USER MOD reduce.3.24.130724 H: found=0, std=0, add=739, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 742 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 92 SER OG : rot -90:sc= 0.15 USER MOD Set 1.2: A 100 ASN : amide:sc= -6.18! C(o=-8.1!,f=-7.4!) USER MOD Set 1.3: A 144 HIS : no HD1:sc= -2.08 K(o=-8.1,f=-11!) USER MOD Set 2.1: A 138 LYS NZ :NH3+ -177:sc= 1.24 (180deg=0) USER MOD Set 2.2: A 140 TYR OH : rot 180:sc= 1.07 USER MOD Set 3.1: A 116 TYR OH : rot 180:sc= 0.014 USER MOD Set 3.2: A 120 SER OG : rot 143:sc= 0.713 USER MOD Set 4.1: A 109 SER OG : rot -91:sc= 1.24 USER MOD Set 4.2: A 164 ASN : amide:sc= -0.0671 K(o=1.2,f=-0.76!) USER MOD Set 5.1: A 95 LYS NZ :NH3+ -118:sc= 0.0299 (180deg=-0.0912) USER MOD Set 5.2: A 148 GLN : amide:sc= -0.187 K(o=-0.16,f=-2.6) USER MOD Single : A 96 SER OG : rot -84:sc= 1.3 USER MOD Single : A 104 LYS NZ :NH3+ 163:sc= -0.0397 (180deg=-0.253) USER MOD Single : A 105 ASN : amide:sc= 1.02 K(o=1,f=-1.3!) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 ASN : amide:sc= -0.302 K(o=-0.3,f=-3.4!) USER MOD Single : A 113 LYS NZ :NH3+ 161:sc= -0.032 (180deg=-0.339) USER MOD Single : A 118 THR OG1 : rot 76:sc= 1 USER MOD Single : A 124 ASN : amide:sc= 1.21 K(o=1.2,f=-0.88) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 128 CYS SG : rot 133:sc= -2.55! USER MOD Single : A 129 LYS NZ :NH3+ -164:sc= -0.0171 (180deg=-0.207) USER MOD Single : A 132 CYS SG : rot 180:sc= 0.142 USER MOD Single : A 135 ASN : amide:sc= 0.964 K(o=0.96,f=0) USER MOD Single : A 137 SER OG : rot 39:sc=-0.00434 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 157 LYS NZ :NH3+ 162:sc= 1.44 (180deg=1.3) USER MOD Single : A 158 MET CE :methyl -175:sc= -1.4 (180deg=-1.41) USER MOD Single : A 159 ASN : amide:sc= -0.0722 K(o=-0.072,f=-3.9!) USER MOD Single : A 161 MET CE :methyl -150:sc= -1.18 (180deg=-3.01!) USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 174 LYS NZ :NH3+ -146:sc= -1 (180deg=-2.44!) USER MOD Single : A 175 SER OG : rot 180:sc= 0 USER MOD Single : A 177 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0169) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 88 6.673 16.647 11.110 1.00 14.85 N ATOM 2 CA GLY A 88 6.632 15.497 10.182 1.00 14.52 C ATOM 3 C GLY A 88 6.090 15.889 8.828 1.00 14.06 C ATOM 4 O GLY A 88 5.516 16.968 8.671 1.00 14.34 O ATOM 0 HA2 GLY A 88 7.635 15.087 10.067 1.00 14.52 H new ATOM 0 HA3 GLY A 88 6.012 14.708 10.608 1.00 14.52 H new ATOM 10 N ALA A 89 6.273 15.019 7.849 1.00 13.50 N ATOM 11 CA ALA A 89 5.792 15.273 6.501 1.00 13.18 C ATOM 12 C ALA A 89 5.252 13.993 5.885 1.00 12.18 C ATOM 13 O ALA A 89 4.076 13.909 5.525 1.00 12.38 O ATOM 14 CB ALA A 89 6.908 15.852 5.641 1.00 13.38 C ATOM 0 H ALA A 89 6.753 14.127 7.963 1.00 13.50 H new ATOM 0 HA ALA A 89 4.982 16.001 6.550 1.00 13.18 H new ATOM 0 HB1 ALA A 89 6.533 16.037 4.634 1.00 13.38 H new ATOM 0 HB2 ALA A 89 7.255 16.789 6.077 1.00 13.38 H new ATOM 0 HB3 ALA A 89 7.736 15.145 5.595 1.00 13.38 H new ATOM 20 N ASP A 90 6.114 12.992 5.790 1.00 11.25 N ATOM 21 CA ASP A 90 5.747 11.707 5.214 1.00 10.32 C ATOM 22 C ASP A 90 6.530 10.588 5.876 1.00 10.04 C ATOM 23 O ASP A 90 7.753 10.521 5.749 1.00 9.96 O ATOM 24 CB ASP A 90 6.004 11.687 3.705 1.00 9.53 C ATOM 25 CG ASP A 90 4.783 12.048 2.889 1.00 9.74 C ATOM 26 OD1 ASP A 90 3.888 11.194 2.734 1.00 9.92 O ATOM 27 OD2 ASP A 90 4.709 13.199 2.404 1.00 9.91 O ATOM 0 H ASP A 90 7.082 13.046 6.108 1.00 11.25 H new ATOM 0 HA ASP A 90 4.682 11.556 5.389 1.00 10.32 H new ATOM 0 HB2 ASP A 90 6.809 12.384 3.471 1.00 9.53 H new ATOM 0 HB3 ASP A 90 6.347 10.694 3.414 1.00 9.53 H new ATOM 32 N PRO A 91 5.837 9.702 6.607 1.00 10.16 N ATOM 33 CA PRO A 91 6.460 8.542 7.247 1.00 10.16 C ATOM 34 C PRO A 91 7.023 7.562 6.223 1.00 9.18 C ATOM 35 O PRO A 91 7.935 6.792 6.520 1.00 9.15 O ATOM 36 CB PRO A 91 5.314 7.892 8.036 1.00 10.77 C ATOM 37 CG PRO A 91 4.260 8.942 8.131 1.00 11.14 C ATOM 38 CD PRO A 91 4.396 9.771 6.887 1.00 10.63 C ATOM 0 HA PRO A 91 7.305 8.830 7.873 1.00 10.16 H new ATOM 0 HB2 PRO A 91 4.940 7.004 7.527 1.00 10.77 H new ATOM 0 HB3 PRO A 91 5.646 7.577 9.025 1.00 10.77 H new ATOM 0 HG2 PRO A 91 3.268 8.495 8.197 1.00 11.14 H new ATOM 0 HG3 PRO A 91 4.395 9.552 9.024 1.00 11.14 H new ATOM 0 HD2 PRO A 91 3.804 9.368 6.065 1.00 10.63 H new ATOM 0 HD3 PRO A 91 4.063 10.797 7.046 1.00 10.63 H new ATOM 46 N SER A 92 6.476 7.603 5.015 1.00 8.61 N ATOM 47 CA SER A 92 6.940 6.750 3.935 1.00 7.83 C ATOM 48 C SER A 92 7.303 7.594 2.706 1.00 6.91 C ATOM 49 O SER A 92 6.417 8.061 1.981 1.00 6.95 O ATOM 50 CB SER A 92 5.858 5.726 3.577 1.00 8.48 C ATOM 51 OG SER A 92 5.427 5.012 4.728 1.00 9.30 O ATOM 0 H SER A 92 5.707 8.222 4.760 1.00 8.61 H new ATOM 0 HA SER A 92 7.833 6.219 4.264 1.00 7.83 H new ATOM 0 HB2 SER A 92 5.008 6.235 3.122 1.00 8.48 H new ATOM 0 HB3 SER A 92 6.246 5.027 2.836 1.00 8.48 H new ATOM 0 HG SER A 92 5.980 4.211 4.842 1.00 9.30 H new ATOM 57 N LEU A 93 8.597 7.823 2.497 1.00 6.42 N ATOM 58 CA LEU A 93 9.077 8.559 1.330 1.00 5.85 C ATOM 59 C LEU A 93 9.897 7.649 0.431 1.00 4.94 C ATOM 60 O LEU A 93 9.744 7.658 -0.793 1.00 5.05 O ATOM 61 CB LEU A 93 9.926 9.764 1.750 1.00 6.31 C ATOM 62 CG LEU A 93 9.143 10.961 2.280 1.00 7.36 C ATOM 63 CD1 LEU A 93 10.099 12.006 2.862 1.00 7.82 C ATOM 64 CD2 LEU A 93 8.312 11.576 1.161 1.00 7.89 C ATOM 0 H LEU A 93 9.336 7.507 3.125 1.00 6.42 H new ATOM 0 HA LEU A 93 8.206 8.919 0.782 1.00 5.85 H new ATOM 0 HB2 LEU A 93 10.629 9.442 2.518 1.00 6.31 H new ATOM 0 HB3 LEU A 93 10.516 10.088 0.893 1.00 6.31 H new ATOM 0 HG LEU A 93 8.475 10.621 3.072 1.00 7.36 H new ATOM 0 HD11 LEU A 93 9.526 12.855 3.236 1.00 7.82 H new ATOM 0 HD12 LEU A 93 10.668 11.563 3.679 1.00 7.82 H new ATOM 0 HD13 LEU A 93 10.784 12.345 2.085 1.00 7.82 H new ATOM 0 HD21 LEU A 93 7.756 12.430 1.548 1.00 7.89 H new ATOM 0 HD22 LEU A 93 8.971 11.906 0.358 1.00 7.89 H new ATOM 0 HD23 LEU A 93 7.614 10.833 0.776 1.00 7.89 H new ATOM 76 N ARG A 94 10.756 6.854 1.047 1.00 4.45 N ATOM 77 CA ARG A 94 11.635 5.963 0.315 1.00 3.96 C ATOM 78 C ARG A 94 11.248 4.517 0.596 1.00 3.05 C ATOM 79 O ARG A 94 10.240 4.256 1.250 1.00 3.26 O ATOM 80 CB ARG A 94 13.093 6.216 0.706 1.00 4.35 C ATOM 81 CG ARG A 94 13.559 7.639 0.428 1.00 5.15 C ATOM 82 CD ARG A 94 14.973 7.876 0.933 1.00 5.75 C ATOM 83 NE ARG A 94 15.964 7.064 0.225 1.00 6.33 N ATOM 84 CZ ARG A 94 16.947 6.400 0.833 1.00 7.04 C ATOM 85 NH1 ARG A 94 17.031 6.403 2.158 1.00 7.28 N ATOM 86 NH2 ARG A 94 17.836 5.721 0.120 1.00 7.78 N ATOM 0 H ARG A 94 10.862 6.809 2.060 1.00 4.45 H new ATOM 0 HA ARG A 94 11.531 6.155 -0.753 1.00 3.96 H new ATOM 0 HB2 ARG A 94 13.218 6.002 1.767 1.00 4.35 H new ATOM 0 HB3 ARG A 94 13.732 5.520 0.163 1.00 4.35 H new ATOM 0 HG2 ARG A 94 13.518 7.832 -0.644 1.00 5.15 H new ATOM 0 HG3 ARG A 94 12.879 8.345 0.905 1.00 5.15 H new ATOM 0 HD2 ARG A 94 15.224 8.931 0.820 1.00 5.75 H new ATOM 0 HD3 ARG A 94 15.017 7.651 1.999 1.00 5.75 H new ATOM 0 HE ARG A 94 15.899 7.003 -0.791 1.00 6.33 H new ATOM 0 HH11 ARG A 94 16.343 6.914 2.711 1.00 7.28 H new ATOM 0 HH12 ARG A 94 17.783 5.895 2.622 1.00 7.28 H new ATOM 0 HH21 ARG A 94 17.769 5.706 -0.898 1.00 7.78 H new ATOM 0 HH22 ARG A 94 18.587 5.214 0.589 1.00 7.78 H new ATOM 100 N LYS A 95 12.055 3.578 0.124 1.00 2.37 N ATOM 101 CA LYS A 95 11.733 2.169 0.269 1.00 1.60 C ATOM 102 C LYS A 95 12.525 1.566 1.427 1.00 1.26 C ATOM 103 O LYS A 95 12.467 0.365 1.687 1.00 1.52 O ATOM 104 CB LYS A 95 12.026 1.430 -1.039 1.00 1.56 C ATOM 105 CG LYS A 95 11.481 0.014 -1.077 1.00 1.15 C ATOM 106 CD LYS A 95 11.700 -0.630 -2.433 1.00 1.36 C ATOM 107 CE LYS A 95 11.200 -2.064 -2.449 1.00 1.24 C ATOM 108 NZ LYS A 95 12.048 -2.957 -1.612 1.00 1.91 N ATOM 0 H LYS A 95 12.933 3.766 -0.360 1.00 2.37 H new ATOM 0 HA LYS A 95 10.671 2.064 0.492 1.00 1.60 H new ATOM 0 HB2 LYS A 95 11.601 1.996 -1.868 1.00 1.56 H new ATOM 0 HB3 LYS A 95 13.104 1.399 -1.194 1.00 1.56 H new ATOM 0 HG2 LYS A 95 11.966 -0.585 -0.306 1.00 1.15 H new ATOM 0 HG3 LYS A 95 10.416 0.027 -0.847 1.00 1.15 H new ATOM 0 HD2 LYS A 95 11.183 -0.053 -3.200 1.00 1.36 H new ATOM 0 HD3 LYS A 95 12.761 -0.610 -2.681 1.00 1.36 H new ATOM 0 HE2 LYS A 95 10.173 -2.094 -2.086 1.00 1.24 H new ATOM 0 HE3 LYS A 95 11.187 -2.432 -3.475 1.00 1.24 H new ATOM 0 HZ1 LYS A 95 12.478 -3.690 -2.212 1.00 1.91 H new ATOM 0 HZ2 LYS A 95 12.798 -2.398 -1.157 1.00 1.91 H new ATOM 0 HZ3 LYS A 95 11.461 -3.408 -0.881 1.00 1.91 H new ATOM 122 N SER A 96 13.230 2.425 2.150 1.00 1.02 N ATOM 123 CA SER A 96 14.077 1.998 3.258 1.00 0.93 C ATOM 124 C SER A 96 13.245 1.541 4.463 1.00 0.89 C ATOM 125 O SER A 96 13.791 1.192 5.513 1.00 1.75 O ATOM 126 CB SER A 96 15.011 3.142 3.647 1.00 1.13 C ATOM 127 OG SER A 96 15.687 3.642 2.502 1.00 1.79 O ATOM 0 H SER A 96 13.232 3.432 1.988 1.00 1.02 H new ATOM 0 HA SER A 96 14.667 1.140 2.934 1.00 0.93 H new ATOM 0 HB2 SER A 96 14.440 3.942 4.118 1.00 1.13 H new ATOM 0 HB3 SER A 96 15.737 2.793 4.382 1.00 1.13 H new ATOM 0 HG SER A 96 16.476 3.090 2.321 1.00 1.79 H new ATOM 133 N GLY A 97 11.925 1.550 4.307 1.00 0.44 N ATOM 134 CA GLY A 97 11.044 1.028 5.334 1.00 0.29 C ATOM 135 C GLY A 97 10.982 -0.496 5.310 1.00 0.27 C ATOM 136 O GLY A 97 10.692 -1.124 6.330 1.00 0.36 O ATOM 0 H GLY A 97 11.448 1.912 3.481 1.00 0.44 H new ATOM 0 HA2 GLY A 97 11.389 1.362 6.312 1.00 0.29 H new ATOM 0 HA3 GLY A 97 10.042 1.434 5.194 1.00 0.29 H new ATOM 140 N VAL A 98 11.293 -1.072 4.139 1.00 0.29 N ATOM 141 CA VAL A 98 11.195 -2.518 3.864 1.00 0.33 C ATOM 142 C VAL A 98 9.776 -3.056 4.053 1.00 0.25 C ATOM 143 O VAL A 98 9.069 -2.711 5.003 1.00 0.27 O ATOM 144 CB VAL A 98 12.212 -3.380 4.647 1.00 0.49 C ATOM 145 CG1 VAL A 98 11.552 -4.116 5.785 1.00 0.47 C ATOM 146 CG2 VAL A 98 12.865 -4.367 3.699 1.00 0.71 C ATOM 0 H VAL A 98 11.627 -0.536 3.338 1.00 0.29 H new ATOM 0 HA VAL A 98 11.458 -2.610 2.810 1.00 0.33 H new ATOM 0 HB VAL A 98 12.967 -2.720 5.075 1.00 0.49 H new ATOM 0 HG11 VAL A 98 12.296 -4.712 6.313 1.00 0.47 H new ATOM 0 HG12 VAL A 98 11.107 -3.398 6.473 1.00 0.47 H new ATOM 0 HG13 VAL A 98 10.775 -4.772 5.392 1.00 0.47 H new ATOM 0 HG21 VAL A 98 13.583 -4.977 4.247 1.00 0.71 H new ATOM 0 HG22 VAL A 98 12.102 -5.010 3.261 1.00 0.71 H new ATOM 0 HG23 VAL A 98 13.380 -3.824 2.907 1.00 0.71 H new ATOM 156 N GLY A 99 9.346 -3.890 3.116 1.00 0.21 N ATOM 157 CA GLY A 99 7.987 -4.380 3.155 1.00 0.20 C ATOM 158 C GLY A 99 7.013 -3.285 2.779 1.00 0.15 C ATOM 159 O GLY A 99 5.849 -3.306 3.162 1.00 0.18 O ATOM 0 H GLY A 99 9.909 -4.232 2.338 1.00 0.21 H new ATOM 0 HA2 GLY A 99 7.879 -5.221 2.470 1.00 0.20 H new