USER MOD reduce.3.24.130724 H: found=0, std=0, add=840, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 842 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: B 31 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: B 35 LYS NZ :NH3+ 163:sc= -0.0102 (180deg=-0.186) USER MOD Set 2.1: B 22 TYR OH : rot 0:sc= -1.51 USER MOD Set 2.2: B 52 GLN : amide:sc= -0.507 K(o=-2,f=-0.068) USER MOD Set 3.1: A 22 TYR OH : rot 15:sc= -0.682 USER MOD Set 3.2: A 52 GLN : amide:sc= -0.548 K(o=-1.2,f=-2.9!) USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 CYS SG : rot 60:sc= -1.78 USER MOD Single : A 14 GLN : amide:sc= -3.77! K(o=-3.8!,f=-2.6) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ -158:sc= -0.107 (180deg=-0.763) USER MOD Single : A 27 MET CE :methyl -148:sc= -0.445 (180deg=-3.05!) USER MOD Single : A 30 MET CE :methyl -159:sc= -3.51 (180deg=-5.78!) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 155:sc= 0.00429 (180deg=0) USER MOD Single : A 40 ASN : amide:sc= -0.747 K(o=-0.75,f=-6.4!) USER MOD Single : A 45 SER OG : rot -70:sc= -0.235 USER MOD Single : A 53 TYR OH : rot 13:sc= -0.124 USER MOD Single : A 56 ASN : amide:sc= -3.15! X(o=-3.2!,f=-2.9) USER MOD Single : A 58 TYR OH : rot 69:sc= 0.195 USER MOD Single : B 12 TYR OH : rot 180:sc= 0 USER MOD Single : B 13 CYS SG : rot 70:sc= -1.54 USER MOD Single : B 14 GLN : amide:sc= -3.4! K(o=-3.4!,f=-2.2) USER MOD Single : B 15 LYS NZ :NH3+ -163:sc= 0.768 (180deg=0.678) USER MOD Single : B 19 LYS NZ :NH3+ -164:sc= -0.161 (180deg=-0.767) USER MOD Single : B 27 MET CE :methyl -147:sc= -0.48 (180deg=-3.24!) USER MOD Single : B 30 MET CE :methyl 173:sc= -3.09 (180deg=-3.13!) USER MOD Single : B 40 ASN : amide:sc= -0.0615 K(o=-0.062,f=-1.6!) USER MOD Single : B 45 SER OG : rot -68:sc= -0.346 USER MOD Single : B 53 TYR OH : rot 16:sc= 0.488 USER MOD Single : B 56 ASN : amide:sc= -2.75! C(o=-2.7!,f=-6.3!) USER MOD ----------------------------------------------------------------- ATOM 106 N PHE A 9 44.219 22.567 17.806 1.00 44.59 N ATOM 107 CA PHE A 9 42.754 22.777 17.753 1.00 42.14 C ATOM 108 C PHE A 9 42.481 24.266 17.551 1.00 41.09 C ATOM 109 O PHE A 9 41.846 24.670 16.598 1.00 40.10 O ATOM 110 CB PHE A 9 42.126 22.297 19.075 1.00 39.48 C ATOM 111 CG PHE A 9 40.695 21.915 18.837 1.00 35.93 C ATOM 112 CD1 PHE A 9 39.698 22.887 18.933 1.00 33.89 C ATOM 113 CD2 PHE A 9 40.366 20.596 18.515 1.00 34.84 C ATOM 114 CE1 PHE A 9 38.370 22.540 18.706 1.00 31.72 C ATOM 115 CE2 PHE A 9 39.035 20.251 18.287 1.00 33.98 C ATOM 116 CZ PHE A 9 38.040 21.227 18.384 1.00 33.09 C ATOM 0 HA PHE A 9 42.318 22.213 16.929 1.00 42.14 H new ATOM 0 HB2 PHE A 9 42.681 21.444 19.466 1.00 39.48 H new ATOM 0 HB3 PHE A 9 42.183 23.086 19.825 1.00 39.48 H new ATOM 0 HD1 PHE A 9 39.957 23.905 19.183 1.00 33.89 H new ATOM 0 HD2 PHE A 9 41.140 19.846 18.443 1.00 34.84 H new ATOM 0 HE1 PHE A 9 37.596 23.289 18.780 1.00 31.72 H new ATOM 0 HE2 PHE A 9 38.774 19.233 18.036 1.00 33.98 H new ATOM 0 HZ PHE A 9 37.008 20.961 18.208 1.00 33.09 H new ATOM 126 N LEU A 10 42.974 25.084 18.436 1.00 40.61 N ATOM 127 CA LEU A 10 42.763 26.546 18.287 1.00 40.95 C ATOM 128 C LEU A 10 43.445 27.002 17.002 1.00 41.08 C ATOM 129 O LEU A 10 42.969 27.883 16.314 1.00 37.24 O ATOM 130 CB LEU A 10 43.356 27.275 19.491 1.00 41.66 C ATOM 131 CG LEU A 10 42.778 26.679 20.779 1.00 43.24 C ATOM 132 CD1 LEU A 10 43.456 27.320 21.984 1.00 42.19 C ATOM 133 CD2 LEU A 10 41.269 26.942 20.850 1.00 41.41 C ATOM 0 H LEU A 10 43.513 24.803 19.255 1.00 40.61 H new ATOM 0 HA LEU A 10 41.698 26.773 18.237 1.00 40.95 H new ATOM 0 HB2 LEU A 10 44.442 27.181 19.489 1.00 41.66 H new ATOM 0 HB3 LEU A 10 43.128 28.339 19.435 1.00 41.66 H new ATOM 0 HG LEU A 10 42.956 25.604 20.783 1.00 43.24 H new ATOM 0 HD11 LEU A 10 43.045 26.896 22.901 1.00 42.19 H new ATOM 0 HD12 LEU A 10 44.528 27.127 21.944 1.00 42.19 H new ATOM 0 HD13 LEU A 10 43.280 28.396 21.971 1.00 42.19 H new ATOM 0 HD21 LEU A 10 40.868 26.514 21.769 1.00 41.41 H new ATOM 0 HD22 LEU A 10 41.086 28.016 20.840 1.00 41.41 H new ATOM 0 HD23 LEU A 10 40.779 26.482 19.992 1.00 41.41 H new ATOM 145 N ASP A 11 44.544 26.391 16.654 1.00 41.30 N ATOM 146 CA ASP A 11 45.224 26.781 15.394 1.00 41.83 C ATOM 147 C ASP A 11 44.240 26.557 14.249 1.00 40.90 C ATOM 148 O ASP A 11 43.995 27.441 13.452 1.00 39.80 O ATOM 149 CB ASP A 11 46.479 25.927 15.183 1.00 44.60 C ATOM 150 CG ASP A 11 47.375 26.585 14.133 1.00 47.53 C ATOM 151 OD1 ASP A 11 47.932 27.629 14.428 1.00 48.01 O ATOM 152 OD2 ASP A 11 47.490 26.033 13.050 1.00 48.56 O ATOM 0 H ASP A 11 44.995 25.645 17.184 1.00 41.30 H new ATOM 0 HA ASP A 11 45.531 27.826 15.436 1.00 41.83 H new ATOM 0 HB2 ASP A 11 47.021 25.820 16.123 1.00 44.60 H new ATOM 0 HB3 ASP A 11 46.199 24.924 14.860 1.00 44.60 H new ATOM 157 N TYR A 12 43.643 25.392 14.172 1.00 39.29 N ATOM 158 CA TYR A 12 42.654 25.166 13.085 1.00 38.27 C ATOM 159 C TYR A 12 41.570 26.217 13.235 1.00 34.82 C ATOM 160 O TYR A 12 41.179 26.868 12.290 1.00 33.76 O ATOM 161 CB TYR A 12 41.988 23.789 13.190 1.00 42.68 C ATOM 162 CG TYR A 12 42.997 22.657 13.249 1.00 45.94 C ATOM 163 CD1 TYR A 12 44.148 22.649 12.440 1.00 47.36 C ATOM 164 CD2 TYR A 12 42.755 21.588 14.117 1.00 48.31 C ATOM 165 CE1 TYR A 12 45.042 21.572 12.511 1.00 48.74 C ATOM 166 CE2 TYR A 12 43.642 20.522 14.187 1.00 49.78 C ATOM 167 CZ TYR A 12 44.788 20.508 13.385 1.00 49.89 C ATOM 168 OH TYR A 12 45.667 19.447 13.456 1.00 52.12 O ATOM 0 H TYR A 12 43.796 24.606 14.803 1.00 39.29 H new ATOM 0 HA TYR A 12 43.170 25.223 12.127 1.00 38.27 H new ATOM 0 HB2 TYR A 12 41.361 23.759 14.081 1.00 42.68 H new ATOM 0 HB3 TYR A 12 41.331 23.641 12.333 1.00 42.68 H new ATOM 0 HD1 TYR A 12 44.342 23.470 11.766 1.00 47.36 H new ATOM 0 HD2 TYR A 12 41.871 21.591 14.738 1.00 48.31 H new ATOM 0 HE1 TYR A 12 45.927 21.563 11.892 1.00 48.74 H new ATOM 0 HE2 TYR A 12 43.447 19.702 14.862 1.00 49.78 H new ATOM 0 HH TYR A 12 45.342 18.796 14.112 1.00 52.12 H new ATOM 178 N CYS A 13 41.083 26.400 14.429 1.00 32.26 N ATOM 179 CA CYS A 13 40.035 27.422 14.638 1.00 30.43 C ATOM 180 C CYS A 13 40.525 28.728 14.027 1.00 30.74 C ATOM 181 O CYS A 13 39.957 29.227 13.084 1.00 28.86 O ATOM 182 CB CYS A 13 39.785 27.603 16.135 1.00 30.34 C ATOM 183 SG CYS A 13 39.507 25.985 16.896 1.00 24.58 S ATOM 0 H CYS A 13 41.367 25.886 15.263 1.00 32.26 H new ATOM 0 HA CYS A 13 39.101 27.115 14.167 1.00 30.43 H new ATOM 0 HB2 CYS A 13 40.639 28.095 16.601 1.00 30.34 H new ATOM 0 HB3 CYS A 13 38.920 28.246 16.296 1.00 30.34 H new ATOM 0 HG CYS A 13 40.550 25.232 16.707 1.00 24.58 H new ATOM 189 N GLN A 14 41.600 29.264 14.536 1.00 32.92 N ATOM 190 CA GLN A 14 42.142 30.528 13.966 1.00 34.93 C ATOM 191 C GLN A 14 42.219 30.399 12.441 1.00 35.74 C ATOM 192 O GLN A 14 41.933 31.327 11.717 1.00 35.15 O ATOM 193 CB GLN A 14 43.538 30.796 14.550 1.00 36.23 C ATOM 194 CG GLN A 14 43.854 32.294 14.487 1.00 40.72 C ATOM 195 CD GLN A 14 44.043 32.721 13.030 1.00 42.88 C ATOM 196 OE1 GLN A 14 45.082 32.485 12.445 1.00 45.84 O ATOM 197 NE2 GLN A 14 43.075 33.344 12.415 1.00 44.23 N ATOM 0 H GLN A 14 42.126 28.881 15.322 1.00 32.92 H new ATOM 0 HA GLN A 14 41.488 31.362 14.221 1.00 34.93 H new ATOM 0 HB2 GLN A 14 43.582 30.450 15.583 1.00 36.23 H new ATOM 0 HB3 GLN A 14 44.288 30.234 13.993 1.00 36.23 H new ATOM 0 HG2 GLN A 14 43.045 32.866 14.941 1.00 40.72 H new ATOM 0 HG3 GLN A 14 44.756 32.509 15.059 1.00 40.72 H new ATOM 0 HE21 GLN A 14 42.203 33.542 12.906 1.00 44.23 H new ATOM 0 HE22 GLN A 14 43.190 33.633 11.444 1.00 44.23 H new ATOM 206 N LYS A 15 42.583 29.250 11.944 1.00 35.66 N ATOM 207 CA LYS A 15 42.642 29.078 10.469 1.00 36.27 C ATOM 208 C LYS A 15 41.205 29.070 9.946 1.00 34.97 C ATOM 209 O LYS A 15 40.813 29.902 9.158 1.00 34.84 O ATOM 210 CB LYS A 15 43.325 27.747 10.144 1.00 40.22 C ATOM 211 CG LYS A 15 44.772 27.723 10.715 1.00 44.18 C ATOM 212 CD LYS A 15 45.805 27.659 9.582 1.00 47.52 C ATOM 213 CE LYS A 15 45.893 26.228 9.049 1.00 50.10 C ATOM 214 NZ LYS A 15 46.869 26.173 7.925 1.00 50.42 N ATOM 0 H LYS A 15 42.840 28.429 12.492 1.00 35.66 H new ATOM 0 HA LYS A 15 43.209 29.884 10.003 1.00 36.27 H new ATOM 0 HB2 LYS A 15 42.748 26.923 10.565 1.00 40.22 H new ATOM 0 HB3 LYS A 15 43.351 27.599 9.064 1.00 40.22 H new ATOM 0 HG2 LYS A 15 44.944 28.613 11.320 1.00 44.18 H new ATOM 0 HG3 LYS A 15 44.894 26.863 11.373 1.00 44.18 H new ATOM 0 HD2 LYS A 15 45.522 28.340 8.779 1.00 47.52 H new ATOM 0 HD3 LYS A 15 46.780 27.983 9.946 1.00 47.52 H new ATOM 0 HE2 LYS A 15 46.202 25.551 9.845 1.00 50.10 H new ATOM 0 HE3 LYS A 15 44.912 25.895 8.709 1.00 50.10 H new ATOM 0 HZ1 LYS A 15 46.928 25.200 7.564 1.00 50.42 H new ATOM 0 HZ2 LYS A 15 46.556 26.807 7.162 1.00 50.42 H new ATOM 0 HZ3 LYS A 15 47.805 26.474 8.263 1.00 50.42 H new ATOM 228 N LEU A 16 40.394 28.158 10.415 1.00 31.52 N ATOM 229 CA LEU A 16 38.969 28.133 9.975 1.00 30.64 C ATOM 230 C LEU A 16 38.418 29.549 10.136 1.00 29.20 C ATOM 231 O LEU A 16 37.689 30.060 9.309 1.00 30.83 O ATOM 232 CB LEU A 16 38.194 27.156 10.871 1.00 29.49 C ATOM 233 CG LEU A 16 36.889 26.706 10.195 1.00 29.11 C ATOM 234 CD1 LEU A 16 37.188 25.896 8.919 1.00 29.81 C ATOM 235 CD2 LEU A 16 36.087 25.840 11.184 1.00 25.98 C ATOM 0 H LEU A 16 40.656 27.432 11.082 1.00 31.52 H new ATOM 0 HA LEU A 16 38.874 27.809 8.939 1.00 30.64 H new ATOM 0 HB2 LEU A 16 38.814 26.286 11.088 1.00 29.49 H new ATOM 0 HB3 LEU A 16 37.968 27.633 11.825 1.00 29.49 H new ATOM 0 HG LEU A 16 36.311 27.586 9.914 1.00 29.11 H new ATOM 0 HD11 LEU A 16 36.251 25.587 8.456 1.00 29.81 H new ATOM 0 HD12 LEU A 16 37.752 26.513 8.220 1.00 29.81 H new ATOM 0 HD13 LEU A 16 37.773 25.013 9.177 1.00 29.81 H new ATOM 0 HD21 LEU A 16 35.159 25.516 10.714 1.00 25.98 H new ATOM 0 HD22 LEU A 16 36.676 24.967 11.464 1.00 25.98 H new ATOM 0 HD23 LEU A 16 35.857 26.424 12.075 1.00 25.98 H new ATOM 247 N LEU A 17 38.815 30.184 11.198 1.00 27.96 N ATOM 248 CA LEU A 17 38.394 31.584 11.462 1.00 28.93 C ATOM 249 C LEU A 17 38.928 32.461 10.324 1.00 30.06 C ATOM 250 O LEU A 17 38.282 33.387 9.876 1.00 30.41 O ATOM 251 CB LEU A 17 39.019 32.029 12.794 1.00 24.89 C ATOM 252 CG LEU A 17 38.277 33.248 13.384 1.00 25.03 C ATOM 253 CD1 LEU A 17 37.136 32.779 14.305 1.00 21.31 C ATOM 254 CD2 LEU A 17 39.260 34.100 14.206 1.00 20.22 C ATOM 0 H LEU A 17 39.426 29.783 11.909 1.00 27.96 H new ATOM 0 HA LEU A 17 37.309 31.668 11.518 1.00 28.93 H new ATOM 0 HB2 LEU A 17 38.989 31.204 13.505 1.00 24.89 H new ATOM 0 HB3 LEU A 17 40.069 32.279 12.640 1.00 24.89 H new ATOM 0 HG LEU A 17 37.864 33.838 12.565 1.00 25.03 H new ATOM 0 HD11 LEU A 17 36.620 33.647 14.715 1.00 21.31 H new ATOM 0 HD12 LEU A 17 36.432 32.175 13.733 1.00 21.31 H new ATOM 0 HD13 LEU A 17 37.548 32.183 15.119 1.00 21.31 H new ATOM 0 HD21 LEU A 17 38.736 34.960 14.622 1.00 20.22 H new ATOM 0 HD22 LEU A 17 39.672 33.499 15.017 1.00 20.22 H new ATOM 0 HD23 LEU A 17 40.069 34.445 13.562 1.00 20.22 H new ATOM 266 N GLU A 18 40.116 32.162 9.857 1.00 32.20 N ATOM 267 CA GLU A 18 40.716 32.960 8.750 1.00 35.35 C ATOM 268 C GLU A 18 40.095 32.507 7.421 1.00 35.74 C ATOM 269 O GLU A 18 39.748 33.313 6.580 1.00 35.74 O ATOM 270 CB GLU A 18 42.262 32.773 8.768 1.00 37.07 C ATOM 271 CG GLU A 18 42.758 31.841 7.646 1.00 39.76 C ATOM 272 CD GLU A 18 44.264 31.621 7.802 1.00 41.67 C ATOM 273 OE1 GLU A 18 44.816 32.104 8.777 1.00 43.93 O ATOM 274 OE2 GLU A 18 44.839 30.972 6.944 1.00 43.25 O ATOM 0 H GLU A 18 40.696 31.396 10.199 1.00 32.20 H new ATOM 0 HA GLU A 18 40.508 34.023 8.875 1.00 35.35 H new ATOM 0 HB2 GLU A 18 42.743 33.746 8.667 1.00 37.07 H new ATOM 0 HB3 GLU A 18 42.564 32.367 9.733 1.00 37.07 H new ATOM 0 HG2 GLU A 18 42.233 30.887 7.691 1.00 39.76 H new ATOM 0 HG3 GLU A 18 42.542 32.279 6.671 1.00 39.76 H new ATOM 281 N LYS A 19 39.945 31.224 7.231 1.00 37.19 N ATOM 282 CA LYS A 19 39.340 30.727 5.967 1.00 36.85 C ATOM 283 C LYS A 19 38.021 31.460 5.730 1.00 36.69 C ATOM 284 O LYS A 19 37.718 31.888 4.634 1.00 36.88 O ATOM 285 CB LYS A 19 39.097 29.229 6.077 1.00 36.86 C ATOM 286 CG LYS A 19 39.005 28.642 4.670 1.00 40.15 C ATOM 287 CD LYS A 19 38.490 27.230 4.778 1.00 41.50 C ATOM 288 CE LYS A 19 38.517 26.557 3.405 1.00 44.93 C ATOM 289 NZ LYS A 19 37.957 27.488 2.384 1.00 44.88 N ATOM 0 H LYS A 19 40.216 30.501 7.897 