USER MOD reduce.3.24.130724 H: found=0, std=0, add=1047, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1047 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 82 SER OG : rot 156:sc= 2.16 USER MOD Set 1.2: A 93 HIS : no HD1:sc= 0.123 K(o=2.1,f=-6.6!) USER MOD Set 1.3: A 95 GLN : amide:sc= -0.165 K(o=2.1,f=-1.1!) USER MOD Set 2.1: A 40 THR OG1 : rot 144:sc= 2.41 USER MOD Set 2.2: A 53 THR OG1 : rot 61:sc= 0.928 USER MOD Set 2.3: A 128 TYR OH : rot -130:sc= 0.848 USER MOD Set 3.1: A 19 TYR OH : rot -165:sc= 0.783 USER MOD Set 3.2: A 102 THR OG1 : rot 27:sc= 1.33 USER MOD Single : A 1 VAL N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 82:sc= 0.99 USER MOD Single : A 9 LYS NZ :NH3+ 146:sc= 1.08 (180deg=0.421) USER MOD Single : A 13 SER OG : rot -46:sc= 1.83 USER MOD Single : A 14 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.025) USER MOD Single : A 15 ASN : amide:sc= 0.977 K(o=0.98,f=-0.88) USER MOD Single : A 20 MET CE :methyl -172:sc= -0.161 (180deg=-0.213) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 GLN : amide:sc= -0.712 X(o=-0.71,f=-0.31) USER MOD Single : A 34 ASN : amide:sc= -0.262 K(o=-0.26,f=-7.8!) USER MOD Single : A 35 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 36 THR OG1 : rot 68:sc= 1.08 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot 70:sc= 0.848 USER MOD Single : A 45 ASN : amide:sc= -0.118 K(o=-0.12,f=-2.3!) USER MOD Single : A 48 THR OG1 : rot -56:sc= 1.28 USER MOD Single : A 52 LYS NZ :NH3+ -167:sc= 0.341 (180deg=-0.226!) USER MOD Single : A 54 GLN : amide:sc= 0.608 K(o=0.61,f=0) USER MOD Single : A 55 SER OG : rot 36:sc= 1 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0.0546 USER MOD Single : A 58 LYS NZ :NH3+ 136:sc= -0.197 (180deg=-2.04) USER MOD Single : A 59 ASN : amide:sc= -0.153 K(o=-0.15,f=-3.4!) USER MOD Single : A 60 THR OG1 : rot 180:sc= -0.109 USER MOD Single : A 63 SER OG : rot 180:sc= 0.00883 USER MOD Single : A 65 LYS NZ :NH3+ 153:sc= 0.875 (180deg=-1.85!) USER MOD Single : A 73 THR OG1 : rot 162:sc= 0.961 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0.364 USER MOD Single : A 79 LYS NZ :NH3+ 166:sc= -1.31 (180deg=-2.33!) USER MOD Single : A 81 LYS NZ :NH3+ 177:sc= 1.24 (180deg=1.04) USER MOD Single : A 85 THR OG1 : rot 180:sc=-0.00989 USER MOD Single : A 90 LYS NZ :NH3+ 145:sc= 0.894 (180deg=-0.328!) USER MOD Single : A 96 LYS NZ :NH3+ -126:sc= 1.18 (180deg=-0.855) USER MOD Single : A 98 ASN : amide:sc=-0.00677 X(o=-0.0068,f=-0.25) USER MOD Single : A 100 GLN : amide:sc= 0.0749 X(o=0.075,f=-0.017) USER MOD Single : A 103 SER OG : rot 180:sc= -0.0518 USER MOD Single : A 108 MET CE :methyl 180:sc= -0.0771 (180deg=-0.0771) USER MOD Single : A 112 LYS NZ :NH3+ 174:sc= 1.23 (180deg=1.05) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 HIS : no HE2:sc= 0.518 K(o=0.52,f=-4!) USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 CYS SG : rot -110:sc= -3.63! USER MOD Single : A 125 THR OG1 : rot 72:sc= 1.29 USER MOD Single : A 127 THR OG1 : rot 180:sc= -0.144 USER MOD Single : A 130 LYS NZ :NH3+ -174:sc= 0.0839 (180deg=0.0772) USER MOD Single : A 131 GLN :FLIP amide:sc=-0.00176 F(o=-0.74,f=-0.0018) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 10.581 -12.741 -4.528 1.00 0.00 N ATOM 2 CA VAL A 1 10.815 -12.141 -3.224 1.00 0.00 C ATOM 3 C VAL A 1 11.694 -10.894 -3.373 1.00 0.00 C ATOM 4 O VAL A 1 11.287 -9.803 -2.974 1.00 0.00 O ATOM 5 CB VAL A 1 11.339 -13.205 -2.236 1.00 0.00 C ATOM 6 CG1 VAL A 1 12.680 -13.846 -2.620 1.00 0.00 C ATOM 7 CG2 VAL A 1 11.440 -12.646 -0.813 1.00 0.00 C ATOM 0 H1 VAL A 1 9.984 -13.586 -4.419 1.00 0.00 H new ATOM 0 H2 VAL A 1 10.101 -12.055 -5.145 1.00 0.00 H new ATOM 0 H3 VAL A 1 11.490 -13.012 -4.954 1.00 0.00 H new ATOM 0 HA VAL A 1 9.883 -11.784 -2.786 1.00 0.00 H new ATOM 0 HB VAL A 1 10.592 -13.997 -2.284 1.00 0.00 H new ATOM 0 HG11 VAL A 1 12.963 -14.579 -1.864 1.00 0.00 H new ATOM 0 HG12 VAL A 1 12.583 -14.340 -3.587 1.00 0.00 H new ATOM 0 HG13 VAL A 1 13.448 -13.075 -2.682 1.00 0.00 H new ATOM 0 HG21 VAL A 1 11.812 -13.421 -0.143 1.00 0.00 H new ATOM 0 HG22 VAL A 1 12.125 -11.798 -0.803 1.00 0.00 H new ATOM 0 HG23 VAL A 1 10.455 -12.320 -0.479 1.00 0.00 H new ATOM 19 N ASP A 2 12.859 -11.040 -4.012 1.00 0.00 N ATOM 20 CA ASP A 2 13.847 -10.002 -4.306 1.00 0.00 C ATOM 21 C ASP A 2 13.188 -8.722 -4.814 1.00 0.00 C ATOM 22 O ASP A 2 13.509 -7.605 -4.401 1.00 0.00 O ATOM 23 CB ASP A 2 14.811 -10.526 -5.383 1.00 0.00 C ATOM 24 CG ASP A 2 15.391 -11.891 -5.045 1.00 0.00 C ATOM 25 OD1 ASP A 2 14.566 -12.832 -4.982 1.00 0.00 O ATOM 26 OD2 ASP A 2 16.622 -11.960 -4.851 1.00 0.00 O ATOM 0 H ASP A 2 13.155 -11.951 -4.361 1.00 0.00 H new ATOM 0 HA ASP A 2 14.379 -9.767 -3.384 1.00 0.00 H new ATOM 0 HB2 ASP A 2 14.285 -10.586 -6.336 1.00 0.00 H new ATOM 0 HB3 ASP A 2 15.625 -9.813 -5.513 1.00 0.00 H new ATOM 31 N ALA A 3 12.243 -8.922 -5.732 1.00 0.00 N ATOM 32 CA ALA A 3 11.474 -7.900 -6.419 1.00 0.00 C ATOM 33 C ALA A 3 10.783 -6.940 -5.453 1.00 0.00 C ATOM 34 O ALA A 3 10.430 -5.830 -5.845 1.00 0.00 O ATOM 35 CB ALA A 3 10.444 -8.597 -7.313 1.00 0.00 C ATOM 0 H ALA A 3 11.982 -9.862 -6.030 1.00 0.00 H new ATOM 0 HA ALA A 3 12.155 -7.293 -7.016 1.00 0.00 H new ATOM 0 HB1 ALA A 3 9.853 -7.848 -7.840 1.00 0.00 H new ATOM 0 HB2 ALA A 3 10.959 -9.229 -8.037 1.00 0.00 H new ATOM 0 HB3 ALA A 3 9.786 -9.212 -6.699 1.00 0.00 H new ATOM 41 N PHE A 4 10.582 -7.370 -4.207 1.00 0.00 N ATOM 42 CA PHE A 4 9.815 -6.665 -3.200 1.00 0.00 C ATOM 43 C PHE A 4 10.675 -6.334 -1.975 1.00 0.00 C ATOM 44 O PHE A 4 10.123 -6.038 -0.920 1.00 0.00 O ATOM 45 CB PHE A 4 8.615 -7.558 -2.845 1.00 0.00 C ATOM 46 CG PHE A 4 7.866 -8.084 -4.061 1.00 0.00 C ATOM 47 CD1 PHE A 4 7.400 -7.183 -5.037 1.00 0.00 C ATOM 48 CD2 PHE A 4 7.861 -9.464 -4.339 1.00 0.00 C ATOM 49 CE1 PHE A 4 6.986 -7.651 -6.296 1.00 0.00 C ATOM 50 CE2 PHE A 4 7.421 -9.935 -5.588 1.00 0.00 C ATOM 51 CZ PHE A 4 7.010 -9.026 -6.577 1.00 0.00 C ATOM 0 H PHE A 4 10.966 -8.252 -3.867 1.00 0.00 H new ATOM 0 HA PHE A 4 9.465 -5.704 -3.578 1.00 0.00 H new ATOM 0 HB2 PHE A 4 8.964 -8.402 -2.251 1.00 0.00 H new ATOM 0 HB3 PHE A 4 7.924 -6.992 -2.220 1.00 0.00 H new ATOM 0 HD1 PHE A 4 7.360 -6.126 -4.817 1.00 0.00 H new ATOM 0 HD2 PHE A 4 8.197 -10.164 -3.589 1.00 0.00 H new ATOM 0 HE1 PHE A 4 6.649 -6.952 -7.048 1.00 0.00 H new ATOM 0 HE2 PHE A 4 7.399 -10.996 -5.787 1.00 0.00 H new ATOM 0 HZ PHE A 4 6.713 -9.384 -7.552 1.00 0.00 H new ATOM 61 N VAL A 5 12.010 -6.376 -2.100 1.00 0.00 N ATOM 62 CA VAL A 5 12.933 -6.144 -0.990 1.00 0.00 C ATOM 63 C VAL A 5 13.479 -4.711 -1.021 1.00 0.00 C ATOM 64 O VAL A 5 14.508 -4.468 -1.656 1.00 0.00 O ATOM 65 CB VAL A 5 14.076 -7.182 -1.042 1.00 0.00 C ATOM 66 CG1 VAL A 5 15.193 -6.867 -0.031 1.00 0.00 C ATOM 67 CG2 VAL A 5 13.563 -8.593 -0.733 1.00 0.00 C ATOM 0 H VAL A 5 12.479 -6.574 -2.984 1.00 0.00 H new ATOM 0 HA VAL A 5 12.396 -6.264 -0.049 1.00 0.00 H new ATOM 0 HB VAL A 5 14.473 -7.132 -2.056 1.00 0.00 H new ATOM 0 HG11 VAL A 5 15.974 -7.624 -0.104 1.00 0.00 H new ATOM 0 HG12 VAL A 5 15.616 -5.887 -0.250 1.00 0.00 H new ATOM 0 HG13 VAL A 5 14.781 -6.867 0.978 1.00 0.00 H new ATOM 0 HG21 VAL A 5 14.392 -9.299 -0.778 1.00 0.00 H new ATOM 0 HG22 VAL A 5 13.125 -8.610 0.265 1.00 0.00 H new ATOM 0 HG23 VAL A 5 12.807 -8.874 -1.466 1.00 0.00 H new ATOM 77 N GLY A 6 12.849 -3.784 -0.288 1.00 0.00 N ATOM 78 CA GLY A 6 13.463 -2.527 0.137 1.00 0.00 C ATOM 79 C GLY A 6 12.589 -1.301 -0.130 1.00 0.00 C ATOM 80 O GLY A 6 11.396 -1.414 -0.409 1.00 0.00 O ATOM 0 H GLY A 6 11.885 -3.891 0.029 1.00 0.00 H new ATOM 0 HA2 GLY A 6 13.683 -2.581 1.203 1.00 0.00 H new ATOM 0 HA3 GLY A 6 14.415 -2.404 -0.379 1.00 0.00 H new ATOM 84 N THR A 7 13.197 -0.114 -0.039 1.00 0.00 N ATOM 85 CA THR A 7 12.554 1.147 -0.382 1.00 0.00 C ATOM 86 C THR A 7 12.647 1.392 -1.886 1.00 0.00 C ATOM 87 O THR A 7 13.674 1.089 -2.502 1.00 0.00 O ATOM 88 CB THR A 7 13.179 2.301 0.415 1.00 0.00 C ATOM 89 OG1 THR A 7 13.312 1.935 1.770 1.00 0.00 O ATOM 90 CG2 THR A 7 12.332 3.576 0.339 1.00 0.00 C ATOM 0 H THR A 7 14.160 -0.006 0.279 1.00 0.00 H new ATOM 0 HA THR A 7 11.499 1.093 -0.114 1.00 0.00 H new ATOM 0 HB THR A 7 14.154 2.503 -0.027 1.00 0.00 H new ATOM 0 HG1 THR A 7 14.123 1.397 1.885 1.00 0.00 H new ATOM 0 HG21 THR A 7 12.811 4.366 0.917 1.00 0.00 H new ATOM 0 HG22 THR A 7 12.241 3.891 -0.701 1.00 0.00 H new ATOM 0 HG23 THR A 7 11.340 3.379 0.747 1.00 0.00 H new ATOM 98 N TRP A 8 11.591 1.968 -2.464 1.00 0.00 N ATOM 99 CA TRP A 8 11.502 2.322 -3.868 1.00 0.00 C ATOM 100 C TRP A 8 10.957 3.748 -3.976 1.00 0.00 C ATOM 101 O TRP A 8 10.072 4.120 -3.203 1.00 0.00 O ATOM 102 CB TRP A 8 10.571 1.336 -4.586 1.00 0.00 C ATOM 103 CG TRP A 8 10.797 -0.121 -4.305 1.00 0.00 C ATOM 104 CD1 TRP A 8 10.407 -0.758 -3.178 1.00 0.00 C ATOM 105 CD2 TRP A 8 11.475 -1.133 -5.110 1.00 0.00 C ATOM 106 NE1 TRP A 8 10.856 -2.058 -3.194 1.00 0.00 N ATOM 107 CE2 TRP A 8 11.537 -2.342 -4.356 1.00 0.00 C ATOM 108 CE3 TRP A 8 12.051 -1.154 -6.398 1.00 0.00 C ATOM 109 CZ2 TRP A 8 12.182 -3.494 -4.829 1.00 0.00 C ATOM 110 CZ3 TRP A 8 12.686 -2.310 -6.892 1.00 0.00 C ATOM 111 CH2 TRP A 8 12.766 -3.472 -6.105 1.00 0.00 C ATOM 0 H TRP A 8 10.748 2.206 -1.942 1.00 0.00 H new ATOM 0 HA TRP A 8 12.485 2.273 -4.336 1.00 0.00 H new ATOM 0 HB2 TRP A 8 9.543 1.580 -4.318 1.00 0.00 H new ATOM 0 HB3 TRP A 8 10.667 1.496 -5.660 1.00 0.00 H new ATOM 0 HD1 TRP A 8 9.828 -0.312 -2.383 1.00 0.00 H new ATOM 0 HE1 TRP A 8 10.704 -2.727 -2.440 1.00 0.00 H new ATOM 0 HE3 TRP A 8 12.004 -0.269 -7.015 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 12.229 -4.385 -4.220 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 13.115 -2.304 -7.883 1.00 0.00 H new ATOM 0 HH2 TRP A 8 13.276 -4.346 -6.482 1.00 0.00 H new ATOM 122 N LYS A 9 11.475 4.543 -4.920 1.00 0.00 N ATOM 123 CA LYS A 9 10.847 5.795 -5.332 1.00 0.00 C ATOM 124 C LYS A 9 9.937 5.503 -6.526 1.00 0.00 C ATOM 125 O LYS A 9 10.353 4.819 -7.460 1.00 0.00 O ATOM 126 CB LYS A 9 11.870 6.903 -5.669 1.00 0.00 C ATOM 127 CG LYS A 9 12.923 6.554 -6.737 1.00 0.00 C ATOM 128 CD LYS A 9 14.265 6.153 -6.114 1.00 0.00 C ATOM 129 CE LYS A 9 15.318 5.619 -7.105 1.00 0.00 C ATOM 130 NZ LYS A 9 15.459 6.419 -8.346 1.00 0.00 N ATOM 0 H LYS A 9 12.341 4.333 -5.417 1.00 0.00 H new ATOM 0 HA LYS A 9 10.266 6.182 -4.495 1.00 0.00 H new ATOM 0 HB2 LYS A 9 11.323 7.785 -6.003 1.00 0.00 H new ATOM 0 HB3 LYS A 9 12.391 7.179 -4.752 1.00 0.00 H new ATOM 0 HG2 LYS A 9 12.553 5.737 -7.357 1.00 0.00 H new ATOM 0 HG3 LYS A 9 13.070 7.411 -7.394 1.00 0.00 H new ATOM 0 HD2 LYS A 9 14.681 7.019 -5.599 1.00 0.00 H new ATOM 0 HD3 LYS A 9 14.082 5.390 -5.358 1.00 0.00 H new ATOM 0 HE2 LYS A 9 16.284 5.579 -6.602 1.00 0.00 H new ATOM 0 HE3 LYS A 9 15.057 4.596 -7.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 16.451 6.404 -8.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 14.856 6.014 -9.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 15.169 7.401 -8.161 1.00 0.00 H new ATOM 144 N LEU A 10 8.704 6.009 -6.505 1.00 0.00 N ATOM 145 CA LEU A 10 7.863 6.046 -7.694 1.00 0.00 C ATOM 146 C LEU A 10 8.491 7.001 -8.717 1.00 0.00 C ATOM 147 O LEU A 10 9.068 8.012 -8.314 1.00 0.00 O ATOM 148 CB LEU A 10 6.464 6.492 -7.258 1.00 0.00 C ATOM 149 CG LEU A 10 5.507 6.771 -8.428 1.00 0.00 C ATOM 150 CD1 LEU A 10 4.054 6.493 -8.024 1.00 0.00 C ATOM 151 CD2 LEU A 10 5.630 8.225 -8.917 1.00 0.00 C ATOM 0 H LEU A 10 8.266 6.400 -5.671 1.00 0.00 H new ATOM 0 HA LEU A 10 7.782 5.069 -8.171 1.00 0.00 H new ATOM 0 HB2 LEU A 10 6.029 5.721 -6.622 1.00 0.00 H new ATOM 0 HB3 LEU A 10 6.553 7.393 -6.651 1.00 0.00 H new ATOM 0 HG LEU A 10 5.789 6.102 -9.241 1.00 0.00 H new ATOM 0 HD11 LEU A 10 3.396 6.698 -8.869 1.00 0.00 H new ATOM 0 HD12 LEU A 10 3.952 5.449 -7.729 1.00 0.00 H new ATOM 0 HD13 LEU A 10 3.780 7.135 -7.187 1.00 0.00 H new ATOM 0 HD21 LEU A 10 4.940 8.390 -9.745 1.00 0.00 H new ATOM 0 HD22 LEU A 10 5.387 8.905 -8.101 1.00 0.00 H new ATOM 0 HD23 LEU A 10 6.650 8.411 -9.252 1.00 0.00 H new ATOM 163 N VAL A 11 8.383 6.694 -10.017 1.00 0.00 N ATOM 164 CA VAL A 11 8.825 7.578 -11.094 1.00 0.00 C ATOM 165 C VAL A 11 7.698 7.833 -12.113 1.00 0.00 C ATOM 166 O VAL A 11 7.316 8.988 -12.294 1.00 0.00 O ATOM 167 CB VAL A 11 10.170 7.104 -11.677 1.00 0.00 C ATOM 168 CG1 VAL A 11 10.087 5.814 -12.488 1.00 0.00 C ATOM 169 CG2 VAL A 11 10.813 8.188 -12.546 1.00 0.00 C ATOM 0 H VAL A 11 7.982 5.817 -10.349 1.00 0.00 H new ATOM 0 HA VAL A 11 9.038 8.568 -10.692 1.00 0.00 H new ATOM 0 HB VAL A 11 10.786 6.897 -10.802 1.00 0.00 H new ATOM 0 HG11 VAL A 11 11.078 5.554 -12.860 1.00 0.00 H new ATOM 0 HG12 VAL A 11 9.715 5.009 -11.854 1.00 0.00 H new ATOM 0 HG13 VAL A 11 9.409 5.956 -13.330 1.00 0.00 H new ATOM 0 HG21 VAL A 11 11.760 7.822 -12.942 1.00 0.00 H new ATOM 0 HG22 VAL A 11 10.146 8.436 -13.372 1.00 0.00 H new ATOM 0 HG23 VAL A 11 10.991 9.079 -11.944 1.00 0.00 H new ATOM 179 N ASP A 12 7.122 6.797 -12.745 1.00 0.00 N ATOM 180 CA ASP A 12 5.918 6.997 -13.567 1.00 0.00 C ATOM 181 C ASP A 12 4.687 7.097 -12.660 1.00 0.00 C ATOM 182 O ASP A 12 4.718 6.643 -11.519 1.00 0.00 O ATOM 183 CB ASP A 12 5.736 5.906 -14.640 1.00 0.00 C ATOM 184 CG ASP A 12 4.450 6.096 -15.449 1.00 0.00 C ATOM 185 OD1 ASP A 12 4.133 7.269 -15.751 1.00 0.00 O ATOM 186 OD2 ASP A 12 3.754 5.083 -15.682 1.00 0.00 O ATOM 0 H ASP A 12 7.460 5.836 -12.705 1.00 0.00 H new ATOM 0 HA ASP A 12 6.042 7.932 -14.113 1.00 0.00 H new ATOM 0 HB2 ASP A 12 6.592 5.917 -15.315 1.00 0.00 H new ATOM 0 HB3 ASP A 12 5.720 4.927 -14.161 1.00 0.00 H new ATOM 191 N SER A 13 3.597 7.671 -13.168 1.00 0.00 N ATOM 192 CA SER A 13 2.317 7.818 -12.489 1.00 0.00 C ATOM 193 C SER A 13 1.287 8.309 -13.507 1.00 0.00 C ATOM 194 O SER A 13 0.669 9.353 -13.293 1.00 0.00 O ATOM 195 CB SER A 13 2.472 8.783 -11.297 1.00 0.00 C ATOM 196 OG SER A 13 1.219 9.112 -10.712 1.00 0.00 O ATOM 0 H SER A 13 3.585 8.064 -14.109 1.00 0.00 H new ATOM 0 HA SER A 13 1.973 6.866 -12.085 1.00 0.00 H new ATOM 0 HB2 SER A 13 3.116 8.328 -10.544 1.00 0.00 H new ATOM 0 HB3 SER A 13 2.967 9.695 -11.631 1.00 0.00 H new ATOM 0 HG SER A 13 0.576 9.333 -11.418 1.00 0.00 H new ATOM 202 N LYS A 14 1.094 7.578 -14.606 1.00 0.00 N ATOM 203 CA LYS A 14 0.225 8.029 -15.680 1.00 0.00 C ATOM 204 C LYS A 14 -1.212 7.592 -15.397 1.00 0.00 C ATOM 205 O LYS A 14 -1.471 6.409 -15.164 1.00 0.00 O ATOM 206 CB LYS A 14 0.727 7.517 -17.039 1.00 0.00 C ATOM 207 CG LYS A 14 0.229 8.383 -18.209 1.00 0.00 C ATOM 208 CD LYS A 14 0.929 9.751 -18.342 1.00 0.00 C ATOM 209 CE LYS A 14 2.439 9.673 -18.616 1.00 0.00 C ATOM 210 NZ LYS A 14 2.753 8.885 -19.825 1.00 0.00 N ATOM 0 H LYS A 14 1.531 6.671 -14.770 1.00 0.00 H new ATOM 0 HA LYS A 14 0.243 9.118 -15.727 1.00 0.00 H new ATOM 0 HB2 LYS A 14 1.817 7.502 -17.039 1.00 0.00 H new ATOM 0 HB3 LYS A 14 0.394 6.489 -17.183 1.00 0.00 H new ATOM 0 HG2 LYS A 14 0.366 7.829 -19.137 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -0.842 8.548 -18.091 1.00 0.00 H new ATOM 0 HD2 LYS A 14 0.455 10.310 -19.149 1.00 0.00 H new ATOM 0 HD3 LYS A 14 0.768 10.317 -17.425 1.00 0.00 H new ATOM 0 HE2 LYS A 14 2.837 10.681 -18.730 1.00 0.00 H new ATOM 0 HE3 LYS A 14 2.939 9.228 -17.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 3.774 8.932 -20.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 2.474 7.894 -19.