.00 3.86 H new ATOM 0 HB3 SER A 63 16.339 7.122 -6.559 1.00 3.86 H new ATOM 0 HG SER A 63 16.462 5.106 -5.421 1.00 4.11 H new ATOM 868 N GLY A 64 18.263 10.405 -5.811 1.00 2.15 N ATOM 869 CA GLY A 64 18.140 11.711 -6.400 1.00 2.11 C ATOM 870 C GLY A 64 17.637 12.822 -5.431 1.00 1.92 C ATOM 871 O GLY A 64 17.318 13.906 -5.930 1.00 2.21 O ATOM 0 H GLY A 64 18.971 10.362 -5.078 1.00 2.15 H new ATOM 0 HA2 GLY A 64 19.111 12.008 -6.797 1.00 2.11 H new ATOM 0 HA3 GLY A 64 17.455 11.649 -7.246 1.00 2.11 H new ATOM 875 N GLY A 65 17.557 12.615 -4.115 1.00 1.62 N ATOM 876 CA GLY A 65 17.051 13.700 -3.263 1.00 1.62 C ATOM 877 C GLY A 65 18.095 14.470 -2.459 1.00 1.43 C ATOM 878 O GLY A 65 18.877 13.878 -1.719 1.00 1.62 O ATOM 0 H GLY A 65 17.820 11.755 -3.633 1.00 1.62 H new ATOM 0 HA2 GLY A 65 16.514 14.408 -3.894 1.00 1.62 H new ATOM 0 HA3 GLY A 65 16.325 13.279 -2.567 1.00 1.62 H new ATOM 882 N ARG A 66 18.053 15.810 -2.562 1.00 1.17 N ATOM 883 CA ARG A 66 18.945 16.690 -1.792 1.00 1.03 C ATOM 884 C ARG A 66 18.264 17.058 -0.473 1.00 0.94 C ATOM 885 O ARG A 66 17.036 17.007 -0.387 1.00 1.04 O ATOM 886 CB ARG A 66 19.347 17.958 -2.573 1.00 1.10 C ATOM 887 CG ARG A 66 18.215 18.831 -3.156 1.00 1.26 C ATOM 888 CD ARG A 66 16.797 18.362 -2.830 1.00 1.41 C ATOM 889 NE ARG A 66 15.800 19.374 -3.196 1.00 1.78 N ATOM 890 CZ ARG A 66 14.822 19.181 -4.084 1.00 2.30 C ATOM 891 NH1 ARG A 66 14.684 18.010 -4.693 1.00 2.55 N ATOM 892 NH2 ARG A 66 13.977 20.166 -4.362 1.00 3.02 N ATOM 0 H ARG A 66 17.407 16.308 -3.175 1.00 1.17 H new ATOM 0 HA ARG A 66 19.870 16.147 -1.596 1.00 1.03 H new ATOM 0 HB2 ARG A 66 19.946 18.584 -1.911 1.00 1.10 H new ATOM 0 HB3 ARG A 66 19.994 17.654 -3.396 1.00 1.10 H new ATOM 0 HG2 ARG A 66 18.337 19.850 -2.788 1.00 1.26 H new ATOM 0 HG3 ARG A 66 18.328 18.868 -4.239 1.00 1.26 H new ATOM 0 HD2 ARG A 66 16.588 17.434 -3.362 1.00 1.41 H new ATOM 0 HD3 ARG A 66 16.721 18.143 -1.765 1.00 1.41 H new ATOM 0 HE ARG A 66 15.858 20.286 -2.742 1.00 1.78 H new ATOM 0 HH11 ARG A 66 15.328 17.247 -4.484 1.00 2.55 H new ATOM 0 HH12 ARG A 66 13.933 17.873 -5.370 1.00 2.55 H new ATOM 0 HH21 ARG A 66 14.075 21.069 -3.897 1.00 3.02 H new ATOM 0 HH22 ARG A 66 13.229 20.020 -5.040 1.00 3.02 H new ATOM 906 N CYS A 67 19.038 17.403 0.564 1.00 0.87 N ATOM 907 CA CYS A 67 18.460 17.737 1.839 1.00 0.87 C ATOM 908 C CYS A 67 17.625 18.992 1.724 1.00 0.88 C ATOM 909 O CYS A 67 18.145 20.099 1.599 1.00 0.93 O ATOM 910 CB CYS A 67 19.553 17.894 2.900 1.00 0.93 C ATOM 911 SG CYS A 67 20.331 16.317 3.388 1.00 1.52 S ATOM 0 H CYS A 67 20.056 17.453 0.530 1.00 0.87 H new ATOM 0 HA CYS A 67 17.806 16.923 2.152 1.00 0.87 H new ATOM 0 HB2 CYS A 67 20.322 18.567 2.520 1.00 0.93 H new ATOM 0 HB3 CYS A 67 19.124 18.367 3.784 1.00 0.93 H new ATOM 916 N ALA A 68 16.327 18.806 1.798 1.00 0.91 N ATOM 917 CA ALA A 68 15.385 19.916 1.731 1.00 0.98 C ATOM 918 C ALA A 68 15.027 20.372 3.137 1.00 0.98 C ATOM 919 O ALA A 68 14.457 21.443 3.343 1.00 1.07 O ATOM 920 CB ALA A 68 14.130 19.513 0.976 1.00 0.98 C ATOM 0 H ALA A 68 15.890 17.891 1.906 1.00 0.91 H new ATOM 0 HA ALA A 68 15.856 20.740 1.195 1.00 0.98 H new ATOM 0 HB1 ALA A 68 13.441 20.357 0.938 1.00 0.98 H new ATOM 0 HB2 ALA A 68 14.395 19.216 -0.039 1.00 0.98 H new ATOM 0 HB3 ALA A 68 13.652 18.677 1.486 1.00 0.98 H new ATOM 926 N ALA A 69 15.427 19.554 4.096 1.00 0.92 N ATOM 927 CA ALA A 69 15.197 19.821 5.508 1.00 0.96 C ATOM 928 C ALA A 69 16.067 18.897 6.367 1.00 0.92 C ATOM 929 O ALA A 69 16.579 17.887 5.886 1.00 0.87 O ATOM 930 CB ALA A 69 13.729 19.631 5.831 1.00 1.00 C ATOM 0 H ALA A 69 15.923 18.681 3.917 1.00 0.92 H new ATOM 0 HA ALA A 69 15.472 20.852 5.730 1.00 0.96 H new ATOM 0 HB1 ALA A 69 13.560 19.832 6.889 1.00 1.00 H new ATOM 0 HB2 ALA A 69 13.133 20.319 5.232 1.00 1.00 H new ATOM 0 HB3 ALA A 69 13.437 18.606 5.605 1.00 1.00 H new ATOM 936 N ALA A 70 16.256 19.268 7.626 1.00 0.98 N ATOM 937 CA ALA A 70 17.093 18.501 8.548 1.00 1.00 C ATOM 938 C ALA A 70 16.641 17.043 8.731 1.00 1.04 C ATOM 939 O ALA A 70 15.546 16.777 9.228 1.00 1.24 O ATOM 940 CB ALA A 70 17.156 19.201 9.897 1.00 1.15 C ATOM 0 H ALA A 70 15.838 20.102 8.038 1.00 0.98 H new ATOM 0 HA ALA A 70 18.084 18.457 8.097 1.00 1.00 H new ATOM 0 HB1 ALA A 70 17.781 18.623 10.578 1.00 1.15 H new ATOM 0 HB2 ALA A 70 17.581 20.197 9.771 1.00 1.15 H new ATOM 0 HB3 ALA A 70 16.151 19.285 10.311 1.00 1.15 H new ATOM 946 N GLY A 71 17.522 16.109 8.333 1.00 1.15 N ATOM 947 CA GLY A 71 17.258 14.675 8.457 1.00 1.27 C ATOM 948 C GLY A 71 16.079 14.234 7.619 1.00 1.21 C ATOM 949 O GLY A 71 15.392 13.268 7.945 1.00 1.28 O ATOM 0 H GLY A 71 18.428 16.330 7.920 1.00 1.15 H new ATOM 0 HA2 GLY A 71 18.144 14.117 8.155 1.00 1.27 H new ATOM 0 HA3 GLY A 71 17.069 14.432 9.503 1.00 1.27 H new ATOM 953 N ILE A 72 15.946 14.863 6.473 1.00 1.12 N ATOM 954 CA ILE A 72 14.927 14.496 5.503 1.00 1.08 C ATOM 955 C ILE A 72 15.403 14.813 4.078 1.00 1.03 C ATOM 956 O ILE A 72 15.399 15.976 3.624 1.00 1.36 O ATOM 957 CB ILE A 72 13.571 15.119 5.850 1.00 1.52 C ATOM 958 CG1 ILE A 72 13.609 16.617 5.712 1.00 1.09 C ATOM 959 CG2 ILE A 72 13.137 14.710 7.250 1.00 2.27 C ATOM 960 CD1 ILE A 72 12.898 17.000 4.472 1.00 0.92 C ATOM 0 H ILE A 72 16.537 15.642 6.183 1.00 1.12 H new ATOM 0 HA ILE A 72 14.770 13.418 5.546 1.00 1.08 H new ATOM 0 HB ILE A 72 12.834 14.742 5.141 1.00 1.52 H new ATOM 0 HG12 ILE A 72 13.140 17.088 6.576 1.00 1.09 H new ATOM 0 HG13 ILE A 72 14.641 16.967 5.679 1.00 1.09 H new ATOM 0 HG21 ILE A 72 12.172 15.162 7.478 1.00 2.27 H new ATOM 0 HG22 ILE A 72 13.051 13.625 7.302 1.00 2.27 H new ATOM 0 HG23 ILE A 72 13.877 15.050 7.974 1.00 2.27 H new ATOM 0 HD11 ILE A 72 12.919 18.084 4.361 1.00 0.92 H new ATOM 0 HD12 ILE A 72 13.387 16.538 3.615 1.00 0.92 H new ATOM 0 HD13 ILE A 72 11.864 16.661 4.526 1.00 0.92 H new ATOM 972 N CYS A 73 15.850 13.763 3.395 1.00 0.82 N ATOM 973 CA CYS A 73 16.379 13.869 2.039 1.00 1.07 C ATOM 974 C CYS A 73 15.256 13.802 1.019 1.00 1.08 C ATOM 975 O CYS A 73 14.857 12.721 0.593 1.00 1.21 O ATOM 976 CB CYS A 73 17.351 12.717 1.790 1.00 1.19 C ATOM 977 SG CYS A 73 19.027 13.210 1.287 1.00 1.98 S ATOM 0 H CYS A 73 15.856 12.813 3.767 1.00 0.82 H new ATOM 0 HA CYS A 73 16.891 14.826 1.935 1.00 1.07 H new ATOM 0 HB2 CYS A 73 17.423 12.121 2.700 1.00 1.19 H new ATOM 0 HB3 CYS A 73 16.933 12.071 1.018 1.00 1.19 H new ATOM 982 N CYS A 74 14.738 14.959 0.642 1.00 0.98 N ATOM 983 CA CYS A 74 13.642 15.017 -0.311 1.00 0.99 C ATOM 984 C CYS A 74 14.120 15.284 -1.736 1.00 1.15 C ATOM 985 O CYS A 74 15.168 15.891 -1.965 1.00 1.33 O ATOM 986 CB CYS A 74 12.637 16.084 0.120 1.00 1.13 C ATOM 987 SG CYS A 74 11.818 15.719 1.708 1.00 1.32 S ATOM 0 H CYS A 74 15.057 15.867 0.979 1.00 0.98 H new ATOM 0 HA CYS A 74 13.161 14.039 -0.316 1.00 0.99 H new ATOM 0 HB2 CYS A 74 13.149 17.043 0.197 1.00 1.13 H new ATOM 0 HB3 CYS A 74 11.878 16.190 -0.655 1.00 1.13 H new ATOM 992 N SER A 75 13.315 14.818 -2.684 1.00 1.14 N ATOM 993 CA SER A 75 13.585 14.976 -4.107 1.00 1.36 C ATOM 994 C SER A 75 12.334 15.531 -4.787 1.00 1.28 C ATOM 995 O SER A 75 11.334 15.783 -4.116 1.00 1.10 O ATOM 996 CB SER A 75 13.978 13.632 -4.727 1.00 1.46 C ATOM 997 OG SER A 75 13.013 12.635 -4.437 1.00 1.99 O ATOM 0 H SER A 75 12.450 14.316 -2.484 1.00 1.14 H new ATOM 0 HA SER A 75 14.415 15.668 -4.248 1.00 1.36 H new ATOM 0 HB2 SER A 75 14.079 13.742 -5.807 1.00 1.46 H new ATOM 0 HB3 SER A 75 14.951 13.323 -4.346 1.00 1.46 H new ATOM 0 HG SER A 75 13.286 11.787 -4.845 1.00 1.99 H new ATOM 1003 N PRO A 76 12.348 15.739 -6.118 1.00 1.46 N ATOM 1004 CA PRO A 76 11.180 16.272 -6.816 1.00 1.42 C ATOM 1005 C PRO A 76 10.117 15.201 -7.039 1.00 1.18 C ATOM 1006 O PRO A 76 9.319 15.283 -7.974 1.00 1.22 O ATOM 1007 CB PRO A 76 11.757 16.748 -8.148 1.00 1.74 C ATOM 1008 CG PRO A 76 12.920 15.849 -8.395 1.00 1.86 C ATOM 1009 CD PRO A 76 13.477 15.488 -7.040 1.00 1.77 C ATOM 0 HA PRO A 76 10.679 17.059 -6.253 1.00 1.42 H new ATOM 0 HB2 PRO A 76 11.021 16.673 -8.948 1.00 1.74 H new ATOM 0 HB3 PRO A 76 12.067 17.792 -8.096 1.00 1.74 H new ATOM 0 HG2 PRO A 76 12.611 14.956 -8.938 1.00 1.86 H new ATOM 0 HG3 PRO A 76 13.674 16.348 -9.004 1.00 1.86 H new ATOM 0 HD2 PRO A 76 13.799 14.447 -7.004 1.00 1.77 H new ATOM 0 HD3 PRO A 76 14.344 16.099 -6.788 1.00 1.77 H new ATOM 1017 N ASP A 77 10.110 14.198 -6.159 1.00 0.99 N ATOM 1018 CA ASP A 77 9.142 13.110 -6.239 1.00 0.91 C ATOM 1019 C ASP A 77 8.749 12.606 -4.844 1.00 0.82 C ATOM 1020 O ASP A 77 7.581 12.303 -4.598 1.00 0.90 O ATOM 1021 CB ASP A 77 9.696 11.959 -7.083 1.00 1.16 C ATOM 1022 CG ASP A 77 11.038 11.465 -6.582 1.00 1.92 C ATOM 1023 OD1 ASP A 77 11.053 10.630 -5.654 1.00 2.65 O ATOM 1024 OD2 ASP A 77 12.073 11.911 -7.120 1.00 2.50 O ATOM 0 H ASP A 77 10.766 14.119 -5.382 1.00 0.99 H new ATOM 0 HA ASP A 77 8.245 13.500 -6.720 1.00 0.91 H new ATOM 0 HB2 ASP A 77 8.984 11.134 -7.078 1.00 1.16 H new ATOM 0 HB3 ASP A 77 9.797 12.287 -8.118 1.00 1.16 H new ATOM 1029 N GLY A 78 9.727 12.511 -3.934 1.00 0.88 N ATOM 1030 CA GLY A 78 9.441 12.033 -2.582 1.00 0.87 C ATOM 1031 C GLY A 78 10.466 12.488 -1.542 1.00 0.86 C ATOM 1032 O GLY A 78 11.132 13.506 -1.726 1.00 0.99 O ATOM 0 H GLY A 78 10.702 12.754 -4.107 1.00 0.88 H new ATOM 0 HA2 GLY A 78 8.453 12.383 -2.283 1.00 0.87 H new ATOM 0 HA3 GLY A 78 9.404 10.944 -2.591 1.00 0.87 H new ATOM 1036 N CYS A 79 10.589 11.719 -0.447 1.00 0.79 N ATOM 1037 CA CYS A 79 11.537 12.033 0.636 1.00 0.80 C ATOM 1038 C CYS A 79 12.182 10.747 1.172 1.00 0.78 C ATOM 1039 O CYS A 79 11.625 9.659 1.027 1.00 0.89 O ATOM 1040 CB CYS A 79 10.850 12.824 1.743 1.00 0.94 C ATOM 1041 SG CYS A 79 10.287 14.477 1.210 1.00 1.34 S ATOM 0 H CYS A 79 10.042 10.873 -0.288 1.00 0.79 H new ATOM 0 HA CYS A 79 12.333 12.661 0.234 1.00 0.80 H new ATOM 0 HB2 CYS A 79 9.994 12.257 2.107 1.00 0.94 H new ATOM 0 HB3 CYS A 79 11.538 12.935 2.581 1.00 0.94 H new ATOM 1046 N HIS A 80 13.427 10.863 1.656 1.00 0.71 N ATOM 1047 CA HIS A 80 14.197 9.688 2.076 1.00 0.76 C ATOM 1048 C HIS A 80 14.988 10.023 3.338 1.00 0.70 C ATOM 1049 O HIS A 80 15.713 11.017 3.377 1.00 0.67 O ATOM 1050 CB HIS A 80 15.136 9.222 0.974 1.00 0.87 C ATOM 1051 CG HIS A 80 15.804 7.921 1.285 1.00 0.99 C ATOM 1052 ND1 HIS A 80 15.114 6.738 1.450 1.00 1.64 N ATOM 1053 CD2 HIS A 80 17.110 7.619 1.465 1.00 1.76 C ATOM 1054 CE1 HIS A 80 15.968 5.766 1.718 1.00 2.09 C ATOM 1055 NE2 HIS A 80 17.185 6.275 1.732 1.00 2.17 N ATOM 0 H HIS A 80 13.917 11.751 1.765 1.00 0.71 H new ATOM 0 HA HIS A 80 13.502 8.875 2.286 1.00 0.76 H new ATOM 0 HB2 HIS A 80 14.575 9.123 0.045 1.00 0.87 H new ATOM 0 HB3 HIS A 80 15.897 9.984 0.807 1.00 0.87 H new ATOM 0 HD1 HIS A 80 14.102 6.630 1.377 1.00 1.64 H new ATOM 0 HD2 HIS A 80 17.940 8.308 1.409 1.00 1.76 H new ATOM 0 HE1 HIS A 80 15.713 4.732 1.895 1.00 2.09 H new ATOM 1064 N GLU A 81 14.822 9.204 4.381 1.00 0.75 N ATOM 