USER MOD reduce.3.24.130724 H: found=0, std=0, add=1489, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1489 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 169 THR OG1 : rot 180:sc= -0.364 USER MOD Set 1.2: A 172 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 126 CYS SG : rot -63:sc= -0.0885! USER MOD Set 2.2: A 127 THR OG1 : rot -160:sc= -2.7! USER MOD Set 3.1: A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 186 THR OG1 : rot 57:sc= 0.455 USER MOD Set 4.1: A 77 GLN : amide:sc= -0.0991 X(o=-0.56,f=-0.71) USER MOD Set 4.2: A 115 TYR OH : rot 180:sc= 0 USER MOD Set 4.3: A 119 LYS NZ :NH3+ 169:sc= -0.465 (180deg=-0.628) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 150:sc= -0.166 (180deg=-1.21!) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 7 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 THR OG1 : rot 170:sc= 0.116 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= 0 K(o=0,f=-0.97) USER MOD Single : A 20 MET CE :methyl -140:sc= -0.811 (180deg=-4.48!) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -0.916 K(o=-0.92,f=-0.16!) USER MOD Single : A 32 GLN : amide:sc= -3.87! C(o=-3.9!,f=-4.2!) USER MOD Single : A 38 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 52 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 153:sc= -0.125 (180deg=-0.79) USER MOD Single : A 60 SER OG : rot -66:sc= 0.471 USER MOD Single : A 62 CYS SG : rot 118:sc= 0.0672 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot -75:sc= 0.708 USER MOD Single : A 73 ASN : amide:sc= -1.67 K(o=-1.7,f=-6.1!) USER MOD Single : A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 40:sc= -2.49! USER MOD Single : A 99 MET CE :methyl 172:sc= -0.0714 (180deg=-0.299) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= -0.0129 X(o=-0.013,f=-0.013) USER MOD Single : A 106 ASN : amide:sc= -0.0535 K(o=-0.054,f=-0.71) USER MOD Single : A 118 SER OG : rot 170:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 156:sc= -0.115 (180deg=-0.638) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 THR OG1 : rot 77:sc= 0.524 USER MOD Single : A 137 MET CE :methyl -140:sc=-0.00888 (180deg=-1.47!) USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 153 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 155 GLN : amide:sc= -0.434 X(o=-0.43,f=-0.13) USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD Single : A 164 TYR OH : rot 180:sc= 0 USER MOD Single : A 167 THR OG1 : rot -34:sc= -0.181! USER MOD Single : A 171 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 174 THR OG1 : rot -90:sc= 0.744 USER MOD Single : A 182 THR OG1 : rot -10:sc= 0.276 USER MOD Single : A 184 SER OG : rot 120:sc= -0.458 USER MOD Single : A 189 LYS NZ :NH3+ -158:sc= 0.644 (180deg=0.534) USER MOD Single : A 190 LYS NZ :NH3+ 159:sc= -0.0732 (180deg=-0.621) USER MOD Single : A 191 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 31.057 -5.086 -13.089 1.00 17.15 N ATOM 2 CA MET A 1 31.458 -4.165 -11.988 1.00 16.73 C ATOM 3 C MET A 1 32.498 -3.171 -12.509 1.00 16.39 C ATOM 4 O MET A 1 33.246 -2.586 -11.751 1.00 16.40 O ATOM 5 CB MET A 1 32.061 -4.976 -10.837 1.00 16.98 C ATOM 6 CG MET A 1 31.069 -6.054 -10.389 1.00 17.51 C ATOM 7 SD MET A 1 31.080 -7.416 -11.580 1.00 17.69 S ATOM 8 CE MET A 1 29.461 -8.104 -11.154 1.00 17.86 C ATOM 0 H1 MET A 1 30.791 -6.009 -12.690 1.00 17.15 H new ATOM 0 H2 MET A 1 30.246 -4.683 -13.600 1.00 17.15 H new ATOM 0 H3 MET A 1 31.854 -5.209 -13.746 1.00 17.15 H new ATOM 0 HA MET A 1 30.582 -3.623 -11.631 1.00 16.73 H new ATOM 0 HB2 MET A 1 32.995 -5.438 -11.156 1.00 16.98 H new ATOM 0 HB3 MET A 1 32.299 -4.318 -10.001 1.00 16.98 H new ATOM 0 HG2 MET A 1 31.337 -6.421 -9.398 1.00 17.51 H new ATOM 0 HG3 MET A 1 30.067 -5.632 -10.312 1.00 17.51 H new ATOM 0 HE1 MET A 1 29.258 -8.972 -11.781 1.00 17.86 H new ATOM 0 HE2 MET A 1 29.457 -8.404 -10.106 1.00 17.86 H new ATOM 0 HE3 MET A 1 28.691 -7.350 -11.318 1.00 17.86 H new ATOM 20 N ASP A 2 32.551 -2.974 -13.798 1.00 16.24 N ATOM 21 CA ASP A 2 33.542 -2.018 -14.367 1.00 16.07 C ATOM 22 C ASP A 2 33.130 -0.586 -14.017 1.00 15.50 C ATOM 23 O ASP A 2 33.871 0.149 -13.396 1.00 15.56 O ATOM 24 CB ASP A 2 33.590 -2.178 -15.888 1.00 16.42 C ATOM 25 CG ASP A 2 34.676 -1.267 -16.463 1.00 16.67 C ATOM 26 OD1 ASP A 2 34.479 -0.063 -16.453 1.00 16.88 O ATOM 27 OD2 ASP A 2 35.687 -1.789 -16.905 1.00 16.77 O ATOM 0 H ASP A 2 31.950 -3.434 -14.482 1.00 16.24 H new ATOM 0 HA ASP A 2 34.527 -2.225 -13.949 1.00 16.07 H new ATOM 0 HB2 ASP A 2 33.796 -3.216 -16.149 1.00 16.42 H new ATOM 0 HB3 ASP A 2 32.622 -1.926 -16.322 1.00 16.42 H new ATOM 32 N GLY A 3 31.952 -0.185 -14.411 1.00 15.11 N ATOM 33 CA GLY A 3 31.494 1.199 -14.102 1.00 14.72 C ATOM 34 C GLY A 3 31.403 1.382 -12.586 1.00 14.60 C ATOM 35 O GLY A 3 32.009 2.271 -12.022 1.00 14.88 O ATOM 0 H GLY A 3 31.287 -0.756 -14.933 1.00 15.11 H new ATOM 0 HA2 GLY A 3 32.188 1.926 -14.525 1.00 14.72 H new ATOM 0 HA3 GLY A 3 30.522 1.382 -14.560 1.00 14.72 H new ATOM 39 N SER A 4 30.650 0.550 -11.922 1.00 14.34 N ATOM 40 CA SER A 4 30.521 0.679 -10.443 1.00 14.41 C ATOM 41 C SER A 4 29.910 -0.601 -9.869 1.00 13.79 C ATOM 42 O SER A 4 29.152 -1.287 -10.526 1.00 14.02 O ATOM 43 CB SER A 4 29.619 1.868 -10.112 1.00 14.82 C ATOM 44 OG SER A 4 29.548 2.025 -8.701 1.00 14.88 O ATOM 0 H SER A 4 30.118 -0.214 -12.339 1.00 14.34 H new ATOM 0 HA SER A 4 31.507 0.838 -10.005 1.00 14.41 H new ATOM 0 HB2 SER A 4 30.011 2.776 -10.571 1.00 14.82 H new ATOM 0 HB3 SER A 4 28.622 1.708 -10.522 1.00 14.82 H new ATOM 0 HG SER A 4 28.972 2.788 -8.485 1.00 14.88 H new ATOM 50 N GLY A 5 30.236 -0.929 -8.649 1.00 13.15 N ATOM 51 CA GLY A 5 29.676 -2.166 -8.033 1.00 12.67 C ATOM 52 C GLY A 5 28.195 -1.960 -7.719 1.00 12.31 C ATOM 53 O GLY A 5 27.332 -2.290 -8.507 1.00 12.37 O ATOM 0 H GLY A 5 30.866 -0.394 -8.052 1.00 13.15 H new ATOM 0 HA2 GLY A 5 29.800 -3.010 -8.712 1.00 12.67 H new ATOM 0 HA3 GLY A 5 30.221 -2.408 -7.121 1.00 12.67 H new ATOM 57 N GLU A 6 27.893 -1.419 -6.570 1.00 12.14 N ATOM 58 CA GLU A 6 26.468 -1.195 -6.202 1.00 12.01 C ATOM 59 C GLU A 6 25.729 -2.536 -6.208 1.00 11.53 C ATOM 60 O GLU A 6 25.487 -3.114 -7.249 1.00 11.57 O ATOM 61 CB GLU A 6 25.825 -0.239 -7.219 1.00 12.39 C ATOM 62 CG GLU A 6 24.564 0.386 -6.618 1.00 12.94 C ATOM 63 CD GLU A 6 23.896 1.289 -7.658 1.00 13.31 C ATOM 64 OE1 GLU A 6 23.600 0.799 -8.736 1.00 13.50 O ATOM 65 OE2 GLU A 6 23.692 2.454 -7.359 1.00 13.55 O ATOM 0 H GLU A 6 28.573 -1.123 -5.870 1.00 12.14 H new ATOM 0 HA GLU A 6 26.407 -0.754 -5.207 1.00 12.01 H new ATOM 0 HB2 GLU A 6 26.533 0.542 -7.495 1.00 12.39 H new ATOM 0 HB3 GLU A 6 25.574 -0.779 -8.132 1.00 12.39 H new ATOM 0 HG2 GLU A 6 23.873 -0.396 -6.302 1.00 12.94 H new ATOM 0 HG3 GLU A 6 24.820 0.964 -5.730 1.00 12.94 H new ATOM 72 N GLN A 7 25.370 -3.039 -5.051 1.00 11.25 N ATOM 73 CA GLN A 7 24.647 -4.350 -4.986 1.00 10.97 C ATOM 74 C GLN A 7 23.590 -4.291 -3.859 1.00 10.29 C ATOM 75 O GLN A 7 23.771 -3.562 -2.904 1.00 10.41 O ATOM 76 CB GLN A 7 25.663 -5.465 -4.684 1.00 11.52 C ATOM 77 CG GLN A 7 26.338 -5.920 -5.982 1.00 12.08 C ATOM 78 CD GLN A 7 27.335 -7.039 -5.674 1.00 12.56 C ATOM 79 OE1 GLN A 7 28.242 -6.860 -4.886 1.00 12.91 O ATOM 80 NE2 GLN A 7 27.203 -8.195 -6.265 1.00 12.77 N ATOM 0 H GLN A 7 25.546 -2.598 -4.148 1.00 11.25 H new ATOM 0 HA GLN A 7 24.152 -4.553 -5.936 1.00 10.97 H new ATOM 0 HB2 GLN A 7 26.413 -5.105 -3.980 1.00 11.52 H new ATOM 0 HB3 GLN A 7 25.161 -6.308 -4.210 1.00 11.52 H new ATOM 0 HG2 GLN A 7 25.588 -6.272 -6.690 1.00 12.08 H new ATOM 0 HG3 GLN A 7 26.851 -5.080 -6.451 1.00 12.08 H new ATOM 0 HE21 GLN A 7 26.441 -8.345 -6.927 1.00 12.77 H new ATOM 0 HE22 GLN A 7 27.861 -8.948 -6.065 1.00 12.77 H new ATOM 89 N PRO A 8 22.516 -5.060 -3.983 1.00 9.81 N ATOM 90 CA PRO A 8 21.457 -5.077 -2.950 1.00 9.37 C ATOM 91 C PRO A 8 22.031 -5.528 -1.597 1.00 9.09 C ATOM 92 O PRO A 8 21.915 -4.842 -0.604 1.00 9.07 O ATOM 93 CB PRO A 8 20.408 -6.091 -3.470 1.00 9.20 C ATOM 94 CG PRO A 8 20.961 -6.703 -4.788 1.00 9.57 C ATOM 95 CD PRO A 8 22.264 -5.955 -5.137 1.00 9.93 C ATOM 0 HA PRO A 8 21.023 -4.090 -2.788 1.00 9.37 H new ATOM 0 HB2 PRO A 8 20.230 -6.872 -2.730 1.00 9.20 H new ATOM 0 HB3 PRO A 8 19.453 -5.597 -3.648 1.00 9.20 H new ATOM 0 HG2 PRO A 8 21.152 -7.769 -4.665 1.00 9.57 H new ATOM 0 HG3 PRO A 8 20.233 -6.601 -5.593 1.00 9.57 H new ATOM 0 HD2 PRO A 8 23.090 -6.650 -5.284 1.00 9.93 H new ATOM 0 HD3 PRO A 8 22.157 -5.387 -6.061 1.00 9.93 H new ATOM 103 N ARG A 9 22.631 -6.685 -1.555 1.00 9.13 N ATOM 104 CA ARG A 9 23.197 -7.193 -0.271 1.00 9.14 C ATOM 105 C ARG A 9 24.525 -6.491 0.018 1.00 8.60 C ATOM 106 O ARG A 9 25.382 -6.386 -0.837 1.00 8.68 O ATOM 107 CB ARG A 9 23.429 -8.703 -0.402 1.00 10.09 C ATOM 108 CG ARG A 9 22.078 -9.444 -0.454 1.00 10.67 C ATOM 109 CD ARG A 9 21.527 -9.675 0.969 1.00 11.51 C ATOM 110 NE ARG A 9 20.040 -9.564 0.939 1.00 12.05 N ATOM 111 CZ ARG A 9 19.331 -9.982 1.952 1.00 12.65 C ATOM 112 NH1 ARG A 9 19.924 -10.487 3.000 1.00 12.79 N ATOM 113 NH2 ARG A 9 18.030 -9.891 1.919 1.00 13.27 N ATOM 0 H ARG A 9 22.755 -7.304 -2.357 1.00 9.13 H new ATOM 0 HA ARG A 9 22.505 -6.993 0.547 1.00 9.14 H new ATOM 0 HB2 ARG A 9 24.003 -8.914 -1.304 1.00 10.09 H new ATOM 0 HB3 ARG A 9 24.018 -9.063 0.442 1.00 10.09 H new ATOM 0 HG2 ARG A 9 21.362 -8.865 -1.037 1.00 10.67 H new ATOM 0 HG3 ARG A 9 22.202 -10.401 -0.961 1.00 10.67 H new ATOM 0 HD2 ARG A 9 21.824 -10.659 1.332 1.00 11.51 H new ATOM 0 HD3 ARG A 9 21.945 -8.941 1.658 1.00 11.51 H new ATOM 0 HE ARG A 9 19.576 -9.161 0.125 1.00 12.05 H new ATOM 0 HH11 ARG A 9 20.941 -10.555 3.027 1.00 12.79 H new ATOM 0 HH12 ARG A 9 19.370 -10.814 3.792 1.00 12.79 H new ATOM 0 HH21 ARG A 9 17.567 -9.493 1.102 1.00 13.27 H new ATOM 0 HH22 ARG A 9 17.476 -10.218 2.710 1.00 13.27 H new ATOM 127 N GLY A 10 24.704 -6.009 1.217 1.00 8.29 N ATOM 128 CA GLY A 10 25.976 -5.314 1.557 1.00 8.00 C ATOM 129 C GLY A 10 25.945 -4.871 3.020 1.00 7.45 C ATOM 130 O GLY A 10 26.751 -5.270 3.835 1.00 7.68 O ATOM 0 H GLY A 10 24.024 -6.067 1.975 1.00 8.29 H new ATOM 0 HA2 GLY A 10 26.822 -5.979 1.386 1.00 8.00 H new ATOM 0 HA3 GLY A 10 26.114 -4.449 0.908 1.00 8.00 H new ATOM 134 N GLY A 11 25.010 -4.012 3.331 1.00 7.01 N ATOM 135 CA GLY A 11 24.876 -3.471 4.713 1.00 6.74 C ATOM 136 C GLY A 11 24.241 -2.083 4.611 1.00 5.83 C ATOM 137 O GLY A 11 24.911 -1.099 4.370 1.00 6.06 O ATOM 0 H GLY A 11 24.320 -3.656 2.670 1.00 7.01 H new ATOM 0 HA2 GLY A 11 24.258 -4.130 5.323 1.00 6.74 H new ATOM 0 HA3 GLY A 11 25.851 -3.411 5.196 1.00 6.74 H new ATOM 141 N GLY A 12 22.940 -2.008 4.747 1.00 5.12 N ATOM 142 CA GLY A 12 22.235 -0.699 4.604 1.00 4.52 C ATOM 143 C GLY A 12 22.793 0.065 3.387 1.00 3.52 C ATOM 144 O GLY A 12 23.257 1.179 3.536 1.00 3.54 O ATOM 0 H GLY A 12 22.334 -2.802 4.952 1.00 5.12 H new ATOM 0 HA2 GLY A 12 21.164 -0.864 4.482 1.00 4.52 H new ATOM 0 HA3 GLY A 12 22.365 -0.105 5.509 1.00 4.52 H new ATOM 148 N PRO A 13 22.750 -0.547 2.214 1.00 3.15 N ATOM 149 CA PRO A 13 23.277 0.100 0.993 1.00 2.77 C ATOM 150 C PRO A 13 22.400 1.295 0.599 1.00 2.05 C ATOM 151 O PRO A 13 22.880 2.353 0.242 1.00 2.37 O ATOM 152 CB PRO A 13 23.196 -0.998 -0.099 1.00 3.47 C ATOM 153 CG PRO A 13 22.453 -2.217 0.514 1.00 3.99 C ATOM 154 CD PRO A 13 22.191 -1.905 2.003 1.00 3.79 C ATOM 0 HA PRO A 13 24.290 0.478 1.133 1.00 2.77 H new ATOM 0 HB2 PRO A 13 22.665 -0.627 -0.976 1.00 3.47 H new ATOM 0 HB3 PRO A 13 24.195 -1.285 -0.429 1.00 3.47 H new ATOM 0 HG2 PRO A 13 21.514 -2.396 -0.010 1.00 3.99 H new ATOM 0 HG3 PRO A 13 23.053 -3.121 0.412 1.00 3.99 H new ATOM 0 HD2 PRO A 13 21.125 -1.933 2.231 1.00 3.79 H new ATOM 0 HD3 PRO A 13 22.675 -2.636 2.651 1.00 3.79 H new ATOM 162 N THR A 14 21.110 1.092 0.615 1.00 1.59 N ATOM 163 CA THR A 14 20.159 2.159 0.194 1.00 1.24 C ATOM 164 C THR A 14 19.947 3.213 1.295 1.00 1.07 C ATOM 165 O THR A 14 19.747 2.913 2.456 1.00 1.20 O ATOM 166 CB THR A 14 18.804 1.503 -0.161 1.00 1.43 C ATOM 167 OG1 THR A 14 18.651 0.317 0.606 1.00 2.16 O ATOM 168 CG2 THR A 14 18.751 1.145 -1.652 1.00 1.78 C ATOM 0 H THR A 14 20.670 0.219 0.906 1.00 1.59 H new ATOM 0 HA THR A 14 20.581 2.671 -0.670 1.00 1.24 H new ATOM 0 HB THR A 14 18.002 2.207 0.060 1.00 1.43 H new ATOM 0 HG1 THR A 14 17.735 -0.018 0.511 1.00 2.16 H new ATOM 0 HG21 THR A 14 17.790 0.685 -1.882 1.00 1.78 H new ATOM 0 HG22 THR A 14 18.872 2.050 -2.248 1.00 1.78 H new ATOM 0 HG23 THR A 14 19.554 0.446 -1.887 1.00 1.78 H new ATOM 176 N SER A 15 19.949 4.449 0.880 1.00 1.07 N ATOM 177 CA SER A 15 19.706 5.604 1.792 1.00 0.91 C ATOM 178 C SER A 15 18.250 5.566 2.282 1.00 0.75 C ATOM 179 O SER A 15 17.326 5.401 1.510 1.00 0.78 O ATOM 180 CB SER A 15 19.946 6.885 0.982 1.00 0.99 C ATOM 181 OG SER A 15 21.327 7.212 1.075 1.00 1.38 O ATOM 0 H SER A 15 20.115 4.716 -0.090 1.00 1.07 H new ATOM 0 HA SER A 15 20.368 5.566 2.657 1.00 0.91 H new ATOM 0 HB2 SER A 15 19.659 6.737 -0.059 1.00 0.99 H new ATOM 0 HB3 SER A 15 19.335 7.700 1.368 1.00 0.99 H new ATOM 0 HG SER A 15 21.505 8.028 0.563 1.00 1.38 H new ATOM 187 N SER A 16 18.051 5.703 3.566 1.00 0.72 N ATOM 188 CA SER A 16 16.668 5.663 4.129 1.00 0.82 C ATOM 189 C SER A 16 15.841 6.850 3.619 1.00 0.81 C ATOM 190 O SER A 16 14.637 6.758 3.481 1.00 0.92 O ATOM 191 CB SER A 16 16.744 5.731 5.656 1.00 1.06 C ATOM 192 OG SER A 16 17.241 7.005 6.045 1.00 1.64 O ATOM 0 H SER A 16 18.791 5.842 4.254 1.00 0.72 H new ATOM 0 HA SER A 16 16.189 4.736 3.813 1.00 0.82 H new ATOM 0 HB2 SER A 16 15.757 5.565 6.089 1.00 1.06 H new ATOM 0 HB3 SER A 16 17.395 4.943 6.035 1.00 1.06 H new ATOM 0 HG SER A 16 17.289 7.053 7.023 1.00 1.64 H new ATOM 198 N GLU A 17 16.465 7.963 3.342 1.00 0.80 N ATOM 199 CA GLU A 17 15.693 9.145 2.851 1.00 0.94 C ATOM 200 C GLU A 17 15.300 8.941 1.384 1.00 0.85 C ATOM 201 O GLU A 17 14.216 9.301 0.970 1.00 0.89 O ATOM 202 CB GLU A 17 16.555 10.405 2.985 1.00 1.13 C ATOM 203 CG GLU A 17 15.715 11.649 2.681 1.00 1.71 C ATOM 204 CD GLU A 17 14.702 11.871 3.805 1.00 2.26 C ATOM 205 OE1 GLU A 17 15.075 11.697 4.954 1.00 2.90 O ATOM 206 OE2 GLU A 17 13.572 12.212 3.498 1.00 2.68 O ATOM 0 H GLU A 17 17.471 8.107 3.433 1.00 0.80 H new ATOM 0 HA GLU A 17 14.787 9.257 3.447 1.00 0.94 H new ATOM 0 HB2 GLU A 17 16.964 10.470 3.993 1.00 1.13 H new ATOM 0 HB3 GLU A 17 17.401 10.351 2.300 1.00 1.13 H new ATOM 0 HG2 GLU A 17 16.361 12.521 2.582 1.00 1.71 H new ATOM 0 HG3 GLU A 17 15.197 11.527 1.730 1.00 1.71 H new ATOM 213 N GLN A 18 16.156 8.351 0.599 1.00 0.80 N ATOM 214 CA GLN A 18 15.804 8.116 -0.829 1.00 0.83 C ATOM 215 C GLN A 18 14.754 7.010 -0.900 1.00 0.68 C ATOM 216 O GLN A 18 13.911 7.001 -1.775 1.00 0.69 O ATOM 217 CB GLN A 18 17.054 7.694 -1.616 1.00 0.96 C ATOM 218 CG GLN A 18 17.793 8.937 -2.119 1.00 1.53 C ATOM 219 CD GLN A 18 19.143 8.528 -2.712 1.00 2.23 C ATOM 220 OE1 GLN A 18 19.340 7.384 -3.071 1.00 2.69 O ATOM 221 NE2 GLN A 18 20.086 9.422 -2.830 1.00 3.07 N ATOM 0 H GLN A 18 17.079 8.023 0.882 1.00 0.80 H new ATOM 0 HA GLN A 18 15.409 9.033 -1.265 1.00 0.83 H new ATOM 0 HB2 GLN A 18 17.712 7.100 -0.981 1.00 0.96 H new ATOM 0 HB3 GLN A 18 16.769 7.063 -2.458 1.00 0.96 H new ATOM 0 HG2 GLN A 18 17.194 9.449 -2.872 1.00 1.53 H new ATOM 0 HG3 GLN A 18 17.943 9.640 -1.299 1.00 1.53 H new ATOM 0 HE21 GLN A 18 19.919 10.382 -2.528 1.00 3.07 H new ATOM 0 HE22 GLN A 18 20.990 9.161 -3.224 1.00 3.07 H new ATOM 230 N ILE A 19 14.786 6.081 0.012 1.00 0.59 N ATOM 231 CA ILE A 19 13.772 5.000 -0.029 1.00 0.58 C ATOM 232 C ILE A 19 12.389 5.658 0.099 1.00 0.52 C ATOM 233 O ILE A 19 11.499 5.400 -0.686 1.00 0.59 O ATOM 234 CB ILE A 19 14.044 3.983 1.101 1.00 0.64 C ATOM 235 CG1 ILE A 19 15.085 2.957 0.639 1.00 0.74 C ATOM 236 CG2 ILE A 19 12.759 3.252 1.512 1.00 0.73 C ATOM 237 CD1 ILE A 19 15.628 2.196 1.854 1.00 0.81 C ATOM 0 H ILE A 19 15.462 6.025 0.774 1.00 0.59 H new ATOM 0 HA ILE A 19 13.816 4.445 -0.966 1.00 0.58 H new ATOM 0 HB ILE A 19 14.421 4.532 1.964 1.00 0.64 H new ATOM 0 HG12 ILE A 19 14.635 2.260 -0.068 1.00 0.74 H new ATOM 0 HG13 ILE A 19 15.900 3.459 0.117 1.00 0.74 H new ATOM 0 HG21 ILE A 19 12.983 2.543 2.309 1.00 0.73 H new ATOM 0 HG22 ILE A 19 12.026 3.976 1.866 1.00 0.73 H new ATOM 0 HG23 ILE A 19 12.354 2.717 0.653 1.00 0.73 H new ATOM 0 HD11 ILE A 19 16.368 1.466 1.525 1.00 0.81 H new ATOM 0 HD12 ILE A 19 16.093 2.899 2.545 1.00 0.81 H new ATOM 0 HD13 ILE A 19 14.809 1.681 2.356 1.00 0.81 H new ATOM 249 N MET A 20 12.191 6.480 1.092 1.00 0.51 N ATOM 250 CA MET A 20 10.841 7.098 1.242 1.00 0.60 C ATOM 251 C MET A 20 10.503 7.894 -0.029 1.00 0.55 C ATOM 252 O MET A 20 9.352 8.011 -0.401 1.00 0.59 O ATOM 253 CB MET A 20 10.766 7.994 2.477 1.00 0.82 C ATOM 254 CG MET A 20 10.868 7.156 3.758 1.00 1.07 C ATOM 255 SD MET A 20 10.043 8.034 5.111 1.00 1.43 S ATOM 256 CE MET A 20 8.326 7.703 4.623 1.00 0.93 C ATOM 0 H MET A 20 12.885 6.747 1.791 1.00 0.51 H new ATOM 0 HA MET A 20 10.108 6.303 1.379 1.00 0.60 H new ATOM 0 HB2 MET A 20 11.572 8.727 2.450 1.00 0.82 H new ATOM 0 HB3 MET A 20 9.829 8.550 2.473 1.00 0.82 H new ATOM 0 HG2 MET A 20 10.406 6.180 3.606 1.00 1.07 H new ATOM 0 HG3 MET A 20 11.914 6.978 4.008 1.00 1.07 H new ATOM 0 HE1 MET A 20 7.722 8.595 4.788 1.00 0.93 H new ATOM 0 HE2 MET A 20 8.293 7.433 3.568 1.00 0.93 H new ATOM 0 HE3 MET A 20 7.930 6.882 5.220 1.00 0.93 H new ATOM 266 N LYS A 21 11.483 8.392 -0.729 1.00 0.57 N ATOM 267 CA LYS A 21 11.191 9.118 -2.000 1.00 0.61 C ATOM 268 C LYS A 21 10.689 8.108 -3.040 1.00 0.53 C ATOM 269 O LYS A 21 9.788 8.391 -3.807 1.00 0.51 O ATOM 270 CB LYS A 21 12.462 9.808 -2.516 1.00 0.72 C ATOM 271 CG LYS A 21 12.090 10.891 -3.544 1.00 1.09 C ATOM 272 CD LYS A 21 13.344 11.686 -3.963 1.00 1.24 C ATOM 273 CE LYS A 21 13.583 12.850 -2.992 1.00 1.80 C ATOM 274 NZ LYS A 21 14.942 13.417 -3.223 1.00 2.40 N ATOM 0 H LYS A 21 12.470 8.329 -0.479 1.00 0.57 H new ATOM 0 HA LYS A 21 10.430 9.878 -1.823 1.00 0.61 H new ATOM 0 HB2 LYS A 21 13.006 10.255 -1.684 1.00 0.72 H new ATOM 0 HB3 LYS A 21 13.125 9.073 -2.973 1.00 0.72 H new ATOM 0 HG2 LYS A 21 11.635 10.429 -4.420 1.00 1.09 H new ATOM 0 HG3 LYS A 21 11.348 11.567 -3.118 1.00 1.09 H new ATOM 0 HD2 LYS A 21 14.213 11.028 -3.975 1.00 1.24 H new ATOM 0 HD3 LYS A 21 13.220 12.068 -4.976 1.00 1.24 H new ATOM 0 HE2 LYS A 21 12.826 13.621 -3.138 1.00 1.80 H new ATOM 0 HE3 LYS A 21 13.492 12.504 -1.962 1.00 1.80 H new ATOM 0 HZ1 LYS A 21 15.105 14.206 -2.565 1.00 2.40 H new ATOM 0 HZ2 LYS A 21 15.658 12.679 -3.063 1.00 2.40 H new ATOM 0 HZ3 LYS A 21 15.013 13.762 -4.202 1.00 2.40 H new ATOM 288 N THR A 22 11.244 6.927 -3.069 1.00 0.53 N ATOM 289 CA THR A 22 10.777 5.906 -4.054 1.00 0.52 C ATOM 290 C THR A 22 9.360 5.446 -3.702 1.00 0.45 C ATOM 291 O THR A 22 8.496 5.349 -4.550 1.00 0.48 O ATOM 292 CB THR A 22 11.711 4.696 -3.998 1.00 0.55 C ATOM 293 OG1 THR A 22 13.053 5.128 -4.177 1.00 0.64 O ATOM 294 CG2 THR A 22 11.336 3.712 -5.109 1.00 0.62 C ATOM 0 H THR A 22 12.000 6.624 -2.455 1.00 0.53 H new ATOM 0 HA THR A 22 10.780 6.345 -5.051 1.00 0.52 H new ATOM 0 HB THR A 22 11.614 4.203 -3.030 1.00 0.55 H new ATOM 0 HG1 THR A 22 13.653 4.354 -4.140 1.00 0.64 H new ATOM 0 HG21 THR A 22 12.001 2.849 -5.070 1.00 0.62 H new ATOM 0 HG22 THR A 22 10.306 3.383 -4.971 1.00 0.62 H new ATOM 0 HG23 THR A 22 11.434 4.202 -6.078 1.00 0.62 H new ATOM 302 N GLY A 23 9.119 5.159 -2.451 1.00 0.42 N ATOM 303 CA GLY A 23 7.764 4.699 -2.028 1.00 0.43 C ATOM 304 C GLY A 23 6.727 5.775 -2.347 1.00 0.41 C ATOM 305 O GLY A 23 5.707 5.500 -2.954 1.00 0.47 O ATOM 0 H GLY A 23 9.806 5.224 -1.700 1.00 0.42 H new ATOM 0 HA2 GLY A 23 7.509 3.772 -2.541 1.00 0.43 H new ATOM 0 HA3 GLY A 23 7.761 4.484 -0.960 1.00 0.43 H new ATOM 309 N ALA A 24 6.973 6.998 -1.973 1.00 0.40 N ATOM 310 CA ALA A 24 5.999 8.077 -2.292 1.00 0.41 C ATOM 311 C ALA A 24 5.745 8.090 -3.797 1.00 0.41 C ATOM 312 O ALA A 24 4.717 8.526 -4.269 1.00 0.41 O ATOM 313 CB ALA A 24 6.605 9.427 -1.903 1.00 0.42 C ATOM 0 H ALA A 24 7.804 7.297 -1.462 1.00 0.40 H new ATOM 0 HA ALA A 24 5.070 7.903 -1.749 1.00 0.41 H new ATOM 0 HB1 ALA A 24 5.897 10.223 -2.134 1.00 0.42 H new ATOM 0 HB2 ALA A 24 6.823 9.434 -0.835 1.00 0.42 H new ATOM 0 HB3 ALA A 24 7.526 9.587 -2.463 1.00 0.42 H new ATOM 319 N LEU A 25 6.702 7.611 -4.550 1.00 0.42 N ATOM 320 CA LEU A 25 6.558 7.588 -6.033 1.00 0.44 C ATOM 321 C LEU A 25 5.620 6.441 -6.430 1.00 0.44 C ATOM 322 O LEU A 25 4.738 6.607 -7.248 1.00 0.46 O ATOM 323 CB LEU A 25 7.957 7.412 -6.678 1.00 0.47 C ATOM 324 CG LEU A 25 8.264 8.569 -7.644 1.00 0.77 C ATOM 325 CD1 LEU A 25 9.751 8.550 -8.006 1.00 1.58 C ATOM 326 CD2 LEU A 25 7.425 8.407 -8.916 1.00 1.67 C ATOM 0 H LEU A 25 7.581 7.233 -4.197 1.00 0.42 H new ATOM 0 HA LEU A 25 6.129 8.525 -6.388 1.00 0.44 H new ATOM 0 HB2 LEU A 25 8.719 7.371 -5.899 1.00 0.47 H new ATOM 0 HB3 LEU A 25 7.998 6.464 -7.214 1.00 0.47 H new ATOM 0 HG LEU A 25 8.019 9.518 -7.166 1.00 0.77 H new ATOM 0 HD11 LEU A 25 9.969 9.370 -8.691 1.00 1.58 H new ATOM 0 HD12 LEU A 25 10.347 8.665 -7.101 1.00 1.58 H new ATOM 0 HD13 LEU A 25 9.997 7.602 -8.485 1.00 1.58 H new ATOM 0 HD21 LEU A 25 7.642 9.226 -9.602 1.00 1.67 H new ATOM 0 HD22 LEU A 25 7.670 7.459 -9.395 1.00 1.67 H new ATOM 0 HD23 LEU A 25 6.366 8.420 -8.658 1.00 1.67 H new ATOM 