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 2.232 9.273 -20.637 1.00 0.00 H new ATOM 224 N ASN A 15 -2.137 8.558 -15.436 1.00 0.00 N ATOM 225 CA ASN A 15 -3.570 8.383 -15.219 1.00 0.00 C ATOM 226 C ASN A 15 -3.832 7.983 -13.760 1.00 0.00 C ATOM 227 O ASN A 15 -4.777 7.258 -13.457 1.00 0.00 O ATOM 228 CB ASN A 15 -4.188 7.353 -16.187 1.00 0.00 C ATOM 229 CG ASN A 15 -3.866 7.510 -17.668 1.00 0.00 C ATOM 230 OD1 ASN A 15 -3.354 8.530 -18.117 1.00 0.00 O ATOM 231 ND2 ASN A 15 -4.164 6.472 -18.446 1.00 0.00 N ATOM 0 H ASN A 15 -1.890 9.529 -15.629 1.00 0.00 H new ATOM 0 HA ASN A 15 -4.055 9.337 -15.425 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -3.866 6.360 -15.875 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -5.271 7.388 -16.071 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -3.967 6.511 -19.446 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -4.589 5.638 -18.042 1.00 0.00 H new ATOM 238 N PHE A 16 -2.971 8.379 -12.827 1.00 0.00 N ATOM 239 CA PHE A 16 -3.056 7.895 -11.455 1.00 0.00 C ATOM 240 C PHE A 16 -4.063 8.765 -10.707 1.00 0.00 C ATOM 241 O PHE A 16 -5.001 8.279 -10.076 1.00 0.00 O ATOM 242 CB PHE A 16 -1.661 7.922 -10.832 1.00 0.00 C ATOM 243 CG PHE A 16 -1.542 7.087 -9.574 1.00 0.00 C ATOM 244 CD1 PHE A 16 -2.033 7.570 -8.349 1.00 0.00 C ATOM 245 CD2 PHE A 16 -1.078 5.764 -9.663 1.00 0.00 C ATOM 246 CE1 PHE A 16 -2.001 6.759 -7.202 1.00 0.00 C ATOM 247 CE2 PHE A 16 -1.100 4.936 -8.531 1.00 0.00 C ATOM 248 CZ PHE A 16 -1.540 5.436 -7.294 1.00 0.00 C ATOM 0 H PHE A 16 -2.207 9.033 -12.997 1.00 0.00 H new ATOM 0 HA PHE A 16 -3.405 6.864 -11.406 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -0.938 7.564 -11.565 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -1.396 8.953 -10.600 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -2.437 8.570 -8.289 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -0.704 5.385 -10.603 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -2.330 7.152 -6.252 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -0.777 3.909 -8.611 1.00 0.00 H new ATOM 0 HZ PHE A 16 -1.524 4.805 -6.417 1.00 0.00 H new ATOM 258 N ASP A 17 -3.842 10.075 -10.818 1.00 0.00 N ATOM 259 CA ASP A 17 -4.847 11.126 -10.904 1.00 0.00 C ATOM 260 C ASP A 17 -6.236 10.583 -11.294 1.00 0.00 C ATOM 261 O ASP A 17 -7.074 10.436 -10.399 1.00 0.00 O ATOM 262 CB ASP A 17 -4.307 12.176 -11.894 1.00 0.00 C ATOM 263 CG ASP A 17 -3.684 11.508 -13.114 1.00 0.00 C ATOM 264 OD1 ASP A 17 -2.539 11.017 -12.964 1.00 0.00 O ATOM 265 OD2 ASP A 17 -4.438 11.319 -14.086 1.00 0.00 O ATOM 0 H ASP A 17 -2.894 10.451 -10.852 1.00 0.00 H new ATOM 0 HA ASP A 17 -5.010 11.584 -9.928 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -5.117 12.834 -12.209 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -3.564 12.800 -11.398 1.00 0.00 H new ATOM 270 N ASP A 18 -6.463 10.270 -12.580 1.00 0.00 N ATOM 271 CA ASP A 18 -7.688 9.657 -13.105 1.00 0.00 C ATOM 272 C ASP A 18 -8.253 8.635 -12.127 1.00 0.00 C ATOM 273 O ASP A 18 -9.391 8.757 -11.681 1.00 0.00 O ATOM 274 CB ASP A 18 -7.429 9.025 -14.495 1.00 0.00 C ATOM 275 CG ASP A 18 -8.013 7.617 -14.678 1.00 0.00 C ATOM 276 OD1 ASP A 18 -9.253 7.493 -14.633 1.00 0.00 O ATOM 277 OD2 ASP A 18 -7.206 6.668 -14.818 1.00 0.00 O ATOM 0 H ASP A 18 -5.770 10.445 -13.308 1.00 0.00 H new ATOM 0 HA ASP A 18 -8.436 10.440 -13.226 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -7.847 9.679 -15.260 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -6.353 8.982 -14.665 1.00 0.00 H new ATOM 282 N TYR A 19 -7.435 7.640 -11.783 1.00 0.00 N ATOM 283 CA TYR A 19 -7.909 6.451 -11.100 1.00 0.00 C ATOM 284 C TYR A 19 -8.746 6.772 -9.868 1.00 0.00 C ATOM 285 O TYR A 19 -9.848 6.252 -9.707 1.00 0.00 O ATOM 286 CB TYR A 19 -6.721 5.543 -10.754 1.00 0.00 C ATOM 287 CG TYR A 19 -6.995 4.061 -10.889 1.00 0.00 C ATOM 288 CD1 TYR A 19 -7.553 3.580 -12.086 1.00 0.00 C ATOM 289 CD2 TYR A 19 -6.444 3.148 -9.970 1.00 0.00 C ATOM 290 CE1 TYR A 19 -7.397 2.239 -12.441 1.00 0.00 C ATOM 291 CE2 TYR A 19 -6.454 1.772 -10.255 1.00 0.00 C ATOM 292 CZ TYR A 19 -6.873 1.332 -11.520 1.00 0.00 C ATOM 293 OH TYR A 19 -6.681 0.057 -11.923 1.00 0.00 O ATOM 0 H TYR A 19 -6.433 7.641 -11.971 1.00 0.00 H new ATOM 0 HA TYR A 19 -8.575 5.921 -11.781 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -5.882 5.804 -11.400 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -6.410 5.749 -9.730 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -8.103 4.249 -12.732 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -6.014 3.505 -9.046 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -7.682 1.904 -13.428 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -6.142 1.059 -9.507 1.00 0.00 H new ATOM 0 HH TYR A 19 -6.543 -0.516 -11.140 1.00 0.00 H new ATOM 303 N MET A 20 -8.235 7.637 -8.992 1.00 0.00 N ATOM 304 CA MET A 20 -9.000 8.006 -7.812 1.00 0.00 C ATOM 305 C MET A 20 -10.234 8.836 -8.179 1.00 0.00 C ATOM 306 O MET A 20 -11.310 8.638 -7.607 1.00 0.00 O ATOM 307 CB MET A 20 -8.127 8.667 -6.747 1.00 0.00 C ATOM 308 CG MET A 20 -7.437 9.987 -7.113 1.00 0.00 C ATOM 309 SD MET A 20 -5.746 9.821 -7.713 1.00 0.00 S ATOM 310 CE MET A 20 -4.909 9.364 -6.171 1.00 0.00 C ATOM 0 H MET A 20 -7.321 8.082 -9.076 1.00 0.00 H new ATOM 0 HA MET A 20 -9.373 7.087 -7.360 1.00 0.00 H new ATOM 0 HB2 MET A 20 -8.746 8.844 -5.868 1.00 0.00 H new ATOM 0 HB3 MET A 20 -7.356 7.954 -6.455 1.00 0.00 H new ATOM 0 HG2 MET A 20 -8.030 10.490 -7.877 1.00 0.00 H new ATOM 0 HG3 MET A 20 -7.433 10.633 -6.235 1.00 0.00 H new ATOM 0 HE1 MET A 20 -3.831 9.361 -6.330 1.00 0.00 H new ATOM 0 HE2 MET A 20 -5.159 10.086 -5.393 1.00 0.00 H new ATOM 0 HE3 MET A 20 -5.233 8.370 -5.862 1.00 0.00 H new ATOM 320 N LYS A 21 -10.081 9.732 -9.160 1.00 0.00 N ATOM 321 CA LYS A 21 -11.106 10.628 -9.686 1.00 0.00 C ATOM 322 C LYS A 21 -12.044 9.835 -10.611 1.00 0.00 C ATOM 323 O LYS A 21 -12.323 10.238 -11.738 1.00 0.00 O ATOM 324 CB LYS A 21 -10.373 11.788 -10.396 1.00 0.00 C ATOM 325 CG LYS A 21 -11.115 13.135 -10.435 1.00 0.00 C ATOM 326 CD LYS A 21 -12.210 13.187 -11.513 1.00 0.00 C ATOM 327 CE LYS A 21 -12.681 14.620 -11.808 1.00 0.00 C ATOM 328 NZ LYS A 21 -13.391 15.232 -10.666 1.00 0.00 N ATOM 0 H LYS A 21 -9.185 9.855 -9.633 1.00 0.00 H new ATOM 0 HA LYS A 21 -11.738 11.050 -8.905 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -9.413 11.940 -9.903 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -10.161 11.483 -11.421 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -11.564 13.325 -9.460 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -10.396 13.934 -10.616 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -11.833 12.736 -12.431 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -13.061 12.588 -11.190 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -11.819 15.235 -12.067 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -13.339 14.610 -12.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -13.687 16.197 -10.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -14.229 14.663 -10.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -12.757 15.268 -9.842 1.00 0.00 H new ATOM 342 N SER A 22 -12.524 8.692 -10.119 1.00 0.00 N ATOM 343 CA SER A 22 -13.225 7.659 -10.865 1.00 0.00 C ATOM 344 C SER A 22 -13.598 6.560 -9.864 1.00 0.00 C ATOM 345 O SER A 22 -14.771 6.241 -9.691 1.00 0.00 O ATOM 346 CB SER A 22 -12.339 7.145 -12.017 1.00 0.00 C ATOM 347 OG SER A 22 -12.933 6.043 -12.676 1.00 0.00 O ATOM 0 H SER A 22 -12.426 8.454 -9.132 1.00 0.00 H new ATOM 0 HA SER A 22 -14.133 8.039 -11.333 1.00 0.00 H new ATOM 0 HB2 SER A 22 -12.168 7.949 -12.733 1.00 0.00 H new ATOM 0 HB3 SER A 22 -11.364 6.854 -11.626 1.00 0.00 H new ATOM 0 HG SER A 22 -12.348 5.742 -13.402 1.00 0.00 H new ATOM 353 N LEU A 23 -12.606 6.014 -9.151 1.00 0.00 N ATOM 354 CA LEU A 23 -12.834 4.983 -8.146 1.00 0.00 C ATOM 355 C LEU A 23 -13.662 5.481 -6.962 1.00 0.00 C ATOM 356 O LEU A 23 -14.509 4.732 -6.471 1.00 0.00 O ATOM 357 CB LEU A 23 -11.503 4.400 -7.652 1.00 0.00 C ATOM 358 CG LEU A 23 -10.872 3.426 -8.658 1.00 0.00 C ATOM 359 CD1 LEU A 23 -9.422 3.152 -8.253 1.00 0.00 C ATOM 360 CD2 LEU A 23 -11.626 2.093 -8.683 1.00 0.00 C ATOM 0 H LEU A 23 -11.626 6.277 -9.258 1.00 0.00 H new ATOM 0 HA LEU A 23 -13.412 4.199 -8.635 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -10.806 5.214 -7.455 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -11.666 3.884 -6.706 1.00 0.00 H new ATOM 0 HG LEU A 23 -10.921 3.881 -9.647 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -8.970 2.461 -8.964 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -8.862 4.087 -8.250 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.400 2.712 -7.256 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -11.157 1.423 -9.404 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -11.595 1.639 -7.693 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -12.663 2.267 -8.970 1.00 0.00 H new ATOM 372 N GLY A 24 -13.394 6.697 -6.473 1.00 0.00 N ATOM 373 CA GLY A 24 -14.124 7.252 -5.338 1.00 0.00 C ATOM 374 C GLY A 24 -13.230 8.127 -4.469 1.00 0.00 C ATOM 375 O GLY A 24 -13.626 9.227 -4.089 1.00 0.00 O ATOM 0 H GLY A 24 -12.674 7.314 -6.850 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -14.968 7.839 -5.700 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -14.535 6.441 -4.737 1.00 0.00 H new ATOM 379 N VAL A 25 -12.010 7.656 -4.190 1.00 0.00 N ATOM 380 CA VAL A 25 -11.071 8.266 -3.251 1.00 0.00 C ATOM 381 C VAL A 25 -10.382 9.496 -3.868 1.00 0.00 C ATOM 382 O VAL A 25 -9.172 9.675 -3.752 1.00 0.00 O ATOM 383 CB VAL A 25 -10.111 7.161 -2.744 1.00 0.00 C ATOM 384 CG1 VAL A 25 -9.262 6.506 -3.846 1.00 0.00 C ATOM 385 CG2 VAL A 25 -9.204 7.619 -1.596 1.00 0.00 C ATOM 0 H VAL A 25 -11.640 6.812 -4.627 1.00 0.00 H new ATOM 0 HA VAL A 25 -11.588 8.669 -2.380 1.00 0.00 H new ATOM 0 HB VAL A 25 -10.791 6.400 -2.361 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -8.619 5.744 -3.405 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -9.918 6.044 -4.584 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -8.647 7.264 -4.331 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -8.559 6.795 -1.291 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -8.591 8.456 -1.929 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -9.817 7.932 -0.751 1.00 0.00 H new ATOM 395 N GLY A 26 -11.151 10.331 -4.571 1.00 0.00 N ATOM 396 CA GLY A 26 -10.656 11.374 -5.448 1.00 0.00 C ATOM 397 C GLY A 26 -10.558 12.721 -4.749 1.00 0.00 C ATOM 398 O GLY A 26 -11.383 13.069 -3.907 1.00 0.00 O ATOM 0 H GLY A 26 -12.170 10.291 -4.538 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -9.673 11.091 -5.826 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -11.316 11.463 -6.311 1.00 0.00 H new ATOM 402 N PHE A 27 -9.548 13.493 -5.146 1.00 0.00 N ATOM 403 CA PHE A 27 -9.229 14.811 -4.632 1.00 0.00 C ATOM 404 C PHE A 27 -8.040 15.333 -5.436 1.00 0.00 C ATOM 405 O PHE A 27 -7.348 14.556 -6.098 1.00 0.00 O ATOM 406 CB PHE A 27 -8.969 14.788 -3.110 1.00 0.00 C ATOM 407 CG PHE A 27 -8.374 13.522 -2.498 1.00 0.00 C ATOM 408 CD1 PHE A 27 -7.402 12.764 -3.176 1.00 0.00 C ATOM 409 CD2 PHE A 27 -8.894 13.040 -1.281 1.00 0.00 C ATOM 410 CE1 PHE A 27 -6.983 11.524 -2.666 1.00 0.00 C ATOM 411 CE2 PHE A 27 -8.485 11.795 -0.777 1.00 0.00 C ATOM 412 CZ PHE A 27 -7.544 11.028 -1.481 1.00 0.00 C ATOM 0 H PHE A 27 -8.899 13.194 -5.874 1.00 0.00 H new ATOM 0 HA PHE A 27 -10.075 15.488 -4.754 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -8.302 15.617 -2.874 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -9.916 14.987 -2.608 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -6.975 13.138 -4.095 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -9.612 13.632 -0.732 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -6.229 10.953 -3.187 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -8.895 11.428 0.152 1.00 0.00 H new ATOM 0 HZ PHE A 27 -7.252 10.057 -1.110 1.00 0.00 H new ATOM 422 N ALA A 28 -7.806 16.646 -5.393 1.00 0.00 N ATOM 423 CA ALA A 28 -6.789 17.305 -6.206 1.00 0.00 C ATOM 424 C ALA A 28 -5.364 16.872 -5.846 1.00 0.00 C ATOM 425 O ALA A 28 -4.446 17.074 -6.637 1.00 0.00 O ATOM 426 CB ALA A 28 -6.936 18.822 -6.059 1.00 0.00 C ATOM 0 H ALA A 28 -8.322 17.284 -4.788 1.00 0.00 H new ATOM 0 HA ALA A 28 -6.949 17.006 -7.242 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -6.179 19.321 -6.664 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -7.927 19.126 -6.395 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -6.806 19.100 -5.013 1.00 0.00 H new ATOM 432 N THR A 29 -5.171 16.293 -4.654 1.00 0.00 N ATOM 433 CA THR A 29 -3.859 16.091 -4.043 1.00 0.00 C ATOM 434 C THR A 29 -2.848 15.479 -5.018 1.00 0.00 C ATOM 435 O THR A 29 -1.687 15.884 -5.049 1.00 0.00 O ATOM 436 CB THR A 29 -4.005 15.280 -2.740 1.00 0.00 C ATOM 437 OG1 THR A 29 -2.885 15.464 -1.904 1.00 0.00 O ATOM 438 CG2 THR A 29 -4.154 13.776 -2.972 1.00 0.00 C ATOM 0 H THR A 29 -5.939 15.947 -4.080 1.00 0.00 H new ATOM 0 HA THR A 29 -3.447 17.066 -3.784 1.00 0.00 H new ATOM 0 HB THR A 29 -4.916 15.656 -2.275 1.00 0.00 H new ATOM 0 HG1 THR A 29 -3.000 14.941 -1.083 1.00 0.00 H new ATOM 0 HG21 THR A 29 -4.252 13.268 -2.013 1.00 0.00 H new ATOM 0 HG22 THR A 29 -5.042 13.587 -3.575 1.00 0.00 H new ATOM 0 HG23 THR A 29 -3.274 13.399 -3.494 1.00 0.00 H new ATOM 446 N ARG A 30 -3.287 14.518 -5.841 1.00 0.00 N ATOM 447 CA ARG A 30 -2.399 13.808 -6.750 1.00 0.00 C ATOM 448 C ARG A 30 -1.650 14.770 -7.680 1.00 0.00 C ATOM 449 O ARG A 30 -0.513 14.480 -8.036 1.00 0.00 O ATOM 450 CB ARG A 30 -3.152 12.725 -7.544 1.00 0.00 C ATOM 451 CG ARG A 30 -2.362 11.409 -7.684 1.00 0.00 C ATOM 452 CD ARG A 30 -0.956 11.590 -8.269 1.00 0.00 C ATOM 453 NE ARG A 30 -0.250 10.326 -8.547 1.00 0.00 N ATOM 454 CZ ARG A 30 0.432 9.583 -7.661 1.00 0.00 C ATOM 455 NH1 ARG A 30 0.375 9.864 -6.355 1.00 0.00 N ATOM 456 NH2 ARG A 30 1.173 8.568 -8.106 1.00 0.00 N ATOM 0 H ARG A 30 -4.261 14.218 -5.890 1.00 0.00 H new ATOM 0 HA ARG A 30 -1.650 13.303 -6.140 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -4.103 12.519 -7.052 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -3.384 13.109 -8.538 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -2.280 10.940 -6.704 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -2.924 10.724 -8.319 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -1.030 12.163 -9.193 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -0.359 12.181 -7.575 1.00 0.00 H new ATOM 0 HE ARG A 30 -0.283 9.982 -9.507 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -0.189 10.647 -6.026 1.00 0.00 H new ATOM 0 HH12 ARG A 30 0.896 9.295 -5.688 1.00 0.00 H new ATOM 0 HH21 ARG A 30 1.215 8.367 -9.105 1.00 0.00 H new ATOM 0 HH22 ARG A 30 1.698 7.993 -7.447 1.00 0.00 H new ATOM 470 N GLN A 31 -2.245 15.909 -8.055 1.00 0.00 N ATOM 471 CA GLN A 31 -1.572 16.850 -8.946 1.00 0.00 C ATOM 472 C GLN A 31 -0.287 17.406 -8.319 1.00 0.00 C ATOM 473 O GLN A 31 0.612 17.831 -9.039 1.00 0.00 O ATOM 474 CB GLN A 31 -2.514 17.984 -9.381 1.00 0.00 C ATOM 475 CG GLN A 31 -3.889 17.533 -9.899 1.00 0.00 C ATOM 476 CD GLN A 31 -3.852 16.227 -10.689 1.00 0.00 C ATOM 477 OE1 GLN A 31 -3.095 16.087 -11.643 1.00 0.00 O ATOM 478 NE2 GLN A 31 -4.665 15.252 -10.289 1.00 0.00 N ATOM 0 H GLN A 31 -3.178 16.195 -7.758 1.00 0.00 H new ATOM 0 HA GLN A 31 -1.285 16.296 -9.840 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -2.665 18.654 -8.534 