USER MOD reduce.3.24.130724 H: found=0, std=0, add=846, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 844 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: C 11 SER OG : rot 180:sc=-0.00296 USER MOD Set 1.2: C 21 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 13 ASN : amide:sc= 0.0167 K(o=0.017,f=-1.1!) USER MOD Set 2.2: A 19 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 11 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ -163:sc= -0.0352 (180deg=-0.298) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -0.982 X(o=-0.98,f=-0.7) USER MOD Single : A 29 GLN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 35 ASN : amide:sc= -0.0612 K(o=-0.061,f=-1.9) USER MOD Single : A 38 LYS NZ :NH3+ -103:sc= -0.605 (180deg=-2.72!) USER MOD Single : A 43 HIS : no HE2:sc= -1.17 X(o=-1.2,f=-1.5) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= 0.93 K(o=0.93,f=0) USER MOD Single : C 1 MET CE :methyl 172:sc= -0.011 (180deg=-0.0484) USER MOD Single : C 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 5 THR OG1 : rot 180:sc= 0.00401 USER MOD Single : C 7 LYS NZ :NH3+ -162:sc= -0.0575 (180deg=-0.345) USER MOD Single : C 13 ASN : amide:sc= -0.212 X(o=-0.21,f=-0.34) USER MOD Single : C 19 THR OG1 : rot 180:sc= 0 USER MOD Single : C 26 SER OG : rot 180:sc= 0 USER MOD Single : C 28 GLN : amide:sc= -0.548 X(o=-0.55,f=-0.32) USER MOD Single : C 29 GLN : amide:sc= 0 X(o=0,f=-0.0073) USER MOD Single : C 35 ASN : amide:sc= -0.0572 K(o=-0.057,f=-2.1!) USER MOD Single : C 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 43 HIS : no HE2:sc= -0.974 K(o=-0.97,f=-1.7) USER MOD Single : C 48 TYR OH : rot -1:sc= 1.08 USER MOD Single : C 49 GLN : amide:sc= 1 K(o=1,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -12.934 2.986 -1.852 1.00 0.00 N ATOM 2 CA MET A 1 -11.976 2.461 -0.859 1.00 0.00 C ATOM 3 C MET A 1 -11.994 0.942 -0.845 1.00 0.00 C ATOM 4 O MET A 1 -13.046 0.352 -0.621 1.00 0.00 O ATOM 5 CB MET A 1 -12.311 2.961 0.544 1.00 0.00 C ATOM 6 CG MET A 1 -11.406 2.319 1.598 1.00 0.00 C ATOM 7 SD MET A 1 -9.682 2.856 1.536 1.00 0.00 S ATOM 8 CE MET A 1 -9.870 4.351 2.530 1.00 0.00 C ATOM 0 H1 MET A 1 -12.906 4.026 -1.845 1.00 0.00 H new ATOM 0 H2 MET A 1 -12.678 2.639 -2.798 1.00 0.00 H new ATOM 0 H3 MET A 1 -13.894 2.664 -1.613 1.00 0.00 H new ATOM 0 HA MET A 1 -10.987 2.817 -1.146 1.00 0.00 H new ATOM 0 HB2 MET A 1 -12.202 4.045 0.581 1.00 0.00 H new ATOM 0 HB3 MET A 1 -13.353 2.737 0.772 1.00 0.00 H new ATOM 0 HG2 MET A 1 -11.807 2.542 2.587 1.00 0.00 H new ATOM 0 HG3 MET A 1 -11.440 1.236 1.477 1.00 0.00 H new ATOM 0 HE1 MET A 1 -8.906 4.851 2.622 1.00 0.00 H new ATOM 0 HE2 MET A 1 -10.581 5.021 2.048 1.00 0.00 H new ATOM 0 HE3 MET A 1 -10.237 4.085 3.521 1.00 0.00 H new ATOM 20 N LEU A 2 -10.842 0.316 -1.074 1.00 0.00 N ATOM 21 CA LEU A 2 -10.706 -1.127 -1.008 1.00 0.00 C ATOM 22 C LEU A 2 -9.564 -1.439 -0.039 1.00 0.00 C ATOM 23 O LEU A 2 -8.401 -1.177 -0.346 1.00 0.00 O ATOM 24 CB LEU A 2 -10.467 -1.662 -2.425 1.00 0.00 C ATOM 25 CG LEU A 2 -10.537 -3.189 -2.577 1.00 0.00 C ATOM 26 CD1 LEU A 2 -9.129 -3.755 -2.621 1.00 0.00 C ATOM 27 CD2 LEU A 2 -11.290 -3.909 -1.460 1.00 0.00 C ATOM 0 H LEU A 2 -9.977 0.802 -1.311 1.00 0.00 H new ATOM 0 HA LEU A 2 -11.605 -1.618 -0.634 1.00 0.00 H new ATOM 0 HB2 LEU A 2 -11.203 -1.214 -3.092 1.00 0.00 H new ATOM 0 HB3 LEU A 2 -9.486 -1.326 -2.761 1.00 0.00 H new ATOM 0 HG LEU A 2 -11.090 -3.362 -3.500 1.00 0.00 H new ATOM 0 HD11 LEU A 2 -9.176 -4.839 -2.729 1.00 0.00 H new ATOM 0 HD12 LEU A 2 -8.592 -3.329 -3.468 1.00 0.00 H new ATOM 0 HD13 LEU A 2 -8.607 -3.504 -1.697 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -11.287 -4.982 -1.652 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -10.802 -3.710 -0.506 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -12.318 -3.549 -1.424 1.00 0.00 H new ATOM 39 N ILE A 3 -9.903 -1.992 1.133 1.00 0.00 N ATOM 40 CA ILE A 3 -8.937 -2.340 2.165 1.00 0.00 C ATOM 41 C ILE A 3 -8.405 -3.743 1.904 1.00 0.00 C ATOM 42 O ILE A 3 -9.142 -4.626 1.466 1.00 0.00 O ATOM 43 CB ILE A 3 -9.573 -2.303 3.563 1.00 0.00 C ATOM 44 CG1 ILE A 3 -9.973 -0.887 3.990 1.00 0.00 C ATOM 45 CG2 ILE A 3 -8.535 -2.795 4.578 1.00 0.00 C ATOM 46 CD1 ILE A 3 -11.380 -0.530 3.538 1.00 0.00 C ATOM 0 H ILE A 3 -10.867 -2.210 1.387 1.00 0.00 H new ATOM 0 HA ILE A 3 -8.129 -1.610 2.132 1.00 0.00 H new ATOM 0 HB ILE A 3 -10.466 -2.926 3.530 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -9.909 -0.804 5.075 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -9.266 -0.170 3.573 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -8.967 -2.776 5.578 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -8.238 -3.814 4.330 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -7.661 -2.145 4.548 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -11.621 0.482 3.863 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -11.438 -0.586 2.451 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -12.091 -1.230 3.976 1.00 0.00 H new ATOM 58 N LEU A 4 -7.115 -3.940 2.187 1.00 0.00 N ATOM 59 CA LEU A 4 -6.464 -5.237 2.130 1.00 0.00 C ATOM 60 C LEU A 4 -5.466 -5.310 3.282 1.00 0.00 C ATOM 61 O LEU A 4 -4.726 -4.355 3.513 1.00 0.00 O ATOM 62 CB LEU A 4 -5.734 -5.393 0.792 1.00 0.00 C ATOM 63 CG LEU A 4 -6.685 -5.380 -0.409 1.00 0.00 C ATOM 64 CD1 LEU A 4 -5.887 -5.361 -1.711 1.00 0.00 C ATOM 65 CD2 LEU A 4 -7.595 -6.611 -0.414 1.00 0.00 C ATOM 0 H LEU A 4 -6.489 -3.185 2.466 1.00 0.00 H new ATOM 0 HA LEU A 4 -7.199 -6.038 2.215 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -5.008 -4.587 0.683 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -5.174 -6.328 0.796 1.00 0.00 H new ATOM 0 HG LEU A 4 -7.300 -4.484 -0.329 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -6.573 -5.352 -2.558 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -5.261 -4.469 -1.741 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -5.256 -6.249 -1.764 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -8.257 -6.571 -1.279 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -6.986 -7.514 -0.465 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -8.191 -6.627 0.499 1.00 0.00 H new ATOM 77 N THR A 5 -5.441 -6.432 4.007 1.00 0.00 N ATOM 78 CA THR A 5 -4.468 -6.622 5.077 1.00 0.00 C ATOM 79 C THR A 5 -3.251 -7.348 4.533 1.00 0.00 C ATOM 80 O THR A 5 -3.371 -8.191 3.645 1.00 0.00 O ATOM 81 CB THR A 5 -5.055 -7.434 6.231 1.00 0.00 C ATOM 82 OG1 THR A 5 -5.555 -8.661 5.751 1.00 0.00 O ATOM 83 CG2 THR A 5 -6.179 -6.677 6.921 1.00 0.00 C ATOM 0 H THR A 5 -6.080 -7.215 3.871 1.00 0.00 H new ATOM 0 HA THR A 5 -4.189 -5.638 5.454 1.00 0.00 H new ATOM 0 HB THR A 5 -4.257 -7.612 6.952 1.00 0.00 H new ATOM 0 HG1 THR A 5 -5.928 -9.176 6.496 1.00 0.00 H new ATOM 0 HG21 THR A 5 -6.576 -7.280 7.737 1.00 0.00 H new ATOM 0 HG22 THR A 5 -5.795 -5.737 7.318 1.00 0.00 H new ATOM 0 HG23 THR A 5 -6.973 -6.470 6.203 1.00 0.00 H new ATOM 91 N ARG A 6 -2.073 -7.023 5.069 1.00 0.00 N ATOM 92 CA ARG A 6 -0.819 -7.654 4.685 1.00 0.00 C ATOM 93 C ARG A 6 0.094 -7.759 5.897 1.00 0.00 C ATOM 94 O ARG A 6 0.193 -6.811 6.671 1.00 0.00 O ATOM 95 CB ARG A 6 -0.123 -6.793 3.625 1.00 0.00 C ATOM 96 CG ARG A 6 -0.816 -6.764 2.260 1.00 0.00 C ATOM 97 CD ARG A 6 -0.573 -8.058 1.476 1.00 0.00 C ATOM 98 NE ARG A 6 -1.412 -9.167 1.934 1.00 0.00 N ATOM 99 CZ ARG A 6 -1.640 -10.273 1.223 1.00 0.00 C ATOM 100 NH1 ARG A 6 -1.104 -10.427 0.014 1.00 0.00 N ATOM 101 NH2 ARG A 6 -2.411 -11.234 1.719 1.00 0.00 N ATOM 0 H ARG A 6 -1.967 -6.307 5.788 1.00 0.00 H new ATOM 0 HA ARG A 6 -1.026 -8.648 4.289 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -0.048 -5.772 4.000 1.00 0.00 H new ATOM 0 HB3 ARG A 6 0.895 -7.159 3.492 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -1.887 -6.618 2.398 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -0.450 -5.914 1.683 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -0.764 -7.877 0.418 1.00 0.00 H new ATOM 0 HD3 ARG A 6 0.476 -8.341 1.567 1.00 0.00 H new ATOM 0 HE ARG A 6 -1.849 -9.090 2.852 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -0.512 -9.695 -0.378 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -1.286 -11.277 -0.520 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -2.829 -11.127 2.643 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -2.585 -12.079 1.176 1.00 0.00 H new ATOM 115 N LYS A 7 0.763 -8.904 6.056 1.00 0.00 N ATOM 116 CA LYS A 7 1.787 -9.067 7.077 1.00 0.00 C ATOM 117 C LYS A 7 3.077 -8.476 6.509 1.00 0.00 C ATOM 118 O LYS A 7 3.231 -8.412 5.291 1.00 0.00 O ATOM 119 CB LYS A 7 1.970 -10.554 7.398 1.00 0.00 C ATOM 120 CG LYS A 7 2.058 -10.846 8.898 1.00 0.00 C ATOM 121 CD LYS A 7 0.725 -10.583 9.603 1.00 0.00 C ATOM 122 CE LYS A 7 0.764 -11.028 11.065 1.00 0.00 C ATOM 123 NZ LYS A 7 0.953 -12.486 11.190 1.00 0.00 N ATOM 0 H LYS A 7 0.608 -9.734 5.484 1.00 0.00 H new ATOM 0 HA LYS A 7 1.509 -8.562 8.002 1.00 0.00 H new ATOM 0 HB2 LYS A 7 1.137 -11.115 6.975 1.00 0.00 H new ATOM 0 HB3 LYS A 7 2.876 -10.914 6.912 1.00 0.00 H new ATOM 0 HG2 LYS A 7 2.352 -11.884 9.050 1.00 0.00 H new ATOM 0 HG3 LYS A 7 2.835 -10.226 9.345 1.00 0.00 H new ATOM 0 HD2 LYS A 7 0.489 -9.520 9.552 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -0.073 -11.112 9.082 1.00 0.00 H new ATOM 0 HE2 LYS A 7 1.573 -10.511 11.581 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -0.164 -10.738 11.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 0.691 -12.789 12.150 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 0.352 -12.975 10.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 1.950 -12.723 11.012 1.00 0.00 H new ATOM 137 N VAL A 8 4.011 -8.046 7.357 1.00 0.00 N ATOM 138 CA VAL A 8 5.257 -7.480 6.853 1.00 0.00 C ATOM 139 C VAL A 8 5.990 -8.513 5.997 1.00 0.00 C ATOM 140 O VAL A 8 6.276 -9.620 6.455 1.00 0.00 O ATOM 141 CB VAL A 8 6.124 -6.931 7.992 1.00 0.00 C ATOM 142 CG1 VAL A 8 5.373 -5.815 8.719 1.00 0.00 C ATOM 143 CG2 VAL A 8 6.529 -7.984 9.023 1.00 0.00 C ATOM 0 H VAL A 8 3.931 -8.078 8.373 1.00 0.00 H new ATOM 0 HA VAL A 8 5.027 -6.627 6.214 1.00 0.00 H new ATOM 0 HB VAL A 8 7.037 -6.565 7.522 1.00 0.00 H new ATOM 0 HG11 VAL A 8 5.992 -5.427 9.528 1.00 0.00 H new ATOM 0 HG12 VAL A 8 5.147 -5.012 8.018 1.00 0.00 H new ATOM 0 HG13 VAL A 8 4.444 -6.210 9.130 1.00 0.00 H new ATOM 0 HG21 VAL A 8 7.140 -7.519 9.797 1.00 0.00 H new ATOM 0 HG22 VAL A 8 5.635 -8.413 9.476 1.00 0.00 H new ATOM 0 HG23 VAL A 8 7.101 -8.772 8.533 1.00 0.00 H new ATOM 153 N GLY A 9 6.294 -8.146 4.747 1.00 0.00 N ATOM 154 CA GLY A 9 6.986 -9.009 3.800 1.00 0.00 C ATOM 155 C GLY A 9 6.097 -9.412 2.618 1.00 0.00 C ATOM 156 O GLY A 9 6.604 -9.873 1.597 1.00 0.00 O ATOM 0 H GLY A 9 6.061 -7.229 4.366 1.00 0.00 H new ATOM 0 HA2 GLY A 9 7.872 -8.496 3.426 1.00 0.00 H new ATOM 0 HA3 GLY A 9 7.330 -9.906 4.315 1.00 0.00 H new ATOM 160 N GLU A 10 4.775 -9.240 2.746 1.00 0.00 N ATOM 161 CA GLU A 10 3.832 -9.596 1.690 1.00 0.00 C ATOM 162 C GLU A 10 3.721 -8.478 0.647 1.00 0.00 C ATOM 163 O GLU A 10 4.405 -7.460 0.742 1.00 0.00 O ATOM 164 CB GLU A 10 2.469 -9.923 2.303 1.00 0.00 C ATOM 165 CG GLU A 10 2.575 -11.151 3.214 1.00 0.00 C ATOM 166 CD GLU A 10 1.196 -11.644 3.650 1.00 0.00 C ATOM 167 OE1 GLU A 10 0.373 -10.792 4.048 1.00 0.00 O ATOM 168 OE2 GLU A 10 0.981 -12.873 3.581 1.00 0.00 O ATOM 0 H GLU A 10 4.336 -8.852 3.581 1.00 0.00 H new ATOM 0 HA GLU A 10 4.202 -10.481 1.173 1.00 0.00 H new ATOM 0 HB2 GLU A 10 2.105 -9.069 2.874 1.00 0.00 H new ATOM 0 HB3 GLU A 10 1.743 -10.110 1.512 1.00 0.00 H new ATOM 0 HG2 GLU A 10 3.100 -11.950 