USER MOD reduce.3.24.130724 H: found=0, std=0, add=729, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 732 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 GLN : amide:sc= -10.5! C(o=-9.3!,f=-13!) USER MOD Set 1.2: A 192 LYS NZ :NH3+ 147:sc= 1.17 (180deg=-0.856) USER MOD Single : A 113 THR OG1 : rot 32:sc= 0.0645 USER MOD Single : A 123 SER OG : rot -159:sc= 0.00286 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0.0614 (180deg=0.0614) USER MOD Single : A 139 GLN : amide:sc= -1.35 K(o=-1.4,f=-0.67) USER MOD Single : A 148 THR OG1 : rot 123:sc= 0.844 USER MOD Single : A 150 THR OG1 : rot 180:sc= 0 USER MOD Single : A 152 CYS SG : rot 172:sc= -0.102 USER MOD Single : A 160 GLN : amide:sc= -2.67! C(o=-2.7!,f=-3.2!) USER MOD Single : A 161 GLN : amide:sc= -1.58 K(o=-1.6,f=-0.027) USER MOD Single : A 167 TYR OH : rot 180:sc= 0 USER MOD Single : A 171 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 172 SER OG : rot 142:sc= 0.677 USER MOD Single : A 173 SER OG : rot 180:sc=-0.00171 USER MOD Single : A 174 CYS SG : rot 111:sc= -5.17! USER MOD Single : A 176 LYS NZ :NH3+ 143:sc= -0.159 (180deg=-2.63!) USER MOD Single : A 178 GLN : amide:sc= -4.67! C(o=-4.7!,f=-4.7!) USER MOD Single : A 179 THR OG1 : rot 180:sc= 0 USER MOD Single : A 181 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 183 SER OG : rot 180:sc= 0.00322 USER MOD Single : A 186 HIS : no HE2:sc= -2.11 K(o=-2.1,f=-2.9!) USER MOD Single : A 188 THR OG1 : rot -160:sc= -3.56! USER MOD Single : A 191 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 195 MET CE :methyl 143:sc= -0.869 (180deg=-2.01!) USER MOD Single : A 197 THR OG1 : rot 35:sc= 0.557 USER MOD Single : A 200 SER OG : rot 180:sc= -0.117 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 113 -9.391 -1.513 9.135 1.00 7.11 N ATOM 2 CA THR A 113 -9.426 -2.952 8.817 1.00 6.14 C ATOM 3 C THR A 113 -10.850 -3.344 8.472 1.00 5.79 C ATOM 4 O THR A 113 -11.731 -3.281 9.331 1.00 6.50 O ATOM 5 CB THR A 113 -8.937 -3.786 10.020 1.00 6.71 C ATOM 6 OG1 THR A 113 -7.594 -3.413 10.357 1.00 7.38 O ATOM 7 CG2 THR A 113 -8.996 -5.276 9.725 1.00 6.15 C ATOM 0 HA THR A 113 -8.767 -3.147 7.971 1.00 6.14 H new ATOM 0 HB THR A 113 -9.599 -3.581 10.861 1.00 6.71 H new ATOM 0 HG1 THR A 113 -7.456 -2.465 10.151 1.00 7.38 H new ATOM 0 HG21 THR A 113 -8.645 -5.833 10.593 1.00 6.15 H new ATOM 0 HG22 THR A 113 -10.024 -5.562 9.502 1.00 6.15 H new ATOM 0 HG23 THR A 113 -8.362 -5.503 8.868 1.00 6.15 H new ATOM 17 N PRO A 114 -11.125 -3.734 7.216 1.00 4.87 N ATOM 18 CA PRO A 114 -12.487 -4.026 6.805 1.00 4.81 C ATOM 19 C PRO A 114 -12.984 -5.316 7.431 1.00 4.53 C ATOM 20 O PRO A 114 -12.243 -6.297 7.530 1.00 4.06 O ATOM 21 CB PRO A 114 -12.385 -4.127 5.289 1.00 4.27 C ATOM 22 CG PRO A 114 -11.017 -4.641 5.077 1.00 3.42 C ATOM 23 CD PRO A 114 -10.163 -3.978 6.119 1.00 4.00 C ATOM 0 HA PRO A 114 -13.204 -3.269 7.123 1.00 4.81 H new ATOM 0 HB2 PRO A 114 -13.137 -4.801 4.879 1.00 4.27 H new ATOM 0 HB3 PRO A 114 -12.530 -3.159 4.810 1.00 4.27 H new ATOM 0 HG2 PRO A 114 -10.987 -5.726 5.180 1.00 3.42 H new ATOM 0 HG3 PRO A 114 -10.662 -4.406 4.074 1.00 3.42 H new ATOM 0 HD2 PRO A 114 -9.340 -4.618 6.436 1.00 4.00 H new ATOM 0 HD3 PRO A 114 -9.722 -3.051 5.752 1.00 4.00 H new ATOM 31 N GLU A 115 -14.239 -5.307 7.840 1.00 5.07 N ATOM 32 CA GLU A 115 -14.811 -6.389 8.628 1.00 5.19 C ATOM 33 C GLU A 115 -15.179 -7.604 7.769 1.00 4.43 C ATOM 34 O GLU A 115 -16.297 -8.118 7.825 1.00 4.78 O ATOM 35 CB GLU A 115 -16.016 -5.855 9.387 1.00 6.23 C ATOM 36 CG GLU A 115 -17.093 -5.299 8.483 1.00 6.90 C ATOM 37 CD GLU A 115 -18.192 -4.592 9.244 1.00 7.69 C ATOM 38 OE1 GLU A 115 -18.399 -3.385 9.018 1.00 8.15 O ATOM 39 OE2 GLU A 115 -18.843 -5.234 10.087 1.00 8.07 O ATOM 0 H GLU A 115 -14.893 -4.551 7.637 1.00 5.07 H new ATOM 0 HA GLU A 115 -14.061 -6.743 9.335 1.00 5.19 H new ATOM 0 HB2 GLU A 115 -16.438 -6.656 9.994 1.00 6.23 H new ATOM 0 HB3 GLU A 115 -15.688 -5.074 10.073 1.00 6.23 H new ATOM 0 HG2 GLU A 115 -16.643 -4.603 7.775 1.00 6.90 H new ATOM 0 HG3 GLU A 115 -17.526 -6.112 7.900 1.00 6.90 H new ATOM 46 N LEU A 116 -14.217 -8.049 6.978 1.00 3.64 N ATOM 47 CA LEU A 116 -14.362 -9.239 6.158 1.00 3.32 C ATOM 48 C LEU A 116 -12.984 -9.783 5.804 1.00 2.70 C ATOM 49 O LEU A 116 -12.639 -10.912 6.156 1.00 3.08 O ATOM 50 CB LEU A 116 -15.172 -8.959 4.873 1.00 3.81 C ATOM 51 CG LEU A 116 -14.664 -7.825 3.967 1.00 4.59 C ATOM 52 CD1 LEU A 116 -15.135 -8.048 2.540 1.00 5.28 C ATOM 53 CD2 LEU A 116 -15.148 -6.470 4.461 1.00 5.24 C ATOM 0 H LEU A 116 -13.309 -7.592 6.887 1.00 3.64 H new ATOM 0 HA LEU A 116 -14.915 -9.981 6.734 1.00 3.32 H new ATOM 0 HB2 LEU A 116 -15.203 -9.876 4.284 1.00 3.81 H new ATOM 0 HB3 LEU A 116 -16.198 -8.730 5.161 1.00 3.81 H new ATOM 0 HG LEU A 116 -13.574 -7.832 3.996 1.00 4.59 H new ATOM 0 HD11 LEU A 116 -14.770 -7.240 1.906 1.00 5.28 H new ATOM 0 HD12 LEU A 116 -14.749 -8.999 2.174 1.00 5.28 H new ATOM 0 HD13 LEU A 116 -16.225 -8.065 2.515 1.00 5.28 H new ATOM 0 HD21 LEU A 116 -14.774 -5.687 3.801 1.00 5.24 H new ATOM 0 HD22 LEU A 116 -16.238 -6.452 4.464 1.00 5.24 H new ATOM 0 HD23 LEU A 116 -14.780 -6.299 5.473 1.00 5.24 H new ATOM 65 N ALA A 117 -12.191 -8.957 5.132 1.00 2.22 N ATOM 66 CA ALA A 117 -10.862 -9.347 4.705 1.00 1.98 C ATOM 67 C ALA A 117 -10.099 -8.152 4.154 1.00 1.62 C ATOM 68 O ALA A 117 -10.672 -7.286 3.491 1.00 1.76 O ATOM 69 CB ALA A 117 -10.951 -10.441 3.652 1.00 2.55 C ATOM 0 H ALA A 117 -12.453 -8.006 4.872 1.00 2.22 H new ATOM 0 HA ALA A 117 -10.322 -9.729 5.571 1.00 1.98 H new ATOM 0 HB1 ALA A 117 -9.947 -10.727 3.338 1.00 2.55 H new ATOM 0 HB2 ALA A 117 -11.461 -11.309 4.071 1.00 2.55 H new ATOM 0 HB3 ALA A 117 -11.509 -10.073 2.791 1.00 2.55 H new ATOM 75 N LEU A 118 -8.812 -8.114 4.444 1.00 1.44 N ATOM 76 CA LEU A 118 -7.905 -7.146 3.845 1.00 1.29 C ATOM 77 C LEU A 118 -7.035 -7.922 2.870 1.00 0.93 C ATOM 78 O LEU A 118 -6.597 -9.019 3.215 1.00 0.99 O ATOM 79 CB LEU A 118 -6.982 -6.503 4.890 1.00 1.74 C ATOM 80 CG LEU A 118 -7.627 -6.073 6.211 1.00 2.42 C ATOM 81 CD1 LEU A 118 -7.775 -7.258 7.154 1.00 3.17 C ATOM 82 CD2 LEU A 118 -6.805 -4.974 6.865 1.00 2.96 C ATOM 0 H LEU A 118 -8.363 -8.752 5.101 1.00 1.44 H new ATOM 0 HA LEU A 118 -8.483 -6.352 3.372 1.00 1.29 H new ATOM 0 HB2 LEU A 118 -6.182 -7.208 5.116 1.00 1.74 H new ATOM 0 HB3 LEU A 118 -6.516 -5.627 4.439 1.00 1.74 H new ATOM 0 HG LEU A 118 -8.623 -5.685 5.995 1.00 2.42 H new ATOM 0 HD11 LEU A 118 -8.235 -6.927 8.085 1.00 3.17 H new ATOM 0 HD12 LEU A 118 -8.403 -8.017 6.688 1.00 3.17 H new ATOM 0 HD13 LEU A 118 -6.792 -7.680 7.365 1.00 3.17 H new ATOM 0 HD21 LEU A 118 -7.275 -4.678 7.803 1.00 2.96 H new ATOM 0 HD22 LEU A 118 -5.798 -5.342 7.063 1.00 2.96 H new ATOM 0 HD23 LEU A 118 -6.752 -4.113 6.198 1.00 2.96 H new ATOM 94 N ASP A 119 -6.767 -7.418 1.672 1.00 0.79 N ATOM 95 CA ASP A 119 -5.934 -8.211 0.775 1.00 0.65 C ATOM 96 C ASP A 119 -4.778 -7.395 0.239 1.00 0.56 C ATOM 97 O ASP A 119 -4.972 -6.333 -0.318 1.00 0.59 O ATOM 98 CB ASP A 119 -6.765 -8.768 -0.386 1.00 0.84 C ATOM 99 CG ASP A 119 -6.012 -9.812 -1.196 1.00 1.06 C ATOM 100 OD1 ASP A 119 -5.294 -9.430 -2.144 1.00 1.51 O ATOM 101 OD2 ASP A 119 -6.120 -11.015 -0.888 1.00 1.42 O ATOM 0 H ASP A 119 -7.090 -6.520 1.313 1.00 0.79 H new ATOM 0 HA ASP A 119 -5.530 -9.044 1.350 1.00 0.65 H new ATOM 0 HB2 ASP A 119 -7.681 -9.209 0.007 1.00 0.84 H new ATOM 0 HB3 ASP A 119 -7.061 -7.949 -1.042 1.00 0.84 H new ATOM 106 N TRP A 120 -3.583 -7.927 0.397 1.00 0.54 N ATOM 107 CA TRP A 120 -2.357 -7.333 -0.102 1.00 0.57 C ATOM 108 C TRP A 120 -1.453 -8.453 -0.538 1.00 0.74 C ATOM 109 O TRP A 120 -1.719 -9.624 -0.251 1.00 0.85 O ATOM 110 CB TRP A 120 -1.600 -6.551 0.976 1.00 0.65 C ATOM 111 CG TRP A 120 -2.477 -5.768 1.884 1.00 0.64 C ATOM 112 CD1 TRP A 120 -3.425 -4.879 1.515 1.00 0.60 C ATOM 113 CD2 TRP A 120 -2.490 -5.817 3.312 1.00 0.76 C ATOM 114 NE1 TRP A 120 -4.042 -4.357 2.627 1.00 0.73 N ATOM 115 CE2 TRP A 120 -3.481 -4.919 3.744 1.00 0.82 C ATOM 116 CE3 TRP A 120 -1.760 -6.531 4.265 1.00 0.88 C ATOM 117 CZ2 TRP A 120 -3.763 -4.719 5.090 1.00 0.99 C ATOM 118 CZ3 TRP A 120 -2.039 -6.330 5.602 1.00 1.02 C ATOM 119 CH2 TRP A 120 -3.034 -5.431 6.004 1.00 1.08 C ATOM 0 H TRP A 120 -3.433 -8.808 0.889 1.00 0.54 H new ATOM 0 HA TRP A 120 -2.623 -6.649 -0.908 1.00 0.57 H new ATOM 0 HB2 TRP A 120 -1.011 -7.249 1.570 1.00 0.65 H new ATOM 0 HB3 TRP A 120 -0.898 -5.872 0.492 1.00 0.65 H new ATOM 0 HD1 TRP A 120 -3.663 -4.617 0.495 1.00 0.60 H new ATOM 0 HE1 TRP A 120 -4.793 -3.666 2.622 1.00 0.73 H new ATOM 0 HE3 TRP A 120 -0.992 -7.227 3.962 1.00 0.88 H new ATOM 0 HZ2 TRP A 120 -4.530 -4.026 5.404 1.00 0.99 H new ATOM 0 HZ3 TRP A 120 -1.481 -6.875 6.349 1.00 1.02 H new ATOM 0 HH2 TRP A 120 -3.231 -5.296 7.057 1.00 1.08 H new ATOM 130 N ARG A 121 -0.402 -8.114 -1.231 1.00 0.81 N ATOM 131 CA ARG A 121 0.663 -9.042 -1.448 1.00 1.06 C ATOM 132 C ARG A 121 1.962 -8.277 -1.554 1.00 1.14 C ATOM 133 O ARG A 121 1.982 -7.123 -1.987 1.00 1.05 O ATOM 134 CB ARG A 121 0.434 -9.840 -2.712 1.00 1.20 C ATOM 135 CG ARG A 121 1.170 -9.269 -3.899 1.00 1.31 C ATOM 136 CD ARG A 121 0.247 -8.907 -5.028 1.00 1.18 C ATOM 137 NE ARG A 121 -0.480 -10.058 -5.550 1.00 1.60 N ATOM 138 CZ ARG A 121 -0.733 -10.254 -6.838 1.00 1.99 C ATOM 139 NH1 ARG A 121 -0.193 -9.463 -7.759 1.00 2.34 N ATOM 140 NH2 ARG A 121 -1.491 -11.277 -7.207 1.00 2.57 N ATOM 0 H ARG A 121 -0.263 -7.197 -1.655 1.00 0.81 H new ATOM 0 HA ARG A 121 0.704 -9.739 -0.611 1.00 1.06 H new ATOM 0 HB2 ARG A 121 0.755 -10.869 -2.551 1.00 1.20 H new ATOM 0 HB3 ARG A 121 -0.633 -9.869 -2.931 1.00 1.20 H new ATOM 0 HG2 ARG A 121 1.723 -8.383 -3.588 1.00 1.31 H new ATOM 0 HG3 ARG A 121 1.903 -9.995 -4.252 1.00 1.31 H new ATOM 0 HD2 ARG A 121 -0.466 -8.158 -4.683 1.00 1.18 H new ATOM 0 HD3 ARG A 121 0.824 -8.452 -5.832 1.00 1.18 H new ATOM 0 HE ARG A 121 -0.815 -10.755 -4.885 1.00 1.60 H new ATOM 0 HH11 ARG A 121 0.421 -8.698 -7.478 1.00 2.34 H new ATOM 0 HH12 ARG A 121 -0.392 -9.620 -8.747 1.00 2.34 H new ATOM 0 HH21 ARG A 121 -1.875 -11.907 -6.503 1.00 2.57 H new ATOM 0 HH22 ARG A 121 -1.690 -11.434 -8.195 1.00 2.57 H new ATOM 154 N GLN A 122 3.032 -8.892 -1.138 1.00 1.38 N ATOM 155 CA GLN A 122 4.335 -8.367 -1.443 1.00 1.54 C ATOM 156 C GLN A 122 