USER MOD reduce.3.24.130724 H: found=0, std=0, add=571, rem=0, adj=15 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 55 THR OG1 : rot 125:sc= 0.237 USER MOD Set 1.2: A 57 SER OG : rot 180:sc= -0.137 USER MOD Set 2.1: A 25 ASN : amide:sc= -5.93! C(o=-12!,f=-11!) USER MOD Set 2.2: A 29 LYS NZ :NH3+ -164:sc= -6.42! (180deg=0) USER MOD Set 3.1: A 7 THR OG1 : rot 129:sc= -0.21 USER MOD Set 3.2: A 9 THR OG1 : rot -150:sc= -0.156 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 175:sc= 0 (180deg=-0.0476) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ -160:sc= -0.0842 (180deg=-0.567) USER MOD Single : A 12 THR OG1 : rot 66:sc= -0.267 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= -0.581 USER MOD Single : A 27 LYS NZ :NH3+ -139:sc= -3.79! (180deg=-5.25!) USER MOD Single : A 31 GLN : amide:sc= -1.82 K(o=-1.8,f=-5.7!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= -0.116 X(o=-0.12,f=-0.14) USER MOD Single : A 41 GLN : amide:sc= -1.15 X(o=-1.2,f=-0.66) USER MOD Single : A 48 LYS NZ :NH3+ 152:sc= -1.04 (180deg=-2.53!) USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 TYR OH : rot -6:sc= 0.92 USER MOD Single : A 60 ASN : amide:sc= -1.41! C(o=-1.4!,f=-1.9!) USER MOD Single : A 68 HIS : no HE2:sc= -1.76 K(o=-1.8,f=-3.7!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 27.692 27.409 3.408 1.00 0.00 N ATOM 2 CA MET A 1 28.163 28.634 2.700 1.00 0.00 C ATOM 3 C MET A 1 27.960 29.853 3.601 1.00 0.00 C ATOM 4 O MET A 1 28.879 30.321 4.243 1.00 0.00 O ATOM 5 CB MET A 1 27.363 28.815 1.408 1.00 0.00 C ATOM 6 CG MET A 1 27.897 30.029 0.643 1.00 0.00 C ATOM 7 SD MET A 1 27.030 30.174 -0.939 1.00 0.00 S ATOM 8 CE MET A 1 27.881 31.659 -1.527 1.00 0.00 C ATOM 0 H1 MET A 1 27.751 26.593 2.766 1.00 0.00 H new ATOM 0 H2 MET A 1 28.290 27.238 4.241 1.00 0.00 H new ATOM 0 H3 MET A 1 26.706 27.541 3.711 1.00 0.00 H new ATOM 0 HA MET A 1 29.221 28.532 2.461 1.00 0.00 H new ATOM 0 HB2 MET A 1 27.441 27.920 0.791 1.00 0.00 H new ATOM 0 HB3 MET A 1 26.306 28.953 1.638 1.00 0.00 H new ATOM 0 HG2 MET A 1 27.755 30.935 1.232 1.00 0.00 H new ATOM 0 HG3 MET A 1 28.969 29.923 0.474 1.00 0.00 H new ATOM 0 HE1 MET A 1 27.495 31.935 -2.509 1.00 0.00 H new ATOM 0 HE2 MET A 1 27.711 32.477 -0.827 1.00 0.00 H new ATOM 0 HE3 MET A 1 28.950 31.461 -1.600 1.00 0.00 H new ATOM 20 N GLN A 2 26.763 30.373 3.654 1.00 0.00 N ATOM 21 CA GLN A 2 26.502 31.563 4.513 1.00 0.00 C ATOM 22 C GLN A 2 26.250 31.108 5.953 1.00 0.00 C ATOM 23 O GLN A 2 25.122 31.006 6.393 1.00 0.00 O ATOM 24 CB GLN A 2 25.269 32.303 3.993 1.00 0.00 C ATOM 25 CG GLN A 2 25.405 32.526 2.487 1.00 0.00 C ATOM 26 CD GLN A 2 24.191 33.305 1.974 1.00 0.00 C ATOM 27 OE1 GLN A 2 23.243 32.723 1.486 1.00 0.00 O ATOM 28 NE2 GLN A 2 24.181 34.607 2.066 1.00 0.00 N ATOM 0 H GLN A 2 25.954 30.024 3.139 1.00 0.00 H new ATOM 0 HA GLN A 2 27.366 32.227 4.487 1.00 0.00 H new ATOM 0 HB2 GLN A 2 24.369 31.726 4.206 1.00 0.00 H new ATOM 0 HB3 GLN A 2 25.163 33.260 4.505 1.00 0.00 H new ATOM 0 HG2 GLN A 2 26.321 33.076 2.271 1.00 0.00 H new ATOM 0 HG3 GLN A 2 25.480 31.568 1.972 1.00 0.00 H new ATOM 0 HE21 GLN A 2 24.977 35.095 2.476 1.00 0.00 H new ATOM 0 HE22 GLN A 2 23.377 35.136 1.728 1.00 0.00 H new ATOM 37 N ILE A 3 27.293 30.837 6.693 1.00 0.00 N ATOM 38 CA ILE A 3 27.112 30.393 8.106 1.00 0.00 C ATOM 39 C ILE A 3 27.002 31.620 9.015 1.00 0.00 C ATOM 40 O ILE A 3 27.788 32.542 8.932 1.00 0.00 O ATOM 41 CB ILE A 3 28.311 29.537 8.534 1.00 0.00 C ATOM 42 CG1 ILE A 3 29.610 30.186 8.045 1.00 0.00 C ATOM 43 CG2 ILE A 3 28.187 28.139 7.926 1.00 0.00 C ATOM 44 CD1 ILE A 3 30.808 29.468 8.670 1.00 0.00 C ATOM 0 H ILE A 3 28.261 30.904 6.380 1.00 0.00 H new ATOM 0 HA ILE A 3 26.201 29.800 8.187 1.00 0.00 H new ATOM 0 HB ILE A 3 28.327 29.463 9.621 1.00 0.00 H new ATOM 0 HG12 ILE A 3 29.668 30.133 6.958 1.00 0.00 H new ATOM 0 HG13 ILE A 3 29.625 31.242 8.314 1.00 0.00 H new ATOM 0 HG21 ILE A 3 29.040 27.533 8.231 1.00 0.00 H new ATOM 0 HG22 ILE A 3 27.266 27.671 8.274 1.00 0.00 H new ATOM 0 HG23 ILE A 3 28.167 28.216 6.839 1.00 0.00 H new ATOM 0 HD11 ILE A 3 31.732 29.930 8.322 1.00 0.00 H new ATOM 0 HD12 ILE A 3 30.752 29.544 9.756 1.00 0.00 H new ATOM 0 HD13 ILE A 3 30.795 28.418 8.378 1.00 0.00 H new ATOM 56 N PHE A 4 26.026 31.642 9.883 1.00 0.00 N ATOM 57 CA PHE A 4 25.855 32.808 10.799 1.00 0.00 C ATOM 58 C PHE A 4 26.573 32.529 12.120 1.00 0.00 C ATOM 59 O PHE A 4 26.816 31.394 12.479 1.00 0.00 O ATOM 60 CB PHE A 4 24.364 33.026 11.069 1.00 0.00 C ATOM 61 CG PHE A 4 23.679 33.453 9.793 1.00 0.00 C ATOM 62 CD1 PHE A 4 23.110 32.491 8.950 1.00 0.00 C ATOM 63 CD2 PHE A 4 23.613 34.809 9.454 1.00 0.00 C ATOM 64 CE1 PHE A 4 22.473 32.886 7.768 1.00 0.00 C ATOM 65 CE2 PHE A 4 22.977 35.203 8.271 1.00 0.00 C ATOM 66 CZ PHE A 4 22.407 34.243 7.427 1.00 0.00 C ATOM 0 H PHE A 4 25.336 30.899 9.998 1.00 0.00 H new ATOM 0 HA PHE A 4 26.278 33.699 10.336 1.00 0.00 H new ATOM 0 HB2 PHE A 4 23.914 32.108 11.446 1.00 0.00 H new ATOM 0 HB3 PHE A 4 24.230 33.786 11.838 1.00 0.00 H new ATOM 0 HD1 PHE A 4 23.163 31.444 9.212 1.00 0.00 H new ATOM 0 HD2 PHE A 4 24.052 35.551 10.104 1.00 0.00 H new ATOM 0 HE1 PHE A 4 22.032 32.144 7.119 1.00 0.00 H new ATOM 0 HE2 PHE A 4 22.926 36.250 8.009 1.00 0.00 H new ATOM 0 HZ PHE A 4 21.917 34.548 6.514 1.00 0.00 H new ATOM 76 N VAL A 5 26.905 33.560 12.856 1.00 0.00 N ATOM 77 CA VAL A 5 27.599 33.367 14.167 1.00 0.00 C ATOM 78 C VAL A 5 27.054 34.383 15.170 1.00 0.00 C ATOM 79 O VAL A 5 27.335 35.560 15.082 1.00 0.00 O ATOM 80 CB VAL A 5 29.101 33.582 13.986 1.00 0.00 C ATOM 81 CG1 VAL A 5 29.817 33.309 15.310 1.00 0.00 C ATOM 82 CG2 VAL A 5 29.630 32.626 12.913 1.00 0.00 C ATOM 0 H VAL A 5 26.724 34.532 12.604 1.00 0.00 H new ATOM 0 HA VAL A 5 27.423 32.356 14.533 1.00 0.00 H new ATOM 0 HB VAL A 5 29.286 34.611 13.677 1.00 0.00 H new ATOM 0 HG11 VAL A 5 30.889 33.462 15.182 1.00 0.00 H new ATOM 0 HG12 VAL A 5 29.442 33.990 16.074 1.00 0.00 H new ATOM 0 HG13 VAL A 5 29.632 32.280 15.619 1.00 0.00 H new ATOM 0 HG21 VAL A 5 30.701 32.780 12.785 1.00 0.00 H new ATOM 0 HG22 VAL A 5 29.446 31.597 13.220 1.00 0.00 H new ATOM 0 HG23 VAL A 5 29.120 32.820 11.969 1.00 0.00 H new ATOM 92 N LYS A 6 26.268 33.939 16.120 1.00 0.00 N ATOM 93 CA LYS A 6 25.687 34.879 17.131 1.00 0.00 C ATOM 94 C LYS A 6 26.448 34.762 18.455 1.00 0.00 C ATOM 95 O LYS A 6 26.603 33.688 19.003 1.00 0.00 O ATOM 96 CB LYS A 6 24.217 34.516 17.362 1.00 0.00 C ATOM 97 CG LYS A 6 23.588 35.514 18.336 1.00 0.00 C ATOM 98 CD LYS A 6 22.098 35.202 18.495 1.00 0.00 C ATOM 99 CE LYS A 6 21.468 36.205 19.461 1.00 0.00 C ATOM 100 NZ LYS A 6 20.014 35.910 19.603 1.00 0.00 N ATOM 0 H LYS A 6 26.002 32.962 16.240 1.00 0.00 H new ATOM 0 HA LYS A 6 25.768 35.901 16.761 1.00 0.00 H new ATOM 0 HB2 LYS A 6 23.676 34.526 16.416 1.00 0.00 H new ATOM 0 HB3 LYS A 6 24.140 33.505 17.762 1.00 0.00 H new ATOM 0 HG2 LYS A 6 24.087 35.458 19.303 1.00 0.00 H new ATOM 0 HG3 LYS A 6 23.720 36.531 17.967 1.00 0.00 H new ATOM 0 HD2 LYS A 6 21.600 35.251 17.527 1.00 0.00 H new ATOM 0 HD3 LYS A 6 21.966 34.187 18.870 1.00 0.00 H new ATOM 0 HE2 LYS A 6 21.958 36.148 20.433 1.00 0.00 H new ATOM 0 HE3 LYS A 6 21.610 37.221 19.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 19.584 36.592 20.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 19.552 35.986 18.