USER MOD reduce.3.24.130724 H: found=0, std=0, add=659, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 660 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 83 MET CE :methyl 164:sc= -10.5! (180deg=-11.4!) USER MOD Set 1.2: A 118 THR OG1 : rot 180:sc= -1.95! USER MOD Set 2.1: A 111 GLN : amide:sc= -3.21! C(o=-9.7!,f=-15!) USER MOD Set 2.2: A 113 MET CE :methyl -142:sc= -6.45! (180deg=-7.78!) USER MOD Set 3.1: A 41 THR OG1 : rot -40:sc= -1.36! USER MOD Set 3.2: A 79 THR OG1 : rot 77:sc= 1.6 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 ASN : amide:sc= -0.441 K(o=-0.44,f=-2.6!) USER MOD Single : A 43 TYR OH : rot 180:sc= 0.101 USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl -146:sc= -0.283 (180deg=-2.07!) USER MOD Single : A 50 THR OG1 : rot 180:sc= -0.177 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 173:sc= -1.14 USER MOD Single : A 63 ASN : amide:sc= 0 X(o=0,f=-0.0054) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 MET CE :methyl -103:sc= -5.82! (180deg=-10.5!) USER MOD Single : A 74 ASN : amide:sc= -0.0049 K(o=-0.0049,f=-1.6!) USER MOD Single : A 75 CYS SG : rot 102:sc= -3.67! USER MOD Single : A 80 TYR OH : rot -9:sc= -6.28! USER MOD Single : A 82 LYS NZ :NH3+ -162:sc= -0.113 (180deg=-0.733) USER MOD Single : A 85 SER OG : rot -104:sc= -1.02! USER MOD Single : A 88 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 94 ASN : amide:sc= -0.222 K(o=-0.22,f=-3.4!) USER MOD Single : A 96 THR OG1 : rot -93:sc= 0.98 USER MOD Single : A 97 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 100 SER OG : rot 1:sc= 1.21 USER MOD Single : A 102 GLN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 ASN : amide:sc= -2.23! C(o=-2.2!,f=-4.2!) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 LYS NZ :NH3+ 161:sc= 0.684 (180deg=-0.0404) USER MOD Single : A 121 SER OG : rot 16:sc= 1! USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 35 27.932 28.357 26.233 1.00 0.00 N ATOM 2 CA ALA A 35 27.998 27.208 25.286 1.00 0.00 C ATOM 3 C ALA A 35 26.583 26.715 24.983 1.00 0.00 C ATOM 4 O ALA A 35 25.943 26.091 25.807 1.00 0.00 O ATOM 5 CB ALA A 35 28.811 26.074 25.916 1.00 0.00 C ATOM 0 HA ALA A 35 28.477 27.527 24.360 1.00 0.00 H new ATOM 0 HB1 ALA A 35 28.860 25.233 25.224 1.00 0.00 H new ATOM 0 HB2 ALA A 35 29.820 26.426 26.131 1.00 0.00 H new ATOM 0 HB3 ALA A 35 28.333 25.754 26.842 1.00 0.00 H new ATOM 11 N PRO A 36 26.086 27.003 23.771 1.00 0.00 N ATOM 12 CA PRO A 36 24.742 26.594 23.345 1.00 0.00 C ATOM 13 C PRO A 36 24.648 25.078 23.143 1.00 0.00 C ATOM 14 O PRO A 36 25.612 24.428 22.795 1.00 0.00 O ATOM 15 CB PRO A 36 24.557 27.312 22.008 1.00 0.00 C ATOM 16 CG PRO A 36 25.944 27.532 21.506 1.00 0.00 C ATOM 17 CD PRO A 36 26.798 27.753 22.721 1.00 0.00 C ATOM 0 HA PRO A 36 23.983 26.844 24.086 1.00 0.00 H new ATOM 0 HB2 PRO A 36 23.974 26.710 21.311 1.00 0.00 H new ATOM 0 HB3 PRO A 36 24.027 28.256 22.135 1.00 0.00 H new ATOM 0 HG2 PRO A 36 26.293 26.671 20.936 1.00 0.00 H new ATOM 0 HG3 PRO A 36 25.985 28.393 20.839 1.00 0.00 H new ATOM 0 HD2 PRO A 36 27.811 27.379 22.575 1.00 0.00 H new ATOM 0 HD3 PRO A 36 26.882 28.811 22.968 1.00 0.00 H new ATOM 25 N ARG A 37 23.492 24.513 23.357 1.00 0.00 N ATOM 26 CA ARG A 37 23.338 23.043 23.177 1.00 0.00 C ATOM 27 C ARG A 37 22.645 22.761 21.842 1.00 0.00 C ATOM 28 O ARG A 37 22.542 21.629 21.413 1.00 0.00 O ATOM 29 CB ARG A 37 22.494 22.473 24.320 1.00 0.00 C ATOM 30 CG ARG A 37 23.247 22.642 25.641 1.00 0.00 C ATOM 31 CD ARG A 37 22.506 21.892 26.750 1.00 0.00 C ATOM 32 NE ARG A 37 21.117 22.420 26.862 1.00 0.00 N ATOM 33 CZ ARG A 37 20.289 21.899 27.727 1.00 0.00 C ATOM 34 NH1 ARG A 37 20.440 22.138 29.001 1.00 0.00 N ATOM 35 NH2 ARG A 37 19.310 21.139 27.316 1.00 0.00 N ATOM 0 H ARG A 37 22.648 25.006 23.649 1.00 0.00 H new ATOM 0 HA ARG A 37 24.321 22.573 23.182 1.00 0.00 H new ATOM 0 HB2 ARG A 37 21.533 22.986 24.368 1.00 0.00 H new ATOM 0 HB3 ARG A 37 22.284 21.419 24.141 1.00 0.00 H new ATOM 0 HG2 ARG A 37 24.263 22.259 25.544 1.00 0.00 H new ATOM 0 HG3 ARG A 37 23.328 23.699 25.893 1.00 0.00 H new ATOM 0 HD2 ARG A 37 22.484 20.825 26.531 1.00 0.00 H new ATOM 0 HD3 ARG A 37 23.030 22.012 27.698 1.00 0.00 H new ATOM 0 HE ARG A 37 20.813 23.188 26.263 1.00 0.00 H new ATOM 0 HH11 ARG A 37 21.205 22.732 29.321 1.00 0.00 H new ATOM 0 HH12 ARG A 37 19.793 21.731 29.676 1.00 0.00 H new ATOM 0 HH21 ARG A 37 19.193 20.953 26.320 1.00 0.00 H new ATOM 0 HH22 ARG A 37 18.663 20.732 27.991 1.00 0.00 H new ATOM 49 N LYS A 38 22.171 23.780 21.180 1.00 0.00 N ATOM 50 CA LYS A 38 21.487 23.567 19.873 1.00 0.00 C ATOM 51 C LYS A 38 22.515 23.140 18.824 1.00 0.00 C ATOM 52 O LYS A 38 23.670 22.914 19.129 1.00 0.00 O ATOM 53 CB LYS A 38 20.816 24.868 19.428 1.00 0.00 C ATOM 54 CG LYS A 38 19.971 25.423 20.576 1.00 0.00 C ATOM 55 CD LYS A 38 19.292 26.720 20.129 1.00 0.00 C ATOM 56 CE LYS A 38 18.388 27.234 21.251 1.00 0.00 C ATOM 57 NZ LYS A 38 19.201 28.011 22.228 1.00 0.00 N ATOM 0 H LYS A 38 22.228 24.751 21.487 1.00 0.00 H new ATOM 0 HA LYS A 38 20.732 22.788 19.982 1.00 0.00 H new ATOM 0 HB2 LYS A 38 21.571 25.597 19.132 1.00 0.00 H new ATOM 0 HB3 LYS A 38 20.189 24.687 18.555 1.00 0.00 H new ATOM 0 HG2 LYS A 38 19.220 24.692 20.876 1.00 0.00 H new ATOM 0 HG3 LYS A 38 20.599 25.610 21.447 1.00 0.00 H new ATOM 0 HD2 LYS A 38 20.043 27.470 19.880 1.00 0.00 H new ATOM 0 HD3 LYS A 38 18.706 26.544 19.227 1.00 0.00 H new ATOM 0 HE2 LYS A 38 17.599 27.862 20.838 1.00 0.00 H new ATOM 0 HE3 LYS A 38 17.900 26.397 21.752 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 18.586 28.360 22.991 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 19.939 27.398 22.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 19.646 28.817 21.745 1.00 0.00 H new ATOM 71 N GLY A 39 22.108 23.030 17.589 1.00 0.00 N ATOM 72 CA GLY A 39 23.065 22.619 16.523 1.00 0.00 C ATOM 73 C GLY A 39 22.323 21.824 15.447 1.00 0.00 C ATOM 74 O GLY A 39 22.061 20.649 15.600 1.00 0.00 O ATOM 0 H GLY A 39 21.155 23.207 17.272 1.00 0.00 H new ATOM 0 HA2 GLY A 39 23.533 23.499 16.082 1.00 0.00 H new ATOM 0 HA3 GLY A 39 23.864 22.014 16.951 1.00 0.00 H new ATOM 78 N ASN A 40 21.982 22.455 14.355 1.00 0.00 N ATOM 79 CA ASN A 40 21.260 21.730 13.272 1.00 0.00 C ATOM 80 C ASN A 40 22.262 21.243 12.224 1.00 0.00 C ATOM 81 O ASN A 40 22.731 22.002 11.400 1.00 0.00 O ATOM 82 CB ASN A 40 20.249 22.670 12.612 1.00 0.00 C ATOM 83 CG ASN A 40 19.298 21.857 11.731 1.00 0.00 C ATOM 84 OD1 ASN A 40 19.290 20.642 11.785 1.00 0.00 O ATOM 85 ND2 ASN A 40 18.491 22.478 10.916 1.00 0.00 N ATOM 0 H ASN A 40 22.172 23.439 14.167 1.00 0.00 H new ATOM 0 HA ASN A 40 20.736 20.874 13.698 1.00 0.00 H new ATOM 0 HB2 ASN A 40 19.685 23.208 13.374 1.00 0.00 H new ATOM 0 HB3 ASN A 40 20.769 23.417 12.012 1.00 0.00 H new ATOM 0 HD21 ASN A 40 17.854 21.945 10.324 1.00 0.00 H new ATOM 0 HD22 ASN A 40 18.497 23.497 10.870 1.00 0.00 H new ATOM 92 N THR A 41 22.596 19.981 12.248 1.00 0.00 N ATOM 93 CA THR A 41 23.567 19.448 11.254 1.00 0.00 C ATOM 94 C THR A 41 22.899 19.370 9.879 1.00 0.00 C ATOM 95 O THR A 41 21.834 18.805 9.727 1.00 0.00 O ATOM 96 CB THR A 41 24.021 18.050 11.681 1.00 0.00 C ATOM 97 OG1 THR A 41 24.787 18.147 12.874 1.00 0.00 O ATOM 98 CG2 THR A 41 24.873 17.427 10.574 1.00 0.00 C ATOM 0 H THR A 41 22.237 19.297 12.914 1.00 0.00 H new ATOM 0 HA THR A 41 24.432 20.110 11.201 1.00 0.00 H new ATOM 0 HB THR A 41 23.148 17.423 11.859 1.00 0.00 H new ATOM 0 HG1 THR A 41 25.370 18.933 12.825 1.00 0.00 H new ATOM 0 HG21 THR A 41 25.195 16.432 10.880 1.00 0.00 H new ATOM 0 HG22 THR A 41 24.284 17.353 9.660 1.00 0.00 H new ATOM 0 HG23 THR A 41 25.747 18.052 10.393 1.00 0.00 H new ATOM 106 N LEU A 42 23.514 19.934 8.876 1.00 0.00 N ATOM 107 CA LEU A 42 22.914 19.892 7.513 1.00 0.00 C ATOM 108 C LEU A 42 23.693 18.904 6.643 1.00 0.00 C ATOM 109 O LEU A 42 24.892 18.757 6.777 1.00 0.00 O ATOM 110 CB LEU A 42 22.977 21.284 6.885 1.00 0.00 C ATOM 111 CG LEU A 42 22.509 22.325 7.902 1.00 0.00 C ATOM 112 CD1 LEU A 42 22.325 23.674 7.204 1.00 0.00 C ATOM 113 CD2 LEU A 42 21.177 21.880 8.511 1.00 0.00 C ATOM 0 H LEU A 42 24.407 20.423 8.942 1.00 0.00 H new ATOM 0 HA LEU A 42 21.874 19.572 7.584 1.00 0.00 H new ATOM 0 HB2 LEU A 42 23.996 21.505 6.566 1.00 0.00 H new ATOM 0 HB3 LEU A 42 22.349 21.322 5.995 1.00 0.00 H new ATOM 0 HG LEU A 42 23.255 22.423 8.691 1.00 0.00 H new ATOM 0 HD11 LEU A 42 21.991 24.416 7.929 1.00 0.00 H new ATOM 0 HD12 LEU A 42 23.273 23.991 6.770 1.00 0.00 H new ATOM 0 HD13 LEU A 42 21.579 23.577 6.415 1.00 0.00 H new ATOM 0 HD21 LEU A 42 20.843 22.622 9.236 1.00 0.00 H new ATOM 0 HD22 LEU A 42 20.431 21.782 7.722 1.00 0.00 H new ATOM 0 HD23 LEU A 42 21.307 20.919 9.009 1.00 0.00 H new ATOM 125 N TYR A 43 23.024 18.226 5.751 1.00 0.00 N ATOM 126 CA TYR A 43 23.729 17.249 4.874 1.00 0.00 C ATOM 127 C TYR A 43 24.058 17.912 3.536 1.00 0.00 C ATOM 128 O TYR A 43 23.180 18.312 2.797 1.00 0.00 O ATOM 129 CB TYR A 43 22.830 16.035 4.636 1.00 0.00 C ATOM 130 CG TYR A 43 23.526 15.069 3.707 1.00 0.00 C ATOM 131 CD1 TYR A 43 24.448 14.148 4.219 1.00 0.00 C ATOM 132 CD2 TYR A 43 23.250 15.094 2.335 1.00 0.00 C ATOM 133 CE1 TYR A 43 25.094 13.253 3.359 1.00 0.00 C ATOM 134 CE2 TYR A 43 23.895 14.199 1.474 1.00 0.00 C ATOM 135 CZ TYR A 43 24.817 13.278 1.986 1.00 0.00 C ATOM 136 OH TYR A 43 25.454 12.394 1.137 1.00 0.00 O ATOM 0 H TYR A 43 22.020 18.306 5.592 1.00 0.00 H new ATOM 0 HA TYR A 43 