5.147 -9.437 -2.141 1.00 1.87 C ATOM 157 O GLN A 122 5.124 -10.608 -1.764 1.00 2.08 O ATOM 158 CB GLN A 122 5.016 -7.912 -0.139 1.00 1.73 C ATOM 159 CG GLN A 122 6.536 -7.778 -0.215 1.00 2.15 C ATOM 160 CD GLN A 122 6.999 -6.549 -0.966 1.00 2.06 C ATOM 161 OE1 GLN A 122 8.076 -6.009 -0.702 1.00 2.16 O ATOM 162 NE2 GLN A 122 6.190 -6.079 -1.892 1.00 1.91 N ATOM 0 H GLN A 122 3.030 -9.752 -0.590 1.00 1.38 H new ATOM 0 HA GLN A 122 4.255 -7.506 -2.106 1.00 1.54 H new ATOM 0 HB2 GLN A 122 4.596 -6.950 0.156 1.00 1.73 H new ATOM 0 HB3 GLN A 122 4.768 -8.623 0.649 1.00 1.73 H new ATOM 0 HG2 GLN A 122 6.941 -7.749 0.797 1.00 2.15 H new ATOM 0 HG3 GLN A 122 6.947 -8.665 -0.698 1.00 2.15 H new ATOM 0 HE21 GLN A 122 5.306 -6.551 -2.085 1.00 1.91 H new ATOM 0 HE22 GLN A 122 6.447 -5.243 -2.417 1.00 1.91 H new ATOM 171 N SER A 123 5.842 -9.025 -3.175 1.00 1.94 N ATOM 172 CA SER A 123 6.757 -9.873 -3.867 1.00 2.32 C ATOM 173 C SER A 123 7.982 -9.044 -4.183 1.00 2.43 C ATOM 174 O SER A 123 7.962 -7.821 -3.997 1.00 2.22 O ATOM 175 CB SER A 123 6.106 -10.443 -5.131 1.00 2.41 C ATOM 176 OG SER A 123 6.936 -11.408 -5.758 1.00 2.83 O ATOM 0 H SER A 123 5.781 -8.081 -3.556 1.00 1.94 H new ATOM 0 HA SER A 123 7.042 -10.730 -3.256 1.00 2.32 H new ATOM 0 HB2 SER A 123 5.149 -10.897 -4.874 1.00 2.41 H new ATOM 0 HB3 SER A 123 5.897 -9.633 -5.830 1.00 2.41 H new ATOM 0 HG SER A 123 6.678 -11.499 -6.699 1.00 2.83 H new ATOM 182 N ALA A 124 9.009 -9.677 -4.704 1.00 2.77 N ATOM 183 CA ALA A 124 10.243 -8.994 -5.051 1.00 2.93 C ATOM 184 C ALA A 124 10.005 -7.908 -6.093 1.00 2.70 C ATOM 185 O ALA A 124 10.861 -7.068 -6.348 1.00 2.77 O ATOM 186 CB ALA A 124 11.226 -10.010 -5.585 1.00 3.35 C ATOM 0 H ALA A 124 9.016 -10.678 -4.900 1.00 2.77 H new ATOM 0 HA ALA A 124 10.641 -8.513 -4.157 1.00 2.93 H new ATOM 0 HB1 ALA A 124 12.158 -9.510 -5.850 1.00 3.35 H new ATOM 0 HB2 ALA A 124 11.422 -10.763 -4.821 1.00 3.35 H new ATOM 0 HB3 ALA A 124 10.808 -10.491 -6.470 1.00 3.35 H new ATOM 192 N GLU A 125 8.822 -7.951 -6.664 1.00 2.48 N ATOM 193 CA GLU A 125 8.463 -7.192 -7.844 1.00 2.35 C ATOM 194 C GLU A 125 7.522 -6.022 -7.545 1.00 1.91 C ATOM 195 O GLU A 125 7.527 -5.024 -8.266 1.00 1.78 O ATOM 196 CB GLU A 125 7.771 -8.168 -8.773 1.00 2.56 C ATOM 197 CG GLU A 125 6.855 -9.086 -7.984 1.00 2.56 C ATOM 198 CD GLU A 125 6.103 -10.083 -8.832 1.00 2.86 C ATOM 199 OE1 GLU A 125 6.380 -11.296 -8.728 1.00 3.11 O ATOM 200 OE2 GLU A 125 5.253 -9.645 -9.634 1.00 2.98 O ATOM 0 H GLU A 125 8.061 -8.531 -6.311 1.00 2.48 H new ATOM 0 HA GLU A 125 9.361 -6.751 -8.277 1.00 2.35 H new ATOM 0 HB2 GLU A 125 7.195 -7.623 -9.521 1.00 2.56 H new ATOM 0 HB3 GLU A 125 8.513 -8.758 -9.310 1.00 2.56 H new ATOM 0 HG2 GLU A 125 7.448 -9.627 -7.246 1.00 2.56 H new ATOM 0 HG3 GLU A 125 6.137 -8.479 -7.433 1.00 2.56 H new ATOM 207 N GLU A 126 6.701 -6.144 -6.502 1.00 1.72 N ATOM 208 CA GLU A 126 5.617 -5.193 -6.287 1.00 1.33 C ATOM 209 C GLU A 126 5.089 -5.252 -4.876 1.00 1.27 C ATOM 210 O GLU A 126 5.051 -6.323 -4.267 1.00 1.55 O ATOM 211 CB GLU A 126 4.474 -5.495 -7.256 1.00 1.42 C ATOM 212 CG GLU A 126 4.247 -6.987 -7.431 1.00 1.81 C ATOM 213 CD GLU A 126 2.877 -7.334 -7.975 1.00 1.94 C ATOM 214 OE1 GLU A 126 2.156 -8.118 -7.328 1.00 2.06 O ATOM 215 OE2 GLU A 126 2.499 -6.798 -9.035 1.00 2.15 O ATOM 0 H GLU A 126 6.766 -6.883 -5.802 1.00 1.72 H new ATOM 0 HA GLU A 126 6.016 -4.193 -6.461 1.00 1.33 H new ATOM 0 HB2 GLU A 126 3.558 -5.031 -6.890 1.00 1.42 H new ATOM 0 HB3 GLU A 126 4.694 -5.047 -8.225 1.00 1.42 H new ATOM 0 HG2 GLU A 126 5.007 -7.385 -8.104 1.00 1.81 H new ATOM 0 HG3 GLU A 126 4.382 -7.482 -6.469 1.00 1.81 H new ATOM 222 N VAL A 127 4.674 -4.100 -4.356 1.00 0.96 N ATOM 223 CA VAL A 127 3.904 -4.090 -3.140 1.00 0.93 C ATOM 224 C VAL A 127 2.464 -3.795 -3.500 1.00 0.66 C ATOM 225 O VAL A 127 2.155 -2.735 -4.040 1.00 0.53 O ATOM 226 CB VAL A 127 4.378 -3.021 -2.130 1.00 1.08 C ATOM 227 CG1 VAL A 127 3.583 -3.127 -0.835 1.00 1.31 C ATOM 228 CG2 VAL A 127 5.867 -3.130 -1.861 1.00 1.53 C ATOM 0 H VAL A 127 4.860 -3.181 -4.758 1.00 0.96 H new ATOM 0 HA VAL A 127 4.025 -5.064 -2.665 1.00 0.93 H new ATOM 0 HB VAL A 127 4.198 -2.040 -2.570 1.00 1.08 H new ATOM 0 HG11 VAL A 127 3.928 -2.368 -0.133 1.00 1.31 H new ATOM 0 HG12 VAL A 127 2.524 -2.973 -1.044 1.00 1.31 H new ATOM 0 HG13 VAL A 127 3.727 -4.116 -0.400 1.00 1.31 H new ATOM 0 HG21 VAL A 127 6.165 -2.363 -1.146 1.00 1.53 H new ATOM 0 HG22 VAL A 127 6.092 -4.115 -1.451 1.00 1.53 H new ATOM 0 HG23 VAL A 127 6.416 -2.991 -2.792 1.00 1.53 H new ATOM 238 N ILE A 128 1.592 -4.735 -3.209 1.00 0.64 N ATOM 239 CA ILE A 128 0.195 -4.608 -3.557 1.00 0.48 C ATOM 240 C ILE A 128 -0.656 -4.564 -2.324 1.00 0.46 C ATOM 241 O ILE A 128 -0.553 -5.425 -1.467 1.00 0.56 O ATOM 242 CB ILE A 128 -0.275 -5.762 -4.460 1.00 0.56 C ATOM 243 CG1 ILE A 128 0.526 -5.739 -5.754 1.00 0.64 C ATOM 244 CG2 ILE A 128 -1.761 -5.639 -4.741 1.00 0.55 C ATOM 245 CD1 ILE A 128 0.656 -4.348 -6.298 1.00 0.55 C ATOM 0 H ILE A 128 1.829 -5.603 -2.728 1.00 0.64 H new ATOM 0 HA ILE A 128 0.087 -3.674 -4.108 1.00 0.48 H new ATOM 0 HB ILE A 128 -0.109 -6.714 -3.955 1.00 0.56 H new ATOM 0 HG12 ILE A 128 1.518 -6.155 -5.576 1.00 0.64 H new ATOM 0 HG13 ILE A 128 0.041 -6.376 -6.494 1.00 0.64 H new ATOM 0 HG21 ILE A 128 -2.080 -6.462 -5.381 1.00 0.55 H new ATOM 0 HG22 ILE A 128 -2.313 -5.675 -3.802 1.00 0.55 H new ATOM 0 HG23 ILE A 128 -1.959 -4.692 -5.242 1.00 0.55 H new ATOM 0 HD11 ILE A 128 1.234 -4.371 -7.222 1.00 0.55 H new ATOM 0 HD12 ILE A 128 -0.335 -3.942 -6.500 1.00 0.55 H new ATOM 0 HD13 ILE A 128 1.164 -3.718 -5.568 1.00 0.55 H new ATOM 257 N VAL A 129 -1.477 -3.545 -2.235 1.00 0.39 N ATOM 258 CA VAL A 129 -2.430 -3.436 -1.150 1.00 0.42 C ATOM 259 C VAL A 129 -3.811 -3.141 -1.720 1.00 0.36 C ATOM 260 O VAL A 129 -3.993 -2.197 -2.492 1.00 0.37 O ATOM 261 CB VAL A 129 -1.978 -2.350 -0.139 1.00 0.52 C ATOM 262 CG1 VAL A 129 -1.367 -1.196 -0.873 1.00 0.73 C ATOM 263 CG2 VAL A 129 -3.115 -1.850 0.739 1.00 0.79 C ATOM 0 H VAL A 129 -1.506 -2.775 -2.903 1.00 0.39 H new ATOM 0 HA VAL A 129 -2.479 -4.379 -0.606 1.00 0.42 H new ATOM 0 HB VAL A 129 -1.243 -2.815 0.518 1.00 0.52 H new ATOM 0 HG11 VAL A 129 -1.051 -0.436 -0.158 1.00 0.73 H new ATOM 0 HG12 VAL A 129 -0.503 -1.542 -1.440 1.00 0.73 H new ATOM 0 HG13 VAL A 129 -2.102 -0.769 -1.556 1.00 0.73 H new ATOM 0 HG21 VAL A 129 -2.738 -1.092 1.426 1.00 0.79 H new ATOM 0 HG22 VAL A 129 -3.895 -1.417 0.113 1.00 0.79 H new ATOM 0 HG23 VAL A 129 -3.528 -2.683 1.309 1.00 0.79 H new ATOM 273 N LYS A 130 -4.758 -3.991 -1.374 1.00 0.36 N ATOM 274 CA LYS A 130 -6.107 -3.908 -1.868 1.00 0.33 C ATOM 275 C LYS A 130 -7.051 -3.648 -0.718 1.00 0.37 C ATOM 276 O LYS A 130 -7.124 -4.424 0.254 1.00 0.43 O ATOM 277 CB LYS A 130 -6.533 -5.191 -2.588 1.00 0.37 C ATOM 278 CG LYS A 130 -5.506 -5.758 -3.551 1.00 0.83 C ATOM 279 CD LYS A 130 -5.942 -7.126 -4.042 1.00 1.18 C ATOM 280 CE LYS A 130 -4.878 -7.796 -4.891 1.00 1.57 C ATOM 281 NZ LYS A 130 -5.263 -9.187 -5.252 1.00 1.50 N ATOM 0 H LYS A 130 -4.603 -4.768 -0.732 1.00 0.36 H new ATOM 0 HA LYS A 130 -6.146 -3.089 -2.586 1.00 0.33 H new ATOM 0 HB2 LYS A 130 -6.765 -5.949 -1.840 1.00 0.37 H new ATOM 0 HB3 LYS A 130 -7.453 -4.993 -3.137 1.00 0.37 H new ATOM 0 HG2 LYS A 130 -5.380 -5.083 -4.398 1.00 0.83 H new ATOM 0 HG3 LYS A 130 -4.537 -5.833 -3.057 1.00 0.83 H new ATOM 0 HD2 LYS A 130 -6.174 -7.760 -3.186 1.00 1.18 H new ATOM 0 HD3 LYS A 130 -6.859 -7.026 -4.623 1.00 1.18 H new ATOM 0 HE2 LYS A 130 -4.717 -7.215 -5.799 1.00 1.57 H new ATOM 0 HE3 LYS A 130 -3.933 -7.808 -4.348 1.00 1.57 H new ATOM 0 HZ1 LYS A 130 -4.514 -9.615 -5.832 1.00 1.50 H new ATOM 0 HZ2 LYS A 130 -5.393 -9.747 -4.385 1.00 1.50 H new ATOM 0 HZ3 LYS A 130 -6.152 -9.172 -5.791 1.00 1.50 H new ATOM 295 N LEU A 131 -7.772 -2.561 -0.842 1.00 0.38 N ATOM 296 CA LEU A 131 -8.600 -2.066 0.208 1.00 0.47 C ATOM 297 C LEU A 131 -10.036 -2.010 -0.287 1.00 0.45 C ATOM 298 O LEU A 131 -10.317 -1.438 -1.330 1.00 0.41 O ATOM 299 CB LEU A 131 -8.070 -0.688 0.589 1.00 0.51 C ATOM 300 CG LEU A 131 -6.538 -0.605 0.676 1.00 0.60 C ATOM 301 CD1 LEU A 131 -5.987 0.245 -0.458 1.00 0.72 C ATOM 302 CD2 LEU A 131 -6.098 -0.041 2.016 1.00 0.96 C ATOM 0 H LEU A 131 -7.794 -1.994 -1.690 1.00 0.38 H new ATOM 0 HA LEU A 131 -8.582 -2.709 1.088 1.00 0.47 H new ATOM 0 HB2 LEU A 131 -8.421 0.039 -0.143 1.00 0.51 H new ATOM 0 HB3 LEU A 131 -8.494 -0.401 1.552 1.00 0.51 H new ATOM 0 HG LEU A 131 -6.140 -1.616 0.584 1.00 0.60 H new ATOM 0 HD11 LEU A 131 -4.901 0.294 -0.382 1.00 0.72 H new ATOM 0 HD12 LEU A 131 -6.264 -0.200 -1.414 1.00 0.72 H new ATOM 0 HD13 LEU A 131 -6.401 1.251 -0.393 1.00 0.72 H new ATOM 0 HD21 LEU A 131 -5.010 0.007 2.051 1.00 0.96 H new ATOM 0 HD22 LEU A 131 -6.510 0.960 2.142 1.00 0.96 H new ATOM 0 HD23 LEU A 131 -6.459 -0.685 2.818 1.00 0.96 H new ATOM 314 N ARG A 132 -10.931 -2.652 0.432 1.00 0.57 N ATOM 315 CA ARG A 132 -12.324 -2.727 0.022 1.00 0.63 C ATOM 316 C ARG A 132 -13.141 -1.673 0.750 1.00 0.60 C ATOM 317 O ARG A 132 -13.054 -1.545 1.971 1.00 0.67 O ATOM 318 CB ARG A 132 -12.877 -4.126 0.298 1.00 0.85 C ATOM 319 CG ARG A 132 -12.149 -5.223 -0.465 1.00 1.32 C ATOM 320 CD ARG A 132 -12.705 -6.596 -0.137 1.00 1.84 C ATOM 321 NE ARG A 132 -12.100 -7.648 -0.954 1.00 2.53 N ATOM 322 CZ ARG A 132 -12.011 -8.921 -0.572 1.00 3.25 C ATOM 323 NH1 ARG A 132 -12.479 -9.295 0.611 1.00 3.46 N ATOM 324 NH2 ARG A 132 -11.462 -9.825 -1.371 1.00 4.13 N ATOM 0 H ARG A 132 -10.722 -3.132 1.307 1.00 0.57 H new ATOM 0 HA ARG A 132 -12.391 -2.534 -1.049 1.00 0.63 H new ATOM 0 HB2 ARG A 132 -12.811 -4.331 1.367 1.00 0.85 H new ATOM 0 HB3 ARG A 132 -13.934 -4.150 0.034 1.00 0.85 H new ATOM 0 HG2 ARG A 132 -12.236 -5.041 -1.536 1.00 1.32 H new ATOM 0 HG3 ARG A 132 -11.087 -5.193 -0.222 1.00 1.32 H new ATOM 0 HD2 ARG A 132 -12.533 -6.813 0.917 1.00 1.84 H new ATOM 0 HD3 ARG A 132 -13.784 -6.595 -0.290 1.00 1.84 H new ATOM 0 HE ARG A 132 -11.725 -7.392 -1.868 1.00 2.53 H new ATOM 0 HH11 ARG A 132 -12.908 -8.607 1.230 1.00 3.46 H new ATOM 0 HH12 ARG A 132 -12.410 -10.270 0.902 1.00 3.46 H new ATOM 0 HH21 ARG A 132 -11.104 -9.548 -2.285 1.00 4.13 H new ATOM 0 HH22 ARG A 132 -11.397 -10.798 -1.072 1.00 4.13 H new ATOM 338 N VAL A 133 -13.950 -0.937 0.003 1.00 0.60 