1.00 37.19 H new ATOM 0 HA LYS A 19 40.013 30.913 5.130 1.00 36.85 H new ATOM 0 HB2 LYS A 19 39.907 28.755 6.632 1.00 36.86 H new ATOM 0 HB3 LYS A 19 38.177 29.035 6.628 1.00 36.86 H new ATOM 0 HG2 LYS A 19 38.339 29.243 4.051 1.00 40.15 H new ATOM 0 HG3 LYS A 19 39.983 28.653 4.189 1.00 40.15 H new ATOM 0 HD2 LYS A 19 39.101 26.664 5.482 1.00 41.50 H new ATOM 0 HD3 LYS A 19 37.473 27.234 5.170 1.00 41.50 H new ATOM 0 HE2 LYS A 19 39.539 26.284 3.142 1.00 44.93 H new ATOM 0 HE3 LYS A 19 37.937 25.635 3.429 1.00 44.93 H new ATOM 0 HZ1 LYS A 19 37.628 26.944 1.561 1.00 44.88 H new ATOM 0 HZ2 LYS A 19 37.158 28.012 2.794 1.00 44.88 H new ATOM 0 HZ3 LYS A 19 38.694 28.158 2.084 1.00 44.88 H new ATOM 303 N PHE A 20 37.239 31.617 6.764 1.00 34.99 N ATOM 304 CA PHE A 20 35.941 32.330 6.640 1.00 34.93 C ATOM 305 C PHE A 20 36.128 33.771 7.119 1.00 34.32 C ATOM 306 O PHE A 20 35.209 34.566 7.114 1.00 35.01 O ATOM 307 CB PHE A 20 34.919 31.624 7.525 1.00 34.20 C ATOM 308 CG PHE A 20 34.498 30.331 6.875 1.00 33.79 C ATOM 309 CD1 PHE A 20 35.256 29.173 7.076 1.00 32.30 C ATOM 310 CD2 PHE A 20 33.358 30.291 6.064 1.00 34.75 C ATOM 311 CE1 PHE A 20 34.875 27.974 6.467 1.00 34.86 C ATOM 312 CE2 PHE A 20 32.978 29.093 5.452 1.00 35.66 C ATOM 313 CZ PHE A 20 33.738 27.933 5.654 1.00 35.69 C ATOM 0 H PHE A 20 37.450 31.275 7.702 1.00 34.99 H new ATOM 0 HA PHE A 20 35.596 32.331 5.606 1.00 34.93 H new ATOM 0 HB2 PHE A 20 35.348 31.427 8.507 1.00 34.20 H new ATOM 0 HB3 PHE A 20 34.051 32.265 7.679 1.00 34.20 H new ATOM 0 HD1 PHE A 20 36.136 29.205 7.702 1.00 32.30 H new ATOM 0 HD2 PHE A 20 32.772 31.185 5.911 1.00 34.75 H new ATOM 0 HE1 PHE A 20 35.459 27.079 6.624 1.00 34.86 H new ATOM 0 HE2 PHE A 20 32.100 29.061 4.824 1.00 35.66 H new ATOM 0 HZ PHE A 20 33.445 27.007 5.182 1.00 35.69 H new ATOM 323 N ARG A 21 37.321 34.105 7.534 1.00 34.35 N ATOM 324 CA ARG A 21 37.600 35.487 8.018 1.00 34.08 C ATOM 325 C ARG A 21 36.598 35.878 9.107 1.00 33.06 C ATOM 326 O ARG A 21 36.179 37.016 9.189 1.00 31.60 O ATOM 327 CB ARG A 21 37.495 36.473 6.849 1.00 37.64 C ATOM 328 CG ARG A 21 38.727 36.340 5.938 1.00 41.19 C ATOM 329 CD ARG A 21 39.996 36.843 6.655 1.00 45.12 C ATOM 330 NE ARG A 21 40.936 37.412 5.649 1.00 48.87 N ATOM 331 CZ ARG A 21 41.930 38.163 6.037 1.00 50.17 C ATOM 332 NH1 ARG A 21 42.100 38.415 7.306 1.00 52.38 N ATOM 333 NH2 ARG A 21 42.755 38.662 5.157 1.00 50.69 N ATOM 0 H ARG A 21 38.121 33.473 7.558 1.00 34.35 H new ATOM 0 HA ARG A 21 38.607 35.518 8.434 1.00 34.08 H new ATOM 0 HB2 ARG A 21 36.587 36.278 6.278 1.00 37.64 H new ATOM 0 HB3 ARG A 21 37.420 37.492 7.228 1.00 37.64 H new ATOM 0 HG2 ARG A 21 38.858 35.298 5.646 1.00 41.19 H new ATOM 0 HG3 ARG A 21 38.571 36.911 5.022 1.00 41.19 H new ATOM 0 HD2 ARG A 21 39.734 37.600 7.394 1.00 45.12 H new ATOM 0 HD3 ARG A 21 40.473 36.024 7.193 1.00 45.12 H new ATOM 0 HE ARG A 21 40.803 37.215 4.657 1.00 48.87 H new ATOM 0 HH11 ARG A 21 41.456 38.025 7.994 1.00 52.38 H new ATOM 0 HH12 ARG A 21 42.877 39.002 7.610 1.00 52.38 H new ATOM 0 HH21 ARG A 21 42.623 38.465 4.165 1.00 50.69 H new ATOM 0 HH22 ARG A 21 43.532 39.249 5.461 1.00 50.69 H new ATOM 347 N TYR A 22 36.211 34.957 9.949 1.00 30.22 N ATOM 348 CA TYR A 22 35.246 35.308 11.023 1.00 29.11 C ATOM 349 C TYR A 22 35.957 36.219 12.059 1.00 27.15 C ATOM 350 O TYR A 22 37.146 36.077 12.263 1.00 25.96 O ATOM 351 CB TYR A 22 34.793 34.020 11.726 1.00 27.09 C ATOM 352 CG TYR A 22 33.695 33.312 10.939 1.00 27.40 C ATOM 353 CD1 TYR A 22 32.482 33.962 10.640 1.00 26.95 C ATOM 354 CD2 TYR A 22 33.891 31.989 10.513 1.00 25.13 C ATOM 355 CE1 TYR A 22 31.485 33.291 9.921 1.00 26.07 C ATOM 356 CE2 TYR A 22 32.891 31.324 9.794 1.00 24.89 C ATOM 357 CZ TYR A 22 31.689 31.974 9.498 1.00 24.53 C ATOM 358 OH TYR A 22 30.704 31.316 8.790 1.00 21.93 O ATOM 0 H TYR A 22 36.520 33.985 9.938 1.00 30.22 H new ATOM 0 HA TYR A 22 34.386 35.824 10.597 1.00 29.11 H new ATOM 0 HB2 TYR A 22 35.645 33.351 11.847 1.00 27.09 H new ATOM 0 HB3 TYR A 22 34.430 34.258 12.726 1.00 27.09 H new ATOM 0 HD1 TYR A 22 32.320 34.979 10.966 1.00 26.95 H new ATOM 0 HD2 TYR A 22 34.817 31.482 10.741 1.00 25.13 H new ATOM 0 HE1 TYR A 22 30.556 33.792 9.693 1.00 26.07 H new ATOM 0 HE2 TYR A 22 33.048 30.307 9.467 1.00 24.89 H new ATOM 0 HH TYR A 22 30.045 31.965 8.466 1.00 21.93 H new ATOM 368 N PRO A 23 35.220 37.107 12.710 1.00 25.95 N ATOM 369 CA PRO A 23 35.804 37.993 13.741 1.00 26.49 C ATOM 370 C PRO A 23 36.514 37.151 14.817 1.00 26.35 C ATOM 371 O PRO A 23 36.490 35.941 14.782 1.00 24.48 O ATOM 372 CB PRO A 23 34.601 38.763 14.336 1.00 27.06 C ATOM 373 CG PRO A 23 33.328 38.302 13.572 1.00 29.61 C ATOM 374 CD PRO A 23 33.776 37.308 12.479 1.00 27.83 C ATOM 0 HA PRO A 23 36.552 38.674 13.335 1.00 26.49 H new ATOM 0 HB2 PRO A 23 34.504 38.558 15.402 1.00 27.06 H new ATOM 0 HB3 PRO A 23 34.744 39.838 14.230 1.00 27.06 H new ATOM 0 HG2 PRO A 23 32.622 37.829 14.254 1.00 29.61 H new ATOM 0 HG3 PRO A 23 32.818 39.156 13.127 1.00 29.61 H new ATOM 0 HD2 PRO A 23 33.230 36.367 12.554 1.00 27.83 H new ATOM 0 HD3 PRO A 23 33.588 37.707 11.482 1.00 27.83 H new ATOM 382 N TRP A 24 37.152 37.789 15.763 1.00 23.75 N ATOM 383 CA TRP A 24 37.872 37.028 16.832 1.00 24.21 C ATOM 384 C TRP A 24 36.896 36.531 17.907 1.00 24.68 C ATOM 385 O TRP A 24 37.239 35.694 18.718 1.00 22.18 O ATOM 386 CB TRP A 24 38.928 37.927 17.482 1.00 24.39 C ATOM 387 CG TRP A 24 39.595 37.186 18.600 1.00 26.00 C ATOM 388 CD1 TRP A 24 39.534 37.536 19.906 1.00 27.56 C ATOM 389 CD2 TRP A 24 40.416 35.980 18.539 1.00 24.99 C ATOM 390 NE1 TRP A 24 40.262 36.624 20.649 1.00 24.44 N ATOM 391 CE2 TRP A 24 40.824 35.647 19.852 1.00 27.17 C ATOM 392 CE3 TRP A 24 40.841 35.151 17.483 1.00 27.07 C ATOM 393 CZ2 TRP A 24 41.625 34.532 20.109 1.00 26.88 C ATOM 394 CZ3 TRP A 24 41.647 34.030 17.740 1.00 28.86 C ATOM 395 CH2 TRP A 24 42.037 33.721 19.049 1.00 27.85 C ATOM 0 H TRP A 24 37.207 38.804 15.843 1.00 23.75 H new ATOM 0 HA TRP A 24 38.351 36.164 16.372 1.00 24.21 H new ATOM 0 HB2 TRP A 24 39.667 38.232 16.741 1.00 24.39 H new ATOM 0 HB3 TRP A 24 38.463 38.837 17.861 1.00 24.39 H new ATOM 0 HD1 TRP A 24 39.003 38.389 20.303 1.00 27.56 H new ATOM 0 HE1 TRP A 24 40.370 36.668 21.662 1.00 24.44 H new ATOM 0 HE3 TRP A 24 40.545 35.379 16.469 1.00 27.07 H new ATOM 0 HZ2 TRP A 24 41.924 34.299 21.120 1.00 26.88 H new ATOM 0 HZ3 TRP A 24 41.968 33.402 16.922 1.00 28.86 H new ATOM 0 HH2 TRP A 24 42.656 32.856 19.239 1.00 27.85 H new ATOM 406 N GLU A 25 35.697 37.042 17.942 1.00 21.18 N ATOM 407 CA GLU A 25 34.733 36.593 18.991 1.00 25.10 C ATOM 408 C GLU A 25 34.081 35.258 18.600 1.00 23.53 C ATOM 409 O GLU A 25 33.416 34.645 19.408 1.00 22.15 O ATOM 410 CB GLU A 25 33.645 37.661 19.195 1.00 30.80 C ATOM 411 CG GLU A 25 33.270 38.291 17.849 1.00 38.77 C ATOM 412 CD GLU A 25 31.891 38.949 17.950 1.00 43.31 C ATOM 413 OE1 GLU A 25 31.783 39.950 18.639 1.00 45.94 O ATOM 414 OE2 GLU A 25 30.968 38.440 17.335 1.00 46.36 O ATOM 0 H GLU A 25 35.342 37.747 17.295 1.00 21.18 H new ATOM 0 HA GLU A 25 35.282 36.451 19.922 1.00 25.10 H new ATOM 0 HB2 GLU A 25 32.764 37.212 19.654 1.00 30.80 H new ATOM 0 HB3 GLU A 25 34.003 38.431 19.879 1.00 30.80 H new ATOM 0 HG2 GLU A 25 34.017 39.032 17.563 1.00 38.77 H new ATOM 0 HG3 GLU A 25 33.263 37.529 17.070 1.00 38.77 H new ATOM 421 N LEU A 26 34.228 34.811 17.371 1.00 21.26 N ATOM 422 CA LEU A 26 33.575 33.521 16.961 1.00 20.65 C ATOM 423 C LEU A 26 34.528 32.342 17.117 1.00 20.00 C ATOM 424 O LEU A 26 34.318 31.292 16.542 1.00 16.59 O ATOM 425 CB LEU A 26 33.123 33.604 15.507 1.00 23.25 C ATOM 426 CG LEU A 26 32.366 34.914 15.257 1.00 26.24 C ATOM 427 CD1 LEU A 26 31.603 34.806 13.940 1.00 29.07 C ATOM 428 CD2 LEU A 26 31.366 35.183 16.390 1.00 26.56 C ATOM 0 H LEU A 26 34.766 35.278 16.641 1.00 21.26 H new ATOM 0 HA LEU A 26 32.715 33.364 17.612 1.00 20.65 H new ATOM 0 HB2 LEU A 26 33.988 33.545 14.847 1.00 23.25 H new ATOM 0 HB3 LEU A 26 32.482 32.755 15.270 1.00 23.25 H new ATOM 0 HG LEU A 26 33.084 35.733 15.215 1.00 26.24 H new ATOM 0 HD11 LEU A 26 31.062 35.734 13.756 1.00 29.07 H new ATOM 0 HD12 LEU A 26 32.306 34.628 13.126 1.00 29.07 H new ATOM 0 HD13 LEU A 26 30.895 33.979 13.996 1.00 29.07 H new ATOM 0 HD21 LEU A 26 30.838 36.117 16.195 1.00 26.56 H new ATOM 0 HD22 LEU A 26 30.648 34.365 16.444 1.00 26.56 H new ATOM 0 HD23 LEU A 26 31.901 35.259 17.337 1.00 26.56 H new ATOM 440 N MET A 27 35.546 32.473 17.915 1.00 18.56 N ATOM 441 CA MET A 27 36.446 31.315 18.111 1.00 17.95 C ATOM 442 C MET A 27 35.681 30.190 18.845 1.00 17.26 C ATOM 443 O MET A 27 35.872 29.035 18.518 1.00 15.06 O ATOM 444 CB MET A 27 37.704 31.722 18.897 1.00 20.02 C ATOM 445 CG MET A 27 38.680 32.442 17.968 1.00 18.07 C ATOM 446 SD MET A 27 39.525 31.242 16.904 1.00 11.26 S ATOM 447 CE MET A 27 40.459 30.378 18.193 1.00 20.89 C ATOM 0 H MET A 27 35.789 33.318 18.431 1.00 18.56 H new ATOM 0 HA MET A 27 36.772 30.950 17.137 1.00 17.95 H new ATOM 0 HB2 MET A 27 37.431 32.372 19.728 1.00 20.02 H new ATOM 0 HB3 MET A 27 38.179 30.839 19.325 1.00 20.02 H new ATOM 0 HG2 MET A 27 38.144 33.168 17.357 1.00 18.07 H new ATOM 0 HG3 MET A 27 39.411 32.997 18.555 1.00 18.07 H new ATOM 0 HE1 MET A 27 41.407 30.029 17.783 1.00 20.89 H new ATOM 0 HE2 MET A 27 40.651 31.059 19.022 1.00 20.89 H new ATOM 0 HE3 MET A 27 39.882 29.525 18.550 1.00 20.89 H new ATOM 457 N PRO A 28 34.815 30.525 19.803 1.00 16.29 N ATOM 458 CA PRO A 28 34.037 29.494 20.517 1.00 17.09 C ATOM 459 C PRO A 28 33.168 28.733 19.511 1.00 15.81 C ATOM 460 O PRO A 28 32.812 27.601 19.724 1.00 16.73 O ATOM 461 CB PRO A 28 33.180 30.284 21.538 1.00 16.95 C ATOM 462 CG PRO A 28 33.758 31.718 21.577 1.00 18.75 C ATOM 463 CD PRO A 28 34.533 31.906 20.265 1.00 16.75 C ATOM 0 HA PRO A 28 34.656 28.751 21.020 1.00 17.09 H new ATOM 0 HB2 PRO A 28 32.132 30.296 21.238 1.00 16.95 H new ATOM 0 HB3 PRO A 28 33.225 29.820 22.523 1.00 16.95 H new ATOM 0 HG2 PRO A 28 32.961 32.456 21.667 1.00 18.75 H new ATOM 0 HG3 PRO A 28 34.413 31.850 22.438 1.00 18.75 H new ATOM 0 HD2 PRO A 28 33.945 32.458 19.532 1.00 16.75 H new ATOM 0 HD3 PRO A 28 35.453 32.468 20.424 1.00 16.75 H new ATOM 471 N LEU A 29 32.839 29.347 18.406 1.00 15.35 N ATOM 472 CA LEU A 29 32.010 28.649 17.381 1.00 15.54 C ATOM 473 C LEU A 29 32.938 27.841 16.478 1.00 15.13 C ATOM 474 O LEU A 29 32.739 26.660 16.271 1.00 14.57 O ATOM 475 CB LEU A 29 31.227 29.683 16.568 1.00 15.26 C ATOM 476 CG LEU A 29 30.483 30.621 17.529 1.00 13.96 C ATOM 477 CD1 LEU A 29 29.618 31.592 16.722 1.00 15.02 C ATOM 478 CD2 LEU A 29 29.588 29.794 18.474 1.00 15.96 C ATOM 0 H LEU A 29 33.109 30.302 18.169 1.00 15.35 H new ATOM 0 HA LEU A 29 31.296 27.977 17.858 1.00 15.54 H new ATOM 0 HB2 LEU A 29 31.905 30.255 15.935 1.00 15.26 H new ATOM 0 HB3 LEU A 29 30.519 29.183 15.907 1.00 15.26 H new ATOM 0 HG LEU A 29 31.206 31.182 18.120 1.00 13.96 H new ATOM 0 HD11 LEU A 29 29.089 32.259 17.402 1.00 15.02 H new ATOM 0 HD12 LEU A 29 30.253 32.179 16.058 1.00 15.02 H new ATOM 0 HD13 LEU A 29 28.896 31.030 16.130 1.00 15.02 H new ATOM 0 HD21 LEU A 29 29.062 30.463 19.155 1.00 15.96 H new ATOM 0 HD22 LEU A 29 28.863 29.229 17.887 1.00 15.96 H new ATOM 0 HD23 LEU A 29 30.206 29.104 19.049 1.00 15.96 H new ATOM 490 N MET A 30 33.975 28.448 15.968 1.00 15.06 N ATOM 491 CA MET A 30 34.927 27.683 15.121 1.00 12.45 C ATOM 492 C MET A 30 35.410 26.489 15.946 1.00 12.90 C ATOM 493 O MET A 30 35.576 25.392 15.451 1.00 14.81 O ATOM 494 CB MET A 30 36.123 28.580 14.765 1.00 15.01 C ATOM 495 CG MET A 30 35.824 29.385 13.502 1.00 12.65 C ATOM 496 SD MET A 30 34.385 30.456 13.781 1.00 8.44 S ATOM 497 CE MET A 30 33.259 29.712 12.570 1.00 27.75 C ATOM 0 H MET A 30 34.201 29.434 16.101 1.00 15.06 H new ATOM 0 HA MET A 30 34.451 27.349 14.199 1.00 12.45 H new ATOM 0 HB2 MET A 30 36.339 29.256 15.593 1.00 15.01 H new ATOM 0 HB3 MET A 30 37.012 27.969 14.613 1.00 15.01 H new ATOM 0 HG2 MET A 30 36.690 29.988 13.231 1.00 12.65 H new ATOM 0 HG3 MET A 30 35.631 28.711 12.667 1.00 12.65 H new ATOM 0 HE1 MET A 30 32.476 30.426 12.314 1.00 27.75 H new ATOM 0 HE2 MET A 30 33.815 29.446 11.671 1.00 27.75 H new ATOM 0 HE3 MET A 30 32.807 28.816 12.996 1.00 27.75 H new ATOM 507 N TYR A 31 35.631 26.716 17.211 1.00 13.07 N ATOM 508 CA TYR A 31 36.102 25.626 18.108 