USER MOD reduce.3.24.130724 H: found=0, std=0, add=673, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 671 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 51 HIS : no HE2:sc= -0.0343 K(o=1.1,f=0.045) USER MOD Set 1.2: A 83 SER OG : rot 42:sc= 1.1 USER MOD Set 2.1: A 50 CYS SG : rot 179:sc= -1.2! USER MOD Set 2.2: A 87 CYS SG : rot 180:sc= -1.28! USER MOD Set 3.1: A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 7 THR OG1 : rot 180:sc= 0.973 USER MOD Set 3.3: A 17 THR OG1 : rot 95:sc= 1.14 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 SER OG : rot 180:sc= 0.0293 USER MOD Single : A 15 GLN : amide:sc= -0.0696 K(o=-0.07,f=-2.9!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 CYS SG : rot -83:sc= -0.321 USER MOD Single : A 25 THR OG1 : rot 120:sc= 1.3 USER MOD Single : A 31 GLN : amide:sc= -0.255 K(o=-0.26,f=-2.8!) USER MOD Single : A 33 HIS : no HD1:sc= -0.923 K(o=-0.92,f=-1.8) USER MOD Single : A 34 ASN : amide:sc= -0.285 X(o=-0.28,f=-0.0014) USER MOD Single : A 37 MET CE :methyl -163:sc= 0 (180deg=-0.0819) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 54:sc= 0.22 USER MOD Single : A 70 ASN : amide:sc= -0.294 K(o=-0.29,f=-4.8!) USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 THR OG1 : rot -160:sc= 0 USER MOD Single : A 82 THR OG1 : rot 134:sc= 0.972 USER MOD Single : A 88 GLN : amide:sc= -0.235 K(o=-0.23,f=-1.4) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 MET CE :methyl -164:sc= -2.09 (180deg=-2.49) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 25 N GLU A 3 42.355 19.996 19.544 1.00 0.00 N ATOM 26 CA GLU A 3 42.309 18.517 19.693 1.00 0.00 C ATOM 27 C GLU A 3 41.048 17.994 20.413 1.00 0.00 C ATOM 28 O GLU A 3 40.894 16.783 20.602 1.00 0.00 O ATOM 29 CB GLU A 3 43.596 18.012 20.374 1.00 0.00 C ATOM 30 CG GLU A 3 44.813 18.136 19.447 1.00 0.00 C ATOM 31 CD GLU A 3 46.124 17.843 20.181 1.00 0.00 C ATOM 32 OE1 GLU A 3 46.513 16.660 20.305 1.00 0.00 O ATOM 33 OE2 GLU A 3 46.788 18.818 20.620 1.00 0.00 O ATOM 0 HA GLU A 3 42.248 18.108 18.685 1.00 0.00 H new ATOM 0 HB2 GLU A 3 43.773 18.582 21.286 1.00 0.00 H new ATOM 0 HB3 GLU A 3 43.467 16.971 20.669 1.00 0.00 H new ATOM 0 HG2 GLU A 3 44.704 17.446 18.610 1.00 0.00 H new ATOM 0 HG3 GLU A 3 44.849 19.142 19.028 1.00 0.00 H new ATOM 40 N LEU A 4 40.134 18.895 20.787 1.00 0.00 N ATOM 41 CA LEU A 4 38.814 18.630 21.373 1.00 0.00 C ATOM 42 C LEU A 4 37.761 19.562 20.718 1.00 0.00 C ATOM 43 O LEU A 4 38.093 20.323 19.805 1.00 0.00 O ATOM 44 CB LEU A 4 38.895 18.851 22.900 1.00 0.00 C ATOM 45 CG LEU A 4 39.988 18.085 23.681 1.00 0.00 C ATOM 46 CD1 LEU A 4 40.061 18.591 25.121 1.00 0.00 C ATOM 47 CD2 LEU A 4 39.714 16.583 23.763 1.00 0.00 C ATOM 0 H LEU A 4 40.307 19.895 20.682 1.00 0.00 H new ATOM 0 HA LEU A 4 38.510 17.600 21.187 1.00 0.00 H new ATOM 0 HB2 LEU A 4 39.041 19.917 23.077 1.00 0.00 H new ATOM 0 HB3 LEU A 4 37.929 18.586 23.329 1.00 0.00 H new ATOM 0 HG LEU A 4 40.917 18.258 23.137 1.00 0.00 H new ATOM 0 HD11 LEU A 4 40.834 18.044 25.660 1.00 0.00 H new ATOM 0 HD12 LEU A 4 40.302 19.654 25.121 1.00 0.00 H new ATOM 0 HD13 LEU A 4 39.099 18.437 25.610 1.00 0.00 H new ATOM 0 HD21 LEU A 4 40.514 16.097 24.322 1.00 0.00 H new ATOM 0 HD22 LEU A 4 38.763 16.414 24.268 1.00 0.00 H new ATOM 0 HD23 LEU A 4 39.670 16.166 22.757 1.00 0.00 H new ATOM 59 N LYS A 5 36.494 19.533 21.163 1.00 0.00 N ATOM 60 CA LYS A 5 35.420 20.447 20.708 1.00 0.00 C ATOM 61 C LYS A 5 34.600 21.059 21.850 1.00 0.00 C ATOM 62 O LYS A 5 34.725 20.654 23.000 1.00 0.00 O ATOM 63 CB LYS A 5 34.438 19.753 19.751 1.00 0.00 C ATOM 64 CG LYS A 5 35.044 19.092 18.512 1.00 0.00 C ATOM 65 CD LYS A 5 34.161 19.258 17.262 1.00 0.00 C ATOM 66 CE LYS A 5 32.665 18.979 17.491 1.00 0.00 C ATOM 67 NZ LYS A 5 31.923 18.953 16.211 1.00 0.00 N ATOM 0 H LYS A 5 36.176 18.862 21.863 1.00 0.00 H new ATOM 0 HA LYS A 5 35.956 21.246 20.196 1.00 0.00 H new ATOM 0 HB2 LYS A 5 33.895 18.993 20.312 1.00 0.00 H new ATOM 0 HB3 LYS A 5 33.705 20.490 19.421 1.00 0.00 H new ATOM 0 HG2 LYS A 5 36.026 19.523 18.318 1.00 0.00 H new ATOM 0 HG3 LYS A 5 35.195 18.030 18.708 1.00 0.00 H new ATOM 0 HD2 LYS A 5 34.274 20.275 16.886 1.00 0.00 H new ATOM 0 HD3 LYS A 5 34.527 18.588 16.484 1.00 0.00 H new ATOM 0 HE2 LYS A 5 32.545 18.025 18.003 1.00 0.00 H new ATOM 0 HE3 LYS A 5 32.245 19.746 18.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 30.917 18.763 16.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 32.019 19.873 15.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 32.310 18.205 15.601 1.00 0.00 H new ATOM 81 N ILE A 6 33.747 22.022 21.507 1.00 0.00 N ATOM 82 CA ILE A 6 32.645 22.546 22.321 1.00 0.00 C ATOM 83 C ILE A 6 31.505 23.001 21.408 1.00 0.00 C ATOM 84 O ILE A 6 31.711 23.799 20.495 1.00 0.00 O ATOM 85 CB ILE A 6 33.134 23.683 23.252 1.00 0.00 C ATOM 86 CG1 ILE A 6 32.015 24.385 24.070 1.00 0.00 C ATOM 87 CG2 ILE A 6 33.979 24.716 22.496 1.00 0.00 C ATOM 88 CD1 ILE A 6 32.527 25.160 25.297 1.00 0.00 C ATOM 0 H ILE A 6 33.808 22.487 20.601 1.00 0.00 H new ATOM 0 HA ILE A 6 32.267 21.754 22.968 1.00 0.00 H new ATOM 0 HB ILE A 6 33.761 23.177 23.986 1.00 0.00 H new ATOM 0 HG12 ILE A 6 31.479 25.073 23.416 1.00 0.00 H new ATOM 0 HG13 ILE A 6 31.297 23.635 24.401 1.00 0.00 H new ATOM 0 HG21 ILE A 6 34.302 25.496 23.185 1.00 0.00 H new ATOM 0 HG22 ILE A 6 34.853 24.227 22.066 1.00 0.00 H new ATOM 0 HG23 ILE A 6 33.383 25.160 21.699 1.00 0.00 H new ATOM 0 HD11 ILE A 6 31.685 25.621 25.814 1.00 0.00 H new ATOM 0 HD12 ILE A 6 33.037 24.474 25.974 1.00 0.00 H new ATOM 0 HD13 ILE A 6 33.222 25.935 24.974 1.00 0.00 H new ATOM 100 N THR A 7 30.292 22.532 21.688 1.00 0.00 N ATOM 101 CA THR A 7 29.056 23.090 21.132 1.00 0.00 C ATOM 102 C THR A 7 28.365 23.960 22.162 1.00 0.00 C ATOM 103 O THR A 7 28.158 23.541 23.300 1.00 0.00 O ATOM 104 CB THR A 7 28.118 21.997 20.589 1.00 0.00 C ATOM 105 OG1 THR A 7 28.734 21.335 19.510 1.00 0.00 O ATOM 106 CG2 THR A 7 26.817 22.589 20.037 1.00 0.00 C ATOM 0 H THR A 7 30.135 21.743 22.315 1.00 0.00 H new ATOM 0 HA THR A 7 29.324 23.714 20.279 1.00 0.00 H new ATOM 0 HB THR A 7 27.906 21.325 21.420 1.00 0.00 H new ATOM 0 HG1 THR A 7 28.135 20.639 19.168 1.00 0.00 H new ATOM 0 HG21 THR A 7 26.182 21.786 19.663 1.00 0.00 H new ATOM 0 HG22 THR A 7 26.296 23.125 20.830 1.00 0.00 H new ATOM 0 HG23 THR A 7 27.047 23.278 19.224 1.00 0.00 H new ATOM 114 N PHE A 8 27.976 25.162 21.749 1.00 0.00 N ATOM 115 CA PHE A 8 27.171 26.083 22.536 1.00 0.00 C ATOM 116 C PHE A 8 25.837 26.387 21.838 1.00 0.00 C ATOM 117 O PHE A 8 25.812 26.690 20.642 1.00 0.00 O ATOM 118 CB PHE A 8 27.940 27.381 22.824 1.00 0.00 C ATOM 119 CG PHE A 8 29.451 27.343 23.017 1.00 0.00 C ATOM 120 CD1 PHE A 8 30.278 27.121 21.896 1.00 0.00 C ATOM 121 CD2 PHE A 8 30.054 27.705 24.250 1.00 0.00 C ATOM 122 CE1 PHE A 8 31.663 27.251 21.995 1.00 0.00 C ATOM 123 CE2 PHE A 8 31.438 27.917 24.320 1.00 0.00 C ATOM 124 CZ PHE A 8 32.236 27.686 23.192 1.00 0.00 C ATOM 0 H PHE A 8 28.221 25.531 20.830 1.00 0.00 H new ATOM 0 HA PHE A 8 26.952 25.600 23.488 1.00 0.00 H new ATOM 0 HB2 PHE A 8 27.735 28.068 22.003 1.00 0.00 H new ATOM 0 HB3 PHE A 8 27.509 27.821 23.723 1.00 0.00 H new ATOM 0 HD1 PHE A 8 29.834 26.847 20.950 1.00 0.00 H new ATOM 0 HD2 PHE A 8 29.446 27.817 25.135 1.00 0.00 H new ATOM 0 HE1 PHE A 8 32.291 27.016 21.148 1.00 0.00 H new ATOM 0 HE2 PHE A 8 31.888 28.257 25.241 1.00 0.00 H new ATOM 0 HZ PHE A 8 33.303 27.846 23.249 1.00 0.00 H new ATOM 134 N ILE A 9 24.748 26.365 22.611 1.00 0.00 N ATOM 135 CA ILE A 9 23.453 26.968 22.231 1.00 0.00 C ATOM 136 C ILE A 9 23.472 28.455 22.592 1.00 0.00 C ATOM 137 O ILE A 9 23.983 28.808 23.652 1.00 0.00 O ATOM 138 CB ILE A 9 22.263 26.277 22.930 1.00 0.00 C ATOM 139 CG1 ILE A 9 22.372 24.738 22.803 1.00 0.00 C ATOM 140 CG2 ILE A 9 20.929 26.882 22.432 1.00 0.00 C ATOM 141 CD1 ILE A 9 21.088 23.931 23.041 1.00 0.00 C ATOM 0 H ILE A 9 24.733 25.924 23.531 1.00 0.00 H new ATOM 0 HA ILE A 9 23.320 26.836 21.157 1.00 0.00 H new ATOM 0 HB ILE A 9 22.289 26.471 24.002 1.00 0.00 H new ATOM 0 HG12 ILE A 9 22.739 24.505 21.804 1.00 0.00 H new ATOM 0 HG13 ILE A 9 23.127 24.392 23.509 1.00 0.00 H new ATOM 0 HG21 ILE A 9 20.096 26.387 22.932 1.00 0.00 H new ATOM 0 HG22 ILE A 9 20.906 27.948 22.658 1.00 0.00 H new ATOM 0 HG23 ILE A 9 20.844 26.738 21.355 1.00 0.00 H new ATOM 0 HD11 ILE A 9 21.299 22.868 22.922 1.00 0.00 H new ATOM 0 HD12 ILE A 9 20.723 24.118 24.051 1.00 0.00 H new ATOM 0 HD13 ILE A 9 20.329 24.233 22.319 1.00 0.00 H new ATOM 153 N LEU A 10 22.932 29.323 21.735 1.00 0.00 N ATOM 154 CA LEU A 10 23.065 30.779 21.850 1.00 0.00 C ATOM 155 C LEU A 10 21.819 31.499 22.407 1.00 0.00 C ATOM 156 O LEU A 10 20.709 30.964 22.410 1.00 0.00 O ATOM 157 CB LEU A 10 23.440 31.346 20.469 1.00 0.00 C ATOM 158 CG LEU A 10 24.716 30.814 19.778 1.00 0.00 C ATOM 159 CD1 LEU A 10 25.230 31.932 18.869 1.00 0.00 C ATOM 160 CD2 LEU A 10 25.869 30.441 20.712 1.00 0.00 C ATOM 0 H LEU A 10 22.381 29.031 20.928 1.00 0.00 H new ATOM 0 HA LEU A 10 23.848 30.968 22.585 1.00 0.00 H new ATOM 0 HB2 LEU A 10 22.600 31.168 19.798 1.00 0.00 H new ATOM 0 HB3 LEU A 10 23.543 32.426 20.571 1.00 0.00 H new ATOM 0 HG LEU A 10 24.425 29.897 19.267 1.00 0.00 H new ATOM 0 HD11 LEU A 10 26.134 31.599 18.359 1.00 0.00 H new ATOM 0 HD12 LEU A 10 24.467 32.181 18.131 1.00 0.00 H new ATOM 0 HD13 LEU A 10 25.456 32.814 19.469 1.00 0.00 H new ATOM 0 HD21 LEU A 10 26.712 30.080 20.123 1.00 0.00 H new ATOM 0 HD22 LEU A 10 26.174 31.318 21.282 1.00 0.00 H new ATOM 0 HD23 LEU A 10 25.544 29.658 21.397 1.00 0.00 H new ATOM 172 N LYS A 11 21.986 32.786 22.761 1.00 0.00 N ATOM 173 CA LYS A 11 20.909 33.729 23.139 1.00 0.00 C ATOM 174 C LYS A 11 19.884 34.018 22.025 1.00 0.00 C ATOM 175 O LYS A 11 18.790 34.483 22.327 1.00 0.00 O ATOM 176 CB LYS A 11 21.519 35.040 23.690 1.00 0.00 C ATOM 177 CG LYS A 11 22.504 35.701 22.718 1.00 0.00 C ATOM 178 CD LYS A 11 22.921 37.141 23.062 1.00 0.00 C ATOM 179 CE LYS A 11 21.772 38.151 22.963 1.00 0.00 C ATOM 180 NZ LYS A 11 22.285 39.540 22.901 1.00 0.00 N ATOM 0 H LYS A 11 22.909 33.218 22.794 1.00 0.00 H new ATOM 0 HA LYS A 11 20.336 33.229 23.920 1.00 0.00 H new ATOM 0 HB2 LYS A 11 20.715 35.741 23.916 1.00 0.00 H new ATOM 0 HB3 LYS A 11 22.031 34.829 24.629 1.00 0.00 H new ATOM 0 HG2 LYS A 11 23.402 35.086 22.666 1.00 0.00 H new ATOM 0 HG3 LYS A 11 22.059 35.700 21.723 1.00 0.00 H new ATOM 0 HD2 LYS A 11 23.326 37.162 24.074 1.00 0.00 H new ATOM 0 HD3 LYS A 11 23.723 37.449 22.391 1.00 0.00 H new ATOM 0 HE2 LYS A 11 21.175 37.941 22.076 1.00 0.00 H new ATOM 0 HE3 LYS A 11 21.113 38.042 23.