USER MOD reduce.3.24.130724 H: found=0, std=0, add=630, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 629 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 22 THR OG1 : rot 180:sc= 0.0498 USER MOD Set 1.2: A 25 ASN : amide:sc= 0.385 K(o=0.43,f=-4.6!) USER MOD Set 2.1: A 7 THR OG1 : rot 134:sc= 1.03 USER MOD Set 2.2: A 9 THR OG1 : rot 180:sc= 0.804 USER MOD Single : A 1 MET CE :methyl -176:sc= 0 (180deg=-0.0299) USER MOD Single : A 1 MET N :NH3+ 175:sc= 0.636 (180deg=0.621) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 180:sc= 0.00884 USER MOD Single : A 27 LYS NZ :NH3+ 177:sc= 1.76 (180deg=1.72) USER MOD Single : A 29 LYS NZ :NH3+ 179:sc= 1.2 (180deg=1.08) USER MOD Single : A 31 GLN : amide:sc= -0.122 X(o=-0.12,f=-0.0089) USER MOD Single : A 33 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0259) USER MOD Single : A 40 GLN : amide:sc= -1.95! K(o=-1.9!,f=-0.38) USER MOD Single : A 41 GLN : amide:sc= -0.229 K(o=-0.23,f=-3.1!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -0.906 K(o=-0.91,f=0) USER MOD Single : A 55 THR OG1 : rot 22:sc= 0.478 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 120:sc= 0.589 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 GLN : amide:sc= -0.0439 K(o=-0.044,f=-2.5!) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 176:sc= 0.0176 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc=-0.00873 X(o=-0.0087,f=-0.062) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 13.736 30.699 16.435 1.00 0.00 N ATOM 2 CA MET A 1 14.091 30.432 17.844 1.00 0.00 C ATOM 3 C MET A 1 15.385 31.124 18.267 1.00 0.00 C ATOM 4 O MET A 1 16.450 30.998 17.673 1.00 0.00 O ATOM 5 CB MET A 1 14.196 28.950 18.199 1.00 0.00 C ATOM 6 CG MET A 1 15.116 28.110 17.310 1.00 0.00 C ATOM 7 SD MET A 1 15.030 26.346 17.681 1.00 0.00 S ATOM 8 CE MET A 1 15.651 26.201 19.369 1.00 0.00 C ATOM 0 H1 MET A 1 12.898 30.140 16.176 1.00 0.00 H new ATOM 0 H2 MET A 1 13.527 31.711 16.315 1.00 0.00 H new ATOM 0 H3 MET A 1 14.532 30.435 15.820 1.00 0.00 H new ATOM 0 HA MET A 1 13.250 30.851 18.397 1.00 0.00 H new ATOM 0 HB2 MET A 1 14.544 28.867 19.229 1.00 0.00 H new ATOM 0 HB3 MET A 1 13.196 28.517 18.165 1.00 0.00 H new ATOM 0 HG2 MET A 1 14.849 28.270 16.265 1.00 0.00 H new ATOM 0 HG3 MET A 1 16.144 28.452 17.433 1.00 0.00 H new ATOM 0 HE1 MET A 1 15.700 25.149 19.650 1.00 0.00 H new ATOM 0 HE2 MET A 1 16.647 26.639 19.429 1.00 0.00 H new ATOM 0 HE3 MET A 1 14.982 26.728 20.049 1.00 0.00 H new ATOM 20 N GLN A 2 15.339 31.837 19.395 1.00 0.00 N ATOM 21 CA GLN A 2 16.471 32.529 19.967 1.00 0.00 C ATOM 22 C GLN A 2 16.962 31.692 21.148 1.00 0.00 C ATOM 23 O GLN A 2 16.277 31.506 22.149 1.00 0.00 O ATOM 24 CB GLN A 2 16.038 33.898 20.489 1.00 0.00 C ATOM 25 CG GLN A 2 15.675 34.914 19.401 1.00 0.00 C ATOM 26 CD GLN A 2 15.709 36.377 19.812 1.00 0.00 C ATOM 27 OE1 GLN A 2 15.814 36.736 20.980 1.00 0.00 O ATOM 28 NE2 GLN A 2 15.587 37.264 18.828 1.00 0.00 N ATOM 0 H GLN A 2 14.485 31.945 19.942 1.00 0.00 H new ATOM 0 HA GLN A 2 17.250 32.665 19.217 1.00 0.00 H new ATOM 0 HB2 GLN A 2 15.178 33.766 21.145 1.00 0.00 H new ATOM 0 HB3 GLN A 2 16.843 34.310 21.098 1.00 0.00 H new ATOM 0 HG2 GLN A 2 16.358 34.777 18.563 1.00 0.00 H new ATOM 0 HG3 GLN A 2 14.674 34.683 19.037 1.00 0.00 H new ATOM 0 HE21 GLN A 2 15.501 36.946 17.863 1.00 0.00 H new ATOM 0 HE22 GLN A 2 15.580 38.262 19.039 1.00 0.00 H new ATOM 37 N ILE A 3 18.218 31.278 21.050 1.00 0.00 N ATOM 38 CA ILE A 3 18.915 30.650 22.159 1.00 0.00 C ATOM 39 C ILE A 3 20.192 31.390 22.560 1.00 0.00 C ATOM 40 O ILE A 3 21.013 31.708 21.695 1.00 0.00 O ATOM 41 CB ILE A 3 19.287 29.204 21.835 1.00 0.00 C ATOM 42 CG1 ILE A 3 19.614 28.978 20.364 1.00 0.00 C ATOM 43 CG2 ILE A 3 18.209 28.215 22.289 1.00 0.00 C ATOM 44 CD1 ILE A 3 20.266 27.642 20.029 1.00 0.00 C ATOM 0 H ILE A 3 18.778 31.368 20.203 1.00 0.00 H new ATOM 0 HA ILE A 3 18.215 30.685 22.994 1.00 0.00 H new ATOM 0 HB ILE A 3 20.198 29.014 22.403 1.00 0.00 H new ATOM 0 HG12 ILE A 3 18.693 29.066 19.788 1.00 0.00 H new ATOM 0 HG13 ILE A 3 20.276 29.778 20.031 1.00 0.00 H new ATOM 0 HG21 ILE A 3 18.517 27.200 22.038 1.00 0.00 H new ATOM 0 HG22 ILE A 3 18.072 28.296 23.367 1.00 0.00 H new ATOM 0 HG23 ILE A 3 17.270 28.444 21.786 1.00 0.00 H new ATOM 0 HD11 ILE A 3 20.455 27.588 18.957 1.00 0.00 H new ATOM 0 HD12 ILE A 3 21.209 27.552 20.568 1.00 0.00 H new ATOM 0 HD13 ILE A 3 19.601 26.829 20.322 1.00 0.00 H new ATOM 56 N PHE A 4 20.336 31.638 23.852 1.00 0.00 N ATOM 57 CA PHE A 4 21.382 32.415 24.495 1.00 0.00 C ATOM 58 C PHE A 4 22.583 31.500 24.788 1.00 0.00 C ATOM 59 O PHE A 4 22.839 31.159 25.936 1.00 0.00 O ATOM 60 CB PHE A 4 20.839 32.904 25.833 1.00 0.00 C ATOM 61 CG PHE A 4 19.537 33.668 25.773 1.00 0.00 C ATOM 62 CD1 PHE A 4 19.410 34.848 25.045 1.00 0.00 C ATOM 63 CD2 PHE A 4 18.492 33.265 26.615 1.00 0.00 C ATOM 64 CE1 PHE A 4 18.215 35.586 25.041 1.00 0.00 C ATOM 65 CE2 PHE A 4 17.333 34.023 26.739 1.00 0.00 C ATOM 66 CZ PHE A 4 17.207 35.137 25.904 1.00 0.00 C ATOM 0 H PHE A 4 19.670 31.271 24.532 1.00 0.00 H new ATOM 0 HA PHE A 4 21.684 33.243 23.854 1.00 0.00 H new ATOM 0 HB2 PHE A 4 20.703 32.042 26.486 1.00 0.00 H new ATOM 0 HB3 PHE A 4 21.591 33.541 26.298 1.00 0.00 H new ATOM 0 HD1 PHE A 4 20.251 35.205 24.469 1.00 0.00 H new ATOM 0 HD2 PHE A 4 18.589 32.349 27.178 1.00 0.00 H new ATOM 0 HE1 PHE A 4 18.081 36.451 24.408 1.00 0.00 H new ATOM 0 HE2 PHE A 4 16.563 33.762 27.450 1.00 0.00 H new ATOM 0 HZ PHE A 4 16.276 35.685 25.926 1.00 0.00 H new ATOM 76 N VAL A 5 23.434 31.251 23.792 1.00 0.00 N ATOM 77 CA VAL A 5 24.717 30.609 23.916 1.00 0.00 C ATOM 78 C VAL A 5 25.641 31.512 24.749 1.00 0.00 C ATOM 79 O VAL A 5 25.793 32.704 24.485 1.00 0.00 O ATOM 80 CB VAL A 5 25.284 30.351 22.524 1.00 0.00 C ATOM 81 CG1 VAL A 5 26.581 29.547 22.606 1.00 0.00 C ATOM 82 CG2 VAL A 5 24.301 29.521 21.690 1.00 0.00 C ATOM 0 H VAL A 5 23.223 31.511 22.829 1.00 0.00 H new ATOM 0 HA VAL A 5 24.626 29.649 24.424 1.00 0.00 H new ATOM 0 HB VAL A 5 25.462 31.324 22.066 1.00 0.00 H new ATOM 0 HG11 VAL A 5 26.967 29.375 21.601 1.00 0.00 H new ATOM 0 HG12 VAL A 5 27.317 30.102 23.187 1.00 0.00 H new ATOM 0 HG13 VAL A 5 26.385 28.589 23.088 1.00 0.00 H new ATOM 0 HG21 VAL A 5 24.721 29.346 20.700 1.00 0.00 H new ATOM 0 HG22 VAL A 5 24.123 28.565 22.183 1.00 0.00 H new ATOM 0 HG23 VAL A 5 23.359 30.061 21.594 1.00 0.00 H new ATOM 92 N LYS A 6 26.333 30.959 25.733 1.00 0.00 N ATOM 93 CA LYS A 6 27.346 31.647 26.502 1.00 0.00 C ATOM 94 C LYS A 6 28.658 30.887 26.410 1.00 0.00 C ATOM 95 O LYS A 6 28.655 29.720 26.022 1.00 0.00 O ATOM 96 CB LYS A 6 26.922 31.733 27.965 1.00 0.00 C ATOM 97 CG LYS A 6 27.679 32.732 28.853 1.00 0.00 C ATOM 98 CD LYS A 6 26.871 33.608 29.813 1.00 0.00 C ATOM 99 CE LYS A 6 26.303 32.911 31.046 1.00 0.00 C ATOM 100 NZ LYS A 6 25.686 33.924 31.908 1.00 0.00 N ATOM 0 H LYS A 6 26.198 29.991 26.023 1.00 0.00 H new ATOM 0 HA LYS A 6 27.471 32.653 26.101 1.00 0.00 H new ATOM 0 HB2 LYS A 6 25.863 31.987 27.996 1.00 0.00 H new ATOM 0 HB3 LYS A 6 27.025 30.742 28.406 1.00 0.00 H new ATOM 0 HG2 LYS A 6 28.401 32.170 29.445 1.00 0.00 H new ATOM 0 HG3 LYS A 6 28.248 33.393 28.199 1.00 0.00 H new ATOM 0 HD2 LYS A 6 27.507 34.428 30.146 1.00 0.00 H new ATOM 0 HD3 LYS A 6 26.044 34.051 29.258 1.00 0.00 H new ATOM 0 HE2 LYS A 6 25.566 32.163 30.753 1.00 0.00 H new ATOM 0 HE3 LYS A 6 27.093 32.387 31.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 25.293 33.466 32.755 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 26.403 34.621 32.