USER MOD reduce.3.24.130724 H: found=0, std=0, add=571, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 572 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 6 LYS NZ :NH3+ 153:sc= 0.318 (180deg=-0.479) USER MOD Set 1.2: A 68 HIS : no HE2:sc= -1.82 K(o=-1.5,f=-4) USER MOD Set 2.1: A 22 THR OG1 : rot -178:sc= -4! USER MOD Set 2.2: A 25 ASN : amide:sc= -3.92! C(o=-7.9!,f=-8.2!) USER MOD Set 3.1: A 7 THR OG1 : rot 126:sc= -0.248 USER MOD Set 3.2: A 9 THR OG1 : rot 180:sc= 0.243 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -172:sc= -1.05! (180deg=-1.53!) USER MOD Single : A 2 GLN : amide:sc= -0.0385 K(o=-0.039,f=-1.4!) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 164:sc= -0.125 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 167:sc= -0.269 (180deg=-0.77) USER MOD Single : A 31 GLN : amide:sc= -1.02 K(o=-1,f=-2.5!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 41 GLN : amide:sc= -1.44 X(o=-1.4,f=-1.5) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=-0.01) USER MOD Single : A 55 THR OG1 : rot -117:sc= -0.375 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 180:sc= 0.792 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 29.463 29.592 3.924 1.00 0.00 N ATOM 2 CA MET A 1 28.557 30.319 2.991 1.00 0.00 C ATOM 3 C MET A 1 27.507 31.086 3.797 1.00 0.00 C ATOM 4 O MET A 1 26.487 30.548 4.178 1.00 0.00 O ATOM 5 CB MET A 1 27.860 29.315 2.072 1.00 0.00 C ATOM 6 CG MET A 1 26.977 30.062 1.071 1.00 0.00 C ATOM 7 SD MET A 1 26.253 28.881 -0.094 1.00 0.00 S ATOM 8 CE MET A 1 25.300 30.074 -1.063 1.00 0.00 C ATOM 0 H1 MET A 1 30.255 29.182 3.389 1.00 0.00 H new ATOM 0 H2 MET A 1 29.832 30.254 4.636 1.00 0.00 H new ATOM 0 H3 MET A 1 28.935 28.832 4.398 1.00 0.00 H new ATOM 0 HA MET A 1 29.138 31.019 2.390 1.00 0.00 H new ATOM 0 HB2 MET A 1 28.601 28.716 1.542 1.00 0.00 H new ATOM 0 HB3 MET A 1 27.256 28.626 2.662 1.00 0.00 H new ATOM 0 HG2 MET A 1 26.188 30.601 1.597 1.00 0.00 H new ATOM 0 HG3 MET A 1 27.566 30.805 0.533 1.00 0.00 H new ATOM 0 HE1 MET A 1 24.762 29.553 -1.855 1.00 0.00 H new ATOM 0 HE2 MET A 1 24.587 30.583 -0.414 1.00 0.00 H new ATOM 0 HE3 MET A 1 25.976 30.807 -1.504 1.00 0.00 H new ATOM 20 N GLN A 2 27.749 32.342 4.060 1.00 0.00 N ATOM 21 CA GLN A 2 26.766 33.142 4.843 1.00 0.00 C ATOM 22 C GLN A 2 26.401 32.389 6.123 1.00 0.00 C ATOM 23 O GLN A 2 25.243 32.168 6.418 1.00 0.00 O ATOM 24 CB GLN A 2 25.506 33.364 4.003 1.00 0.00 C ATOM 25 CG GLN A 2 25.828 34.302 2.839 1.00 0.00 C ATOM 26 CD GLN A 2 24.634 34.363 1.885 1.00 0.00 C ATOM 27 OE1 GLN A 2 23.889 33.410 1.765 1.00 0.00 O ATOM 28 NE2 GLN A 2 24.419 35.449 1.195 1.00 0.00 N ATOM 0 H GLN A 2 28.585 32.848 3.766 1.00 0.00 H new ATOM 0 HA GLN A 2 27.204 34.106 5.102 1.00 0.00 H new ATOM 0 HB2 GLN A 2 25.136 32.411 3.625 1.00 0.00 H new ATOM 0 HB3 GLN A 2 24.715 33.791 4.620 1.00 0.00 H new ATOM 0 HG2 GLN A 2 26.058 35.299 3.215 1.00 0.00 H new ATOM 0 HG3 GLN A 2 26.713 33.950 2.309 1.00 0.00 H new ATOM 0 HE21 GLN A 2 25.044 36.249 1.295 1.00 0.00 H new ATOM 0 HE22 GLN A 2 23.626 35.498 0.555 1.00 0.00 H new ATOM 37 N ILE A 3 27.382 31.991 6.887 1.00 0.00 N ATOM 38 CA ILE A 3 27.094 31.250 8.148 1.00 0.00 C ATOM 39 C ILE A 3 26.711 32.243 9.247 1.00 0.00 C ATOM 40 O ILE A 3 27.372 33.242 9.453 1.00 0.00 O ATOM 41 CB ILE A 3 28.335 30.467 8.573 1.00 0.00 C ATOM 42 CG1 ILE A 3 28.625 29.378 7.537 1.00 0.00 C ATOM 43 CG2 ILE A 3 28.091 29.820 9.938 1.00 0.00 C ATOM 44 CD1 ILE A 3 29.990 28.755 7.820 1.00 0.00 C ATOM 0 H ILE A 3 28.371 32.147 6.692 1.00 0.00 H new ATOM 0 HA ILE A 3 26.269 30.557 7.983 1.00 0.00 H new ATOM 0 HB ILE A 3 29.187 31.144 8.641 1.00 0.00 H new ATOM 0 HG12 ILE A 3 27.850 28.612 7.572 1.00 0.00 H new ATOM 0 HG13 ILE A 3 28.608 29.803 6.533 1.00 0.00 H new ATOM 0 HG21 ILE A 3 28.977 29.262 10.240 1.00 0.00 H new ATOM 0 HG22 ILE A 3 27.882 30.595 10.676 1.00 0.00 H new ATOM 0 HG23 ILE A 3 27.240 29.142 9.872 1.00 0.00 H new ATOM 0 HD11 ILE A 3 30.196 27.980 7.082 1.00 0.00 H new ATOM 0 HD12 ILE A 3 30.760 29.524 7.763 1.00 0.00 H new ATOM 0 HD13 ILE A 3 29.990 28.316 8.818 1.00 0.00 H new ATOM 56 N PHE A 4 25.644 31.978 9.948 1.00 0.00 N ATOM 57 CA PHE A 4 25.207 32.907 11.031 1.00 0.00 C ATOM 58 C PHE A 4 25.971 32.602 12.321 1.00 0.00 C ATOM 59 O PHE A 4 26.234 31.461 12.650 1.00 0.00 O ATOM 60 CB PHE A 4 23.702 32.732 11.273 1.00 0.00 C ATOM 61 CG PHE A 4 22.926 33.422 10.172 1.00 0.00 C ATOM 62 CD1 PHE A 4 22.770 32.797 8.928 1.00 0.00 C ATOM 63 CD2 PHE A 4 22.366 34.685 10.397 1.00 0.00 C ATOM 64 CE1 PHE A 4 22.052 33.437 7.911 1.00 0.00 C ATOM 65 CE2 PHE A 4 21.649 35.324 9.379 1.00 0.00 C ATOM 66 CZ PHE A 4 21.491 34.700 8.137 1.00 0.00 C ATOM 0 H PHE A 4 25.053 31.157 9.818 1.00 0.00 H new ATOM 0 HA PHE A 4 25.414 33.934 10.729 1.00 0.00 H new ATOM 0 HB2 PHE A 4 23.449 31.672 11.301 1.00 0.00 H new ATOM 0 HB3 PHE A 4 23.428 33.150 12.242 1.00 0.00 H new ATOM 0 HD1 PHE A 4 23.203 31.823 8.754 1.00 0.00 H new ATOM 0 HD2 PHE A 4 22.487 35.166 11.356 1.00 0.00 H new ATOM 0 HE1 PHE A 4 21.931 32.956 6.951 1.00 0.00 H new ATOM 0 HE2 PHE A 4 21.218 36.299 9.552 1.00 0.00 H new ATOM 0 HZ PHE A 4 20.936 35.192 7.352 1.00 0.00 H new ATOM 76 N VAL A 5 26.317 33.622 13.063 1.00 0.00 N ATOM 77 CA VAL A 5 27.052 33.420 14.350 1.00 0.00 C ATOM 78 C VAL A 5 26.534 34.425 15.380 1.00 0.00 C ATOM 79 O VAL A 5 26.850 35.597 15.328 1.00 0.00 O ATOM 80 CB VAL A 5 28.549 33.639 14.124 1.00 0.00 C ATOM 81 CG1 VAL A 5 29.300 33.429 15.440 1.00 0.00 C ATOM 82 CG2 VAL A 5 29.058 32.640 13.083 1.00 0.00 C ATOM 0 H VAL A 5 26.120 34.596 12.831 1.00 0.00 H new ATOM 0 HA VAL A 5 26.891 32.405 14.713 1.00 0.00 H new ATOM 0 HB VAL A 5 28.718 34.655 13.767 1.00 0.00 H new ATOM 0 HG11 VAL A 5 30.367 33.585 15.279 1.00 0.00 H new ATOM 0 HG12 VAL A 5 28.937 34.139 16.183 1.00 0.00 H new ATOM 0 HG13 VAL A 5 29.132 32.413 15.797 1.00 0.00 H new ATOM 0 HG21 VAL A 5 30.125 32.795 12.921 1.00 0.00 H new ATOM 0 HG22 VAL A 5 28.889 31.624 13.440 1.00 0.00 H new ATOM 0 HG23 VAL A 5 28.523 32.788 12.145 1.00 0.00 H new ATOM 92 N LYS A 6 25.732 33.981 16.314 1.00 0.00 N ATOM 93 CA LYS A 6 25.182 34.911 17.349 1.00 0.00 C ATOM 94 C LYS A 6 26.003 34.805 18.635 1.00 0.00 C ATOM 95 O LYS A 6 26.249 33.728 19.140 1.00 0.00 O ATOM 96 CB LYS A 6 23.731 34.527 17.647 1.00 0.00 C ATOM 97 CG LYS A 6 22.883 34.715 16.388 1.00 0.00 C ATOM 98 CD LYS A 6 21.431 34.336 16.690 1.00 0.00 C ATOM 99 CE LYS A 6 20.576 34.548 15.440 1.00 0.00 C ATOM 100 NZ LYS A 6 21.035 33.625 14.362 1.00 0.00 N ATOM 0 H LYS A 6 25.433 33.010 16.405 1.00 0.00 H new ATOM 0 HA LYS A 6 25.230 35.934 16.976 1.00 0.00 H new ATOM 0 HB2 LYS A 6 23.680 33.491 17.981 1.00 0.00 H new ATOM 0 HB3 LYS A 6 23.340 35.143 18.457 1.00 0.00 H new ATOM 0 HG2 LYS A 6 22.937 35.750 16.051 1.00 0.00 H new ATOM 0 HG3 LYS A 6 23.271 34.096 15.579 1.00 0.00 H new ATOM 0 HD2 LYS A 6 21.375 33.295 17.009 1.00 0.00 H new ATOM 0 HD3 LYS A 6 21.049 34.942 17.511 1.00 0.00 H new ATOM 0 HE2 LYS A 6 19.526 34.364 15.669 1.00 0.00 H new ATOM 0 HE3 LYS A 6 20.653 35.582 15.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 20.243 33.420 13.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 21.807 34.072 13.