USER MOD reduce.3.24.130724 H: found=0, std=0, add=840, rem=0, adj=19 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 22 TYR OH : rot 0:sc= -1.07 USER MOD Set 1.2: B 52 GLN : amide:sc= -0.722 K(o=-1.8,f=-1.1!) USER MOD Set 2.1: A 22 TYR OH : rot 0:sc= -1.41 USER MOD Set 2.2: A 52 GLN : amide:sc= -0.919 K(o=-2.3,f=-1.3!) USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 CYS SG : rot 72:sc= -0.962 USER MOD Single : A 14 GLN : amide:sc= -3.22 K(o=-3.2,f=-1.7) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ -168:sc=-0.00497 (180deg=-0.202) USER MOD Single : A 27 MET CE :methyl -148:sc= -0.67 (180deg=-3.37!) USER MOD Single : A 30 MET CE :methyl -159:sc= -3.18! (180deg=-5.34!) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 SER OG : rot -74:sc= -0.307 USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 ASN : amide:sc= -1.81 K(o=-1.8,f=-6!) USER MOD Single : A 58 TYR OH : rot 61:sc= 0.314 USER MOD Single : B 12 TYR OH : rot 180:sc= 0 USER MOD Single : B 13 CYS SG : rot 72:sc= -1.27 USER MOD Single : B 14 GLN : amide:sc= -3.94! K(o=-3.9!,f=-2.6) USER MOD Single : B 15 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0222) USER MOD Single : B 19 LYS NZ :NH3+ -161:sc= -0.0662 (180deg=-0.642) USER MOD Single : B 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 30 MET CE :methyl 175:sc= -3.05 (180deg=-3.22) USER MOD Single : B 31 TYR OH : rot 180:sc= 0 USER MOD Single : B 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 40 ASN : amide:sc= -0.0295 K(o=-0.029,f=-1.4) USER MOD Single : B 45 SER OG : rot -67:sc= 0.0403 USER MOD Single : B 53 TYR OH : rot 9:sc= 0.0154 USER MOD Single : B 56 ASN : amide:sc= -0.633 K(o=-0.63,f=-2.6!) USER MOD ----------------------------------------------------------------- ATOM 106 N PHE A 9 44.319 22.624 17.781 1.00 44.59 N ATOM 107 CA PHE A 9 42.856 22.830 17.765 1.00 42.14 C ATOM 108 C PHE A 9 42.572 24.322 17.617 1.00 41.09 C ATOM 109 O PHE A 9 41.957 24.758 16.664 1.00 40.10 O ATOM 110 CB PHE A 9 42.258 22.306 19.083 1.00 39.48 C ATOM 111 CG PHE A 9 40.823 21.938 18.864 1.00 35.93 C ATOM 112 CD1 PHE A 9 39.837 22.913 19.009 1.00 33.89 C ATOM 113 CD2 PHE A 9 40.480 20.633 18.507 1.00 34.84 C ATOM 114 CE1 PHE A 9 38.503 22.582 18.799 1.00 31.72 C ATOM 115 CE2 PHE A 9 39.143 20.303 18.296 1.00 33.98 C ATOM 116 CZ PHE A 9 38.156 21.283 18.443 1.00 33.09 C ATOM 0 HA PHE A 9 42.406 22.291 16.931 1.00 42.14 H new ATOM 0 HB2 PHE A 9 42.819 21.438 19.431 1.00 39.48 H new ATOM 0 HB3 PHE A 9 42.336 23.067 19.859 1.00 39.48 H new ATOM 0 HD1 PHE A 9 40.108 23.922 19.283 1.00 33.89 H new ATOM 0 HD2 PHE A 9 41.248 19.882 18.395 1.00 34.84 H new ATOM 0 HE1 PHE A 9 37.736 23.334 18.912 1.00 31.72 H new ATOM 0 HE2 PHE A 9 38.870 19.295 18.020 1.00 33.98 H new ATOM 0 HZ PHE A 9 37.119 21.030 18.279 1.00 33.09 H new ATOM 126 N LEU A 10 43.026 25.111 18.548 1.00 40.61 N ATOM 127 CA LEU A 10 42.791 26.574 18.450 1.00 40.95 C ATOM 128 C LEU A 10 43.422 27.079 17.158 1.00 41.08 C ATOM 129 O LEU A 10 42.894 27.950 16.498 1.00 37.24 O ATOM 130 CB LEU A 10 43.418 27.279 19.651 1.00 41.66 C ATOM 131 CG LEU A 10 42.883 26.660 20.946 1.00 43.24 C ATOM 132 CD1 LEU A 10 43.515 27.369 22.137 1.00 42.19 C ATOM 133 CD2 LEU A 10 41.358 26.817 21.016 1.00 41.41 C ATOM 0 H LEU A 10 43.548 24.806 19.370 1.00 40.61 H new ATOM 0 HA LEU A 10 41.721 26.783 18.445 1.00 40.95 H new ATOM 0 HB2 LEU A 10 44.503 27.187 19.613 1.00 41.66 H new ATOM 0 HB3 LEU A 10 43.187 28.344 19.622 1.00 41.66 H new ATOM 0 HG LEU A 10 43.134 25.599 20.966 1.00 43.24 H new ATOM 0 HD11 LEU A 10 43.138 26.933 23.062 1.00 42.19 H new ATOM 0 HD12 LEU A 10 44.598 27.254 22.096 1.00 42.19 H new ATOM 0 HD13 LEU A 10 43.262 28.429 22.106 1.00 42.19 H new ATOM 0 HD21 LEU A 10 40.989 26.373 21.941 1.00 41.41 H new ATOM 0 HD22 LEU A 10 41.100 27.876 20.993 1.00 41.41 H new ATOM 0 HD23 LEU A 10 40.901 26.313 20.164 1.00 41.41 H new ATOM 145 N ASP A 11 44.539 26.527 16.773 1.00 41.30 N ATOM 146 CA ASP A 11 45.163 26.977 15.504 1.00 41.83 C ATOM 147 C ASP A 11 44.150 26.764 14.385 1.00 40.90 C ATOM 148 O ASP A 11 43.772 27.692 13.702 1.00 39.80 O ATOM 149 CB ASP A 11 46.429 26.167 15.213 1.00 44.60 C ATOM 150 CG ASP A 11 47.375 26.239 16.412 1.00 47.53 C ATOM 151 OD1 ASP A 11 47.062 26.960 17.345 1.00 48.01 O ATOM 152 OD2 ASP A 11 48.396 25.573 16.377 1.00 48.56 O ATOM 0 H ASP A 11 45.039 25.794 17.276 1.00 41.30 H new ATOM 0 HA ASP A 11 45.442 28.028 15.579 1.00 41.83 H new ATOM 0 HB2 ASP A 11 46.168 25.129 15.005 1.00 44.60 H new ATOM 0 HB3 ASP A 11 46.924 26.556 14.323 1.00 44.60 H new ATOM 157 N TYR A 12 43.680 25.552 14.198 1.00 39.29 N ATOM 158 CA TYR A 12 42.672 25.323 13.123 1.00 38.27 C ATOM 159 C TYR A 12 41.564 26.348 13.279 1.00 34.82 C ATOM 160 O TYR A 12 41.150 26.981 12.330 1.00 33.76 O ATOM 161 CB TYR A 12 42.033 23.934 13.226 1.00 42.68 C ATOM 162 CG TYR A 12 43.061 22.820 13.274 1.00 45.94 C ATOM 163 CD1 TYR A 12 44.230 22.855 12.492 1.00 47.36 C ATOM 164 CD2 TYR A 12 42.815 21.720 14.101 1.00 48.31 C ATOM 165 CE1 TYR A 12 45.138 21.790 12.550 1.00 48.74 C ATOM 166 CE2 TYR A 12 43.716 20.666 14.158 1.00 49.78 C ATOM 167 CZ TYR A 12 44.880 20.694 13.383 1.00 49.89 C ATOM 168 OH TYR A 12 45.774 19.644 13.440 1.00 52.12 O ATOM 0 H TYR A 12 43.947 24.727 14.735 1.00 39.29 H new ATOM 0 HA TYR A 12 43.180 25.406 12.162 1.00 38.27 H new ATOM 0 HB2 TYR A 12 41.413 23.889 14.121 1.00 42.68 H new ATOM 0 HB3 TYR A 12 41.373 23.778 12.373 1.00 42.68 H new ATOM 0 HD1 TYR A 12 44.427 23.700 11.849 1.00 47.36 H new ATOM 0 HD2 TYR A 12 41.917 21.690 14.700 1.00 48.31 H new ATOM 0 HE1 TYR A 12 46.037 21.814 11.952 1.00 48.74 H new ATOM 0 HE2 TYR A 12 43.518 19.822 14.802 1.00 49.78 H new ATOM 0 HH TYR A 12 45.444 18.967 14.067 1.00 52.12 H new ATOM 178 N CYS A 13 41.079 26.529 14.475 1.00 32.26 N ATOM 179 CA CYS A 13 40.010 27.529 14.676 1.00 30.43 C ATOM 180 C CYS A 13 40.474 28.831 14.038 1.00 30.74 C ATOM 181 O CYS A 13 39.889 29.304 13.095 1.00 28.86 O ATOM 182 CB CYS A 13 39.755 27.730 16.170 1.00 30.34 C ATOM 183 SG CYS A 13 39.573 26.116 16.969 1.00 24.58 S ATOM 0 H CYS A 13 41.378 26.029 15.313 1.00 32.26 H new ATOM 0 HA CYS A 13 39.079 27.194 14.220 1.00 30.43 H new ATOM 0 HB2 CYS A 13 40.581 28.281 16.621 1.00 30.34 H new ATOM 0 HB3 CYS A 13 38.855 28.326 16.320 1.00 30.34 H new ATOM 0 HG CYS A 13 40.732 25.530 17.032 1.00 24.58 H new ATOM 189 N GLN A 14 41.552 29.383 14.519 1.00 32.92 N ATOM 190 CA GLN A 14 42.078 30.638 13.918 1.00 34.93 C ATOM 191 C GLN A 14 42.156 30.473 12.393 1.00 35.74 C ATOM 192 O GLN A 14 41.831 31.373 11.647 1.00 35.15 O ATOM 193 CB GLN A 14 43.469 30.933 14.497 1.00 36.23 C ATOM 194 CG GLN A 14 43.789 32.425 14.365 1.00 40.72 C ATOM 195 CD GLN A 14 44.018 32.774 12.897 1.00 42.88 C ATOM 196 OE1 GLN A 14 43.601 33.818 12.436 1.00 45.84 O ATOM 197 NE2 GLN A 14 44.666 31.939 12.139 1.00 44.23 N ATOM 0 H GLN A 14 42.092 29.018 15.304 1.00 32.92 H new ATOM 0 HA GLN A 14 41.415 31.472 14.151 1.00 34.93 H new ATOM 0 HB2 GLN A 14 43.505 30.637 15.545 1.00 36.23 H new ATOM 0 HB3 GLN A 14 44.222 30.344 13.973 1.00 36.23 H new ATOM 0 HG2 GLN A 14 42.968 33.020 14.766 1.00 40.72 H new ATOM 0 HG3 GLN A 14 44.676 32.670 14.950 1.00 40.72 H new ATOM 0 HE21 GLN A 14 45.015 31.063 12.528 1.00 44.23 H new ATOM 0 HE22 GLN A 14 44.825 32.160 11.156 1.00 44.23 H new ATOM 206 N LYS A 15 42.557 29.324 11.916 1.00 35.66 N ATOM 207 CA LYS A 15 42.603 29.130 10.439 1.00 36.27 C ATOM 208 C LYS A 15 41.162 29.147 9.941 1.00 34.97 C ATOM 209 O LYS A 15 40.771 29.976 9.151 1.00 34.84 O ATOM 210 CB LYS A 15 43.224 27.772 10.100 1.00 40.22 C ATOM 211 CG LYS A 15 44.650 27.667 10.664 1.00 44.18 C ATOM 212 CD LYS A 15 45.650 28.333 9.719 1.00 47.52 C ATOM 213 CE LYS A 15 47.071 27.968 10.149 1.00 50.10 C ATOM 214 NZ LYS A 15 48.052 28.748 9.344 1.00 50.42 N ATOM 0 H LYS A 15 42.850 28.523 12.476 1.00 35.66 H new ATOM 0 HA LYS A 15 43.202 29.913 9.974 1.00 36.27 H new ATOM 0 HB2 LYS A 15 42.607 26.972 10.509 1.00 40.22 H new ATOM 0 HB3 LYS A 15 43.245 27.637 9.019 1.00 40.22 H new ATOM 0 HG2 LYS A 15 44.696 28.141 11.644 1.00 44.18 H new ATOM 0 HG3 LYS A 15 44.916 26.619 10.804 1.00 44.18 H new ATOM 0 HD2 LYS A 15 45.473 28.007 8.694 1.00 47.52 H new ATOM 0 HD3 LYS A 15 45.519 29.415 9.736 1.00 47.52 H new ATOM 0 HE2 LYS A 15 47.206 28.179 11.210 1.00 50.10 H new ATOM 0 HE3 LYS A 15 47.240 26.900 10.012 1.00 50.10 H new ATOM 0 HZ1 LYS A 15 49.018 28.499 9.637 1.00 50.42 H new ATOM 0 HZ2 LYS A 15 47.928 28.526 8.336 1.00 50.42 H new ATOM 0 HZ3 LYS A 15 47.895 29.765 9.496 1.00 50.42 H new ATOM 228 N LEU A 16 40.351 28.252 10.433 1.00 31.52 N ATOM 229 CA LEU A 16 38.921 28.237 10.018 1.00 30.64 C ATOM 230 C LEU A 16 38.384 29.660 10.179 1.00 29.20 C ATOM 231 O LEU A 16 37.668 30.178 9.346 1.00 30.83 O ATOM 232 CB LEU A 16 38.160 27.261 10.928 1.00 29.49 C ATOM 233 CG LEU A 16 36.880 26.761 10.243 1.00 29.11 C ATOM 234 CD1 LEU A 16 37.222 25.957 8.972 1.00 29.81 C ATOM 235 CD2 LEU A 16 36.099 25.878 11.234 1.00 25.98 C ATOM 0 H LEU A 16 40.617 27.531 11.104 1.00 31.52 H new ATOM 0 HA LEU A 16 38.800 27.914 8.984 1.00 30.64 H new ATOM 0 HB2 LEU A 16 38.800 26.414 11.176 1.00 29.49 H new ATOM 0 HB3 LEU A 16 37.907 27.754 11.866 1.00 29.49 H new ATOM 0 HG LEU A 16 36.271 27.615 9.948 1.00 29.11 H new ATOM 0 HD11 LEU A 16 36.302 25.612 8.501 1.00 29.81 H new ATOM 0 HD12 LEU A 16 37.769 26.592 8.276 1.00 29.81 H new ATOM 0 HD13 LEU A 16 37.837 25.098 9.239 1.00 29.81 H new ATOM 0 HD21 LEU A 16 35.187 25.517 10.759 1.00 25.98 H new ATOM 0 HD22 LEU A 16 36.716 25.029 11.529 1.00 25.98 H new ATOM 0 HD23 LEU A 16 35.841 26.463 12.117 1.00 25.98 H new ATOM 247 N LEU A 17 38.781 30.296 11.241 1.00 27.96 N ATOM 248 CA LEU A 17 38.373 31.702 11.489 1.00 28.93 C ATOM 249 C LEU A 17 38.866 32.545 10.306 1.00 30.06 C ATOM 250 O LEU A 17 38.235 33.498 9.894 1.00 30.41 O ATOM 251 CB LEU A 17 39.049 32.184 12.788 1.00 24.89 C ATOM 252 CG LEU A 17 38.255 33.342 13.430 1.00 25.03 C ATOM 253 CD1 LEU A 17 37.114 32.777 14.301 1.00 21.31 C ATOM 254 CD2 LEU A 17 39.186 34.217 14.311 1.00 20.22 C ATOM 0 H LEU A 17 39.382 29.893 11.960 1.00 27.96 H new ATOM 0 HA LEU A 17 37.291 31.791 11.589 1.00 28.93 H new ATOM 0 HB2 LEU A 17 39.123 31.355 13.492 1.00 24.89 H new ATOM 0 HB3 LEU A 17 40.066 32.512 12.573 1.00 24.89 H new ATOM 0 HG LEU A 17 37.838 33.957 12.632 1.00 25.03 H new ATOM 0 HD11 LEU A 17 36.558 33.600 14.751 1.00 21.31 H new ATOM 0 HD12 LEU A 17 36.443 32.182 13.681 1.00 21.31 H new ATOM 0 HD13 LEU A 17 37.533 32.150 15.088 1.00 21.31 H new ATOM 0 HD21 LEU A 17 38.609 35.028 14.755 1.00 20.22 H new ATOM 0 HD22 LEU A 17 39.620 33.605 15.102 1.00 20.22 H new ATOM 0 HD23 LEU A 17 39.983 34.633 13.696 1.00 20.22 H new ATOM 266 N GLU A 18 40.004 32.184 9.762 1.00 32.20 N ATOM 267 CA GLU A 18 40.572 32.937 8.608 1.00 35.35 C ATOM 268 C GLU A 18 39.921 32.428 7.312 1.00 35.74 C ATOM 269 O GLU A 18 39.523 33.198 6.461 1.00 35.74 O ATOM 270 CB GLU A 18 42.119 32.748 8.604 1.00 37.07 C ATOM 271 CG GLU A 18 42.603 31.812 7.478 1.00 39.76 C ATOM 272 CD GLU A 18 44.119 31.636 7.584 1.00 41.67 C ATOM 273 OE1 GLU A 18 44.703 32.233 8.474 1.00 43.25 O ATOM 274 OE2 GLU A 18 44.669 30.909 6.775 1.00 43.93 O ATOM 0 H GLU A 18 40.566 31.392 10.074 1.00 32.20 H new ATOM 0 HA GLU A 18 40.363 34.004 8.688 1.00 35.35 H new ATOM 0 HB2 GLU A 18 42.599 33.720 8.494 1.00 37.07 H new ATOM 0 HB3 GLU A 18 42.434 32.344 9.566 1.00 37.07 H new ATOM 0 HG2 GLU A 18 42.107 30.845 7.555 1.00 39.76 H new ATOM 0 HG3 GLU A 18 42.341 32.228 6.505 1.00 39.76 H new ATOM 281 N LYS A 19 39.806 31.136 7.162 1.00 37.19 N ATOM 282 CA LYS A 19 39.179 30.580 5.933 1.00 36.85 C ATOM 283 C LYS A 19 37.845 31.290 5.686 1.00 36.69 C ATOM 284 O LYS A 19 37.449 31.521 4.561 1.00 36.88 O ATOM 285 CB LYS A 19 38.954 29.087 6.118 1.00 36.86 C ATOM 286 CG LYS A 19 38.853 28.424 4.746 1.00 40.15 C ATOM 287 CD LYS A 19 38.366 27.010 4.940 1.00 41.50 C ATOM 288 CE LYS A 19 38.393 26.260 3.610 1.00 44.93 C ATOM 289 NZ LYS A 19 37.379 26.847 2.688 1.00 44.88 N ATOM 0 H LYS A 19 40.120 30.442 7.840 1.00 37.19 H new ATOM 0 HA LYS A 19 39.832 30.737 5.074 1.00 36.85 H new ATOM 0 HB2 LYS A 19 39.775 28.651 6.687 1.00 36.86 H new ATOM 0 HB3 LYS A 19 38.042 28.912 6.689 1.00 36.86 H