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 150:sc= 0 USER MOD Set 1.2: A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= -0.321 X(o=-0.32,f=-0.32) USER MOD Single : A 105 CYS SG : rot 180:sc= -3.43! USER MOD Single : A 107 ASN : amide:sc= -3.12! C(o=-3.1!,f=-4.3!) USER MOD Single : A 113 LYS NZ :NH3+ -145:sc= -0.0777 (180deg=-0.221) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 132 LYS NZ :NH3+ 161:sc= -0.982 (180deg=-1.97!) USER MOD Single : A 133 TYR OH : rot -80:sc= -0.46 USER MOD Single : A 136 SER OG : rot 150:sc= -0.475 USER MOD Single : A 138 SER OG : rot -160:sc= -0.0783 USER MOD Single : A 144 SER OG : rot 180:sc= -2.59! USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 LYS NZ :NH3+ 142:sc= 1.09 (180deg=0.241) USER MOD Single : A 150 ASN : amide:sc= -1.04 K(o=-1,f=-0.083) USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 LYS NZ :NH3+ -158:sc= -0.0362 (180deg=-0.629) USER MOD Single : A 155 ASN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 157 SER OG : rot -94:sc= 1.18 USER MOD Single : A 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 THR OG1 : rot 95:sc= 1.02 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 8.917 9.154 10.159 1.00 0.96 N ATOM 12 CA ALA A 90 7.896 8.386 9.384 1.00 0.72 C ATOM 13 C ALA A 90 6.694 8.128 10.293 1.00 0.58 C ATOM 14 O ALA A 90 6.704 8.555 11.432 1.00 1.23 O ATOM 15 CB ALA A 90 8.597 7.077 8.999 1.00 1.03 C ATOM 0 HA ALA A 90 7.532 8.908 8.499 1.00 0.72 H new ATOM 0 HB1 ALA A 90 7.912 6.453 8.425 1.00 1.03 H new ATOM 0 HB2 ALA A 90 9.477 7.299 8.396 1.00 1.03 H new ATOM 0 HB3 ALA A 90 8.900 6.547 9.902 1.00 1.03 H new ATOM 21 N PRO A 91 5.685 7.447 9.792 1.00 0.79 N ATOM 22 CA PRO A 91 4.495 7.175 10.631 1.00 1.10 C ATOM 23 C PRO A 91 4.902 6.367 11.872 1.00 0.60 C ATOM 24 O PRO A 91 5.279 5.218 11.757 1.00 0.91 O ATOM 25 CB PRO A 91 3.573 6.383 9.703 1.00 1.98 C ATOM 26 CG PRO A 91 4.488 5.805 8.681 1.00 2.18 C ATOM 27 CD PRO A 91 5.533 6.860 8.452 1.00 1.62 C ATOM 0 HA PRO A 91 4.009 8.073 11.012 1.00 1.10 H new ATOM 0 HB2 PRO A 91 3.038 5.603 10.245 1.00 1.98 H new ATOM 0 HB3 PRO A 91 2.821 7.026 9.246 1.00 1.98 H new ATOM 0 HG2 PRO A 91 4.936 4.876 9.033 1.00 2.18 H new ATOM 0 HG3 PRO A 91 3.954 5.572 7.760 1.00 2.18 H new ATOM 0 HD2 PRO A 91 6.467 6.434 8.086 1.00 1.62 H new ATOM 0 HD3 PRO A 91 5.211 7.599 7.718 1.00 1.62 H new ATOM 35 N PRO A 92 4.822 6.993 13.031 1.00 0.59 N ATOM 36 CA PRO A 92 5.202 6.298 14.285 1.00 0.84 C ATOM 37 C PRO A 92 4.314 5.066 14.485 1.00 0.71 C ATOM 38 O PRO A 92 4.750 4.059 15.011 1.00 0.83 O ATOM 39 CB PRO A 92 5.013 7.368 15.366 1.00 1.49 C ATOM 40 CG PRO A 92 4.052 8.339 14.767 1.00 1.64 C ATOM 41 CD PRO A 92 4.370 8.368 13.295 1.00 1.21 C ATOM 0 HA PRO A 92 6.222 5.913 14.295 1.00 0.84 H new ATOM 0 HB2 PRO A 92 4.620 6.937 16.287 1.00 1.49 H new ATOM 0 HB3 PRO A 92 5.958 7.849 15.618 1.00 1.49 H new ATOM 0 HG2 PRO A 92 3.022 8.028 14.939 1.00 1.64 H new ATOM 0 HG3 PRO A 92 4.165 9.328 15.212 1.00 1.64 H new ATOM 0 HD2 PRO A 92 3.496 8.628 12.698 1.00 1.21 H new ATOM 0 HD3 PRO A 92 5.144 9.100 13.063 1.00 1.21 H new ATOM 49 N GLY A 93 3.082 5.125 14.035 1.00 0.65 N ATOM 50 CA GLY A 93 2.176 3.940 14.161 1.00 0.71 C ATOM 51 C GLY A 93 2.269 3.042 12.915 1.00 0.58 C ATOM 52 O GLY A 93 1.315 2.378 12.556 1.00 0.58 O ATOM 0 H GLY A 93 2.666 5.942 13.587 1.00 0.65 H new ATOM 0 HA2 GLY A 93 2.443 3.366 15.048 1.00 0.71 H new ATOM 0 HA3 GLY A 93 1.148 4.276 14.296 1.00 0.71 H new ATOM 56 N GLU A 94 3.397 3.025 12.250 1.00 0.56 N ATOM 57 CA GLU A 94 3.542 2.182 11.019 1.00 0.55 C ATOM 58 C GLU A 94 3.309 0.708 11.343 1.00 0.49 C ATOM 59 O GLU A 94 2.958 -0.065 10.476 1.00 0.53 O ATOM 60 CB GLU A 94 4.983 2.396 10.548 1.00 0.66 C ATOM 61 CG GLU A 94 5.214 1.634 9.238 1.00 1.09 C ATOM 62 CD GLU A 94 6.656 1.837 8.749 1.00 1.10 C ATOM 63 OE1 GLU A 94 7.351 2.672 9.309 1.00 1.62 O ATOM 64 OE2 GLU A 94 7.037 1.159 7.808 1.00 1.44 O ATOM 0 H GLU A 94 4.227 3.560 12.506 1.00 0.56 H new ATOM 0 HA GLU A 94 2.815 2.459 10.256 1.00 0.55 H new ATOM 0 HB2 GLU A 94 5.174 3.459 10.401 1.00 0.66 H new ATOM 0 HB3 GLU A 94 5.681 2.049 11.310 1.00 0.66 H new ATOM 0 HG2 GLU A 94 5.020 0.572 9.388 1.00 1.09 H new ATOM 0 HG3 GLU A 94 4.513 1.982 8.479 1.00 1.09 H new ATOM 71 N ALA A 95 3.509 0.308 12.574 1.00 0.49 N ATOM 72 CA ALA A 95 3.303 -1.131 12.931 1.00 0.50 C ATOM 73 C ALA A 95 1.866 -1.556 12.615 1.00 0.38 C ATOM 74 O ALA A 95 1.632 -2.611 12.047 1.00 0.36 O ATOM 75 CB ALA A 95 3.572 -1.220 14.432 1.00 0.61 C ATOM 0 H ALA A 95 3.804 0.910 13.343 1.00 0.49 H new ATOM 0 HA ALA A 95 3.961 -1.790 12.364 1.00 0.50 H new ATOM 0 HB1 ALA A 95 3.439 -2.249 14.765 1.00 0.61 H new ATOM 0 HB2 ALA A 95 4.594 -0.901 14.638 1.00 0.61 H new ATOM 0 HB3 ALA A 95 2.875 -0.574 14.965 1.00 0.61 H new ATOM 81 N TYR A 96 0.902 -0.740 12.946 1.00 0.38 N ATOM 82 CA TYR A 96 -0.501 -1.106 12.613 1.00 0.35 C ATOM 83 C TYR A 96 -0.675 -1.042 11.095 1.00 0.28 C ATOM 84 O TYR A 96 -1.257 -1.916 10.478 1.00 0.29 O ATOM 85 CB TYR A 96 -1.386 -0.076 13.309 1.00 0.42 C ATOM 86 CG TYR A 96 -2.820 -0.530 13.213 1.00 0.73 C ATOM 87 CD1 TYR A 96 -3.516 -0.379 12.011 1.00 1.47 C ATOM 88 CD2 TYR A 96 -3.452 -1.107 14.322 1.00 1.54 C ATOM 89 CE1 TYR A 96 -4.844 -0.804 11.913 1.00 1.85 C ATOM 90 CE2 TYR A 96 -4.782 -1.532 14.225 1.00 1.93 C ATOM 91 CZ TYR A 96 -5.478 -1.381 13.020 1.00 1.77 C ATOM 92 OH TYR A 96 -6.789 -1.802 12.922 1.00 2.32 O ATOM 0 H TYR A 96 1.024 0.152 13.426 1.00 0.38 H new ATOM 0 HA TYR A 96 -0.762 -2.113 12.940 1.00 0.35 H new ATOM 0 HB2 TYR A 96 -1.092 0.031 14.353 1.00 0.42 H new ATOM 0 HB3 TYR A 96 -1.267 0.902 12.843 1.00 0.42 H new ATOM 0 HD1 TYR A 96 -3.028 0.066 11.157 1.00 1.47 H new ATOM 0 HD2 TYR A 96 -2.914 -1.224 15.251 1.00 1.54 H new ATOM 0 HE1 TYR A 96 -5.381 -0.687 10.983 1.00 1.85 H new ATOM 0 HE2 TYR A 96 -5.271 -1.976 15.079 1.00 1.93 H new ATOM 0 HH TYR A 96 -7.076 -2.180 13.779 1.00 2.32 H new ATOM 102 N LEU A 97 -0.171 0.009 10.499 1.00 0.42 N ATOM 103 CA LEU A 97 -0.292 0.178 9.023 1.00 0.55 C ATOM 104 C LEU A 97 0.408 -0.965 8.278 1.00 0.43 C ATOM 105 O LEU A 97 -0.110 -1.466 7.295 1.00 0.35 O ATOM 106 CB LEU A 97 0.377 1.520 8.703 1.00 0.90 C ATOM 107 CG LEU A 97 0.256 1.799 7.203 1.00 0.94 C ATOM 108 CD1 LEU A 97 -1.217 2.017 6.844 1.00 1.33 C ATOM 109 CD2 LEU A 97 1.063 3.051 6.843 1.00 1.75 C ATOM 0 H LEU A 97 0.323 0.762 10.978 1.00 0.42 H new ATOM 0 HA LEU A 97 -1.335 0.160 8.706 1.00 0.55 H new ATOM 0 HB2 LEU A 97 -0.095 2.320 9.273 1.00 0.90 H new ATOM 0 HB3 LEU A 97 1.426 1.496 8.997 1.00 0.90 H new ATOM 0 HG LEU A 97 0.646 0.948 6.644 1.00 0.94 H new ATOM 0 HD11 LEU A 97 -1.306 2.216 5.776 1.00 1.33 H new ATOM 0 HD12 LEU A 97 -1.789 1.124 7.095 1.00 1.33 H new ATOM 0 HD13 LEU A 97 -1.606 2.867 7.405 1.00 1.33 H new ATOM 0 HD21 LEU A 97 0.974 3.246 5.774 1.00 1.75 H new ATOM 0 HD22 LEU A 97 0.678 3.905 7.401 1.00 1.75 H new ATOM 0 HD23 LEU A 97 2.111 2.894 7.097 1.00 1.75 H new ATOM 121 N GLN A 98 1.580 -1.380 8.717 1.00 0.47 N ATOM 122 CA GLN A 98 2.278 -2.484 7.989 1.00 0.49 C ATOM 123 C GLN A 98 1.451 -3.771 8.094 1.00 0.38 C ATOM 124 O GLN A 98 1.425 -4.567 7.173 1.00 0.39 O ATOM 125 CB GLN A 98 3.671 -2.630 8.621 1.00 0.63 C ATOM 126 CG GLN A 98 3.562 -3.088 10.070 1.00 0.57 C ATOM 127 CD GLN A 98 4.937 -3.532 10.570 1.00 1.24 C ATOM 128 OE1 GLN A 98 5.108 -4.657 10.996 1.00 2.00 O ATOM 129 NE2 GLN A 98 5.931 -2.689 10.532 1.00 2.04 N ATOM 0 H GLN A 98 2.070 -1.008 9.531 1.00 0.47 H new ATOM 0 HA GLN A 98 2.387 -2.268 6.926 1.00 0.49 H new ATOM 0 HB2 GLN A 98 4.260 -3.348 8.051 1.00 0.63 H new ATOM 0 HB3 GLN A 98 4.198 -1.677 8.575 1.00 0.63 H new ATOM 0 HG2 GLN A 98 3.182 -2.277 10.691 1.00 0.57 H new ATOM 0 HG3 GLN A 98 2.851 -3.911 10.150 1.00 0.57 H new ATOM 0 HE21 GLN A 98 5.786 -1.745 10.174 1.00 2.04 H new ATOM 0 HE22 GLN A 98 6.854 -2.974 10.860 1.00 2.04 H new ATOM 138 N VAL A 99 0.736 -3.966 9.187 1.00 0.33 N ATOM 139 CA VAL A 99 -0.124 -5.190 9.301 1.00 0.31 C ATOM 140 C VAL A 99 -1.161 -5.162 8.174 1.00 0.24 C ATOM 141 O VAL A 99 -1.323 -6.124 7.447 1.00 0.30 O ATOM 142 CB VAL A 99 -0.785 -5.111 10.690 1.00 0.32 C ATOM 143 CG1 VAL A 99 -1.930 -6.128 10.807 1.00 0.43 C ATOM 144 CG2 VAL A 99 0.262 -5.452 11.744 1.00 0.43 C ATOM 0 H VAL A 99 0.713 -3.339 9.991 1.00 0.33 H new ATOM 0 HA VAL A 99 0.436 -6.120 9.206 1.00 0.31 H new ATOM 0 HB VAL A 99 -1.182 -4.106 10.834 1.00 0.32 H new ATOM 0 HG11 VAL A 99 -2.382 -6.055 11.796 1.00 0.43 H new ATOM 0 HG12 VAL A 99 -2.683 -5.917 10.047 1.00 0.43 H new ATOM 0 HG13 VAL A 99 -1.539 -7.135 10.661 1.00 0.43 H new ATOM 0 HG21 VAL A 99 -0.189 -5.401 12.735 1.00 0.43 H new ATOM 0 HG22 VAL A 99 0.640 -6.459 11.569 1.00 0.43 H new ATOM 0 HG23 VAL A 99 1.085 -4.740 11.683 1.00 0.43 H new ATOM 154 N ALA A 100 -1.841 -4.053 8.011 1.00 0.18 N ATOM 155 CA ALA A 100 -2.840 -3.955 6.909 1.00 0.18 C ATOM 156 C ALA A 100 -2.107 -4.061 5.574 1.00 0.14 C ATOM 157 O ALA A 100 -2.485 -4.827 4.718 1.00 0.14 O ATOM 158 CB ALA A 100 -3.500 -2.584 7.066 1.00 0.24 C ATOM 0 H ALA A 100 -1.747 -3.219 8.590 1.00 0.18 H new ATOM 0 HA ALA A 100 -3.588 -4.747 6.943 1.00 0.18 H new ATOM 0 HB1 ALA A 100 -4.247 -2.448 6.284 1.00 0.24 H new ATOM 0 HB2 ALA A 100 -3.981 -2.521 8.042 1.00 0.24 H new ATOM 0 HB3 ALA A 100 -2.743 -1.804 6.984 1.00 0.24 H new ATOM 164 N PHE A 101 -1.034 -3.319 5.418 1.00 0.15 N ATOM 165 CA PHE A 101 -0.229 -3.387 4.155 1.00 0.16 C ATOM 166 C PHE A 101 0.259 -4.812 3.907 1.00 0.17 C ATOM 167 O PHE A 101 0.630 -5.141 2.815 1.00 0.20 O ATOM 168 CB PHE A 101 0.992 -2.481 4.385 1.00 0.19 C ATOM 169 CG PHE A 101 0.665 -0.988 4.314 1.00 0.25 C ATOM 170 CD1 PHE A 101 -0.652 -0.510 4.160 1.00 1.10 C ATOM 171 CD2 PHE A 101 1.721 -0.069 4.410 1.00 1.21 C ATOM 172 CE1 PHE A 101 -0.895 0.868 4.108 1.00 1.10 C ATOM 173 CE2 PHE A 101 1.472 1.306 4.355 1.00 1.26 C ATOM 174 CZ PHE A 101 0.167 1.773 4.207 1.00 0.43 C ATOM 0 H PHE A 101 -0.680 -2.665 6.116 1.00 0.15 H new ATOM 0 HA PHE A 101 -0.826 -3.078 3.297 1.00 0.16 H new ATOM 0 HB2 PHE A 101 1.422 -2.705 5.361 1.00 0.19 H new ATOM 0 HB3 PHE A 101 1.753 -2.714 3.640 1.00 0.19 H new ATOM 0 HD1 PHE A 101 -1.474 -1.207 4.082 1.00 1.10 H new ATOM 0 HD2 PHE A 101 2.733 -0.426 4.527 1.00 1.21 H new ATOM 0 HE1 PHE A 101 -1.905 1.233 3.991 1.00 