USER MOD reduce.3.24.130724 H: found=0, std=0, add=770, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 769 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 121:sc= 0.892 USER MOD Set 1.2: A 57 SER OG : rot 180:sc= 0.811 USER MOD Set 2.1: A 6 LYS NZ :NH3+ -119:sc= 2.4 (180deg=0.0766) USER MOD Set 2.2: B 686 GLN : amide:sc= 1.45 K(o=3.9,f=-7.7!) USER MOD Single : A 1 MET CE :methyl -170:sc= -0.0431 (180deg=-0.1) USER MOD Single : A 1 MET N :NH3+ 174:sc= 1.15 (180deg=1.12) USER MOD Single : A 2 GLN : amide:sc= 0.54 K(o=0.54,f=-5.2!) USER MOD Single : A 7 THR OG1 : rot -74:sc= 0.318 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ -177:sc= 1.05 (180deg=1.04) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.0133 USER MOD Single : A 25 ASN : amide:sc= 1.11 K(o=1.1,f=-0.27) USER MOD Single : A 27 LYS NZ :NH3+ -171:sc= 0.868 (180deg=0.818) USER MOD Single : A 29 LYS NZ :NH3+ -175:sc= 0.794 (180deg=0.776) USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 LYS NZ :NH3+ 169:sc= 0.908 (180deg=0.809) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 GLN : amide:sc= -0.456 K(o=-0.46,f=-5.5!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0.706 K(o=0.71,f=-5.7!) USER MOD Single : A 59 TYR OH : rot 60:sc= -0.0268 USER MOD Single : A 60 ASN : amide:sc= -0.0221 X(o=-0.022,f=0) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 LYS NZ :NH3+ -172:sc= 1.26 (180deg=1.18) USER MOD Single : A 65 SER OG : rot 58:sc= 1.18 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HE2:sc= -0.311 K(o=-0.31,f=-2.1!) USER MOD Single : B 689 TYR OH : rot 180:sc= 0 USER MOD Single : B 696 GLN : amide:sc= -0.0909 X(o=-0.091,f=-0.12) USER MOD Single : B 697 LYS NZ :NH3+ 168:sc= 1.2 (180deg=1.12) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.367 -1.723 -2.958 1.00 0.00 N ATOM 2 CA MET A 1 4.725 -1.789 -4.412 1.00 0.00 C ATOM 3 C MET A 1 4.478 -0.458 -5.125 1.00 0.00 C ATOM 4 O MET A 1 3.932 0.451 -4.512 1.00 0.00 O ATOM 5 CB MET A 1 4.011 -2.932 -5.171 1.00 0.00 C ATOM 6 CG MET A 1 2.501 -2.803 -5.454 1.00 0.00 C ATOM 7 SD MET A 1 1.809 -4.301 -6.208 1.00 0.00 S ATOM 8 CE MET A 1 0.300 -3.723 -7.034 1.00 0.00 C ATOM 0 H1 MET A 1 4.453 -2.670 -2.536 1.00 0.00 H new ATOM 0 H2 MET A 1 5.011 -1.067 -2.471 1.00 0.00 H new ATOM 0 H3 MET A 1 3.388 -1.386 -2.856 1.00 0.00 H new ATOM 0 HA MET A 1 5.793 -2.006 -4.429 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.517 -3.060 -6.128 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.164 -3.851 -4.605 1.00 0.00 H new ATOM 0 HG2 MET A 1 1.976 -2.593 -4.522 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.329 -1.954 -6.115 1.00 0.00 H new ATOM 0 HE1 MET A 1 -0.283 -4.581 -7.369 1.00 0.00 H new ATOM 0 HE2 MET A 1 -0.293 -3.132 -6.336 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.568 -3.109 -7.894 1.00 0.00 H new ATOM 20 N GLN A 2 4.770 -0.350 -6.428 1.00 0.00 N ATOM 21 CA GLN A 2 4.462 0.837 -7.230 1.00 0.00 C ATOM 22 C GLN A 2 3.697 0.453 -8.489 1.00 0.00 C ATOM 23 O GLN A 2 3.819 -0.675 -8.955 1.00 0.00 O ATOM 24 CB GLN A 2 5.760 1.612 -7.528 1.00 0.00 C ATOM 25 CG GLN A 2 6.604 1.192 -8.756 1.00 0.00 C ATOM 26 CD GLN A 2 7.303 -0.170 -8.644 1.00 0.00 C ATOM 27 OE1 GLN A 2 6.704 -1.173 -8.274 1.00 0.00 O ATOM 28 NE2 GLN A 2 8.579 -0.260 -8.987 1.00 0.00 N ATOM 0 H GLN A 2 5.230 -1.091 -6.957 1.00 0.00 H new ATOM 0 HA GLN A 2 3.807 1.503 -6.667 1.00 0.00 H new ATOM 0 HB2 GLN A 2 5.498 2.663 -7.649 1.00 0.00 H new ATOM 0 HB3 GLN A 2 6.398 1.542 -6.647 1.00 0.00 H new ATOM 0 HG2 GLN A 2 5.956 1.177 -9.632 1.00 0.00 H new ATOM 0 HG3 GLN A 2 7.361 1.956 -8.933 1.00 0.00 H new ATOM 0 HE21 GLN A 2 9.084 0.571 -9.296 1.00 0.00 H new ATOM 0 HE22 GLN A 2 9.057 -1.160 -8.942 1.00 0.00 H new ATOM 37 N ILE A 3 2.944 1.389 -9.069 1.00 0.00 N ATOM 38 CA ILE A 3 2.274 1.197 -10.371 1.00 0.00 C ATOM 39 C ILE A 3 2.319 2.494 -11.150 1.00 0.00 C ATOM 40 O ILE A 3 2.493 3.551 -10.554 1.00 0.00 O ATOM 41 CB ILE A 3 0.821 0.719 -10.182 1.00 0.00 C ATOM 42 CG1 ILE A 3 0.070 1.683 -9.236 1.00 0.00 C ATOM 43 CG2 ILE A 3 0.808 -0.750 -9.697 1.00 0.00 C ATOM 44 CD1 ILE A 3 -1.435 1.685 -9.456 1.00 0.00 C ATOM 0 H ILE A 3 2.777 2.306 -8.654 1.00 0.00 H new ATOM 0 HA ILE A 3 2.799 0.423 -10.931 1.00 0.00 H new ATOM 0 HB ILE A 3 0.290 0.738 -11.134 1.00 0.00 H new ATOM 0 HG12 ILE A 3 0.280 1.405 -8.203 1.00 0.00 H new ATOM 0 HG13 ILE A 3 0.453 2.694 -9.378 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -0.222 -1.081 -9.566 1.00 0.00 H new ATOM 0 HG22 ILE A 3 1.300 -1.382 -10.436 1.00 0.00 H new ATOM 0 HG23 ILE A 3 1.337 -0.824 -8.747 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -1.903 2.382 -8.761 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -1.653 1.991 -10.479 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -1.829 0.683 -9.286 1.00 0.00 H new ATOM 56 N PHE A 4 2.123 2.413 -12.460 1.00 0.00 N ATOM 57 CA PHE A 4 2.306 3.511 -13.395 1.00 0.00 C ATOM 58 C PHE A 4 0.955 3.868 -13.996 1.00 0.00 C ATOM 59 O PHE A 4 0.472 3.219 -14.910 1.00 0.00 O ATOM 60 CB PHE A 4 3.314 3.119 -14.486 1.00 0.00 C ATOM 61 CG PHE A 4 4.508 2.313 -14.006 1.00 0.00 C ATOM 62 CD1 PHE A 4 5.314 2.832 -12.983 1.00 0.00 C ATOM 63 CD2 PHE A 4 4.801 1.049 -14.544 1.00 0.00 C ATOM 64 CE1 PHE A 4 6.394 2.091 -12.481 1.00 0.00 C ATOM 65 CE2 PHE A 4 5.939 0.352 -14.103 1.00 0.00 C ATOM 66 CZ PHE A 4 6.734 0.866 -13.072 1.00 0.00 C ATOM 0 H PHE A 4 1.822 1.551 -12.914 1.00 0.00 H new ATOM 0 HA PHE A 4 2.708 4.382 -12.876 1.00 0.00 H new ATOM 0 HB2 PHE A 4 2.792 2.544 -15.251 1.00 0.00 H new ATOM 0 HB3 PHE A 4 3.679 4.028 -14.964 1.00 0.00 H new ATOM 0 HD1 PHE A 4 5.102 3.810 -12.578 1.00 0.00 H new ATOM 0 HD2 PHE A 4 4.155 0.615 -15.293 1.00 0.00 H new ATOM 0 HE1 PHE A 4 6.962 2.463 -11.641 1.00 0.00 H new ATOM 0 HE2 PHE A 4 6.202 -0.589 -14.564 1.00 0.00 H new ATOM 0 HZ PHE A 4 7.604 0.322 -12.734 1.00 0.00 H new ATOM 76 N VAL A 5 0.288 4.880 -13.478 1.00 0.00 N ATOM 77 CA VAL A 5 -1.020 5.271 -14.003 1.00 0.00 C ATOM 78 C VAL A 5 -0.752 6.244 -15.146 1.00 0.00 C ATOM 79 O VAL A 5 -0.412 7.401 -14.914 1.00 0.00 O ATOM 80 CB VAL A 5 -1.917 5.796 -12.871 1.00 0.00 C ATOM 81 CG1 VAL A 5 -3.315 6.143 -13.384 1.00 0.00 C ATOM 82 CG2 VAL A 5 -2.053 4.744 -11.762 1.00 0.00 C ATOM 0 H VAL A 5 0.621 5.448 -12.699 1.00 0.00 H new ATOM 0 HA VAL A 5 -1.590 4.435 -14.409 1.00 0.00 H new ATOM 0 HB VAL A 5 -1.445 6.696 -12.478 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -3.924 6.511 -12.559 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -3.240 6.913 -14.152 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -3.779 5.252 -13.808 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -2.691 5.132 -10.968 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -2.496 3.837 -12.173 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -1.068 4.514 -11.356 1.00 0.00 H new ATOM 92 N LYS A 6 -0.838 5.784 -16.391 1.00 0.00 N ATOM 93 CA LYS A 6 -0.791 6.668 -17.546 1.00 0.00 C ATOM 94 C LYS A 6 -2.064 7.479 -17.530 1.00 0.00 C ATOM 95 O LYS A 6 -3.151 6.909 -17.519 1.00 0.00 O ATOM 96 CB LYS A 6 -0.692 5.849 -18.836 1.00 0.00 C ATOM 97 CG LYS A 6 -0.233 6.758 -19.991 1.00 0.00 C ATOM 98 CD LYS A 6 -0.580 6.106 -21.330 1.00 0.00 C ATOM 99 CE LYS A 6 0.325 6.612 -22.460 1.00 0.00 C ATOM 100 NZ LYS A 6 0.276 5.704 -23.642 1.00 0.00 N ATOM 0 H LYS A 6 -0.941 4.796 -16.624 1.00 0.00 H new ATOM 0 HA LYS A 6 0.082 7.319 -17.505 1.00 0.00 H new ATOM 0 HB2 LYS A 6 0.012 5.028 -18.704 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -1.659 5.405 -19.072 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -0.716 7.732 -19.914 1.00 0.00 H new ATOM 0 HG3 LYS A 6 0.842 6.929 -19.927 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -0.483 5.024 -21.243 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -1.621 6.314 -21.577 1.00 0.00 H new ATOM 0 HE2 LYS A 6 0.015 7.614 -22.756 1.00 0.00 H new ATOM 0 HE3 LYS A 6 1.351 6.689 -22.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 1.225 5.321 -23.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -0.382 4.922 -23.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -0.050 6.235 -24.475 1.00 0.00 H new ATOM 114 N THR A 7 -1.970 8.793 -17.513 1.00 0.00 N ATOM 115 CA THR A 7 -3.163 9.584 -17.653 1.00 0.00 C ATOM 116 C THR A 7 -3.523 9.739 -19.108 1.00 0.00 C ATOM 117 O THR A 7 -2.698 9.512 -19.992 1.00 0.00 O ATOM 118 CB THR A 7 -2.993 10.913 -16.958 1.00 0.00 C ATOM 119 OG1 THR A 7 -1.874 11.541 -17.530 1.00 0.00 O ATOM 120 CG2 THR A 7 -2.814 10.760 -15.457 1.00 0.00 C ATOM 0 H THR A 7 -1.103 9.319 -17.406 1.00 0.00 H new ATOM 0 HA THR A 7 -3.995 9.071 -17.171 1.00 0.00 H new ATOM 0 HB THR A 7 -3.893 11.513 -17.093 1.00 0.00 H new ATOM 0 HG1 THR A 7 -1.056 11.104 -17.213 1.00 0.00 H new ATOM 0 HG21 THR A 7 -2.696 11.744 -15.003 1.00 0.00 H new ATOM 0 HG22 THR A 7 -3.690 10.268 -15.034 1.00 0.00 H new ATOM 0 HG23 THR A 7 -1.928 10.158 -15.256 1.00 0.00 H new ATOM 128 N LEU A 8 -4.747 10.195 -19.348 1.00 0.00 N ATOM 129 CA LEU A 8 -5.178 10.432 -20.720 1.00 0.00 C ATOM 130 C LEU A 8 -4.322 11.474 -21.430 1.00 0.00 C ATOM 131 O LEU A 8 -4.303 11.430 -22.650 1.00 0.00 O ATOM 132 CB LEU A 8 -6.667 10.768 -20.858 1.00 0.00 C ATOM 133 CG LEU A 8 -7.660 9.618 -20.642 1.00 0.00 C ATOM 134 CD1 LEU A 8 -9.002 9.889 -21.312 1.00 0.00 C ATOM 135 CD2 LEU A 8 -7.151 8.252 -21.115 1.00 0.00 C ATOM 0 H LEU A 8 -5.442 10.403 -18.631 1.00 0.00 H new ATOM 0 HA LEU A 8 -5.030 9.474 -21.219 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -6.904 11.559 -20.147 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -6.832 11.176 -21.855 1.00 0.00 H new ATOM 0 HG LEU A 8 -7.780 9.574 -19.560 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -9.674 9.049 -21.134 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -9.439 10.798 -20.898 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -8.854 10.014 -22.385 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -7.912 7.495 -20.926 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -6.937 8.293 -22.183 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -6.241 7.995 -20.572 1.00 0.00 H new ATOM 147 N THR A 9 -3.591 12.360 -20.744 1.00 0.00 N ATOM 148 CA THR A 9 -2.733 13.356 -21.397 1.00 0.00 C ATOM 149 C THR A 9 -1.462 12.678 -21.932 1.00 0.00 C ATOM 150 O THR A 9 -0.731 13.255 -22.738 1.00 0.00 O ATOM 151 CB THR A 9 -2.440 14.548 -20.442 1.00 0.00 C ATOM 152 OG1 THR A 9 -1.444 15.437 -20.906 1.00 0.00 O ATOM 153 CG2 THR A 9 -2.100 14.196 -18.994 1.00 0.00 C ATOM 0 H THR A 9 -3.577 12.407 -19.725 1.00 0.00 H new ATOM 0 HA THR A 9 -3.253 13.782 -22.255 1.00 0.00 H new ATOM 0 HB THR A 9 -3.416 15.034 -20.449 1.00 0.00 H new ATOM 0 HG1 THR A 9 -1.319 16.157 -20.254 1.00 0.00 H new ATOM 0 HG21 THR A 9 -1.917 15.111 -18.431 1.00 0.00 H new ATOM 0 HG22 THR A 9 -2.933 13.654 -18.546 1.00 0.00 H new ATOM 0 HG23 THR A 9 -1.207 13.571 -18.971 1.00 0.00 H new ATOM 161 N GLY A 10 -1.190 11.439 -21.506 1.00 0.00 N ATOM 162 CA GLY A 10 0.067 10.779 -21.772 1.00 0.00 C ATOM 163 C GLY A 10 1.096 11.125 -20.709 1.00 0.00 C ATOM 164 O GLY A 10 2.274 11.240 -21.042 1.00 0.00 O ATOM 0 H GLY A 10 -1.846 10.875 -20.966 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -0.083 9.700 -21.801 1.00 0.00 H new ATOM 0 HA3 GLY A 10 0.438 11.076 -22.753 1.00 0.00 H new ATOM 168 N LYS A 11 0.681 11.282 -19.441 1.00 0.00 N ATOM 169 CA LYS A 11 1.634 11.464 -18.347 1.00 0.00 C ATOM 170 C LYS A 11 1.547 10.226 -17.499 1.00 0.00 C ATOM 171 O LYS A 11 0.497 9.971 -16.925 1.00 0.00 O ATOM 172 CB LYS A 11 1.323 12.742 -17.556 1.00 0.00 C ATOM 173 CG LYS A 11 2.262 12.912 -16.348 1.00 0.00 C ATOM 174 CD LYS A 11 1.731 12.431 -14.987 1.00 0.00 C ATOM 175 CE LYS A 11 0.520 13.213 -14.461 1.00 0.00 C ATOM 176 NZ LYS A 11 0.805 14.641 -14.138 1.00 0.00 N ATOM 0 H LYS A 11 -0.298 11.286 -19.156 1.00 0.00 H new ATOM 0 HA LYS A 11 2.651 11.593 -18.717 1.00 0.00 H new ATOM 0 HB2 LYS A 11 1.416 13.607 -18.213 1.00 0.00 H new ATOM 0 HB3 LYS A 11 0.289 12.713 -17.211 1.00 0.00 H new ATOM 0 HG2 LYS A 11 3.189 12.378 -16.560 1.00 0.00 H new ATOM 0 HG3 LYS A 11 2.516 13.968 -16.260 1.00 0.00 H new ATOM 0 HD2 LYS A 11 1.459 11.379 -15.069 1.00 0.00 H new ATOM 0 HD3 LYS A 11 2.535 12.496 -14.254 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -0.275 13.173 -15.206 1.00 0.00 H new ATOM 0 HE3 LYS A 11 0.144 12.718 -13.