new ATOM 0 HG2 LYS A 19 38.166 28.978 4.106 1.00 40.15 H new ATOM 0 HG3 LYS A 19 39.824 28.427 4.250 1.00 40.15 H new ATOM 0 HD2 LYS A 19 38.994 26.497 5.669 1.00 41.50 H new ATOM 0 HD3 LYS A 19 37.353 27.018 5.342 1.00 41.50 H new ATOM 0 HE2 LYS A 19 39.386 26.324 3.164 1.00 44.93 H new ATOM 0 HE3 LYS A 19 38.184 25.203 3.772 1.00 44.93 H new ATOM 0 HZ1 LYS A 19 37.251 26.220 1.868 1.00 44.88 H new ATOM 0 HZ2 LYS A 19 36.473 26.951 3.189 1.00 44.88 H new ATOM 0 HZ3 LYS A 19 37.704 27.780 2.363 1.00 44.88 H new ATOM 303 N PHE A 20 37.156 31.637 6.743 1.00 34.99 N ATOM 304 CA PHE A 20 35.848 32.336 6.617 1.00 34.93 C ATOM 305 C PHE A 20 36.017 33.789 7.068 1.00 34.32 C ATOM 306 O PHE A 20 35.084 34.567 7.056 1.00 35.01 O ATOM 307 CB PHE A 20 34.845 31.635 7.527 1.00 34.20 C ATOM 308 CG PHE A 20 34.411 30.337 6.894 1.00 33.79 C ATOM 309 CD1 PHE A 20 35.157 29.175 7.114 1.00 32.30 C ATOM 310 CD2 PHE A 20 33.276 30.299 6.078 1.00 34.75 C ATOM 311 CE1 PHE A 20 34.768 27.972 6.518 1.00 34.86 C ATOM 312 CE2 PHE A 20 32.888 29.098 5.478 1.00 35.66 C ATOM 313 CZ PHE A 20 33.635 27.933 5.698 1.00 35.69 C ATOM 0 H PHE A 20 37.453 31.461 7.703 1.00 34.99 H new ATOM 0 HA PHE A 20 35.498 32.315 5.585 1.00 34.93 H new ATOM 0 HB2 PHE A 20 35.294 31.444 8.502 1.00 34.20 H new ATOM 0 HB3 PHE A 20 33.980 32.277 7.695 1.00 34.20 H new ATOM 0 HD1 PHE A 20 36.033 29.207 7.744 1.00 32.30 H new ATOM 0 HD2 PHE A 20 32.700 31.197 5.912 1.00 34.75 H new ATOM 0 HE1 PHE A 20 35.342 27.073 6.690 1.00 34.86 H new ATOM 0 HE2 PHE A 20 32.013 29.068 4.845 1.00 35.66 H new ATOM 0 HZ PHE A 20 33.336 27.005 5.234 1.00 35.69 H new ATOM 323 N ARG A 21 37.206 34.153 7.468 1.00 34.35 N ATOM 324 CA ARG A 21 37.458 35.550 7.923 1.00 34.08 C ATOM 325 C ARG A 21 36.487 35.923 9.046 1.00 33.06 C ATOM 326 O ARG A 21 36.063 37.057 9.152 1.00 31.60 O ATOM 327 CB ARG A 21 37.268 36.519 6.750 1.00 37.64 C ATOM 328 CG ARG A 21 38.170 36.101 5.577 1.00 41.19 C ATOM 329 CD ARG A 21 39.660 36.376 5.898 1.00 45.12 C ATOM 330 NE ARG A 21 40.317 37.060 4.736 1.00 48.87 N ATOM 331 CZ ARG A 21 40.157 36.627 3.512 1.00 50.17 C ATOM 332 NH1 ARG A 21 39.491 35.529 3.282 1.00 52.38 N ATOM 333 NH2 ARG A 21 40.689 37.283 2.517 1.00 50.69 N ATOM 0 H ARG A 21 38.019 33.538 7.499 1.00 34.35 H new ATOM 0 HA ARG A 21 38.481 35.618 8.294 1.00 34.08 H new ATOM 0 HB2 ARG A 21 36.225 36.523 6.435 1.00 37.64 H new ATOM 0 HB3 ARG A 21 37.510 37.535 7.063 1.00 37.64 H new ATOM 0 HG2 ARG A 21 38.029 35.041 5.365 1.00 41.19 H new ATOM 0 HG3 ARG A 21 37.881 36.647 4.679 1.00 41.19 H new ATOM 0 HD2 ARG A 21 39.740 36.998 6.789 1.00 45.12 H new ATOM 0 HD3 ARG A 21 40.172 35.439 6.116 1.00 45.12 H new ATOM 0 HE ARG A 21 40.901 37.880 4.904 1.00 48.87 H new ATOM 0 HH11 ARG A 21 39.091 35.003 4.059 1.00 52.38 H new ATOM 0 HH12 ARG A 21 39.370 35.197 2.325 1.00 52.38 H new ATOM 0 HH21 ARG A 21 41.228 38.131 2.695 1.00 50.69 H new ATOM 0 HH22 ARG A 21 40.566 36.948 1.561 1.00 50.69 H new ATOM 347 N TYR A 22 36.127 34.992 9.890 1.00 30.22 N ATOM 348 CA TYR A 22 35.187 35.330 10.992 1.00 29.11 C ATOM 349 C TYR A 22 35.912 36.243 12.013 1.00 27.15 C ATOM 350 O TYR A 22 37.111 36.132 12.168 1.00 25.96 O ATOM 351 CB TYR A 22 34.758 34.038 11.704 1.00 27.09 C ATOM 352 CG TYR A 22 33.650 33.323 10.938 1.00 27.40 C ATOM 353 CD1 TYR A 22 32.433 33.970 10.652 1.00 26.95 C ATOM 354 CD2 TYR A 22 33.844 32.000 10.513 1.00 25.13 C ATOM 355 CE1 TYR A 22 31.429 33.296 9.946 1.00 26.07 C ATOM 356 CE2 TYR A 22 32.836 31.330 9.810 1.00 24.89 C ATOM 357 CZ TYR A 22 31.630 31.978 9.526 1.00 24.53 C ATOM 358 OH TYR A 22 30.638 31.317 8.830 1.00 21.93 O ATOM 0 H TYR A 22 36.441 34.022 9.863 1.00 30.22 H new ATOM 0 HA TYR A 22 34.313 35.840 10.586 1.00 29.11 H new ATOM 0 HB2 TYR A 22 35.617 33.375 11.808 1.00 27.09 H new ATOM 0 HB3 TYR A 22 34.413 34.273 12.711 1.00 27.09 H new ATOM 0 HD1 TYR A 22 32.273 34.987 10.977 1.00 26.95 H new ATOM 0 HD2 TYR A 22 34.775 31.497 10.729 1.00 25.13 H new ATOM 0 HE1 TYR A 22 30.497 33.796 9.725 1.00 26.07 H new ATOM 0 HE2 TYR A 22 32.990 30.311 9.487 1.00 24.89 H new ATOM 0 HH TYR A 22 29.866 31.910 8.718 1.00 21.93 H new ATOM 368 N PRO A 23 35.177 37.097 12.708 1.00 25.95 N ATOM 369 CA PRO A 23 35.780 37.976 13.731 1.00 26.49 C ATOM 370 C PRO A 23 36.536 37.129 14.770 1.00 26.35 C ATOM 371 O PRO A 23 36.511 35.917 14.733 1.00 24.48 O ATOM 372 CB PRO A 23 34.585 38.717 14.380 1.00 27.06 C ATOM 373 CG PRO A 23 33.296 38.260 13.639 1.00 29.61 C ATOM 374 CD PRO A 23 33.720 37.265 12.535 1.00 27.83 C ATOM 0 HA PRO A 23 36.502 38.675 13.310 1.00 26.49 H new ATOM 0 HB2 PRO A 23 34.520 38.483 15.443 1.00 27.06 H new ATOM 0 HB3 PRO A 23 34.712 39.796 14.298 1.00 27.06 H new ATOM 0 HG2 PRO A 23 32.602 37.788 14.334 1.00 29.61 H new ATOM 0 HG3 PRO A 23 32.780 39.116 13.205 1.00 29.61 H new ATOM 0 HD2 PRO A 23 33.198 36.314 12.640 1.00 27.83 H new ATOM 0 HD3 PRO A 23 33.483 37.651 11.544 1.00 27.83 H new ATOM 382 N TRP A 24 37.200 37.767 15.694 1.00 23.75 N ATOM 383 CA TRP A 24 37.956 37.013 16.741 1.00 24.21 C ATOM 384 C TRP A 24 36.996 36.526 17.829 1.00 24.68 C ATOM 385 O TRP A 24 37.345 35.705 18.654 1.00 22.18 O ATOM 386 CB TRP A 24 39.017 37.925 17.365 1.00 24.39 C ATOM 387 CG TRP A 24 39.693 37.210 18.493 1.00 26.00 C ATOM 388 CD1 TRP A 24 39.639 37.586 19.792 1.00 27.56 C ATOM 389 CD2 TRP A 24 40.516 36.006 18.450 1.00 24.99 C ATOM 390 NE1 TRP A 24 40.374 36.691 20.548 1.00 24.44 N ATOM 391 CE2 TRP A 24 40.935 35.700 19.767 1.00 27.17 C ATOM 392 CE3 TRP A 24 40.937 35.158 17.408 1.00 27.07 C ATOM 393 CZ2 TRP A 24 41.740 34.593 20.040 1.00 26.88 C ATOM 394 CZ3 TRP A 24 41.748 34.044 17.680 1.00 28.86 C ATOM 395 CH2 TRP A 24 42.148 33.763 18.994 1.00 27.85 C ATOM 0 H TRP A 24 37.253 38.783 15.772 1.00 23.75 H new ATOM 0 HA TRP A 24 38.441 36.152 16.280 1.00 24.21 H new ATOM 0 HB2 TRP A 24 39.751 38.214 16.613 1.00 24.39 H new ATOM 0 HB3 TRP A 24 38.554 38.843 17.728 1.00 24.39 H new ATOM 0 HD1 TRP A 24 39.108 38.445 20.176 1.00 27.56 H new ATOM 0 HE1 TRP A 24 40.488 36.755 21.560 1.00 24.44 H new ATOM 0 HE3 TRP A 24 40.634 35.366 16.392 1.00 27.07 H new ATOM 0 HZ2 TRP A 24 42.045 34.380 21.054 1.00 26.88 H new ATOM 0 HZ3 TRP A 24 42.065 33.400 16.873 1.00 28.86 H new ATOM 0 HH2 TRP A 24 42.771 32.905 19.197 1.00 27.85 H new ATOM 406 N GLU A 25 35.799 37.039 17.855 1.00 21.18 N ATOM 407 CA GLU A 25 34.830 36.622 18.908 1.00 25.10 C ATOM 408 C GLU A 25 34.160 35.284 18.552 1.00 23.53 C ATOM 409 O GLU A 25 33.514 34.682 19.384 1.00 22.15 O ATOM 410 CB GLU A 25 33.775 37.720 19.088 1.00 30.80 C ATOM 411 CG GLU A 25 32.917 37.876 17.806 1.00 38.77 C ATOM 412 CD GLU A 25 32.918 39.335 17.328 1.00 43.31 C ATOM 413 OE1 GLU A 25 33.985 39.927 17.298 1.00 45.94 O ATOM 414 OE2 GLU A 25 31.853 39.832 17.002 1.00 46.36 O ATOM 0 H GLU A 25 35.448 37.730 17.192 1.00 21.18 H new ATOM 0 HA GLU A 25 35.370 36.478 19.844 1.00 25.10 H new ATOM 0 HB2 GLU A 25 33.132 37.477 19.934 1.00 30.80 H new ATOM 0 HB3 GLU A 25 34.264 38.666 19.321 1.00 30.80 H new ATOM 0 HG2 GLU A 25 33.308 37.230 17.020 1.00 38.77 H new ATOM 0 HG3 GLU A 25 31.895 37.554 18.005 1.00 38.77 H new ATOM 421 N LEU A 26 34.294 34.809 17.332 1.00 21.26 N ATOM 422 CA LEU A 26 33.645 33.503 16.959 1.00 20.65 C ATOM 423 C LEU A 26 34.620 32.345 17.114 1.00 20.00 C ATOM 424 O LEU A 26 34.436 31.293 16.536 1.00 16.59 O ATOM 425 CB LEU A 26 33.158 33.550 15.516 1.00 23.25 C ATOM 426 CG LEU A 26 32.360 34.834 15.267 1.00 26.24 C ATOM 427 CD1 LEU A 26 31.586 34.694 13.960 1.00 29.07 C ATOM 428 CD2 LEU A 26 31.366 35.081 16.409 1.00 26.56 C ATOM 0 H LEU A 26 34.819 35.263 16.584 1.00 21.26 H new ATOM 0 HA LEU A 26 32.800 33.349 17.630 1.00 20.65 H new ATOM 0 HB2 LEU A 26 34.009 33.505 14.836 1.00 23.25 H new ATOM 0 HB3 LEU A 26 32.536 32.680 15.306 1.00 23.25 H new ATOM 0 HG LEU A 26 33.053 35.674 15.212 1.00 26.24 H new ATOM 0 HD11 LEU A 26 31.015 35.604 13.776 1.00 29.07 H new ATOM 0 HD12 LEU A 26 32.284 34.531 13.139 1.00 29.07 H new ATOM 0 HD13 LEU A 26 30.904 33.846 14.030 1.00 29.07 H new ATOM 0 HD21 LEU A 26 30.809 35.997 16.214 1.00 26.56 H new ATOM 0 HD22 LEU A 26 30.673 34.242 16.476 1.00 26.56 H new ATOM 0 HD23 LEU A 26 31.909 35.179 17.349 1.00 26.56 H new ATOM 440 N MET A 27 35.630 32.498 17.918 1.00 18.56 N ATOM 441 CA MET A 27 36.554 31.363 18.116 1.00 17.95 C ATOM 442 C MET A 27 35.801 30.214 18.821 1.00 17.26 C ATOM 443 O MET A 27 36.017 29.069 18.475 1.00 15.06 O ATOM 444 CB MET A 27 37.785 31.789 18.932 1.00 20.02 C ATOM 445 CG MET A 27 38.775 32.516 18.025 1.00 18.07 C ATOM 446 SD MET A 27 39.620 31.326 16.949 1.00 11.26 S ATOM 447 CE MET A 27 40.537 30.435 18.232 1.00 20.89 C ATOM 0 H MET A 27 35.851 33.347 18.438 1.00 18.56 H new ATOM 0 HA MET A 27 36.910 31.020 17.145 1.00 17.95 H new ATOM 0 HB2 MET A 27 37.482 32.440 19.752 1.00 20.02 H new ATOM 0 HB3 MET A 27 38.259 30.914 19.377 1.00 20.02 H new ATOM 0 HG2 MET A 27 38.251 33.257 17.421 1.00 18.07 H new ATOM 0 HG3 MET A 27 39.505 33.055 18.628 1.00 18.07 H new ATOM 0 HE1 MET A 27 41.486 30.085 17.825 1.00 20.89 H new ATOM 0 HE2 MET A 27 40.727 31.102 19.073 1.00 20.89 H new ATOM 0 HE3 MET A 27 39.951 29.581 18.571 1.00 20.89 H new ATOM 457 N PRO A 28 34.917 30.514 19.774 1.00 16.29 N ATOM 458 CA PRO A 28 34.158 29.448 20.453 1.00 17.09 C ATOM 459 C PRO A 28 33.361 28.666 19.402 1.00 15.81 C ATOM 460 O PRO A 28 33.353 27.460 19.391 1.00 16.73 O ATOM 461 CB PRO A 28 33.241 30.193 21.457 1.00 16.95 C ATOM 462 CG PRO A 28 33.770 31.644 21.540 1.00 18.75 C ATOM 463 CD PRO A 28 34.599 31.881 20.266 1.00 16.75 C ATOM 0 HA PRO A 28 34.782 28.722 20.975 1.00 17.09 H new ATOM 0 HB2 PRO A 28 32.204 30.177 21.121 1.00 16.95 H new ATOM 0 HB3 PRO A 28 33.267 29.714 22.436 1.00 16.95 H new ATOM 0 HG2 PRO A 28 32.946 32.354 21.604 1.00 18.75 H new ATOM 0 HG3 PRO A 28 34.381 31.784 22.432 1.00 18.75 H new ATOM 0 HD2 PRO A 28 34.036 32.449 19.525 1.00 16.75 H new ATOM 0 HD3 PRO A 28 35.505 32.447 20.481 1.00 16.75 H new ATOM 471 N LEU A 29 32.713 29.342 18.501 1.00 15.35 N ATOM 472 CA LEU A 29 31.947 28.619 17.448 1.00 15.54 C ATOM 473 C LEU A 29 32.919 27.818 16.583 1.00 15.13 C ATOM 474 O LEU A 29 32.748 26.631 16.387 1.00 14.57 O ATOM 475 CB LEU A 29 31.179 29.637 16.603 1.00 15.26 C ATOM 476 CG LEU A 29 30.442 30.604 17.538 1.00 13.96 C ATOM 477 CD1 LEU A 29 29.555 31.537 16.710 1.00 15.02 C ATOM 478 CD2 LEU A 29 29.574 29.806 18.528 1.00 15.96 C ATOM 0 H LEU A 29 32.679 30.360 18.446 1.00 15.35 H new ATOM 0 HA LEU A 29 31.234 27.930 17.901 1.00 15.54 H new ATOM 0 HB2 LEU A 29 31.865 30.186 15.958 1.00 15.26 H new ATOM 0 HB3 LEU A 29 30.469 29.127 15.952 1.00 15.26 H new ATOM 0 HG LEU A 29 31.169 31.195 18.095 1.00 13.96 H new ATOM 0 HD11 LEU A 29 29.031 32.225 17.374 1.00 15.02 H new ATOM 0 HD12 LEU A 29 30.173 32.105 16.014 1.00 15.02 H new ATOM 0 HD13 LEU A 29 28.828 30.947 16.151 1.00 15.02 H new ATOM 0 HD21 LEU A 29 29.051 30.495 19.191 1.00 15.96 H new ATOM 0 HD22 LEU A 29 28.846 29.211 17.976 1.00 15.96 H new ATOM 0 HD23 LEU A 29 30.209 29.146 19.118 1.00 15.96 H new ATOM 490 N MET A 30 33.955 28.436 16.087 1.00 15.06 N ATOM 491 CA MET A 30 34.934 27.673 15.271 1.00 12.45 C ATOM 492 C MET A 30 35.436 26.501 16.119 1.00 12.90 C ATOM 493 O MET A 30 35.592 25.394 15.645 1.00 14.81 O ATOM 494 CB MET A 30 36.114 28.585 14.902 1.00 15.01 C ATOM 495 CG MET A 30 35.805 29.362 13.622 1.00 12.65 C ATOM 496 SD MET A 30 34.357 30.423 13.885 1.00 8.44 S ATOM 497 CE MET A 30 33.269 29.713 12.620 1.00 27.75 C ATOM 0 H MET A 30 34.163 29.427 16.211 1.00 15.06 H new ATOM 0 HA MET A 30 34.470 27.310 14.354 1.00 12.45 H new ATOM 0 HB2 MET A 30 36.314 29.280 15.718 1.00 15.01 H new ATOM 0 HB3 MET A 30 37.015 27.987 14.764 1.00 15.01 H new ATOM 0 HG2 MET A 30 36.665 29.968 13.336 1.00 12.65 H new ATOM 0 HG3 MET A 30 35.616 28.670 12.801 1.00 12.65 H new ATOM 0 HE1 MET A 30 32.494 30.434 12.360 1.00 27.75 H new ATOM 0 HE2 MET A 30 33.853 29.472 11.732 1.00 27.75 H new ATOM 0 HE3 MET A 30 32.805 28.805 13.007 1.00 27.75 H new ATOM 507 N TYR A 31 35.688 26.749 17.377 1.00 13.07 N ATOM 508 CA TYR A 31 36.179 25.662 18.270 1.00 15.35 C ATOM 509 C TYR A 31 35.185 24.490 18.248 1.00 16.32 C ATOM 510 O TYR A 31 35.560 23.351 18.058 1.00 15.86 O ATOM 511 CB TYR A 31 36.324 26.196 