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 24.924 34.404 31.389 1.00 0.00 H new ATOM 114 N THR A 7 29.793 31.579 26.551 1.00 0.00 N ATOM 115 CA THR A 7 31.145 31.174 26.227 1.00 0.00 C ATOM 116 C THR A 7 31.990 31.154 27.495 1.00 0.00 C ATOM 117 O THR A 7 31.660 31.584 28.603 1.00 0.00 O ATOM 118 CB THR A 7 31.694 32.170 25.200 1.00 0.00 C ATOM 119 OG1 THR A 7 31.905 33.411 25.824 1.00 0.00 O ATOM 120 CG2 THR A 7 30.667 32.502 24.116 1.00 0.00 C ATOM 0 H THR A 7 29.775 32.525 26.932 1.00 0.00 H new ATOM 0 HA THR A 7 31.168 30.170 25.804 1.00 0.00 H new ATOM 0 HB THR A 7 32.591 31.710 24.786 1.00 0.00 H new ATOM 0 HG1 THR A 7 32.783 33.762 25.567 1.00 0.00 H new ATOM 0 HG21 THR A 7 31.099 33.211 23.410 1.00 0.00 H new ATOM 0 HG22 THR A 7 30.387 31.590 23.589 1.00 0.00 H new ATOM 0 HG23 THR A 7 29.782 32.942 24.576 1.00 0.00 H new ATOM 128 N LEU A 8 33.272 30.851 27.350 1.00 0.00 N ATOM 129 CA LEU A 8 34.368 30.842 28.293 1.00 0.00 C ATOM 130 C LEU A 8 34.757 32.321 28.452 1.00 0.00 C ATOM 131 O LEU A 8 35.132 32.666 29.567 1.00 0.00 O ATOM 132 CB LEU A 8 35.598 30.064 27.815 1.00 0.00 C ATOM 133 CG LEU A 8 35.453 28.670 27.196 1.00 0.00 C ATOM 134 CD1 LEU A 8 34.781 27.603 28.063 1.00 0.00 C ATOM 135 CD2 LEU A 8 34.846 28.638 25.787 1.00 0.00 C ATOM 0 H LEU A 8 33.608 30.565 26.430 1.00 0.00 H new ATOM 0 HA LEU A 8 34.050 30.350 29.212 1.00 0.00 H new ATOM 0 HB2 LEU A 8 36.107 30.689 27.081 1.00 0.00 H new ATOM 0 HB3 LEU A 8 36.267 29.967 28.670 1.00 0.00 H new ATOM 0 HG LEU A 8 36.506 28.397 27.122 1.00 0.00 H new ATOM 0 HD11 LEU A 8 34.738 26.662 27.514 1.00 0.00 H new ATOM 0 HD12 LEU A 8 35.356 27.463 28.978 1.00 0.00 H new ATOM 0 HD13 LEU A 8 33.770 27.923 28.315 1.00 0.00 H new ATOM 0 HD21 LEU A 8 34.787 27.607 25.440 1.00 0.00 H new ATOM 0 HD22 LEU A 8 33.846 29.071 25.812 1.00 0.00 H new ATOM 0 HD23 LEU A 8 35.474 29.214 25.107 1.00 0.00 H new ATOM 147 N THR A 9 34.839 33.166 27.430 1.00 0.00 N ATOM 148 CA THR A 9 35.276 34.547 27.532 1.00 0.00 C ATOM 149 C THR A 9 34.272 35.431 28.262 1.00 0.00 C ATOM 150 O THR A 9 34.579 36.569 28.625 1.00 0.00 O ATOM 151 CB THR A 9 35.491 35.025 26.100 1.00 0.00 C ATOM 152 OG1 THR A 9 34.374 34.736 25.295 1.00 0.00 O ATOM 153 CG2 THR A 9 36.704 34.454 25.351 1.00 0.00 C ATOM 0 H THR A 9 34.594 32.896 26.477 1.00 0.00 H new ATOM 0 HA THR A 9 36.189 34.611 28.124 1.00 0.00 H new ATOM 0 HB THR A 9 35.665 36.091 26.245 1.00 0.00 H new ATOM 0 HG1 THR A 9 34.537 35.054 24.383 1.00 0.00 H new ATOM 0 HG21 THR A 9 36.742 34.874 24.346 1.00 0.00 H new ATOM 0 HG22 THR A 9 37.617 34.713 25.887 1.00 0.00 H new ATOM 0 HG23 THR A 9 36.615 33.369 25.288 1.00 0.00 H new ATOM 161 N GLY A 10 33.025 34.980 28.355 1.00 0.00 N ATOM 162 CA GLY A 10 32.086 35.402 29.368 1.00 0.00 C ATOM 163 C GLY A 10 30.927 36.238 28.805 1.00 0.00 C ATOM 164 O GLY A 10 30.278 36.988 29.513 1.00 0.00 O ATOM 0 H GLY A 10 32.638 34.294 27.708 1.00 0.00 H new ATOM 0 HA2 GLY A 10 31.682 34.522 29.869 1.00 0.00 H new ATOM 0 HA3 GLY A 10 32.613 35.985 30.123 1.00 0.00 H new ATOM 168 N LYS A 11 30.563 35.908 27.559 1.00 0.00 N ATOM 169 CA LYS A 11 29.694 36.722 26.741 1.00 0.00 C ATOM 170 C LYS A 11 28.344 36.025 26.553 1.00 0.00 C ATOM 171 O LYS A 11 28.426 34.815 26.332 1.00 0.00 O ATOM 172 CB LYS A 11 30.312 37.045 25.376 1.00 0.00 C ATOM 173 CG LYS A 11 31.035 38.398 25.323 1.00 0.00 C ATOM 174 CD LYS A 11 32.447 38.425 25.895 1.00 0.00 C ATOM 175 CE LYS A 11 33.350 39.613 25.551 1.00 0.00 C ATOM 176 NZ LYS A 11 34.527 39.840 26.406 1.00 0.00 N ATOM 0 H LYS A 11 30.875 35.054 27.097 1.00 0.00 H new ATOM 0 HA LYS A 11 29.550 37.667 27.264 1.00 0.00 H new ATOM 0 HB2 LYS A 11 31.017 36.257 25.112 1.00 0.00 H new ATOM 0 HB3 LYS A 11 29.526 37.035 24.621 1.00 0.00 H new ATOM 0 HG2 LYS A 11 31.079 38.723 24.284 1.00 0.00 H new ATOM 0 HG3 LYS A 11 30.433 39.130 25.861 1.00 0.00 H new ATOM 0 HD2 LYS A 11 32.366 38.373 26.981 1.00 0.00 H new ATOM 0 HD3 LYS A 11 32.955 37.517 25.569 1.00 0.00 H new ATOM 0 HE2 LYS A 11 33.698 39.486 24.526 1.00 0.00 H new ATOM 0 HE3 LYS A 11 32.740 40.516 25.571 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 35.049 40.672 26.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 34.218 40.004 27.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 35.146 39.005 26.373 1.00 0.00 H new ATOM 190 N THR A 12 27.245 36.759 26.464 1.00 0.00 N ATOM 191 CA THR A 12 25.958 36.174 26.155 1.00 0.00 C ATOM 192 C THR A 12 25.739 36.432 24.659 1.00 0.00 C ATOM 193 O THR A 12 25.215 37.497 24.320 1.00 0.00 O ATOM 194 CB THR A 12 24.982 36.968 27.029 1.00 0.00 C ATOM 195 OG1 THR A 12 25.311 36.624 28.364 1.00 0.00 O ATOM 196 CG2 THR A 12 23.534 36.485 26.915 1.00 0.00 C ATOM 0 H THR A 12 27.224 37.769 26.604 1.00 0.00 H new ATOM 0 HA THR A 12 25.851 35.106 26.342 1.00 0.00 H new ATOM 0 HB THR A 12 25.057 38.016 26.740 1.00 0.00 H new ATOM 0 HG1 THR A 12 24.719 37.104 28.981 1.00 0.00 H new ATOM 0 HG21 THR A 12 22.897 37.090 27.560 1.00 0.00 H new ATOM 0 HG22 THR A 12 23.199 36.579 25.882 1.00 0.00 H new ATOM 0 HG23 THR A 12 23.473 35.441 27.222 1.00 0.00 H new ATOM 204 N ILE A 13 26.157 35.557 23.750 1.00 0.00 N ATOM 205 CA ILE A 13 26.121 35.746 22.318 1.00 0.00 C ATOM 206 C ILE A 13 24.729 36.148 21.822 1.00 0.00 C ATOM 207 O ILE A 13 24.583 37.103 21.056 1.00 0.00 O ATOM 208 CB ILE A 13 26.743 34.514 21.678 1.00 0.00 C ATOM 209 CG1 ILE A 13 28.118 34.113 22.225 1.00 0.00 C ATOM 210 CG2 ILE A 13 26.893 34.507 20.155 1.00 0.00 C ATOM 211 CD1 ILE A 13 29.099 35.278 22.288 1.00 0.00 C ATOM 0 H ILE A 13 26.549 34.653 24.014 1.00 0.00 H new ATOM 0 HA ILE A 13 26.720 36.602 22.007 1.00 0.00 H new ATOM 0 HB ILE A 13 25.972 33.799 21.964 1.00 0.00 H new ATOM 0 HG12 ILE A 13 27.997 33.693 23.224 1.00 0.00 H new ATOM 0 HG13 ILE A 13 28.537 33.326 21.597 1.00 0.00 H new ATOM 0 HG21 ILE A 13 27.350 33.569 19.839 1.00 0.00 H new ATOM 0 HG22 ILE A 13 25.911 34.606 19.692 1.00 0.00 H new ATOM 0 HG23 ILE A 13 27.525 35.340 19.848 1.00 0.00 H new ATOM 0 HD11 ILE A 13 30.053 34.929 22.683 1.00 0.00 H new ATOM 0 HD12 ILE A 13 29.247 35.683 21.287 1.00 0.00 H new ATOM 0 HD13 ILE A 13 28.699 36.056 22.939 1.00 0.00 H new ATOM 223 N THR A 14 23.724 35.319 22.093 1.00 0.00 N ATOM 224 CA THR A 14 22.364 35.555 21.664 1.00 0.00 C ATOM 225 C THR A 14 22.338 35.130 20.194 1.00 0.00 C ATOM 226 O THR A 14 22.613 35.975 19.361 1.00 0.00 O ATOM 227 CB THR A 14 21.733 36.905 22.037 1.00 0.00 C ATOM 228 OG1 THR A 14 21.819 36.992 23.442 1.00 0.00 O ATOM 229 CG2 THR A 14 20.231 37.055 21.782 1.00 0.00 C ATOM 0 H THR A 14 23.841 34.456 22.624 1.00 0.00 H new ATOM 0 HA THR A 14 21.661 34.955 22.241 1.00 0.00 H new ATOM 0 HB THR A 14 22.257 37.645 21.433 1.00 0.00 H new ATOM 0 HG1 THR A 14 21.430 37.840 23.742 1.00 0.00 H new ATOM 0 HG21 THR A 14 19.908 38.050 22.087 1.00 0.00 H new ATOM 0 HG22 THR A 14 20.027 36.916 20.720 1.00 0.00 H new ATOM 0 HG23 THR A 14 19.688 36.305 22.357 1.00 0.00 H new ATOM 237 N LEU A 15 22.198 33.825 19.961 1.00 0.00 N ATOM 238 CA LEU A 15 22.182 33.286 18.616 1.00 0.00 C ATOM 239 C LEU A 15 20.711 33.071 18.248 1.00 0.00 C ATOM 240 O LEU A 15 19.876 32.513 18.966 1.00 0.00 O ATOM 241 CB LEU A 15 22.816 31.901 18.565 1.00 0.00 C ATOM 242 CG LEU A 15 23.493 31.498 17.256 1.00 0.00 C ATOM 243 CD1 LEU A 15 24.595 32.428 16.764 1.00 0.00 C ATOM 244 CD2 LEU A 15 23.968 30.050 17.287 1.00 0.00 C ATOM 0 H LEU A 15 22.094 33.125 20.695 1.00 0.00 H new ATOM 0 HA LEU A 15 22.719 33.968 17.957 1.00 0.00 H new ATOM 0 HB2 LEU A 15 23.556 31.837 19.363 1.00 0.00 H new ATOM 0 HB3 LEU A 15 22.043 31.166 18.787 1.00 0.00 H new ATOM 0 HG LEU A 15 22.701 31.599 16.514 1.00 0.00 H new ATOM 0 HD11 LEU A 15 25.004 32.045 15.829 1.00 0.00 H new ATOM 0 HD12 LEU A 15 24.184 33.424 16.599 1.00 0.00 H new ATOM 0 HD13 LEU A 15 25.387 32.481 17.511 1.00 0.00 H new ATOM 0 HD21 LEU A 15 24.444 29.803 16.338 1.00 0.00 H new ATOM 0 HD22 LEU A 15 24.685 29.920 18.097 1.00 0.00 H new ATOM 0 HD23 LEU A 15 23.115 29.391 17.448 1.00 0.00 H new ATOM 256 N GLU A 16 20.397 33.421 17.003 1.00 0.00 N ATOM 257 CA GLU A 16 19.128 33.144 16.356 1.00 0.00 C ATOM 258 C GLU A 16 19.253 31.803 15.629 1.00 0.00 C ATOM 259 O GLU A 16 20.200 31.647 14.873 1.00 0.00 O ATOM 260 CB GLU A 16 18.772 34.214 15.315 1.00 0.00 C ATOM 261 CG GLU A 16 17.347 33.978 14.835 1.00 0.00 C ATOM 262 CD GLU A 16 16.806 35.054 13.915 1.00 0.00 C ATOM 263 OE1 GLU A 16 16.881 36.230 14.329 1.00 0.00 O ATOM 264 OE2 GLU A 16 16.190 34.748 12.872 1.00 0.00 O ATOM 0 H GLU A 16 21.047 33.924 16.399 1.00 0.00 H new ATOM 0 HA GLU A 16 18.348 33.131 17.118 1.00 0.00 H new ATOM 0 HB2 GLU A 16 18.863 35.209 15.750 1.00 0.00 H new ATOM 0 HB3 GLU A 16 19.465 34.169 14.475 1.00 0.00 H new ATOM 0 HG2 GLU A 16 17.306 33.020 14.316 1.00 0.00 H new ATOM 0 HG3 GLU A 16 16.693 33.898 15.704 1.00 0.00 H new ATOM 271 N VAL A 17 18.459 30.775 15.889 1.00 0.00 N ATOM 272 CA VAL A 17 18.571 29.450 15.312 1.00 0.00 C ATOM 273 C VAL A 17 17.213 29.232 14.626 1.00 0.00 C ATOM 274 O VAL A 17 16.207 29.828 15.011 1.00 0.00 O ATOM 275 CB VAL A 17 19.219 28.405 16.215 1.00 0.00 C ATOM 276 CG1 VAL A 17 18.886 26.943 15.870 1.00 0.00 C ATOM 277 CG2 VAL A 17 20.675 28.783 16.465 1.00 0.00 C ATOM 0 H VAL A 17 17.680 30.850 16.543 1.00 0.00 H new ATOM 0 HA VAL A 17 19.331 29.326 14.541 1.00 0.00 H new ATOM 0 HB VAL A 17 18.747 28.431 17.197 1.00 0.00 H new ATOM 0 HG11 VAL A 17 19.395 26.279 16.569 1.00 0.00 H new ATOM 0 HG12 VAL A 17 17.809 26.789 15.941 1.00 0.00 H new ATOM 0 HG13 VAL A 17 19.218 26.724 14.855 1.00 0.00 H new ATOM 0 HG21 VAL A 17 21.139 28.037 17.110 1.00 0.00 H new ATOM 0 HG22 VAL A 17 21.209 28.824 15.515 1.00 0.00 H new ATOM 0 HG23 VAL A 17 20.720 29.759 16.948 1.00 0.00 H new ATOM 287 N GLU A 18 17.224 28.408 13.577 1.00 0.00 N ATOM 288 CA GLU A 18 16.015 27.935 12.927 1.00 0.00 C ATOM 289 C GLU A 18 15.757 26.487 13.330 1.00 0.00 C ATOM 290 O GLU A 18 16.746 25.755 13.275 1.00 0.00 O ATOM 291 CB GLU A 18 16.270 27.981 11.416 1.00 0.00 