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 21.486 40.202 22.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 22.835 39.746 23.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 22.895 39.648 22.065 1.00 0.00 H new ATOM 194 N ASP A 12 20.211 33.732 20.759 1.00 0.00 N ATOM 195 CA ASP A 12 19.269 33.743 19.619 1.00 0.00 C ATOM 196 C ASP A 12 18.712 32.338 19.283 1.00 0.00 C ATOM 197 O ASP A 12 17.886 32.192 18.381 1.00 0.00 O ATOM 198 CB ASP A 12 19.973 34.385 18.405 1.00 0.00 C ATOM 199 CG ASP A 12 19.032 34.671 17.225 1.00 0.00 C ATOM 200 OD1 ASP A 12 18.148 35.555 17.362 1.00 0.00 O ATOM 201 OD2 ASP A 12 19.177 34.049 16.145 1.00 0.00 O ATOM 0 H ASP A 12 21.161 33.479 20.486 1.00 0.00 H new ATOM 0 HA ASP A 12 18.397 34.336 19.896 1.00 0.00 H new ATOM 0 HB2 ASP A 12 20.441 35.318 18.719 1.00 0.00 H new ATOM 0 HB3 ASP A 12 20.772 33.725 18.069 1.00 0.00 H new ATOM 206 N GLY A 13 19.165 31.294 19.987 1.00 0.00 N ATOM 207 CA GLY A 13 18.883 29.880 19.705 1.00 0.00 C ATOM 208 C GLY A 13 19.724 29.271 18.574 1.00 0.00 C ATOM 209 O GLY A 13 19.455 28.145 18.150 1.00 0.00 O ATOM 0 H GLY A 13 19.764 31.416 20.804 1.00 0.00 H new ATOM 0 HA2 GLY A 13 19.049 29.302 20.614 1.00 0.00 H new ATOM 0 HA3 GLY A 13 17.828 29.778 19.450 1.00 0.00 H new ATOM 213 N SER A 14 20.752 29.978 18.087 1.00 0.00 N ATOM 214 CA SER A 14 21.782 29.429 17.184 1.00 0.00 C ATOM 215 C SER A 14 22.588 28.333 17.886 1.00 0.00 C ATOM 216 O SER A 14 22.649 28.275 19.114 1.00 0.00 O ATOM 217 CB SER A 14 22.740 30.515 16.624 1.00 0.00 C ATOM 218 OG SER A 14 22.121 31.795 16.711 1.00 0.00 O ATOM 0 H SER A 14 20.897 30.963 18.310 1.00 0.00 H new ATOM 0 HA SER A 14 21.249 29.003 16.334 1.00 0.00 H new ATOM 0 HB2 SER A 14 23.674 30.514 17.186 1.00 0.00 H new ATOM 0 HB3 SER A 14 22.991 30.292 15.587 1.00 0.00 H new ATOM 0 HG SER A 14 22.730 32.477 16.358 1.00 0.00 H new ATOM 224 N GLN A 15 23.242 27.485 17.103 1.00 0.00 N ATOM 225 CA GLN A 15 24.242 26.521 17.539 1.00 0.00 C ATOM 226 C GLN A 15 25.557 26.886 16.894 1.00 0.00 C ATOM 227 O GLN A 15 25.640 27.176 15.694 1.00 0.00 O ATOM 228 CB GLN A 15 23.889 25.100 17.086 1.00 0.00 C ATOM 229 CG GLN A 15 22.862 24.303 17.905 1.00 0.00 C ATOM 230 CD GLN A 15 21.666 25.081 18.437 1.00 0.00 C ATOM 231 OE1 GLN A 15 21.388 25.087 19.628 1.00 0.00 O ATOM 232 NE2 GLN A 15 20.894 25.726 17.597 1.00 0.00 N ATOM 0 H GLN A 15 23.081 27.450 16.096 1.00 0.00 H new ATOM 0 HA GLN A 15 24.291 26.546 18.628 1.00 0.00 H new ATOM 0 HB2 GLN A 15 23.521 25.160 16.062 1.00 0.00 H new ATOM 0 HB3 GLN A 15 24.812 24.522 17.059 1.00 0.00 H new ATOM 0 HG2 GLN A 15 22.490 23.487 17.285 1.00 0.00 H new ATOM 0 HG3 GLN A 15 23.378 23.850 18.751 1.00 0.00 H new ATOM 0 HE21 GLN A 15 21.114 25.729 16.601 1.00 0.00 H new ATOM 0 HE22 GLN A 15 20.073 26.225 17.939 1.00 0.00 H new ATOM 241 N LYS A 16 26.604 26.790 17.699 1.00 0.00 N ATOM 242 CA LYS A 16 27.970 27.015 17.279 1.00 0.00 C ATOM 243 C LYS A 16 28.806 25.905 17.874 1.00 0.00 C ATOM 244 O LYS A 16 28.789 25.685 19.080 1.00 0.00 O ATOM 245 CB LYS A 16 28.408 28.375 17.788 1.00 0.00 C ATOM 246 CG LYS A 16 27.658 29.551 17.143 1.00 0.00 C ATOM 247 CD LYS A 16 28.125 29.955 15.738 1.00 0.00 C ATOM 248 CE LYS A 16 28.075 31.484 15.589 1.00 0.00 C ATOM 249 NZ LYS A 16 28.361 31.930 14.205 1.00 0.00 N ATOM 0 H LYS A 16 26.520 26.547 18.686 1.00 0.00 H new ATOM 0 HA LYS A 16 28.079 27.008 16.194 1.00 0.00 H new ATOM 0 HB2 LYS A 16 28.263 28.412 18.868 1.00 0.00 H new ATOM 0 HB3 LYS A 16 29.476 28.494 17.606 1.00 0.00 H new ATOM 0 HG2 LYS A 16 26.599 29.298 17.094 1.00 0.00 H new ATOM 0 HG3 LYS A 16 27.749 30.418 17.798 1.00 0.00 H new ATOM 0 HD2 LYS A 16 29.140 29.597 15.566 1.00 0.00 H new ATOM 0 HD3 LYS A 16 27.490 29.487 14.986 1.00 0.00 H new ATOM 0 HE2 LYS A 16 27.090 31.843 15.886 1.00 0.00 H new ATOM 0 HE3 LYS A 16 28.797 31.936 16.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 28.315 32.968 14.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 29.312 31.613 13.928 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 27.657 31.523 13.557 1.00 0.00 H new ATOM 263 N THR A 17 29.501 25.212 16.998 1.00 0.00 N ATOM 264 CA THR A 17 30.386 24.082 17.333 1.00 0.00 C ATOM 265 C THR A 17 31.821 24.365 16.894 1.00 0.00 C ATOM 266 O THR A 17 32.080 24.652 15.723 1.00 0.00 O ATOM 267 CB THR A 17 29.853 22.726 16.841 1.00 0.00 C ATOM 268 OG1 THR A 17 30.559 21.693 17.492 1.00 0.00 O ATOM 269 CG2 THR A 17 29.992 22.476 15.344 1.00 0.00 C ATOM 0 H THR A 17 29.475 25.414 15.998 1.00 0.00 H new ATOM 0 HA THR A 17 30.396 23.991 18.419 1.00 0.00 H new ATOM 0 HB THR A 17 28.787 22.743 17.069 1.00 0.00 H new ATOM 0 HG1 THR A 17 30.059 21.403 18.283 1.00 0.00 H new ATOM 0 HG21 THR A 17 29.587 21.494 15.100 1.00 0.00 H new ATOM 0 HG22 THR A 17 29.444 23.241 14.795 1.00 0.00 H new ATOM 0 HG23 THR A 17 31.045 22.514 15.065 1.00 0.00 H new ATOM 277 N TYR A 18 32.736 24.343 17.857 1.00 0.00 N ATOM 278 CA TYR A 18 34.063 24.966 17.799 1.00 0.00 C ATOM 279 C TYR A 18 35.163 24.013 18.300 1.00 0.00 C ATOM 280 O TYR A 18 34.912 23.155 19.143 1.00 0.00 O ATOM 281 CB TYR A 18 34.030 26.269 18.627 1.00 0.00 C ATOM 282 CG TYR A 18 33.238 27.458 18.065 1.00 0.00 C ATOM 283 CD1 TYR A 18 32.917 27.547 16.691 1.00 0.00 C ATOM 284 CD2 TYR A 18 32.860 28.525 18.911 1.00 0.00 C ATOM 285 CE1 TYR A 18 32.218 28.652 16.176 1.00 0.00 C ATOM 286 CE2 TYR A 18 32.177 29.643 18.391 1.00 0.00 C ATOM 287 CZ TYR A 18 31.870 29.720 17.020 1.00 0.00 C ATOM 288 OH TYR A 18 31.261 30.826 16.515 1.00 0.00 O ATOM 0 H TYR A 18 32.569 23.868 18.744 1.00 0.00 H new ATOM 0 HA TYR A 18 34.306 25.196 16.762 1.00 0.00 H new ATOM 0 HB2 TYR A 18 33.623 26.030 19.610 1.00 0.00 H new ATOM 0 HB3 TYR A 18 35.059 26.595 18.779 1.00 0.00 H new ATOM 0 HD1 TYR A 18 33.215 26.751 16.025 1.00 0.00 H new ATOM 0 HD2 TYR A 18 33.096 28.483 19.964 1.00 0.00 H new ATOM 0 HE1 TYR A 18 31.948 28.680 15.131 1.00 0.00 H new ATOM 0 HE2 TYR A 18 31.887 30.447 19.051 1.00 0.00 H new ATOM 0 HH TYR A 18 31.091 31.465 17.238 1.00 0.00 H new ATOM 298 N GLU A 19 36.389 24.166 17.793 1.00 0.00 N ATOM 299 CA GLU A 19 37.530 23.263 18.023 1.00 0.00 C ATOM 300 C GLU A 19 38.575 23.893 18.965 1.00 0.00 C ATOM 301 O GLU A 19 39.184 24.924 18.650 1.00 0.00 O ATOM 302 CB GLU A 19 38.161 22.869 16.678 1.00 0.00 C ATOM 303 CG GLU A 19 37.229 22.020 15.795 1.00 0.00 C ATOM 304 CD GLU A 19 37.779 21.834 14.373 1.00 0.00 C ATOM 305 OE1 GLU A 19 39.012 21.916 14.166 1.00 0.00 O ATOM 306 OE2 GLU A 19 36.984 21.590 13.429 1.00 0.00 O ATOM 0 H GLU A 19 36.628 24.951 17.187 1.00 0.00 H new ATOM 0 HA GLU A 19 37.161 22.364 18.517 1.00 0.00 H new ATOM 0 HB2 GLU A 19 38.440 23.773 16.136 1.00 0.00 H new ATOM 0 HB3 GLU A 19 39.080 22.313 16.864 1.00 0.00 H new ATOM 0 HG2 GLU A 19 37.086 21.043 16.257 1.00 0.00 H new ATOM 0 HG3 GLU A 19 36.249 22.495 15.744 1.00 0.00 H new ATOM 313 N VAL A 20 38.781 23.264 20.129 1.00 0.00 N ATOM 314 CA VAL A 20 39.477 23.829 21.301 1.00 0.00 C ATOM 315 C VAL A 20 40.569 22.922 21.874 1.00 0.00 C ATOM 316 O VAL A 20 40.747 21.769 21.469 1.00 0.00 O ATOM 317 CB VAL A 20 38.456 24.185 22.408 1.00 0.00 C ATOM 318 CG1 VAL A 20 37.507 25.294 21.958 1.00 0.00 C ATOM 319 CG2 VAL A 20 37.630 22.983 22.891 1.00 0.00 C ATOM 0 H VAL A 20 38.456 22.311 20.290 1.00 0.00 H new ATOM 0 HA VAL A 20 39.981 24.727 20.945 1.00 0.00 H new ATOM 0 HB VAL A 20 39.059 24.531 23.248 1.00 0.00 H new ATOM 0 HG11 VAL A 20 36.804 25.519 22.760 1.00 0.00 H new ATOM 0 HG12 VAL A 20 38.081 26.189 21.718 1.00 0.00 H new ATOM 0 HG13 VAL A 20 36.958 24.967 21.075 1.00 0.00 H new ATOM 0 HG21 VAL A 20 36.936 23.307 23.666 1.00 0.00 H new ATOM 0 HG22 VAL A 20 37.070 22.566 22.054 1.00 0.00 H new ATOM 0 HG23 VAL A 20 38.297 22.222 23.296 1.00 0.00 H new ATOM 329 N CYS A 21 41.293 23.475 22.845 1.00 0.00 N ATOM 330 CA CYS A 21 42.257 22.789 23.692 1.00 0.00 C ATOM 331 C CYS A 21 41.637 22.278 25.003 1.00 0.00 C ATOM 332 O CYS A 21 40.579 22.713 25.457 1.00 0.00 O ATOM 333 CB CYS A 21 43.388 23.783 23.969 1.00 0.00 C ATOM 334 SG CYS A 21 44.895 22.983 24.578 1.00 0.00 S ATOM 0 H CYS A 21 41.216 24.467 23.071 1.00 0.00 H new ATOM 0 HA CYS A 21 42.626 21.899 23.182 1.00 0.00 H new ATOM 0 HB2 CYS A 21 43.617 24.330 23.054 1.00 0.00 H new ATOM 0 HB3 CYS A 21 43.050 24.516 24.702 1.00 0.00 H new ATOM 0 HG CYS A 21 44.793 22.784 25.859 1.00 0.00 H new ATOM 340 N GLU A 22 42.366 21.379 25.646 1.00 0.00 N ATOM 341 CA GLU A 22 42.229 20.970 27.038 1.00 0.00 C ATOM 342 C GLU A 22 42.545 22.115 28.027 1.00 0.00 C ATOM 343 O GLU A 22 43.307 23.031 27.703 1.00 0.00 O ATOM 344 CB GLU A 22 43.212 19.808 27.172 1.00 0.00 C ATOM 345 CG GLU A 22 43.013 18.963 28.419 1.00 0.00 C ATOM 346 CD GLU A 22 43.961 17.757 28.485 1.00 0.00 C ATOM 347 OE1 GLU A 22 44.878 17.630 27.634 1.00 0.00 O ATOM 348 OE2 GLU A 22 43.784 16.899 29.387 1.00 0.00 O ATOM 0 H GLU A 22 43.122 