USER MOD reduce.3.24.130724 H: found=0, std=0, add=766, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 764 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 Single : A 1 GLY N :NH3+ 133:sc= 0.0196 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= -0.022 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 44:sc= 0.944 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 TYR OH : rot 84:sc= 0.113 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 7:sc= 0.929 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 GLN : amide:sc= -0.12 K(o=-0.12,f=-1.5!) USER MOD Single : A 56 ASN : amide:sc= -0.128 K(o=-0.13,f=-2.5) USER MOD Single : A 57 ASN :FLIP amide:sc= 0.0674 F(o=-1.4,f=0.067) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot -65:sc= -0.0209 USER MOD Single : A 70 THR OG1 : rot -160:sc= -1.01 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 ASN : amide:sc= -0.0156 X(o=-0.016,f=-0.016) USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 59:sc= 0.0597 USER MOD Single : A 88 GLN : amide:sc=-0.00301 X(o=-0.003,f=0) USER MOD Single : A 93 TYR OH : rot -82:sc= 0.00392! USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot -11:sc= 0.894 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -42.435 -2.028 -10.346 1.00 0.00 N ATOM 2 CA GLY A 1 -41.152 -1.547 -10.826 1.00 0.00 C ATOM 3 C GLY A 1 -40.191 -1.233 -9.696 1.00 0.00 C ATOM 4 O GLY A 1 -40.607 -0.804 -8.620 1.00 0.00 O ATOM 0 H1 GLY A 1 -43.201 -1.528 -10.841 1.00 0.00 H new ATOM 0 H2 GLY A 1 -42.514 -3.049 -10.529 1.00 0.00 H new ATOM 0 H3 GLY A 1 -42.511 -1.853 -9.324 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -40.707 -2.298 -11.479 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -41.305 -0.651 -11.428 1.00 0.00 H new ATOM 8 N SER A 2 -38.903 -1.449 -9.941 1.00 0.00 N ATOM 9 CA SER A 2 -37.880 -1.191 -8.933 1.00 0.00 C ATOM 10 C SER A 2 -36.642 -0.562 -9.565 1.00 0.00 C ATOM 11 O SER A 2 -36.086 -1.089 -10.528 1.00 0.00 O ATOM 12 CB SER A 2 -37.498 -2.490 -8.220 1.00 0.00 C ATOM 13 OG SER A 2 -38.603 -3.027 -7.513 1.00 0.00 O ATOM 0 H SER A 2 -38.543 -1.802 -10.828 1.00 0.00 H new ATOM 0 HA SER A 2 -38.290 -0.492 -8.204 1.00 0.00 H new ATOM 0 HB2 SER A 2 -37.140 -3.217 -8.949 1.00 0.00 H new ATOM 0 HB3 SER A 2 -36.677 -2.301 -7.529 1.00 0.00 H new ATOM 0 HG SER A 2 -38.334 -3.857 -7.067 1.00 0.00 H new ATOM 19 N SER A 3 -36.216 0.571 -9.014 1.00 0.00 N ATOM 20 CA SER A 3 -35.046 1.276 -9.525 1.00 0.00 C ATOM 21 C SER A 3 -34.566 2.325 -8.527 1.00 0.00 C ATOM 22 O SER A 3 -35.284 2.689 -7.597 1.00 0.00 O ATOM 23 CB SER A 3 -35.369 1.940 -10.865 1.00 0.00 C ATOM 24 OG SER A 3 -36.521 2.760 -10.763 1.00 0.00 O ATOM 0 H SER A 3 -36.663 1.020 -8.215 1.00 0.00 H new ATOM 0 HA SER A 3 -34.249 0.548 -9.672 1.00 0.00 H new ATOM 0 HB2 SER A 3 -34.519 2.540 -11.191 1.00 0.00 H new ATOM 0 HB3 SER A 3 -35.529 1.175 -11.624 1.00 0.00 H new ATOM 0 HG SER A 3 -36.706 3.174 -11.632 1.00 0.00 H new ATOM 30 N GLY A 4 -33.343 2.808 -8.728 1.00 0.00 N ATOM 31 CA GLY A 4 -32.786 3.810 -7.838 1.00 0.00 C ATOM 32 C GLY A 4 -31.287 3.963 -8.003 1.00 0.00 C ATOM 33 O GLY A 4 -30.598 3.017 -8.383 1.00 0.00 O ATOM 0 H GLY A 4 -32.729 2.523 -9.491 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -33.269 4.769 -8.028 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -33.009 3.539 -6.806 1.00 0.00 H new ATOM 37 N SER A 5 -30.781 5.159 -7.719 1.00 0.00 N ATOM 38 CA SER A 5 -29.354 5.434 -7.843 1.00 0.00 C ATOM 39 C SER A 5 -28.898 6.428 -6.779 1.00 0.00 C ATOM 40 O SER A 5 -29.703 6.924 -5.991 1.00 0.00 O ATOM 41 CB SER A 5 -29.038 5.981 -9.237 1.00 0.00 C ATOM 42 OG SER A 5 -27.643 5.968 -9.485 1.00 0.00 O ATOM 0 H SER A 5 -31.338 5.953 -7.402 1.00 0.00 H new ATOM 0 HA SER A 5 -28.814 4.498 -7.696 1.00 0.00 H new ATOM 0 HB2 SER A 5 -29.550 5.383 -9.991 1.00 0.00 H new ATOM 0 HB3 SER A 5 -29.417 6.999 -9.326 1.00 0.00 H new ATOM 0 HG SER A 5 -27.467 6.320 -10.382 1.00 0.00 H new ATOM 48 N SER A 6 -27.600 6.713 -6.763 1.00 0.00 N ATOM 49 CA SER A 6 -27.034 7.644 -5.794 1.00 0.00 C ATOM 50 C SER A 6 -25.749 8.270 -6.327 1.00 0.00 C ATOM 51 O SER A 6 -24.836 7.567 -6.758 1.00 0.00 O ATOM 52 CB SER A 6 -26.756 6.929 -4.470 1.00 0.00 C ATOM 53 OG SER A 6 -26.488 7.859 -3.435 1.00 0.00 O ATOM 0 H SER A 6 -26.921 6.313 -7.410 1.00 0.00 H new ATOM 0 HA SER A 6 -27.761 8.439 -5.624 1.00 0.00 H new ATOM 0 HB2 SER A 6 -27.614 6.314 -4.198 1.00 0.00 H new ATOM 0 HB3 SER A 6 -25.907 6.256 -4.588 1.00 0.00 H new ATOM 0 HG SER A 6 -26.315 7.377 -2.599 1.00 0.00 H new ATOM 59 N GLY A 7 -25.686 9.597 -6.295 1.00 0.00 N ATOM 60 CA GLY A 7 -24.510 10.296 -6.778 1.00 0.00 C ATOM 61 C GLY A 7 -24.538 11.776 -6.449 1.00 0.00 C ATOM 62 O GLY A 7 -25.599 12.338 -6.181 1.00 0.00 O ATOM 0 H GLY A 7 -26.429 10.201 -5.943 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -23.619 9.847 -6.340 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -24.433 10.169 -7.858 1.00 0.00 H new ATOM 66 N ALA A 8 -23.369 12.407 -6.468 1.00 0.00 N ATOM 67 CA ALA A 8 -23.264 13.830 -6.170 1.00 0.00 C ATOM 68 C ALA A 8 -21.844 14.335 -6.396 1.00 0.00 C ATOM 69 O ALA A 8 -20.938 14.038 -5.617 1.00 0.00 O ATOM 70 CB ALA A 8 -23.702 14.103 -4.738 1.00 0.00 C ATOM 0 H ALA A 8 -22.481 11.955 -6.687 1.00 0.00 H new ATOM 0 HA ALA A 8 -23.925 14.368 -6.850 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -23.618 15.170 -4.529 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -24.737 13.788 -4.608 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -23.064 13.548 -4.050 1.00 0.00 H new ATOM 76 N SER A 9 -21.656 15.101 -7.466 1.00 0.00 N ATOM 77 CA SER A 9 -20.343 15.644 -7.797 1.00 0.00 C ATOM 78 C SER A 9 -19.998 16.821 -6.890 1.00 0.00 C ATOM 79 O SER A 9 -20.381 17.959 -7.160 1.00 0.00 O ATOM 80 CB SER A 9 -20.305 16.085 -9.261 1.00 0.00 C ATOM 81 OG SER A 9 -21.261 17.099 -9.514 1.00 0.00 O ATOM 0 H SER A 9 -22.396 15.360 -8.119 1.00 0.00 H new ATOM 0 HA SER A 9 -19.602 14.859 -7.642 1.00 0.00 H new ATOM 0 HB2 SER A 9 -19.308 16.451 -9.508 1.00 0.00 H new ATOM 0 HB3 SER A 9 -20.499 15.229 -9.907 1.00 0.00 H new ATOM 0 HG SER A 9 -21.235 17.761 -8.792 1.00 0.00 H new ATOM 87 N SER A 10 -19.272 16.538 -5.813 1.00 0.00 N ATOM 88 CA SER A 10 -18.878 17.572 -4.864 1.00 0.00 C ATOM 89 C SER A 10 -17.503 17.272 -4.274 1.00 0.00 C ATOM 90 O SER A 10 -17.123 16.112 -4.115 1.00 0.00 O ATOM 91 CB SER A 10 -19.913 17.685 -3.742 1.00 0.00 C ATOM 92 OG SER A 10 -20.064 16.452 -3.061 1.00 0.00 O ATOM 0 H SER A 10 -18.945 15.601 -5.576 1.00 0.00 H new ATOM 0 HA SER A 10 -18.826 18.521 -5.398 1.00 0.00 H new ATOM 0 HB2 SER A 10 -19.607 18.458 -3.037 1.00 0.00 H new ATOM 0 HB3 SER A 10 -20.872 17.994 -4.158 1.00 0.00 H new ATOM 0 HG SER A 10 -20.729 16.551 -2.348 1.00 0.00 H new ATOM 98 N SER A 11 -16.762 18.327 -3.951 1.00 0.00 N ATOM 99 CA SER A 11 -15.427 18.178 -3.383 1.00 0.00 C ATOM 100 C SER A 11 -15.287 18.999 -2.104 1.00 0.00 C ATOM 101 O SER A 11 -16.245 19.620 -1.643 1.00 0.00 O ATOM 102 CB SER A 11 -14.367 18.610 -4.398 1.00 0.00 C ATOM 103 OG SER A 11 -14.371 17.761 -5.532 1.00 0.00 O ATOM 0 H SER A 11 -17.063 19.294 -4.073 1.00 0.00 H new ATOM 0 HA SER A 11 -15.278 17.126 -3.138 1.00 0.00 H new ATOM 0 HB2 SER A 11 -14.554 19.638 -4.709 1.00 0.00 H new ATOM 0 HB3 SER A 11 -13.383 18.593 -3.930 1.00 0.00 H new ATOM 0 HG SER A 11 -13.686 18.059 -6.166 1.00 0.00 H new ATOM 109 N PHE A 12 -14.086 18.996 -1.535 1.00 0.00 N ATOM 110 CA PHE A 12 -13.819 19.738 -0.309 1.00 0.00 C ATOM 111 C PHE A 12 -13.378 21.165 -0.622 1.00 0.00 C ATOM 112 O PHE A 12 -13.977 22.129 -0.146 1.00 0.00 O ATOM 113 CB PHE A 12 -12.744 19.029 0.518 1.00 0.00 C ATOM 114 CG PHE A 12 -11.447 18.846 -0.217 1.00 0.00 C ATOM 115 CD1 PHE A 12 -11.273 17.783 -1.089 1.00 0.00 C ATOM 116 CD2 PHE A 12 -10.401 19.737 -0.036 1.00 0.00 C ATOM 117 CE1 PHE A 12 -10.081 17.612 -1.767 1.00 0.00 C ATOM 118 CE2 PHE A 12 -9.207 19.571 -0.711 1.00 0.00 C ATOM 119 CZ PHE A 12 -9.046 18.506 -1.577 1.00 0.00 C ATOM 0 H PHE A 12 -13.282 18.488 -1.904 1.00 0.00 H new ATOM 0 HA PHE A 12 -14.742 19.780 0.269 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -12.560 19.601 1.427 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -13.119 18.053 0.826 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -12.079 17.080 -1.241 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -10.521 20.570 0.640 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -9.959 16.780 -2.445 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -8.400 20.273 -0.562 1.00 0.00 H new ATOM 0 HZ PHE A 12 -8.113 18.373 -2.104 1.00 0.00 H new ATOM 129 N SER A 13 -12.326 21.290 -1.424 1.00 0.00 N ATOM 130 CA SER A 13 -11.801 22.598 -1.798 1.00 0.00 C ATOM 131 C SER A 13 -10.677 22.460 -2.821 1.00 0.00 C ATOM 132 O SER A 13 -9.683 21.774 -2.580 1.00 0.00 O ATOM 133 CB SER A 13 -11.292 23.339 -0.560 1.00 0.00 C ATOM 134 OG SER A 13 -10.642 24.546 -0.920 1.00 0.00 O ATOM 0 H SER A 13 -11.820 20.501 -1.827 1.00 0.00 H new ATOM 0 HA SER A 13 -12.610 23.172 -2.249 1.00 0.00 H new ATOM 0 HB2 SER A 13 -12.127 23.556 0.106 1.00 0.00 H new ATOM 0 HB3 SER A 13 -10.602 22.701 -0.008 1.00 0.00 H new ATOM 0 HG SER A 13 -10.327 25.002 -0.112 1.00 0.00 H new ATOM 140 N VAL A 14 -10.842 23.117 -3.964 1.00 0.00 N ATOM 141 CA VAL A 14 -9.842 23.070 -5.024 1.00 0.00 C ATOM 142 C VAL A 14 -9.210 24.440 -5.245 1.00 0.00 C ATOM 143 O VAL A 14 -9.882 25.388 -5.651 1.00 0.00 O ATOM 144 CB VAL A 14 -10.453 22.580 -6.351 1.00 0.00 C ATOM 145 CG1 VAL A 14 -9.378 22.453 -7.419 1.00 0.00 C ATOM 146 CG2 VAL A 14 -11.172 21.255 -6.147 1.00 0.00 C ATOM 0 H VAL A 14 -11.659 23.688 -4.180 1.00 0.00 H new ATOM 0 HA VAL A 14 -9.074 22.366 -4.703 1.00 0.00 H new ATOM 0 HB VAL A 14 -11.182 23.316 -6.690 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -9.828 22.106 -8.349 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -8.911 23.424 -7.582 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -8.623 21.738 -7.092 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -11.598 20.923 -7.094 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -10.464 20.509 -5.786 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -11.970 21.383 -5.415 1.00 0.00 H new ATOM 156 N VAL A 15 -7.912 24.537 -4.975 1.00 0.00 N ATOM 157 CA VAL A 15 -7.187 25.790 -5.145 1.00 0.00 C ATOM 158 C VAL A 15 -5.928 25.588 -5.980 1.00 0.00 C ATOM 159 O VAL A 15 -5.841 26.056 -7.115 1.00 0.00 O ATOM 160 CB VAL A 15 -6.796 26.402 -3.786 1.00 0.00 C ATOM 161 CG1 VAL A 15 -5.806 27.540 -3.977 1.00 0.00 C ATOM 162 CG2 VAL A 15 -8.034 26.881 -3.042 1.00 0.00 C ATOM 0 H VAL A 15 -7.341 23.762 -4.637 1.00 0.00 H new ATOM 0 HA VAL A 15 -7.857 26.475 -5.664 1.00 0.00 H new ATOM 0 HB VAL A 15 -6.314 25.631 -3.185 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -5.542 27.959 -3.006 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -4.908 27.163 -4.466 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -6.258 28.315 -4.596 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -7.740 27.310 -2.084 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -8.546 27.637 -3.637 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -8.704 26.039 -2.871 1.00 0.00 H new ATOM 172 N SER A 16 -4.953 24.887 -5.409 1.00 0.00 N ATOM 173 CA SER A 16 -3.695 24.625 -6.100 1.00 0.00 C ATOM 174 C SER A 16 -3.660 23.200 -6.643 1.00 0.00 C ATOM 175 O SER A 16 -3.732 22.983 -7.852 1.00 0.00 O ATOM 176 CB SER A 16 -2.513 24.852 -5.155 1.00 0.00 C ATOM 177 OG SER A 16 -1.280 24.640 -5.821 1.00 0.00 O ATOM 0 H SER A 16 -5.010 24.491 -4.471 1.00 0.00 H new ATOM 0 HA SER A 16 -3.619 25.317 -6.939 1.00 