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -2.022 18.563 -10.162 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -4.565 17.415 -9.052 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -4.304 18.318 -10.532 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -5.284 15.399 -9.491 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -4.669 14.358 -10.780 1.00 0.00 H new ATOM 487 N VAL A 32 -0.194 17.398 -6.985 1.00 0.00 N ATOM 488 CA VAL A 32 1.053 17.656 -6.282 1.00 0.00 C ATOM 489 C VAL A 32 1.763 16.320 -6.055 1.00 0.00 C ATOM 490 O VAL A 32 2.957 16.193 -6.318 1.00 0.00 O ATOM 491 CB VAL A 32 0.775 18.397 -4.964 1.00 0.00 C ATOM 492 CG1 VAL A 32 2.085 18.606 -4.196 1.00 0.00 C ATOM 493 CG2 VAL A 32 0.126 19.764 -5.225 1.00 0.00 C ATOM 0 H VAL A 32 -0.985 17.212 -6.368 1.00 0.00 H new ATOM 0 HA VAL A 32 1.703 18.300 -6.874 1.00 0.00 H new ATOM 0 HB VAL A 32 0.089 17.788 -4.375 1.00 0.00 H new ATOM 0 HG11 VAL A 32 1.880 19.132 -3.263 1.00 0.00 H new ATOM 0 HG12 VAL A 32 2.536 17.638 -3.976 1.00 0.00 H new ATOM 0 HG13 VAL A 32 2.772 19.197 -4.802 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -0.059 20.266 -4.275 1.00 0.00 H new ATOM 0 HG22 VAL A 32 0.794 20.374 -5.833 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -0.818 19.624 -5.752 1.00 0.00 H new ATOM 503 N GLY A 33 1.027 15.322 -5.558 1.00 0.00 N ATOM 504 CA GLY A 33 1.527 13.997 -5.229 1.00 0.00 C ATOM 505 C GLY A 33 2.479 13.441 -6.288 1.00 0.00 C ATOM 506 O GLY A 33 3.628 13.140 -5.975 1.00 0.00 O ATOM 0 H GLY A 33 0.030 15.425 -5.369 1.00 0.00 H new ATOM 0 HA2 GLY A 33 2.042 14.036 -4.269 1.00 0.00 H new ATOM 0 HA3 GLY A 33 0.685 13.315 -5.111 1.00 0.00 H new ATOM 510 N ASN A 34 2.016 13.311 -7.535 1.00 0.00 N ATOM 511 CA ASN A 34 2.824 12.781 -8.636 1.00 0.00 C ATOM 512 C ASN A 34 4.118 13.577 -8.795 1.00 0.00 C ATOM 513 O ASN A 34 5.183 13.000 -8.991 1.00 0.00 O ATOM 514 CB ASN A 34 2.039 12.703 -9.962 1.00 0.00 C ATOM 515 CG ASN A 34 1.347 13.997 -10.396 1.00 0.00 C ATOM 516 OD1 ASN A 34 1.622 15.071 -9.874 1.00 0.00 O ATOM 517 ND2 ASN A 34 0.416 13.901 -11.343 1.00 0.00 N ATOM 0 H ASN A 34 1.069 13.571 -7.809 1.00 0.00 H new ATOM 0 HA ASN A 34 3.087 11.756 -8.375 1.00 0.00 H new ATOM 0 HB2 ASN A 34 2.724 12.396 -10.752 1.00 0.00 H new ATOM 0 HB3 ASN A 34 1.285 11.921 -9.872 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -0.087 14.734 -11.650 1.00 0.00 H new ATOM 0 HD22 ASN A 34 0.206 12.995 -11.762 1.00 0.00 H new ATOM 524 N MET A 35 4.023 14.900 -8.686 1.00 0.00 N ATOM 525 CA MET A 35 5.142 15.813 -8.806 1.00 0.00 C ATOM 526 C MET A 35 6.078 15.747 -7.590 1.00 0.00 C ATOM 527 O MET A 35 7.198 16.245 -7.686 1.00 0.00 O ATOM 528 CB MET A 35 4.602 17.238 -9.032 1.00 0.00 C ATOM 529 CG MET A 35 5.355 17.972 -10.147 1.00 0.00 C ATOM 530 SD MET A 35 7.127 18.248 -9.872 1.00 0.00 S ATOM 531 CE MET A 35 7.563 18.958 -11.481 1.00 0.00 C ATOM 0 H MET A 35 3.138 15.373 -8.507 1.00 0.00 H new ATOM 0 HA MET A 35 5.746 15.516 -9.663 1.00 0.00 H new ATOM 0 HB2 MET A 35 3.543 17.188 -9.283 1.00 0.00 H new ATOM 0 HB3 MET A 35 4.683 17.807 -8.106 1.00 0.00 H new ATOM 0 HG2 MET A 35 5.236 17.406 -11.071 1.00 0.00 H new ATOM 0 HG3 MET A 35 4.878 18.940 -10.303 1.00 0.00 H new ATOM 0 HE1 MET A 35 8.627 19.194 -11.498 1.00 0.00 H new ATOM 0 HE2 MET A 35 7.338 18.239 -12.269 1.00 0.00 H new ATOM 0 HE3 MET A 35 6.987 19.869 -11.645 1.00 0.00 H new ATOM 541 N THR A 36 5.626 15.193 -6.458 1.00 0.00 N ATOM 542 CA THR A 36 6.437 15.061 -5.252 1.00 0.00 C ATOM 543 C THR A 36 7.248 13.755 -5.346 1.00 0.00 C ATOM 544 O THR A 36 7.870 13.493 -6.374 1.00 0.00 O ATOM 545 CB THR A 36 5.542 15.188 -4.001 1.00 0.00 C ATOM 546 OG1 THR A 36 4.649 16.272 -4.148 1.00 0.00 O ATOM 547 CG2 THR A 36 6.345 15.501 -2.730 1.00 0.00 C ATOM 0 H THR A 36 4.681 14.823 -6.358 1.00 0.00 H new ATOM 0 HA THR A 36 7.164 15.867 -5.160 1.00 0.00 H new ATOM 0 HB THR A 36 5.034 14.228 -3.907 1.00 0.00 H new ATOM 0 HG1 THR A 36 3.997 16.066 -4.850 1.00 0.00 H new ATOM 0 HG21 THR A 36 5.666 15.580 -1.881 1.00 0.00 H new ATOM 0 HG22 THR A 36 7.063 14.702 -2.547 1.00 0.00 H new ATOM 0 HG23 THR A 36 6.876 16.444 -2.858 1.00 0.00 H new ATOM 555 N LYS A 37 7.275 12.930 -4.293 1.00 0.00 N ATOM 556 CA LYS A 37 8.005 11.670 -4.259 1.00 0.00 C ATOM 557 C LYS A 37 7.220 10.659 -3.418 1.00 0.00 C ATOM 558 O LYS A 37 7.604 10.400 -2.274 1.00 0.00 O ATOM 559 CB LYS A 37 9.414 11.874 -3.678 1.00 0.00 C ATOM 560 CG LYS A 37 10.344 12.662 -4.611 1.00 0.00 C ATOM 561 CD LYS A 37 11.766 12.799 -4.042 1.00 0.00 C ATOM 562 CE LYS A 37 12.480 11.446 -3.880 1.00 0.00 C ATOM 563 NZ LYS A 37 13.890 11.606 -3.466 1.00 0.00 N ATOM 0 H LYS A 37 6.777 13.129 -3.425 1.00 0.00 H new ATOM 0 HA LYS A 37 8.115 11.290 -5.275 1.00 0.00 H new ATOM 0 HB2 LYS A 37 9.335 12.399 -2.726 1.00 0.00 H new ATOM 0 HB3 LYS A 37 9.859 10.901 -3.469 1.00 0.00 H new ATOM 0 HG2 LYS A 37 10.390 12.164 -5.580 1.00 0.00 H new ATOM 0 HG3 LYS A 37 9.927 13.654 -4.782 1.00 0.00 H new ATOM 0 HD2 LYS A 37 12.355 13.438 -4.700 1.00 0.00 H new ATOM 0 HD3 LYS A 37 11.718 13.297 -3.073 1.00 0.00 H new ATOM 0 HE2 LYS A 37 11.952 10.844 -3.140 1.00 0.00 H new ATOM 0 HE3 LYS A 37 12.439 10.900 -4.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 14.332 10.669 -3.369 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 14.402 12.158 -4.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 13.930 12.104 -2.554 1.00 0.00 H new ATOM 577 N PRO A 38 6.138 10.077 -3.964 1.00 0.00 N ATOM 578 CA PRO A 38 5.394 9.010 -3.318 1.00 0.00 C ATOM 579 C PRO A 38 6.291 7.773 -3.221 1.00 0.00 C ATOM 580 O PRO A 38 6.269 6.876 -4.063 1.00 0.00 O ATOM 581 CB PRO A 38 4.110 8.832 -4.131 1.00 0.00 C ATOM 582 CG PRO A 38 4.463 9.382 -5.510 1.00 0.00 C ATOM 583 CD PRO A 38 5.569 10.404 -5.260 1.00 0.00 C ATOM 0 HA PRO A 38 5.102 9.224 -2.290 1.00 0.00 H new ATOM 0 HB2 PRO A 38 3.814 7.784 -4.184 1.00 0.00 H new ATOM 0 HB3 PRO A 38 3.278 9.377 -3.686 1.00 0.00 H new ATOM 0 HG2 PRO A 38 4.803 8.589 -6.176 1.00 0.00 H new ATOM 0 HG3 PRO A 38 3.597 9.846 -5.983 1.00 0.00 H new ATOM 0 HD2 PRO A 38 6.327 10.356 -6.041 1.00 0.00 H new ATOM 0 HD3 PRO A 38 5.170 11.418 -5.265 1.00 0.00 H new ATOM 591 N THR A 39 7.120 7.787 -2.181 1.00 0.00 N ATOM 592 CA THR A 39 8.130 6.796 -1.877 1.00 0.00 C ATOM 593 C THR A 39 7.451 5.644 -1.147 1.00 0.00 C ATOM 594 O THR A 39 6.475 5.861 -0.429 1.00 0.00 O ATOM 595 CB THR A 39 9.203 7.484 -1.020 1.00 0.00 C ATOM 596 OG1 THR A 39 9.719 8.592 -1.732 1.00 0.00 O ATOM 597 CG2 THR A 39 10.363 6.554 -0.676 1.00 0.00 C ATOM 0 H THR A 39 7.098 8.538 -1.491 1.00 0.00 H new ATOM 0 HA THR A 39 8.609 6.390 -2.768 1.00 0.00 H new ATOM 0 HB THR A 39 8.728 7.790 -0.088 1.00 0.00 H new ATOM 0 HG1 THR A 39 9.036 9.293 -1.787 1.00 0.00 H new ATOM 0 HG21 THR A 39 11.092 7.091 -0.069 1.00 0.00 H new ATOM 0 HG22 THR A 39 9.988 5.696 -0.118 1.00 0.00 H new ATOM 0 HG23 THR A 39 10.838 6.210 -1.595 1.00 0.00 H new ATOM 605 N THR A 40 7.942 4.418 -1.326 1.00 0.00 N ATOM 606 CA THR A 40 7.312 3.254 -0.732 1.00 0.00 C ATOM 607 C THR A 40 8.372 2.279 -0.226 1.00 0.00 C ATOM 608 O THR A 40 9.206 1.812 -0.999 1.00 0.00 O ATOM 609 CB THR A 40 6.346 2.627 -1.749 1.00 0.00 C ATOM 610 OG1 THR A 40 5.444 3.597 -2.257 1.00 0.00 O ATOM 611 CG2 THR A 40 5.497 1.529 -1.118 1.00 0.00 C ATOM 0 H THR A 40 8.774 4.212 -1.879 1.00 0.00 H new ATOM 0 HA THR A 40 6.723 3.542 0.139 1.00 0.00 H new ATOM 0 HB THR A 40 6.970 2.216 -2.543 1.00 0.00 H new ATOM 0 HG1 THR A 40 5.265 3.414 -3.203 1.00 0.00 H new ATOM 0 HG21 THR A 40 4.827 1.110 -1.869 1.00 0.00 H new ATOM 0 HG22 THR A 40 6.146 0.743 -0.733 1.00 0.00 H new ATOM 0 HG23 THR A 40 4.910 1.948 -0.301 1.00 0.00 H new ATOM 619 N ILE A 41 8.320 1.965 1.071 1.00 0.00 N ATOM 620 CA ILE A 41 8.987 0.813 1.652 1.00 0.00 C ATOM 621 C ILE A 41 8.128 -0.397 1.304 1.00 0.00 C ATOM 622 O ILE A 41 6.920 -0.377 1.545 1.00 0.00 O ATOM 623 CB ILE A 41 9.166 1.021 3.170 1.00 0.00 C ATOM 624 CG1 ILE A 41 10.445 1.835 3.427 1.00 0.00 C ATOM 625 CG2 ILE A 41 9.230 -0.308 3.940 1.00 0.00 C ATOM 626 CD1 ILE A 41 10.509 2.431 4.837 1.00 0.00 C ATOM 0 H ILE A 41 7.802 2.519 1.753 1.00 0.00 H new ATOM 0 HA ILE A 41 9.992 0.664 1.258 1.00 0.00 H new ATOM 0 HB ILE A 41 8.293 1.563 3.534 1.00 0.00 H new ATOM 0 HG12 ILE A 41 11.313 1.194 3.271 1.00 0.00 H new ATOM 0 HG13 ILE A 41 10.508 2.641 2.696 1.00 0.00 H new ATOM 0 HG21 ILE A 41 9.357 -0.106 5.004 1.00 0.00 H new ATOM 0 HG22 ILE A 41 8.306 -0.864 3.783 1.00 0.00 H new ATOM 0 HG23 ILE A 41 10.073 -0.897 3.580 1.00 0.00 H new ATOM 0 HD11 ILE A 41 11.436 2.993 4.953 1.00 0.00 H new ATOM 0 HD12 ILE A 41 9.660 3.097 4.989 1.00 0.00 H new ATOM 0 HD13 ILE A 41 10.477 1.628 5.573 1.00 0.00 H new ATOM 638 N ILE A 42 8.742 -1.431 0.726 1.00 0.00 N ATOM 639 CA ILE A 42 8.142 -2.744 0.575 1.00 0.00 C ATOM 640 C ILE A 42 9.132 -3.694 1.241 1.00 0.00 C ATOM 641 O ILE A 42 10.290 -3.735 0.829 1.00 0.00 O ATOM 642 CB ILE A 42 7.921 -3.075 -0.912 1.00 0.00 C ATOM 643 CG1 ILE A 42 7.162 -1.940 -1.622 1.00 0.00 C ATOM 644 CG2 ILE A 42 7.139 -4.391 -1.027 1.00 0.00 C ATOM 645 CD1 ILE A 42 6.974 -2.196 -3.118 1.00 0.00 C ATOM 0 H ILE A 42 9.686 -1.371 0.345 1.00 0.00 H new ATOM 0 HA ILE A 42 7.155 -2.816 1.032 1.00 0.00 H new ATOM 0 HB ILE A 42 8.891 -3.183 -1.397 1.00 0.00 H new ATOM 0 HG12 ILE A 42 6.185 -1.814 -1.154 1.00 0.00 H new ATOM 0 HG13 ILE A 42 7.704 -1.005 -1.484 1.00 0.00 H new ATOM 0 HG21 ILE A 42 6.980 -4.629 -2.079 1.00 0.00 H new ATOM 0 HG22 ILE A 42 7.706 -5.193 -0.555 1.00 0.00 H new ATOM 0 HG23 ILE A 42 6.175 -4.286 -0.529 1.00 0.00 H new ATOM 0 HD11 ILE A 42 6.433 -1.362 -3.565 1.00 0.00 H new ATOM 0 HD12 ILE A 42 7.949 -2.293 -3.596 1.00 0.00 H new ATOM 0 HD13 ILE A 42 6.406 -3.115 -3.261 1.00 0.00 H new ATOM 657 N GLU A 43 8.720 -4.388 2.303 1.00 0.00 N ATOM 658 CA GLU A 43 9.611 -5.248 3.066 1.00 0.00 C ATOM 659 C GLU A 43 8.997 -6.642 3.156 1.00 0.00 C ATOM 660 O GLU A 43 7.824 -6.785 3.500 1.00 0.00 O ATOM 661 CB GLU A 43 9.870 -4.622 4.441 1.00 0.00 C ATOM 662 CG GLU A 43 10.980 -5.340 5.215 1.00 0.00 C ATOM 663 CD GLU A 43 11.202 -4.672 6.566 1.00 0.00 C ATOM 664 OE1 GLU A 43 11.586 -3.483 6.547 1.00 0.00 O ATOM 665 OE2 GLU A 43 10.961 -5.353 7.584 1.00 0.00 O ATOM 0 H GLU A 43 7.762 -4.367 2.653 1.00 0.00 H new ATOM 0 HA GLU A 43 10.578 -5.346 2.573 1.00 0.00 H new ATOM 0 HB2 GLU A 43 10.140 -3.574 4.314 1.00 0.00 H new ATOM 0 HB3 GLU A 43 8.951 -4.645 5.026 1.00 0.00 H new ATOM 0 HG2 GLU A 43 10.713 -6.387 5.359 1.00 0.00 H new ATOM 0 HG3 GLU A 43 11.904 -5.323 4.638 1.00 0.00 H new ATOM 672 N VAL A 44 9.792 -7.660 2.821 1.00 0.00 N ATOM 673 CA VAL A 44 9.413 -9.058 2.928 1.00 0.00 C ATOM 674 C VAL A 44 9.624 -9.487 4.381 1.00 0.00 C ATOM 675 O VAL A 44 10.731 -9.805 4.809 1.00 0.00 O ATOM 676 CB VAL A 44 10.158 -9.913 1.881 1.00 0.00 C ATOM 677 CG1 VAL A 44 9.776 -9.427 0.474 1.00 0.00 C ATOM 678 CG2 VAL A 44 11.687 -9.901 1.997 1.00 0.00 C ATOM 0 H VAL A 44 10.737 -7.526 2.461 1.00 0.00 H new ATOM 0 HA VAL A 44 8.360 -9.211 2.692 1.00 0.00 H new ATOM 0 HB VAL A 44 9.847 -10.940 2.070 1.00 0.00 H new ATOM 0 HG11 VAL A 44 10.298 -10.026 -0.272 1.00 0.00 H new ATOM 0 HG12 VAL A 44 8.700 -9.530 0.333 1.00 0.00 H new ATOM 0 HG13 VAL A 44 10.059 -8.380 0.361 1.00 0.00 H new ATOM 0 HG21 VAL A 44 12.116 -10.531 1.218 1.00 0.00 H new ATOM 0 HG22 VAL A 44 12.053 -8.881 1.881 1.00 0.00 H new ATOM 0 HG23 VAL A 44 11.981 -10.283 2.975 1.00 0.00 H new ATOM 688 N ASN A 45 8.553 -9.467 5.171 1.00 0.00 N ATOM 689 CA ASN A 45 8.589 -9.862 6.568 1.00 0.00 C ATOM 690 C ASN A 45 8.593 -11.392 6.636 1.00 0.00 C ATOM 691 O ASN A 45 7.605 -12.025 7.008 1.00 0.00 O ATOM 692 CB ASN A 45 7.412 -9.217 7.302 1.00 0.00 C ATOM 693 CG ASN A 45 7.477 -9.419 8.813 1.00 0.00 C ATOM 694 OD1 ASN A 45 8.289 -10.182 9.327 1.00 0.00 O ATOM 695 ND2 ASN A 45 6.634 -8.701 9.549 1.00 0.00 N ATOM 0 H ASN A 45 7.630 -9.173 4.852 1.00 0.00 H new ATOM 0 HA ASN A 45 9.493 -9.513 7.068 1.00 0.00 H new ATOM 0 HB2 ASN A 45 7.394 -8.149 7.083 1.00 0.00 H new ATOM 0 HB3 ASN A 45 6.480 -9.636 6.923 1.00 0.00 H new ATOM 0 HD21 ASN A 45 6.653 -8.777 10.566 1.00 0.00 H new ATOM 0 HD22 ASN A 45 5.969 -8.074 9.097 1.00 0.00 H new ATOM 702 N GLY A 46 9.714 -11.983 6.218 1.00 0.00 N ATOM 703 CA GLY A 46 9.922 -13.420 6.163 1.00 0.00 C ATOM 704 C GLY A 46 8.944 -14.092 5.199 1.00 0.00 C ATOM 705 O GLY A 46 9.249 -14.264 4.022 1.00 0.00 O ATOM 0 H GLY A 46 10.525 -11.452 5.899 1.00 0.00 H new ATOM 0 HA2 GLY A 46 10.945 -13.629 5.849 1.00 0.00 H new ATOM 0 HA3 GLY A 46 9.801 -13.844 7.160 1.00 0.00 H new ATOM 709 N ASP A 47 7.781 -14.483 5.722 1.00 0.00 N ATOM 710 CA ASP A 47 6.709 -15.155 4.996 1.00 0.00 C ATOM 711 C ASP A 47 5.659 -14.144 4.519 1.00 0.00 C ATOM 712 O ASP A 47 4.918 -14.393 3.567 1.00 0.00 O ATOM 713 CB ASP A 47 6.120 -16.261 5.896 1.00 0.00 C ATOM 714 CG ASP A 47 4.641 -16.111 6.231 1.00 0.00 C ATOM 715 OD1 ASP A 47 4.215 -15.064 6.786 1.00 0.00 O ATOM 716 OD2 ASP A 47 3.888 -17.065 5.944 1.00 0.00 O ATOM 0 H ASP A 47 7.553 -14.332 6.705 1.00 0.00 H new ATOM 0 HA ASP A 47 7.097 -15.627 4.094 1.00 0.00 H new ATOM 0 HB2 ASP A 47 6.268 -17.223 5.405 1.00 0.00 H new ATOM 0 HB3 ASP A 47 6.685 -16.288 6.827 1.00 0.00 H new ATOM 721 N THR A 48 5.582 -13.014 5.216 1.00 0.00 N ATOM 722 CA THR A 48 4.585 -11.979 5.056 1.00 0.00 C ATOM 723 C THR A 48 5.251 -10.836 4.285 1.00 0.00 C ATOM 724 O THR A 48 6.472 -10.821 4.133 1.00 0.00 O ATOM 725 CB THR A 48 4.135 -11.556 6.472 1.00 0.00 C ATOM 726 OG1 THR A 48 4.579 -12.476 7.450 1.00 0.00 O ATOM 727 CG2 THR A 48 2.625 -11.531 6.638 1.00 0.00 C ATOM 0 H THR A 48 6.256 -12.791 5.948 1.00 0.00 H new ATOM 0 HA THR A 48 3.703 -12.301 4.502 1.00 0.00 H new ATOM 0 HB THR A 48 4.561 -10.561 6.599 1.00 0.00 H new ATOM 0 HG1 THR A 48 4.258 -13.374 7.224 1.00 0.00 H new ATOM 0 HG21 THR A 48 2.376 -11.226 7.654 1.00 0.00 H new ATOM 0 HG22 THR A 48 2.193 -10.823 5.931 1.00 0.00 H new ATOM 0 HG23 THR A 48 2.222 -12.526 6.448 1.00 0.00 H new ATOM 735 N VAL A 49 4.484 -9.859 3.805 1.00 0.00 N ATOM 736 CA VAL A 49 5.055 -8.683 3.168 1.00 0.00 C ATOM 737 C VAL A 49 4.305 -7.456 3.671 1.00 0.00 C ATOM 738 O VAL A 49 3.101 -7.529 3.918 1.00 0.00 O ATOM 739 CB VAL A 49 5.070 -8.862 1.641 1.00 0.00 C ATOM 740 CG1 VAL A 49 3.706 -9.283 1.087 1.00 0.00 C ATOM 741 CG2 VAL A 49 5.567 -7.611 0.903 1.00 0.00 C ATOM 0 H VAL A 49 3.465 -9.862 3.847 1.00 0.00 H new ATOM 0 HA VAL A 49 6.102 -8.540 3.437 1.00 0.00 H new ATOM 0 HB VAL A 49 5.779 -9.669 1.456 1.00 0.00 H new ATOM 0 HG11 VAL A 49 3.772 -9.395 0.005 1.00 0.00 H new ATOM 0 HG12 VAL A 49 3.409 -10.232 1.533 1.00 0.00 H new ATOM 0 HG13 VAL A 49 2.965 -8.521 1.328 1.00 0.00 H new ATOM 0 HG21 VAL A 49 5.557 -7.794 -0.171 1.00 0.00 H new ATOM 0 HG22 VAL A 49 4.914 -6.769 1.134 1.00 0.00 H new ATOM 0 HG23 VAL A 49 6.583 -7.380 1.222 1.00 0.00 H new ATOM 751 N ILE A 50 5.028 -6.357 3.892 1.00 0.00 N ATOM 752 CA ILE A 50 4.472 -5.112 4.396 1.00 0.00 C ATOM 753 C ILE A 50 4.807 -3.992 3.421 1.00 0.00 C ATOM 754 O ILE A 50 5.944 -3.903 2.952 1.00 0.00 O ATOM 755 CB ILE A 50 4.918 -4.859 5.852 1.00 0.00 C ATOM 756 CG1 ILE A 50 4.209 -3.627 6.444 1.00 0.00 C ATOM 757 CG2 ILE A 50 6.439 -4.739 5.989 1.00 0.00 C ATOM 758 CD1 ILE A 50 4.495 -3.436 7.936 1.00 0.00 C ATOM 0 H ILE A 50 6.033 -6.312 3.721 1.00 0.00 H new ATOM 0 HA ILE A 50 3.385 -5.165 4.450 1.00 0.00 H new ATOM 0 HB ILE A 50 4.619 -5.735 6.427 1.00 0.00 H new ATOM 0 HG12 ILE A 