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 19.890 34.946 19.974 1.00 0.00 H new ATOM 114 N THR A 7 26.916 35.865 18.979 1.00 0.00 N ATOM 115 CA THR A 7 27.656 35.831 20.275 1.00 0.00 C ATOM 116 C THR A 7 26.668 36.059 21.422 1.00 0.00 C ATOM 117 O THR A 7 25.479 36.196 21.207 1.00 0.00 O ATOM 118 CB THR A 7 28.713 36.939 20.287 1.00 0.00 C ATOM 119 OG1 THR A 7 28.069 38.204 20.259 1.00 0.00 O ATOM 120 CG2 THR A 7 29.620 36.798 19.064 1.00 0.00 C ATOM 0 H THR A 7 26.817 36.791 18.563 1.00 0.00 H new ATOM 0 HA THR A 7 28.143 34.863 20.395 1.00 0.00 H new ATOM 0 HB THR A 7 29.315 36.857 21.192 1.00 0.00 H new ATOM 0 HG1 THR A 7 28.416 38.764 20.985 1.00 0.00 H new ATOM 0 HG21 THR A 7 30.371 37.588 19.075 1.00 0.00 H new ATOM 0 HG22 THR A 7 30.114 35.827 19.088 1.00 0.00 H new ATOM 0 HG23 THR A 7 29.022 36.879 18.156 1.00 0.00 H new ATOM 128 N LEU A 8 27.141 36.101 22.637 1.00 0.00 N ATOM 129 CA LEU A 8 26.217 36.321 23.787 1.00 0.00 C ATOM 130 C LEU A 8 25.871 37.809 23.887 1.00 0.00 C ATOM 131 O LEU A 8 24.824 38.180 24.380 1.00 0.00 O ATOM 132 CB LEU A 8 26.893 35.872 25.084 1.00 0.00 C ATOM 133 CG LEU A 8 27.492 34.474 24.907 1.00 0.00 C ATOM 134 CD1 LEU A 8 28.078 34.001 26.240 1.00 0.00 C ATOM 135 CD2 LEU A 8 26.401 33.496 24.449 1.00 0.00 C ATOM 0 H LEU A 8 28.125 35.993 22.884 1.00 0.00 H new ATOM 0 HA LEU A 8 25.306 35.742 23.632 1.00 0.00 H new ATOM 0 HB2 LEU A 8 27.675 36.579 25.360 1.00 0.00 H new ATOM 0 HB3 LEU A 8 26.168 35.865 25.898 1.00 0.00 H new ATOM 0 HG LEU A 8 28.279 34.510 24.154 1.00 0.00 H new ATOM 0 HD11 LEU A 8 28.505 33.006 26.117 1.00 0.00 H new ATOM 0 HD12 LEU A 8 28.857 34.693 26.561 1.00 0.00 H new ATOM 0 HD13 LEU A 8 27.290 33.967 26.992 1.00 0.00 H new ATOM 0 HD21 LEU A 8 26.832 32.503 24.324 1.00 0.00 H new ATOM 0 HD22 LEU A 8 25.610 33.457 25.198 1.00 0.00 H new ATOM 0 HD23 LEU A 8 25.986 33.833 23.499 1.00 0.00 H new ATOM 147 N THR A 9 26.742 38.663 23.426 1.00 0.00 N ATOM 148 CA THR A 9 26.463 40.126 23.500 1.00 0.00 C ATOM 149 C THR A 9 25.522 40.524 22.360 1.00 0.00 C ATOM 150 O THR A 9 25.200 41.682 22.185 1.00 0.00 O ATOM 151 CB THR A 9 27.776 40.902 23.371 1.00 0.00 C ATOM 152 OG1 THR A 9 28.387 40.592 22.126 1.00 0.00 O ATOM 153 CG2 THR A 9 28.714 40.512 24.514 1.00 0.00 C ATOM 0 H THR A 9 27.635 38.412 23.001 1.00 0.00 H new ATOM 0 HA THR A 9 25.995 40.359 24.456 1.00 0.00 H new ATOM 0 HB THR A 9 27.573 41.972 23.419 1.00 0.00 H new ATOM 0 HG1 THR A 9 29.361 40.663 22.213 1.00 0.00 H new ATOM 0 HG21 THR A 9 29.649 41.065 24.422 1.00 0.00 H new ATOM 0 HG22 THR A 9 28.244 40.751 25.468 1.00 0.00 H new ATOM 0 HG23 THR A 9 28.919 39.442 24.468 1.00 0.00 H new ATOM 161 N GLY A 10 25.081 39.572 21.582 1.00 0.00 N ATOM 162 CA GLY A 10 24.163 39.892 20.449 1.00 0.00 C ATOM 163 C GLY A 10 24.989 40.244 19.212 1.00 0.00 C ATOM 164 O GLY A 10 24.478 40.323 18.113 1.00 0.00 O ATOM 0 H GLY A 10 25.317 38.585 21.682 1.00 0.00 H new ATOM 0 HA2 GLY A 10 23.517 39.040 20.238 1.00 0.00 H new ATOM 0 HA3 GLY A 10 23.514 40.726 20.716 1.00 0.00 H new ATOM 168 N LYS A 11 26.265 40.452 19.384 1.00 0.00 N ATOM 169 CA LYS A 11 27.126 40.795 18.217 1.00 0.00 C ATOM 170 C LYS A 11 27.097 39.640 17.215 1.00 0.00 C ATOM 171 O LYS A 11 27.841 38.686 17.333 1.00 0.00 O ATOM 172 CB LYS A 11 28.562 41.027 18.690 1.00 0.00 C ATOM 173 CG LYS A 11 28.616 42.284 19.561 1.00 0.00 C ATOM 174 CD LYS A 11 30.051 42.512 20.040 1.00 0.00 C ATOM 175 CE LYS A 11 30.099 43.749 20.939 1.00 0.00 C ATOM 176 NZ LYS A 11 29.692 44.949 20.153 1.00 0.00 N ATOM 0 H LYS A 11 26.748 40.399 20.281 1.00 0.00 H new ATOM 0 HA LYS A 11 26.754 41.702 17.741 1.00 0.00 H new ATOM 0 HB2 LYS A 11 28.914 40.164 19.256 1.00 0.00 H new ATOM 0 HB3 LYS A 11 29.225 41.137 17.832 1.00 0.00 H new ATOM 0 HG2 LYS A 11 28.269 43.148 18.994 1.00 0.00 H new ATOM 0 HG3 LYS A 11 27.949 42.176 20.416 1.00 0.00 H new ATOM 0 HD2 LYS A 11 30.406 41.638 20.586 1.00 0.00 H new ATOM 0 HD3 LYS A 11 30.714 42.645 19.185 1.00 0.00 H new ATOM 0 HE2 LYS A 11 29.434 43.617 21.793 1.00 0.00 H new ATOM 0 HE3 LYS A 11 31.105 43.885 21.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 30.036 45.808 20.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 30.101 44.894 19.198 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 28.655 44.984 20.084 1.00 0.00 H new ATOM 190 N THR A 12 26.236 39.717 16.232 1.00 0.00 N ATOM 191 CA THR A 12 26.142 38.625 15.213 1.00 0.00 C ATOM 192 C THR A 12 26.846 39.061 13.928 1.00 0.00 C ATOM 193 O THR A 12 26.537 40.091 13.363 1.00 0.00 O ATOM 194 CB THR A 12 24.668 38.344 14.910 1.00 0.00 C ATOM 195 OG1 THR A 12 24.008 37.943 16.101 1.00 0.00 O ATOM 196 CG2 THR A 12 24.564 37.230 13.866 1.00 0.00 C ATOM 0 H THR A 12 25.590 40.493 16.090 1.00 0.00 H new ATOM 0 HA THR A 12 26.618 37.724 15.600 1.00 0.00 H new ATOM 0 HB THR A 12 24.198 39.248 14.522 1.00 0.00 H new ATOM 0 HG1 THR A 12 23.987 38.693 16.732 1.00 0.00 H new ATOM 0 HG21 THR A 12 23.514 37.030 13.651 1.00 0.00 H new ATOM 0 HG22 THR A 12 25.070 37.540 12.951 1.00 0.00 H new ATOM 0 HG23 THR A 12 25.034 36.325 14.251 1.00 0.00 H new ATOM 204 N ILE A 13 27.789 38.279 13.460 1.00 0.00 N ATOM 205 CA ILE A 13 28.527 38.624 12.204 1.00 0.00 C ATOM 206 C ILE A 13 28.189 37.585 11.132 1.00 0.00 C ATOM 207 O ILE A 13 27.825 36.465 11.439 1.00 0.00 O ATOM 208 CB ILE A 13 30.032 38.598 12.476 1.00 0.00 C ATOM 209 CG1 ILE A 13 30.379 39.667 13.515 1.00 0.00 C ATOM 210 CG2 ILE A 13 30.792 38.881 11.180 1.00 0.00 C ATOM 211 CD1 ILE A 13 31.822 39.471 13.987 1.00 0.00 C ATOM 0 H ILE A 13 28.082 37.407 13.900 1.00 0.00 H new ATOM 0 HA ILE A 13 28.237 39.618 11.864 1.00 0.00 H new ATOM 0 HB ILE A 13 30.316 37.616 12.854 1.00 0.00 H new ATOM 0 HG12 ILE A 13 30.258 40.661 13.084 1.00 0.00 H new ATOM 0 HG13 ILE A 13 29.696 39.601 14.362 1.00 0.00 H new ATOM 0 HG21 ILE A 13 31.864 38.862 11.375 1.00 0.00 H new ATOM 0 HG22 ILE A 13 30.545 38.120 10.440 1.00 0.00 H new ATOM 0 HG23 ILE A 13 30.510 39.863 10.800 1.00 0.00 H new ATOM 0 HD11 ILE A 13 32.069 40.232 14.727 1.00 0.00 H new ATOM 0 HD12 ILE A 13 31.927 38.483 14.434 1.00 0.00 H new ATOM 0 HD13 ILE A 13 32.498 39.559 13.136 1.00 0.00 H new ATOM 223 N THR A 14 28.313 37.942 9.876 1.00 0.00 N ATOM 224 CA THR A 14 28.007 36.976 8.774 1.00 0.00 C ATOM 225 C THR A 14 29.317 36.533 8.118 1.00 0.00 C ATOM 226 O THR A 14 30.106 37.345 7.680 1.00 0.00 O ATOM 227 CB THR A 14 27.129 37.666 7.727 1.00 0.00 C ATOM 228 OG1 THR A 14 25.911 38.079 8.332 1.00 0.00 O ATOM 229 CG2 THR A 14 26.831 36.694 6.587 1.00 0.00 C ATOM 0 H THR A 14 28.615 38.866 9.566 1.00 0.00 H new ATOM 0 HA THR A 14 27.484 36.109 9.178 1.00 0.00 H new ATOM 0 HB THR A 14 27.652 38.536 7.330 1.00 0.00 H new ATOM 0 HG1 THR A 14 25.348 38.523 7.664 1.00 0.00 H new ATOM 0 HG21 THR A 14 26.206 37.187 5.843 1.00 0.00 H new ATOM 0 HG22 THR A 14 27.766 36.378 6.124 1.00 0.00 H new ATOM 0 HG23 THR A 14 26.308 35.822 6.980 1.00 0.00 H new ATOM 237 N LEU A 15 29.550 35.243 8.047 1.00 0.00 N ATOM 238 CA LEU A 15 30.808 34.721 7.419 1.00 0.00 C ATOM 239 C LEU A 15 30.442 33.785 6.266 1.00 0.00 C ATOM 240 O LEU A 15 29.816 32.762 6.460 1.00 0.00 O ATOM 241 CB LEU A 15 31.610 33.937 8.462 1.00 0.00 C ATOM 242 CG LEU A 15 31.787 34.782 9.729 1.00 0.00 C ATOM 243 CD1 LEU A 15 32.490 33.942 10.799 1.00 0.00 C ATOM 244 CD2 LEU A 15 32.634 36.022 9.414 1.00 0.00 C ATOM 0 H LEU A 15 28.918 34.524 8.400 1.00 0.00 H new ATOM 0 HA LEU A 15 31.404 35.555 7.047 1.00 0.00 H new ATOM 0 HB2 LEU A 15 31.096 33.007 8.704 1.00 0.00 H new ATOM 0 HB3 LEU A 15 32.585 33.667 8.056 1.00 0.00 H new ATOM 0 HG LEU A 15 30.810 35.100 10.092 1.00 0.00 H new ATOM 0 HD11 LEU A 15 32.619 34.538 11.703 1.00 0.00 H new ATOM 0 HD12 LEU A 15 31.886 33.063 11.026 1.00 0.00 H new ATOM 0 HD13 LEU A 15 33.466 33.626 10.431 1.00 0.00 H new ATOM 0 HD21 LEU A 15 32.756 36.618 10.318 1.00 0.00 H new ATOM 0 HD22 LEU A 15 33.613 35.711 9.049 1.00 0.00 H new ATOM 0 HD23 LEU A 15 32.135 36.619 8.650 1.00 0.00 H new ATOM 256 N GLU A 16 30.832 34.124 5.065 1.00 0.00 N ATOM 257 CA GLU A 16 30.509 33.253 3.895 1.00 0.00 C ATOM 258 C GLU A 16 31.689 32.321 3.614 1.00 0.00 C ATOM 259 O GLU A 16 32.751 32.752 3.210 1.00 0.00 O ATOM 260 CB GLU A 16 30.251 34.128 2.667 1.00 0.00 C ATOM 261 CG GLU A 16 28.998 34.974 2.896 1.00 0.00 C ATOM 262 CD GLU A 16 28.747 35.859 1.673 1.00 0.00 C ATOM 263 OE1 GLU A 16 29.578 35.849 0.779 1.00 0.00 O ATOM 264 OE2 GLU A 