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -0.048 15.084 -13.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 1.576 14.692 -13.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 1.086 15.143 -15.004 1.00 0.00 H new ATOM 190 N THR A 12 2.607 9.455 -17.400 1.00 0.00 N ATOM 191 CA THR A 12 2.605 8.310 -16.515 1.00 0.00 C ATOM 192 C THR A 12 2.986 8.780 -15.118 1.00 0.00 C ATOM 193 O THR A 12 4.102 9.246 -14.890 1.00 0.00 O ATOM 194 CB THR A 12 3.489 7.185 -17.070 1.00 0.00 C ATOM 195 OG1 THR A 12 3.668 7.302 -18.479 1.00 0.00 O ATOM 196 CG2 THR A 12 2.775 5.863 -16.799 1.00 0.00 C ATOM 0 H THR A 12 3.475 9.597 -17.916 1.00 0.00 H new ATOM 0 HA THR A 12 1.610 7.869 -16.448 1.00 0.00 H new ATOM 0 HB THR A 12 4.467 7.239 -16.591 1.00 0.00 H new ATOM 0 HG1 THR A 12 4.237 6.571 -18.798 1.00 0.00 H new ATOM 0 HG21 THR A 12 3.377 5.039 -17.182 1.00 0.00 H new ATOM 0 HG22 THR A 12 2.632 5.740 -15.725 1.00 0.00 H new ATOM 0 HG23 THR A 12 1.805 5.865 -17.296 1.00 0.00 H new ATOM 204 N ILE A 13 2.025 8.680 -14.198 1.00 0.00 N ATOM 205 CA ILE A 13 2.231 8.974 -12.792 1.00 0.00 C ATOM 206 C ILE A 13 2.440 7.659 -12.078 1.00 0.00 C ATOM 207 O ILE A 13 1.529 6.848 -11.973 1.00 0.00 O ATOM 208 CB ILE A 13 1.124 9.896 -12.225 1.00 0.00 C ATOM 209 CG1 ILE A 13 0.926 9.797 -10.691 1.00 0.00 C ATOM 210 CG2 ILE A 13 -0.260 9.876 -12.890 1.00 0.00 C ATOM 211 CD1 ILE A 13 -0.295 9.016 -10.171 1.00 0.00 C ATOM 0 H ILE A 13 1.073 8.388 -14.418 1.00 0.00 H new ATOM 0 HA ILE A 13 3.129 9.570 -12.629 1.00 0.00 H new ATOM 0 HB ILE A 13 1.571 10.853 -12.496 1.00 0.00 H new ATOM 0 HG12 ILE A 13 1.820 9.340 -10.267 1.00 0.00 H new ATOM 0 HG13 ILE A 13 0.868 10.811 -10.295 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -0.920 10.575 -12.377 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -0.165 10.167 -13.936 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -0.678 8.871 -12.830 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -0.301 9.033 -9.081 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -1.209 9.477 -10.546 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -0.241 7.984 -10.517 1.00 0.00 H new ATOM 223 N THR A 14 3.651 7.448 -11.591 1.00 0.00 N ATOM 224 CA THR A 14 3.953 6.321 -10.738 1.00 0.00 C ATOM 225 C THR A 14 3.404 6.645 -9.352 1.00 0.00 C ATOM 226 O THR A 14 3.501 7.790 -8.893 1.00 0.00 O ATOM 227 CB THR A 14 5.464 6.073 -10.717 1.00 0.00 C ATOM 228 OG1 THR A 14 5.959 6.080 -12.049 1.00 0.00 O ATOM 229 CG2 THR A 14 5.808 4.730 -10.041 1.00 0.00 C ATOM 0 H THR A 14 4.449 8.055 -11.778 1.00 0.00 H new ATOM 0 HA THR A 14 3.491 5.404 -11.105 1.00 0.00 H new ATOM 0 HB THR A 14 5.933 6.868 -10.138 1.00 0.00 H new ATOM 0 HG1 THR A 14 6.926 5.923 -12.039 1.00 0.00 H new ATOM 0 HG21 THR A 14 6.889 4.587 -10.044 1.00 0.00 H new ATOM 0 HG22 THR A 14 5.446 4.737 -9.013 1.00 0.00 H new ATOM 0 HG23 THR A 14 5.333 3.915 -10.588 1.00 0.00 H new ATOM 237 N LEU A 15 2.851 5.650 -8.669 1.00 0.00 N ATOM 238 CA LEU A 15 2.436 5.793 -7.285 1.00 0.00 C ATOM 239 C LEU A 15 2.674 4.511 -6.542 1.00 0.00 C ATOM 240 O LEU A 15 2.740 3.462 -7.169 1.00 0.00 O ATOM 241 CB LEU A 15 0.960 6.208 -7.201 1.00 0.00 C ATOM 242 CG LEU A 15 -0.090 5.185 -7.657 1.00 0.00 C ATOM 243 CD1 LEU A 15 -1.350 5.302 -6.806 1.00 0.00 C ATOM 244 CD2 LEU A 15 -0.494 5.417 -9.088 1.00 0.00 C ATOM 0 H LEU A 15 2.679 4.724 -9.061 1.00 0.00 H new ATOM 0 HA LEU A 15 3.031 6.579 -6.820 1.00 0.00 H new ATOM 0 HB2 LEU A 15 0.744 6.474 -6.166 1.00 0.00 H new ATOM 0 HB3 LEU A 15 0.830 7.112 -7.796 1.00 0.00 H new ATOM 0 HG LEU A 15 0.362 4.199 -7.552 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -2.085 4.570 -7.142 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -1.102 5.115 -5.761 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -1.765 6.305 -6.906 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -1.238 4.676 -9.381 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -0.917 6.416 -9.189 1.00 0.00 H new ATOM 0 HD23 LEU A 15 0.381 5.326 -9.732 1.00 0.00 H new ATOM 256 N GLU A 16 2.729 4.589 -5.218 1.00 0.00 N ATOM 257 CA GLU A 16 2.968 3.436 -4.374 1.00 0.00 C ATOM 258 C GLU A 16 1.646 2.979 -3.780 1.00 0.00 C ATOM 259 O GLU A 16 0.847 3.771 -3.272 1.00 0.00 O ATOM 260 CB GLU A 16 4.036 3.727 -3.310 1.00 0.00 C ATOM 261 CG GLU A 16 5.426 3.675 -3.950 1.00 0.00 C ATOM 262 CD GLU A 16 6.540 3.915 -2.918 1.00 0.00 C ATOM 263 OE1 GLU A 16 6.926 5.090 -2.704 1.00 0.00 O ATOM 264 OE2 GLU A 16 7.045 2.932 -2.322 1.00 0.00 O ATOM 0 H GLU A 16 2.608 5.460 -4.702 1.00 0.00 H new ATOM 0 HA GLU A 16 3.373 2.619 -4.972 1.00 0.00 H new ATOM 0 HB2 GLU A 16 3.865 4.708 -2.867 1.00 0.00 H new ATOM 0 HB3 GLU A 16 3.968 2.997 -2.503 1.00 0.00 H new ATOM 0 HG2 GLU A 16 5.572 2.704 -4.423 1.00 0.00 H new ATOM 0 HG3 GLU A 16 5.492 4.426 -4.737 1.00 0.00 H new ATOM 271 N VAL A 17 1.422 1.679 -3.910 1.00 0.00 N ATOM 272 CA VAL A 17 0.178 0.962 -3.636 1.00 0.00 C ATOM 273 C VAL A 17 0.528 -0.425 -3.083 1.00 0.00 C ATOM 274 O VAL A 17 1.697 -0.749 -2.895 1.00 0.00 O ATOM 275 CB VAL A 17 -0.653 0.846 -4.938 1.00 0.00 C ATOM 276 CG1 VAL A 17 -1.002 2.205 -5.544 1.00 0.00 C ATOM 277 CG2 VAL A 17 0.087 0.008 -5.998 1.00 0.00 C ATOM 0 H VAL A 17 2.156 1.049 -4.233 1.00 0.00 H new ATOM 0 HA VAL A 17 -0.420 1.500 -2.901 1.00 0.00 H new ATOM 0 HB VAL A 17 -1.581 0.352 -4.651 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -1.584 2.059 -6.454 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -1.586 2.783 -4.828 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -0.085 2.743 -5.783 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -0.521 -0.056 -6.901 1.00 0.00 H new ATOM 0 HG22 VAL A 17 1.040 0.481 -6.235 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.266 -0.995 -5.609 1.00 0.00 H new ATOM 287 N GLU A 18 -0.476 -1.283 -2.949 1.00 0.00 N ATOM 288 CA GLU A 18 -0.363 -2.708 -2.655 1.00 0.00 C ATOM 289 C GLU A 18 -1.282 -3.385 -3.671 1.00 0.00 C ATOM 290 O GLU A 18 -2.211 -2.728 -4.137 1.00 0.00 O ATOM 291 CB GLU A 18 -0.864 -3.002 -1.231 1.00 0.00 C ATOM 292 CG GLU A 18 0.030 -2.425 -0.130 1.00 0.00 C ATOM 293 CD GLU A 18 1.353 -3.202 0.027 1.00 0.00 C ATOM 294 OE1 GLU A 18 2.316 -2.955 -0.738 1.00 0.00 O ATOM 295 OE2 GLU A 18 1.428 -4.083 0.920 1.00 0.00 O ATOM 0 H GLU A 18 -1.447 -0.987 -3.048 1.00 0.00 H new ATOM 0 HA GLU A 18 0.667 -3.059 -2.716 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -1.870 -2.597 -1.119 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -0.938 -4.081 -1.098 1.00 0.00 H new ATOM 0 HG2 GLU A 18 0.250 -1.382 -0.355 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -0.510 -2.440 0.817 1.00 0.00 H new ATOM 302 N PRO A 19 -1.114 -4.677 -3.998 1.00 0.00 N ATOM 303 CA PRO A 19 -2.089 -5.384 -4.827 1.00 0.00 C ATOM 304 C PRO A 19 -3.510 -5.263 -4.253 1.00 0.00 C ATOM 305 O PRO A 19 -4.461 -5.044 -4.993 1.00 0.00 O ATOM 306 CB PRO A 19 -1.610 -6.841 -4.912 1.00 0.00 C ATOM 307 CG PRO A 19 -0.145 -6.803 -4.480 1.00 0.00 C ATOM 308 CD PRO A 19 -0.032 -5.561 -3.595 1.00 0.00 C ATOM 0 HA PRO A 19 -2.150 -4.949 -5.824 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -2.197 -7.488 -4.260 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -1.713 -7.232 -5.924 1.00 0.00 H new ATOM 0 HG2 PRO A 19 0.130 -7.705 -3.933 1.00 0.00 H new ATOM 0 HG3 PRO A 19 0.520 -6.737 -5.341 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -0.117 -5.825 -2.541 1.00 0.00 H new ATOM 0 HD3 PRO A 19 0.936 -5.077 -3.725 1.00 0.00 H new ATOM 316 N SER A 20 -3.654 -5.284 -2.932 1.00 0.00 N ATOM 317 CA SER A 20 -4.947 -5.271 -2.266 1.00 0.00 C ATOM 318 C SER A 20 -5.359 -3.843 -1.947 1.00 0.00 C ATOM 319 O SER A 20 -6.332 -3.637 -1.220 1.00 0.00 O ATOM 320 CB SER A 20 -4.889 -6.162 -1.017 1.00 0.00 C ATOM 321 OG SER A 20 -4.351 -7.444 -1.335 1.00 0.00 O ATOM 0 H SER A 20 -2.864 -5.311 -2.287 1.00 0.00 H new ATOM 0 HA SER A 20 -5.712 -5.680 -2.926 1.00 0.00 H new ATOM 0 HB2 SER A 20 -4.276 -5.685 -0.252 1.00 0.00 H new ATOM 0 HB3 SER A 20 -5.889 -6.276 -0.599 1.00 0.00 H new ATOM 0 HG SER A 20 -4.321 -7.996 -0.526 1.00 0.00 H new ATOM 327 N ASP A 21 -4.632 -2.850 -2.469 1.00 0.00 N ATOM 328 CA ASP A 21 -5.094 -1.492 -2.388 1.00 0.00 C ATOM 329 C ASP A 21 -6.302 -1.357 -3.311 1.00 0.00 C ATOM 330 O ASP A 21 -6.308 -1.889 -4.434 1.00 0.00 O ATOM 331 CB ASP A 21 -4.003 -0.493 -2.769 1.00 0.00 C ATOM 332 CG ASP A 21 -4.310 0.924 -2.276 1.00 0.00 C ATOM 333 OD1 ASP A 21 -5.187 1.085 -1.399 1.00 0.00 O ATOM 334 OD2 ASP A 21 -3.603 1.861 -2.705 1.00 0.00 O ATOM 0 H ASP A 21 -3.737 -2.974 -2.942 1.00 0.00 H new ATOM 0 HA ASP A 21 -5.370 -1.263 -1.359 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -3.051 -0.822 -2.351 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -3.888 -0.481 -3.853 1.00 0.00 H new ATOM 339 N THR A 22 -7.340 -0.699 -2.814 1.00 0.00 N ATOM 340 CA THR A 22 -8.575 -0.521 -3.550 1.00 0.00 C ATOM 341 C THR A 22 -8.416 0.552 -4.600 1.00 0.00 C ATOM 342 O THR A 22 -7.725 1.552 -4.408 1.00 0.00 O ATOM 343 CB THR A 22 -9.779 -0.153 -2.667 1.00 0.00 C ATOM 344 OG1 THR A 22 -9.394 0.783 -1.670 1.00 0.00 O ATOM 345 CG2 THR A 22 -10.398 -1.386 -2.031 1.00 0.00 C ATOM 0 H THR A 22 -7.345 -0.274 -1.887 1.00 0.00 H new ATOM 0 HA THR A 22 -8.780 -1.491 -4.003 1.00 0.00 H new ATOM 0 HB THR A 22 -10.534 0.305 -3.305 1.00 0.00 H new ATOM 0 HG1 THR A 22 -10.170 1.009 -1.117 1.00 0.00 H new ATOM 0 HG21 THR A 22 -11.246 -1.090 -1.414 1.00 0.00 H new ATOM 0 HG22 THR A 22 -10.737 -2.067 -2.812 1.00 0.00 H new ATOM 0 HG23 THR A 22 -9.655 -1.887 -1.411 1.00 0.00 H new ATOM 353 N ILE A 23 -9.170 0.388 -5.680 1.00 0.00 N ATOM 354 CA ILE A 23 -9.336 1.408 -6.701 1.00 0.00 C ATOM 355 C ILE A 23 -9.730 2.749 -6.077 1.00 0.00 C ATOM 356 O ILE A 23 -9.180 3.762 -6.501 1.00 0.00 O ATOM 357 CB ILE A 23 -10.361 0.931 -7.740 1.00 0.00 C ATOM 358 CG1 ILE A 23 -10.004 -0.428 -8.376 1.00 0.00 C ATOM 359 CG2 ILE A 23 -10.575 1.965 -8.858 1.00 0.00 C ATOM 360 CD1 ILE A 23 -8.519 -0.776 -8.521 1.00 0.00 C ATOM 0 H ILE A 23 -9.689 -0.469 -5.871 1.00 0.00 H new ATOM 0 HA ILE A 23 -8.385 1.568 -7.210 1.00 0.00 H new ATOM 0 HB ILE A 23 -11.286 0.807 -7.177 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -10.476 -1.211 -7.782 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -10.456 -0.464 -9.367 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -11.308 1.585 -9.570 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -10.938 2.898 -8.426 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -9.631 2.146 -9.371 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -8.419 -1.758 -8.983 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -8.030 -0.029 -9.147 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -8.050 -0.788 -7.537 1.00 0.00 H new ATOM 372 N GLU A 24 -10.628 2.797 -5.086 1.00 