USER MOD reduce.3.24.130724 H: found=0, std=0, add=913, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 911 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 105 GLN : amide:sc= -1.03 X(o=-0.95,f=-1.2!) USER MOD Set 1.2: A 106 TYR OH : rot -39:sc= 0.075 USER MOD Set 2.1: A 71 THR OG1 : rot -10:sc= 0.885! USER MOD Set 2.2: A 73 GLN : amide:sc= -0.146 K(o=0.74,f=-0.48) USER MOD Set 2.3: A 80 MET CE :methyl -156:sc= 0 (180deg=-1.02) 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 -9:sc= 0.793 USER MOD Single : A 5 SER OG : rot 180:sc= -0.0265 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 11 CYS SG : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -1.1 X(o=-1.1,f=-1!) USER MOD Single : A 14 HIS :FLIP no HE2:sc= -8.04! C(o=-8.8!,f=-8!) USER MOD Single : A 16 ASN : amide:sc= 0.265 K(o=0.27,f=-7.5!) USER MOD Single : A 18 THR OG1 : rot 180:sc= -0.418 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 162:sc= 0.348 (180deg=0.18) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0.00629 USER MOD Single : A 31 LYS NZ :NH3+ -171:sc= -0.0199 (180deg=-0.168) USER MOD Single : A 34 SER OG : rot 150:sc= -0.105 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 CYS SG : rot -130:sc= -2.16 USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 ASN :FLIP amide:sc= -0.251 F(o=-2!,f=-0.25) USER MOD Single : A 56 CYS SG : rot 26:sc= 0.427 USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0.00107 USER MOD Single : A 60 TYR OH : rot 180:sc= -0.444 USER MOD Single : A 65 ASN : amide:sc= -0.514 X(o=-0.51,f=-0.51) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 142:sc= 1.08 (180deg=0.285) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= -0.182 X(o=-0.18,f=-0.015) USER MOD Single : A 98 MET CE :methyl 156:sc= -0.48 (180deg=-1.27) USER MOD Single : A 102 THR OG1 : rot -173:sc= 0.0431 USER MOD Single : A 103 HIS : no HE2:sc= -0.916 K(o=-0.92,f=-2!) USER MOD Single : A 115 THR OG1 : rot 11:sc= 0.998 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 12.234 -19.607 -5.065 1.00 0.00 N ATOM 2 CA GLY A 1 11.306 -18.731 -4.374 1.00 0.00 C ATOM 3 C GLY A 1 10.997 -17.475 -5.164 1.00 0.00 C ATOM 4 O GLY A 1 11.213 -16.362 -4.683 1.00 0.00 O ATOM 0 H1 GLY A 1 12.413 -20.451 -4.484 1.00 0.00 H new ATOM 0 H2 GLY A 1 11.826 -19.895 -5.977 1.00 0.00 H new ATOM 0 H3 GLY A 1 13.129 -19.104 -5.230 1.00 0.00 H new ATOM 0 HA2 GLY A 1 10.379 -19.270 -4.178 1.00 0.00 H new ATOM 0 HA3 GLY A 1 11.724 -18.454 -3.406 1.00 0.00 H new ATOM 8 N SER A 2 10.492 -17.651 -6.381 1.00 0.00 N ATOM 9 CA SER A 2 10.159 -16.523 -7.241 1.00 0.00 C ATOM 10 C SER A 2 8.717 -16.619 -7.730 1.00 0.00 C ATOM 11 O SER A 2 8.009 -17.578 -7.423 1.00 0.00 O ATOM 12 CB SER A 2 11.112 -16.467 -8.437 1.00 0.00 C ATOM 13 OG SER A 2 12.464 -16.487 -8.014 1.00 0.00 O ATOM 0 H SER A 2 10.305 -18.565 -6.793 1.00 0.00 H new ATOM 0 HA SER A 2 10.266 -15.609 -6.657 1.00 0.00 H new ATOM 0 HB2 SER A 2 10.922 -17.313 -9.097 1.00 0.00 H new ATOM 0 HB3 SER A 2 10.922 -15.563 -9.015 1.00 0.00 H new ATOM 0 HG SER A 2 13.052 -16.452 -8.797 1.00 0.00 H new ATOM 19 N SER A 3 8.289 -15.617 -8.492 1.00 0.00 N ATOM 20 CA SER A 3 6.930 -15.586 -9.020 1.00 0.00 C ATOM 21 C SER A 3 6.843 -14.674 -10.240 1.00 0.00 C ATOM 22 O SER A 3 7.807 -13.998 -10.594 1.00 0.00 O ATOM 23 CB SER A 3 5.953 -15.111 -7.943 1.00 0.00 C ATOM 24 OG SER A 3 5.920 -16.012 -6.851 1.00 0.00 O ATOM 0 H SER A 3 8.863 -14.817 -8.757 1.00 0.00 H new ATOM 0 HA SER A 3 6.661 -16.598 -9.324 1.00 0.00 H new ATOM 0 HB2 SER A 3 6.246 -14.121 -7.593 1.00 0.00 H new ATOM 0 HB3 SER A 3 4.955 -15.016 -8.370 1.00 0.00 H new ATOM 0 HG SER A 3 6.417 -16.824 -7.082 1.00 0.00 H new ATOM 30 N GLY A 4 5.677 -14.662 -10.880 1.00 0.00 N ATOM 31 CA GLY A 4 5.484 -13.831 -12.054 1.00 0.00 C ATOM 32 C GLY A 4 4.212 -14.174 -12.805 1.00 0.00 C ATOM 33 O GLY A 4 3.583 -15.198 -12.538 1.00 0.00 O ATOM 0 H GLY A 4 4.863 -15.213 -10.606 1.00 0.00 H new ATOM 0 HA2 GLY A 4 5.453 -12.784 -11.753 1.00 0.00 H new ATOM 0 HA3 GLY A 4 6.338 -13.946 -12.721 1.00 0.00 H new ATOM 37 N SER A 5 3.832 -13.315 -13.745 1.00 0.00 N ATOM 38 CA SER A 5 2.624 -13.530 -14.533 1.00 0.00 C ATOM 39 C SER A 5 2.797 -12.991 -15.950 1.00 0.00 C ATOM 40 O SER A 5 3.547 -12.043 -16.178 1.00 0.00 O ATOM 41 CB SER A 5 1.426 -12.856 -13.861 1.00 0.00 C ATOM 42 OG SER A 5 1.331 -13.227 -12.497 1.00 0.00 O ATOM 0 H SER A 5 4.343 -12.464 -13.980 1.00 0.00 H new ATOM 0 HA SER A 5 2.443 -14.603 -14.591 1.00 0.00 H new ATOM 0 HB2 SER A 5 1.522 -11.773 -13.941 1.00 0.00 H new ATOM 0 HB3 SER A 5 0.509 -13.134 -14.381 1.00 0.00 H new ATOM 0 HG SER A 5 0.559 -12.782 -12.090 1.00 0.00 H new ATOM 48 N SER A 6 2.096 -13.605 -16.899 1.00 0.00 N ATOM 49 CA SER A 6 2.174 -13.190 -18.295 1.00 0.00 C ATOM 50 C SER A 6 1.167 -12.083 -18.589 1.00 0.00 C ATOM 51 O SER A 6 -0.013 -12.197 -18.260 1.00 0.00 O ATOM 52 CB SER A 6 1.920 -14.384 -19.218 1.00 0.00 C ATOM 53 OG SER A 6 1.756 -13.964 -20.561 1.00 0.00 O ATOM 0 H SER A 6 1.469 -14.390 -16.727 1.00 0.00 H new ATOM 0 HA SER A 6 3.177 -12.804 -18.479 1.00 0.00 H new ATOM 0 HB2 SER A 6 2.754 -15.083 -19.151 1.00 0.00 H new ATOM 0 HB3 SER A 6 1.029 -14.919 -18.889 1.00 0.00 H new ATOM 0 HG SER A 6 1.597 -14.745 -21.131 1.00 0.00 H new ATOM 59 N GLY A 7 1.643 -11.009 -19.213 1.00 0.00 N ATOM 60 CA GLY A 7 0.773 -9.895 -19.542 1.00 0.00 C ATOM 61 C GLY A 7 1.249 -8.589 -18.937 1.00 0.00 C ATOM 62 O GLY A 7 2.000 -8.586 -17.962 1.00 0.00 O ATOM 0 H GLY A 7 2.616 -10.891 -19.496 1.00 0.00 H new ATOM 0 HA2 GLY A 7 0.716 -9.790 -20.625 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -0.236 -10.109 -19.189 1.00 0.00 H new ATOM 66 N MET A 8 0.813 -7.476 -19.518 1.00 0.00 N ATOM 67 CA MET A 8 1.200 -6.158 -19.030 1.00 0.00 C ATOM 68 C MET A 8 1.083 -6.085 -17.511 1.00 0.00 C ATOM 69 O MET A 8 0.349 -6.859 -16.897 1.00 0.00 O ATOM 70 CB MET A 8 0.329 -5.077 -19.673 1.00 0.00 C ATOM 71 CG MET A 8 0.513 -4.964 -21.178 1.00 0.00 C ATOM 72 SD MET A 8 -0.651 -3.813 -21.936 1.00 0.00 S ATOM 73 CE MET A 8 -0.685 -4.426 -23.618 1.00 0.00 C ATOM 0 H MET A 8 0.192 -7.461 -20.327 1.00 0.00 H new ATOM 0 HA MET A 8 2.241 -5.987 -19.305 1.00 0.00 H new ATOM 0 HB2 MET A 8 -0.718 -5.290 -19.458 1.00 0.00 H new ATOM 0 HB3 MET A 8 0.559 -4.116 -19.214 1.00 0.00 H new ATOM 0 HG2 MET A 8 1.531 -4.639 -21.392 1.00 0.00 H new ATOM 0 HG3 MET A 8 0.391 -5.948 -21.630 1.00 0.00 H new ATOM 0 HE1 MET A 8 -1.363 -3.815 -24.214 1.00 0.00 H new ATOM 0 HE2 MET A 8 0.317 -4.376 -24.044 1.00 0.00 H new ATOM 0 HE3 MET A 8 -1.030 -5.460 -23.621 1.00 0.00 H new ATOM 83 N VAL A 9 1.812 -5.149 -16.911 1.00 0.00 N ATOM 84 CA VAL A 9 1.789 -4.974 -15.463 1.00 0.00 C ATOM 85 C VAL A 9 1.863 -3.499 -15.087 1.00 0.00 C ATOM 86 O VAL A 9 2.496 -2.690 -15.765 1.00 0.00 O ATOM 87 CB VAL A 9 2.953 -5.724 -14.789 1.00 0.00 C ATOM 88 CG1 VAL A 9 2.844 -7.220 -15.042 1.00 0.00 C ATOM 89 CG2 VAL A 9 4.289 -5.188 -15.283 1.00 0.00 C ATOM 0 H VAL A 9 2.425 -4.501 -17.405 1.00 0.00 H new ATOM 0 HA VAL A 9 0.846 -5.389 -15.108 1.00 0.00 H new ATOM 0 HB VAL A 9 2.895 -5.557 -13.713 1.00 0.00 H new ATOM 0 HG11 VAL A 9 3.675 -7.732 -14.558 1.00 0.00 H new ATOM 0 HG12 VAL A 9 1.903 -7.590 -14.635 1.00 0.00 H new ATOM 0 HG13 VAL A 9 2.875 -7.411 -16.115 1.00 0.00 H new ATOM 0 HG21 VAL A 9 5.100 -5.729 -14.796 1.00 0.00 H new ATOM 0 HG22 VAL A 9 4.359 -5.323 -16.362 1.00 0.00 H new ATOM 0 HG23 VAL A 9 4.366 -4.127 -15.044 1.00 0.00 H new ATOM 99 N PRO A 10 1.200 -3.138 -13.978 1.00 0.00 N ATOM 100 CA PRO A 10 1.175 -1.757 -13.485 1.00 0.00 C ATOM 101 C PRO A 10 2.528 -1.313 -12.939 1.00 0.00 C ATOM 102 O PRO A 10 3.526 -2.022 -13.074 1.00 0.00 O ATOM 103 CB PRO A 10 0.134 -1.800 -12.363 1.00 0.00 C ATOM 104 CG PRO A 10 0.131 -3.216 -11.902 1.00 0.00 C ATOM 105 CD PRO A 10 0.423 -4.049 -13.120 1.00 0.00 C ATOM 0 HA PRO A 10 0.940 -1.045 -14.276 1.00 0.00 H new ATOM 0 HB2 PRO A 10 0.398 -1.121 -11.552 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -0.850 -1.499 -12.724 1.00 0.00 H new ATOM 0 HG2 PRO A 10 0.883 -3.377 -11.130 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -0.833 -3.483 -11.468 1.00 0.00 H new ATOM 0 HD2 PRO A 10 0.990 -4.945 -12.868 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -0.493 -4.379 -13.610 1.00 0.00 H new ATOM 113 N CYS A 11 2.555 -0.137 -12.322 1.00 0.00 N ATOM 114 CA CYS A 11 3.786 0.402 -11.756 1.00 0.00 C ATOM 115 C CYS A 11 3.649 0.606 -10.251 1.00 0.00 C ATOM 116 O CYS A 11 4.642 0.780 -9.545 1.00 0.00 O ATOM 117 CB CYS A 11 4.146 1.727 -12.431 1.00 0.00 C ATOM 118 SG CYS A 11 3.887 1.737 -14.221 1.00 0.00 S ATOM 0 H CYS A 11 1.738 0.462 -12.201 1.00 0.00 H new ATOM 0 HA CYS A 11 4.584 -0.318 -11.936 1.00 0.00 H new ATOM 0 HB2 CYS A 11 3.551 2.524 -11.984 1.00 0.00 H new ATOM 0 HB3 CYS A 11 5.192 1.956 -12.225 1.00 0.00 H new ATOM 0 HG CYS A 11 4.217 2.899 -14.701 1.00 0.00 H new ATOM 124 N TRP A 12 2.412 0.584 -9.767 1.00 0.00 N ATOM 125 CA TRP A 12 2.145 0.768 -8.345 1.00 0.00 C ATOM 126 C TRP A 12 2.361 -0.532 -7.577 1.00 0.00 C ATOM 127 O TRP A 12 2.388 -0.540 -6.348 1.00 0.00 O ATOM 128 CB TRP A 12 0.714 1.267 -8.134 1.00 0.00 C ATOM 129 CG TRP A 12 -0.304 0.502 -8.924 1.00 0.00 C ATOM 130 CD1 TRP A 12 -0.873 0.876 -10.108 1.00 0.00 C ATOM 131 CD2 TRP A 12 -0.874 -0.767 -8.586 1.00 0.00 C ATOM 132 NE1 TRP A 12 -1.763 -0.084 -10.526 1.00 0.00 N ATOM 133 CE2 TRP A 12 -1.782 -1.102 -9.610 1.00 0.00 C ATOM 134 CE3 TRP A 12 -0.706 -1.654 -7.519 1.00 0.00 C ATOM 135 CZ2 TRP A 12 -2.517 -2.285 -9.596 1.00 0.00 C ATOM 136 CZ3 TRP A 12 -1.436 -2.827 -7.506 1.00 0.00 C ATOM 137 CH2 TRP A 12 -2.332 -3.134 -8.539 1.00 0.00 C ATOM 0 H TRP A 12 1.579 0.441 -10.338 1.00 0.00 H new ATOM 0 HA TRP A 12 2.843 1.514 -7.964 1.00 0.00 H new ATOM 0 HB2 TRP A 12 0.466 1.201 -7.075 1.00 0.00 H new ATOM 0 HB3 TRP A 12 0.660 2.320 -8.409 1.00 0.00 H new ATOM 0 HD1 TRP A 12 -0.655 1.792 -10.638 1.00 0.00 H new ATOM 0 HE1 TRP A 12 -2.319 -0.045 -11.380 1.00 0.00 H new ATOM 0 HE3 TRP A 12 -0.018 -1.426 -6.719 1.00 0.00 H new ATOM 0 HZ2 TRP A 12 -3.208 -2.524 -10.391 1.00 0.00 H new ATOM 0 HZ3 TRP A 12 -1.314 -3.519 -6.686 1.00 0.00 H new ATOM 0 HH2 TRP A 12 -2.888 -4.059 -8.500 1.00 0.00 H new ATOM 148 N ASN A 13 2.516 -1.629 -8.312 1.00 0.00 N ATOM 149 CA ASN A 13 2.730 -2.935 -7.699 1.00 0.00 C ATOM 150 C ASN A 13 4.218 -3.261 -7.619 1.00 0.00 C ATOM 151 O ASN A 13 4.692 -4.208 -8.246 1.00 0.00 O ATOM 152 CB ASN A 13 2.001 -4.020 -8.494 1.00 0.00 C ATOM 153 CG ASN A 13 1.990 -5.355 -7.775 1.00 0.00 C ATOM 154 OD1 ASN A 13 3.037 -5.869 -7.380 1.00 0.00 O ATOM 155 ND2 ASN A 13 0.803 -5.924 -7.602 1.00 0.00 N ATOM 0 H ASN A 13 2.497 -1.639 -9.332 1.00 0.00 H new ATOM 0 HA ASN A 13 2.328 -2.904 -6.686 1.00 0.00 H new ATOM 0 HB2 ASN A 13 0.975 -3.702 -8.680 1.00 0.00 H new ATOM 0 HB3 ASN A 13 2.480 -4.138 -9.466 1.00 0.00 H new ATOM 0 HD21 ASN A 13 0.733 -6.823 -7.125 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -0.039 -5.462 -7.946 1.00 0.00 H new ATOM 162 N HIS A 14 4.950 -2.469 -6.841 1.00 0.00 N ATOM 163 CA HIS A 14 6.385 -2.674 -6.677 1.00 0.00 C ATOM 164 C HIS A 14 6.705 -4.154 -6.490 1.00 0.00 C ATOM 165 O HIS A 14 7.277 -4.793 -7.372 1.00 0.00 O ATOM 166 CB HIS A 14 6.903 -1.873 -5.482 1.00 0.00 C ATOM 167 CG HIS A 14 6.848 -0.390 -5.686 1.00 0.00 C ATOM 168 ND1 HIS A 14 5.799 0.434 -5.915 1.00 0.00 N flip ATOM 169 CD2 HIS A 14 7.968 0.414 -5.668 1.00 0.00 C flip ATOM 170 CE1 HIS A 14 6.299 1.707 -6.028 1.00 0.00 C flip ATOM 171 NE2 HIS A 14 7.610 1.668 -5.875 1.00 0.00 N flip ATOM 0 H HIS A 14 4.573 -1.680 -6.315 1.00 0.00 H new ATOM 0 HA HIS A 14 6.882 -2.325 -7.582 1.00 0.00 H new ATOM 0 HB2 HIS A 14 6.317 -2.132 -4.600 1.00 0.00 H new ATOM 0 HB3 HIS A 14 7.933 -2.166 -5.278 1.00 0.00 H new ATOM 0 HD1 HIS A 14 4.819 0.160 -5.990 1.00 0.00 H new ATOM 0 HD2 HIS A 14 8.980 0.072 -5.509 1.00 0.00 H new ATOM 0 HE1 HIS A 14 5.715 2.597 -6.212 1.00 0.00 H new ATOM 180 N GLY A 15 6.332 -4.694 -5.333 1.00 0.00 N ATOM 181 CA GLY A 15 6.588 -6.094 -5.050 1.00 0.00 C ATOM 182 C GLY A 15 7.103 -6.316 -3.642 1.00 0.00 C ATOM 183 O GLY A 15 6.733 -5.594 -2.718 1.00 0.00 O ATOM 0 H GLY A 15 5.857 -4.186 -4.587 1.00 0.00 H new ATOM 0 HA2 GLY A 15 5.670 -6.664 -5.192 1.00 0.00 H new ATOM 0 HA3 GLY A 15 7.316 -6.479 -5.765 1.00 0.00 H new ATOM 187 N ASN A 16 7.959 -7.320 -3.479 1.00 0.00 N ATOM 188 CA ASN A 16 8.525 -7.637 -2.173 1.00 0.00 C ATOM 189 C ASN A 16 9.619 -6.642 -1.798 1.00 0.00 C ATOM 190 O ASN A 16 10.757 -6.754 -2.255 1.00 0.00 O ATOM 191 CB ASN A 16 9.090 -9.059 -2.170 1.00 0.00 C ATOM 192 CG ASN A 16 10.029 -9.310 -3.334 1.00 0.00 C ATOM 193 OD1 ASN A 16 9.885 -8.715 -4.402 1.00 0.00 O ATOM 194 ND2 ASN A 16 10.997 -10.196 -3.132 1.00 0.00 N ATOM 0 H ASN A 16 8.276 -7.928 -4.235 1.00 0.00 H new ATOM 0 HA ASN A 16 7.728 -7.569 -1.433 1.00 0.00 H new ATOM 0 HB2 ASN A 16 9.621 -9.234 -1.234 1.00 0.00 H new ATOM 0 HB3 ASN A 16 8.268 -9.774 -2.209 1.00 0.00 H new ATOM 0 HD21 ASN A 16 11.659 -10.407 -3.879 1.00 0.00 H new ATOM 0 HD22 ASN A 16 11.079 -10.666 -2.230 1.00 0.00 H new ATOM 201 N ILE A 17 9.267 -5.671 -0.962 1.00 0.00 N ATOM 202 CA ILE A 17 10.219 -4.658 -0.524 1.00 0.00 C ATOM 203 C ILE A 17 10.096 -4.399 0.973 1.00 0.00 C ATOM 204 O ILE A 17 9.062 -4.679 1.581 1.00 0.00 O ATOM 205 CB ILE A 17 10.019 -3.332 -1.282 1.00 0.00 C ATOM 206 CG1 ILE A 17 8.776 -2.606 -0.763 1.00 0.00 C ATOM 207 CG2 ILE A 17 9.904 -3.589 -2.777 1.00 0.00 C ATOM 208 CD1 ILE A 17 8.491 -1.307 -1.483 1.00 0.00 C ATOM 0 H ILE A 17 8.330 -5.565 -0.574 1.00 0.00 H new ATOM 0 HA ILE A 17 11.214 -5.045 -0.742 1.00 0.00 H new ATOM 0 HB ILE A 17 10.887 -2.696 -1.109 1.00 0.00 H new ATOM 0 HG12 ILE A 17 7.913 -3.264 -0.862 1.00 0.00 H new ATOM 0 HG13 ILE A 