16 27.730 36.533 1.652 1.00 0.00 O ATOM 0 H GLU A 16 31.361 34.967 4.843 1.00 0.00 H new ATOM 0 HA GLU A 16 29.621 32.661 4.115 1.00 0.00 H new ATOM 0 HB2 GLU A 16 31.109 34.774 2.481 1.00 0.00 H new ATOM 0 HB3 GLU A 16 30.124 33.503 1.783 1.00 0.00 H new ATOM 0 HG2 GLU A 16 28.138 34.328 3.073 1.00 0.00 H new ATOM 0 HG3 GLU A 16 29.121 35.592 3.786 1.00 0.00 H new ATOM 271 N VAL A 17 31.514 31.045 3.825 1.00 0.00 N ATOM 272 CA VAL A 17 32.624 30.086 3.572 1.00 0.00 C ATOM 273 C VAL A 17 32.042 28.682 3.375 1.00 0.00 C ATOM 274 O VAL A 17 31.030 28.331 3.946 1.00 0.00 O ATOM 275 CB VAL A 17 33.585 30.098 4.768 1.00 0.00 C ATOM 276 CG1 VAL A 17 32.784 30.019 6.069 1.00 0.00 C ATOM 277 CG2 VAL A 17 34.545 28.905 4.686 1.00 0.00 C ATOM 0 H VAL A 17 30.648 30.625 4.162 1.00 0.00 H new ATOM 0 HA VAL A 17 33.170 30.375 2.674 1.00 0.00 H new ATOM 0 HB VAL A 17 34.163 31.022 4.749 1.00 0.00 H new ATOM 0 HG11 VAL A 17 33.467 30.028 6.918 1.00 0.00 H new ATOM 0 HG12 VAL A 17 32.112 30.875 6.135 1.00 0.00 H new ATOM 0 HG13 VAL A 17 32.201 29.098 6.082 1.00 0.00 H new ATOM 0 HG21 VAL A 17 35.222 28.924 5.540 1.00 0.00 H new ATOM 0 HG22 VAL A 17 33.974 27.977 4.696 1.00 0.00 H new ATOM 0 HG23 VAL A 17 35.122 28.965 3.763 1.00 0.00 H new ATOM 287 N GLU A 18 32.673 27.882 2.558 1.00 0.00 N ATOM 288 CA GLU A 18 32.153 26.507 2.310 1.00 0.00 C ATOM 289 C GLU A 18 31.923 25.794 3.652 1.00 0.00 C ATOM 290 O GLU A 18 32.612 26.056 4.617 1.00 0.00 O ATOM 291 CB GLU A 18 33.172 25.720 1.484 1.00 0.00 C ATOM 292 CG GLU A 18 33.217 26.280 0.060 1.00 0.00 C ATOM 293 CD GLU A 18 34.258 25.513 -0.758 1.00 0.00 C ATOM 294 OE1 GLU A 18 34.917 24.658 -0.190 1.00 0.00 O ATOM 295 OE2 GLU A 18 34.377 25.793 -1.940 1.00 0.00 O ATOM 0 H GLU A 18 33.526 28.121 2.052 1.00 0.00 H new ATOM 0 HA GLU A 18 31.210 26.568 1.766 1.00 0.00 H new ATOM 0 HB2 GLU A 18 34.158 25.787 1.944 1.00 0.00 H new ATOM 0 HB3 GLU A 18 32.901 24.664 1.463 1.00 0.00 H new ATOM 0 HG2 GLU A 18 32.236 26.193 -0.407 1.00 0.00 H new ATOM 0 HG3 GLU A 18 33.467 27.341 0.083 1.00 0.00 H new ATOM 302 N PRO A 19 30.963 24.895 3.723 1.00 0.00 N ATOM 303 CA PRO A 19 30.658 24.145 4.980 1.00 0.00 C ATOM 304 C PRO A 19 31.660 23.014 5.250 1.00 0.00 C ATOM 305 O PRO A 19 31.789 22.545 6.362 1.00 0.00 O ATOM 306 CB PRO A 19 29.262 23.575 4.710 1.00 0.00 C ATOM 307 CG PRO A 19 29.238 23.346 3.236 1.00 0.00 C ATOM 308 CD PRO A 19 30.058 24.487 2.625 1.00 0.00 C ATOM 0 HA PRO A 19 30.715 24.782 5.862 1.00 0.00 H new ATOM 0 HB2 PRO A 19 29.097 22.648 5.260 1.00 0.00 H new ATOM 0 HB3 PRO A 19 28.482 24.271 5.018 1.00 0.00 H new ATOM 0 HG2 PRO A 19 29.668 22.377 2.983 1.00 0.00 H new ATOM 0 HG3 PRO A 19 28.217 23.351 2.856 1.00 0.00 H new ATOM 0 HD2 PRO A 19 30.615 24.155 1.749 1.00 0.00 H new ATOM 0 HD3 PRO A 19 29.421 25.311 2.304 1.00 0.00 H new ATOM 316 N SER A 20 32.359 22.561 4.246 1.00 0.00 N ATOM 317 CA SER A 20 33.331 21.452 4.467 1.00 0.00 C ATOM 318 C SER A 20 34.577 21.988 5.177 1.00 0.00 C ATOM 319 O SER A 20 35.455 21.240 5.558 1.00 0.00 O ATOM 320 CB SER A 20 33.722 20.836 3.123 1.00 0.00 C ATOM 321 OG SER A 20 32.571 20.760 2.291 1.00 0.00 O ATOM 0 H SER A 20 32.301 22.907 3.288 1.00 0.00 H new ATOM 0 HA SER A 20 32.869 20.687 5.091 1.00 0.00 H new ATOM 0 HB2 SER A 20 34.493 21.439 2.643 1.00 0.00 H new ATOM 0 HB3 SER A 20 34.143 19.842 3.274 1.00 0.00 H new ATOM 0 HG SER A 20 32.817 20.367 1.427 1.00 0.00 H new ATOM 327 N ASP A 21 34.657 23.274 5.366 1.00 0.00 N ATOM 328 CA ASP A 21 35.832 23.853 6.057 1.00 0.00 C ATOM 329 C ASP A 21 35.958 23.200 7.437 1.00 0.00 C ATOM 330 O ASP A 21 34.988 22.725 7.994 1.00 0.00 O ATOM 331 CB ASP A 21 35.616 25.361 6.200 1.00 0.00 C ATOM 332 CG ASP A 21 36.010 26.062 4.895 1.00 0.00 C ATOM 333 OD1 ASP A 21 37.163 26.442 4.775 1.00 0.00 O ATOM 334 OD2 ASP A 21 35.156 26.196 4.035 1.00 0.00 O ATOM 0 H ASP A 21 33.953 23.950 5.069 1.00 0.00 H new ATOM 0 HA ASP A 21 36.746 23.672 5.491 1.00 0.00 H new ATOM 0 HB2 ASP A 21 34.572 25.569 6.435 1.00 0.00 H new ATOM 0 HB3 ASP A 21 36.212 25.747 7.027 1.00 0.00 H new ATOM 339 N THR A 22 37.139 23.163 7.994 1.00 0.00 N ATOM 340 CA THR A 22 37.305 22.528 9.332 1.00 0.00 C ATOM 341 C THR A 22 36.914 23.520 10.430 1.00 0.00 C ATOM 342 O THR A 22 37.152 24.706 10.323 1.00 0.00 O ATOM 343 CB THR A 22 38.765 22.111 9.516 1.00 0.00 C ATOM 344 OG1 THR A 22 39.597 23.259 9.439 1.00 0.00 O ATOM 345 CG2 THR A 22 39.156 21.121 8.418 1.00 0.00 C ATOM 0 H THR A 22 37.991 23.543 7.582 1.00 0.00 H new ATOM 0 HA THR A 22 36.662 21.651 9.398 1.00 0.00 H new ATOM 0 HB THR A 22 38.888 21.638 10.490 1.00 0.00 H new ATOM 0 HG1 THR A 22 40.533 22.993 9.558 1.00 0.00 H new ATOM 0 HG21 THR A 22 40.197 20.824 8.549 1.00 0.00 H new ATOM 0 HG22 THR A 22 38.517 20.240 8.478 1.00 0.00 H new ATOM 0 HG23 THR A 22 39.034 21.592 7.443 1.00 0.00 H new ATOM 353 N ILE A 23 36.305 23.042 11.483 1.00 0.00 N ATOM 354 CA ILE A 23 35.889 23.963 12.583 1.00 0.00 C ATOM 355 C ILE A 23 37.046 24.902 12.938 1.00 0.00 C ATOM 356 O ILE A 23 36.890 26.106 12.972 1.00 0.00 O ATOM 357 CB ILE A 23 35.485 23.162 13.831 1.00 0.00 C ATOM 358 CG1 ILE A 23 34.535 21.996 13.440 1.00 0.00 C ATOM 359 CG2 ILE A 23 34.776 24.105 14.812 1.00 0.00 C ATOM 360 CD1 ILE A 23 35.326 20.695 13.250 1.00 0.00 C ATOM 0 H ILE A 23 36.078 22.058 11.629 1.00 0.00 H new ATOM 0 HA ILE A 23 35.033 24.545 12.242 1.00 0.00 H new ATOM 0 HB ILE A 23 36.375 22.739 14.297 1.00 0.00 H new ATOM 0 HG12 ILE A 23 33.780 21.859 14.215 1.00 0.00 H new ATOM 0 HG13 ILE A 23 34.006 22.244 12.520 1.00 0.00 H new ATOM 0 HG21 ILE A 23 34.483 23.550 15.703 1.00 0.00 H new ATOM 0 HG22 ILE A 23 35.452 24.913 15.093 1.00 0.00 H new ATOM 0 HG23 ILE A 23 33.888 24.523 14.337 1.00 0.00 H new ATOM 0 HD11 ILE A 23 34.643 19.891 12.977 1.00 0.00 H new ATOM 0 HD12 ILE A 23 36.063 20.830 12.459 1.00 0.00 H new ATOM 0 HD13 ILE A 23 35.834 20.439 14.180 1.00 0.00 H new ATOM 372 N GLU A 24 38.206 24.362 13.199 1.00 0.00 N ATOM 373 CA GLU A 24 39.371 25.226 13.545 1.00 0.00 C ATOM 374 C GLU A 24 39.467 26.378 12.545 1.00 0.00 C ATOM 375 O GLU A 24 39.884 27.469 12.877 1.00 0.00 O ATOM 376 CB GLU A 24 40.655 24.396 13.492 1.00 0.00 C ATOM 377 CG GLU A 24 40.665 23.549 12.218 1.00 0.00 C ATOM 378 CD GLU A 24 41.967 22.749 12.146 1.00 0.00 C ATOM 379 OE1 GLU A 24 42.547 22.502 13.191 1.00 0.00 O ATOM 380 OE2 GLU A 24 42.364 22.398 11.048 1.00 0.00 O ATOM 0 H GLU A 24 38.397 23.360 13.188 1.00 0.00 H new ATOM 0 HA GLU A 24 39.239 25.628 14.550 1.00 0.00 H new ATOM 0 HB2 GLU A 24 41.525 25.052 13.512 1.00 0.00 H new ATOM 0 HB3 GLU A 24 40.721 23.753 14.369 1.00 0.00 H new ATOM 0 HG2 GLU A 24 39.810 22.873 12.211 1.00 0.00 H new ATOM 0 HG3 GLU A 24 40.571 24.190 11.342 1.00 0.00 H new ATOM 387 N ASN A 25 39.066 26.149 11.323 1.00 0.00 N ATOM 388 CA ASN A 25 39.118 27.239 10.312 1.00 0.00 C ATOM 389 C ASN A 25 38.120 28.314 10.724 1.00 0.00 C ATOM 390 O ASN A 25 38.395 29.497 10.654 1.00 0.00 O ATOM 391 CB ASN A 25 38.744 26.686 8.935 1.00 0.00 C ATOM 392 CG ASN A 25 39.125 27.701 7.855 1.00 0.00 C ATOM 393 OD1 ASN A 25 40.126 28.379 7.970 1.00 0.00 O ATOM 394 ND2 ASN A 25 38.363 27.835 6.806 1.00 0.00 N ATOM 0 H ASN A 25 38.706 25.257 10.984 1.00 0.00 H new ATOM 0 HA ASN A 25 40.123 27.657 10.258 1.00 0.00 H new ATOM 0 HB2 ASN A 25 39.259 25.742 8.759 1.00 0.00 H new ATOM 0 HB3 ASN A 25 37.675 26.479 8.893 1.00 0.00 H new ATOM 0 HD21 ASN A 25 38.607 28.510 6.081 1.00 0.00 H new ATOM 0 HD22 ASN A 25 37.522 27.265 6.710 1.00 0.00 H new ATOM 401 N VAL A 26 36.966 27.908 11.177 1.00 0.00 N ATOM 402 CA VAL A 26 35.955 28.901 11.623 1.00 0.00 C ATOM 403 C VAL A 26 36.554 29.695 12.778 1.00 0.00 C ATOM 404 O VAL A 26 36.753 30.889 12.684 1.00 0.00 O ATOM 405 CB VAL A 26 34.701 28.170 12.098 1.00 0.00 C ATOM 406 CG1 VAL A 26 33.599 29.185 12.394 1.00 0.00 C ATOM 407 CG2 VAL A 26 34.228 27.208 11.006 1.00 0.00 