20.880 25.177 1.00 0.00 H new ATOM 0 HA GLU A 22 41.206 20.687 27.285 1.00 0.00 H new ATOM 0 HB2 GLU A 22 43.121 19.167 26.295 1.00 0.00 H new ATOM 0 HB3 GLU A 22 44.227 20.204 27.174 1.00 0.00 H new ATOM 0 HG2 GLU A 22 43.164 19.586 29.301 1.00 0.00 H new ATOM 0 HG3 GLU A 22 41.982 18.610 28.451 1.00 0.00 H new ATOM 355 N GLY A 23 41.947 22.097 29.225 1.00 0.00 N ATOM 356 CA GLY A 23 42.117 23.141 30.251 1.00 0.00 C ATOM 357 C GLY A 23 41.324 24.433 29.992 1.00 0.00 C ATOM 358 O GLY A 23 41.155 25.261 30.889 1.00 0.00 O ATOM 0 H GLY A 23 41.321 21.346 29.516 1.00 0.00 H new ATOM 0 HA2 GLY A 23 41.817 22.734 31.217 1.00 0.00 H new ATOM 0 HA3 GLY A 23 43.176 23.389 30.325 1.00 0.00 H new ATOM 362 N GLU A 24 40.768 24.600 28.793 1.00 0.00 N ATOM 363 CA GLU A 24 39.884 25.714 28.448 1.00 0.00 C ATOM 364 C GLU A 24 38.540 25.597 29.191 1.00 0.00 C ATOM 365 O GLU A 24 37.910 24.537 29.195 1.00 0.00 O ATOM 366 CB GLU A 24 39.644 25.741 26.932 1.00 0.00 C ATOM 367 CG GLU A 24 40.898 25.885 26.067 1.00 0.00 C ATOM 368 CD GLU A 24 41.447 27.315 26.036 1.00 0.00 C ATOM 369 OE1 GLU A 24 42.113 27.730 27.012 1.00 0.00 O ATOM 370 OE2 GLU A 24 41.246 28.037 25.026 1.00 0.00 O ATOM 0 H GLU A 24 40.922 23.953 28.019 1.00 0.00 H new ATOM 0 HA GLU A 24 40.366 26.643 28.753 1.00 0.00 H new ATOM 0 HB2 GLU A 24 39.131 24.822 26.647 1.00 0.00 H new ATOM 0 HB3 GLU A 24 38.970 26.566 26.703 1.00 0.00 H new ATOM 0 HG2 GLU A 24 41.670 25.214 26.443 1.00 0.00 H new ATOM 0 HG3 GLU A 24 40.668 25.568 25.050 1.00 0.00 H new ATOM 377 N THR A 25 38.092 26.691 29.807 1.00 0.00 N ATOM 378 CA THR A 25 36.850 26.792 30.595 1.00 0.00 C ATOM 379 C THR A 25 35.676 27.214 29.719 1.00 0.00 C ATOM 380 O THR A 25 35.842 27.958 28.760 1.00 0.00 O ATOM 381 CB THR A 25 37.014 27.782 31.753 1.00 0.00 C ATOM 382 OG1 THR A 25 38.362 28.069 32.047 1.00 0.00 O ATOM 383 CG2 THR A 25 36.423 27.238 33.043 1.00 0.00 C ATOM 0 H THR A 25 38.603 27.573 29.773 1.00 0.00 H new ATOM 0 HA THR A 25 36.643 25.803 31.004 1.00 0.00 H new ATOM 0 HB THR A 25 36.497 28.680 31.414 1.00 0.00 H new ATOM 0 HG1 THR A 25 38.526 29.028 31.928 1.00 0.00 H new ATOM 0 HG21 THR A 25 36.558 27.968 33.841 1.00 0.00 H new ATOM 0 HG22 THR A 25 35.359 27.046 32.903 1.00 0.00 H new ATOM 0 HG23 THR A 25 36.927 26.309 33.311 1.00 0.00 H new ATOM 391 N ILE A 26 34.458 26.797 30.046 1.00 0.00 N ATOM 392 CA ILE A 26 33.286 26.982 29.166 1.00 0.00 C ATOM 393 C ILE A 26 33.005 28.443 28.783 1.00 0.00 C ATOM 394 O ILE A 26 32.942 28.731 27.587 1.00 0.00 O ATOM 395 CB ILE A 26 32.073 26.280 29.805 1.00 0.00 C ATOM 396 CG1 ILE A 26 32.327 24.769 30.012 1.00 0.00 C ATOM 397 CG2 ILE A 26 30.801 26.495 28.978 1.00 0.00 C ATOM 398 CD1 ILE A 26 32.761 23.995 28.765 1.00 0.00 C ATOM 0 H ILE A 26 34.245 26.322 30.923 1.00 0.00 H new ATOM 0 HA ILE A 26 33.509 26.516 28.206 1.00 0.00 H new ATOM 0 HB ILE A 26 31.928 26.735 30.785 1.00 0.00 H new ATOM 0 HG12 ILE A 26 33.094 24.649 30.777 1.00 0.00 H new ATOM 0 HG13 ILE A 26 31.415 24.315 30.400 1.00 0.00 H new ATOM 0 HG21 ILE A 26 29.965 25.986 29.458 1.00 0.00 H new ATOM 0 HG22 ILE A 26 30.587 27.562 28.911 1.00 0.00 H new ATOM 0 HG23 ILE A 26 30.946 26.090 27.976 1.00 0.00 H new ATOM 0 HD11 ILE A 26 32.912 22.946 29.022 1.00 0.00 H new ATOM 0 HD12 ILE A 26 31.988 24.074 28.001 1.00 0.00 H new ATOM 0 HD13 ILE A 26 33.693 24.413 28.383 1.00 0.00 H new ATOM 410 N LEU A 27 32.895 29.385 29.734 1.00 0.00 N ATOM 411 CA LEU A 27 32.734 30.799 29.358 1.00 0.00 C ATOM 412 C LEU A 27 34.053 31.461 28.925 1.00 0.00 C ATOM 413 O LEU A 27 34.020 32.386 28.120 1.00 0.00 O ATOM 414 CB LEU A 27 31.820 31.591 30.307 1.00 0.00 C ATOM 415 CG LEU A 27 32.481 32.377 31.451 1.00 0.00 C ATOM 416 CD1 LEU A 27 33.015 33.747 31.027 1.00 0.00 C ATOM 417 CD2 LEU A 27 31.414 32.620 32.512 1.00 0.00 C ATOM 0 H LEU A 27 32.914 29.203 30.737 1.00 0.00 H new ATOM 0 HA LEU A 27 32.153 30.822 28.436 1.00 0.00 H new ATOM 0 HB2 LEU A 27 31.244 32.295 29.707 1.00 0.00 H new ATOM 0 HB3 LEU A 27 31.109 30.892 30.748 1.00 0.00 H new ATOM 0 HG LEU A 27 33.328 31.788 31.803 1.00 0.00 H new ATOM 0 HD11 LEU A 27 33.467 34.243 31.886 1.00 0.00 H new ATOM 0 HD12 LEU A 27 33.764 33.620 30.246 1.00 0.00 H new ATOM 0 HD13 LEU A 27 32.194 34.356 30.647 1.00 0.00 H new ATOM 0 HD21 LEU A 27 31.847 33.177 33.343 1.00 0.00 H new ATOM 0 HD22 LEU A 27 30.594 33.193 32.079 1.00 0.00 H new ATOM 0 HD23 LEU A 27 31.037 31.664 32.874 1.00 0.00 H new ATOM 429 N ASP A 28 35.209 30.919 29.323 1.00 0.00 N ATOM 430 CA ASP A 28 36.499 31.294 28.725 1.00 0.00 C ATOM 431 C ASP A 28 36.583 30.940 27.230 1.00 0.00 C ATOM 432 O ASP A 28 37.271 31.646 26.506 1.00 0.00 O ATOM 433 CB ASP A 28 37.670 30.648 29.482 1.00 0.00 C ATOM 434 CG ASP A 28 38.007 31.337 30.813 1.00 0.00 C ATOM 435 OD1 ASP A 28 38.040 32.591 30.854 1.00 0.00 O ATOM 436 OD2 ASP A 28 38.332 30.634 31.799 1.00 0.00 O ATOM 0 H ASP A 28 35.280 30.217 30.059 1.00 0.00 H new ATOM 0 HA ASP A 28 36.572 32.378 28.812 1.00 0.00 H new ATOM 0 HB2 ASP A 28 37.432 29.602 29.676 1.00 0.00 H new ATOM 0 HB3 ASP A 28 38.554 30.661 28.844 1.00 0.00 H new ATOM 441 N ILE A 29 35.852 29.932 26.731 1.00 0.00 N ATOM 442 CA ILE A 29 35.685 29.703 25.283 1.00 0.00 C ATOM 443 C ILE A 29 34.555 30.565 24.726 1.00 0.00 C ATOM 444 O ILE A 29 34.682 31.067 23.615 1.00 0.00 O ATOM 445 CB ILE A 29 35.515 28.210 24.894 1.00 0.00 C ATOM 446 CG1 ILE A 29 36.536 27.260 25.571 1.00 0.00 C ATOM 447 CG2 ILE A 29 35.789 28.137 23.374 1.00 0.00 C ATOM 448 CD1 ILE A 29 36.002 25.852 25.841 1.00 0.00 C ATOM 0 H ILE A 29 35.361 29.254 27.314 1.00 0.00 H new ATOM 0 HA ILE A 29 36.622 30.011 24.818 1.00 0.00 H new ATOM 0 HB ILE A 29 34.520 27.892 25.205 1.00 0.00 H new ATOM 0 HG12 ILE A 29 37.420 27.185 24.938 1.00 0.00 H new ATOM 0 HG13 ILE A 29 36.856 27.702 26.515 1.00 0.00 H new ATOM 0 HG21 ILE A 29 35.685 27.106 23.035 1.00 0.00 H new ATOM 0 HG22 ILE A 29 35.074 28.767 22.845 1.00 0.00 H new ATOM 0 HG23 ILE A 29 36.801 28.486 23.170 1.00 0.00 H new ATOM 0 HD11 ILE A 29 36.779 25.253 26.316 1.00 0.00 H new ATOM 0 HD12 ILE A 29 35.136 25.912 26.500 1.00 0.00 H new ATOM 0 HD13 ILE A 29 35.710 25.387 24.900 1.00 0.00 H new ATOM 460 N ALA A 30 33.489 30.839 25.478 1.00 0.00 N ATOM 461 CA ALA A 30 32.472 31.778 25.005 1.00 0.00 C ATOM 462 C ALA A 30 33.083 33.168 24.695 1.00 0.00 C ATOM 463 O ALA A 30 32.817 33.746 23.641 1.00 0.00 O ATOM 464 CB ALA A 30 31.331 31.850 26.022 1.00 0.00 C ATOM 0 H ALA A 30 33.309 30.435 26.397 1.00 0.00 H new ATOM 0 HA ALA A 30 32.061 31.417 24.062 1.00 0.00 H new ATOM 0 HB1 ALA A 30 30.573 32.550 25.670 1.00 0.00 H new ATOM 0 HB2 ALA A 30 30.886 30.862 26.140 1.00 0.00 H new ATOM 0 HB3 ALA A 30 31.720 32.190 26.982 1.00 0.00 H new ATOM 470 N GLN A 31 33.986 33.645 25.560 1.00 0.00 N ATOM 471 CA GLN A 31 34.813 34.838 25.348 1.00 0.00 C ATOM 472 C GLN A 31 35.990 34.593 24.398 1.00 0.00 C ATOM 473 O GLN A 31 36.184 35.372 23.474 1.00 0.00 O ATOM 474 CB GLN A 31 35.310 35.374 26.685 1.00 0.00 C ATOM 475 CG GLN A 31 34.180 35.825 27.619 1.00 0.00 C ATOM 476 CD GLN A 31 33.362 37.046 27.204 1.00 0.00 C ATOM 477 OE1 GLN A 31 33.359 37.497 26.069 1.00 0.00 O ATOM 478 NE2 GLN A 31 32.627 37.636 28.120 1.00 0.00 N ATOM 0 H GLN A 31 34.167 33.195 26.457 1.00 0.00 H new ATOM 0 HA GLN A 31 34.178 35.582 24.867 1.00 0.00 H new ATOM 0 HB2 GLN A 31 35.896 34.601 27.183 1.00 0.00 H new ATOM 0 HB3 GLN A 31 35.980 36.215 26.505 1.00 0.00 H new ATOM 0 HG2 GLN A 31 33.493 34.988 27.744 1.00 0.00 H new ATOM 0 HG3 GLN A 31 34.615 36.029 28.597 1.00 0.00 H new ATOM 0 HE21 GLN A 31 32.615 37.276 29.074 1.00 0.00 H new ATOM 0 HE22 GLN A 31 32.069 38.454 27.877 1.00 0.00 H new ATOM 487 N GLY A 32 36.746 33.505 24.555 1.00 0.00 N ATOM 488 CA GLY A 32 37.917 33.177 23.731 1.00 0.00 C ATOM 489 C GLY A 32 37.602 32.875 22.265 1.00 0.00 C ATOM 490 O GLY A 32 38.487 32.973 21.414 1.00 0.00 O ATOM 0 H GLY A 32 36.558 32.808 25.276 1.00 0.00 H new ATOM 0 HA2 GLY A 32 38.619 34.010 23.774 1.00 0.00 H new ATOM 0 HA3 GLY A 32 38.420 32.313 24.166 1.00 0.00 H new ATOM 494 N HIS A 33 36.342 32.566 21.942 1.00 0.00 N ATOM 495 CA HIS A 33 35.838 32.458 20.583 1.00 0.00 C ATOM 496 C HIS A 33 34.945 33.637 20.167 1.00 0.00 C ATOM 497 O HIS A 33 34.505 33.678 19.020 1.00 0.00 O ATOM 498 CB HIS A 33 35.098 31.126 20.471 1.00 0.00 C ATOM 499 CG HIS A 33 35.443 30.413 19.190 1.00 0.00 C ATOM 500 ND1 HIS A 33 35.088 30.795 17.917 1.00 0.00 N ATOM 501 CD2 HIS A 33 36.287 29.341 19.068 1.00 0.00 C ATOM 502 CE1 HIS A 33 35.665 29.948 17.052 1.00 0.00 C ATOM 503 NE2 HIS A 33 36.439 29.060 17.703 1.00 0.00 N ATOM 0 H HIS A 33 35.628 32.380 22.646 1.00 0.00 H new ATOM 0 HA HIS A 33 36.680 32.493 19.891 1.00 0.00 H new ATOM 0 HB2 HIS A 33 35.353 30.494 21.321 1.00 0.00 H new ATOM 0 HB3 HIS A 33 34.023 31.300 20.514 1.00 0.00 H new ATOM 0 HD2 HIS A 33 36.754 28.806 19.882 1.00 0.00 H new ATOM 0 HE1 HIS A 33 35.528 29.975 15.981 1.00 0.00 H new ATOM 0 HE2 HIS A 33 37.019 28.331 17.288 1.00 0.00 H new ATOM 511 N ASN A 34 34.680 34.586 21.075 1.00 0.00 N ATOM 512 CA ASN A 34 33.765 35.724 20.910 1.00 0.00 C ATOM 513 C ASN A 34 32.421 35.333 20.289 1.00 0.00 C ATOM 514 O ASN A 34 31.977 35.870 19.266 1.00 0.00 O ATOM 515 CB ASN A 34 34.474 36.909 20.249 1.00 0.00 C ATOM 516 CG ASN A 34 35.373 37.594 21.254 1.00 0.00 C ATOM 517 OD1 ASN A 34 34.949 38.444 22.030 1.00 0.00 O ATOM 518 ND2 ASN A 34 36.600 37.162 21.381 1.00 0.00 N ATOM 0 H ASN A 34 35.122 34.580 21.994 1.00 0.00 H new ATOM 0 HA ASN A 34 33.480 36.074 21.902 1.00 0.00 H new ATOM 0 HB2 ASN A 34 35.061 36.564 19.398 1.00 0.00 H new ATOM 0 HB3 ASN A 34 33.739 37.616 19.864 1.00 0.00 H new ATOM 0 HD21 ASN A 34 37.197 37.532 22.121 1.00 0.00 H new ATOM 0 HD22 ASN A 34 36.961 36.455 