ATOM 0 HA3 GLY A 99 7.757 -4.751 4.154 1.00 0.20 H new ATOM 163 N ASN A 100 7.518 -2.310 2.039 1.00 0.13 N ATOM 164 CA ASN A 100 6.760 -1.108 1.707 1.00 0.14 C ATOM 165 C ASN A 100 6.079 -1.292 0.359 1.00 0.14 C ATOM 166 O ASN A 100 6.732 -1.639 -0.629 1.00 0.19 O ATOM 167 CB ASN A 100 7.728 0.082 1.645 1.00 0.21 C ATOM 168 CG ASN A 100 8.221 0.510 3.009 1.00 0.28 C ATOM 169 OD1 ASN A 100 8.652 1.645 3.196 1.00 0.63 O ATOM 170 ND2 ASN A 100 8.140 -0.388 3.983 1.00 0.20 N ATOM 0 H ASN A 100 8.461 -2.327 1.652 1.00 0.13 H new ATOM 0 HA ASN A 100 5.998 -0.924 2.465 1.00 0.14 H new ATOM 0 HB2 ASN A 100 8.582 -0.183 1.022 1.00 0.21 H new ATOM 0 HB3 ASN A 100 7.231 0.924 1.163 1.00 0.21 H new ATOM 0 HD21 ASN A 100 8.442 -0.145 4.927 1.00 0.20 H new ATOM 0 HD22 ASN A 100 7.776 -1.321 3.788 1.00 0.20 H new ATOM 177 N ILE A 101 4.775 -1.074 0.318 1.00 0.12 N ATOM 178 CA ILE A 101 4.025 -1.132 -0.929 1.00 0.13 C ATOM 179 C ILE A 101 3.082 0.053 -1.025 1.00 0.12 C ATOM 180 O ILE A 101 2.768 0.682 -0.011 1.00 0.15 O ATOM 181 CB ILE A 101 3.213 -2.441 -1.071 1.00 0.13 C ATOM 182 CG1 ILE A 101 2.184 -2.562 0.057 1.00 0.11 C ATOM 183 CG2 ILE A 101 4.140 -3.646 -1.094 1.00 0.15 C ATOM 184 CD1 ILE A 101 1.397 -3.856 0.037 1.00 0.13 C ATOM 0 H ILE A 101 4.210 -0.854 1.138 1.00 0.12 H new ATOM 0 HA ILE A 101 4.754 -1.103 -1.739 1.00 0.13 H new ATOM 0 HB ILE A 101 2.674 -2.412 -2.018 1.00 0.13 H new ATOM 0 HG12 ILE A 101 2.698 -2.476 1.014 1.00 0.11 H new ATOM 0 HG13 ILE A 101 1.489 -1.725 -0.008 1.00 0.11 H new ATOM 0 HG21 ILE A 101 3.550 -4.557 -1.194 1.00 0.15 H new ATOM 0 HG22 ILE A 101 4.825 -3.562 -1.938 1.00 0.15 H new ATOM 0 HG23 ILE A 101 4.711 -3.684 -0.166 1.00 0.15 H new ATOM 0 HD11 ILE A 101 0.690 -3.865 0.867 1.00 0.13 H new ATOM 0 HD12 ILE A 101 0.853 -3.937 -0.904 1.00 0.13 H new ATOM 0 HD13 ILE A 101 2.081 -4.699 0.134 1.00 0.13 H new ATOM 196 N PHE A 102 2.627 0.353 -2.227 1.00 0.11 N ATOM 197 CA PHE A 102 1.672 1.425 -2.418 1.00 0.11 C ATOM 198 C PHE A 102 0.440 0.897 -3.145 1.00 0.09 C ATOM 199 O PHE A 102 0.543 0.033 -4.019 1.00 0.11 O ATOM 200 CB PHE A 102 2.327 2.603 -3.163 1.00 0.16 C ATOM 201 CG PHE A 102 1.831 2.835 -4.561 1.00 0.13 C ATOM 202 CD1 PHE A 102 0.719 3.628 -4.794 1.00 0.14 C ATOM 203 CD2 PHE A 102 2.473 2.249 -5.643 1.00 0.17 C ATOM 204 CE1 PHE A 102 0.257 3.833 -6.077 1.00 0.17 C ATOM 205 CE2 PHE A 102 2.017 2.449 -6.927 1.00 0.21 C ATOM 206 CZ PHE A 102 0.923 3.287 -7.146 1.00 0.20 C ATOM 0 H PHE A 102 2.903 -0.129 -3.082 1.00 0.11 H new ATOM 0 HA PHE A 102 1.348 1.801 -1.448 1.00 0.11 H new ATOM 0 HB2 PHE A 102 2.167 3.512 -2.583 1.00 0.16 H new ATOM 0 HB3 PHE A 102 3.403 2.434 -3.201 1.00 0.16 H new ATOM 0 HD1 PHE A 102 0.209 4.090 -3.962 1.00 0.14 H new ATOM 0 HD2 PHE A 102 3.341 1.628 -5.476 1.00 0.17 H new ATOM 0 HE1 PHE A 102 -0.631 4.425 -6.241 1.00 0.17 H new ATOM 0 HE2 PHE A 102 2.503 1.961 -7.759 1.00 0.21 H new ATOM 0 HZ PHE A 102 0.601 3.505 -8.154 1.00 0.20 H new ATOM 216 N ILE A 103 -0.719 1.403 -2.753 1.00 0.08 N ATOM 217 CA ILE A 103 -1.989 0.961 -3.308 1.00 0.08 C ATOM 218 C ILE A 103 -2.703 2.129 -3.973 1.00 0.08 C ATOM 219 O ILE A 103 -2.754 3.221 -3.414 1.00 0.15 O ATOM 220 CB ILE A 103 -2.898 0.394 -2.202 1.00 0.08 C ATOM 221 CG1 ILE A 103 -2.166 -0.682 -1.403 1.00 0.08 C ATOM 222 CG2 ILE A 103 -4.176 -0.174 -2.798 1.00 0.10 C ATOM 223 CD1 ILE A 103 -2.503 -0.655 0.066 1.00 0.09 C ATOM 0 H ILE A 103 -0.806 2.130 -2.043 1.00 0.08 H new ATOM 0 HA ILE A 103 -1.782 0.182 -4.042 1.00 0.08 H new ATOM 0 HB ILE A 103 -3.161 1.209 -1.528 1.00 0.08 H new ATOM 0 HG12 ILE A 103 -2.416 -1.662 -1.810 1.00 0.08 H new ATOM 0 HG13 ILE A 103 -1.091 -0.550 -1.526 1.00 0.08 H new ATOM 0 HG21 ILE A 103 -4.805 -0.570 -2.000 1.00 0.10 H new ATOM 0 HG22 ILE A 103 -4.713 0.614 -3.326 1.00 0.10 H new ATOM 0 HG23 ILE A 103 -3.928 -0.974 -3.495 1.00 0.10 H new ATOM 0 HD11 ILE A 103 -1.952 -1.443 0.580 1.00 0.09 H new ATOM 0 HD12 ILE A 103 -2.228 0.313 0.485 1.00 0.09 H new ATOM 0 HD13 ILE A 103 -3.573 -0.816 0.197 1.00 0.09 H new ATOM 235 N LYS A 104 -3.251 1.902 -5.156 1.00 0.13 N ATOM 236 CA LYS A 104 -3.968 2.947 -5.874 1.00 0.13 C ATOM 237 C LYS A 104 -5.429 2.558 -6.062 1.00 0.12 C ATOM 238 O LYS A 104 -5.756 1.373 -6.085 1.00 0.14 O ATOM 239 CB LYS A 104 -3.331 3.185 -7.244 1.00 0.19 C ATOM 240 CG LYS A 104 -3.480 4.618 -7.747 1.00 0.28 C ATOM 241 CD LYS A 104 -2.678 4.868 -9.018 1.00 0.39 C ATOM 242 CE LYS A 104 -3.366 4.320 -10.263 1.00 0.66 C ATOM 243 NZ LYS A 104 -4.633 5.035 -10.567 1.00 1.46 N ATOM 0 H LYS A 104 -3.214 1.005 -5.640 1.00 0.13 H new ATOM 0 HA LYS A 104 -3.912 3.862 -5.285 1.00 0.13 H new ATOM 0 HB2 LYS A 104 -2.271 2.936 -7.191 1.00 0.19 H new ATOM 0 HB3 LYS A 104 -3.782 2.506 -7.968 1.00 0.19 H new ATOM 0 HG2 LYS A 104 -4.533 4.827 -7.937 1.00 0.28 H new ATOM 0 HG3 LYS A 104 -3.153 5.310 -6.971 1.00 0.28 H new ATOM 0 HD2 LYS A 104 -2.519 5.940 -9.138 1.00 0.39 H new ATOM 0 HD3 LYS A 104 -1.695 4.408 -8.919 1.00 0.39 H new ATOM 0 HE2 LYS A 104 -2.691 4.403 -11.115 1.00 0.66 H new ATOM 0 HE3 LYS A 104 -3.574 3.259 -10.123 1.00 0.66 H new ATOM 0 HZ1 LYS A 104 -4.915 4.840 -11.549 1.00 1.46 H new ATOM 0 HZ2 LYS A 104 -5.380 4.708 -9.921 1.00 1.46 H new ATOM 0 HZ3 LYS A 104 -4.493 6.058 -10.444 1.00 1.46 H new ATOM 257 N ASN A 105 -6.287 3.570 -6.179 1.00 0.12 N ATOM 258 CA ASN A 105 -7.702 3.394 -6.531 1.00 0.13 C ATOM 259 C ASN A 105 -8.504 2.791 -5.376 1.00 0.15 C ATOM 260 O ASN A 105 -9.419 1.995 -5.587 1.00 0.25 O ATOM 261 CB ASN A 105 -7.853 2.524 -7.785 1.00 0.16 C ATOM 262 CG ASN A 105 -9.140 2.823 -8.535 1.00 0.23 C ATOM 263 OD1 ASN A 105 -9.605 3.964 -8.570 1.00 0.49 O ATOM 264 ND2 ASN A 105 -9.732 1.799 -9.125 1.00 0.34 N ATOM 0 H ASN A 105 -6.022 4.544 -6.032 1.00 0.12 H new ATOM 0 HA ASN A 105 -8.104 4.386 -6.740 1.00 0.13 H new ATOM 0 HB2 ASN A 105 -7.002 2.690 -8.446 1.00 0.16 H new ATOM 0 HB3 ASN A 105 -7.836 1.472 -7.500 1.00 0.16 H new ATOM 0 HD21 ASN A 105 -10.606 1.938 -9.632 1.00 0.34 H new ATOM 0 HD22 ASN A 105 -9.315 0.870 -9.073 1.00 0.34 H new ATOM 271 N LEU A 106 -8.177 3.196 -4.159 1.00 0.14 N ATOM 272 CA LEU A 106 -8.902 2.742 -2.977 1.00 0.17 C ATOM 273 C LEU A 106 -10.233 3.465 -2.848 1.00 0.22 C ATOM 274 O LEU A 106 -10.398 4.581 -3.346 1.00 0.26 O ATOM 275 CB LEU A 106 -8.063 2.966 -1.720 1.00 0.16 C ATOM 276 CG LEU A 106 -6.976 1.920 -1.484 1.00 0.14 C ATOM 277 CD1 LEU A 106 -5.907 2.461 -0.558 1.00 0.15 C ATOM 278 CD2 LEU A 106 -7.585 0.663 -0.889 1.00 0.16 C ATOM 0 H LEU A 106 -7.412 3.841 -3.961 1.00 0.14 H new ATOM 0 HA LEU A 106 -9.097 1.675 -3.088 1.00 0.17 H new ATOM 0 HB2 LEU A 106 -7.595 3.949 -1.782 1.00 0.16 H new ATOM 0 HB3 LEU A 106 -8.726 2.983 -0.855 1.00 0.16 H new ATOM 0 HG LEU A 106 -6.516 1.678 -2.442 1.00 0.14 H new ATOM 0 HD11 LEU A 106 -5.142 1.701 -0.402 1.00 0.15 H new ATOM 0 HD12 LEU A 106 -5.454 3.346 -1.004 1.00 0.15 H new ATOM 0 HD13 LEU A 106 -6.355 2.726 0.400 1.00 0.15 H new ATOM 0 HD21 LEU A 106 -6.802 -0.078 -0.724 1.00 0.16 H new ATOM 0 HD22 LEU A 106 -8.062 0.904 0.061 1.00 0.16 H new ATOM 0 HD23 LEU A 106 -8.328 0.258 -1.576 1.00 0.16 H new ATOM 290 N ASP A 107 -11.187 2.821 -2.194 1.00 0.27 N ATOM 291 CA ASP A 107 -12.486 3.426 -1.953 1.00 0.32 C ATOM 292 C ASP A 107 -12.414 4.319 -0.724 1.00 0.30 C ATOM 293 O ASP A 107 -11.634 4.062 0.191 1.00 0.26 O ATOM 294 CB ASP A 107 -13.558 2.343 -1.773 1.00 0.37 C ATOM 295 CG ASP A 107 -14.962 2.913 -1.718 1.00 0.50 C ATOM 296 OD1 ASP A 107 -15.356 3.426 -0.652 1.00 0.71 O ATOM 297 OD2 ASP A 107 -15.680 2.852 -2.739 1.00 0.62 O ATOM 0 H ASP A 107 -11.085 1.877 -1.820 1.00 0.27 H new ATOM 0 HA ASP A 107 -12.761 4.033 -2.815 1.00 0.32 H new ATOM 0 HB2 ASP A 107 -13.491 1.631 -2.596 1.00 0.37 H new ATOM 0 HB3 ASP A 107 -13.359 1.789 -0.855 1.00 0.37 H new ATOM 302 N LYS A 108 -13.219 5.369 -0.720 1.00 0.38 N ATOM 303 CA LYS A 108 -13.235 6.338 0.373 1.00 0.43 C ATOM 304 C LYS A 108 -13.523 5.667 1.719 1.00 0.36 C ATOM 305 O LYS A 108 -13.051 6.122 2.762 1.00 0.46 O ATOM 306 CB LYS A 108 -14.291 7.412 0.103 1.00 0.55 C ATOM 307 CG LYS A 108 -15.711 6.894 0.206 1.00 0.57 C ATOM 308 CD LYS A 108 -16.726 7.994 -0.023 1.00 0.90 C ATOM 309 CE LYS A 108 -18.148 7.447 -0.106 1.00 1.21 C ATOM 310 NZ LYS A 108 -18.633 6.919 1.198 1.00 2.20 N ATOM 0 H LYS A 108 -13.879 5.577 -1.470 1.00 0.38 H new ATOM 0 HA LYS A 108 -12.246 6.794 0.425 1.00 0.43 H new ATOM 0 HB2 LYS A 108 -14.157 8.230 0.811 1.00 0.55 H new ATOM 0 HB3 LYS A 108 -14.133 7.825 -0.893 1.00 0.55 H new ATOM 0 HG2 LYS A 108 -15.863 6.100 -0.526 1.00 0.57 H new ATOM 0 HG3 LYS A 108 -15.867 6.454 1.191 1.00 0.57 H new ATOM 0 HD2 LYS A 108 -16.663 8.721 0.787 1.00 0.90 H new ATOM 0 HD3 LYS A 108 -16.486 8.523 -0.945 1.00 0.90 H new ATOM 0 HE2 LYS A 108 -18.818 8.236 -0.446 1.00 1.21 H new ATOM 0 HE3 LYS A 108 -18.185 6.653 -0.852 1.00 1.21 H new ATOM 0 HZ1 LYS A 108 -19.603 6.560 1.088 1.00 2.20 H new ATOM 0 HZ2 LYS A 108 -18.011 6.147 1.513 1.00 2.20 H new ATOM 0 HZ3 LYS A 108 -18.624 7.681 1.906 1.00 2.20 H new ATOM 324 N SER A 109 -14.303 4.590 1.684 1.00 0.31 N ATOM 325 CA SER A 109 -14.676 3.864 2.895 1.00 0.40 C ATOM 326 C SER A 109 -13.498 3.089 3.484 1.00 0.34 C ATOM 327 O SER A 109 -13.587 2.560 4.593 1.00 0.43 O ATOM 328 CB SER A 109 -15.836 2.909 2.602 1.00 0.56 C ATOM 329 OG SER A 109 -15.532 2.046 1.517 1.00 1.41 O ATOM 0 H SER A 109 -14.691 4.199 0.825 1.00 0.31 H new ATOM 0 HA SER A 109 -14.988 4.602 3.634 1.00 0.40 H new ATOM 0 HB2 SER A 109 -16.055 2.317 3.490 1.00 0.56 H new ATOM 0 HB3 SER A 109 -16.734 3.483 2.372 1.00 0.56 H new ATOM 0 HG SER A 109 -15.833 2.456 0.679 1.00 1.41 H new ATOM 335 N ILE A 110 -12.396 3.022 2.751 1.00 0.23 N ATOM 336 CA ILE A 110 -11.228 2.301 3.220 1.00 0.20 C ATOM 337 C ILE A 110 -10.406 3.168 4.165 1.00 0.20 C ATOM 338 O ILE A 110 -9.858 4.195 3.769 1.00 0.26 O ATOM 339 CB ILE A 110 -10.353 1.814 2.042 1.00 0.20 C ATOM 340 CG1 ILE A 110 -11.150 0.838 1.171 1.00 0.21 C ATOM 341 CG2 ILE A 110 -9.072 1.162 2.548 1.00 0.22 C ATOM 342 CD1 ILE A 110 -11.588 -0.411 1.908 1.00 0.23 C ATOM 0 H ILE A 110 -12.289 3.456 1.834 1.00 0.23 H new ATOM 0 HA ILE A 110 -11.579 1.423 3.763 1.00 0.20 H new ATOM 0 HB ILE A 110 -10.071 2.676 1.438 1.00 0.20 H new ATOM 0 HG12 ILE A 110 -12.031 1.348 0.781 1.00 0.21 H new ATOM 0 HG13 ILE A 110 -10.543 0.550 0.313 1.00 0.21 H new ATOM 0 HG21 ILE A 110 -8.474 0.828 1.700 1.00 0.22 H new ATOM 0 HG22 ILE A 110 -8.502 1.885 3.132 1.00 0.22 H new ATOM 0 HG23 ILE A 110 -9.322 0.306 3.175 1.00 0.22 H new ATOM 0 HD11 ILE A 110 -12.147 -1.056 1.230 1.00 0.23 H new ATOM 0 HD12 ILE A 