1065 CA GLU A 81 15.495 9.438 5.663 1.00 0.77 C ATOM 1066 C GLU A 81 17.001 9.601 5.489 1.00 0.72 C ATOM 1067 O GLU A 81 17.658 8.799 4.826 1.00 0.92 O ATOM 1068 CB GLU A 81 15.201 8.291 6.634 1.00 0.94 C ATOM 1069 CG GLU A 81 13.956 8.514 7.481 1.00 1.70 C ATOM 1070 CD GLU A 81 13.686 7.370 8.438 1.00 2.35 C ATOM 1071 OE1 GLU A 81 14.352 7.307 9.493 1.00 2.71 O ATOM 1072 OE2 GLU A 81 12.807 6.536 8.134 1.00 3.05 O ATOM 0 H GLU A 81 14.229 8.375 4.363 1.00 0.75 H new ATOM 0 HA GLU A 81 15.104 10.369 6.074 1.00 0.77 H new ATOM 0 HB2 GLU A 81 15.084 7.367 6.067 1.00 0.94 H new ATOM 0 HB3 GLU A 81 16.059 8.155 7.293 1.00 0.94 H new ATOM 0 HG2 GLU A 81 14.068 9.438 8.048 1.00 1.70 H new ATOM 0 HG3 GLU A 81 13.095 8.645 6.826 1.00 1.70 H new ATOM 1079 N ASP A 82 17.532 10.665 6.083 1.00 0.76 N ATOM 1080 CA ASP A 82 18.950 10.965 5.990 1.00 0.77 C ATOM 1081 C ASP A 82 19.473 11.517 7.337 1.00 0.96 C ATOM 1082 O ASP A 82 18.999 12.550 7.809 1.00 1.21 O ATOM 1083 CB ASP A 82 19.168 11.933 4.795 1.00 0.86 C ATOM 1084 CG ASP A 82 19.208 13.414 5.163 1.00 1.34 C ATOM 1085 OD1 ASP A 82 18.130 14.042 5.222 1.00 1.82 O ATOM 1086 OD2 ASP A 82 20.320 13.940 5.388 1.00 2.02 O ATOM 0 H ASP A 82 16.996 11.334 6.635 1.00 0.76 H new ATOM 0 HA ASP A 82 19.531 10.063 5.797 1.00 0.77 H new ATOM 0 HB2 ASP A 82 20.104 11.671 4.301 1.00 0.86 H new ATOM 0 HB3 ASP A 82 18.370 11.776 4.069 1.00 0.86 H new ATOM 1091 N PRO A 83 20.436 10.823 7.989 1.00 1.15 N ATOM 1092 CA PRO A 83 20.979 11.242 9.287 1.00 1.42 C ATOM 1093 C PRO A 83 22.059 12.317 9.182 1.00 1.28 C ATOM 1094 O PRO A 83 22.365 12.993 10.165 1.00 1.40 O ATOM 1095 CB PRO A 83 21.585 9.952 9.864 1.00 1.81 C ATOM 1096 CG PRO A 83 21.329 8.875 8.854 1.00 1.93 C ATOM 1097 CD PRO A 83 21.054 9.566 7.549 1.00 1.42 C ATOM 0 HA PRO A 83 20.199 11.690 9.903 1.00 1.42 H new ATOM 0 HB2 PRO A 83 22.654 10.071 10.042 1.00 1.81 H new ATOM 0 HB3 PRO A 83 21.128 9.703 10.822 1.00 1.81 H new ATOM 0 HG2 PRO A 83 22.190 8.213 8.768 1.00 1.93 H new ATOM 0 HG3 PRO A 83 20.481 8.258 9.152 1.00 1.93 H new ATOM 0 HD2 PRO A 83 21.967 9.739 6.979 1.00 1.42 H new ATOM 0 HD3 PRO A 83 20.386 8.985 6.913 1.00 1.42 H new ATOM 1105 N ALA A 84 22.647 12.465 8.002 1.00 1.13 N ATOM 1106 CA ALA A 84 23.702 13.452 7.799 1.00 1.17 C ATOM 1107 C ALA A 84 23.189 14.877 7.996 1.00 1.20 C ATOM 1108 O ALA A 84 23.878 15.722 8.567 1.00 1.53 O ATOM 1109 CB ALA A 84 24.307 13.294 6.411 1.00 1.21 C ATOM 0 H ALA A 84 22.413 11.917 7.174 1.00 1.13 H new ATOM 0 HA ALA A 84 24.473 13.274 8.549 1.00 1.17 H new ATOM 0 HB1 ALA A 84 25.093 14.036 6.270 1.00 1.21 H new ATOM 0 HB2 ALA A 84 24.729 12.294 6.310 1.00 1.21 H new ATOM 0 HB3 ALA A 84 23.533 13.439 5.658 1.00 1.21 H new ATOM 1115 N CYS A 85 21.978 15.141 7.515 1.00 1.02 N ATOM 1116 CA CYS A 85 21.376 16.471 7.634 1.00 1.19 C ATOM 1117 C CYS A 85 20.381 16.539 8.782 1.00 1.46 C ATOM 1118 O CYS A 85 19.591 17.474 8.853 1.00 1.88 O ATOM 1119 CB CYS A 85 20.637 16.847 6.348 1.00 1.15 C ATOM 1120 SG CYS A 85 21.656 16.833 4.840 1.00 1.42 S ATOM 0 H CYS A 85 21.392 14.455 7.039 1.00 1.02 H new ATOM 0 HA CYS A 85 22.194 17.167 7.822 1.00 1.19 H new ATOM 0 HB2 CYS A 85 19.804 16.158 6.211 1.00 1.15 H new ATOM 0 HB3 CYS A 85 20.210 17.843 6.470 1.00 1.15 H new ATOM 1125 N ASP A 86 20.411 15.557 9.667 1.00 1.53 N ATOM 1126 CA ASP A 86 19.466 15.516 10.779 1.00 1.90 C ATOM 1127 C ASP A 86 19.695 16.668 11.745 1.00 1.82 C ATOM 1128 O ASP A 86 18.773 17.425 12.047 1.00 2.29 O ATOM 1129 CB ASP A 86 19.586 14.186 11.525 1.00 2.43 C ATOM 1130 CG ASP A 86 18.237 13.620 11.923 1.00 3.07 C ATOM 1131 OD1 ASP A 86 17.626 14.151 12.874 1.00 3.60 O ATOM 1132 OD2 ASP A 86 17.792 12.643 11.283 1.00 3.47 O ATOM 0 H ASP A 86 21.073 14.781 9.641 1.00 1.53 H new ATOM 0 HA ASP A 86 18.462 15.612 10.365 1.00 1.90 H new ATOM 0 HB2 ASP A 86 20.107 13.465 10.895 1.00 2.43 H new ATOM 0 HB3 ASP A 86 20.195 14.328 12.418 1.00 2.43 H new ATOM 1137 N PRO A 87 20.914 16.812 12.270 1.00 1.72 N ATOM 1138 CA PRO A 87 21.235 17.850 13.214 1.00 2.05 C ATOM 1139 C PRO A 87 22.032 18.996 12.620 1.00 2.20 C ATOM 1140 O PRO A 87 22.201 19.126 11.409 1.00 2.35 O ATOM 1141 CB PRO A 87 22.143 17.075 14.190 1.00 2.46 C ATOM 1142 CG PRO A 87 22.796 15.992 13.368 1.00 2.56 C ATOM 1143 CD PRO A 87 22.091 15.959 12.033 1.00 1.96 C ATOM 0 HA PRO A 87 20.343 18.319 13.629 1.00 2.05 H new ATOM 0 HB2 PRO A 87 22.890 17.732 14.636 1.00 2.46 H new ATOM 0 HB3 PRO A 87 21.564 16.649 15.009 1.00 2.46 H new ATOM 0 HG2 PRO A 87 23.859 16.196 13.237 1.00 2.56 H new ATOM 0 HG3 PRO A 87 22.716 15.027 13.869 1.00 2.56 H new ATOM 0 HD2 PRO A 87 22.720 16.349 11.233 1.00 1.96 H new ATOM 0 HD3 PRO A 87 21.807 14.946 11.750 1.00 1.96 H new ATOM 1151 N GLU A 88 22.455 19.809 13.563 1.00 2.56 N ATOM 1152 CA GLU A 88 23.260 21.005 13.370 1.00 3.21 C ATOM 1153 C GLU A 88 24.588 20.699 12.627 1.00 3.51 C ATOM 1154 O GLU A 88 25.522 21.500 12.667 1.00 4.11 O ATOM 1155 CB GLU A 88 23.584 21.654 14.714 1.00 3.64 C ATOM 1156 CG GLU A 88 24.257 20.708 15.692 1.00 3.54 C ATOM 1157 CD GLU A 88 24.020 21.100 17.135 1.00 4.21 C ATOM 1158 OE1 GLU A 88 22.950 20.753 17.676 1.00 4.58 O ATOM 1159 OE2 GLU A 88 24.905 21.756 17.725 1.00 4.72 O ATOM 0 H GLU A 88 22.235 19.647 14.546 1.00 2.56 H new ATOM 0 HA GLU A 88 22.670 21.687 12.757 1.00 3.21 H new ATOM 0 HB2 GLU A 88 24.232 22.514 14.547 1.00 3.64 H new ATOM 0 HB3 GLU A 88 22.663 22.030 15.159 1.00 3.64 H new ATOM 0 HG2 GLU A 88 23.885 19.696 15.528 1.00 3.54 H new ATOM 0 HG3 GLU A 88 25.329 20.690 15.495 1.00 3.54 H new ATOM 1166 N ALA A 89 24.586 19.641 11.814 1.00 3.29 N ATOM 1167 CA ALA A 89 25.692 19.351 10.922 1.00 3.88 C ATOM 1168 C ALA A 89 25.562 20.263 9.683 1.00 4.78 C ATOM 1169 O ALA A 89 26.251 20.080 8.679 1.00 5.29 O ATOM 1170 CB ALA A 89 25.684 17.881 10.506 1.00 3.48 C ATOM 0 H ALA A 89 23.820 18.970 11.761 1.00 3.29 H new ATOM 0 HA ALA A 89 26.637 19.541 11.432 1.00 3.88 H new ATOM 0 HB1 ALA A 89 26.523 17.688 9.837 1.00 3.48 H new ATOM 0 HB2 ALA A 89 25.773 17.252 11.392 1.00 3.48 H new ATOM 0 HB3 ALA A 89 24.750 17.653 9.992 1.00 3.48 H new ATOM 1176 N ALA A 90 24.688 21.280 9.808 1.00 5.12 N ATOM 1177 CA ALA A 90 24.476 22.264 8.780 1.00 6.15 C ATOM 1178 C ALA A 90 25.629 23.295 8.735 1.00 6.94 C ATOM 1179 O ALA A 90 26.118 23.773 9.757 1.00 6.98 O ATOM 1180 CB ALA A 90 23.136 22.958 9.012 1.00 6.47 C ATOM 0 H ALA A 90 24.115 21.425 10.639 1.00 5.12 H new ATOM 0 HA ALA A 90 24.459 21.760 7.814 1.00 6.15 H new ATOM 0 HB1 ALA A 90 22.973 23.704 8.234 1.00 6.47 H new ATOM 0 HB2 ALA A 90 22.334 22.220 8.981 1.00 6.47 H new ATOM 0 HB3 ALA A 90 23.143 23.446 9.987 1.00 6.47 H new ATOM 1186 N PHE A 91 25.969 23.658 7.496 1.00 7.67 N ATOM 1187 CA PHE A 91 26.981 24.664 7.213 1.00 8.56 C ATOM 1188 C PHE A 91 26.318 26.002 6.876 1.00 9.41 C ATOM 1189 O PHE A 91 25.834 26.197 5.761 1.00 9.96 O ATOM 1190 CB PHE A 91 27.854 24.218 6.041 1.00 9.02 C ATOM 1191 CG PHE A 91 29.084 25.058 5.861 1.00 9.29 C ATOM 1192 CD1 PHE A 91 30.129 24.973 6.764 1.00 9.45 C ATOM 1193 CD2 PHE A 91 29.193 25.933 4.792 1.00 9.65 C ATOM 1194 CE1 PHE A 91 31.263 25.745 6.605 1.00 9.92 C ATOM 1195 CE2 PHE A 91 30.325 26.708 4.627 1.00 10.10 C ATOM 1196 CZ PHE A 91 31.362 26.613 5.535 1.00 10.21 C ATOM 0 H PHE A 91 25.544 23.257 6.660 1.00 7.67 H new ATOM 0 HA PHE A 91 27.604 24.786 8.099 1.00 8.56 H new ATOM 0 HB2 PHE A 91 28.151 23.180 6.193 1.00 9.02 H new ATOM 0 HB3 PHE A 91 27.264 24.250 5.125 1.00 9.02 H new ATOM 0 HD1 PHE A 91 30.057 24.296 7.602 1.00 9.45 H new ATOM 0 HD2 PHE A 91 28.384 26.010 4.080 1.00 9.65 H new ATOM 0 HE1 PHE A 91 32.072 25.670 7.317 1.00 9.92 H new ATOM 0 HE2 PHE A 91 30.399 27.387 3.790 1.00 10.10 H new ATOM 0 HZ PHE A 91 32.249 27.216 5.408 1.00 10.21 H new ATOM 1206 N SER A 92 26.293 26.920 7.837 1.00 9.61 N ATOM 1207 CA SER A 92 25.686 28.231 7.620 1.00 10.49 C ATOM 1208 C SER A 92 26.323 29.282 8.521 1.00 11.25 C ATOM 1209 O SER A 92 26.446 29.025 9.737 1.00 11.48 O ATOM 1210 CB SER A 92 24.179 28.170 7.878 1.00 10.50 C ATOM 1211 OG SER A 92 23.574 27.126 7.135 1.00 10.56 O ATOM 1212 OXT SER A 92 26.696 30.356 8.003 1.00 11.77 O ATOM 0 H SER A 92 26.683 26.783 8.769 1.00 9.61 H new ATOM 0 HA SER A 92 25.859 28.514 6.582 1.00 10.49 H new ATOM 0 HB2 SER A 92 23.995 28.017 8.941 1.00 10.50 H new ATOM 0 HB3 SER A 92 23.723 29.123 7.610 1.00 10.50 H new ATOM 0 HG SER A 92 22.612 27.108 7.319 1.00 10.56 H new TER 1218 SER A 92 ATOM 1219 N ALA B 101 -14.192 6.451 13.611 1.00 10.07 N ATOM 1220 CA ALA B 101 -14.570 6.226 15.029 1.00 9.47 C ATOM 1221 C ALA B 101 -13.979 4.921 15.540 1.00 8.40 C ATOM 1222 O ALA B 101 -14.535 4.294 16.444 1.00 8.14 O ATOM 1223 CB ALA B 101 -16.086 6.205 15.170 1.00 9.68 C ATOM 0 HA ALA B 101 -14.170 7.044 15.627 1.00 9.47 H new ATOM 0 HB1 ALA B 101 -16.352 6.039 16.214 1.00 9.68 H new ATOM 0 HB2 ALA B 101 -16.496 7.159 14.838 1.00 9.68 H new ATOM 0 HB3 ALA B 101 -16.497 5.402 14.559 1.00 9.68 H new ATOM 1231 N VAL B 102 -12.848 4.509 14.953 1.00 8.03 N ATOM 1232 CA VAL B 102 -12.192 3.250 15.371 1.00 7.24 C ATOM 1233 C VAL B 102 -11.009 2.862 14.473 1.00 6.03 C ATOM 1234 O VAL B 102 -10.690 3.546 13.499 1.00 5.94 O ATOM 1235 CB VAL B 102 -13.182 2.024 15.443 1.00 7.66 C ATOM 1236 CG1 VAL B 102 -13.610 1.755 16.879 1.00 7.91 C ATOM 1237 CG2 VAL B 102 -14.406 2.185 14.543 1.00 8.41 C ATOM 0 H VAL B 102 -12.372 5.011 14.204 1.00 8.03 H new ATOM 0 HA VAL B 102 -11.826 3.469 16.374 1.00 7.24 H new ATOM 0 HB VAL B 102 -12.628 1.164 15.067 1.00 7.66 H new ATOM 0 HG11 VAL B 102 -14.292 0.905 16.902 1.00 7.91 H new ATOM 0 HG12 VAL B 102 -12.732 1.532 17.485 1.00 7.91 H new ATOM 0 HG13 VAL B 102 -14.113 2.635 17.280 1.00 7.91 H new ATOM 0 HG21 VAL B 102 -15.046 1.308 14.639 1.00 8.41 H new ATOM 0 HG22 VAL B 102 -14.962 3.074 14.840 1.00 8.41 H new ATOM 0 HG23 VAL B 102 -14.085 2.288 13.507 1.00 8.41 H new ATOM 1247 N LEU B 103 -10.452 1.703 14.775 1.00 5.40 N ATOM 1248 CA LEU B 103 -9.389 1.069 14.007 1.00 4.42 C ATOM 1249 C LEU B 103 -10.023 -0.088 13.294 1.00 4.14 C ATOM 1250 O LEU B 103 -10.434 -1.061 13.929 1.00 4.51 O ATOM 1251 CB LEU B 103 -8.259 0.563 14.881 1.00 4.44 C ATOM 1252 CG LEU B 103 -7.032 0.156 14.077 1.00 5.04 C ATOM 1253 CD1 LEU B 103 -6.379 1.376 13.452 1.00 5.09 C ATOM 1254 CD2 LEU B 103 -6.048 -0.589 14.943 1.00 5.87 C ATOM 0 H LEU B 103 -10.735 1.157 15.589 1.00 5.40 H new ATOM 0 HA LEU B 103 -8.948 1.796 13.325 1.00 4.42 H new ATOM 0 HB2 LEU B 103 -7.980 1.339 15.593 1.00 4.44 H new ATOM 0 HB3 LEU B 103 -8.608 -0.291 15.461 1.00 4.44 H new ATOM 0 HG LEU B 103 -7.352 -0.512 13.277 1.00 5.04 H new ATOM 0 HD11 LEU B 103 -5.503 1.068 12.881 1.00 5.09 H new ATOM 0 HD12 LEU B 103 -7.090 1.869 12.789 1.00 5.09 H new ATOM 0 HD13 LEU B 103 -6.075 2.068 14.237 1.00 5.09 H new ATOM 0 HD21 LEU B 103 -5.179 -0.870 14.348 1.00 5.87 H new ATOM 0 HD22 LEU B 103 -5.732 