USER MOD reduce.3.24.130724 H: found=0, std=0, add=840, rem=0, adj=21 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 -15:sc= -1.45 USER MOD Set 1.2: B 52 GLN : amide:sc= -0.855 K(o=-2.3,f=-0.67) USER MOD Set 2.1: A 22 TYR OH : rot -49:sc= -2.49! USER MOD Set 2.2: A 52 GLN : amide:sc= -1.83! K(o=-4.3!,f=-1.4) USER MOD Set 3.1: A 13 CYS SG : rot 150:sc= -3.6 USER MOD Set 3.2: A 27 MET CE :methyl -177:sc= -2.12 (180deg=0) USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 GLN : amide:sc= -5.27! K(o=-5.3!,f=-2.4) USER MOD Single : A 15 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0679) USER MOD Single : A 19 LYS NZ :NH3+ -158:sc= -0.108 (180deg=-0.694) USER MOD Single : A 30 MET CE :methyl 175:sc= -3.03 (180deg=-3.22!) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ -124:sc= -0.736 (180deg=-2.38) USER MOD Single : A 40 ASN : amide:sc= -0.678 K(o=-0.68,f=-5.6!) USER MOD Single : A 45 SER OG : rot -72:sc= -0.381 USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 ASN : amide:sc= -2.07! C(o=-2.1!,f=-5.5!) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : B 12 TYR OH : rot 180:sc= 0 USER MOD Single : B 13 CYS SG : rot 62:sc= -1.38 USER MOD Single : B 14 GLN : amide:sc= -2.89! K(o=-2.9!,f=-2.2) USER MOD Single : B 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 LYS NZ :NH3+ -160:sc= -0.0357 (180deg=-0.51) USER MOD Single : B 27 MET CE :methyl -140:sc=-0.00661 (180deg=-0.136) USER MOD Single : B 30 MET CE :methyl -158:sc= -3.7! (180deg=-6.13!) USER MOD Single : B 31 TYR OH : rot 180:sc= 0 USER MOD Single : B 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 40 ASN : amide:sc= -0.647 K(o=-0.65,f=-2.9!) USER MOD Single : B 45 SER OG : rot 180:sc= -0.38 USER MOD Single : B 53 TYR OH : rot 23:sc= 1.24 USER MOD Single : B 56 ASN : amide:sc= -7.55! C(o=-7.6!,f=-19!) USER MOD ----------------------------------------------------------------- ATOM 106 N PHE A 9 44.200 22.713 18.111 1.00 44.59 N ATOM 107 CA PHE A 9 42.746 22.962 18.045 1.00 42.14 C ATOM 108 C PHE A 9 42.510 24.453 17.820 1.00 41.09 C ATOM 109 O PHE A 9 41.967 24.863 16.813 1.00 40.10 O ATOM 110 CB PHE A 9 42.091 22.519 19.367 1.00 39.48 C ATOM 111 CG PHE A 9 40.663 22.159 19.094 1.00 35.93 C ATOM 112 CD1 PHE A 9 40.334 20.855 18.722 1.00 34.84 C ATOM 113 CD2 PHE A 9 39.676 23.139 19.183 1.00 33.89 C ATOM 114 CE1 PHE A 9 39.010 20.532 18.438 1.00 33.98 C ATOM 115 CE2 PHE A 9 38.354 22.814 18.903 1.00 31.72 C ATOM 116 CZ PHE A 9 38.022 21.516 18.530 1.00 33.09 C ATOM 0 HA PHE A 9 42.306 22.396 17.224 1.00 42.14 H new ATOM 0 HB2 PHE A 9 42.623 21.665 19.786 1.00 39.48 H new ATOM 0 HB3 PHE A 9 42.145 23.321 20.104 1.00 39.48 H new ATOM 0 HD1 PHE A 9 41.103 20.100 18.655 1.00 34.84 H new ATOM 0 HD2 PHE A 9 39.937 24.147 19.468 1.00 33.89 H new ATOM 0 HE1 PHE A 9 38.748 19.525 18.148 1.00 33.98 H new ATOM 0 HE2 PHE A 9 37.585 23.569 18.975 1.00 31.72 H new ATOM 0 HZ PHE A 9 36.994 21.267 18.310 1.00 33.09 H new ATOM 126 N LEU A 10 42.927 25.270 18.745 1.00 40.61 N ATOM 127 CA LEU A 10 42.738 26.731 18.573 1.00 40.95 C ATOM 128 C LEU A 10 43.437 27.152 17.287 1.00 41.08 C ATOM 129 O LEU A 10 43.053 28.102 16.635 1.00 37.24 O ATOM 130 CB LEU A 10 43.339 27.469 19.762 1.00 41.66 C ATOM 131 CG LEU A 10 42.834 26.832 21.056 1.00 43.24 C ATOM 132 CD1 LEU A 10 43.426 27.575 22.238 1.00 42.19 C ATOM 133 CD2 LEU A 10 41.305 26.918 21.124 1.00 41.41 C ATOM 0 H LEU A 10 43.389 24.988 19.610 1.00 40.61 H new ATOM 0 HA LEU A 10 41.677 26.973 18.516 1.00 40.95 H new ATOM 0 HB2 LEU A 10 44.427 27.424 19.721 1.00 41.66 H new ATOM 0 HB3 LEU A 10 43.062 28.523 19.729 1.00 41.66 H new ATOM 0 HG LEU A 10 43.135 25.785 21.081 1.00 43.24 H new ATOM 0 HD11 LEU A 10 43.070 27.126 23.165 1.00 42.19 H new ATOM 0 HD12 LEU A 10 44.514 27.513 22.199 1.00 42.19 H new ATOM 0 HD13 LEU A 10 43.120 28.621 22.201 1.00 42.19 H new ATOM 0 HD21 LEU A 10 40.956 26.461 22.050 1.00 41.41 H new ATOM 0 HD22 LEU A 10 40.998 27.963 21.097 1.00 41.41 H new ATOM 0 HD23 LEU A 10 40.873 26.391 20.274 1.00 41.41 H new ATOM 145 N ASP A 11 44.455 26.435 16.905 1.00 41.30 N ATOM 146 CA ASP A 11 45.161 26.778 15.645 1.00 41.83 C ATOM 147 C ASP A 11 44.177 26.608 14.489 1.00 40.90 C ATOM 148 O ASP A 11 43.870 27.550 13.788 1.00 39.80 O ATOM 149 CB ASP A 11 46.357 25.845 15.448 1.00 44.60 C ATOM 150 CG ASP A 11 47.178 26.315 14.246 1.00 47.53 C ATOM 151 OD1 ASP A 11 47.682 27.425 14.296 1.00 48.56 O ATOM 152 OD2 ASP A 11 47.287 25.558 13.296 1.00 48.01 O ATOM 0 H ASP A 11 44.826 25.630 17.409 1.00 41.30 H new ATOM 0 HA ASP A 11 45.525 27.805 15.685 1.00 41.83 H new ATOM 0 HB2 ASP A 11 46.977 25.837 16.345 1.00 44.60 H new ATOM 0 HB3 ASP A 11 46.012 24.823 15.289 1.00 44.60 H new ATOM 157 N TYR A 12 43.655 25.418 14.295 1.00 39.29 N ATOM 158 CA TYR A 12 42.671 25.219 13.189 1.00 38.27 C ATOM 159 C TYR A 12 41.620 26.312 13.279 1.00 34.82 C ATOM 160 O TYR A 12 41.316 26.980 12.311 1.00 33.76 O ATOM 161 CB TYR A 12 41.955 23.872 13.320 1.00 42.68 C ATOM 162 CG TYR A 12 42.884 22.690 13.089 1.00 45.94 C ATOM 163 CD1 TYR A 12 43.738 22.630 11.968 1.00 47.36 C ATOM 164 CD2 TYR A 12 42.860 21.621 13.994 1.00 48.31 C ATOM 165 CE1 TYR A 12 44.551 21.508 11.769 1.00 48.74 C ATOM 166 CE2 TYR A 12 43.670 20.511 13.792 1.00 49.78 C ATOM 167 CZ TYR A 12 44.515 20.447 12.680 1.00 49.89 C ATOM 168 OH TYR A 12 45.316 19.340 12.484 1.00 52.12 O ATOM 0 H TYR A 12 43.866 24.588 14.849 1.00 39.29 H new ATOM 0 HA TYR A 12 43.207 25.248 12.241 1.00 38.27 H new ATOM 0 HB2 TYR A 12 41.515 23.794 14.314 1.00 42.68 H new ATOM 0 HB3 TYR A 12 41.135 23.830 12.604 1.00 42.68 H new ATOM 0 HD1 TYR A 12 43.765 23.449 11.264 1.00 47.36 H new ATOM 0 HD2 TYR A 12 42.208 21.660 14.854 1.00 48.31 H new ATOM 0 HE1 TYR A 12 45.206 21.461 10.912 1.00 48.74 H new ATOM 0 HE2 TYR A 12 43.647 19.693 14.497 1.00 49.78 H new ATOM 0 HH TYR A 12 45.169 18.697 13.209 1.00 52.12 H new ATOM 178 N CYS A 13 41.068 26.508 14.446 1.00 32.26 N ATOM 179 CA CYS A 13 40.045 27.572 14.613 1.00 30.43 C ATOM 180 C CYS A 13 40.571 28.844 13.965 1.00 30.74 C ATOM 181 O CYS A 13 40.005 29.346 13.024 1.00 28.86 O ATOM 182 CB CYS A 13 39.795 27.815 16.103 1.00 30.34 C ATOM 183 SG CYS A 13 38.943 29.395 16.336 1.00 24.58 S ATOM 0 H CYS A 13 41.283 25.976 15.289 1.00 32.26 H new ATOM 0 HA CYS A 13 39.108 27.272 14.144 1.00 30.43 H new ATOM 0 HB2 CYS A 13 39.195 27.004 16.517 1.00 30.34 H new ATOM 0 HB3 CYS A 13 40.742 27.819 16.643 1.00 30.34 H new ATOM 0 HG CYS A 13 38.193 29.332 17.396 1.00 24.58 H new ATOM 189 N GLN A 14 41.668 29.351 14.453 1.00 32.92 N ATOM 190 CA GLN A 14 42.246 30.587 13.862 1.00 34.93 C ATOM 191 C GLN A 14 42.263 30.465 12.332 1.00 35.74 C ATOM 192 O GLN A 14 41.958 31.404 11.630 1.00 35.15 O ATOM 193 CB GLN A 14 43.667 30.795 14.408 1.00 36.23 C ATOM 194 CG GLN A 14 44.048 32.281 14.345 1.00 40.72 C ATOM 195 CD GLN A 14 44.294 32.712 12.895 1.00 42.88 C ATOM 196 OE1 GLN A 14 44.221 33.885 12.583 1.00 45.84 O ATOM 197 NE2 GLN A 14 44.584 31.819 11.989 1.00 44.23 N ATOM 0 H GLN A 14 42.190 28.961 15.238 1.00 32.92 H new ATOM 0 HA GLN A 14 41.637 31.449 14.133 1.00 34.93 H new ATOM 0 HB2 GLN A 14 43.724 30.441 15.437 1.00 36.23 H new ATOM 0 HB3 GLN A 14 44.377 30.205 13.828 1.00 36.23 H new ATOM 0 HG2 GLN A 14 43.252 32.885 14.780 1.00 40.72 H new ATOM 0 HG3 GLN A 14 44.944 32.458 14.940 1.00 40.72 H new ATOM 0 HE21 GLN A 14 44.646 30.834 12.246 1.00 44.23 H new ATOM 0 HE22 GLN A 14 44.748 32.106 11.024 1.00 44.23 H new ATOM 206 N LYS A 15 42.581 29.312 11.804 1.00 35.66 N ATOM 207 CA LYS A 15 42.562 29.165 10.321 1.00 36.27 C ATOM 208 C LYS A 15 41.093 29.216 9.884 1.00 34.97 C ATOM 209 O LYS A 15 40.684 30.067 9.124 1.00 34.84 O ATOM 210 CB LYS A 15 43.179 27.810 9.910 1.00 40.22 C ATOM 211 CG LYS A 15 44.687 27.937 9.653 1.00 44.18 C ATOM 212 CD LYS A 15 45.449 28.109 10.977 1.00 47.52 C ATOM 213 CE LYS A 15 46.903 27.661 10.800 1.00 50.10 C ATOM 214 NZ LYS A 15 47.595 28.578 9.851 1.00 50.42 N ATOM 0 H LYS A 15 42.849 28.478 12.327 1.00 35.66 H new ATOM 0 HA LYS A 15 43.142 29.958 9.849 1.00 36.27 H new ATOM 0 HB2 LYS A 15 43.003 27.075 10.695 1.00 40.22 H new ATOM 0 HB3 LYS A 15 42.685 27.441 9.011 1.00 40.22 H new ATOM 0 HG2 LYS A 15 45.048 27.051 9.132 1.00 44.18 H new ATOM 0 HG3 LYS A 15 44.880 28.790 9.003 1.00 44.18 H new ATOM 0 HD2 LYS A 15 45.416 29.151 11.294 1.00 47.52 H new ATOM 0 HD3 LYS A 15 44.971 27.522 11.761 1.00 47.52 H new ATOM 0 HE2 LYS A 15 47.415 27.663 11.762 1.00 50.10 H new ATOM 0 HE3 LYS A 15 46.936 26.639 10.424 1.00 50.10 H new ATOM 0 HZ1 LYS A 15 48.614 28.369 9.847 1.00 50.42 H new ATOM 0 HZ2 LYS A 15 47.210 28.442 8.894 1.00 50.42 H new ATOM 0 HZ3 LYS A 15 47.445 29.563 10.148 1.00 50.42 H new ATOM 228 N LEU A 16 40.285 28.321 10.385 1.00 31.52 N ATOM 229 CA LEU A 16 38.840 28.337 10.016 1.00 30.64 C ATOM 230 C LEU A 16 38.322 29.757 10.229 1.00 29.20 C ATOM 231 O LEU A 16 37.525 30.276 9.473 1.00 30.83 O ATOM 232 CB LEU A 16 38.088 27.344 10.921 1.00 29.49 C ATOM 233 CG LEU A 16 36.780 26.865 10.263 1.00 29.11 C ATOM 234 CD1 LEU A 16 37.072 26.164 8.922 1.00 29.81 C ATOM 235 CD2 LEU A 16 36.076 25.882 11.215 1.00 25.98 C ATOM 0 H LEU A 16 40.561 27.582 11.031 1.00 31.52 H new ATOM 0 HA LEU A 16 38.690 28.044 8.977 1.00 30.64 H new ATOM 0 HB2 LEU A 16 38.726 26.486 11.132 1.00 29.49 H new ATOM 0 HB3 LEU A 16 37.864 27.818 11.877 1.00 29.49 H new ATOM 0 HG LEU A 16 36.141 27.726 10.070 1.00 29.11 H new ATOM 0 HD11 LEU A 16 36.136 25.833 8.473 1.00 29.81 H new ATOM 0 HD12 LEU A 16 37.571 26.861 8.248 1.00 29.81 H new ATOM 0 HD13 LEU A 16 37.716 25.302 9.095 1.00 29.81 H new ATOM 0 HD21 LEU A 16 35.148 25.536 10.760 1.00 25.98 H new ATOM 0 HD22 LEU A 16 36.728 25.029 11.404 1.00 25.98 H new ATOM 0 HD23 LEU A 16 35.853 26.384 12.156 1.00 25.98 H new ATOM 247 N LEU A 17 38.816 30.385 11.250 1.00 27.96 N ATOM 248 CA LEU A 17 38.431 31.786 11.553 1.00 28.93 C ATOM 249 C LEU A 17 38.930 32.668 10.403 1.00 30.06 C ATOM 250 O LEU A 17 38.294 33.627 10.013 1.00 30.41 O ATOM 251 CB LEU A 17 39.123 32.196 12.862 1.00 24.89 C ATOM 252 CG LEU A 17 38.424 33.413 13.510 1.00 25.03 C ATOM 253 CD1 LEU A 17 37.256 32.957 14.420 1.00 21.31 C ATOM 254 CD2 LEU A 17 39.445 34.203 14.352 1.00 20.22 C ATOM 0 H LEU A 17 39.486 29.978 11.903 1.00 27.96 H new ATOM 0 HA LEU A 17 37.351 31.892 11.660 1.00 28.93 H new ATOM 0 HB2 LEU A 17 39.116 31.357 13.558 1.00 24.89 H new ATOM 0 HB3 LEU A 17 40.167 32.437 12.664 1.00 24.89 H new ATOM 0 HG LEU A 17 38.024 34.045 12.717 1.00 25.03 H new ATOM 0 HD11 LEU A 17 36.779 33.830 14.865 1.00 21.31 H new ATOM 0 HD12 LEU A 17 36.525 32.408 13.826 1.00 21.31 H new ATOM 0 HD13 LEU A 17 37.641 32.312 15.210 1.00 21.31 H new ATOM 0 HD21 LEU A 17 38.953 35.061 14.809 1.00 20.22 H new ATOM 0 HD22 LEU A 17 39.849 33.558 15.132 1.00 20.22 H new ATOM 0 HD23 LEU A 17 40.256 34.549 13.711 1.00 20.22 H new ATOM 266 N GLU A 18 40.078 32.336 9.864 1.00 32.20 N ATOM 267 CA GLU A 18 40.650 33.132 8.739 1.00 35.35 C ATOM 268 C GLU A 18 39.996 32.683 7.424 1.00 35.74 C ATOM 269 O GLU A 18 39.619 33.492 6.599 1.00 35.74 O ATOM 270 CB GLU A 18 42.196 32.937 8.718 1.00 37.07 C ATOM 271 CG GLU A 18 42.660 31.989 7.596 1.00 39.76 C ATOM 272 CD GLU A 18 44.170 31.770 7.713 1.00 41.67 C ATOM 273 OE1 GLU A 18 44.681 31.879 8.816 1.00 43.93 O ATOM 274 OE2 GLU A 18 44.790 31.499 6.698 1.00 43.25 O ATOM 0 H GLU A 18 40.645 31.541 10.159 1.00 32.20 H new ATOM 0 HA GLU A 18 40.446 34.195 8.868 1.00 35.35 H new ATOM 0 HB2 GLU A 18 42.679 33.906 8.592 1.00 37.07 H new ATOM 0 HB3 GLU A 18 42.521 32.541 9.680 1.00 37.07 H new ATOM 0 HG2 GLU A 18 42.136 31.036 7.669 1.00 39.76 H new ATOM 0 HG3 GLU A 18 42.417 32.413 6.622 1.00 39.76 H new ATOM 281 N LYS A 19 39.854 31.400 7.228 1.00 37.19 N ATOM 282 CA LYS A 19 39.222 30.900 5.977 1.00 36.85 C ATOM 283 C LYS A 19 37.912 31.650 5.739 1.00 36.69 C ATOM 284 O LYS A 19 37.667 32.181 4.674 1.00 36.88 O ATOM 285 CB LYS A 19 38.952 29.408 6.110 1.00 36.86 C ATOM 286 CG LYS A 19 38.855 28.796 4.714 1.00 40.15 C ATOM 287 CD LYS A 19 38.318 27.394 4.846 1.00 41.50 C ATOM 288 CE LYS A 19 38.340 26.695 3.486 1.00 44.93 C ATOM 289 NZ LYS A 19 37.766 27.601 2.452 1.00 44.88 N ATOM 0 H LYS A 19 40.150 30.676 7.883 1.00 37.19 H new ATOM 0 HA LYS A 19 39.889 31.068 5.132 