110 -10.711 -0.944 2.275 1.00 0.23 H new ATOM 0 HD13 ILE A 110 -12.222 -0.133 2.750 1.00 0.23 H new ATOM 354 N ASP A 111 -10.362 2.760 5.423 1.00 0.17 N ATOM 355 CA ASP A 111 -9.556 3.438 6.428 1.00 0.18 C ATOM 356 C ASP A 111 -8.296 2.621 6.675 1.00 0.14 C ATOM 357 O ASP A 111 -8.086 1.597 6.023 1.00 0.13 O ATOM 358 CB ASP A 111 -10.353 3.593 7.730 1.00 0.23 C ATOM 359 CG ASP A 111 -9.693 4.532 8.724 1.00 1.01 C ATOM 360 OD1 ASP A 111 -9.853 5.762 8.583 1.00 1.23 O ATOM 361 OD2 ASP A 111 -9.014 4.048 9.648 1.00 1.59 O ATOM 0 H ASP A 111 -10.880 1.955 5.776 1.00 0.17 H new ATOM 0 HA ASP A 111 -9.285 4.433 6.074 1.00 0.18 H new ATOM 0 HB2 ASP A 111 -11.351 3.964 7.496 1.00 0.23 H new ATOM 0 HB3 ASP A 111 -10.477 2.614 8.192 1.00 0.23 H new ATOM 366 N ASN A 112 -7.478 3.049 7.621 1.00 0.15 N ATOM 367 CA ASN A 112 -6.249 2.341 7.946 1.00 0.13 C ATOM 368 C ASN A 112 -6.599 0.951 8.436 1.00 0.11 C ATOM 369 O ASN A 112 -5.963 -0.031 8.066 1.00 0.12 O ATOM 370 CB ASN A 112 -5.453 3.071 9.032 1.00 0.16 C ATOM 371 CG ASN A 112 -5.057 4.491 8.653 1.00 0.19 C ATOM 372 OD1 ASN A 112 -5.722 5.154 7.852 1.00 0.60 O ATOM 373 ND2 ASN A 112 -3.975 4.975 9.241 1.00 0.55 N ATOM 0 H ASN A 112 -7.642 3.886 8.180 1.00 0.15 H new ATOM 0 HA ASN A 112 -5.632 2.290 7.049 1.00 0.13 H new ATOM 0 HB2 ASN A 112 -6.046 3.101 9.946 1.00 0.16 H new ATOM 0 HB3 ASN A 112 -4.552 2.500 9.255 1.00 0.16 H new ATOM 0 HD21 ASN A 112 -3.666 5.925 9.037 1.00 0.55 H new ATOM 0 HD22 ASN A 112 -3.450 4.398 9.898 1.00 0.55 H new ATOM 380 N LYS A 113 -7.646 0.883 9.250 1.00 0.12 N ATOM 381 CA LYS A 113 -8.141 -0.363 9.777 1.00 0.12 C ATOM 382 C LYS A 113 -8.538 -1.295 8.654 1.00 0.11 C ATOM 383 O LYS A 113 -8.160 -2.453 8.621 1.00 0.11 O ATOM 384 CB LYS A 113 -9.379 -0.086 10.599 1.00 0.15 C ATOM 385 CG LYS A 113 -9.348 -0.630 12.013 1.00 0.28 C ATOM 386 CD LYS A 113 -9.158 -2.134 12.046 1.00 0.54 C ATOM 387 CE LYS A 113 -7.708 -2.531 11.830 1.00 1.63 C ATOM 388 NZ LYS A 113 -6.837 -2.097 12.954 1.00 2.58 N ATOM 0 H LYS A 113 -8.172 1.701 9.559 1.00 0.12 H new ATOM 0 HA LYS A 113 -7.356 -0.823 10.378 1.00 0.12 H new ATOM 0 HB2 LYS A 113 -9.532 0.992 10.645 1.00 0.15 H new ATOM 0 HB3 LYS A 113 -10.241 -0.509 10.083 1.00 0.15 H new ATOM 0 HG2 LYS A 113 -8.540 -0.152 12.567 1.00 0.28 H new ATOM 0 HG3 LYS A 113 -10.278 -0.372 12.520 1.00 0.28 H new ATOM 0 HD2 LYS A 113 -9.500 -2.521 13.006 1.00 0.54 H new ATOM 0 HD3 LYS A 113 -9.778 -2.594 11.277 1.00 0.54 H new ATOM 0 HE2 LYS A 113 -7.642 -3.613 11.717 1.00 1.63 H new ATOM 0 HE3 LYS A 113 -7.346 -2.091 10.901 1.00 1.63 H new ATOM 0 HZ1 LYS A 113 -5.953 -2.644 12.939 1.00 2.58 H new ATOM 0 HZ2 LYS A 113 -6.620 -1.085 12.854 1.00 2.58 H new ATOM 0 HZ3 LYS A 113 -7.328 -2.258 13.856 1.00 2.58 H new ATOM 402 N ALA A 114 -9.320 -0.749 7.756 1.00 0.11 N ATOM 403 CA ALA A 114 -9.862 -1.483 6.622 1.00 0.12 C ATOM 404 C ALA A 114 -8.752 -1.995 5.714 1.00 0.11 C ATOM 405 O ALA A 114 -8.783 -3.134 5.241 1.00 0.13 O ATOM 406 CB ALA A 114 -10.800 -0.575 5.853 1.00 0.15 C ATOM 0 H ALA A 114 -9.606 0.230 7.786 1.00 0.11 H new ATOM 0 HA ALA A 114 -10.408 -2.352 6.990 1.00 0.12 H new ATOM 0 HB1 ALA A 114 -11.212 -1.115 5.001 1.00 0.15 H new ATOM 0 HB2 ALA A 114 -11.612 -0.254 6.506 1.00 0.15 H new ATOM 0 HB3 ALA A 114 -10.252 0.298 5.499 1.00 0.15 H new ATOM 412 N LEU A 115 -7.770 -1.142 5.486 1.00 0.09 N ATOM 413 CA LEU A 115 -6.614 -1.498 4.688 1.00 0.09 C ATOM 414 C LEU A 115 -5.813 -2.572 5.424 1.00 0.08 C ATOM 415 O LEU A 115 -5.445 -3.596 4.843 1.00 0.09 O ATOM 416 CB LEU A 115 -5.778 -0.232 4.449 1.00 0.10 C ATOM 417 CG LEU A 115 -4.824 -0.257 3.251 1.00 0.11 C ATOM 418 CD1 LEU A 115 -4.182 1.105 3.059 1.00 0.16 C ATOM 419 CD2 LEU A 115 -3.757 -1.313 3.434 1.00 0.11 C ATOM 0 H LEU A 115 -7.752 -0.188 5.847 1.00 0.09 H new ATOM 0 HA LEU A 115 -6.912 -1.903 3.721 1.00 0.09 H new ATOM 0 HB2 LEU A 115 -6.461 0.609 4.324 1.00 0.10 H new ATOM 0 HB3 LEU A 115 -5.192 -0.036 5.347 1.00 0.10 H new ATOM 0 HG LEU A 115 -5.403 -0.504 2.361 1.00 0.11 H new ATOM 0 HD11 LEU A 115 -3.507 1.072 2.204 1.00 0.16 H new ATOM 0 HD12 LEU A 115 -4.957 1.851 2.881 1.00 0.16 H new ATOM 0 HD13 LEU A 115 -3.621 1.372 3.954 1.00 0.16 H new ATOM 0 HD21 LEU A 115 -3.092 -1.312 2.571 1.00 0.11 H new ATOM 0 HD22 LEU A 115 -3.183 -1.098 4.335 1.00 0.11 H new ATOM 0 HD23 LEU A 115 -4.227 -2.292 3.529 1.00 0.11 H new ATOM 431 N TYR A 116 -5.588 -2.350 6.712 1.00 0.08 N ATOM 432 CA TYR A 116 -4.920 -3.327 7.557 1.00 0.09 C ATOM 433 C TYR A 116 -5.679 -4.646 7.567 1.00 0.10 C ATOM 434 O TYR A 116 -5.085 -5.699 7.376 1.00 0.11 O ATOM 435 CB TYR A 116 -4.773 -2.803 8.991 1.00 0.10 C ATOM 436 CG TYR A 116 -4.287 -3.859 9.962 1.00 0.13 C ATOM 437 CD1 TYR A 116 -2.933 -4.136 10.084 1.00 0.19 C ATOM 438 CD2 TYR A 116 -5.180 -4.592 10.737 1.00 0.18 C ATOM 439 CE1 TYR A 116 -2.478 -5.113 10.950 1.00 0.24 C ATOM 440 CE2 TYR A 116 -4.733 -5.569 11.606 1.00 0.23 C ATOM 441 CZ TYR A 116 -3.382 -5.828 11.708 1.00 0.23 C ATOM 442 OH TYR A 116 -2.931 -6.807 12.571 1.00 0.30 O ATOM 0 H TYR A 116 -5.861 -1.495 7.196 1.00 0.08 H new ATOM 0 HA TYR A 116 -3.927 -3.496 7.142 1.00 0.09 H new ATOM 0 HB2 TYR A 116 -4.076 -1.965 8.996 1.00 0.10 H new ATOM 0 HB3 TYR A 116 -5.735 -2.419 9.332 1.00 0.10 H new ATOM 0 HD1 TYR A 116 -2.222 -3.579 9.492 1.00 0.19 H new ATOM 0 HD2 TYR A 116 -6.239 -4.394 10.658 1.00 0.18 H new ATOM 0 HE1 TYR A 116 -1.420 -5.315 11.033 1.00 0.24 H new ATOM 0 HE2 TYR A 116 -5.439 -6.128 12.203 1.00 0.23 H new ATOM 0 HH TYR A 116 -3.694 -7.215 13.030 1.00 0.30 H new ATOM 452 N ASP A 117 -6.992 -4.578 7.748 1.00 0.10 N ATOM 453 CA ASP A 117 -7.819 -5.777 7.869 1.00 0.12 C ATOM 454 C ASP A 117 -7.646 -6.677 6.657 1.00 0.12 C ATOM 455 O ASP A 117 -7.588 -7.904 6.776 1.00 0.15 O ATOM 456 CB ASP A 117 -9.293 -5.375 7.994 1.00 0.16 C ATOM 457 CG ASP A 117 -10.223 -6.563 8.146 1.00 0.27 C ATOM 458 OD1 ASP A 117 -10.679 -7.106 7.117 1.00 0.40 O ATOM 459 OD2 ASP A 117 -10.510 -6.954 9.297 1.00 0.36 O ATOM 0 H ASP A 117 -7.511 -3.702 7.815 1.00 0.10 H new ATOM 0 HA ASP A 117 -7.505 -6.323 8.759 1.00 0.12 H new ATOM 0 HB2 ASP A 117 -9.412 -4.716 8.854 1.00 0.16 H new ATOM 0 HB3 ASP A 117 -9.584 -4.804 7.112 1.00 0.16 H new ATOM 464 N THR A 118 -7.541 -6.062 5.497 1.00 0.11 N ATOM 465 CA THR A 118 -7.408 -6.800 4.262 1.00 0.11 C ATOM 466 C THR A 118 -5.980 -7.331 4.055 1.00 0.10 C ATOM 467 O THR A 118 -5.780 -8.530 3.855 1.00 0.12 O ATOM 468 CB THR A 118 -7.812 -5.907 3.077 1.00 0.13 C ATOM 469 OG1 THR A 118 -9.044 -5.236 3.382 1.00 0.22 O ATOM 470 CG2 THR A 118 -7.990 -6.738 1.819 1.00 0.17 C ATOM 0 H THR A 118 -7.545 -5.048 5.386 1.00 0.11 H new ATOM 0 HA THR A 118 -8.072 -7.663 4.320 1.00 0.11 H new ATOM 0 HB THR A 118 -7.023 -5.175 2.906 1.00 0.13 H new ATOM 0 HG1 THR A 118 -8.871 -4.502 4.008 1.00 0.22 H new ATOM 0 HG21 THR A 118 -8.276 -6.089 0.991 1.00 0.17 H new ATOM 0 HG22 THR A 118 -7.053 -7.240 1.579 1.00 0.17 H new ATOM 0 HG23 THR A 118 -8.769 -7.482 1.982 1.00 0.17 H new ATOM 478 N PHE A 119 -4.998 -6.436 4.119 1.00 0.08 N ATOM 479 CA PHE A 119 -3.603 -6.781 3.827 1.00 0.08 C ATOM 480 C PHE A 119 -2.948 -7.620 4.935 1.00 0.08 C ATOM 481 O PHE A 119 -2.035 -8.396 4.666 1.00 0.09 O ATOM 482 CB PHE A 119 -2.785 -5.523 3.506 1.00 0.08 C ATOM 483 CG PHE A 119 -3.181 -4.868 2.199 1.00 0.08 C ATOM 484 CD1 PHE A 119 -4.439 -4.298 2.026 1.00 0.10 C ATOM 485 CD2 PHE A 119 -2.291 -4.828 1.137 1.00 0.08 C ATOM 486 CE1 PHE A 119 -4.790 -3.712 0.828 1.00 0.11 C ATOM 487 CE2 PHE A 119 -2.639 -4.241 -0.061 1.00 0.10 C ATOM 488 CZ PHE A 119 -3.926 -3.644 -0.186 1.00 0.09 C ATOM 0 H PHE A 119 -5.141 -5.458 4.372 1.00 0.08 H new ATOM 0 HA PHE A 119 -3.613 -7.415 2.941 1.00 0.08 H new ATOM 0 HB2 PHE A 119 -2.905 -4.804 4.316 1.00 0.08 H new ATOM 0 HB3 PHE A 119 -1.728 -5.786 3.467 1.00 0.08 H new ATOM 0 HD1 PHE A 119 -5.149 -4.315 2.840 1.00 0.10 H new ATOM 0 HD2 PHE A 119 -1.309 -5.264 1.250 1.00 0.08 H new ATOM 0 HE1 PHE A 119 -5.782 -3.301 0.709 1.00 0.11 H new ATOM 0 HE2 PHE A 119 -1.947 -4.234 -0.891 1.00 0.10 H new ATOM 0 HZ PHE A 119 -4.202 -3.138 -1.099 1.00 0.09 H new ATOM 498 N SER A 120 -3.412 -7.461 6.176 1.00 0.09 N ATOM 499 CA SER A 120 -2.812 -8.142 7.334 1.00 0.09 C ATOM 500 C SER A 120 -2.805 -9.660 7.154 1.00 0.08 C ATOM 501 O SER A 120 -1.941 -10.354 7.691 1.00 0.09 O ATOM 502 CB SER A 120 -3.556 -7.774 8.625 1.00 0.13 C ATOM 503 OG SER A 120 -2.974 -8.394 9.757 1.00 0.19 O ATOM 0 H SER A 120 -4.205 -6.864 6.410 1.00 0.09 H new ATOM 0 HA SER A 120 -1.778 -7.804 7.408 1.00 0.09 H new ATOM 0 HB2 SER A 120 -3.545 -6.692 8.756 1.00 0.13 H new ATOM 0 HB3 SER A 120 -4.601 -8.074 8.542 1.00 0.13 H new ATOM 0 HG SER A 120 -3.007 -7.779 10.520 1.00 0.19 H new ATOM 509 N ALA A 121 -3.780 -10.170 6.412 1.00 0.09 N ATOM 510 CA ALA A 121 -3.878 -11.600 6.133 1.00 0.11 C ATOM 511 C ALA A 121 -2.610 -12.135 5.455 1.00 0.11 C ATOM 512 O ALA A 121 -2.336 -13.337 5.489 1.00 0.13 O ATOM 513 CB ALA A 121 -5.094 -11.872 5.263 1.00 0.14 C ATOM 0 H ALA A 121 -4.520 -9.610 5.989 1.00 0.09 H new ATOM 0 HA ALA A 121 -3.986 -12.122 7.084 1.00 0.11 H new ATOM 0 HB1 ALA A 121 -5.163 -12.940 5.058 1.00 0.14 H new ATOM 0 HB2 ALA A 121 -5.994 -11.544 5.783 1.00 0.14 H new ATOM 0 HB3 ALA A 121 -4.999 -11.327 4.324 1.00 0.14 H new ATOM 519 N PHE A 122 -1.849 -11.238 4.833 1.00 0.08 N ATOM 520 CA PHE A 122 -0.649 -11.624 4.095 1.00 0.09 C ATOM 521 C PHE A 122 0.593 -11.549 4.975 1.00 0.10 C ATOM 522 O PHE A 122 1.625 -12.146 4.661 1.00 0.18 O ATOM 523 CB PHE A 122 -0.477 -10.718 2.876 1.00 0.09 C ATOM 524 CG PHE A 122 -1.710 -10.642 2.031 1.00 0.09 C ATOM 525 CD1 PHE A 122 -2.255 -11.786 1.477 1.00 0.13 C ATOM 526 CD2 PHE A 122 -2.304 -9.423 1.768 1.00 0.10 C ATOM 527 CE1 PHE A 122 -3.374 -11.717 0.674 1.00 0.16 C ATOM 528 CE2 PHE A 122 -3.426 -9.345 0.967 1.00 0.12 C ATOM 529 CZ PHE A 122 -4.026 -10.511 0.511 1.00 0.13 C ATOM 0 H PHE A 122 -2.043 -10.237 4.825 1.00 0.08 H new ATOM 0 HA PHE A 122 -0.770 -12.657 3.770 1.00 0.09 H new ATOM 0 HB2 PHE A 122 -0.208 -9.716 3.209 1.00 0.09 H new ATOM 0 HB3 PHE A 122 0.351 -11.085 2.270 1.00 0.09 H new ATOM 0 HD1 PHE A 122 -1.799 -12.745 1.676 1.00 0.13 H new ATOM 0 HD2 PHE A 122 -1.887 -8.522 2.193 1.00 0.10 H new ATOM 0 HE1 PHE A 122 -3.739 -12.603 0.175 1.00 0.16 H new ATOM 0 HE2 PHE A 122 -3.835 -8.382 0.697 1.00 0.12 H new ATOM 0 HZ PHE A 122 -4.994 -10.475 0.033 1.00 0.13 H new ATOM 539 N GLY A 123 0.489 -10.823 6.077 1.00 0.09 N ATOM 540 CA GLY A 123 1.616 -10.656 6.968 1.00 0.10 C ATOM 541 C GLY A 123 1.381 -9.548 7.972 1.00 0.09 C ATOM 542 O GLY A 123 0.397 -8.814 7.872 