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 21.375 32.738 14.786 1.00 0.00 H new ATOM 114 N THR A 7 26.428 35.918 19.173 1.00 0.00 N ATOM 115 CA THR A 7 27.231 35.892 20.434 1.00 0.00 C ATOM 116 C THR A 7 26.297 36.085 21.631 1.00 0.00 C ATOM 117 O THR A 7 25.117 36.325 21.478 1.00 0.00 O ATOM 118 CB THR A 7 28.258 37.025 20.408 1.00 0.00 C ATOM 119 OG1 THR A 7 27.585 38.273 20.508 1.00 0.00 O ATOM 120 CG2 THR A 7 29.049 36.973 19.100 1.00 0.00 C ATOM 0 H THR A 7 26.253 36.848 18.793 1.00 0.00 H new ATOM 0 HA THR A 7 27.746 34.935 20.519 1.00 0.00 H new ATOM 0 HB THR A 7 28.944 36.912 21.247 1.00 0.00 H new ATOM 0 HG1 THR A 7 27.959 38.787 21.254 1.00 0.00 H new ATOM 0 HG21 THR A 7 29.780 37.781 19.084 1.00 0.00 H new ATOM 0 HG22 THR A 7 29.565 36.016 19.025 1.00 0.00 H new ATOM 0 HG23 THR A 7 28.367 37.085 18.257 1.00 0.00 H new ATOM 128 N LEU A 8 26.817 35.985 22.826 1.00 0.00 N ATOM 129 CA LEU A 8 25.957 36.167 24.029 1.00 0.00 C ATOM 130 C LEU A 8 25.511 37.628 24.118 1.00 0.00 C ATOM 131 O LEU A 8 24.428 37.929 24.583 1.00 0.00 O ATOM 132 CB LEU A 8 26.750 35.803 25.289 1.00 0.00 C ATOM 133 CG LEU A 8 27.287 34.372 25.177 1.00 0.00 C ATOM 134 CD1 LEU A 8 28.153 34.065 26.403 1.00 0.00 C ATOM 135 CD2 LEU A 8 26.118 33.374 25.111 1.00 0.00 C ATOM 0 H LEU A 8 27.798 35.785 23.019 1.00 0.00 H new ATOM 0 HA LEU A 8 25.084 35.520 23.950 1.00 0.00 H new ATOM 0 HB2 LEU A 8 27.577 36.501 25.422 1.00 0.00 H new ATOM 0 HB3 LEU A 8 26.112 35.893 26.168 1.00 0.00 H new ATOM 0 HG LEU A 8 27.883 34.279 24.269 1.00 0.00 H new ATOM 0 HD11 LEU A 8 28.539 33.048 26.331 1.00 0.00 H new ATOM 0 HD12 LEU A 8 28.986 34.767 26.445 1.00 0.00 H new ATOM 0 HD13 LEU A 8 27.551 34.161 27.307 1.00 0.00 H new ATOM 0 HD21 LEU A 8 26.509 32.360 25.032 1.00 0.00 H new ATOM 0 HD22 LEU A 8 25.515 33.460 26.015 1.00 0.00 H new ATOM 0 HD23 LEU A 8 25.501 33.594 24.240 1.00 0.00 H new ATOM 147 N THR A 9 26.336 38.539 23.680 1.00 0.00 N ATOM 148 CA THR A 9 25.959 39.979 23.744 1.00 0.00 C ATOM 149 C THR A 9 25.011 40.314 22.589 1.00 0.00 C ATOM 150 O THR A 9 24.557 41.434 22.452 1.00 0.00 O ATOM 151 CB THR A 9 27.219 40.841 23.635 1.00 0.00 C ATOM 152 OG1 THR A 9 27.867 40.577 22.399 1.00 0.00 O ATOM 153 CG2 THR A 9 28.166 40.512 24.792 1.00 0.00 C ATOM 0 H THR A 9 27.255 38.348 23.281 1.00 0.00 H new ATOM 0 HA THR A 9 25.460 40.180 24.692 1.00 0.00 H new ATOM 0 HB THR A 9 26.944 41.895 23.682 1.00 0.00 H new ATOM 0 HG1 THR A 9 28.673 41.130 22.328 1.00 0.00 H new ATOM 0 HG21 THR A 9 29.063 41.126 24.714 1.00 0.00 H new ATOM 0 HG22 THR A 9 27.668 40.717 25.740 1.00 0.00 H new ATOM 0 HG23 THR A 9 28.442 39.459 24.748 1.00 0.00 H new ATOM 161 N GLY A 10 24.707 39.353 21.758 1.00 0.00 N ATOM 162 CA GLY A 10 23.787 39.612 20.609 1.00 0.00 C ATOM 163 C GLY A 10 24.603 40.039 19.387 1.00 0.00 C ATOM 164 O GLY A 10 24.121 40.026 18.273 1.00 0.00 O ATOM 0 H GLY A 10 25.056 38.397 21.824 1.00 0.00 H new ATOM 0 HA2 GLY A 10 23.212 38.714 20.380 1.00 0.00 H new ATOM 0 HA3 GLY A 10 23.071 40.391 20.871 1.00 0.00 H new ATOM 168 N LYS A 11 25.837 40.420 19.588 1.00 0.00 N ATOM 169 CA LYS A 11 26.681 40.847 18.435 1.00 0.00 C ATOM 170 C LYS A 11 26.553 39.822 17.306 1.00 0.00 C ATOM 171 O LYS A 11 26.856 38.657 17.473 1.00 0.00 O ATOM 172 CB LYS A 11 28.145 40.940 18.876 1.00 0.00 C ATOM 173 CG LYS A 11 28.995 41.485 17.726 1.00 0.00 C ATOM 174 CD LYS A 11 30.452 41.605 18.181 1.00 0.00 C ATOM 175 CE LYS A 11 31.302 42.151 17.032 1.00 0.00 C ATOM 176 NZ LYS A 11 32.718 42.273 17.478 1.00 0.00 N ATOM 0 H LYS A 11 26.295 40.454 20.499 1.00 0.00 H new ATOM 0 HA LYS A 11 26.347 41.823 18.083 1.00 0.00 H new ATOM 0 HB2 LYS A 11 28.232 41.591 19.746 1.00 0.00 H new ATOM 0 HB3 LYS A 11 28.508 39.957 19.176 1.00 0.00 H new ATOM 0 HG2 LYS A 11 28.926 40.823 16.863 1.00 0.00 H new ATOM 0 HG3 LYS A 11 28.620 42.459 17.412 1.00 0.00 H new ATOM 0 HD2 LYS A 11 30.521 42.266 19.045 1.00 0.00 H new ATOM 0 HD3 LYS A 11 30.828 40.631 18.494 1.00 0.00 H new ATOM 0 HE2 LYS A 11 31.237 41.487 16.170 1.00 0.00 H new ATOM 0 HE3 LYS A 11 30.924 43.123 16.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 33.297 42.644 16.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 32.772 42.922 18.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 33.075 41.338 17.760 1.00 0.00 H new ATOM 190 N THR A 12 26.098 40.244 16.156 1.00 0.00 N ATOM 191 CA THR A 12 25.938 39.295 15.013 1.00 0.00 C ATOM 192 C THR A 12 27.202 39.306 14.153 1.00 0.00 C ATOM 193 O THR A 12 27.792 40.339 13.909 1.00 0.00 O ATOM 194 CB THR A 12 24.741 39.722 14.160 1.00 0.00 C ATOM 195 OG1 THR A 12 23.561 39.678 14.948 1.00 0.00 O ATOM 196 CG2 THR A 12 24.598 38.773 12.968 1.00 0.00 C ATOM 0 H THR A 12 25.829 41.208 15.958 1.00 0.00 H new ATOM 0 HA THR A 12 25.772 38.290 15.400 1.00 0.00 H new ATOM 0 HB THR A 12 24.897 40.738 13.796 1.00 0.00 H new ATOM 0 HG1 THR A 12 22.794 39.953 14.404 1.00 0.00 H new ATOM 0 HG21 THR A 12 23.745 39.077 12.361 1.00 0.00 H new ATOM 0 HG22 THR A 12 25.505 38.808 12.364 1.00 0.00 H new ATOM 0 HG23 THR A 12 24.442 37.756 13.329 1.00 0.00 H new ATOM 204 N ILE A 13 27.610 38.160 13.676 1.00 0.00 N ATOM 205 CA ILE A 13 28.825 38.078 12.810 1.00 0.00 C ATOM 206 C ILE A 13 28.572 37.033 11.723 1.00 0.00 C ATOM 207 O ILE A 13 27.994 35.994 11.983 1.00 0.00 O ATOM 208 CB ILE A 13 30.039 37.661 13.649 1.00 0.00 C ATOM 209 CG1 ILE A 13 30.169 38.589 14.863 1.00 0.00 C ATOM 210 CG2 ILE A 13 31.308 37.762 12.798 1.00 0.00 C ATOM 211 CD1 ILE A 13 31.399 38.190 15.681 1.00 0.00 C ATOM 0 H ILE A 13 27.149 37.267 13.851 1.00 0.00 H new ATOM 0 HA ILE A 13 29.027 39.051 12.361 1.00 0.00 H new ATOM 0 HB ILE A 13 29.906 36.634 13.988 1.00 0.00 H new ATOM 0 HG12 ILE A 13 30.258 39.625 14.535 1.00 0.00 H new ATOM 0 HG13 ILE A 13 29.273 38.526 15.480 1.00 0.00 H new ATOM 0 HG21 ILE A 13 32.171 37.466 13.395 1.00 0.00 H new ATOM 0 HG22 ILE A 13 31.220 37.103 11.934 1.00 0.00 H new ATOM 0 HG23 ILE A 13 31.438 38.790 12.458 1.00 0.00 H new ATOM 0 HD11 ILE A 13 31.492 38.849 16.544 1.00 0.00 H new ATOM 0 HD12 ILE A 13 31.291 37.160 16.021 1.00 0.00 H new ATOM 0 HD13 ILE A 13 32.292 38.276 15.061 1.00 0.00 H new ATOM 223 N THR A 14 28.988 37.298 10.508 1.00 0.00 N ATOM 224 CA THR A 14 28.766 36.321 9.392 1.00 0.00 C ATOM 225 C THR A 14 30.108 35.955 8.757 1.00 0.00 C ATOM 226 O THR A 14 30.959 36.798 8.553 1.00 0.00 O ATOM 227 CB THR A 14 27.866 36.964 8.333 1.00 0.00 C ATOM 228 OG1 THR A 14 28.489 38.141 7.838 1.00 0.00 O ATOM 229 CG2 THR A 14 26.515 37.321 8.956 1.00 0.00 C ATOM 0 H THR A 14 29.474 38.153 10.239 1.00 0.00 H new ATOM 0 HA THR A 14 28.292 35.421 9.784 1.00 0.00 H new ATOM 0 HB THR A 14 27.710 36.263 7.513 1.00 0.00 H new ATOM 0 HG1 THR A 14 27.916 38.554 7.159 1.00 0.00 H new ATOM 0 HG21 THR A 14 25.876 37.779 8.201 1.00 0.00 H new ATOM 0 HG22 THR A 14 26.039 36.417 9.335 1.00 0.00 H new ATOM 0 HG23 THR A 14 26.667 38.022 9.776 1.00 0.00 H new ATOM 237 N LEU A 15 30.293 34.697 8.437 1.00 0.00 N ATOM 238 CA LEU A 15 31.571 34.243 7.803 1.00 0.00 C ATOM 239 C LEU A 15 31.235 33.485 6.517 1.00 0.00 C ATOM 240 O LEU A 15 30.609 32.444 6.548 1.00 0.00 O ATOM 241 CB LEU A 15 32.310 33.298 8.759 1.00 0.00 C ATOM 242 CG LEU A 15 32.452 33.951 10.140 1.00 0.00 C ATOM 243 CD1 LEU A 15 33.011 32.923 11.127 1.00 0.00 C ATOM 244 CD2 LEU A 15 33.408 35.148 10.058 1.00 0.00 C ATOM 0 H LEU A 15 29.606 33.958 8.590 1.00 0.00 H new ATOM 0 HA LEU A 15 32.202 35.105 7.583 1.00 0.00 H new ATOM 0 HB2 LEU A 15 31.765 32.358 8.847 1.00 0.00 H new ATOM 0 HB3 LEU A 15 33.295 33.059 8.358 1.00 0.00 H new ATOM 0 HG LEU A 15 31.475 34.297 10.477 1.00 0.00 H new ATOM 0 HD11 LEU A 15 33.114 33.382 12.110 1.00 0.00 H new ATOM 0 HD12 LEU A 15 32.331 32.074 11.192 1.00 0.00 H new ATOM 0 HD13 LEU A 15 33.987 32.581 10.782 1.00 0.00 H new ATOM 0 HD21 LEU A 15 33.503 35.606 11.043 1.00 0.00 H new ATOM 0 HD22 LEU A 15 34.387 34.809 9.719 1.00 0.00 H new ATOM 0 HD23 LEU A 15 33.014 35.881 9.354 1.00 0.00 H new ATOM 256 N GLU A 16 31.637 33.998 5.384 1.00 0.00 N ATOM 257 CA GLU A 16 31.330 33.301 4.099 1.00 0.00 C ATOM 258 C GLU A 16 32.468 32.339 3.750 1.00 0.00 C ATOM 259 O GLU A 16 33.566 32.750 3.434 1.00 0.00 O ATOM 260 CB GLU A 16 31.184 34.337 2.984 1.00 0.00 C ATOM 261 CG GLU A 16 30.061 35.314 3.338 1.00 0.00 C ATOM 262 CD GLU A 16 29.913 36.350 2.222 1.00 0.00 C ATOM 263 OE1 GLU A 16 29.658 35.948 1.098 1.00 0.00 O ATOM 264 OE2 GLU A 16 30.056 37.526 2.509 1.00 0.00 O ATOM 0 H GLU A 16 32.163 34.867 5.292 1.00 0.00 H new ATOM 0 HA