USER MOD reduce.3.24.130724 H: found=0, std=0, add=859, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 849 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: B 106 G O2' : rot 37:sc= 0.305 USER MOD Set 1.2: B 107 U O3' : rot -97:sc= 0.275 USER MOD Set 2.1: A 44 TYR OH : rot -145:sc= 1.21 USER MOD Set 2.2: B 105 A O2' : rot 25:sc= 1.23 USER MOD Set 3.1: A 37 TYR OH : rot 78:sc= 1.34 USER MOD Set 3.2: A 75 MET CE :methyl -131:sc= -0.981 (180deg=-8.73!) USER MOD Set 4.1: A 22 THR OG1 : rot -42:sc= 1.34 USER MOD Set 4.2: A 25 THR OG1 : rot -70:sc= 1.25 USER MOD Set 5.1: A 13 MET CE :methyl -156:sc= -0.224 (180deg=-0.332) USER MOD Set 5.2: A 63 HIS : no HD1:sc= -0.72 K(o=-0.94,f=-0.39) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -155:sc= 1.43 (180deg=0.414) USER MOD Single : A 2 SER OG : rot -41:sc= 0.385 USER MOD Single : A 3 TYR OH : rot 180:sc= -0.0904 USER MOD Single : A 14 THR OG1 : rot -130:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= -0.0196 USER MOD Single : A 17 LYS NZ :NH3+ 174:sc= 0.846 (180deg=0.766) USER MOD Single : A 20 ASN : amide:sc= 1.17 K(o=1.2,f=-0.021) USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= 0.00391 USER MOD Single : A 29 THR OG1 : rot 51:sc= 0.905 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 TYR OH : rot 18:sc= 1.22 USER MOD Single : A 51 THR OG1 : rot 148:sc= 0.935 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 SER OG : rot 68:sc= 1.28 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 MET CE :methyl -145:sc= 0 (180deg=-1.17) USER MOD Single : A 88 GLN : amide:sc= -1.23 K(o=-1.2,f=-2.4) USER MOD Single : A 89 MET CE :methyl 180:sc= -0.313 (180deg=-0.313) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 99 HIS : no HD1:sc= -0.804 X(o=-0.8,f=-0.94) USER MOD Single : A 100 HIS : no HD1:sc= 0.0987 K(o=0.099,f=-2.2!) USER MOD Single : A 101 SER OG : rot 31:sc= 0.233 USER MOD Single : B 102 U O2' : rot 34:sc= 0.132 USER MOD Single : B 102 U O5' : rot 180:sc= 0 USER MOD Single : B 103 C O2' : rot 21:sc= 0.742 USER MOD Single : B 104 C O2' : rot 83:sc= 1.12 USER MOD Single : B 107 U O2' : rot -25:sc= 0.0699 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -4.784 21.861 3.368 1.00 0.00 N ATOM 2 CA MET A 1 -4.767 20.456 3.820 1.00 0.00 C ATOM 3 C MET A 1 -3.866 19.609 2.925 1.00 0.00 C ATOM 4 O MET A 1 -3.278 20.116 1.972 1.00 0.00 O ATOM 5 CB MET A 1 -6.190 19.872 3.894 1.00 0.00 C ATOM 6 CG MET A 1 -6.833 19.661 2.518 1.00 0.00 C ATOM 7 SD MET A 1 -7.189 21.169 1.584 1.00 0.00 S ATOM 8 CE MET A 1 -7.934 20.419 0.115 1.00 0.00 C ATOM 0 H1 MET A 1 -5.022 22.480 4.169 1.00 0.00 H new ATOM 0 H2 MET A 1 -3.847 22.118 2.998 1.00 0.00 H new ATOM 0 H3 MET A 1 -5.495 21.976 2.618 1.00 0.00 H new ATOM 0 HA MET A 1 -4.355 20.435 4.829 1.00 0.00 H new ATOM 0 HB2 MET A 1 -6.157 18.919 4.421 1.00 0.00 H new ATOM 0 HB3 MET A 1 -6.819 20.540 4.482 1.00 0.00 H new ATOM 0 HG2 MET A 1 -6.173 19.032 1.921 1.00 0.00 H new ATOM 0 HG3 MET A 1 -7.764 19.109 2.652 1.00 0.00 H new ATOM 0 HE1 MET A 1 -8.222 21.202 -0.587 1.00 0.00 H new ATOM 0 HE2 MET A 1 -7.213 19.754 -0.360 1.00 0.00 H new ATOM 0 HE3 MET A 1 -8.817 19.849 0.405 1.00 0.00 H new ATOM 18 N SER A 2 -3.751 18.312 3.230 1.00 0.00 N ATOM 19 CA SER A 2 -2.932 17.388 2.452 1.00 0.00 C ATOM 20 C SER A 2 -3.598 16.014 2.351 1.00 0.00 C ATOM 21 O SER A 2 -3.012 15.071 1.817 1.00 0.00 O ATOM 22 CB SER A 2 -1.550 17.293 3.102 1.00 0.00 C ATOM 23 OG SER A 2 -0.650 16.618 2.255 1.00 0.00 O ATOM 0 H SER A 2 -4.224 17.878 4.023 1.00 0.00 