50 4.525 -2.736 5.901 1.00 0.00 H new ATOM 0 HG13 ILE A 50 3.134 -3.726 6.295 1.00 0.00 H new ATOM 0 HG21 ILE A 50 6.697 -4.562 7.033 1.00 0.00 H new ATOM 0 HG22 ILE A 50 6.909 -5.663 5.651 1.00 0.00 H new ATOM 0 HG23 ILE A 50 6.795 -3.907 5.381 1.00 0.00 H new ATOM 0 HD11 ILE A 50 3.969 -2.552 8.297 1.00 0.00 H new ATOM 0 HD12 ILE A 50 4.154 -4.312 8.487 1.00 0.00 H new ATOM 0 HD13 ILE A 50 5.567 -3.307 8.087 1.00 0.00 H new ATOM 770 N ILE A 51 3.798 -3.178 3.094 1.00 0.00 N ATOM 771 CA ILE A 51 3.927 -1.990 2.270 1.00 0.00 C ATOM 772 C ILE A 51 3.714 -0.775 3.170 1.00 0.00 C ATOM 773 O ILE A 51 2.763 -0.740 3.951 1.00 0.00 O ATOM 774 CB ILE A 51 2.957 -2.023 1.070 1.00 0.00 C ATOM 775 CG1 ILE A 51 3.163 -0.762 0.213 1.00 0.00 C ATOM 776 CG2 ILE A 51 1.480 -2.165 1.475 1.00 0.00 C ATOM 777 CD1 ILE A 51 2.450 -0.842 -1.138 1.00 0.00 C ATOM 0 H ILE A 51 2.842 -3.340 3.410 1.00 0.00 H new ATOM 0 HA ILE A 51 4.922 -1.939 1.829 1.00 0.00 H new ATOM 0 HB ILE A 51 3.193 -2.917 0.492 1.00 0.00 H new ATOM 0 HG12 ILE A 51 2.799 0.107 0.760 1.00 0.00 H new ATOM 0 HG13 ILE A 51 4.230 -0.611 0.048 1.00 0.00 H new ATOM 0 HG21 ILE A 51 0.857 -2.181 0.580 1.00 0.00 H new ATOM 0 HG22 ILE A 51 1.342 -3.093 2.030 1.00 0.00 H new ATOM 0 HG23 ILE A 51 1.192 -1.321 2.102 1.00 0.00 H new ATOM 0 HD11 ILE A 51 2.630 0.075 -1.699 1.00 0.00 H new ATOM 0 HD12 ILE A 51 2.832 -1.694 -1.701 1.00 0.00 H new ATOM 0 HD13 ILE A 51 1.379 -0.964 -0.977 1.00 0.00 H new ATOM 789 N LYS A 52 4.611 0.205 3.056 1.00 0.00 N ATOM 790 CA LYS A 52 4.600 1.446 3.806 1.00 0.00 C ATOM 791 C LYS A 52 4.853 2.577 2.816 1.00 0.00 C ATOM 792 O LYS A 52 6.002 2.857 2.467 1.00 0.00 O ATOM 793 CB LYS A 52 5.632 1.340 4.933 1.00 0.00 C ATOM 794 CG LYS A 52 5.927 2.674 5.640 1.00 0.00 C ATOM 795 CD LYS A 52 6.745 2.490 6.931 1.00 0.00 C ATOM 796 CE LYS A 52 5.969 1.562 7.872 1.00 0.00 C ATOM 797 NZ LYS A 52 6.338 1.633 9.300 1.00 0.00 N ATOM 0 H LYS A 52 5.396 0.146 2.408 1.00 0.00 H new ATOM 0 HA LYS A 52 3.646 1.652 4.291 1.00 0.00 H new ATOM 0 HB2 LYS A 52 5.276 0.621 5.671 1.00 0.00 H new ATOM 0 HB3 LYS A 52 6.562 0.944 4.524 1.00 0.00 H new ATOM 0 HG2 LYS A 52 6.471 3.329 4.960 1.00 0.00 H new ATOM 0 HG3 LYS A 52 4.986 3.171 5.878 1.00 0.00 H new ATOM 0 HD2 LYS A 52 7.723 2.066 6.702 1.00 0.00 H new ATOM 0 HD3 LYS A 52 6.920 3.454 7.409 1.00 0.00 H new ATOM 0 HE2 LYS A 52 4.907 1.789 7.780 1.00 0.00 H new ATOM 0 HE3 LYS A 52 6.106 0.535 7.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 5.921 0.826 9.807 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 7.373 1.603 9.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 5.979 2.520 9.708 1.00 0.00 H new ATOM 811 N THR A 53 3.776 3.204 2.336 1.00 0.00 N ATOM 812 CA THR A 53 3.861 4.287 1.367 1.00 0.00 C ATOM 813 C THR A 53 3.899 5.615 2.120 1.00 0.00 C ATOM 814 O THR A 53 3.217 5.762 3.135 1.00 0.00 O ATOM 815 CB THR A 53 2.752 4.172 0.310 1.00 0.00 C ATOM 816 OG1 THR A 53 3.232 4.683 -0.918 1.00 0.00 O ATOM 817 CG2 THR A 53 1.457 4.887 0.704 1.00 0.00 C ATOM 0 H THR A 53 2.822 2.971 2.612 1.00 0.00 H new ATOM 0 HA THR A 53 4.785 4.225 0.791 1.00 0.00 H new ATOM 0 HB THR A 53 2.500 3.115 0.220 1.00 0.00 H new ATOM 0 HG1 THR A 53 4.009 4.161 -1.208 1.00 0.00 H new ATOM 0 HG21 THR A 53 0.718 4.765 -0.088 1.00 0.00 H new ATOM 0 HG22 THR A 53 1.072 4.458 1.629 1.00 0.00 H new ATOM 0 HG23 THR A 53 1.658 5.948 0.852 1.00 0.00 H new ATOM 825 N GLN A 54 4.754 6.532 1.659 1.00 0.00 N ATOM 826 CA GLN A 54 5.234 7.692 2.391 1.00 0.00 C ATOM 827 C GLN A 54 5.145 8.956 1.531 1.00 0.00 C ATOM 828 O GLN A 54 5.841 9.092 0.523 1.00 0.00 O ATOM 829 CB GLN A 54 6.692 7.439 2.797 1.00 0.00 C ATOM 830 CG GLN A 54 6.814 6.369 3.889 1.00 0.00 C ATOM 831 CD GLN A 54 8.151 5.647 3.781 1.00 0.00 C ATOM 832 OE1 GLN A 54 9.161 6.111 4.295 1.00 0.00 O ATOM 833 NE2 GLN A 54 8.168 4.506 3.102 1.00 0.00 N ATOM 0 H GLN A 54 5.145 6.477 0.719 1.00 0.00 H new ATOM 0 HA GLN A 54 4.614 7.844 3.275 1.00 0.00 H new ATOM 0 HB2 GLN A 54 7.262 7.128 1.921 1.00 0.00 H new ATOM 0 HB3 GLN A 54 7.135 8.370 3.152 1.00 0.00 H new ATOM 0 HG2 GLN A 54 6.722 6.832 4.872 1.00 0.00 H new ATOM 0 HG3 GLN A 54 5.998 5.652 3.797 1.00 0.00 H new ATOM 0 HE21 GLN A 54 7.309 4.147 2.686 1.00 0.00 H new ATOM 0 HE22 GLN A 54 9.041 3.988 2.996 1.00 0.00 H new ATOM 842 N SER A 55 4.318 9.905 1.971 1.00 0.00 N ATOM 843 CA SER A 55 4.316 11.304 1.584 1.00 0.00 C ATOM 844 C SER A 55 3.534 12.047 2.665 1.00 0.00 C ATOM 845 O SER A 55 2.651 11.460 3.287 1.00 0.00 O ATOM 846 CB SER A 55 3.666 11.482 0.208 1.00 0.00 C ATOM 847 OG SER A 55 4.605 11.183 -0.803 1.00 0.00 O ATOM 0 H SER A 55 3.587 9.697 2.651 1.00 0.00 H new ATOM 0 HA SER A 55 5.330 11.696 1.501 1.00 0.00 H new ATOM 0 HB2 SER A 55 2.799 10.828 0.117 1.00 0.00 H new ATOM 0 HB3 SER A 55 3.307 12.505 0.094 1.00 0.00 H new ATOM 0 HG SER A 55 5.179 10.445 -0.509 1.00 0.00 H new ATOM 853 N THR A 56 3.850 13.321 2.893 1.00 0.00 N ATOM 854 CA THR A 56 3.131 14.169 3.830 1.00 0.00 C ATOM 855 C THR A 56 1.652 14.208 3.451 1.00 0.00 C ATOM 856 O THR A 56 0.777 13.989 4.284 1.00 0.00 O ATOM 857 CB THR A 56 3.749 15.568 3.747 1.00 0.00 C ATOM 858 OG1 THR A 56 4.014 15.853 2.385 1.00 0.00 O ATOM 859 CG2 THR A 56 5.079 15.632 4.499 1.00 0.00 C ATOM 0 H THR A 56 4.622 13.795 2.424 1.00 0.00 H new ATOM 0 HA THR A 56 3.207 13.787 4.848 1.00 0.00 H new ATOM 0 HB THR A 56 3.054 16.281 4.189 1.00 0.00 H new ATOM 0 HG1 THR A 56 4.409 16.747 2.309 1.00 0.00 H new ATOM 0 HG21 THR A 56 5.493 16.637 4.422 1.00 0.00 H new ATOM 0 HG22 THR A 56 4.916 15.386 5.548 1.00 0.00 H new ATOM 0 HG23 THR A 56 5.778 14.918 4.064 1.00 0.00 H new ATOM 867 N PHE A 57 1.395 14.469 2.167 1.00 0.00 N ATOM 868 CA PHE A 57 0.063 14.511 1.580 1.00 0.00 C ATOM 869 C PHE A 57 -0.783 13.289 1.944 1.00 0.00 C ATOM 870 O PHE A 57 -1.986 13.430 2.149 1.00 0.00 O ATOM 871 CB PHE A 57 0.176 14.668 0.057 1.00 0.00 C ATOM 872 CG PHE A 57 0.908 15.930 -0.359 1.00 0.00 C ATOM 873 CD1 PHE A 57 0.278 17.177 -0.197 1.00 0.00 C ATOM 874 CD2 PHE A 57 2.250 15.877 -0.780 1.00 0.00 C ATOM 875 CE1 PHE A 57 0.990 18.365 -0.433 1.00 0.00 C ATOM 876 CE2 PHE A 57 2.962 17.066 -1.012 1.00 0.00 C ATOM 877 CZ PHE A 57 2.338 18.309 -0.820 1.00 0.00 C ATOM 0 H PHE A 57 2.134 14.662 1.491 1.00 0.00 H new ATOM 0 HA PHE A 57 -0.455 15.374 1.998 1.00 0.00 H new ATOM 0 HB2 PHE A 57 0.695 13.802 -0.354 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -0.824 14.676 -0.377 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -0.757 17.221 0.110 1.00 0.00 H new ATOM 0 HD2 PHE A 57 2.733 14.922 -0.925 1.00 0.00 H new ATOM 0 HE1 PHE A 57 0.500 19.321 -0.317 1.00 0.00 H new ATOM 0 HE2 PHE A 57 3.991 17.024 -1.338 1.00 0.00 H new ATOM 0 HZ PHE A 57 2.895 19.222 -0.970 1.00 0.00 H new ATOM 887 N LYS A 58 -0.170 12.100 2.000 1.00 0.00 N ATOM 888 CA LYS A 58 -0.820 10.869 2.434 1.00 0.00 C ATOM 889 C LYS A 58 0.215 9.748 2.550 1.00 0.00 C ATOM 890 O LYS A 58 1.049 9.586 1.659 1.00 0.00 O ATOM 891 CB LYS A 58 -1.977 10.472 1.499 1.00 0.00 C ATOM 892 CG LYS A 58 -1.540 10.263 0.044 1.00 0.00 C ATOM 893 CD LYS A 58 -2.683 10.447 -0.966 1.00 0.00 C ATOM 894 CE LYS A 58 -3.904 9.546 -0.716 1.00 0.00 C ATOM 895 NZ LYS A 58 -4.807 10.075 0.331 1.00 0.00 N ATOM 0 H LYS A 58 0.808 11.970 1.740 1.00 0.00 H new ATOM 0 HA LYS A 58 -1.259 11.042 3.416 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -2.434 9.554 1.869 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -2.744 11.246 1.533 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -0.740 10.964 -0.192 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -1.127 9.260 -0.064 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -3.005 11.488 -0.946 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -2.301 10.251 -1.968 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -4.462 9.432 -1.646 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -3.562 8.552 -0.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -5.794 9.986 0.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -4.674 9.535 1.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -4.588 11.077 0.504 1.00 0.00 H new ATOM 909 N ASN A 59 0.140 8.967 3.630 1.00 0.00 N ATOM 910 CA ASN A 59 0.994 7.822 3.910 1.00 0.00 C ATOM 911 C ASN A 59 0.140 6.731 4.554 1.00 0.00 C ATOM 912 O ASN A 59 -0.860 7.047 5.197 1.00 0.00 O ATOM 913 CB ASN A 59 2.164 8.227 4.824 1.00 0.00 C ATOM 914 CG ASN A 59 1.762 8.901 6.135 1.00 0.00 C ATOM 915 OD1 ASN A 59 0.610 9.256 6.362 1.00 0.00 O ATOM 916 ND2 ASN A 59 2.736 9.113 7.013 1.00 0.00 N ATOM 0 H ASN A 59 -0.551 9.127 4.363 1.00 0.00 H new ATOM 0 HA ASN A 59 1.428 7.444 2.984 1.00 0.00 H new ATOM 0 HB2 ASN A 59 2.748 7.336 5.056 1.00 0.00 H new ATOM 0 HB3 ASN A 59 2.818 8.902 4.272 1.00 0.00 H new ATOM 0 HD21 ASN A 59 2.533 9.580 7.897 1.00 0.00 H new ATOM 0 HD22 ASN A 59 3.687 8.809 6.803 1.00 0.00 H new ATOM 923 N THR A 60 0.505 5.460 4.365 1.00 0.00 N ATOM 924 CA THR A 60 -0.238 4.319 4.901 1.00 0.00 C ATOM 925 C THR A 60 0.702 3.114 5.026 1.00 0.00 C ATOM 926 O THR A 60 1.620 2.980 4.214 1.00 0.00 O ATOM 927 CB THR A 60 -1.455 3.965 4.018 1.00 0.00 C ATOM 928 OG1 THR A 60 -1.089 3.878 2.659 1.00 0.00 O ATOM 929 CG2 THR A 60 -2.623 4.947 4.108 1.00 0.00 C ATOM 0 H THR A 60 1.332 5.193 3.831 1.00 0.00 H new ATOM 0 HA THR A 60 -0.621 4.589 5.885 1.00 0.00 H new ATOM 0 HB THR A 60 -1.791 3.006 4.413 1.00 0.00 H new ATOM 0 HG1 THR A 60 -1.877 3.651 2.122 1.00 0.00 H new ATOM 0 HG21 THR A 60 -3.429 4.615 3.454 1.00 0.00 H new ATOM 0 HG22 THR A 60 -2.984 4.990 5.136 1.00 0.00 H new ATOM 0 HG23 THR A 60 -2.290 5.938 3.799 1.00 0.00 H new ATOM 937 N GLU A 61 0.454 2.259 6.028 1.00 0.00 N ATOM 938 CA GLU A 61 1.224 1.069 6.381 1.00 0.00 C ATOM 939 C GLU A 61 0.259 -0.118 6.474 1.00 0.00 C ATOM 940 O GLU A 61 -0.652 -0.069 7.298 1.00 0.00 O ATOM 941 CB GLU A 61 1.917 1.335 7.729 1.00 0.00 C ATOM 942 CG GLU A 61 2.699 0.129 8.278 1.00 0.00 C ATOM 943 CD GLU A 61 3.595 0.508 9.454 1.00 0.00 C ATOM 944 OE1 GLU A 61 3.511 1.659 9.931 1.00 0.00 O ATOM 945 OE2 GLU A 61 4.546 -0.255 9.729 1.00 0.00 O ATOM 0 H GLU A 61 -0.342 2.393 6.651 1.00 0.00 H new ATOM 0 HA GLU A 61 1.984 0.840 5.634 1.00 0.00 H new ATOM 0 HB2 GLU A 61 2.600 2.177 7.615 1.00 0.00 H new ATOM 0 HB3 GLU A 61 1.165 1.631 8.460 1.00 0.00 H new ATOM 0 HG2 GLU A 61 1.997 -0.644 8.593 1.00 0.00 H new ATOM 0 HG3 GLU A 61 3.309 -0.299 7.482 1.00 0.00 H new ATOM 952 N ILE A 62 0.421 -1.150 5.633 1.00 0.00 N ATOM 953 CA ILE A 62 -0.431 -2.343 5.636 1.00 0.00 C ATOM 954 C ILE A 62 0.431 -3.582 5.361 1.00 0.00 C ATOM 955 O ILE A 62 1.370 -3.517 4.566 1.00 0.00 O ATOM 956 CB ILE A 62 -1.574 -2.217 4.600 1.00 0.00 C ATOM 957 CG1 ILE A 62 -2.576 -1.094 4.938 1.00 0.00 C ATOM 958 CG2 ILE A 62 -2.370 -3.527 4.501 1.00 0.00 C ATOM 959 CD1 ILE A 62 -2.284 0.201 4.178 1.00 0.00 C ATOM 0 H ILE A 62 1.155 -1.178 4.925 1.00 0.00 H new ATOM 0 HA ILE A 62 -0.897 -2.444 6.616 1.00 0.00 H new ATOM 0 HB ILE A 62 -1.082 -1.981 3.656 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -3.586 -1.430 4.702 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -2.548 -0.897 6.010 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -3.168 -3.414 3.767 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -1.705 -4.334 4.193 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -2.803 -3.764 5.473 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -3.019 0.958 4.453 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -1.285 0.555 4.433 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -2.340 0.014 3.106 1.00 0.00 H new ATOM 971 N SER A 63 0.112 -4.708 6.011 1.00 0.00 N ATOM 972 CA SER A 63 0.736 -6.008 5.806 1.00 0.00 C ATOM 973 C SER A 63 -0.219 -6.962 5.084 1.00 0.00 C ATOM 974 O SER A 63 -1.436 -6.841 5.209 1.00 0.00 O ATOM 975 CB SER A 63 1.194 -6.556 7.159 1.00 0.00 C ATOM 976 OG SER A 63 0.159 -6.415 8.116 1.00 0.00 O ATOM 0 H SER A 63 -0.619 -4.732 6.722 1.00 0.00 H new ATOM 0 HA SER A 63 1.610 -5.905 5.163 1.00 0.00 H new ATOM 0 HB2 SER A 63 1.469 -7.606 7.061 1.00 0.00 H new ATOM 0 HB3 SER A 63 2.084 -6.024 7.493 1.00 0.00 H new ATOM 0 HG SER A 63 0.460 -6.770 8.978 1.00 0.00 H new ATOM 982 N PHE A 64 0.334 -7.896 4.304 1.00 0.00 N ATOM 983 CA PHE A 64 -0.407 -8.822 3.460 1.00 0.00 C ATOM 984 C PHE A 64 0.488 -10.024 3.136 1.00 0.00 C ATOM 985 O PHE A 64 1.648 -10.061 3.552 1.00 0.00 O ATOM 986 CB PHE A 64 -0.908 -8.096 2.200 1.00 0.00 C ATOM 987 CG PHE A 64 0.174 -7.510 1.308 1.00 0.00 C ATOM 988 CD1 PHE A 64 0.823 -6.314 1.670 1.00 0.00 C ATOM 989 CD2 PHE A 64 0.535 -8.157 0.111 1.00 0.00 C ATOM 990 CE1 PHE A 64 1.857 -5.801 0.872 1.00 0.00 C ATOM 991 CE2 PHE A 64 1.511 -7.592 -0.729 1.00 0.00 C ATOM 992 CZ PHE A 64 2.185 -6.423 -0.342 1.00 0.00 C ATOM 0 H PHE A 64 1.344 -8.028 4.245 1.00 0.00 H new ATOM 0 HA PHE A 64 -1.290 -9.195 3.979 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -1.501 -8.795 1.611 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -1.576 -7.292 2.507 1.00 0.00 H new ATOM 0 HD1 PHE A 64 0.524 -5.789 2.565 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.062 -9.088 -0.163 1.00 0.00 H new ATOM 0 HE1 PHE A 64 2.402 -4.925 1.193 1.00 0.00 H new ATOM 0 HE2 PHE A 64 1.743 -8.059 -1.675 1.00 0.00 H new ATOM 0 HZ PHE A 64 2.953 -6.004 -0.976 1.00 0.00 H new ATOM 1002 N LYS A 65 -0.054 -11.031 2.440 1.00 0.00 N ATOM 1003 CA LYS A 65 0.657 -12.257 2.090 1.00 0.00 C ATOM 1004 C LYS A 65 0.385 -12.586 0.629 1.00 0.00 C ATOM 1005 O LYS A 65 -0.728 -12.376 0.148 1.00 0.00 O ATOM 1006 CB LYS A 65 0.214 -13.427 2.982 1.00 0.00 C ATOM 1007 CG LYS A 65 0.189 -13.012 4.455 1.00 0.00 C ATOM 1008 CD LYS A 65 0.129 -14.183 5.443 1.00 0.00 C ATOM 1009 CE LYS A 65 1.291 -15.162 5.221 1.00 0.00 C ATOM 1010 NZ LYS A 65 1.749 -15.798 6.468 1.00 0.00 N ATOM 0 H LYS A 65 -1.016 -11.012 2.101 1.00 0.00 H new ATOM 0 HA LYS A 65 1.725 -12.103 2.246 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -0.777 -13.766 2.679 1.00 0.00 H new ATOM 0 HB3 LYS A 65 0.894 -14.269 2.849 1.00 0.00 H new ATOM 0 HG2 LYS A 65 1.078 -12.419 4.668 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -0.673 -12.366 4.623 1.00 0.00 H new ATOM 0 HD2 LYS A 65 0.162 -13.802 6.464 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -0.819 -14.709 5.329 1.00 0.00 H new ATOM 0 HE2 LYS A 65 0.980 -15.935 4.518 1.00 0.00 H new ATOM 0 HE3 LYS A 65 2.125 -14.631 4.762 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 2.169 -16.724 6.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 2.461 -15.193 6.