USER MOD reduce.3.24.130724 H: found=0, std=0, add=729, rem=0, adj=19 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 167 TYR OH : rot 110:sc= 0.804 USER MOD Set 1.2: A 192 LYS NZ :NH3+ -177:sc= 0.911 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 30:sc= 0.296 USER MOD Single : A 122 GLN : amide:sc= -11.4! C(o=-11!,f=-3.2!) USER MOD Single : A 123 SER OG : rot 180:sc= -0.0945 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 GLN : amide:sc= -6.64! K(o=-6.6!,f=-0.3) USER MOD Single : A 148 THR OG1 : rot 95:sc= 0.605 USER MOD Single : A 150 THR OG1 : rot 180:sc= 0 USER MOD Single : A 152 CYS SG : rot 124:sc= -0.206 USER MOD Single : A 160 GLN : amide:sc= -8.67! C(o=-8.7!,f=-8.8!) USER MOD Single : A 161 GLN : amide:sc= -1.21 K(o=-1.2,f=-0.01) USER MOD Single : A 171 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 172 SER OG : rot 180:sc= 0 USER MOD Single : A 173 SER OG : rot -51:sc= 0.965 USER MOD Single : A 174 CYS SG : rot 25:sc= 1.15 USER MOD Single : A 176 LYS NZ :NH3+ -132:sc= 1.16 (180deg=-0.917) USER MOD Single : A 178 GLN : amide:sc= -4.58! C(o=-4.6!,f=-5.3!) USER MOD Single : A 179 THR OG1 : rot 180:sc= -0.0594 USER MOD Single : A 181 LYS NZ :NH3+ -166:sc= -0.014 (180deg=-0.172) USER MOD Single : A 183 SER OG : rot -39:sc= 0.476 USER MOD Single : A 186 HIS : no HE2:sc= -1.53 X(o=-1.5,f=-1.7) USER MOD Single : A 188 THR OG1 : rot -168:sc= -4.69! USER MOD Single : A 191 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 195 MET CE :methyl 155:sc= -0.285 (180deg=-1.03) USER MOD Single : A 197 THR OG1 : rot 24:sc= 0.543 USER MOD Single : A 200 SER OG : rot 118:sc= 1.27 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 113 -10.185 -2.137 8.542 1.00 7.11 N ATOM 2 CA THR A 113 -10.432 -3.582 8.422 1.00 6.14 C ATOM 3 C THR A 113 -11.811 -3.802 7.831 1.00 5.79 C ATOM 4 O THR A 113 -12.817 -3.625 8.518 1.00 6.50 O ATOM 5 CB THR A 113 -10.366 -4.264 9.801 1.00 6.71 C ATOM 6 OG1 THR A 113 -9.242 -3.767 10.539 1.00 7.38 O ATOM 7 CG2 THR A 113 -10.253 -5.777 9.659 1.00 6.15 C ATOM 0 HA THR A 113 -9.666 -4.014 7.778 1.00 6.14 H new ATOM 0 HB THR A 113 -11.287 -4.034 10.336 1.00 6.71 H new ATOM 0 HG1 THR A 113 -9.054 -2.844 10.267 1.00 7.38 H new ATOM 0 HG21 THR A 113 -10.208 -6.233 10.648 1.00 6.15 H new ATOM 0 HG22 THR A 113 -11.122 -6.158 9.123 1.00 6.15 H new ATOM 0 HG23 THR A 113 -9.348 -6.024 9.104 1.00 6.15 H new ATOM 17 N PRO A 114 -11.901 -4.154 6.543 1.00 4.87 N ATOM 18 CA PRO A 114 -13.191 -4.341 5.898 1.00 4.81 C ATOM 19 C PRO A 114 -13.880 -5.613 6.369 1.00 4.53 C ATOM 20 O PRO A 114 -13.218 -6.580 6.754 1.00 4.06 O ATOM 21 CB PRO A 114 -12.834 -4.423 4.428 1.00 4.27 C ATOM 22 CG PRO A 114 -11.489 -5.033 4.440 1.00 3.42 C ATOM 23 CD PRO A 114 -10.783 -4.433 5.616 1.00 4.00 C ATOM 0 HA PRO A 114 -13.895 -3.541 6.126 1.00 4.81 H new ATOM 0 HB2 PRO A 114 -13.548 -5.033 3.874 1.00 4.27 H new ATOM 0 HB3 PRO A 114 -12.825 -3.438 3.960 1.00 4.27 H new ATOM 0 HG2 PRO A 114 -11.552 -6.117 4.532 1.00 3.42 H new ATOM 0 HG3 PRO A 114 -10.955 -4.822 3.513 1.00 3.42 H new ATOM 0 HD2 PRO A 114 -10.057 -5.121 6.049 1.00 4.00 H new ATOM 0 HD3 PRO A 114 -10.242 -3.526 5.347 1.00 4.00 H new ATOM 31 N GLU A 115 -15.204 -5.621 6.329 1.00 5.07 N ATOM 32 CA GLU A 115 -15.968 -6.753 6.827 1.00 5.19 C ATOM 33 C GLU A 115 -15.982 -7.891 5.808 1.00 4.43 C ATOM 34 O GLU A 115 -17.015 -8.198 5.213 1.00 4.78 O ATOM 35 CB GLU A 115 -17.394 -6.322 7.160 1.00 6.23 C ATOM 36 CG GLU A 115 -17.915 -6.899 8.466 1.00 6.90 C ATOM 37 CD GLU A 115 -17.807 -8.409 8.535 1.00 7.69 C ATOM 38 OE1 GLU A 115 -18.772 -9.094 8.130 1.00 8.15 O ATOM 39 OE2 GLU A 115 -16.756 -8.918 8.982 1.00 8.07 O ATOM 0 H GLU A 115 -15.770 -4.858 5.958 1.00 5.07 H new ATOM 0 HA GLU A 115 -15.488 -7.116 7.736 1.00 5.19 H new ATOM 0 HB2 GLU A 115 -17.433 -5.234 7.212 1.00 6.23 H new ATOM 0 HB3 GLU A 115 -18.055 -6.626 6.349 1.00 6.23 H new ATOM 0 HG2 GLU A 115 -17.359 -6.463 9.296 1.00 6.90 H new ATOM 0 HG3 GLU A 115 -18.958 -6.609 8.594 1.00 6.90 H new ATOM 46 N LEU A 116 -14.822 -8.502 5.616 1.00 3.64 N ATOM 47 CA LEU A 116 -14.668 -9.642 4.718 1.00 3.32 C ATOM 48 C LEU A 116 -13.231 -10.129 4.754 1.00 2.70 C ATOM 49 O LEU A 116 -12.937 -11.206 5.274 1.00 3.08 O ATOM 50 CB LEU A 116 -15.044 -9.276 3.276 1.00 3.81 C ATOM 51 CG LEU A 116 -14.976 -10.431 2.274 1.00 4.59 C ATOM 52 CD1 LEU A 116 -15.940 -11.541 2.664 1.00 5.28 C ATOM 53 CD2 LEU A 116 -15.275 -9.931 0.870 1.00 5.24 C ATOM 0 H LEU A 116 -13.957 -8.222 6.079 1.00 3.64 H new ATOM 0 HA LEU A 116 -15.340 -10.430 5.057 1.00 3.32 H new ATOM 0 HB2 LEU A 116 -16.056 -8.872 3.272 1.00 3.81 H new ATOM 0 HB3 LEU A 116 -14.382 -8.480 2.935 1.00 3.81 H new ATOM 0 HG LEU A 116 -13.966 -10.840 2.289 1.00 4.59 H new ATOM 0 HD11 LEU A 116 -15.875 -12.351 1.938 1.00 5.28 H new ATOM 0 HD12 LEU A 116 -15.680 -11.918 3.653 1.00 5.28 H new ATOM 0 HD13 LEU A 116 -16.957 -11.150 2.681 1.00 5.28 H new ATOM 0 HD21 LEU A 116 -15.223 -10.764 0.168 1.00 5.24 H new ATOM 0 HD22 LEU A 116 -16.274 -9.496 0.844 1.00 5.24 H new ATOM 0 HD23 LEU A 116 -14.543 -9.174 0.590 1.00 5.24 H new ATOM 65 N ALA A 117 -12.337 -9.302 4.223 1.00 2.22 N ATOM 66 CA ALA A 117 -10.923 -9.629 4.137 1.00 1.98 C ATOM 67 C ALA A 117 -10.128 -8.425 3.646 1.00 1.62 C ATOM 68 O ALA A 117 -10.654 -7.575 2.928 1.00 1.76 O ATOM 69 CB ALA A 117 -10.713 -10.809 3.196 1.00 2.55 C ATOM 0 H ALA A 117 -12.575 -8.387 3.841 1.00 2.22 H new ATOM 0 HA ALA A 117 -10.569 -9.901 5.132 1.00 1.98 H new ATOM 0 HB1 ALA A 117 -9.650 -11.045 3.140 1.00 2.55 H new ATOM 0 HB2 ALA A 117 -11.257 -11.675 3.572 1.00 2.55 H new ATOM 0 HB3 ALA A 117 -11.081 -10.552 2.203 1.00 2.55 H new ATOM 75 N LEU A 118 -8.871 -8.357 4.050 1.00 1.44 N ATOM 76 CA LEU A 118 -7.944 -7.349 3.551 1.00 1.29 C ATOM 77 C LEU A 118 -6.958 -8.070 2.649 1.00 0.93 C ATOM 78 O LEU A 118 -6.329 -9.026 3.102 1.00 0.99 O ATOM 79 CB LEU A 118 -7.142 -6.702 4.686 1.00 1.74 C ATOM 80 CG LEU A 118 -7.943 -6.160 5.880 1.00 2.42 C ATOM 81 CD1 LEU A 118 -8.392 -7.283 6.805 1.00 3.17 C ATOM 82 CD2 LEU A 118 -7.117 -5.138 6.648 1.00 2.96 C ATOM 0 H LEU A 118 -8.462 -8.996 4.732 1.00 1.44 H new ATOM 0 HA LEU A 118 -8.507 -6.569 3.039 1.00 1.29 H new ATOM 0 HB2 LEU A 118 -6.430 -7.437 5.061 1.00 1.74 H new ATOM 0 HB3 LEU A 118 -6.561 -5.881 4.266 1.00 1.74 H new ATOM 0 HG LEU A 118 -8.837 -5.673 5.491 1.00 2.42 H new ATOM 0 HD11 LEU A 118 -8.956 -6.864 7.639 1.00 3.17 H new ATOM 0 HD12 LEU A 118 -9.024 -7.979 6.253 1.00 3.17 H new ATOM 0 HD13 LEU A 118 -7.518 -7.811 7.187 1.00 3.17 H new ATOM 0 HD21 LEU A 118 -7.696 -4.762 7.491 1.00 2.96 H new ATOM 0 HD22 LEU A 118 -6.205 -5.609 7.015 1.00 2.96 H new ATOM 0 HD23 LEU A 118 -6.857 -4.310 5.988 1.00 2.96 H new ATOM 94 N ASP A 119 -6.789 -7.674 1.397 1.00 0.79 N ATOM 95 CA ASP A 119 -5.928 -8.476 0.545 1.00 0.65 C ATOM 96 C ASP A 119 -4.783 -7.667 -0.031 1.00 0.56 C ATOM 97 O ASP A 119 -4.982 -6.610 -0.604 1.00 0.59 O ATOM 98 CB ASP A 119 -6.730 -9.129 -0.583 1.00 0.84 C ATOM 99 CG ASP A 119 -5.896 -10.103 -1.397 1.00 1.06 C ATOM 100 OD1 ASP A 119 -5.350 -9.693 -2.446 1.00 1.51 O ATOM 101 OD2 ASP A 119 -5.779 -11.277 -0.992 1.00 1.42 O ATOM 0 H ASP A 119 -7.210 -6.850 0.967 1.00 0.79 H new ATOM 0 HA ASP A 119 -5.500 -9.257 1.174 1.00 0.65 H new ATOM 0 HB2 ASP A 119 -7.586 -9.654 -0.160 1.00 0.84 H new ATOM 0 HB3 ASP A 119 -7.124 -8.354 -1.241 1.00 0.84 H new ATOM 106 N TRP A 120 -3.585 -8.195 0.126 1.00 0.54 N ATOM 107 CA TRP A 120 -2.368 -7.589 -0.369 1.00 0.57 C ATOM 108 C TRP A 120 -1.502 -8.661 -0.963 1.00 0.74 C ATOM 109 O TRP A 120 -1.762 -9.855 -0.792 1.00 0.85 O ATOM 110 CB TRP A 120 -1.577 -6.954 0.760 1.00 0.65 C ATOM 111 CG TRP A 120 -2.455 -6.231 1.718 1.00 0.64 C ATOM 112 CD1 TRP A 120 -3.375 -5.289 1.401 1.00 0.60 C ATOM 113 CD2 TRP A 120 -2.536 -6.425 3.132 1.00 0.76 C ATOM 114 NE1 TRP A 120 -4.016 -4.855 2.535 1.00 0.73 N ATOM 115 CE2 TRP A 120 -3.516 -5.537 3.614 1.00 0.82 C ATOM 116 CE3 TRP A 120 -1.869 -7.251 4.040 1.00 0.88 C ATOM 117 CZ2 TRP A 120 -3.847 -5.457 4.960 1.00 0.99 C ATOM 118 CZ3 TRP A 120 -2.199 -7.171 5.377 1.00 1.02 C ATOM 119 CH2 TRP A 120 -3.180 -6.279 5.827 1.00 1.08 C ATOM 0 H TRP A 120 -3.429 -9.078 0.613 1.00 0.54 H new ATOM 0 HA TRP A 120 -2.641 -6.830 -1.102 1.00 0.57 H new ATOM 0 HB2 TRP A 120 -1.020 -7.726 1.291 1.00 0.65 H new ATOM 0 HB3 TRP A 120 -0.845 -6.261 0.345 1.00 0.65 H new ATOM 0 HD1 TRP A 120 -3.575 -4.931 0.402 1.00 0.60 H new ATOM 0 HE1 TRP A 120 -4.745 -4.142 2.569 1.00 0.73 H new ATOM 0 HE3 TRP A 120 -1.109 -7.940 3.701 1.00 0.88 H new ATOM 0 HZ2 TRP A 120 -4.604 -4.771 5.310 1.00 0.99 H new ATOM 0 HZ3 TRP A 120 -1.692 -7.807 6.088 1.00 1.02 H new ATOM 0 HH2 TRP A 120 -3.415 -6.239 6.880 1.00 1.08 H new ATOM 130 N ARG A 121 -0.483 -8.240 -1.650 1.00 0.81 N ATOM 131 CA ARG A 121 0.540 -9.138 -2.088 1.00 1.06 C ATOM 132 C ARG A 121 1.853 -8.395 -2.131 1.00 1.14 C ATOM 133 O ARG A 121 1.885 -7.169 -2.196 1.00 1.05 O ATOM 134 CB ARG A 121 0.222 -9.678 -3.460 1.00 1.20 C ATOM 135 CG ARG A 121 0.794 -8.814 -4.557 1.00 1.31 C ATOM 136 CD ARG A 121 -0.109 -8.759 -5.750 1.00 1.18 C ATOM 137 NE ARG A 121 -0.313 -10.084 -6.338 1.00 1.60 N ATOM 138 CZ ARG A 121 -1.067 -10.325 -7.405 1.00 1.99 C ATOM 139 NH1 ARG A 121 -1.718 -9.338 -8.006 1.00 2.34 N ATOM 140 NH2 ARG A 121 -1.162 -11.563 -7.872 1.00 2.57 N ATOM 0 H ARG A 121 -0.338 -7.267 -1.921 1.00 0.81 H new ATOM 0 HA ARG A 121 0.602 -9.976 -1.394 1.00 1.06 H new ATOM 0 HB2 ARG A 121 0.618 -10.689 -3.552 1.00 1.20 H new ATOM 0 HB3 ARG A 121 -0.859 -9.747 -3.580 1.00 1.20 H new ATOM 0 HG2 ARG A 121 0.957 -7.805 -4.178 1.00 1.31 H new ATOM 0 HG3 ARG A 121 1.767 -9.203 -4.856 1.00 1.31 H new ATOM 0 HD2 ARG A 121 -1.071 -8.338 -5.458 1.00 1.18 H new ATOM 0 HD3 ARG A 121 0.317 -8.091 -6.498 1.00 1.18 H new ATOM 0 HE ARG A 121 0.156 -10.876 -5.899 1.00 1.60 H new ATOM 0 HH11 ARG A 121 -1.642 -8.385 -7.650 1.00 2.34 H new ATOM 0 HH12 ARG A 121 -2.295 -9.532 -8.825 1.00 2.34 H new ATOM 0 HH21 ARG A 121 -0.658 -12.322 -7.412 1.00 2.57 H new ATOM 0 HH22 ARG A 121 -1.739 -11.756 -8.691 1.00 2.57 H new ATOM 154 N GLN A 122 2.920 -9.125 -2.071 1.00 1.38 N ATOM 155 CA GLN A 122 4.217 -8.560 -2.331 1.00 1.54 C ATOM 156 C GLN A 122 5.055 -9.542 -3.134 1.00 1.87 C ATOM 157 O GLN A 122 5.028 -10.747 -2.892 1.00 2.08 O ATOM 158 CB GLN A 122 4.869 -8.219 -0.976 1.00 1.73 C ATOM 159 CG GLN A 122 6.392 -8.174 -0.964 1.00 2.15 C ATOM 160 CD GLN A 122 6.966 -6.898 -1.538 1.00 2.06 C ATOM 161 OE1 GLN A 122 8.020 -6.429 -1.116 1.00 2.16 O ATOM 162 NE2 GLN A 122 6.282 -6.324 -2.498 1.00 1.91 N ATOM 0 H GLN A 122 2.925 -10.119 -1.844 1.00 1.38 H new ATOM 0 HA GLN A 122 4.136 -7.649 -2.923 1.00 1.54 H new ATOM 0 HB2 GLN A 122 4.493 -7.250 -0.647 1.00 1.73 H new ATOM 0 HB3 GLN A 122 4.541 -8.954 -0.241 1.00 1.73 H new ATOM 0 HG2 GLN A 122 6.742 -8.291 0.062 1.00 2.15 H new ATOM 0 HG3 GLN A 122 6.776 -9.022 -1.530 1.00 2.15 H new ATOM 0 HE21 GLN A 122 5.410 -6.742 -2.823 1.00 1.91 H new ATOM 0 HE22 GLN A 122 6.622 -5.459 -2.919 1.00 1.91 H new ATOM 171 N SER A 123 5.775 -9.013 -4.105 1.00 1.94 N ATOM 172 CA SER A 123 6.705 -9.779 -4.881 1.00 2.32 C ATOM 173 C SER A 123 7.953 -8.930 -5.032 1.00 2.43 C ATOM 174 O SER A 123 7.938 -7.748 -4.675 1.00 2.22 O ATOM 175 CB SER A 123 6.100 -10.152 -6.246 1.00 2.41 C ATOM 176 OG SER A 123 6.955 -11.020 -6.980 1.00 2.83 O ATOM 0 H SER A 123 5.723 -8.030 -4.372 1.00 1.94 H new ATOM 0 HA SER A 123 6.948 -10.721 -4.389 1.00 2.32 H new ATOM 0 HB2 SER A 123 5.134 -10.634 -6.097 1.00 2.41 H new ATOM 0 HB3 SER A 123 5.918 -9.246 -6.824 1.00 2.41 H new ATOM 0 HG SER A 123 6.539 -11.238 -7.840 1.00 2.83 H new ATOM 182 N ALA A 124 8.996 -9.496 -5.600 1.00 2.77 N ATOM 183 CA ALA A 124 10.263 -8.800 -5.771 1.00 2.93 C ATOM 184 C ALA A 124 10.113 -7.563 -6.650 1.00 2.70 C ATOM 185 O ALA A 124 11.013 -6.735 -6.753 1.00 2.77 O ATOM 186 CB ALA A 124 11.265 -9.752 -6.385 1.00 3.35 C ATOM 0 H ALA A 124 8.994 -10.451 -5.958 1.00 2.77 H new ATOM 0 HA ALA A 124 10.609 -8.465 -4.793 1.00 2.93 H new ATOM 0 HB1 ALA A 124 12.219 -9.241 -6.518 1.00 3.35 H new ATOM 0 HB2 ALA A 124 11.402 -10.610 -5.727 1.00 3.35 H new ATOM 0 HB3 ALA A 124 10.898 -10.092 -7.353 1.00 3.35 H new ATOM 192 N GLU A 125 8.964 -7.473 -7.273 1.00 2.48 N ATOM 193 CA GLU A 125 8.693 -6.514 -8.320 1.00 2.35 C ATOM 194 C GLU A 125 7.724 -5.414 -7.884 1.00 1.91 C ATOM 195 O GLU A 125 7.775 -4.299 -8.401 1.00 1.78 O ATOM 196 CB GLU A 125 8.081 -7.298 -9.458 1.00 2.56 C ATOM 197 CG GLU A 125 7.115 -8.345 -8.931 1.00 2.56 C ATOM 198 CD GLU A 125 6.379 -9.081 -10.025 1.00 2.86 C ATOM 199 OE1 GLU A 125 6.413 -10.324 -10.027 1.00 3.11 O ATOM 200 OE2 GLU A 125 5.770 -8.421 -10.891 1.00 2.98 O ATOM 0 H GLU A 125 8.171 -8.079 -7.062 1.00 2.48 H new ATOM 0 HA GLU A 125 9.619 -6.010 -8.599 1.00 2.35 H new ATOM 0 HB2 GLU A 125 7.558 -6.620 -10.133 1.00 2.56 H new ATOM 0 HB3 GLU A 125 8.868 -7.781 -10.038 1.00 2.56 H new ATOM 0 HG2 GLU A 125 7.665 -9.065 -8.325 1.00 2.56 H new ATOM 0 HG3 GLU A 125 6.390 -7.863 -8.275 1.00 2.56 H new ATOM 207 N GLU A 126 6.843 -5.720 -6.938 1.00 1.72 N ATOM 208 CA GLU A 126 5.736 -4.835 -6.624 1.00 1.33 C ATOM 209 C GLU A 126 5.179 -5.129 -5.256 1.00 1.27 C ATOM 210 O GLU A 126 5.089 -6.288 -4.844 1.00 1.55 O ATOM 211 CB GLU A 126 4.632 -5.020 -7.662 1.00 1.42 C ATOM 212 CG GLU A 126 4.387 -6.483 -7.980 1.00 1.81 C ATOM 213 CD GLU A 126 3.022 -6.745 -8.572 1.00 1.94 C ATOM 214 OE1 GLU A 126 2.135 -7.225 -7.844 1.00 2.06 O ATOM 215 OE2 GLU A 126 2.829 -6.476 -9.779 1.00 2.15 O ATOM 0 H GLU A 126 6.877 -6.572 -6.379 1.00 1.72 H new ATOM 0 HA GLU A 126 6.102 -3.808 -6.637 1.00 1.33 H new ATOM 0 HB2 GLU A 126 3.710 -4.570 -7.294 1.00 1.42 H new ATOM 0 HB3 GLU A 126 4.902 -4.491 -8.576 1.00 1.42 H new ATOM 0 HG2 GLU A 126 5.150 -6.829 -8.677 1.00 1.81 H new ATOM 0 HG3 GLU A 126 4.499 -7.070 -7.068 1.00 1.81 H new ATOM 222 N VAL A 127 4.784 -4.077 -4.561 1.00 0.96 N ATOM 223 CA VAL A 127 4.093 -4.231 -3.305 1.00 0.93 C ATOM 224 C VAL A 127 2.641 -3.833 -3.501 1.00 0.66 C ATOM 225 O VAL A 127 2.345 -2.697 -3.855 1.00 0.53 O ATOM 226 CB VAL A 127 4.695 -3.364 -2.180 1.00 1.08 C ATOM 227 CG1 VAL A 127 4.178 -3.827 -0.827 1.00 1.31 C ATOM 228 CG2 VAL A 127 6.214 -3.391 -2.219 1.00 1.53 C ATOM 0 H VAL A 127 4.932 -3.110 -4.850 1.00 0.96 H new ATOM 0 HA VAL A 127 4.190 -5.273 -3.002 1.00 0.93 H new ATOM 0 HB VAL A 127 4.381 -2.332 -2.337 1.00 1.08 H new ATOM 0 HG11 VAL A 127 4.610 -3.208 -0.041 1.00 1.31 H new ATOM 0 HG12 VAL A 127 3.092 -3.739 -0.803 1.00 1.31 H new ATOM 0 HG13 VAL A 127 4.461 -4.867 -0.666 1.00 1.31 H new ATOM 0 HG21 VAL A 127 6.610 -2.771 -1.415 1.00 1.53 H new ATOM 0 HG22 VAL A 127 6.563 -4.416 -2.093 1.00 1.53 H new ATOM 0 HG23 VAL A 127 6.560 -3.005 -3.178 1.00 1.53 H new ATOM 238 N ILE A 128 1.742 -4.759 -3.275 1.00 0.64 N ATOM 239 CA ILE A 128 0.342 -4.533 -3.562 1.00 0.48 C ATOM 240 C ILE A 128 -0.492 -4.597 -2.313 1.00 0.46 C ATOM 241 O ILE A 128 -0.400 -5.541 -1.543 1.00 0.56 O ATOM 242 CB ILE A 128 -0.201 -5.548 -4.587 1.00 0.56 C ATOM 243 CG1 ILE A 128 0.591 -5.427 -5.879 1.00 0.64 C ATOM 244 CG2 ILE A 128 -1.677 -5.302 -4.837 1.00 0.55 C ATOM 245 CD1 ILE A 128 0.794 -3.993 -6.266 1.00 0.55 C ATOM 0 H ILE A 128 1.953 -5.680 -2.892 1.00 0.64 H new ATOM 0 HA ILE A 128 0.271 -3.532 -3.987 1.00 0.48 H new ATOM 0 HB ILE A 128 -0.089 -6.559 -4.194 1.00 0.56 H new ATOM 0 HG12 ILE A 128 1.559 -5.914 -5.761 1.00 0.64 H new ATOM 0 HG13 ILE A 128 0.067 -5.950 -6.679 1.00 0.64 H new ATOM 0 HG21 ILE A 128 -2.049 -6.025 -5.563 1.00 0.55 H new ATOM 0 HG22 ILE A 128 -2.227 -5.410 -3.902 1.00 0.55 H new ATOM 0 HG23 ILE A 128 -1.817 -4.293 -5.226 1.00 0.55 H new ATOM 0 HD11 ILE A 128 1.364 -3.944 -7.194 1.00 0.55 H new ATOM 0 HD12 ILE A 128 -0.175 -3.514 -6.409 1.00 0.55 H new ATOM 0 HD13 ILE A 128 1.341 -3.477 -5.477 1.00 0.55 H new ATOM 257 N VAL A 129 -1.293 -3.577 -2.111 1.00 0.39 N ATOM 258 CA VAL A 129 -2.280 -3.593 -1.060 1.00 0.42 C ATOM 259 C VAL A 129 -3.633 -3.243 -1.656 1.00 0.36 C ATOM 260 O VAL A 129 -3.797 -2.213 -2.311 1.00 0.37 O ATOM 261 CB VAL A 129 -1.895 -2.623 0.086 1.00 0.52 C ATOM 262 CG1 VAL A 129 -1.293 -1.374 -0.485 1.00 0.73 C ATOM 263 CG2 VAL A 129 -3.089 -2.261 0.957 1.00 0.79 C ATOM 0 H VAL A 129 -1.279 -2.721 -2.665 1.00 0.39 H new ATOM 0 HA VAL A 129 -2.329 -4.590 -0.621 1.00 0.42 H new ATOM 0 HB VAL A 129 -1.168 -3.135 0.716 1.00 0.52 H new ATOM 0 HG11 VAL A 129 -1.024 -0.696 0.325 1.00 0.73 H new ATOM 0 HG12 VAL A 129 -0.400 -1.629 -1.056 1.00 0.73 H new ATOM 0 HG13 VAL A 129 -2.016 -0.888 -1.140 1.00 0.73 H new ATOM 0 HG21 VAL A 129 -2.771 -1.580 1.746 1.00 0.79 H new ATOM 0 HG22 VAL A 129 -3.852 -1.778 0.346 1.00 0.79 H new ATOM 0 HG23 VAL A 129 -3.501 -3.166 1.404 1.00 0.79 H new ATOM 273 N LYS A 130 -4.576 -4.140 -1.469 1.00 0.36 N ATOM 274 CA LYS A 130 -5.899 -4.001 -1.998 1.00 0.33 C ATOM 275 C LYS A 130 -6.866 -3.863 -0.856 1.00 0.37 C ATOM 276 O LYS A 130 -6.961 -4.728 0.028 1.00 0.43 O ATOM 277 CB LYS A 130 -6.309 -5.189 -2.869 1.00 0.37 C ATOM 278 CG LYS A 130 -5.272 -5.636 -3.883 1.00 0.83 C ATOM 279 CD LYS A 130 -5.690 -6.957 -4.508 1.00 1.18 C ATOM 280 CE LYS A 130 -4.676 -7.466 -5.513 1.00 1.57 C ATOM 281 NZ LYS A 130 -5.020 -8.833 -5.978 1.00 1.50 N ATOM 0 H LYS A 130 -4.434 -4.998 -0.935 1.00 0.36 H new ATOM 0 HA LYS A 130 -5.913 -3.115 -2.632 1.00 0.33 H new ATOM 0 HB2 LYS A 130 -6.544 -6.031 -2.219 1.00 0.37 H new ATOM 0 HB3 LYS A 130 -7.225 -4.930 -3.400 1.00 0.37 H new ATOM 0 HG2 LYS A 130 -5.159 -4.878 -4.658 1.00 0.83 H new ATOM 0 HG3 LYS A 130 -4.301 -5.745 -3.399 1.00 0.83 H new ATOM 0 HD2 LYS A 130 -5.825 -7.701 -3.723 1.00 1.18 H new ATOM 0 HD3 LYS A 130 -6.655 -6.834 -5.000 1.00 1.18 H new ATOM 0 HE2 LYS A 130 -4.634 -6.789 -6.366 1.00 1.57 H new ATOM 0 HE3 LYS A 130 -3.684 -7.472 -5.061 1.00 1.57 H new ATOM 0 HZ1 LYS A 130 -4.309 -9.155 -6.665 1.00 1.50 H new ATOM 0 HZ2 LYS A 130 -5.036 -9.482 -5.166 1.00 1.50 H new ATOM 0 HZ3 LYS A 130 -5.957 -8.821 -6.430 1.00 1.50 H new ATOM 295 N LEU A 131 -7.583 -2.775 -0.874 1.00 0.38 N ATOM 296 CA LEU A 131 -8.387 -2.406 0.225 1.00 0.47 C ATOM 297 C LEU A 131 -9.834 -2.412 -0.233 1.00 0.45 C ATOM 298 O LEU A 131 -10.209 -1.677 -1.137 1.00 0.41 O ATOM 299 CB LEU A 131 -7.905 -1.029 0.687 1.00 0.51 C ATOM 300 CG LEU A 131 -6.369 -0.862 0.674 1.00 0.60 C ATOM 301 CD1 LEU A 131 -5.916 -0.131 -0.581 1.00 0.72 C ATOM 302 CD2 LEU A 131 -5.892 -0.113 1.910 1.00 0.96 C ATOM 0 H LEU A 131 -7.617 -2.126 -1.660 1.00 0.38 H new ATOM 0 HA LEU A 131 -8.313 -3.093 1.068 1.00 0.47 H new ATOM 0 HB2 LEU A 131 -8.348 -0.267 0.046 1.00 0.51 H new ATOM 0 HB3 LEU A 131 -8.271 -0.848 1.698 1.00 0.51 H new ATOM 0 HG LEU A 131 -5.928 -1.859 0.679 1.00 0.60 H new ATOM 0 HD11 LEU A 131 -4.831 -0.025 -0.569 1.00 0.72 H new ATOM 0 HD12 LEU A 131 -6.215 -0.700 -1.461 1.00 0.72 H new ATOM 0 HD13 LEU A 131 -6.377 0.856 -0.613 1.00 0.72 H new ATOM 0 HD21 LEU A 131 -4.808 -0.009 1.876 1.00 0.96 H new ATOM 0 HD22 LEU A 131 -6.351 0.875 1.936 1.00 0.96 H new ATOM 0 HD23 LEU A 131 -6.176 -0.668 2.804 1.00 0.96 H new ATOM 314 N ARG A 132 -10.633 -3.274 0.358 1.00 0.57 N ATOM 315 CA ARG A 132 -12.013 -3.415 -0.060 1.00 0.63 C ATOM 316 C ARG A 132 -12.878 -2.560 0.837 1.00 0.60 C ATOM 317 O ARG A 132 -12.656 -2.493 2.046 1.00 0.67 O ATOM 318 CB ARG A 132 -12.474 -4.878 -0.080 1.00 0.85 C ATOM 319 CG ARG A 132 -12.654 -5.511 1.283 1.00 1.32 C ATOM 320 CD ARG A 132 -14.014 -6.175 1.398 1.00 1.84 C ATOM 321 NE ARG A 132 -15.106 -5.204 1.285 1.00 2.53 N ATOM 322 CZ ARG A 132 -16.326 -5.504 0.844 1.00 3.25 C ATOM 323 NH1 ARG A 132 -16.601 -6.741 0.451 1.00 3.46 N ATOM 324 NH2 ARG A 132 -17.261 -4.564 0.781 1.00 4.13 N ATOM 0 H ARG A 132 -10.354 -3.885 1.125 1.00 0.57 H new ATOM 0 HA ARG A 132 -12.107 -3.071 -1.090 1.00 0.63 H new ATOM 0 HB2 ARG A 132 -13.419 -4.938 -0.619 1.00 0.85 H new ATOM 0 HB3 ARG A 132 -11.748 -5.464 -0.643 1.00 0.85 H new ATOM 0 HG2 ARG A 132 -11.870 -6.249 1.452 1.00 1.32 H new ATOM 0 HG3 ARG A 132 -12.549 -4.751 2.058 1.00 1.32 H new ATOM 0 HD2 ARG A 132 -14.117 -6.930 0.618 1.00 1.84 H new ATOM 0 HD3 ARG A 132 -14.086 -6.693 2.354 1.00 1.84 H new ATOM 0 HE ARG A 132 -14.920 -4.240 1.561 1.00 2.53 H new ATOM 0 HH11 ARG A 132 -15.878 -7.460 0.487 1.00 3.46 H new ATOM 0 HH12 ARG A 132 -17.535 -6.973 0.113 1.00 3.46 H new ATOM 0 HH21 ARG A 132 -17.045 -3.610 1.071 1.00 4.13 H new ATOM 0 HH22 ARG A 132 -18.195 -4.796 0.443 1.00 4.13 H new ATOM 338 N VAL A 133 -13.860 -1.901 0.257 1.00 0.60 N ATOM 339 CA VAL A 133 -14.467 -0.761 0.906 1.00 0.57 