H new ATOM 0 HA SER A 2 -2.825 17.761 1.433 1.00 0.00 H new ATOM 0 HB2 SER A 2 -1.174 18.293 3.318 1.00 0.00 H new ATOM 0 HB3 SER A 2 -1.625 16.768 4.054 1.00 0.00 H new ATOM 0 HG SER A 2 -1.102 15.854 1.840 1.00 0.00 H new ATOM 29 N TYR A 3 -4.831 15.899 2.858 1.00 0.00 N ATOM 30 CA TYR A 3 -5.601 14.661 2.834 1.00 0.00 C ATOM 31 C TYR A 3 -7.075 14.979 2.612 1.00 0.00 C ATOM 32 O TYR A 3 -7.458 16.146 2.551 1.00 0.00 O ATOM 33 CB TYR A 3 -5.427 13.914 4.157 1.00 0.00 C ATOM 34 CG TYR A 3 -3.975 13.684 4.515 1.00 0.00 C ATOM 35 CD1 TYR A 3 -3.317 12.546 4.033 1.00 0.00 C ATOM 36 CD2 TYR A 3 -3.292 14.619 5.304 1.00 0.00 C ATOM 37 CE1 TYR A 3 -1.960 12.345 4.317 1.00 0.00 C ATOM 38 CE2 TYR A 3 -1.933 14.435 5.583 1.00 0.00 C ATOM 39 CZ TYR A 3 -1.258 13.304 5.082 1.00 0.00 C ATOM 40 OH TYR A 3 0.067 13.135 5.335 1.00 0.00 O ATOM 0 H TYR A 3 -5.323 16.675 3.300 1.00 0.00 H new ATOM 0 HA TYR A 3 -5.241 14.031 2.020 1.00 0.00 H new ATOM 0 HB2 TYR A 3 -5.908 14.481 4.955 1.00 0.00 H new ATOM 0 HB3 TYR A 3 -5.938 12.953 4.096 1.00 0.00 H new ATOM 0 HD1 TYR A 3 -3.857 11.822 3.441 1.00 0.00 H new ATOM 0 HD2 TYR A 3 -3.813 15.480 5.696 1.00 0.00 H new ATOM 0 HE1 TYR A 3 -1.454 11.463 3.954 1.00 0.00 H new ATOM 0 HE2 TYR A 3 -1.402 15.160 6.182 1.00 0.00 H new ATOM 0 HH TYR A 3 0.396 13.885 5.873 1.00 0.00 H new ATOM 50 N GLY A 4 -7.905 13.943 2.490 1.00 0.00 N ATOM 51 CA GLY A 4 -9.331 14.121 2.283 1.00 0.00 C ATOM 52 C GLY A 4 -10.074 12.796 2.338 1.00 0.00 C ATOM 53 O GLY A 4 -9.454 11.730 2.341 1.00 0.00 O ATOM 0 H GLY A 4 -7.606 12.969 2.532 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -9.728 14.794 3.043 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -9.503 14.595 1.317 1.00 0.00 H new ATOM 57 N ARG A 5 -11.406 12.871 2.378 1.00 0.00 N ATOM 58 CA ARG A 5 -12.279 11.716 2.427 1.00 0.00 C ATOM 59 C ARG A 5 -11.963 10.740 1.296 1.00 0.00 C ATOM 60 O ARG A 5 -11.493 11.145 0.230 1.00 0.00 O ATOM 61 CB ARG A 5 -13.731 12.191 2.380 1.00 0.00 C ATOM 62 CG ARG A 5 -14.054 12.925 1.071 1.00 0.00 C ATOM 63 CD ARG A 5 -15.453 13.542 1.126 1.00 0.00 C ATOM 64 NE ARG A 5 -16.496 12.523 1.307 1.00 0.00 N ATOM 65 CZ ARG A 5 -17.087 12.252 2.477 1.00 0.00 C ATOM 66 NH1 ARG A 5 -16.740 12.896 3.589 1.00 0.00 N ATOM 67 NH2 ARG A 5 -18.035 11.325 2.536 1.00 0.00 N ATOM 0 H ARG A 5 -11.909 13.758 2.377 1.00 0.00 H new ATOM 0 HA ARG A 5 -12.117 11.174 3.358 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -14.396 11.335 2.489 1.00 0.00 H new ATOM 0 HB3 ARG A 5 -13.923 12.853 3.224 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -13.314 13.705 0.894 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -13.991 12.230 0.234 1.00 0.00 H new ATOM 0 HD2 ARG A 5 -15.501 14.260 1.945 1.00 0.00 H new ATOM 0 HD3 ARG A 5 -15.642 14.095 0.206 1.00 0.00 H new ATOM 0 HE ARG A 5 -16.788 11.988 0.489 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -16.012 13.610 3.559 1.00 0.00 H new ATOM 0 HH12 ARG A 5 -17.202 12.676 4.471 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -18.310 10.823 1.692 1.00 0.00 H new ATOM 0 HH22 ARG A 5 -18.488 11.115 3.425 1.00 0.00 H new ATOM 81 N PRO A 6 -12.222 9.449 1.529 1.00 0.00 N ATOM 82 CA PRO A 6 -11.993 8.383 0.570 1.00 0.00 C ATOM 83 C PRO A 6 -12.885 8.581 -0.659 1.00 0.00 C ATOM 84 O PRO A 6 -13.959 9.175 -0.550 1.00 0.00 O ATOM 85 CB PRO A 6 -12.307 7.084 1.317 1.00 0.00 C ATOM 86 CG PRO A 6 -13.246 7.522 2.439 1.00 0.00 C ATOM 87 CD PRO A 6 -12.767 8.936 2.767 1.00 0.00 C ATOM 0 HA PRO A 6 -10.969 8.367 0.196 