USER MOD reduce.3.24.130724 H: found=0, std=0, add=1103, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1097 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 127 GLN : amide:sc= -3.96! C(o=-14!,f=-13!) USER MOD Set 1.2: A 129 HIS : no HE2:sc= -10.4! C(o=-14!,f=-23!) USER MOD Set 2.1: A 103 ASN : amide:sc= -2.93 K(o=-2.9,f=-6.6!) USER MOD Set 2.2: A 110 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 28 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.1: A 29 HIS : no HD1:sc= -3.89! K(o=-7.2!,f=-0.55) USER MOD Set 4.2: A 102 TYR OH : rot 30:sc= -3.33! USER MOD Set 5.1: A 19 ASN : amide:sc= -3.03 K(o=-21,f=-26!) USER MOD Set 5.2: A 55 HIS : no HD1:sc= -11.3! C(o=-21!,f=-30!) USER MOD Set 5.3: A 119 MET CE :methyl 134:sc= -6.62! (180deg=-4.72!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 SER OG : rot 180:sc= -0.314 USER MOD Single : A 20 LYS NZ :NH3+ -164:sc= -0.133 (180deg=-0.555) USER MOD Single : A 24 HIS : no HE2:sc= -2.82! C(o=-2.8!,f=-4.3!) USER MOD Single : A 25 ASN : amide:sc= -0.24 K(o=-0.24,f=-2.6!) USER MOD Single : A 30 CYS SG : rot 180:sc= 0 USER MOD Single : A 31 CYS SG : rot 131:sc= -10.2! USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 ASN : amide:sc= -0.135 X(o=-0.13,f=-0.4) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 42 ASN : amide:sc= 1.01 K(o=1,f=-0.39) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 SER OG : rot -14:sc= -0.111 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc=-0.00834 X(o=-0.0083,f=-0.028) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 55:sc= 0.79 USER MOD Single : A 65 CYS SG : rot -13:sc= 0.48 USER MOD Single : A 66 GLN : amide:sc= -0.2 K(o=-0.2,f=-0.79) USER MOD Single : A 71 TYR OH : rot -175:sc= -1.3 USER MOD Single : A 72 THR OG1 : rot 180:sc= 0.0239 USER MOD Single : A 74 SER OG : rot 78:sc= 0.00226 USER MOD Single : A 77 THR OG1 : rot 151:sc= -0.251 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot -170:sc= 0.156 USER MOD Single : A 95 MET CE :methyl -154:sc= -0.128 (180deg=-1.06) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 GLN : amide:sc= -0.0123 X(o=-0.012,f=-0.028) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 MET CE :methyl -113:sc= -1.02 (180deg=-5.01!) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 48:sc= 0.0763 USER MOD Single : A 125 THR OG1 : rot 42:sc= 0.0772 USER MOD Single : A 132 GLN : amide:sc=-0.00926 X(o=-0.0093,f=-0.068) USER MOD Single : A 133 SER OG : rot 45:sc= 0.676 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 31.475 -28.295 6.153 1.00 0.00 N ATOM 2 CA GLY A 1 30.640 -27.888 5.036 1.00 0.00 C ATOM 3 C GLY A 1 30.931 -26.440 4.634 1.00 0.00 C ATOM 4 O GLY A 1 32.066 -26.100 4.303 1.00 0.00 O ATOM 0 H1 GLY A 1 31.259 -29.280 6.407 1.00 0.00 H new ATOM 0 H2 GLY A 1 32.477 -28.218 5.884 1.00 0.00 H new ATOM 0 H3 GLY A 1 31.288 -27.678 6.969 1.00 0.00 H new ATOM 0 HA2 GLY A 1 30.816 -28.548 4.186 1.00 0.00 H new ATOM 0 HA3 GLY A 1 29.589 -27.990 5.307 1.00 0.00 H new ATOM 8 N SER A 2 29.886 -25.627 4.674 1.00 0.00 N ATOM 9 CA SER A 2 30.015 -24.224 4.318 1.00 0.00 C ATOM 10 C SER A 2 30.337 -24.090 2.828 1.00 0.00 C ATOM 11 O SER A 2 31.443 -24.412 2.397 1.00 0.00 O ATOM 12 CB SER A 2 31.095 -23.540 5.158 1.00 0.00 C ATOM 13 OG SER A 2 30.739 -22.203 5.499 1.00 0.00 O ATOM 0 H SER A 2 28.946 -25.913 4.948 1.00 0.00 H new ATOM 0 HA SER A 2 29.066 -23.730 4.524 1.00 0.00 H new ATOM 0 HB2 SER A 2 31.263 -24.114 6.069 1.00 0.00 H new ATOM 0 HB3 SER A 2 32.035 -23.535 4.606 1.00 0.00 H new ATOM 0 HG SER A 2 31.453 -21.801 6.037 1.00 0.00 H new ATOM 19 N SER A 3 29.350 -23.614 2.083 1.00 0.00 N ATOM 20 CA SER A 3 29.515 -23.434 0.651 1.00 0.00 C ATOM 21 C SER A 3 28.326 -22.657 0.081 1.00 0.00 C ATOM 22 O SER A 3 27.209 -22.768 0.584 1.00 0.00 O ATOM 23 CB SER A 3 29.659 -24.780 -0.061 1.00 0.00 C ATOM 24 OG SER A 3 30.122 -24.629 -1.401 1.00 0.00 O ATOM 0 H SER A 3 28.434 -23.348 2.444 1.00 0.00 H new ATOM 0 HA SER A 3 30.429 -22.865 0.481 1.00 0.00 H new ATOM 0 HB2 SER A 3 30.354 -25.411 0.494 1.00 0.00 H new ATOM 0 HB3 SER A 3 28.697 -25.292 -0.065 1.00 0.00 H new ATOM 0 HG SER A 3 30.202 -25.511 -1.821 1.00 0.00 H new ATOM 30 N GLY A 4 28.607 -21.887 -0.960 1.00 0.00 N ATOM 31 CA GLY A 4 27.575 -21.092 -1.603 1.00 0.00 C ATOM 32 C GLY A 4 28.187 -19.931 -2.389 1.00 0.00 C ATOM 33 O GLY A 4 29.379 -19.651 -2.264 1.00 0.00 O ATOM 0 H GLY A 4 29.535 -21.797 -1.374 1.00 0.00 H new ATOM 0 HA2 GLY A 4 26.991 -21.722 -2.274 1.00 0.00 H new ATOM 0 HA3 GLY A 4 26.888 -20.704 -0.851 1.00 0.00 H new ATOM 37 N SER A 5 27.345 -19.286 -3.183 1.00 0.00 N ATOM 38 CA SER A 5 27.788 -18.162 -3.990 1.00 0.00 C ATOM 39 C SER A 5 26.612 -17.594 -4.787 1.00 0.00 C ATOM 40 O SER A 5 25.589 -18.257 -4.948 1.00 0.00 O ATOM 41 CB SER A 5 28.919 -18.574 -4.934 1.00 0.00 C ATOM 42 OG SER A 5 29.802 -17.491 -5.214 1.00 0.00 O ATOM 0 H SER A 5 26.358 -19.521 -3.285 1.00 0.00 H new ATOM 0 HA SER A 5 28.171 -17.391 -3.321 1.00 0.00 H new ATOM 0 HB2 SER A 5 29.482 -19.395 -4.489 1.00 0.00 H new ATOM 0 HB3 SER A 5 28.495 -18.947 -5.867 1.00 0.00 H new ATOM 0 HG SER A 5 30.511 -17.795 -5.818 1.00 0.00 H new ATOM 48 N SER A 6 26.798 -16.372 -5.264 1.00 0.00 N ATOM 49 CA SER A 6 25.765 -15.707 -6.041 1.00 0.00 C ATOM 50 C SER A 6 26.270 -14.347 -6.527 1.00 0.00 C ATOM 51 O SER A 6 27.307 -13.867 -6.072 1.00 0.00 O ATOM 52 CB SER A 6 24.485 -15.535 -5.221 1.00 0.00 C ATOM 53 OG SER A 6 24.737 -14.928 -3.957 1.00 0.00 O ATOM 0 H SER A 6 27.648 -15.825 -5.128 1.00 0.00 H new ATOM 0 HA SER A 6 25.531 -16.330 -6.904 1.00 0.00 H new ATOM 0 HB2 SER A 6 23.775 -14.925 -5.781 1.00 0.00 H new ATOM 0 HB3 SER A 6 24.019 -16.508 -5.069 1.00 0.00 H new ATOM 0 HG SER A 6 23.894 -14.834 -3.465 1.00 0.00 H new ATOM 59 N GLY A 7 25.514 -13.765 -7.447 1.00 0.00 N ATOM 60 CA GLY A 7 25.872 -12.471 -8.000 1.00 0.00 C ATOM 61 C GLY A 7 24.634 -11.589 -8.178 1.00 0.00 C ATOM 62 O GLY A 7 23.792 -11.860 -9.032 1.00 0.00 O ATOM 0 H GLY A 7 24.655 -14.167 -7.823 1.00 0.00 H new ATOM 0 HA2 GLY A 7 26.585 -11.975 -7.341 1.00 0.00 H new ATOM 0 HA3 GLY A 7 26.367 -12.607 -8.961 1.00 0.00 H new ATOM 66 N PRO A 8 24.561 -10.524 -7.334 1.00 0.00 N ATOM 67 CA PRO A 8 23.440 -9.601 -7.390 1.00 0.00 C ATOM 68 C PRO A 8 23.551 -8.676 -8.604 1.00 0.00 C ATOM 69 O PRO A 8 24.167 -7.615 -8.525 1.00 0.00 O ATOM 70 CB PRO A 8 23.481 -8.853 -6.067 1.00 0.00 C ATOM 71 CG PRO A 8 24.885 -9.052 -5.519 1.00 0.00 C ATOM 72 CD PRO A 8 25.539 -10.172 -6.310 1.00 0.00 C ATOM 0 HA PRO A 8 22.483 -10.108 -7.517 1.00 0.00 H new ATOM 0 HB2 PRO A 8 23.264 -7.794 -6.210 1.00 0.00 H new ATOM 0 HB3 PRO A 8 22.733 -9.241 -5.376 1.00 0.00 H new ATOM 0 HG2 PRO A 8 25.464 -8.133 -5.609 1.00 0.00 H new ATOM 0 HG3 PRO A 8 24.849 -9.304 -4.459 1.00 0.00 H new ATOM 0 HD2 PRO A 8 26.479 -9.845 -6.756 1.00 0.00 H new ATOM 0 HD3 PRO A 8 25.769 -11.025 -5.672 1.00 0.00 H new ATOM 80 N ARG A 9 22.944 -9.113 -9.697 1.00 0.00 N ATOM 81 CA ARG A 9 22.967 -8.338 -10.926 1.00 0.00 C ATOM 82 C ARG A 9 21.567 -8.276 -11.541 1.00 0.00 C ATOM 83 O ARG A 9 20.857 -9.279 -11.577 1.00 0.00 O ATOM 84 CB ARG A 9 23.937 -8.944 -11.942 1.00 0.00 C ATOM 85 CG ARG A 9 25.389 -8.696 -11.530 1.00 0.00 C ATOM 86 CD ARG A 9 26.337 -8.900 -12.714 1.00 0.00 C ATOM 87 NE ARG A 9 27.099 -10.157 -12.541 1.00 0.00 N ATOM 88 CZ ARG A 9 28.129 -10.524 -13.315 1.00 0.00 C ATOM 89 NH1 ARG A 9 28.527 -9.733 -14.320 1.00 0.00 N ATOM 90 NH2 ARG A 9 28.761 -11.683 -13.084 1.00 0.00 N ATOM 0 H ARG A 9 22.433 -9.994 -9.758 1.00 0.00 H new ATOM 0 HA ARG A 9 23.303 -7.331 -10.677 1.00 0.00 H new ATOM 0 HB2 ARG A 9 23.757 -10.016 -12.027 1.00 0.00 H new ATOM 0 HB3 ARG A 9 23.756 -8.511 -12.926 1.00 0.00 H new ATOM 0 HG2 ARG A 9 25.494 -7.681 -11.146 1.00 0.00 H new ATOM 0 HG3 ARG A 9 25.662 -9.373 -10.720 1.00 0.00 H new ATOM 0 HD2 ARG A 9 25.769 -8.934 -13.644 1.00 0.00 H new ATOM 0 HD3 ARG A 9 27.023 -8.057 -12.791 1.00 0.00 H new ATOM 0 HE ARG A 9 26.822 -10.783 -11.785 1.00 0.00 H new ATOM 0 HH11 ARG A 9 28.046 -8.851 -14.496 1.00 0.00 H new ATOM 0 HH12 ARG A 9 29.311 -10.013 -14.909 1.00 0.00 H new ATOM 0 HH21 ARG A 9 28.458 -12.286 -12.319 1.00 0.00 H new ATOM 0 HH22 ARG A 9 29.545 -11.963 -13.673 1.00 0.00 H new ATOM 104 N LEU A 10 21.214 -7.088 -12.009 1.00 0.00 N ATOM 105 CA LEU A 10 19.912 -6.882 -12.621 1.00 0.00 C ATOM 106 C LEU A 10 20.100 -6.422 -14.068 1.00 0.00 C ATOM 107 O LEU A 10 20.794 -5.440 -14.325 1.00 0.00 O ATOM 108 CB LEU A 10 19.068 -5.925 -11.776 1.00 0.00 C ATOM 109 CG LEU A 10 18.742 -6.394 -10.356 1.00 0.00 C ATOM 110 CD1 LEU A 10 19.912 -6.124 -9.408 1.00 0.00 C ATOM 111 CD2 LEU A 10 17.441 -5.763 -9.856 1.00 0.00 C ATOM 0 H LEU A 10 21.807 -6.258 -11.977 1.00 0.00 H new ATOM 0 HA LEU A 10 19.354 -7.818 -12.654 1.00 0.00 H new ATOM 0 HB2 LEU A 10 19.591 -4.971 -11.711 1.00 0.00 H new ATOM 0 HB3 LEU A 10 18.131 -5.739 -12.300 1.00 0.00 H new ATOM 0 HG LEU A 10 18.588 -7.473 -10.379 1.00 0.00 H new ATOM 0 HD11 LEU A 10 19.655 -6.466 -8.406 1.00 0.00 H new ATOM 0 HD12 LEU A 10 20.795 -6.658 -9.758 1.00 0.00 H new ATOM 0 HD13 LEU A 10 20.121 -5.055 -9.383 1.00 0.00 H new ATOM 0 HD21 LEU A 10 17.232 -6.113 -8.845 1.00 0.00 H new ATOM 0 HD22 LEU A 10 17.541 -4.678 -9.851 1.00 0.00 H new ATOM 0 HD23 LEU A 10 16.621 -6.049 -10.515 1.00 0.00 H new ATOM 123 N TYR A 11 19.468 -7.153 -14.974 1.00 0.00 N ATOM 124 CA TYR A 11 19.557 -6.833 -16.389 1.00 0.00 C ATOM 125 C TYR A 11 18.415 -7.484 -17.171 1.00 0.00 C ATOM 126 O TYR A 11 18.636 -8.426 -17.930 1.00 0.00 O ATOM 127 CB TYR A 11 20.887 -7.416 -16.871 1.00 0.00 C ATOM 128 CG TYR A 11 21.237 -8.768 -16.245 1.00 0.00 C ATOM 129 CD1 TYR A 11 20.231 -9.635 -15.869 1.00 0.00 C ATOM 130 CD2 TYR A 11 22.557 -9.119 -16.056 1.00 0.00 C ATOM 131 CE1 TYR A 11 20.560 -10.907 -15.280 1.00 0.00 C ATOM 132 CE2 TYR A 11 22.887 -10.392 -15.467 1.00 0.00 C ATOM 133 CZ TYR A 11 21.872 -11.223 -15.108 1.00 0.00 C ATOM 134 OH TYR A 11 22.183 -12.424 -14.552 1.00 0.00 O ATOM 0 H TYR A 11 18.892 -7.966 -14.756 1.00 0.00 H new ATOM 0 HA TYR A 11 19.493 -5.756 -16.543 1.00 0.00 H new ATOM 0 HB2 TYR A 11 20.852 -7.527 -17.955 1.00 0.00 H new ATOM 0 HB3 TYR A 11 21.685 -6.707 -16.649 1.00 0.00 H new ATOM 0 HD1 TYR A 11 19.197 -9.359 -16.017 1.00 0.00 H new ATOM 0 HD2 TYR A 11 23.344 -8.440 -16.349 1.00 0.00 H new ATOM 0 HE1 TYR A 11 19.783 -11.595 -14.981 1.00 0.00 H new ATOM 0 HE2 TYR A 11 23.917 -10.680 -15.314 1.00 0.00 H new ATOM 0 HH TYR A 11 23.157 -12.514 -14.492 1.00 0.00 H new ATOM 144 N LYS A 12 17.218 -6.955 -16.960 1.00 0.00 N ATOM 145 CA LYS A 12 16.041 -7.472 -17.636 1.00 0.00 C ATOM 146 C LYS A 12 15.063 -6.325 -17.898 1.00 0.00 C ATOM 147 O LYS A 12 14.939 -5.412 -17.083 1.00 0.00 O ATOM 148 CB LYS A 12 15.433 -8.630 -16.842 1.00 0.00 C ATOM 149 CG LYS A 12 16.017 -9.970 -17.292 1.00 0.00 C ATOM 150 CD LYS A 12 15.553 -11.106 -16.377 1.00 0.00 C ATOM 151 CE LYS A 12 16.202 -12.432 -16.777 1.00 0.00 C ATOM 152 NZ LYS A 12 16.873 -13.053 -15.613 1.00 0.00 N ATOM 0 H LYS A 12 17.039 -6.173 -16.330 1.00 0.00 H new ATOM 0 HA LYS A 12 16.311 -7.888 -18.606 1.00 0.00 H new ATOM 0 HB2 LYS A 12 15.623 -8.485 -15.778 1.00 0.00 H new ATOM 0 HB3 LYS A 12 14.351 -8.638 -16.975 1.00 0.00 H new ATOM 0 HG2 LYS A 12 15.712 -10.177 -18.318 1.00 0.00 H new ATOM 0 HG3 LYS A 12 17.106 -9.916 -17.287 1.00 0.00 H new ATOM 0 HD2 LYS A 12 15.805 -10.871 -15.343 1.00 0.00 H new ATOM 0 HD3 LYS A 12 14.468 -11.198 -16.427 1.00 0.00 H new ATOM 0 HE2 LYS A 12 15.445 -13.110 -17.172 1.00 0.00 H new ATOM 0 HE3 LYS A 12 16.926 -12.263 -17.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 17.308 -13.952 -15.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 17.609 -12.412 -15.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 16.174 -13.232 -14.864 1.00 0.00 H new ATOM 166 N GLU A 13 14.394 -6.409 -19.039 1.00 0.00 N ATOM 167 CA GLU A 13 13.431 -5.390 -19.418 1.00 0.00 C ATOM 168 C GLU A 13 12.529 -5.044 -18.232 1.00 0.00 C ATOM 169 O GLU A 13 12.318 -5.871 -17.346 1.00 0.00 O ATOM 170 CB GLU A 13 12.604 -5.839 -20.624 1.00 0.00 C ATOM 171 CG GLU A 13 12.985 -5.047 -21.877 1.00 0.00 C ATOM 172 CD GLU A 13 11.888 -5.140 -22.940 1.00 0.00 C ATOM 173 OE1 GLU A 13 10.722 -4.879 -22.575 1.00 0.00 O ATOM 174 OE2 GLU A 13 12.242 -5.471 -24.092 1.00 0.00 O ATOM 0 H GLU A 13 14.500 -7.167 -19.713 1.00 0.00 H new ATOM 0 HA GLU A 13 13.977 -4.492 -19.708 1.00 0.00 H new ATOM 0 HB2 GLU A 13 12.761 -6.903 -20.801 1.00 0.00 H new ATOM 0 HB3 GLU A 13 11.543 -5.704 -20.413 1.00 0.00 H new ATOM 0 HG2 GLU A 13 13.154 -4.003 -21.614 1.00 0.00 H new ATOM 0 HG3 GLU A 13 13.922 -5.429 -22.282 1.00 0.00 H new ATOM 181 N PRO A 14 12.006 -3.789 -18.254 1.00 0.00 N ATOM 182 CA PRO A 14 11.132 -3.323 -17.191 1.00 0.00 C ATOM 183 C PRO A 14 9.738 -3.942 -17.318 1.00 0.00 C ATOM 184 O PRO A 14 9.432 -4.593 -18.316 1.00 0.00 O ATOM 185 CB PRO A 14 11.123 -1.809 -17.323 1.00 0.00 C ATOM 186 CG PRO A 14 11.615 -1.510 -18.730 1.00 0.00 C ATOM 187 CD PRO A 14 12.234 -2.782 -19.287 1.00 0.00 C ATOM 0 HA PRO A 14 11.478 -3.621 -16.201 1.00 0.00 H new ATOM 0 HB2 PRO A 14 10.121 -1.409 -17.167 1.00 0.00 H new ATOM 0 HB3 PRO A 14 11.770 -1.348 -16.577 1.00 0.00 H new ATOM 0 HG2 PRO A 14 10.790 -1.179 -19.361 1.00 0.00 H new ATOM 0 HG3 PRO A 14 12.348 -0.704 -18.715 1.00 0.00 H new ATOM 0 HD2 PRO A 14 11.768 -3.069 -20.230 1.00 0.00 H new ATOM 0 HD3 PRO A 14 13.298 -2.651 -19.484 1.00 0.00 H new ATOM 195 N SER A 15 8.930 -3.718 -16.292 1.00 0.00 N ATOM 196 CA SER A 15 7.577 -4.246 -16.276 1.00 0.00 C ATOM 197 C SER A 15 6.581 -3.122 -15.982 1.00 0.00 C ATOM 198 O SER A 15 6.408 -2.726 -14.830 1.00 0.00 O ATOM 199 CB SER A 15 7.434 -5.365 -15.243 1.00 0.00 C ATOM 200 OG SER A 15 6.761 -6.502 -15.777 1.00 0.00 O ATOM 0 H SER A 15 9.187 -3.178 -15.466 1.00 0.00 H new ATOM 0 HA SER A 15 7.362 -4.666 -17.258 1.00 0.00 H new ATOM 0 HB2 SER A 15 8.422 -5.661 -14.890 1.00 0.00 H new ATOM 0 HB3 SER A 15 6.885 -4.992 -14.378 1.00 0.00 H new ATOM 0 HG SER A 15 6.691 -7.195 -15.087 1.00 0.00 H new ATOM 206 N ALA A 16 5.951 -2.640 -17.043 1.00 0.00 N ATOM 207 CA ALA A 16 4.976 -1.570 -16.914 1.00 0.00 C ATOM 208 C ALA A 16 5.637 -0.364 -16.244 1.00 0.00 C ATOM 209 O ALA A 16 6.822 -0.401 -15.919 1.00 0.00 O ATOM 210 CB ALA A 16 3.761 -2.077 -16.135 1.00 0.00 C ATOM 0 H ALA A 16 6.097 -2.971 -17.997 1.00 0.00 H new ATOM 0 HA ALA A 16 4.623 -1.251 -17.895 1.00 0.00 H new ATOM 0 HB1 ALA A 16 3.030 -1.274 -16.038 1.00 0.00 H new ATOM 0 HB2 ALA A 16 3.311 -2.915 -16.667 1.00 0.00 H new ATOM 0 HB3 ALA A 16 4.075 -2.403 -15.143 1.00 0.00 H new ATOM 216 N LYS A 17 4.840 0.679 -16.057 1.00 0.00 N ATOM 217 CA LYS A 17 5.332 1.894 -15.431 1.00 0.00 C ATOM 218 C LYS A 17 4.214 2.522 -14.597 1.00 0.00 C ATOM 219 O LYS A 17 3.055 2.528 -15.009 1.00 0.00 O ATOM 220 CB LYS A 17 5.919 2.838 -16.483 1.00 0.00 C ATOM 221 CG LYS A 17 7.021 3.713 -15.881 1.00 0.00 C ATOM 222 CD LYS A 17 6.539 5.153 -15.698 1.00 0.00 C ATOM 223 CE LYS A 17 7.280 6.103 -16.642 1.00 0.00 C ATOM 224 NZ LYS A 17 6.522 7.363 -16.808 1.00 0.00 N ATOM 0 H LYS A 17 3.857 0.707 -16.328 1.00 0.00 H new ATOM 0 HA LYS A 17 6.150 1.666 -14.748 1.00 0.00 H new ATOM 0 HB2 LYS A 17 6.323 2.258 -17.313 1.00 0.00 H new ATOM 0 HB3 LYS A 17 5.130 3.470 -16.891 1.00 0.00 H new ATOM 0 HG2 LYS A 17 7.330 3.304 -14.919 1.00 0.00 H new ATOM 0 HG3 LYS A 17 7.897 3.699 -16.530 1.00 0.00 H new ATOM 0 HD2 LYS A 17 5.467 5.209 -15.888 1.00 0.00 H new ATOM 0 HD3 LYS A 17 6.696 5.465 -14.665 1.00 0.00 H new ATOM 0 HE2 LYS A 17 8.272 6.318 -16.246 1.00 0.00 H new ATOM 0 HE3 LYS A 17 7.420 5.626 -17.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 7.038 7.997 -17.