USER MOD reduce.3.24.130724 H: found=0, std=0, add=1155, rem=0, adj=20 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 167:sc= 0.88 USER MOD Single : A 38 THR OG1 : rot -130:sc= -0.292 USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 48 ASN : amide:sc= -2.16! K(o=-2.2!,f=-0.79) 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= -4.1! C(o=-4.1!,f=-5.1!) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 58 GLN : amide:sc=-0.00311 X(o=-0.0031,f=-0.0031) USER MOD Single : A 59 LYS NZ :NH3+ -161:sc=-0.00812 (180deg=-0.125) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 75 SER OG : rot 180:sc= -1.4 USER MOD Single : A 80 HIS : no HD1:sc= -1.47 K(o=-1.5,f=-0.021) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : B 109 THR OG1 : rot 180:sc= 0 USER MOD Single : B 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 125 SER OG : rot 172:sc= 1.21 USER MOD Single : B 138 THR OG1 : rot -130:sc= -0.74 USER MOD Single : B 145 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : B 148 ASN : amide:sc= -2.21! K(o=-2.2!,f=-0.79) 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= -3.63! C(o=-3.6!,f=-4.7!) USER MOD Single : B 156 SER OG : rot 180:sc= 0 USER MOD Single : B 158 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 159 LYS NZ :NH3+ -164:sc= -0.011 (180deg=-0.113) USER MOD Single : B 163 SER OG : rot 180:sc= 0.00331 USER MOD Single : B 175 SER OG : rot 180:sc= -1.43 USER MOD Single : B 180 HIS : no HD1:sc= -1.35 K(o=-1.4,f=-0.018) USER MOD Single : B 192 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 17.084 36.909 -2.620 1.00 9.95 N ATOM 2 CA ALA A 1 16.224 35.737 -2.926 1.00 9.34 C ATOM 3 C ALA A 1 16.071 35.539 -4.433 1.00 8.30 C ATOM 4 O ALA A 1 15.582 36.415 -5.144 1.00 8.16 O ATOM 5 CB ALA A 1 14.857 35.882 -2.264 1.00 9.73 C ATOM 0 H1 ALA A 1 17.169 37.018 -1.589 1.00 9.95 H new ATOM 0 H2 ALA A 1 18.028 36.764 -3.032 1.00 9.95 H new ATOM 0 H3 ALA A 1 16.658 37.767 -3.024 1.00 9.95 H new ATOM 0 HA ALA A 1 16.713 34.852 -2.519 1.00 9.34 H new ATOM 0 HB1 ALA A 1 14.244 35.013 -2.501 1.00 9.73 H new ATOM 0 HB2 ALA A 1 14.982 35.954 -1.184 1.00 9.73 H new ATOM 0 HB3 ALA A 1 14.368 36.783 -2.633 1.00 9.73 H new ATOM 13 N VAL A 2 16.468 34.364 -4.892 1.00 7.83 N ATOM 14 CA VAL A 2 16.366 33.989 -6.275 1.00 7.06 C ATOM 15 C VAL A 2 15.824 32.562 -6.457 1.00 5.87 C ATOM 16 O VAL A 2 16.393 31.591 -5.958 1.00 5.74 O ATOM 17 CB VAL A 2 17.734 34.079 -6.976 1.00 7.48 C ATOM 18 CG1 VAL A 2 18.021 35.510 -7.393 1.00 8.02 C ATOM 19 CG2 VAL A 2 18.842 33.545 -6.076 1.00 7.83 C ATOM 0 H VAL A 2 16.874 33.640 -4.299 1.00 7.83 H new ATOM 0 HA VAL A 2 15.665 34.692 -6.724 1.00 7.06 H new ATOM 0 HB VAL A 2 17.702 33.459 -7.872 1.00 7.48 H new ATOM 0 HG11 VAL A 2 18.991 35.557 -7.887 1.00 8.02 H new ATOM 0 HG12 VAL A 2 17.247 35.851 -8.080 1.00 8.02 H new ATOM 0 HG13 VAL A 2 18.031 36.151 -6.511 1.00 8.02 H new ATOM 0 HG21 VAL A 2 19.798 33.619 -6.593 1.00 7.83 H new ATOM 0 HG22 VAL A 2 18.880 34.132 -5.158 1.00 7.83 H new ATOM 0 HG23 VAL A 2 18.641 32.502 -5.832 1.00 7.83 H new ATOM 29 N LEU A 3 14.773 32.463 -7.270 1.00 5.32 N ATOM 30 CA LEU A 3 14.206 31.171 -7.625 1.00 4.36 C ATOM 31 C LEU A 3 15.093 30.604 -8.730 1.00 4.03 C ATOM 32 O LEU A 3 15.046 30.999 -9.895 1.00 4.40 O ATOM 33 CB LEU A 3 12.735 31.274 -8.071 1.00 4.40 C ATOM 34 CG LEU A 3 12.248 32.652 -8.517 1.00 5.00 C ATOM 35 CD1 LEU A 3 12.508 32.842 -9.998 1.00 5.26 C ATOM 36 CD2 LEU A 3 10.767 32.811 -8.203 1.00 5.86 C ATOM 0 H LEU A 3 14.301 33.262 -7.692 1.00 5.32 H new ATOM 0 HA LEU A 3 14.188 30.513 -6.757 1.00 4.36 H new ATOM 0 HB2 LEU A 3 12.579 30.575 -8.893 1.00 4.40 H new ATOM 0 HB3 LEU A 3 12.105 30.941 -7.246 1.00 4.40 H new ATOM 0 HG LEU A 3 12.798 33.418 -7.971 1.00 5.00 H new ATOM 0 HD11 LEU A 3 12.157 33.827 -10.306 1.00 5.26 H new ATOM 0 HD12 LEU A 3 13.577 32.760 -10.193 1.00 5.26 H new ATOM 0 HD13 LEU A 3 11.977 32.075 -10.562 1.00 5.26 H new ATOM 0 HD21 LEU A 3 10.431 33.797 -8.525 1.00 5.86 H new ATOM 0 HD22 LEU A 3 10.199 32.044 -8.729 1.00 5.86 H new ATOM 0 HD23 LEU A 3 10.609 32.707 -7.130 1.00 5.86 H new ATOM 48 N ASP A 4 15.753 29.567 -8.328 1.00 3.91 N ATOM 49 CA ASP A 4 16.536 28.715 -9.152 1.00 4.19 C ATOM 50 C ASP A 4 16.892 27.525 -8.306 1.00 3.97 C ATOM 51 O ASP A 4 16.094 26.621 -8.057 1.00 4.06 O ATOM 52 CB ASP A 4 17.743 29.442 -9.726 1.00 4.92 C ATOM 53 CG ASP A 4 17.474 29.964 -11.123 1.00 5.74 C ATOM 54 OD1 ASP A 4 17.296 29.132 -12.039 1.00 6.22 O ATOM 55 OD2 ASP A 4 17.434 31.197 -11.302 1.00 6.19 O ATOM 0 H ASP A 4 15.757 29.277 -7.350 1.00 3.91 H new ATOM 0 HA ASP A 4 15.985 28.386 -10.033 1.00 4.19 H new ATOM 0 HB2 ASP A 4 18.011 30.273 -9.073 1.00 4.92 H new ATOM 0 HB3 ASP A 4 18.598 28.766 -9.749 1.00 4.92 H new ATOM 60 N LEU A 5 18.132 27.593 -7.840 1.00 4.28 N ATOM 61 CA LEU A 5 18.643 26.548 -6.970 1.00 4.71 C ATOM 62 C LEU A 5 19.513 27.164 -5.911 1.00 5.46 C ATOM 63 O LEU A 5 20.179 26.489 -5.125 1.00 6.27 O ATOM 64 CB LEU A 5 19.392 25.479 -7.761 1.00 5.36 C ATOM 65 CG LEU A 5 19.936 24.315 -6.930 1.00 6.10 C ATOM 66 CD1 LEU A 5 18.869 23.772 -5.985 1.00 5.79 C ATOM 67 CD2 LEU A 5 20.450 23.214 -7.843 1.00 7.09 C ATOM 0 H LEU A 5 18.789 28.345 -8.046 1.00 4.28 H new ATOM 0 HA LEU A 5 17.804 26.047 -6.488 1.00 4.71 H new ATOM 0 HB2 LEU A 5 18.724 25.079 -8.523 1.00 5.36 H new ATOM 0 HB3 LEU A 5 20.224 25.952 -8.283 1.00 5.36 H new ATOM 0 HG LEU A 5 20.764 24.684 -6.325 1.00 6.10 H new ATOM 0 HD11 LEU A 5 19.282 22.946 -5.406 1.00 5.79 H new ATOM 0 HD12 LEU A 5 18.546 24.563 -5.308 1.00 5.79 H new ATOM 0 HD13 LEU A 5 18.016 23.419 -6.564 1.00 5.79 H new ATOM 0 HD21 LEU A 5 20.835 22.391 -7.240 1.00 7.09 H new ATOM 0 HD22 LEU A 5 19.636 22.853 -8.472 1.00 7.09 H new ATOM 0 HD23 LEU A 5 21.249 23.607 -8.473 1.00 7.09 H new ATOM 79 N ASP A 6 19.391 28.530 -5.863 1.00 5.46 N ATOM 80 CA ASP A 6 20.035 29.402 -4.879 1.00 6.41 C ATOM 81 C ASP A 6 19.125 29.254 -3.717 1.00 6.28 C ATOM 82 O ASP A 6 19.293 28.274 -2.991 1.00 6.48 O ATOM 83 CB ASP A 6 20.126 30.848 -5.351 1.00 7.20 C ATOM 84 CG ASP A 6 21.374 31.539 -4.841 1.00 8.21 C ATOM 85 OD1 ASP A 6 21.319 32.125 -3.739 1.00 8.64 O ATOM 86 OD2 ASP A 6 22.404 31.492 -5.542 1.00 8.78 O ATOM 0 H ASP A 6 18.823 29.047 -6.534 1.00 5.46 H new ATOM 0 HA ASP A 6 21.072 29.137 -4.672 1.00 6.41 H new ATOM 0 HB2 ASP A 6 20.118 30.874 -6.441 1.00 7.20 H new ATOM 0 HB3 ASP A 6 19.246 31.395 -5.013 1.00 7.20 H new ATOM 91 N VAL A 7 17.993 29.995 -3.619 1.00 6.22 N ATOM 92 CA VAL A 7 17.038 29.570 -2.664 1.00 6.28 C ATOM 93 C VAL A 7 15.738 29.794 -3.467 1.00 5.52 C ATOM 94 O VAL A 7 15.449 30.951 -3.777 1.00 5.69 O ATOM 95 CB VAL A 7 17.095 30.466 -1.399 1.00 7.22 C ATOM 96 CG1 VAL A 7 17.173 31.939 -1.779 1.00 7.36 C ATOM 97 CG2 VAL A 7 15.910 30.208 -0.483 1.00 7.51 C ATOM 0 H VAL A 7 17.761 30.826 -4.163 1.00 6.22 H new ATOM 0 HA VAL A 7 17.168 28.555 -2.288 1.00 6.28 H new ATOM 0 HB VAL A 7 18.001 30.206 -0.852 1.00 7.22 H new ATOM 0 HG11 VAL A 7 17.212 32.546 -0.875 1.00 7.36 H new ATOM 0 HG12 VAL A 7 18.070 32.115 -2.373 1.00 7.36 H new ATOM 0 HG13 VAL A 7 16.293 32.212 -2.362 1.00 7.36 H new ATOM 0 HG21 VAL A 7 15.981 30.852 0.394 1.00 7.51 H new ATOM 0 HG22 VAL A 7 14.984 30.422 -1.017 1.00 7.51 H new ATOM 0 HG23 VAL A 7 15.914 29.165 -0.168 1.00 7.51 H new ATOM 107 N ARG A 8 14.924 28.817 -3.785 1.00 5.09 N ATOM 108 CA ARG A 8 13.709 29.141 -4.498 1.00 4.80 C ATOM 109 C ARG A 8 12.729 29.659 -3.510 1.00 4.48 C ATOM 110 O ARG A 8 12.399 28.926 -2.573 1.00 4.96 O ATOM 111 CB ARG A 8 13.161 27.973 -5.295 1.00 5.24 C ATOM 112 CG ARG A 8 12.673 28.357 -6.678 1.00 6.15 C ATOM 113 CD ARG A 8 11.191 28.096 -6.865 1.00 6.93 C ATOM 114 NE ARG A 8 10.379 29.244 -6.471 1.00 7.61 N ATOM 115 CZ ARG A 8 9.195 29.536 -7.006 1.00 8.32 C ATOM 116 NH1 ARG A 8 8.666 28.752 -7.937 1.00 8.49 N ATOM 117 NH2 ARG A 8 8.536 30.615 -6.608 1.00 9.08 N ATOM 0 H ARG A 8 15.068 27.830 -3.573 1.00 5.09 H new ATOM 0 HA ARG A 8 13.923 29.904 -5.246 1.00 4.80 H new ATOM 0 HB2 ARG A 8 13.937 27.213 -5.391 1.00 5.24 H new ATOM 0 HB3 ARG A 8 12.338 27.520 -4.741 1.00 5.24 H new ATOM 0 HG2 ARG A 8 12.877 29.414 -6.851 1.00 6.15 H new ATOM 0 HG3 ARG A 8 13.234 27.797 -7.426 1.00 6.15 H new ATOM 0 HD2 ARG A 8 10.994 27.854 -7.910 1.00 6.93 H new ATOM 0 HD3 ARG A 8 10.899 27.226 -6.276 1.00 6.93 H new ATOM 0 HE ARG A 8 10.740 29.859 -5.742 1.00 7.61 H new ATOM 0 HH11 ARG A 8 9.167 27.919 -8.247 1.00 8.49 H new ATOM 0 HH12 ARG A 8 7.759 28.982 -8.342 1.00 8.49 H new ATOM 0 HH21 ARG A 8 8.936 31.222 -5.892 1.00 9.08 H new ATOM 0 HH22 ARG A 8 7.629 30.839 -7.018 1.00 9.08 H new ATOM 131 N THR A 9 12.252 30.888 -3.626 1.00 4.05 N ATOM 132 CA THR A 9 11.328 31.263 -2.588 1.00 4.08 C ATOM 133 C THR A 9 10.097 30.378 -2.726 1.00 3.18 C ATOM 134 O THR A 9 9.251 30.565 -3.597 1.00 3.47 O ATOM 135 CB THR A 9 10.951 32.748 -2.721 1.00 4.95 C ATOM 136 OG1 THR A 9 9.879 33.082 -1.853 1.00 5.55 O ATOM 137 CG2 THR A 9 10.546 33.141 -4.126 1.00 5.66 C ATOM 0 H THR A 9 12.463 31.575 -4.350 1.00 4.05 H new ATOM 0 HA THR A 9 11.779 31.128 -1.605 1.00 4.08 H new ATOM 0 HB THR A 9 11.855 33.295 -2.454 1.00 4.95 H new ATOM 0 HG1 THR A 9 9.659 34.032 -1.955 1.00 5.55 H new ATOM 0 HG21 THR A 9 10.293 34.201 -4.149 1.00 5.66 H new ATOM 0 HG22 THR A 9 11.373 32.951 -4.810 1.00 5.66 H new ATOM 0 HG23 THR A 9 9.680 32.555 -4.432 1.00 5.66 H new ATOM 145 N CYS A 10 10.020 29.419 -1.810 1.00 2.54 N ATOM 146 CA CYS A 10 8.909 28.470 -1.731 1.00 1.93 C ATOM 147 C CYS A 10 7.681 29.062 -1.038 1.00 1.72 C ATOM 148 O CYS A 10 7.733 29.284 0.170 1.00 1.97 O ATOM 149 CB CYS A 10 9.357 27.177 -1.053 1.00 2.28 C ATOM 150 SG CYS A 10 10.702 26.280 -1.915 1.00 2.68 S ATOM 0 H CYS A 10 10.732 29.275 -1.094 1.00 2.54 H new ATOM 0 HA CYS A 10 8.606 28.241 -2.753 1.00 1.93 H new ATOM 0 HB2 CYS A 10 9.686 27.410 -0.040 1.00 2.28 H new ATOM 0 HB3 CYS A 10 8.497 26.514 -0.964 1.00 2.28 H new ATOM 155 N LEU A 11 6.575 29.271 -1.750 1.00 1.49 N ATOM 156 CA LEU A 11 5.348 29.796 -1.118 1.00 1.39 C ATOM 157 C LEU A 11 5.241 29.348 0.347 1.00 1.20 C ATOM 158 O LEU A 11 5.523 28.196 0.670 1.00 1.16 O ATOM 159 CB LEU A 11 4.106 29.326 -1.872 1.00 1.55 C ATOM 160 CG LEU A 11 3.881 29.968 -3.239 1.00 1.91 C ATOM 161 CD1 LEU A 11 3.064 29.039 -4.125 1.00 2.48 C ATOM 162 CD2 LEU A 11 3.187 31.317 -3.092 1.00 2.29 C ATOM 0 H LEU A 11 6.494 29.091 -2.751 1.00 1.49 H new ATOM 0 HA LEU A 11 5.407 30.884 -1.155 1.00 1.39 H new ATOM 0 HB2 LEU A 11 4.170 28.246 -2.004 1.00 1.55 H new ATOM 0 HB3 LEU A 11 3.231 29.520 -1.251 1.00 1.55 H new ATOM 0 HG LEU A 11 4.850 30.135 -3.709 1.00 1.91 H new ATOM 0 HD11 LEU A 11 2.909 29.506 -5.097 1.00 2.48 H new ATOM 0 HD12 LEU A 11 3.598 28.098 -4.256 1.00 2.48 H new ATOM 0 HD13 LEU A 11 2.098 28.846 -3.657 1.00 2.48 H new ATOM 0 HD21 LEU A 11 3.036 31.758 -4.077 1.00 2.29 H new ATOM 0 HD22 LEU A 11 2.222 31.178 -2.605 1.00 2.29 H new ATOM 0 HD23 LEU A 11 3.806 31.981 -2.489 1.00 2.29 H new ATOM 174 N PRO A 12 4.867 30.258 1.259 1.00 1.19 N ATOM 175 CA PRO A 12 4.755 29.948 2.696 1.00 1.11 C ATOM 176 C PRO A 12 3.594 29.011 3.067 1.00 1.01 C ATOM 177 O PRO A 12 2.534 29.061 2.451 1.00 1.05 O ATOM 178 CB PRO A 12 4.491 31.323 3.327 1.00 1.29 C ATOM 179 CG PRO A 12 3.899 32.140 2.232 1.00 1.49 C ATOM 180 CD PRO A 12 4.564 31.672 0.974 1.00 1.39 C ATOM 0 HA PRO A 12 5.650 29.426 3.035 1.00 1.11 H new ATOM 0 HB2 PRO A 12 3.810 31.245 4.174 1.00 1.29 H new ATOM 0 HB3 PRO A 12 5.413 31.770 3.700 1.00 1.29 H new ATOM 0 HG2 PRO A 12 2.819 32.001 2.179 1.00 1.49 H new ATOM 0 HG3 PRO A 12 4.076 33.203 2.397 1.00 1.49 H new ATOM 0 HD2 PRO A 12 3.909 31.777 0.109 1.00 1.39 H new ATOM 0 HD3 PRO A 12 5.468 32.242 0.760 1.00 1.39 H new ATOM 188 N CYS A 13 3.791 28.187 4.115 1.00 0.93 N ATOM 189 CA CYS A 13 2.732 27.315 4.590 1.00 0.89 C ATOM 190 C CYS A 13 2.864 27.062 6.111 1.00 0.90 C ATOM 191 O CYS A 13 3.687 27.681 6.806 1.00 1.00 O ATOM 192 CB CYS A 13 2.761 26.011 3.758 1.00 0.82 C ATOM 193 SG CYS A 13 3.145 24.460 4.653 1.00 0.86 S ATOM 0 H CYS A 13 4.666 28.117 4.634 1.00 0.93 H new ATOM 0 HA CYS A 13 1.760 27.788 4.453 1.00 0.89 H new ATOM 0 HB2 CYS A 13 1.789 25.894 3.279 1.00 0.82 H new ATOM 0 HB3 CYS A 13 3.496 26.133 2.962 1.00 0.82 H new ATOM 198 N GLY A 14 2.115 26.057 6.577 1.00 0.91 N ATOM 199 CA GLY A 14 2.189 25.615 7.957 1.00 0.98 C ATOM 200 C GLY A 14 1.492 26.516 8.948 1.00 1.10 C ATOM 201 O GLY A 14 0.651 27.329 8.573 1.00 1.15 O ATOM 0 H GLY A 14 1.448 25.536 6.007 1.00 0.91 H new ATOM 0 HA2 GLY A 14 1.757 24.617 8.028 1.00 0.98 H new ATOM 0 HA3 GLY A 14 3.238 25.529 8.241 1.00 0.98 H new ATOM 205 N PRO A 15 1.868 26.409 10.233 1.00 1.19 N ATOM 206 CA PRO A 15 1.332 27.237 11.326 1.00 1.33 C ATOM 207 C PRO A 15 1.653 28.696 11.096 1.00 1.40 C ATOM 208 O PRO A 15 2.756 29.173 11.355 1.00 1.57 O ATOM 209 CB PRO A 15 2.093 26.722 12.534 1.00 1.46 C ATOM 210 CG PRO A 15 3.353 26.425 11.876 1.00 1.39 C ATOM 211 CD PRO A 15 2.928 25.547 10.754 1.00 1.21 C ATOM 0 HA PRO A 15 0.248 27.173 11.425 1.00 1.33 H new ATOM 0 HB2 PRO A 15 2.192 27.468 13.323 1.00 1.46 H new ATOM 0 HB3 PRO A 15 1.631 25.843 12.983 1.00 1.46 H new ATOM 0 HG2 PRO A 15 3.848 27.328 11.520 1.00 1.39 H new ATOM 0 HG3 PRO A 15 4.051 25.921 12.544 1.00 1.39 H new ATOM 0 HD2 PRO A 15 3.723 25.361 10.031 1.00 1.21 H new ATOM 0 HD3 PRO A 15 2.565 24.574 11.086 1.00 1.21 H new ATOM 219 N GLY A 16 0.677 29.373 10.651 1.00 1.34 N ATOM 220 CA GLY A 16 0.740 30.773 10.376 1.00 1.47 C ATOM 221 C GLY A 16 1.266 31.061 9.013 1.00 1.43 C ATOM 222 O GLY A 16 1.273 32.218 8.592 1.00 1.68 O ATOM 0 H GLY A 16 -0.236 28.963 10.454 1.00 1.34 H new ATOM 0 HA2 GLY A 16 -0.255 31.205 10.477 1.00 1.47 H new ATOM 0 HA3 GLY A 16 1.375 31.258 11.117 1.00 1.47 H new ATOM 226 N GLY A 17 1.744 30.043 8.312 1.00 1.28 N ATOM 227 CA GLY A 17 2.256 30.264 7.031 1.00 1.25 C ATOM 228 C GLY A 17 3.652 30.821 7.031 1.00 1.24 C ATOM 229 O GLY A 17 3.974 31.726 6.262 1.00 1.36 O ATOM 0 H GLY A 17 1.774 29.075 8.633 1.00 1.28 H new ATOM 0 HA2 GLY A 17 2.248 29.325 6.478 1.00 1.25 H new ATOM 0 HA3 GLY A 17 1.599 30.952 6.499 1.00 1.25 H new ATOM 233 N LYS A 18 4.535 30.169 7.809 1.00 1.18 N ATOM 234 CA LYS A 18 5.939 30.528 7.791 1.00 1.23 C ATOM 235 C LYS A 18 6.532 29.604 6.726 1.00 1.13 C ATOM 236 O LYS A 18 7.491 29.959 6.039 1.00 1.22 O ATOM 237 CB LYS A 18 6.550 30.322 9.193 1.00 1.28 C ATOM 238 CG LYS A 18 5.513 30.041 10.293 1.00 1.34 C ATOM 239 CD LYS A 18 5.694 30.943 11.506 1.00 1.73 C ATOM 240 CE LYS A 18 5.384 30.202 12.800 1.00 1.91 C ATOM 241 NZ LYS A 18 5.257 31.130 13.958 1.00 2.50 N ATOM 0 H LYS A 18 4.294 29.407 8.442 1.00 1.18 H new ATOM 0 HA LYS A 18 6.135 31.573 7.553 1.00 1.23 H new ATOM 0 HB2 LYS A 18 7.255 29.492 9.152 1.00 1.28 H new ATOM 0 HB3 LYS A 18 7.120 31.211 9.464 1.00 1.28 H new ATOM 0 HG2 LYS A 18 4.511 30.179 9.887 1.00 1.34 H new ATOM 0 HG3 LYS A 18 5.590 28.999 10.604 1.00 1.34 H new ATOM 0 HD2 LYS A 18 6.718 31.316 11.535 1.00 1.73 H new ATOM 0 HD3 LYS A 18 5.041 31.811 11.417 1.00 1.73 H new ATOM 0 HE2 LYS A 18 4.458 29.640 12.683 1.00 1.91 H new ATOM 0 HE3 LYS A 18 6.173 29.478 13.001 1.00 1.91 H new ATOM 0 HZ1 LYS A 18 5.046 30.585 14.818 1.00 2.50 H new ATOM 0 HZ2 LYS A 18 6.149 31.648 14.087 1.00 2.50 H new ATOM 0 HZ3 LYS A 18 4.487 31.806 13.779 1.00 2.50 H new ATOM 255 N GLY A 19 6.195 28.320 6.896 1.00 1.02 N ATOM 256 CA GLY A 19 6.943 27.313 6.155 1.00 0.95 C ATOM 257 C GLY A 19 6.775 27.288 4.638 1.00 0.91 C ATOM 258 O GLY A 19 5.975 27.985 4.038 1.00 1.00 O ATOM 0 H GLY A 19 5.453 27.973 7.504 1.00 1.02 H new ATOM 0 HA2 GLY A 19 8.002 27.451 6.374 1.00 0.95 H new ATOM 0 HA3 GLY A 19 6.662 26.333 6.541 1.00 0.95 H new ATOM 262 N ARG A 20 7.705 26.574 4.035 1.00 0.86 N ATOM 263 CA ARG A 20 7.843 26.526 2.594 1.00 0.86 C ATOM 264 C ARG A 20 7.326 25.239 1.945 1.00 0.80 C ATOM 265 O ARG A 20 7.399 24.154 2.520 1.00 0.78 O ATOM 266 CB ARG A 20 9.311 26.762 2.276 1.00 0.94 C ATOM 267 CG ARG A 20 9.669 28.239 2.132 1.00 1.13 C ATOM 268 CD ARG A 20 10.407 28.767 3.351 1.00 1.55 C ATOM 269 NE ARG A 20 11.838 28.921 3.097 1.00 1.82 N ATOM 270 CZ ARG A 20 12.795 28.458 3.900 1.00 2.25 C ATOM 271 NH1 ARG A 20 12.487 27.826 5.028 1.00 2.59 N ATOM 272 NH2 ARG A 20 14.068 28.631 3.576 1.00 2.92 N ATOM 0 H ARG A 20 8.390 26.007 4.535 1.00 0.86 H new ATOM 0 HA ARG A 20 7.210 27.302 2.164 1.00 0.86 H new ATOM 0 HB2 ARG A 20 9.921 26.323 3.065 1.00 0.94 H new ATOM 0 HB3 ARG A 20 9.563 26.243 1.351 1.00 0.94 H new ATOM 0 HG2 ARG A 20 10.288 28.377 1.245 1.00 1.13 H new ATOM 0 HG3 ARG A 20 8.759 28.819 1.979 1.00 1.13 H new ATOM 0 HD2 ARG A 20 9.985 29.728 3.643 1.00 1.55 H new ATOM 0 HD3 ARG A 20 10.258 28.086 4.189 1.00 1.55 H new ATOM 0 HE ARG A 20 12.122 29.415 2.251 1.00 1.82 H new ATOM 0 HH11 ARG A 20 11.510 27.691 5.287 1.00 2.59 H new ATOM 0 HH12 ARG A 20 13.228 27.476 5.635 1.00 2.59 H new ATOM 0 HH21 ARG A 20 14.313 29.118 2.714 1.00 2.92 H new ATOM 0 HH22 ARG A 20 14.803 28.278 