USER MOD reduce.3.24.130724 H: found=0, std=0, add=826, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 824 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 51 THR OG1 : rot -65:sc= 1.67 USER MOD Set 1.2: A 55 THR OG1 : rot 3:sc= 0.701 USER MOD Set 2.1: A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 39 THR OG1 : rot 180:sc= -0.443 USER MOD Single : A 1 GLY N :NH3+ 173:sc= 0 (180deg=-0.0557) 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 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 37:sc= 0.935 USER MOD Single : A 12 SER OG : rot 180:sc= -0.026 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 CYS SG : rot -5:sc= 0.269 USER MOD Single : A 17 THR OG1 : rot 34:sc= 0.233 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot 180:sc= -0.196 USER MOD Single : A 42 LYS NZ :NH3+ -135:sc= -1.6! (180deg=-3.56!) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 CYS SG : rot -60:sc= -1.62 USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 THR OG1 : rot 180:sc= -0.64 USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 TYR OH : rot -155:sc= -0.241 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ -120:sc= 0.768 (180deg=-0.0377) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 TYR OH : rot -9:sc= 1.13 USER MOD Single : A 84 TYR OH : rot 30:sc= 0 USER MOD Single : A 94 ASN : amide:sc= 0 X(o=0,f=-0.0022) USER MOD Single : A 95 SER OG : rot -140:sc= -0.77 USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 MET CE :methyl 170:sc= 0 (180deg=-0.194) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0.0142 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 ASN : amide:sc= -0.776 X(o=-0.78,f=-1.2!) USER MOD Single : A 117 CYS SG : rot 14:sc= 0.3 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 10.142 -19.495 -16.422 1.00 0.00 N ATOM 2 CA GLY A 1 9.116 -19.810 -17.398 1.00 0.00 C ATOM 3 C GLY A 1 8.621 -21.237 -17.279 1.00 0.00 C ATOM 4 O GLY A 1 8.382 -21.904 -18.286 1.00 0.00 O ATOM 0 H1 GLY A 1 10.531 -18.551 -16.619 1.00 0.00 H new ATOM 0 H2 GLY A 1 9.729 -19.507 -15.468 1.00 0.00 H new ATOM 0 H3 GLY A 1 10.903 -20.201 -16.478 1.00 0.00 H new ATOM 0 HA2 GLY A 1 8.277 -19.126 -17.272 1.00 0.00 H new ATOM 0 HA3 GLY A 1 9.511 -19.648 -18.401 1.00 0.00 H new ATOM 8 N SER A 2 8.466 -21.708 -16.046 1.00 0.00 N ATOM 9 CA SER A 2 8.002 -23.068 -15.799 1.00 0.00 C ATOM 10 C SER A 2 6.566 -23.067 -15.283 1.00 0.00 C ATOM 11 O SER A 2 6.049 -22.033 -14.858 1.00 0.00 O ATOM 12 CB SER A 2 8.917 -23.768 -14.792 1.00 0.00 C ATOM 13 OG SER A 2 8.690 -23.289 -13.479 1.00 0.00 O ATOM 0 H SER A 2 8.655 -21.167 -15.202 1.00 0.00 H new ATOM 0 HA SER A 2 8.030 -23.612 -16.743 1.00 0.00 H new ATOM 0 HB2 SER A 2 8.744 -24.844 -14.825 1.00 0.00 H new ATOM 0 HB3 SER A 2 9.959 -23.604 -15.067 1.00 0.00 H new ATOM 0 HG SER A 2 9.285 -23.753 -12.854 1.00 0.00 H new ATOM 19 N SER A 3 5.928 -24.231 -15.324 1.00 0.00 N ATOM 20 CA SER A 3 4.550 -24.365 -14.864 1.00 0.00 C ATOM 21 C SER A 3 4.484 -25.183 -13.578 1.00 0.00 C ATOM 22 O SER A 3 5.323 -26.049 -13.336 1.00 0.00 O ATOM 23 CB SER A 3 3.691 -25.023 -15.946 1.00 0.00 C ATOM 24 OG SER A 3 3.800 -24.329 -17.177 1.00 0.00 O ATOM 0 H SER A 3 6.343 -25.096 -15.671 1.00 0.00 H new ATOM 0 HA SER A 3 4.162 -23.367 -14.659 1.00 0.00 H new ATOM 0 HB2 SER A 3 4.001 -26.059 -16.081 1.00 0.00 H new ATOM 0 HB3 SER A 3 2.649 -25.041 -15.626 1.00 0.00 H new ATOM 0 HG SER A 3 3.243 -24.770 -17.852 1.00 0.00 H new ATOM 30 N GLY A 4 3.478 -24.901 -12.756 1.00 0.00 N ATOM 31 CA GLY A 4 3.319 -25.618 -11.505 1.00 0.00 C ATOM 32 C GLY A 4 1.993 -25.323 -10.832 1.00 0.00 C ATOM 33 O GLY A 4 1.832 -24.284 -10.191 1.00 0.00 O ATOM 0 H GLY A 4 2.770 -24.189 -12.934 1.00 0.00 H new ATOM 0 HA2 GLY A 4 3.398 -26.689 -11.691 1.00 0.00 H new ATOM 0 HA3 GLY A 4 4.133 -25.351 -10.831 1.00 0.00 H new ATOM 37 N SER A 5 1.041 -26.239 -10.978 1.00 0.00 N ATOM 38 CA SER A 5 -0.281 -26.069 -10.384 1.00 0.00 C ATOM 39 C SER A 5 -0.342 -26.716 -9.003 1.00 0.00 C ATOM 40 O SER A 5 -0.826 -27.837 -8.851 1.00 0.00 O ATOM 41 CB SER A 5 -1.353 -26.676 -11.291 1.00 0.00 C ATOM 42 OG SER A 5 -2.639 -26.555 -10.711 1.00 0.00 O ATOM 0 H SER A 5 1.160 -27.106 -11.502 1.00 0.00 H new ATOM 0 HA SER A 5 -0.469 -25.001 -10.276 1.00 0.00 H new ATOM 0 HB2 SER A 5 -1.339 -26.177 -12.260 1.00 0.00 H new ATOM 0 HB3 SER A 5 -1.129 -27.728 -11.471 1.00 0.00 H new ATOM 0 HG SER A 5 -3.307 -26.949 -11.311 1.00 0.00 H new ATOM 48 N SER A 6 0.153 -25.999 -7.999 1.00 0.00 N ATOM 49 CA SER A 6 0.158 -26.502 -6.630 1.00 0.00 C ATOM 50 C SER A 6 -0.958 -25.860 -5.810 1.00 0.00 C ATOM 51 O SER A 6 -0.757 -25.481 -4.658 1.00 0.00 O ATOM 52 CB SER A 6 1.512 -26.232 -5.970 1.00 0.00 C ATOM 53 OG SER A 6 1.808 -27.214 -4.993 1.00 0.00 O ATOM 0 H SER A 6 0.556 -25.068 -8.108 1.00 0.00 H new ATOM 0 HA SER A 6 -0.014 -27.578 -6.664 1.00 0.00 H new ATOM 0 HB2 SER A 6 2.294 -26.222 -6.729 1.00 0.00 H new ATOM 0 HB3 SER A 6 1.504 -25.245 -5.507 1.00 0.00 H new ATOM 0 HG SER A 6 2.679 -27.020 -4.587 1.00 0.00 H new ATOM 59 N GLY A 7 -2.136 -25.743 -6.417 1.00 0.00 N ATOM 60 CA GLY A 7 -3.267 -25.147 -5.729 1.00 0.00 C ATOM 61 C GLY A 7 -3.666 -23.811 -6.322 1.00 0.00 C ATOM 62 O GLY A 7 -2.966 -22.811 -6.151 1.00 0.00 O ATOM 0 H GLY A 7 -2.327 -26.050 -7.371 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -4.116 -25.829 -5.773 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -3.019 -25.014 -4.676 1.00 0.00 H new ATOM 66 N THR A 8 -4.795 -23.789 -7.023 1.00 0.00 N ATOM 67 CA THR A 8 -5.286 -22.566 -7.646 1.00 0.00 C ATOM 68 C THR A 8 -6.645 -22.169 -7.082 1.00 0.00 C ATOM 69 O THR A 8 -7.668 -22.755 -7.431 1.00 0.00 O ATOM 70 CB THR A 8 -5.402 -22.722 -9.174 1.00 0.00 C ATOM 71 OG1 THR A 8 -6.315 -23.779 -9.491 1.00 0.00 O ATOM 72 CG2 THR A 8 -4.044 -23.016 -9.794 1.00 0.00 C ATOM 0 H THR A 8 -5.387 -24.606 -7.174 1.00 0.00 H new ATOM 0 HA THR A 8 -4.561 -21.784 -7.422 1.00 0.00 H new ATOM 0 HB THR A 8 -5.775 -21.784 -9.585 1.00 0.00 H new ATOM 0 HG1 THR A 8 -7.057 -23.774 -8.850 1.00 0.00 H new ATOM 0 HG21 THR A 8 -4.152 -23.122 -10.873 1.00 0.00 H new ATOM 0 HG22 THR A 8 -3.360 -22.196 -9.577 1.00 0.00 H new ATOM 0 HG23 THR A 8 -3.646 -23.941 -9.377 1.00 0.00 H new ATOM 80 N GLY A 9 -6.648 -21.168 -6.208 1.00 0.00 N ATOM 81 CA GLY A 9 -7.888 -20.708 -5.610 1.00 0.00 C ATOM 82 C GLY A 9 -8.640 -19.742 -6.503 1.00 0.00 C ATOM 83 O GLY A 9 -8.791 -19.984 -7.701 1.00 0.00 O ATOM 0 H GLY A 9 -5.814 -20.667 -5.903 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -8.523 -21.567 -5.393 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -7.671 -20.224 -4.658 1.00 0.00 H new ATOM 87 N ASP A 10 -9.113 -18.646 -5.921 1.00 0.00 N ATOM 88 CA ASP A 10 -9.854 -17.640 -6.672 1.00 0.00 C ATOM 89 C ASP A 10 -9.578 -16.242 -6.129 1.00 0.00 C ATOM 90 O ASP A 10 -9.515 -16.039 -4.916 1.00 0.00 O ATOM 91 CB ASP A 10 -11.354 -17.935 -6.619 1.00 0.00 C ATOM 92 CG ASP A 10 -11.701 -19.286 -7.212 1.00 0.00 C ATOM 93 OD1 ASP A 10 -11.877 -19.365 -8.445 1.00 0.00 O ATOM 94 OD2 ASP A 10 -11.796 -20.266 -6.441 1.00 0.00 O ATOM 0 H ASP A 10 -8.996 -18.431 -4.931 1.00 0.00 H new ATOM 0 HA ASP A 10 -9.521 -17.679 -7.709 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -11.692 -17.899 -5.583 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -11.894 -17.156 -7.158 1.00 0.00 H new ATOM 99 N ALA A 11 -9.412 -15.283 -7.033 1.00 0.00 N ATOM 100 CA ALA A 11 -9.143 -13.904 -6.644 1.00 0.00 C ATOM 101 C ALA A 11 -10.435 -13.102 -6.535 1.00 0.00 C ATOM 102 O ALA A 11 -10.695 -12.460 -5.517 1.00 0.00 O ATOM 103 CB ALA A 11 -8.196 -13.250 -7.639 1.00 0.00 C ATOM 0 H ALA A 11 -9.459 -15.435 -8.040 1.00 0.00 H new ATOM 0 HA ALA A 11 -8.670 -13.916 -5.662 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -8.004 -12.221 -7.336 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -7.257 -13.802 -7.664 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -8.648 -13.258 -8.631 1.00 0.00 H new ATOM 109 N SER A 12 -11.243 -13.144 -7.589 1.00 0.00 N ATOM 110 CA SER A 12 -12.507 -12.417 -7.614 1.00 0.00 C ATOM 111 C SER A 12 -13.287 -12.639 -6.321 1.00 0.00 C ATOM 112 O SER A 12 -13.950 -11.732 -5.818 1.00 0.00 O ATOM 113 CB SER A 12 -13.350 -12.858 -8.812 1.00 0.00 C ATOM 114 OG SER A 12 -14.525 -12.073 -8.925 1.00 0.00 O ATOM 0 H SER A 12 -11.045 -13.674 -8.438 1.00 0.00 H new ATOM 0 HA SER A 12 -12.284 -11.354 -7.707 1.00 0.00 H new ATOM 0 HB2 SER A 12 -12.762 -12.772 -9.726 1.00 0.00 H new ATOM 0 HB3 SER A 12 -13.620 -13.909 -8.704 1.00 0.00 H new ATOM 0 HG SER A 12 -15.046 -12.373 -9.699 1.00 0.00 H new ATOM 120 N LYS A 13 -13.201 -13.853 -5.788 1.00 0.00 N ATOM 121 CA LYS A 13 -13.896 -14.197 -4.553 1.00 0.00 C ATOM 122 C LYS A 13 -13.307 -13.439 -3.368 1.00 0.00 C ATOM 123 O LYS A 13 -14.030 -13.031 -2.458 1.00 0.00 O ATOM 124 CB LYS A 13 -13.814 -15.704 -4.301 1.00 0.00 C ATOM 125 CG LYS A 13 -14.361 -16.543 -5.442 1.00 0.00 C ATOM 126 CD LYS A 13 -15.876 -16.646 -5.384 1.00 0.00 C ATOM 127 CE LYS A 13 -16.389 -17.801 -6.230 1.00 0.00 C ATOM 128 NZ LYS A 13 -16.344 -19.092 -5.489 1.00 0.00 N ATOM 0 H LYS A 13 -12.657 -14.615 -6.192 1.00 0.00 H new ATOM 0 HA LYS A 13 -14.942 -13.909 -4.661 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -12.774 -15.978 -4.126 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -14.364 -15.942 -3.390 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -14.062 -16.104 -6.394 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -13.926 -17.542 -5.401 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -16.193 -16.782 -4.350 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -16.319 -15.713 -5.733 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -17.413 -17.596 -6.542 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -15.790 -17.881 -7.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -16.702 -19.855 -6.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -15.363 -19.300 -5.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -16.936 -19.024 -4.637 1.00 0.00 H new ATOM 142 N CYS A 14 -11.992 -13.253 -3.385 1.00 0.00 N ATOM 143 CA CYS A 14 -11.305 -12.544 -2.311 1.00 0.00 C ATOM 144 C CYS A 14 -11.745 -11.084 -2.257 1.00 0.00 C ATOM 145 O CYS A 14 -12.261 -10.543 -3.236 1.00 0.00 O ATOM 146 CB CYS A 14 -9.790 -12.627 -2.504 1.00 0.00 C ATOM 147 SG CYS A 14 -8.847 -12.590 -0.962 1.00 0.00 S ATOM 0 H CYS A 14 -11.380 -13.583 -4.131 1.00 0.00 H new ATOM 0 HA CYS A 14 -11.569 -13.020 -1.367 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -9.553 -13.546 -3.041 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -9.469 -11.798 -3.134 1.00 0.00 H new ATOM 0 HG CYS A 14 -9.656 -12.394 0.037 1.00 0.00 H new ATOM 153 N LEU A 15 -11.537 -10.452 -1.108 1.00 0.00 N ATOM 154 CA LEU A 15 -11.913 -9.054 -0.924 1.00 0.00 C ATOM 155 C LEU A 15 -10.806 -8.281 -0.216 1.00 0.00 C ATOM 156 O LEU A 15 -9.952 -8.868 0.450 1.00 0.00 O ATOM 157 CB LEU A 15 -13.213 -8.956 -0.123 1.00 0.00 C ATOM 158 CG LEU A 15 -14.506 -8.958 -0.939 1.00 0.00 C ATOM 159 CD1 LEU A 15 -14.942 -10.381 -1.244 1.00 0.00 C ATOM 160 CD2 LEU A 15 -15.604 -8.209 -0.198 1.00 0.00 C ATOM 0 H LEU A 15 -11.110 -10.885 -0.289 1.00 0.00 H new ATOM 0 HA LEU A 15 -12.066 -8.612 -1.909 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -13.248 -9.790 0.578 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -13.183 -8.042 0.470 1.00 0.00 H new ATOM 0 HG LEU A 15 -14.318 -8.447 -1.884 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -15.864 -10.362 -1.825 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -14.163 -10.886 -1.815 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -15.113 -10.917 -0.310 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -16.517 -8.220 -0.793 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -15.790 -8.692 0.761 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -15.292 -7.178 -0.031 1.00 0.00 H new ATOM 172 N ALA A 16 -10.827 -6.960 -0.361 1.00 0.00 N ATOM 173 CA ALA A 16 -9.828 -6.106 0.268 1.00 0.00 C ATOM 174 C ALA A 16 -10.487 -5.017 1.108 1.00 0.00 C ATOM 175 O ALA A 16 -11.186 -4.151 0.583 1.00 0.00 O ATOM 176 CB ALA A 16 -8.923 -5.486 -0.787 1.00 0.00 C ATOM 0 H ALA A 16 -11.526 -6.458 -0.909 1.00 0.00 H new ATOM 0 HA ALA A 16 -9.223 -6.725 0.931 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -8.182 -4.851 -0.303 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -8.417 -6.276 -1.342 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -9.522 -4.887 -1.473 1.00 0.00 