USER MOD reduce.3.24.130724 H: found=0, std=0, add=840, rem=0, adj=20 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= -0.992 USER MOD Set 1.2: B 52 GLN : amide:sc= -0.491 X(o=-1.5,f=-1.6!) USER MOD Set 2.1: A 22 TYR OH : rot -49:sc= -1.85 USER MOD Set 2.2: A 52 GLN : amide:sc= -0.553 K(o=-2.4,f=-0.068) USER MOD Set 3.1: A 19 LYS NZ :NH3+ -113:sc= -3.51! (180deg=-6.79!) USER MOD Set 3.2: A 45 SER OG : rot -73:sc= -0.0395 USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 CYS SG : rot 71:sc= -0.91 USER MOD Single : A 14 GLN : amide:sc= -2.6! K(o=-2.6!,f=-0.81) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 MET CE :methyl -147:sc= -0.776 (180deg=-3.39!) USER MOD Single : A 30 MET CE :methyl 172:sc= -2.75 (180deg=-2.97!) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ -135:sc= -0.873 (180deg=-3.45!) USER MOD Single : A 40 ASN : amide:sc= -1.23 K(o=-1.2,f=-0.03) USER MOD Single : A 53 TYR OH : rot 11:sc= -0.314 USER MOD Single : A 56 ASN : amide:sc= -5.8! C(o=-5.8!,f=-3!) USER MOD Single : A 58 TYR OH : rot -115:sc= 0.201 USER MOD Single : B 12 TYR OH : rot 180:sc= 0 USER MOD Single : B 13 CYS SG : rot 72:sc= -1.52 USER MOD Single : B 14 GLN : amide:sc= -3.55 K(o=-3.5,f=-1.6) USER MOD Single : B 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.375) USER MOD Single : B 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 30 MET CE :methyl 175:sc= -2.96 (180deg=-3.12!) USER MOD Single : B 31 TYR OH : rot 180:sc= 0 USER MOD Single : B 35 LYS NZ :NH3+ 159:sc= -0.053 (180deg=-0.421) USER MOD Single : B 40 ASN : amide:sc= -0.0386 K(o=-0.039,f=-1.8!) USER MOD Single : B 45 SER OG : rot -59:sc= 0.0238 USER MOD Single : B 53 TYR OH : rot 11:sc= -0.0311 USER MOD Single : B 56 ASN : amide:sc= -1.93 K(o=-1.9,f=-4.9!) USER MOD ----------------------------------------------------------------- ATOM 106 N PHE A 9 44.283 22.541 18.096 1.00 44.59 N ATOM 107 CA PHE A 9 42.822 22.778 18.020 1.00 42.14 C ATOM 108 C PHE A 9 42.561 24.273 17.848 1.00 41.09 C ATOM 109 O PHE A 9 41.954 24.701 16.886 1.00 40.10 O ATOM 110 CB PHE A 9 42.165 22.273 19.315 1.00 39.48 C ATOM 111 CG PHE A 9 40.731 21.935 19.040 1.00 35.93 C ATOM 112 CD1 PHE A 9 39.771 22.945 19.069 1.00 33.89 C ATOM 113 CD2 PHE A 9 40.364 20.619 18.745 1.00 34.84 C ATOM 114 CE1 PHE A 9 38.441 22.641 18.804 1.00 31.72 C ATOM 115 CE2 PHE A 9 39.030 20.318 18.479 1.00 33.98 C ATOM 116 CZ PHE A 9 38.072 21.334 18.510 1.00 33.09 C ATOM 0 HA PHE A 9 42.400 22.244 17.169 1.00 42.14 H new ATOM 0 HB2 PHE A 9 42.693 21.395 19.687 1.00 39.48 H new ATOM 0 HB3 PHE A 9 42.229 23.036 20.091 1.00 39.48 H new ATOM 0 HD1 PHE A 9 40.060 23.961 19.297 1.00 33.89 H new ATOM 0 HD2 PHE A 9 41.111 19.839 18.723 1.00 34.84 H new ATOM 0 HE1 PHE A 9 37.694 23.421 18.827 1.00 31.72 H new ATOM 0 HE2 PHE A 9 38.738 19.304 18.250 1.00 33.98 H new ATOM 0 HZ PHE A 9 37.037 21.102 18.304 1.00 33.09 H new ATOM 126 N LEU A 10 43.025 25.070 18.765 1.00 40.61 N ATOM 127 CA LEU A 10 42.811 26.535 18.638 1.00 40.95 C ATOM 128 C LEU A 10 43.456 27.003 17.340 1.00 41.08 C ATOM 129 O LEU A 10 42.960 27.886 16.670 1.00 37.24 O ATOM 130 CB LEU A 10 43.448 27.262 19.821 1.00 41.66 C ATOM 131 CG LEU A 10 42.958 26.646 21.134 1.00 43.24 C ATOM 132 CD1 LEU A 10 43.516 27.452 22.296 1.00 42.19 C ATOM 133 CD2 LEU A 10 41.427 26.678 21.196 1.00 41.41 C ATOM 0 H LEU A 10 43.541 24.773 19.593 1.00 40.61 H new ATOM 0 HA LEU A 10 41.743 26.755 18.630 1.00 40.95 H new ATOM 0 HB2 LEU A 10 44.534 27.193 19.760 1.00 41.66 H new ATOM 0 HB3 LEU A 10 43.193 28.321 19.788 1.00 41.66 H new ATOM 0 HG LEU A 10 43.296 25.611 21.191 1.00 43.24 H new ATOM 0 HD11 LEU A 10 43.172 27.021 23.236 1.00 42.19 H new ATOM 0 HD12 LEU A 10 44.605 27.431 22.264 1.00 42.19 H new ATOM 0 HD13 LEU A 10 43.171 28.483 22.222 1.00 42.19 H new ATOM 0 HD21 LEU A 10 41.092 26.237 22.135 1.00 41.41 H new ATOM 0 HD22 LEU A 10 41.082 27.710 21.136 1.00 41.41 H new ATOM 0 HD23 LEU A 10 41.017 26.110 20.361 1.00 41.41 H new ATOM 145 N ASP A 11 44.554 26.406 16.968 1.00 41.30 N ATOM 146 CA ASP A 11 45.212 26.812 15.700 1.00 41.83 C ATOM 147 C ASP A 11 44.209 26.618 14.563 1.00 40.90 C ATOM 148 O ASP A 11 43.850 27.557 13.883 1.00 39.80 O ATOM 149 CB ASP A 11 46.463 25.954 15.455 1.00 44.60 C ATOM 150 CG ASP A 11 47.396 26.672 14.476 1.00 47.53 C ATOM 151 OD1 ASP A 11 46.999 27.702 13.957 1.00 48.56 O ATOM 152 OD2 ASP A 11 48.491 26.179 14.262 1.00 48.01 O ATOM 0 H ASP A 11 45.020 25.660 17.485 1.00 41.30 H new ATOM 0 HA ASP A 11 45.522 27.855 15.754 1.00 41.83 H new ATOM 0 HB2 ASP A 11 46.980 25.770 16.397 1.00 44.60 H new ATOM 0 HB3 ASP A 11 46.177 24.982 15.053 1.00 44.60 H new ATOM 157 N TYR A 12 43.732 25.409 14.362 1.00 39.29 N ATOM 158 CA TYR A 12 42.735 25.181 13.272 1.00 38.27 C ATOM 159 C TYR A 12 41.655 26.242 13.366 1.00 34.82 C ATOM 160 O TYR A 12 41.309 26.878 12.390 1.00 33.76 O ATOM 161 CB TYR A 12 42.056 23.817 13.412 1.00 42.68 C ATOM 162 CG TYR A 12 43.050 22.671 13.430 1.00 45.94 C ATOM 163 CD1 TYR A 12 44.183 22.656 12.592 1.00 47.36 C ATOM 164 CD2 TYR A 12 42.813 21.594 14.289 1.00 48.31 C ATOM 165 CE1 TYR A 12 45.060 21.566 12.627 1.00 48.74 C ATOM 166 CE2 TYR A 12 43.684 20.514 14.323 1.00 49.78 C ATOM 167 CZ TYR A 12 44.810 20.493 13.492 1.00 49.89 C ATOM 168 OH TYR A 12 45.675 19.418 13.526 1.00 52.12 O ATOM 0 H TYR A 12 43.988 24.582 14.901 1.00 39.29 H new ATOM 0 HA TYR A 12 43.263 25.224 12.319 1.00 38.27 H new ATOM 0 HB2 TYR A 12 41.470 23.799 14.331 1.00 42.68 H new ATOM 0 HB3 TYR A 12 41.359 23.676 12.586 1.00 42.68 H new ATOM 0 HD1 TYR A 12 44.374 23.483 11.925 1.00 47.36 H new ATOM 0 HD2 TYR A 12 41.945 21.602 14.932 1.00 48.31 H new ATOM 0 HE1 TYR A 12 45.930 21.552 11.987 1.00 48.74 H new ATOM 0 HE2 TYR A 12 43.493 19.688 14.992 1.00 49.78 H new ATOM 0 HH TYR A 12 45.356 18.762 14.180 1.00 52.12 H new ATOM 178 N CYS A 13 41.123 26.449 14.539 1.00 32.26 N ATOM 179 CA CYS A 13 40.074 27.483 14.696 1.00 30.43 C ATOM 180 C CYS A 13 40.565 28.758 14.026 1.00 30.74 C ATOM 181 O CYS A 13 39.956 29.254 13.109 1.00 28.86 O ATOM 182 CB CYS A 13 39.819 27.737 16.182 1.00 30.34 C ATOM 183 SG CYS A 13 39.649 26.153 17.043 1.00 24.58 S ATOM 0 H CYS A 13 41.372 25.946 15.391 1.00 32.26 H new ATOM 0 HA CYS A 13 39.142 27.153 14.237 1.00 30.43 H new ATOM 0 HB2 CYS A 13 40.641 28.310 16.611 1.00 30.34 H new ATOM 0 HB3 CYS A 13 38.915 28.332 16.311 1.00 30.34 H new ATOM 0 HG CYS A 13 40.805 25.561 17.095 1.00 24.58 H new ATOM 189 N GLN A 14 41.684 29.268 14.459 1.00 32.92 N ATOM 190 CA GLN A 14 42.234 30.500 13.833 1.00 34.93 C ATOM 191 C GLN A 14 42.250 30.330 12.306 1.00 35.74 C ATOM 192 O GLN A 14 41.874 31.222 11.575 1.00 35.15 O ATOM 193 CB GLN A 14 43.655 30.753 14.372 1.00 36.23 C ATOM 194 CG GLN A 14 43.968 32.258 14.378 1.00 40.72 C ATOM 195 CD GLN A 14 44.134 32.764 12.946 1.00 42.88 C ATOM 196 OE1 GLN A 14 43.788 33.889 12.644 1.00 45.84 O ATOM 197 NE2 GLN A 14 44.653 31.980 12.045 1.00 44.23 N ATOM 0 H GLN A 14 42.242 28.883 15.221 1.00 32.92 H new ATOM 0 HA GLN A 14 41.610 31.359 14.080 1.00 34.93 H new ATOM 0 HB2 GLN A 14 43.744 30.353 15.382 1.00 36.23 H new ATOM 0 HB3 GLN A 14 44.383 30.226 13.755 1.00 36.23 H new ATOM 0 HG2 GLN A 14 43.165 32.803 14.874 1.00 40.72 H new ATOM 0 HG3 GLN A 14 44.879 32.446 14.947 1.00 40.72 H new ATOM 0 HE21 GLN A 14 44.944 31.035 12.297 1.00 44.23 H new ATOM 0 HE22 GLN A 14 44.769 32.310 11.087 1.00 44.23 H new ATOM 206 N LYS A 15 42.649 29.189 11.807 1.00 35.66 N ATOM 207 CA LYS A 15 42.627 29.009 10.327 1.00 36.27 C ATOM 208 C LYS A 15 41.160 29.078 9.897 1.00 34.97 C ATOM 209 O LYS A 15 40.764 29.915 9.118 1.00 34.84 O ATOM 210 CB LYS A 15 43.208 27.634 9.936 1.00 40.22 C ATOM 211 CG LYS A 15 44.727 27.703 9.723 1.00 44.18 C ATOM 212 CD LYS A 15 45.477 27.776 11.073 1.00 47.52 C ATOM 213 CE LYS A 15 46.833 27.063 10.960 1.00 50.10 C ATOM 214 NZ LYS A 15 46.653 25.613 11.251 1.00 50.42 N ATOM 0 H LYS A 15 42.982 28.390 12.347 1.00 35.66 H new ATOM 0 HA LYS A 15 43.228 29.778 9.841 1.00 36.27 H new ATOM 0 HB2 LYS A 15 42.982 26.907 10.716 1.00 40.22 H new ATOM 0 HB3 LYS A 15 42.728 27.281 9.023 1.00 40.22 H new ATOM 0 HG2 LYS A 15 45.059 26.827 9.166 1.00 44.18 H new ATOM 0 HG3 LYS A 15 44.973 28.577 9.119 1.00 44.18 H new ATOM 0 HD2 LYS A 15 45.627 28.817 11.359 1.00 47.52 H new ATOM 0 HD3 LYS A 15 44.878 27.313 11.857 1.00 47.52 H new ATOM 0 HE2 LYS A 15 47.245 27.196 9.960 1.00 50.10 H new ATOM 0 HE3 LYS A 15 47.546 27.500 11.659 1.00 50.10 H new ATOM 0 HZ1 LYS A 15 47.570 25.127 11.175 1.00 50.42 H new ATOM 0 HZ2 LYS A 15 46.278 25.496 12.214 1.00 50.42 H new ATOM 0 HZ3 LYS A 15 45.986 25.202 10.567 1.00 50.42 H new ATOM 228 N LEU A 16 40.339 28.212 10.426 1.00 31.52 N ATOM 229 CA LEU A 16 38.896 28.248 10.062 1.00 30.64 C ATOM 230 C LEU A 16 38.400 29.680 10.262 1.00 29.20 C ATOM 231 O LEU A 16 37.593 30.191 9.512 1.00 30.83 O ATOM 232 CB LEU A 16 38.133 27.259 10.967 1.00 29.49 C ATOM 233 CG LEU A 16 36.908 26.674 10.240 1.00 29.11 C ATOM 234 CD1 LEU A 16 37.339 25.933 8.956 1.00 29.81 C ATOM 235 CD2 LEU A 16 36.192 25.700 11.189 1.00 25.98 C ATOM 0 H LEU A 16 40.604 27.485 11.091 1.00 31.52 H new ATOM 0 HA LEU A 16 38.734 27.955 9.025 1.00 30.64 H new ATOM 0 HB2 LEU A 16 38.799 26.452 11.271 1.00 29.49 H new ATOM 0 HB3 LEU A 16 37.812 27.767 11.876 1.00 29.49 H new ATOM 0 HG LEU A 16 36.236 27.484 9.955 1.00 29.11 H new ATOM 0 HD11 LEU A 16 36.459 25.527 8.457 1.00 29.81 H new ATOM 0 HD12 LEU A 16 37.847 26.628 8.288 1.00 29.81 H new ATOM 0 HD13 LEU A 16 38.016 25.119 9.215 1.00 29.81 H new ATOM 0 HD21 LEU A 16 35.321 25.277 10.688 1.00 25.98 H new ATOM 0 HD22 LEU A 16 36.874 24.898 11.470 1.00 25.98 H new ATOM 0 HD23 LEU A 16 35.872 26.233 12.084 1.00 25.98 H new ATOM 247 N LEU A 17 38.927 30.333 11.253 1.00 27.96 N ATOM 248 CA LEU A 17 38.558 31.749 11.513 1.00 28.93 C ATOM 249 C LEU A 17 39.051 32.572 10.314 1.00 30.06 C ATOM 250 O LEU A 17 38.443 33.543 9.908 1.00 30.41 O ATOM 251 CB LEU A 17 39.270 32.216 12.800 1.00 24.89 C ATOM 252 CG LEU A 17 38.500 33.369 13.480 1.00 25.03 C ATOM 253 CD1 LEU A 17 37.319 32.814 14.310 1.00 21.31 C ATOM 254 CD2 LEU A 17 39.446 34.188 14.408 1.00 20.22 C ATOM 0 H LEU A 17 39.608 29.941 11.904 1.00 27.96 H new ATOM 0 HA LEU A 17 37.482 31.868 11.640 1.00 28.93 H new ATOM 0 HB2 LEU A 17 39.361 31.379 13.492 1.00 24.89 H new ATOM 0 HB3 LEU A 17 40.282 32.543 12.560 1.00 24.89 H new ATOM 0 HG LEU A 17 38.114 34.024 12.699 1.00 25.03 H new ATOM 0 HD11 LEU A 17 36.787 33.640 14.783 1.00 21.31 H new ATOM 0 HD12 LEU A 17 36.638 32.271 13.655 1.00 21.31 H new ATOM 0 HD13 LEU A 17 37.699 32.140 15.078 1.00 21.31 H new ATOM 0 HD21 LEU A 17 38.885 34.996 14.878 1.00 20.22 H new ATOM 0 HD22 LEU A 17 39.855 33.534 15.178 1.00 20.22 H new ATOM 0 HD23 LEU A 17 40.261 34.608 13.818 1.00 20.22 H new ATOM 266 N GLU A 18 40.168 32.169 9.749 1.00 32.20 N ATOM 267 CA GLU A 18 40.743 32.890 8.575 1.00 35.35 C ATOM 268 C GLU A 18 40.088 32.364 7.288 1.00 35.74 C ATOM 269 O GLU A 18 39.715 33.126 6.417 1.00 35.74 O ATOM 270 CB GLU A 18 42.288 32.686 8.577 1.00 37.07 C ATOM 271 CG GLU A 18 42.756 31.697 7.491 1.00 39.76 C ATOM 272 CD GLU A 18 44.263 31.473 7.629 1.00 41.67 C ATOM 273 OE1 GLU A 18 44.917 32.321 8.215 1.00 43.93 O ATOM 274 OE2 GLU A 18 44.738 30.457 7.149 1.00 43.25 O ATOM 0 H GLU A 18 40.708 31.361 10.059 1.00 32.20 H new ATOM 0 HA GLU A 18 40.542 33.960 8.631 1.00 35.35 H new ATOM 0 HB2 GLU A 18 42.778 33.647 8.423 1.00 37.07 H new ATOM 0 HB3 GLU A 18 42.601 32.321 9.555 1.00 37.07 H new ATOM 0 HG2 GLU A 18 42.225 30.750 7.591 1.00 39.76 H new ATOM 0 HG3 GLU A 18 42.524 32.089 6.501 1.00 39.76 H new ATOM 281 N LYS A 19 39.933 31.071 7.164 1.00 37.19 N ATOM 282 CA LYS A 19 39.290 30.512 5.941 1.00 36.85 C ATOM 283 C LYS A 19 38.003 31.286 5.662 1.00 36.69 C ATOM 284 O LYS A 19 37.732 31.696 4.551 1.00 36.88 O ATOM 285 CB LYS A 19 38.966 29.046 6.163 1.00 36.86 C ATOM 286 CG LYS A 19 38.651 28.401 4.817 1.00 40.15 C ATOM 287 CD LYS A 19 38.344 26.941 5.054 1.00 41.50 C ATOM 288 CE LYS A 19 37.882 26.284 3.753 1.00 44.93 C ATOM 289 NZ LYS A 19 37.946 24.802 3.894 1.00 44.88 N ATOM 0 H LYS A 19 40.224 30.381 7.856 1.00 37.19 H new ATOM 0 HA LYS A 19 39.967 30.603 5.091 1.00 36.85 H new ATOM 0 HB2 LYS A 19 39.809 28.541 6.635 