C ATOM 292 CG GLU A 18 16.258 29.346 10.732 1.00 0.00 C ATOM 293 CD GLU A 18 15.043 30.190 11.075 1.00 0.00 C ATOM 294 OE1 GLU A 18 13.973 29.682 11.492 1.00 0.00 O ATOM 295 OE2 GLU A 18 15.182 31.388 10.772 1.00 0.00 O ATOM 0 H GLU A 18 18.082 28.051 13.156 1.00 0.00 H new ATOM 0 HA GLU A 18 15.159 28.548 13.209 1.00 0.00 H new ATOM 0 HB2 GLU A 18 17.239 27.520 11.226 1.00 0.00 H new ATOM 0 HB3 GLU A 18 15.520 27.357 10.931 1.00 0.00 H new ATOM 0 HG2 GLU A 18 17.159 29.891 11.013 1.00 0.00 H new ATOM 0 HG3 GLU A 18 16.296 29.202 9.652 1.00 0.00 H new ATOM 302 N PRO A 19 14.557 26.023 13.672 1.00 0.00 N ATOM 303 CA PRO A 19 14.344 24.675 14.158 1.00 0.00 C ATOM 304 C PRO A 19 14.774 23.500 13.274 1.00 0.00 C ATOM 305 O PRO A 19 14.970 22.386 13.755 1.00 0.00 O ATOM 306 CB PRO A 19 12.838 24.666 14.402 1.00 0.00 C ATOM 307 CG PRO A 19 12.230 25.672 13.409 1.00 0.00 C ATOM 308 CD PRO A 19 13.335 26.722 13.321 1.00 0.00 C ATOM 0 HA PRO A 19 14.985 24.494 15.021 1.00 0.00 H new ATOM 0 HB2 PRO A 19 12.425 23.669 14.246 1.00 0.00 H new ATOM 0 HB3 PRO A 19 12.610 24.949 15.430 1.00 0.00 H new ATOM 0 HG2 PRO A 19 12.020 25.216 12.441 1.00 0.00 H new ATOM 0 HG3 PRO A 19 11.293 26.093 13.774 1.00 0.00 H new ATOM 0 HD2 PRO A 19 13.398 27.144 12.318 1.00 0.00 H new ATOM 0 HD3 PRO A 19 13.146 27.550 14.004 1.00 0.00 H new ATOM 316 N SER A 20 14.972 23.752 11.986 1.00 0.00 N ATOM 317 CA SER A 20 15.586 22.884 10.996 1.00 0.00 C ATOM 318 C SER A 20 17.107 22.760 11.119 1.00 0.00 C ATOM 319 O SER A 20 17.588 21.732 10.646 1.00 0.00 O ATOM 320 CB SER A 20 15.309 23.350 9.562 1.00 0.00 C ATOM 321 OG SER A 20 15.549 24.727 9.404 1.00 0.00 O ATOM 0 H SER A 20 14.683 24.641 11.577 1.00 0.00 H new ATOM 0 HA SER A 20 15.126 21.917 11.201 1.00 0.00 H new ATOM 0 HB2 SER A 20 15.938 22.790 8.870 1.00 0.00 H new ATOM 0 HB3 SER A 20 14.274 23.129 9.302 1.00 0.00 H new ATOM 0 HG SER A 20 15.364 24.987 8.478 1.00 0.00 H new ATOM 327 N ASP A 21 17.840 23.598 11.846 1.00 0.00 N ATOM 328 CA ASP A 21 19.286 23.607 11.956 1.00 0.00 C ATOM 329 C ASP A 21 19.782 22.344 12.658 1.00 0.00 C ATOM 330 O ASP A 21 19.277 22.020 13.736 1.00 0.00 O ATOM 331 CB ASP A 21 19.902 24.795 12.690 1.00 0.00 C ATOM 332 CG ASP A 21 19.812 26.186 12.089 1.00 0.00 C ATOM 333 OD1 ASP A 21 19.614 26.297 10.850 1.00 0.00 O ATOM 334 OD2 ASP A 21 20.173 27.173 12.758 1.00 0.00 O ATOM 0 H ASP A 21 17.408 24.333 12.407 1.00 0.00 H new ATOM 0 HA ASP A 21 19.609 23.673 10.917 1.00 0.00 H new ATOM 0 HB2 ASP A 21 19.445 24.838 13.678 1.00 0.00 H new ATOM 0 HB3 ASP A 21 20.959 24.573 12.837 1.00 0.00 H new ATOM 339 N THR A 22 20.744 21.596 12.123 1.00 0.00 N ATOM 340 CA THR A 22 21.487 20.614 12.887 1.00 0.00 C ATOM 341 C THR A 22 22.654 21.326 13.586 1.00 0.00 C ATOM 342 O THR A 22 22.980 22.474 13.286 1.00 0.00 O ATOM 343 CB THR A 22 21.907 19.553 11.868 1.00 0.00 C ATOM 344 OG1 THR A 22 22.549 20.081 10.731 1.00 0.00 O ATOM 345 CG2 THR A 22 20.717 18.766 11.324 1.00 0.00 C ATOM 0 H THR A 22 21.026 21.659 11.145 1.00 0.00 H new ATOM 0 HA THR A 22 20.923 20.130 13.684 1.00 0.00 H new ATOM 0 HB THR A 22 22.590 18.921 12.436 1.00 0.00 H new ATOM 0 HG1 THR A 22 22.791 19.351 10.124 1.00 0.00 H new ATOM 0 HG21 THR A 22 21.068 18.026 10.605 1.00 0.00 H new ATOM 0 HG22 THR A 22 20.209 18.261 12.145 1.00 0.00 H new ATOM 0 HG23 THR A 22 20.023 19.448 10.833 1.00 0.00 H new ATOM 353 N ILE A 23 23.420 20.653 14.433 1.00 0.00 N ATOM 354 CA ILE A 23 24.605 21.106 15.145 1.00 0.00 C ATOM 355 C ILE A 23 25.644 21.861 14.305 1.00 0.00 C ATOM 356 O ILE A 23 26.172 22.866 14.773 1.00 0.00 O ATOM 357 CB ILE A 23 25.139 19.954 15.990 1.00 0.00 C ATOM 358 CG1 ILE A 23 24.186 19.503 17.100 1.00 0.00 C ATOM 359 CG2 ILE A 23 26.562 20.221 16.488 1.00 0.00 C ATOM 360 CD1 ILE A 23 24.081 20.571 18.192 1.00 0.00 C ATOM 0 H ILE A 23 23.206 19.682 14.660 1.00 0.00 H new ATOM 0 HA ILE A 23 24.308 21.909 15.820 1.00 0.00 H new ATOM 0 HB ILE A 23 25.197 19.096 15.320 1.00 0.00 H new ATOM 0 HG12 ILE A 23 23.199 19.306 16.681 1.00 0.00 H new ATOM 0 HG13 ILE A 23 24.541 18.568 17.533 1.00 0.00 H new ATOM 0 HG21 ILE A 23 26.903 19.375 17.085 1.00 0.00 H new ATOM 0 HG22 ILE A 23 27.227 20.354 15.635 1.00 0.00 H new ATOM 0 HG23 ILE A 23 26.570 21.124 17.099 1.00 0.00 H new ATOM 0 HD11 ILE A 23 23.399 20.230 18.970 1.00 0.00 H new ATOM 0 HD12 ILE A 23 25.066 20.747 18.624 1.00 0.00 H new ATOM 0 HD13 ILE A 23 23.703 21.498 17.760 1.00 0.00 H new ATOM 372 N GLU A 24 25.830 21.379 13.077 1.00 0.00 N ATOM 373 CA GLU A 24 26.674 21.974 12.065 1.00 0.00 C ATOM 374 C GLU A 24 26.224 23.401 11.743 1.00 0.00 C ATOM 375 O GLU A 24 27.125 24.213 11.549 1.00 0.00 O ATOM 376 CB GLU A 24 26.544 21.125 10.804 1.00 0.00 C ATOM 377 CG GLU A 24 27.546 21.267 9.648 1.00 0.00 C ATOM 378 CD GLU A 24 28.924 20.705 9.973 1.00 0.00 C ATOM 379 OE1 GLU A 24 29.014 19.627 10.607 1.00 0.00 O ATOM 380 OE2 GLU A 24 29.874 21.147 9.294 1.00 0.00 O ATOM 0 H GLU A 24 25.373 20.526 12.755 1.00 0.00 H new ATOM 0 HA GLU A 24 27.702 22.012 12.425 1.00 0.00 H new ATOM 0 HB2 GLU A 24 26.565 20.081 11.118 1.00 0.00 H new ATOM 0 HB3 GLU A 24 25.553 21.314 10.392 1.00 0.00 H new ATOM 0 HG2 GLU A 24 27.151 20.757 8.769 1.00 0.00 H new ATOM 0 HG3 GLU A 24 27.643 22.321 9.388 1.00 0.00 H new ATOM 387 N ASN A 25 24.926 23.689 11.598 1.00 0.00 N ATOM 388 CA ASN A 25 24.347 24.934 11.152 1.00 0.00 C ATOM 389 C ASN A 25 24.476 25.988 12.262 1.00 0.00 C ATOM 390 O ASN A 25 24.837 27.133 12.040 1.00 0.00 O ATOM 391 CB ASN A 25 22.890 24.827 10.697 1.00 0.00 C ATOM 392 CG ASN A 25 22.698 23.798 9.600 1.00 0.00 C ATOM 393 OD1 ASN A 25 21.929 22.847 9.744 1.00 0.00 O ATOM 394 ND2 ASN A 25 23.225 24.029 8.405 1.00 0.00 N ATOM 0 H ASN A 25 24.209 22.995 11.809 1.00 0.00 H new ATOM 0 HA ASN A 25 24.910 25.231 10.267 1.00 0.00 H new ATOM 0 HB2 ASN A 25 22.265 24.564 11.550 1.00 0.00 H new ATOM 0 HB3 ASN A 25 22.552 25.800 10.341 1.00 0.00 H new ATOM 0 HD21 ASN A 25 22.992 23.422 7.619 1.00 0.00 H new ATOM 0 HD22 ASN A 25 23.863 24.813 8.272 1.00 0.00 H new ATOM 401 N VAL A 26 24.338 25.519 13.498 1.00 0.00 N ATOM 402 CA VAL A 26 24.563 26.295 14.698 1.00 0.00 C ATOM 403 C VAL A 26 26.048 26.632 14.848 1.00 0.00 C ATOM 404 O VAL A 26 26.448 27.787 14.955 1.00 0.00 O ATOM 405 CB VAL A 26 24.026 25.447 15.856 1.00 0.00 C ATOM 406 CG1 VAL A 26 24.258 26.062 17.235 1.00 0.00 C ATOM 407 CG2 VAL A 26 22.566 25.087 15.576 1.00 0.00 C ATOM 0 H VAL A 26 24.057 24.557 13.691 1.00 0.00 H new ATOM 0 HA VAL A 26 24.050 27.256 14.671 1.00 0.00 H new ATOM 0 HB VAL A 26 24.605 24.525 15.902 1.00 0.00 H new ATOM 0 HG11 VAL A 26 23.850 25.402 18.001 1.00 0.00 H new ATOM 0 HG12 VAL A 26 25.328 26.192 17.400 1.00 0.00 H new ATOM 0 HG13 VAL A 26 23.762 27.031 17.289 1.00 0.00 H new ATOM 0 HG21 VAL A 26 22.176 24.483 16.396 1.00 0.00 H new ATOM 0 HG22 VAL A 26 21.977 26.000 15.486 1.00 0.00 H new ATOM 0 HG23 VAL A 26 22.503 24.521 14.647 1.00 0.00 H new ATOM 417 N LYS A 27 26.899 25.605 14.836 1.00 0.00 N ATOM 418 CA LYS A 27 28.348 25.665 14.753 1.00 0.00 C ATOM 419 C LYS A 27 28.856 26.667 13.728 1.00 0.00 C ATOM 420 O LYS A 27 29.770 27.442 14.007 1.00 0.00 O ATOM 421 CB LYS A 27 29.056 24.316 14.646 1.00 0.00 C ATOM 422 CG LYS A 27 29.085 23.390 15.867 1.00 0.00 C ATOM 423 CD LYS A 27 30.018 22.209 15.608 1.00 0.00 C ATOM 424 CE LYS A 27 30.521 21.497 16.862 1.00 0.00 C ATOM 425 NZ LYS A 27 31.429 20.399 16.510 1.00 0.00 N ATOM 0 H LYS A 27 26.563 24.643 14.888 1.00 0.00 H new ATOM 0 HA LYS A 27 28.633 26.044 15.734 1.00 0.00 H new ATOM 0 HB2 LYS A 27 28.592 23.766 13.827 1.00 0.00 H new ATOM 0 HB3 LYS A 27 30.089 24.509 14.356 1.00 0.00 H new ATOM 0 HG2 LYS A 27 29.420 23.943 16.744 1.00 0.00 H new ATOM 0 HG3 LYS A 27 28.080 23.029 16.083 1.00 0.00 H new ATOM 0 HD2 LYS A 27 29.498 21.485 14.981 1.00 0.00 H new ATOM 0 HD3 LYS A 27 30.878 22.563 15.039 1.00 0.00 H new ATOM 0 HE2 LYS A 27 31.037 22.208 17.507 1.00 0.00 H new ATOM 0 HE3 LYS A 27 29.675 21.108 17.429 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 31.798 19.962 17.378 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 30.913 19.686 15.