20.740 1.00 0.00 H new ATOM 525 N LEU A 35 31.771 34.409 20.989 1.00 0.00 N ATOM 526 CA LEU A 35 30.329 34.162 20.837 1.00 0.00 C ATOM 527 C LEU A 35 29.510 35.435 21.130 1.00 0.00 C ATOM 528 O LEU A 35 29.783 36.176 22.078 1.00 0.00 O ATOM 529 CB LEU A 35 29.871 33.037 21.792 1.00 0.00 C ATOM 530 CG LEU A 35 30.307 31.628 21.343 1.00 0.00 C ATOM 531 CD1 LEU A 35 30.037 30.552 22.403 1.00 0.00 C ATOM 532 CD2 LEU A 35 29.580 31.214 20.061 1.00 0.00 C ATOM 0 H LEU A 35 32.222 33.808 21.678 1.00 0.00 H new ATOM 0 HA LEU A 35 30.156 33.861 19.804 1.00 0.00 H new ATOM 0 HB2 LEU A 35 30.271 33.232 22.787 1.00 0.00 H new ATOM 0 HB3 LEU A 35 28.784 33.062 21.875 1.00 0.00 H new ATOM 0 HG LEU A 35 31.382 31.695 21.176 1.00 0.00 H new ATOM 0 HD11 LEU A 35 30.365 29.582 22.029 1.00 0.00 H new ATOM 0 HD12 LEU A 35 30.584 30.793 23.314 1.00 0.00 H new ATOM 0 HD13 LEU A 35 28.969 30.515 22.620 1.00 0.00 H new ATOM 0 HD21 LEU A 35 29.905 30.217 19.765 1.00 0.00 H new ATOM 0 HD22 LEU A 35 28.505 31.208 20.238 1.00 0.00 H new ATOM 0 HD23 LEU A 35 29.813 31.922 19.266 1.00 0.00 H new ATOM 544 N ASP A 36 28.463 35.659 20.335 1.00 0.00 N ATOM 545 CA ASP A 36 27.437 36.687 20.553 1.00 0.00 C ATOM 546 C ASP A 36 26.431 36.181 21.572 1.00 0.00 C ATOM 547 O ASP A 36 25.404 35.578 21.250 1.00 0.00 O ATOM 548 CB ASP A 36 26.828 37.092 19.209 1.00 0.00 C ATOM 549 CG ASP A 36 25.873 38.284 19.322 1.00 0.00 C ATOM 550 OD1 ASP A 36 26.174 39.273 20.036 1.00 0.00 O ATOM 551 OD2 ASP A 36 24.800 38.257 18.673 1.00 0.00 O ATOM 0 H ASP A 36 28.298 35.111 19.490 1.00 0.00 H new ATOM 0 HA ASP A 36 27.865 37.597 20.974 1.00 0.00 H new ATOM 0 HB2 ASP A 36 27.629 37.340 18.513 1.00 0.00 H new ATOM 0 HB3 ASP A 36 26.291 36.242 18.788 1.00 0.00 H new ATOM 556 N MET A 37 26.825 36.363 22.828 1.00 0.00 N ATOM 557 CA MET A 37 26.267 35.712 23.994 1.00 0.00 C ATOM 558 C MET A 37 26.441 36.641 25.204 1.00 0.00 C ATOM 559 O MET A 37 27.518 37.176 25.459 1.00 0.00 O ATOM 560 CB MET A 37 26.919 34.320 24.121 1.00 0.00 C ATOM 561 CG MET A 37 28.303 34.283 24.787 1.00 0.00 C ATOM 562 SD MET A 37 28.315 34.295 26.606 1.00 0.00 S ATOM 563 CE MET A 37 29.865 35.195 26.899 1.00 0.00 C ATOM 0 H MET A 37 27.582 37.004 23.066 1.00 0.00 H new ATOM 0 HA MET A 37 25.194 35.535 23.919 1.00 0.00 H new ATOM 0 HB2 MET A 37 26.247 33.676 24.689 1.00 0.00 H new ATOM 0 HB3 MET A 37 27.006 33.889 23.124 1.00 0.00 H new ATOM 0 HG2 MET A 37 28.824 33.388 24.446 1.00 0.00 H new ATOM 0 HG3 MET A 37 28.877 35.140 24.434 1.00 0.00 H new ATOM 0 HE1 MET A 37 30.188 35.038 27.928 1.00 0.00 H new ATOM 0 HE2 MET A 37 30.633 34.829 26.218 1.00 0.00 H new ATOM 0 HE3 MET A 37 29.706 36.260 26.727 1.00 0.00 H new ATOM 573 N GLU A 38 25.344 36.909 25.897 1.00 0.00 N ATOM 574 CA GLU A 38 25.284 37.870 27.012 1.00 0.00 C ATOM 575 C GLU A 38 25.853 37.336 28.345 1.00 0.00 C ATOM 576 O GLU A 38 25.239 36.502 29.009 1.00 0.00 O ATOM 577 CB GLU A 38 23.859 38.439 27.174 1.00 0.00 C ATOM 578 CG GLU A 38 22.695 37.440 27.248 1.00 0.00 C ATOM 579 CD GLU A 38 21.388 38.196 27.505 1.00 0.00 C ATOM 580 OE1 GLU A 38 20.846 38.820 26.560 1.00 0.00 O ATOM 581 OE2 GLU A 38 20.913 38.230 28.666 1.00 0.00 O ATOM 0 H GLU A 38 24.448 36.461 25.704 1.00 0.00 H new ATOM 0 HA GLU A 38 25.952 38.687 26.738 1.00 0.00 H new ATOM 0 HB2 GLU A 38 23.840 39.043 28.081 1.00 0.00 H new ATOM 0 HB3 GLU A 38 23.670 39.113 26.338 1.00 0.00 H new ATOM 0 HG2 GLU A 38 22.625 36.877 26.317 1.00 0.00 H new ATOM 0 HG3 GLU A 38 22.872 36.717 28.045 1.00 0.00 H new ATOM 696 N CYS A 50 27.208 33.373 35.113 1.00 0.00 N ATOM 697 CA CYS A 50 27.963 32.221 34.583 1.00 0.00 C ATOM 698 C CYS A 50 27.130 31.008 34.100 1.00 0.00 C ATOM 699 O CYS A 50 27.634 29.890 33.999 1.00 0.00 O ATOM 700 CB CYS A 50 29.003 31.837 35.636 1.00 0.00 C ATOM 701 SG CYS A 50 30.422 30.850 35.127 1.00 0.00 S ATOM 0 HA CYS A 50 28.430 32.542 33.652 1.00 0.00 H new ATOM 0 HB2 CYS A 50 29.382 32.758 36.078 1.00 0.00 H new ATOM 0 HB3 CYS A 50 28.488 31.292 36.427 1.00 0.00 H new ATOM 0 HG CYS A 50 31.203 30.655 36.148 1.00 0.00 H new ATOM 706 N HIS A 51 25.845 31.195 33.784 1.00 0.00 N ATOM 707 CA HIS A 51 24.884 30.102 33.915 1.00 0.00 C ATOM 708 C HIS A 51 24.754 29.314 32.609 1.00 0.00 C ATOM 709 O HIS A 51 24.067 29.713 31.664 1.00 0.00 O ATOM 710 CB HIS A 51 23.542 30.690 34.377 1.00 0.00 C ATOM 711 CG HIS A 51 22.429 29.678 34.464 1.00 0.00 C ATOM 712 ND1 HIS A 51 21.159 29.826 33.957 1.00 0.00 N ATOM 713 CD2 HIS A 51 22.474 28.461 35.087 1.00 0.00 C ATOM 714 CE1 HIS A 51 20.453 28.734 34.282 1.00 0.00 C ATOM 715 NE2 HIS A 51 21.217 27.858 34.954 1.00 0.00 N ATOM 0 H HIS A 51 25.455 32.074 33.443 1.00 0.00 H new ATOM 0 HA HIS A 51 25.233 29.387 34.660 1.00 0.00 H new ATOM 0 HB2 HIS A 51 23.677 31.152 35.355 1.00 0.00 H new ATOM 0 HB3 HIS A 51 23.247 31.482 33.688 1.00 0.00 H new ATOM 0 HD1 HIS A 51 20.815 30.626 33.427 1.00 0.00 H new ATOM 0 HD2 HIS A 51 23.330 28.039 35.593 1.00 0.00 H new ATOM 0 HE1 HIS A 51 19.413 28.580 34.037 1.00 0.00 H new ATOM 723 N VAL A 52 25.394 28.144 32.578 1.00 0.00 N ATOM 724 CA VAL A 52 25.349 27.206 31.449 1.00 0.00 C ATOM 725 C VAL A 52 24.734 25.902 31.947 1.00 0.00 C ATOM 726 O VAL A 52 24.534 25.678 33.140 1.00 0.00 O ATOM 727 CB VAL A 52 26.725 26.923 30.795 1.00 0.00 C ATOM 728 CG1 VAL A 52 26.545 26.820 29.290 1.00 0.00 C ATOM 729 CG2 VAL A 52 27.835 27.930 31.117 1.00 0.00 C ATOM 0 H VAL A 52 25.971 27.813 33.352 1.00 0.00 H new ATOM 0 HA VAL A 52 24.749 27.670 30.666 1.00 0.00 H new ATOM 0 HB VAL A 52 27.068 25.985 31.231 1.00 0.00 H new ATOM 0 HG11 VAL A 52 27.509 26.621 28.821 1.00 0.00 H new ATOM 0 HG12 VAL A 52 25.855 26.008 29.061 1.00 0.00 H new ATOM 0 HG13 VAL A 52 26.142 27.757 28.907 1.00 0.00 H new ATOM 0 HG21 VAL A 52 28.753 27.635 30.608 1.00 0.00 H new ATOM 0 HG22 VAL A 52 27.535 28.922 30.779 1.00 0.00 H new ATOM 0 HG23 VAL A 52 28.007 27.950 32.193 1.00 0.00 H new ATOM 739 N ILE A 53 24.406 25.012 31.030 1.00 0.00 N ATOM 740 CA ILE A 53 24.021 23.641 31.300 1.00 0.00 C ATOM 741 C ILE A 53 24.703 22.718 30.291 1.00 0.00 C ATOM 742 O ILE A 53 25.013 23.161 29.202 1.00 0.00 O ATOM 743 CB ILE A 53 22.482 23.607 31.311 1.00 0.00 C ATOM 744 CG1 ILE A 53 22.044 22.188 31.671 1.00 0.00 C ATOM 745 CG2 ILE A 53 21.891 24.161 29.996 1.00 0.00 C ATOM 746 CD1 ILE A 53 20.782 21.740 31.003 1.00 0.00 C ATOM 0 H ILE A 53 24.401 25.235 30.035 1.00 0.00 H new ATOM 0 HA ILE A 53 24.354 23.271 32.270 1.00 0.00 H new ATOM 0 HB ILE A 53 22.079 24.276 32.071 1.00 0.00 H new ATOM 0 HG12 ILE A 53 22.845 21.497 31.408 1.00 0.00 H new ATOM 0 HG13 ILE A 53 21.911 22.125 32.751 1.00 0.00 H new ATOM 0 HG21 ILE A 53 20.803 24.121 30.041 1.00 0.00 H new ATOM 0 HG22 ILE A 53 22.211 25.194 29.860 1.00 0.00 H new ATOM 0 HG23 ILE A 53 22.242 23.559 29.158 1.00 0.00 H new ATOM 0 HD11 ILE A 53 20.546 20.723 31.315 1.00 0.00 H new ATOM 0 HD12 ILE A 53 19.965 22.405 31.285 1.00 0.00 H new ATOM 0 HD13 ILE A 53 20.914 21.766 29.921 1.00 0.00 H new ATOM 758 N VAL A 54 24.976 21.466 30.650 1.00 0.00 N ATOM 759 CA VAL A 54 25.534 20.406 29.804 1.00 0.00 C ATOM 760 C VAL A 54 24.480 19.454 29.251 1.00 0.00 C ATOM 761 O VAL A 54 23.417 19.264 29.845 1.00 0.00 O ATOM 762 CB VAL A 54 26.592 19.670 30.632 1.00 0.00 C ATOM 763 CG1 VAL A 54 26.050 18.698 31.621 1.00 0.00 C ATOM 764 CG2 VAL A 54 27.676 18.912 29.858 1.00 0.00 C ATOM 0 H VAL A 54 24.803 21.140 31.601 1.00 0.00 H new ATOM 0 HA VAL A 54 25.982 20.855 28.918 1.00 0.00 H new ATOM 0 HB VAL A 54 27.041 20.532 31.125 1.00 0.00 H new ATOM 0 HG11 VAL A 54 26.874 18.228 32.158 1.00 0.00 H new ATOM 0 HG12 VAL A 54 25.406 19.220 32.329 1.00 0.00 H new ATOM 0 HG13 VAL A 54 25.473 17.934 31.101 1.00 0.00 H new ATOM 0 HG21 VAL A 54 28.360 18.437 30.561 1.00 0.00 H new ATOM 0 HG22 VAL A 54 27.211 18.150 29.233 1.00 0.00 H new ATOM 0 HG23 VAL A 54 28.229 19.610 29.229 1.00 0.00 H new ATOM 774 N ASP A 55 24.825 18.805 28.143 1.00 0.00 N ATOM 775 CA ASP A 55 24.199 17.558 27.716 1.00 0.00 C ATOM 776 C ASP A 55 24.257 16.528 28.873 1.00 0.00 C ATOM 777 O ASP A 55 25.341 16.336 29.446 1.00 0.00 O ATOM 778 CB ASP A 55 25.085 17.040 26.575 1.00 0.00 C ATOM 779 CG ASP A 55 24.553 15.842 25.781 1.00 0.00 C ATOM 780 OD1 ASP A 55 23.605 15.155 26.221 1.00 0.00 O ATOM 781 OD2 ASP A 55 25.124 15.568 24.702 1.00 0.00 O ATOM 0 H ASP A 55 25.554 19.133 27.510 1.00 0.00 H new ATOM 0 HA ASP A 55 23.160 17.705 27.422 1.00 0.00 H new ATOM 0 HB2 ASP A 55 25.257 17.861 25.878 1.00 0.00 H new ATOM 0 HB3 ASP A 55 26.054 16.768 26.993 1.00 0.00 H new ATOM 786 N PRO A 56 23.187 15.766 29.157 1.00 0.00 N ATOM 787 CA PRO A 56 23.225 14.689 30.147 1.00 0.00 C ATOM 788 C PRO A 56 24.240 13.582 29.830 1.00 0.00 C ATOM 789 O PRO A 56 24.621 12.835 30.731 1.00 0.00 O ATOM 790 CB PRO A 56 21.796 14.148 30.220 1.00 0.00 C ATOM 791 CG PRO A 56 20.940 15.326 29.765 1.00 0.00 C ATOM 792 CD PRO A 56 21.820 16.008 28.726 1.00 0.00 C ATOM 0 HA PRO A 56 23.568 15.078 31.106 1.00 0.00 H new ATOM 0 HB2 PRO A 56 21.662 13.282 29.572 1.00 0.00 H new ATOM 0 HB3 PRO A 56 21.538 13.833 31.231 1.00 0.00 H new ATOM 0 HG2 PRO A 56 19.993 14.996 29.338 1.00 0.00 H new ATOM 0 HG3 PRO A 56 20.700 15.994 30.592 1.00 0.00 H new ATOM 0 HD2 PRO A 56 21.643 15.598 27.732 1.00 0.00 H new ATOM 0 HD3 PRO A 56 21.608 17.076 28.672 1.00 0.00 H new ATOM 800 N ASP A 57 24.722 13.506 28.586 1.00 0.00 N ATOM 801 CA ASP A 57 25.800 12.602 28.181 1.00 0.00 C ATOM 802 C ASP A 57 27.157 13.038 28.733 1.00 0.00 C ATOM 803 O ASP A 57 27.905 12.195 29.232 1.00 0.00 O ATOM 804 CB ASP A 57 25.882 12.523 26.646 1.00 0.00 C ATOM 805 CG ASP A 57 25.199 11.288 26.072 1.00 0.00 C ATOM 806 OD1 ASP A 57 25.485 10.160 26.542 1.00 0.00 O ATOM 807 OD2 ASP A 57 24.400 11.445 25.114 1.00 0.00 O