0.00 H new ATOM 0 HB2 SER A 16 -2.548 25.868 -4.762 1.00 0.00 H new ATOM 0 HB3 SER A 16 -2.590 24.177 -4.302 1.00 0.00 H new ATOM 0 HG SER A 16 -0.540 24.793 -5.197 1.00 0.00 H new ATOM 183 N SER A 17 -3.549 22.231 -5.739 1.00 0.00 N ATOM 184 CA SER A 17 -3.501 20.826 -6.126 1.00 0.00 C ATOM 185 C SER A 17 -2.275 20.542 -6.988 1.00 0.00 C ATOM 186 O SER A 17 -2.342 19.777 -7.950 1.00 0.00 O ATOM 187 CB SER A 17 -4.772 20.441 -6.885 1.00 0.00 C ATOM 188 OG SER A 17 -5.849 20.212 -5.993 1.00 0.00 O ATOM 0 H SER A 17 -3.491 22.394 -4.734 1.00 0.00 H new ATOM 0 HA SER A 17 -3.432 20.226 -5.218 1.00 0.00 H new ATOM 0 HB2 SER A 17 -5.037 21.235 -7.584 1.00 0.00 H new ATOM 0 HB3 SER A 17 -4.589 19.544 -7.476 1.00 0.00 H new ATOM 0 HG SER A 17 -6.650 19.969 -6.503 1.00 0.00 H new ATOM 194 N SER A 18 -1.154 21.164 -6.635 1.00 0.00 N ATOM 195 CA SER A 18 0.088 20.983 -7.378 1.00 0.00 C ATOM 196 C SER A 18 1.206 20.506 -6.456 1.00 0.00 C ATOM 197 O SER A 18 1.521 21.153 -5.457 1.00 0.00 O ATOM 198 CB SER A 18 0.495 22.290 -8.060 1.00 0.00 C ATOM 199 OG SER A 18 1.357 22.045 -9.158 1.00 0.00 O ATOM 0 H SER A 18 -1.081 21.798 -5.839 1.00 0.00 H new ATOM 0 HA SER A 18 -0.080 20.223 -8.141 1.00 0.00 H new ATOM 0 HB2 SER A 18 -0.395 22.817 -8.403 1.00 0.00 H new ATOM 0 HB3 SER A 18 0.993 22.940 -7.340 1.00 0.00 H new ATOM 0 HG SER A 18 1.602 22.896 -9.578 1.00 0.00 H new ATOM 205 N TYR A 19 1.803 19.370 -6.800 1.00 0.00 N ATOM 206 CA TYR A 19 2.886 18.805 -6.003 1.00 0.00 C ATOM 207 C TYR A 19 4.245 19.206 -6.568 1.00 0.00 C ATOM 208 O TYR A 19 4.435 19.316 -7.780 1.00 0.00 O ATOM 209 CB TYR A 19 2.770 17.280 -5.957 1.00 0.00 C ATOM 210 CG TYR A 19 3.228 16.599 -7.228 1.00 0.00 C ATOM 211 CD1 TYR A 19 2.392 16.517 -8.334 1.00 0.00 C ATOM 212 CD2 TYR A 19 4.495 16.038 -7.321 1.00 0.00 C ATOM 213 CE1 TYR A 19 2.805 15.895 -9.497 1.00 0.00 C ATOM 214 CE2 TYR A 19 4.917 15.416 -8.480 1.00 0.00 C ATOM 215 CZ TYR A 19 4.069 15.347 -9.565 1.00 0.00 C ATOM 216 OH TYR A 19 4.485 14.727 -10.721 1.00 0.00 O ATOM 0 H TYR A 19 1.556 18.823 -7.624 1.00 0.00 H new ATOM 0 HA TYR A 19 2.803 19.200 -4.991 1.00 0.00 H new ATOM 0 HB2 TYR A 19 3.359 16.904 -5.121 1.00 0.00 H new ATOM 0 HB3 TYR A 19 1.732 17.009 -5.763 1.00 0.00 H new ATOM 0 HD1 TYR A 19 1.402 16.947 -8.284 1.00 0.00 H new ATOM 0 HD2 TYR A 19 5.162 16.089 -6.473 1.00 0.00 H new ATOM 0 HE1 TYR A 19 2.142 15.838 -10.348 1.00 0.00 H new ATOM 0 HE2 TYR A 19 5.906 14.986 -8.536 1.00 0.00 H new ATOM 0 HH TYR A 19 5.400 14.396 -10.604 1.00 0.00 H new ATOM 226 N PRO A 20 5.215 19.430 -5.670 1.00 0.00 N ATOM 227 CA PRO A 20 6.575 19.821 -6.053 1.00 0.00 C ATOM 228 C PRO A 20 7.333 18.688 -6.736 1.00 0.00 C ATOM 229 O PRO A 20 6.740 17.695 -7.157 1.00 0.00 O ATOM 230 CB PRO A 20 7.232 20.176 -4.717 1.00 0.00 C ATOM 231 CG PRO A 20 6.473 19.394 -3.702 1.00 0.00 C ATOM 232 CD PRO A 20 5.060 19.318 -4.210 1.00 0.00 C ATOM 0 HA PRO A 20 6.576 20.638 -6.774 1.00 0.00 H new ATOM 0 HB2 PRO A 20 8.289 19.910 -4.713 1.00 0.00 H new ATOM 0 HB3 PRO A 20 7.172 21.246 -4.518 1.00 0.00 H new ATOM 0 HG2 PRO A 20 6.898 18.398 -3.579 1.00 0.00 H new ATOM 0 HG3 PRO A 20 6.512 19.879 -2.727 1.00 0.00 H new ATOM 0 HD2 PRO A 20 4.582 18.380 -3.928 1.00 0.00 H new ATOM 0 HD3 PRO A 20 4.445 20.123 -3.808 1.00 0.00 H new ATOM 240 N THR A 21 8.650 18.842 -6.841 1.00 0.00 N ATOM 241 CA THR A 21 9.489 17.833 -7.473 1.00 0.00 C ATOM 242 C THR A 21 10.836 17.718 -6.768 1.00 0.00 C ATOM 243 O THR A 21 11.369 18.704 -6.262 1.00 0.00 O ATOM 244 CB THR A 21 9.728 18.151 -8.961 1.00 0.00 C ATOM 245 OG1 THR A 21 10.238 19.482 -9.102 1.00 0.00 O ATOM 246 CG2 THR A 21 8.440 18.010 -9.758 1.00 0.00 C ATOM 0 H THR A 21 9.158 19.657 -6.496 1.00 0.00 H new ATOM 0 HA THR A 21 8.957 16.885 -7.393 1.00 0.00 H new ATOM 0 HB THR A 21 10.457 17.440 -9.349 1.00 0.00 H new ATOM 0 HG1 THR A 21 10.389 19.676 -10.051 1.00 0.00 H new ATOM 0 HG21 THR A 21 8.634 18.240 -10.806 1.00 0.00 H new ATOM 0 HG22 THR A 21 8.069 16.989 -9.673 1.00 0.00 H new ATOM 0 HG23 THR A 21 7.693 18.701 -9.367 1.00 0.00 H new ATOM 254 N GLY A 22 11.382 16.506 -6.738 1.00 0.00 N ATOM 255 CA GLY A 22 12.663 16.284 -6.092 1.00 0.00 C ATOM 256 C GLY A 22 12.561 15.339 -4.912 1.00 0.00 C ATOM 257 O GLY A 22 13.369 14.420 -4.771 1.00 0.00 O ATOM 0 H GLY A 22 10.960 15.674 -7.150 1.00 0.00 H new ATOM 0 HA2 GLY A 22 13.367 15.879 -6.818 1.00 0.00 H new ATOM 0 HA3 GLY A 22 13.067 17.239 -5.755 1.00 0.00 H new ATOM 261 N LEU A 23 11.568 15.565 -4.059 1.00 0.00 N ATOM 262 CA LEU A 23 11.364 14.727 -2.882 1.00 0.00 C ATOM 263 C LEU A 23 11.775 13.285 -3.163 1.00 0.00 C ATOM 264 O LEU A 23 11.660 12.803 -4.291 1.00 0.00 O ATOM 265 CB LEU A 23 9.899 14.776 -2.444 1.00 0.00 C ATOM 266 CG LEU A 23 8.867 14.899 -3.566 1.00 0.00 C ATOM 267 CD1 LEU A 23 8.404 13.523 -4.018 1.00 0.00 C ATOM 268 CD2 LEU A 23 7.683 15.740 -3.111 1.00 0.00 C ATOM 0 H LEU A 23 10.891 16.322 -4.160 1.00 0.00 H new ATOM 0 HA LEU A 23 11.990 15.114 -2.078 1.00 0.00 H new ATOM 0 HB2 LEU A 23 9.681 13.873 -1.874 1.00 0.00 H new ATOM 0 HB3 LEU A 23 9.771 15.620 -1.766 1.00 0.00 H new ATOM 0 HG LEU A 23 9.337 15.398 -4.414 1.00 0.00 H new ATOM 0 HD11 LEU A 23 7.670 13.630 -4.817 1.00 0.00 H new ATOM 0 HD12 LEU A 23 9.258 12.954 -4.384 1.00 0.00 H new ATOM 0 HD13 LEU A 23 7.951 12.997 -3.177 1.00 0.00 H new ATOM 0 HD21 LEU A 23 6.959 15.817 -3.922 1.00 0.00 H new ATOM 0 HD22 LEU A 23 7.213 15.269 -2.248 1.00 0.00 H new ATOM 0 HD23 LEU A 23 8.029 16.737 -2.837 1.00 0.00 H new ATOM 280 N THR A 24 12.253 12.599 -2.129 1.00 0.00 N ATOM 281 CA THR A 24 12.679 11.212 -2.264 1.00 0.00 C ATOM 282 C THR A 24 12.448 10.438 -0.971 1.00 0.00 C ATOM 283 O THR A 24 11.907 10.972 -0.004 1.00 0.00 O ATOM 284 CB THR A 24 14.168 11.117 -2.647 1.00 0.00 C ATOM 285 OG1 THR A 24 14.912 12.143 -1.980 1.00 0.00 O ATOM 286 CG2 THR A 24 14.350 11.249 -4.152 1.00 0.00 C ATOM 0 H THR A 24 12.355 12.982 -1.189 1.00 0.00 H new ATOM 0 HA THR A 24 12.078 10.772 -3.060 1.00 0.00 H new ATOM 0 HB THR A 24 14.538 10.140 -2.337 1.00 0.00 H new ATOM 0 HG1 THR A 24 15.858 12.075 -2.227 1.00 0.00 H new ATOM 0 HG21 THR A 24 15.410 11.179 -4.398 1.00 0.00 H new ATOM 0 HG22 THR A 24 13.807 10.449 -4.656 1.00 0.00 H new ATOM 0 HG23 THR A 24 13.964 12.214 -4.482 1.00 0.00 H new ATOM 294 N GLY A 25 12.863 9.174 -0.961 1.00 0.00 N ATOM 295 CA GLY A 25 12.693 8.347 0.219 1.00 0.00 C ATOM 296 C GLY A 25 12.702 6.866 -0.105 1.00 0.00 C ATOM 297 O GLY A 25 12.360 6.465 -1.216 1.00 0.00 O ATOM 0 H GLY A 25 13.314 8.709 -1.749 1.00 0.00 H new ATOM 0 HA2 GLY A 25 13.490 8.565 0.930 1.00 0.00 H new ATOM 0 HA3 GLY A 25 11.752 8.604 0.706 1.00 0.00 H new ATOM 301 N GLY A 26 13.097 6.052 0.869 1.00 0.00 N ATOM 302 CA GLY A 26 13.143 4.616 0.662 1.00 0.00 C ATOM 303 C GLY A 26 11.791 3.958 0.850 1.00 0.00 C ATOM 304 O GLY A 26 11.704 2.820 1.310 1.00 0.00 O ATOM 0 H GLY A 26 13.386 6.361 1.797 1.00 0.00 H new ATOM 0 HA2 GLY A 26 13.507 4.409 -0.344 1.00 0.00 H new ATOM 0 HA3 GLY A 26 13.858 4.175 1.357 1.00 0.00 H new ATOM 308 N VAL A 27 10.730 4.677 0.495 1.00 0.00 N ATOM 309 CA VAL A 27 9.375 4.157 0.628 1.00 0.00 C ATOM 310 C VAL A 27 8.652 4.157 -0.715 1.00 0.00 C ATOM 311 O VAL A 27 8.798 5.085 -1.512 1.00 0.00 O ATOM 312 CB VAL A 27 8.555 4.979 1.639 1.00 0.00 C ATOM 313 CG1 VAL A 27 7.139 4.435 1.747 1.00 0.00 C ATOM 314 CG2 VAL A 27 9.237 4.985 2.999 1.00 0.00 C ATOM 0 H VAL A 27 10.784 5.621 0.113 1.00 0.00 H new ATOM 0 HA VAL A 27 9.463 3.133 0.990 1.00 0.00 H new ATOM 0 HB VAL A 27 8.497 6.007 1.282 1.00 0.00 H new ATOM 0 HG11 VAL A 27 6.575 5.029 2.466 1.00 0.00 H new ATOM 0 HG12 VAL A 27 6.654 4.488 0.773 1.00 0.00 H new ATOM 0 HG13 VAL A 27 7.172 3.398 2.080 1.00 0.00 H new ATOM 0 HG21 VAL A 27 8.644 5.571 3.701 1.00 0.00 H new ATOM 0 HG22 VAL A 27 9.327 3.962 3.365 1.00 0.00 H new ATOM 0 HG23 VAL A 27 10.229 5.426 2.906 1.00 0.00 H new ATOM 324 N THR A 28 7.872 3.110 -0.961 1.00 0.00 N ATOM 325 CA THR A 28 7.126 2.987 -2.207 1.00 0.00 C ATOM 326 C THR A 28 5.630 3.160 -1.972 1.00 0.00 C ATOM 327 O THR A 28 5.079 2.628 -1.008 1.00 0.00 O ATOM 328 CB THR A 28 7.375 1.624 -2.879 1.00 0.00 C ATOM 329 OG1 THR A 28 8.781 1.355 -2.936 1.00 0.00 O ATOM 330 CG2 THR A 28 6.792 1.599 -4.284 1.00 0.00 C ATOM 0 H THR A 28 7.740 2.334 -0.313 1.00 0.00 H new ATOM 0 HA THR A 28 7.481 3.779 -2.867 1.00 0.00 H new ATOM 0 HB THR A 28 6.882 0.855 -2.284 1.00 0.00 H new ATOM 0 HG1 THR A 28 8.931 0.486 -3.363 1.00 0.00 H new ATOM 0 HG21 THR A 28 6.980 0.626 -4.739 1.00 0.00 H new ATOM 0 HG22 THR A 28 5.717 1.775 -4.235 1.00 0.00 H new ATOM 0 HG23 THR A 28 7.260 2.378 -4.886 1.00 0.00 H new ATOM 338 N ILE A 29 4.979 3.905 -2.859 1.00 0.00 N ATOM 339 CA ILE A 29 3.545 4.145 -2.748 1.00 0.00 C ATOM 340 C ILE A 29 2.747 2.951 -3.260 1.00 0.00 C ATOM 341 O ILE A 29 3.109 2.331 -4.261 1.00 0.00 O ATOM 342 CB ILE A 29 3.123 5.403 -3.529 1.00 0.00 C ATOM 343 CG1 ILE A 29 3.512 6.664 -2.754 1.00 0.00 C ATOM 344 CG2 ILE A 29 1.626 5.382 -3.799 1.00 0.00 C ATOM 345 CD1 ILE A 29 2.878 6.752 -1.384 1.00 0.00 C ATOM 0 H ILE A 29 5.421 4.353 -3.662 1.00 0.00 H new ATOM 0 HA ILE A 29 3.331 4.295 -1.690 1.00 0.00 H new ATOM 0 HB ILE A 29 3.645 5.411 -4.486 1.00 0.00 H new ATOM 0 HG12 ILE A 29 4.596 6.694 -2.646 1.00 0.00 H new ATOM 0 HG13 ILE A 29 3.225 7.540 -3.335 1.00 0.00 H new ATOM 0 HG21 ILE A 29 1.343 6.278 -4.352 1.00 0.00 H new ATOM 0 HG22 ILE A 29 1.375 4.499 -4.386 1.00 0.00 H new ATOM 0 HG23 ILE A 29 1.086 5.354 -2.853 1.00 0.00 H new ATOM 0 HD11 ILE A 29 3.199 7.671 -0.893 1.00 0.00 H new ATOM 0 HD12 ILE A 29 1.793 6.754 -1.485 1.00 0.00 H new ATOM 0 HD13 ILE A 29 3.185 5.895 -0.785 1.00 0.00 H new ATOM 357 N PHE A 30 1.657 2.634 -2.569 1.00 0.00 N ATOM 358 CA PHE A 30 0.806 1.515 -2.954 1.00 0.00 C ATOM 359 C PHE A 30 -0.667 1.853 -2.742 1.00 0.00 C ATOM 360 O PHE A 30 -1.024 2.554 -1.795 1.00 0.00 O ATOM 361 CB PHE A 30 1.174 0.266 -2.150 1.00 0.00 C ATOM 362 CG PHE A 30 2.300 -0.525 -2.754 1.00 0.00 C ATOM 363 CD1 PHE A 30 3.600 -0.047 -2.712 1.00 0.00 C ATOM 364 CD2 PHE A 30 2.058 -1.746 -3.362 1.00 0.00 C ATOM 365 CE1 PHE A 30 4.637 -0.772 -3.267 1.00 0.00 C ATOM 366 CE2 PHE A 30 3.092 -2.476 -3.919 1.00 0.00 C ATOM 367 CZ PHE A 30 4.383 -1.989 -3.870 1.00 0.00 C ATOM 0 H PHE A 30 1.342 3.137 -1.739 1.00 0.00 H new ATOM 0 HA PHE A 30 0.967 1.318 -4.014 1.00 0.00 H new ATOM 0 HB2 PHE A 30 1.451 0.563 -1.138 1.00 0.00 H new ATOM 0 HB3 PHE A 30 0.296 -0.374 -2.065 1.00 0.00 H new ATOM 0 HD1 PHE A 30 3.805 0.903 -2.240 1.00 0.00 H new ATOM 0 HD2 PHE A 30 1.050 -2.132 -3.401 1.00 0.00 H new ATOM 0 HE1 PHE A 30 5.646 -0.388 -3.230 1.00 0.00 H new ATOM 0 HE2 PHE A 30 2.890 -3.426 -4.392 1.00 0.00 H new ATOM 0 HZ PHE A 30 5.193 -2.558 -4.302 1.00 0.00 H new ATOM 377 N VAL A 31 -1.518 1.351 -3.631 1.00 0.00 N ATOM 378 CA VAL A 31 -2.952 1.599 -3.542 1.00 0.00 C ATOM 379 C VAL A 31 -3.730 0.292 -3.437 1.00 0.00 C ATOM 380 O VAL A 31 -3.334 -0.725 -4.006 1.00 0.00 O ATOM 381 CB VAL A 31 -3.461 2.390 -4.761 1.00 0.00 C ATOM 382 CG1 VAL A 31 -4.952 2.165 -4.959 1.00 0.00 C ATOM 383 CG2 VAL A 31 -3.154 3.872 -4.600 1.00 0.00 C ATOM 0 H VAL A 31 -1.239 0.770 -4.421 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.116 2.190 -2.641 1.00 0.00 H new ATOM 0 HB VAL A 31 -2.942 2.029 -5.649 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -5.294 2.732 -5.825 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -5.141 1.104 -5.122 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -5.491 2.498 -4.072 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -3.521 4.416 -5.470 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -3.644 