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -12.781 6.352 0.663 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -11.402 6.621 1.711 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -14.288 7.515 2.118 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -13.175 6.862 3.304 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -13.589 9.557 3.123 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -12.013 8.924 3.554 1.00 0.00 H new ATOM 95 N PRO A 7 -12.454 8.091 -1.827 1.00 0.00 N ATOM 96 CA PRO A 7 -13.173 8.247 -3.078 1.00 0.00 C ATOM 97 C PRO A 7 -14.416 7.360 -3.118 1.00 0.00 C ATOM 98 O PRO A 7 -14.525 6.409 -2.343 1.00 0.00 O ATOM 99 CB PRO A 7 -12.171 7.839 -4.159 1.00 0.00 C ATOM 100 CG PRO A 7 -11.283 6.816 -3.449 1.00 0.00 C ATOM 101 CD PRO A 7 -11.217 7.351 -2.018 1.00 0.00 C ATOM 0 HA PRO A 7 -13.533 9.267 -3.216 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -12.669 7.406 -5.026 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -11.595 8.693 -4.516 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -11.712 5.815 -3.486 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -10.294 6.756 -3.903 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -11.130 6.538 -1.298 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -10.348 7.994 -1.878 1.00 0.00 H new ATOM 109 N PRO A 8 -15.355 7.666 -4.022 1.00 0.00 N ATOM 110 CA PRO A 8 -16.543 6.869 -4.264 1.00 0.00 C ATOM 111 C PRO A 8 -16.233 5.691 -5.190 1.00 0.00 C ATOM 112 O PRO A 8 -15.105 5.527 -5.649 1.00 0.00 O ATOM 113 CB PRO A 8 -17.506 7.839 -4.953 1.00 0.00 C ATOM 114 CG PRO A 8 -16.568 8.709 -5.781 1.00 0.00 C ATOM 115 CD PRO A 8 -15.338 8.839 -4.879 1.00 0.00 C ATOM 0 HA PRO A 8 -16.948 6.442 -3.346 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -18.230 7.316 -5.578 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -18.073 8.427 -4.232 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -16.322 8.243 -6.735 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -17.010 9.680 -6.005 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -14.422 8.880 -5.469 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -15.379 9.755 -4.290 1.00 0.00 H new ATOM 123 N ASP A 9 -17.252 4.867 -5.459 1.00 0.00 N ATOM 124 CA ASP A 9 -17.208 3.766 -6.412 1.00 0.00 C ATOM 125 C ASP A 9 -16.132 2.730 -6.090 1.00 0.00 C ATOM 126 O ASP A 9 -15.754 1.944 -6.955 1.00 0.00 O ATOM 127 CB ASP A 9 -17.084 4.308 -7.837 1.00 0.00 C ATOM 128 CG ASP A 9 -18.228 5.256 -8.178 1.00 0.00 C ATOM 129 OD1 ASP A 9 -19.390 4.792 -8.144 1.00 0.00 O ATOM 130 OD2 ASP A 9 -17.937 6.439 -8.469 1.00 0.00 O ATOM 0 H ASP A 9 -18.159 4.956 -5.000 1.00 0.00 H new ATOM 0 HA ASP A 9 -18.151 3.226 -6.329 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -16.133 4.830 -7.947 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -17.076 3.478 -8.543 1.00 0.00 H new ATOM 135 N VAL A 10 -15.627 2.718 -4.850 1.00 0.00 N ATOM 136 CA VAL A 10 -14.626 1.748 -4.445 1.00 0.00 C ATOM 137 C VAL A 10 -15.184 0.324 -4.533 1.00 0.00 C ATOM 138 O VAL A 10 -14.432 -0.647 -4.585 1.00 0.00 O ATOM 139 CB VAL A 10 -14.123 2.075 -3.034 1.00 0.00 C ATOM 140 CG1 VAL A 10 -13.049 1.092 -2.563 1.00 0.00 C ATOM 141 CG2 VAL A 10 -13.500 3.468 -3.032 1.00 0.00 C ATOM 0 H VAL A 10 -15.901 3.372 -4.117 1.00 0.00 H new ATOM 0 HA VAL A 10 -13.778 1.804 -5.127 1.00 0.00 H new ATOM 0 HB VAL A 10 -14.980 2.012 -2.364 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -12.723 1.363 -1.559 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -13.460 