USER MOD reduce.3.24.130724 H: found=0, std=0, add=977, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 973 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 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 96 SER OG : rot -60:sc= -1.98! USER MOD Set 2.1: A 70 THR OG1 : rot -160:sc= 0.56! USER MOD Set 2.2: A 71 THR OG1 : rot 180:sc= 0.0367 USER MOD Single : A 1 GLY N :NH3+ 138:sc= 0.0838 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 51:sc= 1.17 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 16 HIS : no HD1:sc= -0.789 K(o=-0.79,f=-0.12) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0.173 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0.014 USER MOD Single : A 43 SER OG : rot 180:sc= -0.0284 USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 ASN : amide:sc= -2.18 K(o=-2.2,f=-0.26) USER MOD Single : A 61 TYR OH : rot 30:sc= 0 USER MOD Single : A 62 GLN : amide:sc= -1.96 X(o=-2,f=-1.9) USER MOD Single : A 64 THR OG1 : rot -1:sc= -2.17! USER MOD Single : A 65 HIS : no HD1:sc= -5.01! C(o=-5!,f=-3.8!) USER MOD Single : A 68 ASN : amide:sc= -1.57 K(o=-1.6,f=-3.1!) USER MOD Single : A 69 THR OG1 : rot 8:sc= 0.907 USER MOD Single : A 73 ASN : amide:sc=-0.00212 X(o=-0.0021,f=0) USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 86 GLN : amide:sc=-0.00198 K(o=-0.002,f=-0.87) USER MOD Single : A 87 TYR OH : rot 171:sc=0.000581 USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 180:sc= 0.144 USER MOD Single : A 103 THR OG1 : rot 180:sc= -0.985 USER MOD Single : A 105 GLN : amide:sc= -7.83! C(o=-7.8!,f=-9.6!) USER MOD Single : A 106 THR OG1 : rot -79:sc= -2.2 USER MOD Single : A 108 LYS NZ :NH3+ 155:sc= 0.726 (180deg=0.419) USER MOD Single : A 120 THR OG1 : rot -162:sc= 0.253 USER MOD Single : A 121 THR OG1 : rot 180:sc= -0.202 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 39.077 33.232 -37.123 1.00 0.00 N ATOM 2 CA GLY A 1 40.297 32.614 -36.632 1.00 0.00 C ATOM 3 C GLY A 1 40.097 31.116 -36.396 1.00 0.00 C ATOM 4 O GLY A 1 38.967 30.654 -36.243 1.00 0.00 O ATOM 0 H1 GLY A 1 38.936 34.147 -36.649 1.00 0.00 H new ATOM 0 H2 GLY A 1 39.152 33.382 -38.149 1.00 0.00 H new ATOM 0 H3 GLY A 1 38.268 32.610 -36.922 1.00 0.00 H new ATOM 0 HA2 GLY A 1 41.102 32.768 -37.351 1.00 0.00 H new ATOM 0 HA3 GLY A 1 40.604 33.094 -35.703 1.00 0.00 H new ATOM 8 N SER A 2 41.210 30.399 -36.374 1.00 0.00 N ATOM 9 CA SER A 2 41.171 28.962 -36.159 1.00 0.00 C ATOM 10 C SER A 2 42.583 28.380 -36.251 1.00 0.00 C ATOM 11 O SER A 2 43.377 28.800 -37.091 1.00 0.00 O ATOM 12 CB SER A 2 40.248 28.279 -37.170 1.00 0.00 C ATOM 13 OG SER A 2 40.529 28.684 -38.507 1.00 0.00 O ATOM 0 H SER A 2 42.145 30.786 -36.502 1.00 0.00 H new ATOM 0 HA SER A 2 40.773 28.776 -35.161 1.00 0.00 H new ATOM 0 HB2 SER A 2 40.357 27.198 -37.088 1.00 0.00 H new ATOM 0 HB3 SER A 2 39.211 28.514 -36.930 1.00 0.00 H new ATOM 0 HG SER A 2 39.920 28.225 -39.123 1.00 0.00 H new ATOM 19 N SER A 3 42.852 27.422 -35.377 1.00 0.00 N ATOM 20 CA SER A 3 44.155 26.779 -35.349 1.00 0.00 C ATOM 21 C SER A 3 44.107 25.538 -34.455 1.00 0.00 C ATOM 22 O SER A 3 43.134 25.328 -33.732 1.00 0.00 O ATOM 23 CB SER A 3 45.236 27.744 -34.860 1.00 0.00 C ATOM 24 OG SER A 3 45.236 27.871 -33.441 1.00 0.00 O ATOM 0 H SER A 3 42.190 27.075 -34.683 1.00 0.00 H new ATOM 0 HA SER A 3 44.409 26.478 -36.365 1.00 0.00 H new ATOM 0 HB2 SER A 3 46.213 27.393 -35.193 1.00 0.00 H new ATOM 0 HB3 SER A 3 45.079 28.723 -35.312 1.00 0.00 H new ATOM 0 HG SER A 3 45.941 28.494 -33.168 1.00 0.00 H new ATOM 30 N GLY A 4 45.169 24.750 -34.533 1.00 0.00 N ATOM 31 CA GLY A 4 45.260 23.536 -33.740 1.00 0.00 C ATOM 32 C GLY A 4 45.860 22.390 -34.558 1.00 0.00 C ATOM 33 O GLY A 4 45.740 22.367 -35.782 1.00 0.00 O ATOM 0 H GLY A 4 45.974 24.929 -35.133 1.00 0.00 H new ATOM 0 HA2 GLY A 4 45.874 23.719 -32.858 1.00 0.00 H new ATOM 0 HA3 GLY A 4 44.269 23.254 -33.385 1.00 0.00 H new ATOM 37 N SER A 5 46.492 21.468 -33.848 1.00 0.00 N ATOM 38 CA SER A 5 47.111 20.322 -34.492 1.00 0.00 C ATOM 39 C SER A 5 47.830 19.461 -33.452 1.00 0.00 C ATOM 40 O SER A 5 48.672 19.957 -32.705 1.00 0.00 O ATOM 41 CB SER A 5 48.090 20.765 -35.582 1.00 0.00 C ATOM 42 OG SER A 5 47.848 20.100 -36.819 1.00 0.00 O ATOM 0 H SER A 5 46.589 21.491 -32.833 1.00 0.00 H new ATOM 0 HA SER A 5 46.326 19.731 -34.964 1.00 0.00 H new ATOM 0 HB2 SER A 5 48.008 21.842 -35.727 1.00 0.00 H new ATOM 0 HB3 SER A 5 49.111 20.564 -35.256 1.00 0.00 H new ATOM 0 HG SER A 5 48.492 20.411 -37.489 1.00 0.00 H new ATOM 48 N SER A 6 47.472 18.186 -33.435 1.00 0.00 N ATOM 49 CA SER A 6 48.072 17.251 -32.499 1.00 0.00 C ATOM 50 C SER A 6 47.711 15.816 -32.887 1.00 0.00 C ATOM 51 O SER A 6 46.871 15.598 -33.759 1.00 0.00 O ATOM 52 CB SER A 6 47.622 17.542 -31.066 1.00 0.00 C ATOM 53 OG SER A 6 46.363 16.943 -30.769 1.00 0.00 O ATOM 0 H SER A 6 46.773 17.778 -34.055 1.00 0.00 H new ATOM 0 HA SER A 6 49.155 17.371 -32.543 1.00 0.00 H new ATOM 0 HB2 SER A 6 48.373 17.172 -30.368 1.00 0.00 H new ATOM 0 HB3 SER A 6 47.554 18.620 -30.919 1.00 0.00 H new ATOM 0 HG SER A 6 46.112 17.151 -29.845 1.00 0.00 H new ATOM 59 N GLY A 7 48.364 14.875 -32.222 1.00 0.00 N ATOM 60 CA GLY A 7 48.123 13.467 -32.486 1.00 0.00 C ATOM 61 C GLY A 7 49.062 12.585 -31.661 1.00 0.00 C ATOM 62 O GLY A 7 50.261 12.850 -31.584 1.00 0.00 O ATOM 0 H GLY A 7 49.060 15.060 -31.500 1.00 0.00 H new ATOM 0 HA2 GLY A 7 47.087 13.221 -32.250 1.00 0.00 H new ATOM 0 HA3 GLY A 7 48.266 13.263 -33.547 1.00 0.00 H new ATOM 66 N ARG A 8 48.482 11.554 -31.064 1.00 0.00 N ATOM 67 CA ARG A 8 49.252 10.631 -30.248 1.00 0.00 C ATOM 68 C ARG A 8 48.376 9.458 -29.803 1.00 0.00 C ATOM 69 O ARG A 8 47.200 9.640 -29.491 1.00 0.00 O ATOM 70 CB ARG A 8 49.820 11.332 -29.012 1.00 0.00 C ATOM 71 CG ARG A 8 51.247 11.822 -29.267 1.00 0.00 C ATOM 72 CD ARG A 8 51.337 13.343 -29.127 1.00 0.00 C ATOM 73 NE ARG A 8 51.886 13.697 -27.798 1.00 0.00 N ATOM 74 CZ ARG A 8 51.874 14.935 -27.286 1.00 0.00 C ATOM 75 NH1 ARG A 8 51.341 15.945 -27.987 1.00 0.00 N ATOM 76 NH2 ARG A 8 52.395 15.163 -26.072 1.00 0.00 N ATOM 0 H ARG A 8 47.487 11.338 -31.129 1.00 0.00 H new ATOM 0 HA ARG A 8 50.079 10.262 -30.855 1.00 0.00 H new ATOM 0 HB2 ARG A 8 49.184 12.176 -28.744 1.00 0.00 H new ATOM 0 HB3 ARG A 8 49.813 10.646 -28.165 1.00 0.00 H new ATOM 0 HG2 ARG A 8 51.930 11.347 -28.562 1.00 0.00 H new ATOM 0 HG3 ARG A 8 51.564 11.526 -30.267 1.00 0.00 H new ATOM 0 HD2 ARG A 8 51.972 13.752 -29.913 1.00 0.00 H new ATOM 0 HD3 ARG A 8 50.349 13.787 -29.252 1.00 0.00 H new ATOM 0 HE ARG A 8 52.299 12.952 -27.237 1.00 0.00 H new ATOM 0 HH11 ARG A 8 50.944 15.771 -28.911 1.00 0.00 H new ATOM 0 HH12 ARG A 8 51.332 16.887 -27.597 1.00 0.00 H new ATOM 0 HH21 ARG A 8 52.800 14.394 -25.538 1.00 0.00 H new ATOM 0 HH22 ARG A 8 52.386 16.105 -25.682 1.00 0.00 H new ATOM 90 N ILE A 9 48.983 8.281 -29.787 1.00 0.00 N ATOM 91 CA ILE A 9 48.273 7.078 -29.386 1.00 0.00 C ATOM 92 C ILE A 9 49.050 6.382 -28.266 1.00 0.00 C ATOM 93 O ILE A 9 50.254 6.588 -28.121 1.00 0.00 O ATOM 94 CB ILE A 9 48.006 6.183 -30.598 1.00 0.00 C ATOM 95 CG1 ILE A 9 49.317 5.720 -31.237 1.00 0.00 C ATOM 96 CG2 ILE A 9 47.093 6.884 -31.606 1.00 0.00 C ATOM 97 CD1 ILE A 9 49.529 4.220 -31.028 1.00 0.00 C ATOM 0 H ILE A 9 49.959 8.134 -30.045 1.00 0.00 H new ATOM 0 HA ILE A 9 47.292 7.331 -28.984 1.00 0.00 H new ATOM 0 HB ILE A 9 47.482 5.291 -30.255 1.00 0.00 H new ATOM 0 HG12 ILE A 9 49.305 5.944 -32.304 1.00 0.00 H new ATOM 0 HG13 ILE A 9 50.151 6.272 -30.805 1.00 0.00 H new ATOM 0 HG21 ILE A 9 46.919 6.227 -32.458 1.00 0.00 H new ATOM 0 HG22 ILE A 9 46.141 7.122 -31.131 1.00 0.00 H new ATOM 0 HG23 ILE A 9 47.567 7.804 -31.948 1.00 0.00 H new ATOM 0 HD11 ILE A 9 50.468 3.917 -31.492 1.00 0.00 H new ATOM 0 HD12 ILE A 9 49.565 4.003 -29.960 1.00 0.00 H new ATOM 0 HD13 ILE A 9 48.705 3.669 -31.483 1.00 0.00 H new ATOM 109 N GLY A 10 48.329 5.573 -27.504 1.00 0.00 N ATOM 110 CA GLY A 10 48.936 4.845 -26.402 1.00 0.00 C ATOM 111 C GLY A 10 48.435 5.371 -25.056 1.00 0.00 C ATOM 112 O GLY A 10 48.923 6.386 -24.562 1.00 0.00 O ATOM 0 H GLY A 10 47.330 5.405 -27.628 1.00 0.00 H new ATOM 0 HA2 GLY A 10 48.704 3.784 -26.491 1.00 0.00 H new ATOM 0 HA3 GLY A 10 50.021 4.940 -26.453 1.00 0.00 H new ATOM 116 N ASP A 11 47.468 4.656 -24.501 1.00 0.00 N ATOM 117 CA ASP A 11 46.895 5.038 -23.221 1.00 0.00 C ATOM 118 C ASP A 11 45.813 4.029 -22.830 1.00 0.00 C ATOM 119 O ASP A 11 45.313 3.290 -23.677 1.00 0.00 O ATOM 120 CB ASP A 11 46.246 6.421 -23.299 1.00 0.00 C ATOM 121 CG ASP A 11 45.129 6.554 -24.336 1.00 0.00 C ATOM 122 OD1 ASP A 11 45.474 6.792 -25.514 1.00 0.00 O ATOM 123 OD2 ASP A 11 43.956 6.416 -23.927 1.00 0.00 O ATOM 0 H ASP A 11 47.066 3.814 -24.914 1.00 0.00 H new ATOM 0 HA ASP A 11 47.698 5.058 -22.484 1.00 0.00 H new ATOM 0 HB2 ASP A 11 45.842 6.672 -22.318 1.00 0.00 H new ATOM 0 HB3 ASP A 11 47.019 7.156 -23.523 1.00 0.00 H new ATOM 128 N GLY A 12 45.483 4.031 -21.547 1.00 0.00 N ATOM 129 CA GLY A 12 44.469 3.126 -21.034 1.00 0.00 C ATOM 130 C GLY A 12 44.689 2.842 -19.546 1.00 0.00 C ATOM 131 O GLY A 12 45.608 2.111 -19.180 1.00 0.00 O ATOM 0 H GLY A 12 45.900 4.645 -20.847 1.00 0.00 H new ATOM 0 HA2 GLY A 12 43.480 3.560 -21.183 1.00 0.00 H new ATOM 0 HA3 GLY A 12 44.494 2.191 -21.594 1.00 0.00 H new ATOM 135 N SER A 13 43.831 3.435 -18.730 1.00 0.00 N ATOM 136 CA SER A 13 43.920 3.256 -17.291 1.00 0.00 C ATOM 137 C SER A 13 42.795 4.025 -16.597 1.00 0.00 C ATOM 138 O SER A 13 42.913 5.226 -16.360 1.00 0.00 O ATOM 139 CB SER A 13 45.281 3.713 -16.762 1.00 0.00 C ATOM 140 OG SER A 13 45.429 5.129 -16.824 1.00 0.00 O ATOM 0 H SER A 13 43.070 4.040 -19.038 1.00 0.00 H new ATOM 0 HA SER A 13 43.814 2.194 -17.072 1.00 0.00 H new ATOM 0 HB2 SER A 13 45.399 3.381 -15.731 1.00 0.00 H new ATOM 0 HB3 SER A 13 46.073 3.240 -17.342 1.00 0.00 H new ATOM 0 HG SER A 13 44.655 5.558 -16.402 1.00 0.00 H new ATOM 146 N PRO A 14 41.700 3.282 -16.281 1.00 0.00 N ATOM 147 CA PRO A 14 40.555 3.882 -15.618 1.00 0.00 C ATOM 148 C PRO A 14 40.849 4.139 -14.139 1.00 0.00 C ATOM 149 O PRO A 14 41.873 3.697 -13.621 1.00 0.00 O ATOM 150 CB PRO A 14 39.416 2.898 -15.835 1.00 0.00 C ATOM 151 CG PRO A 14 40.071 1.577 -16.204 1.00 0.00 C ATOM 152 CD PRO A 14 41.525 1.857 -16.546 1.00 0.00 C ATOM 0 HA PRO A 14 40.301 4.862 -16.022 1.00 0.00 H new ATOM 0 HB2 PRO A 14 38.811 2.796 -14.934 1.00 0.00 H new ATOM 0 HB3 PRO A 14 38.751 3.239 -16.628 1.00 0.00 H new ATOM 0 HG2 PRO A 14 40.003 0.872 -15.375 1.00 0.00 H new ATOM 0 HG3 PRO A 14 39.560 1.122 -17.052 1.00 0.00 H new ATOM 0 HD2 PRO A 14 42.198 1.255 -15.936 1.00 0.00 H new ATOM 0 HD3 PRO A 14 41.740 1.619 -17.588 1.00 0.00 H new ATOM 160 N SER A 15 39.933 4.852 -13.501 1.00 0.00 N ATOM 161 CA SER A 15 40.081 5.173 -12.092 1.00 0.00 C ATOM 162 C SER A 15 38.977 4.492 -11.281 1.00 0.00 C ATOM 163 O SER A 15 37.927 4.147 -11.822 1.00 0.00 O ATOM 164 CB SER A 15 40.050 6.686 -11.866 1.00 0.00 C ATOM 165 OG SER A 15 38.905 7.291 -12.458 1.00 0.00 O ATOM 0 H SER A 15 39.085 5.217 -13.934 1.00 0.00 H new ATOM 0 HA SER A 15 41.050 4.803 -11.757 1.00 0.00 H new ATOM 0 HB2 SER A 15 40.057 6.893 -10.796 1.00 0.00 H new ATOM 0 HB3 SER A 15 40.952 7.133 -12.283 1.00 0.00 H new ATOM 0 HG SER A 15 38.921 8.256 -12.290 1.00 0.00 H new ATOM 171 N HIS A 16 39.251 4.319 -9.997 1.00 0.00 N ATOM 172 CA HIS A 16 38.294 3.686 -9.105 1.00 0.00 C ATOM 173 C HIS A 16 37.353 4.745 -8.527 1.00 0.00 C ATOM 174 O HIS A 16 37.626 5.940 -8.619 1.00 0.00 O ATOM 175 CB HIS A 16 39.012 2.876 -8.024 1.00 0.00 C ATOM 176 CG HIS A 16 39.218 3.627 -6.730 1.00 0.00 C ATOM 177 ND1 HIS A 16 38.982 3.061 -5.489 1.00 0.00 N ATOM 178 CD2 HIS A 16 39.642 4.902 -6.498 1.00 0.00 C ATOM 179 CE1 HIS A 16 39.253 3.965 -4.559 1.00 0.00 C ATOM 180 NE2 HIS A 16 39.662 5.106 -5.186 1.00 0.00 N ATOM 0 H HIS A 16 40.123 4.606 -9.552 1.00 0.00 H new ATOM 0 HA HIS A 16 37.685 2.976 -9.664 1.00 0.00 H new ATOM 0 HB2 HIS A 16 38.438 1.972 -7.820 1.00 0.00 H new ATOM 0 HB3 HIS A 16 39.982 2.558 -8.406 1.00 0.00 H new ATOM 0 HD2 HIS A 16 39.915 5.624 -7.253 1.00 0.00 H new ATOM 0 HE1 HIS A 16 39.166 3.824 -3.492 1.00 0.00 H new ATOM 0 HE2 HIS A 16 39.938 5.972 -4.723 1.00 0.00 H new ATOM 188 N PRO A 17 36.235 4.254 -7.928 1.00 0.00 N ATOM 189 CA PRO A 17 35.252 5.144 -7.335 1.00 0.00 C ATOM 190 C PRO A 17 35.757 5.711 -6.006 1.00 0.00 C ATOM 191 O PRO A 17 36.551 5.073 -5.316 1.00 0.00 O ATOM 192 CB PRO A 17 33.998 4.300 -7.181 1.00 0.00 C ATOM 193 CG PRO A 17 34.458 2.853 -7.260 1.00 0.00 C ATOM 194 CD PRO A 17 35.878 2.844 -7.800 1.00 0.00 C ATOM 0 HA PRO A 17 35.053 6.020 -7.952 1.00 0.00 H new ATOM 0 HB2 PRO A 17 33.505 4.502 -6.230 1.00 0.00 H new ATOM 0 HB3 PRO A 17 33.277 4.524 -7.967 1.00 0.00 H new ATOM 0 HG2 PRO A 17 34.421 2.387 -6.276 1.00 0.00 H new ATOM 0 HG3 PRO A 17 33.799 2.278 -7.910 1.00 0.00 H new ATOM 0 HD2 PRO A 17 36.556 2.324 -7.123 1.00 0.00 H new ATOM 0 HD3 PRO A 17 35.933 2.333 -8.761 1.00 0.00 H new ATOM 202 N PRO A 18 35.263 6.936 -5.679 1.00 0.00 N ATOM 203 CA PRO A 18 35.656 7.596 -4.446 1.00 0.00 C ATOM 204 C PRO A 18 34.967 6.957 -3.238 1.00 0.00 C ATOM 205 O PRO A 18 34.067 6.133 -3.397 1.00 0.00 O ATOM 206 CB PRO A 18 35.277 9.055 -4.643 1.00 0.00 C ATOM 207 CG PRO A 18 34.270 9.074 -5.781 1.00 0.00 C ATOM 208 CD PRO A 18 34.322 7.721 -6.472 1.00 0.00 C ATOM 0 HA PRO A 18 36.722 7.499 -4.238 1.00 0.00 H new ATOM 0 HB2 PRO A 18 34.846 9.473 -3.733 1.00 0.00 H new ATOM 0 HB3 PRO A 18 36.153 9.657 -4.886 1.00 0.00 H new ATOM 0 HG2 PRO A 18 33.268 9.270 -5.400 1.00 0.00 H new ATOM 0 HG3 PRO A 18 34.505 9.872 -6.486 1.00 0.00 H new ATOM 0 HD2 PRO A 18 33.339 7.252 -6.498 1.00 0.00 H new ATOM 0 HD3 PRO A 18 34.658 7.816 -7.505 1.00 0.00 H new ATOM 216 N ILE A 19 35.415 7.362 -2.059 1.00 0.00 N ATOM 217 CA ILE A 19 34.852 6.839 -0.825 1.00 0.00 C ATOM 218 C ILE A 19 33.594 7.633 -0.467 1.00 0.00 C ATOM 219 O ILE A 19 33.606 8.863 -0.485 1.00 0.00 O ATOM 220 CB ILE A 19 35.908 6.827 0.282 1.00 0.00 C ATOM 221 CG1 ILE A 19 37.175 6.102 -0.176 1.00 0.00 C ATOM 222 CG2 ILE A 19 35.342 6.233 1.573 1.00 0.00 C ATOM 223 CD1 ILE A 19 36.831 4.779 -0.864 1.00 0.00 C ATOM 0 H ILE A 19 36.161 8.046 -1.932 1.00 0.00 H new ATOM 0 HA ILE A 19 34.547 5.800 -0.955 1.00 0.00 H new ATOM 0 HB ILE A 19 