H new ATOM 182 N THR A 17 -10.259 -5.067 2.417 1.00 0.00 N ATOM 183 CA THR A 17 -10.832 -4.086 3.330 1.00 0.00 C ATOM 184 C THR A 17 -9.744 -3.366 4.117 1.00 0.00 C ATOM 185 O THR A 17 -8.940 -3.995 4.804 1.00 0.00 O ATOM 186 CB THR A 17 -11.813 -4.745 4.318 1.00 0.00 C ATOM 187 OG1 THR A 17 -11.162 -5.811 5.018 1.00 0.00 O ATOM 188 CG2 THR A 17 -13.036 -5.281 3.591 1.00 0.00 C ATOM 0 H THR A 17 -9.682 -5.776 2.868 1.00 0.00 H new ATOM 0 HA THR A 17 -11.373 -3.363 2.719 1.00 0.00 H new ATOM 0 HB THR A 17 -12.138 -3.988 5.032 1.00 0.00 H new ATOM 0 HG1 THR A 17 -10.221 -5.580 5.164 1.00 0.00 H new ATOM 0 HG21 THR A 17 -13.714 -5.742 4.310 1.00 0.00 H new ATOM 0 HG22 THR A 17 -13.546 -4.462 3.085 1.00 0.00 H new ATOM 0 HG23 THR A 17 -12.726 -6.025 2.857 1.00 0.00 H new ATOM 196 N GLY A 18 -9.722 -2.039 4.011 1.00 0.00 N ATOM 197 CA GLY A 18 -8.727 -1.256 4.719 1.00 0.00 C ATOM 198 C GLY A 18 -8.731 0.201 4.298 1.00 0.00 C ATOM 199 O GLY A 18 -9.155 0.550 3.196 1.00 0.00 O ATOM 0 H GLY A 18 -10.375 -1.494 3.448 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -8.912 -1.322 5.791 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -7.739 -1.681 4.539 1.00 0.00 H new ATOM 203 N PRO A 19 -8.250 1.080 5.190 1.00 0.00 N ATOM 204 CA PRO A 19 -8.190 2.521 4.927 1.00 0.00 C ATOM 205 C PRO A 19 -7.149 2.874 3.870 1.00 0.00 C ATOM 206 O PRO A 19 -7.198 3.947 3.271 1.00 0.00 O ATOM 207 CB PRO A 19 -7.797 3.113 6.284 1.00 0.00 C ATOM 208 CG PRO A 19 -7.078 2.010 6.983 1.00 0.00 C ATOM 209 CD PRO A 19 -7.727 0.734 6.522 1.00 0.00 C ATOM 0 HA PRO A 19 -9.133 2.904 4.536 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -7.159 3.989 6.164 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -8.675 3.433 6.846 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -6.016 2.019 6.737 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -7.155 2.118 8.065 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -7.011 -0.086 6.472 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -8.523 0.421 7.198 1.00 0.00 H new ATOM 217 N GLY A 20 -6.206 1.964 3.647 1.00 0.00 N ATOM 218 CA GLY A 20 -5.168 2.199 2.661 1.00 0.00 C ATOM 219 C GLY A 20 -5.663 2.016 1.240 1.00 0.00 C ATOM 220 O GLY A 20 -5.287 2.772 0.343 1.00 0.00 O ATOM 0 H GLY A 20 -6.142 1.069 4.131 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -4.781 3.211 2.780 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -4.337 1.517 2.843 1.00 0.00 H new ATOM 224 N ILE A 21 -6.509 1.013 1.034 1.00 0.00 N ATOM 225 CA ILE A 21 -7.057 0.734 -0.287 1.00 0.00 C ATOM 226 C ILE A 21 -8.200 1.686 -0.620 1.00 0.00 C ATOM 227 O ILE A 21 -8.550 1.868 -1.785 1.00 0.00 O ATOM 228 CB ILE A 21 -7.562 -0.717 -0.393 1.00 0.00 C ATOM 229 CG1 ILE A 21 -8.634 -0.984 0.666 1.00 0.00 C ATOM 230 CG2 ILE A 21 -6.405 -1.693 -0.242 1.00 0.00 C ATOM 231 CD1 ILE A 21 -9.514 -2.173 0.349 1.00 0.00 C ATOM 0 H ILE A 21 -6.830 0.379 1.766 1.00 0.00 H new ATOM 0 HA ILE A 21 -6.247 0.880 -1.002 1.00 0.00 H new ATOM 0 HB ILE A 21 -8.006 -0.861 -1.378 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -8.149 -1.147 1.629 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -9.259 -0.097 0.770 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -6.778 -2.714 -0.319 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -5.673 -1.514 -1.029 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -5.934 -1.551 0.731 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -10.250 -2.303 1.142 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -10.027 -2.004 -0.598 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -8.900 -3.070 0.274 1.00 0.00 H new ATOM 243 N ALA A 22 -8.780 2.289 0.413 1.00 0.00 N ATOM 244 CA ALA A 22 -9.882 3.225 0.230 1.00 0.00 C ATOM 245 C ALA A 22 -9.631 4.144 -0.961 1.00 0.00 C ATOM 246 O ALA A 22 -8.541 4.696 -1.112 1.00 0.00 O ATOM 247 CB ALA A 22 -10.095 4.043 1.494 1.00 0.00 C ATOM 0 H ALA A 22 -8.505 2.146 1.385 1.00 0.00 H new ATOM 0 HA ALA A 22 -10.785 2.649 0.027 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -10.921 4.738 1.343 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -10.329 3.376 2.324 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -9.188 4.602 1.723 1.00 0.00 H new ATOM 253 N SER A 23 -10.645 4.302 -1.805 1.00 0.00 N ATOM 254 CA SER A 23 -10.533 5.150 -2.986 1.00 0.00 C ATOM 255 C SER A 23 -9.692 6.388 -2.687 1.00 0.00 C ATOM 256 O SER A 23 -8.865 6.804 -3.498 1.00 0.00 O ATOM 257 CB SER A 23 -11.921 5.568 -3.475 1.00 0.00 C ATOM 258 OG SER A 23 -12.448 4.618 -4.384 1.00 0.00 O ATOM 0 H SER A 23 -11.554 3.854 -1.693 1.00 0.00 H new ATOM 0 HA SER A 23 -10.039 4.576 -3.770 1.00 0.00 H new ATOM 0 HB2 SER A 23 -12.594 5.674 -2.624 1.00 0.00 H new ATOM 0 HB3 SER A 23 -11.862 6.544 -3.957 1.00 0.00 H new ATOM 0 HG SER A 23 -13.336 4.907 -4.681 1.00 0.00 H new ATOM 264 N THR A 24 -9.911 6.974 -1.513 1.00 0.00 N ATOM 265 CA THR A 24 -9.176 8.165 -1.106 1.00 0.00 C ATOM 266 C THR A 24 -8.549 7.980 0.271 1.00 0.00 C ATOM 267 O THR A 24 -9.109 7.304 1.134 1.00 0.00 O ATOM 268 CB THR A 24 -10.088 9.406 -1.078 1.00 0.00 C ATOM 269 OG1 THR A 24 -11.211 9.170 -0.222 1.00 0.00 O ATOM 270 CG2 THR A 24 -10.575 9.751 -2.477 1.00 0.00 C ATOM 0 H THR A 24 -10.591 6.643 -0.828 1.00 0.00 H new ATOM 0 HA THR A 24 -8.389 8.318 -1.844 1.00 0.00 H new ATOM 0 HB THR A 24 -9.509 10.246 -0.694 1.00 0.00 H new ATOM 0 HG1 THR A 24 -11.785 9.964 -0.209 1.00 0.00 H new ATOM 0 HG21 THR A 24 -11.217 10.631 -2.432 1.00 0.00 H new ATOM 0 HG22 THR A 24 -9.719 9.959 -3.119 1.00 0.00 H new ATOM 0 HG23 THR A 24 -11.138 8.911 -2.884 1.00 0.00 H new ATOM 278 N VAL A 25 -7.381 8.584 0.471 1.00 0.00 N ATOM 279 CA VAL A 25 -6.678 8.487 1.744 1.00 0.00 C ATOM 280 C VAL A 25 -5.965 9.791 2.080 1.00 0.00 C ATOM 281 O VAL A 25 -5.972 10.737 1.290 1.00 0.00 O ATOM 282 CB VAL A 25 -5.649 7.341 1.731 1.00 0.00 C ATOM 283 CG1 VAL A 25 -6.334 6.010 1.456 1.00 0.00 C ATOM 284 CG2 VAL A 25 -4.562 7.613 0.701 1.00 0.00 C ATOM 0 H VAL A 25 -6.902 9.146 -0.233 1.00 0.00 H new ATOM 0 HA VAL A 25 -7.431 8.282 2.505 1.00 0.00 H new ATOM 0 HB VAL A 25 -5.181 7.285 2.714 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -5.591 5.213 1.451 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -7.072 5.813 2.234 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -6.830 6.050 0.486 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -3.843 6.793 0.705 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -5.011 7.697 -0.289 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -4.052 8.544 0.948 1.00 0.00 H new ATOM 294 N LYS A 26 -5.349 9.838 3.255 1.00 0.00 N ATOM 295 CA LYS A 26 -4.629 11.026 3.696 1.00 0.00 C ATOM 296 C LYS A 26 -3.125 10.771 3.726 1.00 0.00 C ATOM 297 O LYS A 26 -2.677 9.673 4.057 1.00 0.00 O ATOM 298 CB LYS A 26 -5.112 11.455 5.084 1.00 0.00 C ATOM 299 CG LYS A 26 -4.608 12.824 5.506 1.00 0.00 C ATOM 300 CD LYS A 26 -4.509 12.939 7.018 1.00 0.00 C ATOM 301 CE LYS A 26 -4.563 14.390 7.472 1.00 0.00 C ATOM 302 NZ LYS A 26 -4.135 14.545 8.890 1.00 0.00 N ATOM 0 H LYS A 26 -5.334 9.065 3.921 1.00 0.00 H new ATOM 0 HA LYS A 26 -4.830 11.827 2.984 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -6.202 11.459 5.095 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -4.788 10.716 5.817 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -3.630 13.006 5.061 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -5.279 13.593 5.125 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -5.324 12.382 7.480 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -3.578 12.485 7.358 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -3.922 14.995 6.831 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -5.578 14.769 7.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -4.186 15.548 9.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -4.762 13.988 9.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -3.157 14.207 8.996 1.00 0.00 H new ATOM 316 N THR A 27 -2.349 11.793 3.379 1.00 0.00 N ATOM 317 CA THR A 27 -0.896 11.681 3.367 1.00 0.00 C ATOM 318 C THR A 27 -0.312 11.945 4.749 1.00 0.00 C ATOM 319 O THR A 27 -0.981 12.497 5.621 1.00 0.00 O ATOM 320 CB THR A 27 -0.265 12.659 2.359 1.00 0.00 C ATOM 321 OG1 THR A 27 -0.600 14.007 2.710 1.00 0.00 O ATOM 322 CG2 THR A 27 -0.743 12.364 0.945 1.00 0.00 C ATOM 0 H THR A 27 -2.703 12.709 3.102 1.00 0.00 H new ATOM 0 HA THR A 27 -0.661 10.660 3.066 1.00 0.00 H new ATOM 0 HB THR A 27 0.817 12.533 2.393 1.00 0.00 H new ATOM 0 HG1 THR A 27 -0.194 14.623 2.065 1.00 0.00 H new ATOM 0 HG21 THR A 27 -0.283 13.068 0.251 1.00 0.00 H new ATOM 0 HG22 THR A 27 -0.461 11.348 0.670 1.00 0.00 H new ATOM 0 HG23 THR A 27 -1.827 12.465 0.899 1.00 0.00 H new ATOM 330 N GLY A 28 0.943 11.547 4.942 1.00 0.00 N ATOM 331 CA GLY A 28 1.596 11.750 6.223 1.00 0.00 C ATOM 332 C GLY A 28 1.286 10.647 7.214 1.00 0.00 C ATOM 333 O GLY A 28 2.137 10.270 8.020 1.00 0.00 O ATOM 0 H GLY A 28 1.518 11.088 4.235 1.00 0.00 H new ATOM 0 HA2 GLY A 28 2.674 11.806 6.073 1.00 0.00 H new ATOM 0 HA3 GLY A 28 1.282 12.707 6.640 1.00 0.00 H new ATOM 337 N GLU A 29 0.064 10.127 7.157 1.00 0.00 N ATOM 338 CA GLU A 29 -0.357 9.061 8.058 1.00 0.00 C ATOM 339 C GLU A 29 -0.049 7.691 7.462 1.00 0.00 C ATOM 340 O GLU A 29 0.091 7.549 6.248 1.00 0.00 O ATOM 341 CB GLU A 29 -1.853 9.176 8.357 1.00 0.00 C ATOM 342 CG GLU A 29 -2.739 8.763 7.193 1.00 0.00 C ATOM 343 CD GLU A 29 -3.082 7.287 7.216 1.00 0.00 C ATOM 344 OE1 GLU A 29 -2.276 6.481 6.707 1.00 0.00 O ATOM 345 OE2 GLU A 29 -4.159 6.936 7.745 1.00 0.00 O ATOM 0 H GLU A 29 -0.652 10.427 6.496 1.00 0.00 H new ATOM 0 HA GLU A 29 0.200 9.166 8.989 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -2.091 8.556 9.222 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -2.082 10.206 8.630 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -3.659 9.346 7.217 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -2.235 9.001 6.256 1.00 0.00 H new ATOM 352 N GLU A 30 0.055 6.686 8.326 1.00 0.00 N ATOM 353 CA GLU A 30 0.347 5.328 7.885 1.00 0.00 C ATOM 354 C GLU A 30 -0.929 4.492 7.812 1.00 0.00 C ATOM 355 O GLU A 30 -1.634 4.328 8.809 1.00 0.00 O ATOM 356 CB GLU A 30 1.351 4.665 8.831 1.00 0.00 C ATOM 357 CG GLU A 30 1.531 3.177 8.581 1.00 0.00 C ATOM 358 CD GLU A 30 2.768 2.619 9.258 1.00 0.00 C ATOM 359 OE1 GLU A 30 2.661 2.183 10.423 1.00 0.00 O ATOM 360 OE2 GLU A 30 3.843 2.617 8.622 1.00 0.00 O ATOM 0 H GLU A 30 -0.059 6.787 9.335 1.00 0.00 H new ATOM 0 HA GLU A 30 0.781 5.384 6.887 1.00 0.00 H new ATOM 0 HB2 GLU A 30 2.316 5.161 8.729 1.00 0.00 H new ATOM 0 HB3 GLU A 30 1.022 4.815 9.859 1.00 0.00 H new ATOM 0 HG2 GLU A 30 0.652 2.643 8.941 1.00 0.00 H new ATOM 0 HG3 GLU A 30 1.596 2.998 7.508 1.00 0.00 H new ATOM 367 N VAL A 31 -1.218 3.967 6.626 1.00 0.00 N ATOM 368 CA VAL A 31 -2.408 3.148 6.424 1.00 0.00 C ATOM 369 C VAL A 31 -2.127 1.682 6.735 1.00 0.00 C ATOM 370 O VAL A 31 -0.975 1.283 6.901 1.00 0.00 O ATOM 371 CB VAL A 31 -2.928 3.264 4.978 1.00 0.00 C ATOM 372 CG1 VAL A 31 -3.310 4.701 4.661 1.00 0.00 C ATOM 373 CG2 VAL A 31 -1.886 2.750 3.995 1.00 0.00 C ATOM 0 H VAL A 31 -0.646 4.094 5.791 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.170 3.521 7.109 1.00 0.00 H new ATOM 0 HB VAL A 31 -3.821 2.647 4.881 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -3.675 4.763 3.636 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -4.093 5.029 5.345 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -2.437 5.343 4.775 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -2.269 2.839 2.979 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -0.973 3.338 4.091 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -1.668 1.704 4.210 1.00 0.00 H new ATOM 383 N GLY A 32 -3.187 0.886 6.815 1.00 0.00 N ATOM 384 CA GLY A 32 -3.034 -0.527 7.106 1.00 0.00 C ATOM 385 C GLY A 32 -4.252 -1.338 6.709 1.00 0.00 C ATOM 386 O GLY A 32 -5.242 -1.384 7.440 1.00 0.00 O ATOM 0 H GLY A 32 -4.150 1.194 6.683 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -2.160 -0.910 6.580 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -2.847 -0.657 8.172 1.00 0.00 H new ATOM 390 N PHE A 33 -4.182 -1.977 5.546 1.00 0.00 N ATOM 391 CA PHE A 33 -5.290 -2.786 5.050 1.00 0.00 C ATOM 392 C PHE A 33 -4.948 -4.272 5.116 1.00 0.00 C ATOM 393 O PHE A 33 -3.780 -4.656 5.056 1.00 0.00 O ATOM 394 CB PHE A 33 -5.632 -2.394 3.612 1.00 0.00 C ATOM 395 CG PHE A 33 -4.526 -2.669 2.635 1.00 0.00 C ATOM 396 CD1 PHE A 33 -4.381 -3.924 2.066 1.00 0.00 C ATOM 397 CD2 