19.705 1.00 14.82 C ATOM 512 CG TYR A 31 36.552 25.045 20.655 1.00 17.46 C ATOM 513 CD1 TYR A 31 35.459 24.299 21.115 1.00 20.04 C ATOM 514 CD2 TYR A 31 37.849 24.718 21.071 1.00 19.91 C ATOM 515 CE1 TYR A 31 35.660 23.227 21.988 1.00 21.64 C ATOM 516 CE2 TYR A 31 38.048 23.644 21.944 1.00 22.38 C ATOM 517 CZ TYR A 31 36.955 22.898 22.403 1.00 23.93 C ATOM 518 OH TYR A 31 37.155 21.839 23.265 1.00 30.09 O ATOM 0 H TYR A 31 35.575 27.659 17.824 1.00 13.07 H new ATOM 0 HA TYR A 31 37.151 25.316 17.918 1.00 15.35 H new ATOM 0 HB2 TYR A 31 37.157 26.896 19.760 1.00 14.82 H new ATOM 0 HB3 TYR A 31 35.427 26.745 19.992 1.00 14.82 H new ATOM 0 HD1 TYR A 31 34.460 24.553 20.794 1.00 20.04 H new ATOM 0 HD2 TYR A 31 38.692 25.293 20.719 1.00 19.91 H new ATOM 0 HE1 TYR A 31 34.817 22.653 22.342 1.00 21.64 H new ATOM 0 HE2 TYR A 31 39.047 23.389 22.265 1.00 22.38 H new ATOM 0 HH TYR A 31 38.112 21.746 23.452 1.00 30.09 H new ATOM 528 N VAL A 32 33.925 24.758 18.459 1.00 16.31 N ATOM 529 CA VAL A 32 32.921 23.654 18.470 1.00 13.79 C ATOM 530 C VAL A 32 32.832 22.991 17.094 1.00 15.33 C ATOM 531 O VAL A 32 32.915 21.785 16.978 1.00 15.78 O ATOM 532 CB VAL A 32 31.548 24.211 18.852 1.00 15.68 C ATOM 533 CG1 VAL A 32 30.533 23.070 18.856 1.00 14.40 C ATOM 534 CG2 VAL A 32 31.614 24.833 20.251 1.00 13.96 C ATOM 0 H VAL A 32 33.547 25.691 18.624 1.00 16.31 H new ATOM 0 HA VAL A 32 33.235 22.909 19.201 1.00 13.79 H new ATOM 0 HB VAL A 32 31.250 24.973 18.132 1.00 15.68 H new ATOM 0 HG11 VAL A 32 29.551 23.458 19.127 1.00 14.40 H new ATOM 0 HG12 VAL A 32 30.485 22.622 17.863 1.00 14.40 H new ATOM 0 HG13 VAL A 32 30.838 22.315 19.580 1.00 14.40 H new ATOM 0 HG21 VAL A 32 30.635 25.229 20.520 1.00 13.96 H new ATOM 0 HG22 VAL A 32 31.909 24.072 20.974 1.00 13.96 H new ATOM 0 HG23 VAL A 32 32.346 25.641 20.256 1.00 13.96 H new ATOM 544 N ILE A 33 32.653 23.756 16.050 1.00 13.65 N ATOM 545 CA ILE A 33 32.550 23.152 14.691 1.00 13.17 C ATOM 546 C ILE A 33 33.654 22.098 14.501 1.00 15.24 C ATOM 547 O ILE A 33 33.385 20.940 14.250 1.00 15.62 O ATOM 548 CB ILE A 33 32.670 24.284 13.659 1.00 15.80 C ATOM 549 CG1 ILE A 33 31.340 25.065 13.645 1.00 14.63 C ATOM 550 CG2 ILE A 33 32.953 23.707 12.270 1.00 15.09 C ATOM 551 CD1 ILE A 33 31.468 26.388 12.873 1.00 15.66 C ATOM 0 H ILE A 33 32.574 24.772 16.080 1.00 13.65 H new ATOM 0 HA ILE A 33 31.593 22.647 14.562 1.00 13.17 H new ATOM 0 HB ILE A 33 33.494 24.946 13.926 1.00 15.80 H new ATOM 0 HG12 ILE A 33 30.562 24.452 13.190 1.00 14.63 H new ATOM 0 HG13 ILE A 33 31.027 25.269 14.669 1.00 14.63 H new ATOM 0 HG21 ILE A 33 33.036 24.520 11.548 1.00 15.09 H new ATOM 0 HG22 ILE A 33 33.887 23.145 12.293 1.00 15.09 H new ATOM 0 HG23 ILE A 33 32.138 23.044 11.978 1.00 15.09 H new ATOM 0 HD11 ILE A 33 30.511 26.910 12.885 1.00 15.66 H new ATOM 0 HD12 ILE A 33 32.228 27.012 13.344 1.00 15.66 H new ATOM 0 HD13 ILE A 33 31.756 26.181 11.842 1.00 15.66 H new ATOM 563 N LEU A 34 34.883 22.491 14.639 1.00 16.71 N ATOM 564 CA LEU A 34 36.022 21.529 14.494 1.00 19.71 C ATOM 565 C LEU A 34 35.782 20.318 15.421 1.00 20.61 C ATOM 566 O LEU A 34 35.899 19.180 15.011 1.00 22.08 O ATOM 567 CB LEU A 34 37.319 22.284 14.916 1.00 19.59 C ATOM 568 CG LEU A 34 38.302 22.711 13.744 1.00 26.84 C ATOM 569 CD1 LEU A 34 37.794 22.434 12.322 1.00 24.93 C ATOM 570 CD2 LEU A 34 38.598 24.218 13.849 1.00 27.25 C ATOM 0 H LEU A 34 35.159 23.450 14.849 1.00 16.71 H new ATOM 0 HA LEU A 34 36.111 21.167 13.470 1.00 19.71 H new ATOM 0 HB2 LEU A 34 37.029 23.181 15.462 1.00 19.59 H new ATOM 0 HB3 LEU A 34 37.871 21.652 15.611 1.00 19.59 H new ATOM 0 HG LEU A 34 39.188 22.092 13.884 1.00 26.84 H new ATOM 0 HD11 LEU A 34 38.540 22.763 11.599 1.00 24.93 H new ATOM 0 HD12 LEU A 34 37.617 21.365 12.201 1.00 24.93 H new ATOM 0 HD13 LEU A 34 36.864 22.977 12.156 1.00 24.93 H new ATOM 0 HD21 LEU A 34 39.273 24.513 13.045 1.00 27.25 H new ATOM 0 HD22 LEU A 34 37.667 24.778 13.765 1.00 27.25 H new ATOM 0 HD23 LEU A 34 39.064 24.431 14.811 1.00 27.25 H new ATOM 582 N LYS A 35 35.466 20.558 16.663 1.00 19.14 N ATOM 583 CA LYS A 35 35.236 19.430 17.623 1.00 20.97 C ATOM 584 C LYS A 35 34.372 18.352 16.979 1.00 22.25 C ATOM 585 O LYS A 35 34.509 17.178 17.262 1.00 22.80 O ATOM 586 CB LYS A 35 34.523 19.964 18.872 1.00 22.98 C ATOM 587 CG LYS A 35 34.536 18.892 19.963 1.00 26.83 C ATOM 588 CD LYS A 35 33.962 19.471 21.258 1.00 29.91 C ATOM 589 CE LYS A 35 33.905 18.376 22.324 1.00 33.36 C ATOM 590 NZ LYS A 35 33.562 18.982 23.642 1.00 35.88 N ATOM 0 H LYS A 35 35.355 21.491 17.061 1.00 19.14 H new ATOM 0 HA LYS A 35 36.199 18.999 17.896 1.00 20.97 H new ATOM 0 HB2 LYS A 35 35.018 20.867 19.229 1.00 22.98 H new ATOM 0 HB3 LYS A 35 33.497 20.238 18.629 1.00 22.98 H new ATOM 0 HG2 LYS A 35 33.949 18.030 19.647 1.00 26.83 H new ATOM 0 HG3 LYS A 35 35.554 18.541 20.130 1.00 26.83 H new ATOM 0 HD2 LYS A 35 34.581 20.299 21.604 1.00 29.91 H new ATOM 0 HD3 LYS A 35 32.964 19.872 21.079 1.00 29.91 H new ATOM 0 HE2 LYS A 35 33.161 17.627 22.052 1.00 33.36 H new ATOM 0 HE3 LYS A 35 34.865 17.864 22.386 1.00 33.36 H new ATOM 0 HZ1 LYS A 35 33.523 18.237 24.367 1.00 35.88 H new ATOM 0 HZ2 LYS A 35 34.287 19.681 23.902 1.00 35.88 H new ATOM 0 HZ3 LYS A 35 32.636 19.451 23.578 1.00 35.88 H new ATOM 604 N ASP A 36 33.473 18.740 16.132 1.00 20.87 N ATOM 605 CA ASP A 36 32.577 17.750 15.480 1.00 18.89 C ATOM 606 C ASP A 36 33.225 17.195 14.211 1.00 17.97 C ATOM 607 O ASP A 36 33.157 16.016 13.927 1.00 19.23 O ATOM 608 CB ASP A 36 31.281 18.461 15.129 1.00 16.73 C ATOM 609 CG ASP A 36 30.856 19.324 16.320 1.00 19.06 C ATOM 610 OD1 ASP A 36 30.668 18.769 17.390 1.00 17.75 O ATOM 611 OD2 ASP A 36 30.728 20.524 16.141 1.00 14.84 O ATOM 0 H ASP A 36 33.316 19.710 15.858 1.00 20.87 H new ATOM 0 HA ASP A 36 32.389 16.914 16.154 1.00 18.89 H new ATOM 0 HB2 ASP A 36 31.418 19.081 14.243 1.00 16.73 H new ATOM 0 HB3 ASP A 36 30.504 17.735 14.892 1.00 16.73 H new ATOM 616 N ALA A 37 33.834 18.044 13.442 1.00 19.53 N ATOM 617 CA ALA A 37 34.474 17.597 12.174 1.00 20.29 C ATOM 618 C ALA A 37 35.831 16.961 12.457 1.00 23.93 C ATOM 619 O ALA A 37 36.765 17.119 11.695 1.00 23.82 O ATOM 620 CB ALA A 37 34.665 18.821 11.290 1.00 19.16 C ATOM 0 H ALA A 37 33.919 19.042 13.637 1.00 19.53 H new ATOM 0 HA ALA A 37 33.843 16.856 11.682 1.00 20.29 H new ATOM 0 HB1 ALA A 37 35.133 18.523 10.352 1.00 19.16 H new ATOM 0 HB2 ALA A 37 33.696 19.276 11.084 1.00 19.16 H new ATOM 0 HB3 ALA A 37 35.303 19.543 11.800 1.00 19.16 H new ATOM 626 N ASP A 38 35.966 16.257 13.538 1.00 25.04 N ATOM 627 CA ASP A 38 37.284 15.644 13.835 1.00 29.02 C ATOM 628 C ASP A 38 38.340 16.751 13.813 1.00 30.09 C ATOM 629 O ASP A 38 39.528 16.500 13.790 1.00 29.56 O ATOM 630 CB ASP A 38 37.602 14.588 12.767 1.00 31.78 C ATOM 631 CG ASP A 38 38.616 13.580 13.315 1.00 34.21 C ATOM 632 OD1 ASP A 38 39.570 14.011 13.942 1.00 37.98 O ATOM 633 OD2 ASP A 38 38.421 12.395 13.098 1.00 39.08 O ATOM 0 H ASP A 38 35.231 16.080 14.223 1.00 25.04 H new ATOM 0 HA ASP A 38 37.274 15.162 14.813 1.00 29.02 H new ATOM 0 HB2 ASP A 38 36.689 14.073 12.470 1.00 31.78 H new ATOM 0 HB3 ASP A 38 38.001 15.070 11.875 1.00 31.78 H new ATOM 638 N ALA A 39 37.891 17.978 13.813 1.00 30.33 N ATOM 639 CA ALA A 39 38.818 19.137 13.787 1.00 32.12 C ATOM 640 C ALA A 39 39.448 19.274 12.396 1.00 33.86 C ATOM 641 O ALA A 39 40.329 20.083 12.186 1.00 34.96 O ATOM 642 CB ALA A 39 39.902 18.951 14.851 1.00 32.67 C ATOM 0 H ALA A 39 36.902 18.226 13.830 1.00 30.33 H new ATOM 0 HA ALA A 39 38.263 20.049 14.005 1.00 32.12 H new ATOM 0 HB1 ALA A 39 40.582 19.803 14.831 1.00 32.67 H new ATOM 0 HB2 ALA A 39 39.438 18.881 15.835 1.00 32.67 H new ATOM 0 HB3 ALA A 39 40.459 18.037 14.647 1.00 32.67 H new ATOM 648 N ASN A 40 38.994 18.506 11.438 1.00 33.92 N ATOM 649 CA ASN A 40 39.568 18.625 10.065 1.00 34.20 C ATOM 650 C ASN A 40 38.881 19.801 9.362 1.00 34.98 C ATOM 651 O ASN A 40 37.743 19.707 8.948 1.00 32.10 O ATOM 652 CB ASN A 40 39.332 17.309 9.277 1.00 33.87 C ATOM 653 CG ASN A 40 40.635 16.831 8.620 1.00 32.69 C ATOM 654 OD1 ASN A 40 41.336 16.002 9.166 1.00 34.27 O ATOM 655 ND2 ASN A 40 40.988 17.324 7.464 1.00 33.64 N ATOM 0 H ASN A 40 38.258 17.808 11.546 1.00 33.92 H new ATOM 0 HA ASN A 40 40.643 18.800 10.116 1.00 34.20 H new ATOM 0 HB2 ASN A 40 38.954 16.539 9.949 1.00 33.87 H new ATOM 0 HB3 ASN A 40 38.570 17.468 8.514 1.00 33.87 H new ATOM 0 HD21 ASN A 40 41.852 17.013 7.019 1.00 33.64 H new ATOM 0 HD22 ASN A 40 40.400 18.020 7.005 1.00 33.64 H new ATOM 662 N ILE A 41 39.564 20.906 9.235 1.00 35.49 N ATOM 663 CA ILE A 41 38.959 22.096 8.570 1.00 37.55 C ATOM 664 C ILE A 41 38.234 21.659 7.299 1.00 36.60 C ATOM 665 O ILE A 41 37.115 22.053 7.046 1.00 34.64 O ATOM 666 CB ILE A 41 40.075 23.092 8.232 1.00 39.67 C ATOM 667 CG1 ILE A 41 40.564 23.708 9.558 1.00 42.22 C ATOM 668 CG2 ILE A 41 39.569 24.187 7.241 1.00 40.78 C ATOM 669 CD1 ILE A 41 41.644 24.764 9.307 1.00 44.19 C ATOM 0 H ILE A 41 40.520 21.037 9.565 1.00 35.49 H new ATOM 0 HA ILE A 41 38.238 22.572 9.234 1.00 37.55 H new ATOM 0 HB ILE A 41 40.900 22.585 7.732 1.00 39.67 H new ATOM 0 HG12 ILE A 41 39.724 24.160 10.085 1.00 42.22 H new ATOM 0 HG13 ILE A 41 40.960 22.924 10.203 1.00 42.22 H new ATOM 0 HG21 ILE A 41 40.381 24.880 7.019 1.00 40.78 H new ATOM 0 HG22 ILE A 41 39.232 23.715 6.318 1.00 40.78 H new ATOM 0 HG23 ILE A 41 38.741 24.732 7.693 1.00 40.78 H new ATOM 0 HD11 ILE A 41 41.972 25.183 10.259 1.00 44.19 H new ATOM 0 HD12 ILE A 41 42.493 24.303 8.802 1.00 44.19 H new ATOM 0 HD13 ILE A 41 41.237 25.559 8.682 1.00 44.19 H new ATOM 681 N GLU A 42 38.855 20.847 6.502 1.00 37.01 N ATOM 682 CA GLU A 42 38.186 20.391 5.261 1.00 36.07 C ATOM 683 C GLU A 42 36.846 19.753 5.627 1.00 33.02 C ATOM 684 O GLU A 42 35.832 20.015 5.012 1.00 31.66 O ATOM 685 CB GLU A 42 39.071 19.358 4.562 1.00 40.46 C ATOM 686 CG GLU A 42 40.401 20.008 4.176 1.00 45.44 C ATOM 687 CD GLU A 42 41.255 19.004 3.400 1.00 49.08 C ATOM 688 OE1 GLU A 42 40.707 18.323 2.549 1.00 51.71 O ATOM 689 OE2 GLU A 42 42.442 18.932 3.671 1.00 50.84 O ATOM 0 H GLU A 42 39.794 20.480 6.654 1.00 37.01 H new ATOM 0 HA GLU A 42 38.021 21.237 4.593 1.00 36.07 H new ATOM 0 HB2 GLU A 42 39.247 18.508 5.221 1.00 40.46 H new ATOM 0 HB3 GLU A 42 38.569 18.974 3.674 1.00 40.46 H new ATOM 0 HG2 GLU A 42 40.221 20.895 3.568 1.00 45.44 H new ATOM 0 HG3 GLU A 42 40.930 20.337 5.070 1.00 45.44 H new ATOM 696 N GLU A 43 36.838 18.921 6.629 1.00 29.75 N ATOM 697 CA GLU A 43 35.569 18.265 7.047 1.00 27.99 C ATOM 698 C GLU A 43 34.687 19.284 7.769 1.00 25.26 C ATOM 699 O GLU A 43 33.478 19.199 7.733 1.00 22.77 O ATOM 700 CB GLU A 43 35.882 17.103 7.995 1.00 30.94 C ATOM 701 CG GLU A 43 34.599 16.326 8.312 1.00 33.24 C ATOM 702 CD GLU A 43 34.898 15.258 9.365 1.00 37.98 C ATOM 703 OE1 GLU A 43 35.953 15.333 9.974 1.00 43.17 O ATOM 704 OE2 GLU A 43 34.067 14.383 9.545 1.00 38.40 O ATOM 0 H GLU A 43 37.659 18.666 7.179 1.00 29.75 H new ATOM 0 HA GLU A 43 35.048 17.886 6.168 1.00 27.99 H new ATOM 0 HB2 GLU A 43 36.616 16.439 7.539 1.00 30.94 H new ATOM 0 HB3 GLU A 43 36.324 17.483 8.916 1.00 30.94 H new ATOM 0 HG2 GLU A 43 33.830 17.006 8.677 1.00 33.24 H new ATOM 0 HG3 GLU A 43 34.210 15.861 7.407 1.00 33.24 H new ATOM 711 N ALA A 44 35.281 20.241 8.435 1.00 22.98 N ATOM 712 CA ALA A 44 34.471 21.259 9.168 1.00 23.88 C ATOM 713 C ALA A 44 33.988 22.334 8.189 1.00 22.87 C ATOM 714 O ALA A 44 32.846 22.747 8.220 1.00 22.85 O ATOM 715 CB ALA A 44 35.326 21.880 10.295 1.00 22.28 C ATOM 0 H ALA A 44 36.292 20.361 8.503 1.00 22.98 H new ATOM 0 HA ALA A 44 33.597 20.787 9.616 1.00 23.88 H new ATOM 0 HB1 ALA A 44 34.736 22.624 10.831 1.00 22.28 H new ATOM 0 HB2 ALA A 44 35.640 21.098 10.987 1.00 22.28 H new ATOM 0 HB3 ALA A 44 36.206 22.357 9.863 1.00 22.28 H new ATOM 721 N SER A 45 34.844 22.785 7.323 1.00 25.55 N ATOM 722 CA SER A 45 34.431 23.826 6.345 1.00 26.34 C ATOM 723 C SER A 45 33.240 23.312 5.535 1.00 26.21 C ATOM 724 O SER A 45 32.269 24.013 5.324 1.00 23.95 O ATOM 725 CB SER A 45 35.598 24.122 5.406 1.00 29.82 C ATOM 726 OG SER A 45 35.602 23.173 4.348 1.00 33.07 O ATOM 0 H SER A 45 35.814 22.479 7.248 1.00 25.55 H new ATOM 0 HA SER A 45 34.146 24.737 6.872 1.00 26.34 H new ATOM 0 HB2 SER A 45 35.509 25.131 5.004 1.00 29.82 