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 122 SER OG : rot -140:sc= 0 USER MOD Set 1.2: A 125 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0941) USER MOD Single : A 96 TYR OH : rot 165:sc= 0 USER MOD Single : A 98 GLN : amide:sc= 0 K(o=0,f=-0.87) USER MOD Single : A 105 CYS SG : rot -169:sc= -2.83! USER MOD Single : A 107 ASN : amide:sc= -4.39! C(o=-4.4!,f=-4.5!) USER MOD Single : A 113 LYS NZ :NH3+ 147:sc= -1.18 (180deg=-3.41!) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 MET CE :methyl -161:sc= -0.767 (180deg=-1.38!) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 TYR OH : rot -74:sc= -0.509 USER MOD Single : A 136 SER OG : rot 144:sc= -1.41 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 144 SER OG : rot -21:sc= 0.196 USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 LYS NZ :NH3+ 148:sc= 0.447 (180deg=-0.905) USER MOD Single : A 150 ASN : amide:sc= -0.684 K(o=-0.68,f=-0.048) 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 -91:sc= 1.16 USER MOD Single : A 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 THR OG1 : rot 127:sc= 0.945 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 7.862 9.950 9.643 1.00 0.96 N ATOM 12 CA ALA A 90 7.249 8.803 8.904 1.00 0.72 C ATOM 13 C ALA A 90 6.041 8.310 9.703 1.00 0.58 C ATOM 14 O ALA A 90 5.709 8.911 10.708 1.00 1.23 O ATOM 15 CB ALA A 90 8.355 7.744 8.841 1.00 1.03 C ATOM 0 HA ALA A 90 6.898 9.056 7.903 1.00 0.72 H new ATOM 0 HB1 ALA A 90 7.987 6.865 8.312 1.00 1.03 H new ATOM 0 HB2 ALA A 90 9.218 8.150 8.313 1.00 1.03 H new ATOM 0 HB3 ALA A 90 8.648 7.463 9.853 1.00 1.03 H new ATOM 21 N PRO A 91 5.400 7.249 9.260 1.00 0.79 N ATOM 22 CA PRO A 91 4.222 6.752 10.003 1.00 1.10 C ATOM 23 C PRO A 91 4.647 6.299 11.404 1.00 0.60 C ATOM 24 O PRO A 91 5.334 5.305 11.542 1.00 0.91 O ATOM 25 CB PRO A 91 3.719 5.584 9.155 1.00 1.98 C ATOM 26 CG PRO A 91 4.909 5.154 8.371 1.00 2.18 C ATOM 27 CD PRO A 91 5.683 6.411 8.082 1.00 1.62 C ATOM 0 HA PRO A 91 3.448 7.504 10.152 1.00 1.10 H new ATOM 0 HB2 PRO A 91 3.341 4.774 9.779 1.00 1.98 H new ATOM 0 HB3 PRO A 91 2.902 5.891 8.501 1.00 1.98 H new ATOM 0 HG2 PRO A 91 5.513 4.443 8.935 1.00 2.18 H new ATOM 0 HG3 PRO A 91 4.611 4.657 7.448 1.00 2.18 H new ATOM 0 HD2 PRO A 91 6.749 6.213 7.974 1.00 1.62 H new ATOM 0 HD3 PRO A 91 5.352 6.886 7.159 1.00 1.62 H new ATOM 35 N PRO A 92 4.228 7.037 12.416 1.00 0.59 N ATOM 36 CA PRO A 92 4.592 6.672 13.809 1.00 0.84 C ATOM 37 C PRO A 92 4.043 5.279 14.121 1.00 0.71 C ATOM 38 O PRO A 92 4.774 4.398 14.538 1.00 0.83 O ATOM 39 CB PRO A 92 3.954 7.778 14.654 1.00 1.49 C ATOM 40 CG PRO A 92 2.866 8.325 13.792 1.00 1.64 C ATOM 41 CD PRO A 92 3.387 8.242 12.381 1.00 1.21 C ATOM 0 HA PRO A 92 5.663 6.612 14.000 1.00 0.84 H new ATOM 0 HB2 PRO A 92 3.559 7.384 15.590 1.00 1.49 H new ATOM 0 HB3 PRO A 92 4.680 8.548 14.914 1.00 1.49 H new ATOM 0 HG2 PRO A 92 1.948 7.748 13.906 1.00 1.64 H new ATOM 0 HG3 PRO A 92 2.631 9.354 14.063 1.00 1.64 H new ATOM 0 HD2 PRO A 92 2.578 8.150 11.656 1.00 1.21 H new ATOM 0 HD3 PRO A 92 3.960 9.128 12.109 1.00 1.21 H new ATOM 49 N GLY A 93 2.779 5.055 13.870 1.00 0.65 N ATOM 50 CA GLY A 93 2.209 3.694 14.095 1.00 0.71 C ATOM 51 C GLY A 93 2.442 2.828 12.851 1.00 0.58 C ATOM 52 O GLY A 93 1.517 2.259 12.304 1.00 0.58 O ATOM 0 H GLY A 93 2.121 5.751 13.521 1.00 0.65 H new ATOM 0 HA2 GLY A 93 2.676 3.232 14.965 1.00 0.71 H new ATOM 0 HA3 GLY A 93 1.142 3.766 14.306 1.00 0.71 H new ATOM 56 N GLU A 94 3.669 2.726 12.401 1.00 0.56 N ATOM 57 CA GLU A 94 3.968 1.899 11.190 1.00 0.55 C ATOM 58 C GLU A 94 3.566 0.453 11.437 1.00 0.49 C ATOM 59 O GLU A 94 3.120 -0.233 10.539 1.00 0.53 O ATOM 60 CB GLU A 94 5.479 2.007 10.975 1.00 0.66 C ATOM 61 CG GLU A 94 5.875 1.222 9.716 1.00 1.09 C ATOM 62 CD GLU A 94 7.390 1.322 9.477 1.00 1.10 C ATOM 63 OE1 GLU A 94 8.055 2.027 10.223 1.00 1.44 O ATOM 64 OE2 GLU A 94 7.861 0.686 8.549 1.00 1.62 O ATOM 0 H GLU A 94 4.479 3.181 12.822 1.00 0.56 H new ATOM 0 HA GLU A 94 3.417 2.244 10.315 1.00 0.55 H new ATOM 0 HB2 GLU A 94 5.768 3.053 10.870 1.00 0.66 H new ATOM 0 HB3 GLU A 94 6.009 1.615 11.843 1.00 0.66 H new ATOM 0 HG2 GLU A 94 5.586 0.177 9.825 1.00 1.09 H new ATOM 0 HG3 GLU A 94 5.337 1.613 8.852 1.00 1.09 H new ATOM 71 N ALA A 95 3.721 -0.019 12.647 1.00 0.49 N ATOM 72 CA ALA A 95 3.346 -1.433 12.947 1.00 0.50 C ATOM 73 C ALA A 95 1.874 -1.663 12.600 1.00 0.38 C ATOM 74 O ALA A 95 1.532 -2.639 11.955 1.00 0.36 O ATOM 75 CB ALA A 95 3.583 -1.609 14.450 1.00 0.61 C ATOM 0 H ALA A 95 4.089 0.511 13.437 1.00 0.49 H new ATOM 0 HA ALA A 95 3.929 -2.148 12.367 1.00 0.50 H new ATOM 0 HB1 ALA A 95 3.327 -2.628 14.742 1.00 0.61 H new ATOM 0 HB2 ALA A 95 4.632 -1.419 14.678 1.00 0.61 H new ATOM 0 HB3 ALA A 95 2.959 -0.906 15.002 1.00 0.61 H new ATOM 81 N TYR A 96 1.005 -0.764 12.996 1.00 0.38 N ATOM 82 CA TYR A 96 -0.439 -0.933 12.653 1.00 0.35 C ATOM 83 C TYR A 96 -0.614 -0.868 11.135 1.00 0.28 C ATOM 84 O TYR A 96 -1.232 -1.724 10.529 1.00 0.29 O ATOM 85 CB TYR A 96 -1.169 0.226 13.336 1.00 0.42 C ATOM 86 CG TYR A 96 -2.653 0.089 13.090 1.00 0.73 C ATOM 87 CD1 TYR A 96 -3.357 -0.982 13.653 1.00 1.54 C ATOM 88 CD2 TYR A 96 -3.323 1.026 12.293 1.00 1.47 C ATOM 89 CE1 TYR A 96 -4.730 -1.117 13.420 1.00 1.93 C ATOM 90 CE2 TYR A 96 -4.697 0.890 12.060 1.00 1.85 C ATOM 91 CZ TYR A 96 -5.401 -0.181 12.623 1.00 1.77 C ATOM 92 OH TYR A 96 -6.755 -0.314 12.393 1.00 2.32 O ATOM 0 H TYR A 96 1.232 0.071 13.536 1.00 0.38 H new ATOM 0 HA TYR A 96 -0.834 -1.893 12.986 1.00 0.35 H new ATOM 0 HB2 TYR A 96 -0.963 0.221 14.406 1.00 0.42 H new ATOM 0 HB3 TYR A 96 -0.810 1.178 12.946 1.00 0.42 H new ATOM 0 HD1 TYR A 96 -2.840 -1.704 14.267 1.00 1.54 H new ATOM 0 HD2 TYR A 96 -2.780 1.853 11.859 1.00 1.47 H new ATOM 0 HE1 TYR A 96 -5.273 -1.943 13.855 1.00 1.93 H new ATOM 0 HE2 TYR A 96 -5.214 1.612 11.445 1.00 1.85 H new ATOM 0 HH TYR A 96 -7.110 0.526 12.033 1.00 2.32 H new ATOM 102 N LEU A 97 -0.063 0.149 10.522 1.00 0.42 N ATOM 103 CA LEU A 97 -0.176 0.294 9.039 1.00 0.55 C ATOM 104 C LEU A 97 0.448 -0.910 8.336 1.00 0.43 C ATOM 105 O LEU A 97 -0.078 -1.406 7.357 1.00 0.35 O ATOM 106 CB LEU A 97 0.579 1.586 8.697 1.00 0.90 C ATOM 107 CG LEU A 97 0.546 1.839 7.182 1.00 0.94 C ATOM 108 CD1 LEU A 97 -0.903 1.907 6.682 1.00 1.33 C ATOM 109 CD2 LEU A 97 1.247 3.167 6.878 1.00 1.75 C ATOM 0 H LEU A 97 0.463 0.889 10.988 1.00 0.42 H new ATOM 0 HA LEU A 97 -1.214 0.340 8.710 1.00 0.55 H new ATOM 0 HB2 LEU A 97 0.129 2.428 9.223 1.00 0.90 H new ATOM 0 HB3 LEU A 97 1.612 1.513 9.038 1.00 0.90 H new ATOM 0 HG LEU A 97 1.057 1.020 6.675 1.00 0.94 H new ATOM 0 HD11 LEU A 97 -0.909 2.087 5.607 1.00 1.33 H new ATOM 0 HD12 LEU A 97 -1.406 0.964 6.895 1.00 1.33 H new ATOM 0 HD13 LEU A 97 -1.425 2.719 7.188 1.00 1.33 H new ATOM 0 HD21 LEU A 97 1.227 3.352 5.804 1.00 1.75 H new ATOM 0 HD22 LEU A 97 0.732 3.977 7.395 1.00 1.75 H new ATOM 0 HD23 LEU A 97 2.281 3.119 7.218 1.00 1.75 H new ATOM 121 N GLN A 98 1.563 -1.385 8.829 1.00 0.47 N ATOM 122 CA GLN A 98 2.220 -2.564 8.190 1.00 0.49 C ATOM 123 C GLN A 98 1.279 -3.770 8.240 1.00 0.38 C ATOM 124 O GLN A 98 1.185 -4.529 7.294 1.00 0.39 O ATOM 125 CB GLN A 98 3.485 -2.827 9.005 1.00 0.63 C ATOM 126 CG GLN A 98 4.309 -3.918 8.319 1.00 0.57 C ATOM 127 CD GLN A 98 5.682 -4.018 8.986 1.00 1.24 C ATOM 128 OE1 GLN A 98 5.837 -3.668 10.139 1.00 2.00 O ATOM 129 NE2 GLN A 98 6.692 -4.482 8.303 1.00 2.04 N ATOM 0 H GLN A 98 2.046 -1.008 9.645 1.00 0.47 H new ATOM 0 HA GLN A 98 2.459 -2.384 7.142 1.00 0.49 H new ATOM 0 HB2 GLN A 98 4.072 -1.913 9.093 1.00 0.63 H new ATOM 0 HB3 GLN A 98 3.222 -3.135 10.017 1.00 0.63 H new ATOM 0 HG2 GLN A 98 3.791 -4.875 8.384 1.00 0.57 H new ATOM 0 HG3 GLN A 98 4.424 -3.689 7.259 1.00 0.57 H new ATOM 0 HE21 GLN A 98 6.561 -4.776 7.335 1.00 2.04 H new ATOM 0 HE22 GLN A 98 7.612 -4.551 8.737 1.00 2.04 H new ATOM 138 N VAL A 99 0.576 -3.951 9.336 1.00 0.33 N ATOM 139 CA VAL A 99 -0.364 -5.112 9.438 1.00 0.31 C ATOM 140 C VAL A 99 -1.420 -5.006 8.329 1.00 0.24 C ATOM 141 O VAL A 99 -1.692 -5.968 7.633 1.00 0.30 O ATOM 142 CB VAL A 99 -1.000 -4.998 10.834 1.00 0.32 C ATOM 143 CG1 VAL A 99 -2.108 -6.048 11.002 1.00 0.43 C ATOM 144 CG2 VAL A 99 0.079 -5.225 11.896 1.00 0.43 C ATOM 0 H VAL A 99 0.613 -3.348 10.158 1.00 0.33 H new ATOM 0 HA VAL A 99 0.132 -6.075 9.315 1.00 0.31 H new ATOM 0 HB VAL A 99 -1.435 -4.005 10.948 1.00 0.32 H new ATOM 0 HG11 VAL A 99 -2.549 -5.956 11.994 1.00 0.43 H new ATOM 0 HG12 VAL A 99 -2.877 -5.889 10.247 1.00 0.43 H new ATOM 0 HG13 VAL A 99 -1.685 -7.046 10.884 1.00 0.43 H new ATOM 0 HG21 VAL A 99 -0.365 -5.146 12.888 1.00 0.43 H new ATOM 0 HG22 VAL A 99 0.510 -6.218 11.770 1.00 0.43 H new ATOM 0 HG23 VAL A 99 0.861 -4.473 11.787 1.00 0.43 H new ATOM 154 N ALA A 100 -1.995 -3.843 8.146 1.00 0.18 N ATOM 155 CA ALA A 100 -3.008 -3.679 7.060 1.00 0.18 C ATOM 156 C ALA A 100 -2.317 -3.844 5.709 1.00 0.14 C ATOM 157 O ALA A 100 -2.764 -4.587 4.865 1.00 0.14 O ATOM 158 CB ALA A 100 -3.557 -2.260 7.221 1.00 0.24 C ATOM 0 H ALA A 100 -1.808 -3.006 8.698 1.00 0.18 H new ATOM 0 HA ALA A 100 -3.809 -4.416 7.115 1.00 0.18 H new ATOM 0 HB1 ALA A 100 -4.308 -2.071 6.454 1.00 0.24 H new ATOM 0 HB2 ALA A 100 -4.011 -2.155 8.207 1.00 0.24 H new ATOM 0 HB3 ALA A 100 -2.744 -1.541 7.118 1.00 0.24 H new ATOM 164 N PHE A 101 -1.206 -3.176 5.520 1.00 0.15 N ATOM 165 CA PHE A 101 -0.441 -3.301 4.235 1.00 0.16 C ATOM 166 C PHE A 101 -0.069 -4.762 3.974 1.00 0.17 C ATOM 167 O PHE A 101 0.238 -5.124 2.867 1.00 0.20 O ATOM 168 CB PHE A 101 0.848 -2.484 4.446 1.00 0.19 C ATOM 169 CG PHE A 101 0.646 -0.977 4.269 1.00 0.25 C ATOM 170 CD1 PHE A 101 -0.614 -0.410 3.982 1.00 1.21 C ATOM 171 CD2 PHE A 101 1.761 -0.137 4.405 1.00 1.10 C ATOM 172 CE1 PHE A 101 -0.740 0.975 3.838 1.00 1.26 C ATOM 173 CE2 PHE A 101 1.627 1.248 4.259 1.00 1.10 C ATOM 174 CZ PHE A 101 0.378 1.803 3.977 1.00 0.43 C ATOM 0 H PHE A 101 -0.791 -2.544 6.205 1.00 0.15 H new ATOM 0 HA PHE A 101 -1.029 -2.949 3.387 1.00 0.16 H new ATOM 0 HB2 PHE A 101 1.232 -2.677 5.448 1.00 0.19 H new ATOM 0 HB3 PHE A 101 1.606 -2.827 3.742 1.00 0.19 H new ATOM 0 HD1 PHE A 101 -1.480 -1.046 3.874 1.00 1.21 H new ATOM 0 HD2 PHE A 101 2.729 -0.562 4.624 1.00 1.10 H new ATOM 0 HE1 PHE A 101 -1.705 1.407 3.618 1.00 1.26 H new ATOM 0 HE2 PHE A 101 2.491 