0.082 -2.551 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -12.198 1.129 -3.243 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -13.141 3.705 -2.030 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -12.665 3.494 -3.732 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -14.248 4.202 -3.332 1.00 0.00 H new ATOM 151 N GLU A 11 -16.517 0.198 -4.554 1.00 0.00 N ATOM 152 CA GLU A 11 -17.200 -1.085 -4.685 1.00 0.00 C ATOM 153 C GLU A 11 -17.007 -1.682 -6.084 1.00 0.00 C ATOM 154 O GLU A 11 -17.504 -2.771 -6.368 1.00 0.00 O ATOM 155 CB GLU A 11 -18.689 -0.900 -4.403 1.00 0.00 C ATOM 156 CG GLU A 11 -18.911 -0.293 -3.016 1.00 0.00 C ATOM 157 CD GLU A 11 -20.400 -0.157 -2.713 1.00 0.00 C ATOM 158 OE1 GLU A 11 -20.976 -1.134 -2.181 1.00 0.00 O ATOM 159 OE2 GLU A 11 -20.953 0.923 -3.012 1.00 0.00 O ATOM 0 H GLU A 11 -17.152 0.993 -4.480 1.00 0.00 H new ATOM 0 HA GLU A 11 -16.768 -1.777 -3.962 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -19.129 -0.253 -5.162 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -19.198 -1.862 -4.469 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -18.438 -0.920 -2.260 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -18.434 0.686 -2.962 1.00 0.00 H new ATOM 166 N GLY A 12 -16.284 -0.970 -6.953 1.00 0.00 N ATOM 167 CA GLY A 12 -16.023 -1.379 -8.323 1.00 0.00 C ATOM 168 C GLY A 12 -14.570 -1.110 -8.719 1.00 0.00 C ATOM 169 O GLY A 12 -14.265 -0.996 -9.904 1.00 0.00 O ATOM 0 H GLY A 12 -15.858 -0.075 -6.712 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -16.242 -2.441 -8.435 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -16.691 -0.843 -8.998 1.00 0.00 H new ATOM 173 N MET A 13 -13.677 -1.005 -7.731 1.00 0.00 N ATOM 174 CA MET A 13 -12.258 -0.758 -7.948 1.00 0.00 C ATOM 175 C MET A 13 -11.427 -1.585 -6.964 1.00 0.00 C ATOM 176 O MET A 13 -11.968 -2.181 -6.034 1.00 0.00 O ATOM 177 CB MET A 13 -11.943 0.729 -7.763 1.00 0.00 C ATOM 178 CG MET A 13 -12.672 1.599 -8.791 1.00 0.00 C ATOM 179 SD MET A 13 -12.165 3.340 -8.793 1.00 0.00 S ATOM 180 CE MET A 13 -12.642 3.812 -7.112 1.00 0.00 C ATOM 0 H MET A 13 -13.928 -1.091 -6.746 1.00 0.00 H new ATOM 0 HA MET A 13 -12.006 -1.050 -8.968 1.00 0.00 H new ATOM 0 HB2 MET A 13 -12.229 1.038 -6.758 1.00 0.00 H new ATOM 0 HB3 MET A 13 -10.868 0.886 -7.851 1.00 0.00 H new ATOM 0 HG2 MET A 13 -12.505 1.183 -9.785 1.00 0.00 H new ATOM 0 HG3 MET A 13 -13.744 1.546 -8.599 1.00 0.00 H new ATOM 0 HE1 MET A 13 -12.806 4.889 -7.069 1.00 0.00 H new ATOM 0 HE2 MET A 13 -13.560 3.294 -6.835 1.00 0.00 H new ATOM 0 HE3 MET A 13 -11.848 3.538 -6.418 1.00 0.00 H new ATOM 190 N THR A 14 -10.108 -1.614 -7.170 1.00 0.00 N ATOM 191 CA THR A 14 -9.182 -2.297 -6.278 1.00 0.00 C ATOM 192 C THR A 14 -9.190 -1.623 -4.904 1.00 0.00 C ATOM 193 O THR A 14 -9.660 -0.493 -4.762 1.00 0.00 O ATOM 194 CB THR A 14 -7.788 -2.289 -6.912 1.00 0.00 C ATOM 195 OG1 THR A 14 -7.889 -2.757 -8.240 1.00 0.00 O ATOM 196 CG2 THR A 14 -6.798 -3.190 -6.183 1.00 0.00 C ATOM 0 H THR A 14 -9.656 -1.161 -7.964 1.00 0.00 H new ATOM 0 HA THR A 14 -9.487 -3.333 -6.132 1.00 0.00 H new ATOM 0 HB THR A 14 -7.421 -1.264 -6.858 1.00 0.00 H new ATOM 0 HG1 THR A 14 -7.219 -3.456 -8.392 1.00 0.00 H new ATOM 0 HG21 THR A 14 -5.829 -3.142 -6.679 1.00 0.00 H new ATOM 0 HG22 THR A 14 -6.694 -2.856 -5.151 1.00 0.00 H new ATOM 0 HG23 THR A 14 -7.162 -4.217 -6.197 1.00 0.00 H new ATOM 203 N SER A 15 -8.664 -2.316 -3.888 1.00 0.00 N ATOM 204 CA SER A 15 -8.675 -1.833 -2.516 1.00 0.00 C ATOM 