0.050 15.767 1.00 5.87 H new ATOM 0 HD23 LEU B 103 -6.521 -1.487 15.341 1.00 5.87 H new ATOM 1266 N ASP B 104 -10.048 -0.021 11.974 1.00 4.04 N ATOM 1267 CA ASP B 104 -10.582 -1.115 11.214 1.00 4.36 C ATOM 1268 C ASP B 104 -9.425 -2.059 10.944 1.00 4.07 C ATOM 1269 O ASP B 104 -8.964 -2.123 9.797 1.00 4.12 O ATOM 1270 CB ASP B 104 -11.201 -0.587 9.908 1.00 5.06 C ATOM 1271 CG ASP B 104 -12.493 -1.287 9.540 1.00 5.80 C ATOM 1272 OD1 ASP B 104 -13.541 -0.952 10.133 1.00 6.19 O ATOM 1273 OD2 ASP B 104 -12.460 -2.166 8.653 1.00 6.27 O ATOM 0 H ASP B 104 -9.709 0.768 11.423 1.00 4.04 H new ATOM 0 HA ASP B 104 -11.373 -1.637 11.751 1.00 4.36 H new ATOM 0 HB2 ASP B 104 -11.389 0.482 10.008 1.00 5.06 H new ATOM 0 HB3 ASP B 104 -10.484 -0.710 9.097 1.00 5.06 H new ATOM 1278 N LEU B 105 -8.884 -2.752 11.964 1.00 4.35 N ATOM 1279 CA LEU B 105 -7.720 -3.590 11.673 1.00 4.75 C ATOM 1280 C LEU B 105 -7.836 -4.864 12.397 1.00 5.41 C ATOM 1281 O LEU B 105 -8.324 -5.871 11.880 1.00 6.19 O ATOM 1282 CB LEU B 105 -6.374 -2.876 11.957 1.00 5.45 C ATOM 1283 CG LEU B 105 -5.099 -3.755 11.824 1.00 6.23 C ATOM 1284 CD1 LEU B 105 -4.759 -4.439 13.138 1.00 5.95 C ATOM 1285 CD2 LEU B 105 -5.226 -4.794 10.706 1.00 7.20 C ATOM 0 H LEU B 105 -9.210 -2.750 12.931 1.00 4.35 H new ATOM 0 HA LEU B 105 -7.713 -3.794 10.602 1.00 4.75 H new ATOM 0 HB2 LEU B 105 -6.282 -2.031 11.275 1.00 5.45 H new ATOM 0 HB3 LEU B 105 -6.407 -2.468 12.967 1.00 5.45 H new ATOM 0 HG LEU B 105 -4.285 -3.080 11.560 1.00 6.23 H new ATOM 0 HD11 LEU B 105 -3.863 -5.046 13.011 1.00 5.95 H new ATOM 0 HD12 LEU B 105 -4.581 -3.685 13.905 1.00 5.95 H new ATOM 0 HD13 LEU B 105 -5.589 -5.077 13.442 1.00 5.95 H new ATOM 0 HD21 LEU B 105 -4.311 -5.384 10.652 1.00 7.20 H new ATOM 0 HD22 LEU B 105 -6.070 -5.452 10.915 1.00 7.20 H new ATOM 0 HD23 LEU B 105 -5.388 -4.287 9.755 1.00 7.20 H new ATOM 1297 N ASP B 106 -7.466 -4.752 13.643 1.00 5.41 N ATOM 1298 CA ASP B 106 -7.538 -5.797 14.690 1.00 6.32 C ATOM 1299 C ASP B 106 -6.416 -5.559 15.698 1.00 6.19 C ATOM 1300 O ASP B 106 -5.734 -6.484 16.140 1.00 6.37 O ATOM 1301 CB ASP B 106 -7.483 -7.186 14.091 1.00 7.13 C ATOM 1302 CG ASP B 106 -8.521 -8.114 14.696 1.00 8.06 C ATOM 1303 OD1 ASP B 106 -9.729 -7.826 14.557 1.00 8.48 O ATOM 1304 OD2 ASP B 106 -8.127 -9.126 15.315 1.00 8.55 O ATOM 0 H ASP B 106 -7.077 -3.880 14.002 1.00 5.41 H new ATOM 0 HA ASP B 106 -8.495 -5.731 15.207 1.00 6.32 H new ATOM 0 HB2 ASP B 106 -7.639 -7.122 13.014 1.00 7.13 H new ATOM 0 HB3 ASP B 106 -6.489 -7.607 14.244 1.00 7.13 H new ATOM 1309 N VAL B 107 -6.217 -4.288 15.991 1.00 6.17 N ATOM 1310 CA VAL B 107 -5.196 -3.785 16.853 1.00 6.24 C ATOM 1311 C VAL B 107 -5.638 -2.434 17.399 1.00 5.49 C ATOM 1312 O VAL B 107 -6.715 -1.934 17.080 1.00 5.67 O ATOM 1313 CB VAL B 107 -3.807 -3.691 16.157 1.00 7.18 C ATOM 1314 CG1 VAL B 107 -3.670 -2.460 15.258 1.00 7.33 C ATOM 1315 CG2 VAL B 107 -2.706 -3.718 17.206 1.00 7.48 C ATOM 0 H VAL B 107 -6.803 -3.548 15.606 1.00 6.17 H new ATOM 0 HA VAL B 107 -5.062 -4.490 17.673 1.00 6.24 H new ATOM 0 HB VAL B 107 -3.713 -4.557 15.502 1.00 7.18 H new ATOM 0 HG11 VAL B 107 -2.680 -2.451 14.802 1.00 7.33 H new ATOM 0 HG12 VAL B 107 -4.430 -2.494 14.477 1.00 7.33 H new ATOM 0 HG13 VAL B 107 -3.803 -1.557 15.854 1.00 7.33 H new ATOM 0 HG21 VAL B 107 -1.735 -3.652 16.716 1.00 7.48 H new ATOM 0 HG22 VAL B 107 -2.828 -2.873 17.884 1.00 7.48 H new ATOM 0 HG23 VAL B 107 -2.765 -4.648 17.771 1.00 7.48 H new ATOM 1325 N ARG B 108 -4.802 -1.882 18.255 1.00 5.08 N ATOM 1326 CA ARG B 108 -5.080 -0.622 18.831 1.00 4.80 C ATOM 1327 C ARG B 108 -4.673 0.350 17.797 1.00 4.49 C ATOM 1328 O ARG B 108 -3.503 0.353 17.408 1.00 4.98 O ATOM 1329 CB ARG B 108 -4.330 -0.415 20.157 1.00 5.26 C ATOM 1330 CG ARG B 108 -5.215 0.073 21.297 1.00 6.18 C ATOM 1331 CD ARG B 108 -4.517 -0.044 22.646 1.00 6.96 C ATOM 1332 NE ARG B 108 -3.458 0.954 22.809 1.00 7.64 N ATOM 1333 CZ ARG B 108 -3.652 2.182 23.298 1.00 8.36 C ATOM 1334 NH1 ARG B 108 -4.864 2.576 23.675 1.00 8.54 N ATOM 1335 NH2 ARG B 108 -2.629 3.016 23.410 1.00 9.12 N ATOM 0 H ARG B 108 -3.924 -2.305 18.556 1.00 5.08 H new ATOM 0 HA ARG B 108 -6.131 -0.514 19.100 1.00 4.80 H new ATOM 0 HB2 ARG B 108 -3.863 -1.355 20.450 1.00 5.26 H new ATOM 0 HB3 ARG B 108 -3.527 0.305 20.000 1.00 5.26 H new ATOM 0 HG2 ARG B 108 -5.494 1.112 21.121 1.00 6.18 H new ATOM 0 HG3 ARG B 108 -6.138 -0.506 21.314 1.00 6.18 H new ATOM 0 HD2 ARG B 108 -5.250 0.073 23.444 1.00 6.96 H new ATOM 0 HD3 ARG B 108 -4.092 -1.042 22.748 1.00 6.96 H new ATOM 0 HE ARG B 108 -2.511 0.695 22.531 1.00 7.64 H new ATOM 0 HH11 ARG B 108 -5.656 1.939 23.592 1.00 8.54 H new ATOM 0 HH12 ARG B 108 -5.002 3.516 24.047 1.00 8.54 H new ATOM 0 HH21 ARG B 108 -1.696 2.720 23.123 1.00 9.12 H new ATOM 0 HH22 ARG B 108 -2.774 3.954 23.783 1.00 9.12 H new ATOM 1349 N THR B 109 -5.621 1.116 17.288 1.00 4.05 N ATOM 1350 CA THR B 109 -5.333 2.045 16.206 1.00 4.08 C ATOM 1351 C THR B 109 -3.968 2.720 16.354 1.00 3.18 C ATOM 1352 O THR B 109 -3.728 3.510 17.267 1.00 3.48 O ATOM 1353 CB THR B 109 -6.426 3.103 16.124 1.00 4.98 C ATOM 1354 OG1 THR B 109 -6.123 4.055 15.120 1.00 5.58 O ATOM 1355 CG2 THR B 109 -6.630 3.850 17.423 1.00 5.69 C ATOM 0 H THR B 109 -6.591 1.115 17.603 1.00 4.05 H new ATOM 0 HA THR B 109 -5.306 1.463 15.285 1.00 4.08 H new ATOM 0 HB THR B 109 -7.342 2.561 15.889 1.00 4.98 H new ATOM 0 HG1 THR B 109 -6.836 4.726 15.080 1.00 5.58 H new ATOM 0 HG21 THR B 109 -7.422 4.589 17.297 1.00 5.69 H new ATOM 0 HG22 THR B 109 -6.911 3.147 18.207 1.00 5.69 H new ATOM 0 HG23 THR B 109 -5.705 4.354 17.702 1.00 5.69 H new ATOM 1363 N CYS B 110 -3.103 2.322 15.430 1.00 2.52 N ATOM 1364 CA CYS B 110 -1.687 2.750 15.327 1.00 1.89 C ATOM 1365 C CYS B 110 -1.340 4.038 16.085 1.00 1.69 C ATOM 1366 O CYS B 110 -1.917 5.082 15.792 1.00 1.94 O ATOM 1367 CB CYS B 110 -1.283 3.041 13.885 1.00 2.23 C ATOM 1368 SG CYS B 110 -1.353 1.626 12.773 1.00 2.61 S ATOM 0 H CYS B 110 -3.366 1.665 14.695 1.00 2.52 H new ATOM 0 HA CYS B 110 -1.157 1.903 15.763 1.00 1.89 H new ATOM 0 HB2 CYS B 110 -1.932 3.824 13.493 1.00 2.23 H new ATOM 0 HB3 CYS B 110 -0.267 3.437 13.881 1.00 2.23 H new ATOM 1373 N LEU B 111 -0.426 3.944 17.082 1.00 1.46 N ATOM 1374 CA LEU B 111 0.018 5.102 17.908 1.00 1.37 C ATOM 1375 C LEU B 111 -0.150 6.464 17.187 1.00 1.20 C ATOM 1376 O LEU B 111 0.396 6.680 16.094 1.00 1.18 O ATOM 1377 CB LEU B 111 1.474 4.923 18.349 1.00 1.54 C ATOM 1378 CG LEU B 111 1.704 5.009 19.863 1.00 1.90 C ATOM 1379 CD1 LEU B 111 1.325 6.387 20.386 1.00 2.47 C ATOM 1380 CD2 LEU B 111 0.914 3.929 20.588 1.00 2.26 C ATOM 0 H LEU B 111 0.026 3.066 17.338 1.00 1.46 H new ATOM 0 HA LEU B 111 -0.632 5.120 18.782 1.00 1.37 H new ATOM 0 HB2 LEU B 111 1.829 3.955 17.996 1.00 1.54 H new ATOM 0 HB3 LEU B 111 2.083 5.683 17.860 1.00 1.54 H new ATOM 0 HG LEU B 111 2.765 4.848 20.056 1.00 1.90 H new ATOM 0 HD11 LEU B 111 1.495 6.427 21.462 1.00 2.47 H new ATOM 0 HD12 LEU B 111 1.935 7.144 19.893 1.00 2.47 H new ATOM 0 HD13 LEU B 111 0.272 6.578 20.178 1.00 2.47 H new ATOM 0 HD21 LEU B 111 1.091 4.007 21.661 1.00 2.26 H new ATOM 0 HD22 LEU B 111 -0.149 4.058 20.385 1.00 2.26 H new ATOM 0 HD23 LEU B 111 1.234 2.947 20.238 1.00 2.26 H new ATOM 1392 N PRO B 112 -0.969 7.363 17.782 1.00 1.19 N ATOM 1393 CA PRO B 112 -1.313 8.689 17.218 1.00 1.12 C ATOM 1394 C PRO B 112 -0.194 9.738 17.230 1.00 1.03 C ATOM 1395 O PRO B 112 0.710 9.691 18.068 1.00 1.06 O ATOM 1396 CB PRO B 112 -2.466 9.123 18.110 1.00 1.30 C ATOM 1397 CG PRO B 112 -2.182 8.497 19.414 1.00 1.47 C ATOM 1398 CD PRO B 112 -1.694 7.135 19.064 1.00 1.37 C ATOM 0 HA PRO B 112 -1.535 8.608 16.154 1.00 1.12 H new ATOM 0 HB2 PRO B 112 -2.516 10.209 18.194 1.00 1.30 H new ATOM 0 HB3 PRO B 112 -3.424 8.790 17.710 1.00 1.30 H new ATOM 0 HG2 PRO B 112 -1.432 9.058 19.971 1.00 1.47 H new ATOM 0 HG3 PRO B 112 -3.075 8.453 20.038 1.00 1.47 H new ATOM 0 HD2 PRO B 112 -1.037 6.731 19.834 1.00 1.37 H new ATOM 0 HD3 PRO B 112 -2.516 6.429 18.944 1.00 1.37 H new ATOM 1406 N CYS B 113 -0.301 10.726 16.315 1.00 0.94 N ATOM 1407 CA CYS B 113 0.693 11.821 16.276 1.00 0.90 C ATOM 1408 C CYS B 113 0.133 13.042 15.564 1.00 0.91 C ATOM 1409 O CYS B 113 -1.052 13.058 15.203 1.00 1.00 O ATOM 1410 CB CYS B 113 2.013 11.354 15.621 1.00 0.83 C ATOM 1411 SG CYS B 113 1.961 11.116 13.806 1.00 0.87 S ATOM 0 H CYS B 113 -1.040 10.789 15.615 1.00 0.94 H new ATOM 0 HA CYS B 113 0.914 12.105 17.305 1.00 0.90 H new ATOM 0 HB2 CYS B 113 2.789 12.084 15.851 1.00 0.83 H new ATOM 0 HB3 CYS B 113 2.313 10.414 16.083 1.00 0.83 H new ATOM 1416 N GLY B 114 0.969 14.042 15.296 1.00 0.92 N ATOM 1417 CA GLY B 114 0.514 15.226 14.564 1.00 0.99 C ATOM 1418 C GLY B 114 -0.335 16.205 15.378 1.00 1.11 C ATOM 1419 O GLY B 114 -0.310 16.176 16.608 1.00 1.16 O ATOM 0 H GLY B 114 1.952 14.060 15.569 1.00 0.92 H new ATOM 0 HA2 GLY B 114 1.387 15.756 14.183 1.00 0.99 H new ATOM 0 HA3 GLY B 114 -0.064 14.900 13.699 1.00 0.99 H new ATOM 1423 N PRO B 115 -1.133 17.076 14.697 1.00 1.19 N ATOM 1424 CA PRO B 115 -2.045 18.069 15.334 1.00 1.33 C ATOM 1425 C PRO B 115 -3.183 17.385 16.087 1.00 1.40 C ATOM 1426 O PRO B 115 -4.144 16.890 15.498 1.00 1.57 O ATOM 1427 CB PRO B 115 -2.587 18.813 14.126 1.00 1.46 C ATOM 1428 CG PRO B 115 -2.705 17.672 13.238 1.00 1.39 C ATOM 1429 CD PRO B 115 -1.315 17.137 13.237 1.00 1.21 C ATOM 0 HA PRO B 115 -1.549 18.700 16.071 1.00 1.33 H new ATOM 0 HB2 PRO B 115 -3.540 19.305 14.319 1.00 1.46 H new ATOM 0 HB3 PRO B 115 -1.905 19.576 13.753 1.00 1.46 H new ATOM 0 HG2 PRO B 115 -3.424 16.940 13.607 1.00 1.39 H new ATOM 0 HG3 PRO B 115 -3.031 17.964 12.240 1.00 1.39 H new ATOM 0 HD2 PRO B 115 -1.232 16.163 12.755 1.00 1.21 H new ATOM 0 HD3 PRO B 115 -0.602 17.799 12.744 1.00 1.21 H new ATOM 1437 N GLY B 116 -3.033 17.355 17.353 1.00 1.35 N ATOM 1438 CA GLY B 116 -3.996 16.705 18.227 1.00 1.48 C ATOM 1439 C GLY B 116 -3.681 15.234 18.390 1.00 1.44 C ATOM 1440 O GLY B 116 -4.353 14.507 19.122 1.00 1.70 O ATOM 0 H GLY B 116 -2.242 17.776 17.841 1.00 1.35 H new ATOM 0 HA2 GLY B 116 -3.991 17.191 19.203 1.00 1.48 H new ATOM 0 HA3 GLY B 116 -4.999 16.822 17.818 1.00 1.48 H new ATOM 1444 N GLY B 117 -2.623 14.825 17.720 1.00 1.29 N ATOM 1445 CA GLY B 117 -2.161 13.511 17.799 1.00 1.26 C ATOM 1446 C GLY B 117 -3.116 12.495 17.261 1.00 1.26 C ATOM 1447 O GLY B 117 -3.383 11.500 17.894 1.00 1.38 O ATOM 0 H GLY B 117 -2.074 15.426 17.106 1.00 1.29 H new ATOM 0 HA2 GLY B 117 -1.220 13.435 17.253 1.00 1.26 H new ATOM 0 HA3 GLY B 117 -1.945 13.275 18.841 1.00 1.26 H new ATOM 1451 N LYS B 118 -3.679 12.797 16.129 1.00 1.19 N ATOM 1452 CA LYS B 118 -4.624 11.907 15.481 1.00 1.25 C ATOM 1453 C LYS B 118 -3.872 11.024 14.490 1.00 1.15 C ATOM 1454 O LYS B 118 -4.237 9.873 14.244 1.00 1.25 O ATOM 1455 CB LYS B 118 -5.704 12.694 14.714 1.00 1.30 C ATOM 1456 CG LYS B 118 -5.740 14.191 15.011 1.00 