338 N LEU A 26 5.832 5.270 -5.893 1.00 0.45 N ATOM 339 CA LEU A 26 4.976 4.112 -6.281 1.00 0.47 C ATOM 340 C LEU A 26 3.498 4.520 -6.233 1.00 0.49 C ATOM 341 O LEU A 26 2.786 4.395 -7.211 1.00 0.52 O ATOM 342 CB LEU A 26 5.233 2.927 -5.329 1.00 0.51 C ATOM 343 CG LEU A 26 6.364 2.037 -5.859 1.00 0.69 C ATOM 344 CD1 LEU A 26 7.687 2.805 -5.839 1.00 1.17 C ATOM 345 CD2 LEU A 26 6.481 0.799 -4.966 1.00 1.35 C ATOM 0 H LEU A 26 6.557 5.065 -5.206 1.00 0.45 H new ATOM 0 HA LEU A 26 5.225 3.806 -7.297 1.00 0.47 H new ATOM 0 HB2 LEU A 26 5.492 3.300 -4.338 1.00 0.51 H new ATOM 0 HB3 LEU A 26 4.322 2.338 -5.220 1.00 0.51 H new ATOM 0 HG LEU A 26 6.142 1.739 -6.884 1.00 0.69 H new ATOM 0 HD11 LEU A 26 8.485 2.166 -6.217 1.00 1.17 H new ATOM 0 HD12 LEU A 26 7.603 3.691 -6.469 1.00 1.17 H new ATOM 0 HD13 LEU A 26 7.917 3.107 -4.817 1.00 1.17 H new ATOM 0 HD21 LEU A 26 7.283 0.159 -5.334 1.00 1.35 H new ATOM 0 HD22 LEU A 26 6.703 1.107 -3.944 1.00 1.35 H new ATOM 0 HD23 LEU A 26 5.541 0.248 -4.983 1.00 1.35 H new ATOM 357 N LEU A 27 3.016 4.981 -5.112 1.00 0.50 N ATOM 358 CA LEU A 27 1.572 5.352 -5.054 1.00 0.56 C ATOM 359 C LEU A 27 1.278 6.395 -6.130 1.00 0.56 C ATOM 360 O LEU A 27 0.340 6.270 -6.892 1.00 0.60 O ATOM 361 CB LEU A 27 1.195 5.925 -3.678 1.00 0.64 C ATOM 362 CG LEU A 27 1.985 5.229 -2.577 1.00 0.95 C ATOM 363 CD1 LEU A 27 1.497 5.735 -1.220 1.00 1.66 C ATOM 364 CD2 LEU A 27 1.768 3.717 -2.668 1.00 1.42 C ATOM 0 H LEU A 27 3.545 5.115 -4.250 1.00 0.50 H new ATOM 0 HA LEU A 27 0.981 4.452 -5.223 1.00 0.56 H new ATOM 0 HB2 LEU A 27 1.395 6.996 -3.656 1.00 0.64 H new ATOM 0 HB3 LEU A 27 0.127 5.797 -3.504 1.00 0.64 H new ATOM 0 HG LEU A 27 3.047 5.446 -2.692 1.00 0.95 H new ATOM 0 HD11 LEU A 27 2.057 5.242 -0.425 1.00 1.66 H new ATOM 0 HD12 LEU A 27 1.650 6.812 -1.157 1.00 1.66 H new ATOM 0 HD13 LEU A 27 0.436 5.512 -1.109 1.00 1.66 H new ATOM 0 HD21 LEU A 27 2.334 3.220 -1.880 1.00 1.42 H new ATOM 0 HD22 LEU A 27 0.708 3.494 -2.550 1.00 1.42 H new ATOM 0 HD23 LEU A 27 2.108 3.358 -3.640 1.00 1.42 H new ATOM 376 N GLN A 28 2.058 7.434 -6.180 1.00 0.55 N ATOM 377 CA GLN A 28 1.811 8.498 -7.185 1.00 0.58 C ATOM 378 C GLN A 28 1.642 7.875 -8.572 1.00 0.54 C ATOM 379 O GLN A 28 0.825 8.294 -9.361 1.00 0.58 O ATOM 380 CB GLN A 28 3.008 9.450 -7.194 1.00 0.60 C ATOM 381 CG GLN A 28 2.963 10.322 -5.936 1.00 1.00 C ATOM 382 CD GLN A 28 4.250 11.141 -5.825 1.00 1.40 C ATOM 383 OE1 GLN A 28 5.065 10.900 -4.957 1.00 2.09 O ATOM 384 NE2 GLN A 28 4.466 12.110 -6.672 1.00 1.91 N ATOM 0 H GLN A 28 2.858 7.592 -5.567 1.00 0.55 H new ATOM 0 HA GLN A 28 0.902 9.042 -6.930 1.00 0.58 H new ATOM 0 HB2 GLN A 28 3.939 8.884 -7.226 1.00 0.60 H new ATOM 0 HB3 GLN A 28 2.985 10.075 -8.086 1.00 0.60 H new ATOM 0 HG2 GLN A 28 2.100 10.987 -5.975 1.00 1.00 H new ATOM 0 HG3 GLN A 28 2.843 9.695 -5.052 1.00 1.00 H new ATOM 0 HE21 GLN A 28 3.782 12.312 -7.401 1.00 1.91 H new ATOM 0 HE22 GLN A 28 5.319 12.665 -6.605 1.00 1.91 H new ATOM 393 N GLY A 29 2.438 6.880 -8.872 1.00 0.50 N ATOM 394 CA GLY A 29 2.365 6.221 -10.209 1.00 0.48 C ATOM 395 C GLY A 29 1.259 5.164 -10.223 1.00 0.44 C ATOM 396 O GLY A 29 0.492 5.076 -11.162 1.00 0.50 O ATOM 0 H GLY A 29 3.141 6.494 -8.242 1.00 0.50 H new ATOM 0 HA2 GLY A 29 2.173 6.968 -10.980 1.00 0.48 H new ATOM 0 HA3 GLY A 29 3.323 5.758 -10.446 1.00 0.48 H new ATOM 400 N PHE A 30 1.166 4.356 -9.202 1.00 0.44 N ATOM 401 CA PHE A 30 0.100 3.311 -9.195 1.00 0.43 C ATOM 402 C PHE A 30 -1.259 3.998 -9.059 1.00 0.40 C ATOM 403 O PHE A 30 -2.216 3.623 -9.708 1.00 0.43 O ATOM 404 CB PHE A 30 0.323 2.330 -8.030 1.00 0.47 C ATOM 405 CG PHE A 30 -0.944 1.537 -7.767 1.00 0.47 C ATOM 406 CD1 PHE A 30 -1.487 0.738 -8.781 1.00 1.20 C ATOM 407 CD2 PHE A 30 -1.578 1.607 -6.518 1.00 1.39 C ATOM 408 CE1 PHE A 30 -2.661 0.011 -8.548 1.00 1.21 C ATOM 409 CE2 PHE A 30 -2.751 0.879 -6.285 1.00 1.42 C ATOM 410 CZ PHE A 30 -3.292 0.081 -7.300 1.00 0.58 C ATOM 0 H PHE A 30 1.773 4.372 -8.382 1.00 0.44 H new ATOM 0 HA PHE A 30 0.133 2.744 -10.126 1.00 0.43 H new ATOM 0 HB2 PHE A 30 1.143 1.652 -8.267 1.00 0.47 H new ATOM 0 HB3 PHE A 30 0.611 2.878 -7.133 1.00 0.47 H new ATOM 0 HD1 PHE A 30 -1.000 0.682 -9.743 1.00 1.20 H new ATOM 0 HD2 PHE A 30 -1.161 2.223 -5.735 1.00 1.39 H new ATOM 0 HE1 PHE A 30 -3.080 -0.604 -9.331 1.00 1.21 H new ATOM 0 HE2 PHE A 30 -3.238 0.933 -5.323 1.00 1.42 H new ATOM 0 HZ PHE A 30 -4.197 -0.481 -7.120 1.00 0.58 H new ATOM 420 N ILE A 31 -1.360 5.003 -8.240 1.00 0.40 N ATOM 421 CA ILE A 31 -2.668 5.692 -8.104 1.00 0.40 C ATOM 422 C ILE A 31 -2.995 6.373 -9.440 1.00 0.40 C ATOM 423 O ILE A 31 -4.082 6.237 -9.965 1.00 0.43 O ATOM 424 CB ILE A 31 -2.599 6.720 -6.970 1.00 0.41 C ATOM 425 CG1 ILE A 31 -2.394 5.992 -5.638 1.00 0.53 C ATOM 426 CG2 ILE A 31 -3.906 7.510 -6.927 1.00 0.72 C ATOM 427 CD1 ILE A 31 -2.090 7.007 -4.533 1.00 0.48 C ATOM 0 H ILE A 31 -0.603 5.374 -7.665 1.00 0.40 H new ATOM 0 HA ILE A 31 -3.453 4.976 -7.860 1.00 0.40 H new ATOM 0 HB ILE A 31 -1.767 7.403 -7.141 1.00 0.41 H new ATOM 0 HG12 ILE A 31 -3.287 5.421 -5.384 1.00 0.53 H new ATOM 0 HG13 ILE A 31 -1.574 5.279 -5.725 1.00 0.53 H new ATOM 0 HG21 ILE A 31 -3.862 8.243 -6.121 1.00 0.72 H new ATOM 0 HG22 ILE A 31 -4.052 8.024 -7.877 1.00 0.72 H new ATOM 0 HG23 ILE A 31 -4.738 6.828 -6.752 1.00 0.72 H new ATOM 0 HD11 ILE A 31 -1.945 6.484 -3.588 1.00 0.48 H new ATOM 0 HD12 ILE A 31 -1.184 7.559 -4.785 1.00 0.48 H new ATOM 0 HD13 ILE A 31 -2.924 7.703 -4.438 1.00 0.48 H new ATOM 439 N GLN A 32 -2.064 7.105 -9.994 1.00 0.42 N ATOM 440 CA GLN A 32 -2.321 7.792 -11.296 1.00 0.47 C ATOM 441 C GLN A 32 -2.755 6.780 -12.368 1.00 0.50 C ATOM 442 O GLN A 32 -3.543 7.094 -13.237 1.00 0.61 O ATOM 443 CB GLN A 32 -1.051 8.515 -11.759 1.00 0.57 C ATOM 444 CG GLN A 32 -1.372 9.453 -12.932 1.00 1.19 C ATOM 445 CD GLN A 32 -1.566 8.639 -14.213 1.00 1.59 C ATOM 446 OE1 GLN A 32 -2.549 8.803 -14.908 1.00 2.16 O ATOM 447 NE2 GLN A 32 -0.662 7.764 -14.560 1.00 2.21 N ATOM 0 H GLN A 32 -1.135 7.257 -9.601 1.00 0.42 H new ATOM 0 HA GLN A 32 -3.124 8.515 -11.152 1.00 0.47 H new ATOM 0 HB2 GLN A 32 -0.627 9.086 -10.933 1.00 0.57 H new ATOM 0 HB3 GLN A 32 -0.299 7.786 -12.062 1.00 0.57 H new ATOM 0 HG2 GLN A 32 -2.274 10.025 -12.715 1.00 1.19 H new ATOM 0 HG3 GLN A 32 -0.563 10.171 -13.066 1.00 1.19 H new ATOM 0 HE21 GLN A 32 0.164 7.625 -13.977 1.00 2.21 H new ATOM 0 HE22 GLN A 32 -0.781 7.219 -15.414 1.00 2.21 H new ATOM 456 N ASP A 33 -2.246 5.576 -12.333 1.00 0.49 N ATOM 457 CA ASP A 33 -2.642 4.582 -13.377 1.00 0.58 C ATOM 458 C ASP A 33 -4.119 4.207 -13.204 1.00 0.61 C ATOM 459 O ASP A 33 -4.858 4.110 -14.163 1.00 0.70 O ATOM 460 CB ASP A 33 -1.769 3.328 -13.261 1.00 0.61 C ATOM 461 CG ASP A 33 -0.303 3.702 -13.495 1.00 1.10 C ATOM 462 OD1 ASP A 33 -0.053 4.534 -14.352 1.00 1.89 O ATOM 463 OD2 ASP A 33 0.545 3.149 -12.813 1.00 1.78 O ATOM 0 H ASP A 33 -1.581 5.240 -11.636 1.00 0.49 H new ATOM 0 HA ASP A 33 -2.499 5.024 -14.363 1.00 0.58 H new ATOM 0 HB2 ASP A 33 -1.888 2.879 -12.275 1.00 0.61 H new ATOM 0 HB3 ASP A 33 -2.086 2.583 -13.990 1.00 0.61 H new ATOM 468 N ARG A 34 -4.557 4.007 -11.991 1.00 0.58 N ATOM 469 CA ARG A 34 -5.990 3.650 -11.758 1.00 0.71 C ATOM 470 C ARG A 34 -6.840 4.922 -11.756 1.00 0.65 C ATOM 471 O ARG A 34 -8.053 4.869 -11.800 1.00 0.85 O ATOM 472 CB ARG A 34 -6.136 2.948 -10.405 1.00 0.85 C ATOM 473 CG ARG A 34 -5.287 1.652 -10.368 1.00 1.25 C ATOM 474 CD ARG A 34 -6.090 0.517 -9.723 1.00 1.31 C ATOM 475 NE ARG A 34 -6.688 0.994 -8.445 1.00 1.58 N ATOM 476 CZ ARG A 34 -7.668 0.330 -7.897 1.00 2.09 C ATOM 477 NH1 ARG A 34 -8.138 -0.738 -8.481 1.00 2.58 N ATOM 478 NH2 ARG A 34 -8.183 0.737 -6.770 1.00 2.75 N ATOM 0 H ARG A 34 -3.986 4.075 -11.149 1.00 0.58 H new ATOM 0 HA ARG A 34 -6.325 2.983 -12.553 1.00 0.71 H new ATOM 0 HB2 ARG A 34 -5.821 3.619 -9.606 1.00 0.85 H new ATOM 0 HB3 ARG A 34 -7.184 2.708 -10.225 1.00 0.85 H new ATOM 0 HG2 ARG A 34 -4.993 1.371 -11.379 1.00 1.25 H new ATOM 0 HG3 ARG A 34 -4.369 1.825 -9.806 1.00 1.25 H new ATOM 0 HD2 ARG A 34 -6.875 0.182 -10.401 1.00 1.31 H new ATOM 0 HD3 ARG A 34 -5.443 -0.340 -9.536 1.00 1.31 H new ATOM 0 HE ARG A 34 -6.332 1.839 -7.999 1.00 1.58 H new ATOM 0 HH11 ARG A 34 -7.739 -1.053 -9.365 1.00 2.58 H new ATOM 0 HH12 ARG A 34 -8.904 -1.258 -8.053 1.00 2.58 H new ATOM 0 HH21 ARG A 34 -7.820 1.575 -6.316 1.00 2.75 H new ATOM 0 HH22 ARG A 34 -8.949 0.217 -6.342 1.00 2.75 H new ATOM 492 N ALA A 35 -6.214 6.060 -11.743 1.00 0.59 N ATOM 493 CA ALA A 35 -6.974 7.339 -11.777 1.00 0.66 C ATOM 494 C ALA A 35 -7.099 7.793 -13.229 1.00 0.80 C ATOM 495 O ALA A 35 -8.069 8.400 -13.637 1.00 0.88 O ATOM 496 CB ALA A 35 -6.183 8.403 -11.017 1.00 0.94 C ATOM 0 H ALA A 35 -5.200 6.162 -11.710 1.00 0.59 H new ATOM 0 HA ALA A 35 -7.958 7.199 -11.329 1.00 0.66 H new ATOM 0 HB1 ALA A 35 -6.730 9.345 -11.035 1.00 0.94 H new ATOM 0 HB2 ALA A 35 -6.044 8.084 -9.984 1.00 0.94 H new ATOM 0 HB3 ALA A 35 -5.210 8.539 -11.489 1.00 0.94 H new ATOM 502 N GLY A 36 -6.077 7.512 -13.997 1.00 1.15 N ATOM 503 CA GLY A 36 -6.034 7.917 -15.430 1.00 1.62 C ATOM 504 C GLY A 36 -7.042 7.131 -16.263 1.00 1.54 C ATOM 505 O GLY A 36 -7.995 7.688 -16.769 1.00 2.10 O ATOM 0 H GLY A 36 -5.251 7.005 -13.679 1.00 1.15 H new ATOM 0 HA2 GLY A 36 -6.243 8.983 -15.514 1.00 1.62 H new ATOM 0 HA3 GLY A 36 -5.031 7.757 -15.825 1.00 1.62 H new ATOM 509 N ARG A 37 -6.841 5.854 -16.449 1.00 2.07 N ATOM 510 CA ARG A 37 -7.806 5.095 -17.290 1.00 2.87 C ATOM 511 C ARG A 37 -7.783 5.698 -18.701 1.00 3.46 C ATOM 512 O ARG A 37 -7.093 6.663 -18.963 1.00 4.10 O ATOM 513 CB ARG A 37 -9.222 5.196 -16.684 1.00 3.63 C ATOM 514 CG ARG A 37 -10.071 3.960 -17.070 1.00 4.34 C ATOM 515 CD ARG A 37 -11.549 4.353 -17.222 1.00 5.18 C ATOM 516 NE ARG A 37 -11.908 5.418 -16.229 1.00 5.74 N ATOM 517 CZ ARG A 37 -11.672 5.271 -14.951 1.00 6.53 C ATOM 518 NH1 ARG A 37 -11.239 4.133 -14.483 1.00 6.88 N ATOM 519 NH2 ARG A 37 -11.921 6.254 -14.130 1.00 7.21 N ATOM 0 H ARG A 37 -6.067 5.314 -16.063 1.00 2.07 H new ATOM 0 HA ARG A 37 -7.530 4.041 -17.332 1.00 2.87 H new ATOM 0 HB2 ARG A 37 -9.154 5.272 -15.599 1.00 3.63 H new ATOM 0 HB3 ARG A 37 -9.711 6.104 -17.038 1.00 3.63 H new ATOM 0 HG2 ARG A 37 -9.703 3.535 -18.004 1.00 4.34 H new ATOM 0 HG3 ARG A 37 -9.970 3.188 -16.307 1.00 4.34 H new ATOM 0 HD2 ARG A 37 -11.735 4.712 -18.234 1.00 5.18 H new ATOM 0 HD3 ARG A 37 -12.182 3.478 -17.073 1.00 5.18 H new ATOM 0 HE ARG A 37 -12.347 6.278 -16.558 1.00 5.74 H new ATOM 0 HH11 ARG A 37 -11.082 3.348 -15.115 1.00 6.88 H new ATOM 0 HH12 ARG A 37 -11.058 4.028 -13.485 1.00 6.88 H new ATOM 0 HH21 ARG A 37 -12.298 7.132 -14.486 1.00 7.21 H new ATOM 0 HH22 ARG A 37 -11.739 6.144 -13.132 1.00 7.21 H new ATOM 533 N MET A 38 -8.505 5.114 -19.616 1.00 3.74 N ATOM 534 CA MET A 38 -8.500 5.624 -21.014 1.00 4.68 C ATOM 535 C MET A 38 -9.036 7.057 -21.078 1.00 4.70 C ATOM 536 O MET A 38 -10.213 7.293 -21.259 1.00 5.17 O ATOM 537 CB MET A 38 -9.368 4.715 -21.888 1.00 5.62 C ATOM 538 CG MET A 38 -8.820 3.286 -21.840 1.00 5.93 C ATOM 539 SD MET A 38 -9.819 2.218 -22.914 1.00 6.79 S ATOM 540 CE MET A 38 -10.741 1.351 -21.618 1.00 7.04 C ATOM 0 H MET A 38 -9.101 4.302 -19.454 1.00 3.74 H new ATOM 0 HA MET A 38 -7.473 5.625 -21.379 1.00 4.68 H new ATOM 0 HB2 MET A 38 -10.400 4.732 -21.537 1.00 5.62 H new ATOM 0 HB3 MET A 38 -9.375 5.079 -22.915 1.00 5.62 H new ATOM 0 HG2 MET A 38 -7.779 3.273 -22.163 1.00 5.93 H new ATOM 0 HG3 MET A 38 -8.840 2.912 -20.817 1.00 5.93 H new ATOM 0 HE1 MET A 38 -11.424 0.635 -22.075 1.00 7.04 H new ATOM 0 HE2 MET A 38 -10.044 0.823 -20.967 1.00 7.04 H new ATOM 0 HE3 MET A 38 -11.310 2.072 -21.032 1.00 7.04 H new ATOM 550 N GLY A 39 -8.162 8.012 -20.903 1.00 4.57 N ATOM 551 CA GLY A 39 -8.572 9.447 -20.922 1.00 4.85 C ATOM 552 C GLY A 39 -7.512 10.252 -20.169 1.00 4.67 C ATOM 553 O GLY A 39 -6.458 10.543 -20.700 1.00 4.95 O ATOM 0 H GLY A 39 -7.166 7.856 -20.745 1.00 4.57 H new ATOM 0 HA2 GLY A 39 -8.663 9.803 -21.948 1.00 4.85 H new ATOM 0 HA3 GLY A 39 -9.548 9.571 -20.453 1.00 4.85 H new ATOM 557 N GLY A 40 -7.752 10.593 -18.927 1.00 4.58 N ATOM 558 CA GLY A 40 -6.724 11.347 -18.137 1.00 4.69 C ATOM 559 C GLY A 40 -6.975 12.862 -18.175 1.00 4.20 C ATOM 560 O GLY A 40 -6.133 13.620 -18.611 1.00 4.34 O ATOM 0 H GLY A 40 -8.614 10.383 -18.424 1.00 4.58 H new ATOM 0 HA2 GLY A 40 -6.735 11.002 -17.103 1.00 4.69 H new ATOM 0 HA3 GLY A 40 -5.732 11.133 -18.534 1.00 4.69 H new ATOM 564 N GLU A 41 -8.142 13.308 -17.789 1.00 4.01 N ATOM 565 CA GLU A 41 -8.453 14.774 -17.866 1.00 3.88 C ATOM 566 C GLU A 41 -8.162 15.478 -16.532 1.00 3.63 C ATOM 567 O GLU A 41 -8.035 16.685 -16.474 1.00 4.16 O ATOM 568 CB GLU A 41 -9.944 14.941 -18.182 1.00 4.26 C ATOM 569 CG GLU A 41 -10.317 14.115 -19.416 1.00 4.51 C ATOM 570 CD GLU A 41 -9.656 14.724 -20.652 1.00 4.90 C ATOM 571 OE1 GLU A 41 -10.023 15.831 -21.008 1.00 5.19 O ATOM 572 OE2 GLU A 41 -8.794 14.074 -21.219 1.00 5.28 O ATOM 0 H GLU A 41 -8.895 12.725 -17.424 1.00 4.01 H new ATOM 0 HA GLU A 41 -7.828 15.219 -18.640 1.00 3.88 H new ATOM 0 HB2 GLU A 41 -10.542 14.623 -17.328 1.00 4.26 H new ATOM 0 HB3 GLU A 41 -10.171 15.993 -18.357 1.00 4.26 H new ATOM 0 HG2 GLU A 41 -9.993 13.082 -19.288 1.00 4.51 H new ATOM 0 HG3 GLU A 41 -11.400 14.096 -19.541 1.00 4.51 H new ATOM 579 N ALA A 42 -8.108 14.740 -15.463 1.00 3.19 N ATOM 580 CA ALA A 42 -7.894 15.375 -14.132 1.00 3.24 C ATOM 581 C ALA A 42 -7.535 14.309 -13.085 1.00 2.77 C ATOM 582 O ALA A 42 -8.096 14.300 -12.008 1.00 3.06 O ATOM 583 CB ALA A 42 -9.244 16.036 -13.855 1.00 4.08 C ATOM 0 H ALA A 42 -8.202 13.724 -15.450 1.00 3.19 H new ATOM 0 HA ALA A 42 -7.071 16.089 -14.100 1.00 3.24 H new ATOM 0 HB1 ALA A 42 -9.210 16.542 -12.890 1.00 4.08 H new ATOM 0 HB2 ALA A 42 -9.461 16.762 -14.638 1.00 4.08 H new ATOM 0 HB3 ALA A 42 -10.025 15.276 -13.839 1.00 4.08 H new ATOM 589 N PRO A 43 -6.605 13.429 -13.427 1.00 2.70 N ATOM 590 CA PRO A 43 -6.181 12.359 -12.505 1.00 3.03 C ATOM 591 C PRO A 43 -5.317 12.927 -11.365 1.00 2.67 C ATOM 592 O PRO A 43 -4.211 12.485 -11.144 1.00 2.87 O ATOM 593 CB PRO A 43 -5.342 11.406 -13.394 1.00 3.84 C ATOM 594 CG PRO A 43 -4.949 12.205 -14.663 1.00 3.86 C ATOM 595 CD PRO A 43 -5.903 13.412 -14.742 1.00 3.12 C ATOM 0 HA PRO A 43 -7.026 11.861 -12.030 1.00 3.03 H new ATOM 0 HB2 PRO A 43 -4.454 11.064 -12.863 1.00 3.84 H new ATOM 0 HB3 PRO A 43 -5.917 10.519 -13.659 1.00 3.84 H new ATOM 0 HG2 PRO A 43 -3.912 12.535 -14.606 1.00 3.86 H new ATOM 0 HG3 PRO A 43 -5.037 11.583 -15.554 1.00 3.86 H new ATOM 0 HD2 PRO A 43 -5.355 14.339 -14.910 1.00 3.12 H new ATOM 0 HD3 PRO A 43 -6.609 13.305 -15.566 1.00 3.12 H new ATOM 603 N GLU A 44 -5.826 13.907 -10.640 1.00 2.45 N ATOM 604 CA GLU A 44 -5.046 14.516 -9.508 1.00 2.23 C ATOM 605 C GLU A 44 -3.553 14.568 -9.854 1.00 1.75 C ATOM 606 O GLU A 44 -3.191 14.584 -11.013 1.00 2.00 O ATOM 607 CB GLU A 44 -5.267 13.705 -8.212 1.00 2.55 C ATOM 608 CG GLU A 44 -4.744 12.260 -8.335 1.00 2.70 C ATOM 609 CD GLU A 44 -5.789 11.371 -9.018 1.00 3.17 C ATOM 610 OE1 GLU A 44 -6.799 11.900 -9.454 1.00 3.77 O ATOM 611 OE2 GLU A 44 -5.562 10.174 -9.089 1.00 3.42 O ATOM 0 H GLU A 44 -6.751 14.310 -10.787 1.00 2.45 H new ATOM 0 HA GLU A 44 -5.400 15.535 -9.349 1.00 2.23 H new ATOM 0 HB2 GLU A 44 -4.764 14.203 -7.383 1.00 2.55 H new ATOM 0 HB3 GLU A 44 -6.330 13.686 -7.974 1.00 2.55 H new ATOM 0 HG2 GLU A 44 -3.817 12.249 -8.909 1.00 2.70 H new ATOM 0 HG3 GLU A 44 -4.511 11.865 -7.346 1.00 2.70 H new ATOM 618 N LEU A 45 -2.696 14.574 -8.854 1.00 1.80 N ATOM 619 CA LEU A 45 -1.208 14.600 -9.091 1.00 1.80 C ATOM 620 C LEU A 45 -0.880 15.276 -10.431 1.00 2.29 C ATOM 621 O LEU A 45 -0.262 14.691 -11.296 1.00 3.01 O ATOM 622 CB LEU A 45 -0.685 13.159 -9.113 1.00 2.23 C ATOM 623 CG LEU A 45 -1.019 12.451 -7.785 1.00 2.52 C ATOM 624 CD1 LEU A 45 -0.942 10.934 -7.978 1.00 3.22 C ATOM 625 CD2 LEU A 45 -0.022 12.866 -6.694 1.00 3.00 C ATOM 0 H LEU A 45 -2.967 14.562 -7.871 1.00 1.80 H new ATOM 0 HA LEU A 45 -0.733 15.167 -8.291 1.00 1.80 H new ATOM 0 HB2 LEU A 45 -1.131 12.615 -9.946 1.00 2.23 H new ATOM 0 HB3 LEU A 45 0.393 13.158 -9.273 1.00 2.23 H new ATOM 0 HG LEU A 45 -2.026 12.738 -7.481 1.00 2.52 H new ATOM 0 HD11 LEU A 45 -1.178 10.435 -7.038 1.00 3.22 H new ATOM 0 HD12 LEU A 45 -1.657 10.628 -8.741 1.00 3.22 H new ATOM 0 HD13 LEU A 45 0.065 10.658 -8.292 1.00 3.22 H new ATOM 0 HD21 LEU A 45 -0.270 12.358 -5.762 1.00 3.00 H new ATOM 0 HD22 LEU A 45 0.987 12.590 -7.000 1.00 3.00 H new ATOM 0 HD23 LEU A 45 -0.074 13.944 -6.545 1.00 3.00 H new ATOM 637 N ALA A 46 -1.324 16.489 -10.614 1.00 2.46 N ATOM 638 CA ALA A 46 -1.077 17.199 -11.906 1.00 3.15 C ATOM 639 C ALA A 46 0.378 17.031 -12.355 1.00 2.91 C ATOM 640 O ALA A 46 1.227 17.841 -12.041 1.00 3.07 O ATOM 641 CB ALA A 46 -1.385 18.687 -11.741 1.00 4.05 C ATOM 0 H ALA A 46 -1.850 17.023 -9.922 1.00 2.46 H new ATOM 0 HA ALA A 46 -1.728 16.765 -12.665 1.00 3.15 H new ATOM 0 HB1 ALA A 46 -1.204 19.203 -12.684 1.00 4.05 H new ATOM 0 HB2 ALA A 46 -2.429 18.813 -11.453 1.00 4.05 H new ATOM 0 HB3 ALA A 46 -0.742 19.108 -10.968 1.00 4.05 H new ATOM 647 N LEU A 47 0.649 15.990 -13.110 1.00 3.18 N ATOM 648 CA LEU A 47 2.031 15.722 -13.637 1.00 3.43 C ATOM 649 C LEU A 47 3.106 16.273 -12.693 1.00 3.14 C ATOM 650 O LEU A 47 3.995 16.990 -13.108 1.00 3.51 O ATOM 651 CB LEU A 47 2.183 16.377 -15.022 1.00 4.05 C ATOM 652 CG LEU A 47 1.532 15.501 -16.106 1.00 4.77 C ATOM 653 CD1 LEU A 47 2.311 14.179 -16.285 1.00 5.26 C ATOM 654 CD2 LEU A 47 0.081 15.205 -15.712 1.00 5.35 C ATOM 0 H LEU A 47 -0.046 15.298 -13.390 1.00 3.18 H new ATOM 0 HA LEU A 47 2.165 14.643 -13.712 1.00 3.43 H new ATOM 0 HB2 LEU A 47 1.720 17.364 -15.017 1.00 4.05 H new ATOM 0 HB3 LEU A 47 3.239 16.522 -15.249 1.00 4.05 H new ATOM 0 HG LEU A 47 1.554 16.038 -17.054 1.00 4.77 H new ATOM 0 HD11 LEU A 47 1.832 13.576 -17.057 1.00 5.26 H new ATOM 0 HD12 LEU A 47 3.337 14.398 -16.581 1.00 5.26 H new ATOM 0 HD13 LEU A 47 2.314 13.628 -15.344 1.00 5.26 H new ATOM 0 HD21 LEU A 47 -0.385 14.584 -16.478 1.00 5.35 H new ATOM 0 HD22 LEU A 47 0.063 14.679 -14.758 1.00 5.35 H new ATOM 0 HD23 LEU A 47 -0.469 16.141 -15.620 1.00 5.35 H new ATOM 666 N ASP A 48 3.039 15.938 -11.429 1.00 3.02 N ATOM 667 CA ASP A 48 4.066 16.433 -10.460 1.00 3.07 C ATOM 668 C ASP A 48 5.208 15.410 -10.279 1.00 2.77 C ATOM 669 O ASP A 48 6.330 15.807 -10.040 1.00 2.85 O ATOM 670 CB ASP A 48 3.372 16.734 -9.111 1.00 3.61 C ATOM 671 CG ASP A 48 3.405 18.237 -8.808 1.00 4.22 C ATOM 672 OD1 ASP A 48 4.484 18.745 -8.553 1.00 4.68 O ATOM 673 OD2 ASP A 48 2.351 18.850 -8.836 1.00 4.69 O ATOM 0 H ASP A 48 2.316 15.342 -11.025 1.00 3.02 H new ATOM 0 HA ASP A 48 4.517 17.345 -10.850 1.00 3.07 H new ATOM 0 HB2 ASP A 48 2.339 16.387 -9.142 1.00 3.61 H new ATOM 0 HB3 ASP A 48 3.869 16.186 -8.311 1.00 3.61 H new ATOM 678 N PRO A 49 4.912 14.131 -10.372 1.00 3.11 N ATOM 679 CA PRO A 49 5.944 13.098 -10.187 1.00 3.40 C ATOM 680 C PRO A 49 7.057 13.231 -11.241 1.00 3.08 C ATOM 681 O PRO A 49 7.102 14.167 -12.014 1.00 3.32 O ATOM 682 CB PRO A 49 5.188 11.764 -10.322 1.00 4.36 C ATOM 683 CG PRO A 49 3.678 12.087 -10.458 1.00 4.66 C ATOM 684 CD PRO A 49 3.559 13.601 -10.661 1.00 3.86 C ATOM 0 HA PRO A 49 6.447 13.182 -9.224 1.00 3.40 H new ATOM 0 HB2 PRO A 49 5.540 11.212 -11.193 1.00 4.36 H new ATOM 0 HB3 PRO A 49 5.367 11.134 -9.451 1.00 4.36 H new ATOM 0 HG2 PRO A 49 3.243 11.550 -11.301 1.00 4.66 H new ATOM 0 HG3 PRO A 49 3.135 11.774 -9.566 1.00 4.66 H new ATOM 0 HD2 PRO A 49 3.250 13.840 -11.678 1.00 3.86 H new ATOM 0 HD3 PRO A 49 2.814 14.032 -9.992 1.00 3.86 H new ATOM 692 N VAL A 50 7.942 12.265 -11.268 1.00 3.08 N ATOM 693 CA VAL A 50 9.066 12.263 -12.252 1.00 3.10 C ATOM 694 C VAL A 50 8.507 11.807 -13.618 1.00 2.75 C ATOM 695 O VAL A 50 7.429 11.249 -13.657 1.00 2.91 O ATOM 696 CB VAL A 50 10.123 11.271 -11.730 1.00 3.88 C ATOM 697 CG1 VAL A 50 10.431 11.585 -10.265 1.00 4.44 C ATOM 698 CG2 VAL A 50 9.590 9.838 -11.844 1.00 4.50 C ATOM 0 H VAL A 50 7.931 11.464 -10.637 1.00 3.08 H new ATOM 0 HA VAL A 50 9.516 13.249 -12.371 1.00 3.10 H new ATOM 0 HB VAL A 50 11.032 11.364 -12.325 1.00 3.88 H new ATOM 0 HG11 VAL A 50 11.179 10.885 -9.892 1.00 4.44 H new ATOM 0 HG12 VAL A 50 10.814 12.602 -10.184 1.00 4.44 H new ATOM 0 HG13 VAL A 50 9.520 11.492 -9.674 1.00 4.44 H new ATOM 0 HG21 VAL A 50 10.341 9.140 -11.474 1.00 4.50 H new ATOM 0 HG22 VAL A 50 8.680 9.740 -11.252 1.00 4.50 H new ATOM 0 HG23 VAL A 50 9.370 9.614 -12.888 1.00 4.50 H new ATOM 708 N PRO A 51 9.223 12.035 -14.704 1.00 2.91 N ATOM 709 CA PRO A 51 8.731 11.609 -16.030 1.00 3.22 C ATOM 710 C PRO A 51 8.404 10.106 -16.004 1.00 2.93 C ATOM 711 O PRO A 51 7.253 9.718 -15.980 1.00 3.37 O ATOM 712 CB PRO A 51 9.880 11.937 -17.009 1.00 4.09 C ATOM 713 CG PRO A 51 10.985 12.676 -16.200 1.00 4.27 C ATOM 714 CD PRO A 51 10.538 12.715 -14.721 1.00 3.50 C ATOM 0 HA PRO A 51 7.813 12.115 -16.328 1.00 3.22 H new ATOM 0 HB2 PRO A 51 10.276 11.025 -17.455 1.00 4.09 H new ATOM 0 HB3 PRO A 51 9.521 12.562 -17.827 1.00 4.09 H new ATOM 0 HG2 PRO A 51 11.940 12.160 -16.297 1.00 4.27 H new ATOM 0 HG3 PRO A 51 11.128 13.686 -16.583 1.00 4.27 H new ATOM 0 HD2 PRO A 51 11.255 12.205 -14.078 1.00 3.50 H new