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 32.220 20.770 15.946 1.00 0.00 H new ATOM 439 N ALA A 28 28.241 26.665 12.548 1.00 0.00 N ATOM 440 CA ALA A 28 28.494 27.545 11.424 1.00 0.00 C ATOM 441 C ALA A 28 28.226 28.995 11.822 1.00 0.00 C ATOM 442 O ALA A 28 29.010 29.889 11.500 1.00 0.00 O ATOM 443 CB ALA A 28 27.585 27.239 10.217 1.00 0.00 C ATOM 0 H ALA A 28 27.499 25.996 12.344 1.00 0.00 H new ATOM 0 HA ALA A 28 29.535 27.386 11.144 1.00 0.00 H new ATOM 0 HB1 ALA A 28 27.816 27.927 9.404 1.00 0.00 H new ATOM 0 HB2 ALA A 28 27.754 26.215 9.885 1.00 0.00 H new ATOM 0 HB3 ALA A 28 26.541 27.359 10.508 1.00 0.00 H new ATOM 449 N LYS A 29 27.028 29.204 12.349 1.00 0.00 N ATOM 450 CA LYS A 29 26.606 30.519 12.783 1.00 0.00 C ATOM 451 C LYS A 29 27.414 31.163 13.917 1.00 0.00 C ATOM 452 O LYS A 29 27.619 32.372 13.891 1.00 0.00 O ATOM 453 CB LYS A 29 25.175 30.543 13.312 1.00 0.00 C ATOM 454 CG LYS A 29 24.079 30.486 12.253 1.00 0.00 C ATOM 455 CD LYS A 29 22.664 30.393 12.838 1.00 0.00 C ATOM 456 CE LYS A 29 21.661 30.172 11.712 1.00 0.00 C ATOM 457 NZ LYS A 29 21.596 28.773 11.239 1.00 0.00 N ATOM 0 H LYS A 29 26.331 28.472 12.485 1.00 0.00 H new ATOM 0 HA LYS A 29 26.747 31.076 11.857 1.00 0.00 H new ATOM 0 HB2 LYS A 29 25.044 29.700 13.991 1.00 0.00 H new ATOM 0 HB3 LYS A 29 25.040 31.450 13.901 1.00 0.00 H new ATOM 0 HG2 LYS A 29 24.146 31.374 11.625 1.00 0.00 H new ATOM 0 HG3 LYS A 29 24.254 29.625 11.607 1.00 0.00 H new ATOM 0 HD2 LYS A 29 22.609 29.573 13.555 1.00 0.00 H new ATOM 0 HD3 LYS A 29 22.422 31.307 13.380 1.00 0.00 H new ATOM 0 HE2 LYS A 29 20.672 30.477 12.054 1.00 0.00 H new ATOM 0 HE3 LYS A 29 21.922 30.818 10.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 20.883 28.694 10.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 22.525 28.489 10.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 21.335 28.151 12.030 1.00 0.00 H new ATOM 471 N ILE A 30 27.891 30.290 14.800 1.00 0.00 N ATOM 472 CA ILE A 30 28.917 30.588 15.790 1.00 0.00 C ATOM 473 C ILE A 30 30.259 30.838 15.091 1.00 0.00 C ATOM 474 O ILE A 30 30.930 31.785 15.484 1.00 0.00 O ATOM 475 CB ILE A 30 29.114 29.501 16.841 1.00 0.00 C ATOM 476 CG1 ILE A 30 27.791 29.508 17.616 1.00 0.00 C ATOM 477 CG2 ILE A 30 30.318 29.614 17.781 1.00 0.00 C ATOM 478 CD1 ILE A 30 27.415 28.322 18.513 1.00 0.00 C ATOM 0 H ILE A 30 27.562 29.325 14.846 1.00 0.00 H new ATOM 0 HA ILE A 30 28.564 31.476 16.315 1.00 0.00 H new ATOM 0 HB ILE A 30 29.357 28.567 16.334 1.00 0.00 H new ATOM 0 HG12 ILE A 30 27.788 30.400 18.242 1.00 0.00 H new ATOM 0 HG13 ILE A 30 26.990 29.628 16.887 1.00 0.00 H new ATOM 0 HG21 ILE A 30 30.322 28.769 18.470 1.00 0.00 H new ATOM 0 HG22 ILE A 30 31.238 29.610 17.196 1.00 0.00 H new ATOM 0 HG23 ILE A 30 30.252 30.543 18.347 1.00 0.00 H new ATOM 0 HD11 ILE A 30 26.446 28.509 18.977 1.00 0.00 H new ATOM 0 HD12 ILE A 30 27.360 27.414 17.912 1.00 0.00 H new ATOM 0 HD13 ILE A 30 28.171 28.199 19.289 1.00 0.00 H new ATOM 490 N GLN A 31 30.610 29.994 14.124 1.00 0.00 N ATOM 491 CA GLN A 31 31.862 30.135 13.425 1.00 0.00 C ATOM 492 C GLN A 31 32.011 31.454 12.674 1.00 0.00 C ATOM 493 O GLN A 31 33.033 32.141 12.761 1.00 0.00 O ATOM 494 CB GLN A 31 32.148 28.906 12.562 1.00 0.00 C ATOM 495 CG GLN A 31 33.159 28.979 11.419 1.00 0.00 C ATOM 496 CD GLN A 31 32.700 29.153 9.981 1.00 0.00 C ATOM 497 OE1 GLN A 31 33.498 28.983 9.063 1.00 0.00 O ATOM 498 NE2 GLN A 31 31.418 29.449 9.765 1.00 0.00 N ATOM 0 H GLN A 31 30.038 29.209 13.814 1.00 0.00 H new ATOM 0 HA GLN A 31 32.640 30.184 14.187 1.00 0.00 H new ATOM 0 HB2 GLN A 31 32.477 28.112 13.232 1.00 0.00 H new ATOM 0 HB3 GLN A 31 31.199 28.587 12.132 1.00 0.00 H new ATOM 0 HG2 GLN A 31 33.834 29.806 11.641 1.00 0.00 H new ATOM 0 HG3 GLN A 31 33.751 28.065 11.457 1.00 0.00 H new ATOM 0 HE21 GLN A 31 30.786 29.583 10.554 1.00 0.00 H new ATOM 0 HE22 GLN A 31 31.070 29.542 8.811 1.00 0.00 H new ATOM 507 N ASP A 32 30.994 31.883 11.925 1.00 0.00 N ATOM 508 CA ASP A 32 30.701 33.267 11.616 1.00 0.00 C ATOM 509 C ASP A 32 30.940 34.435 12.573 1.00 0.00 C ATOM 510 O ASP A 32 31.662 35.397 12.331 1.00 0.00 O ATOM 511 CB ASP A 32 29.393 33.472 10.835 1.00 0.00 C ATOM 512 CG ASP A 32 29.182 34.839 10.201 1.00 0.00 C ATOM 513 OD1 ASP A 32 29.962 35.253 9.323 1.00 0.00 O ATOM 514 OD2 ASP A 32 28.097 35.382 10.503 1.00 0.00 O ATOM 0 H ASP A 32 30.326 31.238 11.502 1.00 0.00 H new ATOM 0 HA ASP A 32 31.601 33.374 11.010 1.00 0.00 H new ATOM 0 HB2 ASP A 32 29.346 32.721 10.047 1.00 0.00 H new ATOM 0 HB3 ASP A 32 28.560 33.278 11.510 1.00 0.00 H new ATOM 519 N LYS A 33 30.260 34.387 13.716 1.00 0.00 N ATOM 520 CA LYS A 33 29.972 35.572 14.491 1.00 0.00 C ATOM 521 C LYS A 33 31.015 35.786 15.595 1.00 0.00 C ATOM 522 O LYS A 33 31.234 36.881 16.096 1.00 0.00 O ATOM 523 CB LYS A 33 28.590 35.373 15.110 1.00 0.00 C ATOM 524 CG LYS A 33 27.943 36.529 15.876 1.00 0.00 C ATOM 525 CD LYS A 33 26.695 36.089 16.631 1.00 0.00 C ATOM 526 CE LYS A 33 26.217 37.239 17.518 1.00 0.00 C ATOM 527 NZ LYS A 33 25.776 38.425 16.777 1.00 0.00 N ATOM 0 H LYS A 33 29.898 33.524 14.123 1.00 0.00 H new ATOM 0 HA LYS A 33 30.000 36.454 13.851 1.00 0.00 H new ATOM 0 HB2 LYS A 33 27.909 35.089 14.308 1.00 0.00 H new ATOM 0 HB3 LYS A 33 28.654 34.524 15.790 1.00 0.00 H new ATOM 0 HG2 LYS A 33 28.664 36.945 16.580 1.00 0.00 H new ATOM 0 HG3 LYS A 33 27.682 37.325 15.178 1.00 0.00 H new ATOM 0 HD2 LYS A 33 25.911 35.805 15.929 1.00 0.00 H new ATOM 0 HD3 LYS A 33 26.913 35.211 17.239 1.00 0.00 H new ATOM 0 HE2 LYS A 33 25.394 36.886 18.140 1.00 0.00 H new ATOM 0 HE3 LYS A 33 27.025 37.524 18.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 25.374 39.118 17.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 26.588 38.848 16.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 25.053 38.151 16.081 1.00 0.00 H new ATOM 541 N GLU A 34 31.563 34.670 16.076 1.00 0.00 N ATOM 542 CA GLU A 34 32.568 34.524 17.112 1.00 0.00 C ATOM 543 C GLU A 34 33.907 34.075 16.510 1.00 0.00 C ATOM 544 O GLU A 34 34.946 34.315 17.111 1.00 0.00 O ATOM 545 CB GLU A 34 32.155 33.472 18.134 1.00 0.00 C ATOM 546 CG GLU A 34 31.719 34.093 19.469 1.00 0.00 C ATOM 547 CD GLU A 34 32.736 34.990 20.166 1.00 0.00 C ATOM 548 OE1 GLU A 34 32.834 36.194 19.856 1.00 0.00 O ATOM 549 OE2 GLU A 34 33.580 34.494 20.949 1.00 0.00 O ATOM 0 H GLU A 34 31.282 33.761 15.709 1.00 0.00 H new ATOM 0 HA GLU A 34 32.669 35.497 17.592 1.00 0.00 H new ATOM 0 HB2 GLU A 34 31.337 32.877 17.729 1.00 0.00 H new ATOM 0 HB3 GLU A 34 32.988 32.791 18.308 1.00 0.00 H new ATOM 0 HG2 GLU A 34 30.814 34.675 19.295 1.00 0.00 H new ATOM 0 HG3 GLU A 34 31.453 33.285 20.151 1.00 0.00 H new ATOM 556 N GLY A 35 33.922 33.369 15.394 1.00 0.00 N ATOM 557 CA GLY A 35 35.188 33.189 14.701 1.00 0.00 C ATOM 558 C GLY A 35 36.026 31.918 14.884 1.00 0.00 C ATOM 559 O GLY A 35 37.048 31.863 14.198 1.00 0.00 O ATOM 0 H GLY A 35 33.111 32.927 14.961 1.00 0.00 H new ATOM 0 HA2 GLY A 35 34.982 33.282 13.635 1.00 0.00 H new ATOM 0 HA3 GLY A 35 35.823 34.030 14.978 1.00 0.00 H new ATOM 563 N ILE A 36 35.621 30.989 15.738 1.00 0.00 N ATOM 564 CA ILE A 36 36.367 29.760 15.964 1.00 0.00 C ATOM 565 C ILE A 36 35.977 28.722 14.918 1.00 0.00 C ATOM 566 O ILE A 36 34.795 28.762 14.590 1.00 0.00 O ATOM 567 CB ILE A 36 36.084 29.244 17.381 1.00 0.00 C ATOM 568 CG1 ILE A 36 34.645 29.012 17.844 1.00 0.00 C ATOM 569 CG2 ILE A 36 36.958 29.892 18.451 1.00 0.00 C ATOM 570 CD1 ILE A 36 33.812 30.213 18.287 1.00 0.00 C ATOM 0 H ILE A 36 34.768 31.066 16.292 1.00 0.00 H new ATOM 0 HA ILE A 36 37.436 29.954 15.872 1.00 0.00 H new ATOM 0 HB ILE A 36 36.396 28.209 17.244 1.00 0.00 H new ATOM 0 HG12 ILE A 36 34.111 28.522 17.029 1.00 0.00 H new ATOM 0 HG13 ILE A 36 34.675 28.307 18.675 1.00 0.00 H new ATOM 0 HG21 ILE A 36 36.704 29.480 19.427 1.00 0.00 H new ATOM 0 HG22 ILE A 36 38.007 29.691 18.235 1.00 0.00 H new ATOM 0 HG23 ILE A 36 36.788 30.969 18.456 1.00 0.00 H new ATOM 0 HD11 ILE A 36 32.818 29.877 18.584 1.00 0.00 H new ATOM 0 HD12 ILE A 36 34.298 30.701 19.132 1.00 0.00 H new ATOM 0 HD13 ILE A 36 33.725 30.920 17.462 1.00 0.00 H new ATOM 582 N PRO A 37 36.774 27.804 14.361 1.00 0.00 N ATOM 583 CA PRO A 37 36.376 26.742 13.457 1.00 0.00 C ATOM 584 C PRO A 37 35.443 25.770 14.173 1.00 0.00 C ATOM 585 O PRO A 37 35.406 25.684 15.404 1.00 0.00 O ATOM 586 CB PRO A 37 37.712 26.139 13.025 1.00 0.00 C ATOM 587 CG PRO A 37 38.596 26.212 14.266 1.00 0.00 C ATOM 588 CD PRO A 37 38.102 27.538 14.874 1.00 0.00 C ATOM 0 HA PRO A 37 35.800 27.063 12.589 1.00 0.00 H new ATOM 0 HB2 PRO A 37 37.590 25.110 12.687 1.00 0.00 H new ATOM 0 HB3 PRO A 37 38.148 26.697 12.196 1.00 0.00 H new ATOM 0 HG2 PRO A 37 38.444 25.365 14.935 1.00 0.00 H new ATOM 0 HG3 PRO A 37 39.658 26.237 14.020 1.00 0.00 H new ATOM 0 HD2 PRO A 37 38.083 27.474 15.962 1.00 0.00 H new ATOM 0 HD3 PRO A 37 38.780 28.351 14.614 1.00 0.00 H new ATOM 596 N PRO A 38 34.728 25.001 13.362 1.00 0.00 N ATOM 597 CA PRO A 38 33.657 24.121 13.789 1.00 0.00 C ATOM 598 C PRO A 38 34.101 22.753 14.289 1.00 0.00 C ATOM 599 O PRO A 38 33.333 22.153 15.036 1.00 0.00 O ATOM 600 CB PRO A 38 32.737 23.935 12.586 1.00 0.00 C ATOM 601 CG PRO A 38 33.627 24.042 11.348 1.00 0.00 C ATOM 602 CD PRO A 38 34.703 24.969 11.910 1.00 0.00 C ATOM 0 HA PRO A 38 33.172 24.590 14.645 1.00 0.00 H new ATOM 0 HB2 PRO A 38 32.238 22.967 12.624 1.00 0.00 H new ATOM 0 HB3 PRO A 38 31.957 