36.188 7.858 0.498 1.00 0.00 H new ATOM 0 HG12 ILE A 19 37.735 6.738 -0.862 1.00 0.00 H new ATOM 0 HG13 ILE A 19 37.820 5.913 0.682 1.00 0.00 H new ATOM 0 HG21 ILE A 19 36.113 6.236 2.344 1.00 0.00 H new ATOM 0 HG22 ILE A 19 34.493 6.830 1.907 1.00 0.00 H new ATOM 0 HG23 ILE A 19 35.016 5.209 1.390 1.00 0.00 H new ATOM 0 HD11 ILE A 19 37.749 4.284 -1.180 1.00 0.00 H new ATOM 0 HD12 ILE A 19 36.293 4.136 -0.168 1.00 0.00 H new ATOM 0 HD13 ILE A 19 36.206 4.974 -1.735 1.00 0.00 H new ATOM 235 N LEU A 20 32.539 6.897 -0.150 1.00 0.00 N ATOM 236 CA LEU A 20 31.276 7.517 0.213 1.00 0.00 C ATOM 237 C LEU A 20 30.529 6.608 1.191 1.00 0.00 C ATOM 238 O LEU A 20 30.008 5.565 0.800 1.00 0.00 O ATOM 239 CB LEU A 20 30.471 7.864 -1.041 1.00 0.00 C ATOM 240 CG LEU A 20 29.796 9.237 -1.046 1.00 0.00 C ATOM 241 CD1 LEU A 20 30.496 10.189 -2.018 1.00 0.00 C ATOM 242 CD2 LEU A 20 28.300 9.112 -1.344 1.00 0.00 C ATOM 0 H LEU A 20 32.533 5.877 -0.137 1.00 0.00 H new ATOM 0 HA LEU A 20 31.449 8.463 0.726 1.00 0.00 H new ATOM 0 HB2 LEU A 20 31.135 7.805 -1.903 1.00 0.00 H new ATOM 0 HB3 LEU A 20 29.703 7.103 -1.178 1.00 0.00 H new ATOM 0 HG LEU A 20 29.891 9.667 -0.049 1.00 0.00 H new ATOM 0 HD11 LEU A 20 29.996 11.158 -2.002 1.00 0.00 H new ATOM 0 HD12 LEU A 20 31.537 10.313 -1.720 1.00 0.00 H new ATOM 0 HD13 LEU A 20 30.454 9.776 -3.026 1.00 0.00 H new ATOM 0 HD21 LEU A 20 27.845 10.102 -1.342 1.00 0.00 H new ATOM 0 HD22 LEU A 20 28.161 8.651 -2.322 1.00 0.00 H new ATOM 0 HD23 LEU A 20 27.827 8.493 -0.581 1.00 0.00 H new ATOM 254 N GLU A 21 30.501 7.038 2.444 1.00 0.00 N ATOM 255 CA GLU A 21 29.826 6.276 3.481 1.00 0.00 C ATOM 256 C GLU A 21 28.312 6.471 3.383 1.00 0.00 C ATOM 257 O GLU A 21 27.735 7.266 4.124 1.00 0.00 O ATOM 258 CB GLU A 21 30.340 6.665 4.869 1.00 0.00 C ATOM 259 CG GLU A 21 31.359 5.645 5.382 1.00 0.00 C ATOM 260 CD GLU A 21 31.718 5.917 6.844 1.00 0.00 C ATOM 261 OE1 GLU A 21 32.630 6.745 7.060 1.00 0.00 O ATOM 262 OE2 GLU A 21 31.074 5.291 7.713 1.00 0.00 O ATOM 0 H GLU A 21 30.935 7.904 2.764 1.00 0.00 H new ATOM 0 HA GLU A 21 30.047 5.219 3.330 1.00 0.00 H new ATOM 0 HB2 GLU A 21 30.798 7.653 4.827 1.00 0.00 H new ATOM 0 HB3 GLU A 21 29.504 6.731 5.565 1.00 0.00 H new ATOM 0 HG2 GLU A 21 30.952 4.639 5.285 1.00 0.00 H new ATOM 0 HG3 GLU A 21 32.259 5.685 4.769 1.00 0.00 H new ATOM 269 N ARG A 22 27.710 5.732 2.463 1.00 0.00 N ATOM 270 CA ARG A 22 26.274 5.813 2.258 1.00 0.00 C ATOM 271 C ARG A 22 25.871 5.030 1.007 1.00 0.00 C ATOM 272 O ARG A 22 26.128 5.467 -0.113 1.00 0.00 O ATOM 273 CB ARG A 22 25.821 7.267 2.109 1.00 0.00 C ATOM 274 CG ARG A 22 25.129 7.759 3.383 1.00 0.00 C ATOM 275 CD ARG A 22 25.388 9.250 3.606 1.00 0.00 C ATOM 276 NE ARG A 22 24.303 9.834 4.426 1.00 0.00 N ATOM 277 CZ ARG A 22 24.265 9.788 5.765 1.00 0.00 C ATOM 278 NH1 ARG A 22 25.251 9.184 6.442 1.00 0.00 N ATOM 279 NH2 ARG A 22 23.241 10.345 6.426 1.00 0.00 N ATOM 0 H ARG A 22 28.191 5.074 1.850 1.00 0.00 H new ATOM 0 HA ARG A 22 25.789 5.380 3.133 1.00 0.00 H new ATOM 0 HB2 ARG A 22 26.682 7.899 1.891 1.00 0.00 H new ATOM 0 HB3 ARG A 22 25.139 7.354 1.263 1.00 0.00 H new ATOM 0 HG2 ARG A 22 24.056 7.579 3.311 1.00 0.00 H new ATOM 0 HG3 ARG A 22 25.491 7.191 4.240 1.00 0.00 H new ATOM 0 HD2 ARG A 22 26.347 9.391 4.104 1.00 0.00 H new ATOM 0 HD3 ARG A 22 25.448 9.765 2.647 1.00 0.00 H new ATOM 0 HE ARG A 22 23.536 10.301 3.942 1.00 0.00 H new ATOM 0 HH11 ARG A 22 26.030 8.760 5.938 1.00 0.00 H new ATOM 0 HH12 ARG A 22 25.223 9.149 7.461 1.00 0.00 H new ATOM 0 HH21 ARG A 22 22.490 10.804 5.910 1.00 0.00 H new ATOM 0 HH22 ARG A 22 23.212 10.310 7.445 1.00 0.00 H new ATOM 293 N THR A 23 25.245 3.886 1.241 1.00 0.00 N ATOM 294 CA THR A 23 24.804 3.037 0.147 1.00 0.00 C ATOM 295 C THR A 23 24.078 3.868 -0.913 1.00 0.00 C ATOM 296 O THR A 23 24.606 4.092 -2.001 1.00 0.00 O ATOM 297 CB THR A 23 23.943 1.917 0.735 1.00 0.00 C ATOM 298 OG1 THR A 23 24.871 0.866 0.993 1.00 0.00 O ATOM 299 CG2 THR A 23 22.979 1.319 -0.291 1.00 0.00 C ATOM 0 H THR A 23 25.033 3.527 2.172 1.00 0.00 H new ATOM 0 HA THR A 23 25.651 2.581 -0.366 1.00 0.00 H new ATOM 0 HB THR A 23 23.377 2.302 1.583 1.00 0.00 H new ATOM 0 HG1 THR A 23 24.398 0.099 1.378 1.00 0.00 H new ATOM 0 HG21 THR A 23 22.392 0.529 0.178 1.00 0.00 H new ATOM 0 HG22 THR A 23 22.311 2.097 -0.659 1.00 0.00 H new ATOM 0 HG23 THR A 23 23.546 0.904 -1.124 1.00 0.00 H new ATOM 307 N LEU A 24 22.877 4.303 -0.558 1.00 0.00 N ATOM 308 CA LEU A 24 22.074 5.104 -1.465 1.00 0.00 C ATOM 309 C LEU A 24 21.490 6.296 -0.705 1.00 0.00 C ATOM 310 O LEU A 24 21.973 6.648 0.371 1.00 0.00 O ATOM 311 CB LEU A 24 21.018 4.237 -2.154 1.00 0.00 C ATOM 312 CG LEU A 24 21.150 4.099 -3.672 1.00 0.00 C ATOM 313 CD1 LEU A 24 20.957 5.449 -4.365 1.00 0.00 C ATOM 314 CD2 LEU A 24 22.481 3.446 -4.049 1.00 0.00 C ATOM 0 H LEU A 24 22.442 4.115 0.345 1.00 0.00 H new ATOM 0 HA LEU A 24 22.693 5.508 -2.266 1.00 0.00 H new ATOM 0 HB2 LEU A 24 21.052 3.240 -1.714 1.00 0.00 H new ATOM 0 HB3 LEU A 24 20.035 4.651 -1.931 1.00 0.00 H new ATOM 0 HG LEU A 24 20.357 3.440 -4.025 1.00 0.00 H new ATOM 0 HD11 LEU A 24 21.056 5.322 -5.443 1.00 0.00 H new ATOM 0 HD12 LEU A 24 19.965 5.838 -4.135 1.00 0.00 H new ATOM 0 HD13 LEU A 24 21.712 6.151 -4.011 1.00 0.00 H new ATOM 0 HD21 LEU A 24 22.550 3.360 -5.133 1.00 0.00 H new ATOM 0 HD22 LEU A 24 23.304 4.059 -3.681 1.00 0.00 H new ATOM 0 HD23 LEU A 24 22.539 2.454 -3.602 1.00 0.00 H new ATOM 326 N ASP A 25 20.458 6.885 -1.293 1.00 0.00 N ATOM 327 CA ASP A 25 19.803 8.030 -0.684 1.00 0.00 C ATOM 328 C ASP A 25 18.599 8.436 -1.535 1.00 0.00 C ATOM 329 O ASP A 25 18.436 7.955 -2.656 1.00 0.00 O ATOM 330 CB ASP A 25 20.751 9.229 -0.604 1.00 0.00 C ATOM 331 CG ASP A 25 21.445 9.416 0.746 1.00 0.00 C ATOM 332 OD1 ASP A 25 20.720 9.714 1.720 1.00 0.00 O ATOM 333 OD2 ASP A 25 22.684 9.257 0.774 1.00 0.00 O ATOM 0 H ASP A 25 20.060 6.590 -2.185 1.00 0.00 H new ATOM 0 HA ASP A 25 19.495 7.746 0.322 1.00 0.00 H new ATOM 0 HB2 ASP A 25 21.513 9.122 -1.376 1.00 0.00 H new ATOM 0 HB3 ASP A 25 20.189 10.134 -0.835 1.00 0.00 H new ATOM 338 N ASP A 26 17.784 9.315 -0.971 1.00 0.00 N ATOM 339 CA ASP A 26 16.599 9.791 -1.664 1.00 0.00 C ATOM 340 C ASP A 26 15.562 8.667 -1.721 1.00 0.00 C ATOM 341 O ASP A 26 15.898 7.497 -1.546 1.00 0.00 O ATOM 342 CB ASP A 26 16.929 10.202 -3.100 1.00 0.00 C ATOM 343 CG ASP A 26 18.402 10.528 -3.358 1.00 0.00 C ATOM 344 OD1 ASP A 26 18.925 11.401 -2.632 1.00 0.00 O ATOM 345 OD2 ASP A 26 18.971 9.896 -4.274 1.00 0.00 O ATOM 0 H ASP A 26 17.921 9.710 -0.041 1.00 0.00 H new ATOM 0 HA ASP A 26 16.214 10.654 -1.121 1.00 0.00 H new ATOM 0 HB2 ASP A 26 16.628 9.397 -3.770 1.00 0.00 H new ATOM 0 HB3 ASP A 26 16.329 11.074 -3.359 1.00 0.00 H new ATOM 350 N VAL A 27 14.321 9.063 -1.965 1.00 0.00 N ATOM 351 CA VAL A 27 13.232 8.104 -2.047 1.00 0.00 C ATOM 352 C VAL A 27 13.120 7.588 -3.483 1.00 0.00 C ATOM 353 O VAL A 27 13.617 8.219 -4.414 1.00 0.00 O ATOM 354 CB VAL A 27 11.937 8.738 -1.536 1.00 0.00 C ATOM 355 CG1 VAL A 27 11.918 8.791 -0.007 1.00 0.00 C ATOM 356 CG2 VAL A 27 11.735 10.132 -2.136 1.00 0.00 C ATOM 0 H VAL A 27 14.046 10.035 -2.109 1.00 0.00 H new ATOM 0 HA VAL A 27 13.431 7.244 -1.407 1.00 0.00 H new ATOM 0 HB VAL A 27 11.107 8.110 -1.859 1.00 0.00 H new ATOM 0 HG11 VAL A 27 10.987 9.246 0.330 1.00 0.00 H new ATOM 0 HG12 VAL A 27 11.993 7.780 0.393 1.00 0.00 H new ATOM 0 HG13 VAL A 27 12.761 9.385 0.347 1.00 0.00 H new ATOM 0 HG21 VAL A 27 10.807 10.561 -1.757 1.00 0.00 H new ATOM 0 HG22 VAL A 27 12.571 10.773 -1.857 1.00 0.00 H new ATOM 0 HG23 VAL A 27 11.682 10.056 -3.222 1.00 0.00 H new ATOM 366 N PRO A 28 12.445 6.415 -3.620 1.00 0.00 N ATOM 367 CA PRO A 28 12.261 5.807 -4.927 1.00 0.00 C ATOM 368 C PRO A 28 11.197 6.553 -5.734 1.00 0.00 C ATOM 369 O PRO A 28 10.450 7.362 -5.185 1.00 0.00 O ATOM 370 CB PRO A 28 11.883 4.363 -4.639 1.00 0.00 C ATOM 371 CG PRO A 28 11.418 4.334 -3.192 1.00 0.00 C ATOM 372 CD PRO A 28 11.843 5.640 -2.540 1.00 0.00 C ATOM 0 HA PRO A 28 13.159 5.855 -5.543 1.00 0.00 H new ATOM 0 HB2 PRO A 28 11.093 4.025 -5.310 1.00 0.00 H new ATOM 0 HB3 PRO A 28 12.734 3.699 -4.789 1.00 0.00 H new ATOM 0 HG2 PRO A 28 10.336 4.216 -3.141 1.00 0.00 H new ATOM 0 HG3 PRO A 28 11.856 3.485 -2.667 1.00 0.00 H new ATOM 0 HD2 PRO A 28 10.990 6.162 -2.106 1.00 0.00 H new ATOM 0 HD3 PRO A 28 12.555 5.466 -1.733 1.00 0.00 H new ATOM 380 N GLY A 29 11.162 6.255 -7.025 1.00 0.00 N ATOM 381 CA GLY A 29 10.202 6.888 -7.913 1.00 0.00 C ATOM 382 C GLY A 29 8.872 6.131 -7.912 1.00 0.00 C ATOM 383 O GLY A 29 8.617 5.319 -7.025 1.00 0.00 O ATOM 0 H GLY A 29 11.783 5.584 -7.477 1.00 0.00 H new ATOM 0 HA2 GLY A 29 10.038 7.919 -7.601 1.00 0.00 H new ATOM 0 HA3 GLY A 29 10.605 6.922 -8.925 1.00 0.00 H new ATOM 387 N PRO A 30 8.039 6.433 -8.944 1.00 0.00 N ATOM 388 CA PRO A 30 6.742 5.790 -9.070 1.00 0.00 C ATOM 389 C PRO A 30 6.890 4.350 -9.565 1.00 0.00 C ATOM 390 O PRO A 30 7.642 4.085 -10.502 1.00 0.00 O ATOM 391 CB PRO A 30 5.958 6.670 -10.030 1.00 0.00 C ATOM 392 CG PRO A 30 6.992 7.510 -10.764 1.00 0.00 C ATOM 393 CD PRO A 30 8.308 7.390 -10.013 1.00 0.00 C ATOM 0 HA PRO A 30 6.222 5.702 -8.116 1.00 0.00 H new ATOM 0 HB2 PRO A 30 5.378 6.066 -10.728 1.00 0.00 H new ATOM 0 HB3 PRO A 30 5.252 7.302 -9.492 1.00 0.00 H new ATOM 0 HG2 PRO A 30 7.106 7.164 -11.791 1.00 0.00 H new ATOM 0 HG3 PRO A 30 6.673 8.551 -10.812 1.00 0.00 H new ATOM 0 HD2 PRO A 30 9.106 7.039 -10.667 1.00 0.00 H new ATOM 0 HD3 PRO A 30 8.624 8.353 -9.612 1.00 0.00 H new ATOM 401 N PRO A 31 6.141 3.432 -8.896 1.00 0.00 N ATOM 402 CA PRO A 31 6.181 2.026 -9.258 1.00 0.00 C ATOM 403 C PRO A 31 5.403 1.770 -10.550 1.00 0.00 C ATOM 404 O PRO A 31 4.175 1.825 -10.561 1.00 0.00 O ATOM 405 CB PRO A 31 5.599 1.294 -8.060 1.00 0.00 C ATOM 406 CG PRO A 31 4.830 2.339 -7.267 1.00 0.00 C ATOM 407 CD PRO A 31 5.239 3.709 -7.782 1.00 0.00 C ATOM 0 HA PRO A 31 7.191 1.675 -9.470 1.00 0.00 H new ATOM 0 HB2 PRO A 31 4.943 0.484 -8.378 1.00 0.00 H new ATOM 0 HB3 PRO A 31 6.387 0.846 -7.455 1.00 0.00 H new ATOM 0 HG2 PRO A 31 3.756 2.192 -7.383 1.00 0.00 H new ATOM 0 HG3 PRO A 31 5.051 2.250 -6.203 1.00 0.00 H new ATOM 0 HD2 PRO A 31 4.373 4.284 -8.108 1.00 0.00 H new ATOM 0 HD3 PRO A 31 5.735 4.292 -7.006 1.00 0.00 H new ATOM 415 N MET A 32 6.151 1.494 -11.609 1.00 0.00 N ATOM 416 CA MET A 32 5.547 1.229 -12.904 1.00 0.00 C ATOM 417 C MET A 32 5.293 -0.267 -13.094 1.00 0.00 C ATOM 418 O MET A 32 5.850 -1.092 -12.372 1.00 0.00 O ATOM 419 CB MET A 32 6.473 1.735 -14.012 1.00 0.00 C ATOM 420 CG MET A 32 7.869 1.122 -13.883 1.00 0.00 C ATOM 421 SD MET A 32 8.713 1.191 -15.454 1.00 0.00 S ATOM 422 CE MET A 32 10.341 0.654 -14.954 1.00 0.00 C ATOM 0 H MET A 32 7.170 1.448 -11.596 1.00 0.00 H new ATOM 0 HA MET A 32 4.591 1.750 -12.952 1.00 0.00 H new ATOM 0 HB2 MET A 32 6.051 1.486 -14.986 1.00 0.00 H new ATOM 0 HB3 MET A 32 6.543 2.822 -13.964 1.00 0.00 H new ATOM 0 HG2 MET A 32 8.443 1.660 -13.128 1.00 0.00 H new ATOM 0 HG3 MET A 32 7.792 0.088 -13.547 1.00 0.00 H new ATOM 0 HE1 MET A 32 11.001 0.639 -15.821 1.00 0.00 H new ATOM 0 HE2 MET A 32 10.738 1.342 -14.207 1.00 0.00 H new ATOM 0 HE3 MET A 32 10.279 -0.347 -14.528 1.00 0.00 H new ATOM 432 N GLY A 33 4.450 -0.572 -14.070 1.00 0.00 N ATOM 433 CA GLY A 33 4.115 -1.955 -14.364 1.00 0.00 C ATOM 434 C GLY A 33 2.904 -2.411 -13.548 1.00 0.00 C ATOM 435 O GLY A 33 2.856 -3.550 -13.084 1.00 0.00 O ATOM 0 H GLY A 33 3.989 0.115 -14.667 1.00 0.00 H new ATOM 0 HA2 GLY A 33 3.903 -2.063 -15.428 1.00 0.00 H new ATOM 0 HA3 GLY A 33 4.969 -2.595 -14.142 1.00 0.00 H new ATOM 439 N ILE A 34 1.954 -1.500 -13.398 1.00 0.00 N ATOM 440 CA ILE A 34 0.746 -1.794 -12.646 1.00 0.00 C ATOM 441 C ILE A 34 -0.300 -2.398 -13.585 1.00 0.00 C ATOM 442 O ILE A 34 -0.909 -1.685 -14.381 1.00 0.00 O ATOM 443 CB ILE A 34 0.260 -0.548 -11.903 1.00 0.00 C ATOM 444 CG1 ILE A 34 1.440 0.298 -11.421 1.00 0.00 C ATOM 445 CG2 ILE A 34 -0.682 -0.924 -10.758 1.00 0.00 C ATOM 446 CD1 ILE A 34 2.394 -0.532 -10.560 1.00 0.00 C ATOM 0 H ILE A 34 1.996 -0.557 -13.785 1.00 0.00 H new ATOM 0 HA ILE A 34 0.949 -2.537 -11.875 1.00 0.00 H new ATOM 0 HB ILE A 34 -0.311 0.064 -12.601 1.00 0.00 H new ATOM 0 HG12 ILE A 34 1.977 0.702 -12.279 1.00 0.00 H new ATOM 0 HG13 ILE A 34 1.072 1.148 -10.846 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -1.012 -0.020 -10.247 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -1.548 -1.452 -11.158 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -0.158 -1.569 -10.052 1.00 0.00 H new ATOM 0 HD11 ILE A 34 3.224 0.093 -10.230 1.00 0.00 H new ATOM 0 HD12 ILE A 34 1.860 -0.914 -9.690 1.00 0.00 H new ATOM 0 HD13 ILE A 34 2.779 -1.367 -11.145 1.00 0.00 H new ATOM 458 N LEU A 35 -0.476 -3.705 -13.461 1.00 0.00 N ATOM 459 CA LEU A 35 -1.438 -4.412 -14.289 1.00 0.00 C ATOM 460 C LEU A 35 -2.350 -5.256 -13.396 1.00 0.00 C ATOM 461 O LEU A 35 -1.989 -5.583 -12.267 1.00 0.00 O ATOM 462 CB LEU A 35 -0.721 -5.220 -15.373 1.00 0.00 C ATOM 463 CG LEU A 35 0.135 -4.415 -16.353 1.00 0.00 C ATOM 464 CD1 LEU A 35 -0.708 -3.370 -17.087 1.00 0.00 C ATOM 465 CD2 LEU A 35 1.337 -3.787 -15.643 1.00 0.00 C ATOM 0 H LEU A 35 0.031 -4.293 -12.800 1.00 0.00 H new ATOM 0 HA LEU A 35 -2.076 -3.705 -14.820 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -0.084 -5.958 -14.886 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -1.469 -5.771 -15.943 1.00 0.00 H new ATOM 0 HG LEU A 35 0.527 -5.099 -17.106 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -0.075 -2.812 -17.777 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -1.501 -3.868 -17.644 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -1.149 -2.684 -16.363 1.00 0.00 H new ATOM 0 HD21 LEU A 35 1.929 -3.220 -16.362 1.00 0.00 H new ATOM 0 HD22 LEU A 35 0.987 -3.120 -14.855 1.00 0.00 H new ATOM 0 HD23 LEU A 35 1.953 -4.573 -15.205 1.00 0.00 H new ATOM 477 N PHE A 36 -3.515 -5.584 -13.936 1.00 0.00 N ATOM 478 CA PHE A 36 -4.482 -6.383 -13.203 1.00 0.00 C ATOM 479 C PHE A 36 -4.815 -7.671 -13.958 1.00 0.00 C ATOM 480 O PHE A 36 -5.706 -7.685 -14.806 1.00 0.00 O ATOM 481 CB PHE A 36 -5.751 -5.540 -13.071 1.00 0.00 C ATOM 482 CG PHE A 36 -5.639 -4.399 -12.057 1.00 0.00 C ATOM 483 CD1 PHE A 36 -5.193 -3.177 -12.455 1.00 0.00 C ATOM 484 CD2 PHE A 36 -5.985 -4.607 -10.759 