24.652 16.927 5.356 1.00 0.00 H new ATOM 0 HB2 TYR A 43 22.603 15.546 5.583 1.00 0.00 H new ATOM 0 HB3 TYR A 43 21.880 16.351 4.205 1.00 0.00 H new ATOM 0 HD1 TYR A 43 24.661 14.128 5.278 1.00 0.00 H new ATOM 0 HD2 TYR A 43 22.539 15.805 1.941 1.00 0.00 H new ATOM 0 HE1 TYR A 43 25.806 12.543 3.754 1.00 0.00 H new ATOM 0 HE2 TYR A 43 23.682 14.219 0.415 1.00 0.00 H new ATOM 0 HH TYR A 43 25.148 12.544 0.218 1.00 0.00 H new ATOM 146 N VAL A 44 25.318 18.031 3.216 1.00 0.00 N ATOM 147 CA VAL A 44 25.702 18.668 1.925 1.00 0.00 C ATOM 148 C VAL A 44 26.356 17.626 1.016 1.00 0.00 C ATOM 149 O VAL A 44 27.140 16.809 1.457 1.00 0.00 O ATOM 150 CB VAL A 44 26.691 19.805 2.192 1.00 0.00 C ATOM 151 CG1 VAL A 44 27.088 20.458 0.867 1.00 0.00 C ATOM 152 CG2 VAL A 44 26.036 20.847 3.100 1.00 0.00 C ATOM 0 H VAL A 44 26.097 17.715 3.793 1.00 0.00 H new ATOM 0 HA VAL A 44 24.812 19.067 1.438 1.00 0.00 H new ATOM 0 HB VAL A 44 27.580 19.406 2.680 1.00 0.00 H new ATOM 0 HG11 VAL A 44 27.792 21.268 1.057 1.00 0.00 H new ATOM 0 HG12 VAL A 44 27.555 19.715 0.221 1.00 0.00 H new ATOM 0 HG13 VAL A 44 26.200 20.857 0.378 1.00 0.00 H new ATOM 0 HG21 VAL A 44 26.740 21.657 3.291 1.00 0.00 H new ATOM 0 HG22 VAL A 44 25.146 21.246 2.613 1.00 0.00 H new ATOM 0 HG23 VAL A 44 25.754 20.381 4.044 1.00 0.00 H new ATOM 162 N TYR A 45 26.040 17.647 -0.250 1.00 0.00 N ATOM 163 CA TYR A 45 26.644 16.658 -1.185 1.00 0.00 C ATOM 164 C TYR A 45 27.330 17.397 -2.337 1.00 0.00 C ATOM 165 O TYR A 45 26.788 18.328 -2.898 1.00 0.00 O ATOM 166 CB TYR A 45 25.548 15.747 -1.743 1.00 0.00 C ATOM 167 CG TYR A 45 26.173 14.681 -2.610 1.00 0.00 C ATOM 168 CD1 TYR A 45 26.660 13.504 -2.030 1.00 0.00 C ATOM 169 CD2 TYR A 45 26.263 14.869 -3.995 1.00 0.00 C ATOM 170 CE1 TYR A 45 27.239 12.514 -2.834 1.00 0.00 C ATOM 171 CE2 TYR A 45 26.842 13.880 -4.799 1.00 0.00 C ATOM 172 CZ TYR A 45 27.331 12.703 -4.219 1.00 0.00 C ATOM 173 OH TYR A 45 27.901 11.728 -5.011 1.00 0.00 O ATOM 0 H TYR A 45 25.389 18.307 -0.677 1.00 0.00 H new ATOM 0 HA TYR A 45 27.379 16.056 -0.651 1.00 0.00 H new ATOM 0 HB2 TYR A 45 24.992 15.287 -0.926 1.00 0.00 H new ATOM 0 HB3 TYR A 45 24.835 16.332 -2.324 1.00 0.00 H new ATOM 0 HD1 TYR A 45 26.589 13.359 -0.962 1.00 0.00 H new ATOM 0 HD2 TYR A 45 25.886 15.777 -4.443 1.00 0.00 H new ATOM 0 HE1 TYR A 45 27.614 11.606 -2.386 1.00 0.00 H new ATOM 0 HE2 TYR A 45 26.912 14.025 -5.867 1.00 0.00 H new ATOM 0 HH TYR A 45 27.885 12.017 -5.947 1.00 0.00 H new ATOM 183 N GLY A 46 28.516 16.988 -2.693 1.00 0.00 N ATOM 184 CA GLY A 46 29.235 17.669 -3.808 1.00 0.00 C ATOM 185 C GLY A 46 30.568 16.963 -4.062 1.00 0.00 C ATOM 186 O GLY A 46 30.866 15.945 -3.468 1.00 0.00 O ATOM 0 H GLY A 46 29.019 16.213 -2.261 1.00 0.00 H new ATOM 0 HA2 GLY A 46 28.625 17.653 -4.711 1.00 0.00 H new ATOM 0 HA3 GLY A 46 29.408 18.716 -3.558 1.00 0.00 H new ATOM 190 N GLU A 47 31.373 17.494 -4.940 1.00 0.00 N ATOM 191 CA GLU A 47 32.686 16.853 -5.232 1.00 0.00 C ATOM 192 C GLU A 47 33.811 17.863 -4.995 1.00 0.00 C ATOM 193 O GLU A 47 33.601 19.059 -5.025 1.00 0.00 O ATOM 194 CB GLU A 47 32.716 16.389 -6.690 1.00 0.00 C ATOM 195 CG GLU A 47 31.598 15.371 -6.924 1.00 0.00 C ATOM 196 CD GLU A 47 31.675 14.850 -8.360 1.00 0.00 C ATOM 197 OE1 GLU A 47 32.437 15.409 -9.132 1.00 0.00 O ATOM 198 OE2 GLU A 47 30.970 13.902 -8.664 1.00 0.00 O ATOM 0 H GLU A 47 31.178 18.345 -5.468 1.00 0.00 H new ATOM 0 HA GLU A 47 32.824 15.994 -4.575 1.00 0.00 H new ATOM 0 HB2 GLU A 47 32.591 17.242 -7.357 1.00 0.00 H new ATOM 0 HB3 GLU A 47 33.683 15.943 -6.921 1.00 0.00 H new ATOM 0 HG2 GLU A 47 31.692 14.544 -6.220 1.00 0.00 H new ATOM 0 HG3 GLU A 47 30.627 15.833 -6.745 1.00 0.00 H new ATOM 205 N ASP A 48 35.005 17.390 -4.761 1.00 0.00 N ATOM 206 CA ASP A 48 36.142 18.324 -4.524 1.00 0.00 C ATOM 207 C ASP A 48 35.711 19.415 -3.542 1.00 0.00 C ATOM 208 O ASP A 48 35.951 20.586 -3.757 1.00 0.00 O ATOM 209 CB ASP A 48 36.560 18.966 -5.848 1.00 0.00 C ATOM 210 CG ASP A 48 37.833 19.788 -5.637 1.00 0.00 C ATOM 211 OD1 ASP A 48 38.385 19.720 -4.552 1.00 0.00 O ATOM 212 OD2 ASP A 48 38.233 20.472 -6.565 1.00 0.00 O ATOM 0 H ASP A 48 35.242 16.399 -4.724 1.00 0.00 H new ATOM 0 HA ASP A 48 36.984 17.772 -4.106 1.00 0.00 H new ATOM 0 HB2 ASP A 48 36.732 18.196 -6.600 1.00 0.00 H new ATOM 0 HB3 ASP A 48 35.760 19.604 -6.223 1.00 0.00 H new ATOM 217 N MET A 49 35.076 19.040 -2.466 1.00 0.00 N ATOM 218 CA MET A 49 34.631 20.057 -1.471 1.00 0.00 C ATOM 219 C MET A 49 35.687 20.193 -0.373 1.00 0.00 C ATOM 220 O MET A 49 36.314 19.229 0.022 1.00 0.00 O ATOM 221 CB MET A 49 33.305 19.618 -0.851 1.00 0.00 C ATOM 222 CG MET A 49 32.225 19.571 -1.935 1.00 0.00 C ATOM 223 SD MET A 49 30.624 19.201 -1.177 1.00 0.00 S ATOM 224 CE MET A 49 31.069 17.589 -0.484 1.00 0.00 C ATOM 0 H MET A 49 34.846 18.074 -2.232 1.00 0.00 H new ATOM 0 HA MET A 49 34.499 21.018 -1.969 1.00 0.00 H new ATOM 0 HB2 MET A 49 33.415 18.637 -0.389 1.00 0.00 H new ATOM 0 HB3 MET A 49 33.013 20.311 -0.062 1.00 0.00 H new ATOM 0 HG2 MET A 49 32.179 20.526 -2.459 1.00 0.00 H new ATOM 0 HG3 MET A 49 32.472 18.812 -2.677 1.00 0.00 H new ATOM 0 HE1 MET A 49 30.202 16.929 -0.512 1.00 0.00 H new ATOM 0 HE2 MET A 49 31.877 17.151 -1.070 1.00 0.00 H new ATOM 0 HE3 MET A 49 31.397 17.715 0.548 1.00 0.00 H new ATOM 234 N THR A 50 35.891 21.383 0.124 1.00 0.00 N ATOM 235 CA THR A 50 36.907 21.579 1.195 1.00 0.00 C ATOM 236 C THR A 50 36.230 22.159 2.439 1.00 0.00 C ATOM 237 O THR A 50 35.123 22.656 2.378 1.00 0.00 O ATOM 238 CB THR A 50 37.986 22.546 0.703 1.00 0.00 C ATOM 239 OG1 THR A 50 37.380 23.581 -0.059 1.00 0.00 O ATOM 240 CG2 THR A 50 38.992 21.791 -0.168 1.00 0.00 C ATOM 0 H THR A 50 35.398 22.227 -0.166 1.00 0.00 H new ATOM 0 HA THR A 50 37.364 20.621 1.443 1.00 0.00 H new ATOM 0 HB THR A 50 38.503 22.979 1.559 1.00 0.00 H new ATOM 0 HG1 THR A 50 38.070 24.202 -0.373 1.00 0.00 H new ATOM 0 HG21 THR A 50 39.760 22.481 -0.518 1.00 0.00 H new ATOM 0 HG22 THR A 50 39.456 20.997 0.417 1.00 0.00 H new ATOM 0 HG23 THR A 50 38.477 21.356 -1.025 1.00 0.00 H new ATOM 248 N PRO A 51 36.915 22.090 3.589 1.00 0.00 N ATOM 249 CA PRO A 51 36.387 22.607 4.859 1.00 0.00 C ATOM 250 C PRO A 51 36.312 24.136 4.862 1.00 0.00 C ATOM 251 O PRO A 51 35.281 24.716 5.143 1.00 0.00 O ATOM 252 CB PRO A 51 37.407 22.130 5.892 1.00 0.00 C ATOM 253 CG PRO A 51 38.670 21.954 5.118 1.00 0.00 C ATOM 254 CD PRO A 51 38.258 21.504 3.744 1.00 0.00 C ATOM 0 HA PRO A 51 35.372 22.260 5.052 1.00 0.00 H new ATOM 0 HB2 PRO A 51 37.531 22.859 6.693 1.00 0.00 H new ATOM 0 HB3 PRO A 51 37.093 21.195 6.357 1.00 0.00 H new ATOM 0 HG2 PRO A 51 39.231 22.887 5.070 1.00 0.00 H new ATOM 0 HG3 PRO A 51 39.318 21.216 5.592 1.00 0.00 H new ATOM 0 HD2 PRO A 51 38.946 21.864 2.979 1.00 0.00 H new ATOM 0 HD3 PRO A 51 38.235 20.417 3.666 1.00 0.00 H new ATOM 262 N THR A 52 37.395 24.794 4.551 1.00 0.00 N ATOM 263 CA THR A 52 37.383 26.284 4.536 1.00 0.00 C ATOM 264 C THR A 52 36.304 26.772 3.566 1.00 0.00 C ATOM 265 O THR A 52 35.524 27.649 3.880 1.00 0.00 O ATOM 266 CB THR A 52 38.749 26.803 4.084 1.00 0.00 C ATOM 267 OG1 THR A 52 39.760 26.264 4.924 1.00 0.00 O ATOM 268 CG2 THR A 52 38.771 28.330 4.171 1.00 0.00 C ATOM 0 H THR A 52 38.287 24.364 4.307 1.00 0.00 H new ATOM 0 HA THR A 52 37.169 26.657 5.538 1.00 0.00 H new ATOM 0 HB THR A 52 38.931 26.498 3.054 1.00 0.00 H new ATOM 0 HG1 THR A 52 40.636 26.594 4.635 1.00 0.00 H new ATOM 0 HG21 THR A 52 39.745 28.699 3.849 1.00 0.00 H new ATOM 0 HG22 THR A 52 37.995 28.742 3.526 1.00 0.00 H new ATOM 0 HG23 THR A 52 38.589 28.638 5.200 1.00 0.00 H new ATOM 276 N LEU A 53 36.253 26.209 2.390 1.00 0.00 N ATOM 277 CA LEU A 53 35.223 26.639 1.403 1.00 0.00 C ATOM 278 C LEU A 53 33.831 26.436 2.004 1.00 0.00 C ATOM 279 O LEU A 53 33.038 27.354 2.082 1.00 0.00 O ATOM 280 CB LEU A 53 35.357 25.804 0.129 1.00 0.00 C ATOM 281 CG LEU A 53 34.408 26.350 -0.940 1.00 0.00 C ATOM 282 CD1 LEU A 53 35.003 27.623 -1.546 1.00 0.00 C ATOM 283 CD2 LEU A 53 34.221 25.301 -2.039 1.00 0.00 C ATOM 0 H LEU A 53 36.880 25.470 2.070 1.00 0.00 H new ATOM 0 HA LEU A 53 35.366 27.692 1.161 1.00 0.00 H new ATOM 0 HB2 LEU A 53 36.385 25.834 -0.232 1.00 0.00 H new ATOM 0 HB3 LEU A 53 35.124 24.760 0.339 1.00 0.00 H new ATOM 0 HG LEU A 53 33.443 26.579 -0.488 1.00 0.00 H new ATOM 0 HD11 LEU A 53 34.328 28.013 -2.308 1.00 0.00 H new ATOM 0 HD12 LEU A 53 35.138 28.370 -0.764 1.00 0.00 H new ATOM 0 HD13 LEU A 53 35.968 27.394 -1.999 1.00 0.00 H new ATOM 0 HD21 LEU A 53 33.545 25.689 -2.801 1.00 0.00 H new ATOM 0 HD22 LEU A 53 35.186 25.073 -2.492 1.00 0.00 H new ATOM 0 HD23 LEU A 53 33.799 24.393 -1.608 1.00 0.00 H new ATOM 295 N LEU A 54 33.528 25.241 2.432 1.00 0.00 N ATOM 296 CA LEU A 54 32.190 24.982 3.031 1.00 0.00 C ATOM 297 C LEU A 54 31.944 25.976 4.166 1.00 0.00 C ATOM 298 O LEU A 54 30.869 26.528 4.301 1.00 0.00 O ATOM 299 CB LEU A 54 32.146 23.555 3.583 1.00 0.00 C ATOM 300 CG LEU A 54 32.250 22.558 2.428 1.00 0.00 C ATOM 301 CD1 LEU A 54 32.951 21.287 2.912 1.00 0.00 C ATOM 302 CD2 LEU A 54 30.846 22.207 1.929 1.00 0.00 C ATOM 0 H LEU A 54 34.150 24.433 2.392 1.00 0.00 H new ATOM 0 HA LEU A 54 31.419 25.099 2.269 1.00 0.00 H new ATOM 0 HB2 LEU A 54 32.965 23.400 4.286 1.00 0.00 H new ATOM 0 HB3 LEU A 54 31.219 23.395 4.133 1.00 0.00 H new ATOM 0 HG LEU A 54 32.824 23.003 1.615 1.00 0.00 H new ATOM 0 HD11 LEU A 54 33.025 20.576 2.089 1.00 0.00 H new ATOM 0 HD12 LEU A 54 33.951 21.536 