1.888 4.365 1.00 1.10 H new ATOM 0 HZ PHE A 101 0.275 2.872 3.866 1.00 0.43 H new ATOM 184 N ASP A 102 -0.069 -5.596 4.980 1.00 0.18 N ATOM 185 CA ASP A 102 0.315 -7.022 4.763 1.00 0.21 C ATOM 186 C ASP A 102 -0.866 -7.841 4.261 1.00 0.20 C ATOM 187 O ASP A 102 -0.766 -8.527 3.260 1.00 0.22 O ATOM 188 CB ASP A 102 0.753 -7.523 6.128 1.00 0.25 C ATOM 189 CG ASP A 102 1.422 -8.891 5.985 1.00 0.32 C ATOM 190 OD1 ASP A 102 0.753 -9.814 5.551 1.00 1.01 O ATOM 191 OD2 ASP A 102 2.593 -8.993 6.314 1.00 1.13 O ATOM 0 H ASP A 102 -0.317 -5.353 5.939 1.00 0.18 H new ATOM 0 HA ASP A 102 1.099 -7.114 4.011 1.00 0.21 H new ATOM 0 HB2 ASP A 102 1.446 -6.814 6.581 1.00 0.25 H new ATOM 0 HB3 ASP A 102 -0.108 -7.596 6.793 1.00 0.25 H new ATOM 196 N ILE A 103 -1.985 -7.787 4.948 1.00 0.18 N ATOM 197 CA ILE A 103 -3.161 -8.583 4.495 1.00 0.18 C ATOM 198 C ILE A 103 -3.577 -8.130 3.103 1.00 0.17 C ATOM 199 O ILE A 103 -3.870 -8.930 2.235 1.00 0.18 O ATOM 200 CB ILE A 103 -4.288 -8.327 5.517 1.00 0.18 C ATOM 201 CG1 ILE A 103 -4.614 -6.823 5.633 1.00 0.94 C ATOM 202 CG2 ILE A 103 -3.867 -8.867 6.882 1.00 0.94 C ATOM 203 CD1 ILE A 103 -5.743 -6.607 6.651 1.00 0.87 C ATOM 0 H ILE A 103 -2.129 -7.232 5.792 1.00 0.18 H new ATOM 0 HA ILE A 103 -2.932 -9.647 4.440 1.00 0.18 H new ATOM 0 HB ILE A 103 -5.185 -8.840 5.171 1.00 0.18 H new ATOM 0 HG12 ILE A 103 -3.725 -6.273 5.941 1.00 0.94 H new ATOM 0 HG13 ILE A 103 -4.910 -6.431 4.660 1.00 0.94 H new ATOM 0 HG21 ILE A 103 -4.662 -8.687 7.606 1.00 0.94 H new ATOM 0 HG22 ILE A 103 -3.680 -9.938 6.808 1.00 0.94 H new ATOM 0 HG23 ILE A 103 -2.958 -8.362 7.209 1.00 0.94 H new ATOM 0 HD11 ILE A 103 -5.966 -5.543 6.726 1.00 0.87 H new ATOM 0 HD12 ILE A 103 -6.634 -7.143 6.325 1.00 0.87 H new ATOM 0 HD13 ILE A 103 -5.431 -6.982 7.626 1.00 0.87 H new ATOM 215 N VAL A 104 -3.589 -6.849 2.891 1.00 0.16 N ATOM 216 CA VAL A 104 -3.990 -6.317 1.560 1.00 0.16 C ATOM 217 C VAL A 104 -2.938 -6.641 0.491 1.00 0.17 C ATOM 218 O VAL A 104 -3.268 -6.952 -0.637 1.00 0.18 O ATOM 219 CB VAL A 104 -4.125 -4.802 1.752 1.00 0.16 C ATOM 220 CG1 VAL A 104 -5.168 -4.501 2.833 1.00 0.18 C ATOM 221 CG2 VAL A 104 -2.774 -4.197 2.150 1.00 0.14 C ATOM 0 H VAL A 104 -3.338 -6.143 3.583 1.00 0.16 H new ATOM 0 HA VAL A 104 -4.920 -6.767 1.214 1.00 0.16 H new ATOM 0 HB VAL A 104 -4.448 -4.357 0.811 1.00 0.16 H new ATOM 0 HG11 VAL A 104 -5.257 -3.422 2.962 1.00 0.18 H new ATOM 0 HG12 VAL A 104 -6.132 -4.911 2.533 1.00 0.18 H new ATOM 0 HG13 VAL A 104 -4.858 -4.955 3.774 1.00 0.18 H new ATOM 0 HG21 VAL A 104 -2.883 -3.121 2.283 1.00 0.14 H new ATOM 0 HG22 VAL A 104 -2.435 -4.646 3.084 1.00 0.14 H new ATOM 0 HG23 VAL A 104 -2.042 -4.393 1.366 1.00 0.14 H new ATOM 231 N CYS A 105 -1.677 -6.543 0.833 1.00 0.18 N ATOM 232 CA CYS A 105 -0.605 -6.814 -0.175 1.00 0.19 C ATOM 233 C CYS A 105 -0.571 -8.277 -0.579 1.00 0.20 C ATOM 234 O CYS A 105 -0.625 -8.601 -1.747 1.00 0.21 O ATOM 235 CB CYS A 105 0.702 -6.403 0.505 1.00 0.22 C ATOM 236 SG CYS A 105 2.074 -6.557 -0.664 1.00 0.29 S ATOM 0 H CYS A 105 -1.344 -6.288 1.763 1.00 0.18 H new ATOM 0 HA CYS A 105 -0.778 -6.258 -1.097 1.00 0.19 H new ATOM 0 HB2 CYS A 105 0.630 -5.376 0.862 1.00 0.22 H new ATOM 0 HB3 CYS A 105 0.883 -7.032 1.377 1.00 0.22 H new ATOM 0 HG CYS A 105 3.201 -6.433 -0.029 1.00 0.29 H new ATOM 242 N ASP A 106 -0.479 -9.163 0.367 1.00 0.21 N ATOM 243 CA ASP A 106 -0.428 -10.609 0.006 1.00 0.24 C ATOM 244 C ASP A 106 -1.720 -11.015 -0.721 1.00 0.25 C ATOM 245 O ASP A 106 -1.763 -12.024 -1.399 1.00 0.28 O ATOM 246 CB ASP A 106 -0.271 -11.356 1.320 1.00 0.25 C ATOM 247 CG ASP A 106 1.030 -10.927 2.002 1.00 0.27 C ATOM 248 OD1 ASP A 106 1.998 -10.697 1.296 1.00 1.05 O ATOM 249 OD2 ASP A 106 1.036 -10.834 3.219 1.00 1.05 O ATOM 0 H ASP A 106 -0.437 -8.956 1.365 1.00 0.21 H new ATOM 0 HA ASP A 106 0.396 -10.837 -0.671 1.00 0.24 H new ATOM 0 HB2 ASP A 106 -1.120 -11.149 1.971 1.00 0.25 H new ATOM 0 HB3 ASP A 106 -0.262 -12.431 1.140 1.00 0.25 H new ATOM 254 N ASN A 107 -2.761 -10.218 -0.614 1.00 0.24 N ATOM 255 CA ASN A 107 -4.030 -10.539 -1.329 1.00 0.26 C ATOM 256 C ASN A 107 -3.980 -9.902 -2.714 1.00 0.26 C ATOM 257 O ASN A 107 -4.413 -10.467 -3.700 1.00 0.29 O ATOM 258 CB ASN A 107 -5.112 -9.854 -0.504 1.00 0.25 C ATOM 259 CG ASN A 107 -6.414 -10.648 -0.597 1.00 0.29 C ATOM 260 OD1 ASN A 107 -6.501 -11.756 -0.103 1.00 1.02 O ATOM 261 ND2 ASN A 107 -7.436 -10.127 -1.216 1.00 1.23 N ATOM 0 H ASN A 107 -2.781 -9.361 -0.061 1.00 0.24 H new ATOM 0 HA ASN A 107 -4.201 -11.610 -1.441 1.00 0.26 H new ATOM 0 HB2 ASN A 107 -4.795 -9.778 0.536 1.00 0.25 H new ATOM 0 HB3 ASN A 107 -5.269 -8.837 -0.865 1.00 0.25 H new ATOM 0 HD21 ASN A 107 -8.310 -10.649 -1.286 1.00 1.23 H new ATOM 0 HD22 ASN A 107 -7.362 -9.198 -1.630 1.00 1.23 H new ATOM 268 N VAL A 108 -3.448 -8.715 -2.770 1.00 0.23 N ATOM 269 CA VAL A 108 -3.338 -7.981 -4.054 1.00 0.24 C ATOM 270 C VAL A 108 -2.368 -6.815 -3.867 1.00 0.25 C ATOM 271 O VAL A 108 -2.761 -5.663 -3.829 1.00 0.42 O ATOM 272 CB VAL A 108 -4.765 -7.498 -4.340 1.00 0.23 C ATOM 273 CG1 VAL A 108 -5.234 -6.517 -3.262 1.00 0.27 C ATOM 274 CG2 VAL A 108 -4.808 -6.822 -5.712 1.00 0.27 C ATOM 0 H VAL A 108 -3.078 -8.215 -1.962 1.00 0.23 H new ATOM 0 HA VAL A 108 -2.957 -8.582 -4.880 1.00 0.24 H new ATOM 0 HB VAL A 108 -5.434 -8.359 -4.333 1.00 0.23 H new ATOM 0 HG11 VAL A 108 -6.249 -6.188 -3.486 1.00 0.27 H new ATOM 0 HG12 VAL A 108 -5.219 -7.010 -2.290 1.00 0.27 H new ATOM 0 HG13 VAL A 108 -4.569 -5.654 -3.242 1.00 0.27 H new ATOM 0 HG21 VAL A 108 -5.822 -6.478 -5.917 1.00 0.27 H new ATOM 0 HG22 VAL A 108 -4.128 -5.970 -5.720 1.00 0.27 H new ATOM 0 HG23 VAL A 108 -4.505 -7.535 -6.479 1.00 0.27 H new ATOM 284 N GLY A 109 -1.102 -7.104 -3.739 1.00 0.24 N ATOM 285 CA GLY A 109 -0.124 -6.007 -3.536 1.00 0.22 C ATOM 286 C GLY A 109 0.186 -5.259 -4.830 1.00 0.23 C ATOM 287 O GLY A 109 0.740 -4.175 -4.801 1.00 0.21 O ATOM 0 H GLY A 109 -0.708 -8.045 -3.766 1.00 0.24 H new ATOM 0 HA2 GLY A 109 -0.516 -5.306 -2.799 1.00 0.22 H new ATOM 0 HA3 GLY A 109 0.799 -6.418 -3.126 1.00 0.22 H new ATOM 291 N ARG A 110 -0.167 -5.810 -5.957 1.00 0.27 N ATOM 292 CA ARG A 110 0.106 -5.108 -7.249 1.00 0.28 C ATOM 293 C ARG A 110 -0.715 -3.804 -7.325 1.00 0.27 C ATOM 294 O ARG A 110 -0.409 -2.895 -8.091 1.00 0.27 O ATOM 295 CB ARG A 110 -0.324 -6.089 -8.343 1.00 0.36 C ATOM 296 CG ARG A 110 0.465 -7.403 -8.220 1.00 0.55 C ATOM 297 CD ARG A 110 1.912 -7.199 -8.684 1.00 0.72 C ATOM 298 NE ARG A 110 1.842 -7.234 -10.175 1.00 1.08 N ATOM 299 CZ ARG A 110 2.888 -6.917 -10.887 1.00 1.39 C ATOM 300 NH1 ARG A 110 4.072 -7.331 -10.528 1.00 2.06 N ATOM 301 NH2 ARG A 110 2.747 -6.190 -11.961 1.00 1.68 N ATOM 0 H ARG A 110 -0.632 -6.714 -6.043 1.00 0.27 H new ATOM 0 HA ARG A 110 1.154 -4.829 -7.354 1.00 0.28 H new ATOM 0 HB2 ARG A 110 -1.392 -6.289 -8.262 1.00 0.36 H new ATOM 0 HB3 ARG A 110 -0.156 -5.646 -9.325 1.00 0.36 H new ATOM 0 HG2 ARG A 110 0.452 -7.747 -7.186 1.00 0.55 H new ATOM 0 HG3 ARG A 110 -0.011 -8.179 -8.820 1.00 0.55 H new ATOM 0 HD2 ARG A 110 2.311 -6.249 -8.329 1.00 0.72 H new ATOM 0 HD3 ARG A 110 2.565 -7.983 -8.300 1.00 0.72 H new ATOM 0 HE ARG A 110 0.975 -7.506 -10.638 1.00 1.08 H new ATOM 0 HH11 ARG A 110 4.180 -7.903 -9.690 1.00 2.06 H new ATOM 0 HH12 ARG A 110 4.890 -7.083 -11.085 1.00 2.06 H new ATOM 0 HH21 ARG A 110 1.820 -5.871 -12.243 1.00 1.68 H new ATOM 0 HH22 ARG A 110 3.564 -5.941 -12.519 1.00 1.68 H new ATOM 315 N ASP A 111 -1.756 -3.702 -6.530 1.00 0.27 N ATOM 316 CA ASP A 111 -2.598 -2.470 -6.555 1.00 0.30 C ATOM 317 C ASP A 111 -1.802 -1.293 -5.978 1.00 0.31 C ATOM 318 O ASP A 111 -2.099 -0.146 -6.254 1.00 0.39 O ATOM 319 CB ASP A 111 -3.822 -2.808 -5.682 1.00 0.30 C ATOM 320 CG ASP A 111 -4.797 -3.703 -6.461 1.00 0.30 C ATOM 321 OD1 ASP A 111 -4.633 -3.835 -7.665 1.00 0.82 O ATOM 322 OD2 ASP A 111 -5.700 -4.234 -5.837 1.00 0.93 O ATOM 0 H ASP A 111 -2.055 -4.418 -5.868 1.00 0.27 H new ATOM 0 HA ASP A 111 -2.901 -2.179 -7.561 1.00 0.30 H new ATOM 0 HB2 ASP A 111 -3.500 -3.314 -4.772 1.00 0.30 H new ATOM 0 HB3 ASP A 111 -4.324 -1.890 -5.376 1.00 0.30 H new ATOM 327 N TRP A 112 -0.769 -1.565 -5.213 1.00 0.27 N ATOM 328 CA TRP A 112 0.072 -0.455 -4.661 1.00 0.29 C ATOM 329 C TRP A 112 0.890 0.138 -5.795 1.00 0.32 C ATOM 330 O TRP A 112 1.172 1.314 -5.807 1.00 0.31 O ATOM 331 CB TRP A 112 0.976 -1.073 -3.594 1.00 0.29 C ATOM 332 CG TRP A 112 0.159 -1.945 -2.702 1.00 0.25 C ATOM 333 CD1 TRP A 112 0.599 -3.082 -2.147 1.00 0.23 C ATOM 334 CD2 TRP A 112 -1.243 -1.807 -2.310 1.00 0.25 C ATOM 335 NE1 TRP A 112 -0.415 -3.632 -1.397 1.00 0.20 N ATOM 336 CE2 TRP A 112 -1.576 -2.900 -1.485 1.00 0.20 C ATOM 337 CE3 TRP A 112 -2.247 -0.854 -2.575 1.00 0.31 C ATOM 338 CZ2 TRP A 112 -2.848 -3.054 -0.952 1.00 0.20 C ATOM 339 CZ3 TRP A 112 -3.533 -1.008 -2.038 1.00 0.32 C ATOM 340 CH2 TRP A 112 -3.835 -2.113 -1.230 1.00 0.27 C ATOM 0 H TRP A 112 -0.474 -2.505 -4.948 1.00 0.27 H new ATOM 0 HA TRP A 112 -0.528 0.341 -4.221 1.00 0.29 H new ATOM 0 HB2 TRP A 112 1.768 -1.655 -4.065 1.00 0.29 H new ATOM 0 HB3 TRP A 112 1.460 -0.289 -3.012 1.00 0.29 H new ATOM 0 HD1 TRP A 112 1.588 -3.499 -2.268 1.00 0.23 H new ATOM 0 HE1 TRP A 112 -0.317 -4.482 -0.842 1.00 0.20 H new ATOM 0 HE3 TRP A 112 -2.024 0.001 -3.196 1.00 0.31 H new ATOM 0 HZ2 TRP A 112 -3.072 -3.903 -0.323 1.00 0.20 H new ATOM 0 HZ3 TRP A 112 -4.295 -0.272 -2.248 1.00 0.32 H new ATOM 0 HH2 TRP A 112 -4.829 -2.234 -0.825 1.00 0.27 H new ATOM 351 N LYS A 113 1.244 -0.663 -6.773 1.00 0.37 N ATOM 352 CA LYS A 113 2.003 -0.121 -7.939 1.00 0.40 C ATOM 353 C LYS A 113 1.088 0.874 -8.648 1.00 0.34 C ATOM 354 O LYS A 113 1.493 1.948 -9.053 1.00 0.30 O ATOM 355 CB LYS A 113 2.282 -1.329 -8.832 1.00 0.50 C ATOM 356 CG LYS A 113 3.303 -2.247 -8.157 1.00 0.72 C ATOM 357 CD LYS A 113 3.468 -3.514 -9.002 1.00 0.89 C ATOM 358 CE LYS A 113 4.562 -4.407 -8.406 1.00 1.51 C ATOM 359 NZ LYS A 113 4.129 -4.693 -7.006 1.00 1.66 N ATOM 0 H LYS A 113 1.040 -1.662 -6.812 1.00 0.37 H new ATOM 0 HA LYS A 113 2.932 0.383 -7.670 1.00 0.40 H new ATOM 0 HB2 LYS A 113 1.357 -1.875 -9.021 1.00 0.50 H new ATOM 0 HB3 LYS A 113 2.660 -0.998 -9.799 1.00 0.50 H new ATOM 0 HG2 LYS A 113 4.260 -1.735 -8.055 1.00 0.72 H new ATOM 0 HG3 LYS A 113 2.971 -2.505 -7.152 1.00 0.72 H new ATOM 0 HD2 LYS A 113 