USER MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 586 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 102:sc= 0.556 USER MOD Set 1.2: A 57 SER OG : rot 180:sc= 0.508 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 169:sc= 1.18 (180deg=1.07) USER MOD Single : A 2 GLN : amide:sc= -0.115 X(o=-0.12,f=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.0185 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0.0723 USER MOD Single : A 11 LYS NZ :NH3+ -148:sc= 1.22 (180deg=1.08) USER MOD Single : A 12 THR OG1 : rot 180:sc= -0.146 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0.0432 USER MOD Single : A 22 THR OG1 : rot -78:sc= 1.31 USER MOD Single : A 25 ASN : amide:sc= 0 X(o=0,f=-0.069) USER MOD Single : A 27 LYS NZ :NH3+ 157:sc= 1.14 (180deg=0.0601!) USER MOD Single : A 29 LYS NZ :NH3+ -108:sc= 0.481 (180deg=-0.0235) USER MOD Single : A 31 GLN : amide:sc= -0.0633 K(o=-0.063,f=-3!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.034) USER MOD Single : A 41 GLN : amide:sc= -0.0232 K(o=-0.023,f=-1.1) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 ASN : amide:sc= -0.0181 X(o=-0.018,f=-0.52) USER MOD Single : A 62 GLN : amide:sc= -0.533 K(o=-0.53,f=0) USER MOD Single : A 63 LYS NZ :NH3+ -161:sc= 1.28 (180deg=1.07) USER MOD Single : A 65 SER OG : rot 107:sc= 1.26 USER MOD Single : A 66 THR OG1 : rot 39:sc= 0.201 USER MOD Single : A 68 HIS : no HD1:sc= -0.146 X(o=-0.15,f=-0.0049) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 13.498 30.873 16.552 1.00 0.00 N ATOM 2 CA MET A 1 13.563 30.962 18.013 1.00 0.00 C ATOM 3 C MET A 1 14.947 31.384 18.519 1.00 0.00 C ATOM 4 O MET A 1 15.951 30.982 17.948 1.00 0.00 O ATOM 5 CB MET A 1 13.047 29.729 18.756 1.00 0.00 C ATOM 6 CG MET A 1 14.029 28.549 18.697 1.00 0.00 C ATOM 7 SD MET A 1 13.307 26.951 19.132 1.00 0.00 S ATOM 8 CE MET A 1 14.756 25.969 18.702 1.00 0.00 C ATOM 0 H1 MET A 1 12.610 30.410 16.272 1.00 0.00 H new ATOM 0 H2 MET A 1 13.533 31.829 16.144 1.00 0.00 H new ATOM 0 H3 MET A 1 14.304 30.317 16.202 1.00 0.00 H new ATOM 0 HA MET A 1 12.861 31.759 18.257 1.00 0.00 H new ATOM 0 HB2 MET A 1 12.860 29.989 19.798 1.00 0.00 H new ATOM 0 HB3 MET A 1 12.092 29.424 18.327 1.00 0.00 H new ATOM 0 HG2 MET A 1 14.441 28.485 17.690 1.00 0.00 H new ATOM 0 HG3 MET A 1 14.862 28.752 19.370 1.00 0.00 H new ATOM 0 HE1 MET A 1 14.550 24.915 18.889 1.00 0.00 H new ATOM 0 HE2 MET A 1 14.992 26.111 17.647 1.00 0.00 H new ATOM 0 HE3 MET A 1 15.604 26.286 19.309 1.00 0.00 H new ATOM 20 N GLN A 2 15.111 32.016 19.684 1.00 0.00 N ATOM 21 CA GLN A 2 16.406 32.464 20.153 1.00 0.00 C ATOM 22 C GLN A 2 16.996 31.286 20.926 1.00 0.00 C ATOM 23 O GLN A 2 16.271 30.645 21.679 1.00 0.00 O ATOM 24 CB GLN A 2 16.237 33.608 21.147 1.00 0.00 C ATOM 25 CG GLN A 2 15.824 34.869 20.386 1.00 0.00 C ATOM 26 CD GLN A 2 15.644 36.113 21.254 1.00 0.00 C ATOM 27 OE1 GLN A 2 15.633 37.208 20.704 1.00 0.00 O ATOM 28 NE2 GLN A 2 15.519 36.066 22.574 1.00 0.00 N ATOM 0 H GLN A 2 14.344 32.227 20.322 1.00 0.00 H new ATOM 0 HA GLN A 2 17.025 32.794 19.319 1.00 0.00 H new ATOM 0 HB2 GLN A 2 15.482 33.353 21.891 1.00 0.00 H new ATOM 0 HB3 GLN A 2 17.169 33.781 21.685 1.00 0.00 H new ATOM 0 HG2 GLN A 2 16.576 35.080 19.626 1.00 0.00 H new ATOM 0 HG3 GLN A 2 14.889 34.670 19.863 1.00 0.00 H new ATOM 0 HE21 GLN A 2 15.525 35.167 23.055 1.00 0.00 H new ATOM 0 HE22 GLN A 2 15.417 36.929 23.108 1.00 0.00 H new ATOM 37 N ILE A 3 18.324 31.133 20.926 1.00 0.00 N ATOM 38 CA ILE A 3 19.153 30.390 21.849 1.00 0.00 C ATOM 39 C ILE A 3 20.242 31.342 22.349 1.00 0.00 C ATOM 40 O ILE A 3 20.830 32.129 21.605 1.00 0.00 O ATOM 41 CB ILE A 3 19.717 29.061 21.337 1.00 0.00 C ATOM 42 CG1 ILE A 3 20.782 29.179 20.242 1.00 0.00 C ATOM 43 CG2 ILE A 3 18.585 28.078 21.005 1.00 0.00 C ATOM 44 CD1 ILE A 3 21.644 27.932 20.042 1.00 0.00 C ATOM 0 H ILE A 3 18.891 31.575 20.202 1.00 0.00 H new ATOM 0 HA ILE A 3 18.514 30.051 22.664 1.00 0.00 H new ATOM 0 HB ILE A 3 20.286 28.639 22.165 1.00 0.00 H new ATOM 0 HG12 ILE A 3 20.288 29.416 19.300 1.00 0.00 H new ATOM 0 HG13 ILE A 3 21.435 30.019 20.480 1.00 0.00 H new ATOM 0 HG21 ILE A 3 19.010 27.142 20.643 1.00 0.00 H new ATOM 0 HG22 ILE A 3 17.995 27.886 21.901 1.00 0.00 H new ATOM 0 HG23 ILE A 3 17.945 28.507 20.234 1.00 0.00 H new ATOM 0 HD11 ILE A 3 22.367 28.113 19.247 1.00 0.00 H new ATOM 0 HD12 ILE A 3 22.172 27.703 20.967 1.00 0.00 H new ATOM 0 HD13 ILE A 3 21.008 27.090 19.769 1.00 0.00 H new ATOM 56 N PHE A 4 20.582 31.186 23.626 1.00 0.00 N ATOM 57 CA PHE A 4 21.652 31.952 24.231 1.00 0.00 C ATOM 58 C PHE A 4 22.849 31.015 24.354 1.00 0.00 C ATOM 59 O PHE A 4 22.700 29.839 24.651 1.00 0.00 O ATOM 60 CB PHE A 4 21.246 32.541 25.581 1.00 0.00 C ATOM 61 CG PHE A 4 20.046 33.448 25.590 1.00 0.00 C ATOM 62 CD1 PHE A 4 19.784 34.416 24.611 1.00 0.00 C ATOM 63 CD2 PHE A 4 19.126 33.221 26.616 1.00 0.00 C ATOM 64 CE1 PHE A 4 18.548 35.083 24.578 1.00 0.00 C ATOM 65 CE2 PHE A 4 17.976 34.014 26.644 1.00 0.00 C ATOM 66 CZ PHE A 4 17.596 34.818 25.566 1.00 0.00 C ATOM 0 H PHE A 4 20.125 30.530 24.260 1.00 0.00 H new ATOM 0 HA PHE A 4 21.901 32.813 23.610 1.00 0.00 H new ATOM 0 HB2 PHE A 4 21.054 31.717 26.268 1.00 0.00 H new ATOM 0 HB3 PHE A 4 22.095 33.097 25.979 1.00 0.00 H new ATOM 0 HD1 PHE A 4 20.539 34.651 23.875 1.00 0.00 H new ATOM 0 HD2 PHE A 4 19.298 32.459 27.362 1.00 0.00 H new ATOM 0 HE1 PHE A 4 18.335 35.795 23.795 1.00 0.00 H new ATOM 0 HE2 PHE A 4 17.359 34.005 27.530 1.00 0.00 H new ATOM 0 HZ PHE A 4 16.597 35.222 25.499 1.00 0.00 H new ATOM 76 N VAL A 5 24.024 31.499 23.975 1.00 0.00 N ATOM 77 CA VAL A 5 25.213 30.697 23.785 1.00 0.00 C ATOM 78 C VAL A 5 26.408 31.400 24.428 1.00 0.00 C ATOM 79 O VAL A 5 26.594 32.592 24.149 1.00 0.00 O ATOM 80 CB VAL A 5 25.497 30.278 22.350 1.00 0.00 C ATOM 81 CG1 VAL A 5 26.707 29.391 22.078 1.00 0.00 C ATOM 82 CG2 VAL A 5 24.313 29.454 21.825 1.00 0.00 C ATOM 0 H VAL A 5 24.175 32.490 23.787 1.00 0.00 H new ATOM 0 HA VAL A 5 25.025 29.748 24.287 1.00 0.00 H new ATOM 0 HB VAL A 5 25.684 31.238 21.869 1.00 0.00 H new ATOM 0 HG11 VAL A 5 26.772 29.181 21.010 1.00 0.00 H new ATOM 0 HG12 VAL A 5 27.613 29.902 22.403 1.00 0.00 H new ATOM 0 HG13 VAL A 5 26.602 28.454 22.626 1.00 0.00 H new ATOM 0 HG21 VAL A 5 24.509 29.150 20.797 1.00 0.00 H new ATOM 0 HG22 VAL A 5 24.182 28.568 22.447 1.00 0.00 H new ATOM 0 HG23 VAL A 5 23.406 30.058 21.858 1.00 0.00 H new ATOM 92 N LYS A 6 27.199 30.791 25.305 1.00 0.00 N ATOM 93 CA LYS A 6 28.168 31.416 26.187 1.00 0.00 C ATOM 94 C LYS A 6 29.607 30.979 25.895 1.00 0.00 C ATOM 95 O LYS A 6 29.936 29.812 26.097 1.00 0.00 O ATOM 96 CB LYS A 6 27.834 31.298 27.676 1.00 0.00 C ATOM 97 CG LYS A 6 28.654 32.201 28.597 1.00 0.00 C ATOM 98 CD LYS A 6 28.073 32.158 30.014 1.00 0.00 C ATOM 99 CE LYS A 6 27.498 33.494 30.497 1.00 0.00 C ATOM 100 NZ LYS A 6 26.593 33.522 31.656 1.00 0.00 N ATOM 0 H LYS A 6 27.175 29.778 25.423 1.00 0.00 H new ATOM 0 HA LYS A 6 28.096 32.478 25.953 1.00 0.00 H new ATOM 0 HB2 LYS A 6 26.777 31.527 27.815 1.00 0.00 H new ATOM 0 HB3 LYS A 6 27.979 30.263 27.984 1.00 0.00 H new ATOM 0 HG2 LYS A 6 29.694 31.875 28.610 1.00 0.00 H new ATOM 0 HG3 LYS A 6 28.645 33.224 28.221 1.00 0.00 H new ATOM 0 HD2 LYS A 6 27.288 31.403 30.050 1.00 0.00 H new ATOM 0 HD3 LYS A 6 28.853 31.840 30.705 1.00 0.00 H new ATOM 0 HE2 LYS A 6 28.340 34.147 30.726 1.00 0.00 H new ATOM 0 HE3 LYS A 6 26.966 33.942 29.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 26.300 34.502 31.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 25.753 32.942 31.