USER MOD reduce.3.24.130724 H: found=0, std=0, add=998, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 998 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 47 THR OG1 : rot 162:sc= 0.614 USER MOD Set 1.2: A 71 GLN : amide:sc= 0.968 K(o=1.6,f=0.65) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -125:sc= 0.0353 (180deg=-0.108) USER MOD Single : A 3 HIS : no HD1:sc= -0.506 K(o=-0.51,f=-1) USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 6 HIS : no HD1:sc= -0.299 X(o=-0.3,f=0.0029) USER MOD Single : A 7 HIS : no HD1:sc= -2.8! C(o=-2.8!,f=-6.9!) USER MOD Single : A 8 HIS : no HD1:sc= 0.746 K(o=0.75,f=-2.7!) USER MOD Single : A 9 MET CE :methyl -166:sc= -0.214 (180deg=-0.769) USER MOD Single : A 11 THR OG1 : rot 180:sc= -0.0706 USER MOD Single : A 15 GLN : amide:sc= 0.562 K(o=0.56,f=-0.053) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= 0 K(o=0,f=-0.84) USER MOD Single : A 21 SER OG : rot 109:sc= 1.41 USER MOD Single : A 22 MET CE :methyl -116:sc= -0.588 (180deg=-1.18) USER MOD Single : A 23 SER OG : rot -110:sc= 0.57 USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ -114:sc= 1.01 (180deg=0.155) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot -135:sc= -1.36 USER MOD Single : A 39 LYS NZ :NH3+ 167:sc= -0.0429 (180deg=-0.302) USER MOD Single : A 41 GLN : amide:sc= 0.0953 X(o=0.095,f=0) USER MOD Single : A 44 LYS NZ :NH3+ 153:sc= -2.47! (180deg=-5.02!) USER MOD Single : A 45 LYS NZ :NH3+ 173:sc=-0.00466 (180deg=-0.0524) USER MOD Single : A 49 HIS : no HE2:sc= -2.38! C(o=-2!,f=-12!) USER MOD Single : A 50 TYR OH : rot -16:sc= 0.329 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 GLN : amide:sc= 0.219 K(o=0.22,f=-5.4!) USER MOD Single : A 62 SER OG : rot 37:sc= 0.277 USER MOD Single : A 63 SER OG : rot -18:sc= 0.282 USER MOD Single : A 65 SER OG : rot -35:sc= 0.259 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 THR OG1 : rot 180:sc= -0.422 USER MOD Single : A 81 LYS NZ :NH3+ -165:sc= 1.22 (180deg=1.07) USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 THR OG1 : rot -48:sc= 0.614 USER MOD Single : A 90 MET CE :methyl 165:sc= -5.36! (180deg=-5.96!) USER MOD Single : A 91 THR OG1 : rot -150:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 162:sc= -0.114! (180deg=-0.683!) USER MOD Single : A 99 THR OG1 : rot -170:sc= 0.104 USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= -0.795 K(o=-0.8,f=0) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 150:sc= -1.85! (180deg=-4.1!) USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -6.626 -55.747 -26.163 1.00 3.40 N ATOM 2 CA MET A 1 -7.859 -54.949 -26.359 1.00 10.21 C ATOM 3 C MET A 1 -8.897 -55.756 -27.136 1.00 31.33 C ATOM 4 O MET A 1 -8.554 -56.698 -27.853 1.00 3.30 O ATOM 5 CB MET A 1 -7.541 -53.648 -27.112 1.00 73.31 C ATOM 6 CG MET A 1 -6.610 -52.709 -26.355 1.00 65.15 C ATOM 7 SD MET A 1 -7.317 -52.150 -24.791 1.00 4.42 S ATOM 8 CE MET A 1 -5.976 -51.150 -24.147 1.00 65.21 C ATOM 0 H1 MET A 1 -6.398 -55.790 -25.149 1.00 3.40 H new ATOM 0 H2 MET A 1 -6.775 -56.710 -26.526 1.00 3.40 H new ATOM 0 H3 MET A 1 -5.839 -55.301 -26.676 1.00 3.40 H new ATOM 0 HA MET A 1 -8.266 -54.700 -25.379 1.00 10.21 H new ATOM 0 HB2 MET A 1 -7.089 -53.897 -28.072 1.00 73.31 H new ATOM 0 HB3 MET A 1 -8.474 -53.126 -27.325 1.00 73.31 H new ATOM 0 HG2 MET A 1 -5.665 -53.217 -26.162 1.00 65.15 H new ATOM 0 HG3 MET A 1 -6.386 -51.844 -26.979 1.00 65.15 H new ATOM 0 HE1 MET A 1 -6.263 -50.734 -23.181 1.00 65.21 H new ATOM 0 HE2 MET A 1 -5.087 -51.768 -24.026 1.00 65.21 H new ATOM 0 HE3 MET A 1 -5.761 -50.338 -24.842 1.00 65.21 H new ATOM 20 N ALA A 2 -10.167 -55.387 -26.987 1.00 11.55 N ATOM 21 CA ALA A 2 -11.261 -56.042 -27.702 1.00 5.04 C ATOM 22 C ALA A 2 -12.343 -55.017 -28.032 1.00 60.10 C ATOM 23 O ALA A 2 -12.504 -54.615 -29.185 1.00 53.10 O ATOM 24 CB ALA A 2 -11.831 -57.193 -26.874 1.00 52.24 C ATOM 0 H ALA A 2 -10.466 -54.631 -26.372 1.00 11.55 H new ATOM 0 HA ALA A 2 -10.880 -56.461 -28.633 1.00 5.04 H new ATOM 0 HB1 ALA A 2 -12.644 -57.668 -27.423 1.00 52.24 H new ATOM 0 HB2 ALA A 2 -11.047 -57.925 -26.681 1.00 52.24 H new ATOM 0 HB3 ALA A 2 -12.209 -56.808 -25.927 1.00 52.24 H new ATOM 30 N HIS A 3 -13.053 -54.562 -27.004 1.00 21.32 N ATOM 31 CA HIS A 3 -14.058 -53.511 -27.163 1.00 71.41 C ATOM 32 C HIS A 3 -13.415 -52.157 -26.864 1.00 74.23 C ATOM 33 O HIS A 3 -13.877 -51.388 -26.021 1.00 21.43 O ATOM 34 CB HIS A 3 -15.281 -53.767 -26.259 1.00 10.53 C ATOM 35 CG HIS A 3 -14.984 -53.794 -24.786 1.00 12.00 C ATOM 36 ND1 HIS A 3 -15.196 -52.714 -23.958 1.00 64.50 N ATOM 37 CD2 HIS A 3 -14.512 -54.784 -23.992 1.00 70.35 C ATOM 38 CE1 HIS A 3 -14.866 -53.036 -22.722 1.00 44.42 C ATOM 39 NE2 HIS A 3 -14.451 -54.287 -22.715 1.00 50.14 N ATOM 0 H HIS A 3 -12.952 -54.905 -26.049 1.00 21.32 H new ATOM 0 HA HIS A 3 -14.421 -53.513 -28.191 1.00 71.41 H new ATOM 0 HB2 HIS A 3 -16.025 -52.994 -26.451 1.00 10.53 H new ATOM 0 HB3 HIS A 3 -15.731 -54.719 -26.542 1.00 10.53 H new ATOM 0 HD2 HIS A 3 -14.235 -55.780 -24.306 1.00 70.35 H new ATOM 0 HE1 HIS A 3 -14.926 -52.385 -21.862 1.00 44.42 H new ATOM 0 HE2 HIS A 3 -14.136 -54.802 -21.893 1.00 50.14 H new ATOM 48 N HIS A 4 -12.325 -51.892 -27.570 1.00 41.44 N ATOM 49 CA HIS A 4 -11.547 -50.675 -27.393 1.00 61.42 C ATOM 50 C HIS A 4 -11.101 -50.171 -28.763 1.00 34.24 C ATOM 51 O HIS A 4 -9.982 -50.442 -29.205 1.00 73.23 O ATOM 52 CB HIS A 4 -10.338 -50.964 -26.486 1.00 70.34 C ATOM 53 CG HIS A 4 -9.570 -49.752 -26.054 1.00 12.14 C ATOM 54 ND1 HIS A 4 -9.908 -49.012 -24.944 1.00 24.54 N ATOM 55 CD2 HIS A 4 -8.451 -49.179 -26.556 1.00 32.52 C ATOM 56 CE1 HIS A 4 -9.030 -48.040 -24.781 1.00 45.00 C ATOM 57 NE2 HIS A 4 -8.132 -48.119 -25.745 1.00 44.43 N ATOM 0 H HIS A 4 -11.954 -52.518 -28.285 1.00 41.44 H new ATOM 0 HA HIS A 4 -12.151 -49.904 -26.915 1.00 61.42 H new ATOM 0 HB2 HIS A 4 -10.686 -51.491 -25.598 1.00 70.34 H new ATOM 0 HB3 HIS A 4 -9.661 -51.637 -27.011 1.00 70.34 H new ATOM 0 HD2 HIS A 4 -7.909 -49.498 -27.434 1.00 32.52 H new ATOM 0 HE1 HIS A 4 -9.044 -47.304 -23.991 1.00 45.00 H new ATOM 0 HE2 HIS A 4 -7.334 -47.496 -25.867 1.00 44.43 H new ATOM 66 N HIS A 5 -12.004 -49.479 -29.450 1.00 33.34 N ATOM 67 CA HIS A 5 -11.770 -49.046 -30.827 1.00 30.04 C ATOM 68 C HIS A 5 -11.165 -47.642 -30.860 1.00 71.42 C ATOM 69 O HIS A 5 -9.964 -47.478 -31.091 1.00 43.00 O ATOM 70 CB HIS A 5 -13.082 -49.074 -31.629 1.00 43.53 C ATOM 71 CG HIS A 5 -13.693 -50.440 -31.769 1.00 2.34 C ATOM 72 ND1 HIS A 5 -13.567 -51.212 -32.904 1.00 73.32 N ATOM 73 CD2 HIS A 5 -14.456 -51.163 -30.912 1.00 13.00 C ATOM 74 CE1 HIS A 5 -14.224 -52.346 -32.739 1.00 45.42 C ATOM 75 NE2 HIS A 5 -14.773 -52.341 -31.539 1.00 75.32 N ATOM 0 H HIS A 5 -12.911 -49.203 -29.074 1.00 33.34 H new ATOM 0 HA HIS A 5 -11.062 -49.738 -31.284 1.00 30.04 H new ATOM 0 HB2 HIS A 5 -13.803 -48.414 -31.147 1.00 43.53 H new ATOM 0 HB3 HIS A 5 -12.895 -48.669 -32.623 1.00 43.53 H new ATOM 0 HD2 HIS A 5 -14.758 -50.866 -29.919 1.00 13.00 H new ATOM 0 HE1 HIS A 5 -14.299 -53.143 -33.464 1.00 45.42 H new ATOM 0 HE2 HIS A 5 -15.340 -53.090 -31.143 1.00 75.32 H new ATOM 84 N HIS A 6 -12.006 -46.637 -30.622 1.00 63.13 N ATOM 85 CA HIS A 6 -11.564 -45.243 -30.614 1.00 11.21 C ATOM 86 C HIS A 6 -10.608 -44.995 -29.447 1.00 65.13 C ATOM 87 O HIS A 6 -10.792 -45.541 -28.356 1.00 22.35 O ATOM 88 CB HIS A 6 -12.765 -44.285 -30.545 1.00 13.32 C ATOM 89 CG HIS A 6 -13.584 -44.405 -29.294 1.00 73.33 C ATOM 90 ND1 HIS A 6 -13.630 -43.426 -28.325 1.00 11.11 N ATOM 91 CD2 HIS A 6 -14.412 -45.389 -28.867 1.00 2.41 C ATOM 92 CE1 HIS A 6 -14.444 -43.804 -27.358 1.00 15.55 C ATOM 93 NE2 HIS A 6 -14.932 -44.990 -27.664 1.00 40.03 N ATOM 0 H HIS A 6 -13.000 -46.762 -30.432 1.00 63.13 H new ATOM 0 HA HIS A 6 -11.033 -45.048 -31.546 1.00 11.21 H new ATOM 0 HB2 HIS A 6 -12.402 -43.261 -30.630 1.00 13.32 H new ATOM 0 HB3 HIS A 6 -13.409 -44.467 -31.405 1.00 13.32 H new ATOM 0 HD2 HIS A 6 -14.623 -46.316 -29.380 1.00 2.41 H new ATOM 0 HE1 HIS A 6 -14.672 -43.238 -26.467 1.00 15.55 H new ATOM 0 HE2 HIS A 6 -15.590 -45.524 -27.097 1.00 40.03 H new ATOM 102 N HIS A 7 -9.593 -44.174 -29.687 1.00 35.24 N ATOM 103 CA HIS A 7 -8.530 -43.948 -28.710 1.00 21.22 C ATOM 104 C HIS A 7 -8.030 -42.504 -28.790 1.00 62.14 C ATOM 105 O HIS A 7 -6.834 -42.236 -28.674 1.00 65.32 O ATOM 106 CB HIS A 7 -7.389 -44.952 -28.966 1.00 40.00 C ATOM 107 CG HIS A 7 -6.218 -44.845 -28.027 1.00 5.42 C ATOM 108 ND1 HIS A 7 -6.302 -45.102 -26.675 1.00 32.01 N ATOM 109 CD2 HIS A 7 -4.923 -44.519 -28.263 1.00 63.42 C ATOM 110 CE1 HIS A 7 -5.112 -44.939 -26.124 1.00 15.31 C ATOM 111 NE2 HIS A 7 -4.261 -44.586 -27.065 1.00 2.11 N ATOM 0 H HIS A 7 -9.482 -43.650 -30.555 1.00 35.24 H new ATOM 0 HA HIS A 7 -8.916 -44.104 -27.703 1.00 21.22 H new ATOM 0 HB2 HIS A 7 -7.794 -45.962 -28.902 1.00 40.00 H new ATOM 0 HB3 HIS A 7 -7.030 -44.817 -29.986 1.00 40.00 H new ATOM 0 HD2 HIS A 7 -4.493 -44.255 -29.218 1.00 63.42 H new ATOM 0 HE1 HIS A 7 -4.877 -45.073 -25.078 1.00 15.31 H new ATOM 0 HE2 HIS A 7 -3.269 -44.394 -26.925 1.00 2.11 H new ATOM 120 N HIS A 8 -8.958 -41.567 -28.980 1.00 54.52 N ATOM 121 CA HIS A 8 -8.609 -40.148 -28.993 1.00 71.42 C ATOM 122 C HIS A 8 -8.113 -39.720 -27.612 1.00 60.23 C ATOM 123 O HIS A 8 -8.892 -39.266 -26.769 1.00 64.12 O ATOM 124 CB HIS A 8 -9.803 -39.282 -29.429 1.00 2.44 C ATOM 125 CG HIS A 8 -9.505 -37.804 -29.447 1.00 43.31 C ATOM 126 ND1 HIS A 8 -8.974 -37.153 -30.542 1.00 41.21 N ATOM 127 CD2 HIS A 8 -9.666 -36.851 -28.492 1.00 73.24 C ATOM 128 CE1 HIS A 8 -8.822 -35.871 -30.261 1.00 22.34 C ATOM 129 NE2 HIS A 8 -9.234 -35.663 -29.025 1.00 54.34 N ATOM 0 H HIS A 8 -9.948 -41.763 -29.126 1.00 54.52 H new ATOM 0 HA HIS A 8 -7.811 -40.000 -29.720 1.00 71.42 H new ATOM 0 HB2 HIS A 8 -10.121 -39.592 -30.425 1.00 2.44 H new ATOM 0 HB3 HIS A 8 -10.640 -39.467 -28.755 1.00 2.44 H new ATOM 0 HD2 HIS A 8 -10.061 -37.001 -27.498 1.00 73.24 H new ATOM 0 HE1 HIS A 8 -8.427 -35.120 -30.930 1.00 22.34 H new ATOM 0 HE2 HIS A 8 -9.232 -34.764 -28.543 1.00 54.34 H new ATOM 138 N MET A 9 -6.822 -39.912 -27.380 1.00 34.13 N ATOM 139 CA MET A 9 -6.194 -39.557 -26.111 1.00 52.34 C ATOM 140 C MET A 9 -5.405 -38.260 -26.261 1.00 10.22 C ATOM 141 O MET A 9 -4.717 -37.823 -25.335 1.00 4.13 O ATOM 142 CB MET A 9 -5.273 -40.694 -25.638 1.00 35.21 C ATOM 143 CG MET A 9 -3.994 -40.849 -26.457 1.00 10.04 C ATOM 144 SD MET A 9 -3.037 -42.312 -25.997 1.00 4.34 S ATOM 145 CE MET A 9 -2.965 -42.140 -24.214 1.00 21.11 C ATOM 0 H MET A 9 -6.181 -40.317 -28.062 1.00 34.13 H new ATOM 0 HA MET A 9 -6.972 -39.407 -25.362 1.00 52.34 H new ATOM 0 HB2 MET A 9 -5.004 -40.519 -24.596 1.00 35.21 H new ATOM 0 HB3 MET A 9 -5.827 -41.632 -25.671 1.00 35.21 H new ATOM 0 HG2 MET A 9 -4.251 -40.907 -27.515 1.00 10.04 H new ATOM 0 HG3 MET A 9 -3.376 -39.961 -26.327 1.00 10.04 H new ATOM 0 HE1 MET A 9 -2.210 -42.816 -23.813 1.00 21.11 H new ATOM 0 HE2 MET A 9 -2.705 -41.113 -23.958 1.00 21.11 H new ATOM 0 HE3 MET A 9 -3.936 -42.386 -23.785 1.00 21.11 H new ATOM 155 N GLY A 10 -5.503 -37.662 -27.448 1.00 72.52 N ATOM 156 CA GLY A 10 -4.853 -36.391 -27.712 1.00 63.23 C ATOM 157 C GLY A 10 -5.574 -35.226 -27.059 1.00 1.24 C ATOM 158 O GLY A 10 -6.327 -35.410 -26.098 1.00 31.32 O ATOM 0 H GLY A 10 -6.027 -38.041 -28.237 1.00 72.52 H new ATOM 0 HA2 GLY A 10 -3.826 -36.429 -27.349 1.00 63.23 H new ATOM 0 HA3 GLY A 10 -4.805 -36.227 -28.789 1.00 63.23 H new ATOM 162 N THR A 11 -5.361 -34.027 -27.589 1.00 0.32 N ATOM 163 CA THR A 11 -5.934 -32.820 -27.007 1.00 22.11 C ATOM 164 C THR A 11 -7.416 -32.673 -27.341 1.00 23.13 C ATOM 165 O THR A 11 -7.962 -33.380 -28.195 1.00 3.55 O ATOM 166 CB THR A 11 -5.189 -31.546 -27.477 1.00 61.11 C ATOM 167 OG1 THR A 11 -5.672 -30.400 -26.757 1.00 12.15 O ATOM 168 CG2 THR A 11 -5.375 -31.317 -28.977 1.00 23.11 C ATOM 0 H THR A 11 -4.795 -33.865 -28.422 1.00 0.32 H new ATOM 0 HA THR A 11 -5.821 -32.926 -25.928 1.00 22.11 H new ATOM 0 HB THR A 11 -4.127 -31.687 -27.277 1.00 61.11 H new ATOM 0 HG1 THR A 11 -5.195 -29.599 -27.059 1.00 12.15 H new ATOM 0 HG21 THR A 11 -4.840 -30.416 -29.276 1.00 23.11 H new ATOM 0 HG22 THR A 11 -4.982 -32.172 -29.527 1.00 23.11 H new ATOM 0 HG23 THR A 11 -6.436 -31.200 -29.198 1.00 23.11 H new ATOM 176 N LEU A 12 -8.045 -31.749 -26.635 1.00 23.05 N ATOM 177 CA LEU A 12 -9.430 -31.362 -26.863 1.00 13.01 C ATOM 178 C LEU A 12 -9.640 -29.964 -26.284 1.00 72.23 C ATOM 179 O LEU A 12 -10.767 -29.496 -26.123 1.00 0.21 O ATOM 180 CB LEU A 12 -10.405 -32.367 -26.214 1.00 64.41 C ATOM 181 CG LEU A 12 -10.362 -32.467 -24.671 1.00 51.22 C ATOM 182 CD1 LEU A 12 -11.553 -33.271 -24.152 1.00 51.14 C ATOM 183 CD2 LEU A 12 -9.052 -33.101 -24.196 1.00 60.24 C ATOM 0 H LEU A 12 -7.601 -31.236 -25.873 1.00 23.05 H new ATOM 0 HA LEU A 12 -9.634 -31.360 -27.934 1.00 13.01 H new ATOM 0 HB2 LEU A 12 -11.419 -32.100 -26.511 1.00 64.41 H new ATOM 0 HB3 LEU A 12 -10.202 -33.355 -26.626 1.00 64.41 H new ATOM 0 HG LEU A 12 -10.418 -31.455 -24.269 1.00 51.22 H new ATOM 0 HD11 LEU A 12 -11.506 -33.331 -23.065 1.00 51.14 H new ATOM 0 HD12 LEU A 12 -12.480 -32.780 -24.449 1.00 51.14 H new ATOM 0 HD13 LEU A 12 -11.524 -34.276 -24.572 1.00 51.14 H new ATOM 0 HD21 LEU A 12 -9.049 -33.159 -23.108 1.00 60.24 H new ATOM 0 HD22 LEU A 12 -8.961 -34.104 -24.613 1.00 60.24 H new ATOM 0 HD23 LEU A 12 -8.211 -32.492 -24.529 1.00 60.24 H new ATOM 195 N GLU A 13 -8.520 -29.299 -26.006 1.00 22.00 N ATOM 196 CA GLU A 13 -8.510 -28.020 -25.307 1.00 22.14 C ATOM 197 C GLU A 13 -8.341 -26.874 -26.300 1.00 41.33 C ATOM 198 O GLU A 13 -8.082 -27.110 -27.482 1.00 42.24 O ATOM 199 CB GLU A 13 -7.358 -28.011 -24.292 1.00 43.13 C ATOM 200 CG GLU A 13 -7.403 -29.173 -23.304 1.00 63.33 C ATOM 201 CD GLU A 13 -6.148 -29.270 -22.452 1.00 30.35 C ATOM 202 OE1 GLU A 13 -6.012 -28.480 -21.492 1.00 43.21 O ATOM 203 OE2 GLU A 13 -5.294 -30.142 -22.729 1.00 14.15 O ATOM 0 H GLU A 13 -7.592 -29.635 -26.261 1.00 22.00 H new ATOM 0 HA GLU A 13 -9.458 -27.886 -24.786 1.00 22.14 H new ATOM 0 HB2 GLU A 13 -6.411 -28.040 -24.830 1.00 43.13 H new ATOM 0 HB3 GLU A 13 -7.381 -27.073 -23.738 1.00 43.13 H new ATOM 0 HG2 GLU A 13 -8.270 -29.058 -22.654 1.00 63.33 H new ATOM 0 HG3 GLU A 13 -7.537 -30.105 -23.852 1.00 63.33 H new ATOM 210 N ALA A 14 -8.490 -25.641 -25.809 1.00 14.03 N ATOM 211 CA ALA A 14 -8.335 -24.441 -26.636 1.00 33.23 C ATOM 212 C ALA A 14 -9.259 -24.508 -27.853 1.00 11.25 C ATOM 213 O ALA A 14 -8.906 -24.064 -28.946 1.00 22.03 O ATOM 214 CB ALA A 14 -6.875 -24.272 -27.060 1.00 1.45 C ATOM 0 H ALA A 14 -8.720 -25.447 -24.834 1.00 14.03 H new ATOM 0 HA ALA A 14 -8.619 -23.569 -26.046 1.00 33.23 H new ATOM 0 HB1 ALA A 14 -6.776 -23.377 -27.674 1.00 1.45 H new ATOM 0 HB2 ALA A 14 -6.248 -24.176 -26.174 1.00 1.45 H new ATOM 0 HB3 ALA A 14 -6.560 -25.143 -27.635 1.00 1.45 H new ATOM 220 N GLN A 15 -10.458 -25.046 -27.639 1.00 71.12 N ATOM 221 CA GLN A 15 -11.416 -25.268 -28.717 1.00 54.40 C ATOM 222 C GLN A 15 -11.915 -23.941 -29.301 1.00 43.42 C ATOM 223 O GLN A 15 -12.520 -23.918 -30.378 1.00 31.11 O ATOM 224 CB GLN A 15 -12.592 -26.116 -28.205 1.00 11.24 C ATOM 225 CG GLN A 15 -13.603 -26.491 -29.283 1.00 43.33 C ATOM 226 CD GLN A 15 -12.981 -27.265 -30.437 1.00 41.31 C ATOM 227 OE1 GLN A 15 -12.938 -28.495 -30.427 1.00 20.25 O ATOM 228 NE2 GLN A 15 -12.489 -26.548 -31.441 1.00 24.31 N ATOM 0 H GLN A 15 -10.790 -25.338 -26.720 1.00 71.12 H new ATOM 0 HA GLN A 15 -10.913 -25.809 -29.519 1.00 54.40 H new ATOM 0 HB2 GLN A 15 -12.200 -27.029 -27.756 1.00 11.24 H new ATOM 0 HB3 GLN A 15 -13.105 -25.567 -27.415 1.00 11.24 H new ATOM 0 HG2 GLN A 15 -14.397 -27.090 -28.837 1.00 43.33 H new ATOM 0 HG3 GLN A 15 -14.067 -25.584 -29.669 1.00 43.33 H new ATOM 0 HE21 GLN A 15 -12.543 -25.530 -31.415 1.00 24.31 H new ATOM 0 HE22 GLN A 15 -12.058 -27.016 -32.238 1.00 24.31 H new ATOM 237 N THR A 16 -11.665 -22.842 -28.592 1.00 0.12 N ATOM 238 CA THR A 16 -12.025 -21.515 -29.079 1.00 75.23 C ATOM 239 C THR A 16 -11.314 -21.227 -30.407 1.00 40.03 C ATOM 240 O THR A 16 -10.218 -20.665 -30.439 1.00 21.31 O ATOM 241 CB THR A 16 -11.678 -20.425 -28.038 1.00 75.20 C ATOM 242 OG1 THR A 16 -12.267 -20.764 -26.772 1.00 44.10 O ATOM 243 CG2 THR A 16 -12.178 -19.048 -28.481 1.00 2.15 C ATOM 0 H THR A 16 -11.214 -22.846 -27.677 1.00 0.12 H new ATOM 0 HA THR A 16 -13.103 -21.495 -29.242 1.00 75.23 H new ATOM 0 HB THR A 16 -10.593 -20.379 -27.946 1.00 75.20 H new ATOM 0 HG1 THR A 16 -12.045 -20.074 -26.113 1.00 44.10 H new ATOM 0 HG21 THR A 16 -11.917 -18.306 -27.726 1.00 2.15 H new ATOM 0 HG22 THR A 16 -11.713 -18.780 -29.430 1.00 2.15 H new ATOM 0 HG23 THR A 16 -13.261 -19.076 -28.603 1.00 2.15 H new ATOM 251 N GLN A 17 -11.950 -21.648 -31.498 1.00 23.22 N ATOM 252 CA GLN A 17 -11.374 -21.552 -32.839 1.00 3.02 C ATOM 253 C GLN A 17 -11.441 -20.122 -33.382 1.00 51.13 C ATOM 254 O GLN A 17 -10.917 -19.834 -34.459 1.00 53.23 O ATOM 255 CB GLN A 17 -12.114 -22.515 -33.782 1.00 70.42 C ATOM 256 CG GLN A 17 -13.603 -22.209 -33.938 1.00 72.33 C ATOM 257 CD GLN A 17 -14.363 -23.290 -34.691 1.00 71.23 C ATOM 258 OE1 GLN A 17 -14.017 -24.472 -34.631 1.00 71.31 O ATOM 259 NE2 GLN A 17 -15.408 -22.892 -35.400 1.00 44.13 N ATOM 0 H GLN A 17 -12.880 -22.066 -31.478 1.00 23.22 H new ATOM 0 HA GLN A 17 -10.321 -21.829 -32.780 1.00 3.02 H new ATOM 0 HB2 GLN A 17 -11.642 -22.481 -34.764 1.00 70.42 H new ATOM 0 HB3 GLN A 17 -12.000 -23.533 -33.409 1.00 70.42 H new ATOM 0 HG2 GLN A 17 -14.047 -22.084 -32.950 1.00 72.33 H new ATOM 0 HG3 GLN A 17 -13.719 -21.260 -34.462 1.00 72.33 H new ATOM 0 HE21 GLN A 17 -15.662 -21.904 -35.424 1.00 44.13 H new ATOM 0 HE22 GLN A 17 -15.959 -23.573 -35.922 1.00 44.13 H new ATOM 268 N GLY A 18 -12.099 -19.239 -32.638 1.00 10.21 N ATOM 269 CA GLY A 18 -12.223 -17.853 -33.048 1.00 61.13 C ATOM 270 C GLY A 18 -13.357 -17.154 -32.326 1.00 70.32 C ATOM 271 O GLY A 18 -14.139 -17.809 -31.633 1.00 74.25 O ATOM 0 H GLY A 18 -12.552 -19.462 -31.752 1.00 10.21 H new ATOM 0 HA2 GLY A 18 -11.288 -17.330 -32.849 1.00 61.13 H new ATOM 0 HA3 GLY A 18 -12.392 -17.806 -34.124 1.00 61.13 H new ATOM 275 N PRO A 19 -13.474 -15.822 -32.468 1.00 71.50 N ATOM 276 CA PRO A 19 -14.537 -15.048 -31.821 1.00 35.41 C ATOM 277 C PRO A 19 -15.894 -15.257 -32.499 1.00 54.13 C ATOM 278 O PRO A 19 -16.034 -15.073 -33.710 1.00 73.40 O ATOM 279 CB PRO A 19 -14.057 -13.598 -31.973 1.00 23.33 C ATOM 280 CG PRO A 19 -13.225 -13.605 -33.213 1.00 14.54 C ATOM 281 CD PRO A 19 -12.575 -14.966 -33.270 1.00 31.43 C ATOM 0 HA PRO A 19 -14.697 -15.343 -30.784 1.00 35.41 H new ATOM 0 HB2 PRO A 19 -14.897 -12.910 -32.063 1.00 23.33 H new ATOM 0 HB3 PRO A 19 -13.476 -13.280 -31.107 1.00 23.33 H new ATOM 0 HG2 PRO A 19 -13.839 -13.429 -34.096 1.00 14.54 H new ATOM 0 HG3 PRO A 19 -12.475 -12.815 -33.184 1.00 14.54 H new ATOM 0 HD2 PRO A 19 -12.490 -15.326 -34.295 1.00 31.43 H new ATOM 0 HD3 PRO A 19 -11.567 -14.945 -32.855 1.00 31.43 H new ATOM 289 N GLY A 20 -16.887 -15.655 -31.711 1.00 31.23 N ATOM 290 CA GLY A 20 -18.231 -15.855 -32.227 1.00 1.24 C ATOM 291 C GLY A 20 -19.220 -14.895 -31.596 1.00 25.15 C ATOM 292 O GLY A 20 -20.418 -15.180 -31.518 1.00 53.44 O ATOM 0 H GLY A 20 -16.784 -15.845 -30.714 1.00 31.23 H new ATOM 0 HA2 GLY A 20 -18.230 -15.719 -33.308 1.00 1.24 H new ATOM 0 HA3 GLY A 20 -18.546 -16.881 -32.035 1.00 1.24 H new ATOM 296 N SER A 21 -18.708 -13.761 -31.130 1.00 21.21 N ATOM 297 CA SER A 21 -19.526 -12.732 -30.500 1.00 53.15 C ATOM 298 C SER A 21 -18.816 -11.381 -30.597 1.00 14.20 C ATOM 299 O SER A 21 -17.682 -11.310 -31.083 1.00 73.52 O ATOM 300 CB SER A 21 -19.789 -13.093 -29.030 1.00 54.50 C ATOM 301 OG SER A 21 -18.570 -13.247 -28.311 1.00 2.55 O ATOM 0 H SER A 21 -17.716 -13.530 -31.178 1.00 21.21 H new ATOM 0 HA SER A 21 -20.483 -12.668 -31.017 1.00 53.15 H new ATOM 0 HB2 SER A 21 -20.393 -12.314 -28.564 1.00 54.50 H new ATOM 0 HB3 SER A 21 -20.365 -14.017 -28.977 1.00 54.50 H new ATOM 0 HG SER A 21 -18.458 -12.495 -27.693 1.00 2.55 H new ATOM 307 N MET A 22 -19.482 -10.322 -30.128 1.00 23.10 N ATOM 308 CA MET A 22 -18.920 -8.971 -30.149 1.00 1.00 C ATOM 309 C MET A 22 -18.759 -8.492 -31.589 1.00 72.15 C ATOM 310 O MET A 22 -17.660 -8.153 -32.030 1.00 54.32 O ATOM 311 CB MET A 22 -17.573 -8.908 -29.400 1.00 40.45 C ATOM 312 CG MET A 22 -17.669 -8.988 -27.876 1.00 23.11 C ATOM 313 SD MET A 22 -18.532 -10.463 -27.280 1.00 11.22 S ATOM 314 CE MET A 22 -20.206 -9.845 -27.088 1.00 2.32 C ATOM 0 H MET A 22 -20.418 -10.377 -29.726 1.00 23.10 H new ATOM 0 HA MET A 22 -19.613 -8.308 -29.632 1.00 1.00 H new ATOM 0 HB2 MET A 22 -16.942 -9.724 -29.751 1.00 40.45 H new ATOM 0 HB3 MET A 22 -17.070 -7.979 -29.668 1.00 40.45 H new ATOM 0 HG2 MET A 22 -16.663 -8.971 -27.456 1.00 23.11 H new ATOM 0 HG3 MET A 22 -18.184 -8.102 -27.506 1.00 23.11 H new ATOM 0 HE1 MET A 22 -20.490 -9.884 -26.036 1.00 2.32 H new ATOM 0 HE2 MET A 22 -20.256 -8.814 -27.439 1.00 2.32 H new ATOM 0 HE3 MET A 22 -20.890 -10.461 -27.672 1.00 2.32 H new ATOM 324 N SER A 23 -19.874 -8.456 -32.310 1.00 10.14 N ATOM 325 CA SER A 23 -19.896 -8.039 -33.713 1.00 32.11 C ATOM 326 C SER A 23 -19.792 -6.510 -33.848 1.00 62.52 C ATOM 327 O SER A 23 -20.410 -5.906 -34.730 1.00 32.10 O ATOM 328 CB SER A 23 -21.185 -8.551 -34.372 1.00 71.33 C ATOM 329 OG SER A 23 -21.289 -9.962 -34.258 1.00 5.30 O ATOM 0 H SER A 23 -20.789 -8.714 -31.941 1.00 10.14 H new ATOM 0 HA SER A 23 -19.031 -8.468 -34.218 1.00 32.11 H new ATOM 0 HB2 SER A 23 -22.049 -8.080 -33.903 1.00 71.33 H new ATOM 0 HB3 SER A 23 -21.198 -8.266 -35.424 1.00 71.33 H new ATOM 0 HG SER A 23 -21.169 -10.371 -35.140 1.00 5.30 H new ATOM 335 N ALA A 24 -18.985 -5.895 -32.991 1.00 60.44 N ATOM 336 CA ALA A 24 -18.773 -4.456 -33.019 1.00 54.02 C ATOM 337 C ALA A 24 -17.351 -4.129 -32.574 1.00 62.11 C ATOM 338 O ALA A 24 -17.081 -3.955 -31.382 1.00 62.02 O ATOM 339 CB ALA A 24 -19.799 -3.740 -32.145 1.00 34.21 C ATOM 0 H ALA A 24 -18.462 -6.379 -32.261 1.00 60.44 H new ATOM 0 HA ALA A 24 -18.905 -4.102 -34.042 1.00 54.02 H new ATOM 0 HB1 ALA A 24 -19.621 -2.665 -32.181 1.00 34.21 H new ATOM 0 HB2 ALA A 24 -20.803 -3.954 -32.512 1.00 34.21 H new ATOM 0 HB3 ALA A 24 -19.707 -4.088 -31.116 1.00 34.21 H new ATOM 345 N GLN A 25 -16.439 -4.102 -33.536 1.00 52.11 N ATOM 346 CA GLN A 25 -15.043 -3.760 -33.284 1.00 33.31 C ATOM 347 C GLN A 25 -14.577 -2.739 -34.311 1.00 11.54 C ATOM 348 O GLN A 25 -14.861 -2.880 -35.500 1.00 33.33 O ATOM 349 CB GLN A 25 -14.151 -5.010 -33.359 1.00 24.32 C ATOM 350 CG GLN A 25 -14.425 -6.042 -32.270 1.00 62.34 C ATOM 351 CD GLN A 25 -13.524 -7.261 -32.391 1.00 50.24 C ATOM 352 OE1 GLN A 25 -13.875 -8.247 -33.040 1.00 54.31 O ATOM 353 NE2 GLN A 25 -12.354 -7.201 -31.774 1.00 0.52 N ATOM 0 H GLN A 25 -16.644 -4.316 -34.512 1.00 52.11 H new ATOM 0 HA GLN A 25 -14.965 -3.339 -32.282 1.00 33.31 H new ATOM 0 HB2 GLN A 25 -14.287 -5.481 -34.332 1.00 24.32 H new ATOM 0 HB3 GLN A 25 -13.107 -4.702 -33.297 1.00 24.32 H new ATOM 0 HG2 GLN A 25 -14.281 -5.582 -31.292 1.00 62.34 H new ATOM 0 HG3 GLN A 25 -15.467 -6.356 -32.324 1.00 62.34 H new ATOM 0 HE21 GLN A 25 -12.098 -6.367 -31.246 1.00 0.52 H new ATOM 0 HE22 GLN A 25 -11.708 -7.989 -31.827 1.00 0.52 H new ATOM 362 N LEU A 26 -13.873 -1.713 -33.848 1.00 30.13 N ATOM 363 CA LEU A 26 -13.322 -0.698 -34.736 1.00 12.14 C ATOM 364 C LEU A 26 -11.985 -0.209 -34.184 1.00 51.43 C ATOM 365 O LEU A 26 -11.939 0.560 -33.220 1.00 61.15 O ATOM 366 CB LEU A 26 -14.320 0.469 -34.907 1.00 71.53 C ATOM 367 CG LEU A 26 -14.074 1.404 -36.115 1.00 4.02 C ATOM 368 CD1 LEU A 26 -15.306 2.269 -36.378 1.00 1.33 C ATOM 369 CD2 LEU A 26 -12.846 2.294 -35.901 1.00 14.44 C ATOM 0 H LEU A 26 -13.670 -1.562 -32.860 1.00 30.13 H new ATOM 0 HA LEU A 26 -13.152 -1.132 -35.721 1.00 12.14 H new ATOM 0 HB2 LEU A 26 -15.323 0.052 -34.995 1.00 71.53 H new ATOM 0 HB3 LEU A 26 -14.303 1.071 -33.998 1.00 71.53 H new ATOM 0 HG LEU A 26 -13.884 0.774 -36.984 1.00 4.02 H new ATOM 0 HD11 LEU A 26 -15.117 2.921 -37.231 1.00 1.33 H new ATOM 0 HD12 LEU A 26 -16.161 1.628 -36.593 1.00 1.33 H new ATOM 0 HD13 LEU A 26 -15.520 2.875 -35.498 1.00 1.33 H new ATOM 0 HD21 LEU A 26 -12.706 2.936 -36.771 1.00 14.44 H new ATOM 0 HD22 LEU A 26 -12.994 2.911 -35.014 1.00 14.44 H new ATOM 0 HD23 LEU A 26 -11.963 1.669 -35.765 1.00 14.44 H new ATOM 381 N GLU A 27 -10.901 -0.691 -34.776 1.00 2.20 N ATOM 382 CA GLU A 27 -9.558 -0.246 -34.429 1.00 14.02 C ATOM 383 C GLU A 27 -8.858 0.318 -35.657 1.00 65.33 C ATOM 384 O GLU A 27 -9.132 -0.104 -36.788 1.00 60.33 O ATOM 385 CB GLU A 27 -8.734 -1.402 -33.847 1.00 53.11 C ATOM 386 CG GLU A 27 -9.229 -1.899 -32.491 1.00 1.14 C ATOM 387 CD GLU A 27 -8.376 -3.029 -31.936 1.00 4.22 C ATOM 388 OE1 GLU A 27 -7.193 -2.786 -31.615 1.00 43.34 O ATOM 389 OE2 GLU A 27 -8.886 -4.162 -31.807 1.00 35.30 O ATOM 0 H GLU A 27 -10.927 -1.400 -35.509 1.00 2.20 H new ATOM 0 HA GLU A 27 -9.643 0.535 -33.674 1.00 14.02 H new ATOM 0 HB2 GLU A 27 -8.745 -2.233 -34.552 1.00 53.11 H new ATOM 0 HB3 GLU A 27 -7.697 -1.081 -33.748 1.00 53.11 H new ATOM 0 HG2 GLU A 27 -9.232 -1.070 -31.783 1.00 1.14 H new ATOM 0 HG3 GLU A 27 -10.260 -2.240 -32.587 1.00 1.14 H new ATOM 396 N LYS A 28 -7.967 1.274 -35.422 1.00 20.23 N ATOM 397 CA LYS A 28 -7.164 1.881 -36.475 1.00 1.42 C ATOM 398 C LYS A 28 -5.687 1.827 -36.084 1.00 24.22 C ATOM 399 O LYS A 28 -5.231 2.582 -35.224 1.00 43.22 O ATOM 400 CB LYS A 28 -7.606 3.339 -36.721 1.00 13.42 C ATOM 401 CG LYS A 28 -7.654 4.199 -35.454 1.00 53.12 C ATOM 402 CD LYS A 28 -7.761 5.692 -35.767 1.00 50.34 C ATOM 403 CE LYS A 28 -9.066 6.051 -36.472 1.00 71.00 C ATOM 404 NZ LYS A 28 -9.173 7.514 -36.716 1.00 31.34 N ATOM 0 H LYS A 28 -7.781 1.651 -34.493 1.00 20.23 H new ATOM 0 HA LYS A 28 -7.309 1.324 -37.401 1.00 1.42 H new ATOM 0 HB2 LYS A 28 -6.922 3.799 -37.434 1.00 13.42 H new ATOM 0 HB3 LYS A 28 -8.593 3.335 -37.183 1.00 13.42 H new ATOM 0 HG2 LYS A 28 -8.506 3.896 -34.845 1.00 53.12 H new ATOM 0 HG3 LYS A 28 -6.757 4.018 -34.861 1.00 53.12 H new ATOM 0 HD2 LYS A 28 -7.685 6.260 -34.840 1.00 50.34 H new ATOM 0 HD3 LYS A 28 -6.920 5.989 -36.393 1.00 50.34 H new ATOM 0 HE2 LYS A 28 -9.126 5.518 -37.421 1.00 71.00 H new ATOM 0 HE3 LYS A 28 -9.910 5.720 -35.867 1.00 71.00 H new ATOM 0 HZ1 LYS A 28 -10.072 7.721 -37.196 1.00 31.34 H new ATOM 0 HZ2 LYS A 28 -9.141 8.021 -35.808 1.00 31.34 H new ATOM 0 HZ3 LYS A 28 -8.381 7.825 -37.314 1.00 31.34 H new ATOM 418 N LYS A 29 -4.944 0.909 -36.687 1.00 10.31 N ATOM 419 CA LYS A 29 -3.528 0.753 -36.371 1.00 4.51 C ATOM 420 C LYS A 29 -2.681 1.240 -37.540 1.00 32.22 C ATOM 421 O LYS A 29 -2.664 0.620 -38.600 1.00 50.14 O ATOM 422 CB LYS A 29 -3.210 -0.719 -36.064 1.00 34.44 C ATOM 423 CG LYS A 29 -4.073 -1.314 -34.953 1.00 63.44 C ATOM 424 CD LYS A 29 -3.729 -2.778 -34.683 1.00 73.32 C ATOM 425 CE LYS A 29 -4.660 -3.395 -33.643 1.00 34.34 C ATOM 426 NZ LYS A 29 -4.538 -2.736 -32.316 1.00 5.41 N ATOM 0 H LYS A 29 -5.295 0.263 -37.394 1.00 10.31 H new ATOM 0 HA LYS A 29 -3.295 1.350 -35.489 1.00 4.51 H new ATOM 0 HB2 LYS A 29 -3.345 -1.308 -36.971 1.00 34.44 H new ATOM 0 HB3 LYS A 29 -2.161 -0.804 -35.782 1.00 34.44 H new ATOM 0 HG2 LYS A 29 -3.937 -0.735 -34.039 1.00 63.44 H new ATOM 0 HG3 LYS A 29 -5.125 -1.233 -35.228 1.00 63.44 H new ATOM 0 HD2 LYS A 29 -3.795 -3.344 -35.612 1.00 73.32 H new ATOM 0 HD3 LYS A 29 -2.698 -2.852 -34.337 1.00 73.32 H new ATOM 0 HE2 LYS A 29 -5.690 -3.319 -33.990 1.00 34.34 H new ATOM 0 HE3 LYS A 29 -4.435 -4.457 -33.541 1.00 34.34 H new ATOM 0 HZ1 LYS A 29 -4.144 -3.410 -31.629 1.00 5.41 H new ATOM 0 HZ2 LYS A 29 -3.908 -1.913 -32.394 1.00 5.41 H new ATOM 0 HZ3 LYS A 29 -5.477 -2.424 -31.996 1.00 5.41 H new ATOM 440 N VAL A 30 -1.991 2.359 -37.350 1.00 1.11 N ATOM 441 CA VAL A 30 -1.136 2.907 -38.393 1.00 62.04 C ATOM 442 C VAL A 30 0.113 2.037 -38.562 1.00 61.23 C ATOM 443 O VAL A 30 1.079 2.142 -37.802 1.00 52.32 O ATOM 444 CB VAL A 30 -0.758 4.388 -38.106 1.00 12.12 C ATOM 445 CG1 VAL A 30 -0.120 4.550 -36.723 1.00 33.10 C ATOM 446 CG2 VAL A 30 0.154 4.941 -39.203 1.00 70.43 C ATOM 0 H VAL A 30 -2.007 2.902 -36.486 1.00 1.11 H new ATOM 0 HA VAL A 30 -1.694 2.898 -39.329 1.00 62.04 H new ATOM 0 HB VAL A 30 -1.680 4.969 -38.108 1.00 12.12 H new ATOM 0 HG11 VAL A 30 0.131 5.598 -36.558 1.00 33.10 H new ATOM 0 HG12 VAL A 30 -0.822 4.220 -35.957 1.00 33.10 H new ATOM 0 HG13 VAL A 30 0.786 3.947 -36.668 1.00 33.10 H new ATOM 0 HG21 VAL A 30 0.404 5.978 -38.980 1.00 70.43 H new ATOM 0 HG22 VAL A 30 1.068 4.349 -39.249 1.00 70.43 H new ATOM 0 HG23 VAL A 30 -0.360 4.890 -40.163 1.00 70.43 H new ATOM 456 N LEU A 31 0.068 1.142 -39.547 1.00 3.31 N ATOM 457 CA LEU A 31 1.169 0.214 -39.793 1.00 51.44 C ATOM 458 C LEU A 31 2.308 0.943 -40.500 1.00 63.53 C ATOM 459 O LEU A 31 3.480 0.590 -40.355 1.00 71.22 O ATOM 460 CB LEU A 31 0.686 -0.979 -40.639 1.00 73.13 C ATOM 461 CG LEU A 31 1.697 -2.129 -40.794 1.00 33.10 C ATOM 462 CD1 LEU A 31 2.013 -2.755 -39.436 1.00 41.32 C ATOM 463 CD2 LEU A 31 1.175 -3.185 -41.769 1.00 61.33 C ATOM 0 H LEU A 31 -0.719 1.040 -40.188 1.00 3.31 H new ATOM 0 HA LEU A 31 1.532 -0.168 -38.839 1.00 51.44 H new ATOM 0 HB2 LEU A 31 -0.225 -1.376 -40.190 1.00 73.13 H new ATOM 0 HB3 LEU A 31 0.420 -0.615 -41.631 1.00 73.13 H new ATOM 0 HG LEU A 31 2.619 -1.718 -41.204 1.00 33.10 H new ATOM 0 HD11 LEU A 31 2.729 -3.566 -39.567 1.00 41.32 H new ATOM 0 HD12 LEU A 31 2.438 -1.998 -38.777 1.00 41.32 H new ATOM 0 HD13 LEU A 31 1.097 -3.148 -38.994 1.00 41.32 H new ATOM 0 HD21 LEU A 31 1.907 -3.988 -41.862 1.00 61.33 H new ATOM 0 HD22 LEU A 31 0.235 -3.592 -41.396 1.00 61.33 H new ATOM 0 HD23 LEU