2.690 1.00 0.00 H new ATOM 0 HG3 GLU A 10 3.169 -10.903 4.094 1.00 0.00 H new ATOM 175 N SER A 11 2.855 -8.667 -0.357 1.00 0.00 N ATOM 176 CA SER A 11 2.736 -7.746 -1.482 1.00 0.00 C ATOM 177 C SER A 11 1.290 -7.569 -1.940 1.00 0.00 C ATOM 178 O SER A 11 0.404 -8.333 -1.555 1.00 0.00 O ATOM 179 CB SER A 11 3.578 -8.266 -2.649 1.00 0.00 C ATOM 180 OG SER A 11 4.931 -8.385 -2.268 1.00 0.00 O ATOM 0 H SER A 11 2.220 -9.464 -0.407 1.00 0.00 H new ATOM 0 HA SER A 11 3.095 -6.772 -1.150 1.00 0.00 H new ATOM 0 HB2 SER A 11 3.199 -9.235 -2.975 1.00 0.00 H new ATOM 0 HB3 SER A 11 3.491 -7.588 -3.498 1.00 0.00 H new ATOM 0 HG SER A 11 5.456 -8.720 -3.025 1.00 0.00 H new ATOM 186 N ILE A 12 1.068 -6.548 -2.771 1.00 0.00 N ATOM 187 CA ILE A 12 -0.227 -6.118 -3.293 1.00 0.00 C ATOM 188 C ILE A 12 -0.016 -5.665 -4.743 1.00 0.00 C ATOM 189 O ILE A 12 1.121 -5.462 -5.164 1.00 0.00 O ATOM 190 CB ILE A 12 -0.754 -4.978 -2.398 1.00 0.00 C ATOM 191 CG1 ILE A 12 -1.072 -5.454 -0.972 1.00 0.00 C ATOM 192 CG2 ILE A 12 -1.987 -4.287 -2.990 1.00 0.00 C ATOM 193 CD1 ILE A 12 -2.276 -6.397 -0.909 1.00 0.00 C ATOM 0 H ILE A 12 1.832 -5.967 -3.116 1.00 0.00 H new ATOM 0 HA ILE A 12 -0.966 -6.919 -3.285 1.00 0.00 H new ATOM 0 HB ILE A 12 0.058 -4.253 -2.351 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -0.199 -5.961 -0.561 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -1.264 -4.587 -0.340 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -2.316 -3.493 -2.320 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -1.734 -3.861 -3.961 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -2.789 -5.015 -3.111 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -2.449 -6.698 0.124 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -3.159 -5.885 -1.291 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -2.078 -7.281 -1.516 1.00 0.00 H new ATOM 205 N ASN A 13 -1.090 -5.508 -5.523 1.00 0.00 N ATOM 206 CA ASN A 13 -0.995 -5.132 -6.929 1.00 0.00 C ATOM 207 C ASN A 13 -2.067 -4.118 -7.326 1.00 0.00 C ATOM 208 O ASN A 13 -3.138 -4.057 -6.723 1.00 0.00 O ATOM 209 CB ASN A 13 -1.118 -6.388 -7.797 1.00 0.00 C ATOM 210 CG ASN A 13 0.220 -7.097 -7.917 1.00 0.00 C ATOM 211 OD1 ASN A 13 0.452 -8.124 -7.283 1.00 0.00 O ATOM 212 ND2 ASN A 13 1.112 -6.552 -8.741 1.00 0.00 N ATOM 0 H ASN A 13 -2.047 -5.639 -5.194 1.00 0.00 H new ATOM 0 HA ASN A 13 -0.026 -4.658 -7.086 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -1.855 -7.064 -7.363 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -1.480 -6.116 -8.788 1.00 0.00 H new ATOM 0 HD21 ASN A 13 2.026 -6.988 -8.864 1.00 0.00 H new ATOM 0 HD22 ASN A 13 0.882 -5.699 -9.250 1.00 0.00 H new ATOM 219 N ILE A 14 -1.755 -3.324 -8.358 1.00 0.00 N ATOM 220 CA ILE A 14 -2.635 -2.296 -8.887 1.00 0.00 C ATOM 221 C ILE A 14 -2.473 -2.252 -10.406 1.00 0.00 C ATOM 222 O ILE A 14 -1.373 -2.463 -10.923 1.00 0.00 O ATOM 223 CB ILE A 14 -2.284 -0.934 -8.264 1.00 0.00 C ATOM 224 CG1 ILE A 14 -2.347 -1.008 -6.731 1.00 0.00 C ATOM 225 CG2 ILE A 14 -3.241 0.140 -8.787 1.00 0.00 C ATOM 226 CD1 ILE A 14 -1.988 0.324 -6.074 1.00 0.00 C ATOM 0 H ILE A 14 -0.865 -3.386 -8.852 1.00 0.00 H new ATOM 0 HA ILE A 14 -3.672 -2.524 -8.639 1.00 0.00 H new ATOM 0 HB ILE A 14 -1.266 -0.670 -8.550 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -3.350 -1.304 -6.424 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -1.665 -1.781 -6.378 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -2.987 1.102 -8.342 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -3.154 0.208 -9.871 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -4.265 -0.124 -8.521 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -2.046 0.223 -4.990 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -0.975 0.608 -6.358 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -2.686 1.093 -6.405 1.00 0.00 H new ATOM 238 N GLY A 15 -3.565 -1.979 -11.118 1.00 0.00 N ATOM 239 CA GLY A 15 -3.555 -1.946 -12.569 1.00 0.00 C ATOM 240 C GLY A 15 -3.008 -3.261 -13.122 1.00 0.00 C ATOM 241 O GLY A 15 -3.306 -4.334 -12.601 1.00 0.00 O ATOM 0 H GLY A 15 -4.474 -1.776 -10.703 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -4.565 -1.777 -12.943 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -2.943 -1.114 -12.917 1.00 0.00 H new ATOM 245 N ASP A 16 -2.206 -3.165 -14.181 1.00 0.00 N ATOM 246 CA ASP A 16 -1.534 -4.306 -14.781 1.00 0.00 C ATOM 247 C ASP A 16 -0.046 -3.992 -14.956 1.00 0.00 C ATOM 248 O ASP A 16 0.682 -4.728 -15.621 1.00 0.00 O ATOM 249 CB ASP A 16 -2.216 -4.658 -16.104 1.00 0.00 C ATOM 250 CG ASP A 16 -1.715 -5.990 -16.668 1.00 0.00 C ATOM 251 OD1 ASP A 16 -1.760 -6.989 -15.914 1.00 0.00 O ATOM 252 OD2 ASP A 16 -1.291 -5.994 -17.847 1.00 0.00 O ATOM 0 H ASP A 16 -2.005 -2.281 -14.648 1.00 0.00 H new ATOM 0 HA ASP A 16 -1.607 -5.178 -14.131 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -3.294 -4.710 -15.954 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -2.033 -3.865 -16.829 1.00 0.00 H new ATOM 257 N ASP A 17 0.409 -2.886 -14.354 1.00 0.00 N ATOM 258 CA ASP A 17 1.775 -2.403 -14.486 1.00 0.00 C ATOM 259 C ASP A 17 2.326 -1.889 -13.154 1.00 0.00 C ATOM 260 O ASP A 17 3.410 -1.307 -13.136 1.00 0.00 O ATOM 261 CB ASP A 17 1.824 -1.288 -15.533 1.00 0.00 C ATOM 262 CG ASP A 17 1.380 -1.778 -16.908 1.00 0.00 C ATOM 263 OD1 ASP A 17 2.228 -2.377 -17.603 1.00 0.00 O ATOM 264 OD2 ASP A 17 0.200 -1.550 -17.252 1.00 0.00 O ATOM 0 H ASP A 17 -0.174 -2.300 -13.756 1.00 0.00 H new ATOM 0 HA ASP A 17 2.399 -3.239 -14.802 1.00 0.00 H new ATOM 0 HB2 ASP A 17 1.183 -0.465 -15.217 1.00 0.00 H new ATOM 0 HB3 ASP A 17 2.839 -0.895 -15.598 1.00 0.00 H new ATOM 269 N ILE A 18 1.613 -2.090 -12.036 1.00 0.00 N ATOM 270 CA ILE A 18 2.078 -1.611 -10.743 1.00 0.00 C ATOM 271 C ILE A 18 2.008 -2.732 -9.705 1.00 0.00 C ATOM 272 O ILE A 18 1.113 -3.578 -9.733 1.00 0.00 O ATOM 273 CB ILE A 18 1.263 -0.387 -10.281 1.00 0.00 C ATOM 274 CG1 ILE A 18 1.345 0.778 -11.280 1.00 0.00 C ATOM 275 CG2 ILE A 18 1.802 0.109 -8.937 1.00 0.00 C ATOM 276 CD1 ILE A 18 0.229 0.705 -12.322 1.00 0.00 C ATOM 0 H ILE A 18 0.718 -2.579 -12.009 1.00 0.00 H new ATOM 0 HA ILE A 18 3.117 -1.299 -10.847 1.00 0.00 H new ATOM 0 HB ILE A 18 0.224 -0.707 -10.201 1.00 0.00 H new ATOM 0 HG12 ILE A 18 1.281 1.724 -10.743 1.00 0.00 H new ATOM 0 HG13 ILE A 18 2.313 0.761 -11.781 1.00 0.00 H new ATOM 0 HG21 ILE A 18 1.225 0.975 -8.611 1.00 0.00 H new ATOM 0 HG22 ILE A 18 1.716 -0.685 -8.195 1.00 0.00 H new ATOM 0 HG23 ILE A 18 2.849 0.391 -9.047 1.00 0.00 H new ATOM 0 HD11 ILE A 18 0.319 1.545 -13.011 1.00 0.00 H new ATOM 0 HD12 ILE A 18 0.310 -0.230 -12.877 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -0.739 0.748 -11.822 1.00 0.00 H new ATOM 288 N THR A 19 2.971 -2.725 -8.781 1.00 0.00 N ATOM 289 CA THR A 19 3.044 -3.668 -7.677 1.00 0.00 C ATOM 290 C THR A 19 3.419 -2.886 -6.421 1.00 0.00 C ATOM 291 O THR A 19 4.036 -1.826 -6.513 1.00 0.00 O ATOM 292 CB THR A 19 4.078 -4.758 -7.982 1.00 0.00 C ATOM 293 OG1 THR A 19 3.775 -5.386 -9.209 1.00 0.00 O ATOM 294 CG2 THR A 19 4.105 -5.834 -6.898 1.00 0.00 C ATOM 0 H THR A 19 3.734 -2.048 -8.785 1.00 0.00 H new ATOM 0 HA THR A 19 2.085 -4.164 -7.528 1.00 0.00 H new ATOM 0 HB THR A 19 5.051 -4.269 -8.026 1.00 0.00 H new ATOM 0 HG1 THR A 19 4.442 -6.079 -9.395 1.00 0.00 H new ATOM 0 HG21 THR A 19 4.851 -6.588 -7.152 1.00 0.00 H new ATOM 0 HG22 THR A 19 4.360 -5.380 -5.941 1.00 0.00 H new ATOM 0 HG23 THR A 19 3.124 -6.304 -6.827 1.00 0.00 H new ATOM 302 N ILE A 20 3.046 -3.411 -5.253 1.00 0.00 N ATOM 303 CA ILE A 20 3.223 -2.747 -3.972 1.00 0.00 C ATOM 304 C ILE A 20 3.739 -3.775 -2.971 1.00 0.00 C ATOM 305 O ILE A 20 3.418 -4.958 -3.079 1.00 0.00 O ATOM 306 CB ILE A 20 1.871 -2.187 -3.509 1.00 0.00 C ATOM 307 CG1 ILE A 20 1.230 -1.237 -4.531 1.00 0.00 C ATOM 308 CG2 ILE A 20 2.010 -1.485 -2.156 1.00 0.00 C ATOM 309 CD1 ILE A 20 2.010 0.069 -4.683 1.00 0.00 C ATOM 0 H ILE A 20 2.605 -4.327 -5.175 1.00 0.00 H new ATOM 0 HA ILE A 20 3.935 -1.926 -4.054 1.00 0.00 H new ATOM 0 HB ILE A 20 1.205 -3.044 -3.409 1.00 0.00 H new ATOM 0 HG12 ILE A 20 1.170 -1.736 -5.498 1.00 0.00 H new ATOM 0 HG13 ILE A 20 0.208 -1.013 -4.224 1.00 0.00 H new ATOM 0 HG21 ILE A 20 1.040 -1.096 -1.847 1.00 0.00 H new ATOM 0 HG22 ILE A 20 2.369 -2.196 -1.412 1.00 0.00 H new ATOM 0 HG23 ILE A 20 2.720 -0.662 -2.244 1.00 0.00 H new ATOM 0 HD11 ILE A 20 1.515 0.705 -5.417 1.00 0.00 H new ATOM 0 HD12 ILE A 20 2.048 0.584 -3.723 1.00 0.00 H new ATOM 0 HD13 ILE A 20 3.024 -0.150 -5.018 1.00 0.00 H new ATOM 321 N THR A 21 4.536 -3.334 -1.998 1.00 0.00 N ATOM 322 CA THR A 21 5.124 -4.221 -1.004 1.00 0.00 C ATOM 323 C THR A 21 5.098 -3.557 0.363 1.00 0.00 C ATOM 324 O THR A 21 5.145 -2.331 0.460 1.00 0.00 O ATOM 325 CB THR A 21 6.568 -4.547 -1.407 1.00 0.00 C ATOM 326 OG1 THR A 21 6.617 -4.992 -2.747 1.00 0.00 O ATOM 327 CG2 THR A 21 7.158 -5.648 -0.530 1.00 0.00 C ATOM 0 H THR A 21 4.790 -2.353 -1.880 1.00 0.00 H new ATOM 0 HA THR A 21 4.547 -5.145 -0.953 1.00 0.00 H new ATOM 0 HB THR A 21 7.146 -3.631 -1.283 1.00 0.00 H new ATOM 0 HG1 THR A 21 7.544 -5.195 -2.991 1.00 0.00 H new ATOM 0 HG21 THR A 21 8.182 -5.853 -0.843 1.00 0.00 H new ATOM 0 HG22 THR A 21 7.155 -5.325 0.511 1.00 0.00 H new ATOM 0 HG23 THR A 21 6.559 -6.553 -0.630 1.00 0.00 H new ATOM 335 N ILE A 22 5.025 -4.367 1.424 1.00 0.00 N ATOM 336 CA ILE A 22 5.064 -3.881 2.796 1.00 0.00 C ATOM 337 C ILE A 22 6.381 -4.327 3.425 1.00 0.00 C ATOM 338 O ILE A 22 6.494 -5.424 3.968 1.00 0.00 O ATOM 339 CB ILE A 22 3.810 -4.325 3.571 1.00 0.00 C ATOM 340 CG1 ILE A 22 3.940 -4.068 5.073 1.00 0.00 C ATOM 341 CG2 ILE A 22 3.494 -5.806 3.367 1.00 0.00 C ATOM 342 CD1 ILE A 22 4.223 -2.601 5.377 1.00 0.00 C ATOM 0 H ILE A 22 4.937 -5.380 1.349 1.00 0.00 H new ATOM 0 HA ILE A 22 5.038 -2.792 2.828 1.00 0.00 H new ATOM 0 HB ILE A 22 2.997 -3.723 3.166 1.00 0.00 H new ATOM 0 HG12 ILE A 22 3.021 -4.372 5.574 1.00 0.00 H new ATOM 0 HG13 ILE A 22 4.743 -4.684 5.478 1.00 0.00 H new ATOM 0 HG21 ILE A 22 2.601 -6.069 3.934 1.00 0.00 H new ATOM 0 HG22 ILE A 22 3.321 -5.999 2.308 1.00 0.00 H new ATOM 0 HG23 ILE A 22 4.334 -6.408 3.713 1.00 0.00 H new ATOM 0 HD11 ILE A 22 4.308 -2.463 6.455 1.00 0.00 H new ATOM 0 HD12 ILE A 22 5.156 -2.304 4.898 1.00 0.00 H new ATOM 0 HD13 ILE A 22 3.408 -1.986 4.995 1.00 0.00 H new ATOM 354 N LEU A 23 7.391 -3.456 3.339 1.00 0.00 N ATOM 355 CA LEU A 23 8.736 -3.775 3.787 1.00 0.00 C ATOM 356 C LEU A 23 8.781 -3.973 5.302 1.00 0.00 C ATOM 357 O LEU A 23 9.581 -4.774 5.780 1.00 0.00 O ATOM 358 CB LEU A 23 9.696 -2.652 3.379 1.00 0.00 C ATOM 359 CG LEU A 23 9.589 -2.283 1.898 1.00 0.00 C ATOM 360 CD1 LEU A 23 10.610 -1.200 1.582 1.00 0.00 C ATOM 361 CD2 LEU A 23 9.873 -3.472 0.982 1.00 0.00 C ATOM 0 H LEU A 23 7.293 -2.515 2.957 1.00 0.00 H new ATOM 0 HA LEU A 23 9.042 -4.708 3.314 1.00 0.00 H new ATOM 0 HB2 LEU A 23 9.491 -1.769 3.984 1.00 0.00 H new ATOM 0 HB3 LEU A 23 10.719 -2.958 3.599 1.00 0.00 H new ATOM 0 HG LEU A 23 8.568 -1.944 1.721 1.00 0.00 H new ATOM 0 HD11 LEU A 23 10.541 -0.931 0.528 1.00 0.00 H new ATOM 0 HD12 LEU A 23 10.410 -0.321 2.195 1.00 0.00 H new ATOM 0 HD13 LEU A 23 11.612 -1.571 1.796 1.00 0.00 H new ATOM 0 HD21 LEU A 23 9.785 -3.159 -0.058 1.00 0.00 H new ATOM 0 HD22 LEU A 23 10.882 -3.840 1.166 1.00 0.00 H new ATOM 0 HD23 LEU A 23 9.155 -4.267 1.184 1.00 0.00 H new ATOM 373 N GLY A 24 7.931 -3.262 6.053 1.00 0.00 N ATOM 374 CA GLY A 24 7.847 -3.483 7.491 1.00 0.00 C ATOM 375 C GLY A 24 7.278 -2.282 8.242 1.00 0.00 C ATOM 376 O GLY A 24 6.755 -1.349 7.631 1.00 0.00 O ATOM 