2.525 -4.059 -9.042 1.00 0.89 H new ATOM 0 HD3 LYS A 113 3.725 -3.246 -10.027 1.00 0.89 H new ATOM 0 HE2 LYS A 113 4.671 -5.328 -8.978 1.00 1.51 H new ATOM 0 HE3 LYS A 113 5.530 -3.905 -8.422 1.00 1.51 H new ATOM 0 HZ1 LYS A 113 4.443 -5.646 -6.733 1.00 1.66 H new ATOM 0 HZ2 LYS A 113 4.550 -3.993 -6.363 1.00 1.66 H new ATOM 0 HZ3 LYS A 113 3.092 -4.639 -6.945 1.00 1.66 H new ATOM 373 N ARG A 114 -0.169 0.518 -8.751 1.00 0.35 N ATOM 374 CA ARG A 114 -1.170 1.435 -9.384 1.00 0.33 C ATOM 375 C ARG A 114 -1.334 2.693 -8.518 1.00 0.28 C ATOM 376 O ARG A 114 -1.307 3.810 -9.003 1.00 0.29 O ATOM 377 CB ARG A 114 -2.478 0.625 -9.397 1.00 0.37 C ATOM 378 CG ARG A 114 -3.640 1.477 -9.933 1.00 0.38 C ATOM 379 CD ARG A 114 -4.910 1.184 -9.120 1.00 0.43 C ATOM 380 NE ARG A 114 -5.860 2.266 -9.495 1.00 0.57 N ATOM 381 CZ ARG A 114 -6.969 1.974 -10.115 1.00 1.04 C ATOM 382 NH1 ARG A 114 -7.931 1.367 -9.477 1.00 1.62 N ATOM 383 NH2 ARG A 114 -7.115 2.288 -11.373 1.00 1.77 N ATOM 0 H ARG A 114 -0.547 -0.371 -8.423 1.00 0.35 H new ATOM 0 HA ARG A 114 -0.876 1.761 -10.382 1.00 0.33 H new ATOM 0 HB2 ARG A 114 -2.355 -0.263 -10.017 1.00 0.37 H new ATOM 0 HB3 ARG A 114 -2.708 0.280 -8.389 1.00 0.37 H new ATOM 0 HG2 ARG A 114 -3.389 2.536 -9.866 1.00 0.38 H new ATOM 0 HG3 ARG A 114 -3.811 1.256 -10.987 1.00 0.38 H new ATOM 0 HD2 ARG A 114 -5.315 0.201 -9.360 1.00 0.43 H new ATOM 0 HD3 ARG A 114 -4.705 1.191 -8.050 1.00 0.43 H new ATOM 0 HE ARG A 114 -5.644 3.236 -9.267 1.00 0.57 H new ATOM 0 HH11 ARG A 114 -7.815 1.121 -8.494 1.00 1.62 H new ATOM 0 HH12 ARG A 114 -8.799 1.138 -9.961 1.00 1.62 H new ATOM 0 HH21 ARG A 114 -6.362 2.762 -11.871 1.00 1.77 H new ATOM 0 HH22 ARG A 114 -7.983 2.060 -11.858 1.00 1.77 H new ATOM 397 N LEU A 115 -1.522 2.502 -7.237 1.00 0.26 N ATOM 398 CA LEU A 115 -1.714 3.663 -6.314 1.00 0.25 C ATOM 399 C LEU A 115 -0.400 4.428 -6.138 1.00 0.25 C ATOM 400 O LEU A 115 -0.395 5.625 -5.926 1.00 0.26 O ATOM 401 CB LEU A 115 -2.167 3.045 -4.989 1.00 0.26 C ATOM 402 CG LEU A 115 -3.580 2.475 -5.150 1.00 0.25 C ATOM 403 CD1 LEU A 115 -3.959 1.672 -3.900 1.00 0.32 C ATOM 404 CD2 LEU A 115 -4.573 3.623 -5.347 1.00 0.23 C ATOM 0 H LEU A 115 -1.551 1.587 -6.788 1.00 0.26 H new ATOM 0 HA LEU A 115 -2.441 4.379 -6.697 1.00 0.25 H new ATOM 0 HB2 LEU A 115 -1.477 2.257 -4.688 1.00 0.26 H new ATOM 0 HB3 LEU A 115 -2.154 3.798 -4.201 1.00 0.26 H new ATOM 0 HG LEU A 115 -3.609 1.818 -6.019 1.00 0.25 H new ATOM 0 HD11 LEU A 115 -4.965 1.268 -4.018 1.00 0.32 H new ATOM 0 HD12 LEU A 115 -3.252 0.853 -3.766 1.00 0.32 H new ATOM 0 HD13 LEU A 115 -3.930 2.323 -3.026 1.00 0.32 H new ATOM 0 HD21 LEU A 115 -5.579 3.219 -5.462 1.00 0.23 H new ATOM 0 HD22 LEU A 115 -4.544 4.282 -4.479 1.00 0.23 H new ATOM 0 HD23 LEU A 115 -4.305 4.187 -6.240 1.00 0.23 H new ATOM 416 N ALA A 116 0.713 3.747 -6.232 1.00 0.26 N ATOM 417 CA ALA A 116 2.037 4.428 -6.081 1.00 0.28 C ATOM 418 C ALA A 116 2.169 5.503 -7.156 1.00 0.26 C ATOM 419 O ALA A 116 2.487 6.650 -6.880 1.00 0.27 O ATOM 420 CB ALA A 116 3.084 3.332 -6.286 1.00 0.31 C ATOM 0 H ALA A 116 0.763 2.744 -6.408 1.00 0.26 H new ATOM 0 HA ALA A 116 2.154 4.911 -5.111 1.00 0.28 H new ATOM 0 HB1 ALA A 116 4.082 3.760 -6.189 1.00 0.31 H new ATOM 0 HB2 ALA A 116 2.948 2.554 -5.535 1.00 0.31 H new ATOM 0 HB3 ALA A 116 2.969 2.900 -7.280 1.00 0.31 H new ATOM 426 N ARG A 117 1.890 5.142 -8.385 1.00 0.27 N ATOM 427 CA ARG A 117 1.959 6.139 -9.493 1.00 0.30 C ATOM 428 C ARG A 117 0.966 7.270 -9.188 1.00 0.32 C ATOM 429 O ARG A 117 1.253 8.437 -9.375 1.00 0.33 O ATOM 430 CB ARG A 117 1.534 5.371 -10.750 1.00 0.35 C ATOM 431 CG ARG A 117 2.549 4.263 -11.047 1.00 0.37 C ATOM 432 CD ARG A 117 3.790 4.861 -11.715 1.00 1.31 C ATOM 433 NE ARG A 117 4.660 3.690 -12.023 1.00 1.53 N ATOM 434 CZ ARG A 117 4.558 3.083 -13.175 1.00 1.93 C ATOM 435 NH1 ARG A 117 5.227 3.523 -14.206 1.00 2.61 N ATOM 436 NH2 ARG A 117 3.789 2.035 -13.296 1.00 2.24 N ATOM 0 H ARG A 117 1.618 4.200 -8.666 1.00 0.27 H new ATOM 0 HA ARG A 117 2.948 6.580 -9.617 1.00 0.30 H new ATOM 0 HB2 ARG A 117 0.543 4.940 -10.607 1.00 0.35 H new ATOM 0 HB3 ARG A 117 1.466 6.052 -11.598 1.00 0.35 H new ATOM 0 HG2 ARG A 117 2.830 3.758 -10.123 1.00 0.37 H new ATOM 0 HG3 ARG A 117 2.101 3.512 -11.698 1.00 0.37 H new ATOM 0 HD2 ARG A 117 3.527 5.407 -12.621 1.00 1.31 H new ATOM 0 HD3 ARG A 117 4.295 5.565 -11.053 1.00 1.31 H new ATOM 0 HE ARG A 117 5.336 3.362 -11.333 1.00 1.53 H new ATOM 0 HH11 ARG A 117 5.829 4.341 -14.112 1.00 2.61 H new ATOM 0 HH12 ARG A 117 5.147 3.049 -15.106 1.00 2.61 H new ATOM 0 HH21 ARG A 117 3.267 1.690 -12.491 1.00 2.24 H new ATOM 0 HH22 ARG A 117 3.710 1.562 -14.196 1.00 2.24 H new ATOM 450 N GLU A 118 -0.190 6.912 -8.681 1.00 0.34 N ATOM 451 CA GLU A 118 -1.212 7.939 -8.312 1.00 0.39 C ATOM 452 C GLU A 118 -0.656 8.816 -7.186 1.00 0.39 C ATOM 453 O GLU A 118 -0.832 10.020 -7.174 1.00 0.41 O ATOM 454 CB GLU A 118 -2.433 7.148 -7.832 1.00 0.43 C ATOM 455 CG GLU A 118 -3.083 6.436 -9.020 1.00 0.47 C ATOM 456 CD GLU A 118 -3.646 7.472 -9.995 1.00 0.53 C ATOM 457 OE1 GLU A 118 -4.284 8.405 -9.534 1.00 0.76 O ATOM 458 OE2 GLU A 118 -3.430 7.315 -11.185 1.00 1.45 O ATOM 0 H GLU A 118 -0.469 5.947 -8.507 1.00 0.34 H new ATOM 0 HA GLU A 118 -1.471 8.594 -9.144 1.00 0.39 H new ATOM 0 HB2 GLU A 118 -2.134 6.420 -7.078 1.00 0.43 H new ATOM 0 HB3 GLU A 118 -3.151 7.819 -7.360 1.00 0.43 H new ATOM 0 HG2 GLU A 118 -2.350 5.807 -9.525 1.00 0.47 H new ATOM 0 HG3 GLU A 118 -3.880 5.779 -8.671 1.00 0.47 H new ATOM 465 N LEU A 119 0.031 8.210 -6.248 1.00 0.37 N ATOM 466 CA LEU A 119 0.631 8.987 -5.117 1.00 0.38 C ATOM 467 C LEU A 119 1.854 9.782 -5.604 1.00 0.36 C ATOM 468 O LEU A 119 2.430 10.552 -4.861 1.00 0.39 O ATOM 469 CB LEU A 119 1.049 7.933 -4.093 1.00 0.38 C ATOM 470 CG LEU A 119 -0.202 7.294 -3.485 1.00 0.56 C ATOM 471 CD1 LEU A 119 0.188 6.028 -2.720 1.00 1.33 C ATOM 472 CD2 LEU A 119 -0.867 8.285 -2.523 1.00 0.58 C ATOM 0 H LEU A 119 0.203 7.205 -6.217 1.00 0.37 H new ATOM 0 HA LEU A 119 -0.068 9.710 -4.697 1.00 0.38 H new ATOM 0 HB2 LEU A 119 1.666 7.171 -4.570 1.00 0.38 H new ATOM 0 HB3 LEU A 119 1.655 8.390 -3.311 1.00 0.38 H new ATOM 0 HG LEU A 119 -0.899 7.036 -4.282 1.00 0.56 H new ATOM 0 HD11 LEU A 119 -0.704 5.575 -2.288 1.00 1.33 H new ATOM 0 HD12 LEU A 119 0.660 5.321 -3.403 1.00 1.33 H new ATOM 0 HD13 LEU A 119 0.887 6.285 -1.924 1.00 1.33 H new ATOM 0 HD21 LEU A 119 -1.758 7.830 -2.090 1.00 0.58 H new ATOM 0 HD22 LEU A 119 -0.169 8.544 -1.727 1.00 0.58 H new ATOM 0 HD23 LEU A 119 -1.148 9.187 -3.067 1.00 0.58 H new ATOM 484 N LYS A 120 2.257 9.599 -6.849 1.00 0.34 N ATOM 485 CA LYS A 120 3.437 10.339 -7.399 1.00 0.35 C ATOM 486 C LYS A 120 4.682 10.019 -6.579 1.00 0.30 C ATOM 487 O LYS A 120 5.405 10.901 -6.154 1.00 0.33 O ATOM 488 CB LYS A 120 3.095 11.836 -7.324 1.00 0.48 C ATOM 489 CG LYS A 120 1.838 12.122 -8.150 1.00 1.05 C ATOM 490 CD LYS A 120 2.114 11.847 -9.631 1.00 1.11 C ATOM 491 CE LYS A 120 0.979 12.435 -10.475 1.00 2.02 C ATOM 492 NZ LYS A 120 1.351 12.138 -11.887 1.00 2.16 N ATOM 0 H LYS A 120 1.810 8.961 -7.508 1.00 0.34 H new ATOM 0 HA LYS A 120 3.646 10.048 -8.428 1.00 0.35 H new ATOM 0 HB2 LYS A 120 2.935 12.130 -6.287 1.00 0.48 H new ATOM 0 HB3 LYS A 120 3.930 12.429 -7.698 1.00 0.48 H new ATOM 0 HG2 LYS A 120 1.014 11.498 -7.803 1.00 1.05 H new ATOM 0 HG3 LYS A 120 1.531 13.159 -8.015 1.00 1.05 H new ATOM 0 HD2 LYS A 120 3.067 12.289 -9.923 1.00 1.11 H new ATOM 0 HD3 LYS A 120 2.194 10.774 -9.805 1.00 1.11 H new ATOM 0 HE2 LYS A 120 0.021 11.984 -10.216 1.00 2.02 H new ATOM 0 HE3 LYS A 120 0.881 13.508 -10.311 1.00 2.02 H new ATOM 0 HZ1 LYS A 120 0.619 12.511 -12.525 1.00 2.16 H new ATOM 0 HZ2 LYS A 120 2.263 12.586 -12.107 1.00 2.16 H new ATOM 0 HZ3 LYS A 120 1.430 11.109 -12.016 1.00 2.16 H new ATOM 506 N VAL A 121 4.936 8.756 -6.364 1.00 0.29 N ATOM 507 CA VAL A 121 6.140 8.351 -5.576 1.00 0.33 C ATOM 508 C VAL A 121 7.401 8.553 -6.420 1.00 0.37 C ATOM 509 O VAL A 121 7.336 8.657 -7.630 1.00 0.42 O ATOM 510 CB VAL A 121 5.940 6.867 -5.244 1.00 0.36 C ATOM 511 CG1 VAL A 121 4.691 6.704 -4.378 1.00 1.65 C ATOM 512 CG2 VAL A 121 5.772 6.052 -6.534 1.00 1.29 C ATOM 0 H VAL A 121 4.361 7.984 -6.701 1.00 0.29 H new ATOM 0 HA VAL A 121 6.258 8.945 -4.670 1.00 0.33 H new ATOM 0 HB VAL A 121 6.815 6.504 -4.705 1.00 0.36 H new ATOM 0 HG11 VAL A 121 4.547 5.650 -4.141 1.00 1.65 H new ATOM 0 HG12 VAL A 121 4.812 7.270 -3.454 1.00 1.65 H new ATOM 0 HG13 VAL A 121 3.821 7.076 -4.920 1.00 1.65 H new ATOM 0 HG21 VAL A 121 5.631 5.000 -6.284 1.00 1.29 H new ATOM 0 HG22 VAL A 121 4.903 6.414 -7.083 1.00 1.29 H new ATOM 0 HG23 VAL A 121 6.663 6.162 -7.152 1.00 1.29 H new ATOM 522 N SER A 122 8.549 8.624 -5.789 1.00 0.45 N ATOM 523 CA SER A 122 9.824 8.834 -6.552 1.00 0.52 C ATOM 524 C SER A 122 9.952 7.821 -7.693 1.00 0.44 C ATOM 525 O SER A 122 10.078 6.631 -7.473 1.00 0.35 O ATOM 526 CB SER A 122 10.941 8.623 -5.529 1.00 0.63 C ATOM 527 OG SER A 122 11.225 9.857 -4.882 1.00 1.10 O ATOM 0 H SER A 122 8.660 8.546 -4.778 1.00 0.45 H new ATOM 0 HA SER A 122 9.862 9.824 -7.007 1.00 0.52 H new ATOM 0 HB2 SER A 122 10.641 7.875 -4.795 1.00 0.63 H new ATOM 0 HB3 SER A 122 11.836 8.244 -6.023 1.00 0.63 H new ATOM 0 HG SER A 122 12.193 9.947 -4.759 1.00 1.10 H new ATOM 533 N GLU A 123 9.928 8.298 -8.911 1.00 0.55 N ATOM 534 CA GLU A 123 10.056 7.386 -10.087 1.00 0.58 C ATOM 535 C GLU A 123 11.390 6.646 -10.015 1.00 0.52 C ATOM 536 O GLU A 123 11.508 5.511 -10.438 1.00 0.53 O ATOM 537 CB GLU A 123 10.010 8.292 -11.319 1.00 0.77 C ATOM 538 CG GLU A 123 10.033 7.429 -12.584 1.00 1.44 C ATOM 539 CD GLU A 123 11.475 7.259 -13.072 1.00 1.61 C ATOM 540 OE1 GLU A 123 12.266 8.165 -12.861 1.00 1.75 O ATOM 541 OE2 GLU A 123 11.762 6.227 -13.655 1.00 2.15 O ATOM 0 H GLU A 123 9.825 9.286 -9.143 1.00 0.55 H new ATOM 0 HA GLU A 123 9.265 6.636 -10.117 1.00 0.58 H new ATOM 0 HB2 GLU A 123 9.109 8.905 -11.300 1.00 0.77 H new ATOM 0 HB3 GLU A 123 10.860 8.974 -11.315 1.00 0.77 H new ATOM 0 HG2 GLU A 123 9.592 6.454 -12.378 1.00 1.44 H new ATOM 0 HG3 GLU A 123 9.428 7.894 -13.363 1.00 1.44 H new ATOM 548 N ALA A 124 12.397 7.288 -9.474 1.00 0.50 N ATOM 549 CA ALA A 124 13.738 6.632 -9.360 1.00 0.50 C ATOM 550 C ALA A 124 13.613 5.313 -8.588 1.00 0.39 C ATOM 551 O ALA A 124 14.083 