17 8.901 -2.403 0.301 1.00 0.00 H new ATOM 0 HG21 ILE A 17 9.763 -2.643 -3.299 1.00 0.00 H new ATOM 0 HG22 ILE A 17 10.815 -4.069 -3.135 1.00 0.00 H new ATOM 0 HG23 ILE A 17 9.051 -4.240 -2.970 1.00 0.00 H new ATOM 0 HD11 ILE A 17 7.596 -0.847 -1.063 1.00 0.00 H new ATOM 0 HD12 ILE A 17 9.337 -0.631 -1.362 1.00 0.00 H new ATOM 0 HD13 ILE A 17 8.333 -1.506 -2.543 1.00 0.00 H new ATOM 220 N THR A 18 11.158 -3.860 1.564 1.00 0.00 N ATOM 221 CA THR A 18 11.169 -3.561 2.991 1.00 0.00 C ATOM 222 C THR A 18 10.395 -2.283 3.291 1.00 0.00 C ATOM 223 O THR A 18 10.100 -1.498 2.390 1.00 0.00 O ATOM 224 CB THR A 18 12.608 -3.414 3.523 1.00 0.00 C ATOM 225 OG1 THR A 18 12.591 -2.795 4.814 1.00 0.00 O ATOM 226 CG2 THR A 18 13.455 -2.585 2.569 1.00 0.00 C ATOM 0 H THR A 18 12.022 -3.622 1.076 1.00 0.00 H new ATOM 0 HA THR A 18 10.688 -4.400 3.494 1.00 0.00 H new ATOM 0 HB THR A 18 13.047 -4.409 3.603 1.00 0.00 H new ATOM 0 HG1 THR A 18 13.509 -2.706 5.146 1.00 0.00 H new ATOM 0 HG21 THR A 18 14.466 -2.495 2.965 1.00 0.00 H new ATOM 0 HG22 THR A 18 13.489 -3.073 1.595 1.00 0.00 H new ATOM 0 HG23 THR A 18 13.017 -1.593 2.462 1.00 0.00 H new ATOM 234 N ARG A 19 10.070 -2.079 4.563 1.00 0.00 N ATOM 235 CA ARG A 19 9.329 -0.895 4.982 1.00 0.00 C ATOM 236 C ARG A 19 10.041 0.378 4.534 1.00 0.00 C ATOM 237 O ARG A 19 9.519 1.139 3.720 1.00 0.00 O ATOM 238 CB ARG A 19 9.155 -0.887 6.502 1.00 0.00 C ATOM 239 CG ARG A 19 7.929 -0.121 6.971 1.00 0.00 C ATOM 240 CD ARG A 19 8.016 0.218 8.451 1.00 0.00 C ATOM 241 NE ARG A 19 7.452 -0.838 9.288 1.00 0.00 N ATOM 242 CZ ARG A 19 7.483 -0.819 10.616 1.00 0.00 C ATOM 243 NH1 ARG A 19 8.048 0.197 11.254 1.00 0.00 N ATOM 244 NH2 ARG A 19 6.948 -1.817 11.308 1.00 0.00 N ATOM 0 H ARG A 19 10.308 -2.718 5.322 1.00 0.00 H new ATOM 0 HA ARG A 19 8.346 -0.926 4.511 1.00 0.00 H new ATOM 0 HB2 ARG A 19 9.088 -1.915 6.857 1.00 0.00 H new ATOM 0 HB3 ARG A 19 10.043 -0.449 6.958 1.00 0.00 H new ATOM 0 HG2 ARG A 19 7.829 0.797 6.392 1.00 0.00 H new ATOM 0 HG3 ARG A 19 7.034 -0.715 6.785 1.00 0.00 H new ATOM 0 HD2 ARG A 19 9.058 0.380 8.725 1.00 0.00 H new ATOM 0 HD3 ARG A 19 7.487 1.152 8.641 1.00 0.00 H new ATOM 0 HE ARG A 19 7.010 -1.634 8.828 1.00 0.00 H new ATOM 0 HH11 ARG A 19 8.460 0.966 10.725 1.00 0.00 H new ATOM 0 HH12 ARG A 19 8.071 0.210 12.274 1.00 0.00 H new ATOM 0 HH21 ARG A 19 6.512 -2.600 10.820 1.00 0.00 H new ATOM 0 HH22 ARG A 19 6.972 -1.801 12.328 1.00 0.00 H new ATOM 258 N SER A 20 11.235 0.603 5.073 1.00 0.00 N ATOM 259 CA SER A 20 12.016 1.786 4.733 1.00 0.00 C ATOM 260 C SER A 20 11.810 2.172 3.271 1.00 0.00 C ATOM 261 O SER A 20 11.685 3.351 2.939 1.00 0.00 O ATOM 262 CB SER A 20 13.502 1.537 5.001 1.00 0.00 C ATOM 263 OG SER A 20 14.303 2.541 4.403 1.00 0.00 O ATOM 0 H SER A 20 11.682 -0.018 5.747 1.00 0.00 H new ATOM 0 HA SER A 20 11.673 2.609 5.360 1.00 0.00 H new ATOM 0 HB2 SER A 20 13.682 1.516 6.076 1.00 0.00 H new ATOM 0 HB3 SER A 20 13.786 0.560 4.611 1.00 0.00 H new ATOM 0 HG SER A 20 15.248 2.360 4.590 1.00 0.00 H new ATOM 269 N LYS A 21 11.774 1.169 2.401 1.00 0.00 N ATOM 270 CA LYS A 21 11.581 1.399 0.974 1.00 0.00 C ATOM 271 C LYS A 21 10.216 2.024 0.703 1.00 0.00 C ATOM 272 O LYS A 21 10.121 3.098 0.110 1.00 0.00 O ATOM 273 CB LYS A 21 11.714 0.085 0.201 1.00 0.00 C ATOM 274 CG LYS A 21 12.069 0.274 -1.263 1.00 0.00 C ATOM 275 CD LYS A 21 13.540 0.612 -1.441 1.00 0.00 C ATOM 276 CE LYS A 21 13.873 0.905 -2.896 1.00 0.00 C ATOM 277 NZ LYS A 21 15.192 1.581 -3.039 1.00 0.00 N ATOM 0 H LYS A 21 11.876 0.188 2.659 1.00 0.00 H new ATOM 0 HA LYS A 21 12.352 2.092 0.636 1.00 0.00 H new ATOM 0 HB2 LYS A 21 12.479 -0.530 0.675 1.00 0.00 H new ATOM 0 HB3 LYS A 21 10.775 -0.464 0.271 1.00 0.00 H new ATOM 0 HG2 LYS A 21 11.834 -0.636 -1.816 1.00 0.00 H new ATOM 0 HG3 LYS A 21 11.458 1.071 -1.687 1.00 0.00 H new ATOM 0 HD2 LYS A 21 13.792 1.477 -0.828 1.00 0.00 H new ATOM 0 HD3 LYS A 21 14.151 -0.219 -1.087 1.00 0.00 H new ATOM 0 HE2 LYS A 21 13.880 -0.027 -3.462 1.00 0.00 H new ATOM 0 HE3 LYS A 21 13.094 1.534 -3.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 15.523 1.492 -4.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 15.094 2.588 -2.796 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 15.881 1.136 -2.400 1.00 0.00 H new ATOM 291 N ALA A 22 9.162 1.345 1.143 1.00 0.00 N ATOM 292 CA ALA A 22 7.803 1.836 0.952 1.00 0.00 C ATOM 293 C ALA A 22 7.740 3.352 1.102 1.00 0.00 C ATOM 294 O ALA A 22 7.320 4.059 0.186 1.00 0.00 O ATOM 295 CB ALA A 22 6.856 1.167 1.937 1.00 0.00 C ATOM 0 H ALA A 22 9.223 0.453 1.634 1.00 0.00 H new ATOM 0 HA ALA A 22 7.492 1.584 -0.062 1.00 0.00 H new ATOM 0 HB1 ALA A 22 5.845 1.544 1.783 1.00 0.00 H new ATOM 0 HB2 ALA A 22 6.870 0.089 1.780 1.00 0.00 H new ATOM 0 HB3 ALA A 22 7.174 1.389 2.956 1.00 0.00 H new ATOM 301 N GLU A 23 8.160 3.845 2.263 1.00 0.00 N ATOM 302 CA GLU A 23 8.150 5.278 2.532 1.00 0.00 C ATOM 303 C GLU A 23 9.155 6.006 1.643 1.00 0.00 C ATOM 304 O GLU A 23 8.816 6.987 0.982 1.00 0.00 O ATOM 305 CB GLU A 23 8.468 5.546 4.004 1.00 0.00 C ATOM 306 CG GLU A 23 7.491 4.889 4.967 1.00 0.00 C ATOM 307 CD GLU A 23 7.828 5.167 6.419 1.00 0.00 C ATOM 308 OE1 GLU A 23 8.871 4.669 6.891 1.00 0.00 O ATOM 309 OE2 GLU A 23 7.049 5.881 7.083 1.00 0.00 O ATOM 0 H GLU A 23 8.511 3.274 3.032 1.00 0.00 H new ATOM 0 HA GLU A 23 7.152 5.656 2.309 1.00 0.00 H new ATOM 0 HB2 GLU A 23 9.475 5.189 4.221 1.00 0.00 H new ATOM 0 HB3 GLU A 23 8.468 6.622 4.177 1.00 0.00 H new ATOM 0 HG2 GLU A 23 6.483 5.247 4.757 1.00 0.00 H new ATOM 0 HG3 GLU A 23 7.489 3.812 4.798 1.00 0.00 H new ATOM 316 N GLU A 24 10.391 5.518 1.635 1.00 0.00 N ATOM 317 CA GLU A 24 11.445 6.123 0.829 1.00 0.00 C ATOM 318 C GLU A 24 10.896 6.609 -0.509 1.00 0.00 C ATOM 319 O GLU A 24 11.004 7.789 -0.845 1.00 0.00 O ATOM 320 CB GLU A 24 12.577 5.120 0.594 1.00 0.00 C ATOM 321 CG GLU A 24 13.632 5.611 -0.383 1.00 0.00 C ATOM 322 CD GLU A 24 14.411 4.476 -1.018 1.00 0.00 C ATOM 323 OE1 GLU A 24 14.763 3.520 -0.297 1.00 0.00 O ATOM 324 OE2 GLU A 24 14.669 4.545 -2.239 1.00 0.00 O ATOM 0 H GLU A 24 10.687 4.706 2.177 1.00 0.00 H new ATOM 0 HA GLU A 24 11.837 6.981 1.375 1.00 0.00 H new ATOM 0 HB2 GLU A 24 13.054 4.894 1.547 1.00 0.00 H new ATOM 0 HB3 GLU A 24 12.153 4.188 0.220 1.00 0.00 H new ATOM 0 HG2 GLU A 24 13.152 6.200 -1.165 1.00 0.00 H new ATOM 0 HG3 GLU A 24 14.323 6.275 0.137 1.00 0.00 H new ATOM 331 N LEU A 25 10.307 5.692 -1.268 1.00 0.00 N ATOM 332 CA LEU A 25 9.740 6.026 -2.570 1.00 0.00 C ATOM 333 C LEU A 25 8.797 7.220 -2.464 1.00 0.00 C ATOM 334 O LEU A 25 9.026 8.263 -3.078 1.00 0.00 O ATOM 335 CB LEU A 25 8.994 4.822 -3.148 1.00 0.00 C ATOM 336 CG LEU A 25 9.794 3.523 -3.250 1.00 0.00 C ATOM 337 CD1 LEU A 25 8.861 2.331 -3.399 1.00 0.00 C ATOM 338 CD2 LEU A 25 10.769 3.588 -4.417 1.00 0.00 C ATOM 0 H LEU A 25 10.209 4.711 -1.005 1.00 0.00 H new ATOM 0 HA LEU A 25 10.560 6.292 -3.237 1.00 0.00 H new ATOM 0 HB2 LEU A 25 8.114 4.636 -2.533 1.00 0.00 H new ATOM 0 HB3 LEU A 25 8.637 5.085 -4.144 1.00 0.00 H new ATOM 0 HG LEU A 25 10.366 3.398 -2.330 1.00 0.00 H new ATOM 0 HD11 LEU A 25 9.449 1.416 -3.470 1.00 0.00 H new ATOM 0 HD12 LEU A 25 8.203 2.273 -2.532 1.00 0.00 H new ATOM 0 HD13 LEU A 25 8.262 2.449 -4.302 1.00 0.00 H new ATOM 0 HD21 LEU A 25 11.330 2.655 -4.475 1.00 0.00 H new ATOM 0 HD22 LEU A 25 10.217 3.737 -5.345 1.00 0.00 H new ATOM 0 HD23 LEU A 25 11.460 4.418 -4.268 1.00 0.00 H new ATOM 350 N LEU A 26 7.737 7.062 -1.679 1.00 0.00 N ATOM 351 CA LEU A 26 6.759 8.127 -1.489 1.00 0.00 C ATOM 352 C LEU A 26 7.451 9.471 -1.282 1.00 0.00 C ATOM 353 O LEU A 26 7.163 10.443 -1.979 1.00 0.00 O ATOM 354 CB LEU A 26 5.860 7.814 -0.292 1.00 0.00 C ATOM 355 CG LEU A 26 4.972 6.576 -0.425 1.00 0.00 C ATOM 356 CD1 LEU A 26 4.483 6.120 0.941 1.00 0.00 C ATOM 357 CD2 LEU A 26 3.796 6.860 -1.347 1.00 0.00 C ATOM 0 H LEU A 26 7.533 6.206 -1.163 1.00 0.00 H new ATOM 0 HA LEU A 26 6.147 8.189 -2.389 1.00 0.00 H new ATOM 0 HB2 LEU A 26 6.491 7.691 0.588 1.00 0.00 H new ATOM 0 HB3 LEU A 26 5.220 8.677 -0.108 1.00 0.00 H new ATOM 0 HG LEU A 26 5.565 5.773 -0.862 1.00 0.00 H new ATOM 0 HD11 LEU A 26 3.853 5.238 0.826 1.00 0.00 H new ATOM 0 HD12 LEU A 26 5.338 5.875 1.571 1.00 0.00 H new ATOM 0 HD13 LEU A 26 3.907 6.920 1.407 1.00 0.00 H new ATOM 0 HD21 LEU A 26 3.175 5.968 -1.430 1.00 0.00 H new ATOM 0 HD22 LEU A 26 3.203 7.678 -0.939 1.00 0.00 H new ATOM 0 HD23 LEU A 26 4.166 7.137 -2.334 1.00 0.00 H new ATOM 369 N SER A 27 8.367 9.516 -0.320 1.00 0.00 N ATOM 370 CA SER A 27 9.100 10.741 -0.020 1.00 0.00 C ATOM 371 C SER A 27 9.526 11.448 -1.303 1.00 0.00 C ATOM 372 O SER A 27 9.251 12.633 -1.492 1.00 0.00 O ATOM 373 CB SER A 27 10.329 10.428 0.836 1.00 0.00 C ATOM 374 OG SER A 27 10.960 11.618 1.277 1.00 0.00 O ATOM 0 H SER A 27 8.619 8.719 0.265 1.00 0.00 H new ATOM 0 HA SER A 27 8.438 11.404 0.536 1.00 0.00 H new ATOM 0 HB2 SER A 27 10.033 9.829 1.697 1.00 0.00 H new ATOM 0 HB3 SER A 27 11.035 9.830 0.259 1.00 0.00 H new ATOM 0 HG SER A 27 11.741 11.391 1.823 1.00 0.00 H new ATOM 380 N ARG A 28 10.199 10.711 -2.181 1.00 0.00 N ATOM 381 CA ARG A 28 10.665 11.267 -3.446 1.00 0.00 C ATOM 382 C ARG A 28 9.595 12.153 -4.077 1.00 0.00 C ATOM 383 O ARG A 28 9.769 13.366 -4.197 1.00 0.00 O ATOM 384 CB ARG A 28 11.046 10.143 -4.411 1.00 0.00 C ATOM 385 CG ARG A 28 11.932 9.078 -3.786 1.00 0.00 C ATOM 386 CD ARG A 28 12.733 8.331 -4.841 1.00 0.00 C ATOM 387 NE ARG A 28 13.677 9.205 -5.532 1.00 0.00 N ATOM 388 CZ ARG A 28 14.842 9.582 -5.017 1.00 0.00 C ATOM 389 NH1 ARG A 28 15.205 9.163 -3.812 1.00 0.00 N ATOM 390 NH2 ARG A 28 15.648 10.379 -5.707 1.00 0.00 N ATOM 0 H ARG A 28 10.434 9.728 -2.040 1.00 0.00 H new ATOM 0 HA ARG A 28 11.545 11.878 -3.244 1.00 0.00 H new ATOM 0 HB2 ARG A 28 10.136 9.673 -4.785 1.00 0.00 H new ATOM 0 HB3 ARG A 28 11.560 10.572 -5.271 1.00 0.00 H new ATOM 0 HG2 ARG A 28 12.612 9.542 -3.072 1.00 0.00 H new ATOM 0 HG3 ARG A 28 11.316 8.373 -3.228 1.00 0.00 H new ATOM 0 HD2 ARG A 28 13.276 7.511 -4.371 1.00 0.00 H new ATOM 0 HD3 ARG A 28 12.052 7.887 -5.567 1.00 0.00 H new ATOM 0 HE ARG A 28 13.428 9.545 -6.461 1.00 0.00 H new ATOM 0 HH11 ARG A 28 14.589 8.550 -3.278 1.00 0.00 H new ATOM 0 HH12 ARG A 28 16.100 9.454 -3.419 1.00 0.00 H new ATOM 0 HH21 ARG A 28 15.373 10.703 -6.634 1.00 0.00 H new ATOM 0 HH22 ARG A 28 16.542 10.668 -5.310 1.00 0.00 H new ATOM 404 N THR A 29 8.487 11.538 -4.480 1.00 0.00 N ATOM 405 CA THR A 29 7.390 12.270 -5.101 1.00 0.00 C ATOM 406 C THR A 29 6.970 13.461 -4.246 1.00 0.00 C ATOM 407 O THR A 29 7.060 14.609 -4.678 1.00 0.00 O ATOM 408 CB THR A 29 6.167 11.361 -5.331 1.00 0.00 C ATOM 409 OG1 THR A 29 6.581 10.122 -5.916 1.00 0.00 O ATOM 410 CG2 THR A 29 5.150 12.041 -6.235 1.00 0.00 C ATOM 0 H THR A 29 8.326 10.535 -4.387 1.00 0.00 H new ATOM 0 HA THR A 29 7.754 12.628 -6.064 1.00 0.00 H new ATOM 0 HB THR A 29 5.699 11.167 -4.366 1.00 0.00 H new ATOM 0 HG1 THR A 29 5.798 9.549 -6.057 1.00 0.00 H new ATOM 0 HG21 THR A 29 4.296 11.380 -6.383 1.00 0.00 H new ATOM 0 HG22 THR A 29 4.815 12.969 -5.772 1.00 0.00 H new ATOM 0 HG23 THR A 29 5.610 12.261 -7.199 1.00 0.00 H new ATOM 418 N GLY A 30 6.511 13.178 -3.031 1.00 0.00 N ATOM 419 CA GLY A 30 6.085 14.237 -2.134 1.00 0.00 C ATOM 420 C GLY A 30 4.764 14.853 -2.551 1.00 0.00 C ATOM 421 O GLY A 30 4.536 16.046 -2.350 1.00 0.00 O ATOM 0 H GLY A 30 6.426 12.235 -2.652 1.00 0.00 H new ATOM 0 HA2 GLY A 30 5.994 13.838 -1.124 1.00 0.00 H new ATOM 0 HA3 GLY A 30 6.850 15.012 -2.103 1.00 0.00 H new ATOM 425 N LYS A 31 3.892 14.039 -3.135 1.00 0.00 N ATOM 426 CA LYS A 31 2.586 14.509 -3.582 1.00 0.00 C ATOM 427 C LYS A 31 1.488 14.059 -2.624 1.00 0.00 C ATOM 428 O LYS A 31 1.587 12.998 -2.007 1.00 0.00 O ATOM 429 CB LYS A 31 2.291 13.993 -4.992 1.00 0.00 C ATOM 430 CG LYS A 31 2.891 14.852 -6.092 1.00 0.00 C ATOM 431 CD LYS A 31 2.817 14.160 -7.443 1.00 0.00 C ATOM 432 CE LYS A 31 3.603 14.918 -8.501 1.00 0.00 C ATOM 433 NZ LYS A 31 5.038 14.518 -8.519 1.00 0.00 N ATOM 0 H LYS A 31 4.066 13.049 -3.310 1.00 0.00 H new ATOM 0 HA LYS A 31 2.606 15.599 -3.597 1.00 0.00 H new ATOM 0 HB2 LYS A 31 2.675 12.977 -5.086 1.00 0.00 H new ATOM 0 HB3 LYS A 31 1.211 13.940 -5.132 1.00 0.00 H new ATOM 0 HG2 LYS A 31 2.363 15.804 -6.140 1.00 0.00 H new ATOM 0 HG3 LYS A 31 3.931 15.076 -5.854 1.00 0.00 H new ATOM 0 HD2 LYS A 31 3.207 13.146 -7.355 1.00 0.00 H new ATOM 0 HD3 LYS A 31 1.775 14.075 -7.753 1.00 0.00 H new ATOM 0 HE2 LYS A 31 3.163 14.735 -9.481 1.00 0.00 H new ATOM 0 HE3 LYS A 31 3.527 15.989 -8.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 5.569 15.159 -9.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 5.426 14.572 -7.