GLU A 16 30.401 32.740 4.205 1.00 0.00 H new ATOM 0 HB2 GLU A 16 32.121 34.877 2.850 1.00 0.00 H new ATOM 0 HB3 GLU A 16 30.964 33.841 2.039 1.00 0.00 H new ATOM 0 HG2 GLU A 16 29.124 34.774 3.473 1.00 0.00 H new ATOM 0 HG3 GLU A 16 30.282 35.811 4.283 1.00 0.00 H new ATOM 271 N VAL A 17 32.209 31.062 3.803 1.00 0.00 N ATOM 272 CA VAL A 17 33.269 30.071 3.469 1.00 0.00 C ATOM 273 C VAL A 17 32.620 28.726 3.142 1.00 0.00 C ATOM 274 O VAL A 17 31.557 28.402 3.633 1.00 0.00 O ATOM 275 CB VAL A 17 34.217 29.908 4.660 1.00 0.00 C ATOM 276 CG1 VAL A 17 33.410 29.579 5.916 1.00 0.00 C ATOM 277 CG2 VAL A 17 35.205 28.774 4.377 1.00 0.00 C ATOM 0 H VAL A 17 31.308 30.662 4.064 1.00 0.00 H new ATOM 0 HA VAL A 17 33.835 30.422 2.606 1.00 0.00 H new ATOM 0 HB VAL A 17 34.765 30.837 4.814 1.00 0.00 H new ATOM 0 HG11 VAL A 17 34.086 29.463 6.763 1.00 0.00 H new ATOM 0 HG12 VAL A 17 32.708 30.388 6.120 1.00 0.00 H new ATOM 0 HG13 VAL A 17 32.859 28.651 5.762 1.00 0.00 H new ATOM 0 HG21 VAL A 17 35.879 28.659 5.226 1.00 0.00 H new ATOM 0 HG22 VAL A 17 34.657 27.845 4.220 1.00 0.00 H new ATOM 0 HG23 VAL A 17 35.783 29.010 3.483 1.00 0.00 H new ATOM 287 N GLU A 18 33.251 27.942 2.316 1.00 0.00 N ATOM 288 CA GLU A 18 32.680 26.623 1.951 1.00 0.00 C ATOM 289 C GLU A 18 32.241 25.882 3.235 1.00 0.00 C ATOM 290 O GLU A 18 33.052 25.647 4.109 1.00 0.00 O ATOM 291 CB GLU A 18 33.765 25.813 1.231 1.00 0.00 C ATOM 292 CG GLU A 18 35.130 26.098 1.861 1.00 0.00 C ATOM 293 CD GLU A 18 36.149 25.071 1.362 1.00 0.00 C ATOM 294 OE1 GLU A 18 35.733 24.110 0.736 1.00 0.00 O ATOM 295 OE2 GLU A 18 37.327 25.263 1.616 1.00 0.00 O ATOM 0 H GLU A 18 34.144 28.162 1.876 1.00 0.00 H new ATOM 0 HA GLU A 18 31.814 26.749 1.301 1.00 0.00 H new ATOM 0 HB2 GLU A 18 33.540 24.748 1.296 1.00 0.00 H new ATOM 0 HB3 GLU A 18 33.782 26.071 0.172 1.00 0.00 H new ATOM 0 HG2 GLU A 18 35.458 27.105 1.604 1.00 0.00 H new ATOM 0 HG3 GLU A 18 35.057 26.055 2.948 1.00 0.00 H new ATOM 302 N PRO A 19 30.981 25.508 3.365 1.00 0.00 N ATOM 303 CA PRO A 19 30.494 24.783 4.576 1.00 0.00 C ATOM 304 C PRO A 19 31.474 23.700 5.042 1.00 0.00 C ATOM 305 O PRO A 19 31.392 23.213 6.151 1.00 0.00 O ATOM 306 CB PRO A 19 29.175 24.160 4.108 1.00 0.00 C ATOM 307 CG PRO A 19 28.653 25.108 3.077 1.00 0.00 C ATOM 308 CD PRO A 19 29.884 25.725 2.397 1.00 0.00 C ATOM 0 HA PRO A 19 30.384 25.446 5.434 1.00 0.00 H new ATOM 0 HB2 PRO A 19 29.333 23.166 3.689 1.00 0.00 H new ATOM 0 HB3 PRO A 19 28.474 24.049 4.935 1.00 0.00 H new ATOM 0 HG2 PRO A 19 28.028 24.588 2.351 1.00 0.00 H new ATOM 0 HG3 PRO A 19 28.034 25.879 3.536 1.00 0.00 H new ATOM 0 HD2 PRO A 19 30.095 25.243 1.442 1.00 0.00 H new ATOM 0 HD3 PRO A 19 29.737 26.786 2.193 1.00 0.00 H new ATOM 316 N SER A 20 32.400 23.320 4.205 1.00 0.00 N ATOM 317 CA SER A 20 33.378 22.273 4.608 1.00 0.00 C ATOM 318 C SER A 20 34.404 22.886 5.564 1.00 0.00 C ATOM 319 O SER A 20 35.422 22.294 5.865 1.00 0.00 O ATOM 320 CB SER A 20 34.089 21.728 3.371 1.00 0.00 C ATOM 321 OG SER A 20 34.499 22.813 2.547 1.00 0.00 O ATOM 0 H SER A 20 32.521 23.689 3.262 1.00 0.00 H new ATOM 0 HA SER A 20 32.855 21.457 5.106 1.00 0.00 H new ATOM 0 HB2 SER A 20 34.954 21.134 3.667 1.00 0.00 H new ATOM 0 HB3 SER A 20 33.423 21.067 2.817 1.00 0.00 H new ATOM 0 HG SER A 20 35.161 22.498 1.897 1.00 0.00 H new ATOM 327 N ASP A 21 34.139 24.070 6.042 1.00 0.00 N ATOM 328 CA ASP A 21 35.090 24.727 6.977 1.00 0.00 C ATOM 329 C ASP A 21 35.449 23.747 8.099 1.00 0.00 C ATOM 330 O ASP A 21 34.858 22.696 8.230 1.00 0.00 O ATOM 331 CB ASP A 21 34.442 25.993 7.565 1.00 0.00 C ATOM 332 CG ASP A 21 32.920 25.828 7.607 1.00 0.00 C ATOM 333 OD1 ASP A 21 32.312 25.851 6.550 1.00 0.00 O ATOM 334 OD2 ASP A 21 32.390 25.680 8.696 1.00 0.00 O ATOM 0 H ASP A 21 33.302 24.611 5.824 1.00 0.00 H new ATOM 0 HA ASP A 21 35.997 25.011 6.444 1.00 0.00 H new ATOM 0 HB2 ASP A 21 34.825 26.175 8.569 1.00 0.00 H new ATOM 0 HB3 ASP A 21 34.706 26.861 6.961 1.00 0.00 H new ATOM 339 N THR A 22 36.418 24.095 8.906 1.00 0.00 N ATOM 340 CA THR A 22 36.843 23.199 10.034 1.00 0.00 C ATOM 341 C THR A 22 36.700 23.946 11.359 1.00 0.00 C ATOM 342 O THR A 22 36.859 25.148 11.430 1.00 0.00 O ATOM 343 CB THR A 22 38.305 22.790 9.839 1.00 0.00 C ATOM 344 OG1 THR A 22 39.148 23.889 10.150 1.00 0.00 O ATOM 345 CG2 THR A 22 38.532 22.365 8.387 1.00 0.00 C ATOM 0 H THR A 22 36.940 24.968 8.835 1.00 0.00 H new ATOM 0 HA THR A 22 36.214 22.309 10.046 1.00 0.00 H new ATOM 0 HB THR A 22 38.538 21.954 10.499 1.00 0.00 H new ATOM 0 HG1 THR A 22 40.083 23.638 9.996 1.00 0.00 H new ATOM 0 HG21 THR A 22 39.574 22.074 8.252 1.00 0.00 H new ATOM 0 HG22 THR A 22 37.886 21.520 8.150 1.00 0.00 H new ATOM 0 HG23 THR A 22 38.298 23.198 7.723 1.00 0.00 H new ATOM 353 N ILE A 23 36.399 23.239 12.414 1.00 0.00 N ATOM 354 CA ILE A 23 36.240 23.899 13.740 1.00 0.00 C ATOM 355 C ILE A 23 37.458 24.799 13.998 1.00 0.00 C ATOM 356 O ILE A 23 37.326 25.952 14.356 1.00 0.00 O ATOM 357 CB ILE A 23 36.127 22.812 14.826 1.00 0.00 C ATOM 358 CG1 ILE A 23 34.694 22.256 14.869 1.00 0.00 C ATOM 359 CG2 ILE A 23 36.467 23.395 16.207 1.00 0.00 C ATOM 360 CD1 ILE A 23 34.229 21.842 13.470 1.00 0.00 C ATOM 0 H ILE A 23 36.256 22.229 12.414 1.00 0.00 H new ATOM 0 HA ILE A 23 35.339 24.512 13.759 1.00 0.00 H new ATOM 0 HB ILE A 23 36.829 22.015 14.582 1.00 0.00 H new ATOM 0 HG12 ILE A 23 34.652 21.398 15.540 1.00 0.00 H new ATOM 0 HG13 ILE A 23 34.019 23.010 15.273 1.00 0.00 H new ATOM 0 HG21 ILE A 23 36.382 22.614 16.963 1.00 0.00 H new ATOM 0 HG22 ILE A 23 37.486 23.782 16.198 1.00 0.00 H new ATOM 0 HG23 ILE A 23 35.774 24.203 16.441 1.00 0.00 H new ATOM 0 HD11 ILE A 23 33.213 21.452 13.525 1.00 0.00 H new ATOM 0 HD12 ILE A 23 34.250 22.708 12.809 1.00 0.00 H new ATOM 0 HD13 ILE A 23 34.893 21.071 13.079 1.00 0.00 H new ATOM 372 N GLU A 24 38.636 24.274 13.822 1.00 0.00 N ATOM 373 CA GLU A 24 39.864 25.085 14.060 1.00 0.00 C ATOM 374 C GLU A 24 39.900 26.276 13.098 1.00 0.00 C ATOM 375 O GLU A 24 40.376 27.342 13.436 1.00 0.00 O ATOM 376 CB GLU A 24 41.098 24.212 13.828 1.00 0.00 C ATOM 377 CG GLU A 24 40.974 23.492 12.483 1.00 0.00 C ATOM 378 CD GLU A 24 42.210 22.621 12.254 1.00 0.00 C ATOM 379 OE1 GLU A 24 43.305 23.156 12.303 1.00 0.00 O ATOM 380 OE2 GLU A 24 42.041 21.433 12.036 1.00 0.00 O ATOM 0 H GLU A 24 38.804 23.314 13.522 1.00 0.00 H new ATOM 0 HA GLU A 24 39.857 25.453 15.086 1.00 0.00 H new ATOM 0 HB2 GLU A 24 41.998 24.827 13.841 1.00 0.00 H new ATOM 0 HB3 GLU A 24 41.197 23.484 14.633 1.00 0.00 H new ATOM 0 HG2 GLU A 24 40.075 22.876 12.470 1.00 0.00 H new ATOM 0 HG3 GLU A 24 40.874 24.219 11.677 1.00 0.00 H new ATOM 387 N ASN A 25 39.405 26.108 11.904 1.00 0.00 N ATOM 388 CA ASN A 25 39.414 27.223 10.932 1.00 0.00 C ATOM 389 C ASN A 25 38.415 28.289 11.381 1.00 0.00 C ATOM 390 O ASN A 25 38.705 29.466 11.370 1.00 0.00 O ATOM 391 CB ASN A 25 39.019 26.674 9.564 1.00 0.00 C ATOM 392 CG ASN A 25 40.209 25.950 8.929 1.00 0.00 C ATOM 393 OD1 ASN A 25 41.343 26.174 9.304 1.00 0.00 O ATOM 394 ND2 ASN A 25 39.997 25.084 7.975 1.00 0.00 N ATOM 0 H ASN A 25 38.993 25.239 11.563 1.00 0.00 H new ATOM 0 HA ASN A 25 40.405 27.672 10.873 1.00 0.00 H new ATOM 0 HB2 ASN A 25 38.178 25.988 9.667 1.00 0.00 H new ATOM 0 HB3 ASN A 25 38.690 27.487 8.917 1.00 0.00 H new ATOM 0 HD21 ASN A 25 40.783 24.596 7.545 1.00 0.00 H new ATOM 0 HD22 ASN A 25 39.045 24.895 7.660 1.00 0.00 H new ATOM 401 N VAL A 26 37.244 27.884 11.789 1.00 0.00 N ATOM 402 CA VAL A 26 36.238 28.878 12.254 1.00 0.00 C ATOM 403 C VAL A 26 36.826 29.634 13.440 1.00 0.00 C ATOM 404 O VAL A 26 37.019 30.833 13.400 1.00 0.00 O ATOM 405 CB VAL A 26 34.968 28.151 12.696 1.00 0.00 C ATOM 406 CG1 VAL A 26 33.920 29.171 13.134 1.00 0.00 C ATOM 407 CG2 VAL A 26 34.420 27.327 11.531 1.00 0.00 C ATOM 0 H VAL A 26 36.941 26.910 11.820 1.00 0.00 H new ATOM 0 HA VAL A 26 35.992 