A 31 1.010 -2.729 -42.745 1.00 61.33 H new ATOM 475 N THR A 32 1.948 1.961 -41.269 1.00 73.42 N ATOM 476 CA THR A 32 2.918 2.805 -41.951 1.00 63.14 C ATOM 477 C THR A 32 2.401 4.243 -42.009 1.00 74.03 C ATOM 478 O THR A 32 1.364 4.496 -42.617 1.00 24.43 O ATOM 479 CB THR A 32 3.186 2.294 -43.389 1.00 71.24 C ATOM 480 OG1 THR A 32 3.549 0.906 -43.356 1.00 42.12 O ATOM 481 CG2 THR A 32 4.293 3.093 -44.070 1.00 61.24 C ATOM 0 H THR A 32 0.977 2.224 -41.437 1.00 73.42 H new ATOM 0 HA THR A 32 3.853 2.771 -41.392 1.00 63.14 H new ATOM 0 HB THR A 32 2.269 2.423 -43.964 1.00 71.24 H new ATOM 0 HG1 THR A 32 3.715 0.590 -44.268 1.00 42.12 H new ATOM 0 HG21 THR A 32 4.454 2.707 -45.077 1.00 61.24 H new ATOM 0 HG22 THR A 32 4.003 4.142 -44.126 1.00 61.24 H new ATOM 0 HG23 THR A 32 5.214 3.002 -43.495 1.00 61.24 H new ATOM 489 N PRO A 33 3.089 5.194 -41.350 1.00 53.10 N ATOM 490 CA PRO A 33 2.688 6.607 -41.366 1.00 31.44 C ATOM 491 C PRO A 33 2.984 7.274 -42.713 1.00 3.51 C ATOM 492 O PRO A 33 4.110 7.201 -43.218 1.00 22.31 O ATOM 493 CB PRO A 33 3.539 7.223 -40.249 1.00 1.05 C ATOM 494 CG PRO A 33 4.760 6.367 -40.195 1.00 71.12 C ATOM 495 CD PRO A 33 4.304 4.971 -40.536 1.00 42.35 C ATOM 0 HA PRO A 33 1.616 6.738 -41.219 1.00 31.44 H new ATOM 0 HB2 PRO A 33 3.791 8.261 -40.468 1.00 1.05 H new ATOM 0 HB3 PRO A 33 3.008 7.218 -39.297 1.00 1.05 H new ATOM 0 HG2 PRO A 33 5.512 6.715 -40.902 1.00 71.12 H new ATOM 0 HG3 PRO A 33 5.215 6.398 -39.205 1.00 71.12 H new ATOM 0 HD2 PRO A 33 5.065 4.425 -41.093 1.00 42.35 H new ATOM 0 HD3 PRO A 33 4.086 4.390 -39.640 1.00 42.35 H new ATOM 503 N GLY A 34 1.974 7.931 -43.280 1.00 1.22 N ATOM 504 CA GLY A 34 2.131 8.586 -44.570 1.00 71.12 C ATOM 505 C GLY A 34 2.806 9.938 -44.454 1.00 51.22 C ATOM 506 O GLY A 34 3.485 10.217 -43.459 1.00 33.52 O ATOM 0 H GLY A 34 1.046 8.022 -42.867 1.00 1.22 H new ATOM 0 HA2 GLY A 34 2.717 7.946 -45.230 1.00 71.12 H new ATOM 0 HA3 GLY A 34 1.152 8.710 -45.033 1.00 71.12 H new ATOM 510 N ASP A 35 2.628 10.779 -45.470 1.00 1.32 N ATOM 511 CA ASP A 35 3.212 12.120 -45.476 1.00 65.45 C ATOM 512 C ASP A 35 2.636 12.960 -44.342 1.00 14.34 C ATOM 513 O ASP A 35 3.336 13.768 -43.730 1.00 32.43 O ATOM 514 CB ASP A 35 2.948 12.840 -46.809 1.00 64.24 C ATOM 515 CG ASP A 35 3.550 12.134 -48.013 1.00 72.41 C ATOM 516 OD1 ASP A 35 4.792 12.071 -48.115 1.00 4.21 O ATOM 517 OD2 ASP A 35 2.781 11.662 -48.877 1.00 51.11 O ATOM 0 H ASP A 35 2.083 10.556 -46.302 1.00 1.32 H new ATOM 0 HA ASP A 35 4.287 12.004 -45.341 1.00 65.45 H new ATOM 0 HB2 ASP A 35 1.872 12.934 -46.954 1.00 64.24 H new ATOM 0 HB3 ASP A 35 3.352 13.851 -46.752 1.00 64.24 H new ATOM 522 N GLY A 36 1.347 12.777 -44.080 1.00 33.03 N ATOM 523 CA GLY A 36 0.655 13.576 -43.082 1.00 42.44 C ATOM 524 C GLY A 36 0.169 14.902 -43.646 1.00 51.13 C ATOM 525 O GLY A 36 -0.837 15.449 -43.190 1.00 23.41 O ATOM 0 H GLY A 36 0.763 12.083 -44.545 1.00 33.03 H new ATOM 0 HA2 GLY A 36 -0.195 13.014 -42.694 1.00 42.44 H new ATOM 0 HA3 GLY A 36 1.323 13.763 -42.241 1.00 42.44 H new ATOM 529 N VAL A 37 0.890 15.426 -44.635 1.00 62.44 N ATOM 530 CA VAL A 37 0.512 16.677 -45.295 1.00 70.24 C ATOM 531 C VAL A 37 -0.453 16.409 -46.449 1.00 51.32 C ATOM 532 O VAL A 37 -1.352 17.211 -46.719 1.00 73.24 O ATOM 533 CB VAL A 37 1.754 17.445 -45.825 1.00 11.24 C ATOM 534 CG1 VAL A 37 2.673 17.840 -44.669 1.00 11.54 C ATOM 535 CG2 VAL A 37 2.512 16.619 -46.867 1.00 52.31 C ATOM 0 H VAL A 37 1.743 15.002 -44.999 1.00 62.44 H new ATOM 0 HA VAL A 37 0.018 17.297 -44.547 1.00 70.24 H new ATOM 0 HB VAL A 37 1.406 18.355 -46.314 1.00 11.24 H new ATOM 0 HG11 VAL A 37 3.538 18.377 -45.059 1.00 11.54 H new ATOM 0 HG12 VAL A 37 2.130 18.482 -43.975 1.00 11.54 H new ATOM 0 HG13 VAL A 37 3.008 16.943 -44.147 1.00 11.54 H new ATOM 0 HG21 VAL A 37 3.376 17.182 -47.220 1.00 52.31 H new ATOM 0 HG22 VAL A 37 2.847 15.685 -46.417 1.00 52.31 H new ATOM 0 HG23 VAL A 37 1.853 16.401 -47.708 1.00 52.31 H new ATOM 545 N THR A 38 -0.266 15.273 -47.115 1.00 10.01 N ATOM 546 CA THR A 38 -1.085 14.899 -48.260 1.00 12.05 C ATOM 547 C THR A 38 -2.498 14.508 -47.819 1.00 25.34 C ATOM 548 O THR A 38 -2.756 13.365 -47.436 1.00 54.22 O ATOM 549 CB THR A 38 -0.427 13.742 -49.050 1.00 44.23 C ATOM 550 OG1 THR A 38 0.058 12.742 -48.140 1.00 15.11 O ATOM 551 CG2 THR A 38 0.727 14.251 -49.912 1.00 33.03 C ATOM 0 H THR A 38 0.454 14.590 -46.877 1.00 10.01 H new ATOM 0 HA THR A 38 -1.160 15.767 -48.916 1.00 12.05 H new ATOM 0 HB THR A 38 -1.182 13.307 -49.705 1.00 44.23 H new ATOM 0 HG1 THR A 38 0.960 12.467 -48.406 1.00 15.11 H new ATOM 0 HG21 THR A 38 1.171 13.417 -50.456 1.00 33.03 H new ATOM 0 HG22 THR A 38 0.353 14.989 -50.622 1.00 33.03 H new ATOM 0 HG23 THR A 38 1.482 14.711 -49.274 1.00 33.03 H new ATOM 559 N LYS A 39 -3.399 15.484 -47.855 1.00 43.31 N ATOM 560 CA LYS A 39 -4.779 15.290 -47.429 1.00 13.11 C ATOM 561 C LYS A 39 -5.633 14.793 -48.595 1.00 41.21 C ATOM 562 O LYS A 39 -5.658 15.417 -49.659 1.00 63.14 O ATOM 563 CB LYS A 39 -5.342 16.612 -46.891 1.00 22.03 C ATOM 564 CG LYS A 39 -4.523 17.193 -45.741 1.00 14.54 C ATOM 565 CD LYS A 39 -5.017 18.576 -45.324 1.00 41.50 C ATOM 566 CE LYS A 39 -4.179 19.152 -44.190 1.00 4.21 C ATOM 567 NZ LYS A 39 -2.746 19.291 -44.569 1.00 32.51 N ATOM 0 H LYS A 39 -3.193 16.429 -48.179 1.00 43.31 H new ATOM 0 HA LYS A 39 -4.803 14.539 -46.639 1.00 13.11 H new ATOM 0 HB2 LYS A 39 -5.383 17.339 -47.702 1.00 22.03 H new ATOM 0 HB3 LYS A 39 -6.366 16.453 -46.554 1.00 22.03 H new ATOM 0 HG2 LYS A 39 -4.571 16.519 -44.886 1.00 14.54 H new ATOM 0 HG3 LYS A 39 -3.476 17.257 -46.038 1.00 14.54 H new ATOM 0 HD2 LYS A 39 -4.983 19.249 -46.181 1.00 41.50 H new ATOM 0 HD3 LYS A 39 -6.059 18.512 -45.011 1.00 41.50 H new ATOM 0 HE2 LYS A 39 -4.575 20.127 -43.906 1.00 4.21 H new ATOM 0 HE3 LYS A 39 -4.261 18.507 -43.315 1.00 4.21 H new ATOM 0 HZ1 LYS A 39 -2.257 19.881 -43.866 1.00 32.51 H new ATOM 0 HZ2 LYS A 39 -2.303 18.351 -44.601 1.00 32.51 H new ATOM 0 HZ3 LYS A 39 -2.676 19.739 -45.505 1.00 32.51 H new ATOM 581 N PRO A 40 -6.340 13.665 -48.417 1.00 42.33 N ATOM 582 CA PRO A 40 -7.219 13.113 -49.450 1.00 34.02 C ATOM 583 C PRO A 40 -8.544 13.867 -49.520 1.00 15.53 C ATOM 584 O PRO A 40 -8.797 14.773 -48.722 1.00 20.24 O ATOM 585 CB PRO A 40 -7.434 11.671 -48.984 1.00 14.44 C ATOM 586 CG PRO A 40 -7.364 11.759 -47.498 1.00 71.04 C ATOM 587 CD PRO A 40 -6.346 12.833 -47.194 1.00 13.23 C ATOM 0 HA PRO A 40 -6.795 13.187 -50.451 1.00 34.02 H new ATOM 0 HB2 PRO A 40 -8.397 11.283 -49.316 1.00 14.44 H new ATOM 0 HB3 PRO A 40 -6.668 11.005 -49.381 1.00 14.44 H new ATOM 0 HG2 PRO A 40 -8.336 12.012 -47.076 1.00 71.04 H new ATOM 0 HG3 PRO A 40 -7.066 10.805 -47.064 1.00 71.04 H new ATOM 0 HD2 PRO A 40 -6.627 13.414 -46.316 1.00 13.23 H new ATOM 0 HD3 PRO A 40 -5.363 12.408 -46.994 1.00 13.23 H new ATOM 595 N GLN A 41 -9.383 13.490 -50.477 1.00 71.30 N ATOM 596 CA GLN A 41 -10.695 14.106 -50.646 1.00 74.23 C ATOM 597 C GLN A 41 -11.543 13.268 -51.593 1.00 54.51 C ATOM 598 O GLN A 41 -11.031 12.375 -52.273 1.00 73.51 O ATOM 599 CB GLN A 41 -10.566 15.534 -51.203 1.00 32.32 C ATOM 600 CG GLN A 41 -9.911 15.597 -52.579 1.00 20.14 C ATOM 601 CD GLN A 41 -10.052 16.952 -53.246 1.00 75.11 C ATOM 602 OE1 GLN A 41 -9.201 17.831 -53.093 1.00 42.13 O ATOM 603 NE2 GLN A 41 -11.125 17.130 -54.000 1.00 32.25 N ATOM 0 H GLN A 41 -9.177 12.755 -51.153 1.00 71.30 H new ATOM 0 HA GLN A 41 -11.175 14.156 -49.668 1.00 74.23 H new ATOM 0 HB2 GLN A 41 -11.558 15.983 -51.261 1.00 32.32 H new ATOM 0 HB3 GLN A 41 -9.984 16.136 -50.505 1.00 32.32 H new ATOM 0 HG2 GLN A 41 -8.853 15.355 -52.482 1.00 20.14 H new ATOM 0 HG3 GLN A 41 -10.354 14.835 -53.221 1.00 20.14 H new ATOM 0 HE21 GLN A 41 -11.807 16.378 -54.102 1.00 32.25 H new ATOM 0 HE22 GLN A 41 -11.270 18.019 -54.479 1.00 32.25 H new ATOM 612 N ALA A 42 -12.837 13.560 -51.635 1.00 32.14 N ATOM 613 CA ALA A 42 -13.744 12.886 -52.553 1.00 64.43 C ATOM 614 C ALA A 42 -13.533 13.397 -53.981 1.00 53.00 C ATOM 615 O ALA A 42 -13.034 14.510 -54.182 1.00 74.42 O ATOM 616 CB ALA A 42 -15.190 13.088 -52.116 1.00 22.33 C ATOM 0 H ALA A 42 -13.282 14.261 -51.042 1.00 32.14 H new ATOM 0 HA ALA A 42 -13.528 11.818 -52.535 1.00 64.43 H new ATOM 0 HB1 ALA A 42 -15.855 12.578 -52.813 1.00 22.33 H new ATOM 0 HB2 ALA A 42 -15.328 12.678 -51.116 1.00 22.33 H new ATOM 0 HB3 ALA A 42 -15.422 14.153 -52.107 1.00 22.33 H new ATOM 622 N GLY A 43 -13.903 12.579 -54.961 1.00 22.23 N ATOM 623 CA GLY A 43 -13.786 12.975 -56.357 1.00 40.21 C ATOM 624 C GLY A 43 -12.374 12.819 -56.890 1.00 65.14 C ATOM 625 O GLY A 43 -12.022 13.400 -57.918 1.00 43.04 O ATOM 0 H GLY A 43 -14.284 11.644 -54.815 1.00 22.23 H new ATOM 0 HA2 GLY A 43 -14.467 12.374 -56.960 1.00 40.21 H new ATOM 0 HA3 GLY A 43 -14.098 14.014 -56.464 1.00 40.21 H new ATOM 629 N LYS A 44 -11.563 12.037 -56.187 1.00 15.02 N ATOM 630 CA LYS A 44 -10.184 11.784 -56.594 1.00 4.12 C ATOM 631 C LYS A 44 -9.980 10.311 -56.921 1.00 2.42 C ATOM 632 O LYS A 44 -10.363 9.436 -56.144 1.00 21.32 O ATOM 633 CB LYS A 44 -9.200 12.205 -55.490 1.00 74.43 C ATOM 634 CG LYS A 44 -9.071 13.714 -55.303 1.00 13.21 C ATOM 635 CD LYS A 44 -8.396 14.405 -56.493 1.00 25.44 C ATOM 636 CE LYS A 44 -6.890 14.128 -56.569 1.00 74.31 C ATOM 637 NZ LYS A 44 -6.581 12.719 -56.941 1.00 24.40 N ATOM 0 H LYS A 44 -11.838 11.564 -55.326 1.00 15.02 H new ATOM 0 HA LYS A 44 -9.989 12.378 -57.487 1.00 4.12 H new ATOM 0 HB2 LYS A 44 -9.518 11.760 -54.547 1.00 74.43 H new ATOM 0 HB3 LYS A 44 -8.217 11.794 -55.720 1.00 74.43 H new ATOM 0 HG2 LYS A 44 -10.062 14.143 -55.154 1.00 13.21 H new ATOM 0 HG3 LYS A 44 -8.497 13.916 -54.398 1.00 13.21 H new ATOM 0 HD2 LYS A 44 -8.869 14.071 -57.417 1.00 25.44 H new ATOM 0 HD3 LYS A 44 -8.559 15.480 -56.422 1.00 25.44 H new ATOM 0 HE2 LYS A 44 -6.438 14.799 -57.299 1.00 74.31 H new ATOM 0 HE3 LYS A 44 -6.435 14.353 -55.605 1.00 74.31 H new ATOM 0 HZ1 LYS A 44 -5.655 12.680 -57.413 1.00 24.40 H new ATOM 0 HZ2 LYS A 44 -6.557 12.131 -56.084 1.00 24.40 H new ATOM 0 HZ3 LYS A 44 -7.314 12.361 -57.586 1.00 24.40 H new ATOM 651 N LYS A 45 -9.393 10.049 -58.083 1.00 31.54 N ATOM 652 CA LYS A 45 -8.964 8.709 -58.446 1.00 2.24 C ATOM 653 C LYS A 45 -7.745 8.343 -57.608 1.00 43.32 C ATOM 654 O LYS A 45 -6.640 8.823 -57.870 1.00 1.42 O ATOM 655 CB LYS A 45 -8.630 8.646 -59.949 1.00 23.45 C ATOM 656 CG LYS A 45 -8.111 7.288 -60.431 1.00 51.53 C ATOM 657 CD LYS A 45 -9.133 6.170 -60.237 1.00 61.23 C ATOM 658 CE LYS A 45 -10.445 6.456 -60.961 1.00 43.20 C ATOM 659 NZ LYS A 45 -10.257 6.635 -62.426 1.00 55.24 N ATOM 0 H LYS A 45 -9.203 10.756 -58.794 1.00 31.54 H new ATOM 0 HA LYS A 45 -9.766 7.997 -58.251 1.00 2.24 H new ATOM 0 HB2 LYS A 45 -9.524 8.901 -60.517 1.00 23.45 H new ATOM 0 HB3 LYS A 45 -7.882 9.406 -60.174 1.00 23.45 H new ATOM 0 HG2 LYS A 45 -7.848 7.357 -61.487 1.00 51.53 H new ATOM 0 HG3 LYS A 45 -7.198 7.039 -59.891 1.00 51.53 H new ATOM 0 HD2 LYS A 45 -8.716 5.231 -60.602 1.00 61.23 H new ATOM 0 HD3 LYS A 45 -9.328 6.039 -59.173 1.00 61.23 H new ATOM 0 HE2 LYS A 45 -11.141 5.636 -60.784 1.00 43.20 H new ATOM 0 HE3 LYS A 45 -10.899 7.355 -60.543 1.00 43.20 H new ATOM 0 HZ1 LYS A 45 -11.185 6.709 -62.889 1.00 55.24 H new ATOM 0 HZ2 LYS A 45 -9.712 7.503 -62.603 1.00 55.24 H new ATOM 0 HZ3 LYS A 45 -9.742 5.818 -62.812 1.00 55.24 H new ATOM 673 N VAL A 46 -7.946 7.504 -56.600 1.00 62.24 N ATOM 674 CA VAL A 46 -6.889 7.184 -55.650 1.00 12.10 C ATOM 675 C VAL A 46 -6.342 5.783 -55.895 1.00 64.05 C ATOM 676 O VAL A 46 -7.082 4.862 -56.256 1.00 45.11 O ATOM 677 CB VAL A 46 -7.377 7.292 -54.178 1.00 33.35 C ATOM 678 CG1 VAL A 46 -7.838 8.713 -53.862 1.00 13.43 C ATOM 679 CG2 VAL A 46 -8.489 6.282 -53.883 1.00 33.14 C ATOM 0 H VAL A 46 -8.832 7.032 -56.419 1.00 62.24 H new ATOM 0 HA VAL A 46 -6.097 7.917 -55.806 1.00 12.10 H new ATOM 0 HB VAL A 46 -6.533 7.054 -53.531 1.00 33.35 H new ATOM 0 HG11 VAL A 46 -8.175 8.764 -52.827 1.00 13.43 H new ATOM 0 HG12 VAL A 46 -7.009 9.405 -54.009 1.00 13.43 H new ATOM 0 HG13 VAL A 46 -8.659 8.985 -54.525 1.00 13.43 H new ATOM 0 HG21 VAL A 46 -8.807 6.384 -52.846 1.00 33.14 H new ATOM 0 HG22 VAL A 46 -9.336 6.470 -54.543 1.00 33.14 H new ATOM 0 HG23 VAL A 46 -8.116 5.271 -54.050 1.00 33.14 H new ATOM 689 N THR A 47 -5.032 5.651 -55.721 1.00 20.33 N ATOM 690 CA THR A 47 -4.339 4.383 -55.865 1.00 43.45 C ATOM 691 C THR A 47 -4.108 3.775 -54.483 1.00 3.34 C ATOM 692 O THR A 47 -3.456 4.394 -53.640 1.00 53.32 O ATOM 693 CB THR A 47 -2.983 4.587 -56.573 1.00 31.33 C ATOM 694 OG1 THR A 47 -3.176 5.373 -57.756 1.00 10.14 O ATOM 695 CG2 THR A 47 -2.344 3.255 -56.944 1.00 54.21 C ATOM 0 H THR A 47 -4.420 6.428 -55.474 1.00 20.33 H new ATOM 0 HA THR A 47 -4.950 3.711 -56.468 1.00 43.45 H new ATOM 0 HB THR A 47 -2.314 5.104 -55.885 1.00 31.33 H new ATOM 0 HG1 THR A 47 -2.317 5.745 -58.046 1.00 10.14 H new ATOM 0 HG21 THR A 47 -1.391 3.435 -57.441 1.00 54.21 H new ATOM 0 HG22 THR A 47 -2.178 2.667 -56.041 1.00 54.21 H new ATOM 0 HG23 THR A 47 -3.006 2.709 -57.616 1.00 54.21 H new ATOM 703 N VAL A 48 -4.645 2.578 -54.249 1.00 1.43 N ATOM 704 CA VAL A 48 -4.638 1.969 -52.922 1.00 41.03 C ATOM 705 C VAL A 48 -4.276 0.481 -52.963 1.00 2.14 C ATOM 706 O VAL A 48 -4.040 -0.099 -54.030 1.00 5.01 O ATOM 707 CB VAL A 48 -6.024 2.113 -52.244 1.00 25.31 C ATOM 708 CG1 VAL A 48 -6.414 3.581 -52.097 1.00 2.44 C ATOM 709 CG2 VAL A 48 -7.086 1.341 -53.026 1.00 31.14 C ATOM 0 H VAL A 48 -5.093 2.009 -54.967 1.00 1.43 H new ATOM 0 HA VAL A 48 -3.876 2.499 -52.350 1.00 41.03 H new ATOM 0 HB VAL A 48 -5.958 1.686 -51.243 1.00 25.31 H new ATOM 0 HG11 VAL A 48 -7.391 3.652 -51.618 1.00 2.44 H new ATOM 0 HG12 VAL A 48 -5.672 4.095 -51.486 1.00 2.44 H new ATOM 0 HG13 VAL A 48 -6.458 4.046 -53.082 1.00 2.44 H new ATOM 0 HG21 VAL A 48 -8.053 1.454 -52.535 1.00 31.14 H new ATOM 0 HG22 VAL A 48 -7.147 1.733 -54.041 1.00 31.14 H new ATOM 0 HG23 VAL A 48 -6.817 0.285 -53.060 1.00 31.14 H new ATOM 719 N HIS A 49 -4.216 -0.106 -51.769 1.00 0.12 N ATOM 720 CA HIS A 49 -4.059 -1.545 -51.573 1.00 21.40 C ATOM 721 C HIS A 49 -4.991 -2.001 -50.455 1.00 62.51 C ATOM 722 O HIS A 49 -5.336 -1.216 -49.568 1.00 12.42 O ATOM 723 CB HIS A 49 -2.609 -1.914 -51.205 1.00 65.53 C ATOM 724 CG HIS A 49 -1.706 -2.118 -52.379 1.00 3.22 C ATOM 725 ND1 HIS A 49 -0.427 -1.609 -52.447 1.00 4.14 N ATOM 726 CD2 HIS A 49 -1.888 -2.825 -53.518 1.00 44.34 C ATOM 727 CE1 HIS A 49 0.137 -1.992 -53.574 1.00 71.41 C ATOM 728 NE2 HIS A 49 -0.728 -2.732 -54.242 1.00 60.41 N ATOM 0 H HIS A 49 -4.276 0.416 -50.895 1.00 0.12 H new ATOM 0 HA HIS A 49 -4.308 -2.044 -52.509 1.00 21.40 H new ATOM 0 HB2 HIS A 49 -2.195 -1.126 -50.576 1.00 65.53 H new ATOM 0 HB3 HIS A 49 -2.620 -2.826 -50.608 1.00 65.53 H new ATOM 0 HD1 HIS A 49 0.014 -1.026 -51.735 1.00 4.14 H new ATOM 