4.281 -9.027 1.00 0.45 O ATOM 552 CB ALA A 124 14.605 7.624 -8.579 1.00 0.56 C ATOM 0 H ALA A 124 12.348 8.238 -9.106 1.00 0.50 H new ATOM 0 HA ALA A 124 14.166 6.397 -10.335 1.00 0.50 H new ATOM 0 HB1 ALA A 124 15.607 7.212 -8.455 1.00 0.56 H new ATOM 0 HB2 ALA A 124 14.665 8.565 -9.126 1.00 0.56 H new ATOM 0 HB3 ALA A 124 14.162 7.802 -7.599 1.00 0.56 H new ATOM 558 N LYS A 125 12.976 5.348 -7.446 1.00 0.31 N ATOM 559 CA LYS A 125 12.805 4.100 -6.639 1.00 0.34 C ATOM 560 C LYS A 125 12.002 3.069 -7.431 1.00 0.34 C ATOM 561 O LYS A 125 12.345 1.903 -7.477 1.00 0.39 O ATOM 562 CB LYS A 125 12.030 4.531 -5.397 1.00 0.42 C ATOM 563 CG LYS A 125 12.919 5.418 -4.529 1.00 0.54 C ATOM 564 CD LYS A 125 12.149 5.854 -3.283 1.00 0.75 C ATOM 565 CE LYS A 125 13.047 6.742 -2.420 1.00 0.75 C ATOM 566 NZ LYS A 125 12.690 8.132 -2.817 1.00 1.56 N ATOM 0 H LYS A 125 12.566 6.187 -7.036 1.00 0.31 H new ATOM 0 HA LYS A 125 13.760 3.641 -6.385 1.00 0.34 H new ATOM 0 HB2 LYS A 125 11.129 5.072 -5.686 1.00 0.42 H new ATOM 0 HB3 LYS A 125 11.709 3.655 -4.833 1.00 0.42 H new ATOM 0 HG2 LYS A 125 13.820 4.876 -4.241 1.00 0.54 H new ATOM 0 HG3 LYS A 125 13.240 6.293 -5.095 1.00 0.54 H new ATOM 0 HD2 LYS A 125 11.248 6.397 -3.569 1.00 0.75 H new ATOM 0 HD3 LYS A 125 11.828 4.981 -2.715 1.00 0.75 H new ATOM 0 HE2 LYS A 125 12.868 6.574 -1.358 1.00 0.75 H new ATOM 0 HE3 LYS A 125 14.102 6.536 -2.602 1.00 0.75 H new ATOM 0 HZ1 LYS A 125 13.173 8.807 -2.190 1.00 1.56 H new ATOM 0 HZ2 LYS A 125 12.986 8.299 -3.800 1.00 1.56 H new ATOM 0 HZ3 LYS A 125 11.661 8.262 -2.738 1.00 1.56 H new ATOM 580 N MET A 126 10.933 3.496 -8.059 1.00 0.42 N ATOM 581 CA MET A 126 10.099 2.550 -8.861 1.00 0.56 C ATOM 582 C MET A 126 10.946 1.930 -9.974 1.00 0.57 C ATOM 583 O MET A 126 10.835 0.755 -10.275 1.00 0.66 O ATOM 584 CB MET A 126 8.963 3.395 -9.458 1.00 0.70 C ATOM 585 CG MET A 126 7.988 3.842 -8.358 1.00 1.10 C ATOM 586 SD MET A 126 7.192 2.396 -7.609 1.00 1.90 S ATOM 587 CE MET A 126 6.249 1.876 -9.063 1.00 2.03 C ATOM 0 H MET A 126 10.603 4.461 -8.050 1.00 0.42 H new ATOM 0 HA MET A 126 9.708 1.734 -8.253 1.00 0.56 H new ATOM 0 HB2 MET A 126 9.378 4.268 -9.961 1.00 0.70 H new ATOM 0 HB3 MET A 126 8.429 2.816 -10.212 1.00 0.70 H new ATOM 0 HG2 MET A 126 8.522 4.409 -7.596 1.00 1.10 H new ATOM 0 HG3 MET A 126 7.233 4.506 -8.778 1.00 1.10 H new ATOM 0 HE1 MET A 126 5.437 1.217 -8.754 1.00 2.03 H new ATOM 0 HE2 MET A 126 5.835 2.753 -9.561 1.00 2.03 H new ATOM 0 HE3 MET A 126 6.906 1.344 -9.751 1.00 2.03 H new ATOM 597 N ASP A 127 11.789 2.721 -10.587 1.00 0.55 N ATOM 598 CA ASP A 127 12.651 2.197 -11.691 1.00 0.62 C ATOM 599 C ASP A 127 13.542 1.062 -11.174 1.00 0.54 C ATOM 600 O ASP A 127 13.716 0.056 -11.837 1.00 0.59 O ATOM 601 CB ASP A 127 13.501 3.393 -12.134 1.00 0.71 C ATOM 602 CG ASP A 127 14.434 2.974 -13.273 1.00 1.04 C ATOM 603 OD1 ASP A 127 15.299 2.151 -13.030 1.00 1.60 O ATOM 604 OD2 ASP A 127 14.265 3.484 -14.369 1.00 1.71 O ATOM 0 H ASP A 127 11.918 3.709 -10.371 1.00 0.55 H new ATOM 0 HA ASP A 127 12.065 1.788 -12.514 1.00 0.62 H new ATOM 0 HB2 ASP A 127 12.855 4.208 -12.462 1.00 0.71 H new ATOM 0 HB3 ASP A 127 14.085 3.767 -11.293 1.00 0.71 H new ATOM 609 N GLY A 128 14.093 1.208 -9.994 1.00 0.46 N ATOM 610 CA GLY A 128 14.956 0.122 -9.442 1.00 0.46 C ATOM 611 C GLY A 128 14.116 -1.019 -8.873 1.00 0.48 C ATOM 612 O GLY A 128 14.385 -2.176 -9.137 1.00 0.51 O ATOM 0 H GLY A 128 13.983 2.026 -9.394 1.00 0.46 H new ATOM 0 HA2 GLY A 128 15.609 -0.261 -10.226 1.00 0.46 H new ATOM 0 HA3 GLY A 128 15.599 0.527 -8.661 1.00 0.46 H new ATOM 616 N ILE A 129 13.112 -0.716 -8.083 1.00 0.54 N ATOM 617 CA ILE A 129 12.283 -1.811 -7.492 1.00 0.68 C ATOM 618 C ILE A 129 11.630 -2.645 -8.615 1.00 0.68 C ATOM 619 O ILE A 129 11.713 -3.859 -8.621 1.00 0.72 O ATOM 620 CB ILE A 129 11.265 -1.096 -6.553 1.00 0.86 C ATOM 621 CG1 ILE A 129 11.058 -1.961 -5.311 1.00 1.04 C ATOM 622 CG2 ILE A 129 9.901 -0.848 -7.222 1.00 1.77 C ATOM 623 CD1 ILE A 129 12.284 -1.843 -4.404 1.00 2.01 C ATOM 0 H ILE A 129 12.835 0.231 -7.825 1.00 0.54 H new ATOM 0 HA ILE A 129 12.861 -2.533 -6.915 1.00 0.68 H new ATOM 0 HB ILE A 129 11.681 -0.121 -6.300 1.00 0.86 H new ATOM 0 HG12 ILE A 129 10.163 -1.642 -4.776 1.00 1.04 H new ATOM 0 HG13 ILE A 129 10.903 -3.001 -5.599 1.00 1.04 H new ATOM 0 HG21 ILE A 129 9.236 -0.348 -6.518 1.00 1.77 H new ATOM 0 HG22 ILE A 129 10.036 -0.220 -8.102 1.00 1.77 H new ATOM 0 HG23 ILE A 129 9.463 -1.801 -7.520 1.00 1.77 H new ATOM 0 HD11 ILE A 129 12.140 -2.459 -3.516 1.00 2.01 H new ATOM 0 HD12 ILE A 129 13.169 -2.183 -4.942 1.00 2.01 H new ATOM 0 HD13 ILE A 129 12.418 -0.803 -4.106 1.00 2.01 H new ATOM 635 N GLU A 130 10.992 -1.999 -9.561 1.00 0.70 N ATOM 636 CA GLU A 130 10.344 -2.748 -10.683 1.00 0.77 C ATOM 637 C GLU A 130 11.378 -3.552 -11.484 1.00 0.65 C ATOM 638 O GLU A 130 11.191 -4.726 -11.746 1.00 0.68 O ATOM 639 CB GLU A 130 9.697 -1.677 -11.564 1.00 0.85 C ATOM 640 CG GLU A 130 8.921 -2.349 -12.698 1.00 1.41 C ATOM 641 CD GLU A 130 7.976 -1.334 -13.343 1.00 1.66 C ATOM 642 OE1 GLU A 130 8.444 -0.540 -14.142 1.00 2.14 O ATOM 643 OE2 GLU A 130 6.799 -1.366 -13.024 1.00 2.01 O ATOM 0 H GLU A 130 10.892 -0.985 -9.604 1.00 0.70 H new ATOM 0 HA GLU A 130 9.615 -3.469 -10.312 1.00 0.77 H new ATOM 0 HB2 GLU A 130 9.027 -1.057 -10.968 1.00 0.85 H new ATOM 0 HB3 GLU A 130 10.462 -1.017 -11.974 1.00 0.85 H new ATOM 0 HG2 GLU A 130 9.613 -2.742 -13.443 1.00 1.41 H new ATOM 0 HG3 GLU A 130 8.353 -3.196 -12.312 1.00 1.41 H new ATOM 650 N GLU A 131 12.457 -2.924 -11.893 1.00 0.59 N ATOM 651 CA GLU A 131 13.492 -3.650 -12.698 1.00 0.55 C ATOM 652 C GLU A 131 14.223 -4.693 -11.850 1.00 0.47 C ATOM 653 O GLU A 131 14.506 -5.785 -12.306 1.00 0.45 O ATOM 654 CB GLU A 131 14.468 -2.569 -13.170 1.00 0.63 C ATOM 655 CG GLU A 131 13.787 -1.679 -14.213 1.00 1.38 C ATOM 656 CD GLU A 131 13.476 -2.500 -15.469 1.00 1.89 C ATOM 657 OE1 GLU A 131 14.222 -3.424 -15.752 1.00 2.50 O ATOM 658 OE2 GLU A 131 12.499 -2.187 -16.129 1.00 2.30 O ATOM 0 H GLU A 131 12.665 -1.943 -11.705 1.00 0.59 H new ATOM 0 HA GLU A 131 13.041 -4.191 -13.530 1.00 0.55 H new ATOM 0 HB2 GLU A 131 14.796 -1.967 -12.323 1.00 0.63 H new ATOM 0 HB3 GLU A 131 15.358 -3.031 -13.597 1.00 0.63 H new ATOM 0 HG2 GLU A 131 12.868 -1.261 -13.803 1.00 1.38 H new ATOM 0 HG3 GLU A 131 14.434 -0.839 -14.467 1.00 1.38 H new ATOM 665 N LYS A 132 14.533 -4.364 -10.624 1.00 0.51 N ATOM 666 CA LYS A 132 15.250 -5.335 -9.741 1.00 0.53 C ATOM 667 C LYS A 132 14.323 -6.492 -9.365 1.00 0.54 C ATOM 668 O LYS A 132 14.731 -7.636 -9.317 1.00 0.63 O ATOM 669 CB LYS A 132 15.664 -4.536 -8.504 1.00 0.68 C ATOM 670 CG LYS A 132 16.603 -5.385 -7.644 1.00 1.39 C ATOM 671 CD LYS A 132 17.209 -4.518 -6.539 1.00 1.91 C ATOM 672 CE LYS A 132 18.005 -5.400 -5.575 1.00 2.62 C ATOM 673 NZ LYS A 132 19.030 -4.496 -4.986 1.00 2.69 N ATOM 0 H LYS A 132 14.321 -3.464 -10.194 1.00 0.51 H new ATOM 0 HA LYS A 132 16.116 -5.776 -10.234 1.00 0.53 H new ATOM 0 HB2 LYS A 132 16.161 -3.613 -8.803 1.00 0.68 H new ATOM 0 HB3 LYS A 132 14.783 -4.252 -7.929 1.00 0.68 H new ATOM 0 HG2 LYS A 132 16.056 -6.220 -7.206 1.00 1.39 H new ATOM 0 HG3 LYS A 132 17.394 -5.810 -8.262 1.00 1.39 H new ATOM 0 HD2 LYS A 132 17.859 -3.758 -6.974 1.00 1.91 H new ATOM 0 HD3 LYS A 132 16.420 -3.993 -6.001 1.00 1.91 H new ATOM 0 HE2 LYS A 132 17.361 -5.823 -4.804 1.00 2.62 H new ATOM 0 HE3 LYS A 132 18.469 -6.237 -6.097 1.00 2.62 H new ATOM 0 HZ1 LYS A 132 19.617 -5.029 -4.313 1.00 2.69 H new ATOM 0 HZ2 LYS A 132 19.632 -4.114 -5.743 1.00 2.69 H new ATOM 0 HZ3 LYS A 132 18.558 -3.713 -4.490 1.00 2.69 H new ATOM 687 N TYR A 133 13.081 -6.195 -9.096 1.00 0.55 N ATOM 688 CA TYR A 133 12.109 -7.260 -8.716 1.00 0.65 C ATOM 689 C TYR A 133 11.073 -7.426 -9.839 1.00 0.54 C ATOM 690 O TYR A 133 10.114 -6.685 -9.899 1.00 0.66 O ATOM 691 CB TYR A 133 11.451 -6.745 -7.436 1.00 0.89 C ATOM 692 CG TYR A 133 12.510 -6.540 -6.377 1.00 1.14 C ATOM 693 CD1 TYR A 133 13.080 -7.642 -5.731 1.00 2.20 C ATOM 694 CD2 TYR A 133 12.927 -5.244 -6.050 1.00 0.98 C ATOM 695 CE1 TYR A 133 14.068 -7.449 -4.757 1.00 2.44 C ATOM 696 CE2 TYR A 133 13.913 -5.051 -5.077 1.00 1.14 C ATOM 697 CZ TYR A 133 14.484 -6.153 -4.430 1.00 1.67 C ATOM 698 OH TYR A 133 15.458 -5.962 -3.471 1.00 1.95 O ATOM 0 H TYR A 133 12.694 -5.251 -9.123 1.00 0.55 H new ATOM 0 HA TYR A 133 12.576 -8.233 -8.563 1.00 0.65 H new ATOM 0 HB2 TYR A 133 10.931 -5.807 -7.633 1.00 0.89 H new ATOM 0 HB3 TYR A 133 10.703 -7.457 -7.086 1.00 0.89 H new ATOM 0 HD1 TYR A 133 12.758 -8.642 -5.983 1.00 2.20 H new ATOM 0 HD2 TYR A 133 12.487 -4.393 -6.549 1.00 0.98 H new ATOM 0 HE1 TYR A 133 14.509 -8.300 -4.259 1.00 2.44 H new ATOM 0 HE2 TYR A 133 14.234 -4.051 -4.825 1.00 1.14 H new ATOM 0 HH TYR A 133 15.079 -6.126 -2.582 1.00 1.95 H new ATOM 708 N PRO A 134 11.312 -8.376 -10.718 1.00 0.51 N ATOM 709 CA PRO A 134 10.388 -8.592 -11.858 1.00 0.53 C ATOM 710 C PRO A 134 9.103 -9.318 -11.440 1.00 0.47 C ATOM 711 O PRO A 134 8.124 -9.290 -12.164 1.00 0.54 O ATOM 712 CB PRO A 134 11.197 -9.464 -12.813 1.00 0.70 C ATOM 713 CG PRO A 134 12.191 -10.179 -11.954 1.00 0.76 C ATOM 714 CD PRO A 134 12.445 -9.319 -10.743 1.00 0.66 C ATOM 0 HA PRO A 134 10.057 -7.649 -12.293 1.00 0.53 H new ATOM 0 HB2 PRO A 134 10.555 -10.169 -13.340 1.00 0.70 H new ATOM 0 HB3 PRO A 134 11.696 -8.859 -13.570 1.00 0.70 H new ATOM 0 HG2 PRO A 134 11.809 -11.156 -11.657 1.00 0.76 H new ATOM 0 HG3 PRO A 134 13.117 -10.352 -12.502 1.00 0.76 H new ATOM 0 HD2 PRO A 134 12.484 -9.917 -9.832 1.00 0.66 H new ATOM 0 HD3 PRO A 134 13.397 -8.794 -10.821 1.00 0.66 H new ATOM 722 N ARG A 135 9.086 -9.984 -10.305 1.00 0.43 N ATOM 723 CA ARG A 135 7.838 -10.712 -9.911 1.00 0.48 C ATOM 724 C ARG A 135 7.652 -10.785 -8.389 1.00 0.43 C ATOM 725 O ARG A 135 6.849 -11.562 -7.905 1.00 0.60 O ATOM 726 CB ARG A 135 8.012 -12.113 -10.495 1.00 0.70 C ATOM 727 CG ARG A 135 6.641 -12.766 -10.668 1.00 0.91 C ATOM 728 CD ARG A 135 5.854 -12.008 -11.740 1.00 1.17 C ATOM 729 NE ARG A 135 4.826 -12.970 -12.221 1.00 1.44 N ATOM 730 CZ ARG A 135 4.714 -13.215 -13.498 1.00 2.17 C ATOM 731 NH1 ARG A 135 4.366 -12.260 -14.317 1.00 2.61 N ATOM 732 NH2 ARG A 135 4.954 -14.413 -13.957 1.00 3.07 N ATOM 0 H ARG A 135 9.864 -10.053 -9.650 1.00 0.43 H new ATOM 