0.00 N ATOM 373 CA GLU A 24 -11.016 4.072 -4.468 1.00 0.00 C ATOM 374 C GLU A 24 -9.790 4.793 -3.898 1.00 0.00 C ATOM 375 O GLU A 24 -9.570 5.980 -4.145 1.00 0.00 O ATOM 376 CB GLU A 24 -12.041 3.823 -3.347 1.00 0.00 C ATOM 377 CG GLU A 24 -12.644 5.105 -2.741 1.00 0.00 C ATOM 378 CD GLU A 24 -13.672 5.819 -3.650 1.00 0.00 C ATOM 379 OE1 GLU A 24 -13.356 6.134 -4.824 1.00 0.00 O ATOM 380 OE2 GLU A 24 -14.792 6.114 -3.170 1.00 0.00 O ATOM 0 H GLU A 24 -11.096 1.978 -4.698 1.00 0.00 H new ATOM 0 HA GLU A 24 -11.465 4.703 -5.235 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -12.849 3.206 -3.740 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -11.561 3.251 -2.553 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -13.126 4.854 -1.796 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -11.836 5.799 -2.512 1.00 0.00 H new ATOM 387 N ASN A 25 -8.970 4.066 -3.138 1.00 0.00 N ATOM 388 CA ASN A 25 -7.834 4.665 -2.449 1.00 0.00 C ATOM 389 C ASN A 25 -6.722 4.994 -3.443 1.00 0.00 C ATOM 390 O ASN A 25 -6.057 6.018 -3.323 1.00 0.00 O ATOM 391 CB ASN A 25 -7.341 3.714 -1.359 1.00 0.00 C ATOM 392 CG ASN A 25 -6.237 4.340 -0.510 1.00 0.00 C ATOM 393 OD1 ASN A 25 -6.316 5.496 -0.101 1.00 0.00 O ATOM 394 ND2 ASN A 25 -5.205 3.578 -0.206 1.00 0.00 N ATOM 0 H ASN A 25 -9.074 3.063 -2.986 1.00 0.00 H new ATOM 0 HA ASN A 25 -8.144 5.599 -1.980 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -8.176 3.433 -0.718 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -6.970 2.798 -1.818 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -4.454 3.946 0.378 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -5.157 2.621 -0.555 1.00 0.00 H new ATOM 401 N VAL A 26 -6.569 4.180 -4.484 1.00 0.00 N ATOM 402 CA VAL A 26 -5.693 4.452 -5.608 1.00 0.00 C ATOM 403 C VAL A 26 -6.116 5.770 -6.262 1.00 0.00 C ATOM 404 O VAL A 26 -5.283 6.664 -6.384 1.00 0.00 O ATOM 405 CB VAL A 26 -5.764 3.232 -6.544 1.00 0.00 C ATOM 406 CG1 VAL A 26 -5.194 3.516 -7.932 1.00 0.00 C ATOM 407 CG2 VAL A 26 -5.050 2.013 -5.942 1.00 0.00 C ATOM 0 H VAL A 26 -7.065 3.293 -4.566 1.00 0.00 H new ATOM 0 HA VAL A 26 -4.652 4.586 -5.315 1.00 0.00 H new ATOM 0 HB VAL A 26 -6.826 3.010 -6.653 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.271 2.620 -8.547 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -5.756 4.325 -8.398 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -4.147 3.806 -7.843 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -5.122 1.172 -6.632 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -4.001 2.254 -5.771 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -5.520 1.747 -4.995 1.00 0.00 H new ATOM 417 N LYS A 27 -7.395 5.961 -6.624 1.00 0.00 N ATOM 418 CA LYS A 27 -7.835 7.242 -7.190 1.00 0.00 C ATOM 419 C LYS A 27 -7.528 8.405 -6.244 1.00 0.00 C ATOM 420 O LYS A 27 -7.177 9.485 -6.717 1.00 0.00 O ATOM 421 CB LYS A 27 -9.358 7.282 -7.441 1.00 0.00 C ATOM 422 CG LYS A 27 -9.994 6.400 -8.524 1.00 0.00 C ATOM 423 CD LYS A 27 -11.458 6.869 -8.671 1.00 0.00 C ATOM 424 CE LYS A 27 -12.404 5.872 -9.343 1.00 0.00 C ATOM 425 NZ LYS A 27 -13.782 6.462 -9.463 1.00 0.00 N ATOM 0 H LYS A 27 -8.129 5.258 -6.536 1.00 0.00 H new ATOM 0 HA LYS A 27 -7.292 7.339 -8.130 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -9.846 7.035 -6.498 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -9.618 8.315 -7.674 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -9.459 6.499 -9.468 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -9.951 5.348 -8.242 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -11.848 7.102 -7.680 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -11.469 7.796 -9.244 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -12.026 5.610 -10.331 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -12.445 4.950 -8.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -14.448 5.728 -9.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -14.084 6.829 -8.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -13.768 7.237 -10.156 1.00 0.00 H new ATOM 439 N ALA A 28 -7.645 8.217 -4.928 1.00 0.00 N ATOM 440 CA ALA A 28 -7.331 9.272 -3.967 1.00 0.00 C ATOM 441 C ALA A 28 -5.838 9.606 -3.995 1.00 0.00 C ATOM 442 O ALA A 28 -5.462 10.772 -3.880 1.00 0.00 O ATOM 443 CB ALA A 28 -7.766 8.860 -2.559 1.00 0.00 C ATOM 0 H ALA A 28 -7.955 7.342 -4.505 1.00 0.00 H new ATOM 0 HA ALA A 28 -7.883 10.168 -4.250 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -7.525 9.657 -1.856 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -8.841 8.680 -2.548 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -7.243 7.949 -2.268 1.00 0.00 H new ATOM 449 N LYS A 29 -4.971 8.619 -4.235 1.00 0.00 N ATOM 450 CA LYS A 29 -3.553 8.898 -4.458 1.00 0.00 C ATOM 451 C LYS A 29 -3.391 9.668 -5.759 1.00 0.00 C ATOM 452 O LYS A 29 -2.592 10.586 -5.828 1.00 0.00 O ATOM 453 CB LYS A 29 -2.746 7.600 -4.476 1.00 0.00 C ATOM 454 CG LYS A 29 -2.711 6.984 -3.076 1.00 0.00 C ATOM 455 CD LYS A 29 -2.112 5.575 -3.114 1.00 0.00 C ATOM 456 CE LYS A 29 -1.990 5.007 -1.690 1.00 0.00 C ATOM 457 NZ LYS A 29 -0.609 5.132 -1.140 1.00 0.00 N ATOM 0 H LYS A 29 -5.223 7.632 -4.279 1.00 0.00 H new ATOM 0 HA LYS A 29 -3.170 9.508 -3.640 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -3.190 6.896 -5.180 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -1.731 7.798 -4.820 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -2.122 7.616 -2.411 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -3.720 6.944 -2.667 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -2.740 4.922 -3.720 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -1.130 5.603 -3.587 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -2.687 5.528 -1.034 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -2.282 3.957 -1.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -0.560 4.660 -0.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 0.066 4.686 -1.793 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -0.369 6.138 -1.028 1.00 0.00 H new ATOM 471 N ILE A 30 -4.189 9.387 -6.785 1.00 0.00 N ATOM 472 CA ILE A 30 -4.116 10.195 -8.006 1.00 0.00 C ATOM 473 C ILE A 30 -4.530 11.626 -7.715 1.00 0.00 C ATOM 474 O ILE A 30 -3.923 12.525 -8.241 1.00 0.00 O ATOM 475 CB ILE A 30 -4.942 9.647 -9.177 1.00 0.00 C ATOM 476 CG1 ILE A 30 -4.825 8.143 -9.416 1.00 0.00 C ATOM 477 CG2 ILE A 30 -4.542 10.410 -10.450 1.00 0.00 C ATOM 478 CD1 ILE A 30 -3.410 7.596 -9.448 1.00 0.00 C ATOM 0 H ILE A 30 -4.874 8.632 -6.802 1.00 0.00 H new ATOM 0 HA ILE A 30 -3.074 10.153 -8.322 1.00 0.00 H new ATOM 0 HB ILE A 30 -5.988 9.804 -8.912 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -5.379 7.624 -8.634 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -5.310 7.904 -10.362 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -5.119 10.035 -11.295 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -4.744 11.473 -10.316 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -3.479 10.264 -10.643 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -3.440 6.521 -9.623 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -2.851 8.079 -10.249 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -2.921 7.795 -8.494 1.00 0.00 H new ATOM 490 N GLN A 31 -5.501 11.883 -6.863 1.00 0.00 N ATOM 491 CA GLN A 31 -5.838 13.236 -6.420 1.00 0.00 C ATOM 492 C GLN A 31 -4.606 13.893 -5.792 1.00 0.00 C ATOM 493 O GLN A 31 -4.348 15.062 -6.050 1.00 0.00 O ATOM 494 CB GLN A 31 -7.019 13.220 -5.445 1.00 0.00 C ATOM 495 CG GLN A 31 -7.574 14.617 -5.093 1.00 0.00 C ATOM 496 CD GLN A 31 -7.912 14.717 -3.605 1.00 0.00 C ATOM 497 OE1 GLN A 31 -7.063 15.050 -2.785 1.00 0.00 O ATOM 498 NE2 GLN A 31 -9.141 14.407 -3.218 1.00 0.00 N ATOM 0 H GLN A 31 -6.088 11.158 -6.450 1.00 0.00 H new ATOM 0 HA GLN A 31 -6.145 13.824 -7.285 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -7.822 12.621 -5.875 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -6.709 12.723 -4.526 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -6.840 15.379 -5.354 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -8.466 14.817 -5.686 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -9.839 14.131 -3.909 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -9.389 14.444 -2.229 1.00 0.00 H new ATOM 507 N ASP A 32 -3.805 13.138 -5.048 1.00 0.00 N ATOM 508 CA ASP A 32 -2.549 13.642 -4.503 1.00 0.00 C ATOM 509 C ASP A 32 -1.516 13.955 -5.603 1.00 0.00 C ATOM 510 O ASP A 32 -0.703 14.864 -5.416 1.00 0.00 O ATOM 511 CB ASP A 32 -1.977 12.677 -3.463 1.00 0.00 C ATOM 512 CG ASP A 32 -0.748 13.289 -2.770 1.00 0.00 C ATOM 513 OD1 ASP A 32 -0.914 14.257 -1.989 1.00 0.00 O ATOM 514 OD2 ASP A 32 0.385 12.784 -2.965 1.00 0.00 O ATOM 0 H ASP A 32 -4.005 12.167 -4.807 1.00 0.00 H new ATOM 0 HA ASP A 32 -2.773 14.586 -4.006 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -2.739 12.441 -2.720 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -1.700 11.739 -3.944 1.00 0.00 H new ATOM 519 N LYS A 33 -1.563 13.273 -6.765 1.00 0.00 N ATOM 520 CA LYS A 33 -0.536 13.410 -7.809 1.00 0.00 C ATOM 521 C LYS A 33 -0.991 14.174 -9.064 1.00 0.00 C ATOM 522 O LYS A 33 -0.158 14.572 -9.873 1.00 0.00 O ATOM 523 CB LYS A 33 0.082 12.050 -8.114 1.00 0.00 C ATOM 524 CG LYS A 33 0.542 11.368 -6.814 1.00 0.00 C ATOM 525 CD LYS A 33 1.728 10.412 -6.973 1.00 0.00 C ATOM 526 CE LYS A 33 3.048 11.119 -7.338 1.00 0.00 C ATOM 527 NZ LYS A 33 4.202 10.173 -7.373 1.00 0.00 N ATOM 0 H LYS A 33 -2.308 12.618 -7.002 1.00 0.00 H new ATOM 0 HA LYS A 33 0.243 14.056 -7.404 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -0.645 11.419 -8.626 1.00 0.00 H new ATOM 0 HB3 LYS A 33 0.930 12.171 -8.788 1.00 0.00 H new ATOM 0 HG2 LYS A 33 0.810 12.139 -6.091 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -0.298 10.815 -6.394 1.00 0.00 H new ATOM 0 HD2 LYS A 33 1.866 9.861 -6.043 1.00 0.00 H new ATOM 0 HD3 LYS A 33 1.492 9.680 -7.745 1.00 0.00 H new ATOM 0 HE2 LYS A 33 2.944 11.599 -8.311 1.00 0.00 H new ATOM 0 HE3 LYS A 33 3.249 11.908 -6.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 5.025 10.645 -7.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 4.437 9.876 -6.