1.00 0.00 C ATOM 485 CE1 PHE A 36 -5.089 -2.119 -11.514 1.00 0.00 C ATOM 486 CE2 PHE A 36 -5.881 -3.549 -9.818 1.00 0.00 C ATOM 487 CZ PHE A 36 -5.435 -2.327 -10.216 1.00 0.00 C ATOM 0 H PHE A 36 -3.811 -5.311 -14.873 1.00 0.00 H new ATOM 0 HA PHE A 36 -4.075 -6.659 -12.231 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -6.000 -5.122 -14.046 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -6.577 -6.189 -12.782 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -4.918 -3.012 -13.486 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -6.339 -5.577 -10.443 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -4.735 -1.149 -11.830 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -6.156 -3.714 -8.787 1.00 0.00 H new ATOM 0 HZ PHE A 36 -5.356 -1.522 -9.501 1.00 0.00 H new ATOM 497 N PRO A 37 -4.061 -8.750 -13.616 1.00 0.00 N ATOM 498 CA PRO A 37 -4.267 -10.039 -14.252 1.00 0.00 C ATOM 499 C PRO A 37 -5.535 -10.715 -13.725 1.00 0.00 C ATOM 500 O PRO A 37 -6.381 -11.148 -14.505 1.00 0.00 O ATOM 501 CB PRO A 37 -3.004 -10.832 -13.955 1.00 0.00 C ATOM 502 CG PRO A 37 -2.341 -10.132 -12.779 1.00 0.00 C ATOM 503 CD PRO A 37 -2.996 -8.770 -12.617 1.00 0.00 C ATOM 0 HA PRO A 37 -4.425 -9.956 -15.327 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -3.241 -11.867 -13.710 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -2.343 -10.852 -14.821 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -2.456 -10.722 -11.870 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -1.271 -10.022 -12.954 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -3.394 -8.639 -11.611 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -2.281 -7.964 -12.784 1.00 0.00 H new ATOM 511 N GLU A 38 -5.625 -10.783 -12.405 1.00 0.00 N ATOM 512 CA GLU A 38 -6.775 -11.398 -11.765 1.00 0.00 C ATOM 513 C GLU A 38 -7.513 -10.373 -10.900 1.00 0.00 C ATOM 514 O GLU A 38 -6.986 -9.918 -9.886 1.00 0.00 O ATOM 515 CB GLU A 38 -6.357 -12.614 -10.936 1.00 0.00 C ATOM 516 CG GLU A 38 -7.560 -13.232 -10.223 1.00 0.00 C ATOM 517 CD GLU A 38 -7.137 -14.431 -9.371 1.00 0.00 C ATOM 518 OE1 GLU A 38 -6.156 -15.094 -9.773 1.00 0.00 O ATOM 519 OE2 GLU A 38 -7.803 -14.657 -8.339 1.00 0.00 O ATOM 0 H GLU A 38 -4.921 -10.422 -11.761 1.00 0.00 H new ATOM 0 HA GLU A 38 -7.455 -11.746 -12.543 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -5.892 -13.358 -11.584 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -5.608 -12.318 -10.202 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -8.037 -12.483 -9.591 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -8.300 -13.547 -10.958 1.00 0.00 H new ATOM 526 N VAL A 39 -8.720 -10.040 -11.333 1.00 0.00 N ATOM 527 CA VAL A 39 -9.535 -9.077 -10.612 1.00 0.00 C ATOM 528 C VAL A 39 -10.992 -9.543 -10.619 1.00 0.00 C ATOM 529 O VAL A 39 -11.617 -9.624 -11.675 1.00 0.00 O ATOM 530 CB VAL A 39 -9.350 -7.682 -11.211 1.00 0.00 C ATOM 531 CG1 VAL A 39 -8.926 -7.767 -12.679 1.00 0.00 C ATOM 532 CG2 VAL A 39 -10.621 -6.845 -11.055 1.00 0.00 C ATOM 0 H VAL A 39 -9.153 -10.420 -12.174 1.00 0.00 H new ATOM 0 HA VAL A 39 -9.219 -9.013 -9.571 1.00 0.00 H new ATOM 0 HB VAL A 39 -8.552 -7.184 -10.660 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -8.801 -6.761 -13.081 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -7.982 -8.307 -12.754 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -9.692 -8.293 -13.249 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -10.462 -5.858 -11.489 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -11.447 -7.338 -11.568 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -10.861 -6.742 -9.997 1.00 0.00 H new ATOM 542 N ARG A 40 -11.492 -9.836 -9.427 1.00 0.00 N ATOM 543 CA ARG A 40 -12.864 -10.291 -9.283 1.00 0.00 C ATOM 544 C ARG A 40 -13.740 -9.168 -8.723 1.00 0.00 C ATOM 545 O ARG A 40 -13.356 -8.000 -8.761 1.00 0.00 O ATOM 546 CB ARG A 40 -12.947 -11.504 -8.354 1.00 0.00 C ATOM 547 CG ARG A 40 -11.715 -12.398 -8.507 1.00 0.00 C ATOM 548 CD ARG A 40 -11.878 -13.697 -7.716 1.00 0.00 C ATOM 549 NE ARG A 40 -12.498 -14.735 -8.570 1.00 0.00 N ATOM 550 CZ ARG A 40 -12.853 -15.952 -8.136 1.00 0.00 C ATOM 551 NH1 ARG A 40 -12.651 -16.291 -6.856 1.00 0.00 N ATOM 552 NH2 ARG A 40 -13.409 -16.829 -8.982 1.00 0.00 N ATOM 0 H ARG A 40 -10.971 -9.767 -8.553 1.00 0.00 H new ATOM 0 HA ARG A 40 -13.223 -10.578 -10.271 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -13.032 -11.169 -7.320 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -13.847 -12.077 -8.578 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -11.556 -12.627 -9.561 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -10.830 -11.865 -8.160 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -10.907 -14.040 -7.360 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -12.496 -13.521 -6.836 1.00 0.00 H new ATOM 0 HE ARG A 40 -12.666 -14.510 -9.551 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -12.227 -15.623 -6.212 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -12.921 -17.217 -6.525 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -13.562 -16.570 -9.957 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -13.679 -17.755 -8.652 1.00 0.00 H new ATOM 566 N THR A 41 -14.899 -9.561 -8.217 1.00 0.00 N ATOM 567 CA THR A 41 -15.833 -8.602 -7.651 1.00 0.00 C ATOM 568 C THR A 41 -15.310 -8.077 -6.312 1.00 0.00 C ATOM 569 O THR A 41 -14.689 -7.016 -6.257 1.00 0.00 O ATOM 570 CB THR A 41 -17.201 -9.279 -7.546 1.00 0.00 C ATOM 571 OG1 THR A 41 -16.893 -10.657 -7.356 1.00 0.00 O ATOM 572 CG2 THR A 41 -17.972 -9.248 -8.867 1.00 0.00 C ATOM 0 H THR A 41 -15.213 -10.531 -8.187 1.00 0.00 H new ATOM 0 HA THR A 41 -15.937 -7.726 -8.291 1.00 0.00 H new ATOM 0 HB THR A 41 -17.790 -8.789 -6.770 1.00 0.00 H new ATOM 0 HG1 THR A 41 -17.724 -11.170 -7.276 1.00 0.00 H new ATOM 0 HG21 THR A 41 -18.935 -9.741 -8.738 1.00 0.00 H new ATOM 0 HG22 THR A 41 -18.132 -8.213 -9.171 1.00 0.00 H new ATOM 0 HG23 THR A 41 -17.399 -9.767 -9.635 1.00 0.00 H new ATOM 580 N THR A 42 -15.581 -8.843 -5.266 1.00 0.00 N ATOM 581 CA THR A 42 -15.147 -8.467 -3.931 1.00 0.00 C ATOM 582 C THR A 42 -13.750 -9.025 -3.649 1.00 0.00 C ATOM 583 O THR A 42 -13.399 -9.277 -2.497 1.00 0.00 O ATOM 584 CB THR A 42 -16.205 -8.948 -2.937 1.00 0.00 C ATOM 585 OG1 THR A 42 -16.213 -10.364 -3.096 1.00 0.00 O ATOM 586 CG2 THR A 42 -17.619 -8.520 -3.334 1.00 0.00 C ATOM 0 H THR A 42 -16.096 -9.722 -5.316 1.00 0.00 H new ATOM 0 HA THR A 42 -15.057 -7.385 -3.834 1.00 0.00 H new ATOM 0 HB THR A 42 -15.974 -8.560 -1.945 1.00 0.00 H new ATOM 0 HG1 THR A 42 -16.871 -10.758 -2.486 1.00 0.00 H new ATOM 0 HG21 THR A 42 -18.331 -8.887 -2.595 1.00 0.00 H new ATOM 0 HG22 THR A 42 -17.671 -7.432 -3.379 1.00 0.00 H new ATOM 0 HG23 THR A 42 -17.864 -8.935 -4.312 1.00 0.00 H new ATOM 594 N SER A 43 -12.991 -9.201 -4.720 1.00 0.00 N ATOM 595 CA SER A 43 -11.640 -9.724 -4.602 1.00 0.00 C ATOM 596 C SER A 43 -10.885 -9.525 -5.918 1.00 0.00 C ATOM 597 O SER A 43 -11.252 -10.099 -6.942 1.00 0.00 O ATOM 598 CB SER A 43 -11.654 -11.205 -4.218 1.00 0.00 C ATOM 599 OG SER A 43 -12.676 -11.925 -4.903 1.00 0.00 O ATOM 0 H SER A 43 -13.285 -8.991 -5.674 1.00 0.00 H new ATOM 0 HA SER A 43 -11.129 -9.176 -3.810 1.00 0.00 H new ATOM 0 HB2 SER A 43 -10.684 -11.648 -4.445 1.00 0.00 H new ATOM 0 HB3 SER A 43 -11.803 -11.299 -3.142 1.00 0.00 H new ATOM 0 HG SER A 43 -12.651 -12.866 -4.632 1.00 0.00 H new ATOM 605 N VAL A 44 -9.843 -8.709 -5.847 1.00 0.00 N ATOM 606 CA VAL A 44 -9.033 -8.427 -7.020 1.00 0.00 C ATOM 607 C VAL A 44 -7.564 -8.714 -6.701 1.00 0.00 C ATOM 608 O VAL A 44 -7.195 -8.857 -5.537 1.00 0.00 O ATOM 609 CB VAL A 44 -9.274 -6.991 -7.489 1.00 0.00 C ATOM 610 CG1 VAL A 44 -10.766 -6.652 -7.475 1.00 0.00 C ATOM 611 CG2 VAL A 44 -8.478 -5.997 -6.641 1.00 0.00 C ATOM 0 H VAL A 44 -9.541 -8.235 -4.996 1.00 0.00 H new ATOM 0 HA VAL A 44 -9.319 -9.077 -7.847 1.00 0.00 H new ATOM 0 HB VAL A 44 -8.922 -6.911 -8.518 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -10.909 -5.626 -7.813 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -11.300 -7.331 -8.140 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -11.154 -6.758 -6.462 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.667 -4.984 -6.995 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -8.785 -6.080 -5.599 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -7.414 -6.218 -6.724 1.00 0.00 H new ATOM 621 N ARG A 45 -6.766 -8.788 -7.756 1.00 0.00 N ATOM 622 CA ARG A 45 -5.346 -9.055 -7.603 1.00 0.00 C ATOM 623 C ARG A 45 -4.555 -8.378 -8.724 1.00 0.00 C ATOM 624 O ARG A 45 -4.733 -8.702 -9.897 1.00 0.00 O ATOM 625 CB ARG A 45 -5.063 -10.558 -7.625 1.00 0.00 C ATOM 626 CG ARG A 45 -3.567 -10.837 -7.463 1.00 0.00 C ATOM 627 CD ARG A 45 -3.129 -12.009 -8.343 1.00 0.00 C ATOM 628 NE ARG A 45 -2.987 -13.233 -7.522 1.00 0.00 N ATOM 629 CZ ARG A 45 -4.015 -13.999 -7.132 1.00 0.00 C ATOM 630 NH1 ARG A 45 -5.266 -13.673 -7.486 1.00 0.00 N ATOM 631 NH2 ARG A 45 -3.792 -15.091 -6.389 1.00 0.00 N ATOM 0 H ARG A 45 -7.076 -8.668 -8.720 1.00 0.00 H new ATOM 0 HA ARG A 45 -5.035 -8.652 -6.639 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -5.617 -11.048 -6.824 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -5.417 -10.985 -8.564 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -2.997 -9.946 -7.727 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -3.346 -11.059 -6.419 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -3.861 -12.174 -9.134 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -2.182 -11.775 -8.829 1.00 0.00 H new ATOM 0 HE ARG A 45 -2.048 -13.510 -7.235 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -5.436 -12.842 -8.052 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -6.048 -14.256 -7.189 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -2.840 -15.339 -6.120 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -4.574 -15.674 -6.092 1.00 0.00 H new ATOM 645 N LEU A 46 -3.698 -7.450 -8.323 1.00 0.00 N ATOM 646 CA LEU A 46 -2.879 -6.724 -9.279 1.00 0.00 C ATOM 647 C LEU A 46 -1.402 -6.982 -8.977 1.00 0.00 C ATOM 648 O LEU A 46 -1.065 -7.530 -7.929 1.00 0.00 O ATOM 649 CB LEU A 46 -3.256 -5.242 -9.291 1.00 0.00 C ATOM 650 CG LEU A 46 -2.438 -4.335 -8.369 1.00 0.00 C ATOM 651 CD1 LEU A 46 -2.439 -2.892 -8.876 1.00 0.00 C ATOM 652 CD2 LEU A 46 -2.930 -4.435 -6.923 1.00 0.00 C ATOM 0 H LEU A 46 -3.553 -7.184 -7.349 1.00 0.00 H new ATOM 0 HA LEU A 46 -3.065 -7.083 -10.291 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -3.160 -4.871 -10.311 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -4.307 -5.153 -9.017 1.00 0.00 H new ATOM 0 HG LEU A 46 -1.404 -4.680 -8.382 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -1.851 -2.269 -8.202 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -2.004 -2.857 -9.875 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -3.463 -2.520 -8.913 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -2.332 -3.781 -6.289 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -3.976 -4.132 -6.873 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -2.833 -5.464 -6.576 1.00 0.00 H new ATOM 664 N ILE A 47 -0.559 -6.573 -9.915 1.00 0.00 N ATOM 665 CA ILE A 47 0.874 -6.753 -9.762 1.00 0.00 C ATOM 666 C ILE A 47 1.592 -5.465 -10.174 1.00 0.00 C ATOM 667 O ILE A 47 1.049 -4.663 -10.932 1.00 0.00 O ATOM 668 CB ILE A 47 1.344 -7.990 -10.529 1.00 0.00 C ATOM 669 CG1 ILE A 47 1.453 -7.699 -12.027 1.00 0.00 C ATOM 670 CG2 ILE A 47 0.438 -9.190 -10.242 1.00 0.00 C ATOM 671 CD1 ILE A 47 0.083 -7.365 -12.621 1.00 0.00 C ATOM 0 H ILE A 47 -0.842 -6.118 -10.783 1.00 0.00 H new ATOM 0 HA ILE A 47 1.125 -6.939 -8.718 1.00 0.00 H new ATOM 0 HB ILE A 47 2.343 -8.250 -10.179 1.00 0.00 H new ATOM 0 HG12 ILE A 47 2.137 -6.866 -12.191 1.00 0.00 H new ATOM 0 HG13 ILE A 47 1.875 -8.564 -12.539 1.00 0.00 H new ATOM 0 HG21 ILE A 47 0.794 -10.056 -10.800 1.00 0.00 H new ATOM 0 HG22 ILE A 47 0.456 -9.413 -9.175 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -0.582 -8.957 -10.547 1.00 0.00 H new ATOM 0 HD11 ILE A 47 0.188 -7.162 -13.687 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -0.592 -8.209 -12.477 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -0.325 -6.485 -12.123 1.00 0.00 H new ATOM 683 N TRP A 48 2.801 -5.308 -9.656 1.00 0.00 N ATOM 684 CA TRP A 48 3.598 -4.132 -9.960 1.00 0.00 C ATOM 685 C TRP A 48 5.070 -4.552 -9.984 1.00 0.00 C ATOM 686 O TRP A 48 5.397 -5.699 -9.684 1.00 0.00 O ATOM 687 CB TRP A 48 3.314 -3.005 -8.966 1.00 0.00 C ATOM 688 CG TRP A 48 3.779 -3.303 -7.538 1.00 0.00 C ATOM 689 CD1 TRP A 48 4.937 -2.958 -6.959 1.00 0.00 C ATOM 690 CD2 TRP A 48 3.043 -4.024 -6.528 1.00 0.00 C ATOM 691 NE1 TRP A 48 5.002 -3.403 -5.654 1.00 0.00 N ATOM 692 CE2 TRP A 48 3.814 -4.071 -5.384 1.00 0.00 C ATOM 693 CE3 TRP A 48 1.769 -4.616 -6.578 1.00 0.00 C ATOM 694 CZ2 TRP A 48 3.397 -4.701 -4.205 1.00 0.00 C ATOM 695 CZ3 TRP A 48 1.368 -5.242 -5.392 1.00 0.00 C ATOM 696 CH2 TRP A 48 2.131 -5.298 -4.232 1.00 0.00 C ATOM 0 H TRP A 48 3.248 -5.976 -9.028 1.00 0.00 H new ATOM 0 HA TRP A 48 3.335 -3.730 -10.938 1.00 0.00 H new ATOM 0 HB2 TRP A 48 3.803 -2.095 -9.314 1.00 0.00 H new ATOM 0 HB3 TRP A 48 2.242 -2.806 -8.954 1.00 0.00 H new ATOM 0 HD1 TRP A 48 5.721 -2.402 -7.451 1.00 0.00 H new ATOM 0 HE1 TRP A 48 5.779 -3.267 -5.007 1.00 0.00 H new ATOM 0 HE3 TRP A 48 1.149 -4.590 -7.462 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 4.019 -4.725 -3.322 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 0.397 -5.715 -5.377 1.00 0.00 H new ATOM 0 HH2 TRP A 48 1.749 -5.800 -3.355 1.00 0.00 H new ATOM 707 N GLN A 49 5.918 -3.599 -10.345 1.00 0.00 N ATOM 708 CA GLN A 49 7.346 -3.856 -10.412 1.00 0.00 C ATOM 709 C GLN A 49 8.120 -2.737 -9.711 1.00 0.00 C ATOM 710 O GLN A 49 7.576 -1.662 -9.464 1.00 0.00 O ATOM 711 CB GLN A 49 7.807 -4.016 -11.862 1.00 0.00 C ATOM 712 CG GLN A 49 7.746 -5.481 -12.298 1.00 0.00 C ATOM 713 CD GLN A 49 7.421 -5.596 -13.789 1.00 0.00 C ATOM 714 OE1 GLN A 49 8.237 -5.318 -14.652 1.00 0.00 O ATOM 715 NE2 GLN A 49 6.186 -6.022 -14.042 1.00 0.00 N ATOM 0 H GLN A 49 5.643 -2.649 -10.594 1.00 0.00 H new ATOM 0 HA GLN A 49 7.551 -4.793 -9.895 1.00 0.00 H new ATOM 0 HB2 GLN A 49 7.178 -3.412 -12.516 1.00 0.00 H new ATOM 0 HB3 GLN A 49 8.826 -3.644 -11.967 1.00 0.00 H new ATOM 0 HG2 GLN A 49 8.700 -5.966 -12.092 1.00 0.00 H new ATOM 0 HG3 GLN A 49 6.989 -6.006 -11.716 1.00 0.00 H new ATOM 0 HE21 GLN A 49 5.553 -6.237 -13.272 1.00 0.00 H new ATOM 0 HE22 GLN A 49 5.872 -6.133 -15.006 1.00 0.00 H new ATOM 724 N PRO A 50 9.410 -3.036 -9.403 1.00 0.00 N ATOM 725 CA PRO A 50 10.264 -2.068 -8.736 1.00 0.00 C ATOM 726 C PRO A 50 10.713 -0.973 -9.705 1.00 0.00 C ATOM 727 O PRO A 50 10.817 -1.208 -10.908 1.00 0.00 O ATOM 728 CB PRO A 50 11.422 -2.882 -8.181 1.00 0.00 C ATOM 729 CG PRO A 50 11.416 -4.193 -8.950 1.00 0.00 C ATOM 730 CD PRO A 50 10.088 -4.299 -9.681 1.00 0.00 C ATOM 0 HA PRO A 50 9.750 -1.534 -7.936 1.00 0.00 H new ATOM 0 HB2 PRO A 50 12.368 -2.356 -8.313 1.00 0.00 H new ATOM 0 HB3 PRO A 50 11.300 -3.056 -7.112 1.00 0.00 H new ATOM 0 HG2 PRO A 50 12.245 -4.224 -9.657 1.00 0.00 H new ATOM 0 HG3 PRO A 50 11.546 -5.035 -8.270 1.00 0.00 H new ATOM 0 HD2 PRO A 50 10.236 -4.442 -10.751 1.00 0.00 H new ATOM 0 HD3 PRO A 50 9.506 -5.148 -9.323 1.00 0.00 H new ATOM 738 N PRO A 51 10.974 0.231 -9.130 1.00 0.00 N ATOM 739 CA PRO A 51 11.409 1.364 -9.930 1.00 0.00 C ATOM 740 C PRO A 51 12.872 1.208 -10.349 1.00 0.00 C ATOM 741 O PRO A 51 13.760 1.134 -9.501 1.00 0.00 O ATOM 742 CB PRO A 51 11.169 2.581 -9.052 1.00 0.00 C ATOM 743 CG PRO A 51 11.046 2.053 -7.632 1.00 0.00 C ATOM 744 CD PRO A 51 10.861 0.546 -7.709 1.00 0.00 C ATOM 0 HA PRO A 51 10.861 1.453 -10.868 1.00 0.00 H new ATOM 0 HB2 PRO A 51 11.992 3.291 -9.135 1.00 0.00 H new ATOM 0 HB3 PRO A 51 10.263 3.107 -9.353 1.00 0.00 H new ATOM 0 HG2 PRO A 51 11.937 2.299 -7.055 1.00 0.00 H new ATOM 0 HG3 PRO A 51 10.200 2.516 -7.125 1.00 0.00 H new ATOM 0 HD2 PRO A 51 11.620 0.024 -7.126 1.00 0.00 H new ATOM 0 HD3 PRO A 51 9.891 0.245 -7.313 1.00 0.00 H new ATOM 752 N ALA A 52 13.078 1.163 -11.657 1.00 0.00 N ATOM 753 CA ALA A 52 14.419 1.018 -12.199 1.00 0.00 C ATOM 754 C ALA A 52 15.390 1.870 -11.380 1.00 0.00 C ATOM 755 O ALA A 52 16.564 1.525 -11.247 1.00 0.00 O ATOM 756 CB ALA A 52 14.415 1.400 -13.681 1.00 0.00 C ATOM 0 H ALA A 52 12.339 1.224 -12.357 1.00 0.00 H new ATOM 0 HA ALA A 52 14.751 -0.018 -12.130 1.00 0.00 H new ATOM 0 HB1 ALA A 52 15.421 1.291 -14.087 1.00 0.00 H new ATOM 0 HB2 ALA A 52 13.732 0.746 -14.223 1.00 0.00 H new ATOM 0 HB3 ALA A 52 14.090 2.435 -13.789 1.00 0.00 H new ATOM 762 N ALA A 53 14.866 2.966 -10.852 1.00 0.00 N ATOM 763 CA ALA A 53 15.673 3.870 -10.050 1.00 0.00 C ATOM 764 C ALA A 53 15.113 3.919 -8.627 1.00 0.00 C ATOM 765 O ALA A 53 14.335 4.811 -8.292 1.00 0.00 O ATOM 766 CB ALA A 53 15.705 5.250 -10.711 1.00 0.00 C ATOM 0 H ALA A 53 13.892 3.249 -10.964 1.00 0.00 H new ATOM 0 HA ALA A 53 16.701 3.514 -9.989 1.00 0.00 H new ATOM 0 HB1 ALA A 53 16.310 5.928 -10.109 1.00 0.00 H new ATOM 0 HB2 ALA A 53 16.137 5.166 -11.708 1.00 0.00 H new ATOM 0 HB3 ALA A 53 14.690 5.641 -10.787 1.00 0.00 H new ATOM 772 N PRO A 54 15.542 2.923 -7.806 1.00 0.00 N ATOM 773 CA PRO A 54 15.093 2.844 -6.426 1.00 0.00 C ATOM 774 C PRO A 54 15.785 3.900 -5.563 1.00 0.00 C ATOM 775 O PRO A 54 15.180 4.447 -4.642 1.00 0.00 O ATOM 776 CB PRO A 54 15.407 1.422 -5.991 1.00 0.00 C ATOM 777 CG PRO A 54 16.437 0.901 -6.981 1.00 0.00 C ATOM 778 CD PRO A 54 16.463 1.850 -8.168 1.00 0.00 C ATOM 0 HA PRO A 54 14.029 3.054 -6.317 1.00 0.00 H new ATOM 0 HB2 PRO A 54 15.798 1.402 -4.974 1.00 0.00 H new ATOM 0 HB3 PRO A 54 14.509 0.804 -6.000 1.00 0.00 H new ATOM 0 HG2 PRO A 54 17.421 0.845 -6.515 1.00 0.00 H new ATOM 0 HG3 PRO A 54 16.180 -0.108 -7.304 1.00 0.00 H new ATOM 0 HD2 PRO A 54 17.468 2.234 -8.346 1.00 0.00 H new ATOM 0 HD3 PRO A 54 16.147 1.349 -9.083 1.00 0.00 H new ATOM 786 N ASN A 55 17.043 4.156 -5.892 1.00 0.00 N ATOM 787 CA ASN A 55 17.823 5.137 -5.157 1.00 0.00 C ATOM 788 C ASN A 55 17.533 4.998 -3.662 1.00 0.00 C ATOM 789 O ASN A 55 17.153 5.968 -3.007 1.00 0.00 O ATOM 790 CB ASN A 55 17.456 6.561 -5.580 1.00 0.00 C ATOM 791 CG ASN A 55 17.328 6.666 -7.101 1.00 0.00 C ATOM 792 OD1 ASN A 55 18.304 6.757 -7.827 1.00 0.00 O ATOM 793 ND2 ASN A 55 16.073 6.648 -7.541 1.00 0.00 N ATOM 0 H ASN A 55 17.541 3.701 -6.657 1.00 0.00 H new ATOM 0 HA ASN A 55 18.877 4.958 -5.370 1.00 0.00 H new ATOM 0 HB2 ASN A 55 16.516 6.852 -5.112 1.00 0.00 H new ATOM 0 HB3 ASN A 55 18.217 7.257 -5.227 1.00 0.00 H new ATOM 0 HD21 ASN A 55 15.882 6.712 -8.541 1.00 0.00 H new ATOM 0 HD22 ASN A 55 15.301 6.570 -6.879 1.00 0.00 H new ATOM 800 N GLY A 56 17.723 3.785 -3.165 1.00 0.00 N ATOM 801 CA GLY A 56 17.486 3.507 -1.759 1.00 0.00 C ATOM 802 C GLY A 56 16.826 2.138 -1.574 1.00 0.00 C ATOM 803 O GLY A 56 15.792 1.857 -2.178 1.00 0.00 O ATOM 0 H GLY A 56 18.038 2.983 -3.711 1.00 0.00 H new ATOM 0 HA2 GLY A 56 18.430 3.536 -1.215 1.00 0.00 H new ATOM 0 HA3 GLY A 56 16.849 4.282 -1.334 1.00 0.00 H new ATOM 807 N ILE A 57 17.452 1.324 -0.737 1.00 0.00 N ATOM 808 CA ILE A 57 16.939 -0.008 -0.465 1.00 0.00 C ATOM 809 C ILE A 57 15.483 0.094 -0.007 1.00 0.00 C ATOM 810 O ILE A 57 15.181 0.791 0.961 1.00 0.00 O ATOM 811 CB ILE A 57 17.846 -0.740 0.527 1.00 0.00 C ATOM 812 CG1 ILE A 57 19.059 -1.344 -0.183 1.00 0.00 C ATOM 813 CG2 ILE A 57 17.061 -1.790 1.316 1.00 0.00 C ATOM 814 CD1 ILE A 57 19.601 -0.392 -1.251 1.00 0.00 C ATOM 0 H ILE A 57 18.310 1.561 -0.238 1.00 0.00 H new ATOM 0 HA ILE A 57 16.946 -0.611 -1.373 1.00 0.00 H new ATOM 0 HB ILE A 57 18.223 -0.013 1.246 1.00 0.00 H new ATOM 0 HG12 ILE A 57 19.840 -1.561 0.546 1.00 0.00 H new ATOM 0 HG13 ILE A 57 18.780 -2.292 -0.644 1.00 0.00 H new ATOM 0 HG21 ILE A 57 17.729 -2.295 2.014 1.00 0.00 H new ATOM 0 HG22 ILE A 57 16.258 -1.304 1.870 1.00 0.00 H new ATOM 0 HG23 ILE A 57 16.636 -2.520 0.627 1.00 0.00 H new ATOM 0 HD11 ILE A 57 20.463 -0.846 -1.740 1.00 0.00 H new ATOM 0 HD12 ILE A 57 18.825 -0.196 -1.991 1.00 0.00 H new ATOM 0 HD13 ILE A 57 19.902 0.546 -0.784 1.00 0.00 H new ATOM 826 N ILE A 58 14.620 -0.610 -0.723 1.00 0.00 N ATOM 827 CA ILE A 58 13.202 -0.607 -0.402 1.00 0.00 C ATOM 828 C ILE A 58 12.985 -1.324 0.932 1.00 0.00 C ATOM 829 O ILE A 58 13.441 -2.452 1.116 1.00 0.00 O ATOM 830 CB ILE A 58 12.390 -1.196 -1.557 1.00 0.00 C ATOM 831 CG1 ILE A 58 12.739 -0.510 -2.879 1.00 0.00 C ATOM 832 CG2 ILE A 58 10.891 -1.137 -1.258 1.00 0.00 C ATOM 833 CD1 ILE A 58 12.384 0.978 -2.834 1.00 0.00 C ATOM 0 H ILE A 58 14.874 -1.187 -1.525 1.00 0.00 H new ATOM 0 HA ILE A 58 12.841 0.414 -0.278 1.00 0.00 H new ATOM 0 HB ILE A 58 12.657 -2.248 -1.661 1.00 0.00 H new ATOM 0 HG12 ILE A 58 13.803 -0.628 -3.084 1.00 0.00 H new ATOM 0 HG13 ILE A 58 12.201 -0.991 -3.696 1.00 0.00 H new ATOM 0 HG21 ILE A 58 10.336 -1.562 -2.095 1.00 0.00 H new ATOM 0 HG22 ILE A 58 10.678 -1.707 -0.354 1.00 0.00 H new ATOM 0 HG23 ILE A 58 10.590 -0.100 -1.112 1.00 0.00 H new ATOM 0 HD11 ILE A 58 12.642 1.443 -3.786 1.00 0.00 H new ATOM 0 HD12 ILE A 58 11.315 1.092 -2.653 1.00 0.00 H new ATOM 0 HD13 ILE A 58 12.942 1.461 -2.032 1.00 0.00 H new ATOM 845 N LEU A 59 12.288 -0.641 1.828 1.00 0.00 N ATOM 846 CA LEU A 59 12.004 -1.199 3.139 1.00 0.00 C ATOM 847 C LEU A 59 10.641 -1.893 3.109 1.00 0.00 C ATOM 848 O LEU A 59 10.397 -2.823 3.877 1.00 0.00 O ATOM 849 CB LEU A 59 12.121 -0.120 4.218 1.00 0.00 C ATOM 850 CG LEU A 59 13.543 0.242 4.652 1.00 0.00 C ATOM 851 CD1 LEU A 59 14.476 0.344 3.445 1.00 0.00 C ATOM 852 CD2 LEU A 59 13.550 1.522 5.492 1.00 0.00 C ATOM 0 H LEU A 59 11.911 0.294 1.672 1.00 0.00 H new ATOM 0 HA LEU A 59 12.743 -1.957 3.398 1.00 0.00 H new ATOM 0 HB2 LEU A 59 11.632 0.784 3.855 1.00 0.00 H new ATOM 0 HB3 LEU A 59 11.567 -0.451 5.097 1.00 0.00 H new ATOM 0 HG LEU A 59 13.922 -0.561 5.284 1.00 0.00 H new ATOM 0 HD11 LEU A 59 15.480 0.602 3.782 1.00 0.00 H new ATOM 0 HD12 LEU A 59 14.503 -0.613 2.924 1.00 0.00 H new ATOM 0 HD13 LEU A 59 14.111 1.116 2.767 1.00 0.00 H new ATOM 0 HD21 LEU A 59 14.572 1.757 5.788 1.00 0.00 H new ATOM 0 HD22 LEU A 59 13.144 2.345 4.904 1.00 0.00 H new ATOM 0 HD23 LEU A 59 12.939 1.376 6.383 1.00 0.00 H new ATOM 864 N ALA A 60 9.788 -1.415 2.215 1.00 0.00 N ATOM 865 CA ALA A 60 8.456 -1.978 2.075 1.00 0.00 C ATOM 866 C ALA A 60 7.673 -1.171 1.038 1.00 0.00 C ATOM 867 O ALA A 60 8.243 -0.341 0.331 1.00 0.00 O ATOM 868 CB ALA A 60 7.765 -2.000 3.440 1.00 0.00 C ATOM 0 H ALA A 60 9.994 -0.644 1.580 1.00 0.00 H new ATOM 0 HA ALA A 60 8.509 -3.007 1.720 1.00 0.00 H new ATOM 0 HB1 ALA A 60 6.766 -2.422 3.335 1.00 0.00 H new ATOM 0 HB2 ALA A 60 8.346 -2.610 4.132 1.00 0.00 H new ATOM 0 HB3 ALA A 60 7.691 -0.984 3.827 1.00 0.00 H new ATOM 874 N TYR A 61 6.377 -1.443 0.979 1.00 0.00 N ATOM 875 CA TYR A 61 5.510 -0.753 0.040 1.00 0.00 C ATOM 876 C TYR A 61 4.150 -0.449 0.671 1.00 0.00 C ATOM 877 O TYR A 61 3.848 -0.926 1.764 1.00 0.00 O ATOM 878 CB TYR A 61 5.310 -1.713 -1.135 1.00 0.00 C ATOM 879 CG TYR A 61 6.372 -1.586 -2.229 1.00 0.00 C ATOM 880 CD1 TYR A 61 7.602 -2.192 -2.071 1.00 0.00 C ATOM 881 CD2 TYR A 61 6.099 -0.867 -3.375 1.00 0.00 C ATOM 882 CE1 TYR A 61 8.601 -2.073 -3.101 1.00 0.00 C ATOM 883 CE2 TYR A 61 7.099 -0.748 -4.405 1.00 0.00 C ATOM 884 CZ TYR A 61 8.300 -1.356 -4.217 1.00 0.00 C ATOM 885 OH TYR A 61 9.244 -1.244 -5.190 1.00 0.00 O ATOM 0 H TYR A 61 5.907 -2.132 1.566 1.00 0.00 H new ATOM 0 HA TYR A 61 5.953 0.195 -0.265 1.00 0.00 H new ATOM 0 HB2 TYR A 61 5.311 -2.736 -0.759 1.00 0.00 H new ATOM 0 HB3 TYR A 61 4.328 -1.535 -1.573 1.00 0.00 H new ATOM 0 HD1 TYR A 61 7.815 -2.756 -1.175 1.00 0.00 H new ATOM 0 HD2 TYR A 61 5.136 -0.394 -3.499 1.00 0.00 H new ATOM 0 HE1 TYR A 61 9.567 -2.542 -2.990 1.00 0.00 H new ATOM 0 HE2 TYR A 61 6.899 -0.188 -5.307 1.00 0.00 H new ATOM 0 HH TYR A 61 9.812 -2.043 -5.189 1.00 0.00 H new ATOM 895 N GLN A 62 3.365 0.344 -0.044 1.00 0.00 N ATOM 896 CA GLN A 62 2.044 0.717 0.433 1.00 0.00 C ATOM 897 C GLN A 62 1.017 0.588 -0.694 1.00 0.00 C ATOM 898 O GLN A 62 1.244 1.067 -1.804 1.00 0.00 O ATOM 899 CB GLN A 62 2.049 2.134 1.009 1.00 0.00 C ATOM 900 CG GLN A 62 0.635 2.578 1.388 1.00 0.00 C ATOM 901 CD GLN A 62 0.640 3.995 1.964 1.00 0.00 C ATOM 902 OE1 GLN A 62 1.036 4.233 3.093 1.00 0.00 O ATOM 903 NE2 GLN A 62 0.180 4.921 1.126 1.00 0.00 N ATOM 0 H GLN A 62 3.619 0.738 -0.950 1.00 0.00 H new ATOM 0 HA GLN A 62 1.763 0.035 1.235 1.00 0.00 H new ATOM 0 HB2 GLN A 62 2.693 2.171 1.888 1.00 0.00 H new ATOM 0 HB3 GLN A 62 2.467 2.826 0.278 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -0.009 2.541 0.509 1.00 0.00 H new ATOM 0 HG3 GLN A 62 0.217 1.886 2.119 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -0.136 4.653 0.194 1.00 0.00 H new ATOM 0 HE22 GLN A 62 0.144 5.898 1.416 1.00 0.00 H new ATOM 912 N ILE A 63 -0.091 -0.063 -0.370 1.00 0.00 N ATOM 913 CA ILE A 63 -1.153 -0.261 -1.341 1.00 0.00 C ATOM 914 C ILE A 63 -2.463 0.295 -0.779 1.00 0.00 C ATOM 915 O ILE A 63 -3.013 -0.249 0.177 1.00 0.00 O ATOM 916 CB ILE A 63 -1.237 -1.733 -1.751 1.00 0.00 C ATOM 917 CG1 ILE A 63 -0.714 -1.936 -3.174 1.00 0.00 C ATOM 918 CG2 ILE A 63 -2.659 -2.270 -1.580 1.00 0.00 C ATOM 919 CD1 ILE A 63 0.191 -3.167 -3.256 1.00 0.00 C ATOM 0 H ILE A 63 -0.276 -0.460 0.551 1.00 0.00 H new ATOM 0 HA ILE A 63 -0.938 0.290 -2.257 1.00 0.00 H new ATOM 0 HB ILE A 63 -0.594 -2.310 -1.086 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -1.553 -2.051 -3.860 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -0.161 -1.052 -3.491 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -2.691 -3.318 -1.878 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -2.958 -2.181 -0.536 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -3.343 -1.694 -2.204 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.549 -3.288 -4.278 1.00 0.00 H new ATOM 0 HD12 ILE A 63 1.042 -3.039 -2.587 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -0.372 -4.053 -2.961 1.00 0.00 H new ATOM 931 N THR A 64 -2.924 1.374 -1.396 1.00 0.00 N ATOM 932 CA THR A 64 -4.158 2.010 -0.969 1.00 0.00 C ATOM 933 C THR A 64 -5.271 1.751 -1.986 1.00 0.00 C ATOM 934 O THR A 64 -5.071 1.922 -3.188 1.00 0.00 O ATOM 935 CB THR A 64 -3.871 3.496 -0.747 1.00 0.00 C ATOM 936 OG1 THR A 64 -3.912 4.057 -2.056 1.00 0.00 O ATOM 937 CG2 THR A 64 -2.438 3.752 -0.276 1.00 0.00 C ATOM 0 H THR A 64 -2.465 1.823 -2.188 1.00 0.00 H new ATOM 0 HA THR A 64 -4.516 1.589 -0.029 1.00 0.00 H new ATOM 0 HB THR A 64 -4.571 3.895 -0.012 1.00 0.00 H new ATOM 0 HG1 THR A 64 -4.089 3.349 -2.710 1.00 0.00 H new ATOM 0 HG21 THR A 64 -2.287 4.822 -0.134 1.00 0.00 H new ATOM 0 HG22 THR A 64 -2.267 3.233 0.667 1.00 0.00 H new ATOM 0 HG23 THR A 64 -1.737 3.384 -1.025 1.00 0.00 H new ATOM 945 N HIS A 65 -6.420 1.343 -1.467 1.00 0.00 N ATOM 946 CA HIS A 65 -7.565 1.059 -2.315 1.00 0.00 C ATOM 947 C HIS A 65 -8.784 1.831 -1.807 1.00 0.00 C ATOM 948 O HIS A 65 -9.009 1.920 -0.601 1.00 0.00 O ATOM 949 CB HIS A 65 -7.813 -0.448 -2.406 1.00 0.00 C ATOM 950 CG HIS A 65 -8.520 -1.027 -1.204 1.00 0.00 C ATOM 951 ND1 HIS A 65 -7.974 -2.035 -0.428 1.00 0.00 N ATOM 952 CD2 HIS A 65 -9.732 -0.730 -0.653 1.00 0.00 C ATOM 953 CE1 HIS A 65 -8.828 -2.324 0.543 1.00 0.00 C ATOM 954 NE2 HIS A 65 -9.917 -1.515 0.401 1.00 0.00 N ATOM 0 H HIS A 65 -6.582 1.202 -0.470 1.00 0.00 H new ATOM 0 HA HIS A 65 -7.362 1.397 -3.331 1.00 0.00 H new ATOM 0 HB2 HIS A 65 -8.405 -0.655 -3.298 1.00 0.00 H new ATOM 0 HB3 HIS A 65 -6.857 -0.956 -2.532 1.00 0.00 H new ATOM 0 HD2 HIS A 65 -10.424 0.017 -1.013 1.00 0.00 H new ATOM 0 HE1 HIS A 65 -8.687 -3.069 1.312 1.00 0.00 H new ATOM 0 HE2 HIS A 65 -10.739 -1.514 1.006 1.00 0.00 H new ATOM 962 N ARG A 66 -9.540 2.371 -2.752 1.00 0.00 N ATOM 963 CA ARG A 66 -10.730 3.132 -2.416 1.00 0.00 C ATOM 964 C ARG A 66 -11.647 3.251 -3.635 1.00 0.00 C ATOM 965 O ARG A 66 -11.186 3.175 -4.772 1.00 0.00 O ATOM 966 CB ARG A 66 -10.366 4.534 -1.922 1.00 0.00 C ATOM 967 CG ARG A 66 -9.787 5.382 -3.057 1.00 0.00 C ATOM 968 CD ARG A 66 -9.418 6.782 -2.562 1.00 0.00 C ATOM 969 NE ARG A 66 -10.250 7.796 -3.246 1.00 0.00 N ATOM 970 CZ ARG A 66 -9.944 9.099 -3.311 1.00 0.00 C ATOM 971 NH1 ARG A 66 -8.824 9.554 -2.734 1.00 0.00 N ATOM 972 NH2 ARG A 66 -10.759 9.947 -3.954 1.00 0.00 N ATOM 0 H ARG A 66 -9.350 2.296 -3.751 1.00 0.00 H new ATOM 0 HA ARG A 66 -11.248 2.600 -1.618 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -11.252 5.021 -1.515 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -9.641 4.461 -1.111 