H new ATOM 0 HB3 SER A 45 36.540 24.078 5.953 1.00 29.82 H new ATOM 0 HG SER A 45 35.919 22.309 4.685 1.00 33.07 H new ATOM 732 N ARG A 46 33.308 22.091 5.081 1.00 26.25 N ATOM 733 CA ARG A 46 32.184 21.524 4.284 1.00 26.19 C ATOM 734 C ARG A 46 30.861 21.764 5.017 1.00 24.78 C ATOM 735 O ARG A 46 29.830 21.963 4.405 1.00 20.51 O ATOM 736 CB ARG A 46 32.405 20.019 4.092 1.00 30.93 C ATOM 737 CG ARG A 46 33.461 19.790 3.007 1.00 37.66 C ATOM 738 CD ARG A 46 33.841 18.308 2.963 1.00 43.41 C ATOM 739 NE ARG A 46 32.605 17.478 2.906 1.00 47.39 N ATOM 740 CZ ARG A 46 32.677 16.221 2.557 1.00 49.82 C ATOM 741 NH1 ARG A 46 33.832 15.692 2.256 1.00 51.10 N ATOM 742 NH2 ARG A 46 31.595 15.494 2.509 1.00 51.02 N ATOM 0 H ARG A 46 34.096 21.460 5.228 1.00 26.25 H new ATOM 0 HA ARG A 46 32.146 22.011 3.310 1.00 26.19 H new ATOM 0 HB2 ARG A 46 32.728 19.566 5.029 1.00 30.93 H new ATOM 0 HB3 ARG A 46 31.469 19.537 3.810 1.00 30.93 H new ATOM 0 HG2 ARG A 46 33.075 20.105 2.038 1.00 37.66 H new ATOM 0 HG3 ARG A 46 34.344 20.396 3.211 1.00 37.66 H new ATOM 0 HD2 ARG A 46 34.466 18.108 2.093 1.00 43.41 H new ATOM 0 HD3 ARG A 46 34.427 18.046 3.844 1.00 43.41 H new ATOM 0 HE ARG A 46 31.702 17.891 3.140 1.00 47.39 H new ATOM 0 HH11 ARG A 46 34.678 16.260 2.293 1.00 51.10 H new ATOM 0 HH12 ARG A 46 33.888 14.711 1.984 1.00 51.10 H new ATOM 0 HH21 ARG A 46 30.692 15.907 2.744 1.00 51.02 H new ATOM 0 HH22 ARG A 46 31.652 14.513 2.236 1.00 51.02 H new ATOM 756 N ARG A 47 30.879 21.755 6.322 1.00 20.40 N ATOM 757 CA ARG A 47 29.617 21.991 7.082 1.00 20.79 C ATOM 758 C ARG A 47 29.283 23.479 7.022 1.00 20.46 C ATOM 759 O ARG A 47 28.244 23.875 6.532 1.00 20.27 O ATOM 760 CB ARG A 47 29.798 21.545 8.541 1.00 18.12 C ATOM 761 CG ARG A 47 30.695 20.302 8.582 1.00 19.83 C ATOM 762 CD ARG A 47 30.757 19.713 10.005 1.00 24.63 C ATOM 763 NE ARG A 47 30.851 18.228 9.909 1.00 25.15 N ATOM 764 CZ ARG A 47 31.190 17.527 10.954 1.00 28.72 C ATOM 765 NH1 ARG A 47 31.426 18.124 12.086 1.00 25.84 N ATOM 766 NH2 ARG A 47 31.293 16.230 10.866 1.00 22.33 N ATOM 0 H ARG A 47 31.709 21.595 6.893 1.00 20.40 H new ATOM 0 HA ARG A 47 28.802 21.415 6.643 1.00 20.79 H new ATOM 0 HB2 ARG A 47 30.244 22.349 9.127 1.00 18.12 H new ATOM 0 HB3 ARG A 47 28.829 21.324 8.989 1.00 18.12 H new ATOM 0 HG2 ARG A 47 30.314 19.551 7.890 1.00 19.83 H new ATOM 0 HG3 ARG A 47 31.699 20.563 8.248 1.00 19.83 H new ATOM 0 HD2 ARG A 47 31.619 20.111 10.541 1.00 24.63 H new ATOM 0 HD3 ARG A 47 29.870 19.999 10.570 1.00 24.63 H new ATOM 0 HE ARG A 47 30.650 17.761 9.025 1.00 25.15 H new ATOM 0 HH11 ARG A 47 31.345 19.139 12.154 1.00 25.84 H new ATOM 0 HH12 ARG A 47 31.691 17.577 12.905 1.00 25.84 H new ATOM 0 HH21 ARG A 47 31.108 15.763 9.978 1.00 22.33 H new ATOM 0 HH22 ARG A 47 31.558 15.683 11.685 1.00 22.33 H new ATOM 780 N ILE A 48 30.174 24.307 7.494 1.00 19.14 N ATOM 781 CA ILE A 48 29.938 25.778 7.441 1.00 21.78 C ATOM 782 C ILE A 48 29.464 26.134 6.042 1.00 25.27 C ATOM 783 O ILE A 48 28.402 26.689 5.848 1.00 23.94 O ATOM 784 CB ILE A 48 31.251 26.493 7.737 1.00 20.97 C ATOM 785 CG1 ILE A 48 31.821 25.927 9.039 1.00 21.08 C ATOM 786 CG2 ILE A 48 30.990 27.995 7.877 1.00 21.08 C ATOM 787 CD1 ILE A 48 33.012 26.768 9.515 1.00 19.82 C ATOM 0 H ILE A 48 31.059 24.027 7.916 1.00 19.14 H new ATOM 0 HA ILE A 48 29.188 26.078 8.173 1.00 21.78 H new ATOM 0 HB ILE A 48 31.964 26.339 6.927 1.00 20.97 H new ATOM 0 HG12 ILE A 48 31.047 25.915 9.807 1.00 21.08 H new ATOM 0 HG13 ILE A 48 32.135 24.894 8.887 1.00 21.08 H new ATOM 0 HG21 ILE A 48 31.928 28.509 8.089 1.00 21.08 H new ATOM 0 HG22 ILE A 48 30.567 28.379 6.949 1.00 21.08 H new ATOM 0 HG23 ILE A 48 30.289 28.168 8.694 1.00 21.08 H new ATOM 0 HD11 ILE A 48 33.405 26.351 10.442 1.00 19.82 H new ATOM 0 HD12 ILE A 48 33.792 26.758 8.754 1.00 19.82 H new ATOM 0 HD13 ILE A 48 32.687 27.794 9.688 1.00 19.82 H new ATOM 799 N GLU A 49 30.244 25.785 5.066 1.00 26.87 N ATOM 800 CA GLU A 49 29.865 26.064 3.656 1.00 31.21 C ATOM 801 C GLU A 49 28.411 25.681 3.431 1.00 31.88 C ATOM 802 O GLU A 49 27.575 26.508 3.126 1.00 31.73 O ATOM 803 CB GLU A 49 30.705 25.179 2.754 1.00 32.85 C ATOM 804 CG GLU A 49 32.125 25.736 2.631 1.00 36.76 C ATOM 805 CD GLU A 49 32.860 25.023 1.493 1.00 40.40 C ATOM 806 OE1 GLU A 49 32.191 24.446 0.651 1.00 40.28 O ATOM 807 OE2 GLU A 49 34.079 25.066 1.484 1.00 43.41 O ATOM 0 H GLU A 49 31.140 25.312 5.184 1.00 26.87 H new ATOM 0 HA GLU A 49 30.018 27.122 3.443 1.00 31.21 H new ATOM 0 HB2 GLU A 49 30.738 24.167 3.156 1.00 32.85 H new ATOM 0 HB3 GLU A 49 30.246 25.115 1.767 1.00 32.85 H new ATOM 0 HG2 GLU A 49 32.090 26.808 2.439 1.00 36.76 H new ATOM 0 HG3 GLU A 49 32.663 25.597 3.568 1.00 36.76 H new ATOM 814 N GLU A 50 28.105 24.421 3.599 1.00 32.05 N ATOM 815 CA GLU A 50 26.704 23.972 3.416 1.00 30.33 C ATOM 816 C GLU A 50 25.852 24.898 4.253 1.00 29.99 C ATOM 817 O GLU A 50 24.836 25.369 3.835 1.00 26.76 O ATOM 818 CB GLU A 50 26.571 22.513 3.901 1.00 33.38 C ATOM 819 CG GLU A 50 25.438 21.799 3.153 1.00 33.45 C ATOM 820 CD GLU A 50 25.446 20.314 3.518 1.00 36.89 C ATOM 821 OE1 GLU A 50 26.175 19.951 4.427 1.00 35.55 O ATOM 822 OE2 GLU A 50 24.723 19.564 2.883 1.00 36.13 O ATOM 0 H GLU A 50 28.767 23.689 3.855 1.00 32.05 H new ATOM 0 HA GLU A 50 26.393 24.003 2.372 1.00 30.33 H new ATOM 0 HB2 GLU A 50 27.510 21.984 3.741 1.00 33.38 H new ATOM 0 HB3 GLU A 50 26.374 22.496 4.973 1.00 33.38 H new ATOM 0 HG2 GLU A 50 24.478 22.244 3.414 1.00 33.45 H new ATOM 0 HG3 GLU A 50 25.564 21.921 2.077 1.00 33.45 H new ATOM 829 N GLY A 51 26.325 25.193 5.418 1.00 0.00 N ATOM 830 CA GLY A 51 25.606 26.118 6.327 1.00 0.00 C ATOM 831 C GLY A 51 25.386 27.471 5.635 1.00 0.00 C ATOM 832 O GLY A 51 24.278 27.921 5.432 1.00 0.00 O ATOM 0 H GLY A 51 27.200 24.825 5.791 1.00 0.00 H new ATOM 0 HA2 GLY A 51 24.647 25.687 6.613 1.00 0.00 H new ATOM 0 HA3 GLY A 51 26.179 26.258 7.244 1.00 0.00 H new ATOM 836 N GLN A 52 26.454 28.134 5.283 1.00 29.60 N ATOM 837 CA GLN A 52 26.331 29.466 4.613 1.00 32.81 C ATOM 838 C GLN A 52 25.317 29.346 3.489 1.00 33.63 C ATOM 839 O GLN A 52 24.397 30.128 3.363 1.00 32.37 O ATOM 840 CB GLN A 52 27.683 29.870 4.014 1.00 32.81 C ATOM 841 CG GLN A 52 28.798 29.767 5.074 1.00 34.44 C ATOM 842 CD GLN A 52 28.969 31.099 5.807 1.00 35.84 C ATOM 843 OE1 GLN A 52 28.014 31.817 6.028 1.00 36.29 O ATOM 844 NE2 GLN A 52 30.162 31.455 6.196 1.00 38.34 N ATOM 0 H GLN A 52 27.411 27.812 5.430 1.00 29.60 H new ATOM 0 HA GLN A 52 26.016 30.216 5.339 1.00 32.81 H new ATOM 0 HB2 GLN A 52 27.919 29.226 3.167 1.00 32.81 H new ATOM 0 HB3 GLN A 52 27.628 30.890 3.634 1.00 32.81 H new ATOM 0 HG2 GLN A 52 28.556 28.981 5.789 1.00 34.44 H new ATOM 0 HG3 GLN A 52 29.736 29.486 4.596 1.00 34.44 H new ATOM 0 HE21 GLN A 52 30.961 30.850 6.009 1.00 38.34 H new ATOM 0 HE22 GLN A 52 30.296 32.339 6.688 1.00 38.34 H new ATOM 853 N TYR A 53 25.487 28.347 2.685 1.00 34.79 N ATOM 854 CA TYR A 53 24.551 28.116 1.561 1.00 37.88 C ATOM 855 C TYR A 53 23.196 27.717 2.144 1.00 39.97 C ATOM 856 O TYR A 53 22.159 28.204 1.748 1.00 39.08 O ATOM 857 CB TYR A 53 25.106 26.975 0.693 1.00 39.97 C ATOM 858 CG TYR A 53 23.992 26.324 -0.090 1.00 42.20 C ATOM 859 CD1 TYR A 53 23.202 25.349 0.515 1.00 42.61 C ATOM 860 CD2 TYR A 53 23.750 26.705 -1.404 1.00 42.58 C ATOM 861 CE1 TYR A 53 22.165 24.747 -0.195 1.00 45.45 C ATOM 862 CE2 TYR A 53 22.711 26.106 -2.127 1.00 44.68 C ATOM 863 CZ TYR A 53 21.916 25.125 -1.521 1.00 45.19 C ATOM 864 OH TYR A 53 20.890 24.531 -2.227 1.00 49.10 O ATOM 0 H TYR A 53 26.246 27.669 2.758 1.00 34.79 H new ATOM 0 HA TYR A 53 24.438 29.013 0.952 1.00 37.88 H new ATOM 0 HB2 TYR A 53 25.862 27.363 0.010 1.00 39.97 H new ATOM 0 HB3 TYR A 53 25.597 26.234 1.324 1.00 39.97 H new ATOM 0 HD1 TYR A 53 23.394 25.059 1.537 1.00 42.61 H new ATOM 0 HD2 TYR A 53 24.363 27.463 -1.868 1.00 42.58 H new ATOM 0 HE1 TYR A 53 21.555 23.991 0.276 1.00 45.45 H new ATOM 0 HE2 TYR A 53 22.523 26.400 -3.149 1.00 44.68 H new ATOM 0 HH TYR A 53 20.853 24.909 -3.131 1.00 49.10 H new ATOM 874 N VAL A 54 23.221 26.823 3.080 1.00 39.04 N ATOM 875 CA VAL A 54 21.969 26.347 3.716 1.00 40.51 C ATOM 876 C VAL A 54 21.159 27.566 4.175 1.00 40.89 C ATOM 877 O VAL A 54 20.028 27.765 3.779 1.00 40.52 O ATOM 878 CB VAL A 54 22.390 25.486 4.909 1.00 40.89 C ATOM 879 CG1 VAL A 54 21.313 25.431 5.963 1.00 41.12 C ATOM 880 CG2 VAL A 54 22.779 24.045 4.474 1.00 40.75 C ATOM 0 H VAL A 54 24.073 26.392 3.440 1.00 39.04 H new ATOM 0 HA VAL A 54 21.348 25.766 3.034 1.00 40.51 H new ATOM 0 HB VAL A 54 23.271 25.963 5.338 1.00 40.89 H new ATOM 0 HG11 VAL A 54 21.649 24.811 6.794 1.00 41.12 H new ATOM 0 HG12 VAL A 54 21.105 26.438 6.323 1.00 41.12 H new ATOM 0 HG13 VAL A 54 20.406 25.004 5.535 1.00 41.12 H new ATOM 0 HG21 VAL A 54 23.072 23.467 5.350 1.00 40.75 H new ATOM 0 HG22 VAL A 54 21.926 23.567 3.993 1.00 40.75 H new ATOM 0 HG23 VAL A 54 23.613 24.089 3.774 1.00 40.75 H new ATOM 890 N VAL A 55 21.741 28.381 5.008 1.00 40.66 N ATOM 891 CA VAL A 55 21.025 29.592 5.496 1.00 41.79 C ATOM 892 C VAL A 55 20.745 30.509 4.307 1.00 43.19 C ATOM 893 O VAL A 55 19.612 30.829 4.010 1.00 42.93 O ATOM 894 CB VAL A 55 21.904 30.321 6.521 1.00 40.93 C ATOM 895 CG1 VAL A 55 21.122 31.483 7.156 1.00 40.61 C ATOM 896 CG2 VAL A 55 22.326 29.333 7.612 1.00 41.17 C ATOM 0 H VAL A 55 22.686 28.260 5.374 1.00 40.66 H new ATOM 0 HA VAL A 55 20.085 29.309 5.969 1.00 41.79 H new ATOM 0 HB VAL A 55 22.786 30.720 6.020 1.00 40.93 H new ATOM 0 HG11 VAL A 55 21.755 31.994 7.882 1.00 40.61 H new ATOM 0 HG12 VAL A 55 20.820 32.186 6.379 1.00 40.61 H new ATOM 0 HG13 VAL A 55 20.236 31.094 7.657 1.00 40.61 H new ATOM 0 HG21 VAL A 55 22.951 29.844 8.344 1.00 41.17 H new ATOM 0 HG22 VAL A 55 21.439 28.936 8.106 1.00 41.17 H new ATOM 0 HG23 VAL A 55 22.889 28.514 7.164 1.00 41.17 H new ATOM 906 N ASN A 56 21.770 30.929 3.617 1.00 43.65 N ATOM 907 CA ASN A 56 21.555 31.816 2.442 1.00 46.57 C ATOM 908 C ASN A 56 20.517 31.177 1.523 1.00 47.19 C ATOM 909 O ASN A 56 19.793 31.854 0.821 1.00 46.87 O ATOM 910 CB ASN A 56 22.872 31.992 1.685 1.00 46.25 C ATOM 911 CG ASN A 56 23.888 32.701 2.582 1.00 46.74 C ATOM 912 OD1 ASN A 56 23.729 32.741 3.786 1.00 46.94 O ATOM 913 ND2 ASN A 56 24.932 33.267 2.043 1.00 47.06 N ATOM 0 H ASN A 56 22.743 30.697 3.816 1.00 43.65 H new ATOM 0 HA ASN A 56 21.202 32.792 2.775 1.00 46.57 H new ATOM 0 HB2 ASN A 56 23.259 31.021 1.377 1.00 46.25 H new ATOM 0 HB3 ASN A 56 22.707 32.572 0.777 1.00 46.25 H new ATOM 0 HD21 ASN A 56 25.615 33.743 2.632 1.00 47.06 H new ATOM 0 HD22 ASN A 56 25.065 33.233 1.032 1.00 47.06 H new ATOM 920 N GLU A 57 20.431 29.874 1.529 1.00 49.43 N ATOM 921 CA GLU A 57 19.432 29.200 0.663 1.00 51.03 C ATOM 922 C GLU A 57 18.049 29.336 1.294 1.00 51.99 C ATOM 923 O GLU A 57 17.122 29.822 0.684 1.00 52.02 O ATOM 924 CB GLU A 57 19.770 27.720 0.519 1.00 52.77 C ATOM 925 CG GLU A 57 18.671 27.013 -0.296 1.00 54.20 C ATOM 926 CD GLU A 57 17.523 26.591 0.627 1.00 56.33 C ATOM 927 OE1 GLU A 57 17.805 26.115 1.713 1.00 57.66 O ATOM 928 OE2 GLU A 57 16.382 26.752 0.230 1.00 57.76 O ATOM 0 H GLU A 57 21.009 29.252 2.095 1.00 49.43 H new ATOM 0 HA GLU A 57 19.444 29.666 -0.322 1.00 51.03 H new ATOM 0 HB2 GLU A 57 20.734 27.604 0.024 1.00 52.77 H new ATOM 0 HB3 GLU A 57 19.859 27.260 1.503 1.00 52.77 H new ATOM 0 HG2 GLU A 57 18.297 27.680 -1.073 1.00 54.20 H new ATOM 0 HG3 GLU A 57 19.085 26.139 -0.798 1.00 54.20 H new ATOM 935 N TYR A 58 17.903 28.910 2.519 1.00 53.12 N ATOM 936 CA TYR A 58 16.576 29.016 3.189 1.00 54.13 C ATOM 937 C TYR A 58 15.995 30.406 2.953 1.00 54.38 C ATOM 938 O TYR A 58 14.803 30.620 3.015 1.00 55.12 O ATOM 939 CB TYR A 58 16.739 28.792 4.691 1.00 54.54 C ATOM 940 CG TYR A 58 15.382 28.620 5.312 1.00 55.20 C ATOM 941 CD1 TYR A 58 14.776 27.364 5.300 1.00 55.36 C ATOM 942 CD2 TYR A 58 14.728 29.713 5.893 1.00 55.64 C ATOM 943 CE1 TYR A 58 13.514 27.193 5.867 1.00 55.93 C ATOM 944 CE2 TYR A 58 13.462 29.543 6.464 1.00 56.15 C ATOM 945 CZ TYR A 58 12.853 28.281 6.452 1.00 56.20 C ATOM 946 OH TYR A 58 11.604 28.111 7.013 1.00 58.01 O ATOM 0 H TYR A 58 18.644 28.494 3.084 1.00 53.12 H new ATOM 0 HA TYR A 58 15.906 28.262 2.777 1.00 54.13 H new ATOM 0 HB2 TYR A 58 17.352 27.909 4.875 1.00 54.54 H new ATOM 0 HB3 TYR A 58 