1.00 15.35 C ATOM 509 C TYR A 31 35.116 24.450 18.059 1.00 16.32 C ATOM 510 O TYR A 31 35.483 23.330 17.763 1.00 15.86 O ATOM 511 CB TYR A 31 36.197 26.162 19.542 1.00 14.82 C ATOM 512 CG TYR A 31 36.488 25.027 20.497 1.00 17.46 C ATOM 513 CD1 TYR A 31 35.434 24.255 20.997 1.00 20.04 C ATOM 514 CD2 TYR A 31 37.806 24.747 20.885 1.00 19.91 C ATOM 515 CE1 TYR A 31 35.690 23.204 21.881 1.00 21.64 C ATOM 516 CE2 TYR A 31 38.062 23.692 21.768 1.00 22.38 C ATOM 517 CZ TYR A 31 37.005 22.921 22.268 1.00 23.93 C ATOM 518 OH TYR A 31 37.260 21.883 23.140 1.00 30.09 O ATOM 0 H TYR A 31 35.504 27.620 17.665 1.00 13.07 H new ATOM 0 HA TYR A 31 37.082 25.281 17.780 1.00 15.35 H new ATOM 0 HB2 TYR A 31 36.983 26.914 19.607 1.00 14.82 H new ATOM 0 HB3 TYR A 31 35.263 26.652 19.819 1.00 14.82 H new ATOM 0 HD1 TYR A 31 34.419 24.472 20.699 1.00 20.04 H new ATOM 0 HD2 TYR A 31 38.621 25.344 20.503 1.00 19.91 H new ATOM 0 HE1 TYR A 31 34.874 22.610 22.266 1.00 21.64 H new ATOM 0 HE2 TYR A 31 39.077 23.472 22.065 1.00 22.38 H new ATOM 0 HH TYR A 31 38.224 21.822 23.303 1.00 30.09 H new ATOM 528 N VAL A 32 33.870 24.695 18.360 1.00 16.31 N ATOM 529 CA VAL A 32 32.863 23.592 18.349 1.00 13.79 C ATOM 530 C VAL A 32 32.797 22.939 16.967 1.00 15.33 C ATOM 531 O VAL A 32 32.901 21.736 16.842 1.00 15.78 O ATOM 532 CB VAL A 32 31.486 24.153 18.708 1.00 15.68 C ATOM 533 CG1 VAL A 32 30.477 23.009 18.758 1.00 14.40 C ATOM 534 CG2 VAL A 32 31.545 24.839 20.077 1.00 13.96 C ATOM 0 H VAL A 32 33.504 25.613 18.614 1.00 16.31 H new ATOM 0 HA VAL A 32 33.161 22.841 19.081 1.00 13.79 H new ATOM 0 HB VAL A 32 31.184 24.881 17.955 1.00 15.68 H new ATOM 0 HG11 VAL A 32 29.493 23.403 19.014 1.00 14.40 H new ATOM 0 HG12 VAL A 32 30.431 22.521 17.784 1.00 14.40 H new ATOM 0 HG13 VAL A 32 30.785 22.285 19.512 1.00 14.40 H new ATOM 0 HG21 VAL A 32 30.561 25.237 20.327 1.00 13.96 H new ATOM 0 HG22 VAL A 32 31.847 24.115 20.834 1.00 13.96 H new ATOM 0 HG23 VAL A 32 32.268 25.654 20.045 1.00 13.96 H new ATOM 544 N ILE A 33 32.612 23.714 15.930 1.00 13.65 N ATOM 545 CA ILE A 33 32.530 23.126 14.561 1.00 13.17 C ATOM 546 C ILE A 33 33.639 22.075 14.376 1.00 15.24 C ATOM 547 O ILE A 33 33.375 20.918 14.118 1.00 15.62 O ATOM 548 CB ILE A 33 32.663 24.271 13.544 1.00 15.80 C ATOM 549 CG1 ILE A 33 31.329 25.049 13.518 1.00 14.63 C ATOM 550 CG2 ILE A 33 32.967 23.713 12.151 1.00 15.09 C ATOM 551 CD1 ILE A 33 31.478 26.401 12.802 1.00 15.66 C ATOM 0 H ILE A 33 32.514 24.728 15.973 1.00 13.65 H new ATOM 0 HA ILE A 33 31.576 22.621 14.411 1.00 13.17 H new ATOM 0 HB ILE A 33 33.482 24.930 13.833 1.00 15.80 H new ATOM 0 HG12 ILE A 33 30.568 24.452 13.015 1.00 14.63 H new ATOM 0 HG13 ILE A 33 30.982 25.213 14.538 1.00 14.63 H new ATOM 0 HG21 ILE A 33 33.058 24.535 11.442 1.00 15.09 H new ATOM 0 HG22 ILE A 33 33.902 23.153 12.179 1.00 15.09 H new ATOM 0 HG23 ILE A 33 32.158 23.053 11.839 1.00 15.09 H new ATOM 0 HD11 ILE A 33 30.520 26.921 12.803 1.00 15.66 H new ATOM 0 HD12 ILE A 33 32.220 27.008 13.321 1.00 15.66 H new ATOM 0 HD13 ILE A 33 31.800 26.235 11.774 1.00 15.66 H new ATOM 563 N LEU A 34 34.866 22.469 14.531 1.00 16.71 N ATOM 564 CA LEU A 34 36.005 21.508 14.398 1.00 19.71 C ATOM 565 C LEU A 34 35.743 20.290 15.310 1.00 20.61 C ATOM 566 O LEU A 34 35.868 19.155 14.893 1.00 22.08 O ATOM 567 CB LEU A 34 37.294 22.261 14.851 1.00 19.59 C ATOM 568 CG LEU A 34 38.304 22.687 13.702 1.00 26.84 C ATOM 569 CD1 LEU A 34 37.835 22.397 12.268 1.00 24.93 C ATOM 570 CD2 LEU A 34 38.587 24.197 13.805 1.00 27.25 C ATOM 0 H LEU A 34 35.139 23.428 14.747 1.00 16.71 H new ATOM 0 HA LEU A 34 36.116 21.153 13.373 1.00 19.71 H new ATOM 0 HB2 LEU A 34 36.993 23.159 15.391 1.00 19.59 H new ATOM 0 HB3 LEU A 34 37.829 21.627 15.558 1.00 19.59 H new ATOM 0 HG LEU A 34 39.190 22.074 13.869 1.00 26.84 H new ATOM 0 HD11 LEU A 34 38.598 22.726 11.562 1.00 24.93 H new ATOM 0 HD12 LEU A 34 37.669 21.326 12.149 1.00 24.93 H new ATOM 0 HD13 LEU A 34 36.906 22.932 12.074 1.00 24.93 H new ATOM 0 HD21 LEU A 34 39.280 24.492 13.017 1.00 27.25 H new ATOM 0 HD22 LEU A 34 37.655 24.750 13.694 1.00 27.25 H new ATOM 0 HD23 LEU A 34 39.027 24.419 14.777 1.00 27.25 H new ATOM 582 N LYS A 35 35.393 20.519 16.546 1.00 19.14 N ATOM 583 CA LYS A 35 35.138 19.379 17.485 1.00 20.97 C ATOM 584 C LYS A 35 34.269 18.322 16.810 1.00 22.25 C ATOM 585 O LYS A 35 34.377 17.144 17.086 1.00 22.80 O ATOM 586 CB LYS A 35 34.414 19.898 18.736 1.00 22.98 C ATOM 587 CG LYS A 35 34.433 18.817 19.820 1.00 26.83 C ATOM 588 CD LYS A 35 33.818 19.370 21.107 1.00 29.91 C ATOM 589 CE LYS A 35 34.149 18.436 22.274 1.00 33.36 C ATOM 590 NZ LYS A 35 33.489 18.936 23.514 1.00 35.88 N ATOM 0 H LYS A 35 35.271 21.447 16.951 1.00 19.14 H new ATOM 0 HA LYS A 35 36.093 18.934 17.764 1.00 20.97 H new ATOM 0 HB2 LYS A 35 34.899 20.803 19.101 1.00 22.98 H new ATOM 0 HB3 LYS A 35 33.386 20.164 18.490 1.00 22.98 H new ATOM 0 HG2 LYS A 35 33.875 17.942 19.485 1.00 26.83 H new ATOM 0 HG3 LYS A 35 35.457 18.491 20.005 1.00 26.83 H new ATOM 0 HD2 LYS A 35 34.204 20.370 21.307 1.00 29.91 H new ATOM 0 HD3 LYS A 35 32.738 19.462 20.996 1.00 29.91 H new ATOM 0 HE2 LYS A 35 33.810 17.424 22.051 1.00 33.36 H new ATOM 0 HE3 LYS A 35 35.228 18.386 22.419 1.00 33.36 H new ATOM 0 HZ1 LYS A 35 33.343 18.145 24.173 1.00 35.88 H new ATOM 0 HZ2 LYS A 35 34.093 19.654 23.963 1.00 35.88 H new ATOM 0 HZ3 LYS A 35 32.570 19.359 23.272 1.00 35.88 H new ATOM 604 N ASP A 36 33.396 18.735 15.944 1.00 20.87 N ATOM 605 CA ASP A 36 32.496 17.768 15.261 1.00 18.89 C ATOM 606 C ASP A 36 33.157 17.222 13.996 1.00 17.97 C ATOM 607 O ASP A 36 33.035 16.057 13.670 1.00 19.23 O ATOM 608 CB ASP A 36 31.212 18.503 14.901 1.00 16.73 C ATOM 609 CG ASP A 36 30.820 19.403 16.077 1.00 19.06 C ATOM 610 OD1 ASP A 36 30.636 18.878 17.163 1.00 17.75 O ATOM 611 OD2 ASP A 36 30.711 20.600 15.871 1.00 14.84 O ATOM 0 H ASP A 36 33.264 19.710 15.675 1.00 20.87 H new ATOM 0 HA ASP A 36 32.285 16.925 15.919 1.00 18.89 H new ATOM 0 HB2 ASP A 36 31.357 19.099 14.000 1.00 16.73 H new ATOM 0 HB3 ASP A 36 30.415 17.791 14.687 1.00 16.73 H new ATOM 616 N ALA A 37 33.836 18.061 13.272 1.00 19.53 N ATOM 617 CA ALA A 37 34.488 17.612 12.012 1.00 20.29 C ATOM 618 C ALA A 37 35.838 16.970 12.314 1.00 23.93 C ATOM 619 O ALA A 37 36.783 17.120 11.564 1.00 23.82 O ATOM 620 CB ALA A 37 34.693 18.834 11.117 1.00 19.16 C ATOM 0 H ALA A 37 33.969 19.046 13.499 1.00 19.53 H new ATOM 0 HA ALA A 37 33.858 16.875 11.514 1.00 20.29 H new ATOM 0 HB1 ALA A 37 35.170 18.527 10.186 1.00 19.16 H new ATOM 0 HB2 ALA A 37 33.728 19.290 10.897 1.00 19.16 H new ATOM 0 HB3 ALA A 37 35.327 19.558 11.629 1.00 19.16 H new ATOM 626 N ASP A 38 35.954 16.269 13.398 1.00 25.04 N ATOM 627 CA ASP A 38 37.262 15.648 13.714 1.00 29.02 C ATOM 628 C ASP A 38 38.324 16.748 13.718 1.00 30.09 C ATOM 629 O ASP A 38 39.510 16.488 13.709 1.00 29.56 O ATOM 630 CB ASP A 38 37.595 14.599 12.645 1.00 31.78 C ATOM 631 CG ASP A 38 38.613 13.598 13.199 1.00 34.21 C ATOM 632 OD1 ASP A 38 38.381 13.083 14.280 1.00 37.98 O ATOM 633 OD2 ASP A 38 39.608 13.367 12.532 1.00 39.08 O ATOM 0 H ASP A 38 35.209 16.099 14.074 1.00 25.04 H new ATOM 0 HA ASP A 38 37.231 15.160 14.688 1.00 29.02 H new ATOM 0 HB2 ASP A 38 36.688 14.078 12.339 1.00 31.78 H new ATOM 0 HB3 ASP A 38 37.997 15.087 11.757 1.00 31.78 H new ATOM 638 N ALA A 39 37.885 17.978 13.725 1.00 30.33 N ATOM 639 CA ALA A 39 38.824 19.129 13.726 1.00 32.12 C ATOM 640 C ALA A 39 39.455 19.291 12.339 1.00 33.86 C ATOM 641 O ALA A 39 40.366 20.073 12.151 1.00 34.96 O ATOM 642 CB ALA A 39 39.904 18.909 14.787 1.00 32.67 C ATOM 0 H ALA A 39 36.898 18.234 13.730 1.00 30.33 H new ATOM 0 HA ALA A 39 38.279 20.042 13.964 1.00 32.12 H new ATOM 0 HB1 ALA A 39 40.592 19.754 14.786 1.00 32.67 H new ATOM 0 HB2 ALA A 39 39.438 18.821 15.768 1.00 32.67 H new ATOM 0 HB3 ALA A 39 40.453 17.994 14.563 1.00 32.67 H new ATOM 648 N ASN A 40 38.970 18.571 11.362 1.00 33.92 N ATOM 649 CA ASN A 40 39.538 18.703 9.988 1.00 34.20 C ATOM 650 C ASN A 40 38.874 19.887 9.287 1.00 34.98 C ATOM 651 O ASN A 40 37.738 19.811 8.862 1.00 32.10 O ATOM 652 CB ASN A 40 39.269 17.430 9.185 1.00 33.87 C ATOM 653 CG ASN A 40 40.111 17.447 7.908 1.00 32.69 C ATOM 654 OD1 ASN A 40 40.319 18.488 7.317 1.00 34.27 O ATOM 655 ND2 ASN A 40 40.609 16.329 7.453 1.00 33.64 N ATOM 0 H ASN A 40 38.208 17.900 11.455 1.00 33.92 H new ATOM 0 HA ASN A 40 40.614 18.862 10.057 1.00 34.20 H new ATOM 0 HB2 ASN A 40 39.513 16.552 9.783 1.00 33.87 H new ATOM 0 HB3 ASN A 40 38.210 17.362 8.935 1.00 33.87 H new ATOM 0 HD21 ASN A 40 41.172 16.330 6.602 1.00 33.64 H new ATOM 0 HD22 ASN A 40 40.435 15.454 7.948 1.00 33.64 H new ATOM 662 N ILE A 41 39.573 20.980 9.162 1.00 35.49 N ATOM 663 CA ILE A 41 38.990 22.175 8.487 1.00 37.55 C ATOM 664 C ILE A 41 38.304 21.747 7.191 1.00 36.60 C ATOM 665 O ILE A 41 37.175 22.105 6.928 1.00 34.64 O ATOM 666 CB ILE A 41 40.121 23.164 8.174 1.00 39.67 C ATOM 667 CG1 ILE A 41 40.618 23.746 9.512 1.00 42.22 C ATOM 668 CG2 ILE A 41 39.639 24.289 7.199 1.00 40.78 C ATOM 669 CD1 ILE A 41 41.677 24.832 9.281 1.00 44.19 C ATOM 0 H ILE A 41 40.528 21.099 9.500 1.00 35.49 H new ATOM 0 HA ILE A 41 38.254 22.649 9.137 1.00 37.55 H new ATOM 0 HB ILE A 41 40.939 22.652 7.666 1.00 39.67 H new ATOM 0 HG12 ILE A 41 39.777 24.165 10.065 1.00 42.22 H new ATOM 0 HG13 ILE A 41 41.038 22.949 10.126 1.00 42.22 H new ATOM 0 HG21 ILE A 41 40.463 24.973 6.997 1.00 40.78 H new ATOM 0 HG22 ILE A 41 39.302 23.841 6.264 1.00 40.78 H new ATOM 0 HG23 ILE A 41 38.815 24.838 7.656 1.00 40.78 H new ATOM 0 HD11 ILE A 41 42.010 25.225 10.241 1.00 44.19 H new ATOM 0 HD12 ILE A 41 42.527 24.404 8.749 1.00 44.19 H new ATOM 0 HD13 ILE A 41 41.247 25.639 8.688 1.00 44.19 H new ATOM 681 N GLU A 42 38.978 20.994 6.378 1.00 37.01 N ATOM 682 CA GLU A 42 38.363 20.557 5.100 1.00 36.07 C ATOM 683 C GLU A 42 36.989 19.947 5.372 1.00 33.02 C ATOM 684 O GLU A 42 36.021 20.252 4.703 1.00 31.66 O ATOM 685 CB GLU A 42 39.267 19.516 4.441 1.00 40.46 C ATOM 686 CG GLU A 42 40.612 20.157 4.099 1.00 45.44 C ATOM 687 CD GLU A 42 41.478 19.152 3.337 1.00 49.08 C ATOM 688 OE1 GLU A 42 41.203 18.929 2.170 1.00 51.71 O ATOM 689 OE2 GLU A 42 42.399 18.620 3.935 1.00 50.84 O ATOM 0 H GLU A 42 39.928 20.661 6.542 1.00 37.01 H new ATOM 0 HA GLU A 42 38.247 21.414 4.437 1.00 36.07 H new ATOM 0 HB2 GLU A 42 39.415 18.670 5.112 1.00 40.46 H new ATOM 0 HB3 GLU A 42 38.796 19.128 3.538 1.00 40.46 H new ATOM 0 HG2 GLU A 42 40.457 21.051 3.495 1.00 45.44 H new ATOM 0 HG3 GLU A 42 41.119 20.472 5.011 1.00 45.44 H new ATOM 696 N GLU A 43 36.891 19.090 6.349 1.00 29.75 N ATOM 697 CA GLU A 43 35.573 18.468 6.659 1.00 27.99 C ATOM 698 C GLU A 43 34.723 19.460 7.455 1.00 25.26 C ATOM 699 O GLU A 43 33.510 19.454 7.375 1.00 22.77 O ATOM 700 CB GLU A 43 35.783 17.186 7.477 1.00 30.94 C ATOM 701 CG GLU A 43 34.545 16.289 7.360 1.00 33.24 C ATOM 702 CD GLU A 43 34.548 15.587 6.000 1.00 37.98 C ATOM 703 OE1 GLU A 43 35.436 14.781 5.774 1.00 43.17 O ATOM 704 OE2 GLU A 43 33.664 15.868 5.208 1.00 38.40 O ATOM 0 H GLU A 43 37.664 18.794 6.945 1.00 29.75 H new ATOM 0 HA GLU A 43 35.061 18.214 5.731 1.00 27.99 H new ATOM 0 HB2 GLU A 43 36.664 16.654 7.118 1.00 30.94 H new ATOM 0 HB3 GLU A 43 35.965 17.436 8.522 1.00 30.94 H new ATOM 0 HG2 GLU A 43 34.541 15.551 8.162 1.00 33.24 H new ATOM 0 HG3 GLU A 43 33.639 16.885 7.471 1.00 33.24 H new ATOM 711 N ALA A 44 35.346 20.315 8.221 1.00 22.98 N ATOM 712 CA ALA A 44 34.564 21.304 9.013 1.00 23.88 C ATOM 713 C ALA A 44 34.073 22.414 8.077 1.00 22.87 C ATOM 714 O ALA A 44 32.946 22.857 8.161 1.00 22.85 O ATOM 715 CB ALA A 44 35.450 21.882 10.141 1.00 22.28 C ATOM 0 H ALA A 44 36.358 20.370 8.331 1.00 22.98 H new ATOM 0 HA ALA A 44 33.700 20.822 9.472 1.00 23.88 H new ATOM 0 HB1 ALA A 44 34.876 22.606 10.720 1.00 22.28 H new ATOM 0 HB2 ALA A 44 35.780 21.074 10.795 1.00 22.28 H new ATOM 0 HB3 ALA A 44 36.319 22.374 9.705 1.00 22.28 H new ATOM 721 N SER A 45 34.909 22.856 7.184 1.00 25.55 N ATOM 722 CA SER A 45 34.499 23.929 6.239 1.00 26.34 C ATOM 723 C SER A 45 33.288 23.462 5.428 1.00 26.21 C ATOM 724 O SER A 45 32.318 24.179 5.275 1.00 23.95 O ATOM 725 CB SER A 45 35.660 24.235 5.294 1.00 29.82 C ATOM 726 OG SER A 45 35.626 23.330 4.198 1.00 33.07 O ATOM 0 H SER A 45 35.864 22.519 