PHE A 33 -3.628 -1.673 2.285 1.00 0.00 C ATOM 398 CE1 PHE A 33 -3.363 -4.180 1.167 1.00 0.00 C ATOM 399 CE2 PHE A 33 -2.608 -1.923 1.387 1.00 0.00 C ATOM 400 CZ PHE A 33 -2.476 -3.178 0.826 1.00 0.00 C ATOM 0 H PHE A 33 -3.370 -1.951 4.929 1.00 0.00 H new ATOM 0 HA PHE A 33 -6.156 -2.601 5.685 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -6.525 -2.935 3.299 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -5.876 -1.332 3.582 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -5.072 -4.712 2.328 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -3.727 -0.689 2.720 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -3.261 -5.163 0.731 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -1.915 -1.138 1.124 1.00 0.00 H new ATOM 0 HZ PHE A 33 -1.681 -3.375 0.122 1.00 0.00 H new ATOM 410 N VAL A 34 -5.977 -5.104 5.243 1.00 0.00 N ATOM 411 CA VAL A 34 -5.788 -6.547 5.317 1.00 0.00 C ATOM 412 C VAL A 34 -6.735 -7.276 4.371 1.00 0.00 C ATOM 413 O VAL A 34 -7.926 -6.970 4.310 1.00 0.00 O ATOM 414 CB VAL A 34 -6.009 -7.071 6.749 1.00 0.00 C ATOM 415 CG1 VAL A 34 -7.433 -6.793 7.204 1.00 0.00 C ATOM 416 CG2 VAL A 34 -5.696 -8.557 6.828 1.00 0.00 C ATOM 0 H VAL A 34 -6.950 -4.803 5.297 1.00 0.00 H new ATOM 0 HA VAL A 34 -4.758 -6.745 5.020 1.00 0.00 H new ATOM 0 HB VAL A 34 -5.329 -6.545 7.419 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -7.571 -7.170 8.217 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -7.617 -5.719 7.188 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -8.133 -7.291 6.533 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -5.858 -8.909 7.847 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -6.349 -9.103 6.147 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -4.656 -8.725 6.547 1.00 0.00 H new ATOM 426 N VAL A 35 -6.199 -8.241 3.631 1.00 0.00 N ATOM 427 CA VAL A 35 -6.997 -9.015 2.687 1.00 0.00 C ATOM 428 C VAL A 35 -7.710 -10.168 3.386 1.00 0.00 C ATOM 429 O VAL A 35 -7.082 -10.975 4.071 1.00 0.00 O ATOM 430 CB VAL A 35 -6.128 -9.580 1.548 1.00 0.00 C ATOM 431 CG1 VAL A 35 -6.967 -10.431 0.608 1.00 0.00 C ATOM 432 CG2 VAL A 35 -5.444 -8.451 0.791 1.00 0.00 C ATOM 0 H VAL A 35 -5.215 -8.506 3.667 1.00 0.00 H new ATOM 0 HA VAL A 35 -7.737 -8.334 2.266 1.00 0.00 H new ATOM 0 HB VAL A 35 -5.357 -10.215 1.983 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -6.336 -10.822 -0.190 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -7.406 -11.261 1.162 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -7.762 -9.822 0.177 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -4.834 -8.868 -0.010 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -6.198 -7.789 0.366 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -4.809 -7.887 1.474 1.00 0.00 H new ATOM 442 N ASP A 36 -9.025 -10.237 3.207 1.00 0.00 N ATOM 443 CA ASP A 36 -9.824 -11.291 3.820 1.00 0.00 C ATOM 444 C ASP A 36 -10.157 -12.380 2.804 1.00 0.00 C ATOM 445 O ASP A 36 -10.488 -12.090 1.655 1.00 0.00 O ATOM 446 CB ASP A 36 -11.113 -10.711 4.403 1.00 0.00 C ATOM 447 CG ASP A 36 -11.672 -11.558 5.530 1.00 0.00 C ATOM 448 OD1 ASP A 36 -11.763 -12.791 5.355 1.00 0.00 O ATOM 449 OD2 ASP A 36 -12.020 -10.988 6.585 1.00 0.00 O ATOM 0 H ASP A 36 -9.559 -9.576 2.643 1.00 0.00 H new ATOM 0 HA ASP A 36 -9.238 -11.735 4.625 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -10.920 -9.703 4.771 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -11.859 -10.625 3.613 1.00 0.00 H new ATOM 454 N ALA A 37 -10.066 -13.634 3.236 1.00 0.00 N ATOM 455 CA ALA A 37 -10.359 -14.765 2.365 1.00 0.00 C ATOM 456 C ALA A 37 -11.351 -15.719 3.019 1.00 0.00 C ATOM 457 O ALA A 37 -11.143 -16.175 4.144 1.00 0.00 O ATOM 458 CB ALA A 37 -9.075 -15.500 2.006 1.00 0.00 C ATOM 0 H ALA A 37 -9.792 -13.892 4.184 1.00 0.00 H new ATOM 0 HA ALA A 37 -10.813 -14.381 1.452 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -9.308 -16.343 1.355 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -8.398 -14.819 1.490 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -8.598 -15.865 2.916 1.00 0.00 H new ATOM 464 N LYS A 38 -12.433 -16.018 2.309 1.00 0.00 N ATOM 465 CA LYS A 38 -13.461 -16.919 2.819 1.00 0.00 C ATOM 466 C LYS A 38 -13.700 -18.075 1.853 1.00 0.00 C ATOM 467 O LYS A 38 -13.824 -19.228 2.265 1.00 0.00 O ATOM 468 CB LYS A 38 -14.766 -16.156 3.053 1.00 0.00 C ATOM 469 CG LYS A 38 -15.234 -15.365 1.844 1.00 0.00 C ATOM 470 CD LYS A 38 -16.582 -14.710 2.094 1.00 0.00 C ATOM 471 CE LYS A 38 -17.190 -14.178 0.805 1.00 0.00 C ATOM 472 NZ LYS A 38 -17.859 -15.253 0.022 1.00 0.00 N ATOM 0 H LYS A 38 -12.622 -15.649 1.377 1.00 0.00 H new ATOM 0 HA LYS A 38 -13.112 -17.329 3.767 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -15.545 -16.864 3.337 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -14.633 -15.474 3.893 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -14.496 -14.600 1.601 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -15.304 -16.026 0.980 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -17.261 -15.433 2.547 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -16.465 -13.893 2.806 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -17.913 -13.397 1.040 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -16.410 -13.719 0.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -18.260 -14.850 -0.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -17.164 -15.987 -0.224 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -18.620 -15.675 0.591 1.00 0.00 H new ATOM 486 N THR A 39 -13.764 -17.757 0.563 1.00 0.00 N ATOM 487 CA THR A 39 -13.989 -18.769 -0.463 1.00 0.00 C ATOM 488 C THR A 39 -12.848 -18.789 -1.473 1.00 0.00 C ATOM 489 O THR A 39 -12.641 -19.782 -2.170 1.00 0.00 O ATOM 490 CB THR A 39 -15.315 -18.530 -1.206 1.00 0.00 C ATOM 491 OG1 THR A 39 -15.378 -17.177 -1.674 1.00 0.00 O ATOM 492 CG2 THR A 39 -16.504 -18.814 -0.300 1.00 0.00 C ATOM 0 H THR A 39 -13.663 -16.807 0.204 1.00 0.00 H new ATOM 0 HA THR A 39 -14.036 -19.732 0.046 1.00 0.00 H new ATOM 0 HB THR A 39 -15.356 -19.211 -2.056 1.00 0.00 H new ATOM 0 HG1 THR A 39 -16.224 -17.034 -2.147 1.00 0.00 H new ATOM 0 HG21 THR A 39 -17.429 -18.638 -0.848 1.00 0.00 H new ATOM 0 HG22 THR A 39 -16.470 -19.852 0.030 1.00 0.00 H new ATOM 0 HG23 THR A 39 -16.466 -18.156 0.568 1.00 0.00 H new ATOM 500 N ALA A 40 -12.110 -17.686 -1.549 1.00 0.00 N ATOM 501 CA ALA A 40 -10.989 -17.579 -2.474 1.00 0.00 C ATOM 502 C ALA A 40 -10.186 -18.875 -2.516 1.00 0.00 C ATOM 503 O ALA A 40 -9.897 -19.402 -3.590 1.00 0.00 O ATOM 504 CB ALA A 40 -10.093 -16.413 -2.083 1.00 0.00 C ATOM 0 H ALA A 40 -12.269 -16.854 -0.981 1.00 0.00 H new ATOM 0 HA ALA A 40 -11.389 -17.398 -3.472 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -9.260 -16.344 -2.782 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -10.668 -15.487 -2.111 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -9.709 -16.571 -1.075 1.00 0.00 H new ATOM 510 N GLY A 41 -9.829 -19.383 -1.341 1.00 0.00 N ATOM 511 CA GLY A 41 -9.063 -20.614 -1.267 1.00 0.00 C ATOM 512 C GLY A 41 -7.593 -20.365 -0.993 1.00 0.00 C ATOM 513 O GLY A 41 -7.233 -19.393 -0.331 1.00 0.00 O ATOM 0 H GLY A 41 -10.056 -18.965 -0.439 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -9.474 -21.248 -0.481 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -9.168 -21.161 -2.204 1.00 0.00 H new ATOM 517 N LYS A 42 -6.741 -21.248 -1.502 1.00 0.00 N ATOM 518 CA LYS A 42 -5.301 -21.122 -1.309 1.00 0.00 C ATOM 519 C LYS A 42 -4.697 -20.162 -2.329 1.00 0.00 C ATOM 520 O LYS A 42 -5.125 -20.116 -3.482 1.00 0.00 O ATOM 521 CB LYS A 42 -4.628 -22.491 -1.423 1.00 0.00 C ATOM 522 CG LYS A 42 -3.150 -22.474 -1.070 1.00 0.00 C ATOM 523 CD LYS A 42 -2.925 -22.781 0.401 1.00 0.00 C ATOM 524 CE LYS A 42 -3.309 -21.602 1.282 1.00 0.00 C ATOM 525 NZ LYS A 42 -4.728 -21.680 1.726 1.00 0.00 N ATOM 0 H LYS A 42 -7.023 -22.060 -2.052 1.00 0.00 H new ATOM 0 HA LYS A 42 -5.128 -20.721 -0.310 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -5.141 -23.195 -0.768 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -4.745 -22.861 -2.442 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -2.621 -23.206 -1.680 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -2.729 -21.497 -1.307 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -3.511 -23.655 0.685 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -1.877 -23.033 0.565 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -2.657 -21.573 2.155 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -3.150 -20.673 0.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -5.177 -20.748 1.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -5.235 -22.379 1.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -4.764 -21.967 2.725 1.00 0.00 H new ATOM 539 N GLY A 43 -3.700 -19.395 -1.897 1.00 0.00 N ATOM 540 CA GLY A 43 -3.054 -18.448 -2.786 1.00 0.00 C ATOM 541 C GLY A 43 -2.316 -17.358 -2.033 1.00 0.00 C ATOM 542 O GLY A 43 -2.701 -16.989 -0.923 1.00 0.00 O ATOM 0 H GLY A 43 -3.329 -19.413 -0.947 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -2.353 -18.979 -3.430 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -3.803 -17.994 -3.435 1.00 0.00 H new ATOM 546 N LYS A 44 -1.253 -16.840 -2.638 1.00 0.00 N ATOM 547 CA LYS A 44 -0.458 -15.785 -2.019 1.00 0.00 C ATOM 548 C LYS A 44 -0.901 -14.411 -2.509 1.00 0.00 C ATOM 549 O LYS A 44 -1.154 -14.217 -3.699 1.00 0.00 O ATOM 550 CB LYS A 44 1.027 -15.993 -2.322 1.00 0.00 C ATOM 551 CG LYS A 44 1.716 -16.947 -1.364 1.00 0.00 C ATOM 552 CD LYS A 44 3.226 -16.777 -1.396 1.00 0.00 C ATOM 553 CE LYS A 44 3.937 -17.992 -0.820 1.00 0.00 C ATOM 554 NZ LYS A 44 3.670 -18.154 0.636 1.00 0.00 N ATOM 0 H LYS A 44 -0.921 -17.133 -3.557 1.00 0.00 H new ATOM 0 HA LYS A 44 -0.612 -15.833 -0.941 1.00 0.00 H new ATOM 0 HB2 LYS A 44 1.132 -16.373 -3.338 1.00 0.00 H new ATOM 0 HB3 LYS A 44 1.534 -15.029 -2.289 1.00 0.00 H new ATOM 0 HG2 LYS A 44 1.351 -16.774 -0.352 1.00 0.00 H new ATOM 0 HG3 LYS A 44 1.459 -17.974 -1.624 1.00 0.00 H new ATOM 0 HD2 LYS A 44 3.553 -16.616 -2.423 1.00 0.00 H new ATOM 0 HD3 LYS A 44 3.505 -15.889 -0.830 1.00 0.00 H new ATOM 0 HE2 LYS A 44 3.613 -18.887 -1.350 1.00 0.00 H new ATOM 0 HE3 LYS A 44 5.010 -17.896 -0.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 4.172 -18.993 0.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 4.002 -17.311 1.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 2.648 -18.272 0.791 1.00 0.00 H new ATOM 568 N VAL A 45 -0.993 -13.459 -1.587 1.00 0.00 N ATOM 569 CA VAL A 45 -1.404 -12.102 -1.927 1.00 0.00 C ATOM 570 C VAL A 45 -0.214 -11.148 -1.911 1.00 0.00 C ATOM 571 O VAL A 45 0.354 -10.862 -0.856 1.00 0.00 O ATOM 572 CB VAL A 45 -2.477 -11.580 -0.954 1.00 0.00 C ATOM 573 CG1 VAL A 45 -2.915 -10.176 -1.344 1.00 0.00 C ATOM 574 CG2 VAL A 45 -3.668 -12.527 -0.918 1.00 0.00 C ATOM 0 H VAL A 45 -0.788 -13.602 -0.598 1.00 0.00 H new ATOM 0 HA VAL A 45 -1.823 -12.141 -2.932 1.00 0.00 H new ATOM 0 HB VAL A 45 -2.045 -11.535 0.046 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -3.674 -9.824 -0.645 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -2.056 -9.506 -1.315 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -3.330 -10.191 -2.352 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -4.417 -12.143 -0.225 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -4.101 -12.605 -1.915 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -3.339 -13.512 -0.588 1.00 0.00 H new ATOM 584 N THR A 46 0.159 -10.657 -3.089 1.00 0.00 N ATOM 585 CA THR A 46 1.282 -9.737 -3.213 1.00 0.00 C ATOM 586 C THR A 46 0.799 -8.299 -3.366 1.00 0.00 C ATOM 587 O THR A 46 -0.179 -8.034 -4.066 1.00 0.00 O ATOM 588 CB THR A 46 2.176 -10.096 -4.414 1.00 0.00 C ATOM 589 OG1 THR A 46 1.397 -10.114 -5.616 1.00 0.00 O ATOM 590 CG2 THR A 46 2.834 -11.453 -4.211 1.00 0.00 C ATOM 0 H THR A 46 -0.301 -10.882 -3.971 1.00 0.00 H new ATOM 0 HA THR A 46 1.866 -9.827 -2.297 1.00 0.00 H new ATOM 0 HB THR A 46 2.956 -9.339 -4.498 1.00 0.00 H new ATOM 0 HG1 THR A 46 1.973 -10.341 -6.376 1.00 0.00 H new ATOM 0 HG21 THR A 46 3.461 -11.686 -5.072 1.00 0.00 H new ATOM 0 HG22 THR A 46 3.448 -11.429 -3.311 1.00 0.00 H new ATOM 0 HG23 THR A 46 2.065 -12.218 -4.105 1.00 0.00 H new ATOM 598 N CYS A 47 1.490 -7.374 -2.709 1.00 0.00 N ATOM 599 CA CYS A 47 1.131 -5.961 -2.773 1.00 0.00 C ATOM 600 C CYS A 47 2.298 -5.127 -3.293 1.00 0.00 C ATOM 601 O CYS A 47 3.459 -5.411 -2.998 1.00 0.00 O ATOM 602 CB CYS A 47 0.703 -5.460 -1.394 