USER MOD reduce.3.24.130724 H: found=0, std=0, add=740, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 741 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 125 LYS NZ :NH3+ -108:sc= 0 (180deg=-0.0485) USER MOD Set 1.2: A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 TYR OH : rot 150:sc= -0.0529 USER MOD Single : A 98 GLN : amide:sc= -0.034 K(o=-0.034,f=-1.9!) USER MOD Single : A 105 CYS SG : rot 41:sc= -2.49! USER MOD Single : A 107 ASN : amide:sc= -4.79! C(o=-4.8!,f=-4.7!) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 LYS NZ :NH3+ -112:sc= 0 (180deg=-0.127) USER MOD Single : A 122 SER OG : rot 28:sc= 0.217 USER MOD Single : A 126 MET CE :methyl -160:sc= -1.11 (180deg=-2.08) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 179:sc= -1.54 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 144 SER OG : rot 160:sc= -1.41 USER MOD Single : A 149 LYS NZ :NH3+ 138:sc= 0.589 (180deg=-0.0832) USER MOD Single : A 150 ASN : amide:sc= -2.26! K(o=-2.3!,f=-0.52) USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 157 SER OG : rot -97:sc= 1.14 USER MOD Single : A 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 THR OG1 : rot 118:sc= 1.17 USER MOD Single : A 168 CYS SG : rot 180:sc= 0 USER MOD Single : A 171 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 11 N ALA A 90 8.758 9.196 9.502 1.00 0.96 N ATOM 12 CA ALA A 90 7.820 8.242 8.836 1.00 0.72 C ATOM 13 C ALA A 90 6.727 7.867 9.835 1.00 0.58 C ATOM 14 O ALA A 90 6.742 8.357 10.945 1.00 1.23 O ATOM 15 CB ALA A 90 8.683 7.029 8.475 1.00 1.03 C ATOM 0 HA ALA A 90 7.333 8.651 7.951 1.00 0.72 H new ATOM 0 HB1 ALA A 90 8.067 6.278 7.980 1.00 1.03 H new ATOM 0 HB2 ALA A 90 9.485 7.339 7.805 1.00 1.03 H new ATOM 0 HB3 ALA A 90 9.112 6.605 9.383 1.00 1.03 H new ATOM 21 N PRO A 91 5.804 7.016 9.438 1.00 0.79 N ATOM 22 CA PRO A 91 4.722 6.627 10.372 1.00 1.10 C ATOM 23 C PRO A 91 5.328 5.899 11.581 1.00 0.60 C ATOM 24 O PRO A 91 5.811 4.791 11.449 1.00 0.91 O ATOM 25 CB PRO A 91 3.830 5.710 9.531 1.00 1.98 C ATOM 26 CG PRO A 91 4.725 5.204 8.453 1.00 2.18 C ATOM 27 CD PRO A 91 5.667 6.335 8.140 1.00 1.62 C ATOM 0 HA PRO A 91 4.160 7.467 10.779 1.00 1.10 H new ATOM 0 HB2 PRO A 91 3.427 4.892 10.128 1.00 1.98 H new ATOM 0 HB3 PRO A 91 2.980 6.253 9.118 1.00 1.98 H new ATOM 0 HG2 PRO A 91 5.271 4.319 8.781 1.00 2.18 H new ATOM 0 HG3 PRO A 91 4.152 4.917 7.571 1.00 2.18 H new ATOM 0 HD2 PRO A 91 6.626 5.972 7.771 1.00 1.62 H new ATOM 0 HD3 PRO A 91 5.262 6.999 7.376 1.00 1.62 H new ATOM 35 N PRO A 92 5.302 6.545 12.730 1.00 0.59 N ATOM 36 CA PRO A 92 5.882 5.925 13.947 1.00 0.84 C ATOM 37 C PRO A 92 5.131 4.626 14.279 1.00 0.71 C ATOM 38 O PRO A 92 5.732 3.624 14.626 1.00 0.83 O ATOM 39 CB PRO A 92 5.705 7.007 15.021 1.00 1.49 C ATOM 40 CG PRO A 92 4.586 7.855 14.519 1.00 1.64 C ATOM 41 CD PRO A 92 4.736 7.874 13.022 1.00 1.21 C ATOM 0 HA PRO A 92 6.927 5.633 13.846 1.00 0.84 H new ATOM 0 HB2 PRO A 92 5.466 6.569 15.990 1.00 1.49 H new ATOM 0 HB3 PRO A 92 6.617 7.590 15.151 1.00 1.49 H new ATOM 0 HG2 PRO A 92 3.620 7.443 14.811 1.00 1.64 H new ATOM 0 HG3 PRO A 92 4.641 8.862 14.932 1.00 1.64 H new ATOM 0 HD2 PRO A 92 3.779 8.024 12.522 1.00 1.21 H new ATOM 0 HD3 PRO A 92 5.397 8.676 12.693 1.00 1.21 H new ATOM 49 N GLY A 93 3.825 4.632 14.156 1.00 0.65 N ATOM 50 CA GLY A 93 3.041 3.386 14.437 1.00 0.71 C ATOM 51 C GLY A 93 2.909 2.523 13.178 1.00 0.58 C ATOM 52 O GLY A 93 1.820 2.130 12.802 1.00 0.58 O ATOM 0 H GLY A 93 3.270 5.440 13.875 1.00 0.65 H new ATOM 0 HA2 GLY A 93 3.531 2.814 15.224 1.00 0.71 H new ATOM 0 HA3 GLY A 93 2.050 3.651 14.806 1.00 0.71 H new ATOM 56 N GLU A 94 4.000 2.229 12.524 1.00 0.56 N ATOM 57 CA GLU A 94 3.933 1.387 11.284 1.00 0.55 C ATOM 58 C GLU A 94 3.506 -0.044 11.614 1.00 0.49 C ATOM 59 O GLU A 94 3.153 -0.801 10.729 1.00 0.53 O ATOM 60 CB GLU A 94 5.342 1.401 10.711 1.00 0.66 C ATOM 61 CG GLU A 94 5.322 0.785 9.313 1.00 1.09 C ATOM 62 CD GLU A 94 6.743 0.757 8.734 1.00 1.10 C ATOM 63 OE1 GLU A 94 7.628 1.361 9.323 1.00 1.62 O ATOM 64 OE2 GLU A 94 6.926 0.121 7.709 1.00 1.44 O ATOM 0 H GLU A 94 4.936 2.533 12.791 1.00 0.56 H new ATOM 0 HA GLU A 94 3.199 1.775 10.578 1.00 0.55 H new ATOM 0 HB2 GLU A 94 5.719 2.423 10.666 1.00 0.66 H new ATOM 0 HB3 GLU A 94 6.016 0.841 11.359 1.00 0.66 H new ATOM 0 HG2 GLU A 94 4.918 -0.226 9.358 1.00 1.09 H new ATOM 0 HG3 GLU A 94 4.666 1.362 8.661 1.00 1.09 H new ATOM 71 N ALA A 95 3.519 -0.428 12.871 1.00 0.49 N ATOM 72 CA ALA A 95 3.095 -1.817 13.221 1.00 0.50 C ATOM 73 C ALA A 95 1.661 -2.035 12.737 1.00 0.38 C ATOM 74 O ALA A 95 1.344 -3.060 12.163 1.00 0.36 O ATOM 75 CB ALA A 95 3.193 -1.905 14.748 1.00 0.61 C ATOM 0 H ALA A 95 3.802 0.155 13.659 1.00 0.49 H new ATOM 0 HA ALA A 95 3.714 -2.583 12.754 1.00 0.50 H new ATOM 0 HB1 ALA A 95 2.895 -2.901 15.075 1.00 0.61 H new ATOM 0 HB2 ALA A 95 4.220 -1.713 15.058 1.00 0.61 H new ATOM 0 HB3 ALA A 95 2.533 -1.163 15.198 1.00 0.61 H new ATOM 81 N TYR A 96 0.804 -1.061 12.924 1.00 0.38 N ATOM 82 CA TYR A 96 -0.588 -1.203 12.422 1.00 0.35 C ATOM 83 C TYR A 96 -0.564 -1.206 10.887 1.00 0.28 C ATOM 84 O TYR A 96 -1.256 -1.973 10.246 1.00 0.29 O ATOM 85 CB TYR A 96 -1.358 0.001 12.980 1.00 0.42 C ATOM 86 CG TYR A 96 -2.845 -0.203 12.782 1.00 0.73 C ATOM 87 CD1 TYR A 96 -3.448 -1.417 13.149 1.00 1.54 C ATOM 88 CD2 TYR A 96 -3.624 0.823 12.233 1.00 1.47 C ATOM 89 CE1 TYR A 96 -4.820 -1.602 12.965 1.00 1.93 C ATOM 90 CE2 TYR A 96 -5.000 0.636 12.050 1.00 1.85 C ATOM 91 CZ TYR A 96 -5.597 -0.577 12.416 1.00 1.77 C ATOM 92 OH TYR A 96 -6.953 -0.762 12.236 1.00 2.32 O ATOM 0 H TYR A 96 1.011 -0.182 13.399 1.00 0.38 H new ATOM 0 HA TYR A 96 -1.064 -2.131 12.738 1.00 0.35 H new ATOM 0 HB2 TYR A 96 -1.137 0.126 14.040 1.00 0.42 H new ATOM 0 HB3 TYR A 96 -1.037 0.914 12.478 1.00 0.42 H new ATOM 0 HD1 TYR A 96 -2.850 -2.209 13.574 1.00 1.54 H new ATOM 0 HD2 TYR A 96 -3.164 1.758 11.951 1.00 1.47 H new ATOM 0 HE1 TYR A 96 -5.281 -2.537 13.247 1.00 1.93 H new ATOM 0 HE2 TYR A 96 -5.601 1.427 11.627 1.00 1.85 H new ATOM 0 HH TYR A 96 -7.414 0.099 12.315 1.00 2.32 H new ATOM 102 N LEU A 97 0.252 -0.358 10.297 1.00 0.42 N ATOM 103 CA LEU A 97 0.353 -0.306 8.800 1.00 0.55 C ATOM 104 C LEU A 97 0.808 -1.648 8.243 1.00 0.43 C ATOM 105 O LEU A 97 0.259 -2.148 7.282 1.00 0.35 O ATOM 106 CB LEU A 97 1.412 0.754 8.499 1.00 0.90 C ATOM 107 CG LEU A 97 0.738 2.104 8.297 1.00 0.94 C ATOM 108 CD1 LEU A 97 0.141 2.584 9.621 1.00 1.33 C ATOM 109 CD2 LEU A 97 1.771 3.120 7.805 1.00 1.75 C ATOM 0 H LEU A 97 0.854 0.302 10.790 1.00 0.42 H new ATOM 0 HA LEU A 97 -0.611 -0.074 8.347 1.00 0.55 H new ATOM 0 HB2 LEU A 97 2.127 0.812 9.320 1.00 0.90 H new ATOM 0 HB3 LEU A 97 1.973 0.479 7.606 1.00 0.90 H new ATOM 0 HG LEU A 97 -0.057 2.005 7.558 1.00 0.94 H new ATOM 0 HD11 LEU A 97 -0.341 3.551 9.474 1.00 1.33 H new ATOM 0 HD12 LEU A 97 -0.596 1.861 9.971 1.00 1.33 H new ATOM 0 HD13 LEU A 97 0.933 2.683 10.363 1.00 1.33 H new ATOM 0 HD21 LEU A 97 1.290 4.087 7.660 1.00 1.75 H new ATOM 0 HD22 LEU A 97 2.566 3.218 8.544 1.00 1.75 H new ATOM 0 HD23 LEU A 97 2.194 2.780 6.860 1.00 1.75 H new ATOM 121 N GLN A 98 1.814 -2.228 8.833 1.00 0.47 N ATOM 122 CA GLN A 98 2.317 -3.543 8.326 1.00 0.49 C ATOM 123 C GLN A 98 1.224 -4.599 8.428 1.00 0.38 C ATOM 124 O GLN A 98 1.086 -5.436 7.560 1.00 0.39 O ATOM 125 CB GLN A 98 3.499 -3.905 9.221 1.00 0.63 C ATOM 126 CG GLN A 98 4.696 -3.016 8.880 1.00 0.57 C ATOM 127 CD GLN A 98 5.789 -3.198 9.939 1.00 1.24 C ATOM 128 OE1 GLN A 98 5.549 -3.760 10.989 1.00 2.00 O ATOM 129 NE2 GLN A 98 6.988 -2.736 9.713 1.00 2.04 N ATOM 0 H GLN A 98 2.311 -1.854 9.641 1.00 0.47 H new ATOM 0 HA GLN A 98 2.612 -3.488 7.278 1.00 0.49 H new ATOM 0 HB2 GLN A 98 3.226 -3.778 10.269 1.00 0.63 H new ATOM 0 HB3 GLN A 98 3.762 -4.954 9.085 1.00 0.63 H new ATOM 0 HG2 GLN A 98 5.084 -3.273 7.894 1.00 0.57 H new ATOM 0 HG3 GLN A 98 4.386 -1.972 8.838 1.00 0.57 H new ATOM 0 HE21 GLN A 98 7.195 -2.263 8.833 1.00 2.04 H new ATOM 0 HE22 GLN A 98 7.718 -2.847 10.416 1.00 2.04 H new ATOM 138 N VAL A 99 0.445 -4.573 9.479 1.00 0.33 N ATOM 139 CA VAL A 99 -0.639 -5.590 9.619 1.00 0.31 C ATOM 140 C VAL A 99 -1.618 -5.450 8.452 1.00 0.24 C ATOM 141 O VAL A 99 -1.927 -6.418 7.779 1.00 0.30 O ATOM 142 CB VAL A 99 -1.316 -5.278 10.968 1.00 0.32 C ATOM 143 CG1 VAL A 99 -2.580 -6.131 11.139 1.00 0.43 C ATOM 144 CG2 VAL A 99 -0.339 -5.584 12.108 1.00 0.43 C ATOM 0 H VAL A 99 0.512 -3.897 10.240 1.00 0.33 H new ATOM 0 HA VAL A 99 -0.268 -6.615 9.599 1.00 0.31 H new ATOM 0 HB VAL A 99 -1.594 -4.224 10.990 1.00 0.32 H new ATOM 0 HG11 VAL A 99 -3.048 -5.900 12.096 1.00 0.43 H new ATOM 0 HG12 VAL A 99 -3.279 -5.912 10.331 1.00 0.43 H new ATOM 0 HG13 VAL A 99 -2.313 -7.187 11.111 1.00 0.43 H new ATOM 0 HG21 VAL A 99 -0.815 -5.364 13.064 1.00 0.43 H new ATOM 0 HG22 VAL A 99 -0.060 -6.637 12.075 1.00 0.43 H new ATOM 0 HG23 VAL A 99 0.554 -4.968 11.997 1.00 0.43 H new ATOM 154 N ALA A 100 -2.080 -4.255 8.185 1.00 0.18 N ATOM 155 CA ALA A 100 -3.009 -4.066 7.039 1.00 0.18 C ATOM 156 C ALA A 100 -2.224 -4.235 5.744 1.00 0.14 C ATOM 157 O ALA A 100 -2.596 -5.005 4.891 1.00 0.14 O ATOM 158 CB ALA A 100 -3.555 -2.642 7.170 1.00 0.24 C ATOM 0 H ALA A 100 -1.854 -3.410 8.709 1.00 0.18 H new ATOM 0 HA ALA A 100 -3.826 -4.788 7.033 1.00 0.18 H new ATOM 0 HB1 ALA A 100 -4.247 -2.441 6.353 1.00 0.24 H new ATOM 0 HB2 ALA A 100 -4.077 -2.539 8.121 1.00 0.24 H new ATOM 0 HB3 ALA A 100 -2.730 -1.931 7.130 1.00 0.24 H new ATOM 164 N PHE A 101 -1.123 -3.533 5.609 1.00 0.15 N ATOM 165 CA PHE A 101 -0.288 -3.653 4.373 1.00 0.16 C ATOM 166 C PHE A 101 0.113 -5.108 4.127 1.00 0.17 C ATOM 167 O PHE A 101 0.467 -5.457 3.033 1.00 0.20 O ATOM 168 CB PHE A 101 0.976 -2.816 4.655 1.00 0.19 C ATOM 169 CG PHE A 101 0.700 -1.309 4.737 1.00 0.25 C ATOM 170 CD1 PHE A 101 -0.586 -0.762 4.535 1.00 1.21 C ATOM 171 CD2 PHE A 101 1.768 -0.452 5.042 1.00 1.10 C ATOM 172 CE1 PHE A 101 -0.783 0.621 4.638 1.00 1.26 C ATOM 173 CE2 PHE A 101 1.564 0.928 5.144 1.00 1.10 C ATOM 174 CZ PHE A 101 0.291 1.465 4.944 1.00 0.43 C ATOM 0 H PHE A 101 -0.766 -2.879 6.306 1.00 0.15 H new ATOM 0 HA PHE A 101 -0.832 -3.312 3.492 1.00 0.16 H new ATOM 0 HB2 PHE A 101 1.422 -3.148 5.593 1.00 0.19 H new ATOM 0 HB3 PHE A 101 1.709 -3.002 3.870 1.00 0.19 H new ATOM 0 HD1 PHE A 101 -1.418 -1.410 4.301 1.00 