7.067 1.00 25.55 H new ATOM 0 HA SER A 45 34.234 24.827 6.797 1.00 26.34 H new ATOM 0 HB2 SER A 45 35.590 25.262 4.935 1.00 29.82 H new ATOM 0 HB3 SER A 45 36.608 24.146 5.824 1.00 29.82 H new ATOM 0 HG SER A 45 35.860 22.431 4.509 1.00 33.07 H new ATOM 732 N ARG A 46 33.334 22.267 4.906 1.00 26.25 N ATOM 733 CA ARG A 46 32.183 21.759 4.105 1.00 26.19 C ATOM 734 C ARG A 46 30.881 21.995 4.875 1.00 24.78 C ATOM 735 O ARG A 46 29.868 22.346 4.305 1.00 20.51 O ATOM 736 CB ARG A 46 32.366 20.260 3.837 1.00 30.93 C ATOM 737 CG ARG A 46 33.392 20.062 2.716 1.00 37.66 C ATOM 738 CD ARG A 46 33.804 18.590 2.646 1.00 43.41 C ATOM 739 NE ARG A 46 32.588 17.730 2.655 1.00 47.39 N ATOM 740 CZ ARG A 46 32.677 16.474 2.309 1.00 49.82 C ATOM 741 NH1 ARG A 46 33.830 15.973 1.961 1.00 51.10 N ATOM 742 NH2 ARG A 46 31.612 15.720 2.311 1.00 51.02 N ATOM 0 H ARG A 46 34.118 21.621 4.999 1.00 26.25 H new ATOM 0 HA ARG A 46 32.138 22.289 3.154 1.00 26.19 H new ATOM 0 HB2 ARG A 46 32.701 19.756 4.744 1.00 30.93 H new ATOM 0 HB3 ARG A 46 31.413 19.811 3.556 1.00 30.93 H new ATOM 0 HG2 ARG A 46 32.968 20.376 1.762 1.00 37.66 H new ATOM 0 HG3 ARG A 46 34.267 20.686 2.897 1.00 37.66 H new ATOM 0 HD2 ARG A 46 34.385 18.407 1.742 1.00 43.41 H new ATOM 0 HD3 ARG A 46 34.444 18.341 3.492 1.00 43.41 H new ATOM 0 HE ARG A 46 31.687 18.121 2.931 1.00 47.39 H new ATOM 0 HH11 ARG A 46 34.662 16.562 1.959 1.00 51.10 H new ATOM 0 HH12 ARG A 46 33.899 14.992 1.691 1.00 51.10 H new ATOM 0 HH21 ARG A 46 30.710 16.112 2.583 1.00 51.02 H new ATOM 0 HH22 ARG A 46 31.681 14.739 2.041 1.00 51.02 H new ATOM 756 N ARG A 47 30.901 21.817 6.168 1.00 20.40 N ATOM 757 CA ARG A 47 29.663 22.044 6.967 1.00 20.79 C ATOM 758 C ARG A 47 29.314 23.526 6.913 1.00 20.46 C ATOM 759 O ARG A 47 28.270 23.916 6.426 1.00 20.27 O ATOM 760 CB ARG A 47 29.901 21.643 8.425 1.00 18.12 C ATOM 761 CG ARG A 47 30.451 20.214 8.497 1.00 19.83 C ATOM 762 CD ARG A 47 30.961 19.932 9.917 1.00 24.63 C ATOM 763 NE ARG A 47 31.832 18.711 9.913 1.00 25.15 N ATOM 764 CZ ARG A 47 31.404 17.563 9.458 1.00 28.72 C ATOM 765 NH1 ARG A 47 30.146 17.395 9.157 1.00 25.84 N ATOM 766 NH2 ARG A 47 32.232 16.559 9.357 1.00 22.33 N ATOM 0 H ARG A 47 31.718 21.525 6.704 1.00 20.40 H new ATOM 0 HA ARG A 47 28.850 21.444 6.558 1.00 20.79 H new ATOM 0 HB2 ARG A 47 30.603 22.335 8.890 1.00 18.12 H new ATOM 0 HB3 ARG A 47 28.969 21.710 8.985 1.00 18.12 H new ATOM 0 HG2 ARG A 47 29.672 19.499 8.230 1.00 19.83 H new ATOM 0 HG3 ARG A 47 31.260 20.088 7.777 1.00 19.83 H new ATOM 0 HD2 ARG A 47 31.523 20.789 10.288 1.00 24.63 H new ATOM 0 HD3 ARG A 47 30.119 19.786 10.593 1.00 24.63 H new ATOM 0 HE ARG A 47 32.783 18.778 10.275 1.00 25.15 H new ATOM 0 HH11 ARG A 47 29.486 18.164 9.276 1.00 25.84 H new ATOM 0 HH12 ARG A 47 29.822 16.495 8.803 1.00 25.84 H new ATOM 0 HH21 ARG A 47 33.207 16.673 9.633 1.00 22.33 H new ATOM 0 HH22 ARG A 47 31.904 15.661 9.003 1.00 22.33 H new ATOM 780 N ILE A 48 30.197 24.358 7.391 1.00 19.14 N ATOM 781 CA ILE A 48 29.951 25.828 7.353 1.00 21.78 C ATOM 782 C ILE A 48 29.479 26.192 5.956 1.00 25.27 C ATOM 783 O ILE A 48 28.418 26.748 5.761 1.00 23.94 O ATOM 784 CB ILE A 48 31.255 26.554 7.661 1.00 20.97 C ATOM 785 CG1 ILE A 48 31.827 25.979 8.957 1.00 21.08 C ATOM 786 CG2 ILE A 48 30.972 28.048 7.822 1.00 21.08 C ATOM 787 CD1 ILE A 48 33.042 26.793 9.421 1.00 19.82 C ATOM 0 H ILE A 48 31.085 24.081 7.809 1.00 19.14 H new ATOM 0 HA ILE A 48 29.198 26.114 8.087 1.00 21.78 H new ATOM 0 HB ILE A 48 31.973 26.420 6.852 1.00 20.97 H new ATOM 0 HG12 ILE A 48 31.061 25.985 9.733 1.00 21.08 H new ATOM 0 HG13 ILE A 48 32.117 24.940 8.803 1.00 21.08 H new ATOM 0 HG21 ILE A 48 31.902 28.573 8.043 1.00 21.08 H new ATOM 0 HG22 ILE A 48 30.545 28.439 6.899 1.00 21.08 H new ATOM 0 HG23 ILE A 48 30.267 28.199 8.640 1.00 21.08 H new ATOM 0 HD11 ILE A 48 33.434 26.367 10.345 1.00 19.82 H new ATOM 0 HD12 ILE A 48 33.814 26.765 8.652 1.00 19.82 H new ATOM 0 HD13 ILE A 48 32.742 27.826 9.596 1.00 19.82 H new ATOM 799 N GLU A 49 30.263 25.846 4.983 1.00 26.87 N ATOM 800 CA GLU A 49 29.892 26.127 3.571 1.00 31.21 C ATOM 801 C GLU A 49 28.439 25.745 3.339 1.00 31.88 C ATOM 802 O GLU A 49 27.605 26.573 3.028 1.00 31.73 O ATOM 803 CB GLU A 49 30.740 25.240 2.678 1.00 32.85 C ATOM 804 CG GLU A 49 32.151 25.818 2.528 1.00 36.76 C ATOM 805 CD GLU A 49 32.877 25.103 1.388 1.00 40.40 C ATOM 806 OE1 GLU A 49 32.423 25.213 0.261 1.00 40.28 O ATOM 807 OE2 GLU A 49 33.876 24.457 1.661 1.00 43.41 O ATOM 0 H GLU A 49 31.159 25.373 5.105 1.00 26.87 H new ATOM 0 HA GLU A 49 30.044 27.185 3.356 1.00 31.21 H new ATOM 0 HB2 GLU A 49 30.795 24.236 3.100 1.00 32.85 H new ATOM 0 HB3 GLU A 49 30.272 25.148 1.698 1.00 32.85 H new ATOM 0 HG2 GLU A 49 32.098 26.888 2.325 1.00 36.76 H new ATOM 0 HG3 GLU A 49 32.706 25.698 3.459 1.00 36.76 H new ATOM 814 N GLU A 50 28.129 24.485 3.507 1.00 32.05 N ATOM 815 CA GLU A 50 26.728 24.041 3.318 1.00 30.33 C ATOM 816 C GLU A 50 25.874 24.967 4.154 1.00 29.99 C ATOM 817 O GLU A 50 24.864 25.447 3.730 1.00 26.76 O ATOM 818 CB GLU A 50 26.590 22.581 3.798 1.00 33.38 C ATOM 819 CG GLU A 50 25.450 21.877 3.050 1.00 33.45 C ATOM 820 CD GLU A 50 25.426 20.397 3.435 1.00 36.89 C ATOM 821 OE1 GLU A 50 26.188 19.641 2.854 1.00 36.13 O ATOM 822 OE2 GLU A 50 24.646 20.043 4.303 1.00 35.55 O ATOM 0 H GLU A 50 28.788 23.751 3.766 1.00 32.05 H new ATOM 0 HA GLU A 50 26.421 24.077 2.273 1.00 30.33 H new ATOM 0 HB2 GLU A 50 27.526 22.047 3.633 1.00 33.38 H new ATOM 0 HB3 GLU A 50 26.397 22.561 4.871 1.00 33.38 H new ATOM 0 HG2 GLU A 50 24.496 22.344 3.296 1.00 33.45 H new ATOM 0 HG3 GLU A 50 25.587 21.982 1.974 1.00 33.45 H new ATOM 829 N GLY A 51 26.338 25.251 5.324 1.00 0.00 N ATOM 830 CA GLY A 51 25.617 26.174 6.232 1.00 0.00 C ATOM 831 C GLY A 51 25.410 27.534 5.548 1.00 0.00 C ATOM 832 O GLY A 51 24.306 27.997 5.350 1.00 0.00 O ATOM 0 H GLY A 51 27.208 24.875 5.702 1.00 0.00 H new ATOM 0 HA2 GLY A 51 24.653 25.746 6.507 1.00 0.00 H new ATOM 0 HA3 GLY A 51 26.183 26.305 7.154 1.00 0.00 H new ATOM 836 N GLN A 52 26.484 28.189 5.196 1.00 29.60 N ATOM 837 CA GLN A 52 26.369 29.524 4.530 1.00 32.81 C ATOM 838 C GLN A 52 25.355 29.414 3.407 1.00 33.63 C ATOM 839 O GLN A 52 24.430 30.194 3.292 1.00 32.37 O ATOM 840 CB GLN A 52 27.721 29.921 3.926 1.00 32.81 C ATOM 841 CG GLN A 52 28.838 29.813 4.984 1.00 34.44 C ATOM 842 CD GLN A 52 29.035 31.154 5.695 1.00 35.84 C ATOM 843 OE1 GLN A 52 28.083 31.795 6.093 1.00 36.29 O ATOM 844 NE2 GLN A 52 30.247 31.604 5.868 1.00 38.34 N ATOM 0 H GLN A 52 27.438 27.859 5.340 1.00 29.60 H new ATOM 0 HA GLN A 52 26.061 30.272 5.261 1.00 32.81 H new ATOM 0 HB2 GLN A 52 27.951 29.275 3.079 1.00 32.81 H new ATOM 0 HB3 GLN A 52 27.670 30.941 3.545 1.00 32.81 H new ATOM 0 HG2 GLN A 52 28.584 29.043 5.712 1.00 34.44 H new ATOM 0 HG3 GLN A 52 29.770 29.507 4.508 1.00 34.44 H new ATOM 0 HE21 GLN A 52 31.044 31.063 5.533 1.00 38.34 H new ATOM 0 HE22 GLN A 52 30.397 32.496 6.339 1.00 38.34 H new ATOM 853 N TYR A 53 25.528 28.426 2.589 1.00 34.79 N ATOM 854 CA TYR A 53 24.591 28.206 1.464 1.00 37.88 C ATOM 855 C TYR A 53 23.233 27.827 2.046 1.00 39.97 C ATOM 856 O TYR A 53 22.206 28.349 1.672 1.00 39.08 O ATOM 857 CB TYR A 53 25.127 27.054 0.600 1.00 39.97 C ATOM 858 CG TYR A 53 24.011 26.456 -0.224 1.00 42.20 C ATOM 859 CD1 TYR A 53 23.147 25.517 0.346 1.00 42.61 C ATOM 860 CD2 TYR A 53 23.842 26.847 -1.547 1.00 42.58 C ATOM 861 CE1 TYR A 53 22.114 24.969 -0.410 1.00 45.45 C ATOM 862 CE2 TYR A 53 22.806 26.300 -2.314 1.00 44.68 C ATOM 863 CZ TYR A 53 21.939 25.359 -1.744 1.00 45.19 C ATOM 864 OH TYR A 53 20.916 24.816 -2.495 1.00 49.10 O ATOM 0 H TYR A 53 26.290 27.751 2.652 1.00 34.79 H new ATOM 0 HA TYR A 53 24.494 29.103 0.853 1.00 37.88 H new ATOM 0 HB2 TYR A 53 25.917 27.419 -0.056 1.00 39.97 H new ATOM 0 HB3 TYR A 53 25.569 26.288 1.237 1.00 39.97 H new ATOM 0 HD1 TYR A 53 23.281 25.216 1.375 1.00 42.61 H new ATOM 0 HD2 TYR A 53 24.511 27.574 -1.984 1.00 42.58 H new ATOM 0 HE1 TYR A 53 21.448 24.243 0.032 1.00 45.45 H new ATOM 0 HE2 TYR A 53 22.676 26.603 -3.342 1.00 44.68 H new ATOM 0 HH TYR A 53 20.291 24.345 -1.905 1.00 49.10 H new ATOM 874 N VAL A 54 23.243 26.909 2.959 1.00 39.04 N ATOM 875 CA VAL A 54 21.985 26.446 3.593 1.00 40.51 C ATOM 876 C VAL A 54 21.184 27.669 4.048 1.00 40.89 C ATOM 877 O VAL A 54 20.065 27.889 3.630 1.00 40.52 O ATOM 878 CB VAL A 54 22.401 25.582 4.785 1.00 40.89 C ATOM 879 CG1 VAL A 54 21.325 25.528 5.842 1.00 41.12 C ATOM 880 CG2 VAL A 54 22.786 24.143 4.345 1.00 40.75 C ATOM 0 H VAL A 54 24.087 26.449 3.301 1.00 39.04 H new ATOM 0 HA VAL A 54 21.357 25.872 2.911 1.00 40.51 H new ATOM 0 HB VAL A 54 23.282 26.057 5.218 1.00 40.89 H new ATOM 0 HG11 VAL A 54 21.660 24.905 6.671 1.00 41.12 H new ATOM 0 HG12 VAL A 54 21.121 26.535 6.205 1.00 41.12 H new ATOM 0 HG13 VAL A 54 20.416 25.105 5.414 1.00 41.12 H new ATOM 0 HG21 VAL A 54 23.076 23.560 5.220 1.00 40.75 H new ATOM 0 HG22 VAL A 54 21.932 23.670 3.860 1.00 40.75 H new ATOM 0 HG23 VAL A 54 23.621 24.187 3.646 1.00 40.75 H new ATOM 890 N VAL A 55 21.761 28.466 4.899 1.00 40.66 N ATOM 891 CA VAL A 55 21.056 29.681 5.386 1.00 41.79 C ATOM 892 C VAL A 55 20.761 30.591 4.195 1.00 43.19 C ATOM 893 O VAL A 55 19.624 30.916 3.917 1.00 42.93 O ATOM 894 CB VAL A 55 21.955 30.409 6.391 1.00 40.93 C ATOM 895 CG1 VAL A 55 21.205 31.594 7.005 1.00 40.61 C ATOM 896 CG2 VAL A 55 22.356 29.434 7.500 1.00 41.17 C ATOM 0 H VAL A 55 22.697 28.327 5.281 1.00 40.66 H new ATOM 0 HA VAL A 55 20.120 29.407 5.873 1.00 41.79 H new ATOM 0 HB VAL A 55 22.843 30.778 5.878 1.00 40.93 H new ATOM 0 HG11 VAL A 55 21.853 32.105 7.718 1.00 40.61 H new ATOM 0 HG12 VAL A 55 20.914 32.288 6.217 1.00 40.61 H new ATOM 0 HG13 VAL A 55 20.313 31.234 7.518 1.00 40.61 H new ATOM 0 HG21 VAL A 55 22.996 29.945 8.219 1.00 41.17 H new ATOM 0 HG22 VAL A 55 21.461 29.069 8.005 1.00 41.17 H new ATOM 0 HG23 VAL A 55 22.897 28.592 7.067 1.00 41.17 H new ATOM 906 N ASN A 56 21.776 31.000 3.480 1.00 43.65 N ATOM 907 CA ASN A 56 21.545 31.880 2.301 1.00 46.57 C ATOM 908 C ASN A 56 20.440 31.267 1.439 1.00 47.19 C ATOM 909 O ASN A 56 19.557 31.951 0.963 1.00 46.87 O ATOM 910 CB ASN A 56 22.837 31.991 1.486 1.00 46.25 C ATOM 911 CG ASN A 56 23.897 32.726 2.308 1.00 46.74 C ATOM 912 OD1 ASN A 56 23.601 33.703 2.967 1.00 46.94 O ATOM 913 ND2 ASN A 56 25.129 32.296 2.296 1.00 47.06 N ATOM 0 H ASN A 56 22.751 30.763 3.662 1.00 43.65 H new ATOM 0 HA ASN A 56 21.246 32.875 2.630 1.00 46.57 H new ATOM 0 HB2 ASN A 56 23.195 30.998 1.216 1.00 46.25 H new ATOM 0 HB3 ASN A 56 22.648 32.526 0.555 1.00 46.25 H new ATOM 0 HD21 ASN A 56 25.843 32.780 2.840 1.00 47.06 H new ATOM 0 HD22 ASN A 56 25.378 31.476 1.743 1.00 47.06 H new ATOM 920 N GLU A 57 20.478 29.976 1.255 1.00 49.43 N ATOM 921 CA GLU A 57 19.427 29.300 0.445 1.00 51.03 C ATOM 922 C GLU A 57 18.074 29.511 1.118 1.00 51.99 C ATOM 923 O GLU A 57 17.155 30.058 0.546 1.00 52.02 O ATOM 924 CB GLU A 57 19.728 27.806 0.382 1.00 52.77 C ATOM 925 CG GLU A 57 18.742 27.111 -0.557 1.00 54.20 C ATOM 926 CD GLU A 57 18.961 25.599 -0.498 1.00 56.33 C ATOM 927 OE1 GLU A 57 19.322 25.114 0.562 1.00 57.66 O ATOM 928 OE2 GLU A 57 18.764 24.951 -1.512 1.00 57.76 O ATOM 0 H GLU A 57 21.196 29.358 1.633 1.00 49.43 H new ATOM 0 HA GLU A 57 19.410 29.714 -0.563 1.00 51.03 H new ATOM 0 HB2 GLU A 57 20.748 27.647 0.033 1.00 52.77 H new ATOM 0 HB3 GLU A 57 19.661 27.371 1.379 1.00 52.77 H new ATOM 0 HG2 GLU A 57 17.718 27.352 -0.270 1.00 54.20 H new ATOM 0 HG3 GLU A 57 18.880 27.470 -1.577 1.00 54.20 H new ATOM 935 N TYR A 58 17.946 29.084 2.340 1.00 53.12 N ATOM 936 CA TYR A 58 16.657 29.260 3.059 1.00 54.13 C ATOM 937 C TYR A 58 16.191 30.703 2.912 1.00 54.38 C ATOM 938 O TYR A 58 15.039 31.024 3.109 1.00 55.12 O ATOM 939 CB TYR A 58 16.862 28.946 4.539 1.00 54.54 C ATOM 940 CG TYR A 58 15.528 28.809 5.215 1.00 55.20 C ATOM 941 CD1 TYR A 58 14.869 27.581 5.191 1.00 55.36 C ATOM 942 CD2 TYR A 58 14.954 29.906 5.866 1.00 55.64 C ATOM 943 CE1 TYR A 58 13.632 27.440 5.819 1.00 55.93 C ATOM 944 CE2 TYR A 58 13.712 29.768 6.498 1.00 56.15 C ATOM 945 CZ TYR A 58 13.050 28.533 6.475 1.00 56.20 C ATOM 946 OH TYR A 58 11.826 28.392 7.097 1.00 58.01 O ATOM 0 H TYR A 58 18.681 28.619 2.874 1.00 53.12 H new ATOM 0 HA TYR A 58 15.908 28.589 