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 0.941 -15.926 7.110 1.00 0.00 H new ATOM 1024 N LEU A 66 1.390 -13.115 -0.068 1.00 0.00 N ATOM 1025 CA LEU A 66 1.335 -13.409 -1.494 1.00 0.00 C ATOM 1026 C LEU A 66 0.547 -14.693 -1.787 1.00 0.00 C ATOM 1027 O LEU A 66 1.028 -15.578 -2.490 1.00 0.00 O ATOM 1028 CB LEU A 66 2.763 -13.433 -2.066 1.00 0.00 C ATOM 1029 CG LEU A 66 3.707 -14.395 -1.314 1.00 0.00 C ATOM 1030 CD1 LEU A 66 4.512 -15.241 -2.302 1.00 0.00 C ATOM 1031 CD2 LEU A 66 4.705 -13.625 -0.443 1.00 0.00 C ATOM 0 H LEU A 66 2.286 -13.356 0.357 1.00 0.00 H new ATOM 0 HA LEU A 66 0.784 -12.617 -2.001 1.00 0.00 H new ATOM 0 HB2 LEU A 66 2.721 -13.723 -3.116 1.00 0.00 H new ATOM 0 HB3 LEU A 66 3.178 -12.426 -2.030 1.00 0.00 H new ATOM 0 HG LEU A 66 3.080 -15.030 -0.688 1.00 0.00 H new ATOM 0 HD11 LEU A 66 5.172 -15.913 -1.753 1.00 0.00 H new ATOM 0 HD12 LEU A 66 3.831 -15.826 -2.919 1.00 0.00 H new ATOM 0 HD13 LEU A 66 5.108 -14.588 -2.939 1.00 0.00 H new ATOM 0 HD21 LEU A 66 5.356 -14.330 0.074 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.307 -12.969 -1.072 1.00 0.00 H new ATOM 0 HD23 LEU A 66 4.163 -13.027 0.290 1.00 0.00 H new ATOM 1043 N GLY A 67 -0.683 -14.778 -1.277 1.00 0.00 N ATOM 1044 CA GLY A 67 -1.596 -15.882 -1.542 1.00 0.00 C ATOM 1045 C GLY A 67 -2.746 -15.900 -0.535 1.00 0.00 C ATOM 1046 O GLY A 67 -3.116 -16.968 -0.055 1.00 0.00 O ATOM 0 H GLY A 67 -1.075 -14.068 -0.659 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.995 -15.793 -2.552 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -1.053 -16.826 -1.495 1.00 0.00 H new ATOM 1050 N VAL A 68 -3.283 -14.727 -0.175 1.00 0.00 N ATOM 1051 CA VAL A 68 -4.282 -14.572 0.880 1.00 0.00 C ATOM 1052 C VAL A 68 -5.162 -13.370 0.534 1.00 0.00 C ATOM 1053 O VAL A 68 -4.672 -12.438 -0.110 1.00 0.00 O ATOM 1054 CB VAL A 68 -3.579 -14.363 2.240 1.00 0.00 C ATOM 1055 CG1 VAL A 68 -4.550 -13.977 3.363 1.00 0.00 C ATOM 1056 CG2 VAL A 68 -2.818 -15.617 2.695 1.00 0.00 C ATOM 0 H VAL A 68 -3.028 -13.845 -0.620 1.00 0.00 H new ATOM 0 HA VAL A 68 -4.900 -15.467 0.955 1.00 0.00 H new ATOM 0 HB VAL A 68 -2.884 -13.542 2.066 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -3.997 -13.844 4.293 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -5.054 -13.046 3.104 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -5.290 -14.767 3.491 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -2.340 -15.424 3.655 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -3.515 -16.449 2.798 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -2.058 -15.870 1.956 1.00 0.00 H new ATOM 1066 N GLU A 69 -6.427 -13.396 0.984 1.00 0.00 N ATOM 1067 CA GLU A 69 -7.328 -12.251 1.007 1.00 0.00 C ATOM 1068 C GLU A 69 -7.349 -11.647 2.412 1.00 0.00 C ATOM 1069 O GLU A 69 -7.360 -12.381 3.399 1.00 0.00 O ATOM 1070 CB GLU A 69 -8.743 -12.639 0.546 1.00 0.00 C ATOM 1071 CG GLU A 69 -9.545 -11.370 0.209 1.00 0.00 C ATOM 1072 CD GLU A 69 -10.965 -11.668 -0.252 1.00 0.00 C ATOM 1073 OE1 GLU A 69 -11.772 -12.040 0.626 1.00 0.00 O ATOM 1074 OE2 GLU A 69 -11.229 -11.475 -1.458 1.00 0.00 O ATOM 0 H GLU A 69 -6.856 -14.245 1.352 1.00 0.00 H new ATOM 0 HA GLU A 69 -6.961 -11.502 0.305 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -8.686 -13.288 -0.328 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -9.249 -13.203 1.329 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -9.582 -10.726 1.088 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -9.025 -10.815 -0.571 1.00 0.00 H new ATOM 1081 N PHE A 70 -7.347 -10.317 2.499 1.00 0.00 N ATOM 1082 CA PHE A 70 -7.447 -9.553 3.734 1.00 0.00 C ATOM 1083 C PHE A 70 -8.310 -8.318 3.463 1.00 0.00 C ATOM 1084 O PHE A 70 -8.467 -7.918 2.310 1.00 0.00 O ATOM 1085 CB PHE A 70 -6.044 -9.177 4.239 1.00 0.00 C ATOM 1086 CG PHE A 70 -5.245 -8.278 3.309 1.00 0.00 C ATOM 1087 CD1 PHE A 70 -4.716 -8.789 2.111 1.00 0.00 C ATOM 1088 CD2 PHE A 70 -5.103 -6.908 3.596 1.00 0.00 C ATOM 1089 CE1 PHE A 70 -4.146 -7.923 1.164 1.00 0.00 C ATOM 1090 CE2 PHE A 70 -4.472 -6.056 2.676 1.00 0.00 C ATOM 1091 CZ PHE A 70 -4.003 -6.558 1.453 1.00 0.00 C ATOM 0 H PHE A 70 -7.272 -9.721 1.674 1.00 0.00 H new ATOM 0 HA PHE A 70 -7.917 -10.146 4.519 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -6.143 -8.680 5.204 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -5.478 -10.093 4.409 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -4.748 -9.851 1.918 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -5.480 -6.511 4.527 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -3.817 -8.309 0.211 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -4.347 -5.009 2.911 1.00 0.00 H new ATOM 0 HZ PHE A 70 -3.535 -5.897 0.738 1.00 0.00 H new ATOM 1101 N ASP A 71 -8.894 -7.725 4.510 1.00 0.00 N ATOM 1102 CA ASP A 71 -9.624 -6.469 4.381 1.00 0.00 C ATOM 1103 C ASP A 71 -8.615 -5.325 4.333 1.00 0.00 C ATOM 1104 O ASP A 71 -7.651 -5.332 5.100 1.00 0.00 O ATOM 1105 CB ASP A 71 -10.624 -6.307 5.531 1.00 0.00 C ATOM 1106 CG ASP A 71 -11.574 -5.142 5.279 1.00 0.00 C ATOM 1107 OD1 ASP A 71 -11.190 -3.997 5.590 1.00 0.00 O ATOM 1108 OD2 ASP A 71 -12.690 -5.426 4.787 1.00 0.00 O ATOM 0 H ASP A 71 -8.872 -8.100 5.458 1.00 0.00 H new ATOM 0 HA ASP A 71 -10.205 -6.462 3.459 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -11.197 -7.227 5.650 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -10.085 -6.144 6.464 1.00 0.00 H new ATOM 1113 N GLU A 72 -8.800 -4.388 3.404 1.00 0.00 N ATOM 1114 CA GLU A 72 -7.914 -3.256 3.198 1.00 0.00 C ATOM 1115 C GLU A 72 -8.800 -2.028 3.052 1.00 0.00 C ATOM 1116 O GLU A 72 -9.939 -2.141 2.603 1.00 0.00 O ATOM 1117 CB GLU A 72 -7.054 -3.518 1.951 1.00 0.00 C ATOM 1118 CG GLU A 72 -5.887 -2.533 1.777 1.00 0.00 C ATOM 1119 CD GLU A 72 -4.939 -2.987 0.671 1.00 0.00 C ATOM 1120 OE1 GLU A 72 -5.426 -3.131 -0.471 1.00 0.00 O ATOM 1121 OE2 GLU A 72 -3.754 -3.234 0.972 1.00 0.00 O ATOM 0 H GLU A 72 -9.591 -4.400 2.761 1.00 0.00 H new ATOM 0 HA GLU A 72 -7.226 -3.101 4.029 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -6.656 -4.531 2.004 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -7.690 -3.471 1.067 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -6.276 -1.543 1.541 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -5.339 -2.445 2.715 1.00 0.00 H new ATOM 1128 N THR A 73 -8.301 -0.849 3.420 1.00 0.00 N ATOM 1129 CA THR A 73 -9.037 0.378 3.197 1.00 0.00 C ATOM 1130 C THR A 73 -8.087 1.474 2.745 1.00 0.00 C ATOM 1131 O THR A 73 -6.868 1.319 2.825 1.00 0.00 O ATOM 1132 CB THR A 73 -9.892 0.750 4.419 1.00 0.00 C ATOM 1133 OG1 THR A 73 -10.828 1.727 4.020 1.00 0.00 O ATOM 1134 CG2 THR A 73 -9.083 1.275 5.607 1.00 0.00 C ATOM 0 H THR A 73 -7.394 -0.725 3.871 1.00 0.00 H new ATOM 0 HA THR A 73 -9.754 0.234 2.388 1.00 0.00 H new ATOM 0 HB THR A 73 -10.377 -0.163 4.766 1.00 0.00 H new ATOM 0 HG1 THR A 73 -11.558 1.766 4.672 1.00 0.00 H new ATOM 0 HG21 THR A 73 -9.758 1.515 6.429 1.00 0.00 H new ATOM 0 HG22 THR A 73 -8.375 0.512 5.930 1.00 0.00 H new ATOM 0 HG23 THR A 73 -8.540 2.172 5.309 1.00 0.00 H new ATOM 1142 N THR A 74 -8.663 2.566 2.248 1.00 0.00 N ATOM 1143 CA THR A 74 -7.933 3.729 1.772 1.00 0.00 C ATOM 1144 C THR A 74 -8.623 4.999 2.269 1.00 0.00 C ATOM 1145 O THR A 74 -9.566 4.936 3.052 1.00 0.00 O ATOM 1146 CB THR A 74 -7.732 3.649 0.247 1.00 0.00 C ATOM 1147 OG1 THR A 74 -7.062 4.792 -0.242 1.00 0.00 O ATOM 1148 CG2 THR A 74 -9.038 3.495 -0.528 1.00 0.00 C ATOM 0 H THR A 74 -9.675 2.665 2.165 1.00 0.00 H new ATOM 0 HA THR A 74 -6.925 3.755 2.185 1.00 0.00 H new ATOM 0 HB THR A 74 -7.130 2.754 0.087 1.00 0.00 H new ATOM 0 HG1 THR A 74 -6.946 4.713 -1.212 1.00 0.00 H new ATOM 0 HG21 THR A 74 -8.824 3.445 -1.596 1.00 0.00 H new ATOM 0 HG22 THR A 74 -9.541 2.580 -0.215 1.00 0.00 H new ATOM 0 HG23 THR A 74 -9.683 4.350 -0.327 1.00 0.00 H new ATOM 1156 N ALA A 75 -8.098 6.155 1.864 1.00 0.00 N ATOM 1157 CA ALA A 75 -8.249 7.424 2.567 1.00 0.00 C ATOM 1158 C ALA A 75 -9.696 7.891 2.761 1.00 0.00 C ATOM 1159 O ALA A 75 -9.961 8.661 3.679 1.00 0.00 O ATOM 1160 CB ALA A 75 -7.426 8.489 1.844 1.00 0.00 C ATOM 0 H ALA A 75 -7.541 6.234 1.013 1.00 0.00 H new ATOM 0 HA ALA A 75 -7.880 7.263 3.580 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -7.531 9.443 2.361 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -6.377 8.194 1.836 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -7.782 8.590 0.819 1.00 0.00 H new ATOM 1166 N ASP A 76 -10.620 7.454 1.903 1.00 0.00 N ATOM 1167 CA ASP A 76 -12.046 7.764 1.970 1.00 0.00 C ATOM 1168 C ASP A 76 -12.832 6.663 2.703 1.00 0.00 C ATOM 1169 O ASP A 76 -14.055 6.591 2.599 1.00 0.00 O ATOM 1170 CB ASP A 76 -12.558 7.923 0.536 1.00 0.00 C ATOM 1171 CG ASP A 76 -12.462 6.635 -0.268 1.00 0.00 C ATOM 1172 OD1 ASP A 76 -11.732 5.714 0.179 1.00 0.00 O ATOM 1173 OD2 ASP A 76 -13.082 6.618 -1.351 1.00 0.00 O ATOM 0 H ASP A 76 -10.385 6.852 1.114 1.00 0.00 H new ATOM 0 HA ASP A 76 -12.192 8.684 2.535 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -13.596 8.255 0.560 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -11.985 8.703 0.034 1.00 0.00 H new ATOM 1178 N ASP A 77 -12.116 5.792 3.417 1.00 0.00 N ATOM 1179 CA ASP A 77 -12.568 4.533 3.981 1.00 0.00 C ATOM 1180 C ASP A 77 -13.302 3.650 2.963 1.00 0.00 C ATOM 1181 O ASP A 77 -14.284 2.980 3.295 1.00 0.00 O ATOM 1182 CB ASP A 77 -13.300 4.714 5.320 1.00 0.00 C ATOM 1183 CG ASP A 77 -13.399 3.406 6.100 1.00 0.00 C ATOM 1184 OD1 ASP A 77 -12.695 2.424 5.761 1.00 0.00 O ATOM 1185 OD2 ASP A 77 -14.208 3.330 7.053 1.00 0.00 O ATOM 0 H ASP A 77 -11.134 5.968 3.628 1.00 0.00 H new ATOM 0 HA ASP A 77 -11.673 3.963 4.232 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -12.776 5.456 5.922 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -14.302 5.103 5.136 1.00 0.00 H new ATOM 1190 N ARG A 78 -12.803 3.584 1.719 1.00 0.00 N ATOM 1191 CA ARG A 78 -13.202 2.503 0.822 1.00 0.00 C ATOM 1192 C ARG A 78 -12.658 1.191 1.383 1.00 0.00 C ATOM 1193 O ARG A 78 -11.567 0.765 1.017 1.00 0.00 O ATOM 1194 CB ARG A 78 -12.701 2.739 -0.608 1.00 0.00 C ATOM 1195 CG ARG A 78 -13.600 3.710 -1.375 1.00 0.00 C ATOM 1196 CD ARG A 78 -14.678 3.021 -2.216 1.00 0.00 C ATOM 1197 NE ARG A 78 -14.075 2.336 -3.372 1.00 0.00 N ATOM 1198 CZ ARG A 78 -14.631 2.220 -4.589 1.00 0.00 C ATOM 1199 NH1 ARG A 78 -15.904 2.579 -4.783 1.00 0.00 N ATOM 1200 NH2 ARG A 78 -13.907 1.743 -5.608 1.00 0.00 N ATOM 0 H ARG A 78 -12.140 4.251 1.324 1.00 0.00 H new ATOM 0 HA ARG A 78 -14.290 2.463 0.766 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -11.685 3.133 -0.576 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -12.658 1.788 -1.139 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -14.081 4.383 -0.665 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -12.981 4.325 -2.028 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -15.221 2.302 -1.603 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -15.404 3.758 -2.561 1.00 0.00 H new ATOM 0 HE ARG A 78 -13.157 1.914 -3.237 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -16.456 2.942 -4.006 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -16.324 2.490 -5.708 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -12.936 1.469 -5.459 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -14.326 1.654 -6.534 1.00 0.00 H new ATOM 1214 N LYS A 79 -13.437 0.567 2.267 1.00 0.00 N ATOM 1215 CA LYS A 79 -13.126 -0.689 2.932 1.00 0.00 C ATOM 1216 C LYS A 79 -13.375 -1.853 1.967 1.00 0.00 C ATOM 1217 O LYS A 79 -14.501 -2.336 1.842 1.00 0.00 O ATOM 1218 CB LYS A 79 -13.971 -0.756 4.212 1.00 0.00 C ATOM 1219 CG LYS A 79 -13.368 -1.669 5.291 1.00 0.00 C ATOM 1220 CD LYS A 79 -14.188 -1.698 6.595 1.00 0.00 C ATOM 1221 CE LYS A 79 -13.981 -0.499 7.544 1.00 0.00 C ATOM 1222 NZ LYS A 79 -14.334 0.794 6.929 1.00 0.00 N ATOM 0 H LYS A 79 -14.342 0.944 2.549 1.00 0.00 H new ATOM 0 HA LYS A 79 -12.077 -0.757 3.219 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -14.084 0.249 4.618 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -14.970 -1.112 3.961 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -13.290 -2.682 4.897 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -12.355 -1.335 5.515 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -15.245 -1.754 6.336 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -13.943 -2.612 7.136 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -14.584 -0.645 8.440 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -12.939 -0.471 7.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -14.404 1.522 7.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -13.600 1.065 6.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -15.248 0.708 6.440 1.00 0.00 H new ATOM 1236 N VAL A 80 -12.333 -2.271 1.250 1.00 0.00 N ATOM 1237 CA VAL A 80 -12.393 -3.295 0.217 1.00 0.00 C ATOM 1238 C VAL A 80 -11.799 -4.606 0.741 1.00 0.00 C ATOM 1239 O VAL A 80 -11.198 -4.647 1.814 1.00 0.00 O ATOM 1240 CB VAL A 80 -11.668 -2.798 -1.047 1.00 0.00 C ATOM 1241 CG1 VAL A 80 -12.151 -1.398 -1.455 1.00 0.00 C ATOM 1242 CG2 VAL A 80 -10.147 -2.752 -0.861 1.00 0.00 C ATOM 0 H VAL A 80 -11.395 -1.892 1.379 1.00 0.00 H new ATOM 0 HA VAL A 80 -13.432 -3.492 -0.049 1.00 0.00 H new ATOM 0 HB VAL A 80 -11.908 -3.515 -1.832 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -11.620 -1.076 -2.351 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -13.221 -1.428 -1.659 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -11.955 -0.695 -0.645 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -9.679 -2.396 -1.779 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -9.901 -2.076 -0.042 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -9.778 -3.751 -0.630 1.00 0.00 H new ATOM 1252 N LYS A 81 -11.944 -5.683 -0.033 1.00 0.00 N ATOM 1253 CA LYS A 81 -11.193 -6.910 0.174 1.00 0.00 C ATOM 1254 C LYS A 81 -10.053 -6.917 -0.841 1.00 0.00 C ATOM 1255 O LYS A 81 -10.248 -6.558 -1.999 1.00 0.00 O ATOM 1256 CB LYS A 81 -12.119 -8.131 0.041 1.00 0.00 C ATOM 1257 CG LYS A 81 -12.260 -8.915 1.356 1.00 0.00 C ATOM 1258 CD LYS A 81 -12.769 -8.114 2.567 1.00 0.00 C ATOM 1259 CE LYS A 81 -14.149 -7.485 2.358 1.00 0.00 C ATOM 1260 NZ LYS A 81 -14.549 -6.705 3.546 1.00 0.00 N ATOM 0 H LYS A 81 -12.589 -5.723 -0.822 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.775 -6.962 1.179 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -13.104 -7.800 -0.288 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -11.731 -8.794 -0.732 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -12.939 -9.751 1.187 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -11.289 -9.340 1.609 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -12.808 -8.772 3.435 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -12.052 -7.326 2.796 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -14.131 -6.838 1.481 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -14.885 -8.265 2.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -15.464 -6.244 3.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -14.635 -7.340 4.