USER MOD reduce.3.24.130724 H: found=0, std=0, add=998, rem=0, adj=29 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 32 THR OG1 : rot -110:sc= 0.762 USER MOD Set 1.2: A 95 LYS NZ :NH3+ -126:sc= 0.493 (180deg=-2.94!) USER MOD Set 2.1: A 47 THR OG1 : rot 65:sc= 0.892 USER MOD Set 2.2: A 71 GLN : amide:sc= 0.00088 X(o=0.89,f=0.83) USER MOD Set 3.1: A 45 LYS NZ :NH3+ -178:sc= 0.333 (180deg=0.331) USER MOD Set 3.2: A 73 THR OG1 : rot 111:sc= 0.544 USER MOD Set 4.1: A 28 LYS NZ :NH3+ -136:sc= 1.11 (180deg=0) USER MOD Set 4.2: A 89 THR OG1 : rot -37:sc= 1.21 USER MOD Set 5.1: A 21 SER OG : rot 119:sc= 0.984 USER MOD Set 5.2: A 120 THR OG1 : rot 78:sc= 0.433 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 172:sc= -0.0307 (180deg=-0.123) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=-0.005) 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=-0.013) USER MOD Single : A 6 HIS : no HD1:sc=-0.00407 X(o=-0.0041,f=0) USER MOD Single : A 7 HIS : no HD1:sc= -0.382 X(o=-0.38,f=-0.72) USER MOD Single : A 8 HIS : no HD1:sc=-0.00108 X(o=-0.0011,f=-0.0011) USER MOD Single : A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot -38:sc= 0.591 USER MOD Single : A 15 GLN : amide:sc= 0.239 K(o=0.24,f=-5.3!) USER MOD Single : A 16 THR OG1 : rot 180:sc= -0.286 USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 MET CE :methyl 161:sc= -0.152 (180deg=-0.581) USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 25 GLN : amide:sc= -0.789 K(o=-0.79,f=-2.8!) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 THR OG1 : rot 75:sc= 0.518 USER MOD Single : A 39 LYS NZ :NH3+ -144:sc= -2.36! (180deg=-4.86!) USER MOD Single : A 41 GLN : amide:sc= -0.106 X(o=-0.11,f=-0.46) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 HIS : no HE2:sc= -1.94 K(o=-1.9,f=-5.7!) USER MOD Single : A 50 TYR OH : rot 142:sc= 1.04 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 GLN : amide:sc= 0.873 K(o=0.87,f=-5.8!) USER MOD Single : A 62 SER OG : rot 43:sc= 0.36 USER MOD Single : A 63 SER OG : rot 128:sc= 0.234 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ -102:sc= 1.13 (180deg=-0.896) USER MOD Single : A 81 LYS NZ :NH3+ 134:sc= 1.22 (180deg=0.0912) USER MOD Single : A 85 GLN : amide:sc= 0.391 X(o=0.39,f=0) USER MOD Single : A 90 MET CE :methyl 174:sc= -4.28! (180deg=-5.05!) USER MOD Single : A 91 THR OG1 : rot -120:sc= 0.00293 USER MOD Single : A 99 THR OG1 : rot 68:sc= -1.55! USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= -0.0417 K(o=-0.042,f=-1.2) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 TYR OH : rot 30:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -15.156 -46.829 -27.396 1.00 3.40 N ATOM 2 CA MET A 1 -14.232 -45.766 -26.933 1.00 10.21 C ATOM 3 C MET A 1 -12.937 -45.795 -27.747 1.00 31.33 C ATOM 4 O MET A 1 -12.244 -46.812 -27.797 1.00 3.30 O ATOM 5 CB MET A 1 -13.936 -45.920 -25.430 1.00 73.31 C ATOM 6 CG MET A 1 -13.290 -47.247 -25.046 1.00 65.15 C ATOM 7 SD MET A 1 -13.057 -47.415 -23.264 1.00 4.42 S ATOM 8 CE MET A 1 -12.172 -48.973 -23.179 1.00 65.21 C ATOM 0 H1 MET A 1 -15.970 -46.887 -26.751 1.00 3.40 H new ATOM 0 H2 MET A 1 -15.490 -46.605 -28.355 1.00 3.40 H new ATOM 0 H3 MET A 1 -14.658 -47.742 -27.407 1.00 3.40 H new ATOM 0 HA MET A 1 -14.712 -44.800 -27.085 1.00 10.21 H new ATOM 0 HB2 MET A 1 -13.281 -45.107 -25.116 1.00 73.31 H new ATOM 0 HB3 MET A 1 -14.868 -45.810 -24.876 1.00 73.31 H new ATOM 0 HG2 MET A 1 -13.911 -48.067 -25.406 1.00 65.15 H new ATOM 0 HG3 MET A 1 -12.325 -47.335 -25.545 1.00 65.15 H new ATOM 0 HE1 MET A 1 -11.956 -49.213 -22.138 1.00 65.21 H new ATOM 0 HE2 MET A 1 -12.784 -49.763 -23.614 1.00 65.21 H new ATOM 0 HE3 MET A 1 -11.237 -48.891 -23.734 1.00 65.21 H new ATOM 20 N ALA A 2 -12.613 -44.668 -28.372 1.00 11.55 N ATOM 21 CA ALA A 2 -11.454 -44.567 -29.259 1.00 5.04 C ATOM 22 C ALA A 2 -10.183 -44.204 -28.485 1.00 60.10 C ATOM 23 O ALA A 2 -9.260 -43.602 -29.034 1.00 53.10 O ATOM 24 CB ALA A 2 -11.735 -43.529 -30.340 1.00 52.24 C ATOM 0 H ALA A 2 -13.142 -43.801 -28.280 1.00 11.55 H new ATOM 0 HA ALA A 2 -11.286 -45.540 -29.721 1.00 5.04 H new ATOM 0 HB1 ALA A 2 -10.873 -43.451 -31.003 1.00 52.24 H new ATOM 0 HB2 ALA A 2 -12.610 -43.831 -30.916 1.00 52.24 H new ATOM 0 HB3 ALA A 2 -11.923 -42.561 -29.875 1.00 52.24 H new ATOM 30 N HIS A 3 -10.138 -44.574 -27.208 1.00 21.32 N ATOM 31 CA HIS A 3 -8.983 -44.290 -26.356 1.00 71.41 C ATOM 32 C HIS A 3 -8.573 -45.550 -25.605 1.00 74.23 C ATOM 33 O HIS A 3 -9.411 -46.201 -24.980 1.00 21.43 O ATOM 34 CB HIS A 3 -9.300 -43.165 -25.355 1.00 10.53 C ATOM 35 CG HIS A 3 -9.644 -41.858 -26.002 1.00 12.00 C ATOM 36 ND1 HIS A 3 -8.763 -40.800 -26.082 1.00 64.50 N ATOM 37 CD2 HIS A 3 -10.785 -41.437 -26.598 1.00 70.35 C ATOM 38 CE1 HIS A 3 -9.348 -39.790 -26.698 1.00 44.42 C ATOM 39 NE2 HIS A 3 -10.574 -40.152 -27.021 1.00 50.14 N ATOM 0 H HIS A 3 -10.892 -45.074 -26.737 1.00 21.32 H new ATOM 0 HA HIS A 3 -8.161 -43.961 -26.991 1.00 71.41 H new ATOM 0 HB2 HIS A 3 -10.132 -43.477 -24.724 1.00 10.53 H new ATOM 0 HB3 HIS A 3 -8.440 -43.021 -24.701 1.00 10.53 H new ATOM 0 HD2 HIS A 3 -11.693 -42.009 -26.717 1.00 70.35 H new ATOM 0 HE1 HIS A 3 -8.899 -38.830 -26.903 1.00 44.42 H new ATOM 0 HE2 HIS A 3 -11.255 -39.569 -27.507 1.00 50.14 H new ATOM 48 N HIS A 4 -7.293 -45.899 -25.684 1.00 41.44 N ATOM 49 CA HIS A 4 -6.762 -47.062 -24.975 1.00 61.42 C ATOM 50 C HIS A 4 -6.247 -46.638 -23.604 1.00 34.24 C ATOM 51 O HIS A 4 -6.179 -47.436 -22.669 1.00 73.23 O ATOM 52 CB HIS A 4 -5.636 -47.716 -25.787 1.00 70.34 C ATOM 53 CG HIS A 4 -6.066 -48.177 -27.148 1.00 12.14 C ATOM 54 ND1 HIS A 4 -6.570 -49.435 -27.395 1.00 24.54 N ATOM 55 CD2 HIS A 4 -6.073 -47.532 -28.341 1.00 32.52 C ATOM 56 CE1 HIS A 4 -6.867 -49.544 -28.677 1.00 45.00 C ATOM 57 NE2 HIS A 4 -6.576 -48.405 -29.272 1.00 44.43 N ATOM 0 H HIS A 4 -6.600 -45.392 -26.234 1.00 41.44 H new ATOM 0 HA HIS A 4 -7.561 -47.792 -24.845 1.00 61.42 H new ATOM 0 HB2 HIS A 4 -4.817 -47.005 -25.896 1.00 70.34 H new ATOM 0 HB3 HIS A 4 -5.246 -48.568 -25.230 1.00 70.34 H new ATOM 0 HD2 HIS A 4 -5.744 -46.520 -28.524 1.00 32.52 H new ATOM 0 HE1 HIS A 4 -7.279 -50.419 -29.157 1.00 45.00 H new ATOM 0 HE2 HIS A 4 -6.704 -48.205 -30.264 1.00 44.43 H new ATOM 66 N HIS A 5 -5.880 -45.366 -23.499 1.00 33.34 N ATOM 67 CA HIS A 5 -5.430 -44.780 -22.241 1.00 30.04 C ATOM 68 C HIS A 5 -6.295 -43.567 -21.921 1.00 71.42 C ATOM 69 O HIS A 5 -6.855 -42.947 -22.829 1.00 43.00 O ATOM 70 CB HIS A 5 -3.948 -44.386 -22.330 1.00 43.53 C ATOM 71 CG HIS A 5 -3.037 -45.542 -22.635 1.00 2.34 C ATOM 72 ND1 HIS A 5 -2.278 -45.622 -23.784 1.00 73.32 N ATOM 73 CD2 HIS A 5 -2.772 -46.670 -21.933 1.00 13.00 C ATOM 74 CE1 HIS A 5 -1.590 -46.748 -23.775 1.00 45.42 C ATOM 75 NE2 HIS A 5 -1.868 -47.402 -22.665 1.00 75.32 N ATOM 0 H HIS A 5 -5.886 -44.712 -24.282 1.00 33.34 H new ATOM 0 HA HIS A 5 -5.530 -45.513 -21.441 1.00 30.04 H new ATOM 0 HB2 HIS A 5 -3.828 -43.626 -23.102 1.00 43.53 H new ATOM 0 HB3 HIS A 5 -3.643 -43.933 -21.387 1.00 43.53 H new ATOM 0 HD2 HIS A 5 -3.193 -46.943 -20.977 1.00 13.00 H new ATOM 0 HE1 HIS A 5 -0.912 -47.079 -24.548 1.00 45.42 H new ATOM 0 HE2 HIS A 5 -1.476 -48.304 -22.394 1.00 75.32 H new ATOM 84 N HIS A 6 -6.407 -43.229 -20.640 1.00 63.13 N ATOM 85 CA HIS A 6 -7.320 -42.174 -20.200 1.00 11.21 C ATOM 86 C HIS A 6 -6.772 -40.787 -20.513 1.00 65.13 C ATOM 87 O HIS A 6 -5.560 -40.598 -20.658 1.00 22.35 O ATOM 88 CB HIS A 6 -7.615 -42.310 -18.701 1.00 13.32 C ATOM 89 CG HIS A 6 -8.391 -43.547 -18.370 1.00 73.33 C ATOM 90 ND1 HIS A 6 -9.727 -43.532 -18.033 1.00 11.11 N ATOM 91 CD2 HIS A 6 -8.014 -44.845 -18.348 1.00 2.41 C ATOM 92 CE1 HIS A 6 -10.136 -44.767 -17.820 1.00 15.55 C ATOM 93 NE2 HIS A 6 -9.116 -45.580 -18.006 1.00 40.03 N ATOM 0 H HIS A 6 -5.878 -43.669 -19.887 1.00 63.13 H new ATOM 0 HA HIS A 6 -8.251 -42.292 -20.754 1.00 11.21 H new ATOM 0 HB2 HIS A 6 -6.675 -42.319 -18.150 1.00 13.32 H new ATOM 0 HB3 HIS A 6 -8.173 -41.436 -18.365 1.00 13.32 H new ATOM 0 HD2 HIS A 6 -7.028 -45.230 -18.561 1.00 2.41 H new ATOM 0 HE1 HIS A 6 -11.137 -45.062 -17.541 1.00 15.55 H new ATOM 0 HE2 HIS A 6 -9.144 -46.595 -17.910 1.00 40.03 H new ATOM 102 N HIS A 7 -7.679 -39.818 -20.621 1.00 35.24 N ATOM 103 CA HIS A 7 -7.307 -38.445 -20.931 1.00 21.22 C ATOM 104 C HIS A 7 -6.989 -37.684 -19.645 1.00 62.14 C ATOM 105 O HIS A 7 -7.886 -37.266 -18.912 1.00 65.32 O ATOM 106 CB HIS A 7 -8.416 -37.743 -21.747 1.00 40.00 C ATOM 107 CG HIS A 7 -9.785 -37.760 -21.118 1.00 5.42 C ATOM 108 ND1 HIS A 7 -10.677 -38.803 -21.276 1.00 32.01 N ATOM 109 CD2 HIS A 7 -10.421 -36.845 -20.343 1.00 63.42 C ATOM 110 CE1 HIS A 7 -11.796 -38.527 -20.630 1.00 15.31 C ATOM 111 NE2 HIS A 7 -11.667 -37.347 -20.056 1.00 2.11 N ATOM 0 H HIS A 7 -8.681 -39.963 -20.497 1.00 35.24 H new ATOM 0 HA HIS A 7 -6.409 -38.456 -21.549 1.00 21.22 H new ATOM 0 HB2 HIS A 7 -8.122 -36.706 -21.912 1.00 40.00 H new ATOM 0 HB3 HIS A 7 -8.478 -38.216 -22.727 1.00 40.00 H new ATOM 0 HD2 HIS A 7 -10.021 -35.897 -20.013 1.00 63.42 H new ATOM 0 HE1 HIS A 7 -12.669 -39.161 -20.580 1.00 15.31 H new ATOM 0 HE2 HIS A 7 -12.377 -36.882 -19.490 1.00 2.11 H new ATOM 120 N HIS A 8 -5.694 -37.541 -19.359 1.00 54.52 N ATOM 121 CA HIS A 8 -5.235 -36.835 -18.160 1.00 71.42 C ATOM 122 C HIS A 8 -5.623 -35.357 -18.226 1.00 60.23 C ATOM 123 O HIS A 8 -5.648 -34.659 -17.211 1.00 64.12 O ATOM 124 CB HIS A 8 -3.713 -36.980 -17.996 1.00 2.44 C ATOM 125 CG HIS A 8 -3.185 -36.409 -16.710 1.00 43.31 C ATOM 126 ND1 HIS A 8 -3.152 -37.124 -15.533 1.00 41.21 N ATOM 127 CD2 HIS A 8 -2.674 -35.187 -16.417 1.00 73.24 C ATOM 128 CE1 HIS A 8 -2.649 -36.369 -14.574 1.00 22.34 C ATOM 129 NE2 HIS A 8 -2.351 -35.189 -15.084 1.00 54.34 N ATOM 0 H HIS A 8 -4.942 -37.906 -19.943 1.00 54.52 H new ATOM 0 HA HIS A 8 -5.721 -37.283 -17.293 1.00 71.42 H new ATOM 0 HB2 HIS A 8 -3.450 -38.037 -18.049 1.00 2.44 H new ATOM 0 HB3 HIS A 8 -3.218 -36.486 -18.832 1.00 2.44 H new ATOM 0 HD2 HIS A 8 -2.545 -34.365 -17.106 1.00 73.24 H new ATOM 0 HE1 HIS A 8 -2.506 -36.667 -13.546 1.00 22.34 H new ATOM 0 HE2 HIS A 8 -1.946 -34.406 -14.571 1.00 54.34 H new ATOM 138 N MET A 9 -5.910 -34.890 -19.436 1.00 34.13 N ATOM 139 CA MET A 9 -6.389 -33.528 -19.657 1.00 52.34 C ATOM 140 C MET A 9 -7.839 -33.576 -20.125 1.00 10.22 C ATOM 141 O MET A 9 -8.215 -34.454 -20.906 1.00 4.13 O ATOM 142 CB MET A 9 -5.512 -32.810 -20.696 1.00 35.21 C ATOM 143 CG MET A 9 -5.503 -33.475 -22.070 1.00 10.04 C ATOM 144 SD MET A 9 -4.369 -32.680 -23.224 1.00 4.34 S ATOM 145 CE MET A 9 -4.622 -33.678 -24.690 1.00 21.11 C ATOM 0 H MET A 9 -5.818 -35.441 -20.289 1.00 34.13 H new ATOM 0 HA MET A 9 -6.330 -32.970 -18.723 1.00 52.34 H new ATOM 0 HB2 MET A 9 -5.862 -31.783 -20.803 1.00 35.21 H new ATOM 0 HB3 MET A 9 -4.490 -32.761 -20.321 1.00 35.21 H new ATOM 0 HG2 MET A 9 -5.226 -34.523 -21.959 1.00 10.04 H new ATOM 0 HG3 MET A 9 -6.511 -33.454 -22.485 1.00 10.04 H new ATOM 0 HE1 MET A 9 -3.987 -33.309 -25.495 1.00 21.11 H new ATOM 0 HE2 MET A 9 -4.366 -34.715 -24.473 1.00 21.11 H new ATOM 0 HE3 MET A 9 -5.667 -33.618 -24.995 1.00 21.11 H new ATOM 155 N GLY A 10 -8.651 -32.652 -19.625 1.00 72.52 N ATOM 156 CA GLY A 10 -10.062 -32.642 -19.956 1.00 63.23 C ATOM 157 C GLY A 10 -10.369 -31.835 -21.202 1.00 1.24 C ATOM 158 O GLY A 10 -9.571 -30.991 -21.620 1.00 31.32 O ATOM 0 H GLY A 10 -8.355 -31.907 -18.994 1.00 72.52 H new ATOM 0 HA2 GLY A 10 -10.404 -33.667 -20.100 1.00 63.23 H new ATOM 0 HA3 GLY A 10 -10.624 -32.233 -19.116 1.00 63.23 H new ATOM 162 N THR A 11 -11.539 -32.079 -21.782 1.00 0.32 N ATOM 163 CA THR A 11 -11.988 -31.370 -22.982 1.00 22.11 C ATOM 164 C THR A 11 -12.749 -30.097 -22.593 1.00 23.13 C ATOM 165 O THR A 11 -13.411 -29.467 -23.423 1.00 3.55 O ATOM 166 CB THR A 11 -12.888 -32.287 -23.854 1.00 61.11 C ATOM 167 OG1 THR A 11 -13.200 -31.655 -25.106 1.00 12.15 O ATOM 168 CG2 THR A 11 -14.182 -32.641 -23.126 1.00 23.11 C ATOM 0 H THR A 11 -12.204 -32.771 -21.437 1.00 0.32 H new ATOM 0 HA THR A 11 -11.111 -31.091 -23.566 1.00 22.11 H new ATOM 0 HB THR A 11 -12.331 -33.204 -24.046 1.00 61.11 H new ATOM 0 HG1 THR A 11 -13.346 -30.697 -24.961 1.00 12.15 H new ATOM 0 HG21 THR A 11 -14.792 -33.284 -23.760 1.00 23.11 H new ATOM 0 HG22 THR A 11 -13.947 -33.164 -22.199 1.00 23.11 H new ATOM 0 HG23 THR A 11 -14.732 -31.728 -22.898 1.00 23.11 H new ATOM 176 N LEU A 12 -12.635 -29.719 -21.320 1.00 23.05 N ATOM 177 CA LEU A 12 -13.327 -28.552 -20.786 1.00 13.01 C ATOM 178 C LEU A 12 -12.703 -27.264 -21.322 1.00 72.23 C ATOM 179 O LEU A 12 -11.474 -27.121 -21.354 1.00 0.21 O ATOM 180 CB LEU A 12 -13.292 -28.543 -19.245 1.00 64.41 C ATOM 181 CG LEU A 12 -13.940 -29.753 -18.537 1.00 51.22 C ATOM 182 CD1 LEU A 12 -15.326 -30.049 -19.105 1.00 51.14 C ATOM 183 CD2 LEU A 12 -13.042 -30.987 -18.615 1.00 60.24 C ATOM 0 H LEU A 12 -12.063 -30.212 -20.635 1.00 23.05 H new ATOM 0 HA LEU A 12 -14.366 -28.607 -21.110 1.00 13.01 H new ATOM 0 HB2 LEU A 12 -12.251 -28.478 -18.927 1.00 64.41 H new ATOM 0 HB3 LEU A 12 -13.789 -27.637 -18.897 1.00 64.41 H new ATOM 0 HG LEU A 12 -14.059 -29.493 -17.485 1.00 51.22 H new ATOM 0 HD11 LEU A 12 -15.756 -30.906 -18.586 1.00 51.14 H new ATOM 0 HD12 LEU A 12 -15.969 -29.180 -18.966 1.00 51.14 H new ATOM 0 HD13 LEU A 12 -15.243 -30.273 -20.169 1.00 51.14 H new ATOM 0 HD21 LEU A 12 -13.526 -31.822 -18.108 1.00 60.24 H new ATOM 0 HD22 LEU A 12 -12.871 -31.247 -19.660 1.00 60.24 H new ATOM 0 HD23 LEU A 12 -12.088 -30.774 -18.133 1.00 60.24 H new ATOM 195 N GLU A 13 -13.554 -26.333 -21.738 1.00 22.00 N ATOM 196 CA GLU A 13 -13.105 -25.045 -22.246 1.00 22.14 C ATOM 197 C GLU A 13 -12.895 -24.068 -21.088 1.00 41.33 C ATOM 198 O GLU A 13 -12.681 -24.480 -19.939 1.00 42.24 O ATOM 199 CB GLU A 13 -14.129 -24.484 -23.249 1.00 43.13 C ATOM 200 CG GLU A 13 -14.279 -25.316 -24.519 1.00 63.33 C ATOM 201 CD GLU A 13 -15.216 -24.672 -25.530 1.00 30.35 C ATOM 202 OE1 GLU A 13 -14.806 -23.692 -26.190 1.00 43.21 O ATOM 203 OE2 GLU A 13 -16.363 -25.143 -25.676 1.00 14.15 O ATOM 0 H GLU A 13 -14.567 -26.450 -21.732 1.00 22.00 H new ATOM 0 HA GLU A 13 -12.155 -25.179 -22.762 1.00 22.14 H new ATOM 0 HB2 GLU A 13 -15.100 -24.412 -22.758 1.00 43.13 H new ATOM 0 HB3 GLU A 13 -13.835 -23.471 -23.524 1.00 43.13 H new ATOM 0 HG2 GLU A 13 -13.299 -25.457 -24.975 1.00 63.33 H new ATOM 0 HG3 GLU A 13 -14.655 -26.306 -24.259 1.00 63.33 H new ATOM 210 N ALA A 14 -12.934 -22.780 -21.401 1.00 14.03 N ATOM 211 CA ALA A 14 -12.779 -21.727 -20.408 1.00 33.23 C ATOM 212 C ALA A 14 -13.655 -20.535 -20.777 1.00 11.25 C ATOM 213 O ALA A 14 -14.473 -20.625 -21.698 1.00 22.03 O ATOM 214 CB ALA A 14 -11.318 -21.313 -20.318 1.00 1.45 C ATOM 0 H ALA A 14 -13.074 -22.436 -22.351 1.00 14.03 H new ATOM 0 HA ALA A 14 -13.094 -22.100 -19.433 1.00 33.23 H new ATOM 0 HB1 ALA A 14 -11.208 -20.525 -19.573 1.00 1.45 