1.21 H new ATOM 0 HD2 PHE A 101 2.755 -0.861 5.199 1.00 1.10 H new ATOM 0 HE1 PHE A 101 -1.767 1.038 4.481 1.00 1.26 H new ATOM 0 HE2 PHE A 101 2.393 1.579 5.378 1.00 1.10 H new ATOM 0 HZ PHE A 101 0.135 2.531 5.025 1.00 0.43 H new ATOM 184 N ASP A 102 0.076 -5.956 5.124 1.00 0.18 N ATOM 185 CA ASP A 102 0.485 -7.378 4.899 1.00 0.21 C ATOM 186 C ASP A 102 -0.671 -8.211 4.351 1.00 0.20 C ATOM 187 O ASP A 102 -0.525 -8.887 3.349 1.00 0.22 O ATOM 188 CB ASP A 102 0.919 -7.883 6.266 1.00 0.25 C ATOM 189 CG ASP A 102 1.360 -9.347 6.175 1.00 0.32 C ATOM 190 OD1 ASP A 102 0.503 -10.191 5.970 1.00 1.13 O ATOM 191 OD2 ASP A 102 2.546 -9.597 6.313 1.00 1.01 O ATOM 0 H ASP A 102 -0.216 -5.730 6.075 1.00 0.18 H new ATOM 0 HA ASP A 102 1.283 -7.455 4.160 1.00 0.21 H new ATOM 0 HB2 ASP A 102 1.739 -7.272 6.644 1.00 0.25 H new ATOM 0 HB3 ASP A 102 0.097 -7.787 6.975 1.00 0.25 H new ATOM 196 N ILE A 103 -1.817 -8.181 4.994 1.00 0.18 N ATOM 197 CA ILE A 103 -2.959 -8.993 4.483 1.00 0.18 C ATOM 198 C ILE A 103 -3.341 -8.512 3.089 1.00 0.17 C ATOM 199 O ILE A 103 -3.584 -9.295 2.186 1.00 0.18 O ATOM 200 CB ILE A 103 -4.123 -8.785 5.477 1.00 0.18 C ATOM 201 CG1 ILE A 103 -4.504 -7.295 5.594 1.00 0.94 C ATOM 202 CG2 ILE A 103 -3.721 -9.316 6.851 1.00 0.94 C ATOM 203 CD1 ILE A 103 -5.670 -7.122 6.574 1.00 0.87 C ATOM 0 H ILE A 103 -2.005 -7.637 5.836 1.00 0.18 H new ATOM 0 HA ILE A 103 -2.705 -10.050 4.408 1.00 0.18 H new ATOM 0 HB ILE A 103 -4.990 -9.330 5.103 1.00 0.18 H new ATOM 0 HG12 ILE A 103 -3.644 -6.718 5.935 1.00 0.94 H new ATOM 0 HG13 ILE A 103 -4.782 -6.905 4.615 1.00 0.94 H new ATOM 0 HG21 ILE A 103 -4.542 -9.169 7.552 1.00 0.94 H new ATOM 0 HG22 ILE A 103 -3.492 -10.379 6.778 1.00 0.94 H new ATOM 0 HG23 ILE A 103 -2.841 -8.779 7.205 1.00 0.94 H new ATOM 0 HD11 ILE A 103 -5.930 -6.066 6.648 1.00 0.87 H new ATOM 0 HD12 ILE A 103 -6.533 -7.684 6.216 1.00 0.87 H new ATOM 0 HD13 ILE A 103 -5.378 -7.493 7.556 1.00 0.87 H new ATOM 215 N VAL A 104 -3.384 -7.226 2.914 1.00 0.16 N ATOM 216 CA VAL A 104 -3.760 -6.666 1.594 1.00 0.16 C ATOM 217 C VAL A 104 -2.665 -6.924 0.552 1.00 0.17 C ATOM 218 O VAL A 104 -2.949 -7.188 -0.602 1.00 0.18 O ATOM 219 CB VAL A 104 -3.984 -5.169 1.834 1.00 0.16 C ATOM 220 CG1 VAL A 104 -5.030 -4.961 2.937 1.00 0.18 C ATOM 221 CG2 VAL A 104 -2.668 -4.481 2.225 1.00 0.14 C ATOM 0 H VAL A 104 -3.173 -6.534 3.634 1.00 0.16 H new ATOM 0 HA VAL A 104 -4.657 -7.137 1.193 1.00 0.16 H new ATOM 0 HB VAL A 104 -4.348 -4.723 0.908 1.00 0.16 H new ATOM 0 HG11 VAL A 104 -5.181 -3.894 3.099 1.00 0.18 H new ATOM 0 HG12 VAL A 104 -5.972 -5.419 2.636 1.00 0.18 H new ATOM 0 HG13 VAL A 104 -4.681 -5.422 3.861 1.00 0.18 H new ATOM 0 HG21 VAL A 104 -2.848 -3.419 2.391 1.00 0.14 H new ATOM 0 HG22 VAL A 104 -2.280 -4.931 3.139 1.00 0.14 H new ATOM 0 HG23 VAL A 104 -1.940 -4.605 1.423 1.00 0.14 H new ATOM 231 N CYS A 105 -1.420 -6.838 0.949 1.00 0.18 N ATOM 232 CA CYS A 105 -0.300 -7.065 -0.024 1.00 0.19 C ATOM 233 C CYS A 105 -0.367 -8.467 -0.590 1.00 0.20 C ATOM 234 O CYS A 105 -0.370 -8.656 -1.788 1.00 0.21 O ATOM 235 CB CYS A 105 0.978 -6.850 0.792 1.00 0.22 C ATOM 236 SG CYS A 105 2.454 -7.324 -0.152 1.00 0.29 S ATOM 0 H CYS A 105 -1.128 -6.621 1.902 1.00 0.18 H new ATOM 0 HA CYS A 105 -0.347 -6.392 -0.880 1.00 0.19 H new ATOM 0 HB2 CYS A 105 1.052 -5.803 1.085 1.00 0.22 H new ATOM 0 HB3 CYS A 105 0.928 -7.435 1.710 1.00 0.22 H new ATOM 0 HG CYS A 105 2.329 -6.924 -1.383 1.00 0.29 H new ATOM 242 N ASP A 106 -0.441 -9.444 0.256 1.00 0.21 N ATOM 243 CA ASP A 106 -0.524 -10.839 -0.253 1.00 0.24 C ATOM 244 C ASP A 106 -1.858 -11.023 -1.002 1.00 0.25 C ATOM 245 O ASP A 106 -2.044 -11.989 -1.720 1.00 0.28 O ATOM 246 CB ASP A 106 -0.465 -11.725 0.983 1.00 0.25 C ATOM 247 CG ASP A 106 0.864 -11.513 1.712 1.00 0.27 C ATOM 248 OD1 ASP A 106 1.855 -11.265 1.043 1.00 1.05 O ATOM 249 OD2 ASP A 106 0.868 -11.602 2.928 1.00 1.05 O ATOM 0 H ASP A 106 -0.448 -9.344 1.271 1.00 0.21 H new ATOM 0 HA ASP A 106 0.278 -11.085 -0.948 1.00 0.24 H new ATOM 0 HB2 ASP A 106 -1.296 -11.492 1.648 1.00 0.25 H new ATOM 0 HB3 ASP A 106 -0.570 -12.771 0.697 1.00 0.25 H new ATOM 254 N ASN A 107 -2.784 -10.093 -0.849 1.00 0.24 N ATOM 255 CA ASN A 107 -4.092 -10.202 -1.557 1.00 0.26 C ATOM 256 C ASN A 107 -4.001 -9.532 -2.929 1.00 0.26 C ATOM 257 O ASN A 107 -4.509 -10.039 -3.910 1.00 0.29 O ATOM 258 CB ASN A 107 -5.070 -9.417 -0.681 1.00 0.25 C ATOM 259 CG ASN A 107 -6.472 -10.015 -0.816 1.00 0.29 C ATOM 260 OD1 ASN A 107 -7.370 -9.376 -1.327 1.00 1.02 O ATOM 261 ND2 ASN A 107 -6.697 -11.226 -0.385 1.00 1.23 N ATOM 0 H ASN A 107 -2.681 -9.266 -0.261 1.00 0.24 H new ATOM 0 HA ASN A 107 -4.393 -11.239 -1.709 1.00 0.26 H new ATOM 0 HB2 ASN A 107 -4.748 -9.449 0.360 1.00 0.25 H new ATOM 0 HB3 ASN A 107 -5.080 -8.369 -0.979 1.00 0.25 H new ATOM 0 HD21 ASN A 107 -7.627 -11.636 -0.477 1.00 1.23 H new ATOM 0 HD22 ASN A 107 -5.943 -11.763 0.044 1.00 1.23 H new ATOM 268 N VAL A 108 -3.367 -8.389 -2.997 1.00 0.23 N ATOM 269 CA VAL A 108 -3.250 -7.674 -4.298 1.00 0.24 C ATOM 270 C VAL A 108 -2.144 -6.618 -4.230 1.00 0.25 C ATOM 271 O VAL A 108 -2.292 -5.519 -4.719 1.00 0.42 O ATOM 272 CB VAL A 108 -4.637 -7.054 -4.504 1.00 0.23 C ATOM 273 CG1 VAL A 108 -4.892 -5.913 -3.511 1.00 0.27 C ATOM 274 CG2 VAL A 108 -4.755 -6.538 -5.940 1.00 0.27 C ATOM 0 H VAL A 108 -2.926 -7.922 -2.205 1.00 0.23 H new ATOM 0 HA VAL A 108 -2.974 -8.324 -5.128 1.00 0.24 H new ATOM 0 HB VAL A 108 -5.389 -7.823 -4.326 1.00 0.23 H new ATOM 0 HG11 VAL A 108 -5.884 -5.495 -3.684 1.00 0.27 H new ATOM 0 HG12 VAL A 108 -4.832 -6.297 -2.493 1.00 0.27 H new ATOM 0 HG13 VAL A 108 -4.141 -5.135 -3.650 1.00 0.27 H new ATOM 0 HG21 VAL A 108 -5.741 -6.097 -6.088 1.00 0.27 H new ATOM 0 HG22 VAL A 108 -3.989 -5.784 -6.120 1.00 0.27 H new ATOM 0 HG23 VAL A 108 -4.619 -7.366 -6.636 1.00 0.27 H new ATOM 284 N GLY A 109 -1.062 -6.961 -3.579 1.00 0.24 N ATOM 285 CA GLY A 109 0.103 -6.037 -3.379 1.00 0.22 C ATOM 286 C GLY A 109 0.325 -5.108 -4.590 1.00 0.23 C ATOM 287 O GLY A 109 0.622 -3.939 -4.435 1.00 0.21 O ATOM 0 H GLY A 109 -0.931 -7.882 -3.160 1.00 0.24 H new ATOM 0 HA2 GLY A 109 -0.063 -5.434 -2.486 1.00 0.22 H new ATOM 0 HA3 GLY A 109 1.004 -6.624 -3.204 1.00 0.22 H new ATOM 291 N ARG A 110 0.177 -5.617 -5.790 1.00 0.27 N ATOM 292 CA ARG A 110 0.383 -4.763 -7.009 1.00 0.28 C ATOM 293 C ARG A 110 -0.518 -3.515 -6.982 1.00 0.27 C ATOM 294 O ARG A 110 -0.287 -2.563 -7.709 1.00 0.27 O ATOM 295 CB ARG A 110 0.036 -5.660 -8.204 1.00 0.36 C ATOM 296 CG ARG A 110 1.324 -6.193 -8.846 1.00 0.55 C ATOM 297 CD ARG A 110 1.671 -7.565 -8.262 1.00 0.72 C ATOM 298 NE ARG A 110 1.065 -8.546 -9.205 1.00 1.08 N ATOM 299 CZ ARG A 110 0.023 -9.240 -8.843 1.00 1.39 C ATOM 300 NH1 ARG A 110 0.066 -9.960 -7.756 1.00 2.06 N ATOM 301 NH2 ARG A 110 -1.063 -9.213 -9.566 1.00 1.68 N ATOM 0 H ARG A 110 -0.077 -6.586 -5.981 1.00 0.27 H new ATOM 0 HA ARG A 110 1.407 -4.393 -7.063 1.00 0.28 H new ATOM 0 HB2 ARG A 110 -0.589 -6.491 -7.877 1.00 0.36 H new ATOM 0 HB3 ARG A 110 -0.541 -5.097 -8.938 1.00 0.36 H new ATOM 0 HG2 ARG A 110 1.197 -6.270 -9.926 1.00 0.55 H new ATOM 0 HG3 ARG A 110 2.143 -5.496 -8.670 1.00 0.55 H new ATOM 0 HD2 ARG A 110 2.750 -7.702 -8.188 1.00 0.72 H new ATOM 0 HD3 ARG A 110 1.266 -7.681 -7.257 1.00 0.72 H new ATOM 0 HE ARG A 110 1.466 -8.675 -10.134 1.00 1.08 H new ATOM 0 HH11 ARG A 110 0.915 -9.979 -7.190 1.00 2.06 H new ATOM 0 HH12 ARG A 110 -0.749 -10.504 -7.472 1.00 2.06 H new ATOM 0 HH21 ARG A 110 -1.097 -8.649 -10.415 1.00 1.68 H new ATOM 0 HH22 ARG A 110 -1.878 -9.756 -9.282 1.00 1.68 H new ATOM 315 N ASP A 111 -1.531 -3.503 -6.153 1.00 0.27 N ATOM 316 CA ASP A 111 -2.429 -2.313 -6.080 1.00 0.30 C ATOM 317 C ASP A 111 -1.698 -1.132 -5.411 1.00 0.31 C ATOM 318 O ASP A 111 -2.124 0.004 -5.515 1.00 0.39 O ATOM 319 CB ASP A 111 -3.614 -2.767 -5.213 1.00 0.30 C ATOM 320 CG ASP A 111 -4.721 -3.375 -6.088 1.00 0.30 C ATOM 321 OD1 ASP A 111 -4.656 -3.229 -7.300 1.00 0.93 O ATOM 322 OD2 ASP A 111 -5.624 -3.974 -5.527 1.00 0.82 O ATOM 0 H ASP A 111 -1.774 -4.268 -5.523 1.00 0.27 H new ATOM 0 HA ASP A 111 -2.746 -1.974 -7.066 1.00 0.30 H new ATOM 0 HB2 ASP A 111 -3.276 -3.501 -4.482 1.00 0.30 H new ATOM 0 HB3 ASP A 111 -4.009 -1.919 -4.654 1.00 0.30 H new ATOM 327 N TRP A 112 -0.606 -1.386 -4.727 1.00 0.27 N ATOM 328 CA TRP A 112 0.141 -0.268 -4.055 1.00 0.29 C ATOM 329 C TRP A 112 1.062 0.416 -5.053 1.00 0.32 C ATOM 330 O TRP A 112 1.000 1.613 -5.233 1.00 0.31 O ATOM 331 CB TRP A 112 0.943 -0.909 -2.915 1.00 0.29 C ATOM 332 CG TRP A 112 0.040 -1.818 -2.157 1.00 0.25 C ATOM 333 CD1 TRP A 112 0.337 -3.083 -1.810 1.00 0.23 C ATOM 334 CD2 TRP A 112 -1.325 -1.572 -1.710 1.00 0.25 C ATOM 335 NE1 TRP A 112 -0.751 -3.629 -1.166 1.00 0.20 N ATOM 336 CE2 TRP A 112 -1.797 -2.740 -1.084 1.00 0.20 C ATOM 337 CE3 TRP A 112 -2.194 -0.462 -1.778 1.00 0.31 C ATOM 338 CZ2 TRP A 112 -3.073 -2.818 -0.554 1.00 0.20 C ATOM 339 CZ3 TRP A 112 -3.489 -0.541 -1.239 1.00 0.32 C ATOM 340 CH2 TRP A 112 -3.927 -1.724 -0.630 1.00 0.27 C ATOM 0 H TRP A 112 -0.200 -2.314 -4.604 1.00 0.27 H new ATOM 0 HA TRP A 112 -0.536 0.494 -3.669 1.00 0.29 H new ATOM 0 HB2 TRP A 112 1.792 -1.464 -3.314 1.00 0.29 H new ATOM 0 HB3 TRP A 112 1.347 -0.140 -2.256 1.00 0.29 H new ATOM 0 HD1 TRP A 112 1.273 -3.587 -2.004 1.00 0.23 H new ATOM 0 HE1 TRP A 112 -0.778 -4.579 -0.795 1.00 0.20 H new ATOM 0 HE3 TRP A 112 -1.862 0.453 -2.247 1.00 0.31 H new ATOM 0 HZ2 TRP A 112 -3.406 -3.730 -0.081 1.00 0.20 H new ATOM 0 HZ3 TRP A 112 -4.148 0.312 -1.294 1.00 0.32 H new ATOM 0 HH2 TRP A 112 -4.925 -1.786 -0.221 1.00 0.27 H new ATOM 351 N LYS A 113 1.909 -0.331 -5.716 1.00 0.37 N ATOM 352 CA LYS A 113 2.830 0.291 -6.725 1.00 0.40 C ATOM 353 C LYS A 113 2.013 1.082 -7.761 1.00 0.34 C ATOM 354 O LYS A 113 2.396 2.174 -8.140 1.00 0.30 O ATOM 355 CB LYS A 113 3.618 -0.856 -7.382 1.00 0.50 C ATOM 356 CG LYS A 113 2.680 -1.958 -7.884 1.00 0.72 C ATOM 357 CD LYS A 113 2.295 -1.685 -9.341 1.00 0.89 C ATOM 358 CE LYS A 113 3.190 -2.501 -10.276 1.00 1.51 C ATOM 359 NZ LYS A 113 2.547 -2.388 -11.614 1.00 1.66 N ATOM 0 H LYS A 113 2.005 -1.340 -5.605 1.00 0.37 H new ATOM 0 HA LYS A 113 3.519 0.995 -6.258 1.00 0.40 H new ATOM 0 HB2 LYS A 113 4.205 -0.467 -8.214 1.00 0.50 H new ATOM 0 HB3 LYS A 113 4.323 -1.274 -6.663 1.00 0.50 H new ATOM 0 HG2 