2.640 1.00 54.13 H new ATOM 0 HB2 TYR A 58 17.433 28.024 4.650 1.00 54.54 H new ATOM 0 HB3 TYR A 58 17.441 29.739 5.012 1.00 54.54 H new ATOM 0 HD1 TYR A 58 15.317 26.738 4.686 1.00 55.36 H new ATOM 0 HD2 TYR A 58 15.467 30.856 5.881 1.00 55.64 H new ATOM 0 HE1 TYR A 58 13.122 26.488 5.800 1.00 55.93 H new ATOM 0 HE2 TYR A 58 13.265 30.612 7.002 1.00 56.15 H new ATOM 0 HH TYR A 58 11.921 27.807 7.878 1.00 58.01 H new ATOM 1151 N ASP B 7 13.030 23.063 9.067 1.00 55.77 N ATOM 1152 CA ASP B 7 12.543 24.279 9.788 1.00 53.95 C ATOM 1153 C ASP B 7 12.924 24.175 11.264 1.00 52.49 C ATOM 1154 O ASP B 7 13.597 25.030 11.805 1.00 51.89 O ATOM 1155 CB ASP B 7 11.020 24.379 9.655 1.00 54.63 C ATOM 1156 CG ASP B 7 10.566 25.795 10.016 1.00 55.27 C ATOM 1157 OD1 ASP B 7 11.238 26.732 9.616 1.00 56.33 O ATOM 1158 OD2 ASP B 7 9.554 25.918 10.686 1.00 55.55 O ATOM 0 HA ASP B 7 13.000 25.169 9.355 1.00 53.95 H new ATOM 0 HB2 ASP B 7 10.717 24.138 8.636 1.00 54.63 H new ATOM 0 HB3 ASP B 7 10.539 23.653 10.311 1.00 54.63 H new ATOM 1163 N VAL B 8 12.522 23.118 11.909 1.00 50.38 N ATOM 1164 CA VAL B 8 12.882 22.932 13.345 1.00 48.45 C ATOM 1165 C VAL B 8 14.380 23.154 13.494 1.00 46.36 C ATOM 1166 O VAL B 8 14.858 23.673 14.483 1.00 44.84 O ATOM 1167 CB VAL B 8 12.544 21.495 13.765 1.00 48.63 C ATOM 1168 CG1 VAL B 8 11.031 21.360 13.921 1.00 48.83 C ATOM 1169 CG2 VAL B 8 13.090 20.488 12.720 1.00 47.55 C ATOM 0 H VAL B 8 11.958 22.371 11.504 1.00 50.38 H new ATOM 0 HA VAL B 8 12.330 23.635 13.969 1.00 48.45 H new ATOM 0 HB VAL B 8 13.017 21.271 14.721 1.00 48.63 H new ATOM 0 HG11 VAL B 8 10.785 20.341 14.219 1.00 48.83 H new ATOM 0 HG12 VAL B 8 10.680 22.056 14.683 1.00 48.83 H new ATOM 0 HG13 VAL B 8 10.546 21.587 12.972 1.00 48.83 H new ATOM 0 HG21 VAL B 8 12.843 19.472 13.030 1.00 47.55 H new ATOM 0 HG22 VAL B 8 12.638 20.691 11.749 1.00 47.55 H new ATOM 0 HG23 VAL B 8 14.172 20.592 12.646 1.00 47.55 H new ATOM 1179 N PHE B 9 15.119 22.761 12.501 1.00 44.57 N ATOM 1180 CA PHE B 9 16.587 22.938 12.548 1.00 42.68 C ATOM 1181 C PHE B 9 16.900 24.432 12.617 1.00 41.92 C ATOM 1182 O PHE B 9 17.459 24.916 13.581 1.00 40.56 O ATOM 1183 CB PHE B 9 17.210 22.324 11.283 1.00 41.99 C ATOM 1184 CG PHE B 9 18.624 21.924 11.580 1.00 41.32 C ATOM 1185 CD1 PHE B 9 19.644 22.867 11.463 1.00 41.38 C ATOM 1186 CD2 PHE B 9 18.912 20.620 11.986 1.00 41.88 C ATOM 1187 CE1 PHE B 9 20.955 22.508 11.748 1.00 39.40 C ATOM 1188 CE2 PHE B 9 20.226 20.262 12.274 1.00 39.39 C ATOM 1189 CZ PHE B 9 21.245 21.210 12.153 1.00 40.84 C ATOM 0 H PHE B 9 14.764 22.321 11.652 1.00 44.57 H new ATOM 0 HA PHE B 9 17.001 22.441 13.425 1.00 42.68 H new ATOM 0 HB2 PHE B 9 16.633 21.457 10.962 1.00 41.99 H new ATOM 0 HB3 PHE B 9 17.186 23.043 10.464 1.00 41.99 H new ATOM 0 HD1 PHE B 9 19.415 23.875 11.151 1.00 41.38 H new ATOM 0 HD2 PHE B 9 18.119 19.892 12.076 1.00 41.88 H new ATOM 0 HE1 PHE B 9 21.748 23.236 11.655 1.00 39.40 H new ATOM 0 HE2 PHE B 9 20.457 19.255 12.590 1.00 39.39 H new ATOM 0 HZ PHE B 9 22.265 20.933 12.376 1.00 40.84 H new ATOM 1199 N LEU B 10 16.527 25.168 11.609 1.00 41.09 N ATOM 1200 CA LEU B 10 16.785 26.630 11.631 1.00 41.50 C ATOM 1201 C LEU B 10 16.100 27.207 12.862 1.00 41.09 C ATOM 1202 O LEU B 10 16.557 28.163 13.455 1.00 38.55 O ATOM 1203 CB LEU B 10 16.216 27.273 10.368 1.00 42.71 C ATOM 1204 CG LEU B 10 16.600 26.430 9.151 1.00 43.61 C ATOM 1205 CD1 LEU B 10 16.168 27.152 7.885 1.00 44.50 C ATOM 1206 CD2 LEU B 10 18.115 26.223 9.118 1.00 43.61 C ATOM 0 H LEU B 10 16.056 24.820 10.774 1.00 41.09 H new ATOM 0 HA LEU B 10 17.856 26.828 11.667 1.00 41.50 H new ATOM 0 HB2 LEU B 10 15.131 27.350 10.443 1.00 42.71 H new ATOM 0 HB3 LEU B 10 16.601 28.287 10.258 1.00 42.71 H new ATOM 0 HG LEU B 10 16.105 25.461 9.215 1.00 43.61 H new ATOM 0 HD11 LEU B 10 16.440 26.555 7.015 1.00 44.50 H new ATOM 0 HD12 LEU B 10 15.088 27.300 7.901 1.00 44.50 H new ATOM 0 HD13 LEU B 10 16.666 28.120 7.830 1.00 44.50 H new ATOM 0 HD21 LEU B 10 18.381 25.622 8.249 1.00 43.61 H new ATOM 0 HD22 LEU B 10 18.613 27.191 9.056 1.00 43.61 H new ATOM 0 HD23 LEU B 10 18.432 25.709 10.025 1.00 43.61 H new ATOM 1218 N ASP B 11 15.012 26.613 13.265 1.00 41.28 N ATOM 1219 CA ASP B 11 14.311 27.110 14.474 1.00 41.44 C ATOM 1220 C ASP B 11 15.279 27.012 15.650 1.00 39.86 C ATOM 1221 O ASP B 11 15.637 28.006 16.247 1.00 37.26 O ATOM 1222 CB ASP B 11 13.065 26.257 14.745 1.00 44.23 C ATOM 1223 CG ASP B 11 12.118 27.013 15.681 1.00 46.87 C ATOM 1224 OD1 ASP B 11 12.516 28.054 16.179 1.00 49.31 O ATOM 1225 OD2 ASP B 11 11.013 26.538 15.883 1.00 48.41 O ATOM 0 H ASP B 11 14.582 25.808 12.810 1.00 41.28 H new ATOM 0 HA ASP B 11 13.993 28.143 14.331 1.00 41.44 H new ATOM 0 HB2 ASP B 11 12.559 26.027 13.808 1.00 44.23 H new ATOM 0 HB3 ASP B 11 13.353 25.306 15.193 1.00 44.23 H new ATOM 1230 N TYR B 12 15.732 25.823 15.978 1.00 39.23 N ATOM 1231 CA TYR B 12 16.697 25.695 17.110 1.00 38.08 C ATOM 1232 C TYR B 12 17.810 26.709 16.911 1.00 34.01 C ATOM 1233 O TYR B 12 18.163 27.444 17.811 1.00 32.49 O ATOM 1234 CB TYR B 12 17.338 24.306 17.147 1.00 42.28 C ATOM 1235 CG TYR B 12 16.335 23.207 17.460 1.00 47.31 C ATOM 1236 CD1 TYR B 12 15.415 23.325 18.522 1.00 49.49 C ATOM 1237 CD2 TYR B 12 16.356 22.036 16.694 1.00 48.65 C ATOM 1238 CE1 TYR B 12 14.533 22.274 18.801 1.00 50.83 C ATOM 1239 CE2 TYR B 12 15.479 20.997 16.974 1.00 51.34 C ATOM 1240 CZ TYR B 12 14.567 21.108 18.028 1.00 50.67 C ATOM 1241 OH TYR B 12 13.697 20.072 18.301 1.00 52.32 O ATOM 0 H TYR B 12 15.478 24.950 15.516 1.00 39.23 H new ATOM 0 HA TYR B 12 16.154 25.861 18.040 1.00 38.08 H new ATOM 0 HB2 TYR B 12 17.808 24.101 16.185 1.00 42.28 H new ATOM 0 HB3 TYR B 12 18.129 24.295 17.897 1.00 42.28 H new ATOM 0 HD1 TYR B 12 15.391 24.225 19.119 1.00 49.49 H new ATOM 0 HD2 TYR B 12 17.059 21.940 15.880 1.00 48.65 H new ATOM 0 HE1 TYR B 12 13.826 22.363 19.613 1.00 50.83 H new ATOM 0 HE2 TYR B 12 15.501 20.099 16.375 1.00 51.34 H new ATOM 0 HH TYR B 12 13.853 19.339 17.670 1.00 52.32 H new ATOM 1251 N CYS B 13 18.362 26.764 15.729 1.00 32.32 N ATOM 1252 CA CYS B 13 19.441 27.744 15.468 1.00 29.00 C ATOM 1253 C CYS B 13 18.980 29.101 15.979 1.00 29.81 C ATOM 1254 O CYS B 13 19.584 29.679 16.851 1.00 24.62 O ATOM 1255 CB CYS B 13 19.716 27.816 13.966 1.00 28.41 C ATOM 1256 SG CYS B 13 19.886 26.140 13.304 1.00 23.95 S ATOM 0 H CYS B 13 18.109 26.172 14.938 1.00 32.32 H new ATOM 0 HA CYS B 13 20.359 27.445 15.975 1.00 29.00 H new ATOM 0 HB2 CYS B 13 18.903 28.337 13.461 1.00 28.41 H new ATOM 0 HB3 CYS B 13 20.626 28.387 13.779 1.00 28.41 H new ATOM 0 HG CYS B 13 18.728 25.549 13.318 1.00 23.95 H new ATOM 1262 N GLN B 14 17.890 29.594 15.463 1.00 29.76 N ATOM 1263 CA GLN B 14 17.372 30.906 15.934 1.00 32.34 C ATOM 1264 C GLN B 14 17.357 30.925 17.470 1.00 33.14 C ATOM 1265 O GLN B 14 17.674 31.921 18.083 1.00 33.29 O ATOM 1266 CB GLN B 14 15.956 31.127 15.376 1.00 34.56 C ATOM 1267 CG GLN B 14 15.653 32.628 15.269 1.00 39.08 C ATOM 1268 CD GLN B 14 15.429 33.208 16.668 1.00 41.02 C ATOM 1269 OE1 GLN B 14 14.356 33.085 17.224 1.00 42.67 O ATOM 1270 NE2 GLN B 14 16.404 33.839 17.264 1.00 42.20 N ATOM 0 H GLN B 14 17.335 29.144 14.735 1.00 29.76 H new ATOM 0 HA GLN B 14 18.017 31.710 15.579 1.00 32.34 H new ATOM 0 HB2 GLN B 14 15.868 30.661 14.395 1.00 34.56 H new ATOM 0 HB3 GLN B 14 15.223 30.647 16.024 1.00 34.56 H new ATOM 0 HG2 GLN B 14 16.480 33.142 14.779 1.00 39.08 H new ATOM 0 HG3 GLN B 14 14.769 32.788 14.652 1.00 39.08 H new ATOM 0 HE21 GLN B 14 17.305 33.942 16.797 1.00 42.20 H new ATOM 0 HE22 GLN B 14 16.265 34.229 18.196 1.00 42.20 H new ATOM 1279 N LYS B 15 17.022 29.831 18.104 1.00 31.48 N ATOM 1280 CA LYS B 15 17.040 29.822 19.596 1.00 31.70 C ATOM 1281 C LYS B 15 18.510 29.840 20.026 1.00 30.74 C ATOM 1282 O LYS B 15 18.961 30.737 20.706 1.00 30.57 O ATOM 1283 CB LYS B 15 16.356 28.547 20.135 1.00 35.91 C ATOM 1284 CG LYS B 15 14.856 28.780 20.363 1.00 40.53 C ATOM 1285 CD LYS B 15 14.130 28.964 19.020 1.00 42.80 C ATOM 1286 CE LYS B 15 12.639 28.630 19.177 1.00 45.27 C ATOM 1287 NZ LYS B 15 11.859 29.346 18.129 1.00 48.21 N ATOM 0 H LYS B 15 16.741 28.956 17.661 1.00 31.48 H new ATOM 0 HA LYS B 15 16.502 30.684 19.991 1.00 31.70 H new ATOM 0 HB2 LYS B 15 16.497 27.729 19.429 1.00 35.91 H new ATOM 0 HB3 LYS B 15 16.827 28.246 21.071 1.00 35.91 H new ATOM 0 HG2 LYS B 15 14.428 27.934 20.902 1.00 40.53 H new ATOM 0 HG3 LYS B 15 14.709 29.662 20.986 1.00 40.53 H new ATOM 0 HD2 LYS B 15 14.246 29.991 18.672 1.00 42.80 H new ATOM 0 HD3 LYS B 15 14.578 28.319 18.264 1.00 42.80 H new ATOM 0 HE2 LYS B 15 12.485 27.555 19.090 1.00 45.27 H new ATOM 0 HE3 LYS B 15 12.292 28.922 20.168 1.00 45.27 H new ATOM 0 HZ1 LYS B 15 10.854 29.362 18.395 1.00 48.21 H new ATOM 0 HZ2 LYS B 15 12.209 30.321 18.041 1.00 48.21 H new ATOM 0 HZ3 LYS B 15 11.969 28.855 17.219 1.00 48.21 H new ATOM 1301 N LEU B 16 19.274 28.866 19.608 1.00 26.59 N ATOM 1302 CA LEU B 16 20.721 28.850 19.972 1.00 27.03 C ATOM 1303 C LEU B 16 21.294 30.226 19.638 1.00 24.17 C ATOM 1304 O LEU B 16 22.127 30.768 20.337 1.00 23.26 O ATOM 1305 CB LEU B 16 21.428 27.755 19.154 1.00 28.15 C ATOM 1306 CG LEU B 16 22.699 27.267 19.873 1.00 28.00 C ATOM 1307 CD1 LEU B 16 22.343 26.623 21.226 1.00 30.50 C ATOM 1308 CD2 LEU B 16 23.410 26.237 18.980 1.00 26.29 C ATOM 0 H LEU B 16 18.961 28.084 19.033 1.00 26.59 H new ATOM 0 HA LEU B 16 20.865 28.637 21.031 1.00 27.03 H new ATOM 0 HB2 LEU B 16 20.749 26.917 18.998 1.00 28.15 H new ATOM 0 HB3 LEU B 16 21.688 28.142 18.169 1.00 28.15 H new ATOM 0 HG LEU B 16 23.354 28.118 20.060 1.00 28.00 H new ATOM 0 HD11 LEU B 16 23.254 26.284 21.719 1.00 30.50 H new ATOM 0 HD12 LEU B 16 21.840 27.356 21.857 1.00 30.50 H new ATOM 0 HD13 LEU B 16 21.682 25.772 21.061 1.00 30.50 H new ATOM 0 HD21 LEU B 16 24.312 25.884 19.479 1.00 26.29 H new ATOM 0 HD22 LEU B 16 22.744 25.394 18.796 1.00 26.29 H new ATOM 0 HD23 LEU B 16 23.678 26.702 18.031 1.00 26.29 H new ATOM 1320 N LEU B 17 20.804 30.793 18.580 1.00 23.83 N ATOM 1321 CA LEU B 17 21.237 32.150 18.161 1.00 25.91 C ATOM 1322 C LEU B 17 20.771 33.142 19.232 1.00 28.74 C ATOM 1323 O LEU B 17 21.458 34.083 19.574 1.00 29.35 O ATOM 1324 CB LEU B 17 20.559 32.478 16.822 1.00 23.53 C ATOM 1325 CG LEU B 17 21.281 33.641 16.097 1.00 23.31 C ATOM 1326 CD1 LEU B 17 22.398 33.099 15.174 1.00 16.92 C ATOM 1327 CD2 LEU B 17 20.266 34.428 15.247 1.00 19.75 C ATOM 0 H LEU B 17 20.105 30.364 17.973 1.00 23.83 H new ATOM 0 HA LEU B 17 22.320 32.205 18.047 1.00 25.91 H new ATOM 0 HB2 LEU B 17 20.559 31.593 16.185 1.00 23.53 H new ATOM 0 HB3 LEU B 17 19.517 32.746 16.995 1.00 23.53 H new ATOM 0 HG LEU B 17 21.726 34.293 16.849 1.00 23.31 H new ATOM 0 HD11 LEU B 17 22.893 33.932 14.674 1.00 16.92 H new ATOM 0 HD12 LEU B 17 23.126 32.548 15.769 1.00 16.92 H new ATOM 0 HD13 LEU B 17 21.963 32.435 14.428 1.00 16.92 H new ATOM 0 HD21 LEU B 17 20.775 35.246 14.737 1.00 19.75 H new ATOM 0 HD22 LEU B 17 19.817 33.764 14.509 1.00 19.75 H new ATOM 0 HD23 LEU B 17 19.486 34.832 15.893 1.00 19.75 H new ATOM 1339 N GLU B 18 19.592 32.921 19.762 1.00 30.66 N ATOM 1340 CA GLU B 18 19.049 33.830 20.814 1.00 33.61 C ATOM 1341 C GLU B 18 19.668 33.457 22.170 1.00 34.68 C ATOM 1342 O GLU B 18 20.091 34.309 22.924 1.00 34.80 O ATOM 1343 CB GLU B 18 17.495 33.719 20.830 1.00 35.91 C ATOM 1344 CG GLU B 18 16.974 32.852 21.992 1.00 37.64 C ATOM 1345 CD GLU B 18 15.458 32.698 21.867 1.00 40.24 C ATOM 1346 OE1 GLU B 18 14.881 33.363 21.022 1.00 40.39 O ATOM 1347 OE2 GLU B 18 14.898 31.916 22.617 1.00 40.89 O ATOM 0 H GLU B 18 18.981 32.145 19.508 1.00 30.66 H new ATOM 0 HA GLU B 18 19.308 34.867 20.603 1.00 33.61 H new ATOM 0 HB2 GLU B 18 17.064 34.717 20.905 1.00 35.91 H new ATOM 0 HB3 GLU B 18 17.155 33.295 19.885 1.00 35.91 H new ATOM 0 HG2 GLU B 18 17.453 31.873 21.974 1.00 37.64 H new ATOM 0 HG3 GLU B 18 17.227 33.313 22.947 1.00 37.64 H new ATOM 1354 N LYS B 19 19.732 32.190 22.481 1.00 34.95 N ATOM 1355 CA LYS B 19 20.331 31.772 23.779 1.00 36.04 C ATOM 1356 C LYS B 19 21.669 32.488 23.968 1.00 35.87 C ATOM 1357 O LYS B 19 21.977 32.992 25.030 1.00 36.90 O ATOM 1358 CB LYS B 19 20.541 30.265 23.780 1.00 36.58 C ATOM 1359 CG LYS B 19 20.603 29.776 25.226 1.00 39.52 C ATOM 1360 CD LYS B 19 21.103 28.354 25.228 1.00 41.12 C ATOM 1361 