0 H GLY A 24 7.305 -2.543 5.692 1.00 0.00 H new ATOM 0 HA2 GLY A 24 7.223 -4.355 7.684 1.00 0.00 H new ATOM 0 HA3 GLY A 24 8.840 -3.710 7.878 1.00 0.00 H new ATOM 380 N VAL A 25 7.385 -2.311 9.577 1.00 0.00 N ATOM 381 CA VAL A 25 6.942 -1.220 10.434 1.00 0.00 C ATOM 382 C VAL A 25 8.041 -0.861 11.423 1.00 0.00 C ATOM 383 O VAL A 25 8.972 -1.636 11.642 1.00 0.00 O ATOM 384 CB VAL A 25 5.640 -1.573 11.170 1.00 0.00 C ATOM 385 CG1 VAL A 25 4.595 -2.134 10.203 1.00 0.00 C ATOM 386 CG2 VAL A 25 5.864 -2.595 12.282 1.00 0.00 C ATOM 0 H VAL A 25 7.784 -3.098 10.088 1.00 0.00 H new ATOM 0 HA VAL A 25 6.733 -0.355 9.805 1.00 0.00 H new ATOM 0 HB VAL A 25 5.281 -0.643 11.611 1.00 0.00 H new ATOM 0 HG11 VAL A 25 3.684 -2.375 10.751 1.00 0.00 H new ATOM 0 HG12 VAL A 25 4.372 -1.391 9.437 1.00 0.00 H new ATOM 0 HG13 VAL A 25 4.984 -3.036 9.731 1.00 0.00 H new ATOM 0 HG21 VAL A 25 4.915 -2.812 12.773 1.00 0.00 H new ATOM 0 HG22 VAL A 25 6.271 -3.512 11.857 1.00 0.00 H new ATOM 0 HG23 VAL A 25 6.566 -2.191 13.012 1.00 0.00 H new ATOM 396 N SER A 26 7.924 0.326 12.025 1.00 0.00 N ATOM 397 CA SER A 26 8.878 0.843 12.995 1.00 0.00 C ATOM 398 C SER A 26 8.105 1.715 13.972 1.00 0.00 C ATOM 399 O SER A 26 8.100 2.940 13.854 1.00 0.00 O ATOM 400 CB SER A 26 9.976 1.644 12.290 1.00 0.00 C ATOM 401 OG SER A 26 10.664 0.837 11.355 1.00 0.00 O ATOM 0 H SER A 26 7.147 0.962 11.845 1.00 0.00 H new ATOM 0 HA SER A 26 9.369 0.028 13.527 1.00 0.00 H new ATOM 0 HB2 SER A 26 9.537 2.503 11.782 1.00 0.00 H new ATOM 0 HB3 SER A 26 10.678 2.034 13.027 1.00 0.00 H new ATOM 0 HG SER A 26 11.360 1.368 10.914 1.00 0.00 H new ATOM 407 N GLY A 27 7.452 1.081 14.944 1.00 0.00 N ATOM 408 CA GLY A 27 6.530 1.781 15.816 1.00 0.00 C ATOM 409 C GLY A 27 5.243 2.014 15.044 1.00 0.00 C ATOM 410 O GLY A 27 4.570 1.056 14.664 1.00 0.00 O ATOM 0 H GLY A 27 7.549 0.085 15.142 1.00 0.00 H new ATOM 0 HA2 GLY A 27 6.335 1.195 16.714 1.00 0.00 H new ATOM 0 HA3 GLY A 27 6.957 2.730 16.140 1.00 0.00 H new ATOM 414 N GLN A 28 4.906 3.281 14.805 1.00 0.00 N ATOM 415 CA GLN A 28 3.721 3.630 14.038 1.00 0.00 C ATOM 416 C GLN A 28 4.109 3.961 12.602 1.00 0.00 C ATOM 417 O GLN A 28 3.243 4.267 11.786 1.00 0.00 O ATOM 418 CB GLN A 28 2.984 4.787 14.715 1.00 0.00 C ATOM 419 CG GLN A 28 1.989 4.258 15.751 1.00 0.00 C ATOM 420 CD GLN A 28 2.574 3.119 16.583 1.00 0.00 C ATOM 421 OE1 GLN A 28 3.317 3.345 17.536 1.00 0.00 O ATOM 422 NE2 GLN A 28 2.242 1.881 16.223 1.00 0.00 N ATOM 0 H GLN A 28 5.443 4.083 15.135 1.00 0.00 H new ATOM 0 HA GLN A 28 3.040 2.780 14.006 1.00 0.00 H new ATOM 0 HB2 GLN A 28 3.702 5.450 15.198 1.00 0.00 H new ATOM 0 HB3 GLN A 28 2.458 5.378 13.966 1.00 0.00 H new ATOM 0 HG2 GLN A 28 1.688 5.071 16.412 1.00 0.00 H new ATOM 0 HG3 GLN A 28 1.089 3.910 15.244 1.00 0.00 H new ATOM 0 HE21 GLN A 28 1.623 1.730 15.427 1.00 0.00 H new ATOM 0 HE22 GLN A 28 2.607 1.083 16.744 1.00 0.00 H new ATOM 431 N GLN A 29 5.406 3.900 12.292 1.00 0.00 N ATOM 432 CA GLN A 29 5.854 4.043 10.924 1.00 0.00 C ATOM 433 C GLN A 29 5.593 2.757 10.157 1.00 0.00 C ATOM 434 O GLN A 29 5.440 1.690 10.750 1.00 0.00 O ATOM 435 CB GLN A 29 7.350 4.335 10.854 1.00 0.00 C ATOM 436 CG GLN A 29 7.643 5.828 10.914 1.00 0.00 C ATOM 437 CD GLN A 29 9.044 6.075 10.383 1.00 0.00 C ATOM 438 OE1 GLN A 29 9.209 6.610 9.293 1.00 0.00 O ATOM 439 NE2 GLN A 29 10.060 5.690 11.149 1.00 0.00 N ATOM 0 H GLN A 29 6.152 3.753 12.972 1.00 0.00 H new ATOM 0 HA GLN A 29 5.303 4.876 10.487 1.00 0.00 H new ATOM 0 HB2 GLN A 29 7.856 3.833 11.678 1.00 0.00 H new ATOM 0 HB3 GLN A 29 7.757 3.922 9.931 1.00 0.00 H new ATOM 0 HG2 GLN A 29 6.913 6.380 10.322 1.00 0.00 H new ATOM 0 HG3 GLN A 29 7.559 6.188 11.940 1.00 0.00 H new ATOM 0 HE21 GLN A 29 9.880 5.248 12.050 1.00 0.00 H new ATOM 0 HE22 GLN A 29 11.019 5.837 10.835 1.00 0.00 H new ATOM 448 N VAL A 30 5.554 2.877 8.833 1.00 0.00 N ATOM 449 CA VAL A 30 5.415 1.755 7.929 1.00 0.00 C ATOM 450 C VAL A 30 6.279 2.034 6.706 1.00 0.00 C ATOM 451 O VAL A 30 6.048 3.017 6.007 1.00 0.00 O ATOM 452 CB VAL A 30 3.949 1.587 7.523 1.00 0.00 C ATOM 453 CG1 VAL A 30 3.791 0.330 6.669 1.00 0.00 C ATOM 454 CG2 VAL A 30 3.034 1.450 8.740 1.00 0.00 C ATOM 0 H VAL A 30 5.620 3.776 8.356 1.00 0.00 H new ATOM 0 HA VAL A 30 5.736 0.832 8.412 1.00 0.00 H new ATOM 0 HB VAL A 30 3.665 2.479 6.965 1.00 0.00 H new ATOM 0 HG11 VAL A 30 2.746 0.214 6.382 1.00 0.00 H new ATOM 0 HG12 VAL A 30 4.405 0.419 5.773 1.00 0.00 H new ATOM 0 HG13 VAL A 30 4.109 -0.541 7.242 1.00 0.00 H new ATOM 0 HG21 VAL A 30 2.002 1.333 8.408 1.00 0.00 H new ATOM 0 HG22 VAL A 30 3.330 0.577 9.321 1.00 0.00 H new ATOM 0 HG23 VAL A 30 3.117 2.343 9.360 1.00 0.00 H new ATOM 464 N ARG A 31 7.272 1.174 6.451 1.00 0.00 N ATOM 465 CA ARG A 31 8.026 1.238 5.210 1.00 0.00 C ATOM 466 C ARG A 31 7.208 0.531 4.145 1.00 0.00 C ATOM 467 O ARG A 31 6.947 -0.671 4.253 1.00 0.00 O ATOM 468 CB ARG A 31 9.384 0.543 5.324 1.00 0.00 C ATOM 469 CG ARG A 31 10.456 1.451 5.922 1.00 0.00 C ATOM 470 CD ARG A 31 11.840 0.962 5.491 1.00 0.00 C ATOM 471 NE ARG A 31 12.129 -0.403 5.950 1.00 0.00 N ATOM 472 CZ ARG A 31 13.192 -1.104 5.537 1.00 0.00 C ATOM 473 NH1 ARG A 31 14.055 -0.574 4.678 1.00 0.00 N ATOM 474 NH2 ARG A 31 13.392 -2.341 5.984 1.00 0.00 N ATOM 0 H ARG A 31 7.565 0.433 7.088 1.00 0.00 H new ATOM 0 HA ARG A 31 8.210 2.284 4.964 1.00 0.00 H new ATOM 0 HB2 ARG A 31 9.282 -0.349 5.942 1.00 0.00 H new ATOM 0 HB3 ARG A 31 9.703 0.211 4.336 1.00 0.00 H new ATOM 0 HG2 ARG A 31 10.303 2.478 5.591 1.00 0.00 H new ATOM 0 HG3 ARG A 31 10.382 1.452 7.009 1.00 0.00 H new ATOM 0 HD2 ARG A 31 11.911 0.998 4.404 1.00 0.00 H new ATOM 0 HD3 ARG A 31 12.598 1.640 5.882 1.00 0.00 H new ATOM 0 HE ARG A 31 11.489 -0.837 6.615 1.00 0.00 H new ATOM 0 HH11 ARG A 31 13.910 0.373 4.328 1.00 0.00 H new ATOM 0 HH12 ARG A 31 14.863 -1.114 4.368 1.00 0.00 H new ATOM 0 HH21 ARG A 31 12.734 -2.758 6.643 1.00 0.00 H new ATOM 0 HH22 ARG A 31 14.203 -2.873 5.668 1.00 0.00 H new ATOM 488 N ILE A 32 6.818 1.292 3.125 1.00 0.00 N ATOM 489 CA ILE A 32 6.038 0.789 2.007 1.00 0.00 C ATOM 490 C ILE A 32 6.888 0.928 0.752 1.00 0.00 C ATOM 491 O ILE A 32 7.618 1.908 0.603 1.00 0.00 O ATOM 492 CB ILE A 32 4.733 1.592 1.880 1.00 0.00 C ATOM 493 CG1 ILE A 32 4.094 1.804 3.262 1.00 0.00 C ATOM 494 CG2 ILE A 32 3.782 0.857 0.930 1.00 0.00 C ATOM 495 CD1 ILE A 32 2.732 2.495 3.189 1.00 0.00 C ATOM 0 H ILE A 32 7.039 2.285 3.055 1.00 0.00 H new ATOM 0 HA ILE A 32 5.769 -0.257 2.157 1.00 0.00 H new ATOM 0 HB ILE A 32 4.947 2.578 1.468 1.00 0.00 H new ATOM 0 HG12 ILE A 32 3.980 0.839 3.756 1.00 0.00 H new ATOM 0 HG13 ILE A 32 4.766 2.401 3.879 1.00 0.00 H new ATOM 0 HG21 ILE A 32 2.854 1.421 0.835 1.00 0.00 H new ATOM 0 HG22 ILE A 32 4.249 0.760 -0.050 1.00 0.00 H new ATOM 0 HG23 ILE A 32 3.565 -0.134 1.328 1.00 0.00 H new ATOM 0 HD11 ILE A 32 2.331 2.617 4.195 1.00 0.00 H new ATOM 0 HD12 ILE A 32 2.845 3.474 2.723 1.00 0.00 H new ATOM 0 HD13 ILE A 32 2.047 1.888 2.597 1.00 0.00 H new ATOM 507 N GLY A 33 6.794 -0.047 -0.149 1.00 0.00 N ATOM 508 CA GLY A 33 7.569 -0.050 -1.376 1.00 0.00 C ATOM 509 C GLY A 33 6.628 -0.098 -2.567 1.00 0.00 C ATOM 510 O GLY A 33 5.529 -0.644 -2.470 1.00 0.00 O ATOM 0 H GLY A 33 6.178 -0.853 -0.045 1.00 0.00 H new ATOM 0 HA2 GLY A 33 8.193 0.842 -1.427 1.00 0.00 H new ATOM 0 HA3 GLY A 33 8.240 -0.909 -1.393 1.00 0.00 H new ATOM 514 N ILE A 34 7.059 0.473 -3.693 1.00 0.00 N ATOM 515 CA ILE A 34 6.247 0.526 -4.893 1.00 0.00 C ATOM 516 C ILE A 34 7.125 0.166 -6.082 1.00 0.00 C ATOM 517 O ILE A 34 8.311 0.495 -6.112 1.00 0.00 O ATOM 518 CB ILE A 34 5.639 1.929 -5.039 1.00 0.00 C ATOM 519 CG1 ILE A 34 4.817 2.261 -3.783 1.00 0.00 C ATOM 520 CG2 ILE A 34 4.775 1.985 -6.308 1.00 0.00 C ATOM 521 CD1 ILE A 34 4.275 3.687 -3.801 1.00 0.00 C ATOM 0 H ILE A 34 7.977 0.907 -3.791 1.00 0.00 H new ATOM 0 HA ILE A 34 5.423 -0.185 -4.839 1.00 0.00 H new ATOM 0 HB ILE A 34 6.429 2.674 -5.136 1.00 0.00 H new ATOM 0 HG12 ILE A 34 3.986 1.561 -3.701 1.00 0.00 H new ATOM 0 HG13 ILE A 34 5.439 2.123 -2.898 1.00 0.00 H new ATOM 0 HG21 ILE A 34 4.344 2.981 -6.411 1.00 0.00 H new ATOM 0 HG22 ILE A 34 5.393 1.765 -7.179 1.00 0.00 H new ATOM 0 HG23 ILE A 34 3.974 1.249 -6.236 1.00 0.00 H new ATOM 0 HD11 ILE A 34 3.702 3.870 -2.892 1.00 0.00 H new ATOM 0 HD12 ILE A 34 5.105 4.391 -3.855 1.00 0.00 H new ATOM 0 HD13 ILE A 34 3.630 3.820 -4.669 1.00 0.00 H new ATOM 533 N ASN A 35 6.539 -0.514 -7.062 1.00 0.00 N ATOM 534 CA ASN A 35 7.252 -0.948 -8.246 1.00 0.00 C ATOM 535 C ASN A 35 6.387 -0.669 -9.463 1.00 0.00 C ATOM 536 O ASN A 35 5.419 -1.379 -9.733 1.00 0.00 O ATOM 537 CB ASN A 35 7.593 -2.435 -8.110 1.00 0.00 C ATOM 538 CG ASN A 35 8.551 -2.917 -9.191 1.00 0.00 C ATOM 539 OD1 ASN A 35 8.882 -2.185 -10.118 1.00 0.00 O ATOM 540 ND2 ASN A 35 9.008 -4.160 -9.080 1.00 0.00 N ATOM 0 H ASN A 35 5.554 -0.778 -7.052 1.00 0.00 H new ATOM 0 HA ASN A 35 8.189 -0.404 -8.363 1.00 0.00 H new ATOM 0 HB2 ASN A 35 8.036 -2.614 -7.131 1.00 0.00 H new ATOM 0 HB3 ASN A 35 6.675 -3.020 -8.156 1.00 0.00 H new ATOM 0 HD21 ASN A 35 9.653 -4.530 -9.778 1.00 0.00 H new ATOM 0 HD22 ASN A 35 8.714 -4.744 -8.297 1.00 0.00 H new ATOM 547 N ALA A 36 6.756 0.386 -10.193 1.00 0.00 N ATOM 548 CA ALA A 36 6.035 0.840 -11.367 1.00 0.00 C ATOM 549 C ALA A 36 7.032 1.360 -12.404 1.00 0.00 C ATOM 550 O ALA A 36 8.137 1.767 -12.043 1.00 0.00 O ATOM 551 CB ALA A 36 5.080 1.950 -10.927 1.00 0.00 C ATOM 0 H ALA A 36 7.577 0.952 -9.976 1.00 0.00 H new ATOM 0 HA ALA A 36 5.469 0.026 -11.820 1.00 0.00 H new ATOM 0 HB1 ALA A 36 4.522 2.313 -11.790 1.00 0.00 H new ATOM 0 HB2 ALA A 36 4.385 1.559 -10.184 1.00 0.00 H new ATOM 0 HB3 ALA A 36 5.651 2.771 -10.493 1.00 0.00 H new ATOM 557 N PRO A 37 6.663 1.356 -13.690 1.00 0.00 N ATOM 558 CA PRO A 37 7.485 1.907 -14.752 1.00 0.00 C ATOM 559 C PRO A 37 7.533 3.426 -14.653 1.00 0.00 C ATOM 560 O PRO A 37 6.593 4.051 -14.161 1.00 0.00 O ATOM 561 CB PRO A 37 6.800 1.474 -16.050 1.00 0.00 C ATOM 562 CG PRO A 37 5.338 1.301 -15.650 1.00 0.00 C ATOM 563 CD PRO A 37 5.423 0.813 -14.212 1.00 0.00 C ATOM 0 HA PRO A 37 8.515 1.556 -14.698 1.00 0.00 H new ATOM 0 HB2 PRO A 37 6.915 2.224 -16.832 1.00 0.00 H new ATOM 0 HB3 PRO A 37 7.222 0.546 -16.435 1.00 0.00 H new ATOM 0 HG2 PRO A 37 4.787 2.239 -15.725 1.00 0.00 H new ATOM 0 HG3 PRO A 37 4.829 0.580 -16.290 1.00 0.00 H new ATOM 0 HD2 PRO A 37 4.568 1.157 -13.630 1.00 0.00 H new ATOM 0 HD3 PRO A 37 5.422 -0.276 -14.167 1.00 0.00 H new ATOM 571 N LYS A 38 8.625 4.034 -15.124 1.00 0.00 N ATOM 572 CA LYS A 38 8.740 5.488 -15.172 1.00 0.00 C ATOM 573 C LYS A 38 7.724 6.077 -16.151 1.00 0.00 C ATOM 574 O LYS A 38 7.643 7.295 -16.295 1.00 0.00 O ATOM 575 CB LYS A 38 10.173 5.885 -15.547 1.00 0.00 C ATOM 576 CG LYS A 38 11.163 5.545 -14.427 1.00 0.00 C ATOM 577 CD LYS A 38 10.945 6.331 -13.122 1.00 0.00 C ATOM 578 CE LYS A 38 11.341 7.810 -13.218 1.00 0.00 C ATOM 579 NZ LYS A 38 10.340 8.619 -13.940 1.00 0.00 N ATOM 0 H LYS A 38 9.443 3.537 -15.478 1.00 0.00 H new ATOM 0 HA LYS A 38 8.519 5.896 -14.186 1.00 0.00 H new ATOM 0 HB2 LYS A 38 10.466 5.370 -16.462 1.00 0.00 H new ATOM 0 HB3 LYS A 38 10.212 6.954 -15.756 1.00 0.00 H new ATOM 0 HG2 LYS A 38 11.094 4.479 -14.210 1.00 0.00 H new ATOM 0 HG3 LYS A 38 12.175 5.733 -14.785 1.00 0.00 H new ATOM 0 HD2 LYS A 38 9.895 6.263 -12.839 1.00 0.00 H new ATOM 0 HD3 LYS A 38 11.521 5.861 -12.325 1.00 0.00 H new ATOM 0 HE2 LYS A 38 11.473 8.213 -12.214 1.00 0.00 H new ATOM 0 HE3 LYS A 38 12.303 7.893 -13.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 10.681 8.815 -14.