0 HA ARG A 135 6.951 -10.198 -10.283 1.00 0.48 H new ATOM 0 HB2 ARG A 135 8.524 -12.057 -11.456 1.00 0.70 H new ATOM 0 HB3 ARG A 135 8.635 -12.719 -9.836 1.00 0.70 H new ATOM 0 HG2 ARG A 135 6.756 -13.811 -10.955 1.00 0.91 H new ATOM 0 HG3 ARG A 135 6.097 -12.753 -9.723 1.00 0.91 H new ATOM 0 HD2 ARG A 135 5.392 -11.111 -11.329 1.00 1.17 H new ATOM 0 HD3 ARG A 135 6.505 -11.687 -12.554 1.00 1.17 H new ATOM 0 HE ARG A 135 4.211 -13.437 -11.555 1.00 1.44 H new ATOM 0 HH11 ARG A 135 4.182 -11.323 -13.959 1.00 2.61 H new ATOM 0 HH12 ARG A 135 4.278 -12.451 -15.315 1.00 2.61 H new ATOM 0 HH21 ARG A 135 5.229 -15.158 -13.318 1.00 3.07 H new ATOM 0 HH22 ARG A 135 4.866 -14.604 -14.955 1.00 3.07 H new ATOM 746 N SER A 136 8.365 -9.989 -7.630 1.00 0.51 N ATOM 747 CA SER A 136 8.194 -10.031 -6.147 1.00 0.44 C ATOM 748 C SER A 136 7.202 -8.966 -5.708 1.00 0.33 C ATOM 749 O SER A 136 7.477 -7.782 -5.745 1.00 0.30 O ATOM 750 CB SER A 136 9.582 -9.756 -5.580 1.00 0.50 C ATOM 751 OG SER A 136 9.609 -10.120 -4.206 1.00 0.90 O ATOM 0 H SER A 136 9.053 -9.317 -7.971 1.00 0.51 H new ATOM 0 HA SER A 136 7.803 -10.986 -5.798 1.00 0.44 H new ATOM 0 HB2 SER A 136 10.332 -10.322 -6.133 1.00 0.50 H new ATOM 0 HB3 SER A 136 9.831 -8.701 -5.694 1.00 0.50 H new ATOM 0 HG SER A 136 10.486 -10.498 -3.985 1.00 0.90 H new ATOM 757 N LEU A 137 6.045 -9.396 -5.283 1.00 0.31 N ATOM 758 CA LEU A 137 5.003 -8.436 -4.821 1.00 0.24 C ATOM 759 C LEU A 137 5.539 -7.663 -3.619 1.00 0.20 C ATOM 760 O LEU A 137 5.387 -6.466 -3.512 1.00 0.21 O ATOM 761 CB LEU A 137 3.817 -9.319 -4.399 1.00 0.23 C ATOM 762 CG LEU A 137 2.664 -8.450 -3.900 1.00 0.21 C ATOM 763 CD1 LEU A 137 2.042 -7.687 -5.080 1.00 0.23 C ATOM 764 CD2 LEU A 137 1.612 -9.352 -3.239 1.00 0.27 C ATOM 0 H LEU A 137 5.775 -10.379 -5.236 1.00 0.31 H new ATOM 0 HA LEU A 137 4.719 -7.712 -5.585 1.00 0.24 H new ATOM 0 HB2 LEU A 137 3.487 -9.925 -5.243 1.00 0.23 H new ATOM 0 HB3 LEU A 137 4.129 -10.008 -3.614 1.00 0.23 H new ATOM 0 HG LEU A 137 3.031 -7.727 -3.172 1.00 0.21 H new ATOM 0 HD11 LEU A 137 1.220 -7.068 -4.720 1.00 0.23 H new ATOM 0 HD12 LEU A 137 2.798 -7.053 -5.542 1.00 0.23 H new ATOM 0 HD13 LEU A 137 1.666 -8.398 -5.815 1.00 0.23 H new ATOM 0 HD21 LEU A 137 0.784 -8.742 -2.879 1.00 0.27 H new ATOM 0 HD22 LEU A 137 1.241 -10.073 -3.968 1.00 0.27 H new ATOM 0 HD23 LEU A 137 2.063 -9.883 -2.400 1.00 0.27 H new ATOM 776 N SER A 138 6.157 -8.368 -2.715 1.00 0.24 N ATOM 777 CA SER A 138 6.714 -7.730 -1.479 1.00 0.26 C ATOM 778 C SER A 138 7.804 -6.687 -1.780 1.00 0.20 C ATOM 779 O SER A 138 7.818 -5.615 -1.205 1.00 0.22 O ATOM 780 CB SER A 138 7.314 -8.890 -0.684 1.00 0.38 C ATOM 781 OG SER A 138 7.836 -8.401 0.545 1.00 1.01 O ATOM 0 H SER A 138 6.305 -9.375 -2.776 1.00 0.24 H new ATOM 0 HA SER A 138 5.934 -7.188 -0.944 1.00 0.26 H new ATOM 0 HB2 SER A 138 6.553 -9.646 -0.493 1.00 0.38 H new ATOM 0 HB3 SER A 138 8.104 -9.371 -1.261 1.00 0.38 H new ATOM 0 HG SER A 138 8.220 -9.144 1.056 1.00 1.01 H new ATOM 787 N GLU A 139 8.745 -7.018 -2.629 1.00 0.24 N ATOM 788 CA GLU A 139 9.878 -6.070 -2.913 1.00 0.25 C ATOM 789 C GLU A 139 9.421 -4.804 -3.645 1.00 0.21 C ATOM 790 O GLU A 139 9.909 -3.722 -3.375 1.00 0.21 O ATOM 791 CB GLU A 139 10.835 -6.840 -3.824 1.00 0.39 C ATOM 792 CG GLU A 139 11.332 -8.112 -3.128 1.00 1.09 C ATOM 793 CD GLU A 139 12.264 -7.748 -1.967 1.00 2.02 C ATOM 794 OE1 GLU A 139 12.885 -6.700 -2.033 1.00 2.24 O ATOM 795 OE2 GLU A 139 12.340 -8.527 -1.032 1.00 2.92 O ATOM 0 H GLU A 139 8.782 -7.901 -3.139 1.00 0.24 H new ATOM 0 HA GLU A 139 10.329 -5.744 -1.976 1.00 0.25 H new ATOM 0 HB2 GLU A 139 10.330 -7.101 -4.754 1.00 0.39 H new ATOM 0 HB3 GLU A 139 11.683 -6.208 -4.088 1.00 0.39 H new ATOM 0 HG2 GLU A 139 10.484 -8.688 -2.757 1.00 1.09 H new ATOM 0 HG3 GLU A 139 11.859 -8.745 -3.843 1.00 1.09 H new ATOM 802 N ARG A 140 8.533 -4.932 -4.595 1.00 0.26 N ATOM 803 CA ARG A 140 8.100 -3.730 -5.376 1.00 0.33 C ATOM 804 C ARG A 140 7.199 -2.806 -4.551 1.00 0.29 C ATOM 805 O ARG A 140 7.396 -1.606 -4.520 1.00 0.35 O ATOM 806 CB ARG A 140 7.337 -4.285 -6.581 1.00 0.42 C ATOM 807 CG ARG A 140 8.262 -5.184 -7.408 1.00 1.07 C ATOM 808 CD ARG A 140 7.508 -5.705 -8.636 1.00 1.17 C ATOM 809 NE ARG A 140 7.426 -4.541 -9.566 1.00 0.98 N ATOM 810 CZ ARG A 140 7.070 -4.722 -10.810 1.00 1.13 C ATOM 811 NH1 ARG A 140 7.677 -5.617 -11.541 1.00 1.60 N ATOM 812 NH2 ARG A 140 6.107 -4.006 -11.323 1.00 1.55 N ATOM 0 H ARG A 140 8.089 -5.810 -4.865 1.00 0.26 H new ATOM 0 HA ARG A 140 8.958 -3.125 -5.669 1.00 0.33 H new ATOM 0 HB2 ARG A 140 6.469 -4.852 -6.244 1.00 0.42 H new ATOM 0 HB3 ARG A 140 6.964 -3.466 -7.196 1.00 0.42 H new ATOM 0 HG2 ARG A 140 9.145 -4.626 -7.720 1.00 1.07 H new ATOM 0 HG3 ARG A 140 8.611 -6.020 -6.802 1.00 1.07 H new ATOM 0 HD2 ARG A 140 8.035 -6.541 -9.096 1.00 1.17 H new ATOM 0 HD3 ARG A 140 6.515 -6.064 -8.366 1.00 1.17 H new ATOM 0 HE ARG A 140 7.648 -3.604 -9.230 1.00 0.98 H new ATOM 0 HH11 ARG A 140 8.430 -6.176 -11.141 1.00 1.60 H new ATOM 0 HH12 ARG A 140 7.398 -5.757 -12.512 1.00 1.60 H new ATOM 0 HH21 ARG A 140 5.633 -3.306 -10.753 1.00 1.55 H new ATOM 0 HH22 ARG A 140 5.829 -4.147 -12.294 1.00 1.55 H new ATOM 826 N VAL A 141 6.203 -3.350 -3.909 1.00 0.24 N ATOM 827 CA VAL A 141 5.267 -2.499 -3.108 1.00 0.27 C ATOM 828 C VAL A 141 5.954 -1.817 -1.917 1.00 0.25 C ATOM 829 O VAL A 141 5.653 -0.687 -1.601 1.00 0.29 O ATOM 830 CB VAL A 141 4.169 -3.439 -2.613 1.00 0.28 C ATOM 831 CG1 VAL A 141 3.450 -4.075 -3.806 1.00 0.33 C ATOM 832 CG2 VAL A 141 4.771 -4.537 -1.736 1.00 0.23 C ATOM 0 H VAL A 141 5.993 -4.348 -3.902 1.00 0.24 H new ATOM 0 HA VAL A 141 4.879 -1.690 -3.727 1.00 0.27 H new ATOM 0 HB VAL A 141 3.455 -2.863 -2.025 1.00 0.28 H new ATOM 0 HG11 VAL A 141 2.669 -4.744 -3.445 1.00 0.33 H new ATOM 0 HG12 VAL A 141 3.003 -3.293 -4.421 1.00 0.33 H new ATOM 0 HG13 VAL A 141 4.165 -4.641 -4.402 1.00 0.33 H new ATOM 0 HG21 VAL A 141 3.979 -5.201 -1.389 1.00 0.23 H new ATOM 0 HG22 VAL A 141 5.496 -5.109 -2.315 1.00 0.23 H new ATOM 0 HG23 VAL A 141 5.268 -4.085 -0.877 1.00 0.23 H new ATOM 842 N ARG A 142 6.835 -2.497 -1.227 1.00 0.21 N ATOM 843 CA ARG A 142 7.481 -1.876 -0.024 1.00 0.22 C ATOM 844 C ARG A 142 8.165 -0.546 -0.360 1.00 0.24 C ATOM 845 O ARG A 142 7.981 0.431 0.340 1.00 0.25 O ATOM 846 CB ARG A 142 8.504 -2.897 0.477 1.00 0.27 C ATOM 847 CG ARG A 142 7.783 -4.007 1.249 1.00 0.28 C ATOM 848 CD ARG A 142 8.807 -5.022 1.765 1.00 1.02 C ATOM 849 NE ARG A 142 7.998 -6.068 2.452 1.00 0.94 N ATOM 850 CZ ARG A 142 8.291 -6.427 3.674 1.00 1.48 C ATOM 851 NH1 ARG A 142 9.182 -7.356 3.887 1.00 2.24 N ATOM 852 NH2 ARG A 142 7.690 -5.857 4.683 1.00 2.10 N ATOM 0 H ARG A 142 7.135 -3.448 -1.440 1.00 0.21 H new ATOM 0 HA ARG A 142 6.733 -1.642 0.734 1.00 0.22 H new ATOM 0 HB2 ARG A 142 9.052 -3.321 -0.364 1.00 0.27 H new ATOM 0 HB3 ARG A 142 9.236 -2.409 1.120 1.00 0.27 H new ATOM 0 HG2 ARG A 142 7.226 -3.581 2.083 1.00 0.28 H new ATOM 0 HG3 ARG A 142 7.059 -4.502 0.602 1.00 0.28 H new ATOM 0 HD2 ARG A 142 9.389 -5.447 0.947 1.00 1.02 H new ATOM 0 HD3 ARG A 142 9.514 -4.556 2.451 1.00 1.02 H new ATOM 0 HE ARG A 142 7.214 -6.505 1.967 1.00 0.94 H new ATOM 0 HH11 ARG A 142 9.651 -7.803 3.099 1.00 2.24 H new ATOM 0 HH12 ARG A 142 9.410 -7.635 4.841 1.00 2.24 H new ATOM 0 HH21 ARG A 142 6.992 -5.132 4.517 1.00 2.10 H new ATOM 0 HH22 ARG A 142 7.918 -6.137 5.637 1.00 2.10 H new ATOM 866 N GLU A 143 8.945 -0.486 -1.411 1.00 0.26 N ATOM 867 CA GLU A 143 9.624 0.808 -1.750 1.00 0.31 C ATOM 868 C GLU A 143 8.581 1.899 -2.017 1.00 0.30 C ATOM 869 O GLU A 143 8.638 2.984 -1.459 1.00 0.31 O ATOM 870 CB GLU A 143 10.441 0.520 -3.009 1.00 0.36 C ATOM 871 CG GLU A 143 11.349 1.717 -3.309 1.00 0.44 C ATOM 872 CD GLU A 143 12.378 1.891 -2.183 1.00 0.97 C ATOM 873 OE1 GLU A 143 12.651 0.920 -1.493 1.00 1.62 O ATOM 874 OE2 GLU A 143 12.880 2.992 -2.034 1.00 1.84 O ATOM 0 H GLU A 143 9.141 -1.263 -2.042 1.00 0.26 H new ATOM 0 HA GLU A 143 10.255 1.166 -0.936 1.00 0.31 H new ATOM 0 HB2 GLU A 143 11.040 -0.380 -2.869 1.00 0.36 H new ATOM 0 HB3 GLU A 143 9.777 0.333 -3.853 1.00 0.36 H new ATOM 0 HG2 GLU A 143 11.860 1.567 -4.260 1.00 0.44 H new ATOM 0 HG3 GLU A 143 10.750 2.622 -3.409 1.00 0.44 H new ATOM 881 N SER A 144 7.623 1.606 -2.854 1.00 0.29 N ATOM 882 CA SER A 144 6.553 2.605 -3.162 1.00 0.29 C ATOM 883 C SER A 144 5.696 2.853 -1.916 1.00 0.28 C ATOM 884 O SER A 144 5.261 3.960 -1.657 1.00 0.28 O ATOM 885 CB SER A 144 5.718 1.970 -4.274 1.00 0.29 C ATOM 886 OG SER A 144 5.153 0.754 -3.801 1.00 1.34 O ATOM 0 H SER A 144 7.533 0.714 -3.341 1.00 0.29 H new ATOM 0 HA SER A 144 6.961 3.569 -3.467 1.00 0.29 H new ATOM 0 HB2 SER A 144 4.929 2.653 -4.587 1.00 0.29 H new ATOM 0 HB3 SER A 144 6.340 1.779 -5.148 1.00 0.29 H new ATOM 0 HG SER A 144 5.669 0.430 -3.033 1.00 1.34 H new ATOM 892 N LEU A 145 5.458 1.825 -1.144 1.00 0.27 N ATOM 893 CA LEU A 145 4.639 1.979 0.094 1.00 0.28 C ATOM 894 C LEU A 145 5.406 2.784 1.146 1.00 0.30 C ATOM 895 O LEU A 145 4.833 3.594 1.846 1.00 0.30 O ATOM 896 CB LEU A 145 4.391 0.560 0.615 1.00 0.29 C ATOM 897 CG LEU A 145 3.330 -0.153 -0.228 1.00 0.37 C ATOM 898 CD1 LEU A 145 3.287 -1.629 0.166 1.00 0.73 C ATOM 899 CD2 LEU A 145 1.965 0.481 0.032 1.00 0.67 C ATOM 0 H LEU A 145 5.798 0.880 -1.320 1.00 0.27 H new ATOM 0 HA LEU A 145 3.708 2.507 -0.113 1.00 0.28 H new ATOM 0 HB2 LEU A 145 5.321 -0.008 0.593 1.00 0.29 H new ATOM 0 HB3 LEU A 145 4.068 0.601 1.655 1.00 0.29 H new ATOM 0 HG LEU A 145 3.577 -0.061 -1.286 1.00 0.37 H new ATOM 0 HD11 LEU A 145 2.533 -2.143 -0.431 1.00 0.73 H new ATOM 0 HD12 LEU A 145 4.262 -2.082 -0.013 1.00 0.73 H new ATOM 0 HD13 LEU A 145 3.035 -1.716 1.223 1.00 0.73 H new ATOM 0 HD21 LEU A 145 1.208 -0.025 -0.567 1.00 0.67 H new ATOM 0 HD22 LEU A 145 1.715 0.385 1.089 1.00 0.67 H new ATOM 0 HD23 LEU A 145 1.996 1.536 -0.239 1.00 0.67 H new ATOM 911 N LYS A 146 6.694 2.557 1.272 1.00 0.33 N ATOM 912 CA LYS A 146 7.494 3.303 2.298 1.00 0.35 C ATOM 913 C LYS A 146 7.437 4.812 2.053 1.00 0.34 C ATOM 914 O LYS A 146 7.199 5.582 2.967 1.00 0.35 O ATOM 915 CB LYS A 146 8.932 2.793 2.149 1.00 0.41 C ATOM 916 CG LYS A 146 9.088 1.452 2.872 1.00 1.01 C ATOM 917 CD LYS A 146 10.509 0.920 2.661 1.00 1.15 C ATOM 918 CE LYS A 146 10.717 -0.341 3.506 1.00 1.96 C ATOM 919 NZ LYS A 