3.268 1.00 0.00 H new ATOM 0 HD13 LEU A 54 32.377 20.842 3.725 1.00 0.00 H new ATOM 0 HD21 LEU A 54 30.920 21.496 1.106 1.00 0.00 H new ATOM 0 HD22 LEU A 54 30.272 21.763 2.742 1.00 0.00 H new ATOM 0 HD23 LEU A 54 30.346 23.112 1.584 1.00 0.00 H new ATOM 314 N ARG A 55 32.933 26.212 4.984 1.00 0.00 N ATOM 315 CA ARG A 55 32.759 27.173 6.109 1.00 0.00 C ATOM 316 C ARG A 55 32.205 28.492 5.566 1.00 0.00 C ATOM 317 O ARG A 55 31.365 29.122 6.178 1.00 0.00 O ATOM 318 CB ARG A 55 34.113 27.424 6.777 1.00 0.00 C ATOM 319 CG ARG A 55 33.924 28.349 7.981 1.00 0.00 C ATOM 320 CD ARG A 55 35.285 28.630 8.623 1.00 0.00 C ATOM 321 NE ARG A 55 35.092 29.432 9.865 1.00 0.00 N ATOM 322 CZ ARG A 55 35.354 28.905 11.029 1.00 0.00 C ATOM 323 NH1 ARG A 55 36.516 28.353 11.250 1.00 0.00 N ATOM 324 NH2 ARG A 55 34.453 28.928 11.974 1.00 0.00 N ATOM 0 H ARG A 55 33.855 25.780 4.921 1.00 0.00 H new ATOM 0 HA ARG A 55 32.065 26.759 6.840 1.00 0.00 H new ATOM 0 HB2 ARG A 55 34.554 26.480 7.096 1.00 0.00 H new ATOM 0 HB3 ARG A 55 34.804 27.874 6.064 1.00 0.00 H new ATOM 0 HG2 ARG A 55 33.458 29.283 7.667 1.00 0.00 H new ATOM 0 HG3 ARG A 55 33.255 27.887 8.707 1.00 0.00 H new ATOM 0 HD2 ARG A 55 35.789 27.692 8.857 1.00 0.00 H new ATOM 0 HD3 ARG A 55 35.924 29.170 7.924 1.00 0.00 H new ATOM 0 HE ARG A 55 34.755 30.393 9.804 1.00 0.00 H new ATOM 0 HH11 ARG A 55 37.220 28.334 10.512 1.00 0.00 H new ATOM 0 HH12 ARG A 55 36.720 27.941 12.161 1.00 0.00 H new ATOM 0 HH21 ARG A 55 33.544 29.358 11.802 1.00 0.00 H new ATOM 0 HH22 ARG A 55 34.658 28.516 12.884 1.00 0.00 H new ATOM 338 N GLY A 56 32.668 28.914 4.422 1.00 0.00 N ATOM 339 CA GLY A 56 32.167 30.189 3.840 1.00 0.00 C ATOM 340 C GLY A 56 30.722 30.003 3.375 1.00 0.00 C ATOM 341 O GLY A 56 29.929 30.923 3.398 1.00 0.00 O ATOM 0 H GLY A 56 33.372 28.430 3.865 1.00 0.00 H new ATOM 0 HA2 GLY A 56 32.222 30.986 4.581 1.00 0.00 H new ATOM 0 HA3 GLY A 56 32.795 30.490 3.001 1.00 0.00 H new ATOM 345 N ALA A 57 30.373 28.819 2.951 1.00 0.00 N ATOM 346 CA ALA A 57 28.979 28.576 2.484 1.00 0.00 C ATOM 347 C ALA A 57 28.036 28.548 3.688 1.00 0.00 C ATOM 348 O ALA A 57 26.835 28.674 3.552 1.00 0.00 O ATOM 349 CB ALA A 57 28.911 27.234 1.753 1.00 0.00 C ATOM 0 H ALA A 57 30.993 28.010 2.908 1.00 0.00 H new ATOM 0 HA ALA A 57 28.680 29.375 1.805 1.00 0.00 H new ATOM 0 HB1 ALA A 57 27.891 27.057 1.412 1.00 0.00 H new ATOM 0 HB2 ALA A 57 29.583 27.253 0.895 1.00 0.00 H new ATOM 0 HB3 ALA A 57 29.211 26.435 2.431 1.00 0.00 H new ATOM 355 N PHE A 58 28.570 28.387 4.867 1.00 0.00 N ATOM 356 CA PHE A 58 27.707 28.354 6.081 1.00 0.00 C ATOM 357 C PHE A 58 28.218 29.382 7.095 1.00 0.00 C ATOM 358 O PHE A 58 27.731 29.467 8.206 1.00 0.00 O ATOM 359 CB PHE A 58 27.756 26.956 6.702 1.00 0.00 C ATOM 360 CG PHE A 58 27.205 25.949 5.721 1.00 0.00 C ATOM 361 CD1 PHE A 58 25.832 25.678 5.693 1.00 0.00 C ATOM 362 CD2 PHE A 58 28.067 25.286 4.840 1.00 0.00 C ATOM 363 CE1 PHE A 58 25.321 24.744 4.783 1.00 0.00 C ATOM 364 CE2 PHE A 58 27.557 24.352 3.930 1.00 0.00 C ATOM 365 CZ PHE A 58 26.184 24.081 3.903 1.00 0.00 C ATOM 0 H PHE A 58 29.569 28.277 5.042 1.00 0.00 H new ATOM 0 HA PHE A 58 26.680 28.593 5.806 1.00 0.00 H new ATOM 0 HB2 PHE A 58 28.782 26.699 6.965 1.00 0.00 H new ATOM 0 HB3 PHE A 58 27.176 26.936 7.625 1.00 0.00 H new ATOM 0 HD1 PHE A 58 25.167 26.189 6.373 1.00 0.00 H new ATOM 0 HD2 PHE A 58 29.126 25.495 4.862 1.00 0.00 H new ATOM 0 HE1 PHE A 58 24.262 24.536 4.760 1.00 0.00 H new ATOM 0 HE2 PHE A 58 28.222 23.841 3.250 1.00 0.00 H new ATOM 0 HZ PHE A 58 25.790 23.360 3.202 1.00 0.00 H new ATOM 375 N SER A 59 29.197 30.160 6.724 1.00 0.00 N ATOM 376 CA SER A 59 29.744 31.178 7.665 1.00 0.00 C ATOM 377 C SER A 59 28.762 32.347 7.801 1.00 0.00 C ATOM 378 O SER A 59 28.344 32.690 8.889 1.00 0.00 O ATOM 379 CB SER A 59 31.079 31.699 7.129 1.00 0.00 C ATOM 380 OG SER A 59 32.146 31.073 7.827 1.00 0.00 O ATOM 0 H SER A 59 29.643 30.135 5.807 1.00 0.00 H new ATOM 0 HA SER A 59 29.892 30.718 8.642 1.00 0.00 H new ATOM 0 HB2 SER A 59 31.159 31.495 6.061 1.00 0.00 H new ATOM 0 HB3 SER A 59 31.135 32.781 7.252 1.00 0.00 H new ATOM 0 HG SER A 59 32.998 31.319 7.410 1.00 0.00 H new ATOM 386 N PRO A 60 28.394 32.974 6.672 1.00 0.00 N ATOM 387 CA PRO A 60 27.467 34.114 6.668 1.00 0.00 C ATOM 388 C PRO A 60 26.037 33.693 7.018 1.00 0.00 C ATOM 389 O PRO A 60 25.300 34.428 7.645 1.00 0.00 O ATOM 390 CB PRO A 60 27.526 34.618 5.227 1.00 0.00 C ATOM 391 CG PRO A 60 27.943 33.431 4.429 1.00 0.00 C ATOM 392 CD PRO A 60 28.850 32.624 5.314 1.00 0.00 C ATOM 0 HA PRO A 60 27.742 34.864 7.409 1.00 0.00 H new ATOM 0 HB2 PRO A 60 26.557 34.995 4.899 1.00 0.00 H new ATOM 0 HB3 PRO A 60 28.239 35.436 5.122 1.00 0.00 H new ATOM 0 HG2 PRO A 60 27.077 32.845 4.123 1.00 0.00 H new ATOM 0 HG3 PRO A 60 28.459 33.736 3.519 1.00 0.00 H new ATOM 0 HD2 PRO A 60 28.755 31.556 5.120 1.00 0.00 H new ATOM 0 HD3 PRO A 60 29.897 32.884 5.161 1.00 0.00 H new ATOM 400 N PHE A 61 25.638 32.517 6.619 1.00 0.00 N ATOM 401 CA PHE A 61 24.256 32.055 6.930 1.00 0.00 C ATOM 402 C PHE A 61 24.050 32.043 8.446 1.00 0.00 C ATOM 403 O PHE A 61 23.022 32.455 8.945 1.00 0.00 O ATOM 404 CB PHE A 61 24.053 30.646 6.373 1.00 0.00 C ATOM 405 CG PHE A 61 23.925 30.714 4.870 1.00 0.00 C ATOM 406 CD1 PHE A 61 22.677 30.954 4.284 1.00 0.00 C ATOM 407 CD2 PHE A 61 25.056 30.540 4.062 1.00 0.00 C ATOM 408 CE1 PHE A 61 22.558 31.019 2.891 1.00 0.00 C ATOM 409 CE2 PHE A 61 24.937 30.604 2.669 1.00 0.00 C ATOM 410 CZ PHE A 61 23.688 30.844 2.084 1.00 0.00 C ATOM 0 H PHE A 61 26.209 31.856 6.091 1.00 0.00 H new ATOM 0 HA PHE A 61 23.534 32.732 6.473 1.00 0.00 H new ATOM 0 HB2 PHE A 61 24.894 30.009 6.649 1.00 0.00 H new ATOM 0 HB3 PHE A 61 23.158 30.198 6.805 1.00 0.00 H new ATOM 0 HD1 PHE A 61 21.805 31.089 4.907 1.00 0.00 H new ATOM 0 HD2 PHE A 61 26.020 30.357 4.514 1.00 0.00 H new ATOM 0 HE1 PHE A 61 21.595 31.204 2.439 1.00 0.00 H new ATOM 0 HE2 PHE A 61 25.808 30.468 2.046 1.00 0.00 H new ATOM 0 HZ PHE A 61 23.596 30.894 1.009 1.00 0.00 H new ATOM 420 N GLY A 62 25.019 31.574 9.182 1.00 0.00 N ATOM 421 CA GLY A 62 24.876 31.537 10.665 1.00 0.00 C ATOM 422 C GLY A 62 26.156 30.974 11.287 1.00 0.00 C ATOM 423 O GLY A 62 27.095 30.631 10.596 1.00 0.00 O ATOM 0 H GLY A 62 25.903 31.215 8.821 1.00 0.00 H new ATOM 0 HA2 GLY A 62 24.683 32.539 11.048 1.00 0.00 H new ATOM 0 HA3 GLY A 62 24.022 30.920 10.943 1.00 0.00 H new ATOM 427 N ASN A 63 26.200 30.875 12.587 1.00 0.00 N ATOM 428 CA ASN A 63 27.419 30.334 13.252 1.00 0.00 C ATOM 429 C ASN A 63 27.343 28.807 13.291 1.00 0.00 C ATOM 430 O ASN A 63 26.295 28.233 13.512 1.00 0.00 O ATOM 431 CB ASN A 63 27.503 30.877 14.680 1.00 0.00 C ATOM 432 CG ASN A 63 28.880 30.558 15.267 1.00 0.00 C ATOM 433 OD1 ASN A 63 29.887 31.023 14.773 1.00 0.00 O ATOM 434 ND2 ASN A 63 28.965 29.777 16.309 1.00 0.00 N ATOM 0 H ASN A 63 25.445 31.145 13.217 1.00 0.00 H new ATOM 0 HA ASN A 63 28.304 30.639 12.694 1.00 0.00 H new ATOM 0 HB2 ASN A 63 27.336 31.954 14.681 1.00 0.00 H new ATOM 0 HB3 ASN A 63 26.721 30.432 15.296 1.00 0.00 H new ATOM 0 HD21 ASN A 63 29.877 29.557 16.709 1.00 0.00 H new ATOM 0 HD22 ASN A 63 28.119 29.386 16.724 1.00 0.00 H new ATOM 441 N ILE A 64 28.446 28.143 13.077 1.00 0.00 N ATOM 442 CA ILE A 64 28.434 26.653 13.102 1.00 0.00 C ATOM 443 C ILE A 64 29.049 26.161 14.414 1.00 0.00 C ATOM 444 O ILE A 64 30.083 26.634 14.842 1.00 0.00 O ATOM 445 CB ILE A 64 29.250 26.117 11.923 1.00 0.00 C ATOM 446 CG1 ILE A 64 28.632 26.605 10.610 1.00 0.00 C ATOM 447 CG2 ILE A 64 29.244 24.588 11.953 1.00 0.00 C ATOM 448 CD1 ILE A 64 29.644 26.430 9.475 1.00 0.00 C ATOM 0 H ILE A 64 29.354 28.567 12.886 1.00 0.00 H new ATOM 0 HA ILE A 64 27.407 26.296 13.025 1.00 0.00 H new ATOM 0 HB ILE A 64 30.276 26.478 11.997 1.00 0.00 H new ATOM 0 HG12 ILE A 64 27.724 26.043 10.392 1.00 0.00 H new ATOM 0 HG13 ILE A 64 28.345 27.653 10.698 1.00 0.00 H new ATOM 0 HG21 ILE A 64 29.825 24.205 11.114 1.00 0.00 H new ATOM 0 HG22 ILE A 64 29.685 24.241 12.888 1.00 0.00 H new ATOM 0 HG23 ILE A 64 28.218 24.227 11.879 1.00 0.00 H new ATOM 0 HD11 ILE A 64 29.205 26.777 8.540 1.00 0.00 H new ATOM 0 HD12 ILE A 64 30.540 27.011 9.693 1.00 0.00 H new ATOM 0 HD13 ILE A 64 29.909 25.377 9.383 1.00 0.00 H new ATOM 460 N ILE A 65 28.420 25.215 15.056 1.00 0.00 N ATOM 461 CA ILE A 65 28.968 24.695 16.340 1.00 0.00 C ATOM 462 C ILE A 65 29.758 23.412 16.077 1.00 0.00 C ATOM 463 O ILE A 65 30.588 23.010 16.867 1.00 0.00 O ATOM 464 CB ILE A 65 27.817 24.398 17.303 1.00 0.00 C ATOM 465 CG1 ILE A 65 26.998 23.219 16.772 1.00 0.00 C ATOM 466 CG2 ILE A 65 26.919 25.631 17.420 1.00 0.00 C ATOM 467 CD1 ILE A 65 25.848 22.919 17.735 1.00 0.00 C ATOM 0 H ILE A 65 27.551 24.780 14.747 1.00 0.00 H new ATOM 0 HA ILE A 65 29.627 25.442 16.782 1.00 0.00 H new ATOM 0 HB ILE A 65 28.220 24.147 18.284 1.00 0.00 H new ATOM 0 HG12 ILE A 65 26.606 23.452 15.782 1.00 0.00 H new ATOM 0 HG13 ILE A 65 27.634 22.340 16.664 1.00 0.00 H new ATOM 0 HG21 ILE A 65 26.099 25.420 18.106 1.00 0.00 H new ATOM 0 HG22 ILE A 65 27.502 26.471 17.799 1.00 0.00 H new ATOM 0 HG23 ILE A 65 26.516 25.882 16.439 1.00 0.00 H new ATOM 0 HD11 ILE A 65 25.266 22.079 17.356 1.00 0.00 H new ATOM 0 HD12 ILE A 65 26.251 22.667 18.716 1.00 0.00 H new ATOM 0 HD13 ILE A 65 25.207 23.796 17.820 1.00 0.00 H new ATOM 479 N ASP A 66 29.506 22.764 14.972 1.00 0.00 N ATOM 480 CA ASP A 66 30.244 21.506 14.662 1.00 0.00 C ATOM 481 