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 9.442 8.097 -13.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 10.191 9.517 -13.437 1.00 0.00 H new ATOM 593 N ASP A 39 6.952 5.212 -16.818 1.00 0.00 N ATOM 594 CA ASP A 39 5.847 5.608 -17.678 1.00 0.00 C ATOM 595 C ASP A 39 4.705 6.207 -16.851 1.00 0.00 C ATOM 596 O ASP A 39 3.771 6.781 -17.409 1.00 0.00 O ATOM 597 CB ASP A 39 5.356 4.371 -18.434 1.00 0.00 C ATOM 598 CG ASP A 39 4.404 4.748 -19.567 1.00 0.00 C ATOM 599 OD1 ASP A 39 4.841 5.509 -20.462 1.00 0.00 O ATOM 600 OD2 ASP A 39 3.246 4.273 -19.534 1.00 0.00 O ATOM 0 H ASP A 39 7.085 4.202 -16.770 1.00 0.00 H new ATOM 0 HA ASP A 39 6.186 6.369 -18.381 1.00 0.00 H new ATOM 0 HB2 ASP A 39 6.210 3.829 -18.840 1.00 0.00 H new ATOM 0 HB3 ASP A 39 4.851 3.697 -17.742 1.00 0.00 H new ATOM 605 N VAL A 40 4.783 6.072 -15.524 1.00 0.00 N ATOM 606 CA VAL A 40 3.787 6.590 -14.593 1.00 0.00 C ATOM 607 C VAL A 40 4.483 7.198 -13.378 1.00 0.00 C ATOM 608 O VAL A 40 5.650 6.900 -13.114 1.00 0.00 O ATOM 609 CB VAL A 40 2.809 5.485 -14.166 1.00 0.00 C ATOM 610 CG1 VAL A 40 2.164 4.822 -15.384 1.00 0.00 C ATOM 611 CG2 VAL A 40 3.489 4.392 -13.339 1.00 0.00 C ATOM 0 H VAL A 40 5.555 5.591 -15.063 1.00 0.00 H new ATOM 0 HA VAL A 40 3.210 7.367 -15.094 1.00 0.00 H new ATOM 0 HB VAL A 40 2.053 5.976 -13.554 1.00 0.00 H new ATOM 0 HG11 VAL A 40 1.476 4.044 -15.053 1.00 0.00 H new ATOM 0 HG12 VAL A 40 1.617 5.570 -15.958 1.00 0.00 H new ATOM 0 HG13 VAL A 40 2.939 4.379 -16.010 1.00 0.00 H new ATOM 0 HG21 VAL A 40 2.755 3.635 -13.062 1.00 0.00 H new ATOM 0 HG22 VAL A 40 4.282 3.930 -13.928 1.00 0.00 H new ATOM 0 HG23 VAL A 40 3.916 4.831 -12.437 1.00 0.00 H new ATOM 621 N ALA A 41 3.770 8.050 -12.636 1.00 0.00 N ATOM 622 CA ALA A 41 4.345 8.758 -11.504 1.00 0.00 C ATOM 623 C ALA A 41 3.919 8.126 -10.179 1.00 0.00 C ATOM 624 O ALA A 41 2.893 7.450 -10.111 1.00 0.00 O ATOM 625 CB ALA A 41 3.895 10.218 -11.560 1.00 0.00 C ATOM 0 H ALA A 41 2.787 8.263 -12.806 1.00 0.00 H new ATOM 0 HA ALA A 41 5.432 8.697 -11.562 1.00 0.00 H new ATOM 0 HB1 ALA A 41 4.319 10.762 -10.716 1.00 0.00 H new ATOM 0 HB2 ALA A 41 4.238 10.669 -12.491 1.00 0.00 H new ATOM 0 HB3 ALA A 41 2.807 10.265 -11.513 1.00 0.00 H new ATOM 631 N VAL A 42 4.709 8.349 -9.127 1.00 0.00 N ATOM 632 CA VAL A 42 4.377 7.894 -7.779 1.00 0.00 C ATOM 633 C VAL A 42 5.041 8.812 -6.757 1.00 0.00 C ATOM 634 O VAL A 42 6.212 9.154 -6.900 1.00 0.00 O ATOM 635 CB VAL A 42 4.823 6.434 -7.603 1.00 0.00 C ATOM 636 CG1 VAL A 42 6.258 6.197 -8.059 1.00 0.00 C ATOM 637 CG2 VAL A 42 4.727 5.975 -6.152 1.00 0.00 C ATOM 0 H VAL A 42 5.596 8.850 -9.187 1.00 0.00 H new ATOM 0 HA VAL A 42 3.299 7.936 -7.622 1.00 0.00 H new ATOM 0 HB VAL A 42 4.139 5.860 -8.228 1.00 0.00 H new ATOM 0 HG11 VAL A 42 6.518 5.149 -7.911 1.00 0.00 H new ATOM 0 HG12 VAL A 42 6.350 6.448 -9.116 1.00 0.00 H new ATOM 0 HG13 VAL A 42 6.933 6.824 -7.477 1.00 0.00 H new ATOM 0 HG21 VAL A 42 5.052 4.937 -6.076 1.00 0.00 H new ATOM 0 HG22 VAL A 42 5.365 6.602 -5.529 1.00 0.00 H new ATOM 0 HG23 VAL A 42 3.695 6.057 -5.812 1.00 0.00 H new ATOM 647 N HIS A 43 4.293 9.219 -5.725 1.00 0.00 N ATOM 648 CA HIS A 43 4.785 10.135 -4.701 1.00 0.00 C ATOM 649 C HIS A 43 3.962 9.998 -3.428 1.00 0.00 C ATOM 650 O HIS A 43 2.855 9.463 -3.465 1.00 0.00 O ATOM 651 CB HIS A 43 4.618 11.585 -5.172 1.00 0.00 C ATOM 652 CG HIS A 43 5.211 11.877 -6.520 1.00 0.00 C ATOM 653 ND1 HIS A 43 6.545 12.206 -6.766 1.00 0.00 N ATOM 654 CD2 HIS A 43 4.522 11.867 -7.698 1.00 0.00 C ATOM 655 CE1 HIS A 43 6.629 12.380 -8.094 1.00 0.00 C ATOM 656 NE2 HIS A 43 5.432 12.185 -8.677 1.00 0.00 N ATOM 0 H HIS A 43 3.329 8.920 -5.580 1.00 0.00 H new ATOM 0 HA HIS A 43 5.832 9.893 -4.518 1.00 0.00 H new ATOM 0 HB2 HIS A 43 3.555 11.825 -5.198 1.00 0.00 H new ATOM 0 HB3 HIS A 43 5.076 12.247 -4.437 1.00 0.00 H new ATOM 0 HD1 HIS A 43 7.296 12.295 -6.082 1.00 0.00 H new ATOM 0 HD2 HIS A 43 3.472 11.652 -7.833 1.00 0.00 H new ATOM 0 HE1 HIS A 43 7.534 12.641 -8.623 1.00 0.00 H new ATOM 664 N ARG A 44 4.486 10.477 -2.295 1.00 0.00 N ATOM 665 CA ARG A 44 3.682 10.554 -1.087 1.00 0.00 C ATOM 666 C ARG A 44 2.707 11.728 -1.226 1.00 0.00 C ATOM 667 O ARG A 44 2.930 12.639 -2.022 1.00 0.00 O ATOM 668 CB ARG A 44 4.562 10.629 0.163 1.00 0.00 C ATOM 669 CG ARG A 44 5.550 11.790 0.146 1.00 0.00 C ATOM 670 CD ARG A 44 6.460 11.659 1.371 1.00 0.00 C ATOM 671 NE ARG A 44 7.179 12.904 1.653 1.00 0.00 N ATOM 672 CZ ARG A 44 8.258 13.348 1.006 1.00 0.00 C ATOM 673 NH1 ARG A 44 8.815 12.638 0.029 1.00 0.00 N ATOM 674 NH2 ARG A 44 8.781 14.521 1.345 1.00 0.00 N ATOM 0 H ARG A 44 5.445 10.810 -2.196 1.00 0.00 H new ATOM 0 HA ARG A 44 3.095 9.644 -0.961 1.00 0.00 H new ATOM 0 HB2 ARG A 44 3.923 10.719 1.042 1.00 0.00 H new ATOM 0 HB3 ARG A 44 5.114 9.695 0.265 1.00 0.00 H new ATOM 0 HG2 ARG A 44 6.140 11.774 -0.770 1.00 0.00 H new ATOM 0 HG3 ARG A 44 5.019 12.742 0.166 1.00 0.00 H new ATOM 0 HD2 ARG A 44 5.862 11.380 2.239 1.00 0.00 H new ATOM 0 HD3 ARG A 44 7.177 10.855 1.206 1.00 0.00 H new ATOM 0 HE ARG A 44 6.822 13.484 2.413 1.00 0.00 H new ATOM 0 HH11 ARG A 44 8.417 11.737 -0.237 1.00 0.00 H new ATOM 0 HH12 ARG A 44 9.640 12.994 -0.454 1.00 0.00 H new ATOM 0 HH21 ARG A 44 8.358 15.071 2.092 1.00 0.00 H new ATOM 0 HH22 ARG A 44 9.606 14.871 0.858 1.00 0.00 H new ATOM 688 N GLU A 45 1.621 11.717 -0.454 1.00 0.00 N ATOM 689 CA GLU A 45 0.535 12.685 -0.600 1.00 0.00 C ATOM 690 C GLU A 45 0.990 14.131 -0.368 1.00 0.00 C ATOM 691 O GLU A 45 0.362 15.062 -0.862 1.00 0.00 O ATOM 692 CB GLU A 45 -0.590 12.262 0.351 1.00 0.00 C ATOM 693 CG GLU A 45 -1.912 12.986 0.098 1.00 0.00 C ATOM 694 CD GLU A 45 -2.037 14.327 0.823 1.00 0.00 C ATOM 695 OE1 GLU A 45 -1.177 14.625 1.685 1.00 0.00 O ATOM 696 OE2 GLU A 45 -3.005 15.054 0.508 1.00 0.00 O ATOM 0 H GLU A 45 1.469 11.036 0.290 1.00 0.00 H new ATOM 0 HA GLU A 45 0.175 12.679 -1.629 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -0.750 11.188 0.256 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -0.275 12.447 1.378 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -2.024 13.152 -0.973 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -2.733 12.340 0.408 1.00 0.00 H new ATOM 703 N GLU A 46 2.075 14.331 0.383 1.00 0.00 N ATOM 704 CA GLU A 46 2.617 15.664 0.659 1.00 0.00 C ATOM 705 C GLU A 46 3.555 16.145 -0.454 1.00 0.00 C ATOM 706 O GLU A 46 4.033 17.277 -0.410 1.00 0.00 O ATOM 707 CB GLU A 46 3.338 15.661 2.009 1.00 0.00 C ATOM 708 CG GLU A 46 4.403 14.569 2.082 1.00 0.00 C ATOM 709 CD GLU A 46 5.057 14.509 3.458 1.00 0.00 C ATOM 710 OE1 GLU A 46 4.358 14.116 4.417 1.00 0.00 O ATOM 711 OE2 GLU A 46 6.256 14.855 3.534 1.00 0.00 O ATOM 0 H GLU A 46 2.603 13.574 0.817 1.00 0.00 H new ATOM 0 HA GLU A 46 1.782 16.364 0.697 1.00 0.00 H new ATOM 0 HB2 GLU A 46 3.802 16.633 2.175 1.00 0.00 H new ATOM 0 HB3 GLU A 46 2.612 15.514 2.808 1.00 0.00 H new ATOM 0 HG2 GLU A 46 3.951 13.604 1.852 1.00 0.00 H new ATOM 0 HG3 GLU A 46 5.165 14.753 1.325 1.00 0.00 H new ATOM 718 N ILE A 47 3.822 15.292 -1.448 1.00 0.00 N ATOM 719 CA ILE A 47 4.672 15.618 -2.585 1.00 0.00 C ATOM 720 C ILE A 47 3.843 15.612 -3.862 1.00 0.00 C ATOM 721 O ILE A 47 4.094 16.420 -4.751 1.00 0.00 O ATOM 722 CB ILE A 47 5.814 14.600 -2.666 1.00 0.00 C ATOM 723 CG1 ILE A 47 6.787 14.760 -1.498 1.00 0.00 C ATOM 724 CG2 ILE A 47 6.570 14.743 -3.986 1.00 0.00 C ATOM 725 CD1 ILE A 47 7.376 16.164 -1.380 1.00 0.00 C ATOM 0 H ILE A 47 3.446 14.344 -1.481 1.00 0.00 H new ATOM 0 HA ILE A 47 5.099 16.613 -2.461 1.00 0.00 H new ATOM 0 HB ILE A 47 5.369 13.606 -2.612 1.00 0.00 H new ATOM 0 HG12 ILE A 47 6.271 14.512 -0.570 1.00 0.00 H new ATOM 0 HG13 ILE A 47 7.600 14.043 -1.612 1.00 0.00 H new ATOM 0 HG21 ILE A 47 7.377 14.011 -4.024 1.00 0.00 H new ATOM 0 HG22 ILE A 47 5.886 14.573 -4.817 1.00 0.00 H new ATOM 0 HG23 ILE A 47 6.987 15.747 -4.059 1.00 0.00 H new ATOM 0 HD11 ILE A 47 8.057 16.203 -0.530 1.00 0.00 H new ATOM 0 HD12 ILE A 47 7.920 16.408 -2.292 1.00 0.00 H new ATOM 0 HD13 ILE A 47 6.572 16.885 -1.234 1.00 0.00 H new ATOM 737 N TYR A 48 2.860 14.715 -3.964 1.00 0.00 N ATOM 738 CA TYR A 48 2.041 14.626 -5.161 1.00 0.00 C ATOM 739 C TYR A 48 1.385 15.970 -5.482 1.00 0.00 C ATOM 740 O TYR A 48 1.271 16.344 -6.648 1.00 0.00 O ATOM 741 CB TYR A 48 0.973 13.557 -4.952 1.00 0.00 C ATOM 742 CG TYR A 48 -0.116 13.627 -5.995 1.00 0.00 C ATOM 743 CD1 TYR A 48 0.209 13.597 -7.361 1.00 0.00 C ATOM 744 CD2 TYR A 48 -1.449 13.738 -5.586 1.00 0.00 C ATOM 745 CE1 TYR A 48 -0.804 13.714 -8.319 1.00 0.00 C ATOM 746 CE2 TYR A 48 -2.466 13.843 -6.538 1.00 0.00 C ATOM 747 CZ TYR A 48 -2.150 13.837 -7.913 1.00 0.00 C ATOM 748 OH TYR A 48 -3.137 13.947 -8.848 1.00 0.00 O ATOM 0 H TYR A 48 2.617 14.046 -3.233 1.00 0.00 H new ATOM 0 HA TYR A 48 2.676 14.357 -6.005 1.00 0.00 H new ATOM 0 HB2 TYR A 48 1.438 12.571 -4.980 1.00 0.00 H new ATOM 0 HB3 TYR A 48 0.533 13.674 -3.962 1.00 0.00 H new ATOM 0 HD1 TYR A 48 1.237 13.484 -7.671 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -1.692 13.743 -4.534 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -0.556 13.710 -9.370 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -3.495 13.929 -6.221 1.00 0.00 H new ATOM 0 HH TYR A 48 -4.005 14.022 -8.400 1.00 0.00 H new ATOM 758 N GLN A 49 0.952 16.700 -4.451 1.00 0.00 N ATOM 759 CA GLN A 49 0.316 17.996 -4.633 1.00 0.00 C ATOM 760 C GLN A 49 1.293 19.011 -5.216 1.00 0.00 C ATOM 761 O GLN A 49 0.876 20.016 -5.791 1.00 0.00 O ATOM 762 CB GLN A 49 -0.197 18.510 -3.286 1.00 0.00 C ATOM 763 CG GLN A 49 -1.221 17.554 -2.675 1.00 0.00 C ATOM 764 CD GLN A 49 -1.664 18.058 -1.307 1.00 0.00 C ATOM 765 OE1 GLN A 49 -2.372 19.057 -1.200 1.00 0.00 O ATOM 766 NE2 GLN A 49 -1.250 17.370 -0.248 1.00 0.00 N ATOM 0 H GLN A 49 1.034 16.408 -3.477 1.00 0.00 H new ATOM 0 HA GLN A 49 -0.514 17.872 -5.329 1.00 0.00 H new ATOM 0 HB2 GLN A 49 0.641 18.634 -2.600 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -0.649 19.493 -3.419 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -2.084 17.465 -3.334 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -0.788 16.558 -2.581 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -0.663 16.545 -0.373 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -1.519 17.667 0.690 1.00 0.00 H new ATOM 775 N ARG A 50 2.600 18.758 -5.066 1.00 0.00 N ATOM 776 CA ARG A 50 3.625 19.683 -5.518 1.00 0.00 C ATOM 777 C ARG A 50 3.918 19.489 -7.002 1.00 0.00 C ATOM 778 O ARG A 50 4.171 20.470 -7.697 1.00 0.00 O ATOM 779 CB ARG A 50 4.877 19.478 -4.669 1.00 0.00 C ATOM 780 CG ARG A 50 5.930 20.529 -5.007 1.00 0.00 C ATOM 781 CD ARG A 50 7.124 20.353 -4.076 1.00 0.00 C ATOM 782 NE ARG A 50 6.795 20.743 -2.698 1.00 0.00 N ATOM 783 CZ ARG A 50 7.386 20.249 -1.605 1.00 0.00 C ATOM 784 NH1 ARG A 50 8.364 19.351 -1.695 1.00 0.00 N ATOM 785 NH2 ARG A 50 6.999 20.655 -0.400 1.00 0.00 N ATOM 0 H ARG A 50 2.965 17.911 -4.630 1.00 0.00 H new ATOM 0 HA ARG A 50 3.275 20.708 -5.397 1.00 0.00 H new ATOM 0 HB2 ARG A 50 4.620 19.539 -3.611 1.00 0.00 H new ATOM 0 HB3 ARG A 50 5.282 18.481 -4.842 1.00 0.00 H new ATOM 0 HG2 ARG A 50 6.244 20.427 -6.046 1.00 0.00 H new ATOM 0 HG3 ARG A 50 5.512 21.530 -4.898 1.00 0.00 H new ATOM 0 HD2 ARG A 50 7.450 19.313 -4.093 1.00 0.00 H new ATOM 0 HD3 ARG A 50 7.959 20.954 -4.436 1.00 0.00 H new ATOM 0 HE ARG A 50 6.063 21.441 -2.566 1.00 0.00 H new ATOM 0 HH11 ARG A 50 8.676 19.027 -2.610 1.00 0.00 H new ATOM 0 HH12 ARG A 50 8.802 18.987 -0.849 1.00 0.00 H new ATOM 0 HH21 ARG A 50 6.252 21.343 -0.309 1.00 0.00 H new ATOM 0 HH22 ARG A 50 7.449 20.278 0.434 1.00 0.00 H new