29.569 11.448 1.00 0.00 H new ATOM 0 HB VAL A 26 35.202 27.491 13.531 1.00 0.00 H new ATOM 0 HG11 VAL A 26 33.015 28.651 13.449 1.00 0.00 H new ATOM 0 HG12 VAL A 26 34.309 29.758 13.966 1.00 0.00 H new ATOM 0 HG13 VAL A 26 33.686 29.833 12.300 1.00 0.00 H new ATOM 0 HG21 VAL A 26 33.514 26.809 11.846 1.00 0.00 H new ATOM 0 HG22 VAL A 26 34.188 27.988 10.696 1.00 0.00 H new ATOM 0 HG23 VAL A 26 35.166 26.596 11.219 1.00 0.00 H new ATOM 417 N LYS A 27 37.113 28.928 14.498 1.00 0.00 N ATOM 418 CA LYS A 27 37.696 29.570 15.706 1.00 0.00 C ATOM 419 C LYS A 27 38.803 30.545 15.289 1.00 0.00 C ATOM 420 O LYS A 27 38.881 31.655 15.777 1.00 0.00 O ATOM 421 CB LYS A 27 38.288 28.483 16.603 1.00 0.00 C ATOM 422 CG LYS A 27 37.160 27.641 17.202 1.00 0.00 C ATOM 423 CD LYS A 27 37.731 26.714 18.278 1.00 0.00 C ATOM 424 CE LYS A 27 36.586 26.050 19.044 1.00 0.00 C ATOM 425 NZ LYS A 27 37.145 25.097 20.044 1.00 0.00 N ATOM 0 H LYS A 27 36.966 27.922 14.577 1.00 0.00 H new ATOM 0 HA LYS A 27 36.921 30.117 16.243 1.00 0.00 H new ATOM 0 HB2 LYS A 27 38.962 27.849 16.027 1.00 0.00 H new ATOM 0 HB3 LYS A 27 38.879 28.936 17.399 1.00 0.00 H new ATOM 0 HG2 LYS A 27 36.397 28.290 17.633 1.00 0.00 H new ATOM 0 HG3 LYS A 27 36.676 27.054 16.421 1.00 0.00 H new ATOM 0 HD2 LYS A 27 38.364 25.954 17.819 1.00 0.00 H new ATOM 0 HD3 LYS A 27 38.360 27.281 18.964 1.00 0.00 H new ATOM 0 HE2 LYS A 27 35.982 26.807 19.545 1.00 0.00 H new ATOM 0 HE3 LYS A 27 35.928 25.524 18.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 36.367 24.645 20.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 37.703 24.369 19.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 37.755 25.612 20.711 1.00 0.00 H new ATOM 439 N ALA A 28 39.655 30.140 14.389 1.00 0.00 N ATOM 440 CA ALA A 28 40.750 31.046 13.940 1.00 0.00 C ATOM 441 C ALA A 28 40.150 32.230 13.178 1.00 0.00 C ATOM 442 O ALA A 28 40.367 33.375 13.523 1.00 0.00 O ATOM 443 CB ALA A 28 41.697 30.272 13.021 1.00 0.00 C ATOM 0 H ALA A 28 39.641 29.222 13.945 1.00 0.00 H new ATOM 0 HA ALA A 28 41.301 31.415 14.805 1.00 0.00 H new ATOM 0 HB1 ALA A 28 42.500 30.930 12.689 1.00 0.00 H new ATOM 0 HB2 ALA A 28 42.121 29.427 13.564 1.00 0.00 H new ATOM 0 HB3 ALA A 28 41.146 29.907 12.154 1.00 0.00 H new ATOM 449 N LYS A 29 39.408 31.964 12.136 1.00 0.00 N ATOM 450 CA LYS A 29 38.803 33.073 11.342 1.00 0.00 C ATOM 451 C LYS A 29 38.203 34.124 12.278 1.00 0.00 C ATOM 452 O LYS A 29 38.284 35.309 12.024 1.00 0.00 O ATOM 453 CB LYS A 29 37.708 32.504 10.438 1.00 0.00 C ATOM 454 CG LYS A 29 38.354 31.767 9.250 1.00 0.00 C ATOM 455 CD LYS A 29 37.417 30.666 8.755 1.00 0.00 C ATOM 456 CE LYS A 29 38.008 29.997 7.507 1.00 0.00 C ATOM 457 NZ LYS A 29 39.497 30.035 7.566 1.00 0.00 N ATOM 0 H LYS A 29 39.194 31.025 11.800 1.00 0.00 H new ATOM 0 HA LYS A 29 39.575 33.544 10.734 1.00 0.00 H new ATOM 0 HB2 LYS A 29 37.074 31.820 11.003 1.00 0.00 H new ATOM 0 HB3 LYS A 29 37.067 33.307 10.076 1.00 0.00 H new ATOM 0 HG2 LYS A 29 38.563 32.470 8.444 1.00 0.00 H new ATOM 0 HG3 LYS A 29 39.309 31.337 9.552 1.00 0.00 H new ATOM 0 HD2 LYS A 29 37.268 29.924 9.539 1.00 0.00 H new ATOM 0 HD3 LYS A 29 36.438 31.087 8.524 1.00 0.00 H new ATOM 0 HE2 LYS A 29 37.665 28.965 7.440 1.00 0.00 H new ATOM 0 HE3 LYS A 29 37.658 30.508 6.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 39.889 29.398 6.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 39.827 31.005 7.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 39.815 29.729 8.508 1.00 0.00 H new ATOM 471 N ILE A 30 37.618 33.716 13.369 1.00 0.00 N ATOM 472 CA ILE A 30 37.038 34.705 14.311 1.00 0.00 C ATOM 473 C ILE A 30 38.173 35.339 15.123 1.00 0.00 C ATOM 474 O ILE A 30 38.181 36.525 15.383 1.00 0.00 O ATOM 475 CB ILE A 30 36.065 33.983 15.242 1.00 0.00 C ATOM 476 CG1 ILE A 30 34.849 33.520 14.435 1.00 0.00 C ATOM 477 CG2 ILE A 30 35.605 34.936 16.347 1.00 0.00 C ATOM 478 CD1 ILE A 30 33.999 32.574 15.285 1.00 0.00 C ATOM 0 H ILE A 30 37.518 32.740 13.647 1.00 0.00 H new ATOM 0 HA ILE A 30 36.506 35.486 13.768 1.00 0.00 H new ATOM 0 HB ILE A 30 36.562 33.123 15.691 1.00 0.00 H new ATOM 0 HG12 ILE A 30 34.255 34.381 14.127 1.00 0.00 H new ATOM 0 HG13 ILE A 30 35.174 33.015 13.526 1.00 0.00 H new ATOM 0 HG21 ILE A 30 34.911 34.418 17.009 1.00 0.00 H new ATOM 0 HG22 ILE A 30 36.469 35.274 16.919 1.00 0.00 H new ATOM 0 HG23 ILE A 30 35.107 35.797 15.901 1.00 0.00 H new ATOM 0 HD11 ILE A 30 33.134 32.245 14.709 1.00 0.00 H new ATOM 0 HD12 ILE A 30 34.595 31.707 15.571 1.00 0.00 H new ATOM 0 HD13 ILE A 30 33.662 33.094 16.181 1.00 0.00 H new ATOM 490 N GLN A 31 39.125 34.545 15.531 1.00 0.00 N ATOM 491 CA GLN A 31 40.259 35.070 16.332 1.00 0.00 C ATOM 492 C GLN A 31 40.870 36.298 15.650 1.00 0.00 C ATOM 493 O GLN A 31 41.049 37.331 16.261 1.00 0.00 O ATOM 494 CB GLN A 31 41.318 33.969 16.454 1.00 0.00 C ATOM 495 CG GLN A 31 42.512 34.483 17.256 1.00 0.00 C ATOM 496 CD GLN A 31 43.528 33.353 17.443 1.00 0.00 C ATOM 497 OE1 GLN A 31 43.323 32.253 16.971 1.00 0.00 O ATOM 498 NE2 GLN A 31 44.621 33.581 18.117 1.00 0.00 N ATOM 0 H GLN A 31 39.163 33.544 15.339 1.00 0.00 H new ATOM 0 HA GLN A 31 39.904 35.365 17.319 1.00 0.00 H new ATOM 0 HB2 GLN A 31 40.890 33.094 16.943 1.00 0.00 H new ATOM 0 HB3 GLN A 31 41.643 33.654 15.463 1.00 0.00 H new ATOM 0 HG2 GLN A 31 42.977 35.322 16.738 1.00 0.00 H new ATOM 0 HG3 GLN A 31 42.180 34.852 18.226 1.00 0.00 H new ATOM 0 HE21 GLN A 31 44.792 34.505 18.513 1.00 0.00 H new ATOM 0 HE22 GLN A 31 45.304 32.835 18.248 1.00 0.00 H new ATOM 507 N ASP A 32 41.215 36.190 14.396 1.00 0.00 N ATOM 508 CA ASP A 32 41.840 37.347 13.691 1.00 0.00 C ATOM 509 C ASP A 32 40.829 38.484 13.510 1.00 0.00 C ATOM 510 O ASP A 32 41.195 39.642 13.459 1.00 0.00 O ATOM 511 CB ASP A 32 42.335 36.893 12.316 1.00 0.00 C ATOM 512 CG ASP A 32 43.207 37.988 11.700 1.00 0.00 C ATOM 513 OD1 ASP A 32 42.662 38.834 11.010 1.00 0.00 O ATOM 514 OD2 ASP A 32 44.405 37.963 11.929 1.00 0.00 O ATOM 0 H ASP A 32 41.092 35.351 13.829 1.00 0.00 H new ATOM 0 HA ASP A 32 42.674 37.711 14.292 1.00 0.00 H new ATOM 0 HB2 ASP A 32 42.906 35.969 12.410 1.00 0.00 H new ATOM 0 HB3 ASP A 32 41.487 36.679 11.665 1.00 0.00 H new ATOM 519 N LYS A 33 39.567 38.176 13.403 1.00 0.00 N ATOM 520 CA LYS A 33 38.556 39.247 13.214 1.00 0.00 C ATOM 521 C LYS A 33 38.271 39.950 14.550 1.00 0.00 C ATOM 522 O LYS A 33 38.200 41.163 14.611 1.00 0.00 O ATOM 523 CB LYS A 33 37.278 38.605 12.671 1.00 0.00 C ATOM 524 CG LYS A 33 37.314 38.488 11.134 1.00 0.00 C ATOM 525 CD LYS A 33 38.702 38.065 10.613 1.00 0.00 C ATOM 526 CE LYS A 33 38.565 37.460 9.212 1.00 0.00 C ATOM 527 NZ LYS A 33 39.919 37.209 8.644 1.00 0.00 N ATOM 0 H LYS A 33 39.194 37.227 13.439 1.00 0.00 H new ATOM 0 HA LYS A 33 38.928 39.994 12.512 1.00 0.00 H new ATOM 0 HB2 LYS A 33 37.152 37.615 13.110 1.00 0.00 H new ATOM 0 HB3 LYS A 33 36.415 39.199 12.972 1.00 0.00 H new ATOM 0 HG2 LYS A 33 36.569 37.761 10.809 1.00 0.00 H new ATOM 0 HG3 LYS A 33 37.039 39.446 10.692 1.00 0.00 H new ATOM 0 HD2 LYS A 33 39.368 38.927 10.584 1.00 0.00 H new ATOM 0 HD3 LYS A 33 39.150 37.339 11.291 1.00 0.00 H new ATOM 0 HE2 LYS A 33 38.001 36.529 9.260 1.00 0.00 H new ATOM 0 HE3 LYS A 33 38.007 38.137 8.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 39.826 36.798 7.693 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 40.442 38.106 8.