4.189 1.00 2.92 H new ATOM 286 N CYS A 21 6.802 25.398 0.719 1.00 0.82 N ATOM 287 CA CYS A 21 6.245 24.286 -0.062 1.00 0.81 C ATOM 288 C CYS A 21 7.142 23.932 -1.247 1.00 0.84 C ATOM 289 O CYS A 21 7.680 24.811 -1.916 1.00 1.04 O ATOM 290 CB CYS A 21 4.861 24.658 -0.615 1.00 0.91 C ATOM 291 SG CYS A 21 3.590 25.023 0.638 1.00 1.10 S ATOM 0 H CYS A 21 6.753 26.299 0.244 1.00 0.82 H new ATOM 0 HA CYS A 21 6.172 23.431 0.610 1.00 0.81 H new ATOM 0 HB2 CYS A 21 4.969 25.528 -1.262 1.00 0.91 H new ATOM 0 HB3 CYS A 21 4.506 23.838 -1.240 1.00 0.91 H new ATOM 296 N PHE A 22 7.294 22.635 -1.503 1.00 0.76 N ATOM 297 CA PHE A 22 8.128 22.162 -2.614 1.00 0.83 C ATOM 298 C PHE A 22 7.351 21.248 -3.569 1.00 0.94 C ATOM 299 O PHE A 22 7.842 20.914 -4.647 1.00 1.43 O ATOM 300 CB PHE A 22 9.359 21.435 -2.064 1.00 0.85 C ATOM 301 CG PHE A 22 9.999 22.175 -0.925 1.00 0.84 C ATOM 302 CD1 PHE A 22 9.339 22.302 0.286 1.00 1.42 C ATOM 303 CD2 PHE A 22 11.240 22.778 -1.074 1.00 1.40 C ATOM 304 CE1 PHE A 22 9.900 23.015 1.327 1.00 1.50 C ATOM 305 CE2 PHE A 22 11.809 23.488 -0.031 1.00 1.51 C ATOM 306 CZ PHE A 22 11.136 23.608 1.170 1.00 1.14 C ATOM 0 H PHE A 22 6.854 21.892 -0.960 1.00 0.76 H new ATOM 0 HA PHE A 22 8.444 23.033 -3.188 1.00 0.83 H new ATOM 0 HB2 PHE A 22 9.070 20.439 -1.730 1.00 0.85 H new ATOM 0 HB3 PHE A 22 10.088 21.304 -2.864 1.00 0.85 H new ATOM 0 HD1 PHE A 22 8.373 21.837 0.418 1.00 1.42 H new ATOM 0 HD2 PHE A 22 11.767 22.692 -2.013 1.00 1.40 H new ATOM 0 HE1 PHE A 22 9.371 23.109 2.264 1.00 1.50 H new ATOM 0 HE2 PHE A 22 12.778 23.948 -0.156 1.00 1.51 H new ATOM 0 HZ PHE A 22 11.576 24.165 1.984 1.00 1.14 H new ATOM 316 N GLY A 23 6.139 20.848 -3.180 1.00 0.83 N ATOM 317 CA GLY A 23 5.337 19.986 -4.027 1.00 0.88 C ATOM 318 C GLY A 23 3.858 20.048 -3.688 1.00 0.88 C ATOM 319 O GLY A 23 3.410 20.991 -3.038 1.00 0.90 O ATOM 0 H GLY A 23 5.702 21.107 -2.295 1.00 0.83 H new ATOM 0 HA2 GLY A 23 5.480 20.272 -5.069 1.00 0.88 H new ATOM 0 HA3 GLY A 23 5.686 18.958 -3.928 1.00 0.88 H new ATOM 323 N PRO A 24 3.071 19.043 -4.112 1.00 1.01 N ATOM 324 CA PRO A 24 1.631 18.989 -3.842 1.00 1.07 C ATOM 325 C PRO A 24 1.329 18.732 -2.369 1.00 0.96 C ATOM 326 O PRO A 24 0.572 19.472 -1.741 1.00 1.03 O ATOM 327 CB PRO A 24 1.128 17.814 -4.696 1.00 1.32 C ATOM 328 CG PRO A 24 2.275 17.412 -5.565 1.00 1.50 C ATOM 329 CD PRO A 24 3.525 17.879 -4.875 1.00 1.24 C ATOM 0 HA PRO A 24 1.148 19.936 -4.081 1.00 1.07 H new ATOM 0 HB2 PRO A 24 0.807 16.984 -4.066 1.00 1.32 H new ATOM 0 HB3 PRO A 24 0.268 18.109 -5.297 1.00 1.32 H new ATOM 0 HG2 PRO A 24 2.292 16.331 -5.707 1.00 1.50 H new ATOM 0 HG3 PRO A 24 2.188 17.862 -6.554 1.00 1.50 H new ATOM 0 HD2 PRO A 24 3.938 17.108 -4.225 1.00 1.24 H new ATOM 0 HD3 PRO A 24 4.304 18.145 -5.590 1.00 1.24 H new ATOM 337 N SER A 25 1.923 17.672 -1.828 1.00 0.97 N ATOM 338 CA SER A 25 1.718 17.307 -0.430 1.00 0.92 C ATOM 339 C SER A 25 3.036 17.347 0.341 1.00 0.78 C ATOM 340 O SER A 25 3.339 16.438 1.105 1.00 0.81 O ATOM 341 CB SER A 25 1.101 15.901 -0.337 1.00 1.12 C ATOM 342 OG SER A 25 -0.302 15.969 -0.154 1.00 1.26 O ATOM 0 H SER A 25 2.551 17.050 -2.337 1.00 0.97 H new ATOM 0 HA SER A 25 1.035 18.030 0.015 1.00 0.92 H new ATOM 0 HB2 SER A 25 1.325 15.342 -1.245 1.00 1.12 H new ATOM 0 HB3 SER A 25 1.553 15.357 0.492 1.00 1.12 H new ATOM 0 HG SER A 25 -0.695 15.084 -0.307 1.00 1.26 H new ATOM 348 N ILE A 26 3.832 18.391 0.129 1.00 0.70 N ATOM 349 CA ILE A 26 5.115 18.496 0.808 1.00 0.61 C ATOM 350 C ILE A 26 5.452 19.940 1.215 1.00 0.58 C ATOM 351 O ILE A 26 5.556 20.832 0.372 1.00 0.73 O ATOM 352 CB ILE A 26 6.238 17.899 -0.071 1.00 0.60 C ATOM 353 CG1 ILE A 26 6.132 16.398 -0.114 1.00 0.79 C ATOM 354 CG2 ILE A 26 7.628 18.313 0.395 1.00 0.74 C ATOM 355 CD1 ILE A 26 7.139 15.752 -1.044 1.00 0.83 C ATOM 0 H ILE A 26 3.614 19.165 -0.499 1.00 0.70 H new ATOM 0 HA ILE A 26 5.038 17.920 1.730 1.00 0.61 H new ATOM 0 HB ILE A 26 6.101 18.301 -1.075 1.00 0.60 H new ATOM 0 HG12 ILE A 26 6.271 16.002 0.892 1.00 0.79 H new ATOM 0 HG13 ILE A 26 5.126 16.121 -0.430 1.00 0.79 H new ATOM 0 HG21 ILE A 26 8.378 17.866 -0.257 1.00 0.74 H new ATOM 0 HG22 ILE A 26 7.716 19.399 0.358 1.00 0.74 H new ATOM 0 HG23 ILE A 26 7.786 17.971 1.418 1.00 0.74 H new ATOM 0 HD11 ILE A 26 7.008 14.670 -1.027 1.00 0.83 H new ATOM 0 HD12 ILE A 26 6.986 16.121 -2.058 1.00 0.83 H new ATOM 0 HD13 ILE A 26 8.148 16.000 -0.716 1.00 0.83 H new ATOM 367 N CYS A 27 5.649 20.136 2.520 1.00 0.56 N ATOM 368 CA CYS A 27 6.008 21.441 3.083 1.00 0.56 C ATOM 369 C CYS A 27 7.132 21.253 4.104 1.00 0.55 C ATOM 370 O CYS A 27 7.180 20.236 4.772 1.00 0.59 O ATOM 371 CB CYS A 27 4.796 22.099 3.740 1.00 0.60 C ATOM 372 SG CYS A 27 4.958 23.901 3.952 1.00 0.92 S ATOM 0 H CYS A 27 5.564 19.396 3.217 1.00 0.56 H new ATOM 0 HA CYS A 27 6.349 22.096 2.281 1.00 0.56 H new ATOM 0 HB2 CYS A 27 3.912 21.892 3.137 1.00 0.60 H new ATOM 0 HB3 CYS A 27 4.631 21.642 4.716 1.00 0.60 H new ATOM 377 N CYS A 28 8.055 22.208 4.180 1.00 0.56 N ATOM 378 CA CYS A 28 9.214 22.117 5.071 1.00 0.58 C ATOM 379 C CYS A 28 9.523 23.424 5.829 1.00 0.61 C ATOM 380 O CYS A 28 9.212 24.533 5.387 1.00 0.76 O ATOM 381 CB CYS A 28 10.483 21.709 4.287 1.00 0.65 C ATOM 382 SG CYS A 28 11.070 20.034 4.599 1.00 1.28 S ATOM 0 H CYS A 28 8.023 23.065 3.628 1.00 0.56 H new ATOM 0 HA CYS A 28 8.944 21.357 5.805 1.00 0.58 H new ATOM 0 HB2 CYS A 28 10.282 21.814 3.221 1.00 0.65 H new ATOM 0 HB3 CYS A 28 11.282 22.409 4.531 1.00 0.65 H new ATOM 387 N GLY A 29 10.241 23.242 6.962 1.00 0.62 N ATOM 388 CA GLY A 29 10.688 24.321 7.763 1.00 0.65 C ATOM 389 C GLY A 29 11.980 23.950 8.491 1.00 0.67 C ATOM 390 O GLY A 29 12.384 22.786 8.539 1.00 0.66 O ATOM 0 H GLY A 29 10.509 22.324 7.317 1.00 0.62 H new ATOM 0 HA2 GLY A 29 10.855 25.199 7.140 1.00 0.65 H new ATOM 0 HA3 GLY A 29 9.919 24.586 8.488 1.00 0.65 H new ATOM 394 N ASP A 30 12.583 24.952 9.079 1.00 0.72 N ATOM 395 CA ASP A 30 13.809 24.835 9.854 1.00 0.76 C ATOM 396 C ASP A 30 13.533 23.974 11.075 1.00 0.77 C ATOM 397 O ASP A 30 14.273 23.054 11.423 1.00 0.80 O ATOM 398 CB ASP A 30 14.334 26.220 10.248 1.00 0.84 C ATOM 399 CG ASP A 30 13.300 27.046 10.988 1.00 1.41 C ATOM 400 OD1 ASP A 30 12.148 27.124 10.515 1.00 1.92 O ATOM 401 OD2 ASP A 30 13.646 27.611 12.047 1.00 2.27 O ATOM 0 H ASP A 30 12.228 25.907 9.035 1.00 0.72 H new ATOM 0 HA ASP A 30 14.585 24.360 9.253 1.00 0.76 H new ATOM 0 HB2 ASP A 30 15.218 26.105 10.875 1.00 0.84 H new ATOM 0 HB3 ASP A 30 14.647 26.755 9.351 1.00 0.84 H new ATOM 406 N GLU A 31 12.461 24.330 11.720 1.00 0.78 N ATOM 407 CA GLU A 31 12.011 23.640 12.903 1.00 0.83 C ATOM 408 C GLU A 31 10.633 23.099 12.663 1.00 0.87 C ATOM 409 O GLU A 31 9.887 22.841 13.601 1.00 1.00 O ATOM 410 CB GLU A 31 12.053 24.515 14.152 1.00 0.90 C ATOM 411 CG GLU A 31 13.063 25.637 14.074 1.00 0.99 C ATOM 412 CD GLU A 31 13.453 26.156 15.437 1.00 1.14 C ATOM 413 OE1 GLU A 31 14.212 25.461 16.141 1.00 1.66 O ATOM 414 OE2 GLU A 31 12.995 27.260 15.801 1.00 1.64 O ATOM 0 H GLU A 31 11.867 25.112 11.442 1.00 0.78 H new ATOM 0 HA GLU A 31 12.700 22.818 13.096 1.00 0.83 H new ATOM 0 HB2 GLU A 31 11.063 24.940 14.321 1.00 0.90 H new ATOM 0 HB3 GLU A 31 12.283 23.890 15.015 1.00 0.90 H new ATOM 0 HG2 GLU A 31 13.954 25.285 13.554 1.00 0.99 H new ATOM 0 HG3 GLU A 31 12.650 26.454 13.482 1.00 0.99 H new ATOM 421 N LEU A 32 10.254 23.026 11.396 1.00 0.82 N ATOM 422 CA LEU A 32 8.975 22.596 10.985 1.00 0.88 C ATOM 423 C LEU A 32 9.118 21.370 10.091 1.00 0.82 C ATOM 424 O LEU A 32 8.133 20.754 9.678 1.00 0.90 O ATOM 425 CB LEU A 32 8.376 23.761 10.249 1.00 0.93 C ATOM 426 CG LEU A 32 7.237 24.470 10.988 1.00 1.15 C ATOM 427 CD1 LEU A 32 7.557 25.948 11.177 1.00 1.24 C ATOM 428 CD2 LEU A 32 5.931 24.299 10.256 1.00 1.37 C ATOM 0 H LEU A 32 10.866 23.278 10.620 1.00 0.82 H new ATOM 0 HA LEU A 32 8.336 22.303 11.818 1.00 0.88 H new ATOM 0 HB2 LEU A 32 9.163 24.486 10.043 1.00 0.93 H new ATOM 0 HB3 LEU A 32 8.004 23.412 9.286 1.00 0.93 H new ATOM 0 HG LEU A 32 7.136 24.012 11.972 1.00 1.15 H new ATOM 0 HD11 LEU A 32 6.736 26.434 11.704 1.00 1.24 H new ATOM 0 HD12 LEU A 32 8.473 26.050 11.759 1.00 1.24 H new ATOM 0 HD13 LEU A 32 7.692 26.418 10.203 1.00 1.24 H new ATOM 0 HD21 LEU A 32 5.138 24.812 10.801 1.00 1.37 H new ATOM 0 HD22 LEU A 32 6.016 24.723 9.256 1.00 1.37 H new ATOM 0 HD23 LEU A 32 5.692 23.238 10.181 1.00 1.37 H new ATOM 440 N GLY A 33 10.371 21.003 9.841 1.00 0.73 N ATOM 441 CA GLY A 33 10.660 19.844 9.050 1.00 0.71 C ATOM 442 C GLY A 33 9.872 19.776 7.770 1.00 0.67 C ATOM 443 O GLY A 33 9.782 20.768 7.064 1.00 0.65 O ATOM 0 H GLY A 33 11.193 21.501 10.182 1.00 0.73 H new ATOM 0 HA2 GLY A 33 11.724 19.832 8.813 1.00 0.71 H new ATOM 0 HA3 GLY A 33 10.455 18.951 9.641 1.00 0.71 H new ATOM 447 N CYS A 34 9.250 18.636 7.464 1.00 0.70 N ATOM 448 CA CYS A 34 8.475 18.544 6.250 1.00 0.69 C ATOM 449 C CYS A 34 7.204 17.812 6.454 1.00 0.65 C ATOM 450 O CYS A 34 7.223 16.591 6.628 1.00 0.62 O ATOM 451 CB CYS A 34 9.254 17.810 5.195 1.00 0.73 C ATOM 452 SG CYS A 34 9.680 18.834 3.770 1.00 1.08 S ATOM 0 H CYS A 34 9.272 17.789 8.032 1.00 0.70 H new ATOM 0 HA CYS A 34 8.256 19.566 5.942 1.00 0.69 H new ATOM 0 HB2 CYS A 34 10.170 17.418 5.638 1.00 0.73 H new ATOM 0 HB3 CYS A 34 8.672 16.953 4.856 1.00 0.73 H new ATOM 457 N PHE A 35 6.075 18.487 6.339 1.00 0.68 N ATOM 458 CA PHE A 35 4.839 17.787 6.447 1.00 0.67 C ATOM 459 C PHE A 35 4.554 17.290 5.066 1.00 0.64 C ATOM 460 O PHE A 35 4.236 18.085 4.180 1.00 0.63 O ATOM 461 CB PHE A 35 3.721 18.737 6.886 1.00 0.69 C ATOM 462 CG PHE A 35 4.112 19.618 8.030 1.00 0.73 C ATOM 463 CD1 PHE A 35 4.290 19.091 9.297 1.00 0.98 C ATOM 464 CD2 PHE A 35 4.316 20.967 7.835 1.00 1.16 C ATOM 465 CE1 PHE A 35 4.665 19.893 10.349 1.00 1.21 C ATOM 466 CE2 PHE A 35 4.688 21.776 8.880 1.00 1.38 C ATOM 467 CZ PHE A 35 4.864 21.240 10.144 1.00 1.26 C ATOM 0 H PHE A 35 6.002 19.491 6.175 1.00 0.68 H new ATOM 0 HA PHE A 35 4.894 16.984 7.182 1.00 0.67 H new ATOM 0 HB2 PHE A 35 3.429 19.359 6.040 1.00 0.69 H new ATOM 0 HB3 PHE A 35 2.846 18.152 7.169 1.00 0.69 H new ATOM 0 HD1 PHE A 35 4.132 18.035 9.462 1.00 0.98 H new ATOM 0 HD2 PHE A 35 4.182 21.392 6.851 1.00 1.16 H new ATOM 0 HE1 PHE A 35 4.803 19.468 11.332 1.00 1.21 H new ATOM 0 HE2 PHE A 35 4.844 22.832 8.716 1.00 1.38 H new ATOM 0 HZ PHE A 35 5.156 21.876 10.966 1.00 1.26 H new ATOM 477 N VAL A 36 4.679 16.006 4.844 1.00 0.67 N ATOM 478 CA VAL A 36 4.430 15.520 3.529 1.00 0.68 C ATOM 479 C VAL A 36 2.976 15.120 3.421 1.00 0.71 C ATOM 480 O VAL A 36 2.588 13.964 3.604 1.00 0.74 O ATOM 481 CB VAL A 36 5.392 14.384 3.131 1.00 0.74 C ATOM 482 CG1 VAL A 36 5.325 14.158 1.623 1.00 0.75 C ATOM 483 CG2 VAL A 36 6.827 14.734 3.562 1.00 0.76 C ATOM 0 H VAL A 36 4.943 15.306 5.537 1.00 0.67 H new ATOM 0 HA VAL A 36 4.626 16.317 2.812 1.00 0.68 H new ATOM 0 HB VAL A 36 5.095 13.465 3.637 1.00 0.74 H new ATOM 0 HG11 VAL A 36 6.007 13.354 1.345 1.00 0.75 H new ATOM 0 HG12 VAL A 36 4.308 13.886 1.341 1.00 0.75 H new ATOM 0 HG13 VAL A 36 5.613 15.073 1.105 1.00 0.75 H new ATOM 0 HG21 VAL A 36 7.500 13.925 3.277 1.00 0.76 H new ATOM 0 HG22 VAL A 36 7.139 15.656 3.072 1.00 0.76 H new ATOM 0 HG23 VAL A 36 6.860 14.869 4.643 1.00 0.76 H new ATOM 493 N GLY A 37 2.182 16.137 3.114 1.00 0.71 N ATOM 494 CA GLY A 37 0.748 15.963 2.945 1.00 0.76 C ATOM 495 C GLY A 37 -0.079 16.128 4.215 1.00 0.72 C ATOM 496 O GLY A 37 -0.089 15.258 5.082 1.00 0.81 O ATOM 0 H GLY A 37 2.509 17.093 2.977 1.00 0.71 H new ATOM 0 HA2 GLY A 37 0.396 16.681 2.205 1.00 0.76 H new ATOM 0 HA3 GLY A 37 0.564 14.969 2.537 1.00 0.76 H new ATOM 500 N THR A 38 -0.808 17.236 4.277 1.00 0.68 N ATOM 501 CA THR A 38 -1.694 17.567 5.399 1.00 0.68 C ATOM 502 C THR A 38 -2.334 18.910 5.107 1.00 0.72 C ATOM 503 O THR A 38 -1.957 19.543 4.122 1.00 0.77 O ATOM 504 CB THR A 38 -0.898 17.659 6.707 1.00 0.72 C ATOM 505 OG1 THR A 38 -1.513 18.572 7.609 1.00 0.77 O ATOM 506 CG2 THR A 38 0.537 18.099 6.499 1.00 0.76 C ATOM 0 H THR A 38 -0.804 17.943 3.542 1.00 0.68 H new ATOM 0 HA THR A 38 -2.450 16.790 5.512 1.00 0.68 H new ATOM 0 HB THR A 38 -0.893 16.650 7.119 1.00 0.72 H new ATOM 0 HG1 THR A 38 -0.842 19.202 7.945 1.00 0.77 H new ATOM 0 HG21 THR A 38 1.047 18.145 7.461 1.00 0.76 H new ATOM 0 HG22 THR A 38 1.046 17.385 5.852 1.00 0.76 H new ATOM 0 HG23 THR A 38 0.552 19.085 6.034 1.00 0.76 H new ATOM 514 N ALA A 39 -3.357 19.348 5.843 1.00 0.77 N ATOM 515 CA ALA A 39 -3.998 20.611 5.521 1.00 0.86 C ATOM 516 C ALA A 39 -3.041 21.798 5.472 1.00 0.82 C ATOM 517 O ALA A 39 -3.238 22.708 4.668 1.00 0.86 O ATOM 518 CB ALA A 39 -5.100 20.891 6.536 1.00 1.02 C ATOM 0 H ALA A 39 -3.748 18.856 6.647 1.00 0.77 H new ATOM 0 HA ALA A 39 -4.404 20.503 4.515 1.00 0.86 H new ATOM 0 HB1 ALA A 39 -5.583 21.838 6.297 1.00 1.02 H new ATOM 0 HB2 ALA A 39 -5.838 20.089 6.503 1.00 1.02 H new ATOM 0 HB3 ALA A 39 -4.669 20.946 7.536 1.00 1.02 H new ATOM 524 N GLU A 40 -1.999 21.796 6.297 1.00 0.78 N ATOM 525 CA GLU A 40 -1.044 22.898 6.295 1.00 0.79 C ATOM 526 C GLU A 40 -0.301 22.957 4.973 1.00 0.74 C ATOM 527 O GLU A 40 0.233 23.999 4.590 1.00 0.79 O ATOM 528 CB GLU A 40 -0.040 22.733 7.435 1.00 0.82 C ATOM 529 CG GLU A 40 -0.422 23.486 8.699 1.00 1.25 C ATOM 530 CD GLU A 40 -0.772 22.555 9.842 1.00 1.55 C ATOM 531 OE1 GLU A 40 -1.882 21.985 9.826 1.00 2.32 O ATOM 532 OE2 GLU A 40 0.068 22.394 10.754 1.00 1.91 O ATOM 0 H GLU A 40 -1.796 21.054 6.967 1.00 0.78 H new ATOM 0 HA GLU A 40 -1.598 23.827 6.434 1.00 0.79 H new ATOM 0 HB2 GLU A 40 0.059 21.673 7.670 1.00 0.82 H new ATOM 0 HB3 GLU A 40 0.938 23.078 7.099 1.00 0.82 H new ATOM 0 HG2 GLU A 40 0.405 24.130 8.999 1.00 1.25 H new ATOM 0 HG3 GLU A 40 -1.272 24.135 8.489 1.00 1.25 H new ATOM 539 N ALA A 41 -0.251 21.827 4.282 1.00 0.70 N ATOM 540 CA ALA A 41 0.435 21.742 3.031 1.00 0.71 C ATOM 541 C ALA A 41 -0.522 21.928 1.878 1.00 0.78 C ATOM 542 O ALA A 41 -0.078 22.148 0.761 1.00 0.87 O ATOM 543 CB ALA A 41 1.148 20.401 2.914 1.00 0.77 C ATOM 0 H ALA A 41 -0.687 20.956 4.583 1.00 0.70 H new ATOM 0 HA ALA A 41 1.175 22.541 2.991 1.00 0.71 H new ATOM 0 HB1 ALA A 41 1.667 20.347 1.957 1.00 0.77 H new ATOM 0 HB2 ALA A 41 1.870 20.301 3.725 1.00 0.77 H new ATOM 0 HB3 ALA A 41 0.418 19.594 2.976 1.00 0.77 H new ATOM 549 N LEU A 42 -1.842 21.840 2.106 1.00 0.81 N ATOM 550 CA LEU A 42 -2.805 22.001 1.025 1.00 0.94 C ATOM 551 C LEU A 42 -2.494 23.205 0.146 1.00 1.05 C ATOM 552 O LEU A 42 -2.523 23.099 -1.073 1.00 1.23 O ATOM 553 CB LEU A 42 -4.217 22.112 1.611 1.00 0.98 C ATOM 554 CG LEU A 42 -4.962 20.780 1.766 1.00 1.02 C ATOM 555 CD1 LEU A 42 -6.001 20.864 2.877 1.00 1.11 C ATOM 556 CD2 LEU A 42 -5.617 20.380 0.453 1.00 1.16 C ATOM 0 H LEU A 42 -2.255 21.660 3.021 1.00 0.81 H new ATOM 0 HA LEU A 42 -2.740 21.121 0.385 1.00 0.94 H new ATOM 0 HB2 LEU A 42 -4.152 22.590 2.588 1.00 0.98 H new ATOM 0 HB3 LEU A 42 -4.808 22.769 0.973 1.00 0.98 H new ATOM 0 HG LEU A 42 -4.235 20.015 2.038 1.00 1.02 H new ATOM 0 HD11 LEU A 42 -6.516 19.907 2.967 1.00 1.11 H new ATOM 0 HD12 LEU A 42 -5.507 21.101 3.820 1.00 1.11 H new ATOM 0 HD13 LEU A 42 -6.724 21.644 2.640 1.00 1.11 H new ATOM 0 HD21 LEU A 42 -6.141 19.433 0.581 1.00 1.16 H new ATOM 0 HD22 LEU A 42 -6.327 21.150 0.151 1.00 1.16 H new ATOM 0 HD23 LEU A 42 -4.853 20.270 -0.316 1.00 1.16 H new ATOM 568 N ARG A 43 -2.161 24.342 0.746 1.00 1.04 N ATOM 569 CA ARG A 43 -1.812 25.518 -0.052 1.00 1.23 C ATOM 570 C ARG A 43 -0.562 25.215 -0.905 1.00 1.24 C ATOM 571 O ARG A 43 -0.276 25.895 -1.886 1.00 1.46 O ATOM 572 CB ARG A 43 -1.576 26.733 0.862 1.00 1.32 C ATOM 573 CG ARG A 43 -0.122 26.957 1.256 1.00 1.34 C ATOM 574 CD ARG A 43 0.563 27.938 0.317 1.00 1.50 C ATOM 575 NE ARG A 43 -0.264 29.114 0.046 1.00 1.88 N ATOM 576 CZ ARG A 43 -0.505 30.076 0.934 1.00 2.20 C ATOM 577 NH1 ARG A 43 -0.001 30.001 2.160 1.00 2.39 N ATOM 578 NH2 ARG A 43 -1.259 31.115 0.598 1.00 2.92 N ATOM 0 H ARG A 43 -2.124 24.477 1.756 1.00 1.04 H new ATOM 0 HA ARG A 43 -2.639 25.758 -0.721 1.00 1.23 H new ATOM 0 HB2 ARG A 43 -1.944 27.627 0.358 1.00 1.32 H new ATOM 0 HB3 ARG A 43 -2.169 26.610 1.768 1.00 1.32 H new ATOM 0 HG2 ARG A 43 -0.074 27.335 2.277 1.00 1.34 H new ATOM 0 HG3 ARG A 43 0.411 26.006 1.243 1.00 1.34 H new ATOM 0 HD2 ARG A 43 1.510 28.255 0.754 1.00 1.50 H new ATOM 0 HD3 ARG A 43 0.797 27.436 -0.622 1.00 1.50 H new ATOM 0 HE ARG A 43 -0.682 29.202 -0.880 1.00 1.88 H new ATOM 0 HH11 ARG A 43 0.575 29.203 2.427 1.00 2.39 H new ATOM 0 HH12 ARG A 43 -0.190 30.742 2.835 1.00 2.39 H new ATOM 0 HH21 ARG A 43 -1.654 31.176 -0.341 1.00 2.92 H new ATOM 0 HH22 ARG A 43 -1.444 31.852 1.278 1.00 2.92 H new ATOM 592 N CYS A 44 0.058 24.080 -0.581 1.00 1.08 N ATOM 593 CA CYS A 44 1.196 23.590 -1.371 1.00 1.15 C ATOM 594 C CYS A 44 0.699 22.962 -2.682 1.00 1.41 C ATOM 595 O CYS A 44 1.480 22.419 -3.463 1.00 1.57 O ATOM 596 CB CYS A 44 2.105 22.624 -0.603 1.00 1.04 C ATOM 597 SG CYS A 44 2.689 23.237 1.017 1.00 1.28 S ATOM 0 H CYS A 44 -0.200 23.489 