1.00 36.85 H new ATOM 0 HB2 LYS A 19 39.751 28.929 6.677 1.00 36.86 H new ATOM 0 HB3 LYS A 19 38.026 29.240 6.660 1.00 36.86 H new ATOM 0 HG2 LYS A 19 38.200 29.395 4.082 1.00 40.15 H new ATOM 0 HG3 LYS A 19 39.835 28.784 4.236 1.00 40.15 H new ATOM 0 HD2 LYS A 19 38.917 26.832 5.563 1.00 41.50 H new ATOM 0 HD3 LYS A 19 37.300 27.421 5.234 1.00 41.50 H new ATOM 0 HE2 LYS A 19 39.362 26.425 3.221 1.00 44.93 H new ATOM 0 HE3 LYS A 19 37.767 25.769 3.532 1.00 44.93 H new ATOM 0 HZ1 LYS A 19 37.436 27.038 1.642 1.00 44.88 H new ATOM 0 HZ2 LYS A 19 36.966 28.127 2.857 1.00 44.88 H new ATOM 0 HZ3 LYS A 19 38.495 28.271 2.134 1.00 44.88 H new ATOM 303 N PHE A 20 37.072 31.700 6.735 1.00 34.99 N ATOM 304 CA PHE A 20 35.776 32.413 6.603 1.00 34.93 C ATOM 305 C PHE A 20 35.954 33.854 7.083 1.00 34.32 C ATOM 306 O PHE A 20 35.040 34.653 7.042 1.00 35.01 O ATOM 307 CB PHE A 20 34.748 31.703 7.477 1.00 34.20 C ATOM 308 CG PHE A 20 34.335 30.411 6.820 1.00 33.79 C ATOM 309 CD1 PHE A 20 35.079 29.247 7.044 1.00 32.30 C ATOM 310 CD2 PHE A 20 33.220 30.378 5.978 1.00 34.75 C ATOM 311 CE1 PHE A 20 34.704 28.049 6.427 1.00 34.86 C ATOM 312 CE2 PHE A 20 32.850 29.183 5.358 1.00 35.66 C ATOM 313 CZ PHE A 20 33.592 28.019 5.583 1.00 35.69 C ATOM 0 H PHE A 20 37.233 31.271 7.646 1.00 34.99 H new ATOM 0 HA PHE A 20 35.441 32.417 5.566 1.00 34.93 H new ATOM 0 HB2 PHE A 20 35.169 31.504 8.463 1.00 34.20 H new ATOM 0 HB3 PHE A 20 33.878 32.342 7.625 1.00 34.20 H new ATOM 0 HD1 PHE A 20 35.942 29.274 7.693 1.00 32.30 H new ATOM 0 HD2 PHE A 20 32.645 31.276 5.807 1.00 34.75 H new ATOM 0 HE1 PHE A 20 35.274 27.149 6.603 1.00 34.86 H new ATOM 0 HE2 PHE A 20 31.991 29.157 4.704 1.00 35.66 H new ATOM 0 HZ PHE A 20 33.304 27.095 5.103 1.00 35.69 H new ATOM 323 N ARG A 21 37.133 34.183 7.538 1.00 34.35 N ATOM 324 CA ARG A 21 37.400 35.568 8.024 1.00 34.08 C ATOM 325 C ARG A 21 36.408 35.935 9.130 1.00 33.06 C ATOM 326 O ARG A 21 35.975 37.065 9.230 1.00 31.60 O ATOM 327 CB ARG A 21 37.255 36.568 6.869 1.00 37.64 C ATOM 328 CG ARG A 21 38.113 36.134 5.671 1.00 41.19 C ATOM 329 CD ARG A 21 39.582 36.496 5.913 1.00 45.12 C ATOM 330 NE ARG A 21 40.360 36.245 4.667 1.00 48.87 N ATOM 331 CZ ARG A 21 41.555 36.751 4.531 1.00 50.17 C ATOM 332 NH1 ARG A 21 42.070 37.474 5.486 1.00 52.38 N ATOM 333 NH2 ARG A 21 42.235 36.531 3.438 1.00 50.69 N ATOM 0 H ARG A 21 37.929 33.547 7.594 1.00 34.35 H new ATOM 0 HA ARG A 21 38.416 35.609 8.416 1.00 34.08 H new ATOM 0 HB2 ARG A 21 36.209 36.637 6.569 1.00 37.64 H new ATOM 0 HB3 ARG A 21 37.558 37.561 7.200 1.00 37.64 H new ATOM 0 HG2 ARG A 21 38.017 35.059 5.516 1.00 41.19 H new ATOM 0 HG3 ARG A 21 37.756 36.621 4.763 1.00 41.19 H new ATOM 0 HD2 ARG A 21 39.668 37.543 6.205 1.00 45.12 H new ATOM 0 HD3 ARG A 21 39.985 35.902 6.733 1.00 45.12 H new ATOM 0 HE ARG A 21 39.958 35.678 3.921 1.00 48.87 H new ATOM 0 HH11 ARG A 21 41.539 37.644 6.340 1.00 52.38 H new ATOM 0 HH12 ARG A 21 43.004 37.869 5.379 1.00 52.38 H new ATOM 0 HH21 ARG A 21 41.832 35.964 2.692 1.00 50.69 H new ATOM 0 HH22 ARG A 21 43.169 36.926 3.330 1.00 50.69 H new ATOM 347 N TYR A 22 36.039 34.999 9.965 1.00 30.22 N ATOM 348 CA TYR A 22 35.076 35.326 11.050 1.00 29.11 C ATOM 349 C TYR A 22 35.782 36.228 12.096 1.00 27.15 C ATOM 350 O TYR A 22 36.976 36.103 12.283 1.00 25.96 O ATOM 351 CB TYR A 22 34.627 34.019 11.724 1.00 27.09 C ATOM 352 CG TYR A 22 33.510 33.350 10.930 1.00 27.40 C ATOM 353 CD1 TYR A 22 32.308 34.029 10.659 1.00 26.95 C ATOM 354 CD2 TYR A 22 33.683 32.041 10.458 1.00 25.13 C ATOM 355 CE1 TYR A 22 31.298 33.402 9.921 1.00 26.07 C ATOM 356 CE2 TYR A 22 32.669 31.416 9.722 1.00 24.89 C ATOM 357 CZ TYR A 22 31.478 32.098 9.453 1.00 24.53 C ATOM 358 OH TYR A 22 30.479 31.483 8.724 1.00 21.93 O ATOM 0 H TYR A 22 36.361 34.031 9.941 1.00 30.22 H new ATOM 0 HA TYR A 22 34.211 35.847 10.641 1.00 29.11 H new ATOM 0 HB2 TYR A 22 35.475 33.339 11.809 1.00 27.09 H new ATOM 0 HB3 TYR A 22 34.283 34.228 12.737 1.00 27.09 H new ATOM 0 HD1 TYR A 22 32.165 35.036 11.021 1.00 26.95 H new ATOM 0 HD2 TYR A 22 34.602 31.513 10.663 1.00 25.13 H new ATOM 0 HE1 TYR A 22 30.378 33.927 9.713 1.00 26.07 H new ATOM 0 HE2 TYR A 22 32.807 30.407 9.362 1.00 24.89 H new ATOM 0 HH TYR A 22 29.624 31.584 9.191 1.00 21.93 H new ATOM 368 N PRO A 23 35.042 37.099 12.768 1.00 25.95 N ATOM 369 CA PRO A 23 35.633 37.980 13.799 1.00 26.49 C ATOM 370 C PRO A 23 36.342 37.141 14.879 1.00 26.35 C ATOM 371 O PRO A 23 36.309 35.930 14.858 1.00 24.48 O ATOM 372 CB PRO A 23 34.438 38.762 14.393 1.00 27.06 C ATOM 373 CG PRO A 23 33.157 38.305 13.639 1.00 29.61 C ATOM 374 CD PRO A 23 33.590 37.285 12.563 1.00 27.83 C ATOM 0 HA PRO A 23 36.387 38.652 13.388 1.00 26.49 H new ATOM 0 HB2 PRO A 23 34.344 38.566 15.461 1.00 27.06 H new ATOM 0 HB3 PRO A 23 34.588 39.836 14.278 1.00 27.06 H new ATOM 0 HG2 PRO A 23 32.446 37.854 14.331 1.00 29.61 H new ATOM 0 HG3 PRO A 23 32.658 39.158 13.180 1.00 29.61 H new ATOM 0 HD2 PRO A 23 33.053 36.343 12.674 1.00 27.83 H new ATOM 0 HD3 PRO A 23 33.378 37.656 11.560 1.00 27.83 H new ATOM 382 N TRP A 24 36.984 37.791 15.813 1.00 23.75 N ATOM 383 CA TRP A 24 37.709 37.058 16.900 1.00 24.21 C ATOM 384 C TRP A 24 36.732 36.587 17.981 1.00 24.68 C ATOM 385 O TRP A 24 37.068 35.764 18.810 1.00 22.18 O ATOM 386 CB TRP A 24 38.747 37.997 17.519 1.00 24.39 C ATOM 387 CG TRP A 24 39.553 37.284 18.565 1.00 26.00 C ATOM 388 CD1 TRP A 24 39.535 37.583 19.885 1.00 27.56 C ATOM 389 CD2 TRP A 24 40.505 36.185 18.410 1.00 24.99 C ATOM 390 NE1 TRP A 24 40.412 36.744 20.548 1.00 24.44 N ATOM 391 CE2 TRP A 24 41.035 35.867 19.684 1.00 27.17 C ATOM 392 CE3 TRP A 24 40.958 35.439 17.304 1.00 27.07 C ATOM 393 CZ2 TRP A 24 41.980 34.853 19.852 1.00 26.88 C ATOM 394 CZ3 TRP A 24 41.907 34.419 17.474 1.00 28.86 C ATOM 395 CH2 TRP A 24 42.419 34.129 18.743 1.00 27.85 C ATOM 0 H TRP A 24 37.039 38.808 15.872 1.00 23.75 H new ATOM 0 HA TRP A 24 38.198 36.181 16.476 1.00 24.21 H new ATOM 0 HB2 TRP A 24 39.408 38.379 16.741 1.00 24.39 H new ATOM 0 HB3 TRP A 24 38.247 38.858 17.963 1.00 24.39 H new ATOM 0 HD1 TRP A 24 38.933 38.352 20.346 1.00 27.56 H new ATOM 0 HE1 TRP A 24 40.578 36.770 21.554 1.00 24.44 H new ATOM 0 HE3 TRP A 24 40.572 35.654 16.318 1.00 27.07 H new ATOM 0 HZ2 TRP A 24 42.369 34.630 20.835 1.00 26.88 H new ATOM 0 HZ3 TRP A 24 42.245 33.853 16.618 1.00 28.86 H new ATOM 0 HH2 TRP A 24 43.153 33.346 18.864 1.00 27.85 H new ATOM 406 N GLU A 25 35.531 37.102 17.997 1.00 21.18 N ATOM 407 CA GLU A 25 34.558 36.674 19.047 1.00 25.10 C ATOM 408 C GLU A 25 33.913 35.334 18.665 1.00 23.53 C ATOM 409 O GLU A 25 33.252 34.722 19.476 1.00 22.15 O ATOM 410 CB GLU A 25 33.469 37.744 19.239 1.00 30.80 C ATOM 411 CG GLU A 25 33.092 38.362 17.890 1.00 38.77 C ATOM 412 CD GLU A 25 31.725 39.045 17.997 1.00 43.31 C ATOM 413 OE1 GLU A 25 30.727 38.348 17.903 1.00 46.36 O ATOM 414 OE2 GLU A 25 31.699 40.252 18.170 1.00 45.94 O ATOM 0 H GLU A 25 35.183 37.795 17.335 1.00 21.18 H new ATOM 0 HA GLU A 25 35.099 36.550 19.985 1.00 25.10 H new ATOM 0 HB2 GLU A 25 32.589 37.298 19.702 1.00 30.80 H new ATOM 0 HB3 GLU A 25 33.827 38.520 19.916 1.00 30.80 H new ATOM 0 HG2 GLU A 25 33.848 39.086 17.587 1.00 38.77 H new ATOM 0 HG3 GLU A 25 33.064 37.590 17.121 1.00 38.77 H new ATOM 421 N LEU A 26 34.074 34.875 17.442 1.00 21.26 N ATOM 422 CA LEU A 26 33.446 33.572 17.044 1.00 20.65 C ATOM 423 C LEU A 26 34.423 32.424 17.258 1.00 20.00 C ATOM 424 O LEU A 26 34.231 31.334 16.757 1.00 16.59 O ATOM 425 CB LEU A 26 33.024 33.616 15.578 1.00 23.25 C ATOM 426 CG LEU A 26 32.215 34.890 15.291 1.00 26.24 C ATOM 427 CD1 LEU A 26 31.451 34.709 13.983 1.00 29.07 C ATOM 428 CD2 LEU A 26 31.209 35.171 16.420 1.00 26.56 C ATOM 0 H LEU A 26 34.608 35.342 16.709 1.00 21.26 H new ATOM 0 HA LEU A 26 32.566 33.411 17.667 1.00 20.65 H new ATOM 0 HB2 LEU A 26 33.906 33.586 14.938 1.00 23.25 H new ATOM 0 HB3 LEU A 26 32.426 32.736 15.339 1.00 23.25 H new ATOM 0 HG LEU A 26 32.905 35.731 15.221 1.00 26.24 H new ATOM 0 HD11 LEU A 26 30.874 35.609 13.771 1.00 29.07 H new ATOM 0 HD12 LEU A 26 32.156 34.531 13.171 1.00 29.07 H new ATOM 0 HD13 LEU A 26 30.776 33.857 14.071 1.00 29.07 H new ATOM 0 HD21 LEU A 26 30.650 36.078 16.191 1.00 26.56 H new ATOM 0 HD22 LEU A 26 30.519 34.332 16.510 1.00 26.56 H new ATOM 0 HD23 LEU A 26 31.745 35.302 17.360 1.00 26.56 H new ATOM 440 N MET A 27 35.449 32.638 18.027 1.00 18.56 N ATOM 441 CA MET A 27 36.393 31.536 18.293 1.00 17.95 C ATOM 442 C MET A 27 35.633 30.362 18.964 1.00 17.26 C ATOM 443 O MET A 27 35.863 29.226 18.601 1.00 15.06 O ATOM 444 CB MET A 27 37.547 32.031 19.195 1.00 20.02 C ATOM 445 CG MET A 27 38.709 32.608 18.369 1.00 18.07 C ATOM 446 SD MET A 27 40.237 32.367 19.300 1.00 11.26 S ATOM 447 CE MET A 27 40.645 30.745 18.627 1.00 20.89 C ATOM 0 H MET A 27 35.670 33.525 18.479 1.00 18.56 H new ATOM 0 HA MET A 27 36.824 31.187 17.354 1.00 17.95 H new ATOM 0 HB2 MET A 27 37.173 32.793 19.878 1.00 20.02 H new ATOM 0 HB3 MET A 27 37.910 31.205 19.807 1.00 20.02 H new ATOM 0 HG2 MET A 27 38.771 32.111 17.401 1.00 18.07 H new ATOM 0 HG3 MET A 27 38.546 33.668 18.173 1.00 18.07 H new ATOM 0 HE1 MET A 27 41.546 30.367 19.110 1.00 20.89 H new ATOM 0 HE2 MET A 27 39.820 30.057 18.810 1.00 20.89 H new ATOM 0 HE3 MET A 27 40.816 30.829 17.554 1.00 20.89 H new ATOM 457 N PRO A 28 34.737 30.641 19.909 1.00 16.29 N ATOM 458 CA PRO A 28 33.969 29.568 20.571 1.00 17.09 C ATOM 459 C PRO A 28 33.168 28.786 19.522 1.00 15.81 C ATOM 460 O PRO A 28 32.992 27.599 19.633 1.00 16.73 O ATOM 461 CB PRO A 28 33.046 30.305 21.573 1.00 16.95 C ATOM 462 CG PRO A 28 33.582 31.752 21.673 1.00 18.75 C ATOM 463 CD PRO A 28 34.411 31.997 20.404 1.00 16.75 C ATOM 0 HA PRO A 28 34.598 28.839 21.082 1.00 17.09 H new ATOM 0 HB2 PRO A 28 32.012 30.296 21.228 1.00 16.95 H new ATOM 0 HB3 PRO A 28 33.061 29.817 22.547 1.00 16.95 H new ATOM 0 HG2 PRO A 28 32.761 32.466 21.744 1.00 18.75 H new ATOM 0 HG3 PRO A 28 34.193 31.879 22.567 1.00 18.75 H new ATOM 0 HD2 PRO A 28 33.847 32.565 19.664 1.00 16.75 H new ATOM 0 HD3 PRO A 28 35.314 32.568 20.623 1.00 16.75 H new ATOM 471 N LEU A 29 32.691 29.438 18.498 1.00 15.35 N ATOM 472 CA LEU A 29 31.919 28.703 17.454 1.00 15.54 C ATOM 473 C LEU A 29 32.889 27.900 16.592 1.00 15.13 C ATOM 474 O LEU A 29 32.784 26.694 16.495 1.00 14.57 O ATOM 475 CB LEU A 29 31.145 29.696 16.589 1.00 15.26 C ATOM 476 CG LEU A 29 30.347 30.646 17.485 1.00 13.96 C ATOM 477 CD1 LEU A 29 29.460 31.524 16.601 1.00 15.02 C ATOM 478 CD2 LEU A 29 29.471 29.836 18.460 1.00 15.96 C ATOM 0 H LEU A 29 32.800 30.439 18.338 1.00 15.35 H new ATOM 0 HA LEU A 29 31.209 28.026 17.928 1.00 15.54 H new ATOM 0 HB2 LEU A 29 31.834 30.263 15.964 1.00 15.26 H new ATOM 0 HB3 LEU A 29 30.472 29.162 15.918 1.00 15.26 H new ATOM 0 HG LEU A 29 31.030 31.269 18.063 1.00 13.96 H new ATOM 0 HD11 LEU A 29 28.885 32.207 17.227 1.00 15.02 H new ATOM 0 HD12 LEU A 29 30.084 32.098 15.916 1.00 15.02 H new ATOM 0 HD13 LEU A 29 28.778 30.894 16.030 1.00 15.02 H new ATOM 0 HD21 LEU A 29 28.906 30.519 19.095 1.00 15.96 H new ATOM 0 HD22 LEU A 29 28.780 29.210 17.895 1.00 15.96 H new ATOM 0 HD23 LEU A 29 30.106 29.205 19.082 1.00 15.96 H new ATOM 490 N MET A 30 33.851 28.542 15.984 1.00 15.06 N ATOM 491 CA MET A 30 34.831 27.783 15.162 1.00 12.45 C ATOM 492 C MET A 30 35.361 26.631 16.012 1.00 12.90 C ATOM 493 O MET A 30 35.579 25.533 15.540 1.00 14.81 O ATOM 494 CB MET A 30 35.998 28.694 14.786 1.00 15.01 C ATOM 495 CG MET A 30 35.541 29.789 13.823 1.00 12.65 C ATOM 496 SD MET A 30 34.986 29.045 12.264 1.00 8.44 S ATOM 497 CE MET A 30 33.247 29.536 12.360 1.00 27.75 C ATOM 0 H MET A 30 33.998 29.551 16.022 1.00 15.06 H new ATOM 0 HA MET A 30 34.355 27.413 14.254 1.00 12.45 H new ATOM 0 HB2 MET A 30 36.417 29.146 15.685 1.00 15.01 H new ATOM 0 HB3 MET A 30 36.791 28.105 14.325 1.00 15.01 H new ATOM 0 HG2 MET A 30 34.731 30.364 14.271 1.00 12.65 H new ATOM 0 HG3 MET A 30 36.359 30.484 13.634 1.00 12.65 H new ATOM 0 HE1 MET A 30 32.737 29.249 11.441 1.00 27.75 H new ATOM 0 HE2 MET A 30 32.775 29.039 13.208 1.00 27.75 H new ATOM 0 HE3 MET A 30 33.181 30.616 12.489 1.00 27.75 H new ATOM 507 N TYR A 31 35.557 26.889 17.276 1.00 13.07 N ATOM 508 CA TYR A 31 36.062 25.832 18.192 1.00 15.35 C ATOM 509 C TYR A 31 35.104 24.632 18.162 