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 3.950 9.338 -7.940 1.00 0.00 H new ATOM 541 N GLU A 34 -2.294 14.389 -9.213 1.00 0.00 N ATOM 542 CA GLU A 34 -2.950 15.045 -10.345 1.00 0.00 C ATOM 543 C GLU A 34 -3.822 16.217 -9.893 1.00 0.00 C ATOM 544 O GLU A 34 -3.865 17.248 -10.564 1.00 0.00 O ATOM 545 CB GLU A 34 -3.853 14.035 -11.077 1.00 0.00 C ATOM 546 CG GLU A 34 -3.082 13.135 -12.036 1.00 0.00 C ATOM 547 CD GLU A 34 -2.744 13.912 -13.320 1.00 0.00 C ATOM 548 OE1 GLU A 34 -1.790 14.727 -13.298 1.00 0.00 O ATOM 549 OE2 GLU A 34 -3.434 13.714 -14.346 1.00 0.00 O ATOM 0 H GLU A 34 -2.964 14.092 -8.504 1.00 0.00 H new ATOM 0 HA GLU A 34 -2.165 15.419 -11.003 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -4.368 13.417 -10.342 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -4.619 14.576 -11.632 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -2.166 12.782 -11.562 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -3.675 12.253 -12.279 1.00 0.00 H new ATOM 556 N GLY A 35 -4.523 16.046 -8.771 1.00 0.00 N ATOM 557 CA GLY A 35 -5.390 17.061 -8.184 1.00 0.00 C ATOM 558 C GLY A 35 -6.866 16.791 -8.450 1.00 0.00 C ATOM 559 O GLY A 35 -7.688 17.676 -8.225 1.00 0.00 O ATOM 0 H GLY A 35 -4.501 15.178 -8.236 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -5.219 17.102 -7.108 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -5.124 18.038 -8.587 1.00 0.00 H new ATOM 563 N ILE A 36 -7.223 15.592 -8.941 1.00 0.00 N ATOM 564 CA ILE A 36 -8.570 15.315 -9.422 1.00 0.00 C ATOM 565 C ILE A 36 -9.266 14.479 -8.352 1.00 0.00 C ATOM 566 O ILE A 36 -8.725 13.433 -8.001 1.00 0.00 O ATOM 567 CB ILE A 36 -8.483 14.537 -10.743 1.00 0.00 C ATOM 568 CG1 ILE A 36 -7.683 15.317 -11.806 1.00 0.00 C ATOM 569 CG2 ILE A 36 -9.894 14.253 -11.289 1.00 0.00 C ATOM 570 CD1 ILE A 36 -7.361 14.423 -12.994 1.00 0.00 C ATOM 0 H ILE A 36 -6.585 14.799 -9.012 1.00 0.00 H new ATOM 0 HA ILE A 36 -9.128 16.234 -9.604 1.00 0.00 H new ATOM 0 HB ILE A 36 -7.968 13.599 -10.535 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -8.257 16.182 -12.139 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -6.760 15.697 -11.368 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -9.817 13.701 -12.226 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -10.453 13.661 -10.564 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -10.413 15.195 -11.465 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -6.796 14.990 -13.734 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -6.768 13.572 -12.659 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -8.288 14.065 -13.442 1.00 0.00 H new ATOM 582 N PRO A 37 -10.462 14.852 -7.874 1.00 0.00 N ATOM 583 CA PRO A 37 -11.185 14.074 -6.878 1.00 0.00 C ATOM 584 C PRO A 37 -11.624 12.720 -7.436 1.00 0.00 C ATOM 585 O PRO A 37 -11.870 12.606 -8.636 1.00 0.00 O ATOM 586 CB PRO A 37 -12.365 14.944 -6.430 1.00 0.00 C ATOM 587 CG PRO A 37 -12.485 16.066 -7.461 1.00 0.00 C ATOM 588 CD PRO A 37 -11.219 16.007 -8.314 1.00 0.00 C ATOM 0 HA PRO A 37 -10.553 13.830 -6.024 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -13.284 14.359 -6.383 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -12.193 15.349 -5.433 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -13.375 15.934 -8.077 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -12.578 17.035 -6.971 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -11.470 15.923 -9.371 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -10.633 16.919 -8.197 1.00 0.00 H new ATOM 596 N PRO A 38 -11.773 11.685 -6.596 1.00 0.00 N ATOM 597 CA PRO A 38 -12.033 10.335 -7.080 1.00 0.00 C ATOM 598 C PRO A 38 -13.362 10.185 -7.773 1.00 0.00 C ATOM 599 O PRO A 38 -13.446 9.438 -8.744 1.00 0.00 O ATOM 600 CB PRO A 38 -11.969 9.434 -5.859 1.00 0.00 C ATOM 601 CG PRO A 38 -12.169 10.358 -4.657 1.00 0.00 C ATOM 602 CD PRO A 38 -11.585 11.680 -5.147 1.00 0.00 C ATOM 0 HA PRO A 38 -11.293 10.074 -7.836 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -12.742 8.667 -5.897 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -11.011 8.918 -5.802 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -13.222 10.454 -4.392 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -11.650 9.989 -3.772 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -12.092 12.527 -4.684 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -10.529 11.760 -4.889 1.00 0.00 H new ATOM 610 N ASP A 39 -14.385 10.910 -7.340 1.00 0.00 N ATOM 611 CA ASP A 39 -15.696 10.787 -7.976 1.00 0.00 C ATOM 612 C ASP A 39 -15.695 11.407 -9.369 1.00 0.00 C ATOM 613 O ASP A 39 -16.496 11.053 -10.232 1.00 0.00 O ATOM 614 CB ASP A 39 -16.777 11.427 -7.099 1.00 0.00 C ATOM 615 CG ASP A 39 -18.160 11.284 -7.757 1.00 0.00 C ATOM 616 OD1 ASP A 39 -18.536 10.135 -8.086 1.00 0.00 O ATOM 617 OD2 ASP A 39 -18.850 12.310 -7.960 1.00 0.00 O ATOM 0 H ASP A 39 -14.339 11.576 -6.569 1.00 0.00 H new ATOM 0 HA ASP A 39 -15.920 9.726 -8.086 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -16.784 10.954 -6.117 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -16.549 12.481 -6.943 1.00 0.00 H new ATOM 622 N GLN A 40 -14.729 12.292 -9.617 1.00 0.00 N ATOM 623 CA GLN A 40 -14.563 12.997 -10.886 1.00 0.00 C ATOM 624 C GLN A 40 -13.618 12.242 -11.832 1.00 0.00 C ATOM 625 O GLN A 40 -13.502 12.592 -13.003 1.00 0.00 O ATOM 626 CB GLN A 40 -14.091 14.418 -10.517 1.00 0.00 C ATOM 627 CG GLN A 40 -13.776 15.347 -11.691 1.00 0.00 C ATOM 628 CD GLN A 40 -13.943 16.823 -11.317 1.00 0.00 C ATOM 629 OE1 GLN A 40 -12.970 17.531 -11.077 1.00 0.00 O ATOM 630 NE2 GLN A 40 -15.174 17.307 -11.251 1.00 0.00 N ATOM 0 H GLN A 40 -14.024 12.544 -8.924 1.00 0.00 H new ATOM 0 HA GLN A 40 -15.493 13.058 -11.452 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -14.861 14.887 -9.905 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -13.198 14.333 -9.897 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -12.754 15.172 -12.028 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -14.432 15.109 -12.528 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -15.971 16.703 -11.454 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -15.325 18.283 -10.997 1.00 0.00 H new ATOM 639 N GLN A 41 -12.997 11.159 -11.370 1.00 0.00 N ATOM 640 CA GLN A 41 -11.911 10.444 -12.017 1.00 0.00 C ATOM 641 C GLN A 41 -12.360 9.002 -12.260 1.00 0.00 C ATOM 642 O GLN A 41 -13.040 8.437 -11.410 1.00 0.00 O ATOM 643 CB GLN A 41 -10.809 10.547 -10.946 1.00 0.00 C ATOM 644 CG GLN A 41 -9.396 10.102 -11.310 1.00 0.00 C ATOM 645 CD GLN A 41 -8.600 9.796 -10.048 1.00 0.00 C ATOM 646 OE1 GLN A 41 -8.088 8.701 -9.909 1.00 0.00 O ATOM 647 NE2 GLN A 41 -8.499 10.690 -9.076 1.00 0.00 N ATOM 0 H GLN A 41 -13.258 10.735 -10.480 1.00 0.00 H new ATOM 0 HA GLN A 41 -11.589 10.823 -12.987 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -10.756 11.587 -10.624 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -11.129 9.962 -10.084 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.438 9.218 -11.946 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -8.897 10.883 -11.883 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -8.925 11.611 -9.183 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -7.995 10.458 -8.220 1.00 0.00 H new ATOM 656 N ARG A 42 -11.952 8.360 -13.356 1.00 0.00 N ATOM 657 CA ARG A 42 -12.161 6.918 -13.544 1.00 0.00 C ATOM 658 C ARG A 42 -10.819 6.235 -13.690 1.00 0.00 C ATOM 659 O ARG A 42 -9.842 6.876 -14.064 1.00 0.00 O ATOM 660 CB ARG A 42 -13.060 6.624 -14.769 1.00 0.00 C ATOM 661 CG ARG A 42 -14.217 5.684 -14.440 1.00 0.00 C ATOM 662 CD ARG A 42 -15.512 5.931 -15.228 1.00 0.00 C ATOM 663 NE ARG A 42 -16.520 4.924 -14.806 1.00 0.00 N ATOM 664 CZ ARG A 42 -17.856 5.001 -14.851 1.00 0.00 C ATOM 665 NH1 ARG A 42 -18.462 6.061 -15.347 1.00 0.00 N ATOM 666 NH2 ARG A 42 -18.588 4.011 -14.353 1.00 0.00 N ATOM 0 H ARG A 42 -11.472 8.816 -14.132 1.00 0.00 H new ATOM 0 HA ARG A 42 -12.678 6.526 -12.668 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -13.458 7.562 -15.155 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -12.454 6.184 -15.562 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -13.892 4.659 -14.620 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -14.438 5.766 -13.376 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -15.882 6.939 -15.041 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -15.324 5.853 -16.299 1.00 0.00 H new ATOM 0 HE ARG A 42 -16.142 4.054 -14.430 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -17.912 6.842 -15.705 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -19.481 6.101 -15.372 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -18.132 3.198 -13.939 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -19.606 4.064 -14.384 1.00 0.00 H new ATOM 680 N LEU A 43 -10.819 4.921 -13.483 1.00 0.00 N ATOM 681 CA LEU A 43 -9.635 4.094 -13.610 1.00 0.00 C ATOM 682 C LEU A 43 -9.948 2.985 -14.586 1.00 0.00 C ATOM 683 O LEU A 43 -10.965 2.310 -14.475 1.00 0.00 O ATOM 684 CB LEU A 43 -9.236 3.545 -12.221 1.00 0.00 C ATOM 685 CG LEU A 43 -7.760 3.792 -11.895 1.00 0.00 C ATOM 686 CD1 LEU A 43 -7.402 5.290 -11.890 1.00 0.00 C ATOM 687 CD2 LEU A 43 -7.461 3.228 -10.510 1.00 0.00 C ATOM 0 H LEU A 43 -11.655 4.399 -13.219 1.00 0.00 H new ATOM 0 HA LEU A 43 -8.788 4.668 -13.986 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -9.857 4.013 -11.457 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -9.439 2.475 -12.185 1.00 0.00 H new ATOM 0 HG LEU A 43 -7.168 3.303 -12.668 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -6.345 5.411 -11.654 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.605 5.716 -12.873 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -8.003 5.805 -11.140 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -6.412 3.398 -10.267 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -8.090 3.725 -9.771 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -7.667 2.158 -10.501 1.00 0.00 H new ATOM 699 N ILE A 44 -9.078 2.836 -15.566 1.00 0.00 N ATOM 700 CA ILE A 44 -9.125 1.808 -16.600 1.00 0.00 C ATOM 701 C ILE A 44 -7.819 1.033 -16.471 1.00 0.00 C ATOM 702 O ILE A 44 -6.816 1.567 -16.004 1.00 0.00 O ATOM 703 CB ILE A 44 -9.392 2.483 -17.979 1.00 0.00 C ATOM 704 CG1 ILE A 44 -10.741 3.238 -17.849 1.00 0.00 C ATOM 705 CG2 ILE A 44 -9.391 1.500 -19.169 1.00 0.00 C ATOM 706 CD1 ILE A 44 -11.260 3.973 -19.073 1.00 0.00 C ATOM 0 H ILE A 44 -8.277 3.458 -15.672 1.00 0.00 H new ATOM 0 HA ILE A 44 -9.941 1.093 -16.496 1.00 0.00 H new ATOM 0 HB ILE A 44 -8.575 3.166 -18.211 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -11.500 2.518 -17.543 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -10.644 3.962 -17.040 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -9.584 2.046 -20.092 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -8.420 1.008 -19.234 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -10.168 0.750 -19.022 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -12.209 4.453 -18.834 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -10.537 4.730 -19.376 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -11.407 3.264 -19.888 1.00 0.00 H new ATOM 718 N PHE A 45 -7.817 -0.221 -16.893 1.00 0.00 N ATOM 719 CA PHE A 45 -6.630 -1.051 -16.950 1.00 0.00 C ATOM 720 C PHE A 45 -6.748 -1.863 -18.217 1.00 0.00 C ATOM 721 O PHE A 45 -7.726 -2.575 -18.380 1.00 0.00 O ATOM 722 CB PHE A 45 -6.589 -1.987 -15.734 1.00 0.00 C ATOM 723 CG PHE A 45 -5.517 -3.061 -15.798 1.00 0.00 C ATOM 724 CD1 PHE A 45 -4.175 -2.700 -15.995 1.00 0.00 C ATOM 725 CD2 PHE A 45 -5.861 -4.420 -15.682 1.00 0.00 C ATOM 726 CE1 PHE A 45 -3.171 -3.683 -16.032 1.00 0.00 C ATOM 727 CE2 PHE A 45 -4.858 -5.405 -15.677 1.00 0.00 C ATOM 728 CZ PHE A 45 -3.513 -5.036 -15.848 1.00 0.00 C ATOM 0 H PHE A 45 -8.660 -0.698 -17.212 1.00 0.00 H new ATOM 0 HA PHE A 45 -5.721 -0.450 -16.942 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -6.432 -1.389 -14.837 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -7.561 -2.469 -15.630 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -3.912 -1.660 -16.119 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -6.899 -4.707 -15.597 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -2.142 -3.402 -16.201 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -5.121 -6.444 -15.542 1.00 0.00 H new ATOM 0 HZ PHE A 45 -2.741 -5.791 -15.838 1.00 0.00 H new ATOM 738 N ALA A 46 -5.781 -1.737 -19.120 1.00 0.00 N ATOM 739 CA ALA A 46 -5.625 -2.600 -20.291 1.00 0.00 C ATOM 740 C ALA A 46 -6.911 -2.859 -21.098 1.00 0.00 C ATOM 741 O ALA A 46 -7.148 -3.948 -21.626 1.00 0.00 O ATOM 742 CB ALA A 46 -4.941 -3.883 -19.821 1.00 0.00 C ATOM 0 H ALA A 46 -5.064 -1.014 -19.058 1.00 0.00 H new ATOM 0 HA ALA A 46 -5.007 -2.077 -21.021 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -4.806 -4.555 -20.669 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -3.969 -3.641 -19.392 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -5.559 -4.370 -19.067 1.00 0.00 H new ATOM 748 N GLY A 47 -7.744 -1.823 -21.171 1.00 0.00 N ATOM 749 CA GLY A 47 -8.959 -1.793 -21.969 1.00 0.00 C ATOM 750 C GLY A 47 -10.213 -2.183 -21.189 1.00 0.00 C ATOM 751 O GLY A 47 -11.269 -2.319 -21.808 1.00 0.00 O ATOM 0 H GLY A 47 -7.583 -0.956 -20.659 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -9.092 -0.791 -22.376 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -8.844 -2.469 -22.817 1.00 0.00 H new ATOM 755 N LYS A 48 -10.144 -2.325 -19.855 1.00 0.00 N ATOM 756 CA LYS A 48 -11.316 -2.578 -19.016 1.00 0.00 C ATOM 757 C LYS A 48 -11.326 -1.618 -17.840 1.00 0.00 C ATOM 758 O LYS A 48 -10.300 -1.359 -17.231 1.00 0.00 O ATOM 759 CB LYS A 48 -11.388 -4.069 -18.627 1.00 0.00 C ATOM 760 CG LYS A 48 -10.405 -4.541 -17.536 1.00 0.00 C ATOM 761 CD LYS A 48 -10.486 -6.054 -17.272 1.00 0.00 C ATOM 762 CE LYS A 48 -9.984 -6.889 -18.465 1.00 0.00 C ATOM 763 NZ LYS A 48 -10.022 -8.355 -18.201 1.00 0.00 N ATOM 0 H LYS A 48 -9.270 -2.267 -19.332 1.00 0.00 H new ATOM 0 HA LYS A 48 -12.232 -2.380 -19.572 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -12.402 -4.286 -18.290 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -11.215 -4.665 -19.523 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -9.389 -4.283 -17.833 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -10.612 -4.004 -16.610 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -9.896 -6.297 -16.388 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -11.518 -6.326 -17.051 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -10.594 -6.666 -19.341 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -8.962 -6.594 -18.705 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -9.674 -8.867 -19.