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 5.584 7.154 -17.206 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 6.410 7.825 -15.883 1.00 0.00 H new ATOM 238 N SER A 18 4.601 3.035 -13.438 1.00 0.00 N ATOM 239 CA SER A 18 3.646 3.664 -12.542 1.00 0.00 C ATOM 240 C SER A 18 2.575 2.653 -12.126 1.00 0.00 C ATOM 241 O SER A 18 1.858 2.121 -12.971 1.00 0.00 O ATOM 242 CB SER A 18 2.998 4.885 -13.196 1.00 0.00 C ATOM 243 OG SER A 18 3.859 5.499 -14.151 1.00 0.00 O ATOM 0 H SER A 18 5.563 3.028 -13.099 1.00 0.00 H new ATOM 0 HA SER A 18 4.181 4.003 -11.655 1.00 0.00 H new ATOM 0 HB2 SER A 18 2.070 4.585 -13.684 1.00 0.00 H new ATOM 0 HB3 SER A 18 2.734 5.611 -12.427 1.00 0.00 H new ATOM 0 HG SER A 18 3.408 6.274 -14.547 1.00 0.00 H new ATOM 249 N ASN A 19 2.502 2.419 -10.824 1.00 0.00 N ATOM 250 CA ASN A 19 1.531 1.482 -10.285 1.00 0.00 C ATOM 251 C ASN A 19 0.490 2.247 -9.466 1.00 0.00 C ATOM 252 O ASN A 19 -0.104 1.696 -8.540 1.00 0.00 O ATOM 253 CB ASN A 19 2.202 0.462 -9.363 1.00 0.00 C ATOM 254 CG ASN A 19 2.685 1.125 -8.072 1.00 0.00 C ATOM 255 OD1 ASN A 19 2.778 2.337 -7.963 1.00 0.00 O ATOM 256 ND2 ASN A 19 2.986 0.265 -7.103 1.00 0.00 N ATOM 0 H ASN A 19 3.100 2.862 -10.126 1.00 0.00 H new ATOM 0 HA ASN A 19 1.066 0.960 -11.122 1.00 0.00 H new ATOM 0 HB2 ASN A 19 1.499 -0.336 -9.125 1.00 0.00 H new ATOM 0 HB3 ASN A 19 3.046 0.001 -9.877 1.00 0.00 H new ATOM 0 HD21 ASN A 19 3.318 0.608 -6.202 1.00 0.00 H new ATOM 0 HD22 ASN A 19 2.885 -0.738 -7.261 1.00 0.00 H new ATOM 263 N LYS A 20 0.301 3.505 -9.835 1.00 0.00 N ATOM 264 CA LYS A 20 -0.658 4.352 -9.146 1.00 0.00 C ATOM 265 C LYS A 20 -2.055 3.741 -9.273 1.00 0.00 C ATOM 266 O LYS A 20 -2.774 3.615 -8.283 1.00 0.00 O ATOM 267 CB LYS A 20 -0.567 5.791 -9.657 1.00 0.00 C ATOM 268 CG LYS A 20 -1.668 6.660 -9.046 1.00 0.00 C ATOM 269 CD LYS A 20 -2.084 7.775 -10.009 1.00 0.00 C ATOM 270 CE LYS A 20 -2.152 9.123 -9.289 1.00 0.00 C ATOM 271 NZ LYS A 20 -2.782 10.143 -10.157 1.00 0.00 N ATOM 0 H LYS A 20 0.796 3.959 -10.603 1.00 0.00 H new ATOM 0 HA LYS A 20 -0.427 4.402 -8.082 1.00 0.00 H new ATOM 0 HB2 LYS A 20 0.409 6.208 -9.410 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -0.652 5.801 -10.744 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -2.533 6.042 -8.805 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -1.316 7.095 -8.111 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -1.372 7.834 -10.832 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -3.056 7.541 -10.444 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -2.722 9.020 -8.366 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -1.148 9.444 -9.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -2.582 11.091 -9.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -2.397 10.065 -11.120 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -3.810 9.990 -10.182 1.00 0.00 H new ATOM 285 N PHE A 21 -2.398 3.379 -10.501 1.00 0.00 N ATOM 286 CA PHE A 21 -3.696 2.784 -10.770 1.00 0.00 C ATOM 287 C PHE A 21 -3.852 1.451 -10.036 1.00 0.00 C ATOM 288 O PHE A 21 -4.967 1.039 -9.720 1.00 0.00 O ATOM 289 CB PHE A 21 -3.769 2.534 -12.278 1.00 0.00 C ATOM 290 CG PHE A 21 -4.162 3.767 -13.095 1.00 0.00 C ATOM 291 CD1 PHE A 21 -3.366 4.870 -13.087 1.00 0.00 C ATOM 292 CD2 PHE A 21 -5.307 3.760 -13.828 1.00 0.00 C ATOM 293 CE1 PHE A 21 -3.731 6.014 -13.845 1.00 0.00 C ATOM 294 CE2 PHE A 21 -5.672 4.904 -14.586 1.00 0.00 C ATOM 295 CZ PHE A 21 -4.876 6.007 -14.579 1.00 0.00 C ATOM 0 H PHE A 21 -1.800 3.486 -11.320 1.00 0.00 H new ATOM 0 HA PHE A 21 -4.488 3.450 -10.429 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -2.799 2.176 -12.624 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -4.490 1.739 -12.470 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -2.457 4.876 -12.504 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -5.939 2.884 -13.834 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -3.099 6.890 -13.839 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -6.582 4.898 -15.168 1.00 0.00 H new ATOM 0 HZ PHE A 21 -5.153 6.877 -15.156 1.00 0.00 H new ATOM 305 N ILE A 22 -2.718 0.814 -9.786 1.00 0.00 N ATOM 306 CA ILE A 22 -2.714 -0.465 -9.095 1.00 0.00 C ATOM 307 C ILE A 22 -3.007 -0.238 -7.611 1.00 0.00 C ATOM 308 O ILE A 22 -3.742 -1.009 -6.994 1.00 0.00 O ATOM 309 CB ILE A 22 -1.404 -1.211 -9.356 1.00 0.00 C ATOM 310 CG1 ILE A 22 -1.174 -1.406 -10.856 1.00 0.00 C ATOM 311 CG2 ILE A 22 -1.368 -2.537 -8.594 1.00 0.00 C ATOM 312 CD1 ILE A 22 0.280 -1.788 -11.142 1.00 0.00 C ATOM 0 H ILE A 22 -1.795 1.159 -10.049 1.00 0.00 H new ATOM 0 HA ILE A 22 -3.503 -1.110 -9.482 1.00 0.00 H new ATOM 0 HB ILE A 22 -0.582 -0.601 -8.981 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -1.839 -2.184 -11.232 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -1.424 -0.488 -11.388 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -0.427 -3.048 -8.797 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -1.454 -2.345 -7.525 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -2.198 -3.165 -8.917 1.00 0.00 H new ATOM 0 HD11 ILE A 22 0.417 -1.921 -12.215 1.00 0.00 H new ATOM 0 HD12 ILE A 22 0.941 -0.997 -10.787 1.00 0.00 H new ATOM 0 HD13 ILE A 22 0.520 -2.719 -10.628 1.00 0.00 H new ATOM 324 N ILE A 23 -2.418 0.823 -7.079 1.00 0.00 N ATOM 325 CA ILE A 23 -2.607 1.161 -5.679 1.00 0.00 C ATOM 326 C ILE A 23 -4.068 1.551 -5.445 1.00 0.00 C ATOM 327 O ILE A 23 -4.704 1.059 -4.515 1.00 0.00 O ATOM 328 CB ILE A 23 -1.607 2.236 -5.247 1.00 0.00 C ATOM 329 CG1 ILE A 23 -0.172 1.707 -5.312 1.00 0.00 C ATOM 330 CG2 ILE A 23 -1.954 2.783 -3.861 1.00 0.00 C ATOM 331 CD1 ILE A 23 -0.051 0.362 -4.593 1.00 0.00 C ATOM 0 H ILE A 23 -1.809 1.460 -7.593 1.00 0.00 H new ATOM 0 HA ILE A 23 -2.403 0.296 -5.048 1.00 0.00 H new ATOM 0 HB ILE A 23 -1.676 3.068 -5.948 1.00 0.00 H new ATOM 0 HG12 ILE A 23 0.132 1.596 -6.353 1.00 0.00 H new ATOM 0 HG13 ILE A 23 0.507 2.429 -4.857 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -1.228 3.545 -3.578 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -2.951 3.222 -3.882 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -1.931 1.972 -3.133 1.00 0.00 H new ATOM 0 HD11 ILE A 23 0.978 0.008 -4.654 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -0.332 0.482 -3.547 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -0.713 -0.364 -5.065 1.00 0.00 H new ATOM 343 N HIS A 24 -4.556 2.433 -6.306 1.00 0.00 N ATOM 344 CA HIS A 24 -5.930 2.894 -6.205 1.00 0.00 C ATOM 345 C HIS A 24 -6.845 1.715 -5.869 1.00 0.00 C ATOM 346 O HIS A 24 -7.630 1.782 -4.925 1.00 0.00 O ATOM 347 CB HIS A 24 -6.352 3.628 -7.480 1.00 0.00 C ATOM 348 CG HIS A 24 -6.658 5.092 -7.273 1.00 0.00 C ATOM 349 ND1 HIS A 24 -7.950 5.584 -7.196 1.00 0.00 N ATOM 350 CD2 HIS A 24 -5.828 6.164 -7.127 1.00 0.00 C ATOM 351 CE1 HIS A 24 -7.887 6.895 -7.013 1.00 0.00 C ATOM 352 NE2 HIS A 24 -6.572 7.253 -6.971 1.00 0.00 N ATOM 0 H HIS A 24 -4.025 2.840 -7.076 1.00 0.00 H new ATOM 0 HA HIS A 24 -6.015 3.617 -5.394 1.00 0.00 H new ATOM 0 HB2 HIS A 24 -5.558 3.535 -8.221 1.00 0.00 H new ATOM 0 HB3 HIS A 24 -7.233 3.138 -7.894 1.00 0.00 H new ATOM 0 HD1 HIS A 24 -8.804 5.032 -7.268 1.00 0.00 H new ATOM 0 HD2 HIS A 24 -4.748 6.133 -7.137 1.00 0.00 H new ATOM 0 HE1 HIS A 24 -8.730 7.563 -6.914 1.00 0.00 H new ATOM 360 N ASN A 25 -6.713 0.661 -6.662 1.00 0.00 N ATOM 361 CA ASN A 25 -7.518 -0.532 -6.461 1.00 0.00 C ATOM 362 C ASN A 25 -7.083 -1.223 -5.167 1.00 0.00 C ATOM 363 O ASN A 25 -7.911 -1.786 -4.452 1.00 0.00 O ATOM 364 CB ASN A 25 -7.332 -1.522 -7.612 1.00 0.00 C ATOM 365 CG ASN A 25 -8.417 -1.338 -8.675 1.00 0.00 C ATOM 366 OD1 ASN A 25 -9.445 -0.721 -8.449 1.00 0.00 O ATOM 367 ND2 ASN A 25 -8.132 -1.907 -9.843 1.00 0.00 N ATOM 0 H ASN A 25 -6.061 0.609 -7.445 1.00 0.00 H new ATOM 0 HA ASN A 25 -8.564 -0.229 -6.412 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -6.349 -1.381 -8.062 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -7.363 -2.542 -7.228 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -8.793 -1.841 -10.617 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -7.252 -2.409 -9.965 1.00 0.00 H new ATOM 374 N ALA A 26 -5.786 -1.158 -4.906 1.00 0.00 N ATOM 375 CA ALA A 26 -5.231 -1.771 -3.711 1.00 0.00 C ATOM 376 C ALA A 26 -5.926 -1.192 -2.477 1.00 0.00 C ATOM 377 O ALA A 26 -6.129 -1.895 -1.488 1.00 0.00 O ATOM 378 CB ALA A 26 -3.717 -1.555 -3.682 1.00 0.00 C ATOM 0 H ALA A 26 -5.103 -0.690 -5.502 1.00 0.00 H new ATOM 0 HA ALA A 26 -5.407 -2.847 -3.715 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -3.301 -2.015 -2.786 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -3.268 -2.010 -4.565 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -3.502 -0.486 -3.675 1.00 0.00 H new ATOM 384 N LEU A 27 -6.273 0.083 -2.576 1.00 0.00 N ATOM 385 CA LEU A 27 -6.941 0.764 -1.480 1.00 0.00 C ATOM 386 C LEU A 27 -8.381 0.256 -1.372 1.00 0.00 C ATOM 387 O LEU A 27 -8.830 -0.122 -0.291 1.00 0.00 O ATOM 388 CB LEU A 27 -6.835 2.281 -1.647 1.00 0.00 C ATOM 389 CG LEU A 27 -5.434 2.828 -1.928 1.00 0.00 C ATOM 390 CD1 LEU A 27 -5.428 4.358 -1.906 1.00 0.00 C ATOM 391 CD2 LEU A 27 -4.409 2.237 -0.958 1.00 0.00 C ATOM 0 H LEU A 27 -6.104 0.662 -3.398 1.00 0.00 H new ATOM 0 HA LEU A 27 -6.450 0.536 -0.534 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -7.492 2.584 -2.462 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -7.213 2.754 -0.741 1.00 0.00 H new ATOM 0 HG LEU A 27 -5.142 2.519 -2.932 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -4.420 4.721 -2.109 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -6.110 4.736 -2.668 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -5.750 4.709 -0.926 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -3.422 2.643 -1.180 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -4.685 2.494 0.065 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -4.388 1.153 -1.067 1.00 0.00 H new ATOM 403 N SER A 28 -9.064 0.265 -2.507 1.00 0.00 N ATOM 404 CA SER A 28 -10.443 -0.190 -2.553 1.00 0.00 C ATOM 405 C SER A 28 -10.492 -1.718 -2.519 1.00 0.00 C ATOM 406 O SER A 28 -11.570 -2.310 -2.549 1.00 0.00 O ATOM 407 CB SER A 28 -11.155 0.336 -3.801 1.00 0.00 C ATOM 408 OG SER A 28 -11.893 1.525 -3.534 1.00 0.00 O ATOM 0 H SER A 28 -8.688 0.580 -3.401 1.00 0.00 H new ATOM 0 HA SER A 28 -10.962 0.203 -1.679 1.00 0.00 H new ATOM 0 HB2 SER A 28 -10.420 0.533 -4.581 1.00 0.00 H new ATOM 0 HB3 SER A 28 -11.829 -0.430 -4.184 1.00 0.00 H new ATOM 0 HG SER A 28 -12.331 1.830 -4.356 1.00 0.00 H new ATOM 414 N HIS A 29 -9.311 -2.315 -2.456 1.00 0.00 N ATOM 415 CA HIS A 29 -9.205 -3.764 -2.417 1.00 0.00 C ATOM 416 C HIS A 29 -9.394 -4.254 -0.980 1.00 0.00 C ATOM 417 O HIS A 29 -10.170 -5.175 -0.732 1.00 0.00 O ATOM 418 CB HIS A 29 -7.884 -4.229 -3.033 1.00 0.00 C ATOM 419 CG HIS A 29 -8.028 -4.840 -4.406 1.00 0.00 C ATOM 420 ND1 HIS A 29 -7.553 -6.102 -4.718 1.00 0.00 N ATOM 421 CD2 HIS A 29 -8.599 -4.352 -5.544 1.00 0.00 C ATOM 422 CE1 HIS A 29 -7.830 -6.351 -5.990 1.00 0.00 C ATOM 423 NE2 HIS A 29 -8.478 -5.264 -6.500 1.00 0.00 N ATOM 0 H HIS A 29 -8.419 -1.822 -2.431 1.00 0.00 H new ATOM 0 HA HIS A 29 -9.996 -4.206 -3.022 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -7.204 -3.379 -3.094 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -7.422 -4.959 -2.368 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -9.070 -3.386 -5.649 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -7.586 -7.255 -6.528 1.00 0.00 H new ATOM 0 HE2 HIS A 29 -8.814 -5.168 -7.458 1.00 0.00 H new ATOM 431 N CYS A 30 -8.671 -3.616 -0.072 1.00 0.00 N ATOM 432 CA CYS A 30 -8.750 -3.975 1.334 1.00 0.00 C ATOM 433 C CYS A 30 -7.908 -2.977 2.133 1.00 0.00 C ATOM 434 O CYS A 30 -8.311 -2.544 3.211 1.00 0.00 O ATOM 435 CB CYS A 30 -8.304 -5.419 1.575 1.00 0.00 C ATOM 436 SG CYS A 30 -9.571 -6.311 2.548 1.00 0.00 S ATOM 0 H CYS A 30 -8.028 -2.853 -0.282 1.00 0.00 H new ATOM 0 HA CYS A 30 -9.787 -3.923 1.667 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -8.144 -5.923 0.622 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -7.352 -5.431 2.105 1.00 0.00 H new ATOM 0 HG CYS A 30 -9.184 -7.536 2.745 1.00 0.00 H new ATOM 442 N CYS A 31 -6.755 -2.642 1.572 1.00 0.00 N ATOM 443 CA CYS A 31 -5.854 -1.704 2.219 1.00 0.00 C ATOM 444 C CYS A 31 -6.693 -0.603 2.870 1.00 0.00 C ATOM 445 O CYS A 31 -6.355 -0.115 3.947 1.00 0.00 O ATOM 446 CB CYS A 31 -4.830 -1.134 1.235 1.00 0.00 C ATOM 447 SG CYS A 31 -4.082 0.388 1.922 1.00 0.00 S ATOM 0 H CYS A 31 -6.425 -3.003 0.677 1.00 0.00 H new ATOM 0 HA CYS A 31 -5.276 -2.220 2.986 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -4.054 -1.873 1.036 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -5.312 -0.914 0.282 1.00 0.00 H new ATOM 0 HG CYS A 31 -2.788 0.317 1.826 1.00 0.00 H new ATOM 453 N LEU A 32 -7.772 -0.244 2.189 1.00 0.00 N ATOM 454 CA LEU A 32 -8.662 0.790 2.688 1.00 0.00 C ATOM 455 C LEU A 32 -10.078 0.532 2.170 1.00 0.00 C ATOM 456 O LEU A 32 -10.728 1.438 1.650 1.00 0.00 O ATOM 457 CB LEU A 32 -8.122 2.178 2.336 1.00 0.00 C ATOM 458 CG LEU A 32 -6.780 2.556 2.967 1.00 0.00 C ATOM 459 CD1 LEU A 32 -6.191 3.800 2.300 1.00 0.00 C ATOM 460 CD2 LEU A 32 -6.916 2.727 4.481 1.00 0.00 C ATOM 0 H LEU A 32 -8.050 -0.651 1.296 1.00 0.00 H new ATOM 0 HA LEU A 32 -8.710 0.758 3.777 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -8.023 2.243 1.253 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -8.863 2.920 2.633 1.00 0.00 H new ATOM 0 HG LEU A 32 -6.080 1.738 2.797 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -5.238 4.047 2.767 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -6.035 3.605 1.239 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -6.880 4.637 2.418 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -5.948 2.995 4.905 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -7.637 3.516 4.695 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -7.259 1.792 4.923 1.00 0.00 H new ATOM 472 N ALA A 33 -10.515 -0.708 2.330 1.00 0.00 N ATOM 473 CA ALA A 33 -11.842 -1.098 1.884 1.00 0.00 C ATOM 474 C ALA A 33 -12.713 -1.409 3.103 1.00 0.00 C ATOM 475 O ALA A 33 -12.354 -2.246 3.930 1.00 0.00 O ATOM 476 CB ALA A 33 -11.732 -2.286 0.927 1.00 0.00 C ATOM 0 H ALA A 33 -9.974 -1.456 2.763 1.00 0.00 H new ATOM 0 HA ALA A 33 -12.318 -0.284 1.337 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -12.728 -2.578 0.593 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -11.128 -2.004 0.064 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -11.261 -3.124 1.440 1.00 0.00 H new ATOM 482 N GLY A 34 -13.842 -0.720 3.175 1.00 0.00 N ATOM 483 CA GLY A 34 -14.768 -0.913 4.279 1.00 0.00 C ATOM 484 C GLY A 34 -15.614 0.341 4.510 1.00 0.00 C ATOM 485 O GLY A 34 -15.607 1.259 3.692 1.00 0.00 O ATOM 0 H GLY A 34 -14.137 -0.027 2.487 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -15.419 -1.762 4.068 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -14.213 -1.154 5.186 1.00 0.00 H new ATOM 489 N LYS A 35 -16.323 0.339 5.630 1.00 0.00 N ATOM 490 CA LYS A 35 -17.173 1.465 5.979 1.00 0.00 C ATOM 491 C LYS A 35 -16.416 2.394 6.930 1.00 0.00 C ATOM 492 O LYS A 35 -16.602 3.609 6.895 1.00 0.00 O ATOM 493 CB LYS A 35 -18.511 0.973 6.535 1.00 0.00 C ATOM 494 CG LYS A 35 -19.586 2.055 6.412 1.00 0.00 C ATOM 495 CD LYS A 35 -20.557 1.736 5.273 1.00 0.00 C ATOM 496 CE LYS A 35 -20.835 2.979 4.425 1.00 0.00 C ATOM 497 NZ LYS A 35 -22.189 3.505 4.705 1.00 0.00 N ATOM 0 H LYS A 35 -16.326 -0.424 6.307 1.00 0.00 H new ATOM 0 HA LYS A 35 -17.418 2.048 5.091 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -18.826 0.079 5.997 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -18.392 0.690 7.581 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -20.135 2.136 7.350 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -19.115 3.022 6.233 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -20.140 0.949 4.645 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -21.492 1.355 5.683 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -20.090 3.745 4.637 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -20.746 2.732 3.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -22.361 4.348 4.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -22.897 2.778 4.