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 5.122 13.543 -8.872 1.00 0.00 H new ATOM 447 N ASP A 32 0.442 14.869 -2.507 1.00 0.00 N ATOM 448 CA ASP A 32 -0.676 14.553 -1.626 1.00 0.00 C ATOM 449 C ASP A 32 -1.650 13.596 -2.307 1.00 0.00 C ATOM 450 O ASP A 32 -2.866 13.751 -2.200 1.00 0.00 O ATOM 451 CB ASP A 32 -1.404 15.832 -1.211 1.00 0.00 C ATOM 452 CG ASP A 32 -0.551 16.725 -0.332 1.00 0.00 C ATOM 453 OD1 ASP A 32 0.691 16.614 -0.403 1.00 0.00 O ATOM 454 OD2 ASP A 32 -1.124 17.534 0.427 1.00 0.00 O ATOM 0 H ASP A 32 0.345 15.750 -3.012 1.00 0.00 H new ATOM 0 HA ASP A 32 -0.279 14.066 -0.735 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -1.702 16.383 -2.103 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -2.318 15.570 -0.679 1.00 0.00 H new ATOM 459 N GLY A 33 -1.106 12.607 -3.010 1.00 0.00 N ATOM 460 CA GLY A 33 -1.942 11.640 -3.699 1.00 0.00 C ATOM 461 C GLY A 33 -1.152 10.452 -4.210 1.00 0.00 C ATOM 462 O GLY A 33 -1.582 9.763 -5.135 1.00 0.00 O ATOM 0 H GLY A 33 -0.102 12.458 -3.115 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -2.721 11.290 -3.022 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -2.442 12.127 -4.536 1.00 0.00 H new ATOM 466 N SER A 34 0.008 10.210 -3.607 1.00 0.00 N ATOM 467 CA SER A 34 0.863 9.100 -4.011 1.00 0.00 C ATOM 468 C SER A 34 0.460 7.816 -3.292 1.00 0.00 C ATOM 469 O SER A 34 -0.068 7.852 -2.180 1.00 0.00 O ATOM 470 CB SER A 34 2.329 9.424 -3.717 1.00 0.00 C ATOM 471 OG SER A 34 2.865 10.295 -4.698 1.00 0.00 O ATOM 0 H SER A 34 0.377 10.768 -2.837 1.00 0.00 H new ATOM 0 HA SER A 34 0.740 8.950 -5.084 1.00 0.00 H new ATOM 0 HB2 SER A 34 2.413 9.884 -2.733 1.00 0.00 H new ATOM 0 HB3 SER A 34 2.910 8.502 -3.688 1.00 0.00 H new ATOM 0 HG SER A 34 3.561 10.854 -4.294 1.00 0.00 H new ATOM 477 N PHE A 35 0.713 6.681 -3.936 1.00 0.00 N ATOM 478 CA PHE A 35 0.376 5.384 -3.360 1.00 0.00 C ATOM 479 C PHE A 35 1.204 4.273 -4.000 1.00 0.00 C ATOM 480 O PHE A 35 1.794 4.459 -5.065 1.00 0.00 O ATOM 481 CB PHE A 35 -1.115 5.093 -3.540 1.00 0.00 C ATOM 482 CG PHE A 35 -1.466 4.590 -4.911 1.00 0.00 C ATOM 483 CD1 PHE A 35 -1.559 5.464 -5.982 1.00 0.00 C ATOM 484 CD2 PHE A 35 -1.703 3.242 -5.129 1.00 0.00 C ATOM 485 CE1 PHE A 35 -1.881 5.003 -7.245 1.00 0.00 C ATOM 486 CE2 PHE A 35 -2.025 2.776 -6.389 1.00 0.00 C ATOM 487 CZ PHE A 35 -2.116 3.658 -7.449 1.00 0.00 C ATOM 0 H PHE A 35 1.150 6.633 -4.856 1.00 0.00 H new ATOM 0 HA PHE A 35 0.606 5.417 -2.295 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -1.425 4.355 -2.800 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -1.681 6.002 -3.339 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -1.378 6.518 -5.828 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -1.635 2.548 -4.304 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -1.949 5.695 -8.072 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -2.206 1.723 -6.546 1.00 0.00 H new ATOM 0 HZ PHE A 35 -2.370 3.296 -8.434 1.00 0.00 H new ATOM 497 N LEU A 36 1.242 3.119 -3.344 1.00 0.00 N ATOM 498 CA LEU A 36 1.997 1.977 -3.847 1.00 0.00 C ATOM 499 C LEU A 36 1.615 0.701 -3.104 1.00 0.00 C ATOM 500 O LEU A 36 0.962 0.749 -2.062 1.00 0.00 O ATOM 501 CB LEU A 36 3.499 2.232 -3.708 1.00 0.00 C ATOM 502 CG LEU A 36 4.025 2.375 -2.280 1.00 0.00 C ATOM 503 CD1 LEU A 36 4.441 1.020 -1.726 1.00 0.00 C ATOM 504 CD2 LEU A 36 5.192 3.351 -2.236 1.00 0.00 C ATOM 0 H LEU A 36 0.759 2.949 -2.462 1.00 0.00 H new ATOM 0 HA LEU A 36 1.753 1.848 -4.901 1.00 0.00 H new ATOM 0 HB2 LEU A 36 4.033 1.413 -4.190 1.00 0.00 H new ATOM 0 HB3 LEU A 36 3.746 3.140 -4.258 1.00 0.00 H new ATOM 0 HG LEU A 36 3.223 2.770 -1.656 1.00 0.00 H new ATOM 0 HD11 LEU A 36 4.813 1.141 -0.709 1.00 0.00 H new ATOM 0 HD12 LEU A 36 3.581 0.350 -1.721 1.00 0.00 H new ATOM 0 HD13 LEU A 36 5.227 0.597 -2.351 1.00 0.00 H new ATOM 0 HD21 LEU A 36 5.553 3.440 -1.212 1.00 0.00 H new ATOM 0 HD22 LEU A 36 5.996 2.985 -2.874 1.00 0.00 H new ATOM 0 HD23 LEU A 36 4.863 4.328 -2.591 1.00 0.00 H new ATOM 516 N VAL A 37 2.028 -0.440 -3.647 1.00 0.00 N ATOM 517 CA VAL A 37 1.733 -1.729 -3.033 1.00 0.00 C ATOM 518 C VAL A 37 2.993 -2.576 -2.898 1.00 0.00 C ATOM 519 O VAL A 37 3.955 -2.399 -3.646 1.00 0.00 O ATOM 520 CB VAL A 37 0.687 -2.512 -3.849 1.00 0.00 C ATOM 521 CG1 VAL A 37 0.282 -3.784 -3.119 1.00 0.00 C ATOM 522 CG2 VAL A 37 -0.527 -1.642 -4.134 1.00 0.00 C ATOM 0 H VAL A 37 2.568 -0.498 -4.511 1.00 0.00 H new ATOM 0 HA VAL A 37 1.331 -1.522 -2.041 1.00 0.00 H new ATOM 0 HB VAL A 37 1.134 -2.795 -4.802 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -0.457 -4.323 -3.711 1.00 0.00 H new ATOM 0 HG12 VAL A 37 1.159 -4.414 -2.972 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -0.146 -3.527 -2.150 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -1.255 -2.212 -4.711 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -0.977 -1.326 -3.193 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -0.220 -0.764 -4.702 1.00 0.00 H new ATOM 532 N ARG A 38 2.982 -3.496 -1.939 1.00 0.00 N ATOM 533 CA ARG A 38 4.125 -4.370 -1.705 1.00 0.00 C ATOM 534 C ARG A 38 3.692 -5.657 -1.010 1.00 0.00 C ATOM 535 O ARG A 38 2.608 -5.728 -0.432 1.00 0.00 O ATOM 536 CB ARG A 38 5.179 -3.651 -0.860 1.00 0.00 C ATOM 537 CG ARG A 38 4.826 -3.572 0.616 1.00 0.00 C ATOM 538 CD ARG A 38 6.044 -3.238 1.463 1.00 0.00 C ATOM 539 NE ARG A 38 5.875 -3.656 2.852 1.00 0.00 N ATOM 540 CZ ARG A 38 5.009 -3.095 3.688 1.00 0.00 C ATOM 541 NH1 ARG A 38 4.236 -2.098 3.278 1.00 0.00 N ATOM 542 NH2 ARG A 38 4.913 -3.530 4.938 1.00 0.00 N ATOM 0 H ARG A 38 2.194 -3.655 -1.311 1.00 0.00 H new ATOM 0 HA ARG A 38 4.558 -4.627 -2.672 1.00 0.00 H new ATOM 0 HB2 ARG A 38 6.133 -4.166 -0.970 1.00 0.00 H new ATOM 0 HB3 ARG A 38 5.315 -2.641 -1.247 1.00 0.00 H new ATOM 0 HG2 ARG A 38 4.057 -2.814 0.767 1.00 0.00 H new ATOM 0 HG3 ARG A 38 4.405 -4.523 0.942 1.00 0.00 H new ATOM 0 HD2 ARG A 38 6.923 -3.726 1.042 1.00 0.00 H new ATOM 0 HD3 ARG A 38 6.227 -2.164 1.427 1.00 0.00 H new ATOM 0 HE ARG A 38 6.454 -4.421 3.199 1.00 0.00 H new ATOM 0 HH11 ARG A 38 4.306 -1.760 2.318 1.00 0.00 H new ATOM 0 HH12 ARG A 38 3.572 -1.669 3.923 1.00 0.00 H new ATOM 0 HH21 ARG A 38 5.505 -4.296 5.258 1.00 0.00 H new ATOM 0 HH22 ARG A 38 4.247 -3.098 5.579 1.00 0.00 H new ATOM 556 N ALA A 39 4.547 -6.673 -1.071 1.00 0.00 N ATOM 557 CA ALA A 39 4.253 -7.957 -0.446 1.00 0.00 C ATOM 558 C ALA A 39 4.574 -7.928 1.044 1.00 0.00 C ATOM 559 O ALA A 39 5.714 -7.685 1.439 1.00 0.00 O ATOM 560 CB ALA A 39 5.031 -9.069 -1.135 1.00 0.00 C ATOM 0 H ALA A 39 5.448 -6.632 -1.547 1.00 0.00 H new ATOM 0 HA ALA A 39 3.186 -8.152 -0.557 1.00 0.00 H new ATOM 0 HB1 ALA A 39 4.802 -10.022 -0.658 1.00 0.00 H new ATOM 0 HB2 ALA A 39 4.749 -9.112 -2.187 1.00 0.00 H new ATOM 0 HB3 ALA A 39 6.100 -8.870 -1.054 1.00 0.00 H new ATOM 566 N SER A 40 3.561 -8.178 1.868 1.00 0.00 N ATOM 567 CA SER A 40 3.734 -8.176 3.316 1.00 0.00 C ATOM 568 C SER A 40 4.782 -9.202 3.738 1.00 0.00 C ATOM 569 O SER A 40 4.680 -10.382 3.404 1.00 0.00 O ATOM 570 CB SER A 40 2.404 -8.473 4.010 1.00 0.00 C ATOM 571 OG SER A 40 2.588 -8.672 5.401 1.00 0.00 O ATOM 0 H SER A 40 2.612 -8.385 1.557 1.00 0.00 H new ATOM 0 HA SER A 40 4.078 -7.186 3.616 1.00 0.00 H new ATOM 0 HB2 SER A 40 1.712 -7.647 3.846 1.00 0.00 H new ATOM 0 HB3 SER A 40 1.950 -9.361 3.569 1.00 0.00 H new ATOM 0 HG SER A 40 1.723 -8.859 5.822 1.00 0.00 H new ATOM 577 N GLU A 41 5.788 -8.742 4.475 1.00 0.00 N ATOM 578 CA GLU A 41 6.854 -9.619 4.943 1.00 0.00 C ATOM 579 C GLU A 41 6.293 -10.747 5.804 1.00 0.00 C ATOM 580 O GLU A 41 6.532 -11.925 5.537 1.00 0.00 O ATOM 581 CB GLU A 41 7.889 -8.821 5.740 1.00 0.00 C ATOM 582 CG GLU A 41 8.483 -7.655 4.968 1.00 0.00 C ATOM 583 CD GLU A 41 9.131 -6.626 5.874 1.00 0.00 C ATOM 584 OE1 GLU A 41 10.146 -6.960 6.520 1.00 0.00 O ATOM 585 OE2 GLU A 41 8.623 -5.487 5.938 1.00 0.00 O ATOM 0 H GLU A 41 5.887 -7.768 4.761 1.00 0.00 H new ATOM 0 HA GLU A 41 7.337 -10.058 4.070 1.00 0.00 H new ATOM 0 HB2 GLU A 41 7.423 -8.444 6.650 1.00 0.00 H new ATOM 0 HB3 GLU A 41 8.693 -9.490 6.048 1.00 0.00 H new ATOM 0 HG2 GLU A 41 9.224 -8.031 4.263 1.00 0.00 H new ATOM 0 HG3 GLU A 41 7.699 -7.175 4.382 1.00 0.00 H new ATOM 592 N SER A 42 5.546 -10.377 6.840 1.00 0.00 N ATOM 593 CA SER A 42 4.954 -11.356 7.744 1.00 0.00 C ATOM 594 C SER A 42 4.296 -12.489 6.962 1.00 0.00 C ATOM 595 O SER A 42 4.711 -13.645 7.055 1.00 0.00 O ATOM 596 CB SER A 42 3.924 -10.684 8.654 1.00 0.00 C ATOM 597 OG SER A 42 4.530 -9.691 9.463 1.00 0.00 O ATOM 0 H SER A 42 5.337 -9.406 7.074 1.00 0.00 H new ATOM 0 HA SER A 42 5.751 -11.776 8.358 1.00 0.00 H new ATOM 0 HB2 SER A 42 3.137 -10.234 8.048 1.00 0.00 H new ATOM 0 HB3 SER A 42 3.449 -11.434 9.287 1.00 0.00 H new ATOM 0 HG SER A 42 3.851 -9.275 10.034 1.00 0.00 H new ATOM 603 N ILE A 43 3.268 -12.149 6.192 1.00 0.00 N ATOM 604 CA ILE A 43 2.553 -13.136 5.393 1.00 0.00 C ATOM 605 C ILE A 43 2.506 -12.726 3.925 1.00 0.00 C ATOM 606 O ILE A 43 2.054 -11.631 3.590 1.00 0.00 O ATOM 607 CB ILE A 43 1.114 -13.338 5.904 1.00 0.00 C ATOM 608 CG1 ILE A 43 1.129 -13.864 7.341 1.00 0.00 C ATOM 609 CG2 ILE A 43 0.358 -14.293 4.992 1.00 0.00 C ATOM 610 CD1 ILE A 43 -0.222 -13.810 8.018 1.00 0.00 C ATOM 0 H ILE A 43 2.912 -11.197 6.105 1.00 0.00 H new ATOM 0 HA ILE A 43 3.099 -14.074 5.488 1.00 0.00 H new ATOM 0 HB ILE A 43 0.602 -12.376 5.895 1.00 0.00 H new ATOM 0 HG12 ILE A 43 1.484 -14.895 7.338 1.00 0.00 H new ATOM 0 HG13 ILE A 43 1.842 -13.282 7.925 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -0.657 -14.426 5.366 1.00 0.00 H new ATOM 0 HG22 ILE A 43 0.322 -13.881 3.983 1.00 0.00 H new ATOM 0 HG23 ILE A 43 0.867 -15.257 4.973 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -0.136 -14.198 9.033 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -0.571 -12.778 8.053 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -0.934 -14.415 7.457 1.00 0.00 H new ATOM 622 N SER A 44 2.975 -13.612 3.053 1.00 0.00 N ATOM 623 CA SER A 44 2.989 -13.342 1.620 1.00 0.00 C ATOM 624 C SER A 44 1.569 -13.278 1.066 1.00 0.00 C ATOM 625 O SER A 44 1.246 -12.411 0.254 1.00 0.00 O ATOM 626 CB SER A 44 3.787 -14.419 0.884 1.00 0.00 C ATOM 627 OG SER A 44 3.337 -15.716 1.233 1.00 0.00 O ATOM 0 H SER A 44 3.351 -14.524 3.314 1.00 0.00 H new ATOM 0 HA SER A 44 3.467 -12.375 1.462 1.00 0.00 H new ATOM 0 HB2 SER A 44 3.691 -14.275 -0.192 1.00 0.00 H new ATOM 0 HB3 SER A 44 4.845 -14.321 1.126 1.00 0.00 H new ATOM 0 HG SER A 44 3.862 -16.386 0.748 1.00 0.00 H new ATOM 633 N ARG A 45 0.724 -14.203 1.511 1.00 0.00 N ATOM 634 CA ARG A 45 -0.661 -14.253 1.060 1.00 0.00 C ATOM 635 C ARG A 45 -1.330 -12.889 1.203 1.00 0.00 C ATOM 636 O ARG A 45 -2.340 -12.611 0.558 1.00 0.00 O ATOM 637 CB ARG A 45 -1.441 -15.301 1.855 1.00 0.00 C ATOM 638 CG ARG A 45 -1.190 -16.727 1.394 1.00 0.00 C ATOM 639 CD ARG A 45 -2.101 -17.713 2.109 1.00 0.00 C ATOM 640 NE ARG A 45 -3.511 -17.367 1.953 1.00 0.00 N ATOM 641 CZ ARG A 45 -4.488 -17.936 2.650 1.00 0.00 C ATOM 642 NH1 ARG A 45 -4.210 -18.872 3.546 1.00 0.00 N ATOM 643 NH2 ARG A 45 -5.748 -17.567 2.452 1.00 0.00 N ATOM 0 H ARG A 45 0.975 -14.928 2.183 1.00 0.00 H new ATOM 0 HA ARG A 45 -0.663 -14.530 0.006 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -1.175 -15.217 2.909 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -2.507 -15.085 1.777 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -1.351 -16.796 0.318 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -0.149 -16.992 1.579 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -1.928 -18.716 1.718 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -1.849 -17.737 3.169 1.00 0.00 H new ATOM 0 HE ARG A 45 -3.759 -16.649 1.272 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -3.243 -19.157 3.702 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -4.963 -19.307 4.080 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -5.966 -16.846 1.764 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -6.498 -18.004 2.988 1.00 0.00 H new ATOM 657 N ALA A 46 -0.758 -12.042 2.053 1.00 0.00 N ATOM 658 CA ALA A 46 -1.298 -10.707 2.280 1.00 0.00 C ATOM 659 C ALA A 46 -0.456 -9.648 1.575 1.00 0.00 C ATOM 660 O ALA A 46 0.678 -9.909 1.174 1.00 0.00 O ATOM 661 CB ALA A 46 -1.376 -10.416 3.771 1.00 0.00 C ATOM 0 H ALA A 46 0.079 -12.257 2.595 1.00 0.00 H new ATOM 0 HA ALA A 46 -2.304 -10.672 1.862 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -1.781 -9.416 3.926 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -2.025 -11.149 4.251 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -0.378 -10.475 4.206 1.00 0.00 H new ATOM 667 N TYR A 47 -1.019 -8.454 1.428 1.00 0.00 N ATOM 668 CA TYR A 47 -0.321 -7.356 0.769 1.00 0.00 C ATOM 669 C TYR A 47 -0.234 -6.138 1.684 1.00 0.00 C ATOM 670 O TYR A 47 -0.757 -6.147 2.798 1.00 0.00 O ATOM 671 CB TYR A 47 -1.031 -6.980 -0.532 1.00 0.00 C ATOM 672 CG TYR A 47 -0.705 -7.901 -1.687 1.00 0.00 C ATOM 673 CD1 TYR A 47 0.444 -7.716 -2.446 1.00 0.00 C ATOM 674 CD2 TYR A 47 -1.547 -8.955 -2.019 1.00 0.00 C ATOM 675 CE1 TYR A 47 0.745 -8.554 -3.502 1.00 0.00 C ATOM 676 CE2 TYR A 47 -1.253 -9.799 -3.073 1.00 0.00 C ATOM 677 CZ TYR A 47 -0.107 -9.594 -3.811 1.00 0.00 C ATOM 678 OH TYR A 47 0.190 -10.431 -4.862 1.00 0.00 O ATOM 0 H TYR A 47 -1.956 -8.222 1.756 1.00 0.00 H new ATOM 0 HA TYR A 47 0.691 -7.689 0.540 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -2.108 -6.988 -0.364 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -0.759 -5.960 -0.803 1.00 0.00 H new ATOM 0 HD1 TYR A 47 1.113 -6.903 -2.206 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -2.446 -9.117 -1.444 1.00 0.00 H new ATOM 0 HE1 TYR A 47 1.642 -8.396 -4.082 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -1.917 -10.615 -3.317 1.00 0.00 H new ATOM 0 HH TYR A 47 -0.510 -11.112 -4.946 1.00 0.00 H new ATOM 688 N ALA A 48 0.430 -5.092 1.205 1.00 0.00 N ATOM 689 CA ALA A 48 0.584 -3.865 1.977 1.00 0.00 C ATOM 690 C ALA A 48 0.452 -2.635 1.085 1.00 0.00 C ATOM 691 O ALA A 48 1.282 -2.403 0.204 1.00 0.00 O ATOM 692 CB ALA A 48 1.925 -3.858 2.695 1.00 0.00 C ATOM 0 H ALA A 48 0.870 -5.069 0.285 1.00 0.00 H new ATOM 0 HA ALA A 48 -0.213 -3.830 2.720 1.00 0.00 H new ATOM 0 HB1 ALA A 48 2.026 -2.936 3.267 1.00 0.00 H new ATOM 0 HB2 ALA A 48 1.981 -4.712 3.370 1.00 0.00 H new ATOM 0 HB3 ALA A 48 2.730 -3.921 1.963 1.00 0.00 H new ATOM 698 N LEU A 49 -0.594 -1.851 1.318 1.00 0.00 N ATOM 699 CA LEU A 49 -0.834 -0.644 0.534 1.00 0.00 C ATOM 700 C LEU A 49 -0.423 0.602 1.313 1.00 0.00 C ATOM 701 O LEU A 49 -0.974 0.891 2.377 1.00 0.00 O ATOM 702 CB LEU A 49 -2.311 -0.551 0.144 1.00 0.00 C ATOM 703 CG LEU A 49 -2.790 0.815 -0.350 1.00 0.00 C ATOM 704 CD1 LEU A 49 -2.118 1.172 -1.667 1.00 0.00 C ATOM 705 CD2 LEU A 49 -4.304 0.826 -0.502 1.00 0.00 C ATOM 0 H LEU A 49 -1.289 -2.029 2.043 1.00 0.00 H new ATOM 0 HA LEU A 49 -0.228 -0.701 -0.370 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -2.507 -1.286 -0.636 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -2.913 -0.834 1.008 1.00 0.00 H new ATOM 0 HG LEU A 49 -2.513 1.565 0.391 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -2.471 2.147 -2.003 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -1.038 1.206 -1.527 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -2.363 0.419 -2.416 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -4.627 1.806 -0.854 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -4.603 0.065 -1.222 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -4.768 0.616 0.462 1.00 0.00 H new ATOM 717 N CYS A 50 0.544 1.336 0.776 1.00 0.00 N ATOM 718 CA CYS A 50 1.028 2.552 1.420 1.00 0.00 C ATOM 719 C CYS A 50 0.465 3.792 0.734 1.00 0.00 C ATOM 720 O CYS A 50 0.480 3.897 -0.493 1.00 0.00 O ATOM 721 CB CYS A 50 2.557 2.592 1.398 1.00 0.00 C ATOM 722 SG CYS A 50 3.343 1.355 2.457 1.00 0.00 S ATOM 0 H CYS A 50 1.009 1.111 -0.104 1.00 0.00 H new ATOM 0 HA CYS A 50 0.687 2.545 2.455 1.00 0.00 H new ATOM 0 HB2 CYS A 50 2.899 2.447 0.373 1.00 0.00 H new ATOM 0 HB3 CYS A 50 2.888 3.583 1.708 1.00 0.00 H new ATOM 0 HG CYS A 50 4.237 1.930 3.206 1.00 0.00 H new ATOM 728 N VAL A 51 -0.034 4.730 1.533 1.00 0.00 N ATOM 729 CA VAL A 51 -0.604 5.963 1.003 1.00 0.00 C ATOM 730 C VAL A 51 -0.026 7.183 1.711 1.00 0.00 C ATOM 731 O VAL A 51 -0.158 7.330 2.927 1.00 0.00 O ATOM 732 CB VAL A 51 -2.137 5.979 1.144 1.00 0.00 C ATOM 733 CG1 VAL A 51 -2.697 7.334 0.738 1.00 0.00 C ATOM 734 CG2 VAL A 51 -2.760 4.865 0.316 1.00 0.00 C ATOM 0 H VAL A 51 -0.055 4.659 2.550 1.00 0.00 H new ATOM 0 HA VAL A 51 -0.344 6.003 -0.055 1.00 0.00 H new ATOM 0 HB VAL A 51 -2.390 5.807 2.190 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -3.782 7.326 0.844 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -2.275 8.109 1.378 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -2.436 7.539 -0.300 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -3.844 4.891 0.428 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -2.500 5.003 -0.734 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -2.383 3.902 0.660 1.00 0.00 H new ATOM 744 N LEU A 52 0.613 8.058 0.942 1.00 0.00 N ATOM 745 CA LEU A 52 1.212 9.268 1.495 1.00 0.00 C ATOM 746 C LEU A 52 0.191 10.400 1.559 1.00 0.00 C ATOM 747 O LEU A 52 -0.628 10.563 0.654 1.00 0.00 O ATOM 748 CB LEU A 52 2.414 9.698 0.652 1.00 0.00 C ATOM 749 CG LEU A 52 3.308 10.778 1.261 1.00 0.00 C ATOM 750 CD1 LEU A 52 4.274 10.169 2.265 1.00 0.00 C ATOM 751 CD2 LEU A 52 4.068 11.518 0.169 1.00 0.00 C ATOM 0 H LEU A 52 0.730 7.952 -0.066 1.00 0.00 H new ATOM 0 HA LEU A 52 1.547 9.047 2.508 1.00 0.00 H new ATOM 0 HB2 LEU A 52 3.026 8.818 0.452 1.00 0.00 H new ATOM 0 HB3 LEU A 52 2.048 10.057 -0.310 1.00 0.00 H new ATOM 0 HG LEU A 52 2.675 11.493 1.786 1.00 0.00 H new ATOM 0 HD11 LEU A 52 4.902 10.953 2.688 1.00 0.00 H new ATOM 0 HD12 LEU A 52 3.712 9.685 3.063 1.00 0.00 H new ATOM 0 HD13 LEU A 52 4.902 9.432 1.765 1.00 0.00 H new ATOM 0 HD21 LEU A 52 4.700 12.283 0.620 1.00 0.00 H new ATOM 0 HD22 LEU A 52 4.690 10.813 -0.383 1.00 0.00 H new ATOM 0 HD23 LEU A 52 3.359 11.988 -0.513 1.00 0.00 H new ATOM 763 N TYR A 53 0.247 11.180 2.633 1.00 0.00 N ATOM 764 CA TYR A 53 -0.673 12.297 2.815 1.00 0.00 C ATOM 765 C TYR A 53 -0.178 13.237 3.910 1.00 0.00 C ATOM 766 O TYR A 53 0.141 12.805 5.017 1.00 0.00 O ATOM 767 CB TYR A 53 -2.071 11.782 3.162 1.00 0.00 C ATOM 768 CG TYR A 53 -3.085 12.882 3.380 1.00 0.00 C ATOM 769 CD1 TYR A 53 -3.634 13.570 2.304 1.00 0.00 C ATOM 770 CD2 TYR A 53 -3.493 13.235 4.660 1.00 0.00 C ATOM 771 CE1 TYR A 53 -4.560 14.577 2.497 1.00 0.00 C ATOM 772 CE2 TYR A 53 -4.420 14.240 4.862 1.00 0.00 C ATOM 773 CZ TYR A 53 -4.950 14.908 3.778 1.00 0.00 C ATOM 774 OH TYR A 53 -5.872 15.909 3.976 1.00 0.00 O ATOM 0 H TYR A 53 0.919 11.060 3.390 1.00 0.00 H new ATOM 0 HA TYR A 53 -0.720 12.853 1.878 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -2.419 11.132 2.359 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -2.011 11.171 4.063 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -3.331 13.313 1.300 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -3.079 12.715 5.512 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -4.976 15.102 1.650 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -4.728 14.501 5.864 1.00 0.00 H new ATOM 0 HH TYR A 53 -6.038 16.016 4.936 1.00 0.00 H new ATOM 784 N ARG A 54 -0.118 14.526 3.591 1.00 0.00 N ATOM 785 CA ARG A 54 0.338 15.528 4.546 1.00 0.00 C ATOM 786 C ARG A 54 1.631 15.085 5.225 1.00 0.00 C ATOM 787 O ARG A 54 1.834 15.327 6.414 1.00 0.00 O ATOM 788 CB ARG A 54 -0.741 15.788 5.600 1.00 0.00 C ATOM 789 CG ARG A 54 -1.913 16.606 5.083 1.00 0.00 C ATOM 790 CD ARG A 54 -2.587 17.382 6.203 1.00 0.00 C ATOM 791 NE ARG A 54 -3.659 18.241 5.706 1.00 0.00 N ATOM 792 CZ ARG A 54 -4.197 19.228 6.413 1.00 0.00 C ATOM 793 NH1 ARG A 54 -3.766 19.480 7.641 1.00 0.00 N ATOM 794 NH2 ARG A 54 -5.169 19.966 5.891 1.00 0.00 N ATOM 0 H ARG A 54 -0.379 14.900 2.679 1.00 0.00 H new ATOM 0 HA ARG A 54 0.533 16.451 4.000 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -1.112 14.833 5.972 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -0.292 16.307 6.447 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -1.565 17.299 4.317 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -2.639 15.945 4.609 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -2.992 16.683 6.935 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -1.845 17.991 6.720 1.00 0.00 H new ATOM 0 HE ARG A 54 -4.014 18.073 4.764 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -3.019 18.915 8.045 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -4.181 20.239 8.182 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -5.503 19.775 4.946 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -5.582 20.724 6.435 1.00 0.00 H new ATOM 808 N ASN A 55 2.501 14.433 4.460 1.00 0.00 N ATOM 809 CA ASN A 55 3.773 13.954 4.988 1.00 0.00 C ATOM 810 C ASN A 55 3.554 12.847 6.015 1.00 0.00 C ATOM 811 O ASN A 55 4.091 12.899 7.122 1.00 0.00 O ATOM 812 CB ASN A 55 4.552 15.108 5.623 1.00 0.00 C ATOM 813 CG ASN A 55 4.674 16.302 4.696 1.00 0.00 C ATOM 814 OD1 ASN A 55 3.664 17.164 4.707 1.00 0.00 O flip ATOM 815 ND2 ASN A 55 5.665 16.447 3.980 1.00 0.00 N flip ATOM 0 H ASN A 55 2.348 14.225 3.473 1.00 0.00 H new ATOM 0 HA ASN A 55 4.352 13.546 4.159 1.00 0.00 H new ATOM 0 HB2 ASN A 55 4.055 15.415 6.543 1.00 0.00 H new ATOM 0 HB3 ASN A 55 5.548 14.762 5.899 1.00 0.00 H new ATOM 0 HD21 ASN A 55 6.417 15.759 4.005 1.00 0.00 H new ATOM 0 HD22 ASN A 55 5.734 17.256 3.362 1.00 0.00 H new ATOM 822 N CYS A 56 2.764 11.848 5.640 1.00 0.00 N ATOM 823 CA CYS A 56 2.473 10.728 6.528 1.00 0.00 C ATOM 824 C CYS A 56 2.158 9.468 5.729 1.00 0.00 C ATOM 825 O CYS A 56 1.265 9.464 4.883 1.00 0.00 O ATOM 826 CB CYS A 56 1.300 11.070 7.448 1.00 0.00 C ATOM 827 SG CYS A 56 1.769 11.989 8.933 1.00 0.00 S ATOM 0 H CYS A 56 2.313 11.790 4.727 1.00 0.00 H new ATOM 0 HA CYS A 56 3.358 10.539 7.135 1.00 0.00 H new ATOM 0 HB2 CYS A 56 0.571 11.655 6.887 1.00 0.00 H new ATOM 0 HB3 CYS A 56 0.805 10.146 7.747 1.00 0.00 H new ATOM 0 HG CYS A 56 2.859 12.659 8.702 1.00 0.00 H new ATOM 833 N VAL A 57 2.900 8.399 6.003 1.00 0.00 N ATOM 834 CA VAL A 57 2.700 7.132 5.310 1.00 0.00 C ATOM 835 C VAL A 57 1.693 6.255 6.045 1.00 0.00 C ATOM 836 O VAL A 57 1.912 5.870 7.194 1.00 0.00 O ATOM 837 CB VAL A 57 4.024 6.359 5.160 1.00 0.00 C ATOM 838 CG1 VAL A 57 3.810 5.081 4.364 1.00 0.00 C ATOM 839 CG2 VAL A 57 5.081 7.235 4.504 1.00 0.00 C ATOM 0 H VAL A 57 3.645 8.386 6.700 1.00 0.00 H new ATOM 0 HA VAL A 57 2.313 7.372 4.320 1.00 0.00 H new ATOM 0 HB VAL A 57 4.378 6.084 6.154 1.00 0.00 H new ATOM 0 HG11 VAL A 57 4.757 4.549 4.269 1.00 0.00 H new ATOM 0 HG12 VAL A 57 3.088 4.448 4.880 1.00 0.00 H new ATOM 0 HG13 VAL A 57 3.432 5.329 3.372 1.00 0.00 H new ATOM 0 HG21 VAL A 57 6.010 6.673 4.406 1.00 0.00 H new ATOM 0 HG22 VAL A 57 4.737 7.543 3.516 1.00 0.00 H new ATOM 0 HG23 VAL A 57 5.255 8.118 5.119 1.00 0.00 H new ATOM 849 N TYR A 58 0.589 5.944 5.376 1.00 0.00 N ATOM 850 CA TYR A 58 -0.454 5.114 5.967 1.00 0.00 C ATOM 851 C TYR A 58 -0.483 3.733 5.319 1.00 0.00 C ATOM 852 O TYR A 58 -1.008 3.560 4.219 1.00 0.00 O ATOM 853 CB TYR A 58 -1.819 5.789 5.817 1.00 0.00 C ATOM 854 CG TYR A 58 -1.934 7.096 6.568 1.00 0.00 C ATOM 855 CD1 TYR A 58 -1.317 8.248 6.095 1.00 0.00 C ATOM 856 CD2 TYR A 58 -2.658 7.179 7.750 1.00 0.00 C ATOM 857 CE1 TYR A 58 -1.419 9.444 6.778 1.00 0.00 C ATOM 858 CE2 TYR A 58 -2.766 8.371 8.439 1.00 0.00 C ATOM 859 CZ TYR A 58 -2.145 9.501 7.950 1.00 0.00 C ATOM 860 OH TYR A 58 -2.249 10.690 8.634 1.00 0.00 O ATOM 0 H TYR A 58 0.393 6.254 4.424 1.00 0.00 H new ATOM 0 HA TYR A 58 -0.230 4.994 7.027 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -2.012 5.969 4.759 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -2.593 5.107 6.170 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -0.748 8.207 5.178 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -3.145 6.296 8.137 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -0.933 10.330 6.397 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -3.334 8.418 9.356 1.00 0.00 H new ATOM 0 HH TYR A 58 -2.795 10.559 9.437 1.00 0.00 H new ATOM 870 N THR A 59 0.084 2.749 6.011 1.00 0.00 N ATOM 871 CA THR A 59 0.125 1.383 5.506 1.00 0.00 C ATOM 872 C THR A 59 -1.203 0.672 5.737 1.00 0.00 C ATOM 873 O THR A 59 -1.878 0.906 6.740 1.00 0.00 O ATOM 874 CB THR A 59 1.252 0.571 6.172 1.00 0.00 C ATOM 875 OG1 THR A 59 2.348 1.432 6.499 1.00 0.00 O ATOM 876 CG2 THR A 59 1.732 -0.543 5.253 1.00 0.00 C ATOM 0 H THR A 59 0.522 2.874 6.924 1.00 0.00 H new ATOM 0 HA THR A 59 0.318 1.448 4.435 1.00 0.00 H new ATOM 0 HB THR A 59 0.857 0.123 7.084 1.00 0.00 H new ATOM 0 HG1 THR A 59 3.060 0.909 6.924 1.00 0.00 H new ATOM 0 HG21 THR A 59 2.528 -1.103 5.745 1.00 0.00 H new ATOM 0 HG22 THR A 59 0.902 -1.213 5.029 1.00 0.00 H new ATOM 0 HG23 THR A 59 2.111 -0.112 4.326 1.00 0.00 H new ATOM 884 N TYR A 60 -1.573 -0.198 4.803 1.00 0.00 N ATOM 885 CA TYR A 60 -2.822 -0.943 4.905 1.00 0.00 C ATOM 886 C TYR A 60 -2.601 -2.422 4.605 1.00 0.00 C ATOM 887 O TYR A 60 -2.216 -2.791 3.496 1.00 0.00 O ATOM 888 CB TYR A 60 -3.863 -0.367 3.943 1.00 0.00 C ATOM 889 CG TYR A 60 -4.487 0.923 4.427 1.00 0.00 C ATOM 890 CD1 TYR A 60 -5.473 0.917 5.406 1.00 0.00 C ATOM 891 CD2 TYR A 60 -4.088 2.148 3.906 1.00 0.00 C ATOM 892 CE1 TYR A 60 -6.045 2.093 5.850 1.00 0.00 C ATOM 893 CE2 TYR A 60 -4.654 3.329 4.345 1.00 0.00 C ATOM 894 CZ TYR A 60 -5.632 3.297 5.317 1.00 0.00 C ATOM 895 OH TYR A 60 -6.199 4.470 5.758 1.00 0.00 O ATOM 0 H TYR A 60 -1.026 -0.404 3.967 1.00 0.00 H new ATOM 0 HA TYR A 60 -3.189 -0.849 5.927 1.00 0.00 H new ATOM 0 HB2 TYR A 60 -3.394 -0.193 2.975 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -4.650 -1.105 3.788 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -5.798 -0.023 5.827 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -3.322 2.177 3.145 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -6.812 2.070 6.610 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -4.332 4.273 3.929 1.00 0.00 H new ATOM 0 HH TYR A 60 -5.796 5.227 5.283 1.00 0.00 H new ATOM 905 N ARG A 61 -2.847 -3.264 5.603 1.00 0.00 N ATOM 906 CA ARG A 61 -2.674 -4.704 5.449 1.00 0.00 C ATOM 907 C ARG A 61 -3.863 -5.319 4.717 1.00 0.00 C ATOM 908 O ARG A 61 -5.017 -5.029 5.035 1.00 0.00 O ATOM 909 CB ARG A 61 -2.503 -5.368 6.816 1.00 0.00 C ATOM 910 CG ARG A 61 -3.769 -5.363 7.658 1.00 0.00 C ATOM 911 CD ARG A 61 -3.582 -6.143 8.950 1.00 0.00 C ATOM 912 NE ARG A 61 -4.414 -5.621 10.030 1.00 0.00 N ATOM 913 CZ ARG A 61 -4.688 -6.297 11.140 1.00 0.00 C ATOM 914 NH1 ARG A 61 -4.197 -7.517 11.315 1.00 0.00 N ATOM 915 NH2 ARG A 61 -5.453 -5.754 12.078 1.00 0.00 N ATOM 0 H ARG A 61 -3.167 -2.974 6.527 1.00 0.00 H new ATOM 0 HA ARG A 61 -1.776 -4.875 4.855 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -2.177 -6.398 6.672 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -1.711 -4.856 7.363 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -4.049 -4.335 7.889 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -4.590 -5.796 7.086 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -3.826 -7.191 8.779 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -2.534 -6.104 9.248 1.00 0.00 H new ATOM 0 HE ARG A 61 -4.807 -4.685 9.926 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -3.608 -7.938 10.596 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -4.409 -8.034 12.168 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -5.832 -4.816 11.947 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -5.662 -6.275 12.930 1.00 0.00 H new ATOM 929 N ILE A 62 -3.574 -6.167 3.737 1.00 0.00 N ATOM 930 CA ILE A 62 -4.619 -6.823 2.961 1.00 0.00 C ATOM 931 C ILE A 62 -4.589 -8.334 3.164 1.00 0.00 C ATOM 932 O ILE A 62 -3.796 -9.039 2.540 1.00 0.00 O ATOM 933 CB ILE A 62 -4.482 -6.515 1.458 1.00 0.00 C ATOM 934 CG1 ILE A 62 -4.657 -5.017 1.204 1.00 0.00 C ATOM 935 CG2 ILE A 62 -5.499 -7.316 0.659 1.00 0.00 C ATOM 936 CD1 ILE A 62 -3.363 -4.237 1.275 1.00 0.00 C ATOM 0 H ILE A 62 -2.624 -6.416 3.461 1.00 0.00 H new ATOM 0 HA ILE A 62 -5.571 -6.430 3.319 1.00 0.00 H new ATOM 0 HB ILE A 62 -3.483 -6.805 1.132 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -5.105 -4.873 0.221 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -5.357 -4.612 1.935 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -5.390 -7.088 -0.401 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -5.331 -8.381 0.820 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -6.506 -7.054 0.985 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -3.563 -3.182 1.085 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -2.924 -4.350 2.266 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -2.668 -4.616 0.525 1.00 0.00 H new ATOM 948 N LEU A 63 -5.459 -8.825 4.040 1.00 0.00 N ATOM 949 CA LEU A 63 -5.534 -10.254 4.325 1.00 0.00 C ATOM 950 C LEU A 63 -6.479 -10.954 3.353 1.00 0.00 C ATOM 951 O LEU A 63 -7.497 -10.403 2.933 1.00 0.00 O ATOM 952 CB LEU A 63 -6.001 -10.483 5.763 1.00 0.00 C ATOM 953 CG LEU A 63 -4.950 -10.267 6.853 1.00 0.00 C ATOM 954 CD1 LEU A 63 -3.886 -11.352 6.791 1.00 0.00 C ATOM 955 CD2 LEU A 63 -4.317 -8.890 6.718 1.00 0.00 C ATOM 0 H LEU A 63 -6.122 -8.255 4.565 1.00 0.00 H new ATOM 0 HA LEU A 63 -4.537 -10.677 4.202 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -6.842 -9.819 5.961 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -6.375 -11.504 5.844 1.00 0.00 H new ATOM 0 HG LEU A 63 -5.444 -10.325 7.823 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -3.147 -11.182 7.574 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -4.351 -12.327 6.937 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -3.396 -11.326 5.818 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -3.572 -8.754 7.502 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -3.838 -8.804 5.743 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -5.087 -8.125 6.813 1.00 0.00 H new ATOM 967 N PRO A 64 -6.138 -12.198 2.989 1.00 0.00 N ATOM 968 CA PRO A 64 -6.944 -13.002 2.065 1.00 0.00 C ATOM 969 C PRO A 64 -8.268 -13.440 2.682 1.00 0.00 C ATOM 970 O PRO A 64 -8.410 -13.484 3.904 1.00 0.00 O ATOM 971 CB PRO A 64 -6.057 -14.217 1.784 1.00 0.00 C ATOM 972 CG PRO A 64 -5.175 -14.326 2.980 1.00 0.00 C ATOM 973 CD PRO A 64 -4.939 -12.918 3.450 1.00 0.00 C ATOM 0 HA PRO A 64 -7.218 -12.442 1.171 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -6.653 -15.119 1.648 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -5.474 -14.080 0.873 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -5.647 -14.924 3.760 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -4.235 -14.816 2.728 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -4.833 -12.869 4.534 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -4.029 -12.499 3.021 1.00 0.00 H new ATOM 981 N ASN A 65 -9.234 -13.765 1.830 1.00 0.00 N ATOM 982 CA ASN A 65 -10.547 -14.200 2.292 1.00 0.00 C ATOM 983 C ASN A 65 -10.798 -15.659 1.923 1.00 0.00 C ATOM 984 O ASN A 65 -10.049 -16.250 1.145 1.00 0.00 O ATOM 985 CB ASN A 65 -11.642 -13.315 1.692 1.00 0.00 C ATOM 986 CG ASN A 65 -12.929 -13.364 2.493 1.00 0.00 C ATOM 987 OD1 ASN A 65 -13.929 -13.927 2.047 1.00 0.00 O ATOM 988 ND2 ASN A 65 -12.909 -12.773 3.681 1.00 0.00 N ATOM 0 H ASN A 65 -9.133 -13.735 0.815 1.00 0.00 H new ATOM 0 HA ASN A 65 -10.570 -14.109 3.378 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -11.287 -12.286 1.643 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -11.842 -13.633 0.669 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -13.745 -12.773 4.265 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -12.057 -12.318 4.010 1.00 0.00 H new ATOM 995 N GLU A 66 -11.857 -16.233 2.486 1.00 0.00 N ATOM 996 CA GLU A 66 -12.205 -17.623 2.216 1.00 0.00 C ATOM 997 C GLU A 66 -12.080 -17.936 0.727 1.00 0.00 C ATOM 998 O GLU A 66 -11.662 -19.029 0.345 1.00 0.00 O ATOM 999 CB GLU A 66 -13.630 -17.916 2.691 1.00 0.00 C ATOM 1000 CG GLU A 66 -13.889 -19.388 2.965 1.00 0.00 C ATOM 1001 CD GLU A 66 -15.305 -19.653 3.439 1.00 0.00 C ATOM 1002 OE1 GLU A 66 -16.236 -19.544 2.614 1.00 0.00 O ATOM 1003 OE2 GLU A 66 -15.482 -19.968 4.634 1.00 0.00 O ATOM 0 H GLU A 66 -12.488 -15.757 3.131 1.00 0.00 H new ATOM 0 HA GLU A 66 -11.508 -18.258 2.763 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -13.826 -17.346 3.599 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -14.335 -17.566 1.937 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -13.700 -19.961 2.057 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -13.185 -19.743 3.718 1.00 0.00 H new ATOM 1010 N ASP A 67 -12.444 -16.968 -0.107 1.00 0.00 N ATOM 1011 CA ASP A 67 -12.372 -17.139 -1.554 1.00 0.00 C ATOM 1012 C ASP A 67 -11.092 -16.524 -2.110 1.00 0.00 C ATOM 1013 O ASP A 67 -11.087 -15.963 -3.206 1.00 0.00 O ATOM 1014 CB ASP A 67 -13.591 -16.505 -2.225 1.00 0.00 C ATOM 1015 CG ASP A 67 -14.794 -17.427 -2.232 1.00 0.00 C ATOM 1016 OD1 ASP A 67 -14.999 -18.143 -1.229 1.00 0.00 O ATOM 1017 OD2 ASP A 67 -15.531 -17.433 -3.239 1.00 0.00 O ATOM 0 H ASP A 67 -12.792 -16.057 0.194 1.00 0.00 H new ATOM 0 HA ASP A 67 -12.364 -18.207 -1.769 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -13.848 -15.581 -1.706 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -13.338 -16.235 -3.250 1.00 0.00 H new ATOM 1022 N ASP A 68 -10.009 -16.634 -1.348 1.00 0.00 N ATOM 1023 CA ASP A 68 -8.723 -16.089 -1.765 1.00 0.00 C ATOM 1024 C ASP A 68 -8.900 -14.730 -2.435 1.00 0.00 C ATOM 1025 O ASP A 68 -8.432 -14.511 -3.553 1.00 0.00 O ATOM 1026 CB ASP A 68 -8.021 -17.055 -2.721 1.00 0.00 C ATOM 1027 CG ASP A 68 -8.956 -17.601 -3.783 1.00 0.00 C ATOM 1028 OD1 ASP A 68 -9.693 -18.564 -3.486 1.00 0.00 O ATOM 1029 OD2 ASP A 68 -8.951 -17.063 -4.909 1.00 0.00 O ATOM 0 H ASP A 68 -9.997 -17.096 -0.439 1.00 0.00 H new ATOM 0 HA ASP A 68 -8.107 -15.958 -0.876 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -7.188 -16.543 -3.203 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -7.600 -17.883 -2.151 1.00 0.00 H new ATOM 1034 N LYS A 69 -9.579 -13.820 -1.745 1.00 0.00 N ATOM 1035 CA LYS A 69 -9.819 -12.481 -2.272 1.00 0.00 C ATOM 1036 C LYS A 69 -9.111 -11.429 -1.425 1.00 0.00 C ATOM 1037 O LYS A 69 -9.086 -11.520 -0.197 1.00 0.00 O ATOM 1038 CB LYS A 69 -11.320 -12.190 -2.317 1.00 0.00 C ATOM 1039 CG LYS A 69 -12.094 -13.126 -3.229 1.00 0.00 C ATOM 1040 CD LYS A 69 -13.343 -12.460 -3.782 1.00 0.00 C ATOM 1041 CE LYS A 69 -14.436 -13.477 -4.070 1.00 0.00 C ATOM 1042 NZ LYS A 69 -15.722 -12.820 -4.435 1.00 0.00 N ATOM 0 H LYS A 69 -9.973 -13.985 -0.819 1.00 0.00 H new ATOM 0 HA LYS A 69 -9.417 -12.438 -3.284 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -11.726 -12.262 -1.308 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -11.473 -11.163 -2.650 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -11.455 -13.443 -4.053 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -12.373 -14.024 -2.678 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -13.710 -11.723 -3.068 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -13.095 -11.922 -4.697 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -14.119 -14.131 -4.882 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -14.586 -14.107 -3.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -16.442 -13.547 -4.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -16.038 -12.215 -3.650 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -15.585 -12.239 -5.286 1.00 0.00 H new ATOM 1056 N PHE A 70 -8.539 -10.429 -2.088 1.00 0.00 N ATOM 1057 CA PHE A 70 -7.831 -9.359 -1.395 1.00 0.00 C ATOM 1058 C PHE A 70 -8.799 -8.265 -0.952 1.00 0.00 C ATOM 1059 O PHE A 70 -9.392 -7.571 -1.779 1.00 0.00 O ATOM 1060 CB PHE A 70 -6.751 -8.763 -2.301 1.00 0.00 C ATOM 1061 CG PHE A 70 -5.854 -9.795 -2.922 1.00 0.00 C ATOM 1062 CD1 PHE A 70 -5.115 -10.658 -2.129 1.00 0.00 C ATOM 1063 CD2 PHE A 70 -5.750 -9.903 -4.300 1.00 0.00 C ATOM 1064 CE1 PHE A 70 -4.288 -11.608 -2.698 1.00 0.00 C ATOM 1065 CE2 PHE A 70 -4.925 -10.851 -4.875 1.00 0.00 C ATOM 1066 CZ PHE A 70 -4.194 -11.705 -4.073 1.00 0.00 C ATOM 0 H PHE A 70 -8.552 -10.337 -3.104 1.00 0.00 H new ATOM 0 HA PHE A 70 -7.359 -9.784 -0.509 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -7.229 -8.186 -3.092 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -6.144 -8.067 -1.721 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -5.186 -10.588 -1.054 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -6.320 -9.238 -4.932 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -3.716 -12.274 -2.069 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -4.852 -10.924 -5.950 1.00 0.00 H new ATOM 0 HZ PHE A 70 -3.550 -12.448 -4.520 1.00 0.00 H new ATOM 1076 N THR A 71 -8.955 -8.117 0.360 1.00 0.00 N ATOM 1077 CA THR A 71 -9.851 -7.111 0.915 1.00 0.00 C ATOM 1078 C THR A 71 -9.184 -6.350 2.055 1.00 0.00 C ATOM 1079 O THR A 71 -8.795 -6.939 3.064 1.00 0.00 O ATOM 1080 CB THR A 71 -11.157 -7.744 1.429 1.00 0.00 C ATOM 1081 OG1 THR A 71 -10.986 -8.192 2.779 1.00 0.00 O ATOM 1082 CG2 THR A 71 -11.575 -8.913 0.550 1.00 0.00 C ATOM 0 H THR A 71 -8.472 -8.682 1.058 1.00 0.00 H new ATOM 0 HA THR A 71 -10.086 -6.417 0.108 1.00 0.00 H new ATOM 0 HB THR A 71 -11.940 -6.987 1.394 1.00 0.00 H new ATOM 0 HG1 THR A 71 -10.037 -8.150 3.020 1.00 0.00 H new ATOM 0 HG21 THR A 71 -12.500 -9.344 0.933 1.00 0.00 H new ATOM 0 HG22 THR A 71 -11.733 -8.563 -0.470 1.00 0.00 H new ATOM 0 HG23 THR A 71 -10.792 -9.671 0.556 1.00 0.00 H new ATOM 1090 N VAL A 72 -9.057 -5.037 1.889 1.00 0.00 N ATOM 1091 CA VAL A 72 -8.439 -4.195 2.907 1.00 0.00 C ATOM 1092 C VAL A 72 -9.139 -4.353 4.251 1.00 0.00 C ATOM 1093 O VAL A 72 -10.346 -4.139 4.361 1.00 0.00 O ATOM 1094 CB VAL A 72 -8.466 -2.710 2.498 1.00 0.00 C ATOM 1095 CG1 VAL A 72 -7.938 -1.836 3.626 1.00 0.00 C ATOM 1096 CG2 VAL A 72 -7.662 -2.494 1.224 1.00 0.00 C ATOM 0 H VAL A 72 -9.373 -4.534 1.060 1.00 0.00 H new ATOM 0 HA VAL A 72 -7.403 -4.520 3.001 1.00 0.00 H new ATOM 0 HB VAL A 72 -9.499 -2.423 2.302 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -7.965 -0.790 3.319 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -8.559 -1.970 4.512 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -6.911 -2.120 3.857 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -7.692 -1.440 0.949 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -6.628 -2.797 1.390 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -8.090 -3.091 0.418 1.00 0.00 H new ATOM 1106 N GLN A 73 -8.374 -4.728 5.271 1.00 0.00 N ATOM 1107 CA GLN A 73 -8.922 -4.915 6.609 1.00 0.00 C ATOM 1108 C GLN A 73 -8.917 -3.604 7.387 1.00 0.00 C ATOM 1109 O GLN A 73 -8.601 -3.578 8.576 1.00 0.00 O ATOM 1110 CB GLN A 73 -8.122 -5.976 7.367 1.00 0.00 C ATOM 1111 CG GLN A 73 -8.891 -6.617 8.511 1.00 0.00 C ATOM 1112 CD GLN A 73 -10.013 -7.515 8.028 1.00 0.00 C ATOM 1113 OE1 GLN A 73 -11.101 -7.044 7.693 1.00 0.00 O ATOM 1114 NE2 GLN A 73 -9.755 -8.817 7.989 1.00 0.00 N ATOM 0 H GLN A 73 -7.373 -4.908 5.196 1.00 0.00 H new ATOM 0 HA GLN A 73 -9.954 -5.252 6.508 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -7.812 -6.753 6.668 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -7.213 -5.521 7.761 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -8.204 -7.199 9.125 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -9.305 -5.836 9.149 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -8.840 -9.164 8.276 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -10.472 -9.470 7.672 1.00 0.00 H new ATOM 1123 N ALA A 74 -9.270 -2.517 6.708 1.00 0.00 N ATOM 1124 CA ALA A 74 -9.307 -1.203 7.337 1.00 0.00 C ATOM 1125 C ALA A 74 -10.593 -1.012 8.135 1.00 0.00 C ATOM 1126 O ALA A 74 -10.569 -0.956 9.364 1.00 0.00 O ATOM 1127 CB ALA A 74 -9.169 -0.111 6.286 1.00 0.00 C ATOM 0 H ALA A 74 -9.534 -2.521 5.723 1.00 0.00 H new ATOM 0 HA ALA A 74 -8.467 -1.135 8.029 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -9.198 0.865 6.770 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -8.220 -0.228 5.762 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -9.989 -0.187 5.572 1.00 0.00 H new ATOM 1133 N SER A 75 -11.714 -0.913 7.427 1.00 0.00 N ATOM 1134 CA SER A 75 -13.009 -0.724 8.069 1.00 0.00 C ATOM 1135 C SER A 75 -13.354 -1.916 8.958 1.00 0.00 C ATOM 1136 O SER A 75 -12.611 -2.895 9.015 1.00 0.00 O ATOM 1137 CB SER A 75 -14.101 -0.526 7.016 1.00 0.00 C ATOM 1138 OG SER A 75 -14.055 0.782 6.473 1.00 0.00 O ATOM 0 H SER A 75 -11.751 -0.961 6.409 1.00 0.00 H new ATOM 0 HA SER A 75 -12.950 0.168 8.693 1.00 0.00 H new ATOM 0 HB2 SER A 75 -13.978 -1.259 6.218 1.00 0.00 H new ATOM 0 HB3 SER A 75 -15.079 -0.703 7.464 1.00 0.00 H new ATOM 0 HG SER A 75 -14.762 0.882 5.801 1.00 0.00 H new ATOM 1144 N GLU A 76 -14.486 -1.823 9.648 1.00 0.00 N ATOM 1145 CA GLU A 76 -14.929 -2.893 10.535 1.00 0.00 C ATOM 1146 C GLU A 76 -15.384 -4.109 9.734 1.00 0.00 C ATOM 1147 O GLU A 76 -14.707 -5.137 9.707 1.00 0.00 O ATOM 1148 CB GLU A 76 -16.069 -2.403 11.431 1.00 0.00 C ATOM 1149 CG GLU A 76 -16.694 -3.501 12.275 1.00 0.00 C ATOM 1150 CD GLU A 76 -15.944 -3.739 13.572 1.00 0.00 C ATOM 1151 OE1 GLU A 76 -14.926 -3.053 13.802 1.00 0.00 O ATOM 1152 OE2 GLU A 76 -16.375 -4.610 14.356 1.00 0.00 O ATOM 0 H GLU A 76 -15.113 -1.019 9.610 1.00 0.00 H new ATOM 0 HA GLU A 76 -14.085 -3.186 11.160 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -15.692 -1.620 12.089 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -16.841 -1.951 10.808 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -17.727 -3.237 12.500 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -16.720 -4.426 11.699 1.00 0.00 H new ATOM 1159 N GLY A 77 -16.536 -3.985 9.082 1.00 0.00 N ATOM 1160 CA GLY A 77 -17.063 -5.081 8.290 1.00 0.00 C ATOM 1161 C GLY A 77 -18.389 -4.741 7.640 1.00 0.00 C ATOM 1162 O GLY A 77 -19.207 -5.625 7.382 1.00 0.00 O ATOM 0 H GLY A 77 -17.114 -3.145 9.088 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -16.341 -5.347 7.518 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -17.188 -5.958 8.926 1.00 0.00 H new ATOM 1166 N VAL A 78 -18.605 -3.457 7.375 1.00 0.00 N ATOM 1167 CA VAL A 78 -19.841 -3.002 6.751 1.00 0.00 C ATOM 1168 C VAL A 78 -19.564 -2.310 5.421 1.00 0.00 C ATOM 1169 O VAL A 78 -20.192 -2.616 4.407 1.00 0.00 O ATOM 1170 CB VAL A 78 -20.611 -2.035 7.670 1.00 0.00 C ATOM 1171 CG1 VAL A 78 -21.518 -2.806 8.617 1.00 0.00 C ATOM 1172 CG2 VAL A 78 -19.644 -1.153 8.444 1.00 0.00 C ATOM 0 H VAL A 78 -17.939 -2.713 7.583 1.00 0.00 H new ATOM 0 HA VAL A 78 -20.451 -3.888 6.575 1.00 0.00 H new ATOM 0 HB VAL A 78 -21.236 -1.392 7.050 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -22.054 -2.106 9.258 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -22.234 -3.390 8.040 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -20.917 -3.475 9.233 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -20.205 -0.476 9.088 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -18.991 -1.777 9.054 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -19.042 -0.573 7.745 1.00 0.00 H new ATOM 1182 N SER A 79 -18.618 -1.376 5.432 1.00 0.00 N ATOM 1183 CA SER A 79 -18.259 -0.637 4.228 1.00 0.00 C ATOM 1184 C SER A 79 -16.975 -1.188 3.615 1.00 0.00 C ATOM 1185 O SER A 79 -16.025 -0.447 3.366 1.00 0.00 O ATOM 1186 CB SER A 79 -18.088 0.849 4.547 1.00 0.00 C ATOM 1187 OG SER A 79 -19.111 1.305 5.415 1.00 0.00 O ATOM 0 H SER A 79 -18.086 -1.113 6.262 1.00 0.00 H new ATOM 0 HA SER A 79 -19.066 -0.755 3.505 1.00 0.00 H new ATOM 0 HB2 SER A 79 -17.114 1.016 5.008 1.00 0.00 H new ATOM 0 HB3 SER A 79 -18.106 1.427 3.623 1.00 0.00 H new ATOM 0 HG SER A 79 -18.978 2.257 5.605 1.00 0.00 H new ATOM 1193 N MET A 80 -16.956 -2.495 3.374 1.00 0.00 N ATOM 1194 CA MET A 80 -15.790 -3.147 2.789 1.00 0.00 C ATOM 1195 C MET A 80 -16.195 -4.043 1.623 1.00 0.00 C ATOM 1196 O MET A 80 -17.137 -4.829 1.731 1.00 0.00 O ATOM 1197 CB MET A 80 -15.054 -3.969 3.848 1.00 0.00 C ATOM 1198 CG MET A 80 -14.308 -5.166 3.279 1.00 0.00 C ATOM 1199 SD MET A 80 -13.086 -5.832 4.425 1.00 0.00 S ATOM 1200 CE MET A 80 -13.935 -7.296 5.012 1.00 0.00 C ATOM 0 H MET A 80 -17.734 -3.123 3.575 1.00 0.00 H new ATOM 0 HA MET A 80 -15.122 -2.372 2.413 1.00 0.00 H new ATOM 0 HB2 MET A 80 -14.346 -3.324 4.369 1.00 0.00 H new ATOM 0 HB3 MET A 80 -15.773 -4.318 4.589 1.00 0.00 H new ATOM 0 HG2 MET A 80 -15.024 -5.947 3.023 1.00 0.00 H new ATOM 0 HG3 MET A 80 -13.811 -4.873 2.354 1.00 0.00 H new ATOM 0 HE1 MET A 80 -13.544 -7.576 5.990 1.00 0.00 H new ATOM 0 HE2 MET A 80 -15.002 -7.090 5.094 1.00 0.00 H new ATOM 0 HE3 MET A 80 -13.777 -8.115 4.310 1.00 0.00 H new ATOM 1210 N ARG A 81 -15.479 -3.921 0.511 1.00 0.00 N ATOM 1211 CA ARG A 81 -15.766 -4.719 -0.675 1.00 0.00 C ATOM 1212 C ARG A 81 -14.848 -5.937 -0.745 1.00 0.00 C ATOM 1213 O ARG A 81 -13.992 -6.133 0.117 1.00 0.00 O ATOM 1214 CB ARG A 81 -15.604 -3.872 -1.938 1.00 0.00 C ATOM 1215 CG ARG A 81 -16.808 -2.993 -2.240 1.00 0.00 C ATOM 1216 CD ARG A 81 -16.923 -2.698 -3.727 1.00 0.00 C ATOM 1217 NE ARG A 81 -17.248 -3.895 -4.499 1.00 0.00 N ATOM 1218 CZ ARG A 81 -17.038 -4.005 -5.806 1.00 0.00 C ATOM 1219 NH1 ARG A 81 -16.507 -2.997 -6.483 1.00 0.00 N ATOM 1220 NH2 ARG A 81 -17.360 -5.127 -6.438 1.00 0.00 N ATOM 0 H ARG A 81 -14.695 -3.277 0.406 1.00 0.00 H new ATOM 0 HA ARG A 81 -16.797 -5.065 -0.609 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -14.722 -3.241 -1.832 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -15.424 -4.531 -2.787 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -17.716 -3.487 -1.895 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -16.724 -2.057 -1.688 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -17.692 -1.943 -3.888 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -15.984 -2.278 -4.087 1.00 0.00 H new ATOM 0 HE ARG A 81 -17.658 -4.689 -4.008 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -16.258 -2.133 -6.000 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -16.347 -3.085 -7.487 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -17.769 -5.905 -5.920 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -17.199 -5.211 -7.442 1.00 0.00 H new ATOM 1234 N PHE A 82 -15.034 -6.751 -1.779 1.00 0.00 N ATOM 1235 CA PHE A 82 -14.224 -7.951 -1.962 1.00 0.00 C ATOM 1236 C PHE A 82 -13.864 -8.145 -3.432 1.00 0.00 C ATOM 1237 O PHE A 82 -14.742 -8.275 -4.285 1.00 0.00 O ATOM 1238 CB PHE A 82 -14.971 -9.180 -1.441 1.00 0.00 C ATOM 1239 CG PHE A 82 -15.360 -9.077 0.006 1.00 0.00 C ATOM 1240 CD1 PHE A 82 -16.310 -8.156 0.418 1.00 0.00 C ATOM 1241 CD2 PHE A 82 -14.776 -9.902 0.954 1.00 0.00 C ATOM 1242 CE1 PHE A 82 -16.668 -8.059 1.749 1.00 0.00 C ATOM 1243 CE2 PHE A 82 -15.131 -9.810 2.287 1.00 0.00 C ATOM 1244 CZ PHE A 82 -16.079 -8.888 2.685 1.00 0.00 C ATOM 0 H PHE A 82 -15.738 -6.602 -2.502 1.00 0.00 H new ATOM 0 HA PHE A 82 -13.302 -7.827 -1.394 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -15.869 -9.330 -2.040 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -14.344 -10.061 -1.579 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -16.776 -7.507 -0.309 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -14.035 -10.625 0.648 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -17.408 -7.336 2.058 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -14.668 -10.458 3.016 1.00 0.00 H new ATOM 0 HZ PHE A 82 -16.360 -8.815 3.725 1.00 0.00 H new ATOM 1254 N PHE A 83 -12.567 -8.162 -3.719 1.00 0.00 N ATOM 1255 CA PHE A 83 -12.089 -8.338 -5.086 1.00 0.00 C ATOM 1256 C PHE A 83 -11.114 -9.509 -5.175 1.00 0.00 C ATOM 1257 O PHE A 83 -10.319 -9.741 -4.263 1.00 0.00 O ATOM 1258 CB PHE A 83 -11.414 -7.058 -5.582 1.00 0.00 C ATOM 1259 CG PHE A 83 -12.024 -5.804 -5.025 1.00 0.00 C ATOM 1260 CD1 PHE A 83 -11.763 -5.410 -3.722 1.00 0.00 C ATOM 1261 CD2 PHE A 83 -12.859 -5.019 -5.804 1.00 0.00 C ATOM 1262 CE1 PHE A 83 -12.323 -4.256 -3.207 1.00 0.00 C ATOM 1263 CE2 PHE A 83 -13.421 -3.864 -5.294 1.00 0.00 C ATOM 1264 CZ PHE A 83 -13.154 -3.483 -3.993 1.00 0.00 C ATOM 0 H PHE A 83 -11.828 -8.056 -3.024 1.00 0.00 H new ATOM 0 HA PHE A 83 -12.949 -8.555 -5.720 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -10.357 -7.088 -5.316 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -11.468 -7.026 -6.670 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -11.115 -6.012 -3.102 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -13.073 -5.313 -6.821 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -12.111 -3.959 -2.191 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -14.068 -3.260 -5.912 1.00 0.00 H new ATOM 0 HZ PHE A 83 -13.595 -2.582 -3.592 1.00 0.00 H new ATOM 1274 N THR A 84 -11.181 -10.245 -6.280 1.00 0.00 N ATOM 1275 CA THR A 84 -10.306 -11.392 -6.488 1.00 0.00 C ATOM 1276 C THR A 84 -8.958 -10.960 -7.053 1.00 0.00 C ATOM 1277 O THR A 84 -7.946 -11.632 -6.855 1.00 0.00 O ATOM 1278 CB THR A 84 -10.944 -12.419 -7.442 1.00 0.00 C ATOM 1279 OG1 THR A 84 -12.333 -12.581 -7.130 1.00 0.00 O ATOM 1280 CG2 THR A 84 -10.237 -13.762 -7.343 1.00 0.00 C ATOM 0 H THR A 84 -11.832 -10.067 -7.045 1.00 0.00 H new ATOM 0 HA THR A 84 -10.156 -11.856 -5.513 1.00 0.00 H new ATOM 0 HB THR A 84 -10.842 -12.047 -8.461 1.00 0.00 H new ATOM 0 HG1 THR A 84 -12.732 -13.234 -7.742 1.00 0.00 H new ATOM 0 HG21 THR A 84 -10.705 -14.471 -8.026 1.00 0.00 H new ATOM 0 HG22 THR A 84 -9.187 -13.641 -7.609 1.00 0.00 H new ATOM 0 HG23 THR A 84 -10.311 -14.138 -6.323 1.00 0.00 H new ATOM 1288 N LYS A 85 -8.950 -9.833 -7.757 1.00 0.00 N ATOM 1289 CA LYS A 85 -7.725 -9.309 -8.349 1.00 0.00 C ATOM 1290 C LYS A 85 -7.214 -8.104 -7.566 1.00 0.00 C ATOM 1291 O LYS A 85 -7.994 -7.369 -6.958 1.00 0.00 O ATOM 1292 CB LYS A 85 -7.968 -8.916 -9.808 1.00 0.00 C ATOM 1293 CG LYS A 85 -8.727 -9.965 -10.603 1.00 0.00 C ATOM 1294 CD LYS A 85 -7.791 -11.014 -11.178 1.00 0.00 C ATOM 1295 CE LYS A 85 -8.487 -12.358 -11.331 1.00 0.00 C ATOM 1296 NZ LYS A 85 -7.512 -13.476 -11.457 1.00 0.00 N ATOM 0 H LYS A 85 -9.779 -9.265 -7.931 1.00 0.00 H new ATOM 0 HA LYS A 85 -6.968 -10.093 -8.310 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -8.524 -7.979 -9.835 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -7.008 -8.731 -10.290 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -9.464 -10.447 -9.961 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -9.276 -9.483 -11.412 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -7.422 -10.681 -12.148 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -6.923 -11.124 -10.528 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -9.131 -12.533 -10.470 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -9.130 -12.336 -12.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -8.026 -14.375 -11.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -6.913 -13.322 -12.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -6.915 -13.513 -10.606 1.00 0.00 H new ATOM 1310 N LEU A 86 -5.901 -7.906 -7.585 1.00 0.00 N ATOM 1311 CA LEU A 86 -5.285 -6.789 -6.877 1.00 0.00 C ATOM 1312 C LEU A 86 -5.597 -5.466 -7.570 1.00 0.00 C ATOM 1313 O LEU A 86 -6.141 -4.547 -6.959 1.00 0.00 O ATOM 1314 CB LEU A 86 -3.771 -6.987 -6.790 1.00 0.00 C ATOM 1315 CG LEU A 86 -3.082 -6.367 -5.573 1.00 0.00 C ATOM 1316 CD1 LEU A 86 -3.747 -5.053 -5.195 1.00 0.00 C ATOM 1317 CD2 LEU A 86 -3.102 -7.334 -4.399 1.00 0.00 C ATOM 0 H LEU A 86 -5.242 -8.504 -8.083 1.00 0.00 H new ATOM 0 HA LEU A 86 -5.700 -6.757 -5.869 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -3.564 -8.057 -6.794 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -3.318 -6.571 -7.690 1.00 0.00 H new ATOM 0 HG LEU A 86 -2.043 -6.163 -5.832 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -3.243 -4.627 -4.327 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -3.680 -4.357 -6.032 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -4.795 -5.232 -4.955 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -2.608 -6.876 -3.542 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -4.134 -7.570 -4.139 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -2.579 -8.250 -4.673 1.00 0.00 H new ATOM 1329 N ASP A 87 -5.252 -5.379 -8.850 1.00 0.00 N ATOM 1330 CA ASP A 87 -5.498 -4.171 -9.628 1.00 0.00 C ATOM 1331 C ASP A 87 -6.960 -3.747 -9.526 1.00 0.00 C ATOM 1332 O ASP A 87 -7.263 -2.565 -9.371 1.00 0.00 O ATOM 1333 CB ASP A 87 -5.120 -4.396 -11.093 1.00 0.00 C ATOM 1334 CG ASP A 87 -3.878 -5.251 -11.246 1.00 0.00 C ATOM 1335 OD1 ASP A 87 -3.152 -5.428 -10.245 1.00 0.00 O ATOM 1336 OD2 ASP A 87 -3.632 -5.745 -12.366 1.00 0.00 O ATOM 0 H ASP A 87 -4.801 -6.131 -9.371 1.00 0.00 H new ATOM 0 HA ASP A 87 -4.878 -3.373 -9.220 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -5.952 -4.873 -11.611 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -4.956 -3.432 -11.575 1.00 0.00 H new ATOM 1341 N GLN A 88 -7.860 -4.721 -9.614 1.00 0.00 N ATOM 1342 CA GLN A 88 -9.290 -4.448 -9.533 1.00 0.00 C ATOM 1343 C GLN A 88 -9.651 -3.829 -8.187 1.00 0.00 C ATOM 1344 O GLN A 88 -10.652 -3.121 -8.065 1.00 0.00 O ATOM 1345 CB GLN A 88 -10.090 -5.734 -9.748 1.00 0.00 C ATOM 1346 CG GLN A 88 -10.025 -6.260 -11.172 1.00 0.00 C ATOM 1347 CD GLN A 88 -11.000 -5.558 -12.098 1.00 0.00 C ATOM 1348 OE1 GLN A 88 -10.631 -4.630 -12.819 1.00 0.00 O ATOM 1349 NE2 GLN A 88 -12.252 -5.998 -12.083 1.00 0.00 N ATOM 0 H GLN A 88 -7.625 -5.705 -9.741 1.00 0.00 H new ATOM 0 HA GLN A 88 -9.543 -3.736 -10.319 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -9.718 -6.501 -9.069 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -11.132 -5.552 -9.484 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -9.012 -6.136 -11.555 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -10.237 -7.329 -11.171 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -12.514 -6.770 -11.470 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -12.952 -5.564 -12.685 1.00 0.00 H new ATOM 1358 N LEU A 89 -8.831 -4.101 -7.178 1.00 0.00 N ATOM 1359 CA LEU A 89 -9.063 -3.571 -5.839 1.00 0.00 C ATOM 1360 C LEU A 89 -8.541 -2.143 -5.719 1.00 0.00 C ATOM 1361 O LEU A 89 -9.188 -1.283 -5.122 1.00 0.00 O ATOM 1362 CB LEU A 89 -8.390 -4.462 -4.793 1.00 0.00 C ATOM 1363 CG LEU A 89 -8.332 -3.901 -3.371 1.00 0.00 C ATOM 1364 CD1 LEU A 89 -8.297 -5.030 -2.353 1.00 0.00 C ATOM 1365 CD2 LEU A 89 -7.122 -2.993 -3.206 1.00 0.00 C ATOM 0 H LEU A 89 -7.999 -4.686 -7.262 1.00 0.00 H new ATOM 0 HA LEU A 89 -10.138 -3.560 -5.661 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -8.916 -5.416 -4.765 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -7.372 -4.669 -5.122 1.00 0.00 H new ATOM 0 HG LEU A 89 -9.231 -3.310 -3.196 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -8.256 -4.612 -1.347 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -9.194 -5.641 -2.456 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -7.416 -5.648 -2.525 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -7.096 -2.603 -2.189 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -6.212 -3.561 -3.400 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -7.190 -2.164 -3.911 1.00 0.00 H new ATOM 1377 N ILE A 90 -7.368 -1.898 -6.293 1.00 0.00 N ATOM 1378 CA ILE A 90 -6.760 -0.574 -6.253 1.00 0.00 C ATOM 1379 C ILE A 90 -7.640 0.455 -6.955 1.00 0.00 C ATOM 1380 O ILE A 90 -8.103 1.414 -6.338 1.00 0.00 O ATOM 1381 CB ILE A 90 -5.367 -0.574 -6.909 1.00 0.00 C ATOM 1382 CG1 ILE A 90 -4.489 -1.666 -6.293 1.00 0.00 C ATOM 1383 CG2 ILE A 90 -4.710 0.790 -6.756 1.00 0.00 C ATOM 1384 CD1 ILE A 90 -4.247 -1.482 -4.811 1.00 0.00 C ATOM 0 H ILE A 90 -6.820 -2.599 -6.791 1.00 0.00 H new ATOM 0 HA ILE A 90 -6.657 -0.305 -5.202 1.00 0.00 H new ATOM 0 HB ILE A 90 -5.482 -0.783 -7.972 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -4.959 -2.635 -6.459 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -3.530 -1.684 -6.810 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -3.726 