H new ATOM 0 HB2 ALA A 14 -10.713 -22.172 -20.028 1.00 1.45 H new ATOM 0 HB3 ALA A 14 -10.984 -20.945 -21.288 1.00 1.45 H new ATOM 220 N GLN A 15 -13.508 -19.434 -20.047 1.00 71.12 N ATOM 221 CA GLN A 15 -14.221 -18.205 -20.371 1.00 54.40 C ATOM 222 C GLN A 15 -13.508 -17.496 -21.518 1.00 43.42 C ATOM 223 O GLN A 15 -12.277 -17.415 -21.535 1.00 31.11 O ATOM 224 CB GLN A 15 -14.306 -17.284 -19.143 1.00 11.24 C ATOM 225 CG GLN A 15 -15.017 -15.959 -19.408 1.00 43.33 C ATOM 226 CD GLN A 15 -16.423 -16.143 -19.956 1.00 41.31 C ATOM 227 OE1 GLN A 15 -16.628 -16.203 -21.169 1.00 20.25 O ATOM 228 NE2 GLN A 15 -17.401 -16.239 -19.071 1.00 24.31 N ATOM 0 H GLN A 15 -12.903 -19.368 -19.229 1.00 71.12 H new ATOM 0 HA GLN A 15 -15.238 -18.454 -20.675 1.00 54.40 H new ATOM 0 HB2 GLN A 15 -14.826 -17.810 -18.343 1.00 11.24 H new ATOM 0 HB3 GLN A 15 -13.297 -17.078 -18.786 1.00 11.24 H new ATOM 0 HG2 GLN A 15 -15.065 -15.386 -18.482 1.00 43.33 H new ATOM 0 HG3 GLN A 15 -14.430 -15.372 -20.115 1.00 43.33 H new ATOM 0 HE21 GLN A 15 -17.194 -16.185 -18.074 1.00 24.31 H new ATOM 0 HE22 GLN A 15 -18.363 -16.367 -19.386 1.00 24.31 H new ATOM 237 N THR A 16 -14.278 -16.996 -22.477 1.00 0.12 N ATOM 238 CA THR A 16 -13.714 -16.368 -23.662 1.00 75.23 C ATOM 239 C THR A 16 -13.658 -14.848 -23.506 1.00 40.03 C ATOM 240 O THR A 16 -14.239 -14.279 -22.575 1.00 21.31 O ATOM 241 CB THR A 16 -14.521 -16.732 -24.934 1.00 75.20 C ATOM 242 OG1 THR A 16 -13.888 -16.167 -26.092 1.00 44.10 O ATOM 243 CG2 THR A 16 -15.963 -16.238 -24.847 1.00 2.15 C ATOM 0 H THR A 16 -15.298 -17.014 -22.455 1.00 0.12 H new ATOM 0 HA THR A 16 -12.699 -16.749 -23.773 1.00 75.23 H new ATOM 0 HB THR A 16 -14.541 -17.819 -25.015 1.00 75.20 H new ATOM 0 HG1 THR A 16 -14.402 -16.402 -26.893 1.00 44.10 H new ATOM 0 HG21 THR A 16 -16.497 -16.512 -25.757 1.00 2.15 H new ATOM 0 HG22 THR A 16 -16.453 -16.695 -23.987 1.00 2.15 H new ATOM 0 HG23 THR A 16 -15.970 -15.154 -24.735 1.00 2.15 H new ATOM 251 N GLN A 17 -12.952 -14.207 -24.429 1.00 23.22 N ATOM 252 CA GLN A 17 -12.794 -12.760 -24.448 1.00 3.02 C ATOM 253 C GLN A 17 -12.214 -12.343 -25.797 1.00 51.13 C ATOM 254 O GLN A 17 -11.005 -12.460 -26.027 1.00 53.23 O ATOM 255 CB GLN A 17 -11.876 -12.292 -23.308 1.00 70.42 C ATOM 256 CG GLN A 17 -11.651 -10.784 -23.289 1.00 72.33 C ATOM 257 CD GLN A 17 -10.616 -10.361 -22.265 1.00 71.23 C ATOM 258 OE1 GLN A 17 -10.940 -10.062 -21.116 1.00 71.31 O ATOM 259 NE2 GLN A 17 -9.356 -10.341 -22.673 1.00 44.13 N ATOM 0 H GLN A 17 -12.469 -14.682 -25.192 1.00 23.22 H new ATOM 0 HA GLN A 17 -13.768 -12.293 -24.304 1.00 3.02 H new ATOM 0 HB2 GLN A 17 -12.307 -12.599 -22.355 1.00 70.42 H new ATOM 0 HB3 GLN A 17 -10.913 -12.794 -23.398 1.00 70.42 H new ATOM 0 HG2 GLN A 17 -11.333 -10.456 -24.278 1.00 72.33 H new ATOM 0 HG3 GLN A 17 -12.595 -10.282 -23.075 1.00 72.33 H new ATOM 0 HE21 GLN A 17 -9.127 -10.596 -23.634 1.00 44.13 H new ATOM 0 HE22 GLN A 17 -8.615 -10.071 -22.026 1.00 44.13 H new ATOM 268 N GLY A 18 -13.076 -11.881 -26.695 1.00 10.21 N ATOM 269 CA GLY A 18 -12.645 -11.534 -28.033 1.00 61.13 C ATOM 270 C GLY A 18 -13.609 -10.590 -28.718 1.00 70.32 C ATOM 271 O GLY A 18 -14.633 -10.221 -28.139 1.00 74.25 O ATOM 0 H GLY A 18 -14.071 -11.741 -26.517 1.00 10.21 H new ATOM 0 HA2 GLY A 18 -11.659 -11.073 -27.987 1.00 61.13 H new ATOM 0 HA3 GLY A 18 -12.545 -12.442 -28.627 1.00 61.13 H new ATOM 275 N PRO A 19 -13.316 -10.199 -29.967 1.00 71.50 N ATOM 276 CA PRO A 19 -14.139 -9.247 -30.716 1.00 35.41 C ATOM 277 C PRO A 19 -15.457 -9.870 -31.182 1.00 54.13 C ATOM 278 O PRO A 19 -15.635 -10.169 -32.366 1.00 73.40 O ATOM 279 CB PRO A 19 -13.243 -8.876 -31.907 1.00 23.33 C ATOM 280 CG PRO A 19 -12.401 -10.087 -32.124 1.00 14.54 C ATOM 281 CD PRO A 19 -12.161 -10.676 -30.756 1.00 31.43 C ATOM 0 HA PRO A 19 -14.439 -8.387 -30.117 1.00 35.41 H new ATOM 0 HB2 PRO A 19 -13.834 -8.639 -32.791 1.00 23.33 H new ATOM 0 HB3 PRO A 19 -12.632 -8.000 -31.688 1.00 23.33 H new ATOM 0 HG2 PRO A 19 -12.906 -10.802 -32.774 1.00 14.54 H new ATOM 0 HG3 PRO A 19 -11.459 -9.826 -32.607 1.00 14.54 H new ATOM 0 HD2 PRO A 19 -12.120 -11.765 -30.789 1.00 31.43 H new ATOM 0 HD3 PRO A 19 -11.217 -10.334 -30.332 1.00 31.43 H new ATOM 289 N GLY A 20 -16.362 -10.101 -30.234 1.00 31.23 N ATOM 290 CA GLY A 20 -17.678 -10.621 -30.564 1.00 1.24 C ATOM 291 C GLY A 20 -18.499 -9.599 -31.319 1.00 25.15 C ATOM 292 O GLY A 20 -18.847 -8.554 -30.767 1.00 53.44 O ATOM 0 H GLY A 20 -16.206 -9.936 -29.239 1.00 31.23 H new ATOM 0 HA2 GLY A 20 -17.574 -11.524 -31.166 1.00 1.24 H new ATOM 0 HA3 GLY A 20 -18.199 -10.906 -29.650 1.00 1.24 H new ATOM 296 N SER A 21 -18.798 -9.891 -32.581 1.00 21.21 N ATOM 297 CA SER A 21 -19.515 -8.959 -33.443 1.00 53.15 C ATOM 298 C SER A 21 -20.994 -8.854 -33.047 1.00 14.20 C ATOM 299 O SER A 21 -21.878 -9.389 -33.715 1.00 73.52 O ATOM 300 CB SER A 21 -19.366 -9.378 -34.912 1.00 54.50 C ATOM 301 OG SER A 21 -17.998 -9.399 -35.304 1.00 2.55 O ATOM 0 H SER A 21 -18.552 -10.773 -33.031 1.00 21.21 H new ATOM 0 HA SER A 21 -19.075 -7.970 -33.317 1.00 53.15 H new ATOM 0 HB2 SER A 21 -19.804 -10.365 -35.058 1.00 54.50 H new ATOM 0 HB3 SER A 21 -19.919 -8.687 -35.548 1.00 54.50 H new ATOM 0 HG SER A 21 -17.750 -10.307 -35.578 1.00 2.55 H new ATOM 307 N MET A 22 -21.239 -8.186 -31.923 1.00 23.10 N ATOM 308 CA MET A 22 -22.593 -7.867 -31.472 1.00 1.00 C ATOM 309 C MET A 22 -22.739 -6.352 -31.411 1.00 72.15 C ATOM 310 O MET A 22 -23.703 -5.818 -30.856 1.00 54.32 O ATOM 311 CB MET A 22 -22.863 -8.484 -30.091 1.00 40.45 C ATOM 312 CG MET A 22 -22.780 -10.004 -30.063 1.00 23.11 C ATOM 313 SD MET A 22 -23.085 -10.684 -28.419 1.00 11.22 S ATOM 314 CE MET A 22 -24.781 -10.170 -28.139 1.00 2.32 C ATOM 0 H MET A 22 -20.506 -7.850 -31.299 1.00 23.10 H new ATOM 0 HA MET A 22 -23.319 -8.283 -32.171 1.00 1.00 H new ATOM 0 HB2 MET A 22 -22.146 -8.078 -29.377 1.00 40.45 H new ATOM 0 HB3 MET A 22 -23.854 -8.179 -29.756 1.00 40.45 H new ATOM 0 HG2 MET A 22 -23.506 -10.417 -30.764 1.00 23.11 H new ATOM 0 HG3 MET A 22 -21.793 -10.317 -30.405 1.00 23.11 H new ATOM 0 HE1 MET A 22 -25.220 -10.778 -27.348 1.00 2.32 H new ATOM 0 HE2 MET A 22 -24.799 -9.121 -27.842 1.00 2.32 H new ATOM 0 HE3 MET A 22 -25.356 -10.298 -29.056 1.00 2.32 H new ATOM 324 N SER A 23 -21.760 -5.678 -31.996 1.00 10.14 N ATOM 325 CA SER A 23 -21.679 -4.231 -31.997 1.00 32.11 C ATOM 326 C SER A 23 -20.652 -3.792 -33.037 1.00 62.52 C ATOM 327 O SER A 23 -19.799 -4.587 -33.450 1.00 32.10 O ATOM 328 CB SER A 23 -21.285 -3.730 -30.600 1.00 71.33 C ATOM 329 OG SER A 23 -20.128 -4.404 -30.127 1.00 5.30 O ATOM 0 H SER A 23 -20.990 -6.130 -32.489 1.00 10.14 H new ATOM 0 HA SER A 23 -22.649 -3.804 -32.251 1.00 32.11 H new ATOM 0 HB2 SER A 23 -21.097 -2.657 -30.634 1.00 71.33 H new ATOM 0 HB3 SER A 23 -22.111 -3.887 -29.907 1.00 71.33 H new ATOM 0 HG SER A 23 -19.895 -4.068 -29.237 1.00 5.30 H new ATOM 335 N ALA A 24 -20.740 -2.544 -33.474 1.00 60.44 N ATOM 336 CA ALA A 24 -19.803 -2.015 -34.453 1.00 54.02 C ATOM 337 C ALA A 24 -18.463 -1.714 -33.793 1.00 62.11 C ATOM 338 O ALA A 24 -18.270 -0.641 -33.215 1.00 62.02 O ATOM 339 CB ALA A 24 -20.369 -0.765 -35.118 1.00 34.21 C ATOM 0 H ALA A 24 -21.450 -1.880 -33.166 1.00 60.44 H new ATOM 0 HA ALA A 24 -19.646 -2.768 -35.225 1.00 54.02 H new ATOM 0 HB1 ALA A 24 -19.653 -0.385 -35.847 1.00 34.21 H new ATOM 0 HB2 ALA A 24 -21.303 -1.012 -35.622 1.00 34.21 H new ATOM 0 HB3 ALA A 24 -20.556 -0.003 -34.361 1.00 34.21 H new ATOM 345 N GLN A 25 -17.557 -2.683 -33.848 1.00 52.11 N ATOM 346 CA GLN A 25 -16.230 -2.533 -33.261 1.00 33.31 C ATOM 347 C GLN A 25 -15.264 -2.006 -34.314 1.00 11.54 C ATOM 348 O GLN A 25 -15.372 -2.351 -35.491 1.00 33.33 O ATOM 349 CB GLN A 25 -15.739 -3.874 -32.696 1.00 24.32 C ATOM 350 CG GLN A 25 -16.661 -4.460 -31.628 1.00 62.34 C ATOM 351 CD GLN A 25 -16.124 -5.737 -31.006 1.00 50.24 C ATOM 352 OE1 GLN A 25 -14.912 -5.932 -30.892 1.00 54.31 O ATOM 353 NE2 GLN A 25 -17.023 -6.616 -30.596 1.00 0.52 N ATOM 0 H GLN A 25 -17.718 -3.585 -34.295 1.00 52.11 H new ATOM 0 HA GLN A 25 -16.280 -1.819 -32.439 1.00 33.31 H new ATOM 0 HB2 GLN A 25 -15.642 -4.589 -33.513 1.00 24.32 H new ATOM 0 HB3 GLN A 25 -14.745 -3.738 -32.271 1.00 24.32 H new ATOM 0 HG2 GLN A 25 -16.814 -3.719 -30.844 1.00 62.34 H new ATOM 0 HG3 GLN A 25 -17.636 -4.662 -32.071 1.00 62.34 H new ATOM 0 HE21 GLN A 25 -18.017 -6.418 -30.708 1.00 0.52 H new ATOM 0 HE22 GLN A 25 -16.722 -7.492 -30.168 1.00 0.52 H new ATOM 362 N LEU A 26 -14.323 -1.166 -33.887 1.00 30.13 N ATOM 363 CA LEU A 26 -13.447 -0.465 -34.816 1.00 12.14 C ATOM 364 C LEU A 26 -12.045 -0.278 -34.237 1.00 51.43 C ATOM 365 O LEU A 26 -11.852 0.480 -33.284 1.00 61.15 O ATOM 366 CB LEU A 26 -14.050 0.903 -35.174 1.00 71.53 C ATOM 367 CG LEU A 26 -13.201 1.777 -36.112 1.00 4.02 C ATOM 368 CD1 LEU A 26 -12.953 1.066 -37.439 1.00 1.33 C ATOM 369 CD2 LEU A 26 -13.872 3.130 -36.341 1.00 14.44 C ATOM 0 H LEU A 26 -14.150 -0.956 -32.904 1.00 30.13 H new ATOM 0 HA LEU A 26 -13.359 -1.074 -35.715 1.00 12.14 H new ATOM 0 HB2 LEU A 26 -15.023 0.741 -35.638 1.00 71.53 H new ATOM 0 HB3 LEU A 26 -14.225 1.456 -34.251 1.00 71.53 H new ATOM 0 HG LEU A 26 -12.236 1.950 -35.635 1.00 4.02 H new ATOM 0 HD11 LEU A 26 -12.350 1.703 -38.086 1.00 1.33 H new ATOM 0 HD12 LEU A 26 -12.424 0.130 -37.257 1.00 1.33 H new ATOM 0 HD13 LEU A 26 -13.907 0.856 -37.923 1.00 1.33 H new ATOM 0 HD21 LEU A 26 -13.256 3.734 -37.007 1.00 14.44 H new ATOM 0 HD22 LEU A 26 -14.853 2.978 -36.792 1.00 14.44 H new ATOM 0 HD23 LEU A 26 -13.987 3.645 -35.387 1.00 14.44 H new ATOM 381 N GLU A 27 -11.085 -0.987 -34.812 1.00 2.20 N ATOM 382 CA GLU A 27 -9.669 -0.780 -34.524 1.00 14.02 C ATOM 383 C GLU A 27 -8.999 -0.155 -35.745 1.00 65.33 C ATOM 384 O GLU A 27 -8.934 -0.780 -36.808 1.00 60.33 O ATOM 385 CB GLU A 27 -8.978 -2.113 -34.178 1.00 53.11 C ATOM 386 CG GLU A 27 -9.320 -2.661 -32.797 1.00 1.14 C ATOM 387 CD GLU A 27 -8.724 -1.822 -31.677 1.00 4.22 C ATOM 388 OE1 GLU A 27 -7.486 -1.838 -31.510 1.00 35.30 O ATOM 389 OE2 GLU A 27 -9.484 -1.136 -30.956 1.00 43.34 O ATOM 0 H GLU A 27 -11.264 -1.725 -35.494 1.00 2.20 H new ATOM 0 HA GLU A 27 -9.577 -0.116 -33.665 1.00 14.02 H new ATOM 0 HB2 GLU A 27 -9.252 -2.855 -34.928 1.00 53.11 H new ATOM 0 HB3 GLU A 27 -7.899 -1.976 -34.244 1.00 53.11 H new ATOM 0 HG2 GLU A 27 -10.403 -2.699 -32.682 1.00 1.14 H new ATOM 0 HG3 GLU A 27 -8.955 -3.685 -32.714 1.00 1.14 H new ATOM 396 N LYS A 28 -8.545 1.089 -35.609 1.00 20.23 N ATOM 397 CA LYS A 28 -7.801 1.754 -36.675 1.00 1.42 C ATOM 398 C LYS A 28 -6.348 1.934 -36.245 1.00 24.22 C ATOM 399 O LYS A 28 -6.014 2.822 -35.459 1.00 43.22 O ATOM 400 CB LYS A 28 -8.453 3.096 -37.062 1.00 13.42 C ATOM 401 CG LYS A 28 -8.656 4.077 -35.906 1.00 53.12 C ATOM 402 CD LYS A 28 -9.254 5.401 -36.388 1.00 50.34 C ATOM 403 CE LYS A 28 -8.385 6.056 -37.459 1.00 71.00 C ATOM 404 NZ LYS A 28 -8.953 7.345 -37.936 1.00 31.34 N ATOM 0 H LYS A 28 -8.679 1.656 -34.772 1.00 20.23 H new ATOM 0 HA LYS A 28 -7.824 1.129 -37.567 1.00 1.42 H new ATOM 0 HB2 LYS A 28 -7.836 3.576 -37.821 1.00 13.42 H new ATOM 0 HB3 LYS A 28 -9.421 2.893 -37.520 1.00 13.42 H new ATOM 0 HG2 LYS A 28 -9.314 3.630 -35.160 1.00 53.12 H new ATOM 0 HG3 LYS A 28 -7.701 4.266 -35.416 1.00 53.12 H new ATOM 0 HD2 LYS A 28 -10.253 5.225 -36.787 1.00 50.34 H new ATOM 0 HD3 LYS A 28 -9.363 6.080 -35.543 1.00 50.34 H new ATOM 0 HE2 LYS A 28 -7.386 6.228 -37.058 1.00 71.00 H new ATOM 0 HE3 LYS A 28 -8.277 5.375 -38.303 1.00 71.00 H new ATOM 0 HZ1 LYS A 28 -8.888 7.391 -38.973 1.00 31.34 H new ATOM 0 HZ2 LYS A 28 -9.950 7.412 -37.649 1.00 31.34 H new ATOM 0 HZ3 LYS A 28 -8.419 8.135 -37.520 1.00 31.34 H new ATOM 418 N LYS A 29 -5.492 1.064 -36.753 1.00 10.31 N ATOM 419 CA LYS A 29 -4.098 0.996 -36.332 1.00 4.51 C ATOM 420 C LYS A 29 -3.188 1.513 -37.441 1.00 32.22 C ATOM 421 O LYS A 29 -3.162 0.946 -38.529 1.00 50.14 O ATOM 422 CB LYS A 29 -3.745 -0.466 -36.018 1.00 34.44 C ATOM 423 CG LYS A 29 -2.410 -0.673 -35.306 1.00 63.44 C ATOM 424 CD LYS A 29 -2.493 -0.292 -33.828 1.00 73.32 C ATOM 425 CE LYS A 29 -1.279 -0.788 -33.045 1.00 34.34 C ATOM 426 NZ LYS A 29 -1.462 -0.630 -31.578 1.00 5.41 N ATOM 0 H LYS A 29 -5.742 0.383 -37.470 1.00 10.31 H new ATOM 0 HA LYS A 29 -3.956 1.614 -35.445 1.00 4.51 H new ATOM 0 HB2 LYS A 29 -4.537 -0.890 -35.401 1.00 34.44 H new ATOM 0 HB3 LYS A 29 -3.732 -1.029 -36.951 1.00 34.44 H new ATOM 0 HG2 LYS A 29 -2.107 -1.716 -35.397 1.00 63.44 H new ATOM 0 HG3 LYS A 29 -1.641 -0.074 -35.794 1.00 63.44 H new ATOM 0 HD2 LYS A 29 -2.567 0.792 -33.736 1.00 73.32 H new ATOM 0 HD3 LYS A 29 -3.401 -0.712 -33.395 1.00 73.32 H new ATOM 0 HE2 LYS A 29 -1.102 -1.838 -33.278 1.00 34.34 H new ATOM 0 HE3 LYS A 29 -0.393 -0.237 -33.362 1.00 34.34 H new ATOM 0 HZ1 LYS A 29 -0.616 -0.978 -31.083 1.00 5.41 H new ATOM 0 HZ2 LYS A 29 -1.606 0.375 -31.352 1.00 5.41 H new ATOM 0 HZ3 LYS A 29 -2.292 -1.176 -31.271 1.00 5.41 H new ATOM 440 N VAL A 30 -2.456 2.591 -37.180 1.00 1.11 N ATOM 441 CA VAL A 30 -1.501 3.098 -38.159 1.00 62.04 C ATOM 442 C VAL A 30 -0.414 2.046 -38.405 1.00 61.23 C ATOM 443 O VAL A 30 0.443 1.799 -37.551 1.00 52.32 O ATOM 444 CB VAL A 30 -0.880 4.456 -37.726 1.00 12.12 C ATOM 445 CG1 VAL A 30 -0.263 4.375 -36.329 1.00 33.10 C ATOM 446 CG2 VAL A 30 0.149 4.935 -38.755 1.00 70.43 C ATOM 0 H VAL A 30 -2.504 3.124 -36.312 1.00 1.11 H new ATOM 0 HA VAL A 30 -2.036 3.287 -39.089 1.00 62.04 H new ATOM 0 HB VAL A 30 -1.686 5.188 -37.682 1.00 12.12 H new ATOM 0 HG11 VAL A 30 0.161 5.343 -36.062 1.00 33.10 H new ATOM 0 HG12 VAL A 30 -1.033 4.104 -35.606 1.00 33.10 H new ATOM 0 HG13 VAL A 30 0.523 3.620 -36.322 1.00 33.10 H new ATOM 0 HG21 VAL A 30 0.571 5.887 -38.432 1.00 70.43 H new ATOM 0 HG22 VAL A 30 0.946 4.196 -38.844 1.00 70.43 H new ATOM 0 HG23 VAL A 30 -0.336 5.063 -39.723 1.00 70.43 H new ATOM 456 N LEU A 31 -0.488 1.399 -39.562 1.00 3.31 N ATOM 457 CA LEU A 31 0.385 0.269 -39.880 1.00 51.44 C ATOM 458 C LEU A 31 1.693 0.781 -40.483 1.00 63.53 C ATOM 459 O LEU A 31 2.746 0.158 -40.346 1.00 71.22 O ATOM 460 CB LEU A 31 -0.338 -0.688 -40.857 1.00 73.13 C ATOM 461 CG LEU A 31 -0.004 -2.191 -40.733 1.00 33.10 C ATOM 462 CD1 LEU A 31 1.456 -2.478 -41.083 1.00 41.32 C ATOM 463 CD2 LEU A 31 -0.343 -2.703 -39.332 1.00 61.33 C ATOM 0 H LEU A 31 -1.148 1.638 -40.302 1.00 3.31 H new ATOM 0 HA LEU A 31 0.620 -0.282 -38.969 1.00 51.44 H new ATOM 0 HB2 LEU A 31 -1.412 -0.566 -40.720 1.00 73.13 H new ATOM 0 HB3 LEU A 31 -0.109 -0.372 -41.875 1.00 73.13 H new ATOM 0 HG LEU A 31 -0.620 -2.727 -41.455 1.00 33.10 H new ATOM 0 HD11 LEU A 31 1.651 -3.546 -40.984 1.00 41.32 H new ATOM 0 HD12 LEU A 31 1.652 -2.167 -42.109 1.00 41.32 H new ATOM 0 HD13 LEU A 31 2.108 -1.926 -40.406 1.00 41.32 H new ATOM 0 HD21 LEU A 31 -0.101 -3.764 -39.264 1.00 61.33 H new ATOM 0 