1.00 36.86 H new ATOM 0 HB3 LYS A 19 38.116 28.946 6.837 1.00 36.86 H new ATOM 0 HG2 LYS A 19 37.801 28.897 4.347 1.00 40.15 H new ATOM 0 HG3 LYS A 19 39.497 28.506 4.138 1.00 40.15 H new ATOM 0 HD2 LYS A 19 39.230 26.432 5.433 1.00 41.50 H new ATOM 0 HD3 LYS A 19 37.570 26.843 5.815 1.00 41.50 H new ATOM 0 HE2 LYS A 19 36.864 26.594 3.518 1.00 44.93 H new ATOM 0 HE3 LYS A 19 38.513 26.609 2.925 1.00 44.93 H new ATOM 0 HZ1 LYS A 19 38.681 24.425 3.263 1.00 44.88 H new ATOM 0 HZ2 LYS A 19 38.175 24.556 4.878 1.00 44.88 H new ATOM 0 HZ3 LYS A 19 37.026 24.389 3.639 1.00 44.88 H new ATOM 303 N PHE A 20 37.215 31.494 6.682 1.00 34.99 N ATOM 304 CA PHE A 20 35.944 32.247 6.531 1.00 34.93 C ATOM 305 C PHE A 20 36.169 33.678 7.022 1.00 34.32 C ATOM 306 O PHE A 20 35.267 34.493 7.045 1.00 35.01 O ATOM 307 CB PHE A 20 34.887 31.566 7.390 1.00 34.20 C ATOM 308 CG PHE A 20 34.486 30.264 6.749 1.00 33.79 C ATOM 309 CD1 PHE A 20 35.201 29.100 7.046 1.00 32.30 C ATOM 310 CD2 PHE A 20 33.418 30.219 5.848 1.00 34.75 C ATOM 311 CE1 PHE A 20 34.849 27.890 6.444 1.00 34.86 C ATOM 312 CE2 PHE A 20 33.069 29.010 5.241 1.00 35.66 C ATOM 313 CZ PHE A 20 33.786 27.845 5.540 1.00 35.69 C ATOM 0 H PHE A 20 37.405 31.167 7.629 1.00 34.99 H new ATOM 0 HA PHE A 20 35.618 32.267 5.491 1.00 34.93 H new ATOM 0 HB2 PHE A 20 35.277 31.386 8.392 1.00 34.20 H new ATOM 0 HB3 PHE A 20 34.017 32.214 7.498 1.00 34.20 H new ATOM 0 HD1 PHE A 20 36.026 29.137 7.742 1.00 32.30 H new ATOM 0 HD2 PHE A 20 32.863 31.118 5.621 1.00 34.75 H new ATOM 0 HE1 PHE A 20 35.399 26.990 6.678 1.00 34.86 H new ATOM 0 HE2 PHE A 20 32.247 28.974 4.542 1.00 35.66 H new ATOM 0 HZ PHE A 20 33.516 26.910 5.071 1.00 35.69 H new ATOM 323 N ARG A 21 37.379 33.984 7.408 1.00 34.35 N ATOM 324 CA ARG A 21 37.697 35.353 7.892 1.00 34.08 C ATOM 325 C ARG A 21 36.689 35.786 8.958 1.00 33.06 C ATOM 326 O ARG A 21 36.298 36.934 9.020 1.00 31.60 O ATOM 327 CB ARG A 21 37.657 36.334 6.712 1.00 37.64 C ATOM 328 CG ARG A 21 38.801 36.027 5.718 1.00 41.19 C ATOM 329 CD ARG A 21 38.319 35.057 4.638 1.00 45.12 C ATOM 330 NE ARG A 21 37.330 35.741 3.758 1.00 48.87 N ATOM 331 CZ ARG A 21 37.010 35.219 2.606 1.00 50.17 C ATOM 332 NH1 ARG A 21 37.555 34.096 2.224 1.00 52.38 N ATOM 333 NH2 ARG A 21 36.143 35.818 1.836 1.00 50.69 N ATOM 0 H ARG A 21 38.166 33.335 7.407 1.00 34.35 H new ATOM 0 HA ARG A 21 38.694 35.352 8.333 1.00 34.08 H new ATOM 0 HB2 ARG A 21 36.696 36.262 6.203 1.00 37.64 H new ATOM 0 HB3 ARG A 21 37.749 37.357 7.078 1.00 37.64 H new ATOM 0 HG2 ARG A 21 39.149 36.951 5.257 1.00 41.19 H new ATOM 0 HG3 ARG A 21 39.649 35.597 6.251 1.00 41.19 H new ATOM 0 HD2 ARG A 21 39.165 34.705 4.047 1.00 45.12 H new ATOM 0 HD3 ARG A 21 37.865 34.180 5.099 1.00 45.12 H new ATOM 0 HE ARG A 21 36.903 36.618 4.056 1.00 48.87 H new ATOM 0 HH11 ARG A 21 38.231 33.626 2.826 1.00 52.38 H new ATOM 0 HH12 ARG A 21 37.305 33.688 1.323 1.00 52.38 H new ATOM 0 HH21 ARG A 21 35.715 36.695 2.135 1.00 50.69 H new ATOM 0 HH22 ARG A 21 35.893 35.410 0.935 1.00 50.69 H new ATOM 347 N TYR A 22 36.273 34.886 9.809 1.00 30.22 N ATOM 348 CA TYR A 22 35.307 35.270 10.869 1.00 29.11 C ATOM 349 C TYR A 22 36.034 36.184 11.890 1.00 27.15 C ATOM 350 O TYR A 22 37.230 36.063 12.053 1.00 25.96 O ATOM 351 CB TYR A 22 34.832 33.995 11.585 1.00 27.09 C ATOM 352 CG TYR A 22 33.699 33.320 10.818 1.00 27.40 C ATOM 353 CD1 TYR A 22 32.505 34.006 10.542 1.00 26.95 C ATOM 354 CD2 TYR A 22 33.850 31.997 10.378 1.00 25.13 C ATOM 355 CE1 TYR A 22 31.478 33.374 9.830 1.00 26.07 C ATOM 356 CE2 TYR A 22 32.821 31.367 9.669 1.00 24.89 C ATOM 357 CZ TYR A 22 31.636 32.057 9.393 1.00 24.53 C ATOM 358 OH TYR A 22 30.623 31.436 8.692 1.00 21.93 O ATOM 0 H TYR A 22 36.561 33.907 9.813 1.00 30.22 H new ATOM 0 HA TYR A 22 34.454 35.795 10.438 1.00 29.11 H new ATOM 0 HB2 TYR A 22 35.667 33.302 11.690 1.00 27.09 H new ATOM 0 HB3 TYR A 22 34.495 34.244 12.591 1.00 27.09 H new ATOM 0 HD1 TYR A 22 32.378 35.024 10.880 1.00 26.95 H new ATOM 0 HD2 TYR A 22 34.765 31.462 10.587 1.00 25.13 H new ATOM 0 HE1 TYR A 22 30.562 33.906 9.618 1.00 26.07 H new ATOM 0 HE2 TYR A 22 32.942 30.347 9.335 1.00 24.89 H new ATOM 0 HH TYR A 22 29.774 31.559 9.166 1.00 21.93 H new ATOM 368 N PRO A 23 35.308 37.052 12.571 1.00 25.95 N ATOM 369 CA PRO A 23 35.918 37.931 13.588 1.00 26.49 C ATOM 370 C PRO A 23 36.634 37.077 14.651 1.00 26.35 C ATOM 371 O PRO A 23 36.590 35.864 14.618 1.00 24.48 O ATOM 372 CB PRO A 23 34.734 38.714 14.203 1.00 27.06 C ATOM 373 CG PRO A 23 33.441 38.255 13.473 1.00 29.61 C ATOM 374 CD PRO A 23 33.857 37.239 12.387 1.00 27.83 C ATOM 0 HA PRO A 23 36.666 38.605 13.170 1.00 26.49 H new ATOM 0 HB2 PRO A 23 34.660 38.519 15.273 1.00 27.06 H new ATOM 0 HB3 PRO A 23 34.881 39.787 14.084 1.00 27.06 H new ATOM 0 HG2 PRO A 23 32.744 37.800 14.177 1.00 29.61 H new ATOM 0 HG3 PRO A 23 32.930 39.107 13.025 1.00 29.61 H new ATOM 0 HD2 PRO A 23 33.320 36.297 12.502 1.00 27.83 H new ATOM 0 HD3 PRO A 23 33.631 37.614 11.389 1.00 27.83 H new ATOM 382 N TRP A 24 37.296 37.707 15.584 1.00 23.75 N ATOM 383 CA TRP A 24 38.022 36.939 16.643 1.00 24.21 C ATOM 384 C TRP A 24 37.053 36.470 17.738 1.00 24.68 C ATOM 385 O TRP A 24 37.387 35.624 18.544 1.00 22.18 O ATOM 386 CB TRP A 24 39.105 37.830 17.267 1.00 24.39 C ATOM 387 CG TRP A 24 39.729 37.126 18.435 1.00 26.00 C ATOM 388 CD1 TRP A 24 39.577 37.489 19.729 1.00 27.56 C ATOM 389 CD2 TRP A 24 40.589 35.949 18.438 1.00 24.99 C ATOM 390 NE1 TRP A 24 40.289 36.611 20.527 1.00 24.44 N ATOM 391 CE2 TRP A 24 40.930 35.644 19.777 1.00 27.17 C ATOM 392 CE3 TRP A 24 41.103 35.125 17.420 1.00 27.07 C ATOM 393 CZ2 TRP A 24 41.749 34.559 20.095 1.00 26.88 C ATOM 394 CZ3 TRP A 24 41.927 34.033 17.737 1.00 28.86 C ATOM 395 CH2 TRP A 24 42.249 33.751 19.071 1.00 27.85 C ATOM 0 H TRP A 24 37.367 38.722 15.661 1.00 23.75 H new ATOM 0 HA TRP A 24 38.479 36.062 16.185 1.00 24.21 H new ATOM 0 HB2 TRP A 24 39.867 38.067 16.524 1.00 24.39 H new ATOM 0 HB3 TRP A 24 38.670 38.775 17.590 1.00 24.39 H new ATOM 0 HD1 TRP A 24 38.995 38.327 20.082 1.00 27.56 H new ATOM 0 HE1 TRP A 24 40.335 36.670 21.544 1.00 24.44 H new ATOM 0 HE3 TRP A 24 40.862 35.334 16.388 1.00 27.07 H new ATOM 0 HZ2 TRP A 24 41.994 34.346 21.125 1.00 26.88 H new ATOM 0 HZ3 TRP A 24 42.315 33.407 16.947 1.00 28.86 H new ATOM 0 HH2 TRP A 24 42.883 32.910 19.308 1.00 27.85 H new ATOM 406 N GLU A 25 35.869 37.015 17.796 1.00 21.18 N ATOM 407 CA GLU A 25 34.914 36.594 18.866 1.00 25.10 C ATOM 408 C GLU A 25 34.246 35.260 18.503 1.00 23.53 C ATOM 409 O GLU A 25 33.590 34.660 19.327 1.00 22.15 O ATOM 410 CB GLU A 25 33.842 37.679 19.075 1.00 30.80 C ATOM 411 CG GLU A 25 33.465 38.309 17.731 1.00 38.77 C ATOM 412 CD GLU A 25 32.109 39.010 17.849 1.00 43.31 C ATOM 413 OE1 GLU A 25 31.600 39.090 18.955 1.00 45.94 O ATOM 414 OE2 GLU A 25 31.604 39.455 16.832 1.00 46.36 O ATOM 0 H GLU A 25 35.521 37.728 17.155 1.00 21.18 H new ATOM 0 HA GLU A 25 35.473 36.461 19.792 1.00 25.10 H new ATOM 0 HB2 GLU A 25 32.959 37.244 19.542 1.00 30.80 H new ATOM 0 HB3 GLU A 25 34.216 38.446 19.753 1.00 30.80 H new ATOM 0 HG2 GLU A 25 34.229 39.024 17.427 1.00 38.77 H new ATOM 0 HG3 GLU A 25 33.422 37.541 16.958 1.00 38.77 H new ATOM 421 N LEU A 26 34.376 34.797 17.280 1.00 21.26 N ATOM 422 CA LEU A 26 33.716 33.504 16.896 1.00 20.65 C ATOM 423 C LEU A 26 34.663 32.321 17.085 1.00 20.00 C ATOM 424 O LEU A 26 34.471 31.271 16.505 1.00 16.59 O ATOM 425 CB LEU A 26 33.263 33.564 15.438 1.00 23.25 C ATOM 426 CG LEU A 26 32.491 34.866 15.172 1.00 26.24 C ATOM 427 CD1 LEU A 26 31.716 34.729 13.865 1.00 29.07 C ATOM 428 CD2 LEU A 26 31.494 35.152 16.307 1.00 26.56 C ATOM 0 H LEU A 26 34.905 35.253 16.537 1.00 21.26 H new ATOM 0 HA LEU A 26 32.853 33.362 17.546 1.00 20.65 H new ATOM 0 HB2 LEU A 26 34.129 33.506 14.778 1.00 23.25 H new ATOM 0 HB3 LEU A 26 32.631 32.706 15.211 1.00 23.25 H new ATOM 0 HG LEU A 26 33.206 35.687 15.112 1.00 26.24 H new ATOM 0 HD11 LEU A 26 31.166 35.650 13.670 1.00 29.07 H new ATOM 0 HD12 LEU A 26 32.412 34.542 13.047 1.00 29.07 H new ATOM 0 HD13 LEU A 26 31.016 33.897 13.943 1.00 29.07 H new ATOM 0 HD21 LEU A 26 30.959 36.078 16.097 1.00 26.56 H new ATOM 0 HD22 LEU A 26 30.781 34.330 16.381 1.00 26.56 H new ATOM 0 HD23 LEU A 26 32.033 35.250 17.249 1.00 26.56 H new ATOM 440 N MET A 27 35.656 32.451 17.920 1.00 18.56 N ATOM 441 CA MET A 27 36.553 31.293 18.154 1.00 17.95 C ATOM 442 C MET A 27 35.775 30.179 18.891 1.00 17.26 C ATOM 443 O MET A 27 35.973 29.020 18.585 1.00 15.06 O ATOM 444 CB MET A 27 37.799 31.708 18.955 1.00 20.02 C ATOM 445 CG MET A 27 38.781 32.430 18.036 1.00 18.07 C ATOM 446 SD MET A 27 39.634 31.230 16.978 1.00 11.26 S ATOM 447 CE MET A 27 40.584 30.388 18.269 1.00 20.89 C ATOM 0 H MET A 27 35.881 33.298 18.442 1.00 18.56 H new ATOM 0 HA MET A 27 36.895 30.915 17.191 1.00 17.95 H new ATOM 0 HB2 MET A 27 37.513 32.359 19.781 1.00 20.02 H new ATOM 0 HB3 MET A 27 38.273 30.829 19.391 1.00 20.02 H new ATOM 0 HG2 MET A 27 38.250 33.157 17.421 1.00 18.07 H new ATOM 0 HG3 MET A 27 39.507 32.985 18.630 1.00 18.07 H new ATOM 0 HE1 MET A 27 41.541 30.062 17.862 1.00 20.89 H new ATOM 0 HE2 MET A 27 40.757 31.073 19.099 1.00 20.89 H new ATOM 0 HE3 MET A 27 40.026 29.521 18.624 1.00 20.89 H new ATOM 457 N PRO A 28 34.890 30.527 19.827 1.00 16.29 N ATOM 458 CA PRO A 28 34.101 29.503 20.539 1.00 17.09 C ATOM 459 C PRO A 28 33.242 28.742 19.522 1.00 15.81 C ATOM 460 O PRO A 28 32.867 27.617 19.741 1.00 16.73 O ATOM 461 CB PRO A 28 33.231 30.300 21.545 1.00 16.95 C ATOM 462 CG PRO A 28 33.789 31.744 21.560 1.00 18.75 C ATOM 463 CD PRO A 28 34.598 31.913 20.263 1.00 16.75 C ATOM 0 HA PRO A 28 34.711 28.763 21.056 1.00 17.09 H new ATOM 0 HB2 PRO A 28 32.184 30.292 21.244 1.00 16.95 H new ATOM 0 HB3 PRO A 28 33.280 29.855 22.539 1.00 16.95 H new ATOM 0 HG2 PRO A 28 32.979 32.472 21.610 1.00 18.75 H new ATOM 0 HG3 PRO A 28 34.419 31.907 22.434 1.00 18.75 H new ATOM 0 HD2 PRO A 28 34.029 32.456 19.508 1.00 16.75 H new ATOM 0 HD3 PRO A 28 35.515 32.476 20.437 1.00 16.75 H new ATOM 471 N LEU A 29 32.940 29.350 18.404 1.00 15.35 N ATOM 472 CA LEU A 29 32.120 28.653 17.370 1.00 15.54 C ATOM 473 C LEU A 29 33.047 27.832 16.475 1.00 15.13 C ATOM 474 O LEU A 29 32.875 26.638 16.329 1.00 14.57 O ATOM 475 CB LEU A 29 31.352 29.683 16.540 1.00 15.26 C ATOM 476 CG LEU A 29 30.594 30.629 17.481 1.00 13.96 C ATOM 477 CD1 LEU A 29 29.777 31.619 16.647 1.00 15.02 C ATOM 478 CD2 LEU A 29 29.650 29.817 18.387 1.00 15.96 C ATOM 0 H LEU A 29 33.226 30.299 18.163 1.00 15.35 H new ATOM 0 HA LEU A 29 31.400 27.989 17.849 1.00 15.54 H new ATOM 0 HB2 LEU A 29 32.041 30.250 15.914 1.00 15.26 H new ATOM 0 HB3 LEU A 29 30.654 29.180 15.871 1.00 15.26 H new ATOM 0 HG LEU A 29 31.306 31.171 18.103 1.00 13.96 H new ATOM 0 HD11 LEU A 29 29.236 32.294 17.310 1.00 15.02 H new ATOM 0 HD12 LEU A 29 30.446 32.196 16.009 1.00 15.02 H new ATOM 0 HD13 LEU A 29 29.066 31.073 16.027 1.00 15.02 H new ATOM 0 HD21 LEU A 29 29.114 30.493 19.053 1.00 15.96 H new ATOM 0 HD22 LEU A 29 28.935 29.272 17.771 1.00 15.96 H new ATOM 0 HD23 LEU A 29 30.232 29.110 18.979 1.00 15.96 H new ATOM 490 N MET A 30 34.050 28.442 15.894 1.00 15.06 N ATOM 491 CA MET A 30 34.985 27.655 15.047 1.00 12.45 C ATOM 492 C MET A 30 35.506 26.500 15.893 1.00 12.90 C ATOM 493 O MET A 30 35.733 25.406 15.416 1.00 14.81 O ATOM 494 CB MET A 30 36.169 28.526 14.619 1.00 15.01 C ATOM 495 CG MET A 30 35.713 29.623 13.658 1.00 12.65 C ATOM 496 SD MET A 30 35.071 28.878 12.133 1.00 8.44 S ATOM 497 CE MET A 30 33.361 29.450 12.278 1.00 27.75 C ATOM 0 H MET A 30 34.257 29.438 15.970 1.00 15.06 H new ATOM 0 HA MET A 30 34.472 27.296 14.155 1.00 12.45 H new ATOM 0 HB2 MET A 30 36.633 28.975 15.497 1.00 15.01 H new ATOM 0 HB3 MET A 30 36.927 27.907 14.139 1.00 15.01 H new ATOM 0 HG2 MET A 30 34.942 30.233 14.128 1.00 12.65 H new ATOM 0 HG3 MET A 30 36.547 30.286 13.427 1.00 12.65 H new ATOM 0 HE1 MET A 30 32.821 29.218 11.360 1.00 27.75 H new ATOM 0 HE2 MET A 30 32.880 28.950 13.119 1.00 27.75 H new ATOM 0 HE3 MET A 30 33.350 30.528 12.442 1.00 27.75 H new ATOM 507 N TYR A 31 35.687 26.751 17.160 1.00 13.07 N ATOM 508 CA TYR A 31 36.185 25.692 18.073 1.00 15.35 C ATOM 509 C TYR A 31 35.212 24.505 18.053 1.00 16.32 C ATOM 510 O TYR A 31 35.594 23.377 