0.209 1.00 1.08 H new ATOM 0 HA CYS A 44 1.816 24.457 -1.599 1.00 1.15 H new ATOM 0 HB2 CYS A 44 1.568 21.688 -0.448 1.00 1.04 H new ATOM 0 HB3 CYS A 44 2.972 22.395 -1.222 1.00 1.04 H new ATOM 602 N GLN A 45 -0.616 23.058 -2.917 1.00 1.55 N ATOM 603 CA GLN A 45 -1.232 22.520 -4.130 1.00 1.86 C ATOM 604 C GLN A 45 -1.013 23.450 -5.322 1.00 2.09 C ATOM 605 O GLN A 45 -1.130 23.034 -6.478 1.00 2.35 O ATOM 606 CB GLN A 45 -2.736 22.301 -3.924 1.00 1.97 C ATOM 607 CG GLN A 45 -3.203 20.903 -4.298 1.00 2.40 C ATOM 608 CD GLN A 45 -4.713 20.765 -4.283 1.00 2.73 C ATOM 609 OE1 GLN A 45 -5.318 20.541 -3.234 1.00 3.31 O ATOM 610 NE2 GLN A 45 -5.333 20.897 -5.451 1.00 3.02 N ATOM 0 H GLN A 45 -1.273 23.506 -2.278 1.00 1.55 H new ATOM 0 HA GLN A 45 -0.754 21.563 -4.340 1.00 1.86 H new ATOM 0 HB2 GLN A 45 -2.983 22.490 -2.879 1.00 1.97 H new ATOM 0 HB3 GLN A 45 -3.286 23.030 -4.519 1.00 1.97 H new ATOM 0 HG2 GLN A 45 -2.830 20.654 -5.291 1.00 2.40 H new ATOM 0 HG3 GLN A 45 -2.770 20.182 -3.604 1.00 2.40 H new ATOM 0 HE21 GLN A 45 -4.794 21.082 -6.297 1.00 3.02 H new ATOM 0 HE22 GLN A 45 -6.348 20.813 -5.502 1.00 3.02 H new ATOM 619 N GLU A 46 -0.678 24.706 -5.052 1.00 2.07 N ATOM 620 CA GLU A 46 -0.461 25.651 -6.136 1.00 2.35 C ATOM 621 C GLU A 46 0.978 25.584 -6.622 1.00 2.34 C ATOM 622 O GLU A 46 1.350 26.251 -7.591 1.00 2.50 O ATOM 623 CB GLU A 46 -0.796 27.075 -5.678 1.00 2.41 C ATOM 624 CG GLU A 46 -1.051 28.041 -6.825 1.00 2.80 C ATOM 625 CD GLU A 46 -1.078 29.490 -6.378 1.00 3.19 C ATOM 626 OE1 GLU A 46 -2.076 29.899 -5.749 1.00 3.53 O ATOM 627 OE2 GLU A 46 -0.101 30.216 -6.660 1.00 3.69 O ATOM 0 H GLU A 46 -0.553 25.086 -4.114 1.00 2.07 H new ATOM 0 HA GLU A 46 -1.120 25.383 -6.961 1.00 2.35 H new ATOM 0 HB2 GLU A 46 -1.678 27.044 -5.038 1.00 2.41 H new ATOM 0 HB3 GLU A 46 0.025 27.455 -5.070 1.00 2.41 H new ATOM 0 HG2 GLU A 46 -0.276 27.913 -7.581 1.00 2.80 H new ATOM 0 HG3 GLU A 46 -2.001 27.794 -7.298 1.00 2.80 H new ATOM 634 N GLU A 47 1.769 24.715 -5.997 1.00 2.22 N ATOM 635 CA GLU A 47 3.144 24.528 -6.410 1.00 2.31 C ATOM 636 C GLU A 47 3.196 23.558 -7.584 1.00 2.34 C ATOM 637 O GLU A 47 4.272 23.216 -8.073 1.00 2.42 O ATOM 638 CB GLU A 47 3.993 23.999 -5.252 1.00 2.37 C ATOM 639 CG GLU A 47 5.382 24.613 -5.190 1.00 2.96 C ATOM 640 CD GLU A 47 6.471 23.645 -5.613 1.00 3.45 C ATOM 641 OE1 GLU A 47 6.158 22.679 -6.339 1.00 3.68 O ATOM 642 OE2 GLU A 47 7.638 23.856 -5.221 1.00 3.99 O ATOM 0 H GLU A 47 1.478 24.136 -5.209 1.00 2.22 H new ATOM 0 HA GLU A 47 3.551 25.491 -6.717 1.00 2.31 H new ATOM 0 HB2 GLU A 47 3.475 24.195 -4.313 1.00 2.37 H new ATOM 0 HB3 GLU A 47 4.086 22.917 -5.345 1.00 2.37 H new ATOM 0 HG2 GLU A 47 5.415 25.493 -5.832 1.00 2.96 H new ATOM 0 HG3 GLU A 47 5.579 24.953 -4.173 1.00 2.96 H new ATOM 649 N ASN A 48 2.018 23.136 -8.051 1.00 2.53 N ATOM 650 CA ASN A 48 1.943 22.235 -9.181 1.00 2.96 C ATOM 651 C ASN A 48 1.685 23.022 -10.458 1.00 3.29 C ATOM 652 O ASN A 48 2.083 22.604 -11.545 1.00 3.76 O ATOM 653 CB ASN A 48 0.849 21.186 -8.976 1.00 3.12 C ATOM 654 CG ASN A 48 1.409 19.779 -8.987 1.00 3.42 C ATOM 655 OD1 ASN A 48 0.992 18.936 -9.782 1.00 3.86 O ATOM 656 ND2 ASN A 48 2.359 19.519 -8.099 1.00 3.75 N ATOM 0 H ASN A 48 1.115 23.407 -7.661 1.00 2.53 H new ATOM 0 HA ASN A 48 2.897 21.715 -9.268 1.00 2.96 H new ATOM 0 HB2 ASN A 48 0.344 21.369 -8.028 1.00 3.12 H new ATOM 0 HB3 ASN A 48 0.099 21.285 -9.761 1.00 3.12 H new ATOM 0 HD21 ASN A 48 2.775 18.589 -8.055 1.00 3.75 H new ATOM 0 HD22 ASN A 48 2.673 20.249 -7.460 1.00 3.75 H new ATOM 663 N TYR A 49 1.021 24.171 -10.324 1.00 3.15 N ATOM 664 CA TYR A 49 0.713 25.007 -11.483 1.00 3.51 C ATOM 665 C TYR A 49 1.966 25.664 -12.074 1.00 3.62 C ATOM 666 O TYR A 49 1.861 26.527 -12.945 1.00 4.04 O ATOM 667 CB TYR A 49 -0.309 26.081 -11.102 1.00 3.61 C ATOM 668 CG TYR A 49 -1.551 25.527 -10.439 1.00 3.97 C ATOM 669 CD1 TYR A 49 -2.406 24.664 -11.115 1.00 4.19 C ATOM 670 CD2 TYR A 49 -1.862 25.862 -9.133 1.00 4.52 C ATOM 671 CE1 TYR A 49 -3.536 24.154 -10.502 1.00 4.70 C ATOM 672 CE2 TYR A 49 -2.989 25.359 -8.510 1.00 5.05 C ATOM 673 CZ TYR A 49 -3.822 24.506 -9.199 1.00 5.03 C ATOM 674 OH TYR A 49 -4.944 24.002 -8.583 1.00 5.68 O ATOM 0 H TYR A 49 0.689 24.541 -9.433 1.00 3.15 H new ATOM 0 HA TYR A 49 0.293 24.355 -12.249 1.00 3.51 H new ATOM 0 HB2 TYR A 49 0.163 26.797 -10.430 1.00 3.61 H new ATOM 0 HB3 TYR A 49 -0.599 26.629 -11.999 1.00 3.61 H new ATOM 0 HD1 TYR A 49 -2.184 24.387 -12.135 1.00 4.19 H new ATOM 0 HD2 TYR A 49 -1.211 26.530 -8.589 1.00 4.52 H new ATOM 0 HE1 TYR A 49 -4.191 23.484 -11.040 1.00 4.70 H new ATOM 0 HE2 TYR A 49 -3.215 25.633 -7.490 1.00 5.05 H new ATOM 0 HH TYR A 49 -4.998 24.348 -7.668 1.00 5.68 H new ATOM 684 N LEU A 50 3.148 25.265 -11.604 1.00 3.50 N ATOM 685 CA LEU A 50 4.399 25.832 -12.101 1.00 3.67 C ATOM 686 C LEU A 50 5.400 24.734 -12.461 1.00 3.63 C ATOM 687 O LEU A 50 5.775 23.929 -11.610 1.00 3.79 O ATOM 688 CB LEU A 50 5.014 26.756 -11.049 1.00 4.02 C ATOM 689 CG LEU A 50 4.292 28.090 -10.852 1.00 4.66 C ATOM 690 CD1 LEU A 50 4.104 28.382 -9.371 1.00 4.84 C ATOM 691 CD2 LEU A 50 5.060 29.218 -11.526 1.00 5.40 C ATOM 0 H LEU A 50 3.264 24.554 -10.882 1.00 3.50 H new ATOM 0 HA LEU A 50 4.171 26.402 -13.001 1.00 3.67 H new ATOM 0 HB2 LEU A 50 5.037 26.229 -10.095 1.00 4.02 H new ATOM 0 HB3 LEU A 50 6.048 26.958 -11.327 1.00 4.02 H new ATOM 0 HG LEU A 50 3.308 28.020 -11.316 1.00 4.66 H new ATOM 0 HD11 LEU A 50 3.589 29.335 -9.251 1.00 4.84 H new ATOM 0 HD12 LEU A 50 3.511 27.589 -8.916 1.00 4.84 H new ATOM 0 HD13 LEU A 50 5.078 28.432 -8.884 1.00 4.84 H new ATOM 0 HD21 LEU A 50 4.531 30.159 -11.375 1.00 5.40 H new ATOM 0 HD22 LEU A 50 6.058 29.289 -11.092 1.00 5.40 H new ATOM 0 HD23 LEU A 50 5.142 29.015 -12.594 1.00 5.40 H new ATOM 703 N PRO A 51 5.855 24.687 -13.728 1.00 3.88 N ATOM 704 CA PRO A 51 6.819 23.682 -14.177 1.00 4.25 C ATOM 705 C PRO A 51 8.255 24.049 -13.799 1.00 4.32 C ATOM 706 O PRO A 51 9.157 24.005 -14.636 1.00 4.70 O ATOM 707 CB PRO A 51 6.643 23.700 -15.694 1.00 4.88 C ATOM 708 CG PRO A 51 6.253 25.104 -16.007 1.00 4.92 C ATOM 709 CD PRO A 51 5.470 25.604 -14.819 1.00 4.30 C ATOM 0 HA PRO A 51 6.648 22.707 -13.721 1.00 4.25 H new ATOM 0 HB2 PRO A 51 7.565 23.421 -16.204 1.00 4.88 H new ATOM 0 HB3 PRO A 51 5.876 22.994 -16.013 1.00 4.88 H new ATOM 0 HG2 PRO A 51 7.134 25.722 -16.180 1.00 4.92 H new ATOM 0 HG3 PRO A 51 5.651 25.147 -16.915 1.00 4.92 H new ATOM 0 HD2 PRO A 51 5.723 26.637 -14.580 1.00 4.30 H new ATOM 0 HD3 PRO A 51 4.397 25.573 -15.006 1.00 4.30 H new ATOM 717 N SER A 52 8.458 24.411 -12.533 1.00 4.18 N ATOM 718 CA SER A 52 9.782 24.785 -12.043 1.00 4.35 C ATOM 719 C SER A 52 10.024 24.217 -10.642 1.00 3.79 C ATOM 720 O SER A 52 9.079 23.863 -9.937 1.00 3.48 O ATOM 721 CB SER A 52 9.932 26.309 -12.028 1.00 4.83 C ATOM 722 OG SER A 52 8.913 26.915 -11.252 1.00 5.64 O ATOM 0 H SER A 52 7.722 24.453 -11.829 1.00 4.18 H new ATOM 0 HA SER A 52 10.527 24.364 -12.718 1.00 4.35 H new ATOM 0 HB2 SER A 52 10.908 26.577 -11.625 1.00 4.83 H new ATOM 0 HB3 SER A 52 9.892 26.691 -13.048 1.00 4.83 H new ATOM 0 HG SER A 52 9.033 27.888 -11.257 1.00 5.64 H new ATOM 728 N PRO A 53 11.301 24.105 -10.229 1.00 3.98 N ATOM 729 CA PRO A 53 11.679 23.559 -8.921 1.00 3.75 C ATOM 730 C PRO A 53 11.602 24.586 -7.783 1.00 2.89 C ATOM 731 O PRO A 53 10.976 25.636 -7.919 1.00 2.99 O ATOM 732 CB PRO A 53 13.137 23.105 -9.132 1.00 4.57 C ATOM 733 CG PRO A 53 13.491 23.457 -10.548 1.00 5.04 C ATOM 734 CD PRO A 53 12.485 24.473 -11.004 1.00 4.80 C ATOM 0 HA PRO A 53 10.999 22.763 -8.615 1.00 3.75 H new ATOM 0 HB2 PRO A 53 13.804 23.604 -8.429 1.00 4.57 H new ATOM 0 HB3 PRO A 53 13.238 22.033 -8.961 1.00 4.57 H new ATOM 0 HG2 PRO A 53 14.502 23.861 -10.605 1.00 5.04 H new ATOM 0 HG3 PRO A 53 13.464 22.573 -11.185 1.00 5.04 H new ATOM 0 HD2 PRO A 53 12.810 25.492 -10.792 1.00 4.80 H new ATOM 0 HD3 PRO A 53 12.304 24.413 -12.077 1.00 4.80 H new ATOM 742 N CYS A 54 12.247 24.254 -6.659 1.00 2.53 N ATOM 743 CA CYS A 54 12.278 25.115 -5.468 1.00 2.00 C ATOM 744 C CYS A 54 13.458 24.703 -4.570 1.00 2.22 C ATOM 745 O CYS A 54 13.582 23.523 -4.246 1.00 2.72 O ATOM 746 CB CYS A 54 10.949 24.985 -4.686 1.00 2.36 C ATOM 747 SG CYS A 54 10.327 26.524 -3.900 1.00 2.74 S ATOM 0 H CYS A 54 12.763 23.381 -6.548 1.00 2.53 H new ATOM 0 HA CYS A 54 12.403 26.153 -5.776 1.00 2.00 H new ATOM 0 HB2 CYS A 54 10.184 24.613 -5.367 1.00 2.36 H new ATOM 0 HB3 CYS A 54 11.079 24.231 -3.910 1.00 2.36 H new ATOM 752 N GLN A 55 14.354 25.640 -4.193 1.00 2.24 N ATOM 753 CA GLN A 55 15.514 25.256 -3.349 1.00 2.74 C ATOM 754 C GLN A 55 15.114 24.417 -2.133 1.00 2.26 C ATOM 755 O GLN A 55 13.974 23.979 -1.991 1.00 2.47 O ATOM 756 CB GLN A 55 16.277 26.471 -2.815 1.00 3.51 C ATOM 757 CG GLN A 55 15.663 27.062 -1.539 1.00 4.44 C ATOM 758 CD GLN A 55 16.581 26.948 -0.335 1.00 5.23 C ATOM 759 OE1 GLN A 55 17.804 26.998 -0.463 1.00 5.71 O ATOM 760 NE2 GLN A 55 15.990 26.795 0.847 1.00 5.75 N ATOM 0 H GLN A 55 14.306 26.627 -4.444 1.00 2.24 H new ATOM 0 HA GLN A 55 16.146 24.671 -4.017 1.00 2.74 H new ATOM 0 HB2 GLN A 55 17.309 26.183 -2.614 1.00 3.51 H new ATOM 0 HB3 GLN A 55 16.306 27.241 -3.586 1.00 3.51 H new ATOM 0 HG2 GLN A 55 15.424 28.112 -1.709 1.00 4.44 H new ATOM 0 HG3 GLN A 55 14.724 26.552 -1.323 1.00 4.44 H new ATOM 0 HE21 GLN A 55 14.972 26.759 0.908 1.00 5.75 H new ATOM 0 HE22 GLN A 55 16.554 26.714 1.693 1.00 5.75 H new ATOM 769 N SER A 56 16.093 24.237 -1.242 1.00 2.28 N ATOM 770 CA SER A 56 15.922 23.493 -0.006 1.00 2.07 C ATOM 771 C SER A 56 17.293 23.353 0.656 1.00 1.82 C ATOM 772 O SER A 56 18.178 24.167 0.421 1.00 2.22 O ATOM 773 CB SER A 56 15.345 22.107 -0.327 1.00 2.60 C ATOM 774 OG SER A 56 16.086 21.474 -1.364 1.00 3.12 O ATOM 0 H SER A 56 17.034 24.611 -1.366 1.00 2.28 H new ATOM 0 HA SER A 56 15.237 24.010 0.666 1.00 2.07 H new ATOM 0 HB2 SER A 56 15.362 21.486 0.568 1.00 2.60 H new ATOM 0 HB3 SER A 56 14.302 22.204 -0.628 1.00 2.60 H new ATOM 0 HG SER A 56 15.701 20.592 -1.550 1.00 3.12 H new ATOM 780 N GLY A 57 17.418 22.420 1.579 1.00 1.58 N ATOM 781 CA GLY A 57 18.669 22.268 2.292 1.00 1.86 C ATOM 782 C GLY A 57 19.631 21.446 1.465 1.00 1.68 C ATOM 783 O GLY A 57 19.205 20.608 0.676 1.00 2.10 O ATOM 0 H GLY A 57 16.683 21.767 1.849 1.00 1.58 H new ATOM 0 HA2 GLY A 57 19.100 23.247 2.502 1.00 1.86 H new ATOM 0 HA3 GLY A 57 18.494 21.783 3.253 1.00 1.86 H new ATOM 787 N GLN A 58 20.918 21.663 1.635 1.00 1.37 N ATOM 788 CA GLN A 58 21.891 20.899 0.881 1.00 1.46 C ATOM 789 C GLN A 58 22.478 19.817 1.758 1.00 1.08 C ATOM 790 O GLN A 58 23.623 19.886 2.198 1.00 1.00 O ATOM 791 CB GLN A 58 23.001 21.800 0.340 1.00 1.97 C ATOM 792 CG GLN A 58 22.491 22.995 -0.450 1.00 2.80 C ATOM 793 CD GLN A 58 21.850 22.607 -1.770 1.00 3.61 C ATOM 794 OE1 GLN A 58 20.638 22.731 -1.945 1.00 3.96 O ATOM 795 NE2 GLN A 58 22.665 22.145 -2.711 1.00 4.36 N ATOM 0 H GLN A 58 21.311 22.351 2.278 1.00 1.37 H new ATOM 0 HA GLN A 58 21.386 20.442 0.030 1.00 1.46 H new ATOM 0 HB2 GLN A 58 23.604 22.158 1.174 1.00 1.97 H new ATOM 0 HB3 GLN A 58 23.658 21.208 -0.298 1.00 1.97 H new ATOM 0 HG2 GLN A 58 21.764 23.539 0.154 1.00 2.80 H new ATOM 0 HG3 GLN A 58 23.320 23.676 -0.642 1.00 2.80 H new ATOM 0 HE21 GLN A 58 23.664 22.058 -2.523 1.00 4.36 H new ATOM 0 HE22 GLN A 58 22.292 21.877 -3.622 1.00 4.36 H new ATOM 804 N LYS A 59 21.698 18.778 1.926 1.00 1.17 N ATOM 805 CA LYS A 59 22.097 17.627 2.725 1.00 1.13 C ATOM 806 C LYS A 59 21.565 16.422 1.999 1.00 0.95 C ATOM 807 O LYS A 59 20.723 15.677 2.490 1.00 0.88 O ATOM 808 CB LYS A 59 21.469 17.706 4.134 1.00 1.54 C ATOM 809 CG LYS A 59 22.427 17.383 5.267 1.00 1.90 C ATOM 810 CD LYS A 59 22.831 18.640 6.019 1.00 2.17 C ATOM 811 CE LYS A 59 24.184 19.150 5.553 1.00 2.82 C ATOM 812 NZ LYS A 59 25.295 18.273 6.015 1.00 3.55 N ATOM 0 H LYS A 59 20.767 18.698 1.516 1.00 1.17 H new ATOM 0 HA LYS A 59 23.179 17.585 2.849 1.00 1.13 H new ATOM 0 HB2 LYS A 59 21.072 18.710 4.286 1.00 1.54 H new ATOM 0 HB3 LYS A 59 20.625 17.018 4.181 1.00 1.54 H new ATOM 0 HG2 LYS A 59 21.957 16.680 5.955 1.00 1.90 H new ATOM 0 HG3 LYS A 59 23.315 16.894 4.868 1.00 1.90 H new ATOM 0 HD2 LYS A 59 22.077 19.413 5.870 1.00 2.17 H new ATOM 0 HD3 LYS A 59 22.867 18.431 7.088 1.00 2.17 H new ATOM 0 HE2 LYS A 59 24.195 19.208 4.465 1.00 2.82 H new ATOM 0 HE3 LYS A 59 24.340 20.162 5.928 1.00 2.82 H new ATOM 0 HZ1 LYS A 59 26.193 18.796 5.968 1.00 3.55 H new ATOM 0 HZ2 LYS A 59 25.118 17.976 6.996 1.00 3.55 H new ATOM 0 HZ3 LYS A 59 25.351 17.433 5.404 1.00 3.55 H new ATOM 826 N PRO A 60 22.045 16.261 0.743 1.00 1.06 N ATOM 827 CA PRO A 60 21.609 15.188 -0.128 1.00 1.15 C ATOM 828 C PRO A 60 21.942 13.792 0.363 1.00 1.10 C ATOM 829 O PRO A 60 22.850 13.127 -0.137 1.00 1.23 O ATOM 830 CB PRO A 60 22.296 15.470 -1.460 1.00 1.48 C ATOM 831 CG PRO A 60 23.454 16.340 -1.119 1.00 1.54 C ATOM 832 CD PRO A 60 23.015 17.151 0.067 1.00 1.30 C ATOM 0 HA PRO A 60 20.521 15.182 -0.186 1.00 1.15 H new ATOM 0 HB2 PRO A 60 22.623 14.547 -1.939 1.00 1.48 H new ATOM 0 HB3 PRO A 60 21.620 15.967 -2.155 1.00 1.48 H new ATOM 0 HG2 PRO A 60 24.335 15.744 -0.882 1.00 1.54 H new ATOM 0 HG3 PRO A 60 23.721 16.984 -1.957 1.00 1.54 H new ATOM 0 HD2 PRO A 60 23.854 17.401 0.717 1.00 1.30 H new ATOM 0 HD3 PRO A 60 22.555 18.092 -0.236 1.00 1.30 H new ATOM 840 N CYS A 61 21.141 13.348 1.305 1.00 1.08 N ATOM 841 CA CYS A 61 21.232 12.007 1.849 1.00 1.13 C ATOM 842 C CYS A 61 20.161 11.186 1.152 1.00 1.36 C ATOM 843 O CYS A 61 19.469 11.703 0.275 1.00 1.54 O ATOM 844 CB CYS A 61 21.045 11.993 3.372 1.00 1.30 C ATOM 845 SG CYS A 61 19.351 11.634 3.936 1.00 1.59 S ATOM 0 H CYS A 61 20.400 13.912 1.721 1.00 1.08 H new ATOM 0 HA CYS A 61 22.223 11.589 1.673 1.00 1.13 H new ATOM 0 HB2 CYS A 61 21.719 11.250 3.799 1.00 1.30 H new ATOM 0 HB3 CYS A 61 21.346 12.962 3.769 1.00 1.30 H new ATOM 850 N GLY A 62 19.992 9.932 1.518 1.00 1.60 N ATOM 851 CA GLY A 62 18.957 9.171 0.864 1.00 1.92 C ATOM 852 C GLY A 62 19.311 8.858 -0.563 1.00 2.10 C ATOM 853 O GLY A 62 20.472 8.959 -0.959 1.00 2.43 O ATOM 0 H GLY A 62 20.531 9.440 2.230 1.00 1.60 H new ATOM 0 HA2 GLY A 62 18.789 8.242 1.409 1.00 1.92 H new ATOM 0 HA3 GLY A 62 18.022 9.730 0.892 1.00 1.92 H new ATOM 857 N SER A 63 18.331 8.403 -1.319 1.00 2.43 N ATOM 858 CA SER A 63 18.575 7.978 -2.720 1.00 2.98 C ATOM 859 C SER A 63 18.477 9.133 -3.674 1.00 2.74 C ATOM 860 O SER A 63 17.922 9.035 -4.769 1.00 3.32 O ATOM 861 CB SER A 63 17.599 6.880 -3.149 1.00 3.86 C ATOM 862 OG SER A 63 16.260 7.236 -2.858 1.00 4.11 O ATOM 0 H SER A 63 17.363 8.311 -1.009 1.00 2.43 H new ATOM 0 HA SER A 63 19.590 7.582 -2.753 1.00 2.98 H new ATOM 0 HB2 SER A 63 17.704 6.695 -4.218 1.00 3.86 H new ATOM 0 HB3 SER A 63 17.849 5.950 -2.639 1.00 3.86 H new ATOM 0 HG SER A 63 15.660 6.516 -3.145 1.00 4.11 H new ATOM 868 N GLY A 64 19.013 10.280 -3.205 1.00 2.15 N ATOM 869 CA GLY A 64 18.994 11.522 -3.966 1.00 2.11 C ATOM 870 C GLY A 64 18.270 12.674 -3.257 1.00 1.92 C ATOM 871 O GLY A 64 18.000 13.701 -3.880 1.00 2.21 O ATOM 0 H GLY A 64 19.465 10.359 -2.294 1.00 2.15 H new ATOM 0 HA2 GLY A 64 20.020 11.824 -4.175 1.00 2.11 H new ATOM 0 HA3 GLY A 64 18.513 11.340 -4.927 1.00 2.11 H new ATOM 875 N GLY A 65 17.927 12.516 -1.975 1.00 1.62 N ATOM 876 CA GLY A 65 17.210 13.580 -1.284 1.00 1.62 C ATOM 877 C GLY A 65 18.048 14.419 -0.329 1.00 1.43 C ATOM 878 O GLY A 65 18.796 13.896 0.493 1.00 1.62 O ATOM 0 H GLY A 65 18.128 11.688 -1.414 1.00 1.62 H new ATOM 0 HA2 GLY A 65 16.768 14.241 -2.030 1.00 1.62 H new ATOM 0 HA3 GLY A 65 16.387 13.136 -0.724 1.00 1.62 H new ATOM 882 N ARG A 66 17.891 15.738 -0.442 1.00 1.17 N ATOM 883 CA ARG A 66 18.590 16.695 0.412 1.00 1.03 C ATOM 884 C ARG A 66 17.692 17.134 1.568 1.00 0.94 C ATOM 885 O ARG A 66 16.470 17.111 1.439 1.00 1.04 O ATOM 886 CB ARG A 66 19.059 17.907 -0.383 1.00 1.10 C ATOM 887 CG ARG A 66 17.978 18.506 -1.265 1.00 1.26 C ATOM 888 CD ARG A 66 18.222 18.194 -2.728 1.00 1.41 C ATOM 889 NE ARG A 66 19.296 19.010 -3.286 1.00 1.78 N ATOM 890 CZ ARG A 66 19.911 18.738 -4.432 1.00 2.30 C ATOM 891 NH1 ARG A 66 19.563 17.671 -5.142 1.00 2.55 N ATOM 892 NH2 ARG A 66 20.876 19.533 -4.869 1.00 3.02 N ATOM 0 H ARG A 66 17.275 16.172 -1.129 1.00 1.17 H new ATOM 0 HA ARG A 66 19.471 16.198 0.819 1.00 1.03 H new ATOM 0 HB2 ARG A 66 19.417 18.670 0.309 1.00 1.10 H new ATOM 0 HB3 ARG A 66 19.906 17.618 -1.005 1.00 1.10 H new ATOM 0 HG2 ARG A 66 17.005 18.117 -0.966 1.00 1.26 H new ATOM 0 HG3 ARG A 66 17.947 19.586 -1.122 1.00 1.26 H new ATOM 0 HD2 ARG A 66 18.473 17.139 -2.837 1.00 1.41 H new ATOM 0 HD3 ARG A 66 17.306 18.364 -3.293 1.00 1.41 H new ATOM 0 HE ARG A 66 19.591 19.837 -2.766 1.00 1.78 H new ATOM 0 HH11 ARG A 66 18.821 17.056 -4.808 1.00 2.55 H new ATOM 0 HH12 ARG A 66 20.038 17.466 -6.021 1.00 2.55 H new ATOM 0 HH21 ARG A 66 21.146 20.353 -4.326 1.00 3.02 H new ATOM 0 HH22 ARG A 66 21.349 19.325 -5.749 1.00 3.02 H new ATOM 906 N CYS A 67 18.280 17.534 2.704 