ATOM 0 H ASP A 57 24.368 14.080 27.821 1.00 0.00 H new ATOM 0 HA ASP A 57 25.564 11.622 28.595 1.00 0.00 H new ATOM 0 HB2 ASP A 57 25.425 13.415 26.218 1.00 0.00 H new ATOM 0 HB3 ASP A 57 26.929 12.525 26.344 1.00 0.00 H new ATOM 812 N TYR A 58 27.506 14.331 28.654 1.00 0.00 N ATOM 813 CA TYR A 58 28.848 14.765 28.994 1.00 0.00 C ATOM 814 C TYR A 58 28.999 15.164 30.457 1.00 0.00 C ATOM 815 O TYR A 58 30.093 15.029 30.995 1.00 0.00 O ATOM 816 CB TYR A 58 29.229 15.872 28.029 1.00 0.00 C ATOM 817 CG TYR A 58 29.460 15.358 26.626 1.00 0.00 C ATOM 818 CD1 TYR A 58 30.720 14.878 26.221 1.00 0.00 C ATOM 819 CD2 TYR A 58 28.372 15.295 25.744 1.00 0.00 C ATOM 820 CE1 TYR A 58 30.886 14.351 24.923 1.00 0.00 C ATOM 821 CE2 TYR A 58 28.528 14.782 24.450 1.00 0.00 C ATOM 822 CZ TYR A 58 29.784 14.290 24.040 1.00 0.00 C ATOM 823 OH TYR A 58 29.916 13.732 22.811 1.00 0.00 O ATOM 0 H TYR A 58 26.878 15.079 28.360 1.00 0.00 H new ATOM 0 HA TYR A 58 29.541 13.930 28.886 1.00 0.00 H new ATOM 0 HB2 TYR A 58 28.440 16.624 28.012 1.00 0.00 H new ATOM 0 HB3 TYR A 58 30.133 16.366 28.386 1.00 0.00 H new ATOM 0 HD1 TYR A 58 31.557 14.913 26.902 1.00 0.00 H new ATOM 0 HD2 TYR A 58 27.403 15.646 26.066 1.00 0.00 H new ATOM 0 HE1 TYR A 58 31.854 13.994 24.604 1.00 0.00 H new ATOM 0 HE2 TYR A 58 27.690 14.763 23.769 1.00 0.00 H new ATOM 0 HH TYR A 58 29.058 13.774 22.339 1.00 0.00 H new ATOM 833 N TYR A 59 27.920 15.564 31.142 1.00 0.00 N ATOM 834 CA TYR A 59 27.966 15.708 32.617 1.00 0.00 C ATOM 835 C TYR A 59 28.382 14.422 33.304 1.00 0.00 C ATOM 836 O TYR A 59 28.924 14.441 34.406 1.00 0.00 O ATOM 837 CB TYR A 59 26.586 15.983 33.229 1.00 0.00 C ATOM 838 CG TYR A 59 26.504 17.008 34.366 1.00 0.00 C ATOM 839 CD1 TYR A 59 27.360 18.126 34.440 1.00 0.00 C ATOM 840 CD2 TYR A 59 25.585 16.802 35.409 1.00 0.00 C ATOM 841 CE1 TYR A 59 27.314 19.004 35.538 1.00 0.00 C ATOM 842 CE2 TYR A 59 25.552 17.657 36.528 1.00 0.00 C ATOM 843 CZ TYR A 59 26.411 18.770 36.595 1.00 0.00 C ATOM 844 OH TYR A 59 26.336 19.625 37.652 1.00 0.00 O ATOM 0 H TYR A 59 27.020 15.791 30.718 1.00 0.00 H new ATOM 0 HA TYR A 59 28.668 16.528 32.770 1.00 0.00 H new ATOM 0 HB2 TYR A 59 25.924 16.315 32.429 1.00 0.00 H new ATOM 0 HB3 TYR A 59 26.189 15.038 33.600 1.00 0.00 H new ATOM 0 HD1 TYR A 59 28.062 18.311 33.641 1.00 0.00 H new ATOM 0 HD2 TYR A 59 24.893 15.975 35.352 1.00 0.00 H new ATOM 0 HE1 TYR A 59 27.972 19.860 35.571 1.00 0.00 H new ATOM 0 HE2 TYR A 59 24.865 17.458 37.337 1.00 0.00 H new ATOM 0 HH TYR A 59 26.177 20.535 37.326 1.00 0.00 H new ATOM 854 N ASP A 60 28.008 13.289 32.710 1.00 0.00 N ATOM 855 CA ASP A 60 27.938 12.042 33.453 1.00 0.00 C ATOM 856 C ASP A 60 29.332 11.532 33.868 1.00 0.00 C ATOM 857 O ASP A 60 29.490 10.702 34.764 1.00 0.00 O ATOM 858 CB ASP A 60 27.247 11.019 32.566 1.00 0.00 C ATOM 859 CG ASP A 60 26.917 9.714 33.291 1.00 0.00 C ATOM 860 OD1 ASP A 60 26.124 9.736 34.263 1.00 0.00 O ATOM 861 OD2 ASP A 60 27.418 8.646 32.865 1.00 0.00 O ATOM 0 H ASP A 60 27.752 13.214 31.726 1.00 0.00 H new ATOM 0 HA ASP A 60 27.381 12.205 34.376 1.00 0.00 H new ATOM 0 HB2 ASP A 60 26.326 11.451 32.174 1.00 0.00 H new ATOM 0 HB3 ASP A 60 27.886 10.800 31.711 1.00 0.00 H new ATOM 866 N ALA A 61 30.343 12.072 33.191 1.00 0.00 N ATOM 867 CA ALA A 61 31.766 11.797 33.384 1.00 0.00 C ATOM 868 C ALA A 61 32.498 12.942 34.118 1.00 0.00 C ATOM 869 O ALA A 61 33.726 12.921 34.222 1.00 0.00 O ATOM 870 CB ALA A 61 32.364 11.490 32.004 1.00 0.00 C ATOM 0 H ALA A 61 30.182 12.753 32.449 1.00 0.00 H new ATOM 0 HA ALA A 61 31.896 10.936 34.040 1.00 0.00 H new ATOM 0 HB1 ALA A 61 33.428 11.279 32.107 1.00 0.00 H new ATOM 0 HB2 ALA A 61 31.862 10.623 31.575 1.00 0.00 H new ATOM 0 HB3 ALA A 61 32.227 12.350 31.348 1.00 0.00 H new ATOM 876 N LEU A 62 31.749 13.945 34.599 1.00 0.00 N ATOM 877 CA LEU A 62 32.282 15.208 35.143 1.00 0.00 C ATOM 878 C LEU A 62 31.975 15.447 36.641 1.00 0.00 C ATOM 879 O LEU A 62 30.965 14.943 37.147 1.00 0.00 O ATOM 880 CB LEU A 62 31.729 16.381 34.315 1.00 0.00 C ATOM 881 CG LEU A 62 32.280 16.507 32.885 1.00 0.00 C ATOM 882 CD1 LEU A 62 31.522 17.654 32.215 1.00 0.00 C ATOM 883 CD2 LEU A 62 33.771 16.847 32.838 1.00 0.00 C ATOM 0 H LEU A 62 30.730 13.902 34.622 1.00 0.00 H new ATOM 0 HA LEU A 62 33.367 15.137 35.071 1.00 0.00 H new ATOM 0 HB2 LEU A 62 30.645 16.283 34.259 1.00 0.00 H new ATOM 0 HB3 LEU A 62 31.938 17.308 34.848 1.00 0.00 H new ATOM 0 HG LEU A 62 32.150 15.546 32.387 1.00 0.00 H new ATOM 0 HD11 LEU A 62 31.882 17.780 31.194 1.00 0.00 H new ATOM 0 HD12 LEU A 62 30.456 17.425 32.199 1.00 0.00 H new ATOM 0 HD13 LEU A 62 31.687 18.575 32.774 1.00 0.00 H new ATOM 0 HD21 LEU A 62 34.095 16.921 31.800 1.00 0.00 H new ATOM 0 HD22 LEU A 62 33.943 17.799 33.341 1.00 0.00 H new ATOM 0 HD23 LEU A 62 34.339 16.064 33.340 1.00 0.00 H new ATOM 895 N PRO A 63 32.795 16.266 37.337 1.00 0.00 N ATOM 896 CA PRO A 63 32.596 16.708 38.724 1.00 0.00 C ATOM 897 C PRO A 63 31.840 18.047 38.869 1.00 0.00 C ATOM 898 O PRO A 63 31.650 18.795 37.904 1.00 0.00 O ATOM 899 CB PRO A 63 34.019 16.849 39.269 1.00 0.00 C ATOM 900 CG PRO A 63 34.772 17.408 38.063 1.00 0.00 C ATOM 901 CD PRO A 63 34.132 16.657 36.899 1.00 0.00 C ATOM 0 HA PRO A 63 31.971 15.994 39.260 1.00 0.00 H new ATOM 0 HB2 PRO A 63 34.062 17.523 40.124 1.00 0.00 H new ATOM 0 HB3 PRO A 63 34.427 15.892 39.596 1.00 0.00 H new ATOM 0 HG2 PRO A 63 34.645 18.487 37.969 1.00 0.00 H new ATOM 0 HG3 PRO A 63 35.843 17.218 38.129 1.00 0.00 H new ATOM 0 HD2 PRO A 63 34.080 17.289 36.013 1.00 0.00 H new ATOM 0 HD3 PRO A 63 34.723 15.781 36.631 1.00 0.00 H new ATOM 909 N GLU A 64 31.471 18.381 40.113 1.00 0.00 N ATOM 910 CA GLU A 64 30.812 19.632 40.543 1.00 0.00 C ATOM 911 C GLU A 64 31.750 20.593 41.322 1.00 0.00 C ATOM 912 O GLU A 64 32.723 20.134 41.934 1.00 0.00 O ATOM 913 CB GLU A 64 29.603 19.274 41.420 1.00 0.00 C ATOM 914 CG GLU A 64 28.432 18.712 40.608 1.00 0.00 C ATOM 915 CD GLU A 64 27.362 18.157 41.549 1.00 0.00 C ATOM 916 OE1 GLU A 64 26.500 18.936 42.017 1.00 0.00 O ATOM 917 OE2 GLU A 64 27.380 16.935 41.844 1.00 0.00 O ATOM 0 H GLU A 64 31.632 17.750 40.898 1.00 0.00 H new ATOM 0 HA GLU A 64 30.509 20.163 39.641 1.00 0.00 H new ATOM 0 HB2 GLU A 64 29.906 18.542 42.168 1.00 0.00 H new ATOM 0 HB3 GLU A 64 29.274 20.163 41.958 1.00 0.00 H new ATOM 0 HG2 GLU A 64 28.006 19.494 39.980 1.00 0.00 H new ATOM 0 HG3 GLU A 64 28.785 17.925 39.941 1.00 0.00 H new ATOM 924 N PRO A 65 31.473 21.914 41.359 1.00 0.00 N ATOM 925 CA PRO A 65 32.366 22.925 41.932 1.00 0.00 C ATOM 926 C PRO A 65 32.024 23.296 43.393 1.00 0.00 C ATOM 927 O PRO A 65 31.014 22.860 43.951 1.00 0.00 O ATOM 928 CB PRO A 65 32.208 24.112 40.984 1.00 0.00 C ATOM 929 CG PRO A 65 30.702 24.104 40.764 1.00 0.00 C ATOM 930 CD PRO A 65 30.374 22.611 40.688 1.00 0.00 C ATOM 0 HA PRO A 65 33.392 22.565 42.005 1.00 0.00 H new ATOM 0 HB2 PRO A 65 32.556 25.045 41.428 1.00 0.00 H new ATOM 0 HB3 PRO A 65 32.762 23.976 40.055 1.00 0.00 H new ATOM 0 HG2 PRO A 65 30.172 24.593 41.582 1.00 0.00 H new ATOM 0 HG3 PRO A 65 30.425 24.625 39.848 1.00 0.00 H new ATOM 0 HD2 PRO A 65 29.423 22.397 41.175 1.00 0.00 H new ATOM 0 HD3 PRO A 65 30.282 22.285 39.652 1.00 0.00 H new ATOM 938 N GLU A 66 32.874 24.115 44.020 1.00 0.00 N ATOM 939 CA GLU A 66 32.673 24.673 45.368 1.00 0.00 C ATOM 940 C GLU A 66 31.386 25.490 45.577 1.00 0.00 C ATOM 941 O GLU A 66 30.778 26.013 44.644 1.00 0.00 O ATOM 942 CB GLU A 66 33.875 25.558 45.758 1.00 0.00 C ATOM 943 CG GLU A 66 35.014 24.717 46.324 1.00 0.00 C ATOM 944 CD GLU A 66 35.964 25.539 47.202 1.00 0.00 C ATOM 945 OE1 GLU A 66 35.593 25.845 48.366 1.00 0.00 O ATOM 946 OE2 GLU A 66 37.077 25.886 46.731 1.00 0.00 O ATOM 0 H GLU A 66 33.749 24.420 43.593 1.00 0.00 H new ATOM 0 HA GLU A 66 32.577 23.794 46.006 1.00 0.00 H new ATOM 0 HB2 GLU A 66 34.224 26.108 44.884 1.00 0.00 H new ATOM 0 HB3 GLU A 66 33.563 26.297 46.496 1.00 0.00 H new ATOM 0 HG2 GLU A 66 34.600 23.896 46.910 1.00 0.00 H new ATOM 0 HG3 GLU A 66 35.576 24.271 45.503 1.00 0.00 H new ATOM 953 N ASP A 67 31.038 25.665 46.858 1.00 0.00 N ATOM 954 CA ASP A 67 29.864 26.391 47.362 1.00 0.00 C ATOM 955 C ASP A 67 29.873 27.908 47.071 1.00 0.00 C ATOM 956 O ASP A 67 28.839 28.573 47.175 1.00 0.00 O ATOM 957 CB ASP A 67 29.753 26.114 48.873 1.00 0.00 C ATOM 958 CG ASP A 67 28.311 26.131 49.371 1.00 0.00 C ATOM 959 OD1 ASP A 67 27.571 25.169 49.052 1.00 0.00 O ATOM 960 OD2 ASP A 67 27.906 27.090 50.070 1.00 0.00 O ATOM 0 H ASP A 67 31.602 25.281 47.616 1.00 0.00 H new ATOM 0 HA ASP A 67 28.990 26.023 46.825 1.00 0.00 H new ATOM 0 HB2 ASP A 67 30.198 25.144 49.094 1.00 0.00 H new ATOM 0 HB3 ASP A 67 30.330 26.861 49.418 1.00 0.00 H new ATOM 965 N ASP A 68 31.036 28.474 46.730 1.00 0.00 N ATOM 966 CA ASP A 68 31.186 29.839 46.212 1.00 0.00 C ATOM 967 C ASP A 68 30.952 29.894 44.699 1.00 0.00 C ATOM 968 O ASP A 68 30.412 30.886 44.218 1.00 0.00 O ATOM 969 CB ASP A 68 32.577 30.373 46.601 1.00 0.00 C ATOM 970 CG ASP A 68 32.810 31.850 46.257 1.00 0.00 C ATOM 971 OD1 ASP A 68 31.863 32.668 46.350 1.00 0.00 O ATOM 972 OD2 ASP A 68 33.965 32.235 45.951 1.00 0.00 O ATOM 0 H ASP A 68 31.925 27.981 46.809 1.00 0.00 H new ATOM 0 HA ASP A 68 30.427 30.480 46.660 1.00 0.00 H new ATOM 0 HB2 ASP A 68 32.718 30.236 47.673 1.00 0.00 H new ATOM 0 HB3 ASP A 68 33.336 29.772 46.100 1.00 0.00 H new ATOM 977 N GLU A 69 31.280 28.829 43.960 1.00 0.00 N ATOM 978 CA GLU A 69 31.109 28.788 42.499 1.00 0.00 C ATOM 979 C GLU A 69 29.675 28.392 42.078 1.00 0.00 C ATOM 980 O GLU A 69 29.047 29.116 41.311 1.00 0.00 O ATOM 981 CB GLU A 69 32.137 27.809 41.917 1.00 0.00 C ATOM 982 CG GLU A 69 33.446 28.466 41.467 1.00 0.00 C ATOM 983 CD GLU A 69 34.317 28.967 42.623 1.00 0.00 C ATOM 984 OE1 