HD22 LEU A 31 0.236 -2.150 -38.593 1.00 61.33 H new ATOM 0 HD23 LEU A 31 -1.406 -2.561 -39.140 1.00 61.33 H new ATOM 475 N THR A 32 1.611 1.919 -41.158 1.00 73.42 N ATOM 476 CA THR A 32 2.770 2.545 -41.770 1.00 63.14 C ATOM 477 C THR A 32 2.547 4.055 -41.863 1.00 74.03 C ATOM 478 O THR A 32 1.690 4.505 -42.625 1.00 24.43 O ATOM 479 CB THR A 32 3.024 1.971 -43.185 1.00 71.24 C ATOM 480 OG1 THR A 32 3.100 0.535 -43.131 1.00 42.12 O ATOM 481 CG2 THR A 32 4.310 2.528 -43.783 1.00 61.24 C ATOM 0 H THR A 32 0.740 2.432 -41.295 1.00 73.42 H new ATOM 0 HA THR A 32 3.642 2.337 -41.151 1.00 63.14 H new ATOM 0 HB THR A 32 2.190 2.269 -43.821 1.00 71.24 H new ATOM 0 HG1 THR A 32 4.022 0.250 -43.299 1.00 42.12 H new ATOM 0 HG21 THR A 32 4.462 2.107 -44.777 1.00 61.24 H new ATOM 0 HG22 THR A 32 4.237 3.613 -43.856 1.00 61.24 H new ATOM 0 HG23 THR A 32 5.153 2.263 -43.144 1.00 61.24 H new ATOM 489 N PRO A 33 3.295 4.850 -41.073 1.00 53.10 N ATOM 490 CA PRO A 33 3.176 6.318 -41.074 1.00 31.44 C ATOM 491 C PRO A 33 3.493 6.917 -42.445 1.00 3.51 C ATOM 492 O PRO A 33 4.552 6.647 -43.023 1.00 22.31 O ATOM 493 CB PRO A 33 4.214 6.768 -40.027 1.00 1.05 C ATOM 494 CG PRO A 33 4.446 5.563 -39.178 1.00 71.12 C ATOM 495 CD PRO A 33 4.306 4.386 -40.102 1.00 42.35 C ATOM 0 HA PRO A 33 2.163 6.648 -40.846 1.00 31.44 H new ATOM 0 HB2 PRO A 33 5.137 7.101 -40.502 1.00 1.05 H new ATOM 0 HB3 PRO A 33 3.842 7.604 -39.434 1.00 1.05 H new ATOM 0 HG2 PRO A 33 5.436 5.589 -38.723 1.00 71.12 H new ATOM 0 HG3 PRO A 33 3.722 5.511 -38.364 1.00 71.12 H new ATOM 0 HD2 PRO A 33 5.250 4.139 -40.588 1.00 42.35 H new ATOM 0 HD3 PRO A 33 3.977 3.492 -39.572 1.00 42.35 H new ATOM 503 N GLY A 34 2.573 7.725 -42.960 1.00 1.22 N ATOM 504 CA GLY A 34 2.738 8.316 -44.274 1.00 71.12 C ATOM 505 C GLY A 34 3.163 9.764 -44.210 1.00 51.22 C ATOM 506 O GLY A 34 3.705 10.217 -43.198 1.00 33.52 O ATOM 0 H GLY A 34 1.708 7.983 -42.485 1.00 1.22 H new ATOM 0 HA2 GLY A 34 3.481 7.747 -44.833 1.00 71.12 H new ATOM 0 HA3 GLY A 34 1.799 8.241 -44.823 1.00 71.12 H new ATOM 510 N ASP A 35 2.894 10.491 -45.290 1.00 1.32 N ATOM 511 CA ASP A 35 3.297 11.888 -45.418 1.00 65.45 C ATOM 512 C ASP A 35 2.721 12.738 -44.283 1.00 14.34 C ATOM 513 O ASP A 35 3.462 13.402 -43.556 1.00 32.43 O ATOM 514 CB ASP A 35 2.850 12.438 -46.776 1.00 64.24 C ATOM 515 CG ASP A 35 3.073 13.933 -46.886 1.00 72.41 C ATOM 516 OD1 ASP A 35 4.231 14.357 -47.087 1.00 4.21 O ATOM 517 OD2 ASP A 35 2.092 14.685 -46.755 1.00 51.11 O ATOM 0 H ASP A 35 2.391 10.129 -46.100 1.00 1.32 H new ATOM 0 HA ASP A 35 4.384 11.937 -45.352 1.00 65.45 H new ATOM 0 HB2 ASP A 35 3.398 11.931 -47.570 1.00 64.24 H new ATOM 0 HB3 ASP A 35 1.793 12.217 -46.926 1.00 64.24 H new ATOM 522 N GLY A 36 1.401 12.719 -44.142 1.00 33.03 N ATOM 523 CA GLY A 36 0.749 13.384 -43.025 1.00 42.44 C ATOM 524 C GLY A 36 0.162 14.745 -43.366 1.00 51.13 C ATOM 525 O GLY A 36 -0.841 15.145 -42.773 1.00 23.41 O ATOM 0 H GLY A 36 0.764 12.251 -44.787 1.00 33.03 H new ATOM 0 HA2 GLY A 36 -0.047 12.741 -42.649 1.00 42.44 H new ATOM 0 HA3 GLY A 36 1.471 13.504 -42.217 1.00 42.44 H new ATOM 529 N VAL A 37 0.753 15.462 -44.321 1.00 62.44 N ATOM 530 CA VAL A 37 0.276 16.812 -44.655 1.00 70.24 C ATOM 531 C VAL A 37 -0.477 16.827 -45.987 1.00 51.32 C ATOM 532 O VAL A 37 -1.102 17.825 -46.348 1.00 73.24 O ATOM 533 CB VAL A 37 1.431 17.853 -44.682 1.00 11.24 C ATOM 534 CG1 VAL A 37 2.109 17.944 -43.316 1.00 11.54 C ATOM 535 CG2 VAL A 37 2.451 17.530 -45.770 1.00 52.31 C ATOM 0 H VAL A 37 1.550 15.142 -44.871 1.00 62.44 H new ATOM 0 HA VAL A 37 -0.414 17.099 -43.862 1.00 70.24 H new ATOM 0 HB VAL A 37 0.994 18.824 -44.917 1.00 11.24 H new ATOM 0 HG11 VAL A 37 2.914 18.678 -43.357 1.00 11.54 H new ATOM 0 HG12 VAL A 37 1.378 18.249 -42.567 1.00 11.54 H new ATOM 0 HG13 VAL A 37 2.519 16.970 -43.048 1.00 11.54 H new ATOM 0 HG21 VAL A 37 3.244 18.278 -45.759 1.00 52.31 H new ATOM 0 HG22 VAL A 37 2.880 16.545 -45.586 1.00 52.31 H new ATOM 0 HG23 VAL A 37 1.959 17.536 -46.743 1.00 52.31 H new ATOM 545 N THR A 38 -0.414 15.718 -46.713 1.00 10.01 N ATOM 546 CA THR A 38 -1.153 15.564 -47.957 1.00 12.05 C ATOM 547 C THR A 38 -2.293 14.563 -47.764 1.00 25.34 C ATOM 548 O THR A 38 -2.053 13.370 -47.551 1.00 54.22 O ATOM 549 CB THR A 38 -0.222 15.086 -49.095 1.00 44.23 C ATOM 550 OG1 THR A 38 0.948 15.919 -49.141 1.00 15.11 O ATOM 551 CG2 THR A 38 -0.933 15.125 -50.445 1.00 33.03 C ATOM 0 H THR A 38 0.147 14.906 -46.457 1.00 10.01 H new ATOM 0 HA THR A 38 -1.565 16.534 -48.234 1.00 12.05 H new ATOM 0 HB THR A 38 0.064 14.054 -48.891 1.00 44.23 H new ATOM 0 HG1 THR A 38 1.540 15.693 -48.393 1.00 15.11 H new ATOM 0 HG21 THR A 38 -0.252 14.783 -51.225 1.00 33.03 H new ATOM 0 HG22 THR A 38 -1.807 14.474 -50.415 1.00 33.03 H new ATOM 0 HG23 THR A 38 -1.249 16.146 -50.661 1.00 33.03 H new ATOM 559 N LYS A 39 -3.528 15.056 -47.811 1.00 43.31 N ATOM 560 CA LYS A 39 -4.712 14.221 -47.601 1.00 13.11 C ATOM 561 C LYS A 39 -5.442 13.973 -48.921 1.00 41.21 C ATOM 562 O LYS A 39 -5.541 14.877 -49.757 1.00 63.14 O ATOM 563 CB LYS A 39 -5.680 14.894 -46.614 1.00 22.03 C ATOM 564 CG LYS A 39 -5.114 15.089 -45.208 1.00 14.54 C ATOM 565 CD LYS A 39 -6.101 15.810 -44.280 1.00 41.50 C ATOM 566 CE LYS A 39 -7.291 14.932 -43.868 1.00 4.21 C ATOM 567 NZ LYS A 39 -8.166 14.555 -45.015 1.00 32.51 N ATOM 0 H LYS A 39 -3.738 16.037 -47.994 1.00 43.31 H new ATOM 0 HA LYS A 39 -4.376 13.269 -47.190 1.00 13.11 H new ATOM 0 HB2 LYS A 39 -5.970 15.866 -47.014 1.00 22.03 H new ATOM 0 HB3 LYS A 39 -6.587 14.293 -46.547 1.00 22.03 H new ATOM 0 HG2 LYS A 39 -4.861 14.118 -44.782 1.00 14.54 H new ATOM 0 HG3 LYS A 39 -4.189 15.662 -45.267 1.00 14.54 H new ATOM 0 HD2 LYS A 39 -5.574 16.140 -43.385 1.00 41.50 H new ATOM 0 HD3 LYS A 39 -6.473 16.705 -44.779 1.00 41.50 H new ATOM 0 HE2 LYS A 39 -6.918 14.026 -43.391 1.00 4.21 H new ATOM 0 HE3 LYS A 39 -7.886 15.462 -43.124 1.00 4.21 H new ATOM 0 HZ1 LYS A 39 -9.158 14.532 -44.702 1.00 32.51 H new ATOM 0 HZ2 LYS A 39 -8.059 15.254 -45.777 1.00 32.51 H new ATOM 0 HZ3 LYS A 39 -7.892 13.615 -45.366 1.00 32.51 H new ATOM 581 N PRO A 40 -5.944 12.744 -49.138 1.00 42.33 N ATOM 582 CA PRO A 40 -6.852 12.455 -50.252 1.00 34.02 C ATOM 583 C PRO A 40 -8.253 13.001 -49.963 1.00 15.53 C ATOM 584 O PRO A 40 -8.597 13.265 -48.806 1.00 20.24 O ATOM 585 CB PRO A 40 -6.855 10.921 -50.313 1.00 14.44 C ATOM 586 CG PRO A 40 -6.574 10.491 -48.912 1.00 71.04 C ATOM 587 CD PRO A 40 -5.658 11.540 -48.331 1.00 13.23 C ATOM 0 HA PRO A 40 -6.545 12.915 -51.191 1.00 34.02 H new ATOM 0 HB2 PRO A 40 -7.815 10.539 -50.660 1.00 14.44 H new ATOM 0 HB3 PRO A 40 -6.096 10.550 -51.002 1.00 14.44 H new ATOM 0 HG2 PRO A 40 -7.496 10.415 -48.335 1.00 71.04 H new ATOM 0 HG3 PRO A 40 -6.103 9.508 -48.892 1.00 71.04 H new ATOM 0 HD2 PRO A 40 -5.863 11.709 -47.274 1.00 13.23 H new ATOM 0 HD3 PRO A 40 -4.612 11.245 -48.409 1.00 13.23 H new ATOM 595 N GLN A 41 -9.058 13.172 -51.004 1.00 71.30 N ATOM 596 CA GLN A 41 -10.402 13.725 -50.855 1.00 74.23 C ATOM 597 C GLN A 41 -11.385 13.014 -51.782 1.00 54.51 C ATOM 598 O GLN A 41 -10.983 12.212 -52.628 1.00 73.51 O ATOM 599 CB GLN A 41 -10.390 15.239 -51.121 1.00 32.32 C ATOM 600 CG GLN A 41 -9.735 15.634 -52.441 1.00 20.14 C ATOM 601 CD GLN A 41 -9.656 17.139 -52.641 1.00 75.11 C ATOM 602 OE1 GLN A 41 -10.508 17.889 -52.160 1.00 42.13 O ATOM 603 NE2 GLN A 41 -8.626 17.594 -53.340 1.00 32.25 N ATOM 0 H GLN A 41 -8.805 12.936 -51.963 1.00 71.30 H new ATOM 0 HA GLN A 41 -10.732 13.561 -49.829 1.00 74.23 H new ATOM 0 HB2 GLN A 41 -11.416 15.607 -51.112 1.00 32.32 H new ATOM 0 HB3 GLN A 41 -9.866 15.736 -50.305 1.00 32.32 H new ATOM 0 HG2 GLN A 41 -8.730 15.215 -52.480 1.00 20.14 H new ATOM 0 HG3 GLN A 41 -10.297 15.193 -53.265 1.00 20.14 H new ATOM 0 HE21 GLN A 41 -7.941 16.942 -53.722 1.00 32.25 H new ATOM 0 HE22 GLN A 41 -8.518 18.596 -53.496 1.00 32.25 H new ATOM 612 N ALA A 42 -12.671 13.310 -51.609 1.00 32.14 N ATOM 613 CA ALA A 42 -13.733 12.645 -52.363 1.00 64.43 C ATOM 614 C ALA A 42 -13.784 13.139 -53.809 1.00 53.00 C ATOM 615 O ALA A 42 -13.337 14.249 -54.113 1.00 74.42 O ATOM 616 CB ALA A 42 -15.077 12.866 -51.679 1.00 22.33 C ATOM 0 H ALA A 42 -13.005 14.011 -50.948 1.00 32.14 H new ATOM 0 HA ALA A 42 -13.514 11.577 -52.385 1.00 64.43 H new ATOM 0 HB1 ALA A 42 -15.861 12.367 -52.248 1.00 22.33 H new ATOM 0 HB2 ALA A 42 -15.044 12.455 -50.670 1.00 22.33 H new ATOM 0 HB3 ALA A 42 -15.289 13.934 -51.629 1.00 22.33 H new ATOM 622 N GLY A 43 -14.341 12.309 -54.691 1.00 22.23 N ATOM 623 CA GLY A 43 -14.430 12.648 -56.101 1.00 40.21 C ATOM 624 C GLY A 43 -13.090 12.544 -56.799 1.00 65.14 C ATOM 625 O GLY A 43 -12.846 13.228 -57.796 1.00 43.04 O ATOM 0 H GLY A 43 -14.735 11.400 -54.449 1.00 22.23 H new ATOM 0 HA2 GLY A 43 -15.144 11.984 -56.588 1.00 40.21 H new ATOM 0 HA3 GLY A 43 -14.815 13.662 -56.206 1.00 40.21 H new ATOM 629 N LYS A 44 -12.215 11.685 -56.275 1.00 15.02 N ATOM 630 CA LYS A 44 -10.858 11.539 -56.804 1.00 4.12 C ATOM 631 C LYS A 44 -10.529 10.067 -57.034 1.00 2.42 C ATOM 632 O LYS A 44 -10.701 9.242 -56.135 1.00 21.32 O ATOM 633 CB LYS A 44 -9.837 12.142 -55.824 1.00 74.43 C ATOM 634 CG LYS A 44 -10.154 13.569 -55.383 1.00 13.21 C ATOM 635 CD LYS A 44 -10.122 14.557 -56.546 1.00 25.44 C ATOM 636 CE LYS A 44 -10.527 15.958 -56.102 1.00 74.31 C ATOM 637 NZ LYS A 44 -10.433 16.940 -57.214 1.00 24.40 N ATOM 0 H LYS A 44 -12.423 11.078 -55.482 1.00 15.02 H new ATOM 0 HA LYS A 44 -10.804 12.070 -57.755 1.00 4.12 H new ATOM 0 HB2 LYS A 44 -9.780 11.506 -54.941 1.00 74.43 H new ATOM 0 HB3 LYS A 44 -8.852 12.129 -56.291 1.00 74.43 H new ATOM 0 HG2 LYS A 44 -11.139 13.592 -54.917 1.00 13.21 H new ATOM 0 HG3 LYS A 44 -9.435 13.880 -54.625 1.00 13.21 H new ATOM 0 HD2 LYS A 44 -9.119 14.585 -56.973 1.00 25.44 H new ATOM 0 HD3 LYS A 44 -10.794 14.215 -57.333 1.00 25.44 H new ATOM 0 HE2 LYS A 44 -11.548 15.937 -55.721 1.00 74.31 H new ATOM 0 HE3 LYS A 44 -9.887 16.278 -55.280 1.00 74.31 H new ATOM 0 HZ1 LYS A 44 -10.717 17.880 -56.872 1.00 24.40 H new ATOM 0 HZ2 LYS A 44 -9.453 16.979 -57.561 1.00 24.40 H new ATOM 0 HZ3 LYS A 44 -11.063 16.649 -57.988 1.00 24.40 H new ATOM 651 N LYS A 45 -10.068 9.741 -58.238 1.00 31.54 N ATOM 652 CA LYS A 45 -9.588 8.393 -58.541 1.00 2.24 C ATOM 653 C LYS A 45 -8.232 8.185 -57.869 1.00 43.32 C ATOM 654 O LYS A 45 -7.228 8.733 -58.320 1.00 1.42 O ATOM 655 CB LYS A 45 -9.466 8.192 -60.063 1.00 23.45 C ATOM 656 CG LYS A 45 -8.951 6.809 -60.477 1.00 51.53 C ATOM 657 CD LYS A 45 -9.965 5.697 -60.202 1.00 61.23 C ATOM 658 CE LYS A 45 -11.229 5.857 -61.041 1.00 43.20 C ATOM 659 NZ LYS A 45 -12.192 4.740 -60.833 1.00 55.24 N ATOM 0 H LYS A 45 -10.016 10.392 -59.022 1.00 31.54 H new ATOM 0 HA LYS A 45 -10.301 7.662 -58.160 1.00 2.24 H new ATOM 0 HB2 LYS A 45 -10.443 8.354 -60.519 1.00 23.45 H new ATOM 0 HB3 LYS A 45 -8.796 8.952 -60.466 1.00 23.45 H new ATOM 0 HG2 LYS A 45 -8.708 6.819 -61.539 1.00 51.53 H new ATOM 0 HG3 LYS A 45 -8.027 6.594 -59.940 1.00 51.53 H new ATOM 0 HD2 LYS A 45 -9.509 4.730 -60.414 1.00 61.23 H new ATOM 0 HD3 LYS A 45 -10.229 5.700 -59.144 1.00 61.23 H new ATOM 0 HE2 LYS A 45 -11.712 6.801 -60.790 1.00 43.20 H new ATOM 0 HE3 LYS A 45 -10.958 5.908 -62.096 1.00 43.20 H new ATOM 0 HZ1 LYS A 45 -13.019 4.875 -61.449 1.00 55.24 H new ATOM 0 HZ2 LYS A 45 -11.731 3.837 -61.065 1.00 55.24 H new ATOM 0 HZ3 LYS A 45 -12.499 4.727 -59.839 1.00 55.24 H new ATOM 673 N VAL A 46 -8.220 7.421 -56.781 1.00 62.24 N ATOM 674 CA VAL A 46 -7.015 7.214 -55.982 1.00 12.10 C ATOM 675 C VAL A 46 -6.435 5.806 -56.163 1.00 64.05 C ATOM 676 O VAL A 46 -7.162 4.846 -56.468 1.00 45.11 O ATOM 677 CB VAL A 46 -7.292 7.465 -54.475 1.00 33.35 C ATOM 678 CG1 VAL A 46 -7.702 8.919 -54.231 1.00 13.43 C ATOM 679 CG2 VAL A 46 -8.367 6.512 -53.952 1.00 33.14 C ATOM 0 H VAL A 46 -9.041 6.929 -56.429 1.00 62.24 H new ATOM 0 HA VAL A 46 -6.281 7.936 -56.341 1.00 12.10 H new ATOM 0 HB VAL A 46 -6.369 7.273 -53.929 1.00 33.35 H new ATOM 0 HG11 VAL A 46 -7.891 9.070 -53.168 1.00 13.43 H new ATOM 0 HG12 VAL A 46 -6.900 9.582 -54.555 1.00 13.43 H new ATOM 0 HG13 VAL A 46 -8.608 9.141 -54.796 1.00 13.43 H new ATOM 0 HG21 VAL A 46 -8.543 6.708 -52.894 1.00 33.14 H new ATOM 0 HG22 VAL A 46 -9.292 6.666 -54.508 1.00 33.14 H new ATOM 0 HG23 VAL A 46 -8.034 5.482 -54.080 1.00 33.14 H new ATOM 689 N THR A 47 -5.119 5.709 -55.974 1.00 20.33 N ATOM 690 CA THR A 47 -4.385 4.451 -56.052 1.00 43.45 C ATOM 691 C THR A 47 -4.108 3.904 -54.642 1.00 3.34 C ATOM 692 O THR A 47 -3.296 4.465 -53.881 1.00 53.32 O ATOM 693 CB THR A 47 -3.054 4.646 -56.814 1.00 31.33 C ATOM 694 OG1 THR A 47 -3.306 5.301 -58.066 1.00 10.14 O ATOM 695 CG2 THR A 47 -2.363 3.309 -57.067 1.00 54.21 C ATOM 0 H THR A 47 -4.528 6.512 -55.760 1.00 20.33 H new ATOM 0 HA THR A 47 -4.997 3.731 -56.595 1.00 43.45 H new ATOM 0 HB THR A 47 -2.396 5.261 -56.200 1.00 31.33 H new ATOM 0 HG1 THR A 47 -3.649 6.204 -57.900 1.00 10.14 H new ATOM 0 HG21 THR A 47 -1.430 3.478 -57.604 1.00 54.21 H new ATOM 0 HG22 THR A 47 -2.151 2.823 -56.115 1.00 54.21 H new ATOM 0 HG23 THR A 47 -3.014 2.670 -57.663 1.00 54.21 H new ATOM 703 N VAL A 48 -4.786 2.807 -54.313 1.00 1.43 N ATOM 704 CA VAL A 48 -4.772 2.231 -52.969 1.00 41.03 C ATOM 705 C VAL A 48 -4.269 0.784 -52.973 1.00 2.14 C ATOM 706 O VAL A 48 -3.930 0.233 -54.013 1.00 5.01 O ATOM 707 CB VAL A 48 -6.187 2.256 -52.345 1.00 25.31 C ATOM 708 CG1 VAL A 48 -6.683 3.689 -52.169 1.00 2.44 C ATOM 709 CG2 VAL A 48 -7.158 1.446 -53.199 1.00 31.14 C ATOM 0 H VAL A 48 -5.364 2.289 -54.975 1.00 1.43 H new ATOM 0 HA VAL A 48 -4.091 2.842 -52.377 1.00 41.03 H new ATOM 0 HB VAL A 48 -6.133 1.799 -51.357 1.00 25.31 H new ATOM 0 HG11 VAL A 48 -7.680 3.677 -51.729 1.00 2.44 H new ATOM 0 HG12 VAL A 48 -6.003 4.232 -51.513 1.00 2.44 H new ATOM 0 HG13 VAL A 48 -6.721 4.183 -53.140 1.00 2.44 H new ATOM 0 HG21 VAL A 48 -8.150 1.473 -52.747 1.00 31.14 H new ATOM 0 HG22 VAL A 48 -7.204 1.872 -54.201 1.00 31.14 H new ATOM 0 HG23 VAL A 48 -6.815 0.413 -53.260 1.00 31.14 H new ATOM 719 N HIS A 49 -4.202 0.197 -51.786 1.00 0.12 N ATOM 720 CA HIS A 49 -3.802 -1.196 -51.597 1.00 21.40 C ATOM 721 C HIS A 49 -4.612 -1.795 -50.446 1.00 62.51 C ATOM 722 O HIS A 49 -4.838 -1.132 -49.434 1.00 12.42 O ATOM 723 CB HIS A 49 -2.285 -1.263 -51.325 1.00 65.53 C ATOM 724 CG HIS A 49 -1.776 -2.545 -50.731 1.00 3.22 C ATOM 725 ND1 HIS A 49 -0.682 -2.582 -49.904 1.00 4.14 N ATOM 726 CD2 HIS A 49 -2.203 -3.826 -50.838 1.00 44.34 C ATOM 727 CE1 HIS A 49 -0.459 -3.819 -49.524 1.00 71.41 C ATOM 728 NE2 HIS A 49 -1.370 -4.604 -50.072 1.00 60.41 N ATOM 0 H HIS A 49 -4.426 0.678 -50.915 1.00 0.12 H new ATOM 0 HA HIS A 49 -4.005 -1.778 -52.496 1.00 21.40 H new ATOM 0 HB2 HIS A 49 -1.760 -1.088 -52.264 1.00 65.53 H new ATOM 0 HB3 HIS A 49 -2.020 -0.445 -50.655 1.00 65.53 