ATOM 799 N ILE A 51 3.888 18.249 -7.500 1.00 0.00 N ATOM 800 CA ILE A 51 4.068 17.992 -8.928 1.00 0.00 C ATOM 801 C ILE A 51 2.905 18.624 -9.694 1.00 0.00 C ATOM 802 O ILE A 51 2.999 18.864 -10.896 1.00 0.00 O ATOM 803 CB ILE A 51 4.193 16.486 -9.230 1.00 0.00 C ATOM 804 CG1 ILE A 51 5.484 15.873 -8.676 1.00 0.00 C ATOM 805 CG2 ILE A 51 4.274 16.239 -10.741 1.00 0.00 C ATOM 806 CD1 ILE A 51 5.497 15.736 -7.160 1.00 0.00 C ATOM 0 H ILE A 51 3.741 17.412 -6.936 1.00 0.00 H new ATOM 0 HA ILE A 51 5.004 18.445 -9.254 1.00 0.00 H new ATOM 0 HB ILE A 51 3.314 16.037 -8.768 1.00 0.00 H new ATOM 0 HG12 ILE A 51 5.628 14.889 -9.122 1.00 0.00 H new ATOM 0 HG13 ILE A 51 6.329 16.489 -8.983 1.00 0.00 H new ATOM 0 HG21 ILE A 51 4.362 15.169 -10.931 1.00 0.00 H new ATOM 0 HG22 ILE A 51 3.372 16.620 -11.221 1.00 0.00 H new ATOM 0 HG23 ILE A 51 5.146 16.752 -11.147 1.00 0.00 H new ATOM 0 HD11 ILE A 51 6.442 15.295 -6.843 1.00 0.00 H new ATOM 0 HD12 ILE A 51 5.385 16.720 -6.705 1.00 0.00 H new ATOM 0 HD13 ILE A 51 4.674 15.095 -6.846 1.00 0.00 H new ATOM 1635 N MET C 1 12.013 -0.165 -7.477 1.00 0.00 N ATOM 1636 CA MET C 1 11.417 0.022 -6.138 1.00 0.00 C ATOM 1637 C MET C 1 11.567 1.463 -5.683 1.00 0.00 C ATOM 1638 O MET C 1 12.661 2.011 -5.755 1.00 0.00 O ATOM 1639 CB MET C 1 12.093 -0.881 -5.104 1.00 0.00 C ATOM 1640 CG MET C 1 11.490 -0.679 -3.713 1.00 0.00 C ATOM 1641 SD MET C 1 9.883 -1.462 -3.482 1.00 0.00 S ATOM 1642 CE MET C 1 10.506 -3.131 -3.166 1.00 0.00 C ATOM 0 H1 MET C 1 11.901 -1.156 -7.772 1.00 0.00 H new ATOM 0 H2 MET C 1 11.534 0.456 -8.160 1.00 0.00 H new ATOM 0 H3 MET C 1 13.025 0.074 -7.443 1.00 0.00 H new ATOM 0 HA MET C 1 10.361 -0.238 -6.215 1.00 0.00 H new ATOM 0 HB2 MET C 1 11.984 -1.924 -5.402 1.00 0.00 H new ATOM 0 HB3 MET C 1 13.161 -0.667 -5.074 1.00 0.00 H new ATOM 0 HG2 MET C 1 12.183 -1.071 -2.969 1.00 0.00 H new ATOM 0 HG3 MET C 1 11.391 0.390 -3.524 1.00 0.00 H new ATOM 0 HE1 MET C 1 9.683 -3.773 -2.852 1.00 0.00 H new ATOM 0 HE2 MET C 1 10.952 -3.531 -4.077 1.00 0.00 H new ATOM 0 HE3 MET C 1 11.259 -3.095 -2.379 1.00 0.00 H new ATOM 1654 N LEU C 2 10.479 2.071 -5.212 1.00 0.00 N ATOM 1655 CA LEU C 2 10.516 3.401 -4.627 1.00 0.00 C ATOM 1656 C LEU C 2 9.862 3.298 -3.252 1.00 0.00 C ATOM 1657 O LEU C 2 8.650 3.111 -3.151 1.00 0.00 O ATOM 1658 CB LEU C 2 9.810 4.368 -5.583 1.00 0.00 C ATOM 1659 CG LEU C 2 9.965 5.855 -5.235 1.00 0.00 C ATOM 1660 CD1 LEU C 2 8.732 6.332 -4.484 1.00 0.00 C ATOM 1661 CD2 LEU C 2 11.173 6.181 -4.358 1.00 0.00 C ATOM 0 H LEU C 2 9.549 1.651 -5.227 1.00 0.00 H new ATOM 0 HA LEU C 2 11.525 3.789 -4.489 1.00 0.00 H new ATOM 0 HB2 LEU C 2 10.194 4.204 -6.590 1.00 0.00 H new ATOM 0 HB3 LEU C 2 8.748 4.124 -5.603 1.00 0.00 H new ATOM 0 HG LEU C 2 10.103 6.358 -6.192 1.00 0.00 H new ATOM 0 HD11 LEU C 2 8.842 7.388 -4.237 1.00 0.00 H new ATOM 0 HD12 LEU C 2 7.850 6.196 -5.109 1.00 0.00 H new ATOM 0 HD13 LEU C 2 8.619 5.755 -3.566 1.00 0.00 H new ATOM 0 HD21 LEU C 2 11.203 7.253 -4.163 1.00 0.00 H new ATOM 0 HD22 LEU C 2 11.093 5.643 -3.414 1.00 0.00 H new ATOM 0 HD23 LEU C 2 12.087 5.880 -4.871 1.00 0.00 H new ATOM 1673 N ILE C 3 10.676 3.414 -2.199 1.00 0.00 N ATOM 1674 CA ILE C 3 10.213 3.314 -0.824 1.00 0.00 C ATOM 1675 C ILE C 3 9.720 4.676 -0.357 1.00 0.00 C ATOM 1676 O ILE C 3 10.273 5.709 -0.735 1.00 0.00 O ATOM 1677 CB ILE C 3 11.339 2.841 0.111 1.00 0.00 C ATOM 1678 CG1 ILE C 3 11.769 1.399 -0.180 1.00 0.00 C ATOM 1679 CG2 ILE C 3 10.846 2.869 1.560 1.00 0.00 C ATOM 1680 CD1 ILE C 3 12.831 1.307 -1.268 1.00 0.00 C ATOM 0 H ILE C 3 11.679 3.581 -2.284 1.00 0.00 H new ATOM 0 HA ILE C 3 9.405 2.584 -0.790 1.00 0.00 H new ATOM 0 HB ILE C 3 12.183 3.512 -0.051 1.00 0.00 H new ATOM 0 HG12 ILE C 3 12.153 0.948 0.735 1.00 0.00 H new ATOM 0 HG13 ILE C 3 10.897 0.818 -0.480 1.00 0.00 H new ATOM 0 HG21 ILE C 3 11.644 2.534 2.222 1.00 0.00 H new ATOM 0 HG22 ILE C 3 10.556 3.886 1.826 1.00 0.00 H new ATOM 0 HG23 ILE C 3 9.986 2.208 1.665 1.00 0.00 H new ATOM 0 HD11 ILE C 3 13.096 0.262 -1.431 1.00 0.00 H new ATOM 0 HD12 ILE C 3 12.441 1.731 -2.194 1.00 0.00 H new ATOM 0 HD13 ILE C 3 13.717 1.862 -0.960 1.00 0.00 H new ATOM 1692 N LEU C 4 8.681 4.659 0.478 1.00 0.00 N ATOM 1693 CA LEU C 4 8.171 5.835 1.153 1.00 0.00 C ATOM 1694 C LEU C 4 7.727 5.409 2.548 1.00 0.00 C ATOM 1695 O LEU C 4 7.064 4.384 2.707 1.00 0.00 O ATOM 1696 CB LEU C 4 6.982 6.418 0.384 1.00 0.00 C ATOM 1697 CG LEU C 4 7.364 7.008 -0.981 1.00 0.00 C ATOM 1698 CD1 LEU C 4 6.100 7.451 -1.711 1.00 0.00 C ATOM 1699 CD2 LEU C 4 8.274 8.224 -0.832 1.00 0.00 C ATOM 0 H LEU C 4 8.166 3.808 0.703 1.00 0.00 H new ATOM 0 HA LEU C 4 8.943 6.602 1.210 1.00 0.00 H new ATOM 0 HB2 LEU C 4 6.236 5.637 0.237 1.00 0.00 H new ATOM 0 HB3 LEU C 4 6.514 7.195 0.989 1.00 0.00 H new ATOM 0 HG LEU C 4 7.893 6.236 -1.539 1.00 0.00 H new ATOM 0 HD11 LEU C 4 6.368 7.870 -2.681 1.00 0.00 H new ATOM 0 HD12 LEU C 4 5.444 6.593 -1.856 1.00 0.00 H new ATOM 0 HD13 LEU C 4 5.584 8.207 -1.119 1.00 0.00 H new ATOM 0 HD21 LEU C 4 8.524 8.615 -1.818 1.00 0.00 H new ATOM 0 HD22 LEU C 4 7.761 8.994 -0.256 1.00 0.00 H new ATOM 0 HD23 LEU C 4 9.188 7.933 -0.315 1.00 0.00 H new ATOM 1711 N THR C 5 8.090 6.194 3.566 1.00 0.00 N ATOM 1712 CA THR C 5 7.637 5.936 4.925 1.00 0.00 C ATOM 1713 C THR C 5 6.397 6.761 5.209 1.00 0.00 C ATOM 1714 O THR C 5 6.244 7.868 4.688 1.00 0.00 O ATOM 1715 CB THR C 5 8.713 6.289 5.960 1.00 0.00 C ATOM 1716 OG1 THR C 5 9.235 7.571 5.705 1.00 0.00 O ATOM 1717 CG2 THR C 5 9.854 5.282 5.930 1.00 0.00 C ATOM 0 H THR C 5 8.695 7.010 3.470 1.00 0.00 H new ATOM 0 HA THR C 5 7.419 4.871 5.005 1.00 0.00 H new ATOM 0 HB THR C 5 8.242 6.267 6.943 1.00 0.00 H new ATOM 0 HG1 THR C 5 9.919 7.785 6.373 1.00 0.00 H new ATOM 0 HG21 THR C 5 10.602 5.557 6.674 1.00 0.00 H new ATOM 0 HG22 THR C 5 9.468 4.288 6.154 1.00 0.00 H new ATOM 0 HG23 THR C 5 10.311 5.279 4.940 1.00 0.00 H new ATOM 1725 N ARG C 6 5.516 6.220 6.045 1.00 0.00 N ATOM 1726 CA ARG C 6 4.309 6.905 6.488 1.00 0.00 C ATOM 1727 C ARG C 6 4.027 6.495 7.925 1.00 0.00 C ATOM 1728 O ARG C 6 4.579 5.507 8.405 1.00 0.00 O ATOM 1729 CB ARG C 6 3.121 6.503 5.608 1.00 0.00 C ATOM 1730 CG ARG C 6 3.199 6.957 4.149 1.00 0.00 C ATOM 1731 CD ARG C 6 2.843 8.431 3.944 1.00 0.00 C ATOM 1732 NE ARG C 6 3.854 9.342 4.495 1.00 0.00 N ATOM 1733 CZ ARG C 6 3.754 10.672 4.456 1.00 0.00 C ATOM 1734 NH1 ARG C 6 2.713 11.263 3.873 1.00 0.00 N ATOM 1735 NH2 ARG C 6 4.696 11.431 5.003 1.00 0.00 N ATOM 0 H ARG C 6 5.622 5.284 6.437 1.00 0.00 H new ATOM 0 HA ARG C 6 4.451 7.983 6.416 1.00 0.00 H new ATOM 0 HB2 ARG C 6 3.027 5.417 5.628 1.00 0.00 H new ATOM 0 HB3 ARG C 6 2.211 6.910 6.049 1.00 0.00 H new ATOM 0 HG2 ARG C 6 4.208 6.781 3.776 1.00 0.00 H new ATOM 0 HG3 ARG C 6 2.526 6.343 3.550 1.00 0.00 H new ATOM 0 HD2 ARG C 6 2.726 8.627 2.878 1.00 0.00 H new ATOM 0 HD3 ARG C 6 1.881 8.636 4.413 1.00 0.00 H new ATOM 0 HE ARG C 6 4.680 8.935 4.933 1.00 0.00 H new ATOM 0 HH11 ARG C 6 1.978 10.698 3.448 1.00 0.00 H new ATOM 0 HH12 ARG C 6 2.651 12.281 3.851 1.00 0.00 H new ATOM 0 HH21 ARG C 6 5.501 10.998 5.456 1.00 0.00 H new ATOM 0 HH22 ARG C 6 4.615 12.447 4.970 1.00 0.00 H new ATOM 1749 N LYS C 7 3.165 7.252 8.599 1.00 0.00 N ATOM 1750 CA LYS C 7 2.703 6.941 9.946 1.00 0.00 C ATOM 1751 C LYS C 7 1.226 6.575 9.832 1.00 0.00 C ATOM 1752 O LYS C 7 0.555 7.040 8.912 1.00 0.00 O ATOM 1753 CB LYS C 7 2.904 8.167 10.847 1.00 0.00 C ATOM 1754 CG LYS C 7 3.442 7.845 12.246 1.00 0.00 C ATOM 1755 CD LYS C 7 4.916 7.427 12.204 1.00 0.00 C ATOM 1756 CE LYS C 7 5.501 7.278 13.609 1.00 0.00 C ATOM 1757 NZ LYS C 7 5.503 8.559 14.336 1.00 0.00 N ATOM 0 H LYS C 7 2.764 8.109 8.219 1.00 0.00 H new ATOM 0 HA LYS C 7 3.260 6.114 10.387 1.00 0.00 H new ATOM 0 HB2 LYS C 7 3.593 8.854 10.356 1.00 0.00 H new ATOM 0 HB3 LYS C 7 1.952 8.688 10.948 1.00 0.00 H new ATOM 0 HG2 LYS C 7 3.329 8.718 12.889 1.00 0.00 H new ATOM 0 HG3 LYS C 7 2.849 7.045 12.689 1.00 0.00 H new ATOM 0 HD2 LYS C 7 5.012 6.483 11.668 1.00 0.00 H new ATOM 0 HD3 LYS C 7 5.489 8.169 11.648 1.00 0.00 H new ATOM 0 HE2 LYS C 7 4.922 6.543 14.168 1.00 0.00 H new ATOM 0 HE3 LYS C 7 6.520 6.897 13.541 1.00 0.00 H new ATOM 0 HZ1 LYS C 7 6.163 8.502 15.138 1.00 0.00 H new ATOM 0 HZ2 LYS C 7 5.802 9.321 13.695 1.00 0.00 H new ATOM 0 HZ3 LYS C 7 4.546 8.759 14.689 1.00 0.00 H new ATOM 1771 N VAL C 8 0.702 5.749 10.740 1.00 0.00 N ATOM 1772 CA VAL C 8 -0.699 5.354 10.654 1.00 0.00 C ATOM 1773 C VAL C 8 -1.595 6.595 10.671 1.00 0.00 C ATOM 1774 O VAL C 8 -1.648 7.321 11.662 1.00 0.00 O ATOM 1775 CB VAL C 8 -1.065 4.326 11.732 1.00 0.00 C ATOM 1776 CG1 VAL C 8 -0.175 3.094 11.574 1.00 0.00 C ATOM 1777 CG2 VAL C 8 -0.919 4.832 13.165 1.00 0.00 C ATOM 0 H VAL C 8 1.216 5.350 11.526 1.00 0.00 H new ATOM 0 HA VAL C 8 -0.867 4.848 9.703 1.00 0.00 H new ATOM 0 HB VAL C 8 -2.121 4.101 11.580 1.00 0.00 H new ATOM 0 HG11 VAL C 8 -0.431 2.360 12.338 1.00 0.00 H new ATOM 0 HG12 VAL C 8 -0.328 2.659 10.587 1.00 0.00 H new ATOM 0 HG13 VAL C 8 0.870 3.383 11.685 1.00 0.00 H new ATOM 0 HG21 VAL C 8 -1.198 4.041 13.861 1.00 0.00 H new ATOM 0 HG22 VAL C 8 0.116 5.124 13.344 1.00 0.00 H new ATOM 0 HG23 VAL C 8 -1.570 5.693 13.315 1.00 0.00 H new ATOM 1787 N GLY C 9 -2.301 6.837 9.561 1.00 0.00 N ATOM 1788 CA GLY C 9 -3.158 8.005 9.406 1.00 0.00 C ATOM 1789 C GLY C 9 -2.723 8.906 8.251 1.00 0.00 C ATOM 1790 O GLY C 9 -3.286 9.986 8.078 1.00 0.00 O ATOM 0 H GLY C 9 -2.290 6.224 8.746 1.00 0.00 H new ATOM 0 HA2 GLY C 9 -4.184 7.678 9.240 1.00 0.00 H new ATOM 0 HA3 GLY C 9 -3.153 8.580 10.332 1.00 0.00 H new ATOM 1794 N GLU C 10 -1.731 8.481 7.458 1.00 0.00 N ATOM 1795 CA GLU C 10 -1.217 9.267 6.337 1.00 0.00 C ATOM 1796 C GLU C 10 -1.500 8.574 5.002 1.00 0.00 C ATOM 1797 O GLU C 10 -2.148 7.528 4.970 1.00 0.00 O ATOM 1798 CB GLU C 10 0.279 9.519 6.531 1.00 0.00 C ATOM 1799 CG GLU C 10 0.538 10.324 7.806 1.00 0.00 C ATOM 1800 CD GLU C 10 2.016 10.694 7.938 1.00 0.00 C ATOM 1801 OE1 GLU C 10 2.862 9.848 7.582 1.00 0.00 O ATOM 1802 OE2 GLU C 10 2.280 11.831 8.395 1.00 0.00 O ATOM 0 H GLU C 10 -1.264 7.582 7.578 1.00 0.00 H new ATOM 0 HA GLU C 10 -1.731 10.228 6.312 1.00 0.00 H new ATOM 0 HB2 GLU C 10 0.808 8.567 6.584 1.00 0.00 H new ATOM 0 HB3 GLU C 10 0.676 10.057 5.670 1.00 0.00 H new ATOM 0 HG2 GLU C 10 -0.067 11.231 7.795 1.00 0.00 H new ATOM 0 HG3 GLU C 10 0.227 9.744 8.675 1.00 0.00 H new ATOM 1809 N SER C 11 -1.015 9.153 3.893 1.00 0.00 N ATOM 1810 CA SER C 11 -1.390 8.684 2.563 1.00 0.00 C ATOM 1811 C SER C 11 -0.254 8.809 1.545 1.00 0.00 C ATOM 1812 O SER C 11 0.758 9.461 1.799 1.00 0.00 O ATOM 1813 CB SER C 11 -2.587 9.500 2.072 1.00 0.00 C ATOM 1814 OG SER C 11 -3.665 9.407 2.977 1.00 0.00 O ATOM 0 H SER C 11 -0.367 9.941 3.897 1.00 0.00 H new ATOM 0 HA SER C 11 -1.635 7.625 2.647 1.00 0.00 H new ATOM 0 HB2 SER C 11 -2.296 10.544 1.953 1.00 0.00 H new ATOM 0 HB3 SER C 11 -2.899 9.142 1.091 1.00 0.00 H new ATOM 0 HG SER C 11 -4.419 9.938 2.644 1.00 0.00 H new ATOM 1820 N ILE C 12 -0.448 8.168 0.387 1.00 0.00 N ATOM 1821 CA ILE C 12 0.498 8.111 -0.728 1.00 0.00 C ATOM 1822 C ILE C 12 -0.322 8.141 -2.027 1.00 0.00 C ATOM 1823 O ILE C 12 -1.525 7.891 -1.994 1.00 0.00 O ATOM 1824 CB ILE C 12 1.355 6.833 -0.607 1.00 0.00 C ATOM 1825 CG1 ILE C 12 2.139 6.845 0.714 1.00 0.00 C ATOM 1826 CG2 ILE C 12 2.327 6.687 -1.782 1.00 0.00 C ATOM 1827 CD1 ILE C 12 3.046 5.625 0.873 1.00 0.00 C ATOM 0 H ILE C 12 -1.307 7.653 0.195 1.00 0.00 H new ATOM 0 HA ILE C 12 1.185 8.957 -0.722 1.00 0.00 H new ATOM 0 HB ILE C 12 0.676 5.980 -0.624 1.00 0.00 H new ATOM 0 HG12 ILE C 12 2.743 7.751 0.765 