17.255 29.639 5.144 1.00 54.54 H new ATOM 0 HD1 TYR A 58 15.285 26.524 4.851 1.00 55.36 H new ATOM 0 HD2 TYR A 58 15.199 30.685 5.900 1.00 55.64 H new ATOM 0 HE1 TYR A 58 13.045 26.220 5.855 1.00 55.93 H new ATOM 0 HE2 TYR A 58 12.955 30.384 6.914 1.00 56.15 H new ATOM 0 HH TYR A 58 11.659 27.460 7.743 1.00 58.01 H new ATOM 1151 N ASP B 7 13.070 23.131 9.067 1.00 55.77 N ATOM 1152 CA ASP B 7 12.536 24.312 9.814 1.00 53.95 C ATOM 1153 C ASP B 7 12.903 24.197 11.297 1.00 52.49 C ATOM 1154 O ASP B 7 13.546 25.066 11.852 1.00 51.89 O ATOM 1155 CB ASP B 7 11.013 24.365 9.669 1.00 54.63 C ATOM 1156 CG ASP B 7 10.509 25.758 10.052 1.00 55.27 C ATOM 1157 OD1 ASP B 7 10.244 25.970 11.224 1.00 56.33 O ATOM 1158 OD2 ASP B 7 10.397 26.590 9.166 1.00 55.55 O ATOM 0 HA ASP B 7 12.973 25.222 9.404 1.00 53.95 H new ATOM 0 HB2 ASP B 7 10.727 24.133 8.643 1.00 54.63 H new ATOM 0 HB3 ASP B 7 10.550 23.612 10.307 1.00 54.63 H new ATOM 1163 N VAL B 8 12.525 23.122 11.938 1.00 50.38 N ATOM 1164 CA VAL B 8 12.886 22.952 13.383 1.00 48.45 C ATOM 1165 C VAL B 8 14.383 23.221 13.512 1.00 46.36 C ATOM 1166 O VAL B 8 14.845 23.921 14.389 1.00 44.84 O ATOM 1167 CB VAL B 8 12.600 21.500 13.851 1.00 48.63 C ATOM 1168 CG1 VAL B 8 11.285 21.442 14.621 1.00 48.83 C ATOM 1169 CG2 VAL B 8 12.521 20.574 12.641 1.00 47.55 C ATOM 0 H VAL B 8 11.986 22.358 11.530 1.00 50.38 H new ATOM 0 HA VAL B 8 12.298 23.636 13.995 1.00 48.45 H new ATOM 0 HB VAL B 8 13.410 21.178 14.505 1.00 48.63 H new ATOM 0 HG11 VAL B 8 11.097 20.418 14.943 1.00 48.83 H new ATOM 0 HG12 VAL B 8 11.346 22.092 15.494 1.00 48.83 H new ATOM 0 HG13 VAL B 8 10.471 21.775 13.977 1.00 48.83 H new ATOM 0 HG21 VAL B 8 12.320 19.556 12.974 1.00 47.55 H new ATOM 0 HG22 VAL B 8 11.719 20.905 11.981 1.00 47.55 H new ATOM 0 HG23 VAL B 8 13.468 20.599 12.101 1.00 47.55 H new ATOM 1179 N PHE B 9 15.135 22.645 12.629 1.00 44.57 N ATOM 1180 CA PHE B 9 16.601 22.834 12.664 1.00 42.68 C ATOM 1181 C PHE B 9 16.911 24.329 12.702 1.00 41.92 C ATOM 1182 O PHE B 9 17.531 24.822 13.623 1.00 40.56 O ATOM 1183 CB PHE B 9 17.226 22.195 11.413 1.00 41.99 C ATOM 1184 CG PHE B 9 18.658 21.849 11.702 1.00 41.32 C ATOM 1185 CD1 PHE B 9 19.636 22.840 11.615 1.00 41.38 C ATOM 1186 CD2 PHE B 9 19.005 20.546 12.065 1.00 41.88 C ATOM 1187 CE1 PHE B 9 20.963 22.530 11.888 1.00 39.40 C ATOM 1188 CE2 PHE B 9 20.336 20.238 12.339 1.00 39.39 C ATOM 1189 CZ PHE B 9 21.312 21.234 12.249 1.00 40.84 C ATOM 0 H PHE B 9 14.794 22.046 11.877 1.00 44.57 H new ATOM 0 HA PHE B 9 17.018 22.358 13.552 1.00 42.68 H new ATOM 0 HB2 PHE B 9 16.672 21.299 11.132 1.00 41.99 H new ATOM 0 HB3 PHE B 9 17.168 22.884 10.570 1.00 41.99 H new ATOM 0 HD1 PHE B 9 19.362 23.847 11.336 1.00 41.38 H new ATOM 0 HD2 PHE B 9 18.246 19.781 12.133 1.00 41.88 H new ATOM 0 HE1 PHE B 9 21.722 23.295 11.820 1.00 39.40 H new ATOM 0 HE2 PHE B 9 20.612 19.233 12.620 1.00 39.39 H new ATOM 0 HZ PHE B 9 22.344 20.995 12.461 1.00 40.84 H new ATOM 1199 N LEU B 10 16.474 25.055 11.714 1.00 41.09 N ATOM 1200 CA LEU B 10 16.735 26.517 11.706 1.00 41.50 C ATOM 1201 C LEU B 10 16.093 27.129 12.946 1.00 41.09 C ATOM 1202 O LEU B 10 16.631 28.031 13.556 1.00 38.55 O ATOM 1203 CB LEU B 10 16.139 27.143 10.447 1.00 42.71 C ATOM 1204 CG LEU B 10 16.555 26.328 9.219 1.00 43.61 C ATOM 1205 CD1 LEU B 10 16.142 27.078 7.960 1.00 44.50 C ATOM 1206 CD2 LEU B 10 18.075 26.130 9.206 1.00 43.61 C ATOM 0 H LEU B 10 15.949 24.700 10.915 1.00 41.09 H new ATOM 0 HA LEU B 10 17.809 26.705 11.712 1.00 41.50 H new ATOM 0 HB2 LEU B 10 15.052 27.174 10.524 1.00 42.71 H new ATOM 0 HB3 LEU B 10 16.481 28.173 10.345 1.00 42.71 H new ATOM 0 HG LEU B 10 16.067 25.354 9.255 1.00 43.61 H new ATOM 0 HD11 LEU B 10 16.435 26.503 7.081 1.00 44.50 H new ATOM 0 HD12 LEU B 10 15.061 27.218 7.958 1.00 44.50 H new ATOM 0 HD13 LEU B 10 16.634 28.051 7.938 1.00 44.50 H new ATOM 0 HD21 LEU B 10 18.359 25.549 8.328 1.00 43.61 H new ATOM 0 HD22 LEU B 10 18.568 27.101 9.173 1.00 43.61 H new ATOM 0 HD23 LEU B 10 18.380 25.598 10.107 1.00 43.61 H new ATOM 1218 N ASP B 11 14.952 26.635 13.342 1.00 41.28 N ATOM 1219 CA ASP B 11 14.306 27.188 14.560 1.00 41.44 C ATOM 1220 C ASP B 11 15.292 27.059 15.718 1.00 39.86 C ATOM 1221 O ASP B 11 15.647 28.036 16.345 1.00 37.26 O ATOM 1222 CB ASP B 11 13.024 26.417 14.882 1.00 44.23 C ATOM 1223 CG ASP B 11 12.125 26.376 13.645 1.00 46.87 C ATOM 1224 OD1 ASP B 11 12.470 27.016 12.665 1.00 49.31 O ATOM 1225 OD2 ASP B 11 11.105 25.708 13.700 1.00 48.41 O ATOM 0 H ASP B 11 14.445 25.880 12.879 1.00 41.28 H new ATOM 0 HA ASP B 11 14.042 28.233 14.398 1.00 41.44 H new ATOM 0 HB2 ASP B 11 13.268 25.403 15.201 1.00 44.23 H new ATOM 0 HB3 ASP B 11 12.499 26.894 15.710 1.00 44.23 H new ATOM 1230 N TYR B 12 15.765 25.865 15.998 1.00 39.23 N ATOM 1231 CA TYR B 12 16.751 25.710 17.109 1.00 38.08 C ATOM 1232 C TYR B 12 17.848 26.740 16.923 1.00 34.01 C ATOM 1233 O TYR B 12 18.189 27.472 17.831 1.00 32.49 O ATOM 1234 CB TYR B 12 17.404 24.326 17.089 1.00 42.28 C ATOM 1235 CG TYR B 12 16.386 23.203 17.178 1.00 47.31 C ATOM 1236 CD1 TYR B 12 15.249 23.292 18.004 1.00 49.49 C ATOM 1237 CD2 TYR B 12 16.606 22.045 16.429 1.00 48.65 C ATOM 1238 CE1 TYR B 12 14.350 22.222 18.067 1.00 50.83 C ATOM 1239 CE2 TYR B 12 15.713 20.984 16.492 1.00 51.34 C ATOM 1240 CZ TYR B 12 14.581 21.066 17.312 1.00 50.67 C ATOM 1241 OH TYR B 12 13.695 20.010 17.374 1.00 52.32 O ATOM 0 H TYR B 12 15.513 25.005 15.511 1.00 39.23 H new ATOM 0 HA TYR B 12 16.224 25.840 18.054 1.00 38.08 H new ATOM 0 HB2 TYR B 12 17.984 24.215 16.173 1.00 42.28 H new ATOM 0 HB3 TYR B 12 18.103 24.245 17.921 1.00 42.28 H new ATOM 0 HD1 TYR B 12 15.072 24.184 18.587 1.00 49.49 H new ATOM 0 HD2 TYR B 12 17.478 21.974 15.796 1.00 48.65 H new ATOM 0 HE1 TYR B 12 13.477 22.288 18.699 1.00 50.83 H new ATOM 0 HE2 TYR B 12 15.892 20.094 15.907 1.00 51.34 H new ATOM 0 HH TYR B 12 14.005 19.288 16.788 1.00 52.32 H new ATOM 1251 N CYS B 13 18.399 26.815 15.744 1.00 32.32 N ATOM 1252 CA CYS B 13 19.463 27.813 15.495 1.00 29.00 C ATOM 1253 C CYS B 13 18.974 29.159 16.009 1.00 29.81 C ATOM 1254 O CYS B 13 19.542 29.724 16.913 1.00 24.62 O ATOM 1255 CB CYS B 13 19.750 27.895 13.996 1.00 28.41 C ATOM 1256 SG CYS B 13 19.903 26.221 13.325 1.00 23.95 S ATOM 0 H CYS B 13 18.156 26.227 14.946 1.00 32.32 H new ATOM 0 HA CYS B 13 20.382 27.528 16.007 1.00 29.00 H new ATOM 0 HB2 CYS B 13 18.947 28.431 13.489 1.00 28.41 H new ATOM 0 HB3 CYS B 13 20.668 28.455 13.820 1.00 28.41 H new ATOM 0 HG CYS B 13 18.731 25.661 13.285 1.00 23.95 H new ATOM 1262 N GLN B 14 17.900 29.657 15.459 1.00 29.76 N ATOM 1263 CA GLN B 14 17.354 30.959 15.930 1.00 32.34 C ATOM 1264 C GLN B 14 17.317 30.974 17.466 1.00 33.14 C ATOM 1265 O GLN B 14 17.586 31.979 18.085 1.00 33.29 O ATOM 1266 CB GLN B 14 15.943 31.159 15.360 1.00 34.56 C ATOM 1267 CG GLN B 14 15.583 32.650 15.348 1.00 39.08 C ATOM 1268 CD GLN B 14 15.298 33.119 16.776 1.00 41.02 C ATOM 1269 OE1 GLN B 14 14.254 32.828 17.326 1.00 42.67 O ATOM 1270 NE2 GLN B 14 16.188 33.836 17.404 1.00 42.20 N ATOM 0 H GLN B 14 17.377 29.216 14.702 1.00 29.76 H new ATOM 0 HA GLN B 14 17.992 31.772 15.585 1.00 32.34 H new ATOM 0 HB2 GLN B 14 15.891 30.757 14.348 1.00 34.56 H new ATOM 0 HB3 GLN B 14 15.219 30.607 15.960 1.00 34.56 H new ATOM 0 HG2 GLN B 14 16.402 33.229 14.921 1.00 39.08 H new ATOM 0 HG3 GLN B 14 14.710 32.819 14.718 1.00 39.08 H new ATOM 0 HE21 GLN B 14 17.064 34.080 16.942 1.00 42.20 H new ATOM 0 HE22 GLN B 14 16.008 34.153 18.357 1.00 42.20 H new ATOM 1279 N LYS B 15 17.015 29.865 18.092 1.00 31.48 N ATOM 1280 CA LYS B 15 17.011 29.852 19.584 1.00 31.70 C ATOM 1281 C LYS B 15 18.475 29.887 20.038 1.00 30.74 C ATOM 1282 O LYS B 15 18.903 30.790 20.723 1.00 30.57 O ATOM 1283 CB LYS B 15 16.328 28.568 20.109 1.00 35.91 C ATOM 1284 CG LYS B 15 14.832 28.796 20.351 1.00 40.53 C ATOM 1285 CD LYS B 15 14.090 28.907 19.015 1.00 42.80 C ATOM 1286 CE LYS B 15 12.590 28.709 19.242 1.00 45.27 C ATOM 1287 NZ LYS B 15 12.045 29.863 20.013 1.00 48.21 N ATOM 0 H LYS B 15 16.775 28.982 17.642 1.00 31.48 H new ATOM 0 HA LYS B 15 16.459 30.707 19.974 1.00 31.70 H new ATOM 0 HB2 LYS B 15 16.464 27.760 19.390 1.00 35.91 H new ATOM 0 HB3 LYS B 15 16.805 28.252 21.037 1.00 35.91 H new ATOM 0 HG2 LYS B 15 14.421 27.973 20.936 1.00 40.53 H new ATOM 0 HG3 LYS B 15 14.685 29.706 20.933 1.00 40.53 H new ATOM 0 HD2 LYS B 15 14.274 29.883 18.565 1.00 42.80 H new ATOM 0 HD3 LYS B 15 14.464 28.158 18.317 1.00 42.80 H new ATOM 0 HE2 LYS B 15 12.075 28.622 18.285 1.00 45.27 H new ATOM 0 HE3 LYS B 15 12.413 27.780 19.784 1.00 45.27 H new ATOM 0 HZ1 LYS B 15 11.012 29.770 20.094 1.00 48.21 H new ATOM 0 HZ2 LYS B 15 12.467 29.876 20.964 1.00 48.21 H new ATOM 0 HZ3 LYS B 15 12.275 30.749 19.520 1.00 48.21 H new ATOM 1301 N LEU B 16 19.260 28.924 19.631 1.00 26.59 N ATOM 1302 CA LEU B 16 20.702 28.932 20.017 1.00 27.03 C ATOM 1303 C LEU B 16 21.255 30.315 19.681 1.00 24.17 C ATOM 1304 O LEU B 16 22.077 30.873 20.380 1.00 23.26 O ATOM 1305 CB LEU B 16 21.438 27.843 19.215 1.00 28.15 C ATOM 1306 CG LEU B 16 22.699 27.369 19.962 1.00 28.00 C ATOM 1307 CD1 LEU B 16 22.318 26.722 21.308 1.00 30.50 C ATOM 1308 CD2 LEU B 16 23.448 26.349 19.084 1.00 26.29 C ATOM 0 H LEU B 16 18.968 28.137 19.052 1.00 26.59 H new ATOM 0 HA LEU B 16 20.836 28.727 21.079 1.00 27.03 H new ATOM 0 HB2 LEU B 16 20.771 26.997 19.045 1.00 28.15 H new ATOM 0 HB3 LEU B 16 21.715 28.232 18.235 1.00 28.15 H new ATOM 0 HG LEU B 16 23.341 28.227 20.163 1.00 28.00 H new ATOM 0 HD11 LEU B 16 23.221 26.393 21.822 1.00 30.50 H new ATOM 0 HD12 LEU B 16 21.793 27.450 21.926 1.00 30.50 H new ATOM 0 HD13 LEU B 16 21.670 25.864 21.129 1.00 30.50 H new ATOM 0 HD21 LEU B 16 24.343 26.008 19.605 1.00 26.29 H new ATOM 0 HD22 LEU B 16 22.799 25.497 18.882 1.00 26.29 H new ATOM 0 HD23 LEU B 16 23.733 26.819 18.143 1.00 26.29 H new ATOM 1320 N LEU B 17 20.756 30.870 18.620 1.00 23.83 N ATOM 1321 CA LEU B 17 21.166 32.232 18.196 1.00 25.91 C ATOM 1322 C LEU B 17 20.680 33.220 19.264 1.00 28.74 C ATOM 1323 O LEU B 17 21.346 34.180 19.596 1.00 29.35 O ATOM 1324 CB LEU B 17 20.485 32.542 16.853 1.00 23.53 C ATOM 1325 CG LEU B 17 21.211 33.688 16.107 1.00 23.31 C ATOM 1326 CD1 LEU B 17 22.341 33.130 15.204 1.00 16.92 C ATOM 1327 CD2 LEU B 17 20.203 34.466 15.234 1.00 19.75 C ATOM 0 H LEU B 17 20.065 30.427 18.014 1.00 23.83 H new ATOM 0 HA LEU B 17 22.248 32.307 18.083 1.00 25.91 H new ATOM 0 HB2 LEU B 17 20.478 31.647 16.231 1.00 23.53 H new ATOM 0 HB3 LEU B 17 19.445 32.819 17.025 1.00 23.53 H new ATOM 0 HG LEU B 17 21.650 34.354 16.850 1.00 23.31 H new ATOM 0 HD11 LEU B 17 22.836 33.954 14.690 1.00 16.92 H new ATOM 0 HD12 LEU B 17 23.067 32.596 15.817 1.00 16.92 H new ATOM 0 HD13 LEU B 17 21.915 32.447 14.469 1.00 16.92 H new ATOM 0 HD21 LEU B 17 20.720 35.271 14.712 1.00 19.75 H new ATOM 0 HD22 LEU B 17 19.755 33.790 14.506 1.00 19.75 H new ATOM 0 HD23 LEU B 17 19.422 34.887 15.867 1.00 19.75 H new ATOM 1339 N GLU B 18 19.508 32.974 19.801 1.00 30.66 N ATOM 1340 CA GLU B 18 18.948 33.876 20.849 1.00 33.61 C ATOM 1341 C GLU B 18 19.566 33.513 22.207 1.00 34.68 C ATOM 1342 O GLU B 18 19.922 34.373 22.986 1.00 34.80 O ATOM 1343 CB GLU B 18 17.396 33.738 20.863 1.00 35.91 C ATOM 1344 CG GLU B 18 16.892 32.869 22.031 1.00 37.64 C ATOM 1345 CD GLU B 18 15.383 32.663 21.891 1.00 40.24 C ATOM 1346 OE1 GLU B 18 14.876 32.863 20.800 1.00 40.39 O ATOM 1347 OE2 GLU B 18 14.759 32.309 22.879 1.00 40.89 O ATOM 0 H GLU B 18 18.915 32.182 19.555 1.00 30.66 H new ATOM 0 HA GLU B 18 19.192 34.917 20.635 1.00 33.61 H new ATOM 0 HB2 GLU B 18 16.947 34.729 20.931 1.00 35.91 H new ATOM 0 HB3 GLU B 18 17.065 33.302 19.921 1.00 35.91 H new ATOM 0 HG2 GLU B 18 17.404 31.907 22.031 1.00 37.64 H new ATOM 0 HG3 GLU B 18 17.119 33.351 22.982 1.00 37.64 H new ATOM 1354 N LYS B 19 19.703 32.247 22.491 1.00 34.95 N ATOM 1355 CA LYS B 19 20.305 31.840 23.789 1.00 36.04 C ATOM 1356 C LYS B 19 21.640 32.565 23.966 1.00 35.87 C ATOM 1357 O LYS B 19 21.931 33.116 25.010 1.00 36.90 O ATOM 1358 CB LYS B 19 20.515 30.327 23.800 1.00 36.58 C ATOM 1359 CG LYS B 19 20.451 29.814 25.250 1.00 39.52 C ATOM 1360 CD LYS B 19 21.202 28.506 25.347 1.00 41.12 C ATOM 1361 CE LYS B 19 20.921 27.842 26.696 1.00 43.76 C ATOM 1362 NZ LYS B 19 20.933 