C ATOM 340 C VAL A 133 -15.647 -1.195 1.757 1.00 0.81 C ATOM 341 O VAL A 133 -16.607 -1.798 1.272 1.00 0.99 O ATOM 342 CB VAL A 133 -14.963 0.270 -0.130 1.00 0.62 C ATOM 343 CG1 VAL A 133 -15.075 1.653 0.491 1.00 0.81 C ATOM 344 CG2 VAL A 133 -14.068 0.287 -1.367 1.00 0.99 C ATOM 0 H VAL A 133 -14.251 -2.134 -0.656 1.00 0.60 H new ATOM 0 HA VAL A 133 -13.704 -0.304 1.536 1.00 0.57 H new ATOM 0 HB VAL A 133 -15.959 -0.032 -0.452 1.00 0.62 H new ATOM 0 HG11 VAL A 133 -15.426 2.361 -0.259 1.00 0.81 H new ATOM 0 HG12 VAL A 133 -15.781 1.623 1.321 1.00 0.81 H new ATOM 0 HG13 VAL A 133 -14.098 1.968 0.857 1.00 0.81 H new ATOM 0 HG21 VAL A 133 -14.444 1.023 -2.078 1.00 0.99 H new ATOM 0 HG22 VAL A 133 -13.051 0.549 -1.076 1.00 0.99 H new ATOM 0 HG23 VAL A 133 -14.070 -0.699 -1.831 1.00 0.99 H new ATOM 354 N GLY A 134 -15.520 -0.935 3.048 1.00 0.96 N ATOM 355 CA GLY A 134 -16.571 -1.242 3.992 1.00 1.24 C ATOM 356 C GLY A 134 -16.968 -0.033 4.784 1.00 1.32 C ATOM 357 O GLY A 134 -17.816 -0.109 5.668 1.00 1.54 O ATOM 0 H GLY A 134 -14.692 -0.509 3.464 1.00 0.96 H new ATOM 0 HA2 GLY A 134 -17.439 -1.630 3.459 1.00 1.24 H new ATOM 0 HA3 GLY A 134 -16.235 -2.028 4.669 1.00 1.24 H new ATOM 361 N VAL A 135 -16.354 1.095 4.469 1.00 1.26 N ATOM 362 CA VAL A 135 -16.602 2.307 5.215 1.00 1.46 C ATOM 363 C VAL A 135 -17.846 3.004 4.668 1.00 1.62 C ATOM 364 O VAL A 135 -18.371 3.955 5.252 1.00 2.18 O ATOM 365 CB VAL A 135 -15.384 3.250 5.158 1.00 1.46 C ATOM 366 CG1 VAL A 135 -15.159 3.751 3.742 1.00 1.28 C ATOM 367 CG2 VAL A 135 -15.535 4.413 6.127 1.00 1.79 C ATOM 0 H VAL A 135 -15.685 1.192 3.705 1.00 1.26 H new ATOM 0 HA VAL A 135 -16.771 2.044 6.259 1.00 1.46 H new ATOM 0 HB VAL A 135 -14.507 2.679 5.464 1.00 1.46 H new ATOM 0 HG11 VAL A 135 -14.295 4.415 3.724 1.00 1.28 H new ATOM 0 HG12 VAL A 135 -14.979 2.904 3.080 1.00 1.28 H new ATOM 0 HG13 VAL A 135 -16.041 4.295 3.404 1.00 1.28 H new ATOM 0 HG21 VAL A 135 -14.659 5.058 6.061 1.00 1.79 H new ATOM 0 HG22 VAL A 135 -16.427 4.985 5.872 1.00 1.79 H new ATOM 0 HG23 VAL A 135 -15.628 4.030 7.143 1.00 1.79 H new ATOM 377 N GLY A 136 -18.315 2.493 3.544 1.00 1.55 N ATOM 378 CA GLY A 136 -19.423 3.086 2.842 1.00 1.67 C ATOM 379 C GLY A 136 -19.176 3.032 1.357 1.00 1.53 C ATOM 380 O GLY A 136 -18.600 2.060 0.868 1.00 1.55 O ATOM 0 H GLY A 136 -17.935 1.658 3.099 1.00 1.55 H new ATOM 0 HA2 GLY A 136 -20.344 2.557 3.086 1.00 1.67 H new ATOM 0 HA3 GLY A 136 -19.555 4.120 3.160 1.00 1.67 H new ATOM 384 N PRO A 137 -19.588 4.053 0.610 1.00 1.48 N ATOM 385 CA PRO A 137 -19.309 4.147 -0.809 1.00 1.43 C ATOM 386 C PRO A 137 -17.893 4.615 -1.047 1.00 1.16 C ATOM 387 O PRO A 137 -17.402 5.509 -0.359 1.00 1.06 O ATOM 388 CB PRO A 137 -20.330 5.178 -1.322 1.00 1.57 C ATOM 389 CG PRO A 137 -21.147 5.574 -0.130 1.00 1.71 C ATOM 390 CD PRO A 137 -20.325 5.227 1.074 1.00 1.57 C ATOM 0 HA PRO A 137 -19.395 3.188 -1.321 1.00 1.43 H new ATOM 0 HB2 PRO A 137 -19.828 6.043 -1.756 1.00 1.57 H new ATOM 0 HB3 PRO A 137 -20.959 4.750 -2.102 1.00 1.57 H new ATOM 0 HG2 PRO A 137 -21.376 6.640 -0.151 1.00 1.71 H new ATOM 0 HG3 PRO A 137 -22.099 5.044 -0.117 1.00 1.71 H new ATOM 0 HD2 PRO A 137 -19.658 6.040 1.361 1.00 1.57 H new ATOM 0 HD3 PRO A 137 -20.946 5.003 1.941 1.00 1.57 H new ATOM 398 N LEU A 138 -17.240 4.012 -2.014 1.00 1.15 N ATOM 399 CA LEU A 138 -15.901 4.373 -2.345 1.00 0.96 C ATOM 400 C LEU A 138 -15.880 5.737 -2.994 1.00 0.97 C ATOM 401 O LEU A 138 -16.441 5.958 -4.070 1.00 1.14 O ATOM 402 CB LEU A 138 -15.341 3.313 -3.276 1.00 1.06 C ATOM 403 CG LEU A 138 -14.039 3.673 -3.998 1.00 0.85 C ATOM 404 CD1 LEU A 138 -12.960 4.078 -3.010 1.00 0.80 C ATOM 405 CD2 LEU A 138 -13.571 2.507 -4.848 1.00 1.69 C ATOM 0 H LEU A 138 -17.629 3.262 -2.585 1.00 1.15 H new ATOM 0 HA LEU A 138 -15.285 4.427 -1.447 1.00 0.96 H new ATOM 0 HB2 LEU A 138 -15.174 2.403 -2.700 1.00 1.06 H new ATOM 0 HB3 LEU A 138 -16.097 3.081 -4.026 1.00 1.06 H new ATOM 0 HG LEU A 138 -14.235 4.526 -4.648 1.00 0.85 H new ATOM 0 HD11 LEU A 138 -12.047 4.328 -3.550 1.00 0.80 H new ATOM 0 HD12 LEU A 138 -13.294 4.946 -2.441 1.00 0.80 H new ATOM 0 HD13 LEU A 138 -12.763 3.251 -2.328 1.00 0.80 H new ATOM 0 HD21 LEU A 138 -12.645 2.776 -5.356 1.00 1.69 H new ATOM 0 HD22 LEU A 138 -13.397 1.639 -4.211 1.00 1.69 H new ATOM 0 HD23 LEU A 138 -14.334 2.267 -5.588 1.00 1.69 H new ATOM 417 N GLN A 139 -15.224 6.633 -2.309 1.00 0.83 N ATOM 418 CA GLN A 139 -15.063 7.990 -2.744 1.00 0.88 C ATOM 419 C GLN A 139 -13.581 8.287 -2.883 1.00 0.75 C ATOM 420 O GLN A 139 -12.746 7.577 -2.331 1.00 0.66 O ATOM 421 CB GLN A 139 -15.738 8.952 -1.762 1.00 0.96 C ATOM 422 CG GLN A 139 -15.088 9.003 -0.390 1.00 0.86 C ATOM 423 CD GLN A 139 -15.374 7.788 0.478 1.00 0.89 C ATOM 424 OE1 GLN A 139 -16.361 7.759 1.209 1.00 1.11 O ATOM 425 NE2 GLN A 139 -14.503 6.789 0.421 1.00 0.93 N ATOM 0 H GLN A 139 -14.777 6.434 -1.414 1.00 0.83 H new ATOM 0 HA GLN A 139 -15.544 8.129 -3.712 1.00 0.88 H new ATOM 0 HB2 GLN A 139 -15.732 9.954 -2.191 1.00 0.96 H new ATOM 0 HB3 GLN A 139 -16.782 8.661 -1.646 1.00 0.96 H new ATOM 0 HG2 GLN A 139 -14.010 9.102 -0.514 1.00 0.86 H new ATOM 0 HG3 GLN A 139 -15.432 9.897 0.130 1.00 0.86 H new ATOM 0 HE21 GLN A 139 -13.696 6.851 -0.199 1.00 0.93 H new ATOM 0 HE22 GLN A 139 -14.641 5.959 0.997 1.00 0.93 H new ATOM 434 N LEU A 140 -13.278 9.315 -3.662 1.00 0.83 N ATOM 435 CA LEU A 140 -11.922 9.593 -4.145 1.00 0.79 C ATOM 436 C LEU A 140 -10.893 9.649 -3.025 1.00 0.65 C ATOM 437 O LEU A 140 -9.718 9.355 -3.239 1.00 0.70 O ATOM 438 CB LEU A 140 -11.862 10.899 -4.965 1.00 0.98 C ATOM 439 CG LEU A 140 -12.949 11.966 -4.724 1.00 1.73 C ATOM 440 CD1 LEU A 140 -14.269 11.516 -5.315 1.00 2.38 C ATOM 441 CD2 LEU A 140 -13.098 12.297 -3.247 1.00 2.60 C ATOM 0 H LEU A 140 -13.971 9.991 -3.984 1.00 0.83 H new ATOM 0 HA LEU A 140 -11.668 8.753 -4.792 1.00 0.79 H new ATOM 0 HB2 LEU A 140 -10.894 11.364 -4.779 1.00 0.98 H new ATOM 0 HB3 LEU A 140 -11.889 10.630 -6.021 1.00 0.98 H new ATOM 0 HG LEU A 140 -12.635 12.880 -5.227 1.00 1.73 H new ATOM 0 HD11 LEU A 140 -15.026 12.279 -5.137 1.00 2.38 H new ATOM 0 HD12 LEU A 140 -14.154 11.362 -6.388 1.00 2.38 H new ATOM 0 HD13 LEU A 140 -14.578 10.582 -4.846 1.00 2.38 H new ATOM 0 HD21 LEU A 140 -13.873 13.052 -3.120 1.00 2.60 H new ATOM 0 HD22 LEU A 140 -13.375 11.397 -2.699 1.00 2.60 H new ATOM 0 HD23 LEU A 140 -12.152 12.679 -2.863 1.00 2.60 H new ATOM 453 N GLU A 141 -11.355 10.026 -1.846 1.00 0.63 N ATOM 454 CA GLU A 141 -10.515 10.173 -0.671 1.00 0.64 C ATOM 455 C GLU A 141 -10.171 8.838 -0.010 1.00 0.59 C ATOM 456 O GLU A 141 -9.432 8.813 0.972 1.00 0.70 O ATOM 457 CB GLU A 141 -11.184 11.089 0.335 1.00 0.78 C ATOM 458 CG GLU A 141 -12.627 10.741 0.563 1.00 1.06 C ATOM 459 CD GLU A 141 -13.193 11.358 1.822 1.00 1.78 C ATOM 460 OE1 GLU A 141 -12.683 11.056 2.917 1.00 2.58 O ATOM 461 OE2 GLU A 141 -14.159 12.144 1.720 1.00 2.05 O ATOM 0 H GLU A 141 -12.337 10.241 -1.676 1.00 0.63 H new ATOM 0 HA GLU A 141 -9.576 10.611 -1.010 1.00 0.64 H new ATOM 0 HB2 GLU A 141 -10.647 11.036 1.282 1.00 0.78 H new ATOM 0 HB3 GLU A 141 -11.113 12.119 -0.014 1.00 0.78 H new ATOM 0 HG2 GLU A 141 -13.214 11.073 -0.293 1.00 1.06 H new ATOM 0 HG3 GLU A 141 -12.729 9.657 0.619 1.00 1.06 H new ATOM 468 N ASP A 142 -10.682 7.727 -0.538 1.00 0.51 N ATOM 469 CA ASP A 142 -10.594 6.465 0.183 1.00 0.51 C ATOM 470 C ASP A 142 -9.218 5.853 0.021 1.00 0.50 C ATOM 471 O ASP A 142 -8.864 4.898 0.698 1.00 0.56 O ATOM 472 CB ASP A 142 -11.641 5.490 -0.313 1.00 0.57 C ATOM 473 CG ASP A 142 -12.067 4.451 0.712 1.00 1.64 C ATOM 474 OD1 ASP A 142 -13.274 4.207 0.876 1.00 2.37 O ATOM 475 OD2 ASP A 142 -11.167 3.862 1.347 1.00 2.39 O ATOM 0 H ASP A 142 -11.151 7.677 -1.442 1.00 0.51 H new ATOM 0 HA ASP A 142 -10.772 6.671 1.239 1.00 0.51 H new ATOM 0 HB2 ASP A 142 -12.520 6.050 -0.631 1.00 0.57 H new ATOM 0 HB3 ASP A 142 -11.254 4.977 -1.193 1.00 0.57 H new ATOM 480 N VAL A 143 -8.421 6.416 -0.867 1.00 0.49 N ATOM 481 CA VAL A 143 -7.002 6.173 -0.811 1.00 0.47 C ATOM 482 C VAL A 143 -6.241 7.478 -0.754 1.00 0.47 C ATOM 483 O VAL A 143 -6.362 8.320 -1.646 1.00 0.59 O ATOM 484 CB VAL A 143 -6.452 5.313 -1.955 1.00 0.55 C ATOM 485 CG1 VAL A 143 -5.055 4.835 -1.581 1.00 0.53 C ATOM 486 CG2 VAL A 143 -7.358 4.136 -2.228 1.00 0.65 C ATOM 0 H VAL A 143 -8.728 7.032 -1.620 1.00 0.49 H new ATOM 0 HA VAL A 143 -6.852 5.597 0.102 1.00 0.47 H new ATOM 0 HB VAL A 143 -6.405 5.911 -2.865 1.00 0.55 H new ATOM 0 HG11 VAL A 143 -4.652 4.222 -2.387 1.00 0.53 H new ATOM 0 HG12 VAL A 143 -4.406 5.696 -1.422 1.00 0.53 H new ATOM 0 HG13 VAL A 143 -5.105 4.244 -0.666 1.00 0.53 H new ATOM 0 HG21 VAL A 143 -6.946 3.541 -3.044 1.00 0.65 H new ATOM 0 HG22 VAL A 143 -7.434 3.520 -1.332 1.00 0.65 H new ATOM 0 HG23 VAL A 143 -8.349 4.496 -2.506 1.00 0.65 H new ATOM 496 N ASP A 144 -5.471 7.658 0.294 1.00 0.40 N ATOM 497 CA ASP A 144 -4.533 8.751 0.331 1.00 0.41 C ATOM 498 C ASP A 144 -3.141 8.185 0.520 1.00 0.33 C ATOM 499 O ASP A 144 -2.761 7.791 1.615 1.00 0.33 O ATOM 500 CB ASP A 144 -4.868 9.749 1.436 1.00 0.47 C ATOM 501 CG ASP A 144 -4.117 11.050 1.263 1.00 0.91 C ATOM 502 OD1 ASP A 144 -4.488 11.847 0.379 1.00 1.11 O ATOM 503 OD2 ASP A 144 -3.154 11.284 2.023 1.00 1.52 O ATOM 0 H ASP A 144 -5.476 7.066 1.125 1.00 0.40 H new ATOM 0 HA ASP A 144 -4.589 9.298 -0.610 1.00 0.41 H new ATOM 0 HB2 ASP A 144 -5.940 9.945 1.436 1.00 0.47 H new ATOM 0 HB3 ASP A 144 -4.624 9.314 2.405 1.00 0.47 H new ATOM 508 N ALA A 145 -2.379 8.119 -0.544 1.00 0.38 N ATOM 509 CA ALA A 145 -1.077 7.498 -0.467 1.00 0.36 C ATOM 510 C ALA A 145 0.022 8.534 -0.621 1.00 0.39 C ATOM 511 O ALA A 145 0.066 9.260 -1.613 1.00 0.47 O ATOM 512 CB ALA A 145 -0.928 6.408 -1.514 1.00 0.48 C ATOM 0 H ALA A 145 -2.632 8.482 -1.463 1.00 0.38 H new ATOM 0 HA ALA A 145 -0.985 7.038 0.517 1.00 0.36 H new ATOM 0 HB1 ALA A 145 0.062 5.958 -1.433 1.00 0.48 H new ATOM 0 HB2 ALA A 145 -1.688 5.644 -1.354 1.00 0.48 H new ATOM 0 HB3 ALA A 145 -1.050 6.839 -2.508 1.00 0.48 H new ATOM 518 N ALA A 146 0.899 8.610 0.360 1.00 0.38 N ATOM 519 CA ALA A 146 2.030 9.520 0.291 1.00 0.49 C ATOM 520 C ALA A 146 3.306 8.733 0.391 1.00 0.48 C ATOM 521 O ALA A 146 3.591 8.154 1.414 1.00 0.66 O ATOM 522 CB ALA A 146 1.986 10.526 1.424 1.00 0.56 C ATOM 