4.250 -3.703 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -2.077 4.013 -4.511 1.00 0.00 H new ATOM 393 N ALA A 32 -4.840 0.327 -2.707 1.00 0.00 N ATOM 394 CA ALA A 32 -5.675 -0.854 -2.530 1.00 0.00 C ATOM 395 C ALA A 32 -6.753 -0.930 -3.606 1.00 0.00 C ATOM 396 O ALA A 32 -7.652 -0.090 -3.660 1.00 0.00 O ATOM 397 CB ALA A 32 -6.308 -0.849 -1.146 1.00 0.00 C ATOM 0 H ALA A 32 -5.182 1.161 -2.229 1.00 0.00 H new ATOM 0 HA ALA A 32 -5.041 -1.735 -2.625 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -6.929 -1.737 -1.027 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -5.525 -0.850 -0.388 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -6.924 0.043 -1.031 1.00 0.00 H new ATOM 403 N LEU A 33 -6.656 -1.941 -4.462 1.00 0.00 N ATOM 404 CA LEU A 33 -7.623 -2.127 -5.539 1.00 0.00 C ATOM 405 C LEU A 33 -8.900 -2.777 -5.018 1.00 0.00 C ATOM 406 O LEU A 33 -9.999 -2.467 -5.478 1.00 0.00 O ATOM 407 CB LEU A 33 -7.018 -2.986 -6.651 1.00 0.00 C ATOM 408 CG LEU A 33 -5.559 -2.695 -7.005 1.00 0.00 C ATOM 409 CD1 LEU A 33 -5.034 -3.725 -7.993 1.00 0.00 C ATOM 410 CD2 LEU A 33 -5.416 -1.290 -7.571 1.00 0.00 C ATOM 0 H LEU A 33 -5.918 -2.644 -4.432 1.00 0.00 H new ATOM 0 HA LEU A 33 -7.875 -1.146 -5.941 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.098 -4.033 -6.358 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -7.621 -2.859 -7.550 1.00 0.00 H new ATOM 0 HG LEU A 33 -4.965 -2.759 -6.093 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -3.994 -3.502 -8.233 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -5.099 -4.719 -7.551 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -5.632 -3.693 -8.904 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -4.371 -1.101 -7.817 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -6.023 -1.197 -8.471 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -5.751 -0.564 -6.831 1.00 0.00 H new ATOM 422 N TYR A 34 -8.748 -3.677 -4.053 1.00 0.00 N ATOM 423 CA TYR A 34 -9.890 -4.371 -3.468 1.00 0.00 C ATOM 424 C TYR A 34 -10.036 -4.029 -1.989 1.00 0.00 C ATOM 425 O TYR A 34 -9.045 -3.862 -1.278 1.00 0.00 O ATOM 426 CB TYR A 34 -9.738 -5.883 -3.641 1.00 0.00 C ATOM 427 CG TYR A 34 -9.005 -6.278 -4.904 1.00 0.00 C ATOM 428 CD1 TYR A 34 -9.655 -6.292 -6.132 1.00 0.00 C ATOM 429 CD2 TYR A 34 -7.663 -6.636 -4.869 1.00 0.00 C ATOM 430 CE1 TYR A 34 -8.990 -6.653 -7.288 1.00 0.00 C ATOM 431 CE2 TYR A 34 -6.990 -6.997 -6.020 1.00 0.00 C ATOM 432 CZ TYR A 34 -7.658 -7.004 -7.227 1.00 0.00 C ATOM 433 OH TYR A 34 -6.991 -7.363 -8.375 1.00 0.00 O ATOM 0 H TYR A 34 -7.846 -3.943 -3.659 1.00 0.00 H new ATOM 0 HA TYR A 34 -10.789 -4.041 -3.989 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -9.205 -6.287 -2.780 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -10.727 -6.341 -3.647 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -10.698 -6.016 -6.184 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -7.137 -6.632 -3.926 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -9.511 -6.660 -8.234 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -5.947 -7.272 -5.975 1.00 0.00 H new ATOM 0 HH TYR A 34 -6.060 -7.580 -8.158 1.00 0.00 H new ATOM 443 N ASP A 35 -11.279 -3.928 -1.532 1.00 0.00 N ATOM 444 CA ASP A 35 -11.557 -3.608 -0.136 1.00 0.00 C ATOM 445 C ASP A 35 -11.270 -4.806 0.764 1.00 0.00 C ATOM 446 O ASP A 35 -11.718 -5.920 0.492 1.00 0.00 O ATOM 447 CB ASP A 35 -13.013 -3.168 0.028 1.00 0.00 C ATOM 448 CG ASP A 35 -13.993 -4.276 -0.302 1.00 0.00 C ATOM 449 OD1 ASP A 35 -13.841 -4.903 -1.371 1.00 0.00 O ATOM 450 OD2 ASP A 35 -14.913 -4.516 0.507 1.00 0.00 O ATOM 0 H ASP A 35 -12.110 -4.063 -2.107 1.00 0.00 H new ATOM 0 HA ASP A 35 -10.902 -2.789 0.161 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -13.176 -2.836 1.053 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -13.206 -2.312 -0.618 1.00 0.00 H new ATOM 455 N TYR A 36 -10.520 -4.569 1.834 1.00 0.00 N ATOM 456 CA TYR A 36 -10.170 -5.629 2.772 1.00 0.00 C ATOM 457 C TYR A 36 -10.503 -5.221 4.204 1.00 0.00 C ATOM 458 O TYR A 36 -10.802 -4.058 4.476 1.00 0.00 O ATOM 459 CB TYR A 36 -8.683 -5.968 2.659 1.00 0.00 C ATOM 460 CG TYR A 36 -8.193 -6.907 3.738 1.00 0.00 C ATOM 461 CD1 TYR A 36 -8.426 -8.274 3.655 1.00 0.00 C ATOM 462 CD2 TYR A 36 -7.497 -6.427 4.841 1.00 0.00 C ATOM 463 CE1 TYR A 36 -7.980 -9.136 4.638 1.00 0.00 C ATOM 464 CE2 TYR A 36 -7.047 -7.282 5.829 1.00 0.00 C ATOM 465 CZ TYR A 36 -7.291 -8.635 5.723 1.00 0.00 C ATOM 466 OH TYR A 36 -6.845 -9.489 6.705 1.00 0.00 O ATOM 0 H TYR A 36 -10.143 -3.652 2.074 1.00 0.00 H new ATOM 0 HA TYR A 36 -10.757 -6.512 2.519 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -8.494 -6.418 1.684 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -8.104 -5.045 2.702 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -8.965 -8.670 2.807 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -7.305 -5.368 4.927 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -8.170 -10.196 4.558 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -6.507 -6.893 6.680 1.00 0.00 H new ATOM 0 HH TYR A 36 -5.988 -9.880 6.434 1.00 0.00 H new ATOM 476 N GLU A 37 -10.449 -6.187 5.116 1.00 0.00 N ATOM 477 CA GLU A 37 -10.745 -5.929 6.520 1.00 0.00 C ATOM 478 C GLU A 37 -9.725 -6.614 7.426 1.00 0.00 C ATOM 479 O GLU A 37 -9.580 -7.836 7.401 1.00 0.00 O ATOM 480 CB GLU A 37 -12.155 -6.412 6.864 1.00 0.00 C ATOM 481 CG GLU A 37 -12.665 -5.899 8.201 1.00 0.00 C ATOM 482 CD GLU A 37 -13.715 -6.807 8.812 1.00 0.00 C ATOM 483 OE1 GLU A 37 -14.890 -6.715 8.399 1.00 0.00 O ATOM 484 OE2 GLU A 37 -13.362 -7.608 9.702 1.00 0.00 O ATOM 0 H GLU A 37 -10.203 -7.155 4.907 1.00 0.00 H new ATOM 0 HA GLU A 37 -10.687 -4.853 6.685 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -12.840 -6.096 6.078 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -12.164 -7.502 6.875 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -11.828 -5.802 8.892 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -13.085 -4.902 8.067 1.00 0.00 H new ATOM 491 N ALA A 38 -9.021 -5.818 8.223 1.00 0.00 N ATOM 492 CA ALA A 38 -8.017 -6.346 9.137 1.00 0.00 C ATOM 493 C ALA A 38 -8.603 -7.437 10.026 1.00 0.00 C ATOM 494 O ALA A 38 -9.398 -7.159 10.924 1.00 0.00 O ATOM 495 CB ALA A 38 -7.435 -5.226 9.987 1.00 0.00 C ATOM 0 H ALA A 38 -9.128 -4.804 8.254 1.00 0.00 H new ATOM 0 HA ALA A 38 -7.218 -6.789 8.542 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -6.686 -5.635 10.665 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -6.970 -4.482 9.340 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -8.231 -4.757 10.566 1.00 0.00 H new ATOM 501 N ARG A 39 -8.207 -8.680 9.769 1.00 0.00 N ATOM 502 CA ARG A 39 -8.696 -9.813 10.546 1.00 0.00 C ATOM 503 C ARG A 39 -8.268 -9.697 12.006 1.00 0.00 C ATOM 504 O ARG A 39 -9.079 -9.867 12.917 1.00 0.00 O ATOM 505 CB ARG A 39 -8.177 -11.125 9.954 1.00 0.00 C ATOM 506 CG ARG A 39 -8.987 -11.620 8.767 1.00 0.00 C ATOM 507 CD ARG A 39 -8.205 -12.630 7.941 1.00 0.00 C ATOM 508 NE ARG A 39 -9.085 -13.549 7.224 1.00 0.00 N ATOM 509 CZ ARG A 39 -9.600 -14.647 7.765 1.00 0.00 C ATOM 510 NH1 ARG A 39 -9.325 -14.962 9.023 1.00 0.00 N ATOM 511 NH2 ARG A 39 -10.393 -15.433 7.048 1.00 0.00 N ATOM 0 H ARG A 39 -7.550 -8.928 9.029 1.00 0.00 H new ATOM 0 HA ARG A 39 -9.785 -9.808 10.504 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -7.141 -10.989 9.645 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -8.180 -11.890 10.730 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -9.912 -12.076 9.121 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -9.268 -10.775 8.139 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -7.573 -12.102 7.227 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -7.543 -13.198 8.595 1.00 0.00 H new ATOM 0 HE ARG A 39 -9.317 -13.336 6.254 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -8.716 -14.360 9.578 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -9.722 -15.806 9.436 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -10.608 -15.194 6.080 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -10.788 -16.276 7.465 1.00 0.00 H new ATOM 525 N THR A 40 -6.989 -9.407 12.221 1.00 0.00 N ATOM 526 CA THR A 40 -6.453 -9.270 13.569 1.00 0.00 C ATOM 527 C THR A 40 -5.719 -7.944 13.737 1.00 0.00 C ATOM 528 O THR A 40 -5.285 -7.334 12.759 1.00 0.00 O ATOM 529 CB THR A 40 -5.490 -10.423 13.911 1.00 0.00 C ATOM 530 OG1 THR A 40 -4.267 -10.273 13.182 1.00 0.00 O ATOM 531 CG2 THR A 40 -6.120 -11.768 13.584 1.00 0.00 C ATOM 0 H THR A 40 -6.305 -9.262 11.478 1.00 0.00 H new ATOM 0 HA THR A 40 -7.303 -9.301 14.251 1.00 0.00 H new ATOM 0 HB THR A 40 -5.281 -10.388 14.980 1.00 0.00 H new ATOM 0 HG1 THR A 40 -3.660 -11.009 13.406 1.00 0.00 H new ATOM 0 HG21 THR A 40 -5.422 -12.567 13.834 1.00 0.00 H new ATOM 0 HG22 THR A 40 -7.035 -11.892 14.163 1.00 0.00 H new ATOM 0 HG23 THR A 40 -6.355 -11.811 12.521 1.00 0.00 H new ATOM 539 N THR A 41 -5.583 -7.502 14.984 1.00 0.00 N ATOM 540 CA THR A 41 -4.902 -6.248 15.280 1.00 0.00 C ATOM 541 C THR A 41 -3.592 -6.138 14.508 1.00 0.00 C ATOM 542 O THR A 41 -3.146 -5.039 14.179 1.00 0.00 O ATOM 543 CB THR A 41 -4.610 -6.109 16.786 1.00 0.00 C ATOM 544 OG1 THR A 41 -3.999 -4.841 17.051 1.00 0.00 O ATOM 545 CG2 THR A 41 -3.699 -7.228 17.266 1.00 0.00 C ATOM 0 H THR A 41 -5.936 -7.994 15.805 1.00 0.00 H new ATOM 0 HA THR A 41 -5.571 -5.445 14.971 1.00 0.00 H new ATOM 0 HB THR A 41 -5.555 -6.176 17.325 1.00 0.00 H new ATOM 0 HG1 THR A 41 -3.818 -4.759 18.011 1.00 0.00 H new ATOM 0 HG21 THR A 41 -3.507 -7.109 18.332 1.00 0.00 H new ATOM 0 HG22 THR A 41 -4.180 -8.190 17.089 1.00 0.00 H new ATOM 0 HG23 THR A 41 -2.756 -7.189 16.721 1.00 0.00 H new ATOM 553 N GLU A 42 -2.981 -7.283 14.221 1.00 0.00 N ATOM 554 CA GLU A 42 -1.722 -7.314 13.487 1.00 0.00 C ATOM 555 C GLU A 42 -1.930 -6.903 12.032 1.00 0.00 C ATOM 556 O GLU A 42 -1.085 -6.232 11.439 1.00 0.00 O ATOM 557 CB GLU A 42 -1.102 -8.711 13.551 1.00 0.00 C ATOM 558 CG GLU A 42 -0.651 -9.114 14.945 1.00 0.00 C ATOM 559 CD GLU A 42 0.731 -8.593 15.284 1.00 0.00 C ATOM 560 OE1 GLU A 42 1.723 -9.200 14.830 1.00 0.00 O ATOM 561 OE2 GLU A 42 0.821 -7.576 16.004 1.00 0.00 O ATOM 0 H GLU A 42 -3.338 -8.201 14.486 1.00 0.00 H new ATOM 0 HA GLU A 42 -1.042 -6.602 13.954 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -1.828 -9.439 13.189 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -0.247 -8.751 12.876 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -1.366 -8.739 15.677 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -0.655 -10.201 15.024 1.00 0.00 H new ATOM 568 N ASP A 43 -3.059 -7.312 11.464 1.00 0.00 N ATOM 569 CA ASP A 43 -3.379 -6.988 10.079 1.00 0.00 C ATOM 570 C ASP A 43 -3.798 -5.527 9.946 1.00 0.00 C ATOM 571 O ASP A 43 -4.422 -4.965 10.847 1.00 0.00 O ATOM 572 CB ASP A 43 -4.493 -7.900 9.564 1.00 0.00 C ATOM 573 CG ASP A 43 -3.970 -9.237 9.080 1.00 0.00 C ATOM 574 OD1 ASP A 43 -2.890 -9.260 8.452 1.00 0.00 O ATOM 575 OD2 ASP A 43 -4.638 -10.262 9.329 1.00 0.00 O ATOM 0 H ASP A 43 -3.768 -7.869 11.941 1.00 0.00 H new ATOM 0 HA ASP A 43 -2.484 -7.147 9.478 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -5.221 -8.064 10.359 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -5.018 -7.402 8.749 1.00 0.00 H new ATOM 580 N LEU A 44 -3.449 -4.917 8.819 1.00 0.00 N ATOM 581 CA LEU A 44 -3.788 -3.520 8.568 1.00 0.00 C ATOM 582 C LEU A 44 -5.127 -3.406 7.847 1.00 0.00 C ATOM 583 O LEU A 44 -5.361 -4.075 6.841 1.00 0.00 O ATOM 584 CB LEU A 44 -2.691 -2.850 7.739 1.00 0.00 C ATOM 585 CG LEU A 44 -2.493 -1.352 7.974 1.00 0.00 C ATOM 586 CD1 LEU A 44 -1.908 -0.691 6.736 1.00 0.00 