LYS A 113 3.168 -2.929 -7.803 1.00 0.72 H new ATOM 0 HG3 LYS A 113 1.785 -1.998 -7.263 1.00 0.72 H new ATOM 0 HD2 LYS A 113 1.249 -1.945 -9.505 1.00 0.89 H new ATOM 0 HD3 LYS A 113 2.397 -0.622 -9.561 1.00 0.89 H new ATOM 0 HE2 LYS A 113 4.207 -2.109 -10.292 1.00 1.51 H new ATOM 0 HE3 LYS A 113 3.254 -3.541 -9.955 1.00 1.51 H new ATOM 0 HZ1 LYS A 113 3.102 -2.922 -12.312 1.00 1.66 H new ATOM 0 HZ2 LYS A 113 1.583 -2.775 -11.570 1.00 1.66 H new ATOM 0 HZ3 LYS A 113 2.506 -1.388 -11.896 1.00 1.66 H new ATOM 373 N ARG A 114 0.876 0.568 -8.197 1.00 0.35 N ATOM 374 CA ARG A 114 0.048 1.358 -9.173 1.00 0.33 C ATOM 375 C ARG A 114 -0.466 2.624 -8.469 1.00 0.28 C ATOM 376 O ARG A 114 -0.471 3.709 -9.037 1.00 0.29 O ATOM 377 CB ARG A 114 -1.116 0.461 -9.644 1.00 0.37 C ATOM 378 CG ARG A 114 -1.840 -0.191 -8.458 1.00 0.38 C ATOM 379 CD ARG A 114 -3.287 0.323 -8.364 1.00 0.43 C ATOM 380 NE ARG A 114 -3.914 -0.050 -9.664 1.00 0.57 N ATOM 381 CZ ARG A 114 -5.048 0.486 -10.019 1.00 1.04 C ATOM 382 NH1 ARG A 114 -6.166 0.040 -9.516 1.00 1.77 N ATOM 383 NH2 ARG A 114 -5.066 1.467 -10.879 1.00 1.62 N ATOM 0 H ARG A 114 0.496 -0.339 -7.927 1.00 0.35 H new ATOM 0 HA ARG A 114 0.631 1.664 -10.041 1.00 0.33 H new ATOM 0 HB2 ARG A 114 -1.824 1.055 -10.221 1.00 0.37 H new ATOM 0 HB3 ARG A 114 -0.734 -0.314 -10.309 1.00 0.37 H new ATOM 0 HG2 ARG A 114 -1.839 -1.275 -8.575 1.00 0.38 H new ATOM 0 HG3 ARG A 114 -1.308 0.030 -7.533 1.00 0.38 H new ATOM 0 HD2 ARG A 114 -3.814 -0.133 -7.526 1.00 0.43 H new ATOM 0 HD3 ARG A 114 -3.313 1.401 -8.208 1.00 0.43 H new ATOM 0 HE ARG A 114 -3.455 -0.725 -10.276 1.00 0.57 H new ATOM 0 HH11 ARG A 114 -6.153 -0.728 -8.845 1.00 1.77 H new ATOM 0 HH12 ARG A 114 -7.053 0.459 -9.794 1.00 1.77 H new ATOM 0 HH21 ARG A 114 -4.192 1.815 -11.274 1.00 1.62 H new ATOM 0 HH22 ARG A 114 -5.954 1.886 -11.156 1.00 1.62 H new ATOM 397 N LEU A 115 -0.846 2.510 -7.215 1.00 0.26 N ATOM 398 CA LEU A 115 -1.297 3.716 -6.466 1.00 0.25 C ATOM 399 C LEU A 115 -0.079 4.594 -6.181 1.00 0.25 C ATOM 400 O LEU A 115 -0.186 5.795 -6.053 1.00 0.26 O ATOM 401 CB LEU A 115 -1.928 3.205 -5.169 1.00 0.26 C ATOM 402 CG LEU A 115 -3.267 2.538 -5.486 1.00 0.25 C ATOM 403 CD1 LEU A 115 -3.786 1.816 -4.241 1.00 0.32 C ATOM 404 CD2 LEU A 115 -4.275 3.608 -5.911 1.00 0.23 C ATOM 0 H LEU A 115 -0.861 1.638 -6.687 1.00 0.26 H new ATOM 0 HA LEU A 115 -2.018 4.313 -7.024 1.00 0.25 H new ATOM 0 HB2 LEU A 115 -1.261 2.494 -4.682 1.00 0.26 H new ATOM 0 HB3 LEU A 115 -2.076 4.031 -4.473 1.00 0.26 H new ATOM 0 HG LEU A 115 -3.134 1.818 -6.293 1.00 0.25 H new ATOM 0 HD11 LEU A 115 -4.740 1.341 -4.467 1.00 0.32 H new ATOM 0 HD12 LEU A 115 -3.066 1.057 -3.934 1.00 0.32 H new ATOM 0 HD13 LEU A 115 -3.921 2.535 -3.433 1.00 0.32 H new ATOM 0 HD21 LEU A 115 -5.231 3.137 -6.138 1.00 0.23 H new ATOM 0 HD22 LEU A 115 -4.407 4.326 -5.101 1.00 0.23 H new ATOM 0 HD23 LEU A 115 -3.906 4.125 -6.797 1.00 0.23 H new ATOM 416 N ALA A 116 1.092 3.998 -6.113 1.00 0.26 N ATOM 417 CA ALA A 116 2.331 4.793 -5.870 1.00 0.28 C ATOM 418 C ALA A 116 2.474 5.805 -7.009 1.00 0.26 C ATOM 419 O ALA A 116 2.774 6.971 -6.801 1.00 0.27 O ATOM 420 CB ALA A 116 3.471 3.770 -5.899 1.00 0.31 C ATOM 0 H ALA A 116 1.237 2.994 -6.216 1.00 0.26 H new ATOM 0 HA ALA A 116 2.324 5.342 -4.928 1.00 0.28 H new ATOM 0 HB1 ALA A 116 4.420 4.278 -5.727 1.00 0.31 H new ATOM 0 HB2 ALA A 116 3.312 3.025 -5.119 1.00 0.31 H new ATOM 0 HB3 ALA A 116 3.493 3.278 -6.871 1.00 0.31 H new ATOM 426 N ARG A 117 2.198 5.367 -8.215 1.00 0.27 N ATOM 427 CA ARG A 117 2.252 6.292 -9.386 1.00 0.30 C ATOM 428 C ARG A 117 1.240 7.417 -9.146 1.00 0.32 C ATOM 429 O ARG A 117 1.510 8.578 -9.386 1.00 0.33 O ATOM 430 CB ARG A 117 1.834 5.437 -10.586 1.00 0.35 C ATOM 431 CG ARG A 117 2.915 4.392 -10.871 1.00 0.37 C ATOM 432 CD ARG A 117 2.476 3.508 -12.042 1.00 1.31 C ATOM 433 NE ARG A 117 3.581 2.523 -12.230 1.00 1.53 N ATOM 434 CZ ARG A 117 3.454 1.561 -13.104 1.00 1.93 C ATOM 435 NH1 ARG A 117 2.340 0.886 -13.173 1.00 2.61 N ATOM 436 NH2 ARG A 117 4.441 1.276 -13.908 1.00 2.24 N ATOM 0 H ARG A 117 1.937 4.406 -8.436 1.00 0.27 H new ATOM 0 HA ARG A 117 3.233 6.740 -9.545 1.00 0.30 H new ATOM 0 HB2 ARG A 117 0.883 4.945 -10.382 1.00 0.35 H new ATOM 0 HB3 ARG A 117 1.684 6.069 -11.462 1.00 0.35 H new ATOM 0 HG2 ARG A 117 3.858 4.884 -11.107 1.00 0.37 H new ATOM 0 HG3 ARG A 117 3.087 3.781 -9.985 1.00 0.37 H new ATOM 0 HD2 ARG A 117 1.534 3.005 -11.823 1.00 1.31 H new ATOM 0 HD3 ARG A 117 2.319 4.100 -12.944 1.00 1.31 H new ATOM 0 HE ARG A 117 4.434 2.601 -11.677 1.00 1.53 H new ATOM 0 HH11 ARG A 117 1.568 1.110 -12.544 1.00 2.61 H new ATOM 0 HH12 ARG A 117 2.240 0.135 -13.856 1.00 2.61 H new ATOM 0 HH21 ARG A 117 5.312 1.804 -13.854 1.00 2.24 H new ATOM 0 HH22 ARG A 117 4.342 0.525 -14.591 1.00 2.24 H new ATOM 450 N GLU A 118 0.079 7.064 -8.638 1.00 0.34 N ATOM 451 CA GLU A 118 -0.958 8.099 -8.334 1.00 0.39 C ATOM 452 C GLU A 118 -0.462 9.004 -7.196 1.00 0.39 C ATOM 453 O GLU A 118 -0.715 10.193 -7.179 1.00 0.41 O ATOM 454 CB GLU A 118 -2.207 7.321 -7.909 1.00 0.43 C ATOM 455 CG GLU A 118 -2.795 6.596 -9.122 1.00 0.47 C ATOM 456 CD GLU A 118 -3.374 7.621 -10.098 1.00 0.53 C ATOM 457 OE1 GLU A 118 -4.277 8.341 -9.704 1.00 0.76 O ATOM 458 OE2 GLU A 118 -2.901 7.674 -11.221 1.00 1.45 O ATOM 0 H GLU A 118 -0.192 6.105 -8.422 1.00 0.34 H new ATOM 0 HA GLU A 118 -1.168 8.740 -9.190 1.00 0.39 H new ATOM 0 HB2 GLU A 118 -1.953 6.602 -7.130 1.00 0.43 H new ATOM 0 HB3 GLU A 118 -2.946 8.002 -7.486 1.00 0.43 H new ATOM 0 HG2 GLU A 118 -2.023 6.005 -9.615 1.00 0.47 H new ATOM 0 HG3 GLU A 118 -3.573 5.902 -8.803 1.00 0.47 H new ATOM 465 N LEU A 119 0.255 8.441 -6.250 1.00 0.37 N ATOM 466 CA LEU A 119 0.790 9.255 -5.109 1.00 0.38 C ATOM 467 C LEU A 119 1.971 10.124 -5.570 1.00 0.36 C ATOM 468 O LEU A 119 2.472 10.939 -4.823 1.00 0.39 O ATOM 469 CB LEU A 119 1.251 8.234 -4.073 1.00 0.38 C ATOM 470 CG LEU A 119 0.045 7.423 -3.595 1.00 0.56 C ATOM 471 CD1 LEU A 119 0.521 6.104 -2.989 1.00 1.33 C ATOM 472 CD2 LEU A 119 -0.714 8.220 -2.533 1.00 0.58 C ATOM 0 H LEU A 119 0.493 7.450 -6.219 1.00 0.37 H new ATOM 0 HA LEU A 119 0.039 9.935 -4.708 1.00 0.38 H new ATOM 0 HB2 LEU A 119 2.001 7.572 -4.506 1.00 0.38 H new ATOM 0 HB3 LEU A 119 1.721 8.740 -3.230 1.00 0.38 H new ATOM 0 HG LEU A 119 -0.611 7.219 -4.441 1.00 0.56 H new ATOM 0 HD11 LEU A 119 -0.340 5.528 -2.649 1.00 1.33 H new ATOM 0 HD12 LEU A 119 1.065 5.533 -3.741 1.00 1.33 H new ATOM 0 HD13 LEU A 119 1.178 6.308 -2.143 1.00 1.33 H new ATOM 0 HD21 LEU A 119 -1.574 7.644 -2.191 1.00 0.58 H new ATOM 0 HD22 LEU A 119 -0.054 8.422 -1.689 1.00 0.58 H new ATOM 0 HD23 LEU A 119 -1.056 9.163 -2.961 1.00 0.58 H new ATOM 484 N LYS A 120 2.415 9.963 -6.802 1.00 0.34 N ATOM 485 CA LYS A 120 3.558 10.782 -7.338 1.00 0.35 C ATOM 486 C LYS A 120 4.855 10.441 -6.604 1.00 0.30 C ATOM 487 O LYS A 120 5.585 11.315 -6.174 1.00 0.33 O ATOM 488 CB LYS A 120 3.185 12.257 -7.117 1.00 0.48 C ATOM 489 CG LYS A 120 4.031 13.149 -8.029 1.00 1.05 C ATOM 490 CD LYS A 120 3.556 12.997 -9.475 1.00 1.11 C ATOM 491 CE LYS A 120 4.165 14.107 -10.337 1.00 2.02 C ATOM 492 NZ LYS A 120 3.291 15.292 -10.112 1.00 2.16 N ATOM 0 H LYS A 120 2.029 9.291 -7.465 1.00 0.34 H new ATOM 0 HA LYS A 120 3.724 10.575 -8.395 1.00 0.35 H new ATOM 0 HB2 LYS A 120 2.126 12.409 -7.326 1.00 0.48 H new ATOM 0 HB3 LYS A 120 3.347 12.530 -6.074 1.00 0.48 H new ATOM 0 HG2 LYS A 120 3.949 14.190 -7.716 1.00 1.05 H new ATOM 0 HG3 LYS A 120 5.083 12.874 -7.950 1.00 1.05 H new ATOM 0 HD2 LYS A 120 3.847 12.021 -9.863 1.00 1.11 H new ATOM 0 HD3 LYS A 120 2.468 13.046 -9.518 1.00 1.11 H new ATOM 0 HE2 LYS A 120 5.194 14.314 -10.044 1.00 2.02 H new ATOM 0 HE3 LYS A 120 4.184 13.824 -11.390 1.00 2.02 H new ATOM 0 HZ1 LYS A 120 2.772 15.511 -10.986 1.00 2.16 H new ATOM 0 HZ2 LYS A 120 2.614 15.085 -9.350 1.00 2.16 H new ATOM 0 HZ3 LYS A 120 3.876 16.109 -9.843 1.00 2.16 H new ATOM 506 N VAL A 121 5.149 9.176 -6.477 1.00 0.29 N ATOM 507 CA VAL A 121 6.410 8.758 -5.786 1.00 0.33 C ATOM 508 C VAL A 121 7.620 9.048 -6.686 1.00 0.37 C ATOM 509 O VAL A 121 7.494 9.185 -7.888 1.00 0.42 O ATOM 510 CB VAL A 121 6.269 7.251 -5.540 1.00 0.36 C ATOM 511 CG1 VAL A 121 5.090 6.993 -4.597 1.00 1.65 C ATOM 512 CG2 VAL A 121 6.037 6.518 -6.873 1.00 1.29 C ATOM 0 H VAL A 121 4.571 8.409 -6.822 1.00 0.29 H new ATOM 0 HA VAL A 121 6.564 9.300 -4.853 1.00 0.33 H new ATOM 0 HB VAL A 121 7.186 6.877 -5.085 1.00 0.36 H new ATOM 0 HG11 VAL A 121 4.991 5.922 -4.423 1.00 1.65 H new ATOM 0 HG12 VAL A 121 5.265 7.500 -3.648 1.00 1.65 H new ATOM 0 HG13 VAL A 121 4.173 7.374 -5.048 1.00 1.65 H new ATOM 0 HG21 VAL A 121 5.938 5.448 -6.688 1.00 1.29 H new ATOM 0 HG22 VAL A 121 5.125 6.891 -7.340 1.00 1.29 H new ATOM 0 HG23 VAL A 121 6.883 6.694 -7.537 1.00 1.29 H new ATOM 522 N SER A 122 8.787 9.164 -6.104 1.00 0.45 N ATOM 523 CA SER A 122 10.017 9.474 -6.909 1.00 0.52 C ATOM 524 C SER A 122 10.231 8.465 -8.037 1.00 0.44 C ATOM 525 O SER A 122 10.234 7.267 -7.833 1.00 0.35 O ATOM 526 CB SER A 122 11.172 9.384 -5.916 1.00 0.63 C ATOM 527 OG SER A 122 11.163 8.099 -5.306 1.00 1.10 O ATOM 0 H SER A 122 8.945 9.058 -5.102 1.00 0.45 H new ATOM 0 HA SER A 122 9.934 10.452 -7.383 1.00 0.52 H new ATOM 0 HB2 SER A 122 12.120 9.551 -6.426 1.00 0.63 H new ATOM 0 HB3 SER A 122 11.077 10.161 -5.157 1.00 0.63 H new ATOM 0 HG SER A 122 10.763 7.448 -5.920 1.00 1.10 H new ATOM 533 N GLU A 123 10.443 8.965 -9.226 1.00 0.55 N ATOM 534 CA GLU A 123 10.700 8.076 -10.398 1.00 0.58 C ATOM 535 C GLU A 123 11.954 7.224 -10.146 1.00 0.52 C ATOM 536 O GLU A 123 12.085 6.133 -10.667 1.00 0.53 O ATOM 537 CB GLU A 123 10.909 9.022 -11.589 1.00 0.77 C ATOM 538 CG GLU A 123 11.202 8.206 -12.856 1.00 1.44 C ATOM 539 CD GLU A 123 11.463 9.142 -14.046 1.00 1.61 C ATOM 540 OE1 GLU A 123 11.127 10.314 -13.953 1.00 1.75 O ATOM 541 OE2 GLU A 123 11.993 8.665 -15.036 1.00 2.15 O ATOM 0 H GLU A 123 10.449 9.963 -9.437 1.00 0.55 H new ATOM 0 HA GLU A 123 9.878 7.384 -10.580 1.00 0.58 H new ATOM 0 HB2 GLU A 123 10.021 9.636 -11.738 1.00 0.77 H new ATOM 0 HB3 GLU A 123 11.736 9.702 -11.384 1.00 0.77 H new ATOM 0 HG2 GLU A 123 12.069 7.566 -12.692 1.00 1.44 H new ATOM 0 HG3 GLU A 123 10.359 7.551 -13.078 1.00 1.44 H new ATOM 548 N ALA A 124 12.886 7.729 -9.369 1.00 0.50 N ATOM 549 CA ALA A 