1.00 0.87 N ATOM 907 CA CYS A 67 17.467 17.958 3.834 1.00 0.87 C ATOM 908 C CYS A 67 16.701 19.227 3.486 1.00 0.88 C ATOM 909 O CYS A 67 17.272 20.304 3.443 1.00 0.93 O ATOM 910 CB CYS A 67 18.331 18.216 5.088 1.00 0.93 C ATOM 911 SG CYS A 67 18.580 16.760 6.170 1.00 1.52 S ATOM 0 H CYS A 67 19.288 17.570 2.856 1.00 0.87 H new ATOM 0 HA CYS A 67 16.768 17.151 4.054 1.00 0.87 H new ATOM 0 HB2 CYS A 67 19.306 18.584 4.769 1.00 0.93 H new ATOM 0 HB3 CYS A 67 17.867 19.010 5.673 1.00 0.93 H new ATOM 916 N ALA A 68 15.400 19.116 3.309 1.00 0.91 N ATOM 917 CA ALA A 68 14.573 20.298 3.042 1.00 0.98 C ATOM 918 C ALA A 68 14.276 20.970 4.377 1.00 0.98 C ATOM 919 O ALA A 68 13.890 22.136 4.460 1.00 1.07 O ATOM 920 CB ALA A 68 13.286 19.943 2.303 1.00 0.98 C ATOM 0 H ALA A 68 14.888 18.235 3.343 1.00 0.91 H new ATOM 0 HA ALA A 68 15.115 20.980 2.387 1.00 0.98 H new ATOM 0 HB1 ALA A 68 12.706 20.849 2.127 1.00 0.98 H new ATOM 0 HB2 ALA A 68 13.531 19.478 1.348 1.00 0.98 H new ATOM 0 HB3 ALA A 68 12.700 19.248 2.905 1.00 0.98 H new ATOM 926 N ALA A 69 14.528 20.187 5.412 1.00 0.92 N ATOM 927 CA ALA A 69 14.370 20.564 6.793 1.00 0.96 C ATOM 928 C ALA A 69 15.086 19.571 7.700 1.00 0.92 C ATOM 929 O ALA A 69 15.403 18.467 7.278 1.00 0.87 O ATOM 930 CB ALA A 69 12.926 20.631 7.138 1.00 1.00 C ATOM 0 H ALA A 69 14.863 19.230 5.300 1.00 0.92 H new ATOM 0 HA ALA A 69 14.814 21.548 6.942 1.00 0.96 H new ATOM 0 HB1 ALA A 69 12.815 20.917 8.184 1.00 1.00 H new ATOM 0 HB2 ALA A 69 12.435 21.370 6.506 1.00 1.00 H new ATOM 0 HB3 ALA A 69 12.468 19.655 6.978 1.00 1.00 H new ATOM 936 N ALA A 70 15.330 19.993 8.938 1.00 0.98 N ATOM 937 CA ALA A 70 16.018 19.183 9.971 1.00 1.00 C ATOM 938 C ALA A 70 16.062 17.676 9.636 1.00 1.04 C ATOM 939 O ALA A 70 16.328 17.305 8.498 1.00 1.24 O ATOM 940 CB ALA A 70 15.365 19.446 11.325 1.00 1.15 C ATOM 0 H ALA A 70 15.056 20.918 9.268 1.00 0.98 H new ATOM 0 HA ALA A 70 17.062 19.494 10.003 1.00 1.00 H new ATOM 0 HB1 ALA A 70 15.865 18.854 12.091 1.00 1.15 H new ATOM 0 HB2 ALA A 70 15.451 20.504 11.571 1.00 1.15 H new ATOM 0 HB3 ALA A 70 14.312 19.168 11.281 1.00 1.15 H new ATOM 946 N GLY A 71 15.828 16.810 10.624 1.00 1.15 N ATOM 947 CA GLY A 71 15.864 15.362 10.373 1.00 1.27 C ATOM 948 C GLY A 71 14.758 14.970 9.416 1.00 1.21 C ATOM 949 O GLY A 71 13.965 14.067 9.686 1.00 1.28 O ATOM 0 H GLY A 71 15.616 17.074 11.586 1.00 1.15 H new ATOM 0 HA2 GLY A 71 16.832 15.082 9.957 1.00 1.27 H new ATOM 0 HA3 GLY A 71 15.752 14.820 11.312 1.00 1.27 H new ATOM 953 N ILE A 72 14.831 15.538 8.223 1.00 1.12 N ATOM 954 CA ILE A 72 13.930 15.212 7.135 1.00 1.08 C ATOM 955 C ILE A 72 14.676 15.305 5.798 1.00 1.03 C ATOM 956 O ILE A 72 14.989 16.404 5.305 1.00 1.36 O ATOM 957 CB ILE A 72 12.669 16.095 7.156 1.00 1.52 C ATOM 958 CG1 ILE A 72 12.874 17.368 6.366 1.00 1.09 C ATOM 959 CG2 ILE A 72 12.255 16.410 8.584 1.00 2.27 C ATOM 960 CD1 ILE A 72 12.396 17.216 4.957 1.00 0.92 C ATOM 0 H ILE A 72 15.525 16.245 7.983 1.00 1.12 H new ATOM 0 HA ILE A 72 13.585 14.186 7.263 1.00 1.08 H new ATOM 0 HB ILE A 72 11.865 15.534 6.680 1.00 1.52 H new ATOM 0 HG12 ILE A 72 12.340 18.187 6.847 1.00 1.09 H new ATOM 0 HG13 ILE A 72 13.931 17.633 6.367 1.00 1.09 H new ATOM 0 HG21 ILE A 72 11.362 17.035 8.574 1.00 2.27 H new ATOM 0 HG22 ILE A 72 12.043 15.482 9.114 1.00 2.27 H new ATOM 0 HG23 ILE A 72 13.063 16.940 9.089 1.00 2.27 H new ATOM 0 HD11 ILE A 72 12.557 18.148 4.416 1.00 0.92 H new ATOM 0 HD12 ILE A 72 12.949 16.413 4.470 1.00 0.92 H new ATOM 0 HD13 ILE A 72 11.333 16.976 4.957 1.00 0.92 H new ATOM 972 N CYS A 73 14.976 14.163 5.219 1.00 0.82 N ATOM 973 CA CYS A 73 15.689 14.138 3.957 1.00 1.07 C ATOM 974 C CYS A 73 14.713 14.078 2.800 1.00 1.08 C ATOM 975 O CYS A 73 14.412 13.005 2.281 1.00 1.21 O ATOM 976 CB CYS A 73 16.641 12.945 3.903 1.00 1.19 C ATOM 977 SG CYS A 73 18.388 13.399 3.696 1.00 1.98 S ATOM 0 H CYS A 73 14.740 13.245 5.597 1.00 0.82 H new ATOM 0 HA CYS A 73 16.274 15.054 3.876 1.00 1.07 H new ATOM 0 HB2 CYS A 73 16.533 12.366 4.820 1.00 1.19 H new ATOM 0 HB3 CYS A 73 16.346 12.295 3.079 1.00 1.19 H new ATOM 982 N CYS A 74 14.209 15.235 2.407 1.00 0.98 N ATOM 983 CA CYS A 74 13.267 15.298 1.314 1.00 0.99 C ATOM 984 C CYS A 74 13.990 15.306 -0.022 1.00 1.15 C ATOM 985 O CYS A 74 14.995 15.992 -0.198 1.00 1.33 O ATOM 986 CB CYS A 74 12.357 16.516 1.446 1.00 1.13 C ATOM 987 SG CYS A 74 10.609 16.096 1.748 1.00 1.32 S ATOM 0 H CYS A 74 14.437 16.136 2.828 1.00 0.98 H new ATOM 0 HA CYS A 74 12.642 14.406 1.357 1.00 0.99 H new ATOM 0 HB2 CYS A 74 12.718 17.141 2.263 1.00 1.13 H new ATOM 0 HB3 CYS A 74 12.426 17.111 0.535 1.00 1.13 H new ATOM 992 N SER A 75 13.464 14.527 -0.953 1.00 1.14 N ATOM 993 CA SER A 75 14.034 14.420 -2.289 1.00 1.36 C ATOM 994 C SER A 75 13.165 15.198 -3.272 1.00 1.28 C ATOM 995 O SER A 75 12.151 15.771 -2.873 1.00 1.10 O ATOM 996 CB SER A 75 14.133 12.944 -2.691 1.00 1.46 C ATOM 997 OG SER A 75 14.662 12.164 -1.631 1.00 1.99 O ATOM 0 H SER A 75 12.634 13.953 -0.807 1.00 1.14 H new ATOM 0 HA SER A 75 15.038 14.845 -2.301 1.00 1.36 H new ATOM 0 HB2 SER A 75 13.146 12.571 -2.965 1.00 1.46 H new ATOM 0 HB3 SER A 75 14.767 12.845 -3.572 1.00 1.46 H new ATOM 0 HG SER A 75 14.714 11.226 -1.910 1.00 1.99 H new ATOM 1003 N PRO A 76 13.520 15.241 -4.569 1.00 1.46 N ATOM 1004 CA PRO A 76 12.722 15.965 -5.553 1.00 1.42 C ATOM 1005 C PRO A 76 11.505 15.156 -6.000 1.00 1.18 C ATOM 1006 O PRO A 76 10.978 15.358 -7.093 1.00 1.22 O ATOM 1007 CB PRO A 76 13.702 16.168 -6.707 1.00 1.74 C ATOM 1008 CG PRO A 76 14.610 14.989 -6.638 1.00 1.86 C ATOM 1009 CD PRO A 76 14.703 14.601 -5.180 1.00 1.77 C ATOM 0 HA PRO A 76 12.313 16.897 -5.163 1.00 1.42 H new ATOM 0 HB2 PRO A 76 13.183 16.214 -7.665 1.00 1.74 H new ATOM 0 HB3 PRO A 76 14.255 17.101 -6.599 1.00 1.74 H new ATOM 0 HG2 PRO A 76 14.220 14.164 -7.234 1.00 1.86 H new ATOM 0 HG3 PRO A 76 15.594 15.234 -7.037 1.00 1.86 H new ATOM 0 HD2 PRO A 76 14.683 13.519 -5.052 1.00 1.77 H new ATOM 0 HD3 PRO A 76 15.629 14.958 -4.729 1.00 1.77 H new ATOM 1017 N ASP A 77 11.066 14.246 -5.129 1.00 0.99 N ATOM 1018 CA ASP A 77 9.908 13.401 -5.394 1.00 0.91 C ATOM 1019 C ASP A 77 9.139 13.130 -4.091 1.00 0.82 C ATOM 1020 O ASP A 77 7.906 13.159 -4.070 1.00 0.90 O ATOM 1021 CB ASP A 77 10.344 12.086 -6.049 1.00 1.16 C ATOM 1022 CG ASP A 77 11.346 12.302 -7.168 1.00 1.92 C ATOM 1023 OD1 ASP A 77 11.019 13.036 -8.125 1.00 2.65 O ATOM 1024 OD2 ASP A 77 12.457 11.736 -7.089 1.00 2.50 O ATOM 0 H ASP A 77 11.504 14.077 -4.223 1.00 0.99 H new ATOM 0 HA ASP A 77 9.245 13.922 -6.084 1.00 0.91 H new ATOM 0 HB2 ASP A 77 10.782 11.434 -5.293 1.00 1.16 H new ATOM 0 HB3 ASP A 77 9.468 11.572 -6.444 1.00 1.16 H new ATOM 1029 N GLY A 78 9.876 12.876 -3.005 1.00 0.88 N ATOM 1030 CA GLY A 78 9.240 12.620 -1.723 1.00 0.87 C ATOM 1031 C GLY A 78 10.066 13.103 -0.541 1.00 0.86 C ATOM 1032 O GLY A 78 10.608 14.208 -0.557 1.00 0.99 O ATOM 0 H GLY A 78 10.895 12.844 -2.993 1.00 0.88 H new ATOM 0 HA2 GLY A 78 8.266 13.110 -1.703 1.00 0.87 H new ATOM 0 HA3 GLY A 78 9.061 11.550 -1.620 1.00 0.87 H new ATOM 1036 N CYS A 79 10.162 12.258 0.486 1.00 0.79 N ATOM 1037 CA CYS A 79 10.923 12.584 1.690 1.00 0.80 C ATOM 1038 C CYS A 79 11.554 11.326 2.283 1.00 0.78 C ATOM 1039 O CYS A 79 11.080 10.217 2.047 1.00 0.89 O ATOM 1040 CB CYS A 79 10.022 13.272 2.719 1.00 0.94 C ATOM 1041 SG CYS A 79 10.682 14.849 3.351 1.00 1.34 S ATOM 0 H CYS A 79 9.720 11.339 0.507 1.00 0.79 H new ATOM 0 HA CYS A 79 11.724 13.271 1.418 1.00 0.80 H new ATOM 0 HB2 CYS A 79 9.047 13.454 2.268 1.00 0.94 H new ATOM 0 HB3 CYS A 79 9.864 12.594 3.558 1.00 0.94 H new ATOM 1046 N HIS A 80 12.631 11.485 3.056 1.00 0.71 N ATOM 1047 CA HIS A 80 13.311 10.327 3.633 1.00 0.76 C ATOM 1048 C HIS A 80 13.806 10.612 5.040 1.00 0.70 C ATOM 1049 O HIS A 80 14.419 11.648 5.299 1.00 0.67 O ATOM 1050 CB HIS A 80 14.500 9.964 2.738 1.00 0.87 C ATOM 1051 CG HIS A 80 15.109 8.616 2.994 1.00 0.99 C ATOM 1052 ND1 HIS A 80 15.929 7.992 2.080 1.00 1.64 N ATOM 1053 CD2 HIS A 80 15.038 7.781 4.060 1.00 1.76 C ATOM 1054 CE1 HIS A 80 16.334 6.835 2.567 1.00 2.09 C ATOM 1055 NE2 HIS A 80 15.808 6.682 3.768 1.00 2.17 N ATOM 0 H HIS A 80 13.044 12.387 3.293 1.00 0.71 H new ATOM 0 HA HIS A 80 12.603 9.501 3.691 1.00 0.76 H new ATOM 0 HB2 HIS A 80 14.177 10.007 1.698 1.00 0.87 H new ATOM 0 HB3 HIS A 80 15.272 10.723 2.863 1.00 0.87 H new ATOM 0 HD2 HIS A 80 14.480 7.949 4.969 1.00 1.76 H new ATOM 0 HE1 HIS A 80 16.985 6.132 2.068 1.00 2.09 H new ATOM 0 HE2 HIS A 80 15.950 5.878 4.380 1.00 2.17 H new ATOM 1064 N GLU A 81 13.552 9.676 5.944 1.00 0.75 N ATOM 1065 CA GLU A 81 13.996 9.815 7.317 1.00 0.77 C ATOM 1066 C GLU A 81 15.501 9.966 7.354 1.00 0.72 C ATOM 1067 O GLU A 81 16.233 9.175 6.760 1.00 0.92 O ATOM 1068 CB GLU A 81 13.571 8.603 8.129 1.00 0.94 C ATOM 1069 CG GLU A 81 12.082 8.350 8.066 1.00 1.70 C ATOM 1070 CD GLU A 81 11.748 6.880 7.926 1.00 2.35 C ATOM 1071 OE1 GLU A 81 12.302 6.228 7.017 1.00 3.05 O ATOM 1072 OE2 GLU A 81 10.937 6.378 8.726 1.00 2.71 O ATOM 0 H GLU A 81 13.041 8.815 5.748 1.00 0.75 H new ATOM 0 HA GLU A 81 13.538 10.704 7.752 1.00 0.77 H new ATOM 0 HB2 GLU A 81 14.100 7.723 7.764 1.00 0.94 H new ATOM 0 HB3 GLU A 81 13.867 8.745 9.168 1.00 0.94 H new ATOM 0 HG2 GLU A 81 11.612 8.742 8.968 1.00 1.70 H new ATOM 0 HG3 GLU A 81 11.659 8.897 7.223 1.00 1.70 H new ATOM 1079 N ASP A 82 15.951 11.001 8.034 1.00 0.76 N ATOM 1080 CA ASP A 82 17.369 11.281 8.134 1.00 0.77 C ATOM 1081 C ASP A 82 17.700 11.893 9.499 1.00 0.96 C ATOM 1082 O ASP A 82 17.273 13.005 9.803 1.00 1.21 O ATOM 1083 CB ASP A 82 17.771 12.212 6.979 1.00 0.86 C ATOM 1084 CG ASP A 82 18.749 13.300 7.391 1.00 1.34 C ATOM 1085 OD1 ASP A 82 18.316 14.279 8.033 1.00 1.82 O ATOM 1086 OD2 ASP A 82 19.949 13.169 7.070 1.00 2.02 O ATOM 0 H ASP A 82 15.353 11.664 8.527 1.00 0.76 H new ATOM 0 HA ASP A 82 17.940 10.356 8.054 1.00 0.77 H new ATOM 0 HB2 ASP A 82 18.216 11.617 6.181 1.00 0.86 H new ATOM 0 HB3 ASP A 82 16.875 12.677 6.568 1.00 0.86 H new ATOM 1091 N PRO A 83 18.446 11.169 10.352 1.00 1.15 N ATOM 1092 CA PRO A 83 18.808 11.646 11.683 1.00 1.42 C ATOM 1093 C PRO A 83 20.027 12.569 11.682 1.00 1.28 C ATOM 1094 O PRO A 83 20.405 13.103 12.725 1.00 1.40 O ATOM 1095 CB PRO A 83 19.121 10.358 12.460 1.00 1.81 C ATOM 1096 CG PRO A 83 18.970 9.226 11.488 1.00 1.93 C ATOM 1097 CD PRO A 83 18.980 9.828 10.111 1.00 1.42 C ATOM 0 HA PRO A 83 18.006 12.244 12.116 1.00 1.42 H new ATOM 0 HB2 PRO A 83 20.131 10.387 12.868 1.00 1.81 H new ATOM 0 HB3 PRO A 83 18.440 10.239 13.303 1.00 1.81 H new ATOM 0 HG2 PRO A 83 19.783 8.509 11.602 1.00 1.93 H new ATOM 0 HG3 PRO A 83 18.040 8.685 11.666 1.00 1.93 H new ATOM 0 HD2 PRO A 83 19.984 9.860 9.689 1.00 1.42 H new ATOM 0 HD3 PRO A 83 18.360 9.262 9.416 1.00 1.42 H new ATOM 1105 N ALA A 84 20.648 12.747 10.519 1.00 1.13 N ATOM 1106 CA ALA A 84 21.819 13.608 10.414 1.00 1.17 C ATOM 1107 C ALA A 84 21.450 15.067 10.661 1.00 1.20 C ATOM 1108 O ALA A 84 22.226 15.824 11.244 1.00 1.53 O ATOM 1109 CB ALA A 84 22.484 13.443 9.055 1.00 1.21 C ATOM 0 H ALA A 84 20.362 12.310 9.643 1.00 1.13 H new ATOM 0 HA ALA A 84 22.530 13.307 11.184 1.00 1.17 H new ATOM 0 HB1 ALA A 84 23.356 14.094 8.995 1.00 1.21 H new ATOM 0 HB2 ALA A 84 22.795 12.406 8.926 1.00 1.21 H new ATOM 0 HB3 ALA A 84 21.777 13.710 8.269 1.00 1.21 H new ATOM 1115 N CYS A 85 20.260 15.452 10.216 1.00 1.02 N ATOM 1116 CA CYS A 85 19.785 16.818 10.394 1.00 1.19 C ATOM 1117 C CYS A 85 18.947 16.941 11.663 1.00 1.46 C ATOM 1118 O CYS A 85 17.850 17.492 11.644 1.00 1.88 O ATOM 1119 CB CYS A 85 18.968 17.273 9.170 1.00 1.15 C ATOM 1120 SG CYS A 85 19.901 17.385 7.597 1.00 1.42 S ATOM 0 H CYS A 85 19.607 14.838 9.730 1.00 1.02 H new ATOM 0 HA CYS A 85 20.656 17.467 10.492 1.00 1.19 H new ATOM 0 HB2 CYS A 85 18.138 16.581 9.031 1.00 1.15 H new ATOM 0 HB3 CYS A 85 18.536 18.250 9.386 1.00 1.15 H new ATOM 1125 N ASP A 86 19.478 16.437 12.778 1.00 1.53 N ATOM 1126 CA ASP A 86 18.788 16.503 14.043 1.00 1.90 C ATOM 1127 C ASP A 86 19.546 17.346 15.081 1.00 1.82 C ATOM 1128 O ASP A 86 19.462 17.054 16.272 1.00 2.29 O ATOM 1129 CB ASP A 86 18.566 15.090 14.584 1.00 2.43 C ATOM 1130 CG ASP A 86 17.304 14.455 14.035 1.00 3.07 C ATOM 1131 OD1 ASP A 86 16.324 15.191 13.795 1.00 3.47 O ATOM 1132 OD2 ASP A 86 17.296 13.223 13.843 1.00 3.60 O ATOM 0 H ASP A 86 20.388 15.979 12.818 1.00 1.53 H new ATOM 0 HA ASP A 86 17.830 16.992 13.867 1.00 1.90 H new ATOM 0 HB2 ASP A 86 19.424 14.467 14.330 1.00 2.43 H new ATOM 0 HB3 ASP A 86 18.509 15.125 15.672 1.00 2.43 H new ATOM 1137 N PRO A 87 20.245 18.445 14.683 1.00 1.72 N ATOM 1138 CA PRO A 87 20.916 19.315 15.644 1.00 2.05 C ATOM 1139 C PRO A 87 19.856 20.190 16.247 1.00 2.20 C ATOM 1140 O PRO A 87 19.866 21.414 16.137 1.00 2.35 O ATOM 1141 CB PRO A 87 21.903 20.137 14.810 1.00 2.46 C ATOM 1142 CG PRO A 87 21.655 19.770 13.379 1.00 2.56 C ATOM 1143 CD PRO A 87 20.372 18.980 13.325 1.00 1.96 C ATOM 0 HA PRO A 87 21.437 18.791 16.445 1.00 2.05 H new ATOM 0 HB2 PRO A 87 21.751 21.205 14.969 1.00 2.46 H new ATOM 0 HB3 PRO A 87 22.931 19.915 15.095 1.00 2.46 H new ATOM 0 HG2 PRO A 87 21.579 20.665 12.762 1.00 2.56 H new ATOM 0 HG3 PRO A 87 22.484 19.181 12.986 1.00 2.56 H new ATOM 0 HD2 PRO A 87 19.523 19.610 13.060 1.00 1.96 H new ATOM 0 HD3 PRO A 87 20.421 18.184 12.582 1.00 1.96 H new ATOM 1151 N GLU A 88 18.964 19.500 16.915 1.00 2.56 N ATOM 1152 CA GLU A 88 17.844 20.189 17.588 1.00 3.21 C ATOM 1153 C GLU A 88 16.949 19.207 18.234 1.00 3.51 C ATOM 1154 O GLU A 88 16.327 19.440 19.271 1.00 4.11 O ATOM 1155 CB GLU A 88 17.069 21.020 16.566 1.00 3.64 C ATOM 1156 CG GLU A 88 16.164 20.198 15.658 1.00 3.54 C ATOM 1157 CD GLU A 88 15.041 21.018 15.043 1.00 4.21 C ATOM 1158 OE1 GLU A 88 15.314 21.783 14.095 1.00 4.58 O ATOM 1159 OE2 GLU A 88 13.890 20.890 15.511 1.00 4.72 O ATOM 0 H GLU A 88 18.972 18.485 17.018 1.00 2.56 H new ATOM 0 HA GLU A 88 18.242 20.848 18.359 1.00 3.21 H new ATOM 0 HB2 GLU A 88 16.464 21.756 17.095 1.00 3.64 H new ATOM 0 HB3 GLU A 88 17.778 21.574 15.950 1.00 3.64 H new ATOM 0 HG2 GLU A 88 16.762 19.755 14.862 1.00 3.54 H new ATOM 0 HG3 GLU A 88 15.735 19.375 16.230 1.00 3.54 H new ATOM 1166 N ALA A 89 16.942 18.040 17.553 1.00 3.29 N ATOM 1167 CA ALA A 89 16.195 16.834 17.901 1.00 3.88 C ATOM 1168 C ALA A 89 16.800 16.119 19.129 1.00 4.78 C ATOM 1169 O ALA A 89 17.015 14.913 19.133 1.00 5.29 O ATOM 1170 CB ALA A 89 16.196 15.914 16.673 1.00 3.48 C ATOM 0 H ALA A 89 17.490 17.918 16.702 1.00 3.29 H new ATOM 0 HA ALA A 89 15.175 17.101 18.176 1.00 3.88 H new ATOM 0 HB1 ALA A 89 15.644 15.002 16.901 1.00 3.48 H new ATOM 0 HB2 ALA A 89 15.722 16.425 15.835 1.00 3.48 H new ATOM 0 HB3 ALA A 89 17.223 15.661 16.409 1.00 3.48 H new ATOM 1176 N ALA A 90 17.015 16.910 20.154 1.00 5.12 N ATOM 1177 CA ALA A 90 17.551 16.536 21.474 1.00 6.15 C ATOM 1178 C ALA A 90 16.546 15.732 22.279 1.00 6.94 C ATOM 1179 O ALA A 90 15.406 16.120 22.518 1.00 6.98 O ATOM 1180 CB ALA A 90 17.954 17.770 22.262 1.00 6.47 C ATOM 0 H ALA A 90 16.810 17.908 20.099 1.00 5.12 H new ATOM 0 HA ALA A 90 18.430 15.916 21.297 1.00 6.15 H new ATOM 0 HB1 ALA A 90 18.347 17.469 23.233 1.00 6.47 H new ATOM 0 HB2 ALA A 90 18.721 18.317 21.714 1.00 6.47 H new ATOM 0 HB3 ALA A 90 17.084 18.411 22.405 1.00 6.47 H new ATOM 1186 N PHE A 91 17.030 14.505 22.583 1.00 7.67 N ATOM 1187 CA PHE A 91 16.270 13.449 23.247 1.00 8.56 C ATOM 1188 C PHE A 91 15.996 13.727 24.713 1.00 9.41 C ATOM 1189 O PHE A 91 16.893 14.059 25.488 1.00 9.96 O ATOM 1190 CB PHE A 91 17.026 12.110 23.116 1.00 9.02 C ATOM 1191 CG PHE A 91 18.509 12.185 23.409 1.00 9.29 C ATOM 1192 CD1 PHE A 91 18.976 12.236 24.714 1.00 9.45 C ATOM 1193 CD2 PHE A 91 19.435 12.193 22.374 1.00 9.65 C ATOM 1194 CE1 PHE A 91 20.335 12.294 24.980 1.00 9.92 C ATOM 1195 CE2 PHE A 91 20.794 12.252 22.636 1.00 10.10 C ATOM 1196 CZ PHE A 91 21.242 12.303 23.940 1.00 10.21 C ATOM 0 H PHE A 91 17.986 14.227 22.363 1.00 7.67 H new ATOM 0 HA PHE A 91 15.302 13.404 22.749 1.00 8.56 H new ATOM 0 HB2 PHE A 91 16.573 11.386 23.793 1.00 9.02 H new ATOM 0 HB3 PHE A 91 16.889 11.730 22.104 1.00 9.02 H new ATOM 0 HD1 PHE A 91 18.272 12.230 25.533 1.00 9.45 H new ATOM 0 HD2 PHE A 91 19.091 12.153 21.351 1.00 9.65 H new ATOM 0 HE1 PHE A 91 20.684 12.332 26.001 1.00 9.92 H new ATOM 0 HE2 PHE A 91 21.502 12.258 21.820 1.00 10.10 H new ATOM 0 HZ PHE A 91 22.301 12.350 24.146 1.00 10.21 H new ATOM 1206 N SER A 92 14.727 13.568 25.073 1.00 9.61 N ATOM 1207 CA SER A 92 14.265 13.773 26.434 1.00 10.49 C ATOM 1208 C SER A 92 14.327 12.469 27.226 1.00 11.25 C ATOM 1209 O SER A 92 14.906 12.476 28.332 1.00 11.48 O ATOM 1210 CB SER A 92 12.834 14.309 26.417 1.00 10.50 C ATOM 1211 OG SER A 92 12.438 14.755 27.701 1.00 10.56 O ATOM 1212 OXT SER A 92 13.795 11.452 26.732 1.00 11.77 O ATOM 0 H SER A 92 13.990 13.292 24.424 1.00 9.61 H new ATOM 0 HA SER A 92 14.917 14.500 26.919 1.00 10.49 H new ATOM 0 HB2 SER A 92 12.759 15.131 25.705 1.00 