0 H ALA A 146 0.852 8.054 1.214 1.00 0.38 H new ATOM 0 HA ALA A 146 1.984 10.055 -0.657 1.00 0.49 H new ATOM 0 HB1 ALA A 146 2.843 11.195 1.350 1.00 0.56 H new ATOM 0 HB2 ALA A 146 1.066 11.106 1.360 1.00 0.56 H new ATOM 0 HB3 ALA A 146 2.018 10.001 2.378 1.00 0.56 H new ATOM 528 N PHE A 147 4.106 8.749 -0.626 1.00 0.57 N ATOM 529 CA PHE A 147 5.288 7.938 -0.614 1.00 0.59 C ATOM 530 C PHE A 147 6.465 8.820 -0.909 1.00 0.68 C ATOM 531 O PHE A 147 6.418 9.648 -1.817 1.00 0.94 O ATOM 532 CB PHE A 147 5.139 6.810 -1.632 1.00 0.82 C ATOM 533 CG PHE A 147 5.847 5.540 -1.281 1.00 2.08 C ATOM 534 CD1 PHE A 147 7.164 5.554 -0.880 1.00 2.46 C ATOM 535 CD2 PHE A 147 5.189 4.325 -1.377 1.00 3.01 C ATOM 536 CE1 PHE A 147 7.821 4.381 -0.573 1.00 3.72 C ATOM 537 CE2 PHE A 147 5.840 3.147 -1.070 1.00 4.26 C ATOM 538 CZ PHE A 147 7.159 3.173 -0.669 1.00 4.62 C ATOM 0 H PHE A 147 3.968 9.307 -1.469 1.00 0.57 H new ATOM 0 HA PHE A 147 5.442 7.474 0.360 1.00 0.59 H new ATOM 0 HB2 PHE A 147 4.078 6.593 -1.758 1.00 0.82 H new ATOM 0 HB3 PHE A 147 5.510 7.160 -2.595 1.00 0.82 H new ATOM 0 HD1 PHE A 147 7.689 6.495 -0.805 1.00 2.46 H new ATOM 0 HD2 PHE A 147 4.157 4.299 -1.695 1.00 3.01 H new ATOM 0 HE1 PHE A 147 8.854 4.407 -0.257 1.00 3.72 H new ATOM 0 HE2 PHE A 147 5.316 2.205 -1.144 1.00 4.26 H new ATOM 0 HZ PHE A 147 7.672 2.253 -0.431 1.00 4.62 H new ATOM 548 N THR A 148 7.488 8.676 -0.109 1.00 0.54 N ATOM 549 CA THR A 148 8.651 9.504 -0.213 1.00 0.64 C ATOM 550 C THR A 148 9.855 8.641 -0.443 1.00 0.71 C ATOM 551 O THR A 148 9.767 7.424 -0.302 1.00 0.74 O ATOM 552 CB THR A 148 8.872 10.290 1.069 1.00 0.56 C ATOM 553 OG1 THR A 148 7.613 10.697 1.625 1.00 0.65 O ATOM 554 CG2 THR A 148 9.730 11.505 0.818 1.00 0.81 C ATOM 0 H THR A 148 7.534 7.978 0.634 1.00 0.54 H new ATOM 0 HA THR A 148 8.503 10.196 -1.042 1.00 0.64 H new ATOM 0 HB THR A 148 9.388 9.640 1.776 1.00 0.56 H new ATOM 0 HG1 THR A 148 7.324 10.042 2.294 1.00 0.65 H new ATOM 0 HG21 THR A 148 9.872 12.049 1.752 1.00 0.81 H new ATOM 0 HG22 THR A 148 10.699 11.192 0.429 1.00 0.81 H new ATOM 0 HG23 THR A 148 9.240 12.153 0.092 1.00 0.81 H new ATOM 562 N ASP A 149 10.985 9.258 -0.707 1.00 0.84 N ATOM 563 CA ASP A 149 12.160 8.513 -1.046 1.00 0.98 C ATOM 564 C ASP A 149 12.521 7.577 0.061 1.00 0.79 C ATOM 565 O ASP A 149 13.055 6.506 -0.161 1.00 0.92 O ATOM 566 CB ASP A 149 13.340 9.428 -1.358 1.00 1.23 C ATOM 567 CG ASP A 149 13.390 10.661 -0.483 1.00 1.87 C ATOM 568 OD1 ASP A 149 12.794 11.687 -0.869 1.00 2.28 O ATOM 569 OD2 ASP A 149 14.021 10.616 0.590 1.00 2.17 O ATOM 0 H ASP A 149 11.108 10.270 -0.692 1.00 0.84 H new ATOM 0 HA ASP A 149 11.934 7.939 -1.945 1.00 0.98 H new ATOM 0 HB2 ASP A 149 14.267 8.868 -1.237 1.00 1.23 H new ATOM 0 HB3 ASP A 149 13.287 9.734 -2.403 1.00 1.23 H new ATOM 574 N THR A 150 12.223 7.961 1.264 1.00 0.56 N ATOM 575 CA THR A 150 12.570 7.131 2.357 1.00 0.54 C ATOM 576 C THR A 150 11.402 6.939 3.351 1.00 0.64 C ATOM 577 O THR A 150 11.577 6.506 4.476 1.00 0.88 O ATOM 578 CB THR A 150 13.889 7.599 3.007 1.00 0.53 C ATOM 579 OG1 THR A 150 13.702 8.842 3.701 1.00 0.67 O ATOM 580 CG2 THR A 150 14.981 7.768 1.949 1.00 0.59 C ATOM 0 H THR A 150 11.748 8.831 1.504 1.00 0.56 H new ATOM 0 HA THR A 150 12.761 6.128 1.974 1.00 0.54 H new ATOM 0 HB THR A 150 14.197 6.835 3.721 1.00 0.53 H new ATOM 0 HG1 THR A 150 14.549 9.120 4.107 1.00 0.67 H new ATOM 0 HG21 THR A 150 15.903 8.098 2.427 1.00 0.59 H new ATOM 0 HG22 THR A 150 15.153 6.815 1.448 1.00 0.59 H new ATOM 0 HG23 THR A 150 14.666 8.511 1.216 1.00 0.59 H new ATOM 588 N ASP A 151 10.195 7.303 2.968 1.00 0.55 N ATOM 589 CA ASP A 151 9.057 6.979 3.820 1.00 0.63 C ATOM 590 C ASP A 151 7.820 6.720 2.966 1.00 0.57 C ATOM 591 O ASP A 151 7.859 6.942 1.766 1.00 0.54 O ATOM 592 CB ASP A 151 8.790 8.066 4.871 1.00 0.71 C ATOM 593 CG ASP A 151 8.403 9.399 4.271 1.00 0.79 C ATOM 594 OD1 ASP A 151 9.294 10.247 4.058 1.00 0.97 O ATOM 595 OD2 ASP A 151 7.203 9.605 3.995 1.00 1.00 O ATOM 0 H ASP A 151 9.975 7.804 2.107 1.00 0.55 H new ATOM 0 HA ASP A 151 9.301 6.070 4.370 1.00 0.63 H new ATOM 0 HB2 ASP A 151 7.994 7.730 5.536 1.00 0.71 H new ATOM 0 HB3 ASP A 151 9.683 8.197 5.483 1.00 0.71 H new ATOM 600 N CYS A 152 6.728 6.238 3.557 1.00 0.66 N ATOM 601 CA CYS A 152 5.557 5.882 2.760 1.00 0.61 C ATOM 602 C CYS A 152 4.257 5.855 3.552 1.00 0.63 C ATOM 603 O CYS A 152 4.227 5.564 4.751 1.00 0.85 O ATOM 604 CB CYS A 152 5.780 4.533 2.080 1.00 0.97 C ATOM 605 SG CYS A 152 4.263 3.630 1.669 1.00 1.56 S ATOM 0 H CYS A 152 6.630 6.088 4.561 1.00 0.66 H new ATOM 0 HA CYS A 152 5.444 6.670 2.016 1.00 0.61 H new ATOM 0 HB2 CYS A 152 6.350 4.693 1.165 1.00 0.97 H new ATOM 0 HB3 CYS A 152 6.392 3.910 2.732 1.00 0.97 H new ATOM 0 HG CYS A 152 4.251 3.358 0.398 1.00 1.56 H new ATOM 611 N VAL A 153 3.192 6.172 2.830 1.00 0.49 N ATOM 612 CA VAL A 153 1.853 6.299 3.352 1.00 0.43 C ATOM 613 C VAL A 153 0.847 5.673 2.418 1.00 0.37 C ATOM 614 O VAL A 153 0.811 5.954 1.224 1.00 0.37 O ATOM 615 CB VAL A 153 1.511 7.781 3.557 1.00 0.43 C ATOM 616 CG1 VAL A 153 0.011 7.996 3.729 1.00 0.41 C ATOM 617 CG2 VAL A 153 2.268 8.353 4.748 1.00 0.60 C ATOM 0 H VAL A 153 3.247 6.353 1.828 1.00 0.49 H new ATOM 0 HA VAL A 153 1.810 5.777 4.308 1.00 0.43 H new ATOM 0 HB VAL A 153 1.822 8.312 2.657 1.00 0.43 H new ATOM 0 HG11 VAL A 153 -0.190 9.058 3.872 1.00 0.41 H new ATOM 0 HG12 VAL A 153 -0.511 7.644 2.840 1.00 0.41 H new ATOM 0 HG13 VAL A 153 -0.339 7.440 4.599 1.00 0.41 H new ATOM 0 HG21 VAL A 153 2.009 9.404 4.873 1.00 0.60 H new ATOM 0 HG22 VAL A 153 1.997 7.803 5.649 1.00 0.60 H new ATOM 0 HG23 VAL A 153 3.340 8.262 4.575 1.00 0.60 H new ATOM 627 N VAL A 154 0.073 4.801 2.984 1.00 0.36 N ATOM 628 CA VAL A 154 -1.091 4.250 2.355 1.00 0.34 C ATOM 629 C VAL A 154 -2.287 4.598 3.203 1.00 0.28 C ATOM 630 O VAL A 154 -2.279 4.375 4.408 1.00 0.29 O ATOM 631 CB VAL A 154 -0.988 2.718 2.162 1.00 0.40 C ATOM 632 CG1 VAL A 154 -1.767 1.954 3.180 1.00 0.38 C ATOM 633 CG2 VAL A 154 -1.445 2.343 0.778 1.00 0.45 C ATOM 0 H VAL A 154 0.237 4.441 3.924 1.00 0.36 H new ATOM 0 HA VAL A 154 -1.188 4.676 1.357 1.00 0.34 H new ATOM 0 HB VAL A 154 0.060 2.449 2.294 1.00 0.40 H new ATOM 0 HG11 VAL A 154 -1.658 0.885 2.995 1.00 0.38 H new ATOM 0 HG12 VAL A 154 -1.393 2.190 4.176 1.00 0.38 H new ATOM 0 HG13 VAL A 154 -2.820 2.228 3.113 1.00 0.38 H new ATOM 0 HG21 VAL A 154 -1.369 1.263 0.650 1.00 0.45 H new ATOM 0 HG22 VAL A 154 -2.481 2.653 0.640 1.00 0.45 H new ATOM 0 HG23 VAL A 154 -0.816 2.841 0.040 1.00 0.45 H new ATOM 643 N ARG A 155 -3.274 5.223 2.629 1.00 0.30 N ATOM 644 CA ARG A 155 -4.449 5.500 3.398 1.00 0.33 C ATOM 645 C ARG A 155 -5.712 4.966 2.758 1.00 0.45 C ATOM 646 O ARG A 155 -5.950 5.162 1.579 1.00 0.63 O ATOM 647 CB ARG A 155 -4.546 6.983 3.671 1.00 0.46 C ATOM 648 CG ARG A 155 -5.803 7.397 4.394 1.00 0.79 C ATOM 649 CD ARG A 155 -6.846 7.900 3.416 1.00 1.06 C ATOM 650 NE ARG A 155 -8.012 8.466 4.099 1.00 1.59 N ATOM 651 CZ ARG A 155 -8.502 9.685 3.877 1.00 1.99 C ATOM 652 NH1 ARG A 155 -7.895 10.503 3.023 1.00 2.40 N ATOM 653 NH2 ARG A 155 -9.595 10.086 4.515 1.00 2.42 N ATOM 0 H ARG A 155 -3.291 5.542 1.660 1.00 0.30 H new ATOM 0 HA ARG A 155 -4.354 4.971 4.346 1.00 0.33 H new ATOM 0 HB2 ARG A 155 -3.683 7.290 4.262 1.00 0.46 H new ATOM 0 HB3 ARG A 155 -4.491 7.520 2.724 1.00 0.46 H new ATOM 0 HG2 ARG A 155 -6.201 6.551 4.954 1.00 0.79 H new ATOM 0 HG3 ARG A 155 -5.571 8.178 5.118 1.00 0.79 H new ATOM 0 HD2 ARG A 155 -6.402 8.657 2.770 1.00 1.06 H new ATOM 0 HD3 ARG A 155 -7.165 7.080 2.773 1.00 1.06 H new ATOM 0 HE ARG A 155 -8.482 7.886 4.794 1.00 1.59 H new ATOM 0 HH11 ARG A 155 -7.052 10.198 2.536 1.00 2.40 H new ATOM 0 HH12 ARG A 155 -8.272 11.436 2.855 1.00 2.40 H new ATOM 0 HH21 ARG A 155 -10.059 9.461 5.174 1.00 2.42 H new ATOM 0 HH22 ARG A 155 -9.971 11.019 4.346 1.00 2.42 H new ATOM 667 N PHE A 156 -6.481 4.269 3.559 1.00 0.44 N ATOM 668 CA PHE A 156 -7.860 3.946 3.249 1.00 0.49 C ATOM 669 C PHE A 156 -8.749 5.014 3.895 1.00 0.57 C ATOM 670 O PHE A 156 -8.283 5.679 4.822 1.00 0.71 O ATOM 671 CB PHE A 156 -8.163 2.539 3.776 1.00 0.60 C ATOM 672 CG PHE A 156 -9.564 2.034 3.564 1.00 0.59 C ATOM 673 CD1 PHE A 156 -9.880 1.285 2.444 1.00 0.56 C ATOM 674 CD2 PHE A 156 -10.560 2.285 4.497 1.00 0.77 C ATOM 675 CE1 PHE A 156 -11.158 0.797 2.253 1.00 0.65 C ATOM 676 CE2 PHE A 156 -11.843 1.803 4.310 1.00 0.82 C ATOM 677 CZ PHE A 156 -12.141 1.058 3.186 1.00 0.72 C ATOM 0 H PHE A 156 -6.166 3.903 4.458 1.00 0.44 H new ATOM 0 HA PHE A 156 -8.050 3.944 2.176 1.00 0.49 H new ATOM 0 HB2 PHE A 156 -7.473 1.841 3.303 1.00 0.60 H new ATOM 0 HB3 PHE A 156 -7.951 2.521 4.845 1.00 0.60 H new ATOM 0 HD1 PHE A 156 -9.116 1.079 1.709 1.00 0.56 H new ATOM 0 HD2 PHE A 156 -10.331 2.864 5.380 1.00 0.77 H new ATOM 0 HE1 PHE A 156 -11.388 0.212 1.375 1.00 0.65 H new ATOM 0 HE2 PHE A 156 -12.610 2.009 5.042 1.00 0.82 H new ATOM 0 HZ PHE A 156 -13.142 0.680 3.037 1.00 0.72 H new ATOM 687 N ALA A 157 -10.006 5.184 3.450 1.00 0.57 N ATOM 688 CA ALA A 157 -10.821 6.327 3.893 1.00 0.65 C ATOM 689 C ALA A 157 -10.851 6.481 5.409 1.00 0.77 C ATOM 690 O ALA A 157 -10.924 7.605 5.911 1.00 0.95 O ATOM 691 CB ALA A 157 -12.238 6.209 3.381 1.00 0.71 C ATOM 0 H ALA A 157 -10.473 4.556 2.795 1.00 0.57 H new ATOM 0 HA ALA A 157 -10.346 7.214 3.475 1.00 0.65 H new ATOM 0 HB1 ALA A 157 -12.820 7.065 3.722 1.00 0.71 H new ATOM 0 HB2 ALA A 157 -12.230 6.186 2.291 1.00 0.71 H new ATOM 0 HB3 ALA A 157 -12.687 5.291 3.760 1.00 0.71 H new ATOM 697 N GLY A 158 -10.758 5.382 6.145 1.00 0.76 N ATOM 698 CA GLY A 158 -10.696 5.501 7.581 1.00 0.94 C ATOM 699 C GLY A 158 -10.321 4.223 8.292 1.00 0.91 C ATOM 700 O GLY A 158 -10.818 3.142 7.968 1.00 1.81 O ATOM 0 H GLY A 158 -10.725 4.430 5.780 1.00 0.76 H new ATOM 0 HA2 GLY A 158 -9.972 6.273 7.839 1.00 0.94 H new ATOM 0 HA3 GLY A 158 -11.665 5.837 7.949 1.00 0.94 H new ATOM 704 N GLY A 159 -9.415 4.363 9.250 1.00 0.72 N ATOM 705 CA GLY A 159 -9.054 3.266 10.124 1.00 0.81 C ATOM 706 C GLY A 159 -7.886 2.464 9.601 1.00 0.60 C ATOM 707 O GLY A 159 -6.937 2.181 10.331 1.00 0.78 O ATOM 0 H GLY A 159 -8.916 5.233 9.439 1.00 0.72 H new ATOM 0 HA2 GLY A 159 -8.807 3.659 11.110 1.00 0.81 H new ATOM 0 HA3 GLY A 159 -9.914 2.608 10.249 1.00 0.81 H new ATOM 711 N GLN