H new ATOM 0 HD1 HIS A 49 -0.127 -1.773 -49.627 1.00 4.14 H new ATOM 0 HD2 HIS A 49 -3.045 -4.172 -51.419 1.00 44.34 H new ATOM 0 HE1 HIS A 49 0.338 -4.142 -48.871 1.00 71.41 H new ATOM 737 N TYR A 50 -5.068 -3.036 -50.620 1.00 14.34 N ATOM 738 CA TYR A 50 -5.882 -3.716 -49.612 1.00 11.42 C ATOM 739 C TYR A 50 -5.283 -5.073 -49.251 1.00 70.24 C ATOM 740 O TYR A 50 -4.727 -5.762 -50.110 1.00 63.33 O ATOM 741 CB TYR A 50 -7.310 -3.944 -50.133 1.00 61.52 C ATOM 742 CG TYR A 50 -8.111 -2.679 -50.371 1.00 44.20 C ATOM 743 CD1 TYR A 50 -8.721 -2.017 -49.314 1.00 71.34 C ATOM 744 CD2 TYR A 50 -8.277 -2.163 -51.651 1.00 44.43 C ATOM 745 CE1 TYR A 50 -9.467 -0.876 -49.523 1.00 2.23 C ATOM 746 CE2 TYR A 50 -9.022 -1.020 -51.865 1.00 51.13 C ATOM 747 CZ TYR A 50 -9.615 -0.381 -50.798 1.00 62.13 C ATOM 748 OH TYR A 50 -10.361 0.756 -51.004 1.00 33.15 O ATOM 0 H TYR A 50 -4.886 -3.593 -51.455 1.00 14.34 H new ATOM 0 HA TYR A 50 -5.904 -3.077 -48.729 1.00 11.42 H new ATOM 0 HB2 TYR A 50 -7.256 -4.504 -51.067 1.00 61.52 H new ATOM 0 HB3 TYR A 50 -7.847 -4.568 -49.418 1.00 61.52 H new ATOM 0 HD1 TYR A 50 -8.609 -2.402 -48.311 1.00 71.34 H new ATOM 0 HD2 TYR A 50 -7.817 -2.663 -52.490 1.00 44.43 H new ATOM 0 HE1 TYR A 50 -9.933 -0.373 -48.689 1.00 2.23 H new ATOM 0 HE2 TYR A 50 -9.139 -0.629 -52.865 1.00 51.13 H new ATOM 0 HH TYR A 50 -9.938 1.304 -51.698 1.00 33.15 H new ATOM 758 N ASP A 51 -5.401 -5.443 -47.981 1.00 4.52 N ATOM 759 CA ASP A 51 -5.077 -6.795 -47.518 1.00 51.23 C ATOM 760 C ASP A 51 -6.168 -7.265 -46.560 1.00 52.23 C ATOM 761 O ASP A 51 -6.723 -6.461 -45.807 1.00 72.43 O ATOM 762 CB ASP A 51 -3.703 -6.847 -46.826 1.00 43.42 C ATOM 763 CG ASP A 51 -2.538 -6.569 -47.772 1.00 52.30 C ATOM 764 OD1 ASP A 51 -2.375 -7.306 -48.774 1.00 62.22 O ATOM 765 OD2 ASP A 51 -1.763 -5.623 -47.516 1.00 54.15 O ATOM 0 H ASP A 51 -5.723 -4.819 -47.242 1.00 4.52 H new ATOM 0 HA ASP A 51 -5.028 -7.456 -48.384 1.00 51.23 H new ATOM 0 HB2 ASP A 51 -3.685 -6.119 -46.015 1.00 43.42 H new ATOM 0 HB3 ASP A 51 -3.569 -7.830 -46.375 1.00 43.42 H new ATOM 770 N GLY A 52 -6.484 -8.558 -46.596 1.00 64.23 N ATOM 771 CA GLY A 52 -7.597 -9.082 -45.818 1.00 20.04 C ATOM 772 C GLY A 52 -7.142 -9.909 -44.632 1.00 41.33 C ATOM 773 O GLY A 52 -6.356 -10.850 -44.789 1.00 22.22 O ATOM 0 H GLY A 52 -5.988 -9.255 -47.152 1.00 64.23 H new ATOM 0 HA2 GLY A 52 -8.210 -8.253 -45.464 1.00 20.04 H new ATOM 0 HA3 GLY A 52 -8.229 -9.694 -46.462 1.00 20.04 H new ATOM 777 N ARG A 53 -7.660 -9.583 -43.449 1.00 44.32 N ATOM 778 CA ARG A 53 -7.240 -10.236 -42.214 1.00 1.42 C ATOM 779 C ARG A 53 -8.436 -10.506 -41.290 1.00 33.53 C ATOM 780 O ARG A 53 -9.365 -9.690 -41.174 1.00 63.13 O ATOM 781 CB ARG A 53 -6.208 -9.354 -41.491 1.00 71.31 C ATOM 782 CG ARG A 53 -5.558 -10.023 -40.285 1.00 52.10 C ATOM 783 CD ARG A 53 -4.673 -9.059 -39.497 1.00 42.02 C ATOM 784 NE ARG A 53 -3.598 -8.483 -40.310 1.00 21.24 N ATOM 785 CZ ARG A 53 -2.315 -8.430 -39.935 1.00 61.51 C ATOM 786 NH1 ARG A 53 -1.920 -8.984 -38.795 1.00 32.45 N ATOM 787 NH2 ARG A 53 -1.421 -7.829 -40.704 1.00 4.41 N ATOM 0 H ARG A 53 -8.375 -8.867 -43.321 1.00 44.32 H new ATOM 0 HA ARG A 53 -6.791 -11.195 -42.470 1.00 1.42 H new ATOM 0 HB2 ARG A 53 -5.430 -9.069 -42.199 1.00 71.31 H new ATOM 0 HB3 ARG A 53 -6.695 -8.435 -41.165 1.00 71.31 H new ATOM 0 HG2 ARG A 53 -6.334 -10.419 -39.630 1.00 52.10 H new ATOM 0 HG3 ARG A 53 -4.960 -10.871 -40.620 1.00 52.10 H new ATOM 0 HD2 ARG A 53 -5.288 -8.255 -39.094 1.00 42.02 H new ATOM 0 HD3 ARG A 53 -4.238 -9.584 -38.647 1.00 42.02 H new ATOM 0 HE ARG A 53 -3.844 -8.097 -41.222 1.00 21.24 H new ATOM 0 HH11 ARG A 53 -2.597 -9.456 -38.196 1.00 32.45 H new ATOM 0 HH12 ARG A 53 -0.939 -8.938 -38.518 1.00 32.45 H new ATOM 0 HH21 ARG A 53 -1.710 -7.404 -41.585 1.00 4.41 H new ATOM 0 HH22 ARG A 53 -0.444 -7.790 -40.415 1.00 4.41 H new ATOM 801 N PHE A 54 -8.411 -11.670 -40.644 1.00 54.13 N ATOM 802 CA PHE A 54 -9.388 -12.014 -39.618 1.00 71.03 C ATOM 803 C PHE A 54 -8.983 -11.367 -38.290 1.00 14.50 C ATOM 804 O PHE A 54 -7.806 -11.052 -38.093 1.00 62.12 O ATOM 805 CB PHE A 54 -9.479 -13.541 -39.448 1.00 75.12 C ATOM 806 CG PHE A 54 -10.018 -14.269 -40.655 1.00 4.21 C ATOM 807 CD1 PHE A 54 -11.371 -14.217 -40.965 1.00 43.03 C ATOM 808 CD2 PHE A 54 -9.178 -15.011 -41.473 1.00 10.32 C ATOM 809 CE1 PHE A 54 -11.870 -14.889 -42.065 1.00 64.24 C ATOM 810 CE2 PHE A 54 -9.673 -15.684 -42.571 1.00 10.31 C ATOM 811 CZ PHE A 54 -11.020 -15.623 -42.869 1.00 33.43 C ATOM 0 H PHE A 54 -7.716 -12.396 -40.817 1.00 54.13 H new ATOM 0 HA PHE A 54 -10.366 -11.641 -39.924 1.00 71.03 H new ATOM 0 HB2 PHE A 54 -8.487 -13.929 -39.217 1.00 75.12 H new ATOM 0 HB3 PHE A 54 -10.115 -13.762 -38.591 1.00 75.12 H new ATOM 0 HD1 PHE A 54 -12.041 -13.645 -40.340 1.00 43.03 H new ATOM 0 HD2 PHE A 54 -8.123 -15.062 -41.247 1.00 10.32 H new ATOM 0 HE1 PHE A 54 -12.924 -14.840 -42.296 1.00 64.24 H new ATOM 0 HE2 PHE A 54 -9.007 -16.259 -43.198 1.00 10.31 H new ATOM 0 HZ PHE A 54 -11.408 -16.148 -43.729 1.00 33.43 H new ATOM 821 N PRO A 55 -9.936 -11.171 -37.356 1.00 32.51 N ATOM 822 CA PRO A 55 -9.642 -10.603 -36.028 1.00 12.25 C ATOM 823 C PRO A 55 -8.660 -11.470 -35.230 1.00 74.21 C ATOM 824 O PRO A 55 -8.097 -11.027 -34.227 1.00 2.34 O ATOM 825 CB PRO A 55 -11.017 -10.553 -35.337 1.00 42.22 C ATOM 826 CG PRO A 55 -11.866 -11.521 -36.094 1.00 14.43 C ATOM 827 CD PRO A 55 -11.376 -11.465 -37.515 1.00 41.45 C ATOM 0 HA PRO A 55 -9.161 -9.627 -36.100 1.00 12.25 H new ATOM 0 HB2 PRO A 55 -10.941 -10.833 -34.286 1.00 42.22 H new ATOM 0 HB3 PRO A 55 -11.439 -9.548 -35.370 1.00 42.22 H new ATOM 0 HG2 PRO A 55 -11.771 -12.527 -35.686 1.00 14.43 H new ATOM 0 HG3 PRO A 55 -12.920 -11.250 -36.032 1.00 14.43 H new ATOM 0 HD2 PRO A 55 -11.541 -12.408 -38.037 1.00 41.45 H new ATOM 0 HD3 PRO A 55 -11.886 -10.690 -38.088 1.00 41.45 H new ATOM 835 N ASP A 56 -8.470 -12.711 -35.684 1.00 72.30 N ATOM 836 CA ASP A 56 -7.529 -13.643 -35.056 1.00 2.21 C ATOM 837 C ASP A 56 -6.100 -13.372 -35.523 1.00 31.10 C ATOM 838 O ASP A 56 -5.148 -13.987 -35.037 1.00 51.45 O ATOM 839 CB ASP A 56 -7.911 -15.095 -35.386 1.00 33.21 C ATOM 840 CG ASP A 56 -9.311 -15.454 -34.917 1.00 3.34 C ATOM 841 OD1 ASP A 56 -9.478 -15.798 -33.726 1.00 33.45 O ATOM 842 OD2 ASP A 56 -10.250 -15.395 -35.739 1.00 1.05 O ATOM 0 H ASP A 56 -8.960 -13.097 -36.491 1.00 72.30 H new ATOM 0 HA ASP A 56 -7.580 -13.494 -33.977 1.00 2.21 H new ATOM 0 HB2 ASP A 56 -7.842 -15.249 -36.463 1.00 33.21 H new ATOM 0 HB3 ASP A 56 -7.192 -15.770 -34.921 1.00 33.21 H new ATOM 847 N GLY A 57 -5.954 -12.460 -36.479 1.00 5.43 N ATOM 848 CA GLY A 57 -4.638 -12.105 -36.987 1.00 3.42 C ATOM 849 C GLY A 57 -4.304 -12.812 -38.286 1.00 52.54 C ATOM 850 O GLY A 57 -3.441 -12.357 -39.040 1.00 13.40 O ATOM 0 H GLY A 57 -6.727 -11.957 -36.914 1.00 5.43 H new ATOM 0 HA2 GLY A 57 -4.591 -11.027 -37.142 1.00 3.42 H new ATOM 0 HA3 GLY A 57 -3.885 -12.353 -36.239 1.00 3.42 H new ATOM 854 N LYS A 58 -4.993 -13.915 -38.551 1.00 22.23 N ATOM 855 CA LYS A 58 -4.763 -14.708 -39.755 1.00 64.14 C ATOM 856 C LYS A 58 -5.261 -13.969 -40.998 1.00 44.42 C ATOM 857 O LYS A 58 -6.433 -13.607 -41.082 1.00 32.12 O ATOM 858 CB LYS A 58 -5.473 -16.065 -39.638 1.00 2.04 C ATOM 859 CG LYS A 58 -5.336 -16.941 -40.884 1.00 64.13 C ATOM 860 CD LYS A 58 -6.124 -18.244 -40.758 1.00 2.12 C ATOM 861 CE LYS A 58 -6.016 -19.093 -42.021 1.00 51.22 C ATOM 862 NZ LYS A 58 -6.806 -20.349 -41.916 1.00 12.14 N ATOM 0 H LYS A 58 -5.723 -14.285 -37.942 1.00 22.23 H new ATOM 0 HA LYS A 58 -3.690 -14.870 -39.855 1.00 64.14 H new ATOM 0 HB2 LYS A 58 -5.069 -16.603 -38.780 1.00 2.04 H new ATOM 0 HB3 LYS A 58 -6.531 -15.895 -39.439 1.00 2.04 H new ATOM 0 HG2 LYS A 58 -5.686 -16.388 -41.756 1.00 64.13 H new ATOM 0 HG3 LYS A 58 -4.284 -17.169 -41.053 1.00 64.13 H new ATOM 0 HD2 LYS A 58 -5.754 -18.812 -39.905 1.00 2.12 H new ATOM 0 HD3 LYS A 58 -7.172 -18.018 -40.560 1.00 2.12 H new ATOM 0 HE2 LYS A 58 -6.365 -18.516 -42.877 1.00 51.22 H new ATOM 0 HE3 LYS A 58 -4.970 -19.337 -42.206 1.00 51.22 H new ATOM 0 HZ1 LYS A 58 -6.706 -20.897 -42.794 1.00 12.14 H new ATOM 0 HZ2 LYS A 58 -6.457 -20.913 -41.115 1.00 12.14 H new ATOM 0 HZ3 LYS A 58 -7.809 -20.117 -41.765 1.00 12.14 H new ATOM 876 N GLN A 59 -4.362 -13.740 -41.952 1.00 62.31 N ATOM 877 CA GLN A 59 -4.723 -13.131 -43.231 1.00 30.32 C ATOM 878 C GLN A 59 -5.216 -14.211 -44.197 1.00 0.55 C ATOM 879 O GLN A 59 -4.582 -15.262 -44.330 1.00 71.44 O ATOM 880 CB GLN A 59 -3.516 -12.388 -43.830 1.00 41.23 C ATOM 881 CG GLN A 59 -2.280 -13.266 -44.015 1.00 10.35 C ATOM 882 CD GLN A 59 -1.095 -12.510 -44.594 1.00 72.33 C ATOM 883 OE1 GLN A 59 -0.944 -11.310 -44.382 1.00 24.21 O ATOM 884 NE2 GLN A 59 -0.240 -13.210 -45.320 1.00 55.00 N ATOM 0 H GLN A 59 -3.372 -13.968 -41.863 1.00 62.31 H new ATOM 0 HA GLN A 59 -5.523 -12.410 -43.067 1.00 30.32 H new ATOM 0 HB2 GLN A 59 -3.801 -11.971 -44.796 1.00 41.23 H new ATOM 0 HB3 GLN A 59 -3.260 -11.549 -43.183 1.00 41.23 H new ATOM 0 HG2 GLN A 59 -1.997 -13.692 -43.053 1.00 10.35 H new ATOM 0 HG3 GLN A 59 -2.528 -14.099 -44.672 1.00 10.35 H new ATOM 0 HE21 GLN A 59 -0.398 -14.206 -45.475 1.00 55.00 H new ATOM 0 HE22 GLN A 59 0.578 -12.754 -45.725 1.00 55.00 H new ATOM 893 N PHE A 60 -6.347 -13.968 -44.861 1.00 4.41 N ATOM 894 CA PHE A 60 -6.898 -14.946 -45.804 1.00 50.42 C ATOM 895 C PHE A 60 -6.340 -14.721 -47.209 1.00 13.13 C ATOM 896 O PHE A 60 -6.378 -15.620 -48.051 1.00 51.22 O ATOM 897 CB PHE A 60 -8.440 -14.927 -45.817 1.00 41.42 C ATOM 898 CG PHE A 60 -9.074 -13.614 -46.214 1.00 61.13 C ATOM 899 CD1 PHE A 60 -9.256 -13.288 -47.553 1.00 12.31 C ATOM 900 CD2 PHE A 60 -9.508 -12.717 -45.247 1.00 40.54 C ATOM 901 CE1 PHE A 60 -9.852 -12.096 -47.916 1.00 10.14 C ATOM 902 CE2 PHE A 60 -10.109 -11.527 -45.608 1.00 73.53 C ATOM 903 CZ PHE A 60 -10.279 -11.214 -46.942 1.00 13.11 C ATOM 0 H PHE A 60 -6.895 -13.113 -44.766 1.00 4.41 H new ATOM 0 HA PHE A 60 -6.588 -15.934 -45.464 1.00 50.42 H new ATOM 0 HB2 PHE A 60 -8.789 -15.700 -46.502 1.00 41.42 H new ATOM 0 HB3 PHE A 60 -8.797 -15.196 -44.823 1.00 41.42 H new ATOM 0 HD1 PHE A 60 -8.927 -13.975 -48.319 1.00 12.31 H new ATOM 0 HD2 PHE A 60 -9.374 -12.952 -44.201 1.00 40.54 H new ATOM 0 HE1 PHE A 60 -9.984 -11.854 -48.960 1.00 10.14 H new ATOM 0 HE2 PHE A 60 -10.446 -10.840 -44.846 1.00 73.53 H new ATOM 0 HZ PHE A 60 -10.745 -10.281 -47.224 1.00 13.11 H new ATOM 913 N ASP A 61 -5.819 -13.519 -47.452 1.00 72.13 N ATOM 914 CA ASP A 61 -5.175 -13.199 -48.727 1.00 21.25 C ATOM 915 C ASP A 61 -4.211 -12.037 -48.535 1.00 45.30 C ATOM 916 O ASP A 61 -4.475 -11.128 -47.743 1.00 20.32 O ATOM 917 CB ASP A 61 -6.210 -12.843 -49.807 1.00 71.44 C ATOM 918 CG ASP A 61 -5.630 -12.905 -51.218 1.00 31.53 C ATOM 919 OD1 ASP A 61 -4.890 -11.981 -51.621 1.00 45.10 O ATOM 920 OD2 ASP A 61 -5.918 -13.887 -51.936 1.00 42.41 O ATOM 0 H ASP A 61 -5.830 -12.750 -46.783 1.00 72.13 H new ATOM 0 HA ASP A 61 -4.630 -14.081 -49.062 1.00 21.25 H new ATOM 0 HB2 ASP A 61 -7.055 -13.528 -49.735 1.00 71.44 H new ATOM 0 HB3 ASP A 61 -6.595 -11.841 -49.620 1.00 71.44 H new ATOM 925 N SER A 62 -3.098 -12.075 -49.251 1.00 2.52 N ATOM 926 CA SER A 62 -2.077 -11.047 -49.138 1.00 22.13 C ATOM 927 C SER A 62 -1.775 -10.427 -50.503 1.00 22.13 C ATOM 928 O SER A 62 -1.022 -10.990 -51.304 1.00 25.20 O ATOM 929 CB SER A 62 -0.808 -11.651 -48.525 1.00 73.41 C ATOM 930 OG SER A 62 -0.400 -12.811 -49.236 1.00 51.41 O ATOM 0 H SER A 62 -2.879 -12.812 -49.921 1.00 2.52 H new ATOM 0 HA SER A 62 -2.445 -10.254 -48.487 1.00 22.13 H new ATOM 0 HB2 SER A 62 -0.007 -10.912 -48.538 1.00 73.41 H new ATOM 0 HB3 SER A 62 -0.990 -11.906 -47.481 1.00 73.41 H new ATOM 0 HG SER A 62 -0.486 -12.651 -50.199 1.00 51.41 H new ATOM 936 N SER A 63 -2.372 -9.270 -50.770 1.00 2.54 N ATOM 937 CA SER A 63 -2.110 -8.541 -52.004 1.00 61.15 C ATOM 938 C SER A 63 -0.704 -7.945 -51.951 1.00 30.33 C ATOM 939 O SER A 63 -0.042 -7.774 -52.979 1.00 20.53 O ATOM 940 CB SER A 63 -3.157 -7.441 -52.200 1.00 5.12 C ATOM 941 OG SER A 63 -4.471 -7.963 -52.072 1.00 11.23 O ATOM 0 H SER A 63 -3.041 -8.817 -50.147 1.00 2.54 H new ATOM 0 HA SER A 63 -2.174 -9.224 -52.851 1.00 61.15 H new ATOM 0 HB2 SER A 63 -3.002 -6.651 -51.465 1.00 5.12 H new ATOM 0 HB3 SER A 63 -3.035 -6.989 -53.184 1.00 5.12 H new ATOM 0 HG SER A 63 -4.974 -7.427 -51.424 1.00 11.23 H new ATOM 947 N ARG A 64 -0.250 -7.648 -50.734 1.00 62.05 N ATOM 948 CA ARG A 64 1.098 -7.136 -50.508 1.00 51.31 C ATOM 949 C ARG A 64 2.144 -8.139 -50.979 1.00 11.31 C ATOM 950 O ARG A 64 3.131 -7.766 -51.608 1.00 41.21 O ATOM 951 CB ARG A 64 1.304 -6.806 -49.022 1.00 11.31 C ATOM 952 CG ARG A 64 0.912 -7.931 -48.067 1.00 31.34 C ATOM 953 CD ARG A 64 1.098 -7.517 -46.612 1.00 61.25 C ATOM 954 NE ARG A 64 0.333 -8.361 -45.692 1.00 63.21 N ATOM 955 CZ ARG A 64 -0.630 -7.894 -44.891 1.00 44.35 C ATOM 956 NH1 ARG A 64 -0.986 -6.621 -44.957 1.00 70.45 N ATOM 957 NH2 ARG A 64 -1.260 -8.704 -44.056 1.00 74.42 N ATOM 0 H ARG A 64 -0.803 -7.755 -49.884 1.00 62.05 H new ATOM 0 HA ARG A 64 1.217 -6.221 -51.088 1.00 51.31 H new ATOM 0 HB2 ARG A 64 2.353 -6.556 -48.860 1.00 11.31 H new ATOM 0 HB3 ARG A 64 0.723 -5.917 -48.776 1.00 11.31 H new ATOM 0 HG2 ARG A 64 -0.128 -8.209 -48.237 1.00 31.34 H new ATOM 0 HG3 ARG A 64 1.516 -8.814 -48.275 1.00 31.34 H new ATOM 0 HD2 ARG A 64 2.156 -7.568 -46.354 1.00 61.25 H new ATOM 0 HD3 ARG A 64 0.790 -6.478 -46.490 1.00 61.25 H new ATOM 0 HE ARG A 64 0.546 -9.358 -45.661 1.00 63.21 H new ATOM 0 HH11 ARG A 64 -0.526 -5.996 -45.619 1.00 70.45 H new ATOM 0 HH12 ARG A 64 -1.721 -6.265 -44.346 1.00 70.45 H new ATOM 0 HH21 ARG A 64 -1.012 -9.693 -44.020 1.00 74.42 H new ATOM 0 HH22 ARG A 64 -1.994 -8.340 -43.448 1.00 74.42 H new ATOM 971 N SER A 65 1.903 -9.417 -50.703 1.00 10.31 N ATOM 972 CA SER A 65 2.837 -10.467 -51.086 1.00 43.24 C ATOM 973 C SER A 65 2.831 -10.643 -52.605 1.00 30.11 C ATOM 974 O SER A 65 3.773 -11.189 -53.180 1.00 40.21 O ATOM 975 CB SER A 65 2.479 -11.783 -50.378 1.00 13.31 C ATOM 976 OG SER A 65 3.548 -12.716 -50.443 1.00 52.33 O ATOM 0 H SER A 65 1.070 -9.749 -50.216 1.00 10.31 H new ATOM 0 HA SER A 65 3.842 -10.180 -50.777 1.00 43.24 H new ATOM 0 HB2 SER A 65 2.233 -11.581 -49.335 1.00 13.31 H new ATOM 0 HB3 SER A 65 1.590 -12.214 -50.837 1.00 13.31 H new ATOM 0 HG SER A 65 3.290 -13.542 -49.983 1.00 52.33 H new ATOM 982 N ARG A 66 1.767 -10.162 -53.248 1.00 45.31 N ATOM 983 CA ARG A 66 1.660 -10.190 -54.706 1.00 14.00 C ATOM 984 C ARG A 66 2.354 -8.968 -55.306 1.00 1.23 C ATOM 985 O ARG A 66 2.854 -9.007 -56.432 1.00 33.32 O ATOM 986 CB ARG A 66 0.191 -10.183 -55.146 1.00 41.14 C ATOM 987 CG ARG A 66 -0.672 -11.274 -54.519 1.00 42.33 C ATOM 988 CD ARG A 66 -2.118 -11.155 -54.983 1.00 1.51 C ATOM 989 NE ARG A 66 -3.015 -12.116 -54.329 1.00 14.23 N ATOM 