1.36 C ATOM 1457 CD LYS B 118 -7.094 14.630 15.524 1.00 1.78 C ATOM 1458 CE LYS B 118 -7.030 16.034 16.100 1.00 1.95 C ATOM 1459 NZ LYS B 118 -7.712 17.026 15.226 1.00 2.54 N ATOM 0 H LYS B 118 -3.503 13.664 15.621 1.00 1.19 H new ATOM 0 HA LYS B 118 -5.111 11.308 16.251 1.00 1.25 H new ATOM 0 HB2 LYS B 118 -5.544 12.554 13.645 1.00 1.30 H new ATOM 0 HB3 LYS B 118 -6.679 12.268 14.949 1.00 1.30 H new ATOM 0 HG2 LYS B 118 -4.976 14.434 15.749 1.00 1.36 H new ATOM 0 HG3 LYS B 118 -5.497 14.747 14.106 1.00 1.36 H new ATOM 0 HD2 LYS B 118 -7.821 14.599 14.713 1.00 1.78 H new ATOM 0 HD3 LYS B 118 -7.440 13.935 16.289 1.00 1.78 H new ATOM 0 HE2 LYS B 118 -7.492 16.042 17.087 1.00 1.95 H new ATOM 0 HE3 LYS B 118 -5.988 16.324 16.233 1.00 1.95 H new ATOM 0 HZ1 LYS B 118 -7.645 17.971 15.655 1.00 2.54 H new ATOM 0 HZ2 LYS B 118 -7.255 17.037 14.292 1.00 2.54 H new ATOM 0 HZ3 LYS B 118 -8.713 16.764 15.119 1.00 2.54 H new ATOM 1473 N GLY B 119 -2.783 11.587 13.953 1.00 1.04 N ATOM 1474 CA GLY B 119 -1.997 10.904 12.941 1.00 0.97 C ATOM 1475 C GLY B 119 -1.432 9.619 13.457 1.00 0.93 C ATOM 1476 O GLY B 119 -1.858 9.177 14.520 1.00 1.02 O ATOM 0 H GLY B 119 -2.434 12.511 14.207 1.00 1.04 H new ATOM 0 HA2 GLY B 119 -2.620 10.704 12.069 1.00 0.97 H new ATOM 0 HA3 GLY B 119 -1.185 11.552 12.611 1.00 0.97 H new ATOM 1480 N ARG B 120 -0.435 9.022 12.817 1.00 0.87 N ATOM 1481 CA ARG B 120 0.115 7.779 13.318 1.00 0.87 C ATOM 1482 C ARG B 120 1.573 7.694 12.918 1.00 0.80 C ATOM 1483 O ARG B 120 2.061 8.532 12.155 1.00 0.79 O ATOM 1484 CB ARG B 120 -0.656 6.596 12.727 1.00 0.95 C ATOM 1485 CG ARG B 120 -2.006 6.346 13.379 1.00 1.16 C ATOM 1486 CD ARG B 120 -2.853 5.379 12.562 1.00 1.60 C ATOM 1487 NE ARG B 120 -3.453 6.023 11.394 1.00 1.82 N ATOM 1488 CZ ARG B 120 -4.679 6.550 11.373 1.00 2.25 C ATOM 1489 NH1 ARG B 120 -5.447 6.516 12.456 1.00 2.62 N ATOM 1490 NH2 ARG B 120 -5.138 7.111 10.263 1.00 2.89 N ATOM 0 H ARG B 120 0.000 9.374 11.965 1.00 0.87 H new ATOM 0 HA ARG B 120 0.028 7.747 14.404 1.00 0.87 H new ATOM 0 HB2 ARG B 120 -0.806 6.770 11.661 1.00 0.95 H new ATOM 0 HB3 ARG B 120 -0.047 5.697 12.821 1.00 0.95 H new ATOM 0 HG2 ARG B 120 -1.858 5.943 14.381 1.00 1.16 H new ATOM 0 HG3 ARG B 120 -2.537 7.291 13.491 1.00 1.16 H new ATOM 0 HD2 ARG B 120 -2.235 4.543 12.236 1.00 1.60 H new ATOM 0 HD3 ARG B 120 -3.641 4.966 13.192 1.00 1.60 H new ATOM 0 HE ARG B 120 -2.898 6.073 10.540 1.00 1.82 H new ATOM 0 HH11 ARG B 120 -5.101 6.085 13.313 1.00 2.62 H new ATOM 0 HH12 ARG B 120 -6.383 6.921 12.431 1.00 2.62 H new ATOM 0 HH21 ARG B 120 -4.554 7.139 9.427 1.00 2.89 H new ATOM 0 HH22 ARG B 120 -6.075 7.514 10.245 1.00 2.89 H new ATOM 1504 N CYS B 121 2.275 6.703 13.441 1.00 0.82 N ATOM 1505 CA CYS B 121 3.694 6.562 13.142 1.00 0.81 C ATOM 1506 C CYS B 121 3.984 5.427 12.169 1.00 0.85 C ATOM 1507 O CYS B 121 3.450 4.325 12.284 1.00 1.05 O ATOM 1508 CB CYS B 121 4.474 6.343 14.432 1.00 0.91 C ATOM 1509 SG CYS B 121 5.027 7.889 15.203 1.00 1.07 S ATOM 0 H CYS B 121 1.895 5.992 14.066 1.00 0.82 H new ATOM 0 HA CYS B 121 4.011 7.487 12.660 1.00 0.81 H new ATOM 0 HB2 CYS B 121 3.850 5.795 15.138 1.00 0.91 H new ATOM 0 HB3 CYS B 121 5.342 5.718 14.223 1.00 0.91 H new ATOM 1514 N PHE B 122 4.854 5.733 11.208 1.00 0.76 N ATOM 1515 CA PHE B 122 5.266 4.784 10.183 1.00 0.84 C ATOM 1516 C PHE B 122 6.734 5.017 9.823 1.00 0.95 C ATOM 1517 O PHE B 122 7.120 4.959 8.655 1.00 1.44 O ATOM 1518 CB PHE B 122 4.385 4.939 8.940 1.00 0.86 C ATOM 1519 CG PHE B 122 3.032 4.303 9.083 1.00 0.86 C ATOM 1520 CD1 PHE B 122 1.963 5.020 9.600 1.00 1.41 C ATOM 1521 CD2 PHE B 122 2.829 2.986 8.703 1.00 1.42 C ATOM 1522 CE1 PHE B 122 0.717 4.433 9.733 1.00 1.53 C ATOM 1523 CE2 PHE B 122 1.588 2.394 8.834 1.00 1.50 C ATOM 1524 CZ PHE B 122 0.531 3.118 9.349 1.00 1.15 C ATOM 0 H PHE B 122 5.293 6.650 11.121 1.00 0.76 H new ATOM 0 HA PHE B 122 5.152 3.770 10.567 1.00 0.84 H new ATOM 0 HB2 PHE B 122 4.258 6.000 8.724 1.00 0.86 H new ATOM 0 HB3 PHE B 122 4.897 4.498 8.084 1.00 0.86 H new ATOM 0 HD1 PHE B 122 2.105 6.047 9.902 1.00 1.41 H new ATOM 0 HD2 PHE B 122 3.652 2.415 8.299 1.00 1.42 H new ATOM 0 HE1 PHE B 122 -0.108 5.001 10.136 1.00 1.53 H new ATOM 0 HE2 PHE B 122 1.445 1.366 8.534 1.00 1.50 H new ATOM 0 HZ PHE B 122 -0.440 2.657 9.452 1.00 1.15 H new ATOM 1534 N GLY B 123 7.541 5.295 10.846 1.00 0.84 N ATOM 1535 CA GLY B 123 8.957 5.553 10.647 1.00 0.89 C ATOM 1536 C GLY B 123 9.463 6.656 11.568 1.00 0.89 C ATOM 1537 O GLY B 123 8.657 7.367 12.166 1.00 0.90 O ATOM 0 H GLY B 123 7.234 5.346 11.817 1.00 0.84 H new ATOM 0 HA2 GLY B 123 9.523 4.639 10.829 1.00 0.89 H new ATOM 0 HA3 GLY B 123 9.133 5.836 9.609 1.00 0.89 H new ATOM 1541 N PRO B 124 10.795 6.834 11.716 1.00 1.02 N ATOM 1542 CA PRO B 124 11.352 7.875 12.590 1.00 1.08 C ATOM 1543 C PRO B 124 11.029 9.281 12.086 1.00 0.96 C ATOM 1544 O PRO B 124 10.254 10.006 12.710 1.00 1.02 O ATOM 1545 CB PRO B 124 12.866 7.618 12.559 1.00 1.33 C ATOM 1546 CG PRO B 124 13.018 6.244 11.996 1.00 1.51 C ATOM 1547 CD PRO B 124 11.857 6.053 11.063 1.00 1.26 C ATOM 0 HA PRO B 124 10.932 7.828 13.595 1.00 1.08 H new ATOM 0 HB2 PRO B 124 13.378 8.356 11.941 1.00 1.33 H new ATOM 0 HB3 PRO B 124 13.297 7.684 13.558 1.00 1.33 H new ATOM 0 HG2 PRO B 124 13.966 6.141 11.467 1.00 1.51 H new ATOM 0 HG3 PRO B 124 13.011 5.494 12.787 1.00 1.51 H new ATOM 0 HD2 PRO B 124 12.076 6.423 10.061 1.00 1.26 H new ATOM 0 HD3 PRO B 124 11.585 5.002 10.963 1.00 1.26 H new ATOM 1555 N SER B 125 11.609 9.658 10.946 1.00 0.97 N ATOM 1556 CA SER B 125 11.351 10.975 10.364 1.00 0.92 C ATOM 1557 C SER B 125 10.144 10.897 9.441 1.00 0.76 C ATOM 1558 O SER B 125 10.146 11.464 8.355 1.00 0.78 O ATOM 1559 CB SER B 125 12.582 11.496 9.582 1.00 1.12 C ATOM 1560 OG SER B 125 13.489 12.157 10.450 1.00 1.25 O ATOM 0 H SER B 125 12.254 9.076 10.412 1.00 0.97 H new ATOM 0 HA SER B 125 11.149 11.674 11.175 1.00 0.92 H new ATOM 0 HB2 SER B 125 13.084 10.663 9.090 1.00 1.12 H new ATOM 0 HB3 SER B 125 12.257 12.181 8.798 1.00 1.12 H new ATOM 0 HG SER B 125 14.327 12.335 9.974 1.00 1.25 H new ATOM 1566 N ILE B 126 9.120 10.138 9.846 1.00 0.70 N ATOM 1567 CA ILE B 126 7.929 9.976 9.033 1.00 0.60 C ATOM 1568 C ILE B 126 6.696 9.600 9.876 1.00 0.57 C ATOM 1569 O ILE B 126 6.680 8.554 10.525 1.00 0.74 O ATOM 1570 CB ILE B 126 8.118 8.925 7.915 1.00 0.60 C ATOM 1571 CG1 ILE B 126 9.566 8.864 7.414 1.00 0.79 C ATOM 1572 CG2 ILE B 126 7.205 9.281 6.779 1.00 0.72 C ATOM 1573 CD1 ILE B 126 10.107 7.455 7.282 1.00 0.85 C ATOM 0 H ILE B 126 9.100 9.631 10.731 1.00 0.70 H new ATOM 0 HA ILE B 126 7.758 10.949 8.572 1.00 0.60 H new ATOM 0 HB ILE B 126 7.879 7.942 8.319 1.00 0.60 H new ATOM 0 HG12 ILE B 126 9.627 9.359 6.445 1.00 0.79 H new ATOM 0 HG13 ILE B 126 10.202 9.425 8.099 1.00 0.79 H new ATOM 0 HG21 ILE B 126 7.321 8.552 5.977 1.00 0.72 H new ATOM 0 HG22 ILE B 126 6.172 9.276 7.127 1.00 0.72 H new ATOM 0 HG23 ILE B 126 7.458 10.274 6.407 1.00 0.72 H new ATOM 0 HD11 ILE B 126 11.135 7.492 6.923 1.00 0.85 H new ATOM 0 HD12 ILE B 126 10.080 6.962 8.254 1.00 0.85 H new ATOM 0 HD13 ILE B 126 9.496 6.895 6.574 1.00 0.85 H new ATOM 1585 N CYS B 127 5.656 10.441 9.829 1.00 0.54 N ATOM 1586 CA CYS B 127 4.399 10.181 10.554 1.00 0.53 C ATOM 1587 C CYS B 127 3.235 10.230 9.556 1.00 0.53 C ATOM 1588 O CYS B 127 3.045 11.241 8.885 1.00 0.56 O ATOM 1589 CB CYS B 127 4.165 11.217 11.664 1.00 0.56 C ATOM 1590 SG CYS B 127 3.852 10.511 13.325 1.00 0.89 S ATOM 0 H CYS B 127 5.657 11.311 9.296 1.00 0.54 H new ATOM 0 HA CYS B 127 4.464 9.198 11.021 1.00 0.53 H new ATOM 0 HB2 CYS B 127 5.036 11.870 11.721 1.00 0.56 H new ATOM 0 HB3 CYS B 127 3.316 11.842 11.385 1.00 0.56 H new ATOM 1595 N CYS B 128 2.480 9.139 9.424 1.00 0.53 N ATOM 1596 CA CYS B 128 1.384 9.101 8.450 1.00 0.56 C ATOM 1597 C CYS B 128 -0.055 9.059 9.079 1.00 0.60 C ATOM 1598 O CYS B 128 -0.267 8.482 10.139 1.00 0.76 O ATOM 1599 CB CYS B 128 1.526 7.848 7.552 1.00 0.63 C ATOM 1600 SG CYS B 128 2.635 7.944 6.090 1.00 1.23 S ATOM 0 H CYS B 128 2.601 8.284 9.967 1.00 0.53 H new ATOM 0 HA CYS B 128 1.473 10.033 7.893 1.00 0.56 H new ATOM 0 HB2 CYS B 128 1.874 7.027 8.179 1.00 0.63 H new ATOM 0 HB3 CYS B 128 0.531 7.579 7.197 1.00 0.63 H new ATOM 1605 N GLY B 129 -1.012 9.709 8.366 1.00 0.60 N ATOM 1606 CA GLY B 129 -2.376 9.763 8.762 1.00 0.65 C ATOM 1607 C GLY B 129 -3.313 9.468 7.613 1.00 0.66 C ATOM 1608 O GLY B 129 -2.948 9.529 6.445 1.00 0.64 O ATOM 0 H GLY B 129 -0.819 10.204 7.496 1.00 0.60 H new ATOM 0 HA2 GLY B 129 -2.549 9.045 9.564 1.00 0.65 H new ATOM 0 HA3 GLY B 129 -2.597 10.751 9.165 1.00 0.65 H new ATOM 1612 N ASP B 130 -4.520 9.195 7.986 1.00 0.72 N ATOM 1613 CA ASP B 130 -5.647 8.916 7.113 1.00 0.76 C ATOM 1614 C ASP B 130 -6.121 10.178 6.415 1.00 0.77 C ATOM 1615 O ASP B 130 -6.517 10.161 5.248 1.00 0.81 O ATOM 1616 CB ASP B 130 -6.830 8.349 7.901 1.00 0.84 C ATOM 1617 CG ASP B 130 -7.268 9.271 9.029 1.00 1.47 C ATOM 1618 OD1 ASP B 130 -6.478 9.460 9.975 1.00 1.96 O ATOM 1619 OD2 ASP B 130 -8.398 9.804 8.964 1.00 2.35 O ATOM 0 H ASP B 130 -4.777 9.155 8.972 1.00 0.72 H new ATOM 0 HA ASP B 130 -5.301 8.187 6.380 1.00 0.76 H new ATOM 0 HB2 ASP B 130 -7.668 8.183 7.224 1.00 0.84 H new ATOM 0 HB3 ASP B 130 -6.557 7.378 8.314 1.00 0.84 H new ATOM 1624 N GLU B 131 -5.884 11.287 7.091 1.00 0.79 N ATOM 1625 CA GLU B 131 -6.132 12.569 6.487 1.00 0.85 C ATOM 1626 C GLU B 131 -5.043 13.493 6.881 1.00 0.89 C ATOM 1627 O GLU B 131 -5.202 14.714 6.781 1.00 1.03 O ATOM 1628 CB GLU B 131 -7.483 13.172 6.955 1.00 0.93 C ATOM 1629 CG GLU B 131 -8.005 12.644 8.293 1.00 1.02 C ATOM 1630 CD GLU B 131 -9.294 13.322 8.735 1.00 1.16 C ATOM 1631 OE1 GLU B 131 -9.273 14.550 8.964 1.00 1.69 O ATOM 1632 OE2 GLU B 131 -10.324 12.624 8.849 1.00 1.63 O ATOM 0 H GLU B 131 -5.525 11.320 8.045 1.00 0.79 H new ATOM 0 HA GLU B 131 -6.172 12.436 5.406 1.00 0.85 H new ATOM 0 HB2 GLU B 131 -7.374 14.254 7.028 1.00 0.93 H new ATOM 0 HB3 GLU B 131 -8.234 12.978 6.189 1.00 0.93 H new ATOM 0 HG2 GLU B 131 -8.174 11.570 8.213 1.00 1.02 H new ATOM 0 HG3 GLU B 131 -7.243 12.790 9.058 1.00 1.02 H new ATOM 1639 N LEU B 132 -3.869 12.961 7.238 1.00 0.83 N ATOM 1640 CA LEU B 132 -2.757 13.749 7.592 1.00 0.89 C ATOM 1641 C LEU B 132 -1.612 13.351 6.679 1.00 0.83 C ATOM 1642 O LEU B 132 -0.575 14.009 6.633 1.00 0.91 O ATOM 1643 CB LEU B 132 -2.421 13.410 9.042 1.00 0.93 C ATOM 1644 CG LEU B 132 -2.415 14.578 10.030 1.00 1.16 C ATOM 1645 CD1 LEU B 132 -2.253 14.068 11.455 1.00 1.25 C ATOM 1646 CD2 LEU B 132 -1.318 15.570 9.687 1.00 1.38 C ATOM 0 H LEU B 132 -3.696 11.957 7.279 1.00 0.83 H new ATOM 0 HA LEU B 132 -2.946 14.818 7.493 1.00 0.89 H new ATOM 0 HB2 LEU B 132 -3.138 12.668 9.394 1.00 0.93 H new ATOM 0 HB3 LEU B 132 -1.438 12.939 9.064 1.00 0.93 H new ATOM 0 HG LEU B 132 -3.372 15.094 9.955 1.00 1.16 H new ATOM 0 HD11 LEU B 132 -2.251 14.912 12.145 