124 14.148 6.956 -9.099 1.00 0.50 C ATOM 550 C ALA A 124 13.821 5.581 -8.504 1.00 0.39 C ATOM 551 O ALA A 124 14.249 4.555 -9.009 1.00 0.45 O ATOM 552 CB ALA A 124 14.930 7.800 -8.091 1.00 0.56 C ATOM 0 H ALA A 124 12.830 8.639 -8.911 1.00 0.50 H new ATOM 0 HA ALA A 124 14.717 6.778 -10.012 1.00 0.50 H new ATOM 0 HB1 ALA A 124 15.866 7.298 -7.845 1.00 0.56 H new ATOM 0 HB2 ALA A 124 15.145 8.777 -8.524 1.00 0.56 H new ATOM 0 HB3 ALA A 124 14.337 7.927 -7.185 1.00 0.56 H new ATOM 558 N LYS A 125 13.048 5.556 -7.448 1.00 0.31 N ATOM 559 CA LYS A 125 12.667 4.251 -6.825 1.00 0.34 C ATOM 560 C LYS A 125 11.911 3.392 -7.839 1.00 0.34 C ATOM 561 O LYS A 125 12.123 2.200 -7.936 1.00 0.39 O ATOM 562 CB LYS A 125 11.769 4.618 -5.641 1.00 0.42 C ATOM 563 CG LYS A 125 12.611 5.271 -4.539 1.00 0.54 C ATOM 564 CD LYS A 125 11.711 5.641 -3.356 1.00 0.75 C ATOM 565 CE LYS A 125 12.555 6.265 -2.239 1.00 0.75 C ATOM 566 NZ LYS A 125 13.123 5.106 -1.494 1.00 1.56 N ATOM 0 H LYS A 125 12.664 6.383 -6.990 1.00 0.31 H new ATOM 0 HA LYS A 125 13.534 3.673 -6.504 1.00 0.34 H new ATOM 0 HB2 LYS A 125 10.984 5.301 -5.965 1.00 0.42 H new ATOM 0 HB3 LYS A 125 11.276 3.726 -5.255 1.00 0.42 H new ATOM 0 HG2 LYS A 125 13.395 4.587 -4.213 1.00 0.54 H new ATOM 0 HG3 LYS A 125 13.106 6.162 -4.925 1.00 0.54 H new ATOM 0 HD2 LYS A 125 10.941 6.342 -3.678 1.00 0.75 H new ATOM 0 HD3 LYS A 125 11.199 4.753 -2.985 1.00 0.75 H new ATOM 0 HE2 LYS A 125 13.344 6.898 -2.646 1.00 0.75 H new ATOM 0 HE3 LYS A 125 11.947 6.893 -1.588 1.00 0.75 H new ATOM 0 HZ1 LYS A 125 12.654 5.024 -0.569 1.00 1.56 H new ATOM 0 HZ2 LYS A 125 12.969 4.234 -2.039 1.00 1.56 H new ATOM 0 HZ3 LYS A 125 14.143 5.250 -1.353 1.00 1.56 H new ATOM 580 N MET A 126 11.051 4.002 -8.615 1.00 0.42 N ATOM 581 CA MET A 126 10.289 3.234 -9.644 1.00 0.56 C ATOM 582 C MET A 126 11.271 2.576 -10.628 1.00 0.57 C ATOM 583 O MET A 126 11.056 1.470 -11.090 1.00 0.66 O ATOM 584 CB MET A 126 9.389 4.265 -10.335 1.00 0.70 C ATOM 585 CG MET A 126 8.397 4.831 -9.310 1.00 1.10 C ATOM 586 SD MET A 126 7.249 3.533 -8.785 1.00 1.90 S ATOM 587 CE MET A 126 6.185 3.556 -10.248 1.00 2.03 C ATOM 0 H MET A 126 10.844 5.000 -8.580 1.00 0.42 H new ATOM 0 HA MET A 126 9.692 2.428 -9.218 1.00 0.56 H new ATOM 0 HB2 MET A 126 9.993 5.068 -10.758 1.00 0.70 H new ATOM 0 HB3 MET A 126 8.852 3.801 -11.162 1.00 0.70 H new ATOM 0 HG2 MET A 126 8.936 5.223 -8.447 1.00 1.10 H new ATOM 0 HG3 MET A 126 7.844 5.663 -9.746 1.00 1.10 H new ATOM 0 HE1 MET A 126 5.224 3.103 -10.006 1.00 2.03 H new ATOM 0 HE2 MET A 126 6.030 4.586 -10.569 1.00 2.03 H new ATOM 0 HE3 MET A 126 6.659 2.993 -11.052 1.00 2.03 H new ATOM 597 N ASP A 127 12.345 3.244 -10.948 1.00 0.55 N ATOM 598 CA ASP A 127 13.350 2.647 -11.883 1.00 0.62 C ATOM 599 C ASP A 127 13.966 1.363 -11.285 1.00 0.54 C ATOM 600 O ASP A 127 14.101 0.353 -11.960 1.00 0.59 O ATOM 601 CB ASP A 127 14.428 3.721 -12.064 1.00 0.71 C ATOM 602 CG ASP A 127 15.455 3.271 -13.115 1.00 1.04 C ATOM 603 OD1 ASP A 127 15.447 2.104 -13.477 1.00 1.60 O ATOM 604 OD2 ASP A 127 16.233 4.108 -13.542 1.00 1.71 O ATOM 0 H ASP A 127 12.573 4.177 -10.605 1.00 0.55 H new ATOM 0 HA ASP A 127 12.893 2.362 -12.831 1.00 0.62 H new ATOM 0 HB2 ASP A 127 13.968 4.660 -12.373 1.00 0.71 H new ATOM 0 HB3 ASP A 127 14.928 3.909 -11.114 1.00 0.71 H new ATOM 609 N GLY A 128 14.350 1.397 -10.023 1.00 0.46 N ATOM 610 CA GLY A 128 14.973 0.187 -9.389 1.00 0.46 C ATOM 611 C GLY A 128 13.946 -0.894 -9.053 1.00 0.48 C ATOM 612 O GLY A 128 14.207 -2.067 -9.235 1.00 0.51 O ATOM 0 H GLY A 128 14.258 2.207 -9.410 1.00 0.46 H new ATOM 0 HA2 GLY A 128 15.723 -0.226 -10.063 1.00 0.46 H new ATOM 0 HA3 GLY A 128 15.493 0.485 -8.478 1.00 0.46 H new ATOM 616 N ILE A 129 12.791 -0.527 -8.558 1.00 0.54 N ATOM 617 CA ILE A 129 11.771 -1.569 -8.209 1.00 0.68 C ATOM 618 C ILE A 129 11.392 -2.367 -9.463 1.00 0.68 C ATOM 619 O ILE A 129 11.298 -3.580 -9.431 1.00 0.72 O ATOM 620 CB ILE A 129 10.576 -0.785 -7.650 1.00 0.86 C ATOM 621 CG1 ILE A 129 9.532 -1.750 -7.118 1.00 1.04 C ATOM 622 CG2 ILE A 129 9.949 0.090 -8.723 1.00 1.77 C ATOM 623 CD1 ILE A 129 8.446 -0.959 -6.385 1.00 2.01 C ATOM 0 H ILE A 129 12.510 0.437 -8.381 1.00 0.54 H new ATOM 0 HA ILE A 129 12.137 -2.295 -7.483 1.00 0.68 H new ATOM 0 HB ILE A 129 10.936 -0.146 -6.844 1.00 0.86 H new ATOM 0 HG12 ILE A 129 9.094 -2.319 -7.938 1.00 1.04 H new ATOM 0 HG13 ILE A 129 9.994 -2.469 -6.442 1.00 1.04 H new ATOM 0 HG21 ILE A 129 9.105 0.635 -8.301 1.00 1.77 H new ATOM 0 HG22 ILE A 129 10.690 0.799 -9.093 1.00 1.77 H new ATOM 0 HG23 ILE A 129 9.602 -0.535 -9.546 1.00 1.77 H new ATOM 0 HD11 ILE A 129 7.692 -1.646 -6.000 1.00 2.01 H new ATOM 0 HD12 ILE A 129 8.893 -0.409 -5.557 1.00 2.01 H new ATOM 0 HD13 ILE A 129 7.978 -0.257 -7.076 1.00 2.01 H new ATOM 635 N GLU A 130 11.185 -1.692 -10.564 1.00 0.70 N ATOM 636 CA GLU A 130 10.822 -2.409 -11.820 1.00 0.77 C ATOM 637 C GLU A 130 11.954 -3.339 -12.264 1.00 0.65 C ATOM 638 O GLU A 130 11.744 -4.513 -12.501 1.00 0.68 O ATOM 639 CB GLU A 130 10.570 -1.322 -12.870 1.00 0.85 C ATOM 640 CG GLU A 130 9.277 -0.574 -12.524 1.00 1.41 C ATOM 641 CD GLU A 130 8.997 0.524 -13.562 1.00 1.66 C ATOM 642 OE1 GLU A 130 9.866 0.795 -14.377 1.00 2.14 O ATOM 643 OE2 GLU A 130 7.909 1.075 -13.523 1.00 2.01 O ATOM 0 H GLU A 130 11.252 -0.678 -10.647 1.00 0.70 H new ATOM 0 HA GLU A 130 9.942 -3.036 -11.677 1.00 0.77 H new ATOM 0 HB2 GLU A 130 11.409 -0.627 -12.899 1.00 0.85 H new ATOM 0 HB3 GLU A 130 10.491 -1.769 -13.861 1.00 0.85 H new ATOM 0 HG2 GLU A 130 8.442 -1.274 -12.492 1.00 1.41 H new ATOM 0 HG3 GLU A 130 9.360 -0.132 -11.531 1.00 1.41 H new ATOM 650 N GLU A 131 13.152 -2.819 -12.392 1.00 0.59 N ATOM 651 CA GLU A 131 14.301 -3.672 -12.839 1.00 0.55 C ATOM 652 C GLU A 131 14.699 -4.692 -11.765 1.00 0.47 C ATOM 653 O GLU A 131 14.863 -5.864 -12.038 1.00 0.45 O ATOM 654 CB GLU A 131 15.447 -2.693 -13.088 1.00 0.63 C ATOM 655 CG GLU A 131 15.050 -1.723 -14.206 1.00 1.38 C ATOM 656 CD GLU A 131 16.181 -0.720 -14.482 1.00 1.89 C ATOM 657 OE1 GLU A 131 17.183 -0.759 -13.782 1.00 2.30 O ATOM 658 OE2 GLU A 131 16.021 0.077 -15.391 1.00 2.50 O ATOM 0 H GLU A 131 13.384 -1.843 -12.207 1.00 0.59 H new ATOM 0 HA GLU A 131 14.043 -4.250 -13.726 1.00 0.55 H new ATOM 0 HB2 GLU A 131 15.674 -2.141 -12.176 1.00 0.63 H new ATOM 0 HB3 GLU A 131 16.351 -3.236 -13.366 1.00 0.63 H new ATOM 0 HG2 GLU A 131 14.822 -2.281 -15.114 1.00 1.38 H new ATOM 0 HG3 GLU A 131 14.143 -1.188 -13.925 1.00 1.38 H new ATOM 665 N LYS A 132 14.878 -4.238 -10.553 1.00 0.51 N ATOM 666 CA LYS A 132 15.294 -5.159 -9.448 1.00 0.53 C ATOM 667 C LYS A 132 14.178 -6.136 -9.064 1.00 0.54 C ATOM 668 O LYS A 132 14.431 -7.291 -8.773 1.00 0.63 O ATOM 669 CB LYS A 132 15.630 -4.239 -8.271 1.00 0.68 C ATOM 670 CG LYS A 132 16.259 -5.056 -7.141 1.00 1.39 C ATOM 671 CD LYS A 132 16.628 -4.127 -5.979 1.00 1.91 C ATOM 672 CE LYS A 132 17.801 -3.235 -6.392 1.00 2.62 C ATOM 673 NZ LYS A 132 18.063 -2.370 -5.209 1.00 2.69 N ATOM 0 H LYS A 132 14.754 -3.264 -10.277 1.00 0.51 H new ATOM 0 HA LYS A 132 16.138 -5.779 -9.750 1.00 0.53 H new ATOM 0 HB2 LYS A 132 16.317 -3.457 -8.593 1.00 0.68 H new ATOM 0 HB3 LYS A 132 14.727 -3.743 -7.915 1.00 0.68 H new ATOM 0 HG2 LYS A 132 15.562 -5.822 -6.801 1.00 1.39 H new ATOM 0 HG3 LYS A 132 17.148 -5.573 -7.503 1.00 1.39 H new ATOM 0 HD2 LYS A 132 15.770 -3.514 -5.703 1.00 1.91 H new ATOM 0 HD3 LYS A 132 16.895 -4.714 -5.101 1.00 1.91 H new ATOM 0 HE2 LYS A 132 18.678 -3.830 -6.648 1.00 2.62 H new ATOM 0 HE3 LYS A 132 17.553 -2.638 -7.270 1.00 2.62 H new ATOM 0 HZ1 LYS A 132 18.856 -1.729 -5.416 1.00 2.69 H new ATOM 0 HZ2 LYS A 132 17.213 -1.811 -4.993 1.00 2.69 H new ATOM 0 HZ3 LYS A 132 18.303 -2.965 -4.390 1.00 2.69 H new ATOM 687 N TYR A 133 12.954 -5.678 -9.027 1.00 0.55 N ATOM 688 CA TYR A 133 11.828 -6.571 -8.618 1.00 0.65 C ATOM 689 C TYR A 133 10.785 -6.692 -9.740 1.00 0.54 C ATOM 690 O TYR A 133 9.839 -5.932 -9.780 1.00 0.66 O ATOM 691 CB TYR A 133 11.230 -5.882 -7.394 1.00 0.89 C ATOM 692 CG TYR A 133 12.282 -5.770 -6.310 1.00 1.14 C ATOM 693 CD1 TYR A 133 13.010 -6.900 -5.911 1.00 0.98 C ATOM 694 CD2 TYR A 133 12.532 -4.531 -5.708 1.00 2.20 C ATOM 695 CE1 TYR A 133 13.985 -6.790 -4.913 1.00 1.14 C ATOM 696 CE2 TYR A 133 13.508 -4.421 -4.710 1.00 2.44 C ATOM 697 CZ TYR A 133 14.234 -5.551 -4.312 1.00 1.67 C ATOM 698 OH TYR A 133 15.195 -5.441 -3.328 1.00 1.95 O ATOM 0 H TYR A 133 12.685 -4.723 -9.263 1.00 0.55 H new ATOM 0 HA TYR A 133 12.160 -7.587 -8.406 1.00 0.65 H new ATOM 0 HB2 TYR A 133 10.865 -4.891 -7.664 1.00 0.89 H new ATOM 0 HB3 TYR A 133 10.374 -6.448 -7.027 1.00 0.89 H new ATOM 0 HD1 TYR A 133 12.818 -7.856 -6.374 1.00 0.98 H new ATOM 0 HD2 TYR A 133 11.972 -3.660 -6.013 1.00 2.20 H new ATOM 0 HE1 TYR A 133 14.545 -7.661 -4.607 1.00 1.14 H new ATOM 0 HE2 TYR A 133 13.701 -3.465 -4.247 1.00 2.44 H new ATOM 0 HH TYR A 133 15.241 -4.512 -3.018 1.00 1.95 H new ATOM 708 N PRO A 134 10.994 -7.641 -10.628 1.00 0.51 N ATOM 709 CA PRO A 134 10.059 -7.835 -11.754 1.00 0.53 C ATOM 710 C PRO A 134 8.897 -8.769 -11.381 1.00 0.47 C ATOM 711 O PRO A 134 7.897 -8.813 -12.076 1.00 0.54 O ATOM 712 CB PRO A 134 10.933 -8.483 -12.823 1.00 0.70 C ATOM 713 CG PRO A 134 12.048 -9.166 -12.083 1.00 0.76 C ATOM 714 CD PRO A 134 12.101 -8.605 -10.681 1.00 0.66 C ATOM 0 HA PRO A 134 9.593 -6.902 -12.069 1.00 0.53 H new ATOM 0 HB2 PRO A 134 10.361 -9.198 -13.415 1.00 0.70 H new ATOM 0 HB3 PRO A 134 11.323 -7.736 -13.515 1.00 0.70 H new ATOM 0 HG2 PRO A 134 11.881 -10.243 -12.055 1.00 0.76 H new ATOM 0 HG3 PRO A 134 12.998 -9.004 -12.593 1.00 0.76 H new ATOM 0 HD2 PRO A 134 11.980 -9.390 -9.935 1.00 0.66 H new ATOM 0 HD3 PRO A 134 13.058 -8.122 -10.483 1.00 0.66 H new ATOM 722 N ARG A 135 9.016 -9.532 -10.315 1.00 0.43 N ATOM 723 CA ARG A 135 7.899 -10.469 -9.956 1.00 0.48 C ATOM 724 C ARG A 135 7.742 -10.637 -8.434 1.00 0.43 C ATOM 725 O ARG A 135 7.045 -11.527 -7.982 1.00 0.60 O ATOM 726 CB ARG A 135 8.300 -11.799 -10.596 1.00 0.70 C ATOM 727 CG ARG A 135 7.071 -12.703 -10.730 1.00 0.91 C ATOM 728 CD ARG A 135 6.173 -12.177 -11.853 1.00 1.17 C ATOM 729 NE ARG A 135 5.045 -13.148 -11.941 1.00 1.44 N ATOM 730 CZ ARG A 135 4.284 -13.168 -13.001 1.00 2.17 C ATOM 731 NH1 ARG A 135 4.818 -13.264 -14.188 1.00 3.07 N ATOM 732 NH2 ARG A 135 2.987 -13.092 -12.875 1.00 2.61 N ATOM 0 H ARG A 135 9.822 -9.547 -9.690 1.00 0.43 H new ATOM 0 HA ARG A 135 6.939 -10.092 -10.308 1.00 0.48 H new ATOM 0 HB2 ARG A 135 8.741 -11.622 -11.577 1.00 0.70 H new ATOM 0 HB3 ARG A 135 9.060 -12.291 -9.989 1.00 0.70 H new ATOM 0 HG2 ARG A 135 7.380 -13.726 -10.945 1.00 0.91 H new ATOM 0 HG3 ARG A 135 6.520 -12.728 -9.790 1.00 0.91 H new ATOM 0 HD2 ARG A 135 5.812 -11.173 -11.630 1.00 1.17 H new ATOM 0 HD3 ARG A 135 6.716 -12.118 -12.796 1.00 1.17 H new ATOM 0 HE ARG A 135 4.868 -13.796 -11.173 1.00 1.44 H new ATOM 0 HH11 ARG A 135 5.831 -13.324 -14.288 1.00 3.07 H new ATOM 0 HH12 ARG A 135 4.222 -13.280 -15.016 1.00 3.07 H new ATOM 0 HH21 ARG A 135 2.568 -13.017 -11.948 1.00 2.61 H new ATOM 0 HH22 ARG A 135 2.392 -13.108 -13.704 1.00 2.61 H new ATOM 746 N SER A 136 8.362 -9.798 -7.641 1.00 0.51 N ATOM 747 CA SER A 136 8.216 -9.930 -6.156 1.00 0.44 C ATOM 748 C SER A 136 7.133 -8.986 -5.654 1.00 0.33 C ATOM 749 O SER A 136 7.295 -7.782 -5.641 1.00 0.30 O ATOM 750 CB SER A 136 9.584 -9.570 -5.564 1.00 0.50 C ATOM 751 OG SER A 136 10.210 -8.575 -6.364 1.00 0.90 O ATOM 0 H SER A 136 8.959 -9.032 -7.954 1.00 0.51 H new ATOM 0 HA SER A 136 7.919 -10.937 -5.862 1.00 0.44 H new ATOM 0 HB2 SER A 136 9.464 -9.206 -4.543 1.00 0.50 H new ATOM 0 HB3 SER A 136 10.214 -10.458 -5.514 1.00 0.50 H new ATOM 0 HG SER A 136 11.077 -8.339 -5.973 1.00 0.90 H new ATOM 757 N LEU A 137 6.025 -9.541 -5.226 1.00 0.31 N ATOM 758 CA LEU A 137 4.914 -8.697 -4.705 1.00 0.24 C ATOM 759 C LEU A 137 5.420 -7.935 -3.478 1.00 0.20 C ATOM 760 O LEU A 137 5.187 -6.755 -3.315 1.00 0.21 O ATOM 761 CB LEU A 137 3.803 -9.692 -4.309 1.00 0.23 C ATOM 762 CG LEU A 137 2.588 -8.936 -3.772 1.00 0.21 C ATOM 763 CD1 LEU A 137 1.936 -8.170 -4.921 1.00 0.23 C ATOM 764 CD2 LEU A 137 1.580 -9.938 -3.189 1.00 0.27 C ATOM 0 H LEU A 137 5.846 -10.545 -5.217 1.00 0.31 H new ATOM 0 HA LEU A 137 4.550 -7.968 -5.429 1.00 0.24 H new ATOM 0 HB2 LEU A 137 3.516 -10.291 -5.173 1.00 0.23 H new ATOM 0 HB3 LEU A 137 4.175 -10.382 -3.552 1.00 0.23 H new ATOM 0 HG LEU A 137 2.898 -8.241 -2.992 1.00 0.21 H new ATOM 0 HD11 LEU A 137 1.067 -7.626 -4.549 1.00 0.23 H new ATOM 0 HD12 LEU A 137 2.653 -7.465 -5.341 1.00 0.23 H new ATOM 0 HD13 LEU A 137 1.622 -8.871 -5.694 1.00 0.23 H new ATOM 0 HD21 LEU A 137 0.713 -9.400 -2.806 1.00 0.27 H new ATOM 0 HD22 LEU A 137 1.262 -10.630 -3.969 1.00 0.27 H new ATOM 0 HD23 LEU A 137 2.049 -10.496 -2.378 1.00 0.27 H new ATOM 776 N SER A 138 6.120 -8.627 -2.624 1.00 0.24 N ATOM 777 CA SER A 138 6.669 -7.996 -1.384 1.00 0.26 C ATOM 778 C SER A 138 7.708 -6.891 -1.684 1.00 0.20 C ATOM 779 O SER A 138 7.665 -5.825 -1.101 1.00 0.22 O ATOM 780 CB SER A 138 7.319 -9.148 -0.615 1.00 0.38 C ATOM 781 OG SER A 138 7.981 -8.632 0.533 1.00 1.01 O ATOM 0 H SER A 138 6.340 -9.617 -2.731 1.00 0.24 H new ATOM 0 HA SER A 138 5.880 -7.498 -0.821 1.00 0.26 H new ATOM 0 HB2 SER A 138 6.563 -9.874 -0.317 1.00 0.38 H new ATOM 0 HB3 SER A 138 8.030 -9.672 -1.254 1.00 0.38 H new ATOM 0 HG SER A 138 8.397 -9.368 1.029 1.00 1.01 H new ATOM 787 N GLU A 139 8.661 -7.150 -2.554 1.00 0.24 N ATOM 788 CA GLU A 139 9.728 -6.122 -2.851 1.00 0.25 C ATOM 789 C GLU A 139 9.154 -4.894 -3.552 1.00 0.21 C ATOM 790 O GLU A 139 9.583 -3.778 -3.321 1.00 0.21 O ATOM 791 CB GLU A 139 10.711 -6.795 -3.806 1.00 0.39 C ATOM 792 CG GLU A 139 11.292 -8.065 -3.178 1.00 1.09 C ATOM 793 CD GLU A 139 12.459 -7.710 -2.254 1.00 2.02 C ATOM 794 OE1 GLU A 139 12.380 -6.689 -1.594 1.00 2.92 O ATOM 795 OE2 GLU A 139 13.412 -8.472 -2.222 1.00 2.24 O ATOM 0 H GLU A 139 8.750 -8.024 -3.072 1.00 0.24 H new ATOM 0 HA GLU A 139 10.188 -5.790 -1.920 1.00 0.25 H new ATOM 0 HB2 GLU A 139 10.207 -7.043 -4.740 1.00 0.39 H new ATOM 0 HB3 GLU A 139 11.517 -6.104 -4.053 1.00 0.39 H new ATOM 0 HG2 GLU A 139 10.519 -8.588 -2.615 1.00 1.09 H new ATOM 0 HG3 GLU A 139 11.631 -8.744 -3.960 1.00 1.09 H new ATOM 802 N ARG A 140 8.236 -5.101 -4.452 1.00 0.26 N ATOM 803 CA ARG A 140 7.675 -3.957 -5.225 1.00 0.33 C ATOM 804 C ARG A 140 6.812 -3.056 -4.349 1.00 0.29 C ATOM 805 O ARG A 140 7.025 -1.861 -4.272 1.00 0.35 O ATOM 806 CB ARG A 140 6.836 -4.600 -6.332 1.00 0.42 C ATOM 807 CG ARG A 140 6.385 -3.529 -7.327 1.00 1.07 C ATOM 808 CD ARG A 140 5.589 -4.187 -8.457 1.00 1.17 C ATOM 809 NE ARG A 140 6.575 -5.040 -9.184 1.00 0.98 N ATOM 810 CZ ARG A 140 6.160 -5.907 -10.068 1.00 1.13 C ATOM 811 NH1 ARG A 140 5.644 -7.041 -9.679 1.00 1.55 N ATOM 812 NH2 ARG A 140 6.261 -5.641 -11.342 1.00 1.60 N ATOM 0 H ARG A 140 7.848 -6.015 -4.687 1.00 0.26 H new ATOM 0 HA ARG A 140 8.465 -3.318 -5.621 1.00 0.33 H new ATOM 0 HB2 ARG A 140 7.419 -5.364 -6.846 1.00 0.42 H new ATOM 0 HB3 ARG A 140 5.968 -5.098 -5.901 1.00 0.42 H new ATOM 0 HG2 ARG A 140 5.771 -2.783 -6.822 1.00 1.07 H new ATOM 0 HG3 ARG A 140 7.251 -3.007 -7.734 1.00 1.07 H new ATOM 0 HD2 ARG A 140 4.766 -4.784 -8.063 1.00 1.17 H new ATOM 0 HD3 ARG A 140 5.152 -3.439 -9.118 1.00 1.17 H new ATOM 0 HE ARG A 140 7.572 -4.946 -8.990 1.00 0.98 H new ATOM 0 HH11 ARG A 140 5.565 -7.251 -8.684 1.00 1.55 H new ATOM 0 HH12 ARG A 140 5.320 -7.718 -10.370 1.00 1.55 H new ATOM 0 HH21 ARG A 140 6.664 -4.755 -11.648 1.00 1.60 H new ATOM 0 HH22 ARG A 140 5.937 -6.319 -12.032 1.00 1.60 H new ATOM 826 N VAL A 141 5.833 -3.610 -3.710 1.00 0.24 N ATOM 827 CA VAL A 141 4.936 -2.779 -2.859 1.00 0.27 C ATOM 828 C VAL A 141 5.686 -2.102 -1.708 1.00 0.25 C ATOM 829 O VAL A 141 5.396 -0.981 -1.372 1.00 0.29 O ATOM 830 CB VAL A 141 3.882 -3.733 -2.318 1.00 0.28 C ATOM 831 CG1 VAL A 141 3.127 -4.374 -3.476 1.00 0.33 C ATOM 832 CG2 VAL A 141 4.540 -4.824 -1.486 1.00 0.23 C ATOM 0 H VAL A 141 5.609 -4.605 -3.736 1.00 0.24 H new ATOM 0 HA VAL A 141 4.501 -1.969 -3.444 1.00 0.27 H new ATOM 0 HB VAL A 141 3.189 -3.171 -1.692 1.00 0.28 H new ATOM 0 HG11 VAL A 141 2.373 -5.057 -3.085 1.00 0.33 H new ATOM 0 HG12 VAL A 141 2.642 -3.598 -4.068 1.00 0.33 H new ATOM 0 HG13 VAL A 141 3.826 -4.926 -4.104 1.00 0.33 H new ATOM 0 HG21 VAL A 141 3.776 -5.501 -1.104 1.00 0.23 H new ATOM 0 HG22 VAL A 141 5.241 -5.382 -2.107 1.00 0.23 H new ATOM 0 HG23 VAL A 141 5.075 -4.372 -0.651 1.00 0.23 H new ATOM 842 N ARG A 142 6.611 -2.781 -1.075 1.00 0.21 N ATOM 843 CA ARG A 142 7.331 -2.167 0.091 1.00 0.22 C ATOM 844 C ARG A 142 7.987 -0.829 -0.273 1.00 0.24 C ATOM 845 O ARG A 142 7.809 0.152 0.428 1.00 0.25 O ATOM 846 CB ARG A 142 8.394 -3.189 0.503 1.00 0.27 C ATOM 847 CG ARG A 142 7.732 -4.335 1.274 1.00 0.28 C ATOM 848 CD ARG A 142 7.386 -3.856 2.688 1.00 1.02 C ATOM 849 NE ARG A 142 6.661 -4.994 3.320 1.00 0.94 N ATOM 850 CZ ARG A 142 6.522 -5.038 4.617 1.00 1.48 C ATOM 851 NH1 ARG A 142 7.521 -5.415 5.367 1.00 2.24 N ATOM 852 NH2 ARG A 142 5.385 -4.705 5.163 1.00 2.10 N ATOM 0 H ARG A 142 6.900 -3.730 -1.312 1.00 0.21 H new ATOM 0 HA ARG A 142 6.634 -1.945 0.899 1.00 0.22 H new ATOM 0 HB2 ARG A 142 8.902 -3.577 -0.380 1.00 0.27 H new ATOM 0 HB3 ARG A 142 9.152 -2.711 1.123 1.00 0.27 H new ATOM 0 HG2 ARG A 142 6.830 -4.664 0.757 1.00 0.28 H new ATOM 0 HG3 ARG A 142 8.403 -5.193 1.321 1.00 0.28 H new ATOM 0 HD2 ARG A 142 8.286 -3.602 3.249 1.00 1.02 H new ATOM 0 HD3 ARG A 142 6.765 -2.961 2.659 1.00 1.02 H new ATOM 0 HE ARG A 142 6.274 -5.738 2.740 1.00 0.94 H new ATOM 0 HH11 ARG A 142 8.410 -5.675 4.940 1.00 2.24 H new ATOM 0 HH12 ARG A 142 7.413 -5.450 6.381 1.00 2.24 H new ATOM 0 HH21 ARG A 142 4.604 -4.410 4.576 1.00 2.10 H new ATOM 0 HH22 ARG A 142 5.277 -4.739 6.177 1.00 2.10 H new ATOM 866 N GLU A 143 8.735 -0.767 -1.345 1.00 0.26 N ATOM 867 CA GLU A 143 9.387 0.531 -1.720 1.00 0.31 C ATOM 868 C GLU A 143 8.318 1.576 -2.040 1.00 0.30 C ATOM 869 O GLU A 143 8.352 2.689 -1.545 1.00 0.31 O ATOM 870 CB GLU A 143 10.227 0.222 -2.956 1.00 0.36 C ATOM 871 CG GLU A 143 11.072 1.447 -3.321 1.00 0.44 C ATOM 872 CD GLU A 143 12.067 1.091 -4.435 1.00 0.97 C ATOM 873 OE1 GLU A 143 12.196 -0.084 -4.749 1.00 1.62 O ATOM 874 OE2 GLU A 143 12.687 2.003 -4.956 1.00 1.84 O ATOM 0 H GLU A 143 8.923 -1.548 -1.973 1.00 0.26 H new ATOM 0 HA GLU A 143 9.999 0.934 -0.913 1.00 0.31 H new ATOM 0 HB2 GLU A 143 10.873 -0.634 -2.764 1.00 0.36 H new ATOM 0 HB3 GLU A 143 9.580 -0.048 -3.790 1.00 0.36 H new ATOM 0 HG2 GLU A 143 10.424 2.260 -3.648 1.00 0.44 H new ATOM 0 HG3 GLU A 143 11.610 1.802 -2.442 1.00 0.44 H new ATOM 881 N SER A 144 7.366 1.212 -2.857 1.00 0.29 N ATOM 882 CA SER A 144 6.274 2.167 -3.216 1.00 0.29 C ATOM 883 C SER A 144 5.456 2.509 -1.967 1.00 0.28 C ATOM 884 O SER A 144 5.076 3.643 -1.747 1.00 0.28 O ATOM 885 CB SER A 144 5.409 1.415 -4.232 1.00 0.29 C ATOM 886 OG SER A 144 4.903 0.230 -3.634 1.00 1.34 O ATOM 0 H SER A 144 7.296 0.293 -3.293 1.00 0.29 H new ATOM 0 HA SER A 144 6.655 3.104 -3.622 1.00 0.29 H new ATOM 0 HB2 SER A 144 4.586 2.048 -4.565 1.00 0.29 H new ATOM 0 HB3 SER A 144 5.998 1.167 -5.115 1.00 0.29 H new ATOM 0 HG SER A 144 4.120 -0.081 -4.135 1.00 1.34 H new ATOM 892 N LEU A 145 5.198 1.529 -1.146 1.00 0.27 N ATOM 893 CA LEU A 145 4.428 1.765 0.109 1.00 0.28 C ATOM 894 C LEU A 145 5.263 2.573 1.102 1.00 0.30 C ATOM 895 O LEU A 145 4.740 3.362 1.861 1.00 0.30 O ATOM 896 CB LEU A 145 4.126 0.378 0.683 1.00 0.29 C ATOM 897 CG LEU A 145 3.021 -0.303 -0.122 1.00 0.37 C ATOM 898 CD1 LEU A 145 2.895 -1.760 0.326 1.00 0.73 C ATOM 899 CD2 LEU A 145 1.702 0.422 0.134 1.00 0.67 C ATOM 0 H LEU A 145 5.491 0.563 -1.293 1.00 0.27 H new ATOM 0 HA LEU A 145 3.516 2.329 -0.084 1.00 0.28 H new ATOM 0 HB2 LEU A 145 5.028 -0.234 0.665 1.00 0.29 H new ATOM 0 HB3 LEU A 145 3.822 0.467 1.726 1.00 0.29 H new ATOM 0 HG LEU A 145 3.261 -0.269 -1.185 1.00 0.37 H new ATOM 0 HD11 LEU A 145 2.107 -2.250 -0.246 1.00 0.73 H new ATOM 0 HD12 LEU A 145 3.840 -2.276 0.157 1.00 0.73 H new ATOM 0 HD13 LEU A 145 2.648 -1.794 1.387 1.00 0.73 H new ATOM 0 HD21 LEU A 145 0.907 -0.057 -0.437 1.00 0.67 H new ATOM 0 HD22 LEU A 145 1.463 0.378 1.197 1.00 0.67 H new ATOM 0 HD23 LEU A 145 1.793 1.463 -0.175 1.00 0.67 H new ATOM 911 N LYS A 146 6.560 2.366 1.110 1.00 0.33 N ATOM 912 CA LYS A 146 7.440 3.107 2.073 1.00 0.35 C ATOM 913 C LYS A 146 7.327 4.614 1.842 1.00 0.34 C ATOM 914 O LYS A 146 7.105 5.371 2.769 1.00 0.35 O ATOM 915 CB LYS A 146 8.859 2.615 1.768 1.00 0.41 C ATOM 916 CG LYS A 146 9.869 3.306 2.690 1.00 1.01 C ATOM 917 CD LYS A 146 11.237 2.627 2.553 1.00 1.15 C ATOM 