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -8.903 4.893 -3.467 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -10.514 5.458 -3.866 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -9.565 6.846 -1.484 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -8.363 6.977 -2.752 1.00 0.00 H new ATOM 0 HE ARG A 66 -11.110 7.484 -3.696 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -8.204 8.909 -2.245 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -8.591 10.546 -2.784 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -11.612 9.600 -4.394 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -10.527 10.939 -4.004 1.00 0.00 H new ATOM 986 N LEU A 67 -12.929 3.434 -3.355 1.00 0.00 N ATOM 987 CA LEU A 67 -13.915 3.564 -4.415 1.00 0.00 C ATOM 988 C LEU A 67 -13.754 4.927 -5.091 1.00 0.00 C ATOM 989 O LEU A 67 -14.090 5.957 -4.509 1.00 0.00 O ATOM 990 CB LEU A 67 -15.322 3.310 -3.871 1.00 0.00 C ATOM 991 CG LEU A 67 -15.763 1.846 -3.810 1.00 0.00 C ATOM 992 CD1 LEU A 67 -17.253 1.735 -3.480 1.00 0.00 C ATOM 993 CD2 LEU A 67 -15.406 1.111 -5.103 1.00 0.00 C ATOM 0 H LEU A 67 -13.308 3.495 -2.410 1.00 0.00 H new ATOM 0 HA LEU A 67 -13.753 2.806 -5.182 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -15.383 3.729 -2.867 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -16.033 3.858 -4.489 1.00 0.00 H new ATOM 0 HG LEU A 67 -15.217 1.359 -3.002 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -17.540 0.684 -3.443 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -17.447 2.199 -2.513 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -17.835 2.243 -4.249 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -15.730 0.073 -5.033 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -15.906 1.591 -5.944 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -14.327 1.144 -5.255 1.00 0.00 H new ATOM 1005 N ASN A 68 -13.240 4.889 -6.312 1.00 0.00 N ATOM 1006 CA ASN A 68 -13.030 6.108 -7.074 1.00 0.00 C ATOM 1007 C ASN A 68 -14.291 6.971 -7.004 1.00 0.00 C ATOM 1008 O ASN A 68 -14.213 8.197 -7.066 1.00 0.00 O ATOM 1009 CB ASN A 68 -12.751 5.797 -8.546 1.00 0.00 C ATOM 1010 CG ASN A 68 -11.843 6.859 -9.169 1.00 0.00 C ATOM 1011 OD1 ASN A 68 -11.011 7.463 -8.513 1.00 0.00 O ATOM 1012 ND2 ASN A 68 -12.050 7.053 -10.468 1.00 0.00 N ATOM 0 H ASN A 68 -12.963 4.033 -6.792 1.00 0.00 H new ATOM 0 HA ASN A 68 -12.173 6.629 -6.647 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -12.282 4.817 -8.632 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -13.691 5.749 -9.096 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -11.495 7.742 -10.976 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -12.764 6.513 -10.957 1.00 0.00 H new ATOM 1019 N THR A 69 -15.425 6.297 -6.876 1.00 0.00 N ATOM 1020 CA THR A 69 -16.701 6.987 -6.797 1.00 0.00 C ATOM 1021 C THR A 69 -17.679 6.202 -5.921 1.00 0.00 C ATOM 1022 O THR A 69 -18.046 5.075 -6.251 1.00 0.00 O ATOM 1023 CB THR A 69 -17.207 7.210 -8.224 1.00 0.00 C ATOM 1024 OG1 THR A 69 -17.537 5.901 -8.683 1.00 0.00 O ATOM 1025 CG2 THR A 69 -16.099 7.670 -9.173 1.00 0.00 C ATOM 0 H THR A 69 -15.486 5.280 -6.825 1.00 0.00 H new ATOM 0 HA THR A 69 -16.595 7.961 -6.318 1.00 0.00 H new ATOM 0 HB THR A 69 -18.007 7.951 -8.214 1.00 0.00 H new ATOM 0 HG1 THR A 69 -17.471 5.267 -7.939 1.00 0.00 H new ATOM 0 HG21 THR A 69 -16.512 7.813 -10.172 1.00 0.00 H new ATOM 0 HG22 THR A 69 -15.680 8.611 -8.815 1.00 0.00 H new ATOM 0 HG23 THR A 69 -15.314 6.914 -9.210 1.00 0.00 H new ATOM 1033 N THR A 70 -18.073 6.828 -4.822 1.00 0.00 N ATOM 1034 CA THR A 70 -19.001 6.201 -3.896 1.00 0.00 C ATOM 1035 C THR A 70 -19.387 7.180 -2.785 1.00 0.00 C ATOM 1036 O THR A 70 -19.362 8.393 -2.985 1.00 0.00 O ATOM 1037 CB THR A 70 -18.355 4.916 -3.376 1.00 0.00 C ATOM 1038 OG1 THR A 70 -19.361 4.328 -2.557 1.00 0.00 O ATOM 1039 CG2 THR A 70 -17.201 5.190 -2.409 1.00 0.00 C ATOM 0 H THR A 70 -17.767 7.763 -4.552 1.00 0.00 H new ATOM 0 HA THR A 70 -19.935 5.934 -4.391 1.00 0.00 H new ATOM 0 HB THR A 70 -17.991 4.327 -4.218 1.00 0.00 H new ATOM 0 HG1 THR A 70 -18.948 3.687 -1.941 1.00 0.00 H new ATOM 0 HG21 THR A 70 -16.778 4.244 -2.070 1.00 0.00 H new ATOM 0 HG22 THR A 70 -16.431 5.771 -2.917 1.00 0.00 H new ATOM 0 HG23 THR A 70 -17.571 5.750 -1.550 1.00 0.00 H new ATOM 1047 N THR A 71 -19.736 6.615 -1.638 1.00 0.00 N ATOM 1048 CA THR A 71 -20.128 7.422 -0.495 1.00 0.00 C ATOM 1049 C THR A 71 -18.966 7.546 0.493 1.00 0.00 C ATOM 1050 O THR A 71 -18.245 6.579 0.733 1.00 0.00 O ATOM 1051 CB THR A 71 -21.383 6.797 0.118 1.00 0.00 C ATOM 1052 OG1 THR A 71 -21.047 5.420 0.267 1.00 0.00 O ATOM 1053 CG2 THR A 71 -22.566 6.790 -0.852 1.00 0.00 C ATOM 0 H THR A 71 -19.755 5.608 -1.476 1.00 0.00 H new ATOM 0 HA THR A 71 -20.369 8.442 -0.795 1.00 0.00 H new ATOM 0 HB THR A 71 -21.657 7.343 1.021 1.00 0.00 H new ATOM 0 HG1 THR A 71 -21.805 4.939 0.660 1.00 0.00 H new ATOM 0 HG21 THR A 71 -23.431 6.336 -0.368 1.00 0.00 H new ATOM 0 HG22 THR A 71 -22.807 7.813 -1.140 1.00 0.00 H new ATOM 0 HG23 THR A 71 -22.305 6.215 -1.741 1.00 0.00 H new ATOM 1061 N ALA A 72 -18.821 8.744 1.039 1.00 0.00 N ATOM 1062 CA ALA A 72 -17.759 9.007 1.996 1.00 0.00 C ATOM 1063 C ALA A 72 -16.421 9.077 1.259 1.00 0.00 C ATOM 1064 O ALA A 72 -16.369 8.916 0.041 1.00 0.00 O ATOM 1065 CB ALA A 72 -17.772 7.929 3.082 1.00 0.00 C ATOM 0 H ALA A 72 -19.421 9.544 0.837 1.00 0.00 H new ATOM 0 HA ALA A 72 -17.914 9.967 2.488 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -16.976 8.126 3.800 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -18.734 7.941 3.595 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -17.616 6.951 2.626 1.00 0.00 H new ATOM 1071 N ASN A 73 -15.369 9.316 2.029 1.00 0.00 N ATOM 1072 CA ASN A 73 -14.034 9.409 1.465 1.00 0.00 C ATOM 1073 C ASN A 73 -13.042 8.706 2.394 1.00 0.00 C ATOM 1074 O ASN A 73 -12.573 9.295 3.367 1.00 0.00 O ATOM 1075 CB ASN A 73 -13.596 10.868 1.323 1.00 0.00 C ATOM 1076 CG ASN A 73 -12.240 10.968 0.620 1.00 0.00 C ATOM 1077 OD1 ASN A 73 -12.112 10.744 -0.572 1.00 0.00 O ATOM 1078 ND2 ASN A 73 -11.239 11.316 1.424 1.00 0.00 N ATOM 0 H ASN A 73 -15.415 9.448 3.039 1.00 0.00 H new ATOM 0 HA ASN A 73 -14.051 8.940 0.481 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -14.345 11.423 0.757 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -13.534 11.330 2.308 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -10.294 11.410 1.051 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -11.416 11.489 2.413 1.00 0.00 H new ATOM 1085 N THR A 74 -12.751 7.457 2.061 1.00 0.00 N ATOM 1086 CA THR A 74 -11.824 6.668 2.854 1.00 0.00 C ATOM 1087 C THR A 74 -11.109 5.642 1.972 1.00 0.00 C ATOM 1088 O THR A 74 -11.718 5.051 1.082 1.00 0.00 O ATOM 1089 CB THR A 74 -12.606 6.038 4.008 1.00 0.00 C ATOM 1090 OG1 THR A 74 -13.874 5.725 3.439 1.00 0.00 O ATOM 1091 CG2 THR A 74 -12.931 7.045 5.113 1.00 0.00 C ATOM 0 H THR A 74 -13.141 6.972 1.253 1.00 0.00 H new ATOM 0 HA THR A 74 -11.037 7.291 3.279 1.00 0.00 H new ATOM 0 HB THR A 74 -12.032 5.212 4.427 1.00 0.00 H new ATOM 0 HG1 THR A 74 -14.445 5.310 4.119 1.00 0.00 H new ATOM 0 HG21 THR A 74 -13.486 6.547 5.908 1.00 0.00 H new ATOM 0 HG22 THR A 74 -12.005 7.452 5.518 1.00 0.00 H new ATOM 0 HG23 THR A 74 -13.534 7.855 4.702 1.00 0.00 H new ATOM 1099 N ALA A 75 -9.826 5.462 2.251 1.00 0.00 N ATOM 1100 CA ALA A 75 -9.021 4.517 1.495 1.00 0.00 C ATOM 1101 C ALA A 75 -8.288 3.588 2.465 1.00 0.00 C ATOM 1102 O ALA A 75 -7.678 4.047 3.429 1.00 0.00 O ATOM 1103 CB ALA A 75 -8.061 5.281 0.581 1.00 0.00 C ATOM 0 H ALA A 75 -9.324 5.954 2.990 1.00 0.00 H new ATOM 0 HA ALA A 75 -9.653 3.897 0.859 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -7.457 4.573 0.014 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -8.632 5.904 -0.108 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -7.409 5.912 1.185 1.00 0.00 H new ATOM 1109 N THR A 76 -8.372 2.298 2.175 1.00 0.00 N ATOM 1110 CA THR A 76 -7.724 1.300 3.009 1.00 0.00 C ATOM 1111 C THR A 76 -6.246 1.172 2.636 1.00 0.00 C ATOM 1112 O THR A 76 -5.901 0.476 1.682 1.00 0.00 O ATOM 1113 CB THR A 76 -8.502 -0.010 2.870 1.00 0.00 C ATOM 1114 OG1 THR A 76 -9.761 0.267 3.476 1.00 0.00 O ATOM 1115 CG2 THR A 76 -7.915 -1.134 3.727 1.00 0.00 C ATOM 0 H THR A 76 -8.879 1.921 1.374 1.00 0.00 H new ATOM 0 HA THR A 76 -7.738 1.592 4.059 1.00 0.00 H new ATOM 0 HB THR A 76 -8.510 -0.317 1.824 1.00 0.00 H new ATOM 0 HG1 THR A 76 -10.329 -0.530 3.428 1.00 0.00 H new ATOM 0 HG21 THR A 76 -8.504 -2.041 3.591 1.00 0.00 H new ATOM 0 HG22 THR A 76 -6.885 -1.322 3.424 1.00 0.00 H new ATOM 0 HG23 THR A 76 -7.937 -0.841 4.777 1.00 0.00 H new ATOM 1123 N VAL A 77 -5.412 1.854 3.408 1.00 0.00 N ATOM 1124 CA VAL A 77 -3.979 1.825 3.171 1.00 0.00 C ATOM 1125 C VAL A 77 -3.385 0.572 3.817 1.00 0.00 C ATOM 1126 O VAL A 77 -3.711 0.243 4.957 1.00 0.00 O ATOM 1127 CB VAL A 77 -3.339 3.119 3.676 1.00 0.00 C ATOM 1128 CG1 VAL A 77 -1.813 3.047 3.587 1.00 0.00 C ATOM 1129 CG2 VAL A 77 -3.876 4.331 2.911 1.00 0.00 C ATOM 0 H VAL A 77 -5.702 2.430 4.198 1.00 0.00 H new ATOM 0 HA VAL A 77 -3.769 1.770 2.103 1.00 0.00 H new ATOM 0 HB VAL A 77 -3.608 3.239 4.725 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -1.383 3.980 3.952 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -1.452 2.218 4.196 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -1.516 2.892 2.550 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -3.405 5.238 3.290 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -3.651 4.221 1.850 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -4.955 4.399 3.048 1.00 0.00 H new ATOM 1139 N GLU A 78 -2.523 -0.093 3.062 1.00 0.00 N ATOM 1140 CA GLU A 78 -1.880 -1.302 3.547 1.00 0.00 C ATOM 1141 C GLU A 78 -0.385 -1.275 3.224 1.00 0.00 C ATOM 1142 O GLU A 78 0.008 -0.905 2.118 1.00 0.00 O ATOM 1143 CB GLU A 78 -2.545 -2.550 2.962 1.00 0.00 C ATOM 1144 CG GLU A 78 -1.760 -3.811 3.325 1.00 0.00 C ATOM 1145 CD GLU A 78 -2.639 -4.804 4.089 1.00 0.00 C ATOM 1146 OE1 GLU A 78 -3.329 -5.592 3.408 1.00 0.00 O ATOM 1147 OE2 GLU A 78 -2.600 -4.751 5.337 1.00 0.00 O ATOM 0 H GLU A 78 -2.255 0.183 2.117 1.00 0.00 H new ATOM 0 HA GLU A 78 -1.997 -1.342 4.630 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -3.565 -2.632 3.337 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -2.610 -2.457 1.878 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -1.379 -4.280 2.418 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -0.895 -3.543 3.932 1.00 0.00 H new ATOM 1154 N VAL A 79 0.408 -1.672 4.208 1.00 0.00 N ATOM 1155 CA VAL A 79 1.851 -1.698 4.041 1.00 0.00 C ATOM 1156 C VAL A 79 2.287 -3.104 3.625 1.00 0.00 C ATOM 1157 O VAL A 79 1.860 -4.092 4.221 1.00 0.00 O ATOM 1158 CB VAL A 79 2.535 -1.215 5.322 1.00 0.00 C ATOM 1159 CG1 VAL A 79 3.885 -1.908 5.519 1.00 0.00 C ATOM 1160 CG2 VAL A 79 2.695 0.307 5.318 1.00 0.00 C ATOM 0 H VAL A 79 0.079 -1.978 5.124 1.00 0.00 H new ATOM 0 HA VAL A 79 2.156 -1.015 3.248 1.00 0.00 H new ATOM 0 HB VAL A 79 1.896 -1.483 6.164 1.00 0.00 H new ATOM 0 HG11 VAL A 79 4.349 -1.546 6.436 1.00 0.00 H new ATOM 0 HG12 VAL A 79 3.734 -2.985 5.589 1.00 0.00 H new ATOM 0 HG13 VAL A 79 4.535 -1.687 4.672 1.00 0.00 H new ATOM 0 HG21 VAL A 79 3.184 0.624 6.239 1.00 0.00 H new ATOM 0 HG22 VAL A 79 3.302 0.607 4.464 1.00 0.00 H new ATOM 0 HG23 VAL A 79 1.713 0.776 5.248 1.00 0.00 H new ATOM 1170 N LEU A 80 3.133 -3.150 2.606 1.00 0.00 N ATOM 1171 CA LEU A 80 3.631 -4.419 2.103 1.00 0.00 C ATOM 1172 C LEU A 80 5.149 -4.473 2.284 1.00 0.00 C ATOM 1173 O LEU A 80 5.770 -3.477 2.654 1.00 0.00 O ATOM 1174 CB LEU A 80 3.175 -4.640 0.660 1.00 0.00 C ATOM 1175 CG LEU A 80 1.696 -4.981 0.468 1.00 0.00 C ATOM 1176 CD1 LEU A 80 1.123 -4.269 -0.759 1.00 0.00 C ATOM 1177 CD2 LEU A 80 1.487 -6.495 0.402 1.00 0.00 C ATOM 0 H LEU A 80 3.486 -2.329 2.115 1.00 0.00 H new ATOM 0 HA LEU A 80 3.212 -5.247 2.675 1.00 0.00 H new ATOM 0 HB2 LEU A 80 3.397 -3.739 0.088 1.00 0.00 H new ATOM 0 HB3 LEU A 80 3.772 -5.445 0.231 1.00 0.00 H new ATOM 0 HG LEU A 80 1.146 -4.617 1.336 1.00 0.00 H new ATOM 0 HD11 LEU A 80 0.071 -4.529 -0.872 1.00 0.00 H new ATOM 0 HD12 LEU A 80 1.219 -3.191 -0.632 1.00 0.00 H new ATOM 0 HD13 LEU A 80 1.671 -4.579 -1.649 1.00 0.00 H new ATOM 0 HD21 LEU A 80 0.427 -6.710 0.265 1.00 0.00 H new ATOM 0 HD22 LEU A 80 2.052 -6.904 -0.436 1.00 0.00 H new ATOM 0 HD23 LEU A 80 1.833 -6.951 1.330 1.00 0.00 H new ATOM 1189 N ALA A 81 5.704 -5.646 2.014 1.00 0.00 N ATOM 1190 CA ALA A 81 7.138 -5.842 2.142 1.00 0.00 C ATOM 1191 C ALA A 81 7.841 -5.249 0.919 1.00 0.00 C ATOM 1192 O ALA A 81 7.199 -4.951 -0.086 1.00 0.00 O ATOM 1193 CB ALA A 81 7.435 -7.333 2.319 1.00 0.00 C ATOM 0 H ALA A 81 5.186 -6.470 1.707 1.00 0.00 H new ATOM 0 HA ALA A 81 7.519 -5.326 3.023 1.00 0.00 H new ATOM 0 HB1 ALA A 81 8.511 -7.481 2.415 1.00 0.00 H new ATOM 0 HB2 ALA A 81 6.937 -7.699 3.217 1.00 0.00 H new ATOM 0 HB3 ALA A 81 7.069 -7.882 1.451 1.00 0.00 H new ATOM 1199 N PRO A 82 9.185 -5.091 1.050 1.00 0.00 N ATOM 1200 CA PRO A 82 9.982 -4.539 -0.032 1.00 0.00 C ATOM 1201 C PRO A 82 10.176 -5.566 -1.150 1.00 0.00 C ATOM 1202 O PRO A 82 10.829 -5.281 -2.153 1.00 0.00 O ATOM 1203 CB PRO A 82 11.289 -4.115 0.618 1.00 0.00 C ATOM 1204 CG PRO A 82 11.359 -4.865 1.939 1.00 0.00 C ATOM 1205 CD PRO A 82 9.979 -5.433 2.226 1.00 0.00 C ATOM 0 HA PRO A 82 9.501 -3.690 -0.518 1.00 0.00 H new ATOM 0 HB2 PRO A 82 12.140 -4.362 -0.017 1.00 0.00 H new ATOM 0 HB3 PRO A 82 11.314 -3.037 0.779 1.00 0.00 H new ATOM 0 HG2 PRO A 82 12.097 -5.665 1.885 1.00 0.00 H new ATOM 0 HG3 PRO A 82 11.671 -4.197 2.741 1.00 0.00 H new ATOM 0 HD2 PRO A 82 10.018 -6.512 2.377 1.00 0.00 H new ATOM 0 HD3 PRO A 82 9.553 -5.000 3.131 1.00 0.00 H new ATOM 1213 N SER A 83 9.597 -6.739 -0.939 1.00 0.00 N ATOM 1214 CA SER A 83 9.698 -7.809 -1.917 1.00 0.00 C ATOM 1215 C SER A 83 8.301 -8.233 -2.375 1.00 0.00 C ATOM 1216 O SER A 83 8.065 -9.407 -2.656 1.00 0.00 O ATOM 1217 CB SER A 83 10.455 -9.009 -1.343 1.00 0.00 C ATOM 1218 OG SER A 83 9.952 -9.398 -0.068 1.00 0.00 O ATOM 0 H SER A 83 9.057 -6.972 -0.106 1.00 0.00 H new ATOM 0 HA SER A 83 10.257 -7.437 -2.775 1.00 0.00 H new ATOM 0 HB2 SER A 83 10.380 -9.849 -2.034 1.00 0.00 H new ATOM 0 HB3 SER A 83 11.513 -8.762 -1.255 1.00 0.00 H new ATOM 0 HG SER A 83 10.460 -10.168 