C ATOM 0 H VAL A 26 36.682 26.932 11.257 1.00 0.00 H new ATOM 0 HA VAL A 26 35.686 29.568 10.804 1.00 0.00 H new ATOM 0 HB VAL A 26 34.930 27.609 13.004 1.00 0.00 H new ATOM 0 HG11 VAL A 26 32.704 28.662 12.733 1.00 0.00 H new ATOM 0 HG12 VAL A 26 33.935 29.871 13.172 1.00 0.00 H new ATOM 0 HG13 VAL A 26 33.370 29.747 11.489 1.00 0.00 H new ATOM 0 HG21 VAL A 26 33.333 26.686 11.344 1.00 0.00 H new ATOM 0 HG22 VAL A 26 34.000 27.770 10.100 1.00 0.00 H new ATOM 0 HG23 VAL A 26 35.014 26.482 10.795 1.00 0.00 H new ATOM 417 N LYS A 27 36.848 29.025 13.867 1.00 0.00 N ATOM 418 CA LYS A 27 37.450 29.703 15.054 1.00 0.00 C ATOM 419 C LYS A 27 38.467 30.753 14.597 1.00 0.00 C ATOM 420 O LYS A 27 38.691 31.748 15.258 1.00 0.00 O ATOM 421 CB LYS A 27 38.155 28.652 15.913 1.00 0.00 C ATOM 422 CG LYS A 27 37.117 27.719 16.541 1.00 0.00 C ATOM 423 CD LYS A 27 37.797 26.839 17.592 1.00 0.00 C ATOM 424 CE LYS A 27 36.833 25.740 18.043 1.00 0.00 C ATOM 425 NZ LYS A 27 36.697 24.725 16.959 1.00 0.00 N ATOM 0 H LYS A 27 36.693 28.023 13.983 1.00 0.00 H new ATOM 0 HA LYS A 27 36.667 30.197 15.630 1.00 0.00 H new ATOM 0 HB2 LYS A 27 38.852 28.078 15.303 1.00 0.00 H new ATOM 0 HB3 LYS A 27 38.740 29.139 16.693 1.00 0.00 H new ATOM 0 HG2 LYS A 27 36.318 28.302 17.000 1.00 0.00 H new ATOM 0 HG3 LYS A 27 36.657 27.098 15.772 1.00 0.00 H new ATOM 0 HD2 LYS A 27 38.703 26.395 17.178 1.00 0.00 H new ATOM 0 HD3 LYS A 27 38.100 27.444 18.447 1.00 0.00 H new ATOM 0 HE2 LYS A 27 37.202 25.268 18.954 1.00 0.00 H new ATOM 0 HE3 LYS A 27 35.859 26.169 18.279 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 35.702 24.433 16.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 37.010 25.137 16.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 37.284 23.896 17.184 1.00 0.00 H new ATOM 439 N ALA A 28 39.074 30.540 13.462 1.00 0.00 N ATOM 440 CA ALA A 28 40.066 31.528 12.952 1.00 0.00 C ATOM 441 C ALA A 28 39.337 32.834 12.620 1.00 0.00 C ATOM 442 O ALA A 28 39.649 33.884 13.145 1.00 0.00 O ATOM 443 CB ALA A 28 40.736 30.967 11.694 1.00 0.00 C ATOM 0 H ALA A 28 38.926 29.725 12.866 1.00 0.00 H new ATOM 0 HA ALA A 28 40.829 31.720 13.706 1.00 0.00 H new ATOM 0 HB1 ALA A 28 41.463 31.687 11.317 1.00 0.00 H new ATOM 0 HB2 ALA A 28 41.243 30.033 11.937 1.00 0.00 H new ATOM 0 HB3 ALA A 28 39.980 30.782 10.931 1.00 0.00 H new ATOM 449 N LYS A 29 38.363 32.772 11.752 1.00 0.00 N ATOM 450 CA LYS A 29 37.608 34.006 11.385 1.00 0.00 C ATOM 451 C LYS A 29 37.167 34.715 12.669 1.00 0.00 C ATOM 452 O LYS A 29 37.069 35.920 12.729 1.00 0.00 O ATOM 453 CB LYS A 29 36.376 33.627 10.556 1.00 0.00 C ATOM 454 CG LYS A 29 36.788 33.352 9.105 1.00 0.00 C ATOM 455 CD LYS A 29 37.702 32.124 9.053 1.00 0.00 C ATOM 456 CE LYS A 29 37.796 31.616 7.613 1.00 0.00 C ATOM 457 NZ LYS A 29 38.705 30.436 7.560 1.00 0.00 N ATOM 0 H LYS A 29 38.057 31.920 11.281 1.00 0.00 H new ATOM 0 HA LYS A 29 38.243 34.668 10.796 1.00 0.00 H new ATOM 0 HB2 LYS A 29 35.898 32.744 10.981 1.00 0.00 H new ATOM 0 HB3 LYS A 29 35.643 34.433 10.589 1.00 0.00 H new ATOM 0 HG2 LYS A 29 35.903 33.185 8.491 1.00 0.00 H new ATOM 0 HG3 LYS A 29 37.304 34.219 8.692 1.00 0.00 H new ATOM 0 HD2 LYS A 29 38.694 32.380 9.425 1.00 0.00 H new ATOM 0 HD3 LYS A 29 37.312 31.340 9.701 1.00 0.00 H new ATOM 0 HE2 LYS A 29 36.806 31.343 7.247 1.00 0.00 H new ATOM 0 HE3 LYS A 29 38.170 32.406 6.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 38.985 30.257 6.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 39.553 30.625 8.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 38.212 29.601 7.937 1.00 0.00 H new ATOM 471 N ILE A 30 36.926 33.977 13.705 1.00 0.00 N ATOM 472 CA ILE A 30 36.518 34.614 14.981 1.00 0.00 C ATOM 473 C ILE A 30 37.767 35.237 15.618 1.00 0.00 C ATOM 474 O ILE A 30 37.879 36.436 15.760 1.00 0.00 O ATOM 475 CB ILE A 30 35.914 33.538 15.900 1.00 0.00 C ATOM 476 CG1 ILE A 30 34.468 33.243 15.473 1.00 0.00 C ATOM 477 CG2 ILE A 30 35.910 34.025 17.355 1.00 0.00 C ATOM 478 CD1 ILE A 30 34.403 32.994 13.963 1.00 0.00 C ATOM 0 H ILE A 30 36.993 32.959 13.726 1.00 0.00 H new ATOM 0 HA ILE A 30 35.770 35.390 14.817 1.00 0.00 H new ATOM 0 HB ILE A 30 36.518 32.634 15.820 1.00 0.00 H new ATOM 0 HG12 ILE A 30 34.093 32.371 16.009 1.00 0.00 H new ATOM 0 HG13 ILE A 30 33.824 34.082 15.739 1.00 0.00 H new ATOM 0 HG21 ILE A 30 35.480 33.255 17.995 1.00 0.00 H new ATOM 0 HG22 ILE A 30 36.932 34.232 17.672 1.00 0.00 H new ATOM 0 HG23 ILE A 30 35.315 34.935 17.433 1.00 0.00 H new ATOM 0 HD11 ILE A 30 33.373 32.786 13.673 1.00 0.00 H new ATOM 0 HD12 ILE A 30 34.758 33.878 13.433 1.00 0.00 H new ATOM 0 HD13 ILE A 30 35.031 32.141 13.708 1.00 0.00 H new ATOM 490 N GLN A 31 38.695 34.415 16.001 1.00 0.00 N ATOM 491 CA GLN A 31 39.939 34.913 16.637 1.00 0.00 C ATOM 492 C GLN A 31 40.512 36.111 15.861 1.00 0.00 C ATOM 493 O GLN A 31 40.846 37.128 16.435 1.00 0.00 O ATOM 494 CB GLN A 31 40.959 33.775 16.649 1.00 0.00 C ATOM 495 CG GLN A 31 42.301 34.289 17.159 1.00 0.00 C ATOM 496 CD GLN A 31 43.221 33.106 17.465 1.00 0.00 C ATOM 497 OE1 GLN A 31 43.251 32.616 18.577 1.00 0.00 O ATOM 498 NE2 GLN A 31 43.979 32.623 16.520 1.00 0.00 N ATOM 0 H GLN A 31 38.644 33.401 15.899 1.00 0.00 H new ATOM 0 HA GLN A 31 39.718 35.244 17.652 1.00 0.00 H new ATOM 0 HB2 GLN A 31 40.605 32.964 17.285 1.00 0.00 H new ATOM 0 HB3 GLN A 31 41.074 33.366 15.645 1.00 0.00 H new ATOM 0 HG2 GLN A 31 42.761 34.937 16.413 1.00 0.00 H new ATOM 0 HG3 GLN A 31 42.154 34.890 18.056 1.00 0.00 H new ATOM 0 HE21 GLN A 31 43.954 33.034 15.587 1.00 0.00 H new ATOM 0 HE22 GLN A 31 44.596 31.835 16.714 1.00 0.00 H new ATOM 507 N ASP A 32 40.668 35.984 14.568 1.00 0.00 N ATOM 508 CA ASP A 32 41.268 37.098 13.760 1.00 0.00 C ATOM 509 C ASP A 32 40.363 38.341 13.709 1.00 0.00 C ATOM 510 O ASP A 32 40.830 39.429 13.435 1.00 0.00 O ATOM 511 CB ASP A 32 41.509 36.599 12.334 1.00 0.00 C ATOM 512 CG ASP A 32 42.394 37.597 11.587 1.00 0.00 C ATOM 513 OD1 ASP A 32 42.660 38.651 12.138 1.00 0.00 O ATOM 514 OD2 ASP A 32 42.791 37.288 10.476 1.00 0.00 O ATOM 0 H ASP A 32 40.406 35.156 14.032 1.00 0.00 H new ATOM 0 HA ASP A 32 42.202 37.391 14.240 1.00 0.00 H new ATOM 0 HB2 ASP A 32 41.986 35.619 12.356 1.00 0.00 H new ATOM 0 HB3 ASP A 32 40.559 36.479 11.814 1.00 0.00 H new ATOM 519 N LYS A 33 39.086 38.206 13.965 1.00 0.00 N ATOM 520 CA LYS A 33 38.177 39.394 13.923 1.00 0.00 C ATOM 521 C LYS A 33 37.908 39.915 15.337 1.00 0.00 C ATOM 522 O LYS A 33 37.951 41.104 15.584 1.00 0.00 O ATOM 523 CB LYS A 33 36.857 38.993 13.267 1.00 0.00 C ATOM 524 CG LYS A 33 37.112 38.405 11.863 1.00 0.00 C ATOM 525 CD LYS A 33 37.295 39.528 10.834 1.00 0.00 C ATOM 526 CE LYS A 33 35.932 40.036 10.335 1.00 0.00 C ATOM 527 NZ LYS A 33 35.475 39.184 9.202 1.00 0.00 N ATOM 0 H LYS A 33 38.632 37.324 14.202 1.00 0.00 H new ATOM 0 HA LYS A 33 38.655 40.185 13.346 1.00 0.00 H new ATOM 0 HB2 LYS A 33 36.343 38.259 13.888 1.00 0.00 H new ATOM 0 HB3 LYS A 33 36.202 39.861 13.191 1.00 0.00 H new ATOM 0 HG2 LYS A 33 38.000 37.774 11.883 1.00 0.00 H new ATOM 0 HG3 LYS A 33 36.276 37.769 11.571 1.00 0.00 H new ATOM 0 HD2 LYS A 33 37.853 40.350 11.281 1.00 0.00 H new ATOM 0 HD3 LYS A 33 37.883 39.164 9.992 1.00 0.00 H new ATOM 0 HE2 LYS A 33 35.202 40.008 11.144 1.00 0.00 H new ATOM 0 HE3 LYS A 33 36.013 41.075 10.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 34.553 39.524 8.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 36.169 39.233 8.