1.00 0.11 O ATOM 0 H GLY A 123 -0.362 -10.344 6.371 1.00 0.09 H new ATOM 0 HA2 GLY A 123 1.803 -11.591 7.496 1.00 0.10 H new ATOM 0 HA3 GLY A 123 2.510 -10.435 6.385 1.00 0.10 H new ATOM 546 N ASN A 124 2.276 -9.427 8.940 1.00 0.13 N ATOM 547 CA ASN A 124 2.141 -8.417 9.980 1.00 0.14 C ATOM 548 C ASN A 124 2.435 -7.032 9.415 1.00 0.11 C ATOM 549 O ASN A 124 3.383 -6.851 8.655 1.00 0.14 O ATOM 550 CB ASN A 124 3.082 -8.725 11.150 1.00 0.18 C ATOM 551 CG ASN A 124 2.882 -7.783 12.323 1.00 0.21 C ATOM 552 OD1 ASN A 124 1.781 -7.289 12.559 1.00 0.24 O ATOM 553 ND2 ASN A 124 3.937 -7.541 13.085 1.00 0.25 N ATOM 0 H ASN A 124 3.104 -10.016 9.028 1.00 0.13 H new ATOM 0 HA ASN A 124 1.115 -8.433 10.347 1.00 0.14 H new ATOM 0 HB2 ASN A 124 2.921 -9.751 11.481 1.00 0.18 H new ATOM 0 HB3 ASN A 124 4.115 -8.659 10.808 1.00 0.18 H new ATOM 0 HD21 ASN A 124 3.851 -6.929 13.896 1.00 0.25 H new ATOM 0 HD22 ASN A 124 4.836 -7.967 12.861 1.00 0.25 H new ATOM 560 N ILE A 125 1.609 -6.066 9.770 1.00 0.11 N ATOM 561 CA ILE A 125 1.773 -4.703 9.289 1.00 0.10 C ATOM 562 C ILE A 125 2.190 -3.784 10.433 1.00 0.11 C ATOM 563 O ILE A 125 1.620 -3.849 11.522 1.00 0.14 O ATOM 564 CB ILE A 125 0.463 -4.177 8.669 1.00 0.11 C ATOM 565 CG1 ILE A 125 0.012 -5.086 7.522 1.00 0.10 C ATOM 566 CG2 ILE A 125 0.633 -2.746 8.183 1.00 0.14 C ATOM 567 CD1 ILE A 125 -1.301 -4.668 6.894 1.00 0.11 C ATOM 0 H ILE A 125 0.813 -6.199 10.393 1.00 0.11 H new ATOM 0 HA ILE A 125 2.550 -4.710 8.524 1.00 0.10 H new ATOM 0 HB ILE A 125 -0.308 -4.184 9.439 1.00 0.11 H new ATOM 0 HG12 ILE A 125 0.785 -5.097 6.753 1.00 0.10 H new ATOM 0 HG13 ILE A 125 -0.082 -6.106 7.894 1.00 0.10 H new ATOM 0 HG21 ILE A 125 -0.304 -2.395 7.749 1.00 0.14 H new ATOM 0 HG22 ILE A 125 0.906 -2.107 9.023 1.00 0.14 H new ATOM 0 HG23 ILE A 125 1.419 -2.709 7.428 1.00 0.14 H new ATOM 0 HD11 ILE A 125 -1.556 -5.358 6.090 1.00 0.11 H new ATOM 0 HD12 ILE A 125 -2.087 -4.685 7.649 1.00 0.11 H new ATOM 0 HD13 ILE A 125 -1.207 -3.660 6.491 1.00 0.11 H new ATOM 579 N LEU A 126 3.178 -2.928 10.191 1.00 0.13 N ATOM 580 CA LEU A 126 3.636 -2.004 11.224 1.00 0.15 C ATOM 581 C LEU A 126 2.857 -0.708 11.101 1.00 0.16 C ATOM 582 O LEU A 126 2.311 -0.191 12.075 1.00 0.24 O ATOM 583 CB LEU A 126 5.140 -1.672 11.119 1.00 0.19 C ATOM 584 CG LEU A 126 6.126 -2.829 10.885 1.00 0.21 C ATOM 585 CD1 LEU A 126 5.613 -4.148 11.438 1.00 0.53 C ATOM 586 CD2 LEU A 126 6.470 -2.931 9.410 1.00 0.54 C ATOM 0 H LEU A 126 3.671 -2.854 9.301 1.00 0.13 H new ATOM 0 HA LEU A 126 3.471 -2.493 12.184 1.00 0.15 H new ATOM 0 HB2 LEU A 126 5.267 -0.957 10.306 1.00 0.19 H new ATOM 0 HB3 LEU A 126 5.434 -1.165 12.038 1.00 0.19 H new ATOM 0 HG LEU A 126 7.039 -2.607 11.438 1.00 0.21 H new ATOM 0 HD11 LEU A 126 6.346 -4.932 11.247 1.00 0.53 H new ATOM 0 HD12 LEU A 126 5.453 -4.055 12.512 1.00 0.53 H new ATOM 0 HD13 LEU A 126 4.672 -4.405 10.952 1.00 0.53 H new ATOM 0 HD21 LEU A 126 7.169 -3.753 9.255 1.00 0.54 H new ATOM 0 HD22 LEU A 126 5.561 -3.114 8.836 1.00 0.54 H new ATOM 0 HD23 LEU A 126 6.927 -1.999 9.078 1.00 0.54 H new ATOM 598 N SER A 127 2.803 -0.204 9.878 1.00 0.14 N ATOM 599 CA SER A 127 2.186 1.077 9.598 1.00 0.17 C ATOM 600 C SER A 127 1.426 1.038 8.276 1.00 0.19 C ATOM 601 O SER A 127 2.023 1.106 7.201 1.00 0.37 O ATOM 602 CB SER A 127 3.261 2.168 9.554 1.00 0.19 C ATOM 603 OG SER A 127 3.893 2.316 10.814 1.00 0.76 O ATOM 0 H SER A 127 3.185 -0.672 9.056 1.00 0.14 H new ATOM 0 HA SER A 127 1.474 1.301 10.393 1.00 0.17 H new ATOM 0 HB2 SER A 127 4.005 1.918 8.798 1.00 0.19 H new ATOM 0 HB3 SER A 127 2.810 3.115 9.257 1.00 0.19 H new ATOM 0 HG SER A 127 4.575 3.017 10.757 1.00 0.76 H new ATOM 609 N CYS A 128 0.116 0.883 8.354 1.00 0.18 N ATOM 610 CA CYS A 128 -0.730 0.992 7.178 1.00 0.17 C ATOM 611 C CYS A 128 -1.287 2.403 7.105 1.00 0.16 C ATOM 612 O CYS A 128 -1.497 3.044 8.137 1.00 0.28 O ATOM 613 CB CYS A 128 -1.866 -0.031 7.220 1.00 0.21 C ATOM 614 SG CYS A 128 -2.840 0.007 8.743 1.00 0.72 S ATOM 0 H CYS A 128 -0.385 0.681 9.219 1.00 0.18 H new ATOM 0 HA CYS A 128 -0.136 0.783 6.289 1.00 0.17 H new ATOM 0 HB2 CYS A 128 -2.529 0.144 6.373 1.00 0.21 H new ATOM 0 HB3 CYS A 128 -1.446 -1.029 7.095 1.00 0.21 H new ATOM 0 HG CYS A 128 -4.106 -0.007 8.449 1.00 0.72 H new ATOM 620 N LYS A 129 -1.511 2.898 5.904 1.00 0.13 N ATOM 621 CA LYS A 129 -1.928 4.276 5.739 1.00 0.14 C ATOM 622 C LYS A 129 -2.866 4.438 4.550 1.00 0.12 C ATOM 623 O LYS A 129 -2.572 3.983 3.449 1.00 0.12 O ATOM 624 CB LYS A 129 -0.684 5.161 5.563 1.00 0.18 C ATOM 625 CG LYS A 129 -0.969 6.644 5.357 1.00 0.23 C ATOM 626 CD LYS A 129 -1.673 7.264 6.554 1.00 0.36 C ATOM 627 CE LYS A 129 -1.663 8.789 6.474 1.00 0.47 C ATOM 628 NZ LYS A 129 -0.302 9.345 6.690 1.00 1.00 N ATOM 0 H LYS A 129 -1.412 2.372 5.035 1.00 0.13 H new ATOM 0 HA LYS A 129 -2.477 4.582 6.630 1.00 0.14 H new ATOM 0 HB2 LYS A 129 -0.049 5.048 6.442 1.00 0.18 H new ATOM 0 HB3 LYS A 129 -0.114 4.794 4.709 1.00 0.18 H new ATOM 0 HG2 LYS A 129 -0.032 7.171 5.175 1.00 0.23 H new ATOM 0 HG3 LYS A 129 -1.585 6.774 4.467 1.00 0.23 H new ATOM 0 HD2 LYS A 129 -2.702 6.907 6.599 1.00 0.36 H new ATOM 0 HD3 LYS A 129 -1.183 6.943 7.473 1.00 0.36 H new ATOM 0 HE2 LYS A 129 -2.034 9.104 5.499 1.00 0.47 H new ATOM 0 HE3 LYS A 129 -2.345 9.196 7.221 1.00 0.47 H new ATOM 0 HZ1 LYS A 129 -0.371 10.362 6.898 1.00 1.00 H new ATOM 0 HZ2 LYS A 129 0.149 8.858 7.490 1.00 1.00 H new ATOM 0 HZ3 LYS A 129 0.270 9.205 5.833 1.00 1.00 H new ATOM 642 N VAL A 130 -3.995 5.084 4.797 1.00 0.15 N ATOM 643 CA VAL A 130 -4.887 5.516 3.741 1.00 0.17 C ATOM 644 C VAL A 130 -4.799 7.014 3.691 1.00 0.20 C ATOM 645 O VAL A 130 -5.228 7.707 4.616 1.00 0.24 O ATOM 646 CB VAL A 130 -6.366 5.110 3.949 1.00 0.21 C ATOM 647 CG1 VAL A 130 -7.244 5.736 2.861 1.00 0.28 C ATOM 648 CG2 VAL A 130 -6.519 3.594 3.956 1.00 0.21 C ATOM 0 H VAL A 130 -4.315 5.322 5.736 1.00 0.15 H new ATOM 0 HA VAL A 130 -4.574 5.030 2.817 1.00 0.17 H new ATOM 0 HB VAL A 130 -6.692 5.484 4.920 1.00 0.21 H new ATOM 0 HG11 VAL A 130 -8.282 5.443 3.018 1.00 0.28 H new ATOM 0 HG12 VAL A 130 -7.162 6.822 2.908 1.00 0.28 H new ATOM 0 HG13 VAL A 130 -6.913 5.389 1.882 1.00 0.28 H new ATOM 0 HG21 VAL A 130 -7.567 3.335 4.104 1.00 0.21 H new ATOM 0 HG22 VAL A 130 -6.176 3.189 3.004 1.00 0.21 H new ATOM 0 HG23 VAL A 130 -5.923 3.172 4.765 1.00 0.21 H new ATOM 658 N VAL A 131 -4.209 7.509 2.642 1.00 0.21 N ATOM 659 CA VAL A 131 -3.922 8.910 2.549 1.00 0.27 C ATOM 660 C VAL A 131 -5.195 9.669 2.218 1.00 0.33 C ATOM 661 O VAL A 131 -5.843 9.425 1.197 1.00 0.33 O ATOM 662 CB VAL A 131 -2.813 9.139 1.520 1.00 0.28 C ATOM 663 CG1 VAL A 131 -2.291 10.563 1.594 1.00 0.34 C ATOM 664 CG2 VAL A 131 -1.701 8.136 1.783 1.00 0.25 C ATOM 0 H VAL A 131 -3.916 6.959 1.835 1.00 0.21 H new ATOM 0 HA VAL A 131 -3.559 9.290 3.504 1.00 0.27 H new ATOM 0 HB VAL A 131 -3.207 8.995 0.514 1.00 0.28 H new ATOM 0 HG11 VAL A 131 -1.504 10.701 0.853 1.00 0.34 H new ATOM 0 HG12 VAL A 131 -3.105 11.260 1.393 1.00 0.34 H new ATOM 0 HG13 VAL A 131 -1.889 10.752 2.590 1.00 0.34 H new ATOM 0 HG21 VAL A 131 -0.900 8.283 1.059 1.00 0.25 H new ATOM 0 HG22 VAL A 131 -1.311 8.281 2.790 1.00 0.25 H new ATOM 0 HG23 VAL A 131 -2.094 7.124 1.689 1.00 0.25 H new ATOM 674 N CYS A 132 -5.554 10.573 3.107 1.00 0.43 N ATOM 675 CA CYS A 132 -6.854 11.205 3.076 1.00 0.55 C ATOM 676 C CYS A 132 -6.800 12.539 2.359 1.00 0.58 C ATOM 677 O CYS A 132 -5.862 13.320 2.534 1.00 0.66 O ATOM 678 CB CYS A 132 -7.351 11.387 4.509 1.00 0.75 C ATOM 679 SG CYS A 132 -6.092 12.034 5.632 1.00 1.58 S ATOM 0 H CYS A 132 -4.953 10.888 3.869 1.00 0.43 H new ATOM 0 HA CYS A 132 -7.545 10.567 2.525 1.00 0.55 H new ATOM 0 HB2 CYS A 132 -8.206 12.064 4.506 1.00 0.75 H new ATOM 0 HB3 CYS A 132 -7.705 10.428 4.887 1.00 0.75 H new ATOM 0 HG CYS A 132 -6.597 12.160 6.823 1.00 1.58 H new ATOM 685 N ASP A 133 -7.799 12.781 1.525 1.00 0.59 N ATOM 686 CA ASP A 133 -7.888 14.022 0.794 1.00 0.72 C ATOM 687 C ASP A 133 -8.589 15.051 1.662 1.00 0.93 C ATOM 688 O ASP A 133 -9.240 14.691 2.644 1.00 0.99 O ATOM 689 CB ASP A 133 -8.645 13.840 -0.533 1.00 0.70 C ATOM 690 CG ASP A 133 -8.585 15.070 -1.419 1.00 1.09 C ATOM 691 OD1 ASP A 133 -7.551 15.274 -2.090 1.00 2.08 O ATOM 692 OD2 ASP A 133 -9.565 15.836 -1.452 1.00 1.20 O ATOM 0 H ASP A 133 -8.560 12.127 1.341 1.00 0.59 H new ATOM 0 HA ASP A 133 -6.881 14.361 0.550 1.00 0.72 H new ATOM 0 HB2 ASP A 133 -8.226 12.990 -1.071 1.00 0.70 H new ATOM 0 HB3 ASP A 133 -9.687 13.601 -0.321 1.00 0.70 H new ATOM 697 N GLU A 134 -8.440 16.316 1.323 1.00 1.12 N ATOM 698 CA GLU A 134 -9.215 17.371 1.970 1.00 1.35 C ATOM 699 C GLU A 134 -10.716 17.085 1.829 1.00 1.36 C ATOM 700 O GLU A 134 -11.516 17.458 2.685 1.00 1.52 O ATOM 701 CB GLU A 134 -8.882 18.745 1.375 1.00 1.57 C ATOM 702 CG GLU A 134 -9.359 18.939 -0.057 1.00 1.60 C ATOM 703 CD GLU A 134 -9.090 20.335 -0.570 1.00 1.96 C ATOM 704 OE1 GLU A 134 -7.970 20.593 -1.060 1.00 2.09 O ATOM 705 OE2 GLU A 134 -10.000 21.184 -0.490 1.00 2.45 O ATOM 0 H GLU A 134 -7.793 16.644 0.606 1.00 1.12 H new ATOM 0 HA GLU A 134 -8.951 17.386 3.027 1.00 1.35 H new ATOM 0 HB2 GLU A 134 -9.328 19.517 2.002 1.00 1.57 H new ATOM 0 HB3 GLU A 134 -7.802 18.891 1.409 1.00 1.57 H new ATOM 0 HG2 GLU A 134 -8.863 18.215 -0.704 1.00 1.60 H new ATOM 0 HG3 GLU A 134 -10.428 18.735 -0.112 1.00 1.60 H new ATOM 712 N ASN A 135 -11.080 16.397 0.750 1.00 1.25 N ATOM 713 CA ASN A 135 -12.468 16.022 0.495 1.00 1.31 C ATOM 714 C ASN A 135 -12.786 14.679 1.143 1.00 1.25 C ATOM 715 O ASN A 135 -13.907 14.179 1.045 1.00 1.36 O ATOM 716 CB ASN A 135 -12.755 15.935 -1.011 1.00 1.32 C ATOM 717 CG ASN A 135 -12.706 17.278 -1.719 1.00 1.47 C ATOM 718 OD1 ASN A 135 -13.694 18.012 -1.744 1.00 1.65 O ATOM 719 ND2 ASN A 135 -11.578 17.590 -2.341 1.00 1.46 N ATOM 0 H ASN A 135 -10.426 16.085 0.032 1.00 1.25 H new ATOM 0 HA ASN A 135 -13.100 16.797 0.929 1.00 1.31 H new ATOM 0 HB2 ASN A 135 -12.030 15.264 -1.472 1.00 1.32 H new ATOM 0 HB3 ASN A 135 -13.739 15.491 -1.160 1.00 1.32 H new ATOM 0 HD21 ASN A 135 -11.508 18.464 -2.863 1.00 1.46 H new ATOM 0 HD22 ASN A 135 -10.780 16.956 -2.298 1.00 1.46 H new ATOM 726 N GLY A 136 -11.797 14.102 1.812 1.00 1.12 N ATOM 727 CA GLY A 136 -11.992 12.816 2.459 1.00 1.11 C ATOM 728 C GLY A 136 -10.883 11.807 2.179 1.00 0.89 C ATOM 729 O GLY A 136 -10.139 11.434 3.084 1.00 0.86 O ATOM 0 H GLY A 136 -10.864 14.499 1.919 1.00 1.12 H new ATOM 0 HA2 GLY A 136 -12.066 12.970 3.536 1.00 1.11 H new ATOM 0 HA3 GLY A 136 -12.943 12.396 2.131 1.00 1.11 H new ATOM 733 N SER A 137 -10.756 11.368 0.932 1.00 0.77 N ATOM 734 CA SER