C ATOM 587 CD2 LEU A 44 -3.809 -0.694 8.361 1.00 0.00 C ATOM 0 H LEU A 44 -2.931 -5.367 8.064 1.00 0.00 H new ATOM 0 HA LEU A 44 -3.870 -3.013 9.529 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -1.748 -3.357 7.943 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -2.915 -3.005 6.684 1.00 0.00 H new ATOM 0 HG LEU A 44 -1.790 -1.222 8.797 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -1.774 0.375 6.921 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -0.944 -1.143 6.503 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -2.586 -0.830 5.894 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -3.649 0.372 8.524 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -4.535 -0.833 7.560 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -4.188 -1.148 9.277 1.00 0.00 H new ATOM 599 N SER A 45 -6.002 -2.551 8.368 1.00 0.00 N ATOM 600 CA SER A 45 -7.319 -2.350 7.775 1.00 0.00 C ATOM 601 C SER A 45 -7.265 -1.290 6.679 1.00 0.00 C ATOM 602 O SER A 45 -7.018 -0.114 6.948 1.00 0.00 O ATOM 603 CB SER A 45 -8.328 -1.938 8.850 1.00 0.00 C ATOM 604 OG SER A 45 -8.102 -0.606 9.278 1.00 0.00 O ATOM 0 H SER A 45 -5.823 -1.987 9.199 1.00 0.00 H new ATOM 0 HA SER A 45 -7.638 -3.292 7.330 1.00 0.00 H new ATOM 0 HB2 SER A 45 -9.341 -2.030 8.457 1.00 0.00 H new ATOM 0 HB3 SER A 45 -8.254 -2.614 9.701 1.00 0.00 H new ATOM 0 HG SER A 45 -7.414 -0.194 8.715 1.00 0.00 H new ATOM 610 N PHE A 46 -7.499 -1.715 5.442 1.00 0.00 N ATOM 611 CA PHE A 46 -7.476 -0.804 4.304 1.00 0.00 C ATOM 612 C PHE A 46 -8.737 -0.958 3.458 1.00 0.00 C ATOM 613 O PHE A 46 -9.482 -1.928 3.604 1.00 0.00 O ATOM 614 CB PHE A 46 -6.237 -1.059 3.443 1.00 0.00 C ATOM 615 CG PHE A 46 -6.085 -2.493 3.022 1.00 0.00 C ATOM 616 CD1 PHE A 46 -5.534 -3.427 3.883 1.00 0.00 C ATOM 617 CD2 PHE A 46 -6.495 -2.906 1.764 1.00 0.00 C ATOM 618 CE1 PHE A 46 -5.392 -4.747 3.496 1.00 0.00 C ATOM 619 CE2 PHE A 46 -6.357 -4.224 1.373 1.00 0.00 C ATOM 620 CZ PHE A 46 -5.806 -5.146 2.240 1.00 0.00 C ATOM 0 H PHE A 46 -7.707 -2.684 5.202 1.00 0.00 H new ATOM 0 HA PHE A 46 -7.439 0.215 4.688 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -6.287 -0.431 2.554 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -5.350 -0.756 3.998 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -5.212 -3.121 4.867 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -6.927 -2.189 1.082 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -4.958 -5.466 4.175 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -6.680 -4.533 0.390 1.00 0.00 H new ATOM 0 HZ PHE A 46 -5.699 -6.177 1.937 1.00 0.00 H new ATOM 630 N LYS A 47 -8.971 0.006 2.574 1.00 0.00 N ATOM 631 CA LYS A 47 -10.140 -0.021 1.703 1.00 0.00 C ATOM 632 C LYS A 47 -9.749 0.267 0.257 1.00 0.00 C ATOM 633 O LYS A 47 -8.674 0.804 -0.011 1.00 0.00 O ATOM 634 CB LYS A 47 -11.176 1.001 2.176 1.00 0.00 C ATOM 635 CG LYS A 47 -11.702 0.732 3.575 1.00 0.00 C ATOM 636 CD LYS A 47 -12.711 -0.404 3.583 1.00 0.00 C ATOM 637 CE LYS A 47 -12.799 -1.062 4.952 1.00 0.00 C ATOM 638 NZ LYS A 47 -13.699 -0.312 5.871 1.00 0.00 N ATOM 0 H LYS A 47 -8.366 0.816 2.442 1.00 0.00 H new ATOM 0 HA LYS A 47 -10.575 -1.019 1.750 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -10.731 1.996 2.149 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -12.013 1.007 1.477 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -10.871 0.486 4.236 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -12.167 1.635 3.970 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -13.692 -0.023 3.298 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -12.429 -1.148 2.838 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -13.163 -2.084 4.841 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -11.803 -1.124 5.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -13.732 -0.792 6.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -13.338 0.655 5.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -14.656 -0.275 5.466 1.00 0.00 H new ATOM 652 N LYS A 48 -10.628 -0.092 -0.672 1.00 0.00 N ATOM 653 CA LYS A 48 -10.377 0.130 -2.090 1.00 0.00 C ATOM 654 C LYS A 48 -10.229 1.618 -2.390 1.00 0.00 C ATOM 655 O LYS A 48 -11.190 2.380 -2.288 1.00 0.00 O ATOM 656 CB LYS A 48 -11.513 -0.460 -2.929 1.00 0.00 C ATOM 657 CG LYS A 48 -11.463 -0.054 -4.392 1.00 0.00 C ATOM 658 CD LYS A 48 -12.345 -0.946 -5.249 1.00 0.00 C ATOM 659 CE LYS A 48 -12.032 -0.784 -6.728 1.00 0.00 C ATOM 660 NZ LYS A 48 -12.693 -1.833 -7.554 1.00 0.00 N ATOM 0 H LYS A 48 -11.522 -0.539 -0.467 1.00 0.00 H new ATOM 0 HA LYS A 48 -9.444 -0.370 -2.351 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -11.477 -1.547 -2.861 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -12.467 -0.146 -2.506 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -11.784 0.983 -4.494 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -10.435 -0.106 -4.750 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -12.203 -1.987 -4.958 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -13.393 -0.704 -5.069 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -12.359 0.201 -7.062 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -10.953 -0.830 -6.878 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -12.455 -1.687 -8.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -12.362 -2.772 -7.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -13.724 -1.773 -7.431 1.00 0.00 H new ATOM 674 N GLY A 49 -9.019 2.026 -2.762 1.00 0.00 N ATOM 675 CA GLY A 49 -8.769 3.421 -3.072 1.00 0.00 C ATOM 676 C GLY A 49 -8.008 4.132 -1.971 1.00 0.00 C ATOM 677 O GLY A 49 -7.960 5.362 -1.936 1.00 0.00 O ATOM 0 H GLY A 49 -8.208 1.415 -2.854 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -8.204 3.488 -4.002 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -9.719 3.929 -3.239 1.00 0.00 H new ATOM 681 N GLU A 50 -7.415 3.358 -1.068 1.00 0.00 N ATOM 682 CA GLU A 50 -6.656 3.923 0.041 1.00 0.00 C ATOM 683 C GLU A 50 -5.161 3.673 -0.139 1.00 0.00 C ATOM 684 O GLU A 50 -4.745 2.572 -0.499 1.00 0.00 O ATOM 685 CB GLU A 50 -7.128 3.325 1.368 1.00 0.00 C ATOM 686 CG GLU A 50 -6.938 4.254 2.556 1.00 0.00 C ATOM 687 CD GLU A 50 -7.438 3.651 3.854 1.00 0.00 C ATOM 688 OE1 GLU A 50 -8.585 3.158 3.877 1.00 0.00 O ATOM 689 OE2 GLU A 50 -6.681 3.671 4.847 1.00 0.00 O ATOM 0 H GLU A 50 -7.446 2.339 -1.083 1.00 0.00 H new ATOM 0 HA GLU A 50 -6.828 4.999 0.054 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -8.184 3.066 1.285 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -6.586 2.398 1.552 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -5.880 4.497 2.657 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -7.464 5.190 2.368 1.00 0.00 H new ATOM 696 N ARG A 51 -4.360 4.703 0.113 1.00 0.00 N ATOM 697 CA ARG A 51 -2.912 4.596 -0.023 1.00 0.00 C ATOM 698 C ARG A 51 -2.280 4.100 1.274 1.00 0.00 C ATOM 699 O ARG A 51 -2.891 4.167 2.341 1.00 0.00 O ATOM 700 CB ARG A 51 -2.314 5.950 -0.410 1.00 0.00 C ATOM 701 CG ARG A 51 -2.620 6.364 -1.839 1.00 0.00 C ATOM 702 CD ARG A 51 -1.515 7.235 -2.416 1.00 0.00 C ATOM 703 NE ARG A 51 -1.829 7.697 -3.765 1.00 0.00 N ATOM 704 CZ ARG A 51 -0.973 8.364 -4.532 1.00 0.00 C ATOM 705 NH1 ARG A 51 0.243 8.645 -4.084 1.00 0.00 N ATOM 706 NH2 ARG A 51 -1.333 8.750 -5.749 1.00 0.00 N ATOM 0 H ARG A 51 -4.689 5.621 0.412 1.00 0.00 H new ATOM 0 HA ARG A 51 -2.698 3.874 -0.811 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -2.694 6.713 0.270 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -1.233 5.912 -0.275 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -2.745 5.475 -2.458 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -3.565 6.907 -1.867 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -1.356 8.096 -1.766 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -0.582 6.672 -2.434 1.00 0.00 H new ATOM 0 HE ARG A 51 -2.756 7.497 -4.139 1.00 0.00 H new ATOM 0 HH11 ARG A 51 0.523 8.349 -3.149 1.00 0.00 H new ATOM 0 HH12 ARG A 51 0.898 9.157 -4.675 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -2.267 8.535 -6.097 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -0.675 9.262 -6.337 1.00 0.00 H new ATOM 720 N PHE A 52 -1.052 3.602 1.175 1.00 0.00 N ATOM 721 CA PHE A 52 -0.336 3.093 2.339 1.00 0.00 C ATOM 722 C PHE A 52 1.168 3.070 2.086 1.00 0.00 C ATOM 723 O PHE A 52 1.622 2.659 1.019 1.00 0.00 O ATOM 724 CB PHE A 52 -0.827 1.687 2.692 1.00 0.00 C ATOM 725 CG PHE A 52 -2.316 1.600 2.872 1.00 0.00 C ATOM 726 CD1 PHE A 52 -3.143 1.336 1.793 1.00 0.00 C ATOM 727 CD2 PHE A 52 -2.887 1.781 4.121 1.00 0.00 C ATOM 728 CE1 PHE A 52 -4.514 1.254 1.956 1.00 0.00 C ATOM 729 CE2 PHE A 52 -4.257 1.700 4.290 1.00 0.00 C ATOM 730 CZ PHE A 52 -5.071 1.438 3.206 1.00 0.00 C ATOM 0 H PHE A 52 -0.532 3.540 0.300 1.00 0.00 H new ATOM 0 HA PHE A 52 -0.535 3.761 3.177 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -0.523 0.996 1.905 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -0.338 1.360 3.610 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -2.712 1.192 0.813 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -2.255 1.988 4.972 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -5.148 1.046 1.107 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -4.690 1.842 5.269 1.00 0.00 H new ATOM 0 HZ PHE A 52 -6.141 1.377 3.336 1.00 0.00 H new ATOM 740 N GLN A 53 1.935 3.516 3.076 1.00 0.00 N ATOM 741 CA GLN A 53 3.389 3.547 2.960 1.00 0.00 C ATOM 742 C GLN A 53 3.993 2.193 3.314 1.00 0.00 C ATOM 743 O GLN A 53 3.931 1.756 4.464 1.00 0.00 O ATOM 744 CB GLN A 53 3.970 4.632 3.869 1.00 0.00 C ATOM 745 CG GLN A 53 3.890 6.029 3.277 1.00 0.00 C ATOM 746 CD GLN A 53 3.923 7.114 4.335 1.00 0.00 C ATOM 747 OE1 GLN A 53 3.441 6.923 5.452 1.00 0.00 O ATOM 748 NE2 GLN A 53 4.494 8.262 3.989 1.00 0.00 N ATOM 0 H GLN A 53 1.575 3.860 3.966 1.00 0.00 H new ATOM 0 HA GLN A 53 3.641 3.776 1.925 1.00 0.00 H new ATOM 0 HB2 GLN A 53 3.439 4.619 4.821 1.00 0.00 H new ATOM 0 HB3 GLN A 53 5.013 4.396 4.082 1.00 0.00 H new ATOM 0 HG2 GLN A 53 4.721 6.175 2.586 1.00 0.00 H new ATOM 0 HG3 GLN A 53 2.972 6.121 2.696 1.00 0.00 H new ATOM 0 HE21 GLN A 53 4.881 8.377 3.052 1.00 0.00 H new ATOM 0 HE22 GLN A 53 4.546 9.028 4.660 1.00 0.00 H new ATOM 757 N ILE A 54 4.576 1.532 2.319 1.00 0.00 N ATOM 758 CA ILE A 54 5.192 0.228 2.526 1.00 0.00 C ATOM 759 C ILE A 54 6.408 0.333 3.440 1.00 0.00 C ATOM 760 O ILE A 54 7.430 0.909 3.066 1.00 0.00 O ATOM 761 CB ILE A 54 5.620 -0.411 1.192 1.00 0.00 C ATOM 762 CG1 ILE A 54 4.424 -0.512 0.243 1.00 0.00 C ATOM 763 CG2 ILE A 54 6.229 -1.784 1.433 1.00 0.00 C ATOM 764 CD1 ILE A 54 3.255 -1.276 0.823 1.00 0.00 C ATOM 0 H ILE A 54 4.634 1.879 1.362 1.00 0.00 H new ATOM 0 HA ILE A 54 4.440 -0.405 2.997 1.00 0.00 H new ATOM 0 HB ILE A 54 6.375 0.223 0.728 1.00 0.00 H new ATOM 0 HG12 ILE A 54 4.095 0.493 -0.022 1.00 0.00 H new ATOM 0 HG13 ILE A 54 4.743 -0.997 -0.680 1.00 0.00 H new ATOM 0 HG21 ILE A 54 6.526 -2.222 0.480 1.00 0.00 H new ATOM 0 HG22 ILE A 54 7.104 -1.686 2.076 1.00 0.00 H new ATOM 0 HG23 ILE A 54 5.494 -2.428 1.915 1.00 0.00 H new ATOM 0 HD11 ILE A 54 2.444 -1.307 0.095 1.00 0.00 H new ATOM 0 HD12 ILE A 54 3.567 -2.292 1.062 1.00 0.00 H new ATOM 0 HD13 ILE A 54 2.910 -0.780 1.730 1.00 0.00 H new ATOM 776 N ILE A 55 6.291 -0.229 4.638 1.00 0.00 N ATOM 777 CA ILE A 55 7.382 -0.201 5.605 1.00 0.00 C ATOM 778 C ILE A 55 8.311 -1.396 5.419 1.00 0.00 C ATOM 779 O ILE A 55 9.526 -1.239 5.309 1.00 0.00 O ATOM 780 CB ILE A 55 6.853 -0.196 7.051 1.00 0.00 C ATOM 781 CG1 ILE A 55 5.843 0.937 7.244 1.00 0.00 C ATOM 782 CG2 ILE A 55 8.005 -0.060 8.036 1.00 0.00 C ATOM 783 CD1 ILE A 55 4.888 0.705 8.394 1.00 0.00 