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 35.383 38.199 9.523 1.00 0.00 H new ATOM 541 N GLU A 34 37.632 39.046 16.270 1.00 0.00 N ATOM 542 CA GLU A 34 37.363 39.509 17.662 1.00 0.00 C ATOM 543 C GLU A 34 38.692 39.670 18.401 1.00 0.00 C ATOM 544 O GLU A 34 38.795 40.404 19.364 1.00 0.00 O ATOM 545 CB GLU A 34 36.491 38.479 18.387 1.00 0.00 C ATOM 546 CG GLU A 34 35.358 38.030 17.463 1.00 0.00 C ATOM 547 CD GLU A 34 34.350 37.199 18.260 1.00 0.00 C ATOM 548 OE1 GLU A 34 34.779 36.450 19.121 1.00 0.00 O ATOM 549 OE2 GLU A 34 33.166 37.327 17.993 1.00 0.00 O ATOM 0 H GLU A 34 37.581 38.037 16.130 1.00 0.00 H new ATOM 0 HA GLU A 34 36.840 40.465 17.637 1.00 0.00 H new ATOM 0 HB2 GLU A 34 37.094 37.621 18.684 1.00 0.00 H new ATOM 0 HB3 GLU A 34 36.081 38.912 19.299 1.00 0.00 H new ATOM 0 HG2 GLU A 34 34.865 38.898 17.026 1.00 0.00 H new ATOM 0 HG3 GLU A 34 35.759 37.442 16.638 1.00 0.00 H new ATOM 556 N GLY A 35 39.711 38.987 17.955 1.00 0.00 N ATOM 557 CA GLY A 35 41.036 39.095 18.626 1.00 0.00 C ATOM 558 C GLY A 35 40.978 38.402 19.985 1.00 0.00 C ATOM 559 O GLY A 35 41.840 38.576 20.823 1.00 0.00 O ATOM 0 H GLY A 35 39.682 38.358 17.153 1.00 0.00 H new ATOM 0 HA2 GLY A 35 41.808 38.638 18.006 1.00 0.00 H new ATOM 0 HA3 GLY A 35 41.307 40.143 18.752 1.00 0.00 H new ATOM 563 N ILE A 36 39.960 37.621 20.206 1.00 0.00 N ATOM 564 CA ILE A 36 39.814 36.907 21.499 1.00 0.00 C ATOM 565 C ILE A 36 40.461 35.514 21.378 1.00 0.00 C ATOM 566 O ILE A 36 40.261 34.833 20.393 1.00 0.00 O ATOM 567 CB ILE A 36 38.327 36.768 21.781 1.00 0.00 C ATOM 568 CG1 ILE A 36 37.697 38.159 21.742 1.00 0.00 C ATOM 569 CG2 ILE A 36 38.119 36.153 23.159 1.00 0.00 C ATOM 570 CD1 ILE A 36 36.206 38.045 22.024 1.00 0.00 C ATOM 0 H ILE A 36 39.213 37.446 19.534 1.00 0.00 H new ATOM 0 HA ILE A 36 40.301 37.452 22.308 1.00 0.00 H new ATOM 0 HB ILE A 36 37.864 36.123 21.034 1.00 0.00 H new ATOM 0 HG12 ILE A 36 38.170 38.806 22.481 1.00 0.00 H new ATOM 0 HG13 ILE A 36 37.860 38.617 20.767 1.00 0.00 H new ATOM 0 HG21 ILE A 36 37.051 36.055 23.357 1.00 0.00 H new ATOM 0 HG22 ILE A 36 38.586 35.169 23.192 1.00 0.00 H new ATOM 0 HG23 ILE A 36 38.571 36.794 23.916 1.00 0.00 H new ATOM 0 HD11 ILE A 36 35.754 39.036 21.997 1.00 0.00 H new ATOM 0 HD12 ILE A 36 35.740 37.413 21.268 1.00 0.00 H new ATOM 0 HD13 ILE A 36 36.055 37.604 23.009 1.00 0.00 H new ATOM 582 N PRO A 37 41.229 35.079 22.356 1.00 0.00 N ATOM 583 CA PRO A 37 41.888 33.739 22.303 1.00 0.00 C ATOM 584 C PRO A 37 40.880 32.595 22.561 1.00 0.00 C ATOM 585 O PRO A 37 40.247 32.564 23.597 1.00 0.00 O ATOM 586 CB PRO A 37 42.926 33.810 23.434 1.00 0.00 C ATOM 587 CG PRO A 37 42.341 34.764 24.424 1.00 0.00 C ATOM 588 CD PRO A 37 41.559 35.795 23.606 1.00 0.00 C ATOM 0 HA PRO A 37 42.323 33.527 21.326 1.00 0.00 H new ATOM 0 HB2 PRO A 37 43.094 32.830 23.880 1.00 0.00 H new ATOM 0 HB3 PRO A 37 43.890 34.162 23.066 1.00 0.00 H new ATOM 0 HG2 PRO A 37 41.687 34.246 25.126 1.00 0.00 H new ATOM 0 HG3 PRO A 37 43.123 35.244 25.012 1.00 0.00 H new ATOM 0 HD2 PRO A 37 40.660 36.122 24.129 1.00 0.00 H new ATOM 0 HD3 PRO A 37 42.156 36.686 23.411 1.00 0.00 H new ATOM 596 N PRO A 38 40.723 31.662 21.642 1.00 0.00 N ATOM 597 CA PRO A 38 39.773 30.523 21.814 1.00 0.00 C ATOM 598 C PRO A 38 39.759 29.960 23.240 1.00 0.00 C ATOM 599 O PRO A 38 38.739 29.522 23.735 1.00 0.00 O ATOM 600 CB PRO A 38 40.300 29.491 20.832 1.00 0.00 C ATOM 601 CG PRO A 38 40.799 30.316 19.702 1.00 0.00 C ATOM 602 CD PRO A 38 41.411 31.570 20.339 1.00 0.00 C ATOM 0 HA PRO A 38 38.741 30.824 21.636 1.00 0.00 H new ATOM 0 HB2 PRO A 38 41.095 28.888 21.271 1.00 0.00 H new ATOM 0 HB3 PRO A 38 39.517 28.803 20.513 1.00 0.00 H new ATOM 0 HG2 PRO A 38 41.541 29.772 19.118 1.00 0.00 H new ATOM 0 HG3 PRO A 38 39.989 30.579 19.022 1.00 0.00 H new ATOM 0 HD2 PRO A 38 42.490 31.473 20.460 1.00 0.00 H new ATOM 0 HD3 PRO A 38 41.237 32.456 19.729 1.00 0.00 H new ATOM 610 N ASP A 39 40.884 29.963 23.902 1.00 0.00 N ATOM 611 CA ASP A 39 40.935 29.421 25.290 1.00 0.00 C ATOM 612 C ASP A 39 39.879 30.111 26.153 1.00 0.00 C ATOM 613 O ASP A 39 39.446 29.587 27.161 1.00 0.00 O ATOM 614 CB ASP A 39 42.322 29.670 25.885 1.00 0.00 C ATOM 615 CG ASP A 39 42.449 28.925 27.214 1.00 0.00 C ATOM 616 OD1 ASP A 39 41.444 28.417 27.684 1.00 0.00 O ATOM 617 OD2 ASP A 39 43.549 28.875 27.740 1.00 0.00 O ATOM 0 H ASP A 39 41.770 30.317 23.542 1.00 0.00 H new ATOM 0 HA ASP A 39 40.736 28.350 25.265 1.00 0.00 H new ATOM 0 HB2 ASP A 39 43.093 29.332 25.192 1.00 0.00 H new ATOM 0 HB3 ASP A 39 42.477 30.738 26.038 1.00 0.00 H new ATOM 622 N GLN A 40 39.458 31.285 25.764 1.00 0.00 N ATOM 623 CA GLN A 40 38.427 32.030 26.548 1.00 0.00 C ATOM 624 C GLN A 40 37.069 31.902 25.853 1.00 0.00 C ATOM 625 O GLN A 40 36.080 32.449 26.299 1.00 0.00 O ATOM 626 CB GLN A 40 38.828 33.503 26.615 1.00 0.00 C ATOM 627 CG GLN A 40 39.957 33.682 27.632 1.00 0.00 C ATOM 628 CD GLN A 40 39.392 33.562 29.048 1.00 0.00 C ATOM 629 OE1 GLN A 40 38.530 34.324 29.437 1.00 0.00 O ATOM 630 NE2 GLN A 40 39.845 32.629 29.842 1.00 0.00 N ATOM 0 H GLN A 40 39.788 31.766 24.927 1.00 0.00 H new ATOM 0 HA GLN A 40 38.357 31.619 27.555 1.00 0.00 H new ATOM 0 HB2 GLN A 40 39.152 33.847 25.633 1.00 0.00 H new ATOM 0 HB3 GLN A 40 37.969 34.112 26.899 1.00 0.00 H new ATOM 0 HG2 GLN A 40 40.728 32.928 27.472 1.00 0.00 H new ATOM 0 HG3 GLN A 40 40.430 34.655 27.499 1.00 0.00 H new ATOM 0 HE21 GLN A 40 40.569 31.989 29.516 1.00 0.00 H new ATOM 0 HE22 GLN A 40 39.475 32.541 30.788 1.00 0.00 H new ATOM 639 N GLN A 41 37.016 31.187 24.758 1.00 0.00 N ATOM 640 CA GLN A 41 35.722 31.024 24.019 1.00 0.00 C ATOM 641 C GLN A 41 35.580 29.590 23.508 1.00 0.00 C ATOM 642 O GLN A 41 36.531 28.974 23.074 1.00 0.00 O ATOM 643 CB GLN A 41 35.694 31.984 22.828 1.00 0.00 C ATOM 644 CG GLN A 41 35.699 33.427 23.334 1.00 0.00 C ATOM 645 CD GLN A 41 35.328 34.369 22.188 1.00 0.00 C ATOM 646 OE1 GLN A 41 34.295 35.008 22.221 1.00 0.00 O ATOM 647 NE2 GLN A 41 36.132 34.483 21.165 1.00 0.00 N ATOM 0 H GLN A 41 37.814 30.707 24.341 1.00 0.00 H new ATOM 0 HA GLN A 41 34.898 31.245 24.698 1.00 0.00 H new ATOM 0 HB2 GLN A 41 36.558 31.810 22.187 1.00 0.00 H new ATOM 0 HB3 GLN A 41 34.806 31.803 22.223 1.00 0.00 H new ATOM 0 HG2 GLN A 41 34.990 33.539 24.155 1.00 0.00 H new ATOM 0 HG3 GLN A 41 36.683 33.683 23.726 1.00 0.00 H new ATOM 0 HE21 GLN A 41 36.999 33.947 21.136 1.00 0.00 H new ATOM 0 HE22 GLN A 41 35.892 35.108 20.395 1.00 0.00 H new ATOM 656 N ARG A 42 34.379 29.071 23.534 1.00 0.00 N ATOM 657 CA ARG A 42 34.119 27.690 23.030 1.00 0.00 C ATOM 658 C ARG A 42 32.890 27.757 22.134 1.00 0.00 C ATOM 659 O ARG A 42 31.935 28.442 22.440 1.00 0.00 O ATOM 660 CB ARG A 42 33.858 26.745 24.203 1.00 0.00 C ATOM 661 CG ARG A 42 35.101 26.681 25.121 1.00 0.00 C ATOM 662 CD ARG A 42 35.220 25.288 25.757 1.00 0.00 C ATOM 663 NE ARG A 42 35.914 25.397 27.071 1.00 0.00 N ATOM 664 CZ ARG A 42 35.839 24.419 27.932 1.00 0.00 C ATOM 665 NH1 ARG A 42 36.446 24.513 29.083 1.00 0.00 N ATOM 666 NH2 ARG A 42 35.158 23.345 27.638 1.00 0.00 N ATOM 0 H ARG A 42 33.554 29.555 23.889 1.00 0.00 H new ATOM 0 HA ARG A 42 34.980 27.314 22.477 1.00 0.00 H new ATOM 0 HB2 ARG A 42 32.994 27.089 24.771 1.00 0.00 H new ATOM 0 HB3 ARG A 42 33.619 25.749 23.831 1.00 0.00 H new ATOM 0 HG2 ARG A 42 35.999 26.904 24.545 1.00 0.00 H new ATOM 0 HG3 ARG A 42 35.026 27.439 25.900 1.00 0.00 H new ATOM 0 HD2 ARG A 42 34.230 24.853 25.892 1.00 0.00 H new ATOM 0 HD3 ARG A 42 35.774 24.621 25.096 1.00 0.00 H new ATOM 0 HE ARG A 42 36.448 26.236 27.298 1.00 0.00 H new ATOM 0 HH11 ARG A 42 36.980 25.352 29.311 1.00 0.00 H new ATOM 0 HH12 ARG A 42 36.387 23.748 29.755 1.00 0.00 H new ATOM 0 HH21 ARG A 42 34.686 23.271 26.737 1.00 0.00 H new ATOM 0 HH22 ARG A 42 35.098 22.579 28.309 1.00 0.00 H new ATOM 680 N LEU A 43 32.895 27.081 21.022 1.00 0.00 N ATOM 681 CA LEU A 43 31.714 27.156 20.118 1.00 0.00 C ATOM 682 C LEU A 43 30.679 26.103 20.515 1.00 0.00 C ATOM 683 O LEU A 43 31.009 24.990 20.872 1.00 0.00 O ATOM 684 CB LEU A 43 32.165 26.906 18.678 1.00 0.00 C ATOM 685 CG LEU A 43 32.844 28.158 18.120 1.00 0.00 C ATOM 686 CD1 LEU A 43 33.977 28.597 19.052 1.00 0.00 C ATOM 687 CD2 LEU A 43 33.418 27.835 16.744 1.00 0.00 C ATOM 0 H LEU A 43 33.657 26.485 20.701 1.00 0.00 H new ATOM 0 HA