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 40.436 36.547 9.258 1.00 0.00 H new ATOM 541 N GLU A 34 38.093 39.209 15.615 1.00 0.00 N ATOM 542 CA GLU A 34 37.796 39.847 16.935 1.00 0.00 C ATOM 543 C GLU A 34 39.084 39.998 17.752 1.00 0.00 C ATOM 544 O GLU A 34 39.229 40.930 18.519 1.00 0.00 O ATOM 545 CB GLU A 34 36.806 38.974 17.709 1.00 0.00 C ATOM 546 CG GLU A 34 35.609 38.644 16.816 1.00 0.00 C ATOM 547 CD GLU A 34 34.631 37.754 17.585 1.00 0.00 C ATOM 548 OE1 GLU A 34 35.077 37.053 18.479 1.00 0.00 O ATOM 549 OE2 GLU A 34 33.454 37.787 17.267 1.00 0.00 O ATOM 0 H GLU A 34 38.140 38.190 15.628 1.00 0.00 H new ATOM 0 HA GLU A 34 37.366 40.834 16.763 1.00 0.00 H new ATOM 0 HB2 GLU A 34 37.293 38.055 18.036 1.00 0.00 H new ATOM 0 HB3 GLU A 34 36.471 39.494 18.607 1.00 0.00 H new ATOM 0 HG2 GLU A 34 35.112 39.562 16.501 1.00 0.00 H new ATOM 0 HG3 GLU A 34 35.945 38.137 15.911 1.00 0.00 H new ATOM 556 N GLY A 35 40.017 39.094 17.610 1.00 0.00 N ATOM 557 CA GLY A 35 41.283 39.199 18.398 1.00 0.00 C ATOM 558 C GLY A 35 41.094 38.509 19.751 1.00 0.00 C ATOM 559 O GLY A 35 41.837 38.731 20.685 1.00 0.00 O ATOM 0 H GLY A 35 39.959 38.290 16.985 1.00 0.00 H new ATOM 0 HA2 GLY A 35 42.105 38.735 17.852 1.00 0.00 H new ATOM 0 HA3 GLY A 35 41.548 40.246 18.544 1.00 0.00 H new ATOM 563 N ILE A 36 40.092 37.680 19.857 1.00 0.00 N ATOM 564 CA ILE A 36 39.815 36.967 21.129 1.00 0.00 C ATOM 565 C ILE A 36 40.407 35.544 21.063 1.00 0.00 C ATOM 566 O ILE A 36 39.910 34.710 20.335 1.00 0.00 O ATOM 567 CB ILE A 36 38.307 36.879 21.285 1.00 0.00 C ATOM 568 CG1 ILE A 36 37.721 38.284 21.155 1.00 0.00 C ATOM 569 CG2 ILE A 36 37.972 36.313 22.659 1.00 0.00 C ATOM 570 CD1 ILE A 36 36.212 38.214 21.329 1.00 0.00 C ATOM 0 H ILE A 36 39.444 37.465 19.100 1.00 0.00 H new ATOM 0 HA ILE A 36 40.262 37.495 21.971 1.00 0.00 H new ATOM 0 HB ILE A 36 37.888 36.228 20.518 1.00 0.00 H new ATOM 0 HG12 ILE A 36 38.156 38.943 21.906 1.00 0.00 H new ATOM 0 HG13 ILE A 36 37.968 38.705 20.180 1.00 0.00 H new ATOM 0 HG21 ILE A 36 36.890 36.249 22.772 1.00 0.00 H new ATOM 0 HG22 ILE A 36 38.406 35.318 22.759 1.00 0.00 H new ATOM 0 HG23 ILE A 36 38.380 36.966 23.431 1.00 0.00 H new ATOM 0 HD11 ILE A 36 35.788 39.214 21.237 1.00 0.00 H new ATOM 0 HD12 ILE A 36 35.787 37.568 20.561 1.00 0.00 H new ATOM 0 HD13 ILE A 36 35.978 37.810 22.314 1.00 0.00 H new ATOM 582 N PRO A 37 41.456 35.253 21.807 1.00 0.00 N ATOM 583 CA PRO A 37 42.083 33.895 21.794 1.00 0.00 C ATOM 584 C PRO A 37 41.034 32.759 21.896 1.00 0.00 C ATOM 585 O PRO A 37 40.296 32.694 22.859 1.00 0.00 O ATOM 586 CB PRO A 37 42.973 33.911 23.043 1.00 0.00 C ATOM 587 CG PRO A 37 43.365 35.342 23.207 1.00 0.00 C ATOM 588 CD PRO A 37 42.164 36.164 22.730 1.00 0.00 C ATOM 0 HA PRO A 37 42.621 33.702 20.866 1.00 0.00 H new ATOM 0 HB2 PRO A 37 42.436 33.544 23.918 1.00 0.00 H new ATOM 0 HB3 PRO A 37 43.847 33.273 22.915 1.00 0.00 H new ATOM 0 HG2 PRO A 37 43.603 35.565 24.247 1.00 0.00 H new ATOM 0 HG3 PRO A 37 44.254 35.573 22.620 1.00 0.00 H new ATOM 0 HD2 PRO A 37 41.528 36.463 23.563 1.00 0.00 H new ATOM 0 HD3 PRO A 37 42.480 37.078 22.226 1.00 0.00 H new ATOM 596 N PRO A 38 40.966 31.865 20.927 1.00 0.00 N ATOM 597 CA PRO A 38 39.994 30.728 20.947 1.00 0.00 C ATOM 598 C PRO A 38 39.851 30.074 22.325 1.00 0.00 C ATOM 599 O PRO A 38 38.769 29.699 22.733 1.00 0.00 O ATOM 600 CB PRO A 38 40.597 29.749 19.953 1.00 0.00 C ATOM 601 CG PRO A 38 41.208 30.631 18.928 1.00 0.00 C ATOM 602 CD PRO A 38 41.782 31.826 19.699 1.00 0.00 C ATOM 0 HA PRO A 38 38.984 31.057 20.701 1.00 0.00 H new ATOM 0 HB2 PRO A 38 41.340 29.105 20.424 1.00 0.00 H new ATOM 0 HB3 PRO A 38 39.838 29.097 19.521 1.00 0.00 H new ATOM 0 HG2 PRO A 38 41.990 30.108 18.377 1.00 0.00 H new ATOM 0 HG3 PRO A 38 40.466 30.955 18.198 1.00 0.00 H new ATOM 0 HD2 PRO A 38 42.840 31.689 19.924 1.00 0.00 H new ATOM 0 HD3 PRO A 38 41.695 32.751 19.129 1.00 0.00 H new ATOM 610 N ASP A 39 40.931 29.926 23.038 1.00 0.00 N ATOM 611 CA ASP A 39 40.856 29.284 24.381 1.00 0.00 C ATOM 612 C ASP A 39 39.830 30.018 25.242 1.00 0.00 C ATOM 613 O ASP A 39 39.198 29.438 26.102 1.00 0.00 O ATOM 614 CB ASP A 39 42.227 29.350 25.056 1.00 0.00 C ATOM 615 CG ASP A 39 43.182 28.372 24.369 1.00 0.00 C ATOM 616 OD1 ASP A 39 43.841 28.781 23.427 1.00 0.00 O ATOM 617 OD2 ASP A 39 43.237 27.231 24.797 1.00 0.00 O ATOM 0 H ASP A 39 41.864 30.222 22.750 1.00 0.00 H new ATOM 0 HA ASP A 39 40.556 28.242 24.268 1.00 0.00 H new ATOM 0 HB2 ASP A 39 42.624 30.363 24.998 1.00 0.00 H new ATOM 0 HB3 ASP A 39 42.136 29.103 26.114 1.00 0.00 H new ATOM 622 N GLN A 40 39.663 31.289 25.018 1.00 0.00 N ATOM 623 CA GLN A 40 38.684 32.070 25.820 1.00 0.00 C ATOM 624 C GLN A 40 37.300 31.991 25.173 1.00 0.00 C ATOM 625 O GLN A 40 36.364 32.625 25.623 1.00 0.00 O ATOM 626 CB GLN A 40 39.139 33.528 25.867 1.00 0.00 C ATOM 627 CG GLN A 40 40.512 33.612 26.533 1.00 0.00 C ATOM 628 CD GLN A 40 40.880 35.078 26.767 1.00 0.00 C ATOM 629 OE1 GLN A 40 40.497 35.942 26.003 1.00 0.00 O ATOM 630 NE2 GLN A 40 41.613 35.399 27.799 1.00 0.00 N ATOM 0 H GLN A 40 40.165 31.824 24.310 1.00 0.00 H new ATOM 0 HA GLN A 40 38.628 31.661 26.829 1.00 0.00 H new ATOM 0 HB2 GLN A 40 39.187 33.938 24.858 1.00 0.00 H new ATOM 0 HB3 GLN A 40 38.417 34.128 26.421 1.00 0.00 H new ATOM 0 HG2 GLN A 40 40.501 33.074 27.481 1.00 0.00 H new ATOM 0 HG3 GLN A 40 41.263 33.134 25.903 1.00 0.00 H new ATOM 0 HE21 GLN A 40 41.935 34.675 28.441 1.00 0.00 H new ATOM 0 HE22 GLN A 40 41.863 36.374 27.963 1.00 0.00 H new ATOM 639 N GLN A 41 37.159 31.228 24.115 1.00 0.00 N ATOM 640 CA GLN A 41 35.831 31.117 23.427 1.00 0.00 C ATOM 641 C GLN A 41 35.531 29.656 23.083 1.00 0.00 C ATOM 642 O GLN A 41 36.386 28.921 22.628 1.00 0.00 O ATOM 643 CB GLN A 41 35.864 31.938 22.136 1.00 0.00 C ATOM 644 CG GLN A 41 36.053 33.415 22.477 1.00 0.00 C ATOM 645 CD GLN A 41 35.858 34.259 21.216 1.00 0.00 C ATOM 646 OE1 GLN A 41 34.915 35.019 21.120 1.00 0.00 O ATOM 647 NE2 GLN A 41 36.714 34.156 20.238 1.00 0.00 N ATOM 0 H GLN A 41 37.908 30.676 23.697 1.00 0.00 H new ATOM 0 HA GLN A 41 35.054 31.493 24.093 1.00 0.00 H new ATOM 0 HB2 GLN A 41 36.676 31.595 21.495 1.00 0.00 H new ATOM 0 HB3 GLN A 41 34.937 31.798 21.579 1.00 0.00 H new ATOM 0 HG2 GLN A 41 35.339 33.717 23.243 1.00 0.00 H new ATOM 0 HG3 GLN A 41 37.049 33.580 22.887 1.00 0.00 H new ATOM 0 HE21 GLN A 41 37.506 33.518 20.318 1.00 0.00 H new ATOM 0 HE22 GLN A 41 36.592 34.713 19.393 1.00 0.00 H new ATOM 656 N ARG A 42 34.305 29.242 23.283 1.00 0.00 N ATOM 657 CA ARG A 42 33.896 27.842 22.958 1.00 0.00 C ATOM 658 C ARG A 42 32.597 27.908 22.166 1.00 0.00 C ATOM 659 O ARG A 42 31.666 28.591 22.546 1.00 0.00 O ATOM 660 CB ARG A 42 33.674 27.053 24.256 1.00 0.00 C ATOM 661 CG ARG A 42 35.008 26.873 25.004 1.00 0.00 C ATOM 662 CD ARG A 42 35.752 25.643 24.472 1.00 0.00 C ATOM 663 NE ARG A 42 37.033 25.479 25.215 1.00 0.00 N ATOM 664 CZ ARG A 42 37.966 24.695 24.744 1.00 0.00 C ATOM 665 NH1 ARG A 42 39.089 24.554 25.395 1.00 0.00 N ATOM 666 NH2 ARG A 42 37.776 24.056 23.624 1.00 0.00 N ATOM 0 H ARG A 42 33.559 29.824 23.664 1.00 0.00 H new ATOM 0 HA ARG A 42 34.671 27.343 22.377 1.00 0.00 H new ATOM 0 HB2 ARG A 42 32.960 27.578 24.891 1.00 0.00 H new ATOM 0 HB3 ARG A 42 33.242 26.078 24.028 1.00 0.00 H new ATOM 0 HG2 ARG A 42 35.626 27.762 24.880 1.00 0.00 H new ATOM 0 HG3 ARG A 42 34.822 26.761 26.072 1.00 0.00 H new ATOM 0 HD2 ARG A 42 35.135 24.752 24.589 1.00 0.00 H new ATOM 0 HD3 ARG A 42 35.949 25.757 23.406 1.00 0.00 H new ATOM 0 HE ARG A 42 37.182 25.979 26.092 1.00 0.00 H new ATOM 0 HH11 ARG A 42 39.237 25.056 26.271 1.00 0.00 H new ATOM 0 HH12 ARG A 42 39.818 23.942 25.028 1.00 0.00 H new ATOM 0 HH21 ARG A 42 36.899 24.168 23.115 1.00 0.00 H new ATOM 0 HH22 ARG A 42 38.504 23.444 23.256 1.00 0.00 H new ATOM 680 N LEU A 43 32.523 27.235 21.051 1.00 0.00 N ATOM 681 CA LEU A 43 31.285 27.301 20.226 1.00 0.00 C ATOM 682 C LEU A 43 30.288 26.227 20.663 1.00 0.00 C ATOM 683 O LEU A 43 30.652 25.126 21.025 1.00 0.00 O ATOM 684 CB LEU A 43 31.653 27.085 18.754 1.00 0.00 C ATOM 685 CG LEU A 43 32.259 28.365 18.170 1.00 0.00 C ATOM 686 CD1 LEU A 43 33.402 28.853 19.061 1.00 0.00 C ATOM 687 CD2 LEU A 43 32.800 28.065 16.775 1.00 0.00 C ATOM 0 H LEU A 43 33.265 26.644 20.676 1.00 0.00 H new ATOM 0 HA LEU A 43 30.823 28.279 20.359 1.00 0.00 H new ATOM 0 HB2 