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -13.830 -5.981 3.744 1.00 0.00 H new ATOM 1274 N SER A 82 -8.857 -7.281 -0.395 1.00 0.00 N ATOM 1275 CA SER A 82 -7.652 -7.299 -1.195 1.00 0.00 C ATOM 1276 C SER A 82 -7.066 -8.690 -1.119 1.00 0.00 C ATOM 1277 O SER A 82 -6.793 -9.168 -0.023 1.00 0.00 O ATOM 1278 CB SER A 82 -6.676 -6.262 -0.647 1.00 0.00 C ATOM 1279 OG SER A 82 -6.982 -5.029 -1.264 1.00 0.00 O ATOM 0 H SER A 82 -8.701 -7.581 0.567 1.00 0.00 H new ATOM 0 HA SER A 82 -7.862 -7.052 -2.236 1.00 0.00 H new ATOM 0 HB2 SER A 82 -6.768 -6.183 0.436 1.00 0.00 H new ATOM 0 HB3 SER A 82 -5.647 -6.553 -0.859 1.00 0.00 H new ATOM 0 HG SER A 82 -6.669 -4.293 -0.698 1.00 0.00 H new ATOM 1285 N ILE A 83 -6.869 -9.318 -2.277 1.00 0.00 N ATOM 1286 CA ILE A 83 -6.257 -10.625 -2.393 1.00 0.00 C ATOM 1287 C ILE A 83 -4.981 -10.468 -3.206 1.00 0.00 C ATOM 1288 O ILE A 83 -4.998 -9.892 -4.295 1.00 0.00 O ATOM 1289 CB ILE A 83 -7.252 -11.687 -2.912 1.00 0.00 C ATOM 1290 CG1 ILE A 83 -6.525 -12.837 -3.634 1.00 0.00 C ATOM 1291 CG2 ILE A 83 -8.377 -11.072 -3.754 1.00 0.00 C ATOM 1292 CD1 ILE A 83 -7.413 -14.068 -3.839 1.00 0.00 C ATOM 0 H ILE A 83 -7.139 -8.917 -3.175 1.00 0.00 H new ATOM 0 HA ILE A 83 -5.975 -11.019 -1.416 1.00 0.00 H new ATOM 0 HB ILE A 83 -7.741 -12.123 -2.041 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -6.171 -12.485 -4.603 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -5.645 -13.122 -3.058 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -9.049 -11.860 -4.095 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -8.934 -10.356 -3.150 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -7.949 -10.562 -4.617 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -6.846 -14.844 -4.352 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -7.746 -14.442 -2.871 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -8.280 -13.795 -4.440 1.00 0.00 H new ATOM 1304 N VAL A 84 -3.865 -10.941 -2.645 1.00 0.00 N ATOM 1305 CA VAL A 84 -2.591 -10.970 -3.342 1.00 0.00 C ATOM 1306 C VAL A 84 -2.239 -12.419 -3.644 1.00 0.00 C ATOM 1307 O VAL A 84 -2.567 -13.315 -2.867 1.00 0.00 O ATOM 1308 CB VAL A 84 -1.497 -10.233 -2.552 1.00 0.00 C ATOM 1309 CG1 VAL A 84 -0.194 -10.160 -3.356 1.00 0.00 C ATOM 1310 CG2 VAL A 84 -1.946 -8.805 -2.209 1.00 0.00 C ATOM 0 H VAL A 84 -3.826 -11.313 -1.696 1.00 0.00 H new ATOM 0 HA VAL A 84 -2.669 -10.432 -4.287 1.00 0.00 H new ATOM 0 HB VAL A 84 -1.324 -10.794 -1.634 1.00 0.00 H new ATOM 0 HG11 VAL A 84 0.563 -9.634 -2.775 1.00 0.00 H new ATOM 0 HG12 VAL A 84 0.154 -11.169 -3.577 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -0.372 -9.625 -4.289 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -1.158 -8.300 -1.650 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -2.147 -8.256 -3.129 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -2.852 -8.844 -1.604 1.00 0.00 H new ATOM 1320 N THR A 85 -1.595 -12.651 -4.786 1.00 0.00 N ATOM 1321 CA THR A 85 -1.018 -13.921 -5.192 1.00 0.00 C ATOM 1322 C THR A 85 0.203 -13.581 -6.055 1.00 0.00 C ATOM 1323 O THR A 85 0.354 -12.429 -6.465 1.00 0.00 O ATOM 1324 CB THR A 85 -2.096 -14.745 -5.921 1.00 0.00 C ATOM 1325 OG1 THR A 85 -3.186 -14.977 -5.047 1.00 0.00 O ATOM 1326 CG2 THR A 85 -1.603 -16.112 -6.403 1.00 0.00 C ATOM 0 H THR A 85 -1.457 -11.920 -5.484 1.00 0.00 H new ATOM 0 HA THR A 85 -0.686 -14.539 -4.358 1.00 0.00 H new ATOM 0 HB THR A 85 -2.380 -14.158 -6.794 1.00 0.00 H new ATOM 0 HG1 THR A 85 -3.872 -15.500 -5.512 1.00 0.00 H new ATOM 0 HG21 THR A 85 -2.416 -16.635 -6.907 1.00 0.00 H new ATOM 0 HG22 THR A 85 -0.774 -15.976 -7.097 1.00 0.00 H new ATOM 0 HG23 THR A 85 -1.268 -16.700 -5.549 1.00 0.00 H new ATOM 1334 N LEU A 86 1.097 -14.542 -6.297 1.00 0.00 N ATOM 1335 CA LEU A 86 2.249 -14.369 -7.172 1.00 0.00 C ATOM 1336 C LEU A 86 2.065 -15.270 -8.396 1.00 0.00 C ATOM 1337 O LEU A 86 2.055 -16.491 -8.255 1.00 0.00 O ATOM 1338 CB LEU A 86 3.535 -14.662 -6.384 1.00 0.00 C ATOM 1339 CG LEU A 86 4.770 -13.916 -6.917 1.00 0.00 C ATOM 1340 CD1 LEU A 86 5.897 -14.022 -5.882 1.00 0.00 C ATOM 1341 CD2 LEU A 86 5.267 -14.456 -8.262 1.00 0.00 C ATOM 0 H LEU A 86 1.037 -15.473 -5.884 1.00 0.00 H new ATOM 0 HA LEU A 86 2.333 -13.343 -7.531 1.00 0.00 H new ATOM 0 HB2 LEU A 86 3.380 -14.391 -5.340 1.00 0.00 H new ATOM 0 HB3 LEU A 86 3.730 -15.734 -6.410 1.00 0.00 H new ATOM 0 HG LEU A 86 4.477 -12.879 -7.081 1.00 0.00 H new ATOM 0 HD11 LEU A 86 6.779 -13.496 -6.249 1.00 0.00 H new ATOM 0 HD12 LEU A 86 5.572 -13.574 -4.943 1.00 0.00 H new ATOM 0 HD13 LEU A 86 6.142 -15.071 -5.717 1.00 0.00 H new ATOM 0 HD21 LEU A 86 6.140 -13.887 -8.582 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.538 -15.506 -8.155 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.477 -14.359 -9.007 1.00 0.00 H new ATOM 1353 N ASP A 87 1.889 -14.671 -9.577 1.00 0.00 N ATOM 1354 CA ASP A 87 1.744 -15.367 -10.851 1.00 0.00 C ATOM 1355 C ASP A 87 3.098 -15.327 -11.570 1.00 0.00 C ATOM 1356 O ASP A 87 3.559 -14.267 -11.991 1.00 0.00 O ATOM 1357 CB ASP A 87 0.568 -14.767 -11.650 1.00 0.00 C ATOM 1358 CG ASP A 87 0.908 -14.396 -13.090 1.00 0.00 C ATOM 1359 OD1 ASP A 87 1.284 -15.324 -13.838 1.00 0.00 O ATOM 1360 OD2 ASP A 87 0.768 -13.197 -13.416 1.00 0.00 O ATOM 0 H ASP A 87 1.843 -13.656 -9.672 1.00 0.00 H new ATOM 0 HA ASP A 87 1.485 -16.417 -10.718 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -0.254 -15.483 -11.657 1.00 0.00 H new ATOM 0 HB3 ASP A 87 0.210 -13.876 -11.133 1.00 0.00 H new ATOM 1365 N GLY A 88 3.780 -16.475 -11.635 1.00 0.00 N ATOM 1366 CA GLY A 88 5.078 -16.624 -12.280 1.00 0.00 C ATOM 1367 C GLY A 88 6.166 -15.805 -11.581 1.00 0.00 C ATOM 1368 O GLY A 88 6.942 -16.343 -10.796 1.00 0.00 O ATOM 0 H GLY A 88 3.432 -17.344 -11.229 1.00 0.00 H new ATOM 0 HA2 GLY A 88 5.362 -17.676 -12.283 1.00 0.00 H new ATOM 0 HA3 GLY A 88 5.003 -16.312 -13.322 1.00 0.00 H new ATOM 1372 N GLY A 89 6.219 -14.506 -11.885 1.00 0.00 N ATOM 1373 CA GLY A 89 7.151 -13.539 -11.313 1.00 0.00 C ATOM 1374 C GLY A 89 6.473 -12.207 -10.973 1.00 0.00 C ATOM 1375 O GLY A 89 7.141 -11.263 -10.554 1.00 0.00 O ATOM 0 H GLY A 89 5.586 -14.085 -12.565 1.00 0.00 H new ATOM 0 HA2 GLY A 89 7.597 -13.958 -10.411 1.00 0.00 H new ATOM 0 HA3 GLY A 89 7.964 -13.361 -12.017 1.00 0.00 H new ATOM 1379 N LYS A 90 5.151 -12.125 -11.150 1.00 0.00 N ATOM 1380 CA LYS A 90 4.352 -10.930 -10.971 1.00 0.00 C ATOM 1381 C LYS A 90 3.589 -11.090 -9.662 1.00 0.00 C ATOM 1382 O LYS A 90 2.817 -12.035 -9.513 1.00 0.00 O ATOM 1383 CB LYS A 90 3.366 -10.787 -12.144 1.00 0.00 C ATOM 1384 CG LYS A 90 4.019 -11.021 -13.515 1.00 0.00 C ATOM 1385 CD LYS A 90 3.007 -10.863 -14.659 1.00 0.00 C ATOM 1386 CE LYS A 90 2.787 -9.406 -15.091 1.00 0.00 C ATOM 1387 NZ LYS A 90 3.876 -8.913 -15.961 1.00 0.00 N ATOM 0 H LYS A 90 4.593 -12.930 -11.434 1.00 0.00 H new ATOM 0 HA LYS A 90 4.980 -10.039 -10.943 1.00 0.00 H new ATOM 0 HB2 LYS A 90 2.549 -11.496 -12.012 1.00 0.00 H new ATOM 0 HB3 LYS A 90 2.928 -9.789 -12.123 1.00 0.00 H new ATOM 0 HG2 LYS A 90 4.838 -10.315 -13.653 1.00 0.00 H new ATOM 0 HG3 LYS A 90 4.451 -12.021 -13.547 1.00 0.00 H new ATOM 0 HD2 LYS A 90 3.350 -11.440 -15.518 1.00 0.00 H new ATOM 0 HD3 LYS A 90 2.053 -11.289 -14.350 1.00 0.00 H new ATOM 0 HE2 LYS A 90 1.837 -9.324 -15.619 1.00 0.00 H new ATOM 0 HE3 LYS A 90 2.716 -8.773 -14.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 3.485 -8.261 -16.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 4.583 -8.414 -15.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 4.327 -9.717 -16.442 1.00 0.00 H new ATOM 1401 N LEU A 91 3.781 -10.179 -8.710 1.00 0.00 N ATOM 1402 CA LEU A 91 2.936 -10.132 -7.529 1.00 0.00 C ATOM 1403 C LEU A 91 1.643 -9.444 -7.950 1.00 0.00 C ATOM 1404 O LEU A 91 1.638 -8.236 -8.185 1.00 0.00 O ATOM 1405 CB LEU A 91 3.690 -9.443 -6.387 1.00 0.00 C ATOM 1406 CG LEU A 91 2.890 -9.318 -5.080 1.00 0.00 C ATOM 1407 CD1 LEU A 91 3.851 -9.122 -3.898 1.00 0.00 C ATOM 1408 CD2 LEU A 91 1.913 -8.135 -5.130 1.00 0.00 C ATOM 0 H LEU A 91 4.512 -9.468 -8.737 1.00 0.00 H new ATOM 0 HA LEU A 91 2.681 -11.117 -7.139 1.00 0.00 H new ATOM 0 HB2 LEU A 91 4.606 -9.998 -6.186 1.00 0.00 H new ATOM 0 HB3 LEU A 91 3.987 -8.446 -6.713 1.00 0.00 H new ATOM 0 HG LEU A 91 2.317 -10.237 -4.953 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.279 -9.034 -2.975 1.00 0.00 H new ATOM 0 HD12 LEU A 91 4.522 -9.978 -3.829 1.00 0.00 H new ATOM 0 HD13 LEU A 91 4.435 -8.215 -4.051 1.00 0.00 H new ATOM 0 HD21 LEU A 91 1.364 -8.076 -4.190 1.00 0.00 H new ATOM 0 HD22 LEU A 91 2.469 -7.210 -5.284 1.00 0.00 H new ATOM 0 HD23 LEU A 91 1.211 -8.277 -5.952 1.00 0.00 H new ATOM 1420 N VAL A 92 0.561 -10.211 -8.091 1.00 0.00 N ATOM 1421 CA VAL A 92 -0.735 -9.702 -8.501 1.00 0.00 C ATOM 1422 C VAL A 92 -1.554 -9.427 -7.241 1.00 0.00 C ATOM 1423 O VAL A 92 -1.902 -10.354 -6.512 1.00 0.00 O ATOM 1424 CB VAL A 92 -1.409 -10.639 -9.529 1.00 0.00 C ATOM 1425 CG1 VAL A 92 -0.416 -11.007 -10.643 1.00 0.00 C ATOM 1426 CG2 VAL A 92 -1.997 -11.937 -8.962 1.00 0.00 C ATOM 0 H VAL A 92 0.567 -11.216 -7.920 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.639 -8.758 -9.038 1.00 0.00 H new ATOM 0 HB VAL A 92 -2.253 -10.060 -9.903 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -0.903 -11.667 -11.361 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -0.086 -10.100 -11.150 1.00 0.00 H new ATOM 0 HG13 VAL A 92 0.446 -11.515 -10.209 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -2.444 -12.517 -9.769 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -1.205 -12.520 -8.491 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.760 -11.698 -8.222 1.00 0.00 H new ATOM 1436 N HIS A 93 -1.821 -8.148 -6.958 1.00 0.00 N ATOM 1437 CA HIS A 93 -2.764 -7.714 -5.938 1.00 0.00 C ATOM 1438 C HIS A 93 -4.047 -7.367 -6.682 1.00 0.00 C ATOM 1439 O HIS A 93 -4.091 -6.345 -7.363 1.00 0.00 O ATOM 1440 CB HIS A 93 -2.170 -6.522 -5.166 1.00 0.00 C ATOM 1441 CG HIS A 93 -3.078 -5.766 -4.213 1.00 0.00 C ATOM 1442 ND1 HIS A 93 -2.765 -4.540 -3.649 1.00 0.00 N ATOM 1443 CD2 HIS A 93 -4.321 -6.128 -3.754 1.00 0.00 C ATOM 1444 CE1 HIS A 93 -3.797 -4.157 -2.876 1.00 0.00 C ATOM 1445 NE2 HIS A 93 -4.756 -5.096 -2.938 1.00 0.00 N ATOM 0 H HIS A 93 -1.374 -7.372 -7.447 1.00 0.00 H new ATOM 0 HA HIS A 93 -2.972 -8.479 -5.190 1.00 0.00 H new ATOM 0 HB2 HIS A 93 -1.316 -6.886 -4.595 1.00 0.00 H new ATOM 0 HB3 HIS A 93 -1.785 -5.810 -5.896 1.00 0.00 H new ATOM 0 HD2 HIS A 93 -4.855 -7.038 -3.984 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -3.847 -3.245 -2.300 1.00 0.00 H new ATOM 0 HE2 HIS A 93 -5.657 -5.056 -2.462 1.00 0.00 H new ATOM 1454 N VAL A 94 -5.077 -8.207 -6.569 1.00 0.00 N ATOM 1455 CA VAL A 94 -6.399 -7.893 -7.086 1.00 0.00 C ATOM 1456 C VAL A 94 -7.254 -7.435 -5.902 1.00 0.00 C ATOM 1457 O VAL A 94 -7.155 -7.981 -4.801 1.00 0.00 O ATOM 1458 CB VAL A 94 -6.945 -9.054 -7.936 1.00 0.00 C ATOM 1459 CG1 VAL A 94 -7.351 -10.292 -7.136 1.00 0.00 C ATOM 1460 CG2 VAL A 94 -8.131 -8.597 -8.790 1.00 0.00 C ATOM 0 H VAL A 94 -5.013 -9.119 -6.117 1.00 0.00 H new ATOM 0 HA VAL A 94 -6.394 -7.066 -7.797 1.00 0.00 H new ATOM 0 HB VAL A 94 -6.108 -9.351 -8.568 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -7.724 -11.058 -7.816 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -6.486 -10.676 -6.596 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -8.134 -10.026 -6.426 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -8.498 -9.436 -9.381 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -8.928 -8.234 -8.141 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -7.812 -7.796 -9.456 1.00 0.00 H new ATOM 1470 N GLN A 95 -7.977 -6.334 -6.092 1.00 0.00 N ATOM 1471 CA GLN A 95 -8.561 -5.536 -5.030 1.00 0.00 C ATOM 1472 C GLN A 95 -10.021 -5.294 -5.382 1.00 0.00 C ATOM 1473 O GLN A 95 -10.316 -4.641 -6.381 1.00 0.00 O ATOM 1474 CB GLN A 95 -7.730 -4.261 -4.890 1.00 0.00 C ATOM 1475 CG GLN A 95 -8.248 -3.304 -3.815 1.00 0.00 C ATOM 1476 CD GLN A 95 -7.240 -2.189 -3.530 1.00 0.00 C ATOM 1477 OE1 GLN A 95 -6.041 -2.353 -3.734 1.00 0.00 O ATOM 1478 NE2 GLN A 95 -7.714 -1.028 -3.089 1.00 0.00 N ATOM 0 H GLN A 95 -8.176 -5.965 -7.022 1.00 0.00 H new ATOM 0 HA GLN A 95 -8.546 -6.030 -4.059 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -6.701 -4.533 -4.656 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -7.713 -3.742 -5.848 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -9.193 -2.868 -4.138 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -8.449 -3.858 -2.898 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -8.715 -0.914 -2.926 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -7.077 -0.251 -2.913 1.00 0.00 H new ATOM 1487 N LYS A 96 -10.913 -5.889 -4.592 1.00 0.00 N ATOM 1488 CA LYS A 96 -12.285 -6.200 -4.929 1.00 0.00 C ATOM 1489 C LYS A 96 -13.195 -5.641 -3.839 1.00 0.00 C ATOM 1490 O LYS A 96 -13.023 -5.945 -2.659 1.00 0.00 O ATOM 1491 CB LYS A 96 -12.373 -7.733 -5.023 1.00 0.00 C ATOM 1492 CG LYS A 96 -13.713 -8.280 -5.537 1.00 0.00 C ATOM 1493 CD LYS A 96 -14.206 -9.450 -4.665 1.00 0.00 C ATOM 1494 CE LYS A 96 -14.797 -8.977 -3.328 1.00 0.00 C ATOM 1495 NZ LYS A 96 -16.117 -8.344 -3.516 1.00 0.00 N ATOM 0 H LYS A 96 -10.674 -6.181 -3.644 1.00 0.00 H new ATOM 0 HA LYS A 96 -12.599 -5.757 -5.874 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -11.578 -8.087 -5.680 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -12.182 -8.153 -4.036 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -14.458 -7.484 -5.538 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -13.601 -8.613 -6.569 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -14.960 -10.015 -5.213 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -13.376 -10.130 -4.472 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -14.892 -9.825 -2.650 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -14.116 -8.268 -2.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -16.112 -7.397 -3.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -16.321 -8.263 -4.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -16.849 -8.926 -3.061 1.00 0.00 H new ATOM 1509 N TRP A 97 -14.183 -4.832 -4.226 1.00 0.00 N ATOM 1510 CA TRP A 97 -15.146 -4.273 -3.289 1.00 0.00 C ATOM 1511 C TRP A 97 -16.486 -4.954 -3.526 1.00 0.00 C ATOM 1512 O TRP A 97 -16.831 -5.923 -2.847 1.00 0.00 O ATOM 1513 CB TRP A 97 -15.183 -2.741 -3.406 1.00 0.00 C ATOM 1514 CG TRP A 97 -14.992 -2.141 -4.769 1.00 0.00 C ATOM 1515 CD1 TRP A 97 -15.965 -1.638 -5.556 1.00 0.00 C ATOM 1516 CD2 TRP A 97 -13.746 -1.914 -5.493 1.00 0.00 C ATOM 1517 NE1 TRP A 97 -15.425 -1.181 -6.736 1.00 0.00 N ATOM 1518 CE2 TRP A 97 -14.053 -1.299 -6.741 1.00 0.00 C ATOM 1519 CE3 TRP A 97 -12.384 -2.148 -5.214 1.00 0.00 C ATOM 1520 CZ2 TRP A 97 -13.063 -0.931 -7.661 1.00 0.00 C ATOM 1521 CZ3 TRP A 97 -11.381 -1.715 -6.097 1.00 0.00 C ATOM 1522 CH2 TRP A 97 -11.715 -1.132 -7.329 1.00 0.00 C ATOM 0 H TRP A 97 -14.334 -4.550 -5.195 1.00 0.00 H new ATOM 0 HA TRP A 97 -14.859 -4.468 -2.256 1.00 0.00 H new ATOM 0 HB2 TRP A 97 -16.143 -2.398 -3.020 1.00 0.00 H new ATOM 0 HB3 TRP A 97 -14.413 -2.336 -2.750 1.00 0.00 H new ATOM 0 HD1 TRP A 97 -17.013 -1.600 -5.298 1.00 0.00 H new ATOM 0 HE1 TRP A 97 -15.972 -0.803 -7.509 1.00 0.00 H new ATOM 0 HE3 TRP A 97 -12.108 -2.668 -4.308 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 -13.334 -0.498 -8.613 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 -10.342 -1.832 -5.825 1.00 0.00 H new ATOM 0 HH2 TRP A 97 -10.937 -0.839 -8.019 1.00 0.00 H new ATOM 1533 N ASN A 98 -17.212 -4.481 -4.531 1.00 0.00 N ATOM 1534 CA ASN A 98 -18.544 -4.904 -4.916 1.00 0.00 C ATOM 1535 C ASN A 98 -18.731 -4.403 -6.340 1.00 0.00 C ATOM 1536 O ASN A 98 -18.067 -3.441 -6.731 1.00 0.00 O ATOM 1537 CB ASN A 98 -19.602 -4.306 -3.979 1.00 0.00 C ATOM 1538 CG ASN A 98 -19.622 -2.779 -4.022 1.00 0.00 C ATOM 1539 OD1 ASN A 98 -20.215 -2.183 -4.913 1.00 0.00 O ATOM 1540 ND2 ASN A 98 -18.970 -2.127 -3.063 1.00 0.00 N ATOM 0 H ASN A 98 -16.858 -3.741 -5.137 1.00 0.00 H new ATOM 0 HA ASN A 98 -18.658 -5.986 -4.852 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -20.585 -4.687 -4.255 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -19.407 -4.635 -2.958 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -18.956 -1.107 -3.058 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -18.484 -2.647 -2.332 1.00 0.00 H new ATOM 1547 N GLY A 99 -19.536 -5.093 -7.146 1.00 0.00 N ATOM 1548 CA GLY A 99 -19.764 -4.745 -8.541 1.00 0.00 C ATOM 1549 C GLY A 99 -18.574 -5.116 -9.427 1.00 0.00 C ATOM 1550 O GLY A 99 -18.758 -5.654 -10.514 1.00 0.00 O ATOM 0 H GLY A 99 -20.053 -5.918 -6.842 