24.696 12.571 1.00 0.00 H new ATOM 0 HG2 PRO A 38 34.025 23.078 11.030 1.00 0.00 H new ATOM 0 HG3 PRO A 38 33.107 24.470 10.491 1.00 0.00 H new ATOM 0 HD2 PRO A 38 35.678 24.648 11.543 1.00 0.00 H new ATOM 0 HD3 PRO A 38 34.537 25.978 11.533 1.00 0.00 H new ATOM 610 N ASP A 39 35.342 22.322 14.083 1.00 0.00 N ATOM 611 CA ASP A 39 35.972 21.257 14.838 1.00 0.00 C ATOM 612 C ASP A 39 36.417 21.594 16.259 1.00 0.00 C ATOM 613 O ASP A 39 36.266 20.755 17.145 1.00 0.00 O ATOM 614 CB ASP A 39 37.108 20.684 13.993 1.00 0.00 C ATOM 615 CG ASP A 39 38.254 19.877 14.565 1.00 0.00 C ATOM 616 OD1 ASP A 39 39.282 20.489 14.957 1.00 0.00 O ATOM 617 OD2 ASP A 39 38.167 18.633 14.637 1.00 0.00 O ATOM 0 H ASP A 39 35.949 22.718 13.366 1.00 0.00 H new ATOM 0 HA ASP A 39 35.199 20.511 15.022 1.00 0.00 H new ATOM 0 HB2 ASP A 39 36.639 20.056 13.235 1.00 0.00 H new ATOM 0 HB3 ASP A 39 37.558 21.529 13.472 1.00 0.00 H new ATOM 622 N GLN A 40 36.896 22.824 16.468 1.00 0.00 N ATOM 623 CA GLN A 40 37.349 23.296 17.761 1.00 0.00 C ATOM 624 C GLN A 40 36.218 23.446 18.789 1.00 0.00 C ATOM 625 O GLN A 40 36.514 23.323 19.972 1.00 0.00 O ATOM 626 CB GLN A 40 38.073 24.640 17.709 1.00 0.00 C ATOM 627 CG GLN A 40 38.420 25.500 18.917 1.00 0.00 C ATOM 628 CD GLN A 40 39.588 26.462 18.741 1.00 0.00 C ATOM 629 OE1 GLN A 40 39.778 27.404 19.502 1.00 0.00 O ATOM 630 NE2 GLN A 40 40.374 26.313 17.672 1.00 0.00 N ATOM 0 H GLN A 40 36.977 23.522 15.728 1.00 0.00 H new ATOM 0 HA GLN A 40 38.041 22.512 18.070 1.00 0.00 H new ATOM 0 HB2 GLN A 40 39.017 24.450 17.197 1.00 0.00 H new ATOM 0 HB3 GLN A 40 37.477 25.274 17.053 1.00 0.00 H new ATOM 0 HG2 GLN A 40 37.538 26.078 19.191 1.00 0.00 H new ATOM 0 HG3 GLN A 40 38.642 24.840 19.756 1.00 0.00 H new ATOM 0 HE21 GLN A 40 40.223 25.532 17.033 1.00 0.00 H new ATOM 0 HE22 GLN A 40 41.125 26.980 17.494 1.00 0.00 H new ATOM 639 N GLN A 41 34.966 23.614 18.368 1.00 0.00 N ATOM 640 CA GLN A 41 33.859 24.000 19.211 1.00 0.00 C ATOM 641 C GLN A 41 33.327 22.704 19.831 1.00 0.00 C ATOM 642 O GLN A 41 32.981 21.862 19.003 1.00 0.00 O ATOM 643 CB GLN A 41 32.752 24.522 18.291 1.00 0.00 C ATOM 644 CG GLN A 41 32.875 25.984 17.855 1.00 0.00 C ATOM 645 CD GLN A 41 31.841 26.296 16.782 1.00 0.00 C ATOM 646 OE1 GLN A 41 30.647 26.212 17.053 1.00 0.00 O ATOM 647 NE2 GLN A 41 32.276 26.749 15.610 1.00 0.00 N ATOM 0 H GLN A 41 34.695 23.478 17.394 1.00 0.00 H new ATOM 0 HA GLN A 41 34.150 24.739 19.957 1.00 0.00 H new ATOM 0 HB2 GLN A 41 32.725 23.898 17.398 1.00 0.00 H new ATOM 0 HB3 GLN A 41 31.795 24.394 18.798 1.00 0.00 H new ATOM 0 HG2 GLN A 41 32.731 26.641 18.713 1.00 0.00 H new ATOM 0 HG3 GLN A 41 33.878 26.175 17.472 1.00 0.00 H new ATOM 0 HE21 GLN A 41 33.277 26.803 15.424 1.00 0.00 H new ATOM 0 HE22 GLN A 41 31.608 27.042 14.897 1.00 0.00 H new ATOM 656 N ARG A 42 33.137 22.585 21.142 1.00 0.00 N ATOM 657 CA ARG A 42 32.179 21.631 21.648 1.00 0.00 C ATOM 658 C ARG A 42 31.046 22.494 22.216 1.00 0.00 C ATOM 659 O ARG A 42 31.231 23.649 22.585 1.00 0.00 O ATOM 660 CB ARG A 42 32.837 20.787 22.740 1.00 0.00 C ATOM 661 CG ARG A 42 33.845 19.828 22.114 1.00 0.00 C ATOM 662 CD ARG A 42 34.772 19.160 23.131 1.00 0.00 C ATOM 663 NE ARG A 42 35.832 18.434 22.429 1.00 0.00 N ATOM 664 CZ ARG A 42 36.718 17.588 22.958 1.00 0.00 C ATOM 665 NH1 ARG A 42 36.719 17.390 24.292 1.00 0.00 N ATOM 666 NH2 ARG A 42 37.587 16.919 22.193 1.00 0.00 N ATOM 0 H ARG A 42 33.626 23.128 21.853 1.00 0.00 H new ATOM 0 HA ARG A 42 31.813 20.938 20.891 1.00 0.00 H new ATOM 0 HB2 ARG A 42 33.336 21.434 23.461 1.00 0.00 H new ATOM 0 HB3 ARG A 42 32.078 20.226 23.286 1.00 0.00 H new ATOM 0 HG2 ARG A 42 33.306 19.056 21.565 1.00 0.00 H new ATOM 0 HG3 ARG A 42 34.449 20.373 21.388 1.00 0.00 H new ATOM 0 HD2 ARG A 42 35.207 19.912 23.790 1.00 0.00 H new ATOM 0 HD3 ARG A 42 34.204 18.475 23.761 1.00 0.00 H new ATOM 0 HE ARG A 42 35.901 18.593 21.424 1.00 0.00 H new ATOM 0 HH11 ARG A 42 36.049 17.884 24.881 1.00 0.00 H new ATOM 0 HH12 ARG A 42 37.390 16.746 24.712 1.00 0.00 H new ATOM 0 HH21 ARG A 42 37.582 17.050 21.181 1.00 0.00 H new ATOM 0 HH22 ARG A 42 38.255 16.278 22.621 1.00 0.00 H new ATOM 680 N LEU A 43 29.845 21.941 22.392 1.00 0.00 N ATOM 681 CA LEU A 43 28.704 22.613 22.981 1.00 0.00 C ATOM 682 C LEU A 43 27.914 21.781 23.982 1.00 0.00 C ATOM 683 O LEU A 43 27.719 20.600 23.716 1.00 0.00 O ATOM 684 CB LEU A 43 27.898 23.541 22.083 1.00 0.00 C ATOM 685 CG LEU A 43 27.671 23.125 20.624 1.00 0.00 C ATOM 686 CD1 LEU A 43 26.394 23.726 20.040 1.00 0.00 C ATOM 687 CD2 LEU A 43 28.807 23.441 19.651 1.00 0.00 C ATOM 0 H LEU A 43 29.641 20.980 22.116 1.00 0.00 H new ATOM 0 HA LEU A 43 29.190 23.358 23.611 1.00 0.00 H new ATOM 0 HB2 LEU A 43 26.921 23.683 22.544 1.00 0.00 H new ATOM 0 HB3 LEU A 43 28.393 24.512 22.079 1.00 0.00 H new ATOM 0 HG LEU A 43 27.603 22.040 20.708 1.00 0.00 H new ATOM 0 HD11 LEU A 43 26.279 23.401 19.006 1.00 0.00 H new ATOM 0 HD12 LEU A 43 25.535 23.392 20.623 1.00 0.00 H new ATOM 0 HD13 LEU A 43 26.455 24.814 20.074 1.00 0.00 H new ATOM 0 HD21 LEU A 43 28.535 23.102 18.651 1.00 0.00 H new ATOM 0 HD22 LEU A 43 28.983 24.517 19.634 1.00 0.00 H new ATOM 0 HD23 LEU A 43 29.714 22.930 19.973 1.00 0.00 H new ATOM 699 N ILE A 44 27.541 22.360 25.125 1.00 0.00 N ATOM 700 CA ILE A 44 27.189 21.593 26.299 1.00 0.00 C ATOM 701 C ILE A 44 25.817 22.083 26.760 1.00 0.00 C ATOM 702 O ILE A 44 25.757 23.180 27.316 1.00 0.00 O ATOM 703 CB ILE A 44 28.276 21.549 27.375 1.00 0.00 C ATOM 704 CG1 ILE A 44 29.692 21.282 26.839 1.00 0.00 C ATOM 705 CG2 ILE A 44 27.774 20.654 28.514 1.00 0.00 C ATOM 706 CD1 ILE A 44 30.857 21.212 27.822 1.00 0.00 C ATOM 0 H ILE A 44 27.478 23.370 25.252 1.00 0.00 H new ATOM 0 HA ILE A 44 27.117 20.534 26.051 1.00 0.00 H new ATOM 0 HB ILE A 44 28.435 22.542 27.796 1.00 0.00 H new ATOM 0 HG12 ILE A 44 29.665 20.338 26.294 1.00 0.00 H new ATOM 0 HG13 ILE A 44 29.921 22.062 26.113 1.00 0.00 H new ATOM 0 HG21 ILE A 44 28.530 20.604 29.297 1.00 0.00 H new ATOM 0 HG22 ILE A 44 26.853 21.069 28.924 1.00 0.00 H new ATOM 0 HG23 ILE A 44 27.581 19.652 28.131 1.00 0.00 H new ATOM 0 HD11 ILE A 44 31.781 21.017 27.278 1.00 0.00 H new ATOM 0 HD12 ILE A 44 30.942 22.160 28.354 1.00 0.00 H new ATOM 0 HD13 ILE A 44 30.681 20.409 28.538 1.00 0.00 H new ATOM 718 N PHE A 45 24.760 21.298 26.600 1.00 0.00 N ATOM 719 CA PHE A 45 23.428 21.543 27.132 1.00 0.00 C ATOM 720 C PHE A 45 22.968 20.357 27.984 1.00 0.00 C ATOM 721 O PHE A 45 23.099 19.222 27.536 1.00 0.00 O ATOM 722 CB PHE A 45 22.484 21.911 25.991 1.00 0.00 C ATOM 723 CG PHE A 45 21.105 22.212 26.523 1.00 0.00 C ATOM 724 CD1 PHE A 45 20.803 23.437 27.126 1.00 0.00 C ATOM 725 CD2 PHE A 45 20.062 21.298 26.359 1.00 0.00 C ATOM 726 CE1 PHE A 45 19.515 23.705 27.604 1.00 0.00 C ATOM 727 CE2 PHE A 45 18.793 21.531 26.918 1.00 0.00 C ATOM 728 CZ PHE A 45 18.478 22.764 27.491 1.00 0.00 C ATOM 0 H PHE A 45 24.812 20.429 26.068 1.00 0.00 H new ATOM 0 HA PHE A 45 23.432 22.397 27.809 1.00 0.00 H new ATOM 0 HB2 PHE A 45 22.871 22.778 25.456 1.00 0.00 H new ATOM 0 HB3 PHE A 45 22.433 21.091 25.275 1.00 0.00 H new ATOM 0 HD1 PHE A 45 21.574 24.187 27.224 1.00 0.00 H new ATOM 0 HD2 PHE A 45 20.233 20.395 25.792 1.00 0.00 H new ATOM 0 HE1 PHE A 45 19.314 24.658 28.071 1.00 0.00 H new ATOM 0 HE2 PHE A 45 18.052 20.745 26.904 1.00 0.00 H new ATOM 0 HZ PHE A 45 17.478 22.986 27.833 1.00 0.00 H new ATOM 738 N ALA A 46 22.471 20.613 29.191 1.00 0.00 N ATOM 739 CA ALA A 46 21.879 19.721 30.175 1.00 0.00 C ATOM 740 C ALA A 46 22.745 18.474 30.364 1.00 0.00 C ATOM 741 O ALA A 46 22.237 17.352 30.362 1.00 0.00 O ATOM 742 CB ALA A 46 20.496 19.405 29.596 1.00 0.00 C ATOM 0 H ALA A 46 22.476 21.571 29.542 1.00 0.00 H new ATOM 0 HA ALA A 46 21.804 20.157 31.171 1.00 0.00 H new ATOM 0 HB1 ALA A 46 19.964 18.733 30.270 1.00 0.00 H new ATOM 0 HB2 ALA A 46 19.929 20.329 29.483 1.00 0.00 H new ATOM 0 HB3 ALA A 46 20.609 18.928 28.623 1.00 0.00 H new ATOM 748 N GLY A 47 24.034 18.703 30.591 1.00 0.00 N ATOM 749 CA GLY A 47 25.069 17.707 30.828 1.00 0.00 C ATOM 750 C GLY A 47 25.797 17.152 29.604 1.00 0.00 C ATOM 751 O GLY A 47 26.961 16.746 29.662 1.00 0.00 O ATOM 0 H GLY A 47 24.406 19.652 30.616 1.00 0.00 H new ATOM 0 HA2 GLY A 47 25.813 18.144 31.494 1.00 0.00 H new ATOM 0 HA3 GLY A 47 24.617 16.870 31.361 1.00 0.00 H new ATOM 755 N LYS A 48 25.058 17.031 28.508 1.00 0.00 N ATOM 756 CA LYS A 48 25.475 16.226 27.375 1.00 0.00 C ATOM 757 C LYS A 48 26.291 17.146 26.468 1.00 0.00 C ATOM 758 O LYS A 48 25.883 18.242 26.100 1.00 0.00 O ATOM 759 CB LYS A 48 24.216 15.783 26.616 1.00 0.00 C ATOM 760 CG LYS A 48 23.266 14.969 27.495 1.00 0.00 C ATOM 761 CD LYS A 48 21.991 14.664 26.709 1.00 0.00 C ATOM 762 CE LYS A 48 20.975 13.870 27.530 1.00 0.00 C ATOM 763 NZ LYS A 48 19.593 14.125 27.102 1.00 0.00 N ATOM 0 H LYS A 48 24.155 17.489 28.383 1.00 0.00 H new ATOM 0 HA LYS A 48 26.051 15.354 27.684 1.00 0.00 H new ATOM 0 HB2 LYS A 48 23.694 16.662 26.238 1.00 0.00 H new ATOM 0 HB3 LYS A 48 24.507 15.188 25.750 1.00 0.00 H new ATOM 0 HG2 LYS A 48 23.746 14.041 27.807 1.00 0.00 H new ATOM 0 HG3 LYS A 48 23.025 15.524 28.401 1.00 0.00 H new ATOM 0 HD2 LYS A 48 21.537 15.599 26.381 1.00 0.00 H new ATOM 0 HD3 LYS A 48 22.247 14.102 25.811 1.00 0.00 H new ATOM 0 HE2 LYS A 48 21.191 12.805 27.440 1.00 0.00 H new ATOM 0 HE3 LYS A 48 21.081 14.129 28.