0 HD2 HIS A 49 -2.780 -3.362 -53.803 1.00 44.34 H new ATOM 0 HE1 HIS A 49 1.137 -1.743 -53.897 1.00 71.41 H new ATOM 737 N TYR A 50 -5.397 -3.262 -50.516 1.00 14.34 N ATOM 738 CA TYR A 50 -6.214 -3.883 -49.474 1.00 11.42 C ATOM 739 C TYR A 50 -5.563 -5.187 -49.025 1.00 70.24 C ATOM 740 O TYR A 50 -5.012 -5.921 -49.851 1.00 63.33 O ATOM 741 CB TYR A 50 -7.633 -4.179 -49.989 1.00 61.52 C ATOM 742 CG TYR A 50 -8.497 -2.949 -50.211 1.00 44.20 C ATOM 743 CD1 TYR A 50 -8.403 -2.204 -51.384 1.00 44.43 C ATOM 744 CD2 TYR A 50 -9.410 -2.536 -49.247 1.00 71.34 C ATOM 745 CE1 TYR A 50 -9.193 -1.087 -51.584 1.00 51.13 C ATOM 746 CE2 TYR A 50 -10.203 -1.421 -49.442 1.00 2.23 C ATOM 747 CZ TYR A 50 -10.089 -0.700 -50.612 1.00 62.13 C ATOM 748 OH TYR A 50 -10.876 0.411 -50.808 1.00 33.15 O ATOM 0 H TYR A 50 -5.170 -3.887 -51.290 1.00 14.34 H new ATOM 0 HA TYR A 50 -6.284 -3.190 -48.636 1.00 11.42 H new ATOM 0 HB2 TYR A 50 -7.557 -4.727 -50.928 1.00 61.52 H new ATOM 0 HB3 TYR A 50 -8.134 -4.835 -49.277 1.00 61.52 H new ATOM 0 HD1 TYR A 50 -7.702 -2.503 -52.149 1.00 44.43 H new ATOM 0 HD2 TYR A 50 -9.501 -3.097 -48.329 1.00 71.34 H new ATOM 0 HE1 TYR A 50 -9.108 -0.520 -52.499 1.00 51.13 H new ATOM 0 HE2 TYR A 50 -10.908 -1.116 -48.683 1.00 2.23 H new ATOM 0 HH TYR A 50 -10.509 0.946 -51.542 1.00 33.15 H new ATOM 758 N ASP A 51 -5.644 -5.480 -47.732 1.00 4.52 N ATOM 759 CA ASP A 51 -5.151 -6.748 -47.186 1.00 51.23 C ATOM 760 C ASP A 51 -6.186 -7.306 -46.211 1.00 52.23 C ATOM 761 O ASP A 51 -6.541 -6.652 -45.225 1.00 72.43 O ATOM 762 CB ASP A 51 -3.799 -6.567 -46.462 1.00 43.42 C ATOM 763 CG ASP A 51 -2.677 -6.050 -47.363 1.00 52.30 C ATOM 764 OD1 ASP A 51 -2.115 -6.851 -48.147 1.00 54.15 O ATOM 765 OD2 ASP A 51 -2.342 -4.844 -47.281 1.00 62.22 O ATOM 0 H ASP A 51 -6.048 -4.855 -47.035 1.00 4.52 H new ATOM 0 HA ASP A 51 -4.995 -7.442 -48.012 1.00 51.23 H new ATOM 0 HB2 ASP A 51 -3.933 -5.874 -45.631 1.00 43.42 H new ATOM 0 HB3 ASP A 51 -3.497 -7.523 -46.034 1.00 43.42 H new ATOM 770 N GLY A 52 -6.693 -8.503 -46.511 1.00 64.23 N ATOM 771 CA GLY A 52 -7.746 -9.106 -45.706 1.00 20.04 C ATOM 772 C GLY A 52 -7.200 -9.810 -44.478 1.00 41.33 C ATOM 773 O GLY A 52 -6.505 -10.821 -44.596 1.00 22.22 O ATOM 0 H GLY A 52 -6.390 -9.069 -47.304 1.00 64.23 H new ATOM 0 HA2 GLY A 52 -8.451 -8.334 -45.396 1.00 20.04 H new ATOM 0 HA3 GLY A 52 -8.302 -9.820 -46.314 1.00 20.04 H new ATOM 777 N ARG A 53 -7.537 -9.288 -43.301 1.00 44.32 N ATOM 778 CA ARG A 53 -7.001 -9.788 -42.036 1.00 1.42 C ATOM 779 C ARG A 53 -8.119 -10.038 -41.015 1.00 33.53 C ATOM 780 O ARG A 53 -9.154 -9.365 -41.016 1.00 63.13 O ATOM 781 CB ARG A 53 -5.968 -8.787 -41.489 1.00 71.31 C ATOM 782 CG ARG A 53 -5.374 -9.169 -40.137 1.00 52.10 C ATOM 783 CD ARG A 53 -4.186 -8.287 -39.772 1.00 42.02 C ATOM 784 NE ARG A 53 -3.019 -8.547 -40.623 1.00 21.24 N ATOM 785 CZ ARG A 53 -1.875 -7.861 -40.557 1.00 61.51 C ATOM 786 NH1 ARG A 53 -1.761 -6.822 -39.743 1.00 32.45 N ATOM 787 NH2 ARG A 53 -0.841 -8.214 -41.307 1.00 4.41 N ATOM 0 H ARG A 53 -8.187 -8.509 -43.197 1.00 44.32 H new ATOM 0 HA ARG A 53 -6.512 -10.745 -42.216 1.00 1.42 H new ATOM 0 HB2 ARG A 53 -5.159 -8.687 -42.212 1.00 71.31 H new ATOM 0 HB3 ARG A 53 -6.440 -7.808 -41.401 1.00 71.31 H new ATOM 0 HG2 ARG A 53 -6.140 -9.084 -39.366 1.00 52.10 H new ATOM 0 HG3 ARG A 53 -5.059 -10.212 -40.160 1.00 52.10 H new ATOM 0 HD2 ARG A 53 -4.473 -7.239 -39.862 1.00 42.02 H new ATOM 0 HD3 ARG A 53 -3.918 -8.456 -38.729 1.00 42.02 H new ATOM 0 HE ARG A 53 -3.086 -9.299 -41.308 1.00 21.24 H new ATOM 0 HH11 ARG A 53 -2.550 -6.541 -39.161 1.00 32.45 H new ATOM 0 HH12 ARG A 53 -0.884 -6.303 -39.698 1.00 32.45 H new ATOM 0 HH21 ARG A 53 -0.917 -9.012 -41.938 1.00 4.41 H new ATOM 0 HH22 ARG A 53 0.031 -7.688 -41.254 1.00 4.41 H new ATOM 801 N PHE A 54 -7.909 -11.027 -40.155 1.00 54.13 N ATOM 802 CA PHE A 54 -8.878 -11.383 -39.125 1.00 71.03 C ATOM 803 C PHE A 54 -8.602 -10.592 -37.842 1.00 14.50 C ATOM 804 O PHE A 54 -7.470 -10.162 -37.613 1.00 62.12 O ATOM 805 CB PHE A 54 -8.810 -12.895 -38.848 1.00 75.12 C ATOM 806 CG PHE A 54 -9.036 -13.741 -40.077 1.00 4.21 C ATOM 807 CD1 PHE A 54 -10.320 -13.962 -40.558 1.00 43.03 C ATOM 808 CD2 PHE A 54 -7.965 -14.308 -40.757 1.00 10.32 C ATOM 809 CE1 PHE A 54 -10.529 -14.732 -41.688 1.00 64.24 C ATOM 810 CE2 PHE A 54 -8.170 -15.078 -41.886 1.00 10.31 C ATOM 811 CZ PHE A 54 -9.452 -15.290 -42.353 1.00 33.43 C ATOM 0 H PHE A 54 -7.067 -11.602 -40.151 1.00 54.13 H new ATOM 0 HA PHE A 54 -9.879 -11.133 -39.475 1.00 71.03 H new ATOM 0 HB2 PHE A 54 -7.835 -13.136 -38.425 1.00 75.12 H new ATOM 0 HB3 PHE A 54 -9.556 -13.153 -38.096 1.00 75.12 H new ATOM 0 HD1 PHE A 54 -11.165 -13.528 -40.044 1.00 43.03 H new ATOM 0 HD2 PHE A 54 -6.959 -14.145 -40.399 1.00 10.32 H new ATOM 0 HE1 PHE A 54 -11.533 -14.897 -42.051 1.00 64.24 H new ATOM 0 HE2 PHE A 54 -7.328 -15.514 -42.403 1.00 10.31 H new ATOM 0 HZ PHE A 54 -9.614 -15.890 -43.236 1.00 33.43 H new ATOM 821 N PRO A 55 -9.625 -10.407 -36.975 1.00 32.51 N ATOM 822 CA PRO A 55 -9.476 -9.672 -35.700 1.00 12.25 C ATOM 823 C PRO A 55 -8.521 -10.366 -34.720 1.00 74.21 C ATOM 824 O PRO A 55 -8.336 -9.911 -33.588 1.00 2.34 O ATOM 825 CB PRO A 55 -10.908 -9.630 -35.137 1.00 42.22 C ATOM 826 CG PRO A 55 -11.609 -10.774 -35.794 1.00 14.43 C ATOM 827 CD PRO A 55 -11.012 -10.884 -37.170 1.00 41.45 C ATOM 0 HA PRO A 55 -9.039 -8.685 -35.853 1.00 12.25 H new ATOM 0 HB2 PRO A 55 -10.910 -9.735 -34.052 1.00 42.22 H new ATOM 0 HB3 PRO A 55 -11.396 -8.683 -35.366 1.00 42.22 H new ATOM 0 HG2 PRO A 55 -11.466 -11.696 -35.231 1.00 14.43 H new ATOM 0 HG3 PRO A 55 -12.683 -10.596 -35.847 1.00 14.43 H new ATOM 0 HD2 PRO A 55 -11.037 -11.909 -37.539 1.00 41.45 H new ATOM 0 HD3 PRO A 55 -11.551 -10.271 -37.893 1.00 41.45 H new ATOM 835 N ASP A 56 -7.937 -11.476 -35.157 1.00 72.30 N ATOM 836 CA ASP A 56 -6.920 -12.187 -34.385 1.00 2.21 C ATOM 837 C ASP A 56 -5.539 -11.578 -34.629 1.00 31.10 C ATOM 838 O ASP A 56 -4.667 -11.599 -33.756 1.00 51.45 O ATOM 839 CB ASP A 56 -6.913 -13.673 -34.772 1.00 33.21 C ATOM 840 CG ASP A 56 -5.709 -14.420 -34.218 1.00 3.34 C ATOM 841 OD1 ASP A 56 -5.749 -14.845 -33.046 1.00 1.05 O ATOM 842 OD2 ASP A 56 -4.716 -14.589 -34.960 1.00 33.45 O ATOM 0 H ASP A 56 -8.153 -11.909 -36.055 1.00 72.30 H new ATOM 0 HA ASP A 56 -7.159 -12.094 -33.326 1.00 2.21 H new ATOM 0 HB2 ASP A 56 -7.826 -14.143 -34.407 1.00 33.21 H new ATOM 0 HB3 ASP A 56 -6.921 -13.761 -35.858 1.00 33.21 H new ATOM 847 N GLY A 57 -5.354 -11.029 -35.826 1.00 5.43 N ATOM 848 CA GLY A 57 -4.072 -10.464 -36.212 1.00 3.42 C ATOM 849 C GLY A 57 -3.471 -11.187 -37.401 1.00 52.54 C ATOM 850 O GLY A 57 -2.679 -10.615 -38.150 1.00 13.40 O ATOM 0 H GLY A 57 -6.077 -10.965 -36.543 1.00 5.43 H new ATOM 0 HA2 GLY A 57 -4.198 -9.409 -36.455 1.00 3.42 H new ATOM 0 HA3 GLY A 57 -3.383 -10.517 -35.369 1.00 3.42 H new ATOM 854 N LYS A 58 -3.854 -12.449 -37.572 1.00 22.23 N ATOM 855 CA LYS A 58 -3.385 -13.264 -38.690 1.00 64.14 C ATOM 856 C LYS A 58 -4.257 -13.005 -39.924 1.00 44.42 C ATOM 857 O LYS A 58 -5.399 -12.555 -39.794 1.00 32.12 O ATOM 858 CB LYS A 58 -3.435 -14.748 -38.299 1.00 2.04 C ATOM 859 CG LYS A 58 -2.717 -15.683 -39.269 1.00 64.13 C ATOM 860 CD LYS A 58 -2.801 -17.137 -38.809 1.00 2.12 C ATOM 861 CE LYS A 58 -1.942 -18.061 -39.666 1.00 51.22 C ATOM 862 NZ LYS A 58 -2.036 -19.479 -39.219 1.00 12.14 N ATOM 0 H LYS A 58 -4.495 -12.934 -36.944 1.00 22.23 H new ATOM 0 HA LYS A 58 -2.356 -12.997 -38.930 1.00 64.14 H new ATOM 0 HB2 LYS A 58 -2.995 -14.865 -37.309 1.00 2.04 H new ATOM 0 HB3 LYS A 58 -4.478 -15.056 -38.223 1.00 2.04 H new ATOM 0 HG2 LYS A 58 -3.158 -15.588 -40.261 1.00 64.13 H new ATOM 0 HG3 LYS A 58 -1.671 -15.387 -39.355 1.00 64.13 H new ATOM 0 HD2 LYS A 58 -2.481 -17.207 -37.769 1.00 2.12 H new ATOM 0 HD3 LYS A 58 -3.838 -17.469 -38.847 1.00 2.12 H new ATOM 0 HE2 LYS A 58 -2.256 -17.987 -40.707 1.00 51.22 H new ATOM 0 HE3 LYS A 58 -0.903 -17.735 -39.623 1.00 51.22 H new ATOM 0 HZ1 LYS A 58 -1.438 -20.075 -39.827 1.00 12.14 H new ATOM 0 HZ2 LYS A 58 -1.712 -19.555 -38.234 1.00 12.14 H new ATOM 0 HZ3 LYS A 58 -3.023 -19.799 -39.284 1.00 12.14 H new ATOM 876 N GLN A 59 -3.723 -13.281 -41.115 1.00 62.31 N ATOM 877 CA GLN A 59 -4.461 -13.061 -42.360 1.00 30.32 C ATOM 878 C GLN A 59 -4.179 -14.176 -43.365 1.00 0.55 C ATOM 879 O GLN A 59 -3.492 -15.152 -43.048 1.00 71.44 O ATOM 880 CB GLN A 59 -4.095 -11.694 -42.955 1.00 41.23 C ATOM 881 CG GLN A 59 -2.644 -11.568 -43.406 1.00 10.35 C ATOM 882 CD GLN A 59 -2.302 -10.161 -43.860 1.00 72.33 C ATOM 883 OE1 GLN A 59 -2.866 -9.189 -43.367 1.00 24.21 O ATOM 884 NE2 GLN A 59 -1.376 -10.040 -44.798 1.00 55.00 N ATOM 0 H GLN A 59 -2.784 -13.657 -41.244 1.00 62.31 H new ATOM 0 HA GLN A 59 -5.528 -13.073 -42.136 1.00 30.32 H new ATOM 0 HB2 GLN A 59 -4.745 -11.497 -43.807 1.00 41.23 H new ATOM 0 HB3 GLN A 59 -4.300 -10.922 -42.213 1.00 41.23 H new ATOM 0 HG2 GLN A 59 -1.985 -11.853 -42.586 1.00 10.35 H new ATOM 0 HG3 GLN A 59 -2.458 -12.266 -44.222 1.00 10.35 H new ATOM 0 HE21 GLN A 59 -0.929 -10.872 -45.184 1.00 55.00 H new ATOM 0 HE22 GLN A 59 -1.109 -9.115 -45.135 1.00 55.00 H new ATOM 893 N PHE A 60 -4.720 -14.032 -44.572 1.00 4.41 N ATOM 894 CA PHE A 60 -4.549 -15.035 -45.620 1.00 50.42 C ATOM 895 C PHE A 60 -3.250 -14.779 -46.386 1.00 13.13 C ATOM 896 O PHE A 60 -2.320 -15.586 -46.338 1.00 51.22 O ATOM 897 CB PHE A 60 -5.756 -15.014 -46.573 1.00 41.42 C ATOM 898 CG PHE A 60 -5.784 -16.163 -47.554 1.00 61.13 C ATOM 899 CD1 PHE A 60 -6.229 -17.419 -47.161 1.00 12.31 C ATOM 900 CD2 PHE A 60 -5.367 -15.991 -48.868 1.00 40.54 C ATOM 901 CE1 PHE A 60 -6.258 -18.473 -48.054 1.00 10.14 C ATOM 902 CE2 PHE A 60 -5.393 -17.043 -49.764 1.00 73.53 C ATOM 903 CZ PHE A 60 -5.840 -18.285 -49.356 1.00 13.11 C ATOM 0 H PHE A 60 -5.282 -13.228 -44.849 1.00 4.41 H new ATOM 0 HA PHE A 60 -4.489 -16.022 -45.162 1.00 50.42 H new ATOM 0 HB2 PHE A 60 -6.672 -15.031 -45.983 1.00 41.42 H new ATOM 0 HB3 PHE A 60 -5.752 -14.076 -47.128 1.00 41.42 H new ATOM 0 HD1 PHE A 60 -6.557 -17.574 -46.144 1.00 12.31 H new ATOM 0 HD2 PHE A 60 -5.018 -15.022 -49.194 1.00 40.54 H new ATOM 0 HE1 PHE A 60 -6.608 -19.443 -47.733 1.00 10.14 H new ATOM 0 HE2 PHE A 60 -5.064 -16.894 -50.782 1.00 73.53 H new ATOM 0 HZ PHE A 60 -5.862 -19.108 -50.055 1.00 13.11 H new ATOM 913 N ASP A 61 -3.185 -13.645 -47.082 1.00 72.13 N ATOM 914 CA ASP A 61 -1.988 -13.262 -47.831 1.00 21.25 C ATOM 915 C ASP A 61 -1.803 -11.749 -47.781 1.00 45.30 C ATOM 916 O ASP A 61 -2.759 -11.008 -47.547 1.00 20.32 O ATOM 917 CB ASP A 61 -2.080 -13.716 -49.299 1.00 71.44 C ATOM 918 CG ASP A 61 -3.030 -12.859 -50.136 1.00 31.53 C ATOM 919 OD1 ASP A 61 -4.258 -13.079 -50.063 1.00 45.10 O ATOM 920 OD2 ASP A 61 -2.552 -11.973 -50.879 1.00 42.41 O ATOM 0 H ASP A 61 -3.950 -12.973 -47.143 1.00 72.13 H new ATOM 0 HA ASP A 61 -1.132 -13.754 -47.369 1.00 21.25 H new ATOM 0 HB2 ASP A 61 -1.086 -13.686 -49.745 1.00 71.44 H new ATOM 0 HB3 ASP A 61 -2.413 -14.753 -49.332 1.00 71.44 H new ATOM 925 N SER A 62 -0.568 -11.299 -47.979 1.00 2.52 N ATOM 926 CA SER A 62 -0.282 -9.875 -48.083 1.00 22.13 C ATOM 927 C SER A 62 -0.455 -9.428 -49.535 1.00 22.13 C ATOM 928 O SER A 62 0.479 -9.506 -50.341 1.00 25.20 O ATOM 929 CB SER A 62 1.136 -9.570 -47.572 1.00 73.41 C ATOM 930 OG SER A 62 2.109 -10.397 -48.195 1.00 51.41 O ATOM 0 H SER A 62 0.250 -11.901 -48.070 1.00 2.52 H new ATOM 0 HA SER A 62 -0.982 -9.318 -47.459 1.00 22.13 H new ATOM 0 HB2 SER A 62 1.373 -8.523 -47.761 1.00 73.41 H new ATOM 0 HB3 SER A 62 1.173 -9.715 -46.492 1.00 73.41 H new ATOM 0 HG SER A 62 1.863 -10.542 -49.133 1.00 51.41 H new ATOM 936 N SER A 63 -1.661 -8.983 -49.863 1.00 2.54 N ATOM 937 CA SER A 63 -2.012 -8.626 -51.231 1.00 61.15 C ATOM 938 C SER A 63 -1.188 -7.433 -51.719 1.00 30.33 C ATOM 939 O SER A 63 -0.937 -7.282 -52.918 1.00 20.53 O ATOM 940 CB SER A 63 -3.509 -8.321 -51.314 1.00 5.12 C ATOM 941 OG SER A 63 -4.288 -9.414 -50.842 1.00 11.23 O ATOM 0 H SER A 63 -2.420 -8.860 -49.192 1.00 2.54 H new ATOM 0 HA SER A 63 -1.783 -9.470 -51.882 1.00 61.15 H new ATOM 0 HB2 SER A 63 -3.734 -7.431 -50.726 1.00 5.12 H new ATOM 0 HB3 SER A 63 -3.780 -8.098 -52.346 1.00 5.12 H new ATOM 0 HG SER A 63 -3.741 -10.227 -50.837 1.00 11.23 H new ATOM 947 N ARG A 64 -0.760 -6.588 -50.786 1.00 62.05 N ATOM 948 CA ARG A 64 0.108 -5.460 -51.117 1.00 51.31 C ATOM 949 C ARG A 64 1.414 -5.957 -51.748 1.00 11.31 C ATOM 950 O ARG A 64 1.991 -5.293 -52.611 1.00 41.21 O ATOM 951 CB ARG A 64 0.390 -4.606 -49.863 1.00 11.31 C ATOM 952 CG ARG A 64 1.143 -5.334 -48.742 1.00 31.34 C ATOM 953 CD ARG A 64 2.583 -4.841 -48.593 1.00 61.25 C ATOM 954 NE ARG A 64 2.646 -3.417 -48.237 1.00 63.21 N ATOM 955 CZ ARG A 64 3.677 -2.837 -47.614 1.00 44.35 C ATOM 956 NH1 ARG A 64 4.754 -3.540 -47.282 1.00 70.45 N ATOM 957 NH2 ARG A 64 3.628 -1.544 -47.333 1.00 74.42 N ATOM 0 H ARG A 64 -0.999 -6.661 -49.797 1.00 62.05 H new ATOM 0 HA ARG A 64 -0.403 -4.830 -51.845 1.00 51.31 H new ATOM 0 HB2 ARG A 64 0.968 -3.731 -50.160 1.00 11.31 H new ATOM 0 HB3 ARG A 64 -0.559 -4.243 -49.468 1.00 11.31 H new ATOM 0 HG2 ARG A 64 0.614 -5.192 -47.800 1.00 31.34 H new ATOM 0 HG3 ARG A 64 1.147 -6.405 -48.946 1.00 31.34 H new ATOM 0 HD2 ARG A 64 3.089 -5.428 -47.827 1.00 61.25 H new ATOM 0 HD3 ARG A 64 3.120 -5.005 -49.527 1.00 61.25 H new ATOM 0 HE ARG A 64 1.848 -2.830 -48.482 1.00 63.21 H new ATOM 0 HH11 ARG A 64 4.801 -4.535 -47.502 1.00 70.45 H new ATOM 0 HH12 ARG A 64 5.534 -3.085 -46.807 1.00 70.45 H new ATOM 0 HH21 ARG A 64 2.807 -0.997 -47.592 1.00 74.42 H new ATOM 0 HH22 ARG A 64 4.411 -1.095 -46.858 1.00 74.42 H new ATOM 971 N SER A 65 1.847 -7.149 -51.334 1.00 10.31 N ATOM 972 CA SER A 65 3.104 -7.737 -51.804 1.00 43.24 C ATOM 973 C SER A 65 2.985 -8.245 -53.246 1.00 30.11 C ATOM 974 O SER A 65 3.980 -8.645 -53.853 1.00 40.21 O ATOM 975 CB SER A 65 3.527 -8.888 -50.872 1.00 13.31 C ATOM 976 OG SER A 65 4.767 -9.461 -51.269 1.00 52.33 O ATOM 0 H SER A 65 1.340 -7.732 -50.667 1.00 10.31 H new ATOM 0 HA SER A 65 3.865 -6.957 -51.787 1.00 43.24 H new ATOM 0 HB2 SER A 65 3.609 -8.517 -49.850 1.00 13.31 H new ATOM 0 HB3 SER A 65 2.755 -9.657 -50.871 1.00 13.31 H new ATOM 0 HG SER A 65 4.834 -9.451 -52.247 1.00 52.33 H new ATOM 982 N ARG A 66 1.777 -8.210 -53.813 1.00 45.31 N ATOM 983 CA ARG A 66 1.567 -8.724 -55.168 1.00 14.00 C ATOM 984 C ARG A 66 2.113 -7.743 -56.212 1.00 1.23 C ATOM 985 O ARG A 66 2.063 -8.002 -57.416 1.00 33.32 O ATOM 986 CB ARG A 66 0.081 -9.020 -55.425 1.00 41.14 C ATOM 987 CG ARG A 66 -0.567 -9.951 -54.394 1.00 42.33 C ATOM 988 CD ARG A 66 0.282 -11.185 -54.100 1.00 1.51 C ATOM 989 NE ARG A 66 0.550 -11.983 -55.297 1.00 14.23 N ATOM 990 CZ ARG A 66 1.544 -12.869 -55.397 1.00 13.50 C ATOM 991 NH1 ARG A 66 2.368 -13.068 -54.372 1.00 