1.00 1.25 H new ATOM 0 HD12 LEU B 132 -3.080 13.402 11.699 1.00 1.25 H new ATOM 0 HD13 LEU B 132 -1.312 13.525 11.542 1.00 1.25 H new ATOM 0 HD21 LEU B 132 -1.333 16.392 10.403 1.00 1.38 H new ATOM 0 HD22 LEU B 132 -0.350 15.071 9.728 1.00 1.38 H new ATOM 0 HD23 LEU B 132 -1.482 15.961 8.683 1.00 1.38 H new ATOM 1658 N GLY B 133 -1.832 12.259 5.926 1.00 0.72 N ATOM 1659 CA GLY B 133 -0.871 11.785 5.013 1.00 0.70 C ATOM 1660 C GLY B 133 0.446 11.441 5.685 1.00 0.66 C ATOM 1661 O GLY B 133 0.463 10.512 6.455 1.00 0.65 O ATOM 0 H GLY B 133 -2.689 11.707 5.960 1.00 0.72 H new ATOM 0 HA2 GLY B 133 -1.259 10.901 4.507 1.00 0.70 H new ATOM 0 HA3 GLY B 133 -0.698 12.541 4.247 1.00 0.70 H new ATOM 1665 N CYS B 134 1.554 12.144 5.404 1.00 0.69 N ATOM 1666 CA CYS B 134 2.826 11.816 6.050 1.00 0.68 C ATOM 1667 C CYS B 134 3.705 12.986 6.256 1.00 0.64 C ATOM 1668 O CYS B 134 4.082 13.672 5.323 1.00 0.62 O ATOM 1669 CB CYS B 134 3.553 10.722 5.322 1.00 0.72 C ATOM 1670 SG CYS B 134 4.033 9.368 6.449 1.00 1.08 S ATOM 0 H CYS B 134 1.593 12.925 4.749 1.00 0.69 H new ATOM 0 HA CYS B 134 2.561 11.453 7.043 1.00 0.68 H new ATOM 0 HB2 CYS B 134 2.918 10.328 4.529 1.00 0.72 H new ATOM 0 HB3 CYS B 134 4.443 11.131 4.844 1.00 0.72 H new ATOM 1675 N PHE B 135 4.074 13.164 7.517 1.00 0.67 N ATOM 1676 CA PHE B 135 4.986 14.198 7.856 1.00 0.66 C ATOM 1677 C PHE B 135 6.288 13.480 7.945 1.00 0.64 C ATOM 1678 O PHE B 135 6.585 12.818 8.943 1.00 0.64 O ATOM 1679 CB PHE B 135 4.667 14.918 9.188 1.00 0.70 C ATOM 1680 CG PHE B 135 3.458 14.430 9.955 1.00 0.72 C ATOM 1681 CD1 PHE B 135 2.225 14.276 9.338 1.00 0.96 C ATOM 1682 CD2 PHE B 135 3.562 14.145 11.309 1.00 1.15 C ATOM 1683 CE1 PHE B 135 1.124 13.845 10.055 1.00 1.19 C ATOM 1684 CE2 PHE B 135 2.464 13.713 12.030 1.00 1.36 C ATOM 1685 CZ PHE B 135 1.245 13.563 11.403 1.00 1.23 C ATOM 0 H PHE B 135 3.748 12.600 8.302 1.00 0.67 H new ATOM 0 HA PHE B 135 4.958 15.002 7.120 1.00 0.66 H new ATOM 0 HB2 PHE B 135 5.538 14.833 9.837 1.00 0.70 H new ATOM 0 HB3 PHE B 135 4.530 15.978 8.976 1.00 0.70 H new ATOM 0 HD1 PHE B 135 2.124 14.495 8.285 1.00 0.96 H new ATOM 0 HD2 PHE B 135 4.513 14.262 11.806 1.00 1.15 H new ATOM 0 HE1 PHE B 135 0.170 13.729 9.562 1.00 1.19 H new ATOM 0 HE2 PHE B 135 2.561 13.493 13.083 1.00 1.36 H new ATOM 0 HZ PHE B 135 0.386 13.226 11.964 1.00 1.23 H new ATOM 1695 N VAL B 136 7.054 13.593 6.890 1.00 0.66 N ATOM 1696 CA VAL B 136 8.316 12.931 6.839 1.00 0.68 C ATOM 1697 C VAL B 136 9.363 13.888 7.359 1.00 0.71 C ATOM 1698 O VAL B 136 10.022 14.641 6.631 1.00 0.74 O ATOM 1699 CB VAL B 136 8.647 12.375 5.424 1.00 0.73 C ATOM 1700 CG1 VAL B 136 9.675 11.258 5.534 1.00 0.75 C ATOM 1701 CG2 VAL B 136 7.377 11.856 4.715 1.00 0.74 C ATOM 0 H VAL B 136 6.820 14.138 6.060 1.00 0.66 H new ATOM 0 HA VAL B 136 8.291 12.045 7.473 1.00 0.68 H new ATOM 0 HB VAL B 136 9.058 13.189 4.827 1.00 0.73 H new ATOM 0 HG11 VAL B 136 9.902 10.873 4.540 1.00 0.75 H new ATOM 0 HG12 VAL B 136 10.586 11.646 5.990 1.00 0.75 H new ATOM 0 HG13 VAL B 136 9.274 10.454 6.151 1.00 0.75 H new ATOM 0 HG21 VAL B 136 7.641 11.474 3.729 1.00 0.74 H new ATOM 0 HG22 VAL B 136 6.931 11.056 5.306 1.00 0.74 H new ATOM 0 HG23 VAL B 136 6.661 12.671 4.609 1.00 0.74 H new ATOM 1711 N GLY B 137 9.463 13.847 8.672 1.00 0.72 N ATOM 1712 CA GLY B 137 10.405 14.694 9.387 1.00 0.76 C ATOM 1713 C GLY B 137 9.822 16.036 9.793 1.00 0.73 C ATOM 1714 O GLY B 137 10.044 17.046 9.127 1.00 0.83 O ATOM 0 H GLY B 137 8.905 13.237 9.269 1.00 0.72 H new ATOM 0 HA2 GLY B 137 10.748 14.170 10.279 1.00 0.76 H new ATOM 0 HA3 GLY B 137 11.280 14.861 8.759 1.00 0.76 H new ATOM 1718 N THR B 138 9.090 16.040 10.902 1.00 0.69 N ATOM 1719 CA THR B 138 8.475 17.256 11.435 1.00 0.70 C ATOM 1720 C THR B 138 8.418 17.147 12.954 1.00 0.73 C ATOM 1721 O THR B 138 8.704 16.075 13.487 1.00 0.77 O ATOM 1722 CB THR B 138 7.098 17.473 10.821 1.00 0.73 C ATOM 1723 OG1 THR B 138 6.214 16.433 11.190 1.00 0.78 O ATOM 1724 CG2 THR B 138 7.133 17.533 9.309 1.00 0.77 C ATOM 0 H THR B 138 8.905 15.204 11.457 1.00 0.69 H new ATOM 0 HA THR B 138 9.073 18.128 11.172 1.00 0.70 H new ATOM 0 HB THR B 138 6.752 18.433 11.204 1.00 0.73 H new ATOM 0 HG1 THR B 138 5.304 16.788 11.264 1.00 0.78 H new ATOM 0 HG21 THR B 138 6.124 17.689 8.928 1.00 0.77 H new ATOM 0 HG22 THR B 138 7.772 18.357 8.992 1.00 0.77 H new ATOM 0 HG23 THR B 138 7.528 16.596 8.917 1.00 0.77 H new ATOM 1732 N ALA B 139 7.958 18.185 13.671 1.00 0.79 N ATOM 1733 CA ALA B 139 7.860 18.087 15.131 1.00 0.88 C ATOM 1734 C ALA B 139 6.905 16.964 15.513 1.00 0.83 C ATOM 1735 O ALA B 139 7.153 16.225 16.465 1.00 0.87 O ATOM 1736 CB ALA B 139 7.420 19.422 15.719 1.00 1.04 C ATOM 0 H ALA B 139 7.657 19.076 13.276 1.00 0.79 H new ATOM 0 HA ALA B 139 8.840 17.850 15.545 1.00 0.88 H new ATOM 0 HB1 ALA B 139 7.351 19.337 16.803 1.00 1.04 H new ATOM 0 HB2 ALA B 139 8.148 20.191 15.461 1.00 1.04 H new ATOM 0 HB3 ALA B 139 6.446 19.695 15.314 1.00 1.04 H new ATOM 1742 N GLU B 140 5.797 16.856 14.783 1.00 0.79 N ATOM 1743 CA GLU B 140 4.799 15.817 15.046 1.00 0.79 C ATOM 1744 C GLU B 140 5.428 14.415 14.991 1.00 0.73 C ATOM 1745 O GLU B 140 4.896 13.454 15.540 1.00 0.79 O ATOM 1746 CB GLU B 140 3.681 15.907 13.998 1.00 0.83 C ATOM 1747 CG GLU B 140 3.117 17.309 13.817 1.00 1.27 C ATOM 1748 CD GLU B 140 2.572 17.546 12.419 1.00 1.55 C ATOM 1749 OE1 GLU B 140 3.294 17.254 11.442 1.00 2.31 O ATOM 1750 OE2 GLU B 140 1.425 18.027 12.303 1.00 1.90 O ATOM 0 H GLU B 140 5.566 17.474 14.005 1.00 0.79 H new ATOM 0 HA GLU B 140 4.396 15.977 16.046 1.00 0.79 H new ATOM 0 HB2 GLU B 140 4.064 15.554 13.041 1.00 0.83 H new ATOM 0 HB3 GLU B 140 2.872 15.235 14.285 1.00 0.83 H new ATOM 0 HG2 GLU B 140 2.322 17.473 14.545 1.00 1.27 H new ATOM 0 HG3 GLU B 140 3.898 18.040 14.027 1.00 1.27 H new ATOM 1757 N ALA B 141 6.587 14.348 14.352 1.00 0.69 N ATOM 1758 CA ALA B 141 7.331 13.114 14.214 1.00 0.70 C ATOM 1759 C ALA B 141 8.161 12.866 15.457 1.00 0.77 C ATOM 1760 O ALA B 141 8.523 11.737 15.739 1.00 0.87 O ATOM 1761 CB ALA B 141 8.193 13.119 12.961 1.00 0.75 C ATOM 0 H ALA B 141 7.035 15.153 13.915 1.00 0.69 H new ATOM 0 HA ALA B 141 6.620 12.295 14.105 1.00 0.70 H new ATOM 0 HB1 ALA B 141 8.737 12.177 12.890 1.00 0.75 H new ATOM 0 HB2 ALA B 141 7.558 13.238 12.083 1.00 0.75 H new ATOM 0 HB3 ALA B 141 8.902 13.945 13.011 1.00 0.75 H new ATOM 1767 N LEU B 142 8.434 13.920 16.235 1.00 0.80 N ATOM 1768 CA LEU B 142 9.189 13.769 17.486 1.00 0.93 C ATOM 1769 C LEU B 142 8.508 12.705 18.358 1.00 1.06 C ATOM 1770 O LEU B 142 9.156 11.852 18.974 1.00 1.24 O ATOM 1771 CB LEU B 142 9.252 15.105 18.235 1.00 0.97 C ATOM 1772 CG LEU B 142 10.444 15.996 17.881 1.00 1.01 C ATOM 1773 CD1 LEU B 142 10.004 17.446 17.735 1.00 1.11 C ATOM 1774 CD2 LEU B 142 11.532 15.874 18.936 1.00 1.14 C ATOM 0 H LEU B 142 8.148 14.876 16.025 1.00 0.80 H new ATOM 0 HA LEU B 142 10.208 13.456 17.258 1.00 0.93 H new ATOM 0 HB2 LEU B 142 8.334 15.658 18.036 1.00 0.97 H new ATOM 0 HB3 LEU B 142 9.276 14.902 19.306 1.00 0.97 H new ATOM 0 HG LEU B 142 10.850 15.662 16.926 1.00 1.01 H new ATOM 0 HD11 LEU B 142 10.866 18.064 17.483 1.00 1.11 H new ATOM 0 HD12 LEU B 142 9.259 17.522 16.943 1.00 1.11 H new ATOM 0 HD13 LEU B 142 9.572 17.791 18.674 1.00 1.11 H new ATOM 0 HD21 LEU B 142 12.372 16.515 18.668 1.00 1.14 H new ATOM 0 HD22 LEU B 142 11.136 16.181 19.904 1.00 1.14 H new ATOM 0 HD23 LEU B 142 11.869 14.839 18.993 1.00 1.14 H new ATOM 1786 N ARG B 143 7.180 12.747 18.346 1.00 1.06 N ATOM 1787 CA ARG B 143 6.368 11.785 19.072 1.00 1.26 C ATOM 1788 C ARG B 143 6.518 10.402 18.450 1.00 1.27 C ATOM 1789 O ARG B 143 6.071 9.410 19.031 1.00 1.49 O ATOM 1790 CB ARG B 143 4.881 12.208 19.019 1.00 1.35 C ATOM 1791 CG ARG B 143 3.893 11.222 19.657 1.00 1.36 C ATOM 1792 CD ARG B 143 3.382 10.178 18.665 1.00 1.50 C ATOM 1793 NE ARG B 143 3.655 8.812 19.117 1.00 1.90 N ATOM 1794 CZ ARG B 143 3.418 7.721 18.392 1.00 2.20 C ATOM 1795 NH1 ARG B 143 2.726 7.795 17.263 1.00 2.36 N ATOM 1796 NH2 ARG B 143 3.858 6.543 18.815 1.00 2.93 N ATOM 0 H ARG B 143 6.641 13.446 17.835 1.00 1.06 H new ATOM 0 HA ARG B 143 6.703 11.754 20.109 1.00 1.26 H new ATOM 0 HB2 ARG B 143 4.777 13.173 19.516 1.00 1.35 H new ATOM 0 HB3 ARG B 143 4.599 12.355 17.976 1.00 1.35 H new ATOM 0 HG2 ARG B 143 4.378 10.717 20.493 1.00 1.36 H new ATOM 0 HG3 ARG B 143 3.047 11.774 20.066 1.00 1.36 H new ATOM 0 HD2 ARG B 143 2.309 10.306 18.525 1.00 1.50 H new ATOM 0 HD3 ARG B 143 3.852 10.339 17.695 1.00 1.50 H new ATOM 0 HE ARG B 143 4.053 8.689 20.048 1.00 1.90 H new ATOM 0 HH11 ARG B 143 2.369 8.695 16.942 1.00 2.36 H new ATOM 0 HH12 ARG B 143 2.551 6.952 16.716 1.00 2.36 H new ATOM 0 HH21 ARG B 143 4.375 6.477 19.692 1.00 2.93 H new ATOM 0 HH22 ARG B 143 3.679 5.704 18.263 1.00 2.93 H new ATOM 1810 N CYS B 144 7.262 10.273 17.341 1.00 1.10 N ATOM 1811 CA CYS B 144 7.510 8.960 16.748 1.00 1.17 C ATOM 1812 C CYS B 144 8.691 8.269 17.424 1.00 1.44 C ATOM 1813 O CYS B 144 9.175 7.249 16.943 1.00 1.61 O ATOM 1814 CB CYS B 144 7.836 9.138 15.258 1.00 1.05 C ATOM 1815 SG CYS B 144 6.648 8.394 14.089 1.00 1.26 S ATOM 0 H CYS B 144 7.695 11.053 16.846 1.00 1.10 H new ATOM 0 HA CYS B 144 6.618 8.347 16.881 1.00 1.17 H new ATOM 0 HB2 CYS B 144 7.906 10.205 15.046 1.00 1.05 H new ATOM 0 HB3 CYS B 144 8.820 8.710 15.067 1.00 1.05 H new ATOM 1820 N GLN B 145 9.032 8.745 18.606 1.00 1.58 N ATOM 1821 CA GLN B 145 10.077 8.097 19.393 1.00 1.89 C ATOM 1822 C GLN B 145 9.503 6.857 20.059 1.00 2.14 C ATOM 1823 O GLN B 145 10.210 5.873 20.316 1.00 2.40 O ATOM 1824 CB GLN B 145 10.696 9.034 20.432 1.00 2.00 C ATOM 1825 CG GLN B 145 12.066 8.572 20.916 1.00 2.43 C ATOM 1826 CD GLN B 145 13.195 9.472 20.445 1.00 2.77 C ATOM 1827 OE1 GLN B 145 13.948 9.121 19.535 1.00 3.35 O ATOM 1828 NE2 GLN B 145 13.321 10.638 21.066 1.00 3.05 N ATOM 0 H GLN B 145 8.611 9.565 19.042 1.00 1.58 H new ATOM 0 HA GLN B 145 10.884 7.815 18.716 1.00 1.89 H new ATOM 0 HB2 GLN B 145 10.787 10.032 20.003 1.00 2.00 H new ATOM 0 HB3 GLN B 145 10.024 9.114 21.286 1.00 2.00 H new ATOM 0 HG2 GLN B 145 12.067 8.536 22.005 1.00 2.43 H new ATOM 0 HG3 GLN B 145 12.247 7.557 20.563 1.00 2.43 H new ATOM 0 HE21 GLN B 145 12.676 10.889 21.815 1.00 3.05 H new ATOM 0 HE22 GLN B 145 14.063 11.283 20.795 1.00 3.05 H new ATOM 1837 N GLU B 146 8.193 6.883 20.301 1.00 2.12 N ATOM 1838 CA GLU B 146 7.537 5.744 20.921 1.00 2.41 C ATOM 1839 C GLU B 146 7.164 4.700 19.873 1.00 2.40 C ATOM 1840 O GLU B 146 6.603 3.653 20.199 1.00 2.57 O ATOM 1841 CB GLU B 146 6.292 6.203 21.679 1.00 2.47 C ATOM 1842 CG GLU B 146 6.602 7.118 22.852 1.00 2.88 C ATOM 1843 CD GLU B 146 5.433 8.010 23.222 1.00 3.26 C ATOM 1844 OE1 GLU B 146 5.111 8.922 22.431 1.00 3.76 O ATOM 1845 OE2 GLU B 146 4.841 7.797 24.300 1.00 3.59 O ATOM 0 H GLU B 146 7.579 7.667 20.080 1.00 2.12 H new ATOM 0 HA GLU B 146 8.231 5.287 21.626 1.00 