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 27.085 33.141 32.490 1.00 0.00 H new ATOM 114 N THR A 7 30.475 31.898 25.484 1.00 0.00 N ATOM 115 CA THR A 7 31.869 31.644 25.143 1.00 0.00 C ATOM 116 C THR A 7 32.682 31.413 26.412 1.00 0.00 C ATOM 117 O THR A 7 32.233 31.773 27.496 1.00 0.00 O ATOM 118 CB THR A 7 32.381 32.830 24.321 1.00 0.00 C ATOM 119 OG1 THR A 7 32.129 34.055 24.960 1.00 0.00 O ATOM 120 CG2 THR A 7 31.917 32.734 22.874 1.00 0.00 C ATOM 0 H THR A 7 30.216 32.878 25.375 1.00 0.00 H new ATOM 0 HA THR A 7 31.970 30.740 24.543 1.00 0.00 H new ATOM 0 HB THR A 7 33.469 32.784 24.266 1.00 0.00 H new ATOM 0 HG1 THR A 7 32.471 34.789 24.407 1.00 0.00 H new ATOM 0 HG21 THR A 7 32.295 33.589 22.313 1.00 0.00 H new ATOM 0 HG22 THR A 7 32.296 31.813 22.431 1.00 0.00 H new ATOM 0 HG23 THR A 7 30.828 32.731 22.841 1.00 0.00 H new ATOM 128 N LEU A 8 33.841 30.760 26.353 1.00 0.00 N ATOM 129 CA LEU A 8 34.597 30.227 27.477 1.00 0.00 C ATOM 130 C LEU A 8 34.941 31.407 28.393 1.00 0.00 C ATOM 131 O LEU A 8 34.882 31.299 29.612 1.00 0.00 O ATOM 132 CB LEU A 8 35.809 29.432 26.969 1.00 0.00 C ATOM 133 CG LEU A 8 36.590 28.771 28.101 1.00 0.00 C ATOM 134 CD1 LEU A 8 35.811 27.641 28.763 1.00 0.00 C ATOM 135 CD2 LEU A 8 37.972 28.361 27.601 1.00 0.00 C ATOM 0 H LEU A 8 34.303 30.579 25.462 1.00 0.00 H new ATOM 0 HA LEU A 8 34.023 29.509 28.064 1.00 0.00 H new ATOM 0 HB2 LEU A 8 35.471 28.667 26.270 1.00 0.00 H new ATOM 0 HB3 LEU A 8 36.471 30.099 26.416 1.00 0.00 H new ATOM 0 HG LEU A 8 36.738 29.497 28.900 1.00 0.00 H new ATOM 0 HD11 LEU A 8 36.411 27.204 29.561 1.00 0.00 H new ATOM 0 HD12 LEU A 8 34.883 28.034 29.180 1.00 0.00 H new ATOM 0 HD13 LEU A 8 35.580 26.875 28.022 1.00 0.00 H new ATOM 0 HD21 LEU A 8 38.527 27.889 28.412 1.00 0.00 H new ATOM 0 HD22 LEU A 8 37.866 27.657 26.776 1.00 0.00 H new ATOM 0 HD23 LEU A 8 38.511 29.244 27.258 1.00 0.00 H new ATOM 147 N THR A 9 35.314 32.582 27.889 1.00 0.00 N ATOM 148 CA THR A 9 35.598 33.799 28.618 1.00 0.00 C ATOM 149 C THR A 9 34.423 34.675 29.071 1.00 0.00 C ATOM 150 O THR A 9 34.660 35.775 29.554 1.00 0.00 O ATOM 151 CB THR A 9 36.438 34.563 27.595 1.00 0.00 C ATOM 152 OG1 THR A 9 35.838 34.688 26.328 1.00 0.00 O ATOM 153 CG2 THR A 9 37.733 33.805 27.298 1.00 0.00 C ATOM 0 H THR A 9 35.432 32.709 26.884 1.00 0.00 H new ATOM 0 HA THR A 9 36.049 33.548 29.578 1.00 0.00 H new ATOM 0 HB THR A 9 36.578 35.542 28.054 1.00 0.00 H new ATOM 0 HG1 THR A 9 36.434 35.188 25.732 1.00 0.00 H new ATOM 0 HG21 THR A 9 38.321 34.361 26.568 1.00 0.00 H new ATOM 0 HG22 THR A 9 38.308 33.693 28.217 1.00 0.00 H new ATOM 0 HG23 THR A 9 37.494 32.820 26.897 1.00 0.00 H new ATOM 161 N GLY A 10 33.175 34.293 28.833 1.00 0.00 N ATOM 162 CA GLY A 10 32.046 34.679 29.641 1.00 0.00 C ATOM 163 C GLY A 10 30.929 35.522 29.011 1.00 0.00 C ATOM 164 O GLY A 10 29.844 35.641 29.581 1.00 0.00 O ATOM 0 H GLY A 10 32.923 33.690 28.050 1.00 0.00 H new ATOM 0 HA2 GLY A 10 31.591 33.767 30.027 1.00 0.00 H new ATOM 0 HA3 GLY A 10 32.430 35.231 30.499 1.00 0.00 H new ATOM 168 N LYS A 11 31.200 35.958 27.782 1.00 0.00 N ATOM 169 CA LYS A 11 30.344 36.819 26.992 1.00 0.00 C ATOM 170 C LYS A 11 29.196 35.960 26.470 1.00 0.00 C ATOM 171 O LYS A 11 29.485 34.978 25.787 1.00 0.00 O ATOM 172 CB LYS A 11 31.130 37.360 25.793 1.00 0.00 C ATOM 173 CG LYS A 11 30.254 37.877 24.659 1.00 0.00 C ATOM 174 CD LYS A 11 31.092 38.480 23.530 1.00 0.00 C ATOM 175 CE LYS A 11 30.163 38.994 22.426 1.00 0.00 C ATOM 176 NZ LYS A 11 30.853 39.419 21.200 1.00 0.00 N ATOM 0 H LYS A 11 32.060 35.706 27.296 1.00 0.00 H new ATOM 0 HA LYS A 11 29.980 37.653 27.592 1.00 0.00 H new ATOM 0 HB2 LYS A 11 31.780 38.166 26.132 1.00 0.00 H new ATOM 0 HB3 LYS A 11 31.775 36.570 25.409 1.00 0.00 H new ATOM 0 HG2 LYS A 11 29.647 37.061 24.266 1.00 0.00 H new ATOM 0 HG3 LYS A 11 29.566 38.630 25.044 1.00 0.00 H new ATOM 0 HD2 LYS A 11 31.706 39.295 23.913 1.00 0.00 H new ATOM 0 HD3 LYS A 11 31.773 37.730 23.128 1.00 0.00 H new ATOM 0 HE2 LYS A 11 29.450 38.209 22.173 1.00 0.00 H new ATOM 0 HE3 LYS A 11 29.588 39.834 22.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 30.326 40.198 20.757 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 31.813 39.741 21.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 30.909 38.619 20.538 1.00 0.00 H new ATOM 190 N THR A 12 27.942 36.307 26.750 1.00 0.00 N ATOM 191 CA THR A 12 26.814 35.654 26.130 1.00 0.00 C ATOM 192 C THR A 12 26.565 36.256 24.744 1.00 0.00 C ATOM 193 O THR A 12 26.813 37.437 24.486 1.00 0.00 O ATOM 194 CB THR A 12 25.644 36.082 27.012 1.00 0.00 C ATOM 195 OG1 THR A 12 25.897 35.708 28.348 1.00 0.00 O ATOM 196 CG2 THR A 12 24.327 35.432 26.576 1.00 0.00 C ATOM 0 H THR A 12 27.690 37.044 27.409 1.00 0.00 H new ATOM 0 HA THR A 12 26.955 34.578 26.032 1.00 0.00 H new ATOM 0 HB THR A 12 25.548 37.164 26.917 1.00 0.00 H new ATOM 0 HG1 THR A 12 25.146 35.985 28.913 1.00 0.00 H new ATOM 0 HG21 THR A 12 23.522 35.765 27.232 1.00 0.00 H new ATOM 0 HG22 THR A 12 24.101 35.720 25.549 1.00 0.00 H new ATOM 0 HG23 THR A 12 24.419 34.348 26.637 1.00 0.00 H new ATOM 204 N ILE A 13 26.271 35.421 23.757 1.00 0.00 N ATOM 205 CA ILE A 13 25.856 35.702 22.394 1.00 0.00 C ATOM 206 C ILE A 13 24.502 34.983 22.279 1.00 0.00 C ATOM 207 O ILE A 13 24.362 33.839 22.696 1.00 0.00 O ATOM 208 CB ILE A 13 26.940 35.207 21.434 1.00 0.00 C ATOM 209 CG1 ILE A 13 28.285 35.875 21.687 1.00 0.00 C ATOM 210 CG2 ILE A 13 26.495 35.570 20.007 1.00 0.00 C ATOM 211 CD1 ILE A 13 29.286 34.883 22.281 1.00 0.00 C ATOM 0 H ILE A 13 26.325 34.415 23.914 1.00 0.00 H new ATOM 0 HA ILE A 13 25.735 36.755 22.141 1.00 0.00 H new ATOM 0 HB ILE A 13 27.063 34.134 21.578 1.00 0.00 H new ATOM 0 HG12 ILE A 13 28.677 36.277 20.753 1.00 0.00 H new ATOM 0 HG13 ILE A 13 28.155 36.717 22.367 1.00 0.00 H new ATOM 0 HG21 ILE A 13 27.247 35.231 19.294 1.00 0.00 H new ATOM 0 HG22 ILE A 13 25.543 35.086 19.788 1.00 0.00 H new ATOM 0 HG23 ILE A 13 26.379 36.651 19.926 1.00 0.00 H new ATOM 0 HD11 ILE A 13 30.238 35.385 22.452 1.00 0.00 H new ATOM 0 HD12 ILE A 13 28.902 34.501 23.227 1.00 0.00 H new ATOM 0 HD13 ILE A 13 29.432 34.055 21.588 1.00 0.00 H new ATOM 223 N THR A 14 23.615 35.665 21.566 1.00 0.00 N ATOM 224 CA THR A 14 22.317 35.216 21.087 1.00 0.00 C ATOM 225 C THR A 14 22.370 34.728 19.645 1.00 0.00 C ATOM 226 O THR A 14 22.733 35.496 18.748 1.00 0.00 O ATOM 227 CB THR A 14 21.293 36.352 21.166 1.00 0.00 C ATOM 228 OG1 THR A 14 21.460 36.924 22.444 1.00 0.00 O ATOM 229 CG2 THR A 14 19.827 35.924 21.053 1.00 0.00 C ATOM 0 H THR A 14 23.803 36.627 21.285 1.00 0.00 H new ATOM 0 HA THR A 14 22.023 34.386 21.730 1.00 0.00 H new ATOM 0 HB THR A 14 21.477 37.017 20.322 1.00 0.00 H new ATOM 0 HG1 THR A 14 20.828 37.665 22.556 1.00 0.00 H new ATOM 0 HG21 THR A 14 19.185 36.802 21.121 1.00 0.00 H new ATOM 0 HG22 THR A 14 19.665 35.429 20.095 1.00 0.00 H new ATOM 0 HG23 THR A 14 19.586 35.235 21.862 1.00 0.00 H new ATOM 237 N LEU A 15 22.025 33.472 19.381 1.00 0.00 N ATOM 238 CA LEU A 15 21.844 32.896 18.065 1.00 0.00 C ATOM 239 C LEU A 15 20.356 32.692 17.771 1.00 0.00 C ATOM 240 O LEU A 15 19.629 32.253 18.659 1.00 0.00 O ATOM 241 CB LEU A 15 22.598 31.568 18.020 1.00 0.00 C ATOM 242 CG LEU A 15 24.131 31.557 18.089 1.00 0.00 C ATOM 243 CD1 LEU A 15 24.757 30.167 17.969 1.00 0.00 C ATOM 244 CD2 LEU A 15 24.843 32.470 17.104 1.00 0.00 C ATOM 0 H LEU A 15 21.856 32.796 20.126 1.00 0.00 H new ATOM 0 HA LEU A 15 22.237 33.568 17.302 1.00 0.00 H new ATOM 0 HB2 LEU A 15 22.231 30.958 18.846 1.00 0.00 H new ATOM 0 HB3 LEU A 15 22.311 31.062 17.098 1.00 0.00 H new ATOM 0 HG LEU A 15 24.289 31.949 19.094 1.00 0.00 H new ATOM 0 HD11 LEU A 15 25.842 30.250 18.028 1.00 0.00 H new ATOM 0 HD12 LEU A 15 24.397 29.535 18.781 1.00 0.00 H new ATOM 0 HD13 LEU A 15 24.478 29.724 17.013 1.00 0.00 H new ATOM 0 HD21 LEU A 15 25.921 32.383 17.241 1.00 0.00 H new ATOM 0 HD22 LEU A 15 24.582 32.181 16.086 1.00 0.00 H new ATOM 0 HD23 LEU A 15 24.538 33.502 17.278 1.00 0.00 H new ATOM 256 N GLU A 16 20.054 33.078 16.537 1.00 0.00 N ATOM 257 CA GLU A 16 18.707 32.758 16.102 1.00 0.00 C ATOM 258 C GLU A 16 18.847 31.393 15.413 1.00 0.00 C ATOM 259 O GLU A 16 19.819 31.166 14.683 1.00 0.00 O ATOM 260 CB GLU A 16 18.312 33.850 15.111 1.00 0.00 C ATOM 261 CG GLU A 16 17.863 35.172 15.732 1.00 0.00 C ATOM 262 CD GLU A 16 17.918 36.197 14.612 1.00 0.00 C ATOM 263 OE1 GLU A 16 19.058 36.611 14.297 1.00 0.00 O ATOM 264 OE2 GLU A 16 16.903 36.494 13.950 1.00 0.00 O ATOM 0 H GLU A 16 20.659 33.566 15.877 1.00 0.00 H new ATOM 0 HA GLU A 16 17.956 32.712 16.890 1.00 0.00 H new ATOM 0 HB2 GLU A 16 19.161 34.046 14.456 1.00 0.00 H new ATOM 0 HB3 GLU A 16 17.506 33.472 14.483 1.00 0.00 H new ATOM 0 HG2 GLU A 16 16.855 35.091 16.138 1.00 0.00 H new ATOM 0 HG3 GLU A 16 18.516 35.458 16.556 1.00 