1.10 H new ATOM 0 HE2 PHE A 101 2.291 2.006 4.427 1.00 1.26 H new ATOM 0 HZ PHE A 101 -0.024 2.835 4.169 1.00 0.43 H new ATOM 184 N ASP A 102 0.286 -5.650 4.909 1.00 0.18 N ATOM 185 CA ASP A 102 0.785 -7.045 4.701 1.00 0.21 C ATOM 186 C ASP A 102 -0.310 -7.946 4.143 1.00 0.20 C ATOM 187 O ASP A 102 -0.134 -8.593 3.128 1.00 0.22 O ATOM 188 CB ASP A 102 1.193 -7.520 6.088 1.00 0.25 C ATOM 189 CG ASP A 102 1.958 -8.844 5.986 1.00 0.32 C ATOM 190 OD1 ASP A 102 1.734 -9.571 5.031 1.00 1.13 O ATOM 191 OD2 ASP A 102 2.754 -9.112 6.871 1.00 1.01 O ATOM 0 H ASP A 102 -0.014 -5.432 5.859 1.00 0.18 H new ATOM 0 HA ASP A 102 1.606 -7.075 3.985 1.00 0.21 H new ATOM 0 HB2 ASP A 102 1.816 -6.767 6.570 1.00 0.25 H new ATOM 0 HB3 ASP A 102 0.308 -7.649 6.712 1.00 0.25 H new ATOM 196 N ILE A 103 -1.440 -7.996 4.802 1.00 0.18 N ATOM 197 CA ILE A 103 -2.551 -8.865 4.311 1.00 0.18 C ATOM 198 C ILE A 103 -2.999 -8.370 2.948 1.00 0.17 C ATOM 199 O ILE A 103 -3.206 -9.139 2.030 1.00 0.18 O ATOM 200 CB ILE A 103 -3.674 -8.711 5.346 1.00 0.18 C ATOM 201 CG1 ILE A 103 -3.174 -9.224 6.687 1.00 0.94 C ATOM 202 CG2 ILE A 103 -4.890 -9.539 4.940 1.00 0.94 C ATOM 203 CD1 ILE A 103 -3.988 -8.597 7.820 1.00 0.87 C ATOM 0 H ILE A 103 -1.640 -7.475 5.655 1.00 0.18 H new ATOM 0 HA ILE A 103 -2.258 -9.909 4.202 1.00 0.18 H new ATOM 0 HB ILE A 103 -3.957 -7.660 5.408 1.00 0.18 H new ATOM 0 HG12 ILE A 103 -3.258 -10.310 6.725 1.00 0.94 H new ATOM 0 HG13 ILE A 103 -2.118 -8.981 6.808 1.00 0.94 H new ATOM 0 HG21 ILE A 103 -5.677 -9.419 5.684 1.00 0.94 H new ATOM 0 HG22 ILE A 103 -5.253 -9.200 3.970 1.00 0.94 H new ATOM 0 HG23 ILE A 103 -4.609 -10.590 4.875 1.00 0.94 H new ATOM 0 HD11 ILE A 103 -3.625 -8.969 8.778 1.00 0.87 H new ATOM 0 HD12 ILE A 103 -3.882 -7.513 7.788 1.00 0.87 H new ATOM 0 HD13 ILE A 103 -5.039 -8.862 7.703 1.00 0.87 H new ATOM 215 N VAL A 104 -3.139 -7.081 2.820 1.00 0.16 N ATOM 216 CA VAL A 104 -3.577 -6.507 1.519 1.00 0.16 C ATOM 217 C VAL A 104 -2.507 -6.744 0.443 1.00 0.17 C ATOM 218 O VAL A 104 -2.814 -7.057 -0.692 1.00 0.18 O ATOM 219 CB VAL A 104 -3.804 -5.009 1.780 1.00 0.16 C ATOM 220 CG1 VAL A 104 -4.754 -4.800 2.972 1.00 0.18 C ATOM 221 CG2 VAL A 104 -2.473 -4.305 2.047 1.00 0.14 C ATOM 0 H VAL A 104 -2.969 -6.400 3.560 1.00 0.16 H new ATOM 0 HA VAL A 104 -4.488 -6.976 1.148 1.00 0.16 H new ATOM 0 HB VAL A 104 -4.261 -4.577 0.890 1.00 0.16 H new ATOM 0 HG11 VAL A 104 -4.900 -3.733 3.138 1.00 0.18 H new ATOM 0 HG12 VAL A 104 -5.715 -5.269 2.758 1.00 0.18 H new ATOM 0 HG13 VAL A 104 -4.321 -5.250 3.865 1.00 0.18 H new ATOM 0 HG21 VAL A 104 -2.652 -3.245 2.230 1.00 0.14 H new ATOM 0 HG22 VAL A 104 -1.996 -4.748 2.921 1.00 0.14 H new ATOM 0 HG23 VAL A 104 -1.821 -4.419 1.181 1.00 0.14 H new ATOM 231 N CYS A 105 -1.253 -6.600 0.800 1.00 0.18 N ATOM 232 CA CYS A 105 -0.155 -6.821 -0.197 1.00 0.19 C ATOM 233 C CYS A 105 -0.195 -8.250 -0.700 1.00 0.20 C ATOM 234 O CYS A 105 -0.204 -8.494 -1.888 1.00 0.21 O ATOM 235 CB CYS A 105 1.138 -6.528 0.569 1.00 0.22 C ATOM 236 SG CYS A 105 2.591 -6.881 -0.455 1.00 0.29 S ATOM 0 H CYS A 105 -0.942 -6.340 1.736 1.00 0.18 H new ATOM 0 HA CYS A 105 -0.246 -6.183 -1.076 1.00 0.19 H new ATOM 0 HB2 CYS A 105 1.152 -5.483 0.880 1.00 0.22 H new ATOM 0 HB3 CYS A 105 1.172 -7.131 1.476 1.00 0.22 H new ATOM 0 HG CYS A 105 3.671 -6.621 0.220 1.00 0.29 H new ATOM 242 N ASP A 106 -0.250 -9.192 0.191 1.00 0.21 N ATOM 243 CA ASP A 106 -0.321 -10.610 -0.255 1.00 0.24 C ATOM 244 C ASP A 106 -1.657 -10.843 -0.982 1.00 0.25 C ATOM 245 O ASP A 106 -1.832 -11.834 -1.666 1.00 0.28 O ATOM 246 CB ASP A 106 -0.226 -11.446 1.015 1.00 0.25 C ATOM 247 CG ASP A 106 1.152 -11.252 1.654 1.00 0.27 C ATOM 248 OD1 ASP A 106 2.106 -11.061 0.916 1.00 1.05 O ATOM 249 OD2 ASP A 106 1.231 -11.303 2.870 1.00 1.05 O ATOM 0 H ASP A 106 -0.249 -9.047 1.201 1.00 0.21 H new ATOM 0 HA ASP A 106 0.476 -10.876 -0.950 1.00 0.24 H new ATOM 0 HB2 ASP A 106 -1.008 -11.152 1.715 1.00 0.25 H new ATOM 0 HB3 ASP A 106 -0.386 -12.499 0.782 1.00 0.25 H new ATOM 254 N ASN A 107 -2.596 -9.925 -0.850 1.00 0.24 N ATOM 255 CA ASN A 107 -3.909 -10.080 -1.542 1.00 0.26 C ATOM 256 C ASN A 107 -3.832 -9.474 -2.947 1.00 0.26 C ATOM 257 O ASN A 107 -4.340 -10.033 -3.902 1.00 0.29 O ATOM 258 CB ASN A 107 -4.881 -9.252 -0.701 1.00 0.25 C ATOM 259 CG ASN A 107 -6.280 -9.863 -0.778 1.00 0.29 C ATOM 260 OD1 ASN A 107 -7.168 -9.301 -1.388 1.00 1.02 O ATOM 261 ND2 ASN A 107 -6.517 -10.996 -0.176 1.00 1.23 N ATOM 0 H ASN A 107 -2.502 -9.077 -0.291 1.00 0.24 H new ATOM 0 HA ASN A 107 -4.204 -11.125 -1.639 1.00 0.26 H new ATOM 0 HB2 ASN A 107 -4.544 -9.220 0.335 1.00 0.25 H new ATOM 0 HB3 ASN A 107 -4.903 -8.223 -1.061 1.00 0.25 H new ATOM 0 HD21 ASN A 107 -7.448 -11.410 -0.217 1.00 1.23 H new ATOM 0 HD22 ASN A 107 -5.771 -11.467 0.336 1.00 1.23 H new ATOM 268 N VAL A 108 -3.208 -8.329 -3.073 1.00 0.23 N ATOM 269 CA VAL A 108 -3.105 -7.673 -4.410 1.00 0.24 C ATOM 270 C VAL A 108 -2.016 -6.593 -4.391 1.00 0.25 C ATOM 271 O VAL A 108 -2.189 -5.509 -4.905 1.00 0.42 O ATOM 272 CB VAL A 108 -4.503 -7.091 -4.639 1.00 0.23 C ATOM 273 CG1 VAL A 108 -4.768 -5.894 -3.719 1.00 0.27 C ATOM 274 CG2 VAL A 108 -4.645 -6.666 -6.101 1.00 0.27 C ATOM 0 H VAL A 108 -2.766 -7.821 -2.307 1.00 0.23 H new ATOM 0 HA VAL A 108 -2.818 -8.354 -5.211 1.00 0.24 H new ATOM 0 HB VAL A 108 -5.237 -7.862 -4.405 1.00 0.23 H new ATOM 0 HG11 VAL A 108 -5.769 -5.505 -3.907 1.00 0.27 H new ATOM 0 HG12 VAL A 108 -4.692 -6.211 -2.679 1.00 0.27 H new ATOM 0 HG13 VAL A 108 -4.032 -5.114 -3.916 1.00 0.27 H new ATOM 0 HG21 VAL A 108 -5.640 -6.252 -6.264 1.00 0.27 H new ATOM 0 HG22 VAL A 108 -3.895 -5.911 -6.335 1.00 0.27 H new ATOM 0 HG23 VAL A 108 -4.502 -7.532 -6.747 1.00 0.27 H new ATOM 284 N GLY A 109 -0.921 -6.892 -3.746 1.00 0.24 N ATOM 285 CA GLY A 109 0.220 -5.931 -3.584 1.00 0.22 C ATOM 286 C GLY A 109 0.442 -5.058 -4.840 1.00 0.23 C ATOM 287 O GLY A 109 0.686 -3.870 -4.738 1.00 0.21 O ATOM 0 H GLY A 109 -0.761 -7.798 -3.306 1.00 0.24 H new ATOM 0 HA2 GLY A 109 0.028 -5.286 -2.726 1.00 0.22 H new ATOM 0 HA3 GLY A 109 1.132 -6.488 -3.367 1.00 0.22 H new ATOM 291 N ARG A 110 0.375 -5.639 -6.012 1.00 0.27 N ATOM 292 CA ARG A 110 0.607 -4.847 -7.268 1.00 0.28 C ATOM 293 C ARG A 110 -0.359 -3.656 -7.370 1.00 0.27 C ATOM 294 O ARG A 110 -0.111 -2.695 -8.098 1.00 0.27 O ATOM 295 CB ARG A 110 0.384 -5.836 -8.417 1.00 0.36 C ATOM 296 CG ARG A 110 1.737 -6.371 -8.910 1.00 0.55 C ATOM 297 CD ARG A 110 1.980 -7.777 -8.343 1.00 0.72 C ATOM 298 NE ARG A 110 1.664 -8.703 -9.467 1.00 1.08 N ATOM 299 CZ ARG A 110 0.464 -9.203 -9.586 1.00 1.39 C ATOM 300 NH1 ARG A 110 0.138 -10.282 -8.927 1.00 1.68 N ATOM 301 NH2 ARG A 110 -0.410 -8.626 -10.365 1.00 2.06 N ATOM 0 H ARG A 110 0.170 -6.628 -6.157 1.00 0.27 H new ATOM 0 HA ARG A 110 1.609 -4.418 -7.289 1.00 0.28 H new ATOM 0 HB2 ARG A 110 -0.244 -6.661 -8.082 1.00 0.36 H new ATOM 0 HB3 ARG A 110 -0.144 -5.345 -9.235 1.00 0.36 H new ATOM 0 HG2 ARG A 110 1.751 -6.401 -9.999 1.00 0.55 H new ATOM 0 HG3 ARG A 110 2.538 -5.700 -8.599 1.00 0.55 H new ATOM 0 HD2 ARG A 110 3.011 -7.896 -8.011 1.00 0.72 H new ATOM 0 HD3 ARG A 110 1.343 -7.971 -7.480 1.00 0.72 H new ATOM 0 HE ARG A 110 2.387 -8.947 -10.145 1.00 1.08 H new ATOM 0 HH11 ARG A 110 0.821 -10.734 -8.319 1.00 1.68 H new ATOM 0 HH12 ARG A 110 -0.800 -10.673 -9.020 1.00 1.68 H new ATOM 0 HH21 ARG A 110 -0.156 -7.784 -10.881 1.00 2.06 H new ATOM 0 HH22 ARG A 110 -1.347 -9.017 -10.458 1.00 2.06 H new ATOM 315 N ASP A 111 -1.443 -3.687 -6.639 1.00 0.27 N ATOM 316 CA ASP A 111 -2.394 -2.543 -6.699 1.00 0.30 C ATOM 317 C ASP A 111 -1.734 -1.315 -6.068 1.00 0.31 C ATOM 318 O ASP A 111 -2.110 -0.193 -6.345 1.00 0.39 O ATOM 319 CB ASP A 111 -3.617 -2.980 -5.886 1.00 0.30 C ATOM 320 CG ASP A 111 -4.603 -3.746 -6.776 1.00 0.30 C ATOM 321 OD1 ASP A 111 -4.203 -4.191 -7.842 1.00 0.82 O ATOM 322 OD2 ASP A 111 -5.750 -3.870 -6.377 1.00 0.93 O ATOM 0 H ASP A 111 -1.707 -4.446 -6.011 1.00 0.27 H new ATOM 0 HA ASP A 111 -2.676 -2.282 -7.719 1.00 0.30 H new ATOM 0 HB2 ASP A 111 -3.303 -3.610 -5.054 1.00 0.30 H new ATOM 0 HB3 ASP A 111 -4.108 -2.106 -5.457 1.00 0.30 H new ATOM 327 N TRP A 112 -0.734 -1.515 -5.240 1.00 0.27 N ATOM 328 CA TRP A 112 -0.031 -0.352 -4.624 1.00 0.29 C ATOM 329 C TRP A 112 0.808 0.327 -5.692 1.00 0.32 C ATOM 330 O TRP A 112 0.953 1.526 -5.689 1.00 0.31 O ATOM 331 CB TRP A 112 0.834 -0.908 -3.490 1.00 0.29 C ATOM 332 CG TRP A 112 -0.019 -1.747 -2.596 1.00 0.25 C ATOM 333 CD1 TRP A 112 0.348 -2.941 -2.092 1.00 0.23 C ATOM 334 CD2 TRP A 112 -1.383 -1.502 -2.128 1.00 0.25 C ATOM 335 NE1 TRP A 112 -0.694 -3.444 -1.339 1.00 0.20 N ATOM 336 CE2 TRP A 112 -1.779 -2.597 -1.334 1.00 0.20 C ATOM 337 CE3 TRP A 112 -2.308 -0.450 -2.306 1.00 0.31 C ATOM 338 CZ2 TRP A 112 -3.034 -2.656 -0.746 1.00 0.20 C ATOM 339 CZ3 TRP A 112 -3.579 -0.512 -1.709 1.00 0.32 C ATOM 340 CH2 TRP A 112 -3.939 -1.618 -0.931 1.00 0.27 C ATOM 0 H TRP A 112 -0.378 -2.431 -4.967 1.00 0.27 H new ATOM 0 HA TRP A 112 -0.721 0.390 -4.223 1.00 0.29 H new ATOM 0 HB2 TRP A 112 1.652 -1.503 -3.897 1.00 0.29 H new ATOM 0 HB3 TRP A 112 1.284 -0.092 -2.924 1.00 0.29 H new ATOM 0 HD1 TRP A 112 1.300 -3.425 -2.251 1.00 0.23 H new ATOM 0 HE1 TRP A 112 -0.664 -4.336 -0.846 1.00 0.20 H new ATOM 0 HE3 TRP A 112 -2.037 0.407 -2.904 1.00 0.31 H new ATOM 0 HZ2 TRP A 112 -3.308 -3.510 -0.144 1.00 0.20 H new ATOM 0 HZ3 TRP A 112 -4.280 0.297 -1.851 1.00 0.32 H new ATOM 0 HH2 TRP A 112 -4.917 -1.665 -0.476 1.00 0.27 H new ATOM 351 N LYS A 113 1.330 -0.424 -6.640 1.00 0.37 N ATOM 352 CA LYS A 113 2.115 0.218 -7.741 1.00 0.40 C ATOM 353 C LYS A 113 1.190 1.191 -8.470 1.00 0.34 C ATOM 354 O LYS A 113 1.565 2.299 -8.801 1.00 0.30 O ATOM 355 CB LYS A 113 2.555 -0.919 -8.664 1.00 0.50 C ATOM 356 CG LYS A 113 3.860 -1.525 -8.144 1.00 0.72 C ATOM 357 CD LYS A 113 5.048 -0.748 -8.726 1.00 0.89 C ATOM 358 CE LYS A 113 5.451 -1.349 -10.080 1.00 1.51 C ATOM 359 NZ LYS A 113 5.089 -0.315 -11.094 1.00 1.66 N ATOM 0 H LYS A 113 1.246 -1.439 -6.696 1.00 0.37 H new ATOM 0 HA LYS A 113 2.984 0.771 -7.385 1.00 0.40 H new ATOM 0 HB2 LYS A 113 1.780 -1.684 -8.711 1.00 0.50 H new ATOM 0 HB3 LYS A 113 2.695 -0.545 -9.678 1.00 0.50 H new ATOM 0 HG2 LYS A 113 3.884 -1.486 -7.055 1.00 0.72 H new ATOM 0 HG3 LYS A 113 3.924 -2.576 -8.427 1.00 0.72 