0.263 1.00 0.00 H new ATOM 1224 N ALA A 84 7.411 -7.253 -2.437 1.00 0.00 N ATOM 1225 CA ALA A 84 6.044 -7.510 -2.856 1.00 0.00 C ATOM 1226 C ALA A 84 5.873 -7.079 -4.314 1.00 0.00 C ATOM 1227 O ALA A 84 6.108 -5.921 -4.655 1.00 0.00 O ATOM 1228 CB ALA A 84 5.077 -6.785 -1.917 1.00 0.00 C ATOM 0 H ALA A 84 7.610 -6.280 -2.204 1.00 0.00 H new ATOM 0 HA ALA A 84 5.819 -8.575 -2.798 1.00 0.00 H new ATOM 0 HB1 ALA A 84 4.051 -6.978 -2.231 1.00 0.00 H new ATOM 0 HB2 ALA A 84 5.219 -7.147 -0.899 1.00 0.00 H new ATOM 0 HB3 ALA A 84 5.272 -5.713 -1.951 1.00 0.00 H new ATOM 1234 N ARG A 85 5.465 -8.035 -5.136 1.00 0.00 N ATOM 1235 CA ARG A 85 5.260 -7.769 -6.550 1.00 0.00 C ATOM 1236 C ARG A 85 3.767 -7.625 -6.852 1.00 0.00 C ATOM 1237 O ARG A 85 3.388 -6.987 -7.833 1.00 0.00 O ATOM 1238 CB ARG A 85 5.842 -8.892 -7.412 1.00 0.00 C ATOM 1239 CG ARG A 85 7.328 -9.099 -7.112 1.00 0.00 C ATOM 1240 CD ARG A 85 8.199 -8.309 -8.090 1.00 0.00 C ATOM 1241 NE ARG A 85 8.125 -8.916 -9.438 1.00 0.00 N ATOM 1242 CZ ARG A 85 8.881 -8.535 -10.477 1.00 0.00 C ATOM 1243 NH1 ARG A 85 9.773 -7.546 -10.328 1.00 0.00 N ATOM 1244 NH2 ARG A 85 8.746 -9.142 -11.663 1.00 0.00 N ATOM 0 H ARG A 85 5.271 -8.995 -4.850 1.00 0.00 H new ATOM 0 HA ARG A 85 5.774 -6.838 -6.790 1.00 0.00 H new ATOM 0 HB2 ARG A 85 5.297 -9.818 -7.226 1.00 0.00 H new ATOM 0 HB3 ARG A 85 5.710 -8.651 -8.467 1.00 0.00 H new ATOM 0 HG2 ARG A 85 7.544 -8.784 -6.091 1.00 0.00 H new ATOM 0 HG3 ARG A 85 7.572 -10.159 -7.177 1.00 0.00 H new ATOM 0 HD2 ARG A 85 7.866 -7.272 -8.130 1.00 0.00 H new ATOM 0 HD3 ARG A 85 9.232 -8.299 -7.743 1.00 0.00 H new ATOM 0 HE ARG A 85 7.456 -9.672 -9.585 1.00 0.00 H new ATOM 0 HH11 ARG A 85 9.876 -7.084 -9.424 1.00 0.00 H new ATOM 0 HH12 ARG A 85 10.349 -7.255 -11.118 1.00 0.00 H new ATOM 0 HH21 ARG A 85 8.067 -9.895 -11.776 1.00 0.00 H new ATOM 0 HH22 ARG A 85 9.322 -8.851 -12.453 1.00 0.00 H new ATOM 1258 N GLN A 86 2.961 -8.227 -5.990 1.00 0.00 N ATOM 1259 CA GLN A 86 1.518 -8.174 -6.153 1.00 0.00 C ATOM 1260 C GLN A 86 0.831 -8.147 -4.786 1.00 0.00 C ATOM 1261 O GLN A 86 1.445 -8.475 -3.772 1.00 0.00 O ATOM 1262 CB GLN A 86 1.017 -9.348 -6.996 1.00 0.00 C ATOM 1263 CG GLN A 86 1.506 -10.681 -6.425 1.00 0.00 C ATOM 1264 CD GLN A 86 2.043 -11.588 -7.534 1.00 0.00 C ATOM 1265 OE1 GLN A 86 3.145 -11.420 -8.031 1.00 0.00 O ATOM 1266 NE2 GLN A 86 1.205 -12.556 -7.893 1.00 0.00 N ATOM 0 H GLN A 86 3.280 -8.754 -5.177 1.00 0.00 H new ATOM 0 HA GLN A 86 1.265 -7.256 -6.684 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -0.073 -9.339 -7.027 1.00 0.00 H new ATOM 0 HB3 GLN A 86 1.366 -9.238 -8.023 1.00 0.00 H new ATOM 0 HG2 GLN A 86 2.288 -10.500 -5.688 1.00 0.00 H new ATOM 0 HG3 GLN A 86 0.688 -11.180 -5.906 1.00 0.00 H new ATOM 0 HE21 GLN A 86 0.297 -12.640 -7.436 1.00 0.00 H new ATOM 0 HE22 GLN A 86 1.470 -13.214 -8.625 1.00 0.00 H new ATOM 1275 N TYR A 87 -0.435 -7.755 -4.803 1.00 0.00 N ATOM 1276 CA TYR A 87 -1.212 -7.682 -3.577 1.00 0.00 C ATOM 1277 C TYR A 87 -2.690 -7.966 -3.848 1.00 0.00 C ATOM 1278 O TYR A 87 -3.302 -7.329 -4.704 1.00 0.00 O ATOM 1279 CB TYR A 87 -1.065 -6.246 -3.070 1.00 0.00 C ATOM 1280 CG TYR A 87 -2.135 -5.831 -2.057 1.00 0.00 C ATOM 1281 CD1 TYR A 87 -3.385 -5.442 -2.494 1.00 0.00 C ATOM 1282 CD2 TYR A 87 -1.850 -5.847 -0.707 1.00 0.00 C ATOM 1283 CE1 TYR A 87 -4.392 -5.052 -1.541 1.00 0.00 C ATOM 1284 CE2 TYR A 87 -2.856 -5.457 0.246 1.00 0.00 C ATOM 1285 CZ TYR A 87 -4.077 -5.079 -0.218 1.00 0.00 C ATOM 1286 OH TYR A 87 -5.028 -4.711 0.682 1.00 0.00 O ATOM 0 H TYR A 87 -0.942 -7.485 -5.646 1.00 0.00 H new ATOM 0 HA TYR A 87 -0.860 -8.418 -2.854 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -0.082 -6.132 -2.612 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -1.101 -5.566 -3.921 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -3.608 -5.430 -3.551 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -0.872 -6.152 -0.365 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -5.374 -4.745 -1.869 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -2.646 -5.464 1.305 1.00 0.00 H new ATOM 0 HH TYR A 87 -4.716 -4.913 1.589 1.00 0.00 H new ATOM 1296 N THR A 88 -3.222 -8.924 -3.102 1.00 0.00 N ATOM 1297 CA THR A 88 -4.618 -9.300 -3.251 1.00 0.00 C ATOM 1298 C THR A 88 -5.512 -8.366 -2.435 1.00 0.00 C ATOM 1299 O THR A 88 -5.291 -8.175 -1.240 1.00 0.00 O ATOM 1300 CB THR A 88 -4.755 -10.772 -2.856 1.00 0.00 C ATOM 1301 OG1 THR A 88 -3.893 -11.457 -3.761 1.00 0.00 O ATOM 1302 CG2 THR A 88 -6.144 -11.335 -3.165 1.00 0.00 C ATOM 0 H THR A 88 -2.712 -9.451 -2.393 1.00 0.00 H new ATOM 0 HA THR A 88 -4.949 -9.193 -4.284 1.00 0.00 H new ATOM 0 HB THR A 88 -4.548 -10.882 -1.792 1.00 0.00 H new ATOM 0 HG1 THR A 88 -3.920 -12.419 -3.574 1.00 0.00 H new ATOM 0 HG21 THR A 88 -6.187 -12.382 -2.865 1.00 0.00 H new ATOM 0 HG22 THR A 88 -6.896 -10.769 -2.616 1.00 0.00 H new ATOM 0 HG23 THR A 88 -6.339 -11.255 -4.234 1.00 0.00 H new ATOM 1310 N ALA A 89 -6.505 -7.808 -3.112 1.00 0.00 N ATOM 1311 CA ALA A 89 -7.434 -6.897 -2.465 1.00 0.00 C ATOM 1312 C ALA A 89 -8.789 -7.589 -2.301 1.00 0.00 C ATOM 1313 O ALA A 89 -9.448 -7.913 -3.289 1.00 0.00 O ATOM 1314 CB ALA A 89 -7.533 -5.605 -3.278 1.00 0.00 C ATOM 0 H ALA A 89 -6.687 -7.969 -4.103 1.00 0.00 H new ATOM 0 HA ALA A 89 -7.078 -6.629 -1.470 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -8.230 -4.922 -2.792 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -6.550 -5.138 -3.339 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -7.889 -5.834 -4.282 1.00 0.00 H new ATOM 1320 N THR A 90 -9.164 -7.796 -1.048 1.00 0.00 N ATOM 1321 CA THR A 90 -10.429 -8.444 -0.743 1.00 0.00 C ATOM 1322 C THR A 90 -11.351 -7.485 0.013 1.00 0.00 C ATOM 1323 O THR A 90 -10.882 -6.559 0.674 1.00 0.00 O ATOM 1324 CB THR A 90 -10.127 -9.731 0.028 1.00 0.00 C ATOM 1325 OG1 THR A 90 -9.323 -9.300 1.122 1.00 0.00 O ATOM 1326 CG2 THR A 90 -9.216 -10.681 -0.752 1.00 0.00 C ATOM 0 H THR A 90 -8.615 -7.527 -0.232 1.00 0.00 H new ATOM 0 HA THR A 90 -10.966 -8.711 -1.653 1.00 0.00 H new ATOM 0 HB THR A 90 -11.062 -10.239 0.266 1.00 0.00 H new ATOM 0 HG1 THR A 90 -9.083 -10.072 1.676 1.00 0.00 H new ATOM 0 HG21 THR A 90 -9.033 -11.578 -0.160 1.00 0.00 H new ATOM 0 HG22 THR A 90 -9.697 -10.957 -1.691 1.00 0.00 H new ATOM 0 HG23 THR A 90 -8.268 -10.186 -0.962 1.00 0.00 H new ATOM 1334 N GLY A 91 -12.645 -7.739 -0.109 1.00 0.00 N ATOM 1335 CA GLY A 91 -13.637 -6.910 0.555 1.00 0.00 C ATOM 1336 C GLY A 91 -13.873 -5.612 -0.220 1.00 0.00 C ATOM 1337 O GLY A 91 -13.825 -4.525 0.354 1.00 0.00 O ATOM 0 H GLY A 91 -13.030 -8.508 -0.658 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -14.574 -7.460 0.645 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -13.304 -6.678 1.567 1.00 0.00 H new ATOM 1341 N LEU A 92 -14.123 -5.768 -1.512 1.00 0.00 N ATOM 1342 CA LEU A 92 -14.366 -4.622 -2.371 1.00 0.00 C ATOM 1343 C LEU A 92 -15.786 -4.706 -2.936 1.00 0.00 C ATOM 1344 O LEU A 92 -16.349 -5.794 -3.050 1.00 0.00 O ATOM 1345 CB LEU A 92 -13.282 -4.517 -3.445 1.00 0.00 C ATOM 1346 CG LEU A 92 -11.845 -4.748 -2.972 1.00 0.00 C ATOM 1347 CD1 LEU A 92 -10.980 -5.310 -4.102 1.00 0.00 C ATOM 1348 CD2 LEU A 92 -11.252 -3.468 -2.379 1.00 0.00 C ATOM 0 H LEU A 92 -14.162 -6.671 -1.985 1.00 0.00 H new ATOM 0 HA LEU A 92 -14.304 -3.697 -1.798 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -13.505 -5.239 -4.231 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -13.340 -3.527 -3.896 1.00 0.00 H new ATOM 0 HG LEU A 92 -11.862 -5.494 -2.178 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -9.964 -5.465 -3.740 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -11.394 -6.260 -4.439 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -10.965 -4.606 -4.934 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -10.230 -3.659 -2.050 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -11.249 -2.684 -3.136 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -11.853 -3.149 -1.528 1.00 0.00 H new ATOM 1360 N LYS A 93 -16.324 -3.544 -3.274 1.00 0.00 N ATOM 1361 CA LYS A 93 -17.667 -3.472 -3.824 1.00 0.00 C ATOM 1362 C LYS A 93 -17.607 -3.708 -5.335 1.00 0.00 C ATOM 1363 O LYS A 93 -16.821 -3.072 -6.035 1.00 0.00 O ATOM 1364 CB LYS A 93 -18.336 -2.153 -3.433 1.00 0.00 C ATOM 1365 CG LYS A 93 -19.812 -2.147 -3.839 1.00 0.00 C ATOM 1366 CD LYS A 93 -20.273 -0.735 -4.207 1.00 0.00 C ATOM 1367 CE LYS A 93 -19.938 -0.411 -5.664 1.00 0.00 C ATOM 1368 NZ LYS A 93 -20.778 0.705 -6.153 1.00 0.00 N ATOM 0 H LYS A 93 -15.854 -2.644 -3.178 1.00 0.00 H new ATOM 0 HA LYS A 93 -18.295 -4.257 -3.403 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -18.250 -2.002 -2.357 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -17.819 -1.322 -3.913 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -19.962 -2.815 -4.687 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -20.420 -2.530 -3.019 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -21.348 -0.647 -4.049 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -19.794 -0.009 -3.550 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -18.884 -0.146 -5.751 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -20.097 -1.293 -6.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -20.538 0.912 -7.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -21.781 0.439 -6.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -20.606 1.550 -5.571 1.00 0.00 H new ATOM 1382 N PRO A 94 -18.471 -4.647 -5.805 1.00 0.00 N ATOM 1383 CA PRO A 94 -18.524 -4.975 -7.219 1.00 0.00 C ATOM 1384 C PRO A 94 -19.236 -3.875 -8.010 1.00 0.00 C ATOM 1385 O PRO A 94 -20.051 -3.136 -7.459 1.00 0.00 O ATOM 1386 CB PRO A 94 -19.242 -6.313 -7.287 1.00 0.00 C ATOM 1387 CG PRO A 94 -19.971 -6.462 -5.961 1.00 0.00 C ATOM 1388 CD PRO A 94 -19.417 -5.420 -5.004 1.00 0.00 C ATOM 0 HA PRO A 94 -17.535 -5.046 -7.671 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -19.942 -6.339 -8.122 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -18.535 -7.129 -7.438 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -21.043 -6.323 -6.097 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -19.828 -7.465 -5.558 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -20.210 -4.786 -4.606 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -18.925 -5.887 -4.151 1.00 0.00 H new ATOM 1396 N GLU A 95 -18.902 -3.800 -9.290 1.00 0.00 N ATOM 1397 CA GLU A 95 -19.499 -2.803 -10.162 1.00 0.00 C ATOM 1398 C GLU A 95 -19.072 -1.398 -9.733 1.00 0.00 C ATOM 1399 O GLU A 95 -19.895 -0.486 -9.673 1.00 0.00 O ATOM 1400 CB GLU A 95 -21.023 -2.932 -10.180 1.00 0.00 C ATOM 1401 CG GLU A 95 -21.471 -4.010 -11.169 1.00 0.00 C ATOM 1402 CD GLU A 95 -21.981 -3.383 -12.468 1.00 0.00 C ATOM 1403 OE1 GLU A 95 -21.208 -2.603 -13.064 1.00 0.00 O ATOM 1404 OE2 GLU A 95 -23.133 -3.700 -12.837 1.00 0.00 O ATOM 0 H GLU A 95 -18.225 -4.414 -9.744 1.00 0.00 H new ATOM 0 HA GLU A 95 -19.141 -2.976 -11.177 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -21.382 -3.178 -9.181 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -21.469 -1.976 -10.452 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -20.638 -4.679 -11.386 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -22.258 -4.616 -10.720 1.00 0.00 H new ATOM 1411 N SER A 96 -17.785 -1.268 -9.444 1.00 0.00 N ATOM 1412 CA SER A 96 -17.239 0.011 -9.022 1.00 0.00 C ATOM 1413 C SER A 96 -15.852 0.215 -9.634 1.00 0.00 C ATOM 1414 O SER A 96 -15.442 -0.537 -10.516 1.00 0.00 O ATOM 1415 CB SER A 96 -17.165 0.101 -7.496 1.00 0.00 C ATOM 1416 OG SER A 96 -17.844 1.249 -6.995 1.00 0.00 O ATOM 0 H SER A 96 -17.105 -2.027 -9.494 1.00 0.00 H new ATOM 0 HA SER A 96 -17.904 0.800 -9.374 1.00 0.00 H new ATOM 0 HB2 SER A 96 -17.600 -0.797 -7.058 1.00 0.00 H new ATOM 0 HB3 SER A 96 -16.121 0.133 -7.185 1.00 0.00 H new ATOM 0 HG SER A 96 -17.436 2.059 -7.368 1.00 0.00 H new ATOM 1422 N VAL A 97 -15.167 1.237 -9.141 1.00 0.00 N ATOM 1423 CA VAL A 97 -13.834 1.550 -9.628 1.00 0.00 C ATOM 1424 C VAL A 97 -12.914 1.832 -8.439 1.00 0.00 C ATOM 1425 O VAL A 97 -12.978 2.906 -7.842 1.00 0.00 O ATOM 1426 CB VAL A 97 -13.900 2.711 -10.622 1.00 0.00 C ATOM 1427 CG1 VAL A 97 -12.506 3.065 -11.144 1.00 0.00 C ATOM 1428 CG2 VAL A 97 -14.853 2.391 -11.776 1.00 0.00 C ATOM 0 H VAL A 97 -15.510 1.859 -8.409 1.00 0.00 H new ATOM 0 HA VAL A 97 -13.415 0.701 -10.168 1.00 0.00 H new ATOM 0 HB VAL A 97 -14.292 3.581 -10.096 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -12.581 3.893 -11.849 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -11.868 3.355 -10.309 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -12.075 2.199 -11.646 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -14.882 3.232 -12.468 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -14.504 1.502 -12.300 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -15.853 2.211 -11.382 1.00 0.00 H new ATOM 1438 N TYR A 98 -12.081 0.850 -8.129 1.00 0.00 N ATOM 1439 CA TYR A 98 -11.149 0.980 -7.022 1.00 0.00 C ATOM 1440 C TYR A 98 -9.774 1.436 -7.513 1.00 0.00 C ATOM 1441 O TYR A 98 -9.195 0.822 -8.408 1.00 0.00 O ATOM 1442 CB TYR A 98 -11.022 -0.418 -6.412 1.00 0.00 C ATOM 1443 CG TYR A 98 -12.073 -0.729 -5.345 1.00 0.00 C ATOM 1444 CD1 TYR A 98 -13.297 -1.250 -5.713 1.00 0.00 C ATOM 1445 CD2 TYR A 98 -11.797 -0.489 -4.014 1.00 0.00 C ATOM 1446 CE1 TYR A 98 -14.286 -1.543 -4.708 1.00 0.00 C ATOM 1447 CE2 TYR A 98 -12.786 -0.782 -3.010 1.00 0.00 C ATOM 1448 CZ TYR A 98 -13.982 -1.294 -3.406 1.00 0.00 C ATOM 1449 OH TYR A 98 -14.916 -1.571 -2.457 1.00 0.00 O ATOM 0 H TYR A 98 -12.032 -0.040 -8.625 1.00 0.00 H new ATOM 0 HA TYR A 98 -11.506 1.719 -6.305 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -11.097 -1.159 -7.208 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -10.030 -0.522 -5.972 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -13.513 -1.438 -6.754 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -10.839 -0.081 -3.726 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -15.248 -1.951 -4.982 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -12.583 -0.599 -1.965 1.00 0.00 H new ATOM 0 HH TYR A 98 -14.561 -1.344 -1.572 1.00 0.00 H new ATOM 1459 N LEU A 99 -9.291 2.510 -6.906 1.00 0.00 N ATOM 1460 CA LEU A 99 -7.994 3.056 -7.270 1.00 0.00 C ATOM 