C ASP A 66 30.143 21.210 13.164 1.00 0.00 C ATOM 482 O ASP A 66 29.113 20.797 12.671 1.00 0.00 O ATOM 483 CB ASP A 66 29.631 20.349 15.452 1.00 0.00 C ATOM 484 CG ASP A 66 30.525 19.114 15.324 1.00 0.00 C ATOM 485 OD1 ASP A 66 31.590 19.235 14.739 1.00 0.00 O ATOM 486 OD2 ASP A 66 30.132 18.068 15.813 1.00 0.00 O ATOM 0 H ASP A 66 28.822 23.051 14.272 1.00 0.00 H new ATOM 0 HA ASP A 66 31.292 21.622 14.939 1.00 0.00 H new ATOM 0 HB2 ASP A 66 29.524 20.627 16.501 1.00 0.00 H new ATOM 0 HB3 ASP A 66 28.632 20.128 15.077 1.00 0.00 H new ATOM 491 N LEU A 67 31.208 21.416 12.437 1.00 0.00 N ATOM 492 CA LEU A 67 31.174 21.144 10.972 1.00 0.00 C ATOM 493 C LEU A 67 32.070 19.943 10.658 1.00 0.00 C ATOM 494 O LEU A 67 33.256 19.957 10.919 1.00 0.00 O ATOM 495 CB LEU A 67 31.682 22.372 10.214 1.00 0.00 C ATOM 496 CG LEU A 67 31.397 22.203 8.720 1.00 0.00 C ATOM 497 CD1 LEU A 67 30.399 23.271 8.268 1.00 0.00 C ATOM 498 CD2 LEU A 67 32.700 22.355 7.932 1.00 0.00 C ATOM 0 H LEU A 67 32.099 21.761 12.794 1.00 0.00 H new ATOM 0 HA LEU A 67 30.151 20.926 10.665 1.00 0.00 H new ATOM 0 HB2 LEU A 67 31.194 23.272 10.589 1.00 0.00 H new ATOM 0 HB3 LEU A 67 32.752 22.498 10.379 1.00 0.00 H new ATOM 0 HG LEU A 67 30.977 21.214 8.539 1.00 0.00 H new ATOM 0 HD11 LEU A 67 30.195 23.152 7.204 1.00 0.00 H new ATOM 0 HD12 LEU A 67 29.471 23.163 8.829 1.00 0.00 H new ATOM 0 HD13 LEU A 67 30.819 24.261 8.448 1.00 0.00 H new ATOM 0 HD21 LEU A 67 32.498 22.235 6.868 1.00 0.00 H new ATOM 0 HD22 LEU A 67 33.121 23.344 8.112 1.00 0.00 H new ATOM 0 HD23 LEU A 67 33.411 21.594 8.254 1.00 0.00 H new ATOM 510 N SER A 68 31.510 18.903 10.101 1.00 0.00 N ATOM 511 CA SER A 68 32.330 17.704 9.773 1.00 0.00 C ATOM 512 C SER A 68 32.299 17.457 8.263 1.00 0.00 C ATOM 513 O SER A 68 31.354 17.810 7.587 1.00 0.00 O ATOM 514 CB SER A 68 31.762 16.483 10.500 1.00 0.00 C ATOM 515 OG SER A 68 31.666 16.761 11.890 1.00 0.00 O ATOM 0 H SER A 68 30.521 18.833 9.860 1.00 0.00 H new ATOM 0 HA SER A 68 33.359 17.872 10.091 1.00 0.00 H new ATOM 0 HB2 SER A 68 30.780 16.233 10.100 1.00 0.00 H new ATOM 0 HB3 SER A 68 32.403 15.617 10.335 1.00 0.00 H new ATOM 0 HG SER A 68 31.301 15.980 12.355 1.00 0.00 H new ATOM 521 N MET A 69 33.326 16.854 7.730 1.00 0.00 N ATOM 522 CA MET A 69 33.356 16.585 6.266 1.00 0.00 C ATOM 523 C MET A 69 33.490 15.080 6.027 1.00 0.00 C ATOM 524 O MET A 69 34.206 14.391 6.727 1.00 0.00 O ATOM 525 CB MET A 69 34.548 17.308 5.638 1.00 0.00 C ATOM 526 CG MET A 69 34.323 18.820 5.713 1.00 0.00 C ATOM 527 SD MET A 69 35.655 19.672 4.830 1.00 0.00 S ATOM 528 CE MET A 69 35.152 19.204 3.157 1.00 0.00 C ATOM 0 H MET A 69 34.146 16.536 8.246 1.00 0.00 H new ATOM 0 HA MET A 69 32.433 16.945 5.812 1.00 0.00 H new ATOM 0 HB2 MET A 69 35.466 17.040 6.160 1.00 0.00 H new ATOM 0 HB3 MET A 69 34.669 16.998 4.600 1.00 0.00 H new ATOM 0 HG2 MET A 69 33.359 19.077 5.275 1.00 0.00 H new ATOM 0 HG3 MET A 69 34.297 19.144 6.754 1.00 0.00 H new ATOM 0 HE1 MET A 69 35.797 18.404 2.794 1.00 0.00 H new ATOM 0 HE2 MET A 69 34.118 18.859 3.171 1.00 0.00 H new ATOM 0 HE3 MET A 69 35.238 20.067 2.497 1.00 0.00 H new ATOM 538 N ASP A 70 32.808 14.563 5.042 1.00 0.00 N ATOM 539 CA ASP A 70 32.897 13.102 4.758 1.00 0.00 C ATOM 540 C ASP A 70 33.440 12.890 3.344 1.00 0.00 C ATOM 541 O ASP A 70 32.747 13.094 2.366 1.00 0.00 O ATOM 542 CB ASP A 70 31.506 12.476 4.870 1.00 0.00 C ATOM 543 CG ASP A 70 31.554 11.295 5.842 1.00 0.00 C ATOM 544 OD1 ASP A 70 32.159 10.293 5.496 1.00 0.00 O ATOM 545 OD2 ASP A 70 30.987 11.412 6.915 1.00 0.00 O ATOM 0 H ASP A 70 32.193 15.089 4.421 1.00 0.00 H new ATOM 0 HA ASP A 70 33.566 12.631 5.478 1.00 0.00 H new ATOM 0 HB2 ASP A 70 30.788 13.219 5.219 1.00 0.00 H new ATOM 0 HB3 ASP A 70 31.167 12.140 3.890 1.00 0.00 H new ATOM 550 N PRO A 71 34.710 12.470 3.239 1.00 0.00 N ATOM 551 CA PRO A 71 35.355 12.226 1.948 1.00 0.00 C ATOM 552 C PRO A 71 34.887 10.929 1.258 1.00 0.00 C ATOM 553 O PRO A 71 34.918 10.840 0.045 1.00 0.00 O ATOM 554 CB PRO A 71 36.840 12.138 2.295 1.00 0.00 C ATOM 555 CG PRO A 71 36.888 11.725 3.729 1.00 0.00 C ATOM 556 CD PRO A 71 35.613 12.206 4.375 1.00 0.00 C ATOM 0 HA PRO A 71 35.110 13.014 1.236 1.00 0.00 H new ATOM 0 HB2 PRO A 71 37.350 11.413 1.660 1.00 0.00 H new ATOM 0 HB3 PRO A 71 37.336 13.097 2.145 1.00 0.00 H new ATOM 0 HG2 PRO A 71 36.978 10.642 3.815 1.00 0.00 H new ATOM 0 HG3 PRO A 71 37.757 12.157 4.225 1.00 0.00 H new ATOM 0 HD2 PRO A 71 35.199 11.454 5.047 1.00 0.00 H new ATOM 0 HD3 PRO A 71 35.781 13.105 4.968 1.00 0.00 H new ATOM 564 N PRO A 72 34.446 9.899 2.014 1.00 0.00 N ATOM 565 CA PRO A 72 33.992 8.642 1.407 1.00 0.00 C ATOM 566 C PRO A 72 32.602 8.785 0.780 1.00 0.00 C ATOM 567 O PRO A 72 32.331 8.254 -0.279 1.00 0.00 O ATOM 568 CB PRO A 72 33.931 7.669 2.581 1.00 0.00 C ATOM 569 CG PRO A 72 33.727 8.528 3.783 1.00 0.00 C ATOM 570 CD PRO A 72 34.355 9.863 3.488 1.00 0.00 C ATOM 0 HA PRO A 72 34.654 8.318 0.604 1.00 0.00 H new ATOM 0 HB2 PRO A 72 33.115 6.957 2.462 1.00 0.00 H new ATOM 0 HB3 PRO A 72 34.850 7.089 2.661 1.00 0.00 H new ATOM 0 HG2 PRO A 72 32.665 8.642 3.999 1.00 0.00 H new ATOM 0 HG3 PRO A 72 34.184 8.074 4.662 1.00 0.00 H new ATOM 0 HD2 PRO A 72 33.747 10.683 3.870 1.00 0.00 H new ATOM 0 HD3 PRO A 72 35.338 9.952 3.951 1.00 0.00 H new ATOM 578 N ARG A 73 31.721 9.499 1.425 1.00 0.00 N ATOM 579 CA ARG A 73 30.350 9.673 0.867 1.00 0.00 C ATOM 580 C ARG A 73 30.291 10.964 0.045 1.00 0.00 C ATOM 581 O ARG A 73 29.288 11.277 -0.564 1.00 0.00 O ATOM 582 CB ARG A 73 29.340 9.754 2.013 1.00 0.00 C ATOM 583 CG ARG A 73 27.920 9.731 1.444 1.00 0.00 C ATOM 584 CD ARG A 73 26.911 9.882 2.585 1.00 0.00 C ATOM 585 NE ARG A 73 25.530 9.711 2.053 1.00 0.00 N ATOM 586 CZ ARG A 73 25.041 8.513 1.881 1.00 0.00 C ATOM 587 NH1 ARG A 73 25.383 7.813 0.835 1.00 0.00 N ATOM 588 NH2 ARG A 73 24.208 8.017 2.754 1.00 0.00 N ATOM 0 H ARG A 73 31.891 9.969 2.314 1.00 0.00 H new ATOM 0 HA ARG A 73 30.109 8.824 0.227 1.00 0.00 H new ATOM 0 HB2 ARG A 73 29.483 8.918 2.697 1.00 0.00 H new ATOM 0 HB3 ARG A 73 29.498 10.667 2.588 1.00 0.00 H new ATOM 0 HG2 ARG A 73 27.793 10.538 0.722 1.00 0.00 H new ATOM 0 HG3 ARG A 73 27.745 8.796 0.911 1.00 0.00 H new ATOM 0 HD2 ARG A 73 27.108 9.141 3.359 1.00 0.00 H new ATOM 0 HD3 ARG A 73 27.015 10.863 3.049 1.00 0.00 H new ATOM 0 HE ARG A 73 24.967 10.530 1.823 1.00 0.00 H new ATOM 0 HH11 ARG A 73 26.033 8.202 0.151 1.00 0.00 H new ATOM 0 HH12 ARG A 73 25.001 6.877 0.701 1.00 0.00 H new ATOM 0 HH21 ARG A 73 23.939 8.565 3.571 1.00 0.00 H new ATOM 0 HH22 ARG A 73 23.826 7.081 2.620 1.00 0.00 H new ATOM 602 N ASN A 74 31.357 11.716 0.023 1.00 0.00 N ATOM 603 CA ASN A 74 31.358 12.984 -0.761 1.00 0.00 C ATOM 604 C ASN A 74 30.263 13.912 -0.228 1.00 0.00 C ATOM 605 O ASN A 74 29.502 14.487 -0.981 1.00 0.00 O ATOM 606 CB ASN A 74 31.090 12.673 -2.235 1.00 0.00 C ATOM 607 CG ASN A 74 32.198 11.765 -2.773 1.00 0.00 C ATOM 608 OD1 ASN A 74 33.246 11.644 -2.172 1.00 0.00 O ATOM 609 ND2 ASN A 74 32.008 11.117 -3.891 1.00 0.00 N ATOM 0 H ASN A 74 32.227 11.508 0.513 1.00 0.00 H new ATOM 0 HA ASN A 74 32.328 13.471 -0.664 1.00 0.00 H new ATOM 0 HB2 ASN A 74 30.121 12.187 -2.345 1.00 0.00 H new ATOM 0 HB3 ASN A 74 31.050 13.597 -2.812 1.00 0.00 H new ATOM 0 HD21 ASN A 74 32.740 10.509 -4.259 1.00 0.00 H new ATOM 0 HD22 ASN A 74 31.128 11.219 -4.396 1.00 0.00 H new ATOM 616 N CYS A 75 30.177 14.062 1.065 1.00 0.00 N ATOM 617 CA CYS A 75 29.133 14.953 1.645 1.00 0.00 C ATOM 618 C CYS A 75 29.679 15.624 2.907 1.00 0.00 C ATOM 619 O CYS A 75 30.420 15.032 3.665 1.00 0.00 O ATOM 620 CB CYS A 75 27.896 14.125 2.001 1.00 0.00 C ATOM 621 SG CYS A 75 28.291 13.011 3.372 1.00 0.00 S ATOM 0 H CYS A 75 30.785 13.606 1.745 1.00 0.00 H new ATOM 0 HA CYS A 75 28.861 15.717 0.916 1.00 0.00 H new ATOM 0 HB2 CYS A 75 27.072 14.783 2.278 1.00 0.00 H new ATOM 0 HB3 CYS A 75 27.568 13.551 1.135 1.00 0.00 H new ATOM 0 HG CYS A 75 27.814 13.499 4.479 1.00 0.00 H new ATOM 627 N ALA A 76 29.321 16.859 3.136 1.00 0.00 N ATOM 628 CA ALA A 76 29.821 17.567 4.348 1.00 0.00 C ATOM 629 C ALA A 76 28.663 17.800 5.320 1.00 0.00 C ATOM 630 O ALA A 76 27.511 17.833 4.933 1.00 0.00 O ATOM 631 CB ALA A 76 30.422 18.913 3.940 1.00 0.00 C ATOM 0 H ALA A 76 28.704 17.407 2.536 1.00 0.00 H new ATOM 0 HA ALA A 76 30.584 16.959 4.833 1.00 0.00 H new ATOM 0 HB1 ALA A 76 30.788 19.432 4.826 1.00 0.00 H new ATOM 0 HB2 ALA A 76 31.249 18.748 3.249 1.00 0.00 H new ATOM 0 HB3 ALA A 76 29.658 19.520 3.454 1.00 0.00 H new ATOM 637 N PHE A 77 28.959 17.960 6.582 1.00 0.00 N ATOM 638 CA PHE A 77 27.875 18.191 7.579 1.00 0.00 C ATOM 639 C PHE A 77 28.085 19.547 8.254 1.00 0.00 C ATOM 640 O PHE A 77 29.171 19.871 8.694 1.00 0.00 O ATOM 641 CB PHE A 77 27.911 17.084 8.634 1.00 0.00 C ATOM 642 CG PHE A 77 27.657 15.749 7.974 1.00 0.00 C ATOM 643 CD1 PHE A 77 26.345 15.293 7.799 1.00 0.00 C ATOM 644 CD2 PHE A 77 28.734 14.968 7.536 1.00 0.00 C ATOM 645 CE1 PHE A 77 26.111 14.056 7.187 1.00 0.00 C ATOM 646 CE2 PHE A 77 28.499 13.732 6.924 1.00 0.00 C ATOM 647 CZ PHE A 77 27.187 13.275 6.750 1.00 0.00 C ATOM 0 H PHE A 77 29.904 17.941 6.965 1.00 0.00 H new ATOM 0 HA PHE A 77 26.908 18.182 7.076 1.00 0.00 H new ATOM 0 HB2 PHE A 77 28.879 17.076 9.134 1.00 0.00 H new ATOM 0 HB3 PHE A 77 27.158 17.272 9.399 1.00 0.00 H new ATOM 0 HD1 PHE A 77 25.514 15.895 8.136 1.00 0.00 H new ATOM 0 HD2 PHE A 77 29.746 15.320 7.671 1.00 0.00 H new ATOM 0 HE1 PHE A 77 