1.00 0.00 C ATOM 603 SG CYS A 47 0.607 -3.659 -1.260 1.00 0.00 S ATOM 0 H CYS A 47 2.302 -7.577 -2.126 1.00 0.00 H new ATOM 0 HA CYS A 47 0.296 -5.854 -3.465 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -0.271 -5.884 -1.151 1.00 0.00 H new ATOM 0 HB3 CYS A 47 1.407 -5.832 -0.649 1.00 0.00 H new ATOM 0 HG CYS A 47 1.774 -3.143 -1.507 1.00 0.00 H new ATOM 609 N THR A 48 1.981 -4.095 -4.070 1.00 0.00 N ATOM 610 CA THR A 48 3.002 -3.221 -4.633 1.00 0.00 C ATOM 611 C THR A 48 2.505 -1.782 -4.724 1.00 0.00 C ATOM 612 O THR A 48 1.588 -1.480 -5.489 1.00 0.00 O ATOM 613 CB THR A 48 3.436 -3.693 -6.033 1.00 0.00 C ATOM 614 OG1 THR A 48 4.034 -4.992 -5.949 1.00 0.00 O ATOM 615 CG2 THR A 48 4.423 -2.715 -6.652 1.00 0.00 C ATOM 0 H THR A 48 1.025 -3.845 -4.323 1.00 0.00 H new ATOM 0 HA THR A 48 3.860 -3.264 -3.962 1.00 0.00 H new ATOM 0 HB THR A 48 2.550 -3.741 -6.666 1.00 0.00 H new ATOM 0 HG1 THR A 48 4.306 -5.286 -6.844 1.00 0.00 H new ATOM 0 HG21 THR A 48 4.715 -3.070 -7.640 1.00 0.00 H new ATOM 0 HG22 THR A 48 3.956 -1.734 -6.742 1.00 0.00 H new ATOM 0 HG23 THR A 48 5.306 -2.639 -6.018 1.00 0.00 H new ATOM 623 N VAL A 49 3.115 -0.898 -3.942 1.00 0.00 N ATOM 624 CA VAL A 49 2.735 0.509 -3.937 1.00 0.00 C ATOM 625 C VAL A 49 3.485 1.285 -5.013 1.00 0.00 C ATOM 626 O VAL A 49 4.707 1.426 -4.953 1.00 0.00 O ATOM 627 CB VAL A 49 3.007 1.158 -2.567 1.00 0.00 C ATOM 628 CG1 VAL A 49 2.557 2.612 -2.565 1.00 0.00 C ATOM 629 CG2 VAL A 49 2.315 0.377 -1.459 1.00 0.00 C ATOM 0 H VAL A 49 3.875 -1.132 -3.303 1.00 0.00 H new ATOM 0 HA VAL A 49 1.666 0.549 -4.144 1.00 0.00 H new ATOM 0 HB VAL A 49 4.081 1.134 -2.381 1.00 0.00 H new ATOM 0 HG11 VAL A 49 2.757 3.054 -1.589 1.00 0.00 H new ATOM 0 HG12 VAL A 49 3.103 3.163 -3.331 1.00 0.00 H new ATOM 0 HG13 VAL A 49 1.488 2.662 -2.774 1.00 0.00 H new ATOM 0 HG21 VAL A 49 2.519 0.850 -0.498 1.00 0.00 H new ATOM 0 HG22 VAL A 49 1.240 0.367 -1.638 1.00 0.00 H new ATOM 0 HG23 VAL A 49 2.690 -0.646 -1.446 1.00 0.00 H new ATOM 639 N LEU A 50 2.746 1.786 -5.996 1.00 0.00 N ATOM 640 CA LEU A 50 3.341 2.549 -7.088 1.00 0.00 C ATOM 641 C LEU A 50 3.134 4.046 -6.882 1.00 0.00 C ATOM 642 O LEU A 50 2.023 4.556 -7.029 1.00 0.00 O ATOM 643 CB LEU A 50 2.738 2.119 -8.426 1.00 0.00 C ATOM 644 CG LEU A 50 3.627 2.309 -9.655 1.00 0.00 C ATOM 645 CD1 LEU A 50 3.254 1.313 -10.742 1.00 0.00 C ATOM 646 CD2 LEU A 50 3.519 3.734 -10.176 1.00 0.00 C ATOM 0 H LEU A 50 1.734 1.678 -6.060 1.00 0.00 H new ATOM 0 HA LEU A 50 4.412 2.346 -7.098 1.00 0.00 H new ATOM 0 HB2 LEU A 50 2.467 1.065 -8.358 1.00 0.00 H new ATOM 0 HB3 LEU A 50 1.814 2.676 -8.581 1.00 0.00 H new ATOM 0 HG LEU A 50 4.661 2.127 -9.363 1.00 0.00 H new ATOM 0 HD11 LEU A 50 3.897 1.463 -11.609 1.00 0.00 H new ATOM 0 HD12 LEU A 50 3.383 0.298 -10.366 1.00 0.00 H new ATOM 0 HD13 LEU A 50 2.214 1.463 -11.031 1.00 0.00 H new ATOM 0 HD21 LEU A 50 4.158 3.851 -11.051 1.00 0.00 H new ATOM 0 HD22 LEU A 50 2.485 3.943 -10.451 1.00 0.00 H new ATOM 0 HD23 LEU A 50 3.836 4.430 -9.399 1.00 0.00 H new ATOM 658 N THR A 51 4.212 4.746 -6.541 1.00 0.00 N ATOM 659 CA THR A 51 4.149 6.185 -6.316 1.00 0.00 C ATOM 660 C THR A 51 3.941 6.938 -7.625 1.00 0.00 C ATOM 661 O THR A 51 4.394 6.517 -8.690 1.00 0.00 O ATOM 662 CB THR A 51 5.431 6.703 -5.637 1.00 0.00 C ATOM 663 OG1 THR A 51 6.572 6.396 -6.446 1.00 0.00 O ATOM 664 CG2 THR A 51 5.599 6.086 -4.257 1.00 0.00 C ATOM 0 H THR A 51 5.139 4.340 -6.415 1.00 0.00 H new ATOM 0 HA THR A 51 3.299 6.365 -5.658 1.00 0.00 H new ATOM 0 HB THR A 51 5.346 7.784 -5.526 1.00 0.00 H new ATOM 0 HG1 THR A 51 6.684 5.424 -6.498 1.00 0.00 H new ATOM 0 HG21 THR A 51 6.511 6.467 -3.797 1.00 0.00 H new ATOM 0 HG22 THR A 51 4.743 6.347 -3.635 1.00 0.00 H new ATOM 0 HG23 THR A 51 5.664 5.002 -4.349 1.00 0.00 H new ATOM 672 N PRO A 52 3.239 8.078 -7.548 1.00 0.00 N ATOM 673 CA PRO A 52 2.957 8.914 -8.717 1.00 0.00 C ATOM 674 C PRO A 52 4.206 9.605 -9.252 1.00 0.00 C ATOM 675 O PRO A 52 4.148 10.338 -10.240 1.00 0.00 O ATOM 676 CB PRO A 52 1.962 9.948 -8.182 1.00 0.00 C ATOM 677 CG PRO A 52 2.242 10.022 -6.721 1.00 0.00 C ATOM 678 CD PRO A 52 2.669 8.640 -6.311 1.00 0.00 C ATOM 0 HA PRO A 52 2.577 8.328 -9.554 1.00 0.00 H new ATOM 0 HB2 PRO A 52 2.102 10.917 -8.661 1.00 0.00 H new ATOM 0 HB3 PRO A 52 0.933 9.643 -8.373 1.00 0.00 H new ATOM 0 HG2 PRO A 52 3.024 10.751 -6.510 1.00 0.00 H new ATOM 0 HG3 PRO A 52 1.356 10.337 -6.169 1.00 0.00 H new ATOM 0 HD2 PRO A 52 3.404 8.669 -5.507 1.00 0.00 H new ATOM 0 HD3 PRO A 52 1.826 8.049 -5.952 1.00 0.00 H new ATOM 686 N ASP A 53 5.336 9.365 -8.596 1.00 0.00 N ATOM 687 CA ASP A 53 6.601 9.962 -9.008 1.00 0.00 C ATOM 688 C ASP A 53 7.262 9.134 -10.105 1.00 0.00 C ATOM 689 O ASP A 53 8.012 9.660 -10.927 1.00 0.00 O ATOM 690 CB ASP A 53 7.543 10.089 -7.810 1.00 0.00 C ATOM 691 CG ASP A 53 8.498 11.259 -7.945 1.00 0.00 C ATOM 692 OD1 ASP A 53 8.056 12.336 -8.397 1.00 0.00 O ATOM 693 OD2 ASP A 53 9.687 11.097 -7.598 1.00 0.00 O ATOM 0 H ASP A 53 5.402 8.761 -7.777 1.00 0.00 H new ATOM 0 HA ASP A 53 6.393 10.956 -9.404 1.00 0.00 H new ATOM 0 HB2 ASP A 53 6.955 10.207 -6.900 1.00 0.00 H new ATOM 0 HB3 ASP A 53 8.115 9.167 -7.702 1.00 0.00 H new ATOM 698 N GLY A 54 6.978 7.836 -10.111 1.00 0.00 N ATOM 699 CA GLY A 54 7.554 6.956 -11.112 1.00 0.00 C ATOM 700 C GLY A 54 8.544 5.972 -10.518 1.00 0.00 C ATOM 701 O GLY A 54 9.478 5.537 -11.191 1.00 0.00 O ATOM 0 H GLY A 54 6.360 7.378 -9.441 1.00 0.00 H new ATOM 0 HA2 GLY A 54 6.756 6.407 -11.611 1.00 0.00 H new ATOM 0 HA3 GLY A 54 8.054 7.555 -11.873 1.00 0.00 H new ATOM 705 N THR A 55 8.339 5.621 -9.252 1.00 0.00 N ATOM 706 CA THR A 55 9.223 4.686 -8.566 1.00 0.00 C ATOM 707 C THR A 55 8.424 3.634 -7.805 1.00 0.00 C ATOM 708 O THR A 55 7.355 3.922 -7.268 1.00 0.00 O ATOM 709 CB THR A 55 10.159 5.414 -7.584 1.00 0.00 C ATOM 710 OG1 THR A 55 9.389 6.196 -6.663 1.00 0.00 O ATOM 711 CG2 THR A 55 11.133 6.313 -8.329 1.00 0.00 C ATOM 0 H THR A 55 7.569 5.970 -8.681 1.00 0.00 H new ATOM 0 HA THR A 55 9.824 4.198 -9.333 1.00 0.00 H new ATOM 0 HB THR A 55 10.729 4.664 -7.036 1.00 0.00 H new ATOM 0 HG1 THR A 55 8.434 6.058 -6.835 1.00 0.00 H new ATOM 0 HG21 THR A 55 11.783 6.816 -7.614 1.00 0.00 H new ATOM 0 HG22 THR A 55 11.737 5.711 -9.008 1.00 0.00 H new ATOM 0 HG23 THR A 55 10.578 7.057 -8.900 1.00 0.00 H new ATOM 719 N GLU A 56 8.951 2.414 -7.763 1.00 0.00 N ATOM 720 CA GLU A 56 8.285 1.320 -7.067 1.00 0.00 C ATOM 721 C GLU A 56 8.724 1.256 -5.607 1.00 0.00 C ATOM 722 O GLU A 56 9.897 1.030 -5.310 1.00 0.00 O ATOM 723 CB GLU A 56 8.586 -0.012 -7.759 1.00 0.00 C ATOM 724 CG GLU A 56 7.864 -0.185 -9.084 1.00 0.00 C ATOM 725 CD GLU A 56 8.597 -1.116 -10.031 1.00 0.00 C ATOM 726 OE1 GLU A 56 8.490 -2.347 -9.853 1.00 0.00 O ATOM 727 OE2 GLU A 56 9.278 -0.613 -10.949 1.00 0.00 O ATOM 0 H GLU A 56 9.836 2.159 -8.202 1.00 0.00 H new ATOM 0 HA GLU A 56 7.211 1.504 -7.098 1.00 0.00 H new ATOM 0 HB2 GLU A 56 9.660 -0.090 -7.927 1.00 0.00 H new ATOM 0 HB3 GLU A 56 8.307 -0.829 -7.093 1.00 0.00 H new ATOM 0 HG2 GLU A 56 6.863 -0.575 -8.900 1.00 0.00 H new ATOM 0 HG3 GLU A 56 7.744 0.789 -9.558 1.00 0.00 H new ATOM 734 N ALA A 57 7.774 1.460 -4.700 1.00 0.00 N ATOM 735 CA ALA A 57 8.061 1.425 -3.272 1.00 0.00 C ATOM 736 C ALA A 57 7.842 0.028 -2.701 1.00 0.00 C ATOM 737 O ALA A 57 7.084 -0.766 -3.258 1.00 0.00 O ATOM 738 CB ALA A 57 7.199 2.440 -2.535 1.00 0.00 C ATOM 0 H ALA A 57 6.799 1.651 -4.930 1.00 0.00 H new ATOM 0 HA ALA A 57 9.110 1.685 -3.132 1.00 0.00 H new ATOM 0 HB1 ALA A 57 7.424 2.403 -1.469 1.00 0.00 H new ATOM 0 HB2 ALA A 57 7.409 3.440 -2.915 1.00 0.00 H new ATOM 0 HB3 ALA A 57 6.146 2.205 -2.692 1.00 0.00 H new ATOM 744 N GLU A 58 8.510 -0.264 -1.590 1.00 0.00 N ATOM 745 CA GLU A 58 8.388 -1.567 -0.946 1.00 0.00 C ATOM 746 C GLU A 58 7.208 -1.586 0.023 1.00 0.00 C ATOM 747 O GLU A 58 6.969 -0.620 0.745 1.00 0.00 O ATOM 748 CB GLU A 58 9.679 -1.916 -0.203 1.00 0.00 C ATOM 749 CG GLU A 58 10.017 -0.948 0.918 1.00 0.00 C ATOM 750 CD GLU A 58 11.453 -1.077 1.388 1.00 0.00 C ATOM 751 OE1 GLU A 58 12.304 -1.503 0.580 1.00 0.00 O ATOM 752 OE2 GLU A 58 11.726 -0.752 2.561 1.00 0.00 O ATOM 0 H GLU A 58 9.141 0.383 -1.117 1.00 0.00 H new ATOM 0 HA GLU A 58 8.211 -2.313 -1.721 1.00 0.00 H new ATOM 0 HB2 GLU A 58 9.590 -2.921 0.210 1.00 0.00 H new ATOM 0 HB3 GLU A 58 10.504 -1.936 -0.915 1.00 0.00 H new ATOM 0 HG2 GLU A 58 9.841 0.072 0.577 1.00 0.00 H new ATOM 0 HG3 GLU A 58 9.346 -1.124 1.759 1.00 0.00 H new ATOM 759 N ALA A 59 6.476 -2.696 0.031 1.00 0.00 N ATOM 760 CA ALA A 59 5.323 -2.842 0.911 1.00 0.00 C ATOM 761 C ALA A 59 5.503 -4.023 1.859 1.00 0.00 C ATOM 762 O ALA A 59 5.884 -5.116 1.439 1.00 0.00 O ATOM 763 CB ALA A 59 4.052 -3.009 0.092 1.00 0.00 C ATOM 0 H ALA A 59 6.661 -3.506 -0.561 1.00 0.00 H new ATOM 0 HA ALA A 59 5.238 -1.937 1.512 1.00 0.00 H new ATOM 0 HB1 ALA A 59 3.199 -3.117 0.762 1.00 0.00 H new ATOM 0 HB2 ALA A 59 3.908 -2.132 -0.540 1.00 0.00 H new ATOM 0 HB3 ALA A 59 4.137 -3.897 -0.534 1.00 0.00 H new ATOM 769 N ASP A 60 5.228 -3.796 3.139 1.00 0.00 N ATOM 770 CA ASP A 60 5.359 -4.842 4.145 1.00 0.00 C ATOM 771 C ASP A 60 4.129 -5.745 4.154 1.00 0.00 C ATOM 772 O ASP A 60 3.005 -5.280 4.343 1.00 0.00 O ATOM 773 CB ASP A 60 5.562 -4.224 5.530 1.00 0.00 C ATOM 774 CG ASP A 60 6.463 -3.005 5.493 1.00 0.00 C ATOM 775 OD1 ASP A 60 7.510 -3.062 4.816 1.00 0.00 O ATOM 776 OD2 ASP A 60 6.121 -1.993 6.141 1.00 0.00 O ATOM 0 H ASP A 60 4.913 -2.897 3.504 1.00 0.00 H new ATOM 0 HA ASP A 60 6.230 -5.447 3.893 1.00 0.00 H new ATOM 0 HB2 ASP A 60 4.594 -3.944 5.945 1.00 0.00 H new ATOM 0 HB3 ASP A 60 5.992 -4.970 6.198 1.00 0.00 H new ATOM 781 N VAL A 61 4.351 -7.040 3.948 1.00 0.00 N ATOM 782 CA VAL A 61 3.262 -8.009 3.932 1.00 0.00 C ATOM 783 C VAL A 61 3.438 -9.051 5.031 1.00 0.00 C ATOM 784 O VAL A 61 4.546 -9.532 5.273 1.00 0.00 O ATOM 785 CB VAL A 61 3.167 -8.724 2.571 1.00 0.00 C ATOM 786 CG1 VAL A 61 2.008 -9.709 2.566 1.00 0.00 C ATOM 787 CG2 VAL A 61 3.023 -7.711 1.446 1.00 0.00 C ATOM 0 H VAL A 61 5.275 -7.442 3.790 1.00 0.00 H new ATOM 0 HA VAL A 61 2.341 -7.453 4.107 1.00 0.00 H new ATOM 0 HB VAL A 61 4.088 -9.283 2.408 1.00 0.00 H new ATOM 0 HG11 VAL A 61 1.956 -10.205 1.597 1.00 0.00 H new ATOM 0 HG12 VAL A 61 2.160 -10.454 3.347 1.00 0.00 H new ATOM 0 HG13 VAL A 61 1.076 -9.175 2.751 1.00 0.00 H new ATOM 0 HG21 VAL A 61 2.957 -8.234 0.492 1.00 0.00 H new ATOM 0 HG22 VAL A 61 2.119 -7.122 1.600 1.00 0.00 H new ATOM 0 HG23 VAL A 61 3.890 -7.050 1.439 1.00 0.00 H new ATOM 797 N ILE A 62 2.338 -9.398 5.692 1.00 0.00 N ATOM 798 CA ILE A 62 2.371 -10.384 6.764 1.00 0.00 C ATOM 799 C ILE A 62 1.200 -11.354 6.654 1.00 0.00 C ATOM 800 O ILE A 62 0.040 -10.942 6.617 1.00 0.00 O ATOM 801 CB ILE A 62 2.337 -9.711 8.149 1.00 0.00 C ATOM 802 CG1 ILE A 62 3.479 -8.702 8.278 1.00 0.00 C ATOM 803 CG2 ILE A 62 2.423 -10.760 9.248 1.00 0.00 C ATOM 804 CD1 ILE A 62 3.111 -7.310 7.812 1.00 0.00 C ATOM 0 H ILE A 62 1.414 -9.011 5.503 1.00 0.00 H new ATOM 0 HA ILE A 62 3.306 -10.934 6.659 1.00 0.00 H new ATOM 0 HB ILE A 62 1.393 -9.177 8.255 1.00 0.00 H new ATOM 0 HG12 ILE A 62 3.796 -8.656 9.320 1.00 0.00 H new ATOM 0 HG13 ILE A 62 4.333 -9.056 7.700 1.00 0.00 H new ATOM 0 HG21 ILE A 62 2.398 -10.270 10.221 1.00 0.00 H new ATOM 0 HG22 ILE A 62 1.579 -11.445 9.164 1.00 0.00 H new ATOM 0 HG23 ILE A 62 3.354 -11.318 9.146 1.00 0.00 H new ATOM 0 HD11 ILE A 62 3.968 -6.648 7.932 1.00 0.00 H new ATOM 0 HD12 ILE A 62 2.822 -7.342 6.761 1.00 0.00 H new ATOM 0 HD13 ILE A 62 2.277 -6.936 8.406 1.00 0.00 H new ATOM 816 N GLU A 63 1.511 -12.646 6.603 1.00 0.00 N ATOM 817 CA GLU A 63 0.483 -13.675 6.498 1.00 0.00 C ATOM 818 C GLU A 63 -0.089 -14.014 7.871 1.00 0.00 C ATOM 819 O GLU A 63 0.612 -13.952 8.880 1.00 0.00 O ATOM 820 CB GLU A 63 1.057 -14.935 5.846 1.00 0.00 C ATOM 821 CG GLU A 63 2.100 -15.639 6.698 1.00 0.00 C ATOM 822 CD GLU A 63 3.087 -16.439 5.868 1.00 0.00 C ATOM 823 OE1 GLU A 63 2.639 -17.188 4.974 1.00 0.00 O ATOM 824 OE2 GLU A 63 4.304 -16.315 6.112 1.00 0.00 O ATOM 0 H GLU A 63 2.466 -13.004 6.633 1.00 0.00 H new ATOM 0 HA GLU A 63 -0.322 -13.287 5.874 1.00 0.00 H new ATOM 0 HB2 GLU A 63 0.243 -15.629 5.636 1.00 0.00 H new ATOM 0 HB3 GLU A 63 1.503 -14.668 4.888 1.00 0.00 H new ATOM 0 HG2 GLU A 63 2.642 -14.899 7.287 1.00 0.00 H new ATOM 0 HG3 GLU A 63 1.600 -16.304 7.402 1.00 0.00 H new ATOM 831 N ASN A 64 -1.368 -14.374 7.901 1.00 0.00 N ATOM 832 CA ASN A 64 -2.035 -14.723 9.149 1.00 0.00 C ATOM 833 C ASN A 64 -2.656 -16.115 9.065 