0.775 -7.225 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -5.329 1.548 -7.236 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -4.604 1.026 -5.697 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -3.618 -2.292 -4.442 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -3.749 -0.528 -4.639 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -5.200 -1.494 -4.282 1.00 0.00 H new ATOM 1396 N GLU A 91 -7.867 0.248 -8.249 1.00 0.00 N ATOM 1397 CA GLU A 91 -8.692 1.158 -9.034 1.00 0.00 C ATOM 1398 C GLU A 91 -9.937 1.573 -8.255 1.00 0.00 C ATOM 1399 O GLU A 91 -10.216 2.761 -8.096 1.00 0.00 O ATOM 1400 CB GLU A 91 -9.099 0.502 -10.355 1.00 0.00 C ATOM 1401 CG GLU A 91 -7.918 0.105 -11.226 1.00 0.00 C ATOM 1402 CD GLU A 91 -8.347 -0.508 -12.545 1.00 0.00 C ATOM 1403 OE1 GLU A 91 -9.035 -1.551 -12.518 1.00 0.00 O ATOM 1404 OE2 GLU A 91 -7.995 0.053 -13.604 1.00 0.00 O ATOM 0 H GLU A 91 -7.491 -0.541 -8.775 1.00 0.00 H new ATOM 0 HA GLU A 91 -8.103 2.050 -9.246 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -9.697 -0.384 -10.142 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -9.736 1.190 -10.912 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -7.303 0.984 -11.421 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -7.295 -0.607 -10.684 1.00 0.00 H new ATOM 1411 N PHE A 92 -10.682 0.584 -7.772 1.00 0.00 N ATOM 1412 CA PHE A 92 -11.899 0.845 -7.012 1.00 0.00 C ATOM 1413 C PHE A 92 -11.648 1.886 -5.925 1.00 0.00 C ATOM 1414 O PHE A 92 -12.488 2.750 -5.672 1.00 0.00 O ATOM 1415 CB PHE A 92 -12.420 -0.449 -6.383 1.00 0.00 C ATOM 1416 CG PHE A 92 -13.583 -0.240 -5.456 1.00 0.00 C ATOM 1417 CD1 PHE A 92 -14.877 -0.184 -5.948 1.00 0.00 C ATOM 1418 CD2 PHE A 92 -13.381 -0.097 -4.092 1.00 0.00 C ATOM 1419 CE1 PHE A 92 -15.949 0.008 -5.097 1.00 0.00 C ATOM 1420 CE2 PHE A 92 -14.450 0.095 -3.237 1.00 0.00 C ATOM 1421 CZ PHE A 92 -15.735 0.149 -3.740 1.00 0.00 C ATOM 0 H PHE A 92 -10.464 -0.405 -7.893 1.00 0.00 H new ATOM 0 HA PHE A 92 -12.650 1.235 -7.699 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -12.717 -1.135 -7.176 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -11.610 -0.928 -5.834 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -15.050 -0.292 -7.009 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -12.378 -0.136 -3.693 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -16.953 0.048 -5.493 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -14.280 0.203 -2.176 1.00 0.00 H new ATOM 0 HZ PHE A 92 -16.571 0.301 -3.073 1.00 0.00 H new ATOM 1431 N TYR A 93 -10.487 1.797 -5.286 1.00 0.00 N ATOM 1432 CA TYR A 93 -10.126 2.729 -4.224 1.00 0.00 C ATOM 1433 C TYR A 93 -9.478 3.985 -4.799 1.00 0.00 C ATOM 1434 O TYR A 93 -8.642 4.618 -4.154 1.00 0.00 O ATOM 1435 CB TYR A 93 -9.173 2.060 -3.232 1.00 0.00 C ATOM 1436 CG TYR A 93 -9.880 1.337 -2.107 1.00 0.00 C ATOM 1437 CD1 TYR A 93 -10.477 2.042 -1.069 1.00 0.00 C ATOM 1438 CD2 TYR A 93 -9.950 -0.050 -2.082 1.00 0.00 C ATOM 1439 CE1 TYR A 93 -11.124 1.386 -0.040 1.00 0.00 C ATOM 1440 CE2 TYR A 93 -10.596 -0.714 -1.058 1.00 0.00 C ATOM 1441 CZ TYR A 93 -11.181 0.008 -0.039 1.00 0.00 C ATOM 1442 OH TYR A 93 -11.824 -0.650 0.985 1.00 0.00 O ATOM 0 H TYR A 93 -9.780 1.089 -5.485 1.00 0.00 H new ATOM 0 HA TYR A 93 -11.039 3.018 -3.703 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -8.542 1.351 -3.769 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -8.513 2.817 -2.808 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -10.434 3.121 -1.067 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -9.491 -0.619 -2.877 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -11.583 1.949 0.759 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -10.643 -1.793 -1.055 1.00 0.00 H new ATOM 0 HH TYR A 93 -11.774 -1.617 0.835 1.00 0.00 H new ATOM 1452 N LYS A 94 -9.872 4.341 -6.017 1.00 0.00 N ATOM 1453 CA LYS A 94 -9.334 5.522 -6.681 1.00 0.00 C ATOM 1454 C LYS A 94 -10.117 6.771 -6.289 1.00 0.00 C ATOM 1455 O LYS A 94 -9.605 7.888 -6.368 1.00 0.00 O ATOM 1456 CB LYS A 94 -9.371 5.340 -8.200 1.00 0.00 C ATOM 1457 CG LYS A 94 -8.284 4.420 -8.729 1.00 0.00 C ATOM 1458 CD LYS A 94 -7.000 5.181 -9.014 1.00 0.00 C ATOM 1459 CE LYS A 94 -5.777 4.295 -8.833 1.00 0.00 C ATOM 1460 NZ LYS A 94 -4.531 4.968 -9.296 1.00 0.00 N ATOM 0 H LYS A 94 -10.563 3.828 -6.565 1.00 0.00 H new ATOM 0 HA LYS A 94 -8.300 5.648 -6.361 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -10.344 4.941 -8.486 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -9.274 6.315 -8.677 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -8.087 3.632 -8.002 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -8.630 3.933 -9.641 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -7.023 5.568 -10.033 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -6.930 6.041 -8.348 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -5.675 4.026 -7.781 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -5.916 3.367 -9.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -3.748 4.727 -8.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -4.301 4.649 -10.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -4.673 5.998 -9.297 1.00 0.00 H new ATOM 1474 N LYS A 95 -11.360 6.575 -5.865 1.00 0.00 N ATOM 1475 CA LYS A 95 -12.214 7.685 -5.457 1.00 0.00 C ATOM 1476 C LYS A 95 -11.931 8.087 -4.013 1.00 0.00 C ATOM 1477 O LYS A 95 -11.265 7.360 -3.277 1.00 0.00 O ATOM 1478 CB LYS A 95 -13.688 7.305 -5.612 1.00 0.00 C ATOM 1479 CG LYS A 95 -14.256 7.617 -6.986 1.00 0.00 C ATOM 1480 CD LYS A 95 -15.678 7.104 -7.132 1.00 0.00 C ATOM 1481 CE LYS A 95 -16.302 7.555 -8.444 1.00 0.00 C ATOM 1482 NZ LYS A 95 -17.391 6.639 -8.884 1.00 0.00 N ATOM 0 H LYS A 95 -11.800 5.657 -5.795 1.00 0.00 H new ATOM 0 HA LYS A 95 -11.995 8.536 -6.102 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -13.802 6.239 -5.414 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -14.272 7.833 -4.858 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -14.238 8.694 -7.152 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -13.625 7.166 -7.752 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -15.680 6.015 -7.082 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -16.282 7.462 -6.299 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -16.700 8.563 -8.329 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -15.533 7.602 -9.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -17.791 6.981 -9.781 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -17.007 5.682 -9.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -18.137 6.614 -8.160 1.00 0.00 H new ATOM 1496 N GLU A 96 -12.444 9.247 -3.615 1.00 0.00 N ATOM 1497 CA GLU A 96 -12.246 9.744 -2.258 1.00 0.00 C ATOM 1498 C GLU A 96 -13.456 9.433 -1.383 1.00 0.00 C ATOM 1499 O GLU A 96 -14.505 9.024 -1.879 1.00 0.00 O ATOM 1500 CB GLU A 96 -11.989 11.252 -2.276 1.00 0.00 C ATOM 1501 CG GLU A 96 -13.260 12.086 -2.292 1.00 0.00 C ATOM 1502 CD GLU A 96 -12.980 13.576 -2.319 1.00 0.00 C ATOM 1503 OE1 GLU A 96 -12.021 13.988 -3.003 1.00 0.00 O ATOM 1504 OE2 GLU A 96 -13.722 14.330 -1.654 1.00 0.00 O ATOM 0 H GLU A 96 -12.999 9.860 -4.212 1.00 0.00 H new ATOM 0 HA GLU A 96 -11.376 9.240 -1.837 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -11.398 11.522 -1.401 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -11.391 11.500 -3.153 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -13.856 11.816 -3.164 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -13.857 11.848 -1.412 1.00 0.00 H new ATOM 1511 N ASN A 97 -13.302 9.630 -0.078 1.00 0.00 N ATOM 1512 CA ASN A 97 -14.381 9.370 0.868 1.00 0.00 C ATOM 1513 C ASN A 97 -14.717 7.882 0.914 1.00 0.00 C ATOM 1514 O ASN A 97 -15.886 7.499 0.892 1.00 0.00 O ATOM 1515 CB ASN A 97 -15.626 10.174 0.487 1.00 0.00 C ATOM 1516 CG ASN A 97 -16.547 10.408 1.668 1.00 0.00 C ATOM 1517 OD1 ASN A 97 -17.729 10.069 1.625 1.00 0.00 O ATOM 1518 ND2 ASN A 97 -16.007 10.992 2.732 1.00 0.00 N ATOM 0 H ASN A 97 -12.440 9.969 0.349 1.00 0.00 H new ATOM 0 HA ASN A 97 -14.046 9.680 1.858 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -15.322 11.135 0.071 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -16.171 9.646 -0.296 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -16.577 11.176 3.557 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -15.022 11.256 2.724 1.00 0.00 H new ATOM 1525 N MET A 98 -13.684 7.050 0.978 1.00 0.00 N ATOM 1526 CA MET A 98 -13.869 5.604 1.029 1.00 0.00 C ATOM 1527 C MET A 98 -13.390 5.041 2.363 1.00 0.00 C ATOM 1528 O MET A 98 -14.195 4.670 3.216 1.00 0.00 O ATOM 1529 CB MET A 98 -13.118 4.931 -0.121 1.00 0.00 C ATOM 1530 CG MET A 98 -13.937 4.815 -1.397 1.00 0.00 C ATOM 1531 SD MET A 98 -13.910 6.327 -2.379 1.00 0.00 S ATOM 1532 CE MET A 98 -15.570 6.322 -3.053 1.00 0.00 C ATOM 0 H MET A 98 -12.710 7.351 0.996 1.00 0.00 H new ATOM 0 HA MET A 98 -14.934 5.396 0.929 1.00 0.00 H new ATOM 0 HB2 MET A 98 -12.211 5.497 -0.332 1.00 0.00 H new ATOM 0 HB3 MET A 98 -12.807 3.935 0.193 1.00 0.00 H new ATOM 0 HG2 MET A 98 -13.553 3.990 -1.997 1.00 0.00 H new ATOM 0 HG3 MET A 98 -14.968 4.571 -1.141 1.00 0.00 H new ATOM 0 HE1 MET A 98 -15.861 7.340 -3.312 1.00 0.00 H new ATOM 0 HE2 MET A 98 -15.598 5.698 -3.946 1.00 0.00 H new ATOM 0 HE3 MET A 98 -16.263 5.925 -2.311 1.00 0.00 H new ATOM 1542 N GLY A 99 -12.073 4.980 2.536 1.00 0.00 N ATOM 1543 CA GLY A 99 -11.510 4.460 3.769 1.00 0.00 C ATOM 1544 C GLY A 99 -10.087 4.928 3.998 1.00 0.00 C ATOM 1545 O GLY A 99 -9.698 5.226 5.128 1.00 0.00 O ATOM 0 H GLY A 99 -11.386 5.281 1.845 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -12.131 4.772 4.609 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -11.531 3.371 3.744 1.00 0.00 H new ATOM 1549 N LEU A 100 -9.306 4.990 2.925 1.00 0.00 N ATOM 1550 CA LEU A 100 -7.916 5.423 3.014 1.00 0.00 C ATOM 1551 C LEU A 100 -7.828 6.900 3.385 1.00 0.00 C ATOM 1552 O LEU A 100 -8.834 7.610 3.393 1.00 0.00 O ATOM 1553 CB LEU A 100 -7.198 5.175 1.687 1.00 0.00 C ATOM 1554 CG LEU A 100 -7.392 3.791 1.067 1.00 0.00 C ATOM 1555 CD1 LEU A 100 -6.702 3.711 -0.286 1.00 0.00 C ATOM 1556 CD2 LEU A 100 -6.865 2.710 2.000 1.00 0.00 C ATOM 0 H LEU A 100 -9.612 4.746 1.983 1.00 0.00 H new ATOM 0 HA LEU A 100 -7.430 4.841 3.797 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -7.535 5.923 0.969 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -6.131 5.337 1.839 1.00 0.00 H new ATOM 0 HG LEU A 100 -8.459 3.627 0.919 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -6.851 2.719 -0.712 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -7.125 4.460 -0.955 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -5.635 3.896 -0.162 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -7.011 1.732 1.543 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -5.802 2.871 2.180 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -7.404 2.752 2.947 1.00 0.00 H new ATOM 1568 N VAL A 101 -6.618 7.357 3.690 1.00 0.00 N ATOM 1569 CA VAL A 101 -6.398 8.751 4.059 1.00 0.00 C ATOM 1570 C VAL A 101 -6.591 9.673 2.860 1.00 0.00 C ATOM 1571 O VAL A 101 -7.273 10.695 2.952 1.00 0.00 O ATOM 1572 CB VAL A 101 -4.985 8.963 4.633 1.00 0.00 C ATOM 1573 CG1 VAL A 101 -3.936 8.811 3.542 1.00 0.00 C ATOM 1574 CG2 VAL A 101 -4.880 10.327 5.299 1.00 0.00 C ATOM 0 H VAL A 101 -5.775 6.783 3.689 1.00 0.00 H new ATOM 0 HA VAL A 101 -7.134 8.996 4.825 1.00 0.00 H new ATOM 0 HB VAL A 101 -4.801 8.200 5.389 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -2.944 8.964 3.967 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -3.997 7.810 3.115 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -4.114 9.550 2.761 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -3.875 10.460 5.699 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -5.085 11.107 4.565 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -5.605 10.393 6.110 1.00 0.00 H new ATOM 1584 N THR A 102 -5.987 9.306 1.734 1.00 0.00 N ATOM 1585 CA THR A 102 -6.091 10.100 0.517 1.00 0.00 C ATOM 1586 C THR A 102 -6.440 9.226 -0.682 1.00 0.00 C ATOM 1587 O THR A 102 -6.154 8.028 -0.693 1.00 0.00 O ATOM 1588 CB THR A 102 -4.780 10.855 0.224 1.00 0.00 C ATOM 1589 OG1 THR A 102 -5.004 11.854 -0.777 1.00 0.00 O ATOM 1590 CG2 THR A 102 -3.697 9.895 -0.244 1.00 0.00 C ATOM 0 H THR A 102 -5.420 8.463 1.640 1.00 0.00 H new ATOM 0 HA THR A 102 -6.889 10.824 0.680 1.00 0.00 H new ATOM 0 HB THR A 102 -4.447 11.333 1.145 1.00 0.00 H new ATOM 0 HG1 THR A 102 -4.148 12.250 -1.041 1.00 0.00 H new ATOM 0 HG21 THR A 102 -2.781 10.450 -0.445 1.00 0.00 H new ATOM 0 HG22 THR A 102 -3.509 9.153 0.532 1.00 0.00 H new ATOM 0 HG23 THR A 102 -4.024 9.393 -1.155 1.00 0.00 H new ATOM 1598 N HIS A 103 -7.058 9.832 -1.691 1.00 0.00 N ATOM 1599 CA HIS A 103 -7.444 9.107 -2.897 1.00 0.00 C ATOM 1600 C HIS A 103 -6.254 8.944 -3.838 1.00 0.00 C ATOM 1601 O HIS A 103 -5.545 9.908 -4.130 1.00 0.00 O ATOM 1602 CB HIS A 103 -8.580 9.837 -3.614 1.00 0.00 C ATOM 1603 CG HIS A 103 -8.154 11.117 -4.264 1.00 0.00 C ATOM 1604 ND1 HIS A 103 -8.100 12.320 -3.593 1.00 0.00 N ATOM 1605 CD2 HIS A 103 -7.758 11.376 -5.532 1.00 0.00 C ATOM 1606 CE1 HIS A 103 -7.691 13.265 -4.421 1.00 0.00 C ATOM 1607 NE2 HIS A 103 -7.476 12.718 -5.604 1.00 0.00 N ATOM 0 H HIS A 103 -7.302 10.822 -1.698 1.00 0.00 H new ATOM 0 HA HIS A 103 -7.788 8.116 -2.601 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -9.003 9.178 -4.372 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -9.373 10.050 -2.897 1.00 0.00 H new ATOM 0 HD1 HIS A 103 -8.338 12.459 -2.611 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -7.679 10.661 -6.337 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -7.556 14.307 -4.173 1.00 0.00 H new ATOM 