CE LYS B 19 21.060 27.784 26.646 1.00 43.76 C ATOM 1362 NZ LYS B 19 21.488 28.831 27.617 1.00 45.38 N ATOM 0 H LYS B 19 19.395 31.428 21.892 1.00 34.95 H new ATOM 0 HA LYS B 19 19.662 32.037 24.598 1.00 36.04 H new ATOM 0 HB2 LYS B 19 19.727 29.771 23.249 1.00 36.58 H new ATOM 0 HB3 LYS B 19 21.463 30.012 23.257 1.00 36.58 H new ATOM 0 HG2 LYS B 19 21.266 30.412 25.813 1.00 39.52 H new ATOM 0 HG3 LYS B 19 19.617 29.832 25.687 1.00 39.52 H new ATOM 0 HD2 LYS B 19 20.491 27.744 24.564 1.00 41.12 H new ATOM 0 HD3 LYS B 19 22.123 28.318 24.844 1.00 41.12 H new ATOM 0 HE2 LYS B 19 20.052 27.445 26.882 1.00 43.76 H new ATOM 0 HE3 LYS B 19 21.714 26.915 26.720 1.00 43.76 H new ATOM 0 HZ1 LYS B 19 21.720 28.386 28.528 1.00 45.38 H new ATOM 0 HZ2 LYS B 19 22.327 29.324 27.249 1.00 45.38 H new ATOM 0 HZ3 LYS B 19 20.716 29.515 27.753 1.00 45.38 H new ATOM 1376 N PHE B 20 22.463 32.537 22.933 1.00 35.16 N ATOM 1377 CA PHE B 20 23.782 33.218 23.012 1.00 34.19 C ATOM 1378 C PHE B 20 23.651 34.621 22.415 1.00 34.42 C ATOM 1379 O PHE B 20 24.602 35.375 22.358 1.00 33.94 O ATOM 1380 CB PHE B 20 24.788 32.408 22.202 1.00 34.18 C ATOM 1381 CG PHE B 20 25.172 31.166 22.966 1.00 32.04 C ATOM 1382 CD1 PHE B 20 24.398 30.007 22.841 1.00 31.71 C ATOM 1383 CD2 PHE B 20 26.292 31.175 23.803 1.00 34.13 C ATOM 1384 CE1 PHE B 20 24.745 28.855 23.554 1.00 31.01 C ATOM 1385 CE2 PHE B 20 26.638 30.025 24.520 1.00 33.69 C ATOM 1386 CZ PHE B 20 25.864 28.864 24.394 1.00 32.95 C ATOM 0 H PHE B 20 22.248 32.127 22.024 1.00 35.16 H new ATOM 0 HA PHE B 20 24.115 33.295 24.047 1.00 34.19 H new ATOM 0 HB2 PHE B 20 24.358 32.136 21.238 1.00 34.18 H new ATOM 0 HB3 PHE B 20 25.674 33.010 21.998 1.00 34.18 H new ATOM 0 HD1 PHE B 20 23.533 30.002 22.194 1.00 31.71 H new ATOM 0 HD2 PHE B 20 26.890 32.070 23.896 1.00 34.13 H new ATOM 0 HE1 PHE B 20 24.150 27.959 23.456 1.00 31.01 H new ATOM 0 HE2 PHE B 20 27.501 30.032 25.170 1.00 33.69 H new ATOM 0 HZ PHE B 20 26.131 27.975 24.946 1.00 32.95 H new ATOM 1396 N ARG B 21 22.472 34.969 21.971 1.00 33.90 N ATOM 1397 CA ARG B 21 22.248 36.320 21.377 1.00 35.50 C ATOM 1398 C ARG B 21 23.231 36.565 20.229 1.00 34.22 C ATOM 1399 O ARG B 21 23.700 37.670 20.036 1.00 33.41 O ATOM 1400 CB ARG B 21 22.446 37.395 22.452 1.00 38.56 C ATOM 1401 CG ARG B 21 21.479 37.144 23.620 1.00 42.96 C ATOM 1402 CD ARG B 21 20.022 37.485 23.220 1.00 46.75 C ATOM 1403 NE ARG B 21 19.359 38.257 24.321 1.00 50.46 N ATOM 1404 CZ ARG B 21 19.444 37.871 25.569 1.00 51.88 C ATOM 1405 NH1 ARG B 21 20.013 36.738 25.874 1.00 54.10 N ATOM 1406 NH2 ARG B 21 18.926 38.609 26.512 1.00 54.21 N ATOM 0 H ARG B 21 21.647 34.369 21.995 1.00 33.90 H new ATOM 0 HA ARG B 21 21.230 36.368 20.991 1.00 35.50 H new ATOM 0 HB2 ARG B 21 23.475 37.380 22.810 1.00 38.56 H new ATOM 0 HB3 ARG B 21 22.270 38.384 22.028 1.00 38.56 H new ATOM 0 HG2 ARG B 21 21.540 36.100 23.929 1.00 42.96 H new ATOM 0 HG3 ARG B 21 21.775 37.748 24.478 1.00 42.96 H new ATOM 0 HD2 ARG B 21 20.015 38.069 22.299 1.00 46.75 H new ATOM 0 HD3 ARG B 21 19.466 36.569 23.021 1.00 46.75 H new ATOM 0 HE ARG B 21 18.831 39.100 24.093 1.00 50.46 H new ATOM 0 HH11 ARG B 21 20.396 36.145 25.138 1.00 54.10 H new ATOM 0 HH12 ARG B 21 20.075 36.445 26.849 1.00 54.10 H new ATOM 0 HH21 ARG B 21 18.457 39.483 26.276 1.00 54.21 H new ATOM 0 HH22 ARG B 21 18.990 38.312 27.486 1.00 54.21 H new ATOM 1420 N TYR B 22 23.551 35.557 19.461 1.00 31.03 N ATOM 1421 CA TYR B 22 24.501 35.770 18.337 1.00 30.00 C ATOM 1422 C TYR B 22 23.800 36.602 17.230 1.00 28.60 C ATOM 1423 O TYR B 22 22.604 36.478 17.056 1.00 27.38 O ATOM 1424 CB TYR B 22 24.901 34.402 17.761 1.00 26.97 C ATOM 1425 CG TYR B 22 26.000 33.755 18.596 1.00 28.47 C ATOM 1426 CD1 TYR B 22 27.231 34.405 18.800 1.00 28.83 C ATOM 1427 CD2 TYR B 22 25.783 32.495 19.171 1.00 26.95 C ATOM 1428 CE1 TYR B 22 28.226 33.797 19.574 1.00 27.02 C ATOM 1429 CE2 TYR B 22 26.783 31.890 19.943 1.00 26.27 C ATOM 1430 CZ TYR B 22 28.002 32.542 20.145 1.00 26.46 C ATOM 1431 OH TYR B 22 28.986 31.947 20.908 1.00 23.82 O ATOM 0 H TYR B 22 23.198 34.605 19.564 1.00 31.03 H new ATOM 0 HA TYR B 22 25.386 36.300 18.691 1.00 30.00 H new ATOM 0 HB2 TYR B 22 24.030 33.748 17.731 1.00 26.97 H new ATOM 0 HB3 TYR B 22 25.244 34.523 16.733 1.00 26.97 H new ATOM 0 HD1 TYR B 22 27.408 35.375 18.359 1.00 28.83 H new ATOM 0 HD2 TYR B 22 24.841 31.989 19.018 1.00 26.95 H new ATOM 0 HE1 TYR B 22 29.169 34.299 19.730 1.00 27.02 H new ATOM 0 HE2 TYR B 22 26.612 30.919 20.383 1.00 26.27 H new ATOM 0 HH TYR B 22 29.770 32.534 20.947 1.00 23.82 H new ATOM 1441 N PRO B 23 24.552 37.408 16.492 1.00 29.13 N ATOM 1442 CA PRO B 23 23.976 38.217 15.396 1.00 28.62 C ATOM 1443 C PRO B 23 23.235 37.305 14.402 1.00 28.74 C ATOM 1444 O PRO B 23 23.237 36.101 14.535 1.00 26.54 O ATOM 1445 CB PRO B 23 25.189 38.907 14.726 1.00 29.12 C ATOM 1446 CG PRO B 23 26.461 38.475 15.506 1.00 29.87 C ATOM 1447 CD PRO B 23 26.005 37.585 16.682 1.00 29.51 C ATOM 0 HA PRO B 23 23.248 38.947 15.751 1.00 28.62 H new ATOM 0 HB2 PRO B 23 25.265 38.617 13.678 1.00 29.12 H new ATOM 0 HB3 PRO B 23 25.075 39.991 14.749 1.00 29.12 H new ATOM 0 HG2 PRO B 23 27.143 37.929 14.854 1.00 29.87 H new ATOM 0 HG3 PRO B 23 27.001 39.348 15.873 1.00 29.87 H new ATOM 0 HD2 PRO B 23 26.523 36.626 16.674 1.00 29.51 H new ATOM 0 HD3 PRO B 23 26.222 38.057 17.640 1.00 29.51 H new ATOM 1455 N TRP B 24 22.598 37.878 13.415 1.00 24.77 N ATOM 1456 CA TRP B 24 21.848 37.050 12.419 1.00 26.20 C ATOM 1457 C TRP B 24 22.796 36.454 11.372 1.00 24.23 C ATOM 1458 O TRP B 24 22.428 35.557 10.641 1.00 20.77 O ATOM 1459 CB TRP B 24 20.800 37.918 11.717 1.00 28.27 C ATOM 1460 CG TRP B 24 20.081 37.100 10.689 1.00 30.88 C ATOM 1461 CD1 TRP B 24 20.114 37.331 9.356 1.00 31.38 C ATOM 1462 CD2 TRP B 24 19.229 35.930 10.879 1.00 29.00 C ATOM 1463 NE1 TRP B 24 19.339 36.380 8.717 1.00 31.09 N ATOM 1464 CE2 TRP B 24 18.773 35.495 9.612 1.00 31.07 C ATOM 1465 CE3 TRP B 24 18.811 35.210 12.015 1.00 30.12 C ATOM 1466 CZ2 TRP B 24 17.935 34.387 9.476 1.00 31.07 C ATOM 1467 CZ3 TRP B 24 17.967 34.096 11.881 1.00 31.73 C ATOM 1468 CH2 TRP B 24 17.531 33.685 10.614 1.00 30.51 C ATOM 0 H TRP B 24 22.563 38.885 13.254 1.00 24.77 H new ATOM 0 HA TRP B 24 21.362 36.232 12.951 1.00 26.20 H new ATOM 0 HB2 TRP B 24 20.091 38.311 12.445 1.00 28.27 H new ATOM 0 HB3 TRP B 24 21.280 38.775 11.245 1.00 28.27 H new ATOM 0 HD1 TRP B 24 20.657 38.128 8.870 1.00 31.38 H new ATOM 0 HE1 TRP B 24 19.202 36.338 7.707 1.00 31.09 H new ATOM 0 HE3 TRP B 24 19.142 35.517 12.996 1.00 30.12 H new ATOM 0 HZ2 TRP B 24 17.601 34.075 8.498 1.00 31.07 H new ATOM 0 HZ3 TRP B 24 17.652 33.553 12.760 1.00 31.73 H new ATOM 0 HH2 TRP B 24 16.883 32.826 10.518 1.00 30.51 H new ATOM 1479 N GLU B 25 24.001 36.942 11.274 1.00 21.71 N ATOM 1480 CA GLU B 25 24.939 36.390 10.251 1.00 23.69 C ATOM 1481 C GLU B 25 25.554 35.070 10.740 1.00 22.17 C ATOM 1482 O GLU B 25 26.179 34.365 9.977 1.00 20.98 O ATOM 1483 CB GLU B 25 26.050 37.411 9.954 1.00 29.06 C ATOM 1484 CG GLU B 25 26.438 38.148 11.238 1.00 37.12 C ATOM 1485 CD GLU B 25 27.814 38.798 11.068 1.00 42.03 C ATOM 1486 OE1 GLU B 25 28.726 38.105 10.646 1.00 44.52 O ATOM 1487 OE2 GLU B 25 27.932 39.976 11.362 1.00 44.49 O ATOM 0 H GLU B 25 24.377 37.693 11.852 1.00 21.71 H new ATOM 0 HA GLU B 25 24.380 36.193 9.336 1.00 23.69 H new ATOM 0 HB2 GLU B 25 26.921 36.903 9.539 1.00 29.06 H new ATOM 0 HB3 GLU B 25 25.709 38.124 9.204 1.00 29.06 H new ATOM 0 HG2 GLU B 25 25.693 38.909 11.471 1.00 37.12 H new ATOM 0 HG3 GLU B 25 26.456 37.452 12.077 1.00 37.12 H new ATOM 1494 N LEU B 26 25.409 34.733 12.003 1.00 18.07 N ATOM 1495 CA LEU B 26 26.013 33.456 12.513 1.00 16.50 C ATOM 1496 C LEU B 26 25.009 32.310 12.453 1.00 16.77 C ATOM 1497 O LEU B 26 25.162 31.313 13.130 1.00 16.07 O ATOM 1498 CB LEU B 26 26.477 33.636 13.955 1.00 18.60 C ATOM 1499 CG LEU B 26 27.292 34.928 14.098 1.00 21.90 C ATOM 1500 CD1 LEU B 26 28.063 34.887 15.414 1.00 24.06 C ATOM 1501 CD2 LEU B 26 28.292 35.069 12.940 1.00 25.09 C ATOM 0 H LEU B 26 24.903 35.282 12.698 1.00 18.07 H new ATOM 0 HA LEU B 26 26.863 33.212 11.876 1.00 16.50 H new ATOM 0 HB2 LEU B 26 25.614 33.668 14.620 1.00 18.60 H new ATOM 0 HB3 LEU B 26 27.082 32.782 14.258 1.00 18.60 H new ATOM 0 HG LEU B 26 26.609 35.777 14.081 1.00 21.90 H new ATOM 0 HD11 LEU B 26 28.645 35.802 15.523 1.00 24.06 H new ATOM 0 HD12 LEU B 26 27.362 34.802 16.244 1.00 24.06 H new ATOM 0 HD13 LEU B 26 28.734 34.028 15.416 1.00 24.06 H new ATOM 0 HD21 LEU B 26 28.860 35.992 13.060 1.00 25.09 H new ATOM 0 HD22 LEU B 26 28.975 34.219 12.943 1.00 25.09 H new ATOM 0 HD23 LEU B 26 27.752 35.096 11.994 1.00 25.09 H new ATOM 1513 N MET B 27 24.005 32.410 11.629 1.00 15.51 N ATOM 1514 CA MET B 27 23.051 31.282 11.532 1.00 15.51 C ATOM 1515 C MET B 27 23.768 30.058 10.918 1.00 15.79 C ATOM 1516 O MET B 27 23.532 28.952 11.362 1.00 14.86 O ATOM 1517 CB MET B 27 21.816 31.672 10.702 1.00 16.03 C ATOM 1518 CG MET B 27 20.860 32.494 11.563 1.00 14.48 C ATOM 1519 SD MET B 27 20.054 31.426 12.787 1.00 11.00 S ATOM 1520 CE MET B 27 19.092 30.411 11.638 1.00 16.96 C ATOM 0 H MET B 27 23.809 33.211 11.029 1.00 15.51 H new ATOM 0 HA MET B 27 22.701 31.025 12.532 1.00 15.51 H new ATOM 0 HB2 MET B 27 22.120 32.247 9.827 1.00 16.03 H new ATOM 0 HB3 MET B 27 21.314 30.777 10.336 1.00 16.03 H new ATOM 0 HG2 MET B 27 21.406 33.291 12.067 1.00 14.48 H new ATOM 0 HG3 MET B 27 20.109 32.971 10.933 1.00 14.48 H new ATOM 0 HE1 MET B 27 18.151 30.124 12.107 1.00 16.96 H new ATOM 0 HE2 MET B 27 18.887 30.982 10.732 1.00 16.96 H new ATOM 0 HE3 MET B 27 19.658 29.515 11.382 1.00 16.96 H new ATOM 1530 N PRO B 28 24.649 30.259 9.938 1.00 15.25 N ATOM 1531 CA PRO B 28 25.389 29.130 9.340 1.00 16.18 C ATOM 1532 C PRO B 28 26.213 28.438 10.431 1.00 15.53 C ATOM 1533 O PRO B 28 26.491 27.266 10.351 1.00 16.52 O ATOM 1534 CB PRO B 28 26.289 29.778 8.259 1.00 16.78 C ATOM 1535 CG PRO B 28 25.759 31.217 8.058 1.00 19.84 C ATOM 1536 CD PRO B 28 24.983 31.573 9.336 1.00 17.18 C ATOM 0 HA PRO B 28 24.745 28.367 8.903 1.00 16.18 H new ATOM 0 HB2 PRO B 28 27.332 29.789 8.576 1.00 16.78 H new ATOM 0 HB3 PRO B 28 26.245 29.214 7.327 1.00 16.78 H new ATOM 0 HG2 PRO B 28 26.580 31.915 7.895 1.00 19.84 H new ATOM 0 HG3 PRO B 28 25.113 31.275 7.182 1.00 19.84 H new ATOM 0 HD2 PRO B 28 25.586 32.179 10.012 1.00 17.18 H new ATOM 0 HD3 PRO B 28 24.085 32.147 9.109 1.00 17.18 H new ATOM 1544 N LEU B 29 26.593 29.153 11.457 1.00 13.35 N ATOM 1545 CA LEU B 29 27.383 28.518 12.552 1.00 12.43 C ATOM 1546 C LEU B 29 26.424 27.808 13.507 1.00 12.94 C ATOM 1547 O LEU B 29 26.532 26.619 13.728 1.00 13.87 O ATOM 1548 CB LEU B 29 28.181 29.584 13.308 1.00 15.82 C ATOM 1549 CG LEU B 29 28.971 30.445 12.318 1.00 12.60 C ATOM 1550 CD1 LEU B 29 29.904 31.371 13.101 1.00 13.73 C ATOM 1551 CD2 LEU B 29 29.799 29.542 11.386 1.00 13.81 C ATOM 0 H LEU B 29 26.392 30.145 11.584 1.00 13.35 H new ATOM 0 HA LEU B 29 28.082 27.796 12.129 1.00 12.43 H new ATOM 0 HB2 LEU B 29 27.506 30.211 13.890 1.00 15.82 H new ATOM 0 HB3 LEU B 29 28.862 29.108 14.014 1.00 15.82 H new ATOM 0 HG LEU B 29 28.282 31.037 11.716 1.00 12.60 H new ATOM 0 HD11 LEU B 29 30.472 31.989 12.405 1.00 13.73 H new ATOM 0 HD12 LEU B 29 29.314 32.011 13.757 1.00 13.73 H new ATOM 0 HD13 LEU B 29 30.592 30.773 13.699 1.00 13.73 H new ATOM 0 HD21 LEU B 29 30.359 30.160 10.684 1.00 13.81 H new ATOM 0 HD22 LEU B 29 30.493 28.946 11.979 1.00 13.81 H new ATOM 0 HD23 LEU B 29 29.132 28.879 10.834 1.00 13.81 H new ATOM 1563 N MET B 30 25.465 28.509 14.059 1.00 13.14 N ATOM 1564 CA MET B 30 24.498 27.835 14.968 1.00 14.92 C ATOM 1565 C MET B 30 23.953 26.610 14.242 1.00 15.06 C ATOM 1566 O MET B 30 23.639 25.598 14.836 1.00 14.78 O ATOM 1567 CB MET B 30 23.336 28.779 15.285 1.00 14.70 C ATOM 1568 CG MET B 30 23.814 29.956 16.136 1.00 10.57 C ATOM 1569 SD MET B 30 24.416 29.353 17.738 1.00 7.09 S ATOM 1570 CE MET B 30 26.162 29.779 17.526 1.00 13.40 C ATOM 0 H MET B 30 25.313 29.508 13.920 1.00 13.14 H new ATOM 0 HA MET B 30 24.992 27.554 15.898 1.00 14.92 H new ATOM 0 HB2 MET B 30 22.897 29.148 14.358 1.00 14.70 H new ATOM 0 HB3 MET B 30 22.553 28.236 15.814 1.00 14.70 H new ATOM 0 HG2 MET B 30 24.609 30.492 15.617 1.00 10.57 H new ATOM 0 HG3 MET B 30 22.998 30.663 16.287 