1.00 16.32 C ATOM 510 O TYR A 31 35.503 23.508 17.932 1.00 15.86 O ATOM 511 CB TYR A 31 36.138 26.396 19.616 1.00 14.82 C ATOM 512 CG TYR A 31 36.463 25.290 20.593 1.00 17.46 C ATOM 513 CD1 TYR A 31 35.438 24.474 21.091 1.00 20.04 C ATOM 514 CD2 TYR A 31 37.786 25.085 21.009 1.00 19.91 C ATOM 515 CE1 TYR A 31 35.731 23.455 21.999 1.00 21.64 C ATOM 516 CE2 TYR A 31 38.078 24.061 21.914 1.00 22.38 C ATOM 517 CZ TYR A 31 37.052 23.246 22.411 1.00 23.93 C ATOM 518 OH TYR A 31 37.344 22.239 23.308 1.00 30.09 O ATOM 0 H TYR A 31 35.387 27.794 17.715 1.00 13.07 H new ATOM 0 HA TYR A 31 37.053 25.510 17.874 1.00 15.35 H new ATOM 0 HB2 TYR A 31 36.900 27.174 19.668 1.00 14.82 H new ATOM 0 HB3 TYR A 31 35.189 26.861 19.883 1.00 14.82 H new ATOM 0 HD1 TYR A 31 34.419 24.634 20.771 1.00 20.04 H new ATOM 0 HD2 TYR A 31 38.577 25.716 20.631 1.00 19.91 H new ATOM 0 HE1 TYR A 31 34.939 22.829 22.383 1.00 21.64 H new ATOM 0 HE2 TYR A 31 39.097 23.897 22.231 1.00 22.38 H new ATOM 0 HH TYR A 31 38.307 22.230 23.487 1.00 30.09 H new ATOM 528 N VAL A 32 33.840 24.863 18.403 1.00 16.31 N ATOM 529 CA VAL A 32 32.857 23.739 18.403 1.00 13.79 C ATOM 530 C VAL A 32 32.802 23.069 17.028 1.00 15.33 C ATOM 531 O VAL A 32 32.943 21.868 16.917 1.00 15.78 O ATOM 532 CB VAL A 32 31.467 24.272 18.757 1.00 15.68 C ATOM 533 CG1 VAL A 32 30.481 23.107 18.794 1.00 14.40 C ATOM 534 CG2 VAL A 32 31.503 24.953 20.131 1.00 13.96 C ATOM 0 H VAL A 32 33.445 25.783 18.600 1.00 16.31 H new ATOM 0 HA VAL A 32 33.174 23.004 19.142 1.00 13.79 H new ATOM 0 HB VAL A 32 31.155 24.999 18.007 1.00 15.68 H new ATOM 0 HG11 VAL A 32 29.488 23.479 19.046 1.00 14.40 H new ATOM 0 HG12 VAL A 32 30.451 22.625 17.817 1.00 14.40 H new ATOM 0 HG13 VAL A 32 30.799 22.385 19.546 1.00 14.40 H new ATOM 0 HG21 VAL A 32 30.510 25.330 20.376 1.00 13.96 H new ATOM 0 HG22 VAL A 32 31.814 24.232 20.887 1.00 13.96 H new ATOM 0 HG23 VAL A 32 32.210 25.782 20.108 1.00 13.96 H new ATOM 544 N ILE A 33 32.588 23.825 15.982 1.00 13.65 N ATOM 545 CA ILE A 33 32.515 23.218 14.619 1.00 13.17 C ATOM 546 C ILE A 33 33.646 22.188 14.446 1.00 15.24 C ATOM 547 O ILE A 33 33.409 21.028 14.172 1.00 15.62 O ATOM 548 CB ILE A 33 32.631 24.349 13.584 1.00 15.80 C ATOM 549 CG1 ILE A 33 31.296 25.124 13.553 1.00 14.63 C ATOM 550 CG2 ILE A 33 32.927 23.769 12.199 1.00 15.09 C ATOM 551 CD1 ILE A 33 31.437 26.464 12.809 1.00 15.66 C ATOM 0 H ILE A 33 32.461 24.837 16.013 1.00 13.65 H new ATOM 0 HA ILE A 33 31.568 22.697 14.479 1.00 13.17 H new ATOM 0 HB ILE A 33 33.446 25.018 13.859 1.00 15.80 H new ATOM 0 HG12 ILE A 33 30.533 24.516 13.067 1.00 14.63 H new ATOM 0 HG13 ILE A 33 30.957 25.307 14.573 1.00 14.63 H new ATOM 0 HG21 ILE A 33 33.007 24.580 11.475 1.00 15.09 H new ATOM 0 HG22 ILE A 33 33.866 23.216 12.229 1.00 15.09 H new ATOM 0 HG23 ILE A 33 32.120 23.098 11.905 1.00 15.09 H new ATOM 0 HD11 ILE A 33 30.478 26.982 12.807 1.00 15.66 H new ATOM 0 HD12 ILE A 33 32.182 27.082 13.310 1.00 15.66 H new ATOM 0 HD13 ILE A 33 31.751 26.279 11.782 1.00 15.66 H new ATOM 563 N LEU A 34 34.861 22.606 14.628 1.00 16.71 N ATOM 564 CA LEU A 34 36.029 21.678 14.509 1.00 19.71 C ATOM 565 C LEU A 34 35.816 20.474 15.452 1.00 20.61 C ATOM 566 O LEU A 34 36.044 19.339 15.084 1.00 22.08 O ATOM 567 CB LEU A 34 37.297 22.483 14.934 1.00 19.59 C ATOM 568 CG LEU A 34 38.288 22.910 13.769 1.00 26.84 C ATOM 569 CD1 LEU A 34 37.829 22.548 12.349 1.00 24.93 C ATOM 570 CD2 LEU A 34 38.516 24.435 13.818 1.00 27.25 C ATOM 0 H LEU A 34 35.106 23.569 14.859 1.00 16.71 H new ATOM 0 HA LEU A 34 36.141 21.302 13.492 1.00 19.71 H new ATOM 0 HB2 LEU A 34 36.971 23.385 15.452 1.00 19.59 H new ATOM 0 HB3 LEU A 34 37.855 21.885 15.655 1.00 19.59 H new ATOM 0 HG LEU A 34 39.199 22.341 13.956 1.00 26.84 H new ATOM 0 HD11 LEU A 34 38.576 22.883 11.629 1.00 24.93 H new ATOM 0 HD12 LEU A 34 37.708 21.468 12.270 1.00 24.93 H new ATOM 0 HD13 LEU A 34 36.877 23.036 12.139 1.00 24.93 H new ATOM 0 HD21 LEU A 34 39.196 24.727 13.018 1.00 27.25 H new ATOM 0 HD22 LEU A 34 37.564 24.950 13.690 1.00 27.25 H new ATOM 0 HD23 LEU A 34 38.949 24.707 14.780 1.00 27.25 H new ATOM 582 N LYS A 35 35.399 20.720 16.662 1.00 19.14 N ATOM 583 CA LYS A 35 35.187 19.600 17.637 1.00 20.97 C ATOM 584 C LYS A 35 34.365 18.491 16.994 1.00 22.25 C ATOM 585 O LYS A 35 34.523 17.326 17.302 1.00 22.80 O ATOM 586 CB LYS A 35 34.437 20.137 18.866 1.00 22.98 C ATOM 587 CG LYS A 35 34.511 19.123 20.013 1.00 26.83 C ATOM 588 CD LYS A 35 34.061 19.792 21.317 1.00 29.91 C ATOM 589 CE LYS A 35 32.574 20.146 21.234 1.00 33.36 C ATOM 590 NZ LYS A 35 32.054 20.420 22.603 1.00 35.88 N ATOM 0 H LYS A 35 35.193 21.651 17.025 1.00 19.14 H new ATOM 0 HA LYS A 35 36.155 19.198 17.935 1.00 20.97 H new ATOM 0 HB2 LYS A 35 34.871 21.086 19.181 1.00 22.98 H new ATOM 0 HB3 LYS A 35 33.396 20.332 18.610 1.00 22.98 H new ATOM 0 HG2 LYS A 35 33.876 18.264 19.795 1.00 26.83 H new ATOM 0 HG3 LYS A 35 35.529 18.749 20.116 1.00 26.83 H new ATOM 0 HD2 LYS A 35 34.238 19.123 22.159 1.00 29.91 H new ATOM 0 HD3 LYS A 35 34.649 20.692 21.496 1.00 29.91 H new ATOM 0 HE2 LYS A 35 32.432 21.019 20.597 1.00 33.36 H new ATOM 0 HE3 LYS A 35 32.018 19.326 20.779 1.00 33.36 H new ATOM 0 HZ1 LYS A 35 31.244 19.797 22.798 1.00 35.88 H new ATOM 0 HZ2 LYS A 35 32.804 20.241 23.301 1.00 35.88 H new ATOM 0 HZ3 LYS A 35 31.751 21.413 22.667 1.00 35.88 H new ATOM 604 N ASP A 36 33.478 18.843 16.118 1.00 20.87 N ATOM 605 CA ASP A 36 32.625 17.820 15.463 1.00 18.89 C ATOM 606 C ASP A 36 33.319 17.267 14.219 1.00 17.97 C ATOM 607 O ASP A 36 33.313 16.079 13.965 1.00 19.23 O ATOM 608 CB ASP A 36 31.316 18.489 15.068 1.00 16.73 C ATOM 609 CG ASP A 36 30.832 19.351 16.238 1.00 19.06 C ATOM 610 OD1 ASP A 36 30.640 18.804 17.311 1.00 14.84 O ATOM 611 OD2 ASP A 36 30.664 20.543 16.039 1.00 17.75 O ATOM 0 H ASP A 36 33.304 19.804 15.823 1.00 20.87 H new ATOM 0 HA ASP A 36 32.442 16.991 16.147 1.00 18.89 H new ATOM 0 HB2 ASP A 36 31.459 19.104 14.180 1.00 16.73 H new ATOM 0 HB3 ASP A 36 30.568 17.737 14.818 1.00 16.73 H new ATOM 616 N ALA A 37 33.894 18.128 13.433 1.00 19.53 N ATOM 617 CA ALA A 37 34.568 17.675 12.186 1.00 20.29 C ATOM 618 C ALA A 37 35.939 17.088 12.503 1.00 23.93 C ATOM 619 O ALA A 37 36.881 17.259 11.755 1.00 23.82 O ATOM 620 CB ALA A 37 34.734 18.873 11.261 1.00 19.16 C ATOM 0 H ALA A 37 33.927 19.134 13.601 1.00 19.53 H new ATOM 0 HA ALA A 37 33.963 16.905 11.708 1.00 20.29 H new ATOM 0 HB1 ALA A 37 35.227 18.557 10.342 1.00 19.16 H new ATOM 0 HB2 ALA A 37 33.754 19.288 11.023 1.00 19.16 H new ATOM 0 HB3 ALA A 37 35.340 19.633 11.755 1.00 19.16 H new ATOM 626 N ASP A 38 36.070 16.406 13.598 1.00 25.04 N ATOM 627 CA ASP A 38 37.394 15.829 13.934 1.00 29.02 C ATOM 628 C ASP A 38 38.427 16.955 13.936 1.00 30.09 C ATOM 629 O ASP A 38 39.619 16.723 13.949 1.00 29.56 O ATOM 630 CB ASP A 38 37.768 14.775 12.883 1.00 31.78 C ATOM 631 CG ASP A 38 38.809 13.811 13.460 1.00 34.21 C ATOM 632 OD1 ASP A 38 39.986 14.120 13.371 1.00 39.08 O ATOM 633 OD2 ASP A 38 38.411 12.782 13.980 1.00 37.98 O ATOM 0 H ASP A 38 35.325 16.223 14.271 1.00 25.04 H new ATOM 0 HA ASP A 38 37.365 15.355 14.915 1.00 29.02 H new ATOM 0 HB2 ASP A 38 36.879 14.223 12.576 1.00 31.78 H new ATOM 0 HB3 ASP A 38 38.165 15.262 11.992 1.00 31.78 H new ATOM 638 N ALA A 39 37.962 18.174 13.919 1.00 30.33 N ATOM 639 CA ALA A 39 38.878 19.343 13.917 1.00 32.12 C ATOM 640 C ALA A 39 39.538 19.493 12.541 1.00 33.86 C ATOM 641 O ALA A 39 40.478 20.244 12.375 1.00 34.96 O ATOM 642 CB ALA A 39 39.940 19.165 15.005 1.00 32.67 C ATOM 0 H ALA A 39 36.970 18.410 13.906 1.00 30.33 H new ATOM 0 HA ALA A 39 38.308 20.248 14.125 1.00 32.12 H new ATOM 0 HB1 ALA A 39 40.611 20.024 15.002 1.00 32.67 H new ATOM 0 HB2 ALA A 39 39.455 19.087 15.978 1.00 32.67 H new ATOM 0 HB3 ALA A 39 40.511 18.257 14.811 1.00 32.67 H new ATOM 648 N ASN A 40 39.047 18.795 11.549 1.00 33.92 N ATOM 649 CA ASN A 40 39.643 18.918 10.185 1.00 34.20 C ATOM 650 C ASN A 40 38.957 20.066 9.447 1.00 34.98 C ATOM 651 O ASN A 40 37.832 19.948 9.003 1.00 32.10 O ATOM 652 CB ASN A 40 39.437 17.616 9.405 1.00 33.87 C ATOM 653 CG ASN A 40 40.349 17.607 8.176 1.00 32.69 C ATOM 654 OD1 ASN A 40 40.525 18.620 7.529 1.00 34.27 O ATOM 655 ND2 ASN A 40 40.941 16.499 7.827 1.00 33.64 N ATOM 0 H ASN A 40 38.262 18.148 11.624 1.00 33.92 H new ATOM 0 HA ASN A 40 40.712 19.115 10.271 1.00 34.20 H new ATOM 0 HB2 ASN A 40 39.659 16.759 10.042 1.00 33.87 H new ATOM 0 HB3 ASN A 40 38.395 17.524 9.098 1.00 33.87 H new ATOM 0 HD21 ASN A 40 41.552 16.483 7.011 1.00 33.64 H new ATOM 0 HD22 ASN A 40 40.793 15.649 8.370 1.00 33.64 H new ATOM 662 N ILE A 41 39.623 21.178 9.315 1.00 35.49 N ATOM 663 CA ILE A 41 39.011 22.339 8.609 1.00 37.55 C ATOM 664 C ILE A 41 38.384 21.869 7.297 1.00 36.60 C ATOM 665 O ILE A 41 37.261 22.204 6.982 1.00 34.64 O ATOM 666 CB ILE A 41 40.105 23.390 8.339 1.00 39.67 C ATOM 667 CG1 ILE A 41 40.455 24.058 9.689 1.00 42.22 C ATOM 668 CG2 ILE A 41 39.626 24.435 7.283 1.00 40.78 C ATOM 669 CD1 ILE A 41 41.490 25.185 9.525 1.00 44.19 C ATOM 0 H ILE A 41 40.568 21.334 9.666 1.00 35.49 H new ATOM 0 HA ILE A 41 38.230 22.784 9.225 1.00 37.55 H new ATOM 0 HB ILE A 41 40.994 22.918 7.921 1.00 39.67 H new ATOM 0 HG12 ILE A 41 39.548 24.462 10.139 1.00 42.22 H new ATOM 0 HG13 ILE A 41 40.844 23.306 10.375 1.00 42.22 H new ATOM 0 HG21 ILE A 41 40.416 25.166 7.110 1.00 40.78 H new ATOM 0 HG22 ILE A 41 39.391 23.926 6.348 1.00 40.78 H new ATOM 0 HG23 ILE A 41 38.736 24.944 7.653 1.00 40.78 H new ATOM 0 HD11 ILE A 41 41.706 25.625 10.498 1.00 44.19 H new ATOM 0 HD12 ILE A 41 42.407 24.778 9.100 1.00 44.19 H new ATOM 0 HD13 ILE A 41 41.091 25.951 8.860 1.00 44.19 H new ATOM 681 N GLU A 42 39.096 21.105 6.529 1.00 37.01 N ATOM 682 CA GLU A 42 38.532 20.630 5.240 1.00 36.07 C ATOM 683 C GLU A 42 37.159 20.002 5.482 1.00 33.02 C ATOM 684 O GLU A 42 36.203 20.293 4.791 1.00 31.66 O ATOM 685 CB GLU A 42 39.477 19.594 4.632 1.00 40.46 C ATOM 686 CG GLU A 42 40.810 20.264 4.293 1.00 45.44 C ATOM 687 CD GLU A 42 41.710 19.270 3.557 1.00 49.08 C ATOM 688 OE1 GLU A 42 41.205 18.565 2.699 1.00 51.71 O ATOM 689 OE2 GLU A 42 42.891 19.232 3.863 1.00 50.84 O ATOM 0 H GLU A 42 40.043 20.788 6.735 1.00 37.01 H new ATOM 0 HA GLU A 42 38.423 21.470 4.554 1.00 36.07 H new ATOM 0 HB2 GLU A 42 39.636 18.775 5.333 1.00 40.46 H new ATOM 0 HB3 GLU A 42 39.034 19.164 3.734 1.00 40.46 H new ATOM 0 HG2 GLU A 42 40.639 21.144 3.673 1.00 45.44 H new ATOM 0 HG3 GLU A 42 41.299 20.607 5.205 1.00 45.44 H new ATOM 696 N GLU A 43 37.051 19.145 6.457 1.00 29.75 N ATOM 697 CA GLU A 43 35.736 18.503 6.739 1.00 27.99 C ATOM 698 C GLU A 43 34.853 19.480 7.519 1.00 25.26 C ATOM 699 O GLU A 43 33.642 19.430 7.445 1.00 22.77 O ATOM 700 CB GLU A 43 35.949 17.230 7.567 1.00 30.94 C ATOM 701 CG GLU A 43 34.695 16.354 7.499 1.00 33.24 C ATOM 702 CD GLU A 43 34.630 15.655 6.139 1.00 37.98 C ATOM 703 OE1 GLU A 43 35.359 14.694 5.954 1.00 43.17 O ATOM 704 OE2 GLU A 43 33.854 16.093 5.306 1.00 38.40 O ATOM 0 H GLU A 43 37.815 18.861 7.071 1.00 29.75 H new ATOM 0 HA GLU A 43 35.250 18.242 5.799 1.00 27.99 H new ATOM 0 HB2 GLU A 43 36.810 16.679 7.189 1.00 30.94 H new ATOM 0 HB3 GLU A 43 36.167 17.491 8.603 1.00 30.94 H new ATOM 0 HG2 GLU A 43 34.712 15.614 8.299 1.00 33.24 H new ATOM 0 HG3 GLU A 43 33.804 16.964 7.648 1.00 33.24 H new ATOM 711 N ALA A 44 35.449 20.371 8.269 1.00 22.98 N ATOM 712 CA ALA A 44 34.635 21.346 9.050 1.00 23.88 C ATOM 713 C ALA A 44 34.137 22.453 8.113 1.00 22.87 C ATOM 714 O ALA A 44 33.013 22.901 8.211 1.00 22.85 O ATOM 715 CB ALA A 44 35.488 21.931 10.199 1.00 22.28 C ATOM 0 H ALA A 44 36.459 20.464 8.373 1.00 22.98 H new ATOM 0 HA ALA A 44 33.771 20.847 9.488 1.00 23.88 H new ATOM 0 HB1 ALA A 44 34.891 22.643 10.769 1.00 22.28 H new ATOM 0 HB2 ALA A 44 35.816 21.125 10.856 1.00 22.28 H new ATOM 0 HB3 ALA A 44 36.359 22.438 9.784 1.00 22.28 H new ATOM 721 N SER A 45 34.962 22.889 7.207 1.00 25.55 N ATOM 722 CA SER A 45 34.540 23.961 6.263 1.00 26.34 C ATOM 723 C SER A 45 33.342 23.482 5.441 1.00 26.21 C ATOM 724 O SER A 45 32.362 24.184 5.288 1.00 23.95 O ATOM 725 CB SER A 45 35.702 24.288 5.326 1.00 29.82 C ATOM 726 OG SER A 45 35.673 23.400 4.217 1.00 33.07 O ATOM 0 H SER A 45 35.915 22.549 7.078 1.00 25.55 H new ATOM 0 HA SER A 