205 C SER A 15 -7.462 -2.363 -1.756 1.00 0.00 C ATOM 206 O SER A 15 -7.617 -3.007 -0.723 1.00 0.00 O ATOM 207 CB SER A 15 -9.964 -2.281 -1.816 1.00 0.00 C ATOM 208 OG SER A 15 -11.101 -1.828 -2.523 1.00 0.00 O ATOM 0 H SER A 15 -8.220 -3.227 -4.001 1.00 0.00 H new ATOM 0 HA SER A 15 -8.632 -0.744 -2.528 1.00 0.00 H new ATOM 0 HB2 SER A 15 -9.985 -3.368 -1.743 1.00 0.00 H new ATOM 0 HB3 SER A 15 -9.984 -1.893 -0.798 1.00 0.00 H new ATOM 0 HG SER A 15 -11.913 -2.125 -2.062 1.00 0.00 H new ATOM 214 N LEU A 16 -6.251 -2.104 -2.253 1.00 0.00 N ATOM 215 CA LEU A 16 -5.047 -2.590 -1.597 1.00 0.00 C ATOM 216 C LEU A 16 -4.879 -1.819 -0.300 1.00 0.00 C ATOM 217 O LEU A 16 -5.249 -0.650 -0.259 1.00 0.00 O ATOM 218 CB LEU A 16 -3.841 -2.336 -2.500 1.00 0.00 C ATOM 219 CG LEU A 16 -2.568 -3.006 -1.966 1.00 0.00 C ATOM 220 CD1 LEU A 16 -2.655 -4.521 -2.123 1.00 0.00 C ATOM 221 CD2 LEU A 16 -1.371 -2.508 -2.763 1.00 0.00 C ATOM 0 H LEU A 16 -6.084 -1.564 -3.102 1.00 0.00 H new ATOM 0 HA LEU A 16 -5.124 -3.659 -1.398 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -4.054 -2.710 -3.502 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -3.675 -1.262 -2.589 1.00 0.00 H new ATOM 0 HG LEU A 16 -2.460 -2.758 -0.910 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -1.744 -4.980 -1.739 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -3.513 -4.896 -1.565 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -2.771 -4.771 -3.178 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -0.463 -2.980 -2.389 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -1.504 -2.760 -3.815 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -1.288 -1.426 -2.657 1.00 0.00 H new ATOM 233 N LYS A 17 -4.325 -2.456 0.733 1.00 0.00 N ATOM 234 CA LYS A 17 -3.986 -1.798 1.983 1.00 0.00 C ATOM 235 C LYS A 17 -2.518 -2.050 2.338 1.00 0.00 C ATOM 236 O LYS A 17 -1.923 -3.029 1.896 1.00 0.00 O ATOM 237 CB LYS A 17 -4.944 -2.267 3.083 1.00 0.00 C ATOM 238 CG LYS A 17 -4.375 -2.258 4.501 1.00 0.00 C ATOM 239 CD LYS A 17 -5.514 -2.537 5.479 1.00 0.00 C ATOM 240 CE LYS A 17 -5.003 -2.716 6.909 1.00 0.00 C ATOM 241 NZ LYS A 17 -4.342 -1.506 7.429 1.00 0.00 N ATOM 0 H LYS A 17 -4.100 -3.451 0.719 1.00 0.00 H new ATOM 0 HA LYS A 17 -4.103 -0.719 1.879 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -5.831 -1.633 3.062 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -5.271 -3.280 2.848 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -3.595 -3.013 4.602 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -3.915 -1.294 4.719 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -6.229 -1.715 5.449 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -6.048 -3.435 5.169 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -5.838 -2.978 7.559 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -4.302 -3.550 6.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -4.105 -1.644 8.432 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -3.471 -1.327 6.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -4.982 -0.692 7.333 1.00 0.00 H new ATOM 255 N VAL A 18 -1.943 -1.153 3.145 1.00 0.00 N ATOM 256 CA VAL A 18 -0.546 -1.182 3.551 1.00 0.00 C ATOM 257 C VAL A 18 -0.449 -0.841 5.035 1.00 0.00 C ATOM 258 O VAL A 18 -1.154 0.061 5.494 1.00 0.00 O ATOM 259 CB VAL A 18 0.193 -0.098 2.770 1.00 0.00 C ATOM 260 CG1 VAL A 18 1.621 0.101 3.267 1.00 0.00 C ATOM 261 CG2 VAL A 18 0.185 -0.332 1.260 1.00 0.00 C ATOM 0 H VAL A 18 -2.457 -0.366 3.542 1.00 0.00 H new ATOM 0 HA VAL A 18 -0.120 -2.167 3.363 1.00 0.00 H new ATOM 0 HB VAL A 18 -0.366 0.818 2.959 1.00 0.00 H new ATOM 0 HG11 VAL A 18 2.105 0.882 2.680 1.00 0.00 H new ATOM 0 HG12 VAL A 18 1.603 0.394 4.317 1.00 0.00 H new ATOM 0 HG13 VAL A 18 2.177 -0.831 3.160 1.00 0.00 H new ATOM 0 HG21 VAL A 18 0.727 0.474 0.764 1.00 0.00 H new ATOM 0 HG22 VAL A 18 0.666 -1.284 1.037 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -0.844 -0.353 0.900 1.00 0.00 H new ATOM 271 N ASP A 19 0.420 -1.553 5.767 1.00 0.00 N ATOM 272 CA ASP A 19 0.598 -1.375 7.203 1.00 0.00 C ATOM 273 C ASP A 19 1.967 -1.890 7.685 1.00 0.00 C ATOM 274 O ASP A 19 2.709 -2.505 6.921 1.00 0.00 O ATOM 275 CB ASP A 19 -0.521 -2.133 7.921 1.00 0.00 C ATOM 276 CG ASP A 19 -0.495 -1.861 9.422 1.00 0.00 C ATOM 277 OD1 ASP A 19 -0.147 -0.714 9.780 1.00 0.00 O ATOM 278 OD2 ASP A 19 -0.817 -2.798 10.188 1.00 0.00 O ATOM 0 H ASP A 19 1.022 -2.274 5.369 1.00 0.00 H new ATOM 0 HA ASP A 19 0.558 -0.310 7.430 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -1.486 -1.836 7.511 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -0.414 -3.203 7.740 1.00 0.00 H new ATOM 283 N ASN A 20 2.275 -1.623 8.966 1.00 0.00 N ATOM 284 CA ASN A 20 3.399 -2.134 9.759 1.00 0.00 C ATOM 285 C ASN A 20 4.502 -1.079 9.928 1.00 0.00 C ATOM 286 O ASN A 20 5.643 -1.427 10.221 1.00 0.00 O ATOM 287 CB ASN A 20 3.954 -3.463 9.233 1.00 0.00 C ATOM 288 CG ASN A 20 4.536 -4.294 10.369 1.00 0.00 C ATOM 289 OD1 ASN A 20 3.794 -4.844 11.177 1.00 0.00 O ATOM 290 ND2 ASN A 20 5.861 -4.400 10.449 1.00 0.00 N ATOM 0 H ASN A 20 1.693 -0.991 9.516 1.00 0.00 H new ATOM 0 HA ASN A 20 2.997 -2.350 10.749 1.00 0.00 H new ATOM 0 HB2 ASN A 20 3.161 -4.022 8.737 1.00 0.00 H new ATOM 0 HB3 ASN A 20 4.724 -3.270 8.486 1.00 0.00 H new ATOM 0 HD21 ASN A 20 6.284 -4.950 11.197 1.00 0.00 H new ATOM 0 HD22 ASN A 20 6.452 -3.931 9.763 1.00 0.00 H new ATOM 297 N LEU A 21 4.169 0.203 9.737 1.00 0.00 N ATOM 298 CA LEU A 21 5.108 1.312 9.833 1.00 0.00 C ATOM 299 C LEU A 21 5.834 1.389 11.184 1.00 0.00 C ATOM 300 O LEU A 21 5.527 0.645 12.118 1.00 0.00 O ATOM 301 CB LEU A 21 4.384 2.627 9.514 1.00 0.00 C ATOM 302 CG LEU A 21 3.076 2.888 10.269 1.00 0.00 C ATOM 303 CD1 LEU A 21 3.175 2.684 11.775 1.00 0.00 C ATOM 304 CD2 LEU A 21 2.608 4.324 10.037 1.00 0.00 C ATOM 0 H LEU A 21 3.220 0.498 9.507 1.00 0.00 H new ATOM 0 HA LEU A 21 5.891 1.135 9.096 1.00 0.00 H new ATOM 0 HB2 LEU A 21 5.067 3.451 9.720 1.00 0.00 H new ATOM 0 HB3 LEU A 21 4.171 2.649 8.445 1.00 0.00 H new ATOM 0 HG LEU A 21 2.372 2.157 9.873 1.00 0.00 H new ATOM 0 HD11 LEU A 21 2.208 2.889 12.234 1.00 0.00 H new ATOM 0 HD12 LEU A 21 3.466 1.655 11.984 1.00 0.00 H new ATOM 0 HD13 LEU A 21 3.923 3.363 12.186 1.00 0.00 H new ATOM 0 HD21 LEU A 21 1.678 4.496 10.579 1.00 0.00 H new ATOM 0 HD22 LEU A 21 3.370 5.017 10.394 1.00 0.00 H new ATOM 0 HD23 LEU A 21 2.442 4.485 8.972 1.00 0.00 H new ATOM 316 N THR A 22 6.805 2.301 11.281 1.00 0.00 N ATOM 317 CA THR A 22 7.596 2.498 12.494 1.00 0.00 C ATOM 318 C THR A 22 6.938 3.516 13.414 1.00 0.00 C ATOM 319 O THR A 22 6.009 4.219 13.022 1.00 0.00 O ATOM 320 CB THR A 22 8.995 3.012 12.144 1.00 0.00 C ATOM 321 OG1 THR A 22 8.912 4.335 11.666 1.00 0.00 O ATOM 322 CG2 THR A 22 9.669 2.146 11.085 1.00 0.00 C ATOM 0 H THR A 22 7.064 2.925 10.517 1.00 0.00 H new ATOM 0 HA THR A 22 7.662 1.533 12.997 1.00 0.00 H new ATOM 0 HB THR A 22 9.595 2.972 13.053 1.00 0.00 H new ATOM 0 HG1 THR A 22 8.145 4.417 11.062 1.00 0.00 H new ATOM 0 HG21 THR A 22 10.659 2.545 10.865 1.00 0.00 H new