10.50 H new ATOM 0 HB3 SER A 92 12.155 13.528 26.075 1.00 10.50 H new ATOM 0 HG SER A 92 11.519 15.094 27.661 1.00 10.56 H new TER 1218 SER A 92 ATOM 1219 N ALA B 101 -2.541 -9.747 13.495 1.00 10.07 N ATOM 1220 CA ALA B 101 -2.239 -9.235 14.857 1.00 9.47 C ATOM 1221 C ALA B 101 -2.680 -7.794 15.010 1.00 8.40 C ATOM 1222 O ALA B 101 -3.333 -7.230 14.131 1.00 8.14 O ATOM 1223 CB ALA B 101 -0.762 -9.366 15.184 1.00 9.68 C ATOM 0 HA ALA B 101 -2.801 -9.847 15.562 1.00 9.47 H new ATOM 0 HB1 ALA B 101 -0.576 -8.982 16.187 1.00 9.68 H new ATOM 0 HB2 ALA B 101 -0.471 -10.415 15.137 1.00 9.68 H new ATOM 0 HB3 ALA B 101 -0.178 -8.795 14.463 1.00 9.68 H new ATOM 1231 N VAL B 102 -2.395 -7.229 16.166 1.00 8.03 N ATOM 1232 CA VAL B 102 -2.846 -5.856 16.493 1.00 7.24 C ATOM 1233 C VAL B 102 -1.893 -4.853 16.013 1.00 6.03 C ATOM 1234 O VAL B 102 -2.194 -3.664 15.891 1.00 5.94 O ATOM 1235 CB VAL B 102 -3.122 -5.580 17.984 1.00 7.66 C ATOM 1236 CG1 VAL B 102 -3.744 -4.193 18.149 1.00 7.91 C ATOM 1237 CG2 VAL B 102 -4.023 -6.640 18.582 1.00 8.41 C ATOM 0 H VAL B 102 -1.856 -7.682 16.904 1.00 8.03 H new ATOM 0 HA VAL B 102 -3.803 -5.779 15.977 1.00 7.24 H new ATOM 0 HB VAL B 102 -2.173 -5.612 18.520 1.00 7.66 H new ATOM 0 HG11 VAL B 102 -3.937 -4.004 19.205 1.00 7.91 H new ATOM 0 HG12 VAL B 102 -3.058 -3.438 17.765 1.00 7.91 H new ATOM 0 HG13 VAL B 102 -4.682 -4.146 17.595 1.00 7.91 H new ATOM 0 HG21 VAL B 102 -4.199 -6.417 19.634 1.00 8.41 H new ATOM 0 HG22 VAL B 102 -4.974 -6.651 18.050 1.00 8.41 H new ATOM 0 HG23 VAL B 102 -3.546 -7.616 18.493 1.00 8.41 H new ATOM 1247 N LEU B 103 -0.725 -5.361 15.661 1.00 5.40 N ATOM 1248 CA LEU B 103 0.406 -4.631 15.077 1.00 4.42 C ATOM 1249 C LEU B 103 1.129 -5.729 14.278 1.00 4.14 C ATOM 1250 O LEU B 103 1.769 -6.605 14.858 1.00 4.51 O ATOM 1251 CB LEU B 103 1.321 -4.047 16.174 1.00 4.44 C ATOM 1252 CG LEU B 103 1.269 -4.755 17.536 1.00 5.04 C ATOM 1253 CD1 LEU B 103 2.016 -6.079 17.489 1.00 5.09 C ATOM 1254 CD2 LEU B 103 1.849 -3.864 18.627 1.00 5.87 C ATOM 0 H LEU B 103 -0.520 -6.353 15.779 1.00 5.40 H new ATOM 0 HA LEU B 103 0.106 -3.776 14.472 1.00 4.42 H new ATOM 0 HB2 LEU B 103 2.349 -4.070 15.813 1.00 4.44 H new ATOM 0 HB3 LEU B 103 1.058 -2.999 16.320 1.00 4.44 H new ATOM 0 HG LEU B 103 0.224 -4.957 17.769 1.00 5.04 H new ATOM 0 HD11 LEU B 103 1.964 -6.561 18.465 1.00 5.09 H new ATOM 0 HD12 LEU B 103 1.561 -6.727 16.740 1.00 5.09 H new ATOM 0 HD13 LEU B 103 3.059 -5.899 17.228 1.00 5.09 H new ATOM 0 HD21 LEU B 103 1.803 -4.384 19.584 1.00 5.87 H new ATOM 0 HD22 LEU B 103 2.887 -3.629 18.391 1.00 5.87 H new ATOM 0 HD23 LEU B 103 1.273 -2.941 18.687 1.00 5.87 H new ATOM 1266 N ASP B 104 1.093 -5.634 12.960 1.00 4.04 N ATOM 1267 CA ASP B 104 1.771 -6.514 12.044 1.00 4.36 C ATOM 1268 C ASP B 104 1.734 -5.805 10.669 1.00 4.07 C ATOM 1269 O ASP B 104 2.392 -4.791 10.435 1.00 4.12 O ATOM 1270 CB ASP B 104 1.113 -7.904 12.027 1.00 5.06 C ATOM 1271 CG ASP B 104 1.960 -8.945 12.730 1.00 5.80 C ATOM 1272 OD1 ASP B 104 3.035 -9.289 12.197 1.00 6.27 O ATOM 1273 OD2 ASP B 104 1.551 -9.414 13.809 1.00 6.19 O ATOM 0 H ASP B 104 0.563 -4.904 12.484 1.00 4.04 H new ATOM 0 HA ASP B 104 2.804 -6.699 12.339 1.00 4.36 H new ATOM 0 HB2 ASP B 104 0.136 -7.848 12.507 1.00 5.06 H new ATOM 0 HB3 ASP B 104 0.944 -8.212 10.995 1.00 5.06 H new ATOM 1278 N LEU B 105 0.862 -6.353 9.811 1.00 4.35 N ATOM 1279 CA LEU B 105 0.619 -5.787 8.501 1.00 4.75 C ATOM 1280 C LEU B 105 -0.885 -5.721 8.236 1.00 5.41 C ATOM 1281 O LEU B 105 -1.337 -5.330 7.159 1.00 6.19 O ATOM 1282 CB LEU B 105 1.353 -6.584 7.419 1.00 5.45 C ATOM 1283 CG LEU B 105 1.445 -5.919 6.039 1.00 6.23 C ATOM 1284 CD1 LEU B 105 1.831 -4.449 6.158 1.00 5.95 C ATOM 1285 CD2 LEU B 105 2.452 -6.657 5.166 1.00 7.20 C ATOM 0 H LEU B 105 0.317 -7.191 10.013 1.00 4.35 H new ATOM 0 HA LEU B 105 1.013 -4.771 8.472 1.00 4.75 H new ATOM 0 HB2 LEU B 105 2.365 -6.789 7.770 1.00 5.45 H new ATOM 0 HB3 LEU B 105 0.855 -7.547 7.304 1.00 5.45 H new ATOM 0 HG LEU B 105 0.461 -5.973 5.573 1.00 6.23 H new ATOM 0 HD11 LEU B 105 1.888 -4.006 5.164 1.00 5.95 H new ATOM 0 HD12 LEU B 105 1.080 -3.922 6.747 1.00 5.95 H new ATOM 0 HD13 LEU B 105 2.801 -4.366 6.648 1.00 5.95 H new ATOM 0 HD21 LEU B 105 2.508 -6.176 4.190 1.00 7.20 H new ATOM 0 HD22 LEU B 105 3.433 -6.631 5.641 1.00 7.20 H new ATOM 0 HD23 LEU B 105 2.136 -7.693 5.042 1.00 7.20 H new ATOM 1297 N ASP B 106 -1.639 -6.056 9.290 1.00 5.41 N ATOM 1298 CA ASP B 106 -3.100 -5.999 9.302 1.00 6.32 C ATOM 1299 C ASP B 106 -3.374 -4.569 9.645 1.00 6.19 C ATOM 1300 O ASP B 106 -3.669 -3.766 8.761 1.00 6.37 O ATOM 1301 CB ASP B 106 -3.689 -6.964 10.333 1.00 7.13 C ATOM 1302 CG ASP B 106 -4.837 -7.779 9.769 1.00 8.06 C ATOM 1303 OD1 ASP B 106 -5.965 -7.248 9.699 1.00 8.55 O ATOM 1304 OD2 ASP B 106 -4.606 -8.948 9.397 1.00 8.48 O ATOM 0 H ASP B 106 -1.241 -6.379 10.172 1.00 5.41 H new ATOM 0 HA ASP B 106 -3.555 -6.301 8.358 1.00 6.32 H new ATOM 0 HB2 ASP B 106 -2.907 -7.637 10.685 1.00 7.13 H new ATOM 0 HB3 ASP B 106 -4.038 -6.400 11.198 1.00 7.13 H new ATOM 1309 N VAL B 107 -2.952 -4.194 10.854 1.00 6.17 N ATOM 1310 CA VAL B 107 -2.843 -2.793 11.109 1.00 6.24 C ATOM 1311 C VAL B 107 -1.800 -2.728 12.193 1.00 5.49 C ATOM 1312 O VAL B 107 -2.090 -3.195 13.291 1.00 5.67 O ATOM 1313 CB VAL B 107 -4.194 -2.189 11.540 1.00 7.18 C ATOM 1314 CG1 VAL B 107 -4.825 -3.002 12.656 1.00 7.33 C ATOM 1315 CG2 VAL B 107 -4.048 -0.728 11.941 1.00 7.48 C ATOM 0 H VAL B 107 -2.697 -4.816 11.621 1.00 6.17 H new ATOM 0 HA VAL B 107 -2.565 -2.209 10.231 1.00 6.24 H new ATOM 0 HB VAL B 107 -4.861 -2.228 10.679 1.00 7.18 H new ATOM 0 HG11 VAL B 107 -5.777 -2.553 12.940 1.00 7.33 H new ATOM 0 HG12 VAL B 107 -4.994 -4.023 12.312 1.00 7.33 H new ATOM 0 HG13 VAL B 107 -4.158 -3.015 13.518 1.00 7.33 H new ATOM 0 HG21 VAL B 107 -5.019 -0.334 12.239 1.00 7.48 H new ATOM 0 HG22 VAL B 107 -3.352 -0.648 12.776 1.00 7.48 H new ATOM 0 HG23 VAL B 107 -3.668 -0.155 11.095 1.00 7.48 H new ATOM 1325 N ARG B 108 -0.629 -2.159 12.005 1.00 5.08 N ATOM 1326 CA ARG B 108 0.287 -2.117 13.112 1.00 4.80 C ATOM 1327 C ARG B 108 -0.119 -1.000 13.986 1.00 4.49 C ATOM 1328 O ARG B 108 -0.115 0.140 13.518 1.00 4.98 O ATOM 1329 CB ARG B 108 1.746 -2.026 12.696 1.00 5.26 C ATOM 1330 CG ARG B 108 2.672 -2.933 13.490 1.00 6.18 C ATOM 1331 CD ARG B 108 3.715 -2.157 14.281 1.00 6.96 C ATOM 1332 NE ARG B 108 3.235 -1.768 15.606 1.00 7.64 N ATOM 1333 CZ ARG B 108 4.032 -1.606 16.664 1.00 8.36 C ATOM 1334 NH1 ARG B 108 5.344 -1.771 16.549 1.00 8.54 N ATOM 1335 NH2 ARG B 108 3.519 -1.260 17.836 1.00 9.12 N ATOM 0 H ARG B 108 -0.303 -1.738 11.135 1.00 5.08 H new ATOM 0 HA ARG B 108 0.230 -3.061 13.653 1.00 4.80 H new ATOM 0 HB2 ARG B 108 1.828 -2.276 11.638 1.00 5.26 H new ATOM 0 HB3 ARG B 108 2.081 -0.995 12.807 1.00 5.26 H new ATOM 0 HG2 ARG B 108 2.080 -3.541 14.175 1.00 6.18 H new ATOM 0 HG3 ARG B 108 3.175 -3.619 12.808 1.00 6.18 H new ATOM 0 HD2 ARG B 108 4.613 -2.766 14.387 1.00 6.96 H new ATOM 0 HD3 ARG B 108 3.999 -1.264 13.724 1.00 6.96 H new ATOM 0 HE ARG B 108 2.235 -1.612 15.729 1.00 7.64 H new ATOM 0 HH11 ARG B 108 5.749 -2.023 15.648 1.00 8.54 H new ATOM 0 HH12 ARG B 108 5.947 -1.645 17.362 1.00 8.54 H new ATOM 0 HH21 ARG B 108 2.513 -1.117 17.930 1.00 9.12 H new ATOM 0 HH22 ARG B 108 4.130 -1.137 18.644 1.00 9.12 H new ATOM 1349 N THR B 109 -0.504 -1.239 15.223 1.00 4.05 N ATOM 1350 CA THR B 109 -0.891 -0.059 15.963 1.00 4.08 C ATOM 1351 C THR B 109 0.348 0.824 16.097 1.00 3.18 C ATOM 1352 O THR B 109 1.248 0.575 16.894 1.00 3.48 O ATOM 1353 CB THR B 109 -1.440 -0.442 17.348 1.00 4.98 C ATOM 1354 OG1 THR B 109 -1.633 0.709 18.158 1.00 5.58 O ATOM 1355 CG2 THR B 109 -0.546 -1.397 18.109 1.00 5.69 C ATOM 0 H THR B 109 -0.556 -2.140 15.698 1.00 4.05 H new ATOM 0 HA THR B 109 -1.684 0.476 15.440 1.00 4.08 H new ATOM 0 HB THR B 109 -2.387 -0.942 17.146 1.00 4.98 H new ATOM 0 HG1 THR B 109 -1.984 0.439 19.032 1.00 5.58 H new ATOM 0 HG21 THR B 109 -0.995 -1.623 19.076 1.00 5.69 H new ATOM 0 HG22 THR B 109 -0.429 -2.318 17.539 1.00 5.69 H new ATOM 0 HG23 THR B 109 0.431 -0.938 18.261 1.00 5.69 H new ATOM 1363 N CYS B 110 0.335 1.888 15.303 1.00 2.52 N ATOM 1364 CA CYS B 110 1.401 2.893 15.273 1.00 1.89 C ATOM 1365 C CYS B 110 1.271 3.922 16.394 1.00 1.69 C ATOM 1366 O CYS B 110 0.354 4.737 16.344 1.00 1.94 O ATOM 1367 CB CYS B 110 1.472 3.577 13.908 1.00 2.23 C ATOM 1368 SG CYS B 110 1.819 2.457 12.501 1.00 2.61 S ATOM 0 H CYS B 110 -0.425 2.083 14.651 1.00 2.52 H new ATOM 0 HA CYS B 110 2.337 2.361 15.442 1.00 1.89 H new ATOM 0 HB2 CYS B 110 0.526 4.086 13.723 1.00 2.23 H new ATOM 0 HB3 CYS B 110 2.246 4.344 13.942 1.00 2.23 H new ATOM 1373 N LEU B 111 2.172 3.926 17.376 1.00 1.46 N ATOM 1374 CA LEU B 111 2.109 4.922 18.462 1.00 1.37 C ATOM 1375 C LEU B 111 1.483 6.244 17.976 1.00 1.20 C ATOM 1376 O LEU B 111 1.791 6.714 16.882 1.00 1.18 O ATOM 1377 CB LEU B 111 3.512 5.215 19.005 1.00 1.54 C ATOM 1378 CG LEU B 111 4.146 4.098 19.833 1.00 1.90 C ATOM 1379 CD1 LEU B 111 5.664 4.204 19.780 1.00 2.47 C ATOM 1380 CD2 LEU B 111 3.654 4.156 21.273 1.00 2.26 C ATOM 0 H LEU B 111 2.945 3.265 17.448 1.00 1.46 H new ATOM 0 HA LEU B 111 1.485 4.500 19.250 1.00 1.37 H new ATOM 0 HB2 LEU B 111 4.169 5.437 18.164 1.00 1.54 H new ATOM 0 HB3 LEU B 111 3.464 6.115 19.618 1.00 1.54 H new ATOM 0 HG LEU B 111 3.849 3.138 19.411 1.00 1.90 H new ATOM 0 HD11 LEU B 111 6.106 3.403 20.373 1.00 2.47 H new ATOM 0 HD12 LEU B 111 5.999 4.117 18.746 1.00 2.47 H new ATOM 0 HD13 LEU B 111 5.976 5.168 20.182 1.00 2.47 H new ATOM 0 HD21 LEU B 111 4.116 3.353 21.848 1.00 2.26 H new ATOM 0 HD22 LEU B 111 3.923 5.117 21.711 1.00 2.26 H new ATOM 0 HD23 LEU B 111 2.570 4.039 21.292 1.00 2.26 H new ATOM 1392 N PRO B 112 0.576 6.838 18.774 1.00 1.19 N ATOM 1393 CA PRO B 112 -0.111 8.098 18.426 1.00 1.12 C ATOM 1394 C PRO B 112 0.832 9.307 18.339 1.00 1.03 C ATOM 1395 O PRO B 112 1.801 9.396 19.086 1.00 1.06 O ATOM 1396 CB PRO B 112 -1.116 8.293 19.559 1.00 1.30 C ATOM 1397 CG PRO B 112 -0.580 7.491 20.691 1.00 1.47 C ATOM 1398 CD PRO B 112 0.123 6.317 20.072 1.00 1.37 C ATOM 0 HA PRO B 112 -0.563 8.032 17.437 1.00 1.12 H new ATOM 0 HB2 PRO B 112 -1.207 9.345 19.829 1.00 1.30 H new ATOM 0 HB3 PRO B 112 -2.109 7.951 19.269 1.00 1.30 H new ATOM 0 HG2 PRO B 112 0.107 8.082 21.297 1.00 1.47 H new ATOM 0 HG3 PRO B 112 -1.383 7.161 21.350 1.00 1.47 H new ATOM 0 HD2 PRO B 112 0.960 5.981 20.684 1.00 1.37 H new ATOM 0 HD3 PRO B 112 -0.546 5.465 19.952 1.00 1.37 H new ATOM 1406 N CYS B 113 0.460 10.292 17.512 1.00 0.94 N ATOM 1407 CA CYS B 113 1.224 11.537 17.417 1.00 0.90 C ATOM 1408 C CYS B 113 0.349 12.689 16.890 1.00 0.91 C ATOM 1409 O CYS B 113 -0.867 12.555 16.751 1.00 1.00 O ATOM 1410 CB CYS B 113 2.474 11.300 16.532 1.00 0.83 C ATOM 1411 SG CYS B 113 2.600 12.289 14.995 1.00 0.87 S ATOM 0 H CYS B 113 -0.359 10.250 16.905 1.00 0.94 H new ATOM 0 HA CYS B 113 1.556 11.836 18.411 1.00 0.90 H new ATOM 0 HB2 CYS B 113 3.360 11.497 17.136 1.00 0.83 H new ATOM 0 HB3 CYS B 113 2.502 10.245 16.260 1.00 0.83 H new ATOM 1416 N GLY B 114 1.006 13.798 16.547 1.00 0.92 N ATOM 1417 CA GLY B 114 0.329 14.945 15.973 1.00 0.99 C ATOM 1418 C GLY B 114 -0.452 15.783 16.960 1.00 1.11 C ATOM 1419 O GLY B 114 -0.226 15.713 18.166 1.00 1.16 O ATOM 0 H GLY B 114 2.012 13.919 16.661 1.00 0.92 H new ATOM 0 HA2 GLY B 114 1.070 15.579 15.486 1.00 0.99 H new ATOM 0 HA3 GLY B 114 -0.352 14.596 15.197 1.00 0.99 H new ATOM 1423 N PRO B 115 -1.409 16.576 16.455 1.00 1.19 N ATOM 1424 CA PRO B 115 -2.281 17.434 17.264 1.00 1.33 C ATOM 1425 C PRO B 115 -3.139 16.634 18.217 1.00 1.40 C ATOM 1426 O PRO B 115 -4.180 16.082 17.857 1.00 1.57 O ATOM 1427 CB PRO B 115 -3.168 18.086 16.216 1.00 1.46 C ATOM 1428 CG PRO B 115 -3.239 16.976 15.283 1.00 1.39 C ATOM 1429 CD PRO B 115 -1.803 16.667 15.055 1.00 1.21 C ATOM 0 HA PRO B 115 -1.716 18.130 17.884 1.00 1.33 H new ATOM 0 HB2 PRO B 115 -4.144 18.375 16.606 1.00 1.46 H new ATOM 0 HB3 PRO B 115 -2.722 18.980 15.779 1.00 1.46 H new ATOM 0 HG2 PRO B 115 -3.777 16.126 15.702 1.00 1.39 H new ATOM 0 HG3 PRO B 115 -3.748 17.252 14.359 1.00 1.39 H new ATOM 0 HD2 PRO B 115 -1.647 15.739 14.505 1.00 1.21 H new ATOM 0 HD3 PRO B 115 -1.277 17.452 14.512 1.00 1.21 H new ATOM 1437 N GLY B 116 -2.671 16.583 19.412 1.00 1.35 N ATOM 1438 CA GLY B 116 -3.334 15.886 20.465 1.00 1.48 C ATOM 1439 C GLY B 116 -3.010 14.436 20.500 1.00 1.44 C ATOM 1440 O GLY B 116 -3.472 13.721 21.389 1.00 1.70 O ATOM 0 H GLY B 116 -1.800 17.032 19.695 1.00 1.35 H new ATOM 0 HA2 GLY B 116 -3.060 16.336 21.419 1.00 1.48 H new ATOM 0 HA3 GLY B 116 -4.411 16.009 20.352 1.00 1.48 H new ATOM 1444 N GLY B 117 -2.136 14.000 19.630 1.00 1.29 N ATOM 1445 CA GLY B 117 -1.729 12.649 19.663 1.00 1.26 C ATOM 1446 C GLY B 117 -2.718 11.654 19.097 1.00 1.26 C ATOM 1447 O GLY B 117 -2.900 10.572 19.650 1.00 1.38 O ATOM 0 H GLY B 117 -1.704 14.568 18.901 1.00 1.29 H new ATOM 0 HA2 GLY B 117 -0.793 12.557 19.112 1.00 1.26 H new ATOM 0 HA3 GLY B 117 -1.519 12.377 20.697 1.00 1.26 H new ATOM 1451 N LYS B 118 -3.345 12.005 17.988 1.00 1.19 N ATOM 1452 CA LYS B 118 -4.267 11.104 17.343 1.00 1.25 C ATOM 1453 C LYS B 118 -3.554 10.307 16.266 1.00 1.15 C ATOM 1454 O LYS B 118 -3.921 9.179 15.945 1.00 1.25 O ATOM 1455 CB LYS B 118 -5.412 11.878 16.668 1.00 1.30 C ATOM 1456 CG LYS B 118 -5.408 13.382 16.915 1.00 1.36 C ATOM 1457 CD LYS B 118 -6.792 13.891 17.264 1.00 1.78 C ATOM 1458 CE LYS B 118 -7.035 15.281 16.702 1.00 1.95 C ATOM 1459 NZ LYS B 118 -8.232 15.921 17.312 1.00 2.54 N ATOM 0 H LYS B 118 -3.229 12.905 17.522 1.00 1.19 H new ATOM 0 HA LYS B 118 -4.667 10.443 18.112 1.00 1.25 H new ATOM 0 HB2 LYS B 118 -5.365 11.702 15.593 1.00 1.30 H new ATOM 0 HB3 LYS B 118 -6.361 11.470 17.017 1.00 1.30 H new ATOM 0 HG2 LYS B 118 -4.718 13.617 17.725 1.00 1.36 H new ATOM 0 HG3 LYS B 118 -5.043 13.897 16.026 1.00 1.36 H new ATOM 0 HD2 LYS B 118 -7.542 13.204 16.873 1.00 1.78 H new ATOM 0 HD3 LYS B 118 -6.911 13.910 18.347 1.00 1.78 H new ATOM 0 HE2 LYS B 118 -6.159 15.904 16.881 1.00 1.95 H new ATOM 0 HE3 LYS B 118 -7.167 15.219 15.622 1.00 1.95 H new ATOM 0 HZ1 LYS B 118 -8.365 16.868 16.903 1.00 2.54 H new ATOM 0 HZ2 LYS B 118 -9.072 15.339 17.120 1.00 2.54 H new ATOM 0 HZ3 LYS B 118 -8.096 16.003 18.340 1.00 2.54 H new ATOM 1473 N GLY B 119 -2.540 10.937 15.695 1.00 1.04 N ATOM 1474 CA GLY B 119 -1.834 10.354 14.592 1.00 0.97 C ATOM 1475 C GLY B 119 -0.801 9.268 14.874 1.00 0.93 C ATOM 1476 O GLY B 119 -0.415 8.985 15.976 1.00 1.02 O ATOM 0 H GLY B 119 -2.196 11.852 15.985 1.00 1.04 H new ATOM 0 HA2 GLY B 119 -2.574 9.936 13.910 1.00 0.97 H new ATOM 0 HA3 GLY B 119 -1.329 11.160 14.060 1.00 0.97 H new ATOM 1480 N ARG B 120 -0.554 8.593 13.794 1.00 0.87 N ATOM 1481 CA ARG B 120 0.276 7.394 13.816 1.00 0.87 C ATOM 1482 C ARG B 120 1.689 7.611 13.262 1.00 0.80 C ATOM 1483 O ARG B 120 1.900 8.368 12.321 1.00 0.79 O ATOM 1484 CB ARG B 120 -0.457 6.292 13.104 1.00 0.95 C ATOM 1485 CG ARG B 120 -1.335 5.459 14.029 1.00 1.16 C ATOM 1486 CD ARG B 120 -2.807 5.763 13.812 1.00 1.60 C ATOM 1487 NE ARG B 120 -3.469 4.716 13.038 1.00 1.82 N ATOM 1488 CZ ARG B 120 -4.217 4.939 11.959 1.00 2.25 C ATOM 1489 NH1 ARG B 120 -4.417 6.175 11.515 1.00 2.62 N ATOM 1490 NH2 ARG B 120 -4.771 3.919 11.319 1.00 2.89 N ATOM 0 H ARG B 120 -0.911 8.842 12.872 1.00 0.87 H new ATOM 0 HA ARG B 120 0.441 7.112 14.856 1.00 0.87 H new ATOM 0 HB2 ARG B 120 -1.076 6.725 12.319 1.00 0.95 H new ATOM 0 HB3 ARG B 120 0.267 5.639 12.616 1.00 0.95 H new ATOM 0 HG2 ARG B 120 -1.150 4.399 13.853 1.00 1.16 H new ATOM 0 HG3 ARG B 120 -1.069 5.661 15.066 1.00 1.16 H new ATOM 0 HD2 ARG B 120 -3.302 5.870 14.777 1.00 1.60 H new ATOM 0 HD3 ARG B 120 -2.909 6.717 13.294 1.00 1.60 H new ATOM 0 HE ARG B 120 -3.351 3.750 13.344 1.00 1.82 H new ATOM 0 HH11 ARG B 120 -3.996 6.966 12.002 1.00 2.62 H new ATOM 0 HH12 ARG B 120 -4.992 6.333 10.687 1.00 2.62 H new ATOM 0 HH21 ARG B 120 -4.624 2.967 11.653 1.00 2.89 H new ATOM 0 HH22 ARG B 120 -5.344 4.086 10.492 1.00 2.89 H new ATOM 1504 N CYS B 121 2.660 6.939 13.912 1.00 0.82 N ATOM 1505 CA CYS B 121 4.083 7.040 13.556 1.00 0.81 C ATOM 1506 C CYS B 121 4.580 5.757 12.897 1.00 0.85 C ATOM 1507 O CYS B 121 4.232 4.657 13.318 1.00 1.05 O ATOM 1508 CB CYS B 121 4.943 7.285 14.809 1.00 0.91 C ATOM 1509 SG CYS B 121 4.594 8.831 15.711 1.00 1.07 S ATOM 0 H CYS B 121 2.477 6.313 14.696 1.00 0.82 H new ATOM 0 HA CYS B 121 4.176 7.875 12.862 1.00 0.81 H new ATOM 0 HB2 CYS B 121 4.805 6.447 15.492 1.00 0.91 H new ATOM 0 HB3 CYS B 121 5.992 7.286 14.514 1.00 0.91 H new ATOM 1514 N PHE B 122 5.396 5.909 11.858 1.00 0.76 N ATOM 1515 CA PHE B 122 5.940 4.756 11.132 1.00 0.84 C ATOM 1516 C PHE B 122 7.473 4.781 11.077 1.00 0.95 C ATOM 1517 O PHE B 122 8.095 3.799 10.669 1.00 1.44 O ATOM 1518 CB PHE B 122 5.356 4.716 9.716 1.00 0.86 C ATOM 1519 CG PHE B 122 3.875 4.968 9.699 1.00 0.86 C ATOM 1520 CD1 PHE B 122 3.374 6.213 10.041 1.00 1.42 C ATOM 1521 CD2 PHE