1461 C LEU A 99 -6.917 2.444 -6.372 1.00 0.00 C ATOM 1462 O LEU A 99 -6.989 2.552 -5.149 1.00 0.00 O ATOM 1463 CB LEU A 99 -8.028 4.585 -7.236 1.00 0.00 C ATOM 1464 CG LEU A 99 -6.669 5.287 -7.276 1.00 0.00 C ATOM 1465 CD1 LEU A 99 -5.967 5.201 -5.920 1.00 0.00 C ATOM 1466 CD2 LEU A 99 -5.800 4.734 -8.408 1.00 0.00 C ATOM 0 H LEU A 99 -9.774 3.017 -6.164 1.00 0.00 H new ATOM 0 HA LEU A 99 -7.743 2.789 -8.296 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -8.620 4.934 -8.082 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -8.549 4.897 -6.331 1.00 0.00 H new ATOM 0 HG LEU A 99 -6.836 6.344 -7.485 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -5.004 5.708 -5.976 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -6.585 5.679 -5.160 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -5.812 4.155 -5.656 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -4.840 5.250 -8.415 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -5.638 3.667 -8.254 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -6.303 4.891 -9.362 1.00 0.00 H new ATOM 1478 N PHE A 100 -5.944 1.815 -7.014 1.00 0.00 N ATOM 1479 CA PHE A 100 -4.854 1.186 -6.289 1.00 0.00 C ATOM 1480 C PHE A 100 -3.593 2.052 -6.333 1.00 0.00 C ATOM 1481 O PHE A 100 -3.001 2.238 -7.395 1.00 0.00 O ATOM 1482 CB PHE A 100 -4.566 -0.148 -6.982 1.00 0.00 C ATOM 1483 CG PHE A 100 -5.440 -1.305 -6.492 1.00 0.00 C ATOM 1484 CD1 PHE A 100 -6.744 -1.380 -6.871 1.00 0.00 C ATOM 1485 CD2 PHE A 100 -4.912 -2.258 -5.678 1.00 0.00 C ATOM 1486 CE1 PHE A 100 -7.554 -2.453 -6.416 1.00 0.00 C ATOM 1487 CE2 PHE A 100 -5.723 -3.332 -5.224 1.00 0.00 C ATOM 1488 CZ PHE A 100 -7.027 -3.407 -5.602 1.00 0.00 C ATOM 0 H PHE A 100 -5.888 1.728 -8.029 1.00 0.00 H new ATOM 0 HA PHE A 100 -5.133 1.050 -5.244 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -4.710 -0.027 -8.056 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -3.518 -0.407 -6.828 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -7.163 -0.623 -7.518 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -3.877 -2.198 -5.377 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -8.590 -2.512 -6.716 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -5.304 -4.089 -4.578 1.00 0.00 H new ATOM 0 HZ PHE A 100 -7.644 -4.223 -5.256 1.00 0.00 H new ATOM 1498 N ARG A 101 -3.221 2.559 -5.167 1.00 0.00 N ATOM 1499 CA ARG A 101 -2.042 3.402 -5.059 1.00 0.00 C ATOM 1500 C ARG A 101 -0.875 2.608 -4.469 1.00 0.00 C ATOM 1501 O ARG A 101 -0.903 2.234 -3.298 1.00 0.00 O ATOM 1502 CB ARG A 101 -2.317 4.623 -4.179 1.00 0.00 C ATOM 1503 CG ARG A 101 -1.519 5.836 -4.660 1.00 0.00 C ATOM 1504 CD ARG A 101 -2.370 7.106 -4.611 1.00 0.00 C ATOM 1505 NE ARG A 101 -2.780 7.388 -3.217 1.00 0.00 N ATOM 1506 CZ ARG A 101 -3.808 8.178 -2.881 1.00 0.00 C ATOM 1507 NH1 ARG A 101 -4.538 8.770 -3.837 1.00 0.00 N ATOM 1508 NH2 ARG A 101 -4.108 8.376 -1.590 1.00 0.00 N ATOM 0 H ARG A 101 -3.715 2.402 -4.289 1.00 0.00 H new ATOM 0 HA ARG A 101 -1.784 3.742 -6.062 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -3.382 4.854 -4.194 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -2.055 4.397 -3.145 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -0.633 5.963 -4.038 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -1.171 5.666 -5.679 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -1.804 7.948 -5.010 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -3.252 6.987 -5.241 1.00 0.00 H new ATOM 0 HE ARG A 101 -2.246 6.953 -2.465 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -4.310 8.619 -4.820 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -5.321 9.372 -3.582 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -3.553 7.925 -0.863 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -4.891 8.978 -1.335 1.00 0.00 H new ATOM 1522 N ILE A 102 0.124 2.374 -5.308 1.00 0.00 N ATOM 1523 CA ILE A 102 1.299 1.631 -4.884 1.00 0.00 C ATOM 1524 C ILE A 102 2.427 2.612 -4.559 1.00 0.00 C ATOM 1525 O ILE A 102 2.622 3.597 -5.270 1.00 0.00 O ATOM 1526 CB ILE A 102 1.678 0.584 -5.933 1.00 0.00 C ATOM 1527 CG1 ILE A 102 0.638 -0.538 -5.988 1.00 0.00 C ATOM 1528 CG2 ILE A 102 3.089 0.047 -5.686 1.00 0.00 C ATOM 1529 CD1 ILE A 102 0.638 -1.217 -7.359 1.00 0.00 C ATOM 0 H ILE A 102 0.144 2.686 -6.279 1.00 0.00 H new ATOM 0 HA ILE A 102 1.088 1.073 -3.972 1.00 0.00 H new ATOM 0 HB ILE A 102 1.684 1.066 -6.911 1.00 0.00 H new ATOM 0 HG12 ILE A 102 0.851 -1.275 -5.213 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -0.352 -0.132 -5.779 1.00 0.00 H new ATOM 0 HG21 ILE A 102 3.334 -0.696 -6.445 1.00 0.00 H new ATOM 0 HG22 ILE A 102 3.805 0.868 -5.737 1.00 0.00 H new ATOM 0 HG23 ILE A 102 3.135 -0.414 -4.699 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -0.109 -2.010 -7.372 1.00 0.00 H new ATOM 0 HD12 ILE A 102 0.401 -0.483 -8.129 1.00 0.00 H new ATOM 0 HD13 ILE A 102 1.622 -1.643 -7.554 1.00 0.00 H new ATOM 1541 N THR A 103 3.139 2.310 -3.484 1.00 0.00 N ATOM 1542 CA THR A 103 4.243 3.153 -3.056 1.00 0.00 C ATOM 1543 C THR A 103 5.327 2.310 -2.381 1.00 0.00 C ATOM 1544 O THR A 103 5.072 1.180 -1.967 1.00 0.00 O ATOM 1545 CB THR A 103 3.677 4.251 -2.154 1.00 0.00 C ATOM 1546 OG1 THR A 103 2.461 4.632 -2.792 1.00 0.00 O ATOM 1547 CG2 THR A 103 4.525 5.523 -2.177 1.00 0.00 C ATOM 0 H THR A 103 2.973 1.493 -2.896 1.00 0.00 H new ATOM 0 HA THR A 103 4.730 3.630 -3.907 1.00 0.00 H new ATOM 0 HB THR A 103 3.608 3.880 -1.131 1.00 0.00 H new ATOM 0 HG1 THR A 103 2.027 5.340 -2.272 1.00 0.00 H new ATOM 0 HG21 THR A 103 4.079 6.270 -1.520 1.00 0.00 H new ATOM 0 HG22 THR A 103 5.534 5.294 -1.834 1.00 0.00 H new ATOM 0 HG23 THR A 103 4.568 5.913 -3.194 1.00 0.00 H new ATOM 1555 N ALA A 104 6.513 2.893 -2.290 1.00 0.00 N ATOM 1556 CA ALA A 104 7.637 2.210 -1.672 1.00 0.00 C ATOM 1557 C ALA A 104 8.129 3.026 -0.475 1.00 0.00 C ATOM 1558 O ALA A 104 7.927 4.238 -0.421 1.00 0.00 O ATOM 1559 CB ALA A 104 8.734 1.985 -2.714 1.00 0.00 C ATOM 0 H ALA A 104 6.720 3.831 -2.634 1.00 0.00 H new ATOM 0 HA ALA A 104 7.334 1.231 -1.301 1.00 0.00 H new ATOM 0 HB1 ALA A 104 9.577 1.473 -2.250 1.00 0.00 H new ATOM 0 HB2 ALA A 104 8.343 1.376 -3.529 1.00 0.00 H new ATOM 0 HB3 ALA A 104 9.065 2.946 -3.107 1.00 0.00 H new ATOM 1565 N GLN A 105 8.764 2.328 0.456 1.00 0.00 N ATOM 1566 CA GLN A 105 9.286 2.973 1.649 1.00 0.00 C ATOM 1567 C GLN A 105 10.797 2.758 1.750 1.00 0.00 C ATOM 1568 O GLN A 105 11.271 1.623 1.703 1.00 0.00 O ATOM 1569 CB GLN A 105 8.574 2.464 2.903 1.00 0.00 C ATOM 1570 CG GLN A 105 8.881 3.356 4.108 1.00 0.00 C ATOM 1571 CD GLN A 105 7.869 3.126 5.232 1.00 0.00 C ATOM 1572 OE1 GLN A 105 7.502 4.029 5.967 1.00 0.00 O ATOM 1573 NE2 GLN A 105 7.439 1.871 5.325 1.00 0.00 N ATOM 0 H GLN A 105 8.929 1.323 0.408 1.00 0.00 H new ATOM 0 HA GLN A 105 9.096 4.044 1.573 1.00 0.00 H new ATOM 0 HB2 GLN A 105 7.498 2.438 2.730 1.00 0.00 H new ATOM 0 HB3 GLN A 105 8.887 1.441 3.114 1.00 0.00 H new ATOM 0 HG2 GLN A 105 9.887 3.148 4.472 1.00 0.00 H new ATOM 0 HG3 GLN A 105 8.861 4.403 3.805 1.00 0.00 H new ATOM 0 HE21 GLN A 105 7.787 1.163 4.678 1.00 0.00 H new ATOM 0 HE22 GLN A 105 6.761 1.616 6.044 1.00 0.00 H new ATOM 1582 N THR A 106 11.513 3.864 1.888 1.00 0.00 N ATOM 1583 CA THR A 106 12.961 3.810 1.997 1.00 0.00 C ATOM 1584 C THR A 106 13.421 4.457 3.305 1.00 0.00 C ATOM 1585 O THR A 106 12.604 4.766 4.170 1.00 0.00 O ATOM 1586 CB THR A 106 13.553 4.471 0.751 1.00 0.00 C ATOM 1587 OG1 THR A 106 12.643 5.525 0.451 1.00 0.00 O ATOM 1588 CG2 THR A 106 13.491 3.563 -0.479 1.00 0.00 C ATOM 0 H THR A 106 11.117 4.803 1.927 1.00 0.00 H new ATOM 0 HA THR A 106 13.317 2.781 2.037 1.00 0.00 H new ATOM 0 HB THR A 106 14.589 4.748 0.945 1.00 0.00 H new ATOM 0 HG1 THR A 106 11.858 5.159 -0.006 1.00 0.00 H new ATOM 0 HG21 THR A 106 13.924 4.080 -1.335 1.00 0.00 H new ATOM 0 HG22 THR A 106 14.053 2.649 -0.285 1.00 0.00 H new ATOM 0 HG23 THR A 106 12.452 3.312 -0.694 1.00 0.00 H new ATOM 1596 N ARG A 107 14.729 4.641 3.408 1.00 0.00 N ATOM 1597 CA ARG A 107 15.309 5.245 4.596 1.00 0.00 C ATOM 1598 C ARG A 107 15.088 6.759 4.583 1.00 0.00 C ATOM 1599 O ARG A 107 15.471 7.454 5.524 1.00 0.00 O ATOM 1600 CB ARG A 107 16.808 4.956 4.685 1.00 0.00 C ATOM 1601 CG ARG A 107 17.578 5.711 3.600 1.00 0.00 C ATOM 1602 CD ARG A 107 19.088 5.591 3.815 1.00 0.00 C ATOM 1603 NE ARG A 107 19.580 6.745 4.602 1.00 0.00 N ATOM 1604 CZ ARG A 107 20.876 7.010 4.816 1.00 0.00 C ATOM 1605 NH1 ARG A 107 21.818 6.206 4.304 1.00 0.00 N ATOM 1606 NH2 ARG A 107 21.230 8.079 5.542 1.00 0.00 N ATOM 0 H ARG A 107 15.404 4.382 2.688 1.00 0.00 H new ATOM 0 HA ARG A 107 14.815 4.810 5.464 1.00 0.00 H new ATOM 0 HB2 ARG A 107 17.180 5.245 5.668 1.00 0.00 H new ATOM 0 HB3 ARG A 107 16.982 3.885 4.581 1.00 0.00 H new ATOM 0 HG2 ARG A 107 17.314 5.315 2.619 1.00 0.00 H new ATOM 0 HG3 ARG A 107 17.288 6.762 3.608 1.00 0.00 H new ATOM 0 HD2 ARG A 107 19.317 4.661 4.335 1.00 0.00 H new ATOM 0 HD3 ARG A 107 19.599 5.552 2.853 1.00 0.00 H new ATOM 0 HE ARG A 107 18.889 7.377 5.006 1.00 0.00 H new ATOM 0 HH11 ARG A 107 21.549 5.392 3.751 1.00 0.00 H new ATOM 0 HH12 ARG A 107 22.804 6.408 4.467 1.00 0.00 H new ATOM 0 HH21 ARG A 107 20.513 8.691 5.932 1.00 0.00 H new ATOM 0 HH22 ARG A 107 22.216 8.281 5.705 1.00 0.00 H new ATOM 1620 N LYS A 108 14.473 7.226 3.507 1.00 0.00 N ATOM 1621 CA LYS A 108 14.197 8.645 3.359 1.00 0.00 C ATOM 1622 C LYS A 108 12.706 8.898 3.594 1.00 0.00 C ATOM 1623 O LYS A 108 12.335 9.850 4.279 1.00 0.00 O ATOM 1624 CB LYS A 108 14.700 9.151 2.006 1.00 0.00 C ATOM 1625 CG LYS A 108 16.054 8.529 1.657 1.00 0.00 C ATOM 1626 CD LYS A 108 17.181 9.184 2.459 1.00 0.00 C ATOM 1627 CE LYS A 108 17.106 10.709 2.365 1.00 0.00 C ATOM 1628 NZ LYS A 108 18.416 11.314 2.695 1.00 0.00 N ATOM 0 H LYS A 108 14.158 6.647 2.729 1.00 0.00 H new ATOM 0 HA LYS A 108 14.741 9.218 4.110 1.00 0.00 H new ATOM 0 HB2 LYS A 108 13.974 8.909 1.230 1.00 0.00 H new ATOM 0 HB3 LYS A 108 14.790 10.237 2.030 1.00 0.00 H new ATOM 0 HG2 LYS A 108 16.031 7.459 1.863 1.00 0.00 H new ATOM 0 HG3 LYS A 108 16.247 8.644 0.590 1.00 0.00 H new ATOM 0 HD2 LYS A 108 17.115 8.877 3.503 1.00 0.00 H new ATOM 0 HD3 LYS A 108 18.145 8.840 2.085 1.00 0.00 H new ATOM 0 HE2 LYS A 108 16.806 11.003 1.359 1.00 0.00 H new ATOM 0 HE3 LYS A 108 16.343 11.084 3.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 18.492 12.247 2.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 18.498 11.423 3.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 19.180 10.698 2.350 1.00 0.00 H new ATOM 1642 N GLY A 109 11.893 8.028 3.013 1.00 0.00 N ATOM 1643 CA GLY A 109 10.451 8.145 3.151 1.00 0.00 C ATOM 1644 C GLY A 109 9.732 7.459 1.988 1.00 0.00 C ATOM 1645 O GLY A 109 10.329 6.659 1.269 1.00 0.00 O ATOM 0 H GLY A 109 12.205 7.240 2.446 1.00 0.00 H new ATOM 0 HA2 GLY A 109 10.135 7.698 4.093 1.00 0.00 H new ATOM 0 HA3 GLY A 109 10.170 9.197 3.187 1.00 0.00 H new ATOM 1649 N TRP A 110 8.459 7.798 1.838 1.00 0.00 N ATOM 1650 CA TRP A 110 7.653 7.225 0.774 1.00 0.00 C ATOM 1651 C TRP A 110 7.788 8.122 -0.458 1.00 0.00 C ATOM 1652 O TRP A 110 7.436 9.300 -0.414 1.00 0.00 O ATOM 1653 CB TRP A 110 6.202 7.042 1.224 1.00 0.00 C ATOM 1654 CG TRP A 110 6.021 6.007 2.337 1.00 0.00 C ATOM 1655 CD1 TRP A 110 6.118 6.193 3.660 1.00 0.00 C ATOM 1656 CD2 TRP A 110 5.705 4.609 2.167 1.00 0.00 C ATOM 1657 NE1 TRP A 110 5.889 5.022 4.354 1.00 0.00 N ATOM 1658 CE2 TRP A 110 5.630 4.028 3.417 1.00 0.00 C ATOM 1659 CE3 TRP A 110 5.490 3.860 0.997 1.00 0.00 C ATOM 1660 CZ2 TRP A 110 5.339 2.673 3.616 1.00 0.00 C ATOM 1661 CZ3 TRP A 110 5.201 2.508 1.213 1.00 0.00 C ATOM 1662 CH2 TRP A 110 5.121 1.908 2.464 1.00 0.00 C ATOM 0 H TRP A 110 7.967 8.462 2.436 1.00 0.00 H new ATOM 0 HA TRP A 110 8.007 6.226 0.517 1.00 0.00 H new ATOM 0 HB2 TRP A 110 5.815 8.001 1.568 1.00 0.00 H new ATOM 0 HB3 TRP A 110 5.601 6.745 0.365 1.00 0.00 H new ATOM 0 HD1 TRP A 110 6.347 7.140 4.125 1.00 0.00 H new ATOM 0 HE1 TRP A 110 5.907 4.907 5.367 1.00 0.00 H new ATOM 0 HE3 TRP A 110 5.544 4.294 0.009 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 5.286 2.241 4.605 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 5.028 1.887 0.346 1.00 0.00 H new ATOM 0 HH2 TRP A 110 4.892 0.856 2.547 1.00 0.00 H new ATOM 1673 N GLY A 111 8.299 7.531 -1.528 1.00 0.00 N ATOM 1674 CA GLY A 111 8.485 8.262 -2.769 1.00 0.00 C ATOM 1675 C GLY A 111 7.171 8.367 -3.546 1.00 0.00 C ATOM 1676 O GLY A 111 6.093 8.349 -2.954 1.00 0.00 O ATOM 0 H GLY A 111 8.590 6.554 -1.561 1.00 0.00 H new ATOM 0 HA2 GLY A 111 8.865 9.261 -2.553 1.00 0.00 H new ATOM 0 HA3 GLY A 111 9.235 7.761 -3.381 1.00 0.00 H new ATOM 1680 N GLU A 112 7.304 8.474 -4.860 1.00 0.00 N ATOM 1681 CA GLU A 112 6.141 8.582 -5.724 1.00 0.00 C ATOM 1682 C GLU A 112 5.164 7.438 -5.444 1.00 0.00 C ATOM 1683 O GLU A 112 5.467 6.534 -4.667 1.00 0.00 O ATOM 1684 CB GLU A 112 6.553 8.603 -7.197 1.00 0.00 C ATOM 1685 CG GLU A 112 6.206 9.945 -7.844 1.00 0.00 C ATOM 1686 CD GLU A 112 7.473 10.731 -8.189 1.00 0.00 C ATOM 1687 OE1 GLU A 112 8.239 11.015 -7.243 1.00 0.00 O ATOM 1688 OE2 GLU A 112 7.646 11.030 -9.390 1.00 0.00 O ATOM 0 H GLU A 112 8.200 8.488 -5.347 1.00 0.00 H new ATOM 0 HA GLU A 112 5.638 9.525 -5.508 1.00 0.00 H new ATOM 0 HB2 GLU A 112 7.624 8.421 -7.281 1.00 0.00 H new ATOM 0 HB3 GLU A 112 6.050 7.797 -7.731 1.00 0.00 H new ATOM 0 HG2 GLU A 112 5.621 9.776 -8.748 1.00 0.00 H new ATOM 0 HG3 GLU A 112 5.584 10.530 -7.166 1.00 0.00 H new ATOM 1695 N ALA A 113 4.011 7.516 -6.091 1.00 0.00 N ATOM 1696 CA ALA A 113 2.987 6.498 -5.922 1.00 0.00 C ATOM 1697 C ALA A 113 2.292 6.252 -7.262 1.00 0.00 C ATOM 1698 O ALA A 113 1.846 7.193 -7.916 1.00 0.00 O ATOM 1699 CB ALA A 113 2.010 6.935 -4.829 1.00 0.00 C ATOM 0 H ALA A 113 3.763 8.268 -6.733 1.00 0.00 H new ATOM 0 HA ALA A 113 3.431 5.555 -5.604 1.00 0.00 H new ATOM 0 HB1 ALA A 113 1.242 6.172 -4.702 1.00 0.00 H new ATOM 0 HB2 ALA A 113 2.549 7.067 -3.891 1.00 0.00 H new ATOM 0 HB3 ALA A 113 1.542 7.877 -5.115 1.00 0.00 H new ATOM 1705 N ALA A 114 2.221 4.981 -7.631 1.00 0.00 N ATOM 1706 CA ALA A 114 1.587 4.599 -8.881 1.00 0.00 C ATOM 1707 C ALA A 114 0.108 4.300 -8.628 1.00 0.00 C ATOM 1708 O ALA A 114 -0.224 3.398 -7.862 1.00 0.00 O ATOM 1709 CB ALA A 114 2.329 3.405 -9.486 1.00 0.00 C ATOM 0 H ALA A 114 