28.876 27.770 1.00 45.38 N ATOM 0 H LYS B 19 19.424 31.479 21.881 1.00 34.95 H new ATOM 0 HA LYS B 19 19.641 32.106 24.611 1.00 36.04 H new ATOM 0 HB2 LYS B 19 19.751 29.838 23.195 1.00 36.58 H new ATOM 0 HB3 LYS B 19 21.479 30.079 23.357 1.00 36.58 H new ATOM 0 HG2 LYS B 19 20.886 30.548 25.928 1.00 39.52 H new ATOM 0 HG3 LYS B 19 19.414 29.675 25.554 1.00 39.52 H new ATOM 0 HD2 LYS B 19 20.901 27.843 24.536 1.00 41.12 H new ATOM 0 HD3 LYS B 19 22.272 28.682 25.234 1.00 41.12 H new ATOM 0 HE2 LYS B 19 19.954 27.339 26.672 1.00 43.76 H new ATOM 0 HE3 LYS B 19 21.672 27.080 26.902 1.00 43.76 H new ATOM 0 HZ1 LYS B 19 21.066 28.416 28.693 1.00 45.38 H new ATOM 0 HZ2 LYS B 19 21.712 29.543 27.601 1.00 45.38 H new ATOM 0 HZ3 LYS B 19 20.029 29.391 27.766 1.00 45.38 H new ATOM 1376 N PHE B 20 22.450 32.571 22.943 1.00 35.16 N ATOM 1377 CA PHE B 20 23.767 33.258 23.015 1.00 34.19 C ATOM 1378 C PHE B 20 23.630 34.657 22.412 1.00 34.42 C ATOM 1379 O PHE B 20 24.585 35.403 22.321 1.00 33.94 O ATOM 1380 CB PHE B 20 24.773 32.450 22.203 1.00 34.18 C ATOM 1381 CG PHE B 20 25.179 31.221 22.975 1.00 32.04 C ATOM 1382 CD1 PHE B 20 24.410 30.056 22.885 1.00 31.71 C ATOM 1383 CD2 PHE B 20 26.319 31.249 23.784 1.00 34.13 C ATOM 1384 CE1 PHE B 20 24.781 28.917 23.604 1.00 31.01 C ATOM 1385 CE2 PHE B 20 26.690 30.112 24.507 1.00 33.69 C ATOM 1386 CZ PHE B 20 25.921 28.945 24.418 1.00 32.95 C ATOM 0 H PHE B 20 22.251 32.122 22.049 1.00 35.16 H new ATOM 0 HA PHE B 20 24.101 33.340 24.049 1.00 34.19 H new ATOM 0 HB2 PHE B 20 24.336 32.163 21.247 1.00 34.18 H new ATOM 0 HB3 PHE B 20 25.650 33.059 21.983 1.00 34.18 H new ATOM 0 HD1 PHE B 20 23.530 30.037 22.260 1.00 31.71 H new ATOM 0 HD2 PHE B 20 26.913 32.149 23.850 1.00 34.13 H new ATOM 0 HE1 PHE B 20 24.190 28.016 23.532 1.00 31.01 H new ATOM 0 HE2 PHE B 20 27.569 30.133 25.134 1.00 33.69 H new ATOM 0 HZ PHE B 20 26.207 28.066 24.977 1.00 32.95 H new ATOM 1396 N ARG B 21 22.443 35.010 21.997 1.00 33.90 N ATOM 1397 CA ARG B 21 22.217 36.355 21.395 1.00 35.50 C ATOM 1398 C ARG B 21 23.202 36.595 20.247 1.00 34.22 C ATOM 1399 O ARG B 21 23.647 37.704 20.029 1.00 33.41 O ATOM 1400 CB ARG B 21 22.411 37.441 22.465 1.00 38.56 C ATOM 1401 CG ARG B 21 21.224 37.444 23.449 1.00 42.96 C ATOM 1402 CD ARG B 21 20.094 38.336 22.917 1.00 46.75 C ATOM 1403 NE ARG B 21 20.582 39.740 22.807 1.00 50.46 N ATOM 1404 CZ ARG B 21 19.903 40.615 22.116 1.00 51.88 C ATOM 1405 NH1 ARG B 21 18.798 40.260 21.520 1.00 54.10 N ATOM 1406 NH2 ARG B 21 20.329 41.845 22.022 1.00 54.21 N ATOM 0 H ARG B 21 21.614 34.419 22.050 1.00 33.90 H new ATOM 0 HA ARG B 21 21.199 36.398 21.008 1.00 35.50 H new ATOM 0 HB2 ARG B 21 23.340 37.265 23.007 1.00 38.56 H new ATOM 0 HB3 ARG B 21 22.500 38.418 21.989 1.00 38.56 H new ATOM 0 HG2 ARG B 21 20.858 36.427 23.591 1.00 42.96 H new ATOM 0 HG3 ARG B 21 21.552 37.804 24.424 1.00 42.96 H new ATOM 0 HD2 ARG B 21 19.761 37.978 21.943 1.00 46.75 H new ATOM 0 HD3 ARG B 21 19.234 38.290 23.585 1.00 46.75 H new ATOM 0 HE ARG B 21 21.447 40.017 23.272 1.00 50.46 H new ATOM 0 HH11 ARG B 21 18.465 39.299 21.594 1.00 54.10 H new ATOM 0 HH12 ARG B 21 18.267 40.944 20.980 1.00 54.10 H new ATOM 0 HH21 ARG B 21 21.193 42.123 22.488 1.00 54.21 H new ATOM 0 HH22 ARG B 21 19.798 42.529 21.482 1.00 54.21 H new ATOM 1420 N TYR B 22 23.547 35.576 19.502 1.00 31.03 N ATOM 1421 CA TYR B 22 24.497 35.786 18.376 1.00 30.00 C ATOM 1422 C TYR B 22 23.784 36.605 17.268 1.00 28.60 C ATOM 1423 O TYR B 22 22.590 36.472 17.101 1.00 27.38 O ATOM 1424 CB TYR B 22 24.907 34.418 17.804 1.00 26.97 C ATOM 1425 CG TYR B 22 26.018 33.784 18.633 1.00 28.47 C ATOM 1426 CD1 TYR B 22 27.243 34.447 18.832 1.00 28.83 C ATOM 1427 CD2 TYR B 22 25.819 32.520 19.208 1.00 26.95 C ATOM 1428 CE1 TYR B 22 28.248 33.851 19.601 1.00 27.02 C ATOM 1429 CE2 TYR B 22 26.829 31.926 19.975 1.00 26.27 C ATOM 1430 CZ TYR B 22 28.041 32.593 20.172 1.00 26.46 C ATOM 1431 OH TYR B 22 29.035 32.008 20.930 1.00 23.82 O ATOM 0 H TYR B 22 23.215 34.619 19.625 1.00 31.03 H new ATOM 0 HA TYR B 22 25.381 36.320 18.726 1.00 30.00 H new ATOM 0 HB2 TYR B 22 24.042 33.755 17.784 1.00 26.97 H new ATOM 0 HB3 TYR B 22 25.242 34.537 16.773 1.00 26.97 H new ATOM 0 HD1 TYR B 22 27.408 35.418 18.390 1.00 28.83 H new ATOM 0 HD2 TYR B 22 24.883 32.003 19.059 1.00 26.95 H new ATOM 0 HE1 TYR B 22 29.186 34.364 19.754 1.00 27.02 H new ATOM 0 HE2 TYR B 22 26.671 30.952 20.414 1.00 26.27 H new ATOM 0 HH TYR B 22 29.813 32.603 20.965 1.00 23.82 H new ATOM 1441 N PRO B 23 24.523 37.410 16.520 1.00 29.13 N ATOM 1442 CA PRO B 23 23.930 38.200 15.420 1.00 28.62 C ATOM 1443 C PRO B 23 23.201 37.270 14.432 1.00 28.74 C ATOM 1444 O PRO B 23 23.221 36.066 14.569 1.00 26.54 O ATOM 1445 CB PRO B 23 25.129 38.907 14.745 1.00 29.12 C ATOM 1446 CG PRO B 23 26.412 38.499 15.522 1.00 29.87 C ATOM 1447 CD PRO B 23 25.973 37.607 16.703 1.00 29.51 C ATOM 0 HA PRO B 23 23.189 38.918 15.772 1.00 28.62 H new ATOM 0 HB2 PRO B 23 25.206 38.615 13.698 1.00 29.12 H new ATOM 0 HB3 PRO B 23 24.997 39.989 14.765 1.00 29.12 H new ATOM 0 HG2 PRO B 23 27.101 37.961 14.870 1.00 29.87 H new ATOM 0 HG3 PRO B 23 26.939 39.382 15.883 1.00 29.87 H new ATOM 0 HD2 PRO B 23 26.504 36.655 16.696 1.00 29.51 H new ATOM 0 HD3 PRO B 23 26.188 38.085 17.659 1.00 29.51 H new ATOM 1455 N TRP B 24 22.553 37.833 13.446 1.00 24.77 N ATOM 1456 CA TRP B 24 21.808 37.001 12.446 1.00 26.20 C ATOM 1457 C TRP B 24 22.760 36.422 11.393 1.00 24.23 C ATOM 1458 O TRP B 24 22.400 35.528 10.654 1.00 20.77 O ATOM 1459 CB TRP B 24 20.754 37.872 11.758 1.00 28.27 C ATOM 1460 CG TRP B 24 20.013 37.073 10.729 1.00 30.88 C ATOM 1461 CD1 TRP B 24 20.126 37.246 9.392 1.00 31.38 C ATOM 1462 CD2 TRP B 24 19.044 35.994 10.920 1.00 29.00 C ATOM 1463 NE1 TRP B 24 19.291 36.349 8.751 1.00 31.09 N ATOM 1464 CE2 TRP B 24 18.604 35.556 9.648 1.00 31.07 C ATOM 1465 CE3 TRP B 24 18.507 35.357 12.058 1.00 30.12 C ATOM 1466 CZ2 TRP B 24 17.667 34.531 9.510 1.00 31.07 C ATOM 1467 CZ3 TRP B 24 17.566 34.323 11.918 1.00 31.73 C ATOM 1468 CH2 TRP B 24 17.146 33.915 10.646 1.00 30.51 C ATOM 0 H TRP B 24 22.506 38.839 13.287 1.00 24.77 H new ATOM 0 HA TRP B 24 21.331 36.171 12.968 1.00 26.20 H new ATOM 0 HB2 TRP B 24 20.055 38.263 12.498 1.00 28.27 H new ATOM 0 HB3 TRP B 24 21.232 38.731 11.287 1.00 28.27 H new ATOM 0 HD1 TRP B 24 20.765 37.968 8.904 1.00 31.38 H new ATOM 0 HE1 TRP B 24 19.194 36.282 7.738 1.00 31.09 H new ATOM 0 HE3 TRP B 24 18.821 35.666 13.044 1.00 30.12 H new ATOM 0 HZ2 TRP B 24 17.347 34.217 8.527 1.00 31.07 H new ATOM 0 HZ3 TRP B 24 17.164 33.840 12.797 1.00 31.73 H new ATOM 0 HH2 TRP B 24 16.418 33.123 10.546 1.00 30.51 H new ATOM 1479 N GLU B 25 23.964 36.920 11.302 1.00 21.71 N ATOM 1480 CA GLU B 25 24.908 36.384 10.275 1.00 23.69 C ATOM 1481 C GLU B 25 25.542 35.073 10.763 1.00 22.17 C ATOM 1482 O GLU B 25 26.162 34.367 9.997 1.00 20.98 O ATOM 1483 CB GLU B 25 26.009 37.418 9.980 1.00 29.06 C ATOM 1484 CG GLU B 25 26.391 38.154 11.266 1.00 37.12 C ATOM 1485 CD GLU B 25 27.764 38.813 11.099 1.00 42.03 C ATOM 1486 OE1 GLU B 25 27.923 39.574 10.159 1.00 44.49 O ATOM 1487 OE2 GLU B 25 28.631 38.545 11.914 1.00 44.52 O ATOM 0 H GLU B 25 24.334 37.668 11.888 1.00 21.71 H new ATOM 0 HA GLU B 25 24.350 36.185 9.360 1.00 23.69 H new ATOM 0 HB2 GLU B 25 26.884 36.921 9.562 1.00 29.06 H new ATOM 0 HB3 GLU B 25 25.660 38.131 9.233 1.00 29.06 H new ATOM 0 HG2 GLU B 25 25.641 38.910 11.500 1.00 37.12 H new ATOM 0 HG3 GLU B 25 26.412 37.456 12.103 1.00 37.12 H new ATOM 1494 N LEU B 26 25.412 34.743 12.028 1.00 18.07 N ATOM 1495 CA LEU B 26 26.027 33.473 12.538 1.00 16.50 C ATOM 1496 C LEU B 26 25.026 32.330 12.453 1.00 16.77 C ATOM 1497 O LEU B 26 25.184 31.305 13.085 1.00 16.07 O ATOM 1498 CB LEU B 26 26.478 33.658 13.986 1.00 18.60 C ATOM 1499 CG LEU B 26 27.281 34.960 14.126 1.00 21.90 C ATOM 1500 CD1 LEU B 26 28.057 34.933 15.440 1.00 24.06 C ATOM 1501 CD2 LEU B 26 28.278 35.115 12.966 1.00 25.09 C ATOM 0 H LEU B 26 24.910 35.293 12.725 1.00 18.07 H new ATOM 0 HA LEU B 26 26.892 33.231 11.920 1.00 16.50 H new ATOM 0 HB2 LEU B 26 25.610 33.684 14.645 1.00 18.60 H new ATOM 0 HB3 LEU B 26 27.088 32.810 14.296 1.00 18.60 H new ATOM 0 HG LEU B 26 26.585 35.799 14.109 1.00 21.90 H new ATOM 0 HD11 LEU B 26 28.629 35.855 15.544 1.00 24.06 H new ATOM 0 HD12 LEU B 26 27.359 34.843 16.273 1.00 24.06 H new ATOM 0 HD13 LEU B 26 28.738 34.082 15.443 1.00 24.06 H new ATOM 0 HD21 LEU B 26 28.835 36.044 13.087 1.00 25.09 H new ATOM 0 HD22 LEU B 26 28.971 34.274 12.967 1.00 25.09 H new ATOM 0 HD23 LEU B 26 27.736 35.137 12.021 1.00 25.09 H new ATOM 1513 N MET B 27 24.013 32.479 11.651 1.00 15.51 N ATOM 1514 CA MET B 27 23.036 31.383 11.504 1.00 15.51 C ATOM 1515 C MET B 27 23.761 30.116 10.981 1.00 15.79 C ATOM 1516 O MET B 27 23.503 29.037 11.477 1.00 14.86 O ATOM 1517 CB MET B 27 21.912 31.809 10.529 1.00 16.03 C ATOM 1518 CG MET B 27 20.720 32.450 11.260 1.00 14.48 C ATOM 1519 SD MET B 27 19.217 32.019 10.359 1.00 11.00 S ATOM 1520 CE MET B 27 18.844 30.518 11.279 1.00 16.96 C ATOM 0 H MET B 27 23.824 33.312 11.094 1.00 15.51 H new ATOM 0 HA MET B 27 22.586 31.159 12.471 1.00 15.51 H new ATOM 0 HB2 MET B 27 22.313 32.515 9.802 1.00 16.03 H new ATOM 0 HB3 MET B 27 21.568 30.938 9.971 1.00 16.03 H new ATOM 0 HG2 MET B 27 20.665 32.090 12.287 1.00 14.48 H new ATOM 0 HG3 MET B 27 20.839 33.532 11.307 1.00 14.48 H new ATOM 0 HE1 MET B 27 17.932 30.068 10.887 1.00 16.96 H new ATOM 0 HE2 MET B 27 19.669 29.814 11.176 1.00 16.96 H new ATOM 0 HE3 MET B 27 18.704 30.762 12.332 1.00 16.96 H new ATOM 1530 N PRO B 28 24.649 30.259 10.003 1.00 15.25 N ATOM 1531 CA PRO B 28 25.381 29.098 9.457 1.00 16.18 C ATOM 1532 C PRO B 28 26.189 28.427 10.573 1.00 15.53 C ATOM 1533 O PRO B 28 26.397 27.238 10.560 1.00 16.52 O ATOM 1534 CB PRO B 28 26.292 29.695 8.355 1.00 16.78 C ATOM 1535 CG PRO B 28 25.778 31.130 8.099 1.00 19.84 C ATOM 1536 CD PRO B 28 25.002 31.542 9.356 1.00 17.18 C ATOM 0 HA PRO B 28 24.728 28.326 9.050 1.00 16.18 H new ATOM 0 HB2 PRO B 28 27.334 29.706 8.675 1.00 16.78 H new ATOM 0 HB3 PRO B 28 26.245 29.097 7.445 1.00 16.78 H new ATOM 0 HG2 PRO B 28 26.607 31.812 7.913 1.00 19.84 H new ATOM 0 HG3 PRO B 28 25.136 31.161 7.219 1.00 19.84 H new ATOM 0 HD2 PRO B 28 25.610 32.165 10.012 1.00 17.18 H new ATOM 0 HD3 PRO B 28 24.112 32.118 9.103 1.00 17.18 H new ATOM 1544 N LEU B 29 26.635 29.174 11.545 1.00 13.35 N ATOM 1545 CA LEU B 29 27.413 28.550 12.654 1.00 12.43 C ATOM 1546 C LEU B 29 26.446 27.859 13.615 1.00 12.94 C ATOM 1547 O LEU B 29 26.557 26.675 13.865 1.00 13.87 O ATOM 1548 CB LEU B 29 28.218 29.623 13.390 1.00 15.82 C ATOM 1549 CG LEU B 29 28.996 30.466 12.376 1.00 12.60 C ATOM 1550 CD1 LEU B 29 29.932 31.412 13.131 1.00 13.73 C ATOM 1551 CD2 LEU B 29 29.818 29.545 11.455 1.00 13.81 C ATOM 0 H LEU B 29 26.496 30.182 11.620 1.00 13.35 H new ATOM 0 HA LEU B 29 28.107 27.813 12.250 1.00 12.43 H new ATOM 0 HB2 LEU B 29 27.550 30.259 13.971 1.00 15.82 H new ATOM 0 HB3 LEU B 29 28.906 29.156 14.095 1.00 15.82 H new ATOM 0 HG LEU B 29 28.301 31.044 11.768 1.00 12.60 H new ATOM 0 HD11 LEU B 29 30.491 32.017 12.417 1.00 13.73 H new ATOM 0 HD12 LEU B 29 29.346 32.064 13.779 1.00 13.73 H new ATOM 0 HD13 LEU B 29 30.627 30.830 13.736 1.00 13.73 H new ATOM 0 HD21 LEU B 29 30.370 30.149 10.735 1.00 13.81 H new ATOM 0 HD22 LEU B 29 30.519 28.963 12.054 1.00 13.81 H new ATOM 0 HD23 LEU B 29 29.148 28.870 10.923 1.00 13.81 H new ATOM 1563 N MET B 30 25.479 28.567 14.140 1.00 13.14 N ATOM 1564 CA MET B 30 24.507 27.908 15.054 1.00 14.92 C ATOM 1565 C MET B 30 23.959 26.676 14.342 1.00 15.06 C ATOM 1566 O MET B 30 23.637 25.673 14.948 1.00 14.78 O ATOM 1567 CB MET B 30 23.346 28.859 15.355 1.00 14.70 C ATOM 1568 CG MET B 30 23.832 30.050 16.178 1.00 10.57 C ATOM 1569 SD MET B 30 24.420 29.478 17.796 1.00 7.09 S ATOM 1570 CE MET B 30 26.178 29.831 17.558 1.00 13.40 C ATOM 0 H MET B 30 25.324 29.562 13.976 1.00 13.14 H new ATOM 0 HA MET B 30 24.998 27.637 15.989 1.00 14.92 H new ATOM 0 HB2 MET B 30 22.904 29.210 14.422 1.00 14.70 H new ATOM 0 HB3 MET B 30 22.564 28.328 15.899 1.00 14.70 H new ATOM 0 HG2 MET B 30 24.635 30.565 15.650 1.00 10.57 H new ATOM 0 HG3 MET B 30 23.023 30.769 16.308 1.00 10.57 H new ATOM 0 HE1 MET B 30 26.718 29.631 