2.55 N ATOM 992 NH2 ARG A 66 1.711 -13.559 -56.520 1.00 75.44 N ATOM 0 H ARG A 66 0.941 -7.837 -53.363 1.00 45.31 H new ATOM 0 HA ARG A 66 2.116 -9.661 -55.259 1.00 14.00 H new ATOM 0 HB2 ARG A 66 -0.467 -8.078 -55.441 1.00 41.14 H new ATOM 0 HB3 ARG A 66 -0.022 -9.466 -56.414 1.00 41.14 H new ATOM 0 HG2 ARG A 66 -0.734 -9.401 -53.468 1.00 42.33 H new ATOM 0 HG3 ARG A 66 -1.545 -10.266 -54.759 1.00 42.33 H new ATOM 0 HD2 ARG A 66 1.228 -10.873 -53.657 1.00 1.51 H new ATOM 0 HD3 ARG A 66 -0.227 -11.804 -53.362 1.00 1.51 H new ATOM 0 HE ARG A 66 -0.060 -11.855 -56.104 1.00 14.23 H new ATOM 0 HH11 ARG A 66 2.241 -12.543 -53.507 1.00 2.55 H new ATOM 0 HH12 ARG A 66 3.126 -13.745 -54.451 1.00 2.55 H new ATOM 0 HH21 ARG A 66 1.079 -13.412 -57.307 1.00 75.44 H new ATOM 0 HH22 ARG A 66 2.471 -14.235 -56.595 1.00 75.44 H new ATOM 1006 N GLY A 67 2.614 -6.602 -55.735 1.00 34.51 N ATOM 1007 CA GLY A 67 3.330 -5.662 -56.585 1.00 34.10 C ATOM 1008 C GLY A 67 2.443 -4.923 -57.570 1.00 63.33 C ATOM 1009 O GLY A 67 2.945 -4.211 -58.443 1.00 1.24 O ATOM 0 H GLY A 67 2.534 -6.310 -54.761 1.00 34.51 H new ATOM 0 HA2 GLY A 67 3.841 -4.934 -55.955 1.00 34.10 H new ATOM 0 HA3 GLY A 67 4.099 -6.201 -57.138 1.00 34.10 H new ATOM 1013 N LYS A 68 1.131 -5.075 -57.433 1.00 75.34 N ATOM 1014 CA LYS A 68 0.181 -4.369 -58.289 1.00 45.14 C ATOM 1015 C LYS A 68 -0.777 -3.537 -57.432 1.00 23.21 C ATOM 1016 O LYS A 68 -1.435 -4.076 -56.540 1.00 4.34 O ATOM 1017 CB LYS A 68 -0.608 -5.362 -59.162 1.00 40.24 C ATOM 1018 CG LYS A 68 -1.586 -4.694 -60.128 1.00 60.33 C ATOM 1019 CD LYS A 68 -0.863 -3.806 -61.142 1.00 74.22 C ATOM 1020 CE LYS A 68 -1.838 -2.989 -61.983 1.00 64.14 C ATOM 1021 NZ LYS A 68 -1.129 -2.120 -62.959 1.00 71.10 N ATOM 0 H LYS A 68 0.699 -5.682 -56.736 1.00 75.34 H new ATOM 0 HA LYS A 68 0.737 -3.702 -58.949 1.00 45.14 H new ATOM 0 HB2 LYS A 68 0.096 -5.967 -59.733 1.00 40.24 H new ATOM 0 HB3 LYS A 68 -1.160 -6.042 -58.513 1.00 40.24 H new ATOM 0 HG2 LYS A 68 -2.156 -5.459 -60.655 1.00 60.33 H new ATOM 0 HG3 LYS A 68 -2.302 -4.095 -59.565 1.00 60.33 H new ATOM 0 HD2 LYS A 68 -0.185 -3.133 -60.616 1.00 74.22 H new ATOM 0 HD3 LYS A 68 -0.251 -4.427 -61.797 1.00 74.22 H new ATOM 0 HE2 LYS A 68 -2.511 -3.661 -62.516 1.00 64.14 H new ATOM 0 HE3 LYS A 68 -2.455 -2.373 -61.329 1.00 64.14 H new ATOM 0 HZ1 LYS A 68 -1.825 -1.580 -63.512 1.00 71.10 H new ATOM 0 HZ2 LYS A 68 -0.506 -1.462 -62.449 1.00 71.10 H new ATOM 0 HZ3 LYS A 68 -0.560 -2.710 -63.599 1.00 71.10 H new ATOM 1035 N PRO A 69 -0.826 -2.209 -57.649 1.00 1.43 N ATOM 1036 CA PRO A 69 -1.769 -1.329 -56.955 1.00 41.05 C ATOM 1037 C PRO A 69 -3.133 -1.275 -57.651 1.00 63.34 C ATOM 1038 O PRO A 69 -3.255 -1.613 -58.832 1.00 73.21 O ATOM 1039 CB PRO A 69 -1.062 0.025 -57.027 1.00 65.54 C ATOM 1040 CG PRO A 69 -0.346 -0.006 -58.338 1.00 33.42 C ATOM 1041 CD PRO A 69 0.053 -1.446 -58.564 1.00 34.41 C ATOM 0 HA PRO A 69 -1.993 -1.661 -55.942 1.00 41.05 H new ATOM 0 HB2 PRO A 69 -1.774 0.849 -56.981 1.00 65.54 H new ATOM 0 HB3 PRO A 69 -0.368 0.157 -56.197 1.00 65.54 H new ATOM 0 HG2 PRO A 69 -0.990 0.351 -59.142 1.00 33.42 H new ATOM 0 HG3 PRO A 69 0.530 0.643 -58.319 1.00 33.42 H new ATOM 0 HD2 PRO A 69 -0.097 -1.744 -59.602 1.00 34.41 H new ATOM 0 HD3 PRO A 69 1.106 -1.609 -58.334 1.00 34.41 H new ATOM 1049 N PHE A 70 -4.151 -0.856 -56.906 1.00 41.12 N ATOM 1050 CA PHE A 70 -5.501 -0.706 -57.445 1.00 52.04 C ATOM 1051 C PHE A 70 -5.885 0.771 -57.428 1.00 55.23 C ATOM 1052 O PHE A 70 -5.298 1.548 -56.681 1.00 31.10 O ATOM 1053 CB PHE A 70 -6.495 -1.538 -56.616 1.00 51.25 C ATOM 1054 CG PHE A 70 -7.914 -1.502 -57.135 1.00 44.01 C ATOM 1055 CD1 PHE A 70 -8.258 -2.179 -58.298 1.00 50.33 C ATOM 1056 CD2 PHE A 70 -8.901 -0.789 -56.464 1.00 54.02 C ATOM 1057 CE1 PHE A 70 -9.552 -2.148 -58.779 1.00 71.23 C ATOM 1058 CE2 PHE A 70 -10.198 -0.755 -56.943 1.00 42.20 C ATOM 1059 CZ PHE A 70 -10.524 -1.434 -58.102 1.00 20.44 C ATOM 0 H PHE A 70 -4.066 -0.612 -55.919 1.00 41.12 H new ATOM 0 HA PHE A 70 -5.530 -1.069 -58.472 1.00 52.04 H new ATOM 0 HB2 PHE A 70 -6.154 -2.573 -56.592 1.00 51.25 H new ATOM 0 HB3 PHE A 70 -6.486 -1.176 -55.588 1.00 51.25 H new ATOM 0 HD1 PHE A 70 -7.504 -2.737 -58.833 1.00 50.33 H new ATOM 0 HD2 PHE A 70 -8.652 -0.256 -55.558 1.00 54.02 H new ATOM 0 HE1 PHE A 70 -9.805 -2.681 -59.684 1.00 71.23 H new ATOM 0 HE2 PHE A 70 -10.956 -0.198 -56.412 1.00 42.20 H new ATOM 0 HZ PHE A 70 -11.536 -1.407 -58.478 1.00 20.44 H new ATOM 1069 N GLN A 71 -6.848 1.163 -58.257 1.00 45.33 N ATOM 1070 CA GLN A 71 -7.302 2.552 -58.299 1.00 52.35 C ATOM 1071 C GLN A 71 -8.824 2.624 -58.323 1.00 12.44 C ATOM 1072 O GLN A 71 -9.479 1.824 -58.994 1.00 73.44 O ATOM 1073 CB GLN A 71 -6.736 3.287 -59.527 1.00 41.45 C ATOM 1074 CG GLN A 71 -5.219 3.432 -59.537 1.00 24.22 C ATOM 1075 CD GLN A 71 -4.727 4.341 -60.652 1.00 52.53 C ATOM 1076 OE1 GLN A 71 -5.350 4.448 -61.709 1.00 33.44 O ATOM 1077 NE2 GLN A 71 -3.604 5.002 -60.427 1.00 75.03 N ATOM 0 H GLN A 71 -7.329 0.542 -58.908 1.00 45.33 H new ATOM 0 HA GLN A 71 -6.934 3.041 -57.397 1.00 52.35 H new ATOM 0 HB2 GLN A 71 -7.043 2.753 -60.427 1.00 41.45 H new ATOM 0 HB3 GLN A 71 -7.183 4.280 -59.578 1.00 41.45 H new ATOM 0 HG2 GLN A 71 -4.889 3.829 -58.577 1.00 24.22 H new ATOM 0 HG3 GLN A 71 -4.764 2.448 -59.648 1.00 24.22 H new ATOM 0 HE21 GLN A 71 -3.115 4.889 -59.539 1.00 75.03 H new ATOM 0 HE22 GLN A 71 -3.227 5.625 -61.141 1.00 75.03 H new ATOM 1086 N PHE A 72 -9.375 3.578 -57.579 1.00 73.33 N ATOM 1087 CA PHE A 72 -10.809 3.854 -57.613 1.00 2.55 C ATOM 1088 C PHE A 72 -11.062 5.291 -57.167 1.00 20.34 C ATOM 1089 O PHE A 72 -10.273 5.857 -56.411 1.00 61.22 O ATOM 1090 CB PHE A 72 -11.597 2.868 -56.728 1.00 25.13 C ATOM 1091 CG PHE A 72 -11.445 3.096 -55.240 1.00 43.44 C ATOM 1092 CD1 PHE A 72 -10.382 2.545 -54.541 1.00 1.40 C ATOM 1093 CD2 PHE A 72 -12.375 3.859 -54.542 1.00 73.40 C ATOM 1094 CE1 PHE A 72 -10.249 2.751 -53.181 1.00 5.31 C ATOM 1095 CE2 PHE A 72 -12.244 4.067 -53.184 1.00 1.11 C ATOM 1096 CZ PHE A 72 -11.181 3.513 -52.503 1.00 32.03 C ATOM 0 H PHE A 72 -8.848 4.176 -56.942 1.00 73.33 H new ATOM 0 HA PHE A 72 -11.160 3.724 -58.637 1.00 2.55 H new ATOM 0 HB2 PHE A 72 -12.654 2.934 -56.986 1.00 25.13 H new ATOM 0 HB3 PHE A 72 -11.274 1.853 -56.961 1.00 25.13 H new ATOM 0 HD1 PHE A 72 -9.650 1.948 -55.065 1.00 1.40 H new ATOM 0 HD2 PHE A 72 -13.211 4.294 -55.070 1.00 73.40 H new ATOM 0 HE1 PHE A 72 -9.416 2.316 -52.648 1.00 5.31 H new ATOM 0 HE2 PHE A 72 -12.973 4.663 -52.655 1.00 1.11 H new ATOM 0 HZ PHE A 72 -11.077 3.675 -51.440 1.00 32.03 H new ATOM 1106 N THR A 73 -12.141 5.884 -57.656 1.00 51.11 N ATOM 1107 CA THR A 73 -12.505 7.240 -57.273 1.00 1.20 C ATOM 1108 C THR A 73 -13.063 7.274 -55.847 1.00 62.13 C ATOM 1109 O THR A 73 -14.162 6.779 -55.585 1.00 74.23 O ATOM 1110 CB THR A 73 -13.535 7.839 -58.258 1.00 52.41 C ATOM 1111 OG1 THR A 73 -13.009 7.790 -59.594 1.00 54.54 O ATOM 1112 CG2 THR A 73 -13.876 9.283 -57.895 1.00 75.20 C ATOM 0 H THR A 73 -12.780 5.447 -58.320 1.00 51.11 H new ATOM 0 HA THR A 73 -11.600 7.846 -57.309 1.00 1.20 H new ATOM 0 HB THR A 73 -14.449 7.248 -58.196 1.00 52.41 H new ATOM 0 HG1 THR A 73 -13.664 8.168 -60.217 1.00 54.54 H new ATOM 0 HG21 THR A 73 -14.603 9.675 -58.607 1.00 75.20 H new ATOM 0 HG22 THR A 73 -14.298 9.316 -56.890 1.00 75.20 H new ATOM 0 HG23 THR A 73 -12.971 9.890 -57.929 1.00 75.20 H new ATOM 1120 N LEU A 74 -12.284 7.838 -54.928 1.00 41.42 N ATOM 1121 CA LEU A 74 -12.706 7.997 -53.539 1.00 2.01 C ATOM 1122 C LEU A 74 -13.958 8.873 -53.464 1.00 50.22 C ATOM 1123 O LEU A 74 -14.038 9.909 -54.135 1.00 44.43 O ATOM 1124 CB LEU A 74 -11.569 8.615 -52.705 1.00 4.02 C ATOM 1125 CG LEU A 74 -11.880 8.841 -51.213 1.00 75.13 C ATOM 1126 CD1 LEU A 74 -12.237 7.528 -50.521 1.00 51.31 C ATOM 1127 CD2 LEU A 74 -10.699 9.514 -50.516 1.00 40.31 C ATOM 0 H LEU A 74 -11.349 8.196 -55.123 1.00 41.42 H new ATOM 0 HA LEU A 74 -12.943 7.015 -53.130 1.00 2.01 H new ATOM 0 HB2 LEU A 74 -10.695 7.968 -52.781 1.00 4.02 H new ATOM 0 HB3 LEU A 74 -11.297 9.572 -53.149 1.00 4.02 H new ATOM 0 HG LEU A 74 -12.744 9.501 -51.144 1.00 75.13 H new ATOM 0 HD11 LEU A 74 -12.452 7.718 -49.469 1.00 51.31 H new ATOM 0 HD12 LEU A 74 -13.115 7.092 -50.998 1.00 51.31 H new ATOM 0 HD13 LEU A 74 -11.399 6.835 -50.601 1.00 51.31 H new ATOM 0 HD21 LEU A 74 -10.936 9.666 -49.463 1.00 40.31 H new ATOM 0 HD22 LEU A 74 -9.817 8.880 -50.601 1.00 40.31 H new ATOM 0 HD23 LEU A 74 -10.500 10.477 -50.986 1.00 40.31 H new ATOM 1139 N GLY A 75 -14.933 8.455 -52.662 1.00 21.12 N ATOM 1140 CA GLY A 75 -16.188 9.180 -52.565 1.00 51.53 C ATOM 1141 C GLY A 75 -17.233 8.645 -53.526 1.00 33.31 C ATOM 1142 O GLY A 75 -18.413 9.000 -53.435 1.00 41.10 O ATOM 0 H GLY A 75 -14.876 7.623 -52.075 1.00 21.12 H new ATOM 0 HA2 GLY A 75 -16.567 9.113 -51.545 1.00 51.53 H new ATOM 0 HA3 GLY A 75 -16.013 10.236 -52.772 1.00 51.53 H new ATOM 1146 N ALA A 76 -16.801 7.792 -54.452 1.00 23.41 N ATOM 1147 CA ALA A 76 -17.704 7.169 -55.414 1.00 10.02 C ATOM 1148 C ALA A 76 -18.201 5.829 -54.879 1.00 2.44 C ATOM 1149 O ALA A 76 -17.587 5.243 -53.986 1.00 74.43 O ATOM 1150 CB ALA A 76 -17.011 6.982 -56.760 1.00 13.12 C ATOM 0 H ALA A 76 -15.825 7.516 -54.556 1.00 23.41 H new ATOM 0 HA ALA A 76 -18.561 7.827 -55.560 1.00 10.02 H new ATOM 0 HB1 ALA A 76 -17.701 6.516 -57.463 1.00 13.12 H new ATOM 0 HB2 ALA A 76 -16.699 7.952 -57.147 1.00 13.12 H new ATOM 0 HB3 ALA A 76 -16.136 6.344 -56.633 1.00 13.12 H new ATOM 1156 N GLY A 77 -19.302 5.338 -55.438 1.00 45.30 N ATOM 1157 CA GLY A 77 -19.892 4.093 -54.973 1.00 54.35 C ATOM 1158 C GLY A 77 -19.208 2.868 -55.550 1.00 33.32 C ATOM 1159 O GLY A 77 -19.868 1.890 -55.912 1.00 54.41 O ATOM 0 H GLY A 77 -19.800 5.782 -56.210 1.00 45.30 H new ATOM 0 HA2 GLY A 77 -19.839 4.055 -53.885 1.00 54.35 H new ATOM 0 HA3 GLY A 77 -20.948 4.074 -55.241 1.00 54.35 H new ATOM 1163 N GLU A 78 -17.882 2.915 -55.632 1.00 32.55 N ATOM 1164 CA GLU A 78 -17.099 1.808 -56.169 1.00 75.44 C ATOM 1165 C GLU A 78 -16.803 0.788 -55.073 1.00 54.02 C ATOM 1166 O GLU A 78 -16.587 -0.392 -55.346 1.00 2.52 O ATOM 1167 CB GLU A 78 -15.792 2.329 -56.784 1.00 2.50 C ATOM 1168 CG GLU A 78 -16.005 3.379 -57.870 1.00 4.04 C ATOM 1169 CD GLU A 78 -16.979 2.924 -58.947 1.00 63.04 C ATOM 1170 OE1 GLU A 78 -16.642 1.988 -59.706 1.00 1.53 O ATOM 1171 OE2 GLU A 78 -18.091 3.487 -59.037 1.00 75.43 O ATOM 0 H GLU A 78 -17.324 3.714 -55.331 1.00 32.55 H new ATOM 0 HA GLU A 78 -17.679 1.318 -56.951 1.00 75.44 H new ATOM 0 HB2 GLU A 78 -15.173 2.755 -55.994 1.00 2.50 H new ATOM 0 HB3 GLU A 78 -15.238 1.490 -57.205 1.00 2.50 H new ATOM 0 HG2 GLU A 78 -16.377 4.296 -57.414 1.00 4.04 H new ATOM 0 HG3 GLU A 78 -15.047 3.618 -58.331 1.00 4.04 H new ATOM 1178 N VAL A 79 -16.798 1.260 -53.831 1.00 13.45 N ATOM 1179 CA VAL A 79 -16.565 0.406 -52.670 1.00 1.34 C ATOM 1180 C VAL A 79 -17.618 0.690 -51.602 1.00 20.50 C ATOM 1181 O VAL A 79 -18.365 1.666 -51.703 1.00 12.22 O ATOM 1182 CB VAL A 79 -15.147 0.622 -52.069 1.00 22.51 C ATOM 1183 CG1 VAL A 79 -14.059 0.242 -53.073 1.00 2.53 C ATOM 1184 CG2 VAL A 79 -14.970 2.067 -51.604 1.00 32.01 C ATOM 0 H VAL A 79 -16.955 2.241 -53.600 1.00 13.45 H new ATOM 0 HA VAL A 79 -16.636 -0.630 -53.001 1.00 1.34 H new ATOM 0 HB VAL A 79 -15.048 -0.032 -51.203 1.00 22.51 H new ATOM 0 HG11 VAL A 79 -13.078 0.403 -52.625 1.00 2.53 H new ATOM 0 HG12 VAL A 79 -14.165 -0.808 -53.345 1.00 2.53 H new ATOM 0 HG13 VAL A 79 -14.156 0.860 -53.966 1.00 2.53 H new ATOM 0 HG21 VAL A 79 -13.971 2.195 -51.187 1.00 32.01 H new ATOM 0 HG22 VAL A 79 -15.099 2.740 -52.451 1.00 32.01 H new ATOM 0 HG23 VAL A 79 -15.714 2.297 -50.841 1.00 32.01 H new ATOM 1194 N ILE A 80 -17.686 -0.170 -50.593 1.00 75.42 N ATOM 1195 CA ILE A 80 -18.600 0.037 -49.477 1.00 23.41 C ATOM 1196 C ILE A 80 -18.092 1.173 -48.589 1.00 60.52 C ATOM 1197 O ILE A 80 -16.888 1.449 -48.553 1.00 13.14 O ATOM 1198 CB ILE A 80 -18.778 -1.258 -48.646 1.00 73.33 C ATOM 1199 CG1 ILE A 80 -17.420 -1.759 -48.129 1.00 72.25 C ATOM 1200 CG2 ILE A 80 -19.481 -2.332 -49.479 1.00 24.01 C ATOM 1201 CD1 ILE A 80 -17.487 -3.096 -47.423 1.00 43.25 C ATOM 0 H ILE A 80 -17.120 -1.016 -50.525 1.00 75.42 H new ATOM 0 HA ILE A 80 -19.575 0.308 -49.883 1.00 23.41 H new ATOM 0 HB ILE A 80 -19.404 -1.035 -47.782 1.00 73.33 H new ATOM 0 HG12 ILE A 80 -16.729 -1.837 -48.969 1.00 72.25 H new ATOM 0 HG13 ILE A 80 -17.007 -1.018 -47.444 1.00 72.25 H new ATOM 0 HG21 ILE A 80 -19.599 -3.236 -48.882 1.00 24.01 H new ATOM 0 HG22 ILE A 80 -20.462 -1.970 -49.787 1.00 24.01 H new ATOM 0 HG23 ILE A 80 -18.883 -2.556 -50.363 1.00 24.01 H new ATOM 0 HD11 ILE A 80 -16.490 -3.381 -47.088 1.00 43.25 H new ATOM 0 HD12 ILE A 80 -18.151 -3.020 -46.562 1.00 43.25 H new ATOM 0 HD13 ILE A 80 -17.869 -3.851 -48.110 1.00 43.25 H new ATOM 1213 N LYS A 81 -19.008 1.821 -47.872 1.00 23.20 N ATOM 1214 CA LYS A 81 -18.680 3.020 -47.100 1.00 11.25 C ATOM 1215 C LYS A 81 -17.612 2.713 -46.050 1.00 2.21 C ATOM 1216 O LYS A 81 -16.833 3.588 -45.671 1.00 14.32 O ATOM 1217 CB LYS A 81 -19.949 3.601 -46.440 1.00 0.11 C ATOM 1218 CG LYS A 81 -19.995 5.134 -46.398 1.00 41.11 C ATOM 1219 CD LYS A 81 -18.901 5.740 -45.518 1.00 62.14 C ATOM 1220 CE LYS A 81 -18.910 7.267 -45.564 1.00 73.31 C ATOM 1221 NZ LYS A 81 -18.643 7.793 -46.932 1.00 30.33 N ATOM 0 H LYS A 81 -19.985 1.536 -47.809 1.00 23.20 H new ATOM 0 HA LYS A 81 -18.276 3.768 -47.782 1.00 11.25 H new ATOM 0 HB2 LYS A 81 -20.824 3.238 -46.980 1.00 0.11 H new ATOM 0 HB3 LYS A 81 -20.022 3.219 -45.422 1.00 0.11 H new ATOM 0 HG2 LYS A 81 -19.896 5.523 -47.411 1.00 41.11 H new ATOM 0 HG3 LYS A 81 -20.970 5.453 -46.028 1.00 41.11 H new ATOM 0 HD2 LYS A 81 -19.038 5.407 -44.489 1.00 62.14 H new ATOM 0 HD3 LYS A 81 -17.928 5.373 -45.845 1.00 62.14 H new ATOM 0 HE2 LYS A 81 -19.877 7.633 -45.219 1.00 73.31 H new ATOM 0 HE3 LYS A 81 -18.159 7.653 -44.875 1.00 73.31 H new ATOM 0 HZ1 LYS A 81 -18.408 8.804 -46.875 1.00 30.33 H new ATOM 0 HZ2 LYS A 81 -17.846 7.275 -47.354 1.00 30.33 H new ATOM 0 HZ3 LYS A 81 -19.489 7.667 -47.524 1.00 30.33 H new ATOM 1235 N GLY A 82 -17.578 1.467 -45.588 1.00 34.43 N ATOM 1236 CA GLY A 82 -16.562 1.051 -44.638 1.00 31.53 C ATOM 1237 C GLY A 82 -15.156 1.263 -45.178 1.00 11.44 C ATOM 1238 O GLY A 82 -14.331 1.941 -44.552 1.00 11.05 O ATOM 0 H GLY A 82 -18.238 0.736 -45.855 1.00 34.43 H new ATOM 0 HA2 GLY A 82 -16.682 1.611 -43.710 1.00 31.53 H new ATOM 0 HA3 GLY A 82 -16.702 -0.002 -44.395 1.00 31.53 H new ATOM 1242 N TRP A 83 -14.890 0.702 -46.355 1.00 20.04 N ATOM 1243 CA TRP A 83 -13.583 0.833 -46.993 1.00 54.32 C ATOM 1244 C TRP A 83 -13.340 2.284 -47.392 1.00 71.34 C ATOM 1245 O TRP A 83 -12.241 2.809 -47.218 1.00 52.20 O ATOM 1246 CB TRP A 83 -13.486 -0.077 -48.227 1.00 1.15 C ATOM 1247 CG TRP A 83 -13.648 -1.539 -47.916 1.00 60.24 C ATOM 1248 CD1 TRP A 83 -13.436 -2.155 -46.715 1.00 62.11 C ATOM 1249 CD2 TRP A 83 -14.040 -2.571 -48.831 1.00 23.23 C ATOM 1250 NE1 TRP A 83 -13.685 -3.500 -46.825 1.00 5.04 N ATOM 1251 CE2 TRP A 83 -14.052 -3.781 -48.114 1.00 4.34 C ATOM 1252 CE3 TRP A 83 -14.384 -2.589 -50.186 1.00 42.12 C ATOM 1253 CZ2 TRP A 83 -14.397 -4.995 -48.704 1.00 13.44 C ATOM 1254 CZ3 TRP A 83 -14.725 -3.794 -50.772 1.00 3.14 C ATOM 1255 CH2 TRP A 83 -14.728 -4.983 -50.032 1.00 54.32 C ATOM 0 H TRP A 83 -15.564 0.151 -46.887 1.00 20.04 H new ATOM 0 HA TRP A 83 -12.819 0.526 -46.279 1.00 54.32 H new ATOM 0 HB2 TRP A 83 -14.250 0.219 -48.946 1.00 1.15 H new ATOM 0 HB3 TRP A 83 -12.519 0.078 -48.706 1.00 1.15 H new ATOM 0 HD1 TRP A 83 -13.119 -1.656 -45.811 1.00 62.11 H new ATOM 0 HE1 TRP A 83 -13.609 -4.180 -46.069 1.00 5.04 H new ATOM 0 HE3 TRP A 83 -14.383 -1.677 -50.765 1.00 42.12 H new ATOM 0 HZ2 TRP A 83 -14.403 -5.912 -48.134 1.00 13.44 H new ATOM 0 HZ3 TRP A 83 -14.994 -3.819 -51.818 1.00 3.14 H new ATOM 0 HH2 TRP A 83 -14.997 -5.909 -50.519 1.00 54.32 H new ATOM 1266 N ASP A 84 -14.389 2.918 -47.915 1.00 72.43 N ATOM 1267 CA ASP A 84 -14.343 4.325 -48.319 1.00 32.24 C ATOM 1268 C ASP A 84 -13.817 5.201 -47.183 1.00 32.32 C ATOM 1269 O ASP A 84 -12.882 5.978 -47.370 1.00 11.55 O ATOM 1270 CB ASP A 84 -15.746 4.785 -48.750 1.00 51.14 C ATOM 1271 CG ASP A 84 -15.836 6.281 -49.019 1.00 24.20 C ATOM 1272 OD1 ASP A 84 -15.528 6.719 -50.150 1.00 41.55 O ATOM 1273 OD2 ASP A 84 -16.252 7.027 -48.105 1.00 3.24 O ATOM 0 H ASP A 84 -15.293 2.473 -48.071 1.00 72.43 H new ATOM 0 HA ASP A 84 -13.659 4.426 -49.162 1.00 32.24 H new ATOM 0 HB2 ASP A 84 -16.037 4.243 -49.650 1.00 51.14 H new ATOM 0 HB3 ASP A 84 -16.462 4.519 -47.972 1.00 51.14 H new ATOM 1278 N GLN A 85 -14.404 5.049 -46.001 1.00 53.44 N ATOM 1279 CA GLN A 85 -13.994 5.822 -44.829 1.00 73.31 C ATOM 1280 C GLN A 85 -12.577 5.432 -44.405 1.00 50.41 C ATOM 1281 O GLN A 85 -11.727 6.299 -44.150 1.00 43.23 O ATOM 1282 CB GLN A 85 -14.979 5.594 -43.670 1.00 11.22 C ATOM 1283 CG GLN A 85 -14.643 6.375 -42.402 1.00 25.14 C ATOM 1284 CD GLN A 85 -15.639 6.127 -41.280 1.00 22.14 C ATOM 1285 OE1 GLN A 85 -15.470 5.219 -40.469 1.00 20.15 O ATOM 1286 NE2 GLN A 85 -16.688 6.933 -41.232 1.00 2.41 N ATOM 0 H GLN A 85 -15.168 4.396 -45.826 1.00 53.44 H new ATOM 0 HA GLN A 85 -14.000 6.880 -45.090 1.00 73.31 H new ATOM 0 HB2 GLN A 85 -15.981 5.871 -43.999 1.00 11.22 H new ATOM 0 HB3 GLN A 85 -15.004 4.530 -43.433 1.00 11.22 H new ATOM 0 HG2 GLN A 85 -13.644 6.099 -42.064 1.00 25.14 H new ATOM 0 HG3 GLN A 85 -14.618 7.440 -42.632 1.00 25.14 H new ATOM 0 HE21 GLN A 85 -16.793 7.675 -41.924 1.00 2.41 H new ATOM 0 HE22 GLN A 85 -17.391 6.812 -40.503 1.00 2.41 H new ATOM 1295 N GLY A 86 -12.332 4.122 -44.349 1.00 70.40 N ATOM 1296 CA GLY A 86 -11.030 3.608 -43.950 1.00 62.34 C ATOM 1297 C GLY A 86 -9.889 4.215 -44.744 1.00 13.43 C ATOM 1298 O GLY A 86 -8.888 4.652 -44.177 1.00 1.43 O ATOM 0 H GLY A 86 -13.019 3.403 -44.575 1.00 70.40 H new ATOM 0 HA2 GLY A 86 -10.875 3.808 -42.890 1.00 62.34 H new ATOM 0 HA3 GLY A 86 -11.018 2.525 -44.075 1.00 62.34 H new ATOM 1302 N VAL A 87 -10.038 4.234 -46.061 1.00 54.13 N ATOM 1303 CA VAL A 87 -9.027 4.816 -46.938 1.00 50.24 C ATOM 1304 C VAL A 87 -9.075 6.346 -46.897 1.00 54.40 C ATOM 1305 O VAL A 87 -8.045 7.010 -47.007 1.00 10.11 O ATOM 1306 CB VAL A 87 -9.180 4.315 -48.400 1.00 55.44 C ATOM 1307 CG1 VAL A 87 -10.523 4.728 -48.995 1.00 34.31 C ATOM 1308 CG2 VAL A 87 -8.027 4.808 -49.266 1.00 62.31 C ATOM 0 H VAL A 87 -10.849 3.853 -46.548 1.00 54.13 H new ATOM 0 HA VAL A 87 -8.056 4.488 -46.568 1.00 50.24 H new ATOM 0 HB VAL A 87 -9.150 3.226 -48.380 1.00 55.44 H new ATOM 0 HG11 VAL A 87 -10.596 4.361 -50.019 1.00 34.31 H new ATOM 0 HG12 VAL A 87 -11.331 4.304 -48.399 1.00 34.31 H new ATOM 0 HG13 VAL A 87 -10.603 5.815 -48.993 1.00 34.31 H new ATOM 0 HG21 VAL A 87 -8.156 4.444 -50.285 1.00 62.31 H new ATOM 0 HG22 VAL A 87 -8.014 5.898 -49.268 1.00 62.31 H new ATOM 0 HG23 VAL A 87 -7.085 4.435 -48.864 1.00 62.31 H new ATOM 1318 N ALA A 88 -10.268 6.905 -46.722 1.00 43.42 N ATOM 1319 CA ALA A 88 -10.440 8.359 -46.698 1.00 63.54 C ATOM 1320 C ALA A 88 -9.797 8.984 -45.460 1.00 61.41 C ATOM 1321 O ALA A 88 -9.425 10.159 -45.471 1.00 62.12 O ATOM 1322 CB ALA A 88 -11.917 8.721 -46.757 1.00 72.34 C ATOM 0 H ALA A 88 -11.131 6.377 -46.595 1.00 43.42 H new ATOM 0 HA ALA A 88 -9.937 8.762 -47.577 1.00 63.54 H new ATOM 0 HB1 ALA A 88 -12.027 9.805 -46.738 1.00 72.34 H new ATOM 0 HB2 ALA A 88 -12.351 8.328 -47.676 1.00 72.34 H new ATOM 0 HB3 ALA A 88 -12.432 8.289 -45.899 1.00 72.34 H new ATOM 1328 N THR A 89 -9.677 8.204 -44.388 1.00 71.10 N ATOM 1329 CA THR A 89 -9.146 8.718 -43.125 1.00 21.14 C ATOM 1330 C THR A 89 -7.615 8.582 -43.019 1.00 72.32 C ATOM 1331 O THR A 89 -7.057 8.695 -41.923 1.00 61.43 O ATOM 1332 CB THR A 89 -9.827 8.018 -41.918 1.00 10.23 C ATOM 1333 OG1 THR A 89 -9.510 8.705 -40.698 1.00 70.41 O ATOM 1334 CG2 THR A 89 -9.404 6.558 -41.800 1.00 23.35 C ATOM 0 H THR A 89 -9.938 7.218 -44.367 1.00 71.10 H new ATOM 0 HA THR A 89 -9.376 9.783 -43.105 1.00 21.14 H new ATOM 0 HB THR A 89 -10.903 8.050 -42.090 1.00 10.23 H new ATOM 0 HG1 THR A 89 -8.545 8.869 -40.656 1.00 70.41 H new ATOM 0 HG21 THR A 89 -9.902 6.103 -40.944 1.00 23.35 H new ATOM 0 HG22 THR A 89 -9.683 6.024 -42.708 1.00 23.35 H new ATOM 0 HG23 THR A 89 -8.324 6.502 -41.664 1.00 23.35 H new ATOM 1342 N MET A 90 -6.925 8.378 -44.145 1.00 23.21 N ATOM 1343 CA MET A 90 -5.456 8.277 -44.132 1.00 52.35 C ATOM 1344 C MET A 90 -4.820 9.272 -45.101 1.00 34.44 C ATOM 1345 O MET A 90 -5.520 10.009 -45.792 1.00 64.34 O ATOM 1346 CB MET A 90 -4.993 6.856 -44.475 1.00 2.44 C ATOM 1347 CG MET A 90 -5.317 6.417 -45.895 1.00 20.52 C ATOM 1348 SD MET A 90 -4.557 4.841 -46.318 1.00 33.02 S ATOM 1349 CE MET A 90 -5.022 3.865 -44.896 1.00 71.33 C ATOM 0 H MET A 90 -7.349 8.280 -45.067 1.00 23.21 H new ATOM 0 HA MET A 90 -5.130 8.518 -43.120 1.00 52.35 H new ATOM 0 HB2 MET A 90 -3.915 6.791 -44.324 1.00 2.44 H new ATOM 0 HB3 MET A 90 -5.455 6.158 -43.777 1.00 2.44 H new ATOM 0 HG2 MET A 90 -6.398 6.338 -46.010 1.00 20.52 H new ATOM 0 HG3 MET A 90 -4.977 7.180 -46.595 1.00 20.52 H new ATOM 0 HE1 MET A 90 -4.866 2.808 -45.113 1.00 71.33 H new ATOM 0 HE2 MET A 90 -4.411 4.154 -44.041 1.00 71.33 H new ATOM 0 HE3 MET A 90 -6.073 4.037 -44.665 1.00 71.33 H new ATOM 1359 N THR A 91 -3.486 9.290 -45.139 1.00 54.53 N ATOM 1360 CA THR A 91 -2.741 10.172 -46.039 1.00 60.53 C ATOM 1361 C THR A 91 -1.927 9.349 -47.044 1.00 4.54 C ATOM 1362 O THR A 91 -1.922 8.119 -46.982 1.00 62.15 O ATOM 1363 CB THR A 91 -1.804 11.114 -45.243 1.00 2.34 C ATOM 1364 OG1 THR A 91 -0.898 10.351 -44.431 1.00 75.53 O ATOM 1365 CG2 THR A 91 -2.605 12.062 -44.355 1.00 54.53 C ATOM 0 H THR A 91 -2.896 8.699 -44.552 1.00 54.53 H new ATOM 0 HA THR A 91 -3.462 10.783 -46.583 1.00 60.53 H new ATOM 0 HB THR A 91 -1.237 11.703 -45.963 1.00 2.34 H new ATOM 0 HG1 THR A 91 -0.666 10.864 -43.629 1.00 75.53 H new ATOM 0 HG21 THR A 91 -1.922 12.712 -43.808 1.00 54.53 H new ATOM 0 HG22 THR A 91 -3.266 12.669 -44.974 1.00 54.53 H new ATOM 0 HG23 THR A 91 -3.200 11.483 -43.648 1.00 54.53 H new ATOM 1373 N LEU A 92 -1.238 10.025 -47.966 1.00 74.01 N ATOM 1374 CA LEU A 92 -0.478 9.341 -49.012 1.00 25.41 C ATOM 1375 C LEU A 92 0.733 8.634 -48.404 1.00 32.24 C ATOM 1376 O LEU A 92 1.491 9.233 -47.638 1.00 31.23 O ATOM 1377 CB LEU A 92 -0.053 10.350 -50.103 1.00 14.43 C ATOM 1378 CG LEU A 92 0.435 9.761 -51.446 1.00 74.12 C ATOM 1379 CD1 LEU A 92 0.428 10.838 -52.531 1.00 1.01 C ATOM 1380 CD2 LEU A 92 1.832 9.151 -51.323 1.00 24.41 C ATOM 0 H LEU A 92 -1.191 11.043 -48.009 1.00 74.01 H new ATOM 0 HA LEU A 92 -1.108 8.585 -49.480 1.00 25.41 H new ATOM 0 HB2 LEU A 92 -0.899 11.006 -50.307 1.00 14.43 H new ATOM 0 HB3 LEU A 92 0.743 10.974 -49.697 1.00 14.43 H new ATOM 0 HG LEU A 92 -0.254 8.963 -51.724 1.00 74.12 H new ATOM 0 HD11 LEU A 92 0.774 10.409 -53.472 1.00 1.01 H new ATOM 0 HD12 LEU A 92 -0.585 11.221 -52.657 1.00 1.01 H new ATOM 0 HD13 LEU A 92 1.090 11.653 -52.239 1.00 1.01 H new ATOM 0 HD21 LEU A 92 2.139 8.748 -52.288 1.00 24.41 H new ATOM 0 HD22 LEU A 92 2.538 9.920 -51.009 1.00 24.41 H new ATOM 0 HD23 LEU A 92 1.816 8.350 -50.584 1.00 24.41 H new ATOM 1392 N GLY A 93 0.890 7.354 -48.738 1.00 34.21 N ATOM 1393 CA GLY A 93 2.008 6.570 -48.243 1.00 5.55 C ATOM 1394 C GLY A 93 1.699 5.898 -46.919 1.00 72.25 C ATOM 1395 O GLY A 93 2.571 5.279 -46.308 1.00 64.11 O ATOM 0 H GLY A 93 0.254 6.842 -49.350 1.00 34.21 H new ATOM 0 HA2 GLY A 93 2.271 5.811 -48.980 1.00 5.55 H new ATOM 0 HA3 GLY A 93 2.878 7.216 -48.126 1.00 5.55 H new ATOM 1399 N GLU A 94 0.449 6.013 -46.481 1.00 71.34 N ATOM 1400 CA GLU A 94 0.035 5.502 -45.181 1.00 13.03 C ATOM 1401 C GLU A 94 -0.676 4.154 -45.322 1.00 35.11 C ATOM 1402 O GLU A 94 -1.530 3.979 -46.191 1.00 11.33 O ATOM 1403 CB GLU A 94 -0.873 6.537 -44.498 1.00 33.44 C ATOM 1404 CG GLU A 94 -1.225 6.219 -43.047 1.00 42.11 C ATOM 1405 CD GLU A 94 -1.635 7.461 -42.273 1.00 1.35 C ATOM 1406 OE1 GLU A 94 -0.739 8.154 -41.746 1.00 22.02 O ATOM 1407 OE2 GLU A 94 -2.846 7.761 -42.197 1.00 1.51 O ATOM 0 H GLU A 94 -0.299 6.459 -47.013 1.00 71.34 H new ATOM 0 HA GLU A 94 0.918 5.338 -44.563 1.00 13.03 H new ATOM 0 HB2 GLU A 94 -0.383 7.510 -44.534 1.00 33.44 H new ATOM 0 HB3 GLU A 94 -1.796 6.624 -45.071 1.00 33.44 H new ATOM 0 HG2 GLU A 94 -2.037 5.492 -43.022 1.00 42.11 H new ATOM 0 HG3 GLU A 94 -0.367 5.755 -42.560 1.00 42.11 H new ATOM 1414 N LYS A 95 -0.294 3.202 -44.475 1.00 63.35 N ATOM 1415 CA LYS A 95 -0.935 1.891 -44.423 1.00 74.54 C ATOM 1416 C LYS A 95 -1.562 1.705 -43.048 1.00 2.34 C ATOM 1417 O LYS A 95 -0.857 1.710 -42.032 1.00 24.43 O ATOM 1418 CB LYS A 95 0.081 0.767 -44.698 1.00 62.30 C ATOM 1419 CG LYS A 95 -0.561 -0.602 -44.951 1.00 64.33 C ATOM 1420 CD LYS A 95 0.490 -1.699 -45.141 1.00 65.41 C ATOM 1421 CE LYS A 95 -0.078 -2.931 -45.849 1.00 1.24 C ATOM 1422 NZ LYS A 95 -1.224 -3.543 -45.123 1.00 21.52 N ATOM 0 H LYS A 95 0.467 3.317 -43.806 1.00 63.35 H new ATOM 0 HA LYS A 95 -1.704 1.840 -45.194 1.00 74.54 H new ATOM 0 HB2 LYS A 95 0.685 1.040 -45.564 1.00 62.30 H new ATOM 0 HB3 LYS A 95 0.759 0.688 -43.849 1.00 62.30 H new ATOM 0 HG2 LYS A 95 -1.208 -0.860 -44.112 1.00 64.33 H new ATOM 0 HG3 LYS A 95 -1.194 -0.548 -45.837 1.00 64.33 H new ATOM 0 HD2 LYS A 95 1.325 -1.303 -45.719 1.00 65.41 H new ATOM 0 HD3 LYS A 95 0.886 -1.992 -44.169 1.00 65.41 H new ATOM 0 HE2 LYS A 95 -0.399 -2.651 -46.852 1.00 1.24 H new ATOM 0 HE3 LYS A 95 0.711 -3.674 -45.963 1.00 1.24 H new ATOM 0 HZ1 LYS A 95 -1.754 -4.162 -45.770 1.00 21.52 H new ATOM 0 HZ2 LYS A 95 -0.868 -4.103 -44.322 1.00 21.52 H new ATOM 0 HZ3 LYS A 95 -1.852 -2.793 -44.769 1.00 21.52 H new ATOM 1436 N ALA A 96 -2.877 1.560 -43.010 1.00 20.50 N ATOM 1437 CA ALA A 96 -3.602 1.459 -41.751 1.00 55.24 C ATOM 1438 C ALA A 96 -4.407 0.165 -41.678 1.00 22.35 C ATOM 1439 O ALA A 96 -5.038 -0.250 -42.651 1.00 52.31 O ATOM 1440 CB ALA A 96 -4.517 2.664 -41.568 1.00 14.21 C ATOM 0 H ALA A 96 -3.467 1.509 -43.840 1.00 20.50 H new ATOM 0 HA ALA A 96 -2.871 1.445 -40.943 1.00 55.24 H new ATOM 0 HB1 ALA A 96 -5.052 2.574 -40.623 1.00 14.21 H new ATOM 0 HB2 ALA A 96 -3.920 3.576 -41.562 1.00 14.21 H new ATOM 0 HB3 ALA A 96 -5.234 2.705 -42.388 1.00 14.21 H new ATOM 1446 N LEU A 97 -4.362 -0.456 -40.512 1.00 62.33 N ATOM 1447 CA LEU A 97 -5.149 -1.642 -40.212 1.00 4.54 C ATOM 1448 C LEU A 97 -6.475 -1.187 -39.608 1.00 23.15 C ATOM 1449 O LEU A 97 -6.516 -0.715 -38.470 1.00 2.53 O ATOM 1450 CB LEU A 97 -4.345 -2.532 -39.234 1.00 62.35 C ATOM 1451 CG LEU A 97 -5.022 -3.829 -38.732 1.00 23.42 C ATOM 1452 CD1 LEU A 97 -3.972 -4.843 -38.285 1.00 52.33 C ATOM 1453 CD2 LEU A 97 -5.981 -3.546 -37.573 1.00 12.41 C ATOM 0 H LEU A 97 -3.772 -0.149 -39.738 1.00 62.33 H new ATOM 0 HA LEU A 97 -5.358 -2.228 -41.107 1.00 4.54 H new ATOM 0 HB2 LEU A 97 -3.409 -2.807 -39.721 1.00 62.35 H new ATOM 0 HB3 LEU A 97 -4.087 -1.928 -38.364 1.00 62.35 H new ATOM 0 HG LEU A 97 -5.594 -4.241 -39.564 1.00 23.42 H new ATOM 0 HD11 LEU A 97 -4.467 -5.749 -37.935 1.00 52.33 H new ATOM 0 HD12 LEU A 97 -3.321 -5.086 -39.124 1.00 52.33 H new ATOM 0 HD13 LEU A 97 -3.378 -4.419 -37.476 1.00 52.33 H new ATOM 0 HD21 LEU A 97 -6.440 -4.479 -37.244 1.00 12.41 H new ATOM 0 HD22 LEU A 97 -5.429 -3.101 -36.745 1.00 12.41 H new ATOM 0 HD23 LEU A 97 -6.758 -2.856 -37.904 1.00 12.41 H new ATOM 1465 N PHE A 98 -7.547 -1.286 -40.386 1.00 33.43 N ATOM 1466 CA PHE A 98 -8.842 -0.770 -39.966 1.00 22.33 C ATOM 1467 C PHE A 98 -9.837 -1.916 -39.807 1.00 65.01 C ATOM 1468 O PHE A 98 -10.035 -2.712 -40.729 1.00 52.24 O ATOM 1469 CB PHE A 98 -9.357 0.257 -40.987 1.00 14.23 C ATOM 1470 CG PHE A 98 -10.425 1.182 -40.445 1.00 54.22 C ATOM 1471 CD1 PHE A 98 -11.760 0.804 -40.443 1.00 1.45 C ATOM 1472 CD2 PHE A 98 -10.088 2.433 -39.938 1.00 54.43 C ATOM 1473 CE1 PHE A 98 -12.735 1.651 -39.950 1.00 61.40 C ATOM 1474 CE2 PHE A 98 -11.060 3.283 -39.445 1.00 53.50 C ATOM 1475 CZ PHE A 98 -12.385 2.891 -39.452 1.00 43.13 C ATOM 0 H PHE A 98 -7.544 -1.719 -41.310 1.00 33.43 H new ATOM 0 HA PHE A 98 -8.731 -0.273 -39.002 1.00 22.33 H new ATOM 0 HB2 PHE A 98 -8.517 0.856 -41.340 1.00 14.23 H new ATOM 0 HB3 PHE A 98 -9.755 -0.274 -41.852 1.00 14.23 H new ATOM 0 HD1 PHE A 98 -12.041 -0.164 -40.831 1.00 1.45 H new ATOM 0 HD2 PHE A 98 -9.054 2.744 -39.930 1.00 54.43 H new ATOM 0 HE1 PHE A 98 -13.770 1.343 -39.954 1.00 61.40 H new ATOM 0 HE2 PHE A 98 -10.784 4.252 -39.055 1.00 53.50 H new ATOM 0 HZ PHE A 98 -13.147 3.554 -39.068 1.00 43.13 H new ATOM 1485 N THR A 99 -10.436 -2.012 -38.629 1.00 0.52 N ATOM 1486 CA THR A 99 -11.424 -3.046 -38.357 1.00 41.40 C ATOM 1487 C THR A 99 -12.787 -2.651 -38.931 1.00 32.20 C ATOM 1488 O THR A 99 -13.409 -1.696 -38.461 1.00 23.33 O ATOM 1489 CB THR A 99 -11.554 -3.290 -36.838 1.00 71.14 C ATOM 1490 OG1 THR A 99 -10.250 -3.302 -36.240 1.00 32.31 O ATOM 1491 CG2 THR A 99 -12.261 -4.610 -36.546 1.00 45.34 C ATOM 0 H THR A 99 -10.255 -1.385 -37.845 1.00 0.52 H new ATOM 0 HA THR A 99 -11.088 -3.966 -38.836 1.00 41.40 H new ATOM 0 HB THR A 99 -12.152 -2.483 -36.414 1.00 71.14 H new ATOM 0 HG1 THR A 99 -10.318 -3.611 -35.313 1.00 32.31 H new ATOM 0 HG21 THR A 99 -12.336 -4.752 -35.468 1.00 45.34 H new ATOM 0 HG22 THR A 99 -13.261 -4.591 -36.980 1.00 45.34 H new ATOM 0 HG23 THR A 99 -11.692 -5.432 -36.981 1.00 45.34 H new ATOM 1499 N ILE A 100 -13.233 -3.371 -39.958 1.00 21.32 N ATOM 1500 CA ILE A 100 -14.504 -3.082 -40.614 1.00 55.40 C ATOM 1501 C ILE A 100 -15.630 -3.929 -40.000 1.00 14.24 C ATOM 1502 O ILE A 100 -15.626 -5.164 -40.119 1.00 1.33 O ATOM 1503 CB ILE A 100 -14.422 -3.353 -42.140 1.00 12.11 C ATOM 1504 CG1 