ATOM 0 HG22 THR A 22 9.763 1.125 11.456 1.00 0.00 H new ATOM 0 HG23 THR A 22 9.067 2.148 10.176 1.00 0.00 H new ATOM 329 N TYR A 23 7.429 3.601 14.653 1.00 0.00 N ATOM 330 CA TYR A 23 6.969 4.569 15.641 1.00 0.00 C ATOM 331 C TYR A 23 7.379 6.000 15.266 1.00 0.00 C ATOM 332 O TYR A 23 7.184 6.921 16.055 1.00 0.00 O ATOM 333 CB TYR A 23 7.505 4.172 17.015 1.00 0.00 C ATOM 334 CG TYR A 23 9.013 4.242 17.136 1.00 0.00 C ATOM 335 CD1 TYR A 23 9.805 3.173 16.687 1.00 0.00 C ATOM 336 CD2 TYR A 23 9.620 5.375 17.703 1.00 0.00 C ATOM 337 CE1 TYR A 23 11.204 3.236 16.793 1.00 0.00 C ATOM 338 CE2 TYR A 23 11.019 5.447 17.803 1.00 0.00 C ATOM 339 CZ TYR A 23 11.814 4.376 17.350 1.00 0.00 C ATOM 340 OH TYR A 23 13.172 4.444 17.452 1.00 0.00 O ATOM 0 H TYR A 23 8.168 2.989 14.999 1.00 0.00 H new ATOM 0 HA TYR A 23 5.879 4.559 15.667 1.00 0.00 H new ATOM 0 HB2 TYR A 23 7.061 4.823 17.768 1.00 0.00 H new ATOM 0 HB3 TYR A 23 7.180 3.156 17.240 1.00 0.00 H new ATOM 0 HD1 TYR A 23 9.337 2.299 16.259 1.00 0.00 H new ATOM 0 HD2 TYR A 23 9.011 6.191 18.062 1.00 0.00 H new ATOM 0 HE1 TYR A 23 11.811 2.412 16.448 1.00 0.00 H new ATOM 0 HE2 TYR A 23 11.485 6.324 18.227 1.00 0.00 H new ATOM 0 HH TYR A 23 13.427 5.299 17.858 1.00 0.00 H new ATOM 350 N ARG A 24 7.948 6.191 14.067 1.00 0.00 N ATOM 351 CA ARG A 24 8.423 7.487 13.585 1.00 0.00 C ATOM 352 C ARG A 24 7.873 7.813 12.201 1.00 0.00 C ATOM 353 O ARG A 24 8.040 8.935 11.727 1.00 0.00 O ATOM 354 CB ARG A 24 9.953 7.478 13.532 1.00 0.00 C ATOM 355 CG ARG A 24 10.611 7.236 14.891 1.00 0.00 C ATOM 356 CD ARG A 24 10.246 8.334 15.886 1.00 0.00 C ATOM 357 NE ARG A 24 10.731 9.648 15.452 1.00 0.00 N ATOM 358 CZ ARG A 24 10.411 10.794 16.055 1.00 0.00 C ATOM 359 NH1 ARG A 24 9.608 10.798 17.115 1.00 0.00 N ATOM 360 NH2 ARG A 24 10.895 11.941 15.597 1.00 0.00 N ATOM 0 H ARG A 24 8.091 5.435 13.398 1.00 0.00 H new ATOM 0 HA ARG A 24 8.069 8.252 14.276 1.00 0.00 H new ATOM 0 HB2 ARG A 24 10.280 6.705 12.837 1.00 0.00 H new ATOM 0 HB3 ARG A 24 10.300 8.432 13.134 1.00 0.00 H new ATOM 0 HG2 ARG A 24 10.297 6.268 15.282 1.00 0.00 H new ATOM 0 HG3 ARG A 24 11.694 7.196 14.771 1.00 0.00 H new ATOM 0 HD2 ARG A 24 9.163 8.369 16.008 1.00 0.00 H new ATOM 0 HD3 ARG A 24 10.669 8.095 16.862 1.00 0.00 H new ATOM 0 HE ARG A 24 11.349 9.688 14.642 1.00 0.00 H new ATOM 0 HH11 ARG A 24 9.232 9.920 17.473 1.00 0.00 H new ATOM 0 HH12 ARG A 24 9.368 11.679 17.570 1.00 0.00 H new ATOM 0 HH21 ARG A 24 11.511 11.946 14.784 1.00 0.00 H new ATOM 0 HH22 ARG A 24 10.651 12.818 16.058 1.00 0.00 H new ATOM 374 N THR A 25 7.218 6.849 11.547 1.00 0.00 N ATOM 375 CA THR A 25 6.627 7.053 10.231 1.00 0.00 C ATOM 376 C THR A 25 5.455 8.030 10.317 1.00 0.00 C ATOM 377 O THR A 25 4.928 8.293 11.401 1.00 0.00 O ATOM 378 CB THR A 25 6.171 5.702 9.681 1.00 0.00 C ATOM 379 OG1 THR A 25 7.282 4.835 9.598 1.00 0.00 O ATOM 380 CG2 THR A 25 5.582 5.806 8.272 1.00 0.00 C ATOM 0 H THR A 25 7.085 5.908 11.919 1.00 0.00 H new ATOM 0 HA THR A 25 7.368 7.485 9.558 1.00 0.00 H new ATOM 0 HB THR A 25 5.403 5.332 10.360 1.00 0.00 H new ATOM 0 HG1 THR A 25 7.881 5.138 8.883 1.00 0.00 H new ATOM 0 HG21 THR A 25 5.275 4.817 7.932 1.00 0.00 H new ATOM 0 HG22 THR A 25 4.717 6.469 8.287 1.00 0.00 H new ATOM 0 HG23 THR A 25 6.334 6.206 7.592 1.00 0.00 H new ATOM 387 N SER A 26 5.046 8.569 9.170 1.00 0.00 N ATOM 388 CA SER A 26 3.970 9.545 9.068 1.00 0.00 C ATOM 389 C SER A 26 3.199 9.305 7.773 1.00 0.00 C ATOM 390 O SER A 26 3.710 8.657 6.861 1.00 0.00 O ATOM 391 CB SER A 26 4.574 