C ATOM 0 H ILE A 55 5.452 -0.709 4.963 1.00 0.00 H new ATOM 0 HA ILE A 55 7.938 0.720 5.428 1.00 0.00 H new ATOM 0 HB ILE A 55 6.348 -1.143 7.241 1.00 0.00 H new ATOM 0 HG12 ILE A 55 6.382 1.869 7.413 1.00 0.00 H new ATOM 0 HG13 ILE A 55 5.270 1.062 6.326 1.00 0.00 H new ATOM 0 HG21 ILE A 55 7.615 -0.058 9.054 1.00 0.00 H new ATOM 0 HG22 ILE A 55 8.691 -0.898 7.912 1.00 0.00 H new ATOM 0 HG23 ILE A 55 8.535 0.874 7.849 1.00 0.00 H new ATOM 0 HD11 ILE A 55 4.201 1.548 8.472 1.00 0.00 H new ATOM 0 HD12 ILE A 55 4.322 -0.210 8.218 1.00 0.00 H new ATOM 0 HD13 ILE A 55 5.452 0.610 9.322 1.00 0.00 H new ATOM 795 N ASN A 56 7.730 -2.591 5.383 1.00 0.00 N ATOM 796 CA ASN A 56 8.506 -3.813 5.209 1.00 0.00 C ATOM 797 C ASN A 56 7.894 -4.697 4.126 1.00 0.00 C ATOM 798 O ASN A 56 6.713 -5.037 4.183 1.00 0.00 O ATOM 799 CB ASN A 56 8.584 -4.584 6.528 1.00 0.00 C ATOM 800 CG ASN A 56 9.860 -5.396 6.649 1.00 0.00 C ATOM 801 OD1 ASN A 56 10.458 -5.785 5.646 1.00 0.00 O ATOM 802 ND2 ASN A 56 10.282 -5.654 7.881 1.00 0.00 N ATOM 0 H ASN A 56 6.725 -2.739 5.472 1.00 0.00 H new ATOM 0 HA ASN A 56 9.513 -3.533 4.899 1.00 0.00 H new ATOM 0 HB2 ASN A 56 8.523 -3.882 7.360 1.00 0.00 H new ATOM 0 HB3 ASN A 56 7.724 -5.249 6.608 1.00 0.00 H new ATOM 0 HD21 ASN A 56 11.135 -6.195 8.025 1.00 0.00 H new ATOM 0 HD22 ASN A 56 9.754 -5.311 8.683 1.00 0.00 H new ATOM 809 N ASN A 57 8.706 -5.064 3.141 1.00 0.00 N ATOM 810 CA ASN A 57 8.245 -5.908 2.045 1.00 0.00 C ATOM 811 C ASN A 57 9.044 -7.207 1.984 1.00 0.00 C ATOM 812 O ASN A 57 9.379 -7.694 0.904 1.00 0.00 O ATOM 813 CB ASN A 57 8.363 -5.162 0.714 1.00 0.00 C ATOM 814 CG ASN A 57 9.801 -4.842 0.356 1.00 0.00 C ATOM 815 OD1 ASN A 57 10.137 -3.558 0.349 1.00 0.00 O flip ATOM 816 ND2 ASN A 57 10.600 -5.740 0.089 1.00 0.00 N flip ATOM 0 H ASN A 57 9.687 -4.790 3.079 1.00 0.00 H new ATOM 0 HA ASN A 57 7.198 -6.154 2.225 1.00 0.00 H new ATOM 0 HB2 ASN A 57 7.920 -5.766 -0.078 1.00 0.00 H new ATOM 0 HB3 ASN A 57 7.790 -4.236 0.768 1.00 0.00 H new ATOM 0 HD21 ASN A 57 10.297 -6.714 0.107 1.00 0.00 H new ATOM 0 HD22 ASN A 57 11.565 -5.510 -0.150 1.00 0.00 H new ATOM 823 N THR A 58 9.346 -7.764 3.153 1.00 0.00 N ATOM 824 CA THR A 58 10.106 -9.005 3.234 1.00 0.00 C ATOM 825 C THR A 58 9.191 -10.219 3.115 1.00 0.00 C ATOM 826 O THR A 58 9.514 -11.184 2.423 1.00 0.00 O ATOM 827 CB THR A 58 10.892 -9.097 4.555 1.00 0.00 C ATOM 828 OG1 THR A 58 11.605 -10.338 4.616 1.00 0.00 O ATOM 829 CG2 THR A 58 9.957 -8.985 5.750 1.00 0.00 C ATOM 0 H THR A 58 9.076 -7.375 4.056 1.00 0.00 H new ATOM 0 HA THR A 58 10.809 -9.000 2.401 1.00 0.00 H new ATOM 0 HB THR A 58 11.600 -8.269 4.589 1.00 0.00 H new ATOM 0 HG1 THR A 58 12.103 -10.388 5.458 1.00 0.00 H new ATOM 0 HG21 THR A 58 10.535 -9.053 6.672 1.00 0.00 H new ATOM 0 HG22 THR A 58 9.437 -8.027 5.717 1.00 0.00 H new ATOM 0 HG23 THR A 58 9.228 -9.795 5.719 1.00 0.00 H new ATOM 837 N GLU A 59 8.049 -10.162 3.792 1.00 0.00 N ATOM 838 CA GLU A 59 7.088 -11.258 3.761 1.00 0.00 C ATOM 839 C GLU A 59 6.195 -11.164 2.527 1.00 0.00 C ATOM 840 O GLU A 59 5.213 -10.423 2.513 1.00 0.00 O ATOM 841 CB GLU A 59 6.229 -11.249 5.027 1.00 0.00 C ATOM 842 CG GLU A 59 7.002 -11.593 6.290 1.00 0.00 C ATOM 843 CD GLU A 59 6.111 -12.139 7.389 1.00 0.00 C ATOM 844 OE1 GLU A 59 5.798 -13.347 7.352 1.00 0.00 O ATOM 845 OE2 GLU A 59 5.728 -11.359 8.285 1.00 0.00 O ATOM 0 H GLU A 59 7.767 -9.369 4.368 1.00 0.00 H new ATOM 0 HA GLU A 59 7.645 -12.194 3.715 1.00 0.00 H new ATOM 0 HB2 GLU A 59 5.779 -10.263 5.144 1.00 0.00 H new ATOM 0 HB3 GLU A 59 5.412 -11.960 4.906 1.00 0.00 H new ATOM 0 HG2 GLU A 59 7.771 -12.328 6.052 1.00 0.00 H new ATOM 0 HG3 GLU A 59 7.514 -10.702 6.652 1.00 0.00 H new ATOM 852 N GLY A 60 6.545 -11.921 1.491 1.00 0.00 N ATOM 853 CA GLY A 60 5.766 -11.908 0.267 1.00 0.00 C ATOM 854 C GLY A 60 4.283 -12.089 0.521 1.00 0.00 C ATOM 855 O GLY A 60 3.451 -11.511 -0.179 1.00 0.00 O ATOM 0 H GLY A 60 7.354 -12.542 1.478 1.00 0.00 H new ATOM 0 HA2 GLY A 60 5.930 -10.965 -0.254 1.00 0.00 H new ATOM 0 HA3 GLY A 60 6.118 -12.701 -0.392 1.00 0.00 H new ATOM 859 N ASP A 61 3.950 -12.894 1.524 1.00 0.00 N ATOM 860 CA ASP A 61 2.557 -13.150 1.868 1.00 0.00 C ATOM 861 C ASP A 61 1.852 -11.861 2.280 1.00 0.00 C ATOM 862 O ASP A 61 0.807 -11.511 1.732 1.00 0.00 O ATOM 863 CB ASP A 61 2.469 -14.177 2.998 1.00 0.00 C ATOM 864 CG ASP A 61 3.109 -15.501 2.628 1.00 0.00 C ATOM 865 OD1 ASP A 61 4.331 -15.519 2.376 1.00 0.00 O ATOM 866 OD2 ASP A 61 2.386 -16.519 2.591 1.00 0.00 O ATOM 0 H ASP A 61 4.626 -13.380 2.113 1.00 0.00 H new ATOM 0 HA ASP A 61 2.058 -13.549 0.985 1.00 0.00 H new ATOM 0 HB2 ASP A 61 2.956 -13.777 3.887 1.00 0.00 H new ATOM 0 HB3 ASP A 61 1.423 -14.342 3.255 1.00 0.00 H new ATOM 871 N TRP A 62 2.432 -11.160 3.248 1.00 0.00 N ATOM 872 CA TRP A 62 1.859 -9.910 3.734 1.00 0.00 C ATOM 873 C TRP A 62 2.938 -8.846 3.903 1.00 0.00 C ATOM 874 O TRP A 62 4.032 -9.131 4.391 1.00 0.00 O ATOM 875 CB TRP A 62 1.137 -10.139 5.063 1.00 0.00 C ATOM 876 CG TRP A 62 0.034 -11.150 4.974 1.00 0.00 C ATOM 877 CD1 TRP A 62 0.170 -12.496 4.787 1.00 0.00 C ATOM 878 CD2 TRP A 62 -1.372 -10.895 5.066 1.00 0.00 C ATOM 879 NE1 TRP A 62 -1.067 -13.093 4.758 1.00 0.00 N ATOM 880 CE2 TRP A 62 -2.029 -12.133 4.927 1.00 0.00 C ATOM 881 CE3 TRP A 62 -2.139 -9.742 5.254 1.00 0.00 C ATOM 882 CZ2 TRP A 62 -3.416 -12.248 4.970 1.00 0.00 C ATOM 883 CZ3 TRP A 62 -3.515 -9.858 5.295 1.00 0.00 C ATOM 884 CH2 TRP A 62 -4.143 -11.103 5.155 1.00 0.00 C ATOM 0 H TRP A 62 3.298 -11.436 3.711 1.00 0.00 H new ATOM 0 HA TRP A 62 1.140 -9.557 2.995 1.00 0.00 H new ATOM 0 HB2 TRP A 62 1.861 -10.466 5.810 1.00 0.00 H new ATOM 0 HB3 TRP A 62 0.725 -9.192 5.412 1.00 0.00 H new ATOM 0 HD1 TRP A 62 1.111 -13.015 4.678 1.00 0.00 H new ATOM 0 HE1 TRP A 62 -1.241 -14.090 4.631 1.00 0.00 H new ATOM 0 HE3 TRP A 62 -1.665 -8.778 5.365 1.00 0.00 H new ATOM 0 HZ2 TRP A 62 -3.901 -13.207 4.861 1.00 0.00 H new ATOM 0 HZ3 TRP A 62 -4.118 -8.973 5.438 1.00 0.00 H new ATOM 0 HH2 TRP A 62 -5.221 -11.160 5.194 1.00 0.00 H new ATOM 895 N TRP A 63 2.623 -7.621 3.499 1.00 0.00 N ATOM 896 CA TRP A 63 3.567 -6.515 3.607 1.00 0.00 C ATOM 897 C TRP A 63 3.126 -5.525 4.679 1.00 0.00 C ATOM 898 O TRP A 63 1.952 -5.164 4.756 1.00 0.00 O ATOM 899 CB TRP A 63 3.704 -5.801 2.261 1.00 0.00 C ATOM 900 CG TRP A 63 4.349 -6.645 1.204 1.00 0.00 C ATOM 901 CD1 TRP A 63 5.072 -7.787 1.395 1.00 0.00 C ATOM 902 CD2 TRP A 63 4.329 -6.412 -0.209 1.00 0.00 C ATOM 903 NE1 TRP A 63 5.504 -8.278 0.186 1.00 0.00 N ATOM 904 CE2 TRP A 63 5.061 -7.453 -0.813 1.00 0.00 C ATOM 905 CE3 TRP A 63 3.764 -5.426 -1.022 1.00 0.00 C ATOM 906 CZ2 TRP A 63 5.241 -7.533 -2.191 1.00 0.00 C ATOM 907 CZ3 TRP A 63 3.943 -5.507 -2.390 1.00 0.00 C ATOM 908 CH2 TRP A 63 4.676 -6.555 -2.964 1.00 0.00 C ATOM 0 H TRP A 63 1.722 -7.368 3.094 1.00 0.00 H new ATOM 0 HA TRP A 63 4.536 -6.924 3.894 1.00 0.00 H new ATOM 0 HB2 TRP A 63 2.716 -5.494 1.918 1.00 0.00 H new ATOM 0 HB3 TRP A 63 4.290 -4.892 2.398 1.00 0.00 H new ATOM 0 HD1 TRP A 63 5.275 -8.238 2.355 1.00 0.00 H new ATOM 0 HE1 TRP A 63 6.064 -9.120 0.054 1.00 0.00 H new ATOM 0 HE3 TRP A 63 3.197 -4.615 -0.589 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 5.807 -8.339 -2.635 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 3.511 -4.750 -3.028 1.00 0.00 H new ATOM 0 HH2 TRP A 63 4.797 -6.591 -4.037 1.00 0.00 H new ATOM 919 N GLU A 64 4.073 -5.090 5.503 1.00 0.00 N ATOM 920 CA GLU A 64 3.779 -4.142 6.572 1.00 0.00 C ATOM 921 C GLU A 64 3.761 -2.712 6.040 1.00 0.00 C ATOM 922 O GLU A 64 4.769 -2.209 5.544 1.00 0.00 O ATOM 923 CB GLU A 64 4.812 -4.267 7.693 1.00 0.00 C ATOM 924 CG GLU A 64 4.524 -3.375 8.889 1.00 0.00 C ATOM 925 CD GLU A 64 5.266 -3.813 10.137 1.00 0.00 C ATOM 926 OE1 GLU A 64 6.513 -3.850 10.103 1.00 0.00 O ATOM 927 OE2 GLU A 64 4.598 -4.118 11.147 1.00 0.00 O ATOM 0 H GLU A 64 5.050 -5.378 5.451 1.00 0.00 H new ATOM 0 HA GLU A 64 2.792 -4.377 6.970 1.00 0.00 H new ATOM 0 HB2 GLU A 64 4.851 -5.304 8.025 1.00 0.00 H new ATOM 0 HB3 GLU A 64 5.797 -4.022 7.297 1.00 0.00 H new ATOM 0 HG2 GLU A 64 4.802 -2.349 8.647 1.00 0.00 H new ATOM 0 HG3 GLU A 64 3.452 -3.377 9.089 1.00 0.00 H new ATOM 934 N ALA A 65 2.607 -2.062 6.146 1.00 0.00 N ATOM 935 CA ALA A 65 2.456 -0.690 5.677 1.00 0.00 C ATOM 936 C ALA A 65 1.780 0.180 6.732 1.00 0.00 C ATOM 937 O ALA A 65 1.097 -0.327 7.622 1.00 0.00 O ATOM 938 CB ALA A 65 1.664 -0.659 4.379 1.00 0.00 C ATOM 0 H ALA A 65 1.762 -2.464 6.553 1.00 0.00 H new ATOM 0 HA ALA A 65 3.451 -0.285 5.492 1.00 0.00 H new ATOM 0 HB1 ALA A 65 1.559 0.372 4.041 1.00 0.00 H new ATOM 0 HB2 ALA A 65 2.188 -1.239 3.619 1.00 0.00 H new ATOM 0 HB3 ALA A 65 0.676 -1.088 4.545 1.00 0.00 H new ATOM 944 N ARG A 66 1.976 1.490 6.627 1.00 0.00 N ATOM 945 CA ARG A 66 1.386 2.429 7.573 1.00 0.00 C ATOM 946 C ARG A 66 0.456 3.407 6.861 1.00 0.00 C ATOM 947 O ARG A 66 0.907 4.278 6.116 1.00 0.00 O ATOM 948 CB ARG A 66 2.483 3.198 8.312 1.00 0.00 C ATOM 949 CG ARG A 66 1.951 4.279 9.239 1.00 0.00 C ATOM 950 CD ARG A 66 3.036 5.277 9.611 1.00 0.00 C ATOM 951 NE ARG A 66 3.777 4.862 10.799 1.00 0.00 N ATOM 952 CZ ARG A 66 3.283 4.917 12.030 1.00 0.00 C ATOM 953 NH1 ARG A 66 2.052 5.367 12.235 1.00 0.00 N ATOM 954 NH2 ARG A 66 4.019 4.521 13.060 1.00 0.00 N ATOM 0 H ARG A 66 2.539 1.925 5.896 1.00 0.00 H new ATOM 0 HA ARG A 66 0.801 1.859 8.295 1.00 0.00 H new ATOM 0 HB2 ARG A 66 3.080 2.495 8.893 1.00 0.00 H new ATOM 0 HB3 ARG A 66 3.150 3.654 7.581 1.00 0.00 H new ATOM 0 HG2 ARG A 66 1.125 4.801 8.755 1.00 0.00 H new ATOM 0 HG3 ARG A 66 1.552 3.820 10.143 1.00 0.00 H new ATOM 0 HD2 ARG A 66 3.726 5.391 8.775 1.00 0.00 H new ATOM 0 HD3 ARG A 66 2.585 6.254 9.788 1.00 0.00 H new ATOM 0 HE ARG A 66 4.727 4.510 10.676 1.00 0.00 H new ATOM 0 HH11 ARG A 66 1.482 5.672 11.446 1.00 0.00 H new ATOM 0 HH12 ARG A 66 1.675 5.408 13.182 1.00 0.00 H new ATOM 0 HH21 ARG A 66 4.966 4.174 12.907 1.00 0.00 H new ATOM 0 HH22 ARG A 66 3.638 4.564 14.005 1.00 0.00 H new ATOM 968 N SER A 67 -0.844 3.257 7.094 1.00 0.00 N ATOM 969 CA SER A 67 -1.837 4.124 6.472 1.00 0.00 C ATOM 970 C SER A 67 -1.460 5.592 6.642 1.00 0.00 C ATOM 971 O SER A 67 -1.010 6.009 7.710 1.00 0.00 O ATOM 972 CB SER A 67 -3.219 3.867 7.076 1.00 0.00 C ATOM 973 OG SER A 67 -3.363 2.511 7.462 1.00 0.00 O ATOM 0 H SER A 67 -1.234 2.543 7.709 1.00 0.00 H new ATOM 0 HA SER A 67 -1.866 3.896 5.407 1.00 0.00 H new ATOM 0 HB2 SER A 67 -3.367 4.512 7.942 1.00 0.00 H new ATOM 0 HB3 SER A 67 -3.990 4.126 6.350 1.00 0.00 H new ATOM 0 HG SER A 67 -3.341 1.940 6.666 1.00 0.00 H new ATOM 979 N ILE A 68 -1.647 6.371 5.582 1.00 0.00 N ATOM 980 CA ILE A 68 -1.328 7.793 5.614 1.00 0.00 C ATOM 981 C ILE A 68 -2.551 8.622 5.993 1.00 0.00 C ATOM 982 O ILE A 68 -2.461 9.545 6.802 1.00 0.00 O ATOM 983 CB ILE A 68 -0.793 8.281 4.255 1.00 0.00 C ATOM 984 CG1 ILE A 68 0.133 7.229 3.640 1.00 0.00 C ATOM 985 CG2 ILE A 68 -0.064 9.606 4.417 1.00 0.00 C ATOM 986 CD1 ILE A 68 0.399 7.445 2.167 1.00 0.00 C ATOM 0 H ILE A 68 -2.018 6.042 4.691 1.00 0.00 H new ATOM 0 HA ILE A 68 -0.553 7.925 6.369 1.00 0.00 H new ATOM 0 HB ILE A 68 -1.637 8.433 3.582 1.00 0.00 H new ATOM 0 HG12 ILE A 68 1.082 7.234 4.177 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -0.308 6.242 3.780 1.00 0.00 H new ATOM 0 HG21 ILE A 68 0.308 9.937 3.448 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -0.750 10.352 4.817 1.00 0.00 H new ATOM 0 HG23 ILE A 68 0.774 9.479 5.103 1.00 0.00 H new ATOM 0 HD11 ILE A 68 1.062 6.663 1.799 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -0.542 7.411 1.618 1.00 0.00 H new ATOM 0 HD13 ILE A 68 0.869 8.418 2.021 1.00 0.00 H new