1.00 0.00 H new ATOM 0 HG13 ILE C 12 1.438 6.882 1.548 1.00 0.00 H new ATOM 0 HG21 ILE C 12 2.912 5.775 -1.659 1.00 0.00 H new ATOM 0 HG22 ILE C 12 1.765 6.635 -2.715 1.00 0.00 H new ATOM 0 HG23 ILE C 12 2.997 7.547 -1.809 1.00 0.00 H new ATOM 0 HD11 ILE C 12 3.575 5.687 1.824 1.00 0.00 H new ATOM 0 HD12 ILE C 12 2.442 4.718 0.852 1.00 0.00 H new ATOM 0 HD13 ILE C 12 3.768 5.600 0.057 1.00 0.00 H new ATOM 1839 N ASN C 13 0.308 8.442 -3.164 1.00 0.00 N ATOM 1840 CA ASN C 13 -0.373 8.583 -4.445 1.00 0.00 C ATOM 1841 C ASN C 13 0.371 7.863 -5.564 1.00 0.00 C ATOM 1842 O ASN C 13 1.587 7.677 -5.505 1.00 0.00 O ATOM 1843 CB ASN C 13 -0.498 10.069 -4.788 1.00 0.00 C ATOM 1844 CG ASN C 13 -1.692 10.708 -4.098 1.00 0.00 C ATOM 1845 OD1 ASN C 13 -2.707 10.986 -4.722 1.00 0.00 O ATOM 1846 ND2 ASN C 13 -1.573 10.948 -2.796 1.00 0.00 N ATOM 0 H ASN C 13 1.315 8.596 -3.218 1.00 0.00 H new ATOM 0 HA ASN C 13 -1.360 8.129 -4.355 1.00 0.00 H new ATOM 0 HB2 ASN C 13 0.414 10.588 -4.493 1.00 0.00 H new ATOM 0 HB3 ASN C 13 -0.596 10.186 -5.867 1.00 0.00 H new ATOM 0 HD21 ASN C 13 -2.344 11.378 -2.284 1.00 0.00 H new ATOM 0 HD22 ASN C 13 -0.711 10.702 -2.309 1.00 0.00 H new ATOM 1853 N ILE C 14 -0.384 7.459 -6.588 1.00 0.00 N ATOM 1854 CA ILE C 14 0.137 6.757 -7.753 1.00 0.00 C ATOM 1855 C ILE C 14 -0.618 7.244 -8.987 1.00 0.00 C ATOM 1856 O ILE C 14 -1.836 7.432 -8.941 1.00 0.00 O ATOM 1857 CB ILE C 14 -0.034 5.240 -7.579 1.00 0.00 C ATOM 1858 CG1 ILE C 14 0.627 4.761 -6.279 1.00 0.00 C ATOM 1859 CG2 ILE C 14 0.569 4.512 -8.782 1.00 0.00 C ATOM 1860 CD1 ILE C 14 0.465 3.256 -6.066 1.00 0.00 C ATOM 0 H ILE C 14 -1.391 7.615 -6.627 1.00 0.00 H new ATOM 0 HA ILE C 14 1.201 6.963 -7.869 1.00 0.00 H new ATOM 0 HB ILE C 14 -1.098 5.013 -7.519 1.00 0.00 H new ATOM 0 HG12 ILE C 14 1.688 5.011 -6.300 1.00 0.00 H new ATOM 0 HG13 ILE C 14 0.191 5.294 -5.434 1.00 0.00 H new ATOM 0 HG21 ILE C 14 0.446 3.436 -8.655 1.00 0.00 H new ATOM 0 HG22 ILE C 14 0.061 4.831 -9.692 1.00 0.00 H new ATOM 0 HG23 ILE C 14 1.630 4.750 -8.857 1.00 0.00 H new ATOM 0 HD11 ILE C 14 0.949 2.966 -5.134 1.00 0.00 H new ATOM 0 HD12 ILE C 14 -0.595 3.008 -6.017 1.00 0.00 H new ATOM 0 HD13 ILE C 14 0.925 2.719 -6.896 1.00 0.00 H new ATOM 1872 N GLY C 15 0.105 7.452 -10.090 1.00 0.00 N ATOM 1873 CA GLY C 15 -0.487 7.978 -11.311 1.00 0.00 C ATOM 1874 C GLY C 15 -1.198 9.295 -11.019 1.00 0.00 C ATOM 1875 O GLY C 15 -0.697 10.126 -10.258 1.00 0.00 O ATOM 0 H GLY C 15 1.105 7.262 -10.157 1.00 0.00 H new ATOM 0 HA2 GLY C 15 0.287 8.132 -12.063 1.00 0.00 H new ATOM 0 HA3 GLY C 15 -1.193 7.257 -11.723 1.00 0.00 H new ATOM 1879 N ASP C 16 -2.366 9.482 -11.631 1.00 0.00 N ATOM 1880 CA ASP C 16 -3.205 10.654 -11.411 1.00 0.00 C ATOM 1881 C ASP C 16 -4.647 10.236 -11.110 1.00 0.00 C ATOM 1882 O ASP C 16 -5.545 11.076 -11.095 1.00 0.00 O ATOM 1883 CB ASP C 16 -3.101 11.613 -12.601 1.00 0.00 C ATOM 1884 CG ASP C 16 -3.641 11.017 -13.899 1.00 0.00 C ATOM 1885 OD1 ASP C 16 -3.048 10.026 -14.380 1.00 0.00 O ATOM 1886 OD2 ASP C 16 -4.650 11.559 -14.401 1.00 0.00 O ATOM 0 H ASP C 16 -2.758 8.818 -12.299 1.00 0.00 H new ATOM 0 HA ASP C 16 -2.847 11.194 -10.535 1.00 0.00 H new ATOM 0 HB2 ASP C 16 -3.649 12.527 -12.372 1.00 0.00 H new ATOM 0 HB3 ASP C 16 -2.058 11.894 -12.744 1.00 0.00 H new ATOM 1891 N ASP C 17 -4.863 8.934 -10.873 1.00 0.00 N ATOM 1892 CA ASP C 17 -6.181 8.377 -10.601 1.00 0.00 C ATOM 1893 C ASP C 17 -6.150 7.361 -9.458 1.00 0.00 C ATOM 1894 O ASP C 17 -7.160 6.701 -9.215 1.00 0.00 O ATOM 1895 CB ASP C 17 -6.744 7.711 -11.863 1.00 0.00 C ATOM 1896 CG ASP C 17 -6.963 8.707 -12.999 1.00 0.00 C ATOM 1897 OD1 ASP C 17 -7.846 9.580 -12.840 1.00 0.00 O ATOM 1898 OD2 ASP C 17 -6.244 8.590 -14.017 1.00 0.00 O ATOM 0 H ASP C 17 -4.117 8.239 -10.866 1.00 0.00 H new ATOM 0 HA ASP C 17 -6.825 9.203 -10.299 1.00 0.00 H new ATOM 0 HB2 ASP C 17 -6.059 6.931 -12.195 1.00 0.00 H new ATOM 0 HB3 ASP C 17 -7.689 7.225 -11.623 1.00 0.00 H new ATOM 1903 N ILE C 18 -5.022 7.213 -8.748 1.00 0.00 N ATOM 1904 CA ILE C 18 -4.939 6.251 -7.654 1.00 0.00 C ATOM 1905 C ILE C 18 -4.337 6.898 -6.411 1.00 0.00 C ATOM 1906 O ILE C 18 -3.443 7.742 -6.497 1.00 0.00 O ATOM 1907 CB ILE C 18 -4.127 5.017 -8.073 1.00 0.00 C ATOM 1908 CG1 ILE C 18 -4.698 4.322 -9.314 1.00 0.00 C ATOM 1909 CG2 ILE C 18 -4.116 3.993 -6.935 1.00 0.00 C ATOM 1910 CD1 ILE C 18 -4.088 4.872 -10.603 1.00 0.00 C ATOM 0 H ILE C 18 -4.167 7.743 -8.914 1.00 0.00 H new ATOM 0 HA ILE C 18 -5.950 5.924 -7.412 1.00 0.00 H new ATOM 0 HB ILE C 18 -3.124 5.375 -8.305 1.00 0.00 H new ATOM 0 HG12 ILE C 18 -4.508 3.251 -9.250 1.00 0.00 H new ATOM 0 HG13 ILE C 18 -5.780 4.453 -9.339 1.00 0.00 H new ATOM 0 HG21 ILE C 18 -3.539 3.119 -7.237 1.00 0.00 H new ATOM 0 HG22 ILE C 18 -3.663 4.438 -6.049 1.00 0.00 H new ATOM 0 HG23 ILE C 18 -5.138 3.691 -6.707 1.00 0.00 H new ATOM 0 HD11 ILE C 18 -4.519 4.353 -11.460 1.00 0.00 H new ATOM 0 HD12 ILE C 18 -4.300 5.938 -10.680 1.00 0.00 H new ATOM 0 HD13 ILE C 18 -3.009 4.717 -10.590 1.00 0.00 H new ATOM 1922 N THR C 19 -4.835 6.485 -5.245 1.00 0.00 N ATOM 1923 CA THR C 19 -4.370 6.968 -3.949 1.00 0.00 C ATOM 1924 C THR C 19 -4.311 5.792 -2.979 1.00 0.00 C ATOM 1925 O THR C 19 -5.006 4.792 -3.172 1.00 0.00 O ATOM 1926 CB THR C 19 -5.321 8.058 -3.439 1.00 0.00 C ATOM 1927 OG1 THR C 19 -5.483 9.053 -4.429 1.00 0.00 O ATOM 1928 CG2 THR C 19 -4.795 8.725 -2.168 1.00 0.00 C ATOM 0 H THR C 19 -5.583 5.796 -5.176 1.00 0.00 H new ATOM 0 HA THR C 19 -3.374 7.401 -4.038 1.00 0.00 H new ATOM 0 HB THR C 19 -6.272 7.577 -3.213 1.00 0.00 H new ATOM 0 HG1 THR C 19 -6.092 9.746 -4.099 1.00 0.00 H new ATOM 0 HG21 THR C 19 -5.499 9.490 -1.841 1.00 0.00 H new ATOM 0 HG22 THR C 19 -4.683 7.976 -1.384 1.00 0.00 H new ATOM 0 HG23 THR C 19 -3.828 9.185 -2.372 1.00 0.00 H new ATOM 1936 N ILE C 20 -3.485 5.911 -1.938 1.00 0.00 N ATOM 1937 CA ILE C 20 -3.253 4.860 -0.960 1.00 0.00 C ATOM 1938 C ILE C 20 -3.293 5.489 0.429 1.00 0.00 C ATOM 1939 O ILE C 20 -2.927 6.653 0.587 1.00 0.00 O ATOM 1940 CB ILE C 20 -1.865 4.236 -1.207 1.00 0.00 C ATOM 1941 CG1 ILE C 20 -1.682 3.743 -2.649 1.00 0.00 C ATOM 1942 CG2 ILE C 20 -1.613 3.076 -0.236 1.00 0.00 C ATOM 1943 CD1 ILE C 20 -2.575 2.554 -2.993 1.00 0.00 C ATOM 0 H ILE C 20 -2.951 6.760 -1.752 1.00 0.00 H new ATOM 0 HA ILE C 20 -4.013 4.083 -1.043 1.00 0.00 H new ATOM 0 HB ILE C 20 -1.138 5.029 -1.035 1.00 0.00 H new ATOM 0 HG12 ILE C 20 -1.896 4.561 -3.336 1.00 0.00 H new ATOM 0 HG13 ILE C 20 -0.640 3.463 -2.801 1.00 0.00 H new ATOM 0 HG21 ILE C 20 -0.628 2.649 -0.427 1.00 0.00 H new ATOM 0 HG22 ILE C 20 -1.657 3.444 0.789 1.00 0.00 H new ATOM 0 HG23 ILE C 20 -2.375 2.309 -0.379 1.00 0.00 H new ATOM 0 HD11 ILE C 20 -2.398 2.253 -4.026 1.00 0.00 H new ATOM 0 HD12 ILE C 20 -2.345 1.722 -2.328 1.00 0.00 H new ATOM 0 HD13 ILE C 20 -3.621 2.837 -2.871 1.00 0.00 H new ATOM 1955 N THR C 21 -3.729 4.728 1.436 1.00 0.00 N ATOM 1956 CA THR C 21 -3.845 5.237 2.795 1.00 0.00 C ATOM 1957 C THR C 21 -3.437 4.154 3.783 1.00 0.00 C ATOM 1958 O THR C 21 -3.942 3.034 3.723 1.00 0.00 O ATOM 1959 CB THR C 21 -5.289 5.674 3.059 1.00 0.00 C ATOM 1960 OG1 THR C 21 -5.734 6.547 2.047 1.00 0.00 O ATOM 1961 CG2 THR C 21 -5.400 6.384 4.404 1.00 0.00 C ATOM 0 H THR C 21 -4.008 3.753 1.329 1.00 0.00 H new ATOM 0 HA THR C 21 -3.186 6.096 2.919 1.00 0.00 H new ATOM 0 HB THR C 21 -5.910 4.778 3.069 1.00 0.00 H new ATOM 0 HG1 THR C 21 -6.659 6.815 2.230 1.00 0.00 H new ATOM 0 HG21 THR C 21 -6.434 6.686 4.572 1.00 0.00 H new ATOM 0 HG22 THR C 21 -5.086 5.708 5.199 1.00 0.00 H new ATOM 0 HG23 THR C 21 -4.760 7.266 4.404 1.00 0.00 H new ATOM 1969 N ILE C 22 -2.520 4.483 4.697 1.00 0.00 N ATOM 1970 CA ILE C 22 -2.112 3.560 5.749 1.00 0.00 C ATOM 1971 C ILE C 22 -3.115 3.662 6.897 1.00 0.00 C ATOM 1972 O ILE C 22 -2.988 4.497 7.792 1.00 0.00 O ATOM 1973 CB ILE C 22 -0.655 3.818 6.161 1.00 0.00 C ATOM 1974 CG1 ILE C 22 -0.280 3.029 7.420 1.00 0.00 C ATOM 1975 CG2 ILE C 22 -0.354 5.297 6.402 1.00 0.00 C ATOM 1976 CD1 ILE C 22 -0.526 1.532 7.241 1.00 0.00 C ATOM 0 H ILE C 22 -2.047 5.386 4.726 1.00 0.00 H new ATOM 0 HA ILE C 22 -2.127 2.529 5.395 1.00 0.00 H new ATOM 0 HB ILE C 22 -0.053 3.480 5.317 1.00 0.00 H new ATOM 0 HG12 ILE C 22 0.770 3.200 7.657 1.00 0.00 H new ATOM 0 HG13 ILE C 22 -0.862 3.395 8.266 1.00 0.00 H new ATOM 0 HG21 ILE C 22 0.691 5.413 6.690 1.00 0.00 H new ATOM 0 HG22 ILE C 22 -0.544 5.860 5.488 1.00 0.00 H new ATOM 0 HG23 ILE C 22 -0.994 5.673 7.200 1.00 0.00 H new ATOM 0 HD11 ILE C 22 -0.248 1.006 8.154 1.00 0.00 H new ATOM 0 HD12 ILE C 22 -1.581 1.359 7.029 1.00 0.00 H new ATOM 0 HD13 ILE C 22 0.076 1.161 6.411 1.00 0.00 H new ATOM 1988 N LEU C 23 -4.129 2.795 6.856 1.00 0.00 N ATOM 1989 CA LEU C 23 -5.217 2.817 7.822 1.00 0.00 C ATOM 1990 C LEU C 23 -4.718 2.445 9.217 1.00 0.00 C ATOM 1991 O LEU C 23 -5.240 2.953 10.210 1.00 0.00 O ATOM 1992 CB LEU C 23 -6.313 1.845 7.375 1.00 0.00 C ATOM 1993 CG LEU C 23 -6.748 2.081 5.926 1.00 0.00 C ATOM 1994 CD1 LEU C 23 -7.820 1.064 5.556 1.00 0.00 C ATOM 1995 CD2 LEU C 23 -7.331 3.476 5.721 1.00 0.00 C ATOM 0 H LEU C 23 -4.214 2.062 6.152 1.00 0.00 H new ATOM 0 HA LEU C 23 -5.623 3.827 7.870 1.00 0.00 H new ATOM 0 HB2 LEU C 23 -5.953 0.822 7.481 1.00 0.00 H new ATOM 0 HB3 LEU C 23 -7.177 1.948 8.032 1.00 0.00 H new ATOM 0 HG LEU C 23 -5.863 1.979 5.298 1.00 0.00 H new ATOM 0 HD11 LEU C 23 -8.135 1.226 4.525 1.00 0.00 H new ATOM 0 HD12 LEU C 23 -7.417 0.057 5.658 1.00 0.00 H new ATOM 0 HD13 LEU C 23 -8.677 1.181 6.220 1.00 0.00 H new ATOM 0 HD21 LEU C 23 -7.625 3.598 4.679 1.00 0.00 H new ATOM 0 HD22 LEU C 23 -8.203 3.603 6.362 1.00 0.00 H new ATOM 0 HD23 LEU C 23 -6.581 4.225 5.976 1.00 0.00 H new ATOM 2007 N GLY C 24 -3.714 1.565 9.309 1.00 0.00 N ATOM 2008 CA GLY C 24 -3.117 1.235 10.600 1.00 0.00 C ATOM 2009 C GLY C 24 -2.416 -0.114 10.592 1.00 0.00 C ATOM 2010 O GLY C 24 -2.196 -0.696 9.533 1.00 0.00 O ATOM 0 H GLY C 24 -3.305 1.076 8.513 1.00 0.00 H new ATOM 0 HA2 GLY C 24 -2.402 2.010 10.874 1.00 0.00 H new ATOM 0 HA3 GLY C 24 -3.893 1.232 11.365 1.00 0.00 H new ATOM 2014 N VAL C 25 -2.067 -0.616 11.782 1.00 0.00 N ATOM 2015 CA VAL C 25 -1.414 -1.913 11.931 1.00 0.00 C ATOM 2016 C VAL C 25 -2.109 -2.716 13.023 1.00 0.00 C ATOM 2017 O VAL C 25 -2.846 -2.165 13.842 1.00 0.00 O ATOM 2018 CB VAL C 25 0.089 -1.755 12.230 1.00 0.00 C ATOM 2019 CG1 VAL C 25 0.744 -0.781 11.253 1.00 0.00 C ATOM 2020 CG2 VAL C 25 0.322 -1.258 13.655 1.00 0.00 C ATOM 0 H VAL C 25 -2.231 -0.132 12.665 1.00 0.00 H new ATOM 0 HA VAL C 25 -1.498 -2.454 10.988 1.00 0.00 H new ATOM 0 HB VAL C 25 0.540 -2.741 12.116 1.00 0.00 H new ATOM 0 HG11 VAL C 25 1.804 -0.689 11.487 1.00 0.00 H new ATOM 0 HG12 VAL C 25 0.628 -1.154 10.235 1.00 0.00 H new ATOM 0 HG13 VAL C 25 0.267 0.195 11.338 1.00 0.00 H new ATOM 0 HG21 VAL C 25 1.392 -1.157 13.835 1.00 0.00 H new ATOM 0 HG22 VAL C 25 -0.161 -0.290 13.786 1.00 0.00 H new ATOM 0 HG23 VAL C 25 -0.099 -1.972 14.363 1.00 0.00 H new ATOM 2030 N SER C 26 -1.868 -4.030 13.030 1.00 0.00 N ATOM 2031 CA SER C 26 -2.433 -4.958 13.998 1.00 0.00 C ATOM 2032 C SER C 26 -1.422 -6.072 14.202 1.00 0.00 C ATOM 2033 O SER C 26 -1.517 -7.129 13.579 1.00 0.00 O ATOM 2034 CB SER C 26 -3.768 -5.515 13.503 1.00 0.00 C ATOM 2035 OG SER C 26 -4.743 -4.491 13.426 1.00 0.00 O ATOM 0 H SER C 26 -1.261 -4.482 12.346 1.00 0.00 H new ATOM 0 HA SER C 26 -2.633 -4.450 14.941 1.00 0.00 H new ATOM 0 HB2 SER C 26 -3.635 -5.971 12.522 1.00 0.00 H new ATOM 0 HB3 SER C 26 -4.111 -6.300 14.176 1.00 0.00 H new ATOM 0 HG SER C 26 -5.589 -4.868 13.106 1.00 0.00 H new ATOM 2041 N GLY