N ATOM 339 CA VAL A 133 -14.671 0.198 0.559 1.00 0.57 C ATOM 340 C VAL A 133 -16.094 -0.172 0.936 1.00 0.81 C ATOM 341 O VAL A 133 -16.887 -0.619 0.107 1.00 0.99 O ATOM 342 CB VAL A 133 -14.701 1.392 -0.426 1.00 0.62 C ATOM 343 CG1 VAL A 133 -15.682 2.464 0.028 1.00 0.81 C ATOM 344 CG2 VAL A 133 -13.316 1.991 -0.575 1.00 0.99 C ATOM 0 H VAL A 133 -14.124 -1.105 -0.988 1.00 0.60 H new ATOM 0 HA VAL A 133 -14.132 0.493 1.459 1.00 0.57 H new ATOM 0 HB VAL A 133 -15.034 1.013 -1.392 1.00 0.62 H new ATOM 0 HG11 VAL A 133 -15.678 3.287 -0.686 1.00 0.81 H new ATOM 0 HG12 VAL A 133 -16.684 2.039 0.086 1.00 0.81 H new ATOM 0 HG13 VAL A 133 -15.388 2.834 1.010 1.00 0.81 H new ATOM 0 HG21 VAL A 133 -13.355 2.829 -1.271 1.00 0.99 H new ATOM 0 HG22 VAL A 133 -12.965 2.341 0.396 1.00 0.99 H new ATOM 0 HG23 VAL A 133 -12.631 1.234 -0.957 1.00 0.99 H new ATOM 354 N GLY A 134 -16.389 0.004 2.210 1.00 0.96 N ATOM 355 CA GLY A 134 -17.731 -0.164 2.708 1.00 1.24 C ATOM 356 C GLY A 134 -18.107 0.985 3.588 1.00 1.32 C ATOM 357 O GLY A 134 -18.838 0.820 4.564 1.00 1.54 O ATOM 0 H GLY A 134 -15.706 0.266 2.921 1.00 0.96 H new ATOM 0 HA2 GLY A 134 -18.429 -0.235 1.874 1.00 1.24 H new ATOM 0 HA3 GLY A 134 -17.805 -1.097 3.266 1.00 1.24 H new ATOM 361 N VAL A 135 -17.597 2.158 3.257 1.00 1.26 N ATOM 362 CA VAL A 135 -17.757 3.290 4.123 1.00 1.46 C ATOM 363 C VAL A 135 -18.785 4.250 3.527 1.00 1.62 C ATOM 364 O VAL A 135 -18.946 5.391 3.965 1.00 2.18 O ATOM 365 CB VAL A 135 -16.400 3.984 4.342 1.00 1.46 C ATOM 366 CG1 VAL A 135 -15.926 4.649 3.061 1.00 1.28 C ATOM 367 CG2 VAL A 135 -16.455 4.967 5.500 1.00 1.79 C ATOM 0 H VAL A 135 -17.075 2.341 2.400 1.00 1.26 H new ATOM 0 HA VAL A 135 -18.122 2.959 5.095 1.00 1.46 H new ATOM 0 HB VAL A 135 -15.670 3.220 4.611 1.00 1.46 H new ATOM 0 HG11 VAL A 135 -14.966 5.134 3.237 1.00 1.28 H new ATOM 0 HG12 VAL A 135 -15.815 3.897 2.280 1.00 1.28 H new ATOM 0 HG13 VAL A 135 -16.656 5.394 2.746 1.00 1.28 H new ATOM 0 HG21 VAL A 135 -15.480 5.437 5.625 1.00 1.79 H new ATOM 0 HG22 VAL A 135 -17.203 5.732 5.293 1.00 1.79 H new ATOM 0 HG23 VAL A 135 -16.722 4.437 6.415 1.00 1.79 H new ATOM 377 N GLY A 136 -19.501 3.749 2.533 1.00 1.55 N ATOM 378 CA GLY A 136 -20.420 4.568 1.779 1.00 1.67 C ATOM 379 C GLY A 136 -19.973 4.694 0.340 1.00 1.53 C ATOM 380 O GLY A 136 -19.504 3.718 -0.250 1.00 1.55 O ATOM 0 H GLY A 136 -19.459 2.775 2.233 1.00 1.55 H new ATOM 0 HA2 GLY A 136 -21.418 4.132 1.817 1.00 1.67 H new ATOM 0 HA3 GLY A 136 -20.487 5.557 2.231 1.00 1.67 H new ATOM 384 N PRO A 137 -20.098 5.882 -0.256 1.00 1.48 N ATOM 385 CA PRO A 137 -19.625 6.137 -1.610 1.00 1.43 C ATOM 386 C PRO A 137 -18.123 6.282 -1.664 1.00 1.16 C ATOM 387 O PRO A 137 -17.528 6.983 -0.856 1.00 1.06 O ATOM 388 CB PRO A 137 -20.311 7.454 -2.008 1.00 1.57 C ATOM 389 CG PRO A 137 -21.227 7.802 -0.875 1.00 1.71 C ATOM 390 CD PRO A 137 -20.710 7.074 0.332 1.00 1.57 C ATOM 0 HA PRO A 137 -19.862 5.313 -2.283 1.00 1.43 H new ATOM 0 HB2 PRO A 137 -19.576 8.242 -2.172 1.00 1.57 H new ATOM 0 HB3 PRO A 137 -20.867 7.338 -2.938 1.00 1.57 H new ATOM 0 HG2 PRO A 137 -21.239 8.878 -0.703 1.00 1.71 H new ATOM 0 HG3 PRO A 137 -22.251 7.503 -1.099 1.00 1.71 H new ATOM 0 HD2 PRO A 137 -19.986 7.671 0.887 1.00 1.57 H new ATOM 0 HD3 PRO A 137 -21.511 6.819 1.026 1.00 1.57 H new ATOM 398 N LEU A 138 -17.526 5.586 -2.614 1.00 1.15 N ATOM 399 CA LEU A 138 -16.118 5.662 -2.852 1.00 0.96 C ATOM 400 C LEU A 138 -15.759 6.975 -3.520 1.00 0.97 C ATOM 401 O LEU A 138 -16.202 7.278 -4.632 1.00 1.14 O ATOM 402 CB LEU A 138 -15.720 4.501 -3.742 1.00 1.06 C ATOM 403 CG LEU A 138 -14.334 4.612 -4.377 1.00 0.85 C ATOM 404 CD1 LEU A 138 -13.357 3.648 -3.727 1.00 0.80 C ATOM 405 CD2 LEU A 138 -14.417 4.369 -5.873 1.00 1.69 C ATOM 0 H LEU A 138 -18.019 4.950 -3.241 1.00 1.15 H new ATOM 0 HA LEU A 138 -15.583 5.610 -1.903 1.00 0.96 H new ATOM 0 HB2 LEU A 138 -15.760 3.584 -3.155 1.00 1.06 H new ATOM 0 HB3 LEU A 138 -16.459 4.403 -4.537 1.00 1.06 H new ATOM 0 HG LEU A 138 -13.963 5.623 -4.211 1.00 0.85 H new ATOM 0 HD11 LEU A 138 -12.379 3.748 -4.198 1.00 0.80 H new ATOM 0 HD12 LEU A 138 -13.273 3.876 -2.664 1.00 0.80 H new ATOM 0 HD13 LEU A 138 -13.717 2.627 -3.851 1.00 0.80 H new ATOM 0 HD21 LEU A 138 -13.422 4.451 -6.311 1.00 1.69 H new ATOM 0 HD22 LEU A 138 -14.813 3.371 -6.058 1.00 1.69 H new ATOM 0 HD23 LEU A 138 -15.075 5.110 -6.326 1.00 1.69 H new ATOM 417 N GLN A 139 -14.970 7.742 -2.823 1.00 0.83 N ATOM 418 CA GLN A 139 -14.398 8.952 -3.342 1.00 0.88 C ATOM 419 C GLN A 139 -12.887 8.843 -3.213 1.00 0.75 C ATOM 420 O GLN A 139 -12.418 7.984 -2.477 1.00 0.66 O ATOM 421 CB GLN A 139 -14.981 10.197 -2.660 1.00 0.96 C ATOM 422 CG GLN A 139 -14.716 10.313 -1.171 1.00 0.86 C ATOM 423 CD GLN A 139 -15.700 9.517 -0.315 1.00 0.89 C ATOM 424 OE1 GLN A 139 -16.770 10.019 0.036 1.00 1.11 O ATOM 425 NE2 GLN A 139 -15.342 8.296 0.053 1.00 0.93 N ATOM 0 H GLN A 139 -14.701 7.540 -1.860 1.00 0.83 H new ATOM 0 HA GLN A 139 -14.653 9.074 -4.395 1.00 0.88 H new ATOM 0 HB2 GLN A 139 -14.578 11.082 -3.153 1.00 0.96 H new ATOM 0 HB3 GLN A 139 -16.059 10.206 -2.821 1.00 0.96 H new ATOM 0 HG2 GLN A 139 -13.703 9.969 -0.962 1.00 0.86 H new ATOM 0 HG3 GLN A 139 -14.762 11.363 -0.882 1.00 0.86 H new ATOM 0 HE21 GLN A 139 -14.449 7.911 -0.256 1.00 0.93 H new ATOM 0 HE22 GLN A 139 -15.959 7.740 0.645 1.00 0.93 H new ATOM 434 N LEU A 140 -12.115 9.634 -3.940 1.00 0.83 N ATOM 435 CA LEU A 140 -10.657 9.444 -3.955 1.00 0.79 C ATOM 436 C LEU A 140 -10.069 9.402 -2.548 1.00 0.65 C ATOM 437 O LEU A 140 -9.017 8.802 -2.325 1.00 0.70 O ATOM 438 CB LEU A 140 -9.947 10.519 -4.761 1.00 0.98 C ATOM 439 CG LEU A 140 -9.885 10.262 -6.261 1.00 1.73 C ATOM 440 CD1 LEU A 140 -11.152 10.739 -6.947 1.00 2.38 C ATOM 441 CD2 LEU A 140 -8.651 10.924 -6.836 1.00 2.60 C ATOM 0 H LEU A 140 -12.455 10.401 -4.520 1.00 0.83 H new ATOM 0 HA LEU A 140 -10.491 8.479 -4.435 1.00 0.79 H new ATOM 0 HB2 LEU A 140 -10.450 11.471 -4.591 1.00 0.98 H new ATOM 0 HB3 LEU A 140 -8.930 10.623 -4.383 1.00 0.98 H new ATOM 0 HG LEU A 140 -9.815 9.189 -6.439 1.00 1.73 H new ATOM 0 HD11 LEU A 140 -11.082 10.544 -8.017 1.00 2.38 H new ATOM 0 HD12 LEU A 140 -12.010 10.207 -6.537 1.00 2.38 H new ATOM 0 HD13 LEU A 140 -11.275 11.809 -6.781 1.00 2.38 H new ATOM 0 HD21 LEU A 140 -8.606 10.740 -7.909 1.00 2.60 H new ATOM 0 HD22 LEU A 140 -8.695 11.998 -6.653 1.00 2.60 H new ATOM 0 HD23 LEU A 140 -7.761 10.511 -6.360 1.00 2.60 H new ATOM 453 N GLU A 141 -10.775 10.014 -1.604 1.00 0.63 N ATOM 454 CA GLU A 141 -10.322 10.103 -0.227 1.00 0.64 C ATOM 455 C GLU A 141 -10.253 8.736 0.447 1.00 0.59 C ATOM 456 O GLU A 141 -9.779 8.621 1.579 1.00 0.70 O ATOM 457 CB GLU A 141 -11.237 11.002 0.570 1.00 0.78 C ATOM 458 CG GLU A 141 -12.462 10.307 1.079 1.00 1.06 C ATOM 459 CD GLU A 141 -13.344 11.226 1.899 1.00 1.78 C ATOM 460 OE1 GLU A 141 -13.472 11.005 3.122 1.00 2.58 O ATOM 461 OE2 GLU A 141 -13.930 12.164 1.325 1.00 2.05 O ATOM 0 H GLU A 141 -11.676 10.461 -1.775 1.00 0.63 H new ATOM 0 HA GLU A 141 -9.315 10.521 -0.252 1.00 0.64 H new ATOM 0 HB2 GLU A 141 -10.684 11.413 1.415 1.00 0.78 H new ATOM 0 HB3 GLU A 141 -11.539 11.844 -0.053 1.00 0.78 H new ATOM 0 HG2 GLU A 141 -13.032 9.916 0.236 1.00 1.06 H new ATOM 0 HG3 GLU A 141 -12.166 9.452 1.687 1.00 1.06 H new ATOM 468 N ASP A 142 -10.708 7.702 -0.246 1.00 0.51 N ATOM 469 CA ASP A 142 -10.697 6.383 0.317 1.00 0.51 C ATOM 470 C ASP A 142 -9.317 5.764 0.193 1.00 0.50 C ATOM 471 O ASP A 142 -9.032 4.747 0.826 1.00 0.56 O ATOM 472 CB ASP A 142 -11.686 5.483 -0.395 1.00 0.57 C ATOM 473 CG ASP A 142 -13.131 5.772 -0.050 1.00 1.64 C ATOM 474 OD1 ASP A 142 -13.789 6.488 -0.819 1.00 2.37 O ATOM 475 OD2 ASP A 142 -13.615 5.271 0.981 1.00 2.39 O ATOM 0 H ASP A 142 -11.085 7.762 -1.192 1.00 0.51 H new ATOM 0 HA ASP A 142 -10.974 6.475 1.367 1.00 0.51 H new ATOM 0 HB2 ASP A 142 -11.551 5.589 -1.471 1.00 0.57 H new ATOM 0 HB3 ASP A 142 -11.463 4.445 -0.147 1.00 0.57 H new ATOM 480 N VAL A 143 -8.455 6.371 -0.621 1.00 0.49 N ATOM 481 CA VAL A 143 -7.026 6.132 -0.516 1.00 0.47 C ATOM 482 C VAL A 143 -6.258 7.442 -0.452 1.00 0.47 C ATOM 483 O VAL A 143 -6.340 8.258 -1.372 1.00 0.59 O ATOM 484 CB VAL A 143 -6.432 5.270 -1.646 1.00 0.55 C ATOM 485 CG1 VAL A 143 -5.036 4.800 -1.254 1.00 0.53 C ATOM 486 CG2 VAL A 143 -7.318 4.085 -1.946 1.00 0.65 C ATOM 0 H VAL A 143 -8.724 7.027 -1.354 1.00 0.49 H new ATOM 0 HA VAL A 143 -6.914 5.567 0.409 1.00 0.47 H new ATOM 0 HB VAL A 143 -6.367 5.878 -2.548 1.00 0.55 H new ATOM 0 HG11 VAL A 143 -4.619 4.190 -2.056 1.00 0.53 H new ATOM 0 HG12 VAL A 143 -4.395 5.665 -1.085 1.00 0.53 H new ATOM 0 HG13 VAL A 143 -5.095 4.208 -0.341 1.00 0.53 H new ATOM 0 HG21 VAL A 143 -6.875 3.493 -2.747 1.00 0.65 H new ATOM 0 HG22 VAL A 143 -7.417 3.469 -1.052 1.00 0.65 H new ATOM 0 HG23 VAL A 143 -8.303 4.436 -2.255 1.00 0.65 H new ATOM 496 N ASP A 144 -5.513 7.655 0.612 1.00 0.40 N ATOM 497 CA ASP A 144 -4.524 8.715 0.602 1.00 0.41 C ATOM 498 C ASP A 144 -3.138 8.101 0.702 1.00 0.33 C ATOM 499 O ASP A 144 -2.719 7.644 1.757 1.00 0.33 O ATOM 500 CB ASP A 144 -4.757 9.723 1.730 1.00 0.47 C ATOM 501 CG ASP A 144 -3.789 10.891 1.679 1.00 0.91 C ATOM 502 OD1 ASP A 144 -3.474 11.365 0.566 1.00 1.11 O ATOM 503 OD2 ASP A 144 -3.359 11.361 2.752 1.00 1.52 O ATOM 0 H ASP A 144 -5.569 7.121 1.479 1.00 0.40 H new ATOM 0 HA ASP A 144 -4.614 9.266 -0.334 1.00 0.41 H new ATOM 0 HB2 ASP A 144 -5.778 10.100 1.670 1.00 0.47 H new ATOM 0 HB3 ASP A 144 -4.659 9.217 2.690 1.00 0.47 H new ATOM 508 N ALA A 145 -2.433 8.054 -0.402 1.00 0.38 N ATOM 509 CA ALA A 145 -1.127 7.447 -0.400 1.00 0.36 C ATOM 510 C ALA A 145 -0.052 8.522 -0.463 1.00 0.39 C ATOM 511 O ALA A 145 0.016 9.283 -1.431 1.00 0.47 O ATOM 512 CB ALA A 145 -0.997 6.475 -1.561 1.00 0.48 C ATOM 0 H ALA A 145 -2.738 8.424 -1.302 1.00 0.38 H new ATOM 0 HA ALA A 145 -0.995 6.887 0.526 1.00 0.36 H new ATOM 0 HB1 ALA A 145 -0.005 6.023 -1.548 1.00 0.48 H new ATOM 0 HB2 ALA A 145 -1.752 5.695 -1.469 1.00 0.48 H new ATOM 0 HB3 ALA A 145 -1.140 7.009 -2.500 1.00 0.48 H new ATOM 518 N ALA A 146 0.807 8.564 0.543 1.00 0.38 N ATOM 519 CA ALA A 146 1.805 9.624 0.635 1.00 0.49 C ATOM 520 C ALA A 146 3.188 9.038 0.504 1.00 0.48 C ATOM 521 O ALA A 146 3.615 8.257 1.333 1.00 0.66 O ATOM 522 CB ALA