17.813 1.00 15.86 O ATOM 511 CB TYR A 31 36.281 26.257 19.496 1.00 14.82 C ATOM 512 CG TYR A 31 36.606 25.145 20.464 1.00 17.46 C ATOM 513 CD1 TYR A 31 35.577 24.333 20.959 1.00 20.04 C ATOM 514 CD2 TYR A 31 37.930 24.924 20.869 1.00 19.91 C ATOM 515 CE1 TYR A 31 35.868 23.300 21.853 1.00 21.64 C ATOM 516 CE2 TYR A 31 38.219 23.888 21.763 1.00 22.38 C ATOM 517 CZ TYR A 31 37.189 23.076 22.256 1.00 23.93 C ATOM 518 OH TYR A 31 37.477 22.056 23.140 1.00 30.09 O ATOM 0 H TYR A 31 35.509 27.653 17.603 1.00 13.07 H new ATOM 0 HA TYR A 31 37.170 25.357 17.748 1.00 15.35 H new ATOM 0 HB2 TYR A 31 37.051 27.028 19.541 1.00 14.82 H new ATOM 0 HB3 TYR A 31 35.339 26.731 19.774 1.00 14.82 H new ATOM 0 HD1 TYR A 31 34.557 24.506 20.649 1.00 20.04 H new ATOM 0 HD2 TYR A 31 38.724 25.552 20.492 1.00 19.91 H new ATOM 0 HE1 TYR A 31 35.074 22.675 22.233 1.00 21.64 H new ATOM 0 HE2 TYR A 31 39.238 23.713 22.074 1.00 22.38 H new ATOM 0 HH TYR A 31 38.441 22.037 23.314 1.00 30.09 H new ATOM 528 N VAL A 32 33.957 24.753 18.310 1.00 16.31 N ATOM 529 CA VAL A 32 32.958 23.643 18.319 1.00 13.79 C ATOM 530 C VAL A 32 32.899 22.968 16.949 1.00 15.33 C ATOM 531 O VAL A 32 33.030 21.765 16.840 1.00 15.78 O ATOM 532 CB VAL A 32 31.573 24.202 18.661 1.00 15.68 C ATOM 533 CG1 VAL A 32 30.561 23.053 18.702 1.00 14.40 C ATOM 534 CG2 VAL A 32 31.617 24.906 20.026 1.00 13.96 C ATOM 0 H VAL A 32 33.578 25.678 18.515 1.00 16.31 H new ATOM 0 HA VAL A 32 33.259 22.909 19.067 1.00 13.79 H new ATOM 0 HB VAL A 32 31.274 24.924 17.901 1.00 15.68 H new ATOM 0 HG11 VAL A 32 29.574 23.446 18.945 1.00 14.40 H new ATOM 0 HG12 VAL A 32 30.527 22.563 17.729 1.00 14.40 H new ATOM 0 HG13 VAL A 32 30.861 22.331 19.461 1.00 14.40 H new ATOM 0 HG21 VAL A 32 30.629 25.301 20.264 1.00 13.96 H new ATOM 0 HG22 VAL A 32 31.917 24.193 20.794 1.00 13.96 H new ATOM 0 HG23 VAL A 32 32.336 25.724 19.990 1.00 13.96 H new ATOM 544 N ILE A 33 32.693 23.727 15.903 1.00 13.65 N ATOM 545 CA ILE A 33 32.616 23.127 14.540 1.00 13.17 C ATOM 546 C ILE A 33 33.737 22.088 14.363 1.00 15.24 C ATOM 547 O ILE A 33 33.507 20.969 13.947 1.00 15.62 O ATOM 548 CB ILE A 33 32.746 24.265 13.514 1.00 15.80 C ATOM 549 CG1 ILE A 33 31.411 25.038 13.465 1.00 14.63 C ATOM 550 CG2 ILE A 33 33.072 23.695 12.128 1.00 15.09 C ATOM 551 CD1 ILE A 33 31.570 26.393 12.751 1.00 15.66 C ATOM 0 H ILE A 33 32.575 24.740 15.936 1.00 13.65 H new ATOM 0 HA ILE A 33 31.665 22.614 14.395 1.00 13.17 H new ATOM 0 HB ILE A 33 33.554 24.935 13.808 1.00 15.80 H new ATOM 0 HG12 ILE A 33 30.661 24.439 12.948 1.00 14.63 H new ATOM 0 HG13 ILE A 33 31.046 25.200 14.479 1.00 14.63 H new ATOM 0 HG21 ILE A 33 33.161 24.511 11.411 1.00 15.09 H new ATOM 0 HG22 ILE A 33 34.013 23.146 12.172 1.00 15.09 H new ATOM 0 HG23 ILE A 33 32.274 23.022 11.814 1.00 15.09 H new ATOM 0 HD11 ILE A 33 30.611 26.910 12.735 1.00 15.66 H new ATOM 0 HD12 ILE A 33 32.301 27.001 13.283 1.00 15.66 H new ATOM 0 HD13 ILE A 33 31.911 26.228 11.729 1.00 15.66 H new ATOM 563 N LEU A 34 34.937 22.456 14.691 1.00 16.71 N ATOM 564 CA LEU A 34 36.100 21.523 14.576 1.00 19.71 C ATOM 565 C LEU A 34 35.896 20.332 15.534 1.00 20.61 C ATOM 566 O LEU A 34 36.194 19.202 15.202 1.00 22.08 O ATOM 567 CB LEU A 34 37.371 22.334 14.978 1.00 19.59 C ATOM 568 CG LEU A 34 38.350 22.735 13.798 1.00 26.84 C ATOM 569 CD1 LEU A 34 37.838 22.413 12.388 1.00 24.93 C ATOM 570 CD2 LEU A 34 38.634 24.247 13.862 1.00 27.25 C ATOM 0 H LEU A 34 35.173 23.384 15.043 1.00 16.71 H new ATOM 0 HA LEU A 34 36.201 21.130 13.564 1.00 19.71 H new ATOM 0 HB2 LEU A 34 37.050 23.246 15.481 1.00 19.59 H new ATOM 0 HB3 LEU A 34 37.934 21.750 15.706 1.00 19.59 H new ATOM 0 HG LEU A 34 39.244 22.130 13.953 1.00 26.84 H new ATOM 0 HD11 LEU A 34 38.579 22.725 11.652 1.00 24.93 H new ATOM 0 HD12 LEU A 34 37.668 21.340 12.299 1.00 24.93 H new ATOM 0 HD13 LEU A 34 36.903 22.945 12.210 1.00 24.93 H new ATOM 0 HD21 LEU A 34 39.307 24.525 13.051 1.00 27.25 H new ATOM 0 HD22 LEU A 34 37.699 24.797 13.762 1.00 27.25 H new ATOM 0 HD23 LEU A 34 39.098 24.490 14.818 1.00 27.25 H new ATOM 582 N LYS A 35 35.404 20.576 16.715 1.00 19.14 N ATOM 583 CA LYS A 35 35.198 19.458 17.690 1.00 20.97 C ATOM 584 C LYS A 35 34.336 18.377 17.054 1.00 22.25 C ATOM 585 O LYS A 35 34.437 17.210 17.377 1.00 22.80 O ATOM 586 CB LYS A 35 34.497 19.999 18.944 1.00 22.98 C ATOM 587 CG LYS A 35 34.639 18.987 20.088 1.00 26.83 C ATOM 588 CD LYS A 35 34.045 19.568 21.382 1.00 29.91 C ATOM 589 CE LYS A 35 32.522 19.400 21.386 1.00 33.36 C ATOM 590 NZ LYS A 35 31.986 19.802 22.718 1.00 35.88 N ATOM 0 H LYS A 35 35.134 21.500 17.052 1.00 19.14 H new ATOM 0 HA LYS A 35 36.164 19.034 17.965 1.00 20.97 H new ATOM 0 HB2 LYS A 35 34.934 20.955 19.234 1.00 22.98 H new ATOM 0 HB3 LYS A 35 33.443 20.181 18.734 1.00 22.98 H new ATOM 0 HG2 LYS A 35 34.129 18.059 19.829 1.00 26.83 H new ATOM 0 HG3 LYS A 35 35.690 18.742 20.239 1.00 26.83 H new ATOM 0 HD2 LYS A 35 34.476 19.064 22.247 1.00 29.91 H new ATOM 0 HD3 LYS A 35 34.302 20.624 21.467 1.00 29.91 H new ATOM 0 HE2 LYS A 35 32.075 20.011 20.602 1.00 33.36 H new ATOM 0 HE3 LYS A 35 32.258 18.364 21.172 1.00 33.36 H new ATOM 0 HZ1 LYS A 35 31.291 19.098 23.039 1.00 35.88 H new ATOM 0 HZ2 LYS A 35 32.766 19.857 23.404 1.00 35.88 H new ATOM 0 HZ3 LYS A 35 31.527 20.732 22.641 1.00 35.88 H new ATOM 604 N ASP A 36 33.482 18.762 16.161 1.00 20.87 N ATOM 605 CA ASP A 36 32.589 17.781 15.498 1.00 18.89 C ATOM 606 C ASP A 36 33.276 17.191 14.268 1.00 17.97 C ATOM 607 O ASP A 36 33.205 16.006 14.010 1.00 19.23 O ATOM 608 CB ASP A 36 31.326 18.519 15.086 1.00 16.73 C ATOM 609 CG ASP A 36 30.878 19.400 16.255 1.00 19.06 C ATOM 610 OD1 ASP A 36 30.687 18.864 17.334 1.00 17.75 O ATOM 611 OD2 ASP A 36 30.735 20.594 16.051 1.00 14.84 O ATOM 0 H ASP A 36 33.361 19.728 15.856 1.00 20.87 H new ATOM 0 HA ASP A 36 32.351 16.961 16.176 1.00 18.89 H new ATOM 0 HB2 ASP A 36 31.514 19.129 14.202 1.00 16.73 H new ATOM 0 HB3 ASP A 36 30.541 17.810 14.823 1.00 16.73 H new ATOM 616 N ALA A 37 33.922 18.017 13.500 1.00 19.53 N ATOM 617 CA ALA A 37 34.601 17.527 12.270 1.00 20.29 C ATOM 618 C ALA A 37 35.960 16.932 12.615 1.00 23.93 C ATOM 619 O ALA A 37 36.913 17.072 11.874 1.00 23.82 O ATOM 620 CB ALA A 37 34.794 18.701 11.323 1.00 19.16 C ATOM 0 H ALA A 37 34.010 19.019 13.671 1.00 19.53 H new ATOM 0 HA ALA A 37 33.990 16.755 11.803 1.00 20.29 H new ATOM 0 HB1 ALA A 37 35.291 18.358 10.415 1.00 19.16 H new ATOM 0 HB2 ALA A 37 33.823 19.125 11.067 1.00 19.16 H new ATOM 0 HB3 ALA A 37 35.406 19.462 11.807 1.00 19.16 H new ATOM 626 N ASP A 38 36.070 16.276 13.729 1.00 25.04 N ATOM 627 CA ASP A 38 37.381 15.691 14.097 1.00 29.02 C ATOM 628 C ASP A 38 38.435 16.800 14.060 1.00 30.09 C ATOM 629 O ASP A 38 39.623 16.550 14.094 1.00 29.56 O ATOM 630 CB ASP A 38 37.739 14.587 13.092 1.00 31.78 C ATOM 631 CG ASP A 38 38.737 13.611 13.723 1.00 34.21 C ATOM 632 OD1 ASP A 38 38.332 12.866 14.600 1.00 39.08 O ATOM 633 OD2 ASP A 38 39.887 13.627 13.317 1.00 37.98 O ATOM 0 H ASP A 38 35.315 16.120 14.397 1.00 25.04 H new ATOM 0 HA ASP A 38 37.341 15.259 15.097 1.00 29.02 H new ATOM 0 HB2 ASP A 38 36.838 14.054 12.788 1.00 31.78 H new ATOM 0 HB3 ASP A 38 38.168 15.028 12.192 1.00 31.78 H new ATOM 638 N ALA A 39 37.990 18.026 13.991 1.00 30.33 N ATOM 639 CA ALA A 39 38.925 19.181 13.954 1.00 32.12 C ATOM 640 C ALA A 39 39.569 19.298 12.567 1.00 33.86 C ATOM 641 O ALA A 39 40.463 20.093 12.356 1.00 34.96 O ATOM 642 CB ALA A 39 39.997 19.005 15.033 1.00 32.67 C ATOM 0 H ALA A 39 37.002 18.277 13.958 1.00 30.33 H new ATOM 0 HA ALA A 39 38.372 20.099 14.151 1.00 32.12 H new ATOM 0 HB1 ALA A 39 40.683 19.852 15.006 1.00 32.67 H new ATOM 0 HB2 ALA A 39 39.522 18.954 16.013 1.00 32.67 H new ATOM 0 HB3 ALA A 39 40.550 18.084 14.849 1.00 32.67 H new ATOM 648 N ASN A 40 39.116 18.527 11.613 1.00 33.92 N ATOM 649 CA ASN A 40 39.702 18.622 10.244 1.00 34.20 C ATOM 650 C ASN A 40 39.034 19.786 9.507 1.00 34.98 C ATOM 651 O ASN A 40 37.894 19.700 9.095 1.00 32.10 O ATOM 652 CB ASN A 40 39.459 17.311 9.480 1.00 33.87 C ATOM 653 CG ASN A 40 40.539 16.289 9.846 1.00 32.69 C ATOM 654 OD1 ASN A 40 41.695 16.465 9.516 1.00 34.27 O ATOM 655 ND2 ASN A 40 40.208 15.223 10.519 1.00 33.64 N ATOM 0 H ASN A 40 38.370 17.840 11.722 1.00 33.92 H new ATOM 0 HA ASN A 40 40.777 18.792 10.310 1.00 34.20 H new ATOM 0 HB2 ASN A 40 38.473 16.915 9.724 1.00 33.87 H new ATOM 0 HB3 ASN A 40 39.471 17.498 8.406 1.00 33.87 H new ATOM 0 HD21 ASN A 40 40.920 14.536 10.769 1.00 33.64 H new ATOM 0 HD22 ASN A 40 39.237 15.076 10.796 1.00 33.64 H new ATOM 662 N ILE A 41 39.731 20.877 9.350 1.00 35.49 N ATOM 663 CA ILE A 41 39.133 22.051 8.655 1.00 37.55 C ATOM 664 C ILE A 41 38.469 21.601 7.350 1.00 36.60 C ATOM 665 O ILE A 41 37.317 21.892 7.105 1.00 34.64 O ATOM 666 CB ILE A 41 40.233 23.094 8.372 1.00 39.67 C ATOM 667 CG1 ILE A 41 40.607 23.761 9.718 1.00 42.22 C ATOM 668 CG2 ILE A 41 39.738 24.144 7.334 1.00 40.78 C ATOM 669 CD1 ILE A 41 41.638 24.887 9.539 1.00 44.19 C ATOM 0 H ILE A 41 40.690 21.006 9.673 1.00 35.49 H new ATOM 0 HA ILE A 41 38.372 22.504 9.290 1.00 37.55 H new ATOM 0 HB ILE A 41 41.113 22.616 7.941 1.00 39.67 H new ATOM 0 HG12 ILE A 41 39.708 24.164 10.184 1.00 42.22 H new ATOM 0 HG13 ILE A 41 41.008 23.008 10.396 1.00 42.22 H new ATOM 0 HG21 ILE A 41 40.528 24.871 7.147 1.00 40.78 H new ATOM 0 HG22 ILE A 41 39.480 23.641 6.402 1.00 40.78 H new ATOM 0 HG23 ILE A 41 38.859 24.656 7.725 1.00 40.78 H new ATOM 0 HD11 ILE A 41 41.870 25.326 10.510 1.00 44.19 H new ATOM 0 HD12 ILE A 41 42.548 24.480 9.098 1.00 44.19 H new ATOM 0 HD13 ILE A 41 41.228 25.655 8.883 1.00 44.19 H new ATOM 681 N GLU A 42 39.173 20.901 6.509 1.00 37.01 N ATOM 682 CA GLU A 42 38.550 20.456 5.231 1.00 36.07 C ATOM 683 C GLU A 42 37.207 19.786 5.527 1.00 33.02 C ATOM 684 O GLU A 42 36.217 20.040 4.872 1.00 31.66 O ATOM 685 CB GLU A 42 39.474 19.460 4.526 1.00 40.46 C ATOM 686 CG GLU A 42 40.866 20.074 4.367 1.00 45.44 C ATOM 687 CD GLU A 42 41.802 19.055 3.713 1.00 49.08 C ATOM 688 OE1 GLU A 42 41.328 18.286 2.893 1.00 50.84 O ATOM 689 OE2 GLU A 42 42.976 19.061 4.044 1.00 51.71 O ATOM 0 H GLU A 42 40.143 20.619 6.647 1.00 37.01 H new ATOM 0 HA GLU A 42 38.393 21.320 4.585 1.00 36.07 H new ATOM 0 HB2 GLU A 42 39.537 18.537 5.102 1.00 40.46 H new ATOM 0 HB3 GLU A 42 39.067 19.200 3.549 1.00 40.46 H new ATOM 0 HG2 GLU A 42 40.810 20.976 3.757 1.00 45.44 H new ATOM 0 HG3 GLU A 42 41.257 20.371 5.340 1.00 45.44 H new ATOM 696 N GLU A 43 37.167 18.936 6.514 1.00 29.75 N ATOM 697 CA GLU A 43 35.890 18.251 6.860 1.00 27.99 C ATOM 698 C GLU A 43 34.980 19.223 7.616 1.00 25.26 C ATOM 699 O GLU A 43 33.771 19.105 7.584 1.00 22.77 O ATOM 700 CB GLU A 43 36.187 17.038 7.747 1.00 30.94 C ATOM 701 CG GLU A 43 34.957 16.129 7.798 1.00 33.24 C ATOM 702 CD GLU A 43 34.823 15.378 6.472 1.00 37.98 C ATOM 703 OE1 GLU A 43 35.685 15.551 5.626 1.00 38.40 O ATOM 704 OE2 GLU A 43 33.861 14.643 6.325 1.00 43.17 O ATOM 0 H GLU A 43 37.965 18.685 7.098 1.00 29.75 H new ATOM 0 HA GLU A 43 35.394 17.922 5.947 1.00 27.99 H new ATOM 0 HB2 GLU A 43 37.043 16.488 7.355 1.00 30.94 H new ATOM 0 HB3 GLU A 43 36.452 17.365 8.752 1.00 30.94 H new ATOM 0 HG2 GLU A 43 35.049 15.421 8.622 1.00 33.24 H new ATOM 0 HG3 GLU A 43 34.061 16.721 7.985 1.00 33.24 H new ATOM 711 N ALA A 44 35.550 20.182 8.302 1.00 22.98 N ATOM 712 CA ALA A 44 34.712 21.157 9.064 1.00 23.88 C ATOM 713 C ALA A 44 34.222 22.259 8.116 1.00 22.87 C ATOM 714 O ALA A 44 33.067 22.636 8.132 1.00 22.85 O ATOM 715 CB ALA A 44 35.542 21.749 10.226 1.00 22.28 C ATOM 0 H ALA A 44 36.557 20.331 8.367 1.00 22.98 H new ATOM 0 HA ALA A 44 33.841 20.655 9.485 1.00 23.88 H new ATOM 0 HB1 ALA A 44 34.932 22.460 10.783 1.00 22.28 H new ATOM 0 HB2 ALA A 44 35.861 20.946 10.891 1.00 22.28 H new ATOM 0 HB3 ALA A 44 36.418 22.258 9.825 1.00 22.28 H new ATOM 721 N SER A 45 35.086 22.768 7.287 1.00 25.55 N ATOM 722 CA SER A 45 34.665 23.833 6.335 1.00 26.34 C ATOM 723 C SER A 45 33.487 23.319 5.506 1.00 26.21 C ATOM 724 O SER A 45 32.484 23.986 5.347 1.00 23.95 O ATOM 725 CB SER A 45 35.834 24.170 5.408 1.00 29.82 C ATOM 726 OG SER A 45 35.797 23.315 4.273 1.00 33.07 O ATOM 0 H SER A 45 36.066 22.494 7.226 1.00 25.55 H new ATOM 0 HA SER A 45 34.367 24.727 6.883 1.00 26.34 H