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -22.261 3.759 5.711 1.00 0.00 H new ATOM 511 N VAL A 36 -15.578 1.786 7.758 1.00 0.00 N ATOM 512 CA VAL A 36 -14.792 2.544 8.717 1.00 0.00 C ATOM 513 C VAL A 36 -13.727 3.351 7.972 1.00 0.00 C ATOM 514 O VAL A 36 -13.411 4.475 8.359 1.00 0.00 O ATOM 515 CB VAL A 36 -14.202 1.604 9.769 1.00 0.00 C ATOM 516 CG1 VAL A 36 -15.293 0.738 10.404 1.00 0.00 C ATOM 517 CG2 VAL A 36 -13.093 0.737 9.170 1.00 0.00 C ATOM 0 H VAL A 36 -15.427 0.778 7.784 1.00 0.00 H new ATOM 0 HA VAL A 36 -15.423 3.254 9.252 1.00 0.00 H new ATOM 0 HB VAL A 36 -13.760 2.216 10.555 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -14.847 0.079 11.148 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -16.033 1.379 10.884 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -15.777 0.139 9.633 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -12.691 0.078 9.939 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -13.500 0.138 8.355 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -12.297 1.377 8.788 1.00 0.00 H new ATOM 527 N ASN A 37 -13.202 2.746 6.917 1.00 0.00 N ATOM 528 CA ASN A 37 -12.178 3.395 6.114 1.00 0.00 C ATOM 529 C ASN A 37 -12.795 3.872 4.798 1.00 0.00 C ATOM 530 O ASN A 37 -12.113 3.935 3.776 1.00 0.00 O ATOM 531 CB ASN A 37 -11.043 2.425 5.781 1.00 0.00 C ATOM 532 CG ASN A 37 -10.271 2.030 7.041 1.00 0.00 C ATOM 533 OD1 ASN A 37 -9.937 2.852 7.879 1.00 0.00 O ATOM 534 ND2 ASN A 37 -10.007 0.729 7.128 1.00 0.00 N ATOM 0 H ASN A 37 -13.466 1.813 6.599 1.00 0.00 H new ATOM 0 HA ASN A 37 -11.780 4.232 6.687 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -11.450 1.533 5.305 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -10.364 2.887 5.064 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -9.496 0.365 7.932 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -10.316 0.096 6.391 1.00 0.00 H new ATOM 541 N GLU A 38 -14.078 4.196 4.865 1.00 0.00 N ATOM 542 CA GLU A 38 -14.794 4.665 3.691 1.00 0.00 C ATOM 543 C GLU A 38 -14.498 6.146 3.446 1.00 0.00 C ATOM 544 O GLU A 38 -14.307 6.564 2.305 1.00 0.00 O ATOM 545 CB GLU A 38 -16.298 4.423 3.833 1.00 0.00 C ATOM 546 CG GLU A 38 -17.055 4.948 2.612 1.00 0.00 C ATOM 547 CD GLU A 38 -18.528 5.196 2.945 1.00 0.00 C ATOM 548 OE1 GLU A 38 -18.777 5.750 4.038 1.00 0.00 O ATOM 549 OE2 GLU A 38 -19.371 4.827 2.099 1.00 0.00 O ATOM 0 H GLU A 38 -14.640 4.143 5.714 1.00 0.00 H new ATOM 0 HA GLU A 38 -14.448 4.097 2.827 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -16.489 3.357 3.953 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -16.666 4.916 4.733 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -16.596 5.874 2.265 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -16.979 4.230 1.796 1.00 0.00 H new ATOM 556 N PRO A 39 -14.469 6.919 4.565 1.00 0.00 N ATOM 557 CA PRO A 39 -14.199 8.345 4.482 1.00 0.00 C ATOM 558 C PRO A 39 -12.715 8.608 4.220 1.00 0.00 C ATOM 559 O PRO A 39 -12.366 9.499 3.447 1.00 0.00 O ATOM 560 CB PRO A 39 -14.678 8.913 5.808 1.00 0.00 C ATOM 561 CG PRO A 39 -14.767 7.731 6.760 1.00 0.00 C ATOM 562 CD PRO A 39 -14.691 6.459 5.932 1.00 0.00 C ATOM 0 HA PRO A 39 -14.714 8.823 3.649 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -13.985 9.666 6.184 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -15.647 9.399 5.697 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -13.954 7.763 7.486 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -15.699 7.764 7.324 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -13.879 5.815 6.270 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -15.611 5.880 6.010 1.00 0.00 H new ATOM 570 N GLN A 40 -11.881 7.816 4.878 1.00 0.00 N ATOM 571 CA GLN A 40 -10.443 7.952 4.725 1.00 0.00 C ATOM 572 C GLN A 40 -10.006 7.453 3.347 1.00 0.00 C ATOM 573 O GLN A 40 -9.335 8.172 2.606 1.00 0.00 O ATOM 574 CB GLN A 40 -9.701 7.209 5.838 1.00 0.00 C ATOM 575 CG GLN A 40 -8.306 6.781 5.376 1.00 0.00 C ATOM 576 CD GLN A 40 -7.310 6.816 6.537 1.00 0.00 C ATOM 577 OE1 GLN A 40 -6.598 7.785 6.749 1.00 0.00 O ATOM 578 NE2 GLN A 40 -7.298 5.709 7.273 1.00 0.00 N ATOM 0 H GLN A 40 -12.174 7.078 5.518 1.00 0.00 H new ATOM 0 HA GLN A 40 -10.187 9.009 4.805 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -9.617 7.851 6.715 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -10.274 6.332 6.139 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -8.350 5.775 4.960 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -7.964 7.441 4.579 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -7.920 4.935 7.040 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -6.667 5.634 8.071 1.00 0.00 H new ATOM 587 N LYS A 41 -10.402 6.226 3.043 1.00 0.00 N ATOM 588 CA LYS A 41 -10.060 5.623 1.767 1.00 0.00 C ATOM 589 C LYS A 41 -10.113 6.691 0.672 1.00 0.00 C ATOM 590 O LYS A 41 -9.158 6.855 -0.086 1.00 0.00 O ATOM 591 CB LYS A 41 -10.954 4.413 1.489 1.00 0.00 C ATOM 592 CG LYS A 41 -10.832 3.964 0.031 1.00 0.00 C ATOM 593 CD LYS A 41 -12.159 4.140 -0.710 1.00 0.00 C ATOM 594 CE LYS A 41 -13.309 3.492 0.064 1.00 0.00 C ATOM 595 NZ LYS A 41 -13.951 2.436 -0.751 1.00 0.00 N ATOM 0 H LYS A 41 -10.957 5.633 3.660 1.00 0.00 H new ATOM 0 HA LYS A 41 -9.040 5.239 1.789 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -10.677 3.592 2.150 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -11.991 4.664 1.710 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -10.054 4.542 -0.467 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -10.526 2.918 -0.007 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -12.363 5.201 -0.851 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -12.087 3.695 -1.702 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -12.934 3.065 0.994 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -14.045 4.249 0.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -14.729 2.006 -0.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -14.326 2.853 -1.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -13.249 1.706 -0.988 1.00 0.00 H new ATOM 609 N ASN A 42 -11.237 7.389 0.625 1.00 0.00 N ATOM 610 CA ASN A 42 -11.427 8.437 -0.364 1.00 0.00 C ATOM 611 C ASN A 42 -10.306 9.469 -0.228 1.00 0.00 C ATOM 612 O ASN A 42 -9.665 9.828 -1.215 1.00 0.00 O ATOM 613 CB ASN A 42 -12.761 9.157 -0.155 1.00 0.00 C ATOM 614 CG ASN A 42 -13.901 8.414 -0.854 1.00 0.00 C ATOM 615 OD1 ASN A 42 -14.122 8.545 -2.047 1.00 0.00 O ATOM 616 ND2 ASN A 42 -14.609 7.628 -0.049 1.00 0.00 N ATOM 0 H ASN A 42 -12.026 7.250 1.256 1.00 0.00 H new ATOM 0 HA ASN A 42 -11.418 7.975 -1.351 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -12.973 9.235 0.911 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -12.694 10.174 -0.542 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -15.391 7.089 -0.421 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -14.370 7.564 0.941 1.00 0.00 H new ATOM 623 N ARG A 43 -10.104 9.917 1.002 1.00 0.00 N ATOM 624 CA ARG A 43 -9.071 10.902 1.280 1.00 0.00 C ATOM 625 C ARG A 43 -7.732 10.444 0.698 1.00 0.00 C ATOM 626 O ARG A 43 -6.970 11.255 0.173 1.00 0.00 O ATOM 627 CB ARG A 43 -8.915 11.127 2.785 1.00 0.00 C ATOM 628 CG ARG A 43 -10.036 12.017 3.325 1.00 0.00 C ATOM 629 CD ARG A 43 -9.515 13.418 3.650 1.00 0.00 C ATOM 630 NE ARG A 43 -10.601 14.241 4.228 1.00 0.00 N ATOM 631 CZ ARG A 43 -10.402 15.385 4.896 1.00 0.00 C ATOM 632 NH1 ARG A 43 -9.158 15.849 5.076 1.00 0.00 N ATOM 633 NH2 ARG A 43 -11.448 16.066 5.386 1.00 0.00 N ATOM 0 H ARG A 43 -10.638 9.617 1.818 1.00 0.00 H new ATOM 0 HA ARG A 43 -9.373 11.840 0.814 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -8.926 10.168 3.303 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -7.949 11.589 2.989 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -10.838 12.085 2.590 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -10.463 11.567 4.221 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -8.684 13.352 4.353 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -9.131 13.891 2.746 1.00 0.00 H new ATOM 0 HE ARG A 43 -11.561 13.917 4.110 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -8.362 15.331 4.704 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -9.007 16.720 5.585 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -12.395 15.713 5.250 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -11.296 16.937 5.895 1.00 0.00 H new ATOM 647 N ILE A 44 -7.486 9.147 0.811 1.00 0.00 N ATOM 648 CA ILE A 44 -6.252 8.573 0.302 1.00 0.00 C ATOM 649 C ILE A 44 -6.248 8.654 -1.225 1.00 0.00 C ATOM 650 O ILE A 44 -5.320 9.201 -1.819 1.00 0.00 O ATOM 651 CB ILE A 44 -6.059 7.154 0.843 1.00 0.00 C ATOM 652 CG1 ILE A 44 -6.394 7.086 2.334 1.00 0.00 C ATOM 653 CG2 ILE A 44 -4.648 6.643 0.548 1.00 0.00 C ATOM 654 CD1 ILE A 44 -5.779 8.266 3.089 1.00 0.00 C ATOM 0 H ILE A 44 -8.120 8.478 1.247 1.00 0.00 H new ATOM 0 HA ILE A 44 -5.393 9.144 0.654 1.00 0.00 H new ATOM 0 HB ILE A 44 -6.755 6.493 0.327 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -7.476 7.088 2.468 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -6.023 6.150 2.751 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -4.537 5.633 0.943 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -4.483 6.632 -0.529 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -3.917 7.299 1.020 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -6.033 8.193 4.147 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -4.695 8.247 2.973 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -6.170 9.200 2.686 1.00 0.00 H new ATOM 666 N LEU A 45 -7.297 8.102 -1.818 1.00 0.00 N ATOM 667 CA LEU A 45 -7.425 8.106 -3.266 1.00 0.00 C ATOM 668 C LEU A 45 -7.079 9.497 -3.801 1.00 0.00 C ATOM 669 O LEU A 45 -6.285 9.628 -4.731 1.00 0.00 O ATOM 670 CB LEU A 45 -8.814 7.615 -3.681 1.00 0.00 C ATOM 671 CG LEU A 45 -9.189 6.202 -3.229 1.00 0.00 C ATOM 672 CD1 LEU A 45 -10.707 6.041 -3.138 1.00 0.00 C ATOM 673 CD2 LEU A 45 -8.554 5.149 -4.140 1.00 0.00 C ATOM 0 H LEU A 45 -8.065 7.649 -1.323 1.00 0.00 H new ATOM 0 HA LEU A 45 -6.718 7.408 -3.713 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -9.556 8.310 -3.287 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -8.883 7.658 -4.768 1.00 0.00 H new ATOM 0 HG LEU A 45 -8.788 6.045 -2.228 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -10.947 5.028 -2.815 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -11.106 6.756 -2.418 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -11.152 6.224 -4.116 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -8.836 4.154 -3.797 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -8.904 5.293 -5.162 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -7.469 5.249 -4.110 1.00 0.00 H new ATOM 685 N GLU A 46 -7.692 10.500 -3.190 1.00 0.00 N ATOM 686 CA GLU A 46 -7.458 11.876 -3.594 1.00 0.00 C ATOM 687 C GLU A 46 -5.967 12.207 -3.513 1.00 0.00 C ATOM 688 O GLU A 46 -5.336 12.498 -4.528 1.00 0.00 O ATOM 689 CB GLU A 46 -8.282 12.844 -2.742 1.00 0.00 C ATOM 690 CG GLU A 46 -9.724 12.356 -2.596 1.00 0.00 C ATOM 691 CD GLU A 46 -10.714 13.417 -3.081 1.00 0.00 C ATOM 692 OE1 GLU A 46 -10.819 13.572 -4.317 1.00 0.00 O ATOM 693 OE2 GLU A 46 -11.343 14.049 -2.205 1.00 0.00 O ATOM 0 H GLU A 46 -8.350 10.387 -2.419 1.00 0.00 H new ATOM 0 HA GLU A 46 -7.779 11.990 -4.629 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -7.827 12.944 -1.757 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -8.274 13.833 -3.199 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -9.861 11.438 -3.167 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -9.926 12.115 -1.552 1.00 0.00 H new ATOM 700 N GLU A 47 -5.446 12.152 -2.296 1.00 0.00 N ATOM 701 CA GLU A 47 -4.040 12.443 -2.069 1.00 0.00 C ATOM 702 C GLU A 47 -3.197 11.923 -3.235 1.00 0.00 C ATOM 703 O GLU A 47 -2.291 12.610 -3.705 1.00 0.00 O ATOM 704 CB GLU A 47 -3.565 11.850 -0.741 1.00 0.00 C ATOM 705 CG GLU A 47 -4.015 12.716 0.438 1.00 0.00 C ATOM 706 CD GLU A 47 -3.225 14.025 0.489 1.00 0.00 C ATOM 707 OE1 GLU A 47 -2.009 13.965 0.210 1.00 0.00 O ATOM 708 OE2 GLU A 47 -3.856 15.056 0.808 1.00 0.00 O ATOM 0 H GLU A 47 -5.972 11.910 -1.456 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.917 13.524 -2.010 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -3.960 10.841 -0.627 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -2.478 11.768 -0.743 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -5.080 12.933 0.349 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -3.878 12.168 1.370 1.00 0.00 H new ATOM 715 N ILE A 48 -3.523 10.714 -3.667 1.00 0.00 N ATOM 716 CA ILE A 48 -2.807 10.094 -4.769 1.00 0.00 C ATOM 717 C ILE A 48 -3.032 10.911 -6.042 1.00 0.00 C ATOM 718 O ILE A 48 -2.076 11.309 -6.706 1.00 0.00 O ATOM 719 CB ILE A 48 -3.202 8.622 -4.904 1.00 0.00 C ATOM 720 CG1 ILE A 48 -2.988 7.873 -3.588 1.00 0.00 C ATOM 721 CG2 ILE A 48 -2.461 7.960 -6.068 1.00 0.00 C ATOM 722 CD1 ILE A 48 -3.938 6.679 -3.475 1.00 0.00 C ATOM 0 H ILE A 48 -4.274 10.147 -3.274 1.00 0.00 H new ATOM 0 HA ILE A 48 -1.734 10.095 -4.575 1.00 0.00 H new ATOM 0 HB ILE A 48 -4.267 8.574 -5.131 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -1.956 7.528 -3.526 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -3.149 8.551 -2.750 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -2.760 6.914 -6.142 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -2.708 8.475 -6.996 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -1.386 8.019 -5.896 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -3.765 6.164 -2.530 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -4.969 7.030 -3.513 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -3.758 5.991 -4.301 1.00 0.00 H new ATOM 734 N GLU A 49 -4.302 11.137 -6.345 1.00 0.00 N ATOM 735 CA GLU A 49 -4.665 11.900 -7.528 1.00 0.00 C ATOM 736 C GLU A 49 -4.135 13.331 -7.419 1.00 0.00 C ATOM 737 O GLU A 49 -3.620 13.882 -8.391 1.00 0.00 O ATOM 738 CB GLU A 49 -6.179 11.891 -7.743 1.00 0.00 C ATOM 739 CG GLU A 49 -6.666 10.501 -8.157 1.00 0.00 C ATOM 740 CD GLU A 49 -7.901 10.597 -9.055 1.00 0.00 C ATOM 741 OE1 GLU A 49 -8.815 11.364 -8.681 1.00 0.00 O ATOM 742 OE2 GLU A 49 -7.904 9.903 -10.094 1.00 0.00 O ATOM 0 H GLU A 49 -5.092 10.805 -5.792 1.00 0.00 H new ATOM 0 HA GLU A 49 -4.205 11.428 -8.396 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -6.682 12.198 -6.826 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -6.445 12.617 -8.511 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -5.870 9.975 -8.683 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -6.903 9.915 -7.269 1.00 0.00 H new ATOM 749 N LYS A 50 -4.279 13.893 -6.228 1.00 0.00 N ATOM 750 CA LYS A 50 -3.822 15.249 -5.980 1.00 0.00 C ATOM 751 C LYS A 50 -2.294 15.288 -6.047 1.00 0.00 C ATOM 752 O LYS A 50 -1.715 16.255 -6.540 1.00 0.00 O ATOM 753 CB LYS A 50 -4.392 15.775 -4.661 1.00 0.00 C ATOM 754 CG LYS A 50 -3.348 15.704 -3.545 1.00 0.00 C ATOM 755 CD LYS A 50 -3.985 15.973 -2.180 1.00 0.00 C ATOM 756 CE LYS A 50 -4.501 17.411 -2.090 1.00 0.00 C ATOM 757 NZ LYS A 50 -3.685 18.195 -1.136 1.00 0.00 N ATOM 0 H LYS A 50 -4.706 13.433 -5.424 1.00 0.00 H new ATOM 0 HA LYS A 50 -4.194 15.922 -6.752 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -4.723 16.806 -4.789 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -5.269 15.191 -4.381 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -2.878 14.720 -3.544 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -2.560 16.433 -3.733 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -4.807 15.277 -2.015 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -3.253 15.795 -1.392 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -4.469 17.878 -3.075 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -5.543 17.410 -1.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -4.048 19.168 -1.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -3.737 17.758 -0.