ATOM 0 HD3 PRO A 51 10.458 13.740 -14.359 1.00 3.50 H new ATOM 722 N GLN A 52 9.399 9.258 -16.021 1.00 2.70 N ATOM 723 CA GLN A 52 9.115 7.792 -16.011 1.00 2.85 C ATOM 724 C GLN A 52 10.405 7.004 -15.760 1.00 2.14 C ATOM 725 O GLN A 52 11.305 6.989 -16.577 1.00 2.38 O ATOM 726 CB GLN A 52 8.528 7.386 -17.368 1.00 3.67 C ATOM 727 CG GLN A 52 8.029 5.937 -17.313 1.00 4.37 C ATOM 728 CD GLN A 52 7.110 5.667 -18.508 1.00 5.22 C ATOM 729 OE1 GLN A 52 7.521 5.790 -19.644 1.00 5.74 O ATOM 730 NE2 GLN A 52 5.876 5.298 -18.299 1.00 5.74 N ATOM 0 H GLN A 52 10.386 9.513 -16.041 1.00 2.70 H new ATOM 0 HA GLN A 52 8.405 7.570 -15.215 1.00 2.85 H new ATOM 0 HB2 GLN A 52 7.707 8.052 -17.632 1.00 3.67 H new ATOM 0 HB3 GLN A 52 9.284 7.489 -18.146 1.00 3.67 H new ATOM 0 HG2 GLN A 52 8.875 5.249 -17.328 1.00 4.37 H new ATOM 0 HG3 GLN A 52 7.492 5.761 -16.381 1.00 4.37 H new ATOM 0 HE21 GLN A 52 5.529 5.194 -17.345 1.00 5.74 H new ATOM 0 HE22 GLN A 52 5.258 5.113 -19.089 1.00 5.74 H new ATOM 739 N ASP A 53 10.492 6.334 -14.638 1.00 1.78 N ATOM 740 CA ASP A 53 11.711 5.525 -14.323 1.00 1.30 C ATOM 741 C ASP A 53 11.430 4.059 -14.661 1.00 1.07 C ATOM 742 O ASP A 53 10.322 3.580 -14.527 1.00 1.19 O ATOM 743 CB ASP A 53 12.048 5.654 -12.836 1.00 1.65 C ATOM 744 CG ASP A 53 12.519 7.078 -12.538 1.00 2.27 C ATOM 745 OD1 ASP A 53 13.370 7.564 -13.265 1.00 2.91 O ATOM 746 OD2 ASP A 53 12.020 7.659 -11.588 1.00 2.80 O ATOM 0 H ASP A 53 9.766 6.312 -13.922 1.00 1.78 H new ATOM 0 HA ASP A 53 12.555 5.886 -14.910 1.00 1.30 H new ATOM 0 HB2 ASP A 53 11.172 5.416 -12.232 1.00 1.65 H new ATOM 0 HB3 ASP A 53 12.825 4.939 -12.566 1.00 1.65 H new ATOM 751 N ALA A 54 12.426 3.347 -15.119 1.00 0.91 N ATOM 752 CA ALA A 54 12.215 1.919 -15.489 1.00 0.84 C ATOM 753 C ALA A 54 12.064 1.061 -14.229 1.00 0.76 C ATOM 754 O ALA A 54 11.468 0.003 -14.259 1.00 0.75 O ATOM 755 CB ALA A 54 13.412 1.424 -16.305 1.00 0.95 C ATOM 0 H ALA A 54 13.376 3.694 -15.252 1.00 0.91 H new ATOM 0 HA ALA A 54 11.305 1.836 -16.083 1.00 0.84 H new ATOM 0 HB1 ALA A 54 13.260 0.379 -16.577 1.00 0.95 H new ATOM 0 HB2 ALA A 54 13.509 2.024 -17.210 1.00 0.95 H new ATOM 0 HB3 ALA A 54 14.321 1.516 -15.710 1.00 0.95 H new ATOM 761 N SER A 55 12.606 1.499 -13.125 1.00 0.75 N ATOM 762 CA SER A 55 12.495 0.694 -11.873 1.00 0.71 C ATOM 763 C SER A 55 11.079 0.819 -11.304 1.00 0.66 C ATOM 764 O SER A 55 10.438 -0.161 -10.980 1.00 0.66 O ATOM 765 CB SER A 55 13.505 1.204 -10.846 1.00 0.76 C ATOM 766 OG SER A 55 14.817 1.097 -11.384 1.00 1.37 O ATOM 0 H SER A 55 13.119 2.376 -13.035 1.00 0.75 H new ATOM 0 HA SER A 55 12.703 -0.352 -12.098 1.00 0.71 H new ATOM 0 HB2 SER A 55 13.288 2.241 -10.590 1.00 0.76 H new ATOM 0 HB3 SER A 55 13.429 0.625 -9.925 1.00 0.76 H new ATOM 0 HG SER A 55 15.467 1.425 -10.728 1.00 1.37 H new ATOM 772 N THR A 56 10.591 2.020 -11.181 1.00 0.65 N ATOM 773 CA THR A 56 9.220 2.228 -10.633 1.00 0.62 C ATOM 774 C THR A 56 8.173 1.862 -11.687 1.00 0.59 C ATOM 775 O THR A 56 7.037 1.563 -11.368 1.00 0.57 O ATOM 776 CB THR A 56 9.050 3.702 -10.254 1.00 0.67 C ATOM 777 OG1 THR A 56 10.067 4.073 -9.332 1.00 1.09 O ATOM 778 CG2 THR A 56 7.677 3.910 -9.612 1.00 1.06 C ATOM 0 H THR A 56 11.086 2.874 -11.438 1.00 0.65 H new ATOM 0 HA THR A 56 9.085 1.595 -9.756 1.00 0.62 H new ATOM 0 HB THR A 56 9.128 4.319 -11.149 1.00 0.67 H new ATOM 0 HG1 THR A 56 9.961 5.017 -9.090 1.00 1.09 H new ATOM 0 HG21 THR A 56 7.557 4.959 -9.342 1.00 1.06 H new ATOM 0 HG22 THR A 56 6.898 3.625 -10.319 1.00 1.06 H new ATOM 0 HG23 THR A 56 7.597 3.294 -8.716 1.00 1.06 H new ATOM 786 N LYS A 57 8.534 1.891 -12.940 1.00 0.61 N ATOM 787 CA LYS A 57 7.540 1.559 -13.998 1.00 0.59 C ATOM 788 C LYS A 57 7.208 0.066 -13.947 1.00 0.54 C ATOM 789 O LYS A 57 6.061 -0.321 -14.061 1.00 0.52 O ATOM 790 CB LYS A 57 8.108 1.934 -15.371 1.00 0.65 C ATOM 791 CG LYS A 57 7.161 1.463 -16.497 1.00 1.20 C ATOM 792 CD LYS A 57 7.377 -0.039 -16.838 1.00 1.33 C ATOM 793 CE LYS A 57 7.315 -0.248 -18.357 1.00 1.94 C ATOM 794 NZ LYS A 57 7.391 -1.705 -18.662 1.00 2.73 N ATOM 0 H LYS A 57 9.468 2.128 -13.275 1.00 0.61 H new ATOM 0 HA LYS A 57 6.624 2.125 -13.828 1.00 0.59 H new ATOM 0 HB2 LYS A 57 8.245 3.014 -15.431 1.00 0.65 H new ATOM 0 HB3 LYS A 57 9.090 1.480 -15.501 1.00 0.65 H new ATOM 0 HG2 LYS A 57 6.126 1.622 -16.193 1.00 1.20 H new ATOM 0 HG3 LYS A 57 7.328 2.067 -17.389 1.00 1.20 H new ATOM 0 HD2 LYS A 57 8.342 -0.372 -16.456 1.00 1.33 H new ATOM 0 HD3 LYS A 57 6.615 -0.645 -16.348 1.00 1.33 H new ATOM 0 HE2 LYS A 57 6.390 0.170 -18.755 1.00 1.94 H new ATOM 0 HE3 LYS A 57 8.137 0.279 -18.841 1.00 1.94 H new ATOM 0 HZ1 LYS A 57 7.349 -1.847 -19.691 1.00 2.73 H new ATOM 0 HZ2 LYS A 57 8.285 -2.090 -18.296 1.00 2.73 H new ATOM 0 HZ3 LYS A 57 6.592 -2.196 -18.212 1.00 2.73 H new ATOM 808 N LYS A 58 8.186 -0.783 -13.780 1.00 0.55 N ATOM 809 CA LYS A 58 7.884 -2.243 -13.730 1.00 0.53 C ATOM 810 C LYS A 58 7.155 -2.535 -12.414 1.00 0.48 C ATOM 811 O LYS A 58 6.171 -3.253 -12.387 1.00 0.46 O ATOM 812 CB LYS A 58 9.200 -3.035 -13.821 1.00 0.56 C ATOM 813 CG LYS A 58 8.950 -4.493 -14.263 1.00 0.78 C ATOM 814 CD LYS A 58 8.626 -5.376 -13.051 1.00 0.96 C ATOM 815 CE LYS A 58 8.593 -6.842 -13.488 1.00 0.85 C ATOM 816 NZ LYS A 58 9.958 -7.262 -13.920 1.00 1.75 N ATOM 0 H LYS A 58 9.170 -0.534 -13.677 1.00 0.55 H new ATOM 0 HA LYS A 58 7.250 -2.541 -14.565 1.00 0.53 H new ATOM 0 HB2 LYS A 58 9.871 -2.549 -14.529 1.00 0.56 H new ATOM 0 HB3 LYS A 58 9.699 -3.027 -12.852 1.00 0.56 H new ATOM 0 HG2 LYS A 58 8.126 -4.527 -14.975 1.00 0.78 H new ATOM 0 HG3 LYS A 58 9.831 -4.879 -14.776 1.00 0.78 H new ATOM 0 HD2 LYS A 58 9.375 -5.234 -12.272 1.00 0.96 H new ATOM 0 HD3 LYS A 58 7.664 -5.090 -12.625 1.00 0.96 H new ATOM 0 HE2 LYS A 58 8.251 -7.470 -12.666 1.00 0.85 H new ATOM 0 HE3 LYS A 58 7.884 -6.973 -14.306 1.00 0.85 H new ATOM 0 HZ1 LYS A 58 10.067 -8.287 -13.779 1.00 1.75 H new ATOM 0 HZ2 LYS A 58 10.089 -7.035 -14.926 1.00 1.75 H new ATOM 0 HZ3 LYS A 58 10.671 -6.758 -13.356 1.00 1.75 H new ATOM 830 N LEU A 59 7.623 -1.997 -11.322 1.00 0.50 N ATOM 831 CA LEU A 59 6.939 -2.271 -10.028 1.00 0.47 C ATOM 832 C LEU A 59 5.475 -1.810 -10.141 1.00 0.43 C ATOM 833 O LEU A 59 4.621 -2.217 -9.377 1.00 0.42 O ATOM 834 CB LEU A 59 7.650 -1.508 -8.888 1.00 0.53 C ATOM 835 CG LEU A 59 8.601 -2.421 -8.086 1.00 0.71 C ATOM 836 CD1 LEU A 59 9.511 -1.525 -7.241 1.00 1.07 C ATOM 837 CD2 LEU A 59 7.782 -3.309 -7.139 1.00 1.34 C ATOM 0 H LEU A 59 8.439 -1.387 -11.269 1.00 0.50 H new ATOM 0 HA LEU A 59 6.974 -3.337 -9.805 1.00 0.47 H new ATOM 0 HB2 LEU A 59 8.215 -0.675 -9.307 1.00 0.53 H new ATOM 0 HB3 LEU A 59 6.904 -1.082 -8.217 1.00 0.53 H new ATOM 0 HG LEU A 59 9.182 -3.046 -8.764 1.00 0.71 H new ATOM 0 HD11 LEU A 59 10.196 -2.145 -6.662 1.00 1.07 H new ATOM 0 HD12 LEU A 59 10.083 -0.867 -7.895 1.00 1.07 H new ATOM 0 HD13 LEU A 59 8.903 -0.925 -6.564 1.00 1.07 H new ATOM 0 HD21 LEU A 59 8.454 -3.954 -6.573 1.00 1.34 H new ATOM 0 HD22 LEU A 59 7.216 -2.682 -6.451 1.00 1.34 H new ATOM 0 HD23 LEU A 59 7.094 -3.923 -7.720 1.00 1.34 H new ATOM 849 N SER A 60 5.182 -0.986 -11.114 1.00 0.43 N ATOM 850 CA SER A 60 3.777 -0.517 -11.309 1.00 0.42 C ATOM 851 C SER A 60 2.972 -1.653 -11.948 1.00 0.39 C ATOM 852 O SER A 60 1.859 -1.943 -11.555 1.00 0.41 O ATOM 853 CB SER A 60 3.777 0.690 -12.249 1.00 0.47 C ATOM 854 OG SER A 60 3.800 0.236 -13.595 1.00 1.36 O ATOM 0 H SER A 60 5.857 -0.617 -11.784 1.00 0.43 H new ATOM 0 HA SER A 60 3.337 -0.234 -10.353 1.00 0.42 H new ATOM 0 HB2 SER A 60 2.892 1.302 -12.074 1.00 0.47 H new ATOM 0 HB3 SER A 60 4.644 1.320 -12.051 1.00 0.47 H new ATOM 0 HG SER A 60 4.652 -0.213 -13.774 1.00 1.36 H new ATOM 860 N GLU A 61 3.554 -2.312 -12.913 1.00 0.38 N ATOM 861 CA GLU A 61 2.865 -3.455 -13.577 1.00 0.38 C ATOM 862 C GLU A 61 2.400 -4.456 -12.513 1.00 0.38 C ATOM 863 O GLU A 61 1.351 -5.057 -12.642 1.00 0.41 O ATOM 864 CB GLU A 61 3.830 -4.148 -14.541 1.00 0.39 C ATOM 865 CG GLU A 61 4.218 -3.178 -15.661 1.00 1.06 C ATOM 866 CD GLU A 61 3.034 -2.996 -16.613 1.00 1.67 C ATOM 867 OE1 GLU A 61 2.044 -3.686 -16.436 1.00 2.25 O ATOM 868 OE2 GLU A 61 3.138 -2.168 -17.504 1.00 2.40 O ATOM 0 H GLU A 61 4.486 -2.105 -13.273 1.00 0.38 H new ATOM 0 HA GLU A 61 2.003 -3.085 -14.133 1.00 0.38 H new ATOM 0 HB2 GLU A 61 4.721 -4.478 -14.006 1.00 0.39 H new ATOM 0 HB3 GLU A 61 3.363 -5.038 -14.962 1.00 0.39 H new ATOM 0 HG2 GLU A 61 4.510 -2.216 -15.239 1.00 1.06 H new ATOM 0 HG3 GLU A 61 5.081 -3.562 -16.206 1.00 1.06 H new ATOM 875 N CYS A 62 3.144 -4.636 -11.461 1.00 0.37 N ATOM 876 CA CYS A 62 2.693 -5.594 -10.409 1.00 0.39 C ATOM 877 C CYS A 62 1.478 -5.000 -9.684 1.00 0.38 C ATOM 878 O CYS A 62 0.511 -5.681 -9.403 1.00 0.44 O ATOM 879 CB CYS A 62 3.825 -5.827 -9.408 1.00 0.41 C ATOM 880 SG CYS A 62 3.311 -7.066 -8.193 1.00 1.62 S ATOM 0 H CYS A 62 4.034 -4.170 -11.282 1.00 0.37 H new ATOM 0 HA CYS A 62 2.421 -6.545 -10.867 1.00 0.39 H new ATOM 0 HB2 CYS A 62 4.722 -6.163 -9.929 1.00 0.41 H new ATOM 0 HB3 CYS A 62 4.079 -4.893 -8.906 1.00 0.41 H new ATOM 0 HG CYS A 62 4.090 -8.104 -8.275 1.00 1.62 H new ATOM 886 N LEU A 63 1.518 -3.728 -9.402 1.00 0.35 N ATOM 887 CA LEU A 63 0.373 -3.055 -8.719 1.00 0.36 C ATOM 888 C LEU A 63 -0.809 -2.933 -9.691 1.00 0.36 C ATOM 889 O LEU A 63 -1.955 -2.905 -9.287 1.00 0.41 O ATOM 890 CB LEU A 63 0.827 -1.662 -8.270 1.00 0.38 C ATOM 891 CG LEU A 63 2.019 -1.796 -7.306 1.00 0.69 C ATOM 892 CD1 LEU A 63 2.566 -0.402 -6.981 1.00 1.39 C ATOM 893 CD2 LEU A 63 1.567 -2.465 -5.994 1.00 1.11 C ATOM 0 H LEU A 63 2.305 -3.116 -9.618 1.00 0.35 H new ATOM 0 HA LEU A 63 0.055 -3.638 -7.855 1.00 0.36 H new ATOM 0 HB2 LEU A 63 1.111 -1.064 -9.136 1.00 0.38 H new ATOM 0 HB3 LEU A 63 0.005 -1.141 -7.779 1.00 0.38 H new ATOM 0 HG LEU A 63 2.789 -2.405 -7.780 1.00 0.69 H new ATOM 0 HD11 LEU A 63 3.411 -0.493 -6.298 1.00 1.39 H new ATOM 0 HD12 LEU A 63 2.893 0.084 -7.900 1.00 1.39 H new ATOM 0 HD13 LEU A 63 1.784 0.196 -6.513 1.00 1.39 H new ATOM 0 HD21 LEU A 63 2.418 -2.555 -5.319 1.00 1.11 H new ATOM 0 HD22 LEU A 63 0.794 -1.858 -5.524 1.00 1.11 H new ATOM 0 HD23 LEU A 63 1.169 -3.456 -6.210 1.00 1.11 H new ATOM 905 N LYS A 64 -0.540 -2.850 -10.963 1.00 0.35 N ATOM 906 CA LYS A 64 -1.648 -2.721 -11.957 1.00 0.37 C ATOM 907 C LYS A 64 -2.258 -4.095 -12.259 1.00 0.39 C ATOM 908 O LYS A 64 -3.463 -4.249 -12.301 1.00 0.43 O ATOM 909 CB LYS A 64 -1.107 -2.118 -13.251 1.00 0.38 C ATOM 910 CG LYS A 64 -0.691 -0.666 -13.001 1.00 0.82 C ATOM 911 CD LYS A 64 0.005 -0.104 -14.246 1.00 1.35 C ATOM 912 CE LYS A 64 -0.994 0.009 -15.405 1.00 1.38 C ATOM 913 NZ LYS A 64 -0.463 0.961 -16.421 1.00 2.09 N ATOM 0 H LYS A 64 0.399 -2.866 -11.361 1.00 0.35 H new ATOM 0 HA LYS A 64 -2.418 -2.073 -11.539 1.00 0.37 H new ATOM 0 HB2 LYS A 64 -0.254 -2.696 -13.606 1.00 0.38 H new ATOM 0 HB3 LYS A 64 -1.867 -2.161 -14.031 1.00 0.38 H new ATOM 0 HG2 LYS A 64 -1.567 -0.064 -12.759 1.00 0.82 H new ATOM 0 HG3 LYS A 64 -0.021 -0.613 -12.143 1.00 0.82 H new ATOM 0 HD2 LYS A 64 0.428 0.876 -14.024 1.00 1.35 H new ATOM 0 HD3 LYS A 64 0.834 -0.752 -14.532 1.00 1.35 H new ATOM 0 HE2 LYS A 64 -1.157 -0.970 -15.857 1.00 1.38 H new ATOM 0 HE3 LYS A 64 -1.960 0.354 -15.036 1.00 1.38 H new ATOM 0 HZ1 LYS A 64 -1.138 1.040 -17.208 1.00 2.09 H new ATOM 0 HZ2 LYS A 64 -0.329 1.895 -15.985 1.00 2.09 H new ATOM 0 HZ3 LYS A 64 0.449 0.613 -16.780 1.00 2.09 H new ATOM 927 N ARG A 65 -1.445 -5.089 -12.483 1.00 0.43 N ATOM 928 CA ARG A 65 -1.990 -6.443 -12.796 1.00 0.47 C ATOM 929 C ARG A 65 -2.851 -6.947 -11.633 1.00 0.50 C ATOM 930 O ARG A 65 -3.863 -7.589 -11.833 1.00 0.54 O ATOM 931 CB ARG A 65 -0.829 -7.417 -13.025 1.00 0.45 C ATOM 932 CG ARG A 65 -0.105 -7.083 -14.344 1.00 0.94 C ATOM 933 CD ARG A 65 -0.818 -7.744 -15.532 1.00 1.55 C ATOM 934 NE ARG A 65 -0.008 -7.542 -16.766 1.00 1.86 N ATOM 935 CZ ARG A 65 -0.251 -8.256 -17.831 1.00 2.39 C ATOM 936 NH1 ARG A 65 -1.206 -9.146 -17.817 1.00 2.94 N ATOM 937 NH2 ARG A 65 0.461 -8.081 -18.910 1.00 2.92 N ATOM 0 H ARG A 65 -0.427 -5.024 -12.463 1.00 0.43 H new ATOM 0 HA ARG A 65 -2.605 -6.380 -13.694 1.00 0.47 H new ATOM 0 HB2 ARG A 65 -0.128 -7.360 -12.192 1.00 0.45 H new ATOM 0 HB3 ARG A 65 -1.204 -8.440 -13.057 1.00 0.45 H new ATOM 0 HG2 ARG A 65 -0.075 -6.003 -14.486 1.00 0.94 H new ATOM 0 HG3 ARG A 65 0.928 -7.427 -14.296 1.00 0.94 H new ATOM 0 HD2 ARG A 65 -0.954 -8.809 -15.343 1.00 1.55 H new ATOM 0 HD3 ARG A 65 -1.811 -7.313 -15.660 1.00 1.55 H new ATOM 0 HE ARG A 65 0.737 -6.845 -16.778 1.00 1.86 H new ATOM 0 HH11 ARG A 65 -1.763 -9.284 -16.973 1.00 2.94 H new ATOM 0 HH12 ARG A 65 -1.396 -9.704 -18.650 1.00 2.94 H new ATOM 0 HH21 ARG A 65 1.208 -7.386 -18.921 1.00 2.92 H new ATOM 0 HH22 ARG A 65 0.271 -8.639 -19.742 1.00 2.92 H new ATOM 951 N ILE A 66 -2.461 -6.660 -10.422 1.00 0.49 N ATOM 952 CA ILE A 66 -3.260 -7.123 -9.249 1.00 0.53 C ATOM 953 C ILE A 66 -4.431 -6.158 -9.030 1.00 0.54 C ATOM 954 O ILE A 66 -5.498 -6.544 -8.599 1.00 0.60 O ATOM 955 CB ILE A 66 -2.354 -7.142 -8.009 1.00 0.52 C ATOM 956 CG1 ILE A 66 -1.375 -8.315 -8.110 1.00 1.22 C ATOM 957 CG2 ILE A 66 -3.194 -7.282 -6.734 1.00 1.29 C ATOM 958 CD1 ILE A 66 -0.267 -8.146 -7.069 1.00 1.25 C ATOM 0 H ILE A 66 -1.624 -6.125 -10.192 1.00 0.49 H new ATOM 0 HA ILE A 66 -3.650 -8.125 -9.427 1.00 0.53 H new ATOM 0 HB ILE A 66 -1.801 -6.204 -7.963 1.00 0.52 H new ATOM 0 HG12 ILE A 66 -1.901 -9.256 -7.948 1.00 1.22 H new ATOM 0 HG13 ILE A 66 -0.945 -8.358 -9.111 1.00 1.22 H new ATOM 0 HG21 ILE A 66 -2.537 -7.294 -5.865 1.00 1.29 H new ATOM 0 HG22 ILE A 66 -3.882 -6.440 -6.657 1.00 1.29 H new ATOM 0 HG23 ILE A 66 -3.761 -8.212 -6.772 1.00 1.29 H new ATOM 0 HD11 ILE A 66 0.430 -8.981 -7.141 1.00 1.25 H new ATOM 0 HD12 ILE A 66 0.265 -7.212 -7.252 1.00 1.25 H new ATOM 0 HD13 ILE A 66 -0.705 -8.124 -6.071 1.00 1.25 H new ATOM 970 N GLY A 67 -4.237 -4.909 -9.345 1.00 0.52 N ATOM 971 CA GLY A 67 -5.329 -3.909 -9.180 1.00 0.55 C ATOM 972 C GLY A 67 -6.526 -4.296 -10.050 1.00 0.53 C ATOM 973 O GLY A 67 -7.664 -4.084 -9.680 1.00 0.63 O ATOM 0 H GLY A 67 -3.362 -4.534 -9.713 1.00 0.52 H new ATOM 0 HA2 GLY A 67 -5.631 -3.857 -8.134 1.00 0.55 H new ATOM 0 HA3 GLY A 67 -4.971 -2.918 -9.459 1.00 0.55 H new ATOM 977 N ASP A 68 -6.287 -4.850 -11.206 1.00 0.54 N ATOM 978 CA ASP A 68 -7.421 -5.233 -12.098 1.00 0.54 C ATOM 979 C ASP A 68 -8.016 -6.573 -11.656 1.00 0.52 C ATOM 980 O ASP A 68 -9.218 -6.722 -11.553 1.00 0.56 O ATOM 981 CB ASP A 68 -6.914 -5.354 -13.537 1.00 0.60 C ATOM 982 CG ASP A 68 -8.082 -5.693 -14.464 1.00 1.43 C ATOM 983 OD1 ASP A 68 -9.070 -4.979 -14.424 1.00 2.20 O ATOM 984 OD2 ASP A 68 -7.969 -6.661 -15.198 1.00 2.12 O ATOM 0 H ASP A 68 -5.357 -5.055 -11.573 1.00 0.54 H new ATOM 0 HA ASP A 68 -8.193 -4.466 -12.039 1.00 0.54 H new ATOM 0 HB2 ASP A 68 -6.448 -4.419 -13.849 1.00 0.60 H new ATOM 0 HB3 ASP A 68 -6.149 -6.128 -13.600 1.00 0.60 H new ATOM 989 N GLU A 69 -7.192 -7.554 -11.408 1.00 0.56 N ATOM 990 CA GLU A 69 -7.725 -8.884 -10.990 1.00 0.56 C ATOM 991 C GLU A 69 -8.393 -8.761 -9.617 1.00 0.55 C ATOM 992 O GLU A 69 -9.544 -9.112 -9.444 1.00 0.73 O ATOM 993 CB GLU A 69 -6.570 -9.898 -10.923 1.00 0.61 C ATOM 994 CG GLU A 69 -7.104 -11.328 -11.070 1.00 0.84 C ATOM 995 CD GLU A 69 -8.209 -11.583 -10.043 1.00 1.65 C ATOM 996 OE1 GLU A 69 -7.905 -11.574 -8.861 1.00 2.48 O ATOM 997 OE2 GLU A 69 -9.339 -11.784 -10.455 1.00 2.23 O ATOM 0 H GLU A 69 -6.176 -7.494 -11.476 1.00 0.56 H new ATOM 0 HA GLU A 69 -8.463 -9.227 -11.715 1.00 0.56 H new ATOM 0 HB2 GLU A 69 -5.849 -9.690 -11.713 1.00 0.61 H new ATOM 0 HB3 GLU A 69 -6.043 -9.796 -9.975 1.00 0.61 H new ATOM 0 HG2 GLU A 69 -7.491 -11.478 -12.078 1.00 0.84 H new ATOM 0 HG3 GLU A 69 -6.294 -12.044 -10.930 1.00 0.84 H new ATOM 1004 N LEU A 70 -7.678 -8.294 -8.636 1.00 0.53 N ATOM 1005 CA LEU A 70 -8.272 -8.184 -7.275 1.00 0.52 C ATOM 1006 C LEU A 70 -9.567 -7.363 -7.332 1.00 0.54 C ATOM 1007 O LEU A 70 -10.530 -7.664 -6.656 1.00 0.60 O ATOM 1008 CB LEU A 70 -7.252 -7.513 -6.330 1.00 0.61 C ATOM 1009 CG LEU A 70 -7.369 -8.075 -4.906 1.00 0.70 C ATOM 1010 CD1 LEU A 70 -6.403 -7.319 -3.990 1.00 1.38 C ATOM 1011 CD2 LEU A 70 -8.799 -7.896 -4.383 1.00 1.61 C ATOM 0 H LEU A 70 -6.710 -7.984 -8.715 1.00 0.53 H new ATOM 0 HA LEU A 70 -8.511 -9.179 -6.899 1.00 0.52 H new ATOM 0 HB2 LEU A 70 -6.242 -7.674 -6.706 1.00 0.61 H new ATOM 0 HB3 LEU A 70 -7.419 -6.436 -6.315 1.00 0.61 H new ATOM 0 HG LEU A 70 -7.124 -9.137 -4.919 1.00 0.70 H new ATOM 0 HD11 LEU A 70 -6.480 -7.712 -2.976 1.00 1.38 H new ATOM 0 HD12 LEU A 70 -5.383 -7.447 -4.352 1.00 1.38 H new ATOM 0 HD13 LEU A 70 -6.657 -6.259 -3.988 1.00 1.38 H new ATOM 0 HD21 LEU A 70 -8.870 -8.298 -3.372 1.00 1.61 H new ATOM 0 HD22 LEU A 70 -9.052 -6.836 -4.370 1.00 1.61 H new ATOM 0 HD23 LEU A 70 -9.494 -8.427 -5.034 1.00 1.61 H new ATOM 1023 N ASP A 71 -9.599 -6.316 -8.112 1.00 0.67 N ATOM 1024 CA ASP A 71 -10.836 -5.486 -8.165 1.00 0.91 C ATOM 1025 C ASP A 71 -12.016 -6.332 -8.664 1.00 1.02 C ATOM 1026 O ASP A 71 -13.140 -5.869 -8.684 1.00 1.29 O ATOM 1027 CB ASP A 71 -10.617 -4.279 -9.082 1.00 1.09 C ATOM 1028 CG ASP A 71 -11.933 -3.518 -9.265 1.00 1.66 C ATOM 1029 OD1 ASP A 71 -12.614 -3.305 -8.276 1.00 2.36 O ATOM 1030 OD2 ASP A 71 -12.235 -3.160 -10.392 1.00 2.25 O ATOM 0 H ASP A 71 -8.833 -6.003 -8.708 1.00 0.67 H new ATOM 0 HA ASP A 71 -11.067 -5.125 -7.163 1.00 0.91 H new ATOM 0 HB2 ASP A 71 -9.862 -3.619 -8.655 1.00 1.09 H new ATOM 0 HB3 ASP A 71 -10.241 -4.610 -10.050 1.00 1.09 H new ATOM 1035 N SER A 72 -11.783 -7.571 -9.041 1.00 0.90 N ATOM 1036 CA SER A 72 -12.907 -8.448 -9.511 1.00 1.20 C ATOM 1037 C SER A 72 -13.162 -9.509 -8.440 1.00 0.98 C ATOM 1038 O SER A 72 -12.935 -10.688 -8.633 1.00 1.02 O ATOM 1039 CB SER A 72 -12.553 -9.108 -10.844 1.00 1.57 C ATOM 1040 OG SER A 72 -11.589 -10.129 -10.620 1.00 2.09 O ATOM 0 H SER A 72 -10.863 -8.012 -9.043 1.00 0.90 H new ATOM 0 HA SER A 72 -13.805 -7.850 -9.667 1.00 1.20 H new ATOM 0 HB2 SER A 72 -13.447 -9.530 -11.303 1.00 1.57 H new ATOM 0 HB3 SER A 72 -12.159 -8.365 -11.538 1.00 1.57 H new ATOM 0 HG SER A 72 -10.712 -9.722 -10.461 1.00 2.09 H new ATOM 1046 N ASN A 73 -13.640 -9.070 -7.309 1.00 0.92 N ATOM 1047 CA ASN A 73 -13.939 -10.000 -6.179 1.00 0.83 C ATOM 1048 C ASN A 73 -15.248 -9.585 -5.500 1.00 0.75 C ATOM 1049 O ASN A 73 -15.247 -9.037 -4.417 1.00 1.07 O ATOM 1050 CB ASN A 73 -12.801 -9.933 -5.157 1.00 0.91 C ATOM 1051 CG ASN A 73 -11.557 -10.613 -5.731 1.00 1.43 C ATOM 1052 OD1 ASN A 73 -11.077 -10.240 -6.783 1.00 2.29 O ATOM 1053 ND2 ASN A 73 -11.011 -11.604 -5.080 1.00 1.90 N ATOM 0 H ASN A 73 -13.840 -8.089 -7.115 1.00 0.92 H new ATOM 0 HA ASN A 73 -14.035 -11.016 -6.563 1.00 0.83 H new ATOM 0 HB2 ASN A 73 -12.580 -8.894 -4.911 1.00 0.91 H new ATOM 0 HB3 ASN A 73 -13.101 -10.423 -4.231 1.00 0.91 H new ATOM 0 HD21 ASN A 73 -10.182 -12.065 -5.455 1.00 1.90 H new ATOM 0 HD22 ASN A 73 -11.414 -11.917 -4.197 1.00 1.90 H new ATOM 1060 N MET A 74 -16.363 -9.818 -6.152 1.00 0.71 N ATOM 1061 CA MET A 74 -17.688 -9.423 -5.577 1.00 0.67 C ATOM 1062 C MET A 74 -17.747 -9.710 -4.072 1.00 0.67 C ATOM 1063 O MET A 74 -18.543 -9.145 -3.353 1.00 0.71 O ATOM 1064 CB MET A 74 -18.817 -10.182 -6.285 1.00 0.75 C ATOM 1065 CG MET A 74 -18.551 -10.231 -7.791 1.00 1.20 C ATOM 1066 SD MET A 74 -18.216 -8.563 -8.405 1.00 1.92 S ATOM 1067 CE MET A 74 -17.704 -9.039 -10.074 1.00 1.96 C ATOM 0 H MET A 74 -16.411 -10.269 -7.066 1.00 0.71 H new ATOM 0 HA MET A 74 -17.813 -8.351 -5.731 1.00 0.67 H new ATOM 0 HB2 MET A 74 -18.891 -11.194 -5.887 1.00 0.75 H new ATOM 0 HB3 MET A 74 -19.772 -9.693 -6.092 1.00 0.75 H new ATOM 0 HG2 MET A 74 -17.703 -10.883 -7.999 1.00 1.20 H new ATOM 0 HG3 MET A 74 -19.412 -10.653 -8.309 1.00 1.20 H new ATOM 0 HE1 MET A 74 -17.445 -8.146 -10.644 1.00 1.96 H new ATOM 0 HE2 MET A 74 -16.836 -9.696 -10.015 1.00 1.96 H new ATOM 0 HE3 MET A 74 -18.522 -9.562 -10.570 1.00 1.96 H new ATOM 1077 N GLU A 75 -16.899 -10.571 -3.589 1.00 0.70 N ATOM 1078 CA GLU A 75 -16.888 -10.879 -2.135 1.00 0.75 C ATOM 1079 C GLU A 75 -16.177 -9.746 -1.390 1.00 0.73 C ATOM 1080 O GLU A 75 -16.612 -9.310 -0.341 1.00 0.78 O ATOM 1081 CB GLU A 75 -16.136 -12.194 -1.907 1.00 0.87 C ATOM 1082 CG GLU A 75 -16.348 -12.662 -0.469 1.00 1.15 C ATOM 1083 CD GLU A 75 -15.574 -13.961 -0.234 1.00 1.70 C ATOM 1084 OE1 GLU A 75 -14.362 -13.893 -0.114 1.00 2.21 O ATOM 1085 OE2 GLU A 75 -16.207 -15.003 -0.178 1.00 2.29 O ATOM 0 H GLU A 75 -16.209 -11.078 -4.143 1.00 0.70 H new ATOM 0 HA GLU A 75 -17.909 -10.975 -1.766 1.00 0.75 H new ATOM 0 HB2 GLU A 75 -16.491 -12.953 -2.603 1.00 0.87 H new ATOM 0 HB3 GLU A 75 -15.073 -12.055 -2.102 1.00 0.87 H new ATOM 0 HG2 GLU A 75 -16.011 -11.894 0.228 1.00 1.15 H new ATOM 0 HG3 GLU A 75 -17.410 -12.820 -0.280 1.00 1.15 H new ATOM 1092 N LEU A 76 -15.088 -9.262 -1.922 1.00 0.74 N ATOM 1093 CA LEU A 76 -14.350 -8.159 -1.240 1.00 0.80 C ATOM 1094 C LEU A 76 -14.925 -6.799 -1.646 1.00 0.75 C ATOM 1095 O LEU A 76 -14.845 -5.838 -0.910 1.00 0.81 O ATOM 1096 CB LEU A 76 -12.873 -8.220 -1.626 1.00 0.92 C ATOM 1097 CG LEU A 76 -12.062 -7.234 -0.772 1.00 1.00 C ATOM 1098 CD1 LEU A 76 -12.010 -7.697 0.698 1.00 1.57 C ATOM 1099 CD2 LEU A 76 -10.644 -7.145 -1.345 1.00 1.51 C ATOM 0 H LEU A 76 -14.677 -9.582 -2.799 1.00 0.74 H new ATOM 0 HA LEU A 76 -14.457 -8.279 -0.162 1.00 0.80 H new ATOM 0 HB2 LEU A 76 -12.494 -9.232 -1.485 1.00 0.92 H new ATOM 0 HB3 LEU A 76 -12.755 -7.980 -2.683 1.00 0.92 H new ATOM 0 HG LEU A 76 -12.540 -6.255 -0.798 1.00 1.00 H new ATOM 0 HD11 LEU A 76 -11.431 -6.984 1.284 1.00 1.57 H new ATOM 0 HD12 LEU A 76 -13.023 -7.756 1.097 1.00 1.57 H new ATOM 0 HD13 LEU A 76 -11.540 -8.679 0.754 1.00 1.57 H new ATOM 0 HD21 LEU A 76 -10.054 -6.448 -0.750 1.00 1.51 H new ATOM 0 HD22 LEU A 76 -10.178 -8.130 -1.318 1.00 1.51 H new ATOM 0 HD23 LEU A 76 -10.689 -6.793 -2.376 1.00 1.51 H new ATOM 1111 N GLN A 77 -15.522 -6.714 -2.803 1.00 0.76 N ATOM 1112 CA GLN A 77 -16.113 -5.416 -3.236 1.00 0.74 C ATOM 1113 C GLN A 77 -17.440 -5.207 -2.504 1.00 0.71 C ATOM 1114 O GLN A 77 -17.778 -4.103 -2.118 1.00 0.72 O ATOM 1115 CB GLN A 77 -16.352 -5.423 -4.749 1.00 0.71 C ATOM 1116 CG GLN A 77 -15.031 -5.669 -5.481 1.00 1.26 C ATOM 1117 CD GLN A 77 -14.142 -4.430 -5.361 1.00 1.59 C ATOM 1118 OE1 GLN A 77 -13.066 -4.493 -4.801 1.00 2.35 O ATOM 1119 NE2 GLN A 77 -14.548 -3.298 -5.867 1.00 2.03 N ATOM 0 H GLN A 77 -15.626 -7.483 -3.465 1.00 0.76 H new ATOM 0 HA GLN A 77 -15.425 -4.605 -2.996 1.00 0.74 H new ATOM 0 HB2 GLN A 77 -17.072 -6.199 -5.009 1.00 0.71 H new ATOM 0 HB3 GLN A 77 -16.781 -4.471 -5.063 1.00 0.71 H new ATOM 0 HG2 GLN A 77 -14.524 -6.536 -5.057 1.00 1.26 H new ATOM 0 HG3 GLN A 77 -15.221 -5.893 -6.531 1.00 1.26 H new ATOM 0 HE21 GLN A 77 -15.451 -3.244 -6.337 1.00 2.03 H new ATOM 0 HE22 GLN A 77 -13.962 -2.467 -5.792 1.00 2.03 H new ATOM 1128 N ARG A 78 -18.191 -6.249 -2.295 1.00 0.72 N ATOM 1129 CA ARG A 78 -19.483 -6.083 -1.579 1.00 0.73 C ATOM 1130 C ARG A 78 -19.206 -5.824 -0.092 1.00 0.75 C ATOM 1131 O ARG A 78 -19.957 -5.149 0.582 1.00 0.79 O ATOM 1132 CB ARG A 78 -20.333 -7.353 -1.762 1.00 0.74 C ATOM 1133 CG ARG A 78 -19.825 -8.493 -0.850 1.00 0.94 C ATOM 1134 CD ARG A 78 -20.574 -8.513 0.508 1.00 1.23 C ATOM 1135 NE ARG A 78 -21.322 -7.241 0.726 1.00 1.80 N ATOM 1136 CZ ARG A 78 -22.255 -7.181 1.636 1.00 2.50 C ATOM 1137 NH1 ARG A 78 -22.535 -8.234 2.354 1.00 2.83 N ATOM 1138 NH2 ARG A 78 -22.913 -6.070 1.822 1.00 3.41 N ATOM 0 H ARG A 78 -17.969 -7.201 -2.586 1.00 0.72 H new ATOM 0 HA ARG A 78 -20.033 -5.234 -1.986 1.00 0.73 H new ATOM 0 HB2 ARG A 78 -21.375 -7.134 -1.531 1.00 0.74 H new ATOM 0 HB3 ARG A 78 -20.298 -7.672 -2.804 1.00 0.74 H new ATOM 0 HG2 ARG A 78 -19.958 -9.450 -1.354 1.00 0.94 H new ATOM 0 HG3 ARG A 78 -18.756 -8.371 -0.675 1.00 0.94 H new ATOM 0 HD2 ARG A 78 -21.266 -9.355 0.533 1.00 1.23 H new ATOM 0 HD3 ARG A 78 -19.861 -8.663 1.318 1.00 1.23 H new ATOM 0 HE ARG A 78 -21.104 -6.418 0.164 1.00 1.80 H new ATOM 0 HH11 ARG A 78 -22.024 -9.104 2.204 1.00 2.83 H new ATOM 0 HH12 ARG A 78 -23.264 -8.187 3.065 1.00 2.83 H new ATOM 0 HH21 ARG A 78 -22.698 -5.249 1.256 1.00 3.41 H new ATOM 0 HH22 ARG A 78 -23.643 -6.022 2.533 1.00 3.41 H new ATOM 1152 N MET A 79 -18.132 -6.366 0.430 1.00 0.75 N ATOM 1153 CA MET A 79 -17.813 -6.159 1.868 1.00 0.77 C ATOM 1154 C MET A 79 -17.393 -4.701 2.086 1.00 0.77 C ATOM 1155 O MET A 79 -17.896 -4.025 2.960 1.00 0.78 O ATOM 1156 CB MET A 79 -16.668 -7.111 2.267 1.00 0.81 C ATOM 1157 CG MET A 79 -16.826 -7.538 3.728 1.00 1.08 C ATOM 1158 SD MET A 79 -15.359 -8.454 4.255 1.00 1.07 S ATOM 1159 CE MET A 79 -15.825 -8.601 5.994 1.00 0.81 C ATOM 0 H MET A 79 -17.465 -6.943 -0.083 1.00 0.75 H new ATOM 0 HA MET A 79 -18.687 -6.371 2.484 1.00 0.77 H new ATOM 0 HB2 MET A 79 -16.672 -7.989 1.621 1.00 0.81 H new ATOM 0 HB3 MET A 79 -15.707 -6.616 2.126 1.00 0.81 H new ATOM 0 HG2 MET A 79 -16.966 -6.661 4.360 1.00 1.08 H new ATOM 0 HG3 MET A 79 -17.715 -8.159 3.842 1.00 1.08 H new ATOM 0 HE1 MET A 79 -15.050 -9.145 6.534 1.00 0.81 H new ATOM 0 HE2 MET A 79 -15.938 -7.607 6.426 1.00 0.81 H new ATOM 0 HE3 MET A 79 -16.769 -9.140 6.073 1.00 0.81 H new ATOM 1169 N ILE A 80 -16.482 -4.211 1.288 1.00 0.77 N ATOM 1170 CA ILE A 80 -16.046 -2.797 1.445 1.00 0.80 C ATOM 1171 C ILE A 80 -17.283 -1.901 1.399 1.00 0.80 C ATOM 1172 O ILE A 80 -17.325 -0.845 1.999 1.00 0.83 O ATOM 1173 CB ILE A 80 -15.087 -2.424 0.311 1.00 0.82 C ATOM 1174 CG1 ILE A 80 -13.796 -3.238 0.451 1.00 0.84 C ATOM 1175 CG2 ILE A 80 -14.754 -0.932 0.386 1.00 0.89 C ATOM 1176 CD1 ILE A 80 -12.984 -3.137 -0.842 1.00 1.10 C ATOM 0 H ILE A 80 -16.024 -4.728 0.538 1.00 0.77 H new ATOM 0 HA ILE A 80 -15.529 -2.666 2.396 1.00 0.80 H new ATOM 0 HB ILE A 80 -15.559 -2.642 -0.647 1.00 0.82 H new ATOM 0 HG12 ILE A 80 -13.209 -2.867 1.291 1.00 0.84 H new ATOM 0 HG13 ILE A 80 -14.033 -4.281 0.664 1.00 0.84 H new ATOM 0 HG21 ILE A 80 -14.071 -0.670 -0.423 1.00 0.89 H new ATOM 0 HG22 ILE A 80 -15.670 -0.349 0.290 1.00 0.89 H new ATOM 0 HG23 ILE A 80 -14.283 -0.712 1.344 1.00 0.89 H new ATOM 0 HD11 ILE A 80 -12.066 -3.716 -0.741 1.00 1.10 H new ATOM 0 HD12 ILE A 80 -13.571 -3.529 -1.672 1.00 1.10 H new ATOM 0 HD13 ILE A 80 -12.735 -2.093 -1.035 1.00 1.10 H new ATOM 1188 N ALA A 81 -18.300 -2.328 0.699 1.00 0.78 N ATOM 1189 CA ALA A 81 -19.546 -1.518 0.623 1.00 0.80 C ATOM 1190 C ALA A 81 -20.283 -1.618 1.961 1.00 0.81 C ATOM 1191 O ALA A 81 -21.107 -0.789 2.293 1.00 0.85 O ATOM 1192 CB ALA A 81 -20.435 -2.052 -0.504 1.00 0.79 C ATOM 0 H ALA A 81 -18.320 -3.204 0.177 1.00 0.78 H new ATOM 0 HA ALA A 81 -19.302 -0.476 0.417 1.00 0.80 H new ATOM 0 HB1 ALA A 81 -21.348 -1.459 -0.560 1.00 0.79 H new ATOM 0 HB2 ALA A 81 -19.901 -1.985 -1.452 1.00 0.79 H new ATOM 0 HB3 ALA A 81 -20.690 -3.093 -0.304 1.00 0.79 H new ATOM 1198 N ALA A 82 -19.981 -2.623 2.737 1.00 0.78 N ATOM 1199 CA ALA A 82 -20.646 -2.779 4.062 1.00 0.80 C ATOM 1200 C ALA A 82 -19.936 -1.898 5.093 1.00 0.79 C ATOM 1201 O ALA A 82 -20.453 -1.638 6.160 1.00 0.83 O ATOM 1202 CB ALA A 82 -20.565 -4.240 4.507 1.00 0.87 C ATOM 0 H ALA A 82 -19.299 -3.346 2.509 1.00 0.78 H new ATOM 0 HA ALA A 82 -21.691 -2.480 3.980 1.00 0.80 H new ATOM 0 HB1 ALA A 82 -21.052 -4.353 5.476 1.00 0.87 H new ATOM 0 HB2 ALA A 82 -21.066 -4.872 3.774 1.00 0.87 H new ATOM 0 HB3 ALA A 82 -19.520 -4.538 4.589 1.00 0.87 H new ATOM 1208 N VAL A 83 -18.767 -1.410 4.774 1.00 0.80 N ATOM 1209 CA VAL A 83 -18.036 -0.523 5.726 1.00 0.85 C ATOM 1210 C VAL A 83 -18.490 0.918 5.492 1.00 0.99 C ATOM 1211 O VAL A 83 -17.967 1.625 4.653 1.00 1.36 O ATOM 1212 CB VAL A 83 -16.527 -0.635 5.483 1.00 0.97 C ATOM 1213 CG1 VAL A 83 -15.769 0.131 6.568 1.00 1.81 C ATOM 1214 CG2 VAL A 83 -16.110 -2.107 5.515 1.00 1.40 C ATOM 0 H VAL A 83 -18.285 -1.588 3.893 1.00 0.80 H new ATOM 0 HA VAL A 83 -18.250 -0.820 6.753 1.00 0.85 H new ATOM 0 HB VAL A 83 -16.290 -0.210 4.508 1.00 0.97 H new ATOM 0 HG11 VAL A 83 -14.697 0.048 6.390 1.00 1.81 H new ATOM 0 HG12 VAL A 83 -16.061 1.181 6.543 1.00 1.81 H new ATOM 0 HG13 VAL A 83 -16.009 -0.289 7.545 1.00 1.81 H new ATOM 0 HG21 VAL A 83 -15.037 -2.185 5.342 1.00 1.40 H new ATOM 0 HG22 VAL A 83 -16.352 -2.533 6.489 1.00 1.40 H new ATOM 0 HG23 VAL A 83 -16.643 -2.653 4.737 1.00 1.40 H new ATOM 1224 N ASP A 84 -19.462 1.353 6.249 1.00 1.46 N ATOM 1225 CA ASP A 84 -19.968 2.745 6.104 1.00 1.71 C ATOM 1226 C ASP A 84 -18.809 3.722 6.299 1.00 1.39 C ATOM 1227 O ASP A 84 -17.950 3.523 7.135 1.00 1.80 O ATOM 1228 CB ASP A 84 -21.042 3.006 7.164 1.00 2.38 C ATOM 1229 CG ASP A 84 -21.566 4.436 7.021 1.00 2.99 C ATOM 1230 OD1 ASP A 84 -22.351 4.671 6.117 1.00 3.57 O ATOM 1231 OD2 ASP A 84 -21.175 5.271 7.819 1.00 3.45 O ATOM 0 H ASP A 84 -19.929 0.798 6.966 1.00 1.46 H new ATOM 0 HA ASP A 84 -20.398 2.881 5.112 1.00 1.71 H new ATOM 0 HB2 ASP A 84 -21.860 2.295 7.050 1.00 2.38 H new ATOM 0 HB3 ASP A 84 -20.627 2.858 8.161 1.00 2.38 H new ATOM 1236 N THR A 85 -18.768 4.769 5.524 1.00 1.68 N ATOM 1237 CA THR A 85 -17.653 5.747 5.654 1.00 1.97 C ATOM 1238 C THR A 85 -17.848 6.611 6.903 1.00 1.67 C ATOM 1239 O THR A 85 -18.871 7.240 7.084 1.00 2.28 O ATOM 1240 CB THR A 85 -17.614 6.647 4.415 1.00 3.20 C ATOM 1241 OG1 THR A 85 -16.913 7.843 4.723 1.00 3.80 O ATOM 1242 CG2 THR A 85 -19.041 6.989 3.979 1.00 3.87 C ATOM 0 H THR A 85 -19.458 4.990 4.806 1.00 1.68 H new ATOM 0 HA THR A 85 -16.714 5.201 5.743 1.00 1.97 H new ATOM 0 HB THR A 85 -17.106 6.124 3.605 1.00 3.20 H new ATOM 0 HG1 THR A 85 -16.886 8.419 3.931 1.00 3.80 H new ATOM 0 HG21 THR A 85 -19.009 7.629 3.097 1.00 3.87 H new ATOM 0 HG22 THR A 85 -19.579 6.071 3.741 1.00 3.87 H new ATOM 0 HG23 THR A 85 -19.553 7.510 4.787 1.00 3.87 H new ATOM 1250 N ASP A 86 -16.857 6.658 7.756 1.00 1.51 N ATOM 1251 CA ASP A 86 -16.941 7.483 8.980 1.00 1.98 C ATOM 1252 C ASP A 86 -15.549 8.048 9.242 1.00 1.78 C ATOM 1253 O ASP A 86 -14.753 8.170 8.339 1.00 2.48 O ATOM 1254 CB ASP A 86 -17.384 6.617 10.162 1.00 2.56 C ATOM 1255 CG ASP A 86 -16.384 5.478 10.362 1.00 3.06 C ATOM 1256 OD1 ASP A 86 -16.519 4.472 9.685 1.00 3.50 O ATOM 1257 OD2 ASP A 86 -15.500 5.630 11.188 1.00 3.57 O ATOM 0 H ASP A 86 -15.981 6.147 7.646 1.00 1.51 H new ATOM 0 HA ASP A 86 -17.667 8.287 8.856 1.00 1.98 H new ATOM 0 HB2 ASP A 86 -17.448 7.222 11.066 1.00 2.56 H new ATOM 0 HB3 ASP A 86 -18.380 6.213 9.978 1.00 2.56 H new ATOM 1262 N SER A 87 -15.250 8.362 10.462 1.00 1.11 N ATOM 1263 CA SER A 87 -13.899 8.911 10.810 1.00 0.93 C ATOM 1264 C SER A 87 -12.799 8.063 10.130 1.00 0.84 C ATOM 1265 O SER A 87 -12.530 6.969 10.585 1.00 0.97 O ATOM 1266 CB SER A 87 -13.718 8.835 12.329 1.00 0.88 C ATOM 1267 OG SER A 87 -14.227 7.594 12.799 1.00 1.63 O ATOM 0 H SER A 87 -15.887 8.264 11.253 1.00 1.11 H new ATOM 0 HA SER A 87 -13.822 9.943 10.468 1.00 0.93 H new ATOM 0 HB2 SER A 87 -12.663 8.930 12.587 1.00 0.88 H new ATOM 0 HB3 SER A 87 -14.240 9.662 12.811 1.00 0.88 H new ATOM 0 HG SER A 87 -13.989 6.883 12.168 1.00 1.63 H new ATOM 1273 N PRO A 88 -12.189 8.556 9.060 1.00 0.77 N ATOM 1274 CA PRO A 88 -11.140 7.784 8.364 1.00 0.83 C ATOM 1275 C PRO A 88 -9.830 7.790 9.172 1.00 0.73 C ATOM 1276 O PRO A 88 -8.975 6.949 8.974 1.00 0.72 O ATOM 1277 CB PRO A 88 -10.944 8.517 7.017 1.00 1.01 C ATOM 1278 CG PRO A 88 -11.698 9.874 7.114 1.00 1.07 C ATOM 1279 CD PRO A 88 -12.475 9.879 8.449 1.00 0.83 C ATOM 0 HA PRO A 88 -11.419 6.739 8.233 1.00 0.83 H new ATOM 0 HB2 PRO A 88 -9.885 8.680 6.819 1.00 1.01 H new ATOM 0 HB3 PRO A 88 -11.334 7.919 6.194 1.00 1.01 H new ATOM 0 HG2 PRO A 88 -10.995 10.707 7.076 1.00 1.07 H new ATOM 0 HG3 PRO A 88 -12.380 9.994 6.273 1.00 1.07 H new ATOM 0 HD2 PRO A 88 -12.146 10.693 9.095 1.00 0.83 H new ATOM 0 HD3 PRO A 88 -13.544 10.016 8.284 1.00 0.83 H new ATOM 1287 N ARG A 89 -9.647 8.738 10.055 1.00 0.75 N ATOM 1288 CA ARG A 89 -8.370 8.788 10.828 1.00 0.73 C ATOM 1289 C ARG A 89 -8.352 7.705 11.912 1.00 0.67 C ATOM 1290 O ARG A 89 -7.386 6.981 12.051 1.00 0.68 O ATOM 1291 CB ARG A 89 -8.220 10.170 11.465 1.00 0.79 C ATOM 1292 CG ARG A 89 -6.858 10.286 12.152 1.00 1.63 C ATOM 1293 CD ARG A 89 -6.648 11.731 12.608 1.00 1.65 C ATOM 1294 NE ARG A 89 -7.766 12.131 13.510 1.00 2.07 N ATOM 1295 CZ ARG A 89 -7.672 13.216 14.228 1.00 2.47 C ATOM 1296 NH1 ARG A 89 -6.606 13.965 14.144 1.00 2.69 N ATOM 1297 NH2 ARG A 89 -8.646 13.556 15.027 1.00 3.10 N ATOM 0 H ARG A 89 -10.320 9.473 10.273 1.00 0.75 H new ATOM 0 HA ARG A 89 -7.537 8.605 10.150 1.00 0.73 H new ATOM 0 HB2 ARG A 89 -8.319 10.943 10.703 1.00 0.79 H new ATOM 0 HB3 ARG A 89 -9.017 10.333 12.190 1.00 0.79 H new ATOM 0 HG2 ARG A 89 -6.809 9.611 13.007 1.00 1.63 H new ATOM 0 HG3 ARG A 89 -6.065 9.989 11.466 1.00 1.63 H new ATOM 0 HD2 ARG A 89 -5.695 11.825 13.128 1.00 1.65 H new ATOM 0 HD3 ARG A 89 -6.607 12.395 11.744 1.00 1.65 H new ATOM 0 HE ARG A 89 -8.606 11.555 13.566 1.00 2.07 H new ATOM 0 HH11 ARG A 89 -5.846 13.702 13.517 1.00 2.69 H new ATOM 0 HH12 ARG A 89 -6.533 14.813 14.706 1.00 2.69 H new ATOM 0 HH21 ARG A 89 -9.481 12.973 15.090 1.00 3.10 H new ATOM 0 HH22 ARG A 89 -8.573 14.404 15.588 1.00 3.10 H new ATOM 1311 N GLU A 90 -9.401 7.577 12.681 1.00 0.65 N ATOM 1312 CA GLU A 90 -9.401 6.525 13.739 1.00 0.65 C ATOM 1313 C GLU A 90 -9.402 5.153 13.060 1.00 0.64 C ATOM 1314 O GLU A 90 -8.788 4.216 13.532 1.00 0.67 O ATOM 1315 CB GLU A 90 -10.633 6.690 14.651 1.00 0.71 C ATOM 1316 CG GLU A 90 -11.902 6.133 13.987 1.00 1.32 C ATOM 1317 CD GLU A 90 -13.111 6.445 14.871 1.00 2.02 C ATOM 1318 OE1 GLU A 90 -13.282 7.600 15.223 1.00 2.46 O ATOM 1319 OE2 GLU A 90 -13.846 5.521 15.183 1.00 2.78 O ATOM 0 H GLU A 90 -10.246 8.146 12.624 1.00 0.65 H new ATOM 0 HA GLU A 90 -8.512 6.619 14.363 1.00 0.65 H new ATOM 0 HB2 GLU A 90 -10.459 6.175 15.596 1.00 0.71 H new ATOM 0 HB3 GLU A 90 -10.776 7.745 14.884 1.00 0.71 H new ATOM 0 HG2 GLU A 90 -12.034 6.576 13.000 1.00 1.32 H new ATOM 0 HG3 GLU A 90 -11.809 5.056 13.844 1.00 1.32 H new ATOM 1326 N VAL A 91 -10.099 5.025 11.965 1.00 0.64 N ATOM 1327 CA VAL A 91 -10.156 3.714 11.260 1.00 0.67 C ATOM 1328 C VAL A 91 -8.815 3.437 10.575 1.00 0.66 C ATOM 1329 O VAL A 91 -8.262 2.361 10.682 1.00 0.67 O ATOM 1330 CB VAL A 91 -11.276 3.754 10.217 1.00 0.71 C ATOM 1331 CG1 VAL A 91 -11.258 2.470 9.385 1.00 0.80 C ATOM 1332 CG2 VAL A 91 -12.625 3.880 10.930 1.00 0.75 C ATOM 0 H VAL A 91 -10.634 5.775 11.527 1.00 0.64 H new ATOM 0 HA VAL A 91 -10.356 2.919 11.978 1.00 0.67 H new ATOM 0 HB VAL A 91 -11.126 4.609 9.558 1.00 0.71 H new ATOM 0 HG11 VAL A 91 -12.057 2.505 8.645 1.00 0.80 H new ATOM 0 HG12 VAL A 91 -10.298 2.379 8.878 1.00 0.80 H new ATOM 0 HG13 VAL A 91 -11.406 1.611 10.039 1.00 0.80 H new ATOM 0 HG21 VAL A 91 -13.426 3.909 10.191 1.00 0.75 H new ATOM 0 HG22 VAL A 91 -12.770 3.024 11.589 1.00 0.75 H new ATOM 0 HG23 VAL A 91 -12.641 4.797 11.519 1.00 0.75 H new ATOM 1342 N PHE A 92 -8.291 4.400 9.872 1.00 0.64 N ATOM 1343 CA PHE A 92 -6.988 4.199 9.177 1.00 0.65 C ATOM 1344 C PHE A 92 -5.935 3.671 10.159 1.00 0.62 C ATOM 1345 O PHE A 92 -5.238 2.718 9.869 1.00 0.67 O ATOM 1346 CB PHE A 92 -6.510 5.531 8.591 1.00 0.65 C ATOM 1347 CG PHE A 92 -5.136 5.355 7.984 1.00 0.65 C ATOM 1348 CD1 PHE A 92 -5.005 4.962 6.646 1.00 1.31 C ATOM 1349 CD2 PHE A 92 -3.994 5.580 8.761 1.00 1.44 C ATOM 1350 CE1 PHE A 92 -3.732 4.796 6.086 1.00 1.31 C ATOM 1351 CE2 PHE A 92 -2.722 5.414 8.202 1.00 1.47 C ATOM 1352 CZ PHE A 92 -2.591 5.022 6.865 1.00 0.73 C ATOM 0 H PHE A 92 -8.710 5.322 9.748 1.00 0.64 H new ATOM 0 HA PHE A 92 -7.125 3.470 8.378 1.00 0.65 H new ATOM 0 HB2 PHE A 92 -7.212 5.879 7.833 1.00 0.65 H new ATOM 0 HB3 PHE A 92 -6.479 6.292 9.370 1.00 0.65 H new ATOM 0 HD1 PHE A 92 -5.886 4.787 6.046 1.00 1.31 H new ATOM 0 HD2 PHE A 92 -4.095 5.882 9.793 1.00 1.44 H new ATOM 0 HE1 PHE A 92 -3.631 4.494 5.054 1.00 1.31 H new ATOM 0 HE2 PHE A 92 -1.841 5.588 8.802 1.00 1.47 H new ATOM 0 HZ PHE A 92 -1.609 4.894 6.434 1.00 0.73 H new ATOM 1362 N PHE A 93 -5.789 4.280 11.306 1.00 0.58 N ATOM 1363 CA PHE A 93 -4.750 3.793 12.263 1.00 0.57 C ATOM 1364 C PHE A 93 -5.205 2.473 12.894 1.00 0.59 C ATOM 1365 O PHE A 93 -4.397 1.632 13.235 1.00 0.60 O ATOM 1366 CB PHE A 93 -4.512 4.847 13.346 1.00 0.57 C ATOM 1367 CG PHE A 93 -3.264 4.510 14.127 1.00 0.56 C ATOM 1368 CD1 PHE A 93 -2.006 4.844 13.612 1.00 1.15 C ATOM 1369 CD2 PHE A 93 -3.365 3.870 15.369 1.00 1.47 C ATOM 1370 CE1 PHE A 93 -0.849 4.538 14.338 1.00 1.07 C ATOM 1371 CE2 PHE A 93 -2.207 3.565 16.095 1.00 1.58 C ATOM 1372 CZ PHE A 93 -0.949 3.899 15.579 1.00 0.70 C ATOM 0 H PHE A 93 -6.335 5.082 11.620 1.00 0.58 H new ATOM 0 HA PHE A 93 -3.816 3.622 11.728 1.00 0.57 H new ATOM 0 HB2 PHE A 93 -4.411 5.832 12.891 1.00 0.57 H new ATOM 0 HB3 PHE A 93 -5.370 4.892 14.017 1.00 0.57 H new ATOM 0 HD1 PHE A 93 -1.928 5.338 12.655 1.00 1.15 H new ATOM 0 HD2 PHE A 93 -4.335 3.612 15.766 1.00 1.47 H new ATOM 0 HE1 PHE A 93 0.122 4.795 13.940 1.00 1.07 H new ATOM 0 HE2 PHE A 93 -2.284 3.072 17.053 1.00 1.58 H new ATOM 0 HZ PHE A 93 -0.056 3.664 16.139 1.00 0.70 H new ATOM 1382 N ARG A 94 -6.485 2.277 13.048 1.00 0.62 N ATOM 1383 CA ARG A 94 -6.970 1.002 13.650 1.00 0.67 C ATOM 1384 C ARG A 94 -6.741 -0.144 12.662 1.00 0.66 C ATOM 1385 O ARG A 94 -6.102 -1.125 12.988 1.00 0.67 O ATOM 1386 CB ARG A 94 -8.463 1.119 13.983 1.00 0.72 C ATOM 1387 CG ARG A 94 -9.033 -0.241 14.420 1.00 0.89 C ATOM 1388 CD ARG A 94 -8.222 -0.810 15.588 1.00 1.00 C ATOM 1389 NE ARG A 94 -9.029 -1.857 16.278 1.00 1.95 N ATOM 1390 CZ ARG A 94 -8.460 -2.670 17.125 1.00 2.64 C ATOM 1391 NH1 ARG A 94 -7.188 -2.551 17.391 1.00 2.76 N ATOM 1392 NH2 ARG A 94 -9.164 -3.600 17.710 1.00 3.65 N ATOM 0 H ARG A 94 -7.214 2.940 12.785 1.00 0.62 H new ATOM 0 HA ARG A 94 -6.420 0.800 14.569 1.00 0.67 H new ATOM 0 HB2 ARG A 94 -8.607 1.851 14.778 1.00 0.72 H new ATOM 0 HB3 ARG A 94 -9.007 1.484 13.112 1.00 0.72 H new ATOM 0 HG2 ARG A 94 -10.076 -0.127 14.715 1.00 0.89 H new ATOM 0 HG3 ARG A 94 -9.013 -0.937 13.582 1.00 0.89 H new ATOM 0 HD2 ARG A 94 -7.287 -1.235 15.224 1.00 1.00 H new ATOM 0 HD3 ARG A 94 -7.961 -0.015 16.287 1.00 1.00 H new ATOM 0 HE ARG A 94 -10.028 -1.938 16.087 1.00 1.95 H new ATOM 0 HH11 ARG A 94 -6.638 -1.822 16.937 1.00 2.76 H new ATOM 0 HH12 ARG A 94 -6.744 -3.187 18.053 1.00 2.76 H new ATOM 0 HH21 ARG A 94 -10.159 -3.691 17.505 1.00 3.65 H new ATOM 0 HH22 ARG A 94 -8.719 -4.236 18.372 1.00 3.65 H new ATOM 1406 N VAL A 95 -7.245 -0.050 11.462 1.00 0.65 N ATOM 1407 CA VAL A 95 -7.036 -1.156 10.485 1.00 0.66 C ATOM 1408 C VAL A 95 -5.540 -1.351 10.230 1.00 0.66 C ATOM 1409 O VAL A 95 -5.045 -2.460 10.197 1.00 0.67 O ATOM 1410 CB VAL A 95 -7.728 -0.786 9.168 1.00 0.64 C ATOM 1411 CG1 VAL A 95 -7.468 -1.871 8.121 1.00 1.27 C ATOM 1412 CG2 VAL A 95 -9.235 -0.658 9.402 1.00 1.08 C ATOM 0 H VAL A 95 -7.790 0.740 11.117 1.00 0.65 H new ATOM 0 HA VAL A 95 -7.453 -2.080 10.885 1.00 0.66 H new ATOM 0 HB VAL A 95 -7.330 0.163 8.809 1.00 0.64 H new ATOM 0 HG11 VAL A 95 -7.962 -1.602 7.188 1.00 1.27 H new ATOM 0 HG12 VAL A 95 -6.395 -1.962 7.950 1.00 1.27 H new ATOM 0 HG13 VAL A 95 -7.861 -2.823 8.478 1.00 1.27 H new ATOM 0 HG21 VAL A 95 -9.728 -0.395 8.466 1.00 1.08 H new ATOM 0 HG22 VAL A 95 -9.629 -1.607 9.765 1.00 1.08 H new ATOM 0 HG23 VAL A 95 -9.424 0.120 10.142 1.00 1.08 H new ATOM 1422 N ALA A 96 -4.818 -0.284 10.027 1.00 0.65 N ATOM 1423 CA ALA A 96 -3.361 -0.415 9.752 1.00 0.68 C ATOM 1424 C ALA A 96 -2.674 -1.133 10.913 1.00 0.70 C ATOM 1425 O ALA A 96 -2.125 -2.207 10.777 1.00 0.76 O ATOM 1426 CB ALA A 96 -2.767 0.989 9.584 1.00 0.69 C ATOM 0 H ALA A 96 -5.174 0.672 10.040 1.00 0.65 H new ATOM 0 HA ALA A 96 -3.206 -0.996 8.843 1.00 0.68 H new ATOM 0 HB1 ALA A 96 -1.699 0.910 9.382 1.00 0.69 H new ATOM 0 HB2 ALA A 96 -3.258 1.494 8.752 1.00 0.69 H new ATOM 0 HB3 ALA A 96 -2.922 1.561 10.499 1.00 0.69 H new ATOM 1432 N ALA A 97 -2.733 -0.514 12.063 1.00 0.74 N ATOM 1433 CA ALA A 97 -2.119 -1.093 13.293 1.00 0.78 C ATOM 1434 C ALA A 97 -2.449 -2.586 13.388 1.00 0.79 C ATOM 1435 O ALA A 97 -1.637 -3.383 13.813 1.00 0.83 O ATOM 1436 CB ALA A 97 -2.681 -0.374 14.523 1.00 0.77 C ATOM 0 H ALA A 97 -3.190 0.387 12.203 1.00 0.74 H new ATOM 0 HA ALA A 97 -1.037 -0.966 13.249 1.00 0.78 H new ATOM 0 HB1 ALA A 97 -2.235 -0.794 15.425 1.00 0.77 H new ATOM 0 HB2 ALA A 97 -2.446 0.689 14.462 1.00 0.77 H new ATOM 0 HB3 ALA A 97 -3.763 -0.505 14.558 1.00 0.77 H new ATOM 1442 N ASP A 98 -3.636 -2.970 13.007 1.00 0.78 N ATOM 1443 CA ASP A 98 -4.014 -4.411 13.092 1.00 0.82 C ATOM 1444 C ASP A 98 -3.170 -5.232 12.112 1.00 0.83 C ATOM 1445 O ASP A 98 -2.746 -6.331 12.411 1.00 0.88 O ATOM 1446 CB ASP A 98 -5.494 -4.569 12.742 1.00 0.82 C ATOM 1447 CG ASP A 98 -5.936 -6.005 13.027 1.00 1.47 C ATOM 1448 OD1 ASP A 98 -5.875 -6.405 14.178 1.00 2.13 O ATOM 1449 OD2 ASP A 98 -6.329 -6.681 12.091 1.00 2.19 O ATOM 0 H ASP A 98 -4.360 -2.351 12.641 1.00 0.78 H new ATOM 0 HA ASP A 98 -3.835 -4.769 14.106 1.00 0.82 H new ATOM 0 HB2 ASP A 98 -6.093 -3.870 13.326 1.00 0.82 H new ATOM 0 HB3 ASP A 98 -5.658 -4.329 11.691 1.00 0.82 H new ATOM 1454 N MET A 99 -2.941 -4.713 10.937 1.00 0.81 N ATOM 1455 CA MET A 99 -2.144 -5.464 9.924 1.00 0.85 C ATOM 1456 C MET A 99 -0.666 -5.502 10.329 1.00 0.97 C ATOM 1457 O MET A 99 0.122 -6.216 9.741 1.00 1.14 O ATOM 1458 CB MET A 99 -2.285 -4.772 8.558 1.00 0.79 C ATOM 1459 CG MET A 99 -3.736 -4.895 8.028 1.00 0.81 C ATOM 1460 SD MET A 99 -3.709 -5.177 6.232 1.00 0.97 S ATOM 1461 CE MET A 99 -4.747 -3.783 5.718 1.00 0.48 C ATOM 0 H MET A 99 -3.273 -3.798 10.633 1.00 0.81 H new ATOM 0 HA MET A 99 -2.516 -6.487 9.863 1.00 0.85 H new ATOM 0 HB2 MET A 99 -2.014 -3.720 8.648 1.00 0.79 H new ATOM 0 HB3 MET A 99 -1.593 -5.220 7.845 1.00 0.79 H new ATOM 0 HG2 MET A 99 -4.248 -5.718 8.528 1.00 0.81 H new ATOM 0 HG3 MET A 99 -4.295 -3.987 8.255 1.00 0.81 H new ATOM 0 HE1 MET A 99 -4.734 -3.701 4.631 1.00 0.48 H new ATOM 0 HE2 MET A 99 -5.770 -3.946 6.057 1.00 0.48 H new ATOM 0 HE3 MET A 99 -4.362 -2.862 6.156 1.00 0.48 H new ATOM 1471 N PHE A 100 -0.279 -4.699 11.296 1.00 0.98 N ATOM 1472 CA PHE A 100 1.167 -4.654 11.706 1.00 1.14 C ATOM 1473 C PHE A 100 1.342 -4.770 13.224 1.00 1.28 C ATOM 1474 O PHE A 100 2.441 -4.658 13.729 1.00 1.67 O ATOM 1475 CB PHE A 100 1.768 -3.333 11.227 1.00 1.19 C ATOM 1476 CG PHE A 100 1.579 -3.222 9.731 1.00 1.15 C ATOM 1477 CD1 PHE A 100 2.369 -3.992 8.868 1.00 1.64 C ATOM 1478 CD2 PHE A 100 0.612 -2.355 9.206 1.00 1.67 C ATOM 1479 CE1 PHE A 100 2.192 -3.896 7.483 1.00 1.69 C ATOM 1480 CE2 PHE A 100 0.435 -2.259 7.821 1.00 1.79 C ATOM 1481 CZ PHE A 100 1.225 -3.029 6.959 1.00 1.38 C ATOM 0 H PHE A 100 -0.897 -4.076 11.817 1.00 0.98 H new ATOM 0 HA PHE A 100 1.676 -5.504 11.253 1.00 1.14 H new ATOM 0 HB2 PHE A 100 1.286 -2.495 11.731 1.00 1.19 H new ATOM 0 HB3 PHE A 100 2.828 -3.289 11.477 1.00 1.19 H new ATOM 0 HD1 PHE A 100 3.115 -4.660 9.272 1.00 1.64 H new ATOM 0 HD2 PHE A 100 0.003 -1.760 9.870 1.00 1.67 H new ATOM 0 HE1 PHE A 100 2.801 -4.491 6.818 1.00 1.69 H new ATOM 0 HE2 PHE A 100 -0.311 -1.591 7.417 1.00 1.79 H new ATOM 0 HZ PHE A 100 1.089 -2.954 5.890 1.00 1.38 H new ATOM 1491 N SER A 101 0.286 -4.945 13.968 1.00 1.34 N ATOM 1492 CA SER A 101 0.453 -5.009 15.451 1.00 1.52 C ATOM 1493 C SER A 101 1.468 -6.100 15.823 1.00 1.61 C ATOM 1494 O SER A 101 1.118 -7.251 15.985 1.00 1.99 O ATOM 1495 CB SER A 101 -0.893 -5.283 16.121 1.00 1.79 C ATOM 1496 OG SER A 101 -0.681 -5.617 17.485 1.00 2.21 O ATOM 0 H SER A 101 -0.669 -5.045 13.625 1.00 1.34 H new ATOM 0 HA SER A 101 0.829 -4.049 15.805 1.00 1.52 H new ATOM 0 HB2 SER A 101 -1.535 -4.405 16.046 1.00 1.79 H new ATOM 0 HB3 SER A 101 -1.406 -6.098 15.611 1.00 1.79 H new ATOM 0 HG SER A 101 -1.543 -5.792 17.917 1.00 2.21 H new ATOM 1502 N ASP A 102 2.722 -5.708 15.970 1.00 1.99 N ATOM 1503 CA ASP A 102 3.844 -6.648 16.348 1.00 2.34 C ATOM 1504 C ASP A 102 3.443 -8.123 16.229 1.00 2.07 C ATOM 1505 O ASP A 102 3.334 -8.839 17.204 1.00 2.62 O ATOM 1506 CB ASP A 102 4.276 -6.364 17.789 1.00 3.15 C ATOM 1507 CG ASP A 102 4.748 -4.914 17.911 1.00 3.78 C ATOM 1508 OD1 ASP A 102 5.023 -4.313 16.886 1.00 4.42 O ATOM 1509 OD2 ASP A 102 4.828 -4.431 19.029 1.00 4.10 O ATOM 0 H ASP A 102 3.023 -4.742 15.839 1.00 1.99 H new ATOM 0 HA ASP A 102 4.663 -6.472 15.651 1.00 2.34 H new ATOM 0 HB2 ASP A 102 3.444 -6.544 18.470 1.00 3.15 H new ATOM 0 HB3 ASP A 102 5.078 -7.043 18.079 1.00 3.15 H new ATOM 1514 N GLY A 103 3.211 -8.564 15.023 1.00 2.05 N ATOM 1515 CA GLY A 103 2.800 -9.977 14.791 1.00 2.45 C ATOM 1516 C GLY A 103 2.314 -10.111 13.350 1.00 2.44 C ATOM 1517 O GLY A 103 1.518 -9.329 12.873 1.00 3.08 O ATOM 0 H GLY A 103 3.290 -7.998 14.178 1.00 2.05 H new ATOM 0 HA2 GLY A 103 3.638 -10.650 14.972 1.00 2.45 H new ATOM 0 HA3 GLY A 103 2.009 -10.260 15.485 1.00 2.45 H new ATOM 1521 N ASN A 104 2.842 -11.086 12.648 1.00 2.29 N ATOM 1522 CA ASN A 104 2.483 -11.294 11.214 1.00 2.55 C ATOM 1523 C ASN A 104 2.947 -10.083 10.404 1.00 2.17 C ATOM 1524 O ASN A 104 2.228 -9.118 10.253 1.00 2.54 O ATOM 1525 CB ASN A 104 0.969 -11.482 11.057 1.00 3.20 C ATOM 1526 CG ASN A 104 0.486 -12.555 12.033 1.00 3.72 C ATOM 1527 OD1 ASN A 104 -0.325 -12.288 12.897 1.00 4.05 O ATOM 1528 ND2 ASN A 104 0.953 -13.769 11.929 1.00 4.31 N ATOM 0 H ASN A 104 3.517 -11.756 13.017 1.00 2.29 H new ATOM 0 HA ASN A 104 2.976 -12.194 10.848 1.00 2.55 H new ATOM 0 HB2 ASN A 104 0.453 -10.541 11.249 1.00 3.20 H new ATOM 0 HB3 ASN A 104 0.732 -11.773 10.034 1.00 3.20 H new ATOM 0 HD21 ASN A 104 0.637 -14.494 12.573 1.00 4.31 H new ATOM 0 HD22 ASN A 104 1.634 -13.993 11.203 1.00 4.31 H new ATOM 1535 N PHE A 105 4.165 -10.115 9.913 1.00 1.90 N ATOM 1536 CA PHE A 105 4.710 -8.955 9.130 1.00 1.74 C ATOM 1537 C PHE A 105 4.943 -9.373 7.667 1.00 1.59 C ATOM 1538 O PHE A 105 5.870 -8.924 7.022 1.00 1.88 O ATOM 1539 CB PHE A 105 6.034 -8.489 9.794 1.00 2.03 C ATOM 1540 CG PHE A 105 5.868 -7.091 10.354 1.00 1.75 C ATOM 1541 CD1 PHE A 105 6.101 -5.980 9.537 1.00 2.28 C ATOM 1542 CD2 PHE A 105 5.470 -6.913 11.684 1.00 2.14 C ATOM 1543 CE1 PHE A 105 5.937 -4.688 10.049 1.00 2.84 C ATOM 1544 CE2 PHE A 105 5.303 -5.621 12.196 1.00 2.60 C ATOM 1545 CZ PHE A 105 5.537 -4.508 11.379 1.00 2.84 C ATOM 0 H PHE A 105 4.809 -10.899 10.021 1.00 1.90 H new ATOM 0 HA PHE A 105 3.998 -8.129 9.132 1.00 1.74 H new ATOM 0 HB2 PHE A 105 6.313 -9.178 10.591 1.00 2.03 H new ATOM 0 HB3 PHE A 105 6.842 -8.503 9.063 1.00 2.03 H new ATOM 0 HD1 PHE A 105 6.408 -6.119 8.511 1.00 2.28 H new ATOM 0 HD2 PHE A 105 5.292 -7.772 12.315 1.00 2.14 H new ATOM 0 HE1 PHE A 105 6.119 -3.830 9.419 1.00 2.84 H new ATOM 0 HE2 PHE A 105 4.994 -5.482 13.221 1.00 2.60 H new ATOM 0 HZ PHE A 105 5.409 -3.511 11.774 1.00 2.84 H new ATOM 1555 N ASN A 106 4.109 -10.227 7.136 1.00 1.85 N ATOM 1556 CA ASN A 106 4.282 -10.667 5.718 1.00 1.93 C ATOM 1557 C ASN A 106 4.547 -9.457 4.816 1.00 1.72 C ATOM 1558 O ASN A 106 3.817 -8.489 4.829 1.00 2.31 O ATOM 1559 CB ASN A 106 3.004 -11.365 5.253 1.00 2.62 C ATOM 1560 CG ASN A 106 2.658 -12.495 6.224 1.00 3.11 C ATOM 1561 OD1 ASN A 106 1.914 -12.298 7.164 1.00 3.46 O ATOM 1562 ND2 ASN A 106 3.172 -13.679 6.035 1.00 3.79 N ATOM 0 H ASN A 106 3.314 -10.640 7.623 1.00 1.85 H new ATOM 0 HA ASN A 106 5.130 -11.350 5.657 1.00 1.93 H new ATOM 0 HB2 ASN A 106 2.183 -10.649 5.204 1.00 2.62 H new ATOM 0 HB3 ASN A 106 3.140 -11.764 4.248 1.00 2.62 H new ATOM 0 HD21 ASN A 106 2.949 -14.440 6.677 1.00 3.79 H new ATOM 0 HD22 ASN A 106 3.797 -13.844 5.246 1.00 3.79 H new ATOM 1569 N TRP A 107 5.593 -9.506 4.037 1.00 1.54 N ATOM 1570 CA TRP A 107 5.914 -8.360 3.137 1.00 1.68 C ATOM 1571 C TRP A 107 4.803 -8.204 2.090 1.00 1.47 C ATOM 1572 O TRP A 107 4.845 -7.335 1.244 1.00 1.49 O ATOM 1573 CB TRP A 107 7.275 -8.631 2.448 1.00 2.30 C ATOM 1574 CG TRP A 107 8.270 -7.592 2.857 1.00 2.32 C ATOM 1575 CD1 TRP A 107 9.152 -7.719 3.873 1.00 2.69 C ATOM 1576 CD2 TRP A 107 8.482 -6.272 2.288 1.00 2.77 C ATOM 1577 NE1 TRP A 107 9.896 -6.557 3.962 1.00 3.12 N ATOM 1578 CE2 TRP A 107 9.520 -5.636 3.004 1.00 3.35 C ATOM 1579 CE3 TRP A 107 7.880 -5.573 1.226 1.00 3.24 C ATOM 1580 CZ2 TRP A 107 9.946 -4.350 2.681 1.00 4.31 C ATOM 1581 CZ3 TRP A 107 8.307 -4.277 0.898 1.00 4.29 C ATOM 1582 CH2 TRP A 107 9.338 -3.667 1.624 1.00 4.80 C ATOM 0 H TRP A 107 6.241 -10.292 3.984 1.00 1.54 H new ATOM 0 HA TRP A 107 5.981 -7.436 3.712 1.00 1.68 H new ATOM 0 HB2 TRP A 107 7.639 -9.622 2.720 1.00 2.30 H new ATOM 0 HB3 TRP A 107 7.152 -8.622 1.365 1.00 2.30 H new ATOM 0 HD1 TRP A 107 9.258 -8.585 4.510 1.00 2.69 H new ATOM 0 HE1 TRP A 107 10.632 -6.399 4.650 1.00 3.12 H new ATOM 0 HE3 TRP A 107 7.085 -6.036 0.660 1.00 3.24 H new ATOM 0 HZ2 TRP A 107 10.741 -3.884 3.244 1.00 4.31 H new ATOM 0 HZ3 TRP A 107 7.838 -3.747 0.082 1.00 4.29 H new ATOM 0 HH2 TRP A 107 9.663 -2.670 1.367 1.00 4.80 H new ATOM 1593 N GLY A 108 3.846 -9.084 2.113 1.00 1.41 N ATOM 1594 CA GLY A 108 2.760 -9.037 1.095 1.00 1.47 C ATOM 1595 C GLY A 108 1.575 -8.177 1.552 1.00 1.05 C ATOM 1596 O GLY A 108 0.846 -7.634 0.736 1.00 1.02 O ATOM 0 H GLY A 108 3.767 -9.838 2.795 1.00 1.41 H new ATOM 0 HA2 GLY A 108 3.157 -8.639 0.161 1.00 1.47 H new ATOM 0 HA3 GLY A 108 2.414 -10.050 0.889 1.00 1.47 H new ATOM 1600 N ARG A 109 1.308 -8.069 2.827 1.00 0.86 N ATOM 1601 CA ARG A 109 0.096 -7.287 3.203 1.00 0.87 C ATOM 1602 C ARG A 109 0.293 -5.823 2.800 1.00 0.70 C ATOM 1603 O ARG A 109 -0.640 -5.128 2.453 1.00 0.81 O ATOM 1604 CB ARG A 109 -0.171 -7.410 4.703 1.00 1.08 C ATOM 1605 CG ARG A 109 1.043 -6.895 5.502 1.00 1.48 C ATOM 1606 CD ARG A 109 1.115 -7.616 6.850 1.00 1.96 C ATOM 1607 NE ARG A 109 -0.244 -7.672 7.454 1.00 2.74 N ATOM 1608 CZ ARG A 109 -0.505 -8.535 8.396 1.00 3.19 C ATOM 1609 NH1 ARG A 109 0.408 -9.385 8.770 1.00 3.19 N ATOM 1610 NH2 ARG A 109 -1.683 -8.558 8.952 1.00 4.08 N ATOM 0 H ARG A 109 1.849 -8.469 3.593 1.00 0.86 H new ATOM 0 HA ARG A 109 -0.772 -7.684 2.676 1.00 0.87 H new ATOM 0 HB2 ARG A 109 -1.060 -6.839 4.970 1.00 1.08 H new ATOM 0 HB3 ARG A 109 -0.371 -8.450 4.960 1.00 1.08 H new ATOM 0 HG2 ARG A 109 1.960 -7.065 4.938 1.00 1.48 H new ATOM 0 HG3 ARG A 109 0.959 -5.819 5.658 1.00 1.48 H new ATOM 0 HD2 ARG A 109 1.507 -8.624 6.715 1.00 1.96 H new ATOM 0 HD3 ARG A 109 1.801 -7.094 7.518 1.00 1.96 H new ATOM 0 HE ARG A 109 -0.972 -7.035 7.131 1.00 2.74 H new ATOM 0 HH11 ARG A 109 1.326 -9.375 8.326 1.00 3.19 H new ATOM 0 HH12 ARG A 109 0.205 -10.060 9.507 1.00 3.19 H new ATOM 0 HH21 ARG A 109 -2.402 -7.901 8.650 1.00 4.08 H new ATOM 0 HH22 ARG A 109 -1.886 -9.234 9.689 1.00 4.08 H new ATOM 1624 N VAL A 110 1.521 -5.352 2.863 1.00 0.60 N ATOM 1625 CA VAL A 110 1.805 -3.929 2.505 1.00 0.68 C ATOM 1626 C VAL A 110 1.150 -3.618 1.155 1.00 0.56 C ATOM 1627 O VAL A 110 0.525 -2.587 0.999 1.00 0.60 O ATOM 1628 CB VAL A 110 3.325 -3.674 2.447 1.00 0.88 C ATOM 1629 CG1 VAL A 110 3.852 -3.224 3.813 1.00 1.27 C ATOM 1630 CG2 VAL A 110 4.034 -4.970 2.037 1.00 1.73 C ATOM 0 H VAL A 110 2.336 -5.896 3.148 1.00 0.60 H new ATOM 0 HA VAL A 110 1.391 -3.272 3.269 1.00 0.68 H new ATOM 0 HB VAL A 110 3.522 -2.886 1.720 1.00 0.88 H new ATOM 0 HG11 VAL A 110 4.926 -3.050 3.749 1.00 1.27 H new ATOM 0 HG12 VAL A 110 3.352 -2.302 4.110 1.00 1.27 H new ATOM 0 HG13 VAL A 110 3.654 -3.999 4.553 1.00 1.27 H new ATOM 0 HG21 VAL A 110 5.110 -4.798 1.994 1.00 1.73 H new ATOM 0 HG22 VAL A 110 3.820 -5.749 2.769 1.00 1.73 H new ATOM 0 HG23 VAL A 110 3.677 -5.285 1.057 1.00 1.73 H new ATOM 1640 N VAL A 111 1.235 -4.491 0.191 1.00 0.51 N ATOM 1641 CA VAL A 111 0.549 -4.185 -1.092 1.00 0.50 C ATOM 1642 C VAL A 111 -0.933 -3.974 -0.764 1.00 0.46 C ATOM 1643 O VAL A 111 -1.587 -3.103 -1.303 1.00 0.47 O ATOM 1644 CB VAL A 111 0.748 -5.326 -2.110 1.00 0.58 C ATOM 1645 CG1 VAL A 111 2.175 -5.864 -1.985 1.00 1.41 C ATOM 1646 CG2 VAL A 111 -0.259 -6.464 -1.873 1.00 1.36 C ATOM 0 H VAL A 111 1.735 -5.379 0.232 1.00 0.51 H new ATOM 0 HA VAL A 111 0.966 -3.290 -1.554 1.00 0.50 H new ATOM 0 HB VAL A 111 0.582 -4.932 -3.113 1.00 0.58 H new ATOM 0 HG11 VAL A 111 2.324 -6.672 -2.702 1.00 1.41 H new ATOM 0 HG12 VAL A 111 2.885 -5.063 -2.189 1.00 1.41 H new ATOM 0 HG13 VAL A 111 2.334 -6.242 -0.975 1.00 1.41 H new ATOM 0 HG21 VAL A 111 -0.094 -7.254 -2.606 1.00 1.36 H new ATOM 0 HG22 VAL A 111 -0.124 -6.866 -0.869 1.00 1.36 H new ATOM 0 HG23 VAL A 111 -1.274 -6.079 -1.976 1.00 1.36 H new ATOM 1656 N ALA A 112 -1.453 -4.756 0.149 1.00 0.45 N ATOM 1657 CA ALA A 112 -2.886 -4.590 0.549 1.00 0.47 C ATOM 1658 C ALA A 112 -3.091 -3.194 1.173 1.00 0.46 C ATOM 1659 O ALA A 112 -4.160 -2.623 1.081 1.00 0.54 O ATOM 1660 CB ALA A 112 -3.276 -5.690 1.550 1.00 0.53 C ATOM 0 H ALA A 112 -0.950 -5.500 0.634 1.00 0.45 H new ATOM 0 HA ALA A 112 -3.523 -4.678 -0.331 1.00 0.47 H new ATOM 0 HB1 ALA A 112 -4.320 -5.566 1.839 1.00 0.53 H new ATOM 0 HB2 ALA A 112 -3.141 -6.668 1.087 1.00 0.53 H new ATOM 0 HB3 ALA A 112 -2.644 -5.618 2.435 1.00 0.53 H new ATOM 1666 N LEU A 113 -2.082 -2.628 1.772 1.00 0.43 N ATOM 1667 CA LEU A 113 -2.233 -1.259 2.357 1.00 0.43 C ATOM 1668 C LEU A 113 -2.466 -0.253 1.221 1.00 0.42 C ATOM 1669 O LEU A 113 -3.472 0.428 1.173 1.00 0.45 O ATOM 1670 CB LEU A 113 -0.939 -0.888 3.118 1.00 0.44 C ATOM 1671 CG LEU A 113 -1.277 0.012 4.321 1.00 0.51 C ATOM 1672 CD1 LEU A 113 0.003 0.366 5.076 1.00 1.45 C ATOM 1673 CD2 LEU A 113 -1.952 1.298 3.831 1.00 1.27 C ATOM 0 H LEU A 113 -1.160 -3.049 1.884 1.00 0.43 H new ATOM 0 HA LEU A 113 -3.079 -1.238 3.044 1.00 0.43 H new ATOM 0 HB2 LEU A 113 -0.436 -1.793 3.460 1.00 0.44 H new ATOM 0 HB3 LEU A 113 -0.249 -0.373 2.450 1.00 0.44 H new ATOM 0 HG LEU A 113 -1.955 -0.522 4.987 1.00 0.51 H new ATOM 0 HD11 LEU A 113 -0.241 1.003 5.926 1.00 1.45 H new ATOM 0 HD12 LEU A 113 0.480 -0.547 5.431 1.00 1.45 H new ATOM 0 HD13 LEU A 113 0.684 0.895 4.410 1.00 1.45 H new ATOM 0 HD21 LEU A 113 -2.190 1.932 4.685 1.00 1.27 H new ATOM 0 HD22 LEU A 113 -1.277 1.830 3.160 1.00 1.27 H new ATOM 0 HD23 LEU A 113 -2.870 1.047 3.299 1.00 1.27 H new ATOM 1685 N PHE A 114 -1.550 -0.181 0.296 1.00 0.40 N ATOM 1686 CA PHE A 114 -1.699 0.744 -0.864 1.00 0.40 C ATOM 1687 C PHE A 114 -3.091 0.609 -1.485 1.00 0.39 C ATOM 1688 O PHE A 114 -3.718 1.583 -1.850 1.00 0.41 O ATOM 1689 CB PHE A 114 -0.639 0.388 -1.916 1.00 0.41 C ATOM 1690 CG PHE A 114 0.715 0.158 -1.259 1.00 0.44 C ATOM 1691 CD1 PHE A 114 1.086 0.839 -0.081 1.00 1.29 C ATOM 1692 CD2 PHE A 114 1.612 -0.745 -1.845 1.00 1.27 C ATOM 1693 CE1 PHE A 114 2.340 0.609 0.496 1.00 1.38 C ATOM 1694 CE2 PHE A 114 2.866 -0.971 -1.263 1.00 1.27 C ATOM 1695 CZ PHE A 114 3.229 -0.295 -0.094 1.00 0.68 C ATOM 0 H PHE A 114 -0.692 -0.732 0.294 1.00 0.40 H new ATOM 0 HA PHE A 114 -1.569 1.771 -0.522 1.00 0.40 H new ATOM 0 HB2 PHE A 114 -0.943 -0.508 -2.457 1.00 0.41 H new ATOM 0 HB3 PHE A 114 -0.562 1.192 -2.648 1.00 0.41 H new ATOM 0 HD1 PHE A 114 0.402 1.539 0.376 1.00 1.29 H new ATOM 0 HD2 PHE A 114 1.336 -1.268 -2.748 1.00 1.27 H new ATOM 0 HE1 PHE A 114 2.622 1.131 1.399 1.00 1.38 H new ATOM 0 HE2 PHE A 114 3.554 -1.669 -1.718 1.00 1.27 H new ATOM 0 HZ PHE A 114 4.196 -0.471 0.353 1.00 0.68 H new ATOM 1705 N TYR A 115 -3.576 -0.594 -1.615 1.00 0.40 N ATOM 1706 CA TYR A 115 -4.920 -0.789 -2.223 1.00 0.41 C ATOM 1707 C TYR A 115 -5.999 -0.240 -1.290 1.00 0.41 C ATOM 1708 O TYR A 115 -6.964 0.362 -1.721 1.00 0.44 O ATOM 1709 CB TYR A 115 -5.168 -2.281 -2.455 1.00 0.44 C ATOM 1710 CG TYR A 115 -6.506 -2.466 -3.133 1.00 0.47 C ATOM 1711 CD1 TYR A 115 -6.608 -2.340 -4.524 1.00 1.24 C ATOM 1712 CD2 TYR A 115 -7.645 -2.760 -2.372 1.00 1.28 C ATOM 1713 CE1 TYR A 115 -7.847 -2.508 -5.154 1.00 1.26 C ATOM 1714 CE2 TYR A 115 -8.884 -2.927 -3.003 1.00 1.32 C ATOM 1715 CZ TYR A 115 -8.985 -2.802 -4.393 1.00 0.61 C ATOM 1716 OH TYR A 115 -10.207 -2.965 -5.015 1.00 0.70 O ATOM 0 H TYR A 115 -3.100 -1.449 -1.327 1.00 0.40 H new ATOM 0 HA TYR A 115 -4.959 -0.258 -3.174 1.00 0.41 H new ATOM 0 HB2 TYR A 115 -4.374 -2.702 -3.072 1.00 0.44 H new ATOM 0 HB3 TYR A 115 -5.152 -2.816 -1.505 1.00 0.44 H new ATOM 0 HD1 TYR A 115 -5.730 -2.113 -5.111 1.00 1.24 H new ATOM 0 HD2 TYR A 115 -7.568 -2.858 -1.299 1.00 1.28 H new ATOM 0 HE1 TYR A 115 -7.925 -2.411 -6.227 1.00 1.26 H new ATOM 0 HE2 TYR A 115 -9.762 -3.152 -2.416 1.00 1.32 H new ATOM 0 HH TYR A 115 -10.892 -3.166 -4.343 1.00 0.70 H new ATOM 1726 N PHE A 116 -5.842 -0.439 -0.010 1.00 0.38 N ATOM 1727 CA PHE A 116 -6.858 0.070 0.949 1.00 0.38 C ATOM 1728 C PHE A 116 -6.889 1.598 0.884 1.00 0.36 C ATOM 1729 O PHE A 116 -7.935 2.211 0.774 1.00 0.35 O ATOM 1730 CB PHE A 116 -6.477 -0.372 2.368 1.00 0.40 C ATOM 1731 CG PHE A 116 -7.418 0.255 3.373 1.00 0.37 C ATOM 1732 CD1 PHE A 116 -8.672 -0.321 3.618 1.00 1.17 C ATOM 1733 CD2 PHE A 116 -7.035 1.413 4.063 1.00 1.35 C ATOM 1734 CE1 PHE A 116 -9.540 0.260 4.550 1.00 1.18 C ATOM 1735 CE2 PHE A 116 -7.904 1.993 4.995 1.00 1.37 C ATOM 1736 CZ PHE A 116 -9.156 1.417 5.239 1.00 0.45 C ATOM 0 H PHE A 116 -5.054 -0.932 0.411 1.00 0.38 H new ATOM 0 HA PHE A 116 -7.840 -0.327 0.693 1.00 0.38 H new ATOM 0 HB2 PHE A 116 -6.521 -1.458 2.444 1.00 0.40 H new ATOM 0 HB3 PHE A 116 -5.450 -0.079 2.586 1.00 0.40 H new ATOM 0 HD1 PHE A 116 -8.969 -1.214 3.087 1.00 1.17 H new ATOM 0 HD2 PHE A 116 -6.069 1.858 3.876 1.00 1.35 H new ATOM 0 HE1 PHE A 116 -10.506 -0.184 4.738 1.00 1.18 H new ATOM 0 HE2 PHE A 116 -7.608 2.886 5.526 1.00 1.37 H new ATOM 0 HZ PHE A 116 -9.826 1.865 5.958 1.00 0.45 H new ATOM 1746 N ALA A 117 -5.739 2.218 0.941 1.00 0.35 N ATOM 1747 CA ALA A 117 -5.689 3.701 0.875 1.00 0.34 C ATOM 1748 C ALA A 117 -6.127 4.162 -0.515 1.00 0.34 C ATOM 1749 O ALA A 117 -6.750 5.192 -0.667 1.00 0.34 O ATOM 1750 CB ALA A 117 -4.262 4.183 1.153 1.00 0.37 C ATOM 0 H ALA A 117 -4.834 1.757 1.031 1.00 0.35 H new ATOM 0 HA ALA A 117 -6.360 4.120 1.625 1.00 0.34 H new ATOM 0 HB1 ALA A 117 -4.229 5.271 1.104 1.00 0.37 H new ATOM 0 HB2 ALA A 117 -3.954 3.855 2.146 1.00 0.37 H new ATOM 0 HB3 ALA A 117 -3.585 3.766 0.407 1.00 0.37 H new ATOM 1756 N SER A 118 -5.817 3.404 -1.533 1.00 0.35 N ATOM 1757 CA SER A 118 -6.227 3.806 -2.907 1.00 0.37 C ATOM 1758 C SER A 118 -7.718 4.144 -2.920 1.00 0.36 C ATOM 1759 O SER A 118 -8.148 5.100 -3.534 1.00 0.36 O ATOM 1760 CB SER A 118 -5.956 2.656 -3.879 1.00 0.42 C ATOM 1761 OG SER A 118 -6.261 3.077 -5.203 1.00 1.25 O ATOM 0 H SER A 118 -5.299 2.527 -1.472 1.00 0.35 H new ATOM 0 HA SER A 118 -5.655 4.682 -3.212 1.00 0.37 H new ATOM 0 HB2 SER A 118 -4.912 2.348 -3.814 1.00 0.42 H new ATOM 0 HB3 SER A 118 -6.561 1.789 -3.612 1.00 0.42 H new ATOM 0 HG SER A 118 -5.940 2.407 -5.842 1.00 1.25 H new ATOM 1767 N LYS A 119 -8.506 3.381 -2.209 1.00 0.37 N ATOM 1768 CA LYS A 119 -9.967 3.671 -2.139 1.00 0.39 C ATOM 1769 C LYS A 119 -10.164 5.000 -1.399 1.00 0.36 C ATOM 1770 O LYS A 119 -10.815 5.896 -1.897 1.00 0.38 O ATOM 1771 CB LYS A 119 -10.684 2.539 -1.389 1.00 0.46 C ATOM 1772 CG LYS A 119 -10.850 1.311 -2.308 1.00 1.29 C ATOM 1773 CD LYS A 119 -12.141 1.434 -3.128 1.00 1.84 C ATOM 1774 CE LYS A 119 -12.237 0.262 -4.107 1.00 2.48 C ATOM 1775 NZ LYS A 119 -12.330 -1.016 -3.346 1.00 3.36 N ATOM 0 H LYS A 119 -8.200 2.569 -1.673 1.00 0.37 H new ATOM 0 HA LYS A 119 -10.385 3.742 -3.143 1.00 0.39 H new ATOM 0 HB2 LYS A 119 -10.114 2.263 -0.501 1.00 0.46 H new ATOM 0 HB3 LYS A 119 -11.661 2.881 -1.047 1.00 0.46 H new ATOM 0 HG2 LYS A 119 -9.993 1.229 -2.976 1.00 1.29 H new ATOM 0 HG3 LYS A 119 -10.876 0.400 -1.709 1.00 1.29 H new ATOM 0 HD2 LYS A 119 -13.006 1.440 -2.465 1.00 1.84 H new ATOM 0 HD3 LYS A 119 -12.150 2.378 -3.672 1.00 1.84 H new ATOM 0 HE2 LYS A 119 -13.111 0.380 -4.748 1.00 2.48 H new ATOM 0 HE3 LYS A 119 -11.364 0.247 -4.759 1.00 2.48 H new ATOM 0 HZ1 LYS A 119 -12.581 -1.789 -3.995 1.00 3.36 H new ATOM 0 HZ2 LYS A 119 -11.413 -1.222 -2.900 1.00 3.36 H new ATOM 0 HZ3 LYS A 119 -13.061 -0.930 -2.611 1.00 3.36 H new ATOM 1789 N LEU A 120 -9.589 5.158 -0.238 1.00 0.36 N ATOM 1790 CA LEU A 120 -9.737 6.458 0.485 1.00 0.35 C ATOM 1791 C LEU A 120 -9.354 7.597 -0.471 1.00 0.33 C ATOM 1792 O LEU A 120 -10.030 8.603 -0.569 1.00 0.39 O ATOM 1793 CB LEU A 120 -8.806 6.467 1.712 1.00 0.36 C ATOM 1794 CG LEU A 120 -9.466 5.700 2.880 1.00 0.68 C ATOM 1795 CD1 LEU A 120 -8.397 5.258 3.882 1.00 1.69 C ATOM 1796 CD2 LEU A 120 -10.477 6.596 3.613 1.00 1.28 C ATOM 0 H LEU A 120 -9.028 4.452 0.239 1.00 0.36 H new ATOM 0 HA LEU A 120 -10.766 6.590 0.819 1.00 0.35 H new ATOM 0 HB2 LEU A 120 -7.851 6.008 1.458 1.00 0.36 H new ATOM 0 HB3 LEU A 120 -8.596 7.494 2.012 1.00 0.36 H new ATOM 0 HG LEU A 120 -9.980 4.832 2.467 1.00 0.68 H new ATOM 0 HD11 LEU A 120 -8.869 4.718 4.703 1.00 1.69 H new ATOM 0 HD12 LEU A 120 -7.679 4.606 3.384 1.00 1.69 H new ATOM 0 HD13 LEU A 120 -7.881 6.135 4.274 1.00 1.69 H new ATOM 0 HD21 LEU A 120 -10.931 6.038 4.432 1.00 1.28 H new ATOM 0 HD22 LEU A 120 -9.965 7.472 4.011 1.00 1.28 H new ATOM 0 HD23 LEU A 120 -11.253 6.914 2.917 1.00 1.28 H new ATOM 1808 N VAL A 121 -8.288 7.414 -1.199 1.00 0.33 N ATOM 1809 CA VAL A 121 -7.841 8.431 -2.193 1.00 0.39 C ATOM 1810 C VAL A 121 -8.868 8.539 -3.326 1.00 0.36 C ATOM 1811 O VAL A 121 -9.447 9.582 -3.556 1.00 0.39 O ATOM 1812 CB VAL A 121 -6.495 7.994 -2.779 1.00 0.54 C ATOM 1813 CG1 VAL A 121 -6.065 8.984 -3.867 1.00 0.95 C ATOM 1814 CG2 VAL A 121 -5.443 7.978 -1.664 1.00 1.18 C ATOM 0 H VAL A 121 -7.696 6.585 -1.146 1.00 0.33 H new ATOM 0 HA VAL A 121 -7.743 9.399 -1.702 1.00 0.39 H new ATOM 0 HB VAL A 121 -6.590 6.998 -3.212 1.00 0.54 H new ATOM 0 HG11 VAL A 121 -5.107 8.673 -4.284 1.00 0.95 H new ATOM 0 HG12 VAL A 121 -6.815 9.005 -4.657 1.00 0.95 H new ATOM 0 HG13 VAL A 121 -5.966 9.980 -3.435 1.00 0.95 H new ATOM 0 HG21 VAL A 121 -4.482 7.668 -2.075 1.00 1.18 H new ATOM 0 HG22 VAL A 121 -5.350 8.977 -1.237 1.00 1.18 H new ATOM 0 HG23 VAL A 121 -5.748 7.278 -0.886 1.00 1.18 H new ATOM 1824 N LEU A 122 -9.095 7.469 -4.038 1.00 0.37 N ATOM 1825 CA LEU A 122 -10.083 7.516 -5.154 1.00 0.39 C ATOM 1826 C LEU A 122 -11.444 7.966 -4.606 1.00 0.40 C ATOM 1827 O LEU A 122 -12.091 8.830 -5.161 1.00 0.40 O ATOM 1828 CB LEU A 122 -10.204 6.119 -5.804 1.00 0.42 C ATOM 1829 CG LEU A 122 -9.265 6.012 -7.015 1.00 0.72 C ATOM 1830 CD1 LEU A 122 -7.814 6.150 -6.555 1.00 1.15 C ATOM 1831 CD2 LEU A 122 -9.458 4.651 -7.688 1.00 1.24 C ATOM 0 H LEU A 122 -8.641 6.567 -3.896 1.00 0.37 H new ATOM 0 HA LEU A 122 -9.749 8.226 -5.911 1.00 0.39 H new ATOM 0 HB2 LEU A 122 -9.957 5.348 -5.074 1.00 0.42 H new ATOM 0 HB3 LEU A 122 -11.233 5.944 -6.117 1.00 0.42 H new ATOM 0 HG LEU A 122 -9.496 6.807 -7.723 1.00 0.72 H new ATOM 0 HD11 LEU A 122 -7.150 6.074 -7.416 1.00 1.15 H new ATOM 0 HD12 LEU A 122 -7.675 7.119 -6.075 1.00 1.15 H new ATOM 0 HD13 LEU A 122 -7.580 5.356 -5.845 1.00 1.15 H new ATOM 0 HD21 LEU A 122 -8.793 4.573 -8.548 1.00 1.24 H new ATOM 0 HD22 LEU A 122 -9.227 3.858 -6.977 1.00 1.24 H new ATOM 0 HD23 LEU A 122 -10.492 4.552 -8.019 1.00 1.24 H new ATOM 1843 N LYS A 123 -11.879 7.395 -3.518 1.00 0.51 N ATOM 1844 CA LYS A 123 -13.189 7.808 -2.942 1.00 0.55 C ATOM 1845 C LYS A 123 -13.216 9.334 -2.785 1.00 0.54 C ATOM 1846 O LYS A 123 -14.239 9.964 -2.972 1.00 0.55 O ATOM 1847 CB LYS A 123 -13.382 7.146 -1.572 1.00 0.59 C ATOM 1848 CG LYS A 123 -13.643 5.635 -1.740 1.00 0.97 C ATOM 1849 CD LYS A 123 -15.135 5.371 -1.997 1.00 1.37 C ATOM 1850 CE LYS A 123 -15.394 3.862 -1.988 1.00 1.74 C ATOM 1851 NZ LYS A 123 -15.142 3.323 -0.621 1.00 2.32 N ATOM 0 H LYS A 123 -11.387 6.664 -3.005 1.00 0.51 H new ATOM 0 HA LYS A 123 -13.994 7.496 -3.608 1.00 0.55 H new ATOM 0 HB2 LYS A 123 -12.496 7.303 -0.957 1.00 0.59 H new ATOM 0 HB3 LYS A 123 -14.219 7.611 -1.050 1.00 0.59 H new ATOM 0 HG2 LYS A 123 -13.051 5.248 -2.569 1.00 0.97 H new ATOM 0 HG3 LYS A 123 -13.323 5.103 -0.844 1.00 0.97 H new ATOM 0 HD2 LYS A 123 -15.739 5.859 -1.232 