LEU A 43 32.364 26.263 18.666 1.00 0.00 H new ATOM 0 HB3 LEU A 43 30.766 26.802 18.187 1.00 0.00 H new ATOM 0 HG LEU A 43 31.493 29.138 18.116 1.00 0.00 H new ATOM 0 HD11 LEU A 43 33.828 29.763 18.640 1.00 0.00 H new ATOM 0 HD12 LEU A 43 33.021 29.060 20.061 1.00 0.00 H new ATOM 0 HD13 LEU A 43 34.173 28.084 19.118 1.00 0.00 H new ATOM 0 HD21 LEU A 43 33.234 28.970 16.350 1.00 0.00 H new ATOM 0 HD22 LEU A 43 33.566 27.292 16.840 1.00 0.00 H new ATOM 0 HD23 LEU A 43 31.988 27.718 16.137 1.00 0.00 H new ATOM 699 N ILE A 44 29.023 26.553 20.604 1.00 0.00 N ATOM 700 CA ILE A 44 27.945 25.587 20.988 1.00 0.00 C ATOM 701 C ILE A 44 26.957 25.478 19.826 1.00 0.00 C ATOM 702 O ILE A 44 26.583 26.471 19.230 1.00 0.00 O ATOM 703 CB ILE A 44 27.210 26.102 22.230 1.00 0.00 C ATOM 704 CG1 ILE A 44 28.181 26.185 23.425 1.00 0.00 C ATOM 705 CG2 ILE A 44 26.044 25.160 22.572 1.00 0.00 C ATOM 706 CD1 ILE A 44 28.829 24.819 23.714 1.00 0.00 C ATOM 0 H ILE A 44 28.683 27.465 20.300 1.00 0.00 H new ATOM 0 HA ILE A 44 28.380 24.612 21.208 1.00 0.00 H new ATOM 0 HB ILE A 44 26.819 27.098 22.022 1.00 0.00 H new ATOM 0 HG12 ILE A 44 28.957 26.921 23.215 1.00 0.00 H new ATOM 0 HG13 ILE A 44 27.645 26.530 24.309 1.00 0.00 H new ATOM 0 HG21 ILE A 44 25.524 25.530 23.456 1.00 0.00 H new ATOM 0 HG22 ILE A 44 25.350 25.121 21.733 1.00 0.00 H new ATOM 0 HG23 ILE A 44 26.430 24.160 22.770 1.00 0.00 H new ATOM 0 HD11 ILE A 44 29.508 24.910 24.562 1.00 0.00 H new ATOM 0 HD12 ILE A 44 28.053 24.090 23.948 1.00 0.00 H new ATOM 0 HD13 ILE A 44 29.386 24.488 22.837 1.00 0.00 H new ATOM 718 N PHE A 45 26.539 24.282 19.487 1.00 0.00 N ATOM 719 CA PHE A 45 25.581 24.100 18.353 1.00 0.00 C ATOM 720 C PHE A 45 24.409 23.222 18.799 1.00 0.00 C ATOM 721 O PHE A 45 24.537 22.024 18.948 1.00 0.00 O ATOM 722 CB PHE A 45 26.314 23.423 17.195 1.00 0.00 C ATOM 723 CG PHE A 45 25.341 23.147 16.078 1.00 0.00 C ATOM 724 CD1 PHE A 45 25.098 24.118 15.102 1.00 0.00 C ATOM 725 CD2 PHE A 45 24.680 21.916 16.022 1.00 0.00 C ATOM 726 CE1 PHE A 45 24.193 23.858 14.066 1.00 0.00 C ATOM 727 CE2 PHE A 45 23.775 21.654 14.988 1.00 0.00 C ATOM 728 CZ PHE A 45 23.531 22.624 14.009 1.00 0.00 C ATOM 0 H PHE A 45 26.823 23.419 19.951 1.00 0.00 H new ATOM 0 HA PHE A 45 25.197 25.070 18.037 1.00 0.00 H new ATOM 0 HB2 PHE A 45 27.122 24.062 16.838 1.00 0.00 H new ATOM 0 HB3 PHE A 45 26.770 22.492 17.533 1.00 0.00 H new ATOM 0 HD1 PHE A 45 25.608 25.069 15.147 1.00 0.00 H new ATOM 0 HD2 PHE A 45 24.868 21.167 16.777 1.00 0.00 H new ATOM 0 HE1 PHE A 45 24.005 24.608 13.311 1.00 0.00 H new ATOM 0 HE2 PHE A 45 23.265 20.703 14.945 1.00 0.00 H new ATOM 0 HZ PHE A 45 22.833 22.422 13.210 1.00 0.00 H new ATOM 738 N ALA A 46 23.264 23.813 19.000 1.00 0.00 N ATOM 739 CA ALA A 46 22.071 23.025 19.421 1.00 0.00 C ATOM 740 C ALA A 46 22.430 22.072 20.566 1.00 0.00 C ATOM 741 O ALA A 46 22.139 20.894 20.514 1.00 0.00 O ATOM 742 CB ALA A 46 21.555 22.210 18.232 1.00 0.00 C ATOM 0 H ALA A 46 23.102 24.814 18.890 1.00 0.00 H new ATOM 0 HA ALA A 46 21.301 23.715 19.765 1.00 0.00 H new ATOM 0 HB1 ALA A 46 20.682 21.633 18.538 1.00 0.00 H new ATOM 0 HB2 ALA A 46 21.278 22.884 17.421 1.00 0.00 H new ATOM 0 HB3 ALA A 46 22.336 21.532 17.889 1.00 0.00 H new ATOM 748 N GLY A 47 23.040 22.569 21.608 1.00 0.00 N ATOM 749 CA GLY A 47 23.390 21.685 22.758 1.00 0.00 C ATOM 750 C GLY A 47 24.475 20.683 22.357 1.00 0.00 C ATOM 751 O GLY A 47 24.947 19.915 23.171 1.00 0.00 O ATOM 0 H GLY A 47 23.311 23.547 21.713 1.00 0.00 H new ATOM 0 HA2 GLY A 47 23.738 22.290 23.596 1.00 0.00 H new ATOM 0 HA3 GLY A 47 22.502 21.151 23.097 1.00 0.00 H new ATOM 755 N LYS A 48 24.873 20.671 21.113 1.00 0.00 N ATOM 756 CA LYS A 48 25.922 19.701 20.674 1.00 0.00 C ATOM 757 C LYS A 48 27.308 20.323 20.846 1.00 0.00 C ATOM 758 O LYS A 48 27.446 21.513 21.054 1.00 0.00 O ATOM 759 CB LYS A 48 25.707 19.338 19.210 1.00 0.00 C ATOM 760 CG LYS A 48 24.242 18.951 18.985 1.00 0.00 C ATOM 761 CD LYS A 48 24.100 18.233 17.641 1.00 0.00 C ATOM 762 CE LYS A 48 22.626 17.924 17.380 1.00 0.00 C ATOM 763 NZ LYS A 48 22.494 17.170 16.101 1.00 0.00 N ATOM 0 H LYS A 48 24.519 21.289 20.382 1.00 0.00 H new ATOM 0 HA LYS A 48 25.852 18.801 21.285 1.00 0.00 H new ATOM 0 HB2 LYS A 48 25.972 20.182 18.573 1.00 0.00 H new ATOM 0 HB3 LYS A 48 26.359 18.510 18.931 1.00 0.00 H new ATOM 0 HG2 LYS A 48 23.898 18.304 19.792 1.00 0.00 H new ATOM 0 HG3 LYS A 48 23.614 19.842 19.001 1.00 0.00 H new ATOM 0 HD2 LYS A 48 24.499 18.856 16.840 1.00 0.00 H new ATOM 0 HD3 LYS A 48 24.680 17.310 17.647 1.00 0.00 H new ATOM 0 HE2 LYS A 48 22.215 17.339 18.203 1.00 0.00 H new ATOM 0 HE3 LYS A 48 22.053 18.850 17.329 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 21.491 16.960 15.924 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 22.871 17.743 15.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 23.028 16.280 16.166 1.00 0.00 H new ATOM 777 N GLN A 49 28.337 19.519 20.753 1.00 0.00 N ATOM 778 CA GLN A 49 29.732 20.024 20.901 1.00 0.00 C ATOM 779 C GLN A 49 30.581 19.517 19.734 1.00 0.00 C ATOM 780 O GLN A 49 30.615 18.338 19.446 1.00 0.00 O ATOM 781 CB GLN A 49 30.318 19.519 22.213 1.00 0.00 C ATOM 782 CG GLN A 49 29.676 20.266 23.384 1.00 0.00 C ATOM 783 CD GLN A 49 30.284 19.774 24.699 1.00 0.00 C ATOM 784 OE1 GLN A 49 30.255 18.595 24.992 1.00 0.00 O ATOM 785 NE2 GLN A 49 30.837 20.635 25.510 1.00 0.00 N ATOM 0 H GLN A 49 28.266 18.517 20.578 1.00 0.00 H new ATOM 0 HA GLN A 49 29.727 21.114 20.902 1.00 0.00 H new ATOM 0 HB2 GLN A 49 30.143 18.448 22.312 1.00 0.00 H new ATOM 0 HB3 GLN A 49 31.398 19.668 22.222 1.00 0.00 H new ATOM 0 HG2 GLN A 49 29.836 21.339 23.276 1.00 0.00 H new ATOM 0 HG3 GLN A 49 28.598 20.103 23.386 1.00 0.00 H new ATOM 0 HE21 GLN A 49 30.861 21.625 25.264 1.00 0.00 H new ATOM 0 HE22 GLN A 49 31.245 20.318 26.390 1.00 0.00 H new ATOM 794 N LEU A 50 31.268 20.400 19.059 1.00 0.00 N ATOM 795 CA LEU A 50 32.117 19.976 17.905 1.00 0.00 C ATOM 796 C LEU A 50 33.557 19.770 18.381 1.00 0.00 C ATOM 797 O LEU A 50 34.119 20.603 19.064 1.00 0.00 O ATOM 798 CB LEU A 50 32.089 21.062 16.827 1.00 0.00 C ATOM 799 CG LEU A 50 30.648 21.524 16.593 1.00 0.00 C ATOM 800 CD1 LEU A 50 30.630 22.598 15.501 1.00 0.00 C ATOM 801 CD2 LEU A 50 29.790 20.332 16.151 1.00 0.00 C ATOM 0 H LEU A 50 31.278 21.400 19.257 1.00 0.00 H new ATOM 0 HA LEU A 50 31.732 19.043 17.493 1.00 0.00 H new ATOM 0 HB2 LEU A 50 32.706 21.907 17.133 1.00 0.00 H new ATOM 0 HB3 LEU A 50 32.512 20.677 15.899 1.00 0.00 H new ATOM 0 HG LEU A 50 30.245 21.936 17.518 1.00 0.00 H new ATOM 0 HD11 LEU A 50 29.605 22.929 15.333 1.00 0.00 H new ATOM 0 HD12 LEU A 50 31.238 23.446 15.815 1.00 0.00 H new ATOM 0 HD13 LEU A 50 31.034 22.184 14.577 1.00 0.00 H new ATOM 0 HD21 LEU A 50 28.765 20.663 15.985 1.00 0.00 H new ATOM 0 HD22 LEU A 50 30.192 19.918 15.226 1.00 0.00 H new ATOM 0 HD23 LEU A 50 29.803 19.567 16.927 1.00 0.00 H new ATOM 813 N GLU A 51 34.158 18.663 18.029 1.00 0.00 N ATOM 814 CA GLU A 51 35.563 18.394 18.460 1.00 0.00 C ATOM 815 C GLU A 51 36.532 18.865 17.374 1.00 0.00 C ATOM 816 O GLU A 51 36.182 18.956 16.213 1.00 0.00 O ATOM 817 CB GLU A 51 35.745 16.891 18.679 1.00 0.00 C ATOM 818 CG GLU A 51 34.749 16.403 19.732 1.00 0.00 C ATOM 819 CD GLU A 51 34.974 14.915 19.995 1.00 0.00 C ATOM 820 OE1 GLU A 51 35.751 14.314 19.270 1.00 0.00 O ATOM 821 OE2 GLU A 51 34.369 14.398 20.920 1.00 0.00 O ATOM 0 H GLU A 51 33.735 17.931 17.459 1.00 0.00 H new ATOM 0 HA GLU A 51 35.767 18.930 19.387 1.00 0.00 H new ATOM 0 HB2 GLU A 51 35.591 16.355 17.742 1.00 0.00 H new ATOM 0 HB3 GLU A 51 36.764 16.681 19.003 1.00 0.00 H new ATOM 0 HG2 GLU A 51 34.873 16.969 20.655 1.00 0.00 H new ATOM 0 HG3 GLU A 51 33.728 16.572 19.389 1.00 0.00 H new ATOM 828 N ASP A 52 37.749 19.160 17.740 1.00 0.00 N ATOM 829 CA ASP A 52 38.742 19.620 16.727 1.00 0.00 C ATOM 830 C ASP A 