H new ATOM 0 HD2 LYS A 113 4.782 0.302 -8.849 1.00 0.89 H new ATOM 0 HD3 LYS A 113 5.891 -0.785 -8.036 1.00 0.89 H new ATOM 0 HE2 LYS A 113 6.518 -1.572 -10.109 1.00 1.51 H new ATOM 0 HE3 LYS A 113 4.924 -2.285 -10.267 1.00 1.51 H new ATOM 0 HZ1 LYS A 113 4.765 -0.782 -11.965 1.00 1.66 H new ATOM 0 HZ2 LYS A 113 4.327 0.286 -10.720 1.00 1.66 H new ATOM 0 HZ3 LYS A 113 5.922 0.272 -11.304 1.00 1.66 H new ATOM 373 N ARG A 114 -0.044 0.788 -8.669 1.00 0.35 N ATOM 374 CA ARG A 114 -1.037 1.702 -9.326 1.00 0.33 C ATOM 375 C ARG A 114 -1.208 2.963 -8.460 1.00 0.28 C ATOM 376 O ARG A 114 -1.160 4.084 -8.941 1.00 0.29 O ATOM 377 CB ARG A 114 -2.346 0.895 -9.359 1.00 0.37 C ATOM 378 CG ARG A 114 -3.503 1.748 -9.895 1.00 0.38 C ATOM 379 CD ARG A 114 -4.806 1.323 -9.204 1.00 0.43 C ATOM 380 NE ARG A 114 -5.848 2.253 -9.727 1.00 0.57 N ATOM 381 CZ ARG A 114 -7.076 2.159 -9.298 1.00 1.04 C ATOM 382 NH1 ARG A 114 -7.711 1.024 -9.387 1.00 1.62 N ATOM 383 NH2 ARG A 114 -7.668 3.201 -8.781 1.00 1.77 N ATOM 0 H ARG A 114 -0.406 -0.129 -8.407 1.00 0.35 H new ATOM 0 HA ARG A 114 -0.731 2.022 -10.322 1.00 0.33 H new ATOM 0 HB2 ARG A 114 -2.218 0.013 -9.987 1.00 0.37 H new ATOM 0 HB3 ARG A 114 -2.585 0.541 -8.356 1.00 0.37 H new ATOM 0 HG2 ARG A 114 -3.307 2.804 -9.711 1.00 0.38 H new ATOM 0 HG3 ARG A 114 -3.592 1.624 -10.974 1.00 0.38 H new ATOM 0 HD2 ARG A 114 -5.053 0.286 -9.433 1.00 0.43 H new ATOM 0 HD3 ARG A 114 -4.719 1.398 -8.120 1.00 0.43 H new ATOM 0 HE ARG A 114 -5.601 2.961 -10.419 1.00 0.57 H new ATOM 0 HH11 ARG A 114 -7.247 0.211 -9.792 1.00 1.62 H new ATOM 0 HH12 ARG A 114 -8.671 0.949 -9.052 1.00 1.62 H new ATOM 0 HH21 ARG A 114 -7.170 4.089 -8.713 1.00 1.77 H new ATOM 0 HH22 ARG A 114 -8.628 3.128 -8.445 1.00 1.77 H new ATOM 397 N LEU A 115 -1.411 2.773 -7.181 1.00 0.26 N ATOM 398 CA LEU A 115 -1.596 3.934 -6.260 1.00 0.25 C ATOM 399 C LEU A 115 -0.272 4.680 -6.082 1.00 0.25 C ATOM 400 O LEU A 115 -0.252 5.873 -5.858 1.00 0.26 O ATOM 401 CB LEU A 115 -2.065 3.331 -4.934 1.00 0.26 C ATOM 402 CG LEU A 115 -3.456 2.713 -5.114 1.00 0.25 C ATOM 403 CD1 LEU A 115 -3.817 1.899 -3.867 1.00 0.32 C ATOM 404 CD2 LEU A 115 -4.496 3.823 -5.323 1.00 0.23 C ATOM 0 H LEU A 115 -1.457 1.858 -6.733 1.00 0.26 H new ATOM 0 HA LEU A 115 -2.316 4.655 -6.646 1.00 0.25 H new ATOM 0 HB2 LEU A 115 -1.359 2.571 -4.598 1.00 0.26 H new ATOM 0 HB3 LEU A 115 -2.095 4.101 -4.163 1.00 0.26 H new ATOM 0 HG LEU A 115 -3.450 2.060 -5.987 1.00 0.25 H new ATOM 0 HD11 LEU A 115 -4.806 1.459 -3.994 1.00 0.32 H new ATOM 0 HD12 LEU A 115 -3.083 1.106 -3.725 1.00 0.32 H new ATOM 0 HD13 LEU A 115 -3.819 2.552 -2.994 1.00 0.32 H new ATOM 0 HD21 LEU A 115 -5.483 3.378 -5.450 1.00 0.23 H new ATOM 0 HD22 LEU A 115 -4.505 4.482 -4.455 1.00 0.23 H new ATOM 0 HD23 LEU A 115 -4.240 4.399 -6.213 1.00 0.23 H new ATOM 416 N ALA A 116 0.839 3.991 -6.194 1.00 0.26 N ATOM 417 CA ALA A 116 2.167 4.669 -6.040 1.00 0.28 C ATOM 418 C ALA A 116 2.264 5.788 -7.074 1.00 0.26 C ATOM 419 O ALA A 116 2.600 6.919 -6.766 1.00 0.27 O ATOM 420 CB ALA A 116 3.211 3.584 -6.320 1.00 0.31 C ATOM 0 H ALA A 116 0.884 2.990 -6.385 1.00 0.26 H new ATOM 0 HA ALA A 116 2.311 5.108 -5.053 1.00 0.28 H new ATOM 0 HB1 ALA A 116 4.211 4.008 -6.226 1.00 0.31 H new ATOM 0 HB2 ALA A 116 3.092 2.771 -5.603 1.00 0.31 H new ATOM 0 HB3 ALA A 116 3.074 3.199 -7.331 1.00 0.31 H new ATOM 426 N ARG A 117 1.915 5.480 -8.296 1.00 0.27 N ATOM 427 CA ARG A 117 1.926 6.521 -9.362 1.00 0.30 C ATOM 428 C ARG A 117 0.936 7.629 -8.977 1.00 0.32 C ATOM 429 O ARG A 117 1.208 8.804 -9.142 1.00 0.33 O ATOM 430 CB ARG A 117 1.464 5.795 -10.628 1.00 0.35 C ATOM 431 CG ARG A 117 2.554 4.823 -11.086 1.00 0.37 C ATOM 432 CD ARG A 117 2.081 4.081 -12.338 1.00 1.31 C ATOM 433 NE ARG A 117 0.973 3.205 -11.865 1.00 1.53 N ATOM 434 CZ ARG A 117 -0.139 3.134 -12.543 1.00 1.93 C ATOM 435 NH1 ARG A 117 -0.133 2.656 -13.757 1.00 2.61 N ATOM 436 NH2 ARG A 117 -1.257 3.539 -12.006 1.00 2.24 N ATOM 0 H ARG A 117 1.623 4.551 -8.600 1.00 0.27 H new ATOM 0 HA ARG A 117 2.903 6.983 -9.505 1.00 0.30 H new ATOM 0 HB2 ARG A 117 0.538 5.254 -10.432 1.00 0.35 H new ATOM 0 HB3 ARG A 117 1.251 6.517 -11.417 1.00 0.35 H new ATOM 0 HG2 ARG A 117 3.475 5.366 -11.298 1.00 0.37 H new ATOM 0 HG3 ARG A 117 2.779 4.111 -10.292 1.00 0.37 H new ATOM 0 HD2 ARG A 117 1.736 4.776 -13.103 1.00 1.31 H new ATOM 0 HD3 ARG A 117 2.888 3.495 -12.779 1.00 1.31 H new ATOM 0 HE ARG A 117 1.084 2.660 -11.010 1.00 1.53 H new ATOM 0 HH11 ARG A 117 0.741 2.338 -14.176 1.00 2.61 H new ATOM 0 HH12 ARG A 117 -1.002 2.600 -14.287 1.00 2.61 H new ATOM 0 HH21 ARG A 117 -1.261 3.911 -11.056 1.00 2.24 H new ATOM 0 HH22 ARG A 117 -2.127 3.484 -12.536 1.00 2.24 H new ATOM 450 N GLU A 118 -0.203 7.252 -8.437 1.00 0.34 N ATOM 451 CA GLU A 118 -1.208 8.275 -8.007 1.00 0.39 C ATOM 452 C GLU A 118 -0.624 9.106 -6.862 1.00 0.39 C ATOM 453 O GLU A 118 -0.785 10.309 -6.804 1.00 0.41 O ATOM 454 CB GLU A 118 -2.419 7.477 -7.517 1.00 0.43 C ATOM 455 CG GLU A 118 -3.107 6.806 -8.711 1.00 0.47 C ATOM 456 CD GLU A 118 -4.325 6.000 -8.238 1.00 0.53 C ATOM 457 OE1 GLU A 118 -4.754 6.198 -7.111 1.00 1.45 O ATOM 458 OE2 GLU A 118 -4.815 5.201 -9.020 1.00 0.76 O ATOM 0 H GLU A 118 -0.477 6.283 -8.277 1.00 0.34 H new ATOM 0 HA GLU A 118 -1.478 8.958 -8.813 1.00 0.39 H new ATOM 0 HB2 GLU A 118 -2.103 6.724 -6.795 1.00 0.43 H new ATOM 0 HB3 GLU A 118 -3.119 8.137 -7.004 1.00 0.43 H new ATOM 0 HG2 GLU A 118 -3.420 7.562 -9.431 1.00 0.47 H new ATOM 0 HG3 GLU A 118 -2.404 6.149 -9.223 1.00 0.47 H new ATOM 465 N LEU A 119 0.075 8.459 -5.963 1.00 0.37 N ATOM 466 CA LEU A 119 0.706 9.182 -4.818 1.00 0.38 C ATOM 467 C LEU A 119 1.947 9.958 -5.286 1.00 0.36 C ATOM 468 O LEU A 119 2.551 10.687 -4.525 1.00 0.39 O ATOM 469 CB LEU A 119 1.079 8.074 -3.832 1.00 0.38 C ATOM 470 CG LEU A 119 -0.101 7.750 -2.888 1.00 0.56 C ATOM 471 CD1 LEU A 119 -0.160 8.787 -1.768 1.00 1.33 C ATOM 472 CD2 LEU A 119 -1.453 7.742 -3.630 1.00 0.58 C ATOM 0 H LEU A 119 0.236 7.452 -5.974 1.00 0.37 H new ATOM 0 HA LEU A 119 0.044 9.922 -4.369 1.00 0.38 H new ATOM 0 HB2 LEU A 119 1.367 7.177 -4.380 1.00 0.38 H new ATOM 0 HB3 LEU A 119 1.945 8.381 -3.245 1.00 0.38 H new ATOM 0 HG LEU A 119 0.070 6.753 -2.483 1.00 0.56 H new ATOM 0 HD11 LEU A 119 -0.993 8.557 -1.103 1.00 1.33 H new ATOM 0 HD12 LEU A 119 0.772 8.766 -1.203 1.00 1.33 H new ATOM 0 HD13 LEU A 119 -0.302 9.779 -2.197 1.00 1.33 H new ATOM 0 HD21 LEU A 119 -2.253 7.510 -2.927 1.00 0.58 H new ATOM 0 HD22 LEU A 119 -1.632 8.722 -4.072 1.00 0.58 H new ATOM 0 HD23 LEU A 119 -1.432 6.988 -4.417 1.00 0.58 H new ATOM 484 N LYS A 120 2.328 9.812 -6.540 1.00 0.34 N ATOM 485 CA LYS A 120 3.519 10.542 -7.077 1.00 0.35 C ATOM 486 C LYS A 120 4.770 10.155 -6.293 1.00 0.30 C ATOM 487 O LYS A 120 5.510 10.999 -5.823 1.00 0.33 O ATOM 488 CB LYS A 120 3.214 12.038 -6.923 1.00 0.48 C ATOM 489 CG LYS A 120 4.238 12.848 -7.718 1.00 1.05 C ATOM 490 CD LYS A 120 3.988 12.644 -9.216 1.00 1.11 C ATOM 491 CE LYS A 120 4.835 13.632 -10.023 1.00 2.02 C ATOM 492 NZ LYS A 120 5.978 12.828 -10.537 1.00 2.16 N ATOM 0 H LYS A 120 1.857 9.211 -7.216 1.00 0.34 H new ATOM 0 HA LYS A 120 3.707 10.291 -8.121 1.00 0.35 H new ATOM 0 HB2 LYS A 120 2.207 12.254 -7.279 1.00 0.48 H new ATOM 0 HB3 LYS A 120 3.247 12.321 -5.871 1.00 0.48 H new ATOM 0 HG2 LYS A 120 4.159 13.905 -7.465 1.00 1.05 H new ATOM 0 HG3 LYS A 120 5.249 12.533 -7.459 1.00 1.05 H new ATOM 0 HD2 LYS A 120 4.237 11.621 -9.500 1.00 1.11 H new ATOM 0 HD3 LYS A 120 2.931 12.789 -9.441 1.00 1.11 H new ATOM 0 HE2 LYS A 120 4.261 14.069 -10.840 1.00 2.02 H new ATOM 0 HE3 LYS A 120 5.181 14.457 -9.400 1.00 2.02 H new ATOM 0 HZ1 LYS A 120 6.605 13.437 -11.101 1.00 2.16 H new ATOM 0 HZ2 LYS A 120 6.510 12.430 -9.737 1.00 2.16 H new ATOM 0 HZ3 LYS A 120 5.619 12.055 -11.132 1.00 2.16 H new ATOM 506 N VAL A 121 5.009 8.878 -6.163 1.00 0.29 N ATOM 507 CA VAL A 121 6.219 8.410 -5.423 1.00 0.33 C ATOM 508 C VAL A 121 7.468 8.688 -6.264 1.00 0.37 C ATOM 509 O VAL A 121 7.386 8.864 -7.465 1.00 0.42 O ATOM 510 CB VAL A 121 6.023 6.901 -5.223 1.00 0.36 C ATOM 511 CG1 VAL A 121 4.771 6.658 -4.377 1.00 1.65 C ATOM 512 CG2 VAL A 121 5.872 6.202 -6.584 1.00 1.29 C ATOM 0 H VAL A 121 4.418 8.136 -6.538 1.00 0.29 H new ATOM 0 HA VAL A 121 6.347 8.920 -4.468 1.00 0.33 H new ATOM 0 HB VAL A 121 6.895 6.492 -4.712 1.00 0.36 H new ATOM 0 HG11 VAL A 121 4.631 5.587 -4.234 1.00 1.65 H new ATOM 0 HG12 VAL A 121 4.888 7.141 -3.407 1.00 1.65 H new ATOM 0 HG13 VAL A 121 3.901 7.073 -4.886 1.00 1.65 H new ATOM 0 HG21 VAL A 121 5.734 5.132 -6.430 1.00 1.29 H new ATOM 0 HG22 VAL A 121 5.007 6.608 -7.108 1.00 1.29 H new ATOM 0 HG23 VAL A 121 6.769 6.370 -7.181 1.00 1.29 H new ATOM 522 N SER A 122 8.621 8.742 -5.644 1.00 0.45 N ATOM 523 CA SER A 122 9.881 9.026 -6.408 1.00 0.52 C ATOM 524 C SER A 122 10.047 8.042 -7.566 1.00 0.44 C ATOM 525 O SER A 122 10.083 6.841 -7.378 1.00 0.35 O ATOM 526 CB SER A 122 11.011 8.844 -5.393 1.00 0.63 C ATOM 527 OG SER A 122 12.240 9.252 -5.981 1.00 1.10 O ATOM 0 H SER A 122 8.747 8.602 -4.642 1.00 0.45 H new ATOM 0 HA SER A 122 9.873 10.025 -6.844 1.00 0.52 H new ATOM 0 HB2 SER A 122 10.810 9.432 -4.498 1.00 0.63 H new ATOM 0 HB3 SER A 122 11.072 7.801 -5.082 1.00 0.63 H new ATOM 0 HG SER A 122 12.837 9.596 -5.285 1.00 1.10 H new ATOM 533 N GLU A 123 10.162 8.557 -8.765 1.00 0.55 N ATOM 534 CA GLU A 123 10.343 7.673 -9.955 1.00 0.58 C ATOM 535 C GLU A 123 11.621 6.851 -9.792 1.00 0.52 C ATOM 536 O GLU A 123 11.704 5.719 -10.229 1.00 0.53 O ATOM 537 CB GLU A 123 10.447 8.616 -11.158 1.00 0.77 C ATOM 538 CG GLU A 123 9.076 9.238 -11.440 1.00 1.44 C ATOM 539 CD GLU A 123 9.179 10.192 -12.632 1.00 1.61 C ATOM 540 OE1 GLU A 123 9.164 9.712 -13.753 1.00 1.75 O ATOM 541 OE2 GLU A 123 9.271 11.387 -12.403 1.00 2.15 O ATOM 0 H GLU A 123 10.138 9.556 -8.970 1.00 0.55 H new ATOM 0 HA GLU A 123 9.520 6.969 -10.079 1.00 0.58 H new ATOM 0 HB2 GLU A 123 11.179 9.399 -10.958 1.00 0.77 H new ATOM 0 HB3 GLU A 123 10.797 8.069 -12.033 1.00 0.77 H new ATOM 0 HG2 GLU A 123 8.347 8.455 -11.650 1.00 1.44 H new ATOM 0 HG3 GLU A 123 8.722 9.776 -10.561 1.00 1.44 H new ATOM 548 N ALA A 124 12.618 7.420 -9.159 1.00 0.50 N ATOM 549 CA ALA A 124 13.904 6.675 -8.954 1.00 0.50 C ATOM 550 C ALA A 124 13.643 5.384 -8.173 1.00 0.39 C ATOM 