2.41 H new ATOM 0 HB2 GLU B 146 5.627 6.722 20.989 1.00 2.47 H new ATOM 0 HB3 GLU B 146 5.754 5.328 22.043 1.00 2.47 H new ATOM 0 HG2 GLU B 146 6.880 6.514 23.715 1.00 2.88 H new ATOM 0 HG3 GLU B 146 7.464 7.738 22.606 1.00 2.88 H new ATOM 1852 N GLU B 147 7.544 4.958 18.621 1.00 2.27 N ATOM 1853 CA GLU B 147 7.297 4.012 17.546 1.00 2.36 C ATOM 1854 C GLU B 147 8.378 2.930 17.556 1.00 2.40 C ATOM 1855 O GLU B 147 8.384 2.035 16.710 1.00 2.48 O ATOM 1856 CB GLU B 147 7.284 4.729 16.194 1.00 2.40 C ATOM 1857 CG GLU B 147 6.528 3.975 15.111 1.00 2.97 C ATOM 1858 CD GLU B 147 7.449 3.378 14.064 1.00 3.47 C ATOM 1859 OE1 GLU B 147 8.182 4.149 13.410 1.00 3.71 O ATOM 1860 OE2 GLU B 147 7.436 2.141 13.900 1.00 4.01 O ATOM 0 H GLU B 147 8.022 5.812 18.333 1.00 2.27 H new ATOM 0 HA GLU B 147 6.322 3.549 17.700 1.00 2.36 H new ATOM 0 HB2 GLU B 147 6.835 5.714 16.319 1.00 2.40 H new ATOM 0 HB3 GLU B 147 8.311 4.886 15.866 1.00 2.40 H new ATOM 0 HG2 GLU B 147 5.941 3.179 15.570 1.00 2.97 H new ATOM 0 HG3 GLU B 147 5.824 4.651 14.627 1.00 2.97 H new ATOM 1867 N ASN B 148 9.279 3.010 18.541 1.00 2.59 N ATOM 1868 CA ASN B 148 10.344 2.034 18.688 1.00 3.03 C ATOM 1869 C ASN B 148 9.923 0.948 19.678 1.00 3.37 C ATOM 1870 O ASN B 148 10.400 -0.186 19.608 1.00 3.85 O ATOM 1871 CB ASN B 148 11.628 2.714 19.167 1.00 3.19 C ATOM 1872 CG ASN B 148 12.872 1.920 18.821 1.00 3.48 C ATOM 1873 OD1 ASN B 148 13.115 1.601 17.656 1.00 3.92 O ATOM 1874 ND2 ASN B 148 13.670 1.597 19.833 1.00 3.79 N ATOM 0 H ASN B 148 9.285 3.747 19.247 1.00 2.59 H new ATOM 0 HA ASN B 148 10.535 1.575 17.718 1.00 3.03 H new ATOM 0 HB2 ASN B 148 11.698 3.706 18.720 1.00 3.19 H new ATOM 0 HB3 ASN B 148 11.580 2.854 20.247 1.00 3.19 H new ATOM 0 HD21 ASN B 148 14.522 1.064 19.660 1.00 3.79 H new ATOM 0 HD22 ASN B 148 13.430 1.882 20.783 1.00 3.79 H new ATOM 1881 N TYR B 149 9.029 1.303 20.605 1.00 3.23 N ATOM 1882 CA TYR B 149 8.555 0.353 21.608 1.00 3.61 C ATOM 1883 C TYR B 149 7.089 -0.034 21.381 1.00 3.72 C ATOM 1884 O TYR B 149 6.475 -0.677 22.233 1.00 4.14 O ATOM 1885 CB TYR B 149 8.729 0.940 23.011 1.00 3.69 C ATOM 1886 CG TYR B 149 10.157 1.322 23.334 1.00 4.04 C ATOM 1887 CD1 TYR B 149 11.114 0.351 23.602 1.00 4.26 C ATOM 1888 CD2 TYR B 149 10.548 2.655 23.371 1.00 4.59 C ATOM 1889 CE1 TYR B 149 12.419 0.696 23.897 1.00 4.76 C ATOM 1890 CE2 TYR B 149 11.851 3.009 23.665 1.00 5.11 C ATOM 1891 CZ TYR B 149 12.782 2.027 23.928 1.00 5.09 C ATOM 1892 OH TYR B 149 14.081 2.375 24.221 1.00 5.73 O ATOM 0 H TYR B 149 8.623 2.236 20.680 1.00 3.23 H new ATOM 0 HA TYR B 149 9.155 -0.552 21.513 1.00 3.61 H new ATOM 0 HB2 TYR B 149 8.095 1.821 23.108 1.00 3.69 H new ATOM 0 HB3 TYR B 149 8.381 0.214 23.746 1.00 3.69 H new ATOM 0 HD1 TYR B 149 10.833 -0.692 23.579 1.00 4.26 H new ATOM 0 HD2 TYR B 149 9.821 3.427 23.167 1.00 4.59 H new ATOM 0 HE1 TYR B 149 13.151 -0.071 24.102 1.00 4.76 H new ATOM 0 HE2 TYR B 149 12.139 4.050 23.689 1.00 5.11 H new ATOM 0 HH TYR B 149 14.171 3.351 24.201 1.00 5.73 H new ATOM 1902 N LEU B 150 6.531 0.359 20.236 1.00 3.60 N ATOM 1903 CA LEU B 150 5.138 0.042 19.921 1.00 3.76 C ATOM 1904 C LEU B 150 4.952 -0.215 18.419 1.00 3.71 C ATOM 1905 O LEU B 150 4.512 0.671 17.686 1.00 3.86 O ATOM 1906 CB LEU B 150 4.221 1.184 20.375 1.00 4.10 C ATOM 1907 CG LEU B 150 3.109 0.776 21.346 1.00 4.74 C ATOM 1908 CD1 LEU B 150 3.106 1.682 22.568 1.00 4.91 C ATOM 1909 CD2 LEU B 150 1.756 0.813 20.653 1.00 5.46 C ATOM 0 H LEU B 150 7.018 0.893 19.516 1.00 3.60 H new ATOM 0 HA LEU B 150 4.871 -0.869 20.457 1.00 3.76 H new ATOM 0 HB2 LEU B 150 4.831 1.953 20.848 1.00 4.10 H new ATOM 0 HB3 LEU B 150 3.765 1.636 19.494 1.00 4.10 H new ATOM 0 HG LEU B 150 3.300 -0.245 21.676 1.00 4.74 H new ATOM 0 HD11 LEU B 150 2.309 1.376 23.246 1.00 4.91 H new ATOM 0 HD12 LEU B 150 4.066 1.607 23.079 1.00 4.91 H new ATOM 0 HD13 LEU B 150 2.941 2.713 22.256 1.00 4.91 H new ATOM 0 HD21 LEU B 150 0.978 0.520 21.358 1.00 5.46 H new ATOM 0 HD22 LEU B 150 1.559 1.823 20.294 1.00 5.46 H new ATOM 0 HD23 LEU B 150 1.760 0.122 19.810 1.00 5.46 H new ATOM 1921 N PRO B 151 5.292 -1.431 17.932 1.00 3.97 N ATOM 1922 CA PRO B 151 5.168 -1.787 16.523 1.00 4.33 C ATOM 1923 C PRO B 151 3.857 -2.512 16.207 1.00 4.40 C ATOM 1924 O PRO B 151 3.858 -3.580 15.595 1.00 4.80 O ATOM 1925 CB PRO B 151 6.360 -2.721 16.335 1.00 4.97 C ATOM 1926 CG PRO B 151 6.518 -3.419 17.653 1.00 5.02 C ATOM 1927 CD PRO B 151 5.840 -2.562 18.703 1.00 4.41 C ATOM 0 HA PRO B 151 5.158 -0.918 15.866 1.00 4.33 H new ATOM 0 HB2 PRO B 151 6.180 -3.434 15.530 1.00 4.97 H new ATOM 0 HB3 PRO B 151 7.260 -2.165 16.073 1.00 4.97 H new ATOM 0 HG2 PRO B 151 6.068 -4.411 17.618 1.00 5.02 H new ATOM 0 HG3 PRO B 151 7.573 -3.555 17.891 1.00 5.02 H new ATOM 0 HD2 PRO B 151 5.054 -3.111 19.221 1.00 4.41 H new ATOM 0 HD3 PRO B 151 6.546 -2.225 19.461 1.00 4.41 H new ATOM 1935 N SER B 152 2.741 -1.930 16.640 1.00 4.26 N ATOM 1936 CA SER B 152 1.425 -2.527 16.413 1.00 4.43 C ATOM 1937 C SER B 152 0.865 -2.173 15.028 1.00 3.85 C ATOM 1938 O SER B 152 0.629 -1.002 14.734 1.00 3.52 O ATOM 1939 CB SER B 152 0.449 -2.058 17.495 1.00 4.91 C ATOM 1940 OG SER B 152 0.885 -2.451 18.784 1.00 5.73 O ATOM 0 H SER B 152 2.720 -1.047 17.150 1.00 4.26 H new ATOM 0 HA SER B 152 1.543 -3.610 16.459 1.00 4.43 H new ATOM 0 HB2 SER B 152 0.353 -0.973 17.456 1.00 4.91 H new ATOM 0 HB3 SER B 152 -0.540 -2.473 17.301 1.00 4.91 H new ATOM 0 HG SER B 152 0.244 -2.137 19.456 1.00 5.73 H new ATOM 1946 N PRO B 153 0.625 -3.184 14.157 1.00 4.04 N ATOM 1947 CA PRO B 153 0.072 -2.954 12.817 1.00 3.79 C ATOM 1948 C PRO B 153 -1.447 -2.796 12.856 1.00 2.92 C ATOM 1949 O PRO B 153 -2.149 -3.687 13.326 1.00 3.04 O ATOM 1950 CB PRO B 153 0.462 -4.226 12.070 1.00 4.60 C ATOM 1951 CG PRO B 153 0.441 -5.290 13.116 1.00 5.10 C ATOM 1952 CD PRO B 153 0.854 -4.626 14.408 1.00 4.86 C ATOM 0 HA PRO B 153 0.445 -2.040 12.354 1.00 3.79 H new ATOM 0 HB2 PRO B 153 -0.240 -4.446 11.265 1.00 4.60 H new ATOM 0 HB3 PRO B 153 1.449 -4.134 11.616 1.00 4.60 H new ATOM 0 HG2 PRO B 153 -0.553 -5.728 13.205 1.00 5.10 H new ATOM 0 HG3 PRO B 153 1.124 -6.100 12.860 1.00 5.10 H new ATOM 0 HD2 PRO B 153 0.260 -4.984 15.249 1.00 4.86 H new ATOM 0 HD3 PRO B 153 1.898 -4.829 14.646 1.00 4.86 H new ATOM 1960 N CYS B 154 -1.947 -1.656 12.379 1.00 2.52 N ATOM 1961 CA CYS B 154 -3.387 -1.385 12.389 1.00 1.97 C ATOM 1962 C CYS B 154 -3.937 -1.134 10.977 1.00 2.15 C ATOM 1963 O CYS B 154 -3.300 -1.482 9.983 1.00 2.65 O ATOM 1964 CB CYS B 154 -3.668 -0.178 13.294 1.00 2.30 C ATOM 1965 SG CYS B 154 -3.341 1.445 12.536 1.00 2.68 S ATOM 0 H CYS B 154 -1.380 -0.907 11.982 1.00 2.52 H new ATOM 0 HA CYS B 154 -3.896 -2.267 12.777 1.00 1.97 H new ATOM 0 HB2 CYS B 154 -4.712 -0.213 13.607 1.00 2.30 H new ATOM 0 HB3 CYS B 154 -3.062 -0.270 14.195 1.00 2.30 H new ATOM 1970 N GLN B 155 -5.119 -0.499 10.903 1.00 2.16 N ATOM 1971 CA GLN B 155 -5.718 -0.182 9.600 1.00 2.64 C ATOM 1972 C GLN B 155 -4.799 0.748 8.791 1.00 2.19 C ATOM 1973 O GLN B 155 -4.404 1.810 9.274 1.00 2.43 O ATOM 1974 CB GLN B 155 -7.090 0.476 9.784 1.00 3.40 C ATOM 1975 CG GLN B 155 -7.040 1.818 10.499 1.00 4.33 C ATOM 1976 CD GLN B 155 -7.236 2.991 9.557 1.00 5.12 C ATOM 1977 OE1 GLN B 155 -6.560 3.100 8.535 1.00 5.61 O ATOM 1978 NE2 GLN B 155 -8.165 3.878 9.899 1.00 5.63 N ATOM 0 H GLN B 155 -5.666 -0.202 11.711 1.00 2.16 H new ATOM 0 HA GLN B 155 -5.844 -1.115 9.051 1.00 2.64 H new ATOM 0 HB2 GLN B 155 -7.550 0.614 8.805 1.00 3.40 H new ATOM 0 HB3 GLN B 155 -7.734 -0.200 10.346 1.00 3.40 H new ATOM 0 HG2 GLN B 155 -7.811 1.843 11.270 1.00 4.33 H new ATOM 0 HG3 GLN B 155 -6.080 1.920 11.005 1.00 4.33 H new ATOM 0 HE21 GLN B 155 -8.703 3.749 10.756 1.00 5.63 H new ATOM 0 HE22 GLN B 155 -8.340 4.688 9.304 1.00 5.63 H new ATOM 1987 N SER B 156 -4.456 0.345 7.561 1.00 2.21 N ATOM 1988 CA SER B 156 -3.580 1.152 6.707 1.00 2.03 C ATOM 1989 C SER B 156 -3.874 0.895 5.226 1.00 1.77 C ATOM 1990 O SER B 156 -4.966 0.435 4.883 1.00 2.17 O ATOM 1991 CB SER B 156 -2.114 0.861 7.033 1.00 2.58 C ATOM 1992 OG SER B 156 -1.706 1.565 8.193 1.00 3.11 O ATOM 0 H SER B 156 -4.770 -0.529 7.139 1.00 2.21 H new ATOM 0 HA SER B 156 -3.776 2.206 6.905 1.00 2.03 H new ATOM 0 HB2 SER B 156 -1.976 -0.210 7.185 1.00 2.58 H new ATOM 0 HB3 SER B 156 -1.486 1.147 6.189 1.00 2.58 H new ATOM 0 HG SER B 156 -0.976 2.177 7.964 1.00 3.11 H new ATOM 1998 N GLY B 157 -2.897 1.138 4.341 1.00 1.55 N ATOM 1999 CA GLY B 157 -3.098 0.887 2.937 1.00 1.82 C ATOM 2000 C GLY B 157 -1.987 0.022 2.402 1.00 1.65 C ATOM 2001 O GLY B 157 -0.811 0.263 2.688 1.00 2.07 O ATOM 0 H GLY B 157 -1.976 1.504 4.584 1.00 1.55 H new ATOM 0 HA2 GLY B 157 -4.059 0.396 2.781 1.00 1.82 H new ATOM 0 HA3 GLY B 157 -3.130 1.830 2.392 1.00 1.82 H new ATOM 2005 N GLN B 158 -2.348 -0.981 1.623 1.00 1.33 N ATOM 2006 CA GLN B 158 -1.356 -1.866 1.059 1.00 1.42 C ATOM 2007 C GLN B 158 -1.257 -1.621 -0.429 1.00 1.04 C ATOM 2008 O GLN B 158 -1.616 -2.459 -1.256 1.00 0.95 O ATOM 2009 CB GLN B 158 -1.742 -3.326 1.335 1.00 1.93 C ATOM 2010 CG GLN B 158 -0.554 -4.230 1.618 1.00 2.76 C ATOM 2011 CD GLN B 158 -0.654 -4.918 2.967 1.00 3.57 C ATOM 2012 OE1 GLN B 158 0.012 -4.528 3.925 1.00 3.89 O ATOM 2013 NE2 GLN B 158 -1.486 -5.950 3.047 1.00 4.34 N ATOM 0 H GLN B 158 -3.312 -1.199 1.370 1.00 1.33 H new ATOM 0 HA GLN B 158 -0.387 -1.671 1.519 1.00 1.42 H new ATOM 0 HB2 GLN B 158 -2.422 -3.358 2.186 1.00 1.93 H new ATOM 0 HB3 GLN B 158 -2.288 -3.717 0.476 1.00 1.93 H new ATOM 0 HG2 GLN B 158 -0.481 -4.984 0.834 1.00 2.76 H new ATOM 0 HG3 GLN B 158 0.363 -3.642 1.581 1.00 2.76 H new ATOM 0 HE21 GLN B 158 -2.019 -6.240 2.227 1.00 4.34 H new ATOM 0 HE22 GLN B 158 -1.592 -6.453 3.928 1.00 4.34 H new ATOM 2022 N LYS B 159 -0.758 -0.446 -0.744 1.00 1.15 N ATOM 2023 CA LYS B 159 -0.519 -0.033 -2.111 1.00 1.13 C ATOM 2024 C LYS B 159 0.980 0.108 -2.377 1.00 0.95 C ATOM 2025 O LYS B 159 1.460 1.239 -2.503 1.00 0.91 O ATOM 2026 CB LYS B 159 -1.286 1.237 -2.425 1.00 1.54 C ATOM 2027 CG LYS B 159 -2.287 1.061 -3.556 1.00 1.91 C ATOM 2028 CD LYS B 159 -1.969 1.986 -4.716 1.00 2.18 C ATOM 2029 CE LYS B 159 -2.623 1.515 -6.004 1.00 2.81 C ATOM 2030 NZ LYS B 159 -2.156 2.302 -7.179 1.00 3.54 N ATOM 0 H LYS B 159 -0.504 0.258 -0.051 1.00 1.15 H new ATOM 0 HA LYS B 159 -0.890 -0.805 -2.785 1.00 1.13 H new ATOM 0 HB2 LYS B 159 -1.812 1.568 -1.530 1.00 1.54 H new ATOM 0 HB3 LYS B 159 -0.581 2.025 -2.690 1.00 1.54 H new ATOM 0 HG2 LYS B 159 -2.275 0.026 -3.898 1.00 1.91 H new ATOM 0 HG3 LYS B 159 -3.293 1.264 -3.190 1.00 1.91 H new ATOM 0 HD2 LYS B 159 -2.310 2.994 -4.482 1.00 2.18 H new ATOM 0 HD3 LYS B 159 -0.889 2.039 -4.854 1.00 2.18 H new ATOM 0 HE2 LYS B 159 -2.400 0.460 -6.161 1.00 2.81 H new ATOM 0 HE3 LYS B 159 -3.706 1.602 -5.915 1.00 2.81 H new ATOM 0 HZ1 LYS B 159 -2.977 2.618 -7.734 1.00 3.54 H new ATOM 0 HZ2 LYS B 159 -1.620 3.131 -6.851 