ILE A 100 -13.259 -2.565 -42.774 1.00 60.11 C ATOM 1505 CG2 ILE A 100 -15.740 -2.992 -42.822 1.00 11.45 C ATOM 1506 CD1 ILE A 100 -13.443 -1.059 -42.747 1.00 2.12 C ATOM 0 H ILE A 100 -12.728 -4.164 -40.355 1.00 21.32 H new ATOM 0 HA ILE A 100 -14.723 -2.025 -40.461 1.00 55.40 H new ATOM 0 HB ILE A 100 -14.236 -4.417 -42.285 1.00 12.11 H new ATOM 0 HG12 ILE A 100 -12.336 -2.817 -42.251 1.00 60.11 H new ATOM 0 HG13 ILE A 100 -13.138 -2.887 -43.808 1.00 60.11 H new ATOM 0 HG21 ILE A 100 -15.662 -3.189 -43.891 1.00 11.45 H new ATOM 0 HG22 ILE A 100 -16.545 -3.594 -42.400 1.00 11.45 H new ATOM 0 HG23 ILE A 100 -15.955 -1.935 -42.662 1.00 11.45 H new ATOM 0 HD11 ILE A 100 -12.582 -0.579 -43.212 1.00 2.12 H new ATOM 0 HD12 ILE A 100 -14.347 -0.793 -43.295 1.00 2.12 H new ATOM 0 HD13 ILE A 100 -13.533 -0.722 -41.714 1.00 2.12 H new ATOM 1518 N PRO A 101 -16.595 -3.276 -39.313 1.00 5.44 N ATOM 1519 CA PRO A 101 -17.745 -3.964 -38.708 1.00 42.13 C ATOM 1520 C PRO A 101 -18.679 -4.547 -39.768 1.00 14.34 C ATOM 1521 O PRO A 101 -18.781 -4.017 -40.876 1.00 14.05 O ATOM 1522 CB PRO A 101 -18.446 -2.859 -37.902 1.00 51.24 C ATOM 1523 CG PRO A 101 -18.039 -1.588 -38.568 1.00 0.42 C ATOM 1524 CD PRO A 101 -16.636 -1.818 -39.070 1.00 24.24 C ATOM 0 HA PRO A 101 -17.444 -4.814 -38.095 1.00 42.13 H new ATOM 0 HB2 PRO A 101 -19.529 -2.985 -37.917 1.00 51.24 H new ATOM 0 HB3 PRO A 101 -18.137 -2.875 -36.857 1.00 51.24 H new ATOM 0 HG2 PRO A 101 -18.713 -1.344 -39.389 1.00 0.42 H new ATOM 0 HG3 PRO A 101 -18.072 -0.752 -37.869 1.00 0.42 H new ATOM 0 HD2 PRO A 101 -16.437 -1.253 -39.981 1.00 24.24 H new ATOM 0 HD3 PRO A 101 -15.891 -1.512 -38.336 1.00 24.24 H new ATOM 1532 N TYR A 102 -19.372 -5.627 -39.408 1.00 62.24 N ATOM 1533 CA TYR A 102 -20.218 -6.364 -40.351 1.00 42.32 C ATOM 1534 C TYR A 102 -21.265 -5.460 -41.009 1.00 55.45 C ATOM 1535 O TYR A 102 -21.643 -5.678 -42.158 1.00 63.25 O ATOM 1536 CB TYR A 102 -20.914 -7.536 -39.642 1.00 22.34 C ATOM 1537 CG TYR A 102 -22.052 -7.129 -38.717 1.00 74.23 C ATOM 1538 CD1 TYR A 102 -21.804 -6.534 -37.483 1.00 34.34 C ATOM 1539 CD2 TYR A 102 -23.379 -7.350 -39.080 1.00 52.43 C ATOM 1540 CE1 TYR A 102 -22.844 -6.173 -36.645 1.00 44.51 C ATOM 1541 CE2 TYR A 102 -24.418 -6.992 -38.249 1.00 11.43 C ATOM 1542 CZ TYR A 102 -24.149 -6.404 -37.032 1.00 3.53 C ATOM 1543 OH TYR A 102 -25.189 -6.049 -36.199 1.00 60.43 O ATOM 0 H TYR A 102 -19.365 -6.014 -38.464 1.00 62.24 H new ATOM 0 HA TYR A 102 -19.567 -6.748 -41.137 1.00 42.32 H new ATOM 0 HB2 TYR A 102 -21.303 -8.221 -40.396 1.00 22.34 H new ATOM 0 HB3 TYR A 102 -20.172 -8.086 -39.064 1.00 22.34 H new ATOM 0 HD1 TYR A 102 -20.785 -6.352 -37.175 1.00 34.34 H new ATOM 0 HD2 TYR A 102 -23.597 -7.811 -40.032 1.00 52.43 H new ATOM 0 HE1 TYR A 102 -22.636 -5.712 -35.691 1.00 44.51 H new ATOM 0 HE2 TYR A 102 -25.439 -7.172 -38.550 1.00 11.43 H new ATOM 0 HH TYR A 102 -26.042 -6.280 -36.624 1.00 60.43 H new ATOM 1553 N GLN A 103 -21.722 -4.450 -40.273 1.00 54.01 N ATOM 1554 CA GLN A 103 -22.757 -3.539 -40.767 1.00 73.14 C ATOM 1555 C GLN A 103 -22.245 -2.722 -41.957 1.00 73.11 C ATOM 1556 O GLN A 103 -23.020 -2.308 -42.823 1.00 64.20 O ATOM 1557 CB GLN A 103 -23.223 -2.604 -39.643 1.00 20.21 C ATOM 1558 CG GLN A 103 -22.114 -1.723 -39.070 1.00 52.32 C ATOM 1559 CD GLN A 103 -22.596 -0.788 -37.971 1.00 12.35 C ATOM 1560 OE1 GLN A 103 -22.073 0.313 -37.805 1.00 44.32 O ATOM 1561 NE2 GLN A 103 -23.587 -1.222 -37.207 1.00 41.41 N ATOM 0 H GLN A 103 -21.393 -4.240 -39.331 1.00 54.01 H new ATOM 0 HA GLN A 103 -23.604 -4.137 -41.103 1.00 73.14 H new ATOM 0 HB2 GLN A 103 -24.021 -1.966 -40.022 1.00 20.21 H new ATOM 0 HB3 GLN A 103 -23.649 -3.203 -38.839 1.00 20.21 H new ATOM 0 HG2 GLN A 103 -21.322 -2.359 -38.675 1.00 52.32 H new ATOM 0 HG3 GLN A 103 -21.677 -1.132 -39.875 1.00 52.32 H new ATOM 0 HE21 GLN A 103 -23.996 -2.141 -37.375 1.00 41.41 H new ATOM 0 HE22 GLN A 103 -23.942 -0.637 -36.450 1.00 41.41 H new ATOM 1570 N LEU A 104 -20.933 -2.509 -41.993 1.00 62.14 N ATOM 1571 CA LEU A 104 -20.291 -1.742 -43.060 1.00 32.30 C ATOM 1572 C LEU A 104 -19.480 -2.670 -43.957 1.00 63.52 C ATOM 1573 O LEU A 104 -18.559 -2.235 -44.650 1.00 31.32 O ATOM 1574 CB LEU A 104 -19.382 -0.654 -42.464 1.00 72.14 C ATOM 1575 CG LEU A 104 -20.096 0.409 -41.608 1.00 20.21 C ATOM 1576 CD1 LEU A 104 -19.095 1.426 -41.060 1.00 1.30 C ATOM 1577 CD2 LEU A 104 -21.193 1.108 -42.414 1.00 71.42 C ATOM 0 H LEU A 104 -20.286 -2.861 -41.287 1.00 62.14 H new ATOM 0 HA LEU A 104 -21.065 -1.260 -43.658 1.00 32.30 H new ATOM 0 HB2 LEU A 104 -18.620 -1.137 -41.852 1.00 72.14 H new ATOM 0 HB3 LEU A 104 -18.864 -0.150 -43.280 1.00 72.14 H new ATOM 0 HG LEU A 104 -20.565 -0.095 -40.763 1.00 20.21 H new ATOM 0 HD11 LEU A 104 -19.622 2.167 -40.459 1.00 1.30 H new ATOM 0 HD12 LEU A 104 -18.358 0.914 -40.441 1.00 1.30 H new ATOM 0 HD13 LEU A 104 -18.591 1.923 -41.889 1.00 1.30 H new ATOM 0 HD21 LEU A 104 -21.684 1.854 -41.789 1.00 71.42 H new ATOM 0 HD22 LEU A 104 -20.751 1.596 -43.283 1.00 71.42 H new ATOM 0 HD23 LEU A 104 -21.926 0.372 -42.744 1.00 71.42 H new ATOM 1589 N ALA A 105 -19.845 -3.951 -43.950 1.00 62.01 N ATOM 1590 CA ALA A 105 -19.129 -4.960 -44.716 1.00 15.02 C ATOM 1591 C ALA A 105 -20.061 -6.080 -45.170 1.00 14.10 C ATOM 1592 O ALA A 105 -21.247 -6.101 -44.834 1.00 75.53 O ATOM 1593 CB ALA A 105 -17.984 -5.535 -43.887 1.00 53.05 C ATOM 0 H ALA A 105 -20.637 -4.312 -43.418 1.00 62.01 H new ATOM 0 HA ALA A 105 -18.723 -4.479 -45.606 1.00 15.02 H new ATOM 0 HB1 ALA A 105 -17.455 -6.289 -44.470 1.00 53.05 H new ATOM 0 HB2 ALA A 105 -17.294 -4.736 -43.616 1.00 53.05 H new ATOM 0 HB3 ALA A 105 -18.384 -5.991 -42.981 1.00 53.05 H new ATOM 1599 N TYR A 106 -19.505 -7.011 -45.937 1.00 54.43 N ATOM 1600 CA TYR A 106 -20.241 -8.188 -46.391 1.00 22.33 C ATOM 1601 C TYR A 106 -20.369 -9.205 -45.254 1.00 52.22 C ATOM 1602 O TYR A 106 -21.148 -10.155 -45.344 1.00 2.43 O ATOM 1603 CB TYR A 106 -19.528 -8.825 -47.597 1.00 62.33 C ATOM 1604 CG TYR A 106 -18.110 -9.292 -47.305 1.00 72.41 C ATOM 1605 CD1 TYR A 106 -17.033 -8.413 -47.386 1.00 61.54 C ATOM 1606 CD2 TYR A 106 -17.850 -10.611 -46.945 1.00 15.41 C ATOM 1607 CE1 TYR A 106 -15.744 -8.834 -47.117 1.00 50.11 C ATOM 1608 CE2 TYR A 106 -16.563 -11.039 -46.673 1.00 43.13 C ATOM 1609 CZ TYR A 106 -15.515 -10.145 -46.761 1.00 60.03 C ATOM 1610 OH TYR A 106 -14.233 -10.566 -46.487 1.00 3.12 O ATOM 0 H TYR A 106 -18.538 -6.973 -46.260 1.00 54.43 H new ATOM 0 HA TYR A 106 -21.241 -7.880 -46.696 1.00 22.33 H new ATOM 0 HB2 TYR A 106 -20.115 -9.675 -47.945 1.00 62.33 H new ATOM 0 HB3 TYR A 106 -19.500 -8.102 -48.412 1.00 62.33 H new ATOM 0 HD1 TYR A 106 -17.208 -7.384 -47.664 1.00 61.54 H new ATOM 0 HD2 TYR A 106 -18.668 -11.313 -46.877 1.00 15.41 H new ATOM 0 HE1 TYR A 106 -14.921 -8.139 -47.186 1.00 50.11 H new ATOM 0 HE2 TYR A 106 -16.379 -12.066 -46.394 1.00 43.13 H new ATOM 0 HH TYR A 106 -14.244 -11.517 -46.251 1.00 3.12 H new ATOM 1620 N GLY A 107 -19.611 -8.974 -44.178 1.00 75.14 N ATOM 1621 CA GLY A 107 -19.564 -9.899 -43.053 1.00 10.44 C ATOM 1622 C GLY A 107 -20.919 -10.138 -42.413 1.00 30.53 C ATOM 1623 O GLY A 107 -21.094 -11.099 -41.665 1.00 60.22 O ATOM 0 H GLY A 107 -19.021 -8.149 -44.067 1.00 75.14 H new ATOM 0 HA2 GLY A 107 -19.157 -10.852 -43.392 1.00 10.44 H new ATOM 0 HA3 GLY A 107 -18.878 -9.510 -42.300 1.00 10.44 H new ATOM 1627 N GLU A 108 -21.876 -9.258 -42.701 1.00 42.23 N ATOM 1628 CA GLU A 108 -23.247 -9.430 -42.229 1.00 2.53 C ATOM 1629 C GLU A 108 -23.791 -10.774 -42.724 1.00 1.12 C ATOM 1630 O GLU A 108 -24.309 -11.578 -41.946 1.00 70.21 O ATOM 1631 CB GLU A 108 -24.117 -8.254 -42.723 1.00 42.32 C ATOM 1632 CG GLU A 108 -25.482 -8.118 -42.036 1.00 4.21 C ATOM 1633 CD GLU A 108 -26.514 -9.133 -42.511 1.00 31.05 C ATOM 1634 OE1 GLU A 108 -26.841 -9.123 -43.714 1.00 42.51 O ATOM 1635 OE2 GLU A 108 -27.018 -9.923 -41.682 1.00 64.21 O ATOM 0 H GLU A 108 -21.726 -8.418 -43.260 1.00 42.23 H new ATOM 0 HA GLU A 108 -23.270 -9.433 -41.139 1.00 2.53 H new ATOM 0 HB2 GLU A 108 -23.562 -7.327 -42.580 1.00 42.32 H new ATOM 0 HB3 GLU A 108 -24.277 -8.367 -43.795 1.00 42.32 H new ATOM 0 HG2 GLU A 108 -25.349 -8.226 -40.960 1.00 4.21 H new ATOM 0 HG3 GLU A 108 -25.867 -7.113 -42.210 1.00 4.21 H new ATOM 1642 N ARG A 109 -23.624 -11.018 -44.022 1.00 41.24 N ATOM 1643 CA ARG A 109 -24.059 -12.265 -44.651 1.00 2.14 C ATOM 1644 C ARG A 109 -22.928 -13.288 -44.650 1.00 64.15 C ATOM 1645 O ARG A 109 -23.166 -14.498 -44.674 1.00 50.12 O ATOM 1646 CB ARG A 109 -24.503 -11.995 -46.096 1.00 42.44 C ATOM 1647 CG ARG A 109 -25.688 -11.042 -46.208 1.00 24.32 C ATOM 1648 CD ARG A 109 -26.977 -11.673 -45.692 1.00 60.10 C ATOM 1649 NE ARG A 109 -27.416 -12.786 -46.534 1.00 12.51 N ATOM 1650 CZ ARG A 109 -28.429 -12.715 -47.399 1.00 71.52 C ATOM 1651 NH1 ARG A 109 -29.140 -11.599 -47.507 1.00 63.01 N ATOM 1652 NH2 ARG A 109 -28.734 -13.762 -48.149 1.00 72.20 N ATOM 0 H ARG A 109 -23.185 -10.360 -44.666 1.00 41.24 H new ATOM 0 HA ARG A 109 -24.897 -12.665 -44.080 1.00 2.14 H new ATOM 0 HB2 ARG A 109 -23.662 -11.582 -46.653 1.00 42.44 H new ATOM 0 HB3 ARG A 109 -24.764 -12.942 -46.569 1.00 42.44 H new ATOM 0 HG2 ARG A 109 -25.478 -10.133 -45.644 1.00 24.32 H new ATOM 0 HG3 ARG A 109 -25.820 -10.747 -47.249 1.00 24.32 H new ATOM 0 HD2 ARG A 109 -26.825 -12.027 -44.673 1.00 60.10 H new ATOM 0 HD3 ARG A 109 -27.761 -10.917 -45.653 1.00 60.10 H new ATOM 0 HE ARG A 109 -26.916 -13.672 -46.455 1.00 12.51 H new ATOM 0 HH11 ARG A 109 -28.913 -10.791 -46.927 1.00 63.01 H new ATOM 0 HH12 ARG A 109 -29.914 -11.549 -48.170 1.00 63.01 H new ATOM 0 HH21 ARG A 109 -28.194 -14.624 -48.066 1.00 72.20 H new ATOM 0 HH22 ARG A 109 -29.509 -13.707 -48.810 1.00 72.20 H new ATOM 1666 N GLY A 110 -21.698 -12.788 -44.626 1.00 51.44 N ATOM 1667 CA GLY A 110 -20.531 -13.647 -44.701 1.00 74.31 C ATOM 1668 C GLY A 110 -20.213 -14.033 -46.134 1.00 44.44 C ATOM 1669 O GLY A 110 -19.200 -13.599 -46.677 1.00 52.23 O ATOM 0 H GLY A 110 -21.487 -11.793 -44.555 1.00 51.44 H new ATOM 0 HA2 GLY A 110 -19.674 -13.136 -44.262 1.00 74.31 H new ATOM 0 HA3 GLY A 110 -20.702 -14.547 -44.111 1.00 74.31 H new ATOM 1673 N TYR A 111 -21.126 -14.810 -46.734 1.00 14.34 N ATOM 1674 CA TYR A 111 -21.008 -15.371 -48.095 1.00 51.25 C ATOM 1675 C TYR A 111 -20.425 -16.802 -48.071 1.00 15.01 C ATOM 1676 O TYR A 111 -21.184 -17.752 -48.272 1.00 51.22 O ATOM 1677 CB TYR A 111 -20.270 -14.453 -49.098 1.00 51.01 C ATOM 1678 CG TYR A 111 -21.106 -13.294 -49.611 1.00 1.55 C ATOM 1679 CD1 TYR A 111 -22.079 -13.499 -50.582 1.00 14.33 C ATOM 1680 CD2 TYR A 111 -20.918 -11.999 -49.135 1.00 62.24 C ATOM 1681 CE1 TYR A 111 -22.841 -12.452 -51.064 1.00 51.32 C ATOM 1682 CE2 TYR A 111 -21.680 -10.948 -49.612 1.00 42.35 C ATOM 1683 CZ TYR A 111 -22.639 -11.180 -50.576 1.00 75.40 C ATOM 1684 OH TYR A 111 -23.396 -10.134 -51.060 1.00 34.13 O ATOM 0 H TYR A 111 -21.996 -15.076 -46.274 1.00 14.34 H new ATOM 0 HA TYR A 111 -22.028 -15.433 -48.475 1.00 51.25 H new ATOM 0 HB2 TYR A 111 -19.374 -14.057 -48.620 1.00 51.01 H new ATOM 0 HB3 TYR A 111 -19.940 -15.052 -49.947 1.00 51.01 H new ATOM 0 HD1 TYR A 111 -22.242 -14.495 -50.967 1.00 14.33 H new ATOM 0 HD2 TYR A 111 -20.166 -11.813 -48.382 1.00 62.24 H new ATOM 0 HE1 TYR A 111 -23.592 -12.630 -51.820 1.00 51.32 H new ATOM 0 HE2 TYR A 111 -21.525 -9.949 -49.231 1.00 42.35 H new ATOM 0 HH TYR A 111 -23.131 -9.304 -50.612 1.00 34.13 H new ATOM 1694 N PRO A 112 -19.104 -17.024 -47.831 1.00 71.14 N ATOM 1695 CA PRO A 112 -18.584 -18.383 -47.693 1.00 74.05 C ATOM 1696 C PRO A 112 -18.837 -18.922 -46.284 1.00 44.53 C ATOM 1697 O PRO A 112 -18.679 -18.193 -45.307 1.00 35.22 O ATOM 1698 CB PRO A 112 -17.086 -18.217 -47.961 1.00 3.14 C ATOM 1699 CG PRO A 112 -16.771 -16.841 -47.479 1.00 55.31 C ATOM 1700 CD PRO A 112 -18.024 -16.020 -47.673 1.00 34.32 C ATOM 0 HA PRO A 112 -19.058 -19.094 -48.369 1.00 74.05 H new ATOM 0 HB2 PRO A 112 -16.502 -18.968 -47.428 1.00 3.14 H new ATOM 0 HB3 PRO A 112 -16.858 -18.328 -49.021 1.00 3.14 H new ATOM 0 HG2 PRO A 112 -16.476 -16.856 -46.430 1.00 55.31 H new ATOM 0 HG3 PRO A 112 -15.938 -16.415 -48.039 1.00 55.31 H new ATOM 0 HD2 PRO A 112 -18.209 -15.369 -46.818 1.00 34.32 H new ATOM 0 HD3 PRO A 112 -17.947 -15.379 -48.551 1.00 34.32 H new ATOM 1708 N PRO A 113 -19.227 -20.205 -46.154 1.00 75.52 N ATOM 1709 CA PRO A 113 -19.545 -20.814 -44.851 1.00 14.13 C ATOM 1710 C PRO A 113 -18.355 -20.788 -43.887 1.00 51.33 C ATOM 1711 O PRO A 113 -18.500 -21.079 -42.697 1.00 50.55 O ATOM 1712 CB PRO A 113 -19.936 -22.259 -45.208 1.00 71.32 C ATOM 1713 CG PRO A 113 -19.352 -22.491 -46.560 1.00 43.15 C ATOM 1714 CD PRO A 113 -19.408 -21.162 -47.259 1.00 14.23 C ATOM 0 HA PRO A 113 -20.334 -20.271 -44.331 1.00 14.13 H new ATOM 0 HB2 PRO A 113 -19.540 -22.967 -44.480 1.00 71.32 H new ATOM 0 HB3 PRO A 113 -21.019 -22.384 -45.218 1.00 71.32 H new ATOM 0 HG2 PRO A 113 -18.326 -22.852 -46.487 1.00 43.15 H new ATOM 0 HG3 PRO A 113 -19.918 -23.245 -47.107 1.00 43.15 H new ATOM 0 HD2 PRO A 113 -18.624 -21.066 -48.010 1.00 14.23 H new ATOM 0 HD3 PRO A 113 -20.359 -21.014 -47.771 1.00 14.23 H new ATOM 1722 N VAL A 114 -17.178 -20.456 -44.411 1.00 63.42 N ATOM 1723 CA VAL A 114 -15.982 -20.295 -43.591 1.00 23.21 C ATOM 1724 C VAL A 114 -16.109 -19.044 -42.719 1.00 74.31 C ATOM 1725 O VAL A 114 -15.594 -18.992 -41.599 1.00 2.15 O ATOM 1726 CB VAL A 114 -14.709 -20.188 -44.472 1.00 34.22 C ATOM 1727 CG1 VAL A 114 -13.450 -20.073 -43.614 1.00 33.32 C ATOM 1728 CG2 VAL A 114 -14.612 -21.378 -45.427 1.00 53.14 C ATOM 0 H VAL A 114 -17.027 -20.292 -45.406 1.00 63.42 H new ATOM 0 HA VAL A 114 -15.888 -21.176 -42.956 1.00 23.21 H new ATOM 0 HB VAL A 114 -14.788 -19.278 -45.067 1.00 34.22 H new ATOM 0 HG11 VAL A 114 -12.575 -20.000 -44.260 1.00 33.32 H new ATOM 0 HG12 VAL A 114 -13.516 -19.182 -42.989 1.00 33.32 H new ATOM 0 HG13 VAL A 114 -13.360 -20.955 -42.980 1.00 33.32 H new ATOM 0 HG21 VAL A 114 -13.713 -21.284 -46.036 1.00 53.14 H new ATOM 0 HG22 VAL A 114 -14.566 -22.303 -44.852 1.00 53.14 H new ATOM 0 HG23 VAL A 114 -15.488 -21.397 -46.075 1.00 53.14 H new ATOM 1738 N ILE A 115 -16.809 -18.045 -43.244 1.00 51.04 N ATOM 1739 CA ILE A 115 -17.044 -16.795 -42.533 1.00 15.41 C ATOM 1740 C ILE A 115 -18.452 -16.798 -41.936 1.00 5.40 C ATOM 1741 O ILE A 115 -19.435 -16.938 -42.666 1.00 35.31 O ATOM 1742 CB ILE A 115 -16.888 -15.575 -43.480 1.00 64.33 C ATOM 1743 CG1 ILE A 115 -15.477 -15.550 -44.103 1.00 53.33 C ATOM 1744 CG2 ILE A 115 -17.186 -14.264 -42.745 1.00 50.30 C ATOM 1745 CD1 ILE A 115 -14.353 -15.421 -43.092 1.00 54.20 C ATOM 0 H ILE A 115 -17.229 -18.079 -44.173 1.00 51.04 H new ATOM 0 HA ILE A 115 -16.303 -16.712 -41.738 1.00 15.41 H new ATOM 0 HB ILE A 115 -17.616 -15.676 -44.285 1.00 64.33 H new