A 160 -7.954 2.108 8.331 1.00 0.50 N ATOM 712 CA GLN A 160 -6.984 1.265 7.705 1.00 0.47 C ATOM 713 C GLN A 160 -5.983 2.093 6.902 1.00 0.40 C ATOM 714 O GLN A 160 -6.289 2.609 5.840 1.00 0.56 O ATOM 715 CB GLN A 160 -7.764 0.298 6.861 1.00 0.71 C ATOM 716 CG GLN A 160 -6.932 -0.451 5.886 1.00 0.64 C ATOM 717 CD GLN A 160 -7.731 -1.515 5.155 1.00 1.08 C ATOM 718 OE1 GLN A 160 -8.703 -2.048 5.692 1.00 1.43 O ATOM 719 NE2 GLN A 160 -7.322 -1.851 3.947 1.00 2.02 N ATOM 0 H GLN A 160 -8.702 2.408 7.706 1.00 0.50 H new ATOM 0 HA GLN A 160 -6.379 0.721 8.430 1.00 0.47 H new ATOM 0 HB2 GLN A 160 -8.271 -0.413 7.514 1.00 0.71 H new ATOM 0 HB3 GLN A 160 -8.538 0.843 6.321 1.00 0.71 H new ATOM 0 HG2 GLN A 160 -6.507 0.245 5.162 1.00 0.64 H new ATOM 0 HG3 GLN A 160 -6.096 -0.919 6.407 1.00 0.64 H new ATOM 0 HE21 GLN A 160 -6.512 -1.387 3.535 1.00 2.02 H new ATOM 0 HE22 GLN A 160 -7.815 -2.575 3.425 1.00 2.02 H new ATOM 728 N GLN A 161 -4.786 2.236 7.437 1.00 0.38 N ATOM 729 CA GLN A 161 -3.765 3.054 6.825 1.00 0.34 C ATOM 730 C GLN A 161 -2.383 2.512 7.186 1.00 0.39 C ATOM 731 O GLN A 161 -2.108 2.168 8.334 1.00 0.46 O ATOM 732 CB GLN A 161 -3.974 4.517 7.220 1.00 0.35 C ATOM 733 CG GLN A 161 -2.732 5.390 7.093 1.00 1.08 C ATOM 734 CD GLN A 161 -2.956 6.814 7.560 1.00 1.12 C ATOM 735 OE1 GLN A 161 -2.329 7.750 7.059 1.00 1.77 O ATOM 736 NE2 GLN A 161 -3.844 6.992 8.530 1.00 1.46 N ATOM 0 H GLN A 161 -4.497 1.788 8.307 1.00 0.38 H new ATOM 0 HA GLN A 161 -3.837 3.012 5.738 1.00 0.34 H new ATOM 0 HB2 GLN A 161 -4.764 4.939 6.598 1.00 0.35 H new ATOM 0 HB3 GLN A 161 -4.325 4.555 8.251 1.00 0.35 H new ATOM 0 HG2 GLN A 161 -1.923 4.947 7.673 1.00 1.08 H new ATOM 0 HG3 GLN A 161 -2.408 5.402 6.052 1.00 1.08 H new ATOM 0 HE21 GLN A 161 -4.342 6.191 8.918 1.00 1.46 H new ATOM 0 HE22 GLN A 161 -4.028 7.930 8.887 1.00 1.46 H new ATOM 745 N TRP A 162 -1.542 2.429 6.173 1.00 0.39 N ATOM 746 CA TRP A 162 -0.303 1.670 6.196 1.00 0.47 C ATOM 747 C TRP A 162 0.753 2.511 5.558 1.00 0.50 C ATOM 748 O TRP A 162 0.484 3.629 5.153 1.00 0.47 O ATOM 749 CB TRP A 162 -0.434 0.347 5.452 1.00 0.50 C ATOM 750 CG TRP A 162 -1.750 -0.334 5.734 1.00 0.47 C ATOM 751 CD1 TRP A 162 -2.994 0.071 5.309 1.00 0.43 C ATOM 752 CD2 TRP A 162 -1.961 -1.514 6.519 1.00 0.53 C ATOM 753 NE1 TRP A 162 -3.954 -0.761 5.823 1.00 0.47 N ATOM 754 CE2 TRP A 162 -3.347 -1.750 6.553 1.00 0.52 C ATOM 755 CE3 TRP A 162 -1.114 -2.389 7.201 1.00 0.62 C ATOM 756 CZ2 TRP A 162 -3.903 -2.825 7.245 1.00 0.60 C ATOM 757 CZ3 TRP A 162 -1.665 -3.456 7.885 1.00 0.68 C ATOM 758 CH2 TRP A 162 -3.048 -3.666 7.904 1.00 0.67 C ATOM 0 H TRP A 162 -1.706 2.901 5.284 1.00 0.39 H new ATOM 0 HA TRP A 162 -0.047 1.429 7.228 1.00 0.47 H new ATOM 0 HB2 TRP A 162 -0.340 0.523 4.380 1.00 0.50 H new ATOM 0 HB3 TRP A 162 0.384 -0.313 5.740 1.00 0.50 H new ATOM 0 HD1 TRP A 162 -3.185 0.918 4.667 1.00 0.43 H new ATOM 0 HE1 TRP A 162 -4.960 -0.660 5.685 1.00 0.47 H new ATOM 0 HE3 TRP A 162 -0.045 -2.235 7.194 1.00 0.62 H new ATOM 0 HZ2 TRP A 162 -4.970 -2.988 7.260 1.00 0.60 H new ATOM 0 HZ3 TRP A 162 -1.017 -4.139 8.414 1.00 0.68 H new ATOM 0 HH2 TRP A 162 -3.449 -4.508 8.449 1.00 0.67 H new ATOM 769 N GLY A 163 1.959 2.052 5.576 1.00 0.58 N ATOM 770 CA GLY A 163 2.992 2.802 4.956 1.00 0.63 C ATOM 771 C GLY A 163 4.252 2.006 4.783 1.00 0.62 C ATOM 772 O GLY A 163 4.243 0.777 4.827 1.00 0.63 O ATOM 0 H GLY A 163 2.249 1.174 6.007 1.00 0.58 H new ATOM 0 HA2 GLY A 163 2.649 3.151 3.982 1.00 0.63 H new ATOM 0 HA3 GLY A 163 3.204 3.687 5.555 1.00 0.63 H new ATOM 776 N GLY A 164 5.328 2.723 4.612 1.00 0.66 N ATOM 777 CA GLY A 164 6.613 2.128 4.392 1.00 0.66 C ATOM 778 C GLY A 164 7.679 3.023 4.946 1.00 0.63 C ATOM 779 O GLY A 164 7.421 4.190 5.231 1.00 0.69 O ATOM 0 H GLY A 164 5.336 3.743 4.622 1.00 0.66 H new ATOM 0 HA2 GLY A 164 6.659 1.150 4.871 1.00 0.66 H new ATOM 0 HA3 GLY A 164 6.774 1.969 3.326 1.00 0.66 H new ATOM 783 N VAL A 165 8.857 2.492 5.118 1.00 0.61 N ATOM 784 CA VAL A 165 9.872 3.180 5.836 1.00 0.59 C ATOM 785 C VAL A 165 11.189 3.027 5.114 1.00 0.60 C ATOM 786 O VAL A 165 11.404 2.073 4.361 1.00 0.78 O ATOM 787 CB VAL A 165 9.956 2.680 7.296 1.00 0.73 C ATOM 788 CG1 VAL A 165 10.597 1.303 7.376 1.00 0.96 C ATOM 789 CG2 VAL A 165 10.690 3.678 8.177 1.00 0.88 C ATOM 0 H VAL A 165 9.131 1.576 4.764 1.00 0.61 H new ATOM 0 HA VAL A 165 9.624 4.240 5.881 1.00 0.59 H new ATOM 0 HB VAL A 165 8.936 2.590 7.671 1.00 0.73 H new ATOM 0 HG11 VAL A 165 10.640 0.982 8.417 1.00 0.96 H new ATOM 0 HG12 VAL A 165 10.004 0.592 6.801 1.00 0.96 H new ATOM 0 HG13 VAL A 165 11.607 1.347 6.968 1.00 0.96 H new ATOM 0 HG21 VAL A 165 10.733 3.299 9.198 1.00 0.88 H new ATOM 0 HG22 VAL A 165 11.703 3.821 7.800 1.00 0.88 H new ATOM 0 HG23 VAL A 165 10.161 4.631 8.166 1.00 0.88 H new ATOM 799 N PHE A 166 12.030 3.991 5.335 1.00 0.55 N ATOM 800 CA PHE A 166 13.270 4.138 4.635 1.00 0.61 C ATOM 801 C PHE A 166 14.239 3.040 4.876 1.00 0.61 C ATOM 802 O PHE A 166 14.626 2.702 5.993 1.00 0.84 O ATOM 803 CB PHE A 166 13.938 5.445 5.022 1.00 1.00 C ATOM 804 CG PHE A 166 14.139 5.665 6.502 1.00 1.66 C ATOM 805 CD1 PHE A 166 15.337 5.321 7.110 1.00 1.99 C ATOM 806 CD2 PHE A 166 13.126 6.199 7.284 1.00 2.17 C ATOM 807 CE1 PHE A 166 15.520 5.510 8.466 1.00 2.71 C ATOM 808 CE2 PHE A 166 13.305 6.392 8.639 1.00 2.96 C ATOM 809 CZ PHE A 166 14.515 6.097 9.221 1.00 3.19 C ATOM 0 H PHE A 166 11.867 4.720 6.029 1.00 0.55 H new ATOM 0 HA PHE A 166 13.006 4.116 3.578 1.00 0.61 H new ATOM 0 HB2 PHE A 166 14.910 5.494 4.531 1.00 1.00 H new ATOM 0 HB3 PHE A 166 13.340 6.267 4.629 1.00 1.00 H new ATOM 0 HD1 PHE A 166 16.136 4.901 6.517 1.00 1.99 H new ATOM 0 HD2 PHE A 166 12.185 6.467 6.827 1.00 2.17 H new ATOM 0 HE1 PHE A 166 16.442 5.202 8.937 1.00 2.71 H new ATOM 0 HE2 PHE A 166 12.495 6.775 9.242 1.00 2.96 H new ATOM 0 HZ PHE A 166 14.683 6.322 10.264 1.00 3.19 H new ATOM 819 N TYR A 167 14.574 2.473 3.769 1.00 0.74 N ATOM 820 CA TYR A 167 15.764 1.733 3.632 1.00 1.06 C ATOM 821 C TYR A 167 16.773 2.674 3.044 1.00 0.98 C ATOM 822 O TYR A 167 17.915 2.769 3.493 1.00 1.22 O ATOM 823 CB TYR A 167 15.532 0.591 2.663 1.00 1.45 C ATOM 824 CG TYR A 167 14.289 -0.229 2.953 1.00 2.10 C ATOM 825 CD1 TYR A 167 14.290 -1.179 3.969 1.00 2.48 C ATOM 826 CD2 TYR A 167 13.127 -0.067 2.208 1.00 2.87 C ATOM 827 CE1 TYR A 167 13.167 -1.939 4.238 1.00 3.52 C ATOM 828 CE2 TYR A 167 11.998 -0.823 2.473 1.00 3.88 C ATOM 829 CZ TYR A 167 11.993 -1.711 3.487 1.00 4.19 C ATOM 830 OH TYR A 167 10.902 -2.522 3.753 1.00 5.30 O ATOM 0 H TYR A 167 14.011 2.516 2.920 1.00 0.74 H new ATOM 0 HA TYR A 167 16.097 1.325 4.586 1.00 1.06 H new ATOM 0 HB2 TYR A 167 15.459 0.995 1.653 1.00 1.45 H new ATOM 0 HB3 TYR A 167 16.400 -0.068 2.681 1.00 1.45 H new ATOM 0 HD1 TYR A 167 15.183 -1.325 4.558 1.00 2.48 H new ATOM 0 HD2 TYR A 167 13.104 0.660 1.410 1.00 2.87 H new ATOM 0 HE1 TYR A 167 13.187 -2.694 5.010 1.00 3.52 H new ATOM 0 HE2 TYR A 167 11.115 -0.700 1.863 1.00 3.88 H new ATOM 0 HH TYR A 167 10.204 -1.996 4.196 1.00 5.30 H new ATOM 840 N ALA A 168 16.300 3.376 2.022 1.00 0.72 N ATOM 841 CA ALA A 168 17.152 4.061 1.126 1.00 0.72 C ATOM 842 C ALA A 168 16.294 4.816 0.136 1.00 0.54 C ATOM 843 O ALA A 168 15.092 4.603 0.112 1.00 0.67 O ATOM 844 CB ALA A 168 18.049 3.054 0.447 1.00 1.03 C ATOM 0 H ALA A 168 15.307 3.472 1.811 1.00 0.72 H new ATOM 0 HA ALA A 168 17.787 4.780 1.644 1.00 0.72 H new ATOM 0 HB1 ALA A 168 18.713 3.568 -0.248 1.00 1.03 H new ATOM 0 HB2 ALA A 168 18.643 2.532 1.197 1.00 1.03 H new ATOM 0 HB3 ALA A 168 17.440 2.334 -0.099 1.00 1.03 H new ATOM 850 N GLU A 169 16.926 5.712 -0.592 1.00 0.55 N ATOM 851 CA GLU A 169 16.547 6.125 -1.975 1.00 0.73 C ATOM 852 C GLU A 169 15.060 6.172 -2.281 1.00 0.54 C ATOM 853 O GLU A 169 14.518 7.225 -2.573 1.00 0.78 O ATOM 854 CB GLU A 169 17.163 5.160 -2.982 1.00 1.19 C ATOM 855 CG GLU A 169 18.229 4.268 -2.387 1.00 1.40 C ATOM 856 CD GLU A 169 19.211 3.732 -3.403 1.00 1.80 C ATOM 857 OE1 GLU A 169 20.286 4.341 -3.580 1.00 2.18 O ATOM 858 OE2 GLU A 169 18.899 2.709 -4.046 1.00 2.02 O ATOM 0 H GLU A 169 17.750 6.205 -0.248 1.00 0.55 H new ATOM 0 HA GLU A 169 16.920 7.146 -2.050 1.00 0.73 H new ATOM 0 HB2 GLU A 169 16.375 4.538 -3.406 1.00 1.19 H new ATOM 0 HB3 GLU A 169 17.595 5.731 -3.804 1.00 1.19 H new ATOM 0 HG2 GLU A 169 18.775 4.827 -1.627 1.00 1.40 H new ATOM 0 HG3 GLU A 169 17.748 3.430 -1.882 1.00 1.40 H new ATOM 865 N ILE A 170 14.490 4.977 -2.314 1.00 0.56 N ATOM 866 CA ILE A 170 13.089 4.687 -2.629 1.00 0.54 C ATOM 867 C ILE A 170 12.304 5.856 -3.258 1.00 0.55 C ATOM 868 O ILE A 170 11.380 6.418 -2.686 1.00 0.65 O ATOM 869 CB ILE A 170 12.404 4.092 -1.363 1.00 0.67 C ATOM 870 CG1 ILE A 170 12.871 2.667 -1.148 1.00 0.97 C ATOM 871 CG2 ILE A 170 10.896 4.118 -1.398 1.00 0.83 C ATOM 872 CD1 ILE A 170 12.909 1.832 -2.409 1.00 1.07 C ATOM 0 H ILE A 170 15.020 4.130 -2.110 1.00 0.56 H new ATOM 0 HA ILE A 170 13.079 3.947 -3.429 1.00 0.54 H new ATOM 0 HB ILE A 170 12.703 4.737 -0.537 1.00 0.67 H new ATOM 0 HG12 ILE A 170 13.868 2.685 -0.707 1.00 0.97 H new ATOM 0 HG13 ILE A 170 12.212 2.185 -0.426 1.00 0.97 H new ATOM 0 HG21 ILE A 170 10.503 3.685 -0.478 1.00 0.83 H new ATOM 0 HG22 ILE A 170 10.552 5.148 -1.490 1.00 0.83 H new ATOM 0 HG23 ILE A 170 10.542 3.540 -2.251 1.00 0.83 H new ATOM 0 HD11 ILE A 170 13.254 0.826 -2.169 1.00 1.07 H new ATOM 0 HD12 ILE A 170 11.910 1.780 -2.841 1.00 1.07 H new ATOM 0 HD13 ILE A 170 13.591 2.288 -3.127 1.00 1.07 H new ATOM 884 N LYS A 171 12.677 6.229 -4.466 1.00 0.67 N ATOM 885 CA LYS A 171 11.850 7.151 -5.225 1.00 0.79 C ATOM 886 C LYS A 171 11.205 6.408 -6.363 1.00 0.84 C ATOM 887 O LYS A 171 10.352 6.924 -7.081 1.00 0.92 O ATOM 888 CB LYS A 171 12.695 8.278 -5.784 1.00 1.11 C ATOM 889 CG LYS A 171 14.164 7.929 -5.838 1.00 1.14 C ATOM 890 CD LYS A 171 14.984 9.067 -6.421 1.00 1.48 C ATOM 891 CE LYS A 171 14.677 9.267 -7.897 1.00 1.91 C ATOM 892 NZ LYS A 171 15.295 10.507 -8.434 1.00 2.68 N ATOM 0 H LYS A 171 13.527 5.918 -4.936 1.00 0.67 H new ATOM 0 HA LYS A 171 11.089 7.571 -4.568 1.00 0.79 H new ATOM 0 HB2 LYS A 171 12.347 8.526 -6.787 1.00 1.11 H new ATOM 0 HB3 LYS A 171 12.559 9.168 -5.170 1.00 1.11 H new ATOM 0 HG2 LYS A 171 14.522 7.698 -4.835 1.00 1.14 H new ATOM 0 HG3 LYS A 171 14.304 