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -9.419 -8.576 -17.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -11.000 -8.646 -17.999 1.00 0.00 H new ATOM 777 N GLN A 49 -12.469 -1.010 -17.573 1.00 0.00 N ATOM 778 CA GLN A 49 -12.706 -0.126 -16.438 1.00 0.00 C ATOM 779 C GLN A 49 -12.547 -0.927 -15.140 1.00 0.00 C ATOM 780 O GLN A 49 -12.857 -2.119 -15.106 1.00 0.00 O ATOM 781 CB GLN A 49 -14.145 0.393 -16.583 1.00 0.00 C ATOM 782 CG GLN A 49 -14.492 1.638 -15.759 1.00 0.00 C ATOM 783 CD GLN A 49 -16.005 1.792 -15.561 1.00 0.00 C ATOM 784 OE1 GLN A 49 -16.464 2.074 -14.464 1.00 0.00 O ATOM 785 NE2 GLN A 49 -16.812 1.662 -16.603 1.00 0.00 N ATOM 0 H GLN A 49 -13.293 -1.122 -18.164 1.00 0.00 H new ATOM 0 HA GLN A 49 -12.001 0.705 -16.410 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -14.327 0.614 -17.635 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -14.830 -0.407 -16.303 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -14.003 1.577 -14.787 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -14.100 2.524 -16.258 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -16.429 1.427 -17.519 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -17.817 1.797 -16.490 1.00 0.00 H new ATOM 794 N LEU A 50 -12.126 -0.251 -14.069 1.00 0.00 N ATOM 795 CA LEU A 50 -12.120 -0.799 -12.717 1.00 0.00 C ATOM 796 C LEU A 50 -13.181 -0.060 -11.898 1.00 0.00 C ATOM 797 O LEU A 50 -13.495 1.085 -12.233 1.00 0.00 O ATOM 798 CB LEU A 50 -10.728 -0.657 -12.071 1.00 0.00 C ATOM 799 CG LEU A 50 -9.487 -0.913 -12.947 1.00 0.00 C ATOM 800 CD1 LEU A 50 -8.225 -0.895 -12.075 1.00 0.00 C ATOM 801 CD2 LEU A 50 -9.565 -2.226 -13.733 1.00 0.00 C ATOM 0 H LEU A 50 -11.775 0.705 -14.120 1.00 0.00 H new ATOM 0 HA LEU A 50 -12.351 -1.864 -12.748 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -10.649 0.353 -11.670 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -10.683 -1.341 -11.223 1.00 0.00 H new ATOM 0 HG LEU A 50 -9.447 -0.111 -13.684 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -7.349 -1.076 -12.698 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -8.131 0.077 -11.591 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -8.297 -1.673 -11.315 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -8.661 -2.347 -14.330 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -9.656 -3.061 -13.038 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -10.434 -2.205 -14.391 1.00 0.00 H new ATOM 813 N GLU A 51 -13.682 -0.646 -10.806 1.00 0.00 N ATOM 814 CA GLU A 51 -14.667 0.006 -9.937 1.00 0.00 C ATOM 815 C GLU A 51 -14.076 0.216 -8.544 1.00 0.00 C ATOM 816 O GLU A 51 -13.174 -0.506 -8.129 1.00 0.00 O ATOM 817 CB GLU A 51 -16.027 -0.728 -9.974 1.00 0.00 C ATOM 818 CG GLU A 51 -16.021 -2.068 -9.244 1.00 0.00 C ATOM 819 CD GLU A 51 -17.324 -2.892 -9.318 1.00 0.00 C ATOM 820 OE1 GLU A 51 -18.367 -2.404 -9.818 1.00 0.00 O ATOM 821 OE2 GLU A 51 -17.306 -4.060 -8.846 1.00 0.00 O ATOM 0 H GLU A 51 -13.417 -1.582 -10.500 1.00 0.00 H new ATOM 0 HA GLU A 51 -14.895 1.003 -10.314 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -16.788 -0.086 -9.531 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -16.313 -0.892 -11.013 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -15.210 -2.674 -9.647 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -15.791 -1.885 -8.194 1.00 0.00 H new ATOM 828 N ASP A 52 -14.573 1.222 -7.826 1.00 0.00 N ATOM 829 CA ASP A 52 -13.989 1.719 -6.577 1.00 0.00 C ATOM 830 C ASP A 52 -13.874 0.650 -5.496 1.00 0.00 C ATOM 831 O ASP A 52 -12.904 0.656 -4.736 1.00 0.00 O ATOM 832 CB ASP A 52 -14.766 2.922 -6.041 1.00 0.00 C ATOM 833 CG ASP A 52 -16.031 2.532 -5.250 1.00 0.00 C ATOM 834 OD1 ASP A 52 -17.067 2.246 -5.893 1.00 0.00 O ATOM 835 OD2 ASP A 52 -15.991 2.505 -3.997 1.00 0.00 O ATOM 0 H ASP A 52 -15.414 1.728 -8.102 1.00 0.00 H new ATOM 0 HA ASP A 52 -12.975 2.028 -6.830 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -14.112 3.510 -5.398 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -15.052 3.562 -6.876 1.00 0.00 H new ATOM 840 N GLY A 53 -14.823 -0.290 -5.476 1.00 0.00 N ATOM 841 CA GLY A 53 -14.931 -1.320 -4.456 1.00 0.00 C ATOM 842 C GLY A 53 -14.021 -2.518 -4.714 1.00 0.00 C ATOM 843 O GLY A 53 -14.174 -3.549 -4.052 1.00 0.00 O ATOM 0 H GLY A 53 -15.551 -0.352 -6.188 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -14.687 -0.888 -3.485 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -15.965 -1.662 -4.402 1.00 0.00 H new ATOM 847 N ARG A 54 -13.106 -2.419 -5.681 1.00 0.00 N ATOM 848 CA ARG A 54 -12.240 -3.506 -6.120 1.00 0.00 C ATOM 849 C ARG A 54 -10.806 -3.134 -5.855 1.00 0.00 C ATOM 850 O ARG A 54 -10.530 -2.021 -5.419 1.00 0.00 O ATOM 851 CB ARG A 54 -12.500 -3.758 -7.604 1.00 0.00 C ATOM 852 CG ARG A 54 -13.910 -4.270 -7.916 1.00 0.00 C ATOM 853 CD ARG A 54 -14.262 -5.630 -7.339 1.00 0.00 C ATOM 854 NE ARG A 54 -15.538 -6.104 -7.898 1.00 0.00 N ATOM 855 CZ ARG A 54 -15.880 -7.373 -8.146 1.00 0.00 C ATOM 856 NH1 ARG A 54 -15.019 -8.378 -7.973 1.00 0.00 N ATOM 857 NH2 ARG A 54 -17.115 -7.626 -8.571 1.00 0.00 N ATOM 0 H ARG A 54 -12.946 -1.552 -6.193 1.00 0.00 H new ATOM 0 HA ARG A 54 -12.449 -4.425 -5.572 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -12.332 -2.832 -8.153 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -11.773 -4.482 -7.971 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -14.631 -3.541 -7.545 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -14.029 -4.314 -8.999 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -13.470 -6.345 -7.564 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -14.334 -5.565 -6.253 1.00 0.00 H new ATOM 0 HE ARG A 54 -16.233 -5.391 -8.119 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -14.073 -8.188 -7.644 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -15.307 -9.336 -8.170 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -17.777 -6.861 -8.701 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -17.400 -8.585 -8.767 1.00 0.00 H new ATOM 871 N THR A 55 -9.871 -4.031 -6.122 1.00 0.00 N ATOM 872 CA THR A 55 -8.474 -3.842 -5.798 1.00 0.00 C ATOM 873 C THR A 55 -7.647 -4.162 -7.018 1.00 0.00 C ATOM 874 O THR A 55 -8.130 -4.763 -7.974 1.00 0.00 O ATOM 875 CB THR A 55 -8.085 -4.769 -4.646 1.00 0.00 C ATOM 876 OG1 THR A 55 -8.490 -6.098 -4.935 1.00 0.00 O ATOM 877 CG2 THR A 55 -8.706 -4.361 -3.316 1.00 0.00 C ATOM 0 H THR A 55 -10.068 -4.923 -6.577 1.00 0.00 H new ATOM 0 HA THR A 55 -8.297 -2.810 -5.494 1.00 0.00 H new ATOM 0 HB THR A 55 -7.002 -4.698 -4.550 1.00 0.00 H new ATOM 0 HG1 THR A 55 -7.706 -6.687 -4.933 1.00 0.00 H new ATOM 0 HG21 THR A 55 -8.392 -5.058 -2.539 1.00 0.00 H new ATOM 0 HG22 THR A 55 -8.379 -3.355 -3.055 1.00 0.00 H new ATOM 0 HG23 THR A 55 -9.793 -4.378 -3.401 1.00 0.00 H new ATOM 885 N LEU A 56 -6.375 -3.790 -6.974 1.00 0.00 N ATOM 886 CA LEU A 56 -5.477 -4.064 -8.097 1.00 0.00 C ATOM 887 C LEU A 56 -5.392 -5.579 -8.336 1.00 0.00 C ATOM 888 O LEU A 56 -5.465 -6.045 -9.472 1.00 0.00 O ATOM 889 CB LEU A 56 -4.100 -3.416 -7.846 1.00 0.00 C ATOM 890 CG LEU A 56 -4.170 -1.933 -7.447 1.00 0.00 C ATOM 891 CD1 LEU A 56 -2.768 -1.365 -7.293 1.00 0.00 C ATOM 892 CD2 LEU A 56 -4.900 -1.112 -8.514 1.00 0.00 C ATOM 0 H LEU A 56 -5.943 -3.305 -6.188 1.00 0.00 H new ATOM 0 HA LEU A 56 -5.871 -3.617 -9.010 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -3.587 -3.969 -7.059 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -3.495 -3.511 -8.748 1.00 0.00 H new ATOM 0 HG LEU A 56 -4.712 -1.872 -6.503 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -2.830 -0.314 -7.010 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -2.234 -1.918 -6.520 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -2.233 -1.455 -8.238 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -4.936 -0.067 -8.207 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -4.369 -1.194 -9.462 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -5.915 -1.490 -8.633 1.00 0.00 H new ATOM 904 N SER A 57 -5.350 -6.347 -7.256 1.00 0.00 N ATOM 905 CA SER A 57 -5.376 -7.797 -7.253 1.00 0.00 C ATOM 906 C SER A 57 -6.659 -8.388 -7.832 1.00 0.00 C ATOM 907 O SER A 57 -6.589 -9.436 -8.477 1.00 0.00 O ATOM 908 CB SER A 57 -5.199 -8.270 -5.814 1.00 0.00 C ATOM 909 OG SER A 57 -6.043 -7.562 -4.907 1.00 0.00 O ATOM 0 H SER A 57 -5.294 -5.954 -6.316 1.00 0.00 H new ATOM 0 HA SER A 57 -4.567 -8.143 -7.897 1.00 0.00 H new ATOM 0 HB2 SER A 57 -5.417 -9.336 -5.754 1.00 0.00 H new ATOM 0 HB3 SER A 57 -4.159 -8.141 -5.516 1.00 0.00 H new ATOM 0 HG SER A 57 -5.899 -7.897 -3.997 1.00 0.00 H new ATOM 915 N ASP A 58 -7.811 -7.720 -7.682 1.00 0.00 N ATOM 916 CA ASP A 58 -9.068 -8.177 -8.285 1.00 0.00 C ATOM 917 C ASP A 58 -8.932 -8.225 -9.813 1.00 0.00 C ATOM 918 O ASP A 58 -9.542 -9.065 -10.480 1.00 0.00 O ATOM 919 CB ASP A 58 -10.216 -7.250 -7.895 1.00 0.00 C ATOM 920 CG ASP A 58 -11.569 -7.833 -8.339 1.00 0.00 C ATOM 921 OD1 ASP A 58 -12.042 -7.538 -9.458 1.00 0.00 O ATOM 922 OD2 ASP A 58 -12.219 -8.524 -7.523 1.00 0.00 O ATOM 0 H ASP A 58 -7.897 -6.857 -7.145 1.00 0.00 H new ATOM 0 HA ASP A 58 -9.286 -9.178 -7.914 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -10.217 -7.100 -6.815 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -10.070 -6.271 -8.352 1.00 0.00 H new ATOM 927 N TYR A 59 -8.040 -7.376 -10.333 1.00 0.00 N ATOM 928 CA TYR A 59 -7.743 -7.226 -11.755 1.00 0.00 C ATOM 929 C TYR A 59 -6.396 -7.851 -12.137 1.00 0.00 C ATOM 930 O TYR A 59 -5.939 -7.716 -13.272 1.00 0.00 O ATOM 931 CB TYR A 59 -7.847 -5.742 -12.117 1.00 0.00 C ATOM 932 CG TYR A 59 -9.241 -5.199 -11.920 1.00 0.00 C ATOM 933 CD1 TYR A 59 -10.277 -5.581 -12.798 1.00 0.00 C ATOM 934 CD2 TYR A 59 -9.520 -4.350 -10.832 1.00 0.00 C ATOM 935 CE1 TYR A 59 -11.588 -5.118 -12.597 1.00 0.00 C ATOM 936 CE2 TYR A 59 -10.828 -3.911 -10.609 