52 39.117 18.447 15.817 1.00 0.00 C ATOM 831 O ASP A 52 38.993 17.298 16.188 1.00 0.00 O ATOM 832 CB ASP A 52 39.994 20.134 17.439 1.00 0.00 C ATOM 833 CG ASP A 52 39.681 21.461 18.132 1.00 0.00 C ATOM 834 OD1 ASP A 52 38.639 22.027 17.841 1.00 0.00 O ATOM 835 OD2 ASP A 52 40.486 21.889 18.942 1.00 0.00 O ATOM 0 H ASP A 52 38.099 19.103 18.696 1.00 0.00 H new ATOM 0 HA ASP A 52 38.310 20.422 16.129 1.00 0.00 H new ATOM 0 HB2 ASP A 52 40.335 19.402 18.171 1.00 0.00 H new ATOM 0 HB3 ASP A 52 40.803 20.269 16.721 1.00 0.00 H new ATOM 840 N GLY A 53 39.570 18.729 14.625 1.00 0.00 N ATOM 841 CA GLY A 53 39.951 17.631 13.691 1.00 0.00 C ATOM 842 C GLY A 53 38.703 17.120 12.971 1.00 0.00 C ATOM 843 O GLY A 53 38.558 15.940 12.719 1.00 0.00 O ATOM 0 H GLY A 53 39.693 19.673 14.258 1.00 0.00 H new ATOM 0 HA2 GLY A 53 40.680 17.992 12.966 1.00 0.00 H new ATOM 0 HA3 GLY A 53 40.425 16.818 14.242 1.00 0.00 H new ATOM 847 N ARG A 54 37.797 18.001 12.639 1.00 0.00 N ATOM 848 CA ARG A 54 36.556 17.559 11.936 1.00 0.00 C ATOM 849 C ARG A 54 35.938 18.725 11.154 1.00 0.00 C ATOM 850 O ARG A 54 36.144 19.882 11.464 1.00 0.00 O ATOM 851 CB ARG A 54 35.548 17.021 12.970 1.00 0.00 C ATOM 852 CG ARG A 54 34.612 15.985 12.316 1.00 0.00 C ATOM 853 CD ARG A 54 35.250 14.592 12.357 1.00 0.00 C ATOM 854 NE ARG A 54 35.233 14.082 13.757 1.00 0.00 N ATOM 855 CZ ARG A 54 34.150 13.535 14.242 1.00 0.00 C ATOM 856 NH1 ARG A 54 34.138 13.090 15.468 1.00 0.00 N ATOM 857 NH2 ARG A 54 33.080 13.433 13.500 1.00 0.00 N ATOM 0 H ARG A 54 37.861 19.002 12.823 1.00 0.00 H new ATOM 0 HA ARG A 54 36.809 16.768 11.229 1.00 0.00 H new ATOM 0 HB2 ARG A 54 36.081 16.564 13.804 1.00 0.00 H new ATOM 0 HB3 ARG A 54 34.962 17.844 13.379 1.00 0.00 H new ATOM 0 HG2 ARG A 54 33.655 15.970 12.837 1.00 0.00 H new ATOM 0 HG3 ARG A 54 34.408 16.269 11.284 1.00 0.00 H new ATOM 0 HD2 ARG A 54 34.705 13.911 11.703 1.00 0.00 H new ATOM 0 HD3 ARG A 54 36.274 14.638 11.987 1.00 0.00 H new ATOM 0 HE ARG A 54 36.068 14.160 14.338 1.00 0.00 H new ATOM 0 HH11 ARG A 54 34.974 13.169 16.047 1.00 0.00 H new ATOM 0 HH12 ARG A 54 33.293 12.663 15.847 1.00 0.00 H new ATOM 0 HH21 ARG A 54 33.089 13.780 12.541 1.00 0.00 H new ATOM 0 HH22 ARG A 54 32.235 13.006 13.879 1.00 0.00 H new ATOM 871 N THR A 55 35.180 18.407 10.134 1.00 0.00 N ATOM 872 CA THR A 55 34.520 19.451 9.288 1.00 0.00 C ATOM 873 C THR A 55 32.996 19.260 9.369 1.00 0.00 C ATOM 874 O THR A 55 32.516 18.186 9.674 1.00 0.00 O ATOM 875 CB THR A 55 35.007 19.271 7.841 1.00 0.00 C ATOM 876 OG1 THR A 55 36.302 19.840 7.711 1.00 0.00 O ATOM 877 CG2 THR A 55 34.054 19.949 6.853 1.00 0.00 C ATOM 0 H THR A 55 34.987 17.448 9.846 1.00 0.00 H new ATOM 0 HA THR A 55 34.769 20.454 9.634 1.00 0.00 H new ATOM 0 HB THR A 55 35.038 18.205 7.614 1.00 0.00 H new ATOM 0 HG1 THR A 55 36.269 20.586 7.076 1.00 0.00 H new ATOM 0 HG21 THR A 55 34.422 19.807 5.837 1.00 0.00 H new ATOM 0 HG22 THR A 55 33.061 19.509 6.945 1.00 0.00 H new ATOM 0 HG23 THR A 55 34.000 21.015 7.073 1.00 0.00 H new ATOM 885 N LEU A 56 32.229 20.290 9.107 1.00 0.00 N ATOM 886 CA LEU A 56 30.745 20.147 9.182 1.00 0.00 C ATOM 887 C LEU A 56 30.293 19.034 8.231 1.00 0.00 C ATOM 888 O LEU A 56 29.515 18.172 8.593 1.00 0.00 O ATOM 889 CB LEU A 56 30.073 21.468 8.772 1.00 0.00 C ATOM 890 CG LEU A 56 30.165 22.498 9.911 1.00 0.00 C ATOM 891 CD1 LEU A 56 31.583 23.071 9.998 1.00 0.00 C ATOM 892 CD2 LEU A 56 29.183 23.641 9.638 1.00 0.00 C ATOM 0 H LEU A 56 32.565 21.217 8.846 1.00 0.00 H new ATOM 0 HA LEU A 56 30.459 19.898 10.204 1.00 0.00 H new ATOM 0 HB2 LEU A 56 30.553 21.864 7.877 1.00 0.00 H new ATOM 0 HB3 LEU A 56 29.028 21.288 8.521 1.00 0.00 H new ATOM 0 HG LEU A 56 29.920 22.006 10.852 1.00 0.00 H new ATOM 0 HD11 LEU A 56 31.632 23.798 10.808 1.00 0.00 H new ATOM 0 HD12 LEU A 56 32.290 22.264 10.191 1.00 0.00 H new ATOM 0 HD13 LEU A 56 31.837 23.559 9.057 1.00 0.00 H new ATOM 0 HD21 LEU A 56 29.245 24.374 10.443 1.00 0.00 H new ATOM 0 HD22 LEU A 56 29.435 24.119 8.692 1.00 0.00 H new ATOM 0 HD23 LEU A 56 28.169 23.245 9.585 1.00 0.00 H new ATOM 904 N SER A 57 30.794 19.028 7.028 1.00 0.00 N ATOM 905 CA SER A 57 30.402 17.951 6.079 1.00 0.00 C ATOM 906 C SER A 57 30.863 16.622 6.673 1.00 0.00 C ATOM 907 O SER A 57 30.118 15.665 6.753 1.00 0.00 O ATOM 908 CB SER A 57 31.085 18.176 4.729 1.00 0.00 C ATOM 909 OG SER A 57 30.591 19.377 4.149 1.00 0.00 O ATOM 0 H SER A 57 31.453 19.716 6.663 1.00 0.00 H new ATOM 0 HA SER A 57 29.323 17.950 5.925 1.00 0.00 H new ATOM 0 HB2 SER A 57 32.165 18.239 4.861 1.00 0.00 H new ATOM 0 HB3 SER A 57 30.893 17.332 4.066 1.00 0.00 H new ATOM 0 HG SER A 57 31.027 19.526 3.284 1.00 0.00 H new ATOM 915 N ASP A 58 32.092 16.572 7.097 1.00 0.00 N ATOM 916 CA ASP A 58 32.630 15.324 7.699 1.00 0.00 C ATOM 917 C ASP A 58 31.676 14.832 8.793 1.00 0.00 C ATOM 918 O ASP A 58 31.535 13.646 9.011 1.00 0.00 O ATOM 919 CB ASP A 58 34.005 15.606 8.303 1.00 0.00 C ATOM 920 CG ASP A 58 34.533 14.347 8.993 1.00 0.00 C ATOM 921 OD1 ASP A 58 33.876 13.324 8.903 1.00 0.00 O ATOM 922 OD2 ASP A 58 35.589 14.428 9.602 1.00 0.00 O ATOM 0 H ASP A 58 32.752 17.348 7.052 1.00 0.00 H new ATOM 0 HA ASP A 58 32.722 14.557 6.931 1.00 0.00 H new ATOM 0 HB2 ASP A 58 34.698 15.922 7.523 1.00 0.00 H new ATOM 0 HB3 ASP A 58 33.937 16.424 9.020 1.00 0.00 H new ATOM 927 N TYR A 59 31.008 15.725 9.481 1.00 0.00 N ATOM 928 CA TYR A 59 30.067 15.270 10.545 1.00 0.00 C ATOM 929 C TYR A 59 28.827 14.670 9.872 1.00 0.00 C ATOM 930 O TYR A 59 28.090 13.914 10.473 1.00 0.00 O ATOM 931 CB TYR A 59 29.647 16.477 11.413 1.00 0.00 C ATOM 932 CG TYR A 59 30.590 16.651 12.589 1.00 0.00 C ATOM 933 CD1 TYR A 59 31.345 17.825 12.721 1.00 0.00 C ATOM 934 CD2 TYR A 59 30.688 15.646 13.559 1.00 0.00 C ATOM 935 CE1 TYR A 59 32.197 17.991 13.820 1.00 0.00 C ATOM 936 CE2 TYR A 59 31.544 15.810 14.656 1.00 0.00 C ATOM 937 CZ TYR A 59 32.297 16.983 14.788 1.00 0.00 C ATOM 938 OH TYR A 59 33.136 17.146 15.871 1.00 0.00 O ATOM 0 H TYR A 59 31.073 16.735 9.353 1.00 0.00 H new ATOM 0 HA TYR A 59 30.549 14.525 11.178 1.00 0.00 H new ATOM 0 HB2 TYR A 59 29.644 17.383 10.807 1.00 0.00 H new ATOM 0 HB3 TYR A 59 28.629 16.333 11.776 1.00 0.00 H new ATOM 0 HD1 TYR A 59 31.269 18.602 11.975 1.00 0.00 H new ATOM 0 HD2 TYR A 59 30.103 14.743 13.461 1.00 0.00 H new ATOM 0 HE1 TYR A 59 32.777 18.896 13.921 1.00 0.00 H new ATOM 0 HE2 TYR A 59 31.623 15.031 15.400 1.00 0.00 H new ATOM 0 HH TYR A 59 33.085 16.354 16.446 1.00 0.00 H new ATOM 948 N ASN A 60 28.589 15.016 8.633 1.00 0.00 N ATOM 949 CA ASN A 60 27.393 14.484 7.913 1.00 0.00 C ATOM 950 C ASN A 60 26.119 15.014 8.578 1.00 0.00 C ATOM 951 O ASN A 60 25.245 14.262 8.959 1.00 0.00 O ATOM 952 CB ASN A 60 27.401 12.947 7.946 1.00 0.00 C ATOM 953 CG ASN A 60 26.522 12.400 6.817 1.00 0.00 C ATOM 954 OD1 ASN A 60 25.411 11.967 7.050 1.00 0.00 O ATOM 955 ND2 ASN A 60 26.977 12.406 5.593 1.00 0.00 N ATOM 0 H ASN A 60 29.175 15.647 8.086 1.00 0.00 H new ATOM 0 HA ASN A 60 27.422 14.814 6.874 1.00 0.00 H new ATOM 0 HB2 ASN A 60 28.421 12.577 7.838 1.00 0.00 H new ATOM 0 HB3 ASN A 60 27.034 12.593 8.909 1.00 0.00 H new ATOM 0 HD21 ASN A 60 26.400 12.047 4.833 1.00 0.00 H new ATOM 0 HD22 ASN A 60 27.910 12.770 5.397 1.00 0.00 H new ATOM 962 N ILE A 61 26.010 16.309 8.720 1.00 0.00 N ATOM 963 CA ILE A 61 24.795 16.898 9.359 1.00 0.00 C ATOM 964 C ILE A 61 23.689 17.055 8.310 1.00 0.00 C ATOM 965 O ILE A 61 23.952 17.249 7.141 1.00 0.00 O ATOM 966 CB ILE A 61 25.138 18.272 9.938 1.00 0.00 C ATOM 967 CG1 ILE A 61 26.236 18.119 10.994 1.00 0.00 C ATOM 968 CG2 ILE A 61 23.891 18.880 10.583 1.00 0.00 C ATOM 969 CD1 ILE A 61 26.742 19.501 11.411 1.00 0.00 C ATOM 0 H ILE A 61 26.712 16.986 8.420 1.00 0.00 H new ATOM 0 HA ILE A 61 24.452 16.239 10.157 1.00 0.00 H new ATOM 0 HB ILE A 61 25.489 18.926 9.140 1.00 0.00 H new ATOM 0 HG12 ILE A 61 25.848 