A 137 -9.831 10.288 0.582 1.00 0.57 C ATOM 735 C SER A 137 -9.110 10.593 -0.731 1.00 0.47 C ATOM 736 O SER A 137 -9.745 10.957 -1.720 1.00 0.53 O ATOM 737 CB SER A 137 -10.627 8.981 0.480 1.00 0.67 C ATOM 738 OG SER A 137 -11.779 9.161 -0.326 1.00 1.61 O ATOM 0 H SER A 137 -11.282 11.742 0.142 1.00 0.77 H new ATOM 0 HA SER A 137 -9.067 10.193 1.354 1.00 0.57 H new ATOM 0 HB2 SER A 137 -9.998 8.198 0.056 1.00 0.67 H new ATOM 0 HB3 SER A 137 -10.921 8.649 1.476 1.00 0.67 H new ATOM 0 HG SER A 137 -11.562 9.747 -1.081 1.00 1.61 H new ATOM 744 N LYS A 138 -7.780 10.466 -0.737 1.00 0.38 N ATOM 745 CA LYS A 138 -7.002 10.821 -1.920 1.00 0.36 C ATOM 746 C LYS A 138 -7.155 9.777 -3.004 1.00 0.34 C ATOM 747 O LYS A 138 -7.217 10.096 -4.191 1.00 0.47 O ATOM 748 CB LYS A 138 -5.517 11.007 -1.597 1.00 0.36 C ATOM 749 CG LYS A 138 -5.226 12.100 -0.575 1.00 0.44 C ATOM 750 CD LYS A 138 -3.793 12.593 -0.657 1.00 0.67 C ATOM 751 CE LYS A 138 -3.562 13.405 -1.917 1.00 0.89 C ATOM 752 NZ LYS A 138 -2.151 13.852 -2.029 1.00 1.51 N ATOM 0 H LYS A 138 -7.230 10.126 0.052 1.00 0.38 H new ATOM 0 HA LYS A 138 -7.396 11.773 -2.277 1.00 0.36 H new ATOM 0 HB2 LYS A 138 -5.118 10.063 -1.225 1.00 0.36 H new ATOM 0 HB3 LYS A 138 -4.983 11.238 -2.519 1.00 0.36 H new ATOM 0 HG2 LYS A 138 -5.906 12.936 -0.736 1.00 0.44 H new ATOM 0 HG3 LYS A 138 -5.421 11.719 0.428 1.00 0.44 H new ATOM 0 HD2 LYS A 138 -3.565 13.202 0.218 1.00 0.67 H new ATOM 0 HD3 LYS A 138 -3.112 11.742 -0.640 1.00 0.67 H new ATOM 0 HE2 LYS A 138 -3.825 12.807 -2.789 1.00 0.89 H new ATOM 0 HE3 LYS A 138 -4.220 14.274 -1.916 1.00 0.89 H new ATOM 0 HZ1 LYS A 138 -2.041 14.447 -2.875 1.00 1.51 H new ATOM 0 HZ2 LYS A 138 -1.893 14.401 -1.184 1.00 1.51 H new ATOM 0 HZ3 LYS A 138 -1.529 13.022 -2.106 1.00 1.51 H new ATOM 766 N GLY A 139 -7.236 8.538 -2.590 1.00 0.27 N ATOM 767 CA GLY A 139 -7.366 7.458 -3.547 1.00 0.26 C ATOM 768 C GLY A 139 -6.278 6.411 -3.431 1.00 0.21 C ATOM 769 O GLY A 139 -6.408 5.317 -3.977 1.00 0.31 O ATOM 0 H GLY A 139 -7.215 8.250 -1.612 1.00 0.27 H new ATOM 0 HA2 GLY A 139 -8.336 6.979 -3.412 1.00 0.26 H new ATOM 0 HA3 GLY A 139 -7.353 7.873 -4.555 1.00 0.26 H new ATOM 773 N TYR A 140 -5.209 6.727 -2.727 1.00 0.19 N ATOM 774 CA TYR A 140 -4.085 5.812 -2.633 1.00 0.15 C ATOM 775 C TYR A 140 -3.626 5.651 -1.191 1.00 0.13 C ATOM 776 O TYR A 140 -3.885 6.512 -0.344 1.00 0.16 O ATOM 777 CB TYR A 140 -2.931 6.269 -3.537 1.00 0.19 C ATOM 778 CG TYR A 140 -2.409 7.664 -3.271 1.00 0.23 C ATOM 779 CD1 TYR A 140 -3.064 8.784 -3.773 1.00 0.26 C ATOM 780 CD2 TYR A 140 -1.242 7.856 -2.542 1.00 0.31 C ATOM 781 CE1 TYR A 140 -2.567 10.056 -3.549 1.00 0.34 C ATOM 782 CE2 TYR A 140 -0.739 9.121 -2.320 1.00 0.39 C ATOM 783 CZ TYR A 140 -1.403 10.217 -2.824 1.00 0.41 C ATOM 784 OH TYR A 140 -0.897 11.481 -2.606 1.00 0.49 O ATOM 0 H TYR A 140 -5.093 7.602 -2.215 1.00 0.19 H new ATOM 0 HA TYR A 140 -4.417 4.835 -2.983 1.00 0.15 H new ATOM 0 HB2 TYR A 140 -2.106 5.564 -3.428 1.00 0.19 H new ATOM 0 HB3 TYR A 140 -3.262 6.215 -4.574 1.00 0.19 H new ATOM 0 HD1 TYR A 140 -3.972 8.659 -4.345 1.00 0.26 H new ATOM 0 HD2 TYR A 140 -0.719 7.000 -2.142 1.00 0.31 H new ATOM 0 HE1 TYR A 140 -3.087 10.918 -3.939 1.00 0.34 H new ATOM 0 HE2 TYR A 140 0.171 9.251 -1.754 1.00 0.39 H new ATOM 0 HH TYR A 140 -0.074 11.417 -2.078 1.00 0.49 H new ATOM 794 N GLY A 141 -2.965 4.538 -0.919 1.00 0.11 N ATOM 795 CA GLY A 141 -2.515 4.238 0.424 1.00 0.11 C ATOM 796 C GLY A 141 -1.213 3.470 0.422 1.00 0.10 C ATOM 797 O GLY A 141 -0.697 3.123 -0.640 1.00 0.12 O ATOM 0 H GLY A 141 -2.729 3.829 -1.613 1.00 0.11 H new ATOM 0 HA2 GLY A 141 -2.388 5.167 0.981 1.00 0.11 H new ATOM 0 HA3 GLY A 141 -3.278 3.658 0.942 1.00 0.11 H new ATOM 801 N PHE A 142 -0.685 3.195 1.607 1.00 0.10 N ATOM 802 CA PHE A 142 0.601 2.518 1.738 1.00 0.10 C ATOM 803 C PHE A 142 0.531 1.442 2.819 1.00 0.10 C ATOM 804 O PHE A 142 -0.147 1.618 3.833 1.00 0.14 O ATOM 805 CB PHE A 142 1.703 3.521 2.112 1.00 0.12 C ATOM 806 CG PHE A 142 1.737 4.757 1.256 1.00 0.14 C ATOM 807 CD1 PHE A 142 2.004 4.669 -0.101 1.00 0.16 C ATOM 808 CD2 PHE A 142 1.496 6.005 1.807 1.00 0.21 C ATOM 809 CE1 PHE A 142 2.030 5.803 -0.891 1.00 0.19 C ATOM 810 CE2 PHE A 142 1.520 7.141 1.022 1.00 0.25 C ATOM 811 CZ PHE A 142 1.813 7.044 -0.323 1.00 0.22 C ATOM 0 H PHE A 142 -1.128 3.431 2.495 1.00 0.10 H new ATOM 0 HA PHE A 142 0.835 2.059 0.778 1.00 0.10 H new ATOM 0 HB2 PHE A 142 1.569 3.818 3.152 1.00 0.12 H new ATOM 0 HB3 PHE A 142 2.669 3.021 2.045 1.00 0.12 H new ATOM 0 HD1 PHE A 142 2.194 3.704 -0.546 1.00 0.16 H new ATOM 0 HD2 PHE A 142 1.287 6.091 2.863 1.00 0.21 H new ATOM 0 HE1 PHE A 142 2.220 5.719 -1.951 1.00 0.19 H new ATOM 0 HE2 PHE A 142 1.309 8.105 1.461 1.00 0.25 H new ATOM 0 HZ PHE A 142 1.873 7.935 -0.930 1.00 0.22 H new ATOM 821 N VAL A 143 1.210 0.322 2.597 1.00 0.08 N ATOM 822 CA VAL A 143 1.369 -0.685 3.640 1.00 0.08 C ATOM 823 C VAL A 143 2.827 -0.822 4.027 1.00 0.08 C ATOM 824 O VAL A 143 3.703 -0.947 3.170 1.00 0.09 O ATOM 825 CB VAL A 143 0.864 -2.082 3.219 1.00 0.08 C ATOM 826 CG1 VAL A 143 0.972 -3.079 4.375 1.00 0.07 C ATOM 827 CG2 VAL A 143 -0.562 -2.007 2.725 1.00 0.10 C ATOM 0 H VAL A 143 1.657 0.089 1.710 1.00 0.08 H new ATOM 0 HA VAL A 143 0.766 -0.336 4.478 1.00 0.08 H new ATOM 0 HB VAL A 143 1.498 -2.434 2.405 1.00 0.08 H new ATOM 0 HG11 VAL A 143 0.609 -4.054 4.050 1.00 0.07 H new ATOM 0 HG12 VAL A 143 2.013 -3.164 4.686 1.00 0.07 H new ATOM 0 HG13 VAL A 143 0.370 -2.730 5.214 1.00 0.07 H new ATOM 0 HG21 VAL A 143 -0.899 -3.002 2.433 1.00 0.10 H new ATOM 0 HG22 VAL A 143 -1.203 -1.626 3.520 1.00 0.10 H new ATOM 0 HG23 VAL A 143 -0.614 -1.339 1.865 1.00 0.10 H new ATOM 837 N HIS A 144 3.086 -0.765 5.316 1.00 0.09 N ATOM 838 CA HIS A 144 4.378 -1.151 5.833 1.00 0.10 C ATOM 839 C HIS A 144 4.284 -2.546 6.406 1.00 0.10 C ATOM 840 O HIS A 144 3.726 -2.740 7.486 1.00 0.11 O ATOM 841 CB HIS A 144 4.830 -0.185 6.920 1.00 0.12 C ATOM 842 CG HIS A 144 5.806 0.827 6.437 1.00 0.14 C ATOM 843 ND1 HIS A 144 6.685 1.480 7.268 1.00 0.18 N ATOM 844 CD2 HIS A 144 6.057 1.277 5.195 1.00 0.17 C ATOM 845 CE1 HIS A 144 7.439 2.288 6.555 1.00 0.21 C ATOM 846 NE2 HIS A 144 7.075 2.191 5.294 1.00 0.21 N ATOM 0 H HIS A 144 2.419 -0.455 6.023 1.00 0.09 H new ATOM 0 HA HIS A 144 5.106 -1.127 5.022 1.00 0.10 H new ATOM 0 HB2 HIS A 144 3.958 0.327 7.328 1.00 0.12 H new ATOM 0 HB3 HIS A 144 5.278 -0.751 7.737 1.00 0.12 H new ATOM 0 HD2 HIS A 144 5.552 0.975 4.289 1.00 0.17 H new ATOM 0 HE1 HIS A 144 8.224 2.923 6.939 1.00 0.21 H new ATOM 0 HE2 HIS A 144 7.483 2.711 4.517 1.00 0.21 H new ATOM 855 N PHE A 145 4.825 -3.509 5.691 1.00 0.10 N ATOM 856 CA PHE A 145 4.816 -4.874 6.160 1.00 0.10 C ATOM 857 C PHE A 145 6.026 -5.151 7.018 1.00 0.13 C ATOM 858 O PHE A 145 7.125 -4.658 6.753 1.00 0.17 O ATOM 859 CB PHE A 145 4.754 -5.869 5.003 1.00 0.10 C ATOM 860 CG PHE A 145 3.357 -6.201 4.567 1.00 0.09 C ATOM 861 CD1 PHE A 145 2.546 -6.999 5.359 1.00 0.10 C ATOM 862 CD2 PHE A 145 2.856 -5.727 3.369 1.00 0.09 C ATOM 863 CE1 PHE A 145 1.262 -7.315 4.963 1.00 0.11 C ATOM 864 CE2 PHE A 145 1.574 -6.041 2.967 1.00 0.10 C ATOM 865 CZ PHE A 145 0.775 -6.836 3.766 1.00 0.10 C ATOM 0 H PHE A 145 5.275 -3.371 4.786 1.00 0.10 H new ATOM 0 HA PHE A 145 3.917 -5.004 6.762 1.00 0.10 H new ATOM 0 HB2 PHE A 145 5.303 -5.460 4.154 1.00 0.10 H new ATOM 0 HB3 PHE A 145 5.261 -6.788 5.298 1.00 0.10 H new ATOM 0 HD1 PHE A 145 2.923 -7.378 6.297 1.00 0.10 H new ATOM 0 HD2 PHE A 145 3.475 -5.104 2.741 1.00 0.09 H new ATOM 0 HE1 PHE A 145 0.640 -7.937 5.590 1.00 0.11 H new ATOM 0 HE2 PHE A 145 1.195 -5.665 2.028 1.00 0.10 H new ATOM 0 HZ PHE A 145 -0.229 -7.082 3.453 1.00 0.10 H new ATOM 875 N GLU A 146 5.786 -5.914 8.064 1.00 0.13 N ATOM 876 CA GLU A 146 6.829 -6.343 8.992 1.00 0.17 C ATOM 877 C GLU A 146 7.997 -6.949 8.235 1.00 0.19 C ATOM 878 O GLU A 146 9.165 -6.715 8.550 1.00 0.22 O ATOM 879 CB GLU A 146 6.267 -7.390 9.950 1.00 0.22 C ATOM 880 CG GLU A 146 7.236 -7.808 11.036 1.00 0.30 C ATOM 881 CD GLU A 146 6.819 -9.092 11.711 1.00 0.37 C ATOM 882 OE1 GLU A 146 7.140 -10.175 11.188 1.00 0.57 O ATOM 883 OE2 GLU A 146 6.165 -9.017 12.772 1.00 0.38 O ATOM 0 H GLU A 146 4.857 -6.260 8.302 1.00 0.13 H new ATOM 0 HA GLU A 146 7.173 -5.472 9.549 1.00 0.17 H new ATOM 0 HB2 GLU A 146 5.363 -6.996 10.415 1.00 0.22 H new ATOM 0 HB3 GLU A 146 5.974 -8.271 9.379 1.00 0.22 H new ATOM 0 HG2 GLU A 146 8.230 -7.932 10.605 1.00 0.30 H new ATOM 0 HG3 GLU A 146 7.308 -7.015 11.781 1.00 0.30 H new ATOM 890 N THR A 147 7.655 -7.728 7.234 1.00 0.22 N ATOM 891 CA THR A 147 8.637 -8.414 6.424 1.00 0.26 C ATOM 892 C THR A 147 8.486 -8.054 4.951 1.00 0.23 C ATOM 893 O THR A 147 7.382 -7.781 4.470 1.00 0.21 O ATOM 894 CB THR A 147 8.527 -9.939 6.589 1.00 0.33 C ATOM 895 OG1 THR A 147 7.170 -10.359 6.387 1.00 0.40 O ATOM 896 CG2 THR A 147 8.994 -10.374 7.965 1.00 0.35 C ATOM 0 H THR A 147 6.689 -7.904 6.958 1.00 0.22 H new ATOM 0 HA THR A 147 9.618 -8.089 6.770 1.00 0.26 H new ATOM 0 HB THR A 147 9.169 -10.406 5.842 1.00 0.33 H new ATOM 0 HG1 THR A 147 7.109 -11.331 6.492 1.00 0.40 H new ATOM 0 HG21 THR A 147 8.905 -11.457 8.054 1.00 0.35 H new ATOM 0 HG22 THR A 147 10.035 -10.082 8.105 1.00 0.35 H new ATOM 0 HG23 THR A 147 8.378 -9.896 8.726 1.00 0.35 H new ATOM 904 N GLN A 148 9.607 -8.051 4.249 1.00 0.24 N ATOM 905 CA GLN A 148 9.641 -7.747 2.826 1.00 0.23 C ATOM 906 C GLN A 148 8.797 -8.744 2.021 1.00 0.21 C ATOM 907 O GLN A 148 8.138 -8.365 1.049 1.00 0.21 O ATOM 908 CB GLN A 148 11.098 -7.768 2.348 1.00 0.28 C ATOM 909 CG GLN A 148 11.312 -7.259 0.932 1.00 0.31 C ATOM 910 CD GLN A 148 10.720 -5.883 0.695 1.00 0.34 C ATOM 911 OE1 GLN A 148 11.364 -4.861 0.907 1.00 0.47 O ATOM 912 NE2 GLN A 148 9.484 -5.852 0.247 1.00 0.38 N ATOM 0 H GLN A 148 10.522 -8.260 4.650 1.00 0.24 H new ATOM 0 HA GLN A 148 9.214 -6.757 2.666 1.00 0.23 H new ATOM 0 HB2 GLN A 148 11.698 -7.166 3.030 1.00 0.28 H new ATOM 0 HB3 GLN A 148 11.472 -8.790 2.412 1.00 0.28 H new ATOM 0 HG2 GLN A 148 12.381 -7.228 0.722 1.00 0.31 H new ATOM 0 HG3 GLN A 148 10.869 -7.964 0.229 1.00 0.31 H new ATOM 0 HE21 GLN A 148 8.979 -6.723 0.082 1.00 0.38 H new ATOM 0 HE22 GLN A 148 9.030 -4.957 0.064 1.00 0.38 H new ATOM 921 N GLU A 149 8.806 -10.009 2.440 1.00 0.22 N ATOM 922 CA GLU A 149 8.102 -11.067 1.719 1.00 0.22 C ATOM 923 C GLU A 149 6.581 -10.890 1.781 1.00 0.18 C ATOM 924 O GLU A 149 5.883 -11.173 0.807 1.00 0.17 O ATOM 925 CB GLU A 149 8.497 -12.445 2.258 1.00 0.28 C ATOM 926 CG GLU A 149 7.902 -12.755 3.610 1.00 0.35 C ATOM 927 CD GLU A 149 8.182 -14.168 4.065 1.00 0.47 C ATOM 