ATOM 0 HG12 ILE A 115 -15.330 -16.464 -44.678 1.00 53.33 H new ATOM 0 HG13 ILE A 115 -15.417 -14.718 -44.805 1.00 53.33 H new ATOM 0 HG21 ILE A 115 -17.069 -13.427 -43.433 1.00 50.30 H new ATOM 0 HG22 ILE A 115 -18.208 -14.283 -42.367 1.00 50.30 H new ATOM 0 HG23 ILE A 115 -16.493 -14.149 -41.911 1.00 50.30 H new ATOM 0 HD11 ILE A 115 -13.395 -15.411 -43.612 1.00 54.20 H new ATOM 0 HD12 ILE A 115 -14.472 -14.493 -42.532 1.00 54.20 H new ATOM 0 HD13 ILE A 115 -14.384 -16.266 -42.404 1.00 54.20 H new ATOM 1757 N PRO A 116 -18.570 -16.665 -40.603 1.00 1.54 N ATOM 1758 CA PRO A 116 -19.873 -16.653 -39.927 1.00 4.42 C ATOM 1759 C PRO A 116 -20.658 -15.367 -40.207 1.00 1.54 C ATOM 1760 O PRO A 116 -20.066 -14.313 -40.449 1.00 44.24 O ATOM 1761 CB PRO A 116 -19.503 -16.757 -38.440 1.00 0.11 C ATOM 1762 CG PRO A 116 -18.135 -16.170 -38.351 1.00 2.34 C ATOM 1763 CD PRO A 116 -17.450 -16.514 -39.651 1.00 73.41 C ATOM 0 HA PRO A 116 -20.523 -17.458 -40.270 1.00 4.42 H new ATOM 0 HB2 PRO A 116 -20.210 -16.210 -37.816 1.00 0.11 H new ATOM 0 HB3 PRO A 116 -19.513 -17.793 -38.100 1.00 0.11 H new ATOM 0 HG2 PRO A 116 -18.182 -15.090 -38.208 1.00 2.34 H new ATOM 0 HG3 PRO A 116 -17.589 -16.580 -37.502 1.00 2.34 H new ATOM 0 HD2 PRO A 116 -16.762 -15.728 -39.962 1.00 73.41 H new ATOM 0 HD3 PRO A 116 -16.868 -17.432 -39.567 1.00 73.41 H new ATOM 1771 N PRO A 117 -22.004 -15.436 -40.186 1.00 32.11 N ATOM 1772 CA PRO A 117 -22.853 -14.260 -40.410 1.00 23.42 C ATOM 1773 C PRO A 117 -22.710 -13.234 -39.282 1.00 61.41 C ATOM 1774 O PRO A 117 -22.618 -13.605 -38.105 1.00 22.34 O ATOM 1775 CB PRO A 117 -24.276 -14.842 -40.443 1.00 44.33 C ATOM 1776 CG PRO A 117 -24.180 -16.121 -39.679 1.00 52.33 C ATOM 1777 CD PRO A 117 -22.801 -16.658 -39.953 1.00 32.41 C ATOM 0 HA PRO A 117 -22.587 -13.725 -41.321 1.00 23.42 H new ATOM 0 HB2 PRO A 117 -24.993 -14.160 -39.986 1.00 44.33 H new ATOM 0 HB3 PRO A 117 -24.609 -15.016 -41.466 1.00 44.33 H new ATOM 0 HG2 PRO A 117 -24.329 -15.952 -38.613 1.00 52.33 H new ATOM 0 HG3 PRO A 117 -24.946 -16.827 -40.000 1.00 52.33 H new ATOM 0 HD2 PRO A 117 -22.418 -17.234 -39.110 1.00 32.41 H new ATOM 0 HD3 PRO A 117 -22.791 -17.317 -40.821 1.00 32.41 H new ATOM 1785 N LYS A 118 -22.708 -11.951 -39.654 1.00 12.23 N ATOM 1786 CA LYS A 118 -22.537 -10.843 -38.704 1.00 22.13 C ATOM 1787 C LYS A 118 -21.095 -10.778 -38.184 1.00 41.51 C ATOM 1788 O LYS A 118 -20.838 -10.257 -37.096 1.00 20.11 O ATOM 1789 CB LYS A 118 -23.528 -10.970 -37.537 1.00 64.12 C ATOM 1790 CG LYS A 118 -24.992 -10.912 -37.964 1.00 0.22 C ATOM 1791 CD LYS A 118 -25.942 -11.319 -36.836 1.00 12.22 C ATOM 1792 CE LYS A 118 -25.937 -12.829 -36.580 1.00 54.44 C ATOM 1793 NZ LYS A 118 -24.653 -13.324 -36.008 1.00 73.32 N ATOM 0 H LYS A 118 -22.825 -11.649 -40.621 1.00 12.23 H new ATOM 0 HA LYS A 118 -22.746 -9.913 -39.233 1.00 22.13 H new ATOM 0 HB2 LYS A 118 -23.347 -11.912 -37.020 1.00 64.12 H new ATOM 0 HB3 LYS A 118 -23.336 -10.171 -36.821 1.00 64.12 H new ATOM 0 HG2 LYS A 118 -25.233 -9.901 -38.292 1.00 0.22 H new ATOM 0 HG3 LYS A 118 -25.145 -11.569 -38.820 1.00 0.22 H new ATOM 0 HD2 LYS A 118 -25.659 -10.798 -35.921 1.00 12.22 H new ATOM 0 HD3 LYS A 118 -26.954 -10.999 -37.085 1.00 12.22 H new ATOM 0 HE2 LYS A 118 -26.751 -13.078 -35.899 1.00 54.44 H new ATOM 0 HE3 LYS A 118 -26.135 -13.350 -37.517 1.00 54.44 H new ATOM 0 HZ1 LYS A 118 -24.837 -14.153 -35.408 1.00 73.32 H new ATOM 0 HZ2 LYS A 118 -24.009 -13.592 -36.780 1.00 73.32 H new ATOM 0 HZ3 LYS A 118 -24.215 -12.573 -35.437 1.00 73.32 H new ATOM 1807 N ALA A 119 -20.157 -11.274 -38.986 1.00 25.12 N ATOM 1808 CA ALA A 119 -18.743 -11.288 -38.609 1.00 55.24 C ATOM 1809 C ALA A 119 -18.065 -9.961 -38.943 1.00 12.24 C ATOM 1810 O ALA A 119 -18.356 -9.339 -39.966 1.00 74.12 O ATOM 1811 CB ALA A 119 -18.021 -12.435 -39.301 1.00 71.50 C ATOM 0 H ALA A 119 -20.350 -11.673 -39.905 1.00 25.12 H new ATOM 0 HA ALA A 119 -18.688 -11.433 -37.530 1.00 55.24 H new ATOM 0 HB1 ALA A 119 -16.970 -12.432 -39.010 1.00 71.50 H new ATOM 0 HB2 ALA A 119 -18.476 -13.381 -39.007 1.00 71.50 H new ATOM 0 HB3 ALA A 119 -18.099 -12.315 -40.382 1.00 71.50 H new ATOM 1817 N THR A 120 -17.163 -9.539 -38.066 1.00 51.12 N ATOM 1818 CA THR A 120 -16.371 -8.333 -38.274 1.00 71.23 C ATOM 1819 C THR A 120 -15.023 -8.710 -38.897 1.00 20.24 C ATOM 1820 O THR A 120 -14.398 -9.689 -38.478 1.00 3.02 O ATOM 1821 CB THR A 120 -16.148 -7.596 -36.933 1.00 65.31 C ATOM 1822 OG1 THR A 120 -17.420 -7.283 -36.346 1.00 65.31 O ATOM 1823 CG2 THR A 120 -15.341 -6.313 -37.117 1.00 44.33 C ATOM 0 H THR A 120 -16.960 -10.022 -37.191 1.00 51.12 H new ATOM 0 HA THR A 120 -16.908 -7.666 -38.948 1.00 71.23 H new ATOM 0 HB THR A 120 -15.579 -8.255 -36.277 1.00 65.31 H new ATOM 0 HG1 THR A 120 -17.282 -6.817 -35.495 1.00 65.31 H new ATOM 0 HG21 THR A 120 -15.207 -5.826 -36.151 1.00 44.33 H new ATOM 0 HG22 THR A 120 -14.366 -6.554 -37.540 1.00 44.33 H new ATOM 0 HG23 THR A 120 -15.873 -5.642 -37.791 1.00 44.33 H new ATOM 1831 N LEU A 121 -14.570 -7.939 -39.886 1.00 2.41 N ATOM 1832 CA LEU A 121 -13.370 -8.299 -40.647 1.00 73.03 C ATOM 1833 C LEU A 121 -12.403 -7.117 -40.677 1.00 70.13 C ATOM 1834 O LEU A 121 -12.823 -5.971 -40.817 1.00 70.31 O ATOM 1835 CB LEU A 121 -13.770 -8.731 -42.077 1.00 5.25 C ATOM 1836 CG LEU A 121 -12.826 -9.726 -42.794 1.00 44.23 C ATOM 1837 CD1 LEU A 121 -11.493 -9.083 -43.161 1.00 63.11 C ATOM 1838 CD2 LEU A 121 -12.606 -10.969 -41.936 1.00 11.54 C ATOM 0 H LEU A 121 -15.011 -7.067 -40.179 1.00 2.41 H new ATOM 0 HA LEU A 121 -12.867 -9.137 -40.165 1.00 73.03 H new ATOM 0 HB2 LEU A 121 -14.763 -9.177 -42.032 1.00 5.25 H new ATOM 0 HB3 LEU A 121 -13.851 -7.835 -42.693 1.00 5.25 H new ATOM 0 HG LEU A 121 -13.310 -10.023 -43.724 1.00 44.23 H new ATOM 0 HD11 LEU A 121 -10.861 -9.816 -43.662 1.00 63.11 H new ATOM 0 HD12 LEU A 121 -11.668 -8.239 -43.828 1.00 63.11 H new ATOM 0 HD13 LEU A 121 -10.996 -8.734 -42.256 1.00 63.11 H new ATOM 0 HD21 LEU A 121 -11.940 -11.657 -42.456 1.00 11.54 H new ATOM 0 HD22 LEU A 121 -12.159 -10.680 -40.985 1.00 11.54 H new ATOM 0 HD23 LEU A 121 -13.562 -11.459 -41.753 1.00 11.54 H new ATOM 1850 N VAL A 122 -11.109 -7.394 -40.544 1.00 31.41 N ATOM 1851 CA VAL A 122 -10.107 -6.340 -40.499 1.00 43.23 C ATOM 1852 C VAL A 122 -9.460 -6.167 -41.866 1.00 70.11 C ATOM 1853 O VAL A 122 -8.914 -7.114 -42.426 1.00 44.44 O ATOM 1854 CB VAL A 122 -9.012 -6.655 -39.455 1.00 61.11 C ATOM 1855 CG1 VAL A 122 -7.950 -5.564 -39.442 1.00 50.24 C ATOM 1856 CG2 VAL A 122 -9.622 -6.844 -38.069 1.00 74.23 C ATOM 0 H VAL A 122 -10.733 -8.339 -40.466 1.00 31.41 H new ATOM 0 HA VAL A 122 -10.611 -5.417 -40.212 1.00 43.23 H new ATOM 0 HB VAL A 122 -8.530 -7.590 -39.738 1.00 61.11 H new ATOM 0 HG11 VAL A 122 -7.189 -5.806 -38.700 1.00 50.24 H new ATOM 0 HG12 VAL A 122 -7.488 -5.495 -40.427 1.00 50.24 H new ATOM 0 HG13 VAL A 122 -8.412 -4.609 -39.190 1.00 50.24 H new ATOM 0 HG21 VAL A 122 -8.832 -7.065 -37.351 1.00 74.23 H new ATOM 0 HG22 VAL A 122 -10.138 -5.931 -37.771 1.00 74.23 H new ATOM 0 HG23 VAL A 122 -10.332 -7.671 -38.093 1.00 74.23 H new ATOM 1866 N PHE A 123 -9.532 -4.966 -42.408 1.00 33.02 N ATOM 1867 CA PHE A 123 -8.921 -4.674 -43.693 1.00 14.15 C ATOM 1868 C PHE A 123 -7.776 -3.690 -43.518 1.00 24.01 C ATOM 1869 O PHE A 123 -7.966 -2.582 -43.006 1.00 14.25 O ATOM 1870 CB PHE A 123 -9.958 -4.111 -44.678 1.00 30.11 C ATOM 1871 CG PHE A 123 -10.928 -5.149 -45.194 1.00 10.14 C ATOM 1872 CD1 PHE A 123 -12.099 -5.434 -44.504 1.00 51.11 C ATOM 1873 CD2 PHE A 123 -10.664 -5.838 -46.370 1.00 52.10 C ATOM 1874 CE1 PHE A 123 -12.986 -6.384 -44.980 1.00 23.22 C ATOM 1875 CE2 PHE A 123 -11.547 -6.788 -46.848 1.00 34.12 C ATOM 1876 CZ PHE A 123 -12.709 -7.060 -46.153 1.00 24.21 C ATOM 0 H PHE A 123 -10.009 -4.174 -41.978 1.00 33.02 H new ATOM 0 HA PHE A 123 -8.529 -5.605 -44.104 1.00 14.15 H new ATOM 0 HB2 PHE A 123 -10.518 -3.315 -44.187 1.00 30.11 H new ATOM 0 HB3 PHE A 123 -9.437 -3.661 -45.523 1.00 30.11 H new ATOM 0 HD1 PHE A 123 -12.320 -4.909 -43.586 1.00 51.11 H new ATOM 0 HD2 PHE A 123 -9.757 -5.629 -46.918 1.00 52.10 H new ATOM 0 HE1 PHE A 123 -13.894 -6.597 -44.435 1.00 23.22 H new ATOM 0 HE2 PHE A 123 -11.328 -7.317 -47.764 1.00 34.12 H new ATOM 0 HZ PHE A 123 -13.401 -7.801 -46.526 1.00 24.21 H new ATOM 1886 N GLU A 124 -6.581 -4.109 -43.905 1.00 64.31 N ATOM 1887 CA GLU A 124 -5.461 -3.194 -43.994 1.00 51.31 C ATOM 1888 C GLU A 124 -5.550 -2.444 -45.313 1.00 24.30 C ATOM 1889 O GLU A 124 -5.413 -3.036 -46.388 1.00 64.22 O ATOM 1890 CB GLU A 124 -4.110 -3.911 -43.890 1.00 15.04 C ATOM 1891 CG GLU A 124 -3.853 -4.587 -42.547 1.00 23.21 C ATOM 1892 CD GLU A 124 -2.365 -4.717 -42.238 1.00 12.02 C ATOM 1893 OE1 GLU A 124 -1.608 -5.199 -43.113 1.00 21.31 O ATOM 1894 OE2 GLU A 124 -1.945 -4.297 -41.141 1.00 32.21 O ATOM 0 H GLU A 124 -6.365 -5.073 -44.161 1.00 64.31 H new ATOM 0 HA GLU A 124 -5.518 -2.504 -43.152 1.00 51.31 H new ATOM 0 HB2 GLU A 124 -4.050 -4.662 -44.678 1.00 15.04 H new ATOM 0 HB3 GLU A 124 -3.315 -3.189 -44.077 1.00 15.04 H new ATOM 0 HG2 GLU A 124 -4.337 -4.014 -41.756 1.00 23.21 H new ATOM 0 HG3 GLU A 124 -4.309 -5.577 -42.548 1.00 23.21 H new ATOM 1901 N VAL A 125 -5.835 -1.155 -45.223 1.00 22.33 N ATOM 1902 CA VAL A 125 -5.902 -0.288 -46.387 1.00 0.42 C ATOM 1903 C VAL A 125 -4.604 0.500 -46.509 1.00 41.00 C ATOM 1904 O VAL A 125 -4.038 0.934 -45.504 1.00 20.15 O ATOM 1905 CB VAL A 125 -7.122 0.673 -46.314 1.00 20.05 C ATOM 1906 CG1 VAL A 125 -8.412 -0.074 -46.645 1.00 34.15 C ATOM 1907 CG2 VAL A 125 -7.230 1.309 -44.928 1.00 11.44 C ATOM 0 H VAL A 125 -6.026 -0.681 -44.341 1.00 22.33 H new ATOM 0 HA VAL A 125 -6.033 -0.909 -47.273 1.00 0.42 H new ATOM 0 HB VAL A 125 -6.972 1.464 -47.049 1.00 20.05 H new ATOM 0 HG11 VAL A 125 -9.256 0.614 -46.589 1.00 34.15 H new ATOM 0 HG12 VAL A 125 -8.346 -0.486 -47.652 1.00 34.15 H new ATOM 0 HG13 VAL A 125 -8.557 -0.884 -45.930 1.00 34.15 H new ATOM 0 HG21 VAL A 125 -8.091 1.977 -44.900 1.00 11.44 H new ATOM 0 HG22 VAL A 125 -7.353 0.528 -44.178 1.00 11.44 H new ATOM 0 HG23 VAL A 125 -6.323 1.876 -44.716 1.00 11.44 H new ATOM 1917 N GLU A 126 -4.117 0.651 -47.731 1.00 43.13 N ATOM 1918 CA GLU A 126 -2.842 1.316 -47.980 1.00 63.02 C ATOM 1919 C GLU A 126 -2.992 2.349 -49.092 1.00 75.21 C ATOM 1920 O GLU A 126 -3.350 2.002 -50.217 1.00 73.13 O ATOM 1921 CB GLU A 126 -1.786 0.273 -48.366 1.00 51.44 C ATOM 1922 CG GLU A 126 -0.397 0.852 -48.619 1.00 43.20 C ATOM 1923 CD GLU A 126 0.601 -0.201 -49.072 1.00 3.30 C ATOM 1924 OE1 GLU A 126 1.139 -0.927 -48.216 1.00 33.31 O ATOM 1925 OE2 GLU A 126 0.857 -0.301 -50.290 1.00 32.43 O ATOM 0 H GLU A 126 -4.588 0.320 -48.573 1.00 43.13 H new ATOM 0 HA GLU A 126 -2.525 1.830 -47.072 1.00 63.02 H new ATOM 0 HB2 GLU A 126 -1.718 -0.470 -47.571 1.00 51.44 H new ATOM 0 HB3 GLU A 126 -2.118 -0.249 -49.263 1.00 51.44 H new ATOM 0 HG2 GLU A 126 -0.465 1.633 -49.377 1.00 43.20 H new ATOM 0 HG3 GLU A 126 -0.032 1.324 -47.707 1.00 43.20 H new ATOM 1932 N LEU A 127 -2.733 3.611 -48.771 1.00 44.31 N ATOM 1933 CA LEU A 127 -2.832 4.697 -49.742 1.00 71.21 C ATOM 1934 C LEU A 127 -1.499 4.851 -50.482 1.00 21.13 C ATOM 1935 O LEU A 127 -0.480 5.201 -49.881 1.00 72.31 O ATOM 1936 CB LEU A 127 -3.220 6.008 -49.023 1.00 2.35 C ATOM 1937 CG LEU A 127 -3.860 7.116 -49.889 1.00 62.44 C ATOM 1938 CD1 LEU A 127 -2.911 7.600 -50.976 1.00 31.13 C ATOM 1939 CD2 LEU A 127 -5.176 6.635 -50.498 1.00 41.12 C ATOM 0 H LEU A 127 -2.450 3.910 -47.838 1.00 44.31 H new ATOM 0 HA LEU A 127 -3.607 4.465 -50.473 1.00 71.21 H new ATOM 0 HB2 LEU A 127 -3.914 5.762 -48.219 1.00 2.35 H new ATOM 0 HB3 LEU A 127 -2.324 6.417 -48.556 1.00 2.35 H new ATOM 0 HG LEU A 127 -4.069 7.962 -49.234 1.00 62.44 H new ATOM 0 HD11 LEU A 127 -3.397 8.379 -51.563 1.00 31.13 H new ATOM 0 HD12 LEU A 127 -2.008 8.002 -50.518 1.00 31.13 H new ATOM 0 HD13 LEU A 127 -2.647 6.766 -51.627 1.00 31.13 H new ATOM 0 HD21 LEU A 127 -5.609 7.431 -51.104 1.00 41.12 H new ATOM 0 HD22 LEU A 127 -4.990 5.763 -51.125 1.00 41.12 H new ATOM 0 HD23 LEU A 127 -5.870 6.367 -49.701 1.00 41.12 H new ATOM 1951 N LEU A 128 -1.508 4.565 -51.780 1.00 14.43 N ATOM 1952 CA LEU A 128 -0.322 4.729 -52.626 1.00 30.41 C ATOM 1953 C LEU A 128 -0.302 6.118 -53.265 1.00 2.23 C ATOM 1954 O LEU A 128 0.741 6.769 -53.318 1.00 15.42 O ATOM 1955 CB LEU A 128 -0.269 3.650 -53.729 1.00 73.21 C ATOM 1956 CG LEU A 128 0.095 2.225 -53.273 1.00 25.15 C ATOM 1957 CD1 LEU A 128 1.472 2.202 -52.612 1.00 61.42 C ATOM 1958 CD2 LEU A 128 -0.972 1.656 -52.339 1.00 51.52 C ATOM 0 H LEU A 128 -2.328 4.216 -52.276 1.00 14.43 H new ATOM 0 HA LEU A 128 0.554 4.617 -51.987 1.00 30.41 H new ATOM 0 HB2 LEU A 128 -1.242 3.614 -54.219 1.00 73.21 H new ATOM 0 HB3 LEU A 128 0.455 3.964 -54.480 1.00 73.21 H new ATOM 0 HG LEU A 128 0.134 1.589 -54.157 1.00 25.15 H new ATOM 0 HD11 LEU A 128 1.708 1.185 -52.298 1.00 61.42 H new ATOM 0 HD12 LEU A 128 2.223 2.545 -53.324 1.00 61.42 H new ATOM 0 HD13 LEU A 128 1.469 2.859 -51.742 1.00 61.42 H new ATOM 0 HD21 LEU A 128 -0.688 0.649 -52.033 1.00 51.52 H new ATOM 0 HD22 LEU A 128 -1.061 2.291 -51.458 1.00 51.52 H new ATOM 0 HD23 LEU A 128 -1.929 1.621 -52.859 1.00 51.52 H new ATOM 1970 N ALA A 129 -1.459 6.566 -53.753 1.00 4.43 N ATOM 1971 CA ALA A 129 -1.565 7.871 -54.414 1.00 1.24 C ATOM 1972 C ALA A 129 -2.951 8.474 -54.208 1.00 55.22 C ATOM 1973 O ALA A 129 -3.951 7.754 -54.208 1.00 1.51 O ATOM 1974 CB ALA A 129 -1.254 7.745 -55.905 1.00 14.11 C ATOM 0 H ALA A 129 -2.336 6.047 -53.704 1.00 4.43 H new ATOM 0 HA ALA A 129 -0.832 8.539 -53.962 1.00 1.24 H new ATOM 0 HB1 ALA A 129 -1.338 8.723 -56.378 1.00 14.11 H new ATOM 0 HB2 ALA A 129 -0.241 7.365 -56.034 1.00 14.11 H new ATOM 0 HB3 ALA A 129 -1.961 7.057 -56.367 1.00 14.11 H new ATOM 1980 N VAL A 130 -2.999 9.790 -54.020 1.00 71.35 N ATOM 1981 CA VAL A 130 -4.257 10.508 -53.808 1.00 3.33 C ATOM 1982 C VAL A 130 -4.761 11.103 -55.126 1.00 10.44 C ATOM 1983 O VAL A 130 -4.064 11.976 -55.696 1.00 70.32 O ATOM 1984 CB VAL A 130 -4.104 11.643 -52.754 1.00 20.24 C ATOM 1985 CG1 VAL A 130 -5.427 12.380 -52.559 1.00 51.34 C ATOM 1986 CG2 VAL A 130 -3.591 11.091 -51.424 1.00 32.12 C ATOM 1987 OXT VAL A 130 -5.857 10.719 -55.580 1.00 0.00 O ATOM 0 H VAL A 130 -2.173 10.388 -54.010 1.00 71.35 H new ATOM 0 HA VAL A 130 -4.981 9.786 -53.430 1.00 3.33 H new ATOM 0 HB VAL A 130 -3.368 12.354 -53.129 1.00 20.24 H new ATOM 0 HG11 VAL A 130 -5.298 13.169 -51.818 1.00 51.34 H new ATOM 0 HG12 VAL A 130 -5.742 12.819 -53.506 1.00 51.34 H new ATOM 0 HG13 VAL A 130 -6.187 11.679 -52.214 1.00 51.34 H new ATOM 0 HG21 VAL A 130 -3.493 11.905 -50.706 1.00 32.12 H new ATOM 0 HG22 VAL A 130 -4.295 10.352 -51.041 1.00 32.12 H new ATOM 0 HG23 VAL A 130 -2.619 10.622 -51.575 1.00 32.12 H new TER 1997 VAL A 130