new ATOM 0 HB2 SER A 45 35.775 25.212 5.094 1.00 29.82 H new ATOM 0 HB3 SER A 45 36.779 24.049 5.937 1.00 29.82 H new ATOM 0 HG SER A 45 36.072 22.411 4.535 1.00 33.07 H new ATOM 732 N ARG A 46 33.607 22.128 4.985 1.00 26.25 N ATOM 733 CA ARG A 46 32.507 21.539 4.167 1.00 26.19 C ATOM 734 C ARG A 46 31.164 21.774 4.871 1.00 24.78 C ATOM 735 O ARG A 46 30.162 22.049 4.242 1.00 20.51 O ATOM 736 CB ARG A 46 32.773 20.029 4.014 1.00 30.93 C ATOM 737 CG ARG A 46 33.633 19.766 2.770 1.00 37.66 C ATOM 738 CD ARG A 46 34.321 18.404 2.868 1.00 43.41 C ATOM 739 NE ARG A 46 33.276 17.321 2.868 1.00 47.39 N ATOM 740 CZ ARG A 46 32.630 16.954 3.936 1.00 49.82 C ATOM 741 NH1 ARG A 46 32.988 17.388 5.110 1.00 51.10 N ATOM 742 NH2 ARG A 46 31.650 16.098 3.835 1.00 51.02 N ATOM 0 H ARG A 46 34.428 21.532 5.092 1.00 26.25 H new ATOM 0 HA ARG A 46 32.469 22.007 3.183 1.00 26.19 H new ATOM 0 HB2 ARG A 46 33.279 19.650 4.902 1.00 30.93 H new ATOM 0 HB3 ARG A 46 31.828 19.492 3.932 1.00 30.93 H new ATOM 0 HG2 ARG A 46 33.010 19.801 1.877 1.00 37.66 H new ATOM 0 HG3 ARG A 46 34.382 20.551 2.667 1.00 37.66 H new ATOM 0 HD2 ARG A 46 35.004 18.267 2.030 1.00 43.41 H new ATOM 0 HD3 ARG A 46 34.918 18.350 3.778 1.00 43.41 H new ATOM 0 HE ARG A 46 33.064 16.852 1.988 1.00 47.39 H new ATOM 0 HH11 ARG A 46 33.782 18.022 5.199 1.00 51.10 H new ATOM 0 HH12 ARG A 46 32.475 17.094 5.941 1.00 51.10 H new ATOM 0 HH21 ARG A 46 31.394 15.721 2.922 1.00 51.02 H new ATOM 0 HH22 ARG A 46 31.140 15.806 4.669 1.00 51.02 H new ATOM 756 N ARG A 47 31.141 21.674 6.170 1.00 20.40 N ATOM 757 CA ARG A 47 29.868 21.900 6.912 1.00 20.79 C ATOM 758 C ARG A 47 29.522 23.383 6.854 1.00 20.46 C ATOM 759 O ARG A 47 28.486 23.771 6.351 1.00 20.27 O ATOM 760 CB ARG A 47 30.041 21.463 8.368 1.00 18.12 C ATOM 761 CG ARG A 47 30.739 20.099 8.409 1.00 19.83 C ATOM 762 CD ARG A 47 30.890 19.622 9.860 1.00 24.63 C ATOM 763 NE ARG A 47 30.938 18.133 9.875 1.00 25.15 N ATOM 764 CZ ARG A 47 31.309 17.504 10.953 1.00 28.72 C ATOM 765 NH1 ARG A 47 31.597 18.177 12.030 1.00 25.84 N ATOM 766 NH2 ARG A 47 31.385 16.202 10.956 1.00 22.33 N ATOM 0 H ARG A 47 31.948 21.446 6.751 1.00 20.40 H new ATOM 0 HA ARG A 47 29.064 21.318 6.460 1.00 20.79 H new ATOM 0 HB2 ARG A 47 30.628 22.201 8.914 1.00 18.12 H new ATOM 0 HB3 ARG A 47 29.070 21.402 8.859 1.00 18.12 H new ATOM 0 HG2 ARG A 47 30.163 19.371 7.838 1.00 19.83 H new ATOM 0 HG3 ARG A 47 31.720 20.170 7.938 1.00 19.83 H new ATOM 0 HD2 ARG A 47 31.799 20.033 10.299 1.00 24.63 H new ATOM 0 HD3 ARG A 47 30.055 19.979 10.463 1.00 24.63 H new ATOM 0 HE ARG A 47 30.680 17.606 9.041 1.00 25.15 H new ATOM 0 HH11 ARG A 47 31.532 19.195 12.028 1.00 25.84 H new ATOM 0 HH12 ARG A 47 31.888 17.686 12.876 1.00 25.84 H new ATOM 0 HH21 ARG A 47 31.154 15.676 10.113 1.00 22.33 H new ATOM 0 HH22 ARG A 47 31.676 15.710 11.801 1.00 22.33 H new ATOM 780 N ILE A 48 30.397 24.219 7.343 1.00 19.14 N ATOM 781 CA ILE A 48 30.147 25.690 7.295 1.00 21.78 C ATOM 782 C ILE A 48 29.673 26.046 5.895 1.00 25.27 C ATOM 783 O ILE A 48 28.616 26.609 5.700 1.00 23.94 O ATOM 784 CB ILE A 48 31.451 26.417 7.602 1.00 20.97 C ATOM 785 CG1 ILE A 48 31.990 25.879 8.928 1.00 21.08 C ATOM 786 CG2 ILE A 48 31.186 27.923 7.703 1.00 21.08 C ATOM 787 CD1 ILE A 48 33.192 26.708 9.402 1.00 19.82 C ATOM 0 H ILE A 48 31.279 23.946 7.776 1.00 19.14 H new ATOM 0 HA ILE A 48 29.392 25.981 8.025 1.00 21.78 H new ATOM 0 HB ILE A 48 32.182 26.251 6.811 1.00 20.97 H new ATOM 0 HG12 ILE A 48 31.204 25.905 9.683 1.00 21.08 H new ATOM 0 HG13 ILE A 48 32.285 24.836 8.810 1.00 21.08 H new ATOM 0 HG21 ILE A 48 32.119 28.443 7.923 1.00 21.08 H new ATOM 0 HG22 ILE A 48 30.782 28.286 6.758 1.00 21.08 H new ATOM 0 HG23 ILE A 48 30.468 28.113 8.501 1.00 21.08 H new ATOM 0 HD11 ILE A 48 33.560 26.308 10.347 1.00 19.82 H new ATOM 0 HD12 ILE A 48 33.984 26.660 8.655 1.00 19.82 H new ATOM 0 HD13 ILE A 48 32.887 27.745 9.541 1.00 19.82 H new ATOM 799 N GLU A 49 30.450 25.688 4.921 1.00 26.87 N ATOM 800 CA GLU A 49 30.074 25.964 3.509 1.00 31.21 C ATOM 801 C GLU A 49 28.615 25.599 3.284 1.00 31.88 C ATOM 802 O GLU A 49 27.788 26.435 2.977 1.00 31.73 O ATOM 803 CB GLU A 49 30.901 25.056 2.616 1.00 32.85 C ATOM 804 CG GLU A 49 32.318 25.610 2.446 1.00 36.76 C ATOM 805 CD GLU A 49 33.031 24.848 1.327 1.00 40.40 C ATOM 806 OE1 GLU A 49 32.705 23.690 1.125 1.00 40.28 O ATOM 807 OE2 GLU A 49 33.890 25.435 0.691 1.00 43.41 O ATOM 0 H GLU A 49 31.343 25.209 5.041 1.00 26.87 H new ATOM 0 HA GLU A 49 30.241 27.018 3.289 1.00 31.21 H new ATOM 0 HB2 GLU A 49 30.945 24.056 3.047 1.00 32.85 H new ATOM 0 HB3 GLU A 49 30.422 24.962 1.641 1.00 32.85 H new ATOM 0 HG2 GLU A 49 32.279 26.673 2.209 1.00 36.76 H new ATOM 0 HG3 GLU A 49 32.873 25.512 3.379 1.00 36.76 H new ATOM 814 N GLU A 50 28.294 24.342 3.450 1.00 32.05 N ATOM 815 CA GLU A 50 26.889 23.907 3.264 1.00 30.33 C ATOM 816 C GLU A 50 26.039 24.842 4.094 1.00 29.99 C ATOM 817 O GLU A 50 25.033 25.325 3.665 1.00 26.76 O ATOM 818 CB GLU A 50 26.740 22.451 3.749 1.00 33.38 C ATOM 819 CG GLU A 50 25.587 21.758 3.012 1.00 33.45 C ATOM 820 CD GLU A 50 25.545 20.280 3.405 1.00 36.89 C ATOM 821 OE1 GLU A 50 24.979 19.979 4.443 1.00 35.55 O ATOM 822 OE2 GLU A 50 26.079 19.474 2.661 1.00 36.13 O ATOM 0 H GLU A 50 28.948 23.602 3.706 1.00 32.05 H new ATOM 0 HA GLU A 50 26.584 23.941 2.218 1.00 30.33 H new ATOM 0 HB2 GLU A 50 27.669 21.907 3.578 1.00 33.38 H new ATOM 0 HB3 GLU A 50 26.555 22.436 4.823 1.00 33.38 H new ATOM 0 HG2 GLU A 50 24.641 22.239 3.261 1.00 33.45 H new ATOM 0 HG3 GLU A 50 25.720 21.855 1.934 1.00 33.45 H new ATOM 829 N GLY A 51 26.501 25.131 5.265 1.00 0.00 N ATOM 830 CA GLY A 51 25.781 26.063 6.166 1.00 0.00 C ATOM 831 C GLY A 51 25.589 27.422 5.478 1.00 0.00 C ATOM 832 O GLY A 51 24.491 27.896 5.276 1.00 0.00 O ATOM 0 H GLY A 51 27.368 24.754 5.648 1.00 0.00 H new ATOM 0 HA2 GLY A 51 24.812 25.644 6.436 1.00 0.00 H new ATOM 0 HA3 GLY A 51 26.342 26.192 7.092 1.00 0.00 H new ATOM 836 N GLN A 52 26.669 28.064 5.125 1.00 29.60 N ATOM 837 CA GLN A 52 26.565 29.397 4.455 1.00 32.81 C ATOM 838 C GLN A 52 25.565 29.280 3.320 1.00 33.63 C ATOM 839 O GLN A 52 24.637 30.054 3.194 1.00 32.37 O ATOM 840 CB GLN A 52 27.925 29.793 3.869 1.00 32.81 C ATOM 841 CG GLN A 52 29.033 29.667 4.934 1.00 34.44 C ATOM 842 CD GLN A 52 29.244 31.000 5.657 1.00 35.84 C ATOM 843 OE1 GLN A 52 28.328 31.787 5.793 1.00 36.29 O ATOM 844 NE2 GLN A 52 30.427 31.282 6.128 1.00 38.34 N ATOM 0 H GLN A 52 27.620 27.725 5.270 1.00 29.60 H new ATOM 0 HA GLN A 52 26.250 30.149 5.178 1.00 32.81 H new ATOM 0 HB2 GLN A 52 28.159 29.156 3.016 1.00 32.81 H new ATOM 0 HB3 GLN A 52 27.883 30.818 3.499 1.00 32.81 H new ATOM 0 HG2 GLN A 52 28.765 28.895 5.655 1.00 34.44 H new ATOM 0 HG3 GLN A 52 29.964 29.352 4.462 1.00 34.44 H new ATOM 0 HE21 GLN A 52 31.193 30.619 6.012 1.00 38.34 H new ATOM 0 HE22 GLN A 52 30.586 32.165 6.612 1.00 38.34 H new ATOM 853 N TYR A 53 25.752 28.291 2.507 1.00 34.79 N ATOM 854 CA TYR A 53 24.828 28.066 1.373 1.00 37.88 C ATOM 855 C TYR A 53 23.461 27.707 1.944 1.00 39.97 C ATOM 856 O TYR A 53 22.446 28.239 1.555 1.00 39.08 O ATOM 857 CB TYR A 53 25.365 26.898 0.528 1.00 39.97 C ATOM 858 CG TYR A 53 24.250 26.289 -0.293 1.00 42.20 C ATOM 859 CD1 TYR A 53 23.383 25.361 0.288 1.00 42.61 C ATOM 860 CD2 TYR A 53 24.087 26.660 -1.622 1.00 42.58 C ATOM 861 CE1 TYR A 53 22.351 24.803 -0.462 1.00 45.45 C ATOM 862 CE2 TYR A 53 23.051 26.103 -2.384 1.00 44.68 C ATOM 863 CZ TYR A 53 22.181 25.172 -1.802 1.00 45.19 C ATOM 864 OH TYR A 53 21.159 24.620 -2.547 1.00 49.10 O ATOM 0 H TYR A 53 26.516 27.619 2.580 1.00 34.79 H new ATOM 0 HA TYR A 53 24.747 28.956 0.748 1.00 37.88 H new ATOM 0 HB2 TYR A 53 26.159 27.251 -0.130 1.00 39.97 H new ATOM 0 HB3 TYR A 53 25.803 26.141 1.178 1.00 39.97 H new ATOM 0 HD1 TYR A 53 23.513 25.075 1.321 1.00 42.61 H new ATOM 0 HD2 TYR A 53 24.759 27.378 -2.068 1.00 42.58 H new ATOM 0 HE1 TYR A 53 21.682 24.086 -0.010 1.00 45.45 H new ATOM 0 HE2 TYR A 53 22.924 26.391 -3.417 1.00 44.68 H new ATOM 0 HH TYR A 53 20.549 24.133 -1.955 1.00 49.10 H new ATOM 874 N VAL A 54 23.449 26.798 2.865 1.00 39.04 N ATOM 875 CA VAL A 54 22.177 26.356 3.489 1.00 40.51 C ATOM 876 C VAL A 54 21.382 27.597 3.913 1.00 40.89 C ATOM 877 O VAL A 54 20.303 27.859 3.422 1.00 40.52 O ATOM 878 CB VAL A 54 22.568 25.505 4.700 1.00 40.89 C ATOM 879 CG1 VAL A 54 21.479 25.483 5.744 1.00 41.12 C ATOM 880 CG2 VAL A 54 22.938 24.053 4.286 1.00 40.75 C ATOM 0 H VAL A 54 24.283 26.331 3.221 1.00 39.04 H new ATOM 0 HA VAL A 54 21.553 25.777 2.809 1.00 40.51 H new ATOM 0 HB VAL A 54 23.450 25.974 5.136 1.00 40.89 H new ATOM 0 HG11 VAL A 54 21.795 24.869 6.587 1.00 41.12 H new ATOM 0 HG12 VAL A 54 21.284 26.499 6.088 1.00 41.12 H new ATOM 0 HG13 VAL A 54 20.569 25.066 5.312 1.00 41.12 H new ATOM 0 HG21 VAL A 54 23.210 23.480 5.172 1.00 40.75 H new ATOM 0 HG22 VAL A 54 22.083 23.584 3.799 1.00 40.75 H new ATOM 0 HG23 VAL A 54 23.781 24.075 3.596 1.00 40.75 H new ATOM 890 N VAL A 55 21.923 28.361 4.816 1.00 40.66 N ATOM 891 CA VAL A 55 21.223 29.591 5.275 1.00 41.79 C ATOM 892 C VAL A 55 20.940 30.479 4.061 1.00 43.19 C ATOM 893 O VAL A 55 19.810 30.833 3.788 1.00 42.93 O ATOM 894 CB VAL A 55 22.122 30.327 6.276 1.00 40.93 C ATOM 895 CG1 VAL A 55 21.373 31.519 6.882 1.00 40.61 C ATOM 896 CG2 VAL A 55 22.517 29.357 7.392 1.00 41.17 C ATOM 0 H VAL A 55 22.825 28.186 5.259 1.00 40.66 H new ATOM 0 HA VAL A 55 20.280 29.339 5.761 1.00 41.79 H new ATOM 0 HB VAL A 55 23.011 30.693 5.762 1.00 40.93 H new ATOM 0 HG11 VAL A 55 22.021 32.034 7.591 1.00 40.61 H new ATOM 0 HG12 VAL A 55 21.083 32.208 6.089 1.00 40.61 H new ATOM 0 HG13 VAL A 55 20.481 31.164 7.398 1.00 40.61 H new ATOM 0 HG21 VAL A 55 23.157 29.870 8.110 1.00 41.17 H new ATOM 0 HG22 VAL A 55 21.620 28.998 7.897 1.00 41.17 H new ATOM 0 HG23 VAL A 55 23.056 28.511 6.965 1.00 41.17 H new ATOM 906 N ASN A 56 21.958 30.833 3.324 1.00 43.65 N ATOM 907 CA ASN A 56 21.746 31.687 2.120 1.00 46.57 C ATOM 908 C ASN A 56 20.685 31.043 1.229 1.00 47.19 C ATOM 909 O ASN A 56 19.940 31.718 0.547 1.00 46.87 O ATOM 910 CB ASN A 56 23.060 31.815 1.346 1.00 46.25 C ATOM 911 CG ASN A 56 24.123 32.440 2.249 1.00 46.74 C ATOM 912 OD1 ASN A 56 25.232 32.693 1.821 1.00 46.94 O ATOM 913 ND2 ASN A 56 23.828 32.699 3.492 1.00 47.06 N ATOM 0 H ASN A 56 22.927 30.568 3.503 1.00 43.65 H new ATOM 0 HA ASN A 56 21.412 32.678 2.427 1.00 46.57 H new ATOM 0 HB2 ASN A 56 23.390 30.834 1.003 1.00 46.25 H new ATOM 0 HB3 ASN A 56 22.913 32.431 0.458 1.00 46.25 H new ATOM 0 HD21 ASN A 56 24.528 33.114 4.106 1.00 47.06 H new ATOM 0 HD22 ASN A 56 22.897 32.486 3.850 1.00 47.06 H new ATOM 920 N GLU A 57 20.602 29.741 1.237 1.00 49.43 N ATOM 921 CA GLU A 57 19.582 29.058 0.398 1.00 51.03 C ATOM 922 C GLU A 57 18.212 29.238 1.045 1.00 51.99 C ATOM 923 O GLU A 57 17.216 29.439 0.381 1.00 52.02 O ATOM 924 CB GLU A 57 19.904 27.573 0.301 1.00 52.77 C ATOM 925 CG GLU A 57 18.994 26.914 -0.735 1.00 54.20 C ATOM 926 CD GLU A 57 19.121 25.392 -0.633 1.00 56.33 C ATOM 927 OE1 GLU A 57 19.512 24.920 0.422 1.00 57.76 O ATOM 928 OE2 GLU A 57 18.824 24.726 -1.611 1.00 57.66 O ATOM 0 H GLU A 57 21.197 29.122 1.788 1.00 49.43 H new ATOM 0 HA GLU A 57 19.582 29.489 -0.603 1.00 51.03 H new ATOM 0 HB2 GLU A 57 20.948 27.435 0.021 1.00 52.77 H new ATOM 0 HB3 GLU A 57 19.769 27.098 1.273 1.00 52.77 H new ATOM 0 HG2 GLU A 57 17.960 27.215 -0.570 1.00 54.20 H new ATOM 0 HG3 GLU A 57 19.266 27.246 -1.737 1.00 54.20 H new ATOM 935 N TYR A 58 18.155 29.176 2.342 1.00 53.12 N ATOM 936 CA TYR A 58 16.854 29.359 3.028 1.00 54.13 C ATOM 937 C TYR A 58 16.493 30.833 2.970 1.00 54.38 C ATOM 938 O TYR A 58 15.356 31.224 3.137 1.00 55.12 O ATOM 939 CB TYR A 58 16.980 28.928 4.488 1.00 54.54 C ATOM 940 CG TYR A 58 15.609 28.812 5.094 1.00 55.20 C ATOM 941 CD1 TYR A 58 15.004 29.924 5.694 1.00 55.64 C ATOM 942 CD2 TYR A 58 14.945 27.588 5.053 1.00 55.36 C ATOM 943 CE1 TYR A 58 13.728 29.804 6.255 1.00 56.15 C ATOM 944 CE2 TYR A 58 13.672 27.465 5.612 1.00 55.93 C ATOM 945 CZ TYR A 58 13.061 28.573 6.215 1.00 56.20 C ATOM 946 OH TYR A 58 11.802 28.451 6.767 1.00 58.01 O ATOM 0 H TYR A 58 18.952 29.007 2.955 1.00 53.12 H new ATOM 0 HA TYR A 58 16.085 28.757 2.544 1.00 54.13 H new ATOM 0 HB2 TYR A 58 17.501 27.973 