ATOM 998 N ALA A 69 -3.693 8.285 5.404 1.00 0.00 N ATOM 999 CA ALA A 69 -4.935 8.996 5.683 1.00 0.00 C ATOM 1000 C ALA A 69 -5.298 8.908 7.161 1.00 0.00 C ATOM 1001 O ALA A 69 -5.369 9.923 7.856 1.00 0.00 O ATOM 1002 CB ALA A 69 -6.064 8.442 4.826 1.00 0.00 C ATOM 0 H ALA A 69 -3.784 7.524 4.731 1.00 0.00 H new ATOM 0 HA ALA A 69 -4.787 10.047 5.435 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -6.985 8.982 5.045 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -5.814 8.563 3.772 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -6.203 7.384 5.047 1.00 0.00 H new ATOM 1008 N THR A 70 -5.528 7.689 7.638 1.00 0.00 N ATOM 1009 CA THR A 70 -5.885 7.468 9.034 1.00 0.00 C ATOM 1010 C THR A 70 -4.651 7.491 9.928 1.00 0.00 C ATOM 1011 O THR A 70 -4.616 8.193 10.937 1.00 0.00 O ATOM 1012 CB THR A 70 -6.616 6.126 9.221 1.00 0.00 C ATOM 1013 OG1 THR A 70 -5.768 5.045 8.816 1.00 0.00 O ATOM 1014 CG2 THR A 70 -7.906 6.094 8.415 1.00 0.00 C ATOM 0 H THR A 70 -5.473 6.839 7.077 1.00 0.00 H new ATOM 0 HA THR A 70 -6.553 8.280 9.321 1.00 0.00 H new ATOM 0 HB THR A 70 -6.864 6.018 10.277 1.00 0.00 H new ATOM 0 HG1 THR A 70 -6.314 4.252 8.633 1.00 0.00 H new ATOM 0 HG21 THR A 70 -8.404 5.136 8.564 1.00 0.00 H new ATOM 0 HG22 THR A 70 -8.562 6.899 8.746 1.00 0.00 H new ATOM 0 HG23 THR A 70 -7.677 6.224 7.357 1.00 0.00 H new ATOM 1022 N GLY A 71 -3.637 6.719 9.549 1.00 0.00 N ATOM 1023 CA GLY A 71 -2.413 6.666 10.328 1.00 0.00 C ATOM 1024 C GLY A 71 -2.230 5.335 11.030 1.00 0.00 C ATOM 1025 O GLY A 71 -1.426 5.217 11.955 1.00 0.00 O ATOM 0 H GLY A 71 -3.641 6.129 8.717 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -1.561 6.848 9.673 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -2.422 7.466 11.069 1.00 0.00 H new ATOM 1029 N LYS A 72 -2.980 4.329 10.593 1.00 0.00 N ATOM 1030 CA LYS A 72 -2.898 2.999 11.185 1.00 0.00 C ATOM 1031 C LYS A 72 -1.650 2.265 10.704 1.00 0.00 C ATOM 1032 O LYS A 72 -0.902 2.774 9.870 1.00 0.00 O ATOM 1033 CB LYS A 72 -4.147 2.186 10.839 1.00 0.00 C ATOM 1034 CG LYS A 72 -5.443 2.848 11.272 1.00 0.00 C ATOM 1035 CD LYS A 72 -6.603 1.866 11.259 1.00 0.00 C ATOM 1036 CE LYS A 72 -7.920 2.563 10.958 1.00 0.00 C ATOM 1037 NZ LYS A 72 -8.445 3.295 12.144 1.00 0.00 N ATOM 0 H LYS A 72 -3.652 4.410 9.830 1.00 0.00 H new ATOM 0 HA LYS A 72 -2.836 3.114 12.267 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -4.176 2.020 9.762 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -4.074 1.206 11.310 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -5.325 3.260 12.274 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -5.665 3.684 10.608 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -6.419 1.094 10.511 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -6.668 1.365 12.225 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -7.781 3.261 10.133 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -8.654 1.826 10.632 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -9.344 3.756 11.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -8.602 2.625 12.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -7.756 4.015 12.440 1.00 0.00 H new ATOM 1051 N SER A 73 -1.434 1.065 11.233 1.00 0.00 N ATOM 1052 CA SER A 73 -0.276 0.262 10.858 1.00 0.00 C ATOM 1053 C SER A 73 -0.558 -1.224 11.058 1.00 0.00 C ATOM 1054 O SER A 73 -1.173 -1.624 12.046 1.00 0.00 O ATOM 1055 CB SER A 73 0.946 0.676 11.681 1.00 0.00 C ATOM 1056 OG SER A 73 0.633 0.743 13.061 1.00 0.00 O ATOM 0 H SER A 73 -2.045 0.628 11.922 1.00 0.00 H new ATOM 0 HA SER A 73 -0.070 0.436 9.802 1.00 0.00 H new ATOM 0 HB2 SER A 73 1.754 -0.038 11.523 1.00 0.00 H new ATOM 0 HB3 SER A 73 1.307 1.646 11.339 1.00 0.00 H new ATOM 0 HG SER A 73 1.431 1.008 13.565 1.00 0.00 H new ATOM 1062 N GLY A 74 -0.103 -2.039 10.111 1.00 0.00 N ATOM 1063 CA GLY A 74 -0.316 -3.472 10.200 1.00 0.00 C ATOM 1064 C GLY A 74 0.275 -4.220 9.022 1.00 0.00 C ATOM 1065 O GLY A 74 1.364 -3.890 8.551 1.00 0.00 O ATOM 0 H GLY A 74 0.409 -1.732 9.284 1.00 0.00 H new ATOM 0 HA2 GLY A 74 0.127 -3.845 11.123 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -1.386 -3.674 10.255 1.00 0.00 H new ATOM 1069 N TYR A 75 -0.442 -5.231 8.545 1.00 0.00 N ATOM 1070 CA TYR A 75 0.020 -6.032 7.417 1.00 0.00 C ATOM 1071 C TYR A 75 -1.071 -6.161 6.358 1.00 0.00 C ATOM 1072 O TYR A 75 -2.202 -6.542 6.660 1.00 0.00 O ATOM 1073 CB TYR A 75 0.452 -7.420 7.893 1.00 0.00 C ATOM 1074 CG TYR A 75 1.452 -7.387 9.026 1.00 0.00 C ATOM 1075 CD1 TYR A 75 2.617 -6.636 8.929 1.00 0.00 C ATOM 1076 CD2 TYR A 75 1.234 -8.109 10.193 1.00 0.00 C ATOM 1077 CE1 TYR A 75 3.535 -6.603 9.961 1.00 0.00 C ATOM 1078 CE2 TYR A 75 2.145 -8.081 11.231 1.00 0.00 C ATOM 1079 CZ TYR A 75 3.294 -7.327 11.110 1.00 0.00 C ATOM 1080 OH TYR A 75 4.205 -7.298 12.142 1.00 0.00 O ATOM 0 H TYR A 75 -1.346 -5.516 8.922 1.00 0.00 H new ATOM 0 HA TYR A 75 0.876 -5.526 6.971 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -0.429 -7.976 8.213 1.00 0.00 H new ATOM 0 HB3 TYR A 75 0.884 -7.965 7.054 1.00 0.00 H new ATOM 0 HD1 TYR A 75 2.808 -6.068 8.031 1.00 0.00 H new ATOM 0 HD2 TYR A 75 0.337 -8.702 10.290 1.00 0.00 H new ATOM 0 HE1 TYR A 75 4.436 -6.014 9.869 1.00 0.00 H new ATOM 0 HE2 TYR A 75 1.959 -8.646 12.132 1.00 0.00 H new ATOM 0 HH TYR A 75 3.884 -7.860 12.878 1.00 0.00 H new ATOM 1090 N ILE A 76 -0.721 -5.843 5.117 1.00 0.00 N ATOM 1091 CA ILE A 76 -1.669 -5.925 4.012 1.00 0.00 C ATOM 1092 C ILE A 76 -1.162 -6.863 2.922 1.00 0.00 C ATOM 1093 O ILE A 76 0.022 -6.879 2.583 1.00 0.00 O ATOM 1094 CB ILE A 76 -1.938 -4.539 3.397 1.00 0.00 C ATOM 1095 CG1 ILE A 76 -0.630 -3.908 2.915 1.00 0.00 C ATOM 1096 CG2 ILE A 76 -2.627 -3.635 4.409 1.00 0.00 C ATOM 1097 CD1 ILE A 76 -0.833 -2.704 2.022 1.00 0.00 C ATOM 0 H ILE A 76 0.211 -5.526 4.851 1.00 0.00 H new ATOM 0 HA ILE A 76 -2.599 -6.318 4.422 1.00 0.00 H new ATOM 0 HB ILE A 76 -2.599 -4.661 2.539 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -0.038 -3.612 3.781 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -0.052 -4.658 2.375 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -2.810 -2.659 3.960 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -3.576 -4.081 4.708 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -1.989 -3.517 5.285 1.00 0.00 H new ATOM 0 HD11 ILE A 76 0.136 -2.309 1.718 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -1.398 -2.998 1.138 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -1.384 -1.936 2.566 1.00 0.00 H new ATOM 1109 N PRO A 77 -2.078 -7.663 2.356 1.00 0.00 N ATOM 1110 CA PRO A 77 -1.748 -8.617 1.294 1.00 0.00 C ATOM 1111 C PRO A 77 -1.400 -7.925 -0.019 1.00 0.00 C ATOM 1112 O PRO A 77 -2.239 -7.253 -0.620 1.00 0.00 O ATOM 1113 CB PRO A 77 -3.031 -9.437 1.142 1.00 0.00 C ATOM 1114 CG PRO A 77 -4.116 -8.535 1.621 1.00 0.00 C ATOM 1115 CD PRO A 77 -3.507 -7.697 2.711 1.00 0.00 C ATOM 0 HA PRO A 77 -0.871 -9.215 1.542 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -3.191 -9.733 0.105 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -2.988 -10.353 1.732 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -4.490 -7.909 0.810 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -4.963 -9.109 1.997 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -3.939 -6.696 2.737 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -3.666 -8.139 3.695 1.00 0.00 H new ATOM 1123 N SER A 78 -0.157 -8.093 -0.461 1.00 0.00 N ATOM 1124 CA SER A 78 0.303 -7.481 -1.702 1.00 0.00 C ATOM 1125 C SER A 78 -0.574 -7.908 -2.875 1.00 0.00 C ATOM 1126 O SER A 78 -0.702 -7.186 -3.863 1.00 0.00 O ATOM 1127 CB SER A 78 1.759 -7.863 -1.974 1.00 0.00 C ATOM 1128 OG SER A 78 1.912 -9.269 -2.055 1.00 0.00 O ATOM 0 H SER A 78 0.549 -8.648 0.022 1.00 0.00 H new ATOM 0 HA SER A 78 0.233 -6.399 -1.593 1.00 0.00 H new ATOM 0 HB2 SER A 78 2.090 -7.404 -2.905 1.00 0.00 H new ATOM 0 HB3 SER A 78 2.395 -7.470 -1.181 1.00 0.00 H new ATOM 0 HG SER A 78 2.851 -9.486 -2.231 1.00 0.00 H new ATOM 1134 N ASN A 79 -1.176 -9.087 -2.758 1.00 0.00 N ATOM 1135 CA ASN A 79 -2.041 -9.611 -3.809 1.00 0.00 C ATOM 1136 C ASN A 79 -3.282 -8.740 -3.977 1.00 0.00 C ATOM 1137 O ASN A 79 -4.083 -8.952 -4.888 1.00 0.00 O ATOM 1138 CB ASN A 79 -2.453 -11.049 -3.489 1.00 0.00 C ATOM 1139 CG ASN A 79 -1.264 -11.931 -3.158 1.00 0.00 C ATOM 1140 OD1 ASN A 79 -0.424 -12.207 -4.015 1.00 0.00 O ATOM 1141 ND2 ASN A 79 -1.189 -12.379 -1.910 1.00 0.00 N ATOM 0 H ASN A 79 -1.081 -9.697 -1.946 1.00 0.00 H new ATOM 0 HA ASN A 79 -1.482 -9.600 -4.745 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -3.146 -11.047 -2.648 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -2.988 -11.469 -4.341 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -0.412 -12.977 -1.629 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -1.908 -12.125 -1.233 1.00 0.00 H new ATOM 1148 N TYR A 80 -3.434 -7.760 -3.093 1.00 0.00 N ATOM 1149 CA TYR A 80 -4.579 -6.858 -3.142 1.00 0.00 C ATOM 1150 C TYR A 80 -4.131 -5.425 -3.412 1.00 0.00 C ATOM 1151 O TYR A 80 -4.834 -4.655 -4.068 1.00 0.00 O ATOM 1152 CB TYR A 80 -5.361 -6.921 -1.829 1.00 0.00 C ATOM 1153 CG TYR A 80 -6.457 -7.962 -1.826 1.00 0.00 C ATOM 1154 CD1 TYR A 80 -6.255 -9.213 -2.396 1.00 0.00 C ATOM 1155 CD2 TYR A 80 -7.694 -7.696 -1.253 1.00 0.00 C ATOM 1156 CE1 TYR A 80 -7.254 -10.168 -2.397 1.00 0.00 C ATOM 1157 CE2 TYR A 80 -8.698 -8.644 -1.248 1.00 0.00 C ATOM 1158 CZ TYR A 80 -8.474 -9.878 -1.821 1.00 0.00 C ATOM 1159 OH TYR A 80 -9.471 -10.827 -1.818 1.00 0.00 O ATOM 0 H TYR A 80 -2.779 -7.570 -2.334 1.00 0.00 H new ATOM 0 HA TYR A 80 -5.227 -7.177 -3.958 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -4.669 -7.132 -1.014 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -5.800 -5.943 -1.630 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -5.301 -9.443 -2.846 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -7.874 -6.731 -0.803 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -7.081 -11.135 -2.846 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -9.654 -8.420 -0.798 1.00 0.00 H new ATOM 0 HH TYR A 80 -10.266 -10.465 -1.373 1.00 0.00 H new ATOM 1169 N VAL A 81 -2.955 -5.073 -2.902 1.00 0.00 N ATOM 1170 CA VAL A 81 -2.411 -3.733 -3.088 1.00 0.00 C ATOM 1171 C VAL A 81 -1.329 -3.724 -4.163 1.00 0.00 C ATOM 1172 O VAL A 81 -0.526 -4.653 -4.258 1.00 0.00 O ATOM 1173 CB VAL A 81 -1.822 -3.179 -1.777 1.00 0.00 C ATOM 1174 CG1 VAL A 81 -2.915 -2.995 -0.736 1.00 0.00 C ATOM 1175 CG2 VAL A 81 -0.726 -4.097 -1.256 1.00 0.00 C ATOM 0 H VAL A 81 -2.361 -5.697 -2.357 1.00 0.00 H new ATOM 0 HA VAL A 81 -3.238 -3.096 -3.403 1.00 0.00 H new ATOM 0 HB VAL A 81 -1.381 -2.203 -1.981 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -2.480 -2.603 0.183 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -3.661 -2.295 -1.112 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -3.389 -3.955 -0.532 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -0.321 -3.691 -0.329 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -1.140 -5.087 -1.067 1.00 0.00 H new ATOM 0 HG23 VAL A 81 0.069 -4.172 -1.998 1.00 0.00 H new ATOM 1185 N VAL A 82 -1.313 -2.668 -4.970 1.00 0.00 N ATOM 1186 CA VAL A 82 -0.328 -2.537 -6.037 1.00 0.00 C ATOM 1187 C VAL A 82 0.287 -1.141 -6.049 1.00 0.00 C ATOM 1188 O VAL A 82 -0.326 -0.162 -5.622 1.00 0.00 O ATOM 1189 CB VAL A 82 -0.953 -2.822 -7.415 1.00 0.00 C ATOM 1190 CG1 VAL A 82 -1.970 -3.949 -7.318 1.00 0.00 C ATOM 1191 CG2 VAL A 82 -1.593 -1.563 -7.980 1.00 0.00 C ATOM 0 H VAL A 82 -1.971 -1.891 -4.905 1.00 0.00 H new ATOM 0 HA VAL A 82 0.452 -3.273 -5.840 1.00 0.00 H new ATOM 0 HB VAL A 82 -0.162 -3.137 -8.095 