928 OE1 GLU A 149 9.264 -14.409 4.638 1.00 0.62 O ATOM 929 OE2 GLU A 149 7.325 -15.047 3.850 1.00 0.74 O ATOM 0 H GLU A 149 9.295 -10.326 3.277 1.00 0.22 H new ATOM 0 HA GLU A 149 8.400 -10.996 0.673 1.00 0.22 H new ATOM 0 HB2 GLU A 149 8.181 -13.209 1.547 1.00 0.28 H new ATOM 0 HB3 GLU A 149 9.583 -12.502 2.326 1.00 0.28 H new ATOM 0 HG2 GLU A 149 8.300 -12.056 4.346 1.00 0.35 H new ATOM 0 HG3 GLU A 149 6.824 -12.598 3.572 1.00 0.35 H new ATOM 936 N ALA A 150 6.075 -10.408 2.915 1.00 0.17 N ATOM 937 CA ALA A 150 4.638 -10.225 3.097 1.00 0.15 C ATOM 938 C ALA A 150 4.118 -9.150 2.156 1.00 0.13 C ATOM 939 O ALA A 150 2.998 -9.235 1.650 1.00 0.13 O ATOM 940 CB ALA A 150 4.333 -9.869 4.543 1.00 0.18 C ATOM 0 H ALA A 150 6.639 -10.138 3.720 1.00 0.17 H new ATOM 0 HA ALA A 150 4.132 -11.160 2.859 1.00 0.15 H new ATOM 0 HB1 ALA A 150 3.258 -9.735 4.666 1.00 0.18 H new ATOM 0 HB2 ALA A 150 4.676 -10.672 5.195 1.00 0.18 H new ATOM 0 HB3 ALA A 150 4.846 -8.944 4.806 1.00 0.18 H new ATOM 946 N ALA A 151 4.952 -8.150 1.916 1.00 0.13 N ATOM 947 CA ALA A 151 4.618 -7.071 1.001 1.00 0.13 C ATOM 948 C ALA A 151 4.411 -7.602 -0.411 1.00 0.12 C ATOM 949 O ALA A 151 3.452 -7.234 -1.086 1.00 0.13 O ATOM 950 CB ALA A 151 5.712 -6.021 1.026 1.00 0.16 C ATOM 0 H ALA A 151 5.873 -8.064 2.347 1.00 0.13 H new ATOM 0 HA ALA A 151 3.683 -6.614 1.324 1.00 0.13 H new ATOM 0 HB1 ALA A 151 5.458 -5.214 0.339 1.00 0.16 H new ATOM 0 HB2 ALA A 151 5.809 -5.621 2.035 1.00 0.16 H new ATOM 0 HB3 ALA A 151 6.656 -6.472 0.722 1.00 0.16 H new ATOM 956 N GLU A 152 5.310 -8.479 -0.845 1.00 0.13 N ATOM 957 CA GLU A 152 5.209 -9.095 -2.162 1.00 0.14 C ATOM 958 C GLU A 152 3.902 -9.867 -2.297 1.00 0.12 C ATOM 959 O GLU A 152 3.235 -9.793 -3.328 1.00 0.15 O ATOM 960 CB GLU A 152 6.385 -10.040 -2.402 1.00 0.18 C ATOM 961 CG GLU A 152 7.736 -9.418 -2.112 1.00 0.26 C ATOM 962 CD GLU A 152 8.882 -10.277 -2.596 1.00 0.75 C ATOM 963 OE1 GLU A 152 9.093 -11.363 -2.017 1.00 1.42 O ATOM 964 OE2 GLU A 152 9.574 -9.873 -3.552 1.00 0.95 O ATOM 0 H GLU A 152 6.119 -8.780 -0.301 1.00 0.13 H new ATOM 0 HA GLU A 152 5.230 -8.300 -2.907 1.00 0.14 H new ATOM 0 HB2 GLU A 152 6.261 -10.925 -1.778 1.00 0.18 H new ATOM 0 HB3 GLU A 152 6.364 -10.375 -3.439 1.00 0.18 H new ATOM 0 HG2 GLU A 152 7.792 -8.440 -2.589 1.00 0.26 H new ATOM 0 HG3 GLU A 152 7.835 -9.256 -1.039 1.00 0.26 H new ATOM 971 N ARG A 153 3.539 -10.595 -1.242 1.00 0.10 N ATOM 972 CA ARG A 153 2.298 -11.361 -1.222 1.00 0.12 C ATOM 973 C ARG A 153 1.097 -10.441 -1.419 1.00 0.11 C ATOM 974 O ARG A 153 0.152 -10.774 -2.133 1.00 0.16 O ATOM 975 CB ARG A 153 2.135 -12.105 0.101 1.00 0.16 C ATOM 976 CG ARG A 153 3.279 -13.040 0.448 1.00 0.21 C ATOM 977 CD ARG A 153 3.024 -13.729 1.779 1.00 0.26 C ATOM 978 NE ARG A 153 4.170 -14.509 2.244 1.00 0.38 N ATOM 979 CZ ARG A 153 4.088 -15.786 2.619 1.00 0.80 C ATOM 980 NH1 ARG A 153 2.953 -16.453 2.462 1.00 1.48 N ATOM 981 NH2 ARG A 153 5.146 -16.399 3.132 1.00 0.84 N ATOM 0 H ARG A 153 4.091 -10.669 -0.387 1.00 0.10 H new ATOM 0 HA ARG A 153 2.347 -12.083 -2.037 1.00 0.12 H new ATOM 0 HB2 ARG A 153 2.025 -11.374 0.902 1.00 0.16 H new ATOM 0 HB3 ARG A 153 1.210 -12.681 0.067 1.00 0.16 H new ATOM 0 HG2 ARG A 153 3.396 -13.787 -0.337 1.00 0.21 H new ATOM 0 HG3 ARG A 153 4.212 -12.479 0.496 1.00 0.21 H new ATOM 0 HD2 ARG A 153 2.773 -12.979 2.529 1.00 0.26 H new ATOM 0 HD3 ARG A 153 2.159 -14.385 1.683 1.00 0.26 H new ATOM 0 HE ARG A 153 5.081 -14.052 2.284 1.00 0.38 H new ATOM 0 HH11 ARG A 153 2.141 -15.989 2.054 1.00 1.48 H new ATOM 0 HH12 ARG A 153 2.892 -17.430 2.749 1.00 1.48 H new ATOM 0 HH21 ARG A 153 6.025 -15.894 3.241 1.00 0.84 H new ATOM 0 HH22 ARG A 153 5.080 -17.376 3.418 1.00 0.84 H new ATOM 995 N ALA A 154 1.139 -9.282 -0.777 1.00 0.09 N ATOM 996 CA ALA A 154 0.072 -8.304 -0.905 1.00 0.09 C ATOM 997 C ALA A 154 0.022 -7.744 -2.323 1.00 0.09 C ATOM 998 O ALA A 154 -1.056 -7.502 -2.863 1.00 0.10 O ATOM 999 CB ALA A 154 0.248 -7.187 0.111 1.00 0.10 C ATOM 0 H ALA A 154 1.902 -8.997 -0.162 1.00 0.09 H new ATOM 0 HA ALA A 154 -0.877 -8.802 -0.704 1.00 0.09 H new ATOM 0 HB1 ALA A 154 -0.560 -6.464 0.000 1.00 0.10 H new ATOM 0 HB2 ALA A 154 0.226 -7.604 1.118 1.00 0.10 H new ATOM 0 HB3 ALA A 154 1.204 -6.691 -0.056 1.00 0.10 H new ATOM 1005 N ILE A 155 1.194 -7.557 -2.923 1.00 0.09 N ATOM 1006 CA ILE A 155 1.286 -7.057 -4.291 1.00 0.10 C ATOM 1007 C ILE A 155 0.578 -7.993 -5.263 1.00 0.11 C ATOM 1008 O ILE A 155 -0.278 -7.566 -6.034 1.00 0.14 O ATOM 1009 CB ILE A 155 2.753 -6.883 -4.739 1.00 0.11 C ATOM 1010 CG1 ILE A 155 3.449 -5.834 -3.874 1.00 0.12 C ATOM 1011 CG2 ILE A 155 2.822 -6.493 -6.210 1.00 0.14 C ATOM 1012 CD1 ILE A 155 4.923 -5.677 -4.178 1.00 0.15 C ATOM 0 H ILE A 155 2.095 -7.745 -2.482 1.00 0.09 H new ATOM 0 HA ILE A 155 0.798 -6.082 -4.302 1.00 0.10 H new ATOM 0 HB ILE A 155 3.268 -7.835 -4.614 1.00 0.11 H new ATOM 0 HG12 ILE A 155 2.954 -4.873 -4.014 1.00 0.12 H new ATOM 0 HG13 ILE A 155 3.330 -6.104 -2.825 1.00 0.12 H new ATOM 0 HG21 ILE A 155 3.864 -6.375 -6.507 1.00 0.14 H new ATOM 0 HG22 ILE A 155 2.358 -7.272 -6.815 1.00 0.14 H new ATOM 0 HG23 ILE A 155 2.293 -5.552 -6.362 1.00 0.14 H new ATOM 0 HD11 ILE A 155 5.350 -4.916 -3.525 1.00 0.15 H new ATOM 0 HD12 ILE A 155 5.432 -6.626 -4.010 1.00 0.15 H new ATOM 0 HD13 ILE A 155 5.050 -5.376 -5.218 1.00 0.15 H new ATOM 1024 N GLU A 156 0.932 -9.270 -5.222 1.00 0.11 N ATOM 1025 CA GLU A 156 0.330 -10.248 -6.114 1.00 0.13 C ATOM 1026 C GLU A 156 -1.160 -10.398 -5.866 1.00 0.12 C ATOM 1027 O GLU A 156 -1.959 -10.414 -6.800 1.00 0.15 O ATOM 1028 CB GLU A 156 0.998 -11.623 -5.991 1.00 0.17 C ATOM 1029 CG GLU A 156 1.467 -11.981 -4.590 1.00 0.21 C ATOM 1030 CD GLU A 156 1.752 -13.456 -4.438 1.00 0.62 C ATOM 1031 OE1 GLU A 156 0.827 -14.208 -4.073 1.00 1.08 O ATOM 1032 OE2 GLU A 156 2.905 -13.869 -4.678 1.00 0.63 O ATOM 0 H GLU A 156 1.630 -9.651 -4.583 1.00 0.11 H new ATOM 0 HA GLU A 156 0.486 -9.868 -7.124 1.00 0.13 H new ATOM 0 HB2 GLU A 156 0.295 -12.384 -6.329 1.00 0.17 H new ATOM 0 HB3 GLU A 156 1.854 -11.657 -6.665 1.00 0.17 H new ATOM 0 HG2 GLU A 156 2.368 -11.414 -4.355 1.00 0.21 H new ATOM 0 HG3 GLU A 156 0.706 -11.684 -3.868 1.00 0.21 H new ATOM 1039 N LYS A 157 -1.526 -10.495 -4.608 1.00 0.09 N ATOM 1040 CA LYS A 157 -2.872 -10.871 -4.240 1.00 0.10 C ATOM 1041 C LYS A 157 -3.858 -9.706 -4.322 1.00 0.08 C ATOM 1042 O LYS A 157 -4.989 -9.879 -4.768 1.00 0.10 O ATOM 1043 CB LYS A 157 -2.866 -11.453 -2.828 1.00 0.12 C ATOM 1044 CG LYS A 157 -3.661 -12.744 -2.713 1.00 0.17 C ATOM 1045 CD LYS A 157 -5.112 -12.570 -3.155 1.00 0.21 C ATOM 1046 CE LYS A 157 -6.028 -12.119 -2.021 1.00 0.29 C ATOM 1047 NZ LYS A 157 -7.449 -12.046 -2.455 1.00 1.16 N ATOM 0 H LYS A 157 -0.906 -10.317 -3.818 1.00 0.09 H new ATOM 0 HA LYS A 157 -3.210 -11.618 -4.958 1.00 0.10 H new ATOM 0 HB2 LYS A 157 -1.836 -11.639 -2.522 1.00 0.12 H new ATOM 0 HB3 LYS A 157 -3.276 -10.717 -2.136 1.00 0.12 H new ATOM 0 HG2 LYS A 157 -3.188 -13.515 -3.321 1.00 0.17 H new ATOM 0 HG3 LYS A 157 -3.637 -13.093 -1.681 1.00 0.17 H new ATOM 0 HD2 LYS A 157 -5.155 -11.839 -3.963 1.00 0.21 H new ATOM 0 HD3 LYS A 157 -5.479 -13.514 -3.559 1.00 0.21 H new ATOM 0 HE2 LYS A 157 -5.939 -12.812 -1.184 1.00 0.29 H new ATOM 0 HE3 LYS A 157 -5.707 -11.141 -1.661 1.00 0.29 H new ATOM 0 HZ1 LYS A 157 -8.067 -12.039 -1.619 1.00 1.16 H new ATOM 0 HZ2 LYS A 157 -7.600 -11.176 -3.004 1.00 1.16 H new ATOM 0 HZ3 LYS A 157 -7.674 -12.872 -3.046 1.00 1.16 H new ATOM 1061 N MET A 158 -3.431 -8.524 -3.920 1.00 0.07 N ATOM 1062 CA MET A 158 -4.344 -7.387 -3.822 1.00 0.08 C ATOM 1063 C MET A 158 -4.357 -6.549 -5.087 1.00 0.09 C ATOM 1064 O MET A 158 -5.256 -5.733 -5.279 1.00 0.13 O ATOM 1065 CB MET A 158 -3.988 -6.506 -2.628 1.00 0.09 C ATOM 1066 CG MET A 158 -4.193 -7.191 -1.294 1.00 0.10 C ATOM 1067 SD MET A 158 -5.891 -7.754 -1.066 1.00 0.35 S ATOM 1068 CE MET A 158 -6.773 -6.211 -1.276 1.00 0.18 C ATOM 0 H MET A 158 -2.467 -8.321 -3.657 1.00 0.07 H new ATOM 0 HA MET A 158 -5.343 -7.800 -3.683 1.00 0.08 H new ATOM 0 HB2 MET A 158 -2.947 -6.196 -2.713 1.00 0.09 H new ATOM 0 HB3 MET A 158 -4.594 -5.601 -2.660 1.00 0.09 H new ATOM 0 HG2 MET A 158 -3.517 -8.043 -1.218 1.00 0.10 H new ATOM 0 HG3 MET A 158 -3.930 -6.503 -0.491 1.00 0.10 H new ATOM 0 HE1 MET A 158 -7.833 -6.368 -1.077 1.00 0.18 H new ATOM 0 HE2 MET A 158 -6.379 -5.469 -0.581 1.00 0.18 H new ATOM 0 HE3 MET A 158 -6.644 -5.855 -2.298 1.00 0.18 H new ATOM 1078 N ASN A 159 -3.369 -6.722 -5.948 1.00 0.09 N ATOM 1079 CA ASN A 159 -3.377 -5.996 -7.205 1.00 0.10 C ATOM 1080 C ASN A 159 -4.490 -6.561 -8.086 1.00 0.13 C ATOM 1081 O ASN A 159 -4.520 -7.764 -8.360 1.00 0.16 O ATOM 1082 CB ASN A 159 -2.025 -6.116 -7.912 1.00 0.14 C ATOM 1083 CG ASN A 159 -1.863 -5.145 -9.070 1.00 0.16 C ATOM 1084 OD1 ASN A 159 -2.828 -4.761 -9.730 1.00 0.44 O ATOM 1085 ND2 ASN A 159 -0.632 -4.730 -9.313 1.00 0.38 N ATOM 0 H ASN A 159 -2.571 -7.342 -5.806 1.00 0.09 H new ATOM 0 HA ASN A 159 -3.556 -4.938 -7.012 1.00 0.10 H new ATOM 0 HB2 ASN A 159 -1.228 -5.944 -7.189 1.00 0.14 H new ATOM 0 HB3 ASN A 159 -1.905 -7.134 -8.282 1.00 0.14 H new ATOM 0 HD21 ASN A 159 -0.457 -4.069 -10.070 1.00 0.38 H new ATOM 0 HD22 ASN A 159 0.143 -5.071 -8.744 1.00 0.38 H new ATOM 1092 N GLY A 160 -5.404 -5.706 -8.515 1.00 0.14 N ATOM 1093 CA GLY A 160 -6.529 -6.165 -9.309 1.00 0.19 C ATOM 1094 C GLY A 160 -7.658 -6.694 -8.442 1.00 0.22 C ATOM 1095 O GLY A 160 -8.590 -7.330 -8.933 1.00 0.29 O ATOM 0 H GLY A 160 -5.390 -4.703 -8.329 1.00 0.14 H new ATOM 0 HA2 GLY A 160 -6.898 -5.344 -9.924 1.00 0.19 H new ATOM 0 HA3 GLY A 160 -6.197 -6.949 -9.990 1.00 0.19 H new ATOM 1099 N MET A 161 -7.563 -6.436 -7.148 1.00 0.22 N ATOM 1100 CA MET A 161 -8.584 -6.849 -6.196 1.00 0.27 C ATOM 1101 C MET A 161 -9.577 -5.709 -6.015 1.00 0.24 C ATOM 1102 O MET A 161 -9.217 -4.542 -6.161 1.00 0.23 O ATOM 1103 CB MET A 161 -7.910 -7.180 -4.858 1.00 0.32 C ATOM 1104 CG MET A 161 -8.508 -8.321 -4.038 1.00 0.68 C ATOM 1105 SD MET A 161 -8.092 -9.979 -4.640 1.00 1.18 S ATOM 1106 CE MET A 161 -9.201 -10.193 -6.034 1.00 1.04 C ATOM 0 H MET A 161 -6.779 -5.936 -6.728 1.00 0.22 H new ATOM 0 HA MET A 161 -9.111 -7.731 -6.560 1.00 0.27 H new ATOM 0 HB2 MET A 161 -6.865 -7.418 -5.056 1.00 0.32 H new ATOM 0 HB3 MET A 161 -7.921 -6.280 -4.243 1.00 0.32 H new ATOM 0 HG2 MET A 161 -8.168 -8.227 -3.007 1.00 0.68 H new ATOM 0 HG3 MET A 161 -9.593 -8.214 -4.027 1.00 0.68 H new ATOM 0 HE1 MET A 161 -9.443 -11.250 -6.147 1.00 1.04 H new ATOM 0 HE2 MET A 161 -10.117 -9.628 -5.861 1.00 1.04 H new ATOM 0 HE3 MET A 161 -8.718 -9.832 -6.942 