0.00 H new ATOM 271 N VAL A 17 17.938 30.436 15.555 1.00 0.00 N ATOM 272 CA VAL A 17 17.959 29.074 15.068 1.00 0.00 C ATOM 273 C VAL A 17 16.492 28.673 14.931 1.00 0.00 C ATOM 274 O VAL A 17 15.653 29.421 15.421 1.00 0.00 O ATOM 275 CB VAL A 17 18.729 28.100 15.976 1.00 0.00 C ATOM 276 CG1 VAL A 17 20.161 28.542 16.292 1.00 0.00 C ATOM 277 CG2 VAL A 17 18.119 27.869 17.352 1.00 0.00 C ATOM 0 H VAL A 17 17.078 30.622 16.071 1.00 0.00 H new ATOM 0 HA VAL A 17 18.496 29.022 14.121 1.00 0.00 H new ATOM 0 HB VAL A 17 18.689 27.197 15.367 1.00 0.00 H new ATOM 0 HG11 VAL A 17 20.636 27.803 16.937 1.00 0.00 H new ATOM 0 HG12 VAL A 17 20.727 28.632 15.365 1.00 0.00 H new ATOM 0 HG13 VAL A 17 20.140 29.506 16.800 1.00 0.00 H new ATOM 0 HG21 VAL A 17 18.738 27.168 17.911 1.00 0.00 H new ATOM 0 HG22 VAL A 17 18.066 28.815 17.890 1.00 0.00 H new ATOM 0 HG23 VAL A 17 17.115 27.458 17.241 1.00 0.00 H new ATOM 287 N GLU A 18 16.220 27.545 14.283 1.00 0.00 N ATOM 288 CA GLU A 18 14.955 26.864 14.131 1.00 0.00 C ATOM 289 C GLU A 18 15.072 25.500 14.817 1.00 0.00 C ATOM 290 O GLU A 18 16.148 24.930 15.022 1.00 0.00 O ATOM 291 CB GLU A 18 14.601 26.718 12.651 1.00 0.00 C ATOM 292 CG GLU A 18 14.165 28.014 11.979 1.00 0.00 C ATOM 293 CD GLU A 18 14.463 28.058 10.491 1.00 0.00 C ATOM 294 OE1 GLU A 18 15.638 27.915 10.106 1.00 0.00 O ATOM 295 OE2 GLU A 18 13.494 28.323 9.743 1.00 0.00 O ATOM 0 H GLU A 18 16.964 27.039 13.804 1.00 0.00 H new ATOM 0 HA GLU A 18 14.152 27.438 14.593 1.00 0.00 H new ATOM 0 HB2 GLU A 18 15.466 26.321 12.120 1.00 0.00 H new ATOM 0 HB3 GLU A 18 13.801 25.984 12.552 1.00 0.00 H new ATOM 0 HG2 GLU A 18 13.094 28.150 12.131 1.00 0.00 H new ATOM 0 HG3 GLU A 18 14.664 28.852 12.466 1.00 0.00 H new ATOM 302 N PRO A 19 13.949 24.888 15.161 1.00 0.00 N ATOM 303 CA PRO A 19 13.873 23.527 15.670 1.00 0.00 C ATOM 304 C PRO A 19 14.446 22.430 14.773 1.00 0.00 C ATOM 305 O PRO A 19 14.909 21.404 15.262 1.00 0.00 O ATOM 306 CB PRO A 19 12.428 23.383 16.154 1.00 0.00 C ATOM 307 CG PRO A 19 11.617 24.256 15.198 1.00 0.00 C ATOM 308 CD PRO A 19 12.613 25.370 14.867 1.00 0.00 C ATOM 0 HA PRO A 19 14.563 23.362 16.498 1.00 0.00 H new ATOM 0 HB2 PRO A 19 12.099 22.344 16.119 1.00 0.00 H new ATOM 0 HB3 PRO A 19 12.320 23.717 17.186 1.00 0.00 H new ATOM 0 HG2 PRO A 19 11.306 23.708 14.308 1.00 0.00 H new ATOM 0 HG3 PRO A 19 10.712 24.643 15.666 1.00 0.00 H new ATOM 0 HD2 PRO A 19 12.533 25.651 13.817 1.00 0.00 H new ATOM 0 HD3 PRO A 19 12.394 26.262 15.453 1.00 0.00 H new ATOM 316 N SER A 20 14.398 22.648 13.460 1.00 0.00 N ATOM 317 CA SER A 20 14.607 21.751 12.346 1.00 0.00 C ATOM 318 C SER A 20 16.060 21.888 11.881 1.00 0.00 C ATOM 319 O SER A 20 16.395 21.365 10.824 1.00 0.00 O ATOM 320 CB SER A 20 13.576 22.062 11.261 1.00 0.00 C ATOM 321 OG SER A 20 13.388 23.434 11.026 1.00 0.00 O ATOM 0 H SER A 20 14.182 23.585 13.119 1.00 0.00 H new ATOM 0 HA SER A 20 14.459 20.707 12.623 1.00 0.00 H new ATOM 0 HB2 SER A 20 13.887 21.584 10.332 1.00 0.00 H new ATOM 0 HB3 SER A 20 12.621 21.618 11.544 1.00 0.00 H new ATOM 0 HG SER A 20 12.718 23.556 10.321 1.00 0.00 H new ATOM 327 N ASP A 21 16.934 22.561 12.630 1.00 0.00 N ATOM 328 CA ASP A 21 18.309 22.839 12.281 1.00 0.00 C ATOM 329 C ASP A 21 19.257 21.766 12.830 1.00 0.00 C ATOM 330 O ASP A 21 18.948 21.284 13.918 1.00 0.00 O ATOM 331 CB ASP A 21 18.830 24.066 13.021 1.00 0.00 C ATOM 332 CG ASP A 21 18.719 25.360 12.214 1.00 0.00 C ATOM 333 OD1 ASP A 21 19.035 25.266 11.004 1.00 0.00 O ATOM 334 OD2 ASP A 21 18.468 26.428 12.787 1.00 0.00 O ATOM 0 H ASP A 21 16.679 22.942 13.541 1.00 0.00 H new ATOM 0 HA ASP A 21 18.300 22.926 11.195 1.00 0.00 H new ATOM 0 HB2 ASP A 21 18.276 24.180 13.953 1.00 0.00 H new ATOM 0 HB3 ASP A 21 19.874 23.903 13.288 1.00 0.00 H new ATOM 339 N THR A 22 20.355 21.428 12.154 1.00 0.00 N ATOM 340 CA THR A 22 21.379 20.531 12.633 1.00 0.00 C ATOM 341 C THR A 22 22.435 21.254 13.483 1.00 0.00 C ATOM 342 O THR A 22 22.698 22.433 13.295 1.00 0.00 O ATOM 343 CB THR A 22 22.030 19.774 11.474 1.00 0.00 C ATOM 344 OG1 THR A 22 22.675 18.566 11.804 1.00 0.00 O ATOM 345 CG2 THR A 22 22.916 20.537 10.489 1.00 0.00 C ATOM 0 H THR A 22 20.553 21.792 11.222 1.00 0.00 H new ATOM 0 HA THR A 22 20.890 19.806 13.284 1.00 0.00 H new ATOM 0 HB THR A 22 21.100 19.567 10.945 1.00 0.00 H new ATOM 0 HG1 THR A 22 23.548 18.760 12.204 1.00 0.00 H new ATOM 0 HG21 THR A 22 23.295 19.850 9.733 1.00 0.00 H new ATOM 0 HG22 THR A 22 22.332 21.321 10.007 1.00 0.00 H new ATOM 0 HG23 THR A 22 23.753 20.985 11.024 1.00 0.00 H new ATOM 353 N ILE A 23 23.095 20.605 14.432 1.00 0.00 N ATOM 354 CA ILE A 23 23.973 21.217 15.412 1.00 0.00 C ATOM 355 C ILE A 23 25.182 21.818 14.686 1.00 0.00 C ATOM 356 O ILE A 23 25.736 22.796 15.189 1.00 0.00 O ATOM 357 CB ILE A 23 24.273 20.059 16.360 1.00 0.00 C ATOM 358 CG1 ILE A 23 23.007 19.708 17.138 1.00 0.00 C ATOM 359 CG2 ILE A 23 25.398 20.387 17.331 1.00 0.00 C ATOM 360 CD1 ILE A 23 23.001 18.315 17.775 1.00 0.00 C ATOM 0 H ILE A 23 23.028 19.593 14.542 1.00 0.00 H new ATOM 0 HA ILE A 23 23.568 22.058 15.975 1.00 0.00 H new ATOM 0 HB ILE A 23 24.600 19.210 15.760 1.00 0.00 H new ATOM 0 HG12 ILE A 23 22.864 20.450 17.923 1.00 0.00 H new ATOM 0 HG13 ILE A 23 22.153 19.787 16.466 1.00 0.00 H new ATOM 0 HG21 ILE A 23 25.575 19.533 17.985 1.00 0.00 H new ATOM 0 HG22 ILE A 23 26.307 20.611 16.773 1.00 0.00 H new ATOM 0 HG23 ILE A 23 25.119 21.252 17.932 1.00 0.00 H new ATOM 0 HD11 ILE A 23 22.061 18.161 18.304 1.00 0.00 H new ATOM 0 HD12 ILE A 23 23.108 17.559 16.997 1.00 0.00 H new ATOM 0 HD13 ILE A 23 23.830 18.233 18.477 1.00 0.00 H new ATOM 372 N GLU A 24 25.754 21.379 13.568 1.00 0.00 N ATOM 373 CA GLU A 24 26.856 22.031 12.884 1.00 0.00 C ATOM 374 C GLU A 24 26.518 23.422 12.358 1.00 0.00 C ATOM 375 O GLU A 24 27.334 24.345 12.424 1.00 0.00 O ATOM 376 CB GLU A 24 27.428 21.120 11.793 1.00 0.00 C ATOM 377 CG GLU A 24 26.461 20.229 10.997 1.00 0.00 C ATOM 378 CD GLU A 24 25.976 18.966 11.701 1.00 0.00 C ATOM 379 OE1 GLU A 24 25.182 19.011 12.669 1.00 0.00 O ATOM 380 OE2 GLU A 24 26.467 17.899 11.288 1.00 0.00 O ATOM 0 H GLU A 24 25.447 20.526 13.100 1.00 0.00 H new ATOM 0 HA GLU A 24 27.631 22.199 13.632 1.00 0.00 H new ATOM 0 HB2 GLU A 24 27.960 21.751 11.080 1.00 0.00 H new ATOM 0 HB3 GLU A 24 28.169 20.471 12.259 1.00 0.00 H new ATOM 0 HG2 GLU A 24 25.590 20.826 10.725 1.00 0.00 H new ATOM 0 HG3 GLU A 24 26.950 19.937 10.068 1.00 0.00 H new ATOM 387 N ASN A 25 25.313 23.575 11.813 1.00 0.00 N ATOM 388 CA ASN A 25 24.723 24.771 11.251 1.00 0.00 C ATOM 389 C ASN A 25 24.431 25.815 12.322 1.00 0.00 C ATOM 390 O ASN A 25 24.482 26.982 11.933 1.00 0.00 O ATOM 391 CB ASN A 25 23.417 24.539 10.481 1.00 0.00 C ATOM 392 CG ASN A 25 23.598 23.978 9.078 1.00 0.00 C ATOM 393 OD1 ASN A 25 24.495 23.191 8.765 1.00 0.00 O ATOM 394 ND2 ASN A 25 22.865 24.411 8.054 1.00 0.00 N ATOM 0 H ASN A 25 24.671 22.785 11.752 1.00 0.00 H new ATOM 0 HA ASN A 25 25.480 25.120 10.549 1.00 0.00 H new ATOM 0 HB2 ASN A 25 22.790 23.855 11.053 1.00 0.00 H new ATOM 0 HB3 ASN A 25 22.878 25.484 10.413 1.00 0.00 H new ATOM 0 HD21 ASN A 25 23.069 24.088 7.108 1.00 0.00 H new ATOM 0 HD22 ASN A 25 22.099 25.065 8.216 1.00 0.00 H new ATOM 401 N VAL A 26 24.115 25.487 13.574 1.00 0.00 N ATOM 402 CA VAL A 26 24.164 26.406 14.701 1.00 0.00 C ATOM 403 C VAL A 26 25.580 26.946 14.882 1.00 0.00 C ATOM 404 O VAL A 26 25.835 28.081 15.279 1.00 0.00 O ATOM 405 CB VAL A 26 23.587 25.637 15.888 1.00 0.00 C ATOM 406 CG1 VAL A 26 23.453 26.561 17.100 1.00 0.00 C ATOM 407 CG2 VAL A 26 22.173 25.140 15.605 1.00 0.00 C ATOM 0 H VAL A 26 23.810 24.549 13.835 1.00 0.00 H new ATOM 0 HA VAL A 26 23.568 27.308 14.561 1.00 0.00 H new ATOM 0 HB VAL A 26 24.266 24.804 16.070 1.00 0.00 H new ATOM 0 HG11 VAL A 26 23.041 26.002 17.940 1.00 0.00 H new ATOM 0 HG12 VAL A 26 24.434 26.951 17.370 1.00 0.00 H new ATOM 0 HG13 VAL A 26 22.788 27.389 16.854 1.00 0.00 H new ATOM 0 HG21 VAL A 26 21.797 24.598 16.473 1.00 0.00 H new ATOM 0 HG22 VAL A 26 21.523 25.990 15.399 1.00 0.00 H new ATOM 0 HG23 VAL A 26 22.187 24.476 14.741 1.00 0.00 H new ATOM 417 N LYS A 27 26.501 25.991 14.944 1.00 0.00 N ATOM 418 CA LYS A 27 27.870 26.074 15.412 1.00 0.00 C ATOM 419 C LYS A 27 28.747 26.931 14.483 1.00 0.00 C ATOM 420 O LYS A 27 29.518 27.743 14.984 1.00 0.00 O ATOM 421 CB LYS A 27 28.468 24.690 15.654 1.00 0.00 C ATOM 422 CG LYS A 27 28.107 23.881 16.897 1.00 0.00 C ATOM 423 CD LYS A 27 28.675 22.478 17.055 1.00 0.00 C ATOM 424 CE LYS A 27 30.109 22.160 16.632 1.00 0.00 C ATOM 425 NZ LYS A 27 30.793 20.973 17.160 1.00 0.00 N ATOM 0 H LYS A 27 26.279 25.045 14.635 1.00 0.00 H new ATOM 0 HA LYS A 27 27.849 26.584 16.375 1.00 0.00 H new ATOM 0 HB2 LYS A 27 28.213 24.077 14.790 1.00 0.00 H new ATOM 0 HB3 LYS A 27 29.552 24.807 15.653 1.00 0.00 H new ATOM 0 HG2 LYS A 27 28.415 24.460 17.767 1.00 0.00 H new ATOM 0 HG3 LYS A 27 27.020 23.802 16.934 1.00 0.00 H new ATOM 0 HD2 LYS A 27 28.586 22.214 18.109 1.00 0.00 H new ATOM 0 HD3 LYS A 27 28.021 21.804 16.501 1.00 0.00 H new ATOM 0 HE2 LYS A 27 30.114 22.078 15.545 1.00 0.00 H new ATOM 0 HE3 LYS A 27 30.720 23.025 16.