918 CE LYS A 146 11.768 2.800 1.127 1.00 1.96 C ATOM 919 NZ LYS A 146 13.242 2.957 1.283 1.00 2.32 N ATOM 0 H LYS A 146 7.047 1.717 0.492 1.00 0.33 H new ATOM 0 HA LYS A 146 7.162 2.928 3.112 1.00 0.35 H new ATOM 0 HB2 LYS A 146 8.914 1.535 1.902 1.00 0.41 H new ATOM 0 HB3 LYS A 146 9.107 2.820 0.727 1.00 0.41 H new ATOM 0 HG2 LYS A 146 9.948 4.362 2.433 1.00 1.01 H new ATOM 0 HG3 LYS A 146 9.528 3.254 3.724 1.00 1.01 H new ATOM 0 HD2 LYS A 146 11.939 3.059 3.266 1.00 1.15 H new ATOM 0 HD3 LYS A 146 11.151 1.567 2.792 1.00 1.15 H new ATOM 0 HE2 LYS A 146 11.526 1.936 0.508 1.00 1.96 H new ATOM 0 HE3 LYS A 146 11.327 3.672 0.644 1.00 1.96 H new ATOM 0 HZ1 LYS A 146 13.679 3.081 0.347 1.00 2.32 H new ATOM 0 HZ2 LYS A 146 13.442 3.791 1.871 1.00 2.32 H new ATOM 0 HZ3 LYS A 146 13.635 2.109 1.739 1.00 2.32 H new ATOM 933 N VAL A 147 7.464 5.057 0.621 1.00 0.32 N ATOM 934 CA VAL A 147 7.342 6.519 0.356 1.00 0.33 C ATOM 935 C VAL A 147 5.914 6.982 0.650 1.00 0.31 C ATOM 936 O VAL A 147 5.699 8.039 1.214 1.00 0.31 O ATOM 937 CB VAL A 147 7.715 6.718 -1.118 1.00 0.36 C ATOM 938 CG1 VAL A 147 9.163 6.278 -1.328 1.00 0.40 C ATOM 939 CG2 VAL A 147 6.802 5.892 -2.034 1.00 0.36 C ATOM 0 H VAL A 147 7.653 4.477 -0.196 1.00 0.32 H new ATOM 0 HA VAL A 147 7.999 7.111 0.994 1.00 0.33 H new ATOM 0 HB VAL A 147 7.594 7.772 -1.368 1.00 0.36 H new ATOM 0 HG11 VAL A 147 9.437 6.416 -2.374 1.00 0.40 H new ATOM 0 HG12 VAL A 147 9.820 6.878 -0.698 1.00 0.40 H new ATOM 0 HG13 VAL A 147 9.266 5.226 -1.062 1.00 0.40 H new ATOM 0 HG21 VAL A 147 7.089 6.052 -3.073 1.00 0.36 H new ATOM 0 HG22 VAL A 147 6.901 4.835 -1.789 1.00 0.36 H new ATOM 0 HG23 VAL A 147 5.767 6.202 -1.891 1.00 0.36 H new ATOM 949 N TRP A 148 4.941 6.189 0.284 1.00 0.32 N ATOM 950 CA TRP A 148 3.518 6.569 0.549 1.00 0.33 C ATOM 951 C TRP A 148 3.281 6.680 2.065 1.00 0.32 C ATOM 952 O TRP A 148 2.853 7.710 2.553 1.00 0.32 O ATOM 953 CB TRP A 148 2.681 5.431 -0.077 1.00 0.36 C ATOM 954 CG TRP A 148 1.264 5.465 0.428 1.00 0.28 C ATOM 955 CD1 TRP A 148 0.426 6.529 0.357 1.00 0.30 C ATOM 956 CD2 TRP A 148 0.524 4.401 1.090 1.00 0.24 C ATOM 957 NE1 TRP A 148 -0.778 6.186 0.958 1.00 0.23 N ATOM 958 CE2 TRP A 148 -0.767 4.878 1.419 1.00 0.18 C ATOM 959 CE3 TRP A 148 0.850 3.078 1.437 1.00 0.31 C ATOM 960 CZ2 TRP A 148 -1.699 4.062 2.074 1.00 0.17 C ATOM 961 CZ3 TRP A 148 -0.087 2.261 2.089 1.00 0.33 C ATOM 962 CH2 TRP A 148 -1.355 2.754 2.406 1.00 0.27 C ATOM 0 H TRP A 148 5.069 5.294 -0.187 1.00 0.32 H new ATOM 0 HA TRP A 148 3.249 7.536 0.124 1.00 0.33 H new ATOM 0 HB2 TRP A 148 2.686 5.525 -1.163 1.00 0.36 H new ATOM 0 HB3 TRP A 148 3.133 4.468 0.162 1.00 0.36 H new ATOM 0 HD1 TRP A 148 0.657 7.484 -0.092 1.00 0.30 H new ATOM 0 HE1 TRP A 148 -1.573 6.819 1.049 1.00 0.23 H new ATOM 0 HE3 TRP A 148 1.829 2.687 1.200 1.00 0.31 H new ATOM 0 HZ2 TRP A 148 -2.678 4.445 2.320 1.00 0.17 H new ATOM 0 HZ3 TRP A 148 0.174 1.245 2.347 1.00 0.33 H new ATOM 0 HH2 TRP A 148 -2.070 2.120 2.909 1.00 0.27 H new ATOM 973 N LYS A 149 3.544 5.629 2.806 1.00 0.36 N ATOM 974 CA LYS A 149 3.313 5.686 4.280 1.00 0.38 C ATOM 975 C LYS A 149 4.196 6.776 4.915 1.00 0.34 C ATOM 976 O LYS A 149 3.758 7.499 5.790 1.00 0.33 O ATOM 977 CB LYS A 149 3.652 4.279 4.813 1.00 0.52 C ATOM 978 CG LYS A 149 5.159 4.010 4.730 1.00 1.36 C ATOM 979 CD LYS A 149 5.441 2.546 5.072 1.00 2.07 C ATOM 980 CE LYS A 149 6.888 2.405 5.546 1.00 2.80 C ATOM 981 NZ LYS A 149 7.331 1.072 5.054 1.00 3.70 N ATOM 0 H LYS A 149 3.906 4.742 2.455 1.00 0.36 H new ATOM 0 HA LYS A 149 2.285 5.949 4.529 1.00 0.38 H new ATOM 0 HB2 LYS A 149 3.319 4.188 5.847 1.00 0.52 H new ATOM 0 HB3 LYS A 149 3.112 3.528 4.236 1.00 0.52 H new ATOM 0 HG2 LYS A 149 5.524 4.236 3.728 1.00 1.36 H new ATOM 0 HG3 LYS A 149 5.693 4.664 5.419 1.00 1.36 H new ATOM 0 HD2 LYS A 149 4.757 2.204 5.849 1.00 2.07 H new ATOM 0 HD3 LYS A 149 5.270 1.917 4.198 1.00 2.07 H new ATOM 0 HE2 LYS A 149 7.514 3.201 5.143 1.00 2.80 H new ATOM 0 HE3 LYS A 149 6.954 2.466 6.632 1.00 2.80 H new ATOM 0 HZ1 LYS A 149 8.299 1.144 4.681 1.00 3.70 H new ATOM 0 HZ2 LYS A 149 7.312 0.389 5.838 1.00 3.70 H new ATOM 0 HZ3 LYS A 149 6.692 0.751 4.299 1.00 3.70 H new ATOM 995 N ASN A 150 5.428 6.910 4.470 1.00 0.37 N ATOM 996 CA ASN A 150 6.323 7.966 5.048 1.00 0.41 C ATOM 997 C ASN A 150 5.712 9.350 4.817 1.00 0.39 C ATOM 998 O ASN A 150 5.685 10.180 5.706 1.00 0.46 O ATOM 999 CB ASN A 150 7.654 7.835 4.299 1.00 0.50 C ATOM 1000 CG ASN A 150 8.645 8.883 4.820 1.00 1.07 C ATOM 1001 OD1 ASN A 150 8.672 9.999 4.341 1.00 1.86 O ATOM 1002 ND2 ASN A 150 9.471 8.565 5.779 1.00 1.27 N ATOM 0 H ASN A 150 5.848 6.338 3.737 1.00 0.37 H new ATOM 0 HA ASN A 150 6.457 7.845 6.123 1.00 0.41 H new ATOM 0 HB2 ASN A 150 8.063 6.834 4.436 1.00 0.50 H new ATOM 0 HB3 ASN A 150 7.495 7.971 3.229 1.00 0.50 H new ATOM 0 HD21 ASN A 150 10.139 9.253 6.126 1.00 1.27 H new ATOM 0 HD22 ASN A 150 9.449 7.628 6.182 1.00 1.27 H new ATOM 1009 N ALA A 151 5.221 9.600 3.629 1.00 0.38 N ATOM 1010 CA ALA A 151 4.609 10.929 3.343 1.00 0.49 C ATOM 1011 C ALA A 151 3.322 11.081 4.148 1.00 0.53 C ATOM 1012 O ALA A 151 3.079 12.105 4.757 1.00 0.72 O ATOM 1013 CB ALA A 151 4.309 10.926 1.843 1.00 0.57 C ATOM 0 H ALA A 151 5.218 8.943 2.849 1.00 0.38 H new ATOM 0 HA ALA A 151 5.265 11.756 3.615 1.00 0.49 H new ATOM 0 HB1 ALA A 151 3.856 11.876 1.561 1.00 0.57 H new ATOM 0 HB2 ALA A 151 5.236 10.787 1.287 1.00 0.57 H new ATOM 0 HB3 ALA A 151 3.621 10.113 1.611 1.00 0.57 H new ATOM 1019 N GLU A 152 2.497 10.062 4.157 1.00 0.40 N ATOM 1020 CA GLU A 152 1.224 10.141 4.926 1.00 0.50 C ATOM 1021 C GLU A 152 1.493 9.986 6.422 1.00 0.60 C ATOM 1022 O GLU A 152 1.978 8.963 6.868 1.00 1.48 O ATOM 1023 CB GLU A 152 0.368 8.974 4.431 1.00 0.44 C ATOM 1024 CG GLU A 152 0.115 9.109 2.929 1.00 0.77 C ATOM 1025 CD GLU A 152 -0.620 10.421 2.625 1.00 1.10 C ATOM 1026 OE1 GLU A 152 -1.712 10.600 3.135 1.00 1.66 O ATOM 1027 OE2 GLU A 152 -0.071 11.226 1.888 1.00 1.81 O ATOM 0 H GLU A 152 2.653 9.182 3.665 1.00 0.40 H new ATOM 0 HA GLU A 152 0.731 11.102 4.780 1.00 0.50 H new ATOM 0 HB2 GLU A 152 0.871 8.030 4.640 1.00 0.44 H new ATOM 0 HB3 GLU A 152 -0.581 8.955 4.967 1.00 0.44 H new ATOM 0 HG2 GLU A 152 1.062 9.083 2.391 1.00 0.77 H new ATOM 0 HG3 GLU A 152 -0.476 8.264 2.576 1.00 0.77 H new ATOM 1034 N LYS A 153 1.155 10.979 7.202 1.00 0.76 N ATOM 1035 CA LYS A 153 1.358 10.873 8.675 1.00 0.67 C ATOM 1036 C LYS A 153 0.089 10.271 9.287 1.00 0.64 C ATOM 1037 O LYS A 153 0.030 9.090 9.572 1.00 0.57 O ATOM 1038 CB LYS A 153 1.594 12.307 9.153 1.00 0.86 C ATOM 1039 CG LYS A 153 2.957 12.785 8.652 1.00 1.17 C ATOM 1040 CD LYS A 153 3.108 14.282 8.929 1.00 1.57 C ATOM 1041 CE LYS A 153 3.412 14.498 10.413 1.00 2.22 C ATOM 1042 NZ LYS A 153 3.988 15.870 10.495 1.00 2.51 N ATOM 0 H LYS A 153 0.748 11.858 6.882 1.00 0.76 H new ATOM 0 HA LYS A 153 2.196 10.237 8.961 1.00 0.67 H new ATOM 0 HB2 LYS A 153 0.806 12.962 8.781 1.00 0.86 H new ATOM 0 HB3 LYS A 153 1.557 12.351 10.241 1.00 0.86 H new ATOM 0 HG2 LYS A 153 3.753 12.231 9.149 1.00 1.17 H new ATOM 0 HG3 LYS A 153 3.052 12.591 7.584 1.00 1.17 H new ATOM 0 HD2 LYS A 153 3.910 14.697 8.318 1.00 1.57 H new ATOM 0 HD3 LYS A 153 2.194 14.808 8.654 1.00 1.57 H new ATOM 0 HE2 LYS A 153 2.509 14.413 11.017 1.00 2.22 H new ATOM 0 HE3 LYS A 153 4.115 13.752 10.784 1.00 2.22 H new ATOM 0 HZ1 LYS A 153 4.222 16.090 11.484 1.00 2.51 H new ATOM 0 HZ2 LYS A 153 4.851 15.920 9.916 1.00 2.51 H new ATOM 0 HZ3 LYS A 153 3.294 16.560 10.142 1.00 2.51 H new ATOM 1056 N LYS A 154 -0.935 11.068 9.464 1.00 0.73 N ATOM 1057 CA LYS A 154 -2.216 10.537 10.022 1.00 0.77 C ATOM 1058 C LYS A 154 -2.858 9.589 8.997 1.00 0.62 C ATOM 1059 O LYS A 154 -3.507 8.614 9.342 1.00 0.60 O ATOM 1060 CB LYS A 154 -3.100 11.764 10.242 1.00 0.95 C ATOM 1061 CG LYS A 154 -4.333 11.358 11.047 1.00 1.29 C ATOM 1062 CD LYS A 154 -5.229 12.578 11.258 1.00 1.34 C ATOM 1063 CE LYS A 154 -4.611 13.490 12.319 1.00 2.02 C ATOM 1064 NZ LYS A 154 -5.420 14.739 12.266 1.00 2.51 N ATOM 0 H LYS A 154 -0.939 12.064 9.246 1.00 0.73 H new ATOM 0 HA LYS A 154 -2.072 9.978 10.947 1.00 0.77 H new ATOM 0 HB2 LYS A 154 -2.544 12.537 10.772 1.00 0.95 H new ATOM 0 HB3 LYS A 154 -3.400 12.187 9.283 1.00 0.95 H new ATOM 0 HG2 LYS A 154 -4.882 10.577 10.522 1.00 1.29 H new ATOM 0 HG3 LYS A 154 -4.032 10.944 12.009 1.00 1.29 H new ATOM 0 HD2 LYS A 154 -5.347 13.122 10.321 1.00 1.34 H new ATOM 0 HD3 LYS A 154 -6.224 12.261 11.571 1.00 1.34 H new ATOM 0 HE2 LYS A 154 -4.654 13.033 13.307 1.00 2.02 H new ATOM 0 HE3 LYS A 154 -3.561 13.690 12.106 1.00 2.02 H new ATOM 0 HZ1 LYS A 154 -5.058 15.417 12.966 1.00 2.51 H new ATOM 0 HZ2 LYS A 154 -5.354 15.155 11.315 1.00 2.51 H new ATOM 0 HZ3 LYS A 154 -6.414 14.518 12.479 1.00 2.51 H new ATOM 1078 N ASN A 155 -2.671 9.878 7.730 1.00 0.57 N ATOM 1079 CA ASN A 155 -3.269 9.020 6.655 1.00 0.47 C ATOM 1080 C ASN A 155 -2.514 7.692 6.535 1.00 0.37 C ATOM 1081 O ASN A 155 -2.968 6.777 5.872 1.00 0.34 O ATOM 1082 CB ASN A 155 -3.098 9.815 5.361 1.00 0.51 C ATOM 1083 CG ASN A 155 -4.107 10.962 5.308 1.00 0.76 C ATOM 1084 OD1 ASN A 155 -3.762 12.102 5.551 1.00 1.37 O ATOM 1085 ND2 ASN A 155 -5.346 10.711 4.986 1.00 1.03 N ATOM 0 H ASN A 155 -2.129 10.673 7.393 1.00 0.57 H new ATOM 0 HA ASN A 155 -4.311 8.786 6.871 1.00 0.47 H new ATOM 0 HB2 ASN A 155 -2.084 10.210 5.300 1.00 0.51 H new ATOM 0 HB3 ASN A 155 -3.237 9.159 4.502 1.00 0.51 H new ATOM 0 HD21 ASN A 155 -6.025 11.471 4.938 1.00 1.03 H new ATOM 0 HD22 ASN A 155 -5.636 9.755 4.782 1.00 1.03 H new ATOM 1092 N ALA A 156 -1.382 7.564 7.190 1.00 0.37 N ATOM 1093 CA ALA A 156 -0.621 6.280 7.123 1.00 0.33 C ATOM 1094 C ALA A 156 -1.447 5.153 7.748 1.00 0.28 C ATOM 1095 O ALA A 156 -1.122 3.990 7.595 1.00 0.28 O ATOM 1096 CB ALA A 156 0.637 6.494 7.975 1.00 0.41 C ATOM 0 H ALA A 156 -0.957 8.291 7.765 1.00 0.37 H new ATOM 0 HA ALA A 156 -0.387 6.012 6.093 1.00 0.33 H new ATOM 0 HB1 ALA A 156 1.240 5.586 7.967 1.00 0.41 H new ATOM 0 HB2 ALA A 156 1.218 7.320 7.565 1.00 0.41 H new ATOM 0 HB3 ALA A 156 0.347 6.728 8.999 1.00 0.41 H new ATOM 1102 N SER A 157 -2.509 5.479 8.454 1.00 0.28 N ATOM 1103 CA SER A 157 -3.323 4.408 9.085 1.00 0.28 C ATOM 1104 C SER A 157 -4.297 3.819 8.070 1.00 0.22 C ATOM 1105 O SER A 157 -4.479 4.335 6.975 1.00 0.21 O ATOM 1106 CB