1.00 1.37 H new ATOM 0 HD3 LYS A 123 -15.431 5.796 -2.956 1.00 1.37 H new ATOM 0 HE2 LYS A 123 -16.422 3.657 -2.288 1.00 1.74 H new ATOM 0 HE3 LYS A 123 -14.746 3.367 -2.711 1.00 1.74 H new ATOM 0 HZ1 LYS A 123 -15.679 2.442 -0.491 1.00 2.32 H new ATOM 0 HZ2 LYS A 123 -14.127 3.130 -0.506 1.00 2.32 H new ATOM 0 HZ3 LYS A 123 -15.445 4.021 0.088 1.00 2.32 H new ATOM 1865 N ALA A 124 -12.106 9.936 -2.432 1.00 0.52 N ATOM 1866 CA ALA A 124 -12.085 11.421 -2.254 1.00 0.52 C ATOM 1867 C ALA A 124 -12.005 12.125 -3.609 1.00 0.51 C ATOM 1868 O ALA A 124 -12.440 13.247 -3.764 1.00 0.54 O ATOM 1869 CB ALA A 124 -10.893 11.835 -1.403 1.00 0.51 C ATOM 0 H ALA A 124 -11.218 9.465 -2.260 1.00 0.52 H new ATOM 0 HA ALA A 124 -13.008 11.713 -1.753 1.00 0.52 H new ATOM 0 HB1 ALA A 124 -10.891 12.918 -1.282 1.00 0.51 H new ATOM 0 HB2 ALA A 124 -10.963 11.361 -0.424 1.00 0.51 H new ATOM 0 HB3 ALA A 124 -9.971 11.523 -1.893 1.00 0.51 H new ATOM 1875 N LEU A 125 -11.453 11.469 -4.596 1.00 0.47 N ATOM 1876 CA LEU A 125 -11.348 12.096 -5.936 1.00 0.47 C ATOM 1877 C LEU A 125 -12.763 12.349 -6.466 1.00 0.48 C ATOM 1878 O LEU A 125 -13.053 13.394 -7.013 1.00 0.48 O ATOM 1879 CB LEU A 125 -10.586 11.139 -6.872 1.00 0.51 C ATOM 1880 CG LEU A 125 -10.703 11.592 -8.333 1.00 0.49 C ATOM 1881 CD1 LEU A 125 -10.122 13.000 -8.495 1.00 1.10 C ATOM 1882 CD2 LEU A 125 -9.929 10.616 -9.225 1.00 1.21 C ATOM 0 H LEU A 125 -11.072 10.526 -4.527 1.00 0.47 H new ATOM 0 HA LEU A 125 -10.810 13.042 -5.882 1.00 0.47 H new ATOM 0 HB2 LEU A 125 -9.536 11.100 -6.582 1.00 0.51 H new ATOM 0 HB3 LEU A 125 -10.983 10.129 -6.767 1.00 0.51 H new ATOM 0 HG LEU A 125 -11.754 11.606 -8.622 1.00 0.49 H new ATOM 0 HD11 LEU A 125 -10.210 13.312 -9.536 1.00 1.10 H new ATOM 0 HD12 LEU A 125 -10.671 13.695 -7.860 1.00 1.10 H new ATOM 0 HD13 LEU A 125 -9.071 12.996 -8.205 1.00 1.10 H new ATOM 0 HD21 LEU A 125 -10.008 10.932 -10.265 1.00 1.21 H new ATOM 0 HD22 LEU A 125 -8.880 10.605 -8.928 1.00 1.21 H new ATOM 0 HD23 LEU A 125 -10.347 9.615 -9.117 1.00 1.21 H new ATOM 1894 N CYS A 126 -13.641 11.393 -6.323 1.00 0.52 N ATOM 1895 CA CYS A 126 -15.030 11.573 -6.837 1.00 0.57 C ATOM 1896 C CYS A 126 -15.743 12.646 -6.010 1.00 0.57 C ATOM 1897 O CYS A 126 -16.477 13.468 -6.519 1.00 0.68 O ATOM 1898 CB CYS A 126 -15.782 10.229 -6.748 1.00 0.66 C ATOM 1899 SG CYS A 126 -16.531 10.030 -5.104 1.00 1.67 S ATOM 0 H CYS A 126 -13.457 10.496 -5.873 1.00 0.52 H new ATOM 0 HA CYS A 126 -15.005 11.894 -7.878 1.00 0.57 H new ATOM 0 HB2 CYS A 126 -16.556 10.186 -7.515 1.00 0.66 H new ATOM 0 HB3 CYS A 126 -15.094 9.406 -6.943 1.00 0.66 H new ATOM 0 HG CYS A 126 -15.595 9.998 -4.202 1.00 1.67 H new ATOM 1905 N THR A 127 -15.526 12.614 -4.730 1.00 0.57 N ATOM 1906 CA THR A 127 -16.182 13.606 -3.844 1.00 0.60 C ATOM 1907 C THR A 127 -15.723 15.014 -4.235 1.00 0.62 C ATOM 1908 O THR A 127 -16.257 16.000 -3.773 1.00 0.70 O ATOM 1909 CB THR A 127 -15.807 13.307 -2.373 1.00 0.60 C ATOM 1910 OG1 THR A 127 -15.116 12.076 -2.315 1.00 1.14 O ATOM 1911 CG2 THR A 127 -17.079 13.194 -1.521 1.00 1.19 C ATOM 0 H THR A 127 -14.921 11.942 -4.258 1.00 0.57 H new ATOM 0 HA THR A 127 -17.265 13.543 -3.952 1.00 0.60 H new ATOM 0 HB THR A 127 -15.182 14.115 -1.992 1.00 0.60 H new ATOM 0 HG1 THR A 127 -15.153 11.723 -1.402 1.00 1.14 H new ATOM 0 HG21 THR A 127 -16.807 12.983 -0.487 1.00 1.19 H new ATOM 0 HG22 THR A 127 -17.632 14.132 -1.567 1.00 1.19 H new ATOM 0 HG23 THR A 127 -17.703 12.386 -1.904 1.00 1.19 H new ATOM 1919 N LYS A 128 -14.706 15.094 -5.070 1.00 0.60 N ATOM 1920 CA LYS A 128 -14.172 16.422 -5.499 1.00 0.70 C ATOM 1921 C LYS A 128 -13.611 17.181 -4.297 1.00 0.61 C ATOM 1922 O LYS A 128 -14.006 18.297 -4.019 1.00 0.60 O ATOM 1923 CB LYS A 128 -15.255 17.264 -6.212 1.00 0.87 C ATOM 1924 CG LYS A 128 -15.378 16.846 -7.687 1.00 1.12 C ATOM 1925 CD LYS A 128 -14.375 17.636 -8.540 1.00 1.43 C ATOM 1926 CE LYS A 128 -14.208 16.964 -9.904 1.00 1.83 C ATOM 1927 NZ LYS A 128 -13.075 17.603 -10.629 1.00 2.47 N ATOM 0 H LYS A 128 -14.225 14.289 -5.471 1.00 0.60 H new ATOM 0 HA LYS A 128 -13.367 16.244 -6.212 1.00 0.70 H new ATOM 0 HB2 LYS A 128 -16.214 17.134 -5.710 1.00 0.87 H new ATOM 0 HB3 LYS A 128 -15.002 18.322 -6.148 1.00 0.87 H new ATOM 0 HG2 LYS A 128 -15.191 15.777 -7.788 1.00 1.12 H new ATOM 0 HG3 LYS A 128 -16.393 17.027 -8.042 1.00 1.12 H new ATOM 0 HD2 LYS A 128 -14.723 18.661 -8.670 1.00 1.43 H new ATOM 0 HD3 LYS A 128 -13.413 17.688 -8.030 1.00 1.43 H new ATOM 0 HE2 LYS A 128 -14.019 15.898 -9.777 1.00 1.83 H new ATOM 0 HE3 LYS A 128 -15.126 17.058 -10.484 1.00 1.83 H new ATOM 0 HZ1 LYS A 128 -12.957 17.150 -11.557 1.00 2.47 H new ATOM 0 HZ2 LYS A 128 -13.274 18.615 -10.761 1.00 2.47 H new ATOM 0 HZ3 LYS A 128 -12.202 17.491 -10.076 1.00 2.47 H new ATOM 1941 N VAL A 129 -12.647 16.608 -3.601 1.00 0.60 N ATOM 1942 CA VAL A 129 -12.007 17.317 -2.450 1.00 0.53 C ATOM 1943 C VAL A 129 -10.487 17.022 -2.537 1.00 0.53 C ATOM 1944 O VAL A 129 -9.977 16.220 -1.783 1.00 0.56 O ATOM 1945 CB VAL A 129 -12.591 16.768 -1.134 1.00 0.57 C ATOM 1946 CG1 VAL A 129 -12.331 15.253 -1.015 1.00 1.40 C ATOM 1947 CG2 VAL A 129 -11.976 17.521 0.056 1.00 1.22 C ATOM 0 H VAL A 129 -12.279 15.675 -3.787 1.00 0.60 H new ATOM 0 HA VAL A 129 -12.189 18.391 -2.480 1.00 0.53 H new ATOM 0 HB VAL A 129 -13.670 16.923 -1.131 1.00 0.57 H new ATOM 0 HG11 VAL A 129 -12.751 14.884 -0.079 1.00 1.40 H new ATOM 0 HG12 VAL A 129 -12.801 14.736 -1.852 1.00 1.40 H new ATOM 0 HG13 VAL A 129 -11.257 15.066 -1.030 1.00 1.40 H new ATOM 0 HG21 VAL A 129 -12.390 17.132 0.986 1.00 1.22 H new ATOM 0 HG22 VAL A 129 -10.895 17.383 0.054 1.00 1.22 H new ATOM 0 HG23 VAL A 129 -12.206 18.583 -0.027 1.00 1.22 H new ATOM 1957 N PRO A 130 -9.806 17.632 -3.492 1.00 0.62 N ATOM 1958 CA PRO A 130 -8.367 17.368 -3.705 1.00 0.73 C ATOM 1959 C PRO A 130 -7.510 17.731 -2.480 1.00 0.65 C ATOM 1960 O PRO A 130 -6.427 17.199 -2.315 1.00 0.64 O ATOM 1961 CB PRO A 130 -7.972 18.224 -4.931 1.00 1.00 C ATOM 1962 CG PRO A 130 -9.234 19.021 -5.368 1.00 1.00 C ATOM 1963 CD PRO A 130 -10.393 18.622 -4.422 1.00 0.75 C ATOM 0 HA PRO A 130 -8.190 16.305 -3.867 1.00 0.73 H new ATOM 0 HB2 PRO A 130 -7.158 18.903 -4.679 1.00 1.00 H new ATOM 0 HB3 PRO A 130 -7.618 17.590 -5.744 1.00 1.00 H new ATOM 0 HG2 PRO A 130 -9.047 20.093 -5.313 1.00 1.00 H new ATOM 0 HG3 PRO A 130 -9.490 18.795 -6.403 1.00 1.00 H new ATOM 0 HD2 PRO A 130 -10.779 19.488 -3.884 1.00 0.75 H new ATOM 0 HD3 PRO A 130 -11.227 18.194 -4.978 1.00 0.75 H new ATOM 1971 N GLU A 131 -7.928 18.640 -1.632 1.00 0.73 N ATOM 1972 CA GLU A 131 -7.029 18.989 -0.482 1.00 0.82 C ATOM 1973 C GLU A 131 -6.918 17.753 0.422 1.00 0.72 C ATOM 1974 O GLU A 131 -6.008 17.614 1.214 1.00 0.73 O ATOM 1975 CB GLU A 131 -7.591 20.204 0.264 1.00 1.09 C ATOM 1976 CG GLU A 131 -6.603 20.697 1.322 1.00 1.55 C ATOM 1977 CD GLU A 131 -6.633 19.764 2.535 1.00 2.17 C ATOM 1978 OE1 GLU A 131 -7.713 19.531 3.053 1.00 2.86 O ATOM 1979 OE2 GLU A 131 -5.575 19.298 2.925 1.00 2.52 O ATOM 0 H GLU A 131 -8.816 19.139 -1.679 1.00 0.73 H new ATOM 0 HA GLU A 131 -6.032 19.262 -0.827 1.00 0.82 H new ATOM 0 HB2 GLU A 131 -7.802 21.005 -0.444 1.00 1.09 H new ATOM 0 HB3 GLU A 131 -8.536 19.940 0.738 1.00 1.09 H new ATOM 0 HG2 GLU A 131 -5.597 20.733 0.904 1.00 1.55 H new ATOM 0 HG3 GLU A 131 -6.858 21.712 1.626 1.00 1.55 H new ATOM 1986 N LEU A 132 -7.833 16.838 0.258 1.00 0.71 N ATOM 1987 CA LEU A 132 -7.829 15.572 1.038 1.00 0.69 C ATOM 1988 C LEU A 132 -6.900 14.558 0.356 1.00 0.58 C ATOM 1989 O LEU A 132 -6.135 13.880 1.014 1.00 0.59 O ATOM 1990 CB LEU A 132 -9.259 15.031 1.077 1.00 0.80 C ATOM 1991 CG LEU A 132 -9.489 14.108 2.279 1.00 0.60 C ATOM 1992 CD1 LEU A 132 -9.500 14.911 3.596 1.00 1.11 C ATOM 1993 CD2 LEU A 132 -10.844 13.405 2.098 1.00 0.77 C ATOM 0 H LEU A 132 -8.605 16.920 -0.404 1.00 0.71 H new ATOM 0 HA LEU A 132 -7.471 15.747 2.053 1.00 0.69 H new ATOM 0 HB2 LEU A 132 -9.961 15.864 1.119 1.00 0.80 H new ATOM 0 HB3 LEU A 132 -9.466 14.486 0.156 1.00 0.80 H new ATOM 0 HG LEU A 132 -8.680 13.379 2.332 1.00 0.60 H new ATOM 0 HD11 LEU A 132 -9.665 14.234 4.434 1.00 1.11 H new ATOM 0 HD12 LEU A 132 -8.543 15.417 3.722 1.00 1.11 H new ATOM 0 HD13 LEU A 132 -10.300 15.651 3.565 1.00 1.11 H new ATOM 0 HD21 LEU A 132 -11.026 12.743 2.944 1.00 0.77 H new ATOM 0 HD22 LEU A 132 -11.637 14.151 2.044 1.00 0.77 H new ATOM 0 HD23 LEU A 132 -10.831 12.822 1.177 1.00 0.77 H new ATOM 2005 N ILE A 133 -6.942 14.455 -0.945 1.00 0.52 N ATOM 2006 CA ILE A 133 -6.037 13.495 -1.654 1.00 0.46 C ATOM 2007 C ILE A 133 -4.622 13.626 -1.077 1.00 0.43 C ATOM 2008 O ILE A 133 -3.999 12.658 -0.689 1.00 0.46 O ATOM 2009 CB ILE A 133 -6.030 13.830 -3.152 1.00 0.45 C ATOM 2010 CG1 ILE A 133 -7.426 13.523 -3.722 1.00 0.42 C ATOM 2011 CG2 ILE A 133 -4.969 12.976 -3.865 1.00 0.49 C ATOM 2012 CD1 ILE A 133 -7.514 13.940 -5.195 1.00 1.19 C ATOM 0 H ILE A 133 -7.562 14.992 -1.550 1.00 0.52 H new ATOM 0 HA ILE A 133 -6.387 12.472 -1.517 1.00 0.46 H new ATOM 0 HB ILE A 133 -5.790 14.882 -3.305 1.00 0.45 H new ATOM 0 HG12 ILE A 133 -7.637 12.458 -3.627 1.00 0.42 H new ATOM 0 HG13 ILE A 133 -8.184 14.051 -3.144 1.00 0.42 H new ATOM 0 HG21 ILE A 133 -4.965 13.214 -4.929 1.00 0.49 H new ATOM 0 HG22 ILE A 133 -3.987 13.188 -3.442 1.00 0.49 H new ATOM 0 HG23 ILE A 133 -5.202 11.920 -3.731 1.00 0.49 H new ATOM 0 HD11 ILE A 133 -8.509 13.714 -5.578 1.00 1.19 H new ATOM 0 HD12 ILE A 133 -7.326 15.010 -5.282 1.00 1.19 H new ATOM 0 HD13 ILE A 133 -6.770 13.393 -5.773 1.00 1.19 H new ATOM 2024 N ARG A 134 -4.137 14.834 -0.988 1.00 0.42 N ATOM 2025 CA ARG A 134 -2.786 15.079 -0.401 1.00 0.43 C ATOM 2026 C ARG A 134 -2.790 14.693 1.084 1.00 0.40 C ATOM 2027 O ARG A 134 -1.865 14.072 1.567 1.00 0.39 O ATOM 2028 CB ARG A 134 -2.445 16.568 -0.527 1.00 0.51 C ATOM 2029 CG ARG A 134 -0.989 16.802 -0.111 1.00 1.26 C ATOM 2030 CD ARG A 134 -0.711 18.305 -0.053 1.00 1.57 C ATOM 2031 NE ARG A 134 0.655 18.535 0.498 1.00 2.30 N ATOM 2032 CZ ARG A 134 1.219 19.706 0.378 1.00 2.86 C ATOM 2033 NH1 ARG A 134 0.581 20.680 -0.212 1.00 2.98 N ATOM 2034 NH2 ARG A 134 2.418 19.904 0.851 1.00 3.71 N ATOM 0 H ARG A 134 -4.625 15.673 -1.301 1.00 0.42 H new ATOM 0 HA ARG A 134 -2.047 14.479 -0.932 1.00 0.43 H new ATOM 0 HB2 ARG A 134 -2.598 16.900 -1.554 1.00 0.51 H new ATOM 0 HB3 ARG A 134 -3.112 17.158 0.101 1.00 0.51 H new ATOM 0 HG2 ARG A 134 -0.800 16.349 0.862 1.00 1.26 H new ATOM 0 HG3 ARG A 134 -0.315 16.324 -0.822 1.00 1.26 H new ATOM 0 HD2 ARG A 134 -0.791 18.740 -1.049 1.00 1.57 H new ATOM 0 HD3 ARG A 134 -1.455 18.800 0.571 1.00 1.57 H new ATOM 0 HE ARG A 134 1.149 17.777 0.969 1.00 2.30 H new ATOM 0 HH11 ARG A 134 -0.358 20.526 -0.579 1.00 2.98 H new ATOM 0 HH12 ARG A 134 1.022 21.595 -0.306 1.00 2.98 H new ATOM 0 HH21 ARG A 134 2.915 19.144 1.315 1.00 3.71 H new ATOM 0 HH22 ARG A 134 2.859 20.819 0.757 1.00 3.71 H new ATOM 2048 N THR A 135 -3.809 15.054 1.817 1.00 0.41 N ATOM 2049 CA THR A 135 -3.817 14.688 3.261 1.00 0.41 C ATOM 2050 C THR A 135 -3.662 13.173 3.393 1.00 0.39 C ATOM 2051 O THR A 135 -2.692 12.689 3.940 1.00 0.52 O ATOM 2052 CB THR A 135 -5.099 15.167 3.942 1.00 0.42 C ATOM 2053 OG1 THR A 135 -5.151 16.586 3.875 1.00 0.89 O ATOM 2054 CG2 THR A 135 -5.095 14.737 5.409 1.00 0.88 C ATOM 0 H THR A 135 -4.621 15.576 1.486 1.00 0.41 H new ATOM 0 HA THR A 135 -2.982 15.181 3.760 1.00 0.41 H new ATOM 0 HB THR A 135 -5.964 14.733 3.440 1.00 0.42 H new ATOM 0 HG1 THR A 135 -5.423 16.861 2.975 1.00 0.89 H new ATOM 0 HG21 THR A 135 -6.010 15.080 5.891 1.00 0.88 H new ATOM 0 HG22 THR A 135 -5.039 13.650 5.469 1.00 0.88 H new ATOM 0 HG23 THR A 135 -4.233 15.174 5.914 1.00 0.88 H new ATOM 2062 N ILE A 136 -4.608 12.420 2.877 1.00 0.35 N ATOM 2063 CA ILE A 136 -4.519 10.926 2.938 1.00 0.36 C ATOM 2064 C ILE A 136 -3.073 10.490 2.661 1.00 0.35 C ATOM 2065 O ILE A 136 -2.378 10.074 3.567 1.00 0.51 O ATOM 2066 CB ILE A 136 -5.470 10.329 1.892 1.00 0.46 C ATOM 2067 CG1 ILE A 136 -6.918 10.671 2.283 1.00 0.60 C ATOM 2068 CG2 ILE A 136 -5.298 8.809 1.846 1.00 0.94 C ATOM 2069 CD1 ILE A 136 -7.845 10.523 1.072 1.00 0.64 C ATOM 0 H ILE A 136 -5.442 12.780 2.414 1.00 0.35 H new ATOM 0 HA ILE A 136 -4.807 10.570 3.927 1.00 0.36 H new ATOM 0 HB ILE A 136 -5.243 10.743 0.910 1.00 0.46 H new ATOM 0 HG12 ILE A 136 -7.250 10.013 3.086 1.00 0.60 H new ATOM 0 HG13 ILE A 136 -6.968 11.691 2.665 1.00 0.60 H new ATOM 0 HG21 ILE A 136 -5.975 8.389 1.102 1.00 0.94 H new ATOM 0 HG22 ILE A 136 -4.269 8.567 1.578 1.00 0.94 H new ATOM 0 HG23 ILE A 136 -5.527 8.387 2.825 1.00 0.94 H new ATOM 0 HD11 ILE A 136 -8.866 10.768 1.363 1.00 0.64 H new ATOM 0 HD12 ILE A 136 -7.521 11.199 0.281 1.00 0.64 H new ATOM 0 HD13 ILE A 136 -7.808 9.496 0.709 1.00 0.64 H new ATOM 2081 N MET A 137 -2.612 10.570 1.432 1.00 0.35 N ATOM 2082 CA MET A 137 -1.201 10.157 1.116 1.00 0.33 C ATOM 2083 C MET A 137 -0.261 10.563 2.263 1.00 0.31 C ATOM 2084 O MET A 137 0.712 9.906 2.565 1.00 0.34 O ATOM 2085 CB MET A 137 -0.749 10.851 -0.177 1.00 0.36 C ATOM 2086 CG MET A 137 -1.393 10.170 -1.390 1.00 0.67 C ATOM 2087 SD MET A 137 -1.372 11.306 -2.802 1.00 1.13 S ATOM 2088 CE MET A 137 0.341 11.032 -3.329 1.00 0.67 C ATOM 0 H MET A 137 -3.151 10.903 0.633 1.00 0.35 H new ATOM 0 HA MET A 137 -1.165 9.075 0.991 1.00 0.33 H new ATOM 0 HB2 MET A 137 -1.028 11.904 -0.151 1.00 0.36 H new ATOM 0 HB3 MET A 137 0.337 10.810 -0.261 1.00 0.36 H new ATOM 0 HG2 MET A 137 -0.853 9.256 -1.637 1.00 0.67 H new ATOM 0 HG3 MET A 137 -2.418 9.881 -1.157 1.00 0.67 H new ATOM 0 HE1 MET A 137 0.787 11.982 -3.625 1.00 0.67 H new ATOM 0 HE2 MET A 137 0.911 10.605 -2.504 1.00 0.67 H new ATOM 0 HE3 MET A 137 0.356 10.345 -4.175 1.00 0.67 H new ATOM 2098 N GLY A 138 -0.592 11.648 2.907 1.00 0.31 N ATOM 2099 CA GLY A 138 0.206 12.159 4.061 1.00 0.33 C ATOM 2100 C GLY A 138 0.221 11.115 5.180 1.00 0.33 C ATOM 2101 O GLY A 138 1.249 10.821 5.756 1.00 0.34 O ATOM 0 H GLY A 138 -1.405 12.218 2.675 1.00 0.31 H new ATOM 0 HA2 GLY A 138 1.225 12.379 3.742 1.00 0.33 H new ATOM 0 HA3 GLY A 138 -0.222 13.092 4.427 1.00 0.33 H new ATOM 2105 N TRP A 139 -0.914 10.552 5.487 1.00 0.34 N ATOM 2106 CA TRP A 139 -0.966 9.522 6.563 1.00 0.37 C ATOM 2107 C TRP A 139 -0.298 8.224 6.090 1.00 0.35 C ATOM 2108 O TRP A 139 0.021 7.361 6.883 1.00 0.39 O ATOM 2109 CB TRP A 139 -2.416 9.235 6.957 1.00 0.43 C ATOM 2110 CG TRP A 139 -3.125 10.500 7.338 1.00 0.46 C ATOM 2111 CD1 TRP A 139 -2.534 11.659 7.726 1.00 0.54 C ATOM 2112 CD2 TRP A 139 -4.561 10.745 7.378 1.00 0.53 C ATOM 2113 NE1 TRP A 139 -3.519 12.591 8.002 1.00 0.57 N ATOM 2114 CE2 TRP A 139 -4.783 12.075 7.802 1.00 0.56 C ATOM 2115 CE3 TRP A 139 -5.681 9.945 7.089 1.00 0.67 C ATOM 2116 CZ2 TRP A 139 -6.073 12.593 7.936 1.00 0.66 C ATOM 2117 CZ3 TRP A 139 -6.979 10.463 7.222 1.00 0.81 C ATOM 2118 CH2 TRP A 139 -7.174 11.785 7.645 1.00 0.78 C ATOM 0 H TRP A 139 -1.807 10.760 5.040 1.00 0.34 H new ATOM 0 HA TRP A 139 -0.430 9.906 7.431 1.00 0.37 H new ATOM 0 HB2 TRP A 139 -2.936 8.758 6.126 1.00 0.43 H new ATOM 0 HB3 TRP A 139 -2.439 8.534 7.792 1.00 0.43 H new ATOM 0 HD1 TRP A 139 -1.470 11.826 7.806 1.00 0.54 H new ATOM 0 HE1 TRP A 139 -3.333 13.544 8.315 1.00 0.57 H new ATOM 0 HE3 TRP A 139 -5.542 8.925 6.762 1.00 0.67 H new ATOM 0 HZ2 TRP A 139 -6.218 13.612 8.263 1.00 0.66 H new ATOM 0 HZ3 TRP A 139 -7.832 9.840 6.997 1.00 0.81 H new ATOM 0 HH2 TRP A 139 -8.175 12.178 7.746 1.00 0.78 H new ATOM 2129 N THR A 140 -0.083 8.071 4.808 1.00 0.34 N ATOM 2130 CA THR A 140 0.565 6.820 4.309 1.00 0.36 C ATOM 2131 C THR A 140 2.078 6.907 4.532 1.00 0.34 C ATOM 2132 O THR A 140 2.722 5.936 4.875 1.00 0.39 O ATOM 2133 CB THR A 140 0.271 6.649 2.816 1.00 0.38 C ATOM 2134 OG1 THR A 140 -1.126 6.780 2.593 1.00 1.20 O ATOM 2135 CG2 THR A 140 0.733 5.264 2.359 1.00 1.17 C ATOM 0 H THR A 140 -0.326 8.753 4.089 1.00 0.34 H new ATOM 0 HA THR A 140 0.168 5.963 4.852 1.00 0.36 H new ATOM 0 HB THR A 140 0.804 7.413 2.250 1.00 0.38 H new ATOM 0 HG1 THR A 140 -1.316 6.673 1.638 1.00 1.20 H new ATOM 0 HG21 THR A 140 0.523 5.143 1.296 1.00 1.17 H new ATOM 0 HG22 THR A 140 1.804 5.163 2.531 1.00 1.17 H new ATOM 0 HG23 THR A 140 0.201 4.498 2.923 1.00 1.17 H new ATOM 2143 N LEU A 141 2.646 8.068 4.350 1.00 0.33 N ATOM 2144 CA LEU A 141 4.114 8.230 4.563 1.00 0.34 C ATOM 2145 C LEU A 141 4.389 8.380 6.064 1.00 0.33 C ATOM 2146 O LEU A 141 5.459 8.058 6.540 1.00 0.33 O ATOM 2147 CB LEU A 141 4.628 9.465 3.802 1.00 0.35 C ATOM 2148 CG LEU A 141 4.796 9.181 2.291 1.00 0.41 C ATOM 2149 CD1 LEU A 141 6.122 8.456 2.023 1.00 0.99 C ATOM 2150 CD2 LEU A 141 3.634 8.334 1.756 1.00 0.80 C ATOM 0 H LEU A 141 2.155 8.915 4.062 1.00 0.33 H new ATOM 0 HA LEU A 141 4.636 7.351 4.184 1.00 0.34 H new ATOM 0 HB2 LEU A 141 3.933 10.293 3.941 1.00 0.35 H new ATOM 0 HB3 LEU A 141 5.584 9.778 4.221 1.00 0.35 H new ATOM 0 HG LEU A 141 4.798 10.140 1.773 1.00 0.41 H new ATOM 0 HD11 LEU A 141 6.223 8.265 0.955 1.00 0.99 H new ATOM 0 HD12 LEU A 141 6.951 9.078 2.360 1.00 0.99 H new ATOM 0 HD13 LEU A 141 6.135 7.510 2.564 1.00 0.99 H new ATOM 0 HD21 LEU A 141 3.778 8.150 0.691 1.00 0.80 H new ATOM 0 HD22 LEU A 141 3.602 7.383 2.288 1.00 0.80 H new ATOM 0 HD23 LEU A 141 2.695 8.867 1.908 1.00 0.80 H new ATOM 2162 N ASP A 142 3.433 8.846 6.818 1.00 0.36 N ATOM 2163 CA ASP A 142 3.652 8.986 8.286 1.00 0.37 C ATOM 2164 C ASP A 142 3.813 7.589 8.891 1.00 0.37 C ATOM 2165 O ASP A 142 4.782 7.295 9.563 1.00 0.42 O ATOM 2166 CB ASP A 142 2.443 9.679 8.916 1.00 0.37 C ATOM 2167 CG ASP A 142 2.341 11.108 8.380 1.00 0.78 C ATOM 2168 OD1 ASP A 142 3.274 11.540 7.723 1.00 1.32 O ATOM 2169 OD2 ASP A 142 1.333 11.745 8.635 1.00 1.59 O ATOM 0 H ASP A 142 2.513 9.135 6.484 1.00 0.36 H new ATOM 0 HA ASP A 142 4.546 9.580 8.477 1.00 0.37 H new ATOM 0 HB2 ASP A 142 1.532 9.126 8.686 1.00 0.37 H new ATOM 0 HB3 ASP A 142 2.542 9.692 10.001 1.00 0.37 H new ATOM 2174 N PHE A 143 2.867 6.726 8.641 1.00 0.41 N ATOM 2175 CA PHE A 143 2.941 5.335 9.175 1.00 0.43 C ATOM 2176 C PHE A 143 4.151 4.616 8.577 1.00 0.43 C ATOM 2177 O PHE A 143 4.789 3.819 9.237 1.00 0.45 O ATOM 2178 CB PHE A 143 1.664 4.582 8.789 1.00 0.44 C ATOM 2179 CG PHE A 143 1.593 3.272 9.538 1.00 0.47 C ATOM 2180 CD1 PHE A 143 2.229 2.136 9.023 1.00 1.16 C ATOM 2181 CD2 PHE A 143 0.887 3.193 10.744 1.00 1.29 C ATOM 2182 CE1 PHE A 143 2.158 0.920 9.715 1.00 1.22 C ATOM 2183 CE2 PHE A 143 0.817 1.977 11.436 1.00 1.35 C ATOM 2184 CZ PHE A 143 1.453 0.841 10.921 1.00 0.72 C ATOM 0 H PHE A 143 2.037 6.927 8.084 1.00 0.41 H new ATOM 0 HA PHE A 143 3.041 5.367 10.260 1.00 0.43 H new ATOM 0 HB2 PHE A 143 0.789 5.190 9.019 1.00 0.44 H new ATOM 0 HB3 PHE A 143 1.651 4.398 7.715 1.00 0.44 H new ATOM 0 HD1 PHE A 143 2.774 2.197 8.093 1.00 1.16 H new ATOM 0 HD2 PHE A 143 0.396 4.069 11.141 1.00 1.29 H new ATOM 0 HE1 PHE A 143 2.648 0.043 9.317 1.00 1.22 H new ATOM 0 HE2 PHE A 143 0.272 1.916 12.367 1.00 1.35 H new ATOM 0 HZ PHE A 143 1.399 -0.096 11.455 1.00 0.72 H new ATOM 2194 N LEU A 144 4.483 4.877 7.344 1.00 0.45 N ATOM 2195 CA LEU A 144 5.662 4.186 6.743 1.00 0.47 C ATOM 2196 C LEU A 144 6.934 4.749 7.402 1.00 0.47 C ATOM 2197 O LEU A 144 7.811 4.010 7.804 1.00 0.49 O ATOM 2198 CB LEU A 144 5.655 4.416 5.219 1.00 0.49 C ATOM 2199 CG LEU A 144 6.467 3.338 4.467 1.00 0.64 C ATOM 2200 CD1 LEU A 144 5.934 3.197 3.037 1.00 1.31 C ATOM 2201 CD2 LEU A 144 7.947 3.737 4.408 1.00 1.01 C ATOM 0 H LEU A 144 3.997 5.531 6.730 1.00 0.45 H new ATOM 0 HA LEU A 144 5.627 3.111 6.917 1.00 0.47 H new ATOM 0 HB2 LEU A 144 4.627 4.414 4.857 1.00 0.49 H new ATOM 0 HB3 LEU A 144 6.068 5.400 4.999 1.00 0.49 H new ATOM 0 HG LEU A 144 6.367 2.391 4.997 1.00 0.64 H new ATOM 0 HD11 LEU A 144 6.508 2.436 2.508 1.00 1.31 H new ATOM 0 HD12 LEU A 144 4.885 2.904 3.067 1.00 1.31 H new ATOM 0 HD13 LEU A 144 6.030 4.150 2.517 1.00 1.31 H new ATOM 0 HD21 LEU A 144 8.510 2.970 3.876 1.00 1.01 H new ATOM 0 HD22 LEU A 144 8.047 4.688 3.886 1.00 1.01 H new ATOM 0 HD23 LEU A 144 8.338 3.837 5.421 1.00 1.01 H new ATOM 2213 N ARG A 145 7.036 6.039 7.521 1.00 0.47 N ATOM 2214 CA ARG A 145 8.242 6.647 8.163 1.00 0.48 C ATOM 2215 C ARG A 145 8.384 6.192 9.629 1.00 0.49 C ATOM 2216 O ARG A 145 9.482 5.994 10.111 1.00 0.50 O ATOM 2217 CB ARG A 145 8.110 8.173 8.129 1.00 0.49 C ATOM 2218 CG ARG A 145 9.432 8.812 8.565 1.00 0.69 C ATOM 2219 CD ARG A 145 9.350 10.329 8.384 1.00 0.68 C ATOM 2220 NE ARG A 145 8.158 10.850 9.109 1.00 1.56 N ATOM 2221 CZ ARG A 145 8.039 12.129 9.339 1.00 2.10 C ATOM 2222 NH1 ARG A 145 8.962 12.955 8.929 1.00 2.12 N ATOM 2223 NH2 ARG A 145 6.996 12.582 9.979 1.00 3.16 N ATOM 0 H ARG A 145 6.335 6.707 7.201 1.00 0.47 H new ATOM 0 HA ARG A 145 9.125 6.322 7.612 1.00 0.48 H new ATOM 0 HB2 ARG A 145 7.849 8.503 7.124 1.00 0.49 H new ATOM 0 HB3 ARG A 145 7.304 8.493 8.789 1.00 0.49 H new ATOM 0 HG2 ARG A 145 9.639 8.570 9.608 1.00 0.69 H new ATOM 0 HG3 ARG A 145 10.255 8.409 7.975 1.00 0.69 H new ATOM 0 HD2 ARG A 145 10.256 10.801 8.764 1.00 0.68 H new ATOM 0 HD3 ARG A 145 9.282 10.577 7.325 1.00 0.68 H new ATOM 0 HE ARG A 145 7.433 10.206 9.426 1.00 1.56 H new ATOM 0 HH11 ARG A 145 9.777 12.601 8.428 1.00 2.12 H new ATOM 0 HH12 ARG A 145 8.868 13.955 9.109 1.00 2.12 H new ATOM 0 