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 18.940 13.565 27.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 19.377 15.136 27.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 19.483 13.854 26.104 1.00 0.00 H new ATOM 777 N GLN A 49 27.455 16.656 26.049 1.00 0.00 N ATOM 778 CA GLN A 49 28.243 17.274 24.999 1.00 0.00 C ATOM 779 C GLN A 49 27.796 16.708 23.640 1.00 0.00 C ATOM 780 O GLN A 49 28.004 15.555 23.279 1.00 0.00 O ATOM 781 CB GLN A 49 29.688 16.809 25.104 1.00 0.00 C ATOM 782 CG GLN A 49 30.417 17.388 26.326 1.00 0.00 C ATOM 783 CD GLN A 49 31.899 17.036 26.404 1.00 0.00 C ATOM 784 OE1 GLN A 49 32.547 17.215 27.431 1.00 0.00 O ATOM 785 NE2 GLN A 49 32.467 16.472 25.339 1.00 0.00 N ATOM 0 H GLN A 49 27.877 15.811 26.435 1.00 0.00 H new ATOM 0 HA GLN A 49 28.129 18.354 25.088 1.00 0.00 H new ATOM 0 HB2 GLN A 49 29.711 15.720 25.156 1.00 0.00 H new ATOM 0 HB3 GLN A 49 30.223 17.096 24.199 1.00 0.00 H new ATOM 0 HG2 GLN A 49 30.314 18.473 26.314 1.00 0.00 H new ATOM 0 HG3 GLN A 49 29.924 17.031 27.230 1.00 0.00 H new ATOM 0 HE21 GLN A 49 31.923 16.326 24.488 1.00 0.00 H new ATOM 0 HE22 GLN A 49 33.446 16.186 25.374 1.00 0.00 H new ATOM 794 N LEU A 50 27.050 17.594 22.992 1.00 0.00 N ATOM 795 CA LEU A 50 26.230 17.340 21.827 1.00 0.00 C ATOM 796 C LEU A 50 27.007 16.733 20.663 1.00 0.00 C ATOM 797 O LEU A 50 28.178 17.080 20.469 1.00 0.00 O ATOM 798 CB LEU A 50 25.478 18.576 21.351 1.00 0.00 C ATOM 799 CG LEU A 50 24.755 19.386 22.431 1.00 0.00 C ATOM 800 CD1 LEU A 50 24.555 20.832 21.953 1.00 0.00 C ATOM 801 CD2 LEU A 50 23.331 18.927 22.755 1.00 0.00 C ATOM 0 H LEU A 50 27.003 18.569 23.289 1.00 0.00 H new ATOM 0 HA LEU A 50 25.502 16.603 22.165 1.00 0.00 H new ATOM 0 HB2 LEU A 50 26.185 19.234 20.846 1.00 0.00 H new ATOM 0 HB3 LEU A 50 24.744 18.265 20.607 1.00 0.00 H new ATOM 0 HG LEU A 50 25.394 19.264 23.305 1.00 0.00 H new ATOM 0 HD11 LEU A 50 24.040 21.403 22.726 1.00 0.00 H new ATOM 0 HD12 LEU A 50 25.525 21.286 21.752 1.00 0.00 H new ATOM 0 HD13 LEU A 50 23.957 20.835 21.041 1.00 0.00 H new ATOM 0 HD21 LEU A 50 22.910 19.566 23.531 1.00 0.00 H new ATOM 0 HD22 LEU A 50 22.715 18.992 21.858 1.00 0.00 H new ATOM 0 HD23 LEU A 50 23.352 17.896 23.107 1.00 0.00 H new ATOM 813 N GLU A 51 26.433 15.753 19.975 1.00 0.00 N ATOM 814 CA GLU A 51 27.173 15.018 18.971 1.00 0.00 C ATOM 815 C GLU A 51 27.004 15.773 17.656 1.00 0.00 C ATOM 816 O GLU A 51 25.964 16.401 17.519 1.00 0.00 O ATOM 817 CB GLU A 51 26.565 13.618 18.839 1.00 0.00 C ATOM 818 CG GLU A 51 27.102 12.736 17.713 1.00 0.00 C ATOM 819 CD GLU A 51 26.358 11.403 17.616 1.00 0.00 C ATOM 820 OE1 GLU A 51 26.701 10.501 18.407 1.00 0.00 O ATOM 821 OE2 GLU A 51 25.495 11.238 16.730 1.00 0.00 O ATOM 0 H GLU A 51 25.465 15.455 20.096 1.00 0.00 H new ATOM 0 HA GLU A 51 28.227 14.926 19.234 1.00 0.00 H new ATOM 0 HB2 GLU A 51 26.714 13.093 19.782 1.00 0.00 H new ATOM 0 HB3 GLU A 51 25.489 13.727 18.701 1.00 0.00 H new ATOM 0 HG2 GLU A 51 27.016 13.268 16.765 1.00 0.00 H new ATOM 0 HG3 GLU A 51 28.163 12.547 17.877 1.00 0.00 H new ATOM 828 N ASP A 52 27.964 15.680 16.725 1.00 0.00 N ATOM 829 CA ASP A 52 27.981 16.449 15.499 1.00 0.00 C ATOM 830 C ASP A 52 26.890 16.083 14.496 1.00 0.00 C ATOM 831 O ASP A 52 26.695 14.878 14.371 1.00 0.00 O ATOM 832 CB ASP A 52 29.355 16.313 14.849 1.00 0.00 C ATOM 833 CG ASP A 52 30.406 17.393 15.093 1.00 0.00 C ATOM 834 OD1 ASP A 52 30.175 18.594 14.831 1.00 0.00 O ATOM 835 OD2 ASP A 52 31.376 17.119 15.827 1.00 0.00 O ATOM 0 H ASP A 52 28.762 15.051 16.817 1.00 0.00 H new ATOM 0 HA ASP A 52 27.772 17.481 15.782 1.00 0.00 H new ATOM 0 HB2 ASP A 52 29.779 15.363 15.175 1.00 0.00 H new ATOM 0 HB3 ASP A 52 29.203 16.241 13.772 1.00 0.00 H new ATOM 840 N GLY A 53 26.189 17.036 13.882 1.00 0.00 N ATOM 841 CA GLY A 53 25.256 16.764 12.815 1.00 0.00 C ATOM 842 C GLY A 53 23.890 16.184 13.203 1.00 0.00 C ATOM 843 O GLY A 53 23.181 15.704 12.325 1.00 0.00 O ATOM 0 H GLY A 53 26.261 18.025 14.122 1.00 0.00 H new ATOM 0 HA2 GLY A 53 25.085 17.693 12.272 1.00 0.00 H new ATOM 0 HA3 GLY A 53 25.731 16.071 12.120 1.00 0.00 H new ATOM 847 N ARG A 54 23.513 16.285 14.472 1.00 0.00 N ATOM 848 CA ARG A 54 22.256 15.836 15.047 1.00 0.00 C ATOM 849 C ARG A 54 21.341 17.053 15.163 1.00 0.00 C ATOM 850 O ARG A 54 21.688 18.205 14.901 1.00 0.00 O ATOM 851 CB ARG A 54 22.524 15.081 16.347 1.00 0.00 C ATOM 852 CG ARG A 54 23.454 13.873 16.159 1.00 0.00 C ATOM 853 CD ARG A 54 22.833 12.609 15.550 1.00 0.00 C ATOM 854 NE ARG A 54 21.773 12.064 16.400 1.00 0.00 N ATOM 855 CZ ARG A 54 21.966 11.153 17.351 1.00 0.00 C ATOM 856 NH1 ARG A 54 23.099 10.514 17.674 1.00 0.00 N ATOM 857 NH2 ARG A 54 20.894 10.729 18.045 1.00 0.00 N ATOM 0 H ARG A 54 24.120 16.712 15.172 1.00 0.00 H new ATOM 0 HA ARG A 54 21.735 15.114 14.419 1.00 0.00 H new ATOM 0 HB2 ARG A 54 22.966 15.764 17.073 1.00 0.00 H new ATOM 0 HB3 ARG A 54 21.577 14.741 16.765 1.00 0.00 H new ATOM 0 HG2 ARG A 54 24.287 14.181 15.527 1.00 0.00 H new ATOM 0 HG3 ARG A 54 23.872 13.612 17.131 1.00 0.00 H new ATOM 0 HD2 ARG A 54 22.427 12.841 14.565 1.00 0.00 H new ATOM 0 HD3 ARG A 54 23.608 11.856 15.406 1.00 0.00 H new ATOM 0 HE ARG A 54 20.823 12.405 16.254 1.00 0.00 H new ATOM 0 HH11 ARG A 54 23.958 10.709 17.160 1.00 0.00 H new ATOM 0 HH12 ARG A 54 23.102 9.833 18.434 1.00 0.00 H new ATOM 0 HH21 ARG A 54 19.969 11.105 17.835 1.00 0.00 H new ATOM 0 HH22 ARG A 54 21.006 10.032 18.781 1.00 0.00 H new ATOM 871 N THR A 55 20.111 16.842 15.613 1.00 0.00 N ATOM 872 CA THR A 55 19.018 17.796 15.673 1.00 0.00 C ATOM 873 C THR A 55 19.042 18.231 17.143 1.00 0.00 C ATOM 874 O THR A 55 19.023 17.407 18.060 1.00 0.00 O ATOM 875 CB THR A 55 17.672 17.162 15.320 1.00 0.00 C ATOM 876 OG1 THR A 55 17.548 16.062 16.189 1.00 0.00 O ATOM 877 CG2 THR A 55 17.655 16.520 13.941 1.00 0.00 C ATOM 0 H THR A 55 19.833 15.929 15.972 1.00 0.00 H new ATOM 0 HA THR A 55 19.134 18.613 14.961 1.00 0.00 H new ATOM 0 HB THR A 55 16.906 17.936 15.377 1.00 0.00 H new ATOM 0 HG1 THR A 55 18.121 16.198 16.973 1.00 0.00 H new ATOM 0 HG21 THR A 55 16.672 16.089 13.752 1.00 0.00 H new ATOM 0 HG22 THR A 55 17.871 17.275 13.185 1.00 0.00 H new ATOM 0 HG23 THR A 55 18.410 15.735 13.896 1.00 0.00 H new ATOM 885 N LEU A 56 18.797 19.521 17.297 1.00 0.00 N ATOM 886 CA LEU A 56 18.735 20.269 18.544 1.00 0.00 C ATOM 887 C LEU A 56 17.563 19.854 19.434 1.00 0.00 C ATOM 888 O LEU A 56 17.671 19.914 20.648 1.00 0.00 O ATOM 889 CB LEU A 56 18.590 21.746 18.182 1.00 0.00 C ATOM 890 CG LEU A 56 19.531 22.216 17.072 1.00 0.00 C ATOM 891 CD1 LEU A 56 19.247 23.691 16.747 1.00 0.00 C ATOM 892 CD2 LEU A 56 21.038 22.107 17.315 1.00 0.00 C ATOM 0 H LEU A 56 18.622 20.121 16.491 1.00 0.00 H new ATOM 0 HA LEU A 56 19.643 20.068 19.112 1.00 0.00 H new ATOM 0 HB2 LEU A 56 17.561 21.934 17.874 1.00 0.00 H new ATOM 0 HB3 LEU A 56 18.770 22.346 19.074 1.00 0.00 H new ATOM 0 HG LEU A 56 19.309 21.519 16.264 1.00 0.00 H new ATOM 0 HD11 LEU A 56 19.918 24.025 15.956 1.00 0.00 H new ATOM 0 HD12 LEU A 56 18.214 23.798 16.416 1.00 0.00 H new ATOM 0 HD13 LEU A 56 19.407 24.297 17.639 1.00 0.00 H new ATOM 0 HD21 LEU A 56 21.575 22.477 16.442 1.00 0.00 H new ATOM 0 HD22 LEU A 56 21.310 22.701 18.187 1.00 0.00 H new ATOM 0 HD23 LEU A 56 21.304 21.064 17.489 1.00 0.00 H new ATOM 904 N SER A 57 16.446 19.415 18.858 1.00 0.00 N ATOM 905 CA SER A 57 15.217 19.280 19.625 1.00 0.00 C ATOM 906 C SER A 57 15.088 17.931 20.327 1.00 0.00 C ATOM 907 O SER A 57 14.240 17.883 21.209 1.00 0.00 O ATOM 908 CB SER A 57 14.086 19.606 18.647 1.00 0.00 C ATOM 909 OG SER A 57 14.126 21.016 18.569 1.00 0.00 O ATOM 0 H SER A 57 16.369 19.151 17.876 1.00 0.00 H new ATOM 0 HA SER A 57 15.192 19.970 20.468 1.00 0.00 H new ATOM 0 HB2 SER A 57 14.249 19.144 17.673 1.00 0.00 H new ATOM 0 HB3 SER A 57 13.123 19.250 19.012 1.00 0.00 H new ATOM 0 HG SER A 57 13.429 21.330 17.955 1.00 0.00 H new ATOM 915 N ASP A 58 15.784 16.876 19.873 1.00 0.00 N ATOM 916 CA ASP A 58 15.828 15.594 20.552 1.00 0.00 C ATOM 917 C ASP A 58 16.722 15.568 21.787 1.00 0.00 C ATOM 918 O ASP A 58 16.548 14.778 22.712 1.00 0.00 O ATOM 919 CB ASP A 58 16.357 14.566 19.555 1.00 0.00 C ATOM 