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -2.401 -4.136 -8.302 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -1.478 -4.853 -6.960 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -2.761 -3.667 -6.623 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -2.030 -1.783 -8.954 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -2.373 -1.216 -7.302 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -0.835 -0.787 -8.089 1.00 0.00 H new ATOM 1201 N PRO A 83 1.528 -1.046 -6.549 1.00 0.00 N ATOM 1202 CA PRO A 83 2.253 0.225 -6.629 1.00 0.00 C ATOM 1203 C PRO A 83 1.656 1.168 -7.669 1.00 0.00 C ATOM 1204 O PRO A 83 1.334 0.756 -8.782 1.00 0.00 O ATOM 1205 CB PRO A 83 3.666 -0.198 -7.040 1.00 0.00 C ATOM 1206 CG PRO A 83 3.482 -1.497 -7.746 1.00 0.00 C ATOM 1207 CD PRO A 83 2.318 -2.172 -7.075 1.00 0.00 C ATOM 0 HA PRO A 83 2.214 0.776 -5.689 1.00 0.00 H new ATOM 0 HB2 PRO A 83 4.128 0.544 -7.691 1.00 0.00 H new ATOM 0 HB3 PRO A 83 4.315 -0.308 -6.171 1.00 0.00 H new ATOM 0 HG2 PRO A 83 3.284 -1.340 -8.806 1.00 0.00 H new ATOM 0 HG3 PRO A 83 4.381 -2.109 -7.677 1.00 0.00 H new ATOM 0 HD2 PRO A 83 1.742 -2.773 -7.778 1.00 0.00 H new ATOM 0 HD3 PRO A 83 2.645 -2.840 -6.278 1.00 0.00 H new ATOM 1215 N ALA A 84 1.512 2.436 -7.297 1.00 0.00 N ATOM 1216 CA ALA A 84 0.956 3.438 -8.198 1.00 0.00 C ATOM 1217 C ALA A 84 1.867 3.660 -9.401 1.00 0.00 C ATOM 1218 O ALA A 84 1.530 4.411 -10.317 1.00 0.00 O ATOM 1219 CB ALA A 84 0.730 4.747 -7.457 1.00 0.00 C ATOM 0 H ALA A 84 1.773 2.793 -6.378 1.00 0.00 H new ATOM 0 HA ALA A 84 -0.003 3.070 -8.564 1.00 0.00 H new ATOM 0 HB1 ALA A 84 0.315 5.486 -8.142 1.00 0.00 H new ATOM 0 HB2 ALA A 84 0.034 4.584 -6.634 1.00 0.00 H new ATOM 0 HB3 ALA A 84 1.679 5.111 -7.063 1.00 0.00 H new ATOM 1225 N ASP A 85 3.021 3.003 -9.392 1.00 0.00 N ATOM 1226 CA ASP A 85 3.980 3.128 -10.484 1.00 0.00 C ATOM 1227 C ASP A 85 3.845 1.965 -11.462 1.00 0.00 C ATOM 1228 O ASP A 85 3.936 2.148 -12.676 1.00 0.00 O ATOM 1229 CB ASP A 85 5.406 3.185 -9.934 1.00 0.00 C ATOM 1230 CG ASP A 85 6.441 2.770 -10.962 1.00 0.00 C ATOM 1231 OD1 ASP A 85 6.612 1.551 -11.173 1.00 0.00 O ATOM 1232 OD2 ASP A 85 7.078 3.665 -11.556 1.00 0.00 O ATOM 0 H ASP A 85 3.316 2.379 -8.641 1.00 0.00 H new ATOM 0 HA ASP A 85 3.767 4.054 -11.018 1.00 0.00 H new ATOM 0 HB2 ASP A 85 5.621 4.198 -9.595 1.00 0.00 H new ATOM 0 HB3 ASP A 85 5.482 2.534 -9.063 1.00 0.00 H new ATOM 1237 N SER A 86 3.629 0.768 -10.925 1.00 0.00 N ATOM 1238 CA SER A 86 3.486 -0.425 -11.750 1.00 0.00 C ATOM 1239 C SER A 86 2.052 -0.943 -11.713 1.00 0.00 C ATOM 1240 O SER A 86 1.801 -2.125 -11.950 1.00 0.00 O ATOM 1241 CB SER A 86 4.447 -1.517 -11.275 1.00 0.00 C ATOM 1242 OG SER A 86 5.683 -1.444 -11.965 1.00 0.00 O ATOM 0 H SER A 86 3.549 0.599 -9.922 1.00 0.00 H new ATOM 0 HA SER A 86 3.730 -0.157 -12.778 1.00 0.00 H new ATOM 0 HB2 SER A 86 4.618 -1.414 -10.204 1.00 0.00 H new ATOM 0 HB3 SER A 86 3.996 -2.497 -11.433 1.00 0.00 H new ATOM 0 HG SER A 86 6.091 -0.566 -11.814 1.00 0.00 H new ATOM 1248 N ILE A 87 1.115 -0.050 -11.414 1.00 0.00 N ATOM 1249 CA ILE A 87 -0.295 -0.416 -11.346 1.00 0.00 C ATOM 1250 C ILE A 87 -0.634 -1.490 -12.374 1.00 0.00 C ATOM 1251 O ILE A 87 -0.763 -1.206 -13.564 1.00 0.00 O ATOM 1252 CB ILE A 87 -1.205 0.805 -11.578 1.00 0.00 C ATOM 1253 CG1 ILE A 87 -0.544 2.072 -11.031 1.00 0.00 C ATOM 1254 CG2 ILE A 87 -2.562 0.585 -10.926 1.00 0.00 C ATOM 1255 CD1 ILE A 87 -1.521 3.194 -10.759 1.00 0.00 C ATOM 0 H ILE A 87 1.306 0.932 -11.215 1.00 0.00 H new ATOM 0 HA ILE A 87 -0.472 -0.806 -10.344 1.00 0.00 H new ATOM 0 HB ILE A 87 -1.355 0.930 -12.650 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -0.017 1.828 -10.108 1.00 0.00 H new ATOM 0 HG13 ILE A 87 0.205 2.418 -11.743 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -3.194 1.456 -11.098 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -3.034 -0.297 -11.358 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -2.431 0.438 -9.854 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -0.983 4.060 -10.373 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -2.030 3.466 -11.684 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -2.256 2.866 -10.023 1.00 0.00 H new ATOM 1267 N GLN A 88 -0.778 -2.726 -11.904 1.00 0.00 N ATOM 1268 CA GLN A 88 -1.103 -3.843 -12.783 1.00 0.00 C ATOM 1269 C GLN A 88 -2.581 -3.827 -13.159 1.00 0.00 C ATOM 1270 O GLN A 88 -2.992 -4.468 -14.126 1.00 0.00 O ATOM 1271 CB GLN A 88 -0.750 -5.169 -12.108 1.00 0.00 C ATOM 1272 CG GLN A 88 -1.446 -5.376 -10.772 1.00 0.00 C ATOM 1273 CD GLN A 88 -0.926 -6.588 -10.025 1.00 0.00 C ATOM 1274 OE1 GLN A 88 -1.646 -7.568 -9.830 1.00 0.00 O ATOM 1275 NE2 GLN A 88 0.331 -6.529 -9.601 1.00 0.00 N ATOM 0 H GLN A 88 -0.675 -2.978 -10.921 1.00 0.00 H new ATOM 0 HA GLN A 88 -0.514 -3.740 -13.694 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -1.013 -5.989 -12.776 1.00 0.00 H new ATOM 0 HB3 GLN A 88 0.329 -5.215 -11.957 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -1.311 -4.488 -10.155 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -2.517 -5.488 -10.938 1.00 0.00 H new ATOM 0 HE21 GLN A 88 0.893 -5.697 -9.784 1.00 0.00 H new ATOM 0 HE22 GLN A 88 0.735 -7.315 -9.092 1.00 0.00 H new ATOM 1284 N ALA A 89 -3.375 -3.092 -12.388 1.00 0.00 N ATOM 1285 CA ALA A 89 -4.807 -2.992 -12.641 1.00 0.00 C ATOM 1286 C ALA A 89 -5.229 -1.540 -12.843 1.00 0.00 C ATOM 1287 O ALA A 89 -6.378 -1.179 -12.595 1.00 0.00 O ATOM 1288 CB ALA A 89 -5.590 -3.617 -11.496 1.00 0.00 C ATOM 0 H ALA A 89 -3.051 -2.557 -11.583 1.00 0.00 H new ATOM 0 HA ALA A 89 -5.028 -3.538 -13.558 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -6.658 -3.535 -11.698 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -5.318 -4.668 -11.400 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -5.356 -3.096 -10.568 1.00 0.00 H new ATOM 1294 N GLU A 90 -4.290 -0.714 -13.294 1.00 0.00 N ATOM 1295 CA GLU A 90 -4.566 0.699 -13.528 1.00 0.00 C ATOM 1296 C GLU A 90 -5.992 0.899 -14.034 1.00 0.00 C ATOM 1297 O GLU A 90 -6.617 1.925 -13.770 1.00 0.00 O ATOM 1298 CB GLU A 90 -3.570 1.276 -14.535 1.00 0.00 C ATOM 1299 CG GLU A 90 -3.218 0.318 -15.661 1.00 0.00 C ATOM 1300 CD GLU A 90 -1.813 0.532 -16.191 1.00 0.00 C ATOM 1301 OE1 GLU A 90 -1.354 1.693 -16.205 1.00 0.00 O ATOM 1302 OE2 GLU A 90 -1.173 -0.463 -16.592 1.00 0.00 O ATOM 0 H GLU A 90 -3.333 -0.998 -13.504 1.00 0.00 H new ATOM 0 HA GLU A 90 -4.459 1.225 -12.580 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -3.986 2.188 -14.962 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -2.657 1.557 -14.010 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -3.316 -0.707 -15.304 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -3.932 0.442 -16.475 1.00 0.00 H new ATOM 1309 N GLU A 91 -6.498 -0.090 -14.764 1.00 0.00 N ATOM 1310 CA GLU A 91 -7.849 -0.022 -15.309 1.00 0.00 C ATOM 1311 C GLU A 91 -8.800 0.652 -14.324 1.00 0.00 C ATOM 1312 O GLU A 91 -9.723 1.361 -14.724 1.00 0.00 O ATOM 1313 CB GLU A 91 -8.358 -1.425 -15.647 1.00 0.00 C ATOM 1314 CG GLU A 91 -7.597 -2.093 -16.780 1.00 0.00 C ATOM 1315 CD GLU A 91 -8.402 -3.181 -17.462 1.00 0.00 C ATOM 1316 OE1 GLU A 91 -9.469 -2.865 -18.028 1.00 0.00 O ATOM 1317 OE2 GLU A 91 -7.964 -4.351 -17.430 1.00 0.00 O ATOM 0 H GLU A 91 -5.994 -0.947 -14.991 1.00 0.00 H new ATOM 0 HA GLU A 91 -7.815 0.574 -16.221 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -8.291 -2.051 -14.757 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -9.413 -1.365 -15.915 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -7.314 -1.340 -17.516 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -6.673 -2.520 -16.390 1.00 0.00 H new ATOM 1324 N TRP A 92 -8.566 0.426 -13.037 1.00 0.00 N ATOM 1325 CA TRP A 92 -9.401 1.011 -11.994 1.00 0.00 C ATOM 1326 C TRP A 92 -9.353 2.534 -12.049 1.00 0.00 C ATOM 1327 O TRP A 92 -10.386 3.200 -11.973 1.00 0.00 O ATOM 1328 CB TRP A 92 -8.950 0.523 -10.617 1.00 0.00 C ATOM 1329 CG TRP A 92 -7.591 1.019 -10.227 1.00 0.00 C ATOM 1330 CD1 TRP A 92 -6.430 0.300 -10.209 1.00 0.00 C ATOM 1331 CD2 TRP A 92 -7.253 2.342 -9.796 1.00 0.00 C ATOM 1332 NE1 TRP A 92 -5.390 1.097 -9.794 1.00 0.00 N ATOM 1333 CE2 TRP A 92 -5.868 2.354 -9.535 1.00 0.00 C ATOM 1334 CE3 TRP A 92 -7.984 3.518 -9.607 1.00 0.00 C ATOM 1335 CZ2 TRP A 92 -5.204 3.495 -9.094 1.00 0.00 C ATOM 1336 CZ3 TRP A 92 -7.323 4.650 -9.169 1.00 0.00 C ATOM 1337 CH2 TRP A 92 -5.945 4.632 -8.918 1.00 0.00 C ATOM 0 H TRP A 92 -7.805 -0.158 -12.690 1.00 0.00 H new ATOM 0 HA TRP A 92 -10.429 0.692 -12.165 1.00 0.00 H new ATOM 0 HB2 TRP A 92 -9.675 0.846 -9.870 1.00 0.00 H new ATOM 0 HB3 TRP A 92 -8.947 -0.567 -10.609 1.00 0.00 H new ATOM 0 HD1 TRP A 92 -6.342 -0.742 -10.481 1.00 0.00 H new ATOM 0 HE1 TRP A 92 -4.419 0.800 -9.695 1.00 0.00 H new ATOM 0 HE3 TRP A 92 -9.046 3.542 -9.800 1.00 0.00 H new ATOM 0 HZ2 TRP A 92 -4.142 3.483 -8.898 1.00 0.00 H new ATOM 0 HZ3 TRP A 92 -7.878 5.564 -9.018 1.00 0.00 H new ATOM 0 HH2 TRP A 92 -5.457 5.534 -8.579 1.00 0.00 H new ATOM 1348 N TYR A 93 -8.149 3.079 -12.181 1.00 0.00 N ATOM 1349 CA TYR A 93 -7.967 4.524 -12.243 1.00 0.00 C ATOM 1350 C TYR A 93 -8.250 5.049 -13.647 1.00 0.00 C ATOM 1351 O TYR A 93 -8.713 6.177 -13.819 1.00 0.00 O ATOM 1352 CB TYR A 93 -6.544 4.898 -11.824 1.00 0.00 C ATOM 1353 CG TYR A 93 -5.587 5.034 -12.986 1.00 0.00 C ATOM 1354 CD1 TYR A 93 -5.764 6.022 -13.946 1.00 0.00 C ATOM 1355 CD2 TYR A 93 -4.504 4.174 -13.123 1.00 0.00 C ATOM 1356 CE1 TYR A 93 -4.891 6.149 -15.010 1.00 0.00 C ATOM 1357 CE2 TYR A 93 -3.626 4.294 -14.183 1.00 0.00 C ATOM 1358 CZ TYR A 93 -3.824 5.283 -15.124 1.00 0.00 C ATOM 1359 OH TYR A 93 -2.952 5.407 -16.181 1.00 0.00 O ATOM 0 H TYR A 93 -7.284 2.542 -12.247 1.00 0.00 H new ATOM 0 HA TYR A 93 -8.675 4.984 -11.553 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -6.571 5.839 -11.275 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -6.165 4.140 -11.139 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -6.598 6.703 -13.860 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -4.346 3.398 -12.388 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -5.044 6.922 -15.748 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -2.789 3.617 -14.274 1.00 0.00 H new ATOM 0 HH TYR A 93 -3.328 4.962 -16.969 1.00 0.00 H new ATOM 1369 N PHE A 94 -7.970 4.221 -14.648 1.00 0.00 N ATOM 1370 CA PHE A 94 -8.194 4.601 -16.039 1.00 0.00 C ATOM 1371 C PHE A 94 -9.672 4.878 -16.296 1.00 0.00 C ATOM 1372 O PHE A 94 -10.025 5.828 -16.993 1.00 0.00 O ATOM 1373 CB PHE A 94 -7.700 3.497 -16.976 1.00 0.00 C ATOM 1374 CG PHE A 94 -6.275 3.678 -17.417 1.00 0.00 C ATOM 1375 CD1 PHE A 94 -5.905 4.779 -18.173 1.00 0.00 C ATOM 1376 CD2 PHE A 94 -5.307 2.747 -17.077 1.00 0.00 C ATOM 1377 CE1 PHE A 94 -4.595 4.949 -18.580 1.00 0.00 C ATOM 1378 CE2 PHE A 94 -3.996 2.912 -17.481 1.00 0.00 C ATOM 1379 CZ PHE A 94 -3.640 4.014 -18.235 1.00 0.00 C ATOM 0 H PHE A 94 -7.588 3.284 -14.523 1.00 0.00 H new ATOM 0 HA PHE A 94 -7.632 5.514 -16.236 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -7.797 2.535 -16.473 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -8.343 3.463 -17.856 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -6.649 5.513 -18.447 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -5.580 1.883 -16.490 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -4.319 5.812 -19.167 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -3.250 2.180 -17.208 1.00 0.00 H new ATOM 0 HZ PHE A 94 -2.616 4.143 -18.554 1.00 0.00 H new ATOM 1389 N GLY A 95 -10.533 4.039 -15.727 1.00 0.00 N ATOM 1390 CA GLY A 95 -11.963 4.209 -15.906 1.00 0.00 C ATOM 1391 C GLY A 95 -12.645 4.738 -14.660 1.00 0.00 C ATOM 1392 O GLY A 95 -13.380 5.724 -14.715 1.00 0.00 O ATOM 0 H GLY A 95 -10.265 3.245 -15.145 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -12.143 4.895 -16.734 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -12.408 3.253 -16.182 1.00 0.00 H new ATOM 1396 N LYS A 96 -12.402 4.081 -13.531 1.00 0.00 N ATOM 1397 CA LYS A 96 -12.998 4.489 -12.264 1.00 0.00 C ATOM 1398 C LYS A 96 -12.109 5.498 -11.545 1.00 0.00 C ATOM 1399 O LYS A 96 -11.305 5.132 -10.688 1.00 0.00 O ATOM 1400 CB LYS A 96 -13.230 3.269 -11.369 1.00 0.00 C ATOM 1401 CG LYS A 96 -14.560 2.579 -11.615 1.00 0.00 C ATOM 1402 CD LYS A 96 -15.087 1.918 -10.352 1.00 0.00 C ATOM 1403 CE LYS A 96 -16.593 1.715 -10.416 1.00 0.00 C ATOM 1404 NZ LYS A 96 -17.175 1.457 -9.070 1.00 0.00 N ATOM 0 H LYS A 96 -11.796 3.263 -13.467 1.00 0.00 H new ATOM 0 HA LYS A 96 -13.956 4.962 -12.478 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -12.424 2.553 -11.529 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -13.179 3.579 -10.325 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -15.287 3.306 -11.977 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -14.443 1.829 -12.397 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -14.595 0.956 -10.211 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -14.838 2.533 -9.487 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -17.060 2.599 -10.851 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -16.819 0.878 -11.