45 34.257 24.851 6.825 1.00 26.34 H new ATOM 0 HB2 SER A 45 35.628 25.320 4.983 1.00 29.82 H new ATOM 0 HB3 SER A 45 36.650 24.195 5.857 1.00 29.82 H new ATOM 0 HG SER A 45 35.944 22.504 4.508 1.00 33.07 H new ATOM 732 N ARG A 46 33.413 22.293 4.908 1.00 26.25 N ATOM 733 CA ARG A 46 32.278 21.770 4.093 1.00 26.19 C ATOM 734 C ARG A 46 30.960 22.008 4.837 1.00 24.78 C ATOM 735 O ARG A 46 29.963 22.375 4.248 1.00 20.51 O ATOM 736 CB ARG A 46 32.475 20.268 3.847 1.00 30.93 C ATOM 737 CG ARG A 46 33.495 20.060 2.722 1.00 37.66 C ATOM 738 CD ARG A 46 33.982 18.610 2.731 1.00 43.41 C ATOM 739 NE ARG A 46 32.816 17.694 2.876 1.00 47.39 N ATOM 740 CZ ARG A 46 32.950 16.421 2.618 1.00 49.82 C ATOM 741 NH1 ARG A 46 34.107 15.952 2.238 1.00 51.10 N ATOM 742 NH2 ARG A 46 31.928 15.619 2.741 1.00 51.02 N ATOM 0 H ARG A 46 34.208 21.660 5.001 1.00 26.25 H new ATOM 0 HA ARG A 46 32.246 22.290 3.135 1.00 26.19 H new ATOM 0 HB2 ARG A 46 32.821 19.782 4.759 1.00 30.93 H new ATOM 0 HB3 ARG A 46 31.525 19.805 3.580 1.00 30.93 H new ATOM 0 HG2 ARG A 46 33.042 20.296 1.759 1.00 37.66 H new ATOM 0 HG3 ARG A 46 34.338 20.738 2.852 1.00 37.66 H new ATOM 0 HD2 ARG A 46 34.518 18.390 1.808 1.00 43.41 H new ATOM 0 HD3 ARG A 46 34.683 18.456 3.551 1.00 43.41 H new ATOM 0 HE ARG A 46 31.913 18.061 3.177 1.00 47.39 H new ATOM 0 HH11 ARG A 46 34.905 16.580 2.143 1.00 51.10 H new ATOM 0 HH12 ARG A 46 34.213 14.958 2.036 1.00 51.10 H new ATOM 0 HH21 ARG A 46 31.024 15.986 3.039 1.00 51.02 H new ATOM 0 HH22 ARG A 46 32.033 14.625 2.539 1.00 51.02 H new ATOM 756 N ARG A 47 30.949 21.808 6.125 1.00 20.40 N ATOM 757 CA ARG A 47 29.695 22.032 6.900 1.00 20.79 C ATOM 758 C ARG A 47 29.351 23.516 6.862 1.00 20.46 C ATOM 759 O ARG A 47 28.313 23.909 6.367 1.00 20.27 O ATOM 760 CB ARG A 47 29.896 21.587 8.350 1.00 18.12 C ATOM 761 CG ARG A 47 30.520 20.188 8.375 1.00 19.83 C ATOM 762 CD ARG A 47 30.786 19.756 9.821 1.00 24.63 C ATOM 763 NE ARG A 47 30.827 18.270 9.885 1.00 25.15 N ATOM 764 CZ ARG A 47 31.318 17.683 10.936 1.00 28.72 C ATOM 765 NH1 ARG A 47 31.752 18.400 11.931 1.00 25.84 N ATOM 766 NH2 ARG A 47 31.379 16.381 10.993 1.00 22.33 N ATOM 0 H ARG A 47 31.751 21.500 6.674 1.00 20.40 H new ATOM 0 HA ARG A 47 28.883 21.452 6.462 1.00 20.79 H new ATOM 0 HB2 ARG A 47 30.541 22.294 8.872 1.00 18.12 H new ATOM 0 HB3 ARG A 47 28.941 21.580 8.875 1.00 18.12 H new ATOM 0 HG2 ARG A 47 29.853 19.475 7.891 1.00 19.83 H new ATOM 0 HG3 ARG A 47 31.452 20.187 7.810 1.00 19.83 H new ATOM 0 HD2 ARG A 47 31.730 20.174 10.171 1.00 24.63 H new ATOM 0 HD3 ARG A 47 30.005 20.139 10.478 1.00 24.63 H new ATOM 0 HE ARG A 47 30.471 17.714 9.107 1.00 25.15 H new ATOM 0 HH11 ARG A 47 31.706 19.418 11.884 1.00 25.84 H new ATOM 0 HH12 ARG A 47 32.138 17.944 12.758 1.00 25.84 H new ATOM 0 HH21 ARG A 47 31.041 15.820 10.211 1.00 22.33 H new ATOM 0 HH22 ARG A 47 31.765 15.924 11.819 1.00 22.33 H new ATOM 780 N ILE A 48 30.227 24.347 7.358 1.00 19.14 N ATOM 781 CA ILE A 48 29.973 25.817 7.325 1.00 21.78 C ATOM 782 C ILE A 48 29.507 26.185 5.926 1.00 25.27 C ATOM 783 O ILE A 48 28.441 26.730 5.729 1.00 23.94 O ATOM 784 CB ILE A 48 31.271 26.549 7.646 1.00 20.97 C ATOM 785 CG1 ILE A 48 31.814 25.994 8.963 1.00 21.08 C ATOM 786 CG2 ILE A 48 30.987 28.048 7.777 1.00 21.08 C ATOM 787 CD1 ILE A 48 33.024 26.811 9.436 1.00 19.82 C ATOM 0 H ILE A 48 31.111 24.071 7.786 1.00 19.14 H new ATOM 0 HA ILE A 48 29.214 26.096 8.055 1.00 21.78 H new ATOM 0 HB ILE A 48 32.005 26.403 6.853 1.00 20.97 H new ATOM 0 HG12 ILE A 48 31.033 26.017 9.723 1.00 21.08 H new ATOM 0 HG13 ILE A 48 32.101 24.951 8.833 1.00 21.08 H new ATOM 0 HG21 ILE A 48 31.913 28.575 8.007 1.00 21.08 H new ATOM 0 HG22 ILE A 48 30.578 28.424 6.839 1.00 21.08 H new ATOM 0 HG23 ILE A 48 30.267 28.213 8.579 1.00 21.08 H new ATOM 0 HD11 ILE A 48 33.396 26.400 10.375 1.00 19.82 H new ATOM 0 HD12 ILE A 48 33.811 26.765 8.683 1.00 19.82 H new ATOM 0 HD13 ILE A 48 32.726 27.849 9.587 1.00 19.82 H new ATOM 799 N GLU A 49 30.300 25.853 4.954 1.00 26.87 N ATOM 800 CA GLU A 49 29.936 26.141 3.541 1.00 31.21 C ATOM 801 C GLU A 49 28.480 25.776 3.295 1.00 31.88 C ATOM 802 O GLU A 49 27.656 26.614 2.988 1.00 31.73 O ATOM 803 CB GLU A 49 30.776 25.245 2.648 1.00 32.85 C ATOM 804 CG GLU A 49 32.199 25.793 2.519 1.00 36.76 C ATOM 805 CD GLU A 49 32.914 25.087 1.366 1.00 40.40 C ATOM 806 OE1 GLU A 49 32.293 24.905 0.331 1.00 43.41 O ATOM 807 OE2 GLU A 49 34.071 24.741 1.536 1.00 40.28 O ATOM 0 H GLU A 49 31.199 25.387 5.078 1.00 26.87 H new ATOM 0 HA GLU A 49 30.101 27.198 3.334 1.00 31.21 H new ATOM 0 HB2 GLU A 49 30.805 24.236 3.060 1.00 32.85 H new ATOM 0 HB3 GLU A 49 30.318 25.173 1.662 1.00 32.85 H new ATOM 0 HG2 GLU A 49 32.171 26.868 2.340 1.00 36.76 H new ATOM 0 HG3 GLU A 49 32.746 25.638 3.449 1.00 36.76 H new ATOM 814 N GLU A 50 28.159 24.518 3.443 1.00 32.05 N ATOM 815 CA GLU A 50 26.756 24.089 3.234 1.00 30.33 C ATOM 816 C GLU A 50 25.901 25.000 4.085 1.00 29.99 C ATOM 817 O GLU A 50 24.893 25.490 3.665 1.00 26.76 O ATOM 818 CB GLU A 50 26.607 22.618 3.676 1.00 33.38 C ATOM 819 CG GLU A 50 25.472 21.939 2.900 1.00 33.45 C ATOM 820 CD GLU A 50 25.435 20.450 3.249 1.00 36.89 C ATOM 821 OE1 GLU A 50 26.227 20.037 4.080 1.00 36.13 O ATOM 822 OE2 GLU A 50 24.615 19.748 2.679 1.00 35.55 O ATOM 0 H GLU A 50 28.809 23.775 3.699 1.00 32.05 H new ATOM 0 HA GLU A 50 26.456 24.154 2.188 1.00 30.33 H new ATOM 0 HB2 GLU A 50 27.542 22.084 3.506 1.00 33.38 H new ATOM 0 HB3 GLU A 50 26.403 22.572 4.746 1.00 33.38 H new ATOM 0 HG2 GLU A 50 24.518 22.405 3.147 1.00 33.45 H new ATOM 0 HG3 GLU A 50 25.622 22.069 1.828 1.00 33.45 H new ATOM 829 N GLY A 51 26.357 25.256 5.267 1.00 0.00 N ATOM 830 CA GLY A 51 25.630 26.159 6.193 1.00 0.00 C ATOM 831 C GLY A 51 25.416 27.534 5.541 1.00 0.00 C ATOM 832 O GLY A 51 24.312 28.013 5.391 1.00 0.00 O ATOM 0 H GLY A 51 27.223 24.870 5.643 1.00 0.00 H new ATOM 0 HA2 GLY A 51 24.668 25.721 6.458 1.00 0.00 H new ATOM 0 HA3 GLY A 51 26.194 26.272 7.119 1.00 0.00 H new ATOM 836 N GLN A 52 26.483 28.188 5.167 1.00 29.60 N ATOM 837 CA GLN A 52 26.353 29.538 4.537 1.00 32.81 C ATOM 838 C GLN A 52 25.349 29.439 3.403 1.00 33.63 C ATOM 839 O GLN A 52 24.405 30.197 3.307 1.00 32.37 O ATOM 840 CB GLN A 52 27.701 29.980 3.955 1.00 32.81 C ATOM 841 CG GLN A 52 28.822 29.833 5.001 1.00 34.44 C ATOM 842 CD GLN A 52 28.982 31.122 5.808 1.00 35.84 C ATOM 843 OE1 GLN A 52 28.037 31.865 5.991 1.00 36.29 O ATOM 844 NE2 GLN A 52 30.153 31.415 6.303 1.00 38.34 N ATOM 0 H GLN A 52 27.439 27.848 5.270 1.00 29.60 H new ATOM 0 HA GLN A 52 26.029 30.260 5.287 1.00 32.81 H new ATOM 0 HB2 GLN A 52 27.937 29.381 3.076 1.00 32.81 H new ATOM 0 HB3 GLN A 52 27.638 31.017 3.626 1.00 32.81 H new ATOM 0 HG2 GLN A 52 28.594 29.004 5.672 1.00 34.44 H new ATOM 0 HG3 GLN A 52 29.761 29.591 4.503 1.00 34.44 H new ATOM 0 HE21 GLN A 52 30.943 30.789 6.148 1.00 38.34 H new ATOM 0 HE22 GLN A 52 30.278 32.270 6.846 1.00 38.34 H new ATOM 853 N TYR A 53 25.554 28.484 2.553 1.00 34.79 N ATOM 854 CA TYR A 53 24.630 28.278 1.415 1.00 37.88 C ATOM 855 C TYR A 53 23.270 27.876 1.979 1.00 39.97 C ATOM 856 O TYR A 53 22.237 28.371 1.579 1.00 39.08 O ATOM 857 CB TYR A 53 25.191 27.150 0.533 1.00 39.97 C ATOM 858 CG TYR A 53 24.082 26.509 -0.265 1.00 42.20 C ATOM 859 CD1 TYR A 53 23.288 25.528 0.323 1.00 42.61 C ATOM 860 CD2 TYR A 53 23.849 26.905 -1.576 1.00 42.58 C ATOM 861 CE1 TYR A 53 22.255 24.936 -0.401 1.00 45.45 C ATOM 862 CE2 TYR A 53 22.814 26.317 -2.313 1.00 44.68 C ATOM 863 CZ TYR A 53 22.014 25.328 -1.723 1.00 45.19 C ATOM 864 OH TYR A 53 20.991 24.745 -2.444 1.00 49.10 O ATOM 0 H TYR A 53 26.333 27.828 2.598 1.00 34.79 H new ATOM 0 HA TYR A 53 24.527 29.184 0.818 1.00 37.88 H new ATOM 0 HB2 TYR A 53 25.949 27.549 -0.141 1.00 39.97 H new ATOM 0 HB3 TYR A 53 25.680 26.401 1.156 1.00 39.97 H new ATOM 0 HD1 TYR A 53 23.473 25.225 1.343 1.00 42.61 H new ATOM 0 HD2 TYR A 53 24.467 27.667 -2.027 1.00 42.58 H new ATOM 0 HE1 TYR A 53 21.641 24.175 0.058 1.00 45.45 H new ATOM 0 HE2 TYR A 53 22.632 26.624 -3.332 1.00 44.68 H new ATOM 0 HH TYR A 53 20.962 25.134 -3.343 1.00 49.10 H new ATOM 874 N VAL A 54 23.285 26.972 2.906 1.00 39.04 N ATOM 875 CA VAL A 54 22.026 26.495 3.525 1.00 40.51 C ATOM 876 C VAL A 54 21.224 27.712 4.001 1.00 40.89 C ATOM 877 O VAL A 54 20.152 28.000 3.508 1.00 40.52 O ATOM 878 CB VAL A 54 22.430 25.609 4.706 1.00 40.89 C ATOM 879 CG1 VAL A 54 21.341 25.541 5.749 1.00 41.12 C ATOM 880 CG2 VAL A 54 22.811 24.175 4.245 1.00 40.75 C ATOM 0 H VAL A 54 24.132 26.534 3.269 1.00 39.04 H new ATOM 0 HA VAL A 54 21.406 25.931 2.828 1.00 40.51 H new ATOM 0 HB VAL A 54 23.309 26.071 5.154 1.00 40.89 H new ATOM 0 HG11 VAL A 54 21.664 24.903 6.572 1.00 41.12 H new ATOM 0 HG12 VAL A 54 21.135 26.543 6.126 1.00 41.12 H new ATOM 0 HG13 VAL A 54 20.436 25.128 5.304 1.00 41.12 H new ATOM 0 HG21 VAL A 54 23.092 23.577 5.112 1.00 40.75 H new ATOM 0 HG22 VAL A 54 21.958 23.714 3.747 1.00 40.75 H new ATOM 0 HG23 VAL A 54 23.651 24.227 3.552 1.00 40.75 H new ATOM 890 N VAL A 55 21.750 28.426 4.957 1.00 40.66 N ATOM 891 CA VAL A 55 21.042 29.628 5.476 1.00 41.79 C ATOM 892 C VAL A 55 20.742 30.560 4.304 1.00 43.19 C ATOM 893 O VAL A 55 19.604 30.897 4.041 1.00 42.93 O ATOM 894 CB VAL A 55 21.936 30.344 6.502 1.00 40.93 C ATOM 895 CG1 VAL A 55 21.164 31.498 7.168 1.00 40.61 C ATOM 896 CG2 VAL A 55 22.379 29.340 7.574 1.00 41.17 C ATOM 0 H VAL A 55 22.645 28.227 5.403 1.00 40.66 H new ATOM 0 HA VAL A 55 20.111 29.338 5.962 1.00 41.79 H new ATOM 0 HB VAL A 55 22.809 30.751 5.992 1.00 40.93 H new ATOM 0 HG11 VAL A 55 21.808 31.997 7.892 1.00 40.61 H new ATOM 0 HG12 VAL A 55 20.851 32.213 6.407 1.00 40.61 H new ATOM 0 HG13 VAL A 55 20.285 31.102 7.677 1.00 40.61 H new ATOM 0 HG21 VAL A 55 23.013 29.843 8.304 1.00 41.17 H new ATOM 0 HG22 VAL A 55 21.501 28.932 8.076 1.00 41.17 H new ATOM 0 HG23 VAL A 55 22.938 28.530 7.105 1.00 41.17 H new ATOM 906 N ASN A 56 21.752 30.971 3.591 1.00 43.65 N ATOM 907 CA ASN A 56 21.519 31.873 2.429 1.00 46.57 C ATOM 908 C ASN A 56 20.409 31.283 1.557 1.00 47.19 C ATOM 909 O ASN A 56 19.492 31.970 1.155 1.00 46.87 O ATOM 910 CB ASN A 56 22.804 31.997 1.608 1.00 46.25 C ATOM 911 CG ASN A 56 23.884 32.685 2.443 1.00 46.74 C ATOM 912 OD1 ASN A 56 23.746 32.826 3.642 1.00 46.94 O ATOM 913 ND2 ASN A 56 24.963 33.123 1.854 1.00 47.06 N ATOM 0 H ASN A 56 22.726 30.723 3.761 1.00 43.65 H new ATOM 0 HA ASN A 56 21.225 32.861 2.783 1.00 46.57 H new ATOM 0 HB2 ASN A 56 23.145 31.010 1.297 1.00 46.25 H new ATOM 0 HB3 ASN A 56 22.613 32.569 0.700 1.00 46.25 H new ATOM 0 HD21 ASN A 56 25.691 33.584 2.400 1.00 47.06 H new ATOM 0 HD22 ASN A 56 25.079 33.004 0.848 1.00 47.06 H new ATOM 920 N GLU A 57 20.480 30.009 1.273 1.00 49.43 N ATOM 921 CA GLU A 57 19.423 29.374 0.438 1.00 51.03 C ATOM 922 C GLU A 57 18.069 29.582 1.112 1.00 51.99 C ATOM 923 O GLU A 57 17.136 30.080 0.514 1.00 52.02 O ATOM 924 CB GLU A 57 19.702 27.873 0.304 1.00 52.77 C ATOM 925 CG GLU A 57 18.700 27.239 -0.670 1.00 54.20 C ATOM 926 CD GLU A 57 17.356 27.025 0.031 1.00 56.33 C ATOM 927 OE1 GLU A 57 17.365 26.544 1.152 1.00 57.76 O ATOM 928 OE2 GLU A 57 16.341 27.346 -0.565 1.00 57.66 O ATOM 0 H GLU A 57 21.223 29.383 1.583 1.00 49.43 H new ATOM 0 HA GLU A 57 19.418 29.826 -0.554 1.00 51.03 H new ATOM 0 HB2 GLU A 57 20.719 27.714 -0.053 1.00 52.77 H new ATOM 0 HB3 GLU A 57 19.628 27.392 1.279 1.00 52.77 H new ATOM 0 HG2 GLU A 57 18.568 27.883 -1.540 1.00 54.20 H new ATOM 0 HG3 GLU A 57 19.086 26.287 -1.034 1.00 54.20 H new ATOM 935 N TYR A 58 17.953 29.210 2.359 1.00 53.12 N ATOM 936 CA TYR A 58 16.658 29.397 3.068 1.00 54.13 C ATOM 937 C TYR A 58 16.208 30.840 2.897 1.00 54.38 C ATOM 938 O TYR A 58 15.036 31.156 2.951 1.00 55.12 O ATOM 939 CB TYR A 58 16.831 29.092 4.556 1.00 54.54 C ATOM 940 CG TYR A 58 15.476 28.990 5.200 1.00 55.20 C ATOM 941 CD1 TYR A 58 14.815 27.763 5.211 1.00 55.36 C ATOM 942 CD2 TYR A 58 14.880 30.117 5.778 1.00 55.64 C ATOM 943 CE1 TYR A 58 13.554 27.655 5.800 1.00 55.93 C ATOM 944 CE2 TYR A 58 13.617 30.011 6.370 1.00 56.15 C ATOM 945 CZ TYR A 58 12.952 28.779 6.381 1.00 56.20 C ATOM 946 OH TYR A 58 11.706 28.672 6.963 1.00 58.01 O ATOM 0 H TYR A 58 18.697 28.787 2.914 1.00 53.12 H new ATOM 0 HA TYR A 58 15.912 28.721 2.651 1.00 54.13 H new ATOM 