GLU A 69 34.683 28.153 43.501 1.00 0.00 O ATOM 985 OE2 GLU A 69 34.728 30.153 42.612 1.00 0.00 O ATOM 0 H GLU A 69 31.670 27.973 44.353 1.00 0.00 H new ATOM 0 HA GLU A 69 31.272 29.791 42.104 1.00 0.00 H new ATOM 0 HB2 GLU A 69 32.363 27.050 42.666 1.00 0.00 H new ATOM 0 HB3 GLU A 69 31.691 27.294 41.066 1.00 0.00 H new ATOM 0 HG2 GLU A 69 34.018 27.749 40.878 1.00 0.00 H new ATOM 0 HG3 GLU A 69 33.214 29.304 40.810 1.00 0.00 H new ATOM 992 N ASN A 70 29.107 27.285 42.584 1.00 0.00 N ATOM 993 CA ASN A 70 27.747 26.834 42.208 1.00 0.00 C ATOM 994 C ASN A 70 26.609 27.773 42.652 1.00 0.00 C ATOM 995 O ASN A 70 25.518 27.735 42.074 1.00 0.00 O ATOM 996 CB ASN A 70 27.512 25.378 42.657 1.00 0.00 C ATOM 997 CG ASN A 70 27.652 25.122 44.145 1.00 0.00 C ATOM 998 OD1 ASN A 70 27.443 25.989 44.980 1.00 0.00 O ATOM 999 ND2 ASN A 70 27.958 23.910 44.530 1.00 0.00 N ATOM 0 H ASN A 70 29.569 26.678 43.261 1.00 0.00 H new ATOM 0 HA ASN A 70 27.712 26.874 41.119 1.00 0.00 H new ATOM 0 HB2 ASN A 70 26.511 25.078 42.347 1.00 0.00 H new ATOM 0 HB3 ASN A 70 28.215 24.735 42.128 1.00 0.00 H new ATOM 0 HD21 ASN A 70 28.021 23.691 45.524 1.00 0.00 H new ATOM 0 HD22 ASN A 70 28.133 23.183 43.836 1.00 0.00 H new ATOM 1006 N ASP A 71 26.866 28.647 43.622 1.00 0.00 N ATOM 1007 CA ASP A 71 25.928 29.696 44.032 1.00 0.00 C ATOM 1008 C ASP A 71 25.834 30.816 43.000 1.00 0.00 C ATOM 1009 O ASP A 71 24.775 31.414 42.877 1.00 0.00 O ATOM 1010 CB ASP A 71 26.358 30.312 45.362 1.00 0.00 C ATOM 1011 CG ASP A 71 25.253 31.166 45.988 1.00 0.00 C ATOM 1012 OD1 ASP A 71 24.191 30.614 46.369 1.00 0.00 O ATOM 1013 OD2 ASP A 71 25.484 32.388 46.158 1.00 0.00 O ATOM 0 H ASP A 71 27.738 28.649 44.152 1.00 0.00 H new ATOM 0 HA ASP A 71 24.953 29.218 44.129 1.00 0.00 H new ATOM 0 HB2 ASP A 71 26.638 29.518 46.055 1.00 0.00 H new ATOM 0 HB3 ASP A 71 27.245 30.926 45.206 1.00 0.00 H new ATOM 1018 N MET A 72 26.904 31.078 42.234 1.00 0.00 N ATOM 1019 CA MET A 72 26.911 32.099 41.176 1.00 0.00 C ATOM 1020 C MET A 72 25.825 31.815 40.128 1.00 0.00 C ATOM 1021 O MET A 72 25.274 32.746 39.541 1.00 0.00 O ATOM 1022 CB MET A 72 28.288 32.158 40.485 1.00 0.00 C ATOM 1023 CG MET A 72 29.441 32.426 41.461 1.00 0.00 C ATOM 1024 SD MET A 72 29.430 34.065 42.233 1.00 0.00 S ATOM 1025 CE MET A 72 30.232 35.028 40.923 1.00 0.00 C ATOM 0 H MET A 72 27.792 30.586 42.332 1.00 0.00 H new ATOM 0 HA MET A 72 26.704 33.060 41.646 1.00 0.00 H new ATOM 0 HB2 MET A 72 28.469 31.215 39.968 1.00 0.00 H new ATOM 0 HB3 MET A 72 28.274 32.940 39.726 1.00 0.00 H new ATOM 0 HG2 MET A 72 29.414 31.671 42.247 1.00 0.00 H new ATOM 0 HG3 MET A 72 30.384 32.298 40.929 1.00 0.00 H new ATOM 0 HE1 MET A 72 30.308 36.070 41.232 1.00 0.00 H new ATOM 0 HE2 MET A 72 31.230 34.630 40.738 1.00 0.00 H new ATOM 0 HE3 MET A 72 29.641 34.963 40.010 1.00 0.00 H new ATOM 1035 N LEU A 73 25.529 30.525 39.952 1.00 0.00 N ATOM 1036 CA LEU A 73 24.628 29.919 38.979 1.00 0.00 C ATOM 1037 C LEU A 73 23.178 29.968 39.479 1.00 0.00 C ATOM 1038 O LEU A 73 22.296 30.438 38.769 1.00 0.00 O ATOM 1039 CB LEU A 73 25.097 28.464 38.731 1.00 0.00 C ATOM 1040 CG LEU A 73 26.617 28.218 38.691 1.00 0.00 C ATOM 1041 CD1 LEU A 73 26.883 26.735 38.420 1.00 0.00 C ATOM 1042 CD2 LEU A 73 27.320 29.068 37.634 1.00 0.00 C ATOM 0 H LEU A 73 25.957 29.814 40.546 1.00 0.00 H new ATOM 0 HA LEU A 73 24.655 30.473 38.041 1.00 0.00 H new ATOM 0 HB2 LEU A 73 24.672 27.833 39.512 1.00 0.00 H new ATOM 0 HB3 LEU A 73 24.674 28.128 37.784 1.00 0.00 H new ATOM 0 HG LEU A 73 27.023 28.508 39.660 1.00 0.00 H new ATOM 0 HD11 LEU A 73 27.958 26.558 38.391 1.00 0.00 H new ATOM 0 HD12 LEU A 73 26.437 26.135 39.213 1.00 0.00 H new ATOM 0 HD13 LEU A 73 26.443 26.455 37.463 1.00 0.00 H new ATOM 0 HD21 LEU A 73 28.389 28.856 37.648 1.00 0.00 H new ATOM 0 HD22 LEU A 73 26.916 28.832 36.650 1.00 0.00 H new ATOM 0 HD23 LEU A 73 27.157 30.124 37.849 1.00 0.00 H new ATOM 1054 N ASP A 74 22.947 29.534 40.728 1.00 0.00 N ATOM 1055 CA ASP A 74 21.649 29.538 41.433 1.00 0.00 C ATOM 1056 C ASP A 74 20.848 30.845 41.304 1.00 0.00 C ATOM 1057 O ASP A 74 19.618 30.812 41.351 1.00 0.00 O ATOM 1058 CB ASP A 74 21.922 29.288 42.926 1.00 0.00 C ATOM 1059 CG ASP A 74 20.645 29.107 43.754 1.00 0.00 C ATOM 1060 OD1 ASP A 74 20.059 27.994 43.725 1.00 0.00 O ATOM 1061 OD2 ASP A 74 20.250 30.049 44.488 1.00 0.00 O ATOM 0 H ASP A 74 23.696 29.151 41.305 1.00 0.00 H new ATOM 0 HA ASP A 74 21.041 28.761 40.968 1.00 0.00 H new ATOM 0 HB2 ASP A 74 22.544 28.399 43.031 1.00 0.00 H new ATOM 0 HB3 ASP A 74 22.492 30.125 43.329 1.00 0.00 H new ATOM 1066 N LEU A 75 21.533 31.979 41.131 1.00 0.00 N ATOM 1067 CA LEU A 75 20.931 33.308 41.019 1.00 0.00 C ATOM 1068 C LEU A 75 20.222 33.552 39.670 1.00 0.00 C ATOM 1069 O LEU A 75 19.373 34.448 39.579 1.00 0.00 O ATOM 1070 CB LEU A 75 22.026 34.363 41.265 1.00 0.00 C ATOM 1071 CG LEU A 75 22.912 34.153 42.511 1.00 0.00 C ATOM 1072 CD1 LEU A 75 23.648 35.449 42.811 1.00 0.00 C ATOM 1073 CD2 LEU A 75 22.139 33.734 43.759 1.00 0.00 C ATOM 0 H LEU A 75 22.551 31.997 41.063 1.00 0.00 H new ATOM 0 HA LEU A 75 20.147 33.385 41.773 1.00 0.00 H new ATOM 0 HB2 LEU A 75 22.672 34.396 40.388 1.00 0.00 H new ATOM 0 HB3 LEU A 75 21.548 35.339 41.346 1.00 0.00 H new ATOM 0 HG LEU A 75 23.594 33.336 42.274 1.00 0.00 H new ATOM 0 HD11 LEU A 75 24.278 35.314 43.690 1.00 0.00 H new ATOM 0 HD12 LEU A 75 24.269 35.721 41.957 1.00 0.00 H new ATOM 0 HD13 LEU A 75 22.925 36.242 43.001 1.00 0.00 H new ATOM 0 HD21 LEU A 75 22.832 33.607 44.591 1.00 0.00 H new ATOM 0 HD22 LEU A 75 21.409 34.503 44.010 1.00 0.00 H new ATOM 0 HD23 LEU A 75 21.624 32.793 43.569 1.00 0.00 H new ATOM 1085 N ALA A 76 20.556 32.770 38.639 1.00 0.00 N ATOM 1086 CA ALA A 76 19.912 32.775 37.325 1.00 0.00 C ATOM 1087 C ALA A 76 18.597 31.973 37.312 1.00 0.00 C ATOM 1088 O ALA A 76 18.243 31.288 38.278 1.00 0.00 O ATOM 1089 CB ALA A 76 20.916 32.236 36.302 1.00 0.00 C ATOM 0 H ALA A 76 21.313 32.089 38.701 1.00 0.00 H new ATOM 0 HA ALA A 76 19.630 33.796 37.067 1.00 0.00 H new ATOM 0 HB1 ALA A 76 20.459 32.230 35.312 1.00 0.00 H new ATOM 0 HB2 ALA A 76 21.800 32.873 36.289 1.00 0.00 H new ATOM 0 HB3 ALA A 76 21.204 31.221 36.575 1.00 0.00 H new ATOM 1095 N TYR A 77 17.847 32.066 36.217 1.00 0.00 N ATOM 1096 CA TYR A 77 16.543 31.417 36.068 1.00 0.00 C ATOM 1097 C TYR A 77 16.622 29.896 35.956 1.00 0.00 C ATOM 1098 O TYR A 77 17.274 29.342 35.063 1.00 0.00 O ATOM 1099 CB TYR A 77 15.827 31.995 34.845 1.00 0.00 C ATOM 1100 CG TYR A 77 14.471 31.390 34.532 1.00 0.00 C ATOM 1101 CD1 TYR A 77 13.348 31.777 35.287 1.00 0.00 C ATOM 1102 CD2 TYR A 77 14.318 30.475 33.473 1.00 0.00 C ATOM 1103 CE1 TYR A 77 12.076 31.252 34.988 1.00 0.00 C ATOM 1104 CE2 TYR A 77 13.046 29.954 33.165 1.00 0.00 C ATOM 1105 CZ TYR A 77 11.918 30.341 33.923 1.00 0.00 C ATOM 1106 OH TYR A 77 10.681 29.862 33.622 1.00 0.00 O ATOM 0 H TYR A 77 18.130 32.601 35.396 1.00 0.00 H new ATOM 0 HA TYR A 77 15.982 31.624 36.979 1.00 0.00 H new ATOM 0 HB2 TYR A 77 15.701 33.067 34.993 1.00 0.00 H new ATOM 0 HB3 TYR A 77 16.471 31.867 33.975 1.00 0.00 H new ATOM 0 HD1 TYR A 77 13.462 32.480 36.099 1.00 0.00 H new ATOM 0 HD2 TYR A 77 15.178 30.172 32.895 1.00 0.00 H new ATOM 0 HE1 TYR A 77 11.219 31.548 35.576 1.00 0.00 H new ATOM 0 HE2 TYR A 77 12.933 29.257 32.348 1.00 0.00 H new ATOM 0 HH TYR A 77 10.745 29.246 32.862 1.00 0.00 H new ATOM 1116 N GLY A 78 15.847 29.225 36.809 1.00 0.00 N ATOM 1117 CA GLY A 78 15.355 27.886 36.509 1.00 0.00 C ATOM 1118 C GLY A 78 16.425 26.792 36.459 1.00 0.00 C ATOM 1119 O GLY A 78 16.290 25.834 35.702 1.00 0.00 O ATOM 0 H GLY A 78 15.548 29.590 37.713 1.00 0.00 H new ATOM 0 HA2 GLY A 78 14.614 27.612 37.260 1.00 0.00 H new ATOM 0 HA3 GLY A 78 14.841 27.912 35.548 1.00 0.00 H new ATOM 1123 N LEU A 79 17.497 26.946 37.240 1.00 0.00 N ATOM 1124 CA LEU A 79 18.732 26.165 37.113 1.00 0.00 C ATOM 1125 C LEU A 79 18.532 24.637 37.120 1.00 0.00 C ATOM 1126 O LEU A 79 17.949 24.067 38.048 1.00 0.00 O ATOM 1127 CB LEU A 79 19.739 26.708 38.136 1.00 0.00 C ATOM 1128 CG LEU A 79 21.137 26.118 37.923 1.00 0.00 C ATOM 1129 CD1 LEU A 79 22.180 27.098 38.402 1.00 0.00 C ATOM 1130 CD2 LEU A 79 21.391 24.844 38.713 1.00 0.00 C ATOM 0 H LEU A 79 17.532 27.631 37.995 1.00 0.00 H new ATOM 0 HA LEU A 79 19.148 26.304 36.115 1.00 0.00 H new ATOM 0 HB2 LEU A 79 19.787 27.794 38.058 1.00 0.00 H new ATOM 0 HB3 LEU A 79 19.395 26.475 39.144 1.00 0.00 H new ATOM 0 HG LEU A 79 21.196 25.903 36.856 1.00 0.00 H new ATOM 0 HD11 LEU A 79 23.173 26.676 38.249 1.00 0.00 H new ATOM 0 HD12 LEU A 79 22.091 28.028 37.840 1.00 0.00 H new ATOM 0 HD13 LEU A 79 22.030 27.299 39.463 1.00 0.00 H new ATOM 0 HD21 LEU A 79 22.400 24.486 38.511 1.00 0.00 H new ATOM 0 HD22 LEU A 79 21.285 25.049 39.778 1.00 0.00 H new ATOM 0 HD23 LEU A 79 20.670 24.082 38.417 1.00 0.00 H new ATOM 1142 N THR A 80 19.037 23.981 36.067 1.00 0.00 N ATOM 1143 CA THR A 80 18.745 22.586 35.700 1.00 0.00 C ATOM 1144 C THR A 80 19.699 21.618 36.391 1.00 0.00 C ATOM 1145 O THR A 80 20.803 21.973 36.802 1.00 0.00 O ATOM 1146 CB THR A 80 18.847 22.350 34.176 1.00 0.00 C ATOM 1147 OG1 THR A 80 18.542 23.496 33.411 1.00 0.00 O ATOM 1148 CG2 THR A 80 17.924 21.245 33.656 1.00 0.00 C ATOM 0 H THR A 80 19.688 24.425 35.419 1.00 0.00 H new ATOM 0 HA THR A 80 17.721 22.402 36.026 1.00 0.00 H new ATOM 0 HB THR A 80 19.891 22.063 34.053 1.00 0.00 H new ATOM 0 HG1 THR A 80 18.312 23.228 32.497 1.00 0.00 H new ATOM 0 HG21 THR A 80 18.054 21.140 32.579 1.00 0.00 H new ATOM 0 HG22 THR A 80 18.172 20.303 34.145 1.00 0.00 H new ATOM 0 HG23 THR A 80 16.888 21.504 33.873 1.00 0.00 H new ATOM 1156 N GLU A 81 19.328 20.345 36.439 1.00 0.00 N ATOM 1157 CA GLU A 81 20.069 19.316 37.178 1.00 0.00 C ATOM 1158 