25.099 13.704 7.052 1.00 0.00 H new ATOM 0 HE2 PHE A 77 29.330 13.130 6.586 1.00 0.00 H new ATOM 0 HZ PHE A 77 27.005 12.320 6.279 1.00 0.00 H new ATOM 657 N VAL A 78 27.055 20.345 8.340 1.00 0.00 N ATOM 658 CA VAL A 78 27.199 21.681 8.987 1.00 0.00 C ATOM 659 C VAL A 78 26.161 21.824 10.102 1.00 0.00 C ATOM 660 O VAL A 78 24.971 21.743 9.870 1.00 0.00 O ATOM 661 CB VAL A 78 26.984 22.776 7.943 1.00 0.00 C ATOM 662 CG1 VAL A 78 27.208 24.146 8.587 1.00 0.00 C ATOM 663 CG2 VAL A 78 27.973 22.586 6.792 1.00 0.00 C ATOM 0 H VAL A 78 26.121 20.130 7.991 1.00 0.00 H new ATOM 0 HA VAL A 78 28.199 21.775 9.411 1.00 0.00 H new ATOM 0 HB VAL A 78 25.965 22.717 7.560 1.00 0.00 H new ATOM 0 HG11 VAL A 78 27.055 24.927 7.843 1.00 0.00 H new ATOM 0 HG12 VAL A 78 26.503 24.282 9.407 1.00 0.00 H new ATOM 0 HG13 VAL A 78 28.226 24.205 8.971 1.00 0.00 H new ATOM 0 HG21 VAL A 78 27.819 23.367 6.048 1.00 0.00 H new ATOM 0 HG22 VAL A 78 28.992 22.645 7.174 1.00 0.00 H new ATOM 0 HG23 VAL A 78 27.813 21.611 6.333 1.00 0.00 H new ATOM 673 N THR A 79 26.602 22.039 11.312 1.00 0.00 N ATOM 674 CA THR A 79 25.643 22.189 12.443 1.00 0.00 C ATOM 675 C THR A 79 25.361 23.675 12.678 1.00 0.00 C ATOM 676 O THR A 79 26.265 24.485 12.737 1.00 0.00 O ATOM 677 CB THR A 79 26.248 21.576 13.708 1.00 0.00 C ATOM 678 OG1 THR A 79 26.748 20.279 13.410 1.00 0.00 O ATOM 679 CG2 THR A 79 25.175 21.474 14.793 1.00 0.00 C ATOM 0 H THR A 79 27.587 22.117 11.566 1.00 0.00 H new ATOM 0 HA THR A 79 24.711 21.677 12.202 1.00 0.00 H new ATOM 0 HB THR A 79 27.062 22.208 14.065 1.00 0.00 H new ATOM 0 HG1 THR A 79 27.598 20.359 12.929 1.00 0.00 H new ATOM 0 HG21 THR A 79 25.608 21.037 15.693 1.00 0.00 H new ATOM 0 HG22 THR A 79 24.792 22.469 15.021 1.00 0.00 H new ATOM 0 HG23 THR A 79 24.359 20.843 14.440 1.00 0.00 H new ATOM 687 N TYR A 80 24.115 24.040 12.811 1.00 0.00 N ATOM 688 CA TYR A 80 23.779 25.476 13.039 1.00 0.00 C ATOM 689 C TYR A 80 23.176 25.648 14.435 1.00 0.00 C ATOM 690 O TYR A 80 22.404 24.831 14.893 1.00 0.00 O ATOM 691 CB TYR A 80 22.768 25.938 11.986 1.00 0.00 C ATOM 692 CG TYR A 80 23.503 26.557 10.823 1.00 0.00 C ATOM 693 CD1 TYR A 80 24.499 27.513 11.054 1.00 0.00 C ATOM 694 CD2 TYR A 80 23.188 26.177 9.513 1.00 0.00 C ATOM 695 CE1 TYR A 80 25.181 28.089 9.975 1.00 0.00 C ATOM 696 CE2 TYR A 80 23.870 26.752 8.435 1.00 0.00 C ATOM 697 CZ TYR A 80 24.867 27.708 8.665 1.00 0.00 C ATOM 698 OH TYR A 80 25.539 28.275 7.602 1.00 0.00 O ATOM 0 H TYR A 80 23.316 23.408 12.772 1.00 0.00 H new ATOM 0 HA TYR A 80 24.686 26.076 12.961 1.00 0.00 H new ATOM 0 HB2 TYR A 80 22.170 25.093 11.644 1.00 0.00 H new ATOM 0 HB3 TYR A 80 22.078 26.661 12.421 1.00 0.00 H new ATOM 0 HD1 TYR A 80 24.742 27.806 12.065 1.00 0.00 H new ATOM 0 HD2 TYR A 80 22.419 25.440 9.334 1.00 0.00 H new ATOM 0 HE1 TYR A 80 25.949 28.827 10.153 1.00 0.00 H new ATOM 0 HE2 TYR A 80 23.627 26.458 7.424 1.00 0.00 H new ATOM 0 HH TYR A 80 26.091 29.018 7.923 1.00 0.00 H new ATOM 708 N GLU A 81 23.524 26.707 15.113 1.00 0.00 N ATOM 709 CA GLU A 81 22.972 26.932 16.479 1.00 0.00 C ATOM 710 C GLU A 81 21.447 27.032 16.408 1.00 0.00 C ATOM 711 O GLU A 81 20.749 26.683 17.339 1.00 0.00 O ATOM 712 CB GLU A 81 23.542 28.233 17.051 1.00 0.00 C ATOM 713 CG GLU A 81 23.180 28.340 18.534 1.00 0.00 C ATOM 714 CD GLU A 81 23.686 29.674 19.087 1.00 0.00 C ATOM 715 OE1 GLU A 81 24.297 30.413 18.333 1.00 0.00 O ATOM 716 OE2 GLU A 81 23.453 29.934 20.256 1.00 0.00 O ATOM 0 H GLU A 81 24.166 27.426 14.780 1.00 0.00 H new ATOM 0 HA GLU A 81 23.250 26.097 17.123 1.00 0.00 H new ATOM 0 HB2 GLU A 81 24.625 28.253 16.928 1.00 0.00 H new ATOM 0 HB3 GLU A 81 23.143 29.088 16.506 1.00 0.00 H new ATOM 0 HG2 GLU A 81 22.100 28.267 18.662 1.00 0.00 H new ATOM 0 HG3 GLU A 81 23.623 27.513 19.088 1.00 0.00 H new ATOM 723 N LYS A 82 20.921 27.507 15.312 1.00 0.00 N ATOM 724 CA LYS A 82 19.441 27.629 15.187 1.00 0.00 C ATOM 725 C LYS A 82 18.988 27.038 13.850 1.00 0.00 C ATOM 726 O LYS A 82 19.715 27.050 12.878 1.00 0.00 O ATOM 727 CB LYS A 82 19.044 29.105 15.254 1.00 0.00 C ATOM 728 CG LYS A 82 19.398 29.664 16.634 1.00 0.00 C ATOM 729 CD LYS A 82 18.823 31.076 16.777 1.00 0.00 C ATOM 730 CE LYS A 82 19.451 31.761 17.994 1.00 0.00 C ATOM 731 NZ LYS A 82 19.627 30.765 19.089 1.00 0.00 N ATOM 0 H LYS A 82 21.452 27.816 14.498 1.00 0.00 H new ATOM 0 HA LYS A 82 18.963 27.086 16.002 1.00 0.00 H new ATOM 0 HB2 LYS A 82 19.562 29.668 14.478 1.00 0.00 H new ATOM 0 HB3 LYS A 82 17.976 29.214 15.068 1.00 0.00 H new ATOM 0 HG2 LYS A 82 18.998 29.016 17.414 1.00 0.00 H new ATOM 0 HG3 LYS A 82 20.480 29.686 16.762 1.00 0.00 H new ATOM 0 HD2 LYS A 82 19.024 31.655 15.876 1.00 0.00 H new ATOM 0 HD3 LYS A 82 17.740 31.030 16.891 1.00 0.00 H new ATOM 0 HE2 LYS A 82 20.414 32.195 17.724 1.00 0.00 H new ATOM 0 HE3 LYS A 82 18.816 32.580 18.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 19.758 31.262 19.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 18.783 30.159 19.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 20.462 30.177 18.893 1.00 0.00 H new ATOM 745 N MET A 83 17.789 26.522 13.796 1.00 0.00 N ATOM 746 CA MET A 83 17.290 25.931 12.523 1.00 0.00 C ATOM 747 C MET A 83 17.122 27.035 11.476 1.00 0.00 C ATOM 748 O MET A 83 17.057 26.775 10.291 1.00 0.00 O ATOM 749 CB MET A 83 15.937 25.256 12.769 1.00 0.00 C ATOM 750 CG MET A 83 16.136 24.008 13.633 1.00 0.00 C ATOM 751 SD MET A 83 14.581 23.086 13.729 1.00 0.00 S ATOM 752 CE MET A 83 15.024 22.035 15.134 1.00 0.00 C ATOM 0 H MET A 83 17.135 26.485 14.578 1.00 0.00 H new ATOM 0 HA MET A 83 18.007 25.193 12.162 1.00 0.00 H new ATOM 0 HB2 MET A 83 15.258 25.950 13.265 1.00 0.00 H new ATOM 0 HB3 MET A 83 15.477 24.984 11.819 1.00 0.00 H new ATOM 0 HG2 MET A 83 16.918 23.379 13.208 1.00 0.00 H new ATOM 0 HG3 MET A 83 16.464 24.293 14.632 1.00 0.00 H new ATOM 0 HE1 MET A 83 14.123 21.584 15.549 1.00 0.00 H new ATOM 0 HE2 MET A 83 15.703 21.250 14.801 1.00 0.00 H new ATOM 0 HE3 MET A 83 15.514 22.638 15.899 1.00 0.00 H new ATOM 762 N GLU A 84 17.049 28.265 11.905 1.00 0.00 N ATOM 763 CA GLU A 84 16.882 29.384 10.934 1.00 0.00 C ATOM 764 C GLU A 84 18.117 29.470 10.034 1.00 0.00 C ATOM 765 O GLU A 84 18.012 29.624 8.833 1.00 0.00 O ATOM 766 CB GLU A 84 16.714 30.700 11.695 1.00 0.00 C ATOM 767 CG GLU A 84 15.399 30.674 12.477 1.00 0.00 C ATOM 768 CD GLU A 84 15.221 32.001 13.218 1.00 0.00 C ATOM 769 OE1 GLU A 84 16.155 32.785 13.223 1.00 0.00 O ATOM 770 OE2 GLU A 84 14.151 32.210 13.768 1.00 0.00 O ATOM 0 H GLU A 84 17.098 28.544 12.885 1.00 0.00 H new ATOM 0 HA GLU A 84 15.999 29.203 10.322 1.00 0.00 H new ATOM 0 HB2 GLU A 84 17.552 30.848 12.377 1.00 0.00 H new ATOM 0 HB3 GLU A 84 16.718 31.538 10.998 1.00 0.00 H new ATOM 0 HG2 GLU A 84 14.563 30.509 11.798 1.00 0.00 H new ATOM 0 HG3 GLU A 84 15.401 29.846 13.186 1.00 0.00 H new ATOM 777 N SER A 85 19.287 29.373 10.603 1.00 0.00 N ATOM 778 CA SER A 85 20.526 29.452 9.778 1.00 0.00 C ATOM 779 C SER A 85 20.543 28.302 8.768 1.00 0.00 C ATOM 780 O SER A 85 21.076 28.425 7.682 1.00 0.00 O ATOM 781 CB SER A 85 21.753 29.348 10.686 1.00 0.00 C ATOM 782 OG SER A 85 22.932 29.445 9.902 1.00 0.00 O ATOM 0 H SER A 85 19.439 29.242 11.603 1.00 0.00 H new ATOM 0 HA SER A 85 20.546 30.404 9.247 1.00 0.00 H new ATOM 0 HB2 SER A 85 21.734 30.142 11.433 1.00 0.00 H new ATOM 0 HB3 SER A 85 21.740 28.401 11.226 1.00 0.00 H new ATOM 0 HG SER A 85 23.331 28.556 9.800 1.00 0.00 H new ATOM 788 N ALA A 86 19.967 27.185 9.116 1.00 0.00 N ATOM 789 CA ALA A 86 19.954 26.029 8.177 1.00 0.00 C ATOM 790 C ALA A 86 18.945 26.288 7.056 1.00 0.00 C ATOM 791 O ALA A 86 19.115 25.840 5.940 1.00 0.00 O ATOM 792 CB ALA A 86 19.557 24.762 8.937 1.00 0.00 C ATOM 0 H ALA A 86 19.505 27.023 10.011 1.00 0.00 H new ATOM 0 HA ALA A 86 20.947 25.901 7.746 1.00 0.00 H new ATOM 0 HB1 ALA A 86 19.547 23.915 8.251 1.00 0.00 H new ATOM 0 HB2 ALA A 86 20.277 24.575 9.734 1.00 0.00 H new ATOM 0 HB3 ALA A 86 18.564 24.892 9.368 1.00 0.00 H new ATOM 798 N ASP A 87 17.895 27.008 7.343 1.00 0.00 N ATOM 799 CA ASP A 87 16.878 27.293 6.292 1.00 0.00 C ATOM 800 C ASP A 87 17.483 28.213 5.230 1.00 0.00 C ATOM 801 O ASP A 87 17.391 27.955 4.046 1.00 0.00 O ATOM 802 CB ASP A 87 15.666 27.978 6.928 1.00 0.00 C ATOM 803 CG ASP A 87 14.564 28.142 5.878 1.00 0.00 C ATOM 804 OD1 ASP A 87 14.734 27.627 4.785 1.00 0.00 O ATOM 805 OD2 ASP A 87 13.570 28.778 6.185 1.00 0.00 O ATOM 0 H ASP A 87 17.698 27.411 8.259 1.00 0.00 H new ATOM 0 HA ASP A 87 16.566 26.358 5.827 1.00 0.00 H new ATOM 0 HB2 ASP A 87 15.299 27.386 7.767 1.00 0.00 H new ATOM 0 HB3 ASP A 87 15.952 28.952 7.326 1.00 0.00 H new ATOM 810 N GLN A 88 18.101 29.285 5.643 1.00 0.00 N ATOM 811 CA GLN A 88 18.710 30.221 4.656 1.00 0.00 C ATOM 812 C GLN A 88 19.895 29.539 3.968 1.00 0.00 C ATOM 813 O GLN A 88 20.136 29.729 2.792 1.00 0.00 O ATOM 814 CB GLN A 88 19.195 31.479 5.378 1.00 0.00 C ATOM 815 CG GLN A 88 19.686 32.501 4.350 1.00 0.00 C ATOM 816 CD GLN A 88 20.191 33.751 5.075 1.00 0.00 C ATOM 817 OE1 GLN A 88 20.032 33.879 6.273 1.00 0.00 O ATOM 818 NE2 GLN A 88 20.796 34.685 4.394 1.00 0.00 N ATOM 0 H GLN A 88 18.211 29.553 6.621 1.00 0.00 H new ATOM 0 HA GLN A 88 17.965 30.495 3.909 1.00 0.00 H new ATOM 0 HB2 GLN A 88 18.386 31.905 5.972 1.00 0.00 H new ATOM 0 HB3 GLN A 88 20.000 31.227 6.069 1.00 0.00 H new ATOM 0 HG2 GLN A 88 20.485 32.070 3.746 1.00 0.00 H new ATOM 0 HG3 GLN A 88 18.877 32.765 3.668 1.00 0.00 H new