C 27 -0.443 -5.840 15.077 1.00 0.00 N ATOM 2042 CA GLY C 27 0.672 -6.752 15.232 1.00 0.00 C ATOM 2043 C GLY C 27 1.620 -6.535 14.064 1.00 0.00 C ATOM 2044 O GLY C 27 2.183 -5.453 13.927 1.00 0.00 O ATOM 0 H GLY C 27 -0.407 -5.024 15.687 1.00 0.00 H new ATOM 0 HA2 GLY C 27 1.184 -6.571 16.177 1.00 0.00 H new ATOM 0 HA3 GLY C 27 0.321 -7.784 15.252 1.00 0.00 H new ATOM 2048 N GLN C 28 1.788 -7.561 13.226 1.00 0.00 N ATOM 2049 CA GLN C 28 2.627 -7.468 12.041 1.00 0.00 C ATOM 2050 C GLN C 28 1.754 -7.278 10.808 1.00 0.00 C ATOM 2051 O GLN C 28 2.268 -7.193 9.696 1.00 0.00 O ATOM 2052 CB GLN C 28 3.516 -8.706 11.938 1.00 0.00 C ATOM 2053 CG GLN C 28 4.857 -8.461 12.628 1.00 0.00 C ATOM 2054 CD GLN C 28 4.697 -7.763 13.976 1.00 0.00 C ATOM 2055 OE1 GLN C 28 4.364 -8.390 14.977 1.00 0.00 O ATOM 2056 NE2 GLN C 28 4.931 -6.450 14.003 1.00 0.00 N ATOM 0 H GLN C 28 1.347 -8.472 13.353 1.00 0.00 H new ATOM 0 HA GLN C 28 3.284 -6.601 12.114 1.00 0.00 H new ATOM 0 HB2 GLN C 28 3.016 -9.559 12.396 1.00 0.00 H new ATOM 0 HB3 GLN C 28 3.680 -8.957 10.890 1.00 0.00 H new ATOM 0 HG2 GLN C 28 5.368 -9.413 12.773 1.00 0.00 H new ATOM 0 HG3 GLN C 28 5.491 -7.855 11.981 1.00 0.00 H new ATOM 0 HE21 GLN C 28 5.206 -5.963 13.150 1.00 0.00 H new ATOM 0 HE22 GLN C 28 4.835 -5.933 14.877 1.00 0.00 H new ATOM 2065 N GLN C 29 0.434 -7.209 10.998 1.00 0.00 N ATOM 2066 CA GLN C 29 -0.463 -6.875 9.914 1.00 0.00 C ATOM 2067 C GLN C 29 -0.456 -5.372 9.688 1.00 0.00 C ATOM 2068 O GLN C 29 -0.064 -4.601 10.561 1.00 0.00 O ATOM 2069 CB GLN C 29 -1.893 -7.288 10.238 1.00 0.00 C ATOM 2070 CG GLN C 29 -2.112 -8.786 10.082 1.00 0.00 C ATOM 2071 CD GLN C 29 -3.604 -9.066 10.071 1.00 0.00 C ATOM 2072 OE1 GLN C 29 -4.178 -9.342 9.019 1.00 0.00 O ATOM 2073 NE2 GLN C 29 -4.241 -9.002 11.234 1.00 0.00 N ATOM 0 H GLN C 29 -0.026 -7.381 11.892 1.00 0.00 H new ATOM 0 HA GLN C 29 -0.120 -7.406 9.026 1.00 0.00 H new ATOM 0 HB2 GLN C 29 -2.131 -6.993 11.260 1.00 0.00 H new ATOM 0 HB3 GLN C 29 -2.580 -6.753 9.583 1.00 0.00 H new ATOM 0 HG2 GLN C 29 -1.655 -9.140 9.158 1.00 0.00 H new ATOM 0 HG3 GLN C 29 -1.633 -9.324 10.900 1.00 0.00 H new ATOM 0 HE21 GLN C 29 -3.728 -8.770 12.084 1.00 0.00 H new ATOM 0 HE22 GLN C 29 -5.243 -9.185 11.277 1.00 0.00 H new ATOM 2082 N VAL C 30 -0.902 -4.969 8.500 1.00 0.00 N ATOM 2083 CA VAL C 30 -1.049 -3.579 8.130 1.00 0.00 C ATOM 2084 C VAL C 30 -2.336 -3.445 7.331 1.00 0.00 C ATOM 2085 O VAL C 30 -2.476 -4.073 6.280 1.00 0.00 O ATOM 2086 CB VAL C 30 0.153 -3.139 7.288 1.00 0.00 C ATOM 2087 CG1 VAL C 30 0.012 -1.657 6.948 1.00 0.00 C ATOM 2088 CG2 VAL C 30 1.465 -3.342 8.044 1.00 0.00 C ATOM 0 H VAL C 30 -1.174 -5.617 7.761 1.00 0.00 H new ATOM 0 HA VAL C 30 -1.092 -2.945 9.016 1.00 0.00 H new ATOM 0 HB VAL C 30 0.173 -3.746 6.383 1.00 0.00 H new ATOM 0 HG11 VAL C 30 0.865 -1.338 6.349 1.00 0.00 H new ATOM 0 HG12 VAL C 30 -0.907 -1.499 6.384 1.00 0.00 H new ATOM 0 HG13 VAL C 30 -0.023 -1.074 7.868 1.00 0.00 H new ATOM 0 HG21 VAL C 30 2.298 -3.020 7.419 1.00 0.00 H new ATOM 0 HG22 VAL C 30 1.451 -2.754 8.962 1.00 0.00 H new ATOM 0 HG23 VAL C 30 1.583 -4.397 8.291 1.00 0.00 H new ATOM 2098 N ARG C 31 -3.279 -2.631 7.817 1.00 0.00 N ATOM 2099 CA ARG C 31 -4.466 -2.308 7.044 1.00 0.00 C ATOM 2100 C ARG C 31 -4.090 -1.208 6.072 1.00 0.00 C ATOM 2101 O ARG C 31 -3.689 -0.118 6.484 1.00 0.00 O ATOM 2102 CB ARG C 31 -5.616 -1.818 7.931 1.00 0.00 C ATOM 2103 CG ARG C 31 -6.353 -2.981 8.594 1.00 0.00 C ATOM 2104 CD ARG C 31 -7.777 -2.550 8.949 1.00 0.00 C ATOM 2105 NE ARG C 31 -7.807 -1.434 9.900 1.00 0.00 N ATOM 2106 CZ ARG C 31 -8.923 -0.768 10.222 1.00 0.00 C ATOM 2107 NH1 ARG C 31 -10.094 -1.102 9.689 1.00 0.00 N ATOM 2108 NH2 ARG C 31 -8.874 0.235 11.092 1.00 0.00 N ATOM 0 H ARG C 31 -3.237 -2.190 8.736 1.00 0.00 H new ATOM 0 HA ARG C 31 -4.810 -3.207 6.532 1.00 0.00 H new ATOM 0 HB2 ARG C 31 -5.225 -1.150 8.698 1.00 0.00 H new ATOM 0 HB3 ARG C 31 -6.317 -1.238 7.331 1.00 0.00 H new ATOM 0 HG2 ARG C 31 -6.379 -3.839 7.922 1.00 0.00 H new ATOM 0 HG3 ARG C 31 -5.823 -3.296 9.493 1.00 0.00 H new ATOM 0 HD2 ARG C 31 -8.303 -2.261 8.039 1.00 0.00 H new ATOM 0 HD3 ARG C 31 -8.315 -3.398 9.373 1.00 0.00 H new ATOM 0 HE ARG C 31 -6.931 -1.150 10.339 1.00 0.00 H new ATOM 0 HH11 ARG C 31 -10.151 -1.875 9.025 1.00 0.00 H new ATOM 0 HH12 ARG C 31 -10.936 -0.586 9.944 1.00 0.00 H new ATOM 0 HH21 ARG C 31 -7.985 0.499 11.516 1.00 0.00 H new ATOM 0 HH22 ARG C 31 -9.726 0.741 11.336 1.00 0.00 H new ATOM 2122 N ILE C 32 -4.223 -1.508 4.781 1.00 0.00 N ATOM 2123 CA ILE C 32 -3.912 -0.579 3.709 1.00 0.00 C ATOM 2124 C ILE C 32 -5.184 -0.331 2.915 1.00 0.00 C ATOM 2125 O ILE C 32 -5.853 -1.279 2.503 1.00 0.00 O ATOM 2126 CB ILE C 32 -2.819 -1.169 2.805 1.00 0.00 C ATOM 2127 CG1 ILE C 32 -1.687 -1.802 3.632 1.00 0.00 C ATOM 2128 CG2 ILE C 32 -2.289 -0.061 1.893 1.00 0.00 C ATOM 2129 CD1 ILE C 32 -0.542 -2.306 2.753 1.00 0.00 C ATOM 0 H ILE C 32 -4.554 -2.415 4.452 1.00 0.00 H new ATOM 0 HA ILE C 32 -3.541 0.361 4.116 1.00 0.00 H new ATOM 0 HB ILE C 32 -3.244 -1.968 2.197 1.00 0.00 H new ATOM 0 HG12 ILE C 32 -1.303 -1.068 4.341 1.00 0.00 H new ATOM 0 HG13 ILE C 32 -2.086 -2.631 4.216 1.00 0.00 H new ATOM 0 HG21 ILE C 32 -1.511 -0.464 1.244 1.00 0.00 H new ATOM 0 HG22 ILE C 32 -3.104 0.329 1.283 1.00 0.00 H new ATOM 0 HG23 ILE C 32 -1.874 0.743 2.501 1.00 0.00 H new ATOM 0 HD11 ILE C 32 0.233 -2.744 3.381 1.00 0.00 H new ATOM 0 HD12 ILE C 32 -0.919 -3.060 2.062 1.00 0.00 H new ATOM 0 HD13 ILE C 32 -0.123 -1.473 2.188 1.00 0.00 H new ATOM 2141 N GLY C 33 -5.518 0.939 2.704 1.00 0.00 N ATOM 2142 CA GLY C 33 -6.676 1.329 1.925 1.00 0.00 C ATOM 2143 C GLY C 33 -6.211 1.790 0.553 1.00 0.00 C ATOM 2144 O GLY C 33 -5.101 2.312 0.412 1.00 0.00 O ATOM 0 H GLY C 33 -4.986 1.727 3.073 1.00 0.00 H new ATOM 0 HA2 GLY C 33 -7.365 0.490 1.828 1.00 0.00 H new ATOM 0 HA3 GLY C 33 -7.217 2.130 2.429 1.00 0.00 H new ATOM 2148 N ILE C 34 -7.056 1.604 -0.461 1.00 0.00 N ATOM 2149 CA ILE C 34 -6.738 2.008 -1.817 1.00 0.00 C ATOM 2150 C ILE C 34 -7.957 2.707 -2.397 1.00 0.00 C ATOM 2151 O ILE C 34 -9.089 2.336 -2.098 1.00 0.00 O ATOM 2152 CB ILE C 34 -6.326 0.784 -2.649 1.00 0.00 C ATOM 2153 CG1 ILE C 34 -5.154 0.069 -1.970 1.00 0.00 C ATOM 2154 CG2 ILE C 34 -5.956 1.234 -4.067 1.00 0.00 C ATOM 2155 CD1 ILE C 34 -4.721 -1.198 -2.712 1.00 0.00 C ATOM 0 H ILE C 34 -7.974 1.171 -0.359 1.00 0.00 H new ATOM 0 HA ILE C 34 -5.894 2.698 -1.830 1.00 0.00 H new ATOM 0 HB ILE C 34 -7.157 0.082 -2.716 1.00 0.00 H new ATOM 0 HG12 ILE C 34 -4.307 0.752 -1.903 1.00 0.00 H new ATOM 0 HG13 ILE C 34 -5.435 -0.191 -0.950 1.00 0.00 H new ATOM 0 HG21 ILE C 34 -5.663 0.367 -4.659 1.00 0.00 H new ATOM 0 HG22 ILE C 34 -6.816 1.717 -4.531 1.00 0.00 H new ATOM 0 HG23 ILE C 34 -5.126 1.938 -4.020 1.00 0.00 H new ATOM 0 HD11 ILE C 34 -3.887 -1.662 -2.185 1.00 0.00 H new ATOM 0 HD12 ILE C 34 -5.556 -1.897 -2.756 1.00 0.00 H new ATOM 0 HD13 ILE C 34 -4.411 -0.939 -3.724 1.00 0.00 H new ATOM 2167 N ASN C 35 -7.720 3.721 -3.227 1.00 0.00 N ATOM 2168 CA ASN C 35 -8.788 4.510 -3.809 1.00 0.00 C ATOM 2169 C ASN C 35 -8.488 4.732 -5.287 1.00 0.00 C ATOM 2170 O ASN C 35 -7.638 5.547 -5.644 1.00 0.00 O ATOM 2171 CB ASN C 35 -8.924 5.821 -3.032 1.00 0.00 C ATOM 2172 CG ASN C 35 -10.169 6.598 -3.436 1.00 0.00 C ATOM 2173 OD1 ASN C 35 -10.885 6.222 -4.360 1.00 0.00 O ATOM 2174 ND2 ASN C 35 -10.436 7.694 -2.731 1.00 0.00 N ATOM 0 H ASN C 35 -6.784 4.013 -3.510 1.00 0.00 H new ATOM 0 HA ASN C 35 -9.744 3.991 -3.741 1.00 0.00 H new ATOM 0 HB2 ASN C 35 -8.961 5.607 -1.964 1.00 0.00 H new ATOM 0 HB3 ASN C 35 -8.041 6.437 -3.203 1.00 0.00 H new ATOM 0 HD21 ASN C 35 -11.260 8.254 -2.951 1.00 0.00 H new ATOM 0 HD22 ASN C 35 -9.817 7.974 -1.970 1.00 0.00 H new ATOM 2181 N ALA C 36 -9.203 3.988 -6.133 1.00 0.00 N ATOM 2182 CA ALA C 36 -9.042 4.032 -7.572 1.00 0.00 C ATOM 2183 C ALA C 36 -10.411 3.840 -8.229 1.00 0.00 C ATOM 2184 O ALA C 36 -11.304 3.249 -7.619 1.00 0.00 O ATOM 2185 CB ALA C 36 -8.087 2.907 -7.979 1.00 0.00 C ATOM 0 H ALA C 36 -9.919 3.331 -5.824 1.00 0.00 H new ATOM 0 HA ALA C 36 -8.632 4.990 -7.893 1.00 0.00 H new ATOM 0 HB1 ALA C 36 -7.950 2.920 -9.060 1.00 0.00 H new ATOM 0 HB2 ALA C 36 -7.124 3.052 -7.489 1.00 0.00 H new ATOM 0 HB3 ALA C 36 -8.506 1.947 -7.678 1.00 0.00 H new ATOM 2191 N PRO C 37 -10.598 4.330 -9.460 1.00 0.00 N ATOM 2192 CA PRO C 37 -11.823 4.131 -10.208 1.00 0.00 C ATOM 2193 C PRO C 37 -11.942 2.673 -10.627 1.00 0.00 C ATOM 2194 O PRO C 37 -10.932 1.999 -10.822 1.00 0.00 O ATOM 2195 CB PRO C 37 -11.689 5.045 -11.432 1.00 0.00 C ATOM 2196 CG PRO C 37 -10.180 5.156 -11.643 1.00 0.00 C ATOM 2197 CD PRO C 37 -9.637 5.107 -10.223 1.00 0.00 C ATOM 0 HA PRO C 37 -12.715 4.366 -9.627 1.00 0.00 H new ATOM 0 HB2 PRO C 37 -12.184 4.619 -12.305 1.00 0.00 H new ATOM 0 HB3 PRO C 37 -12.140 6.021 -11.253 1.00 0.00 H new ATOM 0 HG2 PRO C 37 -9.795 4.338 -12.252 1.00 0.00 H new ATOM 0 HG3 PRO C 37 -9.909 6.083 -12.148 1.00 0.00 H new ATOM 0 HD2 PRO C 37 -8.651 4.644 -10.197 1.00 0.00 H new ATOM 0 HD3 PRO C 37 -9.529 6.110 -9.810 1.00 0.00 H new ATOM 2205 N LYS C 38 -13.172 2.173 -10.768 1.00 0.00 N ATOM 2206 CA LYS C 38 -13.400 0.814 -11.246 1.00 0.00 C ATOM 2207 C LYS C 38 -12.961 0.681 -12.704 1.00 0.00 C ATOM 2208 O LYS C 38 -13.057 -0.398 -13.289 1.00 0.00 O ATOM 2209 CB LYS C 38 -14.868 0.427 -11.030 1.00 0.00 C ATOM 2210 CG LYS C 38 -15.210 0.374 -9.536 1.00 0.00 C ATOM 2211 CD LYS C 38 -14.581 -0.840 -8.843 1.00 0.00 C ATOM 2212 CE LYS C 38 -15.458 -2.083 -9.023 1.00 0.00 C ATOM 2213 NZ LYS C 38 -14.772 -3.307 -8.567 1.00 0.00 N ATOM 0 H LYS C 38 -14.024 2.692 -10.557 1.00 0.00 H new ATOM 0 HA LYS C 38 -12.793 0.114 -10.672 1.00 0.00 H new ATOM 0 HB2 LYS C 38 -15.515 1.148 -11.529 1.00 0.00 H new ATOM 0 HB3 LYS C 38 -15.062 -0.544 -11.486 1.00 0.00 H new ATOM 0 HG2 LYS C 38 -14.863 1.287 -9.052 1.00 0.00 H new ATOM 0 HG3 LYS C 38 -16.293 0.340 -9.413 1.00 0.00 H new ATOM 0 HD2 LYS C 38 -13.589 -1.026 -9.255 1.00 0.00 H new ATOM 0 HD3 LYS C 38 -14.451 -0.632 -7.781 1.00 0.00 H new ATOM 0 HE2 LYS C 38 -16.386 -1.957 -8.465 1.00 0.00 H new ATOM 0 HE3 LYS C 38 -15.729 -2.188 -10.074 1.00 0.00 H new ATOM 0 HZ1 LYS C 38 -15.397 -4.127 -8.705 1.00 0.00 H new ATOM 0 HZ2 LYS C 38 -13.899 -3.441 -9.116 1.00 0.00 H new ATOM 0 HZ3 LYS C 38 -14.536 -3.217 -7.558 1.00 0.00 H new ATOM 2227 N ASP C 39 -12.483 1.783 -13.291 1.00 0.00 N ATOM 2228 CA ASP C 39 -11.880 1.814 -14.613 1.00 0.00 C ATOM 2229 C ASP C 39 -10.536 1.080 -14.618 1.00 0.00 C ATOM 2230 O ASP C 39 -9.982 0.805 -15.683 1.00 0.00 O ATOM 2231 CB ASP C 39 -11.675 3.277 -15.017 1.00 0.00 C ATOM 2232 CG ASP C 39 -11.307 3.407 -16.497 1.00 0.00 C ATOM 2233 OD1 ASP C 39 -12.134 2.981 -17.337 1.00 0.00 O ATOM 2234 OD2 ASP C 39 -10.207 3.933 -16.776 1.00 0.00 O ATOM 0 H ASP C 39 -12.509 2.698 -12.842 1.00 0.00 H new ATOM 0 HA ASP C 39 -12.538 1.312 -15.322 1.00 0.00 H new ATOM 0 HB2 ASP C 39 -12.586 3.841 -14.817 1.00 0.00 H new ATOM 0 HB3 ASP C 39 -10.887 3.717 -14.406 1.00 0.00 H new ATOM 2239 N VAL C 40 -10.020 0.757 -13.426 1.00 0.00 N ATOM 2240 CA VAL C 40 -8.754 0.052 -13.252 1.00 0.00 C ATOM 2241 C VAL C 40 -8.896 -0.997 -12.151 1.00 0.00 C ATOM 2242 O VAL C 40 -9.808 -0.928 -11.328 1.00 0.00 O ATOM 2243 CB VAL C 40 -7.613 1.027 -12.921 1.00 0.00 C ATOM 2244 CG1 VAL C 40 -7.492 2.114 -13.989 1.00 0.00 C ATOM 2245 CG2 VAL C 40 -7.810 1.707 -11.566 1.00 0.00 C ATOM 0 H VAL C 40 -10.481 0.984 -12.545 1.00 0.00 H new ATOM 0 HA VAL C 40 -8.504 -0.443 -14.190 1.00 0.00 H new ATOM 0 HB VAL C 40 -6.703 0.428 -12.889 1.00 0.00 H new ATOM 0 