4.553 1.00 54.54 H new ATOM 0 HB3 TYR A 58 17.575 29.653 5.043 1.00 54.54 H new ATOM 0 HD1 TYR A 58 15.521 30.872 5.723 1.00 55.64 H new ATOM 0 HD2 TYR A 58 15.415 26.734 4.589 1.00 55.36 H new ATOM 0 HE1 TYR A 58 13.258 30.659 6.718 1.00 56.15 H new ATOM 0 HE2 TYR A 58 13.158 26.516 5.580 1.00 55.93 H new ATOM 0 HH TYR A 58 11.837 27.837 7.530 1.00 58.01 H new ATOM 1151 N ASP B 7 13.233 23.215 8.770 1.00 55.77 N ATOM 1152 CA ASP B 7 12.652 24.357 9.541 1.00 53.95 C ATOM 1153 C ASP B 7 12.996 24.208 11.025 1.00 52.49 C ATOM 1154 O ASP B 7 13.611 25.073 11.616 1.00 51.89 O ATOM 1155 CB ASP B 7 11.130 24.369 9.365 1.00 54.63 C ATOM 1156 CG ASP B 7 10.577 25.743 9.752 1.00 55.27 C ATOM 1157 OD1 ASP B 7 11.034 26.724 9.190 1.00 56.33 O ATOM 1158 OD2 ASP B 7 9.705 25.790 10.605 1.00 55.55 O ATOM 0 HA ASP B 7 13.069 25.293 9.169 1.00 53.95 H new ATOM 0 HB2 ASP B 7 10.872 24.140 8.331 1.00 54.63 H new ATOM 0 HB3 ASP B 7 10.676 23.596 9.985 1.00 54.63 H new ATOM 1163 N VAL B 8 12.635 23.105 11.627 1.00 50.38 N ATOM 1164 CA VAL B 8 12.979 22.900 13.070 1.00 48.45 C ATOM 1165 C VAL B 8 14.473 23.172 13.221 1.00 46.36 C ATOM 1166 O VAL B 8 14.921 23.858 14.116 1.00 44.84 O ATOM 1167 CB VAL B 8 12.693 21.436 13.492 1.00 48.63 C ATOM 1168 CG1 VAL B 8 11.346 21.347 14.205 1.00 48.83 C ATOM 1169 CG2 VAL B 8 12.677 20.536 12.257 1.00 47.55 C ATOM 0 H VAL B 8 12.121 22.341 11.188 1.00 50.38 H new ATOM 0 HA VAL B 8 12.383 23.564 13.695 1.00 48.45 H new ATOM 0 HB VAL B 8 13.478 21.106 14.172 1.00 48.63 H new ATOM 0 HG11 VAL B 8 11.156 20.314 14.497 1.00 48.83 H new ATOM 0 HG12 VAL B 8 11.362 21.978 15.094 1.00 48.83 H new ATOM 0 HG13 VAL B 8 10.556 21.686 13.534 1.00 48.83 H new ATOM 0 HG21 VAL B 8 12.476 19.508 12.558 1.00 47.55 H new ATOM 0 HG22 VAL B 8 11.899 20.872 11.572 1.00 47.55 H new ATOM 0 HG23 VAL B 8 13.645 20.585 11.759 1.00 47.55 H new ATOM 1179 N PHE B 9 15.238 22.618 12.335 1.00 44.57 N ATOM 1180 CA PHE B 9 16.702 22.814 12.389 1.00 42.68 C ATOM 1181 C PHE B 9 17.005 24.311 12.419 1.00 41.92 C ATOM 1182 O PHE B 9 17.624 24.812 13.337 1.00 40.56 O ATOM 1183 CB PHE B 9 17.347 22.169 11.151 1.00 41.99 C ATOM 1184 CG PHE B 9 18.774 21.822 11.465 1.00 41.32 C ATOM 1185 CD1 PHE B 9 19.759 22.805 11.368 1.00 41.38 C ATOM 1186 CD2 PHE B 9 19.109 20.526 11.863 1.00 41.88 C ATOM 1187 CE1 PHE B 9 21.080 22.494 11.667 1.00 39.40 C ATOM 1188 CE2 PHE B 9 20.434 20.216 12.165 1.00 39.39 C ATOM 1189 CZ PHE B 9 21.418 21.204 12.065 1.00 40.84 C ATOM 0 H PHE B 9 14.908 22.032 11.568 1.00 44.57 H new ATOM 0 HA PHE B 9 17.109 22.347 13.286 1.00 42.68 H new ATOM 0 HB2 PHE B 9 16.797 21.273 10.864 1.00 41.99 H new ATOM 0 HB3 PHE B 9 17.304 22.854 10.304 1.00 41.99 H new ATOM 0 HD1 PHE B 9 19.495 23.806 11.061 1.00 41.38 H new ATOM 0 HD2 PHE B 9 18.344 19.767 11.937 1.00 41.88 H new ATOM 0 HE1 PHE B 9 21.844 23.253 11.591 1.00 39.40 H new ATOM 0 HE2 PHE B 9 20.699 19.216 12.475 1.00 39.39 H new ATOM 0 HZ PHE B 9 22.445 20.965 12.298 1.00 40.84 H new ATOM 1199 N LEU B 10 16.566 25.031 11.426 1.00 41.09 N ATOM 1200 CA LEU B 10 16.823 26.494 11.411 1.00 41.50 C ATOM 1201 C LEU B 10 16.169 27.115 12.639 1.00 41.09 C ATOM 1202 O LEU B 10 16.696 28.029 13.240 1.00 38.55 O ATOM 1203 CB LEU B 10 16.241 27.109 10.139 1.00 42.71 C ATOM 1204 CG LEU B 10 16.662 26.277 8.923 1.00 43.61 C ATOM 1205 CD1 LEU B 10 16.272 27.018 7.650 1.00 44.50 C ATOM 1206 CD2 LEU B 10 18.179 26.060 8.933 1.00 43.61 C ATOM 0 H LEU B 10 16.043 24.671 10.628 1.00 41.09 H new ATOM 0 HA LEU B 10 17.896 26.685 11.429 1.00 41.50 H new ATOM 0 HB2 LEU B 10 15.154 27.147 10.207 1.00 42.71 H new ATOM 0 HB3 LEU B 10 16.590 28.136 10.028 1.00 42.71 H new ATOM 0 HG LEU B 10 16.161 25.309 8.962 1.00 43.61 H new ATOM 0 HD11 LEU B 10 16.569 26.430 6.781 1.00 44.50 H new ATOM 0 HD12 LEU B 10 15.193 27.170 7.633 1.00 44.50 H new ATOM 0 HD13 LEU B 10 16.775 27.985 7.623 1.00 44.50 H new ATOM 0 HD21 LEU B 10 18.468 25.468 8.065 1.00 43.61 H new ATOM 0 HD22 LEU B 10 18.685 27.025 8.898 1.00 43.61 H new ATOM 0 HD23 LEU B 10 18.465 25.533 9.843 1.00 43.61 H new ATOM 1218 N ASP B 11 15.031 26.616 13.035 1.00 41.28 N ATOM 1219 CA ASP B 11 14.376 27.179 14.243 1.00 41.44 C ATOM 1220 C ASP B 11 15.362 27.075 15.404 1.00 39.86 C ATOM 1221 O ASP B 11 15.732 28.067 15.999 1.00 37.26 O ATOM 1222 CB ASP B 11 13.100 26.400 14.572 1.00 44.23 C ATOM 1223 CG ASP B 11 12.172 26.392 13.355 1.00 46.87 C ATOM 1224 OD1 ASP B 11 12.464 27.102 12.407 1.00 48.41 O ATOM 1225 OD2 ASP B 11 11.185 25.675 13.392 1.00 49.31 O ATOM 0 H ASP B 11 14.533 25.852 12.579 1.00 41.28 H new ATOM 0 HA ASP B 11 14.101 28.219 14.067 1.00 41.44 H new ATOM 0 HB2 ASP B 11 13.350 25.378 14.858 1.00 44.23 H new ATOM 0 HB3 ASP B 11 12.594 26.855 15.424 1.00 44.23 H new ATOM 1230 N TYR B 12 15.820 25.884 15.721 1.00 39.23 N ATOM 1231 CA TYR B 12 16.806 25.746 16.835 1.00 38.08 C ATOM 1232 C TYR B 12 17.911 26.764 16.632 1.00 34.01 C ATOM 1233 O TYR B 12 18.256 27.508 17.529 1.00 32.49 O ATOM 1234 CB TYR B 12 17.450 24.358 16.842 1.00 42.28 C ATOM 1235 CG TYR B 12 16.424 23.244 16.951 1.00 47.31 C ATOM 1236 CD1 TYR B 12 15.301 23.350 17.794 1.00 49.49 C ATOM 1237 CD2 TYR B 12 16.619 22.080 16.204 1.00 48.65 C ATOM 1238 CE1 TYR B 12 14.390 22.291 17.876 1.00 50.83 C ATOM 1239 CE2 TYR B 12 15.715 21.029 16.287 1.00 51.34 C ATOM 1240 CZ TYR B 12 14.597 21.129 17.123 1.00 50.67 C ATOM 1241 OH TYR B 12 13.699 20.084 17.204 1.00 52.32 O ATOM 0 H TYR B 12 15.555 25.013 15.260 1.00 39.23 H new ATOM 0 HA TYR B 12 16.279 25.900 17.777 1.00 38.08 H new ATOM 0 HB2 TYR B 12 18.031 24.225 15.929 1.00 42.28 H new ATOM 0 HB3 TYR B 12 18.148 24.288 17.677 1.00 42.28 H new ATOM 0 HD1 TYR B 12 15.143 24.246 18.376 1.00 49.49 H new ATOM 0 HD2 TYR B 12 17.480 21.997 15.557 1.00 48.65 H new ATOM 0 HE1 TYR B 12 13.527 22.370 18.520 1.00 50.83 H new ATOM 0 HE2 TYR B 12 15.875 20.133 15.706 1.00 51.34 H new ATOM 0 HH TYR B 12 13.991 19.356 16.617 1.00 52.32 H new ATOM 1251 N CYS B 13 18.467 26.813 15.452 1.00 32.32 N ATOM 1252 CA CYS B 13 19.542 27.796 15.187 1.00 29.00 C ATOM 1253 C CYS B 13 19.074 29.155 15.688 1.00 29.81 C ATOM 1254 O CYS B 13 19.681 29.742 16.549 1.00 24.62 O ATOM 1255 CB CYS B 13 19.825 27.859 13.686 1.00 28.41 C ATOM 1256 SG CYS B 13 19.989 26.177 13.037 1.00 23.95 S ATOM 0 H CYS B 13 18.220 26.214 14.665 1.00 32.32 H new ATOM 0 HA CYS B 13 20.459 27.504 15.699 1.00 29.00 H new ATOM 0 HB2 CYS B 13 19.017 28.382 13.174 1.00 28.41 H new ATOM 0 HB3 CYS B 13 20.739 28.424 13.500 1.00 28.41 H new ATOM 0 HG CYS B 13 18.821 25.606 13.011 1.00 23.95 H new ATOM 1262 N GLN B 14 17.976 29.637 15.177 1.00 29.76 N ATOM 1263 CA GLN B 14 17.452 30.949 15.642 1.00 32.34 C ATOM 1264 C GLN B 14 17.416 30.969 17.177 1.00 33.14 C ATOM 1265 O GLN B 14 17.812 31.931 17.799 1.00 33.29 O ATOM 1266 CB GLN B 14 16.044 31.165 15.068 1.00 34.56 C ATOM 1267 CG GLN B 14 15.727 32.664 14.989 1.00 39.08 C ATOM 1268 CD GLN B 14 15.546 33.233 16.396 1.00 41.02 C ATOM 1269 OE1 GLN B 14 15.903 34.365 16.656 1.00 42.67 O ATOM 1270 NE2 GLN B 14 15.002 32.495 17.320 1.00 42.20 N ATOM 0 H GLN B 14 17.419 29.178 14.457 1.00 29.76 H new ATOM 0 HA GLN B 14 18.101 31.753 15.296 1.00 32.34 H new ATOM 0 HB2 GLN B 14 15.976 30.719 14.076 1.00 34.56 H new ATOM 0 HB3 GLN B 14 15.307 30.663 15.695 1.00 34.56 H new ATOM 0 HG2 GLN B 14 16.533 33.188 14.476 1.00 39.08 H new ATOM 0 HG3 GLN B 14 14.821 32.823 14.404 1.00 39.08 H new ATOM 0 HE21 GLN B 14 14.702 31.545 17.103 1.00 42.20 H new ATOM 0 HE22 GLN B 14 14.876 32.867 18.261 1.00 42.20 H new ATOM 1279 N LYS B 15 16.972 29.913 17.804 1.00 31.48 N ATOM 1280 CA LYS B 15 16.972 29.916 19.293 1.00 31.70 C ATOM 1281 C LYS B 15 18.437 29.991 19.732 1.00 30.74 C ATOM 1282 O LYS B 15 18.852 30.908 20.405 1.00 30.57 O ATOM 1283 CB LYS B 15 16.328 28.622 19.835 1.00 35.91 C ATOM 1284 CG LYS B 15 14.817 28.806 20.041 1.00 40.53 C ATOM 1285 CD LYS B 15 14.107 28.948 18.688 1.00 42.80 C ATOM 1286 CE LYS B 15 12.612 28.636 18.846 1.00 45.27 C ATOM 1287 NZ LYS B 15 11.850 29.287 17.742 1.00 48.21 N ATOM 0 H LYS B 15 16.617 29.066 17.361 1.00 31.48 H new ATOM 0 HA LYS B 15 16.398 30.758 19.679 1.00 31.70 H new ATOM 0 HB2 LYS B 15 16.507 27.803 19.139 1.00 35.91 H new ATOM 0 HB3 LYS B 15 16.797 28.346 20.779 1.00 35.91 H new ATOM 0 HG2 LYS B 15 14.411 27.953 20.584 1.00 40.53 H new ATOM 0 HG3 LYS B 15 14.631 29.690 20.651 1.00 40.53 H new ATOM 0 HD2 LYS B 15 14.237 29.960 18.304 1.00 42.80 H new ATOM 0 HD3 LYS B 15 14.554 28.270 17.960 1.00 42.80 H new ATOM 0 HE2 LYS B 15 12.450 27.558 18.828 1.00 45.27 H new ATOM 0 HE3 LYS B 15 12.254 28.996 19.811 1.00 45.27 H new ATOM 0 HZ1 LYS B 15 10.837 29.076 17.848 1.00 48.21 H new ATOM 0 HZ2 LYS B 15 11.995 30.316 17.780 1.00 48.21 H new ATOM 0 HZ3 LYS B 15 12.185 28.923 16.827 1.00 48.21 H new ATOM 1301 N LEU B 16 19.237 29.045 19.323 1.00 26.59 N ATOM 1302 CA LEU B 16 20.679 29.086 19.693 1.00 27.03 C ATOM 1303 C LEU B 16 21.215 30.472 19.333 1.00 24.17 C ATOM 1304 O LEU B 16 22.007 31.060 20.042 1.00 23.26 O ATOM 1305 CB LEU B 16 21.420 27.985 18.908 1.00 28.15 C ATOM 1306 CG LEU B 16 22.663 27.499 19.676 1.00 28.00 C ATOM 1307 CD1 LEU B 16 22.259 26.917 21.047 1.00 30.50 C ATOM 1308 CD2 LEU B 16 23.370 26.419 18.841 1.00 26.29 C ATOM 0 H LEU B 16 18.956 28.249 18.751 1.00 26.59 H new ATOM 0 HA LEU B 16 20.826 28.909 20.758 1.00 27.03 H new ATOM 0 HB2 LEU B 16 20.748 27.146 18.730 1.00 28.15 H new ATOM 0 HB3 LEU B 16 21.718 28.368 17.932 1.00 28.15 H new ATOM 0 HG LEU B 16 23.334 28.341 19.845 1.00 28.00 H new ATOM 0 HD11 LEU B 16 23.150 26.579 21.576 1.00 30.50 H new ATOM 0 HD12 LEU B 16 21.758 27.686 21.635 1.00 30.50 H new ATOM 0 HD13 LEU B 16 21.583 26.075 20.900 1.00 30.50 H new ATOM 0 HD21 LEU B 16 24.253 26.066 19.375 1.00 26.29 H new ATOM 0 HD22 LEU B 16 22.689 25.584 18.674 1.00 26.29 H new ATOM 0 HD23 LEU B 16 23.670 26.840 17.881 1.00 26.29 H new ATOM 1320 N LEU B 17 20.739 31.001 18.246 1.00 23.83 N ATOM 1321 CA LEU B 17 21.147 32.365 17.815 1.00 25.91 C ATOM 1322 C LEU B 17 20.665 33.348 18.889 1.00 28.74 C ATOM 1323 O LEU B 17 21.299 34.344 19.178 1.00 29.35 O ATOM 1324 CB LEU B 17 20.454 32.683 16.474 1.00 23.53 C ATOM 1325 CG LEU B 17 21.235 33.751 15.677 1.00 23.31 C ATOM 1326 CD1 LEU B 17 22.420 33.104 14.920 1.00 16.92 C ATOM 1327 CD2 LEU B 17 20.295 34.474 14.664 1.00 19.75 C ATOM 0 H LEU B 17 20.073 30.539 17.626 1.00 23.83 H new ATOM 0 HA LEU B 17 22.227 32.438 17.689 1.00 25.91 H new ATOM 0 HB2 LEU B 17 20.371 31.772 15.881 1.00 23.53 H new ATOM 0 HB3 LEU B 17 19.440 33.036 16.661 1.00 23.53 H new ATOM 0 HG LEU B 17 21.624 34.484 16.384 1.00 23.31 H new ATOM 0 HD11 LEU B 17 22.959 33.871 14.364 1.00 16.92 H new ATOM 0 HD12 LEU B 17 23.095 32.633 15.635 1.00 16.92 H new ATOM 0 HD13 LEU B 17 22.042 32.352 14.227 1.00 16.92 H new ATOM 0 HD21 LEU B 17 20.863 35.223 14.112 1.00 19.75 H new ATOM 0 HD22 LEU B 17 19.882 33.745 13.967 1.00 19.75 H new ATOM 0 HD23 LEU B 17 19.483 34.960 15.204 1.00 19.75 H new ATOM 1339 N GLU B 18 19.525 33.060 19.474 1.00 30.66 N ATOM 1340 CA GLU B 18 18.956 33.950 20.527 1.00 33.61 C ATOM 1341 C GLU B 18 19.570 33.584 21.888 1.00 34.68 C ATOM 1342 O GLU B 18 19.966 34.444 22.650 1.00 34.80 O ATOM 1343 CB GLU B 18 17.405 33.796 20.520 1.00 35.91 C ATOM 1344 CG GLU B 18 16.884 32.972 21.713 1.00 37.64 C ATOM 1345 CD GLU B 18 15.369 32.802 21.586 1.00 40.24 C ATOM 1346 OE1 GLU B 18 14.761 33.591 20.882 1.00 40.39 O ATOM 1347 OE2 GLU B 18 14.843 31.884 22.193 1.00 40.89 O ATOM 0 H GLU B 18 18.962 32.236 19.261 1.00 30.66 H new ATOM 0 HA GLU B 18 19.196 34.995 20.331 1.00 33.61 H new ATOM 0 HB2 GLU B 18 16.946 34.784 20.538 1.00 35.91 H new ATOM 0 HB3 GLU B 18 17.096 33.318 19.591 1.00 35.91 H new ATOM 0 HG2 GLU B 18 17.370 31.997 21.736 1.00 37.64 H new ATOM 0 HG3 GLU B 18 17.128 33.473 22.650 1.00 37.64 H new ATOM 1354 N LYS B 19 19.656 32.317 22.195 1.00 34.95 N ATOM 1355 CA LYS B 19 20.247 31.904 23.498 1.00 36.04 C ATOM 1356 C LYS B 19 21.580 32.631 23.691 1.00 35.87 C ATOM 1357 O LYS B 19 21.823 33.252 24.706 1.00 36.90 O ATOM 1358 CB LYS B 19 20.458 30.388 23.502 1.00 36.58 C ATOM 1359 CG LYS B 19 20.314 29.848 24.943 1.00 39.52 C ATOM 1360 CD LYS B 19 21.153 28.593 25.099 1.00 41.12 C ATOM 1361 CE LYS B 19 20.716 27.819 26.345 1.00 43.76 