ATOM 0 HE21 GLN A 88 20.930 34.578 3.388 1.00 0.00 H new ATOM 0 HE22 GLN A 88 21.135 35.522 4.867 1.00 0.00 H new ATOM 827 N ALA A 89 20.639 28.748 4.692 1.00 0.00 N ATOM 828 CA ALA A 89 21.808 28.057 4.078 1.00 0.00 C ATOM 829 C ALA A 89 21.319 26.893 3.214 1.00 0.00 C ATOM 830 O ALA A 89 21.690 26.762 2.064 1.00 0.00 O ATOM 831 CB ALA A 89 22.722 27.523 5.183 1.00 0.00 C ATOM 0 H ALA A 89 20.488 28.551 5.681 1.00 0.00 H new ATOM 0 HA ALA A 89 22.361 28.762 3.457 1.00 0.00 H new ATOM 0 HB1 ALA A 89 23.577 27.017 4.735 1.00 0.00 H new ATOM 0 HB2 ALA A 89 23.072 28.352 5.798 1.00 0.00 H new ATOM 0 HB3 ALA A 89 22.169 26.819 5.804 1.00 0.00 H new ATOM 837 N VAL A 90 20.489 26.046 3.760 1.00 0.00 N ATOM 838 CA VAL A 90 19.979 24.891 2.969 1.00 0.00 C ATOM 839 C VAL A 90 19.121 25.403 1.810 1.00 0.00 C ATOM 840 O VAL A 90 19.094 24.824 0.743 1.00 0.00 O ATOM 841 CB VAL A 90 19.128 23.992 3.871 1.00 0.00 C ATOM 842 CG1 VAL A 90 18.514 22.866 3.036 1.00 0.00 C ATOM 843 CG2 VAL A 90 20.008 23.392 4.969 1.00 0.00 C ATOM 0 H VAL A 90 20.143 26.104 4.718 1.00 0.00 H new ATOM 0 HA VAL A 90 20.821 24.322 2.575 1.00 0.00 H new ATOM 0 HB VAL A 90 18.332 24.582 4.326 1.00 0.00 H new ATOM 0 HG11 VAL A 90 17.908 22.226 3.678 1.00 0.00 H new ATOM 0 HG12 VAL A 90 17.887 23.294 2.254 1.00 0.00 H new ATOM 0 HG13 VAL A 90 19.309 22.275 2.581 1.00 0.00 H new ATOM 0 HG21 VAL A 90 19.403 22.752 5.611 1.00 0.00 H new ATOM 0 HG22 VAL A 90 20.804 22.802 4.515 1.00 0.00 H new ATOM 0 HG23 VAL A 90 20.445 24.194 5.564 1.00 0.00 H new ATOM 853 N ALA A 91 18.421 26.485 2.012 1.00 0.00 N ATOM 854 CA ALA A 91 17.564 27.033 0.922 1.00 0.00 C ATOM 855 C ALA A 91 18.427 27.824 -0.063 1.00 0.00 C ATOM 856 O ALA A 91 18.296 27.690 -1.264 1.00 0.00 O ATOM 857 CB ALA A 91 16.502 27.955 1.525 1.00 0.00 C ATOM 0 H ALA A 91 18.405 27.014 2.884 1.00 0.00 H new ATOM 0 HA ALA A 91 17.078 26.211 0.396 1.00 0.00 H new ATOM 0 HB1 ALA A 91 15.875 28.357 0.729 1.00 0.00 H new ATOM 0 HB2 ALA A 91 15.885 27.391 2.224 1.00 0.00 H new ATOM 0 HB3 ALA A 91 16.989 28.775 2.052 1.00 0.00 H new ATOM 863 N GLU A 92 19.305 28.651 0.434 1.00 0.00 N ATOM 864 CA GLU A 92 20.173 29.453 -0.475 1.00 0.00 C ATOM 865 C GLU A 92 21.263 28.558 -1.068 1.00 0.00 C ATOM 866 O GLU A 92 21.520 28.580 -2.255 1.00 0.00 O ATOM 867 CB GLU A 92 20.821 30.594 0.313 1.00 0.00 C ATOM 868 CG GLU A 92 21.272 31.689 -0.652 1.00 0.00 C ATOM 869 CD GLU A 92 22.063 32.751 0.116 1.00 0.00 C ATOM 870 OE1 GLU A 92 21.767 32.953 1.282 1.00 0.00 O ATOM 871 OE2 GLU A 92 22.950 33.345 -0.475 1.00 0.00 O ATOM 0 H GLU A 92 19.459 28.806 1.430 1.00 0.00 H new ATOM 0 HA GLU A 92 19.567 29.866 -1.281 1.00 0.00 H new ATOM 0 HB2 GLU A 92 20.112 31.000 1.035 1.00 0.00 H new ATOM 0 HB3 GLU A 92 21.674 30.220 0.880 1.00 0.00 H new ATOM 0 HG2 GLU A 92 21.889 31.261 -1.442 1.00 0.00 H new ATOM 0 HG3 GLU A 92 20.406 32.143 -1.134 1.00 0.00 H new ATOM 878 N LEU A 93 21.912 27.775 -0.250 1.00 0.00 N ATOM 879 CA LEU A 93 22.988 26.884 -0.768 1.00 0.00 C ATOM 880 C LEU A 93 22.385 25.854 -1.726 1.00 0.00 C ATOM 881 O LEU A 93 22.942 25.557 -2.764 1.00 0.00 O ATOM 882 CB LEU A 93 23.657 26.161 0.402 1.00 0.00 C ATOM 883 CG LEU A 93 24.191 27.191 1.400 1.00 0.00 C ATOM 884 CD1 LEU A 93 24.590 26.484 2.695 1.00 0.00 C ATOM 885 CD2 LEU A 93 25.413 27.892 0.803 1.00 0.00 C ATOM 0 H LEU A 93 21.744 27.714 0.754 1.00 0.00 H new ATOM 0 HA LEU A 93 23.729 27.482 -1.299 1.00 0.00 H new ATOM 0 HB2 LEU A 93 22.942 25.501 0.892 1.00 0.00 H new ATOM 0 HB3 LEU A 93 24.472 25.535 0.038 1.00 0.00 H new ATOM 0 HG LEU A 93 23.417 27.929 1.612 1.00 0.00 H new ATOM 0 HD11 LEU A 93 24.971 27.216 3.407 1.00 0.00 H new ATOM 0 HD12 LEU A 93 23.720 25.984 3.119 1.00 0.00 H new ATOM 0 HD13 LEU A 93 25.365 25.747 2.483 1.00 0.00 H new ATOM 0 HD21 LEU A 93 25.794 28.626 1.513 1.00 0.00 H new ATOM 0 HD22 LEU A 93 26.188 27.155 0.591 1.00 0.00 H new ATOM 0 HD23 LEU A 93 25.129 28.395 -0.121 1.00 0.00 H new ATOM 897 N ASN A 94 21.251 25.306 -1.387 1.00 0.00 N ATOM 898 CA ASN A 94 20.616 24.295 -2.279 1.00 0.00 C ATOM 899 C ASN A 94 20.231 24.953 -3.606 1.00 0.00 C ATOM 900 O ASN A 94 19.550 25.959 -3.636 1.00 0.00 O ATOM 901 CB ASN A 94 19.363 23.734 -1.606 1.00 0.00 C ATOM 902 CG ASN A 94 18.764 22.630 -2.482 1.00 0.00 C ATOM 903 OD1 ASN A 94 19.387 22.181 -3.423 1.00 0.00 O ATOM 904 ND2 ASN A 94 17.573 22.173 -2.210 1.00 0.00 N ATOM 0 H ASN A 94 20.737 25.514 -0.531 1.00 0.00 H new ATOM 0 HA ASN A 94 21.321 23.485 -2.467 1.00 0.00 H new ATOM 0 HB2 ASN A 94 19.613 23.337 -0.622 1.00 0.00 H new ATOM 0 HB3 ASN A 94 18.633 24.528 -1.453 1.00 0.00 H new ATOM 0 HD21 ASN A 94 17.164 21.438 -2.788 1.00 0.00 H new ATOM 0 HD22 ASN A 94 17.050 22.550 -1.420 1.00 0.00 H new ATOM 911 N GLY A 95 20.662 24.392 -4.703 1.00 0.00 N ATOM 912 CA GLY A 95 20.320 24.985 -6.027 1.00 0.00 C ATOM 913 C GLY A 95 21.417 25.965 -6.448 1.00 0.00 C ATOM 914 O GLY A 95 21.183 26.888 -7.203 1.00 0.00 O ATOM 0 H GLY A 95 21.236 23.549 -4.740 1.00 0.00 H new ATOM 0 HA2 GLY A 95 20.215 24.198 -6.774 1.00 0.00 H new ATOM 0 HA3 GLY A 95 19.361 25.500 -5.970 1.00 0.00 H new ATOM 918 N THR A 96 22.615 25.774 -5.966 1.00 0.00 N ATOM 919 CA THR A 96 23.725 26.695 -6.341 1.00 0.00 C ATOM 920 C THR A 96 24.846 25.897 -7.009 1.00 0.00 C ATOM 921 O THR A 96 24.934 24.694 -6.869 1.00 0.00 O ATOM 922 CB THR A 96 24.266 27.380 -5.083 1.00 0.00 C ATOM 923 OG1 THR A 96 25.050 26.455 -4.342 1.00 0.00 O ATOM 924 CG2 THR A 96 23.099 27.867 -4.222 1.00 0.00 C ATOM 0 H THR A 96 22.873 25.020 -5.329 1.00 0.00 H new ATOM 0 HA THR A 96 23.353 27.449 -7.034 1.00 0.00 H new ATOM 0 HB THR A 96 24.883 28.232 -5.370 1.00 0.00 H new ATOM 0 HG1 THR A 96 24.487 26.008 -3.676 1.00 0.00 H new ATOM 0 HG21 THR A 96 23.486 28.354 -3.327 1.00 0.00 H new ATOM 0 HG22 THR A 96 22.498 28.577 -4.791 1.00 0.00 H new ATOM 0 HG23 THR A 96 22.480 27.017 -3.934 1.00 0.00 H new ATOM 932 N GLN A 97 25.704 26.559 -7.738 1.00 0.00 N ATOM 933 CA GLN A 97 26.817 25.837 -8.415 1.00 0.00 C ATOM 934 C GLN A 97 28.141 26.548 -8.120 1.00 0.00 C ATOM 935 O GLN A 97 28.183 27.746 -7.926 1.00 0.00 O ATOM 936 CB GLN A 97 26.573 25.823 -9.926 1.00 0.00 C ATOM 937 CG GLN A 97 27.674 25.015 -10.613 1.00 0.00 C ATOM 938 CD GLN A 97 27.439 25.014 -12.125 1.00 0.00 C ATOM 939 OE1 GLN A 97 26.430 25.503 -12.595 1.00 0.00 O ATOM 940 NE2 GLN A 97 28.334 24.483 -12.912 1.00 0.00 N ATOM 0 H GLN A 97 25.682 27.567 -7.893 1.00 0.00 H new ATOM 0 HA GLN A 97 26.863 24.813 -8.045 1.00 0.00 H new ATOM 0 HB2 GLN A 97 25.598 25.387 -10.144 1.00 0.00 H new ATOM 0 HB3 GLN A 97 26.560 26.842 -10.312 1.00 0.00 H new ATOM 0 HG2 GLN A 97 28.650 25.444 -10.386 1.00 0.00 H new ATOM 0 HG3 GLN A 97 27.680 23.993 -10.235 1.00 0.00 H new ATOM 0 HE21 GLN A 97 29.181 24.073 -12.518 1.00 0.00 H new ATOM 0 HE22 GLN A 97 28.187 24.478 -13.921 1.00 0.00 H new ATOM 949 N VAL A 98 29.221 25.817 -8.084 1.00 0.00 N ATOM 950 CA VAL A 98 30.540 26.452 -7.800 1.00 0.00 C ATOM 951 C VAL A 98 31.271 26.715 -9.119 1.00 0.00 C ATOM 952 O VAL A 98 30.660 26.919 -10.149 1.00 0.00 O ATOM 953 CB VAL A 98 31.385 25.519 -6.926 1.00 0.00 C ATOM 954 CG1 VAL A 98 32.317 26.352 -6.044 1.00 0.00 C ATOM 955 CG2 VAL A 98 30.469 24.673 -6.037 1.00 0.00 C ATOM 0 H VAL A 98 29.248 24.809 -8.239 1.00 0.00 H new ATOM 0 HA VAL A 98 30.382 27.394 -7.274 1.00 0.00 H new ATOM 0 HB VAL A 98 31.975 24.863 -7.566 1.00 0.00 H new ATOM 0 HG11 VAL A 98 32.918 25.689 -5.422 1.00 0.00 H new ATOM 0 HG12 VAL A 98 32.973 26.953 -6.674 1.00 0.00 H new ATOM 0 HG13 VAL A 98 31.724 27.009 -5.407 1.00 0.00 H new ATOM 0 HG21 VAL A 98 31.074 24.011 -5.417 1.00 0.00 H new ATOM 0 HG22 VAL A 98 29.876 25.328 -5.398 1.00 0.00 H new ATOM 0 HG23 VAL A 98 29.804 24.077 -6.662 1.00 0.00 H new ATOM 965 N GLU A 99 32.577 26.713 -9.096 1.00 0.00 N ATOM 966 CA GLU A 99 33.344 26.964 -10.348 1.00 0.00 C ATOM 967 C GLU A 99 32.880 25.992 -11.436 1.00 0.00 C ATOM 968 O GLU A 99 32.772 26.348 -12.593 1.00 0.00 O ATOM 969 CB GLU A 99 34.837 26.755 -10.082 1.00 0.00 C ATOM 970 CG GLU A 99 35.329 27.809 -9.088 1.00 0.00 C ATOM 971 CD GLU A 99 36.841 27.669 -8.905 1.00 0.00 C ATOM 972 OE1 GLU A 99 37.392 26.703 -9.406 1.00 0.00 O ATOM 973 OE2 GLU A 99 37.423 28.531 -8.266 1.00 0.00 O ATOM 0 H GLU A 99 33.144 26.548 -8.265 1.00 0.00 H new ATOM 0 HA GLU A 99 33.173 27.988 -10.679 1.00 0.00 H new ATOM 0 HB2 GLU A 99 35.010 25.755 -9.684 1.00 0.00 H new ATOM 0 HB3 GLU A 99 35.397 26.829 -11.014 1.00 0.00 H new ATOM 0 HG2 GLU A 99 35.087 28.808 -9.451 1.00 0.00 H new ATOM 0 HG3 GLU A 99 34.823 27.686 -8.131 1.00 0.00 H new ATOM 980 N SER A 100 32.603 24.769 -11.075 1.00 0.00 N ATOM 981 CA SER A 100 32.146 23.778 -12.089 1.00 0.00 C ATOM 982 C SER A 100 31.518 22.576 -11.382 1.00 0.00 C ATOM 983 O SER A 100 31.567 21.463 -11.868 1.00 0.00 O ATOM 984 CB SER A 100 33.342 23.312 -12.922 1.00 0.00 C ATOM 985 OG SER A 100 33.697 24.327 -13.849 1.00 0.00 O ATOM 0 H SER A 100 32.674 24.413 -10.122 1.00 0.00 H new ATOM 0 HA SER A 100 31.407 24.242 -12.742 1.00 0.00 H new ATOM 0 HB2 SER A 100 34.187 23.087 -12.271 1.00 0.00 H new ATOM 0 HB3 SER A 100 33.094 22.392 -13.451 1.00 0.00 H new ATOM 0 HG SER A 100 33.105 25.099 -13.731 1.00 0.00 H new ATOM 991 N VAL A 101 30.927 22.789 -10.238 1.00 0.00 N ATOM 992 CA VAL A 101 30.298 21.656 -9.504 1.00 0.00 C ATOM 993 C VAL A 101 29.036 22.147 -8.792 1.00 0.00 C ATOM 994 O VAL A 101 28.978 23.259 -8.307 1.00 0.00 O ATOM 995 