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 31.557 20.695 16.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 31.194 21.190 18.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 30.113 20.191 17.249 1.00 0.00 H new ATOM 439 N ALA A 28 28.645 26.869 13.160 1.00 0.00 N ATOM 440 CA ALA A 28 29.302 27.586 12.090 1.00 0.00 C ATOM 441 C ALA A 28 28.984 29.082 12.057 1.00 0.00 C ATOM 442 O ALA A 28 29.771 29.758 11.395 1.00 0.00 O ATOM 443 CB ALA A 28 29.044 26.801 10.807 1.00 0.00 C ATOM 0 H ALA A 28 27.988 26.200 12.759 1.00 0.00 H new ATOM 0 HA ALA A 28 30.380 27.628 12.248 1.00 0.00 H new ATOM 0 HB1 ALA A 28 29.523 27.307 9.969 1.00 0.00 H new ATOM 0 HB2 ALA A 28 29.454 25.796 10.907 1.00 0.00 H new ATOM 0 HB3 ALA A 28 27.971 26.739 10.628 1.00 0.00 H new ATOM 449 N LYS A 29 27.931 29.594 12.694 1.00 0.00 N ATOM 450 CA LYS A 29 27.498 30.969 12.845 1.00 0.00 C ATOM 451 C LYS A 29 28.512 31.766 13.657 1.00 0.00 C ATOM 452 O LYS A 29 28.732 32.929 13.348 1.00 0.00 O ATOM 453 CB LYS A 29 26.045 31.125 13.294 1.00 0.00 C ATOM 454 CG LYS A 29 25.033 30.595 12.287 1.00 0.00 C ATOM 455 CD LYS A 29 23.616 30.644 12.866 1.00 0.00 C ATOM 456 CE LYS A 29 22.581 30.517 11.752 1.00 0.00 C ATOM 457 NZ LYS A 29 21.194 30.531 12.228 1.00 0.00 N ATOM 0 H LYS A 29 27.285 28.968 13.174 1.00 0.00 H new ATOM 0 HA LYS A 29 27.479 31.415 11.850 1.00 0.00 H new ATOM 0 HB2 LYS A 29 25.909 30.604 14.241 1.00 0.00 H new ATOM 0 HB3 LYS A 29 25.842 32.180 13.479 1.00 0.00 H new ATOM 0 HG2 LYS A 29 25.078 31.187 11.373 1.00 0.00 H new ATOM 0 HG3 LYS A 29 25.285 29.570 12.016 1.00 0.00 H new ATOM 0 HD2 LYS A 29 23.483 29.838 13.588 1.00 0.00 H new ATOM 0 HD3 LYS A 29 23.468 31.581 13.403 1.00 0.00 H new ATOM 0 HE2 LYS A 29 22.721 31.334 11.044 1.00 0.00 H new ATOM 0 HE3 LYS A 29 22.759 29.590 11.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 20.788 29.577 12.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 21.172 30.829 13.224 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 20.637 31.197 11.655 1.00 0.00 H new ATOM 471 N ILE A 30 29.178 31.085 14.587 1.00 0.00 N ATOM 472 CA ILE A 30 30.180 31.683 15.461 1.00 0.00 C ATOM 473 C ILE A 30 31.504 31.988 14.774 1.00 0.00 C ATOM 474 O ILE A 30 32.285 32.835 15.193 1.00 0.00 O ATOM 475 CB ILE A 30 30.425 30.868 16.727 1.00 0.00 C ATOM 476 CG1 ILE A 30 29.129 30.646 17.511 1.00 0.00 C ATOM 477 CG2 ILE A 30 31.471 31.477 17.669 1.00 0.00 C ATOM 478 CD1 ILE A 30 28.667 31.851 18.333 1.00 0.00 C ATOM 0 H ILE A 30 29.034 30.089 14.755 1.00 0.00 H new ATOM 0 HA ILE A 30 29.739 32.639 15.745 1.00 0.00 H new ATOM 0 HB ILE A 30 30.818 29.917 16.368 1.00 0.00 H new ATOM 0 HG12 ILE A 30 28.338 30.376 16.811 1.00 0.00 H new ATOM 0 HG13 ILE A 30 29.266 29.797 18.181 1.00 0.00 H new ATOM 0 HG21 ILE A 30 31.587 30.839 18.545 1.00 0.00 H new ATOM 0 HG22 ILE A 30 32.426 31.558 17.149 1.00 0.00 H new ATOM 0 HG23 ILE A 30 31.144 32.468 17.983 1.00 0.00 H new ATOM 0 HD11 ILE A 30 27.742 31.603 18.854 1.00 0.00 H new ATOM 0 HD12 ILE A 30 29.436 32.111 19.061 1.00 0.00 H new ATOM 0 HD13 ILE A 30 28.493 32.699 17.670 1.00 0.00 H new ATOM 490 N GLN A 31 31.791 31.419 13.602 1.00 0.00 N ATOM 491 CA GLN A 31 32.894 31.752 12.723 1.00 0.00 C ATOM 492 C GLN A 31 32.735 33.149 12.134 1.00 0.00 C ATOM 493 O GLN A 31 33.709 33.902 12.122 1.00 0.00 O ATOM 494 CB GLN A 31 32.731 30.719 11.608 1.00 0.00 C ATOM 495 CG GLN A 31 33.883 30.714 10.605 1.00 0.00 C ATOM 496 CD GLN A 31 35.137 30.008 11.117 1.00 0.00 C ATOM 497 OE1 GLN A 31 35.540 30.173 12.267 1.00 0.00 O ATOM 498 NE2 GLN A 31 35.901 29.304 10.285 1.00 0.00 N ATOM 0 H GLN A 31 31.217 30.665 13.224 1.00 0.00 H new ATOM 0 HA GLN A 31 33.859 31.741 13.229 1.00 0.00 H new ATOM 0 HB2 GLN A 31 32.643 29.728 12.053 1.00 0.00 H new ATOM 0 HB3 GLN A 31 31.799 30.914 11.077 1.00 0.00 H new ATOM 0 HG2 GLN A 31 33.552 30.228 9.687 1.00 0.00 H new ATOM 0 HG3 GLN A 31 34.135 31.743 10.348 1.00 0.00 H new ATOM 0 HE21 GLN A 31 35.598 29.147 9.324 1.00 0.00 H new ATOM 0 HE22 GLN A 31 36.789 28.921 10.609 1.00 0.00 H new ATOM 507 N ASP A 32 31.521 33.579 11.781 1.00 0.00 N ATOM 508 CA ASP A 32 31.197 34.947 11.435 1.00 0.00 C ATOM 509 C ASP A 32 31.363 35.866 12.648 1.00 0.00 C ATOM 510 O ASP A 32 31.965 36.939 12.515 1.00 0.00 O ATOM 511 CB ASP A 32 29.787 34.960 10.852 1.00 0.00 C ATOM 512 CG ASP A 32 29.382 36.373 10.442 1.00 0.00 C ATOM 513 OD1 ASP A 32 29.654 36.806 9.299 1.00 0.00 O ATOM 514 OD2 ASP A 32 28.569 37.048 11.103 1.00 0.00 O ATOM 0 H ASP A 32 30.716 32.955 11.729 1.00 0.00 H new ATOM 0 HA ASP A 32 31.883 35.336 10.683 1.00 0.00 H new ATOM 0 HB2 ASP A 32 29.740 34.298 9.987 1.00 0.00 H new ATOM 0 HB3 ASP A 32 29.081 34.574 11.587 1.00 0.00 H new ATOM 519 N LYS A 33 30.825 35.484 13.805 1.00 0.00 N ATOM 520 CA LYS A 33 30.877 36.354 14.958 1.00 0.00 C ATOM 521 C LYS A 33 32.250 36.453 15.614 1.00 0.00 C ATOM 522 O LYS A 33 32.887 37.469 15.358 1.00 0.00 O ATOM 523 CB LYS A 33 29.879 35.971 16.052 1.00 0.00 C ATOM 524 CG LYS A 33 28.501 36.636 15.952 1.00 0.00 C ATOM 525 CD LYS A 33 27.585 36.276 14.783 1.00 0.00 C ATOM 526 CE LYS A 33 26.332 37.146 14.666 1.00 0.00 C ATOM 527 NZ LYS A 33 25.298 36.339 14.001 1.00 0.00 N ATOM 0 H LYS A 33 30.357 34.591 13.959 1.00 0.00 H new ATOM 0 HA LYS A 33 30.616 37.322 14.530 1.00 0.00 H new ATOM 0 HB2 LYS A 33 29.743 34.890 16.033 1.00 0.00 H new ATOM 0 HB3 LYS A 33 30.314 36.221 17.020 1.00 0.00 H new ATOM 0 HG2 LYS A 33 27.961 36.414 16.873 1.00 0.00 H new ATOM 0 HG3 LYS A 33 28.658 37.714 15.927 1.00 0.00 H new ATOM 0 HD2 LYS A 33 28.153 36.353 13.856 1.00 0.00 H new ATOM 0 HD3 LYS A 33 27.280 35.234 14.884 1.00 0.00 H new ATOM 0 HE2 LYS A 33 25.994 37.467 15.651 1.00 0.00 H new ATOM 0 HE3 LYS A 33 26.543 38.048 14.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 24.428 36.901 13.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 25.633 36.054 13.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 25.101 35.491 14.569 1.00 0.00 H new ATOM 541 N GLU A 34 32.633 35.409 16.348 1.00 0.00 N ATOM 542 CA GLU A 34 33.683 35.376 17.349 1.00 0.00 C ATOM 543 C GLU A 34 35.002 34.759 16.887 1.00 0.00 C ATOM 544 O GLU A 34 36.080 35.167 17.310 1.00 0.00 O ATOM 545 CB GLU A 34 33.224 34.488 18.509 1.00 0.00 C ATOM 546 CG GLU A 34 31.944 34.966 19.188 1.00 0.00 C ATOM 547 CD GLU A 34 32.094 36.191 20.080 1.00 0.00 C ATOM 548 OE1 GLU A 34 33.172 36.420 20.665 1.00 0.00 O ATOM 549 OE2 GLU A 34 31.136 36.998 20.114 1.00 0.00 O ATOM 0 H GLU A 34 32.180 34.501 16.246 1.00 0.00 H new ATOM 0 HA GLU A 34 33.857 36.421 17.604 1.00 0.00 H new ATOM 0 HB2 GLU A 34 33.070 33.475 18.138 1.00 0.00 H new ATOM 0 HB3 GLU A 34 34.020 34.438 19.252 1.00 0.00 H new ATOM 0 HG2 GLU A 34 31.205 35.187 18.418 1.00 0.00 H new ATOM 0 HG3 GLU A 34 31.544 34.148 19.787 1.00 0.00 H new ATOM 556 N GLY A 35 34.919 33.973 15.819 1.00 0.00 N ATOM 557 CA GLY A 35 35.958 33.497 14.915 1.00 0.00 C ATOM 558 C GLY A 35 36.247 31.994 15.013 1.00 0.00 C ATOM 559 O GLY A 35 37.193 31.548 14.362 1.00 0.00 O ATOM 0 H GLY A 35 34.009 33.611 15.533 1.00 0.00 H new ATOM 0 HA2 GLY A 35 35.667 33.732 13.891 1.00 0.00 H new ATOM 0 HA3 GLY A 35 36.878 34.045 15.119 1.00 0.00 H new ATOM 563 N ILE A 36 35.432 31.305 15.804 