551 O ALA A 124 14.028 4.306 -8.586 1.00 0.45 O ATOM 552 CB ALA A 124 14.791 7.618 -8.138 1.00 0.56 C ATOM 0 H ALA A 124 12.599 8.365 -8.776 1.00 0.50 H new ATOM 0 HA ALA A 124 14.371 6.394 -9.898 1.00 0.50 H new ATOM 0 HB1 ALA A 124 15.752 7.140 -7.948 1.00 0.56 H new ATOM 0 HB2 ALA A 124 14.949 8.542 -8.695 1.00 0.56 H new ATOM 0 HB3 ALA A 124 14.305 7.845 -7.189 1.00 0.56 H new ATOM 558 N LYS A 125 12.976 5.493 -7.053 1.00 0.31 N ATOM 559 CA LYS A 125 12.666 4.280 -6.236 1.00 0.34 C ATOM 560 C LYS A 125 11.788 3.326 -7.044 1.00 0.34 C ATOM 561 O LYS A 125 11.979 2.125 -7.033 1.00 0.39 O ATOM 562 CB LYS A 125 11.900 4.808 -5.028 1.00 0.42 C ATOM 563 CG LYS A 125 12.836 5.669 -4.181 1.00 0.54 C ATOM 564 CD LYS A 125 12.083 6.207 -2.965 1.00 0.75 C ATOM 565 CE LYS A 125 13.026 7.069 -2.123 1.00 0.75 C ATOM 566 NZ LYS A 125 12.861 8.451 -2.654 1.00 1.56 N ATOM 0 H LYS A 125 12.631 6.372 -6.667 1.00 0.31 H new ATOM 0 HA LYS A 125 13.561 3.731 -5.945 1.00 0.34 H new ATOM 0 HB2 LYS A 125 11.041 5.395 -5.354 1.00 0.42 H new ATOM 0 HB3 LYS A 125 11.513 3.979 -4.436 1.00 0.42 H new ATOM 0 HG2 LYS A 125 13.694 5.080 -3.858 1.00 0.54 H new ATOM 0 HG3 LYS A 125 13.223 6.496 -4.776 1.00 0.54 H new ATOM 0 HD2 LYS A 125 11.224 6.796 -3.287 1.00 0.75 H new ATOM 0 HD3 LYS A 125 11.697 5.381 -2.368 1.00 0.75 H new ATOM 0 HE2 LYS A 125 12.768 7.019 -1.065 1.00 0.75 H new ATOM 0 HE3 LYS A 125 14.058 6.731 -2.215 1.00 0.75 H new ATOM 0 HZ1 LYS A 125 13.477 9.102 -2.126 1.00 1.56 H new ATOM 0 HZ2 LYS A 125 13.120 8.469 -3.661 1.00 1.56 H new ATOM 0 HZ3 LYS A 125 11.870 8.748 -2.546 1.00 1.56 H new ATOM 580 N MET A 126 10.833 3.865 -7.757 1.00 0.42 N ATOM 581 CA MET A 126 9.933 3.010 -8.593 1.00 0.56 C ATOM 582 C MET A 126 10.771 2.247 -9.625 1.00 0.57 C ATOM 583 O MET A 126 10.554 1.077 -9.883 1.00 0.66 O ATOM 584 CB MET A 126 8.984 3.999 -9.281 1.00 0.70 C ATOM 585 CG MET A 126 7.568 3.413 -9.347 1.00 1.10 C ATOM 586 SD MET A 126 7.296 2.654 -10.968 1.00 1.90 S ATOM 587 CE MET A 126 5.738 3.491 -11.352 1.00 2.03 C ATOM 0 H MET A 126 10.636 4.865 -7.797 1.00 0.42 H new ATOM 0 HA MET A 126 9.386 2.268 -8.011 1.00 0.56 H new ATOM 0 HB2 MET A 126 8.970 4.942 -8.734 1.00 0.70 H new ATOM 0 HB3 MET A 126 9.342 4.219 -10.287 1.00 0.70 H new ATOM 0 HG2 MET A 126 7.434 2.671 -8.560 1.00 1.10 H new ATOM 0 HG3 MET A 126 6.831 4.197 -9.174 1.00 1.10 H new ATOM 0 HE1 MET A 126 5.381 3.165 -12.329 1.00 2.03 H new ATOM 0 HE2 MET A 126 4.996 3.244 -10.593 1.00 2.03 H new ATOM 0 HE3 MET A 126 5.898 4.569 -11.365 1.00 2.03 H new ATOM 597 N ASP A 127 11.735 2.914 -10.205 1.00 0.55 N ATOM 598 CA ASP A 127 12.619 2.256 -11.218 1.00 0.62 C ATOM 599 C ASP A 127 13.361 1.063 -10.606 1.00 0.54 C ATOM 600 O ASP A 127 13.516 0.033 -11.235 1.00 0.59 O ATOM 601 CB ASP A 127 13.615 3.336 -11.654 1.00 0.71 C ATOM 602 CG ASP A 127 12.897 4.407 -12.483 1.00 1.04 C ATOM 603 OD1 ASP A 127 11.882 4.090 -13.083 1.00 1.60 O ATOM 604 OD2 ASP A 127 13.382 5.527 -12.510 1.00 1.71 O ATOM 0 H ASP A 127 11.951 3.894 -10.020 1.00 0.55 H new ATOM 0 HA ASP A 127 12.042 1.868 -12.058 1.00 0.62 H new ATOM 0 HB2 ASP A 127 14.077 3.791 -10.778 1.00 0.71 H new ATOM 0 HB3 ASP A 127 14.417 2.887 -12.240 1.00 0.71 H new ATOM 609 N GLY A 128 13.818 1.195 -9.385 1.00 0.46 N ATOM 610 CA GLY A 128 14.551 0.070 -8.728 1.00 0.46 C ATOM 611 C GLY A 128 13.595 -1.082 -8.428 1.00 0.48 C ATOM 612 O GLY A 128 13.948 -2.237 -8.563 1.00 0.51 O ATOM 0 H GLY A 128 13.715 2.034 -8.815 1.00 0.46 H new ATOM 0 HA2 GLY A 128 15.356 -0.276 -9.376 1.00 0.46 H new ATOM 0 HA3 GLY A 128 15.013 0.418 -7.804 1.00 0.46 H new ATOM 616 N ILE A 129 12.387 -0.780 -8.026 1.00 0.54 N ATOM 617 CA ILE A 129 11.400 -1.865 -7.715 1.00 0.68 C ATOM 618 C ILE A 129 11.194 -2.769 -8.947 1.00 0.68 C ATOM 619 O ILE A 129 11.427 -3.962 -8.891 1.00 0.72 O ATOM 620 CB ILE A 129 10.106 -1.104 -7.316 1.00 0.86 C ATOM 621 CG1 ILE A 129 10.148 -0.801 -5.821 1.00 1.04 C ATOM 622 CG2 ILE A 129 8.837 -1.916 -7.620 1.00 1.77 C ATOM 623 CD1 ILE A 129 9.262 0.414 -5.530 1.00 2.01 C ATOM 0 H ILE A 129 12.039 0.170 -7.899 1.00 0.54 H new ATOM 0 HA ILE A 129 11.728 -2.532 -6.918 1.00 0.68 H new ATOM 0 HB ILE A 129 10.067 -0.187 -7.904 1.00 0.86 H new ATOM 0 HG12 ILE A 129 9.801 -1.664 -5.253 1.00 1.04 H new ATOM 0 HG13 ILE A 129 11.173 -0.603 -5.506 1.00 1.04 H new ATOM 0 HG21 ILE A 129 7.959 -1.343 -7.324 1.00 1.77 H new ATOM 0 HG22 ILE A 129 8.788 -2.129 -8.688 1.00 1.77 H new ATOM 0 HG23 ILE A 129 8.863 -2.853 -7.064 1.00 1.77 H new ATOM 0 HD11 ILE A 129 9.288 0.636 -4.463 1.00 2.01 H new ATOM 0 HD12 ILE A 129 9.630 1.275 -6.089 1.00 2.01 H new ATOM 0 HD13 ILE A 129 8.237 0.197 -5.831 1.00 2.01 H new ATOM 635 N GLU A 130 10.742 -2.211 -10.040 1.00 0.70 N ATOM 636 CA GLU A 130 10.499 -3.043 -11.261 1.00 0.77 C ATOM 637 C GLU A 130 11.788 -3.722 -11.734 1.00 0.65 C ATOM 638 O GLU A 130 11.800 -4.902 -12.034 1.00 0.68 O ATOM 639 CB GLU A 130 9.989 -2.062 -12.320 1.00 0.85 C ATOM 640 CG GLU A 130 8.586 -1.592 -11.938 1.00 1.41 C ATOM 641 CD GLU A 130 8.112 -0.528 -12.929 1.00 1.66 C ATOM 642 OE1 GLU A 130 8.510 0.615 -12.775 1.00 2.14 O ATOM 643 OE2 GLU A 130 7.360 -0.875 -13.824 1.00 2.01 O ATOM 0 H GLU A 130 10.531 -1.218 -10.142 1.00 0.70 H new ATOM 0 HA GLU A 130 9.786 -3.844 -11.064 1.00 0.77 H new ATOM 0 HB2 GLU A 130 10.663 -1.209 -12.396 1.00 0.85 H new ATOM 0 HB3 GLU A 130 9.970 -2.542 -13.298 1.00 0.85 H new ATOM 0 HG2 GLU A 130 7.896 -2.436 -11.938 1.00 1.41 H new ATOM 0 HG3 GLU A 130 8.591 -1.185 -10.927 1.00 1.41 H new ATOM 650 N GLU A 131 12.866 -2.986 -11.817 1.00 0.59 N ATOM 651 CA GLU A 131 14.156 -3.587 -12.289 1.00 0.55 C ATOM 652 C GLU A 131 14.711 -4.596 -11.276 1.00 0.47 C ATOM 653 O GLU A 131 15.019 -5.724 -11.615 1.00 0.45 O ATOM 654 CB GLU A 131 15.114 -2.403 -12.433 1.00 0.63 C ATOM 655 CG GLU A 131 14.650 -1.506 -13.583 1.00 1.38 C ATOM 656 CD GLU A 131 14.777 -2.262 -14.906 1.00 1.89 C ATOM 657 OE1 GLU A 131 15.859 -2.754 -15.182 1.00 2.30 O ATOM 658 OE2 GLU A 131 13.792 -2.334 -15.622 1.00 2.50 O ATOM 0 H GLU A 131 12.912 -1.995 -11.579 1.00 0.59 H new ATOM 0 HA GLU A 131 14.021 -4.134 -13.222 1.00 0.55 H new ATOM 0 HB2 GLU A 131 15.147 -1.833 -11.504 1.00 0.63 H new ATOM 0 HB3 GLU A 131 16.126 -2.761 -12.623 1.00 0.63 H new ATOM 0 HG2 GLU A 131 13.616 -1.201 -13.425 1.00 1.38 H new ATOM 0 HG3 GLU A 131 15.250 -0.596 -13.613 1.00 1.38 H new ATOM 665 N LYS A 132 14.855 -4.190 -10.043 1.00 0.51 N ATOM 666 CA LYS A 132 15.414 -5.109 -8.999 1.00 0.53 C ATOM 667 C LYS A 132 14.427 -6.231 -8.658 1.00 0.54 C ATOM 668 O LYS A 132 14.819 -7.363 -8.442 1.00 0.63 O ATOM 669 CB LYS A 132 15.661 -4.227 -7.772 1.00 0.68 C ATOM 670 CG LYS A 132 16.461 -5.013 -6.728 1.00 1.39 C ATOM 671 CD LYS A 132 16.685 -4.142 -5.486 1.00 1.91 C ATOM 672 CE LYS A 132 18.081 -3.508 -5.534 1.00 2.62 C ATOM 673 NZ LYS A 132 18.066 -2.609 -6.723 1.00 2.69 N ATOM 0 H LYS A 132 14.610 -3.258 -9.709 1.00 0.51 H new ATOM 0 HA LYS A 132 16.325 -5.596 -9.348 1.00 0.53 H new ATOM 0 HB2 LYS A 132 16.205 -3.328 -8.061 1.00 0.68 H new ATOM 0 HB3 LYS A 132 14.711 -3.902 -7.348 1.00 0.68 H new ATOM 0 HG2 LYS A 132 15.926 -5.922 -6.455 1.00 1.39 H new ATOM 0 HG3 LYS A 132 17.419 -5.321 -7.146 1.00 1.39 H new ATOM 0 HD2 LYS A 132 15.924 -3.363 -5.436 1.00 1.91 H new ATOM 0 HD3 LYS A 132 16.582 -4.746 -4.585 1.00 1.91 H new ATOM 0 HE2 LYS A 132 18.291 -2.950 -4.622 1.00 2.62 H new ATOM 0 HE3 LYS A 132 18.855 -4.269 -5.627 1.00 2.62 H new ATOM 0 HZ1 LYS A 132 18.837 -1.916 -6.644 1.00 2.69 H new ATOM 0 HZ2 LYS A 132 18.196 -3.174 -7.587 1.00 2.69 H new ATOM 0 HZ3 LYS A 132 17.155 -2.110 -6.769 1.00 2.69 H new ATOM 687 N TYR A 133 13.159 -5.920 -8.576 1.00 0.55 N ATOM 688 CA TYR A 133 12.150 -6.959 -8.211 1.00 0.65 C ATOM 689 C TYR A 133 11.091 -7.110 -9.314 1.00 0.54 C ATOM 690 O TYR A 133 10.042 -6.500 -9.242 1.00 0.66 O ATOM 691 CB TYR A 133 11.508 -6.431 -6.930 1.00 0.89 C ATOM 692 CG TYR A 133 12.563 -6.272 -5.864 1.00 1.14 C ATOM 693 CD1 TYR A 133 13.178 -7.400 -5.308 1.00 2.20 C ATOM 694 CD2 TYR A 133 12.928 -4.991 -5.432 1.00 0.98 C ATOM 695 CE1 TYR A 133 14.157 -7.247 -4.319 1.00 2.44 C ATOM 696 CE2 TYR A 133 13.906 -4.838 -4.443 1.00 1.14 C ATOM 697 CZ TYR A 133 14.521 -5.966 -3.887 1.00 1.67 C ATOM 698 OH TYR A 133 15.486 -5.815 -2.912 1.00 1.95 O ATOM 0 H TYR A 133 12.778 -4.989 -8.746 1.00 0.55 H new ATOM 0 HA TYR A 133 12.603 -7.942 -8.082 1.00 0.65 H new ATOM 0 HB2 TYR A 133 11.023 -5.474 -7.122 1.00 0.89 H new ATOM 0 HB3 TYR A 133 10.733 -7.118 -6.590 1.00 0.89 H new ATOM 0 HD1 TYR A 133 12.897 -8.388 -5.642 1.00 2.20 H new ATOM 0 HD2 TYR A 133 12.455 -4.121 -5.862 1.00 0.98 H new ATOM 0 HE1 TYR A 133 14.631 -8.117 -3.889 1.00 2.44 H new ATOM 0 HE2 TYR A 133 14.186 -3.850 -4.109 1.00 1.14 H new ATOM 0 HH TYR A 133 15.089 -5.978 -2.031 1.00 1.95 H new ATOM 708 N PRO A 134 11.395 -7.914 -10.308 1.00 0.51 N ATOM 709 CA PRO A 134 10.443 -8.120 -11.419 1.00 0.53 C ATOM 710 C PRO A 134 9.369 -9.160 -11.061 1.00 0.47 C ATOM 711 O PRO A 134 8.427 -9.350 -11.810 1.00 0.54 O ATOM 712 CB PRO A 134 11.324 -8.635 -12.552 1.00 0.70 C ATOM 713 CG PRO A 134 12.511 -9.266 -11.889 1.00 0.76 C ATOM 714 CD PRO A 134 12.630 -8.693 -10.497 1.00 0.66 C ATOM 0 HA PRO A 134 9.898 -7.210 -11.671 1.00 0.53 H new ATOM 0 HB2 PRO A 134 10.788 -9.359 -13.166 1.00 0.70 H new ATOM 0 HB3 PRO A 134 11.630 -7.822 -13.211 1.00 0.70 H new ATOM 0 HG2 PRO A 134 12.392 -10.349 -11.846 1.00 0.76 H new ATOM 0 HG3 PRO A 134 13.417 -9.067 -12.461 1.00 0.76 H new ATOM 0 HD2 PRO A 134 12.719 -9.482 -9.750 1.00 0.66 H new ATOM 0 HD3 PRO A 134 13.514 -8.063 -10.402 1.00 0.66 H new ATOM 722 N ARG A 135 9.503 -9.856 -9.950 1.00 0.43 N ATOM 723 CA ARG A 135 8.477 -10.895 -9.608 1.00 0.48 C ATOM 724 C ARG A 135 8.152 -10.945 -8.101 1.00 0.43 C ATOM 725 O ARG A 135 7.314 -11.724 -7.687 1.00 0.60 O ATOM 726 CB ARG A 135 9.113 -12.213 -10.051 1.00 0.70 C ATOM 727 CG ARG A 135 8.028 -13.280 -10.207 1.00 0.91 C ATOM 728 CD ARG A 135 7.269 -13.039 -11.514 1.00 1.17 C ATOM 729 NE ARG A 135 6.419 -14.248 -11.697 1.00 1.44 N ATOM 730 CZ ARG A 135 6.134 -14.668 -12.900 1.00 2.17 C ATOM 731 NH1 ARG A 135 5.605 -13.849 -13.769 1.00 3.07 N ATOM 732 NH2 ARG A 135 6.378 -15.905 -13.235 1.00 2.61 N ATOM 0 H ARG A 135 10.264 -9.751 -9.279 1.00 0.43 H new