C ATOM 1362 NZ LYS B 19 20.690 28.739 27.517 1.00 45.38 N ATOM 0 H LYS B 19 19.342 31.551 21.599 1.00 34.95 H new ATOM 0 HA LYS B 19 19.576 32.165 24.316 1.00 36.04 H new ATOM 0 HB2 LYS B 19 19.730 29.908 22.848 1.00 36.58 H new ATOM 0 HB3 LYS B 19 21.446 30.147 23.110 1.00 36.58 H new ATOM 0 HG2 LYS B 19 20.634 30.604 25.660 1.00 39.52 H new ATOM 0 HG3 LYS B 19 19.268 29.628 25.158 1.00 39.52 H new ATOM 0 HD2 LYS B 19 21.048 27.964 24.215 1.00 41.12 H new ATOM 0 HD3 LYS B 19 22.207 28.859 25.178 1.00 41.12 H new ATOM 0 HE2 LYS B 19 19.729 27.384 26.188 1.00 43.76 H new ATOM 0 HE3 LYS B 19 21.402 26.993 26.533 1.00 43.76 H new ATOM 0 HZ1 LYS B 19 20.680 28.182 28.395 1.00 45.38 H new ATOM 0 HZ2 LYS B 19 21.535 29.345 27.501 1.00 45.38 H new ATOM 0 HZ3 LYS B 19 19.837 29.333 27.473 1.00 45.38 H new ATOM 1376 N PHE B 20 22.438 32.563 22.712 1.00 35.16 N ATOM 1377 CA PHE B 20 23.752 33.249 22.804 1.00 34.19 C ATOM 1378 C PHE B 20 23.618 34.645 22.194 1.00 34.42 C ATOM 1379 O PHE B 20 24.562 35.407 22.137 1.00 33.94 O ATOM 1380 CB PHE B 20 24.775 32.439 22.016 1.00 34.18 C ATOM 1381 CG PHE B 20 25.154 31.206 22.797 1.00 32.04 C ATOM 1382 CD1 PHE B 20 24.378 30.047 22.690 1.00 31.71 C ATOM 1383 CD2 PHE B 20 26.275 31.224 23.632 1.00 34.13 C ATOM 1384 CE1 PHE B 20 24.724 28.904 23.418 1.00 31.01 C ATOM 1385 CE2 PHE B 20 26.620 30.084 24.362 1.00 33.69 C ATOM 1386 CZ PHE B 20 25.844 28.922 24.255 1.00 32.95 C ATOM 0 H PHE B 20 22.280 32.054 21.842 1.00 35.16 H new ATOM 0 HA PHE B 20 24.072 33.334 23.842 1.00 34.19 H new ATOM 0 HB2 PHE B 20 24.362 32.156 21.048 1.00 34.18 H new ATOM 0 HB3 PHE B 20 25.660 33.044 21.820 1.00 34.18 H new ATOM 0 HD1 PHE B 20 23.512 30.035 22.045 1.00 31.71 H new ATOM 0 HD2 PHE B 20 26.874 32.119 23.713 1.00 34.13 H new ATOM 0 HE1 PHE B 20 24.127 28.008 23.334 1.00 31.01 H new ATOM 0 HE2 PHE B 20 27.485 30.098 25.009 1.00 33.69 H new ATOM 0 HZ PHE B 20 26.111 28.040 24.819 1.00 32.95 H new ATOM 1396 N ARG B 21 22.439 34.977 21.739 1.00 33.90 N ATOM 1397 CA ARG B 21 22.204 36.317 21.130 1.00 35.50 C ATOM 1398 C ARG B 21 23.212 36.578 20.009 1.00 34.22 C ATOM 1399 O ARG B 21 23.646 37.694 19.806 1.00 33.41 O ATOM 1400 CB ARG B 21 22.343 37.402 22.204 1.00 38.56 C ATOM 1401 CG ARG B 21 21.167 37.309 23.189 1.00 42.96 C ATOM 1402 CD ARG B 21 19.836 37.686 22.492 1.00 46.75 C ATOM 1403 NE ARG B 21 19.046 38.622 23.358 1.00 50.46 N ATOM 1404 CZ ARG B 21 18.878 38.392 24.635 1.00 51.88 C ATOM 1405 NH1 ARG B 21 19.323 37.291 25.174 1.00 54.10 N ATOM 1406 NH2 ARG B 21 18.237 39.259 25.370 1.00 54.21 N ATOM 0 H ARG B 21 21.620 34.369 21.764 1.00 33.90 H new ATOM 0 HA ARG B 21 21.197 36.340 20.712 1.00 35.50 H new ATOM 0 HB2 ARG B 21 23.286 37.281 22.737 1.00 38.56 H new ATOM 0 HB3 ARG B 21 22.363 38.387 21.739 1.00 38.56 H new ATOM 0 HG2 ARG B 21 21.100 36.297 23.588 1.00 42.96 H new ATOM 0 HG3 ARG B 21 21.341 37.974 24.035 1.00 42.96 H new ATOM 0 HD2 ARG B 21 20.041 38.155 21.529 1.00 46.75 H new ATOM 0 HD3 ARG B 21 19.254 36.786 22.291 1.00 46.75 H new ATOM 0 HE ARG B 21 18.631 39.456 22.942 1.00 50.46 H new ATOM 0 HH11 ARG B 21 19.806 36.601 24.599 1.00 54.10 H new ATOM 0 HH12 ARG B 21 19.188 37.120 26.170 1.00 54.10 H new ATOM 0 HH21 ARG B 21 17.869 40.112 24.949 1.00 54.21 H new ATOM 0 HH22 ARG B 21 18.104 39.084 26.366 1.00 54.21 H new ATOM 1420 N TYR B 22 23.586 35.569 19.267 1.00 31.03 N ATOM 1421 CA TYR B 22 24.554 35.793 18.162 1.00 30.00 C ATOM 1422 C TYR B 22 23.851 36.604 17.046 1.00 28.60 C ATOM 1423 O TYR B 22 22.654 36.492 16.891 1.00 27.38 O ATOM 1424 CB TYR B 22 24.982 34.431 17.591 1.00 26.97 C ATOM 1425 CG TYR B 22 26.077 33.798 18.441 1.00 28.47 C ATOM 1426 CD1 TYR B 22 27.300 34.458 18.653 1.00 28.83 C ATOM 1427 CD2 TYR B 22 25.863 32.538 19.020 1.00 26.95 C ATOM 1428 CE1 TYR B 22 28.292 33.861 19.439 1.00 27.02 C ATOM 1429 CE2 TYR B 22 26.858 31.944 19.804 1.00 26.27 C ATOM 1430 CZ TYR B 22 28.071 32.606 20.015 1.00 26.46 C ATOM 1431 OH TYR B 22 29.052 32.020 20.789 1.00 23.82 O ATOM 0 H TYR B 22 23.264 34.608 19.379 1.00 31.03 H new ATOM 0 HA TYR B 22 25.426 36.334 18.530 1.00 30.00 H new ATOM 0 HB2 TYR B 22 24.120 33.765 17.548 1.00 26.97 H new ATOM 0 HB3 TYR B 22 25.339 34.558 16.569 1.00 26.97 H new ATOM 0 HD1 TYR B 22 27.474 35.427 18.209 1.00 28.83 H new ATOM 0 HD2 TYR B 22 24.926 32.025 18.860 1.00 26.95 H new ATOM 0 HE1 TYR B 22 29.230 34.371 19.601 1.00 27.02 H new ATOM 0 HE2 TYR B 22 26.689 30.973 20.246 1.00 26.27 H new ATOM 0 HH TYR B 22 29.832 32.611 20.831 1.00 23.82 H new ATOM 1441 N PRO B 23 24.598 37.377 16.277 1.00 29.13 N ATOM 1442 CA PRO B 23 24.007 38.152 15.167 1.00 28.62 C ATOM 1443 C PRO B 23 23.274 37.205 14.201 1.00 28.74 C ATOM 1444 O PRO B 23 23.326 36.001 14.338 1.00 26.54 O ATOM 1445 CB PRO B 23 25.212 38.831 14.467 1.00 29.12 C ATOM 1446 CG PRO B 23 26.493 38.435 15.255 1.00 29.87 C ATOM 1447 CD PRO B 23 26.054 37.554 16.446 1.00 29.51 C ATOM 0 HA PRO B 23 23.276 38.884 15.509 1.00 28.62 H new ATOM 0 HB2 PRO B 23 25.285 38.507 13.429 1.00 29.12 H new ATOM 0 HB3 PRO B 23 25.088 39.914 14.455 1.00 29.12 H new ATOM 0 HG2 PRO B 23 27.186 37.892 14.612 1.00 29.87 H new ATOM 0 HG3 PRO B 23 27.016 39.324 15.608 1.00 29.87 H new ATOM 0 HD2 PRO B 23 26.571 36.595 16.438 1.00 29.51 H new ATOM 0 HD3 PRO B 23 26.285 38.033 17.397 1.00 29.51 H new ATOM 1455 N TRP B 24 22.613 37.750 13.218 1.00 24.77 N ATOM 1456 CA TRP B 24 21.892 36.899 12.223 1.00 26.20 C ATOM 1457 C TRP B 24 22.908 36.361 11.217 1.00 24.23 C ATOM 1458 O TRP B 24 22.632 35.466 10.444 1.00 20.77 O ATOM 1459 CB TRP B 24 20.839 37.746 11.502 1.00 28.27 C ATOM 1460 CG TRP B 24 20.171 36.943 10.429 1.00 30.88 C ATOM 1461 CD1 TRP B 24 20.392 37.092 9.103 1.00 31.38 C ATOM 1462 CD2 TRP B 24 19.172 35.885 10.560 1.00 29.00 C ATOM 1463 NE1 TRP B 24 19.594 36.198 8.412 1.00 31.09 N ATOM 1464 CE2 TRP B 24 18.824 35.433 9.265 1.00 31.07 C ATOM 1465 CE3 TRP B 24 18.538 35.278 11.662 1.00 30.12 C ATOM 1466 CZ2 TRP B 24 17.882 34.421 9.072 1.00 31.07 C ATOM 1467 CZ3 TRP B 24 17.593 34.259 11.468 1.00 31.73 C ATOM 1468 CH2 TRP B 24 17.264 33.834 10.176 1.00 30.51 C ATOM 0 H TRP B 24 22.539 38.755 13.058 1.00 24.77 H new ATOM 0 HA TRP B 24 21.395 36.068 12.723 1.00 26.20 H new ATOM 0 HB2 TRP B 24 20.096 38.100 12.217 1.00 28.27 H new ATOM 0 HB3 TRP B 24 21.308 38.628 11.067 1.00 28.27 H new ATOM 0 HD1 TRP B 24 21.080 37.795 8.656 1.00 31.38 H new ATOM 0 HE1 TRP B 24 19.577 36.114 7.396 1.00 31.09 H new ATOM 0 HE3 TRP B 24 18.781 35.599 12.664 1.00 30.12 H new ATOM 0 HZ2 TRP B 24 17.633 34.094 8.073 1.00 31.07 H new ATOM 0 HZ3 TRP B 24 17.116 33.800 12.321 1.00 31.73 H new ATOM 0 HH2 TRP B 24 16.532 33.052 10.034 1.00 30.51 H new ATOM 1479 N GLU B 25 24.081 36.923 11.226 1.00 21.71 N ATOM 1480 CA GLU B 25 25.148 36.493 10.285 1.00 23.69 C ATOM 1481 C GLU B 25 25.703 35.118 10.687 1.00 22.17 C ATOM 1482 O GLU B 25 26.280 34.421 9.878 1.00 20.98 O ATOM 1483 CB GLU B 25 26.265 37.545 10.350 1.00 29.06 C ATOM 1484 CG GLU B 25 27.500 37.090 9.569 1.00 37.12 C ATOM 1485 CD GLU B 25 27.123 36.844 8.107 1.00 42.03 C ATOM 1486 OE1 GLU B 25 26.734 35.731 7.795 1.00 44.52 O ATOM 1487 OE2 GLU B 25 27.230 37.774 7.323 1.00 44.49 O ATOM 0 H GLU B 25 24.350 37.677 11.858 1.00 21.71 H new ATOM 0 HA GLU B 25 24.748 36.407 9.275 1.00 23.69 H new ATOM 0 HB2 GLU B 25 25.903 38.490 9.944 1.00 29.06 H new ATOM 0 HB3 GLU B 25 26.536 37.728 11.390 1.00 29.06 H new ATOM 0 HG2 GLU B 25 28.281 37.848 9.631 1.00 37.12 H new ATOM 0 HG3 GLU B 25 27.905 36.178 10.009 1.00 37.12 H new ATOM 1494 N LEU B 26 25.575 34.736 11.934 1.00 18.07 N ATOM 1495 CA LEU B 26 26.143 33.420 12.381 1.00 16.50 C ATOM 1496 C LEU B 26 25.116 32.305 12.273 1.00 16.77 C ATOM 1497 O LEU B 26 25.232 31.279 12.914 1.00 16.07 O ATOM 1498 CB LEU B 26 26.634 33.553 13.820 1.00 18.60 C ATOM 1499 CG LEU B 26 27.428 34.858 13.964 1.00 21.90 C ATOM 1500 CD1 LEU B 26 28.178 34.855 15.285 1.00 24.06 C ATOM 1501 CD2 LEU B 26 28.445 34.992 12.832 1.00 25.09 C ATOM 0 H LEU B 26 25.104 35.274 12.661 1.00 18.07 H new ATOM 0 HA LEU B 26 26.976 33.158 11.728 1.00 16.50 H new ATOM 0 HB2 LEU B 26 25.788 33.550 14.507 1.00 18.60 H new ATOM 0 HB3 LEU B 26 27.261 32.701 14.083 1.00 18.60 H new ATOM 0 HG LEU B 26 26.728 35.692 13.926 1.00 21.90 H new ATOM 0 HD11 LEU B 26 28.741 35.783 15.386 1.00 24.06 H new ATOM 0 HD12 LEU B 26 27.467 34.771 16.107 1.00 24.06 H new ATOM 0 HD13 LEU B 26 28.865 34.009 15.312 1.00 24.06 H new ATOM 0 HD21 LEU B 26 28.999 35.923 12.949 1.00 25.09 H new ATOM 0 HD22 LEU B 26 29.137 34.151 12.864 1.00 25.09 H new ATOM 0 HD23 LEU B 26 27.925 34.998 11.874 1.00 25.09 H new ATOM 1513 N MET B 27 24.137 32.468 11.438 1.00 15.51 N ATOM 1514 CA MET B 27 23.152 31.388 11.268 1.00 15.51 C ATOM 1515 C MET B 27 23.882 30.117 10.759 1.00 15.79 C ATOM 1516 O MET B 27 23.606 29.039 11.246 1.00 14.86 O ATOM 1517 CB MET B 27 22.060 31.833 10.264 1.00 16.03 C ATOM 1518 CG MET B 27 20.830 32.435 10.968 1.00 14.48 C ATOM 1519 SD MET B 27 19.364 31.968 10.023 1.00 11.00 S ATOM 1520 CE MET B 27 18.988 30.470 10.944 1.00 16.96 C ATOM 0 H MET B 27 23.980 33.301 10.870 1.00 15.51 H new ATOM 0 HA MET B 27 22.671 31.164 12.220 1.00 15.51 H new ATOM 0 HB2 MET B 27 22.479 32.568 9.577 1.00 16.03 H new ATOM 0 HB3 MET B 27 21.750 30.977 9.664 1.00 16.03 H new ATOM 0 HG2 MET B 27 20.758 32.066 11.991 1.00 14.48 H new ATOM 0 HG3 MET B 27 20.917 33.520 11.026 1.00 14.48 H new ATOM 0 HE1 MET B 27 18.097 30.000 10.527 1.00 16.96 H new ATOM 0 HE2 MET B 27 19.829 29.780 10.875 1.00 16.96 H new ATOM 0 HE3 MET B 27 18.810 30.721 11.990 1.00 16.96 H new ATOM 1530 N PRO B 28 24.795 30.256 9.801 1.00 15.25 N ATOM 1531 CA PRO B 28 25.535 29.091 9.271 1.00 16.18 C ATOM 1532 C PRO B 28 26.324 28.416 10.397 1.00 15.53 C ATOM 1533 O PRO B 28 26.525 27.225 10.388 1.00 16.52 O ATOM 1534 CB PRO B 28 26.468 29.682 8.182 1.00 16.78 C ATOM 1535 CG PRO B 28 25.974 31.124 7.922 1.00 19.84 C ATOM 1536 CD PRO B 28 25.170 31.540 9.162 1.00 17.18 C ATOM 0 HA PRO B 28 24.884 28.321 8.857 1.00 16.18 H new ATOM 0 HB2 PRO B 28 27.505 29.681 8.517 1.00 16.78 H new ATOM 0 HB3 PRO B 28 26.427 29.087 7.270 1.00 16.78 H new ATOM 0 HG2 PRO B 28 26.815 31.799 7.760 1.00 19.84 H new ATOM 0 HG3 PRO B 28 25.355 31.166 7.026 1.00 19.84 H new ATOM 0 HD2 PRO B 28 25.765 32.160 9.833 1.00 17.18 H new ATOM 0 HD3 PRO B 28 24.289 32.121 8.889 1.00 17.18 H new ATOM 1544 N LEU B 29 26.767 29.161 11.372 1.00 13.35 N ATOM 1545 CA LEU B 29 27.531 28.532 12.488 1.00 12.43 C ATOM 1546 C LEU B 29 26.554 27.849 13.444 1.00 12.94 C ATOM 1547 O LEU B 29 26.678 26.673 13.724 1.00 13.87 O ATOM 1548 CB LEU B 29 28.342 29.600 13.224 1.00 15.82 C ATOM 1549 CG LEU B 29 29.119 30.445 12.206 1.00 12.60 C ATOM 1550 CD1 LEU B 29 30.073 31.382 12.951 1.00 13.73 C ATOM 1551 CD2 LEU B 29 29.923 29.525 11.271 1.00 13.81 C ATOM 0 H LEU B 29 26.635 30.170 11.445 1.00 13.35 H new ATOM 0 HA LEU B 29 28.220 27.786 12.091 1.00 12.43 H new ATOM 0 HB2 LEU B 29 27.678 30.236 13.810 1.00 15.82 H new ATOM 0 HB3 LEU B 29 29.032 29.129 13.924 1.00 15.82 H new ATOM 0 HG LEU B 29 28.419 31.033 11.612 1.00 12.60 H new ATOM 0 HD11 LEU B 29 30.627 31.984 12.231 1.00 13.73 H new ATOM 0 HD12 LEU B 29 29.501 32.037 13.608 1.00 13.73 H new ATOM 0 HD13 LEU B 29 30.772 30.793 13.545 1.00 13.73 H new ATOM 0 HD21 LEU B 29 30.473 30.130 10.550 1.00 13.81 H new ATOM 0 HD22 LEU B 29 30.625 28.933 11.858 1.00 13.81 H new ATOM 0 HD23 LEU B 29 29.242 28.859 10.741 1.00 13.81 H new ATOM 1563 N MET B 30 25.566 28.552 13.933 1.00 13.14 N ATOM 1564 CA MET B 30 24.588 27.895 14.841 1.00 14.92 C ATOM 1565 C MET B 30 24.045 26.662 14.127 1.00 15.06 C ATOM 1566 O MET B 30 23.706 25.666 14.735 1.00 14.78 O ATOM 1567 CB MET B 30 23.425 28.846 15.134 1.00 14.70 C ATOM 1568 CG MET B 30 23.903 30.039 15.961 1.00 10.57 C ATOM 1569 SD MET B 30 24.479 29.470 17.584 1.00 7.09 S ATOM 1570 CE MET B 30 26.236 29.849 17.374 1.00 13.40 C ATOM 0 H MET B 30 25.397 29.540 13.745 1.00 13.14 H new ATOM 0 HA MET B 30 25.073 27.626 15.779 1.00 14.92 H new ATOM 0 HB2 MET B 30 22.989 29.196 14.198 1.00 14.70 H new ATOM 0 HB3 MET B 30 22.640 28.315 15.672 1.00 14.70 H new ATOM 0 HG2 MET B 30 24.709 30.555 15.439 1.00 10.57 H new ATOM 0 HG3 MET B 30 23.092 30.757 16.084 1.00 10.57 H new ATOM 0 HE1 MET B 