1.00 0.00 N ATOM 564 CA ILE A 36 35.684 29.972 16.310 1.00 0.00 C ATOM 565 C ILE A 36 34.971 29.017 15.347 1.00 0.00 C ATOM 566 O ILE A 36 33.747 29.069 15.313 1.00 0.00 O ATOM 567 CB ILE A 36 35.185 29.717 17.724 1.00 0.00 C ATOM 568 CG1 ILE A 36 35.759 30.812 18.634 1.00 0.00 C ATOM 569 CG2 ILE A 36 35.579 28.344 18.260 1.00 0.00 C ATOM 570 CD1 ILE A 36 35.343 30.894 20.094 1.00 0.00 C ATOM 0 H ILE A 36 34.539 31.683 16.121 1.00 0.00 H new ATOM 0 HA ILE A 36 36.763 29.827 16.364 1.00 0.00 H new ATOM 0 HB ILE A 36 34.095 29.739 17.708 1.00 0.00 H new ATOM 0 HG12 ILE A 36 36.844 30.712 18.613 1.00 0.00 H new ATOM 0 HG13 ILE A 36 35.518 31.771 18.176 1.00 0.00 H new ATOM 0 HG21 ILE A 36 35.193 28.224 19.272 1.00 0.00 H new ATOM 0 HG22 ILE A 36 35.160 27.569 17.618 1.00 0.00 H new ATOM 0 HG23 ILE A 36 36.665 28.257 18.273 1.00 0.00 H new ATOM 0 HD11 ILE A 36 35.853 31.731 20.571 1.00 0.00 H new ATOM 0 HD12 ILE A 36 34.265 31.043 20.157 1.00 0.00 H new ATOM 0 HD13 ILE A 36 35.612 29.968 20.602 1.00 0.00 H new ATOM 582 N PRO A 37 35.612 28.032 14.722 1.00 0.00 N ATOM 583 CA PRO A 37 35.031 27.076 13.798 1.00 0.00 C ATOM 584 C PRO A 37 34.049 26.068 14.399 1.00 0.00 C ATOM 585 O PRO A 37 34.010 26.004 15.627 1.00 0.00 O ATOM 586 CB PRO A 37 36.225 26.349 13.170 1.00 0.00 C ATOM 587 CG PRO A 37 37.422 26.590 14.084 1.00 0.00 C ATOM 588 CD PRO A 37 37.030 27.806 14.923 1.00 0.00 C ATOM 0 HA PRO A 37 34.412 27.621 13.085 1.00 0.00 H new ATOM 0 HB2 PRO A 37 36.021 25.283 13.074 1.00 0.00 H new ATOM 0 HB3 PRO A 37 36.423 26.727 12.167 1.00 0.00 H new ATOM 0 HG2 PRO A 37 37.621 25.722 14.713 1.00 0.00 H new ATOM 0 HG3 PRO A 37 38.328 26.781 13.508 1.00 0.00 H new ATOM 0 HD2 PRO A 37 37.245 27.631 15.977 1.00 0.00 H new ATOM 0 HD3 PRO A 37 37.605 28.682 14.622 1.00 0.00 H new ATOM 596 N PRO A 38 33.321 25.213 13.685 1.00 0.00 N ATOM 597 CA PRO A 38 32.414 24.196 14.197 1.00 0.00 C ATOM 598 C PRO A 38 33.266 23.039 14.726 1.00 0.00 C ATOM 599 O PRO A 38 32.751 22.472 15.694 1.00 0.00 O ATOM 600 CB PRO A 38 31.576 23.684 13.030 1.00 0.00 C ATOM 601 CG PRO A 38 32.483 23.926 11.825 1.00 0.00 C ATOM 602 CD PRO A 38 33.302 25.150 12.237 1.00 0.00 C ATOM 0 HA PRO A 38 31.773 24.596 14.982 1.00 0.00 H new ATOM 0 HB2 PRO A 38 31.328 22.629 13.143 1.00 0.00 H new ATOM 0 HB3 PRO A 38 30.634 24.225 12.941 1.00 0.00 H new ATOM 0 HG2 PRO A 38 33.121 23.065 11.623 1.00 0.00 H new ATOM 0 HG3 PRO A 38 31.906 24.115 10.920 1.00 0.00 H new ATOM 0 HD2 PRO A 38 34.317 25.078 11.846 1.00 0.00 H new ATOM 0 HD3 PRO A 38 32.864 26.058 11.822 1.00 0.00 H new ATOM 610 N ASP A 39 34.327 22.569 14.091 1.00 0.00 N ATOM 611 CA ASP A 39 35.177 21.432 14.383 1.00 0.00 C ATOM 612 C ASP A 39 36.089 21.573 15.603 1.00 0.00 C ATOM 613 O ASP A 39 36.738 20.639 16.068 1.00 0.00 O ATOM 614 CB ASP A 39 36.014 21.206 13.134 1.00 0.00 C ATOM 615 CG ASP A 39 37.090 20.130 13.093 1.00 0.00 C ATOM 616 OD1 ASP A 39 36.662 18.974 13.304 1.00 0.00 O ATOM 617 OD2 ASP A 39 38.319 20.383 13.130 1.00 0.00 O ATOM 0 H ASP A 39 34.652 23.041 13.247 1.00 0.00 H new ATOM 0 HA ASP A 39 34.531 20.593 14.643 1.00 0.00 H new ATOM 0 HB2 ASP A 39 35.321 20.995 12.320 1.00 0.00 H new ATOM 0 HB3 ASP A 39 36.501 22.153 12.901 1.00 0.00 H new ATOM 622 N GLN A 40 36.245 22.814 16.075 1.00 0.00 N ATOM 623 CA GLN A 40 36.944 22.983 17.334 1.00 0.00 C ATOM 624 C GLN A 40 36.024 23.274 18.518 1.00 0.00 C ATOM 625 O GLN A 40 36.182 22.727 19.610 1.00 0.00 O ATOM 626 CB GLN A 40 37.786 24.254 17.293 1.00 0.00 C ATOM 627 CG GLN A 40 38.872 24.232 18.365 1.00 0.00 C ATOM 628 CD GLN A 40 39.640 25.548 18.367 1.00 0.00 C ATOM 629 OE1 GLN A 40 39.099 26.641 18.441 1.00 0.00 O ATOM 630 NE2 GLN A 40 40.966 25.485 18.238 1.00 0.00 N ATOM 0 H GLN A 40 35.914 23.669 15.627 1.00 0.00 H new ATOM 0 HA GLN A 40 37.492 22.049 17.458 1.00 0.00 H new ATOM 0 HB2 GLN A 40 38.244 24.358 16.310 1.00 0.00 H new ATOM 0 HB3 GLN A 40 37.145 25.123 17.439 1.00 0.00 H new ATOM 0 HG2 GLN A 40 38.423 24.064 19.344 1.00 0.00 H new ATOM 0 HG3 GLN A 40 39.557 23.404 18.182 1.00 0.00 H new ATOM 0 HE21 GLN A 40 41.430 24.579 18.175 1.00 0.00 H new ATOM 0 HE22 GLN A 40 41.516 26.343 18.202 1.00 0.00 H new ATOM 639 N GLN A 41 34.954 24.010 18.226 1.00 0.00 N ATOM 640 CA GLN A 41 33.820 24.239 19.099 1.00 0.00 C ATOM 641 C GLN A 41 33.208 22.984 19.718 1.00 0.00 C ATOM 642 O GLN A 41 32.744 22.127 18.964 1.00 0.00 O ATOM 643 CB GLN A 41 32.844 25.117 18.307 1.00 0.00 C ATOM 644 CG GLN A 41 31.531 25.617 18.931 1.00 0.00 C ATOM 645 CD GLN A 41 30.768 26.505 17.967 1.00 0.00 C ATOM 646 OE1 GLN A 41 29.582 26.686 18.213 1.00 0.00 O ATOM 647 NE2 GLN A 41 31.395 27.050 16.919 1.00 0.00 N ATOM 0 H GLN A 41 34.856 24.484 17.328 1.00 0.00 H new ATOM 0 HA GLN A 41 34.143 24.755 20.003 1.00 0.00 H new ATOM 0 HB2 GLN A 41 33.399 25.999 17.986 1.00 0.00 H new ATOM 0 HB3 GLN A 41 32.577 24.563 17.407 1.00 0.00 H new ATOM 0 HG2 GLN A 41 30.912 24.765 19.213 1.00 0.00 H new ATOM 0 HG3 GLN A 41 31.747 26.170 19.845 1.00 0.00 H new ATOM 0 HE21 GLN A 41 32.386 26.864 16.764 1.00 0.00 H new ATOM 0 HE22 GLN A 41 30.882 27.652 16.275 1.00 0.00 H new ATOM 656 N ARG A 42 32.890 22.952 21.009 1.00 0.00 N ATOM 657 CA ARG A 42 32.095 21.894 21.583 1.00 0.00 C ATOM 658 C ARG A 42 31.073 22.535 22.513 1.00 0.00 C ATOM 659 O ARG A 42 31.285 23.652 22.992 1.00 0.00 O ATOM 660 CB ARG A 42 33.051 20.993 22.373 1.00 0.00 C ATOM 661 CG ARG A 42 34.189 20.347 21.584 1.00 0.00 C ATOM 662 CD ARG A 42 33.742 19.270 20.585 1.00 0.00 C ATOM 663 NE ARG A 42 33.021 18.199 21.273 1.00 0.00 N ATOM 664 CZ ARG A 42 32.509 17.056 20.786 1.00 0.00 C ATOM 665 NH1 ARG A 42 32.271 16.828 19.489 1.00 0.00 N ATOM 666 NH2 ARG A 42 32.321 16.076 21.670 1.00 0.00 N ATOM 0 H ARG A 42 33.181 23.664 21.679 1.00 0.00 H new ATOM 0 HA ARG A 42 31.573 21.307 20.828 1.00 0.00 H new ATOM 0 HB2 ARG A 42 33.487 21.583 23.179 1.00 0.00 H new ATOM 0 HB3 ARG A 42 32.466 20.200 22.838 1.00 0.00 H new ATOM 0 HG2 ARG A 42 34.726 21.126 21.043 1.00 0.00 H new ATOM 0 HG3 ARG A 42 34.894 19.903 22.286 1.00 0.00 H new ATOM 0 HD2 ARG A 42 33.102 19.716 19.823 1.00 0.00 H new ATOM 0 HD3 ARG A 42 34.611 18.859 20.071 1.00 0.00 H new ATOM 0 HE ARG A 42 32.887 18.341 22.274 1.00 0.00 H new ATOM 0 HH11 ARG A 42 32.481 17.548 18.798 1.00 0.00 H new ATOM 0 HH12 ARG A 42 31.880 15.934 19.192 1.00 0.00 H new ATOM 0 HH21 ARG A 42 32.563 16.220 22.650 1.00 0.00 H new ATOM 0 HH22 ARG A 42 31.935 15.182 21.366 1.00 0.00 H new ATOM 680 N LEU A 43 30.026 21.739 22.726 1.00 0.00 N ATOM 681 CA LEU A 43 28.849 22.297 23.359 1.00 0.00 C ATOM 682 C LEU A 43 28.437 21.395 24.526 1.00 0.00 C ATOM 683 O LEU A 43 28.710 20.198 24.569 1.00 0.00 O ATOM 684 CB LEU A 43 27.708 22.286 22.332 1.00 0.00 C ATOM 685 CG LEU A 43 27.836 23.309 21.207 1.00 0.00 C ATOM 686 CD1 LEU A 43 26.804 23.082 20.105 1.00 0.00 C ATOM 687 CD2 LEU A 43 27.727 24.752 21.705 1.00 0.00 C ATOM 0 H LEU A 43 29.973 20.751 22.480 1.00 0.00 H new ATOM 0 HA LEU A 43 29.054 23.307 23.713 1.00 0.00 H new ATOM 0 HB2 LEU A 43 27.647 21.291 21.891 1.00 0.00 H new ATOM 0 HB3 LEU A 43 26.768 22.461 22.855 1.00 0.00 H new ATOM 0 HG LEU A 43 28.835 23.160 20.797 1.00 0.00 H new ATOM 0 HD11 LEU A 43 26.933 23.833 19.326 1.00 0.00 H new ATOM 0 HD12 LEU A 43 26.941 22.089 19.678 1.00 0.00 H new ATOM 0 HD13 LEU A 43 25.801 23.162 20.524 1.00 0.00 H new ATOM 0 HD21 LEU A 43 27.825 25.436 20.862 1.00 0.00 H new ATOM 0 HD22 LEU A 43 26.758 24.900 22.182 1.00 0.00 H new ATOM 0 HD23 LEU A 43 28.520 24.949 22.426 1.00 0.00 H new ATOM 699 N ILE A 44 27.795 22.035 25.504 1.00 0.00 N ATOM 700 CA ILE A 44 27.104 21.460 26.632 1.00 0.00 C ATOM 701 C ILE A 44 25.777 22.212 26.780 1.00 0.00 C ATOM 702 O ILE A 44 25.725 23.427 26.881 1.00 0.00 O ATOM 703 CB ILE A 44 27.939 21.506 27.912 1.00 0.00 C ATOM 704 CG1 ILE A 44 29.431 21.199 27.766 1.00 0.00 C ATOM 705 CG2 ILE A 44 27.291 20.605 28.958 1.00 0.00 C ATOM 706 CD1 ILE A 44 30.256 21.355 29.047 1.00 0.00 C ATOM 0 H ILE A 44 27.748 23.054 25.518 1.00 0.00 H new ATOM 0 HA ILE A 44 26.920 20.400 26.457 1.00 0.00 H new ATOM 0 HB ILE A 44 27.934 22.550 28.226 1.00 0.00 H new ATOM 0 HG12 ILE A 44 29.542 20.177 27.403 1.00 0.00 H new