HH21 ARG A 145 6.274 11.936 10.299 1.00 3.16 H new ATOM 0 HH22 ARG A 145 6.903 13.582 10.159 1.00 3.16 H new ATOM 2237 N GLU A 146 7.304 6.082 10.365 1.00 0.49 N ATOM 2238 CA GLU A 146 7.430 5.706 11.817 1.00 0.51 C ATOM 2239 C GLU A 146 7.588 4.188 12.034 1.00 0.53 C ATOM 2240 O GLU A 146 8.560 3.764 12.629 1.00 0.55 O ATOM 2241 CB GLU A 146 6.211 6.203 12.599 1.00 0.52 C ATOM 2242 CG GLU A 146 6.090 7.722 12.478 1.00 0.96 C ATOM 2243 CD GLU A 146 4.724 8.165 13.010 1.00 1.48 C ATOM 2244 OE1 GLU A 146 4.314 7.647 14.036 1.00 2.03 O ATOM 2245 OE2 GLU A 146 4.111 9.012 12.381 1.00 2.22 O ATOM 0 H GLU A 146 6.351 6.233 10.033 1.00 0.49 H new ATOM 0 HA GLU A 146 8.338 6.185 12.183 1.00 0.51 H new ATOM 0 HB2 GLU A 146 5.307 5.727 12.219 1.00 0.52 H new ATOM 0 HB3 GLU A 146 6.303 5.920 13.648 1.00 0.52 H new ATOM 0 HG2 GLU A 146 6.887 8.208 13.041 1.00 0.96 H new ATOM 0 HG3 GLU A 146 6.204 8.026 11.437 1.00 0.96 H new ATOM 2252 N ARG A 147 6.662 3.361 11.632 1.00 0.59 N ATOM 2253 CA ARG A 147 6.830 1.893 11.923 1.00 0.62 C ATOM 2254 C ARG A 147 7.730 1.218 10.878 1.00 0.58 C ATOM 2255 O ARG A 147 8.626 0.468 11.213 1.00 0.62 O ATOM 2256 CB ARG A 147 5.444 1.218 11.957 1.00 0.63 C ATOM 2257 CG ARG A 147 4.906 1.211 13.397 1.00 0.73 C ATOM 2258 CD ARG A 147 3.514 0.575 13.438 1.00 1.11 C ATOM 2259 NE ARG A 147 3.230 0.112 14.825 1.00 1.75 N ATOM 2260 CZ ARG A 147 2.010 -0.181 15.178 1.00 2.40 C ATOM 2261 NH1 ARG A 147 1.036 -0.060 14.319 1.00 2.71 N ATOM 2262 NH2 ARG A 147 1.763 -0.593 16.392 1.00 3.30 N ATOM 0 H ARG A 147 5.814 3.620 11.127 1.00 0.59 H new ATOM 0 HA ARG A 147 7.313 1.782 12.894 1.00 0.62 H new ATOM 0 HB2 ARG A 147 4.753 1.751 11.303 1.00 0.63 H new ATOM 0 HB3 ARG A 147 5.516 0.198 11.581 1.00 0.63 H new ATOM 0 HG2 ARG A 147 5.586 0.657 14.044 1.00 0.73 H new ATOM 0 HG3 ARG A 147 4.860 2.230 13.781 1.00 0.73 H new ATOM 0 HD2 ARG A 147 2.761 1.297 13.121 1.00 1.11 H new ATOM 0 HD3 ARG A 147 3.463 -0.264 12.744 1.00 1.11 H new ATOM 0 HE ARG A 147 3.991 0.024 15.499 1.00 1.75 H new ATOM 0 HH11 ARG A 147 1.229 0.264 13.371 1.00 2.71 H new ATOM 0 HH12 ARG A 147 0.081 -0.289 14.595 1.00 2.71 H new ATOM 0 HH21 ARG A 147 2.525 -0.686 17.064 1.00 3.30 H new ATOM 0 HH22 ARG A 147 0.808 -0.822 16.668 1.00 3.30 H new ATOM 2276 N LEU A 148 7.496 1.467 9.626 1.00 0.53 N ATOM 2277 CA LEU A 148 8.331 0.829 8.569 1.00 0.57 C ATOM 2278 C LEU A 148 9.615 1.632 8.375 1.00 0.67 C ATOM 2279 O LEU A 148 10.151 2.178 9.314 1.00 1.61 O ATOM 2280 CB LEU A 148 7.545 0.797 7.262 1.00 0.59 C ATOM 2281 CG LEU A 148 6.154 0.186 7.515 1.00 0.70 C ATOM 2282 CD1 LEU A 148 5.337 0.166 6.209 1.00 1.29 C ATOM 2283 CD2 LEU A 148 6.310 -1.248 8.057 1.00 1.34 C ATOM 0 H LEU A 148 6.761 2.086 9.284 1.00 0.53 H new ATOM 0 HA LEU A 148 8.586 -0.188 8.868 1.00 0.57 H new ATOM 0 HB2 LEU A 148 7.444 1.806 6.861 1.00 0.59 H new ATOM 0 HB3 LEU A 148 8.082 0.210 6.517 1.00 0.59 H new ATOM 0 HG LEU A 148 5.627 0.794 8.250 1.00 0.70 H new ATOM 0 HD11 LEU A 148 4.356 -0.268 6.400 1.00 1.29 H new ATOM 0 HD12 LEU A 148 5.217 1.184 5.839 1.00 1.29 H new ATOM 0 HD13 LEU A 148 5.859 -0.432 5.462 1.00 1.29 H new ATOM 0 HD21 LEU A 148 5.325 -1.679 8.235 1.00 1.34 H new ATOM 0 HD22 LEU A 148 6.845 -1.856 7.328 1.00 1.34 H new ATOM 0 HD23 LEU A 148 6.870 -1.225 8.992 1.00 1.34 H new ATOM 2295 N LEU A 149 10.123 1.663 7.167 1.00 0.67 N ATOM 2296 CA LEU A 149 11.397 2.391 6.871 1.00 0.57 C ATOM 2297 C LEU A 149 12.566 1.625 7.491 1.00 0.56 C ATOM 2298 O LEU A 149 13.379 1.054 6.792 1.00 0.58 O ATOM 2299 CB LEU A 149 11.355 3.836 7.399 1.00 0.54 C ATOM 2300 CG LEU A 149 12.629 4.593 6.983 1.00 0.59 C ATOM 2301 CD1 LEU A 149 12.732 4.693 5.451 1.00 0.83 C ATOM 2302 CD2 LEU A 149 12.583 5.999 7.595 1.00 1.21 C ATOM 0 H LEU A 149 9.700 1.206 6.359 1.00 0.67 H new ATOM 0 HA LEU A 149 11.527 2.446 5.790 1.00 0.57 H new ATOM 0 HB2 LEU A 149 10.476 4.348 7.008 1.00 0.54 H new ATOM 0 HB3 LEU A 149 11.265 3.831 8.485 1.00 0.54 H new ATOM 0 HG LEU A 149 13.503 4.052 7.344 1.00 0.59 H new ATOM 0 HD11 LEU A 149 13.640 5.232 5.182 1.00 0.83 H new ATOM 0 HD12 LEU A 149 12.764 3.691 5.022 1.00 0.83 H new ATOM 0 HD13 LEU A 149 11.865 5.227 5.062 1.00 0.83 H new ATOM 0 HD21 LEU A 149 13.479 6.549 7.310 1.00 1.21 H new ATOM 0 HD22 LEU A 149 11.702 6.526 7.230 1.00 1.21 H new ATOM 0 HD23 LEU A 149 12.535 5.922 8.681 1.00 1.21 H new ATOM 2314 N GLY A 150 12.664 1.596 8.793 1.00 0.56 N ATOM 2315 CA GLY A 150 13.789 0.851 9.426 1.00 0.58 C ATOM 2316 C GLY A 150 13.834 -0.574 8.868 1.00 0.62 C ATOM 2317 O GLY A 150 14.859 -1.046 8.418 1.00 0.70 O ATOM 0 H GLY A 150 12.020 2.051 9.440 1.00 0.56 H new ATOM 0 HA2 GLY A 150 14.733 1.360 9.230 1.00 0.58 H new ATOM 0 HA3 GLY A 150 13.660 0.826 10.508 1.00 0.58 H new ATOM 2321 N TRP A 151 12.730 -1.268 8.922 1.00 0.63 N ATOM 2322 CA TRP A 151 12.698 -2.673 8.426 1.00 0.69 C ATOM 2323 C TRP A 151 12.946 -2.707 6.913 1.00 0.70 C ATOM 2324 O TRP A 151 13.535 -3.637 6.399 1.00 0.72 O ATOM 2325 CB TRP A 151 11.324 -3.293 8.743 1.00 0.73 C ATOM 2326 CG TRP A 151 11.298 -3.795 10.156 1.00 1.25 C ATOM 2327 CD1 TRP A 151 11.368 -5.098 10.515 1.00 2.17 C ATOM 2328 CD2 TRP A 151 11.195 -3.035 11.397 1.00 1.86 C ATOM 2329 NE1 TRP A 151 11.317 -5.186 11.894 1.00 2.65 N ATOM 2330 CE2 TRP A 151 11.211 -3.943 12.483 1.00 2.43 C ATOM 2331 CE3 TRP A 151 11.092 -1.661 11.684 1.00 2.68 C ATOM 2332 CZ2 TRP A 151 11.127 -3.504 13.805 1.00 3.17 C ATOM 2333 CZ3 TRP A 151 11.008 -1.217 13.014 1.00 3.62 C ATOM 2334 CH2 TRP A 151 11.026 -2.136 14.072 1.00 3.67 C ATOM 0 H TRP A 151 11.845 -0.920 9.290 1.00 0.63 H new ATOM 0 HA TRP A 151 13.482 -3.246 8.921 1.00 0.69 H new ATOM 0 HB2 TRP A 151 10.539 -2.550 8.598 1.00 0.73 H new ATOM 0 HB3 TRP A 151 11.118 -4.112 8.054 1.00 0.73 H new ATOM 0 HD1 TRP A 151 11.450 -5.933 9.835 1.00 2.17 H new ATOM 0 HE1 TRP A 151 11.353 -6.063 12.413 1.00 2.65 H new ATOM 0 HE3 TRP A 151 11.077 -0.944 10.877 1.00 2.68 H new ATOM 0 HZ2 TRP A 151 11.140 -4.217 14.616 1.00 3.17 H new ATOM 0 HZ3 TRP A 151 10.929 -0.160 13.223 1.00 3.62 H new ATOM 0 HH2 TRP A 151 10.962 -1.787 15.092 1.00 3.67 H new ATOM 2345 N ILE A 152 12.500 -1.716 6.189 1.00 0.73 N ATOM 2346 CA ILE A 152 12.720 -1.734 4.714 1.00 0.76 C ATOM 2347 C ILE A 152 14.209 -1.563 4.421 1.00 0.79 C ATOM 2348 O ILE A 152 14.711 -2.008 3.408 1.00 0.89 O ATOM 2349 CB ILE A 152 11.928 -0.602 4.058 1.00 0.78 C ATOM 2350 CG1 ILE A 152 10.443 -0.763 4.399 1.00 0.83 C ATOM 2351 CG2 ILE A 152 12.112 -0.659 2.538 1.00 0.92 C ATOM 2352 CD1 ILE A 152 9.662 0.442 3.873 1.00 0.94 C ATOM 0 H ILE A 152 11.999 -0.904 6.549 1.00 0.73 H new ATOM 0 HA ILE A 152 12.379 -2.686 4.308 1.00 0.76 H new ATOM 0 HB ILE A 152 12.288 0.358 4.428 1.00 0.78 H new ATOM 0 HG12 ILE A 152 10.056 -1.681 3.957 1.00 0.83 H new ATOM 0 HG13 ILE A 152 10.315 -0.849 5.478 1.00 0.83 H new ATOM 0 HG21 ILE A 152 11.547 0.148 2.073 1.00 0.92 H new ATOM 0 HG22 ILE A 152 13.169 -0.549 2.295 1.00 0.92 H new ATOM 0 HG23 ILE A 152 11.751 -1.617 2.164 1.00 0.92 H new ATOM 0 HD11 ILE A 152 8.606 0.326 4.117 1.00 0.94 H new ATOM 0 HD12 ILE A 152 10.043 1.353 4.336 1.00 0.94 H new ATOM 0 HD13 ILE A 152 9.780 0.508 2.791 1.00 0.94 H new ATOM 2364 N GLN A 153 14.920 -0.935 5.313 1.00 0.77 N ATOM 2365 CA GLN A 153 16.381 -0.744 5.105 1.00 0.80 C ATOM 2366 C GLN A 153 17.088 -2.080 5.358 1.00 0.81 C ATOM 2367 O GLN A 153 17.999 -2.450 4.643 1.00 0.82 O ATOM 2368 CB GLN A 153 16.897 0.342 6.061 1.00 0.82 C ATOM 2369 CG GLN A 153 18.142 1.020 5.482 1.00 1.09 C ATOM 2370 CD GLN A 153 18.583 2.141 6.426 1.00 1.98 C ATOM 2371 OE1 GLN A 153 17.936 2.403 7.421 1.00 2.66 O ATOM 2372 NE2 GLN A 153 19.667 2.816 6.156 1.00 2.77 N ATOM 0 H GLN A 153 14.551 -0.544 6.180 1.00 0.77 H new ATOM 0 HA GLN A 153 16.584 -0.421 4.084 1.00 0.80 H new ATOM 0 HB2 GLN A 153 16.118 1.085 6.232 1.00 0.82 H new ATOM 0 HB3 GLN A 153 17.133 -0.100 7.029 1.00 0.82 H new ATOM 0 HG2 GLN A 153 18.945 0.293 5.360 1.00 1.09 H new ATOM 0 HG3 GLN A 153 17.925 1.424 4.493 1.00 1.09 H new ATOM 0 HE21 GLN A 153 20.210 2.596 5.321 1.00 2.77 H new ATOM 0 HE22 GLN A 153 19.971 3.563 6.780 1.00 2.77 H new ATOM 2381 N ASP A 154 16.684 -2.811 6.359 1.00 0.83 N ATOM 2382 CA ASP A 154 17.348 -4.117 6.627 1.00 0.86 C ATOM 2383 C ASP A 154 17.167 -5.032 5.411 1.00 0.85 C ATOM 2384 O ASP A 154 17.920 -5.962 5.202 1.00 0.94 O ATOM 2385 CB ASP A 154 16.722 -4.768 7.861 1.00 0.90 C ATOM 2386 CG ASP A 154 17.404 -6.110 8.133 1.00 1.28 C ATOM 2387 OD1 ASP A 154 16.956 -7.102 7.582 1.00 1.99 O ATOM 2388 OD2 ASP A 154 18.362 -6.122 8.888 1.00 1.84 O ATOM 0 H ASP A 154 15.929 -2.564 6.999 1.00 0.83 H new ATOM 0 HA ASP A 154 18.411 -3.958 6.809 1.00 0.86 H new ATOM 0 HB2 ASP A 154 16.829 -4.112 8.725 1.00 0.90 H new ATOM 0 HB3 ASP A 154 15.654 -4.916 7.704 1.00 0.90 H new ATOM 2393 N GLN A 155 16.173 -4.767 4.605 1.00 0.79 N ATOM 2394 CA GLN A 155 15.933 -5.608 3.396 1.00 0.79 C ATOM 2395 C GLN A 155 17.031 -5.348 2.357 1.00 0.72 C ATOM 2396 O GLN A 155 17.618 -6.267 1.821 1.00 1.03 O ATOM 2397 CB GLN A 155 14.562 -5.252 2.798 1.00 0.90 C ATOM 2398 CG GLN A 155 14.065 -6.401 1.913 1.00 1.37 C ATOM 2399 CD GLN A 155 13.643 -7.580 2.794 1.00 2.01 C ATOM 2400 OE1 GLN A 155 14.089 -8.692 2.596 1.00 2.72 O ATOM 2401 NE2 GLN A 155 12.795 -7.382 3.767 1.00 2.54 N ATOM 0 H GLN A 155 15.513 -4.000 4.733 1.00 0.79 H new ATOM 0 HA GLN A 155 15.949 -6.661 3.676 1.00 0.79 H new ATOM 0 HB2 GLN A 155 13.846 -5.061 3.597 1.00 0.90 H new ATOM 0 HB3 GLN A 155 14.638 -4.336 2.212 1.00 0.90 H new ATOM 0 HG2 GLN A 155 13.224 -6.068 1.305 1.00 1.37 H new ATOM 0 HG3 GLN A 155 14.852 -6.711 1.225 1.00 1.37 H new ATOM 0 HE21 GLN A 155 12.420 -6.448 3.934 1.00 2.54 H new ATOM 0 HE22 GLN A 155 12.508 -8.161 4.360 1.00 2.54 H new ATOM 2410 N GLY A 156 17.315 -4.097 2.079 1.00 0.63 N ATOM 2411 CA GLY A 156 18.382 -3.751 1.084 1.00 0.72 C ATOM 2412 C GLY A 156 17.803 -2.842 -0.004 1.00 0.87 C ATOM 2413 O GLY A 156 18.470 -2.521 -0.968 1.00 1.38 O ATOM 0 H GLY A 156 16.850 -3.294 2.502 1.00 0.63 H new ATOM 0 HA2 GLY A 156 19.211 -3.251 1.585 1.00 0.72 H new ATOM 0 HA3 GLY A 156 18.782 -4.660 0.636 1.00 0.72 H new ATOM 2417 N GLY A 157 16.570 -2.420 0.145 1.00 0.81 N ATOM 2418 CA GLY A 157 15.937 -1.520 -0.876 1.00 1.10 C ATOM 2419 C GLY A 157 14.681 -2.183 -1.444 1.00 0.84 C ATOM 2420 O GLY A 157 14.452 -3.364 -1.273 1.00 0.88 O ATOM 0 H GLY A 157 15.970 -2.661 0.934 1.00 0.81 H new ATOM 0 HA2 GLY A 157 15.680 -0.563 -0.421 1.00 1.10 H new ATOM 0 HA3 GLY A 157 16.644 -1.312 -1.679 1.00 1.10 H new ATOM 2424 N TRP A 158 13.860 -1.415 -2.109 1.00 0.67 N ATOM 2425 CA TRP A 158 12.603 -1.970 -2.687 1.00 0.50 C ATOM 2426 C TRP A 158 12.916 -3.165 -3.592 1.00 0.51 C ATOM 2427 O TRP A 158 12.017 -3.862 -4.042 1.00 0.53 O ATOM 2428 CB TRP A 158 11.894 -0.885 -3.501 1.00 0.51 C ATOM 2429 CG TRP A 158 11.407 0.195 -2.589 1.00 0.46 C ATOM 2430 CD1 TRP A 158 11.921 1.445 -2.518 1.00 0.59 C ATOM 2431 CD2 TRP A 158 10.319 0.146 -1.623 1.00 0.46 C ATOM 2432 NE1 TRP A 158 11.216 2.166 -1.571 1.00 0.55 N ATOM 2433 CE2 TRP A 158 10.217 1.407 -0.990 1.00 0.47 C ATOM 2434 CE3 TRP A 158 9.419 -0.863 -1.240 1.00 0.65 C ATOM 2435 CZ2 TRP A 158 9.254 1.658 -0.010 1.00 0.58 C ATOM 2436 CZ3 TRP A 158 8.449 -0.615 -0.255 1.00 0.84 C ATOM 2437 CH2 TRP A 158 8.366 0.642 0.359 1.00 0.78 C ATOM 0 H TRP A 158 14.008 -0.420 -2.277 1.00 0.67 H new ATOM 0 HA TRP A 158 11.957 -2.303 -1.874 1.00 0.50 H new ATOM 0 HB2 TRP A 158 12.577 -0.468 -4.241 1.00 0.51 H new ATOM 0 HB3 TRP A 158 11.056 -1.317 -4.048 1.00 0.51 H new ATOM 0 HD1 TRP A 158 12.747 1.819 -3.105 1.00 0.59 H new ATOM 0 HE1 TRP A 158 11.409 3.138 -1.331 1.00 0.55 H new ATOM 0 HE3 TRP A 158 9.474 -1.836 -1.706 1.00 0.65 H new ATOM 0 HZ2 TRP A 158 9.195 2.629 0.459 1.00 0.58 H new ATOM 0 HZ3 TRP A 158 7.763 -1.398 0.031 1.00 0.84 H new ATOM 0 HH2 TRP A 158 7.618 0.826 1.116 1.00 0.78 H new ATOM 2448 N ASP A 159 14.160 -3.430 -3.879 1.00 0.50 N ATOM 2449 CA ASP A 159 14.455 -4.589 -4.762 1.00 0.51 C ATOM 2450 C ASP A 159 13.948 -5.858 -4.077 1.00 0.51 C ATOM 2451 O ASP A 159 13.543 -6.807 -4.718 1.00 0.51 O ATOM 2452 CB ASP A 159 15.963 -4.687 -5.005 1.00 0.54 C ATOM 2453 CG ASP A 159 16.430 -3.478 -5.819 1.00 1.66 C ATOM 2454 OD1 ASP A 159 16.090 -2.368 -5.442 1.00 2.46 O ATOM 2455 OD2 ASP A 159 17.120 -3.683 -6.804 1.00 2.37 O ATOM 0 H ASP A 159 14.970 -2.905 -3.548 1.00 0.50 H new ATOM 0 HA ASP A 159 13.959 -4.464 -5.725 1.00 0.51 H new ATOM 0 HB2 ASP A 159 16.493 -4.725 -4.054 1.00 0.54 H new ATOM 0 HB3 ASP A 159 16.197 -5.609 -5.537 1.00 0.54 H new ATOM 2460 N GLY A 160 13.958 -5.871 -2.769 1.00 0.52 N ATOM 2461 CA GLY A 160 13.466 -7.065 -2.028 1.00 0.54 C ATOM 2462 C GLY A 160 11.989 -7.275 -2.355 1.00 0.53 C ATOM 2463 O GLY A 160 11.517 -8.392 -2.444 1.00 0.54 O ATOM 0 H GLY A 160 14.287 -5.103 -2.183 1.00 0.52 H new ATOM 0 HA2 GLY A 160 14.043 -7.946 -2.307 1.00 0.54 H new ATOM 0 HA3 GLY A 160 13.598 -6.924 -0.955 1.00 0.54 H new ATOM 2467 N LEU A 161 11.256 -6.214 -2.558 1.00 0.54 N ATOM 2468 CA LEU A 161 9.818 -6.366 -2.903 1.00 0.56 C ATOM 2469 C LEU A 161 9.715 -7.250 -4.145 1.00 0.56 C ATOM 2470 O LEU A 161 9.008 -8.238 -4.173 1.00 0.62 O ATOM 2471 CB LEU A 161 9.211 -4.976 -3.201 1.00 0.58 C ATOM 2472 CG LEU A 161 7.715 -4.974 -2.832 1.00 0.74 C ATOM 2473 CD1 LEU A 161 7.105 -3.604 -3.131 1.00 1.63 C ATOM 2474 CD2 LEU A 161 6.983 -6.048 -3.644 1.00 1.56 C ATOM 0 H LEU A 161 11.591 -5.252 -2.500 1.00 0.54 H new ATOM 0 HA LEU A 161 9.274 -6.819 -2.074 1.00 0.56 H new ATOM 0 HB2 LEU A 161 9.737 -4.209 -2.632 1.00 0.58 H new ATOM 0 HB3 LEU A 161 9.336 -4.732 -4.256 1.00 0.58 H new ATOM 0 HG LEU A 161 7.611 -5.188 -1.768 1.00 0.74 H new ATOM 0 HD11 LEU A 161 6.047 -3.611 -2.867 1.00 1.63 H new ATOM 0 HD12 LEU A 161 7.619 -2.841 -2.547 1.00 1.63 H new ATOM 0 HD13 LEU A 161 7.213 -3.382 -4.193 1.00 1.63 H new ATOM 0 HD21 LEU A 161 5.925 -6.045 -3.381 1.00 1.56 H new ATOM 0 HD22 LEU A 161 7.093 -5.838 -4.708 1.00 1.56 H new ATOM 0 HD23 LEU A 161 7.409 -7.026 -3.421 1.00 1.56 H new ATOM 2486 N LEU A 162 10.433 -6.886 -5.178 1.00 0.53 N ATOM 2487 CA LEU A 162 10.404 -7.685 -6.439 1.00 0.56 C ATOM 2488 C LEU A 162 11.055 -9.054 -6.187 1.00 0.55 C ATOM 2489 O LEU A 162 10.670 -10.047 -6.771 1.00 0.57 O ATOM 2490 CB LEU A 162 11.186 -6.929 -7.543 1.00 0.61 C ATOM 2491 CG LEU A 162 10.226 -6.173 -8.482 1.00 0.80 C ATOM 2492 CD1 LEU A 162 10.997 -5.076 -9.225 1.00 1.56 C ATOM 2493 CD2 LEU A 162 9.630 -7.141 -9.514 1.00 1.33 C ATOM 0 H LEU A 162 11.040 -6.067 -5.201 1.00 0.53 H new ATOM 0 HA LEU A 162 9.373 -7.829 -6.761 1.00 0.56 H new ATOM 0 HB2 LEU A 162 11.881 -6.225 -7.084 1.00 0.61 H new ATOM 0 HB3 LEU A 162 11.783 -7.636 -8.120 1.00 0.61 H new ATOM 0 HG LEU A 162 9.425 -5.733 -7.888 1.00 0.80 H new ATOM 0 HD11 LEU A 162 10.319 -4.541 -9.889 1.00 1.56 H new ATOM 0 HD12 LEU A 162 11.424 -4.379 -8.504 1.00 1.56 H new ATOM 0 HD13 LEU A 162 11.798 -5.527 -9.811 1.00 1.56 H new ATOM 0 HD21 LEU A 162 8.953 -6.598 -10.173 1.00 1.33 H new ATOM 0 HD22 LEU A 162 10.433 -7.584 -10.103 1.00 1.33 H new ATOM 0 HD23 LEU A 162 9.081 -7.929 -8.999 1.00 1.33 H new ATOM 2505 N SER A 163 12.043 -9.114 -5.340 1.00 0.54 N ATOM 2506 CA SER A 163 12.715 -10.418 -5.081 1.00 0.56 C ATOM 2507 C SER A 163 11.679 -11.460 -4.653 1.00 0.53 C ATOM 2508 O SER A 163 11.820 -12.639 -4.906 1.00 0.60 O ATOM 2509 CB SER A 163 13.741 -10.246 -3.963 1.00 0.63 C ATOM 2510 OG SER A 163 14.496 -11.443 -3.835 1.00 1.32 O ATOM 0 H SER A 163 12.414 -8.320 -4.817 1.00 0.54 H new ATOM 0 HA SER A 163 13.211 -10.752 -5.992 1.00 0.56 H new ATOM 0 HB2 SER A 163 14.401 -9.407 -4.184 1.00 0.63 H new ATOM 0 HB3 SER A 163 13.238 -10.017 -3.024 1.00 0.63 H new ATOM 0 HG SER A 163 15.157 -11.338 -3.120 1.00 1.32 H new ATOM 2516 N TYR A 164 10.639 -11.021 -3.993 1.00 0.59 N ATOM 2517 CA TYR A 164 9.581 -11.963 -3.523 1.00 0.64 C ATOM 2518 C TYR A 164 8.568 -12.198 -4.646 1.00 0.63 C ATOM 2519 O TYR A 164 8.012 -13.270 -4.777 1.00 0.68 O ATOM 2520 CB TYR A 164 8.872 -11.352 -2.305 1.00 0.69 C ATOM 2521 CG TYR A 164 7.640 -12.161 -1.956 1.00 0.72 C ATOM 2522 CD1 TYR A 164 7.776 -13.418 -1.355 1.00 1.50 C ATOM 2523 CD2 TYR A 164 6.362 -11.653 -2.233 1.00 1.34 C ATOM 2524 CE1 TYR A 164 6.638 -14.168 -1.032 1.00 1.57 C ATOM 2525 CE2 TYR A 164 5.225 -12.403 -1.909 1.00 1.35 C ATOM 2526 CZ TYR A 164 5.363 -13.660 -1.309 1.00 0.87 C ATOM 2527 OH TYR A 164 4.242 -14.399 -0.991 1.00 0.97 O ATOM 0 H TYR A 164 10.476 -10.042 -3.758 1.00 0.59 H new ATOM 0 HA TYR A 164 10.032 -12.915 -3.245 1.00 0.64 H new ATOM 0 HB2 TYR A 164 9.552 -11.327 -1.454 1.00 0.69 H new ATOM 0 HB3 TYR A 164 8.590 -10.321 -2.519 1.00 0.69 H new ATOM 0 HD1 TYR A 164 8.759 -13.810 -1.140 1.00 1.50 H new ATOM 0 HD2 TYR A 164 6.255 -10.683 -2.696 1.00 1.34 H new ATOM 0 HE1 TYR A 164 6.744 -15.138 -0.569 1.00 1.57 H new ATOM 0 HE2 TYR A 164 4.241 -12.012 -2.122 1.00 1.35 H new ATOM 0 HH TYR A 164 3.438 -13.901 -1.249 1.00 0.97 H new ATOM 2537 N PHE A 165 8.317 -11.204 -5.452 1.00 0.64 N ATOM 2538 CA PHE A 165 7.331 -11.373 -6.557 1.00 0.72 C ATOM 2539 C PHE A 165 7.996 -12.112 -7.731 1.00 0.82 C ATOM 2540 O PHE A 165 7.806 -11.779 -8.884 1.00 1.56 O ATOM 2541 CB PHE A 165 6.815 -9.977 -6.990 1.00 0.74 C ATOM 2542 CG PHE A 165 5.416 -9.747 -6.447 1.00 0.84 C ATOM 2543 CD1 PHE A 165 4.327 -10.398 -7.038 1.00 1.42 C ATOM 2544 CD2 PHE A 165 5.213 -8.893 -5.355 1.00 1.65 C ATOM 2545 CE1 PHE A 165 3.035 -10.195 -6.540 1.00 1.71 C ATOM 2546 CE2 PHE A 165 3.920 -8.690 -4.857 1.00 1.96 C ATOM 2547 CZ PHE A 165 2.831 -9.341 -5.450 1.00 1.66 C ATOM 0 H PHE A 165 8.751 -10.283 -5.394 1.00 0.64 H new ATOM 0 HA PHE A 165 6.482 -11.968 -6.221 1.00 0.72 H new ATOM 0 HB2 PHE A 165 7.488 -9.202 -6.623 1.00 0.74 H new ATOM 0 HB3 PHE A 165 6.808 -9.904 -8.078 1.00 0.74 H new ATOM 0 HD1 PHE A 165 4.484 -11.057 -7.879 1.00 1.42 H new ATOM 0 HD2 PHE A 165 6.053 -8.392 -4.898 1.00 1.65 H new ATOM 0 HE1 PHE A 165 2.195 -10.697 -6.997 1.00 1.71 H new ATOM 0 HE2 PHE A 165 3.763 -8.031 -4.016 1.00 1.96 H new ATOM 0 HZ PHE A 165 1.834 -9.184 -5.066 1.00 1.66 H new ATOM 2557 N GLY A 166 8.776 -13.121 -7.444 1.00 0.94 N ATOM 2558 CA GLY A 166 9.444 -13.877 -8.543 1.00 1.01 C ATOM 2559 C GLY A 166 8.393 -14.285 -9.575 1.00 1.23 C ATOM 2560 O GLY A 166 8.224 -13.643 -10.592 1.00 1.85 O ATOM 0 H GLY A 166 8.978 -13.453 -6.501 1.00 0.94 H new ATOM 0 HA2 GLY A 166 10.212 -13.261 -9.011 1.00 1.01 H new ATOM 0 HA3 GLY A 166 9.943 -14.760 -8.144 1.00 1.01 H new ATOM 2564 N THR A 167 7.671 -15.337 -9.309 1.00 1.51 N ATOM 2565 CA THR A 167 6.611 -15.778 -10.255 1.00 2.01 C ATOM 2566 C THR A 167 5.596 -16.674 -9.520 1.00 1.65 C ATOM 2567 O THR A 167 5.314 -17.766 -9.971 1.00 2.06 O ATOM 2568 CB THR A 167 7.258 -16.564 -11.403 1.00 3.10 C ATOM 2569 OG1 THR A 167 8.449 -15.904 -11.808 1.00 3.65 O ATOM 2570 CG2 THR A 167 6.292 -16.645 -12.587 1.00 3.92 C ATOM 0 H THR A 167 7.771 -15.913 -8.473 1.00 1.51 H new ATOM 0 HA THR A 167 6.092 -14.907 -10.654 1.00 2.01 H new ATOM 0 HB THR A 167 7.492 -17.573 -11.064 1.00 3.10 H new ATOM 0 HG1 THR A 167 8.334 -14.935 -11.714 1.00 3.65 H new ATOM 0 HG21 THR A 167 6.757 -17.204 -13.399 1.00 3.92 H new ATOM 0 HG22 THR A 167 5.377 -17.150 -12.276 1.00 3.92 H new ATOM 0 HG23 THR A 167 6.052 -15.639 -12.931 1.00 3.92 H new ATOM 2578 N PRO A 168 5.067 -16.193 -8.407 1.00 1.84 N ATOM 2579 CA PRO A 168 4.079 -16.966 -7.626 1.00 2.36 C ATOM 2580 C PRO A 168 2.815 -17.205 -8.465 1.00 1.79 C ATOM 2581 O PRO A 168 2.682 -16.705 -9.564 1.00 2.00 O ATOM 2582 CB PRO A 168 3.765 -16.082 -6.395 1.00 3.35 C ATOM 2583 CG PRO A 168 4.498 -14.726 -6.595 1.00 3.48 C ATOM 2584 CD PRO A 168 5.400 -14.865 -7.840 1.00 2.53 C ATOM 0 HA PRO A 168 4.453 -17.947 -7.334 1.00 2.36 H new ATOM 0 HB2 PRO A 168 2.690 -15.926 -6.299 1.00 3.35 H new ATOM 0 HB3 PRO A 168 4.100 -16.568 -5.479 1.00 3.35 H new ATOM 0 HG2 PRO A 168 3.779 -13.918 -6.731 1.00 3.48 H new ATOM 0 HG3 PRO A 168 5.093 -14.479 -5.716 1.00 3.48 H new ATOM 0 HD2 PRO A 168 5.206 -14.069 -8.559 1.00 2.53 H new ATOM 0 HD3 PRO A 168 6.455 -14.803 -7.572 1.00 2.53 H new ATOM 2592 N THR A 169 1.884 -17.955 -7.941 1.00 1.73 N ATOM 2593 CA THR A 169 0.622 -18.219 -8.690 1.00 1.33 C ATOM 2594 C THR A 169 -0.333 -17.041 -8.489 1.00 1.05 C ATOM 2595 O THR A 169 -0.438 -16.494 -7.410 1.00 1.06 O ATOM 2596 CB THR A 169 -0.029 -19.498 -8.158 1.00 1.53 C ATOM 2597 OG1 THR A 169 -0.208 -19.386 -6.753 1.00 1.94 O ATOM 2598 CG2 THR A 169 0.867 -20.697 -8.467 1.00 2.40 C ATOM 0 H THR A 169 1.943 -18.398 -7.024 1.00 1.73 H new ATOM 0 HA THR A 169 0.842 -18.340 -9.751 1.00 1.33 H new ATOM 0 HB THR A 169 -0.997 -19.640 -8.638 1.00 1.53 H new ATOM 0 HG1 THR A 169 -0.626 -20.203 -6.410 1.00 1.94 H new ATOM 0 HG21 THR A 169 0.401 -21.607 -8.087 1.00 2.40 H new ATOM 0 HG22 THR A 169 1.003 -20.782 -9.545 1.00 2.40 H new ATOM 0 HG23 THR A 169 1.837 -20.559 -7.989 1.00 2.40 H new ATOM 2606 N TRP A 170 -1.028 -16.643 -9.518 1.00 1.04 N ATOM 2607 CA TRP A 170 -1.971 -15.497 -9.380 1.00 1.01 C ATOM 2608 C TRP A 170 -3.113 -15.882 -8.436 1.00 0.92 C ATOM 2609 O TRP A 170 -3.851 -15.040 -7.965 1.00 0.95 O ATOM 2610 CB TRP A 170 -2.542 -15.138 -10.753 1.00 1.32 C ATOM 2611 CG TRP A 170 -3.213 -16.337 -11.343 1.00 1.70 C ATOM 2612 CD1 TRP A 170 -4.532 -16.616 -11.243 1.00 2.30 C ATOM 2613 CD2 TRP A 170 -2.622 -17.420 -12.118 1.00 2.52 C ATOM 2614 NE1 TRP A 170 -4.790 -17.801 -11.908 1.00 3.04 N ATOM 2615 CE2 TRP A 170 -3.644 -18.335 -12.464 1.00 3.15 C ATOM 2616 CE3 TRP A 170 -1.312 -17.694 -12.550 1.00 3.32 C ATOM 2617 CZ2 TRP A 170 -3.377 -19.482 -13.213 1.00 4.11 C ATOM 2618 CZ3 TRP A 170 -1.039 -18.848 -13.304 1.00 4.37 C ATOM 2619 CH2 TRP A 170 -2.069 -19.739 -13.634 1.00 4.64 C ATOM 0 H TRP A 170 -0.984 -17.061 -10.448 1.00 1.04 H new ATOM 0 HA TRP A 170 -1.439 -14.638 -8.972 1.00 1.01 H new ATOM 0 HB2 TRP A 170 -3.255 -14.319 -10.659 1.00 1.32 H new ATOM 0 HB3 TRP A 170 -1.745 -14.793 -11.411 1.00 1.32 H new ATOM 0 HD1 TRP A 170 -5.265 -16.012 -10.728 1.00 2.30 H new ATOM 0 HE1 TRP A 170 -5.713 -18.228 -11.979 1.00 3.04 H new ATOM 0 HE3 TRP A 170 -0.511 -17.014 -12.301 1.00 3.32 H new ATOM 0 HZ2 TRP A 170 -4.174 -20.165 -13.465 1.00 4.11 H new ATOM 0 HZ3 TRP A 170 -0.030 -19.049 -13.631 1.00 4.37 H new ATOM 0 HH2 TRP A 170 -1.852 -20.624 -14.214 1.00 4.64 H new ATOM 2630 N GLN A 171 -3.267 -17.150 -8.158 1.00 0.88 N ATOM 2631 CA GLN A 171 -4.365 -17.592 -7.247 1.00 0.84 C ATOM 2632 C GLN A 171 -3.892 -17.552 -5.793 1.00 0.75 C ATOM 2633 O GLN A 171 -4.681 -17.354 -4.896 1.00 0.75 O ATOM 2634 CB GLN A 171 -4.779 -19.026 -7.585 1.00 0.88 C ATOM 2635 CG GLN A 171 -5.130 -19.138 -9.068 1.00 1.57 C ATOM 2636 CD GLN A 171 -5.558 -20.575 -9.374 1.00 1.93 C ATOM 2637 OE1 GLN A 171 -5.185 -21.493 -8.671 1.00 2.66 O ATOM 2638 NE2 GLN A 171 -6.332 -20.811 -10.397 1.00 2.34 N ATOM 0 H GLN A 171 -2.679 -17.900 -8.523 1.00 0.88 H new ATOM 0 HA GLN A 171 -5.212 -16.919 -7.378 1.00 0.84 H new ATOM 0 HB2 GLN A 171 -3.968 -19.713 -7.343 1.00 0.88 H new ATOM 0 HB3 GLN A 171 -5.636 -19.318 -6.978 1.00 0.88 H new ATOM 0 HG2 GLN A 171 -5.934 -18.445 -9.318 1.00 1.57 H new ATOM 0 HG3 GLN A 171 -4.271 -18.863 -9.680 1.00 1.57 H new ATOM 0 HE21 GLN A 171 -6.646 -20.041 -10.988 1.00 2.34 H new ATOM 0 HE22 GLN A 171 -6.624 -21.766 -10.606 1.00 2.34 H new ATOM 2647 N THR A 172 -2.624 -17.704 -5.533 1.00 0.67 N ATOM 2648 CA THR A 172 -2.160 -17.641 -4.114 1.00 0.60 C ATOM 2649 C THR A 172 -1.890 -16.180 -3.750 1.00 0.59 C ATOM 2650 O THR A 172 -1.788 -15.836 -2.597 1.00 0.74 O ATOM 2651 CB THR A 172 -0.881 -18.465 -3.949 1.00 0.59 C ATOM 2652 OG1 THR A 172 -1.192 -19.845 -4.085 1.00 0.81 O ATOM 2653 CG2 THR A 172 -0.274 -18.210 -2.564 1.00 0.92 C ATOM 0 H THR A 172 -1.896 -17.867 -6.228 1.00 0.67 H new ATOM 0 HA THR A 172 -2.926 -18.050 -3.455 1.00 0.60 H new ATOM 0 HB THR A 172 -0.161 -18.174 -4.714 1.00 0.59 H new ATOM 0 HG1 THR A 172 -0.375 -20.376 -3.982 1.00 0.81 H new ATOM 0 HG21 THR A 172 0.636 -18.799 -2.452 1.00 0.92 H new ATOM 0 HG22 THR A 172 -0.036 -17.151 -2.460 1.00 0.92 H new ATOM 0 HG23 THR A 172 -0.990 -18.498 -1.794 1.00 0.92 H new ATOM 2661 N VAL A 173 -1.799 -15.312 -4.716 1.00 0.59 N ATOM 2662 CA VAL A 173 -1.560 -13.871 -4.405 1.00 0.58 C ATOM 2663 C VAL A 173 -2.916 -13.184 -4.234 1.00 0.57 C ATOM 2664 O VAL A 173 -3.061 -12.270 -3.443 1.00 0.60 O ATOM 2665 CB VAL A 173 -0.794 -13.234 -5.570 1.00 0.64 C ATOM 2666 CG1 VAL A 173 -0.727 -11.715 -5.389 1.00 1.13 C ATOM 2667 CG2 VAL A 173 0.626 -13.803 -5.607 1.00 1.01 C ATOM 0 H VAL A 173 -1.879 -15.535 -5.708 1.00 0.59 H new ATOM 0 HA VAL A 173 -0.976 -13.764 -3.491 1.00 0.58 H new ATOM 0 HB VAL A 173 -1.310 -13.458 -6.504 1.00 0.64 H new ATOM 0 HG11 VAL A 173 -0.181 -11.273 -6.222 1.00 1.13 H new ATOM 0 HG12 VAL A 173 -1.737 -11.307 -5.360 1.00 1.13 H new ATOM 0 HG13 VAL A 173 -0.215 -11.482 -4.455 1.00 1.13 H new ATOM 0 HG21 VAL A 173 1.176 -13.354 -6.434 1.00 1.01 H new ATOM 0 HG22 VAL A 173 1.133 -13.578 -4.669 1.00 1.01 H new ATOM 0 HG23 VAL A 173 0.582 -14.883 -5.745 1.00 1.01 H new ATOM 2677 N THR A 174 -3.912 -13.624 -4.947 1.00 0.55 N ATOM 2678 CA THR A 174 -5.259 -13.003 -4.805 1.00 0.56 C ATOM 2679 C THR A 174 -5.953 -13.571 -3.560 1.00 0.53 C ATOM 2680 O THR A 174 -6.710 -12.883 -2.902 1.00 0.55 O ATOM 2681 CB THR A 174 -6.096 -13.324 -6.048 1.00 0.59 C ATOM 2682 OG1 THR A 174 -6.098 -14.728 -6.265 1.00 1.37 O ATOM 2683 CG2 THR A 174 -5.496 -12.619 -7.265 1.00 1.27 C ATOM 0 H THR A 174 -3.854 -14.386 -5.622 1.00 0.55 H new ATOM 0 HA THR A 174 -5.157 -11.923 -4.702 1.00 0.56 H new ATOM 0 HB THR A 174 -7.118 -12.977 -5.898 1.00 0.59 H new ATOM 0 HG1 THR A 174 -5.342 -14.971 -6.840 1.00 1.37 H new ATOM 0 HG21 THR A 174 -6.092 -12.848 -8.149 1.00 1.27 H new ATOM 0 HG22 THR A 174 -5.494 -11.542 -7.097 1.00 1.27 H new ATOM 0 HG23 THR A 174 -4.473 -12.964 -7.418 1.00 1.27 H new ATOM 2691 N ILE A 175 -5.722 -14.820 -3.234 1.00 0.51 N ATOM 2692 CA ILE A 175 -6.402 -15.411 -2.038 1.00 0.50 C ATOM 2693 C ILE A 175 -5.656 -15.016 -0.758 1.00 0.49 C ATOM 2694 O ILE A 175 -6.227 -14.950 0.312 1.00 0.49 O ATOM 2695 CB ILE A 175 -6.396 -16.937 -2.157 1.00 0.52 C ATOM 2696 CG1 ILE A 175 -7.165 -17.358 -3.413 1.00 0.77 C ATOM 2697 CG2 ILE A 175 -7.067 -17.548 -0.925 1.00 0.87 C ATOM 2698 CD1 ILE A 175 -6.886 -18.835 -3.713 1.00 0.89 C ATOM 0 H ILE A 175 -5.099 -15.450 -3.738 1.00 0.51 H new ATOM 0 HA ILE A 175 -7.425 -15.038 -1.993 1.00 0.50 H new ATOM 0 HB ILE A 175 -5.367 -17.289 -2.226 1.00 0.52 H new ATOM 0 HG12 ILE A 175 -8.234 -17.201 -3.267 1.00 0.77 H new ATOM 0 HG13 ILE A 175 -6.865 -16.741 -4.260 1.00 0.77 H new ATOM 0 HG21 ILE A 175 -7.063 -18.635 -1.010 1.00 0.87 H new ATOM 0 HG22 ILE A 175 -6.521 -17.252 -0.029 1.00 0.87 H new ATOM 0 HG23 ILE A 175 -8.095 -17.193 -0.857 1.00 0.87 H new ATOM 0 HD11 ILE A 175 -7.433 -19.134 -4.607 1.00 0.89 H new ATOM 0 HD12 ILE A 175 -5.818 -18.978 -3.877 1.00 0.89 H new ATOM 0 HD13 ILE A 175 -7.208 -19.445 -2.869 1.00 0.89 H new ATOM 2710 N PHE A 176 -4.383 -14.733 -0.871 1.00 0.48 N ATOM 2711 CA PHE A 176 -3.584 -14.319 0.321 1.00 0.49 C ATOM 2712 C PHE A 176 -3.982 -12.899 0.713 1.00 0.49 C ATOM 2713 O PHE A 176 -4.621 -12.674 1.721 1.00 0.56 O ATOM 2714 CB PHE A 176 -2.102 -14.324 -0.063 1.00 0.51 C ATOM 2715 CG PHE A 176 -1.260 -13.994 1.145 1.00 0.51 C ATOM 2716 CD1 PHE A 176 -1.098 -14.946 2.158 1.00 1.23 C ATOM 2717 CD2 PHE A 176 -0.634 -12.746 1.252 1.00 1.41 C ATOM 2718 CE1 PHE A 176 -0.312 -14.652 3.277 1.00 1.22 C ATOM 2719 CE2 PHE A 176 0.152 -12.451 2.372 1.00 1.52 C ATOM 2720 CZ PHE A 176 0.313 -13.405 3.385 1.00 0.76 C ATOM 0 H PHE A 176 -3.859 -14.772 -1.745 1.00 0.48 H new ATOM 0 HA PHE A 176 -3.765 -15.001 1.152 1.00 0.49 H new ATOM 0 HB2 PHE A 176 -1.822 -15.301 -0.457 1.00 0.51 H new ATOM 0 HB3 PHE A 176 -1.919 -13.597 -0.855 1.00 0.51 H new ATOM 0 HD1 PHE A 176 -1.580 -15.909 2.076 1.00 1.23 H new ATOM 0 HD2 PHE A 176 -0.758 -12.011 0.470 1.00 1.41 H new ATOM 0 HE1 PHE A 176 -0.188 -15.388 4.058 1.00 1.22 H new ATOM 0 HE2 PHE A 176 0.634 -11.488 2.455 1.00 1.52 H new ATOM 0 HZ PHE A 176 0.920 -13.178 4.249 1.00 0.76 H new ATOM 2730 N VAL A 177 -3.593 -11.939 -0.081 1.00 0.46 N ATOM 2731 CA VAL A 177 -3.925 -10.518 0.227 1.00 0.48 C ATOM 2732 C VAL A 177 -5.415 -10.398 0.565 1.00 0.44 C ATOM 2733 O VAL A 177 -5.774 -9.931 1.629 1.00 0.57 O ATOM 2734 CB VAL A 177 -3.599 -9.662 -1.006 1.00 0.56 C ATOM 2735 CG1 VAL A 177 -4.219 -8.268 -0.864 1.00 1.20 C ATOM 2736 CG2 VAL A 177 -2.078 -9.535 -1.144 1.00 1.24 C ATOM 0 H VAL A 177 -3.055 -12.079 -0.936 1.00 0.46 H new ATOM 0 HA VAL A 177 -3.343 -10.174 1.082 1.00 0.48 H new ATOM 0 HB VAL A 177 -4.013 -10.142 -1.893 1.00 0.56 H new ATOM 0 HG11 VAL A 177 -3.980 -7.672 -1.745 1.00 1.20 H new ATOM 0 HG12 VAL A 177 -5.301 -8.359 -0.770 1.00 1.20 H new ATOM 0 HG13 VAL A 177 -3.817 -7.780 0.024 1.00 1.20 H new ATOM 0 HG21 VAL A 177 -1.841 -8.928 -2.018 1.00 1.24 H new ATOM 0 HG22 VAL A 177 -1.670 -9.061 -0.252 1.00 1.24 H new ATOM 0 HG23 VAL A 177 -1.639 -10.526 -1.261 1.00 1.24 H new ATOM 2746 N ALA A 178 -6.285 -10.805 -0.310 1.00 0.45 N ATOM 2747 CA ALA A 178 -7.738 -10.696 -0.002 1.00 0.43 C ATOM 2748 C ALA A 178 -8.022 -11.326 1.366 1.00 0.40 C ATOM 2749 O ALA A 178 -8.828 -10.842 2.135 1.00 0.40 O ATOM 2750 CB ALA A 178 -8.536 -11.439 -1.075 1.00 0.46 C ATOM 0 H ALA A 178 -6.058 -11.206 -1.220 1.00 0.45 H new ATOM 0 HA ALA A 178 -8.029 -9.646 0.015 1.00 0.43 H new ATOM 0 HB1 ALA A 178 -9.601 -11.363 -0.855 1.00 0.46 H new ATOM 0 HB2 ALA A 178 -8.335 -10.996 -2.050 1.00 0.46 H new ATOM 0 HB3 ALA A 178 -8.242 -12.489 -1.086 1.00 0.46 H new ATOM 2756 N GLY A 179 -7.382 -12.427 1.650 1.00 0.41 N ATOM 2757 CA GLY A 179 -7.618 -13.137 2.941 1.00 0.43 C ATOM 2758 C GLY A 179 -7.273 -12.256 4.147 1.00 0.43 C ATOM 2759 O GLY A 179 -8.019 -12.199 5.104 1.00 0.48 O ATOM 0 H GLY A 179 -6.698 -12.870 1.037 1.00 0.41 H new ATOM 0 HA2 GLY A 179 -8.662 -13.443 3.002 1.00 0.43 H new ATOM 0 HA3 GLY A 179 -7.017 -14.046 2.971 1.00 0.43 H new ATOM 2763 N VAL A 180 -6.147 -11.595 4.143 1.00 0.42 N ATOM 2764 CA VAL A 180 -5.787 -10.768 5.330 1.00 0.45 C ATOM 2765 C VAL A 180 -6.640 -9.496 5.398 1.00 0.45 C ATOM 2766 O VAL A 180 -7.008 -9.030 6.460 1.00 0.43 O ATOM 2767 CB VAL A 180 -4.284 -10.411 5.298 1.00 0.49 C ATOM 2768 CG1 VAL A 180 -3.503 -11.569 4.677 1.00 1.31 C ATOM 2769 CG2 VAL A 180 -4.038 -9.140 4.468 1.00 1.41 C ATOM 0 H VAL A 180 -5.469 -11.591 3.381 1.00 0.42 H new ATOM 0 HA VAL A 180 -5.990 -11.355 6.226 1.00 0.45 H new ATOM 0 HB VAL A 180 -3.951 -10.232 6.320 1.00 0.49 H new ATOM 0 HG11 VAL A 180 -2.442 -11.321 4.653 1.00 1.31 H new ATOM 0 HG12 VAL A 180 -3.651 -12.469 5.273 1.00 1.31 H new ATOM 0 HG13 VAL A 180 -3.858 -11.744 3.661 1.00 1.31 H new ATOM 0 HG21 VAL A 180 -2.972 -8.910 4.461 1.00 1.41 H new ATOM 0 HG22 VAL A 180 -4.381 -9.301 3.446 1.00 1.41 H new ATOM 0 HG23 VAL A 180 -4.586 -8.307 4.908 1.00 1.41 H new ATOM 2779 N LEU A 181 -6.937 -8.918 4.263 1.00 0.49 N ATOM 2780 CA LEU A 181 -7.737 -7.663 4.256 1.00 0.50 C ATOM 2781 C LEU A 181 -9.098 -7.911 4.916 1.00 0.49 C ATOM 2782 O LEU A 181 -9.620 -7.089 5.640 1.00 0.51 O ATOM 2783 CB LEU A 181 -7.947 -7.218 2.796 1.00 0.56 C ATOM 2784 CG LEU A 181 -8.062 -5.685 2.709 1.00 0.64 C ATOM 2785 CD1 LEU A 181 -9.097 -5.164 3.718 1.00 1.60 C ATOM 2786 CD2 LEU A 181 -6.705 -5.001 3.011 1.00 1.20 C ATOM 0 H LEU A 181 -6.660 -9.262 3.344 1.00 0.49 H new ATOM 0 HA LEU A 181 -7.210 -6.887 4.811 1.00 0.50 H new ATOM 0 HB2 LEU A 181 -7.114 -7.561 2.182 1.00 0.56 H new ATOM 0 HB3 LEU A 181 -8.850 -7.679 2.396 1.00 0.56 H new ATOM 0 HG LEU A 181 -8.372 -5.444 1.692 1.00 0.64 H new ATOM 0 HD11 LEU A 181 -9.165 -4.079 3.642 1.00 1.60 H new ATOM 0 HD12 LEU A 181 -10.070 -5.604 3.501 1.00 1.60 H new ATOM 0 HD13 LEU A 181 -8.791 -5.439 4.728 1.00 1.60 H new ATOM 0 HD21 LEU A 181 -6.819 -3.919 2.942 1.00 1.20 H new ATOM 0 HD22 LEU A 181 -6.379 -5.268 4.016 1.00 1.20 H new ATOM 0 HD23 LEU A 181 -5.961 -5.334 2.288 1.00 1.20 H new ATOM 2798 N THR A 182 -9.675 -9.051 4.639 1.00 0.49 N ATOM 2799 CA THR A 182 -11.009 -9.381 5.208 1.00 0.51 C ATOM 2800 C THR A 182 -10.887 -9.662 6.702 1.00 0.48 C ATOM 2801 O THR A 182 -11.785 -9.386 7.469 1.00 0.51 O ATOM 2802 CB THR A 182 -11.580 -10.618 4.505 1.00 0.54 C ATOM 2803 OG1 THR A 182 -10.635 -11.677 4.567 1.00 1.16 O ATOM 2804 CG2 THR A 182 -11.883 -10.284 3.044 1.00 1.07 C ATOM 0 H THR A 182 -9.274 -9.771 4.038 1.00 0.49 H new ATOM 0 HA THR A 182 -11.676 -8.532 5.055 1.00 0.51 H new ATOM 0 HB THR A 182 -12.500 -10.925 5.002 1.00 0.54 H new ATOM 0 HG1 THR A 182 -9.781 -11.334 4.903 1.00 1.16 H new ATOM 0 HG21 THR A 182 -12.289 -11.165 2.546 1.00 1.07 H new ATOM 0 HG22 THR A 182 -12.611 -9.474 2.999 1.00 1.07 H new ATOM 0 HG23 THR A 182 -10.965 -9.975 2.544 1.00 1.07 H new ATOM 2812 N ALA A 183 -9.788 -10.225 7.124 1.00 0.45 N ATOM 2813 CA ALA A 183 -9.635 -10.540 8.571 1.00 0.44 C ATOM 2814 C ALA A 183 -9.870 -9.269 9.387 1.00 0.44 C ATOM 2815 O ALA A 183 -10.512 -9.284 10.417 1.00 0.50 O ATOM 2816 CB ALA A 183 -8.227 -11.076 8.828 1.00 0.46 C ATOM 0 H ALA A 183 -8.995 -10.479 6.534 1.00 0.45 H new ATOM 0 HA ALA A 183 -10.362 -11.297 8.866 1.00 0.44 H new ATOM 0 HB1 ALA A 183 -8.113 -11.307 9.887 1.00 0.46 H new ATOM 0 HB2 ALA A 183 -8.069 -11.980 8.240 1.00 0.46 H new ATOM 0 HB3 ALA A 183 -7.493 -10.323 8.540 1.00 0.46 H new ATOM 2822 N SER A 184 -9.348 -8.165 8.918 1.00 0.47 N ATOM 2823 CA SER A 184 -9.523 -6.867 9.637 1.00 0.51 C ATOM 2824 C SER A 184 -10.974 -6.390 9.517 1.00 0.54 C ATOM 2825 O SER A 184 -11.558 -5.899 10.462 1.00 0.56 O ATOM 2826 CB SER A 184 -8.597 -5.822 9.014 1.00 0.62 C ATOM 2827 OG SER A 184 -8.695 -4.609 9.749 1.00 1.55 O ATOM 0 H SER A 184 -8.802 -8.107 8.058 1.00 0.47 H new ATOM 0 HA SER A 184 -9.279 -7.004 10.690 1.00 0.51 H new ATOM 0 HB2 SER A 184 -7.568 -6.182 9.020 1.00 0.62 H new ATOM 0 HB3 SER A 184 -8.870 -5.652 7.972 1.00 0.62 H new ATOM 0 HG SER A 184 -7.816 -4.376 10.114 1.00 1.55 H new ATOM 2833 N LEU A 185 -11.559 -6.542 8.364 1.00 0.58 N ATOM 2834 CA LEU A 185 -12.975 -6.115 8.161 1.00 0.69 C ATOM 2835 C LEU A 185 -13.922 -7.084 8.868 1.00 0.69 C ATOM 2836 O LEU A 185 -14.980 -6.719 9.340 1.00 0.79 O ATOM 2837 CB LEU A 185 -13.271 -6.149 6.657 1.00 0.71 C ATOM 2838 CG LEU A 185 -12.321 -5.188 5.918 1.00 0.79 C ATOM 2839 CD1 LEU A 185 -12.600 -5.263 4.415 1.00 1.62 C ATOM 2840 CD2 LEU A 185 -12.514 -3.742 6.424 1.00 1.18 C ATOM 0 H LEU A 185 -11.113 -6.949 7.542 1.00 0.58 H new ATOM 0 HA LEU A 185 -13.119 -5.114 8.567 1.00 0.69 H new ATOM 0 HB2 LEU A 185 -13.148 -7.162 6.275 1.00 0.71 H new ATOM 0 HB3 LEU A 185 -14.307 -5.864 6.474 1.00 0.71 H new ATOM 0 HG LEU A 185 -11.290 -5.482 6.113 1.00 0.79 H new ATOM 0 HD11 LEU A 185 -11.930 -4.585 3.886 1.00 1.62 H new ATOM 0 HD12 LEU A 185 -12.435 -6.282 4.065 1.00 1.62 H new ATOM 0 HD13 LEU A 185 -13.634 -4.976 4.222 1.00 1.62 H new ATOM 0 HD21 LEU A 185 -11.835 -3.076 5.891 1.00 1.18 H new ATOM 0 HD22 LEU A 185 -13.543 -3.429 6.247 1.00 1.18 H new ATOM 0 HD23 LEU A 185 -12.301 -3.699 7.492 1.00 1.18 H new ATOM 2852 N THR A 186 -13.530 -8.327 8.935 1.00 0.62 N ATOM 2853 CA THR A 186 -14.366 -9.365 9.596 1.00 0.68 C ATOM 2854 C THR A 186 -14.463 -9.112 11.097 1.00 0.62 C ATOM 2855 O THR A 186 -15.514 -9.260 11.689 1.00 0.64 O ATOM 2856 CB THR A 186 -13.715 -10.735 9.390 1.00 0.73 C ATOM 2857 OG1 THR A 186 -13.457 -10.933 8.008 1.00 0.89 O ATOM 2858 CG2 THR A 186 -14.669 -11.824 9.886 1.00 1.00 C ATOM 0 H THR A 186 -12.650 -8.671 8.552 1.00 0.62 H new ATOM 0 HA THR A 186 -15.364 -9.331 9.158 1.00 0.68 H new ATOM 0 HB THR A 186 -12.779 -10.782 9.946 1.00 0.73 H new ATOM 0 HG1 THR A 186 -12.896 -10.203 7.672 1.00 0.89 H new ATOM 0 HG21 THR A 186 -14.211 -12.802 9.742 1.00 1.00 H new ATOM 0 HG22 THR A 186 -14.875 -11.672 10.946 1.00 1.00 H new ATOM 0 HG23 THR A 186 -15.602 -11.774 9.324 1.00 1.00 H new ATOM 2866 N ILE A 187 -13.377 -8.758 11.736 1.00 0.64 N ATOM 2867 CA ILE A 187 -13.438 -8.537 13.211 1.00 0.66 C ATOM 2868 C ILE A 187 -14.047 -7.167 13.508 1.00 0.66 C ATOM 2869 O ILE A 187 -14.741 -7.005 14.492 1.00 0.75 O ATOM 2870 CB ILE A 187 -12.030 -8.632 13.815 1.00 0.72 C ATOM 2871 CG1 ILE A 187 -11.119 -7.578 13.165 1.00 0.88 C ATOM 2872 CG2 ILE A 187 -11.458 -10.028 13.556 1.00 1.57 C ATOM 2873 CD1 ILE A 187 -9.701 -7.695 13.731 1.00 0.87 C ATOM 0 H ILE A 187 -12.463 -8.614 11.307 1.00 0.64 H new ATOM 0 HA ILE A 187 -14.066 -9.307 13.660 1.00 0.66 H new ATOM 0 HB ILE A 187 -12.083 -8.453 14.889 1.00 0.72 H new ATOM 0 HG12 ILE A 187 -11.101 -7.717 12.084 1.00 0.88 H new ATOM 0 HG13 ILE A 187 -11.513 -6.579 13.352 1.00 0.88 H new ATOM 0 HG21 ILE A 187 -10.458 -10.097 13.984 1.00 1.57 H new ATOM 0 HG22 ILE A 187 -12.103 -10.777 14.017 1.00 1.57 H new ATOM 0 HG23 ILE A 187 -11.406 -10.206 12.482 1.00 1.57 H new ATOM 0 HD11 ILE A 187 -9.061 -6.945 13.266 1.00 0.87 H new ATOM 0 HD12 ILE A 187 -9.725 -7.534 14.809 1.00 0.87 H new ATOM 0 HD13 ILE A 187 -9.307 -8.689 13.522 1.00 0.87 H new ATOM 2885 N TRP A 188 -13.756 -6.159 12.733 1.00 0.64 N ATOM 2886 CA TRP A 188 -14.296 -4.816 13.081 1.00 0.70 C ATOM 2887 C TRP A 188 -15.829 -4.857 13.078 1.00 0.81 C ATOM 2888 O TRP A 188 -16.483 -4.135 13.805 1.00 1.06 O ATOM 2889 CB TRP A 188 -13.773 -3.791 12.064 1.00 0.85 C ATOM 2890 CG TRP A 188 -14.534 -2.507 12.167 1.00 0.92 C ATOM 2891 CD1 TRP A 188 -15.440 -2.067 11.264 1.00 1.76 C ATOM 2892 CD2 TRP A 188 -14.466 -1.493 13.208 1.00 1.04 C ATOM 2893 NE1 TRP A 188 -15.934 -0.846 11.686 1.00 2.01 N ATOM 2894 CE2 TRP A 188 -15.365 -0.450 12.880 1.00 1.34 C ATOM 2895 CE3 TRP A 188 -13.720 -1.379 14.393 1.00 1.79 C ATOM 2896 CZ2 TRP A 188 -15.517 0.667 13.701 1.00 1.47 C ATOM 2897 CZ3 TRP A 188 -13.870 -0.257 15.222 1.00 2.17 C ATOM 2898 CH2 TRP A 188 -14.767 0.765 14.876 1.00 1.71 C ATOM 0 H TRP A 188 -13.181 -6.204 11.892 1.00 0.64 H new ATOM 0 HA TRP A 188 -13.967 -4.526 14.079 1.00 0.70 H new ATOM 0 HB2 TRP A 188 -12.713 -3.606 12.239 1.00 0.85 H new ATOM 0 HB3 TRP A 188 -13.864 -4.193 11.055 1.00 0.85 H new ATOM 0 HD1 TRP A 188 -15.730 -2.584 10.361 1.00 1.76 H new ATOM 0 HE1 TRP A 188 -16.633 -0.304 11.177 1.00 2.01 H new ATOM 0 HE3 TRP A 188 -13.027 -2.160 14.668 1.00 1.79 H new ATOM 0 HZ2 TRP A 188 -16.209 1.451 13.431 1.00 1.47 H new ATOM 0 HZ3 TRP A 188 -13.292 -0.180 16.131 1.00 2.17 H new ATOM 0 HH2 TRP A 188 -14.878 1.627 15.517 1.00 1.71 H new ATOM 2909 N LYS A 189 -16.402 -5.700 12.262 1.00 0.95 N ATOM 2910 CA LYS A 189 -17.887 -5.798 12.201 1.00 1.23 C ATOM 2911 C LYS A 189 -18.400 -6.553 13.427 1.00 1.53 C ATOM 2912 O LYS A 189 -18.728 -7.721 13.357 1.00 2.02 O ATOM 2913 CB LYS A 189 -18.295 -6.552 10.927 1.00 1.90 C ATOM 2914 CG LYS A 189 -18.128 -5.644 9.691 1.00 2.68 C ATOM 2915 CD LYS A 189 -19.407 -4.832 9.457 1.00 3.60 C ATOM 2916 CE LYS A 189 -19.158 -3.791 8.365 1.00 4.51 C ATOM 2917 NZ LYS A 189 -20.406 -3.013 8.133 1.00 5.09 N ATOM 0 H LYS A 189 -15.902 -6.328 11.632 1.00 0.95 H new ATOM 0 HA LYS A 189 -18.318 -4.797 12.186 1.00 1.23 H new ATOM 0 HB2 LYS A 189 -17.683 -7.447 10.814 1.00 1.90 H new ATOM 0 HB3 LYS A 189 -19.331 -6.882 11.007 1.00 1.90 H new ATOM 0 HG2 LYS A 189 -17.282 -4.972 9.836 1.00 2.68 H new ATOM 0 HG3 LYS A 189 -17.907 -6.250 8.812 1.00 2.68 H new ATOM 0 HD2 LYS A 189 -20.222 -5.494 9.164 1.00 3.60 H new ATOM 0 HD3 LYS A 189 -19.712 -4.340 10.381 1.00 3.60 H new ATOM 0 HE2 LYS A 189 -18.349 -3.123 8.661 1.00 4.51 H new ATOM 0 HE3 LYS A 189 -18.845 -4.282 7.443 1.00 4.51 H new ATOM 0 HZ1 LYS A 189 -20.377 -2.585 7.186 1.00 5.09 H new ATOM 0 HZ2 LYS A 189 -21.228 -3.646 8.202 1.00 5.09 H new ATOM 0 HZ3 LYS A 189 -20.486 -2.263 8.849 1.00 5.09 H new ATOM 2931 N LYS A 190 -18.473 -5.891 14.551 1.00 2.36 N ATOM 2932 CA LYS A 190 -18.966 -6.552 15.800 1.00 3.37 C ATOM 2933 C LYS A 190 -19.905 -5.596 16.537 1.00 3.71 C ATOM 2934 O LYS A 190 -20.795 -6.011 17.252 1.00 4.35 O ATOM 2935 CB LYS A 190 -17.776 -6.890 16.699 1.00 4.30 C ATOM 2936 CG LYS A 190 -18.277 -7.568 17.976 1.00 5.08 C ATOM 2937 CD LYS A 190 -17.086 -8.107 18.769 1.00 5.78 C ATOM 2938 CE LYS A 190 -17.565 -8.609 20.133 1.00 6.76 C ATOM 2939 NZ LYS A 190 -18.688 -9.570 19.941 1.00 7.40 N ATOM 0 H LYS A 190 -18.210 -4.912 14.660 1.00 2.36 H new ATOM 0 HA LYS A 190 -19.500 -7.467 15.545 1.00 3.37 H new ATOM 0 HB2 LYS A 190 -17.084 -7.548 16.173 1.00 4.30 H new ATOM 0 HB3 LYS A 190 -17.226 -5.983 16.948 1.00 4.30 H new ATOM 0 HG2 LYS A 190 -18.839 -6.857 18.582 1.00 5.08 H new ATOM 0 HG3 LYS A 190 -18.958 -8.381 17.725 1.00 5.08 H new ATOM 0 HD2 LYS A 190 -16.607 -8.917 18.220 1.00 5.78 H new ATOM 0 HD3 LYS A 190 -16.339 -7.324 18.900 1.00 5.78 H new ATOM 0 HE2 LYS A 190 -16.745 -9.093 20.663 1.00 6.76 H new ATOM 0 HE3 LYS A 190 -17.891 -7.770 20.748 1.00 6.76 H new ATOM 0 HZ1 LYS A 190 -18.780 -10.169 20.786 1.00 7.40 H new ATOM 0 HZ2 LYS A 190 -19.573 -9.044 19.791 1.00 7.40 H new ATOM 0 HZ3 LYS A 190 -18.495 -10.168 19.112 1.00 7.40 H new ATOM 2953 N MET A 191 -19.715 -4.316 16.363 1.00 3.81 N ATOM 2954 CA MET A 191 -20.598 -3.329 17.048 1.00 4.63 C ATOM 2955 C MET A 191 -21.889 -3.159 16.242 1.00 4.97 C ATOM 2956 O MET A 191 -22.519 -4.123 15.855 1.00 5.27 O ATOM 2957 CB MET A 191 -19.873 -1.984 17.149 1.00 5.48 C ATOM 2958 CG MET A 191 -18.511 -2.189 17.816 1.00 5.71 C ATOM 2959 SD MET A 191 -17.717 -0.582 18.076 1.00 7.00 S ATOM 2960 CE MET A 191 -18.318 -0.291 19.759 1.00 7.52 C ATOM 0 H MET A 191 -18.986 -3.911 15.776 1.00 3.81 H new ATOM 0 HA MET A 191 -20.840 -3.685 18.049 1.00 4.63 H new ATOM 0 HB2 MET A 191 -19.743 -1.553 16.156 1.00 5.48 H new ATOM 0 HB3 MET A 191 -20.471 -1.279 17.727 1.00 5.48 H new ATOM 0 HG2 MET A 191 -18.635 -2.704 18.769 1.00 5.71 H new ATOM 0 HG3 MET A 191 -17.880 -2.821 17.192 1.00 5.71 H new ATOM 0 HE1 MET A 191 -17.940 0.665 20.120 1.00 7.52 H new ATOM 0 HE2 MET A 191 -19.408 -0.273 19.758 1.00 7.52 H new ATOM 0 HE3 MET A 191 -17.969 -1.090 20.413 1.00 7.52 H new ATOM 2970 N GLY A 192 -22.288 -1.943 15.984 1.00 5.37 N ATOM 2971 CA GLY A 192 -23.537 -1.720 15.203 1.00 6.15 C ATOM 2972 C GLY A 192 -24.746 -2.157 16.032 1.00 6.68 C ATOM 2973 O GLY A 192 -25.396 -3.112 15.639 1.00 7.01 O ATOM 2974 OXT GLY A 192 -25.000 -1.531 17.048 1.00 7.06 O ATOM 0 H GLY A 192 -21.803 -1.096 16.280 1.00 5.37 H new ATOM 0 HA2 GLY A 192 -23.628 -0.667 14.936 1.00 6.15 H new ATOM 0 HA3 GLY A 192 -23.500 -2.283 14.270 1.00 6.15 H new TER 2978 GLY A 192