1.00 0.00 C ATOM 937 CZ TYR A 59 -11.871 -4.279 -11.492 1.00 0.00 C ATOM 938 OH TYR A 59 -13.124 -3.764 -11.306 1.00 0.00 O ATOM 0 H TYR A 59 -7.485 -6.751 -9.749 1.00 0.00 H new ATOM 0 HA TYR A 59 -8.475 -7.779 -12.343 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -7.148 -5.172 -11.505 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -7.549 -5.602 -13.156 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -10.061 -6.234 -13.631 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -8.725 -4.039 -10.171 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -12.375 -5.400 -13.281 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -11.045 -3.286 -9.756 1.00 0.00 H new ATOM 0 HH TYR A 59 -13.768 -4.497 -11.209 1.00 0.00 H new ATOM 948 N ASN A 60 -5.777 -8.568 -11.195 1.00 0.00 N ATOM 949 CA ASN A 60 -4.531 -9.319 -11.332 1.00 0.00 C ATOM 950 C ASN A 60 -3.319 -8.444 -11.677 1.00 0.00 C ATOM 951 O ASN A 60 -2.282 -8.944 -12.115 1.00 0.00 O ATOM 952 CB ASN A 60 -4.712 -10.519 -12.282 1.00 0.00 C ATOM 953 CG ASN A 60 -3.924 -11.720 -11.784 1.00 0.00 C ATOM 954 OD1 ASN A 60 -2.912 -12.121 -12.355 1.00 0.00 O ATOM 955 ND2 ASN A 60 -4.385 -12.318 -10.695 1.00 0.00 N ATOM 0 H ASN A 60 -6.161 -8.643 -10.253 1.00 0.00 H new ATOM 0 HA ASN A 60 -4.294 -9.722 -10.347 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -5.769 -10.776 -12.355 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -4.379 -10.249 -13.284 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -3.898 -13.129 -10.314 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -5.227 -11.967 -10.238 1.00 0.00 H new ATOM 962 N ILE A 61 -3.447 -7.133 -11.468 1.00 0.00 N ATOM 963 CA ILE A 61 -2.366 -6.163 -11.526 1.00 0.00 C ATOM 964 C ILE A 61 -1.389 -6.527 -10.398 1.00 0.00 C ATOM 965 O ILE A 61 -1.803 -6.942 -9.310 1.00 0.00 O ATOM 966 CB ILE A 61 -2.988 -4.763 -11.313 1.00 0.00 C ATOM 967 CG1 ILE A 61 -3.975 -4.377 -12.436 1.00 0.00 C ATOM 968 CG2 ILE A 61 -1.928 -3.655 -11.163 1.00 0.00 C ATOM 969 CD1 ILE A 61 -5.005 -3.353 -11.954 1.00 0.00 C ATOM 0 H ILE A 61 -4.346 -6.706 -11.245 1.00 0.00 H new ATOM 0 HA ILE A 61 -1.834 -6.164 -12.477 1.00 0.00 H new ATOM 0 HB ILE A 61 -3.539 -4.841 -10.376 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -3.423 -3.968 -13.282 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -4.488 -5.270 -12.793 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -2.423 -2.695 -11.016 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -1.294 -3.872 -10.303 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -1.315 -3.613 -12.064 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -5.682 -3.106 -12.771 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -5.575 -3.773 -11.125 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.493 -2.450 -11.622 1.00 0.00 H new ATOM 981 N GLN A 62 -0.100 -6.320 -10.653 1.00 0.00 N ATOM 982 CA GLN A 62 0.985 -6.526 -9.703 1.00 0.00 C ATOM 983 C GLN A 62 1.797 -5.228 -9.639 1.00 0.00 C ATOM 984 O GLN A 62 1.361 -4.184 -10.122 1.00 0.00 O ATOM 985 CB GLN A 62 1.822 -7.740 -10.159 1.00 0.00 C ATOM 986 CG GLN A 62 0.982 -9.025 -10.287 1.00 0.00 C ATOM 987 CD GLN A 62 1.812 -10.217 -10.771 1.00 0.00 C ATOM 988 OE1 GLN A 62 2.842 -10.563 -10.191 1.00 0.00 O ATOM 989 NE2 GLN A 62 1.386 -10.872 -11.843 1.00 0.00 N ATOM 0 H GLN A 62 0.228 -5.992 -11.561 1.00 0.00 H new ATOM 0 HA GLN A 62 0.622 -6.750 -8.700 1.00 0.00 H new ATOM 0 HB2 GLN A 62 2.286 -7.516 -11.120 1.00 0.00 H new ATOM 0 HB3 GLN A 62 2.630 -7.908 -9.447 1.00 0.00 H new ATOM 0 HG2 GLN A 62 0.537 -9.263 -9.321 1.00 0.00 H new ATOM 0 HG3 GLN A 62 0.160 -8.851 -10.982 1.00 0.00 H new ATOM 0 HE21 GLN A 62 0.532 -10.576 -12.315 1.00 0.00 H new ATOM 0 HE22 GLN A 62 1.913 -11.671 -12.195 1.00 0.00 H new ATOM 998 N LYS A 63 2.972 -5.248 -9.013 1.00 0.00 N ATOM 999 CA LYS A 63 3.903 -4.132 -9.024 1.00 0.00 C ATOM 1000 C LYS A 63 4.374 -3.831 -10.432 1.00 0.00 C ATOM 1001 O LYS A 63 4.218 -4.648 -11.340 1.00 0.00 O ATOM 1002 CB LYS A 63 5.094 -4.446 -8.113 1.00 0.00 C ATOM 1003 CG LYS A 63 6.115 -5.443 -8.660 1.00 0.00 C ATOM 1004 CD LYS A 63 7.065 -5.825 -7.514 1.00 0.00 C ATOM 1005 CE LYS A 63 8.153 -6.819 -7.924 1.00 0.00 C ATOM 1006 NZ LYS A 63 9.335 -6.179 -8.563 1.00 0.00 N ATOM 0 H LYS A 63 3.304 -6.051 -8.479 1.00 0.00 H new ATOM 0 HA LYS A 63 3.390 -3.246 -8.649 1.00 0.00 H new ATOM 0 HB2 LYS A 63 5.611 -3.513 -7.891 1.00 0.00 H new ATOM 0 HB3 LYS A 63 4.711 -4.831 -7.168 1.00 0.00 H new ATOM 0 HG2 LYS A 63 5.612 -6.328 -9.050 1.00 0.00 H new ATOM 0 HG3 LYS A 63 6.673 -5.003 -9.487 1.00 0.00 H new ATOM 0 HD2 LYS A 63 7.537 -4.921 -7.129 1.00 0.00 H new ATOM 0 HD3 LYS A 63 6.483 -6.253 -6.698 1.00 0.00 H new ATOM 0 HE2 LYS A 63 8.481 -7.370 -7.042 1.00 0.00 H new ATOM 0 HE3 LYS A 63 7.727 -7.547 -8.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 9.969 -6.914 -8.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 9.019 -5.566 -9.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 9.844 -5.609 -7.858 1.00 0.00 H new ATOM 1020 N GLU A 64 5.001 -2.665 -10.541 1.00 0.00 N ATOM 1021 CA GLU A 64 5.575 -2.095 -11.742 1.00 0.00 C ATOM 1022 C GLU A 64 4.671 -2.364 -12.953 1.00 0.00 C ATOM 1023 O GLU A 64 5.102 -2.818 -14.017 1.00 0.00 O ATOM 1024 CB GLU A 64 7.078 -2.451 -11.859 1.00 0.00 C ATOM 1025 CG GLU A 64 7.438 -3.863 -12.328 1.00 0.00 C ATOM 1026 CD GLU A 64 8.905 -4.208 -12.008 1.00 0.00 C ATOM 1027 OE1 GLU A 64 9.802 -3.880 -12.826 1.00 0.00 O ATOM 1028 OE2 GLU A 64 9.165 -4.822 -10.944 1.00 0.00 O ATOM 0 H GLU A 64 5.127 -2.055 -9.733 1.00 0.00 H new ATOM 0 HA GLU A 64 5.596 -1.006 -11.694 1.00 0.00 H new ATOM 0 HB2 GLU A 64 7.539 -1.741 -12.546 1.00 0.00 H new ATOM 0 HB3 GLU A 64 7.537 -2.294 -10.883 1.00 0.00 H new ATOM 0 HG2 GLU A 64 6.780 -4.586 -11.846 1.00 0.00 H new ATOM 0 HG3 GLU A 64 7.270 -3.945 -13.402 1.00 0.00 H new ATOM 1035 N SER A 65 3.375 -2.109 -12.745 1.00 0.00 N ATOM 1036 CA SER A 65 2.338 -2.407 -13.731 1.00 0.00 C ATOM 1037 C SER A 65 1.610 -1.115 -14.055 1.00 0.00 C ATOM 1038 O SER A 65 1.563 -0.208 -13.222 1.00 0.00 O ATOM 1039 CB SER A 65 1.384 -3.493 -13.222 1.00 0.00 C ATOM 1040 OG SER A 65 2.044 -4.738 -13.061 1.00 0.00 O ATOM 0 H SER A 65 3.018 -1.690 -11.886 1.00 0.00 H new ATOM 0 HA SER A 65 2.788 -2.804 -14.641 1.00 0.00 H new ATOM 0 HB2 SER A 65 0.955 -3.183 -12.269 1.00 0.00 H new ATOM 0 HB3 SER A 65 0.557 -3.608 -13.922 1.00 0.00 H new ATOM 0 HG SER A 65 2.798 -4.631 -12.445 1.00 0.00 H new ATOM 1046 N THR A 66 1.043 -1.033 -15.249 1.00 0.00 N ATOM 1047 CA THR A 66 0.503 0.204 -15.795 1.00 0.00 C ATOM 1048 C THR A 66 -1.014 0.192 -15.706 1.00 0.00 C ATOM 1049 O THR A 66 -1.651 -0.848 -15.834 1.00 0.00 O ATOM 1050 CB THR A 66 1.020 0.401 -17.239 1.00 0.00 C ATOM 1051 OG1 THR A 66 2.432 0.256 -17.242 1.00 0.00 O ATOM 1052 CG2 THR A 66 0.662 1.758 -17.869 1.00 0.00 C ATOM 0 H THR A 66 0.943 -1.833 -15.874 1.00 0.00 H new ATOM 0 HA THR A 66 0.846 1.058 -15.210 1.00 0.00 H new ATOM 0 HB THR A 66 0.523 -0.357 -17.845 1.00 0.00 H new ATOM 0 HG1 THR A 66 2.771 0.377 -18.153 1.00 0.00 H new ATOM 0 HG21 THR A 66 1.065 1.807 -18.881 1.00 0.00 H new ATOM 0 HG22 THR A 66 -0.422 1.868 -17.904 1.00 0.00 H new ATOM 0 HG23 THR A 66 1.089 2.562 -17.269 1.00 0.00 H new ATOM 1060 N LEU A 67 -1.582 1.375 -15.505 1.00 0.00 N ATOM 1061 CA LEU A 67 -2.998 1.676 -15.386 1.00 0.00 C ATOM 1062 C LEU A 67 -3.331 2.865 -16.281 1.00 0.00 C ATOM 1063 O LEU A 67 -2.421 3.501 -16.805 1.00 0.00 O ATOM 1064 CB LEU A 67 -3.255 2.042 -13.916 1.00 0.00 C ATOM 1065 CG LEU A 67 -4.406 1.285 -13.278 1.00 0.00 C ATOM 1066 CD1 LEU A 67 -4.053 -0.191 -13.133 1.00 0.00 C ATOM 1067 CD2 LEU A 67 -4.659 1.860 -11.889 1.00 0.00 C ATOM 0 H LEU A 67 -1.013 2.217 -15.414 1.00 0.00 H new ATOM 0 HA LEU A 67 -3.614 0.829 -15.687 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -2.348 1.852 -13.342 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -3.457 3.111 -13.849 1.00 0.00 H new ATOM 0 HG LEU A 67 -5.290 1.384 -13.907 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -4.887 -0.721 -12.674 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -3.850 -0.615 -14.117 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -3.168 -0.293 -12.505 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -5.484 1.325 -11.419 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -3.761 1.750 -11.281 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -4.913 2.917 -11.973 1.00 0.00 H new ATOM 1079 N HIS A 68 -4.607 3.224 -16.384 1.00 0.00 N ATOM 1080 CA HIS A 68 -5.075 4.354 -17.191 1.00 0.00 C ATOM 1081 C HIS A 68 -5.929 5.277 -16.314 1.00 0.00 C ATOM 1082 O HIS A 68 -6.793 4.776 -15.593 1.00 0.00 O ATOM 1083 CB HIS A 68 -5.886 3.816 -18.382 1.00 0.00 C ATOM 1084 CG HIS A 68 -5.114 3.629 -19.661 1.00 0.00 C ATOM 1085 ND1 HIS A 68 -4.291 2.577 -20.008 1.00 0.00 N ATOM 1086 CD2 HIS A 68 -5.219 4.432 -20.758 1.00 0.00 C ATOM 1087 CE1 HIS A 68 -3.921 2.745 -21.294 1.00 0.00 C ATOM 1088 NE2 HIS A 68 -4.460 3.872 -21.784 1.00 0.00 N ATOM 0 H HIS A 68 -5.360 2.732 -15.903 1.00 0.00 H new ATOM 0 HA HIS A 68 -4.231 4.927 -17.575 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -6.323 2.858 -18.099 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -6.713 4.499 -18.574 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -4.012 1.808 -19.399 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -5.792 5.345 -20.821 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -3.284 2.071 -21.848 1.00 0.00 H new ATOM 1095 N LEU A 69 -5.756 6.605 -16.394 1.00 0.00 N ATOM 1096 CA LEU A 69 -6.576 7.587 -15.680 1.00 0.00 C ATOM 1097 C LEU A 69 -7.453 8.271 -16.704 1.00 0.00 C ATOM 1098 O LEU A 69 -6.910 8.668 -17.726 1.00 0.00 O ATOM 1099 CB LEU A 69 -5.635 8.678 -15.110 1.00 0.00 C ATOM 1100 CG LEU A 69 -6.067 9.515 -13.911 1.00 0.00 C ATOM 1101 CD1 LEU A 69 -6.951 10.698 -14.301 1.00 0.00 C ATOM 1102 CD2 LEU A 69 -6.701 8.646 -12.839 1.00 0.00 C ATOM 0 H LEU A 69 -5.028 7.031 -16.968 1.00 0.00 H new ATOM 0 HA LEU A 69 -7.156 7.106 -14.892 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -4.699 8.189 -14.842 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -5.412 9.369 -15.923 1.00 0.00 H new ATOM 0 HG LEU A 69 -5.164 9.954 -13.486 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -7.227 11.256 -13.407 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -6.405 11.351 -14.983 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -7.852 10.332 -14.793 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -7.000 9.269 -11.996 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -7.578 8.145 -13.249 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -5.981 7.900 -12.502 1.00 0.00 H new ATOM 1114 N VAL A 70 -8.735 8.492 -16.428 1.00 0.00 N ATOM 1115 CA VAL A 70 -9.601 9.341 -17.260 1.00 0.00 C ATOM 1116 C VAL A 70 -10.377 10.254 -16.331 1.00 0.00 C ATOM 1117 O VAL A 70 -10.507 9.978 -15.141 1.00 0.00 O ATOM 1118 CB VAL A 70 -10.540 8.493 -18.160 1.00 0.00 C ATOM 1119 CG1 VAL A 70 -9.863 7.274 -18.793 1.00 0.00 C ATOM 1120 CG2 VAL A 70 -11.775 7.941 -17.463 1.00 0.00 C ATOM 0 H VAL A 70 -9.210 8.089 -15.620 1.00 0.00 H new ATOM 0 HA VAL A 70 -8.998 9.937 -17.945 1.00 0.00 H new ATOM 0 HB VAL A 70 -10.823 9.230 -18.911 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -10.585 6.734 -19.406 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -9.031 7.602 -19.416 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -9.490 6.616 -18.008 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -12.366 7.364 -18.174 