2.592 4.203 -7.086 1.00 0.00 H new ATOM 0 HA ALA A 114 1.639 5.414 -9.602 1.00 0.00 H new ATOM 0 HB1 ALA A 114 1.853 3.118 -10.424 1.00 0.00 H new ATOM 0 HB2 ALA A 114 3.367 3.679 -9.674 1.00 0.00 H new ATOM 0 HB3 ALA A 114 2.296 2.566 -8.791 1.00 0.00 H new ATOM 1715 N GLU A 115 -0.740 5.076 -9.287 1.00 0.00 N ATOM 1716 CA GLU A 115 -2.176 4.905 -9.143 1.00 0.00 C ATOM 1717 C GLU A 115 -2.730 4.067 -10.297 1.00 0.00 C ATOM 1718 O GLU A 115 -2.506 4.387 -11.464 1.00 0.00 O ATOM 1719 CB GLU A 115 -2.883 6.259 -9.060 1.00 0.00 C ATOM 1720 CG GLU A 115 -3.132 6.660 -7.604 1.00 0.00 C ATOM 1721 CD GLU A 115 -4.279 7.667 -7.501 1.00 0.00 C ATOM 1722 OE1 GLU A 115 -5.155 7.622 -8.391 1.00 0.00 O ATOM 1723 OE2 GLU A 115 -4.253 8.459 -6.534 1.00 0.00 O ATOM 0 H GLU A 115 -0.461 5.824 -9.922 1.00 0.00 H new ATOM 0 HA GLU A 115 -2.367 4.374 -8.211 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -2.277 7.020 -9.552 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -3.831 6.211 -9.595 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -3.367 5.774 -7.014 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -2.225 7.092 -7.182 1.00 0.00 H new ATOM 1730 N ALA A 116 -3.441 3.011 -9.932 1.00 0.00 N ATOM 1731 CA ALA A 116 -4.028 2.125 -10.922 1.00 0.00 C ATOM 1732 C ALA A 116 -5.484 1.842 -10.548 1.00 0.00 C ATOM 1733 O ALA A 116 -5.763 1.346 -9.457 1.00 0.00 O ATOM 1734 CB ALA A 116 -3.193 0.847 -11.023 1.00 0.00 C ATOM 0 H ALA A 116 -3.624 2.749 -8.963 1.00 0.00 H new ATOM 0 HA ALA A 116 -4.026 2.594 -11.906 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -3.634 0.182 -11.766 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -2.175 1.100 -11.320 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -3.174 0.347 -10.055 1.00 0.00 H new ATOM 1740 N LEU A 117 -6.374 2.169 -11.473 1.00 0.00 N ATOM 1741 CA LEU A 117 -7.795 1.956 -11.254 1.00 0.00 C ATOM 1742 C LEU A 117 -8.187 0.575 -11.784 1.00 0.00 C ATOM 1743 O LEU A 117 -7.725 0.160 -12.846 1.00 0.00 O ATOM 1744 CB LEU A 117 -8.608 3.101 -11.859 1.00 0.00 C ATOM 1745 CG LEU A 117 -8.577 4.425 -11.093 1.00 0.00 C ATOM 1746 CD1 LEU A 117 -8.379 5.606 -12.045 1.00 0.00 C ATOM 1747 CD2 LEU A 117 -9.829 4.589 -10.229 1.00 0.00 C ATOM 0 H LEU A 117 -6.139 2.580 -12.376 1.00 0.00 H new ATOM 0 HA LEU A 117 -8.022 1.964 -10.188 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -8.246 3.281 -12.871 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -9.646 2.778 -11.944 1.00 0.00 H new ATOM 0 HG LEU A 117 -7.721 4.408 -10.419 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -8.361 6.534 -11.474 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -7.436 5.489 -12.578 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -9.199 5.637 -12.762 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -9.781 5.538 -9.695 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -10.714 4.574 -10.865 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -9.885 3.771 -9.510 1.00 0.00 H new ATOM 1759 N VAL A 118 -9.035 -0.098 -11.021 1.00 0.00 N ATOM 1760 CA VAL A 118 -9.495 -1.423 -11.401 1.00 0.00 C ATOM 1761 C VAL A 118 -10.952 -1.596 -10.968 1.00 0.00 C ATOM 1762 O VAL A 118 -11.280 -1.421 -9.795 1.00 0.00 O ATOM 1763 CB VAL A 118 -8.566 -2.487 -10.813 1.00 0.00 C ATOM 1764 CG1 VAL A 118 -8.542 -2.411 -9.285 1.00 0.00 C ATOM 1765 CG2 VAL A 118 -8.967 -3.886 -11.286 1.00 0.00 C ATOM 0 H VAL A 118 -9.416 0.249 -10.141 1.00 0.00 H new ATOM 0 HA VAL A 118 -9.462 -1.543 -12.484 1.00 0.00 H new ATOM 0 HB VAL A 118 -7.557 -2.287 -11.174 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -7.874 -3.178 -8.893 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -8.187 -1.428 -8.975 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -9.548 -2.573 -8.897 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -8.291 -4.624 -10.854 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -9.988 -4.099 -10.968 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -8.908 -3.933 -12.373 1.00 0.00 H new ATOM 1775 N VAL A 119 -11.788 -1.937 -11.938 1.00 0.00 N ATOM 1776 CA VAL A 119 -13.202 -2.136 -11.672 1.00 0.00 C ATOM 1777 C VAL A 119 -13.433 -3.577 -11.213 1.00 0.00 C ATOM 1778 O VAL A 119 -12.738 -4.491 -11.653 1.00 0.00 O ATOM 1779 CB VAL A 119 -14.024 -1.763 -12.907 1.00 0.00 C ATOM 1780 CG1 VAL A 119 -15.406 -2.419 -12.865 1.00 0.00 C ATOM 1781 CG2 VAL A 119 -14.143 -0.244 -13.049 1.00 0.00 C ATOM 0 H VAL A 119 -11.513 -2.080 -12.910 1.00 0.00 H new ATOM 0 HA VAL A 119 -13.535 -1.481 -10.866 1.00 0.00 H new ATOM 0 HB VAL A 119 -13.500 -2.142 -13.784 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -15.970 -2.137 -13.754 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -15.294 -3.503 -12.835 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -15.941 -2.085 -11.976 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -14.732 -0.006 -13.935 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -14.633 0.167 -12.166 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -13.149 0.191 -13.147 1.00 0.00 H new ATOM 1791 N THR A 120 -14.412 -3.735 -10.334 1.00 0.00 N ATOM 1792 CA THR A 120 -14.743 -5.049 -9.811 1.00 0.00 C ATOM 1793 C THR A 120 -15.914 -5.653 -10.588 1.00 0.00 C ATOM 1794 O THR A 120 -17.017 -5.109 -10.578 1.00 0.00 O ATOM 1795 CB THR A 120 -15.017 -4.907 -8.312 1.00 0.00 C ATOM 1796 OG1 THR A 120 -15.836 -3.745 -8.219 1.00 0.00 O ATOM 1797 CG2 THR A 120 -13.760 -4.541 -7.520 1.00 0.00 C ATOM 0 H THR A 120 -14.987 -2.974 -9.971 1.00 0.00 H new ATOM 0 HA THR A 120 -13.915 -5.746 -9.940 1.00 0.00 H new ATOM 0 HB THR A 120 -15.430 -5.840 -7.928 1.00 0.00 H new ATOM 0 HG1 THR A 120 -15.824 -3.409 -7.298 1.00 0.00 H new ATOM 0 HG21 THR A 120 -14.009 -4.452 -6.463 1.00 0.00 H new ATOM 0 HG22 THR A 120 -13.008 -5.319 -7.652 1.00 0.00 H new ATOM 0 HG23 THR A 120 -13.366 -3.591 -7.881 1.00 0.00 H new ATOM 1805 N THR A 121 -15.635 -6.771 -11.243 1.00 0.00 N ATOM 1806 CA THR A 121 -16.652 -7.454 -12.024 1.00 0.00 C ATOM 1807 C THR A 121 -16.103 -8.771 -12.578 1.00 0.00 C ATOM 1808 O THR A 121 -14.903 -9.028 -12.502 1.00 0.00 O ATOM 1809 CB THR A 121 -17.139 -6.494 -13.110 1.00 0.00 C ATOM 1810 OG1 THR A 121 -17.993 -7.294 -13.923 1.00 0.00 O ATOM 1811 CG2 THR A 121 -16.018 -6.064 -14.058 1.00 0.00 C ATOM 0 H THR A 121 -14.719 -7.220 -11.249 1.00 0.00 H new ATOM 0 HA THR A 121 -17.507 -7.728 -11.406 1.00 0.00 H new ATOM 0 HB THR A 121 -17.578 -5.612 -12.644 1.00 0.00 H new ATOM 0 HG1 THR A 121 -18.355 -6.749 -14.653 1.00 0.00 H new ATOM 0 HG21 THR A 121 -16.418 -5.383 -14.809 1.00 0.00 H new ATOM 0 HG22 THR A 121 -15.236 -5.560 -13.491 1.00 0.00 H new ATOM 0 HG23 THR A 121 -15.601 -6.943 -14.550 1.00 0.00 H new ATOM 1819 N GLU A 122 -17.009 -9.569 -13.124 1.00 0.00 N ATOM 1820 CA GLU A 122 -16.631 -10.852 -13.691 1.00 0.00 C ATOM 1821 C GLU A 122 -16.418 -10.724 -15.200 1.00 0.00 C ATOM 1822 O GLU A 122 -15.759 -11.563 -15.812 1.00 0.00 O ATOM 1823 CB GLU A 122 -17.678 -11.922 -13.374 1.00 0.00 C ATOM 1824 CG GLU A 122 -17.904 -12.037 -11.865 1.00 0.00 C ATOM 1825 CD GLU A 122 -19.204 -12.785 -11.561 1.00 0.00 C ATOM 1826 OE1 GLU A 122 -19.311 -13.944 -12.015 1.00 0.00 O ATOM 1827 OE2 GLU A 122 -20.061 -12.180 -10.881 1.00 0.00 O ATOM 0 H GLU A 122 -18.004 -9.352 -13.186 1.00 0.00 H new ATOM 0 HA GLU A 122 -15.691 -11.164 -13.236 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -18.617 -11.675 -13.868 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -17.352 -12.884 -13.771 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -17.064 -12.559 -11.407 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -17.941 -11.042 -11.422 1.00 0.00 H new ATOM 1834 N LYS A 123 -16.989 -9.666 -15.758 1.00 0.00 N ATOM 1835 CA LYS A 123 -16.871 -9.417 -17.185 1.00 0.00 C ATOM 1836 C LYS A 123 -15.554 -8.689 -17.463 1.00 0.00 C ATOM 1837 O LYS A 123 -15.139 -7.831 -16.686 1.00 0.00 O ATOM 1838 CB LYS A 123 -18.105 -8.676 -17.703 1.00 0.00 C ATOM 1839 CG LYS A 123 -19.326 -9.597 -17.732 1.00 0.00 C ATOM 1840 CD LYS A 123 -20.523 -8.942 -17.041 1.00 0.00 C ATOM 1841 CE LYS A 123 -21.071 -7.783 -17.876 1.00 0.00 C ATOM 1842 NZ LYS A 123 -21.692 -6.763 -17.001 1.00 0.00 N ATOM 0 H LYS A 123 -17.535 -8.972 -15.248 1.00 0.00 H new ATOM 0 HA LYS A 123 -16.839 -10.357 -17.735 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -18.310 -7.815 -17.067 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -17.910 -8.293 -18.705 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -19.583 -9.834 -18.764 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -19.087 -10.539 -17.238 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -21.306 -9.683 -16.883 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -20.225 -8.578 -16.058 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -20.266 -7.332 -18.456 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -21.807 -8.156 -18.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -22.059 -5.983 -17.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -22.473 -7.193 -16.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -20.980 -6.395 -16.338 1.00 0.00 H new ATOM 1856 N ARG A 124 -14.934 -9.059 -18.574 1.00 0.00 N ATOM 1857 CA ARG A 124 -13.673 -8.452 -18.965 1.00 0.00 C ATOM 1858 C ARG A 124 -13.768 -6.927 -18.876 1.00 0.00 C ATOM 1859 O ARG A 124 -14.831 -6.353 -19.106 1.00 0.00 O ATOM 1860 CB ARG A 124 -13.288 -8.850 -20.391 1.00 0.00 C ATOM 1861 CG ARG A 124 -11.774 -9.025 -20.522 1.00 0.00 C ATOM 1862 CD ARG A 124 -11.431 -10.374 -21.157 1.00 0.00 C ATOM 1863 NE ARG A 124 -10.876 -10.169 -22.513 1.00 0.00 N ATOM 1864 CZ ARG A 124 -10.402 -11.154 -23.288 1.00 0.00 C ATOM 1865 NH1 ARG A 124 -10.412 -12.418 -22.845 1.00 0.00 N ATOM 1866 NH2 ARG A 124 -9.917 -10.875 -24.506 1.00 0.00 N ATOM 0 H ARG A 124 -15.281 -9.772 -19.216 1.00 0.00 H new ATOM 0 HA ARG A 124 -12.905 -8.812 -18.280 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -13.790 -9.779 -20.661 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -13.631 -8.088 -21.090 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -11.362 -8.218 -21.128 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -11.310 -8.953 -19.539 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -10.709 -10.904 -20.536 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -12.324 -10.997 -21.211 1.00 0.00 H new ATOM 0 HE ARG A 124 -10.853 -9.218 -22.881 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -10.780 -12.631 -21.918 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -10.051 -13.168 -23.435 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -9.909 -9.912 -24.843 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -9.556 -11.625 -25.095 1.00 0.00 H new ATOM 1880 N SER A 125 -12.641 -6.315 -18.542 1.00 0.00 N ATOM 1881 CA SER A 125 -12.584 -4.868 -18.420 1.00 0.00 C ATOM 1882 C SER A 125 -11.131 -4.413 -18.265 1.00 0.00 C ATOM 1883 O SER A 125 -10.394 -4.950 -17.440 1.00 0.00 O ATOM 1884 CB SER A 125 -13.422 -4.381 -17.236 1.00 0.00 C ATOM 1885 OG SER A 125 -13.917 -3.061 -17.439 1.00 0.00 O ATOM 0 H SER A 125 -11.761 -6.794 -18.352 1.00 0.00 H new ATOM 0 HA SER A 125 -13.000 -4.432 -19.328 1.00 0.00 H new ATOM 0 HB2 SER A 125 -14.259 -5.062 -17.080 1.00 0.00 H new ATOM 0 HB3 SER A 125 -12.817 -4.406 -16.329 1.00 0.00 H new ATOM 0 HG SER A 125 -14.448 -2.788 -16.662 1.00 0.00 H new ATOM 1891 N GLY A 126 -10.764 -3.428 -19.071 1.00 0.00 N ATOM 1892 CA GLY A 126 -9.413 -2.895 -19.033 1.00 0.00 C ATOM 1893 C GLY A 126 -8.682 -3.160 -20.351 1.00 0.00 C ATOM 1894 O GLY A 126 -8.150 -4.249 -20.562 1.00 0.00 O ATOM 0 H GLY A 126 -11.378 -2.985 -19.754 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -9.447 -1.823 -18.841 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -8.862 -3.349 -18.210 1.00 0.00 H new ATOM 1898 N PRO A 127 -8.679 -2.119 -21.226 1.00 0.00 N ATOM 1899 CA PRO A 127 -8.022 -2.229 -22.518 1.00 0.00 C ATOM 1900 C PRO A 127 -6.501 -2.152 -22.368 1.00 0.00 C ATOM 1901 O PRO A 127 -5.995 -1.859 -21.286 1.00 0.00 O ATOM 1902 CB PRO A 127 -8.595 -1.092 -23.349 1.00 0.00 C ATOM 1903 CG PRO A 127 -9.198 -0.113 -22.355 1.00 0.00 C ATOM 1904 CD PRO A 127 -9.298 -0.815 -21.010 1.00 0.00 C ATOM 0 HA PRO A 127 -8.203 -3.189 -23.002 1.00 0.00 H new ATOM 0 HB2 PRO A 127 -7.818 -0.614 -23.946 1.00 0.00 H new ATOM 0 HB3 PRO A 127 -9.351 -1.458 -24.044 1.00 0.00 H new ATOM 0 HG2 PRO A 127 -8.578 0.780 -22.274 1.00 0.00 H new ATOM 0 HG3 PRO A 127 -10.183 0.213 -22.690 1.00 0.00 H new ATOM 0 HD2 PRO A 127 -8.780 -0.255 -20.231 1.00 0.00 H new ATOM 0 HD3 PRO A 127 -10.336 -0.917 -20.693 1.00 0.00 H new ATOM 1912 N SER A 128 -5.816 -2.421 -23.470 1.00 0.00 N ATOM 1913 CA SER A 128 -4.363 -2.386 -23.474 1.00 0.00 C ATOM 1914 C SER A 128 -3.860 -1.711 -24.751 1.00 0.00 C ATOM 1915 O SER A 128 -4.465 -1.853 -25.813 1.00 0.00 O ATOM 1916 CB SER A 128 -3.778 -3.795 -23.353 1.00 0.00 C ATOM 1917 OG SER A 128 -3.045 -3.966 -22.143 1.00 0.00 O ATOM 0 H SER A 128 -6.240 -2.664 -24.365 1.00 0.00 H new ATOM 0 HA SER A 128 -4.032 -1.809 -22.611 1.00 0.00 H new ATOM 0 HB2 SER A 128 -4.584 -4.527 -23.395 1.00 0.00 H new ATOM 0 HB3 SER A 128 -3.125 -3.991 -24.203 1.00 0.00 H new ATOM 0 HG SER A 128 -2.689 -4.878 -22.102 1.00 0.00 H new ATOM 1923 N SER A 129 -2.758 -0.989 -24.607 1.00 0.00 N ATOM 1924 CA SER A 129 -2.167 -0.292 -25.736 1.00 0.00 C ATOM 1925 C SER A 129 -0.647 -0.226 -25.573 1.00 0.00 C ATOM 1926 O SER A 129 -0.133 -0.335 -24.461 1.00 0.00 O ATOM 1927 CB SER A 129 -2.747 1.117 -25.877 1.00 0.00 C ATOM 1928 OG SER A 129 -3.019 1.448 -27.236 1.00 0.00 O ATOM 0 H SER A 129 -2.259 -0.872 -23.725 1.00 0.00 H new ATOM 0 HA SER A 129 -2.405 -0.847 -26.644 1.00 0.00 H new ATOM 0 HB2 SER A 129 -3.666 1.191 -25.295 1.00 0.00 H new ATOM 0 HB3 SER A 129 -2.047 1.841 -25.461 1.00 0.00 H new ATOM 0 HG SER A 129 -3.389 2.354 -27.284 1.00 0.00 H new ATOM 1934 N GLY A 130 0.030 -0.048 -26.698 1.00 0.00 N ATOM 1935 CA GLY A 130 1.480 0.033 -26.694 1.00 0.00 C ATOM 1936 C GLY A 130 1.965 1.224 -27.524 1.00 0.00 C ATOM 1937 O GLY A 130 3.142 1.578 -27.479 1.00 0.00 O ATOM 0 H GLY A 130 -0.400 0.042 -27.619 1.00 0.00 H new ATOM 0 HA2 GLY A 130 1.840 0.129 -25.669 1.00 0.00 H new ATOM 0 HA3 GLY A 130 1.900 -0.889 -27.095 1.00 0.00 H new TER 1941 GLY A 130