A 146 1.683 10.372 1.952 1.00 0.56 C ATOM 0 H ALA A 146 0.836 7.884 1.303 1.00 0.38 H new ATOM 0 HA ALA A 146 1.632 10.330 -0.177 1.00 0.49 H new ATOM 0 HB1 ALA A 146 2.438 11.157 1.996 1.00 0.56 H new ATOM 0 HB2 ALA A 146 0.691 10.818 2.027 1.00 0.56 H new ATOM 0 HB3 ALA A 146 1.832 9.678 2.780 1.00 0.56 H new ATOM 528 N PHE A 147 3.910 9.444 -0.506 1.00 0.57 N ATOM 529 CA PHE A 147 5.142 8.771 -0.833 1.00 0.59 C ATOM 530 C PHE A 147 6.328 9.719 -0.697 1.00 0.68 C ATOM 531 O PHE A 147 6.275 10.875 -1.119 1.00 0.94 O ATOM 532 CB PHE A 147 5.018 8.195 -2.250 1.00 0.82 C ATOM 533 CG PHE A 147 5.201 9.235 -3.311 1.00 2.08 C ATOM 534 CD1 PHE A 147 6.465 9.549 -3.742 1.00 2.46 C ATOM 535 CD2 PHE A 147 4.118 9.908 -3.855 1.00 3.01 C ATOM 536 CE1 PHE A 147 6.668 10.517 -4.707 1.00 3.72 C ATOM 537 CE2 PHE A 147 4.307 10.876 -4.823 1.00 4.26 C ATOM 538 CZ PHE A 147 5.586 11.181 -5.251 1.00 4.62 C ATOM 0 H PHE A 147 3.671 10.229 -1.112 1.00 0.57 H new ATOM 0 HA PHE A 147 5.323 7.952 -0.136 1.00 0.59 H new ATOM 0 HB2 PHE A 147 5.761 7.409 -2.385 1.00 0.82 H new ATOM 0 HB3 PHE A 147 4.038 7.731 -2.366 1.00 0.82 H new ATOM 0 HD1 PHE A 147 7.314 9.032 -3.321 1.00 2.46 H new ATOM 0 HD2 PHE A 147 3.118 9.674 -3.520 1.00 3.01 H new ATOM 0 HE1 PHE A 147 7.669 10.754 -5.035 1.00 3.72 H new ATOM 0 HE2 PHE A 147 3.458 11.393 -5.244 1.00 4.26 H new ATOM 0 HZ PHE A 147 5.738 11.936 -6.008 1.00 4.62 H new ATOM 548 N THR A 148 7.360 9.238 -0.044 1.00 0.54 N ATOM 549 CA THR A 148 8.606 9.954 0.090 1.00 0.64 C ATOM 550 C THR A 148 9.758 9.039 -0.260 1.00 0.71 C ATOM 551 O THR A 148 9.595 7.822 -0.332 1.00 0.74 O ATOM 552 CB THR A 148 8.828 10.411 1.524 1.00 0.56 C ATOM 553 OG1 THR A 148 7.583 10.754 2.148 1.00 0.65 O ATOM 554 CG2 THR A 148 9.765 11.594 1.545 1.00 0.81 C ATOM 0 H THR A 148 7.357 8.327 0.415 1.00 0.54 H new ATOM 0 HA THR A 148 8.558 10.816 -0.576 1.00 0.64 H new ATOM 0 HB THR A 148 9.275 9.590 2.085 1.00 0.56 H new ATOM 0 HG1 THR A 148 7.463 10.214 2.957 1.00 0.65 H new ATOM 0 HG21 THR A 148 9.920 11.917 2.574 1.00 0.81 H new ATOM 0 HG22 THR A 148 10.721 11.309 1.106 1.00 0.81 H new ATOM 0 HG23 THR A 148 9.331 12.412 0.970 1.00 0.81 H new ATOM 562 N ASP A 149 10.941 9.616 -0.388 1.00 0.84 N ATOM 563 CA ASP A 149 12.094 8.875 -0.833 1.00 0.98 C ATOM 564 C ASP A 149 12.626 8.009 0.270 1.00 0.79 C ATOM 565 O ASP A 149 13.516 7.193 0.059 1.00 0.92 O ATOM 566 CB ASP A 149 13.204 9.792 -1.349 1.00 1.23 C ATOM 567 CG ASP A 149 12.811 10.566 -2.593 1.00 1.87 C ATOM 568 OD1 ASP A 149 12.083 11.578 -2.468 1.00 2.28 O ATOM 569 OD2 ASP A 149 13.241 10.185 -3.702 1.00 2.17 O ATOM 0 H ASP A 149 11.122 10.600 -0.187 1.00 0.84 H new ATOM 0 HA ASP A 149 11.766 8.247 -1.661 1.00 0.98 H new ATOM 0 HB2 ASP A 149 13.479 10.496 -0.563 1.00 1.23 H new ATOM 0 HB3 ASP A 149 14.089 9.194 -1.566 1.00 1.23 H new ATOM 574 N THR A 150 12.114 8.201 1.459 1.00 0.56 N ATOM 575 CA THR A 150 12.517 7.368 2.550 1.00 0.54 C ATOM 576 C THR A 150 11.316 6.830 3.314 1.00 0.64 C ATOM 577 O THR A 150 11.462 6.201 4.346 1.00 0.88 O ATOM 578 CB THR A 150 13.487 8.106 3.481 1.00 0.53 C ATOM 579 OG1 THR A 150 12.837 9.241 4.064 1.00 0.67 O ATOM 580 CG2 THR A 150 14.710 8.560 2.698 1.00 0.59 C ATOM 0 H THR A 150 11.427 8.918 1.689 1.00 0.56 H new ATOM 0 HA THR A 150 13.046 6.512 2.132 1.00 0.54 H new ATOM 0 HB THR A 150 13.801 7.428 4.275 1.00 0.53 H new ATOM 0 HG1 THR A 150 13.462 9.706 4.659 1.00 0.67 H new ATOM 0 HG21 THR A 150 15.395 9.084 3.365 1.00 0.59 H new ATOM 0 HG22 THR A 150 15.212 7.692 2.271 1.00 0.59 H new ATOM 0 HG23 THR A 150 14.400 9.231 1.896 1.00 0.59 H new ATOM 588 N ASP A 151 10.118 7.093 2.826 1.00 0.55 N ATOM 589 CA ASP A 151 8.929 6.474 3.400 1.00 0.63 C ATOM 590 C ASP A 151 7.756 6.676 2.481 1.00 0.57 C ATOM 591 O ASP A 151 7.737 7.620 1.740 1.00 0.54 O ATOM 592 CB ASP A 151 8.611 7.028 4.803 1.00 0.71 C ATOM 593 CG ASP A 151 8.459 8.543 4.839 1.00 0.79 C ATOM 594 OD1 ASP A 151 9.409 9.228 5.277 1.00 0.97 O ATOM 595 OD2 ASP A 151 7.388 9.059 4.451 1.00 1.00 O ATOM 0 H ASP A 151 9.939 7.722 2.044 1.00 0.55 H new ATOM 0 HA ASP A 151 9.127 5.408 3.510 1.00 0.63 H new ATOM 0 HB2 ASP A 151 7.691 6.570 5.166 1.00 0.71 H new ATOM 0 HB3 ASP A 151 9.405 6.734 5.489 1.00 0.71 H new ATOM 600 N CYS A 152 6.780 5.803 2.527 1.00 0.66 N ATOM 601 CA CYS A 152 5.586 5.987 1.729 1.00 0.61 C ATOM 602 C CYS A 152 4.386 5.371 2.433 1.00 0.63 C ATOM 603 O CYS A 152 4.533 4.510 3.300 1.00 0.85 O ATOM 604 CB CYS A 152 5.797 5.465 0.298 1.00 0.97 C ATOM 605 SG CYS A 152 4.288 5.223 -0.672 1.00 1.56 S ATOM 0 H CYS A 152 6.785 4.962 3.104 1.00 0.66 H new ATOM 0 HA CYS A 152 5.374 7.051 1.627 1.00 0.61 H new ATOM 0 HB2 CYS A 152 6.442 6.164 -0.234 1.00 0.97 H new ATOM 0 HB3 CYS A 152 6.331 4.516 0.351 1.00 0.97 H new ATOM 0 HG CYS A 152 4.603 4.951 -1.904 1.00 1.56 H new ATOM 611 N VAL A 153 3.214 5.831 2.042 1.00 0.49 N ATOM 612 CA VAL A 153 2.026 5.745 2.848 1.00 0.43 C ATOM 613 C VAL A 153 0.857 5.258 2.049 1.00 0.37 C ATOM 614 O VAL A 153 0.655 5.622 0.897 1.00 0.37 O ATOM 615 CB VAL A 153 1.712 7.127 3.454 1.00 0.43 C ATOM 616 CG1 VAL A 153 0.225 7.308 3.751 1.00 0.41 C ATOM 617 CG2 VAL A 153 2.537 7.356 4.712 1.00 0.60 C ATOM 0 H VAL A 153 3.065 6.281 1.139 1.00 0.49 H new ATOM 0 HA VAL A 153 2.207 5.026 3.647 1.00 0.43 H new ATOM 0 HB VAL A 153 1.983 7.873 2.707 1.00 0.43 H new ATOM 0 HG11 VAL A 153 0.057 8.297 4.176 1.00 0.41 H new ATOM 0 HG12 VAL A 153 -0.345 7.208 2.827 1.00 0.41 H new ATOM 0 HG13 VAL A 153 -0.099 6.548 4.462 1.00 0.41 H new ATOM 0 HG21 VAL A 153 2.303 8.336 5.127 1.00 0.60 H new ATOM 0 HG22 VAL A 153 2.302 6.586 5.446 1.00 0.60 H new ATOM 0 HG23 VAL A 153 3.598 7.310 4.465 1.00 0.60 H new ATOM 627 N VAL A 154 0.125 4.409 2.697 1.00 0.36 N ATOM 628 CA VAL A 154 -1.117 3.910 2.216 1.00 0.34 C ATOM 629 C VAL A 154 -2.197 4.355 3.174 1.00 0.28 C ATOM 630 O VAL A 154 -2.059 4.204 4.380 1.00 0.29 O ATOM 631 CB VAL A 154 -1.090 2.366 2.104 1.00 0.40 C ATOM 632 CG1 VAL A 154 -1.836 1.696 3.200 1.00 0.38 C ATOM 633 CG2 VAL A 154 -1.621 1.950 0.763 1.00 0.45 C ATOM 0 H VAL A 154 0.388 4.033 3.608 1.00 0.36 H new ATOM 0 HA VAL A 154 -1.312 4.300 1.217 1.00 0.34 H new ATOM 0 HB VAL A 154 -0.053 2.046 2.203 1.00 0.40 H new ATOM 0 HG11 VAL A 154 -1.782 0.615 3.069 1.00 0.38 H new ATOM 0 HG12 VAL A 154 -1.395 1.968 4.159 1.00 0.38 H new ATOM 0 HG13 VAL A 154 -2.879 2.013 3.177 1.00 0.38 H new ATOM 0 HG21 VAL A 154 -1.602 0.863 0.685 1.00 0.45 H new ATOM 0 HG22 VAL A 154 -2.646 2.303 0.652 1.00 0.45 H new ATOM 0 HG23 VAL A 154 -1.001 2.381 -0.023 1.00 0.45 H new ATOM 643 N ARG A 155 -3.203 5.019 2.692 1.00 0.30 N ATOM 644 CA ARG A 155 -4.300 5.314 3.563 1.00 0.33 C ATOM 645 C ARG A 155 -5.628 4.872 2.994 1.00 0.45 C ATOM 646 O ARG A 155 -5.947 5.165 1.855 1.00 0.63 O ATOM 647 CB ARG A 155 -4.288 6.792 3.897 1.00 0.46 C ATOM 648 CG ARG A 155 -5.428 7.272 4.763 1.00 0.79 C ATOM 649 CD ARG A 155 -6.491 7.962 3.923 1.00 1.06 C ATOM 650 NE ARG A 155 -7.114 9.098 4.618 1.00 1.59 N ATOM 651 CZ ARG A 155 -7.742 9.039 5.801 1.00 1.99 C ATOM 652 NH1 ARG A 155 -7.964 7.877 6.403 1.00 2.40 N ATOM 653 NH2 ARG A 155 -8.188 10.156 6.365 1.00 2.42 N ATOM 0 H ARG A 155 -3.289 5.357 1.734 1.00 0.30 H new ATOM 0 HA ARG A 155 -4.174 4.741 4.482 1.00 0.33 H new ATOM 0 HB2 ARG A 155 -3.350 7.025 4.400 1.00 0.46 H new ATOM 0 HB3 ARG A 155 -4.300 7.357 2.965 1.00 0.46 H new ATOM 0 HG2 ARG A 155 -5.868 6.428 5.293 1.00 0.79 H new ATOM 0 HG3 ARG A 155 -5.051 7.961 5.519 1.00 0.79 H new ATOM 0 HD2 ARG A 155 -6.043 8.312 2.993 1.00 1.06 H new ATOM 0 HD3 ARG A 155 -7.261 7.239 3.654 1.00 1.06 H new ATOM 0 HE ARG A 155 -7.064 10.009 4.161 1.00 1.59 H new ATOM 0 HH11 ARG A 155 -7.655 7.009 5.966 1.00 2.40 H new ATOM 0 HH12 ARG A 155 -8.443 7.852 7.303 1.00 2.40 H new ATOM 0 HH21 ARG A 155 -8.052 11.053 5.898 1.00 2.42 H new ATOM 0 HH22 ARG A 155 -8.667 10.117 7.265 1.00 2.42 H new ATOM 667 N PHE A 156 -6.384 4.160 3.798 1.00 0.44 N ATOM 668 CA PHE A 156 -7.767 3.859 3.490 1.00 0.49 C ATOM 669 C PHE A 156 -8.661 4.958 4.050 1.00 0.57 C ATOM 670 O PHE A 156 -8.198 5.735 4.878 1.00 0.71 O ATOM 671 CB PHE A 156 -8.155 2.528 4.114 1.00 0.60 C ATOM 672 CG PHE A 156 -9.520 2.038 3.732 1.00 0.59 C ATOM 673 CD1 PHE A 156 -9.793 1.678 2.424 1.00 0.56 C ATOM 674 CD2 PHE A 156 -10.524 1.925 4.677 1.00 0.77 C ATOM 675 CE1 PHE A 156 -11.041 1.217 2.063 1.00 0.65 C ATOM 676 CE2 PHE A 156 -11.776 1.466 4.324 1.00 0.82 C ATOM 677 CZ PHE A 156 -12.056 1.154 3.035 1.00 0.72 C ATOM 0 H PHE A 156 -6.060 3.772 4.684 1.00 0.44 H new ATOM 0 HA PHE A 156 -7.890 3.800 2.409 1.00 0.49 H new ATOM 0 HB2 PHE A 156 -7.419 1.777 3.826 1.00 0.60 H new ATOM 0 HB3 PHE A 156 -8.107 2.622 5.199 1.00 0.60 H new ATOM 0 HD1 PHE A 156 -9.018 1.759 1.676 1.00 0.56 H new ATOM 0 HD2 PHE A 156 -10.325 2.199 5.703 1.00 0.77 H new ATOM 0 HE1 PHE A 156 -11.237 0.908 1.047 1.00 0.65 H new ATOM 0 HE2 PHE A 156 -12.539 1.354 5.080 1.00 0.82 H new ATOM 0 HZ PHE A 156 -13.056 0.858 2.755 1.00 0.72 H new ATOM 687 N ALA A 157 -9.926 5.015 3.637 1.00 0.57 N ATOM 688 CA ALA A 157 -10.845 6.035 4.146 1.00 0.65 C ATOM 689 C ALA A 157 -10.916 6.001 5.671 1.00 0.77 C ATOM 690 O ALA A 157 -11.074 7.035 6.324 1.00 0.95 O ATOM 691 CB ALA A 157 -12.232 5.832 3.579 1.00 0.71 C ATOM 0 H ALA A 157 -10.336 4.374 2.958 1.00 0.57 H new ATOM 0 HA ALA A 157 -10.462 7.006 3.832 1.00 0.65 H new ATOM 0 HB1 ALA A 157 -12.900 6.600 3.969 1.00 0.71 H new ATOM 0 HB2 ALA A 157 -12.194 5.902 2.492 1.00 0.71 H new ATOM 0 HB3 ALA A 157 -12.602 4.848 3.867 1.00 0.71 H new ATOM 697 N GLY A 158 -10.759 4.809 6.230 1.00 0.76 N ATOM 698 CA GLY A 158 -10.817 4.650 7.666 1.00 0.94 C ATOM 699 C GLY A 158 -9.452 4.407 8.278 1.00 0.91 C ATOM 700 O GLY A 158 -8.494 5.122 7.981 1.00 1.81 O ATOM 0 H GLY A 158 -10.592 3.947 5.711 1.00 0.76 H new ATOM 0 HA2 GLY A 158 -11.257 5.543 8.110 1.00 0.94 H new ATOM 0 HA3 GLY A 158 -11.475 3.816 7.910 1.00 0.94 H new ATOM 704 N GLY A 159 -9.359 3.381 9.113 1.00 0.72 N ATOM 705 CA GLY A 159 -8.129 3.113 9.835 1.00 0.81 C ATOM 706 C GLY A 159 -7.199 2.155 9.117 1.00 0.60 C ATOM 707 O GLY A 159 -6.135 1.814 9.637 1.00 0.78 O ATOM 0 H GLY A 159 -10.117 2.726 9.305 1.00 0.72 H new ATOM 0 HA2 GLY A 159 -7.606 4.054 10.006 1.00 0.81 H new ATOM 0 HA3 GLY A 159 -8.375 