LEU A 43 31.264 28.145 20.200 1.00 0.00 H new ATOM 0 HB2 LEU A 43 32.855 26.062 18.645 1.00 0.00 H new ATOM 0 HB3 LEU A 43 31.307 26.641 18.060 1.00 0.00 H new ATOM 0 HG LEU A 43 32.115 28.964 18.043 1.00 0.00 H new ATOM 0 HD11 LEU A 43 34.456 29.489 18.648 1.00 0.00 H new ATOM 0 HD12 LEU A 43 33.571 28.819 20.039 1.00 0.00 H new ATOM 0 HD13 LEU A 43 34.712 27.796 19.133 1.00 0.00 H new ATOM 0 HD21 LEU A 43 33.905 28.721 16.336 1.00 0.00 H new ATOM 0 HD22 LEU A 43 34.147 27.029 16.834 1.00 0.00 H new ATOM 0 HD23 LEU A 43 32.613 27.524 16.078 1.00 0.00 H new ATOM 699 N ILE A 44 29.425 26.461 20.444 1.00 0.00 N ATOM 700 CA ILE A 44 28.319 25.517 20.804 1.00 0.00 C ATOM 701 C ILE A 44 27.311 25.476 19.654 1.00 0.00 C ATOM 702 O ILE A 44 26.965 26.495 19.092 1.00 0.00 O ATOM 703 CB ILE A 44 27.613 26.023 22.066 1.00 0.00 C ATOM 704 CG1 ILE A 44 28.597 26.044 23.253 1.00 0.00 C ATOM 705 CG2 ILE A 44 26.417 25.115 22.395 1.00 0.00 C ATOM 706 CD1 ILE A 44 29.184 24.646 23.522 1.00 0.00 C ATOM 0 H ILE A 44 29.112 27.385 20.146 1.00 0.00 H new ATOM 0 HA ILE A 44 28.726 24.522 20.983 1.00 0.00 H new ATOM 0 HB ILE A 44 27.254 27.037 21.887 1.00 0.00 H new ATOM 0 HG12 ILE A 44 29.405 26.746 23.045 1.00 0.00 H new ATOM 0 HG13 ILE A 44 28.085 26.403 24.146 1.00 0.00 H new ATOM 0 HG21 ILE A 44 25.919 25.480 23.293 1.00 0.00 H new ATOM 0 HG22 ILE A 44 25.714 25.123 21.562 1.00 0.00 H new ATOM 0 HG23 ILE A 44 26.768 24.097 22.563 1.00 0.00 H new ATOM 0 HD11 ILE A 44 29.873 24.697 24.365 1.00 0.00 H new ATOM 0 HD12 ILE A 44 28.377 23.951 23.755 1.00 0.00 H new ATOM 0 HD13 ILE A 44 29.718 24.299 22.637 1.00 0.00 H new ATOM 718 N PHE A 45 26.834 24.306 19.300 1.00 0.00 N ATOM 719 CA PHE A 45 25.842 24.186 18.186 1.00 0.00 C ATOM 720 C PHE A 45 24.629 23.395 18.684 1.00 0.00 C ATOM 721 O PHE A 45 24.691 22.197 18.864 1.00 0.00 O ATOM 722 CB PHE A 45 26.494 23.439 17.020 1.00 0.00 C ATOM 723 CG PHE A 45 25.460 23.157 15.957 1.00 0.00 C ATOM 724 CD1 PHE A 45 25.182 24.115 14.976 1.00 0.00 C ATOM 725 CD2 PHE A 45 24.781 21.935 15.955 1.00 0.00 C ATOM 726 CE1 PHE A 45 24.223 23.850 13.991 1.00 0.00 C ATOM 727 CE2 PHE A 45 23.821 21.668 14.971 1.00 0.00 C ATOM 728 CZ PHE A 45 23.542 22.627 13.989 1.00 0.00 C ATOM 0 H PHE A 45 27.092 23.422 19.739 1.00 0.00 H new ATOM 0 HA PHE A 45 25.524 25.175 17.857 1.00 0.00 H new ATOM 0 HB2 PHE A 45 27.306 24.034 16.603 1.00 0.00 H new ATOM 0 HB3 PHE A 45 26.932 22.505 17.373 1.00 0.00 H new ATOM 0 HD1 PHE A 45 25.707 25.059 14.979 1.00 0.00 H new ATOM 0 HD2 PHE A 45 24.997 21.196 16.713 1.00 0.00 H new ATOM 0 HE1 PHE A 45 24.009 24.589 13.233 1.00 0.00 H new ATOM 0 HE2 PHE A 45 23.296 20.724 14.969 1.00 0.00 H new ATOM 0 HZ PHE A 45 22.801 22.423 13.230 1.00 0.00 H new ATOM 738 N ALA A 46 23.526 24.053 18.906 1.00 0.00 N ATOM 739 CA ALA A 46 22.316 23.332 19.389 1.00 0.00 C ATOM 740 C ALA A 46 22.682 22.454 20.589 1.00 0.00 C ATOM 741 O ALA A 46 22.350 21.288 20.641 1.00 0.00 O ATOM 742 CB ALA A 46 21.765 22.452 18.266 1.00 0.00 C ATOM 0 H ALA A 46 23.410 25.058 18.774 1.00 0.00 H new ATOM 0 HA ALA A 46 21.561 24.058 19.689 1.00 0.00 H new ATOM 0 HB1 ALA A 46 20.879 21.924 18.619 1.00 0.00 H new ATOM 0 HB2 ALA A 46 21.500 23.075 17.412 1.00 0.00 H new ATOM 0 HB3 ALA A 46 22.523 21.729 17.965 1.00 0.00 H new ATOM 748 N GLY A 47 23.349 23.012 21.562 1.00 0.00 N ATOM 749 CA GLY A 47 23.720 22.215 22.769 1.00 0.00 C ATOM 750 C GLY A 47 24.681 21.085 22.389 1.00 0.00 C ATOM 751 O GLY A 47 25.092 20.308 23.229 1.00 0.00 O ATOM 0 H GLY A 47 23.654 23.985 21.575 1.00 0.00 H new ATOM 0 HA2 GLY A 47 24.186 22.863 23.511 1.00 0.00 H new ATOM 0 HA3 GLY A 47 22.823 21.799 23.228 1.00 0.00 H new ATOM 755 N LYS A 48 25.030 20.962 21.135 1.00 0.00 N ATOM 756 CA LYS A 48 25.945 19.854 20.726 1.00 0.00 C ATOM 757 C LYS A 48 27.405 20.296 20.851 1.00 0.00 C ATOM 758 O LYS A 48 27.746 21.443 20.635 1.00 0.00 O ATOM 759 CB LYS A 48 25.665 19.453 19.281 1.00 0.00 C ATOM 760 CG LYS A 48 24.171 19.168 19.104 1.00 0.00 C ATOM 761 CD LYS A 48 23.946 18.397 17.801 1.00 0.00 C ATOM 762 CE LYS A 48 22.448 18.171 17.593 1.00 0.00 C ATOM 763 NZ LYS A 48 21.780 19.476 17.326 1.00 0.00 N ATOM 0 H LYS A 48 24.724 21.576 20.380 1.00 0.00 H new ATOM 0 HA LYS A 48 25.770 19.002 21.383 1.00 0.00 H new ATOM 0 HB2 LYS A 48 25.975 20.250 18.606 1.00 0.00 H new ATOM 0 HB3 LYS A 48 26.247 18.569 19.020 1.00 0.00 H new ATOM 0 HG2 LYS A 48 23.798 18.590 19.949 1.00 0.00 H new ATOM 0 HG3 LYS A 48 23.612 20.103 19.086 1.00 0.00 H new ATOM 0 HD2 LYS A 48 24.361 18.954 16.961 1.00 0.00 H new ATOM 0 HD3 LYS A 48 24.467 17.440 17.838 1.00 0.00 H new ATOM 0 HE2 LYS A 48 22.285 17.490 16.758 1.00 0.00 H new ATOM 0 HE3 LYS A 48 22.014 17.702 18.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 20.933 19.320 16.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 21.503 19.915 18.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 22.437 20.105 16.822 1.00 0.00 H new ATOM 777 N GLN A 49 28.264 19.375 21.203 1.00 0.00 N ATOM 778 CA GLN A 49 29.713 19.683 21.360 1.00 0.00 C ATOM 779 C GLN A 49 30.485 19.141 20.157 1.00 0.00 C ATOM 780 O GLN A 49 30.322 18.000 19.771 1.00 0.00 O ATOM 781 CB GLN A 49 30.237 19.025 22.638 1.00 0.00 C ATOM 782 CG GLN A 49 31.611 19.603 22.982 1.00 0.00 C ATOM 783 CD GLN A 49 32.230 18.801 24.127 1.00 0.00 C ATOM 784 OE1 GLN A 49 31.784 18.883 25.254 1.00 0.00 O ATOM 785 NE2 GLN A 49 33.249 18.022 23.885 1.00 0.00 N ATOM 0 H GLN A 49 28.015 18.404 21.391 1.00 0.00 H new ATOM 0 HA GLN A 49 29.849 20.763 21.422 1.00 0.00 H new ATOM 0 HB2 GLN A 49 29.542 19.197 23.460 1.00 0.00 H new ATOM 0 HB3 GLN A 49 30.308 17.946 22.501 1.00 0.00 H new ATOM 0 HG2 GLN A 49 32.261 19.569 22.107 1.00 0.00 H new ATOM 0 HG3 GLN A 49 31.515 20.651 23.268 1.00 0.00 H new ATOM 0 HE21 GLN A 49 33.624 17.952 22.939 1.00 0.00 H new ATOM 0 HE22 GLN A 49 33.670 17.483 24.642 1.00 0.00 H new ATOM 794 N LEU A 50 31.333 19.948 19.567 1.00 0.00 N ATOM 795 CA LEU A 50 32.133 19.492 18.387 1.00 0.00 C ATOM 796 C LEU A 50 33.600 19.363 18.804 1.00 0.00 C ATOM 797 O LEU A 50 34.106 20.156 19.572 1.00 0.00 O ATOM 798 CB LEU A 50 32.018 20.528 17.264 1.00 0.00 C ATOM 799 CG LEU A 50 30.554 20.935 17.081 1.00 0.00 C ATOM 800 CD1 LEU A 50 30.451 21.967 15.956 1.00 0.00 C ATOM 801 CD2 LEU A 50 29.716 19.703 16.720 1.00 0.00 C ATOM 0 H LEU A 50 31.507 20.911 19.855 1.00 0.00 H new ATOM 0 HA LEU A 50 31.759 18.531 18.035 1.00 0.00 H new ATOM 0 HB2 LEU A 50 32.621 21.404 17.502 1.00 0.00 H new ATOM 0 HB3 LEU A 50 32.409 20.115 16.334 1.00 0.00 H new ATOM 0 HG LEU A 50 30.180 21.366 18.010 1.00 0.00 H new ATOM 0 HD11 LEU A 50 29.409 22.258 15.824 1.00 0.00 H new ATOM 0 HD12 LEU A 50 31.044 22.845 16.212 1.00 0.00 H new ATOM 0 HD13 LEU A 50 30.827 21.534 15.029 1.00 0.00 H new ATOM 0 HD21 LEU A 50 28.674 19.997 16.591 1.00 0.00 H new ATOM 0 HD22 LEU A 50 30.089 19.269 15.792 1.00 0.00 H new ATOM 0 HD23 LEU A 50 29.788 18.966 17.520 1.00 0.00 H new ATOM 813 N GLU A 51 34.290 18.368 18.311 1.00 0.00 N ATOM 814 CA GLU A 51 35.726 18.189 18.686 1.00 0.00 C ATOM 815 C GLU A 51 36.614 18.882 17.651 1.00 0.00 C ATOM 816 O GLU A 51 36.230 19.070 16.514 1.00 0.00 O ATOM 817 CB GLU A 51 36.057 16.696 18.718 1.00 0.00 C ATOM 818 CG GLU A 51 35.147 15.994 19.727 1.00 0.00 C ATOM 819 CD GLU A 51 35.531 14.515 19.819 1.00 0.00 C ATOM 820 OE1 GLU A 51 36.383 14.096 19.051 1.00 0.00 O ATOM 821 OE2 GLU A 51 34.966 13.829 20.654 1.00 0.00 O ATOM 0 H GLU A 51 33.922 17.670 17.664 1.00 0.00 H new ATOM 0 HA GLU A 51 35.903 18.626 19.669 1.00 0.00 H new ATOM 0 HB2 GLU A 51 35.923 16.262 17.727 1.00 0.00 H new ATOM 0 HB3 GLU A 51 37.102 16.550 18.991 1.00 0.00 H new ATOM 0 HG2 GLU A 51 35.239 16.466 20.705 1.00 0.00 H new ATOM 0 HG3 GLU A 51 34.105 16.092 19.422 1.00 0.00 H new ATOM 828 N ASP A 52 37.800 19.267 18.038 1.00 0.00 N ATOM 829 CA ASP A 52 38.713 19.947 17.076 