1.00 10.57 H new ATOM 0 HE1 MET B 30 26.696 29.601 18.460 1.00 13.40 H new ATOM 0 HE2 MET B 30 26.594 29.162 16.738 1.00 13.40 H new ATOM 0 HE3 MET B 30 26.249 30.830 17.252 1.00 13.40 H new ATOM 1580 N TYR B 31 23.845 26.712 12.948 1.00 13.82 N ATOM 1581 CA TYR B 31 23.327 25.576 12.142 1.00 14.24 C ATOM 1582 C TYR B 31 24.270 24.371 12.277 1.00 15.20 C ATOM 1583 O TYR B 31 23.862 23.293 12.661 1.00 15.23 O ATOM 1584 CB TYR B 31 23.238 26.005 10.673 1.00 15.18 C ATOM 1585 CG TYR B 31 22.897 24.812 9.813 1.00 19.70 C ATOM 1586 CD1 TYR B 31 23.916 23.960 9.374 1.00 21.03 C ATOM 1587 CD2 TYR B 31 21.567 24.557 9.454 1.00 22.09 C ATOM 1588 CE1 TYR B 31 23.610 22.854 8.578 1.00 22.51 C ATOM 1589 CE2 TYR B 31 21.262 23.448 8.659 1.00 25.56 C ATOM 1590 CZ TYR B 31 22.282 22.596 8.219 1.00 25.00 C ATOM 1591 OH TYR B 31 21.979 21.503 7.433 1.00 30.46 O ATOM 0 H TYR B 31 24.096 27.542 12.410 1.00 13.82 H new ATOM 0 HA TYR B 31 22.338 25.292 12.501 1.00 14.24 H new ATOM 0 HB2 TYR B 31 22.479 26.779 10.556 1.00 15.18 H new ATOM 0 HB3 TYR B 31 24.186 26.437 10.352 1.00 15.18 H new ATOM 0 HD1 TYR B 31 24.941 24.158 9.651 1.00 21.03 H new ATOM 0 HD2 TYR B 31 20.780 25.215 9.790 1.00 22.09 H new ATOM 0 HE1 TYR B 31 24.398 22.198 8.239 1.00 22.51 H new ATOM 0 HE2 TYR B 31 20.237 23.248 8.384 1.00 25.56 H new ATOM 0 HH TYR B 31 21.012 21.469 7.278 1.00 30.46 H new ATOM 1601 N VAL B 32 25.524 24.542 11.955 1.00 14.03 N ATOM 1602 CA VAL B 32 26.484 23.400 12.054 1.00 12.14 C ATOM 1603 C VAL B 32 26.526 22.866 13.488 1.00 12.91 C ATOM 1604 O VAL B 32 26.357 21.686 13.720 1.00 14.47 O ATOM 1605 CB VAL B 32 27.885 23.865 11.636 1.00 12.64 C ATOM 1606 CG1 VAL B 32 28.842 22.676 11.674 1.00 12.95 C ATOM 1607 CG2 VAL B 32 27.831 24.432 10.214 1.00 14.27 C ATOM 0 H VAL B 32 25.926 25.420 11.628 1.00 14.03 H new ATOM 0 HA VAL B 32 26.152 22.602 11.389 1.00 12.14 H new ATOM 0 HB VAL B 32 28.234 24.638 12.321 1.00 12.64 H new ATOM 0 HG11 VAL B 32 29.839 23.002 11.378 1.00 12.95 H new ATOM 0 HG12 VAL B 32 28.878 22.270 12.685 1.00 12.95 H new ATOM 0 HG13 VAL B 32 28.493 21.906 10.986 1.00 12.95 H new ATOM 0 HG21 VAL B 32 28.826 24.763 9.916 1.00 14.27 H new ATOM 0 HG22 VAL B 32 27.485 23.660 9.527 1.00 14.27 H new ATOM 0 HG23 VAL B 32 27.144 25.278 10.185 1.00 14.27 H new ATOM 1617 N ILE B 33 26.753 23.721 14.450 1.00 13.72 N ATOM 1618 CA ILE B 33 26.809 23.268 15.872 1.00 9.81 C ATOM 1619 C ILE B 33 25.666 22.278 16.154 1.00 12.06 C ATOM 1620 O ILE B 33 25.885 21.166 16.592 1.00 13.15 O ATOM 1621 CB ILE B 33 26.701 24.518 16.758 1.00 11.56 C ATOM 1622 CG1 ILE B 33 28.046 25.265 16.693 1.00 12.90 C ATOM 1623 CG2 ILE B 33 26.386 24.137 18.209 1.00 12.06 C ATOM 1624 CD1 ILE B 33 27.937 26.660 17.320 1.00 11.54 C ATOM 0 H ILE B 33 26.903 24.720 14.311 1.00 13.72 H new ATOM 0 HA ILE B 33 27.743 22.748 16.083 1.00 9.81 H new ATOM 0 HB ILE B 33 25.890 25.152 16.398 1.00 11.56 H new ATOM 0 HG12 ILE B 33 28.811 24.688 17.213 1.00 12.90 H new ATOM 0 HG13 ILE B 33 28.366 25.354 15.655 1.00 12.90 H new ATOM 0 HG21 ILE B 33 26.315 25.040 18.815 1.00 12.06 H new ATOM 0 HG22 ILE B 33 25.439 23.599 18.247 1.00 12.06 H new ATOM 0 HG23 ILE B 33 27.180 23.500 18.599 1.00 12.06 H new ATOM 0 HD11 ILE B 33 28.902 27.163 17.259 1.00 11.54 H new ATOM 0 HD12 ILE B 33 27.190 27.243 16.782 1.00 11.54 H new ATOM 0 HD13 ILE B 33 27.642 26.567 18.365 1.00 11.54 H new ATOM 1636 N LEU B 34 24.459 22.672 15.883 1.00 13.55 N ATOM 1637 CA LEU B 34 23.280 21.775 16.098 1.00 16.27 C ATOM 1638 C LEU B 34 23.473 20.477 15.286 1.00 18.00 C ATOM 1639 O LEU B 34 23.241 19.390 15.777 1.00 20.35 O ATOM 1640 CB LEU B 34 22.021 22.553 15.602 1.00 15.33 C ATOM 1641 CG LEU B 34 21.031 23.082 16.725 1.00 18.88 C ATOM 1642 CD1 LEU B 34 21.495 22.853 18.170 1.00 18.63 C ATOM 1643 CD2 LEU B 34 20.802 24.596 16.539 1.00 18.04 C ATOM 0 H LEU B 34 24.228 23.594 15.514 1.00 13.55 H new ATOM 0 HA LEU B 34 23.167 21.502 17.147 1.00 16.27 H new ATOM 0 HB2 LEU B 34 22.357 23.406 15.013 1.00 15.33 H new ATOM 0 HB3 LEU B 34 21.460 21.903 14.931 1.00 15.33 H new ATOM 0 HG LEU B 34 20.121 22.497 16.592 1.00 18.88 H new ATOM 0 HD11 LEU B 34 20.749 23.250 18.859 1.00 18.63 H new ATOM 0 HD12 LEU B 34 21.620 21.785 18.347 1.00 18.63 H new ATOM 0 HD13 LEU B 34 22.445 23.361 18.332 1.00 18.63 H new ATOM 0 HD21 LEU B 34 20.122 24.959 17.310 1.00 18.04 H new ATOM 0 HD22 LEU B 34 21.754 25.120 16.619 1.00 18.04 H new ATOM 0 HD23 LEU B 34 20.367 24.780 15.557 1.00 18.04 H new ATOM 1655 N LYS B 35 23.884 20.584 14.055 1.00 16.90 N ATOM 1656 CA LYS B 35 24.080 19.359 13.213 1.00 19.51 C ATOM 1657 C LYS B 35 24.916 18.336 13.971 1.00 18.97 C ATOM 1658 O LYS B 35 24.796 17.144 13.770 1.00 18.29 O ATOM 1659 CB LYS B 35 24.810 19.745 11.920 1.00 23.32 C ATOM 1660 CG LYS B 35 24.715 18.593 10.917 1.00 27.46 C ATOM 1661 CD LYS B 35 25.454 18.972 9.629 1.00 30.03 C ATOM 1662 CE LYS B 35 25.032 18.031 8.498 1.00 33.24 C ATOM 1663 NZ LYS B 35 23.678 18.418 8.012 1.00 34.14 N ATOM 0 H LYS B 35 24.095 21.466 13.589 1.00 16.90 H new ATOM 0 HA LYS B 35 23.107 18.927 12.977 1.00 19.51 H new ATOM 0 HB2 LYS B 35 24.369 20.647 11.496 1.00 23.32 H new ATOM 0 HB3 LYS B 35 25.855 19.971 12.133 1.00 23.32 H new ATOM 0 HG2 LYS B 35 25.148 17.689 11.344 1.00 27.46 H new ATOM 0 HG3 LYS B 35 23.670 18.373 10.698 1.00 27.46 H new ATOM 0 HD2 LYS B 35 25.230 20.004 9.360 1.00 30.03 H new ATOM 0 HD3 LYS B 35 26.531 18.910 9.784 1.00 30.03 H new ATOM 0 HE2 LYS B 35 25.752 18.081 7.681 1.00 33.24 H new ATOM 0 HE3 LYS B 35 25.023 17.000 8.852 1.00 33.24 H new ATOM 0 HZ1 LYS B 35 23.508 17.988 7.080 1.00 34.14 H new ATOM 0 HZ2 LYS B 35 22.959 18.083 8.685 1.00 34.14 H new ATOM 0 HZ3 LYS B 35 23.621 19.453 7.931 1.00 34.14 H new ATOM 1677 N ASP B 36 25.774 18.795 14.824 1.00 17.40 N ATOM 1678 CA ASP B 36 26.645 17.871 15.591 1.00 17.99 C ATOM 1679 C ASP B 36 25.950 17.423 16.875 1.00 20.53 C ATOM 1680 O ASP B 36 25.986 16.267 17.247 1.00 21.50 O ATOM 1681 CB ASP B 36 27.925 18.622 15.929 1.00 17.75 C ATOM 1682 CG ASP B 36 28.377 19.392 14.686 1.00 19.30 C ATOM 1683 OD1 ASP B 36 28.511 18.771 13.644 1.00 18.21 O ATOM 1684 OD2 ASP B 36 28.583 20.589 14.798 1.00 17.31 O ATOM 0 H ASP B 36 25.913 19.785 15.028 1.00 17.40 H new ATOM 0 HA ASP B 36 26.863 16.981 15.001 1.00 17.99 H new ATOM 0 HB2 ASP B 36 27.754 19.308 16.759 1.00 17.75 H new ATOM 0 HB3 ASP B 36 28.701 17.925 16.246 1.00 17.75 H new ATOM 1689 N ALA B 37 25.340 18.340 17.564 1.00 17.76 N ATOM 1690 CA ALA B 37 24.661 17.997 18.843 1.00 20.31 C ATOM 1691 C ALA B 37 23.286 17.395 18.575 1.00 21.98 C ATOM 1692 O ALA B 37 22.345 17.635 19.305 1.00 20.93 O ATOM 1693 CB ALA B 37 24.502 19.270 19.660 1.00 16.79 C ATOM 0 H ALA B 37 25.281 19.322 17.295 1.00 17.76 H new ATOM 0 HA ALA B 37 25.260 17.265 19.385 1.00 20.31 H new ATOM 0 HB1 ALA B 37 24.006 19.038 20.602 1.00 16.79 H new ATOM 0 HB2 ALA B 37 25.484 19.697 19.863 1.00 16.79 H new ATOM 0 HB3 ALA B 37 23.902 19.988 19.101 1.00 16.79 H new ATOM 1699 N ASP B 38 23.149 16.625 17.541 1.00 22.08 N ATOM 1700 CA ASP B 38 21.820 16.034 17.256 1.00 24.70 C ATOM 1701 C ASP B 38 20.800 17.169 17.154 1.00 27.43 C ATOM 1702 O ASP B 38 19.606 16.957 17.217 1.00 26.89 O ATOM 1703 CB ASP B 38 21.436 15.081 18.397 1.00 26.17 C ATOM 1704 CG ASP B 38 20.381 14.084 17.910 1.00 26.41 C ATOM 1705 OD1 ASP B 38 19.349 14.528 17.433 1.00 29.79 O ATOM 1706 OD2 ASP B 38 20.623 12.894 18.022 1.00 30.65 O ATOM 0 H ASP B 38 23.891 16.380 16.886 1.00 22.08 H new ATOM 0 HA ASP B 38 21.842 15.474 16.321 1.00 24.70 H new ATOM 0 HB2 ASP B 38 22.319 14.547 18.749 1.00 26.17 H new ATOM 0 HB3 ASP B 38 21.049 15.649 19.243 1.00 26.17 H new ATOM 1711 N ALA B 39 21.279 18.374 16.999 1.00 25.83 N ATOM 1712 CA ALA B 39 20.374 19.547 16.889 1.00 28.40 C ATOM 1713 C ALA B 39 19.708 19.828 18.242 1.00 30.32 C ATOM 1714 O ALA B 39 18.740 20.558 18.327 1.00 32.55 O ATOM 1715 CB ALA B 39 19.317 19.275 15.819 1.00 28.82 C ATOM 0 H ALA B 39 22.273 18.595 16.944 1.00 25.83 H new ATOM 0 HA ALA B 39 20.952 20.425 16.602 1.00 28.40 H new ATOM 0 HB1 ALA B 39 18.652 20.135 15.737 1.00 28.82 H new ATOM 0 HB2 ALA B 39 19.806 19.102 14.860 1.00 28.82 H new ATOM 0 HB3 ALA B 39 18.738 18.394 16.095 1.00 28.82 H new ATOM 1721 N ASN B 40 20.226 19.267 19.305 1.00 29.50 N ATOM 1722 CA ASN B 40 19.630 19.516 20.653 1.00 32.01 C ATOM 1723 C ASN B 40 20.332 20.718 21.290 1.00 32.47 C ATOM 1724 O ASN B 40 21.476 20.642 21.691 1.00 29.40 O ATOM 1725 CB ASN B 40 19.822 18.281 21.536 1.00 33.06 C ATOM 1726 CG ASN B 40 18.853 17.182 21.095 1.00 33.55 C ATOM 1727 OD1 ASN B 40 18.714 16.916 19.917 1.00 35.11 O ATOM 1728 ND2 ASN B 40 18.173 16.528 21.996 1.00 33.85 N ATOM 0 H ASN B 40 21.036 18.647 19.298 1.00 29.50 H new ATOM 0 HA ASN B 40 18.564 19.720 20.554 1.00 32.01 H new ATOM 0 HB2 ASN B 40 20.850 17.925 21.463 1.00 33.06 H new ATOM 0 HB3 ASN B 40 19.647 18.537 22.581 1.00 33.06 H new ATOM 0 HD21 ASN B 40 17.525 15.793 21.712 1.00 33.85 H new ATOM 0 HD22 ASN B 40 18.290 16.751 22.984 1.00 33.85 H new ATOM 1735 N ILE B 41 19.658 21.832 21.371 1.00 33.58 N ATOM 1736 CA ILE B 41 20.285 23.048 21.965 1.00 35.14 C ATOM 1737 C ILE B 41 20.917 22.708 23.318 1.00 34.57 C ATOM 1738 O ILE B 41 22.094 22.922 23.528 1.00 33.97 O ATOM 1739 CB ILE B 41 19.211 24.140 22.133 1.00 38.72 C ATOM 1740 CG1 ILE B 41 18.829 24.644 20.719 1.00 39.13 C ATOM 1741 CG2 ILE B 41 19.733 25.302 23.039 1.00 40.27 C ATOM 1742 CD1 ILE B 41 17.858 25.837 20.773 1.00 40.55 C ATOM 0 H ILE B 41 18.697 21.954 21.051 1.00 33.58 H new ATOM 0 HA ILE B 41 21.070 23.414 21.303 1.00 35.14 H new ATOM 0 HB ILE B 41 18.329 23.735 22.630 1.00 38.72 H new ATOM 0 HG12 ILE B 41 19.732 24.936 20.182 1.00 39.13 H new ATOM 0 HG13 ILE B 41 18.372 23.830 20.156 1.00 39.13 H new ATOM 0 HG21 ILE B 41 18.956 26.060 23.142 1.00 40.27 H new ATOM 0 HG22 ILE B 41 19.989 24.909 24.023 1.00 40.27 H new ATOM 0 HG23 ILE B 41 20.618 25.748 22.585 1.00 40.27 H new ATOM 0 HD11 ILE B 41 17.618 26.157 19.759 1.00 40.55 H new ATOM 0 HD12 ILE B 41 16.943 25.539 21.286 1.00 40.55 H new ATOM 0 HD13 ILE B 41 18.324 26.661 21.313 1.00 40.55 H new ATOM 1754 N GLU B 42 20.152 22.197 24.241 1.00 35.46 N ATOM 1755 CA GLU B 42 20.724 21.864 25.578 1.00 34.62 C ATOM 1756 C GLU B 42 22.047 21.114 25.406 1.00 31.10 C ATOM 1757 O GLU B 42 22.985 21.312 26.152 1.00 29.48 O ATOM 1758 CB GLU B 42 19.736 20.990 26.352 1.00 40.18 C ATOM 1759 CG GLU B 42 18.463 21.789 26.637 1.00 46.15 C ATOM 1760 CD GLU B 42 17.548 20.981 27.558 1.00 50.80 C ATOM 1761 OE1 GLU B 42 17.815 20.950 28.748 1.00 53.92 O ATOM 1762 OE2 GLU B 42 16.595 20.406 27.058 1.00 52.61 O ATOM 0 H GLU B 42 19.158 21.995 24.130 1.00 35.46 H new ATOM 0 HA GLU B 42 20.905 22.786 26.131 1.00 34.62 H new ATOM 0 HB2 GLU B 42 19.496 20.096 25.776 1.00 40.18 H new ATOM 0 HB3 GLU B 42 20.185 20.655 27.287 1.00 40.18 H new ATOM 0 HG2 GLU B 42 18.716 22.742 27.103 1.00 46.15 H new ATOM 0 HG3 GLU B 42 17.948 22.017 25.704 1.00 46.15 H new ATOM 1769 N GLU B 43 22.132 20.261 24.424 1.00 26.75 N ATOM 1770 CA GLU B 43 23.398 19.505 24.198 1.00 25.31 C ATOM 1771 C GLU B 43 24.342 20.352 23.344 1.00 22.10 C ATOM 1772 O GLU B 43 25.545 20.305 23.501 1.00 21.22 O ATOM 1773 CB GLU B 43 23.089 18.192 23.471 1.00 24.85 C ATOM 1774 CG GLU B 43 24.285 17.245 23.589 1.00 27.31 C ATOM 1775 CD GLU B 43 24.384 16.725 25.024 1.00 29.91 C ATOM 1776 OE1 GLU B 43 23.501 15.986 25.427 1.00 30.00 O ATOM 1777 OE2 GLU B 43 25.341 17.075 25.695 1.00 28.72 O ATOM 0 H GLU B 43 21.380 20.054 23.767 1.00 26.75 H new ATOM 0 HA GLU B 43 23.868 19.283 25.156 1.00 25.31 H new ATOM 0 HB2 GLU B 43 22.201 17.728 23.900 1.00 24.85 H new ATOM 0 HB3 GLU B 43 22.870 18.389 22.421 1.00 24.85 H new ATOM 0 HG2 GLU B 43 24.172 16.411 22.896 1.00 27.31 H new ATOM 0 HG3 GLU B 43 25.203 17.765 23.315 1.00 27.31 H new ATOM 1784 N ALA B 44 23.805 21.126 22.439 1.00 21.46 N ATOM 1785 CA ALA B 44 24.673 21.974 21.576 1.00 22.00 C ATOM 1786 C ALA B 44 25.184 23.168 22.391 1.00 21.74 C ATOM 1787 O ALA B 44 26.301 23.615 22.222 1.00 19.07 O ATOM 1788 CB ALA B 44 23.868 22.444 20.347 1.00 22.06 C ATOM 0 H ALA B 44 22.804 21.207 22.261 1.00 21.46 H new ATOM 0 HA ALA B 44 25.532 21.402 21.226 1.00 22.00 H new ATOM 0 HB1 ALA B 44 24.501 23.065 19.713 1.00 22.06 H new ATOM 0 HB2 ALA B 44 23.528 21.577 