B 122 2.983 3.953 9.385 1.00 1.41 C ATOM 1522 CE1 PHE B 122 2.013 6.444 10.070 1.00 1.50 C ATOM 1523 CE2 PHE B 122 1.618 4.181 9.407 1.00 1.53 C ATOM 1524 CZ PHE B 122 1.133 5.428 9.751 1.00 1.15 C ATOM 0 H PHE B 122 5.697 6.814 11.498 1.00 0.76 H new ATOM 0 HA PHE B 122 5.653 3.854 11.673 1.00 0.84 H new ATOM 0 HB2 PHE B 122 5.856 5.463 9.099 1.00 0.86 H new ATOM 0 HB3 PHE B 122 5.561 3.743 9.269 1.00 0.86 H new ATOM 0 HD1 PHE B 122 4.056 7.013 10.288 1.00 1.42 H new ATOM 0 HD2 PHE B 122 3.357 2.975 9.121 1.00 1.41 H new ATOM 0 HE1 PHE B 122 1.636 7.419 10.342 1.00 1.50 H new ATOM 0 HE2 PHE B 122 0.933 3.385 9.156 1.00 1.53 H new ATOM 0 HZ PHE B 122 0.068 5.608 9.770 1.00 1.15 H new ATOM 1534 N GLY B 123 8.081 5.893 11.492 1.00 0.84 N ATOM 1535 CA GLY B 123 9.529 5.993 11.477 1.00 0.89 C ATOM 1536 C GLY B 123 10.046 7.068 12.416 1.00 0.89 C ATOM 1537 O GLY B 123 9.331 7.500 13.317 1.00 0.90 O ATOM 0 H GLY B 123 7.597 6.722 11.837 1.00 0.84 H new ATOM 0 HA2 GLY B 123 9.960 5.032 11.758 1.00 0.89 H new ATOM 0 HA3 GLY B 123 9.865 6.209 10.463 1.00 0.89 H new ATOM 1541 N PRO B 124 11.297 7.524 12.223 1.00 1.02 N ATOM 1542 CA PRO B 124 11.905 8.561 13.061 1.00 1.08 C ATOM 1543 C PRO B 124 11.266 9.929 12.844 1.00 0.96 C ATOM 1544 O PRO B 124 10.841 10.586 13.795 1.00 1.02 O ATOM 1545 CB PRO B 124 13.377 8.594 12.618 1.00 1.33 C ATOM 1546 CG PRO B 124 13.565 7.420 11.715 1.00 1.51 C ATOM 1547 CD PRO B 124 12.210 7.070 11.171 1.00 1.26 C ATOM 0 HA PRO B 124 11.774 8.338 14.120 1.00 1.08 H new ATOM 0 HB2 PRO B 124 13.607 9.525 12.100 1.00 1.33 H new ATOM 0 HB3 PRO B 124 14.044 8.535 13.478 1.00 1.33 H new ATOM 0 HG2 PRO B 124 14.256 7.661 10.907 1.00 1.51 H new ATOM 0 HG3 PRO B 124 13.992 6.578 12.259 1.00 1.51 H new ATOM 0 HD2 PRO B 124 12.014 7.573 10.224 1.00 1.26 H new ATOM 0 HD3 PRO B 124 12.114 6.000 10.989 1.00 1.26 H new ATOM 1555 N SER B 125 11.207 10.353 11.585 1.00 0.97 N ATOM 1556 CA SER B 125 10.625 11.645 11.235 1.00 0.92 C ATOM 1557 C SER B 125 9.420 11.465 10.312 1.00 0.76 C ATOM 1558 O SER B 125 9.284 12.175 9.323 1.00 0.78 O ATOM 1559 CB SER B 125 11.680 12.530 10.553 1.00 1.12 C ATOM 1560 OG SER B 125 12.255 13.442 11.473 1.00 1.25 O ATOM 0 H SER B 125 11.556 9.820 10.789 1.00 0.97 H new ATOM 0 HA SER B 125 10.288 12.129 12.151 1.00 0.92 H new ATOM 0 HB2 SER B 125 12.461 11.903 10.122 1.00 1.12 H new ATOM 0 HB3 SER B 125 11.221 13.079 9.731 1.00 1.12 H new ATOM 0 HG SER B 125 13.008 13.904 11.048 1.00 1.25 H new ATOM 1566 N ILE B 126 8.553 10.503 10.624 1.00 0.70 N ATOM 1567 CA ILE B 126 7.387 10.247 9.790 1.00 0.60 C ATOM 1568 C ILE B 126 6.137 9.895 10.607 1.00 0.57 C ATOM 1569 O ILE B 126 6.119 8.909 11.341 1.00 0.74 O ATOM 1570 CB ILE B 126 7.694 9.129 8.767 1.00 0.60 C ATOM 1571 CG1 ILE B 126 8.655 9.657 7.711 1.00 0.79 C ATOM 1572 CG2 ILE B 126 6.431 8.599 8.100 1.00 0.72 C ATOM 1573 CD1 ILE B 126 9.062 8.616 6.690 1.00 0.85 C ATOM 0 H ILE B 126 8.637 9.896 11.439 1.00 0.70 H new ATOM 0 HA ILE B 126 7.167 11.174 9.261 1.00 0.60 H new ATOM 0 HB ILE B 126 8.150 8.299 9.307 1.00 0.60 H new ATOM 0 HG12 ILE B 126 8.190 10.497 7.196 1.00 0.79 H new ATOM 0 HG13 ILE B 126 9.549 10.040 8.204 1.00 0.79 H new ATOM 0 HG21 ILE B 126 6.696 7.816 7.390 1.00 0.72 H new ATOM 0 HG22 ILE B 126 5.763 8.190 8.858 1.00 0.72 H new ATOM 0 HG23 ILE B 126 5.929 9.411 7.574 1.00 0.72 H new ATOM 0 HD11 ILE B 126 9.747 9.062 5.969 1.00 0.85 H new ATOM 0 HD12 ILE B 126 9.556 7.786 7.194 1.00 0.85 H new ATOM 0 HD13 ILE B 126 8.176 8.250 6.171 1.00 0.85 H new ATOM 1585 N CYS B 127 5.088 10.703 10.438 1.00 0.54 N ATOM 1586 CA CYS B 127 3.810 10.489 11.122 1.00 0.53 C ATOM 1587 C CYS B 127 2.666 10.666 10.129 1.00 0.53 C ATOM 1588 O CYS B 127 2.779 11.474 9.213 1.00 0.56 O ATOM 1589 CB CYS B 127 3.649 11.457 12.288 1.00 0.56 C ATOM 1590 SG CYS B 127 2.408 10.930 13.509 1.00 0.89 S ATOM 0 H CYS B 127 5.099 11.520 9.827 1.00 0.54 H new ATOM 0 HA CYS B 127 3.791 9.475 11.521 1.00 0.53 H new ATOM 0 HB2 CYS B 127 4.611 11.574 12.788 1.00 0.56 H new ATOM 0 HB3 CYS B 127 3.371 12.437 11.900 1.00 0.56 H new ATOM 1595 N CYS B 128 1.588 9.877 10.279 1.00 0.53 N ATOM 1596 CA CYS B 128 0.469 9.932 9.331 1.00 0.56 C ATOM 1597 C CYS B 128 -0.947 9.856 9.962 1.00 0.60 C ATOM 1598 O CYS B 128 -1.166 9.313 11.042 1.00 0.76 O ATOM 1599 CB CYS B 128 0.581 8.777 8.306 1.00 0.63 C ATOM 1600 SG CYS B 128 0.981 9.276 6.613 1.00 1.23 S ATOM 0 H CYS B 128 1.471 9.204 11.037 1.00 0.53 H new ATOM 0 HA CYS B 128 0.561 10.915 8.870 1.00 0.56 H new ATOM 0 HB2 CYS B 128 1.345 8.081 8.651 1.00 0.63 H new ATOM 0 HB3 CYS B 128 -0.364 8.233 8.293 1.00 0.63 H new ATOM 1605 N GLY B 129 -1.854 10.456 9.189 1.00 0.60 N ATOM 1606 CA GLY B 129 -3.244 10.523 9.519 1.00 0.65 C ATOM 1607 C GLY B 129 -4.160 10.401 8.324 1.00 0.66 C ATOM 1608 O GLY B 129 -3.765 10.572 7.188 1.00 0.64 O ATOM 0 H GLY B 129 -1.621 10.911 8.306 1.00 0.60 H new ATOM 0 HA2 GLY B 129 -3.479 9.729 10.228 1.00 0.65 H new ATOM 0 HA3 GLY B 129 -3.443 11.469 10.023 1.00 0.65 H new ATOM 1612 N ASP B 130 -5.403 10.172 8.632 1.00 0.72 N ATOM 1613 CA ASP B 130 -6.513 10.067 7.694 1.00 0.76 C ATOM 1614 C ASP B 130 -6.818 11.426 7.063 1.00 0.77 C ATOM 1615 O ASP B 130 -6.884 11.594 5.845 1.00 0.81 O ATOM 1616 CB ASP B 130 -7.774 9.554 8.395 1.00 0.84 C ATOM 1617 CG ASP B 130 -8.205 10.461 9.535 1.00 1.47 C ATOM 1618 OD1 ASP B 130 -7.361 10.752 10.406 1.00 1.96 O ATOM 1619 OD2 ASP B 130 -9.385 10.877 9.556 1.00 2.35 O ATOM 0 H ASP B 130 -5.700 10.044 9.599 1.00 0.72 H new ATOM 0 HA ASP B 130 -6.219 9.361 6.917 1.00 0.76 H new ATOM 0 HB2 ASP B 130 -8.584 9.474 7.670 1.00 0.84 H new ATOM 0 HB3 ASP B 130 -7.591 8.551 8.780 1.00 0.84 H new ATOM 1624 N GLU B 131 -6.761 12.394 7.954 1.00 0.79 N ATOM 1625 CA GLU B 131 -6.807 13.761 7.502 1.00 0.85 C ATOM 1626 C GLU B 131 -5.687 14.502 8.121 1.00 0.89 C ATOM 1627 O GLU B 131 -5.800 15.705 8.362 1.00 1.03 O ATOM 1628 CB GLU B 131 -8.146 14.412 7.868 1.00 0.93 C ATOM 1629 CG GLU B 131 -9.243 13.407 8.155 1.00 1.02 C ATOM 1630 CD GLU B 131 -10.628 14.030 8.112 1.00 1.16 C ATOM 1631 OE1 GLU B 131 -11.091 14.359 7.000 1.00 1.69 O ATOM 1632 OE2 GLU B 131 -11.245 14.191 9.186 1.00 1.63 O ATOM 0 H GLU B 131 -6.685 12.264 8.963 1.00 0.79 H new ATOM 0 HA GLU B 131 -6.713 13.787 6.416 1.00 0.85 H new ATOM 0 HB2 GLU B 131 -8.006 15.047 8.743 1.00 0.93 H new ATOM 0 HB3 GLU B 131 -8.462 15.061 7.051 1.00 0.93 H new ATOM 0 HG2 GLU B 131 -9.189 12.598 7.427 1.00 1.02 H new ATOM 0 HG3 GLU B 131 -9.078 12.964 9.137 1.00 1.02 H new ATOM 1639 N LEU B 132 -4.572 13.837 8.329 1.00 0.83 N ATOM 1640 CA LEU B 132 -3.435 14.424 8.900 1.00 0.89 C ATOM 1641 C LEU B 132 -2.241 14.067 8.023 1.00 0.83 C ATOM 1642 O LEU B 132 -1.116 14.498 8.269 1.00 0.91 O ATOM 1643 CB LEU B 132 -3.309 13.817 10.280 1.00 0.93 C ATOM 1644 CG LEU B 132 -3.604 14.765 11.448 1.00 1.16 C ATOM 1645 CD1 LEU B 132 -4.728 14.220 12.324 1.00 1.25 C ATOM 1646 CD2 LEU B 132 -2.372 15.008 12.283 1.00 1.38 C ATOM 0 H LEU B 132 -4.453 12.852 8.092 1.00 0.83 H new ATOM 0 HA LEU B 132 -3.492 15.510 8.973 1.00 0.89 H new ATOM 0 HB2 LEU B 132 -3.986 12.965 10.346 1.00 0.93 H new ATOM 0 HB3 LEU B 132 -2.297 13.429 10.396 1.00 0.93 H new ATOM 0 HG LEU B 132 -3.922 15.716 11.021 1.00 1.16 H new ATOM 0 HD11 LEU B 132 -4.917 14.911 13.145 1.00 1.25 H new ATOM 0 HD12 LEU B 132 -5.633 14.109 11.727 1.00 1.25 H new ATOM 0 HD13 LEU B 132 -4.438 13.250 12.727 1.00 1.25 H new ATOM 0 HD21 LEU B 132 -2.615 15.684 13.103 1.00 1.38 H new ATOM 0 HD22 LEU B 132 -2.014 14.061 12.688 1.00 1.38 H new ATOM 0 HD23 LEU B 132 -1.595 15.454 11.663 1.00 1.38 H new ATOM 1658 N GLY B 133 -2.523 13.283 6.969 1.00 0.72 N ATOM 1659 CA GLY B 133 -1.514 12.876 6.047 1.00 0.70 C ATOM 1660 C GLY B 133 -0.247 12.428 6.725 1.00 0.66 C ATOM 1661 O GLY B 133 -0.305 11.648 7.662 1.00 0.65 O ATOM 0 H GLY B 133 -3.456 12.930 6.756 1.00 0.72 H new ATOM 0 HA2 GLY B 133 -1.898 12.062 5.432 1.00 0.70 H new ATOM 0 HA3 GLY B 133 -1.287 13.704 5.375 1.00 0.70 H new ATOM 1665 N CYS B 134 0.910 12.885 6.250 1.00 0.69 N ATOM 1666 CA CYS B 134 2.168 12.468 6.843 1.00 0.68 C ATOM 1667 C CYS B 134 3.120 13.586 7.069 1.00 0.64 C ATOM 1668 O CYS B 134 3.695 14.109 6.125 1.00 0.62 O ATOM 1669 CB CYS B 134 2.839 11.459 5.957 1.00 0.72 C ATOM 1670 SG CYS B 134 2.926 9.805 6.682 1.00 1.08 S ATOM 0 H CYS B 134 0.998 13.534 5.468 1.00 0.69 H new ATOM 0 HA CYS B 134 1.914 12.046 7.815 1.00 0.68 H new ATOM 0 HB2 CYS B 134 2.301 11.404 5.011 1.00 0.72 H new ATOM 0 HB3 CYS B 134 3.849 11.801 5.730 1.00 0.72 H new ATOM 1675 N PHE B 135 3.359 13.898 8.327 1.00 0.67 N ATOM 1676 CA PHE B 135 4.328 14.905 8.622 1.00 0.66 C ATOM 1677 C PHE B 135 5.636 14.185 8.617 1.00 0.64 C ATOM 1678 O PHE B 135 5.922 13.421 9.539 1.00 0.64 O ATOM 1679 CB PHE B 135 4.084 15.532 9.992 1.00 0.70 C ATOM 1680 CG PHE B 135 2.655 15.896 10.225 1.00 0.72 C ATOM 1681 CD1 PHE B 135 2.067 16.933 9.525 1.00 0.96 C ATOM 1682 CD2 PHE B 135 1.897 15.187 11.131 1.00 1.15 C ATOM 1683 CE1 PHE B 135 0.746 17.257 9.724 1.00 1.19 C ATOM 1684 CE2 PHE B 135 0.576 15.506 11.339 1.00 1.36 C ATOM 1685 CZ PHE B 135 -0.002 16.545 10.632 1.00 1.23 C ATOM 0 H PHE B 135 2.903 13.475 9.135 1.00 0.67 H new ATOM 0 HA PHE B 135 4.288 15.720 7.900 1.00 0.66 H new ATOM 0 HB2 PHE B 135 4.406 14.835 10.766 1.00 0.70 H new ATOM 0 HB3 PHE B 135 4.701 16.425 10.091 1.00 0.70 H new ATOM 0 HD1 PHE B 135 2.653 17.496 8.813 1.00 0.96 H new ATOM 0 HD2 PHE B 135 2.344 14.373 11.683 1.00 1.15 H new ATOM 0 HE1 PHE B 135 0.297 18.068 9.169 1.00 1.19 H new ATOM 0 HE2 PHE B 135 -0.010 14.946 12.053 1.00 1.36 H new ATOM 0 HZ PHE B 135 -1.040 16.797 10.793 1.00 1.23 H new ATOM 1695 N VAL B 136 6.440 14.390 7.600 1.00 0.66 N ATOM 1696 CA VAL B 136 7.686 13.698 7.568 1.00 0.68 C ATOM 1697 C VAL B 136 8.738 14.568 8.212 1.00 0.71 C ATOM 1698 O VAL B 136 9.478 15.317 7.567 1.00 0.74 O ATOM 1699 CB VAL B 136 8.066 13.259 6.137 1.00 0.73 C ATOM 1700 CG1 VAL B 136 9.244 12.290 6.170 1.00 0.75 C ATOM 1701 CG2 VAL B 136 6.853 12.616 5.446 1.00 0.74 C ATOM 0 H VAL B 136 6.255 15.011 6.812 1.00 0.66 H new ATOM 0 HA VAL B 136 7.604 12.772 8.137 1.00 0.68 H new ATOM 0 HB VAL B 136 8.367 14.138 5.567 1.00 0.73 H new ATOM 0 HG11 VAL B 136 9.498 11.991 5.153 1.00 0.75 H new ATOM 0 HG12 VAL B 136 10.103 12.778 6.630 1.00 0.75 H new ATOM 0 HG13 VAL B 136 8.973 11.408 6.750 1.00 0.75 H new ATOM 0 HG21 VAL B 136 7.129 12.309 4.437 1.00 0.74 H new ATOM 0 HG22 VAL B 136 6.530 11.744 6.015 1.00 0.74 H new ATOM 0 HG23 VAL B 136 6.038 13.338 5.395 1.00 0.74 H new ATOM 1711 N GLY B 137 8.765 14.439 9.529 1.00 0.72 N ATOM 1712 CA GLY B 137 9.715 15.173 10.350 1.00 0.76 C ATOM 1713 C GLY B 137 9.246 16.548 10.808 1.00 0.73 C ATOM 1714 O GLY B 137 9.210 17.501 10.034 1.00 0.83 O ATOM 0 H GLY B 137 8.137 13.830 10.054 1.00 0.72 H new ATOM 0 HA2 GLY B 137 9.949 14.574 11.230 1.00 0.76 H new ATOM 0 HA3 GLY B 137 10.642 15.291 9.789 1.00 0.76 H new ATOM 1718 N THR B 138 8.942 16.636 12.097 1.00 0.69 N ATOM 1719 CA THR B 138 8.504 17.873 12.741 1.00 0.70 C ATOM 1720 C THR B 138 8.399 17.604 14.240 1.00 0.73 C ATOM 1721 O THR B 138 8.616 16.468 14.658 1.00 0.77 O ATOM 1722 CB THR B 138 7.192 18.377 12.143 1.00 0.73 C ATOM 1723 OG1 THR B 138 6.437 19.101 13.101 1.00 0.78 O ATOM 1724 CG2 THR B 138 6.333 17.267 11.585 1.00 0.77 C ATOM 0 H THR B 138 8.993 15.841 12.735 1.00 0.69 H new ATOM 0 HA THR B 138 9.227 18.670 12.568 1.00 0.70 H new ATOM 0 HB THR B 138 7.478 19.032 11.320 1.00 0.73 H new ATOM 0 HG1 THR B 138 5.517 18.763 13.115 1.00 0.78 H new ATOM 0 HG21 THR B 138 5.415 17.688 11.175 1.00 0.77 H new ATOM 0 HG22 THR B 138 6.877 16.747 10.797 1.00 0.77 H new ATOM 0 HG23 THR B 138 6.085 16.564 12.380 1.00 0.77 H new ATOM 1732 N ALA B 139 8.006 18.577 15.058 1.00 0.79 N ATOM 1733 CA ALA B 139 7.893 18.309 16.489 1.00 0.88 C ATOM 1734 C ALA B 139 6.803 17.287 16.778 1.00 0.83 C ATOM 1735 O ALA B 139 6.946 16.464 17.683 1.00 0.87 O ATOM 1736 CB ALA B 139 7.652 19.598 17.258 1.00 1.04 C ATOM 0 H ALA B 139 7.768 19.526 14.769 1.00 0.79 H new ATOM 0 HA ALA B 139 8.838 17.883 16.826 1.00 0.88 H new ATOM 0 HB1 ALA B 139 7.571 19.377 18.322 1.00 1.04 H new ATOM 0 HB2 ALA B 139 8.484 20.282 17.092 1.00 1.04 H new ATOM 0 HB3 ALA B 139 6.728 20.061 16.912 1.00 1.04 H new ATOM 1742 N GLU B 140 5.698 17.346 16.043 1.00 0.79 N ATOM 1743 CA GLU B 140 4.594 16.415 16.257 1.00 0.79 C ATOM 1744 C GLU B 140 5.024 14.974 16.001 1.00 0.73 C ATOM 1745 O GLU B 140 4.411 14.032 16.497 1.00 0.79 O ATOM 1746 CB GLU B 140 3.438 16.767 15.319 1.00 0.83 C ATOM 1747 CG GLU B 140 2.409 17.696 15.939 1.00 1.27 C ATOM 1748 CD GLU B 140 2.390 19.063 15.286 1.00 1.55 C ATOM 1749 OE1 GLU B 140 3.303 19.867 15.564 1.00 2.31 O ATOM 1750 OE2 GLU B 140 1.462 19.329 14.493 1.00 1.90 O ATOM 0 H GLU B 140 5.542 18.024 15.297 1.00 0.79 H new ATOM 0 HA GLU B 140 4.278 16.501 17.296 1.00 0.79 H new ATOM 0 HB2 GLU B 140 3.841 17.234 14.420 1.00 0.83 H new ATOM 0 HB3 GLU B 140 2.943 15.848 15.006 1.00 0.83 H new ATOM 0 HG2 GLU B 140 1.421 17.244 15.856 1.00 1.27 H new ATOM 0 HG3 GLU B 140 2.620 17.808 17.002 1.00 1.27 H new ATOM 1757 N ALA B 141 6.077 14.825 15.215 1.00 0.69 N ATOM 1758 CA ALA B 141 6.593 13.521 14.872 1.00 0.70 C ATOM 1759 C ALA B 141 7.694 13.106 15.825 1.00 0.77 C ATOM 1760 O ALA B 141 8.035 11.935 15.896 1.00 0.87 O ATOM 1761 CB ALA B 141 7.073 13.487 13.433 1.00 0.75 C ATOM 0 H ALA B 141 6.592 15.602 14.802 1.00 0.69 H new ATOM 0 HA ALA B 141 5.780 12.802 14.968 1.00 0.70 H new ATOM 0 HB1 ALA B 141 7.457 12.494 13.201 1.00 0.75 H new ATOM 0 HB2 ALA B 141 6.242 13.720 12.767 1.00 0.75 H new ATOM 0 HB3 ALA B 141 7.865 14.223 13.296 1.00 0.75 H new ATOM 1767 N LEU B 142 8.293 14.064 16.529 1.00 0.80 N ATOM 1768 CA LEU B 142 9.381 13.753 17.446 1.00 0.93 C ATOM 1769 C LEU B 142 9.094 12.523 18.291 1.00 1.06 C ATOM 1770 O LEU B 142 9.953 11.651 18.417 1.00 1.24 O ATOM 1771 CB LEU B 142 9.692 14.953 18.340 1.00 0.97 C ATOM 1772 CG LEU B 142 10.740 15.931 17.794 1.00 1.01 C ATOM 1773 CD1 LEU B 142 10.517 17.328 18.358 1.00 1.11 C ATOM 1774 CD2 LEU B 142 12.146 15.447 18.114 1.00 1.14 C ATOM 0 H LEU B 142 8.045 15.052 16.482 1.00 0.80 H new ATOM 0 HA LEU B 142 10.255 13.527 16.836 1.00 0.93 H new ATOM 0 HB2 LEU B 142 8.767 15.501 18.517 1.00 0.97 H new ATOM 0 HB3 LEU B 142 10.034 14.584 19.307 1.00 0.97 H new ATOM 0 HG LEU B 142 10.630 15.976 16.710 1.00 1.01 H new ATOM 0 HD11 LEU B 142 11.271 18.006 17.958 1.00 1.11 H new ATOM 0 HD12 LEU B 142 9.525 17.680 18.075 1.00 1.11 H new ATOM 0 HD13 LEU B 142 10.595 17.298 19.445 1.00 1.11 H new ATOM 0 HD21 LEU B 142 12.874 16.155 17.718 1.00 1.14 H new ATOM 0 HD22 LEU B 142 12.267 15.369 19.194 1.00 1.14 H new ATOM 0 HD23 LEU B 142 12.307 14.469 17.659 1.00 1.14 H new ATOM 1786 N ARG B 143 7.894 12.420 18.850 1.00 1.06 N ATOM 1787 CA ARG B 143 7.567 11.243 19.635 1.00 1.26 C ATOM 1788 C ARG B 143 7.799 10.008 18.753 1.00 1.27 C ATOM 1789 O ARG B 143 7.974 8.892 19.246 1.00 1.49 O ATOM 1790 CB ARG B 143 6.163 11.347 20.243 1.00 1.35 C ATOM 1791 CG ARG B 143 5.054 10.726 19.422 1.00 1.36 C ATOM 1792 CD ARG B 143 4.745 9.315 19.892 1.00 1.50 C ATOM 1793 NE ARG B 143 4.692 9.207 21.351 1.00 1.90 N ATOM 1794 CZ ARG B 143 3.706 9.695 22.102 1.00 2.20 C ATOM 1795 NH1 ARG B 143 2.701 10.358 21.543 1.00 2.36 N ATOM 1796 NH2 ARG B 143 3.728 9.526 23.418 1.00 2.93 N ATOM 0 H ARG B 143 7.153 13.117 18.777 1.00 1.06 H new ATOM 0 HA ARG B 143 8.219 11.154 20.504 1.00 1.26 H new ATOM 0 HB2 ARG B 143 6.174 10.874 21.225 1.00 1.35 H new ATOM 0 HB3 ARG B 143 5.930 12.400 20.400 1.00 1.35 H new ATOM 0 HG2 ARG B 143 4.157 11.341 19.494 1.00 1.36 H new ATOM 0 HG3 ARG B 143 5.343 10.707 18.371 1.00 1.36 H new ATOM 0 HD2 ARG B 143 3.790 8.997 19.473 1.00 1.50 H new ATOM 0 HD3 ARG B 143 5.504 8.634 19.508 1.00 1.50 H new ATOM 0 HE ARG B 143 5.459 8.728 21.823 1.00 1.90 H new ATOM 0 HH11 ARG B 143 2.681 10.496 20.533 1.00 2.36 H new ATOM 0 HH12 ARG B 143 1.949 10.729 22.124 1.00 2.36 H new ATOM 0 HH21 ARG B 143 4.500 9.022 23.855 1.00 2.93 H new ATOM 0 HH22 ARG B 143 2.973 9.900 23.993 1.00 2.93 H new ATOM 1810 N CYS B 144 7.734 10.215 17.426 1.00 1.10 N ATOM 1811 CA CYS B 144 7.932 9.101 16.473 1.00 1.17 C ATOM 1812 C CYS B 144 9.410 8.631 16.484 1.00 1.44 C ATOM 1813 O CYS B 144 9.821 7.795 15.684 1.00 1.61 O ATOM 1814 CB CYS B 144 7.516 9.487 15.045 1.00 1.05 C ATOM 1815 SG CYS B 144 5.847 10.210 14.896 1.00 1.26 S ATOM 0 H CYS B 144 7.550 11.120 16.993 1.00 1.10 H new ATOM 0 HA CYS B 144 7.291 8.281 16.798 1.00 1.17 H new ATOM 0 HB2 CYS B 144 8.241 10.200 14.652 1.00 1.05 H new ATOM 0 HB3 CYS B 144 7.568 8.599 14.415 1.00 1.05 H new ATOM 1820 N GLN B 145 10.165 9.168 17.442 1.00 1.58 N ATOM 1821 CA GLN B 145 11.578 8.810 17.621 1.00 1.89 C ATOM 1822 C GLN B 145 11.712 7.471 18.345 1.00 2.14 C ATOM 1823 O GLN B 145 12.748 6.802 18.267 1.00 2.40 O ATOM 1824 CB GLN B 145 12.353 9.891 18.378 1.00 2.00 C ATOM 1825 CG GLN B 145 13.629 10.321 17.670 1.00 2.43 C