0 HB2 TYR A 58 17.380 28.160 4.687 1.00 54.54 H new ATOM 0 HB3 TYR A 58 17.416 29.877 5.035 1.00 54.54 H new ATOM 0 HD1 TYR A 58 15.278 26.896 4.764 1.00 55.36 H new ATOM 0 HD2 TYR A 58 15.394 31.067 5.767 1.00 55.64 H new ATOM 0 HE1 TYR A 58 13.042 26.704 5.808 1.00 55.93 H new ATOM 0 HE2 TYR A 58 13.155 30.879 6.818 1.00 56.15 H new ATOM 0 HH TYR A 58 11.435 29.544 7.319 1.00 58.01 H new ATOM 1151 N ASP B 7 13.131 22.910 8.757 1.00 55.77 N ATOM 1152 CA ASP B 7 12.610 24.082 9.508 1.00 53.95 C ATOM 1153 C ASP B 7 12.961 23.939 10.986 1.00 52.49 C ATOM 1154 O ASP B 7 13.598 24.796 11.566 1.00 51.89 O ATOM 1155 CB ASP B 7 11.095 24.133 9.357 1.00 54.63 C ATOM 1156 CG ASP B 7 10.730 24.452 7.906 1.00 55.27 C ATOM 1157 OD1 ASP B 7 10.876 23.573 7.072 1.00 56.33 O ATOM 1158 OD2 ASP B 7 10.311 25.569 7.653 1.00 55.55 O ATOM 0 HA ASP B 7 13.056 24.996 9.116 1.00 53.95 H new ATOM 0 HB2 ASP B 7 10.659 23.178 9.650 1.00 54.63 H new ATOM 0 HB3 ASP B 7 10.679 24.891 10.021 1.00 54.63 H new ATOM 1163 N VAL B 8 12.564 22.854 11.600 1.00 50.38 N ATOM 1164 CA VAL B 8 12.895 22.648 13.044 1.00 48.45 C ATOM 1165 C VAL B 8 14.376 22.951 13.236 1.00 46.36 C ATOM 1166 O VAL B 8 14.800 23.492 14.238 1.00 44.84 O ATOM 1167 CB VAL B 8 12.661 21.182 13.432 1.00 48.63 C ATOM 1168 CG1 VAL B 8 11.179 20.785 13.279 1.00 48.83 C ATOM 1169 CG2 VAL B 8 13.547 20.301 12.556 1.00 47.55 C ATOM 0 H VAL B 8 12.027 22.103 11.166 1.00 50.38 H new ATOM 0 HA VAL B 8 12.269 23.296 13.658 1.00 48.45 H new ATOM 0 HB VAL B 8 12.920 21.045 14.482 1.00 48.63 H new ATOM 0 HG11 VAL B 8 11.051 19.740 13.563 1.00 48.83 H new ATOM 0 HG12 VAL B 8 10.565 21.414 13.924 1.00 48.83 H new ATOM 0 HG13 VAL B 8 10.871 20.920 12.242 1.00 48.83 H new ATOM 0 HG21 VAL B 8 13.393 19.254 12.819 1.00 47.55 H new ATOM 0 HG22 VAL B 8 13.289 20.454 11.508 1.00 47.55 H new ATOM 0 HG23 VAL B 8 14.593 20.565 12.714 1.00 47.55 H new ATOM 1179 N PHE B 9 15.158 22.581 12.264 1.00 44.57 N ATOM 1180 CA PHE B 9 16.617 22.810 12.342 1.00 42.68 C ATOM 1181 C PHE B 9 16.889 24.310 12.444 1.00 41.92 C ATOM 1182 O PHE B 9 17.429 24.790 13.420 1.00 40.56 O ATOM 1183 CB PHE B 9 17.287 22.233 11.080 1.00 41.99 C ATOM 1184 CG PHE B 9 18.702 21.859 11.410 1.00 41.32 C ATOM 1185 CD1 PHE B 9 19.711 22.814 11.293 1.00 41.38 C ATOM 1186 CD2 PHE B 9 19.001 20.568 11.852 1.00 41.88 C ATOM 1187 CE1 PHE B 9 21.021 22.480 11.615 1.00 39.40 C ATOM 1188 CE2 PHE B 9 20.314 20.236 12.177 1.00 39.39 C ATOM 1189 CZ PHE B 9 21.322 21.197 12.056 1.00 40.84 C ATOM 0 H PHE B 9 14.840 22.124 11.409 1.00 44.57 H new ATOM 0 HA PHE B 9 17.026 22.315 13.223 1.00 42.68 H new ATOM 0 HB2 PHE B 9 16.738 21.359 10.728 1.00 41.99 H new ATOM 0 HB3 PHE B 9 17.269 22.967 10.274 1.00 41.99 H new ATOM 0 HD1 PHE B 9 19.475 23.811 10.953 1.00 41.38 H new ATOM 0 HD2 PHE B 9 18.217 19.830 11.941 1.00 41.88 H new ATOM 0 HE1 PHE B 9 21.805 23.217 11.523 1.00 39.40 H new ATOM 0 HE2 PHE B 9 20.552 19.240 12.521 1.00 39.39 H new ATOM 0 HZ PHE B 9 22.341 20.941 12.307 1.00 40.84 H new ATOM 1199 N LEU B 10 16.510 25.053 11.445 1.00 41.09 N ATOM 1200 CA LEU B 10 16.738 26.519 11.492 1.00 41.50 C ATOM 1201 C LEU B 10 16.035 27.077 12.725 1.00 41.09 C ATOM 1202 O LEU B 10 16.503 28.006 13.353 1.00 38.55 O ATOM 1203 CB LEU B 10 16.173 27.167 10.230 1.00 42.71 C ATOM 1204 CG LEU B 10 16.602 26.354 9.007 1.00 43.61 C ATOM 1205 CD1 LEU B 10 16.146 27.068 7.743 1.00 44.50 C ATOM 1206 CD2 LEU B 10 18.127 26.213 8.986 1.00 43.61 C ATOM 0 H LEU B 10 16.053 24.709 10.600 1.00 41.09 H new ATOM 0 HA LEU B 10 17.805 26.733 11.546 1.00 41.50 H new ATOM 0 HB2 LEU B 10 15.085 27.213 10.287 1.00 42.71 H new ATOM 0 HB3 LEU B 10 16.531 28.193 10.143 1.00 42.71 H new ATOM 0 HG LEU B 10 16.149 25.364 9.056 1.00 43.61 H new ATOM 0 HD11 LEU B 10 16.450 26.491 6.869 1.00 44.50 H new ATOM 0 HD12 LEU B 10 15.061 27.167 7.753 1.00 44.50 H new ATOM 0 HD13 LEU B 10 16.600 28.058 7.700 1.00 44.50 H new ATOM 0 HD21 LEU B 10 18.427 25.633 8.113 1.00 43.61 H new ATOM 0 HD22 LEU B 10 18.583 27.202 8.939 1.00 43.61 H new ATOM 0 HD23 LEU B 10 18.458 25.703 9.891 1.00 43.61 H new ATOM 1218 N ASP B 11 14.921 26.505 13.088 1.00 41.28 N ATOM 1219 CA ASP B 11 14.205 26.994 14.294 1.00 41.44 C ATOM 1220 C ASP B 11 15.135 26.854 15.496 1.00 39.86 C ATOM 1221 O ASP B 11 15.420 27.820 16.175 1.00 37.26 O ATOM 1222 CB ASP B 11 12.937 26.169 14.519 1.00 44.23 C ATOM 1223 CG ASP B 11 12.075 26.204 13.255 1.00 46.87 C ATOM 1224 OD1 ASP B 11 12.314 27.065 12.423 1.00 49.31 O ATOM 1225 OD2 ASP B 11 11.191 25.372 13.141 1.00 48.41 O ATOM 0 H ASP B 11 14.479 25.724 12.603 1.00 41.28 H new ATOM 0 HA ASP B 11 13.920 28.038 14.161 1.00 41.44 H new ATOM 0 HB2 ASP B 11 13.199 25.140 14.765 1.00 44.23 H new ATOM 0 HB3 ASP B 11 12.377 26.567 15.365 1.00 44.23 H new ATOM 1230 N TYR B 12 15.641 25.669 15.761 1.00 39.23 N ATOM 1231 CA TYR B 12 16.574 25.526 16.918 1.00 38.08 C ATOM 1232 C TYR B 12 17.652 26.590 16.782 1.00 34.01 C ATOM 1233 O TYR B 12 17.934 27.330 17.702 1.00 32.49 O ATOM 1234 CB TYR B 12 17.275 24.164 16.919 1.00 42.28 C ATOM 1235 CG TYR B 12 16.330 23.007 17.205 1.00 47.31 C ATOM 1236 CD1 TYR B 12 15.459 23.025 18.312 1.00 49.49 C ATOM 1237 CD2 TYR B 12 16.365 21.881 16.374 1.00 48.65 C ATOM 1238 CE1 TYR B 12 14.638 21.920 18.572 1.00 50.83 C ATOM 1239 CE2 TYR B 12 15.547 20.790 16.634 1.00 51.34 C ATOM 1240 CZ TYR B 12 14.684 20.802 17.734 1.00 50.67 C ATOM 1241 OH TYR B 12 13.876 19.713 17.990 1.00 52.32 O ATOM 0 H TYR B 12 15.451 24.815 15.237 1.00 39.23 H new ATOM 0 HA TYR B 12 15.997 25.626 17.838 1.00 38.08 H new ATOM 0 HB2 TYR B 12 17.751 24.006 15.951 1.00 42.28 H new ATOM 0 HB3 TYR B 12 18.068 24.171 17.667 1.00 42.28 H new ATOM 0 HD1 TYR B 12 15.424 23.889 18.959 1.00 49.49 H new ATOM 0 HD2 TYR B 12 17.033 21.861 15.525 1.00 48.65 H new ATOM 0 HE1 TYR B 12 13.969 21.932 19.420 1.00 50.83 H new ATOM 0 HE2 TYR B 12 15.577 19.928 15.984 1.00 51.34 H new ATOM 0 HH TYR B 12 14.032 19.023 17.311 1.00 52.32 H new ATOM 1251 N CYS B 13 18.253 26.673 15.627 1.00 32.32 N ATOM 1252 CA CYS B 13 19.308 27.691 15.412 1.00 29.00 C ATOM 1253 C CYS B 13 18.795 29.034 15.915 1.00 29.81 C ATOM 1254 O CYS B 13 19.331 29.595 16.842 1.00 24.62 O ATOM 1255 CB CYS B 13 19.633 27.783 13.921 1.00 28.41 C ATOM 1256 SG CYS B 13 19.810 26.115 13.241 1.00 23.95 S ATOM 0 H CYS B 13 18.055 26.076 14.824 1.00 32.32 H new ATOM 0 HA CYS B 13 20.213 27.415 15.953 1.00 29.00 H new ATOM 0 HB2 CYS B 13 18.842 28.319 13.397 1.00 28.41 H new ATOM 0 HB3 CYS B 13 20.553 28.348 13.772 1.00 28.41 H new ATOM 0 HG CYS B 13 18.687 25.473 13.369 1.00 23.95 H new ATOM 1262 N GLN B 14 17.743 29.537 15.326 1.00 29.76 N ATOM 1263 CA GLN B 14 17.178 30.841 15.779 1.00 32.34 C ATOM 1264 C GLN B 14 17.115 30.864 17.311 1.00 33.14 C ATOM 1265 O GLN B 14 17.409 31.859 17.937 1.00 33.29 O ATOM 1266 CB GLN B 14 15.774 31.022 15.185 1.00 34.56 C ATOM 1267 CG GLN B 14 15.358 32.504 15.225 1.00 39.08 C ATOM 1268 CD GLN B 14 14.784 32.850 16.604 1.00 41.02 C ATOM 1269 OE1 GLN B 14 13.611 32.651 16.853 1.00 42.67 O ATOM 1270 NE2 GLN B 14 15.565 33.364 17.513 1.00 42.20 N ATOM 0 H GLN B 14 17.249 29.099 14.548 1.00 29.76 H new ATOM 0 HA GLN B 14 17.814 31.658 15.439 1.00 32.34 H new ATOM 0 HB2 GLN B 14 15.759 30.662 14.156 1.00 34.56 H new ATOM 0 HB3 GLN B 14 15.056 30.422 15.744 1.00 34.56 H new ATOM 0 HG2 GLN B 14 16.219 33.138 15.011 1.00 39.08 H new ATOM 0 HG3 GLN B 14 14.615 32.703 14.452 1.00 39.08 H new ATOM 0 HE21 GLN B 14 16.549 33.531 17.304 1.00 42.20 H new ATOM 0 HE22 GLN B 14 15.192 33.599 18.433 1.00 42.20 H new ATOM 1279 N LYS B 15 16.760 29.770 17.925 1.00 31.48 N ATOM 1280 CA LYS B 15 16.723 29.745 19.411 1.00 31.70 C ATOM 1281 C LYS B 15 18.164 29.752 19.924 1.00 30.74 C ATOM 1282 O LYS B 15 18.579 30.645 20.627 1.00 30.57 O ATOM 1283 CB LYS B 15 16.024 28.476 19.872 1.00 35.91 C ATOM 1284 CG LYS B 15 14.671 28.314 19.128 1.00 40.53 C ATOM 1285 CD LYS B 15 13.540 27.968 20.112 1.00 42.80 C ATOM 1286 CE LYS B 15 12.422 27.208 19.383 1.00 45.27 C ATOM 1287 NZ LYS B 15 12.749 25.755 19.355 1.00 48.21 N ATOM 0 H LYS B 15 16.496 28.899 17.465 1.00 31.48 H new ATOM 0 HA LYS B 15 16.183 30.611 19.795 1.00 31.70 H new ATOM 0 HB2 LYS B 15 16.659 27.611 19.681 1.00 35.91 H new ATOM 0 HB3 LYS B 15 15.854 28.515 20.948 1.00 35.91 H new ATOM 0 HG2 LYS B 15 14.429 29.236 18.600 1.00 40.53 H new ATOM 0 HG3 LYS B 15 14.757 27.529 18.376 1.00 40.53 H new ATOM 0 HD2 LYS B 15 13.931 27.361 20.929 1.00 42.80 H new ATOM 0 HD3 LYS B 15 13.141 28.880 20.556 1.00 42.80 H new ATOM 0 HE2 LYS B 15 11.469 27.368 19.888 1.00 45.27 H new ATOM 0 HE3 LYS B 15 12.312 27.587 18.367 1.00 45.27 H new ATOM 0 HZ1 LYS B 15 11.993 25.238 18.862 1.00 48.21 H new ATOM 0 HZ2 LYS B 15 13.650 25.611 18.855 1.00 48.21 H new ATOM 0 HZ3 LYS B 15 12.833 25.399 20.329 1.00 48.21 H new ATOM 1301 N LEU B 16 18.949 28.774 19.547 1.00 26.59 N ATOM 1302 CA LEU B 16 20.376 28.756 19.991 1.00 27.03 C ATOM 1303 C LEU B 16 20.962 30.134 19.688 1.00 24.17 C ATOM 1304 O LEU B 16 21.704 30.708 20.458 1.00 23.26 O ATOM 1305 CB LEU B 16 21.126 27.664 19.210 1.00 28.15 C ATOM 1306 CG LEU B 16 22.391 27.219 19.966 1.00 28.00 C ATOM 1307 CD1 LEU B 16 22.024 26.327 21.159 1.00 30.50 C ATOM 1308 CD2 LEU B 16 23.307 26.429 19.009 1.00 26.29 C ATOM 0 H LEU B 16 18.666 27.993 18.955 1.00 26.59 H new ATOM 0 HA LEU B 16 20.465 28.540 21.056 1.00 27.03 H new ATOM 0 HB2 LEU B 16 20.470 26.807 19.054 1.00 28.15 H new ATOM 0 HB3 LEU B 16 21.400 28.039 18.224 1.00 28.15 H new ATOM 0 HG LEU B 16 22.906 28.106 20.334 1.00 28.00 H new ATOM 0 HD11 LEU B 16 22.932 26.024 21.679 1.00 30.50 H new ATOM 0 HD12 LEU B 16 21.381 26.881 21.843 1.00 30.50 H new ATOM 0 HD13 LEU B 16 21.497 25.442 20.803 1.00 30.50 H new ATOM 0 HD21 LEU B 16 24.204 26.113 19.542 1.00 26.29 H new ATOM 0 HD22 LEU B 16 22.776 25.552 18.639 1.00 26.29 H new ATOM 0 HD23 LEU B 16 23.589 27.064 18.169 1.00 26.29 H new ATOM 1320 N LEU B 17 20.573 30.671 18.572 1.00 23.83 N ATOM 1321 CA LEU B 17 21.021 32.031 18.170 1.00 25.91 C ATOM 1322 C LEU B 17 20.538 33.016 19.242 1.00 28.74 C ATOM 1323 O LEU B 17 21.208 33.971 19.582 1.00 29.35 O ATOM 1324 CB LEU B 17 20.370 32.367 16.818 1.00 23.53 C ATOM 1325 CG LEU B 17 21.111 33.521 16.105 1.00 23.31 C ATOM 1326 CD1 LEU B 17 22.227 32.961 15.202 1.00 16.92 C ATOM 1327 CD2 LEU B 17 20.117 34.311 15.234 1.00 19.75 C ATOM 0 H LEU B 17 19.949 30.216 17.905 1.00 23.83 H new ATOM 0 HA LEU B 17 22.106 32.087 18.076 1.00 25.91 H new ATOM 0 HB2 LEU B 17 20.373 31.482 16.181 1.00 23.53 H new ATOM 0 HB3 LEU B 17 19.327 32.644 16.974 1.00 23.53 H new ATOM 0 HG LEU B 17 21.549 34.174 16.860 1.00 23.31 H new ATOM 0 HD11 LEU B 17 22.741 33.784 14.706 1.00 16.92 H new ATOM 0 HD12 LEU B 17 22.939 32.401 15.808 1.00 16.92 H new ATOM 0 HD13 LEU B 17 21.791 32.301 14.452 1.00 16.92 H new ATOM 0 HD21 LEU B 17 20.640 35.125 14.732 1.00 19.75 H new ATOM 0 HD22 LEU B 17 19.678 33.647 14.489 1.00 19.75 H new ATOM 0 HD23 LEU B 17 19.328 34.721 15.864 1.00 19.75 H new ATOM 1339 N GLU B 18 19.366 32.770 19.778 1.00 30.66 N ATOM 1340 CA GLU B 18 18.802 33.661 20.835 1.00 33.61 C ATOM 1341 C GLU B 18 19.358 33.233 22.195 1.00 34.68 C ATOM 1342 O GLU B 18 19.597 34.049 23.057 1.00 34.80 O ATOM 1343 CB GLU B 18 17.250 33.568 20.792 1.00 35.91 C ATOM 1344 CG GLU B 18 16.686 32.746 21.965 1.00 37.64 C ATOM 1345 CD GLU B 18 15.190 32.511 21.750 1.00 40.24 C ATOM 1346 OE1 GLU B 18 14.695 32.892 20.702 1.00 40.39 O ATOM 1347 OE2 GLU B 18 14.565 31.953 22.637 1.00 40.89 O ATOM 0 H GLU B 18 18.772 31.981 19.524 1.00 30.66 H new ATOM 0 HA GLU B 18 19.087 34.699 20.665 1.00 33.61 H new ATOM 0 HB2 GLU B 18 16.826 34.572 20.817 1.00 35.91 H new ATOM 0 HB3 GLU B 18 16.940 33.115 19.850 1.00 35.91 H new ATOM 0 HG2 GLU B 18 17.208 31.792 22.039 1.00 37.64 H new ATOM 0 HG3 GLU B 18 16.851 33.273 22.905 1.00 37.64 H new ATOM 1354 N LYS B 19 19.575 31.963 22.390 1.00 34.95 N ATOM 1355 CA LYS B 19 20.133 31.511 23.689 1.00 36.04 C ATOM 1356 C LYS B 19 21.473 32.216 23.894 1.00 35.87 C ATOM 1357 O LYS B 19 21.886 32.491 25.002 1.00 36.90 O ATOM 1358 CB LYS B 19 20.327 30.005 23.669 1.00 36.58 C ATOM 1359 CG LYS B 19 20.443 29.506 25.106 1.00 39.52 C ATOM 1360 CD LYS B 19 20.892 28.068 25.071 1.00 41.12 C ATOM 1361 CE LYS B 19 20.995 