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -2.696 18.211 -1.456 1.00 0.00 H new ATOM 771 N SER A 51 -1.684 14.225 -5.545 1.00 0.00 N ATOM 772 CA SER A 51 -0.234 14.125 -5.542 1.00 0.00 C ATOM 773 C SER A 51 0.286 14.018 -6.977 1.00 0.00 C ATOM 774 O SER A 51 -0.356 13.406 -7.830 1.00 0.00 O ATOM 775 CB SER A 51 0.234 12.924 -4.717 1.00 0.00 C ATOM 776 OG SER A 51 -0.205 11.689 -5.276 1.00 0.00 O ATOM 0 H SER A 51 -2.167 13.425 -5.137 1.00 0.00 H new ATOM 0 HA SER A 51 0.170 15.027 -5.082 1.00 0.00 H new ATOM 0 HB2 SER A 51 1.322 12.928 -4.656 1.00 0.00 H new ATOM 0 HB3 SER A 51 -0.143 13.015 -3.698 1.00 0.00 H new ATOM 0 HG SER A 51 -0.900 11.861 -5.945 1.00 0.00 H new ATOM 782 N LYS A 52 1.444 14.622 -7.200 1.00 0.00 N ATOM 783 CA LYS A 52 2.057 14.603 -8.517 1.00 0.00 C ATOM 784 C LYS A 52 2.998 13.400 -8.618 1.00 0.00 C ATOM 785 O LYS A 52 3.914 13.392 -9.439 1.00 0.00 O ATOM 786 CB LYS A 52 2.736 15.941 -8.811 1.00 0.00 C ATOM 787 CG LYS A 52 1.961 16.728 -9.871 1.00 0.00 C ATOM 788 CD LYS A 52 2.049 16.043 -11.236 1.00 0.00 C ATOM 789 CE LYS A 52 0.655 15.784 -11.810 1.00 0.00 C ATOM 790 NZ LYS A 52 0.193 16.952 -12.595 1.00 0.00 N ATOM 0 H LYS A 52 1.974 15.128 -6.490 1.00 0.00 H new ATOM 0 HA LYS A 52 1.298 14.481 -9.290 1.00 0.00 H new ATOM 0 HB2 LYS A 52 2.804 16.528 -7.895 1.00 0.00 H new ATOM 0 HB3 LYS A 52 3.756 15.768 -9.155 1.00 0.00 H new ATOM 0 HG2 LYS A 52 0.917 16.817 -9.572 1.00 0.00 H new ATOM 0 HG3 LYS A 52 2.360 17.740 -9.942 1.00 0.00 H new ATOM 0 HD2 LYS A 52 2.619 16.667 -11.924 1.00 0.00 H new ATOM 0 HD3 LYS A 52 2.588 15.100 -11.140 1.00 0.00 H new ATOM 0 HE2 LYS A 52 0.675 14.897 -12.444 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -0.046 15.582 -11.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -0.755 16.760 -12.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 0.155 17.790 -11.981 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 0.854 17.127 -13.379 1.00 0.00 H new ATOM 804 N ALA A 53 2.740 12.414 -7.772 1.00 0.00 N ATOM 805 CA ALA A 53 3.552 11.209 -7.756 1.00 0.00 C ATOM 806 C ALA A 53 2.923 10.163 -8.678 1.00 0.00 C ATOM 807 O ALA A 53 1.743 10.255 -9.013 1.00 0.00 O ATOM 808 CB ALA A 53 3.695 10.709 -6.318 1.00 0.00 C ATOM 0 H ALA A 53 1.980 12.425 -7.092 1.00 0.00 H new ATOM 0 HA ALA A 53 4.555 11.417 -8.130 1.00 0.00 H new ATOM 0 HB1 ALA A 53 4.304 9.805 -6.306 1.00 0.00 H new ATOM 0 HB2 ALA A 53 4.174 11.478 -5.712 1.00 0.00 H new ATOM 0 HB3 ALA A 53 2.709 10.487 -5.910 1.00 0.00 H new ATOM 814 N ASN A 54 3.738 9.192 -9.062 1.00 0.00 N ATOM 815 CA ASN A 54 3.276 8.129 -9.939 1.00 0.00 C ATOM 816 C ASN A 54 3.456 6.781 -9.237 1.00 0.00 C ATOM 817 O ASN A 54 2.582 5.918 -9.311 1.00 0.00 O ATOM 818 CB ASN A 54 4.083 8.097 -11.238 1.00 0.00 C ATOM 819 CG ASN A 54 3.682 9.250 -12.161 1.00 0.00 C ATOM 820 OD1 ASN A 54 2.543 9.377 -12.579 1.00 0.00 O ATOM 821 ND2 ASN A 54 4.679 10.080 -12.454 1.00 0.00 N ATOM 0 H ASN A 54 4.716 9.119 -8.782 1.00 0.00 H new ATOM 0 HA ASN A 54 2.227 8.315 -10.171 1.00 0.00 H new ATOM 0 HB2 ASN A 54 5.147 8.161 -11.011 1.00 0.00 H new ATOM 0 HB3 ASN A 54 3.923 7.146 -11.747 1.00 0.00 H new ATOM 0 HD21 ASN A 54 4.513 10.881 -13.063 1.00 0.00 H new ATOM 0 HD22 ASN A 54 5.609 9.915 -12.070 1.00 0.00 H new ATOM 828 N HIS A 55 4.594 6.643 -8.573 1.00 0.00 N ATOM 829 CA HIS A 55 4.899 5.415 -7.859 1.00 0.00 C ATOM 830 C HIS A 55 4.500 5.562 -6.390 1.00 0.00 C ATOM 831 O HIS A 55 5.064 6.384 -5.669 1.00 0.00 O ATOM 832 CB HIS A 55 6.370 5.033 -8.039 1.00 0.00 C ATOM 833 CG HIS A 55 6.709 3.647 -7.545 1.00 0.00 C ATOM 834 ND1 HIS A 55 7.969 3.090 -7.682 1.00 0.00 N ATOM 835 CD2 HIS A 55 5.941 2.712 -6.915 1.00 0.00 C ATOM 836 CE1 HIS A 55 7.948 1.875 -7.155 1.00 0.00 C ATOM 837 NE2 HIS A 55 6.691 1.642 -6.680 1.00 0.00 N ATOM 0 H HIS A 55 5.316 7.361 -8.514 1.00 0.00 H new ATOM 0 HA HIS A 55 4.317 4.594 -8.276 1.00 0.00 H new ATOM 0 HB2 HIS A 55 6.626 5.104 -9.096 1.00 0.00 H new ATOM 0 HB3 HIS A 55 6.990 5.758 -7.511 1.00 0.00 H new ATOM 0 HD2 HIS A 55 4.899 2.823 -6.652 1.00 0.00 H new ATOM 0 HE1 HIS A 55 8.781 1.189 -7.109 1.00 0.00 H new ATOM 0 HE2 HIS A 55 6.379 0.787 -6.220 1.00 0.00 H new ATOM 845 N PHE A 56 3.530 4.754 -5.989 1.00 0.00 N ATOM 846 CA PHE A 56 3.049 4.784 -4.618 1.00 0.00 C ATOM 847 C PHE A 56 3.208 3.417 -3.951 1.00 0.00 C ATOM 848 O PHE A 56 2.991 2.384 -4.583 1.00 0.00 O ATOM 849 CB PHE A 56 1.562 5.141 -4.674 1.00 0.00 C ATOM 850 CG PHE A 56 1.267 6.473 -5.366 1.00 0.00 C ATOM 851 CD1 PHE A 56 1.284 6.553 -6.723 1.00 0.00 C ATOM 852 CD2 PHE A 56 0.989 7.578 -4.623 1.00 0.00 C ATOM 853 CE1 PHE A 56 1.010 7.790 -7.365 1.00 0.00 C ATOM 854 CE2 PHE A 56 0.715 8.815 -5.265 1.00 0.00 C ATOM 855 CZ PHE A 56 0.732 8.895 -6.622 1.00 0.00 C ATOM 0 H PHE A 56 3.064 4.074 -6.590 1.00 0.00 H new ATOM 0 HA PHE A 56 3.621 5.509 -4.039 1.00 0.00 H new ATOM 0 HB2 PHE A 56 1.028 4.347 -5.195 1.00 0.00 H new ATOM 0 HB3 PHE A 56 1.169 5.176 -3.658 1.00 0.00 H new ATOM 0 HD1 PHE A 56 1.506 5.676 -7.313 1.00 0.00 H new ATOM 0 HD2 PHE A 56 0.977 7.515 -3.545 1.00 0.00 H new ATOM 0 HE1 PHE A 56 1.022 7.853 -8.443 1.00 0.00 H new ATOM 0 HE2 PHE A 56 0.493 9.692 -4.675 1.00 0.00 H new ATOM 0 HZ PHE A 56 0.525 9.836 -7.110 1.00 0.00 H new ATOM 865 N LEU A 57 3.586 3.454 -2.681 1.00 0.00 N ATOM 866 CA LEU A 57 3.777 2.230 -1.921 1.00 0.00 C ATOM 867 C LEU A 57 2.838 2.234 -0.713 1.00 0.00 C ATOM 868 O LEU A 57 2.318 3.281 -0.330 1.00 0.00 O ATOM 869 CB LEU A 57 5.251 2.053 -1.554 1.00 0.00 C ATOM 870 CG LEU A 57 6.155 1.498 -2.656 1.00 0.00 C ATOM 871 CD1 LEU A 57 6.567 2.600 -3.634 1.00 0.00 C ATOM 872 CD2 LEU A 57 7.367 0.777 -2.061 1.00 0.00 C ATOM 0 H LEU A 57 3.765 4.312 -2.160 1.00 0.00 H new ATOM 0 HA LEU A 57 3.516 1.361 -2.525 1.00 0.00 H new ATOM 0 HB2 LEU A 57 5.645 3.020 -1.241 1.00 0.00 H new ATOM 0 HB3 LEU A 57 5.313 1.389 -0.692 1.00 0.00 H new ATOM 0 HG LEU A 57 5.588 0.760 -3.223 1.00 0.00 H new ATOM 0 HD11 LEU A 57 7.209 2.179 -4.407 1.00 0.00 H new ATOM 0 HD12 LEU A 57 5.677 3.029 -4.095 1.00 0.00 H new ATOM 0 HD13 LEU A 57 7.109 3.379 -3.097 1.00 0.00 H new ATOM 0 HD21 LEU A 57 7.993 0.392 -2.866 1.00 0.00 H new ATOM 0 HD22 LEU A 57 7.944 1.475 -1.455 1.00 0.00 H new ATOM 0 HD23 LEU A 57 7.028 -0.051 -1.438 1.00 0.00 H new ATOM 884 N ILE A 58 2.650 1.051 -0.147 1.00 0.00 N ATOM 885 CA ILE A 58 1.783 0.905 1.010 1.00 0.00 C ATOM 886 C ILE A 58 2.629 0.551 2.235 1.00 0.00 C ATOM 887 O ILE A 58 3.358 -0.439 2.225 1.00 0.00 O ATOM 888 CB ILE A 58 0.669 -0.103 0.721 1.00 0.00 C ATOM 889 CG1 ILE A 58 -0.362 0.481 -0.248 1.00 0.00 C ATOM 890 CG2 ILE A 58 0.023 -0.594 2.018 1.00 0.00 C ATOM 891 CD1 ILE A 58 -0.863 -0.585 -1.224 1.00 0.00 C ATOM 0 H ILE A 58 3.083 0.185 -0.468 1.00 0.00 H new ATOM 0 HA ILE A 58 1.280 1.847 1.230 1.00 0.00 H new ATOM 0 HB ILE A 58 1.113 -0.971 0.234 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -1.203 0.890 0.313 1.00 0.00 H new ATOM 0 HG13 ILE A 58 0.083 1.307 -0.803 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -0.765 -1.309 1.784 1.00 0.00 H new ATOM 0 HG22 ILE A 58 0.777 -1.076 2.640 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -0.404 0.253 2.555 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -1.594 -0.144 -1.901 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -0.024 -0.974 -1.800 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -1.329 -1.398 -0.667 1.00 0.00 H new ATOM 903 N LEU A 59 2.504 1.381 3.260 1.00 0.00 N ATOM 904 CA LEU A 59 3.248 1.168 4.490 1.00 0.00 C ATOM 905 C LEU A 59 2.407 0.325 5.451 1.00 0.00 C ATOM 906 O LEU A 59 1.299 0.713 5.815 1.00 0.00 O ATOM 907 CB LEU A 59 3.700 2.505 5.081 1.00 0.00 C ATOM 908 CG LEU A 59 4.426 2.433 6.426 1.00 0.00 C ATOM 909 CD1 LEU A 59 5.810 1.801 6.269 1.00 0.00 C ATOM 910 CD2 LEU A 59 4.496 3.812 7.085 1.00 0.00 C ATOM 0 H LEU A 59 1.899 2.202 3.264 1.00 0.00 H new ATOM 0 HA LEU A 59 4.162 0.608 4.290 1.00 0.00 H new ATOM 0 HB2 LEU A 59 4.357 2.994 4.362 1.00 0.00 H new ATOM 0 HB3 LEU A 59 2.824 3.143 5.197 1.00 0.00 H new ATOM 0 HG LEU A 59 3.852 1.787 7.091 1.00 0.00 H new ATOM 0 HD11 LEU A 59 6.304 1.762 7.240 1.00 0.00 H new ATOM 0 HD12 LEU A 59 5.706 0.790 5.874 1.00 0.00 H new ATOM 0 HD13 LEU A 59 6.407 2.400 5.581 1.00 0.00 H new ATOM 0 HD21 LEU A 59 5.017 3.733 8.039 1.00 0.00 H new ATOM 0 HD22 LEU A 59 5.035 4.500 6.433 1.00 0.00 H new ATOM 0 HD23 LEU A 59 3.486 4.187 7.253 1.00 0.00 H new ATOM 922 N PHE A 60 2.967 -0.814 5.833 1.00 0.00 N ATOM 923 CA PHE A 60 2.283 -1.715 6.744 1.00 0.00 C ATOM 924 C PHE A 60 2.756 -1.503 8.183 1.00 0.00 C ATOM 925 O PHE A 60 3.516 -0.577 8.461 1.00 0.00 O ATOM 926 CB PHE A 60 2.632 -3.140 6.309 1.00 0.00 C ATOM 927 CG PHE A 60 1.999 -3.559 4.981 1.00 0.00 C ATOM 928 CD1 PHE A 60 0.718 -3.200 4.695 1.00 0.00 C ATOM 929 CD2 PHE A 60 2.716 -4.289 4.086 1.00 0.00 C ATOM 930 CE1 PHE A 60 0.130 -3.588 3.462 1.00 0.00 C ATOM 931 CE2 PHE A 60 2.128 -4.677 2.853 1.00 0.00 C ATOM 932 CZ PHE A 60 0.848 -4.319 2.567 1.00 0.00 C ATOM 0 H PHE A 60 3.887 -1.133 5.528 1.00 0.00 H new ATOM 0 HA PHE A 60 1.209 -1.531 6.713 1.00 0.00 H new ATOM 0 HB2 PHE A 60 3.715 -3.229 6.227 1.00 0.00 H new ATOM 0 HB3 PHE A 60 2.313 -3.834 7.086 1.00 0.00 H new ATOM 0 HD1 PHE A 60 0.148 -2.620 5.406 1.00 0.00 H new ATOM 0 HD2 PHE A 60 3.733 -4.574 4.313 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -0.887 -3.303 3.235 1.00 0.00 H new ATOM 0 HE2 PHE A 60 2.698 -5.257 2.142 1.00 0.00 H new ATOM 0 HZ PHE A 60 0.401 -4.615 1.629 1.00 0.00 H new ATOM 942 N ARG A 61 2.286 -2.378 9.061 1.00 0.00 N ATOM 943 CA ARG A 61 2.652 -2.298 10.465 1.00 0.00 C ATOM 944 C ARG A 61 3.561 -3.469 10.845 1.00 0.00 C ATOM 945 O ARG A 61 3.404 -4.060 11.912 1.00 0.00 O ATOM 946 CB ARG A 61 1.411 -2.314 11.360 1.00 0.00 C ATOM 947 CG ARG A 61 1.519 -1.265 12.468 1.00 0.00 C ATOM 948 CD ARG A 61 2.393 -1.770 13.618 1.00 0.00 C ATOM 949 NE ARG A 61 2.435 -0.763 14.702 1.00 0.00 N ATOM 950 CZ ARG A 61 2.888 -1.010 15.938 1.00 0.00 C ATOM 951 NH1 ARG A 61 3.339 -2.231 16.256 1.00 0.00 N ATOM 952 NH2 ARG A 61 2.889 -0.035 16.858 1.00 0.00 N ATOM 0 H ARG A 61 1.656 -3.145 8.827 1.00 0.00 H new ATOM 0 HA ARG A 61 3.183 -1.358 10.615 1.00 0.00 H new ATOM 0 HB2 ARG A 61 0.522 -2.122 10.759 1.00 0.00 H new ATOM 0 HB3 ARG A 61 1.290 -3.303 11.802 1.00 0.00 H new ATOM 0 HG2 ARG A 61 1.941 -0.345 12.063 1.00 0.00 H new ATOM 0 HG3 ARG A 61 0.524 -1.022 12.842 1.00 0.00 H new ATOM 0 HD2 ARG A 61 1.998 -2.711 14.000 1.00 0.00 H new ATOM 0 HD3 ARG A 61 3.402 -1.971 13.258 1.00 0.00 H new ATOM 0 HE ARG A 61 2.098 0.177 14.495 1.00 0.00 H new ATOM 0 HH11 ARG A 61 3.338 -2.973 15.557 1.00 0.00 H new ATOM 0 HH12 ARG A 61 3.684 -2.418 17.198 1.00 0.00 H new ATOM 0 HH21 ARG A 61 2.545 0.894 16.617 1.00 0.00 H new ATOM 0 HH22 ARG A 61 3.234 -0.223 17.799 1.00 0.00 H new ATOM 966 N ASP A 62 4.490 -3.769 9.950 1.00 0.00 N ATOM 967 CA ASP A 62 5.424 -4.859 10.177 1.00 0.00 C ATOM 968 C ASP A 62 4.650 -6.174 10.282 1.00 0.00 C ATOM 969 O ASP A 62 3.952 -6.412 11.267 1.00 0.00 O ATOM 970 CB ASP A 62 6.196 -4.659 11.483 1.00 0.00 C ATOM 971 CG ASP A 62 6.691 -3.233 11.730 1.00 0.00 C ATOM 972 OD1 ASP A 62 5.881 -2.432 12.246 1.00 0.00 O ATOM 973 OD2 ASP A 62 7.868 -2.976 11.398 1.00 0.00 O ATOM 0 H ASP A 62 4.616 -3.276 9.066 1.00 0.00 H new ATOM 0 HA ASP A 62 6.125 -4.882 9.343 1.00 0.00 H new ATOM 0 HB2 ASP A 62 5.556 -4.954 12.315 1.00 0.00 H new ATOM 0 HB3 ASP A 62 7.054 -5.331 11.487 1.00 0.00 H new ATOM 978 N SER A 63 4.799 -6.995 9.252 1.00 0.00 N ATOM 979 CA SER A 63 4.123 -8.281 9.216 1.00 0.00 C ATOM 980 C SER A 63 2.701 -8.140 9.764 1.00 0.00 C ATOM 981 O SER A 63 2.479 -8.282 10.966 1.00 0.00 O ATOM 982 CB SER A 63 4.897 -9.333 10.012 1.00 0.00 C ATOM 983 OG SER A 63 4.848 -10.615 9.392 1.00 0.00 O ATOM 0 H SER A 63 5.378 -6.794 8.436 1.00 0.00 H new ATOM 0 HA SER A 63 4.075 -8.613 8.179 1.00 0.00 H new ATOM 0 HB2 SER A 63 5.936 -9.019 10.113 1.00 0.00 H new ATOM 0 HB3 SER A 63 4.485 -9.401 11.019 1.00 0.00 H new ATOM 0 HG SER A 63 5.355 -11.258 9.930 1.00 0.00 H new ATOM 989 N SER A 64 1.776 -7.862 8.857 1.00 0.00 N ATOM 990 CA SER A 64 0.383 -7.701 9.235 1.00 0.00 C ATOM 991 C SER A 64 -0.468 -7.430 7.992 1.00 0.00 C ATOM 992 O SER A 64 -1.585 -7.933 7.879 1.00 0.00 O ATOM 993 CB SER A 64 0.215 -6.568 10.250 1.00 0.00 C ATOM 994 OG SER A 64 0.112 -7.058 11.584 1.00 0.00 O ATOM 0 H SER A 64 1.964 -7.744 7.861 1.00 0.00 H new ATOM 0 HA SER A 64 0.047 -8.626 9.704 1.00 0.00 H new ATOM 0 HB2 SER A 64 1.064 -5.888 10.178 1.00 0.00 H new ATOM 0 HB3 SER A 64 -0.677 -5.991 10.006 1.00 0.00 H new ATOM 0 HG SER A 64 0.885 -7.627 11.784 1.00 0.00 H new ATOM 1000 N CYS A 65 0.092 -6.636 7.092 1.00 0.00 N ATOM 1001 CA CYS A 65 -0.601 -6.293 5.862 1.00 0.00 C ATOM 1002 C CYS A 65 -1.685 -5.265 6.192 1.00 0.00 C ATOM 1003 O CYS A 65 -2.738 -5.241 5.556 1.00 0.00 O ATOM 1004 CB CYS A 65 -1.180 -7.531 5.174 1.00 0.00 C ATOM 1005 SG CYS A 65 -0.632 -7.590 3.429 1.00 0.00 S ATOM 0 H CYS A 65 1.018 -6.220 7.190 1.00 0.00 H new ATOM 0 HA CYS A 65 0.105 -5.861 5.153 1.00 0.00 H new ATOM 0 HB2 CYS A 65 -0.857 -8.432 5.696 1.00 0.00 H new ATOM 0 HB3 CYS A 65 -2.269 -7.508 5.221 1.00 0.00 H new ATOM 0 HG CYS A 65 -0.108 -6.447 3.100 1.00 0.00 H new ATOM 1011 N GLN A 66 -1.391 -4.440 7.187 1.00 0.00 N ATOM 1012 CA GLN A 66 -2.327 -3.413 7.610 1.00 0.00 C ATOM 1013 C GLN A 66 -1.771 -2.024 7.290 1.00 0.00 C ATOM 1014 O GLN A 66 -1.044 -1.442 8.094 1.00 0.00 O ATOM 1015 CB GLN A 66 -2.650 -3.545 9.099 1.00 0.00 C ATOM 1016 CG GLN A 66 -3.622 -4.699 9.350 1.00 0.00 C ATOM 1017 CD GLN A 66 -4.876 -4.212 10.079 1.00 0.00 C ATOM 1018 OE1 GLN A 66 -4.845 -3.281 10.866 1.00 0.00 O ATOM 1019 NE2 GLN A 66 -5.978 -4.892 9.773 1.00 0.00 N ATOM 0 H GLN A 66 -0.517 -4.463 7.712 1.00 0.00 H new ATOM 0 HA GLN A 66 -3.257 -3.547 7.057 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -1.731 -3.711 9.661 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -3.083 -2.614 9.464 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -3.903 -5.155 8.401 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -3.130 -5.471 9.942 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -5.933 -5.662 9.105 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -6.867 -4.644 10.206 1.00 0.00 H new ATOM 1028 N PHE A 67 -2.134 -1.533 6.114 1.00 0.00 N ATOM 1029 CA PHE A 67 -1.680 -0.223 5.678 1.00 0.00 C ATOM 1030 C PHE A 67 -1.806 0.804 6.806 1.00 0.00 C ATOM 1031 O PHE A 67 -2.850 0.901 7.449 1.00 0.00 O ATOM 1032 CB PHE A 67 -2.583 0.200 4.517 1.00 0.00 C ATOM 1033 CG PHE A 67 -2.450 1.674 4.130 1.00 0.00 C ATOM 1034 CD1 PHE A 67 -2.917 2.641 4.964 1.00 0.00 C ATOM 1035 CD2 PHE A 67 -1.863 2.017 2.952 1.00 0.00 C ATOM 1036 CE1 PHE A 67 -2.794 4.009 4.604 1.00 0.00 C ATOM 1037 CE2 PHE A 67 -1.739 3.385 2.592 1.00 0.00 C ATOM 1038 CZ PHE A 67 -2.207 4.352 3.426 1.00 0.00 C ATOM 0 H PHE A 67 -2.737 -2.018 5.450 1.00 0.00 H new ATOM 0 HA PHE A 67 -0.632 -0.272 5.382 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -2.352 -0.415 3.648 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -3.620 -0.003 4.784 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -3.381 2.369 5.900 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -1.491 1.249 2.290 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -3.167 4.777 5.266 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -1.273 3.657 1.656 1.00 0.00 H new ATOM 0 HZ PHE A 67 -2.113 5.393 3.153 1.00 0.00 H new ATOM 1048 N ARG A 68 -0.726 1.545 7.010 1.00 0.00 N ATOM 1049 CA ARG A 68 -0.702 2.561 8.049 1.00 0.00 C ATOM 1050 C ARG A 68 -0.751 3.958 7.426 1.00 0.00 C ATOM 1051 O ARG A 68 -1.383 4.862 7.970 1.00 0.00 O ATOM 1052 CB ARG A 68 0.555 2.438 8.911 1.00 0.00 C ATOM 1053 CG ARG A 68 0.382 1.360 9.983 1.00 0.00 C ATOM 1054 CD ARG A 68 -0.351 1.916 11.206 1.00 0.00 C ATOM 1055 NE ARG A 68 0.622 2.490 12.162 1.00 0.00 N ATOM 1056 CZ ARG A 68 0.287 3.025 13.344 1.00 0.00 C ATOM 1057 NH1 ARG A 68 -0.997 3.063 13.723 1.00 0.00 N ATOM 1058 NH2 ARG A 68 1.238 3.522 14.147 1.00 0.00 N ATOM 0 H ARG A 68 0.138 1.462 6.474 1.00 0.00 H new ATOM 0 HA ARG A 68 -1.577 2.410 8.681 1.00 0.00 H new ATOM 0 HB2 ARG A 68 1.410 2.195 8.280 1.00 0.00 H new ATOM 0 HB3 ARG A 68 0.770 3.396 9.385 