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -18.203 1.324 -9.156 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -16.748 0.600 -8.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -16.982 2.267 -8.447 1.00 0.00 H new ATOM 1418 N MET A 97 -12.260 6.771 -11.898 1.00 0.00 N ATOM 1419 CA MET A 97 -11.472 7.833 -11.283 1.00 0.00 C ATOM 1420 C MET A 97 -11.652 7.837 -9.769 1.00 0.00 C ATOM 1421 O MET A 97 -12.689 7.417 -9.256 1.00 0.00 O ATOM 1422 CB MET A 97 -11.872 9.192 -11.860 1.00 0.00 C ATOM 1423 CG MET A 97 -11.345 9.435 -13.265 1.00 0.00 C ATOM 1424 SD MET A 97 -12.333 10.636 -14.179 1.00 0.00 S ATOM 1425 CE MET A 97 -13.506 9.557 -14.996 1.00 0.00 C ATOM 0 H MET A 97 -12.920 7.092 -12.606 1.00 0.00 H new ATOM 0 HA MET A 97 -10.421 7.647 -11.505 1.00 0.00 H new ATOM 0 HB2 MET A 97 -12.959 9.267 -11.871 1.00 0.00 H new ATOM 0 HB3 MET A 97 -11.505 9.979 -11.202 1.00 0.00 H new ATOM 0 HG2 MET A 97 -10.315 9.787 -13.207 1.00 0.00 H new ATOM 0 HG3 MET A 97 -11.329 8.492 -13.811 1.00 0.00 H new ATOM 0 HE1 MET A 97 -14.188 10.153 -15.602 1.00 0.00 H new ATOM 0 HE2 MET A 97 -12.971 8.856 -15.636 1.00 0.00 H new ATOM 0 HE3 MET A 97 -14.074 9.004 -14.248 1.00 0.00 H new ATOM 1435 N GLY A 98 -10.636 8.314 -9.057 1.00 0.00 N ATOM 1436 CA GLY A 98 -10.703 8.363 -7.608 1.00 0.00 C ATOM 1437 C GLY A 98 -9.332 8.462 -6.968 1.00 0.00 C ATOM 1438 O GLY A 98 -8.983 7.656 -6.105 1.00 0.00 O ATOM 0 H GLY A 98 -9.767 8.668 -9.458 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -11.305 9.219 -7.304 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -11.209 7.470 -7.240 1.00 0.00 H new ATOM 1442 N ARG A 99 -8.553 9.452 -7.391 1.00 0.00 N ATOM 1443 CA ARG A 99 -7.212 9.652 -6.855 1.00 0.00 C ATOM 1444 C ARG A 99 -6.981 11.119 -6.503 1.00 0.00 C ATOM 1445 O ARG A 99 -6.821 11.963 -7.385 1.00 0.00 O ATOM 1446 CB ARG A 99 -6.162 9.187 -7.865 1.00 0.00 C ATOM 1447 CG ARG A 99 -4.731 9.426 -7.409 1.00 0.00 C ATOM 1448 CD ARG A 99 -4.227 10.791 -7.851 1.00 0.00 C ATOM 1449 NE ARG A 99 -2.773 10.891 -7.767 1.00 0.00 N ATOM 1450 CZ ARG A 99 -2.064 11.837 -8.374 1.00 0.00 C ATOM 1451 NH1 ARG A 99 -2.674 12.760 -9.104 1.00 0.00 N ATOM 1452 NH2 ARG A 99 -0.743 11.861 -8.250 1.00 0.00 N ATOM 0 H ARG A 99 -8.827 10.128 -8.104 1.00 0.00 H new ATOM 0 HA ARG A 99 -7.119 9.059 -5.945 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -6.301 8.123 -8.057 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -6.325 9.705 -8.810 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -4.677 9.351 -6.323 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -4.084 8.649 -7.815 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -4.545 10.980 -8.876 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -4.680 11.563 -7.229 1.00 0.00 H new ATOM 0 HE ARG A 99 -2.274 10.196 -7.212 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -3.689 12.745 -9.201 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -2.128 13.485 -9.569 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -0.271 11.153 -7.688 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -0.200 12.588 -8.716 1.00 0.00 H new ATOM 1466 N LYS A 100 -6.964 11.415 -5.208 1.00 0.00 N ATOM 1467 CA LYS A 100 -6.751 12.779 -4.737 1.00 0.00 C ATOM 1468 C LYS A 100 -5.384 12.919 -4.075 1.00 0.00 C ATOM 1469 O LYS A 100 -4.786 11.931 -3.650 1.00 0.00 O ATOM 1470 CB LYS A 100 -7.851 13.177 -3.751 1.00 0.00 C ATOM 1471 CG LYS A 100 -7.699 12.540 -2.380 1.00 0.00 C ATOM 1472 CD LYS A 100 -8.414 13.345 -1.308 1.00 0.00 C ATOM 1473 CE LYS A 100 -7.774 13.147 0.057 1.00 0.00 C ATOM 1474 NZ LYS A 100 -8.372 14.042 1.086 1.00 0.00 N ATOM 0 H LYS A 100 -7.095 10.728 -4.465 1.00 0.00 H new ATOM 0 HA LYS A 100 -6.787 13.445 -5.599 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -7.853 14.261 -3.640 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -8.819 12.897 -4.167 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -8.099 11.526 -2.403 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -6.641 12.459 -2.131 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -8.393 14.403 -1.571 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -9.462 13.048 -1.266 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -7.892 12.108 0.366 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -6.703 13.339 -0.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -7.908 13.876 2.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -8.237 15.034 0.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -9.389 13.842 1.171 1.00 0.00 H new ATOM 1488 N ASP A 101 -4.897 14.152 -3.989 1.00 0.00 N ATOM 1489 CA ASP A 101 -3.602 14.421 -3.376 1.00 0.00 C ATOM 1490 C ASP A 101 -3.468 15.897 -3.014 1.00 0.00 C ATOM 1491 O ASP A 101 -4.177 16.746 -3.555 1.00 0.00 O ATOM 1492 CB ASP A 101 -2.471 14.011 -4.321 1.00 0.00 C ATOM 1493 CG ASP A 101 -1.136 13.900 -3.612 1.00 0.00 C ATOM 1494 OD1 ASP A 101 -1.116 13.994 -2.367 1.00 0.00 O ATOM 1495 OD2 ASP A 101 -0.110 13.721 -4.302 1.00 0.00 O ATOM 0 H ASP A 101 -5.380 14.981 -4.336 1.00 0.00 H new ATOM 0 HA ASP A 101 -3.532 13.833 -2.461 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -2.715 13.054 -4.781 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -2.392 14.741 -5.126 1.00 0.00 H new ATOM 1500 N ALA A 102 -2.557 16.195 -2.094 1.00 0.00 N ATOM 1501 CA ALA A 102 -2.330 17.568 -1.661 1.00 0.00 C ATOM 1502 C ALA A 102 -1.041 17.684 -0.855 1.00 0.00 C ATOM 1503 O ALA A 102 -0.953 17.185 0.267 1.00 0.00 O ATOM 1504 CB ALA A 102 -3.512 18.066 -0.842 1.00 0.00 C ATOM 0 H ALA A 102 -1.964 15.504 -1.634 1.00 0.00 H new ATOM 0 HA ALA A 102 -2.229 18.190 -2.550 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -3.328 19.093 -0.525 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -4.416 18.030 -1.449 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -3.639 17.433 0.036 1.00 0.00 H new ATOM 1510 N GLU A 103 -0.043 18.344 -1.434 1.00 0.00 N ATOM 1511 CA GLU A 103 1.242 18.522 -0.768 1.00 0.00 C ATOM 1512 C GLU A 103 1.934 19.794 -1.253 1.00 0.00 C ATOM 1513 O GLU A 103 1.832 20.161 -2.423 1.00 0.00 O ATOM 1514 CB GLU A 103 2.144 17.311 -1.018 1.00 0.00 C ATOM 1515 CG GLU A 103 3.230 17.135 0.030 1.00 0.00 C ATOM 1516 CD GLU A 103 2.708 16.519 1.313 1.00 0.00 C ATOM 1517 OE1 GLU A 103 1.492 16.243 1.386 1.00 0.00 O ATOM 1518 OE2 GLU A 103 3.514 16.313 2.244 1.00 0.00 O ATOM 0 H GLU A 103 -0.099 18.764 -2.362 1.00 0.00 H new ATOM 0 HA GLU A 103 1.058 18.614 0.302 1.00 0.00 H new ATOM 0 HB2 GLU A 103 1.530 16.411 -1.047 1.00 0.00 H new ATOM 0 HB3 GLU A 103 2.610 17.411 -1.998 1.00 0.00 H new ATOM 0 HG2 GLU A 103 4.022 16.505 -0.375 1.00 0.00 H new ATOM 0 HG3 GLU A 103 3.676 18.104 0.252 1.00 0.00 H new ATOM 1525 N SER A 104 2.637 20.461 -0.344 1.00 0.00 N ATOM 1526 CA SER A 104 3.342 21.693 -0.676 1.00 0.00 C ATOM 1527 C SER A 104 4.794 21.630 -0.212 1.00 0.00 C ATOM 1528 O SER A 104 5.128 20.905 0.724 1.00 0.00 O ATOM 1529 CB SER A 104 2.643 22.894 -0.037 1.00 0.00 C ATOM 1530 OG SER A 104 2.521 22.728 1.365 1.00 0.00 O ATOM 0 H SER A 104 2.734 20.169 0.628 1.00 0.00 H new ATOM 0 HA SER A 104 3.329 21.808 -1.760 1.00 0.00 H new ATOM 0 HB2 SER A 104 3.206 23.802 -0.251 1.00 0.00 H new ATOM 0 HB3 SER A 104 1.654 23.020 -0.479 1.00 0.00 H new ATOM 0 HG SER A 104 2.072 23.510 1.749 1.00 0.00 H new ATOM 1536 N GLY A 105 5.655 22.397 -0.875 1.00 0.00 N ATOM 1537 CA GLY A 105 7.061 22.414 -0.517 1.00 0.00 C ATOM 1538 C GLY A 105 7.967 22.480 -1.731 1.00 0.00 C ATOM 1539 O GLY A 105 8.456 21.463 -2.223 1.00 0.00 O ATOM 0 H GLY A 105 5.403 23.006 -1.653 1.00 0.00 H new ATOM 0 HA2 GLY A 105 7.259 23.271 0.127 1.00 0.00 H new ATOM 0 HA3 GLY A 105 7.297 21.520 0.060 1.00 0.00 H new ATOM 1543 N PRO A 106 8.202 23.701 -2.234 1.00 0.00 N ATOM 1544 CA PRO A 106 9.055 23.925 -3.404 1.00 0.00 C ATOM 1545 C PRO A 106 10.527 23.657 -3.108 1.00 0.00 C ATOM 1546 O PRO A 106 11.003 23.910 -2.001 1.00 0.00 O ATOM 1547 CB PRO A 106 8.835 25.405 -3.726 1.00 0.00 C ATOM 1548 CG PRO A 106 8.427 26.018 -2.431 1.00 0.00 C ATOM 1549 CD PRO A 106 7.652 24.958 -1.698 1.00 0.00 C ATOM 0 HA PRO A 106 8.804 23.254 -4.226 1.00 0.00 H new ATOM 0 HB2 PRO A 106 9.744 25.865 -4.113 1.00 0.00 H new ATOM 0 HB3 PRO A 106 8.064 25.535 -4.486 1.00 0.00 H new ATOM 0 HG2 PRO A 106 9.298 26.332 -1.856 1.00 0.00 H new ATOM 0 HG3 PRO A 106 7.816 26.906 -2.595 1.00 0.00 H new ATOM 0 HD2 PRO A 106 7.793 25.031 -0.620 1.00 0.00 H new ATOM 0 HD3 PRO A 106 6.582 25.041 -1.886 1.00 0.00 H new ATOM 1557 N SER A 107 11.243 23.144 -4.104 1.00 0.00 N ATOM 1558 CA SER A 107 12.660 22.839 -3.949 1.00 0.00 C ATOM 1559 C SER A 107 13.337 22.694 -5.308 1.00 0.00 C ATOM 1560 O SER A 107 12.675 22.481 -6.324 1.00 0.00 O ATOM 1561 CB SER A 107 12.841 21.556 -3.136 1.00 0.00 C ATOM 1562 OG SER A 107 12.302 21.696 -1.834 1.00 0.00 O ATOM 0 H SER A 107 10.864 22.931 -5.027 1.00 0.00 H new ATOM 0 HA SER A 107 13.128 23.667 -3.417 1.00 0.00 H new ATOM 0 HB2 SER A 107 12.353 20.726 -3.647 1.00 0.00 H new ATOM 0 HB3 SER A 107 13.901 21.311 -3.070 1.00 0.00 H new ATOM 0 HG SER A 107 12.091 22.638 -1.667 1.00 0.00 H new ATOM 1568 N SER A 108 14.661 22.811 -5.319 1.00 0.00 N ATOM 1569 CA SER A 108 15.429 22.697 -6.553 1.00 0.00 C ATOM 1570 C SER A 108 16.525 21.645 -6.416 1.00 0.00 C ATOM 1571 O SER A 108 17.618 21.931 -5.928 1.00 0.00 O ATOM 1572 CB SER A 108 16.045 24.048 -6.922 1.00 0.00 C ATOM 1573 OG SER A 108 15.043 25.035 -7.095 1.00 0.00 O ATOM 0 H SER A 108 15.224 22.985 -4.487 1.00 0.00 H new ATOM 0 HA SER A 108 14.750 22.387 -7.347 1.00 0.00 H new ATOM 0 HB2 SER A 108 16.737 24.361 -6.141 1.00 0.00 H new ATOM 0 HB3 SER A 108 16.624 23.949 -7.840 1.00 0.00 H new ATOM 0 HG SER A 108 15.462 25.889 -7.329 1.00 0.00 H new ATOM 1579 N GLY A 109 16.224 20.425 -6.850 1.00 0.00 N ATOM 1580 CA GLY A 109 17.193 19.348 -6.767 1.00 0.00 C ATOM 1581 C GLY A 109 17.889 19.091 -8.089 1.00 0.00 C ATOM 1582 O GLY A 109 19.118 19.087 -8.161 1.00 0.00 O ATOM 0 H GLY A 109 15.326 20.163 -7.258 1.00 0.00 H new ATOM 0 HA2 GLY A 109 17.938 19.591 -6.009 1.00 0.00 H new ATOM 0 HA3 GLY A 109 16.692 18.437 -6.441 1.00 0.00 H new TER 1586 GLY A 109