27.515 26.493 1.00 43.76 C ATOM 1362 NZ LYS B 19 21.983 28.317 27.269 1.00 45.38 N ATOM 0 H LYS B 19 19.391 31.225 21.710 1.00 34.95 H new ATOM 0 HA LYS B 19 19.453 31.755 24.505 1.00 36.04 H new ATOM 0 HB2 LYS B 19 19.487 29.523 23.169 1.00 36.58 H new ATOM 0 HB3 LYS B 19 21.224 29.747 23.106 1.00 36.58 H new ATOM 0 HG2 LYS B 19 21.157 30.113 25.663 1.00 39.52 H new ATOM 0 HG3 LYS B 19 19.484 29.592 25.617 1.00 39.52 H new ATOM 0 HD2 LYS B 19 20.187 27.473 24.491 1.00 41.12 H new ATOM 0 HD3 LYS B 19 21.858 27.993 24.572 1.00 41.12 H new ATOM 0 HE2 LYS B 19 20.020 27.550 26.979 1.00 43.76 H new ATOM 0 HE3 LYS B 19 21.301 26.469 26.466 1.00 43.76 H new ATOM 0 HZ1 LYS B 19 22.307 27.768 28.090 1.00 45.38 H new ATOM 0 HZ2 LYS B 19 22.796 28.547 26.663 1.00 45.38 H new ATOM 0 HZ3 LYS B 19 21.536 29.197 27.596 1.00 45.38 H new ATOM 1376 N PHE B 20 22.144 32.520 22.811 1.00 35.16 N ATOM 1377 CA PHE B 20 23.453 33.222 22.876 1.00 34.19 C ATOM 1378 C PHE B 20 23.284 34.613 22.256 1.00 34.42 C ATOM 1379 O PHE B 20 24.206 35.403 22.205 1.00 33.94 O ATOM 1380 CB PHE B 20 24.466 32.424 22.062 1.00 34.18 C ATOM 1381 CG PHE B 20 24.876 31.195 22.833 1.00 32.04 C ATOM 1382 CD1 PHE B 20 24.118 30.025 22.724 1.00 31.71 C ATOM 1383 CD2 PHE B 20 26.001 31.226 23.663 1.00 34.13 C ATOM 1384 CE1 PHE B 20 24.484 28.885 23.445 1.00 31.01 C ATOM 1385 CE2 PHE B 20 26.366 30.088 24.388 1.00 33.69 C ATOM 1386 CZ PHE B 20 25.605 28.917 24.278 1.00 32.95 C ATOM 0 H PHE B 20 21.828 32.304 21.866 1.00 35.16 H new ATOM 0 HA PHE B 20 23.796 33.314 23.907 1.00 34.19 H new ATOM 0 HB2 PHE B 20 24.033 32.137 21.104 1.00 34.18 H new ATOM 0 HB3 PHE B 20 25.340 33.039 21.846 1.00 34.18 H new ATOM 0 HD1 PHE B 20 23.249 30.002 22.082 1.00 31.71 H new ATOM 0 HD2 PHE B 20 26.588 32.129 23.744 1.00 34.13 H new ATOM 0 HE1 PHE B 20 23.901 27.980 23.358 1.00 31.01 H new ATOM 0 HE2 PHE B 20 27.233 30.111 25.032 1.00 33.69 H new ATOM 0 HZ PHE B 20 25.885 28.037 24.838 1.00 32.95 H new ATOM 1396 N ARG B 21 22.102 34.908 21.783 1.00 33.90 N ATOM 1397 CA ARG B 21 21.842 36.234 21.159 1.00 35.50 C ATOM 1398 C ARG B 21 22.863 36.508 20.055 1.00 34.22 C ATOM 1399 O ARG B 21 23.287 37.630 19.861 1.00 33.41 O ATOM 1400 CB ARG B 21 21.934 37.334 22.219 1.00 38.56 C ATOM 1401 CG ARG B 21 20.871 37.103 23.315 1.00 42.96 C ATOM 1402 CD ARG B 21 21.400 36.153 24.398 1.00 46.75 C ATOM 1403 NE ARG B 21 20.546 36.276 25.615 1.00 50.46 N ATOM 1404 CZ ARG B 21 20.619 35.380 26.561 1.00 51.88 C ATOM 1405 NH1 ARG B 21 21.441 34.374 26.446 1.00 54.10 N ATOM 1406 NH2 ARG B 21 19.870 35.490 27.624 1.00 54.21 N ATOM 0 H ARG B 21 21.299 34.279 21.804 1.00 33.90 H new ATOM 0 HA ARG B 21 20.841 36.226 20.727 1.00 35.50 H new ATOM 0 HB2 ARG B 21 22.930 37.340 22.662 1.00 38.56 H new ATOM 0 HB3 ARG B 21 21.785 38.310 21.756 1.00 38.56 H new ATOM 0 HG2 ARG B 21 20.594 38.056 23.765 1.00 42.96 H new ATOM 0 HG3 ARG B 21 19.968 36.686 22.869 1.00 42.96 H new ATOM 0 HD2 ARG B 21 21.390 35.126 24.034 1.00 46.75 H new ATOM 0 HD3 ARG B 21 22.435 36.396 24.639 1.00 46.75 H new ATOM 0 HE ARG B 21 19.903 37.063 25.708 1.00 50.46 H new ATOM 0 HH11 ARG B 21 22.028 34.287 25.616 1.00 54.10 H new ATOM 0 HH12 ARG B 21 21.497 33.674 27.186 1.00 54.10 H new ATOM 0 HH21 ARG B 21 19.227 36.277 27.716 1.00 54.21 H new ATOM 0 HH22 ARG B 21 19.927 34.789 28.363 1.00 54.21 H new ATOM 1420 N TYR B 22 23.259 35.504 19.320 1.00 31.03 N ATOM 1421 CA TYR B 22 24.242 35.743 18.233 1.00 30.00 C ATOM 1422 C TYR B 22 23.547 36.553 17.110 1.00 28.60 C ATOM 1423 O TYR B 22 22.362 36.387 16.900 1.00 27.38 O ATOM 1424 CB TYR B 22 24.696 34.394 17.658 1.00 26.97 C ATOM 1425 CG TYR B 22 25.770 33.751 18.527 1.00 28.47 C ATOM 1426 CD1 TYR B 22 26.988 34.410 18.779 1.00 28.83 C ATOM 1427 CD2 TYR B 22 25.548 32.478 19.075 1.00 26.95 C ATOM 1428 CE1 TYR B 22 27.965 33.797 19.574 1.00 27.02 C ATOM 1429 CE2 TYR B 22 26.528 31.870 19.868 1.00 26.27 C ATOM 1430 CZ TYR B 22 27.736 32.530 20.117 1.00 26.46 C ATOM 1431 OH TYR B 22 28.701 31.929 20.900 1.00 23.82 O ATOM 0 H TYR B 22 22.946 34.539 19.426 1.00 31.03 H new ATOM 0 HA TYR B 22 25.102 36.289 18.621 1.00 30.00 H new ATOM 0 HB2 TYR B 22 23.840 33.724 17.580 1.00 26.97 H new ATOM 0 HB3 TYR B 22 25.081 34.538 16.649 1.00 26.97 H new ATOM 0 HD1 TYR B 22 27.169 35.388 18.359 1.00 28.83 H new ATOM 0 HD2 TYR B 22 24.617 31.965 18.884 1.00 26.95 H new ATOM 0 HE1 TYR B 22 28.898 34.305 19.768 1.00 27.02 H new ATOM 0 HE2 TYR B 22 26.351 30.891 20.288 1.00 26.27 H new ATOM 0 HH TYR B 22 29.555 32.395 20.782 1.00 23.82 H new ATOM 1441 N PRO B 23 24.288 37.384 16.398 1.00 29.13 N ATOM 1442 CA PRO B 23 23.712 38.169 15.288 1.00 28.62 C ATOM 1443 C PRO B 23 22.988 37.233 14.304 1.00 28.74 C ATOM 1444 O PRO B 23 22.999 36.032 14.454 1.00 26.54 O ATOM 1445 CB PRO B 23 24.921 38.867 14.623 1.00 29.12 C ATOM 1446 CG PRO B 23 26.186 38.495 15.448 1.00 29.87 C ATOM 1447 CD PRO B 23 25.726 37.615 16.630 1.00 29.51 C ATOM 0 HA PRO B 23 22.972 38.895 15.623 1.00 28.62 H new ATOM 0 HB2 PRO B 23 25.029 38.543 13.588 1.00 29.12 H new ATOM 0 HB3 PRO B 23 24.778 39.947 14.606 1.00 29.12 H new ATOM 0 HG2 PRO B 23 26.904 37.959 14.828 1.00 29.87 H new ATOM 0 HG3 PRO B 23 26.685 39.394 15.810 1.00 29.87 H new ATOM 0 HD2 PRO B 23 26.277 36.675 16.660 1.00 29.51 H new ATOM 0 HD3 PRO B 23 25.897 38.115 17.584 1.00 29.51 H new ATOM 1455 N TRP B 24 22.352 37.786 13.308 1.00 24.77 N ATOM 1456 CA TRP B 24 21.609 36.948 12.313 1.00 26.20 C ATOM 1457 C TRP B 24 22.570 36.339 11.283 1.00 24.23 C ATOM 1458 O TRP B 24 22.205 35.450 10.540 1.00 20.77 O ATOM 1459 CB TRP B 24 20.585 37.831 11.600 1.00 28.27 C ATOM 1460 CG TRP B 24 19.814 37.034 10.592 1.00 30.88 C ATOM 1461 CD1 TRP B 24 19.841 37.252 9.257 1.00 31.38 C ATOM 1462 CD2 TRP B 24 18.897 35.916 10.804 1.00 29.00 C ATOM 1463 NE1 TRP B 24 19.000 36.347 8.636 1.00 31.09 N ATOM 1464 CE2 TRP B 24 18.395 35.503 9.545 1.00 31.07 C ATOM 1465 CE3 TRP B 24 18.453 35.225 11.948 1.00 30.12 C ATOM 1466 CZ2 TRP B 24 17.488 34.450 9.429 1.00 31.07 C ATOM 1467 CZ3 TRP B 24 17.541 34.164 11.829 1.00 31.73 C ATOM 1468 CH2 TRP B 24 17.057 33.782 10.571 1.00 30.51 C ATOM 0 H TRP B 24 22.313 38.791 13.136 1.00 24.77 H new ATOM 0 HA TRP B 24 21.110 36.132 12.835 1.00 26.20 H new ATOM 0 HB2 TRP B 24 19.901 38.265 12.329 1.00 28.27 H new ATOM 0 HB3 TRP B 24 21.092 38.660 11.106 1.00 28.27 H new ATOM 0 HD1 TRP B 24 20.425 38.010 8.757 1.00 31.38 H new ATOM 0 HE1 TRP B 24 18.846 36.308 7.629 1.00 31.09 H new ATOM 0 HE3 TRP B 24 18.816 35.513 12.923 1.00 30.12 H new ATOM 0 HZ2 TRP B 24 17.122 34.154 8.457 1.00 31.07 H new ATOM 0 HZ3 TRP B 24 17.210 33.639 12.713 1.00 31.73 H new ATOM 0 HH2 TRP B 24 16.350 32.970 10.488 1.00 30.51 H new ATOM 1479 N GLU B 25 23.784 36.815 11.213 1.00 21.71 N ATOM 1480 CA GLU B 25 24.746 36.266 10.205 1.00 23.69 C ATOM 1481 C GLU B 25 25.428 34.989 10.723 1.00 22.17 C ATOM 1482 O GLU B 25 26.089 34.306 9.972 1.00 20.98 O ATOM 1483 CB GLU B 25 25.811 37.324 9.874 1.00 29.06 C ATOM 1484 CG GLU B 25 26.186 38.097 11.141 1.00 37.12 C ATOM 1485 CD GLU B 25 27.526 38.808 10.936 1.00 42.03 C ATOM 1486 OE1 GLU B 25 28.542 38.131 10.946 1.00 44.49 O ATOM 1487 OE2 GLU B 25 27.514 40.017 10.773 1.00 44.52 O ATOM 0 H GLU B 25 24.153 37.558 11.807 1.00 21.71 H new ATOM 0 HA GLU B 25 24.186 36.012 9.305 1.00 23.69 H new ATOM 0 HB2 GLU B 25 26.695 36.844 9.455 1.00 29.06 H new ATOM 0 HB3 GLU B 25 25.432 38.011 9.117 1.00 29.06 H new ATOM 0 HG2 GLU B 25 25.410 38.825 11.377 1.00 37.12 H new ATOM 0 HG3 GLU B 25 26.252 37.415 11.988 1.00 37.12 H new ATOM 1494 N LEU B 26 25.304 34.663 11.991 1.00 18.07 N ATOM 1495 CA LEU B 26 25.980 33.426 12.514 1.00 16.50 C ATOM 1496 C LEU B 26 25.040 32.232 12.455 1.00 16.77 C ATOM 1497 O LEU B 26 25.260 31.227 13.102 1.00 16.07 O ATOM 1498 CB LEU B 26 26.428 33.648 13.954 1.00 18.60 C ATOM 1499 CG LEU B 26 27.167 34.987 14.078 1.00 21.90 C ATOM 1500 CD1 LEU B 26 27.922 35.021 15.405 1.00 24.06 C ATOM 1501 CD2 LEU B 26 28.172 35.155 12.928 1.00 25.09 C ATOM 0 H LEU B 26 24.770 35.193 12.680 1.00 18.07 H new ATOM 0 HA LEU B 26 26.848 33.220 11.888 1.00 16.50 H new ATOM 0 HB2 LEU B 26 25.563 33.639 14.617 1.00 18.60 H new ATOM 0 HB3 LEU B 26 27.080 32.834 14.269 1.00 18.60 H new ATOM 0 HG LEU B 26 26.438 35.797 14.035 1.00 21.90 H new ATOM 0 HD11 LEU B 26 28.449 35.970 15.499 1.00 24.06 H new ATOM 0 HD12 LEU B 26 27.216 34.915 16.228 1.00 24.06 H new ATOM 0 HD13 LEU B 26 28.641 34.202 15.436 1.00 24.06 H new ATOM 0 HD21 LEU B 26 28.687 36.110 13.032 1.00 25.09 H new ATOM 0 HD22 LEU B 26 28.900 34.345 12.960 1.00 25.09 H new ATOM 0 HD23 LEU B 26 27.643 35.130 11.976 1.00 25.09 H new ATOM 1513 N MET B 27 24.014 32.309 11.661 1.00 15.51 N ATOM 1514 CA MET B 27 23.105 31.152 11.547 1.00 15.51 C ATOM 1515 C MET B 27 23.870 29.949 10.948 1.00 15.79 C ATOM 1516 O MET B 27 23.671 28.838 11.399 1.00 14.86 O ATOM 1517 CB MET B 27 21.900 31.505 10.660 1.00 16.03 C ATOM 1518 CG MET B 27 20.826 32.253 11.449 1.00 14.48 C ATOM 1519 SD MET B 27 19.275 32.065 10.559 1.00 11.00 S ATOM 1520 CE MET B 27 18.808 30.451 11.219 1.00 16.96 C ATOM 0 H MET B 27 23.770 33.119 11.091 1.00 15.51 H new ATOM 0 HA MET B 27 22.739 30.888 12.539 1.00 15.51 H new ATOM 0 HB2 MET B 27 22.231 32.118 9.822 1.00 16.03 H new ATOM 0 HB3 MET B 27 21.476 30.593 10.240 1.00 16.03 H new ATOM 0 HG2 MET B 27 20.741 31.850 12.458 1.00 14.48 H new ATOM 0 HG3 MET B 27 21.086 33.307 11.548 1.00 14.48 H new ATOM 0 HE1 MET B 27 18.377 29.843 10.423 1.00 16.96 H new ATOM 0 HE2 MET B 27 19.691 29.952 11.619 1.00 16.96 H new ATOM 0 HE3 MET B 27 18.074 30.582 12.014 1.00 16.96 H new ATOM 1530 N PRO B 28 24.732 30.170 9.957 1.00 15.25 N ATOM 1531 CA PRO B 28 25.494 29.061 9.358 1.00 16.18 C ATOM 1532 C PRO B 28 26.339 28.402 10.448 1.00 15.53 C ATOM 1533 O PRO B 28 26.704 27.255 10.353 1.00 16.52 O ATOM 1534 CB PRO B 28 26.362 29.725 8.261 1.00 16.78 C ATOM 1535 CG PRO B 28 25.804 31.155 8.073 1.00 19.84 C ATOM 1536 CD PRO B 28 25.030 31.489 9.355 1.00 17.18 C ATOM 0 HA PRO B 28 24.871 28.277 8.928 1.00 16.18 H new ATOM 0 HB2 PRO B 28 27.410 29.753 8.558 1.00 16.78 H new ATOM 0 HB3 PRO B 28 26.310 29.161 7.329 1.00 16.78 H new ATOM 0 HG2 PRO B 28 26.611 31.869 7.910 1.00 19.84 H new ATOM 0 HG3 PRO B 28 25.152 31.206 7.201 1.00 19.84 H new ATOM 0 HD2 PRO B 28 25.623 32.108 10.028 1.00 17.18 H new ATOM 0 HD3 PRO B 28 24.116 32.042 9.135 1.00 17.18 H new ATOM 1544 N LEU B 29 26.634 29.120 11.497 1.00 13.35 N ATOM 1545 CA LEU B 29 27.431 28.530 12.608 1.00 12.43 C ATOM 1546 C LEU B 29 26.469 27.826 13.566 1.00 12.94 C ATOM 1547 O LEU B 29 26.634 26.662 13.874 1.00 13.87 O ATOM 1548 CB LEU B 29 28.207 29.640 13.323 1.00 15.82 C ATOM 1549 CG LEU B 29 28.945 30.490 12.280 1.00 12.60 C ATOM 1550 CD1 LEU B 29 29.862 31.488 12.994 1.00 13.73 C ATOM 1551 CD2 LEU B 29 29.784 29.579 11.364 1.00 13.81 C ATOM 0 H LEU B 29 26.356 30.092 11.632 1.00 13.35 H new ATOM 0 HA LEU B 29 28.152 27.806 12.227 1.00 12.43 H new ATOM 0 HB2 LEU B 29 27.525 30.263 13.901 1.00 15.82 H new ATOM 0 HB3 LEU B 29 28.918 29.208 14.027 1.00 15.82 H new ATOM 0 HG LEU B 29 28.218 31.032 11.675 1.00 12.60 H new ATOM 0 HD11 LEU B 29 30.387 32.093 12.255 1.00 13.73 H new ATOM 0 HD12 LEU B 29 29.265 32.136 13.635 1.00 13.73 H new ATOM 0 HD13 LEU B 29 30.587 30.946 13.601 1.00 13.73 H new ATOM 0 HD21 LEU B 29 30.306 30.187 10.625 1.00 13.81 H new ATOM 0 HD22 LEU B 29 30.512 29.032 11.963 1.00 13.81 H new ATOM 0 HD23 LEU B 29 29.129 28.872 10.855 1.00 13.81 H new ATOM 1563 N MET B 30 25.439 28.500 14.010 1.00 13.14 N ATOM 1564 CA MET B 30 24.454 27.830 14.904 1.00 14.92 C ATOM 1565 C MET B 30 23.960 26.583 14.176 1.00 15.06 C ATOM 1566 O MET B 30 23.731 25.543 14.760 1.00 14.78 O ATOM 1567 CB MET B 30 23.262 28.771 15.152 1.00 14.70 C ATOM 1568 CG MET B 30 23.545 29.683 16.342 1.00 10.57 C ATOM 1569 SD MET B 30 24.993 30.715 15.990 1.00 7.09 S ATOM 1570 CE MET B 30 26.116 30.026 17.234 1.00 13.40 C ATOM 0 H MET B 30 25.240 29.477 13.793 1.00 13.14 H new ATOM 0 HA MET B 30 24.910 27.575 15.860 1.00 14.92 H new ATOM 0 HB2 MET B 30 23.073 29.371 14.262 1.00 14.70 H new ATOM 0 HB3 MET B 30 22.361 28.186 15.339 1.00 14.70 H new ATOM 0 HG2 MET B 30 22.678 30.312 16.544 1.00 10.57 H new ATOM 0 HG3 MET B 30 23.721 29.086 17.237 1.00 10.57 H new