30 26.765 29.653 18.307 1.00 13.40 H new ATOM 0 HE2 MET B 30 26.651 29.224 16.583 1.00 13.40 H new ATOM 0 HE3 MET B 30 26.352 30.899 17.105 1.00 13.40 H new ATOM 1580 N TYR B 31 23.965 26.736 12.828 1.00 13.82 N ATOM 1581 CA TYR B 31 23.448 25.590 12.036 1.00 14.24 C ATOM 1582 C TYR B 31 24.380 24.378 12.200 1.00 15.20 C ATOM 1583 O TYR B 31 23.961 23.311 12.601 1.00 15.23 O ATOM 1584 CB TYR B 31 23.377 25.993 10.559 1.00 15.18 C ATOM 1585 CG TYR B 31 23.032 24.788 9.719 1.00 19.70 C ATOM 1586 CD1 TYR B 31 24.047 23.919 9.302 1.00 21.03 C ATOM 1587 CD2 TYR B 31 21.702 24.538 9.356 1.00 22.09 C ATOM 1588 CE1 TYR B 31 23.736 22.801 8.525 1.00 22.51 C ATOM 1589 CE2 TYR B 31 21.392 23.417 8.580 1.00 25.56 C ATOM 1590 CZ TYR B 31 22.408 22.548 8.163 1.00 25.00 C ATOM 1591 OH TYR B 31 22.101 21.444 7.395 1.00 30.46 O ATOM 0 H TYR B 31 24.239 27.550 12.278 1.00 13.82 H new ATOM 0 HA TYR B 31 22.453 25.320 12.391 1.00 14.24 H new ATOM 0 HB2 TYR B 31 22.627 26.772 10.420 1.00 15.18 H new ATOM 0 HB3 TYR B 31 24.332 26.410 10.239 1.00 15.18 H new ATOM 0 HD1 TYR B 31 25.072 24.113 9.581 1.00 21.03 H new ATOM 0 HD2 TYR B 31 20.918 25.209 9.675 1.00 22.09 H new ATOM 0 HE1 TYR B 31 24.520 22.132 8.203 1.00 22.51 H new ATOM 0 HE2 TYR B 31 20.367 23.221 8.302 1.00 25.56 H new ATOM 0 HH TYR B 31 21.135 21.415 7.235 1.00 30.46 H new ATOM 1601 N VAL B 32 25.638 24.533 11.881 1.00 14.03 N ATOM 1602 CA VAL B 32 26.592 23.388 12.003 1.00 12.14 C ATOM 1603 C VAL B 32 26.614 22.869 13.442 1.00 12.91 C ATOM 1604 O VAL B 32 26.435 21.693 13.686 1.00 14.47 O ATOM 1605 CB VAL B 32 27.998 23.844 11.600 1.00 12.64 C ATOM 1606 CG1 VAL B 32 28.949 22.653 11.650 1.00 12.95 C ATOM 1607 CG2 VAL B 32 27.965 24.406 10.176 1.00 14.27 C ATOM 0 H VAL B 32 26.048 25.403 11.541 1.00 14.03 H new ATOM 0 HA VAL B 32 26.266 22.585 11.342 1.00 12.14 H new ATOM 0 HB VAL B 32 28.341 24.617 12.288 1.00 12.64 H new ATOM 0 HG11 VAL B 32 29.950 22.975 11.364 1.00 12.95 H new ATOM 0 HG12 VAL B 32 28.973 22.249 12.662 1.00 12.95 H new ATOM 0 HG13 VAL B 32 28.604 21.883 10.960 1.00 12.95 H new ATOM 0 HG21 VAL B 32 28.965 24.730 9.890 1.00 14.27 H new ATOM 0 HG22 VAL B 32 27.623 23.633 9.488 1.00 14.27 H new ATOM 0 HG23 VAL B 32 27.283 25.255 10.136 1.00 14.27 H new ATOM 1617 N ILE B 33 26.834 23.733 14.396 1.00 13.72 N ATOM 1618 CA ILE B 33 26.871 23.293 15.822 1.00 9.81 C ATOM 1619 C ILE B 33 25.712 22.321 16.102 1.00 12.06 C ATOM 1620 O ILE B 33 25.908 21.222 16.581 1.00 13.15 O ATOM 1621 CB ILE B 33 26.768 24.553 16.693 1.00 11.56 C ATOM 1622 CG1 ILE B 33 28.127 25.275 16.655 1.00 12.90 C ATOM 1623 CG2 ILE B 33 26.413 24.190 18.138 1.00 12.06 C ATOM 1624 CD1 ILE B 33 28.024 26.684 17.252 1.00 11.54 C ATOM 0 H ILE B 33 26.991 24.730 14.249 1.00 13.72 H new ATOM 0 HA ILE B 33 27.797 22.763 16.047 1.00 9.81 H new ATOM 0 HB ILE B 33 25.980 25.199 16.307 1.00 11.56 H new ATOM 0 HG12 ILE B 33 28.865 24.695 17.209 1.00 12.90 H new ATOM 0 HG13 ILE B 33 28.479 25.338 15.625 1.00 12.90 H new ATOM 0 HG21 ILE B 33 26.346 25.099 18.736 1.00 12.06 H new ATOM 0 HG22 ILE B 33 25.455 23.671 18.158 1.00 12.06 H new ATOM 0 HG23 ILE B 33 27.186 23.541 18.550 1.00 12.06 H new ATOM 0 HD11 ILE B 33 28.999 27.169 17.211 1.00 11.54 H new ATOM 0 HD12 ILE B 33 27.304 27.269 16.681 1.00 11.54 H new ATOM 0 HD13 ILE B 33 27.696 26.617 18.289 1.00 11.54 H new ATOM 1636 N LEU B 34 24.518 22.718 15.785 1.00 13.55 N ATOM 1637 CA LEU B 34 23.327 21.839 15.996 1.00 16.27 C ATOM 1638 C LEU B 34 23.520 20.525 15.210 1.00 18.00 C ATOM 1639 O LEU B 34 23.209 19.454 15.694 1.00 20.35 O ATOM 1640 CB LEU B 34 22.086 22.620 15.462 1.00 15.33 C ATOM 1641 CG LEU B 34 21.088 23.188 16.556 1.00 18.88 C ATOM 1642 CD1 LEU B 34 21.543 23.013 18.010 1.00 18.63 C ATOM 1643 CD2 LEU B 34 20.870 24.691 16.316 1.00 18.04 C ATOM 0 H LEU B 34 24.306 23.630 15.381 1.00 13.55 H new ATOM 0 HA LEU B 34 23.193 21.588 17.048 1.00 16.27 H new ATOM 0 HB2 LEU B 34 22.441 23.454 14.857 1.00 15.33 H new ATOM 0 HB3 LEU B 34 21.527 21.961 14.798 1.00 15.33 H new ATOM 0 HG LEU B 34 20.177 22.601 16.437 1.00 18.88 H new ATOM 0 HD11 LEU B 34 20.792 23.434 18.679 1.00 18.63 H new ATOM 0 HD12 LEU B 34 21.669 21.952 18.227 1.00 18.63 H new ATOM 0 HD13 LEU B 34 22.492 23.529 18.159 1.00 18.63 H new ATOM 0 HD21 LEU B 34 20.184 25.084 17.067 1.00 18.04 H new ATOM 0 HD22 LEU B 34 21.824 25.213 16.388 1.00 18.04 H new ATOM 0 HD23 LEU B 34 20.447 24.843 15.323 1.00 18.04 H new ATOM 1655 N LYS B 35 24.019 20.600 14.010 1.00 16.90 N ATOM 1656 CA LYS B 35 24.220 19.357 13.200 1.00 19.51 C ATOM 1657 C LYS B 35 25.021 18.340 14.005 1.00 18.97 C ATOM 1658 O LYS B 35 24.873 17.144 13.844 1.00 18.29 O ATOM 1659 CB LYS B 35 24.989 19.703 11.918 1.00 23.32 C ATOM 1660 CG LYS B 35 24.976 18.503 10.970 1.00 27.46 C ATOM 1661 CD LYS B 35 25.710 18.868 9.678 1.00 30.03 C ATOM 1662 CE LYS B 35 25.551 17.738 8.660 1.00 33.24 C ATOM 1663 NZ LYS B 35 24.138 17.687 8.190 1.00 34.14 N ATOM 0 H LYS B 35 24.298 21.467 13.550 1.00 16.90 H new ATOM 0 HA LYS B 35 23.248 18.934 12.946 1.00 19.51 H new ATOM 0 HB2 LYS B 35 24.536 20.567 11.433 1.00 23.32 H new ATOM 0 HB3 LYS B 35 26.016 19.976 12.161 1.00 23.32 H new ATOM 0 HG2 LYS B 35 25.455 17.646 11.444 1.00 27.46 H new ATOM 0 HG3 LYS B 35 23.949 18.212 10.748 1.00 27.46 H new ATOM 0 HD2 LYS B 35 25.310 19.797 9.271 1.00 30.03 H new ATOM 0 HD3 LYS B 35 26.767 19.039 9.884 1.00 30.03 H new ATOM 0 HE2 LYS B 35 26.221 17.899 7.815 1.00 33.24 H new ATOM 0 HE3 LYS B 35 25.830 16.786 9.111 1.00 33.24 H new ATOM 0 HZ1 LYS B 35 24.094 17.192 7.277 1.00 34.14 H new ATOM 0 HZ2 LYS B 35 23.558 17.179 8.888 1.00 34.14 H new ATOM 0 HZ3 LYS B 35 23.775 18.655 8.077 1.00 34.14 H new ATOM 1677 N ASP B 36 25.878 18.809 14.858 1.00 17.40 N ATOM 1678 CA ASP B 36 26.715 17.891 15.673 1.00 17.99 C ATOM 1679 C ASP B 36 25.984 17.503 16.958 1.00 20.53 C ATOM 1680 O ASP B 36 26.025 16.370 17.394 1.00 21.50 O ATOM 1681 CB ASP B 36 28.008 18.620 16.013 1.00 17.75 C ATOM 1682 CG ASP B 36 28.484 19.374 14.768 1.00 19.30 C ATOM 1683 OD1 ASP B 36 28.656 18.735 13.743 1.00 18.21 O ATOM 1684 OD2 ASP B 36 28.670 20.575 14.863 1.00 17.31 O ATOM 0 H ASP B 36 26.038 19.802 15.029 1.00 17.40 H new ATOM 0 HA ASP B 36 26.923 16.978 15.115 1.00 17.99 H new ATOM 0 HB2 ASP B 36 27.845 19.315 16.837 1.00 17.75 H new ATOM 0 HB3 ASP B 36 28.768 17.910 16.339 1.00 17.75 H new ATOM 1689 N ALA B 37 25.334 18.444 17.574 1.00 17.76 N ATOM 1690 CA ALA B 37 24.614 18.157 18.844 1.00 20.31 C ATOM 1691 C ALA B 37 23.247 17.547 18.551 1.00 21.98 C ATOM 1692 O ALA B 37 22.281 17.818 19.236 1.00 20.93 O ATOM 1693 CB ALA B 37 24.436 19.474 19.600 1.00 16.79 C ATOM 0 H ALA B 37 25.269 19.409 17.251 1.00 17.76 H new ATOM 0 HA ALA B 37 25.187 17.448 19.441 1.00 20.31 H new ATOM 0 HB1 ALA B 37 23.910 19.288 20.536 1.00 16.79 H new ATOM 0 HB2 ALA B 37 25.414 19.906 19.813 1.00 16.79 H new ATOM 0 HB3 ALA B 37 23.858 20.168 18.990 1.00 16.79 H new ATOM 1699 N ASP B 38 23.143 16.740 17.541 1.00 22.08 N ATOM 1700 CA ASP B 38 21.822 16.145 17.228 1.00 24.70 C ATOM 1701 C ASP B 38 20.807 17.281 17.082 1.00 27.43 C ATOM 1702 O ASP B 38 19.611 17.070 17.070 1.00 26.89 O ATOM 1703 CB ASP B 38 21.407 15.208 18.372 1.00 26.17 C ATOM 1704 CG ASP B 38 20.402 14.172 17.861 1.00 26.41 C ATOM 1705 OD1 ASP B 38 19.879 14.368 16.776 1.00 30.65 O ATOM 1706 OD2 ASP B 38 20.174 13.201 18.563 1.00 29.79 O ATOM 0 H ASP B 38 23.907 16.468 16.923 1.00 22.08 H new ATOM 0 HA ASP B 38 21.867 15.571 16.302 1.00 24.70 H new ATOM 0 HB2 ASP B 38 22.285 14.706 18.778 1.00 26.17 H new ATOM 0 HB3 ASP B 38 20.966 15.785 19.184 1.00 26.17 H new ATOM 1711 N ALA B 39 21.296 18.488 16.974 1.00 25.83 N ATOM 1712 CA ALA B 39 20.403 19.667 16.831 1.00 28.40 C ATOM 1713 C ALA B 39 19.750 19.991 18.181 1.00 30.32 C ATOM 1714 O ALA B 39 18.889 20.844 18.275 1.00 32.55 O ATOM 1715 CB ALA B 39 19.340 19.373 15.769 1.00 28.82 C ATOM 0 H ALA B 39 22.292 18.706 16.979 1.00 25.83 H new ATOM 0 HA ALA B 39 20.984 20.534 16.515 1.00 28.40 H new ATOM 0 HB1 ALA B 39 18.684 20.237 15.662 1.00 28.82 H new ATOM 0 HB2 ALA B 39 19.826 19.166 14.815 1.00 28.82 H new ATOM 0 HB3 ALA B 39 18.753 18.506 16.072 1.00 28.82 H new ATOM 1721 N ASN B 40 20.163 19.328 19.229 1.00 29.50 N ATOM 1722 CA ASN B 40 19.577 19.612 20.571 1.00 32.01 C ATOM 1723 C ASN B 40 20.293 20.822 21.174 1.00 32.47 C ATOM 1724 O ASN B 40 21.439 20.745 21.570 1.00 29.40 O ATOM 1725 CB ASN B 40 19.764 18.397 21.484 1.00 33.06 C ATOM 1726 CG ASN B 40 18.754 17.311 21.107 1.00 33.55 C ATOM 1727 OD1 ASN B 40 18.482 17.095 19.943 1.00 35.11 O ATOM 1728 ND2 ASN B 40 18.181 16.614 22.050 1.00 33.85 N ATOM 0 H ASN B 40 20.880 18.603 19.213 1.00 29.50 H new ATOM 0 HA ASN B 40 18.512 19.821 20.473 1.00 32.01 H new ATOM 0 HB2 ASN B 40 20.779 18.012 21.390 1.00 33.06 H new ATOM 0 HB3 ASN B 40 19.628 18.688 22.526 1.00 33.06 H new ATOM 0 HD21 ASN B 40 17.505 15.889 21.809 1.00 33.85 H new ATOM 0 HD22 ASN B 40 18.409 16.795 23.028 1.00 33.85 H new ATOM 1735 N ILE B 41 19.631 21.943 21.232 1.00 33.58 N ATOM 1736 CA ILE B 41 20.275 23.165 21.791 1.00 35.14 C ATOM 1737 C ILE B 41 20.918 22.848 23.145 1.00 34.57 C ATOM 1738 O ILE B 41 22.093 23.075 23.341 1.00 33.97 O ATOM 1739 CB ILE B 41 19.213 24.274 21.939 1.00 38.72 C ATOM 1740 CG1 ILE B 41 18.872 24.787 20.520 1.00 39.13 C ATOM 1741 CG2 ILE B 41 19.736 25.423 22.853 1.00 40.27 C ATOM 1742 CD1 ILE B 41 17.879 25.960 20.550 1.00 40.55 C ATOM 0 H ILE B 41 18.669 22.067 20.916 1.00 33.58 H new ATOM 0 HA ILE B 41 21.058 23.509 21.116 1.00 35.14 H new ATOM 0 HB ILE B 41 18.315 23.883 22.416 1.00 38.72 H new ATOM 0 HG12 ILE B 41 19.788 25.101 20.019 1.00 39.13 H new ATOM 0 HG13 ILE B 41 18.451 23.971 19.932 1.00 39.13 H new ATOM 0 HG21 ILE B 41 18.970 26.194 22.943 1.00 40.27 H new ATOM 0 HG22 ILE B 41 19.968 25.025 23.841 1.00 40.27 H new ATOM 0 HG23 ILE B 41 20.636 25.855 22.415 1.00 40.27 H new ATOM 0 HD11 ILE B 41 17.670 26.286 19.531 1.00 40.55 H new ATOM 0 HD12 ILE B 41 16.952 25.640 21.026 1.00 40.55 H new ATOM 0 HD13 ILE B 41 18.310 26.787 21.114 1.00 40.55 H new ATOM 1754 N GLU B 42 20.170 22.339 24.081 1.00 35.46 N ATOM 1755 CA GLU B 42 20.766 22.029 25.414 1.00 34.62 C ATOM 1756 C GLU B 42 22.080 21.269 25.227 1.00 31.10 C ATOM 1757 O GLU B 42 23.049 21.506 25.921 1.00 29.48 O ATOM 1758 CB GLU B 42 19.791 21.176 26.225 1.00 40.18 C ATOM 1759 CG GLU B 42 18.584 22.023 26.630 1.00 46.15 C ATOM 1760 CD GLU B 42 17.716 21.238 27.615 1.00 50.80 C ATOM 1761 OE1 GLU B 42 17.733 20.020 27.548 1.00 53.92 O ATOM 1762 OE2 GLU B 42 17.049 21.867 28.420 1.00 52.61 O ATOM 0 H GLU B 42 19.178 22.124 23.985 1.00 35.46 H new ATOM 0 HA GLU B 42 20.962 22.960 25.946 1.00 34.62 H new ATOM 0 HB2 GLU B 42 19.465 20.319 25.636 1.00 40.18 H new ATOM 0 HB3 GLU B 42 20.287 20.783 27.113 1.00 40.18 H new ATOM 0 HG2 GLU B 42 18.917 22.955 27.086 1.00 46.15 H new ATOM 0 HG3 GLU B 42 18.001 22.290 25.748 1.00 46.15 H new ATOM 1769 N GLU B 43 22.125 20.364 24.291 1.00 26.75 N ATOM 1770 CA GLU B 43 23.382 19.600 24.057 1.00 25.31 C ATOM 1771 C GLU B 43 24.322 20.442 23.193 1.00 22.10 C ATOM 1772 O GLU B 43 25.529 20.351 23.301 1.00 21.22 O ATOM 1773 CB GLU B 43 23.063 18.286 23.338 1.00 24.85 C ATOM 1774 CG GLU B 43 24.264 17.342 23.442 1.00 27.31 C ATOM 1775 CD GLU B 43 24.390 16.830 24.878 1.00 29.91 C ATOM 1776 OE1 GLU B 43 23.421 16.940 25.612 1.00 30.00 O ATOM 1777 OE2 GLU B 43 25.452 16.338 25.220 1.00 28.72 O ATOM 0 H GLU B 43 21.347 20.120 23.678 1.00 26.75 H new ATOM 0 HA GLU B 43 23.858 19.376 25.012 1.00 25.31 H new ATOM 0 HB2 GLU B 43 22.182 17.821 23.781 1.00 24.85 H new ATOM 0 HB3 GLU B 43 22.829 18.480 22.291 1.00 24.85 H new ATOM 0 HG2 GLU B 43 24.142 16.504 22.756 1.00 27.31 H new ATOM 0 HG3 GLU B 43 25.176 17.863 23.149 1.00 27.31 H new ATOM 1784 N ALA B 44 23.777 21.267 22.338 1.00 21.46 N ATOM 1785 CA ALA B 44 24.639 22.118 21.471 1.00 22.00 C ATOM 1786 C ALA B 44 25.173 23.291 22.301 1.00 21.74 C ATOM 1787 O ALA B 44 26.323 23.667 22.197 1.00 19.07 O ATOM 1788 CB ALA B 44 23.816 22.618 20.262 1.00 22.06 C ATOM 0 H ALA B 44 22.773 21.387 22.204 1.00 21.46 H new ATOM 0 HA ALA B 44 25.485 21.544 21.093 1.00 22.00 H new ATOM 0 HB1 ALA B 44 24.445 23.241 19.626 1.00 22.06 H new ATOM 0 HB2 ALA B 44 23.455 21.764 19.689 1.00 22.06 