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -11.470 7.298 -16.638 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -12.374 8.766 -17.078 1.00 0.00 H new ATOM 1130 N LEU A 71 -10.955 11.305 -16.887 1.00 0.00 N ATOM 1131 CA LEU A 71 -11.907 12.147 -16.196 1.00 0.00 C ATOM 1132 C LEU A 71 -13.273 11.569 -16.501 1.00 0.00 C ATOM 1133 O LEU A 71 -13.596 11.384 -17.666 1.00 0.00 O ATOM 1134 CB LEU A 71 -11.855 13.550 -16.800 1.00 0.00 C ATOM 1135 CG LEU A 71 -12.749 14.552 -16.053 1.00 0.00 C ATOM 1136 CD1 LEU A 71 -12.089 15.015 -14.751 1.00 0.00 C ATOM 1137 CD2 LEU A 71 -13.160 15.683 -16.995 1.00 0.00 C ATOM 0 H LEU A 71 -10.771 11.599 -17.846 1.00 0.00 H new ATOM 0 HA LEU A 71 -11.698 12.193 -15.127 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -10.826 13.908 -16.787 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -12.163 13.503 -17.844 1.00 0.00 H new ATOM 0 HG LEU A 71 -13.673 14.067 -15.739 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -12.744 15.723 -14.243 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -11.915 14.154 -14.105 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -11.138 15.497 -14.977 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -13.794 16.390 -16.460 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -12.269 16.196 -17.358 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -13.711 15.270 -17.840 1.00 0.00 H new ATOM 1149 N ARG A 72 -14.105 11.409 -15.484 1.00 0.00 N ATOM 1150 CA ARG A 72 -15.519 11.078 -15.649 1.00 0.00 C ATOM 1151 C ARG A 72 -16.444 12.125 -15.045 1.00 0.00 C ATOM 1152 O ARG A 72 -17.637 11.881 -14.929 1.00 0.00 O ATOM 1153 CB ARG A 72 -15.811 9.653 -15.156 1.00 0.00 C ATOM 1154 CG ARG A 72 -15.943 9.476 -13.620 1.00 0.00 C ATOM 1155 CD ARG A 72 -17.392 9.121 -13.250 1.00 0.00 C ATOM 1156 NE ARG A 72 -17.593 8.960 -11.790 1.00 0.00 N ATOM 1157 CZ ARG A 72 -18.293 7.998 -11.170 1.00 0.00 C ATOM 1158 NH1 ARG A 72 -18.840 7.000 -11.861 1.00 0.00 N ATOM 1159 NH2 ARG A 72 -18.454 8.027 -9.855 1.00 0.00 N ATOM 0 H ARG A 72 -13.819 11.505 -14.510 1.00 0.00 H new ATOM 0 HA ARG A 72 -15.737 11.095 -16.717 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -16.736 9.312 -15.621 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -15.015 8.998 -15.510 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -15.270 8.690 -13.278 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -15.645 10.394 -13.114 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -18.057 9.902 -13.619 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -17.674 8.197 -13.754 1.00 0.00 H new ATOM 0 HE ARG A 72 -17.151 9.657 -11.191 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -18.729 6.960 -12.874 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -19.370 6.275 -11.377 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -18.045 8.784 -9.308 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -18.987 7.292 -9.390 1.00 0.00 H new ATOM 1331 N ILE B 683 -6.166 15.407 -21.824 1.00 0.00 N ATOM 1332 CA ILE B 683 -6.549 14.243 -22.579 1.00 0.00 C ATOM 1333 C ILE B 683 -5.803 14.335 -23.927 1.00 0.00 C ATOM 1334 O ILE B 683 -5.673 15.415 -24.507 1.00 0.00 O ATOM 1335 CB ILE B 683 -8.083 14.225 -22.759 1.00 0.00 C ATOM 1336 CG1 ILE B 683 -8.994 14.747 -21.605 1.00 0.00 C ATOM 1337 CG2 ILE B 683 -8.523 12.810 -23.051 1.00 0.00 C ATOM 1338 CD1 ILE B 683 -8.945 14.071 -20.224 1.00 0.00 C ATOM 0 HA ILE B 683 -6.285 13.314 -22.074 1.00 0.00 H new ATOM 0 HB ILE B 683 -8.226 14.944 -23.566 1.00 0.00 H new ATOM 0 HG12 ILE B 683 -8.760 15.802 -21.459 1.00 0.00 H new ATOM 0 HG13 ILE B 683 -10.025 14.694 -21.956 1.00 0.00 H new ATOM 0 HG21 ILE B 683 -9.605 12.785 -23.180 1.00 0.00 H new ATOM 0 HG22 ILE B 683 -8.040 12.460 -23.963 1.00 0.00 H new ATOM 0 HG23 ILE B 683 -8.242 12.163 -22.220 1.00 0.00 H new ATOM 0 HD11 ILE B 683 -9.644 14.567 -19.551 1.00 0.00 H new ATOM 0 HD12 ILE B 683 -9.220 13.021 -20.323 1.00 0.00 H new ATOM 0 HD13 ILE B 683 -7.936 14.145 -19.818 1.00 0.00 H new ATOM 1350 N ASP B 684 -5.316 13.207 -24.443 1.00 0.00 N ATOM 1351 CA ASP B 684 -4.487 13.118 -25.644 1.00 0.00 C ATOM 1352 C ASP B 684 -4.965 11.935 -26.494 1.00 0.00 C ATOM 1353 O ASP B 684 -5.170 10.849 -25.935 1.00 0.00 O ATOM 1354 CB ASP B 684 -3.008 12.936 -25.273 1.00 0.00 C ATOM 1355 CG ASP B 684 -2.160 12.849 -26.550 1.00 0.00 C ATOM 1356 OD1 ASP B 684 -2.032 11.737 -27.111 1.00 0.00 O ATOM 1357 OD2 ASP B 684 -1.642 13.897 -27.003 1.00 0.00 O ATOM 0 H ASP B 684 -5.495 12.296 -24.020 1.00 0.00 H new ATOM 0 HA ASP B 684 -4.581 14.044 -26.212 1.00 0.00 H new ATOM 0 HB2 ASP B 684 -2.672 13.771 -24.658 1.00 0.00 H new ATOM 0 HB3 ASP B 684 -2.881 12.031 -24.678 1.00 0.00 H new ATOM 1362 N PRO B 685 -5.164 12.113 -27.818 1.00 0.00 N ATOM 1363 CA PRO B 685 -5.634 11.075 -28.729 1.00 0.00 C ATOM 1364 C PRO B 685 -4.940 9.722 -28.584 1.00 0.00 C ATOM 1365 O PRO B 685 -5.625 8.712 -28.683 1.00 0.00 O ATOM 1366 CB PRO B 685 -5.439 11.640 -30.137 1.00 0.00 C ATOM 1367 CG PRO B 685 -5.643 13.135 -29.928 1.00 0.00 C ATOM 1368 CD PRO B 685 -5.023 13.367 -28.549 1.00 0.00 C ATOM 0 HA PRO B 685 -6.675 10.850 -28.497 1.00 0.00 H new ATOM 0 HB2 PRO B 685 -4.447 11.417 -30.529 1.00 0.00 H new ATOM 0 HB3 PRO B 685 -6.160 11.227 -30.843 1.00 0.00 H new ATOM 0 HG2 PRO B 685 -5.147 13.724 -30.700 1.00 0.00 H new ATOM 0 HG3 PRO B 685 -6.698 13.407 -29.949 1.00 0.00 H new ATOM 0 HD2 PRO B 685 -3.974 13.649 -28.637 1.00 0.00 H new ATOM 0 HD3 PRO B 685 -5.529 14.180 -28.027 1.00 0.00 H new ATOM 1376 N GLN B 686 -3.626 9.657 -28.334 1.00 0.00 N ATOM 1377 CA GLN B 686 -2.921 8.380 -28.302 1.00 0.00 C ATOM 1378 C GLN B 686 -3.492 7.519 -27.169 1.00 0.00 C ATOM 1379 O GLN B 686 -3.910 6.385 -27.403 1.00 0.00 O ATOM 1380 CB GLN B 686 -1.401 8.622 -28.175 1.00 0.00 C ATOM 1381 CG GLN B 686 -0.529 7.383 -28.460 1.00 0.00 C ATOM 1382 CD GLN B 686 -0.582 6.319 -27.357 1.00 0.00 C ATOM 1383 OE1 GLN B 686 -0.493 6.628 -26.168 1.00 0.00 O ATOM 1384 NE2 GLN B 686 -0.723 5.053 -27.711 1.00 0.00 N ATOM 0 H GLN B 686 -3.038 10.470 -28.153 1.00 0.00 H new ATOM 0 HA GLN B 686 -3.071 7.832 -29.232 1.00 0.00 H new ATOM 0 HB2 GLN B 686 -1.114 9.418 -28.862 1.00 0.00 H new ATOM 0 HB3 GLN B 686 -1.186 8.978 -27.167 1.00 0.00 H new ATOM 0 HG2 GLN B 686 -0.849 6.934 -29.400 1.00 0.00 H new ATOM 0 HG3 GLN B 686 0.505 7.702 -28.595 1.00 0.00 H new ATOM 0 HE21 GLN B 686 -0.796 4.804 -28.698 1.00 0.00 H new ATOM 0 HE22 GLN B 686 -0.759 4.325 -26.998 1.00 0.00 H new ATOM 1393 N VAL B 687 -3.564 8.064 -25.956 1.00 0.00 N ATOM 1394 CA VAL B 687 -4.043 7.320 -24.798 1.00 0.00 C ATOM 1395 C VAL B 687 -5.535 7.041 -24.939 1.00 0.00 C ATOM 1396 O VAL B 687 -6.033 5.960 -24.644 1.00 0.00 O ATOM 1397 CB VAL B 687 -3.794 8.112 -23.504 1.00 0.00 C ATOM 1398 CG1 VAL B 687 -4.030 7.166 -22.326 1.00 0.00 C ATOM 1399 CG2 VAL B 687 -2.383 8.705 -23.446 1.00 0.00 C ATOM 0 H VAL B 687 -3.294 9.026 -25.751 1.00 0.00 H new ATOM 0 HA VAL B 687 -3.497 6.378 -24.747 1.00 0.00 H new ATOM 0 HB VAL B 687 -4.480 8.958 -23.466 1.00 0.00 H new ATOM 0 HG11 VAL B 687 -3.861 7.700 -21.391 1.00 0.00 H new ATOM 0 HG12 VAL B 687 -5.056 6.799 -22.354 1.00 0.00 H new ATOM 0 HG13 VAL B 687 -3.342 6.323 -22.392 1.00 0.00 H new ATOM 0 HG21 VAL B 687 -2.257 9.255 -22.513 1.00 0.00 H new ATOM 0 HG22 VAL B 687 -1.648 7.901 -23.496 1.00 0.00 H new ATOM 0 HG23 VAL B 687 -2.238 9.382 -24.288 1.00 0.00 H new ATOM 1409 N PHE B 688 -6.263 8.046 -25.387 1.00 0.00 N ATOM 1410 CA PHE B 688 -7.685 8.018 -25.583 1.00 0.00 C ATOM 1411 C PHE B 688 -8.078 7.024 -26.693 1.00 0.00 C ATOM 1412 O PHE B 688 -9.204 6.537 -26.679 1.00 0.00 O ATOM 1413 CB PHE B 688 -8.051 9.480 -25.794 1.00 0.00 C ATOM 1414 CG PHE B 688 -9.530 9.801 -25.978 1.00 0.00 C ATOM 1415 CD1 PHE B 688 -10.458 9.615 -24.933 1.00 0.00 C ATOM 1416 CD2 PHE B 688 -9.986 10.295 -27.215 1.00 0.00 C ATOM 1417 CE1 PHE B 688 -11.819 9.924 -25.123 1.00 0.00 C ATOM 1418 CE2 PHE B 688 -11.342 10.603 -27.403 1.00 0.00 C ATOM 1419 CZ PHE B 688 -12.262 10.419 -26.359 1.00 0.00 C ATOM 0 H PHE B 688 -5.850 8.945 -25.634 1.00 0.00 H new ATOM 0 HA PHE B 688 -8.260 7.628 -24.743 1.00 0.00 H new ATOM 0 HB2 PHE B 688 -7.684 10.048 -24.939 1.00 0.00 H new ATOM 0 HB3 PHE B 688 -7.514 9.841 -26.671 1.00 0.00 H new ATOM 0 HD1 PHE B 688 -10.123 9.233 -23.980 1.00 0.00 H new ATOM 0 HD2 PHE B 688 -9.287 10.438 -28.026 1.00 0.00 H new ATOM 0 HE1 PHE B 688 -12.522 9.780 -24.316 1.00 0.00 H new ATOM 0 HE2 PHE B 688 -11.679 10.984 -28.356 1.00 0.00 H new ATOM 0 HZ PHE B 688 -13.305 10.657 -26.506 1.00 0.00 H new ATOM 1429 N TYR B 689 -7.159 6.627 -27.587 1.00 0.00 N ATOM 1430 CA TYR B 689 -7.342 5.544 -28.550 1.00 0.00 C ATOM 1431 C TYR B 689 -6.940 4.181 -27.952 1.00 0.00 C ATOM 1432 O TYR B 689 -7.525 3.156 -28.300 1.00 0.00 O ATOM 1433 CB TYR B 689 -6.510 5.843 -29.806 1.00 0.00 C ATOM 1434 CG TYR B 689 -6.915 5.035 -31.021 1.00 0.00 C ATOM 1435 CD1 TYR B 689 -7.922 5.534 -31.870 1.00 0.00 C ATOM 1436 CD2 TYR B 689 -6.289 3.807 -31.308 1.00 0.00 C ATOM 1437 CE1 TYR B 689 -8.309 4.802 -33.009 1.00 0.00 C ATOM 1438 CE2 TYR B 689 -6.670 3.077 -32.449 1.00 0.00 C ATOM 1439 CZ TYR B 689 -7.686 3.567 -33.302 1.00 0.00 C ATOM 1440 OH TYR B 689 -8.052 2.843 -34.400 1.00 0.00 O ATOM 0 H TYR B 689 -6.242 7.068 -27.657 1.00 0.00 H new ATOM 0 HA TYR B 689 -8.399 5.485 -28.811 1.00 0.00 H new ATOM 0 HB2 TYR B 689 -6.597 6.903 -30.043 1.00 0.00 H new ATOM 0 HB3 TYR B 689 -5.460 5.650 -29.588 1.00 0.00 H new ATOM 0 HD1 TYR B 689 -8.397 6.478 -31.647 1.00 0.00 H new ATOM 0 HD2 TYR B 689 -5.518 3.426 -30.654 1.00 0.00 H new ATOM 0 HE1 TYR B 689 -9.082 5.184 -33.659 1.00 0.00 H new ATOM 0 HE2 TYR B 689 -6.185 2.139 -32.674 1.00 0.00 H new ATOM 0 HH TYR B 689 -7.518 2.023 -34.444 1.00 0.00 H new ATOM 1450 N GLU B 690 -5.984 4.167 -27.016 1.00 0.00 N ATOM 1451 CA GLU B 690 -5.602 3.021 -26.170 1.00 0.00 C ATOM 1452 C GLU B 690 -6.775 2.547 -25.285 1.00 0.00 C ATOM 1453 O GLU B 690 -6.748 1.462 -24.703 1.00 0.00 O ATOM 1454 CB GLU B 690 -4.406 3.459 -25.300 1.00 0.00 C ATOM 1455 CG GLU B 690 -3.276 2.424 -25.163 1.00 0.00 C ATOM 1456 CD GLU B 690 -1.916 3.124 -24.947 1.00 0.00 C ATOM 1457 OE1 GLU B 690 -1.724 3.836 -23.933 1.00 0.00 O ATOM 1458 OE2 GLU B 690 -1.023 2.996 -25.819 1.00 0.00 O ATOM 0 H GLU B 690 -5.425 4.996 -26.815 1.00 0.00 H new ATOM 0 HA GLU B 690 -5.329 2.176 -26.802 1.00 0.00 H new ATOM 0 HB2 GLU B 690 -3.989 4.374 -25.720 1.00 0.00 H new ATOM 0 HB3 GLU B 690 -4.774 3.704 -24.304 1.00 0.00 H new ATOM 0 HG2 GLU B 690 -3.485 1.759 -24.325 1.00 0.00 H new ATOM 0 HG3 GLU B 690 -3.233 1.804 -26.059 1.00 0.00 H new ATOM 1465 N LEU B 691 -7.801 3.391 -25.184 1.00 0.00 N ATOM 1466 CA LEU B 691 -8.937 3.317 -24.284 1.00 0.00 C ATOM 1467 C LEU B 691 -10.085 2.481 -24.882 1.00 0.00 C ATOM 1468 O LEU B 691 -10.226 2.448 -26.105 1.00 0.00 O ATOM 1469 CB LEU B 691 -9.373 4.791 -24.096 1.00 0.00 C ATOM 1470 CG LEU B 691 -9.796 5.230 -22.701 1.00 0.00 C ATOM 1471 CD1 LEU B 691 -8.675 4.965 -21.690 1.00 0.00 C ATOM 1472 CD2 LEU B 691 -10.147 6.713 -22.707 1.00 0.00 C ATOM 0 H LEU B 691 -7.857 4.213 -25.785 1.00 0.00 H new ATOM 0 HA LEU B 691 -8.679 2.829 -23.344 1.00 0.00 H new ATOM 0 HB2 LEU B 691 -8.547 5.428 -24.412 1.00 0.00 H new ATOM 0 HB3 LEU B 691 -10.203 4.985 -24.775 1.00 0.00 H new ATOM 0 HG LEU B 691 -10.673 4.654 -22.407 1.00 0.00 H new ATOM 0 HD11 LEU B 691 -8.996 5.285 -20.699 1.00 0.00 H new ATOM 0 HD12 LEU B 691 -8.447 3.899 -21.671 1.00 0.00 H new ATOM 0 HD13 LEU B 691 -7.784 5.522 -21.980 1.00 0.00 H new ATOM 0 HD21 LEU B 691 -10.449 7.020 -21.705 1.00 0.00 H new ATOM 0 HD22 