ATOM 0 HA ARG A 135 7.528 -10.680 -10.098 1.00 0.48 H new ATOM 0 HB2 ARG A 135 9.640 -12.075 -10.995 1.00 0.70 H new ATOM 0 HB3 ARG A 135 9.852 -12.536 -9.318 1.00 0.70 H new ATOM 0 HG2 ARG A 135 8.476 -14.274 -10.211 1.00 0.91 H new ATOM 0 HG3 ARG A 135 7.341 -13.243 -9.362 1.00 0.91 H new ATOM 0 HD2 ARG A 135 6.662 -12.135 -11.457 1.00 1.17 H new ATOM 0 HD3 ARG A 135 7.956 -12.909 -12.351 1.00 1.17 H new ATOM 0 HE ARG A 135 6.060 -14.747 -10.883 1.00 1.44 H new ATOM 0 HH11 ARG A 135 5.415 -12.882 -13.508 1.00 3.07 H new ATOM 0 HH12 ARG A 135 5.382 -14.177 -14.709 1.00 3.07 H new ATOM 0 HH21 ARG A 135 6.792 -16.545 -12.557 1.00 2.61 H new ATOM 0 HH22 ARG A 135 6.155 -16.232 -14.175 1.00 2.61 H new ATOM 746 N SER A 136 8.792 -10.144 -7.276 1.00 0.51 N ATOM 747 CA SER A 136 8.486 -10.191 -5.812 1.00 0.44 C ATOM 748 C SER A 136 7.450 -9.139 -5.443 1.00 0.33 C ATOM 749 O SER A 136 7.712 -7.951 -5.469 1.00 0.30 O ATOM 750 CB SER A 136 9.816 -9.912 -5.114 1.00 0.50 C ATOM 751 OG SER A 136 9.720 -10.296 -3.749 1.00 0.90 O ATOM 0 H SER A 136 9.504 -9.468 -7.552 1.00 0.51 H new ATOM 0 HA SER A 136 8.067 -11.153 -5.516 1.00 0.44 H new ATOM 0 HB2 SER A 136 10.619 -10.463 -5.603 1.00 0.50 H new ATOM 0 HB3 SER A 136 10.064 -8.853 -5.189 1.00 0.50 H new ATOM 0 HG SER A 136 10.601 -10.580 -3.426 1.00 0.90 H new ATOM 757 N LEU A 137 6.271 -9.579 -5.087 1.00 0.31 N ATOM 758 CA LEU A 137 5.197 -8.623 -4.696 1.00 0.24 C ATOM 759 C LEU A 137 5.646 -7.859 -3.448 1.00 0.20 C ATOM 760 O LEU A 137 5.448 -6.667 -3.326 1.00 0.21 O ATOM 761 CB LEU A 137 3.978 -9.505 -4.380 1.00 0.23 C ATOM 762 CG LEU A 137 2.784 -8.630 -4.004 1.00 0.21 C ATOM 763 CD1 LEU A 137 2.363 -7.777 -5.210 1.00 0.23 C ATOM 764 CD2 LEU A 137 1.621 -9.534 -3.582 1.00 0.27 C ATOM 0 H LEU A 137 6.007 -10.563 -5.051 1.00 0.31 H new ATOM 0 HA LEU A 137 4.971 -7.891 -5.471 1.00 0.24 H new ATOM 0 HB2 LEU A 137 3.730 -10.121 -5.245 1.00 0.23 H new ATOM 0 HB3 LEU A 137 4.213 -10.185 -3.561 1.00 0.23 H new ATOM 0 HG LEU A 137 3.057 -7.969 -3.182 1.00 0.21 H new ATOM 0 HD11 LEU A 137 1.511 -7.155 -4.936 1.00 0.23 H new ATOM 0 HD12 LEU A 137 3.194 -7.141 -5.513 1.00 0.23 H new ATOM 0 HD13 LEU A 137 2.085 -8.429 -6.038 1.00 0.23 H new ATOM 0 HD21 LEU A 137 0.762 -8.920 -3.311 1.00 0.27 H new ATOM 0 HD22 LEU A 137 1.351 -10.190 -4.410 1.00 0.27 H new ATOM 0 HD23 LEU A 137 1.921 -10.136 -2.725 1.00 0.27 H new ATOM 776 N SER A 138 6.256 -8.557 -2.527 1.00 0.24 N ATOM 777 CA SER A 138 6.739 -7.906 -1.265 1.00 0.26 C ATOM 778 C SER A 138 7.775 -6.800 -1.543 1.00 0.20 C ATOM 779 O SER A 138 7.672 -5.703 -1.032 1.00 0.22 O ATOM 780 CB SER A 138 7.385 -9.039 -0.464 1.00 0.38 C ATOM 781 OG SER A 138 7.962 -8.510 0.722 1.00 1.01 O ATOM 0 H SER A 138 6.444 -9.558 -2.592 1.00 0.24 H new ATOM 0 HA SER A 138 5.919 -7.421 -0.736 1.00 0.26 H new ATOM 0 HB2 SER A 138 6.639 -9.793 -0.213 1.00 0.38 H new ATOM 0 HB3 SER A 138 8.149 -9.533 -1.064 1.00 0.38 H new ATOM 0 HG SER A 138 8.630 -9.137 1.069 1.00 1.01 H new ATOM 787 N GLU A 139 8.786 -7.095 -2.324 1.00 0.24 N ATOM 788 CA GLU A 139 9.861 -6.080 -2.608 1.00 0.25 C ATOM 789 C GLU A 139 9.344 -4.930 -3.475 1.00 0.21 C ATOM 790 O GLU A 139 9.741 -3.791 -3.314 1.00 0.21 O ATOM 791 CB GLU A 139 10.948 -6.820 -3.394 1.00 0.39 C ATOM 792 CG GLU A 139 11.443 -8.048 -2.625 1.00 1.09 C ATOM 793 CD GLU A 139 12.245 -7.608 -1.398 1.00 2.02 C ATOM 794 OE1 GLU A 139 12.858 -6.553 -1.458 1.00 2.24 O ATOM 795 OE2 GLU A 139 12.233 -8.333 -0.417 1.00 2.92 O ATOM 0 H GLU A 139 8.917 -7.997 -2.781 1.00 0.24 H new ATOM 0 HA GLU A 139 10.221 -5.654 -1.672 1.00 0.25 H new ATOM 0 HB2 GLU A 139 10.555 -7.128 -4.363 1.00 0.39 H new ATOM 0 HB3 GLU A 139 11.783 -6.147 -3.588 1.00 0.39 H new ATOM 0 HG2 GLU A 139 10.596 -8.660 -2.316 1.00 1.09 H new ATOM 0 HG3 GLU A 139 12.064 -8.667 -3.273 1.00 1.09 H new ATOM 802 N ARG A 140 8.504 -5.235 -4.424 1.00 0.26 N ATOM 803 CA ARG A 140 7.996 -4.183 -5.355 1.00 0.33 C ATOM 804 C ARG A 140 7.192 -3.126 -4.594 1.00 0.29 C ATOM 805 O ARG A 140 7.517 -1.953 -4.610 1.00 0.35 O ATOM 806 CB ARG A 140 7.077 -4.953 -6.322 1.00 0.42 C ATOM 807 CG ARG A 140 6.637 -4.065 -7.489 1.00 1.07 C ATOM 808 CD ARG A 140 5.501 -4.754 -8.255 1.00 1.17 C ATOM 809 NE ARG A 140 6.133 -5.915 -8.942 1.00 0.98 N ATOM 810 CZ ARG A 140 5.795 -6.210 -10.170 1.00 1.13 C ATOM 811 NH1 ARG A 140 6.339 -5.569 -11.168 1.00 1.60 N ATOM 812 NH2 ARG A 140 4.913 -7.145 -10.401 1.00 1.55 N ATOM 0 H ARG A 140 8.144 -6.173 -4.598 1.00 0.26 H new ATOM 0 HA ARG A 140 8.802 -3.654 -5.863 1.00 0.33 H new ATOM 0 HB2 ARG A 140 7.600 -5.830 -6.705 1.00 0.42 H new ATOM 0 HB3 ARG A 140 6.200 -5.314 -5.785 1.00 0.42 H new ATOM 0 HG2 ARG A 140 6.304 -3.096 -7.117 1.00 1.07 H new ATOM 0 HG3 ARG A 140 7.479 -3.878 -8.156 1.00 1.07 H new ATOM 0 HD2 ARG A 140 4.712 -5.081 -7.577 1.00 1.17 H new ATOM 0 HD3 ARG A 140 5.043 -4.074 -8.974 1.00 1.17 H new ATOM 0 HE ARG A 140 6.829 -6.479 -8.455 1.00 0.98 H new ATOM 0 HH11 ARG A 140 7.028 -4.838 -10.990 1.00 1.60 H new ATOM 0 HH12 ARG A 140 6.076 -5.799 -12.126 1.00 1.60 H new ATOM 0 HH21 ARG A 140 4.486 -7.647 -9.622 1.00 1.55 H new ATOM 0 HH22 ARG A 140 4.651 -7.373 -11.360 1.00 1.55 H new ATOM 826 N VAL A 141 6.144 -3.534 -3.945 1.00 0.24 N ATOM 827 CA VAL A 141 5.286 -2.565 -3.190 1.00 0.27 C ATOM 828 C VAL A 141 5.971 -1.981 -1.940 1.00 0.25 C ATOM 829 O VAL A 141 5.776 -0.829 -1.617 1.00 0.29 O ATOM 830 CB VAL A 141 4.032 -3.347 -2.808 1.00 0.28 C ATOM 831 CG1 VAL A 141 3.329 -3.834 -4.078 1.00 0.33 C ATOM 832 CG2 VAL A 141 4.398 -4.557 -1.948 1.00 0.23 C ATOM 0 H VAL A 141 5.835 -4.505 -3.900 1.00 0.24 H new ATOM 0 HA VAL A 141 5.068 -1.696 -3.811 1.00 0.27 H new ATOM 0 HB VAL A 141 3.372 -2.692 -2.240 1.00 0.28 H new ATOM 0 HG11 VAL A 141 2.433 -4.393 -3.807 1.00 0.33 H new ATOM 0 HG12 VAL A 141 3.050 -2.977 -4.691 1.00 0.33 H new ATOM 0 HG13 VAL A 141 4.002 -4.480 -4.642 1.00 0.33 H new ATOM 0 HG21 VAL A 141 3.492 -5.103 -1.684 1.00 0.23 H new ATOM 0 HG22 VAL A 141 5.067 -5.211 -2.507 1.00 0.23 H new ATOM 0 HG23 VAL A 141 4.896 -4.220 -1.039 1.00 0.23 H new ATOM 842 N ARG A 142 6.727 -2.762 -1.210 1.00 0.21 N ATOM 843 CA ARG A 142 7.363 -2.239 0.050 1.00 0.22 C ATOM 844 C ARG A 142 8.107 -0.913 -0.163 1.00 0.24 C ATOM 845 O ARG A 142 7.866 0.044 0.550 1.00 0.25 O ATOM 846 CB ARG A 142 8.334 -3.332 0.499 1.00 0.27 C ATOM 847 CG ARG A 142 7.587 -4.356 1.357 1.00 0.28 C ATOM 848 CD ARG A 142 8.553 -5.455 1.807 1.00 1.02 C ATOM 849 NE ARG A 142 7.722 -6.383 2.624 1.00 0.94 N ATOM 850 CZ ARG A 142 8.170 -6.833 3.765 1.00 1.48 C ATOM 851 NH1 ARG A 142 8.025 -6.121 4.850 1.00 2.24 N ATOM 852 NH2 ARG A 142 8.759 -7.995 3.823 1.00 2.10 N ATOM 0 H ARG A 142 6.934 -3.737 -1.427 1.00 0.21 H new ATOM 0 HA ARG A 142 6.600 -2.022 0.797 1.00 0.22 H new ATOM 0 HB2 ARG A 142 8.774 -3.821 -0.370 1.00 0.27 H new ATOM 0 HB3 ARG A 142 9.154 -2.894 1.068 1.00 0.27 H new ATOM 0 HG2 ARG A 142 7.148 -3.866 2.226 1.00 0.28 H new ATOM 0 HG3 ARG A 142 6.765 -4.791 0.788 1.00 0.28 H new ATOM 0 HD2 ARG A 142 8.994 -5.968 0.952 1.00 1.02 H new ATOM 0 HD3 ARG A 142 9.376 -5.043 2.391 1.00 1.02 H new ATOM 0 HE ARG A 142 6.801 -6.668 2.291 1.00 0.94 H new ATOM 0 HH11 ARG A 142 7.562 -5.213 4.806 1.00 2.24 H new ATOM 0 HH12 ARG A 142 8.375 -6.473 5.741 1.00 2.24 H new ATOM 0 HH21 ARG A 142 8.870 -8.553 2.977 1.00 2.10 H new ATOM 0 HH22 ARG A 142 9.109 -8.346 4.715 1.00 2.10 H new ATOM 866 N GLU A 143 9.003 -0.836 -1.116 1.00 0.26 N ATOM 867 CA GLU A 143 9.743 0.450 -1.330 1.00 0.31 C ATOM 868 C GLU A 143 8.764 1.570 -1.704 1.00 0.30 C ATOM 869 O GLU A 143 8.768 2.632 -1.105 1.00 0.31 O ATOM 870 CB GLU A 143 10.734 0.164 -2.458 1.00 0.36 C ATOM 871 CG GLU A 143 11.545 1.427 -2.771 1.00 0.44 C ATOM 872 CD GLU A 143 12.569 1.137 -3.877 1.00 0.97 C ATOM 873 OE1 GLU A 143 12.824 -0.028 -4.145 1.00 1.84 O ATOM 874 OE2 GLU A 143 13.080 2.089 -4.442 1.00 1.62 O ATOM 0 H GLU A 143 9.253 -1.596 -1.748 1.00 0.26 H new ATOM 0 HA GLU A 143 10.261 0.787 -0.432 1.00 0.31 H new ATOM 0 HB2 GLU A 143 11.403 -0.647 -2.169 1.00 0.36 H new ATOM 0 HB3 GLU A 143 10.199 -0.166 -3.349 1.00 0.36 H new ATOM 0 HG2 GLU A 143 10.877 2.229 -3.085 1.00 0.44 H new ATOM 0 HG3 GLU A 143 12.057 1.772 -1.872 1.00 0.44 H new ATOM 881 N SER A 144 7.909 1.333 -2.667 1.00 0.29 N ATOM 882 CA SER A 144 6.906 2.377 -3.054 1.00 0.29 C ATOM 883 C SER A 144 6.003 2.692 -1.857 1.00 0.28 C ATOM 884 O SER A 144 5.658 3.832 -1.604 1.00 0.28 O ATOM 885 CB SER A 144 6.100 1.769 -4.201 1.00 0.29 C ATOM 886 OG SER A 144 6.895 1.761 -5.378 1.00 1.34 O ATOM 0 H SER A 144 7.860 0.466 -3.201 1.00 0.29 H new ATOM 0 HA SER A 144 7.377 3.312 -3.358 1.00 0.29 H new ATOM 0 HB2 SER A 144 5.794 0.754 -3.948 1.00 0.29 H new ATOM 0 HB3 SER A 144 5.190 2.345 -4.367 1.00 0.29 H new ATOM 0 HG SER A 144 6.383 1.370 -6.116 1.00 1.34 H new ATOM 892 N LEU A 145 5.631 1.683 -1.115 1.00 0.27 N ATOM 893 CA LEU A 145 4.761 1.898 0.080 1.00 0.28 C ATOM 894 C LEU A 145 5.542 2.626 1.170 1.00 0.30 C ATOM 895 O LEU A 145 4.986 3.392 1.930 1.00 0.30 O ATOM 896 CB LEU A 145 4.379 0.498 0.572 1.00 0.29 C ATOM 897 CG LEU A 145 3.365 -0.143 -0.377 1.00 0.37 C ATOM 898 CD1 LEU A 145 3.187 -1.617 -0.011 1.00 0.73 C ATOM 899 CD2 LEU A 145 2.029 0.580 -0.233 1.00 0.67 C ATOM 0 H LEU A 145 5.894 0.712 -1.286 1.00 0.27 H new ATOM 0 HA LEU A 145 3.885 2.500 -0.164 1.00 0.28 H new ATOM 0 HB2 LEU A 145 5.270 -0.127 0.638 1.00 0.29 H new ATOM 0 HB3 LEU A 145 3.958 0.561 1.576 1.00 0.29 H new ATOM 0 HG LEU A 145 3.719 -0.066 -1.405 1.00 0.37 H new ATOM 0 HD11 LEU A 145 2.465 -2.075 -0.687 1.00 0.73 H new ATOM 0 HD12 LEU A 145 4.144 -2.132 -0.099 1.00 0.73 H new ATOM 0 HD13 LEU A 145 2.826 -1.696 1.014 1.00 0.73 H new ATOM 0 HD21 LEU A 145 1.298 0.131 -0.905 1.00 0.67 H new ATOM 0 HD22 LEU A 145 1.677 0.493 0.795 1.00 0.67 H new ATOM 0 HD23 LEU A 145 2.156 1.633 -0.486 1.00 0.67 H new ATOM 911 N LYS A 146 6.825 2.377 1.258 1.00 0.33 N ATOM 912 CA LYS A 146 7.653 3.040 2.313 1.00 0.35 C ATOM 913 C LYS A 146 7.600 4.563 2.151 1.00 0.34 C ATOM 914 O LYS A 146 7.359 5.286 3.100 1.00 0.35 O ATOM 915 CB LYS A 146 9.075 2.515 2.094 1.00 0.41 C ATOM 916 CG LYS A 146 10.013 3.097 3.154 1.00 1.01 C ATOM 917 CD LYS A 146 11.430 2.564 2.926 1.00 1.15 C ATOM 918 CE LYS A 146 12.098 3.354 1.798 1.00 1.96 C ATOM 919 