SER A 157 -4.091 5.091 10.213 1.00 0.34 C ATOM 1107 OG SER A 157 -4.535 6.372 9.780 1.00 1.05 O ATOM 0 H SER A 157 -2.837 6.431 8.614 1.00 0.28 H new ATOM 0 HA SER A 157 -2.702 3.591 9.452 1.00 0.28 H new ATOM 0 HB2 SER A 157 -4.944 4.480 10.508 1.00 0.34 H new ATOM 0 HB3 SER A 157 -3.453 5.193 11.091 1.00 0.34 H new ATOM 0 HG SER A 157 -3.903 7.057 10.084 1.00 1.05 H new ATOM 1113 N VAL A 158 -4.904 2.724 8.425 1.00 0.23 N ATOM 1114 CA VAL A 158 -5.851 2.061 7.491 1.00 0.22 C ATOM 1115 C VAL A 158 -7.006 2.988 7.121 1.00 0.18 C ATOM 1116 O VAL A 158 -7.376 3.062 5.972 1.00 0.18 O ATOM 1117 CB VAL A 158 -6.372 0.829 8.226 1.00 0.28 C ATOM 1118 CG1 VAL A 158 -5.206 -0.111 8.536 1.00 0.34 C ATOM 1119 CG2 VAL A 158 -7.056 1.236 9.538 1.00 0.27 C ATOM 0 H VAL A 158 -4.785 2.258 9.325 1.00 0.23 H new ATOM 0 HA VAL A 158 -5.355 1.796 6.557 1.00 0.22 H new ATOM 0 HB VAL A 158 -7.099 0.323 7.590 1.00 0.28 H new ATOM 0 HG11 VAL A 158 -5.578 -0.991 9.061 1.00 0.34 H new ATOM 0 HG12 VAL A 158 -4.729 -0.418 7.605 1.00 0.34 H new ATOM 0 HG13 VAL A 158 -4.479 0.405 9.163 1.00 0.34 H new ATOM 0 HG21 VAL A 158 -7.422 0.345 10.049 1.00 0.27 H new ATOM 0 HG22 VAL A 158 -6.340 1.753 10.177 1.00 0.27 H new ATOM 0 HG23 VAL A 158 -7.893 1.899 9.321 1.00 0.27 H new ATOM 1129 N ALA A 159 -7.573 3.702 8.071 1.00 0.15 N ATOM 1130 CA ALA A 159 -8.713 4.632 7.751 1.00 0.13 C ATOM 1131 C ALA A 159 -8.359 5.514 6.553 1.00 0.13 C ATOM 1132 O ALA A 159 -9.206 5.848 5.738 1.00 0.15 O ATOM 1133 CB ALA A 159 -8.909 5.475 9.010 1.00 0.12 C ATOM 0 H ALA A 159 -7.297 3.682 9.053 1.00 0.15 H new ATOM 0 HA ALA A 159 -9.622 4.092 7.484 1.00 0.13 H new ATOM 0 HB1 ALA A 159 -9.726 6.179 8.853 1.00 0.12 H new ATOM 0 HB2 ALA A 159 -9.148 4.823 9.851 1.00 0.12 H new ATOM 0 HB3 ALA A 159 -7.993 6.025 9.226 1.00 0.12 H new ATOM 1139 N GLY A 160 -7.105 5.853 6.425 1.00 0.13 N ATOM 1140 CA GLY A 160 -6.684 6.677 5.263 1.00 0.15 C ATOM 1141 C GLY A 160 -6.751 5.831 4.000 1.00 0.16 C ATOM 1142 O GLY A 160 -7.473 6.146 3.073 1.00 0.18 O ATOM 0 H GLY A 160 -6.360 5.596 7.072 1.00 0.13 H new ATOM 0 HA2 GLY A 160 -7.331 7.549 5.166 1.00 0.15 H new ATOM 0 HA3 GLY A 160 -5.670 7.048 5.413 1.00 0.15 H new ATOM 1146 N LEU A 161 -5.994 4.764 3.950 1.00 0.16 N ATOM 1147 CA LEU A 161 -6.005 3.899 2.731 1.00 0.18 C ATOM 1148 C LEU A 161 -7.377 3.244 2.490 1.00 0.20 C ATOM 1149 O LEU A 161 -7.837 3.185 1.366 1.00 0.28 O ATOM 1150 CB LEU A 161 -4.957 2.821 2.981 1.00 0.19 C ATOM 1151 CG LEU A 161 -4.815 1.979 1.714 1.00 0.22 C ATOM 1152 CD1 LEU A 161 -4.011 2.752 0.662 1.00 0.23 C ATOM 1153 CD2 LEU A 161 -4.108 0.662 2.052 1.00 0.27 C ATOM 0 H LEU A 161 -5.372 4.455 4.697 1.00 0.16 H new ATOM 0 HA LEU A 161 -5.793 4.496 1.844 1.00 0.18 H new ATOM 0 HB2 LEU A 161 -4.001 3.275 3.243 1.00 0.19 H new ATOM 0 HB3 LEU A 161 -5.252 2.193 3.822 1.00 0.19 H new ATOM 0 HG LEU A 161 -5.804 1.762 1.311 1.00 0.22 H new ATOM 0 HD11 LEU A 161 -3.913 2.146 -0.239 1.00 0.23 H new ATOM 0 HD12 LEU A 161 -4.527 3.681 0.420 1.00 0.23 H new ATOM 0 HD13 LEU A 161 -3.020 2.979 1.056 1.00 0.23 H new ATOM 0 HD21 LEU A 161 -4.007 0.061 1.148 1.00 0.27 H new ATOM 0 HD22 LEU A 161 -3.120 0.874 2.460 1.00 0.27 H new ATOM 0 HD23 LEU A 161 -4.694 0.113 2.789 1.00 0.27 H new ATOM 1165 N VAL A 162 -8.019 2.714 3.513 1.00 0.22 N ATOM 1166 CA VAL A 162 -9.335 2.025 3.290 1.00 0.26 C ATOM 1167 C VAL A 162 -10.322 2.986 2.647 1.00 0.29 C ATOM 1168 O VAL A 162 -11.022 2.638 1.718 1.00 0.34 O ATOM 1169 CB VAL A 162 -9.838 1.563 4.679 1.00 0.30 C ATOM 1170 CG1 VAL A 162 -8.759 0.731 5.389 1.00 0.30 C ATOM 1171 CG2 VAL A 162 -10.221 2.758 5.563 1.00 0.31 C ATOM 0 H VAL A 162 -7.692 2.729 4.479 1.00 0.22 H new ATOM 0 HA VAL A 162 -9.229 1.172 2.620 1.00 0.26 H new ATOM 0 HB VAL A 162 -10.726 0.952 4.518 1.00 0.30 H new ATOM 0 HG11 VAL A 162 -9.128 0.413 6.364 1.00 0.30 H new ATOM 0 HG12 VAL A 162 -8.522 -0.146 4.787 1.00 0.30 H new ATOM 0 HG13 VAL A 162 -7.861 1.335 5.520 1.00 0.30 H new ATOM 0 HG21 VAL A 162 -10.570 2.398 6.531 1.00 0.31 H new ATOM 0 HG22 VAL A 162 -9.351 3.398 5.706 1.00 0.31 H new ATOM 0 HG23 VAL A 162 -11.015 3.328 5.080 1.00 0.31 H new ATOM 1181 N LYS A 163 -10.360 4.195 3.123 1.00 0.29 N ATOM 1182 CA LYS A 163 -11.285 5.196 2.524 1.00 0.34 C ATOM 1183 C LYS A 163 -10.920 5.423 1.050 1.00 0.36 C ATOM 1184 O LYS A 163 -11.753 5.327 0.170 1.00 0.39 O ATOM 1185 CB LYS A 163 -11.087 6.474 3.345 1.00 0.33 C ATOM 1186 CG LYS A 163 -12.033 7.562 2.832 1.00 0.39 C ATOM 1187 CD LYS A 163 -11.883 8.821 3.689 1.00 1.30 C ATOM 1188 CE LYS A 163 -10.562 9.516 3.348 1.00 1.51 C ATOM 1189 NZ LYS A 163 -10.898 10.460 2.246 1.00 2.30 N ATOM 0 H LYS A 163 -9.793 4.535 3.899 1.00 0.29 H new ATOM 0 HA LYS A 163 -12.325 4.870 2.547 1.00 0.34 H new ATOM 0 HB2 LYS A 163 -11.281 6.276 4.399 1.00 0.33 H new ATOM 0 HB3 LYS A 163 -10.053 6.811 3.269 1.00 0.33 H new ATOM 0 HG2 LYS A 163 -11.809 7.791 1.790 1.00 0.39 H new ATOM 0 HG3 LYS A 163 -13.063 7.208 2.866 1.00 0.39 H new ATOM 0 HD2 LYS A 163 -12.719 9.497 3.510 1.00 1.30 H new ATOM 0 HD3 LYS A 163 -11.906 8.559 4.747 1.00 1.30 H new ATOM 0 HE2 LYS A 163 -10.159 10.045 4.212 1.00 1.51 H new ATOM 0 HE3 LYS A 163 -9.806 8.796 3.034 1.00 1.51 H new ATOM 0 HZ1 LYS A 163 -10.042 10.975 1.957 1.00 2.30 H new ATOM 0 HZ2 LYS A 163 -11.273 9.928 1.435 1.00 2.30 H new ATOM 0 HZ3 LYS A 163 -11.615 11.138 2.576 1.00 2.30 H new ATOM 1203 N ALA A 164 -9.673 5.723 0.788 1.00 0.36 N ATOM 1204 CA ALA A 164 -9.219 5.966 -0.620 1.00 0.39 C ATOM 1205 C ALA A 164 -9.309 4.702 -1.492 1.00 0.39 C ATOM 1206 O ALA A 164 -9.844 4.733 -2.583 1.00 0.33 O ATOM 1207 CB ALA A 164 -7.763 6.429 -0.498 1.00 0.44 C ATOM 0 H ALA A 164 -8.942 5.811 1.494 1.00 0.36 H new ATOM 0 HA ALA A 164 -9.856 6.703 -1.109 1.00 0.39 H new ATOM 0 HB1 ALA A 164 -7.360 6.627 -1.491 1.00 0.44 H new ATOM 0 HB2 ALA A 164 -7.720 7.340 0.100 1.00 0.44 H new ATOM 0 HB3 ALA A 164 -7.173 5.650 -0.016 1.00 0.44 H new ATOM 1213 N LEU A 165 -8.739 3.608 -1.044 1.00 0.50 N ATOM 1214 CA LEU A 165 -8.744 2.361 -1.873 1.00 0.55 C ATOM 1215 C LEU A 165 -10.168 1.863 -2.209 1.00 0.45 C ATOM 1216 O LEU A 165 -10.430 1.478 -3.335 1.00 0.42 O ATOM 1217 CB LEU A 165 -7.903 1.329 -1.081 1.00 0.80 C ATOM 1218 CG LEU A 165 -8.649 0.768 0.145 1.00 0.52 C ATOM 1219 CD1 LEU A 165 -9.631 -0.326 -0.289 1.00 1.47 C ATOM 1220 CD2 LEU A 165 -7.621 0.157 1.117 1.00 1.24 C ATOM 0 H LEU A 165 -8.271 3.525 -0.141 1.00 0.50 H new ATOM 0 HA LEU A 165 -8.309 2.542 -2.856 1.00 0.55 H new ATOM 0 HB2 LEU A 165 -7.629 0.507 -1.742 1.00 0.80 H new ATOM 0 HB3 LEU A 165 -6.975 1.798 -0.753 1.00 0.80 H new ATOM 0 HG LEU A 165 -9.201 1.574 0.629 1.00 0.52 H new ATOM 0 HD11 LEU A 165 -10.152 -0.715 0.586 1.00 1.47 H new ATOM 0 HD12 LEU A 165 -10.356 0.092 -0.987 1.00 1.47 H new ATOM 0 HD13 LEU A 165 -9.084 -1.134 -0.774 1.00 1.47 H new ATOM 0 HD21 LEU A 165 -8.138 -0.243 1.989 1.00 1.24 H new ATOM 0 HD22 LEU A 165 -7.079 -0.645 0.616 1.00 1.24 H new ATOM 0 HD23 LEU A 165 -6.918 0.927 1.434 1.00 1.24 H new ATOM 1232 N ARG A 166 -11.082 1.837 -1.267 1.00 0.47 N ATOM 1233 CA ARG A 166 -12.460 1.327 -1.583 1.00 0.45 C ATOM 1234 C ARG A 166 -13.254 2.321 -2.441 1.00 0.41 C ATOM 1235 O ARG A 166 -13.978 1.932 -3.339 1.00 0.52 O ATOM 1236 CB ARG A 166 -13.134 1.064 -0.223 1.00 0.52 C ATOM 1237 CG ARG A 166 -13.541 2.377 0.462 1.00 1.19 C ATOM 1238 CD ARG A 166 -13.856 2.102 1.936 1.00 1.53 C ATOM 1239 NE ARG A 166 -15.074 1.244 1.919 1.00 2.29 N ATOM 1240 CZ ARG A 166 -14.968 -0.048 2.084 1.00 2.88 C ATOM 1241 NH1 ARG A 166 -14.210 -0.524 3.035 1.00 3.25 N ATOM 1242 NH2 ARG A 166 -15.620 -0.865 1.301 1.00 3.60 N ATOM 0 H ARG A 166 -10.939 2.142 -0.304 1.00 0.47 H new ATOM 0 HA ARG A 166 -12.417 0.415 -2.179 1.00 0.45 H new ATOM 0 HB2 ARG A 166 -14.015 0.438 -0.366 1.00 0.52 H new ATOM 0 HB3 ARG A 166 -12.452 0.511 0.422 1.00 0.52 H new ATOM 0 HG2 ARG A 166 -12.736 3.108 0.380 1.00 1.19 H new ATOM 0 HG3 ARG A 166 -14.412 2.805 -0.034 1.00 1.19 H new ATOM 0 HD2 ARG A 166 -13.025 1.597 2.429 1.00 1.53 H new ATOM 0 HD3 ARG A 166 -14.034 3.029 2.481 1.00 1.53 H new ATOM 0 HE ARG A 166 -15.992 1.666 1.778 1.00 2.29 H new ATOM 0 HH11 ARG A 166 -13.701 0.113 3.648 1.00 3.25 H new ATOM 0 HH12 ARG A 166 -14.127 -1.532 3.164 1.00 3.25 H new ATOM 0 HH21 ARG A 166 -16.214 -0.495 0.559 1.00 3.60 H new ATOM 0 HH22 ARG A 166 -15.536 -1.873 1.432 1.00 3.60 H new ATOM 1256 N THR A 167 -13.128 3.594 -2.169 1.00 0.33 N ATOM 1257 CA THR A 167 -13.884 4.608 -2.967 1.00 0.36 C ATOM 1258 C THR A 167 -13.486 4.525 -4.436 1.00 0.35 C ATOM 1259 O THR A 167 -14.312 4.649 -5.323 1.00 0.41 O ATOM 1260 CB THR A 167 -13.481 5.964 -2.381 1.00 0.42 C ATOM 1261 OG1 THR A 167 -13.843 6.004 -1.008 1.00 0.44 O ATOM 1262 CG2 THR A 167 -14.190 7.102 -3.129 1.00 0.47 C ATOM 0 H THR A 167 -12.536 3.976 -1.431 1.00 0.33 H new ATOM 0 HA THR A 167 -14.961 4.448 -2.917 1.00 0.36 H new ATOM 0 HB THR A 167 -12.404 6.092 -2.487 1.00 0.42 H new ATOM 0 HG1 THR A 167 -13.038 6.114 -0.460 1.00 0.44 H new ATOM 0 HG21 THR A 167 -13.893 8.059 -2.701 1.00 0.47 H new ATOM 0 HG22 THR A 167 -13.912 7.074 -4.182 1.00 0.47 H new ATOM 0 HG23 THR A 167 -15.269 6.982 -3.036 1.00 0.47 H new ATOM 1270 N CYS A 168 -12.227 4.323 -4.693 1.00 0.32 N ATOM 1271 CA CYS A 168 -11.763 4.245 -6.102 1.00 0.36 C ATOM 1272 C CYS A 168 -12.136 2.896 -6.718 1.00 0.31 C ATOM 1273 O CYS A 168 -12.857 2.843 -7.696 1.00 0.34 O ATOM 1274 CB CYS A 168 -10.242 4.399 -6.026 1.00 0.40 C ATOM 1275 SG CYS A 168 -9.594 4.794 -7.668 1.00 1.38 S ATOM 0 H CYS A 168 -11.499 4.208 -3.988 1.00 0.32 H new ATOM 0 HA CYS A 168 -12.222 5.011 -6.727 1.00 0.36 H new ATOM 0 HB2 CYS A 168 -9.980 5.188 -5.321 1.00 0.40 H new ATOM 0 HB3 CYS A 168 -9.790 3.478 -5.657 1.00 0.40 H new ATOM 0 HG CYS A 168 -8.302 4.927 -7.604 1.00 1.38 H new ATOM 1281 N ARG A 169 -11.666 1.804 -6.151 1.00 0.30 N ATOM 1282 CA ARG A 169 -12.011 0.440 -6.729 1.00 0.31 C ATOM 1283 C ARG A 169 -11.386 -0.736 -5.955 1.00 0.26 C ATOM 1284 O ARG A 169 -11.693 -1.881 -6.232 1.00 0.34 O ATOM 1285 CB ARG A 169 -11.453 0.418 -8.160 1.00 0.44 C ATOM 1286 CG ARG A 169 -12.203 -0.640 -8.974 1.00 0.69 C ATOM 1287 CD ARG A 169 -13.587 -0.107 -9.354 1.00 0.84 C ATOM 1288 NE ARG A 169 -14.367 -1.309 -9.764 1.00 1.56 N ATOM 1289 CZ ARG A 169 -15.673 -1.288 -9.723 1.00 2.15 C