HG11 VAL C 40 -6.677 2.790 -13.730 1.00 0.00 H new ATOM 0 HG12 VAL C 40 -7.288 1.653 -14.955 1.00 0.00 H new ATOM 0 HG13 VAL C 40 -8.425 2.675 -14.044 1.00 0.00 H new ATOM 0 HG21 VAL C 40 -6.979 2.386 -11.376 1.00 0.00 H new ATOM 0 HG22 VAL C 40 -8.744 2.269 -11.573 1.00 0.00 H new ATOM 0 HG23 VAL C 40 -7.847 0.951 -10.782 1.00 0.00 H new ATOM 2255 N ALA C 41 -7.989 -1.977 -12.134 1.00 0.00 N ATOM 2256 CA ALA C 41 -8.072 -3.083 -11.199 1.00 0.00 C ATOM 2257 C ALA C 41 -7.124 -2.908 -10.019 1.00 0.00 C ATOM 2258 O ALA C 41 -6.133 -2.184 -10.108 1.00 0.00 O ATOM 2259 CB ALA C 41 -7.739 -4.374 -11.946 1.00 0.00 C ATOM 0 H ALA C 41 -7.188 -2.020 -12.764 1.00 0.00 H new ATOM 0 HA ALA C 41 -9.083 -3.120 -10.794 1.00 0.00 H new ATOM 0 HB1 ALA C 41 -7.796 -5.218 -11.258 1.00 0.00 H new ATOM 0 HB2 ALA C 41 -8.452 -4.519 -12.758 1.00 0.00 H new ATOM 0 HB3 ALA C 41 -6.731 -4.308 -12.356 1.00 0.00 H new ATOM 2265 N VAL C 42 -7.436 -3.575 -8.905 1.00 0.00 N ATOM 2266 CA VAL C 42 -6.565 -3.612 -7.732 1.00 0.00 C ATOM 2267 C VAL C 42 -6.837 -4.906 -6.971 1.00 0.00 C ATOM 2268 O VAL C 42 -7.990 -5.273 -6.768 1.00 0.00 O ATOM 2269 CB VAL C 42 -6.808 -2.368 -6.859 1.00 0.00 C ATOM 2270 CG1 VAL C 42 -8.292 -2.105 -6.624 1.00 0.00 C ATOM 2271 CG2 VAL C 42 -6.142 -2.490 -5.493 1.00 0.00 C ATOM 0 H VAL C 42 -8.301 -4.104 -8.793 1.00 0.00 H new ATOM 0 HA VAL C 42 -5.516 -3.596 -8.028 1.00 0.00 H new ATOM 0 HB VAL C 42 -6.371 -1.540 -7.417 1.00 0.00 H new ATOM 0 HG11 VAL C 42 -8.410 -1.217 -6.003 1.00 0.00 H new ATOM 0 HG12 VAL C 42 -8.790 -1.947 -7.581 1.00 0.00 H new ATOM 0 HG13 VAL C 42 -8.738 -2.962 -6.120 1.00 0.00 H new ATOM 0 HG21 VAL C 42 -6.339 -1.590 -4.910 1.00 0.00 H new ATOM 0 HG22 VAL C 42 -6.543 -3.357 -4.969 1.00 0.00 H new ATOM 0 HG23 VAL C 42 -5.066 -2.610 -5.622 1.00 0.00 H new ATOM 2281 N HIS C 43 -5.777 -5.600 -6.545 1.00 0.00 N ATOM 2282 CA HIS C 43 -5.910 -6.898 -5.890 1.00 0.00 C ATOM 2283 C HIS C 43 -4.697 -7.212 -5.024 1.00 0.00 C ATOM 2284 O HIS C 43 -3.685 -6.518 -5.080 1.00 0.00 O ATOM 2285 CB HIS C 43 -5.993 -8.002 -6.946 1.00 0.00 C ATOM 2286 CG HIS C 43 -7.112 -7.842 -7.934 1.00 0.00 C ATOM 2287 ND1 HIS C 43 -8.443 -8.180 -7.708 1.00 0.00 N ATOM 2288 CD2 HIS C 43 -6.973 -7.346 -9.199 1.00 0.00 C ATOM 2289 CE1 HIS C 43 -9.082 -7.873 -8.849 1.00 0.00 C ATOM 2290 NE2 HIS C 43 -8.227 -7.374 -9.760 1.00 0.00 N ATOM 0 H HIS C 43 -4.814 -5.279 -6.644 1.00 0.00 H new ATOM 0 HA HIS C 43 -6.809 -6.856 -5.275 1.00 0.00 H new ATOM 0 HB2 HIS C 43 -5.049 -8.038 -7.490 1.00 0.00 H new ATOM 0 HB3 HIS C 43 -6.107 -8.961 -6.441 1.00 0.00 H new ATOM 0 HD1 HIS C 43 -8.846 -8.576 -6.859 1.00 0.00 H new ATOM 0 HD2 HIS C 43 -6.061 -7.001 -9.664 1.00 0.00 H new ATOM 0 HE1 HIS C 43 -10.141 -8.009 -9.013 1.00 0.00 H new ATOM 2298 N ARG C 44 -4.805 -8.270 -4.218 1.00 0.00 N ATOM 2299 CA ARG C 44 -3.661 -8.818 -3.509 1.00 0.00 C ATOM 2300 C ARG C 44 -2.753 -9.511 -4.514 1.00 0.00 C ATOM 2301 O ARG C 44 -3.188 -9.859 -5.609 1.00 0.00 O ATOM 2302 CB ARG C 44 -4.140 -9.826 -2.464 1.00 0.00 C ATOM 2303 CG ARG C 44 -4.806 -9.112 -1.290 1.00 0.00 C ATOM 2304 CD ARG C 44 -5.503 -10.117 -0.379 1.00 0.00 C ATOM 2305 NE ARG C 44 -6.737 -10.610 -1.004 1.00 0.00 N ATOM 2306 CZ ARG C 44 -7.173 -11.874 -0.966 1.00 0.00 C ATOM 2307 NH1 ARG C 44 -6.459 -12.834 -0.386 1.00 0.00 N ATOM 2308 NH2 ARG C 44 -8.342 -12.175 -1.515 1.00 0.00 N ATOM 0 H ARG C 44 -5.681 -8.763 -4.043 1.00 0.00 H new ATOM 0 HA ARG C 44 -3.116 -8.020 -3.006 1.00 0.00 H new ATOM 0 HB2 ARG C 44 -4.844 -10.522 -2.919 1.00 0.00 H new ATOM 0 HB3 ARG C 44 -3.296 -10.415 -2.106 1.00 0.00 H new ATOM 0 HG2 ARG C 44 -4.059 -8.556 -0.724 1.00 0.00 H new ATOM 0 HG3 ARG C 44 -5.529 -8.386 -1.661 1.00 0.00 H new ATOM 0 HD2 ARG C 44 -4.835 -10.953 -0.172 1.00 0.00 H new ATOM 0 HD3 ARG C 44 -5.735 -9.649 0.578 1.00 0.00 H new ATOM 0 HE ARG C 44 -7.309 -9.933 -1.509 1.00 0.00 H new ATOM 0 HH11 ARG C 44 -5.560 -12.613 0.041 1.00 0.00 H new ATOM 0 HH12 ARG C 44 -6.811 -13.791 -0.369 1.00 0.00 H new ATOM 0 HH21 ARG C 44 -8.899 -11.446 -1.961 1.00 0.00 H new ATOM 0 HH22 ARG C 44 -8.684 -13.136 -1.492 1.00 0.00 H new ATOM 2322 N GLU C 45 -1.490 -9.717 -4.148 1.00 0.00 N ATOM 2323 CA GLU C 45 -0.543 -10.392 -5.026 1.00 0.00 C ATOM 2324 C GLU C 45 -0.921 -11.869 -5.181 1.00 0.00 C ATOM 2325 O GLU C 45 -0.545 -12.496 -6.168 1.00 0.00 O ATOM 2326 CB GLU C 45 0.866 -10.196 -4.451 1.00 0.00 C ATOM 2327 CG GLU C 45 1.969 -10.688 -5.398 1.00 0.00 C ATOM 2328 CD GLU C 45 2.322 -12.165 -5.220 1.00 0.00 C ATOM 2329 OE1 GLU C 45 1.821 -12.788 -4.254 1.00 0.00 O ATOM 2330 OE2 GLU C 45 3.102 -12.669 -6.059 1.00 0.00 O ATOM 0 H GLU C 45 -1.101 -9.426 -3.251 1.00 0.00 H new ATOM 0 HA GLU C 45 -0.568 -9.965 -6.029 1.00 0.00 H new ATOM 0 HB2 GLU C 45 1.022 -9.139 -4.237 1.00 0.00 H new ATOM 0 HB3 GLU C 45 0.944 -10.728 -3.503 1.00 0.00 H new ATOM 0 HG2 GLU C 45 1.652 -10.521 -6.427 1.00 0.00 H new ATOM 0 HG3 GLU C 45 2.865 -10.088 -5.239 1.00 0.00 H new ATOM 2337 N GLU C 46 -1.658 -12.431 -4.216 1.00 0.00 N ATOM 2338 CA GLU C 46 -2.120 -13.815 -4.282 1.00 0.00 C ATOM 2339 C GLU C 46 -3.407 -13.943 -5.102 1.00 0.00 C ATOM 2340 O GLU C 46 -3.865 -15.056 -5.360 1.00 0.00 O ATOM 2341 CB GLU C 46 -2.333 -14.352 -2.862 1.00 0.00 C ATOM 2342 CG GLU C 46 -3.535 -13.690 -2.183 1.00 0.00 C ATOM 2343 CD GLU C 46 -3.660 -14.104 -0.716 1.00 0.00 C ATOM 2344 OE1 GLU C 46 -3.939 -15.297 -0.464 1.00 0.00 O ATOM 2345 OE2 GLU C 46 -3.475 -13.217 0.147 1.00 0.00 O ATOM 0 H GLU C 46 -1.948 -11.938 -3.372 1.00 0.00 H new ATOM 0 HA GLU C 46 -1.355 -14.407 -4.785 1.00 0.00 H new ATOM 0 HB2 GLU C 46 -2.484 -15.431 -2.899 1.00 0.00 H new ATOM 0 HB3 GLU C 46 -1.436 -14.176 -2.268 1.00 0.00 H new ATOM 0 HG2 GLU C 46 -3.437 -12.606 -2.247 1.00 0.00 H new ATOM 0 HG3 GLU C 46 -4.447 -13.960 -2.715 1.00 0.00 H new ATOM 2352 N ILE C 47 -3.985 -12.812 -5.515 1.00 0.00 N ATOM 2353 CA ILE C 47 -5.220 -12.770 -6.290 1.00 0.00 C ATOM 2354 C ILE C 47 -4.958 -12.224 -7.687 1.00 0.00 C ATOM 2355 O ILE C 47 -5.571 -12.674 -8.647 1.00 0.00 O ATOM 2356 CB ILE C 47 -6.239 -11.895 -5.551 1.00 0.00 C ATOM 2357 CG1 ILE C 47 -6.698 -12.539 -4.243 1.00 0.00 C ATOM 2358 CG2 ILE C 47 -7.454 -11.613 -6.430 1.00 0.00 C ATOM 2359 CD1 ILE C 47 -7.303 -13.935 -4.425 1.00 0.00 C ATOM 0 H ILE C 47 -3.600 -11.889 -5.316 1.00 0.00 H new ATOM 0 HA ILE C 47 -5.617 -13.779 -6.397 1.00 0.00 H new ATOM 0 HB ILE C 47 -5.737 -10.957 -5.316 1.00 0.00 H new ATOM 0 HG12 ILE C 47 -5.849 -12.606 -3.563 1.00 0.00 H new ATOM 0 HG13 ILE C 47 -7.435 -11.892 -3.768 1.00 0.00 H new ATOM 0 HG21 ILE C 47 -8.162 -10.991 -5.883 1.00 0.00 H new ATOM 0 HG22 ILE C 47 -7.136 -11.093 -7.334 1.00 0.00 H new ATOM 0 HG23 ILE C 47 -7.933 -12.554 -6.702 1.00 0.00 H new ATOM 0 HD11 ILE C 47 -7.606 -14.330 -3.455 1.00 0.00 H new ATOM 0 HD12 ILE C 47 -8.173 -13.872 -5.079 1.00 0.00 H new ATOM 0 HD13 ILE C 47 -6.561 -14.598 -4.871 1.00 0.00 H new ATOM 2371 N TYR C 48 -4.048 -11.259 -7.808 1.00 0.00 N ATOM 2372 CA TYR C 48 -3.749 -10.639 -9.085 1.00 0.00 C ATOM 2373 C TYR C 48 -3.336 -11.685 -10.122 1.00 0.00 C ATOM 2374 O TYR C 48 -3.694 -11.571 -11.292 1.00 0.00 O ATOM 2375 CB TYR C 48 -2.625 -9.622 -8.877 1.00 0.00 C ATOM 2376 CG TYR C 48 -2.022 -9.167 -10.183 1.00 0.00 C ATOM 2377 CD1 TYR C 48 -2.831 -8.614 -11.187 1.00 0.00 C ATOM 2378 CD2 TYR C 48 -0.646 -9.314 -10.380 1.00 0.00 C ATOM 2379 CE1 TYR C 48 -2.264 -8.230 -12.409 1.00 0.00 C ATOM 2380 CE2 TYR C 48 -0.071 -8.924 -11.591 1.00 0.00 C ATOM 2381 CZ TYR C 48 -0.876 -8.382 -12.618 1.00 0.00 C ATOM 2382 OH TYR C 48 -0.310 -8.012 -13.799 1.00 0.00 O ATOM 0 H TYR C 48 -3.505 -10.892 -7.027 1.00 0.00 H new ATOM 0 HA TYR C 48 -4.641 -10.140 -9.463 1.00 0.00 H new ATOM 0 HB2 TYR C 48 -3.014 -8.758 -8.337 1.00 0.00 H new ATOM 0 HB3 TYR C 48 -1.848 -10.064 -8.254 1.00 0.00 H new ATOM 0 HD1 TYR C 48 -3.890 -8.484 -11.018 1.00 0.00 H new ATOM 0 HD2 TYR C 48 -0.029 -9.729 -9.597 1.00 0.00 H new ATOM 0 HE1 TYR C 48 -2.887 -7.819 -13.189 1.00 0.00 H new ATOM 0 HE2 TYR C 48 0.992 -9.037 -11.743 1.00 0.00 H new ATOM 0 HH TYR C 48 -1.004 -7.674 -14.403 1.00 0.00 H new ATOM 2392 N GLN C 49 -2.587 -12.708 -9.697 1.00 0.00 N ATOM 2393 CA GLN C 49 -2.135 -13.764 -10.592 1.00 0.00 C ATOM 2394 C GLN C 49 -3.314 -14.574 -11.123 1.00 0.00 C ATOM 2395 O GLN C 49 -3.200 -15.237 -12.152 1.00 0.00 O ATOM 2396 CB GLN C 49 -1.183 -14.695 -9.837 1.00 0.00 C ATOM 2397 CG GLN C 49 0.022 -13.939 -9.274 1.00 0.00 C ATOM 2398 CD GLN C 49 0.921 -14.882 -8.479 1.00 0.00 C ATOM 2399 OE1 GLN C 49 1.488 -15.824 -9.031 1.00 0.00 O ATOM 2400 NE2 GLN C 49 1.059 -14.634 -7.180 1.00 0.00 N ATOM 0 H GLN C 49 -2.282 -12.822 -8.730 1.00 0.00 H new ATOM 0 HA GLN C 49 -1.622 -13.304 -11.437 1.00 0.00 H new ATOM 0 HB2 GLN C 49 -1.720 -15.181 -9.023 1.00 0.00 H new ATOM 0 HB3 GLN C 49 -0.838 -15.483 -10.507 1.00 0.00 H new ATOM 0 HG2 GLN C 49 0.588 -13.488 -10.089 1.00 0.00 H new ATOM 0 HG3 GLN C 49 -0.319 -13.125 -8.633 1.00 0.00 H new ATOM 0 HE21 GLN C 49 0.573 -13.843 -6.757 1.00 0.00 H new ATOM 0 HE22 GLN C 49 1.651 -15.235 -6.606 1.00 0.00 H new ATOM 2409 N ARG C 50 -4.450 -14.519 -10.424 1.00 0.00 N ATOM 2410 CA ARG C 50 -5.628 -15.287 -10.787 1.00 0.00 C ATOM 2411 C ARG C 50 -6.472 -14.547 -11.820 1.00 0.00 C ATOM 2412 O ARG C 50 -7.041 -15.189 -12.698 1.00 0.00 O ATOM 2413 CB ARG C 50 -6.423 -15.582 -9.514 1.00 0.00 C ATOM 2414 CG ARG C 50 -7.589 -16.505 -9.827 1.00 0.00 C ATOM 2415 CD ARG C 50 -8.315 -16.833 -8.523 1.00 0.00 C ATOM 2416 NE ARG C 50 -7.505 -17.692 -7.648 1.00 0.00 N ATOM 2417 CZ ARG C 50 -7.449 -19.023 -7.747 1.00 0.00 C ATOM 2418 NH1 ARG C 50 -8.147 -19.675 -8.678 1.00 0.00 N ATOM 2419 NH2 ARG C 50 -6.685 -19.718 -6.908 1.00 0.00 N ATOM 0 H ARG C 50 -4.572 -13.940 -9.593 1.00 0.00 H new ATOM 0 HA ARG C 50 -5.328 -16.227 -11.251 1.00 0.00 H new ATOM 0 HB2 ARG C 50 -5.774 -16.043 -8.770 1.00 0.00 H new ATOM 0 HB3 ARG C 50 -6.792 -14.651 -9.083 1.00 0.00 H new ATOM 0 HG2 ARG C 50 -8.271 -16.027 -10.530 1.00 0.00 H new ATOM 0 HG3 ARG C 50 -7.231 -17.419 -10.301 1.00 0.00 H new ATOM 0 HD2 ARG C 50 -8.558 -15.908 -8.000 1.00 0.00 H new ATOM 0 HD3 ARG C 50 -9.259 -17.330 -8.748 1.00 0.00 H new ATOM 0 HE ARG C 50 -6.950 -17.243 -6.919 1.00 0.00 H new ATOM 0 HH11 ARG C 50 -8.736 -19.157 -9.330 1.00 0.00 H new ATOM 0 HH12 ARG C 50 -8.092 -20.692 -8.738 1.00 0.00 H new ATOM 0 HH21 ARG C 50 -6.144 -19.234 -6.191 1.00 0.00 H new ATOM 0 HH22 ARG C 50 -6.641 -20.734 -6.982 1.00 0.00 H new ATOM 2433 N ILE C 51 -6.557 -13.213 -11.743 1.00 0.00 N ATOM 2434 CA ILE C 51 -7.282 -12.432 -12.744 1.00 0.00 C ATOM 2435 C ILE C 51 -6.567 -12.562 -14.090 1.00 0.00 C ATOM 2436 O ILE C 51 -7.159 -12.329 -15.142 1.00 0.00 O ATOM 2437 CB ILE C 51 -7.428 -10.957 -12.323 1.00 0.00 C ATOM 2438 CG1 ILE C 51 -8.384 -10.768 -11.143 1.00 0.00 C ATOM 2439 CG2 ILE C 51 -8.052 -10.121 -13.445 1.00 0.00 C ATOM 2440 CD1 ILE C 51 -7.813 -11.261 -9.819 1.00 0.00 C ATOM 0 H ILE C 51 -6.134 -12.657 -11.000 1.00 0.00 H new ATOM 0 HA ILE C 51 -8.294 -12.826 -12.835 1.00 0.00 H new ATOM 0 HB ILE C 51 -6.415 -10.646 -12.069 1.00 0.00 H new ATOM 0 HG12 ILE C 51 -8.633 -9.711 -11.052 1.00 0.00 H new ATOM 0 HG13 ILE C 51 -9.314 -11.298 -11.349 1.00 0.00 H new ATOM 0 HG21 ILE C 51 -8.143 -9.085 -13.119 1.00 0.00 H new ATOM 0 HG22 ILE C 51 -7.418 -10.169 -14.330 1.00 0.00 H new ATOM 0 HG23 ILE C 51 -9.040 -10.514 -13.685 1.00 0.00 H new ATOM 0 HD11 ILE C 51 -8.542 -11.097 -9.025 1.00 0.00 H new ATOM 0 HD12 ILE C 51 -7.590 -12.325 -9.893 1.00 0.00 H new ATOM 0 HD13 ILE C 51 -6.898 -10.714 -9.591 1.00 0.00 H new