1616 N LEU A 104 -6.041 7.720 -4.308 1.00 0.00 N ATOM 1617 CA LEU A 104 -4.936 7.431 -5.215 1.00 0.00 C ATOM 1618 C LEU A 104 -4.937 8.394 -6.398 1.00 0.00 C ATOM 1619 O LEU A 104 -5.810 8.329 -7.263 1.00 0.00 O ATOM 1620 CB LEU A 104 -5.027 5.989 -5.718 1.00 0.00 C ATOM 1621 CG LEU A 104 -5.390 4.935 -4.671 1.00 0.00 C ATOM 1622 CD1 LEU A 104 -5.373 3.544 -5.285 1.00 0.00 C ATOM 1623 CD2 LEU A 104 -4.437 5.009 -3.487 1.00 0.00 C ATOM 0 H LEU A 104 -6.619 6.912 -4.076 1.00 0.00 H new ATOM 0 HA LEU A 104 -4.004 7.560 -4.665 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -5.768 5.950 -6.516 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -4.068 5.718 -6.160 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.399 5.139 -4.313 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -5.634 2.808 -4.525 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -6.096 3.497 -6.099 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -4.377 3.329 -5.672 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -4.710 4.252 -2.752 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -3.417 4.831 -3.829 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -4.500 5.997 -3.031 1.00 0.00 H new ATOM 1635 N GLN A 105 -3.951 9.286 -6.429 1.00 0.00 N ATOM 1636 CA GLN A 105 -3.838 10.261 -7.507 1.00 0.00 C ATOM 1637 C GLN A 105 -2.944 9.735 -8.625 1.00 0.00 C ATOM 1638 O GLN A 105 -3.380 9.595 -9.768 1.00 0.00 O ATOM 1639 CB GLN A 105 -3.281 11.582 -6.972 1.00 0.00 C ATOM 1640 CG GLN A 105 -4.261 12.343 -6.094 1.00 0.00 C ATOM 1641 CD GLN A 105 -3.859 13.791 -5.891 1.00 0.00 C ATOM 1642 OE1 GLN A 105 -3.180 14.382 -6.730 1.00 0.00 O ATOM 1643 NE2 GLN A 105 -4.278 14.370 -4.772 1.00 0.00 N ATOM 0 H GLN A 105 -3.220 9.353 -5.721 1.00 0.00 H new ATOM 0 HA GLN A 105 -4.835 10.433 -7.914 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -2.375 11.380 -6.401 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -2.994 12.213 -7.813 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -5.253 12.305 -6.545 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -4.333 11.850 -5.124 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -4.839 13.842 -4.104 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -4.039 15.343 -4.581 1.00 0.00 H new ATOM 1652 N TYR A 106 -1.692 9.446 -8.289 1.00 0.00 N ATOM 1653 CA TYR A 106 -0.736 8.938 -9.265 1.00 0.00 C ATOM 1654 C TYR A 106 0.055 7.766 -8.694 1.00 0.00 C ATOM 1655 O TYR A 106 0.613 7.834 -7.599 1.00 0.00 O ATOM 1656 CB TYR A 106 0.221 10.050 -9.700 1.00 0.00 C ATOM 1657 CG TYR A 106 -0.394 11.431 -9.650 1.00 0.00 C ATOM 1658 CD1 TYR A 106 -0.413 12.162 -8.469 1.00 0.00 C ATOM 1659 CD2 TYR A 106 -0.956 12.004 -10.785 1.00 0.00 C ATOM 1660 CE1 TYR A 106 -0.973 13.424 -8.419 1.00 0.00 C ATOM 1661 CE2 TYR A 106 -1.517 13.265 -10.744 1.00 0.00 C ATOM 1662 CZ TYR A 106 -1.524 13.971 -9.559 1.00 0.00 C ATOM 1663 OH TYR A 106 -2.083 15.228 -9.515 1.00 0.00 O ATOM 0 H TYR A 106 -1.315 9.555 -7.347 1.00 0.00 H new ATOM 0 HA TYR A 106 -1.294 8.588 -10.133 1.00 0.00 H new ATOM 0 HB2 TYR A 106 1.103 10.030 -9.059 1.00 0.00 H new ATOM 0 HB3 TYR A 106 0.561 9.849 -10.716 1.00 0.00 H new ATOM 0 HD1 TYR A 106 0.017 11.737 -7.574 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -0.954 11.454 -11.714 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -0.979 13.979 -7.493 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -1.948 13.696 -11.635 1.00 0.00 H new ATOM 0 HH TYR A 106 -2.572 15.339 -8.673 1.00 0.00 H new ATOM 1673 N PRO A 107 0.107 6.662 -9.454 1.00 0.00 N ATOM 1674 CA PRO A 107 0.827 5.452 -9.046 1.00 0.00 C ATOM 1675 C PRO A 107 2.339 5.648 -9.056 1.00 0.00 C ATOM 1676 O PRO A 107 2.994 5.449 -10.079 1.00 0.00 O ATOM 1677 CB PRO A 107 0.414 4.421 -10.099 1.00 0.00 C ATOM 1678 CG PRO A 107 0.050 5.228 -11.297 1.00 0.00 C ATOM 1679 CD PRO A 107 -0.535 6.509 -10.771 1.00 0.00 C ATOM 0 HA PRO A 107 0.585 5.158 -8.025 1.00 0.00 H new ATOM 0 HB2 PRO A 107 1.229 3.731 -10.319 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -0.428 3.820 -9.756 1.00 0.00 H new ATOM 0 HG2 PRO A 107 0.925 5.424 -11.916 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -0.669 4.698 -11.921 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -0.313 7.351 -11.427 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -1.620 6.450 -10.685 1.00 0.00 H new ATOM 1687 N VAL A 108 2.889 6.037 -7.910 1.00 0.00 N ATOM 1688 CA VAL A 108 4.325 6.257 -7.786 1.00 0.00 C ATOM 1689 C VAL A 108 5.112 5.167 -8.504 1.00 0.00 C ATOM 1690 O VAL A 108 4.937 3.974 -8.254 1.00 0.00 O ATOM 1691 CB VAL A 108 4.761 6.303 -6.310 1.00 0.00 C ATOM 1692 CG1 VAL A 108 3.858 7.234 -5.515 1.00 0.00 C ATOM 1693 CG2 VAL A 108 4.759 4.905 -5.711 1.00 0.00 C ATOM 0 H VAL A 108 2.361 6.206 -7.054 1.00 0.00 H new ATOM 0 HA VAL A 108 4.539 7.220 -8.250 1.00 0.00 H new ATOM 0 HB VAL A 108 5.778 6.693 -6.261 1.00 0.00 H new ATOM 0 HG11 VAL A 108 4.181 7.254 -4.474 1.00 0.00 H new ATOM 0 HG12 VAL A 108 3.915 8.240 -5.932 1.00 0.00 H new ATOM 0 HG13 VAL A 108 2.830 6.877 -5.569 1.00 0.00 H new ATOM 0 HG21 VAL A 108 5.070 4.956 -4.667 1.00 0.00 H new ATOM 0 HG22 VAL A 108 3.755 4.485 -5.771 1.00 0.00 H new ATOM 0 HG23 VAL A 108 5.451 4.271 -6.265 1.00 0.00 H new ATOM 1703 N PRO A 109 6.002 5.582 -9.417 1.00 0.00 N ATOM 1704 CA PRO A 109 6.835 4.656 -10.189 1.00 0.00 C ATOM 1705 C PRO A 109 7.892 3.972 -9.329 1.00 0.00 C ATOM 1706 O PRO A 109 8.229 4.449 -8.244 1.00 0.00 O ATOM 1707 CB PRO A 109 7.499 5.560 -11.231 1.00 0.00 C ATOM 1708 CG PRO A 109 7.506 6.914 -10.609 1.00 0.00 C ATOM 1709 CD PRO A 109 6.263 6.989 -9.766 1.00 0.00 C ATOM 0 HA PRO A 109 6.249 3.844 -10.620 1.00 0.00 H new ATOM 0 HB2 PRO A 109 8.510 5.224 -11.459 1.00 0.00 H new ATOM 0 HB3 PRO A 109 6.943 5.558 -12.169 1.00 0.00 H new ATOM 0 HG2 PRO A 109 8.399 7.060 -10.001 1.00 0.00 H new ATOM 0 HG3 PRO A 109 7.508 7.693 -11.371 1.00 0.00 H new ATOM 0 HD2 PRO A 109 6.416 7.602 -8.878 1.00 0.00 H new ATOM 0 HD3 PRO A 109 5.430 7.428 -10.316 1.00 0.00 H new ATOM 1717 N LEU A 110 8.411 2.851 -9.818 1.00 0.00 N ATOM 1718 CA LEU A 110 9.431 2.101 -9.093 1.00 0.00 C ATOM 1719 C LEU A 110 10.711 2.917 -8.952 1.00 0.00 C ATOM 1720 O LEU A 110 10.798 4.042 -9.443 1.00 0.00 O ATOM 1721 CB LEU A 110 9.729 0.783 -9.811 1.00 0.00 C ATOM 1722 CG LEU A 110 8.512 -0.026 -10.262 1.00 0.00 C ATOM 1723 CD1 LEU A 110 8.928 -1.427 -10.681 1.00 0.00 C ATOM 1724 CD2 LEU A 110 7.470 -0.085 -9.154 1.00 0.00 C ATOM 0 H LEU A 110 8.143 2.442 -10.713 1.00 0.00 H new ATOM 0 HA LEU A 110 9.048 1.886 -8.095 1.00 0.00 H new ATOM 0 HB2 LEU A 110 10.341 1.000 -10.687 1.00 0.00 H new ATOM 0 HB3 LEU A 110 10.330 0.159 -9.149 1.00 0.00 H new ATOM 0 HG LEU A 110 8.068 0.472 -11.124 1.00 0.00 H new ATOM 0 HD11 LEU A 110 8.049 -1.988 -10.999 1.00 0.00 H new ATOM 0 HD12 LEU A 110 9.637 -1.364 -11.507 1.00 0.00 H new ATOM 0 HD13 LEU A 110 9.397 -1.935 -9.838 1.00 0.00 H new ATOM 0 HD21 LEU A 110 6.611 -0.665 -9.493 1.00 0.00 H new ATOM 0 HD22 LEU A 110 7.903 -0.559 -8.273 1.00 0.00 H new ATOM 0 HD23 LEU A 110 7.149 0.926 -8.902 1.00 0.00 H new ATOM 1736 N GLU A 111 11.704 2.342 -8.281 1.00 0.00 N ATOM 1737 CA GLU A 111 12.980 3.017 -8.077 1.00 0.00 C ATOM 1738 C GLU A 111 14.068 2.396 -8.949 1.00 0.00 C ATOM 1739 O GLU A 111 14.967 1.720 -8.450 1.00 0.00 O ATOM 1740 CB GLU A 111 13.390 2.947 -6.605 1.00 0.00 C ATOM 1741 CG GLU A 111 14.437 3.978 -6.215 1.00 0.00 C ATOM 1742 CD GLU A 111 15.838 3.569 -6.626 1.00 0.00 C ATOM 1743 OE1 GLU A 111 16.210 3.814 -7.793 1.00 0.00 O ATOM 1744 OE2 GLU A 111 16.563 3.006 -5.780 1.00 0.00 O ATOM 0 H GLU A 111 11.649 1.410 -7.869 1.00 0.00 H new ATOM 0 HA GLU A 111 12.860 4.062 -8.364 1.00 0.00 H new ATOM 0 HB2 GLU A 111 12.506 3.086 -5.983 1.00 0.00 H new ATOM 0 HB3 GLU A 111 13.776 1.950 -6.391 1.00 0.00 H new ATOM 0 HG2 GLU A 111 14.191 4.934 -6.678 1.00 0.00 H new ATOM 0 HG3 GLU A 111 14.408 4.130 -5.136 1.00 0.00 H new ATOM 1751 N GLU A 112 13.979 2.633 -10.254 1.00 0.00 N ATOM 1752 CA GLU A 112 14.955 2.096 -11.196 1.00 0.00 C ATOM 1753 C GLU A 112 15.969 3.164 -11.596 1.00 0.00 C ATOM 1754 O GLU A 112 15.642 4.348 -11.668 1.00 0.00 O ATOM 1755 CB GLU A 112 14.251 1.554 -12.441 1.00 0.00 C ATOM 1756 CG GLU A 112 13.530 2.622 -13.246 1.00 0.00 C ATOM 1757 CD GLU A 112 12.682 2.039 -14.361 1.00 0.00 C ATOM 1758 OE1 GLU A 112 13.195 1.184 -15.112 1.00 0.00 O ATOM 1759 OE2 GLU A 112 11.505 2.438 -14.480 1.00 0.00 O ATOM 0 H GLU A 112 13.242 3.193 -10.683 1.00 0.00 H new ATOM 0 HA GLU A 112 15.486 1.281 -10.704 1.00 0.00 H new ATOM 0 HB2 GLU A 112 14.986 1.064 -13.079 1.00 0.00 H new ATOM 0 HB3 GLU A 112 13.533 0.792 -12.139 1.00 0.00 H new ATOM 0 HG2 GLU A 112 12.896 3.207 -12.580 1.00 0.00 H new ATOM 0 HG3 GLU A 112 14.263 3.307 -13.672 1.00 0.00 H new ATOM 1766 N GLU A 113 17.200 2.735 -11.854 1.00 0.00 N ATOM 1767 CA GLU A 113 18.262 3.655 -12.245 1.00 0.00 C ATOM 1768 C GLU A 113 17.913 4.365 -13.550 1.00 0.00 C ATOM 1769 O GLU A 113 17.876 3.748 -14.615 1.00 0.00 O ATOM 1770 CB GLU A 113 19.587 2.904 -12.399 1.00 0.00 C ATOM 1771 CG GLU A 113 20.181 2.441 -11.079 1.00 0.00 C ATOM 1772 CD GLU A 113 19.621 1.108 -10.623 1.00 0.00 C ATOM 1773 OE1 GLU A 113 20.013 0.071 -11.197 1.00 0.00 O ATOM 1774 OE2 GLU A 113 18.789 1.102 -9.691 1.00 0.00 O ATOM 0 H GLU A 113 17.487 1.758 -11.800 1.00 0.00 H new ATOM 0 HA GLU A 113 18.366 4.404 -11.460 1.00 0.00 H new ATOM 0 HB2 GLU A 113 19.431 2.037 -13.042 1.00 0.00 H new ATOM 0 HB3 GLU A 113 20.305 3.550 -12.904 1.00 0.00 H new ATOM 0 HG2 GLU A 113 21.263 2.361 -11.180 1.00 0.00 H new ATOM 0 HG3 GLU A 113 19.987 3.193 -10.314 1.00 0.00 H new ATOM 1781 N ASP A 114 17.658 5.666 -13.459 1.00 0.00 N ATOM 1782 CA ASP A 114 17.313 6.461 -14.631 1.00 0.00 C ATOM 1783 C ASP A 114 18.447 7.415 -14.994 1.00 0.00 C ATOM 1784 O ASP A 114 18.810 8.293 -14.211 1.00 0.00 O ATOM 1785 CB ASP A 114 16.028 7.251 -14.377 1.00 0.00 C ATOM 1786 CG ASP A 114 16.196 8.298 -13.294 1.00 0.00 C ATOM 1787 OD1 ASP A 114 16.452 7.914 -12.133 1.00 0.00 O ATOM 1788 OD2 ASP A 114 16.071 9.501 -13.606 1.00 0.00 O ATOM 0 H ASP A 114 17.684 6.192 -12.585 1.00 0.00 H new ATOM 0 HA ASP A 114 17.153 5.780 -15.467 1.00 0.00 H new ATOM 0 HB2 ASP A 114 15.715 7.736 -15.301 1.00 0.00 H new ATOM 0 HB3 ASP A 114 15.232 6.563 -14.092 1.00 0.00 H new ATOM 1793 N THR A 115 19.005 7.235 -16.187 1.00 0.00 N ATOM 1794 CA THR A 115 20.100 8.077 -16.654 1.00 0.00 C ATOM 1795 C THR A 115 19.782 8.689 -18.013 1.00 0.00 C ATOM 1796 O THR A 115 19.963 8.051 -19.050 1.00 0.00 O ATOM 1797 CB THR A 115 21.415 7.283 -16.756 1.00 0.00 C ATOM 1798 OG1 THR A 115 21.341 6.350 -17.840 1.00 0.00 O ATOM 1799 CG2 THR A 115 21.701 6.540 -15.460 1.00 0.00 C ATOM 0 H THR A 115 18.717 6.513 -16.848 1.00 0.00 H new ATOM 0 HA THR A 115 20.221 8.873 -15.920 1.00 0.00 H new ATOM 0 HB THR A 115 22.226 7.988 -16.938 1.00 0.00 H new ATOM 0 HG1 THR A 115 20.543 6.536 -18.378 1.00 0.00 H new ATOM 0 HG21 THR A 115 22.635 5.986 -15.556 1.00 0.00 H new ATOM 0 HG22 THR A 115 21.786 7.255 -14.642 1.00 0.00 H new ATOM 0 HG23 THR A 115 20.887 5.845 -15.252 1.00 0.00 H new ATOM 1807 N GLY A 116 19.307 9.931 -18.002 1.00 0.00 N ATOM 1808 CA GLY A 116 18.972 10.608 -19.241 1.00 0.00 C ATOM 1809 C GLY A 116 20.052 11.576 -19.683 1.00 0.00 C ATOM 1810 O GLY A 116 20.382 12.519 -18.964 1.00 0.00 O ATOM 0 H GLY A 116 19.148 10.480 -17.157 1.00 0.00 H new ATOM 0 HA2 GLY A 116 18.810 9.867 -20.024 1.00 0.00 H new ATOM 0 HA3 GLY A 116 18.034 11.148 -19.114 1.00 0.00 H new ATOM 1814 N ASP A 117 20.605 11.342 -20.868 1.00 0.00 N ATOM 1815 CA ASP A 117 21.655 12.200 -21.405 1.00 0.00 C ATOM 1816 C ASP A 117 21.108 13.584 -21.737 1.00 0.00 C ATOM 1817 O ASP A 117 21.356 14.550 -21.015 1.00 0.00 O ATOM 1818 CB ASP A 117 22.270 11.568 -22.654 1.00 0.00 C ATOM 1819 CG ASP A 117 21.267 10.747 -23.442 1.00 0.00 C ATOM 1820 OD1 ASP A 117 20.935 9.629 -22.996 1.00 0.00 O ATOM 1821 OD2 ASP A 117 20.814 11.224 -24.503 1.00 0.00 O ATOM 0 H ASP A 117 20.344 10.565 -21.475 1.00 0.00 H new ATOM 0 HA ASP A 117 22.428 12.307 -20.644 1.00 0.00 H new ATOM 0 HB2 ASP A 117 22.675 12.353 -23.293 1.00 0.00 H new ATOM 0 HB3 ASP A 117 23.106 10.932 -22.362 1.00 0.00 H new ATOM 1826 N ASP A 118 20.364 13.674 -22.834 1.00 0.00 N ATOM 1827 CA ASP A 118 19.781 14.940 -23.262 1.00 0.00 C ATOM 1828 C ASP A 118 18.426 15.167 -22.599 1.00 0.00 C ATOM 1829 O ASP A 118 17.717 14.226 -22.242 1.00 0.00 O ATOM 1830 CB ASP A 118 19.630 14.968 -24.783 1.00 0.00 C ATOM 1831 CG ASP A 118 20.883 15.461 -25.481 1.00 0.00 C ATOM 1832 OD1 ASP A 118 21.308 16.601 -25.200 1.00 0.00 O ATOM 1833 OD2 ASP A 118 21.438 14.707 -26.308 1.00 0.00 O ATOM 0 H ASP A 118 20.150 12.884 -23.443 1.00 0.00 H new ATOM 0 HA ASP A 118 20.453 15.742 -22.957 1.00 0.00 H new ATOM 0 HB2 ASP A 118 19.389 13.967 -25.140 1.00 0.00 H new ATOM 0 HB3 ASP A 118 18.792 15.612 -25.050 1.00 0.00 H new ATOM 1838 N PRO A 119 18.056 16.445 -22.430 1.00 0.00 N ATOM 1839 CA PRO A 119 16.784 16.826 -21.809 1.00 0.00 C ATOM 1840 C PRO A 119 15.586 16.493 -22.692 1.00 0.00 C ATOM 1841 O PRO A 119 14.572 15.986 -22.213 1.00 0.00 O ATOM 1842 CB PRO A 119 16.914 18.340 -21.632 1.00 0.00 C ATOM 1843 CG PRO A 119 17.888 18.762 -22.679 1.00 0.00 C ATOM 1844 CD PRO A 119 18.852 17.617 -22.832 1.00 0.00 C ATOM 0 HA PRO A 119 16.608 16.289 -20.877 1.00 0.00 H new ATOM 0 HB2 PRO A 119 15.953 18.838 -21.762 1.00 0.00 H new ATOM 0 HB3 PRO A 119 17.272 18.593 -20.634 1.00 0.00 H new ATOM 0 HG2 PRO A 119 17.382 18.974 -23.621 1.00 0.00 H new ATOM 0 HG3 PRO A 119 18.408 19.673 -22.384 1.00 0.00 H new ATOM 0 HD2 PRO A 119 19.210 17.527 -23.858 1.00 0.00 H new ATOM 0 HD3 PRO A 119 19.730 17.743 -22.198 1.00 0.00 H new TER 1852 PRO A 119