18.484 1.00 13.40 H new ATOM 0 HE2 MET B 30 26.572 29.197 16.764 1.00 13.40 H new ATOM 0 HE3 MET B 30 26.305 30.878 17.283 1.00 13.40 H new ATOM 1580 N TYR B 31 23.854 26.762 13.046 1.00 13.82 N ATOM 1581 CA TYR B 31 23.330 25.621 12.253 1.00 14.24 C ATOM 1582 C TYR B 31 24.262 24.408 12.397 1.00 15.20 C ATOM 1583 O TYR B 31 23.852 23.346 12.820 1.00 15.23 O ATOM 1584 CB TYR B 31 23.241 26.033 10.781 1.00 15.18 C ATOM 1585 CG TYR B 31 22.874 24.835 9.938 1.00 19.70 C ATOM 1586 CD1 TYR B 31 23.878 23.969 9.487 1.00 21.03 C ATOM 1587 CD2 TYR B 31 21.536 24.589 9.606 1.00 22.09 C ATOM 1588 CE1 TYR B 31 23.548 22.861 8.707 1.00 22.51 C ATOM 1589 CE2 TYR B 31 21.206 23.476 8.827 1.00 25.56 C ATOM 1590 CZ TYR B 31 22.211 22.612 8.375 1.00 25.00 C ATOM 1591 OH TYR B 31 21.884 21.516 7.603 1.00 30.46 O ATOM 0 H TYR B 31 24.112 27.583 12.499 1.00 13.82 H new ATOM 0 HA TYR B 31 22.340 25.349 12.619 1.00 14.24 H new ATOM 0 HB2 TYR B 31 22.495 26.819 10.658 1.00 15.18 H new ATOM 0 HB3 TYR B 31 24.195 26.444 10.450 1.00 15.18 H new ATOM 0 HD1 TYR B 31 24.910 24.160 9.744 1.00 21.03 H new ATOM 0 HD2 TYR B 31 20.761 25.257 9.951 1.00 22.09 H new ATOM 0 HE1 TYR B 31 24.324 22.195 8.359 1.00 22.51 H new ATOM 0 HE2 TYR B 31 20.174 23.282 8.573 1.00 25.56 H new ATOM 0 HH TYR B 31 20.914 21.490 7.467 1.00 30.46 H new ATOM 1601 N VAL B 32 25.509 24.555 12.033 1.00 14.03 N ATOM 1602 CA VAL B 32 26.461 23.407 12.132 1.00 12.14 C ATOM 1603 C VAL B 32 26.502 22.874 13.564 1.00 12.91 C ATOM 1604 O VAL B 32 26.321 21.695 13.800 1.00 14.47 O ATOM 1605 CB VAL B 32 27.864 23.864 11.719 1.00 12.64 C ATOM 1606 CG1 VAL B 32 28.812 22.670 11.754 1.00 12.95 C ATOM 1607 CG2 VAL B 32 27.822 24.438 10.300 1.00 14.27 C ATOM 0 H VAL B 32 25.910 25.420 11.671 1.00 14.03 H new ATOM 0 HA VAL B 32 26.123 22.613 11.467 1.00 12.14 H new ATOM 0 HB VAL B 32 28.214 24.632 12.409 1.00 12.64 H new ATOM 0 HG11 VAL B 32 29.812 22.990 11.461 1.00 12.95 H new ATOM 0 HG12 VAL B 32 28.844 22.260 12.764 1.00 12.95 H new ATOM 0 HG13 VAL B 32 28.459 21.905 11.063 1.00 12.95 H new ATOM 0 HG21 VAL B 32 28.821 24.762 10.009 1.00 14.27 H new ATOM 0 HG22 VAL B 32 27.473 23.672 9.608 1.00 14.27 H new ATOM 0 HG23 VAL B 32 27.142 25.289 10.272 1.00 14.27 H new ATOM 1617 N ILE B 33 26.744 23.728 14.521 1.00 13.72 N ATOM 1618 CA ILE B 33 26.804 23.281 15.943 1.00 9.81 C ATOM 1619 C ILE B 33 25.653 22.306 16.238 1.00 12.06 C ATOM 1620 O ILE B 33 25.852 21.230 16.768 1.00 13.15 O ATOM 1621 CB ILE B 33 26.712 24.535 16.822 1.00 11.56 C ATOM 1622 CG1 ILE B 33 28.064 25.266 16.753 1.00 12.90 C ATOM 1623 CG2 ILE B 33 26.392 24.164 18.275 1.00 12.06 C ATOM 1624 CD1 ILE B 33 27.970 26.666 17.372 1.00 11.54 C ATOM 0 H ILE B 33 26.904 24.725 14.378 1.00 13.72 H new ATOM 0 HA ILE B 33 27.734 22.752 16.149 1.00 9.81 H new ATOM 0 HB ILE B 33 25.909 25.177 16.459 1.00 11.56 H new ATOM 0 HG12 ILE B 33 28.822 24.684 17.277 1.00 12.90 H new ATOM 0 HG13 ILE B 33 28.385 25.346 15.714 1.00 12.90 H new ATOM 0 HG21 ILE B 33 26.332 25.071 18.877 1.00 12.06 H new ATOM 0 HG22 ILE B 33 25.438 23.638 18.315 1.00 12.06 H new ATOM 0 HG23 ILE B 33 27.178 23.519 18.667 1.00 12.06 H new ATOM 0 HD11 ILE B 33 28.941 27.158 17.309 1.00 11.54 H new ATOM 0 HD12 ILE B 33 27.229 27.254 16.831 1.00 11.54 H new ATOM 0 HD13 ILE B 33 27.673 26.582 18.418 1.00 11.54 H new ATOM 1636 N LEU B 34 24.462 22.675 15.884 1.00 13.55 N ATOM 1637 CA LEU B 34 23.275 21.795 16.109 1.00 16.27 C ATOM 1638 C LEU B 34 23.436 20.504 15.282 1.00 18.00 C ATOM 1639 O LEU B 34 23.065 19.431 15.715 1.00 20.35 O ATOM 1640 CB LEU B 34 22.022 22.598 15.639 1.00 15.33 C ATOM 1641 CG LEU B 34 21.064 23.134 16.782 1.00 18.88 C ATOM 1642 CD1 LEU B 34 21.580 22.931 18.213 1.00 18.63 C ATOM 1643 CD2 LEU B 34 20.821 24.640 16.579 1.00 18.04 C ATOM 0 H LEU B 34 24.249 23.567 15.438 1.00 13.55 H new ATOM 0 HA LEU B 34 23.173 21.513 17.157 1.00 16.27 H new ATOM 0 HB2 LEU B 34 22.362 23.450 15.050 1.00 15.33 H new ATOM 0 HB3 LEU B 34 21.438 21.963 14.973 1.00 15.33 H new ATOM 0 HG LEU B 34 20.153 22.543 16.690 1.00 18.88 H new ATOM 0 HD11 LEU B 34 20.854 23.330 18.922 1.00 18.63 H new ATOM 0 HD12 LEU B 34 21.723 21.867 18.401 1.00 18.63 H new ATOM 0 HD13 LEU B 34 22.530 23.451 18.334 1.00 18.63 H new ATOM 0 HD21 LEU B 34 20.162 25.011 17.364 1.00 18.04 H new ATOM 0 HD22 LEU B 34 21.772 25.171 16.622 1.00 18.04 H new ATOM 0 HD23 LEU B 34 20.356 24.806 15.607 1.00 18.04 H new ATOM 1655 N LYS B 35 23.977 20.601 14.102 1.00 16.90 N ATOM 1656 CA LYS B 35 24.152 19.380 13.252 1.00 19.51 C ATOM 1657 C LYS B 35 24.977 18.347 14.006 1.00 18.97 C ATOM 1658 O LYS B 35 24.847 17.156 13.801 1.00 18.29 O ATOM 1659 CB LYS B 35 24.879 19.762 11.957 1.00 23.32 C ATOM 1660 CG LYS B 35 24.787 18.608 10.957 1.00 27.46 C ATOM 1661 CD LYS B 35 25.431 19.025 9.632 1.00 30.03 C ATOM 1662 CE LYS B 35 25.025 18.041 8.534 1.00 33.24 C ATOM 1663 NZ LYS B 35 25.890 18.245 7.337 1.00 34.14 N ATOM 0 H LYS B 35 24.308 21.471 13.684 1.00 16.90 H new ATOM 0 HA LYS B 35 23.174 18.961 13.015 1.00 19.51 H new ATOM 0 HB2 LYS B 35 24.435 20.662 11.531 1.00 23.32 H new ATOM 0 HB3 LYS B 35 25.924 19.991 12.168 1.00 23.32 H new ATOM 0 HG2 LYS B 35 25.289 17.727 11.356 1.00 27.46 H new ATOM 0 HG3 LYS B 35 23.744 18.335 10.796 1.00 27.46 H new ATOM 0 HD2 LYS B 35 25.117 20.034 9.365 1.00 30.03 H new ATOM 0 HD3 LYS B 35 26.516 19.045 9.734 1.00 30.03 H new ATOM 0 HE2 LYS B 35 25.121 17.017 8.895 1.00 33.24 H new ATOM 0 HE3 LYS B 35 23.978 18.188 8.268 1.00 33.24 H new ATOM 0 HZ1 LYS B 35 25.613 17.576 6.591 1.00 34.14 H new ATOM 0 HZ2 LYS B 35 25.777 19.218 6.989 1.00 34.14 H new ATOM 0 HZ3 LYS B 35 26.884 18.084 7.596 1.00 34.14 H new ATOM 1677 N ASP B 36 25.833 18.797 14.868 1.00 17.40 N ATOM 1678 CA ASP B 36 26.690 17.862 15.638 1.00 17.99 C ATOM 1679 C ASP B 36 25.976 17.419 16.913 1.00 20.53 C ATOM 1680 O ASP B 36 25.976 16.257 17.271 1.00 21.50 O ATOM 1681 CB ASP B 36 27.970 18.598 16.000 1.00 17.75 C ATOM 1682 CG ASP B 36 28.490 19.318 14.753 1.00 19.30 C ATOM 1683 OD1 ASP B 36 28.683 18.654 13.748 1.00 18.21 O ATOM 1684 OD2 ASP B 36 28.687 20.520 14.825 1.00 17.31 O ATOM 0 H ASP B 36 25.979 19.785 15.076 1.00 17.40 H new ATOM 0 HA ASP B 36 26.908 16.976 15.042 1.00 17.99 H new ATOM 0 HB2 ASP B 36 27.781 19.315 16.799 1.00 17.75 H new ATOM 0 HB3 ASP B 36 28.717 17.897 16.371 1.00 17.75 H new ATOM 1689 N ALA B 37 25.390 18.345 17.611 1.00 17.76 N ATOM 1690 CA ALA B 37 24.694 18.006 18.881 1.00 20.31 C ATOM 1691 C ALA B 37 23.317 17.421 18.595 1.00 21.98 C ATOM 1692 O ALA B 37 22.371 17.666 19.318 1.00 20.93 O ATOM 1693 CB ALA B 37 24.538 19.278 19.699 1.00 16.79 C ATOM 0 H ALA B 37 25.362 19.332 17.355 1.00 17.76 H new ATOM 0 HA ALA B 37 25.279 17.267 19.428 1.00 20.31 H new ATOM 0 HB1 ALA B 37 24.029 19.048 20.635 1.00 16.79 H new ATOM 0 HB2 ALA B 37 25.522 19.695 19.914 1.00 16.79 H new ATOM 0 HB3 ALA B 37 23.951 20.003 19.135 1.00 16.79 H new ATOM 1699 N ASP B 38 23.183 16.659 17.556 1.00 22.08 N ATOM 1700 CA ASP B 38 21.853 16.081 17.252 1.00 24.70 C ATOM 1701 C ASP B 38 20.835 17.220 17.166 1.00 27.43 C ATOM 1702 O ASP B 38 19.640 17.007 17.187 1.00 26.89 O ATOM 1703 CB ASP B 38 21.461 15.108 18.372 1.00 26.17 C ATOM 1704 CG ASP B 38 20.411 14.119 17.858 1.00 26.41 C ATOM 1705 OD1 ASP B 38 20.766 13.273 17.054 1.00 30.65 O ATOM 1706 OD2 ASP B 38 19.270 14.226 18.277 1.00 29.79 O ATOM 0 H ASP B 38 23.930 16.412 16.907 1.00 22.08 H new ATOM 0 HA ASP B 38 21.878 15.542 16.305 1.00 24.70 H new ATOM 0 HB2 ASP B 38 22.341 14.569 18.722 1.00 26.17 H new ATOM 0 HB3 ASP B 38 21.066 15.661 19.224 1.00 26.17 H new ATOM 1711 N ALA B 39 21.316 18.430 17.069 1.00 25.83 N ATOM 1712 CA ALA B 39 20.410 19.604 16.980 1.00 28.40 C ATOM 1713 C ALA B 39 19.773 19.878 18.349 1.00 30.32 C ATOM 1714 O ALA B 39 18.820 20.624 18.461 1.00 32.55 O ATOM 1715 CB ALA B 39 19.332 19.334 15.926 1.00 28.82 C ATOM 0 H ALA B 39 22.311 18.654 17.048 1.00 25.83 H new ATOM 0 HA ALA B 39 20.979 20.485 16.685 1.00 28.40 H new ATOM 0 HB1 ALA B 39 18.666 20.194 15.859 1.00 28.82 H new ATOM 0 HB2 ALA B 39 19.804 19.164 14.958 1.00 28.82 H new ATOM 0 HB3 ALA B 39 18.758 18.452 16.210 1.00 28.82 H new ATOM 1721 N ASN B 40 20.298 19.289 19.391 1.00 29.50 N ATOM 1722 CA ASN B 40 19.730 19.525 20.753 1.00 32.01 C ATOM 1723 C ASN B 40 20.408 20.751 21.371 1.00 32.47 C ATOM 1724 O ASN B 40 21.546 20.697 21.791 1.00 29.40 O ATOM 1725 CB ASN B 40 19.986 18.299 21.633 1.00 33.06 C ATOM 1726 CG ASN B 40 19.020 17.178 21.243 1.00 33.55 C ATOM 1727 OD1 ASN B 40 18.873 16.864 20.078 1.00 35.11 O ATOM 1728 ND2 ASN B 40 18.351 16.557 22.175 1.00 33.85 N ATOM 0 H ASN B 40 21.096 18.654 19.359 1.00 29.50 H new ATOM 0 HA ASN B 40 18.656 19.697 20.680 1.00 32.01 H new ATOM 0 HB2 ASN B 40 21.016 17.963 21.515 1.00 33.06 H new ATOM 0 HB3 ASN B 40 19.853 18.558 22.683 1.00 33.06 H new ATOM 0 HD21 ASN B 40 17.705 15.808 21.926 1.00 33.85 H new ATOM 0 HD22 ASN B 40 18.474 16.820 23.153 1.00 33.85 H new ATOM 1735 N ILE B 41 19.719 21.858 21.420 1.00 33.58 N ATOM 1736 CA ILE B 41 20.322 23.093 21.997 1.00 35.14 C ATOM 1737 C ILE B 41 20.961 22.780 23.350 1.00 34.57 C ATOM 1738 O ILE B 41 22.130 23.033 23.559 1.00 33.97 O ATOM 1739 CB ILE B 41 19.226 24.165 22.153 1.00 38.72 C ATOM 1740 CG1 ILE B 41 18.857 24.665 20.735 1.00 39.13 C ATOM 1741 CG2 ILE B 41 19.711 25.334 23.071 1.00 40.27 C ATOM 1742 CD1 ILE B 41 17.848 25.828 20.771 1.00 40.55 C ATOM 0 H ILE B 41 18.761 21.961 21.084 1.00 33.58 H new ATOM 0 HA ILE B 41 21.098 23.469 21.330 1.00 35.14 H new ATOM 0 HB ILE B 41 18.345 23.743 22.637 1.00 38.72 H new ATOM 0 HG12 ILE B 41 19.761 24.987 20.219 1.00 39.13 H new ATOM 0 HG13 ILE B 41 18.437 23.840 20.159 1.00 39.13 H new ATOM 0 HG21 ILE B 41 18.918 26.076 23.164 1.00 40.27 H new ATOM 0 HG22 ILE B 41 19.959 24.943 24.058 1.00 40.27 H new ATOM 0 HG23 ILE B 41 20.594 25.799 22.632 1.00 40.27 H new ATOM 0 HD11 ILE B 41 17.620 26.144 19.753 1.00 40.55 H new ATOM 0 HD12 ILE B 41 16.932 25.500 21.262 1.00 40.55 H new ATOM 0 HD13 ILE B 41 18.276 26.664 21.323 1.00 40.55 H new ATOM 1754 N GLU B 42 20.213 22.248 24.274 1.00 35.46 N ATOM 1755 CA GLU B 42 20.796 21.941 25.611 1.00 34.62 C ATOM 1756 C GLU B 42 22.142 21.236 25.437 1.00 31.10 C ATOM 1757 O GLU B 42 23.106 21.546 26.107 1.00 29.48 O ATOM 1758 CB GLU B 42 19.839 21.035 26.387 1.00 40.18 C ATOM 1759 CG GLU B 42 18.473 21.715 26.497 1.00 46.15 C ATOM 1760 CD GLU B 42 17.479 20.758 27.157 1.00 50.80 C ATOM 1761 OE1 GLU B 42 17.921 19.890 27.891 1.00 52.61 O ATOM 1762 OE2 GLU B 42 16.292 20.910 26.918 1.00 53.92 O ATOM 0 H GLU B 42 19.227 22.013 24.164 1.00 35.46 H new ATOM 0 HA GLU B 42 20.946 22.869 26.162 1.00 34.62 H new ATOM 0 HB2 GLU B 42 19.740 20.074 25.882 1.00 40.18 H new ATOM 0 HB3 GLU B 42 20.238 20.832 27.381 1.00 40.18 H new ATOM 0 HG2 GLU B 42 18.557 22.630 27.083 1.00 46.15 H new ATOM 0 HG3 GLU B 42 18.117 22.001 25.507 1.00 46.15 H new ATOM 1769 N GLU B 43 22.217 20.298 24.536 1.00 26.75 N ATOM 1770 CA GLU B 43 23.504 19.580 24.315 1.00 25.31 C ATOM 1771 C GLU B 43 24.423 20.440 23.443 1.00 22.10 C ATOM 1772 O GLU B 43 25.622 20.463 23.629 1.00 21.22 O ATOM 1773 CB GLU B 43 23.232 18.246 23.613 1.00 24.85 C ATOM 1774 CG GLU B 43 24.459 17.340 23.740 1.00 27.31 C ATOM 1775 CD GLU B 43 24.589 16.855 25.185 1.00 29.91 C ATOM 1776 OE1 GLU B 43 23.639 17.021 25.932 1.00 28.72 O ATOM 1777 OE2 GLU B 43 25.636 16.326 25.519 1.00 30.00 O ATOM 0 H GLU B 43 21.444 19.997 23.943 1.00 26.75 H new ATOM 0 HA GLU B 43 23.985 19.392 25.275 1.00 25.31 H new ATOM 0 HB2 GLU B 43 22.362 17.761 24.056 1.00 24.85 H new ATOM 0 HB3 GLU B 43 23.001 18.417 22.562 1.00 24.85 H new ATOM 0 HG2 GLU B 43 24.366 16.488 23.066 1.00 27.31 H new ATOM 0 HG3 GLU B 43 25.357 17.883 23.445 1.00 27.31 H new ATOM 1784 N ALA B 44 23.872 21.148 22.493 1.00 21.46 N ATOM 1785 CA ALA B 44 24.725 22.002 21.619 1.00 22.00 C ATOM 1786 C ALA B 44 25.239 23.195 22.430 1.00 21.74 C ATOM 1787 O ALA B 44 26.355 23.641 22.257 1.00 19.07 O ATOM 1788 CB ALA B 44 23.906 22.473 20.396 1.00 22.06 C ATOM 0 H ALA B 44 22.874 21.172 22.286 1.00 21.46 H new ATOM 0 HA ALA B 44 25.581 21.432 21.257 1.00 22.00 H new ATOM 0 HB1 ALA B 44 24.531 23.097 19.758 1.00 22.06 H new ATOM 0 HB2 ALA B 44 23.564 21.606 19.832 1.00 22.06 H new