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -0.176 0.519 9.571 1.00 0.00 H new ATOM 0 HG3 ARG A 68 1.359 0.979 10.282 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -1.064 2.681 10.897 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -0.923 1.124 11.689 1.00 0.00 H new ATOM 0 HE ARG A 68 1.609 2.478 11.905 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -1.721 2.685 13.112 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -1.251 3.470 14.623 1.00 0.00 H new ATOM 0 HH21 ARG A 68 2.216 3.493 13.858 1.00 0.00 H new ATOM 0 HH22 ARG A 68 0.984 3.929 15.047 1.00 0.00 H new ATOM 1072 N ALA A 69 -0.074 4.090 6.295 1.00 0.00 N ATOM 1073 CA ALA A 69 -0.032 5.361 5.592 1.00 0.00 C ATOM 1074 C ALA A 69 0.447 5.131 4.158 1.00 0.00 C ATOM 1075 O ALA A 69 0.995 4.075 3.844 1.00 0.00 O ATOM 1076 CB ALA A 69 0.865 6.337 6.357 1.00 0.00 C ATOM 0 H ALA A 69 0.450 3.338 5.848 1.00 0.00 H new ATOM 0 HA ALA A 69 -1.027 5.804 5.539 1.00 0.00 H new ATOM 0 HB1 ALA A 69 0.897 7.291 5.830 1.00 0.00 H new ATOM 0 HB2 ALA A 69 0.465 6.489 7.359 1.00 0.00 H new ATOM 0 HB3 ALA A 69 1.873 5.927 6.427 1.00 0.00 H new ATOM 1082 N LEU A 70 0.224 6.136 3.324 1.00 0.00 N ATOM 1083 CA LEU A 70 0.626 6.056 1.930 1.00 0.00 C ATOM 1084 C LEU A 70 1.860 6.933 1.709 1.00 0.00 C ATOM 1085 O LEU A 70 2.057 7.923 2.412 1.00 0.00 O ATOM 1086 CB LEU A 70 -0.548 6.404 1.013 1.00 0.00 C ATOM 1087 CG LEU A 70 -0.269 6.334 -0.490 1.00 0.00 C ATOM 1088 CD1 LEU A 70 0.281 4.961 -0.882 1.00 0.00 C ATOM 1089 CD2 LEU A 70 -1.515 6.703 -1.297 1.00 0.00 C ATOM 0 H LEU A 70 -0.230 7.011 3.587 1.00 0.00 H new ATOM 0 HA LEU A 70 0.909 5.035 1.673 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -1.374 5.730 1.241 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -0.884 7.413 1.253 1.00 0.00 H new ATOM 0 HG LEU A 70 0.499 7.069 -0.729 1.00 0.00 H new ATOM 0 HD11 LEU A 70 0.471 4.938 -1.955 1.00 0.00 H new ATOM 0 HD12 LEU A 70 1.211 4.775 -0.345 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -0.446 4.191 -0.626 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -1.289 6.645 -2.362 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -2.321 6.009 -1.059 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -1.824 7.718 -1.046 1.00 0.00 H new ATOM 1101 N TYR A 71 2.659 6.538 0.729 1.00 0.00 N ATOM 1102 CA TYR A 71 3.869 7.276 0.406 1.00 0.00 C ATOM 1103 C TYR A 71 4.149 7.238 -1.098 1.00 0.00 C ATOM 1104 O TYR A 71 3.697 6.331 -1.795 1.00 0.00 O ATOM 1105 CB TYR A 71 5.006 6.564 1.142 1.00 0.00 C ATOM 1106 CG TYR A 71 5.021 6.813 2.652 1.00 0.00 C ATOM 1107 CD1 TYR A 71 4.101 6.182 3.464 1.00 0.00 C ATOM 1108 CD2 TYR A 71 5.955 7.668 3.200 1.00 0.00 C ATOM 1109 CE1 TYR A 71 4.116 6.417 4.885 1.00 0.00 C ATOM 1110 CE2 TYR A 71 5.970 7.902 4.621 1.00 0.00 C ATOM 1111 CZ TYR A 71 5.049 7.265 5.393 1.00 0.00 C ATOM 1112 OH TYR A 71 5.063 7.486 6.735 1.00 0.00 O ATOM 0 H TYR A 71 2.493 5.716 0.148 1.00 0.00 H new ATOM 0 HA TYR A 71 3.771 8.321 0.699 1.00 0.00 H new ATOM 0 HB2 TYR A 71 4.927 5.492 0.962 1.00 0.00 H new ATOM 0 HB3 TYR A 71 5.957 6.889 0.721 1.00 0.00 H new ATOM 0 HD1 TYR A 71 3.370 5.513 3.035 1.00 0.00 H new ATOM 0 HD2 TYR A 71 6.675 8.162 2.564 1.00 0.00 H new ATOM 0 HE1 TYR A 71 3.402 5.930 5.533 1.00 0.00 H new ATOM 0 HE2 TYR A 71 6.696 8.568 5.063 1.00 0.00 H new ATOM 0 HH TYR A 71 5.730 8.172 6.947 1.00 0.00 H new ATOM 1122 N THR A 72 4.893 8.235 -1.554 1.00 0.00 N ATOM 1123 CA THR A 72 5.239 8.328 -2.962 1.00 0.00 C ATOM 1124 C THR A 72 6.748 8.168 -3.152 1.00 0.00 C ATOM 1125 O THR A 72 7.536 8.826 -2.475 1.00 0.00 O ATOM 1126 CB THR A 72 4.696 9.656 -3.495 1.00 0.00 C ATOM 1127 OG1 THR A 72 4.877 10.565 -2.413 1.00 0.00 O ATOM 1128 CG2 THR A 72 3.182 9.626 -3.709 1.00 0.00 C ATOM 0 H THR A 72 5.266 8.986 -0.973 1.00 0.00 H new ATOM 0 HA THR A 72 4.784 7.521 -3.536 1.00 0.00 H new ATOM 0 HB THR A 72 5.190 9.898 -4.436 1.00 0.00 H new ATOM 0 HG1 THR A 72 4.553 11.452 -2.673 1.00 0.00 H new ATOM 0 HG21 THR A 72 2.849 10.592 -4.088 1.00 0.00 H new ATOM 0 HG22 THR A 72 2.932 8.848 -4.430 1.00 0.00 H new ATOM 0 HG23 THR A 72 2.685 9.416 -2.762 1.00 0.00 H new ATOM 1136 N LEU A 73 7.106 7.289 -4.077 1.00 0.00 N ATOM 1137 CA LEU A 73 8.507 7.033 -4.365 1.00 0.00 C ATOM 1138 C LEU A 73 9.059 8.165 -5.234 1.00 0.00 C ATOM 1139 O LEU A 73 8.418 8.581 -6.198 1.00 0.00 O ATOM 1140 CB LEU A 73 8.683 5.644 -4.980 1.00 0.00 C ATOM 1141 CG LEU A 73 10.063 5.339 -5.565 1.00 0.00 C ATOM 1142 CD1 LEU A 73 11.173 5.769 -4.604 1.00 0.00 C ATOM 1143 CD2 LEU A 73 10.181 3.864 -5.954 1.00 0.00 C ATOM 0 H LEU A 73 6.449 6.745 -4.637 1.00 0.00 H new ATOM 0 HA LEU A 73 9.090 7.024 -3.444 1.00 0.00 H new ATOM 0 HB2 LEU A 73 8.462 4.899 -4.215 1.00 0.00 H new ATOM 0 HB3 LEU A 73 7.941 5.521 -5.769 1.00 0.00 H new ATOM 0 HG LEU A 73 10.183 5.923 -6.478 1.00 0.00 H new ATOM 0 HD11 LEU A 73 12.144 5.541 -5.044 1.00 0.00 H new ATOM 0 HD12 LEU A 73 11.100 6.841 -4.421 1.00 0.00 H new ATOM 0 HD13 LEU A 73 11.067 5.232 -3.662 1.00 0.00 H new ATOM 0 HD21 LEU A 73 11.172 3.675 -6.367 1.00 0.00 H new ATOM 0 HD22 LEU A 73 10.031 3.242 -5.072 1.00 0.00 H new ATOM 0 HD23 LEU A 73 9.425 3.623 -6.701 1.00 0.00 H new ATOM 1155 N SER A 74 10.242 8.631 -4.861 1.00 0.00 N ATOM 1156 CA SER A 74 10.887 9.707 -5.594 1.00 0.00 C ATOM 1157 C SER A 74 11.550 9.155 -6.857 1.00 0.00 C ATOM 1158 O SER A 74 12.382 8.252 -6.782 1.00 0.00 O ATOM 1159 CB SER A 74 11.920 10.425 -4.723 1.00 0.00 C ATOM 1160 OG SER A 74 11.347 10.923 -3.517 1.00 0.00 O ATOM 0 H SER A 74 10.770 8.283 -4.061 1.00 0.00 H new ATOM 0 HA SER A 74 10.125 10.432 -5.878 1.00 0.00 H new ATOM 0 HB2 SER A 74 12.732 9.738 -4.482 1.00 0.00 H new ATOM 0 HB3 SER A 74 12.357 11.251 -5.285 1.00 0.00 H new ATOM 0 HG SER A 74 11.234 10.187 -2.880 1.00 0.00 H new ATOM 1166 N GLY A 75 11.157 9.720 -7.989 1.00 0.00 N ATOM 1167 CA GLY A 75 11.703 9.296 -9.267 1.00 0.00 C ATOM 1168 C GLY A 75 13.171 9.706 -9.400 1.00 0.00 C ATOM 1169 O GLY A 75 13.954 9.022 -10.057 1.00 0.00 O ATOM 0 H GLY A 75 10.466 10.468 -8.048 1.00 0.00 H new ATOM 0 HA2 GLY A 75 11.614 8.214 -9.363 1.00 0.00 H new ATOM 0 HA3 GLY A 75 11.124 9.737 -10.078 1.00 0.00 H new ATOM 1173 N GLU A 76 13.500 10.822 -8.766 1.00 0.00 N ATOM 1174 CA GLU A 76 14.859 11.332 -8.805 1.00 0.00 C ATOM 1175 C GLU A 76 15.791 10.424 -7.999 1.00 0.00 C ATOM 1176 O GLU A 76 16.971 10.298 -8.320 1.00 0.00 O ATOM 1177 CB GLU A 76 14.920 12.772 -8.291 1.00 0.00 C ATOM 1178 CG GLU A 76 14.430 12.860 -6.844 1.00 0.00 C ATOM 1179 CD GLU A 76 13.187 13.745 -6.739 1.00 0.00 C ATOM 1180 OE1 GLU A 76 13.232 14.857 -7.308 1.00 0.00 O ATOM 1181 OE2 GLU A 76 12.220 13.291 -6.091 1.00 0.00 O ATOM 0 H GLU A 76 12.848 11.387 -8.222 1.00 0.00 H new ATOM 0 HA GLU A 76 15.194 11.336 -9.842 1.00 0.00 H new ATOM 0 HB2 GLU A 76 15.943 13.142 -8.355 1.00 0.00 H new ATOM 0 HB3 GLU A 76 14.309 13.414 -8.925 1.00 0.00 H new ATOM 0 HG2 GLU A 76 14.202 11.861 -6.472 1.00 0.00 H new ATOM 0 HG3 GLU A 76 15.222 13.262 -6.212 1.00 0.00 H new ATOM 1188 N THR A 77 15.224 9.813 -6.969 1.00 0.00 N ATOM 1189 CA THR A 77 15.988 8.919 -6.116 1.00 0.00 C ATOM 1190 C THR A 77 15.217 7.620 -5.877 1.00 0.00 C ATOM 1191 O THR A 77 14.498 7.149 -6.757 1.00 0.00 O ATOM 1192 CB THR A 77 16.327 9.671 -4.827 1.00 0.00 C ATOM 1193 OG1 THR A 77 15.071 9.815 -4.169 1.00 0.00 O ATOM 1194 CG2 THR A 77 16.777 11.110 -5.089 1.00 0.00 C ATOM 0 H THR A 77 14.244 9.920 -6.706 1.00 0.00 H new ATOM 0 HA THR A 77 16.923 8.621 -6.592 1.00 0.00 H new ATOM 0 HB THR A 77 17.112 9.137 -4.291 1.00 0.00 H new ATOM 0 HG1 THR A 77 15.211 9.843 -3.199 1.00 0.00 H new ATOM 0 HG21 THR A 77 17.005 11.598 -4.141 1.00 0.00 H new ATOM 0 HG22 THR A 77 17.667 11.104 -5.718 1.00 0.00 H new ATOM 0 HG23 THR A 77 15.979 11.654 -5.595 1.00 0.00 H new ATOM 1202 N GLU A 78 15.391 7.077 -4.681 1.00 0.00 N ATOM 1203 CA GLU A 78 14.720 5.842 -4.315 1.00 0.00 C ATOM 1204 C GLU A 78 14.002 6.005 -2.973 1.00 0.00 C ATOM 1205 O GLU A 78 13.445 5.045 -2.443 1.00 0.00 O ATOM 1206 CB GLU A 78 15.708 4.674 -4.270 1.00 0.00 C ATOM 1207 CG GLU A 78 16.441 4.524 -5.604 1.00 0.00 C ATOM 1208 CD GLU A 78 17.275 3.242 -5.631 1.00 0.00 C ATOM 1209 OE1 GLU A 78 18.288 3.209 -4.900 1.00 0.00 O ATOM 1210 OE2 GLU A 78 16.880 2.323 -6.381 1.00 0.00 O ATOM 0 H GLU A 78 15.987 7.470 -3.953 1.00 0.00 H new ATOM 0 HA GLU A 78 13.975 5.616 -5.078 1.00 0.00 H new ATOM 0 HB2 GLU A 78 16.431 4.835 -3.470 1.00 0.00 H new ATOM 0 HB3 GLU A 78 15.176 3.752 -4.038 1.00 0.00 H new ATOM 0 HG2 GLU A 78 15.719 4.509 -6.420 1.00 0.00 H new ATOM 0 HG3 GLU A 78 17.088 5.386 -5.766 1.00 0.00 H new ATOM 1217 N GLU A 79 14.040 7.227 -2.463 1.00 0.00 N ATOM 1218 CA GLU A 79 13.400 7.528 -1.194 1.00 0.00 C ATOM 1219 C GLU A 79 11.887 7.659 -1.380 1.00 0.00 C ATOM 1220 O GLU A 79 11.410 7.850 -2.497 1.00 0.00 O ATOM 1221 CB GLU A 79 13.988 8.795 -0.570 1.00 0.00 C ATOM 1222 CG GLU A 79 15.400 8.541 -0.039 1.00 0.00 C ATOM 1223 CD GLU A 79 16.389 8.333 -1.188 1.00 0.00 C ATOM 1224 OE1 GLU A 79 16.778 9.354 -1.793 1.00 0.00 O ATOM 1225 OE2 GLU A 79 16.733 7.157 -1.434 1.00 0.00 O ATOM 0 H GLU A 79 14.504 8.020 -2.906 1.00 0.00 H new ATOM 0 HA GLU A 79 13.592 6.703 -0.508 1.00 0.00 H new ATOM 0 HB2 GLU A 79 14.013 9.592 -1.313 1.00 0.00 H new ATOM 0 HB3 GLU A 79 13.346 9.136 0.242 1.00 0.00 H new ATOM 0 HG2 GLU A 79 15.720 9.385 0.572 1.00 0.00 H new ATOM 0 HG3 GLU A 79 15.397 7.663 0.607 1.00 0.00 H new ATOM 1232 N LEU A 80 11.175 7.551 -0.268 1.00 0.00 N ATOM 1233 CA LEU A 80 9.726 7.655 -0.294 1.00 0.00 C ATOM 1234 C LEU A 80 9.285 8.809 0.609 1.00 0.00 C ATOM 1235 O LEU A 80 9.697 8.889 1.765 1.00 0.00 O ATOM 1236 CB LEU A 80 9.085 6.313 0.066 1.00 0.00 C ATOM 1237 CG LEU A 80 9.332 5.166 -0.917 1.00 0.00 C ATOM 1238 CD1 LEU A 80 9.894 3.939 -0.197 1.00 0.00 C ATOM 1239 CD2 LEU A 80 8.064 4.838 -1.706 1.00 0.00 C ATOM 0 H LEU A 80 11.575 7.392 0.657 1.00 0.00 H new ATOM 0 HA LEU A 80 9.379 7.887 -1.301 1.00 0.00 H new ATOM 0 HB2 LEU A 80 9.451 6.010 1.047 1.00 0.00 H new ATOM 0 HB3 LEU A 80 8.009 6.460 0.159 1.00 0.00 H new ATOM 0 HG LEU A 80 10.084 5.489 -1.637 1.00 0.00 H new ATOM 0 HD11 LEU A 80 10.060 3.139 -0.918 1.00 0.00 H new ATOM 0 HD12 LEU A 80 10.838 4.199 0.281 1.00 0.00 H new ATOM 0 HD13 LEU A 80 9.184 3.604 0.559 1.00 0.00 H new ATOM 0 HD21 LEU A 80 8.267 4.020 -2.397 1.00 0.00 H new ATOM 0 HD22 LEU A 80 7.273 4.543 -1.017 1.00 0.00 H new ATOM 0 HD23 LEU A 80 7.747 5.717 -2.267 1.00 0.00 H new ATOM 1251 N SER A 81 8.452 9.673 0.047 1.00 0.00 N ATOM 1252 CA SER A 81 7.951 10.818 0.787 1.00 0.00 C ATOM 1253 C SER A 81 6.583 10.494 1.390 1.00 0.00 C ATOM 1254 O SER A 81 5.800 9.753 0.799 1.00 0.00 O ATOM 1255 CB SER A 81 7.856 12.055 -0.110 1.00 0.00 C ATOM 1256 OG SER A 81 7.679 13.250 0.646 1.00 0.00 O ATOM 0 H SER A 81 8.112 9.603 -0.912 1.00 0.00 H new ATOM 0 HA SER A 81 8.653 11.038 1.592 1.00 0.00 H new ATOM 0 HB2 SER A 81 8.761 12.137 -0.711 1.00 0.00 H new ATOM 0 HB3 SER A 81 7.023 11.937 -0.803 1.00 0.00 H new ATOM 0 HG SER A 81 7.625 14.017 0.038 1.00 0.00 H new ATOM 1262 N ARG A 82 6.338 11.065 2.560 1.00 0.00 N ATOM 1263 CA ARG A 82 5.078 10.846 3.250 1.00 0.00 C ATOM 1264 C ARG A 82 3.953 11.621 2.561 1.00 0.00 C ATOM 1265 O ARG A 82 3.854 12.839 2.708 1.00 0.00 O ATOM 1266 CB ARG A 82 5.168 11.284 4.714 1.00 0.00 C ATOM 1267 CG ARG A 82 3.922 10.855 5.492 1.00 0.00 C ATOM 1268 CD ARG A 82 3.962 11.387 6.926 1.00 0.00 C ATOM 1269 NE ARG A 82 2.619 11.862 7.326 1.00 0.00 N ATOM 1270 CZ ARG A 82 2.345 12.432 8.508 1.00 0.00 C ATOM 1271 NH1 ARG A 82 3.319 12.600 9.413 1.00 0.00 N ATOM 1272 NH2 ARG A 82 1.097 12.833 8.786 1.00 0.00 N ATOM 0 H ARG A 82 6.990 11.679 3.048 1.00 0.00 H new ATOM 0 HA ARG A 82 4.862 9.778 3.215 1.00 0.00 H new ATOM 0 HB2 ARG A 82 6.056 10.849 5.174 1.00 0.00 H new ATOM 0 HB3 ARG A 82 5.279 12.367 4.767 1.00 0.00 H new ATOM 0 HG2 ARG A 82 3.029 11.224 4.988 1.00 0.00 H new ATOM 0 HG3 ARG A 82 3.854 9.767 5.505 1.00 0.00 H new ATOM 0 HD2 ARG A 82 4.297 10.602 7.605 1.00 0.00 H new ATOM 0 HD3 ARG A 82 4.682 12.202 7.001 1.00 0.00 H new ATOM 0 HE ARG A 82 1.854 11.749 6.661 1.00 0.00 H new ATOM 0 HH11 ARG A 82 4.269 12.294 9.203 1.00 0.00 H new ATOM 0 HH12 ARG A 82 3.110 13.034 10.312 1.00 0.00 H new ATOM 0 HH21 ARG A 82 0.355 12.705 8.098 1.00 0.00 H new ATOM 0 HH22 ARG A 82 0.889 13.267 9.686 1.00 0.00 H new ATOM 1286 N LEU A 83 3.135 10.885 1.825 1.00 0.00 N ATOM 1287 CA LEU A 83 2.021 11.488 1.113 1.00 0.00 C ATOM 1288 C LEU A 83 0.890 11.783 2.100 1.00 0.00 C ATOM 1289 O LEU A 83 0.509 12.937 2.287 1.00 0.00 O ATOM 1290 CB LEU A 83 1.597 10.607 -0.064 1.00 0.00 C ATOM 1291 CG LEU A 83 0.394 11.100 -0.871 1.00 0.00 C ATOM 1292 CD1 LEU A 83 0.674 12.470 -1.492 1.00 0.00 C ATOM 1293 CD2 LEU A 83 -0.020 10.068 -1.923 1.00 0.00 C ATOM 0 H LEU A 83 3.221 9.876 1.706 1.00 0.00 H new ATOM 0 HA LEU A 83 2.319 12.441 0.676 1.00 0.00 H new ATOM 0 HB2 LEU A 83 2.446 10.505 -0.740 1.00 0.00 H new ATOM 0 HB3 LEU A 83 1.371 9.611 0.316 1.00 0.00 H new ATOM 0 HG LEU A 83 -0.448 11.222 -0.189 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -0.197 12.797 -2.060 1.00 0.00 H new ATOM 0 HD12 LEU A 83 0.884 13.191 -0.702 1.00 0.00 H new ATOM 0 HD13 LEU A 83 1.535 12.399 -2.157 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -0.877 10.443 -2.483 1.00 0.00 H new ATOM 0 HD22 LEU A 83 0.811 9.892 -2.606 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -0.289 9.134 -1.430 1.00 0.00 H new ATOM 1305 N ALA A 84 0.384 10.718 2.706 1.00 0.00 N ATOM 1306 CA ALA A 84 -0.696 10.848 3.669 1.00 0.00 C ATOM 1307 C ALA A 84 -0.495 9.832 4.794 1.00 0.00 C ATOM 1308 O ALA A 84 0.397 8.987 4.721 1.00 0.00 O ATOM 1309 CB ALA A 84 -2.039 10.672 2.957 1.00 0.00 C ATOM 0 H ALA A 84 0.702 9.762 2.548 1.00 0.00 H new ATOM 0 HA ALA A 84 -0.693 11.841 4.118 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -2.849 10.769 3.679 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -2.145 11.436 2.187 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -2.080 9.685 2.497 1.00 0.00 H new ATOM 1315 N GLY A 85 -1.338 9.946 5.810 1.00 0.00 N ATOM 1316 CA GLY A 85 -1.264 9.047 6.949 1.00 0.00 C ATOM 1317 C GLY A 85 -0.200 9.512 7.946 1.00 0.00 C ATOM 1318 O GLY A 85 0.264 10.649 7.878 1.00 0.00 O ATOM 0 H GLY A 85 -2.076 10.648 5.868 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -2.234 8.999 7.443 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -1.031 8.039 6.607 1.00 0.00 H new ATOM 1322 N TYR A 86 0.155 8.608 8.847 1.00 0.00 N ATOM 1323 CA TYR A 86 1.156 8.911 9.856 1.00 0.00 C ATOM 1324 C TYR A 86 2.389 8.020 9.690 1.00 0.00 C ATOM 1325 O TYR A 86 2.290 6.906 9.178 1.00 0.00 O ATOM 1326 CB TYR A 86 0.500 8.608 11.205 1.00 0.00 C ATOM 1327 CG TYR A 86 1.372 8.957 12.413 1.00 0.00 C ATOM 1328 CD1 TYR A 86 1.422 10.256 12.876 1.00 0.00 C ATOM 1329 CD2 TYR A 86 2.108 7.972 13.039 1.00 0.00 C ATOM 1330 CE1 TYR A 86 2.243 10.584 14.013 1.00 0.00 C ATOM 1331 CE2 TYR A 86 2.929 8.300 14.176 1.00 0.00 C ATOM 1332 CZ TYR A 86 2.956 9.590 14.607 1.00 0.00 C ATOM 1333 OH TYR A 86 3.731 9.899 15.681 1.00 0.00 O ATOM 0 H TYR A 86 -0.232 7.666 8.900 1.00 0.00 H new ATOM 0 HA TYR A 86 1.483 9.948 9.773 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -0.437 9.161 11.274 1.00 0.00 H new ATOM 0 HB3 TYR A 86 0.249 7.548 11.245 1.00 0.00 H new ATOM 0 HD1 TYR A 86 0.846 11.027 12.386 1.00 0.00 H new ATOM 0 HD2 TYR A 86 2.068 6.955 12.677 1.00 0.00 H new ATOM 0 HE1 TYR A 86 2.291 11.597 14.385 1.00 0.00 H new ATOM 0 HE2 TYR A 86 3.510 7.539 14.675 1.00 0.00 H new ATOM 0 HH TYR A 86 4.182 9.090 16.003 1.00 0.00 H new ATOM 1343 N GLY A 87 3.522 8.544 10.134 1.00 0.00 N ATOM 1344 CA GLY A 87 4.773 7.810 10.041 1.00 0.00 C ATOM 1345 C GLY A 87 5.958 8.764 9.882 1.00 0.00 C ATOM 1346 O GLY A 87 5.866 9.938 10.236 1.00 0.00 O ATOM 0 H GLY A 87 3.600 9.468 10.559 1.00 0.00 H new ATOM 0 HA2 GLY A 87 4.909 7.201 10.935 1.00 0.00 H new ATOM 0 HA3 GLY A 87 4.736 7.126 9.193 1.00 0.00 H new ATOM 1350 N PRO A 88 7.072 8.209 9.334 1.00 0.00 N ATOM 1351 CA PRO A 88 8.274 8.998 9.123 