1.00 0.00 C ATOM 830 C ASP A 52 38.941 19.045 15.863 1.00 0.00 C ATOM 831 O ASP A 52 38.797 17.840 15.939 1.00 0.00 O ATOM 832 CB ASP A 52 40.053 20.232 17.760 1.00 0.00 C ATOM 833 CG ASP A 52 40.539 18.972 18.475 1.00 0.00 C ATOM 834 OD1 ASP A 52 41.242 18.194 17.853 1.00 0.00 O ATOM 835 OD2 ASP A 52 40.202 18.806 19.637 1.00 0.00 O ATOM 0 H ASP A 52 38.176 19.140 18.978 1.00 0.00 H new ATOM 0 HA ASP A 52 38.264 20.885 16.750 1.00 0.00 H new ATOM 0 HB2 ASP A 52 40.789 20.551 17.022 1.00 0.00 H new ATOM 0 HB3 ASP A 52 39.943 21.048 18.474 1.00 0.00 H new ATOM 840 N GLY A 53 39.293 19.617 14.744 1.00 0.00 N ATOM 841 CA GLY A 53 39.526 18.789 13.527 1.00 0.00 C ATOM 842 C GLY A 53 38.181 18.398 12.915 1.00 0.00 C ATOM 843 O GLY A 53 37.141 18.802 13.385 1.00 0.00 O ATOM 0 H GLY A 53 39.429 20.620 14.620 1.00 0.00 H new ATOM 0 HA2 GLY A 53 40.120 19.346 12.802 1.00 0.00 H new ATOM 0 HA3 GLY A 53 40.094 17.895 13.785 1.00 0.00 H new ATOM 847 N ARG A 54 38.198 17.608 11.874 1.00 0.00 N ATOM 848 CA ARG A 54 36.921 17.181 11.227 1.00 0.00 C ATOM 849 C ARG A 54 36.198 18.401 10.640 1.00 0.00 C ATOM 850 O ARG A 54 36.487 19.536 10.982 1.00 0.00 O ATOM 851 CB ARG A 54 36.026 16.486 12.267 1.00 0.00 C ATOM 852 CG ARG A 54 34.972 15.620 11.565 1.00 0.00 C ATOM 853 CD ARG A 54 34.290 14.717 12.593 1.00 0.00 C ATOM 854 NE ARG A 54 35.244 13.663 13.038 1.00 0.00 N ATOM 855 CZ ARG A 54 34.877 12.784 13.931 1.00 0.00 C ATOM 856 NH1 ARG A 54 35.713 11.859 14.319 1.00 0.00 N ATOM 857 NH2 ARG A 54 33.675 12.830 14.436 1.00 0.00 N ATOM 0 H ARG A 54 39.045 17.238 11.442 1.00 0.00 H new ATOM 0 HA ARG A 54 37.141 16.483 10.420 1.00 0.00 H new ATOM 0 HB2 ARG A 54 36.635 15.867 12.926 1.00 0.00 H new ATOM 0 HB3 ARG A 54 35.536 17.232 12.893 1.00 0.00 H new ATOM 0 HG2 ARG A 54 34.233 16.253 11.074 1.00 0.00 H new ATOM 0 HG3 ARG A 54 35.441 15.016 10.788 1.00 0.00 H new ATOM 0 HD2 ARG A 54 33.958 15.307 13.448 1.00 0.00 H new ATOM 0 HD3 ARG A 54 33.402 14.259 12.158 1.00 0.00 H new ATOM 0 HE ARG A 54 36.185 13.628 12.645 1.00 0.00 H new ATOM 0 HH11 ARG A 54 36.653 11.823 13.924 1.00 0.00 H new ATOM 0 HH12 ARG A 54 35.426 11.172 15.017 1.00 0.00 H new ATOM 0 HH21 ARG A 54 33.022 13.553 14.133 1.00 0.00 H new ATOM 0 HH22 ARG A 54 33.388 12.143 15.134 1.00 0.00 H new ATOM 871 N THR A 55 35.256 18.168 9.753 1.00 0.00 N ATOM 872 CA THR A 55 34.491 19.291 9.119 1.00 0.00 C ATOM 873 C THR A 55 33.005 19.136 9.440 1.00 0.00 C ATOM 874 O THR A 55 32.590 18.177 10.058 1.00 0.00 O ATOM 875 CB THR A 55 34.687 19.243 7.602 1.00 0.00 C ATOM 876 OG1 THR A 55 34.163 18.023 7.098 1.00 0.00 O ATOM 877 CG2 THR A 55 36.178 19.336 7.274 1.00 0.00 C ATOM 0 H THR A 55 34.983 17.237 9.439 1.00 0.00 H new ATOM 0 HA THR A 55 34.852 20.244 9.506 1.00 0.00 H new ATOM 0 HB THR A 55 34.165 20.081 7.141 1.00 0.00 H new ATOM 0 HG1 THR A 55 33.510 18.214 6.393 1.00 0.00 H new ATOM 0 HG21 THR A 55 36.316 19.302 6.193 1.00 0.00 H new ATOM 0 HG22 THR A 55 36.578 20.273 7.661 1.00 0.00 H new ATOM 0 HG23 THR A 55 36.705 18.500 7.734 1.00 0.00 H new ATOM 885 N LEU A 56 32.196 20.073 9.019 1.00 0.00 N ATOM 886 CA LEU A 56 30.736 19.973 9.300 1.00 0.00 C ATOM 887 C LEU A 56 30.145 18.819 8.487 1.00 0.00 C ATOM 888 O LEU A 56 29.385 18.017 8.995 1.00 0.00 O ATOM 889 CB LEU A 56 30.039 21.284 8.920 1.00 0.00 C ATOM 890 CG LEU A 56 30.394 22.388 9.931 1.00 0.00 C ATOM 891 CD1 LEU A 56 31.837 22.871 9.720 1.00 0.00 C ATOM 892 CD2 LEU A 56 29.432 23.567 9.746 1.00 0.00 C ATOM 0 H LEU A 56 32.483 20.900 8.495 1.00 0.00 H new ATOM 0 HA LEU A 56 30.583 19.788 10.363 1.00 0.00 H new ATOM 0 HB2 LEU A 56 30.342 21.588 7.918 1.00 0.00 H new ATOM 0 HB3 LEU A 56 28.959 21.136 8.896 1.00 0.00 H new ATOM 0 HG LEU A 56 30.305 21.985 10.940 1.00 0.00 H new ATOM 0 HD11 LEU A 56 32.069 23.652 10.444 1.00 0.00 H new ATOM 0 HD12 LEU A 56 32.524 22.035 9.855 1.00 0.00 H new ATOM 0 HD13 LEU A 56 31.944 23.269 8.711 1.00 0.00 H new ATOM 0 HD21 LEU A 56 29.678 24.353 10.460 1.00 0.00 H new ATOM 0 HD22 LEU A 56 29.524 23.956 8.732 1.00 0.00 H new ATOM 0 HD23 LEU A 56 28.409 23.232 9.915 1.00 0.00 H new ATOM 904 N SER A 57 30.502 18.708 7.234 1.00 0.00 N ATOM 905 CA SER A 57 29.964 17.581 6.420 1.00 0.00 C ATOM 906 C SER A 57 30.415 16.279 7.077 1.00 0.00 C ATOM 907 O SER A 57 29.629 15.393 7.342 1.00 0.00 O ATOM 908 CB SER A 57 30.517 17.663 4.996 1.00 0.00 C ATOM 909 OG SER A 57 31.934 17.563 5.037 1.00 0.00 O ATOM 0 H SER A 57 31.135 19.341 6.745 1.00 0.00 H new ATOM 0 HA SER A 57 28.876 17.627 6.371 1.00 0.00 H new ATOM 0 HB2 SER A 57 30.102 16.861 4.385 1.00 0.00 H new ATOM 0 HB3 SER A 57 30.220 18.604 4.532 1.00 0.00 H new ATOM 0 HG SER A 57 32.292 17.614 4.126 1.00 0.00 H new ATOM 915 N ASP A 58 31.685 16.170 7.339 1.00 0.00 N ATOM 916 CA ASP A 58 32.213 14.939 7.986 1.00 0.00 C ATOM 917 C ASP A 58 31.378 14.635 9.236 1.00 0.00 C ATOM 918 O ASP A 58 31.177 13.490 9.592 1.00 0.00 O ATOM 919 CB ASP A 58 33.677 15.156 8.379 1.00 0.00 C ATOM 920 CG ASP A 58 34.565 15.069 7.135 1.00 0.00 C ATOM 921 OD1 ASP A 58 34.052 14.722 6.083 1.00 0.00 O ATOM 922 OD2 ASP A 58 35.747 15.347 7.255 1.00 0.00 O ATOM 0 H ASP A 58 32.384 16.884 7.132 1.00 0.00 H new ATOM 0 HA ASP A 58 32.151 14.100 7.293 1.00 0.00 H new ATOM 0 HB2 ASP A 58 33.795 16.130 8.854 1.00 0.00 H new ATOM 0 HB3 ASP A 58 33.982 14.406 9.109 1.00 0.00 H new ATOM 927 N TYR A 59 30.878 15.647 9.900 1.00 0.00 N ATOM 928 CA TYR A 59 30.046 15.401 11.117 1.00 0.00 C ATOM 929 C TYR A 59 28.676 14.872 10.670 1.00 0.00 C ATOM 930 O TYR A 59 27.932 14.315 11.450 1.00 0.00 O ATOM 931 CB TYR A 59 29.871 16.720 11.906 1.00 0.00 C ATOM 932 CG TYR A 59 30.920 16.831 12.999 1.00 0.00 C ATOM 933 CD1 TYR A 59 31.832 17.896 12.999 1.00 0.00 C ATOM 934 CD2 TYR A 59 30.971 15.870 14.016 1.00 0.00 C ATOM 935 CE1 TYR A 59 32.792 17.997 14.013 1.00 0.00 C ATOM 936 CE2 TYR A 59 31.933 15.971 15.030 1.00 0.00 C ATOM 937 CZ TYR A 59 32.842 17.035 15.027 1.00 0.00 C ATOM 938 OH TYR A 59 33.789 17.135 16.027 1.00 0.00 O ATOM 0 H TYR A 59 31.009 16.628 9.653 1.00 0.00 H new ATOM 0 HA TYR A 59 30.533 14.671 11.763 1.00 0.00 H new ATOM 0 HB2 TYR A 59 29.953 17.570 11.228 1.00 0.00 H new ATOM 0 HB3 TYR A 59 28.874 16.758 12.346 1.00 0.00 H new ATOM 0 HD1 TYR A 59 31.794 18.639 12.216 1.00 0.00 H new ATOM 0 HD2 TYR A 59 30.268 15.050 14.019 1.00 0.00 H new ATOM 0 HE1 TYR A 59 33.494 18.818 14.012 1.00 0.00 H new ATOM 0 HE2 TYR A 59 31.973 15.228 15.813 1.00 0.00 H new ATOM 0 HH TYR A 59 34.399 17.875 15.827 1.00 0.00 H new ATOM 948 N ASN A 60 28.351 15.047 9.416 1.00 0.00 N ATOM 949 CA ASN A 60 27.039 14.559 8.887 1.00 0.00 C ATOM 950 C ASN A 60 25.904 15.460 9.387 1.00 0.00 C ATOM 951 O ASN A 60 25.017 15.021 10.092 1.00 0.00 O ATOM 952 CB ASN A 60 26.799 13.107 9.333 1.00 0.00 C ATOM 953 CG ASN A 60 28.133 12.360 9.383 1.00 0.00 C ATOM 954 OD1 ASN A 60 28.558 11.921 10.434 1.00 0.00 O ATOM 955 ND2 ASN A 60 28.818 12.198 8.284 1.00 0.00 N ATOM 0 H ASN A 60 28.943 15.512 8.728 1.00 0.00 H new ATOM 0 HA ASN A 60 27.061 14.593 7.798 1.00 0.00 H new ATOM 0 HB2 ASN A 60 26.324 13.091 10.314 1.00 0.00 H new ATOM 0 HB3 ASN A 60 26.118 12.611 8.641 1.00 0.00 H new ATOM 0 HD21 ASN A 60 29.710 11.703 8.307 1.00 0.00 H new ATOM 0 HD22 ASN A 60 28.462 12.566 7.402 1.00 0.00 H new ATOM 962 N ILE A 61 25.918 16.711 9.019 1.00 0.00 N ATOM 963 CA ILE A 61 24.843 17.630 9.458 1.00 0.00 C ATOM 964 C ILE A 61 23.530 17.199 8.795 1.00 0.00 C ATOM 965 O ILE A 61 23.524 16.642 7.716 1.00 0.00 O ATOM 966 CB ILE A 61 25.222 19.052 9.034 1.00 0.00 C ATOM 967 CG1 ILE A 61 24.114 20.029 9.429 1.00 0.00 C ATOM 968 CG2 ILE A 61 25.417 19.096 7.518 1.00 0.00 C ATOM 969 CD1 ILE A 61 23.907 20.020 10.949 1.00 0.00 C ATOM 0 H ILE A 61 26.635 17.134 8.429 1.00 0.00 H new ATOM 0 HA ILE A 61 24.717 17.601 10.540 1.00 0.00 H new ATOM 0 HB ILE A 61 26.147 19.338 9.534 1.00 0.00 H new ATOM 0 HG12 