ATOM 0 HB3 ALA B 44 23.045 23.049 20.735 1.00 22.06 H new ATOM 1794 N SER B 45 24.435 23.707 23.315 1.00 21.72 N ATOM 1795 CA SER B 45 24.875 24.864 24.141 1.00 24.00 C ATOM 1796 C SER B 45 26.076 24.458 24.994 1.00 24.30 C ATOM 1797 O SER B 45 27.066 25.159 25.066 1.00 23.27 O ATOM 1798 CB SER B 45 23.728 25.298 25.052 1.00 25.03 C ATOM 1799 OG SER B 45 23.676 24.441 26.188 1.00 28.51 O ATOM 0 H SER B 45 23.489 23.374 23.503 1.00 21.72 H new ATOM 0 HA SER B 45 25.158 25.690 23.489 1.00 24.00 H new ATOM 0 HB2 SER B 45 23.871 26.331 25.368 1.00 25.03 H new ATOM 0 HB3 SER B 45 22.783 25.259 24.510 1.00 25.03 H new ATOM 0 HG SER B 45 23.421 23.538 25.905 1.00 28.51 H new ATOM 1805 N ARG B 46 25.996 23.332 25.648 1.00 26.45 N ATOM 1806 CA ARG B 46 27.129 22.885 26.504 1.00 27.79 C ATOM 1807 C ARG B 46 28.444 23.000 25.727 1.00 26.86 C ATOM 1808 O ARG B 46 29.469 23.354 26.274 1.00 25.99 O ATOM 1809 CB ARG B 46 26.901 21.431 26.930 1.00 31.64 C ATOM 1810 CG ARG B 46 25.837 21.377 28.040 1.00 39.02 C ATOM 1811 CD ARG B 46 25.700 19.940 28.585 1.00 43.92 C ATOM 1812 NE ARG B 46 24.617 19.203 27.848 1.00 48.12 N ATOM 1813 CZ ARG B 46 23.379 19.621 27.841 1.00 50.42 C ATOM 1814 NH1 ARG B 46 23.024 20.648 28.565 1.00 52.31 N ATOM 1815 NH2 ARG B 46 22.486 18.990 27.129 1.00 52.39 N ATOM 0 H ARG B 46 25.194 22.702 25.626 1.00 26.45 H new ATOM 0 HA ARG B 46 27.186 23.517 27.390 1.00 27.79 H new ATOM 0 HB2 ARG B 46 26.578 20.838 26.075 1.00 31.64 H new ATOM 0 HB3 ARG B 46 27.835 20.996 27.286 1.00 31.64 H new ATOM 0 HG2 ARG B 46 26.111 22.055 28.849 1.00 39.02 H new ATOM 0 HG3 ARG B 46 24.878 21.718 27.650 1.00 39.02 H new ATOM 0 HD2 ARG B 46 26.647 19.411 28.477 1.00 43.92 H new ATOM 0 HD3 ARG B 46 25.470 19.968 29.650 1.00 43.92 H new ATOM 0 HE ARG B 46 24.855 18.352 27.339 1.00 48.12 H new ATOM 0 HH11 ARG B 46 23.715 21.129 29.141 1.00 52.31 H new ATOM 0 HH12 ARG B 46 22.056 20.969 28.555 1.00 52.31 H new ATOM 0 HH21 ARG B 46 22.755 18.173 26.580 1.00 52.39 H new ATOM 0 HH22 ARG B 46 21.519 19.313 27.121 1.00 52.39 H new ATOM 1829 N ARG B 47 28.424 22.708 24.457 1.00 22.86 N ATOM 1830 CA ARG B 47 29.676 22.808 23.653 1.00 20.88 C ATOM 1831 C ARG B 47 30.077 24.275 23.534 1.00 18.23 C ATOM 1832 O ARG B 47 31.138 24.676 23.971 1.00 21.17 O ATOM 1833 CB ARG B 47 29.437 22.221 22.262 1.00 19.97 C ATOM 1834 CG ARG B 47 28.738 20.865 22.402 1.00 21.43 C ATOM 1835 CD ARG B 47 28.513 20.239 21.021 1.00 22.98 C ATOM 1836 NE ARG B 47 28.416 18.760 21.172 1.00 20.54 N ATOM 1837 CZ ARG B 47 27.976 18.034 20.186 1.00 24.59 C ATOM 1838 NH1 ARG B 47 27.658 18.599 19.057 1.00 24.12 N ATOM 1839 NH2 ARG B 47 27.858 16.743 20.327 1.00 16.51 N ATOM 0 H ARG B 47 27.598 22.405 23.941 1.00 22.86 H new ATOM 0 HA ARG B 47 30.475 22.251 24.142 1.00 20.88 H new ATOM 0 HB2 ARG B 47 28.825 22.900 21.668 1.00 19.97 H new ATOM 0 HB3 ARG B 47 30.384 22.103 21.736 1.00 19.97 H new ATOM 0 HG2 ARG B 47 29.342 20.198 23.017 1.00 21.43 H new ATOM 0 HG3 ARG B 47 27.783 20.991 22.912 1.00 21.43 H new ATOM 0 HD2 ARG B 47 27.601 20.633 20.573 1.00 22.98 H new ATOM 0 HD3 ARG B 47 29.334 20.497 20.352 1.00 22.98 H new ATOM 0 HE ARG B 47 28.694 18.317 22.048 1.00 20.54 H new ATOM 0 HH11 ARG B 47 27.754 19.608 18.947 1.00 24.12 H new ATOM 0 HH12 ARG B 47 27.313 18.032 18.282 1.00 24.12 H new ATOM 0 HH21 ARG B 47 28.111 16.301 21.211 1.00 16.51 H new ATOM 0 HH22 ARG B 47 27.513 16.175 19.553 1.00 16.51 H new ATOM 1853 N ILE B 48 29.223 25.084 22.969 1.00 16.11 N ATOM 1854 CA ILE B 48 29.529 26.540 22.844 1.00 18.86 C ATOM 1855 C ILE B 48 30.047 27.035 24.184 1.00 23.26 C ATOM 1856 O ILE B 48 31.122 27.587 24.294 1.00 21.90 O ATOM 1857 CB ILE B 48 28.246 27.280 22.488 1.00 18.65 C ATOM 1858 CG1 ILE B 48 27.655 26.624 21.242 1.00 19.26 C ATOM 1859 CG2 ILE B 48 28.565 28.753 22.215 1.00 21.02 C ATOM 1860 CD1 ILE B 48 26.449 27.422 20.733 1.00 15.25 C ATOM 0 H ILE B 48 28.322 24.799 22.586 1.00 16.11 H new ATOM 0 HA ILE B 48 30.276 26.713 22.070 1.00 18.86 H new ATOM 0 HB ILE B 48 27.530 27.230 23.308 1.00 18.65 H new ATOM 0 HG12 ILE B 48 28.414 26.564 20.462 1.00 19.26 H new ATOM 0 HG13 ILE B 48 27.352 25.603 21.471 1.00 19.26 H new ATOM 0 HG21 ILE B 48 27.647 29.283 21.960 1.00 21.02 H new ATOM 0 HG22 ILE B 48 29.007 29.201 23.105 1.00 21.02 H new ATOM 0 HG23 ILE B 48 29.268 28.825 21.385 1.00 21.02 H new ATOM 0 HD11 ILE B 48 26.042 26.939 19.845 1.00 15.25 H new ATOM 0 HD12 ILE B 48 25.684 27.460 21.509 1.00 15.25 H new ATOM 0 HD13 ILE B 48 26.763 28.436 20.483 1.00 15.25 H new ATOM 1872 N GLU B 49 29.283 26.807 25.206 1.00 24.41 N ATOM 1873 CA GLU B 49 29.694 27.224 26.572 1.00 29.72 C ATOM 1874 C GLU B 49 31.146 26.844 26.807 1.00 31.01 C ATOM 1875 O GLU B 49 31.999 27.685 27.011 1.00 30.32 O ATOM 1876 CB GLU B 49 28.861 26.444 27.570 1.00 30.86 C ATOM 1877 CG GLU B 49 27.448 27.026 27.660 1.00 35.37 C ATOM 1878 CD GLU B 49 26.733 26.444 28.881 1.00 37.77 C ATOM 1879 OE1 GLU B 49 27.065 25.334 29.264 1.00 38.92 O ATOM 1880 OE2 GLU B 49 25.867 27.119 29.412 1.00 38.78 O ATOM 0 H GLU B 49 28.376 26.342 25.155 1.00 24.41 H new ATOM 0 HA GLU B 49 29.560 28.300 26.681 1.00 29.72 H new ATOM 0 HB2 GLU B 49 28.811 25.397 27.271 1.00 30.86 H new ATOM 0 HB3 GLU B 49 29.336 26.473 28.551 1.00 30.86 H new ATOM 0 HG2 GLU B 49 27.495 28.112 27.736 1.00 35.37 H new ATOM 0 HG3 GLU B 49 26.889 26.794 26.753 1.00 35.37 H new ATOM 1887 N GLU B 50 31.431 25.567 26.764 1.00 31.22 N ATOM 1888 CA GLU B 50 32.828 25.112 26.965 1.00 30.52 C ATOM 1889 C GLU B 50 33.684 25.950 26.043 1.00 30.97 C ATOM 1890 O GLU B 50 34.704 26.449 26.414 1.00 30.11 O ATOM 1891 CB GLU B 50 32.932 23.616 26.603 1.00 33.65 C ATOM 1892 CG GLU B 50 34.069 22.954 27.391 1.00 34.45 C ATOM 1893 CD GLU B 50 34.061 21.446 27.128 1.00 36.26 C ATOM 1894 OE1 GLU B 50 33.170 20.782 27.632 1.00 36.07 O ATOM 1895 OE2 GLU B 50 34.946 20.982 26.429 1.00 35.94 O ATOM 0 H GLU B 50 30.752 24.824 26.598 1.00 31.22 H new ATOM 0 HA GLU B 50 33.153 25.227 27.999 1.00 30.52 H new ATOM 0 HB2 GLU B 50 31.989 23.116 26.823 1.00 33.65 H new ATOM 0 HB3 GLU B 50 33.110 23.505 25.533 1.00 33.65 H new ATOM 0 HG2 GLU B 50 35.027 23.381 27.095 1.00 34.45 H new ATOM 0 HG3 GLU B 50 33.949 23.149 28.457 1.00 34.45 H new ATOM 1902 N GLY B 51 33.210 26.140 24.856 1.00 0.00 N ATOM 1903 CA GLY B 51 33.931 26.973 23.862 1.00 0.00 C ATOM 1904 C GLY B 51 34.177 28.379 24.427 1.00 0.00 C ATOM 1905 O GLY B 51 35.291 28.841 24.557 1.00 0.00 O ATOM 0 H GLY B 51 32.331 25.745 24.521 1.00 0.00 H new ATOM 0 HA2 GLY B 51 34.881 26.505 23.605 1.00 0.00 H new ATOM 0 HA3 GLY B 51 33.350 27.039 22.942 1.00 0.00 H new ATOM 1909 N GLN B 52 33.122 29.074 24.745 1.00 30.19 N ATOM 1910 CA GLN B 52 33.265 30.456 25.290 1.00 33.26 C ATOM 1911 C GLN B 52 34.278 30.417 26.420 1.00 34.21 C ATOM 1912 O GLN B 52 35.224 31.178 26.465 1.00 33.27 O ATOM 1913 CB GLN B 52 31.921 30.932 25.847 1.00 34.36 C ATOM 1914 CG GLN B 52 30.805 30.744 24.797 1.00 37.06 C ATOM 1915 CD GLN B 52 30.657 32.003 23.940 1.00 39.18 C ATOM 1916 OE1 GLN B 52 31.632 32.638 23.590 1.00 39.82 O ATOM 1917 NE2 GLN B 52 29.462 32.387 23.587 1.00 40.80 N ATOM 0 H GLN B 52 32.161 28.745 24.651 1.00 30.19 H new ATOM 0 HA GLN B 52 33.590 31.135 24.502 1.00 33.26 H new ATOM 0 HB2 GLN B 52 31.677 30.373 26.751 1.00 34.36 H new ATOM 0 HB3 GLN B 52 31.989 31.982 26.130 1.00 34.36 H new ATOM 0 HG2 GLN B 52 31.036 29.889 24.161 1.00 37.06 H new ATOM 0 HG3 GLN B 52 29.861 30.524 25.296 1.00 37.06 H new ATOM 0 HE21 GLN B 52 28.646 31.851 23.883 1.00 40.80 H new ATOM 0 HE22 GLN B 52 29.343 33.223 23.015 1.00 40.80 H new ATOM 1926 N TYR B 53 34.083 29.507 27.320 1.00 35.76 N ATOM 1927 CA TYR B 53 35.022 29.360 28.455 1.00 38.60 C ATOM 1928 C TYR B 53 36.370 28.923 27.893 1.00 39.68 C ATOM 1929 O TYR B 53 37.406 29.457 28.221 1.00 39.52 O ATOM 1930 CB TYR B 53 34.479 28.281 29.404 1.00 40.83 C ATOM 1931 CG TYR B 53 35.594 27.736 30.267 1.00 43.21 C ATOM 1932 CD1 TYR B 53 36.451 26.754 29.766 1.00 44.13 C ATOM 1933 CD2 TYR B 53 35.766 28.220 31.558 1.00 43.89 C ATOM 1934 CE1 TYR B 53 37.481 26.255 30.558 1.00 47.20 C ATOM 1935 CE2 TYR B 53 36.800 27.723 32.362 1.00 46.12 C ATOM 1936 CZ TYR B 53 37.659 26.738 31.860 1.00 46.20 C ATOM 1937 OH TYR B 53 38.679 26.244 32.648 1.00 48.95 O ATOM 0 H TYR B 53 33.303 28.850 27.319 1.00 35.76 H new ATOM 0 HA TYR B 53 35.131 30.297 29.000 1.00 38.60 H new ATOM 0 HB2 TYR B 53 33.694 28.701 30.033 1.00 40.83 H new ATOM 0 HB3 TYR B 53 34.027 27.473 28.828 1.00 40.83 H new ATOM 0 HD1 TYR B 53 36.314 26.381 28.762 1.00 44.13 H new ATOM 0 HD2 TYR B 53 35.102 28.980 31.942 1.00 43.89 H new ATOM 0 HE1 TYR B 53 38.143 25.496 30.168 1.00 47.20 H new ATOM 0 HE2 TYR B 53 36.934 28.098 33.366 1.00 46.12 H new ATOM 0 HH TYR B 53 39.265 25.676 32.106 1.00 48.95 H new ATOM 1947 N VAL B 54 36.341 27.943 27.047 1.00 39.35 N ATOM 1948 CA VAL B 54 37.586 27.419 26.435 1.00 40.00 C ATOM 1949 C VAL B 54 38.381 28.600 25.866 1.00 40.47 C ATOM 1950 O VAL B 54 39.482 28.891 26.287 1.00 39.23 O ATOM 1951 CB VAL B 54 37.143 26.466 25.321 1.00 40.33 C ATOM 1952 CG1 VAL B 54 38.196 26.324 24.248 1.00 40.58 C ATOM 1953 CG2 VAL B 54 36.757 25.068 25.878 1.00 39.92 C ATOM 0 H VAL B 54 35.488 27.471 26.746 1.00 39.35 H new ATOM 0 HA VAL B 54 38.222 26.897 27.150 1.00 40.00 H new ATOM 0 HB VAL B 54 36.257 26.912 24.870 1.00 40.33 H new ATOM 0 HG11 VAL B 54 37.841 25.639 23.478 1.00 40.58 H new ATOM 0 HG12 VAL B 54 38.396 27.299 23.803 1.00 40.58 H new ATOM 0 HG13 VAL B 54 39.113 25.931 24.688 1.00 40.58 H new ATOM 0 HG21 VAL B 54 36.449 24.422 25.056 1.00 39.92 H new ATOM 0 HG22 VAL B 54 37.617 24.628 26.383 1.00 39.92 H new ATOM 0 HG23 VAL B 54 35.935 25.173 26.586 1.00 39.92 H new ATOM 1963 N VAL B 55 37.815 29.277 24.910 1.00 40.13 N ATOM 1964 CA VAL B 55 38.509 30.442 24.300 1.00 42.29 C ATOM 1965 C VAL B 55 38.843 31.449 25.402 1.00 43.82 C ATOM 1966 O VAL B 55 39.988 31.798 25.610 1.00 43.78 O ATOM 1967 CB VAL B 55 37.580 31.077 23.258 1.00 41.62 C ATOM 1968 CG1 VAL B 55 38.292 32.225 22.531 1.00 42.45 C ATOM 1969 CG2 VAL B 55 37.176 30.009 22.240 1.00 41.12 C ATOM 0 H VAL B 55 36.894 29.072 24.522 1.00 40.13 H new ATOM 0 HA VAL B 55 39.432 30.130 23.812 1.00 42.29 H new ATOM 0 HB VAL B 55 36.699 31.475 23.761 1.00 41.62 H new ATOM 0 HG11 VAL B 55 37.618 32.664 21.795 1.00 42.45 H new ATOM 0 HG12 VAL B 55 38.586 32.986 23.253 1.00 42.45 H new ATOM 0 HG13 VAL B 55 39.179 31.842 22.027 1.00 42.45 H new ATOM 0 HG21 VAL B 55 36.515 30.449 21.494 1.00 41.12 H new ATOM 0 HG22 VAL B 55 38.067 29.618 21.750 1.00 41.12 H new ATOM 0 HG23 VAL B 55 36.657 29.197 22.750 1.00 41.12 H new ATOM 1979 N ASN B 56 37.853 31.911 26.117 1.00 44.48 N ATOM 1980 CA ASN B 56 38.122 32.884 27.213 1.00 47.06 C ATOM 1981 C ASN B 56 39.242 32.332 28.097 1.00 47.69 C ATOM 1982 O ASN B 56 40.195 33.015 28.413 1.00 47.82 O ATOM 1983 CB ASN B 56 36.851 33.076 28.045 1.00 46.90 C ATOM 1984 CG ASN B 56 35.821 33.864 27.233 1.00 47.81 C ATOM 1985 OD1 ASN B 56 36.143 34.427 26.205 1.00 48.43 O ATOM 1986 ND2 ASN B 56 34.587 33.929 27.654 1.00 47.03 N ATOM 0 H ASN B 56 36.873 31.658 25.990 1.00 44.48 H new ATOM 0 HA ASN B 56 38.423 33.845 26.796 1.00 47.06 H new ATOM 0 HB2 ASN B 56 36.441 32.107 28.330 1.00 46.90 H new ATOM 0 HB3 ASN B 56 37.085 33.607 28.968 1.00 46.90 H new ATOM 0 HD21 ASN B 56 33.893 34.452 27.120 1.00 47.03 H new ATOM 0 HD22 ASN B 56 34.317 33.456 28.517 1.00 47.03 H new ATOM 1993 N GLU B 57 39.138 31.089 28.483 1.00 49.57 N ATOM 1994 CA GLU B 57 40.196 30.472 29.331 1.00 51.35 C ATOM 1995 C GLU B 57 41.546 30.642 28.636 1.00 52.18 C ATOM 1996 O GLU B 57 42.487 31.158 29.205 1.00 52.13 O ATOM 1997 CB GLU B 57 39.893 28.982 29.508 1.00 52.66 C ATOM 1998 CG GLU B 57 40.908 28.351 30.462 1.00 53.83 C ATOM 1999 CD GLU B 57 40.648 26.846 30.559 1.00 55.85 C ATOM 2000 OE1 GLU B 57 40.282 26.263 29.553 1.00 57.10 O ATOM 2001 OE2 GLU B 57 40.821 26.304 31.638 1.00 56.34 O ATOM 0 H GLU B 57 38.361 30.472 28.246 1.00 49.57 H new ATOM 0 HA GLU B 57 40.222 30.954 30.308 1.00 51.35 H new ATOM 0 HB2 GLU B 57 38.884 28.852 29.899 1.00 52.66 H new ATOM 0 HB3 GLU B 57 39.928 28.478 28.542 1.00 52.66 H new ATOM 0 HG2 GLU B 57 41.921 28.534 30.105 1.00 53.83 H new ATOM 0 HG3 GLU B 57 40.830 28.809 31.448 1.00 53.83 H new