ATOM 1290 NH1 ARG A 169 -16.331 -0.349 -10.348 1.00 2.74 N ATOM 1291 NH2 ARG A 169 -16.320 -2.206 -9.058 1.00 2.73 N ATOM 0 H ARG A 169 -11.067 1.788 -5.326 1.00 0.30 H new ATOM 0 HA ARG A 169 -13.092 0.311 -6.676 1.00 0.31 H new ATOM 0 HB2 ARG A 169 -11.566 1.398 -8.623 1.00 0.44 H new ATOM 0 HB3 ARG A 169 -10.386 0.194 -8.144 1.00 0.44 H new ATOM 0 HG2 ARG A 169 -11.639 -0.890 -9.872 1.00 0.69 H new ATOM 0 HG3 ARG A 169 -12.302 -1.558 -8.394 1.00 0.69 H new ATOM 0 HD2 ARG A 169 -14.059 0.401 -8.513 1.00 0.84 H new ATOM 0 HD3 ARG A 169 -13.521 0.616 -10.167 1.00 0.84 H new ATOM 0 HE ARG A 169 -13.881 -2.149 -10.077 1.00 1.56 H new ATOM 0 HH11 ARG A 169 -15.826 0.368 -10.868 1.00 2.74 H new ATOM 0 HH12 ARG A 169 -17.350 -0.333 -10.316 1.00 2.74 H new ATOM 0 HH21 ARG A 169 -15.806 -2.940 -8.570 1.00 2.73 H new ATOM 0 HH22 ARG A 169 -17.339 -2.190 -9.026 1.00 2.73 H new ATOM 1305 N LEU A 170 -10.484 -0.486 -5.045 1.00 0.20 N ATOM 1306 CA LEU A 170 -9.804 -1.610 -4.322 1.00 0.17 C ATOM 1307 C LEU A 170 -10.682 -2.206 -3.211 1.00 0.19 C ATOM 1308 O LEU A 170 -10.278 -2.314 -2.071 1.00 0.23 O ATOM 1309 CB LEU A 170 -8.548 -0.958 -3.739 1.00 0.18 C ATOM 1310 CG LEU A 170 -7.648 -0.450 -4.876 1.00 0.21 C ATOM 1311 CD1 LEU A 170 -7.642 1.084 -4.905 1.00 0.26 C ATOM 1312 CD2 LEU A 170 -6.221 -0.934 -4.640 1.00 0.25 C ATOM 0 H LEU A 170 -10.185 0.449 -4.767 1.00 0.20 H new ATOM 0 HA LEU A 170 -9.587 -2.448 -4.984 1.00 0.17 H new ATOM 0 HB2 LEU A 170 -8.827 -0.131 -3.086 1.00 0.18 H new ATOM 0 HB3 LEU A 170 -8.004 -1.678 -3.127 1.00 0.18 H new ATOM 0 HG LEU A 170 -8.031 -0.830 -5.823 1.00 0.21 H new ATOM 0 HD11 LEU A 170 -7.000 1.430 -5.715 1.00 0.26 H new ATOM 0 HD12 LEU A 170 -8.657 1.449 -5.064 1.00 0.26 H new ATOM 0 HD13 LEU A 170 -7.265 1.464 -3.956 1.00 0.26 H new ATOM 0 HD21 LEU A 170 -5.578 -0.576 -5.444 1.00 0.25 H new ATOM 0 HD22 LEU A 170 -5.859 -0.548 -3.687 1.00 0.25 H new ATOM 0 HD23 LEU A 170 -6.205 -2.024 -4.620 1.00 0.25 H new ATOM 1324 N ASN A 171 -11.875 -2.616 -3.541 1.00 0.24 N ATOM 1325 CA ASN A 171 -12.781 -3.221 -2.515 1.00 0.30 C ATOM 1326 C ASN A 171 -12.116 -4.438 -1.853 1.00 0.24 C ATOM 1327 O ASN A 171 -12.395 -4.765 -0.714 1.00 0.25 O ATOM 1328 CB ASN A 171 -14.014 -3.659 -3.302 1.00 0.40 C ATOM 1329 CG ASN A 171 -15.248 -3.531 -2.418 1.00 0.50 C ATOM 1330 OD1 ASN A 171 -15.808 -4.514 -1.976 1.00 0.58 O ATOM 1331 ND2 ASN A 171 -15.698 -2.340 -2.148 1.00 0.59 N ATOM 0 H ASN A 171 -12.267 -2.559 -4.481 1.00 0.24 H new ATOM 0 HA ASN A 171 -13.021 -2.520 -1.715 1.00 0.30 H new ATOM 0 HB2 ASN A 171 -14.127 -3.044 -4.195 1.00 0.40 H new ATOM 0 HB3 ASN A 171 -13.898 -4.690 -3.637 1.00 0.40 H new ATOM 0 HD21 ASN A 171 -16.525 -2.228 -1.562 1.00 0.59 H new ATOM 0 HD22 ASN A 171 -15.223 -1.518 -2.522 1.00 0.59 H new ATOM 1338 N LEU A 172 -11.267 -5.127 -2.574 1.00 0.21 N ATOM 1339 CA LEU A 172 -10.603 -6.351 -2.006 1.00 0.21 C ATOM 1340 C LEU A 172 -9.850 -6.051 -0.711 1.00 0.17 C ATOM 1341 O LEU A 172 -10.160 -6.585 0.336 1.00 0.21 O ATOM 1342 CB LEU A 172 -9.589 -6.784 -3.066 1.00 0.23 C ATOM 1343 CG LEU A 172 -10.319 -7.333 -4.291 1.00 0.32 C ATOM 1344 CD1 LEU A 172 -9.320 -7.526 -5.434 1.00 1.13 C ATOM 1345 CD2 LEU A 172 -10.949 -8.681 -3.936 1.00 0.85 C ATOM 0 H LEU A 172 -11.002 -4.898 -3.532 1.00 0.21 H new ATOM 0 HA LEU A 172 -11.349 -7.111 -1.773 1.00 0.21 H new ATOM 0 HB2 LEU A 172 -8.966 -5.937 -3.353 1.00 0.23 H new ATOM 0 HB3 LEU A 172 -8.924 -7.545 -2.657 1.00 0.23 H new ATOM 0 HG LEU A 172 -11.095 -6.633 -4.601 1.00 0.32 H new ATOM 0 HD11 LEU A 172 -9.839 -7.918 -6.309 1.00 1.13 H new ATOM 0 HD12 LEU A 172 -8.862 -6.569 -5.682 1.00 1.13 H new ATOM 0 HD13 LEU A 172 -8.546 -8.229 -5.126 1.00 1.13 H new ATOM 0 HD21 LEU A 172 -11.472 -9.079 -4.806 1.00 0.85 H new ATOM 0 HD22 LEU A 172 -10.169 -9.378 -3.631 1.00 0.85 H new ATOM 0 HD23 LEU A 172 -11.656 -8.548 -3.117 1.00 0.85 H new ATOM 1357 N VAL A 173 -8.857 -5.211 -0.778 1.00 0.16 N ATOM 1358 CA VAL A 173 -8.060 -4.890 0.444 1.00 0.21 C ATOM 1359 C VAL A 173 -8.932 -4.203 1.490 1.00 0.22 C ATOM 1360 O VAL A 173 -8.770 -4.427 2.676 1.00 0.25 O ATOM 1361 CB VAL A 173 -6.913 -3.983 -0.024 1.00 0.29 C ATOM 1362 CG1 VAL A 173 -5.969 -4.795 -0.914 1.00 0.38 C ATOM 1363 CG2 VAL A 173 -7.450 -2.783 -0.817 1.00 0.34 C ATOM 0 H VAL A 173 -8.560 -4.730 -1.627 1.00 0.16 H new ATOM 0 HA VAL A 173 -7.670 -5.790 0.920 1.00 0.21 H new ATOM 0 HB VAL A 173 -6.383 -3.608 0.852 1.00 0.29 H new ATOM 0 HG11 VAL A 173 -5.151 -4.159 -1.252 1.00 0.38 H new ATOM 0 HG12 VAL A 173 -5.566 -5.634 -0.347 1.00 0.38 H new ATOM 0 HG13 VAL A 173 -6.517 -5.171 -1.778 1.00 0.38 H new ATOM 0 HG21 VAL A 173 -6.617 -2.156 -1.137 1.00 0.34 H new ATOM 0 HG22 VAL A 173 -7.993 -3.139 -1.692 1.00 0.34 H new ATOM 0 HG23 VAL A 173 -8.121 -2.200 -0.186 1.00 0.34 H new ATOM 1373 N ALA A 174 -9.871 -3.393 1.072 1.00 0.27 N ATOM 1374 CA ALA A 174 -10.770 -2.726 2.064 1.00 0.34 C ATOM 1375 C ALA A 174 -11.516 -3.797 2.878 1.00 0.29 C ATOM 1376 O ALA A 174 -11.646 -3.704 4.080 1.00 0.32 O ATOM 1377 CB ALA A 174 -11.752 -1.893 1.231 1.00 0.43 C ATOM 0 H ALA A 174 -10.054 -3.165 0.095 1.00 0.27 H new ATOM 0 HA ALA A 174 -10.223 -2.101 2.770 1.00 0.34 H new ATOM 0 HB1 ALA A 174 -12.444 -1.374 1.895 1.00 0.43 H new ATOM 0 HB2 ALA A 174 -11.199 -1.162 0.640 1.00 0.43 H new ATOM 0 HB3 ALA A 174 -12.312 -2.549 0.565 1.00 0.43 H new ATOM 1383 N ASP A 175 -12.008 -4.810 2.216 1.00 0.24 N ATOM 1384 CA ASP A 175 -12.744 -5.901 2.931 1.00 0.23 C ATOM 1385 C ASP A 175 -11.857 -6.602 3.970 1.00 0.17 C ATOM 1386 O ASP A 175 -12.310 -6.916 5.053 1.00 0.20 O ATOM 1387 CB ASP A 175 -13.163 -6.881 1.833 1.00 0.27 C ATOM 1388 CG ASP A 175 -14.251 -6.240 0.966 1.00 0.37 C ATOM 1389 OD1 ASP A 175 -15.006 -5.435 1.488 1.00 0.80 O ATOM 1390 OD2 ASP A 175 -14.302 -6.559 -0.210 1.00 0.99 O ATOM 0 H ASP A 175 -11.933 -4.932 1.206 1.00 0.24 H new ATOM 0 HA ASP A 175 -13.595 -5.507 3.486 1.00 0.23 H new ATOM 0 HB2 ASP A 175 -12.302 -7.146 1.219 1.00 0.27 H new ATOM 0 HB3 ASP A 175 -13.534 -7.805 2.277 1.00 0.27 H new ATOM 1395 N LEU A 176 -10.614 -6.881 3.645 1.00 0.14 N ATOM 1396 CA LEU A 176 -9.727 -7.599 4.627 1.00 0.20 C ATOM 1397 C LEU A 176 -9.518 -6.756 5.888 1.00 0.25 C ATOM 1398 O LEU A 176 -9.777 -7.200 6.992 1.00 0.27 O ATOM 1399 CB LEU A 176 -8.380 -7.815 3.906 1.00 0.28 C ATOM 1400 CG LEU A 176 -8.428 -8.953 2.841 1.00 0.49 C ATOM 1401 CD1 LEU A 176 -9.824 -9.137 2.219 1.00 1.33 C ATOM 1402 CD2 LEU A 176 -7.421 -8.631 1.722 1.00 1.09 C ATOM 0 H LEU A 176 -10.177 -6.647 2.754 1.00 0.14 H new ATOM 0 HA LEU A 176 -10.174 -8.542 4.942 1.00 0.20 H new ATOM 0 HB2 LEU A 176 -8.082 -6.885 3.421 1.00 0.28 H new ATOM 0 HB3 LEU A 176 -7.614 -8.050 4.645 1.00 0.28 H new ATOM 0 HG LEU A 176 -8.176 -9.883 3.350 1.00 0.49 H new ATOM 0 HD11 LEU A 176 -9.792 -9.943 1.486 1.00 1.33 H new ATOM 0 HD12 LEU A 176 -10.541 -9.386 3.001 1.00 1.33 H new ATOM 0 HD13 LEU A 176 -10.129 -8.212 1.729 1.00 1.33 H new ATOM 0 HD21 LEU A 176 -7.446 -9.421 0.971 1.00 1.09 H new ATOM 0 HD22 LEU A 176 -7.685 -7.681 1.258 1.00 1.09 H new ATOM 0 HD23 LEU A 176 -6.418 -8.563 2.144 1.00 1.09 H new ATOM 1414 N VAL A 177 -9.053 -5.548 5.729 1.00 0.33 N ATOM 1415 CA VAL A 177 -8.828 -4.669 6.915 1.00 0.41 C ATOM 1416 C VAL A 177 -10.164 -4.389 7.617 1.00 0.37 C ATOM 1417 O VAL A 177 -10.227 -4.262 8.826 1.00 0.39 O ATOM 1418 CB VAL A 177 -8.204 -3.379 6.362 1.00 0.52 C ATOM 1419 CG1 VAL A 177 -6.880 -3.707 5.666 1.00 0.58 C ATOM 1420 CG2 VAL A 177 -9.150 -2.727 5.352 1.00 0.52 C ATOM 0 H VAL A 177 -8.818 -5.129 4.829 1.00 0.33 H new ATOM 0 HA VAL A 177 -8.175 -5.130 7.656 1.00 0.41 H new ATOM 0 HB VAL A 177 -8.029 -2.691 7.189 1.00 0.52 H new ATOM 0 HG11 VAL A 177 -6.438 -2.791 5.274 1.00 0.58 H new ATOM 0 HG12 VAL A 177 -6.196 -4.162 6.382 1.00 0.58 H new ATOM 0 HG13 VAL A 177 -7.062 -4.402 4.846 1.00 0.58 H new ATOM 0 HG21 VAL A 177 -8.697 -1.813 4.967 1.00 0.52 H new ATOM 0 HG22 VAL A 177 -9.334 -3.416 4.528 1.00 0.52 H new ATOM 0 HG23 VAL A 177 -10.094 -2.486 5.841 1.00 0.52 H new ATOM 1430 N GLU A 178 -11.228 -4.290 6.859 1.00 0.36 N ATOM 1431 CA GLU A 178 -12.573 -4.018 7.464 1.00 0.39 C ATOM 1432 C GLU A 178 -12.983 -5.132 8.435 1.00 0.31 C ATOM 1433 O GLU A 178 -13.275 -4.886 9.591 1.00 0.34 O ATOM 1434 CB GLU A 178 -13.527 -3.992 6.262 1.00 0.45 C ATOM 1435 CG GLU A 178 -14.984 -3.857 6.724 1.00 0.51 C ATOM 1436 CD GLU A 178 -15.232 -2.463 7.316 1.00 1.32 C ATOM 1437 OE1 GLU A 178 -14.446 -1.568 7.045 1.00 1.85 O ATOM 1438 OE2 GLU A 178 -16.210 -2.315 8.031 1.00 1.85 O ATOM 0 H GLU A 178 -11.225 -4.386 5.844 1.00 0.36 H new ATOM 0 HA GLU A 178 -12.581 -3.092 8.039 1.00 0.39 H new ATOM 0 HB2 GLU A 178 -13.270 -3.160 5.606 1.00 0.45 H new ATOM 0 HB3 GLU A 178 -13.409 -4.905 5.679 1.00 0.45 H new ATOM 0 HG2 GLU A 178 -15.656 -4.026 5.883 1.00 0.51 H new ATOM 0 HG3 GLU A 178 -15.208 -4.620 7.469 1.00 0.51 H new ATOM 1445 N GLU A 179 -13.026 -6.348 7.960 1.00 0.25 N ATOM 1446 CA GLU A 179 -13.447 -7.480 8.834 1.00 0.24 C ATOM 1447 C GLU A 179 -12.458 -7.645 9.988 1.00 0.25 C ATOM 1448 O GLU A 179 -12.816 -8.087 11.058 1.00 0.39 O ATOM 1449 CB GLU A 179 -13.472 -8.713 7.916 1.00 0.31 C ATOM 1450 CG GLU A 179 -12.063 -9.014 7.395 1.00 1.03 C ATOM 1451 CD GLU A 179 -12.063 -10.329 6.606 1.00 1.32 C ATOM 1452 OE1 GLU A 179 -12.946 -11.143 6.833 1.00 1.76 O ATOM 1453 OE2 GLU A 179 -11.178 -10.500 5.783 1.00 1.92 O ATOM 0 H GLU A 179 -12.787 -6.606 7.003 1.00 0.25 H new ATOM 0 HA GLU A 179 -14.423 -7.319 9.292 1.00 0.24 H new ATOM 0 HB2 GLU A 179 -13.857 -9.574 8.462 1.00 0.31 H new ATOM 0 HB3 GLU A 179 -14.148 -8.538 7.079 1.00 0.31 H new ATOM 0 HG2 GLU A 179 -11.720 -8.199 6.758 1.00 1.03 H new ATOM 0 HG3 GLU A 179 -11.365 -9.081 8.229 1.00 1.03 H new ATOM 1460 N ALA A 180 -11.220 -7.287 9.774 1.00 0.26 N ATOM 1461 CA ALA A 180 -10.203 -7.405 10.859 1.00 0.38 C ATOM 1462 C ALA A 180 -10.446 -6.346 11.949 1.00 0.44 C ATOM 1463 O ALA A 180 -10.173 -6.575 13.112 1.00 0.60 O ATOM 1464 CB ALA A 180 -8.850 -7.184 10.172 1.00 0.50 C ATOM 0 H ALA A 180 -10.868 -6.917 8.891 1.00 0.26 H new ATOM 0 HA ALA A 180 -10.248 -8.374 11.356 1.00 0.38 H new ATOM 0 HB1 ALA A 180 -8.051 -7.256 10.910 1.00 0.50 H new ATOM 0 HB2 ALA A 180 -8.704 -7.943 9.403 1.00 0.50 H new ATOM 0 HB3 ALA A 180 -8.832 -6.195 9.714 1.00 0.50 H new