1.00 1.04 H new ATOM 1116 N LEU A 162 -10.816 -6.040 -5.709 1.00 0.26 N ATOM 1117 CA LEU A 162 -11.827 -5.037 -5.470 1.00 0.26 C ATOM 1118 C LEU A 162 -11.951 -4.814 -3.992 1.00 0.28 C ATOM 1119 O LEU A 162 -12.168 -5.758 -3.230 1.00 0.44 O ATOM 1120 CB LEU A 162 -13.199 -5.448 -6.009 1.00 0.31 C ATOM 1121 CG LEU A 162 -13.419 -5.293 -7.510 1.00 0.34 C ATOM 1122 CD1 LEU A 162 -14.830 -5.702 -7.856 1.00 0.42 C ATOM 1123 CD2 LEU A 162 -13.202 -3.860 -7.940 1.00 0.34 C ATOM 0 H LEU A 162 -11.145 -7.001 -5.620 1.00 0.26 H new ATOM 0 HA LEU A 162 -11.516 -4.131 -5.990 1.00 0.26 H new ATOM 0 HB2 LEU A 162 -13.369 -6.492 -5.746 1.00 0.31 H new ATOM 0 HB3 LEU A 162 -13.958 -4.861 -5.491 1.00 0.31 H new ATOM 0 HG LEU A 162 -12.703 -5.929 -8.031 1.00 0.34 H new ATOM 0 HD11 LEU A 162 -14.988 -5.591 -8.929 1.00 0.42 H new ATOM 0 HD12 LEU A 162 -14.987 -6.742 -7.571 1.00 0.42 H new ATOM 0 HD13 LEU A 162 -15.535 -5.068 -7.318 1.00 0.42 H new ATOM 0 HD21 LEU A 162 -13.364 -3.774 -9.014 1.00 0.34 H new ATOM 0 HD22 LEU A 162 -13.903 -3.212 -7.414 1.00 0.34 H new ATOM 0 HD23 LEU A 162 -12.182 -3.559 -7.702 1.00 0.34 H new ATOM 1135 N LEU A 163 -11.800 -3.589 -3.576 1.00 0.25 N ATOM 1136 CA LEU A 163 -12.036 -3.271 -2.202 1.00 0.33 C ATOM 1137 C LEU A 163 -13.296 -2.435 -2.076 1.00 0.45 C ATOM 1138 O LEU A 163 -13.291 -1.239 -2.371 1.00 1.02 O ATOM 1139 CB LEU A 163 -10.834 -2.569 -1.578 1.00 0.29 C ATOM 1140 CG LEU A 163 -9.685 -3.500 -1.185 1.00 0.31 C ATOM 1141 CD1 LEU A 163 -8.530 -2.710 -0.594 1.00 0.31 C ATOM 1142 CD2 LEU A 163 -10.176 -4.546 -0.194 1.00 0.34 C ATOM 0 H LEU A 163 -11.518 -2.804 -4.163 1.00 0.25 H new ATOM 0 HA LEU A 163 -12.180 -4.200 -1.650 1.00 0.33 H new ATOM 0 HB2 LEU A 163 -10.458 -1.827 -2.282 1.00 0.29 H new ATOM 0 HB3 LEU A 163 -11.166 -2.029 -0.691 1.00 0.29 H new ATOM 0 HG LEU A 163 -9.327 -4.005 -2.082 1.00 0.31 H new ATOM 0 HD11 LEU A 163 -7.724 -3.392 -0.322 1.00 0.31 H new ATOM 0 HD12 LEU A 163 -8.165 -1.993 -1.330 1.00 0.31 H new ATOM 0 HD13 LEU A 163 -8.870 -2.177 0.294 1.00 0.31 H new ATOM 0 HD21 LEU A 163 -9.351 -5.204 0.079 1.00 0.34 H new ATOM 0 HD22 LEU A 163 -10.557 -4.051 0.699 1.00 0.34 H new ATOM 0 HD23 LEU A 163 -10.973 -5.134 -0.650 1.00 0.34 H new ATOM 1154 N ASN A 164 -14.386 -3.111 -1.716 1.00 0.41 N ATOM 1155 CA ASN A 164 -15.684 -2.483 -1.465 1.00 0.42 C ATOM 1156 C ASN A 164 -16.430 -2.139 -2.745 1.00 0.45 C ATOM 1157 O ASN A 164 -17.662 -2.064 -2.749 1.00 0.72 O ATOM 1158 CB ASN A 164 -15.540 -1.250 -0.570 1.00 0.49 C ATOM 1159 CG ASN A 164 -15.458 -1.612 0.899 1.00 1.06 C ATOM 1160 OD1 ASN A 164 -15.981 -2.641 1.326 1.00 1.71 O ATOM 1161 ND2 ASN A 164 -14.828 -0.760 1.688 1.00 1.07 N ATOM 0 H ASN A 164 -14.393 -4.123 -1.589 1.00 0.41 H new ATOM 0 HA ASN A 164 -16.286 -3.223 -0.939 1.00 0.42 H new ATOM 0 HB2 ASN A 164 -14.645 -0.698 -0.856 1.00 0.49 H new ATOM 0 HB3 ASN A 164 -16.389 -0.586 -0.731 1.00 0.49 H new ATOM 0 HD21 ASN A 164 -14.762 -0.945 2.689 1.00 1.07 H new ATOM 0 HD22 ASN A 164 -14.407 0.082 1.296 1.00 1.07 H new ATOM 1168 N ASP A 165 -15.680 -1.993 -3.825 1.00 0.42 N ATOM 1169 CA ASP A 165 -16.227 -1.608 -5.136 1.00 0.44 C ATOM 1170 C ASP A 165 -15.129 -1.222 -6.125 1.00 0.43 C ATOM 1171 O ASP A 165 -15.326 -1.287 -7.337 1.00 0.65 O ATOM 1172 CB ASP A 165 -17.200 -0.430 -4.997 1.00 0.55 C ATOM 1173 CG ASP A 165 -17.779 0.021 -6.324 1.00 0.71 C ATOM 1174 OD1 ASP A 165 -18.583 -0.731 -6.913 1.00 0.82 O ATOM 1175 OD2 ASP A 165 -17.432 1.129 -6.782 1.00 0.85 O ATOM 0 H ASP A 165 -14.670 -2.136 -3.828 1.00 0.42 H new ATOM 0 HA ASP A 165 -16.753 -2.482 -5.520 1.00 0.44 H new ATOM 0 HB2 ASP A 165 -18.014 -0.715 -4.330 1.00 0.55 H new ATOM 0 HB3 ASP A 165 -16.683 0.408 -4.529 1.00 0.55 H new ATOM 1180 N ARG A 166 -13.971 -0.847 -5.613 1.00 0.32 N ATOM 1181 CA ARG A 166 -12.924 -0.272 -6.447 1.00 0.27 C ATOM 1182 C ARG A 166 -11.764 -1.230 -6.592 1.00 0.24 C ATOM 1183 O ARG A 166 -11.342 -1.862 -5.621 1.00 0.24 O ATOM 1184 CB ARG A 166 -12.428 1.050 -5.868 1.00 0.24 C ATOM 1185 CG ARG A 166 -13.495 2.123 -5.798 1.00 0.27 C ATOM 1186 CD ARG A 166 -12.909 3.462 -5.390 1.00 0.27 C ATOM 1187 NE ARG A 166 -13.947 4.475 -5.202 1.00 0.42 N ATOM 1188 CZ ARG A 166 -13.715 5.714 -4.771 1.00 0.58 C ATOM 1189 NH1 ARG A 166 -12.495 6.074 -4.388 1.00 0.96 N ATOM 1190 NH2 ARG A 166 -14.713 6.586 -4.698 1.00 0.70 N ATOM 0 H ARG A 166 -13.729 -0.929 -4.625 1.00 0.32 H new ATOM 0 HA ARG A 166 -13.354 -0.085 -7.431 1.00 0.27 H new ATOM 0 HB2 ARG A 166 -12.037 0.874 -4.866 1.00 0.24 H new ATOM 0 HB3 ARG A 166 -11.599 1.414 -6.475 1.00 0.24 H new ATOM 0 HG2 ARG A 166 -13.982 2.218 -6.769 1.00 0.27 H new ATOM 0 HG3 ARG A 166 -14.264 1.828 -5.084 1.00 0.27 H new ATOM 0 HD2 ARG A 166 -12.344 3.345 -4.465 1.00 0.27 H new ATOM 0 HD3 ARG A 166 -12.206 3.799 -6.152 1.00 0.27 H new ATOM 0 HE ARG A 166 -14.910 4.216 -5.415 1.00 0.42 H new ATOM 0 HH11 ARG A 166 -11.730 5.400 -4.423 1.00 0.96 H new ATOM 0 HH12 ARG A 166 -12.323 7.024 -4.059 1.00 0.96 H new ATOM 0 HH21 ARG A 166 -15.655 6.307 -4.972 1.00 0.70 H new ATOM 0 HH22 ARG A 166 -14.538 7.535 -4.368 1.00 0.70 H new ATOM 1204 N LYS A 167 -11.261 -1.340 -7.808 1.00 0.22 N ATOM 1205 CA LYS A 167 -10.163 -2.242 -8.100 1.00 0.20 C ATOM 1206 C LYS A 167 -8.849 -1.553 -7.788 1.00 0.17 C ATOM 1207 O LYS A 167 -8.517 -0.538 -8.398 1.00 0.22 O ATOM 1208 CB LYS A 167 -10.216 -2.669 -9.568 1.00 0.23 C ATOM 1209 CG LYS A 167 -9.854 -4.125 -9.790 1.00 0.40 C ATOM 1210 CD LYS A 167 -10.202 -4.576 -11.199 1.00 0.47 C ATOM 1211 CE LYS A 167 -10.191 -6.090 -11.305 1.00 0.53 C ATOM 1212 NZ LYS A 167 -10.448 -6.561 -12.690 1.00 1.00 N ATOM 0 H LYS A 167 -11.598 -0.812 -8.613 1.00 0.22 H new ATOM 0 HA LYS A 167 -10.247 -3.135 -7.481 1.00 0.20 H new ATOM 0 HB2 LYS A 167 -11.220 -2.490 -9.954 1.00 0.23 H new ATOM 0 HB3 LYS A 167 -9.536 -2.042 -10.145 1.00 0.23 H new ATOM 0 HG2 LYS A 167 -8.788 -4.267 -9.614 1.00 0.40 H new ATOM 0 HG3 LYS A 167 -10.382 -4.747 -9.067 1.00 0.40 H new ATOM 0 HD2 LYS A 167 -11.186 -4.196 -11.473 1.00 0.47 H new ATOM 0 HD3 LYS A 167 -9.488 -4.153 -11.906 1.00 0.47 H new ATOM 0 HE2 LYS A 167 -9.226 -6.468 -10.968 1.00 0.53 H new ATOM 0 HE3 LYS A 167 -10.946 -6.504 -10.637 1.00 0.53 H new ATOM 0 HZ1 LYS A 167 -10.431 -7.601 -12.712 1.00 1.00 H new ATOM 0 HZ2 LYS A 167 -11.380 -6.224 -13.004 1.00 1.00 H new ATOM 0 HZ3 LYS A 167 -9.713 -6.189 -13.325 1.00 1.00 H new ATOM 1226 N VAL A 168 -8.094 -2.111 -6.860 1.00 0.13 N ATOM 1227 CA VAL A 168 -6.910 -1.440 -6.360 1.00 0.12 C ATOM 1228 C VAL A 168 -5.643 -1.998 -6.979 1.00 0.11 C ATOM 1229 O VAL A 168 -5.559 -3.176 -7.332 1.00 0.13 O ATOM 1230 CB VAL A 168 -6.792 -1.525 -4.822 1.00 0.13 C ATOM 1231 CG1 VAL A 168 -7.835 -0.650 -4.149 1.00 0.17 C ATOM 1232 CG2 VAL A 168 -6.914 -2.964 -4.339 1.00 0.13 C ATOM 0 H VAL A 168 -8.278 -3.022 -6.440 1.00 0.13 H new ATOM 0 HA VAL A 168 -7.022 -0.394 -6.646 1.00 0.12 H new ATOM 0 HB VAL A 168 -5.804 -1.157 -4.546 1.00 0.13 H new ATOM 0 HG11 VAL A 168 -7.731 -0.727 -3.067 1.00 0.17 H new ATOM 0 HG12 VAL A 168 -7.692 0.387 -4.454 1.00 0.17 H new ATOM 0 HG13 VAL A 168 -8.831 -0.981 -4.442 1.00 0.17 H new ATOM 0 HG21 VAL A 168 -6.827 -2.992 -3.253 1.00 0.13 H new ATOM 0 HG22 VAL A 168 -7.882 -3.367 -4.636 1.00 0.13 H new ATOM 0 HG23 VAL A 168 -6.120 -3.565 -4.782 1.00 0.13 H new ATOM 1242 N PHE A 169 -4.669 -1.122 -7.122 1.00 0.11 N ATOM 1243 CA PHE A 169 -3.383 -1.475 -7.679 1.00 0.12 C ATOM 1244 C PHE A 169 -2.346 -1.509 -6.568 1.00 0.10 C ATOM 1245 O PHE A 169 -2.112 -0.500 -5.908 1.00 0.12 O ATOM 1246 CB PHE A 169 -2.997 -0.449 -8.751 1.00 0.18 C ATOM 1247 CG PHE A 169 -1.622 -0.636 -9.324 1.00 0.14 C ATOM 1248 CD1 PHE A 169 -0.527 -0.027 -8.737 1.00 0.18 C ATOM 1249 CD2 PHE A 169 -1.428 -1.415 -10.449 1.00 0.25 C ATOM 1250 CE1 PHE A 169 0.739 -0.195 -9.261 1.00 0.23 C ATOM 1251 CE2 PHE A 169 -0.164 -1.585 -10.980 1.00 0.30 C ATOM 1252 CZ PHE A 169 0.920 -0.974 -10.384 1.00 0.26 C ATOM 0 H PHE A 169 -4.750 -0.141 -6.853 1.00 0.11 H new ATOM 0 HA PHE A 169 -3.432 -2.461 -8.141 1.00 0.12 H new ATOM 0 HB2 PHE A 169 -3.724 -0.498 -9.561 1.00 0.18 H new ATOM 0 HB3 PHE A 169 -3.065 0.550 -8.321 1.00 0.18 H new ATOM 0 HD1 PHE A 169 -0.664 0.587 -7.859 1.00 0.18 H new ATOM 0 HD2 PHE A 169 -2.274 -1.896 -10.918 1.00 0.25 H new ATOM 0 HE1 PHE A 169 1.586 0.283 -8.792 1.00 0.23 H new ATOM 0 HE2 PHE A 169 -0.025 -2.195 -11.860 1.00 0.30 H new ATOM 0 HZ PHE A 169 1.909 -1.106 -10.797 1.00 0.26 H new ATOM 1262 N VAL A 170 -1.737 -2.662 -6.352 1.00 0.09 N ATOM 1263 CA VAL A 170 -0.702 -2.791 -5.339 1.00 0.10 C ATOM 1264 C VAL A 170 0.622 -3.128 -6.004 1.00 0.11 C ATOM 1265 O VAL A 170 0.711 -4.082 -6.775 1.00 0.13 O ATOM 1266 CB VAL A 170 -1.034 -3.885 -4.295 1.00 0.10 C ATOM 1267 CG1 VAL A 170 0.005 -3.904 -3.186 1.00 0.11 C ATOM 1268 CG2 VAL A 170 -2.424 -3.692 -3.714 1.00 0.09 C ATOM 0 H VAL A 170 -1.940 -3.521 -6.863 1.00 0.09 H new ATOM 0 HA VAL A 170 -0.640 -1.837 -4.816 1.00 0.10 H new ATOM 0 HB VAL A 170 -1.014 -4.847 -4.808 1.00 0.10 H new ATOM 0 HG11 VAL A 170 -0.248 -4.680 -2.464 1.00 0.11 H new ATOM 0 HG12 VAL A 170 0.987 -4.110 -3.611 1.00 0.11 H new ATOM 0 HG13 VAL A 170 0.022 -2.935 -2.687 1.00 0.11 H new ATOM 0 HG21 VAL A 170 -2.626 -4.477 -2.985 1.00 0.09 H new ATOM 0 HG22 VAL A 170 -2.483 -2.719 -3.226 1.00 0.09 H new ATOM 0 HG23 VAL A 170 -3.163 -3.742 -4.514 1.00 0.09 H new ATOM 1278 N GLY A 171 1.637 -2.331 -5.720 1.00 0.12 N ATOM 1279 CA GLY A 171 2.937 -2.551 -6.313 1.00 0.14 C ATOM 1280 C GLY A 171 4.064 -2.146 -5.390 1.00 0.14 C ATOM 1281 O GLY A 171 3.826 -1.769 -4.240 1.00 0.18 O ATOM 0 H GLY A 171 1.584 -1.533 -5.087 1.00 0.12 H new ATOM 0 HA2 GLY A 171 3.043 -3.605 -6.571 1.00 0.14 H new ATOM 0 HA3 GLY A 171 3.010 -1.986 -7.242 1.00 0.14 H new ATOM 1285 N ARG A 172 5.285 -2.223 -5.897 1.00 0.18 N ATOM 1286 CA ARG A 172 6.468 -1.847 -5.133 1.00 0.19 C ATOM 1287 C ARG A 172 6.409 -0.374 -4.747 1.00 0.22 C ATOM 1288 O ARG A 172 5.998 0.466 -5.552 1.00 0.36 O ATOM 1289 CB ARG A 172 7.735 -2.089 -5.957 1.00 0.23 C ATOM 1290 CG ARG A 172 8.000 -3.543 -6.318 1.00 0.32 C ATOM 1291 CD ARG A 172 8.477 -4.354 -5.122 1.00 0.39 C ATOM 1292 NE ARG A 172 9.138 -5.588 -5.544 1.00 1.03 N ATOM 1293 CZ ARG A 172 9.142 -6.715 -4.839 1.00 1.26 C ATOM 1294 NH1 ARG A 172 8.491 -6.784 -3.687 1.00 1.34 N ATOM 1295 NH2 ARG A 172 9.800 -7.776 -5.286 1.00 1.93 N ATOM 0 H ARG A 172 5.485 -2.546 -6.844 1.00 0.18 H new ATOM 0 HA ARG A 172 6.493 -2.460 -4.232 1.00 0.19 H new ATOM 0 HB2 ARG A 172 7.668 -1.508 -6.877 1.00 0.23 H new ATOM 0 HB3 ARG A 172 8.591 -1.707 -5.400 1.00 0.23 H new ATOM 0 HG2 