ATOM 0 HE1 MET B 30 26.901 30.749 17.456 1.00 13.40 H new ATOM 0 HE2 MET B 30 25.559 29.804 18.144 1.00 13.40 H new ATOM 0 HE3 MET B 30 26.565 29.110 16.851 1.00 13.40 H new ATOM 1580 N TYR B 31 23.793 26.706 12.891 1.00 13.82 N ATOM 1581 CA TYR B 31 23.309 25.566 12.074 1.00 14.24 C ATOM 1582 C TYR B 31 24.260 24.370 12.224 1.00 15.20 C ATOM 1583 O TYR B 31 23.865 23.297 12.633 1.00 15.23 O ATOM 1584 CB TYR B 31 23.251 25.998 10.607 1.00 15.18 C ATOM 1585 CG TYR B 31 22.881 24.819 9.744 1.00 19.70 C ATOM 1586 CD1 TYR B 31 23.874 23.934 9.310 1.00 21.03 C ATOM 1587 CD2 TYR B 31 21.546 24.611 9.374 1.00 22.09 C ATOM 1588 CE1 TYR B 31 23.538 22.843 8.508 1.00 22.51 C ATOM 1589 CE2 TYR B 31 21.209 23.515 8.573 1.00 25.56 C ATOM 1590 CZ TYR B 31 22.204 22.631 8.139 1.00 25.00 C ATOM 1591 OH TYR B 31 21.870 21.552 7.347 1.00 30.46 O ATOM 0 H TYR B 31 23.975 27.562 12.366 1.00 13.82 H new ATOM 0 HA TYR B 31 22.317 25.269 12.413 1.00 14.24 H new ATOM 0 HB2 TYR B 31 22.519 26.796 10.482 1.00 15.18 H new ATOM 0 HB3 TYR B 31 24.216 26.399 10.298 1.00 15.18 H new ATOM 0 HD1 TYR B 31 24.903 24.096 9.596 1.00 21.03 H new ATOM 0 HD2 TYR B 31 20.779 25.295 9.706 1.00 22.09 H new ATOM 0 HE1 TYR B 31 24.306 22.162 8.172 1.00 22.51 H new ATOM 0 HE2 TYR B 31 20.180 23.351 8.289 1.00 25.56 H new ATOM 0 HH TYR B 31 20.903 21.552 7.185 1.00 30.46 H new ATOM 1601 N VAL B 32 25.509 24.545 11.884 1.00 14.03 N ATOM 1602 CA VAL B 32 26.483 23.417 11.992 1.00 12.14 C ATOM 1603 C VAL B 32 26.517 22.884 13.427 1.00 12.91 C ATOM 1604 O VAL B 32 26.375 21.700 13.657 1.00 14.47 O ATOM 1605 CB VAL B 32 27.880 23.903 11.592 1.00 12.64 C ATOM 1606 CG1 VAL B 32 28.853 22.728 11.641 1.00 12.95 C ATOM 1607 CG2 VAL B 32 27.843 24.478 10.168 1.00 14.27 C ATOM 0 H VAL B 32 25.898 25.421 11.536 1.00 14.03 H new ATOM 0 HA VAL B 32 26.171 22.615 11.323 1.00 12.14 H new ATOM 0 HB VAL B 32 28.205 24.680 12.283 1.00 12.64 H new ATOM 0 HG11 VAL B 32 29.849 23.068 11.357 1.00 12.95 H new ATOM 0 HG12 VAL B 32 28.883 22.322 12.652 1.00 12.95 H new ATOM 0 HG13 VAL B 32 28.523 21.953 10.949 1.00 12.95 H new ATOM 0 HG21 VAL B 32 28.839 24.822 9.889 1.00 14.27 H new ATOM 0 HG22 VAL B 32 27.518 23.705 9.472 1.00 14.27 H new ATOM 0 HG23 VAL B 32 27.146 25.315 10.132 1.00 14.27 H new ATOM 1617 N ILE B 33 26.710 23.742 14.391 1.00 13.72 N ATOM 1618 CA ILE B 33 26.758 23.286 15.810 1.00 9.81 C ATOM 1619 C ILE B 33 25.619 22.287 16.081 1.00 12.06 C ATOM 1620 O ILE B 33 25.844 21.174 16.513 1.00 13.15 O ATOM 1621 CB ILE B 33 26.636 24.532 16.697 1.00 11.56 C ATOM 1622 CG1 ILE B 33 27.971 25.295 16.627 1.00 12.90 C ATOM 1623 CG2 ILE B 33 26.331 24.144 18.148 1.00 12.06 C ATOM 1624 CD1 ILE B 33 27.855 26.679 17.277 1.00 11.54 C ATOM 0 H ILE B 33 26.837 24.745 14.256 1.00 13.72 H new ATOM 0 HA ILE B 33 27.694 22.771 16.027 1.00 9.81 H new ATOM 0 HB ILE B 33 25.816 25.157 16.343 1.00 11.56 H new ATOM 0 HG12 ILE B 33 28.749 24.719 17.129 1.00 12.90 H new ATOM 0 HG13 ILE B 33 28.276 25.404 15.586 1.00 12.90 H new ATOM 0 HG21 ILE B 33 26.249 25.045 18.756 1.00 12.06 H new ATOM 0 HG22 ILE B 33 25.391 23.593 18.187 1.00 12.06 H new ATOM 0 HG23 ILE B 33 27.135 23.517 18.534 1.00 12.06 H new ATOM 0 HD11 ILE B 33 28.814 27.193 17.212 1.00 11.54 H new ATOM 0 HD12 ILE B 33 27.094 27.262 16.758 1.00 11.54 H new ATOM 0 HD13 ILE B 33 27.574 26.567 18.324 1.00 11.54 H new ATOM 1636 N LEU B 34 24.410 22.675 15.810 1.00 13.55 N ATOM 1637 CA LEU B 34 23.238 21.767 16.017 1.00 16.27 C ATOM 1638 C LEU B 34 23.442 20.471 15.203 1.00 18.00 C ATOM 1639 O LEU B 34 23.143 19.388 15.664 1.00 20.35 O ATOM 1640 CB LEU B 34 21.974 22.535 15.513 1.00 15.33 C ATOM 1641 CG LEU B 34 20.965 23.048 16.629 1.00 18.88 C ATOM 1642 CD1 LEU B 34 21.406 22.799 18.078 1.00 18.63 C ATOM 1643 CD2 LEU B 34 20.734 24.564 16.459 1.00 18.04 C ATOM 0 H LEU B 34 24.173 23.598 15.447 1.00 13.55 H new ATOM 0 HA LEU B 34 23.125 21.492 17.066 1.00 16.27 H new ATOM 0 HB2 LEU B 34 22.306 23.395 14.932 1.00 15.33 H new ATOM 0 HB3 LEU B 34 21.427 21.883 14.832 1.00 15.33 H new ATOM 0 HG LEU B 34 20.058 22.464 16.474 1.00 18.88 H new ATOM 0 HD11 LEU B 34 20.649 23.186 18.760 1.00 18.63 H new ATOM 0 HD12 LEU B 34 21.529 21.728 18.242 1.00 18.63 H new ATOM 0 HD13 LEU B 34 22.353 23.306 18.262 1.00 18.63 H new ATOM 0 HD21 LEU B 34 20.042 24.915 17.225 1.00 18.04 H new ATOM 0 HD22 LEU B 34 21.683 25.090 16.559 1.00 18.04 H new ATOM 0 HD23 LEU B 34 20.313 24.760 15.473 1.00 18.04 H new ATOM 1655 N LYS B 35 23.934 20.576 14.000 1.00 16.90 N ATOM 1656 CA LYS B 35 24.141 19.351 13.158 1.00 19.51 C ATOM 1657 C LYS B 35 24.965 18.324 13.922 1.00 18.97 C ATOM 1658 O LYS B 35 24.821 17.132 13.737 1.00 18.29 O ATOM 1659 CB LYS B 35 24.887 19.733 11.871 1.00 23.32 C ATOM 1660 CG LYS B 35 24.881 18.549 10.900 1.00 27.46 C ATOM 1661 CD LYS B 35 25.357 19.015 9.522 1.00 30.03 C ATOM 1662 CE LYS B 35 25.539 17.803 8.606 1.00 33.24 C ATOM 1663 NZ LYS B 35 25.727 18.265 7.202 1.00 34.14 N ATOM 0 H LYS B 35 24.204 21.455 13.558 1.00 16.90 H new ATOM 0 HA LYS B 35 23.169 18.924 12.912 1.00 19.51 H new ATOM 0 HB2 LYS B 35 24.413 20.598 11.408 1.00 23.32 H new ATOM 0 HB3 LYS B 35 25.913 20.019 12.105 1.00 23.32 H new ATOM 0 HG2 LYS B 35 25.531 17.757 11.272 1.00 27.46 H new ATOM 0 HG3 LYS B 35 23.877 18.130 10.827 1.00 27.46 H new ATOM 0 HD2 LYS B 35 24.632 19.705 9.090 1.00 30.03 H new ATOM 0 HD3 LYS B 35 26.298 19.558 9.615 1.00 30.03 H new ATOM 0 HE2 LYS B 35 26.401 17.218 8.926 1.00 33.24 H new ATOM 0 HE3 LYS B 35 24.669 17.150 8.672 1.00 33.24 H new ATOM 0 HZ1 LYS B 35 25.851 17.441 6.579 1.00 34.14 H new ATOM 0 HZ2 LYS B 35 24.891 18.805 6.900 1.00 34.14 H new ATOM 0 HZ3 LYS B 35 26.570 18.871 7.146 1.00 34.14 H new ATOM 1677 N ASP B 36 25.837 18.777 14.765 1.00 17.40 N ATOM 1678 CA ASP B 36 26.693 17.841 15.535 1.00 17.99 C ATOM 1679 C ASP B 36 25.989 17.415 16.820 1.00 20.53 C ATOM 1680 O ASP B 36 25.992 16.259 17.193 1.00 21.50 O ATOM 1681 CB ASP B 36 27.987 18.568 15.874 1.00 17.75 C ATOM 1682 CG ASP B 36 28.505 19.261 14.612 1.00 19.30 C ATOM 1683 OD1 ASP B 36 28.731 18.571 13.631 1.00 18.21 O ATOM 1684 OD2 ASP B 36 28.666 20.470 14.647 1.00 17.31 O ATOM 0 H ASP B 36 25.997 19.766 14.958 1.00 17.40 H new ATOM 0 HA ASP B 36 26.896 16.947 14.946 1.00 17.99 H new ATOM 0 HB2 ASP B 36 27.814 19.300 16.663 1.00 17.75 H new ATOM 0 HB3 ASP B 36 28.729 17.864 16.250 1.00 17.75 H new ATOM 1689 N ALA B 37 25.406 18.350 17.510 1.00 17.76 N ATOM 1690 CA ALA B 37 24.719 18.025 18.788 1.00 20.31 C ATOM 1691 C ALA B 37 23.353 17.407 18.518 1.00 21.98 C ATOM 1692 O ALA B 37 22.402 17.651 19.234 1.00 20.93 O ATOM 1693 CB ALA B 37 24.539 19.309 19.582 1.00 16.79 C ATOM 0 H ALA B 37 25.375 19.334 17.242 1.00 17.76 H new ATOM 0 HA ALA B 37 25.321 17.309 19.348 1.00 20.31 H new ATOM 0 HB1 ALA B 37 24.036 19.087 20.523 1.00 16.79 H new ATOM 0 HB2 ALA B 37 25.515 19.750 19.787 1.00 16.79 H new ATOM 0 HB3 ALA B 37 23.937 20.012 19.006 1.00 16.79 H new ATOM 1699 N ASP B 38 23.233 16.617 17.495 1.00 22.08 N ATOM 1700 CA ASP B 38 21.912 16.008 17.205 1.00 24.70 C ATOM 1701 C ASP B 38 20.872 17.126 17.122 1.00 27.43 C ATOM 1702 O ASP B 38 19.690 16.909 17.297 1.00 26.89 O ATOM 1703 CB ASP B 38 21.547 15.032 18.332 1.00 26.17 C ATOM 1704 CG ASP B 38 20.518 14.015 17.829 1.00 26.41 C ATOM 1705 OD1 ASP B 38 20.920 13.074 17.165 1.00 29.79 O ATOM 1706 OD2 ASP B 38 19.347 14.195 18.118 1.00 30.65 O ATOM 0 H ASP B 38 23.984 16.368 16.852 1.00 22.08 H new ATOM 0 HA ASP B 38 21.941 15.463 16.262 1.00 24.70 H new ATOM 0 HB2 ASP B 38 22.441 14.515 18.681 1.00 26.17 H new ATOM 0 HB3 ASP B 38 21.143 15.580 19.183 1.00 26.17 H new ATOM 1711 N ALA B 39 21.321 18.323 16.863 1.00 25.83 N ATOM 1712 CA ALA B 39 20.394 19.479 16.769 1.00 28.40 C ATOM 1713 C ALA B 39 19.729 19.725 18.128 1.00 30.32 C ATOM 1714 O ALA B 39 18.759 20.449 18.231 1.00 32.55 O ATOM 1715 CB ALA B 39 19.335 19.201 15.705 1.00 28.82 C ATOM 0 H ALA B 39 22.304 18.549 16.711 1.00 25.83 H new ATOM 0 HA ALA B 39 20.954 20.370 16.487 1.00 28.40 H new ATOM 0 HB1 ALA B 39 18.655 20.051 15.637 1.00 28.82 H new ATOM 0 HB2 ALA B 39 19.820 19.046 14.741 1.00 28.82 H new ATOM 0 HB3 ALA B 39 18.773 18.307 15.976 1.00 28.82 H new ATOM 1721 N ASN B 40 20.249 19.136 19.175 1.00 29.50 N ATOM 1722 CA ASN B 40 19.653 19.347 20.529 1.00 32.01 C ATOM 1723 C ASN B 40 20.331 20.550 21.190 1.00 32.47 C ATOM 1724 O ASN B 40 21.453 20.473 21.649 1.00 29.40 O ATOM 1725 CB ASN B 40 19.868 18.099 21.387 1.00 33.06 C ATOM 1726 CG ASN B 40 18.966 16.971 20.882 1.00 33.55 C ATOM 1727 OD1 ASN B 40 18.736 16.846 19.695 1.00 35.11 O ATOM 1728 ND2 ASN B 40 18.441 16.138 21.739 1.00 33.85 N ATOM 0 H ASN B 40 21.060 18.518 19.151 1.00 29.50 H new ATOM 0 HA ASN B 40 18.583 19.534 20.435 1.00 32.01 H new ATOM 0 HB2 ASN B 40 20.913 17.791 21.344 1.00 33.06 H new ATOM 0 HB3 ASN B 40 19.643 18.319 22.431 1.00 33.06 H new ATOM 0 HD21 ASN B 40 17.838 15.383 21.412 1.00 33.85 H new ATOM 0 HD22 ASN B 40 18.634 16.242 22.735 1.00 33.85 H new ATOM 1735 N ILE B 41 19.656 21.665 21.228 1.00 33.58 N ATOM 1736 CA ILE B 41 20.243 22.891 21.842 1.00 35.14 C ATOM 1737 C ILE B 41 20.904 22.556 23.177 1.00 34.57 C ATOM 1738 O ILE B 41 22.089 22.748 23.351 1.00 33.97 O ATOM 1739 CB ILE B 41 19.121 23.911 22.063 1.00 38.72 C ATOM 1740 CG1 ILE B 41 18.557 24.288 20.686 1.00 39.13 C ATOM 1741 CG2 ILE B 41 19.636 25.176 22.827 1.00 40.27 C ATOM 1742 CD1 ILE B 41 17.490 25.367 20.841 1.00 40.55 C ATOM 0 H ILE B 41 18.713 21.781 20.856 1.00 33.58 H new ATOM 0 HA ILE B 41 21.002 23.303 21.177 1.00 35.14 H new ATOM 0 HB ILE B 41 18.340 23.474 22.685 1.00 38.72 H new ATOM 0 HG12 ILE B 41 19.359 24.647 20.041 1.00 39.13 H new ATOM 0 HG13 ILE B 41 18.130 23.408 20.205 1.00 39.13 H new ATOM 0 HG21 ILE B 41 18.813 25.877 22.966 1.00 40.27 H new ATOM 0 HG22 ILE B 41 20.028 24.879 23.800 1.00 40.27 H new ATOM 0 HG23 ILE B 41 20.426 25.654 22.248 1.00 40.27 H new ATOM 0 HD11 ILE B 41 17.094 25.630 19.860 1.00 40.55 H new ATOM 0 HD12 ILE B 41 16.683 24.992 21.470 1.00 40.55 H new ATOM 0 HD13 ILE B 41 17.930 26.250 21.303 1.00 40.55 H new ATOM 1754 N GLU B 42 20.146 22.080 24.125 1.00 35.46 N ATOM 1755 CA GLU B 42 20.732 21.757 25.459 1.00 34.62 C ATOM 1756 C GLU B 42 22.063 21.026 25.283 1.00 31.10 C ATOM 1757 O GLU B 42 23.006 21.247 26.017 1.00 29.48 O ATOM 1758 CB GLU B 42 19.762 20.868 26.238 1.00 40.18 C ATOM 1759 CG GLU B 42 18.402 21.560 26.337 1.00 46.15 C ATOM 1760 CD GLU B 42 17.444 20.688 27.151 1.00 50.80 C ATOM 1761 OE1 GLU B 42 17.389 19.498 26.888 1.00 53.92 O ATOM 1762 OE2 GLU B 42 16.783 21.225 28.024 1.00 52.61 O ATOM 0 H GLU B 42 19.146 21.900 24.035 1.00 35.46 H new ATOM 0 HA GLU B 42 20.904 22.683 26.008 1.00 34.62 H new ATOM 0 HB2 GLU B 42 19.656 19.904 25.740 1.00 40.18 H new ATOM 0 HB3 GLU B 42 20.155 20.670 27.235 1.00 40.18 H new ATOM 0 HG2 GLU B 42 18.512 22.536 26.809 1.00 46.15 H new ATOM 0 HG3 GLU B 42 17.996 21.732 25.340 1.00 46.15 H new ATOM 1769 N GLU B 43 22.153 20.167 24.308 1.00 26.75 N ATOM 1770 CA GLU B 43 23.429 19.435 24.077 1.00 25.31 C ATOM 1771 C GLU B 43 24.340 20.299 23.205 1.00 22.10 C ATOM 1772 O GLU B 43 25.549 20.206 23.273 1.00 21.22 O ATOM 1773 CB GLU B 43 23.141 18.109 23.366 1.00 24.85 C ATOM 1774 CG GLU B 43 24.351 17.181 23.498 1.00 27.31 C ATOM 1775 CD GLU B 43 24.466 16.696 24.944 1.00 29.91 C ATOM 1776 OE1 GLU B 43 23.518 16.098 25.424 1.00 28.72 O ATOM 1777 OE2 GLU B 43 25.500 16.934 25.548 1.00 30.00 O ATOM 0 H GLU B 43 21.398 19.940 23.661 1.00 26.75 H new ATOM 0 HA GLU B 43 23.916 19.228 25.030 1.00 25.31 H new ATOM 0 HB2 GLU B 43 22.259 17.637 23.799 1.00 24.85 H new ATOM 0 HB3 GLU B 43 22.922 18.289 22.314 1.00 24.85 H new ATOM 0 HG2 GLU B 43 24.245 16.330 22.825 1.00 27.31 H new ATOM 0 HG3 GLU B 43 25.260 17.707 23.206 1.00 27.31 H new ATOM 1784 N ALA B 44 23.768 21.146 22.388 1.00 21.46 N ATOM 1785 CA ALA B 44 24.604 22.020 21.517 1.00 22.00 C ATOM 1786 C ALA B 44 25.104 23.213 22.340 1.00 21.74 C ATOM 1787 O ALA B 44 26.216 23.668 22.177 1.00 19.07 O ATOM 1788 CB ALA B 44 23.769 22.495 20.304 1.00 22.06 C ATOM 0 H ALA B 44 22.760 21.269 22.288 1.00 21.46 H new ATOM 0 HA ALA B 44 25.465 21.466 21.142 1.00 22.00 H new ATOM 0 HB1 ALA B 44 24.382 23.134 19.668 1.00 22.06 H new ATOM 0 HB2 ALA B 44 23.433 21.630 19.733 