C GLU A 81 21.440 18.968 36.559 1.00 0.00 C ATOM 1159 O GLU A 81 22.265 18.345 37.228 1.00 0.00 O ATOM 1160 CB GLU A 81 19.189 18.070 37.367 1.00 0.00 C ATOM 1161 CG GLU A 81 17.798 18.373 37.953 1.00 0.00 C ATOM 1162 CD GLU A 81 17.844 19.032 39.337 1.00 0.00 C ATOM 1163 OE1 GLU A 81 17.878 20.280 39.450 1.00 0.00 O ATOM 1164 OE2 GLU A 81 17.806 18.292 40.351 1.00 0.00 O ATOM 0 H GLU A 81 18.498 19.989 35.964 1.00 0.00 H new ATOM 0 HA GLU A 81 20.306 19.735 38.156 1.00 0.00 H new ATOM 0 HB2 GLU A 81 19.067 17.574 36.404 1.00 0.00 H new ATOM 0 HB3 GLU A 81 19.704 17.369 38.024 1.00 0.00 H new ATOM 0 HG2 GLU A 81 17.259 19.026 37.267 1.00 0.00 H new ATOM 0 HG3 GLU A 81 17.232 17.444 38.021 1.00 0.00 H new ATOM 1171 N THR A 82 21.724 19.430 35.333 1.00 0.00 N ATOM 1172 CA THR A 82 23.049 19.364 34.690 1.00 0.00 C ATOM 1173 C THR A 82 23.683 20.745 34.471 1.00 0.00 C ATOM 1174 O THR A 82 24.489 20.947 33.559 1.00 0.00 O ATOM 1175 CB THR A 82 23.055 18.534 33.408 1.00 0.00 C ATOM 1176 OG1 THR A 82 22.233 19.101 32.408 1.00 0.00 O ATOM 1177 CG2 THR A 82 22.568 17.104 33.578 1.00 0.00 C ATOM 0 H THR A 82 21.020 19.873 34.743 1.00 0.00 H new ATOM 0 HA THR A 82 23.681 18.838 35.406 1.00 0.00 H new ATOM 0 HB THR A 82 24.108 18.529 33.125 1.00 0.00 H new ATOM 0 HG1 THR A 82 22.713 19.106 31.554 1.00 0.00 H new ATOM 0 HG21 THR A 82 22.606 16.590 32.618 1.00 0.00 H new ATOM 0 HG22 THR A 82 23.206 16.585 34.293 1.00 0.00 H new ATOM 0 HG23 THR A 82 21.542 17.110 33.945 1.00 0.00 H new ATOM 1185 N SER A 83 23.303 21.748 35.265 1.00 0.00 N ATOM 1186 CA SER A 83 23.875 23.087 35.141 1.00 0.00 C ATOM 1187 C SER A 83 25.366 23.166 35.496 1.00 0.00 C ATOM 1188 O SER A 83 25.881 22.400 36.316 1.00 0.00 O ATOM 1189 CB SER A 83 23.071 24.102 35.929 1.00 0.00 C ATOM 1190 OG SER A 83 23.587 25.405 35.740 1.00 0.00 O ATOM 0 H SER A 83 22.602 21.657 36.000 1.00 0.00 H new ATOM 0 HA SER A 83 23.812 23.334 34.081 1.00 0.00 H new ATOM 0 HB2 SER A 83 22.028 24.070 35.615 1.00 0.00 H new ATOM 0 HB3 SER A 83 23.093 23.847 36.989 1.00 0.00 H new ATOM 0 HG SER A 83 23.818 25.532 34.796 1.00 0.00 H new ATOM 1196 N ARG A 84 26.061 24.092 34.832 1.00 0.00 N ATOM 1197 CA ARG A 84 27.510 24.244 34.697 1.00 0.00 C ATOM 1198 C ARG A 84 27.937 25.714 34.626 1.00 0.00 C ATOM 1199 O ARG A 84 27.111 26.610 34.490 1.00 0.00 O ATOM 1200 CB ARG A 84 27.944 23.504 33.425 1.00 0.00 C ATOM 1201 CG ARG A 84 27.777 21.989 33.535 1.00 0.00 C ATOM 1202 CD ARG A 84 29.039 21.241 33.103 1.00 0.00 C ATOM 1203 NE ARG A 84 29.440 21.492 31.708 1.00 0.00 N ATOM 1204 CZ ARG A 84 30.655 21.282 31.240 1.00 0.00 C ATOM 1205 NH1 ARG A 84 31.628 20.867 31.983 1.00 0.00 N ATOM 1206 NH2 ARG A 84 30.957 21.470 29.997 1.00 0.00 N ATOM 0 H ARG A 84 25.572 24.829 34.324 1.00 0.00 H new ATOM 0 HA ARG A 84 27.993 23.824 35.579 1.00 0.00 H new ATOM 0 HB2 ARG A 84 27.359 23.869 32.581 1.00 0.00 H new ATOM 0 HB3 ARG A 84 28.988 23.735 33.214 1.00 0.00 H new ATOM 0 HG2 ARG A 84 27.533 21.725 34.564 1.00 0.00 H new ATOM 0 HG3 ARG A 84 26.937 21.671 32.917 1.00 0.00 H new ATOM 0 HD2 ARG A 84 29.860 21.524 33.762 1.00 0.00 H new ATOM 0 HD3 ARG A 84 28.878 20.171 33.236 1.00 0.00 H new ATOM 0 HE ARG A 84 28.735 21.850 31.064 1.00 0.00 H new ATOM 0 HH11 ARG A 84 31.472 20.688 32.975 1.00 0.00 H new ATOM 0 HH12 ARG A 84 32.552 20.718 31.577 1.00 0.00 H new ATOM 0 HH21 ARG A 84 30.244 21.791 29.342 1.00 0.00 H new ATOM 0 HH22 ARG A 84 31.908 21.297 29.671 1.00 0.00 H new ATOM 1220 N LEU A 85 29.251 25.922 34.690 1.00 0.00 N ATOM 1221 CA LEU A 85 29.921 27.209 34.881 1.00 0.00 C ATOM 1222 C LEU A 85 31.175 27.377 34.011 1.00 0.00 C ATOM 1223 O LEU A 85 31.694 26.416 33.448 1.00 0.00 O ATOM 1224 CB LEU A 85 30.218 27.393 36.379 1.00 0.00 C ATOM 1225 CG LEU A 85 31.311 26.528 37.036 1.00 0.00 C ATOM 1226 CD1 LEU A 85 31.397 26.939 38.500 1.00 0.00 C ATOM 1227 CD2 LEU A 85 31.035 25.019 37.033 1.00 0.00 C ATOM 0 H LEU A 85 29.916 25.153 34.605 1.00 0.00 H new ATOM 0 HA LEU A 85 29.250 27.999 34.545 1.00 0.00 H new ATOM 0 HB2 LEU A 85 30.487 28.438 36.535 1.00 0.00 H new ATOM 0 HB3 LEU A 85 29.289 27.218 36.922 1.00 0.00 H new ATOM 0 HG LEU A 85 32.218 26.694 36.455 1.00 0.00 H new ATOM 0 HD11 LEU A 85 32.163 26.346 39.000 1.00 0.00 H new ATOM 0 HD12 LEU A 85 31.655 27.996 38.567 1.00 0.00 H new ATOM 0 HD13 LEU A 85 30.434 26.769 38.983 1.00 0.00 H new ATOM 0 HD21 LEU A 85 31.861 24.497 37.517 1.00 0.00 H new ATOM 0 HD22 LEU A 85 30.111 24.817 37.575 1.00 0.00 H new ATOM 0 HD23 LEU A 85 30.937 24.669 36.005 1.00 0.00 H new ATOM 1239 N GLY A 86 31.660 28.609 33.889 1.00 0.00 N ATOM 1240 CA GLY A 86 32.814 29.015 33.087 1.00 0.00 C ATOM 1241 C GLY A 86 34.078 29.421 33.857 1.00 0.00 C ATOM 1242 O GLY A 86 34.986 29.970 33.231 1.00 0.00 O ATOM 0 H GLY A 86 31.234 29.398 34.375 1.00 0.00 H new ATOM 0 HA2 GLY A 86 33.071 28.192 32.420 1.00 0.00 H new ATOM 0 HA3 GLY A 86 32.514 29.854 32.459 1.00 0.00 H new ATOM 1246 N CYS A 87 34.155 29.148 35.163 1.00 0.00 N ATOM 1247 CA CYS A 87 35.307 29.401 36.041 1.00 0.00 C ATOM 1248 C CYS A 87 36.046 28.114 36.437 1.00 0.00 C ATOM 1249 O CYS A 87 37.266 28.022 36.285 1.00 0.00 O ATOM 1250 CB CYS A 87 34.778 30.089 37.302 1.00 0.00 C ATOM 1251 SG CYS A 87 33.009 29.885 37.593 1.00 0.00 S ATOM 0 H CYS A 87 33.376 28.722 35.665 1.00 0.00 H new ATOM 0 HA CYS A 87 36.025 30.022 35.504 1.00 0.00 H new ATOM 0 HB2 CYS A 87 35.320 29.702 38.164 1.00 0.00 H new ATOM 0 HB3 CYS A 87 35.000 31.154 37.238 1.00 0.00 H new ATOM 0 HG CYS A 87 32.674 30.506 38.685 1.00 0.00 H new ATOM 1256 N GLN A 88 35.303 27.119 36.932 1.00 0.00 N ATOM 1257 CA GLN A 88 35.869 25.885 37.486 1.00 0.00 C ATOM 1258 C GLN A 88 36.031 24.764 36.454 1.00 0.00 C ATOM 1259 O GLN A 88 37.084 24.124 36.425 1.00 0.00 O ATOM 1260 CB GLN A 88 35.005 25.444 38.676 1.00 0.00 C ATOM 1261 CG GLN A 88 35.589 24.270 39.483 1.00 0.00 C ATOM 1262 CD GLN A 88 35.229 22.868 38.982 1.00 0.00 C ATOM 1263 OE1 GLN A 88 34.322 22.651 38.191 1.00 0.00 O ATOM 1264 NE2 GLN A 88 35.893 21.851 39.474 1.00 0.00 N ATOM 0 H GLN A 88 34.284 27.148 36.960 1.00 0.00 H new ATOM 0 HA GLN A 88 36.885 26.099 37.819 1.00 0.00 H new ATOM 0 HB2 GLN A 88 34.865 26.294 39.343 1.00 0.00 H new ATOM 0 HB3 GLN A 88 34.018 25.162 38.309 1.00 0.00 H new ATOM 0 HG2 GLN A 88 36.675 24.364 39.490 1.00 0.00 H new ATOM 0 HG3 GLN A 88 35.254 24.363 40.516 1.00 0.00 H new ATOM 0 HE21 GLN A 88 36.653 22.010 40.135 1.00 0.00 H new ATOM 0 HE22 GLN A 88 35.650 20.900 39.196 1.00 0.00 H new ATOM 1273 N ILE A 89 35.007 24.502 35.625 1.00 0.00 N ATOM 1274 CA ILE A 89 34.991 23.303 34.777 1.00 0.00 C ATOM 1275 C ILE A 89 35.509 23.556 33.361 1.00 0.00 C ATOM 1276 O ILE A 89 35.088 24.475 32.652 1.00 0.00 O ATOM 1277 CB ILE A 89 33.641 22.553 34.809 1.00 0.00 C ATOM 1278 CG1 ILE A 89 33.790 21.091 34.330 1.00 0.00 C ATOM 1279 CG2 ILE A 89 32.569 23.270 33.972 1.00 0.00 C ATOM 1280 CD1 ILE A 89 34.851 20.268 35.071 1.00 0.00 C ATOM 0 H ILE A 89 34.187 25.100 35.526 1.00 0.00 H new ATOM 0 HA ILE A 89 35.712 22.621 35.228 1.00 0.00 H new ATOM 0 HB ILE A 89 33.316 22.546 35.849 1.00 0.00 H new ATOM 0 HG12 ILE A 89 32.827 20.591 34.434 1.00 0.00 H new ATOM 0 HG13 ILE A 89 34.033 21.096 33.268 1.00 0.00 H new ATOM 0 HG21 ILE A 89 31.635 22.710 34.021 1.00 0.00 H new ATOM 0 HG22 ILE A 89 32.411 24.274 34.366 1.00 0.00 H new ATOM 0 HG23 ILE A 89 32.900 23.334 32.935 1.00 0.00 H new ATOM 0 HD11 ILE A 89 34.879 19.258 34.662 1.00 0.00 H new ATOM 0 HD12 ILE A 89 35.827 20.737 34.947 1.00 0.00 H new ATOM 0 HD13 ILE A 89 34.602 20.224 36.131 1.00 0.00 H new ATOM 1292 N LYS A 90 36.422 22.683 32.950 1.00 0.00 N ATOM 1293 CA LYS A 90 37.237 22.794 31.754 1.00 0.00 C ATOM 1294 C LYS A 90 37.185 21.542 30.886 1.00 0.00 C ATOM 1295 O LYS A 90 36.493 20.573 31.204 1.00 0.00 O ATOM 1296 CB LYS A 90 38.664 23.193 32.176 1.00 0.00 C ATOM 1297 CG LYS A 90 39.263 22.465 33.393 1.00 0.00 C ATOM 1298 CD LYS A 90 39.595 20.986 33.120 1.00 0.00 C ATOM 1299 CE LYS A 90 40.726 20.445 34.009 1.00 0.00 C ATOM 1300 NZ LYS A 90 40.424 20.534 35.456 1.00 0.00 N ATOM 0 H LYS A 90 36.622 21.832 33.475 1.00 0.00 H new ATOM 0 HA LYS A 90 36.833 23.574 31.109 1.00 0.00 H new ATOM 0 HB2 LYS A 90 39.326 23.032 31.325 1.00 0.00 H new ATOM 0 HB3 LYS A 90 38.669 24.263 32.385 1.00 0.00 H new ATOM 0 HG2 LYS A 90 40.171 22.982 33.705 1.00 0.00 H new ATOM 0 HG3 LYS A 90 38.560 22.524 34.224 1.00 0.00 H new ATOM 0 HD2 LYS A 90 38.700 20.385 33.276 1.00 0.00 H new ATOM 0 HD3 LYS A 90 39.878 20.871 32.074 1.00 0.00 H new ATOM 0 HE2 LYS A 90 40.918 19.404 33.748 1.00 0.00 H new ATOM 0 HE3 LYS A 90 41.640 21.000 33.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 41.224 20.154 36.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 40.268 21.528 35.