ATOM 0 HG13 ILE A 44 29.848 21.855 27.002 1.00 0.00 H new ATOM 0 HG21 ILE A 44 27.879 20.631 29.875 1.00 0.00 H new ATOM 0 HG22 ILE A 44 26.280 20.957 29.165 1.00 0.00 H new ATOM 0 HG23 ILE A 44 27.250 19.583 28.582 1.00 0.00 H new ATOM 0 HD11 ILE A 44 31.299 21.115 28.840 1.00 0.00 H new ATOM 0 HD12 ILE A 44 30.184 22.383 29.403 1.00 0.00 H new ATOM 0 HD13 ILE A 44 29.873 20.678 29.811 1.00 0.00 H new ATOM 718 N PHE A 45 24.683 21.461 26.876 1.00 0.00 N ATOM 719 CA PHE A 45 23.309 21.834 27.153 1.00 0.00 C ATOM 720 C PHE A 45 22.933 21.076 28.428 1.00 0.00 C ATOM 721 O PHE A 45 22.798 19.850 28.341 1.00 0.00 O ATOM 722 CB PHE A 45 22.359 21.591 25.981 1.00 0.00 C ATOM 723 CG PHE A 45 20.885 21.827 26.215 1.00 0.00 C ATOM 724 CD1 PHE A 45 20.459 22.992 26.859 1.00 0.00 C ATOM 725 CD2 PHE A 45 19.951 20.898 25.764 1.00 0.00 C ATOM 726 CE1 PHE A 45 19.084 23.267 26.935 1.00 0.00 C ATOM 727 CE2 PHE A 45 18.588 21.222 25.798 1.00 0.00 C ATOM 728 CZ PHE A 45 18.136 22.444 26.326 1.00 0.00 C ATOM 0 H PHE A 45 24.755 20.452 26.744 1.00 0.00 H new ATOM 0 HA PHE A 45 23.215 22.910 27.300 1.00 0.00 H new ATOM 0 HB2 PHE A 45 22.674 22.229 25.155 1.00 0.00 H new ATOM 0 HB3 PHE A 45 22.486 20.559 25.654 1.00 0.00 H new ATOM 0 HD1 PHE A 45 21.178 23.672 27.292 1.00 0.00 H new ATOM 0 HD2 PHE A 45 20.274 19.937 25.392 1.00 0.00 H new ATOM 0 HE1 PHE A 45 18.751 24.139 27.479 1.00 0.00 H new ATOM 0 HE2 PHE A 45 17.868 20.517 25.410 1.00 0.00 H new ATOM 0 HZ PHE A 45 17.098 22.734 26.263 1.00 0.00 H new ATOM 738 N ALA A 46 22.592 21.734 29.533 1.00 0.00 N ATOM 739 CA ALA A 46 22.038 21.329 30.815 1.00 0.00 C ATOM 740 C ALA A 46 22.759 20.099 31.377 1.00 0.00 C ATOM 741 O ALA A 46 22.137 19.127 31.773 1.00 0.00 O ATOM 742 CB ALA A 46 20.538 21.092 30.626 1.00 0.00 C ATOM 0 H ALA A 46 22.726 22.745 29.542 1.00 0.00 H new ATOM 0 HA ALA A 46 22.187 22.116 31.555 1.00 0.00 H new ATOM 0 HB1 ALA A 46 20.096 20.786 31.574 1.00 0.00 H new ATOM 0 HB2 ALA A 46 20.064 22.012 30.285 1.00 0.00 H new ATOM 0 HB3 ALA A 46 20.384 20.308 29.884 1.00 0.00 H new ATOM 748 N GLY A 47 24.088 20.181 31.411 1.00 0.00 N ATOM 749 CA GLY A 47 24.910 19.170 32.039 1.00 0.00 C ATOM 750 C GLY A 47 25.274 18.051 31.059 1.00 0.00 C ATOM 751 O GLY A 47 26.294 17.393 31.263 1.00 0.00 O ATOM 0 H GLY A 47 24.616 20.952 31.002 1.00 0.00 H new ATOM 0 HA2 GLY A 47 25.821 19.628 32.424 1.00 0.00 H new ATOM 0 HA3 GLY A 47 24.380 18.748 32.893 1.00 0.00 H new ATOM 755 N LYS A 48 24.598 17.985 29.917 1.00 0.00 N ATOM 756 CA LYS A 48 24.604 16.989 28.866 1.00 0.00 C ATOM 757 C LYS A 48 25.362 17.545 27.653 1.00 0.00 C ATOM 758 O LYS A 48 25.041 18.591 27.090 1.00 0.00 O ATOM 759 CB LYS A 48 23.161 16.643 28.511 1.00 0.00 C ATOM 760 CG LYS A 48 22.385 15.913 29.602 1.00 0.00 C ATOM 761 CD LYS A 48 20.874 16.005 29.376 1.00 0.00 C ATOM 762 CE LYS A 48 20.419 17.457 29.513 1.00 0.00 C ATOM 763 NZ LYS A 48 19.047 17.621 28.983 1.00 0.00 N ATOM 0 H LYS A 48 23.947 18.734 29.682 1.00 0.00 H new ATOM 0 HA LYS A 48 25.108 16.080 29.194 1.00 0.00 H new ATOM 0 HB2 LYS A 48 22.633 17.564 28.265 1.00 0.00 H new ATOM 0 HB3 LYS A 48 23.162 16.026 27.612 1.00 0.00 H new ATOM 0 HG2 LYS A 48 22.687 14.866 29.626 1.00 0.00 H new ATOM 0 HG3 LYS A 48 22.635 16.339 30.574 1.00 0.00 H new ATOM 0 HD2 LYS A 48 20.621 15.627 28.385 1.00 0.00 H new ATOM 0 HD3 LYS A 48 20.350 15.380 30.099 1.00 0.00 H new ATOM 0 HE2 LYS A 48 20.449 17.757 30.561 1.00 0.00 H new ATOM 0 HE3 LYS A 48 21.104 18.112 28.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 18.752 18.613 29.083 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 19.029 17.354 27.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 18.394 17.011 29.515 1.00 0.00 H new ATOM 777 N GLN A 49 26.444 16.893 27.237 1.00 0.00 N ATOM 778 CA GLN A 49 27.229 17.120 26.045 1.00 0.00 C ATOM 779 C GLN A 49 26.390 16.520 24.911 1.00 0.00 C ATOM 780 O GLN A 49 25.655 15.554 25.057 1.00 0.00 O ATOM 781 CB GLN A 49 28.615 16.485 26.234 1.00 0.00 C ATOM 782 CG GLN A 49 29.233 16.725 27.610 1.00 0.00 C ATOM 783 CD GLN A 49 30.679 16.258 27.682 1.00 0.00 C ATOM 784 OE1 GLN A 49 30.967 15.221 27.070 1.00 0.00 O ATOM 785 NE2 GLN A 49 31.511 17.051 28.346 1.00 0.00 N ATOM 0 H GLN A 49 26.823 16.120 27.784 1.00 0.00 H new ATOM 0 HA GLN A 49 27.434 18.166 25.819 1.00 0.00 H new ATOM 0 HB2 GLN A 49 28.536 15.411 26.066 1.00 0.00 H new ATOM 0 HB3 GLN A 49 29.289 16.878 25.472 1.00 0.00 H new ATOM 0 HG2 GLN A 49 29.184 17.788 27.847 1.00 0.00 H new ATOM 0 HG3 GLN A 49 28.646 16.202 28.366 1.00 0.00 H new ATOM 0 HE21 GLN A 49 31.156 17.884 28.815 1.00 0.00 H new ATOM 0 HE22 GLN A 49 32.505 16.827 28.387 1.00 0.00 H new ATOM 794 N LEU A 50 26.569 17.079 23.720 1.00 0.00 N ATOM 795 CA LEU A 50 25.968 16.719 22.451 1.00 0.00 C ATOM 796 C LEU A 50 26.986 16.817 21.311 1.00 0.00 C ATOM 797 O LEU A 50 27.778 17.755 21.223 1.00 0.00 O ATOM 798 CB LEU A 50 24.613 17.423 22.306 1.00 0.00 C ATOM 799 CG LEU A 50 24.547 18.950 22.297 1.00 0.00 C ATOM 800 CD1 LEU A 50 23.091 19.413 22.196 1.00 0.00 C ATOM 801 CD2 LEU A 50 25.347 19.720 23.338 1.00 0.00 C ATOM 0 H LEU A 50 27.201 17.872 23.614 1.00 0.00 H new ATOM 0 HA LEU A 50 25.700 15.664 22.401 1.00 0.00 H new ATOM 0 HB2 LEU A 50 24.162 17.073 21.377 1.00 0.00 H new ATOM 0 HB3 LEU A 50 23.977 17.075 23.120 1.00 0.00 H new ATOM 0 HG LEU A 50 25.098 19.225 21.398 1.00 0.00 H new ATOM 0 HD11 LEU A 50 23.055 20.502 22.190 1.00 0.00 H new ATOM 0 HD12 LEU A 50 22.651 19.031 21.275 1.00 0.00 H new ATOM 0 HD13 LEU A 50 22.529 19.036 23.051 1.00 0.00 H new ATOM 0 HD21 LEU A 50 25.193 20.790 23.197 1.00 0.00 H new ATOM 0 HD22 LEU A 50 25.015 19.434 24.336 1.00 0.00 H new ATOM 0 HD23 LEU A 50 26.406 19.488 23.228 1.00 0.00 H new ATOM 813 N GLU A 51 27.036 15.774 20.485 1.00 0.00 N ATOM 814 CA GLU A 51 27.810 15.735 19.256 1.00 0.00 C ATOM 815 C GLU A 51 26.986 16.296 18.098 1.00 0.00 C ATOM 816 O GLU A 51 25.770 16.485 18.119 1.00 0.00 O ATOM 817 CB GLU A 51 28.013 14.247 18.945 1.00 0.00 C ATOM 818 CG GLU A 51 28.978 13.523 19.892 1.00 0.00 C ATOM 819 CD GLU A 51 30.367 14.128 20.042 1.00 0.00 C ATOM 820 OE1 GLU A 51 31.017 14.664 19.115 1.00 0.00 O ATOM 821 OE2 GLU A 51 31.039 13.849 21.057 1.00 0.00 O ATOM 0 H GLU A 51 26.523 14.910 20.662 1.00 0.00 H new ATOM 0 HA GLU A 51 28.734 16.302 19.369 1.00 0.00 H new ATOM 0 HB2 GLU A 51 27.045 13.746 18.981 1.00 0.00 H new ATOM 0 HB3 GLU A 51 28.384 14.150 17.925 1.00 0.00 H new ATOM 0 HG2 GLU A 51 28.517 13.478 20.879 1.00 0.00 H new ATOM 0 HG3 GLU A 51 29.089 12.496 19.545 1.00 0.00 H new ATOM 828 N ASP A 52 27.641 16.668 16.998 1.00 0.00 N ATOM 829 CA ASP A 52 27.249 17.127 15.680 1.00 0.00 C ATOM 830 C ASP A 52 26.522 15.999 14.957 1.00 0.00 C ATOM 831 O ASP A 52 26.804 14.849 15.302 1.00 0.00 O ATOM 832 CB ASP A 52 28.557 17.426 14.947 1.00 0.00 C ATOM 833 CG ASP A 52 29.350 18.600 15.512 1.00 0.00 C ATOM 834 OD1 ASP A 52 29.890 18.414 16.626 1.00 0.00 O ATOM 835 OD2 ASP A 52 29.447 19.613 14.795 1.00 0.00 O ATOM 0 H ASP A 52 28.660 16.644 17.034 1.00 0.00 H new ATOM 0 HA ASP A 52 26.593 17.997 15.725 1.00 0.00 H new ATOM 0 HB2 ASP A 52 29.184 16.535 14.973 1.00 0.00 H new ATOM 0 HB3 ASP A 52 28.333 17.627 13.899 1.00 0.00 H new ATOM 840 N GLY A 53 25.762 16.253 13.901 1.00 0.00 N ATOM 841 CA GLY A 53 25.156 15.213 13.093 1.00 0.00 C ATOM 842 C GLY A 53 23.680 14.860 13.294 1.00 0.00 C ATOM 843 O GLY A 53 23.285 13.730 13.042 1.00 0.00 O ATOM 0 H GLY A 53 25.549 17.198 13.581 1.00 0.00 H new ATOM 0 HA2 GLY A 53 25.284 15.496 12.048 1.00 0.00 H new ATOM 0 HA3 GLY A 53 25.733 14.302 13.249 1.00 0.00 H new ATOM 847 N ARG A 54 22.950 15.730 13.997 1.00 0.00 N ATOM 848 CA ARG A 54 21.534 15.644 14.283 1.00 0.00 C ATOM 849 C ARG A 54 20.932 17.013 14.611 1.00 0.00 C ATOM 850 O ARG A 54 21.694 17.939 14.909 1.00 0.00 O ATOM 851 CB ARG A 54 21.289 14.604 15.376 1.00 0.00 C ATOM 852 CG ARG A 54 19.937 14.281 16.011 1.00 0.00 C ATOM 853 CD ARG A 54 18.939 13.589 15.093 1.00 0.00 C ATOM 854 NE ARG A 54 19.307 12.227 14.708 1.00 0.00 N ATOM 855 CZ ARG A 54 19.158 11.644 13.510 1.00 0.00 C ATOM 856 NH1 ARG A 54 18.529 12.230 12.483 1.00 0.00 N ATOM 857 NH2 ARG A 54 19.422 10.352 13.270 1.00 