17.585 11.862 1.00 0.00 H new ATOM 0 HG13 ILE A 61 27.058 17.525 10.595 1.00 0.00 H new ATOM 0 HG21 ILE A 61 24.135 19.859 10.996 1.00 0.00 H new ATOM 0 HG22 ILE A 61 23.109 18.988 9.832 1.00 0.00 H new ATOM 0 HG23 ILE A 61 23.539 18.227 11.382 1.00 0.00 H new ATOM 0 HD11 ILE A 61 27.524 19.391 12.163 1.00 0.00 H new ATOM 0 HD12 ILE A 61 27.146 20.018 10.541 1.00 0.00 H new ATOM 0 HD13 ILE A 61 25.918 20.080 11.827 1.00 0.00 H new ATOM 1066 N LEU A 67 23.110 27.074 8.314 1.00 0.00 N ATOM 1067 CA LEU A 67 23.890 26.599 9.497 1.00 0.00 C ATOM 1068 C LEU A 67 23.932 27.700 10.559 1.00 0.00 C ATOM 1069 O LEU A 67 24.464 28.771 10.335 1.00 0.00 O ATOM 1070 CB LEU A 67 25.317 26.259 9.056 1.00 0.00 C ATOM 1071 CG LEU A 67 25.276 25.447 7.758 1.00 0.00 C ATOM 1072 CD1 LEU A 67 26.701 25.068 7.346 1.00 0.00 C ATOM 1073 CD2 LEU A 67 24.449 24.175 7.972 1.00 0.00 C ATOM 0 HA LEU A 67 23.415 25.712 9.916 1.00 0.00 H new ATOM 0 HB2 LEU A 67 25.889 27.174 8.906 1.00 0.00 H new ATOM 0 HB3 LEU A 67 25.823 25.691 9.836 1.00 0.00 H new ATOM 0 HG LEU A 67 24.818 26.047 6.971 1.00 0.00 H new ATOM 0 HD11 LEU A 67 26.671 24.490 6.422 1.00 0.00 H new ATOM 0 HD12 LEU A 67 27.287 25.973 7.189 1.00 0.00 H new ATOM 0 HD13 LEU A 67 27.161 24.470 8.133 1.00 0.00 H new ATOM 0 HD21 LEU A 67 24.421 23.599 7.047 1.00 0.00 H new ATOM 0 HD22 LEU A 67 24.903 23.574 8.760 1.00 0.00 H new ATOM 0 HD23 LEU A 67 23.434 24.446 8.261 1.00 0.00 H new ATOM 1085 N HIS A 68 23.367 27.442 11.714 1.00 0.00 N ATOM 1086 CA HIS A 68 23.356 28.463 12.810 1.00 0.00 C ATOM 1087 C HIS A 68 24.314 28.033 13.924 1.00 0.00 C ATOM 1088 O HIS A 68 24.367 26.879 14.298 1.00 0.00 O ATOM 1089 CB HIS A 68 21.940 28.574 13.380 1.00 0.00 C ATOM 1090 CG HIS A 68 21.930 29.571 14.506 1.00 0.00 C ATOM 1091 ND1 HIS A 68 21.013 29.504 15.545 1.00 0.00 N ATOM 1092 CD2 HIS A 68 22.719 30.664 14.770 1.00 0.00 C ATOM 1093 CE1 HIS A 68 21.269 30.528 16.379 1.00 0.00 C ATOM 1094 NE2 HIS A 68 22.297 31.264 15.953 1.00 0.00 N ATOM 0 H HIS A 68 22.909 26.561 11.946 1.00 0.00 H new ATOM 0 HA HIS A 68 23.672 29.427 12.411 1.00 0.00 H new ATOM 0 HB2 HIS A 68 21.245 28.884 12.599 1.00 0.00 H new ATOM 0 HB3 HIS A 68 21.603 27.601 13.738 1.00 0.00 H new ATOM 0 HD1 HIS A 68 20.278 28.805 15.656 1.00 0.00 H new ATOM 0 HD2 HIS A 68 23.539 31.005 14.155 1.00 0.00 H new ATOM 0 HE1 HIS A 68 20.711 30.729 17.282 1.00 0.00 H new ATOM 1103 N LEU A 69 25.061 28.962 14.464 1.00 0.00 N ATOM 1104 CA LEU A 69 26.016 28.630 15.567 1.00 0.00 C ATOM 1105 C LEU A 69 25.974 29.744 16.614 1.00 0.00 C ATOM 1106 O LEU A 69 25.632 30.870 16.315 1.00 0.00 O ATOM 1107 CB LEU A 69 27.444 28.509 15.015 1.00 0.00 C ATOM 1108 CG LEU A 69 27.490 27.498 13.840 1.00 0.00 C ATOM 1109 CD1 LEU A 69 27.325 28.230 12.503 1.00 0.00 C ATOM 1110 CD2 LEU A 69 28.839 26.766 13.833 1.00 0.00 C ATOM 0 H LEU A 69 25.051 29.944 14.187 1.00 0.00 H new ATOM 0 HA LEU A 69 25.728 27.680 16.016 1.00 0.00 H new ATOM 0 HB2 LEU A 69 27.793 29.485 14.677 1.00 0.00 H new ATOM 0 HB3 LEU A 69 28.120 28.186 15.807 1.00 0.00 H new ATOM 0 HG LEU A 69 26.677 26.783 13.970 1.00 0.00 H new ATOM 0 HD11 LEU A 69 27.359 27.509 11.687 1.00 0.00 H new ATOM 0 HD12 LEU A 69 26.367 28.749 12.488 1.00 0.00 H new ATOM 0 HD13 LEU A 69 28.132 28.953 12.382 1.00 0.00 H new ATOM 0 HD21 LEU A 69 28.864 26.057 13.005 1.00 0.00 H new ATOM 0 HD22 LEU A 69 29.645 27.490 13.716 1.00 0.00 H new ATOM 0 HD23 LEU A 69 28.967 26.230 14.773 1.00 0.00 H new ATOM 1122 N VAL A 70 26.325 29.440 17.841 1.00 0.00 N ATOM 1123 CA VAL A 70 26.317 30.477 18.921 1.00 0.00 C ATOM 1124 C VAL A 70 27.645 30.417 19.678 1.00 0.00 C ATOM 1125 O VAL A 70 27.994 29.405 20.255 1.00 0.00 O ATOM 1126 CB VAL A 70 25.166 30.189 19.888 1.00 0.00 C ATOM 1127 CG1 VAL A 70 25.177 31.214 21.024 1.00 0.00 C ATOM 1128 CG2 VAL A 70 23.835 30.277 19.137 1.00 0.00 C ATOM 0 H VAL A 70 26.619 28.511 18.142 1.00 0.00 H new ATOM 0 HA VAL A 70 26.186 31.467 18.485 1.00 0.00 H new ATOM 0 HB VAL A 70 25.287 29.188 20.303 1.00 0.00 H new ATOM 0 HG11 VAL A 70 24.356 31.006 21.710 1.00 0.00 H new ATOM 0 HG12 VAL A 70 26.123 31.152 21.561 1.00 0.00 H new ATOM 0 HG13 VAL A 70 25.059 32.216 20.611 1.00 0.00 H new ATOM 0 HG21 VAL A 70 23.015 30.072 19.825 1.00 0.00 H new ATOM 0 HG22 VAL A 70 23.718 31.277 18.720 1.00 0.00 H new ATOM 0 HG23 VAL A 70 23.823 29.544 18.330 1.00 0.00 H new ATOM 1138 N LEU A 71 28.394 31.486 19.677 1.00 0.00 N ATOM 1139 CA LEU A 71 29.704 31.486 20.393 1.00 0.00 C ATOM 1140 C LEU A 71 29.476 31.801 21.873 1.00 0.00 C ATOM 1141 O LEU A 71 28.631 32.602 22.221 1.00 0.00 O ATOM 1142 CB LEU A 71 30.615 32.554 19.763 1.00 0.00 C ATOM 1143 CG LEU A 71 32.059 32.461 20.334 1.00 0.00 C ATOM 1144 CD1 LEU A 71 33.077 32.802 19.239 1.00 0.00 C ATOM 1145 CD2 LEU A 71 32.244 33.449 21.496 1.00 0.00 C ATOM 0 H LEU A 71 28.156 32.361 19.211 1.00 0.00 H new ATOM 0 HA LEU A 71 30.176 30.507 20.308 1.00 0.00 H new ATOM 0 HB2 LEU A 71 30.639 32.425 18.681 1.00 0.00 H new ATOM 0 HB3 LEU A 71 30.207 33.546 19.957 1.00 0.00 H new ATOM 0 HG LEU A 71 32.217 31.443 20.691 1.00 0.00 H new ATOM 0 HD11 LEU A 71 34.086 32.735 19.646 1.00 0.00 H new ATOM 0 HD12 LEU A 71 32.972 32.099 18.413 1.00 0.00 H new ATOM 0 HD13 LEU A 71 32.898 33.815 18.879 1.00 0.00 H new ATOM 0 HD21 LEU A 71 33.260 33.370 21.883 1.00 0.00 H new ATOM 0 HD22 LEU A 71 32.069 34.465 21.141 1.00 0.00 H new ATOM 0 HD23 LEU A 71 31.534 33.214 22.289 1.00 0.00 H new ATOM 1157 N ARG A 72 30.228 31.175 22.748 1.00 0.00 N ATOM 1158 CA ARG A 72 30.074 31.424 24.216 1.00 0.00 C ATOM 1159 C ARG A 72 31.322 32.139 24.741 1.00 0.00 C ATOM 1160 O ARG A 72 32.404 31.979 24.211 1.00 0.00 O ATOM 1161 CB ARG A 72 29.923 30.084 24.940 1.00 0.00 C ATOM 1162 CG ARG A 72 29.440 30.327 26.373 1.00 0.00 C ATOM 1163 CD ARG A 72 29.504 29.017 27.163 1.00 0.00 C ATOM 1164 NE ARG A 72 30.928 28.655 27.411 1.00 0.00 N ATOM 1165 CZ ARG A 72 31.222 27.545 28.031 1.00 0.00 C ATOM 1166 NH1 ARG A 72 32.468 27.226 28.247 1.00 0.00 N ATOM 1167 NH2 ARG A 72 30.268 26.752 28.436 1.00 0.00 N ATOM 0 H ARG A 72 30.949 30.496 22.504 1.00 0.00 H new ATOM 0 HA ARG A 72 29.194 32.042 24.393 1.00 0.00 H new ATOM 0 HB2 ARG A 72 29.213 29.450 24.409 1.00 0.00 H new ATOM 0 HB3 ARG A 72 30.876 29.556 24.951 1.00 0.00 H new ATOM 0 HG2 ARG A 72 30.060 31.084 26.853 1.00 0.00 H new ATOM 0 HG3 ARG A 72 28.419 30.709 26.364 1.00 0.00 H new ATOM 0 HD2 ARG A 72 28.975 29.125 28.110 1.00 0.00 H new ATOM 0 HD3 ARG A 72 29.007 28.221 26.609 1.00 0.00 H new ATOM 0 HE ARG A 72 31.674 29.275 27.096 1.00 0.00 H new ATOM 0 HH11 ARG A 72 33.215 27.845 27.931 1.00 0.00 H new ATOM 0 HH12 ARG A 72 32.696 26.358 28.732 1.00 0.00 H new ATOM 0 HH21 ARG A 72 29.293 27.000 28.268 1.00 0.00 H new ATOM 0 HH22 ARG A 72 30.497 25.884 28.921 1.00 0.00 H new ATOM 1181 N LEU A 73 31.179 32.925 25.780 1.00 0.00 N ATOM 1182 CA LEU A 73 32.352 33.660 26.357 1.00 0.00 C ATOM 1183 C LEU A 73 32.669 33.093 27.742 1.00 0.00 C ATOM 1184 O LEU A 73 31.786 32.861 28.543 1.00 0.00 O ATOM 1185 CB LEU A 73 32.003 35.144 26.492 1.00 0.00 C ATOM 1186 CG LEU A 73 31.512 35.691 25.147 1.00 0.00 C ATOM 1187 CD1 LEU A 73 31.011 37.124 25.338 1.00 0.00 C ATOM 1188 CD2 LEU A 73 32.660 35.681 24.126 1.00 0.00 C ATOM 0 H LEU A 73 30.293 33.091 26.258 1.00 0.00 H new ATOM 0 HA LEU A 73 33.216 33.543 25.702 1.00 0.00 H new ATOM 0 HB2 LEU A 73 31.232 35.277 27.251 1.00 0.00 H new ATOM 0 HB3 LEU A 73 32.878 35.703 26.824 1.00 0.00 H new ATOM 0 HG LEU A 73 30.701 35.063 24.777 1.00 0.00 H new ATOM 0 HD11 LEU A 73 30.661 37.517 24.384 1.00 0.00 H new ATOM 0 HD12 LEU A 73 30.191 37.130 26.056 1.00 0.00 H new ATOM 0 HD13 LEU A 73 31.824 37.747 25.711 1.00 0.00 H new ATOM 0 HD21 LEU A 73 32.303 36.071 23.173 1.00 0.00 H new ATOM 0 HD22 LEU A 73 33.476 36.305 24.490 1.00 0.00 H new ATOM 0 HD23 LEU A 73 33.016 34.660 23.989 1.00 0.00 H new