990 CZ ARG A 66 -3.842 -12.928 -54.990 1.00 13.50 C ATOM 991 NH1 ARG A 66 -3.831 -12.952 -56.319 1.00 2.55 N ATOM 992 NH2 ARG A 66 -4.681 -13.709 -54.323 1.00 75.44 N ATOM 0 H ARG A 66 0.963 -9.746 -52.778 1.00 45.31 H new ATOM 0 HA ARG A 66 2.138 -11.104 -55.058 1.00 14.00 H new ATOM 0 HB2 ARG A 66 -0.242 -9.213 -54.902 1.00 41.14 H new ATOM 0 HB3 ARG A 66 0.151 -10.287 -56.230 1.00 41.14 H new ATOM 0 HG2 ARG A 66 -0.279 -12.254 -54.788 1.00 42.33 H new ATOM 0 HG3 ARG A 66 -0.627 -11.200 -53.432 1.00 42.33 H new ATOM 0 HD2 ARG A 66 -2.474 -10.144 -54.787 1.00 1.51 H new ATOM 0 HD3 ARG A 66 -2.160 -11.304 -56.062 1.00 1.51 H new ATOM 0 HE ARG A 66 -3.005 -12.166 -53.310 1.00 14.23 H new ATOM 0 HH11 ARG A 66 -3.190 -12.349 -56.835 1.00 2.55 H new ATOM 0 HH12 ARG A 66 -4.464 -13.573 -56.823 1.00 2.55 H new ATOM 0 HH21 ARG A 66 -4.695 -13.689 -53.303 1.00 75.44 H new ATOM 0 HH22 ARG A 66 -5.313 -14.329 -54.830 1.00 75.44 H new ATOM 1006 N GLY A 67 2.375 -7.881 -54.534 1.00 34.51 N ATOM 1007 CA GLY A 67 2.905 -6.619 -55.022 1.00 34.10 C ATOM 1008 C GLY A 67 1.936 -5.930 -55.963 1.00 63.33 C ATOM 1009 O GLY A 67 2.342 -5.143 -56.821 1.00 1.24 O ATOM 0 H GLY A 67 2.032 -7.854 -53.574 1.00 34.51 H new ATOM 0 HA2 GLY A 67 3.120 -5.964 -54.178 1.00 34.10 H new ATOM 0 HA3 GLY A 67 3.849 -6.796 -55.537 1.00 34.10 H new ATOM 1013 N LYS A 68 0.646 -6.223 -55.791 1.00 75.34 N ATOM 1014 CA LYS A 68 -0.399 -5.692 -56.668 1.00 45.14 C ATOM 1015 C LYS A 68 -1.243 -4.635 -55.951 1.00 23.21 C ATOM 1016 O LYS A 68 -1.899 -4.932 -54.949 1.00 4.34 O ATOM 1017 CB LYS A 68 -1.304 -6.831 -57.156 1.00 40.24 C ATOM 1018 CG LYS A 68 -2.432 -6.383 -58.086 1.00 60.33 C ATOM 1019 CD LYS A 68 -1.899 -5.724 -59.359 1.00 74.22 C ATOM 1020 CE LYS A 68 -3.022 -5.328 -60.312 1.00 64.14 C ATOM 1021 NZ LYS A 68 -3.973 -4.364 -59.697 1.00 71.10 N ATOM 0 H LYS A 68 0.298 -6.829 -55.048 1.00 75.34 H new ATOM 0 HA LYS A 68 0.088 -5.220 -57.521 1.00 45.14 H new ATOM 0 HB2 LYS A 68 -0.692 -7.569 -57.675 1.00 40.24 H new ATOM 0 HB3 LYS A 68 -1.739 -7.330 -56.290 1.00 40.24 H new ATOM 0 HG2 LYS A 68 -3.045 -7.244 -58.353 1.00 60.33 H new ATOM 0 HG3 LYS A 68 -3.079 -5.682 -57.559 1.00 60.33 H new ATOM 0 HD2 LYS A 68 -1.320 -4.839 -59.094 1.00 74.22 H new ATOM 0 HD3 LYS A 68 -1.219 -6.410 -59.865 1.00 74.22 H new ATOM 0 HE2 LYS A 68 -2.593 -4.887 -61.212 1.00 64.14 H new ATOM 0 HE3 LYS A 68 -3.564 -6.221 -60.622 1.00 64.14 H new ATOM 0 HZ1 LYS A 68 -4.835 -4.866 -59.403 1.00 71.10 H new ATOM 0 HZ2 LYS A 68 -3.530 -3.921 -58.867 1.00 71.10 H new ATOM 0 HZ3 LYS A 68 -4.220 -3.629 -60.391 1.00 71.10 H new ATOM 1035 N PRO A 69 -1.216 -3.379 -56.440 1.00 1.43 N ATOM 1036 CA PRO A 69 -2.067 -2.301 -55.934 1.00 41.05 C ATOM 1037 C PRO A 69 -3.466 -2.324 -56.568 1.00 63.34 C ATOM 1038 O PRO A 69 -3.777 -3.187 -57.394 1.00 73.21 O ATOM 1039 CB PRO A 69 -1.302 -1.015 -56.332 1.00 65.54 C ATOM 1040 CG PRO A 69 -0.058 -1.476 -57.039 1.00 33.42 C ATOM 1041 CD PRO A 69 -0.330 -2.882 -57.497 1.00 34.41 C ATOM 0 HA PRO A 69 -2.241 -2.385 -54.861 1.00 41.05 H new ATOM 0 HB2 PRO A 69 -1.909 -0.385 -56.982 1.00 65.54 H new ATOM 0 HB3 PRO A 69 -1.054 -0.421 -55.453 1.00 65.54 H new ATOM 0 HG2 PRO A 69 0.171 -0.829 -57.886 1.00 33.42 H new ATOM 0 HG3 PRO A 69 0.803 -1.444 -56.372 1.00 33.42 H new ATOM 0 HD2 PRO A 69 -0.808 -2.907 -58.476 1.00 34.41 H new ATOM 0 HD3 PRO A 69 0.584 -3.471 -57.574 1.00 34.41 H new ATOM 1049 N PHE A 70 -4.290 -1.356 -56.179 1.00 41.12 N ATOM 1050 CA PHE A 70 -5.667 -1.226 -56.655 1.00 52.04 C ATOM 1051 C PHE A 70 -5.980 0.255 -56.871 1.00 55.23 C ATOM 1052 O PHE A 70 -5.253 1.118 -56.378 1.00 31.10 O ATOM 1053 CB PHE A 70 -6.655 -1.820 -55.636 1.00 51.25 C ATOM 1054 CG PHE A 70 -6.378 -3.260 -55.272 1.00 44.01 C ATOM 1055 CD1 PHE A 70 -6.834 -4.296 -56.076 1.00 54.02 C ATOM 1056 CD2 PHE A 70 -5.661 -3.576 -54.123 1.00 50.33 C ATOM 1057 CE1 PHE A 70 -6.580 -5.613 -55.743 1.00 42.20 C ATOM 1058 CE2 PHE A 70 -5.407 -4.892 -53.787 1.00 71.23 C ATOM 1059 CZ PHE A 70 -5.866 -5.911 -54.598 1.00 20.44 C ATOM 0 H PHE A 70 -4.019 -0.630 -55.516 1.00 41.12 H new ATOM 0 HA PHE A 70 -5.772 -1.773 -57.592 1.00 52.04 H new ATOM 0 HB2 PHE A 70 -6.631 -1.216 -54.729 1.00 51.25 H new ATOM 0 HB3 PHE A 70 -7.665 -1.747 -56.040 1.00 51.25 H new ATOM 0 HD1 PHE A 70 -7.394 -4.070 -56.972 1.00 54.02 H new ATOM 0 HD2 PHE A 70 -5.298 -2.783 -53.486 1.00 50.33 H new ATOM 0 HE1 PHE A 70 -6.940 -6.409 -56.378 1.00 42.20 H new ATOM 0 HE2 PHE A 70 -4.850 -5.123 -52.891 1.00 71.23 H new ATOM 0 HZ PHE A 70 -5.667 -6.940 -54.338 1.00 20.44 H new ATOM 1069 N GLN A 71 -7.047 0.553 -57.607 1.00 45.33 N ATOM 1070 CA GLN A 71 -7.443 1.941 -57.861 1.00 52.35 C ATOM 1071 C GLN A 71 -8.965 2.078 -57.845 1.00 12.44 C ATOM 1072 O GLN A 71 -9.677 1.232 -58.394 1.00 73.44 O ATOM 1073 CB GLN A 71 -6.897 2.430 -59.214 1.00 41.45 C ATOM 1074 CG GLN A 71 -5.374 2.405 -59.321 1.00 24.22 C ATOM 1075 CD GLN A 71 -4.870 2.920 -60.657 1.00 52.53 C ATOM 1076 OE1 GLN A 71 -4.718 2.160 -61.615 1.00 33.44 O ATOM 1077 NE2 GLN A 71 -4.597 4.212 -60.728 1.00 75.03 N ATOM 0 H GLN A 71 -7.654 -0.144 -58.039 1.00 45.33 H new ATOM 0 HA GLN A 71 -7.020 2.557 -57.067 1.00 52.35 H new ATOM 0 HB2 GLN A 71 -7.316 1.811 -60.007 1.00 41.45 H new ATOM 0 HB3 GLN A 71 -7.245 3.448 -59.387 1.00 41.45 H new ATOM 0 HG2 GLN A 71 -4.948 3.009 -58.520 1.00 24.22 H new ATOM 0 HG3 GLN A 71 -5.021 1.385 -59.173 1.00 24.22 H new ATOM 0 HE21 GLN A 71 -4.736 4.808 -59.912 1.00 75.03 H new ATOM 0 HE22 GLN A 71 -4.247 4.612 -61.599 1.00 75.03 H new ATOM 1086 N PHE A 72 -9.459 3.147 -57.225 1.00 73.33 N ATOM 1087 CA PHE A 72 -10.899 3.423 -57.188 1.00 2.55 C ATOM 1088 C PHE A 72 -11.138 4.907 -56.939 1.00 20.34 C ATOM 1089 O PHE A 72 -10.224 5.625 -56.549 1.00 61.22 O ATOM 1090 CB PHE A 72 -11.609 2.585 -56.105 1.00 25.13 C ATOM 1091 CG PHE A 72 -11.427 3.107 -54.699 1.00 43.44 C ATOM 1092 CD1 PHE A 72 -10.300 2.787 -53.961 1.00 1.40 C ATOM 1093 CD2 PHE A 72 -12.392 3.920 -54.117 1.00 73.40 C ATOM 1094 CE1 PHE A 72 -10.140 3.267 -52.676 1.00 5.31 C ATOM 1095 CE2 PHE A 72 -12.233 4.401 -52.834 1.00 1.11 C ATOM 1096 CZ PHE A 72 -11.106 4.075 -52.113 1.00 32.03 C ATOM 0 H PHE A 72 -8.886 3.838 -56.741 1.00 73.33 H new ATOM 0 HA PHE A 72 -11.318 3.144 -58.155 1.00 2.55 H new ATOM 0 HB2 PHE A 72 -12.675 2.547 -56.331 1.00 25.13 H new ATOM 0 HB3 PHE A 72 -11.237 1.562 -56.152 1.00 25.13 H new ATOM 0 HD1 PHE A 72 -9.538 2.156 -54.395 1.00 1.40 H new ATOM 0 HD2 PHE A 72 -13.279 4.179 -54.677 1.00 73.40 H new ATOM 0 HE1 PHE A 72 -9.257 3.009 -52.111 1.00 5.31 H new ATOM 0 HE2 PHE A 72 -12.991 5.033 -52.395 1.00 1.11 H new ATOM 0 HZ PHE A 72 -10.979 4.451 -51.109 1.00 32.03 H new ATOM 1106 N THR A 73 -12.363 5.360 -57.166 1.00 51.11 N ATOM 1107 CA THR A 73 -12.721 6.753 -56.931 1.00 1.20 C ATOM 1108 C THR A 73 -13.200 6.943 -55.493 1.00 62.13 C ATOM 1109 O THR A 73 -14.276 6.466 -55.121 1.00 74.23 O ATOM 1110 CB THR A 73 -13.822 7.220 -57.909 1.00 52.41 C ATOM 1111 OG1 THR A 73 -13.446 6.885 -59.252 1.00 54.54 O ATOM 1112 CG2 THR A 73 -14.055 8.728 -57.809 1.00 75.20 C ATOM 0 H THR A 73 -13.128 4.782 -57.514 1.00 51.11 H new ATOM 0 HA THR A 73 -11.830 7.357 -57.099 1.00 1.20 H new ATOM 0 HB THR A 73 -14.749 6.713 -57.641 1.00 52.41 H new ATOM 0 HG1 THR A 73 -14.035 6.179 -59.590 1.00 54.54 H new ATOM 0 HG21 THR A 73 -14.836 9.023 -58.510 1.00 75.20 H new ATOM 0 HG22 THR A 73 -14.363 8.982 -56.795 1.00 75.20 H new ATOM 0 HG23 THR A 73 -13.132 9.256 -58.050 1.00 75.20 H new ATOM 1120 N LEU A 74 -12.381 7.609 -54.682 1.00 41.42 N ATOM 1121 CA LEU A 74 -12.724 7.890 -53.293 1.00 2.01 C ATOM 1122 C LEU A 74 -13.971 8.767 -53.226 1.00 50.22 C ATOM 1123 O LEU A 74 -14.093 9.741 -53.974 1.00 44.43 O ATOM 1124 CB LEU A 74 -11.544 8.575 -52.579 1.00 4.02 C ATOM 1125 CG LEU A 74 -11.777 8.936 -51.099 1.00 75.13 C ATOM 1126 CD1 LEU A 74 -12.149 7.698 -50.288 1.00 51.31 C ATOM 1127 CD2 LEU A 74 -10.540 9.612 -50.507 1.00 40.31 C ATOM 0 H LEU A 74 -11.469 7.966 -54.967 1.00 41.42 H new ATOM 0 HA LEU A 74 -12.934 6.948 -52.786 1.00 2.01 H new ATOM 0 HB2 LEU A 74 -10.675 7.920 -52.642 1.00 4.02 H new ATOM 0 HB3 LEU A 74 -11.295 9.487 -53.122 1.00 4.02 H new ATOM 0 HG LEU A 74 -12.610 9.637 -51.051 1.00 75.13 H new ATOM 0 HD11 LEU A 74 -12.308 7.979 -49.247 1.00 51.31 H new ATOM 0 HD12 LEU A 74 -13.063 7.261 -50.690 1.00 51.31 H new ATOM 0 HD13 LEU A 74 -11.342 6.968 -50.347 1.00 51.31 H new ATOM 0 HD21 LEU A 74 -10.725 9.859 -49.462 1.00 40.31 H new ATOM 0 HD22 LEU A 74 -9.688 8.935 -50.575 1.00 40.31 H new ATOM 0 HD23 LEU A 74 -10.323 10.525 -51.062 1.00 40.31 H new ATOM 1139 N GLY A 75 -14.894 8.415 -52.338 1.00 21.12 N ATOM 1140 CA GLY A 75 -16.128 9.164 -52.198 1.00 51.53 C ATOM 1141 C GLY A 75 -17.101 8.891 -53.328 1.00 33.31 C ATOM 1142 O GLY A 75 -17.891 9.762 -53.699 1.00 41.10 O ATOM 0 H GLY A 75 -14.808 7.617 -51.708 1.00 21.12 H new ATOM 0 HA2 GLY A 75 -16.598 8.910 -51.248 1.00 51.53 H new ATOM 0 HA3 GLY A 75 -15.901 10.230 -52.167 1.00 51.53 H new ATOM 1146 N ALA A 76 -17.051 7.680 -53.876 1.00 23.41 N ATOM 1147 CA ALA A 76 -17.921 7.295 -54.982 1.00 10.02 C ATOM 1148 C ALA A 76 -18.468 5.885 -54.782 1.00 2.44 C ATOM 1149 O ALA A 76 -18.044 5.161 -53.876 1.00 74.43 O ATOM 1150 CB ALA A 76 -17.170 7.391 -56.308 1.00 13.12 C ATOM 0 H ALA A 76 -16.413 6.945 -53.570 1.00 23.41 H new ATOM 0 HA ALA A 76 -18.764 7.985 -55.006 1.00 10.02 H new ATOM 0 HB1 ALA A 76 -17.833 7.101 -57.123 1.00 13.12 H new ATOM 0 HB2 ALA A 76 -16.833 8.416 -56.462 1.00 13.12 H new ATOM 0 HB3 ALA A 76 -16.307 6.725 -56.287 1.00 13.12 H new ATOM 1156 N GLY A 77 -19.407 5.504 -55.639 1.00 45.30 N ATOM 1157 CA GLY A 77 -20.018 4.188 -55.566 1.00 54.35 C ATOM 1158 C GLY A 77 -19.171 3.121 -56.235 1.00 33.32 C ATOM 1159 O GLY A 77 -19.632 2.437 -57.154 1.00 54.41 O ATOM 0 H GLY A 77 -19.761 6.092 -56.394 1.00 45.30 H new ATOM 0 HA2 GLY A 77 -20.176 3.921 -54.521 1.00 54.35 H new ATOM 0 HA3 GLY A 77 -21.000 4.219 -56.039 1.00 54.35 H new ATOM 1163 N GLU A 78 -17.920 3.000 -55.796 1.00 32.55 N ATOM 1164 CA GLU A 78 -17.014 1.961 -56.293 1.00 75.44 C ATOM 1165 C GLU A 78 -16.572 1.045 -55.151 1.00 54.02 C ATOM 1166 O GLU A 78 -16.124 -0.076 -55.385 1.00 2.52 O ATOM 1167 CB GLU A 78 -15.797 2.586 -57.002 1.00 2.50 C ATOM 1168 CG GLU A 78 -16.151 3.242 -58.338 1.00 4.04 C ATOM 1169 CD GLU A 78 -14.962 3.876 -59.054 1.00 63.04 C ATOM 1170 OE1 GLU A 78 -13.806 3.463 -58.815 1.00 1.53 O ATOM 1171 OE2 GLU A 78 -15.180 4.799 -59.870 1.00 75.43 O ATOM 0 H GLU A 78 -17.506 3.612 -55.092 1.00 32.55 H new ATOM 0 HA GLU A 78 -17.552 1.358 -57.024 1.00 75.44 H new ATOM 0 HB2 GLU A 78 -15.346 3.331 -56.347 1.00 2.50 H new ATOM 0 HB3 GLU A 78 -15.047 1.814 -57.171 1.00 2.50 H new ATOM 0 HG2 GLU A 78 -16.598 2.493 -58.992 1.00 4.04 H new ATOM 0 HG3 GLU A 78 -16.908 4.007 -58.166 1.00 4.04 H new ATOM 1178 N VAL A 79 -16.719 1.523 -53.913 1.00 13.45 N ATOM 1179 CA VAL A 79 -16.381 0.732 -52.725 1.00 1.34 C ATOM 1180 C VAL A 79 -17.381 1.005 -51.604 1.00 20.50 C ATOM 1181 O VAL A 79 -18.115 1.998 -51.643 1.00 12.22 O ATOM 1182 CB VAL A 79 -14.954 1.038 -52.191 1.00 22.51 C ATOM 1183 CG1 VAL A 79 -13.886 0.704 -53.233 1.00 2.53 C ATOM 1184 CG2 VAL A 79 -14.851 2.497 -51.740 1.00 32.01 C ATOM 0 H VAL A 79 -17.071 2.458 -53.706 1.00 13.45 H new ATOM 0 HA VAL A 79 -16.419 -0.313 -53.031 1.00 1.34 H new ATOM 0 HB VAL A 79 -14.773 0.401 -51.325 1.00 22.51 H new ATOM 0 HG11 VAL A 79 -12.899 0.930 -52.828 1.00 2.53 H new ATOM 0 HG12 VAL A 79 -13.942 -0.355 -53.484 1.00 2.53 H new ATOM 0 HG13 VAL A 79 -14.055 1.299 -54.130 1.00 2.53 H new ATOM 0 HG21 VAL A 79 -13.845 2.693 -51.369 1.00 32.01 H new ATOM 0 HG22 VAL A 79 -15.061 3.154 -52.584 1.00 32.01 H new ATOM 0 HG23 VAL A 79 -15.573 2.684 -50.945 1.00 32.01 H new ATOM 1194 N ILE A 80 -17.412 0.111 -50.622 1.00 75.42 N ATOM 1195 CA ILE A 80 -18.222 0.298 -49.421 1.00 23.41 C ATOM 1196 C ILE A 80 -17.610 1.381 -48.529 1.00 60.52 C ATOM 1197 O ILE A 80 -16.389 1.579 -48.529 1.00 13.14 O ATOM 1198 CB ILE A 80 -18.347 -1.022 -48.615 1.00 73.33 C ATOM 1199 CG1 ILE A 80 -16.949 -1.596 -48.310 1.00 72.25 C ATOM 1200 CG2 ILE A 80 -19.204 -2.034 -49.376 1.00 24.01 C ATOM 1201 CD1 ILE A 80 -16.965 -2.923 -47.578 1.00 43.25 C ATOM 0 H ILE A 80 -16.880 -0.759 -50.634 1.00 75.42 H new ATOM 0 HA ILE A 80 -19.217 0.607 -49.740 1.00 23.41 H new ATOM 0 HB ILE A 80 -18.841 -0.810 -47.667 1.00 73.33 H new ATOM 0 HG12 ILE A 80 -16.407 -1.718 -49.248 1.00 72.25 H new ATOM 0 HG13 ILE A 80 -16.394 -0.872 -47.713 1.00 72.25 H new ATOM 0 HG21 ILE A 80 -19.281 -2.954 -48.797 1.00 24.01 H new ATOM 0 HG22 ILE A 80 -20.200 -1.621 -49.535 1.00 24.01 H new ATOM 0 HG23 ILE A 80 -18.743 -2.250 -50.340 1.00 24.01 H new ATOM 0 HD11 ILE A 80 -15.941 -3.255 -47.404 1.00 43.25 H new ATOM 0 HD12 ILE A 80 -17.476 -2.805 -46.622 1.00 43.25 H new ATOM 0 HD13 ILE A 80 -17.489 -3.665 -48.181 1.00 43.25 H new ATOM 1213 N LYS A 81 -18.457 2.067 -47.762 1.00 23.20 N ATOM 1214 CA LYS A 81 -18.005 3.162 -46.901 1.00 11.25 C ATOM 1215 C LYS A 81 -16.988 2.700 -45.861 1.00 2.21 C ATOM 1216 O LYS A 81 -16.304 3.525 -45.255 1.00 14.32 O ATOM 1217 CB LYS A 81 -19.197 3.862 -46.227 1.00 0.11 C ATOM 1218 CG LYS A 81 -19.822 4.946 -47.101 1.00 41.11 C ATOM 1219 CD LYS A 81 -18.821 6.069 -47.387 1.00 62.14 C ATOM 1220 CE LYS A 81 -19.342 7.069 -48.414 1.00 73.31 C ATOM 1221 NZ LYS A 81 -18.350 8.146 -48.687 1.00 30.33 N ATOM 0 H LYS A 81 -19.460 1.885 -47.719 1.00 23.20 H new ATOM 0 HA LYS A 81 -17.500 3.882 -47.544 1.00 11.25 H new ATOM 0 HB2 LYS A 81 -19.956 3.119 -45.980 1.00 0.11 H new ATOM 0 HB3 LYS A 81 -18.867 4.305 -45.287 1.00 0.11 H new ATOM 0 HG2 LYS A 81 -20.161 4.509 -48.040 1.00 41.11 H new ATOM 0 HG3 LYS A 81 -20.701 5.356 -46.604 1.00 41.11 H new ATOM 0 HD2 LYS A 81 -18.592 6.592 -46.459 1.00 62.14 H new ATOM 0 HD3 LYS A 81 -17.888 5.636 -47.747 1.00 62.14 H new ATOM 0 HE2 LYS A 81 -19.578 6.548 -49.342 1.00 73.31 H new ATOM 0 HE3 LYS A 81 -20.270 7.512 -48.052 1.00 73.31 H new ATOM 0 HZ1 LYS A 81 -18.271 8.294 -49.713 1.00 30.33 H new ATOM 0 HZ2 LYS A 81 -18.662 9.028 -48.233 1.00 30.33 H new ATOM 0 HZ3 LYS A 81 -17.423 7.869 -48.305 1.00 30.33 H new ATOM 1235 N GLY A 82 -16.892 1.393 -45.647 1.00 34.43 N ATOM 1236 CA GLY A 82 -15.852 0.868 -44.781 1.00 31.53 C ATOM 1237 C GLY A 82 -14.470 1.209 -45.311 1.00 11.44 C ATOM 1238 O GLY A 82 -13.690 1.911 -44.655 1.00 11.05 O ATOM 0 H GLY A 82 -17.511 0.691 -46.054 1.00 34.43 H new ATOM 0 HA2 GLY A 82 -15.970 1.277 -43.778 1.00 31.53 H new ATOM 0 HA3 GLY A 82 -15.956 -0.214 -44.699 1.00 31.53 H new ATOM 1242 N TRP A 83 -14.182 0.736 -46.521 1.00 20.04 N ATOM 1243 CA TRP A 83 -12.898 0.990 -47.166 1.00 54.32 C ATOM 1244 C TRP A 83 -12.763 2.469 -47.498 1.00 71.34 C ATOM 1245 O TRP A 83 -11.688 3.054 -47.347 1.00 52.20 O ATOM 1246 CB TRP A 83 -12.760 0.153 -48.447 1.00 1.15 C ATOM 1247 CG TRP A 83 -12.908 -1.324 -48.226 1.00 60.24 C ATOM 1248 CD1 TRP A 83 -12.545 -2.029 -47.114 1.00 62.11 C ATOM 1249 CD2 TRP A 83 -13.446 -2.280 -49.148 1.00 23.23 C ATOM 1250 NE1 TRP A 83 -12.839 -3.359 -47.283 1.00 5.04 N ATOM 1251 CE2 TRP A 83 -13.386 -3.540 -48.525 1.00 4.34 C ATOM 1252 CE3 TRP A 83 -13.970 -2.191 -50.441 1.00 42.12 C ATOM 1253 CZ2 TRP A 83 -13.840 -4.702 -49.147 1.00 13.44 C ATOM 1254 CZ3 TRP A 83 -14.418 -3.345 -51.059 1.00 3.14 C ATOM 1255 CH2 TRP A 83 -14.349 -4.585 -50.413 1.00 54.32 C ATOM 0 H TRP A 83 -14.825 0.172 -47.077 1.00 20.04 H new ATOM 0 HA TRP A 83 -12.104 0.704 -46.476 1.00 54.32 H new ATOM 0 HB2 TRP A 83 -13.511 0.480 -49.166 1.00 1.15 H new ATOM 0 HB3 TRP A 83 -11.785 0.348 -48.894 1.00 1.15 H new ATOM 0 HD1 TRP A 83 -12.093 -1.602 -46.231 1.00 62.11 H new ATOM 0 HE1 TRP A 83 -12.676 -4.094 -46.595 1.00 5.04 H new ATOM 0 HE3 TRP A 83 -14.024 -1.239 -50.948 1.00 42.12 H new ATOM 0 HZ2 TRP A 83 -13.792 -5.659 -48.649 1.00 13.44 H new ATOM 0 HZ3 TRP A 83 -14.828 -3.288 -52.057 1.00 3.14 H new ATOM 0 HH2 TRP A 83 -14.705 -5.468 -50.924 1.00 54.32 H new ATOM 1266 N ASP A 84 -13.870 3.060 -47.946 1.00 72.43 N ATOM 1267 CA ASP A 84 -13.915 4.478 -48.304 1.00 32.24 C ATOM 1268 C ASP A 84 -13.374 5.340 -47.161 1.00 32.32 C ATOM 1269 O ASP A 84 -12.429 6.111 -47.339 1.00 11.55 O ATOM 1270 CB ASP A 84 -15.361 4.873 -48.637 1.00 51.14 C ATOM 1271 CG ASP A 84 -15.513 6.322 -49.079 1.00 24.20 C ATOM 1272 OD1 ASP A 84 -15.363 6.596 -50.283 1.00 41.55 O ATOM 1273 OD2 ASP A 84 -15.822 7.184 -48.228 1.00 3.24 O ATOM 0 H ASP A 84 -14.757 2.572 -48.071 1.00 72.43 H new ATOM 0 HA ASP A 84 -13.286 4.646 -49.178 1.00 32.24 H new ATOM 0 HB2 ASP A 84 -15.734 4.221 -49.426 1.00 51.14 H new ATOM 0 HB3 ASP A 84 -15.986 4.702 -47.760 1.00 51.14 H new ATOM 1278 N GLN A 85 -13.955 5.170 -45.975 1.00 53.44 N ATOM 1279 CA GLN A 85 -13.521 5.911 -44.793 1.00 73.31 C ATOM 1280 C GLN A 85 -12.125 5.464 -44.364 1.00 50.41 C ATOM 1281 O GLN A 85 -11.307 6.281 -43.922 1.00 43.23 O ATOM 1282 CB GLN A 85 -14.518 5.722 -43.644 1.00 11.22 C ATOM 1283 CG GLN A 85 -15.904 6.274 -43.944 1.00 25.14 C ATOM 1284 CD GLN A 85 -16.895 6.005 -42.825 1.00 22.14 C ATOM 1285 OE1 GLN A 85 -17.047 6.808 -41.903 1.00 20.15 O ATOM 1286 NE2 GLN A 85 -17.567 4.865 -42.894 1.00 2.41 N ATOM 0 H GLN A 85 -14.728 4.525 -45.807 1.00 53.44 H new ATOM 0 HA GLN A 85 -13.483 6.970 -45.047 1.00 73.31 H new ATOM 0 HB2 GLN A 85 -14.601 4.659 -43.417 1.00 11.22 H new ATOM 0 HB3 GLN A 85 -14.127 6.210 -42.751 1.00 11.22 H new ATOM 0 HG2 GLN A 85 -15.834 7.349 -44.112 1.00 25.14 H new ATOM 0 HG3 GLN A 85 -16.276 5.830 -44.868 1.00 25.14 H new ATOM 0 HE21 GLN A 85 -17.411 4.228 -43.675 1.00 2.41 H new ATOM 0 HE22 GLN A 85 -18.240 4.625 -42.166 1.00 2.41 H new ATOM 1295 N GLY A 86 -11.862 4.164 -44.509 1.00 70.40 N ATOM 1296 CA GLY A 86 -10.561 3.614 -44.166 1.00 62.34 C ATOM 1297 C GLY A 86 -9.418 4.362 -44.833 1.00 13.43 C ATOM 1298 O GLY A 86 -8.487 4.814 -44.164 1.00 1.43 O ATOM 0 H GLY A 86 -12.532 3.480 -44.860 1.00 70.40 H new ATOM 0 HA2 GLY A 86 -10.430 3.647 -43.084 1.00 62.34 H new ATOM 0 HA3 GLY A 86 -10.525 2.565 -44.460 1.00 62.34 H new ATOM 1302 N VAL A 87 -9.488 4.500 -46.153 1.00 54.13 N ATOM 1303 CA VAL A 87 -8.475 5.243 -46.896 1.00 50.24 C ATOM 1304 C VAL A 87 -8.654 6.752 -46.713 1.00 54.40 C ATOM 1305 O VAL A 87 -7.683 7.507 -46.731 1.00 10.11 O ATOM 1306 CB VAL A 87 -8.492 4.889 -48.404 1.00 55.44 C ATOM 1307 CG1 VAL A 87 -8.214 3.402 -48.619 1.00 34.31 C ATOM 1308 CG2 VAL A 87 -9.816 5.293 -49.045 1.00 62.31 C ATOM 0 H VAL A 87 -10.233 4.109 -46.729 1.00 54.13 H new ATOM 0 HA VAL A 87 -7.507 4.950 -46.490 1.00 50.24 H new ATOM 0 HB VAL A 87 -7.697 5.454 -48.890 1.00 55.44 H new ATOM 0 HG11 VAL A 87 -8.231 3.179 -49.686 1.00 34.31 H new ATOM 0 HG12 VAL A 87 -7.234 3.153 -48.212 1.00 34.31 H new ATOM 0 HG13 VAL A 87 -8.978 2.812 -48.113 1.00 34.31 H new ATOM 0 HG21 VAL A 87 -9.802 5.034 -50.104 1.00 62.31 H new ATOM 0 HG22 VAL A 87 -10.634 4.766 -48.553 1.00 62.31 H new ATOM 0 HG23 VAL A 87 -9.960 6.368 -48.937 1.00 62.31 H new ATOM 1318 N ALA A 88 -9.898 7.191 -46.524 1.00 43.42 N ATOM 1319 CA ALA A 88 -10.189 8.615 -46.351 1.00 63.54 C ATOM 1320 C ALA A 88 -9.599 9.168 -45.051 1.00 61.41 C ATOM 1321 O ALA A 88 -9.318 10.366 -44.953 1.00 62.12 O ATOM 1322 CB ALA A 88 -11.693 8.862 -46.395 1.00 72.34 C ATOM 0 H ALA A 88 -10.717 6.585 -46.487 1.00 43.42 H new ATOM 0 HA ALA A 88 -9.715 9.145 -47.178 1.00 63.54 H new ATOM 0 HB1 ALA A 88 -11.891 9.926 -46.265 1.00 72.34 H new ATOM 0 HB2 ALA A 88 -12.087 8.535 -47.357 1.00 72.34 H new ATOM 0 HB3 ALA A 88 -12.177 8.302 -45.595 1.00 72.34 H new ATOM 1328 N THR A 89 -9.416 8.302 -44.057 1.00 71.10 N ATOM 1329 CA THR A 89 -8.925 8.733 -42.746 1.00 21.14 C ATOM 1330 C THR A 89 -7.387 8.736 -42.682 1.00 72.32 C ATOM 1331 O THR A 89 -6.808 9.072 -41.643 1.00 61.43 O ATOM 1332 CB THR A 89 -9.505 7.847 -41.606 1.00 10.23 C ATOM 1333 OG1 THR A 89 -9.250 8.445 -40.322 1.00 70.41 O ATOM 1334 CG2 THR A 89 -8.917 6.440 -41.632 1.00 23.35 C ATOM 0 H THR A 89 -9.599 7.301 -44.131 1.00 71.10 H new ATOM 0 HA THR A 89 -9.271 9.757 -42.603 1.00 21.14 H new ATOM 0 HB THR A 89 -10.580 7.775 -41.770 1.00 10.23 H new ATOM 0 HG1 THR A 89 -8.365 8.866 -40.327 1.00 70.41 H new ATOM 0 HG21 THR A 89 -9.346 5.851 -40.821 1.00 23.35 H new ATOM 0 HG22 THR A 89 -9.148 5.967 -42.586 1.00 23.35 H new ATOM 0 HG23 THR A 89 -7.836 6.495 -41.507 1.00 23.35 H new ATOM 1342 N MET A 90 -6.722 8.378 -43.784 1.00 23.21 N ATOM 1343 CA MET A 90 -5.251 8.371 -43.826 1.00 52.35 C ATOM 1344 C MET A 90 -4.723 9.453 -44.769 1.00 34.44 C ATOM 1345 O MET A 90 -5.492 10.255 -45.305 1.00 64.34 O ATOM 1346 CB MET A 90 -4.715 6.999 -44.257 1.00 2.44 C ATOM 1347 CG MET A 90 -5.040 6.623 -45.697 1.00 20.52 C ATOM 1348 SD MET A 90 -4.258 5.080 -46.201 1.00 33.02 S ATOM 1349 CE MET A 90 -4.813 3.982 -44.903 1.00 71.33 C ATOM 0 H MET A 90 -7.171 8.091 -44.654 1.00 23.21 H new ATOM 0 HA MET A 90 -4.897 8.582 -42.817 1.00 52.35 H new ATOM 0 HB2 MET A 90 -3.633 6.987 -44.126 1.00 2.44 H new ATOM 0 HB3 MET A 90 -5.125 6.237 -43.594 1.00 2.44 H new ATOM 0 HG2 MET A 90 -6.120 6.533 -45.811 1.00 20.52 H new ATOM 0 HG3 MET A 90 -4.715 7.425 -46.360 1.00 20.52 H new ATOM 0 HE1 MET A 90 -4.500 2.963 -45.130 1.00 71.33 H new ATOM 0 HE2 MET A 90 -4.377 4.292 -43.953 1.00 71.33 H new ATOM 0 HE3 MET A 90 -5.900 4.021 -44.833 1.00 71.33 H new ATOM 1359 N THR A 91 -3.406 9.471 -44.965 1.00 54.53 N ATOM 1360 CA THR A 91 -2.762 10.452 -45.834 1.00 60.53 C ATOM 1361 C THR A 91 -1.974 9.763 -46.954 1.00 4.54 C ATOM 1362 O THR A 91 -1.944 8.535 -47.040 1.00 62.15 O ATOM 1363 CB THR A 91 -1.832 11.389 -45.026 1.00 2.34 C ATOM 1364 OG1 THR A 91 -0.885 10.621 -44.271 1.00 75.53 O ATOM 1365 CG2 THR A 91 -2.634 12.274 -44.078 1.00 54.53 C ATOM 0 H THR A 91 -2.761 8.812 -44.530 1.00 54.53 H new ATOM 0 HA THR A 91 -3.550 11.055 -46.286 1.00 60.53 H new ATOM 0 HB THR A 91 -1.303 12.025 -45.736 1.00 2.34 H new ATOM 0 HG1 THR A 91 -0.995 10.813 -43.316 1.00 75.53 H new ATOM 0 HG21 THR A 91 -1.955 12.922 -43.523 1.00 54.53 H new ATOM 0 HG22 THR A 91 -3.330 12.885 -44.652 1.00 54.53 H new ATOM 0 HG23 THR A 91 -3.190 11.649 -43.380 1.00 54.53 H new ATOM 1373 N LEU A 92 -1.362 10.571 -47.820 1.00 74.01 N ATOM 1374 CA LEU A 92 -0.598 10.072 -48.968 1.00 25.41 C ATOM 1375 C LEU A 92 0.573 9.191 -48.499 1.00 32.24 C ATOM 1376 O LEU A 92 1.357 9.600 -47.636 1.00 31.23 O ATOM 1377 CB LEU A 92 -0.072 11.270 -49.797 1.00 14.43 C ATOM 1378 CG LEU A 92 0.138 11.034 -51.312 1.00 74.12 C ATOM 1379 CD1 LEU A 92 1.132 9.905 -51.581 1.00 1.01 C ATOM 1380 CD2 LEU A 92 -1.195 10.758 -52.004 1.00 24.41 C ATOM 0 H LEU A 92 -1.381 11.588 -47.747 1.00 74.01 H new ATOM 0 HA LEU A 92 -1.252 9.462 -49.591 1.00 25.41 H new ATOM 0 HB2 LEU A 92 -0.770 12.099 -49.676 1.00 14.43 H new ATOM 0 HB3 LEU A 92 0.878 11.588 -49.368 1.00 14.43 H new ATOM 0 HG LEU A 92 0.564 11.947 -51.728 1.00 74.12 H new ATOM 0 HD11 LEU A 92 1.250 9.773 -52.656 1.00 1.01 H new ATOM 0 HD12 LEU A 92 2.096 10.156 -51.138 1.00 1.01 H new ATOM 0 HD13 LEU A 92 0.760 8.980 -51.140 1.00 1.01 H new ATOM 0 HD21 LEU A 92 -1.026 10.595 -53.068 1.00 24.41 H new ATOM 0 HD22 LEU A 92 -1.654 9.870 -51.569 1.00 24.41 H new ATOM 0 HD23 LEU A 92 -1.859 11.612 -51.869 1.00 24.41 H new ATOM 1392 N GLY A 93 0.675 7.982 -49.063 1.00 34.21 N ATOM 1393 CA GLY A 93 1.788 7.092 -48.763 1.00 5.55 C ATOM 1394 C GLY A 93 1.710 6.521 -47.362 1.00 72.25 C ATOM 1395 O GLY A 93 2.734 6.317 -46.701 1.00 64.11 O ATOM 0 H GLY A 93 -0.001 7.604 -49.727 1.00 34.21 H new ATOM 0 HA2 GLY A 93 1.801 6.275 -49.485 1.00 5.55 H new ATOM 0 HA3 GLY A 93 2.726 7.635 -48.879 1.00 5.55 H new ATOM 1399 N GLU A 94 0.490 6.251 -46.915 1.00 71.34 N ATOM 1400 CA GLU A 94 0.246 5.785 -45.553 1.00 13.03 C ATOM 1401 C GLU A 94 -0.598 4.513 -45.571 1.00 35.11 C ATOM 1402 O GLU A 94 -1.396 4.301 -46.486 1.00 11.33 O ATOM 1403 CB GLU A 94 -0.448 6.901 -44.755 1.00 33.44 C ATOM 1404 CG GLU A 94 -0.637 6.604 -43.271 1.00 42.11 C ATOM 1405 CD GLU A 94 -0.925 7.862 -42.464 1.00 1.35 C ATOM 1406 OE1 GLU A 94 -2.041 8.411 -42.580 1.00 22.02 O ATOM 1407 OE2 GLU A 94 -0.030 8.314 -41.716 1.00 1.51 O ATOM 0 H GLU A 94 -0.353 6.347 -47.480 1.00 71.34 H new ATOM 0 HA GLU A 94 1.194 5.545 -45.071 1.00 13.03 H new ATOM 0 HB2 GLU A 94 0.134 7.817 -44.856 1.00 33.44 H new ATOM 0 HB3 GLU A 94 -1.424 7.093 -45.200 1.00 33.44 H new ATOM 0 HG2 GLU A 94 -1.458 5.898 -43.145 1.00 42.11 H new ATOM 0 HG3 GLU A 94 0.260 6.122 -42.882 1.00 42.11 H new ATOM 1414 N LYS A 95 -0.408 3.662 -44.565 1.00 63.35 N ATOM 1415 CA LYS A 95 -1.160 2.414 -44.456 1.00 74.54 C ATOM 1416 C LYS A 95 -1.689 2.228 -43.044 1.00 2.34 C ATOM 1417 O LYS A 95 -0.987 2.491 -42.063 1.00 24.43 O ATOM 1418 CB LYS A 95 -0.295 1.206 -44.854 1.00 62.30 C ATOM 1419 CG LYS A 95 -0.998 -0.145 -44.674 1.00 64.33 C ATOM 1420 CD LYS A 95 -0.276 -1.300 -45.380 1.00 65.41 C ATOM 1421 CE LYS A 95 1.135 -1.546 -44.845 1.00 1.24 C ATOM 1422 NZ LYS A 95 2.098 -0.497 -45.280 1.00 21.52 N ATOM 0 H LYS A 95 0.262 3.815 -43.812 1.00 63.35 H new ATOM 0 HA LYS A 95 -2.002 2.476 -45.145 1.00 74.54 H new ATOM 0 HB2 LYS A 95 0.004 1.313 -45.897 1.00 62.30 H new ATOM 0 HB3 LYS A 95 0.618 1.212 -44.258 1.00 62.30 H new ATOM 0 HG2 LYS A 95 -1.074 -0.369 -43.610 1.00 64.33 H new ATOM 0 HG3 LYS A 95 -2.015 -0.072 -45.058 1.00 64.33 H new ATOM 0 HD2 LYS A 95 -0.864 -2.211 -45.267 1.00 65.41 H new ATOM 0 HD3 LYS A 95 -0.221 -1.087 -46.448 1.00 65.41 H new ATOM 0 HE2 LYS A 95 1.107 -1.580 -43.756 1.00 1.24 H new ATOM 0 HE3 LYS A 95 1.485 -2.520 -45.186 1.00 1.24 H new ATOM 0 HZ1 LYS A 95 2.915 -0.946 -45.741 1.00 21.52 H new ATOM 0 HZ2 LYS A 95 1.631 0.146 -45.951 1.00 21.52 H new ATOM 0 HZ3 LYS A 95 2.421 0.043 -44.452 1.00 21.52 H new ATOM 1436 N ALA A 96 -2.923 1.759 -42.949 1.00 20.50 N ATOM 1437 CA ALA A 96 -3.564 1.524 -41.670 1.00 55.24 C ATOM 1438 C ALA A 96 -4.333 0.208 -41.688 1.00 22.35 C ATOM 1439 O ALA A 96 -4.903 -0.181 -42.710 1.00 52.31 O ATOM 1440 CB ALA A 96 -4.496 2.681 -41.321 1.00 14.21 C ATOM 0 H ALA A 96 -3.505 1.532 -43.755 1.00 20.50 H new ATOM 0 HA ALA A 96 -2.790 1.459 -40.905 1.00 55.24 H new ATOM 0 HB1 ALA A 96 -4.969 2.489 -40.358 1.00 14.21 H new ATOM 0 HB2 ALA A 96 -3.922 3.606 -41.265 1.00 14.21 H new ATOM 0 HB3 ALA A 96 -5.263 2.775 -42.090 1.00 14.21 H new ATOM 1446 N LEU A 97 -4.339 -0.463 -40.550 1.00 62.33 N ATOM 1447 CA LEU A 97 -5.120 -1.668 -40.359 1.00 4.54 C ATOM 1448 C LEU A 97 -6.481 -1.246 -39.828 1.00 23.15 C ATOM 1449 O LEU A 97 -6.606 -0.823 -38.676 1.00 2.53 O ATOM 1450 CB LEU A 97 -4.381 -2.602 -39.376 1.00 62.35 C ATOM 1451 CG LEU A 97 -5.092 -3.920 -38.997 1.00 23.42 C ATOM 1452 CD1 LEU A 97 -4.070 -5.004 -38.649 1.00 52.33 C ATOM 1453 CD2 LEU A 97 -6.045 -3.711 -37.818 1.00 12.41 C ATOM 0 H LEU A 97 -3.800 -0.185 -39.730 1.00 62.33 H new ATOM 0 HA LEU A 97 -5.254 -2.218 -41.290 1.00 4.54 H new ATOM 0 HB2 LEU A 97 -3.412 -2.851 -39.808 1.00 62.35 H new ATOM 0 HB3 LEU A 97 -4.187 -2.045 -38.459 1.00 62.35 H new ATOM 0 HG LEU A 97 -5.673 -4.243 -39.861 1.00 23.42 H new ATOM 0 HD11 LEU A 97 -4.591 -5.924 -38.385 1.00 52.33 H new ATOM 0 HD12 LEU A 97 -3.426 -5.186 -39.509 1.00 52.33 H new ATOM 0 HD13 LEU A 97 -3.464 -4.675 -37.805 1.00 52.33 H new ATOM 0 HD21 LEU A 97 -6.532 -4.655 -37.572 1.00 12.41 H new ATOM 0 HD22 LEU A 97 -5.483 -3.357 -36.954 1.00 12.41 H new ATOM 0 HD23 LEU A 97 -6.800 -2.972 -38.087 1.00 12.41 H new ATOM 1465 N PHE A 98 -7.487 -1.307 -40.694 1.00 33.43 N ATOM 1466 CA PHE A 98 -8.802 -0.769 -40.382 1.00 22.33 C ATOM 1467 C PHE A 98 -9.811 -1.904 -40.242 1.00 65.01 C ATOM 1468 O PHE A 98 -10.095 -2.623 -41.204 1.00 52.24 O ATOM 1469 CB PHE A 98 -9.232 0.212 -41.489 1.00 14.23 C ATOM 1470 CG PHE A 98 -10.306 1.196 -41.073 1.00 54.22 C ATOM 1471 CD1 PHE A 98 -9.965 2.423 -40.514 1.00 54.43 C ATOM 1472 CD2 PHE A 98 -11.650 0.902 -41.250 1.00 1.45 C ATOM 1473 CE1 PHE A 98 -10.942 3.329 -40.143 1.00 53.50 C ATOM 1474 CE2 PHE A 98 -12.629 1.806 -40.879 1.00 61.40 C ATOM 1475 CZ PHE A 98 -12.275 3.019 -40.326 1.00 43.13 C ATOM 0 H PHE A 98 -7.414 -1.726 -41.621 1.00 33.43 H new ATOM 0 HA PHE A 98 -8.761 -0.232 -39.435 1.00 22.33 H new ATOM 0 HB2 PHE A 98 -8.357 0.769 -41.824 1.00 14.23 H new ATOM 0 HB3 PHE A 98 -9.592 -0.360 -42.344 1.00 14.23 H new ATOM 0 HD1 PHE A 98 -8.924 2.671 -40.368 1.00 54.43 H new ATOM 0 HD2 PHE A 98 -11.936 -0.045 -41.683 1.00 1.45 H new ATOM 0 HE1 PHE A 98 -10.662 4.278 -39.710 1.00 53.50 H new ATOM 0 HE2 PHE A 98 -13.671 1.562 -41.022 1.00 61.40 H new ATOM 0 HZ PHE A 98 -13.039 3.725 -40.037 1.00 43.13 H new ATOM 1485 N THR A 99 -10.323 -2.085 -39.035 1.00 0.52 N ATOM 1486 CA THR A 99 -11.310 -3.120 -38.773 1.00 41.40 C ATOM 1487 C THR A 99 -12.674 -2.694 -39.317 1.00 32.20 C ATOM 1488 O THR A 99 -13.322 -1.805 -38.764 1.00 23.33 O ATOM 1489 CB THR A 99 -11.406 -3.409 -37.262 1.00 71.14 C ATOM 1490 OG1 THR A 99 -10.089 -3.586 -36.723 1.00 32.31 O ATOM 1491 CG2 THR A 99 -12.235 -4.656 -36.985 1.00 45.34 C ATOM 0 H THR A 99 -10.070 -1.527 -38.219 1.00 0.52 H new ATOM 0 HA THR A 99 -10.997 -4.033 -39.278 1.00 41.40 H new ATOM 0 HB THR A 99 -11.897 -2.560 -36.787 1.00 71.14 H new ATOM 0 HG1 THR A 99 -9.606 -2.734 -36.753 1.00 32.31 H new ATOM 0 HG21 THR A 99 -12.282 -4.830 -35.910 1.00 45.34 H new ATOM 0 HG22 THR A 99 -13.243 -4.516 -37.374 1.00 45.34 H new ATOM 0 HG23 THR A 99 -11.774 -5.515 -37.472 1.00 45.34 H new ATOM 1499 N ILE A 100 -13.084 -3.316 -40.416 1.00 21.32 N ATOM 1500 CA ILE A 100 -14.336 -2.981 -41.081 1.00 55.40 C ATOM 1501 C ILE A 100 -15.517 -3.652 -40.374 1.00 14.24 C ATOM 1502 O ILE A 100 -15.616 -4.891 -40.352 1.00 1.33 