ATOM 1826 CD GLN B 145 14.493 11.234 18.520 1.00 2.77 C ATOM 1827 OE1 GLN B 145 14.266 12.442 18.580 1.00 3.35 O ATOM 1828 NE2 GLN B 145 15.489 10.659 19.183 1.00 3.05 N ATOM 0 H GLN B 145 9.822 9.857 18.111 1.00 1.58 H new ATOM 0 HA GLN B 145 12.011 8.723 16.625 1.00 1.89 H new ATOM 0 HB2 GLN B 145 11.711 10.761 18.515 1.00 2.00 H new ATOM 0 HB3 GLN B 145 12.604 9.520 19.372 1.00 2.00 H new ATOM 0 HG2 GLN B 145 14.203 9.436 17.396 1.00 2.43 H new ATOM 0 HG3 GLN B 145 13.370 10.832 16.743 1.00 2.43 H new ATOM 0 HE21 GLN B 145 15.641 9.653 19.104 1.00 3.05 H new ATOM 0 HE22 GLN B 145 16.103 11.223 19.771 1.00 3.05 H new ATOM 1837 N GLU B 146 10.659 7.061 19.042 1.00 2.12 N ATOM 1838 CA GLU B 146 10.703 5.805 19.768 1.00 2.41 C ATOM 1839 C GLU B 146 10.302 4.646 18.868 1.00 2.40 C ATOM 1840 O GLU B 146 10.351 3.483 19.276 1.00 2.57 O ATOM 1841 CB GLU B 146 9.782 5.866 20.990 1.00 2.47 C ATOM 1842 CG GLU B 146 10.103 4.825 22.051 1.00 2.88 C ATOM 1843 CD GLU B 146 9.013 4.696 23.098 1.00 3.26 C ATOM 1844 OE1 GLU B 146 8.900 5.601 23.952 1.00 3.59 O ATOM 1845 OE2 GLU B 146 8.273 3.690 23.064 1.00 3.76 O ATOM 0 H GLU B 146 9.780 7.572 19.118 1.00 2.12 H new ATOM 0 HA GLU B 146 11.727 5.641 20.104 1.00 2.41 H new ATOM 0 HB2 GLU B 146 9.850 6.859 21.435 1.00 2.47 H new ATOM 0 HB3 GLU B 146 8.751 5.733 20.663 1.00 2.47 H new ATOM 0 HG2 GLU B 146 10.255 3.858 21.571 1.00 2.88 H new ATOM 0 HG3 GLU B 146 11.041 5.089 22.540 1.00 2.88 H new ATOM 1852 N GLU B 147 9.980 4.959 17.616 1.00 2.27 N ATOM 1853 CA GLU B 147 9.632 3.932 16.657 1.00 2.36 C ATOM 1854 C GLU B 147 10.904 3.338 16.064 1.00 2.40 C ATOM 1855 O GLU B 147 10.848 2.472 15.189 1.00 2.48 O ATOM 1856 CB GLU B 147 8.747 4.499 15.545 1.00 2.40 C ATOM 1857 CG GLU B 147 7.636 3.555 15.115 1.00 2.97 C ATOM 1858 CD GLU B 147 7.886 2.941 13.750 1.00 3.47 C ATOM 1859 OE1 GLU B 147 9.059 2.890 13.327 1.00 3.71 O ATOM 1860 OE2 GLU B 147 6.906 2.505 13.108 1.00 4.01 O ATOM 0 H GLU B 147 9.955 5.911 17.250 1.00 2.27 H new ATOM 0 HA GLU B 147 9.070 3.151 17.170 1.00 2.36 H new ATOM 0 HB2 GLU B 147 8.306 5.436 15.885 1.00 2.40 H new ATOM 0 HB3 GLU B 147 9.368 4.734 14.681 1.00 2.40 H new ATOM 0 HG2 GLU B 147 7.534 2.760 15.854 1.00 2.97 H new ATOM 0 HG3 GLU B 147 6.690 4.097 15.098 1.00 2.97 H new ATOM 1867 N ASN B 148 12.056 3.793 16.564 1.00 2.59 N ATOM 1868 CA ASN B 148 13.326 3.281 16.098 1.00 3.03 C ATOM 1869 C ASN B 148 13.833 2.201 17.044 1.00 3.37 C ATOM 1870 O ASN B 148 14.557 1.295 16.633 1.00 3.85 O ATOM 1871 CB ASN B 148 14.359 4.403 15.971 1.00 3.19 C ATOM 1872 CG ASN B 148 14.868 4.544 14.553 1.00 3.48 C ATOM 1873 OD1 ASN B 148 16.069 4.459 14.298 1.00 3.92 O ATOM 1874 ND2 ASN B 148 13.950 4.763 13.620 1.00 3.79 N ATOM 0 H ASN B 148 12.125 4.510 17.286 1.00 2.59 H new ATOM 0 HA ASN B 148 13.177 2.847 15.109 1.00 3.03 H new ATOM 0 HB2 ASN B 148 13.913 5.345 16.292 1.00 3.19 H new ATOM 0 HB3 ASN B 148 15.197 4.203 16.639 1.00 3.19 H new ATOM 0 HD21 ASN B 148 14.229 4.868 12.645 1.00 3.79 H new ATOM 0 HD22 ASN B 148 12.965 4.826 13.878 1.00 3.79 H new ATOM 1881 N TYR B 149 13.445 2.298 18.316 1.00 3.23 N ATOM 1882 CA TYR B 149 13.875 1.319 19.314 1.00 3.61 C ATOM 1883 C TYR B 149 13.229 -0.054 19.098 1.00 3.72 C ATOM 1884 O TYR B 149 13.354 -0.938 19.945 1.00 4.14 O ATOM 1885 CB TYR B 149 13.559 1.828 20.722 1.00 3.69 C ATOM 1886 CG TYR B 149 14.095 3.217 20.998 1.00 4.04 C ATOM 1887 CD1 TYR B 149 15.461 3.478 20.991 1.00 4.26 C ATOM 1888 CD2 TYR B 149 13.231 4.268 21.260 1.00 4.59 C ATOM 1889 CE1 TYR B 149 15.944 4.749 21.237 1.00 4.76 C ATOM 1890 CE2 TYR B 149 13.705 5.541 21.507 1.00 5.11 C ATOM 1891 CZ TYR B 149 15.061 5.777 21.495 1.00 5.09 C ATOM 1892 OH TYR B 149 15.537 7.045 21.739 1.00 5.73 O ATOM 0 H TYR B 149 12.840 3.036 18.677 1.00 3.23 H new ATOM 0 HA TYR B 149 14.952 1.195 19.201 1.00 3.61 H new ATOM 0 HB2 TYR B 149 12.478 1.829 20.865 1.00 3.69 H new ATOM 0 HB3 TYR B 149 13.976 1.135 21.452 1.00 3.69 H new ATOM 0 HD1 TYR B 149 16.155 2.675 20.790 1.00 4.26 H new ATOM 0 HD2 TYR B 149 12.166 4.088 21.271 1.00 4.59 H new ATOM 0 HE1 TYR B 149 17.008 4.937 21.227 1.00 4.76 H new ATOM 0 HE2 TYR B 149 13.015 6.347 21.709 1.00 5.11 H new ATOM 0 HH TYR B 149 14.784 7.651 21.901 1.00 5.73 H new ATOM 1902 N LEU B 150 12.539 -0.235 17.972 1.00 3.60 N ATOM 1903 CA LEU B 150 11.883 -1.507 17.676 1.00 3.76 C ATOM 1904 C LEU B 150 12.211 -1.982 16.260 1.00 3.71 C ATOM 1905 O LEU B 150 11.925 -1.284 15.287 1.00 3.86 O ATOM 1906 CB LEU B 150 10.368 -1.369 17.826 1.00 4.10 C ATOM 1907 CG LEU B 150 9.863 -1.254 19.267 1.00 4.74 C ATOM 1908 CD1 LEU B 150 8.849 -0.125 19.393 1.00 4.91 C ATOM 1909 CD2 LEU B 150 9.260 -2.575 19.730 1.00 5.46 C ATOM 0 H LEU B 150 12.420 0.479 17.254 1.00 3.60 H new ATOM 0 HA LEU B 150 12.255 -2.245 18.386 1.00 3.76 H new ATOM 0 HB2 LEU B 150 10.043 -0.488 17.273 1.00 4.10 H new ATOM 0 HB3 LEU B 150 9.893 -2.232 17.359 1.00 4.10 H new ATOM 0 HG LEU B 150 10.712 -1.022 19.910 1.00 4.74 H new ATOM 0 HD11 LEU B 150 8.503 -0.060 20.425 1.00 4.91 H new ATOM 0 HD12 LEU B 150 9.316 0.817 19.107 1.00 4.91 H new ATOM 0 HD13 LEU B 150 8.001 -0.323 18.737 1.00 4.91 H new ATOM 0 HD21 LEU B 150 8.907 -2.474 20.756 1.00 5.46 H new ATOM 0 HD22 LEU B 150 8.424 -2.840 19.083 1.00 5.46 H new ATOM 0 HD23 LEU B 150 10.018 -3.357 19.683 1.00 5.46 H new ATOM 1921 N PRO B 151 12.811 -3.179 16.118 1.00 3.97 N ATOM 1922 CA PRO B 151 13.161 -3.730 14.809 1.00 4.33 C ATOM 1923 C PRO B 151 11.963 -4.380 14.115 1.00 4.40 C ATOM 1924 O PRO B 151 12.053 -5.508 13.630 1.00 4.80 O ATOM 1925 CB PRO B 151 14.215 -4.779 15.158 1.00 4.97 C ATOM 1926 CG PRO B 151 13.827 -5.261 16.514 1.00 5.02 C ATOM 1927 CD PRO B 151 13.191 -4.088 17.218 1.00 4.41 C ATOM 0 HA PRO B 151 13.507 -2.966 14.113 1.00 4.33 H new ATOM 0 HB2 PRO B 151 14.220 -5.593 14.434 1.00 4.97 H new ATOM 0 HB3 PRO B 151 15.217 -4.349 15.161 1.00 4.97 H new ATOM 0 HG2 PRO B 151 13.130 -6.096 16.444 1.00 5.02 H new ATOM 0 HG3 PRO B 151 14.698 -5.618 17.063 1.00 5.02 H new ATOM 0 HD2 PRO B 151 12.323 -4.395 17.801 1.00 4.41 H new ATOM 0 HD3 PRO B 151 13.887 -3.611 17.909 1.00 4.41 H new ATOM 1935 N SER B 152 10.843 -3.659 14.073 1.00 4.26 N ATOM 1936 CA SER B 152 9.628 -4.164 13.440 1.00 4.43 C ATOM 1937 C SER B 152 8.926 -3.056 12.652 1.00 3.85 C ATOM 1938 O SER B 152 9.167 -1.871 12.883 1.00 3.52 O ATOM 1939 CB SER B 152 8.681 -4.742 14.494 1.00 4.91 C ATOM 1940 OG SER B 152 8.375 -3.782 15.489 1.00 5.73 O ATOM 0 H SER B 152 10.753 -2.724 14.470 1.00 4.26 H new ATOM 0 HA SER B 152 9.909 -4.956 12.745 1.00 4.43 H new ATOM 0 HB2 SER B 152 7.762 -5.079 14.015 1.00 4.91 H new ATOM 0 HB3 SER B 152 9.138 -5.616 14.957 1.00 4.91 H new ATOM 0 HG SER B 152 7.767 -4.177 16.149 1.00 5.73 H new ATOM 1946 N PRO B 153 8.058 -3.429 11.691 1.00 4.04 N ATOM 1947 CA PRO B 153 7.333 -2.475 10.845 1.00 3.79 C ATOM 1948 C PRO B 153 6.066 -1.913 11.506 1.00 2.92 C ATOM 1949 O PRO B 153 5.887 -2.011 12.719 1.00 3.04 O ATOM 1950 CB PRO B 153 6.965 -3.310 9.603 1.00 4.60 C ATOM 1951 CG PRO B 153 7.488 -4.694 9.851 1.00 5.10 C ATOM 1952 CD PRO B 153 7.731 -4.807 11.327 1.00 4.86 C ATOM 0 HA PRO B 153 7.940 -1.595 10.631 1.00 3.79 H new ATOM 0 HB2 PRO B 153 5.886 -3.324 9.451 1.00 4.60 H new ATOM 0 HB3 PRO B 153 7.408 -2.883 8.703 1.00 4.60 H new ATOM 0 HG2 PRO B 153 6.770 -5.444 9.519 1.00 5.10 H new ATOM 0 HG3 PRO B 153 8.409 -4.865 9.293 1.00 5.10 H new ATOM 0 HD2 PRO B 153 6.851 -5.171 11.858 1.00 4.86 H new ATOM 0 HD3 PRO B 153 8.547 -5.493 11.554 1.00 4.86 H new ATOM 1960 N CYS B 154 5.196 -1.317 10.681 1.00 2.52 N ATOM 1961 CA CYS B 154 3.931 -0.721 11.138 1.00 1.97 C ATOM 1962 C CYS B 154 2.973 -0.589 9.942 1.00 2.15 C ATOM 1963 O CYS B 154 3.374 -0.043 8.913 1.00 2.65 O ATOM 1964 CB CYS B 154 4.196 0.666 11.767 1.00 2.30 C ATOM 1965 SG CYS B 154 3.153 1.097 13.213 1.00 2.68 S ATOM 0 H CYS B 154 5.348 -1.234 9.676 1.00 2.52 H new ATOM 0 HA CYS B 154 3.478 -1.362 11.894 1.00 1.97 H new ATOM 0 HB2 CYS B 154 5.242 0.713 12.070 1.00 2.30 H new ATOM 0 HB3 CYS B 154 4.052 1.426 10.999 1.00 2.30 H new ATOM 1970 N GLN B 155 1.724 -1.106 10.033 1.00 2.16 N ATOM 1971 CA GLN B 155 0.809 -1.010 8.869 1.00 2.64 C ATOM 1972 C GLN B 155 0.721 0.402 8.301 1.00 2.19 C ATOM 1973 O GLN B 155 1.454 1.307 8.697 1.00 2.43 O ATOM 1974 CB GLN B 155 -0.618 -1.438 9.214 1.00 3.40 C ATOM 1975 CG GLN B 155 -1.444 -0.320 9.865 1.00 4.33 C ATOM 1976 CD GLN B 155 -2.629 0.106 9.016 1.00 5.12 C ATOM 1977 OE1 GLN B 155 -3.213 -0.702 8.294 1.00 5.61 O ATOM 1978 NE2 GLN B 155 -2.991 1.382 9.104 1.00 5.63 N ATOM 0 H GLN B 155 1.340 -1.571 10.856 1.00 2.16 H new ATOM 0 HA GLN B 155 1.243 -1.684 8.130 1.00 2.64 H new ATOM 0 HB2 GLN B 155 -1.120 -1.770 8.306 1.00 3.40 H new ATOM 0 HB3 GLN B 155 -0.581 -2.293 9.889 1.00 3.40 H new ATOM 0 HG2 GLN B 155 -1.802 -0.658 10.837 1.00 4.33 H new ATOM 0 HG3 GLN B 155 -0.802 0.543 10.044 1.00 4.33 H new ATOM 0 HE21 GLN B 155 -2.478 2.017 9.716 1.00 5.63 H new ATOM 0 HE22 GLN B 155 -3.782 1.726 8.560 1.00 5.63 H new ATOM 1987 N SER B 156 -0.236 0.576 7.387 1.00 2.21 N ATOM 1988 CA SER B 156 -0.487 1.858 6.783 1.00 2.03 C ATOM 1989 C SER B 156 -1.699 1.784 5.840 1.00 1.77 C ATOM 1990 O SER B 156 -2.578 0.944 6.030 1.00 2.17 O ATOM 1991 CB SER B 156 0.774 2.388 6.100 1.00 2.58 C ATOM 1992 OG SER B 156 1.394 1.386 5.323 1.00 3.11 O ATOM 0 H SER B 156 -0.847 -0.171 7.056 1.00 2.21 H new ATOM 0 HA SER B 156 -0.743 2.577 7.561 1.00 2.03 H new ATOM 0 HB2 SER B 156 0.518 3.237 5.466 1.00 2.58 H new ATOM 0 HB3 SER B 156 1.473 2.752 6.853 1.00 2.58 H new ATOM 0 HG SER B 156 2.197 1.753 4.897 1.00 3.11 H new ATOM 1998 N GLY B 157 -1.659 2.505 4.739 1.00 1.55 N ATOM 1999 CA GLY B 157 -2.728 2.393 3.764 1.00 1.82 C ATOM 2000 C GLY B 157 -2.273 1.531 2.637 1.00 1.65 C ATOM 2001 O GLY B 157 -1.073 1.463 2.386 1.00 2.07 O ATOM 0 H GLY B 157 -0.916 3.161 4.498 1.00 1.55 H new ATOM 0 HA2 GLY B 157 -3.617 1.966 4.228 1.00 1.82 H new ATOM 0 HA3 GLY B 157 -3.004 3.380 3.394 1.00 1.82 H new ATOM 2005 N GLN B 158 -3.183 0.856 1.942 1.00 1.33 N ATOM 2006 CA GLN B 158 -2.710 0.027 0.860 1.00 1.42 C ATOM 2007 C GLN B 158 -2.972 0.679 -0.484 1.00 1.04 C ATOM 2008 O GLN B 158 -3.705 0.170 -1.326 1.00 0.95 O ATOM 2009 CB GLN B 158 -3.444 -1.323 0.906 1.00 1.93 C ATOM 2010 CG GLN B 158 -3.388 -2.008 2.261 1.00 2.76 C ATOM 2011 CD GLN B 158 -2.004 -2.524 2.591 1.00 3.57 C ATOM 2012 OE1 GLN B 158 -1.336 -2.016 3.490 1.00 3.89 O ATOM 2013 NE2 GLN B 158 -1.567 -3.546 1.863 1.00 4.34 N ATOM 0 H GLN B 158 -4.191 0.867 2.100 1.00 1.33 H new ATOM 0 HA GLN B 158 -1.635 -0.112 0.977 1.00 1.42 H new ATOM 0 HB2 GLN B 158 -4.487 -1.168 0.631 1.00 1.93 H new ATOM 0 HB3 GLN B 158 -3.012 -1.986 0.156 1.00 1.93 H new ATOM 0 HG2 GLN B 158 -3.705 -1.306 3.033 1.00 2.76 H new ATOM 0 HG3 GLN B 158 -4.095 -2.838 2.275 1.00 2.76 H new ATOM 0 HE21 GLN B 158 -2.155 -3.936 1.127 1.00 4.34 H new ATOM 0 HE22 GLN B 158 -0.643 -3.940 2.040 1.00 4.34 H new ATOM 2022 N LYS B 159 -2.289 1.790 -0.677 1.00 1.15 N ATOM 2023 CA LYS B 159 -2.232 2.521 -1.926 1.00 1.13 C ATOM 2024 C LYS B 159 -0.812 2.479 -2.486 1.00 0.95 C ATOM 2025 O LYS B 159 -0.210 3.553 -2.597 1.00 0.91 O ATOM 2026 CB LYS B 159 -2.778 3.919 -1.763 1.00 1.54 C ATOM 2027 CG LYS B 159 -3.867 4.245 -2.770 1.00 1.91 C ATOM 2028 CD LYS B 159 -5.256 4.116 -2.161 1.00 2.18 C ATOM 2029 CE LYS B 159 -5.941 2.825 -2.586 1.00 2.81 C ATOM 2030 NZ LYS B 159 -6.333 2.847 -4.023 1.00 3.54 N ATOM 0 H LYS B 159 -1.737 2.225 0.062 1.00 1.15 H new ATOM 0 HA LYS B 159 -2.877 2.041 -2.662 1.00 1.13 H new ATOM 0 HB2 LYS B 159 -3.175 4.034 -0.755 1.00 1.54 H new ATOM 0 HB3 LYS B 159 -1.965 4.637 -1.869 1.00 1.54 H new ATOM 0 HG2 LYS B 159 -3.726 5.260 -3.142 1.00 1.91 H new ATOM 0 HG3 LYS B 159 -3.782 3.576 -3.627 1.00 1.91 H new ATOM 0 HD2 LYS B 159 -5.181 4.147 -1.074 1.00 2.18 H new ATOM 0 HD3 LYS B 159 -5.866 4.968 -2.463 1.00 2.18 H new ATOM 0 HE2 LYS B 159 -5.272 1.984 -2.406 1.00 2.81 H new ATOM 0 HE3 LYS B 159 -6.827 2.665 -1.971 1.00 2.81 H new ATOM 0 HZ1 LYS B 159 -7.021 2.089 -4.207 1.00 3.54 H new ATOM 0 HZ2 LYS B 159 -6.761 3.767 -4.252 1.00 3.54 H new ATOM 0 HZ3 LYS B 159 -5.491 2.700 -4.615 1.00 3.54 H new ATOM 2044 N PRO B 160 -0.187 1.325 -2.718 1.00 1.05 N ATOM 2045 CA PRO B 160 1.219 1.294 -3.127 1.00 1.14 C ATOM 2046 C PRO B 160 1.535 1.952 -4.458 1.00 1.10 C ATOM 2047 O PRO B 160 1.763 1.289 -5.468 1.00 1.23 O ATOM 2048 CB PRO B 160 1.572 -0.185 -3.153 1.00 1.46 C ATOM 2049 CG PRO B 160 0.262 -0.885 -3.259 1.00 1.51 C ATOM 2050 CD PRO B 160 -0.723 -0.024 -2.512 1.00 1.27 C ATOM 0 HA PRO B 160 1.811 1.884 -2.427 1.00 1.14 H new ATOM 0 HB2 PRO B 160 2.218 -0.423 -3.998 1.00 1.46 H new ATOM 0 HB3 PRO B 160 2.107 -0.480 -2.250 1.00 1.46 H new ATOM 0 HG2 PRO B 160 -0.034 -1.005 -4.301 1.00 1.51 H new ATOM 0 HG3 PRO B 160 0.316 -1.884 -2.826 1.00 1.51 H new ATOM 0 HD2 PRO B 160 -1.733 -0.124 -2.910 1.00 1.27 H new ATOM 0 HD3 PRO B 160 -0.770 -0.285 -1.455 1.00 1.27 H new ATOM 2058 N CYS B 161 1.613 3.267 -4.410 1.00 1.09 N ATOM 2059 CA CYS B 161 1.984 4.080 -5.554 1.00 1.15 C ATOM 2060 C CYS B 161 3.461 4.420 -5.400 1.00 1.37 C ATOM 2061 O CYS B 161 4.093 3.974 -4.445 1.00 1.58 O ATOM 2062 CB CYS B 161 1.117 5.340 -5.670 1.00 1.32 C ATOM 2063 SG CYS B 161 1.843 6.842 -4.944 1.00 1.58 S ATOM 0 H CYS B 161 1.419 3.808 -3.567 1.00 1.09 H new ATOM 0 HA CYS B 161 1.815 3.529 -6.479 1.00 1.15 H new ATOM 0 HB2 CYS B 161 0.913 5.526 -6.724 1.00 1.32 H new ATOM 0 HB3 CYS B 161 0.158 5.149 -5.188 1.00 1.32 H new ATOM 2068 N GLY B 162 4.016 5.220 -6.294 1.00 1.57 N ATOM 2069 CA GLY B 162 5.412 5.571 -6.134 1.00 1.88 C ATOM 2070 C GLY B 162 6.321 4.391 -6.390 1.00 2.05 C ATOM 2071 O GLY B 162 5.892 3.386 -6.953 1.00 2.37 O ATOM 0 H GLY B 162 3.545 5.623 -7.104 1.00 1.57 H new ATOM 0 HA2 GLY B 162 5.664 6.380 -6.820 1.00 1.88 H new ATOM 0 HA3 GLY B 162 5.579 5.946 -5.124 1.00 1.88 H new ATOM 2075 N SER B 163 7.589 4.521 -6.018 1.00 2.40 N ATOM 2076 CA SER B 163 8.572 3.453 -6.250 1.00 2.93 C ATOM 2077 C SER B 163 8.555 2.417 -5.130 1.00 2.71 C ATOM 2078 O SER B 163 9.602 1.953 -4.678 1.00 3.29 O ATOM 2079 CB SER B 163 9.979 4.042 -6.384 1.00 3.81 C ATOM 2080 OG SER B 163 10.283 4.908 -5.300 1.00 4.07 O ATOM 0 H SER B 163 7.966 5.349 -5.556 1.00 2.40 H new ATOM 0 HA SER B 163 8.296 2.954 -7.179 1.00 2.93 H new ATOM 0 HB2 SER B 163 10.711 3.235 -6.423 1.00 3.81 H new ATOM 0 HB3 SER B 163 10.058 4.590 -7.323 1.00 3.81 H new ATOM 0 HG SER B 163 11.188 5.267 -5.412 1.00 4.07 H new ATOM 2086 N GLY B 164 7.343 2.072 -4.691 1.00 2.12 N ATOM 2087 CA GLY B 164 7.140 1.122 -3.627 1.00 2.11 C ATOM 2088 C GLY B 164 6.384 1.696 -2.420 1.00 1.92 C ATOM 2089 O GLY B 164 6.319 1.028 -1.385 1.00 2.20 O ATOM 0 H GLY B 164 6.478 2.453 -5.074 1.00 2.12 H new ATOM 0 HA2 GLY B 164 6.588 0.267 -4.017 1.00 2.11 H new ATOM 0 HA3 GLY B 164 8.109 0.751 -3.294 1.00 2.11 H new ATOM 2093 N GLY B 165 5.868 2.919 -2.500 1.00 1.61 N ATOM 2094 CA GLY B 165 5.194 3.466 -1.332 1.00 1.60 C ATOM 2095 C GLY B 165 3.672 3.439 -1.384 1.00 1.42 C ATOM 2096 O GLY B 165 3.055 3.810 -2.380 1.00 1.62 O ATOM 0 H GLY B 165 5.900 3.524 -3.320 1.00 1.61 H new ATOM 0 HA2 GLY B 165 5.521 2.912 -0.452 1.00 1.60 H new ATOM 0 HA3 GLY B 165 5.518 4.498 -1.197 1.00 1.60 H new ATOM 2100 N ARG B 166 3.079 3.004 -0.272 1.00 1.16 N ATOM 2101 CA ARG B 166 1.629 2.935 -0.121 1.00 1.03 C ATOM 2102 C ARG B 166 1.112 4.170 0.616 1.00 0.95 C ATOM 2103 O ARG B 166 1.851 4.771 1.395 1.00 1.04 O ATOM 2104 CB ARG B 166 1.212 1.663 0.608 1.00 1.08 C ATOM 2105 CG ARG B 166 1.995 1.411 1.884 1.00 1.23 C ATOM 2106 CD ARG B 166 2.985 0.274 1.707 1.00 1.39 C ATOM 2107 NE ARG B 166 2.323 -1.026 1.720 1.00 1.79 N ATOM 2108 CZ ARG B 166 2.891 -2.149 1.291 1.00 2.31 C ATOM 2109 NH1 ARG B 166 4.128 -2.133 0.810 1.00 2.54 N ATOM 2110 NH2 ARG B 166 2.218 -3.290 1.339 1.00 3.05 N ATOM 0 H ARG B 166 3.594 2.689 0.550 1.00 1.16 H new ATOM 0 HA ARG B 166 1.186 2.911 -1.116 1.00 1.03 H new ATOM 0 HB2 ARG B 166 0.151 1.723 0.849 1.00 1.08 H new ATOM 0 HB3 ARG B 166 1.340 0.812 -0.061 1.00 1.08 H new ATOM 0 HG2 ARG B 166 2.527 2.318 2.172 1.00 1.23 H new ATOM 0 HG3 ARG B 166 1.307 1.174 2.695 1.00 1.23 H new ATOM 0 HD2 ARG B 166 3.520 0.401 0.766 1.00 1.39 H new ATOM 0 HD3 ARG B 166 3.728 0.312 2.503 1.00 1.39 H new ATOM 0 HE ARG B 166 1.370 -1.076 2.079 1.00 1.79 H new ATOM 0 HH11 ARG B 166 4.648 -1.256 0.768 1.00 2.54 H new ATOM 0 HH12 ARG B 166 4.559 -2.997 0.482 1.00 2.54 H new ATOM 0 HH21 ARG B 166 1.266 -3.306 1.705 1.00 3.05 H new ATOM 0 HH22 ARG B 166 2.652 -4.152 1.010 1.00 3.05 H new ATOM 2124 N CYS B 167 -0.148 4.566 0.384 1.00 0.87 N ATOM 2125 CA CYS B 167 -0.676 5.739 1.057 1.00 0.88 C ATOM 2126 C CYS B 167 -0.764 5.488 2.555 1.00 0.88 C ATOM 2127 O CYS B 167 -1.649 4.775 3.009 1.00 0.93 O ATOM 2128 CB CYS B 167 -2.076 6.119 0.524 1.00 0.94 C ATOM 2129 SG CYS B 167 -2.081 7.256 -0.913 1.00 1.56 S ATOM 0 H CYS B 167 -0.798 4.099 -0.249 1.00 0.87 H new ATOM 0 HA CYS B 167 