7.032 -6.441 1.00 1.14 H new ATOM 0 HD2 LYS A 171 14.774 9.987 -5.875 1.00 1.48 H new ATOM 0 HD3 LYS A 171 16.046 8.856 -6.293 1.00 1.48 H new ATOM 0 HE2 LYS A 171 15.039 8.408 -8.462 1.00 1.91 H new ATOM 0 HE3 LYS A 171 13.597 9.310 -8.040 1.00 1.91 H new ATOM 0 HZ1 LYS A 171 15.060 10.603 -9.443 1.00 2.68 H new ATOM 0 HZ2 LYS A 171 14.930 11.330 -7.913 1.00 2.68 H new ATOM 0 HZ3 LYS A 171 16.328 10.457 -8.322 1.00 2.68 H new ATOM 906 N SER A 172 11.631 5.183 -6.504 1.00 0.92 N ATOM 907 CA SER A 172 10.985 4.234 -7.357 1.00 1.13 C ATOM 908 C SER A 172 9.709 3.713 -6.714 1.00 1.05 C ATOM 909 O SER A 172 8.678 3.585 -7.355 1.00 1.12 O ATOM 910 CB SER A 172 11.999 3.160 -7.683 1.00 1.45 C ATOM 911 OG SER A 172 11.400 1.911 -7.987 1.00 1.86 O ATOM 0 H SER A 172 12.450 4.814 -6.020 1.00 0.92 H new ATOM 0 HA SER A 172 10.656 4.687 -8.292 1.00 1.13 H new ATOM 0 HB2 SER A 172 12.604 3.483 -8.530 1.00 1.45 H new ATOM 0 HB3 SER A 172 12.675 3.037 -6.837 1.00 1.45 H new ATOM 0 HG SER A 172 12.098 1.254 -8.191 1.00 1.86 H new ATOM 917 N SER A 173 9.797 3.421 -5.429 1.00 1.00 N ATOM 918 CA SER A 173 8.636 3.069 -4.638 1.00 1.09 C ATOM 919 C SER A 173 7.873 4.332 -4.254 1.00 0.94 C ATOM 920 O SER A 173 6.727 4.281 -3.834 1.00 1.14 O ATOM 921 CB SER A 173 9.055 2.261 -3.411 1.00 1.24 C ATOM 922 OG SER A 173 9.603 1.015 -3.792 1.00 1.47 O ATOM 0 H SER A 173 10.673 3.422 -4.907 1.00 1.00 H new ATOM 0 HA SER A 173 7.969 2.440 -5.228 1.00 1.09 H new ATOM 0 HB2 SER A 173 9.788 2.824 -2.833 1.00 1.24 H new ATOM 0 HB3 SER A 173 8.193 2.101 -2.764 1.00 1.24 H new ATOM 0 HG SER A 173 8.991 0.564 -4.410 1.00 1.47 H new ATOM 928 N CYS A 174 8.512 5.473 -4.482 1.00 0.76 N ATOM 929 CA CYS A 174 7.910 6.781 -4.235 1.00 0.85 C ATOM 930 C CYS A 174 6.984 7.072 -5.386 1.00 0.73 C ATOM 931 O CYS A 174 6.215 8.034 -5.408 1.00 0.88 O ATOM 932 CB CYS A 174 9.014 7.820 -4.173 1.00 1.09 C ATOM 933 SG CYS A 174 8.487 9.522 -3.874 1.00 1.63 S ATOM 0 H CYS A 174 9.464 5.519 -4.844 1.00 0.76 H new ATOM 0 HA CYS A 174 7.358 6.799 -3.295 1.00 0.85 H new ATOM 0 HB2 CYS A 174 9.711 7.533 -3.386 1.00 1.09 H new ATOM 0 HB3 CYS A 174 9.565 7.792 -5.113 1.00 1.09 H new ATOM 0 HG CYS A 174 7.349 9.520 -3.245 1.00 1.63 H new ATOM 939 N ALA A 175 7.089 6.175 -6.326 1.00 0.63 N ATOM 940 CA ALA A 175 6.235 6.126 -7.482 1.00 0.66 C ATOM 941 C ALA A 175 5.045 5.240 -7.147 1.00 0.59 C ATOM 942 O ALA A 175 5.219 4.090 -6.756 1.00 0.65 O ATOM 943 CB ALA A 175 6.994 5.606 -8.687 1.00 0.80 C ATOM 0 H ALA A 175 7.791 5.436 -6.309 1.00 0.63 H new ATOM 0 HA ALA A 175 5.885 7.126 -7.739 1.00 0.66 H new ATOM 0 HB1 ALA A 175 6.330 5.577 -9.551 1.00 0.80 H new ATOM 0 HB2 ALA A 175 7.836 6.265 -8.899 1.00 0.80 H new ATOM 0 HB3 ALA A 175 7.363 4.602 -8.479 1.00 0.80 H new ATOM 949 N LYS A 176 3.842 5.771 -7.274 1.00 0.60 N ATOM 950 CA LYS A 176 2.683 5.128 -6.681 1.00 0.59 C ATOM 951 C LYS A 176 1.505 5.116 -7.626 1.00 0.53 C ATOM 952 O LYS A 176 1.153 6.142 -8.211 1.00 0.66 O ATOM 953 CB LYS A 176 2.269 5.865 -5.416 1.00 0.83 C ATOM 954 CG LYS A 176 3.426 6.471 -4.657 1.00 0.84 C ATOM 955 CD LYS A 176 2.993 7.688 -3.856 1.00 1.59 C ATOM 956 CE LYS A 176 2.663 8.874 -4.748 1.00 2.27 C ATOM 957 NZ LYS A 176 3.829 9.296 -5.570 1.00 2.95 N ATOM 0 H LYS A 176 3.643 6.636 -7.777 1.00 0.60 H new ATOM 0 HA LYS A 176 2.967 4.100 -6.454 1.00 0.59 H new ATOM 0 HB2 LYS A 176 1.566 6.655 -5.681 1.00 0.83 H new ATOM 0 HB3 LYS A 176 1.739 5.174 -4.761 1.00 0.83 H new ATOM 0 HG2 LYS A 176 3.852 5.725 -3.986 1.00 0.84 H new ATOM 0 HG3 LYS A 176 4.212 6.756 -5.357 1.00 0.84 H new ATOM 0 HD2 LYS A 176 2.120 7.434 -3.255 1.00 1.59 H new ATOM 0 HD3 LYS A 176 3.787 7.966 -3.163 1.00 1.59 H new ATOM 0 HE2 LYS A 176 1.832 8.614 -5.404 1.00 2.27 H new ATOM 0 HE3 LYS A 176 2.333 9.710 -4.132 1.00 2.27 H new ATOM 0 HZ1 LYS A 176 3.947 10.327 -5.501 1.00 2.95 H new ATOM 0 HZ2 LYS A 176 4.688 8.825 -5.221 1.00 2.95 H new ATOM 0 HZ3 LYS A 176 3.668 9.032 -6.563 1.00 2.95 H new ATOM 971 N VAL A 177 0.895 3.960 -7.774 1.00 0.43 N ATOM 972 CA VAL A 177 -0.368 3.876 -8.481 1.00 0.41 C ATOM 973 C VAL A 177 -1.421 3.221 -7.623 1.00 0.37 C ATOM 974 O VAL A 177 -1.142 2.274 -6.904 1.00 0.41 O ATOM 975 CB VAL A 177 -0.262 3.145 -9.834 1.00 0.49 C ATOM 976 CG1 VAL A 177 -1.548 3.316 -10.629 1.00 0.68 C ATOM 977 CG2 VAL A 177 0.937 3.635 -10.633 1.00 0.77 C ATOM 0 H VAL A 177 1.248 3.071 -7.418 1.00 0.43 H new ATOM 0 HA VAL A 177 -0.660 4.904 -8.697 1.00 0.41 H new ATOM 0 HB VAL A 177 -0.115 2.083 -9.636 1.00 0.49 H new ATOM 0 HG11 VAL A 177 -1.459 2.795 -11.582 1.00 0.68 H new ATOM 0 HG12 VAL A 177 -2.383 2.900 -10.065 1.00 0.68 H new ATOM 0 HG13 VAL A 177 -1.725 4.376 -10.811 1.00 0.68 H new ATOM 0 HG21 VAL A 177 0.985 3.101 -11.582 1.00 0.77 H new ATOM 0 HG22 VAL A 177 0.836 4.704 -10.823 1.00 0.77 H new ATOM 0 HG23 VAL A 177 1.851 3.452 -10.067 1.00 0.77 H new ATOM 987 N GLN A 178 -2.622 3.748 -7.690 1.00 0.38 N ATOM 988 CA GLN A 178 -3.729 3.189 -6.956 1.00 0.37 C ATOM 989 C GLN A 178 -4.940 2.993 -7.850 1.00 0.33 C ATOM 990 O GLN A 178 -5.159 3.744 -8.802 1.00 0.40 O ATOM 991 CB GLN A 178 -4.068 4.063 -5.735 1.00 0.48 C ATOM 992 CG GLN A 178 -5.514 3.960 -5.270 1.00 0.64 C ATOM 993 CD GLN A 178 -6.356 5.143 -5.723 1.00 1.70 C ATOM 994 OE1 GLN A 178 -6.460 6.149 -5.024 1.00 2.52 O ATOM 995 NE2 GLN A 178 -6.952 5.043 -6.899 1.00 2.30 N ATOM 0 H GLN A 178 -2.856 4.568 -8.250 1.00 0.38 H new ATOM 0 HA GLN A 178 -3.432 2.205 -6.593 1.00 0.37 H new ATOM 0 HB2 GLN A 178 -3.413 3.783 -4.910 1.00 0.48 H new ATOM 0 HB3 GLN A 178 -3.850 5.103 -5.976 1.00 0.48 H new ATOM 0 HG2 GLN A 178 -5.951 3.038 -5.654 1.00 0.64 H new ATOM 0 HG3 GLN A 178 -5.539 3.895 -4.182 1.00 0.64 H new ATOM 0 HE21 GLN A 178 -6.845 4.194 -7.454 1.00 2.30 H new ATOM 0 HE22 GLN A 178 -7.518 5.815 -7.251 1.00 2.30 H new ATOM 1004 N THR A 179 -5.712 1.969 -7.532 1.00 0.32 N ATOM 1005 CA THR A 179 -6.944 1.688 -8.230 1.00 0.32 C ATOM 1006 C THR A 179 -8.124 1.807 -7.275 1.00 0.31 C ATOM 1007 O THR A 179 -8.118 1.211 -6.207 1.00 0.30 O ATOM 1008 CB THR A 179 -6.931 0.257 -8.795 1.00 0.33 C ATOM 1009 OG1 THR A 179 -5.697 0.013 -9.485 1.00 0.36 O ATOM 1010 CG2 THR A 179 -8.099 0.027 -9.743 1.00 0.42 C ATOM 0 H THR A 179 -5.498 1.312 -6.782 1.00 0.32 H new ATOM 0 HA THR A 179 -7.039 2.407 -9.044 1.00 0.32 H new ATOM 0 HB THR A 179 -7.027 -0.435 -7.958 1.00 0.33 H new ATOM 0 HG1 THR A 179 -5.696 -0.900 -9.840 1.00 0.36 H new ATOM 0 HG21 THR A 179 -8.062 -0.993 -10.125 1.00 0.42 H new ATOM 0 HG22 THR A 179 -9.037 0.180 -9.209 1.00 0.42 H new ATOM 0 HG23 THR A 179 -8.036 0.729 -10.575 1.00 0.42 H new ATOM 1018 N ARG A 180 -9.107 2.597 -7.644 1.00 0.38 N ATOM 1019 CA ARG A 180 -10.397 2.578 -6.978 1.00 0.44 C ATOM 1020 C ARG A 180 -11.465 2.697 -8.046 1.00 0.55 C ATOM 1021 O ARG A 180 -11.291 3.435 -9.011 1.00 0.64 O ATOM 1022 CB ARG A 180 -10.540 3.688 -5.923 1.00 0.60 C ATOM 1023 CG ARG A 180 -10.147 5.080 -6.386 1.00 0.95 C ATOM 1024 CD ARG A 180 -11.035 6.154 -5.775 1.00 1.44 C ATOM 1025 NE ARG A 180 -12.461 5.922 -6.021 1.00 1.98 N ATOM 1026 CZ ARG A 180 -13.309 6.862 -6.449 1.00 2.68 C ATOM 1027 NH1 ARG A 180 -12.857 8.050 -6.829 1.00 3.12 N ATOM 1028 NH2 ARG A 180 -14.607 6.599 -6.530 1.00 3.41 N ATOM 0 H ARG A 180 -9.039 3.268 -8.409 1.00 0.38 H new ATOM 0 HA ARG A 180 -10.501 1.642 -6.429 1.00 0.44 H new ATOM 0 HB2 ARG A 180 -11.576 3.714 -5.586 1.00 0.60 H new ATOM 0 HB3 ARG A 180 -9.930 3.425 -5.059 1.00 0.60 H new ATOM 0 HG2 ARG A 180 -9.108 5.272 -6.117 1.00 0.95 H new ATOM 0 HG3 ARG A 180 -10.210 5.132 -7.473 1.00 0.95 H new ATOM 0 HD2 ARG A 180 -10.859 6.196 -4.700 1.00 1.44 H new ATOM 0 HD3 ARG A 180 -10.754 7.125 -6.182 1.00 1.44 H new ATOM 0 HE ARG A 180 -12.829 4.985 -5.855 1.00 1.98 H new ATOM 0 HH11 ARG A 180 -11.857 8.250 -6.795 1.00 3.12 H new ATOM 0 HH12 ARG A 180 -13.509 8.763 -7.155 1.00 3.12 H new ATOM 0 HH21 ARG A 180 -14.958 5.679 -6.265 1.00 3.41 H new ATOM 0 HH22 ARG A 180 -15.253 7.317 -6.857 1.00 3.41 H new ATOM 1042 N LYS A 181 -12.550 1.971 -7.888 1.00 0.61 N ATOM 1043 CA LYS A 181 -13.544 1.861 -8.948 1.00 0.75 C ATOM 1044 C LYS A 181 -14.846 1.311 -8.397 1.00 0.71 C ATOM 1045 O LYS A 181 -15.935 1.706 -8.809 1.00 0.89 O ATOM 1046 CB LYS A 181 -13.016 0.931 -10.047 1.00 0.91 C ATOM 1047 CG LYS A 181 -12.741 -0.481 -9.547 1.00 0.92 C ATOM 1048 CD LYS A 181 -11.659 -1.174 -10.360 1.00 1.36 C ATOM 1049 CE LYS A 181 -12.136 -1.493 -11.767 1.00 1.64 C ATOM 1050 NZ LYS A 181 -13.189 -2.543 -11.770 1.00 2.13 N ATOM 0 H LYS A 181 -12.771 1.447 -7.041 1.00 0.61 H new ATOM 0 HA LYS A 181 -13.730 2.852 -9.363 1.00 0.75 H new ATOM 0 HB2 LYS A 181 -13.741 0.888 -10.859 1.00 0.91 H new ATOM 0 HB3 LYS A 181 -12.099 1.350 -10.460 1.00 0.91 H new ATOM 0 HG2 LYS A 181 -12.439 -0.442 -8.500 1.00 0.92 H new ATOM 0 HG3 LYS A 181 -13.659 -1.067 -9.592 1.00 0.92 H new ATOM 0 HD2 LYS A 181 -10.776 -0.537 -10.410 1.00 1.36 H new ATOM 0 HD3 LYS A 181 -11.360 -2.095 -9.859 1.00 1.36 H new ATOM 0 HE2 LYS A 181 -12.525 -0.587 -12.233 1.00 1.64 H new ATOM 0 HE3 LYS A 181 -11.291 -1.824 -12.371 1.00 1.64 H new ATOM 0 HZ1 LYS A 181 -13.319 -2.901 -12.738 1.00 2.13 H new ATOM 0 HZ2 LYS A 181 -12.902 -3.325 -11.147 1.00 2.13 H new ATOM 0 HZ3 LYS A 181 -14.084 -2.138 -11.427 1.00 2.13 H new ATOM 1064 N GLY A 182 -14.711 0.402 -7.451 1.00 0.64 N ATOM 1065 CA GLY A 182 -15.849 -0.282 -6.907 1.00 0.73 C ATOM 1066 C GLY A 182 -15.663 -0.594 -5.449 1.00 0.65 C ATOM 1067 O GLY A 182 -15.694 0.291 -4.601 1.00 0.78 O ATOM 0 H GLY A 182 -13.816 0.125 -7.047 1.00 0.64 H new ATOM 0 HA2 GLY A 182 -16.740 0.332 -7.037 1.00 0.73 H new ATOM 0 HA3 GLY A 182 -16.016 -1.207 -7.459 1.00 0.73 H new ATOM 1071 N SER A 183 -15.461 -1.859 -5.167 1.00 0.61 N ATOM 1072 CA SER A 183 -15.213 -2.308 -3.812 1.00 0.70 C ATOM 1073 C SER A 183 -13.732 -2.638 -3.616 1.00 0.66 C ATOM 1074 O SER A 183 -13.355 -3.243 -2.619 1.00 0.81 O ATOM 1075 CB SER A 183 -16.091 -3.526 -3.511 1.00 0.88 C ATOM 1076 OG SER A 183 -16.040 -3.891 -2.142 1.00 1.60 O ATOM 0 H SER A 183 -15.463 -2.604 -5.863 1.00 0.61 H new ATOM 0 HA SER A 183 -15.468 -1.509 -3.116 1.00 0.70 H new ATOM 0 HB2 SER A 183 -17.122 -3.308 -3.790 1.00 0.88 H new ATOM 0 HB3 SER A 183 -15.766 -4.367 -4.123 1.00 0.88 H new ATOM 0 HG SER A 183 -15.123 -3.790 -1.810 1.00 1.60 H new ATOM 1082 N LEU A 184 -12.891 -2.238 -4.566 1.00 0.53 N ATOM 1083 CA LEU A 184 -11.471 -2.565 -4.490 1.00 0.51 C ATOM 1084 C LEU A 184 -10.571 -1.349 -4.680 1.00 0.39 C ATOM 1085 O LEU A 184 -10.757 -0.544 -5.596 1.00 0.43 O ATOM 1086 CB LEU A 184 -11.105 -3.646 -5.503 1.00 0.68 C ATOM 1087 CG LEU A 184 -10.889 -5.034 -4.899 1.00 1.14 C ATOM 1088 CD1 LEU A 184 -10.428 -6.019 -5.960 1.00 1.80 C ATOM 1089 CD2 LEU A 184 -9.881 -4.958 -3.765 1.00 2.15 C ATOM 0 H LEU A 184 -13.163 -1.695 -5.386 1.00 0.53 H new ATOM 0 HA LEU A 184 -11.299 -2.941 -3.481 1.00 0.51 H new ATOM 0 HB2 LEU A 184 -11.896 -3.708 -6.251 1.00 0.68 H new ATOM 0 HB3 LEU A 184 -10.196 -3.345 -6.024 1.00 0.68 H new ATOM 0 HG LEU A 184 -11.839 -5.390 -4.500 1.00 1.14 H new ATOM 0 HD11 LEU A 184 -10.281 -6.999 -5.507 1.00 1.80 H new ATOM 0 HD12 LEU A 184 -11.183 -6.091 -6.743 1.00 1.80 H new ATOM 0 HD13 LEU A 184 -9.489 -5.675 -6.393 1.00 1.80 H new ATOM 0 HD21 LEU A 184 -9.734 -5.952 -3.342 1.00 2.15 H new ATOM 0 HD22 LEU A 184 -8.932 -4.582 -4.147 1.00 2.15 H new ATOM 0 HD23 LEU A 184 -10.253 -4.286 -2.992 1.00 2.15 H new ATOM 1101 N LEU A 185 -9.596 -1.249 -3.784 1.00 0.32 N ATOM 1102 CA LEU A 185 -8.583 -0.208 -3.786 1.00 0.30 C ATOM 1103 C LEU A 185 -7.228 -0.870 -3.923 1.00 0.29 C ATOM 1104 O LEU A 185 -6.982 -1.889 -3.314 1.00 0.48 O ATOM 1105 CB LEU A 185 -8.602 0.611 -2.490 1.00 0.38 C ATOM 1106 CG LEU A 185 -9.756 1.611 -2.308 1.00 0.55 C ATOM 1107 CD1 LEU A 185 -11.111 0.997 -2.577 1.00 0.99 C ATOM 1108 CD2 LEU A 185 -9.723 2.190 -0.906 1.00 1.07 C ATOM 0 H LEU A 185 -9.488 -1.911 -3.015 1.00 0.32 H new ATOM 0 HA LEU A 185 -8.786 0.471 -4.614 1.00 0.30 H new ATOM 0 HB2 LEU A 185 -8.622 -0.085 -1.651 1.00 0.38 H new ATOM 0 HB3 LEU A 185 -7.664 1.162 -2.425 1.00 0.38 H new ATOM 0 HG LEU A 185 -9.610 2.402 -3.044 1.00 0.55 H new ATOM 0 HD11 LEU A 185 -11.886 1.749 -2.433 1.00 0.99 H new ATOM 0 HD12 LEU A 185 -11.147 0.630 -3.603 1.00 0.99 H new ATOM 0 HD13 LEU A 185 -11.278 0.168 -1.889 1.00 0.99 H new ATOM 0 HD21 LEU A 185 -10.543 2.897 -0.785 1.00 1.07 H new ATOM 0 HD22 LEU A 185 -9.827 1.386 -0.178 1.00 1.07 H new ATOM 0 HD23 LEU A 185 -8.775 2.703 -0.747 1.00 1.07 H new ATOM 1120 N HIS A 186 -6.385 -0.331 -4.758 1.00 0.27 N ATOM 1121 CA HIS A 186 -5.097 -0.943 -5.064 1.00 0.30 C ATOM 1122 C HIS A 186 -3.962 0.029 -4.815 1.00 0.40 C ATOM 1123 O HIS A 186 -4.110 1.199 -5.100 1.00 0.67 O ATOM 1124 CB HIS A 186 -5.058 -1.321 -6.529 1.00 0.44 C ATOM 1125 CG HIS A 186 -5.942 -2.469 -6.919 1.00 0.67 C ATOM 1126 ND1 HIS A 186 -5.481 -3.568 -7.610 1.00 1.18 N ATOM 1127 CD2 HIS A 186 -7.270 -2.674 -6.743 1.00 1.54 C ATOM 1128 CE1 HIS A 186 -6.483 -4.393 -7.840 1.00 1.51 C ATOM 1129 NE2 HIS A 186 -7.582 -3.877 -7.325 1.00 1.79 N ATOM 0 H HIS A 186 -6.559 0.544 -5.252 1.00 0.27 H new ATOM 0 HA HIS A 186 -4.980 -1.818 -4.424 1.00 0.30 H new ATOM 0 HB2 HIS A 186 -5.340 -0.450 -7.120 1.00 0.44 H new ATOM 0 HB3 HIS A 186 -4.031 -1.568 -6.796 1.00 0.44 H new ATOM 0 HD1 HIS A 186 -4.515 -3.720 -7.899 1.00 1.18 H new ATOM 0 HD2 HIS A 186 -7.957 -2.012 -6.237 1.00 1.54 H new ATOM 0 HE1 HIS A 186 -6.415 -5.335 -8.363 1.00 1.51 H new ATOM 1138 N LEU A 187 -2.856 -0.427 -4.270 1.00 0.32 N ATOM 1139 CA LEU A 187 -1.622 0.292 -4.406 1.00 0.37 C ATOM 1140 C LEU A 187 -0.729 -0.603 -5.215 1.00 0.36 C ATOM 1141 O LEU A 187 -0.430 -1.722 -4.784 1.00 0.35 O ATOM 1142 CB LEU A 187 -0.953 0.543 -3.053 1.00 0.43 C ATOM 1143 CG LEU A 187 -0.023 1.768 -2.952 1.00 0.55 C ATOM 1144 CD1 LEU A 187 0.834 1.671 -1.701 1.00 1.38 C ATOM 1145 CD2 LEU A 187 0.862 1.923 -4.179 1.00 1.26 C ATOM 0 H LEU A 187 -2.792 -1.291 -3.731 1.00 0.32 H new ATOM 0 HA LEU A 187 -1.801 1.264 -4.865 1.00 0.37 H new ATOM 0 HB2 LEU A 187 -1.736 0.648 -2.302 1.00 0.43 H new ATOM 0 HB3 LEU A 187 -0.376 -0.344 -2.790 1.00 0.43 H new ATOM 0 HG LEU A 187 -0.657 2.653 -2.895 1.00 0.55 H new ATOM 0 HD11 LEU A 187 1.487 2.541 -1.639 1.00 1.38 H new ATOM 0 HD12 LEU A 187 0.191 1.637 -0.821 1.00 1.38 H new ATOM 0 HD13 LEU A 187 1.439 0.765 -1.744 1.00 1.38 H new ATOM 0 HD21 LEU A 187 1.499 2.800 -4.060 1.00 1.26 H new ATOM 0 HD22 LEU A 187 1.484 1.035 -4.293 1.00 1.26 H new ATOM 0 HD23 LEU A 187 0.238 2.045 -5.064 1.00 1.26 H new ATOM 1157 N THR A 188 -0.357 -0.125 -6.381 1.00 0.39 N ATOM 1158 CA THR A 188 0.653 -0.759 -7.181 1.00 0.44 C ATOM 1159 C THR A 188 1.967 -0.072 -6.907 1.00 0.50 C ATOM 1160 O THR A 188 2.167 1.090 -7.276 1.00 0.55 O ATOM 1161 CB THR A 188 0.311 -0.674 -8.675 1.00 0.51 C ATOM 1162 OG1 THR A 188 -0.455 0.501 -8.928 1.00 0.70 O ATOM 1163 CG2 THR A 188 -0.483 -1.889 -9.121 1.00 0.47 C ATOM 0 H THR A 188 -0.751 0.718 -6.798 1.00 0.39 H new ATOM 0 HA THR A 188 0.714 -1.816 -6.921 1.00 0.44 H new ATOM 0 HB THR A 188 1.245 -0.639 -9.235 1.00 0.51 H new ATOM 0 HG1 THR A 188 -0.831 0.458 -9.832 1.00 0.70 H new ATOM 0 HG21 THR A 188 -0.712 -1.804 -10.183 1.00 0.47 H new ATOM 0 HG22 THR A 188 0.104 -2.791 -8.948 1.00 0.47 H new ATOM 0 HG23 THR A 188 -1.411 -1.946 -8.553 1.00 0.47 H new ATOM 1171 N LEU A 189 2.839 -0.782 -6.235 1.00 0.52 N ATOM 1172 CA LEU A 189 4.057 -0.212 -5.742 1.00 0.58 C ATOM 1173 C LEU A 189 5.265 -0.858 -6.398 1.00 0.61 C ATOM 1174 O LEU A 189 5.507 -2.043 -6.207 1.00 0.67 O ATOM 1175 CB LEU A 189 4.091 -0.382 -4.231 1.00 0.67 C ATOM 1176 CG LEU A 189 5.427 -0.073 -3.590 1.00 0.75 C ATOM 1177 CD1 LEU A 189 5.867 1.296 -4.038 1.00 1.08 C ATOM 1178 CD2 LEU A 189 5.295 -0.107 -2.090 1.00 1.21 C ATOM 0 H LEU A 189 2.719 -1.771 -6.017 1.00 0.52 H new ATOM 0 HA LEU A 189 4.094 0.849 -5.989 1.00 0.58 H new ATOM 0 HB2 LEU A 189 3.333 0.265 -3.789 1.00 0.67 H new ATOM 0 HB3 LEU A 189 3.815 -1.408 -3.988 1.00 0.67 H new ATOM 0 HG LEU A 189 6.166 -0.816 -3.890 1.00 0.75 H new ATOM 0 HD11 LEU A 189 6.829 1.535 -3.585 1.00 1.08 H new ATOM 0 HD12 LEU A 189 5.963 1.310 -5.124 1.00 1.08 H new ATOM 0 HD13 LEU A 189 5.127 2.035 -3.730 1.00 1.08 H new ATOM 0 HD21 LEU A 189 6.260 0.116 -1.635 1.00 1.21 H new ATOM 0 HD22 LEU A 189 4.563 0.636 -1.772 1.00 1.21 H new ATOM 0 HD23 LEU A 189 4.966 -1.098 -1.776 1.00 1.21 H new ATOM 1190 N PRO A 190 6.023 -0.091 -7.191 1.00 0.66 N ATOM 1191 CA PRO A 190 7.288 -0.555 -7.759 1.00 0.73 C ATOM 1192 C PRO A 190 8.230 -1.051 -6.670 1.00 0.89 C ATOM 1193 O PRO A 190 8.192 -0.574 -5.532 1.00 0.98 O ATOM 1194 CB PRO A 190 7.853 0.696 -8.437 1.00 0.86 C ATOM 1195 CG PRO A 190 6.656 1.523 -8.746 1.00 0.86 C ATOM 1196 CD PRO A 190 5.696 1.276 -7.620 1.00 0.78 C ATOM 0 HA PRO A 190 7.161 -1.393 -8.444 1.00 0.73 H new ATOM 0 HB2 PRO A 190 8.543 1.226 -7.781 1.00 0.86 H new ATOM 0 HB3 PRO A 190 8.405 0.442 -9.342 1.00 0.86 H new ATOM 0 HG2 PRO A 190 6.916 2.579 -8.815 1.00 0.86 H new ATOM 0 HG3 PRO A 190 6.219 1.239 -9.703 1.00 0.86 H new ATOM 0 HD2 PRO A 190 5.831 1.994 -6.811 1.00 0.78 H new ATOM 0 HD3 PRO A 190 4.660 1.357 -7.949 1.00 0.78 H new ATOM 1204 N LYS A 191 9.074 -1.999 -7.040 1.00 1.06 N ATOM 1205 CA LYS A 191 9.908 -2.727 -6.092 1.00 1.32 C ATOM 1206 C LYS A 191 10.790 -1.801 -5.267 1.00 1.50 C ATOM 1207 O LYS A 191 11.489 -0.935 -5.797 1.00 1.61 O ATOM 1208 CB LYS A 191 10.763 -3.742 -6.849 1.00 1.60 C ATOM 1209 CG LYS A 191 11.584 -3.137 -7.974 1.00 1.99 C ATOM 1210 CD LYS A 191 11.968 -4.188 -8.997 1.00 2.64 C ATOM 1211 CE LYS A 191 12.746 -3.584 -10.151 1.00 3.26 C ATOM 1212 NZ LYS A 191 12.785 -4.498 -11.322 1.00 3.64 N ATOM 0 H LYS A 191 9.202 -2.288 -8.010 1.00 1.06 H new ATOM 0 HA LYS A 191 9.250 -3.242 -5.392 1.00 1.32 H new ATOM 0 HB2 LYS A 191 11.435 -4.233 -6.145 1.00 1.60 H new ATOM 0 HB3 LYS A 191 10.113 -4.514 -7.261 1.00 1.60 H new ATOM 0 HG2 LYS A 191 11.014 -2.345 -8.459 1.00 1.99 H new ATOM 0 HG3 LYS A 191 12.484 -2.678 -7.565 1.00 1.99 H new ATOM 0 HD2 LYS A 191 12.568 -4.961 -8.518 1.00 2.64 H new ATOM 0 HD3 LYS A 191 11.069 -4.672 -9.377 1.00 2.64 H new ATOM 0 HE2 LYS A 191 12.290 -2.638 -10.442 1.00 3.26 H new ATOM 0 HE3 LYS A 191 13.763 -3.362 -9.828 1.00 3.26 H new ATOM 0 HZ1 LYS A 191 13.325 -4.053 -12.092 1.00 3.64 H new ATOM 0 HZ2 LYS A 191 13.242 -5.391 -11.050 1.00 3.64 H new ATOM 0 HZ3 LYS A 191 11.815 -4.690 -11.645 1.00 3.64 H new ATOM 1226 N LYS A 192 10.720 -1.991 -3.954 1.00 1.73 N ATOM 1227 CA LYS A 192 11.527 -1.227 -3.022 1.00 2.06 C ATOM 1228 C LYS A 192 12.920 -1.846 -2.884 1.00 2.14 C ATOM 1229 O LYS A 192 13.847 -1.462 -3.590 1.00 2.45 O ATOM 1230 CB LYS A 192 10.825 -1.114 -1.655 1.00 2.43 C ATOM 1231 CG LYS A 192 10.204 -2.411 -1.146 1.00 2.74 C ATOM 1232 CD LYS A 192 9.622 -2.236 0.248 1.00 3.41 C ATOM 1233 CE LYS A 192 9.042 -3.537 0.785 1.00 4.16 C ATOM 1234 NZ LYS A 192 8.604 -3.408 2.204 1.00 4.71 N ATOM 0 H LYS A 192 10.105 -2.675 -3.512 1.00 1.73 H new ATOM 0 HA LYS A 192 11.647 -0.218 -3.416 1.00 2.06 H new ATOM 0 HB2 LYS A 192 11.547 -0.760 -0.919 1.00 2.43 H new ATOM 0 HB3 LYS A 192 10.044 -0.357 -1.725 1.00 2.43 H new ATOM 0 HG2 LYS A 192 9.421 -2.735 -1.831 1.00 2.74 H new ATOM 0 HG3 LYS A 192 10.959 -3.197 -1.131 1.00 2.74 H new ATOM 0 HD2 LYS A 192 10.398 -1.878 0.924 1.00 3.41 H new ATOM 0 HD3 LYS A 192 8.844 -1.473 0.224 1.00 3.41 H new ATOM 0 HE2 LYS A 192 8.194 -3.837 0.170 1.00 4.16 H new ATOM 0 HE3 LYS A 192 9.789 -4.327 0.706 1.00 4.16 H new ATOM 0 HZ1 LYS A 192 8.263 -4.329 2.547 1.00 4.71 H new ATOM 0 HZ2 LYS A 192 9.406 -3.097 2.788 1.00 4.71 H new ATOM 0 HZ3 LYS A 192 7.837 -2.708 2.268 1.00 4.71 H new ATOM 1248 N VAL A 193 13.065 -2.808 -1.981 1.00 2.09 N ATOM 1249 CA VAL A 193 14.314 -3.541 -1.838 1.00 2.30 C ATOM 1250 C VAL A 193 14.029 -5.029 -1.789 1.00 2.34 C ATOM 1251 O VAL A 193 13.539 -5.546 -0.782 1.00 2.29 O ATOM 1252 CB VAL A 193 15.107 -3.118 -0.579 1.00 2.58 C ATOM 1253 CG1 VAL A 193 16.432 -3.867 -0.500 1.00 2.90 C ATOM 1254 CG2 VAL A 193 15.348 -1.614 -0.561 1.00 2.95 C ATOM 0 H VAL A 193 12.330 -3.098 -1.336 1.00 2.09 H new ATOM 0 HA VAL A 193 14.932 -3.304 -2.704 1.00 2.30 H new ATOM 0 HB VAL A 193 14.508 -3.377 0.294 1.00 2.58 H new ATOM 0 HG11 VAL A 193 16.974 -3.555 0.393 1.00 2.90 H new ATOM 0 HG12 VAL A 193 16.242 -4.939 -0.452 1.00 2.90 H new ATOM 0 HG13 VAL A 193 17.030 -3.644 -1.384 1.00 2.90 H new ATOM 0 HG21 VAL A 193 15.907 -1.346 0.335 1.00 2.95 H new ATOM 0 HG22 VAL A 193 15.918 -1.326 -1.444 1.00 2.95 H new ATOM 0 HG23 VAL A 193 14.391 -1.092 -0.561 1.00 2.95 H new ATOM 1264 N PRO A 194 14.297 -5.726 -2.895 1.00 2.59 N ATOM 1265 CA PRO A 194 14.063 -7.158 -2.997 1.00 2.88 C ATOM 1266 C PRO A 194 15.143 -7.985 -2.301 1.00 3.13 C ATOM 1267 O PRO A 194 16.227 -7.481 -2.021 1.00 3.21 O ATOM 1268 CB PRO A 194 14.079 -7.400 -4.501 1.00 3.34 C ATOM 1269 CG PRO A 194 15.040 -6.390 -5.008 1.00 3.19 C ATOM 1270 CD PRO A 194 14.844 -5.171 -4.149 1.00 2.80 C ATOM 0 HA PRO A 194 13.136 -7.458 -2.509 1.00 2.88 H new ATOM 0 HB2 PRO A 194 14.400 -8.414 -4.740 1.00 3.34 H new ATOM 0 HB3 PRO A 194 13.090 -7.267 -4.939 1.00 3.34 H new ATOM 0 HG2 PRO A 194 16.064 -6.756 -4.940 1.00 3.19 H new ATOM 0 HG3 PRO A 194 14.852 -6.163 -6.057 1.00 3.19 H new ATOM 0 HD2 PRO A 194 15.782 -4.643 -3.980 1.00 2.80 H new ATOM 0 HD3 PRO A 194 14.157 -4.461 -4.609 1.00 2.80 H new ATOM 1278 N MET A 195 14.797 -9.240 -1.991 1.00 3.35 N ATOM 1279 CA MET A 195 15.719 -10.249 -1.429 1.00 3.77 C ATOM 1280 C MET A 195 15.979 -9.964 0.045 1.00 3.52 C ATOM 1281 O MET A 195 16.823 -10.587 0.692 1.00 3.93 O ATOM 1282 CB MET A 195 17.031 -10.365 -2.239 1.00 4.38 C ATOM 1283 CG MET A 195 18.188 -9.502 -1.748 1.00 4.43 C ATOM 1284 SD MET A 195 19.610 -9.556 -2.857 1.00 5.16 S ATOM 1285 CE MET A 195 18.896 -8.878 -4.355 1.00 5.60 C ATOM 0 H MET A 195 13.850 -9.595 -2.124 1.00 3.35 H new ATOM 0 HA MET A 195 15.235 -11.222 -1.507 1.00 3.77 H new ATOM 0 HB2 MET A 195 17.350 -11.407 -2.232 1.00 4.38 H new ATOM 0 HB3 MET A 195 16.821 -10.103 -3.276 1.00 4.38 H new ATOM 0 HG2 MET A 195 17.850 -8.471 -1.646 1.00 4.43 H new ATOM 0 HG3 MET A 195 18.492 -9.837 -0.756 1.00 4.43 H new ATOM 0 HE1 MET A 195 19.683 -8.437 -4.966 1.00 5.60 H new ATOM 0 HE2 MET A 195 18.404 -9.673 -4.916 1.00 5.60 H new ATOM 0 HE3 MET A 195 18.166 -8.111 -4.095 1.00 5.60 H new ATOM 1295 N LEU A 196 15.221 -9.018 0.554 1.00 2.98 N ATOM 1296 CA LEU A 196 15.207 -8.681 1.954 1.00 2.89 C ATOM 1297 C LEU A 196 13.850 -9.039 2.500 1.00 2.64 C ATOM 1298 O LEU A 196 12.845 -8.851 1.832 1.00 2.41 O ATOM 1299 CB LEU A 196 15.539 -7.207 2.149 1.00 2.77 C ATOM 1300 CG LEU A 196 14.530 -6.363 2.944 1.00 3.23 C ATOM 1301 CD1 LEU A 196 14.745 -6.524 4.441 1.00 3.64 C ATOM 1302 CD2 LEU A 196 14.632 -4.897 2.551 1.00 3.80 C ATOM 0 H LEU A 196 14.585 -8.452 -0.008 1.00 2.98 H new ATOM 0 HA LEU A 196 15.968 -9.241 2.498 1.00 2.89 H new ATOM 0 HB2 LEU A 196 16.505 -7.141 2.650 1.00 2.77 H new ATOM 0 HB3 LEU A 196 15.659 -6.754 1.165 1.00 2.77 H new ATOM 0 HG LEU A 196 13.529 -6.720 2.702 1.00 3.23 H new ATOM 0 HD11 LEU A 196 14.018 -5.916 4.980 1.00 3.64 H new ATOM 0 HD12 LEU A 196 14.618 -7.571 4.716 1.00 3.64 H new ATOM 0 HD13 LEU A 196 15.753 -6.200 4.701 1.00 3.64 H new ATOM 0 HD21 LEU A 196 13.910 -4.316 3.124 1.00 3.80 H new ATOM 0 HD22 LEU A 196 15.638 -4.534 2.760 1.00 3.80 H new ATOM 0 HD23 LEU A 196 14.421 -4.790 1.487 1.00 3.80 H new ATOM 1314 N THR A 197 13.817 -9.598 3.677 1.00 2.86 N ATOM 1315 CA THR A 197 12.601 -10.189 4.169 1.00 2.73 C ATOM 1316 C THR A 197 11.802 -9.194 4.993 1.00 2.44 C ATOM 1317 O THR A 197 12.246 -8.732 6.047 1.00 2.80 O ATOM 1318 CB THR A 197 12.949 -11.459 4.950 1.00 3.34 C ATOM 1319 OG1 THR A 197 13.523 -11.150 6.229 1.00 3.71 O ATOM 1320 CG2 THR A 197 13.957 -12.227 4.122 1.00 3.84 C ATOM 0 H THR A 197 14.613 -9.658 4.312 1.00 2.86 H new ATOM 0 HA THR A 197 11.958 -10.467 3.333 1.00 2.73 H new ATOM 0 HB THR A 197 12.044 -12.039 5.129 1.00 3.34 H new ATOM 0 HG1 THR A 197 13.245 -10.252 6.504 1.00 3.71 H new ATOM 0 HG21 THR A 197 14.234 -13.143 4.644 1.00 3.84 H new ATOM 0 HG22 THR A 197 13.519 -12.478 3.156 1.00 3.84 H new ATOM 0 HG23 THR A 197 14.845 -11.614 3.969 1.00 3.84 H new ATOM 1328 N TRP A 198 10.639 -8.827 4.477 1.00 2.12 N ATOM 1329 CA TRP A 198 9.795 -7.849 5.123 1.00 2.18 C ATOM 1330 C TRP A 198 8.724 -8.553 5.933 1.00 2.10 C ATOM 1331 O TRP A 198 7.933 -9.329 5.395 1.00 1.86 O ATOM 1332 CB TRP A 198 9.136 -6.944 4.081 1.00 2.35 C ATOM 1333 CG TRP A 198 9.900 -6.877 2.793 1.00 2.45 C ATOM 1334 CD1 TRP A 198 10.863 -5.975 2.451 1.00 2.79 C ATOM 1335 CD2 TRP A 198 9.776 -7.774 1.685 1.00 2.74 C ATOM 1336 NE1 TRP A 198 11.333 -6.244 1.189 1.00 2.99 N ATOM 1337 CE2 TRP A 198 10.684 -7.348 0.701 1.00 2.99 C ATOM 1338 CE3 TRP A 198 8.984 -8.898 1.432 1.00 3.25 C ATOM 1339 CZ2 TRP A 198 10.821 -8.006 -0.516 1.00 3.56 C ATOM 1340 CZ3 TRP A 198 9.123 -9.550 0.223 1.00 3.96 C ATOM 1341 CH2 TRP A 198 10.035 -9.104 -0.739 1.00 4.04 C ATOM 0 H TRP A 198 10.261 -9.199 3.606 1.00 2.12 H new ATOM 0 HA TRP A 198 10.410 -7.238 5.784 1.00 2.18 H new ATOM 0 HB2 TRP A 198 8.128 -7.306 3.880 1.00 2.35 H new ATOM 0 HB3 TRP A 198 9.038 -5.939 4.491 1.00 2.35 H new ATOM 0 HD1 TRP A 198 11.206 -5.167 3.080 1.00 2.79 H new ATOM 0 HE1 TRP A 198 12.048 -5.710 0.696 1.00 2.99 H new ATOM 0 HE3 TRP A 198 8.277 -9.250 2.169 1.00 3.25 H new ATOM 0 HZ2 TRP A 198 11.524 -7.662 -1.260 1.00 3.56 H new ATOM 0 HZ3 TRP A 198 8.517 -10.420 0.016 1.00 3.96 H new ATOM 0 HH2 TRP A 198 10.121 -9.636 -1.675 1.00 4.04 H new ATOM 1352 N PRO A 199 8.701 -8.288 7.243 1.00 2.57 N ATOM 1353 CA PRO A 199 7.694 -8.832 8.151 1.00 2.78 C ATOM 1354 C PRO A 199 6.287 -8.449 7.716 1.00 2.32 C ATOM 1355 O PRO A 199 5.329 -9.195 7.918 1.00 2.35 O ATOM 1356 CB PRO A 199 8.032 -8.179 9.502 1.00 3.36 C ATOM 1357 CG PRO A 199 8.904 -7.018 9.162 1.00 3.70 C ATOM 1358 CD PRO A 199 9.663 -7.437 7.943 1.00 3.21 C ATOM 0 HA PRO A 199 7.710 -9.921 8.181 1.00 2.78 H new ATOM 0 HB2 PRO A 199 7.130 -7.856 10.021 1.00 3.36 H new ATOM 0 HB3 PRO A 199 8.546 -8.879 10.161 1.00 3.36 H new ATOM 0 HG2 PRO A 199 8.311 -6.124 8.968 1.00 3.70 H new ATOM 0 HG3 PRO A 199 9.580 -6.780 9.983 1.00 3.70 H new ATOM 0 HD2 PRO A 199 9.962 -6.581 7.338 1.00 3.21 H new ATOM 0 HD3 PRO A 199 10.573 -7.980 8.199 1.00 3.21 H new ATOM 1366 N SER A 200 6.186 -7.279 7.105 1.00 1.98 N ATOM 1367 CA SER A 200 4.937 -6.742 6.665 1.00 1.64 C ATOM 1368 C SER A 200 5.166 -5.681 5.595 1.00 1.46 C ATOM 1369 O SER A 200 6.253 -5.106 5.484 1.00 1.48 O ATOM 1370 CB SER A 200 4.209 -6.162 7.870 1.00 1.61 C ATOM 1371 OG SER A 200 5.079 -5.349 8.644 1.00 2.22 O ATOM 0 H SER A 200 6.987 -6.679 6.905 1.00 1.98 H new ATOM 0 HA SER A 200 4.326 -7.527 6.220 1.00 1.64 H new ATOM 0 HB2 SER A 200 3.356 -5.572 7.535 1.00 1.61 H new ATOM 0 HB3 SER A 200 3.816 -6.970 8.486 1.00 1.61 H new ATOM 0 HG SER A 200 4.742 -4.429 8.657 1.00 2.22 H new ATOM 1377 N LEU A 201 4.143 -5.476 4.792 1.00 1.48 N ATOM 1378 CA LEU A 201 4.100 -4.396 3.794 1.00 1.53 C ATOM 1379 C LEU A 201 4.318 -3.069 4.467 1.00 1.27 C ATOM 1380 O LEU A 201 4.989 -2.184 3.939 1.00 1.34 O ATOM 1381 CB LEU A 201 2.732 -4.293 3.107 1.00 1.86 C ATOM 1382 CG LEU A 201 2.024 -5.615 2.790 1.00 2.53 C ATOM 1383 CD1 LEU A 201 3.027 -6.631 2.289 1.00 3.12 C ATOM 1384 CD2 LEU A 201 1.280 -6.137 4.009 1.00 3.06 C ATOM 0 H LEU A 201 3.303 -6.054 4.804 1.00 1.48 H new ATOM 0 HA LEU A 201 4.874 -4.628 3.062 1.00 1.53 H new ATOM 0 HB2 LEU A 201 2.075 -3.698 3.742 1.00 1.86 H new ATOM 0 HB3 LEU A 201 2.859 -3.742 2.175 1.00 1.86 H new ATOM 0 HG LEU A 201 1.288 -5.439 2.006 1.00 2.53 H new ATOM 0 HD11 LEU A 201 2.516 -7.568 2.066 1.00 3.12 H new ATOM 0 HD12 LEU A 201 3.506 -6.255 1.385 1.00 3.12 H new ATOM 0 HD13 LEU A 201 3.783 -6.804 3.055 1.00 3.12 H new ATOM 0 HD21 LEU A 201 0.786 -7.076 3.759 1.00 3.06 H new ATOM 0 HD22 LEU A 201 1.986 -6.304 4.822 1.00 3.06 H new ATOM 0 HD23 LEU A 201 0.534 -5.406 4.321 1.00 3.06 H new ATOM 1396 N LEU A 202 3.763 -2.963 5.656 1.00 1.16 N ATOM 1397 CA LEU A 202 3.769 -1.733 6.386 1.00 1.12 C ATOM 1398 C LEU A 202 4.830 -1.831 7.448 1.00 1.18 C ATOM 1399 O LEU A 202 4.865 -2.787 8.220 1.00 1.36 O ATOM 1400 CB LEU A 202 2.394 -1.492 7.022 1.00 1.37 C ATOM 1401 CG LEU A 202 2.433 -0.772 8.358 1.00 2.56 C ATOM 1402 CD1 LEU A 202 2.746 0.677 8.114 1.00 3.06 C ATOM 1403 CD2 LEU A 202 1.119 -0.949 9.087 1.00 3.24 C ATOM 0 H LEU A 202 3.297 -3.733 6.136 1.00 1.16 H new ATOM 0 HA LEU A 202 3.982 -0.896 5.721 1.00 1.12 H new ATOM 0 HB2 LEU A 202 1.784 -0.912 6.329 1.00 1.37 H new ATOM 0 HB3 LEU A 202 1.897 -2.453 7.156 1.00 1.37 H new ATOM 0 HG LEU A 202 3.211 -1.195 8.994 1.00 2.56 H new ATOM 0 HD11 LEU A 202 2.777 1.208 9.066 1.00 3.06 H new ATOM 0 HD12 LEU A 202 3.713 0.762 7.619 1.00 3.06 H new ATOM 0 HD13 LEU A 202 1.975 1.114 7.480 1.00 3.06 H new ATOM 0 HD21 LEU A 202 1.160 -0.428 10.043 1.00 3.24 H new ATOM 0 HD22 LEU A 202 0.310 -0.537 8.484 1.00 3.24 H new ATOM 0 HD23 LEU A 202 0.939 -2.010 9.260 1.00 3.24 H new ATOM 1415 N VAL A 203 5.693 -0.848 7.479 1.00 1.19 N ATOM 1416 CA VAL A 203 6.795 -0.849 8.394 1.00 1.44 C ATOM 1417 C VAL A 203 6.981 0.564 8.859 1.00 1.43 C ATOM 1418 O VAL A 203 6.702 1.490 8.092 1.00 2.00 O ATOM 1419 CB VAL A 203 8.120 -1.276 7.747 1.00 1.69 C ATOM 1420 CG1 VAL A 203 9.089 -1.802 8.796 1.00 2.05 C ATOM 1421 CG2 VAL A 203 7.920 -2.294 6.633 1.00 2.01 C ATOM 0 H VAL A 203 5.648 -0.030 6.872 1.00 1.19 H new ATOM 0 HA VAL A 203 6.564 -1.556 9.191 1.00 1.44 H new ATOM 0 HB VAL A 203 8.552 -0.386 7.289 1.00 1.69 H new ATOM 0 HG11 VAL A 203 10.021 -2.099 8.314 1.00 2.05 H new ATOM 0 HG12 VAL A 203 9.292 -1.021 9.528 1.00 2.05 H new ATOM 0 HG13 VAL A 203 8.649 -2.664 9.298 1.00 2.05 H new ATOM 0 HG21 VAL A 203 8.887 -2.563 6.208 1.00 2.01 H new ATOM 0 HG22 VAL A 203 7.440 -3.186 7.037 1.00 2.01 H new ATOM 0 HG23 VAL A 203 7.289 -1.863 5.855 1.00 2.01 H new ATOM 1431 N GLU A 204 7.461 0.752 10.068 1.00 1.46 N ATOM 1432 CA GLU A 204 7.625 2.090 10.570 1.00 1.75 C ATOM 1433 C GLU A 204 8.302 2.077 11.935 1.00 2.25 C ATOM 1434 O GLU A 204 7.592 2.141 12.961 1.00 2.80 O ATOM 1435 CB GLU A 204 6.256 2.741 10.634 1.00 2.00 C ATOM 1436 CG GLU A 204 6.302 4.257 10.750 1.00 2.67 C ATOM 1437 CD GLU A 204 5.045 4.835 11.366 1.00 3.03 C ATOM 1438 OE1 GLU A 204 5.153 5.522 12.407 1.00 3.44 O ATOM 1439 OE2 GLU A 204 3.943 4.591 10.832 1.00 3.27 O ATOM 1440 OXT GLU A 204 9.544 1.984 11.978 1.00 2.67 O ATOM 0 H GLU A 204 7.739 0.008 10.708 1.00 1.46 H new ATOM 0 HA GLU A 204 8.270 2.665 9.906 1.00 1.75 H new ATOM 0 HB2 GLU A 204 5.694 2.471 9.740 1.00 2.00 H new ATOM 0 HB3 GLU A 204 5.711 2.337 11.487 1.00 2.00 H new ATOM 0 HG2 GLU A 204 7.163 4.545 11.353 1.00 2.67 H new ATOM 0 HG3 GLU A 204 6.448 4.689 9.760 1.00 2.67 H new TER 1447 GLU A 204