1.00 0.00 C ATOM 834 O ASN A 64 -2.915 -16.623 7.974 1.00 0.00 O ATOM 835 CB ASN A 64 -3.115 -13.691 9.480 1.00 0.00 C ATOM 836 CG ASN A 64 -2.574 -12.526 10.288 1.00 0.00 C ATOM 837 OD1 ASN A 64 -2.833 -12.414 11.486 1.00 0.00 O ATOM 838 ND2 ASN A 64 -1.818 -11.653 9.632 1.00 0.00 N ATOM 0 H ASN A 64 -1.963 -14.432 7.075 1.00 0.00 H new ATOM 0 HA ASN A 64 -1.287 -14.725 9.942 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -3.551 -13.316 8.554 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -3.917 -14.175 10.037 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -1.425 -10.849 10.122 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -1.630 -11.787 8.638 1.00 0.00 H new ATOM 845 N GLU A 65 -2.891 -16.723 10.223 1.00 0.00 N ATOM 846 CA GLU A 65 -3.480 -18.055 10.278 1.00 0.00 C ATOM 847 C GLU A 65 -4.879 -18.058 9.667 1.00 0.00 C ATOM 848 O GLU A 65 -5.348 -19.082 9.171 1.00 0.00 O ATOM 849 CB GLU A 65 -3.544 -18.549 11.726 1.00 0.00 C ATOM 850 CG GLU A 65 -2.202 -19.006 12.272 1.00 0.00 C ATOM 851 CD GLU A 65 -1.416 -17.876 12.910 1.00 0.00 C ATOM 852 OE1 GLU A 65 -1.764 -17.477 14.041 1.00 0.00 O ATOM 853 OE2 GLU A 65 -0.455 -17.391 12.278 1.00 0.00 O ATOM 0 H GLU A 65 -2.683 -16.315 11.134 1.00 0.00 H new ATOM 0 HA GLU A 65 -2.848 -18.728 9.699 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -3.930 -17.749 12.357 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -4.253 -19.375 11.788 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -2.363 -19.793 13.009 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -1.614 -19.441 11.464 1.00 0.00 H new ATOM 860 N ASP A 66 -5.538 -16.905 9.709 1.00 0.00 N ATOM 861 CA ASP A 66 -6.882 -16.773 9.159 1.00 0.00 C ATOM 862 C ASP A 66 -6.831 -16.473 7.664 1.00 0.00 C ATOM 863 O ASP A 66 -7.690 -15.772 7.132 1.00 0.00 O ATOM 864 CB ASP A 66 -7.648 -15.668 9.888 1.00 0.00 C ATOM 865 CG ASP A 66 -9.151 -15.822 9.757 1.00 0.00 C ATOM 866 OD1 ASP A 66 -9.682 -15.535 8.664 1.00 0.00 O ATOM 867 OD2 ASP A 66 -9.794 -16.228 10.746 1.00 0.00 O ATOM 0 H ASP A 66 -5.163 -16.049 10.118 1.00 0.00 H new ATOM 0 HA ASP A 66 -7.401 -17.720 9.303 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -7.375 -15.676 10.943 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -7.349 -14.699 9.489 1.00 0.00 H new ATOM 872 N GLY A 67 -5.816 -17.009 6.992 1.00 0.00 N ATOM 873 CA GLY A 67 -5.671 -16.785 5.565 1.00 0.00 C ATOM 874 C GLY A 67 -5.812 -15.324 5.190 1.00 0.00 C ATOM 875 O GLY A 67 -6.438 -14.990 4.183 1.00 0.00 O ATOM 0 H GLY A 67 -5.092 -17.594 7.410 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -4.695 -17.147 5.241 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -6.421 -17.368 5.031 1.00 0.00 H new ATOM 879 N THR A 68 -5.231 -14.446 6.003 1.00 0.00 N ATOM 880 CA THR A 68 -5.297 -13.012 5.753 1.00 0.00 C ATOM 881 C THR A 68 -3.903 -12.403 5.669 1.00 0.00 C ATOM 882 O THR A 68 -2.958 -12.905 6.280 1.00 0.00 O ATOM 883 CB THR A 68 -6.097 -12.286 6.851 1.00 0.00 C ATOM 884 OG1 THR A 68 -5.763 -12.824 8.137 1.00 0.00 O ATOM 885 CG2 THR A 68 -7.593 -12.423 6.612 1.00 0.00 C ATOM 0 H THR A 68 -4.709 -14.704 6.841 1.00 0.00 H new ATOM 0 HA THR A 68 -5.805 -12.882 4.797 1.00 0.00 H new ATOM 0 HB THR A 68 -5.836 -11.228 6.820 1.00 0.00 H new ATOM 0 HG1 THR A 68 -6.274 -12.356 8.830 1.00 0.00 H new ATOM 0 HG21 THR A 68 -8.137 -11.902 7.400 1.00 0.00 H new ATOM 0 HG22 THR A 68 -7.849 -11.987 5.646 1.00 0.00 H new ATOM 0 HG23 THR A 68 -7.867 -13.478 6.618 1.00 0.00 H new ATOM 893 N TYR A 69 -3.780 -11.319 4.912 1.00 0.00 N ATOM 894 CA TYR A 69 -2.499 -10.643 4.747 1.00 0.00 C ATOM 895 C TYR A 69 -2.607 -9.170 5.132 1.00 0.00 C ATOM 896 O TYR A 69 -3.374 -8.415 4.533 1.00 0.00 O ATOM 897 CB TYR A 69 -2.013 -10.769 3.302 1.00 0.00 C ATOM 898 CG TYR A 69 -1.623 -12.178 2.915 1.00 0.00 C ATOM 899 CD1 TYR A 69 -2.529 -13.225 3.027 1.00 0.00 C ATOM 900 CD2 TYR A 69 -0.349 -12.461 2.441 1.00 0.00 C ATOM 901 CE1 TYR A 69 -2.177 -14.515 2.675 1.00 0.00 C ATOM 902 CE2 TYR A 69 0.011 -13.747 2.086 1.00 0.00 C ATOM 903 CZ TYR A 69 -0.906 -14.770 2.205 1.00 0.00 C ATOM 904 OH TYR A 69 -0.551 -16.052 1.853 1.00 0.00 O ATOM 0 H TYR A 69 -4.552 -10.889 4.403 1.00 0.00 H new ATOM 0 HA TYR A 69 -1.777 -11.122 5.409 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -2.799 -10.421 2.632 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -1.156 -10.111 3.157 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -3.525 -13.028 3.395 1.00 0.00 H new ATOM 0 HD2 TYR A 69 0.373 -11.663 2.348 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -2.893 -15.318 2.768 1.00 0.00 H new ATOM 0 HE2 TYR A 69 1.006 -13.950 1.717 1.00 0.00 H new ATOM 0 HH TYR A 69 0.378 -16.060 1.541 1.00 0.00 H new ATOM 914 N ASP A 70 -1.833 -8.770 6.135 1.00 0.00 N ATOM 915 CA ASP A 70 -1.840 -7.388 6.600 1.00 0.00 C ATOM 916 C ASP A 70 -0.734 -6.582 5.925 1.00 0.00 C ATOM 917 O ASP A 70 0.438 -6.958 5.970 1.00 0.00 O ATOM 918 CB ASP A 70 -1.669 -7.338 8.119 1.00 0.00 C ATOM 919 CG ASP A 70 -2.913 -7.792 8.856 1.00 0.00 C ATOM 920 OD1 ASP A 70 -3.842 -6.973 9.010 1.00 0.00 O ATOM 921 OD2 ASP A 70 -2.956 -8.966 9.282 1.00 0.00 O ATOM 0 H ASP A 70 -1.193 -9.383 6.641 1.00 0.00 H new ATOM 0 HA ASP A 70 -2.801 -6.946 6.335 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -0.828 -7.969 8.408 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -1.422 -6.320 8.421 1.00 0.00 H new ATOM 926 N ILE A 71 -1.114 -5.474 5.299 1.00 0.00 N ATOM 927 CA ILE A 71 -0.156 -4.616 4.614 1.00 0.00 C ATOM 928 C ILE A 71 -0.258 -3.176 5.105 1.00 0.00 C ATOM 929 O ILE A 71 -1.341 -2.700 5.446 1.00 0.00 O ATOM 930 CB ILE A 71 -0.366 -4.641 3.088 1.00 0.00 C ATOM 931 CG1 ILE A 71 -0.211 -6.066 2.554 1.00 0.00 C ATOM 932 CG2 ILE A 71 0.617 -3.704 2.403 1.00 0.00 C ATOM 933 CD1 ILE A 71 -0.948 -6.309 1.255 1.00 0.00 C ATOM 0 H ILE A 71 -2.080 -5.149 5.252 1.00 0.00 H new ATOM 0 HA ILE A 71 0.835 -5.007 4.843 1.00 0.00 H new ATOM 0 HB ILE A 71 -1.377 -4.298 2.869 1.00 0.00 H new ATOM 0 HG12 ILE A 71 0.848 -6.277 2.406 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -0.574 -6.768 3.305 1.00 0.00 H new ATOM 0 HG21 ILE A 71 0.456 -3.733 1.325 1.00 0.00 H new ATOM 0 HG22 ILE A 71 0.464 -2.688 2.766 1.00 0.00 H new ATOM 0 HG23 ILE A 71 1.636 -4.019 2.626 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -0.793 -7.340 0.936 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -2.013 -6.131 1.402 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -0.569 -5.632 0.490 1.00 0.00 H new ATOM 945 N PHE A 72 0.877 -2.486 5.139 1.00 0.00 N ATOM 946 CA PHE A 72 0.917 -1.099 5.588 1.00 0.00 C ATOM 947 C PHE A 72 1.835 -0.266 4.699 1.00 0.00 C ATOM 948 O PHE A 72 2.861 -0.749 4.221 1.00 0.00 O ATOM 949 CB PHE A 72 1.390 -1.024 7.041 1.00 0.00 C ATOM 950 CG PHE A 72 0.822 -2.108 7.912 1.00 0.00 C ATOM 951 CD1 PHE A 72 1.432 -3.350 7.982 1.00 0.00 C ATOM 952 CD2 PHE A 72 -0.323 -1.885 8.661 1.00 0.00 C ATOM 953 CE1 PHE A 72 0.912 -4.349 8.783 1.00 0.00 C ATOM 954 CE2 PHE A 72 -0.847 -2.880 9.463 1.00 0.00 C ATOM 955 CZ PHE A 72 -0.230 -4.114 9.524 1.00 0.00 C ATOM 0 H PHE A 72 1.782 -2.865 4.861 1.00 0.00 H new ATOM 0 HA PHE A 72 -0.092 -0.692 5.521 1.00 0.00 H new ATOM 0 HB2 PHE A 72 2.478 -1.083 7.064 1.00 0.00 H new ATOM 0 HB3 PHE A 72 1.114 -0.054 7.455 1.00 0.00 H new ATOM 0 HD1 PHE A 72 2.324 -3.540 7.404 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -0.811 -0.922 8.617 1.00 0.00 H new ATOM 0 HE1 PHE A 72 1.398 -5.312 8.830 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -1.739 -2.693 10.042 1.00 0.00 H new ATOM 0 HZ PHE A 72 -0.639 -4.893 10.150 1.00 0.00 H new ATOM 965 N TYR A 73 1.458 0.990 4.482 1.00 0.00 N ATOM 966 CA TYR A 73 2.246 1.890 3.648 1.00 0.00 C ATOM 967 C TYR A 73 1.869 3.345 3.912 1.00 0.00 C ATOM 968 O TYR A 73 0.719 3.655 4.225 1.00 0.00 O ATOM 969 CB TYR A 73 2.043 1.560 2.169 1.00 0.00 C ATOM 970 CG TYR A 73 0.729 2.057 1.612 1.00 0.00 C ATOM 971 CD1 TYR A 73 0.543 3.402 1.312 1.00 0.00 C ATOM 972 CD2 TYR A 73 -0.328 1.184 1.384 1.00 0.00 C ATOM 973 CE1 TYR A 73 -0.656 3.861 0.804 1.00 0.00 C ATOM 974 CE2 TYR A 73 -1.530 1.635 0.874 1.00 0.00 C ATOM 975 CZ TYR A 73 -1.689 2.973 0.586 1.00 0.00 C ATOM 976 OH TYR A 73 -2.886 3.428 0.079 1.00 0.00 O ATOM 0 H TYR A 73 0.613 1.407 4.872 1.00 0.00 H new ATOM 0 HA TYR A 73 3.297 1.752 3.902 1.00 0.00 H new ATOM 0 HB2 TYR A 73 2.860 1.995 1.593 1.00 0.00 H new ATOM 0 HB3 TYR A 73 2.099 0.480 2.036 1.00 0.00 H new ATOM 0 HD1 TYR A 73 1.350 4.100 1.479 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -0.208 0.135 1.609 1.00 0.00 H new ATOM 0 HE1 TYR A 73 -0.784 4.909 0.579 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -2.341 0.943 0.702 1.00 0.00 H new ATOM 0 HH TYR A 73 -3.607 2.820 0.347 1.00 0.00 H new ATOM 986 N THR A 74 2.847 4.237 3.782 1.00 0.00 N ATOM 987 CA THR A 74 2.620 5.658 4.006 1.00 0.00 C ATOM 988 C THR A 74 2.809 6.455 2.720 1.00 0.00 C ATOM 989 O THR A 74 3.582 6.065 1.845 1.00 0.00 O ATOM 990 CB THR A 74 3.568 6.216 5.085 1.00 0.00 C ATOM 991 OG1 THR A 74 3.435 5.457 6.292 1.00 0.00 O ATOM 992 CG2 THR A 74 3.267 7.681 5.365 1.00 0.00 C ATOM 0 H THR A 74 3.804 3.999 3.522 1.00 0.00 H new ATOM 0 HA THR A 74 1.590 5.763 4.348 1.00 0.00 H new ATOM 0 HB THR A 74 4.591 6.136 4.716 1.00 0.00 H new ATOM 0 HG1 THR A 74 4.042 5.816 6.973 1.00 0.00 H new ATOM 0 HG21 THR A 74 3.949 8.053 6.130 1.00 0.00 H new ATOM 0 HG22 THR A 74 3.397 8.260 4.451 1.00 0.00 H new ATOM 0 HG23 THR A 74 2.240 7.781 5.715 1.00 0.00 H new ATOM 1000 N ALA A 75 2.098 7.573 2.612 1.00 0.00 N ATOM 1001 CA ALA A 75 2.191 8.425 1.432 1.00 0.00 C ATOM 1002 C ALA A 75 2.975 9.696 1.735 1.00 0.00 C ATOM 1003 O ALA A 75 2.413 10.688 2.200 1.00 0.00 O ATOM 1004 CB ALA A 75 0.799 8.770 0.920 1.00 0.00 C ATOM 0 H ALA A 75 1.452 7.910 3.326 1.00 0.00 H new ATOM 0 HA ALA A 75 2.726 7.875 0.657 1.00 0.00 H new ATOM 0 HB1 ALA A 75 0.883 9.406 0.039 1.00 0.00 H new ATOM 0 HB2 ALA A 75 0.271 7.854 0.657 1.00 0.00 H new ATOM 0 HB3 ALA A 75 0.246 9.297 1.697 1.00 0.00 H new ATOM 1010 N ALA A 76 4.276 9.661 1.467 1.00 0.00 N ATOM 1011 CA ALA A 76 5.138 10.812 1.710 1.00 0.00 C ATOM 1012 C ALA A 76 4.575 12.067 1.053 1.00 0.00 C ATOM 1013 O ALA A 76 4.527 13.134 1.666 1.00 0.00 O ATOM 1014 CB ALA A 76 6.545 10.533 1.203 1.00 0.00 C ATOM 0 H ALA A 76 4.757 8.848 1.081 1.00 0.00 H new ATOM 0 HA ALA A 76 5.179 10.985 2.785 1.00 0.00 H new ATOM 0 HB1 ALA A 76 7.178 11.400 1.391 1.00 0.00 H new ATOM 0 HB2 ALA A 76 6.954 9.666 1.722 1.00 0.00 H new ATOM 0 HB3 ALA A 76 6.513 10.332 0.132 1.00 0.00 H new ATOM 1020 N LYS A 77 4.149 11.934 -0.200 1.00 0.00 N ATOM 1021 CA LYS A 77 3.589 13.057 -0.941 1.00 0.00 C ATOM 1022 C LYS A 77 2.267 12.670 -1.597 1.00 0.00 C ATOM 1023 O LYS A 77 2.026 11.508 -1.923 1.00 0.00 O ATOM 1024 CB LYS A 77 4.578 13.536 -2.006 1.00 0.00 C ATOM 1025 CG LYS A 77 4.736 12.570 -3.167 1.00 0.00 C ATOM 1026 CD LYS A 77 5.674 13.123 -4.228 1.00 0.00 C ATOM 1027 CE LYS A 77 5.425 12.478 -5.583 1.00 0.00 C ATOM 1028 NZ LYS A 77 5.934 13.320 -6.701 1.00 0.00 N ATOM 0 H LYS A 77 4.182 11.059 -0.723 1.00 0.00 H new ATOM 0 HA LYS A 77 3.402 13.868 -0.237 1.00 0.00 H new ATOM 0 HB2 LYS A 77 4.247 14.501 -2.390 1.00 0.00 H new ATOM 0 HB3 LYS A 77 5.551 13.695 -1.541 1.00 0.00 H new ATOM 0 HG2 LYS A 77 5.121 11.618 -2.800 1.00 0.00 H new ATOM 0 HG3 LYS A 77 3.761 12.370 -3.611 1.00 0.00 H new ATOM 0 HD2 LYS A 77 5.540 14.202 -4.307 1.00 0.00 H new ATOM 0 HD3 LYS A 77 6.707 12.952 -3.927 1.00 0.00 H new ATOM 0 HE2 LYS A 77 5.909 11.502 -5.615 1.00 0.00 H new ATOM 0 HE3 LYS A 77 4.356 12.309 -5.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 5.147 13.572 -7.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 6.360 14.187 -6.