146 11.998 -0.924 3.016 1.00 2.32 N ATOM 0 H LYS A 146 7.224 1.890 0.711 1.00 0.33 H new ATOM 0 HA LYS A 146 7.102 3.136 3.302 1.00 0.35 H new ATOM 0 HB2 LYS A 146 9.178 2.678 1.094 1.00 0.41 H new ATOM 0 HB3 LYS A 146 9.630 3.522 2.561 1.00 0.41 H new ATOM 0 HG2 LYS A 146 8.889 1.575 3.937 1.00 1.01 H new ATOM 0 HG3 LYS A 146 8.360 0.735 2.492 1.00 1.01 H new ATOM 0 HD2 LYS A 146 10.671 0.694 1.607 1.00 1.15 H new ATOM 0 HD3 LYS A 146 11.238 1.681 2.940 1.00 1.15 H new ATOM 0 HE2 LYS A 146 10.773 -0.100 4.568 1.00 1.96 H new ATOM 0 HE3 LYS A 146 9.891 -1.041 3.381 1.00 1.96 H new ATOM 0 HZ1 LYS A 146 12.210 -1.793 3.547 1.00 2.32 H new ATOM 0 HZ2 LYS A 146 11.912 -1.149 2.004 1.00 2.32 H new ATOM 0 HZ3 LYS A 146 12.767 -0.238 3.154 1.00 2.32 H new ATOM 933 N VAL A 147 7.661 5.252 0.842 1.00 0.32 N ATOM 934 CA VAL A 147 7.612 6.724 0.580 1.00 0.33 C ATOM 935 C VAL A 147 6.195 7.272 0.802 1.00 0.31 C ATOM 936 O VAL A 147 6.020 8.296 1.436 1.00 0.31 O ATOM 937 CB VAL A 147 8.083 6.920 -0.862 1.00 0.36 C ATOM 938 CG1 VAL A 147 9.517 6.406 -0.981 1.00 0.40 C ATOM 939 CG2 VAL A 147 7.182 6.159 -1.842 1.00 0.36 C ATOM 0 H VAL A 147 7.873 4.667 0.033 1.00 0.32 H new ATOM 0 HA VAL A 147 8.254 7.274 1.267 1.00 0.33 H new ATOM 0 HB VAL A 147 8.036 7.980 -1.111 1.00 0.36 H new ATOM 0 HG11 VAL A 147 9.867 6.539 -2.005 1.00 0.40 H new ATOM 0 HG12 VAL A 147 10.161 6.964 -0.302 1.00 0.40 H new ATOM 0 HG13 VAL A 147 9.547 5.348 -0.722 1.00 0.40 H new ATOM 0 HG21 VAL A 147 7.539 6.315 -2.860 1.00 0.36 H new ATOM 0 HG22 VAL A 147 7.207 5.095 -1.608 1.00 0.36 H new ATOM 0 HG23 VAL A 147 6.159 6.526 -1.756 1.00 0.36 H new ATOM 949 N TRP A 148 5.183 6.600 0.303 1.00 0.32 N ATOM 950 CA TRP A 148 3.785 7.096 0.513 1.00 0.33 C ATOM 951 C TRP A 148 3.464 7.119 2.021 1.00 0.32 C ATOM 952 O TRP A 148 3.004 8.120 2.541 1.00 0.32 O ATOM 953 CB TRP A 148 2.873 6.116 -0.274 1.00 0.36 C ATOM 954 CG TRP A 148 1.470 6.117 0.281 1.00 0.28 C ATOM 955 CD1 TRP A 148 0.711 7.218 0.500 1.00 0.30 C ATOM 956 CD2 TRP A 148 0.668 4.977 0.697 1.00 0.24 C ATOM 957 NE1 TRP A 148 -0.494 6.823 1.066 1.00 0.23 N ATOM 958 CE2 TRP A 148 -0.571 5.447 1.200 1.00 0.18 C ATOM 959 CE3 TRP A 148 0.900 3.591 0.695 1.00 0.31 C ATOM 960 CZ2 TRP A 148 -1.543 4.562 1.690 1.00 0.17 C ATOM 961 CZ3 TRP A 148 -0.076 2.707 1.175 1.00 0.33 C ATOM 962 CH2 TRP A 148 -1.288 3.192 1.674 1.00 0.27 C ATOM 0 H TRP A 148 5.263 5.738 -0.236 1.00 0.32 H new ATOM 0 HA TRP A 148 3.637 8.115 0.157 1.00 0.33 H new ATOM 0 HB2 TRP A 148 2.852 6.400 -1.326 1.00 0.36 H new ATOM 0 HB3 TRP A 148 3.287 5.109 -0.224 1.00 0.36 H new ATOM 0 HD1 TRP A 148 0.996 8.234 0.272 1.00 0.30 H new ATOM 0 HE1 TRP A 148 -1.232 7.468 1.349 1.00 0.23 H new ATOM 0 HE3 TRP A 148 1.837 3.204 0.321 1.00 0.31 H new ATOM 0 HZ2 TRP A 148 -2.479 4.938 2.076 1.00 0.17 H new ATOM 0 HZ3 TRP A 148 0.110 1.643 1.159 1.00 0.33 H new ATOM 0 HH2 TRP A 148 -2.030 2.502 2.049 1.00 0.27 H new ATOM 973 N LYS A 149 3.693 6.030 2.722 1.00 0.36 N ATOM 974 CA LYS A 149 3.386 6.012 4.186 1.00 0.38 C ATOM 975 C LYS A 149 4.212 7.091 4.912 1.00 0.34 C ATOM 976 O LYS A 149 3.746 7.719 5.843 1.00 0.33 O ATOM 977 CB LYS A 149 3.711 4.588 4.688 1.00 0.52 C ATOM 978 CG LYS A 149 5.225 4.349 4.757 1.00 1.36 C ATOM 979 CD LYS A 149 5.501 3.014 5.449 1.00 2.07 C ATOM 980 CE LYS A 149 6.898 3.049 6.074 1.00 2.80 C ATOM 981 NZ LYS A 149 7.304 1.622 6.190 1.00 3.70 N ATOM 0 H LYS A 149 4.075 5.163 2.346 1.00 0.36 H new ATOM 0 HA LYS A 149 2.340 6.242 4.386 1.00 0.38 H new ATOM 0 HB2 LYS A 149 3.273 4.440 5.675 1.00 0.52 H new ATOM 0 HB3 LYS A 149 3.255 3.854 4.024 1.00 0.52 H new ATOM 0 HG2 LYS A 149 5.649 4.344 3.753 1.00 1.36 H new ATOM 0 HG3 LYS A 149 5.707 5.160 5.303 1.00 1.36 H new ATOM 0 HD2 LYS A 149 4.751 2.827 6.217 1.00 2.07 H new ATOM 0 HD3 LYS A 149 5.432 2.197 4.730 1.00 2.07 H new ATOM 0 HE2 LYS A 149 7.595 3.608 5.450 1.00 2.80 H new ATOM 0 HE3 LYS A 149 6.882 3.535 7.049 1.00 2.80 H new ATOM 0 HZ1 LYS A 149 8.335 1.544 6.077 1.00 3.70 H new ATOM 0 HZ2 LYS A 149 7.030 1.258 7.125 1.00 3.70 H new ATOM 0 HZ3 LYS A 149 6.832 1.065 5.449 1.00 3.70 H new ATOM 995 N ASN A 150 5.435 7.304 4.480 1.00 0.37 N ATOM 996 CA ASN A 150 6.300 8.339 5.133 1.00 0.41 C ATOM 997 C ASN A 150 5.652 9.719 5.033 1.00 0.39 C ATOM 998 O ASN A 150 5.670 10.488 5.977 1.00 0.46 O ATOM 999 CB ASN A 150 7.620 8.308 4.354 1.00 0.50 C ATOM 1000 CG ASN A 150 8.595 9.335 4.937 1.00 1.07 C ATOM 1001 OD1 ASN A 150 8.687 10.445 4.452 1.00 1.86 O ATOM 1002 ND2 ASN A 150 9.330 9.011 5.963 1.00 1.27 N ATOM 0 H ASN A 150 5.870 6.805 3.704 1.00 0.37 H new ATOM 0 HA ASN A 150 6.447 8.137 6.194 1.00 0.41 H new ATOM 0 HB2 ASN A 150 8.057 7.311 4.402 1.00 0.50 H new ATOM 0 HB3 ASN A 150 7.436 8.525 3.302 1.00 0.50 H new ATOM 0 HD21 ASN A 150 9.982 9.689 6.358 1.00 1.27 H new ATOM 0 HD22 ASN A 150 9.254 8.079 6.371 1.00 1.27 H new ATOM 1009 N ALA A 151 5.079 10.039 3.902 1.00 0.38 N ATOM 1010 CA ALA A 151 4.429 11.374 3.752 1.00 0.49 C ATOM 1011 C ALA A 151 3.219 11.460 4.683 1.00 0.53 C ATOM 1012 O ALA A 151 3.083 12.394 5.451 1.00 0.72 O ATOM 1013 CB ALA A 151 3.997 11.456 2.286 1.00 0.57 C ATOM 0 H ALA A 151 5.033 9.437 3.080 1.00 0.38 H new ATOM 0 HA ALA A 151 5.097 12.195 4.012 1.00 0.49 H new ATOM 0 HB1 ALA A 151 3.510 12.414 2.103 1.00 0.57 H new ATOM 0 HB2 ALA A 151 4.873 11.365 1.643 1.00 0.57 H new ATOM 0 HB3 ALA A 151 3.300 10.647 2.066 1.00 0.57 H new ATOM 1019 N GLU A 152 2.344 10.487 4.625 1.00 0.40 N ATOM 1020 CA GLU A 152 1.144 10.502 5.514 1.00 0.50 C ATOM 1021 C GLU A 152 1.511 10.117 6.949 1.00 0.60 C ATOM 1022 O GLU A 152 1.938 9.009 7.207 1.00 1.48 O ATOM 1023 CB GLU A 152 0.185 9.468 4.924 1.00 0.44 C ATOM 1024 CG GLU A 152 -0.597 10.102 3.772 1.00 0.77 C ATOM 1025 CD GLU A 152 -1.570 9.084 3.160 1.00 1.10 C ATOM 1026 OE1 GLU A 152 -1.482 7.913 3.500 1.00 1.66 O ATOM 1027 OE2 GLU A 152 -2.392 9.496 2.359 1.00 1.81 O ATOM 0 H GLU A 152 2.410 9.683 4.000 1.00 0.40 H new ATOM 0 HA GLU A 152 0.703 11.498 5.560 1.00 0.50 H new ATOM 0 HB2 GLU A 152 0.741 8.601 4.567 1.00 0.44 H new ATOM 0 HB3 GLU A 152 -0.502 9.112 5.692 1.00 0.44 H new ATOM 0 HG2 GLU A 152 -1.149 10.970 4.133 1.00 0.77 H new ATOM 0 HG3 GLU A 152 0.094 10.459 3.008 1.00 0.77 H new ATOM 1034 N LYS A 153 1.309 11.010 7.886 1.00 0.76 N ATOM 1035 CA LYS A 153 1.595 10.681 9.315 1.00 0.67 C ATOM 1036 C LYS A 153 0.291 10.187 9.954 1.00 0.64 C ATOM 1037 O LYS A 153 0.104 9.004 10.163 1.00 0.57 O ATOM 1038 CB LYS A 153 2.089 11.984 9.951 1.00 0.86 C ATOM 1039 CG LYS A 153 2.406 11.744 11.429 1.00 1.17 C ATOM 1040 CD LYS A 153 3.007 13.014 12.035 1.00 1.57 C ATOM 1041 CE LYS A 153 3.224 12.811 13.537 1.00 2.22 C ATOM 1042 NZ LYS A 153 3.936 14.038 13.994 1.00 2.51 N ATOM 0 H LYS A 153 0.958 11.954 7.722 1.00 0.76 H new ATOM 0 HA LYS A 153 2.345 9.900 9.445 1.00 0.67 H new ATOM 0 HB2 LYS A 153 2.978 12.340 9.431 1.00 0.86 H new ATOM 0 HB3 LYS A 153 1.330 12.760 9.853 1.00 0.86 H new ATOM 0 HG2 LYS A 153 1.499 11.466 11.966 1.00 1.17 H new ATOM 0 HG3 LYS A 153 3.104 10.914 11.532 1.00 1.17 H new ATOM 0 HD2 LYS A 153 3.954 13.249 11.549 1.00 1.57 H new ATOM 0 HD3 LYS A 153 2.342 13.861 11.864 1.00 1.57 H new ATOM 0 HE2 LYS A 153 2.275 12.688 14.060 1.00 2.22 H new ATOM 0 HE3 LYS A 153 3.815 11.916 13.733 1.00 2.22 H new ATOM 0 HZ1 LYS A 153 4.120 13.972 15.016 1.00 2.51 H new ATOM 0 HZ2 LYS A 153 4.838 14.126 13.485 1.00 2.51 H new ATOM 0 HZ3 LYS A 153 3.347 14.873 13.801 1.00 2.51 H new ATOM 1056 N LYS A 154 -0.632 11.078 10.221 1.00 0.73 N ATOM 1057 CA LYS A 154 -1.948 10.650 10.784 1.00 0.77 C ATOM 1058 C LYS A 154 -2.704 9.865 9.705 1.00 0.62 C ATOM 1059 O LYS A 154 -3.376 8.880 9.974 1.00 0.60 O ATOM 1060 CB LYS A 154 -2.686 11.945 11.137 1.00 0.95 C ATOM 1061 CG LYS A 154 -4.061 11.610 11.720 1.00 1.29 C ATOM 1062 CD LYS A 154 -4.797 12.905 12.071 1.00 1.34 C ATOM 1063 CE LYS A 154 -6.222 12.576 12.521 1.00 2.02 C ATOM 1064 NZ LYS A 154 -6.761 13.857 13.055 1.00 2.51 N ATOM 0 H LYS A 154 -0.530 12.082 10.073 1.00 0.73 H new ATOM 0 HA LYS A 154 -1.851 10.010 11.661 1.00 0.77 H new ATOM 0 HB2 LYS A 154 -2.105 12.522 11.857 1.00 0.95 H new ATOM 0 HB3 LYS A 154 -2.798 12.565 10.248 1.00 0.95 H new ATOM 0 HG2 LYS A 154 -4.642 11.033 11.001 1.00 1.29 H new ATOM 0 HG3 LYS A 154 -3.949 10.990 12.610 1.00 1.29 H new ATOM 0 HD2 LYS A 154 -4.267 13.434 12.863 1.00 1.34 H new ATOM 0 HD3 LYS A 154 -4.821 13.568 11.206 1.00 1.34 H new ATOM 0 HE2 LYS A 154 -6.824 12.210 11.689 1.00 2.02 H new ATOM 0 HE3 LYS A 154 -6.226 11.797 13.284 1.00 2.02 H new ATOM 0 HZ1 LYS A 154 -7.737 13.713 13.384 1.00 2.51 H new ATOM 0 HZ2 LYS A 154 -6.171 14.177 13.850 1.00 2.51 H new ATOM 0 HZ3 LYS A 154 -6.752 14.577 12.305 1.00 2.51 H new ATOM 1078 N ASN A 155 -2.576 10.296 8.473 1.00 0.57 N ATOM 1079 CA ASN A 155 -3.271 9.599 7.351 1.00 0.47 C ATOM 1080 C ASN A 155 -2.566 8.277 7.015 1.00 0.37 C ATOM 1081 O ASN A 155 -3.035 7.521 6.185 1.00 0.34 O ATOM 1082 CB ASN A 155 -3.192 10.560 6.161 1.00 0.51 C ATOM 1083 CG ASN A 155 -4.083 11.779 6.418 1.00 0.76 C ATOM 1084 OD1 ASN A 155 -3.602 12.893 6.487 1.00 1.37 O ATOM 1085 ND2 ASN A 155 -5.372 11.617 6.555 1.00 1.03 N ATOM 0 H ASN A 155 -2.017 11.104 8.198 1.00 0.57 H new ATOM 0 HA ASN A 155 -4.301 9.353 7.608 1.00 0.47 H new ATOM 0 HB2 ASN A 155 -2.161 10.878 6.007 1.00 0.51 H new ATOM 0 HB3 ASN A 155 -3.509 10.052 5.250 1.00 0.51 H new ATOM 0 HD21 ASN A 155 -5.973 12.425 6.720 1.00 1.03 H new ATOM 0 HD22 ASN A 155 -5.778 10.683 6.497 1.00 1.03 H new ATOM 1092 N ALA A 156 -1.464 7.968 7.674 1.00 0.37 N ATOM 1093 CA ALA A 156 -0.775 6.671 7.403 1.00 0.33 C ATOM 1094 C ALA A 156 -1.596 5.513 7.977 1.00 0.28 C ATOM 1095 O ALA A 156 -1.233 4.366 7.810 1.00 0.28 O ATOM 1096 CB ALA A 156 0.578 6.742 8.122 1.00 0.41 C ATOM 0 H ALA A 156 -1.022 8.557 8.380 1.00 0.37 H new ATOM 0 HA ALA A 156 -0.654 6.505 6.332 1.00 0.33 H new ATOM 0 HB1 ALA A 156 1.127 5.815 7.957 1.00 0.41 H new ATOM 0 HB2 ALA A 156 1.155 7.580 7.730 1.00 0.41 H new ATOM 0 HB3 ALA A 156 0.415 6.882 9.191 1.00 0.41 H new ATOM 1102 N SER A 157 -2.693 5.787 8.655 1.00 0.28 N ATOM 1103 CA SER A 157 -3.492 4.669 9.217 1.00 0.28 C ATOM 1104 C SER A 157 -4.414 4.110 8.139 1.00 0.22 C ATOM 1105 O SER A 157 -4.570 4.680 7.061 1.00 0.21 O ATOM 1106 CB SER A 157 -4.303 5.274 