NZ LYS A 146 13.539 2.979 1.864 1.00 2.32 N ATOM 0 H LYS A 146 7.336 1.742 0.644 1.00 0.33 H new ATOM 0 HA LYS A 146 7.294 2.821 3.319 1.00 0.35 H new ATOM 0 HB2 LYS A 146 9.082 1.426 2.147 1.00 0.41 H new ATOM 0 HB3 LYS A 146 9.424 2.788 1.098 1.00 0.41 H new ATOM 0 HG2 LYS A 146 10.009 4.186 3.101 1.00 1.01 H new ATOM 0 HG3 LYS A 146 9.666 2.825 4.151 1.00 1.01 H new ATOM 0 HD2 LYS A 146 12.015 2.652 3.842 1.00 1.15 H new ATOM 0 HD3 LYS A 146 11.395 1.505 2.671 1.00 1.15 H new ATOM 0 HE2 LYS A 146 11.668 3.099 0.829 1.00 1.96 H new ATOM 0 HE3 LYS A 146 11.963 4.427 1.934 1.00 1.96 H new ATOM 0 HZ1 LYS A 146 14.063 3.482 1.120 1.00 2.32 H new ATOM 0 HZ2 LYS A 146 13.923 3.240 2.795 1.00 2.32 H new ATOM 0 HZ3 LYS A 146 13.638 1.953 1.724 1.00 2.32 H new ATOM 933 N VAL A 147 7.827 5.059 0.960 1.00 0.32 N ATOM 934 CA VAL A 147 7.780 6.540 0.757 1.00 0.33 C ATOM 935 C VAL A 147 6.357 7.076 0.964 1.00 0.31 C ATOM 936 O VAL A 147 6.167 8.115 1.569 1.00 0.31 O ATOM 937 CB VAL A 147 8.282 6.800 -0.669 1.00 0.36 C ATOM 938 CG1 VAL A 147 9.737 6.340 -0.780 1.00 0.40 C ATOM 939 CG2 VAL A 147 7.438 6.044 -1.703 1.00 0.36 C ATOM 0 H VAL A 147 8.041 4.509 0.128 1.00 0.32 H new ATOM 0 HA VAL A 147 8.406 7.059 1.483 1.00 0.33 H new ATOM 0 HB VAL A 147 8.200 7.868 -0.872 1.00 0.36 H new ATOM 0 HG11 VAL A 147 10.100 6.522 -1.792 1.00 0.40 H new ATOM 0 HG12 VAL A 147 10.349 6.895 -0.069 1.00 0.40 H new ATOM 0 HG13 VAL A 147 9.800 5.275 -0.558 1.00 0.40 H new ATOM 0 HG21 VAL A 147 7.819 6.249 -2.704 1.00 0.36 H new ATOM 0 HG22 VAL A 147 7.494 4.973 -1.506 1.00 0.36 H new ATOM 0 HG23 VAL A 147 6.401 6.372 -1.636 1.00 0.36 H new ATOM 949 N TRP A 148 5.357 6.378 0.480 1.00 0.32 N ATOM 950 CA TRP A 148 3.950 6.859 0.667 1.00 0.33 C ATOM 951 C TRP A 148 3.617 6.925 2.171 1.00 0.32 C ATOM 952 O TRP A 148 3.156 7.939 2.661 1.00 0.32 O ATOM 953 CB TRP A 148 3.062 5.835 -0.090 1.00 0.36 C ATOM 954 CG TRP A 148 1.644 5.862 0.424 1.00 0.28 C ATOM 955 CD1 TRP A 148 0.888 6.974 0.596 1.00 0.30 C ATOM 956 CD2 TRP A 148 0.820 4.738 0.847 1.00 0.24 C ATOM 957 NE1 TRP A 148 -0.339 6.602 1.127 1.00 0.23 N ATOM 958 CE2 TRP A 148 -0.430 5.231 1.296 1.00 0.18 C ATOM 959 CE3 TRP A 148 1.040 3.352 0.890 1.00 0.31 C ATOM 960 CZ2 TRP A 148 -1.425 4.367 1.777 1.00 0.17 C ATOM 961 CZ3 TRP A 148 0.040 2.489 1.365 1.00 0.33 C ATOM 962 CH2 TRP A 148 -1.183 2.996 1.809 1.00 0.27 C ATOM 0 H TRP A 148 5.452 5.502 -0.033 1.00 0.32 H new ATOM 0 HA TRP A 148 3.788 7.864 0.278 1.00 0.33 H new ATOM 0 HB2 TRP A 148 3.070 6.060 -1.156 1.00 0.36 H new ATOM 0 HB3 TRP A 148 3.476 4.833 0.027 1.00 0.36 H new ATOM 0 HD1 TRP A 148 1.191 7.983 0.359 1.00 0.30 H new ATOM 0 HE1 TRP A 148 -1.083 7.258 1.364 1.00 0.23 H new ATOM 0 HE3 TRP A 148 1.984 2.948 0.556 1.00 0.31 H new ATOM 0 HZ2 TRP A 148 -2.370 4.762 2.119 1.00 0.17 H new ATOM 0 HZ3 TRP A 148 0.218 1.424 1.387 1.00 0.33 H new ATOM 0 HH2 TRP A 148 -1.943 2.323 2.178 1.00 0.27 H new ATOM 973 N LYS A 149 3.834 5.854 2.896 1.00 0.36 N ATOM 974 CA LYS A 149 3.511 5.865 4.356 1.00 0.38 C ATOM 975 C LYS A 149 4.324 6.953 5.087 1.00 0.34 C ATOM 976 O LYS A 149 3.828 7.595 5.992 1.00 0.33 O ATOM 977 CB LYS A 149 3.827 4.445 4.873 1.00 0.52 C ATOM 978 CG LYS A 149 5.338 4.183 4.885 1.00 1.36 C ATOM 979 CD LYS A 149 5.629 2.875 5.623 1.00 2.07 C ATOM 980 CE LYS A 149 5.157 1.690 4.778 1.00 2.80 C ATOM 981 NZ LYS A 149 6.003 0.545 5.215 1.00 3.70 N ATOM 0 H LYS A 149 4.218 4.978 2.542 1.00 0.36 H new ATOM 0 HA LYS A 149 2.465 6.110 4.541 1.00 0.38 H new ATOM 0 HB2 LYS A 149 3.426 4.324 5.879 1.00 0.52 H new ATOM 0 HB3 LYS A 149 3.332 3.707 4.242 1.00 0.52 H new ATOM 0 HG2 LYS A 149 5.715 4.127 3.864 1.00 1.36 H new ATOM 0 HG3 LYS A 149 5.856 5.009 5.372 1.00 1.36 H new ATOM 0 HD2 LYS A 149 6.697 2.789 5.823 1.00 2.07 H new ATOM 0 HD3 LYS A 149 5.123 2.870 6.588 1.00 2.07 H new ATOM 0 HE2 LYS A 149 4.099 1.485 4.942 1.00 2.80 H new ATOM 0 HE3 LYS A 149 5.282 1.889 3.714 1.00 2.80 H new ATOM 0 HZ1 LYS A 149 5.429 -0.322 5.238 1.00 3.70 H new ATOM 0 HZ2 LYS A 149 6.791 0.421 4.548 1.00 3.70 H new ATOM 0 HZ3 LYS A 149 6.381 0.735 6.165 1.00 3.70 H new ATOM 995 N ASN A 150 5.563 7.162 4.701 1.00 0.37 N ATOM 996 CA ASN A 150 6.406 8.207 5.377 1.00 0.41 C ATOM 997 C ASN A 150 5.799 9.607 5.223 1.00 0.39 C ATOM 998 O ASN A 150 5.726 10.360 6.176 1.00 0.46 O ATOM 999 CB ASN A 150 7.772 8.134 4.684 1.00 0.50 C ATOM 1000 CG ASN A 150 8.717 9.195 5.262 1.00 1.07 C ATOM 1001 OD1 ASN A 150 8.790 10.297 4.756 1.00 1.86 O ATOM 1002 ND2 ASN A 150 9.444 8.908 6.305 1.00 1.27 N ATOM 0 H ASN A 150 6.028 6.655 3.948 1.00 0.37 H new ATOM 0 HA ASN A 150 6.476 8.025 6.449 1.00 0.41 H new ATOM 0 HB2 ASN A 150 8.203 7.142 4.817 1.00 0.50 H new ATOM 0 HB3 ASN A 150 7.653 8.288 3.612 1.00 0.50 H new ATOM 0 HD21 ASN A 150 10.074 9.609 6.696 1.00 1.27 H new ATOM 0 HD22 ASN A 150 9.383 7.983 6.730 1.00 1.27 H new ATOM 1009 N ALA A 151 5.385 9.967 4.036 1.00 0.38 N ATOM 1010 CA ALA A 151 4.809 11.332 3.832 1.00 0.49 C ATOM 1011 C ALA A 151 3.510 11.481 4.626 1.00 0.53 C ATOM 1012 O ALA A 151 3.270 12.499 5.248 1.00 0.72 O ATOM 1013 CB ALA A 151 4.537 11.438 2.330 1.00 0.57 C ATOM 0 H ALA A 151 5.420 9.380 3.203 1.00 0.38 H new ATOM 0 HA ALA A 151 5.484 12.116 4.175 1.00 0.49 H new ATOM 0 HB1 ALA A 151 4.112 12.416 2.105 1.00 0.57 H new ATOM 0 HB2 ALA A 151 5.471 11.313 1.781 1.00 0.57 H new ATOM 0 HB3 ALA A 151 3.834 10.660 2.032 1.00 0.57 H new ATOM 1019 N GLU A 152 2.678 10.474 4.612 1.00 0.40 N ATOM 1020 CA GLU A 152 1.394 10.549 5.371 1.00 0.50 C ATOM 1021 C GLU A 152 1.641 10.433 6.880 1.00 0.60 C ATOM 1022 O GLU A 152 2.420 9.616 7.333 1.00 1.48 O ATOM 1023 CB GLU A 152 0.561 9.367 4.869 1.00 0.44 C ATOM 1024 CG GLU A 152 -0.386 9.839 3.760 1.00 0.77 C ATOM 1025 CD GLU A 152 0.318 9.760 2.401 1.00 1.10 C ATOM 1026 OE1 GLU A 152 1.531 9.890 2.371 1.00 1.81 O ATOM 1027 OE2 GLU A 152 -0.372 9.576 1.412 1.00 1.66 O ATOM 0 H GLU A 152 2.832 9.601 4.107 1.00 0.40 H new ATOM 0 HA GLU A 152 0.888 11.502 5.214 1.00 0.50 H new ATOM 0 HB2 GLU A 152 1.216 8.582 4.492 1.00 0.44 H new ATOM 0 HB3 GLU A 152 -0.011 8.937 5.691 1.00 0.44 H new ATOM 0 HG2 GLU A 152 -1.284 9.221 3.750 1.00 0.77 H new ATOM 0 HG3 GLU A 152 -0.705 10.863 3.954 1.00 0.77 H new ATOM 1034 N LYS A 153 0.947 11.223 7.656 1.00 0.76 N ATOM 1035 CA LYS A 153 1.087 11.147 9.150 1.00 0.67 C ATOM 1036 C LYS A 153 -0.210 10.558 9.718 1.00 0.64 C ATOM 1037 O LYS A 153 -0.328 9.356 9.871 1.00 0.57 O ATOM 1038 CB LYS A 153 1.359 12.577 9.695 1.00 0.86 C ATOM 1039 CG LYS A 153 0.758 13.679 8.802 1.00 1.17 C ATOM 1040 CD LYS A 153 0.667 14.986 9.594 1.00 1.57 C ATOM 1041 CE LYS A 153 0.213 16.115 8.667 1.00 2.22 C ATOM 1042 NZ LYS A 153 0.054 17.302 9.553 1.00 2.51 N ATOM 0 H LYS A 153 0.284 11.923 7.322 1.00 0.76 H new ATOM 0 HA LYS A 153 1.919 10.508 9.448 1.00 0.67 H new ATOM 0 HB2 LYS A 153 0.945 12.663 10.700 1.00 0.86 H new ATOM 0 HB3 LYS A 153 2.435 12.730 9.780 1.00 0.86 H new ATOM 0 HG2 LYS A 153 1.376 13.821 7.916 1.00 1.17 H new ATOM 0 HG3 LYS A 153 -0.232 13.382 8.456 1.00 1.17 H new ATOM 0 HD2 LYS A 153 -0.036 14.875 10.420 1.00 1.57 H new ATOM 0 HD3 LYS A 153 1.636 15.227 10.030 1.00 1.57 H new ATOM 0 HE2 LYS A 153 0.948 16.303 7.884 1.00 2.22 H new ATOM 0 HE3 LYS A 153 -0.725 15.865 8.170 1.00 2.22 H new ATOM 0 HZ1 LYS A 153 -0.256 18.118 8.988 1.00 2.51 H new ATOM 0 HZ2 LYS A 153 -0.657 17.097 10.284 1.00 2.51 H new ATOM 0 HZ3 LYS A 153 0.964 17.521 10.007 1.00 2.51 H new ATOM 1056 N LYS A 154 -1.202 11.376 9.990 1.00 0.73 N ATOM 1057 CA LYS A 154 -2.503 10.833 10.494 1.00 0.77 C ATOM 1058 C LYS A 154 -3.100 9.935 9.405 1.00 0.62 C ATOM 1059 O LYS A 154 -3.708 8.910 9.671 1.00 0.60 O ATOM 1060 CB LYS A 154 -3.395 12.051 10.737 1.00 0.95 C ATOM 1061 CG LYS A 154 -4.691 11.605 11.418 1.00 1.29 C ATOM 1062 CD LYS A 154 -5.585 12.821 11.662 1.00 1.34 C ATOM 1063 CE LYS A 154 -6.832 12.393 12.441 1.00 2.02 C ATOM 1064 NZ LYS A 154 -7.608 11.543 11.495 1.00 2.51 N ATOM 0 H LYS A 154 -1.166 12.390 9.885 1.00 0.73 H new ATOM 0 HA LYS A 154 -2.396 10.245 11.405 1.00 0.77 H new ATOM 0 HB2 LYS A 154 -2.875 12.778 11.361 1.00 0.95 H new ATOM 0 HB3 LYS A 154 -3.619 12.545 9.792 1.00 0.95 H new ATOM 0 HG2 LYS A 154 -5.211 10.878 10.794 1.00 1.29 H new ATOM 0 HG3 LYS A 154 -4.466 11.111 12.363 1.00 1.29 H new ATOM 0 HD2 LYS A 154 -5.038 13.581 12.220 1.00 1.34 H new ATOM 0 HD3 LYS A 154 -5.874 13.270 10.711 1.00 1.34 H new ATOM 0 HE2 LYS A 154 -6.564 11.838 13.340 1.00 2.02 H new ATOM 0 HE3 LYS A 154 -7.413 13.258 12.761 1.00 2.02 H new ATOM 0 HZ1 LYS A 154 -8.606 11.519 11.788 1.00 2.51 H new ATOM 0 HZ2 LYS A 154 -7.538 11.938 10.536 1.00 2.51 H new ATOM 0 HZ3 LYS A 154 -7.223 10.577 11.500 1.00 2.51 H new ATOM 1078 N ASN A 155 -2.890 10.311 8.167 1.00 0.57 N ATOM 1079 CA ASN A 155 -3.408 9.502 7.026 1.00 0.47 C ATOM 1080 C ASN A 155 -2.575 8.223 6.854 1.00 0.37 C ATOM 1081 O ASN A 155 -2.897 7.380 6.037 1.00 0.34 O ATOM 1082 CB ASN A 155 -3.248 10.396 5.793 1.00 0.51 C ATOM 1083 CG ASN A 155 -4.411 11.385 5.709 1.00 0.76 C ATOM 1084 OD1 ASN A 155 -4.724 12.057 6.671 1.00 1.37 O ATOM 1085 ND2 ASN A 155 -5.062 11.508 4.585 1.00 1.03 N ATOM 0 H ASN A 155 -2.377 11.151 7.899 1.00 0.57 H new ATOM 0 HA ASN A 155 -4.442 9.197 7.184 1.00 0.47 H new ATOM 0 HB2 ASN A 155 -2.303 10.937 5.846 1.00 0.51 H new ATOM 0 HB3 ASN A 155 -3.215 9.784 4.892 1.00 0.51 H new ATOM 0 HD21 ASN A 155 -5.835 12.169 4.513 1.00 1.03 H new ATOM 0 HD22 ASN A 155 -4.798 10.943 3.778 1.00 1.03 H new ATOM 1092 N ALA A 156 -1.520 8.055 7.629 1.00 0.37 N ATOM 1093 CA ALA A 156 -0.699 6.814 7.512 1.00 0.33 C ATOM 1094 C ALA A 156 -1.472 5.616 8.065 1.00 0.28 C ATOM 1095 O ALA A 156 -1.012 4.494 7.974 1.00 0.28 O ATOM 1096 CB ALA A 156 0.541 7.050 8.374 1.00 0.41 C ATOM 0 H ALA A 156 -1.200 8.723 8.330 1.00 0.37 H new ATOM 0 HA ALA A 156 -0.446 6.604 6.473 1.00 0.33 H new ATOM 0 HB1 ALA A 156 1.187 6.173 8.331 1.00 0.41 H new ATOM 0 HB2 ALA A 156 1.084 7.919 8.001 1.00 0.41 H new ATOM 0 HB3 ALA A 156 0.238 7.227 9.406 1.00 0.41 H new ATOM 1102 N SER A 157 -2.633 5.830 8.648 1.00 0.28 N ATOM 1103 CA SER A 157 -3.392 4.679 9.202 1.00 0.28 C ATOM 1104 C SER A 157 -4.238 4.027 8.113 1.00 0.22 C ATOM 1105 O SER A 157 -4.398 4.548 7.008 1.00 0.21 O ATOM 1106 CB SER A 157 -4.287 5.271 10.290 