1.00 3.54 H new ATOM 0 HZ3 LYS B 159 -1.544 1.708 -7.774 1.00 3.54 H new ATOM 2044 N PRO B 160 1.760 -0.983 -2.415 1.00 1.05 N ATOM 2045 CA PRO B 160 3.205 -0.884 -2.614 1.00 1.14 C ATOM 2046 C PRO B 160 3.606 -0.330 -3.972 1.00 1.10 C ATOM 2047 O PRO B 160 4.039 -1.056 -4.868 1.00 1.23 O ATOM 2048 CB PRO B 160 3.706 -2.311 -2.456 1.00 1.46 C ATOM 2049 CG PRO B 160 2.514 -3.163 -2.721 1.00 1.51 C ATOM 2050 CD PRO B 160 1.331 -2.376 -2.224 1.00 1.27 C ATOM 0 HA PRO B 160 3.637 -0.183 -1.900 1.00 1.14 H new ATOM 0 HB2 PRO B 160 4.511 -2.528 -3.158 1.00 1.46 H new ATOM 0 HB3 PRO B 160 4.101 -2.483 -1.455 1.00 1.46 H new ATOM 0 HG2 PRO B 160 2.419 -3.383 -3.784 1.00 1.51 H new ATOM 0 HG3 PRO B 160 2.593 -4.119 -2.203 1.00 1.51 H new ATOM 0 HD2 PRO B 160 0.428 -2.602 -2.791 1.00 1.27 H new ATOM 0 HD3 PRO B 160 1.113 -2.592 -1.178 1.00 1.27 H new ATOM 2058 N CYS B 161 3.518 0.974 -4.069 1.00 1.09 N ATOM 2059 CA CYS B 161 3.920 1.702 -5.253 1.00 1.15 C ATOM 2060 C CYS B 161 5.371 2.137 -5.030 1.00 1.37 C ATOM 2061 O CYS B 161 5.982 1.713 -4.042 1.00 1.58 O ATOM 2062 CB CYS B 161 2.934 2.849 -5.589 1.00 1.32 C ATOM 2063 SG CYS B 161 3.359 4.518 -4.984 1.00 1.58 S ATOM 0 H CYS B 161 3.161 1.569 -3.321 1.00 1.09 H new ATOM 0 HA CYS B 161 3.880 1.079 -6.146 1.00 1.15 H new ATOM 0 HB2 CYS B 161 2.830 2.899 -6.673 1.00 1.32 H new ATOM 0 HB3 CYS B 161 1.956 2.583 -5.187 1.00 1.32 H new ATOM 2068 N GLY B 162 5.907 3.009 -5.870 1.00 1.57 N ATOM 2069 CA GLY B 162 7.262 3.467 -5.633 1.00 1.88 C ATOM 2070 C GLY B 162 8.292 2.342 -5.641 1.00 2.05 C ATOM 2071 O GLY B 162 8.045 1.240 -6.132 1.00 2.37 O ATOM 0 H GLY B 162 5.444 3.400 -6.691 1.00 1.57 H new ATOM 0 HA2 GLY B 162 7.529 4.199 -6.395 1.00 1.88 H new ATOM 0 HA3 GLY B 162 7.302 3.979 -4.672 1.00 1.88 H new ATOM 2075 N SER B 163 9.459 2.676 -5.137 1.00 2.40 N ATOM 2076 CA SER B 163 10.645 1.786 -5.078 1.00 2.93 C ATOM 2077 C SER B 163 10.633 0.954 -3.815 1.00 2.71 C ATOM 2078 O SER B 163 11.638 0.758 -3.133 1.00 3.29 O ATOM 2079 CB SER B 163 11.939 2.607 -5.127 1.00 3.81 C ATOM 2080 OG SER B 163 12.283 2.950 -6.457 1.00 4.07 O ATOM 0 H SER B 163 9.636 3.598 -4.739 1.00 2.40 H new ATOM 0 HA SER B 163 10.603 1.123 -5.942 1.00 2.93 H new ATOM 0 HB2 SER B 163 11.819 3.514 -4.535 1.00 3.81 H new ATOM 0 HB3 SER B 163 12.751 2.037 -4.675 1.00 3.81 H new ATOM 0 HG SER B 163 13.111 3.474 -6.456 1.00 4.07 H new ATOM 2086 N GLY B 164 9.403 0.468 -3.525 1.00 2.12 N ATOM 2087 CA GLY B 164 9.106 -0.343 -2.371 1.00 2.11 C ATOM 2088 C GLY B 164 8.086 0.274 -1.378 1.00 1.92 C ATOM 2089 O GLY B 164 7.934 -0.287 -0.290 1.00 2.20 O ATOM 0 H GLY B 164 8.588 0.645 -4.113 1.00 2.12 H new ATOM 0 HA2 GLY B 164 8.722 -1.305 -2.711 1.00 2.11 H new ATOM 0 HA3 GLY B 164 10.035 -0.541 -1.837 1.00 2.11 H new ATOM 2093 N GLY B 165 7.444 1.412 -1.672 1.00 1.61 N ATOM 2094 CA GLY B 165 6.539 1.981 -0.660 1.00 1.60 C ATOM 2095 C GLY B 165 5.043 1.765 -0.878 1.00 1.42 C ATOM 2096 O GLY B 165 4.510 2.077 -1.942 1.00 1.62 O ATOM 0 H GLY B 165 7.523 1.932 -2.546 1.00 1.61 H new ATOM 0 HA2 GLY B 165 6.806 1.561 0.310 1.00 1.60 H new ATOM 0 HA3 GLY B 165 6.723 3.054 -0.604 1.00 1.60 H new ATOM 2100 N ARG B 166 4.362 1.276 0.173 1.00 1.16 N ATOM 2101 CA ARG B 166 2.905 1.069 0.148 1.00 1.03 C ATOM 2102 C ARG B 166 2.217 2.337 0.654 1.00 0.95 C ATOM 2103 O ARG B 166 2.835 3.114 1.382 1.00 1.04 O ATOM 2104 CB ARG B 166 2.467 -0.160 0.972 1.00 1.08 C ATOM 2105 CG ARG B 166 2.929 -0.241 2.442 1.00 1.23 C ATOM 2106 CD ARG B 166 3.731 0.962 2.940 1.00 1.39 C ATOM 2107 NE ARG B 166 3.905 0.927 4.396 1.00 1.79 N ATOM 2108 CZ ARG B 166 5.087 0.875 5.012 1.00 2.31 C ATOM 2109 NH1 ARG B 166 6.215 0.869 4.312 1.00 2.54 N ATOM 2110 NH2 ARG B 166 5.142 0.826 6.337 1.00 3.05 N ATOM 0 H ARG B 166 4.802 1.015 1.056 1.00 1.16 H new ATOM 0 HA ARG B 166 2.606 0.867 -0.881 1.00 1.03 H new ATOM 0 HB2 ARG B 166 1.378 -0.200 0.960 1.00 1.08 H new ATOM 0 HB3 ARG B 166 2.825 -1.053 0.459 1.00 1.08 H new ATOM 0 HG2 ARG B 166 2.050 -0.359 3.076 1.00 1.23 H new ATOM 0 HG3 ARG B 166 3.535 -1.138 2.567 1.00 1.23 H new ATOM 0 HD2 ARG B 166 4.708 0.975 2.456 1.00 1.39 H new ATOM 0 HD3 ARG B 166 3.222 1.883 2.655 1.00 1.39 H new ATOM 0 HE ARG B 166 3.066 0.944 4.976 1.00 1.79 H new ATOM 0 HH11 ARG B 166 6.183 0.904 3.293 1.00 2.54 H new ATOM 0 HH12 ARG B 166 7.114 0.829 4.793 1.00 2.54 H new ATOM 0 HH21 ARG B 166 4.281 0.828 6.884 1.00 3.05 H new ATOM 0 HH22 ARG B 166 6.045 0.786 6.809 1.00 3.05 H new ATOM 2124 N CYS B 167 0.957 2.577 0.265 1.00 0.87 N ATOM 2125 CA CYS B 167 0.267 3.761 0.683 1.00 0.88 C ATOM 2126 C CYS B 167 0.065 3.744 2.179 1.00 0.88 C ATOM 2127 O CYS B 167 -0.771 3.005 2.701 1.00 0.93 O ATOM 2128 CB CYS B 167 -1.069 3.888 -0.059 1.00 0.94 C ATOM 2129 SG CYS B 167 -0.889 4.324 -1.823 1.00 1.56 S ATOM 0 H CYS B 167 0.414 1.957 -0.336 1.00 0.87 H new ATOM 0 HA CYS B 167 0.872 4.633 0.434 1.00 0.88 H new ATOM 0 HB2 CYS B 167 -1.610 2.945 0.020 1.00 0.94 H new ATOM 0 HB3 CYS B 167 -1.678 4.646 0.434 1.00 0.94 H new ATOM 2134 N ALA B 168 0.815 4.592 2.859 1.00 0.90 N ATOM 2135 CA ALA B 168 0.694 4.706 4.306 1.00 0.95 C ATOM 2136 C ALA B 168 -0.366 5.755 4.625 1.00 0.96 C ATOM 2137 O ALA B 168 -0.857 5.867 5.748 1.00 1.04 O ATOM 2138 CB ALA B 168 2.037 5.045 4.930 1.00 0.96 C ATOM 0 H ALA B 168 1.510 5.209 2.439 1.00 0.90 H new ATOM 0 HA ALA B 168 0.383 3.753 4.734 1.00 0.95 H new ATOM 0 HB1 ALA B 168 1.926 5.126 6.011 1.00 0.96 H new ATOM 0 HB2 ALA B 168 2.755 4.259 4.697 1.00 0.96 H new ATOM 0 HB3 ALA B 168 2.395 5.994 4.530 1.00 0.96 H new ATOM 2144 N ALA B 169 -0.618 6.575 3.618 1.00 0.90 N ATOM 2145 CA ALA B 169 -1.553 7.697 3.735 1.00 0.94 C ATOM 2146 C ALA B 169 -2.030 8.158 2.361 1.00 0.91 C ATOM 2147 O ALA B 169 -1.417 7.839 1.344 1.00 0.87 O ATOM 2148 CB ALA B 169 -0.897 8.840 4.487 1.00 0.98 C ATOM 0 H ALA B 169 -0.186 6.488 2.698 1.00 0.90 H new ATOM 0 HA ALA B 169 -2.427 7.363 4.294 1.00 0.94 H new ATOM 0 HB1 ALA B 169 -1.598 9.671 4.570 1.00 0.98 H new ATOM 0 HB2 ALA B 169 -0.613 8.504 5.484 1.00 0.98 H new ATOM 0 HB3 ALA B 169 -0.008 9.168 3.948 1.00 0.98 H new ATOM 2154 N ALA B 170 -3.146 8.879 2.335 1.00 0.98 N ATOM 2155 CA ALA B 170 -3.730 9.352 1.082 1.00 1.00 C ATOM 2156 C ALA B 170 -2.779 10.222 0.253 1.00 1.04 C ATOM 2157 O ALA B 170 -2.383 11.309 0.671 1.00 1.25 O ATOM 2158 CB ALA B 170 -5.025 10.105 1.355 1.00 1.15 C ATOM 0 H ALA B 170 -3.667 9.150 3.169 1.00 0.98 H new ATOM 0 HA ALA B 170 -3.934 8.463 0.485 1.00 1.00 H new ATOM 0 HB1 ALA B 170 -5.450 10.452 0.413 1.00 1.15 H new ATOM 0 HB2 ALA B 170 -5.734 9.442 1.850 1.00 1.15 H new ATOM 0 HB3 ALA B 170 -4.820 10.961 1.998 1.00 1.15 H new ATOM 2164 N GLY B 171 -2.460 9.745 -0.949 1.00 1.15 N ATOM 2165 CA GLY B 171 -1.609 10.488 -1.862 1.00 1.28 C ATOM 2166 C GLY B 171 -0.144 10.546 -1.457 1.00 1.22 C ATOM 2167 O GLY B 171 0.593 11.437 -1.873 1.00 1.29 O ATOM 0 H GLY B 171 -2.781 8.846 -1.309 1.00 1.15 H new ATOM 0 HA2 GLY B 171 -1.681 10.038 -2.852 1.00 1.28 H new ATOM 0 HA3 GLY B 171 -1.990 11.506 -1.946 1.00 1.28 H new ATOM 2171 N ILE B 172 0.237 9.636 -0.592 1.00 1.13 N ATOM 2172 CA ILE B 172 1.607 9.579 -0.089 1.00 1.09 C ATOM 2173 C ILE B 172 2.078 8.125 0.082 1.00 1.02 C ATOM 2174 O ILE B 172 1.708 7.410 1.032 1.00 1.34 O ATOM 2175 CB ILE B 172 1.755 10.413 1.182 1.00 1.53 C ATOM 2176 CG1 ILE B 172 0.985 9.802 2.320 1.00 1.09 C ATOM 2177 CG2 ILE B 172 1.316 11.848 0.931 1.00 2.27 C ATOM 2178 CD1 ILE B 172 1.936 9.155 3.257 1.00 0.91 C ATOM 0 H ILE B 172 -0.380 8.917 -0.214 1.00 1.13 H new ATOM 0 HA ILE B 172 2.269 10.025 -0.831 1.00 1.09 H new ATOM 0 HB ILE B 172 2.808 10.424 1.464 1.00 1.53 H new ATOM 0 HG12 ILE B 172 0.409 10.568 2.839 1.00 1.09 H new ATOM 0 HG13 ILE B 172 0.273 9.069 1.941 1.00 1.09 H new ATOM 0 HG21 ILE B 172 1.428 12.428 1.847 1.00 2.27 H new ATOM 0 HG22 ILE B 172 1.934 12.285 0.147 1.00 2.27 H new ATOM 0 HG23 ILE B 172 0.272 11.860 0.619 1.00 2.27 H new ATOM 0 HD11 ILE B 172 1.385 8.710 4.085 1.00 0.91 H new ATOM 0 HD12 ILE B 172 2.492 8.378 2.732 1.00 0.91 H new ATOM 0 HD13 ILE B 172 2.631 9.901 3.643 1.00 0.91 H new ATOM 2190 N CYS B 173 2.883 7.693 -0.894 1.00 0.81 N ATOM 2191 CA CYS B 173 3.416 6.333 -0.944 1.00 1.04 C ATOM 2192 C CYS B 173 4.690 6.226 -0.124 1.00 1.06 C ATOM 2193 O CYS B 173 5.784 6.489 -0.621 1.00 1.19 O ATOM 2194 CB CYS B 173 3.725 5.968 -2.395 1.00 1.17 C ATOM 2195 SG CYS B 173 2.894 4.474 -3.011 1.00 1.94 S ATOM 0 H CYS B 173 3.182 8.280 -1.672 1.00 0.81 H new ATOM 0 HA CYS B 173 2.673 5.651 -0.531 1.00 1.04 H new ATOM 0 HB2 CYS B 173 3.446 6.808 -3.031 1.00 1.17 H new ATOM 0 HB3 CYS B 173 4.802 5.834 -2.498 1.00 1.17 H new ATOM 2200 N CYS B 174 4.541 5.856 1.138 1.00 0.97 N ATOM 2201 CA CYS B 174 5.682 5.742 2.027 1.00 0.99 C ATOM 2202 C CYS B 174 6.187 4.305 2.148 1.00 1.16 C ATOM 2203 O CYS B 174 5.439 3.339 1.975 1.00 1.35 O ATOM 2204 CB CYS B 174 5.323 6.296 3.405 1.00 1.12 C ATOM 2205 SG CYS B 174 4.947 8.082 3.400 1.00 1.26 S ATOM 0 H CYS B 174 3.644 5.631 1.567 1.00 0.97 H new ATOM 0 HA CYS B 174 6.493 6.328 1.595 1.00 0.99 H new ATOM 0 HB2 CYS B 174 4.461 5.753 3.792 1.00 1.12 H new ATOM 0 HB3 CYS B 174 6.151 6.110 4.089 1.00 1.12 H new ATOM 2210 N SER B 175 7.473 4.198 2.457 1.00 1.15 N ATOM 2211 CA SER B 175 8.146 2.918 2.629 1.00 1.38 C ATOM 2212 C SER B 175 8.912 2.935 3.950 1.00 1.29 C ATOM 2213 O SER B 175 8.863 3.931 4.673 1.00 1.12 O ATOM 2214 CB SER B 175 9.101 2.659 1.461 1.00 1.48 C ATOM 2215 OG SER B 175 9.989 3.749 1.277 1.00 2.00 O ATOM 0 H SER B 175 8.083 5.004 2.596 1.00 1.15 H new ATOM 0 HA SER B 175 7.408 2.116 2.647 1.00 1.38 H new ATOM 0 HB2 SER B 175 9.671 1.749 1.648 1.00 1.48 H new ATOM 0 HB3 SER B 175 8.528 2.494 0.548 1.00 1.48 H new ATOM 0 HG SER B 175 10.590 3.558 0.526 1.00 2.00 H new ATOM 2221 N PRO B 176 9.632 1.854 4.307 1.00 1.49 N ATOM 2222 CA PRO B 176 10.379 1.819 5.563 1.00 1.45 C ATOM 2223 C PRO B 176 11.686 2.601 5.465 1.00 1.20 C ATOM 2224 O PRO B 176 12.647 2.321 6.181 1.00 1.25 O ATOM 2225 CB PRO B 176 10.652 0.330 5.764 1.00 1.77 C ATOM 2226 CG PRO B 176 10.717 -0.230 4.383 1.00 1.90 C ATOM 2227 CD PRO B 176 9.773 0.596 3.543 1.00 1.81 C ATOM 0 HA PRO B 176 9.833 2.276 6.388 1.00 1.45 H new ATOM 0 HB2 PRO B 176 11.586 0.167 6.302 1.00 1.77 H new ATOM 0 HB3 PRO B 176 9.862 -0.143 6.347 1.00 1.77 H new ATOM 0 HG2 PRO B 176 11.733 -0.178 3.990 1.00 1.90 H new ATOM 0 HG3 PRO B 176 10.426 -1.280 4.376 1.00 1.90 H new ATOM 0 HD2 PRO B 176 10.177 0.776 2.547 1.00 1.81 H new ATOM 0 HD3 PRO B 176 8.813 0.097 3.412 1.00 1.81 H new ATOM 2235 N ASP B 177 11.702 3.595 4.575 1.00 1.01 N ATOM 2236 CA ASP B 177 12.878 4.435 4.383 1.00 0.92 C ATOM 2237 C ASP B 177 12.484 5.877 4.033 1.00 0.83 C ATOM 2238 O ASP B 177 13.109 6.826 4.509 1.00 0.90 O ATOM 2239 CB ASP B 177 13.781 3.853 3.293 1.00 1.18 C ATOM 2240 CG ASP B 177 13.047 3.628 1.986 1.00 1.96 C ATOM 2241 OD1 