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 6.651 12.790 -7.236 1.00 0.00 H new ATOM 1042 N PRO A 78 1.391 13.666 -1.796 1.00 0.00 N ATOM 1043 CA PRO A 78 0.080 13.454 -2.417 1.00 0.00 C ATOM 1044 C PRO A 78 0.189 13.121 -3.901 1.00 0.00 C ATOM 1045 O PRO A 78 1.232 13.327 -4.519 1.00 0.00 O ATOM 1046 CB PRO A 78 -0.627 14.798 -2.221 1.00 0.00 C ATOM 1047 CG PRO A 78 0.476 15.793 -2.107 1.00 0.00 C ATOM 1048 CD PRO A 78 1.613 15.075 -1.433 1.00 0.00 C ATOM 0 HA PRO A 78 -0.449 12.610 -1.974 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -1.282 15.027 -3.062 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -1.249 14.792 -1.326 1.00 0.00 H new ATOM 0 HG2 PRO A 78 0.774 16.160 -3.089 1.00 0.00 H new ATOM 0 HG3 PRO A 78 0.162 16.659 -1.525 1.00 0.00 H new ATOM 0 HD2 PRO A 78 2.580 15.433 -1.786 1.00 0.00 H new ATOM 0 HD3 PRO A 78 1.595 15.219 -0.353 1.00 0.00 H new ATOM 1056 N GLY A 79 -0.898 12.604 -4.468 1.00 0.00 N ATOM 1057 CA GLY A 79 -0.903 12.250 -5.876 1.00 0.00 C ATOM 1058 C GLY A 79 -1.765 11.038 -6.166 1.00 0.00 C ATOM 1059 O GLY A 79 -2.697 10.736 -5.419 1.00 0.00 O ATOM 0 H GLY A 79 -1.774 12.424 -3.978 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -1.265 13.097 -6.459 1.00 0.00 H new ATOM 0 HA3 GLY A 79 0.118 12.052 -6.201 1.00 0.00 H new ATOM 1063 N THR A 80 -1.455 10.339 -7.254 1.00 0.00 N ATOM 1064 CA THR A 80 -2.210 9.155 -7.642 1.00 0.00 C ATOM 1065 C THR A 80 -1.396 7.886 -7.416 1.00 0.00 C ATOM 1066 O THR A 80 -0.520 7.548 -8.211 1.00 0.00 O ATOM 1067 CB THR A 80 -2.636 9.221 -9.122 1.00 0.00 C ATOM 1068 OG1 THR A 80 -3.400 10.408 -9.360 1.00 0.00 O ATOM 1069 CG2 THR A 80 -3.457 7.998 -9.503 1.00 0.00 C ATOM 0 H THR A 80 -0.686 10.573 -7.882 1.00 0.00 H new ATOM 0 HA THR A 80 -3.101 9.128 -7.015 1.00 0.00 H new ATOM 0 HB THR A 80 -1.736 9.241 -9.736 1.00 0.00 H new ATOM 0 HG1 THR A 80 -3.665 10.443 -10.303 1.00 0.00 H new ATOM 0 HG21 THR A 80 -3.746 8.066 -10.552 1.00 0.00 H new ATOM 0 HG22 THR A 80 -2.862 7.098 -9.349 1.00 0.00 H new ATOM 0 HG23 THR A 80 -4.352 7.952 -8.882 1.00 0.00 H new ATOM 1077 N TYR A 81 -1.692 7.187 -6.326 1.00 0.00 N ATOM 1078 CA TYR A 81 -0.987 5.955 -5.993 1.00 0.00 C ATOM 1079 C TYR A 81 -1.730 4.737 -6.536 1.00 0.00 C ATOM 1080 O TYR A 81 -2.960 4.681 -6.505 1.00 0.00 O ATOM 1081 CB TYR A 81 -0.820 5.831 -4.478 1.00 0.00 C ATOM 1082 CG TYR A 81 0.222 6.764 -3.905 1.00 0.00 C ATOM 1083 CD1 TYR A 81 0.069 8.142 -3.987 1.00 0.00 C ATOM 1084 CD2 TYR A 81 1.362 6.267 -3.283 1.00 0.00 C ATOM 1085 CE1 TYR A 81 1.019 8.999 -3.466 1.00 0.00 C ATOM 1086 CE2 TYR A 81 2.316 7.116 -2.758 1.00 0.00 C ATOM 1087 CZ TYR A 81 2.142 8.481 -2.852 1.00 0.00 C ATOM 1088 OH TYR A 81 3.091 9.330 -2.332 1.00 0.00 O ATOM 0 H TYR A 81 -2.416 7.453 -5.658 1.00 0.00 H new ATOM 0 HA TYR A 81 -0.002 5.994 -6.458 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -1.778 6.031 -3.998 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -0.549 4.804 -4.234 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -0.808 8.551 -4.467 1.00 0.00 H new ATOM 0 HD2 TYR A 81 1.504 5.199 -3.209 1.00 0.00 H new ATOM 0 HE1 TYR A 81 0.884 10.068 -3.539 1.00 0.00 H new ATOM 0 HE2 TYR A 81 3.194 6.713 -2.276 1.00 0.00 H new ATOM 0 HH TYR A 81 2.892 10.250 -2.606 1.00 0.00 H new ATOM 1098 N VAL A 82 -0.975 3.763 -7.032 1.00 0.00 N ATOM 1099 CA VAL A 82 -1.560 2.545 -7.579 1.00 0.00 C ATOM 1100 C VAL A 82 -1.038 1.311 -6.853 1.00 0.00 C ATOM 1101 O VAL A 82 0.170 1.076 -6.795 1.00 0.00 O ATOM 1102 CB VAL A 82 -1.261 2.406 -9.084 1.00 0.00 C ATOM 1103 CG1 VAL A 82 -1.828 1.103 -9.623 1.00 0.00 C ATOM 1104 CG2 VAL A 82 -1.819 3.597 -9.849 1.00 0.00 C ATOM 0 H VAL A 82 0.044 3.794 -7.066 1.00 0.00 H new ATOM 0 HA VAL A 82 -2.638 2.619 -7.435 1.00 0.00 H new ATOM 0 HB VAL A 82 -0.180 2.388 -9.222 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -1.607 1.023 -10.687 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -1.377 0.263 -9.094 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -2.908 1.087 -9.475 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -1.599 3.483 -10.910 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -2.898 3.648 -9.705 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -1.360 4.514 -9.480 1.00 0.00 H new ATOM 1114 N ILE A 83 -1.955 0.523 -6.302 1.00 0.00 N ATOM 1115 CA ILE A 83 -1.588 -0.689 -5.582 1.00 0.00 C ATOM 1116 C ILE A 83 -1.981 -1.935 -6.366 1.00 0.00 C ATOM 1117 O ILE A 83 -3.143 -2.111 -6.733 1.00 0.00 O ATOM 1118 CB ILE A 83 -2.250 -0.741 -4.192 1.00 0.00 C ATOM 1119 CG1 ILE A 83 -1.844 0.478 -3.362 1.00 0.00 C ATOM 1120 CG2 ILE A 83 -1.875 -2.028 -3.473 1.00 0.00 C ATOM 1121 CD1 ILE A 83 -2.860 0.862 -2.310 1.00 0.00 C ATOM 0 H ILE A 83 -2.958 0.703 -6.341 1.00 0.00 H new ATOM 0 HA ILE A 83 -0.505 -0.667 -5.459 1.00 0.00 H new ATOM 0 HB ILE A 83 -3.332 -0.723 -4.322 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -0.890 0.274 -2.876 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -1.687 1.325 -4.030 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -2.351 -2.049 -2.493 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -2.212 -2.883 -4.058 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -0.793 -2.075 -3.352 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -2.504 1.734 -1.762 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -3.810 1.098 -2.790 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -3.000 0.031 -1.619 1.00 0.00 H new ATOM 1133 N TYR A 84 -1.005 -2.800 -6.620 1.00 0.00 N ATOM 1134 CA TYR A 84 -1.248 -4.032 -7.362 1.00 0.00 C ATOM 1135 C TYR A 84 -1.433 -5.212 -6.413 1.00 0.00 C ATOM 1136 O TYR A 84 -0.565 -5.506 -5.592 1.00 0.00 O ATOM 1137 CB TYR A 84 -0.089 -4.311 -8.320 1.00 0.00 C ATOM 1138 CG TYR A 84 0.077 -3.257 -9.393 1.00 0.00 C ATOM 1139 CD1 TYR A 84 -0.937 -3.004 -10.308 1.00 0.00 C ATOM 1140 CD2 TYR A 84 1.249 -2.517 -9.491 1.00 0.00 C ATOM 1141 CE1 TYR A 84 -0.790 -2.043 -11.289 1.00 0.00 C ATOM 1142 CE2 TYR A 84 1.405 -1.553 -10.468 1.00 0.00 C ATOM 1143 CZ TYR A 84 0.382 -1.319 -11.365 1.00 0.00 C ATOM 1144 OH TYR A 84 0.535 -0.361 -12.340 1.00 0.00 O ATOM 0 H TYR A 84 -0.038 -2.671 -6.323 1.00 0.00 H new ATOM 0 HA TYR A 84 -2.165 -3.905 -7.938 1.00 0.00 H new ATOM 0 HB2 TYR A 84 0.836 -4.383 -7.747 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -0.246 -5.279 -8.795 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -1.856 -3.568 -10.251 1.00 0.00 H new ATOM 0 HD2 TYR A 84 2.052 -2.699 -8.791 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -1.588 -1.859 -11.993 1.00 0.00 H new ATOM 0 HE2 TYR A 84 2.322 -0.986 -10.530 1.00 0.00 H new ATOM 0 HH TYR A 84 -0.340 0.020 -12.564 1.00 0.00 H new ATOM 1154 N VAL A 85 -2.572 -5.886 -6.534 1.00 0.00 N ATOM 1155 CA VAL A 85 -2.873 -7.037 -5.690 1.00 0.00 C ATOM 1156 C VAL A 85 -3.173 -8.273 -6.531 1.00 0.00 C ATOM 1157 O VAL A 85 -4.067 -8.258 -7.376 1.00 0.00 O ATOM 1158 CB VAL A 85 -4.073 -6.755 -4.765 1.00 0.00 C ATOM 1159 CG1 VAL A 85 -4.383 -7.972 -3.907 1.00 0.00 C ATOM 1160 CG2 VAL A 85 -3.801 -5.537 -3.896 1.00 0.00 C ATOM 0 H VAL A 85 -3.302 -5.655 -7.208 1.00 0.00 H new ATOM 0 HA VAL A 85 -1.989 -7.223 -5.081 1.00 0.00 H new ATOM 0 HB VAL A 85 -4.945 -6.544 -5.384 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -5.233 -7.754 -3.260 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -4.624 -8.819 -4.550 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -3.515 -8.216 -3.295 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -4.659 -5.353 -3.249 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -2.917 -5.717 -3.284 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -3.632 -4.667 -4.531 1.00 0.00 H new ATOM 1170 N ARG A 86 -2.419 -9.340 -6.292 1.00 0.00 N ATOM 1171 CA ARG A 86 -2.604 -10.585 -7.027 1.00 0.00 C ATOM 1172 C ARG A 86 -2.688 -11.774 -6.073 1.00 0.00 C ATOM 1173 O ARG A 86 -1.902 -11.884 -5.132 1.00 0.00 O ATOM 1174 CB ARG A 86 -1.456 -10.793 -8.017 1.00 0.00 C ATOM 1175 CG ARG A 86 -1.147 -12.254 -8.294 1.00 0.00 C ATOM 1176 CD ARG A 86 0.035 -12.405 -9.239 1.00 0.00 C ATOM 1177 NE ARG A 86 -0.380 -12.431 -10.638 1.00 0.00 N ATOM 1178 CZ ARG A 86 0.389 -12.878 -11.625 1.00 0.00 C ATOM 1179 NH1 ARG A 86 1.607 -13.331 -11.367 1.00 0.00 N ATOM 1180 NH2 ARG A 86 -0.061 -12.870 -12.873 1.00 0.00 N ATOM 0 H ARG A 86 -1.674 -9.368 -5.595 1.00 0.00 H new ATOM 0 HA ARG A 86 -3.542 -10.516 -7.577 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -1.704 -10.299 -8.956 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -0.560 -10.309 -7.628 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -0.932 -12.765 -7.356 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -2.024 -12.737 -8.726 1.00 0.00 H new ATOM 0 HD2 ARG A 86 0.731 -11.581 -9.083 1.00 0.00 H new ATOM 0 HD3 ARG A 86 0.572 -13.324 -9.003 1.00 0.00 H new ATOM 0 HE ARG A 86 -1.312 -12.087 -10.871 1.00 0.00 H new ATOM 0 HH11 ARG A 86 1.956 -13.337 -10.409 1.00 0.00 H new ATOM 0 HH12 ARG A 86 2.195 -13.674 -12.127 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -0.998 -12.521 -13.075 1.00 0.00 H new ATOM 0 HH22 ARG A 86 0.530 -13.213 -13.630 1.00 0.00 H new ATOM 1194 N PHE A 87 -3.646 -12.660 -6.324 1.00 0.00 N ATOM 1195 CA PHE A 87 -3.834 -13.839 -5.487 1.00 0.00 C ATOM 1196 C PHE A 87 -3.537 -15.114 -6.270 1.00 0.00 C ATOM 1197 O PHE A 87 -4.192 -15.410 -7.267 1.00 0.00 O ATOM 1198 CB PHE A 87 -5.264 -13.882 -4.943 1.00 0.00 C ATOM 1199 CG PHE A 87 -5.631 -15.201 -4.325 1.00 0.00 C ATOM 1200 CD1 PHE A 87 -5.962 -16.285 -5.121 1.00 0.00 C ATOM 1201 CD2 PHE A 87 -5.644 -15.355 -2.948 1.00 0.00 C ATOM 1202 CE1 PHE A 87 -6.300 -17.501 -4.555 1.00 0.00 C ATOM 1203 CE2 PHE A 87 -5.981 -16.568 -2.377 1.00 0.00 C ATOM 1204 CZ PHE A 87 -6.311 -17.641 -3.181 1.00 0.00 C ATOM 0 H PHE A 87 -4.304 -12.584 -7.100 1.00 0.00 H new ATOM 0 HA PHE A 87 -3.137 -13.776 -4.651 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -5.385 -13.095 -4.199 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -5.959 -13.664 -5.754 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -5.956 -16.180 -6.196 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -5.388 -14.519 -2.314 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -6.555 -18.339 -5.186 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -5.986 -16.676 -1.302 1.00 0.00 H new ATOM 0 HZ PHE A 87 -6.577 -18.588 -2.736 1.00 0.00 H new ATOM 1214 N GLY A 88 -2.542 -15.866 -5.809 1.00 0.00 N ATOM 1215 CA GLY A 88 -2.174 -17.101 -6.477 1.00 0.00 C ATOM 1216 C GLY A 88 -2.029 -16.928 -7.975 1.00 0.00 C ATOM 1217 O GLY A 88 -2.459 -17.782 -8.751 1.00 0.00 O ATOM 0 H GLY A 88 -1.984 -15.642 -4.985 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -1.234 -17.468 -6.064 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -2.930 -17.860 -6.273 1.00 0.00 H new ATOM 1221 N GLY A 89 -1.424 -15.818 -8.386 1.00 0.00 N ATOM 1222 CA GLY A 89 -1.236 -15.555 -9.801 1.00 0.00 C ATOM 1223 C GLY A 89 -2.516 -15.114 -10.484 1.00 0.00 C ATOM 1224 O GLY A 89 -2.686 -15.312 -11.687 1.00 0.00 O ATOM 0 H GLY A 89 -1.060 -15.096 -7.764 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -0.477 -14.783 -9.926 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -0.859 -16.455 -10.288 1.00 0.00 H new ATOM 1228 N VAL A 90 -3.420 -14.518 -9.714 1.00 0.00 N ATOM 1229 CA VAL A 90 -4.692 -14.049 -10.250 1.00 0.00 C ATOM 1230 C VAL A 90 -4.993 -12.628 -9.788 1.00 0.00 C ATOM 1231 O VAL A 90 -5.383 -12.407 -8.642 1.00 0.00 O ATOM 1232 CB VAL A 90 -5.853 -14.971 -9.830 1.00 0.00 C ATOM 1233 CG1 VAL A 90 -7.164 -14.486 -10.429 1.00 0.00 C ATOM 1234 CG2 VAL A 90 -5.568 -16.407 -10.242 1.00 0.00 C ATOM 0 H VAL A 90 -3.295 -14.348 -8.716 1.00 0.00 H new ATOM 0 HA VAL A 90 -4.602 -14.063 -11.336 1.00 0.00 H new ATOM 0 HB VAL A 90 -5.944 -14.940 -8.744 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -7.972 -15.150 -10.121 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -7.372 -13.475 -10.079 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -7.089 -14.486 -11.516 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -6.398 -17.044 -9.938 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -5.449 -16.458 -11.324 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -4.652 -16.749 -9.760 1.00 0.00 H new ATOM 1244 N ASP A 91 -4.811 -11.668 -10.689 1.00 0.00 N ATOM 1245 CA ASP A 91 -5.065 -10.267 -10.374 1.00 0.00 C ATOM 1246 C ASP A 91 -6.556 -10.019 -10.168 1.00 0.00 C ATOM 1247 O ASP A 91 -7.326 -9.978 -11.126 1.00 0.00 O ATOM 1248 CB ASP A 91 -4.535 -9.368 -11.492 1.00 0.00 C ATOM 1249 CG ASP A 91 -4.542 -7.901 -11.107 1.00 0.00 C ATOM 1250 OD1 ASP A 91 -3.987 -7.564 -10.041 1.00 0.00 O ATOM 1251 OD2 ASP A 91 -5.103 -7.090 -11.874 1.00 0.00 O ATOM 0 H ASP A 91 -4.489 -11.835 -11.642 1.00 0.00 H new ATOM 0 HA ASP A 91 -4.544 -10.027 -9.447 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -3.519 -9.669 -11.746 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -5.142 -9.509 -12.386 1.00 0.00 H new ATOM 1256 N ILE A 92 -6.954 -9.853 -8.911 1.00 0.00 N ATOM 1257 CA ILE A 92 -8.352 -9.608 -8.579 1.00 0.00 C ATOM 1258 C ILE A 92 -8.974 -8.594 -9.534 1.00 0.00 C ATOM 1259 O ILE A 92 -8.289 -7.759 -10.126 1.00 0.00 O ATOM 1260 CB ILE A 92 -8.506 -9.097 -7.135 1.00 