19.781 1.00 22.06 H new ATOM 0 HB3 ALA B 44 23.005 23.023 20.677 1.00 22.06 H new ATOM 1794 N SER B 45 24.378 23.679 23.274 1.00 21.72 N ATOM 1795 CA SER B 45 24.816 24.836 24.102 1.00 24.00 C ATOM 1796 C SER B 45 26.012 24.427 24.962 1.00 24.30 C ATOM 1797 O SER B 45 26.995 25.135 25.055 1.00 23.27 O ATOM 1798 CB SER B 45 23.663 25.271 25.006 1.00 25.03 C ATOM 1799 OG SER B 45 23.628 24.440 26.161 1.00 28.51 O ATOM 0 H SER B 45 23.432 23.346 23.460 1.00 21.72 H new ATOM 0 HA SER B 45 25.105 25.662 23.452 1.00 24.00 H new ATOM 0 HB2 SER B 45 23.789 26.313 25.298 1.00 25.03 H new ATOM 0 HB3 SER B 45 22.718 25.203 24.467 1.00 25.03 H new ATOM 0 HG SER B 45 23.376 23.529 25.901 1.00 28.51 H new ATOM 1805 N ARG B 46 25.934 23.290 25.597 1.00 26.45 N ATOM 1806 CA ARG B 46 27.062 22.836 26.458 1.00 27.79 C ATOM 1807 C ARG B 46 28.376 22.929 25.675 1.00 26.86 C ATOM 1808 O ARG B 46 29.413 23.246 26.225 1.00 25.99 O ATOM 1809 CB ARG B 46 26.806 21.386 26.900 1.00 31.64 C ATOM 1810 CG ARG B 46 25.861 21.376 28.111 1.00 39.02 C ATOM 1811 CD ARG B 46 25.441 19.937 28.446 1.00 43.92 C ATOM 1812 NE ARG B 46 24.223 19.582 27.666 1.00 48.12 N ATOM 1813 CZ ARG B 46 23.850 18.335 27.572 1.00 50.42 C ATOM 1814 NH1 ARG B 46 24.548 17.398 28.153 1.00 52.31 N ATOM 1815 NH2 ARG B 46 22.778 18.024 26.894 1.00 52.39 N ATOM 0 H ARG B 46 25.137 22.655 25.557 1.00 26.45 H new ATOM 0 HA ARG B 46 27.135 23.472 27.340 1.00 27.79 H new ATOM 0 HB2 ARG B 46 26.368 20.817 26.080 1.00 31.64 H new ATOM 0 HB3 ARG B 46 27.748 20.902 27.157 1.00 31.64 H new ATOM 0 HG2 ARG B 46 26.356 21.827 28.971 1.00 39.02 H new ATOM 0 HG3 ARG B 46 24.979 21.980 27.898 1.00 39.02 H new ATOM 0 HD2 ARG B 46 26.251 19.246 28.211 1.00 43.92 H new ATOM 0 HD3 ARG B 46 25.242 19.844 29.514 1.00 43.92 H new ATOM 0 HE ARG B 46 23.681 20.313 27.206 1.00 48.12 H new ATOM 0 HH11 ARG B 46 25.386 17.640 28.681 1.00 52.31 H new ATOM 0 HH12 ARG B 46 24.255 16.424 28.079 1.00 52.31 H new ATOM 0 HH21 ARG B 46 22.233 18.756 26.438 1.00 52.39 H new ATOM 0 HH22 ARG B 46 22.486 17.049 26.820 1.00 52.39 H new ATOM 1829 N ARG B 47 28.344 22.667 24.398 1.00 22.86 N ATOM 1830 CA ARG B 47 29.595 22.755 23.591 1.00 20.88 C ATOM 1831 C ARG B 47 30.007 24.219 23.476 1.00 18.23 C ATOM 1832 O ARG B 47 31.076 24.609 23.904 1.00 21.17 O ATOM 1833 CB ARG B 47 29.343 22.174 22.200 1.00 19.97 C ATOM 1834 CG ARG B 47 28.648 20.818 22.345 1.00 21.43 C ATOM 1835 CD ARG B 47 28.441 20.178 20.968 1.00 22.98 C ATOM 1836 NE ARG B 47 28.339 18.701 21.136 1.00 20.54 N ATOM 1837 CZ ARG B 47 27.943 17.958 20.143 1.00 24.59 C ATOM 1838 NH1 ARG B 47 27.688 18.502 18.989 1.00 24.12 N ATOM 1839 NH2 ARG B 47 27.810 16.670 20.302 1.00 16.51 N ATOM 0 H ARG B 47 27.509 22.396 23.879 1.00 22.86 H new ATOM 0 HA ARG B 47 30.392 22.189 24.074 1.00 20.88 H new ATOM 0 HB2 ARG B 47 28.724 22.854 21.615 1.00 19.97 H new ATOM 0 HB3 ARG B 47 30.285 22.059 21.664 1.00 19.97 H new ATOM 0 HG2 ARG B 47 29.248 20.159 22.973 1.00 21.43 H new ATOM 0 HG3 ARG B 47 27.687 20.945 22.843 1.00 21.43 H new ATOM 0 HD2 ARG B 47 27.536 20.568 20.502 1.00 22.98 H new ATOM 0 HD3 ARG B 47 29.272 20.426 20.308 1.00 22.98 H new ATOM 0 HE ARG B 47 28.580 18.272 22.029 1.00 20.54 H new ATOM 0 HH11 ARG B 47 27.799 19.508 18.864 1.00 24.12 H new ATOM 0 HH12 ARG B 47 27.378 17.922 18.209 1.00 24.12 H new ATOM 0 HH21 ARG B 47 28.016 16.244 21.205 1.00 16.51 H new ATOM 0 HH22 ARG B 47 27.500 16.089 19.523 1.00 16.51 H new ATOM 1853 N ILE B 48 29.154 25.038 22.928 1.00 16.11 N ATOM 1854 CA ILE B 48 29.471 26.492 22.812 1.00 18.86 C ATOM 1855 C ILE B 48 29.988 26.971 24.158 1.00 23.26 C ATOM 1856 O ILE B 48 31.064 27.519 24.274 1.00 21.90 O ATOM 1857 CB ILE B 48 28.197 27.244 22.450 1.00 18.65 C ATOM 1858 CG1 ILE B 48 27.606 26.596 21.198 1.00 19.26 C ATOM 1859 CG2 ILE B 48 28.533 28.712 22.181 1.00 21.02 C ATOM 1860 CD1 ILE B 48 26.393 27.390 20.698 1.00 15.25 C ATOM 0 H ILE B 48 28.246 24.763 22.553 1.00 16.11 H new ATOM 0 HA ILE B 48 30.222 26.667 22.042 1.00 18.86 H new ATOM 0 HB ILE B 48 27.476 27.199 23.266 1.00 18.65 H new ATOM 0 HG12 ILE B 48 28.363 26.548 20.415 1.00 19.26 H new ATOM 0 HG13 ILE B 48 27.310 25.570 21.418 1.00 19.26 H new ATOM 0 HG21 ILE B 48 27.622 29.252 21.922 1.00 21.02 H new ATOM 0 HG22 ILE B 48 28.975 29.154 23.074 1.00 21.02 H new ATOM 0 HG23 ILE B 48 29.241 28.778 21.355 1.00 21.02 H new ATOM 0 HD11 ILE B 48 25.988 26.912 19.806 1.00 15.25 H new ATOM 0 HD12 ILE B 48 25.629 27.415 21.475 1.00 15.25 H new ATOM 0 HD13 ILE B 48 26.699 28.408 20.457 1.00 15.25 H new ATOM 1872 N GLU B 49 29.225 26.730 25.177 1.00 24.41 N ATOM 1873 CA GLU B 49 29.638 27.126 26.550 1.00 29.72 C ATOM 1874 C GLU B 49 31.093 26.747 26.776 1.00 31.01 C ATOM 1875 O GLU B 49 31.944 27.589 26.987 1.00 30.32 O ATOM 1876 CB GLU B 49 28.808 26.328 27.537 1.00 30.86 C ATOM 1877 CG GLU B 49 27.407 26.934 27.671 1.00 35.37 C ATOM 1878 CD GLU B 49 26.693 26.305 28.869 1.00 37.77 C ATOM 1879 OE1 GLU B 49 27.214 25.340 29.404 1.00 38.78 O ATOM 1880 OE2 GLU B 49 25.638 26.798 29.231 1.00 38.92 O ATOM 0 H GLU B 49 28.317 26.268 25.120 1.00 24.41 H new ATOM 0 HA GLU B 49 29.502 28.200 26.677 1.00 29.72 H new ATOM 0 HB2 GLU B 49 28.733 25.293 27.205 1.00 30.86 H new ATOM 0 HB3 GLU B 49 29.300 26.316 28.509 1.00 30.86 H new ATOM 0 HG2 GLU B 49 27.477 28.014 27.801 1.00 35.37 H new ATOM 0 HG3 GLU B 49 26.835 26.759 26.760 1.00 35.37 H new ATOM 1887 N GLU B 50 31.384 25.471 26.718 1.00 31.22 N ATOM 1888 CA GLU B 50 32.786 25.023 26.910 1.00 30.52 C ATOM 1889 C GLU B 50 33.631 25.873 25.988 1.00 30.97 C ATOM 1890 O GLU B 50 34.647 26.384 26.359 1.00 30.11 O ATOM 1891 CB GLU B 50 32.899 23.529 26.540 1.00 33.65 C ATOM 1892 CG GLU B 50 34.046 22.872 27.319 1.00 34.45 C ATOM 1893 CD GLU B 50 34.053 21.367 27.046 1.00 36.26 C ATOM 1894 OE1 GLU B 50 33.877 20.992 25.899 1.00 36.07 O ATOM 1895 OE2 GLU B 50 34.236 20.616 27.989 1.00 35.94 O ATOM 0 H GLU B 50 30.709 24.726 26.546 1.00 31.22 H new ATOM 0 HA GLU B 50 33.116 25.133 27.943 1.00 30.52 H new ATOM 0 HB2 GLU B 50 31.961 23.020 26.763 1.00 33.65 H new ATOM 0 HB3 GLU B 50 33.071 23.425 25.469 1.00 33.65 H new ATOM 0 HG2 GLU B 50 34.999 23.310 27.022 1.00 34.45 H new ATOM 0 HG3 GLU B 50 33.928 23.058 28.387 1.00 34.45 H new ATOM 1902 N GLY B 51 33.151 26.060 24.804 1.00 0.00 N ATOM 1903 CA GLY B 51 33.859 26.906 23.813 1.00 0.00 C ATOM 1904 C GLY B 51 34.104 28.306 24.392 1.00 0.00 C ATOM 1905 O GLY B 51 35.217 28.772 24.518 1.00 0.00 O ATOM 0 H GLY B 51 32.277 25.654 24.469 1.00 0.00 H new ATOM 0 HA2 GLY B 51 34.809 26.445 23.543 1.00 0.00 H new ATOM 0 HA3 GLY B 51 33.269 26.980 22.899 1.00 0.00 H new ATOM 1909 N GLN B 52 33.048 28.995 24.724 1.00 30.19 N ATOM 1910 CA GLN B 52 33.194 30.376 25.279 1.00 33.26 C ATOM 1911 C GLN B 52 34.230 30.338 26.388 1.00 34.21 C ATOM 1912 O GLN B 52 35.176 31.099 26.414 1.00 33.27 O ATOM 1913 CB GLN B 52 31.860 30.845 25.870 1.00 34.36 C ATOM 1914 CG GLN B 52 30.722 30.666 24.845 1.00 37.06 C ATOM 1915 CD GLN B 52 30.554 31.931 24.000 1.00 39.18 C ATOM 1916 OE1 GLN B 52 31.497 32.668 23.787 1.00 39.82 O ATOM 1917 NE2 GLN B 52 29.378 32.212 23.511 1.00 40.80 N ATOM 0 H GLN B 52 32.087 28.664 24.636 1.00 30.19 H new ATOM 0 HA GLN B 52 33.498 31.060 24.486 1.00 33.26 H new ATOM 0 HB2 GLN B 52 31.636 30.277 26.773 1.00 34.36 H new ATOM 0 HB3 GLN B 52 31.933 31.893 26.162 1.00 34.36 H new ATOM 0 HG2 GLN B 52 30.939 29.816 24.198 1.00 37.06 H new ATOM 0 HG3 GLN B 52 29.790 30.442 25.364 1.00 37.06 H new ATOM 0 HE21 GLN B 52 28.589 31.591 23.692 1.00 40.80 H new ATOM 0 HE22 GLN B 52 29.247 33.052 22.948 1.00 40.80 H new ATOM 1926 N TYR B 53 34.053 29.430 27.294 1.00 35.76 N ATOM 1927 CA TYR B 53 35.014 29.288 28.411 1.00 38.60 C ATOM 1928 C TYR B 53 36.354 28.849 27.829 1.00 39.68 C ATOM 1929 O TYR B 53 37.396 29.381 28.144 1.00 39.52 O ATOM 1930 CB TYR B 53 34.491 28.212 29.377 1.00 40.83 C ATOM 1931 CG TYR B 53 35.627 27.662 30.209 1.00 43.21 C ATOM 1932 CD1 TYR B 53 36.459 26.670 29.685 1.00 44.13 C ATOM 1933 CD2 TYR B 53 35.848 28.153 31.489 1.00 43.89 C ATOM 1934 CE1 TYR B 53 37.513 26.168 30.444 1.00 47.20 C ATOM 1935 CE2 TYR B 53 36.905 27.654 32.260 1.00 46.12 C ATOM 1936 CZ TYR B 53 37.740 26.659 31.736 1.00 46.20 C ATOM 1937 OH TYR B 53 38.784 26.163 32.490 1.00 48.95 O ATOM 0 H TYR B 53 33.274 28.772 27.309 1.00 35.76 H new ATOM 0 HA TYR B 53 35.131 30.230 28.947 1.00 38.60 H new ATOM 0 HB2 TYR B 53 33.727 28.637 30.027 1.00 40.83 H new ATOM 0 HB3 TYR B 53 34.019 27.406 28.815 1.00 40.83 H new ATOM 0 HD1 TYR B 53 36.284 26.291 28.689 1.00 44.13 H new ATOM 0 HD2 TYR B 53 35.204 28.921 31.891 1.00 43.89 H new ATOM 0 HE1 TYR B 53 38.155 25.401 30.037 1.00 47.20 H new ATOM 0 HE2 TYR B 53 37.076 28.035 33.256 1.00 46.12 H new ATOM 0 HH TYR B 53 39.411 25.686 31.907 1.00 48.95 H new ATOM 1947 N VAL B 54 36.311 27.867 26.987 1.00 39.35 N ATOM 1948 CA VAL B 54 37.548 27.339 26.361 1.00 40.00 C ATOM 1949 C VAL B 54 38.355 28.515 25.802 1.00 40.47 C ATOM 1950 O VAL B 54 39.482 28.755 26.187 1.00 39.23 O ATOM 1951 CB VAL B 54 37.087 26.399 25.244 1.00 40.33 C ATOM 1952 CG1 VAL B 54 38.124 26.257 24.159 1.00 40.58 C ATOM 1953 CG2 VAL B 54 36.699 25.001 25.795 1.00 39.92 C ATOM 0 H VAL B 54 35.454 27.396 26.698 1.00 39.35 H new ATOM 0 HA VAL B 54 38.185 26.805 27.066 1.00 40.00 H new ATOM 0 HB VAL B 54 36.200 26.856 24.806 1.00 40.33 H new ATOM 0 HG11 VAL B 54 37.754 25.581 23.388 1.00 40.58 H new ATOM 0 HG12 VAL B 54 38.326 27.233 23.719 1.00 40.58 H new ATOM 0 HG13 VAL B 54 39.043 25.853 24.584 1.00 40.58 H new ATOM 0 HG21 VAL B 54 36.377 24.362 24.973 1.00 39.92 H new ATOM 0 HG22 VAL B 54 37.561 24.552 26.287 1.00 39.92 H new ATOM 0 HG23 VAL B 54 35.885 25.106 26.513 1.00 39.92 H new ATOM 1963 N VAL B 55 37.772 29.249 24.900 1.00 40.13 N ATOM 1964 CA VAL B 55 38.480 30.415 24.309 1.00 42.29 C ATOM 1965 C VAL B 55 38.819 31.404 25.426 1.00 43.82 C ATOM 1966 O VAL B 55 39.966 31.739 25.643 1.00 43.78 O ATOM 1967 CB VAL B 55 37.567 31.077 23.271 1.00 41.62 C ATOM 1968 CG1 VAL B 55 38.316 32.202 22.551 1.00 42.45 C ATOM 1969 CG2 VAL B 55 37.132 30.027 22.246 1.00 41.12 C ATOM 0 H VAL B 55 36.829 29.091 24.544 1.00 40.13 H new ATOM 0 HA VAL B 55 39.401 30.096 23.821 1.00 42.29 H new ATOM 0 HB VAL B 55 36.695 31.494 23.775 1.00 41.62 H new ATOM 0 HG11 VAL B 55 37.658 32.665 21.816 1.00 42.45 H new ATOM 0 HG12 VAL B 55 38.633 32.951 23.277 1.00 42.45 H new ATOM 0 HG13 VAL B 55 39.191 31.792 22.047 1.00 42.45 H new ATOM 0 HG21 VAL B 55 36.482 30.490 21.504 1.00 41.12 H new ATOM 0 HG22 VAL B 55 38.012 29.615 21.751 1.00 41.12 H new ATOM 0 HG23 VAL B 55 36.592 29.226 22.752 1.00 41.12 H new ATOM 1979 N ASN B 56 37.832 31.865 26.146 1.00 44.48 N ATOM 1980 CA ASN B 56 38.106 32.820 27.258 1.00 47.06 C ATOM 1981 C ASN B 56 39.231 32.253 28.128 1.00 47.69 C ATOM 1982 O ASN B 56 40.152 32.949 28.505 1.00 47.82 O ATOM 1983 CB ASN B 56 36.840 32.996 28.100 1.00 46.90 C ATOM 1984 CG ASN B 56 35.712 33.536 27.218 1.00 47.81 C ATOM 1985 OD1 ASN B 56 35.873 33.673 26.021 1.00 48.43 O ATOM 1986 ND2 ASN B 56 34.569 33.850 27.762 1.00 47.03 N ATOM 0 H ASN B 56 36.850 31.622 26.013 1.00 44.48 H new ATOM 0 HA ASN B 56 38.404 33.788 26.855 1.00 47.06 H new ATOM 0 HB2 ASN B 56 36.547 32.043 28.540 1.00 46.90 H new ATOM 0 HB3 ASN B 56 37.031 33.682 28.925 1.00 46.90 H new ATOM 0 HD21 ASN B 56 33.811 34.210 27.183 1.00 47.03 H new ATOM 0 HD22 ASN B 56 34.434 33.735 28.766 1.00 47.03 H new ATOM 1993 N GLU B 57 39.165 30.986 28.434 1.00 49.57 N ATOM 1994 CA GLU B 57 40.229 30.356 29.265 1.00 51.35 C ATOM 1995 C GLU B 57 41.579 30.554 28.574 1.00 52.18 C ATOM 1996 O GLU B 57 42.510 31.086 29.146 1.00 52.13 O ATOM 1997 CB GLU B 57 39.935 28.859 29.405 1.00 52.66 C ATOM 1998 CG GLU B 57 40.914 28.220 30.389 1.00 53.83 C ATOM 1999 CD GLU B 57 40.790 26.697 30.315 1.00 55.85 C ATOM 2000 OE1 GLU B 57 40.616 26.190 29.219 1.00 56.34 O ATOM 2001 OE2 GLU B 57 40.871 26.065 31.355 1.00 57.10 O ATOM 0 H GLU B 57 38.416 30.358 28.143 1.00 49.57 H new ATOM 0 HA GLU B 57 40.254 30.814 30.254 1.00 51.35 H new ATOM 0 HB2 GLU B 57 38.912 28.712 29.751 1.00 52.66 H new ATOM 0 HB3 GLU B 57 40.015 28.372 28.433 1.00 52.66 H new ATOM 0 HG2 GLU B 57 41.934 28.524 30.153 1.00 53.83 H new ATOM 0 HG3 GLU B 57 40.705 28.564 31.402 1.00 53.83 H new