O ATOM 1503 CB ILE A 100 -14.320 -3.424 -42.568 1.00 12.11 C ATOM 1504 CG1 ILE A 100 -13.088 -2.860 -43.293 1.00 60.11 C ATOM 1505 CG2 ILE A 100 -15.603 -2.989 -43.276 1.00 11.45 C ATOM 1506 CD1 ILE A 100 -13.068 -1.351 -43.398 1.00 2.12 C ATOM 0 H ILE A 100 -12.560 -4.064 -40.869 1.00 21.32 H new ATOM 0 HA ILE A 100 -14.448 -1.898 -41.035 1.00 55.40 H new ATOM 0 HB ILE A 100 -14.264 -4.512 -42.595 1.00 12.11 H new ATOM 0 HG12 ILE A 100 -12.190 -3.189 -42.770 1.00 60.11 H new ATOM 0 HG13 ILE A 100 -13.045 -3.284 -44.296 1.00 60.11 H new ATOM 0 HG21 ILE A 100 -15.571 -3.310 -44.317 1.00 11.45 H new ATOM 0 HG22 ILE A 100 -16.463 -3.443 -42.783 1.00 11.45 H new ATOM 0 HG23 ILE A 100 -15.692 -1.903 -43.233 1.00 11.45 H new ATOM 0 HD11 ILE A 100 -12.166 -1.035 -43.923 1.00 2.12 H new ATOM 0 HD12 ILE A 100 -13.946 -1.013 -43.949 1.00 2.12 H new ATOM 0 HD13 ILE A 100 -13.077 -0.917 -42.398 1.00 2.12 H new ATOM 1518 N PRO A 101 -16.414 -2.845 -39.768 1.00 5.44 N ATOM 1519 CA PRO A 101 -17.605 -3.354 -39.084 1.00 42.13 C ATOM 1520 C PRO A 101 -18.591 -4.001 -40.056 1.00 14.34 C ATOM 1521 O PRO A 101 -18.695 -3.592 -41.216 1.00 14.05 O ATOM 1522 CB PRO A 101 -18.228 -2.101 -38.433 1.00 51.24 C ATOM 1523 CG PRO A 101 -17.151 -1.067 -38.469 1.00 0.42 C ATOM 1524 CD PRO A 101 -16.331 -1.376 -39.688 1.00 24.24 C ATOM 0 HA PRO A 101 -17.356 -4.133 -38.363 1.00 42.13 H new ATOM 0 HB2 PRO A 101 -19.111 -1.770 -38.980 1.00 51.24 H new ATOM 0 HB3 PRO A 101 -18.545 -2.305 -37.410 1.00 51.24 H new ATOM 0 HG2 PRO A 101 -17.573 -0.064 -38.525 1.00 0.42 H new ATOM 0 HG3 PRO A 101 -16.541 -1.106 -37.567 1.00 0.42 H new ATOM 0 HD2 PRO A 101 -16.735 -0.898 -40.580 1.00 24.24 H new ATOM 0 HD3 PRO A 101 -15.302 -1.033 -39.582 1.00 24.24 H new ATOM 1532 N TYR A 102 -19.332 -4.987 -39.557 1.00 62.24 N ATOM 1533 CA TYR A 102 -20.309 -5.728 -40.358 1.00 42.32 C ATOM 1534 C TYR A 102 -21.307 -4.783 -41.032 1.00 55.45 C ATOM 1535 O TYR A 102 -21.796 -5.065 -42.125 1.00 63.25 O ATOM 1536 CB TYR A 102 -21.059 -6.734 -39.466 1.00 22.34 C ATOM 1537 CG TYR A 102 -21.769 -6.095 -38.282 1.00 74.23 C ATOM 1538 CD1 TYR A 102 -21.055 -5.698 -37.154 1.00 34.34 C ATOM 1539 CD2 TYR A 102 -23.145 -5.873 -38.293 1.00 52.43 C ATOM 1540 CE1 TYR A 102 -21.685 -5.098 -36.083 1.00 44.51 C ATOM 1541 CE2 TYR A 102 -23.781 -5.277 -37.221 1.00 11.43 C ATOM 1542 CZ TYR A 102 -23.046 -4.889 -36.119 1.00 3.53 C ATOM 1543 OH TYR A 102 -23.668 -4.277 -35.055 1.00 60.43 O ATOM 0 H TYR A 102 -19.274 -5.297 -38.587 1.00 62.24 H new ATOM 0 HA TYR A 102 -19.771 -6.264 -41.140 1.00 42.32 H new ATOM 0 HB2 TYR A 102 -21.791 -7.267 -40.072 1.00 22.34 H new ATOM 0 HB3 TYR A 102 -20.351 -7.476 -39.096 1.00 22.34 H new ATOM 0 HD1 TYR A 102 -19.988 -5.863 -37.117 1.00 34.34 H new ATOM 0 HD2 TYR A 102 -23.724 -6.172 -39.154 1.00 52.43 H new ATOM 0 HE1 TYR A 102 -21.113 -4.793 -35.219 1.00 44.51 H new ATOM 0 HE2 TYR A 102 -24.849 -5.115 -37.245 1.00 11.43 H new ATOM 0 HH TYR A 102 -24.628 -4.203 -35.236 1.00 60.43 H new ATOM 1553 N GLN A 103 -21.577 -3.655 -40.379 1.00 54.01 N ATOM 1554 CA GLN A 103 -22.515 -2.658 -40.894 1.00 73.14 C ATOM 1555 C GLN A 103 -21.998 -2.020 -42.186 1.00 73.11 C ATOM 1556 O GLN A 103 -22.772 -1.717 -43.097 1.00 64.20 O ATOM 1557 CB GLN A 103 -22.749 -1.559 -39.847 1.00 20.21 C ATOM 1558 CG GLN A 103 -23.333 -2.064 -38.532 1.00 52.32 C ATOM 1559 CD GLN A 103 -23.462 -0.969 -37.484 1.00 12.35 C ATOM 1560 OE1 GLN A 103 -22.679 -0.019 -37.460 1.00 44.32 O ATOM 1561 NE2 GLN A 103 -24.448 -1.098 -36.610 1.00 41.41 N ATOM 0 H GLN A 103 -21.156 -3.406 -39.484 1.00 54.01 H new ATOM 0 HA GLN A 103 -23.453 -3.169 -41.109 1.00 73.14 H new ATOM 0 HB2 GLN A 103 -21.802 -1.059 -39.643 1.00 20.21 H new ATOM 0 HB3 GLN A 103 -23.421 -0.810 -40.266 1.00 20.21 H new ATOM 0 HG2 GLN A 103 -24.315 -2.499 -38.719 1.00 52.32 H new ATOM 0 HG3 GLN A 103 -22.701 -2.861 -38.142 1.00 52.32 H new ATOM 0 HE21 GLN A 103 -25.076 -1.900 -36.664 1.00 41.41 H new ATOM 0 HE22 GLN A 103 -24.580 -0.395 -35.883 1.00 41.41 H new ATOM 1570 N LEU A 104 -20.685 -1.828 -42.262 1.00 62.14 N ATOM 1571 CA LEU A 104 -20.074 -1.093 -43.369 1.00 32.30 C ATOM 1572 C LEU A 104 -19.479 -2.048 -44.397 1.00 63.52 C ATOM 1573 O LEU A 104 -18.635 -1.654 -45.204 1.00 31.32 O ATOM 1574 CB LEU A 104 -18.985 -0.149 -42.833 1.00 72.14 C ATOM 1575 CG LEU A 104 -19.473 0.927 -41.849 1.00 20.21 C ATOM 1576 CD1 LEU A 104 -18.304 1.776 -41.353 1.00 1.30 C ATOM 1577 CD2 LEU A 104 -20.540 1.807 -42.501 1.00 71.42 C ATOM 0 H LEU A 104 -20.020 -2.172 -41.569 1.00 62.14 H new ATOM 0 HA LEU A 104 -20.850 -0.506 -43.860 1.00 32.30 H new ATOM 0 HB2 LEU A 104 -18.219 -0.748 -42.340 1.00 72.14 H new ATOM 0 HB3 LEU A 104 -18.508 0.346 -43.679 1.00 72.14 H new ATOM 0 HG LEU A 104 -19.919 0.427 -40.989 1.00 20.21 H new ATOM 0 HD11 LEU A 104 -18.672 2.531 -40.658 1.00 1.30 H new ATOM 0 HD12 LEU A 104 -17.580 1.138 -40.846 1.00 1.30 H new ATOM 0 HD13 LEU A 104 -17.825 2.266 -42.201 1.00 1.30 H new ATOM 0 HD21 LEU A 104 -20.873 2.562 -41.789 1.00 71.42 H new ATOM 0 HD22 LEU A 104 -20.121 2.296 -43.380 1.00 71.42 H new ATOM 0 HD23 LEU A 104 -21.388 1.190 -42.799 1.00 71.42 H new ATOM 1589 N ALA A 105 -19.935 -3.296 -44.378 1.00 62.01 N ATOM 1590 CA ALA A 105 -19.422 -4.316 -45.283 1.00 15.02 C ATOM 1591 C ALA A 105 -20.459 -5.402 -45.524 1.00 14.10 C ATOM 1592 O ALA A 105 -21.577 -5.342 -45.012 1.00 75.53 O ATOM 1593 CB ALA A 105 -18.143 -4.928 -44.718 1.00 53.05 C ATOM 0 H ALA A 105 -20.662 -3.626 -43.743 1.00 62.01 H new ATOM 0 HA ALA A 105 -19.197 -3.840 -46.238 1.00 15.02 H new ATOM 0 HB1 ALA A 105 -17.770 -5.689 -45.404 1.00 53.05 H new ATOM 0 HB2 ALA A 105 -17.390 -4.149 -44.596 1.00 53.05 H new ATOM 0 HB3 ALA A 105 -18.354 -5.384 -43.751 1.00 53.05 H new ATOM 1599 N TYR A 106 -20.074 -6.399 -46.308 1.00 54.43 N ATOM 1600 CA TYR A 106 -20.925 -7.553 -46.576 1.00 22.33 C ATOM 1601 C TYR A 106 -20.917 -8.510 -45.384 1.00 52.22 C ATOM 1602 O TYR A 106 -21.715 -9.442 -45.322 1.00 2.43 O ATOM 1603 CB TYR A 106 -20.441 -8.280 -47.840 1.00 62.33 C ATOM 1604 CG TYR A 106 -18.987 -8.725 -47.776 1.00 72.41 C ATOM 1605 CD1 TYR A 106 -17.957 -7.885 -48.194 1.00 61.54 C ATOM 1606 CD2 TYR A 106 -18.643 -9.986 -47.293 1.00 15.41 C ATOM 1607 CE1 TYR A 106 -16.636 -8.287 -48.134 1.00 50.11 C ATOM 1608 CE2 TYR A 106 -17.325 -10.393 -47.231 1.00 43.13 C ATOM 1609 CZ TYR A 106 -16.326 -9.541 -47.652 1.00 60.03 C ATOM 1610 OH TYR A 106 -15.011 -9.951 -47.594 1.00 3.12 O ATOM 0 H TYR A 106 -19.168 -6.432 -46.775 1.00 54.43 H new ATOM 0 HA TYR A 106 -21.946 -7.205 -46.735 1.00 22.33 H new ATOM 0 HB2 TYR A 106 -21.071 -9.153 -48.009 1.00 62.33 H new ATOM 0 HB3 TYR A 106 -20.572 -7.622 -48.699 1.00 62.33 H new ATOM 0 HD1 TYR A 106 -18.195 -6.902 -48.572 1.00 61.54 H new ATOM 0 HD2 TYR A 106 -19.421 -10.657 -46.961 1.00 15.41 H new ATOM 0 HE1 TYR A 106 -15.851 -7.622 -48.463 1.00 50.11 H new ATOM 0 HE2 TYR A 106 -17.078 -11.375 -46.854 1.00 43.13 H new ATOM 0 HH TYR A 106 -14.967 -10.859 -47.229 1.00 3.12 H new ATOM 1620 N GLY A 107 -20.014 -8.252 -44.437 1.00 75.14 N ATOM 1621 CA GLY A 107 -19.813 -9.136 -43.298 1.00 10.44 C ATOM 1622 C GLY A 107 -21.077 -9.404 -42.502 1.00 30.53 C ATOM 1623 O GLY A 107 -21.183 -10.434 -41.833 1.00 60.22 O ATOM 0 H GLY A 107 -19.409 -7.431 -44.441 1.00 75.14 H new ATOM 0 HA2 GLY A 107 -19.410 -10.085 -43.653 1.00 10.44 H new ATOM 0 HA3 GLY A 107 -19.064 -8.698 -42.638 1.00 10.44 H new ATOM 1627 N GLU A 108 -22.038 -8.482 -42.569 1.00 42.23 N ATOM 1628 CA GLU A 108 -23.298 -8.643 -41.849 1.00 2.53 C ATOM 1629 C GLU A 108 -24.091 -9.823 -42.408 1.00 1.12 C ATOM 1630 O GLU A 108 -24.664 -10.613 -41.656 1.00 70.21 O ATOM 1631 CB GLU A 108 -24.141 -7.363 -41.913 1.00 42.32 C ATOM 1632 CG GLU A 108 -25.359 -7.402 -40.994 1.00 4.21 C ATOM 1633 CD GLU A 108 -26.242 -6.171 -41.115 1.00 31.05 C ATOM 1634 OE1 GLU A 108 -27.154 -6.170 -41.969 1.00 64.21 O ATOM 1635 OE2 GLU A 108 -26.040 -5.206 -40.349 1.00 42.51 O ATOM 0 H GLU A 108 -21.967 -7.621 -43.112 1.00 42.23 H new ATOM 0 HA GLU A 108 -23.059 -8.843 -40.804 1.00 2.53 H new ATOM 0 HB2 GLU A 108 -23.517 -6.510 -41.644 1.00 42.32 H new ATOM 0 HB3 GLU A 108 -24.472 -7.204 -42.939 1.00 42.32 H new ATOM 0 HG2 GLU A 108 -25.950 -8.289 -41.223 1.00 4.21 H new ATOM 0 HG3 GLU A 108 -25.024 -7.500 -39.962 1.00 4.21 H new ATOM 1642 N ARG A 109 -24.098 -9.947 -43.730 1.00 41.24 N ATOM 1643 CA ARG A 109 -24.830 -11.020 -44.409 1.00 2.14 C ATOM 1644 C ARG A 109 -23.894 -12.176 -44.780 1.00 64.15 C ATOM 1645 O ARG A 109 -24.351 -13.276 -45.103 1.00 50.12 O ATOM 1646 CB ARG A 109 -25.567 -10.468 -45.644 1.00 42.44 C ATOM 1647 CG ARG A 109 -24.762 -9.450 -46.451 1.00 24.32 C ATOM 1648 CD ARG A 109 -25.603 -8.799 -47.544 1.00 60.10 C ATOM 1649 NE ARG A 109 -24.913 -7.663 -48.164 1.00 12.51 N ATOM 1650 CZ ARG A 109 -25.341 -7.021 -49.254 1.00 71.52 C ATOM 1651 NH1 ARG A 109 -26.463 -7.396 -49.861 1.00 63.01 N ATOM 1652 NH2 ARG A 109 -24.648 -5.991 -49.724 1.00 72.20 N ATOM 0 H ARG A 109 -23.603 -9.316 -44.360 1.00 41.24 H new ATOM 0 HA ARG A 109 -25.577 -11.418 -43.722 1.00 2.14 H new ATOM 0 HB2 ARG A 109 -25.836 -11.300 -46.295 1.00 42.44 H new ATOM 0 HB3 ARG A 109 -26.498 -10.003 -45.320 1.00 42.44 H new ATOM 0 HG2 ARG A 109 -24.376 -8.680 -45.783 1.00 24.32 H new ATOM 0 HG3 ARG A 109 -23.900 -9.943 -46.901 1.00 24.32 H new ATOM 0 HD2 ARG A 109 -25.841 -9.539 -48.308 1.00 60.10 H new ATOM 0 HD3 ARG A 109 -26.549 -8.462 -47.121 1.00 60.10 H new ATOM 0 HE ARG A 109 -24.046 -7.341 -47.733 1.00 12.51 H new ATOM 0 HH11 ARG A 109 -27.004 -8.179 -49.495 1.00 63.01 H new ATOM 0 HH12 ARG A 109 -26.783 -6.900 -50.693 1.00 63.01 H new ATOM 0 HH21 ARG A 109 -23.793 -5.694 -49.253 1.00 72.20 H new ATOM 0 HH22 ARG A 109 -24.970 -5.497 -50.556 1.00 72.20 H new ATOM 1666 N GLY A 110 -22.588 -11.917 -44.710 1.00 51.44 N ATOM 1667 CA GLY A 110 -21.581 -12.948 -44.935 1.00 74.31 C ATOM 1668 C GLY A 110 -21.542 -13.466 -46.366 1.00 44.44 C ATOM 1669 O GLY A 110 -20.715 -13.012 -47.165 1.00 52.23 O ATOM 0 H GLY A 110 -22.204 -10.996 -44.498 1.00 51.44 H new ATOM 0 HA2 GLY A 110 -20.601 -12.548 -44.676 1.00 74.31 H new ATOM 0 HA3 GLY A 110 -21.772 -13.783 -44.261 1.00 74.31 H new ATOM 1673 N TYR A 111 -22.456 -14.404 -46.660 1.00 14.34 N ATOM 1674 CA TYR A 111 -22.560 -15.141 -47.936 1.00 51.25 C ATOM 1675 C TYR A 111 -21.887 -16.530 -47.844 1.00 15.01 C ATOM 1676 O TYR A 111 -22.603 -17.533 -47.748 1.00 51.22 O ATOM 1677 CB TYR A 111 -22.086 -14.340 -49.171 1.00 51.01 C ATOM 1678 CG TYR A 111 -23.044 -13.239 -49.601 1.00 1.55 C ATOM 1679 CD1 TYR A 111 -24.222 -13.550 -50.273 1.00 14.33 C ATOM 1680 CD2 TYR A 111 -22.770 -11.897 -49.345 1.00 62.24 C ATOM 1681 CE1 TYR A 111 -25.095 -12.560 -50.679 1.00 51.32 C ATOM 1682 CE2 TYR A 111 -23.643 -10.901 -49.748 1.00 42.35 C ATOM 1683 CZ TYR A 111 -24.804 -11.241 -50.414 1.00 75.40 C ATOM 1684 OH TYR A 111 -25.679 -10.257 -50.818 1.00 34.13 O ATOM 0 H TYR A 111 -23.173 -14.683 -45.991 1.00 14.34 H new ATOM 0 HA TYR A 111 -23.626 -15.297 -48.100 1.00 51.25 H new ATOM 0 HB2 TYR A 111 -21.114 -13.897 -48.953 1.00 51.01 H new ATOM 0 HB3 TYR A 111 -21.942 -15.028 -50.004 1.00 51.01 H new ATOM 0 HD1 TYR A 111 -24.458 -14.583 -50.481 1.00 14.33 H new ATOM 0 HD2 TYR A 111 -21.862 -11.630 -48.824 1.00 62.24 H new ATOM 0 HE1 TYR A 111 -26.003 -12.820 -51.203 1.00 51.32 H new ATOM 0 HE2 TYR A 111 -23.418 -9.865 -49.543 1.00 42.35 H new ATOM 0 HH TYR A 111 -26.592 -10.613 -50.822 1.00 34.13 H new ATOM 1694 N PRO A 112 -20.530 -16.656 -47.839 1.00 71.14 N ATOM 1695 CA PRO A 112 -19.872 -17.960 -47.777 1.00 74.05 C ATOM 1696 C PRO A 112 -19.635 -18.412 -46.330 1.00 44.53 C ATOM 1697 O PRO A 112 -19.306 -17.591 -45.476 1.00 35.22 O ATOM 1698 CB PRO A 112 -18.531 -17.718 -48.505 1.00 3.14 C ATOM 1699 CG PRO A 112 -18.368 -16.224 -48.608 1.00 55.31 C ATOM 1700 CD PRO A 112 -19.520 -15.590 -47.864 1.00 34.32 C ATOM 0 HA PRO A 112 -20.472 -18.751 -48.227 1.00 74.05 H new ATOM 0 HB2 PRO A 112 -17.703 -18.162 -47.952 1.00 3.14 H new ATOM 0 HB3 PRO A 112 -18.537 -18.177 -49.493 1.00 3.14 H new ATOM 0 HG2 PRO A 112 -17.416 -15.912 -48.179 1.00 55.31 H new ATOM 0 HG3 PRO A 112 -18.366 -15.909 -49.652 1.00 55.31 H new ATOM 0 HD2 PRO A 112 -19.231 -15.285 -46.858 1.00 34.32 H new ATOM 0 HD3 PRO A 112 -19.887 -14.699 -48.374 1.00 34.32 H new ATOM 1708 N PRO A 113 -19.771 -19.726 -46.041 1.00 75.52 N ATOM 1709 CA PRO A 113 -19.610 -20.267 -44.677 1.00 14.13 C ATOM 1710 C PRO A 113 -18.226 -19.970 -44.090 1.00 51.33 C ATOM 1711 O PRO A 113 -18.020 -20.053 -42.876 1.00 50.55 O ATOM 1712 CB PRO A 113 -19.810 -21.785 -44.857 1.00 71.32 C ATOM 1713 CG PRO A 113 -19.606 -22.032 -46.317 1.00 43.15 C ATOM 1714 CD PRO A 113 -20.090 -20.790 -47.012 1.00 14.23 C ATOM 0 HA PRO A 113 -20.315 -19.816 -43.979 1.00 14.13 H new ATOM 0 HB2 PRO A 113 -19.097 -22.351 -44.258 1.00 71.32 H new ATOM 0 HB3 PRO A 113 -20.807 -22.092 -44.540 1.00 71.32 H new ATOM 0 HG2 PRO A 113 -18.556 -22.221 -46.539 1.00 43.15 H new ATOM 0 HG3 PRO A 113 -20.164 -22.908 -46.647 1.00 43.15 H new ATOM 0 HD2 PRO A 113 -19.581 -20.635 -47.964 1.00 14.23 H new ATOM 0 HD3 PRO A 113 -21.158 -20.836 -47.225 1.00 14.23 H new ATOM 1722 N VAL A 114 -17.279 -19.640 -44.965 1.00 63.42 N ATOM 1723 CA VAL A 114 -15.936 -19.258 -44.542 1.00 23.21 C ATOM 1724 C VAL A 114 -15.992 -17.958 -43.739 1.00 74.31 C ATOM 1725 O VAL A 114 -15.267 -17.787 -42.754 1.00 2.15 O ATOM 1726 CB VAL A 114 -14.992 -19.078 -45.757 1.00 34.22 C ATOM 1727 CG1 VAL A 114 -13.571 -18.739 -45.306 1.00 33.32 C ATOM 1728 CG2 VAL A 114 -15.001 -20.333 -46.625 1.00 53.14 C ATOM 0 H VAL A 114 -17.419 -19.630 -45.975 1.00 63.42 H new ATOM 0 HA VAL A 114 -15.541 -20.059 -43.918 1.00 23.21 H new ATOM 0 HB VAL A 114 -15.358 -18.242 -46.352 1.00 34.22 H new ATOM 0 HG11 VAL A 114 -12.931 -18.618 -46.180 1.00 33.32 H new ATOM 0 HG12 VAL A 114 -13.582 -17.811 -44.734 1.00 33.32 H new ATOM 0 HG13 VAL A 114 -13.185 -19.545 -44.682 1.00 33.32 H new ATOM 0 HG21 VAL A 114 -14.333 -20.192 -47.475 1.00 53.14 H new ATOM 0 HG22 VAL A 114 -14.663 -21.185 -46.036 1.00 53.14 H new ATOM 0 HG23 VAL A 114 -16.013 -20.519 -46.985 1.00 53.14 H new ATOM 1738 N ILE A 115 -16.875 -17.058 -44.164 1.00 51.04 N ATOM 1739 CA ILE A 115 -17.077 -15.776 -43.499 1.00 15.41 C ATOM 1740 C ILE A 115 -18.408 -15.797 -42.742 1.00 5.40 C ATOM 1741 O ILE A 115 -19.473 -15.753 -43.358 1.00 35.31 O ATOM 1742 CB ILE A 115 -17.077 -14.601 -44.517 1.00 64.33 C ATOM 1743 CG1 ILE A 115 -15.761 -14.576 -45.318 1.00 53.33 C ATOM 1744 CG2 ILE A 115 -17.309 -13.261 -43.810 1.00 50.30 C ATOM 1745 CD1 ILE A 115 -14.523 -14.390 -44.461 1.00 54.20 C ATOM 0 H ILE A 115 -17.471 -17.198 -44.980 1.00 51.04 H new ATOM 0 HA ILE A 115 -16.252 -15.621 -42.803 1.00 15.41 H new ATOM 0 HB ILE A 115 -17.899 -14.759 -45.215 1.00 64.33 H new ATOM 0 HG12 ILE A 115 -15.668 -15.508 -45.875 1.00 53.33 H new ATOM 0 HG13 ILE A 115 -15.808 -13.770 -46.051 1.00 53.33 H new ATOM 0 HG21 ILE A 115 -17.304 -12.456 -44.545 1.00 50.30 H new ATOM 0 HG22 ILE A 115 -18.272 -13.281 -43.300 1.00 50.30 H new ATOM 0 HG23 ILE A 115 -16.516 -13.092 -43.082 1.00 50.30 H new ATOM 0 HD11 ILE A 115 -13.638 -14.383 -45.097 1.00 54.20 H new ATOM 0 HD12 ILE A 115 -14.591 -13.444 -43.924 1.00 54.20 H new ATOM 0 HD13 ILE A 115 -14.449 -15.209 -43.746 1.00 54.20 H new ATOM 1757 N PRO A 116 -18.364 -15.886 -41.400 1.00 1.54 N ATOM 1758 CA PRO A 116 -19.577 -15.950 -40.574 1.00 4.42 C ATOM 1759 C PRO A 116 -20.450 -14.699 -40.722 1.00 1.54 C ATOM 1760 O PRO A 116 -19.942 -13.604 -40.968 1.00 44.24 O ATOM 1761 CB PRO A 116 -19.037 -16.077 -39.138 1.00 0.11 C ATOM 1762 CG PRO A 116 -17.628 -15.584 -39.204 1.00 2.34 C ATOM 1763 CD PRO A 116 -17.136 -15.926 -40.584 1.00 73.41 C ATOM 0 HA PRO A 116 -20.223 -16.778 -40.866 1.00 4.42 H new ATOM 0 HB2 PRO A 116 -19.629 -15.484 -38.441 1.00 0.11 H new ATOM 0 HB3 PRO A 116 -19.077 -17.110 -38.792 1.00 0.11 H new ATOM 0 HG2 PRO A 116 -17.582 -14.509 -39.028 1.00 2.34 H new ATOM 0 HG3 PRO A 116 -17.012 -16.059 -38.441 1.00 2.34 H new ATOM 0 HD2 PRO A 116 -16.395 -15.209 -40.936 1.00 73.41 H new ATOM 0 HD3 PRO A 116 -16.666 -16.909 -40.612 1.00 73.41 H new ATOM 1771 N PRO A 117 -21.781 -14.851 -40.592 1.00 32.11 N ATOM 1772 CA PRO A 117 -22.717 -13.729 -40.701 1.00 23.42 C ATOM 1773 C PRO A 117 -22.568 -12.737 -39.547 1.00 61.41 C ATOM 1774 O PRO A 117 -22.294 -13.130 -38.407 1.00 22.34 O ATOM 1775 CB PRO A 117 -24.096 -14.400 -40.672 1.00 44.33 C ATOM 1776 CG PRO A 117 -23.873 -15.699 -39.975 1.00 52.33 C ATOM 1777 CD PRO A 117 -22.478 -16.129 -40.340 1.00 32.41 C ATOM 0 HA PRO A 117 -22.544 -13.140 -41.602 1.00 23.42 H new ATOM 0 HB2 PRO A 117 -24.824 -13.786 -40.141 1.00 44.33 H new ATOM 0 HB3 PRO A 117 -24.483 -14.553 -41.680 1.00 44.33 H new ATOM 0 HG2 PRO A 117 -23.977 -15.586 -38.896 1.00 52.33 H new ATOM 0 HG3 PRO A 117 -24.606 -16.442 -40.290 1.00 52.33 H new ATOM 0 HD2 PRO A 117 -22.007 -16.691 -39.534 1.00 32.41 H new ATOM 0 HD3 PRO A 117 -22.473 -16.770 -41.221 1.00 32.41 H new ATOM 1785 N LYS A 118 -22.752 -11.455 -39.867 1.00 12.23 N ATOM 1786 CA LYS A 118 -22.632 -10.356 -38.905 1.00 22.13 C ATOM 1787 C LYS A 118 -21.212 -10.249 -38.365 1.00 41.51 C ATOM 1788 O LYS A 118 -20.994 -9.707 -37.284 1.00 20.11 O ATOM 1789 CB LYS A 118 -23.640 -10.502 -37.753 1.00 64.12 C ATOM 1790 CG LYS A 118 -25.098 -10.431 -38.204 1.00 0.22 C ATOM 1791 CD LYS A 118 -26.057 -10.260 -37.029 1.00 12.22 C ATOM 1792 CE LYS A 118 -25.770 -8.977 -36.256 1.00 54.44 C ATOM 1793 NZ LYS A 118 -26.794 -8.711 -35.216 1.00 73.32 N ATOM 0 H LYS A 118 -22.991 -11.147 -40.810 1.00 12.23 H new ATOM 0 HA LYS A 118 -22.864 -9.434 -39.438 1.00 22.13 H new ATOM 0 HB2 LYS A 118 -23.470 -11.454 -37.251 1.00 64.12 H new ATOM 0 HB3 LYS A 118 -23.457 -9.717 -37.019 1.00 64.12 H new ATOM 0 HG2 LYS A 118 -25.222 -9.598 -38.896 1.00 0.22 H new ATOM 0 HG3 LYS A 118 -25.353 -11.340 -38.749 1.00 0.22 H new ATOM 0 HD2 LYS A 118 -27.084 -10.244 -37.395 1.00 12.22 H new ATOM 0 HD3 LYS A 118 -25.971 -11.116 -36.360 1.00 12.22 H new ATOM 0 HE2 LYS A 118 -24.788 -9.048 -35.788 1.00 54.44 H new ATOM 0 HE3 LYS A 118 -25.732 -8.137 -36.950 1.00 54.44 H new ATOM 0 HZ1 LYS A 118 -26.560 -7.830 -34.715 1.00 73.32 H new ATOM 0 HZ2 LYS A 118 -27.728 -8.617 -35.664 1.00 73.32 H new ATOM 0 HZ3 LYS A 118 -26.813 -9.500 -34.538 1.00 73.32 H new ATOM 1807 N ALA A 119 -20.247 -10.719 -39.150 1.00 25.12 N ATOM 1808 CA ALA A 119 -18.853 -10.748 -38.719 1.00 55.24 C ATOM 1809 C ALA A 119 -18.132 -9.449 -39.067 1.00 12.24 C ATOM 1810 O ALA A 119 -18.281 -8.915 -40.169 1.00 74.12 O ATOM 1811 CB ALA A 119 -18.122 -11.934 -39.340 1.00 71.50 C ATOM 0 H ALA A 119 -20.405 -11.085 -40.089 1.00 25.12 H new ATOM 0 HA ALA A 119 -18.849 -10.857 -37.634 1.00 55.24 H new ATOM 0 HB1 ALA A 119 -17.084 -11.937 -39.006 1.00 71.50 H new ATOM 0 HB2 ALA A 119 -18.605 -12.861 -39.032 1.00 71.50 H new ATOM 0 HB3 ALA A 119 -18.153 -11.852 -40.426 1.00 71.50 H new ATOM 1817 N THR A 120 -17.367 -8.943 -38.110 1.00 51.12 N ATOM 1818 CA THR A 120 -16.496 -7.800 -38.335 1.00 71.23 C ATOM 1819 C THR A 120 -15.154 -8.294 -38.889 1.00 20.24 C ATOM 1820 O THR A 120 -14.565 -9.230 -38.341 1.00 3.02 O ATOM 1821 CB THR A 120 -16.282 -7.017 -37.019 1.00 65.31 C ATOM 1822 OG1 THR A 120 -17.556 -6.705 -36.434 1.00 65.31 O ATOM 1823 CG2 THR A 120 -15.504 -5.727 -37.253 1.00 44.33 C ATOM 0 H THR A 120 -17.333 -9.312 -37.160 1.00 51.12 H new ATOM 0 HA THR A 120 -16.960 -7.127 -39.056 1.00 71.23 H new ATOM 0 HB THR A 120 -15.700 -7.646 -36.345 1.00 65.31 H new ATOM 0 HG1 THR A 120 -17.919 -7.503 -35.995 1.00 65.31 H new ATOM 0 HG21 THR A 120 -15.373 -5.204 -36.306 1.00 44.33 H new ATOM 0 HG22 THR A 120 -14.527 -5.963 -37.675 1.00 44.33 H new ATOM 0 HG23 THR A 120 -16.055 -5.091 -37.946 1.00 44.33 H new ATOM 1831 N LEU A 121 -14.673 -7.680 -39.970 1.00 2.41 N ATOM 1832 CA LEU A 121 -13.503 -8.203 -40.688 1.00 73.03 C ATOM 1833 C LEU A 121 -12.423 -7.124 -40.769 1.00 70.13 C ATOM 1834 O LEU A 121 -12.738 -5.945 -40.889 1.00 70.31 O ATOM 1835 CB LEU A 121 -13.938 -8.676 -42.095 1.00 5.25 C ATOM 1836 CG LEU A 121 -13.071 -9.771 -42.760 1.00 44.23 C ATOM 1837 CD1 LEU A 121 -11.705 -9.237 -43.181 1.00 63.11 C ATOM 1838 CD2 LEU A 121 -12.917 -10.974 -41.829 1.00 11.54 C ATOM 0 H LEU A 121 -15.068 -6.828 -40.367 1.00 2.41 H new ATOM 0 HA LEU A 121 -13.084 -9.056 -40.154 1.00 73.03 H new ATOM 0 HB2 LEU A 121 -14.961 -9.046 -42.028 1.00 5.25 H new ATOM 0 HB3 LEU A 121 -13.956 -7.809 -42.755 1.00 5.25 H new ATOM 0 HG LEU A 121 -13.587 -10.092 -43.665 1.00 44.23 H new ATOM 0 HD11 LEU A 121 -11.128 -10.038 -43.644 1.00 63.11 H new ATOM 0 HD12 LEU A 121 -11.836 -8.425 -43.896 1.00 63.11 H new ATOM 0 HD13 LEU A 121 -11.173 -8.866 -42.305 1.00 63.11 H new ATOM 0 HD21 LEU A 121 -12.304 -11.734 -42.314 1.00 11.54 H new ATOM 0 HD22 LEU A 121 -12.437 -10.658 -40.903 1.00 11.54 H new ATOM 0 HD23 LEU A 121 -13.900 -11.389 -41.605 1.00 11.54 H new ATOM 1850 N VAL A 122 -11.151 -7.519 -40.715 1.00 31.41 N ATOM 1851 CA VAL A 122 -10.064 -6.551 -40.677 1.00 43.23 C ATOM 1852 C VAL A 122 -9.472 -6.363 -42.072 1.00 70.11 C ATOM 1853 O VAL A 122 -8.988 -7.313 -42.683 1.00 44.44 O ATOM 1854 CB VAL A 122 -8.949 -7.000 -39.703 1.00 61.11 C ATOM 1855 CG1 VAL A 122 -7.797 -6.003 -39.699 1.00 50.24 C ATOM 1856 CG2 VAL A 122 -9.509 -7.199 -38.292 1.00 74.23 C ATOM 0 H VAL A 122 -10.853 -8.494 -40.697 1.00 31.41 H new ATOM 0 HA VAL A 122 -10.475 -5.605 -40.324 1.00 43.23 H new ATOM 0 HB VAL A 122 -8.561 -7.958 -40.049 1.00 61.11 H new ATOM 0 HG11 VAL A 122 -7.026 -6.341 -39.007 1.00 50.24 H new ATOM 0 HG12 VAL A 122 -7.377 -5.929 -40.702 1.00 50.24 H new ATOM 0 HG13 VAL A 122 -8.163 -5.025 -39.385 1.00 50.24 H new ATOM 0 HG21 VAL A 122 -8.708 -7.515 -37.624 1.00 74.23 H new ATOM 0 HG22 VAL A 122 -9.933 -6.261 -37.933 1.00 74.23 H new ATOM 0 HG23 VAL A 122 -10.286 -7.963 -38.313 1.00 74.23 H new ATOM 1866 N PHE A 123 -9.528 -5.139 -42.579 1.00 33.02 N ATOM 1867 CA PHE A 123 -8.948 -4.815 -43.876 1.00 14.15 C ATOM 1868 C PHE A 123 -7.812 -3.815 -43.708 1.00 24.01 C ATOM 1869 O PHE A 123 -8.003 -2.703 -43.202 1.00 14.25 O ATOM 1870 CB PHE A 123 -10.011 -4.266 -44.839 1.00 30.11 C ATOM 1871 CG PHE A 123 -10.908 -5.331 -45.432 1.00 10.14 C ATOM 1872 CD1 PHE A 123 -12.082 -5.719 -44.795 1.00 51.11 C ATOM 1873 CD2 PHE A 123 -10.577 -5.938 -46.638 1.00 52.10 C ATOM 1874 CE1 PHE A 123 -12.901 -6.685 -45.348 1.00 23.22 C ATOM 1875 CE2 PHE A 123 -11.394 -6.907 -47.191 1.00 34.12 C ATOM 1876 CZ PHE A 123 -12.556 -7.279 -46.547 1.00 24.21 C ATOM 0 H PHE A 123 -9.972 -4.350 -42.109 1.00 33.02 H new ATOM 0 HA PHE A 123 -8.549 -5.733 -44.309 1.00 14.15 H new ATOM 0 HB2 PHE A 123 -10.627 -3.539 -44.309 1.00 30.11 H new ATOM 0 HB3 PHE A 123 -9.513 -3.732 -45.648 1.00 30.11 H new ATOM 0 HD1 PHE A 123 -12.357 -5.260 -43.857 1.00 51.11 H new ATOM 0 HD2 PHE A 123 -9.671 -5.649 -47.149 1.00 52.10 H new ATOM 0 HE1 PHE A 123 -13.810 -6.976 -44.843 1.00 23.22 H new ATOM 0 HE2 PHE A 123 -11.122 -7.373 -48.127 1.00 34.12 H new ATOM 0 HZ PHE A 123 -13.196 -8.034 -46.980 1.00 24.21 H new ATOM 1886 N GLU A 124 -6.624 -4.236 -44.104 1.00 64.31 N ATOM 1887 CA GLU A 124 -5.459 -3.374 -44.090 1.00 51.31 C ATOM 1888 C GLU A 124 -5.450 -2.531 -45.357 1.00 24.30 C ATOM 1889 O GLU A 124 -5.213 -3.041 -46.455 1.00 64.22 O ATOM 1890 CB GLU A 124 -4.187 -4.220 -43.970 1.00 15.04 C ATOM 1891 CG GLU A 124 -4.144 -5.045 -42.688 1.00 23.21 C ATOM 1892 CD GLU A 124 -2.992 -6.031 -42.657 1.00 12.02 C ATOM 1893 OE1 GLU A 124 -1.837 -5.603 -42.472 1.00 32.21 O ATOM 1894 OE2 GLU A 124 -3.231 -7.245 -42.814 1.00 21.31 O ATOM 0 H GLU A 124 -6.442 -5.181 -44.443 1.00 64.31 H new ATOM 0 HA GLU A 124 -5.495 -2.706 -43.229 1.00 51.31 H new ATOM 0 HB2 GLU A 124 -4.118 -4.888 -44.829 1.00 15.04 H new ATOM 0 HB3 GLU A 124 -3.316 -3.565 -44.005 1.00 15.04 H new ATOM 0 HG2 GLU A 124 -4.064 -4.374 -41.833 1.00 23.21 H new ATOM 0 HG3 GLU A 124 -5.083 -5.588 -42.580 1.00 23.21 H new ATOM 1901 N VAL A 125 -5.756 -1.251 -45.193 1.00 22.33 N ATOM 1902 CA VAL A 125 -5.886 -0.325 -46.311 1.00 0.42 C ATOM 1903 C VAL A 125 -4.646 0.559 -46.412 1.00 41.00 C ATOM 1904 O VAL A 125 -4.044 0.911 -45.396 1.00 20.15 O ATOM 1905 CB VAL A 125 -7.158 0.555 -46.159 1.00 20.05 C ATOM 1906 CG1 VAL A 125 -8.416 -0.308 -46.196 1.00 34.15 C ATOM 1907 CG2 VAL A 125 -7.114 1.360 -44.863 1.00 11.44 C ATOM 0 H VAL A 125 -5.921 -0.825 -44.281 1.00 22.33 H new ATOM 0 HA VAL A 125 -5.981 -0.909 -47.226 1.00 0.42 H new ATOM 0 HB VAL A 125 -7.184 1.252 -46.997 1.00 20.05 H new ATOM 0 HG11 VAL A 125 -9.296 0.326 -46.088 1.00 34.15 H new ATOM 0 HG12 VAL A 125 -8.466 -0.838 -47.147 1.00 34.15 H new ATOM 0 HG13 VAL A 125 -8.387 -1.029 -45.379 1.00 34.15 H new ATOM 0 HG21 VAL A 125 -8.016 1.967 -44.781 1.00 11.44 H new ATOM 0 HG22 VAL A 125 -7.056 0.679 -44.014 1.00 11.44 H new ATOM 0 HG23 VAL A 125 -6.238 2.009 -44.868 1.00 11.44 H new ATOM 1917 N GLU A 126 -4.260 0.902 -47.635 1.00 43.13 N ATOM 1918 CA GLU A 126 -3.075 1.717 -47.873 1.00 63.02 C ATOM 1919 C GLU A 126 -3.309 2.672 -49.042 1.00 75.21 C ATOM 1920 O GLU A 126 -3.773 2.260 -50.105 1.00 73.13 O ATOM 1921 CB GLU A 126 -1.873 0.803 -48.159 1.00 51.44 C ATOM 1922 CG GLU A 126 -0.565 1.542 -48.433 1.00 43.20 C ATOM 1923 CD GLU A 126 0.628 0.601 -48.538 1.00 3.30 C ATOM 1924 OE1 GLU A 126 0.711 -0.150 -49.530 1.00 32.43 O ATOM 1925 OE2 GLU A 126 1.469 0.585 -47.610 1.00 33.31 O ATOM 0 H GLU A 126 -4.755 0.626 -48.483 1.00 43.13 H new ATOM 0 HA GLU A 126 -2.868 2.313 -46.984 1.00 63.02 H new ATOM 0 HB2 GLU A 126 -1.728 0.138 -47.308 1.00 51.44 H new ATOM 0 HB3 GLU A 126 -2.107 0.175 -49.018 1.00 51.44 H new ATOM 0 HG2 GLU A 126 -0.659 2.108 -49.360 1.00 43.20 H new ATOM 0 HG3 GLU A 126 -0.385 2.263 -47.636 1.00 43.20 H new ATOM 1932 N LEU A 127 -3.006 3.945 -48.828 1.00 44.31 N ATOM 1933 CA LEU A 127 -3.119 4.964 -49.869 1.00 71.21 C ATOM 1934 C LEU A 127 -1.737 5.209 -50.475 1.00 21.13 C ATOM 1935 O LEU A 127 -0.880 5.837 -49.846 1.00 72.31 O ATOM 1936 CB LEU A 127 -3.703 6.263 -49.266 1.00 2.35 C ATOM 1937 CG LEU A 127 -4.255 7.314 -50.258 1.00 62.44 C ATOM 1938 CD1 LEU A 127 -3.150 7.922 -51.118 1.00 31.13 C ATOM 1939 CD2 LEU A 127 -5.348 6.711 -51.135 1.00 41.12 C ATOM 0 H LEU A 127 -2.676 4.302 -47.932 1.00 44.31 H new ATOM 0 HA LEU A 127 -3.793 4.626 -50.657 1.00 71.21 H new ATOM 0 HB2 LEU A 127 -4.507 5.988 -48.583 1.00 2.35 H new ATOM 0 HB3 LEU A 127 -2.925 6.738 -48.668 1.00 2.35 H new ATOM 0 HG LEU A 127 -4.689 8.120 -49.666 1.00 62.44 H new ATOM 0 HD11 LEU A 127 -3.581 8.655 -51.800 1.00 31.13 H new ATOM 0 HD12 LEU A 127 -2.417 8.411 -50.476 1.00 31.13 H new ATOM 0 HD13 LEU A 127 -2.661 7.135 -51.692 1.00 31.13 H new ATOM 0 HD21 LEU A 127 -5.721 7.469 -51.824 1.00 41.12 H new ATOM 0 HD22 LEU A 127 -4.940 5.874 -51.702 1.00 41.12 H new ATOM 0 HD23 LEU A 127 -6.166 6.359 -50.506 1.00 41.12 H new ATOM 1951 N LEU A 128 -1.518 4.708 -51.689 1.00 14.43 N ATOM 1952 CA LEU A 128 -0.213 4.829 -52.340 1.00 30.41 C ATOM 1953 C LEU A 128 -0.093 6.175 -53.033 1.00 2.23 C ATOM 1954 O LEU A 128 0.904 6.882 -52.874 1.00 15.42 O ATOM 1955 CB LEU A 128 0.020 3.699 -53.361 1.00 73.21 C ATOM 1956 CG LEU A 128 0.294 2.307 -52.768 1.00 25.15 C ATOM 1957 CD1 LEU A 128 1.498 2.346 -51.825 1.00 61.42 C ATOM 1958 CD2 LEU A 128 -0.944 1.765 -52.060 1.00 51.52 C ATOM 0 H LEU A 128 -2.222 4.217 -52.240 1.00 14.43 H new ATOM 0 HA LEU A 128 0.548 4.748 -51.564 1.00 30.41 H new ATOM 0 HB2 LEU A 128 -0.856 3.632 -54.007 1.00 73.21 H new ATOM 0 HB3 LEU A 128 0.863 3.976 -53.995 1.00 73.21 H new ATOM 0 HG LEU A 128 0.533 1.629 -53.587 1.00 25.15 H new ATOM 0 HD11 LEU A 128 1.673 1.350 -51.417 1.00 61.42 H new ATOM 0 HD12 LEU A 128 2.380 2.673 -52.375 1.00 61.42 H new ATOM 0 HD13 LEU A 128 1.299 3.042 -51.010 1.00 61.42 H new ATOM 0 HD21 LEU A 128 -0.726 0.779 -51.649 1.00 51.52 H new ATOM 0 HD22 LEU A 128 -1.226 2.441 -51.253 1.00 51.52 H new ATOM 0 HD23 LEU A 128 -1.766 1.687 -52.772 1.00 51.52 H new ATOM 1970 N ALA A 129 -1.121 6.522 -53.795 1.00 4.43 N ATOM 1971 CA ALA A 129 -1.126 7.761 -54.563 1.00 1.24 C ATOM 1972 C ALA A 129 -2.539 8.073 -55.029 1.00 55.22 C ATOM 1973 O ALA A 129 -3.490 7.399 -54.632 1.00 1.51 O ATOM 1974 CB ALA A 129 -0.178 7.650 -55.755 1.00 14.11 C ATOM 0 H ALA A 129 -1.966 5.961 -53.898 1.00 4.43 H new ATOM 0 HA ALA A 129 -0.779 8.575 -53.927 1.00 1.24 H new ATOM 0 HB1 ALA A 129 -0.192 8.583 -56.319 1.00 14.11 H new ATOM 0 HB2 ALA A 129 0.834 7.457 -55.398 1.00 14.11 H new ATOM 0 HB3 ALA A 129 -0.498 6.831 -56.399 1.00 14.11 H new ATOM 1980 N VAL A 130 -2.679 9.103 -55.849 1.00 71.35 N ATOM 1981 CA VAL A 130 -3.965 9.444 -56.443 1.00 3.33 C ATOM 1982 C VAL A 130 -4.015 8.945 -57.896 1.00 10.44 C ATOM 1983 O VAL A 130 -4.540 7.836 -58.118 1.00 70.32 O ATOM 1984 CB VAL A 130 -4.257 10.973 -56.336 1.00 20.24 C ATOM 1985 CG1 VAL A 130 -3.071 11.811 -56.826 1.00 51.34 C ATOM 1986 CG2 VAL A 130 -5.542 11.345 -57.084 1.00 32.12 C ATOM 1987 OXT VAL A 130 -3.486 9.620 -58.805 1.00 0.00 O ATOM 0 H VAL A 130 -1.914 9.721 -56.120 1.00 71.35 H new ATOM 0 HA VAL A 130 -4.755 8.942 -55.884 1.00 3.33 H new ATOM 0 HB VAL A 130 -4.405 11.202 -55.281 1.00 20.24 H new ATOM 0 HG11 VAL A 130 -3.312 12.870 -56.736 1.00 51.34 H new ATOM 0 HG12 VAL A 130 -2.192 11.586 -56.222 1.00 51.34 H new ATOM 0 HG13 VAL A 130 -2.864 11.573 -57.869 1.00 51.34 H new ATOM 0 HG21 VAL A 130 -5.720 12.416 -56.992 1.00 32.12 H new ATOM 0 HG22 VAL A 130 -5.439 11.084 -58.137 1.00 32.12 H new ATOM 0 HG23 VAL A 130 -6.383 10.800 -56.656 1.00 32.12 H new TER 1997 VAL A 130