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -20.657 -5.256 -8.901 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -19.956 -3.675 -8.621 1.00 0.00 H new ATOM 1554 N GLN A 100 -17.355 -4.815 -8.970 1.00 0.00 N ATOM 1555 CA GLN A 100 -16.124 -4.957 -9.708 1.00 0.00 C ATOM 1556 C GLN A 100 -14.939 -4.806 -8.746 1.00 0.00 C ATOM 1557 O GLN A 100 -15.106 -4.833 -7.522 1.00 0.00 O ATOM 1558 CB GLN A 100 -16.090 -3.937 -10.859 1.00 0.00 C ATOM 1559 CG GLN A 100 -15.822 -2.480 -10.447 1.00 0.00 C ATOM 1560 CD GLN A 100 -17.053 -1.647 -10.095 1.00 0.00 C ATOM 1561 OE1 GLN A 100 -17.445 -0.790 -10.877 1.00 0.00 O ATOM 1562 NE2 GLN A 100 -17.626 -1.797 -8.904 1.00 0.00 N ATOM 0 H GLN A 100 -17.207 -4.449 -8.029 1.00 0.00 H new ATOM 0 HA GLN A 100 -16.056 -5.947 -10.158 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -15.321 -4.242 -11.569 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -17.044 -3.978 -11.385 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -15.152 -2.484 -9.587 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -15.293 -1.984 -11.261 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -17.289 -2.515 -8.263 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -18.402 -1.194 -8.632 1.00 0.00 H new ATOM 1571 N GLU A 101 -13.756 -4.602 -9.325 1.00 0.00 N ATOM 1572 CA GLU A 101 -12.474 -4.639 -8.657 1.00 0.00 C ATOM 1573 C GLU A 101 -11.464 -3.798 -9.449 1.00 0.00 C ATOM 1574 O GLU A 101 -11.835 -3.072 -10.381 1.00 0.00 O ATOM 1575 CB GLU A 101 -12.074 -6.121 -8.533 1.00 0.00 C ATOM 1576 CG GLU A 101 -12.068 -6.890 -9.860 1.00 0.00 C ATOM 1577 CD GLU A 101 -11.971 -8.385 -9.594 1.00 0.00 C ATOM 1578 OE1 GLU A 101 -12.886 -8.889 -8.906 1.00 0.00 O ATOM 1579 OE2 GLU A 101 -10.982 -8.984 -10.058 1.00 0.00 O ATOM 0 H GLU A 101 -13.672 -4.397 -10.321 1.00 0.00 H new ATOM 0 HA GLU A 101 -12.509 -4.206 -7.657 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -11.081 -6.180 -8.088 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -12.761 -6.614 -7.845 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -12.976 -6.670 -10.421 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -11.228 -6.566 -10.474 1.00 0.00 H new ATOM 1586 N THR A 102 -10.192 -3.895 -9.070 1.00 0.00 N ATOM 1587 CA THR A 102 -9.037 -3.504 -9.867 1.00 0.00 C ATOM 1588 C THR A 102 -7.983 -4.598 -9.737 1.00 0.00 C ATOM 1589 O THR A 102 -7.886 -5.225 -8.681 1.00 0.00 O ATOM 1590 CB THR A 102 -8.484 -2.146 -9.396 1.00 0.00 C ATOM 1591 OG1 THR A 102 -7.343 -1.770 -10.130 1.00 0.00 O ATOM 1592 CG2 THR A 102 -8.052 -2.133 -7.934 1.00 0.00 C ATOM 0 H THR A 102 -9.929 -4.266 -8.157 1.00 0.00 H new ATOM 0 HA THR A 102 -9.324 -3.388 -10.912 1.00 0.00 H new ATOM 0 HB THR A 102 -9.317 -1.459 -9.545 1.00 0.00 H new ATOM 0 HG1 THR A 102 -7.378 -2.177 -11.021 1.00 0.00 H new ATOM 0 HG21 THR A 102 -7.674 -1.144 -7.675 1.00 0.00 H new ATOM 0 HG22 THR A 102 -8.906 -2.372 -7.300 1.00 0.00 H new ATOM 0 HG23 THR A 102 -7.267 -2.873 -7.780 1.00 0.00 H new ATOM 1600 N SER A 103 -7.157 -4.774 -10.769 1.00 0.00 N ATOM 1601 CA SER A 103 -5.906 -5.505 -10.683 1.00 0.00 C ATOM 1602 C SER A 103 -4.770 -4.492 -10.522 1.00 0.00 C ATOM 1603 O SER A 103 -4.791 -3.423 -11.138 1.00 0.00 O ATOM 1604 CB SER A 103 -5.741 -6.396 -11.918 1.00 0.00 C ATOM 1605 OG SER A 103 -5.982 -5.656 -13.098 1.00 0.00 O ATOM 0 H SER A 103 -7.347 -4.404 -11.700 1.00 0.00 H new ATOM 0 HA SER A 103 -5.892 -6.169 -9.819 1.00 0.00 H new ATOM 0 HB2 SER A 103 -4.734 -6.812 -11.942 1.00 0.00 H new ATOM 0 HB3 SER A 103 -6.432 -7.237 -11.862 1.00 0.00 H new ATOM 0 HG SER A 103 -5.871 -6.239 -13.878 1.00 0.00 H new ATOM 1611 N LEU A 104 -3.816 -4.814 -9.645 1.00 0.00 N ATOM 1612 CA LEU A 104 -2.613 -4.050 -9.360 1.00 0.00 C ATOM 1613 C LEU A 104 -1.458 -5.052 -9.407 1.00 0.00 C ATOM 1614 O LEU A 104 -1.230 -5.777 -8.437 1.00 0.00 O ATOM 1615 CB LEU A 104 -2.718 -3.408 -7.964 1.00 0.00 C ATOM 1616 CG LEU A 104 -3.956 -2.523 -7.754 1.00 0.00 C ATOM 1617 CD1 LEU A 104 -4.109 -2.205 -6.267 1.00 0.00 C ATOM 1618 CD2 LEU A 104 -3.834 -1.206 -8.514 1.00 0.00 C ATOM 0 H LEU A 104 -3.872 -5.665 -9.086 1.00 0.00 H new ATOM 0 HA LEU A 104 -2.464 -3.243 -10.078 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -2.723 -4.200 -7.215 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -1.825 -2.808 -7.787 1.00 0.00 H new ATOM 0 HG LEU A 104 -4.822 -3.069 -8.127 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -4.987 -1.577 -6.118 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -4.227 -3.133 -5.707 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -3.222 -1.678 -5.914 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -4.726 -0.604 -8.344 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -2.957 -0.663 -8.162 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -3.731 -1.409 -9.580 1.00 0.00 H new ATOM 1630 N VAL A 105 -0.762 -5.144 -10.541 1.00 0.00 N ATOM 1631 CA VAL A 105 0.327 -6.103 -10.702 1.00 0.00 C ATOM 1632 C VAL A 105 1.651 -5.395 -10.421 1.00 0.00 C ATOM 1633 O VAL A 105 1.851 -4.301 -10.934 1.00 0.00 O ATOM 1634 CB VAL A 105 0.273 -6.777 -12.087 1.00 0.00 C ATOM 1635 CG1 VAL A 105 -1.038 -7.563 -12.231 1.00 0.00 C ATOM 1636 CG2 VAL A 105 0.380 -5.804 -13.269 1.00 0.00 C ATOM 0 H VAL A 105 -0.935 -4.564 -11.362 1.00 0.00 H new ATOM 0 HA VAL A 105 0.225 -6.916 -9.983 1.00 0.00 H new ATOM 0 HB VAL A 105 1.146 -7.429 -12.127 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -1.072 -8.038 -13.212 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -1.091 -8.327 -11.456 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -1.883 -6.883 -12.128 1.00 0.00 H new ATOM 0 HG21 VAL A 105 0.333 -6.361 -14.205 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -0.444 -5.092 -13.230 1.00 0.00 H new ATOM 0 HG23 VAL A 105 1.327 -5.267 -13.214 1.00 0.00 H new ATOM 1646 N ARG A 106 2.527 -5.982 -9.597 1.00 0.00 N ATOM 1647 CA ARG A 106 3.877 -5.498 -9.320 1.00 0.00 C ATOM 1648 C ARG A 106 4.873 -6.516 -9.871 1.00 0.00 C ATOM 1649 O ARG A 106 4.812 -7.683 -9.485 1.00 0.00 O ATOM 1650 CB ARG A 106 4.105 -5.373 -7.806 1.00 0.00 C ATOM 1651 CG ARG A 106 3.319 -4.231 -7.160 1.00 0.00 C ATOM 1652 CD ARG A 106 3.597 -4.198 -5.650 1.00 0.00 C ATOM 1653 NE ARG A 106 3.004 -3.013 -5.006 1.00 0.00 N ATOM 1654 CZ ARG A 106 3.565 -1.793 -4.936 1.00 0.00 C ATOM 1655 NH1 ARG A 106 4.763 -1.569 -5.486 1.00 0.00 N ATOM 1656 NH2 ARG A 106 2.917 -0.794 -4.328 1.00 0.00 N ATOM 0 H ARG A 106 2.303 -6.837 -9.089 1.00 0.00 H new ATOM 0 HA ARG A 106 4.009 -4.521 -9.784 1.00 0.00 H new ATOM 0 HB2 ARG A 106 3.826 -6.311 -7.326 1.00 0.00 H new ATOM 0 HB3 ARG A 106 5.168 -5.223 -7.618 1.00 0.00 H new ATOM 0 HG2 ARG A 106 3.603 -3.281 -7.612 1.00 0.00 H new ATOM 0 HG3 ARG A 106 2.252 -4.364 -7.340 1.00 0.00 H new ATOM 0 HD2 ARG A 106 3.197 -5.100 -5.188 1.00 0.00 H new ATOM 0 HD3 ARG A 106 4.674 -4.203 -5.479 1.00 0.00 H new ATOM 0 HE ARG A 106 2.087 -3.128 -4.575 1.00 0.00 H new ATOM 0 HH11 ARG A 106 5.255 -2.325 -5.961 1.00 0.00 H new ATOM 0 HH12 ARG A 106 5.184 -0.642 -5.430 1.00 0.00 H new ATOM 0 HH21 ARG A 106 1.998 -0.958 -3.918 1.00 0.00 H new ATOM 0 HH22 ARG A 106 3.342 0.132 -4.275 1.00 0.00 H new ATOM 1670 N GLU A 107 5.800 -6.085 -10.731 1.00 0.00 N ATOM 1671 CA GLU A 107 6.838 -6.952 -11.275 1.00 0.00 C ATOM 1672 C GLU A 107 8.141 -6.166 -11.377 1.00 0.00 C ATOM 1673 O GLU A 107 8.170 -5.137 -12.048 1.00 0.00 O ATOM 1674 CB GLU A 107 6.388 -7.443 -12.653 1.00 0.00 C ATOM 1675 CG GLU A 107 7.412 -8.369 -13.325 1.00 0.00 C ATOM 1676 CD GLU A 107 6.871 -8.862 -14.655 1.00 0.00 C ATOM 1677 OE1 GLU A 107 6.202 -8.054 -15.336 1.00 0.00 O ATOM 1678 OE2 GLU A 107 6.985 -10.070 -14.932 1.00 0.00 O ATOM 0 H GLU A 107 5.848 -5.123 -11.067 1.00 0.00 H new ATOM 0 HA GLU A 107 7.003 -7.813 -10.627 1.00 0.00 H new ATOM 0 HB2 GLU A 107 5.440 -7.971 -12.552 1.00 0.00 H new ATOM 0 HB3 GLU A 107 6.207 -6.583 -13.297 1.00 0.00 H new ATOM 0 HG2 GLU A 107 8.350 -7.836 -13.480 1.00 0.00 H new ATOM 0 HG3 GLU A 107 7.630 -9.216 -12.675 1.00 0.00 H new ATOM 1685 N MET A 108 9.212 -6.642 -10.730 1.00 0.00 N ATOM 1686 CA MET A 108 10.549 -6.108 -10.923 1.00 0.00 C ATOM 1687 C MET A 108 11.376 -7.092 -11.731 1.00 0.00 C ATOM 1688 O MET A 108 11.741 -8.154 -11.231 1.00 0.00 O ATOM 1689 CB MET A 108 11.217 -5.761 -9.587 1.00 0.00 C ATOM 1690 CG MET A 108 12.675 -5.304 -9.743 1.00 0.00 C ATOM 1691 SD MET A 108 13.906 -6.644 -9.772 1.00 0.00 S ATOM 1692 CE MET A 108 15.384 -5.679 -10.142 1.00 0.00 C ATOM 0 H MET A 108 9.167 -7.409 -10.059 1.00 0.00 H new ATOM 0 HA MET A 108 10.478 -5.174 -11.481 1.00 0.00 H new ATOM 0 HB2 MET A 108 10.646 -4.973 -9.096 1.00 0.00 H new ATOM 0 HB3 MET A 108 11.184 -6.633 -8.934 1.00 0.00 H new ATOM 0 HG2 MET A 108 12.763 -4.731 -10.666 1.00 0.00 H new ATOM 0 HG3 MET A 108 12.917 -4.627 -8.923 1.00 0.00 H new ATOM 0 HE1 MET A 108 16.247 -6.342 -10.198 1.00 0.00 H new ATOM 0 HE2 MET A 108 15.256 -5.169 -11.097 1.00 0.00 H new ATOM 0 HE3 MET A 108 15.544 -4.942 -9.355 1.00 0.00 H new ATOM 1702 N VAL A 109 11.775 -6.660 -12.922 1.00 0.00 N ATOM 1703 CA VAL A 109 12.925 -7.182 -13.637 1.00 0.00 C ATOM 1704 C VAL A 109 13.834 -5.980 -13.899 1.00 0.00 C ATOM 1705 O VAL A 109 13.563 -4.896 -13.369 1.00 0.00 O ATOM 1706 CB VAL A 109 12.475 -7.937 -14.901 1.00 0.00 C ATOM 1707 CG1 VAL A 109 11.735 -9.218 -14.506 1.00 0.00 C ATOM 1708 CG2 VAL A 109 11.548 -7.105 -15.790 1.00 0.00 C ATOM 0 H VAL A 109 11.292 -5.917 -13.427 1.00 0.00 H new ATOM 0 HA VAL A 109 13.483 -7.927 -13.069 1.00 0.00 H new ATOM 0 HB VAL A 109 13.380 -8.161 -15.466 1.00 0.00 H new ATOM 0 HG11 VAL A 109 11.419 -9.748 -15.405 1.00 0.00 H new ATOM 0 HG12 VAL A 109 12.399 -9.856 -13.923 1.00 0.00 H new ATOM 0 HG13 VAL A 109 10.860 -8.963 -13.909 1.00 0.00 H new ATOM 0 HG21 VAL A 109 11.263 -7.688 -16.666 1.00 0.00 H new ATOM 0 HG22 VAL A 109 10.654 -6.833 -15.229 1.00 0.00 H new ATOM 0 HG23 VAL A 109 12.066 -6.200 -16.109 1.00 0.00 H new ATOM 1718 N ASP A 110 14.909 -6.173 -14.671 1.00 0.00 N ATOM 1719 CA ASP A 110 15.853 -5.114 -15.006 1.00 0.00 C ATOM 1720 C ASP A 110 16.320 -4.428 -13.711 1.00 0.00 C ATOM 1721 O ASP A 110 16.993 -5.062 -12.899 1.00 0.00 O ATOM 1722 CB ASP A 110 15.197 -4.200 -16.056 1.00 0.00 C ATOM 1723 CG ASP A 110 16.024 -2.965 -16.367 1.00 0.00 C ATOM 1724 OD1 ASP A 110 17.015 -3.103 -17.111 1.00 0.00 O ATOM 1725 OD2 ASP A 110 15.651 -1.916 -15.794 1.00 0.00 O ATOM 0 H ASP A 110 15.145 -7.076 -15.081 1.00 0.00 H new ATOM 0 HA ASP A 110 16.767 -5.486 -15.468 1.00 0.00 H new ATOM 0 HB2 ASP A 110 15.039 -4.766 -16.974 1.00 0.00 H new ATOM 0 HB3 ASP A 110 14.214 -3.892 -15.699 1.00 0.00 H new ATOM 1730 N GLY A 111 15.893 -3.191 -13.464 1.00 0.00 N ATOM 1731 CA GLY A 111 16.076 -2.461 -12.225 1.00 0.00 C ATOM 1732 C GLY A 111 14.838 -1.613 -11.942 1.00 0.00 C ATOM 1733 O GLY A 111 14.948 -0.568 -11.302 1.00 0.00 O ATOM 0 H GLY A 111 15.385 -2.649 -14.163 1.00 0.00 H new ATOM 0 HA2 GLY A 111 16.248 -3.156 -11.404 1.00 0.00 H new ATOM 0 HA3 GLY A 111 16.958 -1.824 -12.293 1.00 0.00 H new ATOM 1737 N LYS A 112 13.662 -2.052 -12.412 1.00 0.00 N ATOM 1738 CA LYS A 112 12.423 -1.296 -12.287 1.00 0.00 C ATOM 1739 C LYS A 112 11.281 -2.223 -11.895 1.00 0.00 C ATOM 1740 O LYS A 112 10.985 -3.181 -12.603 1.00 0.00 O ATOM 1741 CB LYS A 112 12.106 -0.532 -13.585 1.00 0.00 C ATOM 1742 CG LYS A 112 13.097 0.625 -13.763 1.00 0.00 C ATOM 1743 CD LYS A 112 12.628 1.726 -14.737 1.00 0.00 C ATOM 1744 CE LYS A 112 12.977 3.056 -14.054 1.00 0.00 C ATOM 1745 NZ LYS A 112 12.816 4.288 -14.844 1.00 0.00 N ATOM 0 H LYS A 112 13.551 -2.946 -12.890 1.00 0.00 H new ATOM 0 HA LYS A 112 12.547 -0.554 -11.498 1.00 0.00 H new ATOM 0 HB2 LYS A 112 12.164 -1.207 -14.439 1.00 0.00 H new ATOM 0 HB3 LYS A 112 11.087 -0.148 -13.552 1.00 0.00 H new ATOM 0 HG2 LYS A 112 13.288 1.076 -12.789 1.00 0.00 H new ATOM 0 HG3 LYS A 112 14.045 0.223 -14.119 1.00 0.00 H new ATOM 0 HD2 LYS A 112 13.129 1.637 -15.701 1.00 0.00 H new ATOM 0 HD3 LYS A 112 11.557 1.652 -14.927 1.00 0.00 H new ATOM 0 HE2 LYS A 112 12.361 3.147 -13.160 1.00 0.00 H new ATOM 0 HE3 LYS A 112 14.014 3.002 -13.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 12.987 5.115 -14.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 13.498 4.289 -15.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 11.849 4.332 -15.225 1.00 0.00 H new ATOM 1759 N LEU A 113 10.645 -1.912 -10.763 1.00 0.00 N ATOM 1760 CA LEU A 113 9.404 -2.514 -10.320 1.00 0.00 C ATOM 1761 C LEU A 113 8.289 -1.829 -11.112 1.00 0.00 C ATOM 1762 O LEU A 113 7.814 -0.755 -10.745 1.00 0.00 O ATOM 1763 CB LEU A 113 9.318 -2.378 -8.792 1.00 0.00 C ATOM 1764 CG LEU A 113 8.197 -3.191 -8.122 1.00 0.00 C ATOM 1765 CD1 LEU A 113 8.370 -3.154 -6.597 1.00 0.00 C ATOM 1766 CD2 LEU A 113 6.802 -2.665 -8.474 1.00 0.00 C ATOM 0 H LEU A 113 10.999 -1.209 -10.114 1.00 0.00 H new ATOM 0 HA LEU A 113 9.323 -3.584 -10.512 1.00 0.00 H new ATOM 0 HB2 LEU A 113 10.272 -2.683 -8.362 1.00 0.00 H new ATOM 0 HB3 LEU A 113 9.179 -1.326 -8.545 1.00 0.00 H new ATOM 0 HG LEU A 113 8.276 -4.212 -8.496 1.00 0.00 H new ATOM 0 HD11 LEU A 113 7.574 -3.731 -6.126 1.00 0.00 H new ATOM 0 HD12 LEU A 113 9.336 -3.583 -6.330 1.00 0.00 H new ATOM 0 HD13 LEU A 113 8.323 -2.122 -6.250 1.00 0.00 H new ATOM 0 HD21 LEU A 113 6.047 -3.274 -7.976 1.00 0.00 H new ATOM 0 HD22 LEU A 113 6.709 -1.630 -8.144 1.00 0.00 H new ATOM 0 HD23 LEU A 113 6.655 -2.716 -9.553 1.00 0.00 H new ATOM 1778 N ILE A 114 7.919 -2.426 -12.243 1.00 0.00 N ATOM 1779 CA ILE A 114 6.845 -1.960 -13.103 1.00 0.00 C ATOM 1780 C ILE A 114 5.525 -2.273 -12.399 1.00 0.00 C ATOM 1781 O ILE A 114 5.394 -3.347 -11.801 1.00 0.00 O ATOM 1782 CB ILE A 114 6.950 -2.647 -14.481 1.00 0.00 C ATOM 1783 CG1 ILE A 114 8.287 -2.275 -15.154 1.00 0.00 C ATOM 1784 CG2 ILE A 114 5.767 -2.258 -15.382 1.00 0.00 C ATOM 1785 CD1 ILE A 114 8.573 -3.097 -16.415 1.00 0.00 C ATOM 0 H ILE A 114 8.373 -3.270 -12.592 1.00 0.00 H new ATOM 0 HA ILE A 114 6.907 -0.886 -13.280 1.00 0.00 H new ATOM 0 HB ILE A 114 6.916 -3.726 -14.332 1.00 0.00 H new ATOM 0 HG12 ILE A 114 8.275 -1.216 -15.412 1.00 0.00 H new ATOM 0 HG13 ILE A 114 9.099 -2.420 -14.441 1.00 0.00 H new ATOM 0 HG21 ILE A 114 5.865 -2.756 -16.347 1.00 0.00 H new ATOM 0 HG22 ILE A 114 4.834 -2.564 -14.909 1.00 0.00 H new ATOM 0 HG23 ILE A 114 5.762 -1.178 -15.530 1.00 0.00 H new ATOM 0 HD11 ILE A 114 9.527 -2.788 -16.842 1.00 0.00 H new ATOM 0 HD12 ILE A 114 8.616 -4.155 -16.157 1.00 0.00 H new ATOM 0 HD13 ILE A 114 7.779 -2.933 -17.144 1.00 0.00 H new ATOM 1797 N LEU A 115 4.564 -1.338 -12.443 1.00 0.00 N ATOM 1798 CA LEU A 115 3.288 -1.511 -11.773 1.00 0.00 C ATOM 1799 C LEU A 115 2.138 -0.971 -12.629 1.00 0.00 C ATOM 1800 O LEU A 115 1.932 0.240 -12.720 1.00 0.00 O ATOM 1801 CB LEU A 115 3.373 -0.880 -10.381 1.00 0.00 C ATOM 1802 CG LEU A 115 2.284 -1.329 -9.394 1.00 0.00 C ATOM 1803 CD1 LEU A 115 2.609 -0.753 -8.020 1.00 0.00 C ATOM 1804 CD2 LEU A 115 0.875 -0.876 -9.780 1.00 0.00 C ATOM 0 H LEU A 115 4.658 -0.453 -12.941 1.00 0.00 H new ATOM 0 HA LEU A 115 3.068 -2.570 -11.640 1.00 0.00 H new ATOM 0 HB2 LEU A 115 4.348 -1.113 -9.953 1.00 0.00 H new ATOM 0 HB3 LEU A 115 3.321 0.204 -10.487 1.00 0.00 H new ATOM 0 HG LEU A 115 2.283 -2.419 -9.401 1.00 0.00 H new ATOM 0 HD11 LEU A 115 1.845 -1.062 -7.306 1.00 0.00 H new ATOM 0 HD12 LEU A 115 3.582 -1.120 -7.692 1.00 0.00 H new ATOM 0 HD13 LEU A 115 2.632 0.335 -8.078 1.00 