0.00 N ATOM 0 H ARG A 54 23.370 16.565 14.404 1.00 0.00 H new ATOM 0 HA ARG A 54 21.013 15.309 13.386 1.00 0.00 H new ATOM 0 HB2 ARG A 54 21.661 13.661 14.976 1.00 0.00 H new ATOM 0 HB3 ARG A 54 21.945 14.881 16.201 1.00 0.00 H new ATOM 0 HG2 ARG A 54 20.105 13.648 16.882 1.00 0.00 H new ATOM 0 HG3 ARG A 54 19.492 15.208 16.372 1.00 0.00 H new ATOM 0 HD2 ARG A 54 17.968 13.563 15.588 1.00 0.00 H new ATOM 0 HD3 ARG A 54 18.820 14.188 14.190 1.00 0.00 H new ATOM 0 HE ARG A 54 19.727 11.652 15.438 1.00 0.00 H new ATOM 0 HH11 ARG A 54 18.136 13.165 12.592 1.00 0.00 H new ATOM 0 HH12 ARG A 54 18.443 11.742 11.592 1.00 0.00 H new ATOM 0 HH21 ARG A 54 19.757 9.752 14.023 1.00 0.00 H new ATOM 0 HH22 ARG A 54 19.287 9.969 12.334 1.00 0.00 H new ATOM 871 N THR A 55 19.604 17.081 14.558 1.00 0.00 N ATOM 872 CA THR A 55 18.721 18.217 14.673 1.00 0.00 C ATOM 873 C THR A 55 18.448 18.470 16.157 1.00 0.00 C ATOM 874 O THR A 55 18.542 17.570 16.985 1.00 0.00 O ATOM 875 CB THR A 55 17.471 18.024 13.803 1.00 0.00 C ATOM 876 OG1 THR A 55 16.686 16.908 14.156 1.00 0.00 O ATOM 877 CG2 THR A 55 17.889 18.002 12.334 1.00 0.00 C ATOM 0 H THR A 55 19.064 16.228 14.415 1.00 0.00 H new ATOM 0 HA THR A 55 19.183 19.123 14.281 1.00 0.00 H new ATOM 0 HB THR A 55 16.810 18.872 13.983 1.00 0.00 H new ATOM 0 HG1 THR A 55 15.909 17.205 14.674 1.00 0.00 H new ATOM 0 HG21 THR A 55 17.008 17.865 11.707 1.00 0.00 H new ATOM 0 HG22 THR A 55 18.373 18.945 12.079 1.00 0.00 H new ATOM 0 HG23 THR A 55 18.585 17.180 12.166 1.00 0.00 H new ATOM 885 N LEU A 56 18.227 19.752 16.458 1.00 0.00 N ATOM 886 CA LEU A 56 18.120 20.295 17.794 1.00 0.00 C ATOM 887 C LEU A 56 16.885 19.718 18.483 1.00 0.00 C ATOM 888 O LEU A 56 16.854 19.503 19.696 1.00 0.00 O ATOM 889 CB LEU A 56 18.110 21.828 17.764 1.00 0.00 C ATOM 890 CG LEU A 56 19.226 22.557 17.023 1.00 0.00 C ATOM 891 CD1 LEU A 56 18.776 24.002 16.818 1.00 0.00 C ATOM 892 CD2 LEU A 56 20.536 22.354 17.783 1.00 0.00 C ATOM 0 H LEU A 56 18.114 20.464 15.736 1.00 0.00 H new ATOM 0 HA LEU A 56 18.995 20.004 18.375 1.00 0.00 H new ATOM 0 HB2 LEU A 56 17.163 22.143 17.326 1.00 0.00 H new ATOM 0 HB3 LEU A 56 18.116 22.178 18.796 1.00 0.00 H new ATOM 0 HG LEU A 56 19.425 22.163 16.026 1.00 0.00 H new ATOM 0 HD11 LEU A 56 19.553 24.554 16.289 1.00 0.00 H new ATOM 0 HD12 LEU A 56 17.857 24.017 16.232 1.00 0.00 H new ATOM 0 HD13 LEU A 56 18.596 24.468 17.787 1.00 0.00 H new ATOM 0 HD21 LEU A 56 21.342 22.871 17.263 1.00 0.00 H new ATOM 0 HD22 LEU A 56 20.438 22.757 18.791 1.00 0.00 H new ATOM 0 HD23 LEU A 56 20.764 21.289 17.838 1.00 0.00 H new ATOM 904 N SER A 57 15.804 19.476 17.742 1.00 0.00 N ATOM 905 CA SER A 57 14.525 18.848 18.004 1.00 0.00 C ATOM 906 C SER A 57 14.607 17.654 18.959 1.00 0.00 C ATOM 907 O SER A 57 14.008 17.631 20.038 1.00 0.00 O ATOM 908 CB SER A 57 13.730 18.644 16.709 1.00 0.00 C ATOM 909 OG SER A 57 14.330 17.892 15.674 1.00 0.00 O ATOM 0 H SER A 57 15.823 19.777 16.768 1.00 0.00 H new ATOM 0 HA SER A 57 13.920 19.543 18.586 1.00 0.00 H new ATOM 0 HB2 SER A 57 12.787 18.162 16.968 1.00 0.00 H new ATOM 0 HB3 SER A 57 13.486 19.628 16.309 1.00 0.00 H new ATOM 0 HG SER A 57 13.717 17.839 14.911 1.00 0.00 H new ATOM 915 N ASP A 58 15.447 16.746 18.489 1.00 0.00 N ATOM 916 CA ASP A 58 15.815 15.448 19.003 1.00 0.00 C ATOM 917 C ASP A 58 16.610 15.441 20.304 1.00 0.00 C ATOM 918 O ASP A 58 16.453 14.563 21.154 1.00 0.00 O ATOM 919 CB ASP A 58 16.655 14.704 17.957 1.00 0.00 C ATOM 920 CG ASP A 58 16.833 13.212 18.222 1.00 0.00 C ATOM 921 OD1 ASP A 58 15.794 12.538 18.075 1.00 0.00 O ATOM 922 OD2 ASP A 58 17.931 12.837 18.682 1.00 0.00 O ATOM 0 H ASP A 58 15.950 16.934 17.622 1.00 0.00 H new ATOM 0 HA ASP A 58 14.861 14.968 19.219 1.00 0.00 H new ATOM 0 HB2 ASP A 58 16.189 14.832 16.980 1.00 0.00 H new ATOM 0 HB3 ASP A 58 17.639 15.169 17.904 1.00 0.00 H new ATOM 927 N TYR A 59 17.330 16.553 20.476 1.00 0.00 N ATOM 928 CA TYR A 59 18.188 16.881 21.595 1.00 0.00 C ATOM 929 C TYR A 59 17.488 17.847 22.553 1.00 0.00 C ATOM 930 O TYR A 59 18.119 18.209 23.556 1.00 0.00 O ATOM 931 CB TYR A 59 19.484 17.490 21.083 1.00 0.00 C ATOM 932 CG TYR A 59 20.554 16.445 20.827 1.00 0.00 C ATOM 933 CD1 TYR A 59 21.248 15.945 21.937 1.00 0.00 C ATOM 934 CD2 TYR A 59 20.734 15.867 19.566 1.00 0.00 C ATOM 935 CE1 TYR A 59 22.210 14.961 21.722 1.00 0.00 C ATOM 936 CE2 TYR A 59 21.711 14.886 19.366 1.00 0.00 C ATOM 937 CZ TYR A 59 22.483 14.453 20.441 1.00 0.00 C ATOM 938 OH TYR A 59 23.397 13.447 20.384 1.00 0.00 O ATOM 0 H TYR A 59 17.321 17.297 19.778 1.00 0.00 H new ATOM 0 HA TYR A 59 18.413 15.967 22.144 1.00 0.00 H new ATOM 0 HB2 TYR A 59 19.286 18.036 20.161 1.00 0.00 H new ATOM 0 HB3 TYR A 59 19.854 18.214 21.809 1.00 0.00 H new ATOM 0 HD1 TYR A 59 21.043 16.312 22.932 1.00 0.00 H new ATOM 0 HD2 TYR A 59 20.113 16.181 18.740 1.00 0.00 H new ATOM 0 HE1 TYR A 59 22.763 14.577 22.566 1.00 0.00 H new ATOM 0 HE2 TYR A 59 21.866 14.467 18.383 1.00 0.00 H new ATOM 0 HH TYR A 59 23.515 13.164 19.453 1.00 0.00 H new ATOM 948 N ASN A 60 16.238 18.245 22.356 1.00 0.00 N ATOM 949 CA ASN A 60 15.308 18.952 23.204 1.00 0.00 C ATOM 950 C ASN A 60 15.703 20.405 23.447 1.00 0.00 C ATOM 951 O ASN A 60 15.344 21.002 24.459 1.00 0.00 O ATOM 952 CB ASN A 60 14.813 18.262 24.490 1.00 0.00 C ATOM 953 CG ASN A 60 15.809 17.876 25.576 1.00 0.00 C ATOM 954 OD1 ASN A 60 16.552 18.670 26.143 1.00 0.00 O ATOM 955 ND2 ASN A 60 15.952 16.578 25.796 1.00 0.00 N ATOM 0 H ASN A 60 15.796 18.044 21.459 1.00 0.00 H new ATOM 0 HA ASN A 60 14.414 18.929 22.580 1.00 0.00 H new ATOM 0 HB2 ASN A 60 14.073 18.919 24.947 1.00 0.00 H new ATOM 0 HB3 ASN A 60 14.291 17.353 24.191 1.00 0.00 H new ATOM 0 HD21 ASN A 60 16.676 16.245 26.433 1.00 0.00 H new ATOM 0 HD22 ASN A 60 15.338 15.911 25.328 1.00 0.00 H new ATOM 962 N ILE A 61 16.393 20.992 22.468 1.00 0.00 N ATOM 963 CA ILE A 61 16.709 22.395 22.596 1.00 0.00 C ATOM 964 C ILE A 61 15.488 23.177 22.106 1.00 0.00 C ATOM 965 O ILE A 61 14.924 22.910 21.047 1.00 0.00 O ATOM 966 CB ILE A 61 17.929 22.670 21.705 1.00 0.00 C ATOM 967 CG1 ILE A 61 19.202 21.939 22.117 1.00 0.00 C ATOM 968 CG2 ILE A 61 18.271 24.118 21.359 1.00 0.00 C ATOM 969 CD1 ILE A 61 20.221 21.616 21.019 1.00 0.00 C ATOM 0 H ILE A 61 16.726 20.535 21.619 1.00 0.00 H new ATOM 0 HA ILE A 61 16.939 22.687 23.621 1.00 0.00 H new ATOM 0 HB ILE A 61 17.538 22.242 20.782 1.00 0.00 H new ATOM 0 HG12 ILE A 61 19.704 22.540 22.875 1.00 0.00 H new ATOM 0 HG13 ILE A 61 18.912 21.002 22.593 1.00 0.00 H new ATOM 0 HG21 ILE A 61 19.157 24.141 20.724 1.00 0.00 H new ATOM 0 HG22 ILE A 61 17.434 24.573 20.830 1.00 0.00 H new ATOM 0 HG23 ILE A 61 18.467 24.675 22.276 1.00 0.00 H new ATOM 0 HD11 ILE A 61 21.074 21.097 21.456 1.00 0.00 H new ATOM 0 HD12 ILE A 61 19.755 20.980 20.266 1.00 0.00 H new ATOM 0 HD13 ILE A 61 20.559 22.541 20.553 1.00 0.00 H new ATOM 981 N GLN A 62 14.986 24.105 22.924 1.00 0.00 N ATOM 982 CA GLN A 62 13.795 24.931 22.791 1.00 0.00 C ATOM 983 C GLN A 62 14.258 26.383 22.691 1.00 0.00 C ATOM 984 O GLN A 62 15.446 26.695 22.777 1.00 0.00 O ATOM 985 CB GLN A 62 12.963 24.631 24.041 1.00 0.00 C ATOM 986 CG GLN A 62 12.562 23.162 24.218 1.00 0.00 C ATOM 987 CD GLN A 62 11.527 22.661 23.215 1.00 0.00 C ATOM 988 OE1 GLN A 62 11.308 21.457 23.283 1.00 0.00 O ATOM 989 NE2 GLN A 62 10.839 23.516 22.474 1.00 0.00 N ATOM 0 H GLN A 62 15.467 24.316 23.798 1.00 0.00 H new ATOM 0 HA GLN A 62 13.188 24.734 21.907 1.00 0.00 H new ATOM 0 HB2 GLN A 62 13.528 24.946 24.919 1.00 0.00 H new ATOM 0 HB3 GLN A 62 12.058 25.237 24.010 1.00 0.00 H new ATOM 0 HG2 GLN A 62 13.456 22.543 24.138 1.00 0.00 H new ATOM 0 HG3 GLN A 62 12.169 23.025 25.225 1.00 0.00 H new ATOM 0 HE21 GLN A 62 11.087 24.505 22.474 1.00 0.00 H new ATOM 0 HE22 GLN A 62 10.061 23.185 21.903 1.00 0.00 H new ATOM 998 N LYS A 63 13.327 27.319 22.538 1.00 0.00 N ATOM 999 CA LYS A 63 13.462 28.760 22.650 1.00 0.00 C ATOM 1000 C LYS A 63 14.067 29.158 24.000 1.00 0.00 C ATOM 1001 O LYS A 63 13.752 28.611 25.055 1.00 0.00 O ATOM 1002 CB LYS A 63 12.097 29.408 22.463 1.00 0.00 C ATOM 1003 CG LYS A 63 11.049 29.495 23.568 1.00 0.00 C ATOM 1004 CD LYS A 63 11.027 30.932 24.100 1.00 0.00 C ATOM 1005 CE LYS A 63 10.212 30.961 25.387 1.00 0.00 C ATOM 1006 NZ LYS A 63 10.203 32.304 25.990 1.00 0.00 N ATOM 0 H LYS A 63 12.368 27.058 22.311 1.00 0.00 H new ATOM 0 HA LYS A 63 14.141 29.111 21.872 1.00 0.00 H new ATOM 0 HB2 LYS A 63 12.285 30.431 22.137 1.00 0.00 H new ATOM 0 HB3 LYS A 63 11.622 28.890 21.630 1.00 0.00 H new ATOM 0 HG2 LYS A 63 10.068 29.218 23.183 1.00 0.00 H new ATOM 0 HG3 LYS A 63 11.285 28.797 24.371 1.00 0.00 H new ATOM 0 HD2 LYS A 63 12.042 31.282 24.287 1.00 0.00 H new ATOM 0 HD3 LYS A 63 10.590 31.603 23.360 1.00 0.00 H new ATOM 0 HE2 LYS A 63 9.189 30.648 25.178 1.00 0.00 H new ATOM 0 HE3 LYS A 63 10.626 30.245 26.