2.702 10.814 1.00 0.81 H new ATOM 711 N GLN A 160 -7.575 1.721 7.918 1.00 0.50 N ATOM 712 CA GLN A 160 -6.772 0.817 7.160 1.00 0.47 C ATOM 713 C GLN A 160 -5.701 1.601 6.385 1.00 0.40 C ATOM 714 O GLN A 160 -5.665 1.654 5.160 1.00 0.56 O ATOM 715 CB GLN A 160 -7.701 0.011 6.285 1.00 0.71 C ATOM 716 CG GLN A 160 -6.994 -0.842 5.281 1.00 0.64 C ATOM 717 CD GLN A 160 -7.935 -1.646 4.405 1.00 1.08 C ATOM 718 OE1 GLN A 160 -9.067 -1.246 4.153 1.00 1.43 O ATOM 719 NE2 GLN A 160 -7.467 -2.792 3.936 1.00 2.02 N ATOM 0 H GLN A 160 -8.445 1.995 7.461 1.00 0.50 H new ATOM 0 HA GLN A 160 -6.222 0.120 7.792 1.00 0.47 H new ATOM 0 HB2 GLN A 160 -8.320 -0.625 6.917 1.00 0.71 H new ATOM 0 HB3 GLN A 160 -8.373 0.691 5.762 1.00 0.71 H new ATOM 0 HG2 GLN A 160 -6.374 -0.207 4.648 1.00 0.64 H new ATOM 0 HG3 GLN A 160 -6.323 -1.524 5.803 1.00 0.64 H new ATOM 0 HE21 GLN A 160 -6.519 -3.089 4.169 1.00 2.02 H new ATOM 0 HE22 GLN A 160 -8.054 -3.378 3.342 1.00 2.02 H new ATOM 728 N GLN A 161 -4.829 2.209 7.154 1.00 0.38 N ATOM 729 CA GLN A 161 -3.765 3.041 6.652 1.00 0.34 C ATOM 730 C GLN A 161 -2.432 2.434 7.067 1.00 0.39 C ATOM 731 O GLN A 161 -2.242 2.037 8.216 1.00 0.46 O ATOM 732 CB GLN A 161 -3.943 4.465 7.185 1.00 0.35 C ATOM 733 CG GLN A 161 -2.671 5.301 7.193 1.00 1.08 C ATOM 734 CD GLN A 161 -2.858 6.620 7.915 1.00 1.12 C ATOM 735 OE1 GLN A 161 -2.687 6.701 9.131 1.00 1.77 O ATOM 736 NE2 GLN A 161 -3.184 7.666 7.176 1.00 1.46 N ATOM 0 H GLN A 161 -4.842 2.136 8.171 1.00 0.38 H new ATOM 0 HA GLN A 161 -3.789 3.093 5.563 1.00 0.34 H new ATOM 0 HB2 GLN A 161 -4.693 4.974 6.580 1.00 0.35 H new ATOM 0 HB3 GLN A 161 -4.334 4.413 8.201 1.00 0.35 H new ATOM 0 HG2 GLN A 161 -1.870 4.737 7.672 1.00 1.08 H new ATOM 0 HG3 GLN A 161 -2.357 5.492 6.167 1.00 1.08 H new ATOM 0 HE21 GLN A 161 -3.317 7.558 6.170 1.00 1.46 H new ATOM 0 HE22 GLN A 161 -3.302 8.581 7.611 1.00 1.46 H new ATOM 745 N TRP A 162 -1.536 2.356 6.108 1.00 0.39 N ATOM 746 CA TRP A 162 -0.324 1.576 6.207 1.00 0.47 C ATOM 747 C TRP A 162 0.753 2.278 5.437 1.00 0.50 C ATOM 748 O TRP A 162 0.534 3.344 4.898 1.00 0.47 O ATOM 749 CB TRP A 162 -0.471 0.157 5.664 1.00 0.50 C ATOM 750 CG TRP A 162 -1.807 -0.460 5.949 1.00 0.47 C ATOM 751 CD1 TRP A 162 -2.980 -0.183 5.308 1.00 0.43 C ATOM 752 CD2 TRP A 162 -2.116 -1.434 6.955 1.00 0.53 C ATOM 753 NE1 TRP A 162 -3.994 -0.926 5.848 1.00 0.47 N ATOM 754 CE2 TRP A 162 -3.492 -1.701 6.861 1.00 0.52 C ATOM 755 CE3 TRP A 162 -1.366 -2.107 7.924 1.00 0.62 C ATOM 756 CZ2 TRP A 162 -4.135 -2.608 7.699 1.00 0.60 C ATOM 757 CZ3 TRP A 162 -2.003 -3.008 8.756 1.00 0.68 C ATOM 758 CH2 TRP A 162 -3.376 -3.251 8.639 1.00 0.67 C ATOM 0 H TRP A 162 -1.633 2.845 5.218 1.00 0.39 H new ATOM 0 HA TRP A 162 -0.080 1.487 7.266 1.00 0.47 H new ATOM 0 HB2 TRP A 162 -0.309 0.171 4.586 1.00 0.50 H new ATOM 0 HB3 TRP A 162 0.309 -0.471 6.095 1.00 0.50 H new ATOM 0 HD1 TRP A 162 -3.091 0.519 4.495 1.00 0.43 H new ATOM 0 HE1 TRP A 162 -4.968 -0.906 5.545 1.00 0.47 H new ATOM 0 HE3 TRP A 162 -0.306 -1.926 8.021 1.00 0.62 H new ATOM 0 HZ2 TRP A 162 -5.195 -2.797 7.610 1.00 0.60 H new ATOM 0 HZ3 TRP A 162 -1.432 -3.533 9.508 1.00 0.68 H new ATOM 0 HH2 TRP A 162 -3.846 -3.960 9.304 1.00 0.67 H new ATOM 769 N GLY A 163 1.929 1.748 5.487 1.00 0.58 N ATOM 770 CA GLY A 163 3.006 2.312 4.745 1.00 0.63 C ATOM 771 C GLY A 163 4.298 1.607 5.051 1.00 0.62 C ATOM 772 O GLY A 163 4.292 0.536 5.655 1.00 0.63 O ATOM 0 H GLY A 163 2.169 0.922 6.036 1.00 0.58 H new ATOM 0 HA2 GLY A 163 2.793 2.242 3.678 1.00 0.63 H new ATOM 0 HA3 GLY A 163 3.101 3.372 4.983 1.00 0.63 H new ATOM 776 N GLY A 164 5.397 2.215 4.674 1.00 0.66 N ATOM 777 CA GLY A 164 6.689 1.651 4.951 1.00 0.66 C ATOM 778 C GLY A 164 7.710 2.731 5.110 1.00 0.63 C ATOM 779 O GLY A 164 7.496 3.860 4.672 1.00 0.69 O ATOM 0 H GLY A 164 5.419 3.103 4.173 1.00 0.66 H new ATOM 0 HA2 GLY A 164 6.643 1.050 5.859 1.00 0.66 H new ATOM 0 HA3 GLY A 164 6.981 0.983 4.141 1.00 0.66 H new ATOM 783 N VAL A 165 8.817 2.395 5.723 1.00 0.61 N ATOM 784 CA VAL A 165 9.774 3.384 6.094 1.00 0.59 C ATOM 785 C VAL A 165 11.174 2.903 5.743 1.00 0.60 C ATOM 786 O VAL A 165 11.570 1.778 6.051 1.00 0.78 O ATOM 787 CB VAL A 165 9.635 3.731 7.591 1.00 0.73 C ATOM 788 CG1 VAL A 165 10.067 2.574 8.477 1.00 0.96 C ATOM 789 CG2 VAL A 165 10.394 5.007 7.930 1.00 0.88 C ATOM 0 H VAL A 165 9.070 1.439 5.972 1.00 0.61 H new ATOM 0 HA VAL A 165 9.589 4.301 5.534 1.00 0.59 H new ATOM 0 HB VAL A 165 8.579 3.910 7.790 1.00 0.73 H new ATOM 0 HG11 VAL A 165 9.955 2.856 9.524 1.00 0.96 H new ATOM 0 HG12 VAL A 165 9.446 1.703 8.267 1.00 0.96 H new ATOM 0 HG13 VAL A 165 11.111 2.332 8.276 1.00 0.96 H new ATOM 0 HG21 VAL A 165 10.279 5.228 8.991 1.00 0.88 H new ATOM 0 HG22 VAL A 165 11.451 4.874 7.700 1.00 0.88 H new ATOM 0 HG23 VAL A 165 9.996 5.834 7.342 1.00 0.88 H new ATOM 799 N PHE A 166 11.875 3.747 5.042 1.00 0.55 N ATOM 800 CA PHE A 166 13.176 3.477 4.527 1.00 0.61 C ATOM 801 C PHE A 166 14.103 4.589 4.975 1.00 0.61 C ATOM 802 O PHE A 166 13.665 5.626 5.460 1.00 0.84 O ATOM 803 CB PHE A 166 13.095 3.406 3.003 1.00 1.00 C ATOM 804 CG PHE A 166 12.342 2.205 2.501 1.00 1.66 C ATOM 805 CD1 PHE A 166 13.011 1.027 2.205 1.00 1.99 C ATOM 806 CD2 PHE A 166 10.970 2.255 2.324 1.00 2.17 C ATOM 807 CE1 PHE A 166 12.325 -0.080 1.743 1.00 2.71 C ATOM 808 CE2 PHE A 166 10.278 1.152 1.861 1.00 2.96 C ATOM 809 CZ PHE A 166 10.947 -0.012 1.573 1.00 3.19 C ATOM 0 H PHE A 166 11.536 4.680 4.807 1.00 0.55 H new ATOM 0 HA PHE A 166 13.560 2.526 4.896 1.00 0.61 H new ATOM 0 HB2 PHE A 166 12.614 4.310 2.630 1.00 1.00 H new ATOM 0 HB3 PHE A 166 14.105 3.390 2.593 1.00 1.00 H new ATOM 0 HD1 PHE A 166 14.082 0.974 2.337 1.00 1.99 H new ATOM 0 HD2 PHE A 166 10.435 3.165 2.550 1.00 2.17 H new ATOM 0 HE1 PHE A 166 12.856 -0.992 1.515 1.00 2.71 H new ATOM 0 HE2 PHE A 166 9.208 1.206 1.725 1.00 2.96 H new ATOM 0 HZ PHE A 166 10.403 -0.874 1.215 1.00 3.19 H new ATOM 819 N TYR A 167 15.374 4.354 4.879 1.00 0.74 N ATOM 820 CA TYR A 167 16.346 5.365 5.234 1.00 1.06 C ATOM 821 C TYR A 167 16.809 6.116 4.025 1.00 0.98 C ATOM 822 O TYR A 167 17.432 7.170 4.149 1.00 1.22 O ATOM 823 CB TYR A 167 17.532 4.766 5.994 1.00 1.45 C ATOM 824 CG TYR A 167 17.914 3.369 5.546 1.00 2.10 C ATOM 825 CD1 TYR A 167 17.588 2.249 6.304 1.00 2.48 C ATOM 826 CD2 TYR A 167 18.603 3.176 4.356 1.00 2.87 C ATOM 827 CE1 TYR A 167 17.945 0.978 5.887 1.00 3.52 C ATOM 828 CE2 TYR A 167 18.959 1.912 3.933 1.00 3.88 C ATOM 829 CZ TYR A 167 18.599 0.791 4.752 1.00 4.19 C ATOM 830 OH TYR A 167 18.988 -0.443 4.277 1.00 5.30 O ATOM 0 H TYR A 167 15.773 3.472 4.558 1.00 0.74 H new ATOM 0 HA TYR A 167 15.852 6.071 5.902 1.00 1.06 H new ATOM 0 HB2 TYR A 167 18.394 5.422 5.875 1.00 1.45 H new ATOM 0 HB3 TYR A 167 17.293 4.742 7.057 1.00 1.45 H new ATOM 0 HD1 TYR A 167 17.049 2.373 7.231 1.00 2.48 H new ATOM 0 HD2 TYR A 167 18.865 4.031 3.750 1.00 2.87 H new ATOM 0 HE1 TYR A 167 17.686 0.126 6.498 1.00 3.52 H new ATOM 0 HE2 TYR A 167 19.496 1.770 3.007 1.00 3.88 H new ATOM 0 HH TYR A 167 19.454 -0.332 3.422 1.00 5.30 H new ATOM 840 N ALA A 168 16.516 5.586 2.859 1.00 0.72 N ATOM 841 CA ALA A 168 17.074 6.136 1.677 1.00 0.72 C ATOM 842 C ALA A 168 16.348 5.673 0.441 1.00 0.54 C ATOM 843 O ALA A 168 15.441 4.837 0.485 1.00 0.67 O ATOM 844 CB ALA A 168 18.545 5.766 1.598 1.00 1.03 C ATOM 0 H ALA A 168 15.901 4.785 2.719 1.00 0.72 H new ATOM 0 HA ALA A 168 16.967 7.220 1.722 1.00 0.72 H new ATOM 0 HB1 ALA A 168 18.978 6.187 0.691 1.00 1.03 H new ATOM 0 HB2 ALA A 168 19.068 6.164 2.468 1.00 1.03 H new ATOM 0 HB3 ALA A 168 18.647 4.681 1.579 1.00 1.03 H new ATOM 850 N GLU A 169 16.797 6.265 -0.635 1.00 0.55 N ATOM 851 CA GLU A 169 16.599 5.806 -2.030 1.00 0.73 C ATOM 852 C GLU A 169 15.193 6.012 -2.547 1.00 0.54 C ATOM 853 O GLU A 169 14.981 6.734 -3.519 1.00 0.78 O ATOM 854 CB GLU A 169 16.949 4.319 -2.223 1.00 1.19 C ATOM 855 CG GLU A 169 17.830 3.722 -1.140 1.00 1.40 C ATOM 856 CD GLU A 169 18.922 2.837 -1.697 1.00 1.80 C ATOM 857 OE1 GLU A 169 20.114 3.166 -1.528 1.00 2.18 O ATOM 858 OE2 GLU A 169 18.591 1.797 -2.302 1.00 2.02 O ATOM 0 H GLU A 169 17.341 7.126 -0.585 1.00 0.55 H new ATOM 0 HA GLU A 169 17.284 6.432 -2.601 1.00 0.73 H new ATOM 0 HB2 GLU A 169 16.023 3.747 -2.273 1.00 1.19 H new ATOM 0 HB3 GLU A 169 17.450 4.201 -3.184 1.00 1.19 H new ATOM 0 HG2 GLU A 169 18.281 4.527 -0.560 1.00 1.40 H new ATOM 0 HG3 GLU A 169 17.213 3.142 -0.454 1.00 1.40 H new ATOM 865 N ILE A 170 14.273 5.365 -1.869 1.00 0.56 N ATOM 866 CA ILE A 170 12.918 5.109 -2.339 1.00 0.54 C ATOM 867 C ILE A 170 12.339 6.180 -3.260 1.00 0.55 C ATOM 868 O ILE A 170 11.819 7.187 -2.836 1.00 0.65 O ATOM 869 CB ILE A 170 11.986 4.856 -1.134 1.00 0.67 C ATOM 870 CG1 ILE A 170 12.191 3.431 -0.626 1.00 0.97 C ATOM 871 CG2 ILE A 170 10.521 5.115 -1.452 1.00 0.83 C ATOM 872 CD1 ILE A 170 12.150 2.383 -1.714 1.00 1.07 C ATOM 0 H ILE A 170 14.448 4.985 -0.939 1.00 0.56 H new ATOM 0 HA ILE A 170 12.984 4.218 -2.963 1.00 0.54 H new ATOM 0 HB ILE A 170 12.254 5.568 -0.354 1.00 0.67 H new ATOM 0 HG12 ILE A 170 13.152 3.372 -0.114 1.00 0.97 H new ATOM 0 HG13 ILE A 170 11.422 3.205 0.113 1.00 0.97 H new ATOM 0 HG21 ILE A 170 9.916 4.920 -0.566 1.00 0.83 H new ATOM 0 HG22 ILE A 170 10.393 6.154 -1.757 1.00 0.83 H new ATOM 0 HG23 ILE A 170 10.202 4.457 -2.261 1.00 0.83 H new ATOM 0 HD11 ILE A 170 12.303 1.397 -1.275 1.00 1.07 H new ATOM 0 HD12 ILE A 170 11.180 2.412 -2.211 1.00 1.07 H new ATOM 0 HD13 ILE A 170 12.937 2.583 -2.441 1.00 1.07 H new ATOM 884 N LYS A 171 12.458 5.950 -4.542 1.00 0.67 N ATOM 885 CA LYS A 171 11.631 6.650 -5.505 1.00 0.79 C ATOM 886 C LYS A 171 10.831 5.613 -6.236 1.00 0.84 C ATOM 887 O LYS A 171 9.942 5.902 -7.032 1.00 0.92 O ATOM 888 CB LYS A 171 12.508 7.402 -6.487 1.00 1.11 C ATOM 889 CG LYS A 171 13.873 6.768 -6.609 1.00 1.14 C ATOM 890 CD LYS A 171 14.844 7.646 -7.383 1.00 1.48 C ATOM 891 CE LYS A 171 15.071 8.969 -6.665 1.00 1.91 C ATOM 892 NZ LYS A 171 16.033 9.840 -7.385 1.00 2.68 N ATOM 0 H LYS A 171 13.117 5.286 -4.948 1.00 0.67 H new ATOM 0 HA LYS A 171 10.979 7.368 -5.007 1.00 0.79 H new ATOM 0 HB2 LYS A 171 12.027 7.422 -7.465 1.00 1.11 H new ATOM 0 HB3 LYS A 171 12.614 8.437 -6.163 1.00 1.11 H new ATOM 0 HG2 LYS A 171 14.273 6.576 -5.614 1.00 1.14 H new ATOM 0 