CB VAL A 101 31.286 21.107 -8.470 1.00 0.00 C ATOM 996 CG1 VAL A 101 30.655 19.917 -7.746 1.00 0.00 C ATOM 997 CG2 VAL A 101 32.565 20.656 -9.177 1.00 0.00 C ATOM 0 H VAL A 101 30.853 23.698 -9.781 1.00 0.00 H new ATOM 0 HA VAL A 101 30.034 20.868 -10.209 1.00 0.00 H new ATOM 0 HB VAL A 101 31.527 21.886 -7.747 1.00 0.00 H new ATOM 0 HG11 VAL A 101 31.357 19.525 -7.010 1.00 0.00 H new ATOM 0 HG12 VAL A 101 29.743 20.239 -7.243 1.00 0.00 H new ATOM 0 HG13 VAL A 101 30.414 19.137 -8.469 1.00 0.00 H new ATOM 0 HG21 VAL A 101 33.269 20.265 -8.442 1.00 0.00 H new ATOM 0 HG22 VAL A 101 32.325 19.876 -9.900 1.00 0.00 H new ATOM 0 HG23 VAL A 101 33.014 21.505 -9.693 1.00 0.00 H new ATOM 1007 N GLN A 102 28.024 21.325 -8.724 1.00 0.00 N ATOM 1008 CA GLN A 102 26.768 21.745 -8.043 1.00 0.00 C ATOM 1009 C GLN A 102 26.801 21.280 -6.585 1.00 0.00 C ATOM 1010 O GLN A 102 27.410 20.282 -6.255 1.00 0.00 O ATOM 1011 CB GLN A 102 25.567 21.114 -8.751 1.00 0.00 C ATOM 1012 CG GLN A 102 25.554 21.548 -10.219 1.00 0.00 C ATOM 1013 CD GLN A 102 24.409 20.843 -10.948 1.00 0.00 C ATOM 1014 OE1 GLN A 102 23.853 19.886 -10.448 1.00 0.00 O ATOM 1015 NE2 GLN A 102 24.031 21.277 -12.119 1.00 0.00 N ATOM 0 H GLN A 102 28.014 20.381 -9.111 1.00 0.00 H new ATOM 0 HA GLN A 102 26.681 22.831 -8.078 1.00 0.00 H new ATOM 0 HB2 GLN A 102 25.621 20.027 -8.682 1.00 0.00 H new ATOM 0 HB3 GLN A 102 24.642 21.419 -8.262 1.00 0.00 H new ATOM 0 HG2 GLN A 102 25.433 22.629 -10.289 1.00 0.00 H new ATOM 0 HG3 GLN A 102 26.506 21.303 -10.691 1.00 0.00 H new ATOM 0 HE21 GLN A 102 24.497 22.081 -12.540 1.00 0.00 H new ATOM 0 HE22 GLN A 102 23.269 20.813 -12.613 1.00 0.00 H new ATOM 1024 N LEU A 103 26.151 21.997 -5.708 1.00 0.00 N ATOM 1025 CA LEU A 103 26.148 21.594 -4.273 1.00 0.00 C ATOM 1026 C LEU A 103 24.717 21.271 -3.836 1.00 0.00 C ATOM 1027 O LEU A 103 23.789 21.996 -4.134 1.00 0.00 O ATOM 1028 CB LEU A 103 26.692 22.740 -3.418 1.00 0.00 C ATOM 1029 CG LEU A 103 28.149 23.015 -3.799 1.00 0.00 C ATOM 1030 CD1 LEU A 103 28.624 24.294 -3.106 1.00 0.00 C ATOM 1031 CD2 LEU A 103 29.023 21.841 -3.356 1.00 0.00 C ATOM 0 H LEU A 103 25.623 22.843 -5.923 1.00 0.00 H new ATOM 0 HA LEU A 103 26.777 20.713 -4.144 1.00 0.00 H new ATOM 0 HB2 LEU A 103 26.091 23.637 -3.568 1.00 0.00 H new ATOM 0 HB3 LEU A 103 26.624 22.483 -2.361 1.00 0.00 H new ATOM 0 HG LEU A 103 28.225 23.137 -4.880 1.00 0.00 H new ATOM 0 HD11 LEU A 103 29.661 24.491 -3.377 1.00 0.00 H new ATOM 0 HD12 LEU A 103 28.002 25.131 -3.421 1.00 0.00 H new ATOM 0 HD13 LEU A 103 28.548 24.172 -2.026 1.00 0.00 H new ATOM 0 HD21 LEU A 103 30.060 22.037 -3.627 1.00 0.00 H new ATOM 0 HD22 LEU A 103 28.947 21.719 -2.276 1.00 0.00 H new ATOM 0 HD23 LEU A 103 28.685 20.929 -3.849 1.00 0.00 H new ATOM 1043 N LYS A 104 24.532 20.189 -3.130 1.00 0.00 N ATOM 1044 CA LYS A 104 23.163 19.822 -2.674 1.00 0.00 C ATOM 1045 C LYS A 104 23.094 19.918 -1.149 1.00 0.00 C ATOM 1046 O LYS A 104 23.978 19.466 -0.448 1.00 0.00 O ATOM 1047 CB LYS A 104 22.845 18.391 -3.109 1.00 0.00 C ATOM 1048 CG LYS A 104 22.881 18.302 -4.636 1.00 0.00 C ATOM 1049 CD LYS A 104 22.504 16.885 -5.073 1.00 0.00 C ATOM 1050 CE LYS A 104 22.666 16.758 -6.589 1.00 0.00 C ATOM 1051 NZ LYS A 104 21.327 16.579 -7.219 1.00 0.00 N ATOM 0 H LYS A 104 25.270 19.544 -2.850 1.00 0.00 H new ATOM 0 HA LYS A 104 22.437 20.504 -3.116 1.00 0.00 H new ATOM 0 HB2 LYS A 104 23.568 17.699 -2.677 1.00 0.00 H new ATOM 0 HB3 LYS A 104 21.862 18.097 -2.740 1.00 0.00 H new ATOM 0 HG2 LYS A 104 22.189 19.024 -5.069 1.00 0.00 H new ATOM 0 HG3 LYS A 104 23.876 18.554 -5.002 1.00 0.00 H new ATOM 0 HD2 LYS A 104 23.137 16.156 -4.567 1.00 0.00 H new ATOM 0 HD3 LYS A 104 21.475 16.667 -4.787 1.00 0.00 H new ATOM 0 HE2 LYS A 104 23.152 17.648 -6.989 1.00 0.00 H new ATOM 0 HE3 LYS A 104 23.308 15.910 -6.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 21.437 16.493 -8.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 20.880 15.718 -6.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 20.729 17.402 -7.002 1.00 0.00 H new ATOM 1065 N VAL A 105 22.051 20.505 -0.627 1.00 0.00 N ATOM 1066 CA VAL A 105 21.930 20.628 0.853 1.00 0.00 C ATOM 1067 C VAL A 105 20.678 19.889 1.327 1.00 0.00 C ATOM 1068 O VAL A 105 19.636 19.946 0.705 1.00 0.00 O ATOM 1069 CB VAL A 105 21.825 22.105 1.235 1.00 0.00 C ATOM 1070 CG1 VAL A 105 21.913 22.245 2.757 1.00 0.00 C ATOM 1071 CG2 VAL A 105 22.970 22.884 0.584 1.00 0.00 C ATOM 0 H VAL A 105 21.279 20.904 -1.161 1.00 0.00 H new ATOM 0 HA VAL A 105 22.810 20.192 1.326 1.00 0.00 H new ATOM 0 HB VAL A 105 20.872 22.503 0.887 1.00 0.00 H new ATOM 0 HG11 VAL A 105 21.838 23.297 3.030 1.00 0.00 H new ATOM 0 HG12 VAL A 105 21.097 21.691 3.221 1.00 0.00 H new ATOM 0 HG13 VAL A 105 22.866 21.847 3.105 1.00 0.00 H new ATOM 0 HG21 VAL A 105 22.895 23.937 0.856 1.00 0.00 H new ATOM 0 HG22 VAL A 105 23.924 22.487 0.931 1.00 0.00 H new ATOM 0 HG23 VAL A 105 22.908 22.784 -0.500 1.00 0.00 H new ATOM 1081 N ASN A 106 20.771 19.194 2.428 1.00 0.00 N ATOM 1082 CA ASN A 106 19.588 18.452 2.944 1.00 0.00 C ATOM 1083 C ASN A 106 19.581 18.508 4.473 1.00 0.00 C ATOM 1084 O ASN A 106 20.408 19.156 5.083 1.00 0.00 O ATOM 1085 CB ASN A 106 19.659 16.994 2.485 1.00 0.00 C ATOM 1086 CG ASN A 106 19.400 16.921 0.979 1.00 0.00 C ATOM 1087 OD1 ASN A 106 18.758 17.788 0.418 1.00 0.00 O ATOM 1088 ND2 ASN A 106 19.875 15.916 0.296 1.00 0.00 N ATOM 0 H ASN A 106 21.616 19.109 2.992 1.00 0.00 H new ATOM 0 HA ASN A 106 18.676 18.908 2.559 1.00 0.00 H new ATOM 0 HB2 ASN A 106 20.638 16.576 2.717 1.00 0.00 H new ATOM 0 HB3 ASN A 106 18.922 16.396 3.021 1.00 0.00 H new ATOM 0 HD21 ASN A 106 19.708 15.858 -0.709 1.00 0.00 H new ATOM 0 HD22 ASN A 106 20.414 15.189 0.767 1.00 0.00 H new ATOM 1095 N ILE A 107 18.654 17.836 5.097 1.00 0.00 N ATOM 1096 CA ILE A 107 18.596 17.853 6.585 1.00 0.00 C ATOM 1097 C ILE A 107 19.229 16.574 7.138 1.00 0.00 C ATOM 1098 O ILE A 107 18.984 15.489 6.651 1.00 0.00 O ATOM 1099 CB ILE A 107 17.136 17.936 7.037 1.00 0.00 C ATOM 1100 CG1 ILE A 107 16.483 19.175 6.425 1.00 0.00 C ATOM 1101 CG2 ILE A 107 17.079 18.029 8.563 1.00 0.00 C ATOM 1102 CD1 ILE A 107 15.038 19.284 6.915 1.00 0.00 C ATOM 0 H ILE A 107 17.934 17.276 4.641 1.00 0.00 H new ATOM 0 HA ILE A 107 19.143 18.718 6.959 1.00 0.00 H new ATOM 0 HB ILE A 107 16.602 17.045 6.708 1.00 0.00 H new ATOM 0 HG12 ILE A 107 17.041 20.069 6.704 1.00 0.00 H new ATOM 0 HG13 ILE A 107 16.506 19.111 5.337 1.00 0.00 H new ATOM 0 HG21 ILE A 107 16.039 18.088 8.885 1.00 0.00 H new ATOM 0 HG22 ILE A 107 17.544 17.145 8.999 1.00 0.00 H new ATOM 0 HG23 ILE A 107 17.613 18.920 8.893 1.00 0.00 H new ATOM 0 HD11 ILE A 107 14.572 20.167 6.479 1.00 0.00 H new ATOM 0 HD12 ILE A 107 14.484 18.395 6.614 1.00 0.00 H new ATOM 0 HD13 ILE A 107 15.028 19.367 8.002 1.00 0.00 H new ATOM 1114 N ALA A 108 20.043 16.695 8.150 1.00 0.00 N ATOM 1115 CA ALA A 108 20.691 15.487 8.734 1.00 0.00 C ATOM 1116 C ALA A 108 20.217 15.301 10.176 1.00 0.00 C ATOM 1117 O ALA A 108 19.990 16.255 10.893 1.00 0.00 O ATOM 1118 CB ALA A 108 22.211 15.664 8.715 1.00 0.00 C ATOM 0 H ALA A 108 20.288 17.578 8.598 1.00 0.00 H new ATOM 0 HA ALA A 108 20.420 14.610 8.147 1.00 0.00 H new ATOM 0 HB1 ALA A 108 22.686 14.781 9.142 1.00 0.00 H new ATOM 0 HB2 ALA A 108 22.549 15.796 7.687 1.00 0.00 H new ATOM 0 HB3 ALA A 108 22.483 16.541 9.302 1.00 0.00 H new ATOM 1124 N ARG A 109 20.064 14.079 10.608 1.00 0.00 N ATOM 1125 CA ARG A 109 19.605 13.835 12.003 1.00 0.00 C ATOM 1126 C ARG A 109 20.755 13.249 12.824 1.00 0.00 C ATOM 1127 O ARG A 109 20.546 12.550 13.795 1.00 0.00 O ATOM 1128 CB ARG A 109 18.434 12.849 11.989 1.00 0.00 C ATOM 1129 CG ARG A 109 17.329 13.388 11.079 1.00 0.00 C ATOM 1130 CD ARG A 109 16.171 12.389 11.034 1.00 0.00 C ATOM 1131 NE ARG A 109 15.220 12.780 9.955 1.00 0.00 N ATOM 1132 CZ ARG A 109 14.281 11.955 9.581 1.00 0.00 C ATOM 1133 NH1 ARG A 109 14.543 10.682 9.456 1.00 0.00 N ATOM 1134 NH2 ARG A 109 13.081 12.402 9.333 1.00 0.00 N ATOM 0 H ARG A 109 20.237 13.240 10.055 1.00 0.00 H new ATOM 0 HA ARG A 109 19.283 14.776 12.449 1.00 0.00 H new ATOM 0 HB2 ARG A 109 18.769 11.874 11.635 1.00 0.00 H new ATOM 0 HB3 ARG A 109 18.051 12.707 13.000 1.00 0.00 H new ATOM 0 HG2 ARG A 109 16.978 14.352 11.448 1.00 0.00 H new ATOM 0 HG3 ARG A 109 17.719 13.554 10.075 1.00 0.00 H new ATOM 0 HD2 ARG A 109 16.551 11.384 10.852 1.00 0.00 H new ATOM 0 HD3 ARG A 109 15.658 12.367 11.995 1.00 0.00 H new ATOM 0 HE ARG A 109 15.303 13.693 9.509 1.00 0.00 H new ATOM 0 HH11 ARG A 109 15.481 10.333 9.651 1.00 0.00 H new ATOM 0 HH12 ARG A 109 13.809 10.037 9.164 1.00 0.00 H new ATOM 0 HH21 ARG A 109 12.877 13.396 9.431 1.00 0.00 H new ATOM 0 HH22 ARG A 109 12.347 11.757 9.041 1.00 0.00 H new ATOM 1148 N LYS A 110 21.971 13.532 12.443 1.00 0.00 N ATOM 1149 CA LYS A 110 23.135 12.993 13.202 1.00 0.00 C ATOM 1150 C LYS A 110 23.481 13.946 14.347 1.00 0.00 C ATOM 1151 O LYS A 110 24.536 13.856 14.944 1.00 0.00 O ATOM 1152 CB LYS A 110 24.339 12.863 12.267 1.00 0.00 C ATOM 1153 CG LYS A 110 24.016 11.865 11.154 1.00 0.00 C ATOM 1154 CD LYS A 110 25.242 11.694 10.254 1.00 0.00 C ATOM 1155 CE LYS A 110 24.900 10.753 9.097 1.00 0.00 C ATOM 1156 NZ LYS A 110 25.831 9.589 9.112 1.00 0.00 N ATOM 0 H LYS A 110 22.209 14.113 11.639 1.00 0.00 H new ATOM 0 HA LYS A 110 22.882 12.013 13.607 1.00 0.00 H new ATOM 0 HB2 LYS A 110 24.586 13.834 11.838 1.00 0.00 H new ATOM 0 HB3 LYS A 110 25.213 12.529 12.827 1.00 0.00 H new ATOM 0 HG2 LYS A 110 23.729 10.905 11.583 1.00 0.00 H new ATOM 0 HG3 LYS A 110 23.167 12.219 10.568 1.00 0.00 H new ATOM 0 HD2 LYS A 110 25.560 12.662 9.867 1.00 0.00 H new ATOM 0 HD3 LYS A 110 26.075 11.291 10.830 1.00 0.00 H new ATOM 0 HE2 LYS A 110 23.869 10.409 9.186 1.00 0.00 H new ATOM 0 HE3 LYS A 110 24.978 11.283 8.