10.364 1.00 0.34 C ATOM 1107 OG SER A 157 -4.728 6.585 10.011 1.00 1.05 O ATOM 0 H SER A 157 -3.056 6.723 8.835 1.00 0.28 H new ATOM 0 HA SER A 157 -2.866 3.849 9.569 1.00 0.28 H new ATOM 0 HB2 SER A 157 -5.168 4.647 10.581 1.00 0.34 H new ATOM 0 HB3 SER A 157 -3.699 5.309 11.271 1.00 0.34 H new ATOM 0 HG SER A 157 -4.063 7.237 10.315 1.00 1.05 H new ATOM 1113 N VAL A 158 -5.007 2.983 8.412 1.00 0.23 N ATOM 1114 CA VAL A 158 -5.898 2.355 7.405 1.00 0.22 C ATOM 1115 C VAL A 158 -7.057 3.280 7.051 1.00 0.18 C ATOM 1116 O VAL A 158 -7.344 3.467 5.894 1.00 0.18 O ATOM 1117 CB VAL A 158 -6.411 1.060 8.032 1.00 0.28 C ATOM 1118 CG1 VAL A 158 -5.234 0.117 8.285 1.00 0.34 C ATOM 1119 CG2 VAL A 158 -7.131 1.345 9.355 1.00 0.27 C ATOM 0 H VAL A 158 -4.912 2.471 9.289 1.00 0.23 H new ATOM 0 HA VAL A 158 -5.361 2.158 6.477 1.00 0.22 H new ATOM 0 HB VAL A 158 -7.118 0.596 7.345 1.00 0.28 H new ATOM 0 HG11 VAL A 158 -5.598 -0.808 8.732 1.00 0.34 H new ATOM 0 HG12 VAL A 158 -4.738 -0.108 7.341 1.00 0.34 H new ATOM 0 HG13 VAL A 158 -4.525 0.593 8.963 1.00 0.34 H new ATOM 0 HG21 VAL A 158 -7.488 0.409 9.784 1.00 0.27 H new ATOM 0 HG22 VAL A 158 -6.440 1.822 10.050 1.00 0.27 H new ATOM 0 HG23 VAL A 158 -7.978 2.007 9.173 1.00 0.27 H new ATOM 1129 N ALA A 159 -7.712 3.879 8.028 1.00 0.15 N ATOM 1130 CA ALA A 159 -8.862 4.806 7.732 1.00 0.13 C ATOM 1131 C ALA A 159 -8.501 5.767 6.603 1.00 0.13 C ATOM 1132 O ALA A 159 -9.326 6.108 5.773 1.00 0.15 O ATOM 1133 CB ALA A 159 -9.106 5.574 9.031 1.00 0.12 C ATOM 0 H ALA A 159 -7.499 3.765 9.019 1.00 0.15 H new ATOM 0 HA ALA A 159 -9.749 4.261 7.409 1.00 0.13 H new ATOM 0 HB1 ALA A 159 -9.932 6.271 8.892 1.00 0.12 H new ATOM 0 HB2 ALA A 159 -9.353 4.872 9.828 1.00 0.12 H new ATOM 0 HB3 ALA A 159 -8.206 6.127 9.301 1.00 0.12 H new ATOM 1139 N GLY A 160 -7.259 6.161 6.544 1.00 0.13 N ATOM 1140 CA GLY A 160 -6.825 7.060 5.445 1.00 0.15 C ATOM 1141 C GLY A 160 -6.885 6.281 4.140 1.00 0.16 C ATOM 1142 O GLY A 160 -7.710 6.552 3.282 1.00 0.18 O ATOM 0 H GLY A 160 -6.530 5.899 7.208 1.00 0.13 H new ATOM 0 HA2 GLY A 160 -7.471 7.937 5.394 1.00 0.15 H new ATOM 0 HA3 GLY A 160 -5.812 7.420 5.626 1.00 0.15 H new ATOM 1146 N LEU A 161 -6.014 5.316 3.978 1.00 0.16 N ATOM 1147 CA LEU A 161 -6.023 4.526 2.719 1.00 0.18 C ATOM 1148 C LEU A 161 -7.359 3.810 2.495 1.00 0.20 C ATOM 1149 O LEU A 161 -7.934 3.951 1.450 1.00 0.28 O ATOM 1150 CB LEU A 161 -4.905 3.489 2.866 1.00 0.19 C ATOM 1151 CG LEU A 161 -4.861 2.591 1.615 1.00 0.22 C ATOM 1152 CD1 LEU A 161 -4.131 3.312 0.473 1.00 0.23 C ATOM 1153 CD2 LEU A 161 -4.147 1.276 1.952 1.00 0.27 C ATOM 0 H LEU A 161 -5.305 5.046 4.660 1.00 0.16 H new ATOM 0 HA LEU A 161 -5.877 5.184 1.863 1.00 0.18 H new ATOM 0 HB2 LEU A 161 -3.946 3.990 2.999 1.00 0.19 H new ATOM 0 HB3 LEU A 161 -5.074 2.882 3.755 1.00 0.19 H new ATOM 0 HG LEU A 161 -5.880 2.373 1.294 1.00 0.22 H new ATOM 0 HD11 LEU A 161 -4.106 2.668 -0.406 1.00 0.23 H new ATOM 0 HD12 LEU A 161 -4.656 4.236 0.231 1.00 0.23 H new ATOM 0 HD13 LEU A 161 -3.112 3.544 0.782 1.00 0.23 H new ATOM 0 HD21 LEU A 161 -4.116 0.641 1.066 1.00 0.27 H new ATOM 0 HD22 LEU A 161 -3.130 1.488 2.282 1.00 0.27 H new ATOM 0 HD23 LEU A 161 -4.687 0.763 2.748 1.00 0.27 H new ATOM 1165 N VAL A 162 -7.837 3.009 3.433 1.00 0.22 N ATOM 1166 CA VAL A 162 -9.106 2.240 3.176 1.00 0.26 C ATOM 1167 C VAL A 162 -10.219 3.147 2.676 1.00 0.29 C ATOM 1168 O VAL A 162 -10.975 2.773 1.801 1.00 0.34 O ATOM 1169 CB VAL A 162 -9.503 1.559 4.497 1.00 0.30 C ATOM 1170 CG1 VAL A 162 -8.347 0.695 5.004 1.00 0.30 C ATOM 1171 CG2 VAL A 162 -9.890 2.588 5.572 1.00 0.31 C ATOM 0 H VAL A 162 -7.411 2.858 4.347 1.00 0.22 H new ATOM 0 HA VAL A 162 -8.941 1.498 2.394 1.00 0.26 H new ATOM 0 HB VAL A 162 -10.374 0.934 4.301 1.00 0.30 H new ATOM 0 HG11 VAL A 162 -8.634 0.215 5.940 1.00 0.30 H new ATOM 0 HG12 VAL A 162 -8.111 -0.068 4.263 1.00 0.30 H new ATOM 0 HG13 VAL A 162 -7.471 1.321 5.171 1.00 0.30 H new ATOM 0 HG21 VAL A 162 -10.164 2.069 6.490 1.00 0.31 H new ATOM 0 HG22 VAL A 162 -9.044 3.247 5.766 1.00 0.31 H new ATOM 0 HG23 VAL A 162 -10.737 3.179 5.222 1.00 0.31 H new ATOM 1181 N LYS A 163 -10.309 4.333 3.193 1.00 0.29 N ATOM 1182 CA LYS A 163 -11.364 5.263 2.708 1.00 0.34 C ATOM 1183 C LYS A 163 -11.146 5.582 1.222 1.00 0.36 C ATOM 1184 O LYS A 163 -11.981 5.297 0.387 1.00 0.39 O ATOM 1185 CB LYS A 163 -11.204 6.524 3.557 1.00 0.33 C ATOM 1186 CG LYS A 163 -12.281 7.541 3.178 1.00 0.39 C ATOM 1187 CD LYS A 163 -12.111 8.797 4.032 1.00 1.30 C ATOM 1188 CE LYS A 163 -12.675 8.538 5.431 1.00 1.51 C ATOM 1189 NZ LYS A 163 -12.006 9.540 6.306 1.00 2.30 N ATOM 0 H LYS A 163 -9.703 4.701 3.927 1.00 0.29 H new ATOM 0 HA LYS A 163 -12.363 4.837 2.798 1.00 0.34 H new ATOM 0 HB2 LYS A 163 -11.283 6.274 4.615 1.00 0.33 H new ATOM 0 HB3 LYS A 163 -10.214 6.954 3.404 1.00 0.33 H new ATOM 0 HG2 LYS A 163 -12.204 7.793 2.120 1.00 0.39 H new ATOM 0 HG3 LYS A 163 -13.272 7.114 3.332 1.00 0.39 H new ATOM 0 HD2 LYS A 163 -11.057 9.067 4.097 1.00 1.30 H new ATOM 0 HD3 LYS A 163 -12.627 9.638 3.569 1.00 1.30 H new ATOM 0 HE2 LYS A 163 -13.758 8.659 5.449 1.00 1.51 H new ATOM 0 HE3 LYS A 163 -12.462 7.521 5.761 1.00 1.51 H new ATOM 0 HZ1 LYS A 163 -12.341 9.426 7.284 1.00 2.30 H new ATOM 0 HZ2 LYS A 163 -10.976 9.396 6.274 1.00 2.30 H new ATOM 0 HZ3 LYS A 163 -12.232 10.499 5.972 1.00 2.30 H new ATOM 1203 N ALA A 164 -10.019 6.161 0.890 1.00 0.36 N ATOM 1204 CA ALA A 164 -9.737 6.513 -0.545 1.00 0.39 C ATOM 1205 C ALA A 164 -9.576 5.260 -1.410 1.00 0.39 C ATOM 1206 O ALA A 164 -10.034 5.186 -2.533 1.00 0.33 O ATOM 1207 CB ALA A 164 -8.421 7.293 -0.505 1.00 0.44 C ATOM 0 H ALA A 164 -9.279 6.407 1.547 1.00 0.36 H new ATOM 0 HA ALA A 164 -10.556 7.084 -0.982 1.00 0.39 H new ATOM 0 HB1 ALA A 164 -8.142 7.589 -1.516 1.00 0.44 H new ATOM 0 HB2 ALA A 164 -8.544 8.183 0.112 1.00 0.44 H new ATOM 0 HB3 ALA A 164 -7.638 6.664 -0.082 1.00 0.44 H new ATOM 1213 N LEU A 165 -8.877 4.307 -0.888 1.00 0.50 N ATOM 1214 CA LEU A 165 -8.581 3.042 -1.629 1.00 0.55 C ATOM 1215 C LEU A 165 -9.839 2.322 -2.161 1.00 0.45 C ATOM 1216 O LEU A 165 -9.977 2.107 -3.355 1.00 0.42 O ATOM 1217 CB LEU A 165 -7.878 2.202 -0.555 1.00 0.80 C ATOM 1218 CG LEU A 165 -7.660 0.777 -1.023 1.00 0.52 C ATOM 1219 CD1 LEU A 165 -6.264 0.309 -0.601 1.00 1.47 C ATOM 1220 CD2 LEU A 165 -8.731 -0.132 -0.397 1.00 1.24 C ATOM 0 H LEU A 165 -8.481 4.344 0.051 1.00 0.50 H new ATOM 0 HA LEU A 165 -7.994 3.220 -2.530 1.00 0.55 H new ATOM 0 HB2 LEU A 165 -6.919 2.656 -0.306 1.00 0.80 H new ATOM 0 HB3 LEU A 165 -8.476 2.200 0.357 1.00 0.80 H new ATOM 0 HG LEU A 165 -7.738 0.729 -2.109 1.00 0.52 H new ATOM 0 HD11 LEU A 165 -6.107 -0.716 -0.937 1.00 1.47 H new ATOM 0 HD12 LEU A 165 -5.512 0.958 -1.050 1.00 1.47 H new ATOM 0 HD13 LEU A 165 -6.179 0.352 0.485 1.00 1.47 H new ATOM 0 HD21 LEU A 165 -8.578 -1.158 -0.731 1.00 1.24 H new ATOM 0 HD22 LEU A 165 -8.655 -0.089 0.689 1.00 1.24 H new ATOM 0 HD23 LEU A 165 -9.720 0.206 -0.705 1.00 1.24 H new ATOM 1232 N ARG A 166 -10.729 1.919 -1.293 1.00 0.47 N ATOM 1233 CA ARG A 166 -11.941 1.177 -1.758 1.00 0.45 C ATOM 1234 C ARG A 166 -12.860 2.105 -2.550 1.00 0.41 C ATOM 1235 O ARG A 166 -13.581 1.672 -3.430 1.00 0.52 O ATOM 1236 CB ARG A 166 -12.620 0.633 -0.481 1.00 0.52 C ATOM 1237 CG ARG A 166 -13.348 1.747 0.288 1.00 1.19 C ATOM 1238 CD ARG A 166 -13.789 1.216 1.655 1.00 1.53 C ATOM 1239 NE ARG A 166 -14.796 2.198 2.146 1.00 2.29 N ATOM 1240 CZ ARG A 166 -14.427 3.190 2.909 1.00 2.88 C ATOM 1241 NH1 ARG A 166 -13.727 2.961 3.986 1.00 3.60 N ATOM 1242 NH2 ARG A 166 -14.762 4.411 2.595 1.00 3.25 N ATOM 0 H ARG A 166 -10.671 2.070 -0.286 1.00 0.47 H new ATOM 0 HA ARG A 166 -11.690 0.358 -2.432 1.00 0.45 H new ATOM 0 HB2 ARG A 166 -13.330 -0.149 -0.750 1.00 0.52 H new ATOM 0 HB3 ARG A 166 -11.870 0.174 0.164 1.00 0.52 H new ATOM 0 HG2 ARG A 166 -12.690 2.607 0.414 1.00 1.19 H new ATOM 0 HG3 ARG A 166 -14.214 2.089 -0.278 1.00 1.19 H new ATOM 0 HD2 ARG A 166 -14.220 0.218 1.570 1.00 1.53 H new ATOM 0 HD3 ARG A 166 -12.945 1.141 2.340 1.00 1.53 H new ATOM 0 HE ARG A 166 -15.777 2.095 1.885 1.00 2.29 H new ATOM 0 HH11 ARG A 166 -13.468 2.006 4.232 1.00 3.60 H new ATOM 0 HH12 ARG A 166 -13.439 3.737 4.582 1.00 3.60 H new ATOM 0 HH21 ARG A 166 -15.311 4.589 1.754 1.00 3.25 H new ATOM 0 HH22 ARG A 166 -14.474 5.188 3.190 1.00 3.25 H new ATOM 1256 N THR A 167 -12.829 3.377 -2.251 1.00 0.33 N ATOM 1257 CA THR A 167 -13.697 4.339 -3.003 1.00 0.36 C ATOM 1258 C THR A 167 -13.347 4.308 -4.487 1.00 0.35 C ATOM 1259 O THR A 167 -14.215 4.375 -5.339 1.00 0.41 O ATOM 1260 CB THR A 167 -13.400 5.715 -2.407 1.00 0.42 C ATOM 1261 OG1 THR A 167 -13.834 5.740 -1.058 1.00 0.44 O ATOM 1262 CG2 THR A 167 -14.131 6.813 -3.189 1.00 0.47 C ATOM 0 H THR A 167 -12.246 3.792 -1.524 1.00 0.33 H new ATOM 0 HA THR A 167 -14.754 4.088 -2.917 1.00 0.36 H new ATOM 0 HB THR A 167 -12.327 5.898 -2.464 1.00 0.42 H new ATOM 0 HG1 THR A 167 -13.097 6.034 -0.483 1.00 0.44 H new ATOM 0 HG21 THR A 167 -13.906 7.784 -2.749 1.00 0.47 H new ATOM 0 HG22 THR A 167 -13.801 6.801 -4.228 1.00 0.47 H new ATOM 0 HG23 THR A 167 -15.206 6.636 -3.147 1.00 0.47 H new ATOM 1270 N CYS A 168 -12.085 4.222 -4.796 1.00 0.32 N ATOM 1271 CA CYS A 168 -11.678 4.204 -6.223 1.00 0.36 C ATOM 1272 C CYS A 168 -12.016 2.854 -6.848 1.00 0.31 C ATOM 1273 O CYS A 168 -12.784 2.784 -7.788 1.00 0.34 O ATOM 1274 CB CYS A 168 -10.164 4.428 -6.215 1.00 0.40 C ATOM 1275 SG CYS A 168 -9.575 4.628 -7.915 1.00 1.38 S ATOM 0 H CYS A 168 -11.321 4.164 -4.123 1.00 0.32 H new ATOM 0 HA CYS A 168 -12.195 4.965 -6.807 1.00 0.36 H new ATOM 0 HB2 CYS A 168 -9.920 5.313 -5.628 1.00 0.40 H new ATOM 0 HB3 CYS A 168 -9.663 3.583 -5.742 1.00 0.40 H new ATOM 0 HG CYS A 168 -8.289 4.821 -7.909 1.00 1.38 H new ATOM 1281 N ARG A 169 -11.464 1.777 -6.327 1.00 0.30 N ATOM 1282 CA ARG A 169 -11.781 0.412 -6.920 1.00 0.31 C ATOM 1283 C ARG A 169 -11.108 -0.756 -6.168 1.00 0.26 C ATOM 1284 O ARG A 169 -11.122 -1.877 -6.642 1.00 0.34 O ATOM 1285 CB ARG A 169 -11.239 0.459 -8.363 1.00 0.44 C ATOM 1286 CG ARG A 169 -11.776 -0.732 -9.164 1.00 0.69 C ATOM 1287 CD ARG A 169 -11.442 -0.547 -10.647 1.00 0.84 C ATOM 1288 NE ARG A 169 -12.332 0.557 -11.103 1.00 1.56 N ATOM 1289 CZ ARG A 169 -13.584 0.310 -11.381 1.00 2.15 C ATOM 1290 NH1 