ILE A 61 24.372 21.035 9.097 1.00 0.00 H new ATOM 0 HG13 ILE A 61 23.185 19.757 8.928 1.00 0.00 H new ATOM 0 HG21 ILE A 61 25.687 20.108 7.215 1.00 0.00 H new ATOM 0 HG22 ILE A 61 26.213 18.408 7.233 1.00 0.00 H new ATOM 0 HG23 ILE A 61 24.491 18.804 7.023 1.00 0.00 H new ATOM 0 HD11 ILE A 61 23.115 20.721 11.212 1.00 0.00 H new ATOM 0 HD12 ILE A 61 23.627 19.017 11.272 1.00 0.00 H new ATOM 0 HD13 ILE A 61 24.832 20.315 11.444 1.00 0.00 H new ATOM 1066 N LEU A 67 23.597 26.850 8.360 1.00 0.00 N ATOM 1067 CA LEU A 67 23.826 26.406 9.765 1.00 0.00 C ATOM 1068 C LEU A 67 24.094 27.622 10.655 1.00 0.00 C ATOM 1069 O LEU A 67 24.655 28.608 10.222 1.00 0.00 O ATOM 1070 CB LEU A 67 25.028 25.459 9.803 1.00 0.00 C ATOM 1071 CG LEU A 67 24.952 24.493 8.616 1.00 0.00 C ATOM 1072 CD1 LEU A 67 26.081 23.466 8.715 1.00 0.00 C ATOM 1073 CD2 LEU A 67 23.601 23.774 8.625 1.00 0.00 C ATOM 0 HA LEU A 67 22.941 25.887 10.133 1.00 0.00 H new ATOM 0 HB2 LEU A 67 25.956 26.029 9.763 1.00 0.00 H new ATOM 0 HB3 LEU A 67 25.037 24.902 10.740 1.00 0.00 H new ATOM 0 HG LEU A 67 25.056 25.054 7.687 1.00 0.00 H new ATOM 0 HD11 LEU A 67 26.024 22.780 7.870 1.00 0.00 H new ATOM 0 HD12 LEU A 67 27.042 23.980 8.702 1.00 0.00 H new ATOM 0 HD13 LEU A 67 25.982 22.905 9.644 1.00 0.00 H new ATOM 0 HD21 LEU A 67 23.549 23.087 7.780 1.00 0.00 H new ATOM 0 HD22 LEU A 67 23.493 23.215 9.554 1.00 0.00 H new ATOM 0 HD23 LEU A 67 22.798 24.507 8.547 1.00 0.00 H new ATOM 1085 N HIS A 68 23.693 27.549 11.901 1.00 0.00 N ATOM 1086 CA HIS A 68 23.908 28.689 12.850 1.00 0.00 C ATOM 1087 C HIS A 68 24.904 28.271 13.933 1.00 0.00 C ATOM 1088 O HIS A 68 24.831 27.182 14.468 1.00 0.00 O ATOM 1089 CB HIS A 68 22.576 29.057 13.505 1.00 0.00 C ATOM 1090 CG HIS A 68 22.790 30.180 14.483 1.00 0.00 C ATOM 1091 ND1 HIS A 68 21.943 30.391 15.564 1.00 0.00 N ATOM 1092 CD2 HIS A 68 23.748 31.162 14.560 1.00 0.00 C ATOM 1093 CE1 HIS A 68 22.405 31.462 16.236 1.00 0.00 C ATOM 1094 NE2 HIS A 68 23.500 31.966 15.665 1.00 0.00 N ATOM 0 H HIS A 68 23.221 26.740 12.306 1.00 0.00 H new ATOM 0 HA HIS A 68 24.301 29.547 12.305 1.00 0.00 H new ATOM 0 HB2 HIS A 68 21.855 29.356 12.744 1.00 0.00 H new ATOM 0 HB3 HIS A 68 22.159 28.190 14.017 1.00 0.00 H new ATOM 0 HD1 HIS A 68 21.122 29.836 15.804 1.00 0.00 H new ATOM 0 HD2 HIS A 68 24.567 31.289 13.868 1.00 0.00 H new ATOM 0 HE1 HIS A 68 21.946 31.864 17.127 1.00 0.00 H new ATOM 1103 N LEU A 69 25.830 29.138 14.267 1.00 0.00 N ATOM 1104 CA LEU A 69 26.841 28.822 15.326 1.00 0.00 C ATOM 1105 C LEU A 69 26.682 29.824 16.470 1.00 0.00 C ATOM 1106 O LEU A 69 26.246 30.940 16.264 1.00 0.00 O ATOM 1107 CB LEU A 69 28.251 28.954 14.738 1.00 0.00 C ATOM 1108 CG LEU A 69 28.331 28.212 13.401 1.00 0.00 C ATOM 1109 CD1 LEU A 69 29.732 28.385 12.810 1.00 0.00 C ATOM 1110 CD2 LEU A 69 28.049 26.722 13.617 1.00 0.00 C ATOM 0 H LEU A 69 25.929 30.062 13.846 1.00 0.00 H new ATOM 0 HA LEU A 69 26.691 27.806 15.691 1.00 0.00 H new ATOM 0 HB2 LEU A 69 28.498 30.006 14.595 1.00 0.00 H new ATOM 0 HB3 LEU A 69 28.984 28.547 15.434 1.00 0.00 H new ATOM 0 HG LEU A 69 27.589 28.622 12.715 1.00 0.00 H new ATOM 0 HD11 LEU A 69 29.793 27.858 11.858 1.00 0.00 H new ATOM 0 HD12 LEU A 69 29.932 29.445 12.652 1.00 0.00 H new ATOM 0 HD13 LEU A 69 30.471 27.976 13.499 1.00 0.00 H new ATOM 0 HD21 LEU A 69 28.107 26.199 12.663 1.00 0.00 H new ATOM 0 HD22 LEU A 69 28.787 26.308 14.304 1.00 0.00 H new ATOM 0 HD23 LEU A 69 27.052 26.598 14.039 1.00 0.00 H new ATOM 1122 N VAL A 70 27.028 29.443 17.675 1.00 0.00 N ATOM 1123 CA VAL A 70 26.897 30.381 18.834 1.00 0.00 C ATOM 1124 C VAL A 70 28.133 30.257 19.725 1.00 0.00 C ATOM 1125 O VAL A 70 28.449 29.194 20.221 1.00 0.00 O ATOM 1126 CB VAL A 70 25.650 30.014 19.642 1.00 0.00 C ATOM 1127 CG1 VAL A 70 25.519 30.961 20.837 1.00 0.00 C ATOM 1128 CG2 VAL A 70 24.412 30.143 18.754 1.00 0.00 C ATOM 0 H VAL A 70 27.396 28.521 17.907 1.00 0.00 H new ATOM 0 HA VAL A 70 26.809 31.405 18.471 1.00 0.00 H new ATOM 0 HB VAL A 70 25.738 28.988 19.999 1.00 0.00 H new ATOM 0 HG11 VAL A 70 24.631 30.700 21.413 1.00 0.00 H new ATOM 0 HG12 VAL A 70 26.401 30.871 21.471 1.00 0.00 H new ATOM 0 HG13 VAL A 70 25.431 31.987 20.480 1.00 0.00 H new ATOM 0 HG21 VAL A 70 23.523 29.882 19.329 1.00 0.00 H new ATOM 0 HG22 VAL A 70 24.325 31.169 18.398 1.00 0.00 H new ATOM 0 HG23 VAL A 70 24.504 29.470 17.902 1.00 0.00 H new ATOM 1138 N LEU A 71 28.844 31.334 19.922 1.00 0.00 N ATOM 1139 CA LEU A 71 30.071 31.277 20.769 1.00 0.00 C ATOM 1140 C LEU A 71 29.679 31.361 22.245 1.00 0.00 C ATOM 1141 O LEU A 71 28.722 32.015 22.607 1.00 0.00 O ATOM 1142 CB LEU A 71 30.979 32.465 20.426 1.00 0.00 C ATOM 1143 CG LEU A 71 31.757 32.176 19.140 1.00 0.00 C ATOM 1144 CD1 LEU A 71 30.784 31.820 18.017 1.00 0.00 C ATOM 1145 CD2 LEU A 71 32.560 33.420 18.747 1.00 0.00 C ATOM 0 H LEU A 71 28.628 32.252 19.533 1.00 0.00 H new ATOM 0 HA LEU A 71 30.596 30.341 20.581 1.00 0.00 H new ATOM 0 HB2 LEU A 71 30.380 33.367 20.303 1.00 0.00 H new ATOM 0 HB3 LEU A 71 31.672 32.652 21.246 1.00 0.00 H new ATOM 0 HG LEU A 71 32.434 31.338 19.305 1.00 0.00 H new ATOM 0 HD11 LEU A 71 31.342 31.615 17.103 1.00 0.00 H new ATOM 0 HD12 LEU A 71 30.211 30.936 18.298 1.00 0.00 H new ATOM 0 HD13 LEU A 71 30.104 32.654 17.847 1.00 0.00 H new ATOM 0 HD21 LEU A 71 33.116 33.220 17.831 1.00 0.00 H new ATOM 0 HD22 LEU A 71 31.879 34.255 18.583 1.00 0.00 H new ATOM 0 HD23 LEU A 71 33.256 33.671 19.547 1.00 0.00 H new ATOM 1157 N ARG A 72 30.436 30.721 23.103 1.00 0.00 N ATOM 1158 CA ARG A 72 30.154 30.766 24.573 1.00 0.00 C ATOM 1159 C ARG A 72 31.310 31.530 25.236 1.00 0.00 C ATOM 1160 O ARG A 72 32.370 31.672 24.655 1.00 0.00 O ATOM 1161 CB ARG A 72 30.082 29.314 25.110 1.00 0.00 C ATOM 1162 CG ARG A 72 28.908 29.151 26.089 1.00 0.00 C ATOM 1163 CD ARG A 72 29.105 30.059 27.310 1.00 0.00 C ATOM 1164 NE ARG A 72 28.361 29.494 28.471 1.00 0.00 N ATOM 1165 CZ ARG A 72 28.493 30.031 29.653 1.00 0.00 C ATOM 1166 NH1 ARG A 72 27.838 29.540 30.670 1.00 0.00 N ATOM 1167 NH2 ARG A 72 29.281 31.057 29.820 1.00 0.00 N ATOM 0 H ARG A 72 31.249 30.162 22.844 1.00 0.00 H new ATOM 0 HA ARG A 72 29.208 31.263 24.788 1.00 0.00 H new ATOM 0 HB2 ARG A 72 29.967 28.619 24.278 1.00 0.00 H new ATOM 0 HB3 ARG A 72 31.016 29.060 25.610 1.00 0.00 H new ATOM 0 HG2 ARG A 72 27.972 29.399 25.590 1.00 0.00 H new ATOM 0 HG3 ARG A 72 28.833 28.111 26.408 1.00 0.00 H new ATOM 0 HD2 ARG A 72 30.165 30.141 27.549 1.00 0.00 H new ATOM 0 HD3 ARG A 72 28.749 31.065 27.090 1.00 0.00 H new ATOM 0 HE ARG A 72 27.749 28.688 28.342 1.00 0.00 H new ATOM 0 HH11 ARG A 72 27.223 28.737 30.541 1.00 0.00 H new ATOM 0 HH12 ARG A 72 27.941 29.960 31.594 1.00 0.00 H new ATOM 0 HH21 ARG A 72 29.795 31.440 29.026 1.00 0.00 H new ATOM 0 HH22 ARG A 72 29.384 31.476 30.744 1.00 0.00 H new ATOM 1181 N LEU A 73 31.131 32.020 26.439 1.00 0.00 N ATOM 1182 CA LEU A 73 32.231 32.772 27.127 1.00 0.00 C ATOM 1183 C LEU A 73 32.857 31.877 28.203 1.00 0.00 C ATOM 1184 O LEU A 73 32.250 30.934 28.666 1.00 0.00 O ATOM 1185 CB LEU A 73 31.644 34.032 27.784 1.00 0.00 C ATOM 1186 CG LEU A 73 32.763 35.053 28.084 1.00 0.00 C ATOM 1187 CD1 LEU A 73 33.068 35.895 26.839 1.00 0.00 C ATOM 1188 CD2 LEU A 73 32.319 35.986 29.217 1.00 0.00 C ATOM 0 H LEU A 73 30.269 31.932 26.977 1.00 0.00 H new ATOM 0 HA LEU A 73 32.994 33.059 26.403 1.00 0.00 H new ATOM 0 HB2 LEU A 73 30.900 34.481 27.125 1.00 0.00 H new ATOM 0 HB3 LEU A 73 31.131 33.763 28.707 1.00 0.00 H new ATOM 0 HG LEU A 73 33.660 34.507 28.378 1.00 0.00 H new ATOM 0 HD11 LEU A 73 33.859 36.609 27.068 1.00 0.00 H new ATOM 0 HD12 LEU A 73 33.392 35.242 26.029 1.00 0.00 H new ATOM 0 HD13 LEU A 73 32.170 36.433 26.535 1.00 0.00 H new ATOM 0 HD21 LEU A 73 33.110 36.706 29.427 1.00 0.00 H new ATOM 0 HD22 LEU A 73 31.415 36.517 28.918 1.00 0.00 H new ATOM 0 HD23 LEU A 73 32.115 35.399 30.113 1.00 0.00 H new