920 CG ASP A 58 16.019 13.153 20.020 1.00 0.00 C ATOM 921 OD1 ASP A 58 14.805 12.855 20.094 1.00 0.00 O ATOM 922 OD2 ASP A 58 16.962 12.447 20.417 1.00 0.00 O ATOM 0 H ASP A 58 16.334 16.901 19.014 1.00 0.00 H new ATOM 0 HA ASP A 58 14.818 15.378 20.900 1.00 0.00 H new ATOM 0 HB2 ASP A 58 15.922 14.746 18.572 1.00 0.00 H new ATOM 0 HB3 ASP A 58 17.437 14.673 19.451 1.00 0.00 H new ATOM 927 N TYR A 59 17.567 16.588 21.866 1.00 0.00 N ATOM 928 CA TYR A 59 18.363 16.970 23.015 1.00 0.00 C ATOM 929 C TYR A 59 17.601 18.005 23.834 1.00 0.00 C ATOM 930 O TYR A 59 18.108 18.470 24.854 1.00 0.00 O ATOM 931 CB TYR A 59 19.666 17.630 22.546 1.00 0.00 C ATOM 932 CG TYR A 59 20.665 16.624 22.023 1.00 0.00 C ATOM 933 CD1 TYR A 59 21.341 15.793 22.923 1.00 0.00 C ATOM 934 CD2 TYR A 59 21.150 16.724 20.717 1.00 0.00 C ATOM 935 CE1 TYR A 59 22.359 14.934 22.472 1.00 0.00 C ATOM 936 CE2 TYR A 59 22.270 15.979 20.314 1.00 0.00 C ATOM 937 CZ TYR A 59 22.882 15.059 21.182 1.00 0.00 C ATOM 938 OH TYR A 59 23.997 14.385 20.816 1.00 0.00 O ATOM 0 H TYR A 59 17.721 17.210 21.072 1.00 0.00 H new ATOM 0 HA TYR A 59 18.574 16.079 23.606 1.00 0.00 H new ATOM 0 HB2 TYR A 59 19.442 18.356 21.764 1.00 0.00 H new ATOM 0 HB3 TYR A 59 20.110 18.182 23.375 1.00 0.00 H new ATOM 0 HD1 TYR A 59 21.079 15.811 23.971 1.00 0.00 H new ATOM 0 HD2 TYR A 59 20.660 17.379 20.012 1.00 0.00 H new ATOM 0 HE1 TYR A 59 22.741 14.168 23.131 1.00 0.00 H new ATOM 0 HE2 TYR A 59 22.668 16.116 19.319 1.00 0.00 H new ATOM 0 HH TYR A 59 23.789 13.793 20.064 1.00 0.00 H new ATOM 948 N ASN A 60 16.357 18.372 23.562 1.00 0.00 N ATOM 949 CA ASN A 60 15.371 19.166 24.256 1.00 0.00 C ATOM 950 C ASN A 60 15.534 20.694 24.256 1.00 0.00 C ATOM 951 O ASN A 60 15.196 21.329 25.243 1.00 0.00 O ATOM 952 CB ASN A 60 15.210 18.510 25.625 1.00 0.00 C ATOM 953 CG ASN A 60 13.791 18.626 26.168 1.00 0.00 C ATOM 954 OD1 ASN A 60 13.482 19.206 27.207 1.00 0.00 O ATOM 955 ND2 ASN A 60 12.826 17.835 25.683 1.00 0.00 N ATOM 0 H ASN A 60 15.953 18.053 22.681 1.00 0.00 H new ATOM 0 HA ASN A 60 14.440 19.146 23.689 1.00 0.00 H new ATOM 0 HB2 ASN A 60 15.483 17.457 25.553 1.00 0.00 H new ATOM 0 HB3 ASN A 60 15.903 18.971 26.329 1.00 0.00 H new ATOM 0 HD21 ASN A 60 11.935 17.759 26.173 1.00 0.00 H new ATOM 0 HD22 ASN A 60 12.982 17.309 24.823 1.00 0.00 H new ATOM 962 N ILE A 61 16.272 21.270 23.301 1.00 0.00 N ATOM 963 CA ILE A 61 16.731 22.635 23.232 1.00 0.00 C ATOM 964 C ILE A 61 15.581 23.482 22.669 1.00 0.00 C ATOM 965 O ILE A 61 15.299 23.275 21.492 1.00 0.00 O ATOM 966 CB ILE A 61 18.035 22.808 22.459 1.00 0.00 C ATOM 967 CG1 ILE A 61 19.019 21.714 22.854 1.00 0.00 C ATOM 968 CG2 ILE A 61 18.629 24.201 22.682 1.00 0.00 C ATOM 969 CD1 ILE A 61 20.256 21.681 21.945 1.00 0.00 C ATOM 0 H ILE A 61 16.583 20.733 22.491 1.00 0.00 H new ATOM 0 HA ILE A 61 16.989 22.977 24.234 1.00 0.00 H new ATOM 0 HB ILE A 61 17.825 22.716 21.393 1.00 0.00 H new ATOM 0 HG12 ILE A 61 19.334 21.868 23.886 1.00 0.00 H new ATOM 0 HG13 ILE A 61 18.517 20.747 22.815 1.00 0.00 H new ATOM 0 HG21 ILE A 61 19.558 24.295 22.119 1.00 0.00 H new ATOM 0 HG22 ILE A 61 17.921 24.957 22.343 1.00 0.00 H new ATOM 0 HG23 ILE A 61 18.832 24.344 23.743 1.00 0.00 H new ATOM 0 HD11 ILE A 61 20.925 20.884 22.270 1.00 0.00 H new ATOM 0 HD12 ILE A 61 19.947 21.499 20.916 1.00 0.00 H new ATOM 0 HD13 ILE A 61 20.776 22.637 22.003 1.00 0.00 H new ATOM 981 N GLN A 62 14.889 24.234 23.509 1.00 0.00 N ATOM 982 CA GLN A 62 13.807 25.150 23.179 1.00 0.00 C ATOM 983 C GLN A 62 14.380 26.536 22.882 1.00 0.00 C ATOM 984 O GLN A 62 15.563 26.744 23.136 1.00 0.00 O ATOM 985 CB GLN A 62 12.777 25.254 24.304 1.00 0.00 C ATOM 986 CG GLN A 62 12.046 23.954 24.635 1.00 0.00 C ATOM 987 CD GLN A 62 10.923 23.626 23.661 1.00 0.00 C ATOM 988 OE1 GLN A 62 10.965 23.875 22.462 1.00 0.00 O ATOM 989 NE2 GLN A 62 9.835 23.051 24.164 1.00 0.00 N ATOM 0 H GLN A 62 15.082 24.220 24.511 1.00 0.00 H new ATOM 0 HA GLN A 62 13.298 24.755 22.300 1.00 0.00 H new ATOM 0 HB2 GLN A 62 13.279 25.610 25.204 1.00 0.00 H new ATOM 0 HB3 GLN A 62 12.039 26.008 24.031 1.00 0.00 H new ATOM 0 HG2 GLN A 62 12.764 23.134 24.640 1.00 0.00 H new ATOM 0 HG3 GLN A 62 11.635 24.024 25.642 1.00 0.00 H new ATOM 0 HE21 GLN A 62 9.785 22.838 25.160 1.00 0.00 H new ATOM 0 HE22 GLN A 62 9.050 22.823 23.554 1.00 0.00 H new ATOM 998 N LYS A 63 13.578 27.463 22.375 1.00 0.00 N ATOM 999 CA LYS A 63 13.901 28.871 22.472 1.00 0.00 C ATOM 1000 C LYS A 63 13.873 29.410 23.909 1.00 0.00 C ATOM 1001 O LYS A 63 13.234 28.767 24.731 1.00 0.00 O ATOM 1002 CB LYS A 63 12.791 29.602 21.702 1.00 0.00 C ATOM 1003 CG LYS A 63 11.389 29.692 22.306 1.00 0.00 C ATOM 1004 CD LYS A 63 10.372 30.272 21.329 1.00 0.00 C ATOM 1005 CE LYS A 63 9.083 30.613 22.074 1.00 0.00 C ATOM 1006 NZ LYS A 63 8.057 30.877 21.053 1.00 0.00 N ATOM 0 H LYS A 63 12.702 27.261 21.894 1.00 0.00 H new ATOM 0 HA LYS A 63 14.909 29.023 22.087 1.00 0.00 H new ATOM 0 HB2 LYS A 63 13.135 30.620 21.522 1.00 0.00 H new ATOM 0 HB3 LYS A 63 12.697 29.120 20.729 1.00 0.00 H new ATOM 0 HG2 LYS A 63 11.065 28.698 22.616 1.00 0.00 H new ATOM 0 HG3 LYS A 63 11.422 30.311 23.203 1.00 0.00 H new ATOM 0 HD2 LYS A 63 10.777 31.166 20.855 1.00 0.00 H new ATOM 0 HD3 LYS A 63 10.166 29.555 20.534 1.00 0.00 H new ATOM 0 HE2 LYS A 63 8.781 29.789 22.721 1.00 0.00 H new ATOM 0 HE3 LYS A 63 9.225 31.484 22.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 7.158 31.115 21.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 8.359 31.673 20.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 7.928 30.030 20.463 1.00 0.00 H new ATOM 1020 N GLU A 64 14.564 30.530 24.101 1.00 0.00 N ATOM 1021 CA GLU A 64 14.790 31.365 25.268 1.00 0.00 C ATOM 1022 C GLU A 64 15.653 30.641 26.302 1.00 0.00 C ATOM 1023 O GLU A 64 15.499 31.052 27.452 1.00 0.00 O ATOM 1024 CB GLU A 64 13.510 31.979 25.807 1.00 0.00 C ATOM 1025 CG GLU A 64 13.664 33.479 26.089 1.00 0.00 C ATOM 1026 CD GLU A 64 12.410 34.012 26.762 1.00 0.00 C ATOM 1027 OE1 GLU A 64 11.439 34.306 26.027 1.00 0.00 O ATOM 1028 OE2 GLU A 64 12.460 34.257 27.989 1.00 0.00 O ATOM 0 H GLU A 64 15.057 30.933 23.304 1.00 0.00 H new ATOM 0 HA GLU A 64 15.375 32.232 24.961 1.00 0.00 H new ATOM 0 HB2 GLU A 64 12.705 31.826 25.089 1.00 0.00 H new ATOM 0 HB3 GLU A 64 13.220 31.466 26.724 1.00 0.00 H new ATOM 0 HG2 GLU A 64 14.530 33.650 26.728 1.00 0.00 H new ATOM 0 HG3 GLU A 64 13.843 34.016 25.158 1.00 0.00 H new ATOM 1035 N SER A 65 16.370 29.600 25.877 1.00 0.00 N ATOM 1036 CA SER A 65 17.185 28.750 26.720 1.00 0.00 C ATOM 1037 C SER A 65 18.651 29.179 26.726 1.00 0.00 C ATOM 1038 O SER A 65 18.920 30.173 26.056 1.00 0.00 O ATOM 1039 CB SER A 65 17.049 27.321 26.192 1.00 0.00 C ATOM 1040 OG SER A 65 17.693 26.286 26.904 1.00 0.00 O ATOM 0 H SER A 65 16.394 29.322 24.896 1.00 0.00 H new ATOM 0 HA SER A 65 16.841 28.824 27.752 1.00 0.00 H new ATOM 0 HB2 SER A 65 15.986 27.082 26.145 1.00 0.00 H new ATOM 0 HB3 SER A 65 17.425 27.306 25.169 1.00 0.00 H new ATOM 0 HG SER A 65 17.465 25.422 26.502 1.00 0.00 H new ATOM 1046 N THR A 66 19.503 28.501 27.487 1.00 0.00 N ATOM 1047 CA THR A 66 20.882 28.862 27.743 1.00 0.00 C ATOM 1048 C THR A 66 21.810 27.663 27.545 1.00 0.00 C ATOM 1049 O THR A 66 21.445 26.555 27.936 1.00 0.00 O ATOM 1050 CB THR A 66 21.052 29.490 29.124 1.00 0.00 C ATOM 1051 OG1 THR A 66 20.817 28.567 30.149 1.00 0.00 O ATOM 1052 CG2 THR A 66 20.170 30.700 29.448 1.00 0.00 C ATOM 0 H THR A 66 19.231 27.641 27.964 1.00 0.00 H new ATOM 0 HA THR A 66 21.167 29.620 27.014 1.00 0.00 H new ATOM 0 HB THR A 66 22.086 29.830 29.076 1.00 0.00 H new ATOM 0 HG1 THR A 66 20.937 29.005 31.017 1.00 0.00 H new ATOM 0 HG21 THR A 66 20.389 31.050 30.457 1.00 0.00 H new ATOM 0 HG22 THR A 66 20.372 31.499 28.735 1.00 0.00 H new ATOM 0 HG23 THR A 66 19.120 30.413 29.383 1.00 0.00 H new ATOM 1060 N LEU A 67 22.907 27.927 26.828 1.00 0.00 N ATOM 1061 CA LEU A 67 23.788 26.863 26.405 1.00 0.00 C ATOM 1062 C LEU A 67 25.193 27.323 26.784 1.00 0.00 C ATOM 1063 O LEU A 67 25.491 28.492 26.554 1.00 0.00 O ATOM 1064 CB LEU A 67 23.718 26.642 24.896 1.00 0.00 C ATOM 1065 CG LEU A 67 22.574 25.743 24.426 1.00 0.00 C ATOM 1066 CD1 LEU A 67 21.318 26.587 24.250 1.00 0.00 C ATOM 1067 CD2 LEU A 67 22.887 25.058 23.102 1.00 0.00 C ATOM 0 H LEU A 67 23.194 28.862 26.537 1.00 0.00 H new ATOM 0 HA LEU A 67 23.509 25.921 26.877 1.00 0.00 H new ATOM 0 HB2 LEU A 67 23.623 27.611 24.406 1.00 0.00 H new ATOM 0 HB3 LEU A 67 24.661 26.208 24.564 1.00 0.00 H new ATOM 0 HG LEU A 67 22.430 24.971 25.182 1.00 0.00 H new ATOM 0 HD11 LEU A 67 20.497 25.953 23.915 1.00 0.00 H new ATOM 0 HD12 LEU A 67 21.054 27.049 25.201 1.00 0.00 H new ATOM 0 HD13 LEU A 67 21.503 27.364 23.508 1.00 0.00 H new ATOM 0 HD21 LEU A 67 22.045 24.430 