ARG A 172 7.089 -3.989 -6.717 1.00 0.32 H new ATOM 0 HG3 ARG A 172 8.749 -3.589 -7.108 1.00 0.32 H new ATOM 0 HD2 ARG A 172 9.166 -3.756 -4.526 1.00 0.39 H new ATOM 0 HD3 ARG A 172 7.628 -4.595 -4.482 1.00 0.39 H new ATOM 0 HE ARG A 172 9.628 -5.584 -6.438 1.00 1.03 H new ATOM 0 HH11 ARG A 172 7.984 -5.970 -3.338 1.00 1.34 H new ATOM 0 HH12 ARG A 172 8.497 -7.651 -3.149 1.00 1.34 H new ATOM 0 HH21 ARG A 172 10.304 -7.728 -6.172 1.00 1.93 H new ATOM 0 HH22 ARG A 172 9.802 -8.640 -4.744 1.00 1.93 H new ATOM 1309 N PHE A 173 6.815 -0.060 -3.527 1.00 0.23 N ATOM 1310 CA PHE A 173 6.905 1.328 -3.106 1.00 0.29 C ATOM 1311 C PHE A 173 8.249 1.882 -3.540 1.00 0.80 C ATOM 1312 O PHE A 173 9.292 1.449 -3.054 1.00 1.44 O ATOM 1313 CB PHE A 173 6.753 1.460 -1.587 1.00 0.48 C ATOM 1314 CG PHE A 173 6.609 2.882 -1.107 1.00 0.42 C ATOM 1315 CD1 PHE A 173 7.670 3.765 -1.209 1.00 0.72 C ATOM 1316 CD2 PHE A 173 5.420 3.334 -0.553 1.00 0.35 C ATOM 1317 CE1 PHE A 173 7.547 5.068 -0.771 1.00 0.71 C ATOM 1318 CE2 PHE A 173 5.292 4.636 -0.111 1.00 0.37 C ATOM 1319 CZ PHE A 173 6.331 5.503 -0.221 1.00 0.42 C ATOM 0 H PHE A 173 7.085 -0.741 -2.817 1.00 0.23 H new ATOM 0 HA PHE A 173 6.095 1.891 -3.570 1.00 0.29 H new ATOM 0 HB2 PHE A 173 5.880 0.890 -1.268 1.00 0.48 H new ATOM 0 HB3 PHE A 173 7.621 1.011 -1.105 1.00 0.48 H new ATOM 0 HD1 PHE A 173 8.604 3.431 -1.636 1.00 0.72 H new ATOM 0 HD2 PHE A 173 4.582 2.658 -0.466 1.00 0.35 H new ATOM 0 HE1 PHE A 173 8.381 5.749 -0.851 1.00 0.71 H new ATOM 0 HE2 PHE A 173 4.361 4.966 0.324 1.00 0.37 H new ATOM 0 HZ PHE A 173 6.222 6.524 0.114 1.00 0.42 H new ATOM 1329 N LYS A 174 8.226 2.825 -4.460 1.00 1.17 N ATOM 1330 CA LYS A 174 9.453 3.407 -4.962 1.00 1.67 C ATOM 1331 C LYS A 174 9.322 4.908 -5.127 1.00 1.86 C ATOM 1332 O LYS A 174 8.281 5.416 -5.550 1.00 2.43 O ATOM 1333 CB LYS A 174 9.839 2.774 -6.301 1.00 2.20 C ATOM 1334 CG LYS A 174 8.727 2.806 -7.341 1.00 2.69 C ATOM 1335 CD LYS A 174 9.198 2.347 -8.722 1.00 3.30 C ATOM 1336 CE LYS A 174 9.511 0.851 -8.773 1.00 4.16 C ATOM 1337 NZ LYS A 174 10.811 0.518 -8.132 1.00 4.66 N ATOM 0 H LYS A 174 7.374 3.203 -4.874 1.00 1.17 H new ATOM 0 HA LYS A 174 10.236 3.206 -4.231 1.00 1.67 H new ATOM 0 HB2 LYS A 174 10.711 3.293 -6.699 1.00 2.20 H new ATOM 0 HB3 LYS A 174 10.134 1.739 -6.131 1.00 2.20 H new ATOM 0 HG2 LYS A 174 7.907 2.168 -7.010 1.00 2.69 H new ATOM 0 HG3 LYS A 174 8.333 3.819 -7.414 1.00 2.69 H new ATOM 0 HD2 LYS A 174 8.429 2.578 -9.459 1.00 3.30 H new ATOM 0 HD3 LYS A 174 10.088 2.910 -9.003 1.00 3.30 H new ATOM 0 HE2 LYS A 174 8.713 0.299 -8.276 1.00 4.16 H new ATOM 0 HE3 LYS A 174 9.527 0.522 -9.812 1.00 4.16 H new ATOM 0 HZ1 LYS A 174 11.254 -0.275 -8.638 1.00 4.66 H new ATOM 0 HZ2 LYS A 174 11.439 1.346 -8.169 1.00 4.66 H new ATOM 0 HZ3 LYS A 174 10.650 0.250 -7.140 1.00 4.66 H new ATOM 1351 N SER A 175 10.378 5.611 -4.769 1.00 2.06 N ATOM 1352 CA SER A 175 10.495 7.015 -5.092 1.00 2.52 C ATOM 1353 C SER A 175 10.906 7.111 -6.562 1.00 2.93 C ATOM 1354 O SER A 175 11.243 6.088 -7.166 1.00 3.60 O ATOM 1355 CB SER A 175 11.537 7.675 -4.180 1.00 3.15 C ATOM 1356 OG SER A 175 11.514 9.087 -4.295 1.00 3.52 O ATOM 0 H SER A 175 11.170 5.229 -4.252 1.00 2.06 H new ATOM 0 HA SER A 175 9.550 7.536 -4.936 1.00 2.52 H new ATOM 0 HB2 SER A 175 11.347 7.391 -3.145 1.00 3.15 H new ATOM 0 HB3 SER A 175 12.530 7.305 -4.435 1.00 3.15 H new ATOM 0 HG SER A 175 12.189 9.475 -3.699 1.00 3.52 H new ATOM 1362 N ARG A 176 10.879 8.302 -7.148 1.00 3.11 N ATOM 1363 CA ARG A 176 11.283 8.449 -8.545 1.00 3.87 C ATOM 1364 C ARG A 176 12.736 8.014 -8.711 1.00 4.29 C ATOM 1365 O ARG A 176 13.127 7.473 -9.747 1.00 4.77 O ATOM 1366 CB ARG A 176 11.078 9.882 -9.036 1.00 4.45 C ATOM 1367 CG ARG A 176 9.641 10.362 -8.901 1.00 4.94 C ATOM 1368 CD ARG A 176 9.384 11.613 -9.721 1.00 5.64 C ATOM 1369 NE ARG A 176 9.388 11.334 -11.155 1.00 6.15 N ATOM 1370 CZ ARG A 176 9.312 12.271 -12.099 1.00 6.90 C ATOM 1371 NH1 ARG A 176 9.265 13.555 -11.769 1.00 7.24 N ATOM 1372 NH2 ARG A 176 9.285 11.923 -13.377 1.00 7.60 N ATOM 0 H ARG A 176 10.588 9.166 -6.690 1.00 3.11 H new ATOM 0 HA ARG A 176 10.651 7.806 -9.158 1.00 3.87 H new ATOM 0 HB2 ARG A 176 11.731 10.549 -8.473 1.00 4.45 H new ATOM 0 HB3 ARG A 176 11.379 9.948 -10.081 1.00 4.45 H new ATOM 0 HG2 ARG A 176 8.962 9.572 -9.222 1.00 4.94 H new ATOM 0 HG3 ARG A 176 9.422 10.564 -7.852 1.00 4.94 H new ATOM 0 HD2 ARG A 176 8.423 12.042 -9.437 1.00 5.64 H new ATOM 0 HD3 ARG A 176 10.146 12.359 -9.494 1.00 5.64 H new ATOM 0 HE ARG A 176 9.453 10.360 -11.452 1.00 6.15 H new ATOM 0 HH11 ARG A 176 9.287 13.830 -10.787 1.00 7.24 H new ATOM 0 HH12 ARG A 176 9.207 14.267 -12.497 1.00 7.24 H new ATOM 0 HH21 ARG A 176 9.322 10.938 -13.638 1.00 7.60 H new ATOM 0 HH22 ARG A 176 9.227 12.640 -14.100 1.00 7.60 H new ATOM 1386 N LYS A 177 13.528 8.248 -7.676 1.00 4.61 N ATOM 1387 CA LYS A 177 14.863 7.675 -7.589 1.00 5.47 C ATOM 1388 C LYS A 177 14.898 6.591 -6.513 1.00 6.20 C ATOM 1389 O LYS A 177 15.159 6.878 -5.342 1.00 6.81 O ATOM 1390 CB LYS A 177 15.926 8.735 -7.270 1.00 5.99 C ATOM 1391 CG LYS A 177 16.204 9.703 -8.406 1.00 6.65 C ATOM 1392 CD LYS A 177 17.322 10.665 -8.031 1.00 7.44 C ATOM 1393 CE LYS A 177 17.803 11.477 -9.224 1.00 7.99 C ATOM 1394 NZ LYS A 177 16.725 12.315 -9.806 1.00 8.61 N ATOM 0 H LYS A 177 13.268 8.833 -6.882 1.00 4.61 H new ATOM 0 HA LYS A 177 15.094 7.246 -8.564 1.00 5.47 H new ATOM 0 HB2 LYS A 177 15.606 9.302 -6.396 1.00 5.99 H new ATOM 0 HB3 LYS A 177 16.855 8.232 -7.002 1.00 5.99 H new ATOM 0 HG2 LYS A 177 16.480 9.149 -9.303 1.00 6.65 H new ATOM 0 HG3 LYS A 177 15.299 10.263 -8.643 1.00 6.65 H new ATOM 0 HD2 LYS A 177 16.972 11.341 -7.251 1.00 7.44 H new ATOM 0 HD3 LYS A 177 18.158 10.103 -7.614 1.00 7.44 H new ATOM 0 HE2 LYS A 177 18.631 12.116 -8.916 1.00 7.99 H new ATOM 0 HE3 LYS A 177 18.189 10.802 -9.988 1.00 7.99 H new ATOM 0 HZ1 LYS A 177 17.112 12.888 -10.583 1.00 8.61 H new ATOM 0 HZ2 LYS A 177 15.968 11.702 -10.171 1.00 8.61 H new ATOM 0 HZ3 LYS A 177 16.339 12.943 -9.072 1.00 8.61 H new ATOM 1408 N GLU A 178 14.599 5.353 -6.894 1.00 6.45 N ATOM 1409 CA GLU A 178 14.702 4.242 -5.957 1.00 7.43 C ATOM 1410 C GLU A 178 16.162 3.825 -5.843 1.00 7.96 C ATOM 1411 O GLU A 178 16.642 2.970 -6.588 1.00 8.13 O ATOM 1412 CB GLU A 178 13.830 3.055 -6.391 1.00 7.79 C ATOM 1413 CG GLU A 178 13.901 1.861 -5.447 1.00 8.26 C ATOM 1414 CD GLU A 178 13.111 0.670 -5.953 1.00 8.30 C ATOM 1415 OE1 GLU A 178 11.901 0.585 -5.666 1.00 8.55 O ATOM 1416 OE2 GLU A 178 13.694 -0.184 -6.650 1.00 8.32 O ATOM 0 H GLU A 178 14.288 5.097 -7.831 1.00 6.45 H new ATOM 0 HA GLU A 178 14.336 4.567 -4.983 1.00 7.43 H new ATOM 0 HB2 GLU A 178 12.794 3.386 -6.466 1.00 7.79 H new ATOM 0 HB3 GLU A 178 14.136 2.737 -7.388 1.00 7.79 H new ATOM 0 HG2 GLU A 178 14.943 1.570 -5.312 1.00 8.26 H new ATOM 0 HG3 GLU A 178 13.523 2.154 -4.468 1.00 8.26 H new ATOM 1423 N ARG A 179 16.874 4.481 -4.945 1.00 8.49 N ATOM 1424 CA ARG A 179 18.292 4.242 -4.765 1.00 9.26 C ATOM 1425 C ARG A 179 18.624 4.138 -3.283 1.00 10.11 C ATOM 1426 O ARG A 179 18.117 4.917 -2.473 1.00 10.52 O ATOM 1427 CB ARG A 179 19.076 5.393 -5.406 1.00 9.63 C ATOM 1428 CG ARG A 179 20.578 5.387 -5.137 1.00 10.21 C ATOM 1429 CD ARG A 179 21.318 4.367 -5.990 1.00 10.71 C ATOM 1430 NE ARG A 179 22.766 4.505 -5.861 1.00 11.04 N ATOM 1431 CZ ARG A 179 23.646 3.945 -6.690 1.00 11.73 C ATOM 1432 NH1 ARG A 179 23.229 3.192 -7.702 1.00 12.15 N ATOM 1433 NH2 ARG A 179 24.947 4.125 -6.499 1.00 12.18 N ATOM 0 H ARG A 179 16.487 5.191 -4.323 1.00 8.49 H new ATOM 0 HA ARG A 179 18.568 3.302 -5.243 1.00 9.26 H new ATOM 0 HB2 ARG A 179 18.916 5.364 -6.484 1.00 9.63 H new ATOM 0 HB3 ARG A 179 18.663 6.336 -5.048 1.00 9.63 H new ATOM 0 HG2 ARG A 179 20.983 6.380 -5.331 1.00 10.21 H new ATOM 0 HG3 ARG A 179 20.754 5.171 -4.083 1.00 10.21 H new ATOM 0 HD2 ARG A 179 21.020 3.361 -5.695 1.00 10.71 H new ATOM 0 HD3 ARG A 179 21.032 4.490 -7.035 1.00 10.71 H new ATOM 0 HE ARG A 179 23.126 5.065 -5.088 1.00 11.04 H new ATOM 0 HH11 ARG A 179 22.231 3.040 -7.847 1.00 12.15 H new ATOM 0 HH12 ARG A 179 23.907 2.766 -8.334 1.00 12.15 H new ATOM 0 HH21 ARG A 179 25.274 4.692 -5.717 1.00 12.18 H new ATOM 0 HH22 ARG A 179 25.620 3.696 -7.134 1.00 12.18 H new ATOM 1447 N GLU A 180 19.454 3.169 -2.934 1.00 10.55 N ATOM 1448 CA GLU A 180 19.918 3.019 -1.564 1.00 11.52 C ATOM 1449 C GLU A 180 21.415 2.729 -1.558 1.00 12.20 C ATOM 1450 O GLU A 180 21.842 1.615 -1.875 1.00 12.70 O ATOM 1451 CB GLU A 180 19.151 1.897 -0.852 1.00 11.80 C ATOM 1452 CG GLU A 180 19.478 1.777 0.629 1.00 12.14 C ATOM 1453 CD GLU A 180 19.078 3.007 1.422 1.00 12.44 C ATOM 1454 OE1 GLU A 180 19.650 4.091 1.184 1.00 12.62 O ATOM 1455 OE2 GLU A 180 18.185 2.902 2.286 1.00 12.64 O ATOM 0 H GLU A 180 19.821 2.472 -3.582 1.00 10.55 H new ATOM 0 HA GLU A 180 19.733 3.948 -1.025 1.00 11.52 H new ATOM 0 HB2 GLU A 180 18.081 2.071 -0.966 1.00 11.80 H new ATOM 0 HB3 GLU A 180 19.373 0.949 -1.342 1.00 11.80 H new ATOM 0 HG2 GLU A 180 18.969 0.905 1.039 1.00 12.14 H new ATOM 0 HG3 GLU A 180 20.548 1.606 0.747 1.00 12.14 H new ATOM 1462 N ALA A 181 22.210 3.737 -1.221 1.00 12.41 N ATOM 1463 CA ALA A 181 23.661 3.599 -1.222 1.00 13.20 C ATOM 1464 C ALA A 181 24.136 2.849 0.015 1.00 13.42 C ATOM 1465 O ALA A 181 24.500 3.454 1.024 1.00 13.65 O ATOM 1466 CB ALA A 181 24.333 4.962 -1.311 1.00 13.56 C ATOM 0 H ALA A 181 21.874 4.659 -0.943 1.00 12.41 H new ATOM 0 HA ALA A 181 23.943 3.020 -2.101 1.00 13.20 H new ATOM 0 HB1 ALA A 181 25.416 4.835 -1.310 1.00 13.56 H new ATOM 0 HB2 ALA A 181 24.027 5.459 -2.231 1.00 13.56 H new ATOM 0 HB3 ALA A 181 24.039 5.569 -0.455 1.00 13.56 H new ATOM 1472 N GLU A 182 24.107 1.532 -0.064 1.00 13.52 N ATOM 1473 CA GLU A 182 24.527 0.692 1.039 1.00 13.92 C ATOM 1474 C GLU A 182 25.023 -0.639 0.494 1.00 14.43 C ATOM 1475 O GLU A 182 26.252 -0.810 0.359 1.00 15.05 O ATOM 1476 CB GLU A 182 23.363 0.471 2.009 1.00 13.77 C ATOM 1477 CG GLU A 182 23.796 -0.023 3.378 1.00 14.19 C ATOM 1478 CD GLU A 182 24.630 1.001 4.123 1.00 14.38 C ATOM 1479 OE1 GLU A 182 24.051 1.842 4.839 1.00 14.46 O ATOM 1480 OE2 GLU A 182 25.871 0.969 3.994 1.00 14.58 O ATOM 1481 OXT GLU A 182 24.177 -1.490 0.145 1.00 14.36 O ATOM 0 H GLU A 182 23.794 1.019 -0.888 1.00 13.52 H new ATOM 0 HA GLU A 182 25.335 1.182 1.582 1.00 13.92 H new ATOM 0 HB2 GLU A 182 22.816 1.407 2.126 1.00 13.77 H new ATOM 0 HB3 GLU A 182 22.671 -0.250 1.574 1.00 13.77 H new ATOM 0 HG2 GLU A 182 22.914 -0.269 3.969 1.00 14.19 H new ATOM 0 HG3 GLU A 182 24.370 -0.943 3.265 1.00 14.19 H new TER 1488 GLU A 182