1.00 0.00 C ATOM 1352 C PRO A 88 8.111 9.937 7.926 1.00 0.00 C ATOM 1353 O PRO A 88 7.683 9.513 6.854 1.00 0.00 O ATOM 1354 CB PRO A 88 9.385 7.978 8.931 1.00 0.00 C ATOM 1355 CG PRO A 88 8.694 6.671 8.578 1.00 0.00 C ATOM 1356 CD PRO A 88 7.217 6.822 8.902 1.00 0.00 C ATOM 0 HA PRO A 88 8.497 9.657 9.962 1.00 0.00 H new ATOM 0 HB2 PRO A 88 10.066 8.287 8.138 1.00 0.00 H new ATOM 0 HB3 PRO A 88 9.980 7.873 9.838 1.00 0.00 H new ATOM 0 HG2 PRO A 88 8.831 6.440 7.522 1.00 0.00 H new ATOM 0 HG3 PRO A 88 9.126 5.846 9.144 1.00 0.00 H new ATOM 0 HD2 PRO A 88 6.597 6.612 8.030 1.00 0.00 H new ATOM 0 HD3 PRO A 88 6.911 6.129 9.686 1.00 0.00 H new ATOM 1364 N ARG A 89 8.462 11.195 8.150 1.00 0.00 N ATOM 1365 CA ARG A 89 8.359 12.198 7.104 1.00 0.00 C ATOM 1366 C ARG A 89 8.760 11.599 5.754 1.00 0.00 C ATOM 1367 O ARG A 89 8.070 11.795 4.754 1.00 0.00 O ATOM 1368 CB ARG A 89 9.254 13.402 7.405 1.00 0.00 C ATOM 1369 CG ARG A 89 8.893 14.591 6.512 1.00 0.00 C ATOM 1370 CD ARG A 89 8.932 15.901 7.300 1.00 0.00 C ATOM 1371 NE ARG A 89 8.814 17.051 6.377 1.00 0.00 N ATOM 1372 CZ ARG A 89 8.395 18.270 6.744 1.00 0.00 C ATOM 1373 NH1 ARG A 89 8.052 18.505 8.018 1.00 0.00 N ATOM 1374 NH2 ARG A 89 8.319 19.254 5.838 1.00 0.00 N ATOM 0 H ARG A 89 8.818 11.542 9.041 1.00 0.00 H new ATOM 0 HA ARG A 89 7.322 12.531 7.065 1.00 0.00 H new ATOM 0 HB2 ARG A 89 9.149 13.684 8.453 1.00 0.00 H new ATOM 0 HB3 ARG A 89 10.298 13.131 7.251 1.00 0.00 H new ATOM 0 HG2 ARG A 89 9.589 14.646 5.675 1.00 0.00 H new ATOM 0 HG3 ARG A 89 7.898 14.445 6.091 1.00 0.00 H new ATOM 0 HD2 ARG A 89 8.119 15.922 8.026 1.00 0.00 H new ATOM 0 HD3 ARG A 89 9.864 15.969 7.862 1.00 0.00 H new ATOM 0 HE ARG A 89 9.068 16.907 5.400 1.00 0.00 H new ATOM 0 HH11 ARG A 89 8.110 17.756 8.708 1.00 0.00 H new ATOM 0 HH12 ARG A 89 7.733 19.433 8.297 1.00 0.00 H new ATOM 0 HH21 ARG A 89 8.580 19.076 4.868 1.00 0.00 H new ATOM 0 HH22 ARG A 89 8.000 20.182 6.118 1.00 0.00 H new ATOM 1388 N THR A 90 9.874 10.882 5.768 1.00 0.00 N ATOM 1389 CA THR A 90 10.375 10.253 4.558 1.00 0.00 C ATOM 1390 C THR A 90 10.891 8.845 4.862 1.00 0.00 C ATOM 1391 O THR A 90 11.016 8.464 6.025 1.00 0.00 O ATOM 1392 CB THR A 90 11.438 11.172 3.953 1.00 0.00 C ATOM 1393 OG1 THR A 90 10.686 12.200 3.314 1.00 0.00 O ATOM 1394 CG2 THR A 90 12.207 10.506 2.810 1.00 0.00 C ATOM 0 H THR A 90 10.444 10.723 6.599 1.00 0.00 H new ATOM 0 HA THR A 90 9.581 10.122 3.823 1.00 0.00 H new ATOM 0 HB THR A 90 12.138 11.478 4.731 1.00 0.00 H new ATOM 0 HG1 THR A 90 11.298 12.841 2.896 1.00 0.00 H new ATOM 0 HG21 THR A 90 12.949 11.201 2.417 1.00 0.00 H new ATOM 0 HG22 THR A 90 12.709 9.612 3.181 1.00 0.00 H new ATOM 0 HG23 THR A 90 11.512 10.229 2.017 1.00 0.00 H new ATOM 1402 N VAL A 91 11.176 8.111 3.796 1.00 0.00 N ATOM 1403 CA VAL A 91 11.675 6.754 3.935 1.00 0.00 C ATOM 1404 C VAL A 91 12.742 6.496 2.869 1.00 0.00 C ATOM 1405 O VAL A 91 12.559 6.848 1.705 1.00 0.00 O ATOM 1406 CB VAL A 91 10.514 5.760 3.871 1.00 0.00 C ATOM 1407 CG1 VAL A 91 11.027 4.325 3.735 1.00 0.00 C ATOM 1408 CG2 VAL A 91 9.602 5.903 5.092 1.00 0.00 C ATOM 0 H VAL A 91 11.071 8.431 2.833 1.00 0.00 H new ATOM 0 HA VAL A 91 12.148 6.619 4.908 1.00 0.00 H new ATOM 0 HB VAL A 91 9.925 5.990 2.983 1.00 0.00 H new ATOM 0 HG11 VAL A 91 10.181 3.639 3.692 1.00 0.00 H new ATOM 0 HG12 VAL A 91 11.615 4.234 2.822 1.00 0.00 H new ATOM 0 HG13 VAL A 91 11.651 4.079 4.594 1.00 0.00 H new ATOM 0 HG21 VAL A 91 8.785 5.185 5.022 1.00 0.00 H new ATOM 0 HG22 VAL A 91 10.176 5.712 5.999 1.00 0.00 H new ATOM 0 HG23 VAL A 91 9.195 6.914 5.126 1.00 0.00 H new ATOM 1418 N THR A 92 13.833 5.883 3.304 1.00 0.00 N ATOM 1419 CA THR A 92 14.928 5.573 2.402 1.00 0.00 C ATOM 1420 C THR A 92 15.069 4.059 2.233 1.00 0.00 C ATOM 1421 O THR A 92 14.468 3.289 2.980 1.00 0.00 O ATOM 1422 CB THR A 92 16.192 6.244 2.944 1.00 0.00 C ATOM 1423 OG1 THR A 92 16.714 5.300 3.874 1.00 0.00 O ATOM 1424 CG2 THR A 92 15.880 7.475 3.798 1.00 0.00 C ATOM 0 H THR A 92 13.982 5.593 4.270 1.00 0.00 H new ATOM 0 HA THR A 92 14.738 5.963 1.402 1.00 0.00 H new ATOM 0 HB THR A 92 16.836 6.532 2.113 1.00 0.00 H new ATOM 0 HG1 THR A 92 17.440 5.713 4.387 1.00 0.00 H new ATOM 0 HG21 THR A 92 16.811 7.914 4.158 1.00 0.00 H new ATOM 0 HG22 THR A 92 15.342 8.208 3.197 1.00 0.00 H new ATOM 0 HG23 THR A 92 15.265 7.181 4.648 1.00 0.00 H new ATOM 1432 N PRO A 93 15.888 3.668 1.220 1.00 0.00 N ATOM 1433 CA PRO A 93 16.116 2.260 0.943 1.00 0.00 C ATOM 1434 C PRO A 93 17.050 1.640 1.984 1.00 0.00 C ATOM 1435 O PRO A 93 17.272 0.430 1.983 1.00 0.00 O ATOM 1436 CB PRO A 93 16.687 2.223 -0.465 1.00 0.00 C ATOM 1437 CG PRO A 93 17.192 3.628 -0.747 1.00 0.00 C ATOM 1438 CD PRO A 93 16.616 4.552 0.314 1.00 0.00 C ATOM 0 HA PRO A 93 15.204 1.667 1.004 1.00 0.00 H new ATOM 0 HB2 PRO A 93 17.495 1.495 -0.540 1.00 0.00 H new ATOM 0 HB3 PRO A 93 15.926 1.929 -1.188 1.00 0.00 H new ATOM 0 HG2 PRO A 93 18.281 3.654 -0.725 1.00 0.00 H new ATOM 0 HG3 PRO A 93 16.886 3.951 -1.742 1.00 0.00 H new ATOM 0 HD2 PRO A 93 17.404 5.094 0.837 1.00 0.00 H new ATOM 0 HD3 PRO A 93 15.955 5.298 -0.127 1.00 0.00 H new ATOM 1446 N ALA A 94 17.572 2.498 2.849 1.00 0.00 N ATOM 1447 CA ALA A 94 18.478 2.051 3.893 1.00 0.00 C ATOM 1448 C ALA A 94 17.666 1.632 5.121 1.00 0.00 C ATOM 1449 O ALA A 94 18.189 0.975 6.020 1.00 0.00 O ATOM 1450 CB ALA A 94 19.482 3.161 4.209 1.00 0.00 C ATOM 0 H ALA A 94 17.384 3.501 2.848 1.00 0.00 H new ATOM 0 HA ALA A 94 19.047 1.183 3.561 1.00 0.00 H new ATOM 0 HB1 ALA A 94 20.161 2.825 4.992 1.00 0.00 H new ATOM 0 HB2 ALA A 94 20.053 3.401 3.312 1.00 0.00 H new ATOM 0 HB3 ALA A 94 18.948 4.049 4.548 1.00 0.00 H new ATOM 1456 N MET A 95 16.403 2.030 5.119 1.00 0.00 N ATOM 1457 CA MET A 95 15.514 1.705 6.221 1.00 0.00 C ATOM 1458 C MET A 95 14.528 0.604 5.824 1.00 0.00 C ATOM 1459 O MET A 95 14.010 -0.109 6.682 1.00 0.00 O ATOM 1460 CB MET A 95 14.740 2.956 6.640 1.00 0.00 C ATOM 1461 CG MET A 95 15.644 3.932 7.396 1.00 0.00 C ATOM 1462 SD MET A 95 14.696 4.815 8.624 1.00 0.00 S ATOM 1463 CE MET A 95 13.291 5.305 7.638 1.00 0.00 C ATOM 0 H MET A 95 15.974 2.575 4.371 1.00 0.00 H new ATOM 0 HA MET A 95 16.117 1.344 7.054 1.00 0.00 H new ATOM 0 HB2 MET A 95 14.328 3.446 5.758 1.00 0.00 H new ATOM 0 HB3 MET A 95 13.897 2.673 7.270 1.00 0.00 H new ATOM 0 HG2 MET A 95 16.459 3.389 7.875 1.00 0.00 H new ATOM 0 HG3 MET A 95 16.097 4.636 6.698 1.00 0.00 H new ATOM 0 HE1 MET A 95 12.846 6.206 8.061 1.00 0.00 H new ATOM 0 HE2 MET A 95 13.615 5.505 6.617 1.00 0.00 H new ATOM 0 HE3 MET A 95 12.552 4.503 7.634 1.00 0.00 H new ATOM 1473 N VAL A 96 14.300 0.499 4.524 1.00 0.00 N ATOM 1474 CA VAL A 96 13.385 -0.503 4.003 1.00 0.00 C ATOM 1475 C VAL A 96 13.862 -1.893 4.429 1.00 0.00 C ATOM 1476 O VAL A 96 15.059 -2.175 4.410 1.00 0.00 O ATOM 1477 CB VAL A 96 13.256 -0.355 2.485 1.00 0.00 C ATOM 1478 CG1 VAL A 96 14.426 -1.030 1.766 1.00 0.00 C ATOM 1479 CG2 VAL A 96 11.917 -0.907 1.993 1.00 0.00 C ATOM 0 H VAL A 96 14.733 1.091 3.815 1.00 0.00 H new ATOM 0 HA VAL A 96 12.387 -0.360 4.416 1.00 0.00 H new ATOM 0 HB VAL A 96 13.287 0.708 2.248 1.00 0.00 H new ATOM 0 HG11 VAL A 96 14.309 -0.910 0.689 1.00 0.00 H new ATOM 0 HG12 VAL A 96 15.362 -0.570 2.083 1.00 0.00 H new ATOM 0 HG13 VAL A 96 14.441 -2.092 2.013 1.00 0.00 H new ATOM 0 HG21 VAL A 96 11.850 -0.790 0.911 1.00 0.00 H new ATOM 0 HG22 VAL A 96 11.843 -1.964 2.249 1.00 0.00 H new ATOM 0 HG23 VAL A 96 11.102 -0.361 2.468 1.00 0.00 H new ATOM 1489 N GLU A 97 12.901 -2.724 4.803 1.00 0.00 N ATOM 1490 CA GLU A 97 13.208 -4.078 5.233 1.00 0.00 C ATOM 1491 C GLU A 97 12.883 -5.075 4.119 1.00 0.00 C ATOM 1492 O GLU A 97 13.682 -5.962 3.823 1.00 0.00 O ATOM 1493 CB GLU A 97 12.456 -4.428 6.519 1.00 0.00 C ATOM 1494 CG GLU A 97 12.806 -5.841 6.991 1.00 0.00 C ATOM 1495 CD GLU A 97 11.922 -6.260 8.167 1.00 0.00 C ATOM 1496 OE1 GLU A 97 11.683 -5.393 9.035 1.00 0.00 O ATOM 1497 OE2 GLU A 97 11.506 -7.439 8.172 1.00 0.00 O ATOM 0 H GLU A 97 11.909 -2.486 4.817 1.00 0.00 H new ATOM 0 HA GLU A 97 14.275 -4.138 5.447 1.00 0.00 H new ATOM 0 HB2 GLU A 97 12.706 -3.708 7.298 1.00 0.00 H new ATOM 0 HB3 GLU A 97 11.382 -4.353 6.348 1.00 0.00 H new ATOM 0 HG2 GLU A 97 12.681 -6.545 6.168 1.00 0.00 H new ATOM 0 HG3 GLU A 97 13.854 -5.880 7.287 1.00 0.00 H new ATOM 1504 N GLY A 98 11.709 -4.896 3.532 1.00 0.00 N ATOM 1505 CA GLY A 98 11.269 -5.769 2.457 1.00 0.00 C ATOM 1506 C GLY A 98 10.310 -5.039 1.515 1.00 0.00 C ATOM 1507 O GLY A 98 9.684 -4.053 1.902 1.00 0.00 O ATOM 0 H GLY A 98 11.049 -4.159 3.780 1.00 0.00 H new ATOM 0 HA2 GLY A 98 12.133 -6.126 1.897 1.00 0.00 H new ATOM 0 HA3 GLY A 98 10.776 -6.646 2.875 1.00 0.00 H new ATOM 1511 N ILE A 99 10.225 -5.550 0.296 1.00 0.00 N ATOM 1512 CA ILE A 99 9.353 -4.959 -0.705 1.00 0.00 C ATOM 1513 C ILE A 99 8.418 -6.035 -1.260 1.00 0.00 C ATOM 1514 O ILE A 99 8.781 -7.209 -1.319 1.00 0.00 O ATOM 1515 CB ILE A 99 10.176 -4.246 -1.779 1.00 0.00 C ATOM 1516 CG1 ILE A 99 11.533 -4.927 -1.973 1.00 0.00 C ATOM 1517 CG2 ILE A 99 10.323 -2.757 -1.459 1.00 0.00 C ATOM 1518 CD1 ILE A 99 12.261 -4.361 -3.194 1.00 0.00 C ATOM 0 H ILE A 99 10.746 -6.367 -0.022 1.00 0.00 H new ATOM 0 HA ILE A 99 8.724 -4.190 -0.256 1.00 0.00 H new ATOM 0 HB ILE A 99 9.640 -4.321 -2.725 1.00 0.00 H new ATOM 0 HG12 ILE A 99 12.145 -4.786 -1.082 1.00 0.00 H new ATOM 0 HG13 ILE A 99 11.391 -6.001 -2.095 1.00 0.00 H new ATOM 0 HG21 ILE A 99 10.912 -2.274 -2.238 1.00 0.00 H new ATOM 0 HG22 ILE A 99 9.336 -2.296 -1.412 1.00 0.00 H new ATOM 0 HG23 ILE A 99 10.825 -2.639 -0.499 1.00 0.00 H new ATOM 0 HD11 ILE A 99 13.222 -4.862 -3.309 1.00 0.00 H new ATOM 0 HD12 ILE A 99 11.657 -4.525 -4.086 1.00 0.00 H new ATOM 0 HD13 ILE A 99 12.423 -3.292 -3.058 1.00 0.00 H new ATOM 1530 N TYR A 100 7.231 -5.597 -1.654 1.00 0.00 N ATOM 1531 CA TYR A 100 6.241 -6.508 -2.203 1.00 0.00 C ATOM 1532 C TYR A 100 5.441 -5.839 -3.322 1.00 0.00 C ATOM 1533 O TYR A 100 5.269 -4.621 -3.325 1.00 0.00 O ATOM 1534 CB TYR A 100 5.295 -6.847 -1.049 1.00 0.00 C ATOM 1535 CG TYR A 100 6.007 -7.301 0.227 1.00 0.00 C ATOM 1536 CD1 TYR A 100 6.606 -6.370 1.051 1.00 0.00 C ATOM 1537 CD2 TYR A 100 6.051 -8.641 0.553 1.00 0.00 C ATOM 1538 CE1 TYR A 100 7.276 -6.797 2.252 1.00 0.00 C ATOM 1539 CE2 TYR A 100 6.721 -9.068 1.753 1.00 0.00 C ATOM 1540 CZ TYR A 100 7.301 -8.125 2.544 1.00 0.00 C ATOM 1541 OH TYR A 100 7.934 -8.529 3.678 1.00 0.00 O ATOM 0 H TYR A 100 6.933 -4.623 -1.604 1.00 0.00 H new ATOM 0 HA TYR A 100 6.723 -7.391 -2.623 1.00 0.00 H new ATOM 0 HB2 TYR A 100 4.687 -5.971 -0.822 1.00 0.00 H new ATOM 0 HB3 TYR A 100 4.613 -7.633 -1.371 1.00 0.00 H new ATOM 0 HD1 TYR A 100 6.572 -5.321 0.795 1.00 0.00 H new ATOM 0 HD2 TYR A 100 5.583 -9.369 -0.092 1.00 0.00 H new ATOM 0 HE1 TYR A 100 7.748 -6.079 2.906 1.00 0.00 H new ATOM 0 HE2 TYR A 100 6.762 -10.114 2.020 1.00 0.00 H new ATOM 0 HH TYR A 100 7.871 -9.504 3.758 1.00 0.00 H new ATOM 1551 N LYS A 101 4.974 -6.665 -4.247 1.00 0.00 N ATOM 1552 CA LYS A 101 4.197 -6.168 -5.370 1.00 0.00 C ATOM 1553 C LYS A 101 2.730 -6.563 -5.184 1.00 0.00 C ATOM 1554 O LYS A 101 2.369 -7.165 -4.173 1.00 0.00 O ATOM 1555 CB LYS A 101 4.799 -6.647 -6.692 1.00 0.00 C ATOM 1556 CG LYS A 101 4.474 -8.121 -6.941 1.00 0.00 C ATOM 1557 CD LYS A 101 5.745 -8.974 -6.918 1.00 0.00 C ATOM 1558 CE LYS A 101 6.596 -8.723 -8.164 1.00 0.00 C ATOM 1559 NZ LYS A 101 7.308 -9.957 -8.563 1.00 0.00 N ATOM 0 H LYS A 101 5.119 -7.675 -4.242 1.00 0.00 H new ATOM 0 HA LYS A 101 4.233 -5.079 -5.406 1.00 0.00 H new ATOM 0 HB2 LYS A 101 4.412 -6.042 -7.512 1.00 0.00 H new ATOM 0 HB3 LYS A 101 5.880 -6.507 -6.675 1.00 0.00 H new ATOM 0 HG2 LYS A 101 3.779 -8.477 -6.181 1.00 0.00 H new ATOM 0 HG3 LYS A 101 3.976 -8.230 -7.905 1.00 0.00 H new ATOM 0 HD2 LYS A 101 6.325 -8.744 -6.024 1.00 0.00 H new ATOM 0 HD3 LYS A 101 5.478 -10.029 -6.862 1.00 0.00 H new ATOM 0 HE2 LYS A 101 5.962 -8.382 -8.982 1.00 0.00 H new ATOM 0 HE3 LYS A 101 7.316 -7.929 -7.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 7.881 -9.769 -9.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 7.928 -10.266 -7.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 6.616 -10.705 -8.772 1.00 0.00 H new ATOM 1573 N TYR A 102 1.925 -6.208 -6.174 1.00 0.00 N ATOM 1574 CA TYR A 102 0.506 -6.518 -6.132 1.00 0.00 C ATOM 1575 C TYR A 102 0.061 -7.227 -7.412 1.00 0.00 C ATOM 1576 O TYR A 102 0.050 -6.627 -8.486 1.00 0.00 O ATOM 1577 CB TYR A 102 -0.217 -5.173 -6.030 1.00 0.00 C ATOM 1578 CG TYR A 102 -1.714 -5.246 -6.339 1.00 0.00 C ATOM 1579 CD1 TYR A 102 -2.155 -5.142 -7.642 1.00 0.00 C ATOM 1580 CD2 TYR A 102 -2.622 -5.416 -5.314 1.00 0.00 C ATOM 1581 CE1 TYR A 102 -3.564 -5.210 -7.933 1.00 0.00 C ATOM 1582 CE2 TYR A 102 -4.031 -5.484 -5.605 1.00 0.00 C ATOM 1583 CZ TYR A 102 -4.432 -5.378 -6.900 1.00 0.00 C ATOM 1584 OH TYR A 102 -5.763 -5.443 -7.175 1.00 0.00 O ATOM 0 H TYR A 102 2.228 -5.709 -7.010 1.00 0.00 H new ATOM 0 HA TYR A 102 0.282 -7.178 -5.294 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -0.083 -4.776 -5.024 1.00 0.00 H new ATOM 0 HB3 TYR A 102 0.251 -4.467 -6.716 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -1.444 -5.010 -8.444 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -2.276 -5.498 -4.294 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -3.923 -5.129 -8.948 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -4.753 -5.616 -4.813 1.00 0.00 H new ATOM 0 HH TYR A 102 -5.894 -5.824 -8.068 1.00 0.00 H new ATOM 1594 N ASN A 103 -0.295 -8.494 -7.257 1.00 0.00 N ATOM 1595 CA ASN A 103 -0.740 -9.290 -8.388 1.00 0.00 C ATOM 1596 C ASN A 103 -2.021 -8.683 -8.962 1.00 0.00 C ATOM 1597 O ASN A 103 -3.106 -8.886 -8.420 1.00 0.00 O ATOM 1598 CB ASN A 103 -1.047 -10.727 -7.962 1.00 0.00 C ATOM 1599 CG ASN A 103 -0.105 -11.717 -8.650 1.00 0.00 C ATOM 1600 OD1 ASN A 103 -0.477 -12.439 -9.560 1.00 0.00 O ATOM 1601 ND2 ASN A 103 1.134 -11.710 -8.165 1.00 0.00 N ATOM 0 H ASN A 103 -0.284 -8.989 -6.365 1.00 0.00 H new ATOM 0 HA ASN A 103 0.058 -9.296 -9.131 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -0.949 -10.818 -6.880 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -2.080 -10.971 -8.210 1.00 0.00 H new ATOM 0 HD21 ASN A 103 1.839 -12.335 -8.557 1.00 0.00 H new ATOM 0 HD22 ASN A 103 1.379 -11.080 -7.401 1.00 0.00 H new ATOM 1608 N SER A 104 -1.853 -7.949 -10.052 1.00 0.00 N ATOM 1609 CA SER A 104 -2.982 -7.310 -10.706 1.00 0.00 C ATOM 1610 C SER A 104 -3.740 -8.331 -11.558 1.00 0.00 C ATOM 1611 O SER A 104 -4.710 -7.986 -12.230 1.00 0.00 O ATOM 1612 CB SER A 104 -2.525 -6.133 -11.570 1.00 0.00 C ATOM 1613 OG SER A 104 -3.238 -4.938 -11.264 1.00 0.00 O ATOM 0 H SER A 104 -0.951 -7.783 -10.499 1.00 0.00 H new ATOM 0 HA SER A 104 -3.649 -6.923 -9.935 1.00 0.00 H new ATOM 0 HB2 SER A 104 -1.458 -5.967 -11.421 1.00 0.00 H new ATOM 0 HB3 SER A 104 -2.665 -6.380 -12.622 1.00 0.00 H new ATOM 0 HG SER A 104 -2.916 -4.210 -11.835 1.00 0.00 H new ATOM 1619 N ASP A 105 -3.267 -9.567 -11.502 1.00 0.00 N ATOM 1620 CA ASP A 105 -3.887 -10.641 -12.260 1.00 0.00 C ATOM 1621 C ASP A 105 -4.488 -11.662 -11.292 1.00 0.00 C ATOM 1622 O ASP A 105 -5.579 -12.179 -11.528 1.00 0.00 O ATOM 1623 CB ASP A 105 -2.860 -11.364 -13.132 1.00 0.00 C ATOM 1624 CG ASP A 105 -3.108 -11.268 -14.639 1.00 0.00 C ATOM 1625 OD1 ASP A 105 -3.971 -12.033 -15.122 1.00 0.00 O ATOM 1626 OD2 ASP A 105 -2.430 -10.432 -15.274 1.00 0.00 O ATOM 0 H ASP A 105 -2.461 -9.849 -10.943 1.00 0.00 H new ATOM 0 HA ASP A 105 -4.656 -10.204 -12.897 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -1.872 -10.958 -12.915 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -2.842 -12.416 -12.848 1.00 0.00 H new ATOM 1631 N ARG A 106 -3.750 -11.922 -10.223 1.00 0.00 N ATOM 1632 CA ARG A 106 -4.196 -12.871 -9.218 1.00 0.00 C ATOM 1633 C ARG A 106 -4.880 -12.139 -8.061 1.00 0.00 C ATOM 1634 O ARG A 106 -5.447 -12.770 -7.171 1.00 0.00 O ATOM 1635 CB ARG A 106 -3.023 -13.689 -8.673 1.00 0.00 C ATOM 1636 CG ARG A 106 -2.493 -14.660 -9.730 1.00 0.00 C ATOM 1637 CD ARG A 106 -2.234 -16.041 -9.125 1.00 0.00 