0.006 6.565 0.857 1.00 0.88 H new ATOM 0 HB2 CYS B 167 -2.602 5.205 0.246 1.00 0.94 H new ATOM 0 HB3 CYS B 167 -2.643 6.579 1.333 1.00 0.94 H new ATOM 2134 N ALA B 168 0.098 6.125 3.337 1.00 0.90 N ATOM 2135 CA ALA B 168 0.011 5.977 4.795 1.00 0.95 C ATOM 2136 C ALA B 168 -1.125 6.890 5.261 1.00 0.96 C ATOM 2137 O ALA B 168 -1.660 6.783 6.362 1.00 1.04 O ATOM 2138 CB ALA B 168 1.339 6.290 5.477 1.00 0.96 C ATOM 0 H ALA B 168 0.847 6.733 3.005 1.00 0.90 H new ATOM 0 HA ALA B 168 -0.203 4.945 5.071 1.00 0.95 H new ATOM 0 HB1 ALA B 168 1.232 6.169 6.555 1.00 0.96 H new ATOM 0 HB2 ALA B 168 2.106 5.609 5.110 1.00 0.96 H new ATOM 0 HB3 ALA B 168 1.629 7.317 5.255 1.00 0.96 H new ATOM 2144 N ALA B 169 -1.402 7.823 4.369 1.00 0.90 N ATOM 2145 CA ALA B 169 -2.416 8.850 4.549 1.00 0.94 C ATOM 2146 C ALA B 169 -2.819 9.459 3.215 1.00 0.91 C ATOM 2147 O ALA B 169 -2.096 9.330 2.237 1.00 0.87 O ATOM 2148 CB ALA B 169 -1.913 9.915 5.478 1.00 0.98 C ATOM 0 H ALA B 169 -0.916 7.891 3.475 1.00 0.90 H new ATOM 0 HA ALA B 169 -3.299 8.385 4.988 1.00 0.94 H new ATOM 0 HB1 ALA B 169 -2.680 10.679 5.605 1.00 0.98 H new ATOM 0 HB2 ALA B 169 -1.677 9.472 6.446 1.00 0.98 H new ATOM 0 HB3 ALA B 169 -1.015 10.369 5.059 1.00 0.98 H new ATOM 2154 N ALA B 170 -3.983 10.114 3.199 1.00 0.98 N ATOM 2155 CA ALA B 170 -4.542 10.764 1.998 1.00 1.00 C ATOM 2156 C ALA B 170 -3.494 11.006 0.895 1.00 1.04 C ATOM 2157 O ALA B 170 -2.715 10.115 0.570 1.00 1.25 O ATOM 2158 CB ALA B 170 -5.233 12.064 2.406 1.00 1.15 C ATOM 0 H ALA B 170 -4.574 10.212 4.025 1.00 0.98 H new ATOM 0 HA ALA B 170 -5.271 10.082 1.560 1.00 1.00 H new ATOM 0 HB1 ALA B 170 -5.648 12.548 1.522 1.00 1.15 H new ATOM 0 HB2 ALA B 170 -6.036 11.844 3.110 1.00 1.15 H new ATOM 0 HB3 ALA B 170 -4.509 12.728 2.878 1.00 1.15 H new ATOM 2164 N GLY B 171 -3.512 12.200 0.309 1.00 1.15 N ATOM 2165 CA GLY B 171 -2.597 12.574 -0.773 1.00 1.28 C ATOM 2166 C GLY B 171 -1.104 12.424 -0.441 1.00 1.22 C ATOM 2167 O GLY B 171 -0.300 13.297 -0.753 1.00 1.29 O ATOM 0 H GLY B 171 -4.163 12.940 0.570 1.00 1.15 H new ATOM 0 HA2 GLY B 171 -2.823 11.963 -1.647 1.00 1.28 H new ATOM 0 HA3 GLY B 171 -2.790 13.610 -1.050 1.00 1.28 H new ATOM 2171 N ILE B 172 -0.790 11.380 0.298 1.00 1.13 N ATOM 2172 CA ILE B 172 0.574 11.126 0.763 1.00 1.09 C ATOM 2173 C ILE B 172 0.982 9.660 0.564 1.00 1.02 C ATOM 2174 O ILE B 172 0.520 8.748 1.263 1.00 1.34 O ATOM 2175 CB ILE B 172 0.745 11.576 2.222 1.00 1.53 C ATOM 2176 CG1 ILE B 172 0.437 10.453 3.191 1.00 1.09 C ATOM 2177 CG2 ILE B 172 -0.131 12.782 2.502 1.00 2.27 C ATOM 2178 CD1 ILE B 172 1.672 9.697 3.559 1.00 0.91 C ATOM 0 H ILE B 172 -1.467 10.679 0.598 1.00 1.13 H new ATOM 0 HA ILE B 172 1.251 11.722 0.151 1.00 1.09 H new ATOM 0 HB ILE B 172 1.788 11.855 2.369 1.00 1.53 H new ATOM 0 HG12 ILE B 172 -0.023 10.862 4.091 1.00 1.09 H new ATOM 0 HG13 ILE B 172 -0.288 9.773 2.744 1.00 1.09 H new ATOM 0 HG21 ILE B 172 -0.002 13.093 3.539 1.00 2.27 H new ATOM 0 HG22 ILE B 172 0.154 13.600 1.840 1.00 2.27 H new ATOM 0 HG23 ILE B 172 -1.175 12.521 2.329 1.00 2.27 H new ATOM 0 HD11 ILE B 172 1.416 8.899 4.255 1.00 0.91 H new ATOM 0 HD12 ILE B 172 2.116 9.267 2.661 1.00 0.91 H new ATOM 0 HD13 ILE B 172 2.386 10.373 4.029 1.00 0.91 H new ATOM 2190 N CYS B 173 1.851 9.437 -0.414 1.00 0.81 N ATOM 2191 CA CYS B 173 2.314 8.095 -0.714 1.00 1.04 C ATOM 2192 C CYS B 173 3.601 7.798 0.030 1.00 1.06 C ATOM 2193 O CYS B 173 4.695 7.935 -0.516 1.00 1.19 O ATOM 2194 CB CYS B 173 2.527 7.919 -2.214 1.00 1.17 C ATOM 2195 SG CYS B 173 1.498 6.619 -2.961 1.00 1.94 S ATOM 0 H CYS B 173 2.246 10.166 -1.008 1.00 0.81 H new ATOM 0 HA CYS B 173 1.548 7.393 -0.387 1.00 1.04 H new ATOM 0 HB2 CYS B 173 2.318 8.865 -2.713 1.00 1.17 H new ATOM 0 HB3 CYS B 173 3.576 7.687 -2.397 1.00 1.17 H new ATOM 2200 N CYS B 174 3.466 7.401 1.282 1.00 0.97 N ATOM 2201 CA CYS B 174 4.623 7.090 2.089 1.00 0.99 C ATOM 2202 C CYS B 174 5.095 5.671 1.830 1.00 1.16 C ATOM 2203 O CYS B 174 4.295 4.740 1.732 1.00 1.35 O ATOM 2204 CB CYS B 174 4.323 7.301 3.572 1.00 1.12 C ATOM 2205 SG CYS B 174 5.281 8.657 4.325 1.00 1.26 S ATOM 0 H CYS B 174 2.570 7.288 1.757 1.00 0.97 H new ATOM 0 HA CYS B 174 5.426 7.771 1.806 1.00 0.99 H new ATOM 0 HB2 CYS B 174 3.260 7.508 3.693 1.00 1.12 H new ATOM 0 HB3 CYS B 174 4.531 6.377 4.111 1.00 1.12 H new ATOM 2210 N SER B 175 6.404 5.523 1.713 1.00 1.15 N ATOM 2211 CA SER B 175 7.021 4.228 1.463 1.00 1.38 C ATOM 2212 C SER B 175 7.665 3.720 2.752 1.00 1.29 C ATOM 2213 O SER B 175 7.615 4.405 3.773 1.00 1.12 O ATOM 2214 CB SER B 175 8.061 4.360 0.345 1.00 1.48 C ATOM 2215 OG SER B 175 7.548 5.117 -0.739 1.00 2.00 O ATOM 0 H SER B 175 7.068 6.293 1.788 1.00 1.15 H new ATOM 0 HA SER B 175 6.266 3.510 1.144 1.00 1.38 H new ATOM 0 HB2 SER B 175 8.960 4.838 0.734 1.00 1.48 H new ATOM 0 HB3 SER B 175 8.353 3.369 -0.004 1.00 1.48 H new ATOM 0 HG SER B 175 8.230 5.189 -1.439 1.00 2.00 H new ATOM 2221 N PRO B 176 8.285 2.526 2.747 1.00 1.49 N ATOM 2222 CA PRO B 176 8.921 1.995 3.947 1.00 1.45 C ATOM 2223 C PRO B 176 10.299 2.615 4.177 1.00 1.20 C ATOM 2224 O PRO B 176 11.160 2.023 4.827 1.00 1.25 O ATOM 2225 CB PRO B 176 9.034 0.503 3.644 1.00 1.77 C ATOM 2226 CG PRO B 176 9.182 0.433 2.163 1.00 1.90 C ATOM 2227 CD PRO B 176 8.420 1.608 1.598 1.00 1.81 C ATOM 0 HA PRO B 176 8.358 2.211 4.855 1.00 1.45 H new ATOM 0 HB2 PRO B 176 9.891 0.059 4.150 1.00 1.77 H new ATOM 0 HB3 PRO B 176 8.150 -0.038 3.981 1.00 1.77 H new ATOM 0 HG2 PRO B 176 10.233 0.478 1.876 1.00 1.90 H new ATOM 0 HG3 PRO B 176 8.786 -0.507 1.778 1.00 1.90 H new ATOM 0 HD2 PRO B 176 8.959 2.075 0.774 1.00 1.81 H new ATOM 0 HD3 PRO B 176 7.447 1.305 1.211 1.00 1.81 H new ATOM 2235 N ASP B 177 10.484 3.823 3.642 1.00 1.01 N ATOM 2236 CA ASP B 177 11.734 4.561 3.782 1.00 0.92 C ATOM 2237 C ASP B 177 11.455 6.068 3.878 1.00 0.83 C ATOM 2238 O ASP B 177 12.067 6.772 4.684 1.00 0.90 O ATOM 2239 CB ASP B 177 12.668 4.256 2.606 1.00 1.18 C ATOM 2240 CG ASP B 177 12.741 2.771 2.293 1.00 1.96 C ATOM 2241 OD1 ASP B 177 13.109 1.991 3.197 1.00 2.72 O ATOM 2242 OD2 ASP B 177 12.430 2.390 1.145 1.00 2.51 O ATOM 0 H ASP B 177 9.772 4.314 3.101 1.00 1.01 H new ATOM 0 HA ASP B 177 12.227 4.244 4.701 1.00 0.92 H new ATOM 0 HB2 ASP B 177 12.323 4.794 1.723 1.00 1.18 H new ATOM 0 HB3 ASP B 177 13.668 4.626 2.834 1.00 1.18 H new ATOM 2247 N GLY B 178 10.521 6.556 3.055 1.00 0.89 N ATOM 2248 CA GLY B 178 10.175 7.967 3.081 1.00 0.87 C ATOM 2249 C GLY B 178 8.716 8.231 2.744 1.00 0.85 C ATOM 2250 O GLY B 178 7.820 7.546 3.237 1.00 0.99 O ATOM 0 H GLY B 178 10.003 5.999 2.376 1.00 0.89 H new ATOM 0 HA2 GLY B 178 10.391 8.370 4.071 1.00 0.87 H new ATOM 0 HA3 GLY B 178 10.808 8.503 2.373 1.00 0.87 H new ATOM 2254 N CYS B 179 8.486 9.231 1.894 1.00 0.78 N ATOM 2255 CA CYS B 179 7.134 9.600 1.477 1.00 0.79 C ATOM 2256 C CYS B 179 7.136 10.110 0.038 1.00 0.77 C ATOM 2257 O CYS B 179 8.162 10.570 -0.461 1.00 0.88 O ATOM 2258 CB CYS B 179 6.560 10.657 2.423 1.00 0.92 C ATOM 2259 SG CYS B 179 4.921 10.238 3.101 1.00 1.34 S ATOM 0 H CYS B 179 9.222 9.802 1.479 1.00 0.78 H new ATOM 0 HA CYS B 179 6.502 8.713 1.522 1.00 0.79 H new ATOM 0 HB2 CYS B 179 7.256 10.806 3.249 1.00 0.92 H new ATOM 0 HB3 CYS B 179 6.489 11.606 1.891 1.00 0.92 H new ATOM 2264 N HIS B 180 5.993 10.028 -0.644 1.00 0.70 N ATOM 2265 CA HIS B 180 5.921 10.463 -2.037 1.00 0.75 C ATOM 2266 C HIS B 180 4.601 11.150 -2.342 1.00 0.69 C ATOM 2267 O HIS B 180 3.532 10.653 -1.988 1.00 0.66 O ATOM 2268 CB HIS B 180 6.078 9.237 -2.939 1.00 0.89 C ATOM 2269 CG HIS B 180 6.356 9.532 -4.383 1.00 0.94 C ATOM 2270 ND1 HIS B 180 6.867 8.585 -5.245 1.00 1.60 N ATOM 2271 CD2 HIS B 180 6.184 10.654 -5.124 1.00 1.70 C ATOM 2272 CE1 HIS B 180 6.996 9.108 -6.449 1.00 2.03 C ATOM 2273 NE2 HIS B 180 6.588 10.363 -6.404 1.00 2.10 N ATOM 0 H HIS B 180 5.118 9.670 -0.261 1.00 0.70 H new ATOM 0 HA HIS B 180 6.719 11.183 -2.219 1.00 0.75 H new ATOM 0 HB2 HIS B 180 6.889 8.621 -2.549 1.00 0.89 H new ATOM 0 HB3 HIS B 180 5.167 8.642 -2.876 1.00 0.89 H new ATOM 0 HD2 HIS B 180 5.801 11.601 -4.773 1.00 1.70 H new ATOM 0 HE1 HIS B 180 7.371 8.597 -7.323 1.00 2.03 H new ATOM 0 HE2 HIS B 180 6.575 11.011 -7.192 1.00 2.10 H new ATOM 2282 N GLU B 181 4.684 12.287 -3.019 1.00 0.75 N ATOM 2283 CA GLU B 181 3.496 13.026 -3.397 1.00 0.77 C ATOM 2284 C GLU B 181 2.601 12.152 -4.250 1.00 0.73 C ATOM 2285 O GLU B 181 3.045 11.552 -5.228 1.00 0.94 O ATOM 2286 CB GLU B 181 3.883 14.282 -4.160 1.00 0.93 C ATOM 2287 CG GLU B 181 4.849 15.159 -3.393 1.00 1.69 C ATOM 2288 CD GLU B 181 5.936 15.734 -4.277 1.00 2.34 C ATOM 2289 OE1 GLU B 181 6.595 14.952 -4.991 1.00 3.06 O ATOM 2290 OE2 GLU B 181 6.128 16.964 -4.255 1.00 2.69 O ATOM 0 H GLU B 181 5.562 12.714 -3.315 1.00 0.75 H new ATOM 0 HA GLU B 181 2.955 13.318 -2.497 1.00 0.77 H new ATOM 0 HB2 GLU B 181 4.333 13.999 -5.112 1.00 0.93 H new ATOM 0 HB3 GLU B 181 2.984 14.854 -4.390 1.00 0.93 H new ATOM 0 HG2 GLU B 181 4.299 15.974 -2.922 1.00 1.69 H new ATOM 0 HG3 GLU B 181 5.306 14.577 -2.592 1.00 1.69 H new ATOM 2297 N ASP B 182 1.346 12.067 -3.855 1.00 0.77 N ATOM 2298 CA ASP B 182 0.385 11.246 -4.564 1.00 0.79 C ATOM 2299 C ASP B 182 -1.006 11.886 -4.511 1.00 0.97 C ATOM 2300 O ASP B 182 -1.607 11.986 -3.444 1.00 1.22 O ATOM 2301 CB ASP B 182 0.389 9.839 -3.947 1.00 0.90 C ATOM 2302 CG ASP B 182 -0.998 9.234 -3.811 1.00 1.39 C ATOM 2303 OD1 ASP B 182 -1.737 9.639 -2.888 1.00 1.88 O ATOM 2304 OD2 ASP B 182 -1.346 8.355 -4.628 1.00 2.06 O ATOM 0 H ASP B 182 0.967 12.558 -3.045 1.00 0.77 H new ATOM 0 HA ASP B 182 0.660 11.168 -5.616 1.00 0.79 H new ATOM 0 HB2 ASP B 182 1.004 9.183 -4.562 1.00 0.90 H new ATOM 0 HB3 ASP B 182 0.856 9.884 -2.963 1.00 0.90 H new ATOM 2309 N PRO B 183 -1.532 12.347 -5.661 1.00 1.15 N ATOM 2310 CA PRO B 183 -2.842 12.987 -5.726 1.00 1.41 C ATOM 2311 C PRO B 183 -3.998 11.991 -5.806 1.00 1.28 C ATOM 2312 O PRO B 183 -5.164 12.386 -5.797 1.00 1.41 O ATOM 2313 CB PRO B 183 -2.776 13.826 -7.013 1.00 1.79 C ATOM 2314 CG PRO B 183 -1.436 13.552 -7.629 1.00 1.91 C ATOM 2315 CD PRO B 183 -0.900 12.309 -6.980 1.00 1.41 C ATOM 0 HA PRO B 183 -3.038 13.568 -4.825 1.00 1.41 H new ATOM 0 HB2 PRO B 183 -3.580 13.553 -7.696 1.00 1.79 H new ATOM 0 HB3 PRO B 183 -2.892 14.887 -6.791 1.00 1.79 H new ATOM 0 HG2 PRO B 183 -1.528 13.415 -8.707 1.00 1.91 H new ATOM 0 HG3 PRO B 183 -0.760 14.392 -7.470 1.00 1.91 H new ATOM 0 HD2 PRO B 183 -1.172 11.411 -7.535 1.00 1.41 H new ATOM 0 HD3 PRO B 183 0.188 12.324 -6.910 1.00 1.41 H new ATOM 2323 N ALA B 184 -3.678 10.702 -5.898 1.00 1.13 N ATOM 2324 CA ALA B 184 -4.708 9.674 -5.979 1.00 1.18 C ATOM 2325 C ALA B 184 -5.497 9.586 -4.677 1.00 1.22 C ATOM 2326 O ALA B 184 -6.702 9.334 -4.684 1.00 1.56 O ATOM 2327 CB ALA B 184 -4.093 8.328 -6.329 1.00 1.21 C ATOM 0 H ALA B 184 -2.721 10.348 -5.918 1.00 1.13 H new ATOM 0 HA ALA B 184 -5.402 9.952 -6.773 1.00 1.18 H new ATOM 0 HB1 ALA B 184 -4.877 7.573 -6.385 1.00 1.21 H new ATOM 0 HB2 ALA B 184 -3.588 8.398 -7.292 1.00 1.21 H new ATOM 0 HB3 ALA B 184 -3.373 8.046 -5.561 1.00 1.21 H new ATOM 2333 N CYS B 185 -4.807 9.798 -3.560 1.00 1.05 N ATOM 2334 CA CYS B 185 -5.444 9.748 -2.250 1.00 1.23 C ATOM 2335 C CYS B 185 -5.886 11.139 -1.803 1.00 1.50 C ATOM 2336 O CYS B 185 -5.613 11.558 -0.684 1.00 1.94 O ATOM 2337 CB CYS B 185 -4.494 9.132 -1.208 1.00 1.19 C ATOM 2338 SG CYS B 185 -4.038 7.380 -1.488 1.00 1.46 S ATOM 0 H CYS B 185 -3.809 10.006 -3.537 1.00 1.05 H new ATOM 0 HA CYS B 185 -6.329 9.117 -2.332 1.00 1.23 H new ATOM 0 HB2 CYS B 185 -3.581 9.726 -1.180 1.00 1.19 H new ATOM 0 HB3 CYS B 185 -4.959 9.215 -0.226 1.00 1.19 H new ATOM 2343 N ASP B 186 -6.585 11.848 -2.683 1.00 1.54 N ATOM 2344 CA ASP B 186 -7.074 13.171 -2.380 1.00 1.92 C ATOM 2345 C ASP B 186 -8.605 13.241 -2.380 1.00 1.82 C ATOM 2346 O ASP B 186 -9.165 14.280 -2.735 1.00 2.28 O ATOM 2347 CB ASP B 186 -6.512 14.172 -3.389 1.00 2.44 C ATOM 2348 CG ASP B 186 -5.145 14.683 -2.987 1.00 3.09 C ATOM 2349 OD1 ASP B 186 -4.894 14.814 -1.770 1.00 3.49 O ATOM 2350 OD2 ASP B 186 -4.324 14.951 -3.886 1.00 3.61 O ATOM 0 H ASP B 186 -6.823 11.517 -3.618 1.00 1.54 H new ATOM 0 HA ASP B 186 -6.736 13.421 -1.374 1.00 1.92 H new ATOM 0 HB2 ASP B 186 -6.448 13.700 -4.369 1.00 2.44 H new ATOM 0 HB3 ASP B 186 -7.199 15.013 -3.485 1.00 2.44 H new ATOM 2355 N PRO B 187 -9.332 12.182 -1.936 1.00 1.73 N ATOM 2356 CA PRO B 187 -10.779 12.239 -1.869 1.00 2.05 C ATOM 2357 C PRO B 187 -11.164 13.015 -0.658 1.00 2.17 C ATOM 2358 O PRO B 187 -11.812 12.522 0.270 1.00 2.31 O ATOM 2359 CB PRO B 187 -11.236 10.782 -1.756 1.00 2.47 C ATOM 2360 CG PRO B 187 -9.989 9.959 -1.656 1.00 2.58 C ATOM 2361 CD PRO B 187 -8.837 10.904 -1.413 1.00 1.99 C ATOM 0 HA PRO B 187 -11.233 12.722 -2.734 1.00 2.05 H new ATOM 0 HB2 PRO B 187 -11.868 10.639 -0.879 1.00 2.47 H new ATOM 0 HB3 PRO B 187 -11.826 10.491 -2.625 1.00 2.47 H new ATOM 0 HG2 PRO B 187 -10.071 9.238 -0.843 1.00 2.58 H new ATOM 0 HG3 PRO B 187 -9.831 9.390 -2.572 1.00 2.58 H new ATOM 0 HD2 PRO B 187 -8.589 10.972 -0.354 1.00 1.99 H new ATOM 0 HD3 PRO B 187 -7.935 10.580 -1.931 1.00 1.99 H new ATOM 2369 N GLU B 188 -10.696 14.230 -0.662 1.00 2.54 N ATOM 2370 CA GLU B 188 -10.943 15.121 0.493 1.00 3.18 C ATOM 2371 C GLU B 188 -10.361 16.453 0.212 1.00 3.47 C ATOM 2372 O GLU B 188 -10.854 17.511 0.607 1.00 4.08 O ATOM 2373 CB GLU B 188 -10.338 14.527 1.764 1.00 3.61 C ATOM 2374 CG GLU B 188 -8.822 14.647 1.855 1.00 3.52 C ATOM 2375 CD GLU B 188 -8.313 14.546 3.278 1.00 4.20 C ATOM 2376 OE1 GLU B 188 -8.283 13.422 3.820 1.00 4.57 O ATOM 2377 OE2 GLU B 188 -7.942 15.593 3.848 1.00 4.70 O ATOM 0 H GLU B 188 -10.152 14.642 -1.420 1.00 2.54 H new ATOM 0 HA GLU B 188 -12.017 15.224 0.649 1.00 3.18 H new ATOM 0 HB2 GLU B 188 -10.782 15.021 2.628 1.00 3.61 H new ATOM 0 HB3 GLU B 188 -10.611 13.473 1.824 1.00 3.61 H new ATOM 0 HG2 GLU B 188 -8.363 13.863 1.252 1.00 3.52 H new ATOM 0 HG3 GLU B 188 -8.511 15.601 1.429 1.00 3.52 H new ATOM 2384 N ALA B 189 -9.229 16.348 -0.526 1.00 3.25 N ATOM 2385 CA ALA B 189 -8.399 17.439 -0.998 1.00 3.84 C ATOM 2386 C ALA B 189 -9.092 18.286 -2.080 1.00 4.73 C ATOM 2387 O ALA B 189 -8.509 18.578 -3.131 1.00 5.24 O ATOM 2388 CB ALA B 189 -7.094 16.827 -1.543 1.00 3.45 C ATOM 0 H ALA B 189 -8.866 15.439 -0.814 1.00 3.25 H new ATOM 0 HA ALA B 189 -8.200 18.118 -0.169 1.00 3.84 H new ATOM 0 HB1 ALA B 189 -6.444 17.622 -1.908 1.00 3.45 H new ATOM 0 HB2 ALA B 189 -6.588 16.281 -0.747 1.00 3.45 H new ATOM 0 HB3 ALA B 189 -7.326 16.144 -2.360 1.00 3.45 H new ATOM 2394 N ALA B 190 -10.342 18.652 -1.815 1.00 5.07 N ATOM 2395 CA ALA B 190 -11.199 19.459 -2.687 1.00 6.09 C ATOM 2396 C ALA B 190 -10.717 20.895 -2.784 1.00 6.88 C ATOM 2397 O ALA B 190 -10.498 21.594 -1.792 1.00 6.93 O ATOM 2398 CB ALA B 190 -12.626 19.443 -2.154 1.00 6.41 C ATOM 0 H ALA B 190 -10.809 18.384 -0.949 1.00 5.07 H new ATOM 0 HA ALA B 190 -11.160 19.023 -3.685 1.00 6.09 H new ATOM 0 HB1 ALA B 190 -13.264 20.044 -2.803 1.00 6.41 H new ATOM 0 HB2 ALA B 190 -12.995 18.417 -2.131 1.00 6.41 H new ATOM 0 HB3 ALA B 190 -12.642 19.857 -1.146 1.00 6.41 H new ATOM 2404 N PHE B 191 -10.487 21.264 -4.051 1.00 7.61 N ATOM 2405 CA PHE B 191 -9.927 22.550 -4.449 1.00 8.50 C ATOM 2406 C PHE B 191 -10.884 23.719 -4.270 1.00 9.34 C ATOM 2407 O PHE B 191 -12.035 23.684 -4.702 1.00 9.88 O ATOM 2408 CB PHE B 191 -9.485 22.475 -5.923 1.00 8.96 C ATOM 2409 CG PHE B 191 -10.490 21.828 -6.851 1.00 9.23 C ATOM 2410 CD1 PHE B 191 -11.600 22.529 -7.300 1.00 9.37 C ATOM 2411 CD2 PHE B 191 -10.315 20.519 -7.282 1.00 9.60 C ATOM 2412 CE1 PHE B 191 -12.512 21.940 -8.159 1.00 9.84 C ATOM 2413 CE2 PHE B 191 -11.226 19.925 -8.139 1.00 10.04 C ATOM 2414 CZ PHE B 191 -12.326 20.637 -8.577 1.00 10.14 C ATOM 0 H PHE B 191 -10.693 20.656 -4.844 1.00 7.61 H new ATOM 0 HA PHE B 191 -9.080 22.739 -3.789 1.00 8.50 H new ATOM 0 HB2 PHE B 191 -9.280 23.485 -6.279 1.00 8.96 H new ATOM 0 HB3 PHE B 191 -8.548 21.920 -5.980 1.00 8.96 H new ATOM 0 HD1 PHE B 191 -11.755 23.547 -6.975 1.00 9.37 H new ATOM 0 HD2 PHE B 191 -9.457 19.957 -6.944 1.00 9.60 H new ATOM 0 HE1 PHE B 191 -13.369 22.500 -8.502 1.00 9.84 H new ATOM 0 HE2 PHE B 191 -11.077 18.906 -8.465 1.00 10.04 H new ATOM 0 HZ PHE B 191 -13.039 20.176 -9.245 1.00 10.14 H new ATOM 2424 N SER B 192 -10.362 24.763 -3.633 1.00 9.55 N ATOM 2425 CA SER B 192 -11.111 25.981 -3.380 1.00 10.42 C ATOM 2426 C SER B 192 -10.913 26.978 -4.520 1.00 11.18 C ATOM 2427 O SER B 192 -11.926 27.484 -5.046 1.00 11.41 O ATOM 2428 CB SER B 192 -10.657 26.599 -2.056 1.00 10.44 C ATOM 2429 OG SER B 192 -11.520 27.649 -1.659 1.00 10.49 O ATOM 2430 OXT SER B 192 -9.746 27.245 -4.875 1.00 11.70 O ATOM 0 H SER B 192 -9.406 24.784 -3.279 1.00 9.55 H new ATOM 0 HA SER B 192 -12.171 25.736 -3.318 1.00 10.42 H new ATOM 0 HB2 SER B 192 -10.634 25.832 -1.282 1.00 10.44 H new ATOM 0 HB3 SER B 192 -9.641 26.979 -2.159 1.00 10.44 H new ATOM 0 HG SER B 192 -11.208 28.025 -0.809 1.00 10.49 H new TER 2436 SER B 192