LEU B 691 -9.277 7.292 -23.017 1.00 0.00 H new ATOM 0 HD23 LEU B 691 -10.967 6.890 -23.403 1.00 0.00 H new ATOM 1484 N PRO B 692 -10.979 1.888 -24.062 1.00 0.00 N ATOM 1485 CA PRO B 692 -12.216 1.256 -24.538 1.00 0.00 C ATOM 1486 C PRO B 692 -13.134 2.294 -25.182 1.00 0.00 C ATOM 1487 O PRO B 692 -13.114 3.456 -24.780 1.00 0.00 O ATOM 1488 CB PRO B 692 -12.871 0.664 -23.280 1.00 0.00 C ATOM 1489 CG PRO B 692 -12.344 1.578 -22.174 1.00 0.00 C ATOM 1490 CD PRO B 692 -10.903 1.782 -22.617 1.00 0.00 C ATOM 0 HA PRO B 692 -12.022 0.496 -25.295 1.00 0.00 H new ATOM 0 HB2 PRO B 692 -13.959 0.685 -23.340 1.00 0.00 H new ATOM 0 HB3 PRO B 692 -12.581 -0.375 -23.121 1.00 0.00 H new ATOM 0 HG2 PRO B 692 -12.894 2.517 -22.120 1.00 0.00 H new ATOM 0 HG3 PRO B 692 -12.410 1.113 -21.190 1.00 0.00 H new ATOM 0 HD2 PRO B 692 -10.475 2.682 -22.175 1.00 0.00 H new ATOM 0 HD3 PRO B 692 -10.272 0.947 -22.313 1.00 0.00 H new ATOM 1498 N GLU B 693 -13.978 1.899 -26.135 1.00 0.00 N ATOM 1499 CA GLU B 693 -14.864 2.850 -26.811 1.00 0.00 C ATOM 1500 C GLU B 693 -15.958 3.331 -25.863 1.00 0.00 C ATOM 1501 O GLU B 693 -16.266 4.517 -25.843 1.00 0.00 O ATOM 1502 CB GLU B 693 -15.463 2.215 -28.077 1.00 0.00 C ATOM 1503 CG GLU B 693 -16.186 3.280 -28.923 1.00 0.00 C ATOM 1504 CD GLU B 693 -16.939 2.730 -30.146 1.00 0.00 C ATOM 1505 OE1 GLU B 693 -16.487 1.754 -30.790 1.00 0.00 O ATOM 1506 OE2 GLU B 693 -17.992 3.326 -30.490 1.00 0.00 O ATOM 0 H GLU B 693 -14.068 0.935 -26.455 1.00 0.00 H new ATOM 0 HA GLU B 693 -14.280 3.719 -27.113 1.00 0.00 H new ATOM 0 HB2 GLU B 693 -14.673 1.749 -28.666 1.00 0.00 H new ATOM 0 HB3 GLU B 693 -16.162 1.426 -27.800 1.00 0.00 H new ATOM 0 HG2 GLU B 693 -16.894 3.810 -28.286 1.00 0.00 H new ATOM 0 HG3 GLU B 693 -15.454 4.012 -29.264 1.00 0.00 H new ATOM 1513 N ALA B 694 -16.540 2.445 -25.052 1.00 0.00 N ATOM 1514 CA ALA B 694 -17.711 2.799 -24.250 1.00 0.00 C ATOM 1515 C ALA B 694 -17.379 3.860 -23.199 1.00 0.00 C ATOM 1516 O ALA B 694 -18.154 4.797 -22.990 1.00 0.00 O ATOM 1517 CB ALA B 694 -18.286 1.537 -23.605 1.00 0.00 C ATOM 0 H ALA B 694 -16.221 1.483 -24.934 1.00 0.00 H new ATOM 0 HA ALA B 694 -18.463 3.237 -24.907 1.00 0.00 H new ATOM 0 HB1 ALA B 694 -19.159 1.799 -23.007 1.00 0.00 H new ATOM 0 HB2 ALA B 694 -18.578 0.831 -24.383 1.00 0.00 H new ATOM 0 HB3 ALA B 694 -17.532 1.080 -22.965 1.00 0.00 H new ATOM 1523 N VAL B 695 -16.198 3.774 -22.572 1.00 0.00 N ATOM 1524 CA VAL B 695 -15.808 4.804 -21.609 1.00 0.00 C ATOM 1525 C VAL B 695 -15.449 6.083 -22.367 1.00 0.00 C ATOM 1526 O VAL B 695 -15.814 7.157 -21.903 1.00 0.00 O ATOM 1527 CB VAL B 695 -14.722 4.329 -20.616 1.00 0.00 C ATOM 1528 CG1 VAL B 695 -14.721 5.252 -19.384 1.00 0.00 C ATOM 1529 CG2 VAL B 695 -14.950 2.898 -20.103 1.00 0.00 C ATOM 0 H VAL B 695 -15.518 3.026 -22.709 1.00 0.00 H new ATOM 0 HA VAL B 695 -16.656 5.025 -20.962 1.00 0.00 H new ATOM 0 HB VAL B 695 -13.779 4.356 -21.162 1.00 0.00 H new ATOM 0 HG11 VAL B 695 -13.957 4.920 -18.681 1.00 0.00 H new ATOM 0 HG12 VAL B 695 -14.508 6.275 -19.696 1.00 0.00 H new ATOM 0 HG13 VAL B 695 -15.698 5.216 -18.901 1.00 0.00 H new ATOM 0 HG21 VAL B 695 -14.152 2.628 -19.411 1.00 0.00 H new ATOM 0 HG22 VAL B 695 -15.910 2.844 -19.589 1.00 0.00 H new ATOM 0 HG23 VAL B 695 -14.950 2.205 -20.945 1.00 0.00 H new ATOM 1539 N GLN B 696 -14.840 6.018 -23.565 1.00 0.00 N ATOM 1540 CA GLN B 696 -14.655 7.229 -24.374 1.00 0.00 C ATOM 1541 C GLN B 696 -16.005 7.895 -24.640 1.00 0.00 C ATOM 1542 O GLN B 696 -16.117 9.107 -24.522 1.00 0.00 O ATOM 1543 CB GLN B 696 -13.987 6.941 -25.731 1.00 0.00 C ATOM 1544 CG GLN B 696 -12.526 6.495 -25.691 1.00 0.00 C ATOM 1545 CD GLN B 696 -12.122 5.993 -27.085 1.00 0.00 C ATOM 1546 OE1 GLN B 696 -12.152 6.729 -28.070 1.00 0.00 O ATOM 1547 NE2 GLN B 696 -11.802 4.713 -27.223 1.00 0.00 N ATOM 0 H GLN B 696 -14.477 5.161 -23.983 1.00 0.00 H new ATOM 0 HA GLN B 696 -14.000 7.885 -23.800 1.00 0.00 H new ATOM 0 HB2 GLN B 696 -14.565 6.169 -26.239 1.00 0.00 H new ATOM 0 HB3 GLN B 696 -14.052 7.842 -26.341 1.00 0.00 H new ATOM 0 HG2 GLN B 696 -11.887 7.324 -25.389 1.00 0.00 H new ATOM 0 HG3 GLN B 696 -12.393 5.705 -24.952 1.00 0.00 H new ATOM 0 HE21 GLN B 696 -11.777 4.103 -26.406 1.00 0.00 H new ATOM 0 HE22 GLN B 696 -11.581 4.339 -28.146 1.00 0.00 H new ATOM 1556 N LYS B 697 -17.029 7.101 -24.962 1.00 0.00 N ATOM 1557 CA LYS B 697 -18.399 7.562 -25.206 1.00 0.00 C ATOM 1558 C LYS B 697 -18.893 8.406 -24.026 1.00 0.00 C ATOM 1559 O LYS B 697 -19.409 9.502 -24.245 1.00 0.00 O ATOM 1560 CB LYS B 697 -19.317 6.339 -25.437 1.00 0.00 C ATOM 1561 CG LYS B 697 -20.370 6.540 -26.538 1.00 0.00 C ATOM 1562 CD LYS B 697 -19.998 5.860 -27.868 1.00 0.00 C ATOM 1563 CE LYS B 697 -18.756 6.475 -28.540 1.00 0.00 C ATOM 1564 NZ LYS B 697 -18.595 6.004 -29.948 1.00 0.00 N ATOM 0 H LYS B 697 -16.926 6.091 -25.063 1.00 0.00 H new ATOM 0 HA LYS B 697 -18.420 8.190 -26.097 1.00 0.00 H new ATOM 0 HB2 LYS B 697 -18.699 5.479 -25.694 1.00 0.00 H new ATOM 0 HB3 LYS B 697 -19.825 6.099 -24.503 1.00 0.00 H new ATOM 0 HG2 LYS B 697 -21.326 6.148 -26.192 1.00 0.00 H new ATOM 0 HG3 LYS B 697 -20.507 7.608 -26.710 1.00 0.00 H new ATOM 0 HD2 LYS B 697 -19.818 4.800 -27.688 1.00 0.00 H new ATOM 0 HD3 LYS B 697 -20.844 5.928 -28.552 1.00 0.00 H new ATOM 0 HE2 LYS B 697 -18.837 7.562 -28.528 1.00 0.00 H new ATOM 0 HE3 LYS B 697 -17.866 6.215 -27.966 1.00 0.00 H new ATOM 0 HZ1 LYS B 697 -17.879 6.585 -30.429 1.00 0.00 H new ATOM 0 HZ2 LYS B 697 -18.291 5.009 -29.949 1.00 0.00 H new ATOM 0 HZ3 LYS B 697 -19.503 6.089 -30.448 1.00 0.00 H new ATOM 1578 N GLU B 698 -18.688 7.915 -22.795 1.00 0.00 N ATOM 1579 CA GLU B 698 -19.082 8.650 -21.586 1.00 0.00 C ATOM 1580 C GLU B 698 -18.373 9.988 -21.591 1.00 0.00 C ATOM 1581 O GLU B 698 -18.993 11.044 -21.490 1.00 0.00 O ATOM 1582 CB GLU B 698 -18.694 7.943 -20.266 1.00 0.00 C ATOM 1583 CG GLU B 698 -19.643 8.424 -19.157 1.00 0.00 C ATOM 1584 CD GLU B 698 -19.327 7.761 -17.812 1.00 0.00 C ATOM 1585 OE1 GLU B 698 -18.166 7.850 -17.344 1.00 0.00 O ATOM 1586 OE2 GLU B 698 -20.245 7.155 -17.205 1.00 0.00 O ATOM 0 H GLU B 698 -18.251 7.012 -22.611 1.00 0.00 H new ATOM 0 HA GLU B 698 -20.169 8.731 -21.616 1.00 0.00 H new ATOM 0 HB2 GLU B 698 -18.764 6.861 -20.381 1.00 0.00 H new ATOM 0 HB3 GLU B 698 -17.660 8.170 -20.005 1.00 0.00 H new ATOM 0 HG2 GLU B 698 -19.565 9.507 -19.056 1.00 0.00 H new ATOM 0 HG3 GLU B 698 -20.673 8.203 -19.438 1.00 0.00 H new ATOM 1593 N LEU B 699 -17.053 9.890 -21.722 1.00 0.00 N ATOM 1594 CA LEU B 699 -16.104 10.961 -21.557 1.00 0.00 C ATOM 1595 C LEU B 699 -16.459 12.074 -22.514 1.00 0.00 C ATOM 1596 O LEU B 699 -16.862 13.123 -22.054 1.00 0.00 O ATOM 1597 CB LEU B 699 -14.709 10.378 -21.793 1.00 0.00 C ATOM 1598 CG LEU B 699 -13.991 9.848 -20.537 1.00 0.00 C ATOM 1599 CD1 LEU B 699 -14.865 9.181 -19.469 1.00 0.00 C ATOM 1600 CD2 LEU B 699 -12.920 8.855 -21.015 1.00 0.00 C ATOM 0 H LEU B 699 -16.602 9.006 -21.960 1.00 0.00 H new ATOM 0 HA LEU B 699 -16.124 11.391 -20.556 1.00 0.00 H new ATOM 0 HB2 LEU B 699 -14.791 9.564 -22.514 1.00 0.00 H new ATOM 0 HB3 LEU B 699 -14.085 11.147 -22.250 1.00 0.00 H new ATOM 0 HG LEU B 699 -13.588 10.723 -20.027 1.00 0.00 H new ATOM 0 HD11 LEU B 699 -14.239 8.853 -18.639 1.00 0.00 H new ATOM 0 HD12 LEU B 699 -15.604 9.895 -19.106 1.00 0.00 H new ATOM 0 HD13 LEU B 699 -15.374 8.320 -19.902 1.00 0.00 H new ATOM 0 HD21 LEU B 699 -12.385 8.454 -20.154 1.00 0.00 H new ATOM 0 HD22 LEU B 699 -13.397 8.039 -21.558 1.00 0.00 H new ATOM 0 HD23 LEU B 699 -12.217 9.367 -21.672 1.00 0.00 H new ATOM 1612 N LEU B 700 -16.402 11.846 -23.821 1.00 0.00 N ATOM 1613 CA LEU B 700 -16.648 12.884 -24.817 1.00 0.00 C ATOM 1614 C LEU B 700 -18.033 13.499 -24.661 1.00 0.00 C ATOM 1615 O LEU B 700 -18.157 14.720 -24.745 1.00 0.00 O ATOM 1616 CB LEU B 700 -16.388 12.374 -26.249 1.00 0.00 C ATOM 1617 CG LEU B 700 -17.267 11.188 -26.685 1.00 0.00 C ATOM 1618 CD1 LEU B 700 -18.460 11.607 -27.551 1.00 0.00 C ATOM 1619 CD2 LEU B 700 -16.441 10.150 -27.449 1.00 0.00 C ATOM 0 H LEU B 700 -16.183 10.934 -24.222 1.00 0.00 H new ATOM 0 HA LEU B 700 -15.931 13.685 -24.637 1.00 0.00 H new ATOM 0 HB2 LEU B 700 -16.543 13.198 -26.946 1.00 0.00 H new ATOM 0 HB3 LEU B 700 -15.341 12.081 -26.330 1.00 0.00 H new ATOM 0 HG LEU B 700 -17.659 10.756 -25.764 1.00 0.00 H new ATOM 0 HD11 LEU B 700 -19.039 10.725 -27.824 1.00 0.00 H new ATOM 0 HD12 LEU B 700 -19.092 12.296 -26.991 1.00 0.00 H new ATOM 0 HD13 LEU B 700 -18.099 12.098 -28.454 1.00 0.00 H new ATOM 0 HD21 LEU B 700 -17.083 9.321 -27.747 1.00 0.00 H new ATOM 0 HD22 LEU B 700 -16.008 10.611 -28.337 1.00 0.00 H new ATOM 0 HD23 LEU B 700 -15.642 9.777 -26.808 1.00 0.00 H new ATOM 1631 N ALA B 701 -19.068 12.691 -24.410 1.00 0.00 N ATOM 1632 CA ALA B 701 -20.422 13.215 -24.341 1.00 0.00 C ATOM 1633 C ALA B 701 -20.582 14.103 -23.111 1.00 0.00 C ATOM 1634 O ALA B 701 -21.079 15.221 -23.228 1.00 0.00 O ATOM 1635 CB ALA B 701 -21.414 12.052 -24.334 1.00 0.00 C ATOM 0 H ALA B 701 -18.990 11.686 -24.254 1.00 0.00 H new ATOM 0 HA ALA B 701 -20.626 13.833 -25.216 1.00 0.00 H new ATOM 0 HB1 ALA B 701 -22.431 12.441 -24.282 1.00 0.00 H new ATOM 0 HB2 ALA B 701 -21.295 11.467 -25.246 1.00 0.00 H new ATOM 0 HB3 ALA B 701 -21.224 11.417 -23.469 1.00 0.00 H new ATOM 1641 N GLU B 702 -20.116 13.652 -21.951 1.00 0.00 N ATOM 1642 CA GLU B 702 -20.126 14.447 -20.737 1.00 0.00 C ATOM 1643 C GLU B 702 -19.248 15.677 -20.895 1.00 0.00 C ATOM 1644 O GLU B 702 -19.662 16.761 -20.496 1.00 0.00 O ATOM 1645 CB GLU B 702 -19.615 13.619 -19.561 1.00 0.00 C ATOM 1646 CG GLU B 702 -20.584 12.565 -19.044 1.00 0.00 C ATOM 1647 CD GLU B 702 -21.810 13.196 -18.361 1.00 0.00 C ATOM 1648 OE1 GLU B 702 -22.818 13.462 -19.055 1.00 0.00 O ATOM 1649 OE2 GLU B 702 -21.766 13.429 -17.128 1.00 0.00 O ATOM 0 H GLU B 702 -19.720 12.720 -21.830 1.00 0.00 H new ATOM 0 HA GLU B 702 -21.153 14.760 -20.547 1.00 0.00 H new ATOM 0 HB2 GLU B 702 -18.690 13.125 -19.859 1.00 0.00 H new ATOM 0 HB3 GLU B 702 -19.366 14.294 -18.742 1.00 0.00 H new ATOM 0 HG2 GLU B 702 -20.913 11.938 -19.872 1.00 0.00 H new ATOM 0 HG3 GLU B 702 -20.069 11.915 -18.337 1.00 0.00 H new ATOM 1656 N TRP B 703 -18.059 15.512 -21.487 1.00 0.00 N ATOM 1657 CA TRP B 703 -17.058 16.559 -21.561 1.00 0.00 C ATOM 1658 C TRP B 703 -17.621 17.771 -22.321 1.00 0.00 C ATOM 1659 O TRP B 703 -17.327 18.909 -21.948 1.00 0.00 O ATOM 1660 CB TRP B 703 -15.759 16.054 -22.230 1.00 0.00 C ATOM 1661 CG TRP B 703 -14.844 15.048 -21.554 1.00 0.00 C ATOM 1662 CD1 TRP B 703 -14.853 14.647 -20.257 1.00 0.00 C ATOM 1663 CD2 TRP B 703 -13.797 14.231 -22.176 1.00 0.00 C ATOM 1664 NE1 TRP B 703 -13.908 13.658 -20.052 1.00 0.00 N ATOM 1665 CE2 TRP B 703 -13.170 13.421 -21.182 1.00 0.00 C ATOM 1666 CE3 TRP B 703 -13.340 14.052 -23.499 1.00 0.00 C ATOM 1667 CZ2 TRP B 703 -12.118 12.532 -21.457 1.00 0.00 C ATOM 1668 CZ3 TRP B 703 -12.348 13.100 -23.810 1.00 0.00 C ATOM 1669 CH2 TRP B 703 -11.749 12.337 -22.794 1.00 0.00 C ATOM 0 H TRP B 703 -17.772 14.638 -21.928 1.00 0.00 H new ATOM 0 HA TRP B 703 -16.807 16.861 -20.544 1.00 0.00 H new ATOM 0 HB2 TRP B 703 -16.047 15.623 -23.189 1.00 0.00 H new ATOM 0 HB3 TRP B 703 -15.154 16.934 -22.445 1.00 0.00 H new ATOM 0 HD1 TRP B 703 -15.506 15.044 -19.493 1.00 0.00 H new ATOM 0 HE1 TRP B 703 -13.777 13.166 -19.168 1.00 0.00 H new ATOM 0 HE3 TRP B 703 -13.759 14.657 -24.290 1.00 0.00 H new ATOM 0 HZ2 TRP B 703 -11.608 12.013 -20.659 1.00 0.00 H new ATOM 0 HZ3 TRP B 703 -12.046 12.956 -24.837 1.00 0.00 H new ATOM 0 HH2 TRP B 703 -11.002 11.598 -23.044 1.00 0.00 H new