HG3 LYS A 171 13.781 5.803 -7.108 1.00 1.14 H new ATOM 0 HD2 LYS A 171 15.794 7.126 -7.504 1.00 1.48 H new ATOM 0 HD3 LYS A 171 14.453 7.833 -8.383 1.00 1.48 H new ATOM 0 HE2 LYS A 171 14.120 9.491 -6.559 1.00 1.91 H new ATOM 0 HE3 LYS A 171 15.442 8.775 -5.659 1.00 1.91 H new ATOM 0 HZ1 LYS A 171 16.157 10.729 -6.860 1.00 2.68 H new ATOM 0 HZ2 LYS A 171 16.949 9.354 -7.464 1.00 2.68 H new ATOM 0 HZ3 LYS A 171 15.668 10.048 -8.337 1.00 2.68 H new ATOM 906 N SER A 172 11.182 4.391 -5.929 1.00 0.92 N ATOM 907 CA SER A 172 10.454 3.233 -6.338 1.00 1.13 C ATOM 908 C SER A 172 9.180 3.050 -5.517 1.00 1.05 C ATOM 909 O SER A 172 8.109 2.840 -6.064 1.00 1.12 O ATOM 910 CB SER A 172 11.414 2.077 -6.215 1.00 1.45 C ATOM 911 OG SER A 172 10.757 0.827 -6.201 1.00 1.86 O ATOM 0 H SER A 172 12.008 4.175 -5.371 1.00 0.92 H new ATOM 0 HA SER A 172 10.100 3.319 -7.365 1.00 1.13 H new ATOM 0 HB2 SER A 172 12.119 2.104 -7.046 1.00 1.45 H new ATOM 0 HB3 SER A 172 11.996 2.188 -5.300 1.00 1.45 H new ATOM 0 HG SER A 172 11.287 0.173 -6.703 1.00 1.86 H new ATOM 917 N SER A 173 9.311 3.165 -4.197 1.00 1.00 N ATOM 918 CA SER A 173 8.159 3.201 -3.304 1.00 1.09 C ATOM 919 C SER A 173 7.552 4.597 -3.307 1.00 0.94 C ATOM 920 O SER A 173 6.484 4.838 -2.751 1.00 1.14 O ATOM 921 CB SER A 173 8.517 2.716 -1.898 1.00 1.24 C ATOM 922 OG SER A 173 8.877 1.342 -1.920 1.00 1.47 O ATOM 0 H SER A 173 10.211 3.235 -3.721 1.00 1.00 H new ATOM 0 HA SER A 173 7.404 2.506 -3.672 1.00 1.09 H new ATOM 0 HB2 SER A 173 9.343 3.308 -1.503 1.00 1.24 H new ATOM 0 HB3 SER A 173 7.669 2.865 -1.229 1.00 1.24 H new ATOM 0 HG SER A 173 9.105 1.049 -1.013 1.00 1.47 H new ATOM 928 N CYS A 174 8.259 5.510 -3.964 1.00 0.76 N ATOM 929 CA CYS A 174 7.736 6.829 -4.247 1.00 0.85 C ATOM 930 C CYS A 174 6.809 6.676 -5.407 1.00 0.73 C ATOM 931 O CYS A 174 5.953 7.510 -5.693 1.00 0.88 O ATOM 932 CB CYS A 174 8.831 7.805 -4.662 1.00 1.09 C ATOM 933 SG CYS A 174 9.569 8.736 -3.312 1.00 1.63 S ATOM 0 H CYS A 174 9.205 5.352 -4.311 1.00 0.76 H new ATOM 0 HA CYS A 174 7.255 7.221 -3.351 1.00 0.85 H new ATOM 0 HB2 CYS A 174 9.617 7.250 -5.173 1.00 1.09 H new ATOM 0 HB3 CYS A 174 8.416 8.508 -5.384 1.00 1.09 H new ATOM 0 HG CYS A 174 10.794 8.339 -3.130 1.00 1.63 H new ATOM 939 N ALA A 175 7.005 5.590 -6.085 1.00 0.63 N ATOM 940 CA ALA A 175 6.184 5.287 -7.192 1.00 0.66 C ATOM 941 C ALA A 175 5.065 4.395 -6.729 1.00 0.59 C ATOM 942 O ALA A 175 5.280 3.264 -6.312 1.00 0.65 O ATOM 943 CB ALA A 175 7.015 4.681 -8.293 1.00 0.80 C ATOM 0 H ALA A 175 7.731 4.902 -5.883 1.00 0.63 H new ATOM 0 HA ALA A 175 5.735 6.188 -7.609 1.00 0.66 H new ATOM 0 HB1 ALA A 175 6.376 4.449 -9.145 1.00 0.80 H new ATOM 0 HB2 ALA A 175 7.785 5.389 -8.599 1.00 0.80 H new ATOM 0 HB3 ALA A 175 7.485 3.766 -7.932 1.00 0.80 H new ATOM 949 N LYS A 176 3.877 4.926 -6.766 1.00 0.60 N ATOM 950 CA LYS A 176 2.721 4.225 -6.289 1.00 0.59 C ATOM 951 C LYS A 176 1.510 4.580 -7.134 1.00 0.53 C ATOM 952 O LYS A 176 1.193 5.760 -7.299 1.00 0.66 O ATOM 953 CB LYS A 176 2.480 4.555 -4.830 1.00 0.83 C ATOM 954 CG LYS A 176 2.985 5.922 -4.418 1.00 0.84 C ATOM 955 CD LYS A 176 1.905 6.757 -3.759 1.00 1.59 C ATOM 956 CE LYS A 176 1.167 7.620 -4.772 1.00 2.27 C ATOM 957 NZ LYS A 176 0.004 8.324 -4.168 1.00 2.95 N ATOM 0 H LYS A 176 3.683 5.859 -7.129 1.00 0.60 H new ATOM 0 HA LYS A 176 2.892 3.152 -6.373 1.00 0.59 H new ATOM 0 HB2 LYS A 176 1.411 4.497 -4.626 1.00 0.83 H new ATOM 0 HB3 LYS A 176 2.964 3.798 -4.212 1.00 0.83 H new ATOM 0 HG2 LYS A 176 3.822 5.806 -3.730 1.00 0.84 H new ATOM 0 HG3 LYS A 176 3.363 6.447 -5.295 1.00 0.84 H new ATOM 0 HD2 LYS A 176 1.196 6.102 -3.253 1.00 1.59 H new ATOM 0 HD3 LYS A 176 2.352 7.393 -2.995 1.00 1.59 H new ATOM 0 HE2 LYS A 176 1.855 8.353 -5.192 1.00 2.27 H new ATOM 0 HE3 LYS A 176 0.824 6.996 -5.597 1.00 2.27 H new ATOM 0 HZ1 LYS A 176 -0.081 9.274 -4.583 1.00 2.95 H new ATOM 0 HZ2 LYS A 176 -0.865 7.785 -4.357 1.00 2.95 H new ATOM 0 HZ3 LYS A 176 0.143 8.406 -3.141 1.00 2.95 H new ATOM 971 N VAL A 177 0.858 3.597 -7.694 1.00 0.43 N ATOM 972 CA VAL A 177 -0.399 3.842 -8.386 1.00 0.41 C ATOM 973 C VAL A 177 -1.476 2.913 -7.894 1.00 0.37 C ATOM 974 O VAL A 177 -1.221 1.746 -7.646 1.00 0.41 O ATOM 975 CB VAL A 177 -0.265 3.782 -9.925 1.00 0.49 C ATOM 976 CG1 VAL A 177 0.449 2.521 -10.378 1.00 0.68 C ATOM 977 CG2 VAL A 177 -1.630 3.900 -10.584 1.00 0.77 C ATOM 0 H VAL A 177 1.164 2.624 -7.691 1.00 0.43 H new ATOM 0 HA VAL A 177 -0.690 4.865 -8.146 1.00 0.41 H new ATOM 0 HB VAL A 177 0.345 4.629 -10.238 1.00 0.49 H new ATOM 0 HG11 VAL A 177 0.523 2.516 -11.465 1.00 0.68 H new ATOM 0 HG12 VAL A 177 1.449 2.494 -9.946 1.00 0.68 H new ATOM 0 HG13 VAL A 177 -0.112 1.647 -10.049 1.00 0.68 H new ATOM 0 HG21 VAL A 177 -1.516 3.856 -11.667 1.00 0.77 H new ATOM 0 HG22 VAL A 177 -2.266 3.080 -10.252 1.00 0.77 H new ATOM 0 HG23 VAL A 177 -2.088 4.849 -10.306 1.00 0.77 H new ATOM 987 N GLN A 178 -2.675 3.432 -7.740 1.00 0.38 N ATOM 988 CA GLN A 178 -3.739 2.653 -7.172 1.00 0.37 C ATOM 989 C GLN A 178 -5.049 2.805 -7.935 1.00 0.33 C ATOM 990 O GLN A 178 -5.361 3.860 -8.487 1.00 0.40 O ATOM 991 CB GLN A 178 -3.888 2.988 -5.682 1.00 0.48 C ATOM 992 CG GLN A 178 -5.283 2.792 -5.110 1.00 0.64 C ATOM 993 CD GLN A 178 -6.140 4.034 -5.264 1.00 1.70 C ATOM 994 OE1 GLN A 178 -5.630 5.155 -5.287 1.00 2.52 O ATOM 995 NE2 GLN A 178 -7.441 3.851 -5.363 1.00 2.30 N ATOM 0 H GLN A 178 -2.931 4.385 -8.000 1.00 0.38 H new ATOM 0 HA GLN A 178 -3.475 1.599 -7.263 1.00 0.37 H new ATOM 0 HB2 GLN A 178 -3.191 2.371 -5.116 1.00 0.48 H new ATOM 0 HB3 GLN A 178 -3.592 4.026 -5.528 1.00 0.48 H new ATOM 0 HG2 GLN A 178 -5.766 1.954 -5.612 1.00 0.64 H new ATOM 0 HG3 GLN A 178 -5.209 2.531 -4.054 1.00 0.64 H new ATOM 0 HE21 GLN A 178 -7.826 2.907 -5.340 1.00 2.30 H new ATOM 0 HE22 GLN A 178 -8.063 4.653 -5.463 1.00 2.30 H new ATOM 1004 N THR A 179 -5.794 1.713 -7.951 1.00 0.32 N ATOM 1005 CA THR A 179 -7.078 1.629 -8.613 1.00 0.32 C ATOM 1006 C THR A 179 -8.208 1.803 -7.606 1.00 0.31 C ATOM 1007 O THR A 179 -8.155 1.235 -6.518 1.00 0.30 O ATOM 1008 CB THR A 179 -7.235 0.243 -9.256 1.00 0.33 C ATOM 1009 OG1 THR A 179 -6.016 -0.126 -9.921 1.00 0.36 O ATOM 1010 CG2 THR A 179 -8.385 0.223 -10.253 1.00 0.42 C ATOM 0 H THR A 179 -5.515 0.845 -7.494 1.00 0.32 H new ATOM 0 HA THR A 179 -7.125 2.415 -9.367 1.00 0.32 H new ATOM 0 HB THR A 179 -7.456 -0.473 -8.464 1.00 0.33 H new ATOM 0 HG1 THR A 179 -6.120 -1.011 -10.328 1.00 0.36 H new ATOM 0 HG21 THR A 179 -8.470 -0.772 -10.691 1.00 0.42 H new ATOM 0 HG22 THR A 179 -9.314 0.475 -9.742 1.00 0.42 H new ATOM 0 HG23 THR A 179 -8.196 0.951 -11.042 1.00 0.42 H new ATOM 1018 N ARG A 180 -9.201 2.610 -7.943 1.00 0.38 N ATOM 1019 CA ARG A 180 -10.435 2.646 -7.182 1.00 0.44 C ATOM 1020 C ARG A 180 -11.605 2.677 -8.151 1.00 0.55 C ATOM 1021 O ARG A 180 -11.477 3.167 -9.276 1.00 0.64 O ATOM 1022 CB ARG A 180 -10.471 3.846 -6.225 1.00 0.60 C ATOM 1023 CG ARG A 180 -10.900 5.167 -6.849 1.00 0.95 C ATOM 1024 CD ARG A 180 -9.933 5.669 -7.910 1.00 1.44 C ATOM 1025 NE ARG A 180 -10.503 6.788 -8.657 1.00 1.98 N ATOM 1026 CZ ARG A 180 -9.792 7.664 -9.369 1.00 2.68 C ATOM 1027 NH1 ARG A 180 -8.467 7.588 -9.403 1.00 3.12 N ATOM 1028 NH2 ARG A 180 -10.413 8.635 -10.026 1.00 3.41 N ATOM 0 H ARG A 180 -9.175 3.248 -8.738 1.00 0.38 H new ATOM 0 HA ARG A 180 -10.501 1.752 -6.562 1.00 0.44 H new ATOM 0 HB2 ARG A 180 -11.150 3.614 -5.404 1.00 0.60 H new ATOM 0 HB3 ARG A 180 -9.479 3.974 -5.792 1.00 0.60 H new ATOM 0 HG2 ARG A 180 -11.888 5.048 -7.294 1.00 0.95 H new ATOM 0 HG3 ARG A 180 -10.992 5.919 -6.065 1.00 0.95 H new ATOM 0 HD2 ARG A 180 -9.001 5.980 -7.438 1.00 1.44 H new ATOM 0 HD3 ARG A 180 -9.688 4.858 -8.596 1.00 1.44 H new ATOM 0 HE ARG A 180 -11.516 6.908 -8.632 1.00 1.98 H new ATOM 0 HH11 ARG A 180 -7.985 6.856 -8.882 1.00 3.12 H new ATOM 0 HH12 ARG A 180 -7.931 8.262 -9.950 1.00 3.12 H new ATOM 0 HH21 ARG A 180 -11.429 8.709 -9.985 1.00 3.41 H new ATOM 0 HH22 ARG A 180 -9.874 9.307 -10.572 1.00 3.41 H new ATOM 1042 N LYS A 181 -12.728 2.146 -7.721 1.00 0.61 N ATOM 1043 CA LYS A 181 -13.871 1.952 -8.602 1.00 0.75 C ATOM 1044 C LYS A 181 -15.098 1.576 -7.795 1.00 0.71 C ATOM 1045 O LYS A 181 -16.217 1.976 -8.107 1.00 0.89 O ATOM 1046 CB LYS A 181 -13.567 0.837 -9.606 1.00 0.91 C ATOM 1047 CG LYS A 181 -12.900 -0.371 -8.962 1.00 0.92 C ATOM 1048 CD LYS A 181 -13.424 -1.683 -9.527 1.00 1.36 C ATOM 1049 CE LYS A 181 -13.131 -1.823 -11.014 1.00 1.64 C ATOM 1050 NZ LYS A 181 -13.578 -3.140 -11.544 1.00 2.13 N ATOM 0 H LYS A 181 -12.880 1.837 -6.761 1.00 0.61 H new ATOM 0 HA LYS A 181 -14.063 2.884 -9.134 1.00 0.75 H new ATOM 0 HB2 LYS A 181 -14.494 0.522 -10.084 1.00 0.91 H new ATOM 0 HB3 LYS A 181 -12.920 1.228 -10.391 1.00 0.91 H new ATOM 0 HG2 LYS A 181 -11.822 -0.315 -9.117 1.00 0.92 H new ATOM 0 HG3 LYS A 181 -13.069 -0.347 -7.885 1.00 0.92 H new ATOM 0 HD2 LYS A 181 -12.971 -2.516 -8.989 1.00 1.36 H new ATOM 0 HD3 LYS A 181 -14.500 -1.744 -9.362 1.00 1.36 H new ATOM 0 HE2 LYS A 181 -13.631 -1.023 -11.560 1.00 1.64 H new ATOM 0 HE3 LYS A 181 -12.061 -1.706 -11.186 1.00 1.64 H new ATOM 0 HZ1 LYS A 181 -13.361 -3.197 -12.560 1.00 2.13 H new ATOM 0 HZ2 LYS A 181 -13.082 -3.903 -11.041 1.00 2.13 H new ATOM 0 HZ3 LYS A 181 -14.603 -3.241 -11.403 1.00 2.13 H new ATOM 1064 N GLY A 182 -14.868 0.798 -6.753 1.00 0.64 N ATOM 1065 CA GLY A 182 -15.947 0.308 -5.942 1.00 0.73 C ATOM 1066 C GLY A 182 -15.443 -0.395 -4.717 1.00 0.65 C ATOM 1067 O GLY A 182 -15.055 0.233 -3.734 1.00 0.78 O ATOM 0 H GLY A 182 -13.940 0.497 -6.455 1.00 0.64 H new ATOM 0 HA2 GLY A 182 -16.588 1.139 -5.647 1.00 0.73 H new ATOM 0 HA3 GLY A 182 -16.561 -0.376 -6.528 1.00 0.73 H new ATOM 1071 N SER A 183 -15.415 -1.705 -4.799 1.00 0.61 N ATOM 1072 CA SER A 183 -14.983 -2.535 -3.692 1.00 0.70 C ATOM 1073 C SER A 183 -13.514 -2.933 -3.838 1.00 0.66 C ATOM 1074 O SER A 183 -13.032 -3.822 -3.137 1.00 0.81 O ATOM 1075 CB SER A 183 -15.874 -3.776 -3.602 1.00 0.88 C ATOM 1076 OG SER A 183 -15.953 -4.441 -4.856 1.00 1.60 O ATOM 0 H SER A 183 -15.690 -2.227 -5.631 1.00 0.61 H new ATOM 0 HA SER A 183 -15.076 -1.961 -2.770 1.00 0.70 H new ATOM 0 HB2 SER A 183 -15.478 -4.458 -2.849 1.00 0.88 H new ATOM 0 HB3 SER A 183 -16.873 -3.487 -3.276 1.00 0.88 H new ATOM 0 HG SER A 183 -16.526 -5.231 -4.772 1.00 1.60 H new ATOM 1082 N LEU A 184 -12.805 -2.284 -4.753 1.00 0.53 N ATOM 1083 CA LEU A 184 -11.390 -2.571 -4.945 1.00 0.51 C ATOM 1084 C LEU A 184 -10.558 -1.293 -4.971 1.00 0.39 C ATOM 1085 O LEU A 184 -10.777 -0.409 -5.804 1.00 0.43 O ATOM 1086 CB LEU A 184 -11.180 -3.345 -6.251 1.00 0.68 C ATOM 1087 CG LEU A 184 -9.724 -3.680 -6.582 1.00 1.14 C ATOM 1088 CD1 LEU A 184 -9.157 -4.667 -5.574 1.00 1.80 C ATOM 1089 CD2 LEU A 184 -9.611 -4.229 -7.993 1.00 2.15 C ATOM 0 H LEU A 184 -13.182 -1.563 -5.368 1.00 0.53 H new ATOM 0 HA LEU A 184 -11.059 -3.177 -4.102 1.00 0.51 H new ATOM 0 HB2 LEU A 184 -11.747 -4.274 -6.199 1.00 0.68 H new ATOM 0 HB3 LEU A 184 -11.598 -2.762 -7.072 1.00 0.68 H new ATOM 0 HG LEU A 184 -9.139 -2.762 -6.524 1.00 1.14 H new ATOM 0 HD11 LEU A 184 -8.121 -4.892 -5.828 1.00 1.80 H new ATOM 0 HD12 LEU A 184 -9.200 -4.232 -4.575 1.00 1.80 H new ATOM 0 HD13 LEU A 184 -9.743 -5.586 -5.595 1.00 1.80 H new ATOM 0 HD21 LEU A 184 -8.569 -4.461 -8.211 1.00 2.15 H new ATOM 0 HD22 LEU A 184 -10.211 -5.135 -8.080 1.00 2.15 H new ATOM 0 HD23 LEU A 184 -9.973 -3.485 -8.703 1.00 2.15 H new ATOM 1101 N LEU A 185 -9.620 -1.205 -4.032 1.00 0.32 N ATOM 1102 CA LEU A 185 -8.600 -0.167 -4.016 1.00 0.30 C ATOM 1103 C LEU A 185 -7.257 -0.864 -4.061 1.00 0.29 C ATOM 1104 O LEU A 185 -6.911 -1.592 -3.152 1.00 0.48 O ATOM 1105 CB LEU A 185 -8.681 0.695 -2.747 1.00 0.38 C ATOM 1106 CG LEU A 185 -9.867 1.676 -2.638 1.00 0.55 C ATOM 1107 CD1 LEU A 185 -11.202 1.021 -2.939 1.00 0.99 C ATOM 1108 CD2 LEU A 185 -9.910 2.289 -1.251 1.00 1.07 C ATOM 0 H LEU A 185 -9.548 -1.860 -3.254 1.00 0.32 H new ATOM 0 HA LEU A 185 -8.745 0.497 -4.868 1.00 0.30 H new ATOM 0 HB2 LEU A 185 -8.714 0.027 -1.886 1.00 0.38 H new ATOM 0 HB3 LEU A 185 -7.758 1.270 -2.669 1.00 0.38 H new ATOM 0 HG LEU A 185 -9.704 2.449 -3.389 1.00 0.55 H new ATOM 0 HD11 LEU A 185 -11.999 1.759 -2.847 1.00 0.99 H new ATOM 0 HD12 LEU A 185 -11.192 0.623 -3.954 1.00 0.99 H new ATOM 0 HD13 LEU A 185 -11.376 0.209 -2.233 1.00 0.99 H new ATOM 0 HD21 LEU A 185 -10.751 2.980 -1.184 1.00 1.07 H new ATOM 0 HD22 LEU A 185 -10.029 1.500 -0.508 1.00 1.07 H new ATOM 0 HD23 LEU A 185 -8.982 2.828 -1.062 1.00 1.07 H new ATOM 1120 N HIS A 186 -6.519 -0.655 -5.113 1.00 0.27 N ATOM 1121 CA HIS A 186 -5.356 -1.477 -5.401 1.00 0.30 C ATOM 1122 C HIS A 186 -4.105 -0.632 -5.600 1.00 0.40 C ATOM 1123 O HIS A 186 -4.055 0.101 -6.562 1.00 0.67 O ATOM 1124 CB HIS A 186 -5.682 -2.195 -6.691 1.00 0.44 C ATOM 1125 CG HIS A 186 -4.622 -3.118 -7.217 1.00 0.67 C ATOM 1126 ND1 HIS A 186 -4.749 -4.487 -7.202 1.00 1.18 N ATOM 1127 CD2 HIS A 186 -3.430 -2.865 -7.808 1.00 1.54 C ATOM 1128 CE1 HIS A 186 -3.685 -5.032 -7.753 1.00 1.51 C ATOM 1129 NE2 HIS A 186 -2.866 -4.073 -8.135 1.00 1.79 N ATOM 0 H HIS A 186 -6.696 0.081 -5.797 1.00 0.27 H new ATOM 0 HA HIS A 186 -5.151 -2.157 -4.574 1.00 0.30 H new ATOM 0 HB2 HIS A 186 -6.596 -2.771 -6.542 1.00 0.44 H new ATOM 0 HB3 HIS A 186 -5.897 -1.448 -7.455 1.00 0.44 H new ATOM 0 HD1 HIS A 186 -5.544 -5.001 -6.823 1.00 1.18 H new ATOM 0 HD2 HIS A 186 -3.001 -1.890 -7.989 1.00 1.54 H new ATOM 0 HE1 HIS A 186 -3.512 -6.091 -7.872 1.00 1.51 H new ATOM 1138 N LEU A 187 -3.071 -0.799 -4.788 1.00 0.32 N ATOM 1139 CA LEU A 187 -1.851 -0.053 -4.980 1.00 0.37 C ATOM 1140 C LEU A 187 -0.838 -0.945 -5.633 1.00 0.36 C ATOM 1141 O LEU A 187 -0.506 -1.998 -5.083 1.00 0.35 O ATOM 1142 CB LEU A 187 -1.263 0.399 -3.653 1.00 0.43 C ATOM 1143 CG LEU A 187 -0.060 1.338 -3.760 1.00 0.55 C ATOM 1144 CD1 LEU A 187 -0.458 2.646 -4.415 1.00 1.38 C ATOM 1145 CD2 LEU A 187 0.546 1.593 -2.390 1.00 1.26 C ATOM 0 H LEU A 187 -3.059 -1.442 -3.996 1.00 0.32 H new ATOM 0 HA LEU A 187 -2.083 0.819 -5.591 1.00 0.37 H new ATOM 0 HB2 LEU A 187 -2.044 0.898 -3.079 1.00 0.43 H new ATOM 0 HB3 LEU A 187 -0.966 -0.483 -3.086 1.00 0.43 H new ATOM 0 HG LEU A 187 0.692 0.856 -4.384 1.00 0.55 H new ATOM 0 HD11 LEU A 187 0.412 3.299 -4.481 1.00 1.38 H new ATOM 0 HD12 LEU A 187 -0.842 2.450 -5.416 1.00 1.38 H new ATOM 0 HD13 LEU A 187 -1.231 3.131 -3.819 1.00 1.38 H new ATOM 0 HD21 LEU A 187 1.400 2.263 -2.489 1.00 1.26 H new ATOM 0 HD22 LEU A 187 -0.201 2.050 -1.741 1.00 1.26 H new ATOM 0 HD23 LEU A 187 0.874 0.649 -1.956 1.00 1.26 H new ATOM 1157 N THR A 188 -0.402 -0.521 -6.807 1.00 0.39 N ATOM 1158 CA THR A 188 0.690 -1.136 -7.521 1.00 0.44 C ATOM 1159 C THR A 188 1.973 -0.358 -7.281 1.00 0.50 C ATOM 1160 O THR A 188 2.129 0.777 -7.740 1.00 0.55 O ATOM 1161 CB THR A 188 0.393 -1.174 -9.028 1.00 0.51 C ATOM 1162 OG1 THR A 188 -0.499 -0.112 -9.375 1.00 0.70 O ATOM 1163 CG2 THR A 188 -0.237 -2.489 -9.422 1.00 0.47 C ATOM 0 H THR A 188 -0.809 0.277 -7.295 1.00 0.39 H new ATOM 0 HA THR A 188 0.808 -2.156 -7.155 1.00 0.44 H new ATOM 0 HB THR A 188 1.338 -1.059 -9.560 1.00 0.51 H new ATOM 0 HG1 THR A 188 -0.931 -0.314 -10.231 1.00 0.70 H new ATOM 0 HG21 THR A 188 -0.437 -2.490 -10.493 1.00 0.47 H new ATOM 0 HG22 THR A 188 0.443 -3.305 -9.179 1.00 0.47 H new ATOM 0 HG23 THR A 188 -1.172 -2.622 -8.878 1.00 0.47 H new ATOM 1171 N LEU A 189 2.871 -0.975 -6.552 1.00 0.52 N ATOM 1172 CA LEU A 189 4.107 -0.361 -6.140 1.00 0.58 C ATOM 1173 C LEU A 189 5.295 -1.124 -6.733 1.00 0.61 C ATOM 1174 O LEU A 189 5.490 -2.299 -6.435 1.00 0.67 O ATOM 1175 CB LEU A 189 4.082 -0.344 -4.616 1.00 0.67 C ATOM 1176 CG LEU A 189 5.397 -0.166 -3.869 1.00 0.75 C ATOM 1177 CD1 LEU A 189 6.332 0.801 -4.568 1.00 1.08 C ATOM 1178 CD2 LEU A 189 5.052 0.365 -2.511 1.00 1.21 C ATOM 0 H LEU A 189 2.760 -1.934 -6.223 1.00 0.52 H new ATOM 0 HA LEU A 189 4.217 0.660 -6.505 1.00 0.58 H new ATOM 0 HB2 LEU A 189 3.413 0.458 -4.305 1.00 0.67 H new ATOM 0 HB3 LEU A 189 3.635 -1.280 -4.281 1.00 0.67 H new ATOM 0 HG LEU A 189 5.918 -1.122 -3.819 1.00 0.75 H new ATOM 0 HD11 LEU A 189 7.255 0.893 -3.995 1.00 1.08 H new ATOM 0 HD12 LEU A 189 6.560 0.429 -5.567 1.00 1.08 H new ATOM 0 HD13 LEU A 189 5.854 1.778 -4.645 1.00 1.08 H new ATOM 0 HD21 LEU A 189 5.965 0.510 -1.934 1.00 1.21 H new ATOM 0 HD22 LEU A 189 4.533 1.318 -2.614 1.00 1.21 H new ATOM 0 HD23 LEU A 189 4.407 -0.346 -1.995 1.00 1.21 H new ATOM 1190 N PRO A 190 6.076 -0.456 -7.605 1.00 0.66 N ATOM 1191 CA PRO A 190 7.266 -1.035 -8.253 1.00 0.73 C ATOM 1192 C PRO A 190 8.278 -1.595 -7.258 1.00 0.89 C ATOM 1193 O PRO A 190 8.331 -1.182 -6.097 1.00 0.98 O ATOM 1194 CB PRO A 190 7.881 0.151 -9.003 1.00 0.86 C ATOM 1195 CG PRO A 190 6.748 1.083 -9.233 1.00 0.86 C ATOM 1196 CD PRO A 190 5.840 0.928 -8.048 1.00 0.78 C ATOM 0 HA PRO A 190 6.995 -1.878 -8.888 1.00 0.73 H new ATOM 0 HB2 PRO A 190 8.669 0.624 -8.417 1.00 0.86 H new ATOM 0 HB3 PRO A 190 8.330 -0.166 -9.944 1.00 0.86 H new ATOM 0 HG2 PRO A 190 7.100 2.111 -9.323 1.00 0.86 H new ATOM 0 HG3 PRO A 190 6.226 0.842 -10.159 1.00 0.86 H new ATOM 0 HD2 PRO A 190 6.080 1.646 -7.263 1.00 0.78 H new ATOM 0 HD3 PRO A 190 4.797 1.089 -8.319 1.00 0.78 H new ATOM 1204 N LYS A 191 9.071 -2.551 -7.721 1.00 1.06 N ATOM 1205 CA LYS A 191 10.038 -3.219 -6.872 1.00 1.32 C ATOM 1206 C LYS A 191 11.137 -2.273 -6.412 1.00 1.50 C ATOM 1207 O LYS A 191 11.764 -1.575 -7.212 1.00 1.61 O ATOM 1208 CB LYS A 191 10.646 -4.431 -7.580 1.00 1.60 C ATOM 1209 CG LYS A 191 11.280 -4.142 -8.929 1.00 1.99 C ATOM 1210 CD LYS A 191 11.821 -5.422 -9.546 1.00 2.64 C ATOM 1211 CE LYS A 191 12.494 -5.174 -10.885 1.00 3.26 C ATOM 1212 NZ LYS A 191 13.002 -6.436 -11.480 1.00 3.64 N ATOM 0 H LYS A 191 9.061 -2.880 -8.686 1.00 1.06 H new ATOM 0 HA LYS A 191 9.501 -3.563 -5.988 1.00 1.32 H new ATOM 0 HB2 LYS A 191 11.401 -4.871 -6.929 1.00 1.60 H new ATOM 0 HB3 LYS A 191 9.867 -5.181 -7.716 1.00 1.60 H new ATOM 0 HG2 LYS A 191 10.544 -3.693 -9.595 1.00 1.99 H new ATOM 0 HG3 LYS A 191 12.087 -3.418 -8.811 1.00 1.99 H new ATOM 0 HD2 LYS A 191 12.535 -5.880 -8.862 1.00 2.64 H new ATOM 0 HD3 LYS A 191 11.005 -6.133 -9.677 1.00 2.64 H new ATOM 0 HE2 LYS A 191 11.785 -4.707 -11.569 1.00 3.26 H new ATOM 0 HE3 LYS A 191 13.319 -4.474 -10.755 1.00 3.26 H new ATOM 0 HZ1 LYS A 191 13.456 -6.231 -12.393 1.00 3.64 H new ATOM 0 HZ2 LYS A 191 13.697 -6.868 -10.838 1.00 3.64 H new ATOM 0 HZ3 LYS A 191 12.210 -7.094 -11.627 1.00 3.64 H new ATOM 1226 N LYS A 192 11.339 -2.254 -5.106 1.00 1.73 N ATOM 1227 CA LYS A 192 12.382 -1.462 -4.480 1.00 2.06 C ATOM 1228 C LYS A 192 13.558 -2.377 -4.115 1.00 2.14 C ATOM 1229 O LYS A 192 14.253 -2.884 -4.995 1.00 2.45 O ATOM 1230 CB LYS A 192 11.828 -0.727 -3.235 1.00 2.43 C ATOM 1231 CG LYS A 192 11.137 -1.628 -2.205 1.00 2.74 C ATOM 1232 CD LYS A 192 9.726 -2.020 -2.621 1.00 3.41 C ATOM 1233 CE LYS A 192 9.423 -3.473 -2.276 1.00 4.16 C ATOM 1234 NZ LYS A 192 9.684 -3.785 -0.844 1.00 4.71 N ATOM 0 H LYS A 192 10.779 -2.792 -4.445 1.00 1.73 H new ATOM 0 HA LYS A 192 12.735 -0.701 -5.176 1.00 2.06 H new ATOM 0 HB2 LYS A 192 12.649 -0.204 -2.745 1.00 2.43 H new ATOM 0 HB3 LYS A 192 11.119 0.032 -3.565 1.00 2.43 H new ATOM 0 HG2 LYS A 192 11.732 -2.529 -2.059 1.00 2.74 H new ATOM 0 HG3 LYS A 192 11.099 -1.113 -1.245 1.00 2.74 H new ATOM 0 HD2 LYS A 192 9.006 -1.370 -2.125 1.00 3.41 H new ATOM 0 HD3 LYS A 192 9.607 -1.868 -3.694 1.00 3.41 H new ATOM 0 HE2 LYS A 192 8.380 -3.688 -2.507 1.00 4.16 H new ATOM 0 HE3 LYS A 192 10.030 -4.126 -2.903 1.00 4.16 H new ATOM 0 HZ1 LYS A 192 9.005 -4.501 -0.516 1.00 4.71 H new ATOM 0 HZ2 LYS A 192 10.652 -4.151 -0.739 1.00 4.71 H new ATOM 0 HZ3 LYS A 192 9.577 -2.921 -0.275 1.00 4.71 H new ATOM 1248 N VAL A 193 13.773 -2.592 -2.829 1.00 2.09 N ATOM 1249 CA VAL A 193 14.656 -3.643 -2.365 1.00 2.30 C ATOM 1250 C VAL A 193 13.821 -4.805 -1.849 1.00 2.34 C ATOM 1251 O VAL A 193 13.014 -4.648 -0.934 1.00 2.29 O ATOM 1252 CB VAL A 193 15.635 -3.144 -1.274 1.00 2.58 C ATOM 1253 CG1 VAL A 193 16.648 -2.183 -1.875 1.00 2.90 C ATOM 1254 CG2 VAL A 193 14.889 -2.469 -0.129 1.00 2.95 C ATOM 0 H VAL A 193 13.343 -2.046 -2.083 1.00 2.09 H new ATOM 0 HA VAL A 193 15.267 -3.972 -3.205 1.00 2.30 H new ATOM 0 HB VAL A 193 16.159 -4.011 -0.872 1.00 2.58 H new ATOM 0 HG11 VAL A 193 17.330 -1.840 -1.097 1.00 2.90 H new ATOM 0 HG12 VAL A 193 17.214 -2.692 -2.655 1.00 2.90 H new ATOM 0 HG13 VAL A 193 16.127 -1.327 -2.304 1.00 2.90 H new ATOM 0 HG21 VAL A 193 15.604 -2.130 0.621 1.00 2.95 H new ATOM 0 HG22 VAL A 193 14.331 -1.614 -0.512 1.00 2.95 H new ATOM 0 