0.00 H new ATOM 0 HD21 LEU A 115 0.162 -1.231 -9.036 1.00 0.00 H new ATOM 0 HD22 LEU A 115 0.842 0.213 -9.824 1.00 0.00 H new ATOM 0 HD23 LEU A 115 0.615 -1.286 -10.756 1.00 0.00 H new ATOM 1816 N THR A 116 1.370 -1.878 -13.234 1.00 0.00 N ATOM 1817 CA THR A 116 0.197 -1.543 -14.030 1.00 0.00 C ATOM 1818 C THR A 116 -1.042 -1.649 -13.143 1.00 0.00 C ATOM 1819 O THR A 116 -1.171 -2.611 -12.379 1.00 0.00 O ATOM 1820 CB THR A 116 0.105 -2.483 -15.241 1.00 0.00 C ATOM 1821 OG1 THR A 116 1.331 -2.443 -15.945 1.00 0.00 O ATOM 1822 CG2 THR A 116 -1.032 -2.079 -16.187 1.00 0.00 C ATOM 0 H THR A 116 1.551 -2.880 -13.182 1.00 0.00 H new ATOM 0 HA THR A 116 0.271 -0.524 -14.409 1.00 0.00 H new ATOM 0 HB THR A 116 -0.101 -3.490 -14.878 1.00 0.00 H new ATOM 0 HG1 THR A 116 1.283 -3.041 -16.720 1.00 0.00 H new ATOM 0 HG21 THR A 116 -1.065 -2.768 -17.031 1.00 0.00 H new ATOM 0 HG22 THR A 116 -1.981 -2.115 -15.652 1.00 0.00 H new ATOM 0 HG23 THR A 116 -0.860 -1.066 -16.551 1.00 0.00 H new ATOM 1830 N LEU A 117 -1.940 -0.663 -13.247 1.00 0.00 N ATOM 1831 CA LEU A 117 -3.216 -0.648 -12.556 1.00 0.00 C ATOM 1832 C LEU A 117 -4.318 -0.723 -13.614 1.00 0.00 C ATOM 1833 O LEU A 117 -4.396 0.162 -14.471 1.00 0.00 O ATOM 1834 CB LEU A 117 -3.376 0.621 -11.704 1.00 0.00 C ATOM 1835 CG LEU A 117 -2.183 0.989 -10.801 1.00 0.00 C ATOM 1836 CD1 LEU A 117 -1.110 1.776 -11.571 1.00 0.00 C ATOM 1837 CD2 LEU A 117 -2.651 1.854 -9.621 1.00 0.00 C ATOM 0 H LEU A 117 -1.788 0.161 -13.829 1.00 0.00 H new ATOM 0 HA LEU A 117 -3.277 -1.498 -11.876 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -3.572 1.460 -12.372 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -4.258 0.502 -11.075 1.00 0.00 H new ATOM 0 HG LEU A 117 -1.756 0.052 -10.444 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -0.285 2.017 -10.901 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -0.740 1.172 -12.399 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -1.543 2.698 -11.959 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -1.796 2.105 -8.993 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -3.105 2.770 -9.999 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -3.384 1.301 -9.033 1.00 0.00 H new ATOM 1849 N THR A 118 -5.159 -1.759 -13.569 1.00 0.00 N ATOM 1850 CA THR A 118 -6.274 -1.897 -14.501 1.00 0.00 C ATOM 1851 C THR A 118 -7.583 -2.090 -13.737 1.00 0.00 C ATOM 1852 O THR A 118 -7.697 -2.990 -12.906 1.00 0.00 O ATOM 1853 CB THR A 118 -5.987 -3.037 -15.484 1.00 0.00 C ATOM 1854 OG1 THR A 118 -4.698 -2.865 -16.033 1.00 0.00 O ATOM 1855 CG2 THR A 118 -6.977 -3.032 -16.648 1.00 0.00 C ATOM 0 H THR A 118 -5.085 -2.518 -12.891 1.00 0.00 H new ATOM 0 HA THR A 118 -6.385 -0.984 -15.086 1.00 0.00 H new ATOM 0 HB THR A 118 -6.071 -3.975 -14.935 1.00 0.00 H new ATOM 0 HG1 THR A 118 -4.510 -3.593 -16.661 1.00 0.00 H new ATOM 0 HG21 THR A 118 -6.745 -3.853 -17.326 1.00 0.00 H new ATOM 0 HG22 THR A 118 -7.990 -3.153 -16.265 1.00 0.00 H new ATOM 0 HG23 THR A 118 -6.903 -2.086 -17.185 1.00 0.00 H new ATOM 1863 N HIS A 119 -8.571 -1.236 -14.018 1.00 0.00 N ATOM 1864 CA HIS A 119 -9.906 -1.270 -13.444 1.00 0.00 C ATOM 1865 C HIS A 119 -10.898 -1.207 -14.608 1.00 0.00 C ATOM 1866 O HIS A 119 -10.525 -0.852 -15.722 1.00 0.00 O ATOM 1867 CB HIS A 119 -10.030 -0.059 -12.505 1.00 0.00 C ATOM 1868 CG HIS A 119 -11.419 0.314 -12.051 1.00 0.00 C ATOM 1869 ND1 HIS A 119 -12.304 -0.482 -11.345 1.00 0.00 N ATOM 1870 CD2 HIS A 119 -12.042 1.501 -12.331 1.00 0.00 C ATOM 1871 CE1 HIS A 119 -13.457 0.211 -11.232 1.00 0.00 C ATOM 1872 NE2 HIS A 119 -13.320 1.412 -11.825 1.00 0.00 N ATOM 0 H HIS A 119 -8.450 -0.471 -14.682 1.00 0.00 H new ATOM 0 HA HIS A 119 -10.107 -2.173 -12.867 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -9.425 -0.253 -11.620 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -9.594 0.805 -13.006 1.00 0.00 H new ATOM 0 HD1 HIS A 119 -12.120 -1.416 -10.979 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -11.613 2.346 -12.850 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -14.352 -0.143 -10.741 1.00 0.00 H new ATOM 1881 N GLY A 120 -12.170 -1.529 -14.359 1.00 0.00 N ATOM 1882 CA GLY A 120 -13.229 -1.268 -15.321 1.00 0.00 C ATOM 1883 C GLY A 120 -13.144 0.179 -15.812 1.00 0.00 C ATOM 1884 O GLY A 120 -13.096 1.105 -15.002 1.00 0.00 O ATOM 0 H GLY A 120 -12.486 -1.971 -13.496 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -13.142 -1.953 -16.165 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -14.201 -1.449 -14.862 1.00 0.00 H new ATOM 1888 N THR A 121 -13.086 0.374 -17.130 1.00 0.00 N ATOM 1889 CA THR A 121 -12.946 1.670 -17.782 1.00 0.00 C ATOM 1890 C THR A 121 -11.522 2.235 -17.649 1.00 0.00 C ATOM 1891 O THR A 121 -10.872 2.499 -18.658 1.00 0.00 O ATOM 1892 CB THR A 121 -14.094 2.639 -17.393 1.00 0.00 C ATOM 1893 OG1 THR A 121 -14.673 3.175 -18.563 1.00 0.00 O ATOM 1894 CG2 THR A 121 -13.723 3.842 -16.523 1.00 0.00 C ATOM 0 H THR A 121 -13.137 -0.398 -17.795 1.00 0.00 H new ATOM 0 HA THR A 121 -13.069 1.529 -18.856 1.00 0.00 H new ATOM 0 HB THR A 121 -14.758 2.010 -16.800 1.00 0.00 H new ATOM 0 HG1 THR A 121 -15.399 3.786 -18.318 1.00 0.00 H new ATOM 0 HG21 THR A 121 -14.615 4.437 -16.325 1.00 0.00 H new ATOM 0 HG22 THR A 121 -13.302 3.493 -15.580 1.00 0.00 H new ATOM 0 HG23 THR A 121 -12.987 4.455 -17.044 1.00 0.00 H new ATOM 1902 N ALA A 122 -11.028 2.435 -16.423 1.00 0.00 N ATOM 1903 CA ALA A 122 -9.783 3.162 -16.199 1.00 0.00 C ATOM 1904 C ALA A 122 -8.564 2.232 -16.236 1.00 0.00 C ATOM 1905 O ALA A 122 -8.544 1.191 -15.578 1.00 0.00 O ATOM 1906 CB ALA A 122 -9.861 3.941 -14.887 1.00 0.00 C ATOM 0 H ALA A 122 -11.476 2.101 -15.570 1.00 0.00 H new ATOM 0 HA ALA A 122 -9.652 3.874 -17.014 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -8.927 4.481 -14.728 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -10.687 4.651 -14.934 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -10.025 3.248 -14.062 1.00 0.00 H new ATOM 1912 N VAL A 123 -7.522 2.642 -16.966 1.00 0.00 N ATOM 1913 CA VAL A 123 -6.245 1.947 -17.096 1.00 0.00 C ATOM 1914 C VAL A 123 -5.143 2.960 -16.782 1.00 0.00 C ATOM 1915 O VAL A 123 -5.217 4.106 -17.232 1.00 0.00 O ATOM 1916 CB VAL A 123 -6.128 1.338 -18.505 1.00 0.00 C ATOM 1917 CG1 VAL A 123 -6.124 2.383 -19.631 1.00 0.00 C ATOM 1918 CG2 VAL A 123 -4.876 0.461 -18.613 1.00 0.00 C ATOM 0 H VAL A 123 -7.551 3.507 -17.505 1.00 0.00 H new ATOM 0 HA VAL A 123 -6.157 1.113 -16.399 1.00 0.00 H new ATOM 0 HB VAL A 123 -7.024 0.732 -18.640 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -6.039 1.880 -20.594 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -7.052 2.954 -19.601 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -5.278 3.058 -19.498 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -4.812 0.040 -19.616 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -3.990 1.065 -18.416 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -4.934 -0.347 -17.884 1.00 0.00 H new ATOM 1928 N CYS A 124 -4.193 2.616 -15.903 1.00 0.00 N ATOM 1929 CA CYS A 124 -3.211 3.566 -15.382 1.00 0.00 C ATOM 1930 C CYS A 124 -1.891 2.836 -15.129 1.00 0.00 C ATOM 1931 O CYS A 124 -1.893 1.613 -14.977 1.00 0.00 O ATOM 1932 CB CYS A 124 -3.730 4.205 -14.081 1.00 0.00 C ATOM 1933 SG CYS A 124 -5.499 4.625 -14.146 1.00 0.00 S ATOM 0 H CYS A 124 -4.086 1.671 -15.535 1.00 0.00 H new ATOM 0 HA CYS A 124 -3.049 4.360 -16.111 1.00 0.00 H new ATOM 0 HB2 CYS A 124 -3.556 3.519 -13.252 1.00 0.00 H new ATOM 0 HB3 CYS A 124 -3.156 5.108 -13.873 1.00 0.00 H new ATOM 0 HG CYS A 124 -5.638 5.917 -14.171 1.00 0.00 H new ATOM 1939 N THR A 125 -0.770 3.563 -15.072 1.00 0.00 N ATOM 1940 CA THR A 125 0.549 2.965 -14.882 1.00 0.00 C ATOM 1941 C THR A 125 1.345 3.735 -13.834 1.00 0.00 C ATOM 1942 O THR A 125 1.159 4.940 -13.662 1.00 0.00 O ATOM 1943 CB THR A 125 1.322 2.927 -16.213 1.00 0.00 C ATOM 1944 OG1 THR A 125 1.478 4.224 -16.746 1.00 0.00 O ATOM 1945 CG2 THR A 125 0.611 2.072 -17.260 1.00 0.00 C ATOM 0 H THR A 125 -0.755 4.579 -15.156 1.00 0.00 H new ATOM 0 HA THR A 125 0.410 1.943 -14.529 1.00 0.00 H new ATOM 0 HB THR A 125 2.295 2.491 -15.987 1.00 0.00 H new ATOM 0 HG1 THR A 125 2.132 4.721 -16.212 1.00 0.00 H new ATOM 0 HG21 THR A 125 1.190 2.072 -18.184 1.00 0.00 H new ATOM 0 HG22 THR A 125 0.515 1.051 -16.892 1.00 0.00 H new ATOM 0 HG23 THR A 125 -0.380 2.482 -17.453 1.00 0.00 H new ATOM 1953 N ARG A 126 2.253 3.034 -13.152 1.00 0.00 N ATOM 1954 CA ARG A 126 3.395 3.652 -12.513 1.00 0.00 C ATOM 1955 C ARG A 126 4.581 2.693 -12.604 1.00 0.00 C ATOM 1956 O ARG A 126 4.423 1.515 -12.931 1.00 0.00 O ATOM 1957 CB ARG A 126 3.074 4.086 -11.075 1.00 0.00 C ATOM 1958 CG ARG A 126 2.605 2.945 -10.179 1.00 0.00 C ATOM 1959 CD ARG A 126 2.249 3.489 -8.793 1.00 0.00 C ATOM 1960 NE ARG A 126 1.352 2.576 -8.071 1.00 0.00 N ATOM 1961 CZ ARG A 126 1.045 2.665 -6.768 1.00 0.00 C ATOM 1962 NH1 ARG A 126 1.686 3.538 -5.985 1.00 0.00 N ATOM 1963 NH2 ARG A 126 0.100 1.869 -6.254 1.00 0.00 N ATOM 0 H ARG A 126 2.209 2.022 -13.033 1.00 0.00 H new ATOM 0 HA ARG A 126 3.660 4.573 -13.032 1.00 0.00 H new ATOM 0 HB2 ARG A 126 3.962 4.540 -10.635 1.00 0.00 H new ATOM 0 HB3 ARG A 126 2.303 4.856 -11.101 1.00 0.00 H new ATOM 0 HG2 ARG A 126 1.738 2.455 -10.622 1.00 0.00 H new ATOM 0 HG3 ARG A 126 3.388 2.191 -10.094 1.00 0.00 H new ATOM 0 HD2 ARG A 126 3.161 3.639 -8.214 1.00 0.00 H new ATOM 0 HD3 ARG A 126 1.773 4.464 -8.895 1.00 0.00 H new ATOM 0 HE ARG A 126 0.930 1.815 -8.602 1.00 0.00 H new ATOM 0 HH11 ARG A 126 2.411 4.139 -6.378 1.00 0.00 H new ATOM 0 HH12 ARG A 126 1.450 3.603 -4.995 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -0.383 1.199 -6.852 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -0.137 1.933 -5.264 1.00 0.00 H new ATOM 1977 N THR A 127 5.775 3.197 -12.304 1.00 0.00 N ATOM 1978 CA THR A 127 6.973 2.390 -12.203 1.00 0.00 C ATOM 1979 C THR A 127 7.711 2.865 -10.958 1.00 0.00 C ATOM 1980 O THR A 127 7.611 4.041 -10.599 1.00 0.00 O ATOM 1981 CB THR A 127 7.817 2.487 -13.487 1.00 0.00 C ATOM 1982 OG1 THR A 127 8.215 3.820 -13.751 1.00 0.00 O ATOM 1983 CG2 THR A 127 7.083 1.927 -14.715 1.00 0.00 C ATOM 0 H THR A 127 5.933 4.188 -12.123 1.00 0.00 H new ATOM 0 HA THR A 127 6.739 1.330 -12.105 1.00 0.00 H new ATOM 0 HB THR A 127 8.702 1.877 -13.307 1.00 0.00 H new ATOM 0 HG1 THR A 127 8.750 3.845 -14.572 1.00 0.00 H new ATOM 0 HG21 THR A 127 7.721 2.019 -15.594 1.00 0.00 H new ATOM 0 HG22 THR A 127 6.844 0.877 -14.548 1.00 0.00 H new ATOM 0 HG23 THR A 127 6.162 2.487 -14.875 1.00 0.00 H new ATOM 1991 N TYR A 128 8.385 1.939 -10.278 1.00 0.00 N ATOM 1992 CA TYR A 128 9.104 2.160 -9.037 1.00 0.00 C ATOM 1993 C TYR A 128 10.567 1.762 -9.238 1.00 0.00 C ATOM 1994 O TYR A 128 10.851 0.664 -9.717 1.00 0.00 O ATOM 1995 CB TYR A 128 8.451 1.327 -7.928 1.00 0.00 C ATOM 1996 CG TYR A 128 7.321 2.003 -7.181 1.00 0.00 C ATOM 1997 CD1 TYR A 128 7.617 2.856 -6.104 1.00 0.00 C ATOM 1998 CD2 TYR A 128 5.986 1.646 -7.443 1.00 0.00 C ATOM 1999 CE1 TYR A 128 6.586 3.344 -5.284 1.00 0.00 C ATOM 2000 CE2 TYR A 128 4.959 2.105 -6.600 1.00 0.00 C ATOM 2001 CZ TYR A 128 5.260 2.958 -5.527 1.00 0.00 C ATOM 2002 OH TYR A 128 4.261 3.345 -4.685 1.00 0.00 O ATOM 0 H TYR A 128 8.444 0.972 -10.597 1.00 0.00 H new ATOM 0 HA TYR A 128 9.065 3.210 -8.748 1.00 0.00 H new ATOM 0 HB2 TYR A 128 8.072 0.404 -8.367 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.220 1.045 -7.209 1.00 0.00 H new ATOM 0 HD1 TYR A 128 8.641 3.137 -5.906 1.00 0.00 H new ATOM 0 HD2 TYR A 128 5.750 1.020 -8.291 1.00 0.00 H new ATOM 0 HE1 TYR A 128 6.814 4.015 -4.469 1.00 0.00 H new ATOM 0 HE2 TYR A 128 3.938 1.801 -6.778 1.00 0.00 H new ATOM 0 HH TYR A 128 3.725 2.564 -4.433 1.00 0.00 H new ATOM 2012 N GLU A 129 11.489 2.648 -8.863 1.00 0.00 N ATOM 2013 CA GLU A 129 12.926 2.430 -8.923 1.00 0.00 C ATOM 2014 C GLU A 129 13.438 2.208 -7.508 1.00 0.00 C ATOM 2015 O GLU A 129 13.059 2.939 -6.592 1.00 0.00 O ATOM 2016 CB GLU A 129 13.610 3.670 -9.492 1.00 0.00 C ATOM 2017 CG GLU A 129 13.238 3.942 -10.942 1.00 0.00 C ATOM 2018 CD GLU A 129 13.771 5.277 -11.446 1.00 0.00 C ATOM 2019 OE1 GLU A 129 14.280 6.044 -10.591 1.00 0.00 O ATOM 2020 OE2 GLU A 129 13.658 5.499 -12.672 1.00 0.00 O ATOM 0 H GLU A 129 11.243 3.568 -8.497 1.00 0.00 H new ATOM 0 HA GLU A 129 13.140 1.568 -9.555 1.00 0.00 H new ATOM 0 HB2 GLU A 129 13.343 4.536 -8.886 1.00 0.00 H new ATOM 0 HB3 GLU A 129 14.691 3.549 -9.417 1.00 0.00 H new ATOM 0 HG2 GLU A 129 13.627 3.140 -11.569 1.00 0.00 H new ATOM 0 HG3 GLU A 129 12.153 3.927 -11.043 1.00 0.00 H new ATOM 2027 N LYS A 130 14.320 1.228 -7.327 1.00 0.00 N ATOM 2028 CA LYS A 130 14.855 0.896 -6.019 1.00 0.00 C ATOM 2029 C LYS A 130 15.700 2.053 -5.468 1.00 0.00 C ATOM 2030 O LYS A 130 16.487 2.648 -6.202 1.00 0.00 O ATOM 2031 CB LYS A 130 15.681 -0.396 -6.126 1.00 0.00 C ATOM 2032 CG LYS A 130 15.636 -1.163 -4.806 1.00 0.00 C ATOM 2033 CD LYS A 130 16.503 -2.428 -4.842 1.00 0.00 C ATOM 2034 CE LYS A 130 16.030 -3.306 -3.679 1.00 0.00 C ATOM 2035 NZ LYS A 130 16.825 -4.530 -3.460 1.00 0.00 N ATOM 0 H LYS A 130 14.680 0.646 -8.084 1.00 0.00 H new ATOM 0 HA LYS A 130 14.034 0.734 -5.321 1.00 0.00 H new ATOM 0 HB2 LYS A 130 15.291 -1.020 -6.931 1.00 0.00 H new ATOM 0 HB3 LYS A 130 16.713 -0.156 -6.380 1.00 0.00 H new ATOM 0 HG2 LYS A 130 15.976 -0.514 -3.999 1.00 0.00 H new ATOM 0 HG3 LYS A 130 14.605 -1.437 -4.582 1.00 0.00 H new ATOM 0 HD2 LYS A 130 16.392 -2.949 -5.793 1.00 0.00 H new ATOM 0 HD3 LYS A 130 17.559 -2.179 -4.737 1.00 0.00 H new ATOM 0 HE2 LYS A 130 16.045 -2.712 -2.765 1.00 0.00 H new ATOM 0 HE3 LYS A 130 14.993 -3.591 -3.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 16.374 -5.110 -2.723 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 16.876 -5.074 -4.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 17.785 -4.271 -3.157 1.00 0.00 H new ATOM 2049 N GLN A 131 15.565 2.338 -4.169 1.00 0.00 N ATOM 2050 CA GLN A 131 16.560 3.073 -3.387 1.00 0.00 C ATOM 2051 C GLN A 131 17.022 2.273 -2.158 1.00 0.00 C ATOM 2052 O GLN A 131 17.940 2.695 -1.462 1.00 0.00 O ATOM 2053 CB GLN A 131 16.058 4.478 -3.031 1.00 0.00 C ATOM 2054 CG GLN A 131 14.889 4.471 -2.045 1.00 0.00 C ATOM 2055 CD GLN A 131 14.307 5.866 -1.854 1.00 0.00 C ATOM 2056 OE1 GLN A 131 13.223 6.179 -2.556 1.00 0.00 O flip ATOM 2057 NE2 GLN A 131 14.820 6.663 -1.078 1.00 0.00 N flip ATOM 0 H GLN A 131 14.749 2.060 -3.625 1.00 0.00 H new ATOM 0 HA GLN A 131 17.445 3.206 -4.009 1.00 0.00 H new ATOM 0 HB2 GLN A 131 16.880 5.053 -2.605 1.00 0.00 H new ATOM 0 HB3 GLN A 131 15.751 4.989 -3.944 1.00 0.00 H new ATOM 0 HG2 GLN A 131 14.111 3.798 -2.407 1.00 0.00 H new ATOM 0 HG3 GLN A 131 15.225 4.082 -1.084 1.00 0.00 H new ATOM 0 HE21 GLN A 131 15.652 6.398 -0.551 1.00 0.00 H new ATOM 0 HE22 GLN A 131 14.415 7.592 -0.959 1.00 0.00 H new ATOM 2066 N ALA A 132 16.406 1.116 -1.883 1.00 0.00 N ATOM 2067 CA ALA A 132 16.825 0.181 -0.847 1.00 0.00 C ATOM 2068 C ALA A 132 16.697 0.809 0.538 1.00 0.00 C ATOM 2069 O ALA A 132 15.651 0.641 1.163 1.00 0.00 O ATOM 2070 CB ALA A 132 18.236 -0.359 -1.114 1.00 0.00 C ATOM 2071 OXT ALA A 132 17.730 1.548 1.077 1.00 0.00 O ATOM 0 H ALA A 132 15.580 0.802 -2.393 1.00 0.00 H new ATOM 0 HA ALA A 132 16.154 -0.677 -0.875 1.00 0.00 H new ATOM 0 HB1 ALA A 132 18.516 -1.053 -0.322 1.00 0.00 H new ATOM 0 HB2 ALA A 132 18.252 -0.877 -2.073 1.00 0.00 H new ATOM 0 HB3 ALA A 132 18.944 0.469 -1.138 1.00 0.00 H new