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 39.568 19.982 35.667 1.00 0.00 H new ATOM 1314 N MET A 91 37.879 21.595 29.757 1.00 0.00 N ATOM 1315 CA MET A 91 37.974 20.491 28.805 1.00 0.00 C ATOM 1316 C MET A 91 39.046 19.462 29.182 1.00 0.00 C ATOM 1317 O MET A 91 40.128 19.836 29.630 1.00 0.00 O ATOM 1318 CB MET A 91 38.174 21.063 27.398 1.00 0.00 C ATOM 1319 CG MET A 91 37.048 22.005 26.967 1.00 0.00 C ATOM 1320 SD MET A 91 35.388 21.624 27.615 1.00 0.00 S ATOM 1321 CE MET A 91 34.442 22.269 26.235 1.00 0.00 C ATOM 0 H MET A 91 38.403 22.422 29.470 1.00 0.00 H new ATOM 0 HA MET A 91 37.039 19.931 28.831 1.00 0.00 H new ATOM 0 HB2 MET A 91 39.122 21.599 27.362 1.00 0.00 H new ATOM 0 HB3 MET A 91 38.245 20.242 26.685 1.00 0.00 H new ATOM 0 HG2 MET A 91 37.312 23.017 27.274 1.00 0.00 H new ATOM 0 HG3 MET A 91 36.999 22.005 25.878 1.00 0.00 H new ATOM 0 HE1 MET A 91 33.402 22.398 26.535 1.00 0.00 H new ATOM 0 HE2 MET A 91 34.854 23.231 25.930 1.00 0.00 H new ATOM 0 HE3 MET A 91 34.494 21.570 25.400 1.00 0.00 H new ATOM 1331 N SER A 92 38.722 18.185 28.969 1.00 0.00 N ATOM 1332 CA SER A 92 39.502 16.976 29.277 1.00 0.00 C ATOM 1333 C SER A 92 39.215 15.874 28.240 1.00 0.00 C ATOM 1334 O SER A 92 38.341 16.034 27.387 1.00 0.00 O ATOM 1335 CB SER A 92 39.135 16.472 30.681 1.00 0.00 C ATOM 1336 OG SER A 92 37.846 15.881 30.681 1.00 0.00 O ATOM 0 H SER A 92 37.829 17.945 28.539 1.00 0.00 H new ATOM 0 HA SER A 92 40.563 17.222 29.242 1.00 0.00 H new ATOM 0 HB2 SER A 92 39.874 15.744 31.016 1.00 0.00 H new ATOM 0 HB3 SER A 92 39.160 17.301 31.388 1.00 0.00 H new ATOM 0 HG SER A 92 37.631 15.565 31.583 1.00 0.00 H new ATOM 1342 N LYS A 93 39.881 14.717 28.305 1.00 0.00 N ATOM 1343 CA LYS A 93 39.718 13.623 27.328 1.00 0.00 C ATOM 1344 C LYS A 93 38.308 13.029 27.211 1.00 0.00 C ATOM 1345 O LYS A 93 37.989 12.424 26.187 1.00 0.00 O ATOM 1346 CB LYS A 93 40.756 12.526 27.637 1.00 0.00 C ATOM 1347 CG LYS A 93 40.559 11.837 29.005 1.00 0.00 C ATOM 1348 CD LYS A 93 41.626 10.767 29.293 1.00 0.00 C ATOM 1349 CE LYS A 93 41.573 9.562 28.340 1.00 0.00 C ATOM 1350 NZ LYS A 93 40.392 8.696 28.576 1.00 0.00 N ATOM 0 H LYS A 93 40.555 14.506 29.041 1.00 0.00 H new ATOM 0 HA LYS A 93 39.886 14.069 26.348 1.00 0.00 H new ATOM 0 HB2 LYS A 93 40.714 11.770 26.853 1.00 0.00 H new ATOM 0 HB3 LYS A 93 41.753 12.965 27.604 1.00 0.00 H new ATOM 0 HG2 LYS A 93 40.584 12.590 29.793 1.00 0.00 H new ATOM 0 HG3 LYS A 93 39.572 11.376 29.036 1.00 0.00 H new ATOM 0 HD2 LYS A 93 42.613 11.225 29.229 1.00 0.00 H new ATOM 0 HD3 LYS A 93 41.505 10.414 30.317 1.00 0.00 H new ATOM 0 HE2 LYS A 93 41.556 9.919 27.310 1.00 0.00 H new ATOM 0 HE3 LYS A 93 42.481 8.971 28.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 40.406 7.900 27.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 40.418 8.331 29.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 39.522 9.249 28.437 1.00 0.00 H new ATOM 1364 N ASP A 94 37.457 13.232 28.220 1.00 0.00 N ATOM 1365 CA ASP A 94 36.067 12.756 28.226 1.00 0.00 C ATOM 1366 C ASP A 94 35.145 13.604 27.335 1.00 0.00 C ATOM 1367 O ASP A 94 34.076 13.150 26.925 1.00 0.00 O ATOM 1368 CB ASP A 94 35.525 12.744 29.669 1.00 0.00 C ATOM 1369 CG ASP A 94 36.060 11.576 30.497 1.00 0.00 C ATOM 1370 OD1 ASP A 94 35.941 10.414 30.036 1.00 0.00 O ATOM 1371 OD2 ASP A 94 36.604 11.805 31.606 1.00 0.00 O ATOM 0 H ASP A 94 37.715 13.738 29.067 1.00 0.00 H new ATOM 0 HA ASP A 94 36.073 11.746 27.816 1.00 0.00 H new ATOM 0 HB2 ASP A 94 35.790 13.681 30.159 1.00 0.00 H new ATOM 0 HB3 ASP A 94 34.436 12.695 29.642 1.00 0.00 H new ATOM 1376 N ILE A 95 35.545 14.838 27.022 1.00 0.00 N ATOM 1377 CA ILE A 95 34.667 15.855 26.432 1.00 0.00 C ATOM 1378 C ILE A 95 34.618 15.835 24.907 1.00 0.00 C ATOM 1379 O ILE A 95 33.983 16.715 24.343 1.00 0.00 O ATOM 1380 CB ILE A 95 35.070 17.265 26.907 1.00 0.00 C ATOM 1381 CG1 ILE A 95 36.333 17.769 26.163 1.00 0.00 C ATOM 1382 CG2 ILE A 95 35.215 17.350 28.438 1.00 0.00 C ATOM 1383 CD1 ILE A 95 36.064 18.948 25.234 1.00 0.00 C ATOM 0 H ILE A 95 36.499 15.165 27.172 1.00 0.00 H new ATOM 0 HA ILE A 95 33.666 15.603 26.782 1.00 0.00 H new ATOM 0 HB ILE A 95 34.254 17.939 26.647 1.00 0.00 H new ATOM 0 HG12 ILE A 95 37.085 18.059 26.897 1.00 0.00 H new ATOM 0 HG13 ILE A 95 36.754 16.948 25.582 1.00 0.00 H new ATOM 0 HG21 ILE A 95 35.500 18.363 28.721 1.00 0.00 H new ATOM 0 HG22 ILE A 95 34.265 17.096 28.908 1.00 0.00 H new ATOM 0 HG23 ILE A 95 35.983 16.651 28.770 1.00 0.00 H new ATOM 0 HD11 ILE A 95 36.992 19.247 24.747 1.00 0.00 H new ATOM 0 HD12 ILE A 95 35.336 18.656 24.477 1.00 0.00 H new ATOM 0 HD13 ILE A 95 35.672 19.785 25.812 1.00 0.00 H new ATOM 1395 N ASP A 96 35.344 14.949 24.225 1.00 0.00 N ATOM 1396 CA ASP A 96 35.565 15.019 22.775 1.00 0.00 C ATOM 1397 C ASP A 96 34.241 14.874 21.995 1.00 0.00 C ATOM 1398 O ASP A 96 33.831 13.780 21.602 1.00 0.00 O ATOM 1399 CB ASP A 96 36.644 13.999 22.395 1.00 0.00 C ATOM 1400 CG ASP A 96 36.875 13.896 20.883 1.00 0.00 C ATOM 1401 OD1 ASP A 96 37.257 14.911 20.254 1.00 0.00 O ATOM 1402 OD2 ASP A 96 36.645 12.797 20.324 1.00 0.00 O ATOM 0 H ASP A 96 35.802 14.152 24.667 1.00 0.00 H new ATOM 0 HA ASP A 96 35.936 16.003 22.489 1.00 0.00 H new ATOM 0 HB2 ASP A 96 37.580 14.273 22.881 1.00 0.00 H new ATOM 0 HB3 ASP A 96 36.360 13.020 22.780 1.00 0.00 H new ATOM 1407 N GLY A 97 33.582 16.021 21.815 1.00 0.00 N ATOM 1408 CA GLY A 97 32.256 16.198 21.177 1.00 0.00 C ATOM 1409 C GLY A 97 31.134 16.822 22.045 1.00 0.00 C ATOM 1410 O GLY A 97 29.963 16.791 21.657 1.00 0.00 O ATOM 0 H GLY A 97 33.975 16.910 22.126 1.00 0.00 H new ATOM 0 HA2 GLY A 97 32.386 16.822 20.293 1.00 0.00 H new ATOM 0 HA3 GLY A 97 31.914 15.223 20.831 1.00 0.00 H new ATOM 1414 N ILE A 98 31.474 17.373 23.215 1.00 0.00 N ATOM 1415 CA ILE A 98 30.588 17.966 24.234 1.00 0.00 C ATOM 1416 C ILE A 98 29.700 19.136 23.767 1.00 0.00 C ATOM 1417 O ILE A 98 30.104 19.960 22.944 1.00 0.00 O ATOM 1418 CB ILE A 98 31.471 18.375 25.441 1.00 0.00 C ATOM 1419 CG1 ILE A 98 30.697 18.732 26.726 1.00 0.00 C ATOM 1420 CG2 ILE A 98 32.490 19.470 25.066 1.00 0.00 C ATOM 1421 CD1 ILE A 98 30.538 20.222 27.036 1.00 0.00 C ATOM 0 H ILE A 98 32.452 17.422 23.501 1.00 0.00 H new ATOM 0 HA ILE A 98 29.857 17.202 24.499 1.00 0.00 H new ATOM 0 HB ILE A 98 32.021 17.468 25.693 1.00 0.00 H new ATOM 0 HG12 ILE A 98 29.703 18.289 26.660 1.00 0.00 H new ATOM 0 HG13 ILE A 98 31.200 18.260 27.570 1.00 0.00 H new ATOM 0 HG21 ILE A 98 33.087 19.726 25.941 1.00 0.00 H new ATOM 0 HG22 ILE A 98 33.144 19.103 24.275 1.00 0.00 H new ATOM 0 HG23 ILE A 98 31.960 20.356 24.717 1.00 0.00 H new ATOM 0 HD11 ILE A 98 29.977 20.343 27.963 1.00 0.00 H new ATOM 0 HD12 ILE A 98 31.522 20.678 27.145 1.00 0.00 H new ATOM 0 HD13 ILE A 98 30.001 20.708 26.221 1.00 0.00 H new ATOM 1433 N ARG A 99 28.520 19.266 24.393 1.00 0.00 N ATOM 1434 CA ARG A 99 27.623 20.436 24.324 1.00 0.00 C ATOM 1435 C ARG A 99 27.432 21.101 25.673 1.00 0.00 C ATOM 1436 O ARG A 99 27.445 20.441 26.716 1.00 0.00 O ATOM 1437 CB ARG A 99 26.199 19.998 23.926 1.00 0.00 C ATOM 1438 CG ARG A 99 25.376 21.019 23.118 1.00 0.00 C ATOM 1439 CD ARG A 99 23.865 20.798 23.293 1.00 0.00 C ATOM 1440 NE ARG A 99 23.426 19.561 22.629 1.00 0.00 N ATOM 1441 CZ ARG A 99 22.798 18.530 23.161 1.00 0.00 C ATOM 1442 NH1 ARG A 99 22.291 18.553 24.361 1.00 0.00 N ATOM 1443 NH2 ARG A 99 22.683 17.435 22.479 1.00 0.00 N ATOM 0 H ARG A 99 28.146 18.527 24.988 1.00 0.00 H new ATOM 0 HA ARG A 99 28.090 21.111 23.607 1.00 0.00 H new ATOM 0 HB2 ARG A 99 26.273 19.080 23.344 1.00 0.00 H new ATOM 0 HB3 ARG A 99 25.648 19.756 24.835 1.00 0.00 H new ATOM 0 HG2 ARG A 99 25.635 22.029 23.436 1.00 0.00 H new ATOM 0 HG3 ARG A 99 25.635 20.941 22.062 1.00 0.00 H new ATOM 0 HD2 ARG A 99 23.623 20.749 24.355 1.00 0.00 H new ATOM 0 HD3 ARG A 99 23.321 21.648 22.881 1.00 0.00 H new ATOM 0 HE ARG A 99 23.633 19.492 21.633 1.00 0.00 H new ATOM 0 HH11 ARG A 99 22.371 19.394 24.932 1.00 0.00 H new ATOM 0 HH12 ARG A 99 21.814 17.730 24.729 1.00 0.00 H new ATOM 0 HH21 ARG A 99 23.076 17.376 21.540 1.00 0.00 H new ATOM 0 HH22 ARG A 99 22.199 16.632 22.881 1.00 0.00 H new ATOM 1457 N VAL A 100 27.076 22.375 25.610 1.00 0.00 N ATOM 1458 CA VAL A 100 26.386 23.098 26.668 1.00 0.00 C ATOM 1459 C VAL A 100 25.350 24.088 26.103 1.00 0.00 C ATOM 1460 O VAL A 100 25.466 24.499 24.947 1.00 0.00 O ATOM 1461 CB VAL A 100 27.415 23.844 27.549 1.00 0.00 C ATOM 1462 CG1 VAL A 100 28.230 22.931 28.483 1.00 0.00 C ATOM 1463 CG2 VAL A 100 28.351 24.724 26.703 1.00 0.00 C ATOM 0 H VAL A 100 27.266 22.954 24.792 1.00 0.00 H new ATOM 0 HA VAL A 100 25.846 22.371 27.274 1.00 0.00 H new ATOM 0 HB VAL A 100 26.816 24.482 28.199 1.00 0.00 H new ATOM 0 HG11 VAL A 100 28.927 23.534 29.064 1.00 0.00 H new ATOM 0 HG12 VAL A 100 27.555 22.405 29.158 1.00 0.00 H new ATOM 0 HG13 VAL A 100 28.786 22.206 27.889 1.00 0.00 H new ATOM 0 HG21 VAL A 100 29.060 25.233 27.356 1.00 0.00 H new ATOM 0 HG22 VAL A 100 28.894 24.100 25.993 1.00 0.00 H new ATOM 0 HG23 VAL A 100 27.763 25.464 26.160 1.00 0.00 H new ATOM 1473 N ALA A 101 24.371 24.536 26.901 1.00 0.00 N ATOM 1474 CA ALA A 101 23.419 25.579 26.486 1.00 0.00 C ATOM 1475 C ALA A 101 23.549 26.873 27.303 1.00 0.00 C ATOM 1476 O ALA A 101 23.522 26.882 28.537 1.00 0.00 O ATOM 1477 CB ALA A 101 21.990 25.023 26.466 1.00 0.00 C ATOM 0 H ALA A 101 24.216 24.189 27.847 1.00 0.00 H new ATOM 0 HA ALA A 101 23.674 25.870 25.467 1.00 0.00 H new ATOM 0 HB1 ALA A 101 21.299 25.807 26.157 1.00 0.00 H new ATOM 0 HB2 ALA A 101 21.933 24.192 25.764 1.00 0.00 H new ATOM 0 HB3 ALA A 101 21.721 24.675 27.463 1.00 0.00 H new ATOM 1483 N LEU A 102 23.698 27.979 26.578 1.00 0.00 N ATOM 1484 CA LEU A 102 23.966 29.331 27.061 1.00 0.00 C ATOM 1485 C LEU A 102 22.660 30.161 26.880 1.00 0.00 C ATOM 1486 O LEU A 102 21.935 29.926 25.905 1.00 0.00 O ATOM 1487 CB LEU A 102 25.186 29.826 26.243 1.00 0.00 C ATOM 1488 CG LEU A 102 26.470 30.245 26.986 1.00 0.00 C ATOM 1489 CD1 LEU A 102 27.525 30.668 25.962 1.00 0.00 C ATOM 1490 CD2 LEU A 102 26.293 31.381 27.985 1.00 0.00 C ATOM 0 H LEU A 102 23.629 27.951 25.561 1.00 0.00 H new ATOM 0 HA LEU A 102 24.220 29.411 28.118 1.00 0.00 H new ATOM 0 HB2 LEU A 102 25.455 29.034 25.544 1.00 0.00 H new ATOM 0 HB3 LEU A 102 24.858 30.679 25.648 1.00 0.00 H new ATOM 0 HG LEU A 102 26.772 29.371 27.563 1.00 0.00 H new ATOM 0 HD11 LEU A 102 28.436 30.966 26.480 1.00 0.00 H new ATOM 0 HD12 LEU A 102 27.742 29.832 25.297 1.00 0.00 H new ATOM 0 HD13 LEU A 102 27.149 31.508 25.378 1.00 0.00 H new ATOM 0 HD21 LEU A 102 27.250 31.604 28.456 1.00 0.00 H new ATOM 0 HD22 LEU A 102 25.929 32.268 27.467 1.00 0.00 H new ATOM 0 HD23 LEU A 102 25.573 31.086 28.748 1.00 0.00 H new