C ATOM 1638 NE ARG A 106 -0.781 -16.242 -8.929 1.00 0.00 N ATOM 1639 CZ ARG A 106 -0.102 -15.820 -7.853 1.00 0.00 C ATOM 1640 NH1 ARG A 106 -0.741 -15.171 -6.870 1.00 0.00 N ATOM 1641 NH2 ARG A 106 1.215 -16.048 -7.760 1.00 0.00 N ATOM 0 H ARG A 106 -2.845 -11.491 -10.031 1.00 0.00 H new ATOM 0 HA ARG A 106 -4.906 -13.547 -9.694 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -2.224 -13.019 -8.356 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -3.341 -14.245 -7.791 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -3.213 -14.745 -10.544 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -1.571 -14.268 -10.159 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -2.754 -16.133 -8.172 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -2.632 -16.815 -9.781 1.00 0.00 H new ATOM 0 HE ARG A 106 -0.264 -16.732 -9.659 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -1.744 -14.998 -6.941 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -0.225 -14.850 -6.051 1.00 0.00 H new ATOM 0 HH21 ARG A 106 1.701 -16.543 -8.508 1.00 0.00 H new ATOM 0 HH22 ARG A 106 1.732 -15.727 -6.941 1.00 0.00 H new ATOM 1655 N LYS A 107 -4.803 -10.817 -8.113 1.00 0.00 N ATOM 1656 CA LYS A 107 -5.407 -9.992 -7.080 1.00 0.00 C ATOM 1657 C LYS A 107 -4.853 -10.404 -5.715 1.00 0.00 C ATOM 1658 O LYS A 107 -5.600 -10.506 -4.743 1.00 0.00 O ATOM 1659 CB LYS A 107 -6.933 -10.055 -7.169 1.00 0.00 C ATOM 1660 CG LYS A 107 -7.413 -9.759 -8.592 1.00 0.00 C ATOM 1661 CD LYS A 107 -8.719 -10.496 -8.894 1.00 0.00 C ATOM 1662 CE LYS A 107 -8.533 -11.496 -10.037 1.00 0.00 C ATOM 1663 NZ LYS A 107 -9.839 -12.045 -10.464 1.00 0.00 N ATOM 0 H LYS A 107 -4.332 -10.297 -8.854 1.00 0.00 H new ATOM 0 HA LYS A 107 -5.145 -8.944 -7.227 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -7.278 -11.043 -6.863 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -7.371 -9.336 -6.477 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -7.560 -8.686 -8.714 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -6.648 -10.059 -9.308 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -9.061 -11.019 -8.001 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -9.494 -9.776 -9.158 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -8.045 -11.007 -10.880 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -7.879 -12.307 -9.716 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -9.694 -12.722 -11.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -10.291 -12.529 -9.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -10.451 -11.270 -10.790 1.00 0.00 H new ATOM 1677 N ARG A 108 -3.548 -10.630 -5.685 1.00 0.00 N ATOM 1678 CA ARG A 108 -2.885 -11.029 -4.455 1.00 0.00 C ATOM 1679 C ARG A 108 -1.623 -10.193 -4.238 1.00 0.00 C ATOM 1680 O ARG A 108 -1.310 -9.313 -5.039 1.00 0.00 O ATOM 1681 CB ARG A 108 -2.508 -12.511 -4.488 1.00 0.00 C ATOM 1682 CG ARG A 108 -3.753 -13.396 -4.405 1.00 0.00 C ATOM 1683 CD ARG A 108 -3.669 -14.350 -3.211 1.00 0.00 C ATOM 1684 NE ARG A 108 -4.635 -15.459 -3.380 1.00 0.00 N ATOM 1685 CZ ARG A 108 -5.940 -15.368 -3.091 1.00 0.00 C ATOM 1686 NH1 ARG A 108 -6.443 -14.220 -2.618 1.00 0.00 N ATOM 1687 NH2 ARG A 108 -6.742 -16.426 -3.276 1.00 0.00 N ATOM 0 H ARG A 108 -2.932 -10.544 -6.493 1.00 0.00 H new ATOM 0 HA ARG A 108 -3.581 -10.862 -3.633 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -1.962 -12.731 -5.406 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -1.840 -12.738 -3.657 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -4.642 -12.772 -4.314 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -3.858 -13.969 -5.326 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -2.658 -14.748 -3.123 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -3.880 -13.810 -2.288 1.00 0.00 H new ATOM 0 HE ARG A 108 -4.285 -16.348 -3.739 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -5.832 -13.415 -2.478 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -7.437 -14.151 -2.398 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -6.359 -17.300 -3.637 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -7.736 -16.357 -3.056 1.00 0.00 H new ATOM 1701 N PHE A 109 -0.930 -10.497 -3.150 1.00 0.00 N ATOM 1702 CA PHE A 109 0.292 -9.784 -2.817 1.00 0.00 C ATOM 1703 C PHE A 109 1.507 -10.710 -2.902 1.00 0.00 C ATOM 1704 O PHE A 109 1.452 -11.855 -2.454 1.00 0.00 O ATOM 1705 CB PHE A 109 0.142 -9.289 -1.377 1.00 0.00 C ATOM 1706 CG PHE A 109 -0.543 -7.927 -1.255 1.00 0.00 C ATOM 1707 CD1 PHE A 109 0.018 -6.830 -1.831 1.00 0.00 C ATOM 1708 CD2 PHE A 109 -1.713 -7.813 -0.572 1.00 0.00 C ATOM 1709 CE1 PHE A 109 -0.618 -5.565 -1.718 1.00 0.00 C ATOM 1710 CE2 PHE A 109 -2.349 -6.548 -0.459 1.00 0.00 C ATOM 1711 CZ PHE A 109 -1.788 -5.451 -1.034 1.00 0.00 C ATOM 0 H PHE A 109 -1.191 -11.227 -2.488 1.00 0.00 H new ATOM 0 HA PHE A 109 0.446 -8.962 -3.516 1.00 0.00 H new ATOM 0 HB2 PHE A 109 -0.429 -10.023 -0.809 1.00 0.00 H new ATOM 0 HB3 PHE A 109 1.130 -9.230 -0.919 1.00 0.00 H new ATOM 0 HD1 PHE A 109 0.947 -6.921 -2.374 1.00 0.00 H new ATOM 0 HD2 PHE A 109 -2.159 -8.684 -0.115 1.00 0.00 H new ATOM 0 HE1 PHE A 109 -0.173 -4.694 -2.175 1.00 0.00 H new ATOM 0 HE2 PHE A 109 -3.278 -6.457 0.084 1.00 0.00 H new ATOM 0 HZ PHE A 109 -2.271 -4.489 -0.948 1.00 0.00 H new ATOM 1721 N THR A 110 2.575 -10.181 -3.480 1.00 0.00 N ATOM 1722 CA THR A 110 3.801 -10.945 -3.629 1.00 0.00 C ATOM 1723 C THR A 110 5.001 -10.130 -3.142 1.00 0.00 C ATOM 1724 O THR A 110 4.948 -8.902 -3.106 1.00 0.00 O ATOM 1725 CB THR A 110 3.914 -11.377 -5.093 1.00 0.00 C ATOM 1726 OG1 THR A 110 2.798 -12.242 -5.287 1.00 0.00 O ATOM 1727 CG2 THR A 110 5.128 -12.272 -5.347 1.00 0.00 C ATOM 0 H THR A 110 2.616 -9.232 -3.851 1.00 0.00 H new ATOM 0 HA THR A 110 3.785 -11.842 -3.010 1.00 0.00 H new ATOM 0 HB THR A 110 3.975 -10.493 -5.728 1.00 0.00 H new ATOM 0 HG1 THR A 110 2.793 -12.567 -6.211 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.161 -12.550 -6.400 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.039 -11.733 -5.085 1.00 0.00 H new ATOM 0 HG23 THR A 110 5.051 -13.172 -4.737 1.00 0.00 H new ATOM 1735 N GLN A 111 6.055 -10.846 -2.780 1.00 0.00 N ATOM 1736 CA GLN A 111 7.265 -10.205 -2.296 1.00 0.00 C ATOM 1737 C GLN A 111 8.286 -10.074 -3.429 1.00 0.00 C ATOM 1738 O GLN A 111 8.263 -10.851 -4.382 1.00 0.00 O ATOM 1739 CB GLN A 111 7.857 -10.971 -1.111 1.00 0.00 C ATOM 1740 CG GLN A 111 9.263 -10.468 -0.779 1.00 0.00 C ATOM 1741 CD GLN A 111 9.789 -11.118 0.502 1.00 0.00 C ATOM 1742 OE1 GLN A 111 9.699 -12.318 0.702 1.00 0.00 O ATOM 1743 NE2 GLN A 111 10.342 -10.261 1.356 1.00 0.00 N ATOM 0 H GLN A 111 6.096 -11.865 -2.812 1.00 0.00 H new ATOM 0 HA GLN A 111 7.007 -9.205 -1.947 1.00 0.00 H new ATOM 0 HB2 GLN A 111 7.211 -10.856 -0.240 1.00 0.00 H new ATOM 0 HB3 GLN A 111 7.893 -12.035 -1.343 1.00 0.00 H new ATOM 0 HG2 GLN A 111 9.937 -10.689 -1.607 1.00 0.00 H new ATOM 0 HG3 GLN A 111 9.247 -9.384 -0.661 1.00 0.00 H new ATOM 0 HE21 GLN A 111 10.385 -9.268 1.126 1.00 0.00 H new ATOM 0 HE22 GLN A 111 10.723 -10.597 2.241 1.00 0.00 H new ATOM 1752 N ILE A 112 9.157 -9.086 -3.287 1.00 0.00 N ATOM 1753 CA ILE A 112 10.183 -8.844 -4.286 1.00 0.00 C ATOM 1754 C ILE A 112 11.488 -9.509 -3.843 1.00 0.00 C ATOM 1755 O ILE A 112 11.823 -9.498 -2.659 1.00 0.00 O ATOM 1756 CB ILE A 112 10.320 -7.345 -4.562 1.00 0.00 C ATOM 1757 CG1 ILE A 112 8.975 -6.633 -4.402 1.00 0.00 C ATOM 1758 CG2 ILE A 112 10.941 -7.095 -5.937 1.00 0.00 C ATOM 1759 CD1 ILE A 112 8.033 -6.974 -5.559 1.00 0.00 C ATOM 0 H ILE A 112 9.173 -8.444 -2.495 1.00 0.00 H new ATOM 0 HA ILE A 112 9.901 -9.296 -5.237 1.00 0.00 H new ATOM 0 HB ILE A 112 10.998 -6.922 -3.821 1.00 0.00 H new ATOM 0 HG12 ILE A 112 8.516 -6.923 -3.457 1.00 0.00 H new ATOM 0 HG13 ILE A 112 9.132 -5.555 -4.362 1.00 0.00 H new ATOM 0 HG21 ILE A 112 11.027 -6.022 -6.108 1.00 0.00 H new ATOM 0 HG22 ILE A 112 11.931 -7.549 -5.977 1.00 0.00 H new ATOM 0 HG23 ILE A 112 10.308 -7.535 -6.708 1.00 0.00 H new ATOM 0 HD11 ILE A 112 7.084 -6.455 -5.421 1.00 0.00 H new ATOM 0 HD12 ILE A 112 8.484 -6.660 -6.500 1.00 0.00 H new ATOM 0 HD13 ILE A 112 7.858 -8.050 -5.581 1.00 0.00 H new ATOM 1771 N PRO A 113 12.207 -10.087 -4.842 1.00 0.00 N ATOM 1772 CA PRO A 113 13.467 -10.755 -4.567 1.00 0.00 C ATOM 1773 C PRO A 113 14.581 -9.740 -4.306 1.00 0.00 C ATOM 1774 O PRO A 113 15.701 -10.116 -3.963 1.00 0.00 O ATOM 1775 CB PRO A 113 13.728 -11.622 -5.789 1.00 0.00 C ATOM 1776 CG PRO A 113 12.851 -11.058 -6.894 1.00 0.00 C ATOM 1777 CD PRO A 113 11.841 -10.119 -6.255 1.00 0.00 C ATOM 0 HA PRO A 113 13.431 -11.363 -3.663 1.00 0.00 H new ATOM 0 HB2 PRO A 113 14.780 -11.592 -6.072 1.00 0.00 H new ATOM 0 HB3 PRO A 113 13.481 -12.665 -5.588 1.00 0.00 H new ATOM 0 HG2 PRO A 113 13.456 -10.525 -7.627 1.00 0.00 H new ATOM 0 HG3 PRO A 113 12.342 -11.862 -7.425 1.00 0.00 H new ATOM 0 HD2 PRO A 113 11.889 -9.125 -6.699 1.00 0.00 H new ATOM 0 HD3 PRO A 113 10.822 -10.481 -6.392 1.00 0.00 H new ATOM 1785 N ALA A 114 14.235 -8.472 -4.478 1.00 0.00 N ATOM 1786 CA ALA A 114 15.192 -7.400 -4.265 1.00 0.00 C ATOM 1787 C ALA A 114 14.771 -6.582 -3.042 1.00 0.00 C ATOM 1788 O ALA A 114 13.603 -6.591 -2.657 1.00 0.00 O ATOM 1789 CB ALA A 114 15.292 -6.546 -5.531 1.00 0.00 C ATOM 0 H ALA A 114 13.305 -8.164 -4.762 1.00 0.00 H new ATOM 0 HA ALA A 114 16.184 -7.805 -4.065 1.00 0.00 H new ATOM 0 HB1 ALA A 114 16.010 -5.742 -5.371 1.00 0.00 H new ATOM 0 HB2 ALA A 114 15.622 -7.167 -6.364 1.00 0.00 H new ATOM 0 HB3 ALA A 114 14.315 -6.120 -5.761 1.00 0.00 H new ATOM 1795 N LYS A 115 15.746 -5.896 -2.465 1.00 0.00 N ATOM 1796 CA LYS A 115 15.492 -5.075 -1.294 1.00 0.00 C ATOM 1797 C LYS A 115 15.563 -3.598 -1.686 1.00 0.00 C ATOM 1798 O LYS A 115 15.449 -2.719 -0.833 1.00 0.00 O ATOM 1799 CB LYS A 115 16.442 -5.455 -0.156 1.00 0.00 C ATOM 1800 CG LYS A 115 15.698 -6.196 0.956 1.00 0.00 C ATOM 1801 CD LYS A 115 15.439 -7.653 0.565 1.00 0.00 C ATOM 1802 CE LYS A 115 16.669 -8.520 0.836 1.00 0.00 C ATOM 1803 NZ LYS A 115 16.572 -9.802 0.102 1.00 0.00 N ATOM 0 H LYS A 115 16.714 -5.892 -2.787 1.00 0.00 H new ATOM 0 HA LYS A 115 14.487 -5.256 -0.913 1.00 0.00 H new ATOM 0 HB2 LYS A 115 17.245 -6.083 -0.542 1.00 0.00 H new ATOM 0 HB3 LYS A 115 16.907 -4.556 0.249 1.00 0.00 H new ATOM 0 HG2 LYS A 115 16.282 -6.161 1.876 1.00 0.00 H new ATOM 0 HG3 LYS A 115 14.751 -5.697 1.160 1.00 0.00 H new ATOM 0 HD2 LYS A 115 14.588 -8.038 1.126 1.00 0.00 H new ATOM 0 HD3 LYS A 115 15.176 -7.709 -0.491 1.00 0.00 H new ATOM 0 HE2 LYS A 115 17.570 -7.988 0.532 1.00 0.00 H new ATOM 0 HE3 LYS A 115 16.757 -8.712 1.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 17.415 -10.378 0.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 15.722 -10.316 0.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 16.510 -9.614 -0.919 1.00 0.00 H new ATOM 1817 N THR A 116 15.749 -3.370 -2.978 1.00 0.00 N ATOM 1818 CA THR A 116 15.836 -2.015 -3.494 1.00 0.00 C ATOM 1819 C THR A 116 14.507 -1.599 -4.128 1.00 0.00 C ATOM 1820 O THR A 116 13.647 -2.440 -4.383 1.00 0.00 O ATOM 1821 CB THR A 116 17.018 -1.953 -4.464 1.00 0.00 C ATOM 1822 OG1 THR A 116 18.103 -2.509 -3.726 1.00 0.00 O ATOM 1823 CG2 THR A 116 17.462 -0.518 -4.755 1.00 0.00 C ATOM 0 H THR A 116 15.842 -4.101 -3.683 1.00 0.00 H new ATOM 0 HA THR A 116 16.016 -1.298 -2.693 1.00 0.00 H new ATOM 0 HB THR A 116 16.747 -2.446 -5.398 1.00 0.00 H new ATOM 0 HG1 THR A 116 18.910 -2.509 -4.281 1.00 0.00 H new ATOM 0 HG21 THR A 116 18.303 -0.531 -5.448 1.00 0.00 H new ATOM 0 HG22 THR A 116 16.635 0.036 -5.199 1.00 0.00 H new ATOM 0 HG23 THR A 116 17.765 -0.035 -3.826 1.00 0.00 H new ATOM 1831 N MET A 117 14.381 -0.301 -4.364 1.00 0.00 N ATOM 1832 CA MET A 117 13.171 0.236 -4.963 1.00 0.00 C ATOM 1833 C MET A 117 13.135 -0.041 -6.467 1.00 0.00 C ATOM 1834 O MET A 117 13.966 0.470 -7.216 1.00 0.00 O ATOM 1835 CB MET A 117 13.108 1.745 -4.720 1.00 0.00 C ATOM 1836 CG MET A 117 12.150 2.076 -3.574 1.00 0.00 C ATOM 1837 SD MET A 117 12.811 1.469 -2.031 1.00 0.00 S ATOM 1838 CE MET A 117 11.399 0.561 -1.425 1.00 0.00 C ATOM 0 H MET A 117 15.097 0.394 -4.151 1.00 0.00 H new ATOM 0 HA MET A 117 12.312 -0.251 -4.502 1.00 0.00 H new ATOM 0 HB2 MET A 117 14.104 2.121 -4.486 1.00 0.00 H new ATOM 0 HB3 MET A 117 12.782 2.250 -5.629 1.00 0.00 H new ATOM 0 HG2 MET A 117 11.999 3.154 -3.515 1.00 0.00 H new ATOM 0 HG3 MET A 117 11.175 1.627 -3.763 1.00 0.00 H new ATOM 0 HE1 MET A 117 11.007 1.051 -0.534 1.00 0.00 H new ATOM 0 HE2 MET A 117 10.627 0.534 -2.194 1.00 0.00 H new ATOM 0 HE3 MET A 117 11.700 -0.457 -1.177 1.00 0.00 H new ATOM 1848 N SER A 118 12.163 -0.849 -6.864 1.00 0.00 N ATOM 1849 CA SER A 118 12.007 -1.200 -8.266 1.00 0.00 C ATOM 1850 C SER A 118 10.612 -0.803 -8.753 1.00 0.00 C ATOM 1851 O SER A 118 9.695 -0.637 -7.951 1.00 0.00 O ATOM 1852 CB SER A 118 12.241 -2.696 -8.488 1.00 0.00 C ATOM 1853 OG SER A 118 12.479 -3.000 -9.860 1.00 0.00 O ATOM 0 H SER A 118 11.476 -1.271 -6.240 1.00 0.00 H new ATOM 0 HA SER A 118 12.754 -0.653 -8.841 1.00 0.00 H new ATOM 0 HB2 SER A 118 13.093 -3.023 -7.891 1.00 0.00 H new ATOM 0 HB3 SER A 118 11.373 -3.255 -8.138 1.00 0.00 H new ATOM 0 HG SER A 118 12.625 -3.964 -9.961 1.00 0.00 H new ATOM 1859 N MET A 119 10.497 -0.661 -10.065 1.00 0.00 N ATOM 1860 CA MET A 119 9.229 -0.286 -10.668 1.00 0.00 C ATOM 1861 C MET A 119 8.278 -1.483 -10.735 1.00 0.00 C ATOM 1862 O MET A 119 7.742 -1.796 -11.797 1.00 0.00 O ATOM 1863 CB MET A 119 9.474 0.250 -12.080 1.00 0.00 C ATOM 1864 CG MET A 119 9.997 1.688 -12.037 1.00 0.00 C ATOM 1865 SD MET A 119 8.631 2.836 -12.074 1.00 0.00 S ATOM 1866 CE MET A 119 8.160 2.813 -10.352 1.00 0.00 C ATOM 0 H MET A 119 11.260 -0.799 -10.727 1.00 0.00 H new ATOM 0 HA MET A 119 8.769 0.486 -10.051 1.00 0.00 H new ATOM 0 HB2 MET A 119 10.193 -0.387 -12.595 1.00 0.00 H new ATOM 0 HB3 MET A 119 8.547 0.213 -12.653 1.00 0.00 H new ATOM 0 HG2 MET A 119 10.588 1.842 -11.134 1.00 0.00 H new ATOM 0 HG3 MET A 119 10.658 1.869 -12.885 1.00 0.00 H new ATOM 0 HE1 MET A 119 8.008 3.834 -10.003 1.00 0.00 H new ATOM 0 HE2 MET A 119 7.235 2.248 -10.235 1.00 0.00 H new ATOM 0 HE3 MET A 119 8.949 2.343 -9.765 1.00 0.00 H new ATOM 1876 N SER A 120 8.099 -2.121 -9.587 1.00 0.00 N ATOM 1877 CA SER A 120 7.222 -3.276 -9.502 1.00 0.00 C ATOM 1878 C SER A 120 6.892 -3.576 -8.038 1.00 0.00 C ATOM 1879 O SER A 120 6.651 -4.726 -7.676 1.00 0.00 O ATOM 1880 CB SER A 120 7.859 -4.500 -10.164 1.00 0.00 C ATOM 1881 OG SER A 120 7.262 -4.797 -11.423 1.00 0.00 O ATOM 0 H SER A 120 8.547 -1.860 -8.708 1.00 0.00 H new ATOM 0 HA SER A 120 6.300 -3.046 -10.036 1.00 0.00 H new ATOM 0 HB2 SER A 120 8.926 -4.324 -10.301 1.00 0.00 H new ATOM 0 HB3 SER A 120 7.761 -5.362 -9.504 1.00 0.00 H new ATOM 0 HG SER A 120 7.192 -3.976 -11.954 1.00 0.00 H new ATOM 1887 N VAL A 121 6.892 -2.521 -7.237 1.00 0.00 N ATOM 1888 CA VAL A 121 6.596 -2.656 -5.821 1.00 0.00 C ATOM 1889 C VAL A 121 5.269 -1.960 -5.513 1.00 0.00 C ATOM 1890 O VAL A 121 5.008 -0.866 -6.011 1.00 0.00 O ATOM 1891 CB VAL A 121 7.761 -2.118 -4.989 1.00 0.00 C ATOM 1892 CG1 VAL A 121 7.495 -2.297 -3.493 1.00 0.00 C ATOM 1893 CG2 VAL A 121 9.078 -2.782 -5.395 1.00 0.00 C ATOM 0 H VAL A 121 7.092 -1.568 -7.542 1.00 0.00 H new ATOM 0 HA VAL A 121 6.482 -3.706 -5.553 1.00 0.00 H new ATOM 0 HB VAL A 121 7.849 -1.050 -5.188 1.00 0.00 H new ATOM 0 HG11 VAL A 121 8.339 -1.906 -2.924 1.00 0.00 H new ATOM 0 HG12 VAL A 121 6.590 -1.756 -3.217 1.00 0.00 H new ATOM 0 HG13 VAL A 121 7.367 -3.356 -3.270 1.00 0.00 H new ATOM 0 HG21 VAL A 121 9.890 -2.381 -4.788 1.00 0.00 H new ATOM 0 HG22 VAL A 121 9.006 -3.858 -5.240 1.00 0.00 H new ATOM 0 HG23 VAL A 121 9.278 -2.580 -6.447 1.00 0.00 H new ATOM 1903 N ASP A 122 4.465 -2.623 -4.695 1.00 0.00 N ATOM 1904 CA ASP A 122 3.172 -2.081 -4.315 1.00 0.00 C ATOM 1905 C ASP A 122 3.029 -2.134 -2.792 1.00 0.00 C ATOM 1906 O ASP A 122 1.948 -1.889 -2.258 1.00 0.00 O ATOM 1907 CB ASP A 122 2.031 -2.899 -4.925 1.00 0.00 C ATOM 1908 CG ASP A 122 1.662 -2.522 -6.361 1.00 0.00 C ATOM 1909 OD1 ASP A 122 2.384 -2.982 -7.272 1.00 0.00 O ATOM 1910 OD2 ASP A 122 0.666 -1.783 -6.515 1.00 0.00 O ATOM 0 H ASP A 122 4.684 -3.531 -4.285 1.00 0.00 H new ATOM 0 HA ASP A 122 3.116 -1.055 -4.680 1.00 0.00 H new ATOM 0 HB2 ASP A 122 2.307 -3.953 -4.901 1.00 0.00 H new ATOM 0 HB3 ASP A 122 1.147 -2.787 -4.297 1.00 0.00 H new ATOM 1915 N ALA A 123 4.135 -2.454 -2.137 1.00 0.00 N ATOM 1916 CA ALA A 123 4.147 -2.542 -0.686 1.00 0.00 C ATOM 1917 C ALA A 123 5.594 -2.619 -0.196 1.00 0.00 C ATOM 1918 O ALA A 123 6.468 -3.113 -0.906 1.00 0.00 O ATOM 1919 CB ALA A 123 3.315 -3.746 -0.241 1.00 0.00 C ATOM 0 H ALA A 123 5.029 -2.656 -2.584 1.00 0.00 H new ATOM 0 HA ALA A 123 3.697 -1.653 -0.244 1.00 0.00 H new ATOM 0 HB1 ALA A 123 3.324 -3.812 0.847 1.00 0.00 H new ATOM 0 HB2 ALA A 123 2.289 -3.628 -0.589 1.00 0.00 H new ATOM 0 HB3 ALA A 123 3.739 -4.657 -0.663 1.00 0.00 H new ATOM 1925 N PHE A 124 5.802 -2.123 1.015 1.00 0.00 N ATOM 1926 CA PHE A 124 7.128 -2.130 1.608 1.00 0.00 C ATOM 1927 C PHE A 124 7.049 -1.977 3.129 1.00 0.00 C ATOM 1928 O PHE A 124 6.123 -1.356 3.646 1.00 0.00 O ATOM 1929 CB PHE A 124 7.885 -0.934 1.026 1.00 0.00 C ATOM 1930 CG PHE A 124 7.435 0.418 1.583 1.00 0.00 C ATOM 1931 CD1 PHE A 124 6.144 0.820 1.433 1.00 0.00 C ATOM 1932 CD2 PHE A 124 8.325 1.218 2.229 1.00 0.00 C ATOM 1933 CE1 PHE A 124 5.726 2.075 1.950 1.00 0.00 C ATOM 1934 CE2 PHE A 124 7.908 2.473 2.745 1.00 0.00 C ATOM 1935 CZ PHE A 124 6.617 2.875 2.595 1.00 0.00 C ATOM 0 H PHE A 124 5.074 -1.714 1.601 1.00 0.00 H new ATOM 0 HA PHE A 124 7.628 -3.074 1.390 1.00 0.00 H new ATOM 0 HB2 PHE A 124 8.950 -1.060 1.223 1.00 0.00 H new ATOM 0 HB3 PHE A 124 7.759 -0.929 -0.057 1.00 0.00 H new ATOM 0 HD1 PHE A 124 5.437 0.185 0.921 1.00 0.00 H new ATOM 0 HD2 PHE A 124 9.350 0.898 2.350 1.00 0.00 H new ATOM 0 HE1 PHE A 124 4.701 2.394 1.831 1.00 0.00 H new ATOM 0 HE2 PHE A 124 8.616 3.109 3.257 1.00 0.00 H new ATOM 0 HZ PHE A 124 6.300 3.830 2.988 1.00 0.00 H new ATOM 1945 N THR A 125 8.034 -2.555 3.801 1.00 0.00 N ATOM 1946 CA THR A 125 8.088 -2.491 5.252 1.00 0.00 C ATOM 1947 C THR A 125 9.458 -1.990 5.713 1.00 0.00 C ATOM 1948 O THR A 125 10.482 -2.594 5.396 1.00 0.00 O ATOM 1949 CB THR A 125 7.730 -3.874 5.799 1.00 0.00 C ATOM 1950 OG1 THR A 125 8.430 -4.776 4.948 1.00 0.00 O ATOM 1951 CG2 THR A 125 6.256 -4.226 5.584 1.00 0.00 C ATOM 0 H THR A 125 8.801 -3.070 3.368 1.00 0.00 H new ATOM 0 HA THR A 125 7.367 -1.774 5.644 1.00 0.00 H new ATOM 0 HB THR A 125 7.961 -3.914 6.864 1.00 0.00 H new ATOM 0 HG1 THR A 125 9.329 -4.428 4.772 1.00 0.00 H new ATOM 0 HG21 THR A 125 6.056 -5.217 5.990 1.00 0.00 H new ATOM 0 HG22 THR A 125 5.629 -3.492 6.091 1.00 0.00 H new ATOM 0 HG23 THR A 125 6.032 -4.219 4.517 1.00 0.00 H new ATOM 1959 N ILE A 126 9.433 -0.893 6.455 1.00 0.00 N ATOM 1960 CA ILE A 126 10.660 -0.305 6.963 1.00 0.00 C ATOM 1961 C ILE A 126 11.231 -1.199 8.065 1.00 0.00 C ATOM 1962 O ILE A 126 10.612 -2.191 8.447 1.00 0.00 O ATOM 1963 CB ILE A 126 10.419 1.140 7.406 1.00 0.00 C ATOM 1964 CG1 ILE A 126 9.507 1.191 8.634 1.00 0.00 C ATOM 1965 CG2 ILE A 126 9.874 1.984 6.252 1.00 0.00 C ATOM 1966 CD1 ILE A 126 9.313 2.631 9.113 1.00 0.00 C ATOM 0 H ILE A 126 8.582 -0.396 6.717 1.00 0.00 H new ATOM 0 HA ILE A 126 11.411 -0.251 6.175 1.00 0.00 H new ATOM 0 HB ILE A 126 11.376 1.573 7.697 1.00 0.00 H new ATOM 0 HG12 ILE A 126 8.540 0.751 8.392 1.00 0.00 H new ATOM 0 HG13 ILE A 126 9.938 0.592 9.436 1.00 0.00 H new ATOM 0 HG21 ILE A 126 9.712 3.006 6.594 1.00 0.00 H new ATOM 0 HG22 ILE A 126 10.592 1.985 5.432 1.00 0.00 H new ATOM 0 HG23 ILE A 126 8.930 1.562 5.907 1.00 0.00 H new ATOM 0 HD11 ILE A 126 8.661 2.639 9.986 1.00 0.00 H new ATOM 0 HD12 ILE A 126 10.280 3.060 9.378 1.00 0.00 H new ATOM 0 HD13 ILE A 126 8.860 3.221 8.317 1.00 0.00 H new ATOM 1978 N GLN A 127 12.405 -0.816 8.545 1.00 0.00 N ATOM 1979 CA GLN A 127 13.066 -1.571 9.596 1.00 0.00 C ATOM 1980 C GLN A 127 12.254 -1.502 10.891 1.00 0.00 C ATOM 1981 O GLN A 127 11.154 -0.951 10.909 1.00 0.00 O ATOM 1982 CB GLN A 127 14.494 -1.068 9.817 1.00 0.00 C ATOM 1983 CG GLN A 127 15.479 -1.791 8.897 1.00 0.00 C ATOM 1984 CD GLN A 127 16.579 -2.482 9.705 1.00 0.00 C ATOM 1985 OE1 GLN A 127 16.341 -3.414 10.456 1.00 0.00 O ATOM 1986 NE2 GLN A 127 17.793 -1.975 9.511 1.00 0.00 N ATOM 0 H GLN A 127 12.916 0.007 8.226 1.00 0.00 H new ATOM 0 HA GLN A 127 13.127 -2.614 9.284 1.00 0.00 H new ATOM 0 HB2 GLN A 127 14.538 0.005 9.631 1.00 0.00 H new ATOM 0 HB3 GLN A 127 14.781 -1.223 10.857 1.00 0.00 H new ATOM 0 HG2 GLN A 127 14.947 -2.528 8.296 1.00 0.00 H new ATOM 0 HG3 GLN A 127 15.925 -1.078 8.204 1.00 0.00 H new ATOM 0 HE21 GLN A 127 17.923 -1.194 8.868 1.00 0.00 H new ATOM 0 HE22 GLN A 127 18.594 -2.367 10.005 1.00 0.00 H new ATOM 1995 N GLY A 128 12.826 -2.070 11.942 1.00 0.00 N ATOM 1996 CA GLY A 128 12.169 -2.080 13.238 1.00 0.00 C ATOM 1997 C GLY A 128 12.675 -0.936 14.118 1.00 0.00 C ATOM 1998 O GLY A 128 11.884 -0.143 14.627 1.00 0.00 O ATOM 0 H GLY A 128 13.738 -2.527 11.923 1.00 0.00 H new ATOM 0 HA2 GLY A 128 11.091 -1.991 13.104 1.00 0.00 H new ATOM 0 HA3 GLY A 128 12.351 -3.033 13.734 1.00 0.00 H new ATOM 2002 N HIS A 129 13.990 -0.886 14.270 1.00 0.00 N ATOM 2003 CA HIS A 129 14.611 0.148 15.080 1.00 0.00 C ATOM 2004 C HIS A 129 13.900 1.482 14.843 1.00 0.00 C ATOM 2005 O HIS A 129 13.847 2.328 15.734 1.00 0.00 O ATOM 2006 CB HIS A 129 16.115 0.221 14.809 1.00 0.00 C ATOM 2007 CG HIS A 129 16.473 0.255 13.342 1.00 0.00 C ATOM 2008 ND1 HIS A 129 16.896 1.405 12.700 1.00 0.00 N ATOM 2009 CD2 HIS A 129 16.469 -0.732 12.401 1.00 0.00 C ATOM 2010 CE1 HIS A 129 17.132 1.113 11.430 1.00 0.00 C ATOM 2011 NE2 HIS A 129 16.865 -0.212 11.246 1.00 0.00 N ATOM 0 H HIS A 129 14.643 -1.545 13.846 1.00 0.00 H new ATOM 0 HA HIS A 129 14.503 -0.099 16.136 1.00 0.00 H new ATOM 0 HB2 HIS A 129 16.518 1.111 15.292 1.00 0.00 H new ATOM 0 HB3 HIS A 129 16.599 -0.639 15.271 1.00 0.00 H new ATOM 0 HD1 HIS A 129 17.007 2.322 13.132 1.00 0.00 H new ATOM 0 HD2 HIS A 129 16.191 -1.762 12.567 1.00 0.00 H new ATOM 0 HE1 HIS A 129 17.475 1.803 10.673 1.00 0.00 H new ATOM 2019 N LEU A 130 13.372 1.628 13.637 1.00 0.00 N ATOM 2020 CA LEU A 130 12.667 2.844 13.271 1.00 0.00 C ATOM 2021 C LEU A 130 11.574 3.125 14.304 1.00 0.00 C ATOM 2022 O LEU A 130 11.639 4.117 15.028 1.00 0.00 O ATOM 2023 CB LEU A 130 12.147 2.751 11.835 1.00 0.00 C ATOM 2024 CG LEU A 130 13.144 3.118 10.735 1.00 0.00 C ATOM 2025 CD1 LEU A 130 14.581 2.848 11.185 1.00 0.00 C ATOM 2026 CD2 LEU A 130 12.809 2.398 9.427 1.00 0.00 C ATOM 0 H LEU A 130 13.418 0.924 12.901 1.00 0.00 H new ATOM 0 HA LEU A 130 13.346 3.697 13.285 1.00 0.00 H new ATOM 0 HB2 LEU A 130 11.802 1.732 11.660 1.00 0.00 H new ATOM 0 HB3 LEU A 130 11.278 3.402 11.742 1.00 0.00 H new ATOM 0 HG LEU A 130 13.061 4.188 10.544 1.00 0.00 H new ATOM 0 HD11 LEU A 130 15.270 3.118 10.384 1.00 0.00 H new ATOM 0 HD12 LEU A 130 14.803 3.444 12.070 1.00 0.00 H new ATOM 0 HD13 LEU A 130 14.696 1.790 11.421 1.00 0.00 H new ATOM 0 HD21 LEU A 130 13.534 2.677 8.662 1.00 0.00 H new ATOM 0 HD22 LEU A 130 12.845 1.320 9.585 1.00 0.00 H new ATOM 0 HD23 LEU A 130 11.809 2.683 9.101 1.00 0.00 H new ATOM 2038 N TRP A 131 10.594 2.234 14.339 1.00 0.00 N ATOM 2039 CA TRP A 131 9.488 2.374 15.271 1.00 0.00 C ATOM 2040 C TRP A 131 10.072 2.569 16.672 1.00 0.00 C ATOM 2041 O TRP A 131 9.809 3.579 17.323 1.00 0.00 O ATOM 2042 CB TRP A 131 8.540 1.176 15.181 1.00 0.00 C ATOM 2043 CG TRP A 131 8.157 0.793 13.750 1.00 0.00 C ATOM 2044 CD1 TRP A 131 8.625 -0.226 13.016 1.00 0.00 C ATOM 2045 CD2 TRP A 131 7.200 1.468 12.906 1.00 0.00 C ATOM 2046 NE1 TRP A 131 8.042 -0.256 11.765 1.00 0.00 N ATOM 2047 CE2 TRP A 131 7.149 0.806 11.696 1.00 0.00 C ATOM 2048 CE3 TRP A 131 6.405 2.600 13.157 1.00 0.00 C ATOM 2049 CZ2 TRP A 131 6.317 1.201 10.642 1.00 0.00 C ATOM 2050 CZ3 TRP A 131 5.579 2.982 12.093 1.00 0.00 C ATOM 2051 CH2 TRP A 131 5.516 2.327 10.869 1.00 0.00 C ATOM 0 H TRP A 131 10.543 1.412 13.737 1.00 0.00 H new ATOM 0 HA TRP A 131 8.882 3.245 15.022 1.00 0.00 H new ATOM 0 HB2 TRP A 131 9.008 0.318 15.663 1.00 0.00 H new ATOM 0 HB3 TRP A 131 7.633 1.401 15.742 1.00 0.00 H new ATOM 0 HD1 TRP A 131 9.365 -0.934 13.360 1.00 0.00 H new ATOM 0 HE1 TRP A 131 8.232 -0.934 11.027 1.00 0.00 H new ATOM 0 HE3 TRP A 131 6.429 3.133 14.096 1.00 0.00 H new ATOM 0 HZ2 TRP A 131 6.294 0.666 9.704 1.00 0.00 H new ATOM 0 HZ3 TRP A 131 4.947 3.846 12.233 1.00 0.00 H new ATOM 0 HH2 TRP A 131 4.852 2.685 10.096 1.00 0.00 H new ATOM 2062 N GLN A 132 10.855 1.587 17.094 1.00 0.00 N ATOM 2063 CA GLN A 132 11.479 1.639 18.405 1.00 0.00 C ATOM 2064 C GLN A 132 11.940 3.064 18.718 1.00 0.00 C ATOM 2065 O GLN A 132 11.565 3.631 19.743 1.00 0.00 O ATOM 2066 CB GLN A 132 12.645 0.652 18.497 1.00 0.00 C ATOM 2067 CG GLN A 132 12.643 -0.076 19.843 1.00 0.00 C ATOM 2068 CD GLN A 132 13.698 0.508 20.784 1.00 0.00 C ATOM 2069 OE1 GLN A 132 13.612 1.641 21.229 1.00 0.00 O ATOM 2070 NE2 GLN A 132 14.697 -0.326 21.060 1.00 0.00 N ATOM 0 H GLN A 132 11.071 0.751 16.551 1.00 0.00 H new ATOM 0 HA GLN A 132 10.739 1.346 19.150 1.00 0.00 H new ATOM 0 HB2 GLN A 132 12.576 -0.074 17.687 1.00 0.00 H new ATOM 0 HB3 GLN A 132 13.588 1.184 18.369 1.00 0.00 H new ATOM 0 HG2 GLN A 132 11.657 0.003 20.302 1.00 0.00 H new ATOM 0 HG3 GLN A 132 12.837 -1.137 19.687 1.00 0.00 H new ATOM 0 HE21 GLN A 132 14.707 -1.261 20.654 1.00 0.00 H new ATOM 0 HE22 GLN A 132 15.452 -0.030 21.678 1.00 0.00 H new ATOM 2079 N SER A 133 12.748 3.601 17.816 1.00 0.00 N ATOM 2080 CA SER A 133 13.265 4.949 17.983 1.00 0.00 C ATOM 2081 C SER A 133 13.932 5.418 16.688 1.00 0.00 C ATOM 2082 O SER A 133 14.653 4.656 16.046 1.00 0.00 O ATOM 2083 CB SER A 133 14.256 5.019 19.146 1.00 0.00 C ATOM 2084 OG SER A 133 13.632 5.443 20.355 1.00 0.00 O ATOM 0 H SER A 133 13.057 3.127 16.967 1.00 0.00 H new ATOM 0 HA SER A 133 12.429 5.609 18.214 1.00 0.00 H new ATOM 0 HB2 SER A 133 14.708 4.039 19.296 1.00 0.00 H new ATOM 0 HB3 SER A 133 15.063 5.707 18.894 1.00 0.00 H new ATOM 0 HG SER A 133 12.787 4.961 20.473 1.00 0.00 H new ATOM 2090 N LYS A 134 13.668 6.669 16.343 1.00 0.00 N ATOM 2091 CA LYS A 134 14.233 7.249 15.137 1.00 0.00 C ATOM 2092 C LYS A 134 15.690 6.802 14.997 1.00 0.00 C ATOM 2093 O LYS A 134 16.035 6.082 14.061 1.00 0.00 O ATOM 2094 CB LYS A 134 14.053 8.768 15.137 1.00 0.00 C ATOM 2095 CG LYS A 134 14.049 9.320 13.710 1.00 0.00 C ATOM 2096 CD LYS A 134 13.545 10.764 13.681 1.00 0.00 C ATOM 2097 CE LYS A 134 14.582 11.694 13.048 1.00 0.00 C ATOM 2098 NZ LYS A 134 15.194 12.564 14.077 1.00 0.00 N ATOM 0 H LYS A 134 13.070 7.298 16.878 1.00 0.00 H new ATOM 0 HA LYS A 134 13.702 6.889 14.256 1.00 0.00 H new ATOM 0 HB2 LYS A 134 13.118 9.027 15.633 1.00 0.00 H new ATOM 0 HB3 LYS A 134 14.856 9.233 15.708 1.00 0.00 H new ATOM 0 HG2 LYS A 134 15.056 9.275 13.296 1.00 0.00 H new ATOM 0 HG3 LYS A 134 13.416 8.698 13.077 1.00 0.00 H new ATOM 0 HD2 LYS A 134 12.613 10.816 13.118 1.00 0.00 H new ATOM 0 HD3 LYS A 134 13.324 11.096 14.695 1.00 0.00 H new ATOM 0 HE2 LYS A 134 15.355 11.105 12.555 1.00 0.00 H new ATOM 0 HE3 LYS A 134 14.109 12.306 12.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 15.895 13.189 13.631 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 14.455 13.140 14.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 15.662 11.976 14.795 1.00 0.00 H new ATOM 2112 N LYS A 135 16.506 7.248 15.941 1.00 0.00 N ATOM 2113 CA LYS A 135 17.917 6.903 15.934 1.00 0.00 C ATOM 2114 C LYS A 135 18.563 7.390 17.233 1.00 0.00 C ATOM 2115 O LYS A 135 18.027 8.270 17.905 1.00 0.00 O ATOM 2116 CB LYS A 135 18.594 7.441 14.672 1.00 0.00 C ATOM 2117 CG LYS A 135 19.269 6.313 13.888 1.00 0.00 C ATOM 2118 CD LYS A 135 20.621 6.764 13.332 1.00 0.00 C ATOM 2119 CE LYS A 135 20.530 7.045 11.831 1.00 0.00 C ATOM 2120 NZ LYS A 135 21.455 8.135 11.451 1.00 0.00 N ATOM 0 H LYS A 135 16.217 7.845 16.716 1.00 0.00 H new ATOM 0 HA LYS A 135 18.044 5.821 15.900 1.00 0.00 H new ATOM 0 HB2 LYS A 135 17.855 7.935 14.041 1.00 0.00 H new ATOM 0 HB3 LYS A 135 19.335 8.193 14.945 1.00 0.00 H new ATOM 0 HG2 LYS A 135 19.409 5.448 14.536 1.00 0.00 H new ATOM 0 HG3 LYS A 135 18.622 5.997 13.069 1.00 0.00 H new ATOM 0 HD2 LYS A 135 20.952 7.662 13.854 1.00 0.00 H new ATOM 0 HD3 LYS A 135 21.370 5.994 13.517 1.00 0.00 H new ATOM 0 HE2 LYS A 135 20.773 6.142 11.271 1.00 0.00 H new ATOM 0 HE3 LYS A 135 19.508 7.319 11.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 21.381 8.313 10.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 21.205 9.000 11.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 22.430 7.860 11.684 1.00 0.00 H new ATOM 2134 N SER A 136 19.705 6.796 17.548 1.00 0.00 N ATOM 2135 CA SER A 136 20.429 7.158 18.754 1.00 0.00 C ATOM 2136 C SER A 136 21.858 6.616 18.689 1.00 0.00 C ATOM 2137 O SER A 136 22.122 5.498 19.128 1.00 0.00 O ATOM 2138 CB SER A 136 19.718 6.632 20.002 1.00 0.00 C ATOM 2139 OG SER A 136 20.460 6.893 21.190 1.00 0.00 O ATOM 0 H SER A 136 20.146 6.066 16.988 1.00 0.00 H new ATOM 0 HA SER A 136 20.462 8.246 18.819 1.00 0.00 H new ATOM 0 HB2 SER A 136 18.734 7.094 20.080 1.00 0.00 H new ATOM 0 HB3 SER A 136 19.559 5.558 19.903 1.00 0.00 H new ATOM 0 HG SER A 136 19.972 6.543 21.964 1.00 0.00 H new ATOM 2145 N GLY A 137 22.743 7.434 18.137 1.00 0.00 N ATOM 2146 CA GLY A 137 24.138 7.050 18.009 1.00 0.00 C ATOM 2147 C GLY A 137 24.865 7.953 17.011 1.00 0.00 C ATOM 2148 O GLY A 137 24.583 7.915 15.814 1.00 0.00 O ATOM 0 H GLY A 137 22.520 8.361 17.774 1.00 0.00 H new ATOM 0 HA2 GLY A 137 24.626 7.110 18.982 1.00 0.00 H new ATOM 0 HA3 GLY A 137 24.205 6.012 17.682 1.00 0.00 H new ATOM 2152 N PRO A 138 25.812 8.765 17.554 1.00 0.00 N ATOM 2153 CA PRO A 138 26.582 9.676 16.724 1.00 0.00 C ATOM 2154 C PRO A 138 27.641 8.922 15.919 1.00 0.00 C ATOM 2155 O PRO A 138 28.415 8.145 16.477 1.00 0.00 O ATOM 2156 CB PRO A 138 27.178 10.683 17.694 1.00 0.00 C ATOM 2157 CG PRO A 138 27.105 10.034 19.066 1.00 0.00 C ATOM 2158 CD PRO A 138 26.173 8.837 18.967 1.00 0.00 C ATOM 0 HA PRO A 138 25.972 10.179 15.973 1.00 0.00 H new ATOM 0 HB2 PRO A 138 28.208 10.919 17.428 1.00 0.00 H new ATOM 0 HB3 PRO A 138 26.621 11.620 17.675 1.00 0.00 H new ATOM 0 HG2 PRO A 138 28.096 9.720 19.393 1.00 0.00 H new ATOM 0 HG3 PRO A 138 26.736 10.745 19.805 1.00 0.00 H new ATOM 0 HD2 PRO A 138 26.666 7.923 19.297 1.00 0.00 H new ATOM 0 HD3 PRO A 138 25.292 8.968 19.595 1.00 0.00 H new ATOM 2166 N SER A 139 27.643 9.177 14.619 1.00 0.00 N ATOM 2167 CA SER A 139 28.595 8.532 13.731 1.00 0.00 C ATOM 2168 C SER A 139 28.468 9.108 12.319 1.00 0.00 C ATOM 2169 O SER A 139 27.363 9.243 11.797 1.00 0.00 O ATOM 2170 CB SER A 139 28.386 7.016 13.706 1.00 0.00 C ATOM 2171 OG SER A 139 29.537 6.311 14.163 1.00 0.00 O ATOM 0 H SER A 139 27.000 9.822 14.159 1.00 0.00 H new ATOM 0 HA SER A 139 29.599 8.727 14.107 1.00 0.00 H new ATOM 0 HB2 SER A 139 27.531 6.758 14.331 1.00 0.00 H new ATOM 0 HB3 SER A 139 28.146 6.700 12.691 1.00 0.00 H new ATOM 0 HG SER A 139 29.363 5.347 14.134 1.00 0.00 H new ATOM 2177 N SER A 140 29.616 9.432 11.741 1.00 0.00 N ATOM 2178 CA SER A 140 29.647 9.990 10.400 1.00 0.00 C ATOM 2179 C SER A 140 30.462 9.085 9.475 1.00 0.00 C ATOM 2180 O SER A 140 31.675 8.956 9.637 1.00 0.00 O ATOM 2181 CB SER A 140 30.229 11.405 10.406 1.00 0.00 C ATOM 2182 OG SER A 140 29.960 12.098 9.190 1.00 0.00 O ATOM 0 H SER A 140 30.531 9.319 12.177 1.00 0.00 H new ATOM 0 HA SER A 140 28.623 10.049 10.030 1.00 0.00 H new ATOM 0 HB2 SER A 140 29.811 11.965 11.243 1.00 0.00 H new ATOM 0 HB3 SER A 140 31.306 11.353 10.563 1.00 0.00 H new ATOM 0 HG SER A 140 30.346 12.998 9.234 1.00 0.00 H new ATOM 2188 N GLY A 141 29.764 8.481 8.524 1.00 0.00 N ATOM 2189 CA GLY A 141 30.408 7.591 7.573 1.00 0.00 C ATOM 2190 C GLY A 141 30.300 6.133 8.026 1.00 0.00 C ATOM 2191 O GLY A 141 29.882 5.270 7.255 1.00 0.00 O ATOM 0 H GLY A 141 28.759 8.591 8.392 1.00 0.00 H new ATOM 0 HA2 GLY A 141 29.947 7.706 6.592 1.00 0.00 H new ATOM 0 HA3 GLY A 141 31.457 7.865 7.466 1.00 0.00 H new TER 2195 GLY A 141