0.00 C ATOM 1261 CG1 ILE A 92 -7.498 -7.981 -6.854 1.00 0.00 C ATOM 1262 CG2 ILE A 92 -8.328 -10.241 -6.146 1.00 0.00 C ATOM 1263 CD1 ILE A 92 -7.270 -7.729 -5.380 1.00 0.00 C ATOM 0 H ILE A 92 -6.328 -9.884 -8.106 1.00 0.00 H new ATOM 0 HA ILE A 92 -8.871 -10.561 -8.676 1.00 0.00 H new ATOM 0 HB ILE A 92 -9.511 -8.691 -7.015 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -6.547 -8.235 -7.322 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -7.848 -7.061 -7.322 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -8.440 -9.864 -5.129 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -9.082 -11.005 -6.334 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -7.335 -10.674 -6.265 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -6.544 -6.925 -5.256 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -8.211 -7.444 -4.910 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -6.890 -8.636 -4.910 1.00 0.00 H new ATOM 1275 N PRO A 93 -10.305 -8.666 -9.688 1.00 0.00 N ATOM 1276 CA PRO A 93 -11.050 -7.760 -10.568 1.00 0.00 C ATOM 1277 C PRO A 93 -11.089 -6.334 -10.032 1.00 0.00 C ATOM 1278 O PRO A 93 -11.722 -5.457 -10.620 1.00 0.00 O ATOM 1279 CB PRO A 93 -12.456 -8.364 -10.589 1.00 0.00 C ATOM 1280 CG PRO A 93 -12.565 -9.115 -9.308 1.00 0.00 C ATOM 1281 CD PRO A 93 -11.184 -9.635 -9.014 1.00 0.00 C ATOM 0 HA PRO A 93 -10.592 -7.679 -11.554 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -13.219 -7.589 -10.659 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -12.591 -9.023 -11.447 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -12.917 -8.468 -8.505 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -13.280 -9.933 -9.395 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -10.990 -9.676 -7.942 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -11.043 -10.644 -9.403 1.00 0.00 H new ATOM 1289 N ASN A 94 -10.410 -6.108 -8.912 1.00 0.00 N ATOM 1290 CA ASN A 94 -10.369 -4.786 -8.297 1.00 0.00 C ATOM 1291 C ASN A 94 -9.026 -4.108 -8.553 1.00 0.00 C ATOM 1292 O ASN A 94 -8.861 -2.916 -8.295 1.00 0.00 O ATOM 1293 CB ASN A 94 -10.619 -4.894 -6.791 1.00 0.00 C ATOM 1294 CG ASN A 94 -12.094 -5.007 -6.457 1.00 0.00 C ATOM 1295 OD1 ASN A 94 -12.861 -4.065 -6.656 1.00 0.00 O ATOM 1296 ND2 ASN A 94 -12.496 -6.165 -5.946 1.00 0.00 N ATOM 0 H ASN A 94 -9.881 -6.823 -8.412 1.00 0.00 H new ATOM 0 HA ASN A 94 -11.154 -4.179 -8.747 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -10.093 -5.765 -6.400 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -10.202 -4.019 -6.292 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -13.477 -6.301 -5.701 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -11.824 -6.918 -5.799 1.00 0.00 H new ATOM 1303 N SER A 95 -8.069 -4.877 -9.063 1.00 0.00 N ATOM 1304 CA SER A 95 -6.739 -4.352 -9.352 1.00 0.00 C ATOM 1305 C SER A 95 -6.653 -3.855 -10.792 1.00 0.00 C ATOM 1306 O SER A 95 -7.228 -4.435 -11.712 1.00 0.00 O ATOM 1307 CB SER A 95 -5.680 -5.428 -9.108 1.00 0.00 C ATOM 1308 OG SER A 95 -4.456 -4.852 -8.684 1.00 0.00 O ATOM 0 H SER A 95 -8.190 -5.865 -9.285 1.00 0.00 H new ATOM 0 HA SER A 95 -6.553 -3.511 -8.684 1.00 0.00 H new ATOM 0 HB2 SER A 95 -6.036 -6.129 -8.353 1.00 0.00 H new ATOM 0 HB3 SER A 95 -5.519 -5.999 -10.023 1.00 0.00 H new ATOM 0 HG SER A 95 -3.709 -5.320 -9.111 1.00 0.00 H new ATOM 1314 N PRO A 96 -5.915 -2.752 -10.992 1.00 0.00 N ATOM 1315 CA PRO A 96 -5.226 -2.052 -9.904 1.00 0.00 C ATOM 1316 C PRO A 96 -6.196 -1.351 -8.961 1.00 0.00 C ATOM 1317 O PRO A 96 -7.395 -1.269 -9.233 1.00 0.00 O ATOM 1318 CB PRO A 96 -4.357 -1.027 -10.637 1.00 0.00 C ATOM 1319 CG PRO A 96 -5.055 -0.795 -11.932 1.00 0.00 C ATOM 1320 CD PRO A 96 -5.699 -2.103 -12.297 1.00 0.00 C ATOM 0 HA PRO A 96 -4.660 -2.736 -9.272 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -4.267 -0.104 -10.065 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -3.347 -1.405 -10.794 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -5.801 -0.006 -11.837 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -4.352 -0.478 -12.702 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -6.637 -1.954 -12.832 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -5.056 -2.702 -12.942 1.00 0.00 H new ATOM 1328 N PHE A 97 -5.671 -0.845 -7.849 1.00 0.00 N ATOM 1329 CA PHE A 97 -6.493 -0.150 -6.864 1.00 0.00 C ATOM 1330 C PHE A 97 -6.204 1.348 -6.875 1.00 0.00 C ATOM 1331 O PHE A 97 -5.078 1.779 -6.622 1.00 0.00 O ATOM 1332 CB PHE A 97 -6.239 -0.719 -5.465 1.00 0.00 C ATOM 1333 CG PHE A 97 -6.858 -2.069 -5.247 1.00 0.00 C ATOM 1334 CD1 PHE A 97 -6.548 -3.131 -6.082 1.00 0.00 C ATOM 1335 CD2 PHE A 97 -7.749 -2.278 -4.207 1.00 0.00 C ATOM 1336 CE1 PHE A 97 -7.115 -4.376 -5.882 1.00 0.00 C ATOM 1337 CE2 PHE A 97 -8.319 -3.520 -4.003 1.00 0.00 C ATOM 1338 CZ PHE A 97 -8.002 -4.570 -4.843 1.00 0.00 C ATOM 0 H PHE A 97 -4.682 -0.903 -7.608 1.00 0.00 H new ATOM 0 HA PHE A 97 -7.540 -0.303 -7.127 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -5.164 -0.790 -5.300 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -6.631 -0.024 -4.722 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -5.856 -2.984 -6.898 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -8.001 -1.460 -3.548 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -6.864 -5.196 -6.538 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -9.011 -3.670 -3.188 1.00 0.00 H new ATOM 0 HZ PHE A 97 -8.448 -5.541 -4.687 1.00 0.00 H new ATOM 1348 N THR A 98 -7.231 2.140 -7.172 1.00 0.00 N ATOM 1349 CA THR A 98 -7.089 3.589 -7.219 1.00 0.00 C ATOM 1350 C THR A 98 -7.062 4.185 -5.816 1.00 0.00 C ATOM 1351 O THR A 98 -8.031 4.075 -5.065 1.00 0.00 O ATOM 1352 CB THR A 98 -8.234 4.241 -8.018 1.00 0.00 C ATOM 1353 OG1 THR A 98 -8.225 3.758 -9.366 1.00 0.00 O ATOM 1354 CG2 THR A 98 -8.101 5.756 -8.016 1.00 0.00 C ATOM 0 H THR A 98 -8.170 1.801 -7.383 1.00 0.00 H new ATOM 0 HA THR A 98 -6.143 3.797 -7.718 1.00 0.00 H new ATOM 0 HB THR A 98 -9.178 3.975 -7.542 1.00 0.00 H new ATOM 0 HG1 THR A 98 -8.956 4.175 -9.868 1.00 0.00 H new ATOM 0 HG21 THR A 98 -8.920 6.194 -8.586 1.00 0.00 H new ATOM 0 HG22 THR A 98 -8.136 6.123 -6.990 1.00 0.00 H new ATOM 0 HG23 THR A 98 -7.151 6.038 -8.470 1.00 0.00 H new ATOM 1362 N VAL A 99 -5.946 4.817 -5.468 1.00 0.00 N ATOM 1363 CA VAL A 99 -5.792 5.433 -4.155 1.00 0.00 C ATOM 1364 C VAL A 99 -5.276 6.862 -4.274 1.00 0.00 C ATOM 1365 O VAL A 99 -4.118 7.087 -4.624 1.00 0.00 O ATOM 1366 CB VAL A 99 -4.831 4.624 -3.264 1.00 0.00 C ATOM 1367 CG1 VAL A 99 -4.633 5.317 -1.925 1.00 0.00 C ATOM 1368 CG2 VAL A 99 -5.351 3.208 -3.069 1.00 0.00 C ATOM 0 H VAL A 99 -5.134 4.916 -6.078 1.00 0.00 H new ATOM 0 HA VAL A 99 -6.780 5.444 -3.694 1.00 0.00 H new ATOM 0 HB VAL A 99 -3.863 4.566 -3.762 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -3.951 4.731 -1.309 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -4.213 6.310 -2.088 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -5.593 5.408 -1.417 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -4.660 2.650 -2.437 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -6.331 3.243 -2.593 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -5.436 2.715 -4.037 1.00 0.00 H new ATOM 1378 N MET A 100 -6.143 7.825 -3.980 1.00 0.00 N ATOM 1379 CA MET A 100 -5.774 9.234 -4.054 1.00 0.00 C ATOM 1380 C MET A 100 -5.410 9.773 -2.673 1.00 0.00 C ATOM 1381 O MET A 100 -6.267 9.893 -1.798 1.00 0.00 O ATOM 1382 CB MET A 100 -6.921 10.054 -4.647 1.00 0.00 C ATOM 1383 CG MET A 100 -6.570 11.516 -4.870 1.00 0.00 C ATOM 1384 SD MET A 100 -5.705 11.795 -6.427 1.00 0.00 S ATOM 1385 CE MET A 100 -4.600 13.127 -5.966 1.00 0.00 C ATOM 0 H MET A 100 -7.106 7.656 -3.688 1.00 0.00 H new ATOM 0 HA MET A 100 -4.902 9.322 -4.702 1.00 0.00 H new ATOM 0 HB2 MET A 100 -7.220 9.611 -5.597 1.00 0.00 H new ATOM 0 HB3 MET A 100 -7.782 9.993 -3.982 1.00 0.00 H new ATOM 0 HG2 MET A 100 -7.483 12.111 -4.855 1.00 0.00 H new ATOM 0 HG3 MET A 100 -5.948 11.866 -4.046 1.00 0.00 H new ATOM 0 HE1 MET A 100 -3.877 13.293 -6.765 1.00 0.00 H new ATOM 0 HE2 MET A 100 -5.176 14.038 -5.803 1.00 0.00 H new ATOM 0 HE3 MET A 100 -4.073 12.862 -5.049 1.00 0.00 H new ATOM 1395 N ALA A 101 -4.135 10.096 -2.486 1.00 0.00 N ATOM 1396 CA ALA A 101 -3.658 10.623 -1.214 1.00 0.00 C ATOM 1397 C ALA A 101 -3.791 12.141 -1.164 1.00 0.00 C ATOM 1398 O ALA A 101 -3.093 12.860 -1.879 1.00 0.00 O ATOM 1399 CB ALA A 101 -2.213 10.209 -0.979 1.00 0.00 C ATOM 0 H ALA A 101 -3.413 10.002 -3.200 1.00 0.00 H new ATOM 0 HA ALA A 101 -4.277 10.204 -0.421 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -1.870 10.610 -0.025 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -2.144 9.121 -0.961 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -1.588 10.599 -1.782 1.00 0.00 H new ATOM 1405 N THR A 102 -4.693 12.624 -0.315 1.00 0.00 N ATOM 1406 CA THR A 102 -4.919 14.056 -0.174 1.00 0.00 C ATOM 1407 C THR A 102 -4.031 14.649 0.914 1.00 0.00 C ATOM 1408 O THR A 102 -3.733 13.991 1.912 1.00 0.00 O ATOM 1409 CB THR A 102 -6.392 14.363 0.158 1.00 0.00 C ATOM 1410 OG1 THR A 102 -6.850 13.496 1.202 1.00 0.00 O ATOM 1411 CG2 THR A 102 -7.271 14.193 -1.073 1.00 0.00 C ATOM 0 H THR A 102 -5.279 12.043 0.285 1.00 0.00 H new ATOM 0 HA THR A 102 -4.668 14.511 -1.132 1.00 0.00 H new ATOM 0 HB THR A 102 -6.458 15.399 0.492 1.00 0.00 H new ATOM 0 HG1 THR A 102 -7.786 13.699 1.408 1.00 0.00 H new ATOM 0 HG21 THR A 102 -8.306 14.415 -0.814 1.00 0.00 H new ATOM 0 HG22 THR A 102 -6.938 14.875 -1.855 1.00 0.00 H new ATOM 0 HG23 THR A 102 -7.199 13.167 -1.433 1.00 0.00 H new ATOM 1419 N ASP A 103 -3.612 15.894 0.718 1.00 0.00 N ATOM 1420 CA ASP A 103 -2.759 16.575 1.684 1.00 0.00 C ATOM 1421 C ASP A 103 -3.582 17.116 2.849 1.00 0.00 C ATOM 1422 O ASP A 103 -3.106 17.180 3.982 1.00 0.00 O ATOM 1423 CB ASP A 103 -1.997 17.717 1.009 1.00 0.00 C ATOM 1424 CG ASP A 103 -2.923 18.734 0.372 1.00 0.00 C ATOM 1425 OD1 ASP A 103 -3.893 18.317 -0.295 1.00 0.00 O ATOM 1426 OD2 ASP A 103 -2.678 19.947 0.540 1.00 0.00 O ATOM 0 H ASP A 103 -3.850 16.452 -0.102 1.00 0.00 H new ATOM 0 HA ASP A 103 -2.043 15.851 2.073 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -1.367 18.215 1.746 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -1.334 17.307 0.248 1.00 0.00 H new ATOM 1431 N GLY A 104 -4.820 17.506 2.561 1.00 0.00 N ATOM 1432 CA GLY A 104 -5.689 18.037 3.595 1.00 0.00 C ATOM 1433 C GLY A 104 -5.733 19.553 3.593 1.00 0.00 C ATOM 1434 O GLY A 104 -4.828 20.205 3.074 1.00 0.00 O ATOM 0 H GLY A 104 -5.236 17.464 1.631 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -6.697 17.647 3.454 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -5.346 17.688 4.569 1.00 0.00 H new ATOM 1438 N GLU A 105 -6.789 20.113 4.174 1.00 0.00 N ATOM 1439 CA GLU A 105 -6.947 21.562 4.235 1.00 0.00 C ATOM 1440 C GLU A 105 -5.637 22.237 4.629 1.00 0.00 C ATOM 1441 O GLU A 105 -4.752 21.608 5.212 1.00 0.00 O ATOM 1442 CB GLU A 105 -8.046 21.936 5.232 1.00 0.00 C ATOM 1443 CG GLU A 105 -7.664 21.685 6.681 1.00 0.00 C ATOM 1444 CD GLU A 105 -8.653 22.291 7.659 1.00 0.00 C ATOM 1445 OE1 GLU A 105 -9.837 21.898 7.623 1.00 0.00 O ATOM 1446 OE2 GLU A 105 -8.241 23.158 8.458 1.00 0.00 O ATOM 0 H GLU A 105 -7.547 19.587 4.609 1.00 0.00 H new ATOM 0 HA GLU A 105 -7.232 21.912 3.243 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -8.294 22.990 5.108 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -8.946 21.367 4.998 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -7.599 20.611 6.855 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -6.673 22.099 6.869 1.00 0.00 H new ATOM 1453 N VAL A 106 -5.519 23.521 4.306 1.00 0.00 N ATOM 1454 CA VAL A 106 -4.316 24.282 4.625 1.00 0.00 C ATOM 1455 C VAL A 106 -4.136 24.416 6.133 1.00 0.00 C ATOM 1456 O VAL A 106 -5.096 24.664 6.865 1.00 0.00 O ATOM 1457 CB VAL A 106 -4.358 25.687 3.997 1.00 0.00 C ATOM 1458 CG1 VAL A 106 -4.420 25.593 2.480 1.00 0.00 C ATOM 1459 CG2 VAL A 106 -5.540 26.478 4.538 1.00 0.00 C ATOM 0 H VAL A 106 -6.241 24.056 3.824 1.00 0.00 H new ATOM 0 HA VAL A 106 -3.472 23.732 4.208 1.00 0.00 H new ATOM 0 HB VAL A 106 -3.443 26.213 4.268 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -4.449 26.596 2.054 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -3.539 25.068 2.112 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -5.317 25.048 2.186 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -5.554 27.468 4.083 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -6.467 25.956 4.299 