H new ATOM 0 HB3 ALA B 44 22.967 23.202 20.617 1.00 22.06 H new ATOM 1794 N SER B 45 24.348 23.857 23.132 1.00 21.72 N ATOM 1795 CA SER B 45 24.803 24.991 23.980 1.00 24.00 C ATOM 1796 C SER B 45 25.978 24.523 24.837 1.00 24.30 C ATOM 1797 O SER B 45 26.938 25.238 25.046 1.00 23.27 O ATOM 1798 CB SER B 45 23.653 25.432 24.884 1.00 25.03 C ATOM 1799 OG SER B 45 23.534 24.529 25.976 1.00 28.51 O ATOM 0 H SER B 45 23.374 23.583 23.262 1.00 21.72 H new ATOM 0 HA SER B 45 25.114 25.828 23.355 1.00 24.00 H new ATOM 0 HB2 SER B 45 23.833 26.442 25.252 1.00 25.03 H new ATOM 0 HB3 SER B 45 22.722 25.460 24.318 1.00 25.03 H new ATOM 0 HG SER B 45 23.364 23.626 25.636 1.00 28.51 H new ATOM 1805 N ARG B 46 25.902 23.320 25.328 1.00 26.45 N ATOM 1806 CA ARG B 46 27.000 22.777 26.172 1.00 27.79 C ATOM 1807 C ARG B 46 28.331 22.920 25.432 1.00 26.86 C ATOM 1808 O ARG B 46 29.336 23.290 26.006 1.00 25.99 O ATOM 1809 CB ARG B 46 26.718 21.296 26.454 1.00 31.64 C ATOM 1810 CG ARG B 46 25.615 21.162 27.530 1.00 39.02 C ATOM 1811 CD ARG B 46 26.246 21.046 28.922 1.00 43.92 C ATOM 1812 NE ARG B 46 27.009 19.769 29.011 1.00 48.12 N ATOM 1813 CZ ARG B 46 27.866 19.585 29.978 1.00 50.42 C ATOM 1814 NH1 ARG B 46 28.052 20.519 30.871 1.00 52.31 N ATOM 1815 NH2 ARG B 46 28.536 18.468 30.053 1.00 52.39 N ATOM 0 H ARG B 46 25.119 22.684 25.179 1.00 26.45 H new ATOM 0 HA ARG B 46 27.056 23.326 27.112 1.00 27.79 H new ATOM 0 HB2 ARG B 46 26.406 20.796 25.537 1.00 31.64 H new ATOM 0 HB3 ARG B 46 27.629 20.802 26.792 1.00 31.64 H new ATOM 0 HG2 ARG B 46 24.954 22.028 27.493 1.00 39.02 H new ATOM 0 HG3 ARG B 46 25.002 20.284 27.326 1.00 39.02 H new ATOM 0 HD2 ARG B 46 26.908 21.892 29.106 1.00 43.92 H new ATOM 0 HD3 ARG B 46 25.472 21.075 29.689 1.00 43.92 H new ATOM 0 HE ARG B 46 26.861 19.038 28.315 1.00 48.12 H new ATOM 0 HH11 ARG B 46 27.528 21.392 30.813 1.00 52.31 H new ATOM 0 HH12 ARG B 46 28.722 20.376 31.627 1.00 52.31 H new ATOM 0 HH21 ARG B 46 28.390 17.738 29.356 1.00 52.39 H new ATOM 0 HH22 ARG B 46 29.206 18.325 30.809 1.00 52.39 H new ATOM 1829 N ARG B 47 28.344 22.635 24.160 1.00 22.86 N ATOM 1830 CA ARG B 47 29.609 22.760 23.380 1.00 20.88 C ATOM 1831 C ARG B 47 30.014 24.230 23.335 1.00 18.23 C ATOM 1832 O ARG B 47 31.062 24.612 23.816 1.00 21.17 O ATOM 1833 CB ARG B 47 29.389 22.250 21.953 1.00 19.97 C ATOM 1834 CG ARG B 47 28.839 20.814 21.986 1.00 21.43 C ATOM 1835 CD ARG B 47 28.210 20.458 20.630 1.00 22.98 C ATOM 1836 NE ARG B 47 27.289 19.284 20.793 1.00 20.54 N ATOM 1837 CZ ARG B 47 27.699 18.159 21.319 1.00 24.59 C ATOM 1838 NH1 ARG B 47 28.967 17.955 21.546 1.00 24.12 N ATOM 1839 NH2 ARG B 47 26.838 17.210 21.568 1.00 16.51 N ATOM 0 H ARG B 47 27.534 22.321 23.626 1.00 22.86 H new ATOM 0 HA ARG B 47 30.393 22.170 23.853 1.00 20.88 H new ATOM 0 HB2 ARG B 47 28.692 22.903 21.428 1.00 19.97 H new ATOM 0 HB3 ARG B 47 30.328 22.276 21.400 1.00 19.97 H new ATOM 0 HG2 ARG B 47 29.642 20.114 22.218 1.00 21.43 H new ATOM 0 HG3 ARG B 47 28.095 20.719 22.777 1.00 21.43 H new ATOM 0 HD2 ARG B 47 27.659 21.313 20.238 1.00 22.98 H new ATOM 0 HD3 ARG B 47 28.991 20.223 19.907 1.00 22.98 H new ATOM 0 HE ARG B 47 26.320 19.366 20.486 1.00 20.54 H new ATOM 0 HH11 ARG B 47 29.649 18.676 21.313 1.00 24.12 H new ATOM 0 HH12 ARG B 47 29.276 17.074 21.957 1.00 24.12 H new ATOM 0 HH21 ARG B 47 25.851 17.348 21.352 1.00 16.51 H new ATOM 0 HH22 ARG B 47 27.153 16.331 21.978 1.00 16.51 H new ATOM 1853 N ILE B 48 29.173 25.060 22.781 1.00 16.11 N ATOM 1854 CA ILE B 48 29.477 26.521 22.721 1.00 18.86 C ATOM 1855 C ILE B 48 29.960 26.963 24.094 1.00 23.26 C ATOM 1856 O ILE B 48 31.037 27.498 24.255 1.00 21.90 O ATOM 1857 CB ILE B 48 28.202 27.270 22.358 1.00 18.65 C ATOM 1858 CG1 ILE B 48 27.619 26.637 21.095 1.00 19.26 C ATOM 1859 CG2 ILE B 48 28.535 28.741 22.106 1.00 21.02 C ATOM 1860 CD1 ILE B 48 26.449 27.475 20.567 1.00 15.25 C ATOM 0 H ILE B 48 28.282 24.788 22.364 1.00 16.11 H new ATOM 0 HA ILE B 48 30.244 26.728 21.974 1.00 18.86 H new ATOM 0 HB ILE B 48 27.476 27.210 23.169 1.00 18.65 H new ATOM 0 HG12 ILE B 48 28.392 26.558 20.330 1.00 19.26 H new ATOM 0 HG13 ILE B 48 27.280 25.624 21.312 1.00 19.26 H new ATOM 0 HG21 ILE B 48 27.624 29.281 21.846 1.00 21.02 H new ATOM 0 HG22 ILE B 48 28.969 29.175 23.007 1.00 21.02 H new ATOM 0 HG23 ILE B 48 29.249 28.817 21.286 1.00 21.02 H new ATOM 0 HD11 ILE B 48 26.045 27.010 19.667 1.00 15.25 H new ATOM 0 HD12 ILE B 48 25.670 27.532 21.327 1.00 15.25 H new ATOM 0 HD13 ILE B 48 26.799 28.480 20.331 1.00 15.25 H new ATOM 1872 N GLU B 49 29.164 26.704 25.084 1.00 24.41 N ATOM 1873 CA GLU B 49 29.533 27.059 26.480 1.00 29.72 C ATOM 1874 C GLU B 49 30.984 26.686 26.741 1.00 31.01 C ATOM 1875 O GLU B 49 31.820 27.526 27.009 1.00 30.32 O ATOM 1876 CB GLU B 49 28.662 26.228 27.402 1.00 30.86 C ATOM 1877 CG GLU B 49 27.376 26.997 27.745 1.00 35.37 C ATOM 1878 CD GLU B 49 27.617 27.913 28.950 1.00 37.77 C ATOM 1879 OE1 GLU B 49 28.022 27.405 29.983 1.00 38.92 O ATOM 1880 OE2 GLU B 49 27.392 29.104 28.818 1.00 38.78 O ATOM 0 H GLU B 49 28.255 26.252 24.986 1.00 24.41 H new ATOM 0 HA GLU B 49 29.397 28.128 26.645 1.00 29.72 H new ATOM 0 HB2 GLU B 49 28.412 25.281 26.924 1.00 30.86 H new ATOM 0 HB3 GLU B 49 29.208 25.990 28.315 1.00 30.86 H new ATOM 0 HG2 GLU B 49 27.056 27.588 26.887 1.00 35.37 H new ATOM 0 HG3 GLU B 49 26.571 26.296 27.966 1.00 35.37 H new ATOM 1887 N GLU B 50 31.287 25.416 26.647 1.00 31.22 N ATOM 1888 CA GLU B 50 32.683 24.975 26.868 1.00 30.52 C ATOM 1889 C GLU B 50 33.545 25.849 25.985 1.00 30.97 C ATOM 1890 O GLU B 50 34.538 26.374 26.396 1.00 30.11 O ATOM 1891 CB GLU B 50 32.817 23.487 26.475 1.00 33.65 C ATOM 1892 CG GLU B 50 33.920 22.811 27.298 1.00 34.45 C ATOM 1893 CD GLU B 50 33.939 21.312 26.992 1.00 36.26 C ATOM 1894 OE1 GLU B 50 33.104 20.606 27.533 1.00 35.94 O ATOM 1895 OE2 GLU B 50 34.789 20.895 26.222 1.00 36.07 O ATOM 0 H GLU B 50 30.624 24.672 26.427 1.00 31.22 H new ATOM 0 HA GLU B 50 32.985 25.067 27.911 1.00 30.52 H new ATOM 0 HB2 GLU B 50 31.868 22.975 26.637 1.00 33.65 H new ATOM 0 HB3 GLU B 50 33.046 23.405 25.412 1.00 33.65 H new ATOM 0 HG2 GLU B 50 34.888 23.253 27.062 1.00 34.45 H new ATOM 0 HG3 GLU B 50 33.746 22.974 28.362 1.00 34.45 H new ATOM 1902 N GLY B 51 33.107 26.038 24.783 1.00 0.00 N ATOM 1903 CA GLY B 51 33.840 26.906 23.827 1.00 0.00 C ATOM 1904 C GLY B 51 34.073 28.298 24.435 1.00 0.00 C ATOM 1905 O GLY B 51 35.184 28.748 24.616 1.00 0.00 O ATOM 0 H GLY B 51 32.254 25.620 24.411 1.00 0.00 H new ATOM 0 HA2 GLY B 51 34.796 26.449 23.571 1.00 0.00 H new ATOM 0 HA3 GLY B 51 33.273 26.997 22.901 1.00 0.00 H new ATOM 1909 N GLN B 52 33.014 28.996 24.729 1.00 30.19 N ATOM 1910 CA GLN B 52 33.154 30.369 25.307 1.00 33.26 C ATOM 1911 C GLN B 52 34.148 30.309 26.453 1.00 34.21 C ATOM 1912 O GLN B 52 35.104 31.056 26.518 1.00 33.27 O ATOM 1913 CB GLN B 52 31.805 30.847 25.855 1.00 34.36 C ATOM 1914 CG GLN B 52 30.700 30.674 24.798 1.00 37.06 C ATOM 1915 CD GLN B 52 30.607 31.916 23.910 1.00 39.18 C ATOM 1916 OE1 GLN B 52 31.602 32.548 23.617 1.00 39.82 O ATOM 1917 NE2 GLN B 52 29.438 32.290 23.469 1.00 40.80 N ATOM 0 H GLN B 52 32.054 28.679 24.595 1.00 30.19 H new ATOM 0 HA GLN B 52 33.494 31.057 24.533 1.00 33.26 H new ATOM 0 HB2 GLN B 52 31.550 30.282 26.752 1.00 34.36 H new ATOM 0 HB3 GLN B 52 31.876 31.895 26.147 1.00 34.36 H new ATOM 0 HG2 GLN B 52 30.909 29.797 24.185 1.00 37.06 H new ATOM 0 HG3 GLN B 52 29.743 30.499 25.289 1.00 37.06 H new ATOM 0 HE21 GLN B 52 28.605 31.757 23.717 1.00 40.80 H new ATOM 0 HE22 GLN B 52 29.357 33.116 22.876 1.00 40.80 H new ATOM 1926 N TYR B 53 33.926 29.398 27.345 1.00 35.76 N ATOM 1927 CA TYR B 53 34.843 29.235 28.494 1.00 38.60 C ATOM 1928 C TYR B 53 36.197 28.794 27.952 1.00 39.68 C ATOM 1929 O TYR B 53 37.231 29.308 28.314 1.00 39.52 O ATOM 1930 CB TYR B 53 34.272 28.152 29.423 1.00 40.83 C ATOM 1931 CG TYR B 53 35.363 27.586 30.301 1.00 43.21 C ATOM 1932 CD1 TYR B 53 36.226 26.610 29.800 1.00 44.13 C ATOM 1933 CD2 TYR B 53 35.508 28.042 31.606 1.00 43.89 C ATOM 1934 CE1 TYR B 53 37.235 26.089 30.604 1.00 47.20 C ATOM 1935 CE2 TYR B 53 36.520 27.523 32.423 1.00 46.12 C ATOM 1936 CZ TYR B 53 37.386 26.543 31.921 1.00 46.20 C ATOM 1937 OH TYR B 53 38.384 26.026 32.721 1.00 48.95 O ATOM 0 H TYR B 53 33.138 28.750 27.327 1.00 35.76 H new ATOM 0 HA TYR B 53 34.951 30.166 29.050 1.00 38.60 H new ATOM 0 HB2 TYR B 53 33.480 28.575 30.042 1.00 40.83 H new ATOM 0 HB3 TYR B 53 33.822 27.355 28.831 1.00 40.83 H new ATOM 0 HD1 TYR B 53 36.110 26.258 28.785 1.00 44.13 H new ATOM 0 HD2 TYR B 53 34.839 28.798 31.990 1.00 43.89 H new ATOM 0 HE1 TYR B 53 37.902 25.335 30.213 1.00 47.20 H new ATOM 0 HE2 TYR B 53 36.632 27.877 33.437 1.00 46.12 H new ATOM 0 HH TYR B 53 38.997 25.492 32.175 1.00 48.95 H new ATOM 1947 N VAL B 54 36.177 27.836 27.085 1.00 39.35 N ATOM 1948 CA VAL B 54 37.431 27.315 26.491 1.00 40.00 C ATOM 1949 C VAL B 54 38.239 28.496 25.941 1.00 40.47 C ATOM 1950 O VAL B 54 39.317 28.803 26.410 1.00 39.23 O ATOM 1951 CB VAL B 54 37.014 26.365 25.366 1.00 40.33 C ATOM 1952 CG1 VAL B 54 38.098 26.216 24.329 1.00 40.58 C ATOM 1953 CG2 VAL B 54 36.606 24.970 25.912 1.00 39.92 C ATOM 0 H VAL B 54 35.327 27.380 26.753 1.00 39.35 H new ATOM 0 HA VAL B 54 38.051 26.790 27.218 1.00 40.00 H new ATOM 0 HB VAL B 54 36.143 26.815 24.889 1.00 40.33 H new ATOM 0 HG11 VAL B 54 37.763 25.534 23.548 1.00 40.58 H new ATOM 0 HG12 VAL B 54 38.318 27.189 23.891 1.00 40.58 H new ATOM 0 HG13 VAL B 54 38.998 25.817 24.798 1.00 40.58 H new ATOM 0 HG21 VAL B 54 36.317 24.325 25.082 1.00 39.92 H new ATOM 0 HG22 VAL B 54 37.449 24.525 26.441 1.00 39.92 H new ATOM 0 HG23 VAL B 54 35.765 25.079 26.597 1.00 39.92 H new ATOM 1963 N VAL B 55 37.714 29.160 24.950 1.00 40.13 N ATOM 1964 CA VAL B 55 38.433 30.323 24.363 1.00 42.29 C ATOM 1965 C VAL B 55 38.747 31.320 25.479 1.00 43.82 C ATOM 1966 O VAL B 55 39.888 31.665 25.713 1.00 43.78 O ATOM 1967 CB VAL B 55 37.542 30.982 23.300 1.00 41.62 C ATOM 1968 CG1 VAL B 55 38.305 32.110 22.595 1.00 42.45 C ATOM 1969 CG2 VAL B 55 37.131 29.929 22.268 1.00 41.12 C ATOM 0 H VAL B 55 36.814 28.946 24.520 1.00 40.13 H new ATOM 0 HA VAL B 55 39.362 29.999 23.895 1.00 42.29 H new ATOM 0 HB VAL B 55 36.658 31.399 23.783 1.00 41.62 H new ATOM 0 HG11 VAL B 55 37.663 32.569 21.844 1.00 42.45 H new ATOM 0 HG12 VAL B 55 38.602 32.861 23.327 1.00 42.45 H new ATOM 0 HG13 VAL B 55 39.193 31.702 22.113 1.00 42.45 H new ATOM 0 HG21 VAL B 55 36.498 30.390 21.510 1.00 41.12 H new ATOM 0 HG22 VAL B 55 38.022 29.516 21.795 1.00 41.12 H new ATOM 0 HG23 VAL B 55 36.580 29.130 22.763 1.00 41.12 H new ATOM 1979 N ASN B 56 37.745 31.778 26.179 1.00 44.48 N ATOM 1980 CA ASN B 56 37.995 32.742 27.288 1.00 47.06 C ATOM 1981 C ASN B 56 39.087 32.174 28.193 1.00 47.69 C ATOM 1982 O ASN B 56 40.069 32.826 28.487 1.00 47.82 O ATOM 1983 CB ASN B 56 36.711 32.940 28.096 1.00 46.90 C ATOM 1984 CG ASN B 56 35.650 33.601 27.215 1.00 47.81 C ATOM 1985 OD1 ASN B 56 35.819 33.709 26.017 1.00 48.43 O ATOM 1986 ND2 ASN B 56 34.554 34.052 27.762 1.00 47.03 N ATOM 0 H ASN B 56 36.767 31.527 26.032 1.00 44.48 H new ATOM 0 HA ASN B 56 38.311 33.703 26.881 1.00 47.06 H new ATOM 0 HB2 ASN B 56 36.348 31.980 28.462 1.00 46.90 H new ATOM 0 HB3 ASN B 56 36.911 33.560 28.970 1.00 46.90 H new ATOM 0 HD21 ASN B 56 33.840 34.495 27.183 1.00 47.03 H new ATOM 0 HD22 ASN B 56 34.411 33.962 28.768 1.00 47.03 H new ATOM 1993 N GLU B 57 38.928 30.951 28.623 1.00 49.57 N ATOM 1994 CA GLU B 57 39.959 30.322 29.494 1.00 51.35 C ATOM 1995 C GLU B 57 41.325 30.504 28.838 1.00 52.18 C ATOM 1996 O GLU B 57 42.262 30.973 29.453 1.00 52.13 O ATOM 1997 CB GLU B 57 39.655 28.827 29.646 1.00 52.66 C ATOM 1998 CG GLU B 57 40.671 28.180 30.591 1.00 53.83 C ATOM 1999 CD GLU B 57 40.403 26.677 30.679 1.00 55.85 C ATOM 2000 OE1 GLU B 57 40.065 26.095 29.661 1.00 56.34 O ATOM 2001 OE2 GLU B 57 40.544 26.133 31.761 1.00 57.10 O ATOM 0 H GLU B 57 38.125 30.360 28.407 1.00 49.57 H new ATOM 0 HA GLU B 57 39.954 30.788 30.479 1.00 51.35 H new ATOM 0 HB2 GLU B 57 38.646 28.690 30.035 1.00 52.66 H new ATOM 0 HB3 GLU B 57 39.690 28.339 28.672 1.00 52.66 H new ATOM 0 HG2 GLU B 57 41.684 28.359 30.230 1.00 53.83 H new ATOM 0 HG3 GLU B 57 40.601 28.631 31.581 1.00 53.83 H new