1.00 0.34 C ATOM 1107 OG SER A 157 -4.807 6.520 9.850 1.00 1.05 O ATOM 0 H SER A 157 -3.075 6.742 8.759 1.00 0.28 H new ATOM 0 HA SER A 157 -2.731 3.907 9.596 1.00 0.28 H new ATOM 0 HB2 SER A 157 -5.103 4.585 10.517 1.00 0.34 H new ATOM 0 HB3 SER A 157 -3.718 5.406 11.210 1.00 0.34 H new ATOM 0 HG SER A 157 -4.227 7.245 10.164 1.00 1.05 H new ATOM 1113 N VAL A 158 -4.776 2.877 8.415 1.00 0.23 N ATOM 1114 CA VAL A 158 -5.607 2.165 7.414 1.00 0.22 C ATOM 1115 C VAL A 158 -6.798 3.029 7.017 1.00 0.18 C ATOM 1116 O VAL A 158 -7.097 3.149 5.854 1.00 0.18 O ATOM 1117 CB VAL A 158 -6.072 0.869 8.080 1.00 0.28 C ATOM 1118 CG1 VAL A 158 -4.858 0.003 8.415 1.00 0.34 C ATOM 1119 CG2 VAL A 158 -6.857 1.169 9.364 1.00 0.27 C ATOM 0 H VAL A 158 -4.674 2.403 9.312 1.00 0.23 H new ATOM 0 HA VAL A 158 -5.045 1.951 6.505 1.00 0.22 H new ATOM 0 HB VAL A 158 -6.726 0.338 7.388 1.00 0.28 H new ATOM 0 HG11 VAL A 158 -5.190 -0.920 8.890 1.00 0.34 H new ATOM 0 HG12 VAL A 158 -4.316 -0.234 7.499 1.00 0.34 H new ATOM 0 HG13 VAL A 158 -4.201 0.545 9.095 1.00 0.34 H new ATOM 0 HG21 VAL A 158 -7.178 0.233 9.821 1.00 0.27 H new ATOM 0 HG22 VAL A 158 -6.220 1.714 10.061 1.00 0.27 H new ATOM 0 HG23 VAL A 158 -7.731 1.774 9.123 1.00 0.27 H new ATOM 1129 N ALA A 159 -7.459 3.659 7.972 1.00 0.15 N ATOM 1130 CA ALA A 159 -8.634 4.545 7.647 1.00 0.13 C ATOM 1131 C ALA A 159 -8.310 5.438 6.451 1.00 0.13 C ATOM 1132 O ALA A 159 -9.162 5.738 5.633 1.00 0.15 O ATOM 1133 CB ALA A 159 -8.863 5.390 8.900 1.00 0.12 C ATOM 0 H ALA A 159 -7.233 3.596 8.965 1.00 0.15 H new ATOM 0 HA ALA A 159 -9.519 3.967 7.382 1.00 0.13 H new ATOM 0 HB1 ALA A 159 -9.706 6.061 8.737 1.00 0.12 H new ATOM 0 HB2 ALA A 159 -9.078 4.736 9.745 1.00 0.12 H new ATOM 0 HB3 ALA A 159 -7.969 5.976 9.112 1.00 0.12 H new ATOM 1139 N GLY A 160 -7.065 5.812 6.327 1.00 0.13 N ATOM 1140 CA GLY A 160 -6.656 6.638 5.166 1.00 0.15 C ATOM 1141 C GLY A 160 -6.714 5.779 3.909 1.00 0.16 C ATOM 1142 O GLY A 160 -7.515 6.015 3.024 1.00 0.18 O ATOM 0 H GLY A 160 -6.318 5.579 6.981 1.00 0.13 H new ATOM 0 HA2 GLY A 160 -7.315 7.500 5.065 1.00 0.15 H new ATOM 0 HA3 GLY A 160 -5.647 7.024 5.314 1.00 0.15 H new ATOM 1146 N LEU A 161 -5.856 4.790 3.814 1.00 0.16 N ATOM 1147 CA LEU A 161 -5.856 3.924 2.593 1.00 0.18 C ATOM 1148 C LEU A 161 -7.182 3.153 2.411 1.00 0.20 C ATOM 1149 O LEU A 161 -7.700 3.087 1.312 1.00 0.28 O ATOM 1150 CB LEU A 161 -4.702 2.941 2.778 1.00 0.19 C ATOM 1151 CG LEU A 161 -4.583 2.067 1.521 1.00 0.22 C ATOM 1152 CD1 LEU A 161 -3.838 2.830 0.417 1.00 0.23 C ATOM 1153 CD2 LEU A 161 -3.844 0.764 1.864 1.00 0.27 C ATOM 0 H LEU A 161 -5.163 4.547 4.522 1.00 0.16 H new ATOM 0 HA LEU A 161 -5.744 4.539 1.700 1.00 0.18 H new ATOM 0 HB2 LEU A 161 -3.771 3.481 2.950 1.00 0.19 H new ATOM 0 HB3 LEU A 161 -4.876 2.317 3.655 1.00 0.19 H new ATOM 0 HG LEU A 161 -5.581 1.822 1.159 1.00 0.22 H new ATOM 0 HD11 LEU A 161 -3.759 2.201 -0.470 1.00 0.23 H new ATOM 0 HD12 LEU A 161 -4.386 3.739 0.170 1.00 0.23 H new ATOM 0 HD13 LEU A 161 -2.839 3.092 0.766 1.00 0.23 H new ATOM 0 HD21 LEU A 161 -3.761 0.146 0.970 1.00 0.27 H new ATOM 0 HD22 LEU A 161 -2.847 0.998 2.236 1.00 0.27 H new ATOM 0 HD23 LEU A 161 -4.399 0.222 2.630 1.00 0.27 H new ATOM 1165 N VAL A 162 -7.717 2.532 3.447 1.00 0.22 N ATOM 1166 CA VAL A 162 -8.978 1.732 3.263 1.00 0.26 C ATOM 1167 C VAL A 162 -10.085 2.607 2.697 1.00 0.29 C ATOM 1168 O VAL A 162 -10.824 2.196 1.821 1.00 0.34 O ATOM 1169 CB VAL A 162 -9.362 1.178 4.644 1.00 0.30 C ATOM 1170 CG1 VAL A 162 -8.201 0.367 5.221 1.00 0.30 C ATOM 1171 CG2 VAL A 162 -9.726 2.301 5.621 1.00 0.31 C ATOM 0 H VAL A 162 -7.341 2.545 4.395 1.00 0.22 H new ATOM 0 HA VAL A 162 -8.825 0.917 2.555 1.00 0.26 H new ATOM 0 HB VAL A 162 -10.236 0.540 4.512 1.00 0.30 H new ATOM 0 HG11 VAL A 162 -8.480 -0.023 6.200 1.00 0.30 H new ATOM 0 HG12 VAL A 162 -7.969 -0.463 4.553 1.00 0.30 H new ATOM 0 HG13 VAL A 162 -7.325 1.007 5.322 1.00 0.30 H new ATOM 0 HG21 VAL A 162 -9.992 1.871 6.587 1.00 0.31 H new ATOM 0 HG22 VAL A 162 -8.872 2.968 5.743 1.00 0.31 H new ATOM 0 HG23 VAL A 162 -10.573 2.864 5.229 1.00 0.31 H new ATOM 1181 N LYS A 163 -10.185 3.812 3.168 1.00 0.29 N ATOM 1182 CA LYS A 163 -11.227 4.732 2.635 1.00 0.34 C ATOM 1183 C LYS A 163 -10.975 4.988 1.144 1.00 0.36 C ATOM 1184 O LYS A 163 -11.846 4.821 0.314 1.00 0.39 O ATOM 1185 CB LYS A 163 -11.077 6.019 3.452 1.00 0.33 C ATOM 1186 CG LYS A 163 -12.111 7.047 2.987 1.00 0.39 C ATOM 1187 CD LYS A 163 -11.964 8.329 3.808 1.00 1.30 C ATOM 1188 CE LYS A 163 -12.991 9.356 3.330 1.00 1.51 C ATOM 1189 NZ LYS A 163 -12.733 10.571 4.153 1.00 2.30 N ATOM 0 H LYS A 163 -9.592 4.203 3.900 1.00 0.29 H new ATOM 0 HA LYS A 163 -12.234 4.325 2.720 1.00 0.34 H new ATOM 0 HB2 LYS A 163 -11.213 5.806 4.512 1.00 0.33 H new ATOM 0 HB3 LYS A 163 -10.071 6.421 3.334 1.00 0.33 H new ATOM 0 HG2 LYS A 163 -11.973 7.264 1.928 1.00 0.39 H new ATOM 0 HG3 LYS A 163 -13.117 6.643 3.101 1.00 0.39 H new ATOM 0 HD2 LYS A 163 -12.112 8.115 4.867 1.00 1.30 H new ATOM 0 HD3 LYS A 163 -10.956 8.729 3.701 1.00 1.30 H new ATOM 0 HE2 LYS A 163 -12.873 9.567 2.267 1.00 1.51 H new ATOM 0 HE3 LYS A 163 -14.009 8.992 3.472 1.00 1.51 H new ATOM 0 HZ1 LYS A 163 -13.400 11.322 3.882 1.00 2.30 H new ATOM 0 HZ2 LYS A 163 -12.859 10.342 5.160 1.00 2.30 H new ATOM 0 HZ3 LYS A 163 -11.759 10.899 3.992 1.00 2.30 H new ATOM 1203 N ALA A 164 -9.779 5.400 0.814 1.00 0.36 N ATOM 1204 CA ALA A 164 -9.432 5.690 -0.613 1.00 0.39 C ATOM 1205 C ALA A 164 -9.454 4.435 -1.500 1.00 0.39 C ATOM 1206 O ALA A 164 -10.040 4.441 -2.567 1.00 0.33 O ATOM 1207 CB ALA A 164 -8.021 6.280 -0.571 1.00 0.44 C ATOM 0 H ALA A 164 -9.019 5.550 1.477 1.00 0.36 H new ATOM 0 HA ALA A 164 -10.165 6.367 -1.051 1.00 0.39 H new ATOM 0 HB1 ALA A 164 -7.696 6.519 -1.584 1.00 0.44 H new ATOM 0 HB2 ALA A 164 -8.024 7.188 0.033 1.00 0.44 H new ATOM 0 HB3 ALA A 164 -7.336 5.554 -0.132 1.00 0.44 H new ATOM 1213 N LEU A 165 -8.775 3.381 -1.103 1.00 0.50 N ATOM 1214 CA LEU A 165 -8.713 2.160 -1.973 1.00 0.55 C ATOM 1215 C LEU A 165 -10.103 1.570 -2.271 1.00 0.45 C ATOM 1216 O LEU A 165 -10.392 1.230 -3.404 1.00 0.42 O ATOM 1217 CB LEU A 165 -7.779 1.155 -1.253 1.00 0.80 C ATOM 1218 CG LEU A 165 -8.393 0.595 0.044 1.00 0.52 C ATOM 1219 CD1 LEU A 165 -9.357 -0.558 -0.272 1.00 1.47 C ATOM 1220 CD2 LEU A 165 -7.257 0.064 0.939 1.00 1.24 C ATOM 0 H LEU A 165 -8.265 3.314 -0.222 1.00 0.50 H new ATOM 0 HA LEU A 165 -8.318 2.412 -2.957 1.00 0.55 H new ATOM 0 HB2 LEU A 165 -7.551 0.330 -1.928 1.00 0.80 H new ATOM 0 HB3 LEU A 165 -6.834 1.646 -1.020 1.00 0.80 H new ATOM 0 HG LEU A 165 -8.944 1.388 0.550 1.00 0.52 H new ATOM 0 HD11 LEU A 165 -9.782 -0.942 0.656 1.00 1.47 H new ATOM 0 HD12 LEU A 165 -10.159 -0.196 -0.916 1.00 1.47 H new ATOM 0 HD13 LEU A 165 -8.816 -1.356 -0.781 1.00 1.47 H new ATOM 0 HD21 LEU A 165 -7.677 -0.336 1.862 1.00 1.24 H new ATOM 0 HD22 LEU A 165 -6.719 -0.725 0.414 1.00 1.24 H new ATOM 0 HD23 LEU A 165 -6.570 0.877 1.176 1.00 1.24 H new ATOM 1232 N ARG A 166 -10.958 1.426 -1.294 1.00 0.47 N ATOM 1233 CA ARG A 166 -12.310 0.835 -1.565 1.00 0.45 C ATOM 1234 C ARG A 166 -13.190 1.787 -2.380 1.00 0.41 C ATOM 1235 O ARG A 166 -13.932 1.362 -3.248 1.00 0.52 O ATOM 1236 CB ARG A 166 -12.924 0.549 -0.191 1.00 0.52 C ATOM 1237 CG ARG A 166 -14.318 -0.062 -0.373 1.00 1.19 C ATOM 1238 CD ARG A 166 -14.935 -0.366 0.991 1.00 1.53 C ATOM 1239 NE ARG A 166 -16.338 -0.761 0.689 1.00 2.29 N ATOM 1240 CZ ARG A 166 -17.293 0.125 0.766 1.00 2.88 C ATOM 1241 NH1 ARG A 166 -17.492 0.959 -0.219 1.00 3.60 N ATOM 1242 NH2 ARG A 166 -18.048 0.180 1.828 1.00 3.25 N ATOM 0 H ARG A 166 -10.785 1.689 -0.324 1.00 0.47 H new ATOM 0 HA ARG A 166 -12.229 -0.073 -2.162 1.00 0.45 H new ATOM 0 HB2 ARG A 166 -12.286 -0.134 0.370 1.00 0.52 H new ATOM 0 HB3 ARG A 166 -12.991 1.470 0.388 1.00 0.52 H new ATOM 0 HG2 ARG A 166 -14.957 0.627 -0.925 1.00 1.19 H new ATOM 0 HG3 ARG A 166 -14.250 -0.976 -0.963 1.00 1.19 H new ATOM 0 HD2 ARG A 166 -14.398 -1.167 1.499 1.00 1.53 H new ATOM 0 HD3 ARG A 166 -14.901 0.505 1.645 1.00 1.53 H new ATOM 0 HE ARG A 166 -16.552 -1.722 0.422 1.00 2.29 H new ATOM 0 HH11 ARG A 166 -16.901 0.918 -1.049 1.00 3.60 H new ATOM 0 HH12 ARG A 166 -18.239 1.651 -0.158 1.00 3.60 H new ATOM 0 HH21 ARG A 166 -17.892 -0.470 2.599 1.00 3.25 H new ATOM 0 HH22 ARG A 166 -18.794 0.873 1.888 1.00 3.25 H new ATOM 1256 N THR A 167 -13.133 3.061 -2.096 1.00 0.33 N ATOM 1257 CA THR A 167 -13.991 4.035 -2.842 1.00 0.36 C ATOM 1258 C THR A 167 -13.669 3.990 -4.332 1.00 0.35 C ATOM 1259 O THR A 167 -14.550 4.075 -5.169 1.00 0.41 O ATOM 1260 CB THR A 167 -13.635 5.407 -2.265 1.00 0.42 C ATOM 1261 OG1 THR A 167 -13.918 5.419 -0.874 1.00 0.44 O ATOM 1262 CG2 THR A 167 -14.452 6.502 -2.958 1.00 0.47 C ATOM 0 H THR A 167 -12.532 3.471 -1.382 1.00 0.33 H new ATOM 0 HA THR A 167 -15.052 3.809 -2.736 1.00 0.36 H new ATOM 0 HB THR A 167 -12.575 5.597 -2.430 1.00 0.42 H new ATOM 0 HG1 THR A 167 -13.105 5.198 -0.373 1.00 0.44 H new ATOM 0 HG21 THR A 167 -14.189 7.473 -2.538 1.00 0.47 H new ATOM 0 HG22 THR A 167 -14.234 6.498 -4.026 1.00 0.47 H new ATOM 0 HG23 THR A 167 -15.515 6.316 -2.804 1.00 0.47 H new ATOM 1270 N CYS A 168 -12.415 3.877 -4.664 1.00 0.32 N ATOM 1271 CA CYS A 168 -12.026 3.849 -6.099 1.00 0.36 C ATOM 1272 C CYS A 168 -12.302 2.477 -6.725 1.00 0.31 C ATOM 1273 O CYS A 168 -13.001 2.381 -7.716 1.00 0.34 O ATOM 1274 CB CYS A 168 -10.526 4.146 -6.105 1.00 0.40 C ATOM 1275 SG CYS A 168 -10.265 5.926 -5.902 1.00 1.38 S ATOM 0 H CYS A 168 -11.642 3.803 -4.003 1.00 0.32 H new ATOM 0 HA CYS A 168 -12.597 4.570 -6.684 1.00 0.36 H new ATOM 0 HB2 CYS A 168 -10.033 3.601 -5.300 1.00 0.40 H new ATOM 0 HB3 CYS A 168 -10.080 3.806 -7.040 1.00 0.40 H new ATOM 0 HG CYS A 168 -8.990 6.181 -5.904 1.00 1.38 H new ATOM 1281 N ARG A 169 -11.763 1.410 -6.165 1.00 0.30 N ATOM 1282 CA ARG A 169 -12.011 0.033 -6.767 1.00 0.31 C ATOM 1283 C ARG A 169 -11.311 -1.114 -6.011 1.00 0.26 C ATOM 1284 O ARG A 169 -11.541 -2.272 -6.309 1.00 0.34 O ATOM 1285 CB ARG A 169 -11.459 0.084 -8.205 1.00 0.44 C ATOM 1286 CG ARG A 169 -12.367 -0.736 -9.125 1.00 0.69 C ATOM 1287 CD ARG A 169 -11.986 -0.483 -10.585 1.00 0.84 C ATOM 1288 NE ARG A 169 -13.161 -0.951 -11.373 1.00 1.56 N ATOM 1289 CZ ARG A 169 -13.794 -0.120 -12.156 1.00 2.15 C ATOM 