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -5.447 26.577 5.620 1.00 0.00 H new ATOM 1469 N THR A 107 -2.900 24.253 6.593 1.00 0.00 N ATOM 1470 CA THR A 107 -2.592 24.356 8.014 1.00 0.00 C ATOM 1471 C THR A 107 -2.053 25.738 8.361 1.00 0.00 C ATOM 1472 O THR A 107 -1.467 26.416 7.517 1.00 0.00 O ATOM 1473 CB THR A 107 -1.565 23.292 8.444 1.00 0.00 C ATOM 1474 OG1 THR A 107 -0.349 23.460 7.707 1.00 0.00 O ATOM 1475 CG2 THR A 107 -2.111 21.890 8.221 1.00 0.00 C ATOM 0 H THR A 107 -2.095 24.049 6.001 1.00 0.00 H new ATOM 0 HA THR A 107 -3.524 24.188 8.553 1.00 0.00 H new ATOM 0 HB THR A 107 -1.365 23.420 9.508 1.00 0.00 H new ATOM 0 HG1 THR A 107 0.300 22.781 7.987 1.00 0.00 H new ATOM 0 HG21 THR A 107 -1.367 21.156 8.532 1.00 0.00 H new ATOM 0 HG22 THR A 107 -3.020 21.756 8.807 1.00 0.00 H new ATOM 0 HG23 THR A 107 -2.337 21.751 7.164 1.00 0.00 H new ATOM 1483 N ALA A 108 -2.252 26.149 9.609 1.00 0.00 N ATOM 1484 CA ALA A 108 -1.784 27.451 10.069 1.00 0.00 C ATOM 1485 C ALA A 108 -0.378 27.353 10.652 1.00 0.00 C ATOM 1486 O ALA A 108 -0.113 26.524 11.523 1.00 0.00 O ATOM 1487 CB ALA A 108 -2.745 28.025 11.098 1.00 0.00 C ATOM 0 H ALA A 108 -2.734 25.599 10.320 1.00 0.00 H new ATOM 0 HA ALA A 108 -1.748 28.121 9.210 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -2.382 28.997 11.432 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -3.732 28.140 10.650 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -2.811 27.350 11.951 1.00 0.00 H new ATOM 1493 N VAL A 109 0.520 28.204 10.167 1.00 0.00 N ATOM 1494 CA VAL A 109 1.900 28.213 10.640 1.00 0.00 C ATOM 1495 C VAL A 109 2.594 29.523 10.285 1.00 0.00 C ATOM 1496 O VAL A 109 2.673 29.897 9.115 1.00 0.00 O ATOM 1497 CB VAL A 109 2.704 27.040 10.049 1.00 0.00 C ATOM 1498 CG1 VAL A 109 2.822 27.181 8.540 1.00 0.00 C ATOM 1499 CG2 VAL A 109 4.080 26.960 10.694 1.00 0.00 C ATOM 0 H VAL A 109 0.317 28.897 9.446 1.00 0.00 H new ATOM 0 HA VAL A 109 1.864 28.108 11.724 1.00 0.00 H new ATOM 0 HB VAL A 109 2.172 26.113 10.263 1.00 0.00 H new ATOM 0 HG11 VAL A 109 3.393 26.343 8.140 1.00 0.00 H new ATOM 0 HG12 VAL A 109 1.826 27.186 8.096 1.00 0.00 H new ATOM 0 HG13 VAL A 109 3.331 28.115 8.301 1.00 0.00 H new ATOM 0 HG21 VAL A 109 4.635 26.126 10.265 1.00 0.00 H new ATOM 0 HG22 VAL A 109 4.622 27.888 10.512 1.00 0.00 H new ATOM 0 HG23 VAL A 109 3.970 26.809 11.768 1.00 0.00 H new ATOM 1509 N GLU A 110 3.096 30.215 11.303 1.00 0.00 N ATOM 1510 CA GLU A 110 3.784 31.484 11.096 1.00 0.00 C ATOM 1511 C GLU A 110 5.215 31.255 10.617 1.00 0.00 C ATOM 1512 O GLU A 110 5.957 30.467 11.201 1.00 0.00 O ATOM 1513 CB GLU A 110 3.793 32.301 12.390 1.00 0.00 C ATOM 1514 CG GLU A 110 4.264 31.516 13.603 1.00 0.00 C ATOM 1515 CD GLU A 110 4.437 32.388 14.831 1.00 0.00 C ATOM 1516 OE1 GLU A 110 5.496 33.039 14.952 1.00 0.00 O ATOM 1517 OE2 GLU A 110 3.514 32.420 15.671 1.00 0.00 O ATOM 0 H GLU A 110 3.039 29.919 12.277 1.00 0.00 H new ATOM 0 HA GLU A 110 3.246 32.039 10.327 1.00 0.00 H new ATOM 0 HB2 GLU A 110 4.438 33.169 12.257 1.00 0.00 H new ATOM 0 HB3 GLU A 110 2.788 32.677 12.579 1.00 0.00 H new ATOM 0 HG2 GLU A 110 3.545 30.726 13.821 1.00 0.00 H new ATOM 0 HG3 GLU A 110 5.212 31.030 13.371 1.00 0.00 H new ATOM 1524 N GLU A 111 5.593 31.951 9.549 1.00 0.00 N ATOM 1525 CA GLU A 111 6.934 31.823 8.990 1.00 0.00 C ATOM 1526 C GLU A 111 7.406 33.147 8.398 1.00 0.00 C ATOM 1527 O GLU A 111 6.936 33.569 7.342 1.00 0.00 O ATOM 1528 CB GLU A 111 6.961 30.733 7.917 1.00 0.00 C ATOM 1529 CG GLU A 111 6.748 29.332 8.466 1.00 0.00 C ATOM 1530 CD GLU A 111 7.983 28.778 9.148 1.00 0.00 C ATOM 1531 OE1 GLU A 111 8.808 28.142 8.460 1.00 0.00 O ATOM 1532 OE2 GLU A 111 8.125 28.982 10.373 1.00 0.00 O ATOM 0 H GLU A 111 4.990 32.608 9.054 1.00 0.00 H new ATOM 0 HA GLU A 111 7.611 31.545 9.798 1.00 0.00 H new ATOM 0 HB2 GLU A 111 6.190 30.945 7.176 1.00 0.00 H new ATOM 0 HB3 GLU A 111 7.919 30.769 7.399 1.00 0.00 H new ATOM 0 HG2 GLU A 111 5.921 29.346 9.176 1.00 0.00 H new ATOM 0 HG3 GLU A 111 6.458 28.667 7.652 1.00 0.00 H new ATOM 1539 N ALA A 112 8.338 33.799 9.087 1.00 0.00 N ATOM 1540 CA ALA A 112 8.874 35.074 8.629 1.00 0.00 C ATOM 1541 C ALA A 112 10.233 35.356 9.261 1.00 0.00 C ATOM 1542 O ALA A 112 10.391 35.349 10.482 1.00 0.00 O ATOM 1543 CB ALA A 112 7.900 36.200 8.944 1.00 0.00 C ATOM 0 H ALA A 112 8.737 33.464 9.964 1.00 0.00 H new ATOM 0 HA ALA A 112 9.009 35.017 7.549 1.00 0.00 H new ATOM 0 HB1 ALA A 112 8.313 37.147 8.596 1.00 0.00 H new ATOM 0 HB2 ALA A 112 6.951 36.012 8.441 1.00 0.00 H new ATOM 0 HB3 ALA A 112 7.737 36.249 10.021 1.00 0.00 H new ATOM 1549 N PRO A 113 11.241 35.611 8.412 1.00 0.00 N ATOM 1550 CA PRO A 113 12.604 35.901 8.865 1.00 0.00 C ATOM 1551 C PRO A 113 12.711 37.257 9.554 1.00 0.00 C ATOM 1552 O PRO A 113 11.876 38.139 9.344 1.00 0.00 O ATOM 1553 CB PRO A 113 13.417 35.893 7.570 1.00 0.00 C ATOM 1554 CG PRO A 113 12.434 36.229 6.502 1.00 0.00 C ATOM 1555 CD PRO A 113 11.124 35.636 6.945 1.00 0.00 C ATOM 0 HA PRO A 113 12.949 35.179 9.605 1.00 0.00 H new ATOM 0 HB2 PRO A 113 14.226 36.622 7.606 1.00 0.00 H new ATOM 0 HB3 PRO A 113 13.873 34.919 7.395 1.00 0.00 H new ATOM 0 HG2 PRO A 113 12.351 37.308 6.374 1.00 0.00 H new ATOM 0 HG3 PRO A 113 12.744 35.817 5.542 1.00 0.00 H new ATOM 0 HD2 PRO A 113 10.278 36.241 6.619 1.00 0.00 H new ATOM 0 HD3 PRO A 113 10.977 34.636 6.536 1.00 0.00 H new ATOM 1563 N VAL A 114 13.743 37.420 10.375 1.00 0.00 N ATOM 1564 CA VAL A 114 13.959 38.670 11.092 1.00 0.00 C ATOM 1565 C VAL A 114 15.409 39.126 10.977 1.00 0.00 C ATOM 1566 O VAL A 114 16.325 38.435 11.421 1.00 0.00 O ATOM 1567 CB VAL A 114 13.593 38.534 12.583 1.00 0.00 C ATOM 1568 CG1 VAL A 114 13.865 39.835 13.321 1.00 0.00 C ATOM 1569 CG2 VAL A 114 12.138 38.118 12.737 1.00 0.00 C ATOM 0 H VAL A 114 14.443 36.701 10.560 1.00 0.00 H new ATOM 0 HA VAL A 114 13.309 39.414 10.632 1.00 0.00 H new ATOM 0 HB VAL A 114 14.218 37.758 13.024 1.00 0.00 H new ATOM 0 HG11 VAL A 114 13.600 39.719 14.372 1.00 0.00 H new ATOM 0 HG12 VAL A 114 14.923 40.086 13.239 1.00 0.00 H new ATOM 0 HG13 VAL A 114 13.267 40.634 12.882 1.00 0.00 H new ATOM 0 HG21 VAL A 114 11.896 38.026 13.796 1.00 0.00 H new ATOM 0 HG22 VAL A 114 11.494 38.870 12.281 1.00 0.00 H new ATOM 0 HG23 VAL A 114 11.980 37.159 12.244 1.00 0.00 H new ATOM 1579 N ASN A 115 15.611 40.295 10.377 1.00 0.00 N ATOM 1580 CA ASN A 115 16.950 40.843 10.202 1.00 0.00 C ATOM 1581 C ASN A 115 16.917 42.369 10.199 1.00 0.00 C ATOM 1582 O ASN A 115 15.943 42.978 9.756 1.00 0.00 O ATOM 1583 CB ASN A 115 17.568 40.333 8.899 1.00 0.00 C ATOM 1584 CG ASN A 115 16.653 40.538 7.707 1.00 0.00 C ATOM 1585 OD1 ASN A 115 15.806 41.431 7.706 1.00 0.00 O ATOM 1586 ND2 ASN A 115 16.821 39.709 6.682 1.00 0.00 N ATOM 0 H ASN A 115 14.864 40.881 10.004 1.00 0.00 H new ATOM 0 HA ASN A 115 17.563 40.511 11.040 1.00 0.00 H new ATOM 0 HB2 ASN A 115 18.512 40.848 8.722 1.00 0.00 H new ATOM 0 HB3 ASN A 115 17.797 39.272 8.999 1.00 0.00 H new ATOM 0 HD21 ASN A 115 16.235 39.799 5.852 1.00 0.00 H new ATOM 0 HD22 ASN A 115 17.536 38.983 6.725 1.00 0.00 H new ATOM 1593 N ALA A 116 17.988 42.980 10.695 1.00 0.00 N ATOM 1594 CA ALA A 116 18.083 44.434 10.745 1.00 0.00 C ATOM 1595 C ALA A 116 19.490 44.879 11.130 1.00 0.00 C ATOM 1596 O ALA A 116 20.212 44.158 11.819 1.00 0.00 O ATOM 1597 CB ALA A 116 17.062 44.995 11.726 1.00 0.00 C ATOM 0 H ALA A 116 18.802 42.491 11.068 1.00 0.00 H new ATOM 0 HA ALA A 116 17.867 44.823 9.750 1.00 0.00 H new ATOM 0 HB1 ALA A 116 17.143 46.082 11.754 1.00 0.00 H new ATOM 0 HB2 ALA A 116 16.058 44.714 11.407 1.00 0.00 H new ATOM 0 HB3 ALA A 116 17.253 44.591 12.720 1.00 0.00 H new ATOM 1603 N CYS A 117 19.871 46.069 10.680 1.00 0.00 N ATOM 1604 CA CYS A 117 21.194 46.609 10.976 1.00 0.00 C ATOM 1605 C CYS A 117 21.135 48.124 11.148 1.00 0.00 C ATOM 1606 O CYS A 117 20.418 48.827 10.437 1.00 0.00 O ATOM 1607 CB CYS A 117 22.176 46.248 9.861 1.00 0.00 C ATOM 1608 SG CYS A 117 22.685 44.513 9.860 1.00 0.00 S ATOM 0 H CYS A 117 19.284 46.678 10.110 1.00 0.00 H new ATOM 0 HA CYS A 117 21.540 46.168 11.911 1.00 0.00 H new ATOM 0 HB2 CYS A 117 21.720 46.482 8.899 1.00 0.00 H new ATOM 0 HB3 CYS A 117 23.062 46.876 9.955 1.00 0.00 H new ATOM 0 HG CYS A 117 21.900 43.830 10.639 1.00 0.00 H new ATOM 1614 N PRO A 118 21.908 48.640 12.115 1.00 0.00 N ATOM 1615 CA PRO A 118 21.962 50.076 12.404 1.00 0.00 C ATOM 1616 C PRO A 118 22.652 50.864 11.297 1.00 0.00 C ATOM 1617 O PRO A 118 23.604 50.385 10.681 1.00 0.00 O ATOM 1618 CB PRO A 118 22.775 50.147 13.699 1.00 0.00 C ATOM 1619 CG PRO A 118 23.612 48.915 13.689 1.00 0.00 C ATOM 1620 CD PRO A 118 22.789 47.860 13.002 1.00 0.00 C ATOM 0 HA PRO A 118 20.967 50.513 12.485 1.00 0.00 H new ATOM 0 HB2 PRO A 118 23.392 51.045 13.730 1.00 0.00 H new ATOM 0 HB3 PRO A 118 22.125 50.177 14.573 1.00 0.00 H new ATOM 0 HG2 PRO A 118 24.550 49.085 13.160 1.00 0.00 H new ATOM 0 HG3 PRO A 118 23.869 48.610 14.703 1.00 0.00 H new ATOM 0 HD2 PRO A 118 23.413 47.166 12.439 1.00 0.00 H new ATOM 0 HD3 PRO A 118 22.218 47.267 13.716 1.00 0.00 H new ATOM 1628 N SER A 119 22.167 52.077 11.050 1.00 0.00 N ATOM 1629 CA SER A 119 22.736 52.932 10.014 1.00 0.00 C ATOM 1630 C SER A 119 22.131 54.332 10.071 1.00 0.00 C ATOM 1631 O SER A 119 20.967 54.502 10.428 1.00 0.00 O ATOM 1632 CB SER A 119 22.504 52.319 8.632 1.00 0.00 C ATOM 1633 OG SER A 119 23.362 52.897 7.666 1.00 0.00 O ATOM 0 H SER A 119 21.382 52.490 11.553 1.00 0.00 H new ATOM 0 HA SER A 119 23.808 53.012 10.192 1.00 0.00 H new ATOM 0 HB2 SER A 119 22.673 51.243 8.675 1.00 0.00 H new ATOM 0 HB3 SER A 119 21.466 52.467 8.335 1.00 0.00 H new ATOM 0 HG SER A 119 23.194 52.486 6.792 1.00 0.00 H new ATOM 1639 N GLY A 120 22.933 55.331 9.715 1.00 0.00 N ATOM 1640 CA GLY A 120 22.461 56.703 9.732 1.00 0.00 C ATOM 1641 C GLY A 120 22.186 57.238 8.341 1.00 0.00 C ATOM 1642 O GLY A 120 23.067 57.790 7.680 1.00 0.00 O ATOM 0 H GLY A 120 23.901 55.214 9.415 1.00 0.00 H new ATOM 0 HA2 GLY A 120 21.550 56.763 10.328 1.00 0.00 H new ATOM 0 HA3 GLY A 120 23.204 57.334 10.220 1.00 0.00 H new ATOM 1646 N PRO A 121 20.938 57.078 7.876 1.00 0.00 N ATOM 1647 CA PRO A 121 20.522 57.542 6.550 1.00 0.00 C ATOM 1648 C PRO A 121 20.464 59.063 6.460 1.00 0.00 C ATOM 1649 O PRO A 121 20.732 59.763 7.436 1.00 0.00 O ATOM 1650 CB PRO A 121 19.123 56.943 6.387 1.00 0.00 C ATOM 1651 CG PRO A 121 18.626 56.756 7.779 1.00 0.00 C ATOM 1652 CD PRO A 121 19.838 56.431 8.610 1.00 0.00 C ATOM 0 HA PRO A 121 21.224 57.238 5.773 1.00 0.00 H new ATOM 0 HB2 PRO A 121 18.471 57.608 5.820 1.00 0.00 H new ATOM 0 HB3 PRO A 121 19.158 55.996 5.849 1.00 0.00 H new ATOM 0 HG2 PRO A 121 18.134 57.658 8.142 1.00 0.00 H new ATOM 0 HG3 PRO A 121 17.892 55.951 7.827 1.00 0.00 H new ATOM 0 HD2 PRO A 121 19.747 56.821 9.624 1.00 0.00 H new ATOM 0 HD3 PRO A 121 19.990 55.355 8.695 1.00 0.00 H new ATOM 1660 N SER A 122 20.113 59.569 5.282 1.00 0.00 N ATOM 1661 CA SER A 122 20.023 61.008 5.063 1.00 0.00 C ATOM 1662 C SER A 122 19.107 61.323 3.884 1.00 0.00 C ATOM 1663 O SER A 122 18.588 60.420 3.230 1.00 0.00 O ATOM 1664 CB SER A 122 21.414 61.594 4.814 1.00 0.00 C ATOM 1665 OG SER A 122 22.007 61.027 3.659 1.00 0.00 O ATOM 0 H SER A 122 19.886 59.003 4.464 1.00 0.00 H new ATOM 0 HA SER A 122 19.600 61.461 5.959 1.00 0.00 H new ATOM 0 HB2 SER A 122 21.341 62.675 4.696 1.00 0.00 H new ATOM 0 HB3 SER A 122 22.050 61.411 5.680 1.00 0.00 H new ATOM 0 HG SER A 122 22.894 61.419 3.521 1.00 0.00 H new ATOM 1671 N SER A 123 18.913 62.611 3.622 1.00 0.00 N ATOM 1672 CA SER A 123 18.057 63.047 2.525 1.00 0.00 C ATOM 1673 C SER A 123 18.859 63.824 1.485 1.00 0.00 C ATOM 1674 O SER A 123 19.488 64.834 1.797 1.00 0.00 O ATOM 1675 CB SER A 123 16.914 63.914 3.056 1.00 0.00 C ATOM 1676 OG SER A 123 16.082 64.365 2.000 1.00 0.00 O ATOM 0 H SER A 123 19.337 63.371 4.154 1.00 0.00 H new ATOM 0 HA SER A 123 17.640 62.160 2.048 1.00 0.00 H new ATOM 0 HB2 SER A 123 16.322 63.343 3.771 1.00 0.00 H new ATOM 0 HB3 SER A 123 17.322 64.770 3.593 1.00 0.00 H new ATOM 0 HG SER A 123 15.358 64.915 2.366 1.00 0.00 H new ATOM 1682 N GLY A 124 18.832 63.343 0.246 1.00 0.00 N ATOM 1683 CA GLY A 124 19.560 64.003 -0.823 1.00 0.00 C ATOM 1684 C GLY A 124 18.639 64.634 -1.847 1.00 0.00 C ATOM 1685 O GLY A 124 17.990 63.935 -2.624 1.00 0.00 O ATOM 0 H GLY A 124 18.319 62.508 -0.037 1.00 0.00 H new ATOM 0 HA2 GLY A 124 20.206 64.771 -0.398 1.00 0.00 H new ATOM 0 HA3 GLY A 124 20.208 63.279 -1.318 1.00 0.00 H new TER 1689 GLY A 124