1.00 22.06 H new ATOM 0 HB3 ALA B 44 22.903 23.056 20.656 1.00 22.06 H new ATOM 1794 N SER B 45 24.289 23.712 23.223 1.00 21.72 N ATOM 1795 CA SER B 45 24.708 24.870 24.061 1.00 24.00 C ATOM 1796 C SER B 45 25.896 24.470 24.938 1.00 24.30 C ATOM 1797 O SER B 45 26.870 25.189 25.046 1.00 23.27 O ATOM 1798 CB SER B 45 23.539 25.291 24.948 1.00 25.03 C ATOM 1799 OG SER B 45 23.480 24.441 26.087 1.00 28.51 O ATOM 0 H SER B 45 23.346 23.367 23.402 1.00 21.72 H new ATOM 0 HA SER B 45 25.002 25.699 23.418 1.00 24.00 H new ATOM 0 HB2 SER B 45 23.660 26.328 25.260 1.00 25.03 H new ATOM 0 HB3 SER B 45 22.605 25.234 24.389 1.00 25.03 H new ATOM 0 HG SER B 45 22.731 24.711 26.658 1.00 28.51 H new ATOM 1805 N ARG B 46 25.823 23.332 25.571 1.00 26.45 N ATOM 1806 CA ARG B 46 26.946 22.893 26.446 1.00 27.79 C ATOM 1807 C ARG B 46 28.268 23.015 25.682 1.00 26.86 C ATOM 1808 O ARG B 46 29.288 23.362 26.244 1.00 25.99 O ATOM 1809 CB ARG B 46 26.714 21.437 26.878 1.00 31.64 C ATOM 1810 CG ARG B 46 25.751 21.403 28.075 1.00 39.02 C ATOM 1811 CD ARG B 46 25.325 19.957 28.377 1.00 43.92 C ATOM 1812 NE ARG B 46 24.094 19.637 27.603 1.00 48.12 N ATOM 1813 CZ ARG B 46 23.700 18.398 27.484 1.00 50.42 C ATOM 1814 NH1 ARG B 46 24.391 17.437 28.034 1.00 52.31 N ATOM 1815 NH2 ARG B 46 22.616 18.121 26.813 1.00 52.39 N ATOM 0 H ARG B 46 25.034 22.687 25.520 1.00 26.45 H new ATOM 0 HA ARG B 46 26.992 23.525 27.333 1.00 27.79 H new ATOM 0 HB2 ARG B 46 26.301 20.862 26.049 1.00 31.64 H new ATOM 0 HB3 ARG B 46 27.662 20.971 27.147 1.00 31.64 H new ATOM 0 HG2 ARG B 46 26.233 21.838 28.951 1.00 39.02 H new ATOM 0 HG3 ARG B 46 24.872 22.011 27.861 1.00 39.02 H new ATOM 0 HD2 ARG B 46 26.126 19.267 28.112 1.00 43.92 H new ATOM 0 HD3 ARG B 46 25.140 19.835 29.444 1.00 43.92 H new ATOM 0 HE ARG B 46 23.558 20.386 27.165 1.00 48.12 H new ATOM 0 HH11 ARG B 46 25.239 17.654 28.557 1.00 52.31 H new ATOM 0 HH12 ARG B 46 24.083 16.469 27.941 1.00 52.31 H new ATOM 0 HH21 ARG B 46 22.077 18.872 26.382 1.00 52.39 H new ATOM 0 HH22 ARG B 46 22.307 17.153 26.719 1.00 52.39 H new ATOM 1829 N ARG B 47 28.260 22.743 24.408 1.00 22.86 N ATOM 1830 CA ARG B 47 29.521 22.859 23.620 1.00 20.88 C ATOM 1831 C ARG B 47 29.896 24.331 23.512 1.00 18.23 C ATOM 1832 O ARG B 47 30.939 24.752 23.971 1.00 21.17 O ATOM 1833 CB ARG B 47 29.310 22.274 22.225 1.00 19.97 C ATOM 1834 CG ARG B 47 28.679 20.885 22.349 1.00 21.43 C ATOM 1835 CD ARG B 47 28.437 20.290 20.957 1.00 22.98 C ATOM 1836 NE ARG B 47 28.387 18.805 21.067 1.00 20.54 N ATOM 1837 CZ ARG B 47 27.961 18.095 20.064 1.00 24.59 C ATOM 1838 NH1 ARG B 47 27.629 18.682 18.951 1.00 24.12 N ATOM 1839 NH2 ARG B 47 27.874 16.798 20.170 1.00 16.51 N ATOM 0 H ARG B 47 27.440 22.447 23.879 1.00 22.86 H new ATOM 0 HA ARG B 47 30.322 22.310 24.115 1.00 20.88 H new ATOM 0 HB2 ARG B 47 28.665 22.928 21.638 1.00 19.97 H new ATOM 0 HB3 ARG B 47 30.262 22.208 21.698 1.00 19.97 H new ATOM 0 HG2 ARG B 47 29.333 20.230 22.924 1.00 21.43 H new ATOM 0 HG3 ARG B 47 27.737 20.952 22.893 1.00 21.43 H new ATOM 0 HD2 ARG B 47 27.503 20.669 20.543 1.00 22.98 H new ATOM 0 HD3 ARG B 47 29.233 20.591 20.275 1.00 22.98 H new ATOM 0 HE ARG B 47 28.686 18.346 21.927 1.00 20.54 H new ATOM 0 HH11 ARG B 47 27.703 19.696 18.867 1.00 24.12 H new ATOM 0 HH12 ARG B 47 27.295 18.128 18.162 1.00 24.12 H new ATOM 0 HH21 ARG B 47 28.140 16.338 21.041 1.00 16.51 H new ATOM 0 HH22 ARG B 47 27.540 16.243 19.382 1.00 16.51 H new ATOM 1853 N ILE B 48 29.038 25.124 22.932 1.00 16.11 N ATOM 1854 CA ILE B 48 29.319 26.586 22.820 1.00 18.86 C ATOM 1855 C ILE B 48 29.777 27.080 24.182 1.00 23.26 C ATOM 1856 O ILE B 48 30.847 27.631 24.338 1.00 21.90 O ATOM 1857 CB ILE B 48 28.040 27.307 22.413 1.00 18.65 C ATOM 1858 CG1 ILE B 48 27.495 26.636 21.155 1.00 19.26 C ATOM 1859 CG2 ILE B 48 28.355 28.777 22.134 1.00 21.02 C ATOM 1860 CD1 ILE B 48 26.283 27.407 20.618 1.00 15.25 C ATOM 0 H ILE B 48 28.151 24.823 22.529 1.00 16.11 H new ATOM 0 HA ILE B 48 30.089 26.778 22.073 1.00 18.86 H new ATOM 0 HB ILE B 48 27.298 27.255 23.210 1.00 18.65 H new ATOM 0 HG12 ILE B 48 28.273 26.593 20.393 1.00 19.26 H new ATOM 0 HG13 ILE B 48 27.210 25.608 21.378 1.00 19.26 H new ATOM 0 HG21 ILE B 48 27.442 29.296 21.842 1.00 21.02 H new ATOM 0 HG22 ILE B 48 28.763 29.239 23.033 1.00 21.02 H new ATOM 0 HG23 ILE B 48 29.085 28.846 21.327 1.00 21.02 H new ATOM 0 HD11 ILE B 48 25.907 26.915 19.721 1.00 15.25 H new ATOM 0 HD12 ILE B 48 25.500 27.428 21.376 1.00 15.25 H new ATOM 0 HD13 ILE B 48 26.579 28.427 20.375 1.00 15.25 H new ATOM 1872 N GLU B 49 28.972 26.847 25.172 1.00 24.41 N ATOM 1873 CA GLU B 49 29.328 27.260 26.556 1.00 29.72 C ATOM 1874 C GLU B 49 30.771 26.885 26.848 1.00 31.01 C ATOM 1875 O GLU B 49 31.613 27.728 27.088 1.00 30.32 O ATOM 1876 CB GLU B 49 28.465 26.468 27.520 1.00 30.86 C ATOM 1877 CG GLU B 49 27.058 27.065 27.600 1.00 35.37 C ATOM 1878 CD GLU B 49 26.321 26.467 28.800 1.00 37.77 C ATOM 1879 OE1 GLU B 49 26.748 26.714 29.916 1.00 38.78 O ATOM 1880 OE2 GLU B 49 25.343 25.771 28.583 1.00 38.92 O ATOM 0 H GLU B 49 28.069 26.381 25.083 1.00 24.41 H new ATOM 0 HA GLU B 49 29.183 28.335 26.662 1.00 29.72 H new ATOM 0 HB2 GLU B 49 28.407 25.429 27.195 1.00 30.86 H new ATOM 0 HB3 GLU B 49 28.922 26.467 28.509 1.00 30.86 H new ATOM 0 HG2 GLU B 49 27.116 28.149 27.698 1.00 35.37 H new ATOM 0 HG3 GLU B 49 26.510 26.857 26.681 1.00 35.37 H new ATOM 1887 N GLU B 50 31.061 25.608 26.816 1.00 31.22 N ATOM 1888 CA GLU B 50 32.449 25.161 27.076 1.00 30.52 C ATOM 1889 C GLU B 50 33.331 25.993 26.174 1.00 30.97 C ATOM 1890 O GLU B 50 34.325 26.520 26.579 1.00 30.11 O ATOM 1891 CB GLU B 50 32.573 23.659 26.742 1.00 33.65 C ATOM 1892 CG GLU B 50 33.652 23.003 27.614 1.00 34.45 C ATOM 1893 CD GLU B 50 33.659 21.493 27.365 1.00 36.26 C ATOM 1894 OE1 GLU B 50 34.094 21.091 26.298 1.00 35.94 O ATOM 1895 OE2 GLU B 50 33.230 20.765 28.244 1.00 36.07 O ATOM 0 H GLU B 50 30.393 24.863 26.621 1.00 31.22 H new ATOM 0 HA GLU B 50 32.737 25.288 28.119 1.00 30.52 H new ATOM 0 HB2 GLU B 50 31.615 23.164 26.904 1.00 33.65 H new ATOM 0 HB3 GLU B 50 32.823 23.534 25.688 1.00 33.65 H new ATOM 0 HG2 GLU B 50 34.629 23.425 27.381 1.00 34.45 H new ATOM 0 HG3 GLU B 50 33.458 23.208 28.667 1.00 34.45 H new ATOM 1902 N GLY B 51 32.907 26.150 24.964 1.00 0.00 N ATOM 1903 CA GLY B 51 33.658 26.980 23.993 1.00 0.00 C ATOM 1904 C GLY B 51 33.875 28.392 24.557 1.00 0.00 C ATOM 1905 O GLY B 51 34.981 28.839 24.769 1.00 0.00 O ATOM 0 H GLY B 51 32.053 25.730 24.596 1.00 0.00 H new ATOM 0 HA2 GLY B 51 34.620 26.516 23.775 1.00 0.00 H new ATOM 0 HA3 GLY B 51 33.111 27.037 23.052 1.00 0.00 H new ATOM 1909 N GLN B 52 32.804 29.107 24.788 1.00 30.19 N ATOM 1910 CA GLN B 52 32.922 30.500 25.324 1.00 33.26 C ATOM 1911 C GLN B 52 33.910 30.493 26.475 1.00 34.21 C ATOM 1912 O GLN B 52 34.838 31.274 26.533 1.00 33.27 O ATOM 1913 CB GLN B 52 31.564 30.976 25.850 1.00 34.36 C ATOM 1914 CG GLN B 52 30.468 30.770 24.785 1.00 37.06 C ATOM 1915 CD GLN B 52 30.314 32.023 23.919 1.00 39.18 C ATOM 1916 OE1 GLN B 52 31.274 32.717 23.651 1.00 39.82 O ATOM 1917 NE2 GLN B 52 29.130 32.338 23.472 1.00 40.80 N ATOM 0 H GLN B 52 31.849 28.786 24.628 1.00 30.19 H new ATOM 0 HA GLN B 52 33.257 31.167 24.529 1.00 33.26 H new ATOM 0 HB2 GLN B 52 31.306 30.428 26.756 1.00 34.36 H new ATOM 0 HB3 GLN B 52 31.622 32.030 26.121 1.00 34.36 H new ATOM 0 HG2 GLN B 52 30.720 29.916 24.156 1.00 37.06 H new ATOM 0 HG3 GLN B 52 29.520 30.539 25.271 1.00 37.06 H new ATOM 0 HE21 GLN B 52 28.327 31.752 23.700 1.00 40.80 H new ATOM 0 HE22 GLN B 52 29.007 33.170 22.895 1.00 40.80 H new ATOM 1926 N TYR B 53 33.713 29.589 27.377 1.00 35.76 N ATOM 1927 CA TYR B 53 34.629 29.476 28.531 1.00 38.60 C ATOM 1928 C TYR B 53 35.987 29.011 28.010 1.00 39.68 C ATOM 1929 O TYR B 53 37.017 29.568 28.310 1.00 39.52 O ATOM 1930 CB TYR B 53 34.063 28.437 29.511 1.00 40.83 C ATOM 1931 CG TYR B 53 35.157 27.929 30.421 1.00 43.21 C ATOM 1932 CD1 TYR B 53 36.015 26.918 29.984 1.00 44.13 C ATOM 1933 CD2 TYR B 53 35.311 28.475 31.690 1.00 43.89 C ATOM 1934 CE1 TYR B 53 37.028 26.452 30.818 1.00 47.20 C ATOM 1935 CE2 TYR B 53 36.326 28.011 32.535 1.00 46.12 C ATOM 1936 CZ TYR B 53 37.188 26.997 32.098 1.00 46.20 C ATOM 1937 OH TYR B 53 38.190 26.535 32.927 1.00 48.95 O ATOM 0 H TYR B 53 32.948 28.915 27.365 1.00 35.76 H new ATOM 0 HA TYR B 53 34.734 30.432 29.043 1.00 38.60 H new ATOM 0 HB2 TYR B 53 33.264 28.883 30.104 1.00 40.83 H new ATOM 0 HB3 TYR B 53 33.624 27.606 28.958 1.00 40.83 H new ATOM 0 HD1 TYR B 53 35.893 26.497 28.997 1.00 44.13 H new ATOM 0 HD2 TYR B 53 34.647 29.258 32.024 1.00 43.89 H new ATOM 0 HE1 TYR B 53 37.691 25.670 30.478 1.00 47.20 H new ATOM 0 HE2 TYR B 53 36.444 28.434 33.522 1.00 46.12 H new ATOM 0 HH TYR B 53 38.898 26.125 32.387 1.00 48.95 H new ATOM 1947 N VAL B 54 35.974 27.985 27.227 1.00 39.35 N ATOM 1948 CA VAL B 54 37.231 27.433 26.668 1.00 40.00 C ATOM 1949 C VAL B 54 38.063 28.574 26.071 1.00 40.47 C ATOM 1950 O VAL B 54 39.208 28.776 26.423 1.00 39.23 O ATOM 1951 CB VAL B 54 36.815 26.439 25.584 1.00 40.33 C ATOM 1952 CG1 VAL B 54 37.910 26.231 24.566 1.00 40.58 C ATOM 1953 CG2 VAL B 54 36.385 25.075 26.187 1.00 39.92 C ATOM 0 H VAL B 54 35.128 27.491 26.942 1.00 39.35 H new ATOM 0 HA VAL B 54 37.839 26.942 27.428 1.00 40.00 H new ATOM 0 HB VAL B 54 35.954 26.877 25.078 1.00 40.33 H new ATOM 0 HG11 VAL B 54 37.576 25.518 23.812 1.00 40.58 H new ATOM 0 HG12 VAL B 54 38.147 27.181 24.087 1.00 40.58 H new ATOM 0 HG13 VAL B 54 38.800 25.844 25.063 1.00 40.58 H new ATOM 0 HG21 VAL B 54 36.097 24.397 25.384 1.00 39.92 H new ATOM 0 HG22 VAL B 54 37.217 24.645 26.744 1.00 39.92 H new ATOM 0 HG23 VAL B 54 35.538 25.224 26.857 1.00 39.92 H new ATOM 1963 N VAL B 55 37.490 29.312 25.164 1.00 40.13 N ATOM 1964 CA VAL B 55 38.235 30.433 24.529 1.00 42.29 C ATOM 1965 C VAL B 55 38.551 31.503 25.582 1.00 43.82 C ATOM 1966 O VAL B 55 39.698 31.833 25.810 1.00 43.78 O ATOM 1967 CB VAL B 55 37.377 31.037 23.407 1.00 41.62 C ATOM 1968 CG1 VAL B 55 38.170 32.113 22.645 1.00 42.45 C ATOM 1969 CG2 VAL B 55 36.969 29.923 22.434 1.00 41.12 C ATOM 0 H VAL B 55 36.533 29.187 24.833 1.00 40.13 H new ATOM 0 HA VAL B 55 39.170 30.063 24.109 1.00 42.29 H new ATOM 0 HB VAL B 55 36.491 31.497 23.844 1.00 41.62 H new ATOM 0 HG11 VAL B 55 37.548 32.531 21.853 1.00 42.45 H new ATOM 0 HG12 VAL B 55 38.462 32.906 23.334 1.00 42.45 H new ATOM 0 HG13 VAL B 55 39.062 31.666 22.207 1.00 42.45 H new ATOM 0 HG21 VAL B 55 36.359 30.344 21.634 1.00 41.12 H new ATOM 0 HG22 VAL B 55 37.863 29.467 22.008 1.00 41.12 H new ATOM 0 HG23 VAL B 55 36.395 29.166 22.968 1.00 41.12 H new ATOM 1979 N ASN B 56 37.553 32.060 26.221 1.00 44.48 N ATOM 1980 CA ASN B 56 37.839 33.112 27.237 1.00 47.06 C ATOM 1981 C ASN B 56 38.849 32.571 28.251 1.00 47.69 C ATOM 1982 O ASN B 56 39.622 33.309 28.828 1.00 47.82 O ATOM 1983 CB ASN B 56 36.532 33.572 27.916 1.00 46.90 C ATOM 1984 CG ASN B 56 36.091 32.631 29.048 1.00 47.81 C ATOM 1985 OD1 ASN B 56 36.717 31.636 29.326 1.00 48.43 O ATOM 1986 ND2 ASN B 56 35.012 32.921 29.722 1.00 47.03 N ATOM 0 H ASN B 56 36.568 31.835 26.085 1.00 44.48 H new ATOM 0 HA ASN B 56 38.274 33.987 26.753 1.00 47.06 H new ATOM 0 HB2 ASN B 56 36.669 34.577 28.316 1.00 46.90 H new ATOM 0 HB3 ASN B 56 35.740 33.632 27.169 1.00 46.90 H new ATOM 0 HD21 ASN B 56 34.703 32.309 30.477 1.00 47.03 H new ATOM 0 HD22 ASN B 56 34.478 33.759 29.493 1.00 47.03 H new ATOM 1993 N GLU B 57 38.868 31.281 28.448 1.00 49.57 N ATOM 1994 CA GLU B 57 39.850 30.685 29.397 1.00 51.35 C ATOM 1995 C GLU B 57 41.231 30.773 28.754 1.00 52.18 C ATOM 1996 O GLU B 57 42.156 31.329 29.311 1.00 52.13 O ATOM 1997 CB GLU B 57 39.497 29.217 29.660 1.00 52.66 C ATOM 1998 CG GLU B 57 40.417 28.632 30.740 1.00 53.83 C ATOM 1999 CD GLU B 57 40.409 27.103 30.655 1.00 55.85 C ATOM 2000 OE1 GLU B 57 40.432 26.591 29.548 1.00 56.34 O ATOM 2001 OE2 GLU B 57 40.380 26.472 31.699 1.00 57.10 O ATOM 0 H GLU B 57 38.245 30.614 27.992 1.00 49.57 H new ATOM 0 HA GLU B 57 39.833 31.220 30.346 1.00 51.35 H new ATOM 0 HB2 GLU B 57 38.457 29.137 29.977 1.00 52.66 H new ATOM 0 HB3 GLU B 57 39.595 28.642 28.739 1.00 52.66 H new ATOM 0 HG2 GLU B 57 41.432 29.007 30.609 1.00 53.83 H new ATOM 0 HG3 GLU B 57 40.084 28.952 31.727 1.00 53.83 H new