ASP B 177 12.925 4.592 1.202 1.00 2.72 O ATOM 2242 OD2 ASP B 177 12.595 2.489 1.749 1.00 2.51 O ATOM 0 H ASP B 177 10.911 3.835 3.977 1.00 1.01 H new ATOM 0 HA ASP B 177 13.429 4.455 5.324 1.00 0.92 H new ATOM 0 HB2 ASP B 177 14.620 4.528 3.123 1.00 1.18 H new ATOM 0 HB3 ASP B 177 14.198 2.907 3.639 1.00 1.18 H new ATOM 2247 N GLY B 178 11.451 6.040 3.197 1.00 0.89 N ATOM 2248 CA GLY B 178 11.014 7.379 2.807 1.00 0.87 C ATOM 2249 C GLY B 178 9.562 7.433 2.336 1.00 0.85 C ATOM 2250 O GLY B 178 8.751 6.586 2.708 1.00 0.99 O ATOM 0 H GLY B 178 10.914 5.276 2.787 1.00 0.89 H new ATOM 0 HA2 GLY B 178 11.138 8.054 3.654 1.00 0.87 H new ATOM 0 HA3 GLY B 178 11.660 7.746 2.009 1.00 0.87 H new ATOM 2254 N CYS B 179 9.242 8.437 1.505 1.00 0.78 N ATOM 2255 CA CYS B 179 7.884 8.607 0.968 1.00 0.79 C ATOM 2256 C CYS B 179 7.950 9.037 -0.502 1.00 0.77 C ATOM 2257 O CYS B 179 8.982 9.524 -0.964 1.00 0.88 O ATOM 2258 CB CYS B 179 7.085 9.588 1.820 1.00 0.92 C ATOM 2259 SG CYS B 179 6.768 8.978 3.513 1.00 1.34 S ATOM 0 H CYS B 179 9.907 9.144 1.190 1.00 0.78 H new ATOM 0 HA CYS B 179 7.360 7.652 1.009 1.00 0.79 H new ATOM 0 HB2 CYS B 179 7.625 10.533 1.876 1.00 0.92 H new ATOM 0 HB3 CYS B 179 6.133 9.793 1.330 1.00 0.92 H new ATOM 2264 N HIS B 180 6.882 8.766 -1.258 1.00 0.70 N ATOM 2265 CA HIS B 180 6.891 9.013 -2.711 1.00 0.75 C ATOM 2266 C HIS B 180 5.509 9.332 -3.196 1.00 0.69 C ATOM 2267 O HIS B 180 4.551 8.609 -2.923 1.00 0.66 O ATOM 2268 CB HIS B 180 7.408 7.783 -3.474 1.00 0.89 C ATOM 2269 CG HIS B 180 7.598 8.029 -4.944 1.00 0.94 C ATOM 2270 ND1 HIS B 180 8.526 8.920 -5.440 1.00 1.60 N ATOM 2271 CD2 HIS B 180 6.969 7.504 -6.026 1.00 1.70 C ATOM 2272 CE1 HIS B 180 8.460 8.935 -6.759 1.00 2.03 C ATOM 2273 NE2 HIS B 180 7.525 8.085 -7.140 1.00 2.10 N ATOM 0 H HIS B 180 6.009 8.380 -0.898 1.00 0.70 H new ATOM 0 HA HIS B 180 7.554 9.858 -2.897 1.00 0.75 H new ATOM 0 HB2 HIS B 180 8.357 7.468 -3.040 1.00 0.89 H new ATOM 0 HB3 HIS B 180 6.707 6.960 -3.339 1.00 0.89 H new ATOM 0 HD1 HIS B 180 9.165 9.481 -4.876 1.00 1.60 H new ATOM 0 HD2 HIS B 180 6.179 6.767 -6.014 1.00 1.70 H new ATOM 0 HE1 HIS B 180 9.068 9.540 -7.415 1.00 2.03 H new ATOM 2282 N GLU B 181 5.390 10.495 -3.846 1.00 0.75 N ATOM 2283 CA GLU B 181 4.099 11.001 -4.308 1.00 0.77 C ATOM 2284 C GLU B 181 3.336 9.962 -5.114 1.00 0.73 C ATOM 2285 O GLU B 181 3.874 9.346 -6.034 1.00 0.94 O ATOM 2286 CB GLU B 181 4.294 12.276 -5.137 1.00 0.93 C ATOM 2287 CG GLU B 181 4.279 13.552 -4.306 1.00 1.69 C ATOM 2288 CD GLU B 181 4.465 14.801 -5.147 1.00 2.34 C ATOM 2289 OE1 GLU B 181 3.484 15.240 -5.784 1.00 2.69 O ATOM 2290 OE2 GLU B 181 5.591 15.340 -5.169 1.00 3.06 O ATOM 0 H GLU B 181 6.179 11.104 -4.063 1.00 0.75 H new ATOM 0 HA GLU B 181 3.504 11.233 -3.425 1.00 0.77 H new ATOM 0 HB2 GLU B 181 5.242 12.211 -5.670 1.00 0.93 H new ATOM 0 HB3 GLU B 181 3.508 12.334 -5.890 1.00 0.93 H new ATOM 0 HG2 GLU B 181 3.334 13.619 -3.768 1.00 1.69 H new ATOM 0 HG3 GLU B 181 5.069 13.502 -3.557 1.00 1.69 H new ATOM 2297 N ASP B 182 2.077 9.766 -4.741 1.00 0.77 N ATOM 2298 CA ASP B 182 1.226 8.792 -5.401 1.00 0.79 C ATOM 2299 C ASP B 182 -0.216 9.335 -5.527 1.00 0.97 C ATOM 2300 O ASP B 182 -0.857 9.629 -4.519 1.00 1.22 O ATOM 2301 CB ASP B 182 1.319 7.453 -4.619 1.00 0.90 C ATOM 2302 CG ASP B 182 0.220 7.231 -3.584 1.00 1.39 C ATOM 2303 OD1 ASP B 182 0.386 7.687 -2.433 1.00 1.88 O ATOM 2304 OD2 ASP B 182 -0.800 6.599 -3.930 1.00 2.06 O ATOM 0 H ASP B 182 1.624 10.273 -3.981 1.00 0.77 H new ATOM 0 HA ASP B 182 1.560 8.606 -6.422 1.00 0.79 H new ATOM 0 HB2 ASP B 182 1.295 6.630 -5.334 1.00 0.90 H new ATOM 0 HB3 ASP B 182 2.285 7.410 -4.116 1.00 0.90 H new ATOM 2309 N PRO B 183 -0.735 9.505 -6.767 1.00 1.15 N ATOM 2310 CA PRO B 183 -2.080 10.043 -6.999 1.00 1.41 C ATOM 2311 C PRO B 183 -3.190 9.002 -6.858 1.00 1.28 C ATOM 2312 O PRO B 183 -4.358 9.354 -6.697 1.00 1.41 O ATOM 2313 CB PRO B 183 -2.026 10.552 -8.450 1.00 1.79 C ATOM 2314 CG PRO B 183 -0.636 10.281 -8.941 1.00 1.91 C ATOM 2315 CD PRO B 183 -0.060 9.227 -8.039 1.00 1.41 C ATOM 0 HA PRO B 183 -2.321 10.808 -6.260 1.00 1.41 H new ATOM 0 HB2 PRO B 183 -2.763 10.041 -9.069 1.00 1.79 H new ATOM 0 HB3 PRO B 183 -2.254 11.617 -8.497 1.00 1.79 H new ATOM 0 HG2 PRO B 183 -0.650 9.939 -9.976 1.00 1.91 H new ATOM 0 HG3 PRO B 183 -0.032 11.188 -8.913 1.00 1.91 H new ATOM 0 HD2 PRO B 183 -0.272 8.221 -8.401 1.00 1.41 H new ATOM 0 HD3 PRO B 183 1.023 9.313 -7.952 1.00 1.41 H new ATOM 2323 N ALA B 184 -2.830 7.728 -6.935 1.00 1.13 N ATOM 2324 CA ALA B 184 -3.814 6.654 -6.828 1.00 1.18 C ATOM 2325 C ALA B 184 -4.485 6.638 -5.456 1.00 1.22 C ATOM 2326 O ALA B 184 -5.689 6.404 -5.346 1.00 1.56 O ATOM 2327 CB ALA B 184 -3.158 5.312 -7.114 1.00 1.21 C ATOM 0 H ALA B 184 -1.870 7.412 -7.070 1.00 1.13 H new ATOM 0 HA ALA B 184 -4.590 6.838 -7.571 1.00 1.18 H new ATOM 0 HB1 ALA B 184 -3.901 4.519 -7.031 1.00 1.21 H new ATOM 0 HB2 ALA B 184 -2.743 5.317 -8.122 1.00 1.21 H new ATOM 0 HB3 ALA B 184 -2.359 5.137 -6.394 1.00 1.21 H new ATOM 2333 N CYS B 185 -3.698 6.882 -4.412 1.00 1.05 N ATOM 2334 CA CYS B 185 -4.213 6.891 -3.040 1.00 1.23 C ATOM 2335 C CYS B 185 -4.465 8.298 -2.536 1.00 1.50 C ATOM 2336 O CYS B 185 -4.631 8.499 -1.339 1.00 1.94 O ATOM 2337 CB CYS B 185 -3.218 6.219 -2.092 1.00 1.19 C ATOM 2338 SG CYS B 185 -2.797 4.498 -2.499 1.00 1.46 S ATOM 0 H CYS B 185 -2.700 7.077 -4.487 1.00 1.05 H new ATOM 0 HA CYS B 185 -5.157 6.346 -3.058 1.00 1.23 H new ATOM 0 HB2 CYS B 185 -2.300 6.807 -2.079 1.00 1.19 H new ATOM 0 HB3 CYS B 185 -3.628 6.246 -1.082 1.00 1.19 H new ATOM 2343 N ASP B 186 -4.491 9.266 -3.436 1.00 1.54 N ATOM 2344 CA ASP B 186 -4.686 10.657 -3.039 1.00 1.92 C ATOM 2345 C ASP B 186 -6.081 10.891 -2.471 1.00 1.82 C ATOM 2346 O ASP B 186 -6.224 11.395 -1.358 1.00 2.28 O ATOM 2347 CB ASP B 186 -4.463 11.581 -4.238 1.00 2.44 C ATOM 2348 CG ASP B 186 -3.686 12.830 -3.871 1.00 3.09 C ATOM 2349 OD1 ASP B 186 -4.272 13.727 -3.230 1.00 3.61 O ATOM 2350 OD2 ASP B 186 -2.491 12.913 -4.226 1.00 3.49 O ATOM 0 H ASP B 186 -4.381 9.120 -4.440 1.00 1.54 H new ATOM 0 HA ASP B 186 -3.959 10.881 -2.258 1.00 1.92 H new ATOM 0 HB2 ASP B 186 -3.926 11.038 -5.016 1.00 2.44 H new ATOM 0 HB3 ASP B 186 -5.428 11.867 -4.657 1.00 2.44 H new ATOM 2355 N PRO B 187 -7.131 10.552 -3.228 1.00 1.73 N ATOM 2356 CA PRO B 187 -8.505 10.742 -2.812 1.00 2.05 C ATOM 2357 C PRO B 187 -9.159 9.494 -2.279 1.00 2.17 C ATOM 2358 O PRO B 187 -8.540 8.445 -2.090 1.00 2.31 O ATOM 2359 CB PRO B 187 -9.163 11.158 -4.139 1.00 2.47 C ATOM 2360 CG PRO B 187 -8.321 10.555 -5.230 1.00 2.58 C ATOM 2361 CD PRO B 187 -7.092 9.971 -4.579 1.00 1.99 C ATOM 0 HA PRO B 187 -8.595 11.453 -1.991 1.00 2.05 H new ATOM 0 HB2 PRO B 187 -10.190 10.797 -4.195 1.00 2.47 H new ATOM 0 HB3 PRO B 187 -9.201 12.243 -4.231 1.00 2.47 H new ATOM 0 HG2 PRO B 187 -8.877 9.783 -5.762 1.00 2.58 H new ATOM 0 HG3 PRO B 187 -8.044 11.312 -5.964 1.00 2.58 H new ATOM 0 HD2 PRO B 187 -7.127 8.882 -4.552 1.00 1.99 H new ATOM 0 HD3 PRO B 187 -6.182 10.247 -5.112 1.00 1.99 H new ATOM 2369 N GLU B 188 -10.444 9.653 -2.128 1.00 2.54 N ATOM 2370 CA GLU B 188 -11.406 8.654 -1.718 1.00 3.18 C ATOM 2371 C GLU B 188 -11.477 7.475 -2.706 1.00 3.47 C ATOM 2372 O GLU B 188 -12.453 6.723 -2.712 1.00 4.08 O ATOM 2373 CB GLU B 188 -12.803 9.292 -1.629 1.00 3.61 C ATOM 2374 CG GLU B 188 -13.254 9.949 -2.931 1.00 3.52 C ATOM 2375 CD GLU B 188 -14.270 11.058 -2.714 1.00 4.20 C ATOM 2376 OE1 GLU B 188 -13.855 12.189 -2.384 1.00 4.57 O ATOM 2377 OE2 GLU B 188 -15.480 10.795 -2.879 1.00 4.70 O ATOM 0 H GLU B 188 -10.887 10.555 -2.301 1.00 2.54 H new ATOM 0 HA GLU B 188 -11.083 8.274 -0.749 1.00 3.18 H new ATOM 0 HB2 GLU B 188 -13.526 8.527 -1.347 1.00 3.61 H new ATOM 0 HB3 GLU B 188 -12.803 10.039 -0.835 1.00 3.61 H new ATOM 0 HG2 GLU B 188 -12.384 10.356 -3.447 1.00 3.52 H new ATOM 0 HG3 GLU B 188 -13.686 9.191 -3.584 1.00 3.52 H new ATOM 2384 N ALA B 189 -10.347 7.191 -3.351 1.00 3.25 N ATOM 2385 CA ALA B 189 -10.203 5.981 -4.134 1.00 3.84 C ATOM 2386 C ALA B 189 -9.846 4.828 -3.166 1.00 4.73 C ATOM 2387 O ALA B 189 -9.450 3.743 -3.588 1.00 5.24 O ATOM 2388 CB ALA B 189 -9.110 6.141 -5.188 1.00 3.45 C ATOM 0 H ALA B 189 -9.520 7.788 -3.342 1.00 3.25 H new ATOM 0 HA ALA B 189 -11.135 5.767 -4.657 1.00 3.84 H new ATOM 0 HB1 ALA B 189 -9.021 5.219 -5.763 1.00 3.45 H new ATOM 0 HB2 ALA B 189 -9.367 6.962 -5.857 1.00 3.45 H new ATOM 0 HB3 ALA B 189 -8.160 6.356 -4.698 1.00 3.45 H new ATOM 2394 N ALA B 190 -10.073 5.074 -1.864 1.00 5.07 N ATOM 2395 CA ALA B 190 -9.871 4.104 -0.826 1.00 6.09 C ATOM 2396 C ALA B 190 -11.035 3.091 -0.762 1.00 6.88 C ATOM 2397 O ALA B 190 -12.209 3.433 -0.871 1.00 6.93 O ATOM 2398 CB ALA B 190 -9.705 4.817 0.513 1.00 6.41 C ATOM 0 H ALA B 190 -10.407 5.974 -1.520 1.00 5.07 H new ATOM 0 HA ALA B 190 -8.965 3.542 -1.052 1.00 6.09 H new ATOM 0 HB1 ALA B 190 -9.552 4.080 1.301 1.00 6.41 H new ATOM 0 HB2 ALA B 190 -8.843 5.483 0.466 1.00 6.41 H new ATOM 0 HB3 ALA B 190 -10.601 5.398 0.729 1.00 6.41 H new ATOM 2404 N PHE B 191 -10.631 1.842 -0.516 1.00 7.61 N ATOM 2405 CA PHE B 191 -11.549 0.727 -0.356 1.00 8.50 C ATOM 2406 C PHE B 191 -11.751 0.418 1.129 1.00 9.34 C ATOM 2407 O PHE B 191 -10.901 -0.214 1.757 1.00 9.88 O ATOM 2408 CB PHE B 191 -11.002 -0.513 -1.066 1.00 8.96 C ATOM 2409 CG PHE B 191 -12.006 -1.620 -1.187 1.00 9.23 C ATOM 2410 CD1 PHE B 191 -13.075 -1.505 -2.057 1.00 9.37 C ATOM 2411 CD2 PHE B 191 -11.883 -2.773 -0.428 1.00 9.60 C ATOM 2412 CE1 PHE B 191 -14.005 -2.520 -2.173 1.00 9.84 C ATOM 2413 CE2 PHE B 191 -12.810 -3.792 -0.538 1.00 10.04 C ATOM 2414 CZ PHE B 191 -13.872 -3.665 -1.412 1.00 10.14 C ATOM 0 H PHE B 191 -9.649 1.581 -0.423 1.00 7.61 H new ATOM 0 HA PHE B 191 -12.507 1.001 -0.799 1.00 8.50 H new ATOM 0 HB2 PHE B 191 -10.661 -0.231 -2.062 1.00 8.96 H new ATOM 0 HB3 PHE B 191 -10.131 -0.880 -0.522 1.00 8.96 H new ATOM 0 HD1 PHE B 191 -13.184 -0.611 -2.653 1.00 9.37 H new ATOM 0 HD2 PHE B 191 -11.054 -2.876 0.257 1.00 9.60 H new ATOM 0 HE1 PHE B 191 -14.834 -2.418 -2.857 1.00 9.84 H new ATOM 0 HE2 PHE B 191 -12.704 -4.686 0.058 1.00 10.04 H new ATOM 0 HZ PHE B 191 -14.598 -4.460 -1.500 1.00 10.14 H new ATOM 2424 N SER B 192 -12.872 0.861 1.686 1.00 9.55 N ATOM 2425 CA SER B 192 -13.165 0.622 3.096 1.00 10.42 C ATOM 2426 C SER B 192 -14.670 0.601 3.343 1.00 11.18 C ATOM 2427 O SER B 192 -15.358 1.533 2.880 1.00 11.41 O ATOM 2428 CB SER B 192 -12.510 1.694 3.969 1.00 10.44 C ATOM 2429 OG SER B 192 -11.128 1.812 3.682 1.00 10.49 O ATOM 2430 OXT SER B 192 -15.147 -0.350 3.998 1.00 11.70 O ATOM 0 H SER B 192 -13.590 1.385 1.187 1.00 9.55 H new ATOM 0 HA SER B 192 -12.755 -0.352 3.363 1.00 10.42 H new ATOM 0 HB2 SER B 192 -13.002 2.652 3.804 1.00 10.44 H new ATOM 0 HB3 SER B 192 -12.646 1.443 5.021 1.00 10.44 H new ATOM 0 HG SER B 192 -10.733 2.505 4.252 1.00 10.49 H new TER 2436 SER B 192