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 9.932 32.233 26.992 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 11.152 32.724 25.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 9.519 32.905 25.488 1.00 0.00 H new ATOM 1020 N GLU A 64 15.027 30.081 23.993 1.00 0.00 N ATOM 1021 CA GLU A 64 15.731 30.694 25.109 1.00 0.00 C ATOM 1022 C GLU A 64 16.548 29.756 26.007 1.00 0.00 C ATOM 1023 O GLU A 64 16.665 29.831 27.227 1.00 0.00 O ATOM 1024 CB GLU A 64 14.803 31.590 25.922 1.00 0.00 C ATOM 1025 CG GLU A 64 14.580 32.894 25.163 1.00 0.00 C ATOM 1026 CD GLU A 64 13.424 33.739 25.688 1.00 0.00 C ATOM 1027 OE1 GLU A 64 12.584 33.322 26.507 1.00 0.00 O ATOM 1028 OE2 GLU A 64 13.301 34.924 25.294 1.00 0.00 O ATOM 0 H GLU A 64 15.364 30.456 23.106 1.00 0.00 H new ATOM 0 HA GLU A 64 16.497 31.303 24.628 1.00 0.00 H new ATOM 0 HB2 GLU A 64 13.851 31.088 26.095 1.00 0.00 H new ATOM 0 HB3 GLU A 64 15.238 31.794 26.900 1.00 0.00 H new ATOM 0 HG2 GLU A 64 15.495 33.485 25.205 1.00 0.00 H new ATOM 0 HG3 GLU A 64 14.398 32.663 24.114 1.00 0.00 H new ATOM 1035 N SER A 65 17.024 28.646 25.456 1.00 0.00 N ATOM 1036 CA SER A 65 17.954 27.672 26.009 1.00 0.00 C ATOM 1037 C SER A 65 19.304 28.332 26.272 1.00 0.00 C ATOM 1038 O SER A 65 19.636 29.294 25.575 1.00 0.00 O ATOM 1039 CB SER A 65 18.119 26.555 24.981 1.00 0.00 C ATOM 1040 OG SER A 65 16.931 25.825 24.734 1.00 0.00 O ATOM 0 H SER A 65 16.738 28.380 24.514 1.00 0.00 H new ATOM 0 HA SER A 65 17.575 27.276 26.951 1.00 0.00 H new ATOM 0 HB2 SER A 65 18.471 26.986 24.044 1.00 0.00 H new ATOM 0 HB3 SER A 65 18.892 25.868 25.326 1.00 0.00 H new ATOM 0 HG SER A 65 16.572 26.071 23.856 1.00 0.00 H new ATOM 1046 N THR A 66 20.062 27.922 27.285 1.00 0.00 N ATOM 1047 CA THR A 66 21.337 28.494 27.703 1.00 0.00 C ATOM 1048 C THR A 66 22.417 27.441 27.445 1.00 0.00 C ATOM 1049 O THR A 66 22.466 26.434 28.152 1.00 0.00 O ATOM 1050 CB THR A 66 21.323 28.898 29.173 1.00 0.00 C ATOM 1051 OG1 THR A 66 20.891 27.912 30.090 1.00 0.00 O ATOM 1052 CG2 THR A 66 20.340 30.057 29.342 1.00 0.00 C ATOM 0 H THR A 66 19.785 27.134 27.871 1.00 0.00 H new ATOM 0 HA THR A 66 21.535 29.403 27.135 1.00 0.00 H new ATOM 0 HB THR A 66 22.365 29.125 29.401 1.00 0.00 H new ATOM 0 HG1 THR A 66 21.236 27.037 29.816 1.00 0.00 H new ATOM 0 HG21 THR A 66 20.314 30.363 30.388 1.00 0.00 H new ATOM 0 HG22 THR A 66 20.659 30.898 28.726 1.00 0.00 H new ATOM 0 HG23 THR A 66 19.345 29.738 29.032 1.00 0.00 H new ATOM 1060 N LEU A 67 23.263 27.652 26.447 1.00 0.00 N ATOM 1061 CA LEU A 67 24.333 26.708 26.189 1.00 0.00 C ATOM 1062 C LEU A 67 25.714 27.276 26.517 1.00 0.00 C ATOM 1063 O LEU A 67 25.988 28.479 26.482 1.00 0.00 O ATOM 1064 CB LEU A 67 24.284 26.297 24.720 1.00 0.00 C ATOM 1065 CG LEU A 67 23.227 25.318 24.213 1.00 0.00 C ATOM 1066 CD1 LEU A 67 21.839 25.945 24.046 1.00 0.00 C ATOM 1067 CD2 LEU A 67 23.565 24.564 22.929 1.00 0.00 C ATOM 0 H LEU A 67 23.229 28.452 25.816 1.00 0.00 H new ATOM 0 HA LEU A 67 24.181 25.847 26.840 1.00 0.00 H new ATOM 0 HB2 LEU A 67 24.179 27.211 24.136 1.00 0.00 H new ATOM 0 HB3 LEU A 67 25.257 25.872 24.475 1.00 0.00 H new ATOM 0 HG LEU A 67 23.217 24.589 25.023 1.00 0.00 H new ATOM 0 HD11 LEU A 67 21.140 25.191 23.683 1.00 0.00 H new ATOM 0 HD12 LEU A 67 21.494 26.327 25.007 1.00 0.00 H new ATOM 0 HD13 LEU A 67 21.894 26.764 23.329 1.00 0.00 H new ATOM 0 HD21 LEU A 67 22.740 23.900 22.669 1.00 0.00 H new ATOM 0 HD22 LEU A 67 23.726 25.277 22.120 1.00 0.00 H new ATOM 0 HD23 LEU A 67 24.470 23.976 23.080 1.00 0.00 H new ATOM 1079 N HIS A 68 26.626 26.387 26.894 1.00 0.00 N ATOM 1080 CA HIS A 68 28.050 26.563 27.065 1.00 0.00 C ATOM 1081 C HIS A 68 28.647 26.286 25.672 1.00 0.00 C ATOM 1082 O HIS A 68 28.281 25.328 25.014 1.00 0.00 O ATOM 1083 CB HIS A 68 28.660 25.567 28.054 1.00 0.00 C ATOM 1084 CG HIS A 68 28.213 25.823 29.471 1.00 0.00 C ATOM 1085 ND1 HIS A 68 28.179 24.829 30.452 1.00 0.00 N ATOM 1086 CD2 HIS A 68 27.964 27.035 30.057 1.00 0.00 C ATOM 1087 CE1 HIS A 68 27.943 25.443 31.600 1.00 0.00 C ATOM 1088 NE2 HIS A 68 27.669 26.735 31.373 1.00 0.00 N ATOM 0 H HIS A 68 26.350 25.429 27.108 1.00 0.00 H new ATOM 0 HA HIS A 68 28.258 27.558 27.458 1.00 0.00 H new ATOM 0 HB2 HIS A 68 28.381 24.554 27.765 1.00 0.00 H new ATOM 0 HB3 HIS A 68 29.747 25.626 28.002 1.00 0.00 H new ATOM 0 HD2 HIS A 68 27.992 28.010 29.593 1.00 0.00 H new ATOM 0 HE1 HIS A 68 27.967 24.974 32.573 1.00 0.00 H new ATOM 0 HE2 HIS A 68 27.302 27.392 32.062 1.00 0.00 H new ATOM 1096 N LEU A 69 29.639 27.070 25.277 1.00 0.00 N ATOM 1097 CA LEU A 69 30.522 26.959 24.125 1.00 0.00 C ATOM 1098 C LEU A 69 31.816 26.787 24.908 1.00 0.00 C ATOM 1099 O LEU A 69 32.227 27.704 25.619 1.00 0.00 O ATOM 1100 CB LEU A 69 30.404 28.263 23.330 1.00 0.00 C ATOM 1101 CG LEU A 69 30.857 28.136 21.873 1.00 0.00 C ATOM 1102 CD1 LEU A 69 30.365 29.332 21.052 1.00 0.00 C ATOM 1103 CD2 LEU A 69 32.382 28.086 21.854 1.00 0.00 C ATOM 0 H LEU A 69 29.872 27.899 25.823 1.00 0.00 H new ATOM 0 HA LEU A 69 30.363 26.183 23.376 1.00 0.00 H new ATOM 0 HB2 LEU A 69 29.367 28.599 23.351 1.00 0.00 H new ATOM 0 HB3 LEU A 69 30.999 29.033 23.821 1.00 0.00 H new ATOM 0 HG LEU A 69 30.440 27.230 21.433 1.00 0.00 H new ATOM 0 HD11 LEU A 69 30.696 29.225 20.019 1.00 0.00 H new ATOM 0 HD12 LEU A 69 29.276 29.371 21.082 1.00 0.00 H new ATOM 0 HD13 LEU A 69 30.772 30.253 21.470 1.00 0.00 H new ATOM 0 HD21 LEU A 69 32.730 27.995 20.825 1.00 0.00 H new ATOM 0 HD22 LEU A 69 32.782 29.000 22.293 1.00 0.00 H new ATOM 0 HD23 LEU A 69 32.725 27.227 22.430 1.00 0.00 H new ATOM 1115 N VAL A 70 32.466 25.651 24.651 1.00 0.00 N ATOM 1116 CA VAL A 70 33.793 25.270 25.064 1.00 0.00 C ATOM 1117 C VAL A 70 34.534 24.712 23.849 1.00 0.00 C ATOM 1118 O VAL A 70 33.933 24.511 22.794 1.00 0.00 O ATOM 1119 CB VAL A 70 33.780 24.381 26.302 1.00 0.00 C ATOM 1120 CG1 VAL A 70 33.083 24.975 27.530 1.00 0.00 C ATOM 1121 CG2 VAL A 70 33.347 22.925 26.073 1.00 0.00 C ATOM 0 H VAL A 70 32.026 24.916 24.097 1.00 0.00 H new ATOM 0 HA VAL A 70 34.357 26.138 25.406 1.00 0.00 H new ATOM 0 HB VAL A 70 34.844 24.347 26.535 1.00 0.00 H new ATOM 0 HG11 VAL A 70 33.130 24.264 28.354 1.00 0.00 H new ATOM 0 HG12 VAL A 70 33.582 25.900 27.820 1.00 0.00 H new ATOM 0 HG13 VAL A 70 32.041 25.185 27.291 1.00 0.00 H new ATOM 0 HG21 VAL A 70 33.374 22.384 27.019 1.00 0.00 H new ATOM 0 HG22 VAL A 70 32.333 22.906 25.673 1.00 0.00 H new ATOM 0 HG23 VAL A 70 34.026 22.451 25.364 1.00 0.00 H new ATOM 1131 N LEU A 71 35.846 24.576 23.959 1.00 0.00 N ATOM 1132 CA LEU A 71 36.789 24.179 22.929 1.00 0.00 C ATOM 1133 C LEU A 71 37.382 22.777 23.067 1.00 0.00 C ATOM 1134 O LEU A 71 37.718 22.406 24.192 1.00 0.00 O ATOM 1135 CB LEU A 71 37.947 25.173 22.983 1.00 0.00 C ATOM 1136 CG LEU A 71 37.630 26.564 22.428 1.00 0.00 C ATOM 1137 CD1 LEU A 71 36.697 27.385 23.326 1.00 0.00 C ATOM 1138 CD2 LEU A 71 38.979 27.207 22.128 1.00 0.00 C ATOM 0 H LEU A 71 36.316 24.756 24.846 1.00 0.00 H new ATOM 0 HA LEU A 71 36.232 24.171 21.992 1.00 0.00 H new ATOM 0 HB2 LEU A 71 38.270 25.276 24.019 1.00 0.00 H new ATOM 0 HB3 LEU A 71 38.788 24.759 22.427 1.00 0.00 H new ATOM 0 HG LEU A 71 37.041 26.505 21.513 1.00 0.00 H new ATOM 0 HD11 LEU A 71 36.516 28.358 22.870 1.00 0.00 H new ATOM 0 HD12 LEU A 71 35.750 26.859 23.445 1.00 0.00 H new ATOM 0 HD13 LEU A 71 37.160 27.523 24.303 1.00 0.00 H new ATOM 0 HD21 LEU A 71 38.824 28.208 21.726 1.00 0.00 H new ATOM 0 HD22 LEU A 71 39.564 27.271 23.046 1.00 0.00 H new ATOM 0 HD23 LEU A 71 39.516 26.602 21.397 1.00 0.00 H new