ARG A 169 -13.890 -0.602 -12.263 1.00 2.73 N ATOM 1291 NH2 ARG A 169 -14.530 0.974 -10.774 1.00 2.74 N ATOM 0 H ARG A 169 -10.821 1.772 -5.535 1.00 0.30 H new ATOM 0 HA ARG A 169 -12.853 0.228 -6.857 1.00 0.31 H new ATOM 0 HB2 ARG A 169 -11.535 1.393 -8.841 1.00 0.44 H new ATOM 0 HB3 ARG A 169 -10.149 0.438 -8.352 1.00 0.44 H new ATOM 0 HG2 ARG A 169 -11.337 -1.659 -8.795 1.00 0.69 H new ATOM 0 HG3 ARG A 169 -12.855 -0.815 -9.032 1.00 0.69 H new ATOM 0 HD2 ARG A 169 -10.392 -0.292 -10.787 1.00 0.84 H new ATOM 0 HD3 ARG A 169 -11.626 -1.462 -11.211 1.00 0.84 H new ATOM 0 HE ARG A 169 -11.964 1.504 -11.198 1.00 1.56 H new ATOM 0 HH11 ARG A 169 -13.151 -1.123 -12.736 1.00 2.73 H new ATOM 0 HH12 ARG A 169 -14.868 -0.794 -12.479 1.00 2.73 H new ATOM 0 HH21 ARG A 169 -14.291 1.685 -10.083 1.00 2.74 H new ATOM 0 HH22 ARG A 169 -15.508 0.782 -10.991 1.00 2.74 H new ATOM 1305 N LEU A 170 -10.500 -0.520 -5.040 1.00 0.20 N ATOM 1306 CA LEU A 170 -9.805 -1.628 -4.316 1.00 0.17 C ATOM 1307 C LEU A 170 -10.715 -2.276 -3.261 1.00 0.19 C ATOM 1308 O LEU A 170 -10.382 -2.343 -2.092 1.00 0.23 O ATOM 1309 CB LEU A 170 -8.616 -0.931 -3.676 1.00 0.18 C ATOM 1310 CG LEU A 170 -7.696 -0.361 -4.769 1.00 0.21 C ATOM 1311 CD1 LEU A 170 -7.901 1.152 -4.883 1.00 0.26 C ATOM 1312 CD2 LEU A 170 -6.236 -0.640 -4.406 1.00 0.25 C ATOM 0 H LEU A 170 -10.452 0.392 -4.585 1.00 0.20 H new ATOM 0 HA LEU A 170 -9.516 -2.448 -4.973 1.00 0.17 H new ATOM 0 HB2 LEU A 170 -8.961 -0.129 -3.023 1.00 0.18 H new ATOM 0 HB3 LEU A 170 -8.063 -1.634 -3.053 1.00 0.18 H new ATOM 0 HG LEU A 170 -7.938 -0.835 -5.720 1.00 0.21 H new ATOM 0 HD11 LEU A 170 -7.247 1.550 -5.659 1.00 0.26 H new ATOM 0 HD12 LEU A 170 -8.939 1.360 -5.142 1.00 0.26 H new ATOM 0 HD13 LEU A 170 -7.663 1.624 -3.930 1.00 0.26 H new ATOM 0 HD21 LEU A 170 -5.585 -0.236 -5.181 1.00 0.25 H new ATOM 0 HD22 LEU A 170 -6.002 -0.167 -3.452 1.00 0.25 H new ATOM 0 HD23 LEU A 170 -6.080 -1.716 -4.326 1.00 0.25 H new ATOM 1324 N ASN A 171 -11.860 -2.750 -3.670 1.00 0.24 N ATOM 1325 CA ASN A 171 -12.808 -3.392 -2.709 1.00 0.30 C ATOM 1326 C ASN A 171 -12.158 -4.594 -2.012 1.00 0.24 C ATOM 1327 O ASN A 171 -12.445 -4.883 -0.865 1.00 0.25 O ATOM 1328 CB ASN A 171 -13.978 -3.862 -3.572 1.00 0.40 C ATOM 1329 CG ASN A 171 -15.265 -3.787 -2.760 1.00 0.50 C ATOM 1330 OD1 ASN A 171 -15.797 -4.793 -2.332 1.00 0.58 O ATOM 1331 ND2 ASN A 171 -15.791 -2.618 -2.536 1.00 0.59 N ATOM 0 H ASN A 171 -12.184 -2.721 -4.637 1.00 0.24 H new ATOM 0 HA ASN A 171 -13.113 -2.701 -1.923 1.00 0.30 H new ATOM 0 HB2 ASN A 171 -14.060 -3.240 -4.463 1.00 0.40 H new ATOM 0 HB3 ASN A 171 -13.807 -4.884 -3.911 1.00 0.40 H new ATOM 0 HD21 ASN A 171 -16.655 -2.542 -1.999 1.00 0.59 H new ATOM 0 HD22 ASN A 171 -15.340 -1.778 -2.898 1.00 0.59 H new ATOM 1338 N LEU A 172 -11.311 -5.315 -2.706 1.00 0.21 N ATOM 1339 CA LEU A 172 -10.669 -6.527 -2.093 1.00 0.21 C ATOM 1340 C LEU A 172 -9.953 -6.181 -0.790 1.00 0.17 C ATOM 1341 O LEU A 172 -10.295 -6.666 0.269 1.00 0.21 O ATOM 1342 CB LEU A 172 -9.619 -6.978 -3.110 1.00 0.23 C ATOM 1343 CG LEU A 172 -10.306 -7.507 -4.368 1.00 0.32 C ATOM 1344 CD1 LEU A 172 -9.259 -7.718 -5.462 1.00 1.13 C ATOM 1345 CD2 LEU A 172 -10.989 -8.841 -4.055 1.00 0.85 C ATOM 0 H LEU A 172 -11.035 -5.120 -3.668 1.00 0.21 H new ATOM 0 HA LEU A 172 -11.418 -7.286 -1.868 1.00 0.21 H new ATOM 0 HB2 LEU A 172 -8.966 -6.144 -3.366 1.00 0.23 H new ATOM 0 HB3 LEU A 172 -8.989 -7.754 -2.675 1.00 0.23 H new ATOM 0 HG LEU A 172 -11.052 -6.788 -4.707 1.00 0.32 H new ATOM 0 HD11 LEU A 172 -9.744 -8.096 -6.362 1.00 1.13 H new ATOM 0 HD12 LEU A 172 -8.769 -6.770 -5.684 1.00 1.13 H new ATOM 0 HD13 LEU A 172 -8.516 -8.439 -5.121 1.00 1.13 H new ATOM 0 HD21 LEU A 172 -11.479 -9.218 -4.953 1.00 0.85 H new ATOM 0 HD22 LEU A 172 -10.243 -9.561 -3.719 1.00 0.85 H new ATOM 0 HD23 LEU A 172 -11.732 -8.694 -3.271 1.00 0.85 H new ATOM 1357 N VAL A 173 -8.960 -5.345 -0.874 1.00 0.16 N ATOM 1358 CA VAL A 173 -8.184 -4.964 0.345 1.00 0.21 C ATOM 1359 C VAL A 173 -9.086 -4.297 1.376 1.00 0.22 C ATOM 1360 O VAL A 173 -8.868 -4.426 2.565 1.00 0.25 O ATOM 1361 CB VAL A 173 -7.095 -4.000 -0.131 1.00 0.29 C ATOM 1362 CG1 VAL A 173 -6.092 -4.757 -0.993 1.00 0.38 C ATOM 1363 CG2 VAL A 173 -7.701 -2.876 -0.965 1.00 0.34 C ATOM 0 H VAL A 173 -8.647 -4.904 -1.739 1.00 0.16 H new ATOM 0 HA VAL A 173 -7.753 -5.840 0.830 1.00 0.21 H new ATOM 0 HB VAL A 173 -6.603 -3.575 0.744 1.00 0.29 H new ATOM 0 HG11 VAL A 173 -5.315 -4.072 -1.333 1.00 0.38 H new ATOM 0 HG12 VAL A 173 -5.639 -5.557 -0.407 1.00 0.38 H new ATOM 0 HG13 VAL A 173 -6.603 -5.184 -1.856 1.00 0.38 H new ATOM 0 HG21 VAL A 173 -6.911 -2.201 -1.294 1.00 0.34 H new ATOM 0 HG22 VAL A 173 -8.203 -3.299 -1.835 1.00 0.34 H new ATOM 0 HG23 VAL A 173 -8.422 -2.324 -0.362 1.00 0.34 H new ATOM 1373 N ALA A 174 -10.106 -3.603 0.940 1.00 0.27 N ATOM 1374 CA ALA A 174 -11.037 -2.946 1.914 1.00 0.34 C ATOM 1375 C ALA A 174 -11.646 -4.021 2.823 1.00 0.29 C ATOM 1376 O ALA A 174 -11.735 -3.864 4.027 1.00 0.32 O ATOM 1377 CB ALA A 174 -12.118 -2.288 1.053 1.00 0.43 C ATOM 0 H ALA A 174 -10.336 -3.462 -0.044 1.00 0.27 H new ATOM 0 HA ALA A 174 -10.540 -2.215 2.552 1.00 0.34 H new ATOM 0 HB1 ALA A 174 -12.839 -1.785 1.697 1.00 0.43 H new ATOM 0 HB2 ALA A 174 -11.658 -1.560 0.385 1.00 0.43 H new ATOM 0 HB3 ALA A 174 -12.628 -3.050 0.463 1.00 0.43 H new ATOM 1383 N ASP A 175 -12.047 -5.123 2.245 1.00 0.24 N ATOM 1384 CA ASP A 175 -12.622 -6.237 3.055 1.00 0.23 C ATOM 1385 C ASP A 175 -11.584 -6.776 4.044 1.00 0.17 C ATOM 1386 O ASP A 175 -11.894 -7.041 5.190 1.00 0.20 O ATOM 1387 CB ASP A 175 -13.011 -7.314 2.041 1.00 0.27 C ATOM 1388 CG ASP A 175 -14.211 -6.837 1.220 1.00 0.37 C ATOM 1389 OD1 ASP A 175 -15.127 -6.287 1.809 1.00 0.99 O ATOM 1390 OD2 ASP A 175 -14.196 -7.035 0.016 1.00 0.80 O ATOM 0 H ASP A 175 -12.001 -5.300 1.242 1.00 0.24 H new ATOM 0 HA ASP A 175 -13.477 -5.910 3.647 1.00 0.23 H new ATOM 0 HB2 ASP A 175 -12.169 -7.529 1.383 1.00 0.27 H new ATOM 0 HB3 ASP A 175 -13.257 -8.242 2.557 1.00 0.27 H new ATOM 1395 N LEU A 176 -10.357 -6.957 3.607 1.00 0.14 N ATOM 1396 CA LEU A 176 -9.311 -7.502 4.532 1.00 0.20 C ATOM 1397 C LEU A 176 -9.080 -6.547 5.703 1.00 0.25 C ATOM 1398 O LEU A 176 -9.117 -6.948 6.852 1.00 0.27 O ATOM 1399 CB LEU A 176 -8.026 -7.633 3.696 1.00 0.28 C ATOM 1400 CG LEU A 176 -8.025 -8.926 2.850 1.00 0.49 C ATOM 1401 CD1 LEU A 176 -9.307 -9.050 2.026 1.00 1.33 C ATOM 1402 CD2 LEU A 176 -6.824 -8.897 1.898 1.00 1.09 C ATOM 0 H LEU A 176 -10.038 -6.753 2.660 1.00 0.14 H new ATOM 0 HA LEU A 176 -9.617 -8.461 4.951 1.00 0.20 H new ATOM 0 HB2 LEU A 176 -7.929 -6.768 3.039 1.00 0.28 H new ATOM 0 HB3 LEU A 176 -7.160 -7.630 4.357 1.00 0.28 H new ATOM 0 HG LEU A 176 -7.964 -9.780 3.525 1.00 0.49 H new ATOM 0 HD11 LEU A 176 -9.276 -9.970 1.442 1.00 1.33 H new ATOM 0 HD12 LEU A 176 -10.168 -9.073 2.694 1.00 1.33 H new ATOM 0 HD13 LEU A 176 -9.392 -8.196 1.354 1.00 1.33 H new ATOM 0 HD21 LEU A 176 -6.815 -9.806 1.296 1.00 1.09 H new ATOM 0 HD22 LEU A 176 -6.900 -8.029 1.243 1.00 1.09 H new ATOM 0 HD23 LEU A 176 -5.902 -8.835 2.477 1.00 1.09 H new ATOM 1414 N VAL A 177 -8.844 -5.287 5.426 1.00 0.33 N ATOM 1415 CA VAL A 177 -8.615 -4.314 6.535 1.00 0.41 C ATOM 1416 C VAL A 177 -9.889 -4.199 7.373 1.00 0.37 C ATOM 1417 O VAL A 177 -9.842 -4.169 8.587 1.00 0.39 O ATOM 1418 CB VAL A 177 -8.256 -2.979 5.864 1.00 0.52 C ATOM 1419 CG1 VAL A 177 -7.005 -3.161 5.002 1.00 0.58 C ATOM 1420 CG2 VAL A 177 -9.408 -2.494 4.979 1.00 0.52 C ATOM 0 H VAL A 177 -8.801 -4.894 4.486 1.00 0.33 H new ATOM 0 HA VAL A 177 -7.815 -4.625 7.206 1.00 0.41 H new ATOM 0 HB VAL A 177 -8.070 -2.238 6.642 1.00 0.52 H new ATOM 0 HG11 VAL A 177 -6.750 -2.214 4.526 1.00 0.58 H new ATOM 0 HG12 VAL A 177 -6.175 -3.487 5.629 1.00 0.58 H new ATOM 0 HG13 VAL A 177 -7.197 -3.912 4.236 1.00 0.58 H new ATOM 0 HG21 VAL A 177 -9.135 -1.547 4.513 1.00 0.52 H new ATOM 0 HG22 VAL A 177 -9.609 -3.235 4.205 1.00 0.52 H new ATOM 0 HG23 VAL A 177 -10.301 -2.354 5.588 1.00 0.52 H new ATOM 1430 N GLU A 178 -11.033 -4.168 6.731 1.00 0.36 N ATOM 1431 CA GLU A 178 -12.320 -4.092 7.490 1.00 0.39 C ATOM 1432 C GLU A 178 -12.448 -5.316 8.405 1.00 0.31 C ATOM 1433 O GLU A 178 -12.651 -5.198 9.599 1.00 0.34 O ATOM 1434 CB GLU A 178 -13.404 -4.100 6.404 1.00 0.45 C ATOM 1435 CG GLU A 178 -14.797 -4.241 7.026 1.00 0.51 C ATOM 1436 CD GLU A 178 -15.094 -3.047 7.941 1.00 1.32 C ATOM 1437 OE1 GLU A 178 -14.508 -1.997 7.730 1.00 1.85 O ATOM 1438 OE2 GLU A 178 -15.909 -3.204 8.836 1.00 1.85 O ATOM 0 H GLU A 178 -11.130 -4.192 5.716 1.00 0.36 H new ATOM 0 HA GLU A 178 -12.393 -3.211 8.128 1.00 0.39 H new ATOM 0 HB2 GLU A 178 -13.351 -3.178 5.825 1.00 0.45 H new ATOM 0 HB3 GLU A 178 -13.225 -4.923 5.712 1.00 0.45 H new ATOM 0 HG2 GLU A 178 -15.549 -4.301 6.240 1.00 0.51 H new ATOM 0 HG3 GLU A 178 -14.856 -5.168 7.596 1.00 0.51 H new ATOM 1445 N GLU A 179 -12.308 -6.487 7.841 1.00 0.25 N ATOM 1446 CA GLU A 179 -12.405 -7.736 8.653 1.00 0.24 C ATOM 1447 C GLU A 179 -11.324 -7.737 9.733 1.00 0.25 C ATOM 1448 O GLU A 179 -11.562 -8.123 10.863 1.00 0.39 O ATOM 1449 CB GLU A 179 -12.207 -8.877 7.651 1.00 0.31 C ATOM 1450 CG GLU A 179 -13.469 -9.022 6.796 1.00 1.03 C ATOM 1451 CD GLU A 179 -14.644 -9.452 7.680 1.00 1.32 C ATOM 1452 OE1 GLU A 179 -14.409 -10.171 8.637 1.00 1.76 O ATOM 1453 OE2 GLU A 179 -15.758 -9.051 7.386 1.00 1.92 O ATOM 0 H GLU A 179 -12.130 -6.633 6.847 1.00 0.25 H new ATOM 0 HA GLU A 179 -13.358 -7.832 9.173 1.00 0.24 H new ATOM 0 HB2 GLU A 179 -11.345 -8.674 7.016 1.00 0.31 H new ATOM 0 HB3 GLU A 179 -12.002 -9.809 8.179 1.00 0.31 H new ATOM 0 HG2 GLU A 179 -13.698 -8.076 6.305 1.00 1.03 H new ATOM 0 HG3 GLU A 179 -13.305 -9.758 6.009 1.00 1.03 H new ATOM 1460 N ALA A 180 -10.145 -7.288 9.395 1.00 0.26 N ATOM 1461 CA ALA A 180 -9.045 -7.236 10.401 1.00 0.38 C ATOM 1462 C ALA A 180 -9.417 -6.248 11.511 1.00 0.44 C ATOM 1463 O ALA A 180 -9.125 -6.465 12.672 1.00 0.60 O ATOM 1464 CB ALA A 180 -7.816 -6.745 9.633 1.00 0.50 C ATOM 0 H ALA A 180 -9.896 -6.954 8.464 1.00 0.26 H new ATOM 0 HA ALA A 180 -8.861 -8.203 10.870 1.00 0.38 H new ATOM 0 HB1 ALA A 180 -6.965 -6.682 10.311 1.00 0.50 H new ATOM 0 HB2 ALA A 180 -7.587 -7.443 8.828 1.00 0.50 H new ATOM 0 HB3 ALA A 180 -8.019 -5.760 9.213 1.00 0.50 H new