HG23 VAL A 193 14.198 -3.180 0.324 1.00 2.95 H new ATOM 1264 N PRO A 194 13.932 -5.961 -2.506 1.00 2.59 N ATOM 1265 CA PRO A 194 13.195 -7.163 -2.137 1.00 2.88 C ATOM 1266 C PRO A 194 13.825 -7.909 -0.962 1.00 3.13 C ATOM 1267 O PRO A 194 14.967 -7.631 -0.607 1.00 3.21 O ATOM 1268 CB PRO A 194 13.261 -7.999 -3.407 1.00 3.34 C ATOM 1269 CG PRO A 194 14.585 -7.659 -3.978 1.00 3.19 C ATOM 1270 CD PRO A 194 14.802 -6.200 -3.675 1.00 2.80 C ATOM 0 HA PRO A 194 12.182 -6.939 -1.801 1.00 2.88 H new ATOM 0 HB2 PRO A 194 13.179 -9.064 -3.191 1.00 3.34 H new ATOM 0 HB3 PRO A 194 12.452 -7.750 -4.094 1.00 3.34 H new ATOM 0 HG2 PRO A 194 15.370 -8.271 -3.535 1.00 3.19 H new ATOM 0 HG3 PRO A 194 14.606 -7.842 -5.052 1.00 3.19 H new ATOM 0 HD2 PRO A 194 15.847 -5.988 -3.449 1.00 2.80 H new ATOM 0 HD3 PRO A 194 14.524 -5.569 -4.519 1.00 2.80 H new ATOM 1278 N MET A 195 13.032 -8.788 -0.325 1.00 3.35 N ATOM 1279 CA MET A 195 13.527 -9.790 0.638 1.00 3.77 C ATOM 1280 C MET A 195 13.830 -9.129 1.963 1.00 3.52 C ATOM 1281 O MET A 195 14.416 -9.724 2.872 1.00 3.93 O ATOM 1282 CB MET A 195 14.756 -10.552 0.106 1.00 4.38 C ATOM 1283 CG MET A 195 16.100 -9.934 0.482 1.00 4.43 C ATOM 1284 SD MET A 195 17.476 -10.674 -0.418 1.00 5.16 S ATOM 1285 CE MET A 195 16.909 -10.477 -2.105 1.00 5.60 C ATOM 0 H MET A 195 12.022 -8.824 -0.464 1.00 3.35 H new ATOM 0 HA MET A 195 12.739 -10.529 0.782 1.00 3.77 H new ATOM 0 HB2 MET A 195 14.724 -11.575 0.482 1.00 4.38 H new ATOM 0 HB3 MET A 195 14.689 -10.610 -0.980 1.00 4.38 H new ATOM 0 HG2 MET A 195 16.073 -8.863 0.281 1.00 4.43 H new ATOM 0 HG3 MET A 195 16.264 -10.053 1.553 1.00 4.43 H new ATOM 0 HE1 MET A 195 17.757 -10.245 -2.749 1.00 5.60 H new ATOM 0 HE2 MET A 195 16.440 -11.402 -2.442 1.00 5.60 H new ATOM 0 HE3 MET A 195 16.184 -9.664 -2.153 1.00 5.60 H new ATOM 1295 N LEU A 196 13.378 -7.903 2.066 1.00 2.98 N ATOM 1296 CA LEU A 196 13.534 -7.135 3.264 1.00 2.89 C ATOM 1297 C LEU A 196 12.496 -7.572 4.257 1.00 2.64 C ATOM 1298 O LEU A 196 11.334 -7.805 3.905 1.00 2.41 O ATOM 1299 CB LEU A 196 13.417 -5.646 2.981 1.00 2.77 C ATOM 1300 CG LEU A 196 12.016 -5.103 2.660 1.00 3.23 C ATOM 1301 CD1 LEU A 196 12.070 -3.592 2.518 1.00 3.64 C ATOM 1302 CD2 LEU A 196 11.446 -5.721 1.393 1.00 3.80 C ATOM 0 H LEU A 196 12.891 -7.414 1.315 1.00 2.98 H new ATOM 0 HA LEU A 196 14.529 -7.307 3.674 1.00 2.89 H new ATOM 0 HB2 LEU A 196 13.799 -5.106 3.847 1.00 2.77 H new ATOM 0 HB3 LEU A 196 14.072 -5.408 2.143 1.00 2.77 H new ATOM 0 HG LEU A 196 11.358 -5.373 3.486 1.00 3.23 H new ATOM 0 HD11 LEU A 196 11.074 -3.212 2.290 1.00 3.64 H new ATOM 0 HD12 LEU A 196 12.422 -3.151 3.451 1.00 3.64 H new ATOM 0 HD13 LEU A 196 12.753 -3.327 1.711 1.00 3.64 H new ATOM 0 HD21 LEU A 196 10.455 -5.310 1.202 1.00 3.80 H new ATOM 0 HD22 LEU A 196 12.101 -5.495 0.551 1.00 3.80 H new ATOM 0 HD23 LEU A 196 11.373 -6.802 1.516 1.00 3.80 H new ATOM 1314 N THR A 197 12.910 -7.720 5.484 1.00 2.86 N ATOM 1315 CA THR A 197 12.086 -8.390 6.434 1.00 2.73 C ATOM 1316 C THR A 197 11.363 -7.417 7.340 1.00 2.44 C ATOM 1317 O THR A 197 11.948 -6.765 8.211 1.00 2.80 O ATOM 1318 CB THR A 197 12.966 -9.371 7.207 1.00 3.34 C ATOM 1319 OG1 THR A 197 13.941 -8.674 7.995 1.00 3.71 O ATOM 1320 CG2 THR A 197 13.681 -10.218 6.183 1.00 3.84 C ATOM 0 H THR A 197 13.805 -7.387 5.842 1.00 2.86 H new ATOM 0 HA THR A 197 11.296 -8.940 5.923 1.00 2.73 H new ATOM 0 HB THR A 197 12.354 -9.972 7.880 1.00 3.34 H new ATOM 0 HG1 THR A 197 13.554 -7.838 8.329 1.00 3.71 H new ATOM 0 HG21 THR A 197 14.324 -10.937 6.691 1.00 3.84 H new ATOM 0 HG22 THR A 197 12.949 -10.751 5.577 1.00 3.84 H new ATOM 0 HG23 THR A 197 14.287 -9.579 5.541 1.00 3.84 H new ATOM 1328 N TRP A 198 10.084 -7.300 7.074 1.00 2.12 N ATOM 1329 CA TRP A 198 9.160 -6.630 7.952 1.00 2.18 C ATOM 1330 C TRP A 198 8.088 -7.603 8.431 1.00 2.10 C ATOM 1331 O TRP A 198 7.638 -8.468 7.675 1.00 1.86 O ATOM 1332 CB TRP A 198 8.551 -5.436 7.222 1.00 2.35 C ATOM 1333 CG TRP A 198 8.375 -5.689 5.758 1.00 2.45 C ATOM 1334 CD1 TRP A 198 8.111 -6.883 5.167 1.00 2.79 C ATOM 1335 CD2 TRP A 198 8.472 -4.739 4.703 1.00 2.74 C ATOM 1336 NE1 TRP A 198 8.015 -6.737 3.820 1.00 2.99 N ATOM 1337 CE2 TRP A 198 8.227 -5.430 3.509 1.00 2.99 C ATOM 1338 CE3 TRP A 198 8.728 -3.374 4.651 1.00 3.25 C ATOM 1339 CZ2 TRP A 198 8.234 -4.815 2.284 1.00 3.56 C ATOM 1340 CZ3 TRP A 198 8.736 -2.747 3.419 1.00 3.96 C ATOM 1341 CH2 TRP A 198 8.487 -3.471 2.244 1.00 4.04 C ATOM 0 H TRP A 198 9.652 -7.673 6.229 1.00 2.12 H new ATOM 0 HA TRP A 198 9.685 -6.264 8.834 1.00 2.18 H new ATOM 0 HB2 TRP A 198 7.584 -5.198 7.665 1.00 2.35 H new ATOM 0 HB3 TRP A 198 9.190 -4.564 7.363 1.00 2.35 H new ATOM 0 HD1 TRP A 198 7.994 -7.818 5.694 1.00 2.79 H new ATOM 0 HE1 TRP A 198 7.817 -7.483 3.153 1.00 2.99 H new ATOM 0 HE3 TRP A 198 8.917 -2.814 5.555 1.00 3.25 H new ATOM 0 HZ2 TRP A 198 8.046 -5.374 1.379 1.00 3.56 H new ATOM 0 HZ3 TRP A 198 8.936 -1.687 3.361 1.00 3.96 H new ATOM 0 HH2 TRP A 198 8.495 -2.960 1.293 1.00 4.04 H new ATOM 1352 N PRO A 199 7.691 -7.491 9.708 1.00 2.57 N ATOM 1353 CA PRO A 199 6.674 -8.356 10.303 1.00 2.78 C ATOM 1354 C PRO A 199 5.308 -8.179 9.650 1.00 2.32 C ATOM 1355 O PRO A 199 4.441 -9.048 9.746 1.00 2.35 O ATOM 1356 CB PRO A 199 6.623 -7.915 11.770 1.00 3.36 C ATOM 1357 CG PRO A 199 7.207 -6.547 11.783 1.00 3.70 C ATOM 1358 CD PRO A 199 8.219 -6.522 10.675 1.00 3.21 C ATOM 0 HA PRO A 199 6.921 -9.410 10.174 1.00 2.78 H new ATOM 0 HB2 PRO A 199 5.600 -7.910 12.145 1.00 3.36 H new ATOM 0 HB3 PRO A 199 7.192 -8.593 12.406 1.00 3.36 H new ATOM 0 HG2 PRO A 199 6.437 -5.792 11.626 1.00 3.70 H new ATOM 0 HG3 PRO A 199 7.674 -6.331 12.744 1.00 3.70 H new ATOM 0 HD2 PRO A 199 8.311 -5.528 10.238 1.00 3.21 H new ATOM 0 HD3 PRO A 199 9.210 -6.807 11.029 1.00 3.21 H new ATOM 1366 N SER A 200 5.129 -7.053 8.978 1.00 1.98 N ATOM 1367 CA SER A 200 3.908 -6.747 8.290 1.00 1.64 C ATOM 1368 C SER A 200 4.208 -5.683 7.250 1.00 1.46 C ATOM 1369 O SER A 200 5.313 -5.144 7.224 1.00 1.48 O ATOM 1370 CB SER A 200 2.825 -6.262 9.265 1.00 1.61 C ATOM 1371 OG SER A 200 1.585 -6.067 8.601 1.00 2.22 O ATOM 0 H SER A 200 5.840 -6.326 8.901 1.00 1.98 H new ATOM 0 HA SER A 200 3.523 -7.647 7.809 1.00 1.64 H new ATOM 0 HB2 SER A 200 2.701 -6.991 10.066 1.00 1.61 H new ATOM 0 HB3 SER A 200 3.142 -5.328 9.730 1.00 1.61 H new ATOM 0 HG SER A 200 0.914 -5.760 9.245 1.00 2.22 H new ATOM 1377 N LEU A 201 3.245 -5.405 6.402 1.00 1.48 N ATOM 1378 CA LEU A 201 3.395 -4.390 5.363 1.00 1.53 C ATOM 1379 C LEU A 201 3.747 -3.062 6.005 1.00 1.27 C ATOM 1380 O LEU A 201 4.669 -2.365 5.580 1.00 1.34 O ATOM 1381 CB LEU A 201 2.074 -4.230 4.596 1.00 1.86 C ATOM 1382 CG LEU A 201 2.197 -3.759 3.142 1.00 2.53 C ATOM 1383 CD1 LEU A 201 2.651 -2.311 3.081 1.00 3.12 C ATOM 1384 CD2 LEU A 201 3.160 -4.652 2.374 1.00 3.06 C ATOM 0 H LEU A 201 2.336 -5.869 6.405 1.00 1.48 H new ATOM 0 HA LEU A 201 4.184 -4.698 4.677 1.00 1.53 H new ATOM 0 HB2 LEU A 201 1.553 -5.187 4.605 1.00 1.86 H new ATOM 0 HB3 LEU A 201 1.447 -3.521 5.136 1.00 1.86 H new ATOM 0 HG LEU A 201 1.214 -3.827 2.676 1.00 2.53 H new ATOM 0 HD11 LEU A 201 2.731 -1.998 2.040 1.00 3.12 H new ATOM 0 HD12 LEU A 201 1.925 -1.680 3.594 1.00 3.12 H new ATOM 0 HD13 LEU A 201 3.623 -2.214 3.565 1.00 3.12 H new ATOM 0 HD21 LEU A 201 3.236 -4.304 1.344 1.00 3.06 H new ATOM 0 HD22 LEU A 201 4.143 -4.615 2.843 1.00 3.06 H new ATOM 0 HD23 LEU A 201 2.792 -5.678 2.384 1.00 3.06 H new ATOM 1396 N LEU A 202 3.028 -2.747 7.063 1.00 1.16 N ATOM 1397 CA LEU A 202 3.198 -1.512 7.748 1.00 1.12 C ATOM 1398 C LEU A 202 3.906 -1.764 9.058 1.00 1.18 C ATOM 1399 O LEU A 202 3.505 -2.629 9.840 1.00 1.36 O ATOM 1400 CB LEU A 202 1.833 -0.889 7.990 1.00 1.37 C ATOM 1401 CG LEU A 202 1.801 0.196 9.046 1.00 2.56 C ATOM 1402 CD1 LEU A 202 2.404 1.457 8.487 1.00 3.06 C ATOM 1403 CD2 LEU A 202 0.378 0.406 9.513 1.00 3.24 C ATOM 0 H LEU A 202 2.311 -3.352 7.462 1.00 1.16 H new ATOM 0 HA LEU A 202 3.800 -0.827 7.151 1.00 1.12 H new ATOM 0 HB2 LEU A 202 1.470 -0.472 7.051 1.00 1.37 H new ATOM 0 HB3 LEU A 202 1.137 -1.677 8.279 1.00 1.37 H new ATOM 0 HG LEU A 202 2.393 -0.100 9.912 1.00 2.56 H new ATOM 0 HD11 LEU A 202 2.381 2.239 9.246 1.00 3.06 H new ATOM 0 HD12 LEU A 202 3.436 1.267 8.192 1.00 3.06 H new ATOM 0 HD13 LEU A 202 1.832 1.779 7.617 1.00 3.06 H new ATOM 0 HD21 LEU A 202 0.356 1.187 10.273 1.00 3.24 H new ATOM 0 HD22 LEU A 202 -0.242 0.705 8.668 1.00 3.24 H new ATOM 0 HD23 LEU A 202 -0.007 -0.522 9.935 1.00 3.24 H new ATOM 1415 N VAL A 203 4.960 -1.017 9.285 1.00 1.19 N ATOM 1416 CA VAL A 203 5.708 -1.130 10.515 1.00 1.44 C ATOM 1417 C VAL A 203 5.985 0.252 11.056 1.00 1.43 C ATOM 1418 O VAL A 203 5.397 0.688 12.047 1.00 2.00 O ATOM 1419 CB VAL A 203 7.062 -1.826 10.312 1.00 1.69 C ATOM 1420 CG1 VAL A 203 7.665 -2.197 11.656 1.00 2.05 C ATOM 1421 CG2 VAL A 203 6.936 -3.053 9.419 1.00 2.01 C ATOM 0 H VAL A 203 5.320 -0.322 8.631 1.00 1.19 H new ATOM 0 HA VAL A 203 5.107 -1.724 11.203 1.00 1.44 H new ATOM 0 HB VAL A 203 7.728 -1.126 9.807 1.00 1.69 H new ATOM 0 HG11 VAL A 203 8.625 -2.690 11.501 1.00 2.05 H new ATOM 0 HG12 VAL A 203 7.812 -1.295 12.250 1.00 2.05 H new ATOM 0 HG13 VAL A 203 6.991 -2.873 12.183 1.00 2.05 H new ATOM 0 HG21 VAL A 203 7.915 -3.518 9.299 1.00 2.01 H new ATOM 0 HG22 VAL A 203 6.249 -3.766 9.875 1.00 2.01 H new ATOM 0 HG23 VAL A 203 6.554 -2.755 8.443 1.00 2.01 H new ATOM 1431 N GLU A 204 6.903 0.910 10.366 1.00 1.46 N ATOM 1432 CA GLU A 204 7.249 2.300 10.602 1.00 1.75 C ATOM 1433 C GLU A 204 7.981 2.464 11.931 1.00 2.25 C ATOM 1434 O GLU A 204 9.223 2.331 11.944 1.00 2.80 O ATOM 1435 CB GLU A 204 5.991 3.152 10.566 1.00 2.00 C ATOM 1436 CG GLU A 204 6.254 4.633 10.359 1.00 2.67 C ATOM 1437 CD GLU A 204 5.043 5.484 10.667 1.00 3.03 C ATOM 1438 OE1 GLU A 204 5.216 6.590 11.222 1.00 3.44 O ATOM 1439 OE2 GLU A 204 3.910 5.048 10.375 1.00 3.27 O ATOM 1440 OXT GLU A 204 7.314 2.701 12.956 1.00 2.67 O ATOM 0 H GLU A 204 7.439 0.482 9.611 1.00 1.46 H new ATOM 0 HA GLU A 204 7.924 2.633 9.814 1.00 1.75 H new ATOM 0 HB2 GLU A 204 5.344 2.793 9.766 1.00 2.00 H new ATOM 0 HB3 GLU A 204 5.446 3.017 11.501 1.00 2.00 H new ATOM 0 HG2 GLU A 204 7.084 4.944 10.994 1.00 2.67 H new ATOM 0 HG3 GLU A 204 6.561 4.804 9.327 1.00 2.67 H new TER 1447 GLU A 204