22.809 1.00 0.00 H new ATOM 0 HD22 LEU A 67 23.062 25.812 22.335 1.00 0.00 H new ATOM 0 HD23 LEU A 67 23.778 24.441 23.214 1.00 0.00 H new ATOM 1079 N HIS A 68 26.176 26.476 27.086 1.00 0.00 N ATOM 1080 CA HIS A 68 27.574 26.806 27.292 1.00 0.00 C ATOM 1081 C HIS A 68 28.431 26.308 26.127 1.00 0.00 C ATOM 1082 O HIS A 68 28.370 25.102 25.885 1.00 0.00 O ATOM 1083 CB HIS A 68 28.064 26.278 28.637 1.00 0.00 C ATOM 1084 CG HIS A 68 29.440 26.726 29.018 1.00 0.00 C ATOM 1085 ND1 HIS A 68 29.901 28.037 28.892 1.00 0.00 N ATOM 1086 CD2 HIS A 68 30.432 25.920 29.528 1.00 0.00 C ATOM 1087 CE1 HIS A 68 31.137 27.961 29.379 1.00 0.00 C ATOM 1088 NE2 HIS A 68 31.555 26.709 29.634 1.00 0.00 N ATOM 0 H HIS A 68 25.999 25.478 27.199 1.00 0.00 H new ATOM 0 HA HIS A 68 27.673 27.891 27.319 1.00 0.00 H new ATOM 0 HB2 HIS A 68 27.366 26.593 29.412 1.00 0.00 H new ATOM 0 HB3 HIS A 68 28.044 25.188 28.614 1.00 0.00 H new ATOM 0 HD2 HIS A 68 30.346 24.876 29.792 1.00 0.00 H new ATOM 0 HE1 HIS A 68 31.752 28.831 29.554 1.00 0.00 H new ATOM 0 HE2 HIS A 68 32.503 26.408 29.858 1.00 0.00 H new ATOM 1096 N LEU A 69 29.145 27.144 25.381 1.00 0.00 N ATOM 1097 CA LEU A 69 30.074 26.711 24.360 1.00 0.00 C ATOM 1098 C LEU A 69 31.363 26.371 25.099 1.00 0.00 C ATOM 1099 O LEU A 69 31.841 27.242 25.818 1.00 0.00 O ATOM 1100 CB LEU A 69 30.352 27.799 23.333 1.00 0.00 C ATOM 1101 CG LEU A 69 31.185 27.487 22.090 1.00 0.00 C ATOM 1102 CD1 LEU A 69 30.450 26.538 21.149 1.00 0.00 C ATOM 1103 CD2 LEU A 69 31.529 28.744 21.291 1.00 0.00 C ATOM 0 H LEU A 69 29.089 28.158 25.476 1.00 0.00 H new ATOM 0 HA LEU A 69 29.661 25.866 23.809 1.00 0.00 H new ATOM 0 HB2 LEU A 69 29.388 28.174 22.990 1.00 0.00 H new ATOM 0 HB3 LEU A 69 30.845 28.619 23.856 1.00 0.00 H new ATOM 0 HG LEU A 69 32.100 27.026 22.462 1.00 0.00 H new ATOM 0 HD11 LEU A 69 31.071 26.338 20.276 1.00 0.00 H new ATOM 0 HD12 LEU A 69 30.240 25.602 21.667 1.00 0.00 H new ATOM 0 HD13 LEU A 69 29.513 26.995 20.830 1.00 0.00 H new ATOM 0 HD21 LEU A 69 32.121 28.470 20.418 1.00 0.00 H new ATOM 0 HD22 LEU A 69 30.610 29.232 20.967 1.00 0.00 H new ATOM 0 HD23 LEU A 69 32.102 29.428 21.917 1.00 0.00 H new ATOM 1115 N VAL A 70 32.090 25.271 24.907 1.00 0.00 N ATOM 1116 CA VAL A 70 33.463 24.983 25.288 1.00 0.00 C ATOM 1117 C VAL A 70 34.303 24.971 24.008 1.00 0.00 C ATOM 1118 O VAL A 70 33.807 24.487 22.989 1.00 0.00 O ATOM 1119 CB VAL A 70 33.425 23.765 26.218 1.00 0.00 C ATOM 1120 CG1 VAL A 70 34.813 23.204 26.552 1.00 0.00 C ATOM 1121 CG2 VAL A 70 32.756 24.100 27.551 1.00 0.00 C ATOM 0 H VAL A 70 31.679 24.472 24.425 1.00 0.00 H new ATOM 0 HA VAL A 70 33.981 25.727 25.893 1.00 0.00 H new ATOM 0 HB VAL A 70 32.858 23.019 25.662 1.00 0.00 H new ATOM 0 HG11 VAL A 70 34.708 22.344 27.214 1.00 0.00 H new ATOM 0 HG12 VAL A 70 35.312 22.896 25.633 1.00 0.00 H new ATOM 0 HG13 VAL A 70 35.407 23.973 27.047 1.00 0.00 H new ATOM 0 HG21 VAL A 70 32.746 23.214 28.186 1.00 0.00 H new ATOM 0 HG22 VAL A 70 33.312 24.896 28.047 1.00 0.00 H new ATOM 0 HG23 VAL A 70 31.733 24.429 27.372 1.00 0.00 H new ATOM 1131 N LEU A 71 35.537 25.473 23.953 1.00 0.00 N ATOM 1132 CA LEU A 71 36.537 25.319 22.923 1.00 0.00 C ATOM 1133 C LEU A 71 37.183 23.976 23.300 1.00 0.00 C ATOM 1134 O LEU A 71 37.273 23.711 24.493 1.00 0.00 O ATOM 1135 CB LEU A 71 37.688 26.323 23.026 1.00 0.00 C ATOM 1136 CG LEU A 71 37.377 27.612 22.262 1.00 0.00 C ATOM 1137 CD1 LEU A 71 35.997 28.244 22.344 1.00 0.00 C ATOM 1138 CD2 LEU A 71 38.457 28.614 22.690 1.00 0.00 C ATOM 0 H LEU A 71 35.886 26.057 24.713 1.00 0.00 H new ATOM 0 HA LEU A 71 36.078 25.425 21.940 1.00 0.00 H new ATOM 0 HB2 LEU A 71 37.876 26.556 24.074 1.00 0.00 H new ATOM 0 HB3 LEU A 71 38.600 25.875 22.630 1.00 0.00 H new ATOM 0 HG LEU A 71 37.378 27.326 21.210 1.00 0.00 H new ATOM 0 HD11 LEU A 71 35.974 29.148 21.736 1.00 0.00 H new ATOM 0 HD12 LEU A 71 35.252 27.539 21.975 1.00 0.00 H new ATOM 0 HD13 LEU A 71 35.774 28.498 23.380 1.00 0.00 H new ATOM 0 HD21 LEU A 71 38.295 29.563 22.179 1.00 0.00 H new ATOM 0 HD22 LEU A 71 38.404 28.768 23.768 1.00 0.00 H new ATOM 0 HD23 LEU A 71 39.440 28.224 22.427 1.00 0.00 H new ATOM 1150 N ARG A 72 37.698 23.142 22.394 1.00 0.00 N ATOM 1151 CA ARG A 72 38.478 21.946 22.576 1.00 0.00 C ATOM 1152 C ARG A 72 39.789 22.103 23.357 1.00 0.00 C ATOM 1153 O ARG A 72 40.414 21.096 23.637 1.00 0.00 O ATOM 1154 CB ARG A 72 38.526 21.114 21.294 1.00 0.00 C ATOM 1155 CG ARG A 72 39.152 19.716 21.404 1.00 0.00 C ATOM 1156 CD ARG A 72 40.512 19.517 20.738 1.00 0.00 C ATOM 1157 NE ARG A 72 40.688 18.263 20.013 1.00 0.00 N ATOM 1158 CZ ARG A 72 41.716 17.427 20.242 1.00 0.00 C ATOM 1159 NH1 ARG A 72 42.735 17.696 21.064 1.00 0.00 N ATOM 1160 NH2 ARG A 72 41.813 16.277 19.546 1.00 0.00 N ATOM 0 H ARG A 72 37.552 23.324 21.401 1.00 0.00 H new ATOM 0 HA ARG A 72 37.935 21.332 23.295 1.00 0.00 H new ATOM 0 HB2 ARG A 72 37.508 21.003 20.922 1.00 0.00 H new ATOM 0 HB3 ARG A 72 39.080 21.677 20.543 1.00 0.00 H new ATOM 0 HG2 ARG A 72 39.252 19.471 22.461 1.00 0.00 H new ATOM 0 HG3 ARG A 72 38.455 18.997 20.975 1.00 0.00 H new ATOM 0 HD2 ARG A 72 40.680 20.342 20.045 1.00 0.00 H new ATOM 0 HD3 ARG A 72 41.284 19.583 21.505 1.00 0.00 H new ATOM 0 HE ARG A 72 40.002 18.010 19.302 1.00 0.00 H new ATOM 0 HH11 ARG A 72 42.765 18.584 21.565 1.00 0.00 H new ATOM 0 HH12 ARG A 72 43.482 17.013 21.190 1.00 0.00 H new ATOM 0 HH21 ARG A 72 41.108 16.043 18.847 1.00 0.00 H new ATOM 0 HH22 ARG A 72 42.592 15.641 19.718 1.00 0.00 H new ATOM 1174 N LEU A 73 40.194 23.329 23.670 1.00 0.00 N ATOM 1175 CA LEU A 73 41.373 23.683 24.448 1.00 0.00 C ATOM 1176 C LEU A 73 41.027 23.717 25.930 1.00 0.00 C ATOM 1177 O LEU A 73 39.854 23.870 26.277 1.00 0.00 O ATOM 1178 CB LEU A 73 41.911 25.050 24.034 1.00 0.00 C ATOM 1179 CG LEU A 73 42.536 25.191 22.637 1.00 0.00 C ATOM 1180 CD1 LEU A 73 43.496 24.067 22.254 1.00 0.00 C ATOM 1181 CD2 LEU A 73 41.528 25.412 21.508 1.00 0.00 C ATOM 0 H LEU A 73 39.674 24.153 23.368 1.00 0.00 H new ATOM 0 HA LEU A 73 42.138 22.929 24.260 1.00 0.00 H new ATOM 0 HB2 LEU A 73 41.092 25.766 24.106 1.00 0.00 H new ATOM 0 HB3 LEU A 73 42.661 25.348 24.766 1.00 0.00 H new ATOM 0 HG LEU A 73 43.120 26.105 22.744 1.00 0.00 H new ATOM 0 HD11 LEU A 73 43.889 24.249 21.254 1.00 0.00 H new ATOM 0 HD12 LEU A 73 44.320 24.034 22.967 1.00 0.00 H new ATOM 0 HD13 LEU A 73 42.966 23.115 22.268 1.00 0.00 H new ATOM 0 HD21 LEU A 73 42.058 25.500 20.559 1.00 0.00 H new ATOM 0 HD22 LEU A 73 40.841 24.567 21.463 1.00 0.00 H new ATOM 0 HD23 LEU A 73 40.966 26.327 21.696 1.00 0.00 H new ATOM 1193 N ARG A 74 42.016 23.532 26.798 1.00 0.00 N ATOM 1194 CA ARG A 74 41.815 23.287 28.216 1.00 0.00 C ATOM 1195 C ARG A 74 42.040 24.633 28.913 1.00 0.00 C ATOM 1196 O ARG A 74 42.975 25.397 28.700 1.00 0.00 O ATOM 1197 CB ARG A 74 42.920 22.362 28.726 1.00 0.00 C ATOM 1198 CG ARG A 74 42.855 20.930 28.195 1.00 0.00 C ATOM 1199 CD ARG A 74 43.922 19.949 28.670 1.00 0.00 C ATOM 1200 NE ARG A 74 43.503 18.557 28.507 1.00 0.00 N ATOM 1201 CZ ARG A 74 44.174 17.459 28.890 1.00 0.00 C ATOM 1202 NH1 ARG A 74 45.406 17.535 29.409 1.00 0.00 N ATOM 1203 NH2 ARG A 74 43.663 16.237 28.673 1.00 0.00 N ATOM 0 H ARG A 74 42.999 23.549 26.527 1.00 0.00 H new ATOM 0 HA ARG A 74 40.831 22.856 28.399 1.00 0.00 H new ATOM 0 HB2 ARG A 74 43.886 22.790 28.457 1.00 0.00 H new ATOM 0 HB3 ARG A 74 42.876 22.333 29.815 1.00 0.00 H new ATOM 0 HG2 ARG A 74 41.880 20.519 28.458 1.00 0.00 H new ATOM 0 HG3 ARG A 74 42.900 20.973 27.107 1.00 0.00 H new ATOM 0 HD2 ARG A 74 44.843 20.117 28.112 1.00 0.00 H new ATOM 0 HD3 ARG A 74 44.147 20.139 29.720 1.00 0.00 H new ATOM 0 HE ARG A 74 42.603 18.404 28.053 1.00 0.00 H new ATOM 0 HH11 ARG A 74 45.857 18.443 29.521 1.00 0.00 H new ATOM 0 HH12 ARG A 74 45.894 16.685 29.692 1.00 0.00 H new ATOM 0 HH21 ARG A 74 42.758 16.137 28.214 1.00 0.00 H new ATOM 0 HH22 ARG A 74 44.180 15.408 28.967 1.00 0.00 H new ATOM 1217 N GLY A 75 41.081 24.964 29.771 1.00 0.00 N ATOM 1218 CA GLY A 75 41.064 26.178 30.559 1.00 0.00 C ATOM 1219 C GLY A 75 39.787 26.998 30.345 1.00 0.00 C ATOM 1220 O GLY A 75 38.787 26.466 29.888 1.00 0.00 O ATOM 0 H GLY A 75 40.269 24.370 29.938 1.00 0.00 H new ATOM 0 HA2 GLY A 75 41.156 25.923 31.615 1.00 0.00 H new ATOM 0 HA3 GLY A 75 41.931 26.787 30.301 1.00 0.00 H new ATOM 1224 N GLY A 76 39.746 28.208 30.904 1.00 0.00 N ATOM 1225 CA GLY A 76 38.734 29.253 30.794 1.00 0.00 C ATOM 1226 C GLY A 76 38.209 29.505 32.194 1.00 0.00 C ATOM 1227 O GLY A 76 38.900 30.315 32.844 1.00 0.00 O ATOM 1228 OXT GLY A 76 37.198 28.957 32.680 1.00 0.00 O ATOM 0 H GLY A 76 40.507 28.510 31.512 1.00 0.00 H new ATOM 0 HA2 GLY A 76 39.162 30.162 30.372 1.00 0.00 H new ATOM 0 HA3 GLY A 76 37.928 28.942 30.129 1.00 0.00 H new TER 1232 GLY A 76