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 25.599 8.949 8.326 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 26.809 9.926 9.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 25.735 9.079 10.013 1.00 0.00 H new ATOM 1170 N GLN A 111 22.603 14.862 14.658 1.00 0.00 N ATOM 1171 CA GLN A 111 22.890 15.818 15.764 1.00 0.00 C ATOM 1172 C GLN A 111 21.818 15.691 16.846 1.00 0.00 C ATOM 1173 O GLN A 111 20.998 16.569 17.027 1.00 0.00 O ATOM 1174 CB GLN A 111 22.892 17.247 15.217 1.00 0.00 C ATOM 1175 CG GLN A 111 23.334 18.214 16.320 1.00 0.00 C ATOM 1176 CD GLN A 111 24.617 17.694 16.970 1.00 0.00 C ATOM 1177 OE1 GLN A 111 24.576 16.798 17.791 1.00 0.00 O ATOM 1178 NE2 GLN A 111 25.763 18.221 16.635 1.00 0.00 N ATOM 0 H GLN A 111 21.703 14.989 14.195 1.00 0.00 H new ATOM 0 HA GLN A 111 23.866 15.589 16.192 1.00 0.00 H new ATOM 0 HB2 GLN A 111 23.565 17.320 14.363 1.00 0.00 H new ATOM 0 HB3 GLN A 111 21.897 17.514 14.862 1.00 0.00 H new ATOM 0 HG2 GLN A 111 23.502 19.207 15.902 1.00 0.00 H new ATOM 0 HG3 GLN A 111 22.548 18.312 17.069 1.00 0.00 H new ATOM 0 HE21 GLN A 111 25.797 18.973 15.946 1.00 0.00 H new ATOM 0 HE22 GLN A 111 26.625 17.881 17.062 1.00 0.00 H new ATOM 1187 N PRO A 112 21.836 14.576 17.587 1.00 0.00 N ATOM 1188 CA PRO A 112 20.874 14.328 18.666 1.00 0.00 C ATOM 1189 C PRO A 112 21.172 15.215 19.874 1.00 0.00 C ATOM 1190 O PRO A 112 20.340 15.415 20.737 1.00 0.00 O ATOM 1191 CB PRO A 112 21.106 12.862 19.025 1.00 0.00 C ATOM 1192 CG PRO A 112 22.515 12.587 18.615 1.00 0.00 C ATOM 1193 CD PRO A 112 22.797 13.471 17.431 1.00 0.00 C ATOM 0 HA PRO A 112 19.848 14.543 18.369 1.00 0.00 H new ATOM 0 HB2 PRO A 112 20.963 12.689 20.092 1.00 0.00 H new ATOM 0 HB3 PRO A 112 20.407 12.211 18.500 1.00 0.00 H new ATOM 0 HG2 PRO A 112 23.205 12.801 19.431 1.00 0.00 H new ATOM 0 HG3 PRO A 112 22.645 11.537 18.354 1.00 0.00 H new ATOM 0 HD2 PRO A 112 23.826 13.831 17.435 1.00 0.00 H new ATOM 0 HD3 PRO A 112 22.649 12.941 16.490 1.00 0.00 H new ATOM 1201 N MET A 113 22.359 15.750 19.931 1.00 0.00 N ATOM 1202 CA MET A 113 22.738 16.633 21.066 1.00 0.00 C ATOM 1203 C MET A 113 21.571 17.576 21.380 1.00 0.00 C ATOM 1204 O MET A 113 21.405 18.014 22.502 1.00 0.00 O ATOM 1205 CB MET A 113 23.996 17.423 20.666 1.00 0.00 C ATOM 1206 CG MET A 113 24.146 18.705 21.499 1.00 0.00 C ATOM 1207 SD MET A 113 24.566 20.084 20.403 1.00 0.00 S ATOM 1208 CE MET A 113 23.238 19.843 19.195 1.00 0.00 C ATOM 0 H MET A 113 23.089 15.611 19.232 1.00 0.00 H new ATOM 0 HA MET A 113 22.955 16.049 21.960 1.00 0.00 H new ATOM 0 HB2 MET A 113 24.878 16.796 20.799 1.00 0.00 H new ATOM 0 HB3 MET A 113 23.944 17.680 19.608 1.00 0.00 H new ATOM 0 HG2 MET A 113 23.219 18.917 22.031 1.00 0.00 H new ATOM 0 HG3 MET A 113 24.923 18.574 22.252 1.00 0.00 H new ATOM 0 HE1 MET A 113 23.615 20.049 18.193 1.00 0.00 H new ATOM 0 HE2 MET A 113 22.883 18.813 19.245 1.00 0.00 H new ATOM 0 HE3 MET A 113 22.415 20.521 19.419 1.00 0.00 H new ATOM 1218 N LEU A 114 20.760 17.893 20.407 1.00 0.00 N ATOM 1219 CA LEU A 114 19.612 18.806 20.676 1.00 0.00 C ATOM 1220 C LEU A 114 18.670 18.843 19.472 1.00 0.00 C ATOM 1221 O LEU A 114 17.956 19.803 19.268 1.00 0.00 O ATOM 1222 CB LEU A 114 20.140 20.215 20.943 1.00 0.00 C ATOM 1223 CG LEU A 114 19.104 21.003 21.747 1.00 0.00 C ATOM 1224 CD1 LEU A 114 19.819 21.923 22.740 1.00 0.00 C ATOM 1225 CD2 LEU A 114 18.252 21.844 20.794 1.00 0.00 C ATOM 0 H LEU A 114 20.841 17.563 19.445 1.00 0.00 H new ATOM 0 HA LEU A 114 19.065 18.440 21.545 1.00 0.00 H new ATOM 0 HB2 LEU A 114 21.081 20.165 21.492 1.00 0.00 H new ATOM 0 HB3 LEU A 114 20.347 20.722 20.001 1.00 0.00 H new ATOM 0 HG LEU A 114 18.463 20.310 22.292 1.00 0.00 H new ATOM 0 HD11 LEU A 114 19.081 22.484 23.313 1.00 0.00 H new ATOM 0 HD12 LEU A 114 20.426 21.324 23.419 1.00 0.00 H new ATOM 0 HD13 LEU A 114 20.460 22.617 22.196 1.00 0.00 H new ATOM 0 HD21 LEU A 114 17.513 22.406 21.366 1.00 0.00 H new ATOM 0 HD22 LEU A 114 18.893 22.537 20.249 1.00 0.00 H new ATOM 0 HD23 LEU A 114 17.742 21.189 20.088 1.00 0.00 H new ATOM 1237 N ASP A 115 18.657 17.808 18.678 1.00 0.00 N ATOM 1238 CA ASP A 115 17.755 17.794 17.491 1.00 0.00 C ATOM 1239 C ASP A 115 17.784 19.167 16.816 1.00 0.00 C ATOM 1240 O ASP A 115 16.765 19.692 16.411 1.00 0.00 O ATOM 1241 CB ASP A 115 16.327 17.477 17.940 1.00 0.00 C ATOM 1242 CG ASP A 115 16.208 15.982 18.248 1.00 0.00 C ATOM 1243 OD1 ASP A 115 17.146 15.260 17.951 1.00 0.00 O ATOM 1244 OD2 ASP A 115 15.182 15.587 18.774 1.00 0.00 O ATOM 0 H ASP A 115 19.230 16.973 18.799 1.00 0.00 H new ATOM 0 HA ASP A 115 18.091 17.034 16.786 1.00 0.00 H new ATOM 0 HB2 ASP A 115 16.074 18.062 18.824 1.00 0.00 H new ATOM 0 HB3 ASP A 115 15.619 17.756 17.160 1.00 0.00 H new ATOM 1249 N ALA A 116 18.947 19.753 16.698 1.00 0.00 N ATOM 1250 CA ALA A 116 19.055 21.094 16.054 1.00 0.00 C ATOM 1251 C ALA A 116 18.632 22.182 17.038 1.00 0.00 C ATOM 1252 O ALA A 116 19.445 22.944 17.520 1.00 0.00 O ATOM 1253 CB ALA A 116 18.153 21.159 14.826 1.00 0.00 C ATOM 0 H ALA A 116 19.830 19.358 17.022 1.00 0.00 H new ATOM 0 HA ALA A 116 20.091 21.252 15.755 1.00 0.00 H new ATOM 0 HB1 ALA A 116 18.239 22.142 14.363 1.00 0.00 H new ATOM 0 HB2 ALA A 116 18.456 20.394 14.111 1.00 0.00 H new ATOM 0 HB3 ALA A 116 17.119 20.988 15.125 1.00 0.00 H new ATOM 1259 N ALA A 117 17.366 22.274 17.331 1.00 0.00 N ATOM 1260 CA ALA A 117 16.913 23.331 18.273 1.00 0.00 C ATOM 1261 C ALA A 117 15.468 23.071 18.716 1.00 0.00 C ATOM 1262 O ALA A 117 15.223 22.564 19.793 1.00 0.00 O ATOM 1263 CB ALA A 117 17.001 24.689 17.577 1.00 0.00 C ATOM 0 H ALA A 117 16.632 21.669 16.963 1.00 0.00 H new ATOM 0 HA ALA A 117 17.553 23.322 19.156 1.00 0.00 H new ATOM 0 HB1 ALA A 117 16.670 25.471 18.261 1.00 0.00 H new ATOM 0 HB2 ALA A 117 18.032 24.879 17.280 1.00 0.00 H new ATOM 0 HB3 ALA A 117 16.363 24.687 16.693 1.00 0.00 H new ATOM 1269 N THR A 118 14.509 23.422 17.901 1.00 0.00 N ATOM 1270 CA THR A 118 13.086 23.201 18.289 1.00 0.00 C ATOM 1271 C THR A 118 12.872 21.732 18.660 1.00 0.00 C ATOM 1272 O THR A 118 11.905 21.382 19.307 1.00 0.00 O ATOM 1273 CB THR A 118 12.166 23.576 17.122 1.00 0.00 C ATOM 1274 OG1 THR A 118 12.389 22.689 16.037 1.00 0.00 O ATOM 1275 CG2 THR A 118 12.456 25.012 16.679 1.00 0.00 C ATOM 0 H THR A 118 14.649 23.851 16.986 1.00 0.00 H new ATOM 0 HA THR A 118 12.850 23.827 19.149 1.00 0.00 H new ATOM 0 HB THR A 118 11.127 23.501 17.443 1.00 0.00 H new ATOM 0 HG1 THR A 118 11.799 22.929 15.292 1.00 0.00 H new ATOM 0 HG21 THR A 118 11.801 25.276 15.849 1.00 0.00 H new ATOM 0 HG22 THR A 118 12.279 25.692 17.512 1.00 0.00 H new ATOM 0 HG23 THR A 118 13.495 25.092 16.360 1.00 0.00 H new ATOM 1283 N GLY A 119 13.765 20.869 18.260 1.00 0.00 N ATOM 1284 CA GLY A 119 13.607 19.427 18.598 1.00 0.00 C ATOM 1285 C GLY A 119 13.378 19.281 20.105 1.00 0.00 C ATOM 1286 O GLY A 119 13.982 19.971 20.903 1.00 0.00 O ATOM 0 H GLY A 119 14.596 21.100 17.715 1.00 0.00 H new ATOM 0 HA2 GLY A 119 12.767 19.003 18.048 1.00 0.00 H new ATOM 0 HA3 GLY A 119 14.496 18.872 18.298 1.00 0.00 H new ATOM 1290 N LYS A 120 12.509 18.392 20.501 1.00 0.00 N ATOM 1291 CA LYS A 120 12.243 18.205 21.956 1.00 0.00 C ATOM 1292 C LYS A 120 11.692 19.505 22.543 1.00 0.00 C ATOM 1293 O LYS A 120 12.105 19.946 23.597 1.00 0.00 O ATOM 1294 CB LYS A 120 13.544 17.834 22.670 1.00 0.00 C ATOM 1295 CG LYS A 120 14.002 16.449 22.211 1.00 0.00 C ATOM 1296 CD LYS A 120 15.220 16.017 23.029 1.00 0.00 C ATOM 1297 CE LYS A 120 15.780 14.712 22.460 1.00 0.00 C ATOM 1298 NZ LYS A 120 16.379 14.971 21.121 1.00 0.00 N ATOM 0 H LYS A 120 11.972 17.787 19.880 1.00 0.00 H new ATOM 0 HA LYS A 120 11.514 17.406 22.093 1.00 0.00 H new ATOM 0 HB2 LYS A 120 14.314 18.574 22.452 1.00 0.00 H new ATOM 0 HB3 LYS A 120 13.393 17.839 23.749 1.00 0.00 H new ATOM 0 HG2 LYS A 120 13.194 15.728 22.334 1.00 0.00 H new ATOM 0 HG3 LYS A 120 14.252 16.470 21.150 1.00 0.00 H new ATOM 0 HD2 LYS A 120 15.983 16.795 23.003 1.00 0.00 H new ATOM 0 HD3 LYS A 120 14.940 15.880 24.073 1.00 0.00 H new ATOM 0 HE2 LYS A 120 16.532 14.302 23.134 1.00 0.00 H new ATOM 0 HE3 LYS A 120 14.987 13.969 22.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 17.028 14.197 20.875 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 15.624 15.029 20.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 16.904 15.869 21.143 1.00 0.00 H new ATOM 1312 N SER A 121 10.760 20.123 21.871 1.00 0.00 N ATOM 1313 CA SER A 121 10.184 21.394 22.391 1.00 0.00 C ATOM 1314 C SER A 121 9.112 21.902 21.424 1.00 0.00 C ATOM 1315 O SER A 121 7.977 21.475 21.551 1.00 0.00 O ATOM 1316 CB SER A 121 11.291 22.442 22.521 1.00 0.00 C ATOM 1317 OG SER A 121 11.827 22.725 21.237 1.00 0.00 O ATOM 1318 OXT SER A 121 9.447 22.708 20.572 1.00 0.00 O ATOM 0 H SER A 121 10.373 19.802 20.984 1.00 0.00 H new ATOM 0 HA SER A 121 9.737 21.216 23.369 1.00 0.00 H new ATOM 0 HB2 SER A 121 10.894 23.352 22.970 1.00 0.00 H new ATOM 0 HB3 SER A 121 12.077 22.077 23.183 1.00 0.00 H new ATOM 0 HG SER A 121 11.216 22.393 20.547 1.00 0.00 H new TER 1324 SER A 121