1290 NH1 ARG A 169 -13.275 0.221 -13.304 1.00 2.73 N ATOM 1291 NH2 ARG A 169 -14.948 0.370 -11.790 1.00 2.74 N ATOM 0 H ARG A 169 -11.172 1.422 -5.334 1.00 0.30 H new ATOM 0 HA ARG A 169 -13.079 -0.179 -6.715 1.00 0.31 H new ATOM 0 HB2 ARG A 169 -11.408 1.116 -8.551 1.00 0.44 H new ATOM 0 HB3 ARG A 169 -10.443 -0.311 -8.231 1.00 0.44 H new ATOM 0 HG2 ARG A 169 -12.273 -1.797 -8.893 1.00 0.69 H new ATOM 0 HG3 ARG A 169 -13.410 -0.465 -8.959 1.00 0.69 H new ATOM 0 HD2 ARG A 169 -11.785 0.573 -10.764 1.00 0.84 H new ATOM 0 HD3 ARG A 169 -11.083 -1.030 -10.858 1.00 0.84 H new ATOM 0 HE ARG A 169 -13.471 -1.920 -11.301 1.00 1.56 H new ATOM 0 HH11 ARG A 169 -12.374 -0.162 -13.590 1.00 2.73 H new ATOM 0 HH12 ARG A 169 -13.770 0.870 -13.915 1.00 2.73 H new ATOM 0 HH21 ARG A 169 -15.354 0.103 -10.893 1.00 2.74 H new ATOM 0 HH22 ARG A 169 -15.443 1.019 -12.401 1.00 2.74 H new ATOM 1305 N LEU A 170 -10.438 -0.821 -5.088 1.00 0.20 N ATOM 1306 CA LEU A 170 -9.696 -1.908 -4.378 1.00 0.17 C ATOM 1307 C LEU A 170 -10.549 -2.562 -3.283 1.00 0.19 C ATOM 1308 O LEU A 170 -10.184 -2.587 -2.125 1.00 0.23 O ATOM 1309 CB LEU A 170 -8.491 -1.189 -3.777 1.00 0.18 C ATOM 1310 CG LEU A 170 -7.592 -0.655 -4.903 1.00 0.21 C ATOM 1311 CD1 LEU A 170 -7.614 0.876 -4.915 1.00 0.26 C ATOM 1312 CD2 LEU A 170 -6.157 -1.117 -4.663 1.00 0.25 C ATOM 0 H LEU A 170 -10.204 0.126 -4.792 1.00 0.20 H new ATOM 0 HA LEU A 170 -9.418 -2.723 -5.046 1.00 0.17 H new ATOM 0 HB2 LEU A 170 -8.825 -0.367 -3.144 1.00 0.18 H new ATOM 0 HB3 LEU A 170 -7.927 -1.872 -3.142 1.00 0.18 H new ATOM 0 HG LEU A 170 -7.960 -1.033 -5.857 1.00 0.21 H new ATOM 0 HD11 LEU A 170 -6.973 1.243 -5.717 1.00 0.26 H new ATOM 0 HD12 LEU A 170 -8.634 1.224 -5.077 1.00 0.26 H new ATOM 0 HD13 LEU A 170 -7.250 1.253 -3.959 1.00 0.26 H new ATOM 0 HD21 LEU A 170 -5.515 -0.740 -5.460 1.00 0.25 H new ATOM 0 HD22 LEU A 170 -5.807 -0.735 -3.704 1.00 0.25 H new ATOM 0 HD23 LEU A 170 -6.122 -2.206 -4.654 1.00 0.25 H new ATOM 1324 N ASN A 171 -11.677 -3.100 -3.652 1.00 0.24 N ATOM 1325 CA ASN A 171 -12.567 -3.766 -2.652 1.00 0.30 C ATOM 1326 C ASN A 171 -11.834 -4.920 -1.951 1.00 0.24 C ATOM 1327 O ASN A 171 -12.076 -5.202 -0.792 1.00 0.25 O ATOM 1328 CB ASN A 171 -13.735 -4.315 -3.470 1.00 0.40 C ATOM 1329 CG ASN A 171 -14.999 -4.294 -2.618 1.00 0.50 C ATOM 1330 OD1 ASN A 171 -15.493 -5.324 -2.203 1.00 0.58 O ATOM 1331 ND2 ASN A 171 -15.545 -3.144 -2.345 1.00 0.59 N ATOM 0 H ASN A 171 -12.026 -3.109 -4.610 1.00 0.24 H new ATOM 0 HA ASN A 171 -12.888 -3.074 -1.873 1.00 0.30 H new ATOM 0 HB2 ASN A 171 -13.878 -3.715 -4.369 1.00 0.40 H new ATOM 0 HB3 ASN A 171 -13.519 -5.332 -3.796 1.00 0.40 H new ATOM 0 HD21 ASN A 171 -16.393 -3.103 -1.779 1.00 0.59 H new ATOM 0 HD22 ASN A 171 -15.125 -2.284 -2.697 1.00 0.59 H new ATOM 1338 N LEU A 172 -10.962 -5.609 -2.653 1.00 0.21 N ATOM 1339 CA LEU A 172 -10.237 -6.772 -2.033 1.00 0.21 C ATOM 1340 C LEU A 172 -9.549 -6.380 -0.729 1.00 0.17 C ATOM 1341 O LEU A 172 -9.884 -6.869 0.331 1.00 0.21 O ATOM 1342 CB LEU A 172 -9.155 -7.158 -3.042 1.00 0.23 C ATOM 1343 CG LEU A 172 -9.789 -7.816 -4.264 1.00 0.32 C ATOM 1344 CD1 LEU A 172 -8.740 -7.945 -5.370 1.00 1.13 C ATOM 1345 CD2 LEU A 172 -10.293 -9.209 -3.882 1.00 0.85 C ATOM 0 H LEU A 172 -10.720 -5.418 -3.625 1.00 0.21 H new ATOM 0 HA LEU A 172 -10.937 -7.577 -1.808 1.00 0.21 H new ATOM 0 HB2 LEU A 172 -8.596 -6.272 -3.345 1.00 0.23 H new ATOM 0 HB3 LEU A 172 -8.443 -7.841 -2.580 1.00 0.23 H new ATOM 0 HG LEU A 172 -10.622 -7.208 -4.617 1.00 0.32 H new ATOM 0 HD11 LEU A 172 -9.190 -8.415 -6.245 1.00 1.13 H new ATOM 0 HD12 LEU A 172 -8.371 -6.955 -5.639 1.00 1.13 H new ATOM 0 HD13 LEU A 172 -7.911 -8.557 -5.015 1.00 1.13 H new ATOM 0 HD21 LEU A 172 -10.747 -9.683 -4.752 1.00 0.85 H new ATOM 0 HD22 LEU A 172 -9.457 -9.815 -3.533 1.00 0.85 H new ATOM 0 HD23 LEU A 172 -11.035 -9.122 -3.088 1.00 0.85 H new ATOM 1357 N VAL A 173 -8.590 -5.500 -0.808 1.00 0.16 N ATOM 1358 CA VAL A 173 -7.859 -5.078 0.420 1.00 0.21 C ATOM 1359 C VAL A 173 -8.816 -4.397 1.392 1.00 0.22 C ATOM 1360 O VAL A 173 -8.638 -4.458 2.594 1.00 0.25 O ATOM 1361 CB VAL A 173 -6.760 -4.130 -0.062 1.00 0.29 C ATOM 1362 CG1 VAL A 173 -5.775 -4.923 -0.923 1.00 0.38 C ATOM 1363 CG2 VAL A 173 -7.346 -2.982 -0.895 1.00 0.34 C ATOM 0 H VAL A 173 -8.280 -5.054 -1.671 1.00 0.16 H new ATOM 0 HA VAL A 173 -7.429 -5.921 0.960 1.00 0.21 H new ATOM 0 HB VAL A 173 -6.259 -3.702 0.806 1.00 0.29 H new ATOM 0 HG11 VAL A 173 -4.984 -4.261 -1.275 1.00 0.38 H new ATOM 0 HG12 VAL A 173 -5.338 -5.726 -0.330 1.00 0.38 H new ATOM 0 HG13 VAL A 173 -6.300 -5.348 -1.779 1.00 0.38 H new ATOM 0 HG21 VAL A 173 -6.542 -2.324 -1.224 1.00 0.34 H new ATOM 0 HG22 VAL A 173 -7.860 -3.390 -1.765 1.00 0.34 H new ATOM 0 HG23 VAL A 173 -8.053 -2.416 -0.288 1.00 0.34 H new ATOM 1373 N ALA A 174 -9.849 -3.780 0.882 1.00 0.27 N ATOM 1374 CA ALA A 174 -10.853 -3.124 1.776 1.00 0.34 C ATOM 1375 C ALA A 174 -11.460 -4.184 2.704 1.00 0.29 C ATOM 1376 O ALA A 174 -11.598 -3.984 3.895 1.00 0.32 O ATOM 1377 CB ALA A 174 -11.917 -2.561 0.832 1.00 0.43 C ATOM 0 H ALA A 174 -10.043 -3.701 -0.116 1.00 0.27 H new ATOM 0 HA ALA A 174 -10.422 -2.343 2.402 1.00 0.34 H new ATOM 0 HB1 ALA A 174 -12.692 -2.062 1.414 1.00 0.43 H new ATOM 0 HB2 ALA A 174 -11.457 -1.845 0.151 1.00 0.43 H new ATOM 0 HB3 ALA A 174 -12.361 -3.374 0.258 1.00 0.43 H new ATOM 1383 N ASP A 175 -11.802 -5.321 2.158 1.00 0.24 N ATOM 1384 CA ASP A 175 -12.367 -6.420 2.998 1.00 0.23 C ATOM 1385 C ASP A 175 -11.333 -6.867 4.041 1.00 0.17 C ATOM 1386 O ASP A 175 -11.664 -7.143 5.178 1.00 0.20 O ATOM 1387 CB ASP A 175 -12.674 -7.557 2.020 1.00 0.27 C ATOM 1388 CG ASP A 175 -13.862 -7.175 1.129 1.00 0.37 C ATOM 1389 OD1 ASP A 175 -14.692 -6.398 1.573 1.00 0.80 O ATOM 1390 OD2 ASP A 175 -13.920 -7.668 0.013 1.00 0.99 O ATOM 0 H ASP A 175 -11.715 -5.537 1.165 1.00 0.24 H new ATOM 0 HA ASP A 175 -13.257 -6.108 3.544 1.00 0.23 H new ATOM 0 HB2 ASP A 175 -11.799 -7.765 1.404 1.00 0.27 H new ATOM 0 HB3 ASP A 175 -12.900 -8.470 2.570 1.00 0.27 H new ATOM 1395 N LEU A 176 -10.082 -6.944 3.650 1.00 0.14 N ATOM 1396 CA LEU A 176 -9.011 -7.385 4.606 1.00 0.20 C ATOM 1397 C LEU A 176 -8.910 -6.429 5.789 1.00 0.25 C ATOM 1398 O LEU A 176 -9.059 -6.819 6.932 1.00 0.27 O ATOM 1399 CB LEU A 176 -7.707 -7.327 3.795 1.00 0.28 C ATOM 1400 CG LEU A 176 -7.437 -8.648 3.059 1.00 0.49 C ATOM 1401 CD1 LEU A 176 -8.672 -9.100 2.283 1.00 1.33 C ATOM 1402 CD2 LEU A 176 -6.294 -8.429 2.077 1.00 1.09 C ATOM 0 H LEU A 176 -9.755 -6.721 2.710 1.00 0.14 H new ATOM 0 HA LEU A 176 -9.220 -8.377 5.008 1.00 0.20 H new ATOM 0 HB2 LEU A 176 -7.764 -6.513 3.073 1.00 0.28 H new ATOM 0 HB3 LEU A 176 -6.874 -7.105 4.461 1.00 0.28 H new ATOM 0 HG LEU A 176 -7.183 -9.416 3.790 1.00 0.49 H new ATOM 0 HD11 LEU A 176 -8.457 -10.037 1.770 1.00 1.33 H new ATOM 0 HD12 LEU A 176 -9.502 -9.247 2.974 1.00 1.33 H new ATOM 0 HD13 LEU A 176 -8.940 -8.339 1.550 1.00 1.33 H new ATOM 0 HD21 LEU A 176 -6.088 -9.358 1.545 1.00 1.09 H new ATOM 0 HD22 LEU A 176 -6.572 -7.655 1.362 1.00 1.09 H new ATOM 0 HD23 LEU A 176 -5.402 -8.117 2.620 1.00 1.09 H new ATOM 1414 N VAL A 177 -8.652 -5.179 5.515 1.00 0.33 N ATOM 1415 CA VAL A 177 -8.535 -4.177 6.613 1.00 0.41 C ATOM 1416 C VAL A 177 -9.865 -4.085 7.365 1.00 0.37 C ATOM 1417 O VAL A 177 -9.899 -3.985 8.575 1.00 0.39 O ATOM 1418 CB VAL A 177 -8.192 -2.847 5.926 1.00 0.52 C ATOM 1419 CG1 VAL A 177 -6.856 -2.981 5.189 1.00 0.58 C ATOM 1420 CG2 VAL A 177 -9.289 -2.473 4.921 1.00 0.52 C ATOM 0 H VAL A 177 -8.517 -4.807 4.575 1.00 0.33 H new ATOM 0 HA VAL A 177 -7.771 -4.445 7.343 1.00 0.41 H new ATOM 0 HB VAL A 177 -8.119 -2.067 6.684 1.00 0.52 H new ATOM 0 HG11 VAL A 177 -6.613 -2.037 4.702 1.00 0.58 H new ATOM 0 HG12 VAL A 177 -6.071 -3.234 5.902 1.00 0.58 H new ATOM 0 HG13 VAL A 177 -6.932 -3.768 4.438 1.00 0.58 H new ATOM 0 HG21 VAL A 177 -9.035 -1.528 4.440 1.00 0.52 H new ATOM 0 HG22 VAL A 177 -9.372 -3.254 4.165 1.00 0.52 H new ATOM 0 HG23 VAL A 177 -10.241 -2.370 5.443 1.00 0.52 H new ATOM 1430 N GLU A 178 -10.960 -4.134 6.650 1.00 0.36 N ATOM 1431 CA GLU A 178 -12.299 -4.069 7.312 1.00 0.39 C ATOM 1432 C GLU A 178 -12.489 -5.263 8.260 1.00 0.31 C ATOM 1433 O GLU A 178 -12.753 -5.102 9.438 1.00 0.34 O ATOM 1434 CB GLU A 178 -13.296 -4.117 6.140 1.00 0.45 C ATOM 1435 CG GLU A 178 -14.718 -4.410 6.639 1.00 0.51 C ATOM 1436 CD GLU A 178 -15.741 -4.212 5.510 1.00 1.32 C ATOM 1437 OE1 GLU A 178 -15.332 -3.973 4.383 1.00 1.85 O ATOM 1438 OE2 GLU A 178 -16.924 -4.300 5.796 1.00 1.85 O ATOM 0 H GLU A 178 -10.985 -4.216 5.634 1.00 0.36 H new ATOM 0 HA GLU A 178 -12.429 -3.178 7.926 1.00 0.39 H new ATOM 0 HB2 GLU A 178 -13.282 -3.166 5.607 1.00 0.45 H new ATOM 0 HB3 GLU A 178 -12.991 -4.885 5.429 1.00 0.45 H new ATOM 0 HG2 GLU A 178 -14.774 -5.433 7.012 1.00 0.51 H new ATOM 0 HG3 GLU A 178 -14.959 -3.752 7.474 1.00 0.51 H new ATOM 1445 N GLU A 179 -12.363 -6.453 7.741 1.00 0.25 N ATOM 1446 CA GLU A 179 -12.554 -7.673 8.583 1.00 0.24 C ATOM 1447 C GLU A 179 -11.553 -7.695 9.736 1.00 0.25 C ATOM 1448 O GLU A 179 -11.885 -8.067 10.847 1.00 0.39 O ATOM 1449 CB GLU A 179 -12.322 -8.850 7.632 1.00 0.31 C ATOM 1450 CG GLU A 179 -13.489 -8.942 6.643 1.00 1.03 C ATOM 1451 CD GLU A 179 -13.281 -10.117 5.676 1.00 1.32 C ATOM 1452 OE1 GLU A 179 -12.196 -10.681 5.664 1.00 1.92 O ATOM 1453 OE2 GLU A 179 -14.214 -10.429 4.954 1.00 1.76 O ATOM 0 H GLU A 179 -12.135 -6.636 6.764 1.00 0.25 H new ATOM 0 HA GLU A 179 -13.544 -7.708 9.038 1.00 0.24 H new ATOM 0 HB2 GLU A 179 -11.384 -8.717 7.093 1.00 0.31 H new ATOM 0 HB3 GLU A 179 -12.236 -9.778 8.198 1.00 0.31 H new ATOM 0 HG2 GLU A 179 -14.425 -9.071 7.186 1.00 1.03 H new ATOM 0 HG3 GLU A 179 -13.572 -8.011 6.082 1.00 1.03 H new ATOM 1460 N ALA A 180 -10.336 -7.304 9.482 1.00 0.26 N ATOM 1461 CA ALA A 180 -9.306 -7.299 10.565 1.00 0.38 C ATOM 1462 C ALA A 180 -9.654 -6.264 11.646 1.00 0.44 C ATOM 1463 O ALA A 180 -9.396 -6.474 12.817 1.00 0.60 O ATOM 1464 CB ALA A 180 -7.994 -6.940 9.863 1.00 0.50 C ATOM 0 H ALA A 180 -10.007 -6.987 8.570 1.00 0.26 H new ATOM 0 HA ALA A 180 -9.244 -8.260 11.075 1.00 0.38 H new ATOM 0 HB1 ALA A 180 -7.185 -6.916 10.593 1.00 0.50 H new ATOM 0 HB2 ALA A 180 -7.773 -7.687 9.101 1.00 0.50 H new ATOM 0 HB3 ALA A 180 -8.089 -5.961 9.394 1.00 0.50 H new