10.950 9.081 1.00 0.00 C ATOM 392 OG SER A 26 5.284 11.161 10.285 1.00 0.00 O ATOM 0 H SER A 26 5.463 8.333 8.270 1.00 0.00 H new ATOM 0 HA SER A 26 3.284 9.445 9.909 1.00 0.00 H new ATOM 0 HB2 SER A 26 5.242 11.075 8.229 1.00 0.00 H new ATOM 0 HB3 SER A 26 3.785 11.695 8.980 1.00 0.00 H new ATOM 0 HG SER A 26 5.669 12.062 10.284 1.00 0.00 H new ATOM 398 N PRO A 27 1.965 9.813 7.663 1.00 0.00 N ATOM 399 CA PRO A 27 1.149 9.611 6.482 1.00 0.00 C ATOM 400 C PRO A 27 1.699 10.363 5.271 1.00 0.00 C ATOM 401 O PRO A 27 1.366 10.011 4.142 1.00 0.00 O ATOM 402 CB PRO A 27 -0.251 10.094 6.873 1.00 0.00 C ATOM 403 CG PRO A 27 0.008 11.109 7.982 1.00 0.00 C ATOM 404 CD PRO A 27 1.265 10.581 8.671 1.00 0.00 C ATOM 0 HA PRO A 27 1.139 8.565 6.176 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -0.767 10.549 6.028 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -0.875 9.271 7.222 1.00 0.00 H new ATOM 0 HG2 PRO A 27 0.162 12.110 7.580 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -0.832 11.169 8.674 1.00 0.00 H new ATOM 0 HD2 PRO A 27 1.883 11.399 9.040 1.00 0.00 H new ATOM 0 HD3 PRO A 27 1.010 9.961 9.530 1.00 0.00 H new ATOM 412 N ASP A 28 2.537 11.387 5.475 1.00 0.00 N ATOM 413 CA ASP A 28 3.099 12.133 4.357 1.00 0.00 C ATOM 414 C ASP A 28 4.289 11.395 3.746 1.00 0.00 C ATOM 415 O ASP A 28 4.516 11.477 2.538 1.00 0.00 O ATOM 416 CB ASP A 28 3.512 13.533 4.812 1.00 0.00 C ATOM 417 CG ASP A 28 4.608 13.496 5.873 1.00 0.00 C ATOM 418 OD1 ASP A 28 4.261 13.226 7.046 1.00 0.00 O ATOM 419 OD2 ASP A 28 5.776 13.738 5.505 1.00 0.00 O ATOM 0 H ASP A 28 2.835 11.711 6.395 1.00 0.00 H new ATOM 0 HA ASP A 28 2.332 12.225 3.588 1.00 0.00 H new ATOM 0 HB2 ASP A 28 3.861 14.104 3.952 1.00 0.00 H new ATOM 0 HB3 ASP A 28 2.642 14.055 5.210 1.00 0.00 H new ATOM 424 N THR A 29 5.058 10.666 4.561 1.00 0.00 N ATOM 425 CA THR A 29 6.162 9.887 4.024 1.00 0.00 C ATOM 426 C THR A 29 5.600 8.750 3.192 1.00 0.00 C ATOM 427 O THR A 29 6.055 8.518 2.075 1.00 0.00 O ATOM 428 CB THR A 29 7.052 9.321 5.132 1.00 0.00 C ATOM 429 OG1 THR A 29 6.398 9.329 6.382 1.00 0.00 O ATOM 430 CG2 THR A 29 8.323 10.155 5.247 1.00 0.00 C ATOM 0 H THR A 29 4.936 10.603 5.572 1.00 0.00 H new ATOM 0 HA THR A 29 6.779 10.544 3.411 1.00 0.00 H new ATOM 0 HB THR A 29 7.288 8.290 4.867 1.00 0.00 H new ATOM 0 HG1 THR A 29 5.519 8.906 6.294 1.00 0.00 H new ATOM 0 HG21 THR A 29 8.954 9.749 6.037 1.00 0.00 H new ATOM 0 HG22 THR A 29 8.863 10.127 4.301 1.00 0.00 H new ATOM 0 HG23 THR A 29 8.061 11.186 5.485 1.00 0.00 H new ATOM 437 N LEU A 30 4.607 8.031 3.721 1.00 0.00 N ATOM 438 CA LEU A 30 4.035 6.907 2.996 1.00 0.00 C ATOM 439 C LEU A 30 3.314 7.386 1.738 1.00 0.00 C ATOM 440 O LEU A 30 3.159 6.620 0.793 1.00 0.00 O ATOM 441 CB LEU A 30 3.083 6.118 3.890 1.00 0.00 C ATOM 442 CG LEU A 30 3.778 5.616 5.156 1.00 0.00 C ATOM 443 CD1 LEU A 30 2.704 5.056 6.083 1.00 0.00 C ATOM 444 CD2 LEU A 30 4.780 4.513 4.823 1.00 0.00 C ATOM 0 H LEU A 30 4.191 8.207 4.635 1.00 0.00 H new ATOM 0 HA LEU A 30 4.849 6.248 2.694 1.00 0.00 H new ATOM 0 HB2 LEU A 30 2.237 6.748 4.165 1.00 0.00 H new ATOM 0 HB3 LEU A 30 2.682 5.270 3.335 1.00 0.00 H new ATOM 0 HG LEU A 30 4.319 6.436 5.628 1.00 0.00 H new ATOM 0 HD11 LEU A 30 3.169 4.689 6.998 1.00 0.00 H new ATOM 0 HD12 LEU A 30 1.990 5.842 6.329 1.00 0.00 H new ATOM 0 HD13 LEU A 30 2.185 4.237 5.585 1.00 0.00 H new ATOM 0 HD21 LEU A 30 5.262 4.171 5.739 1.00 0.00 H new ATOM 0 HD22 LEU A 30 4.260 3.678 4.354 1.00 0.00 H new ATOM 0 HD23 LEU A 30 5.534 4.901 4.139 1.00 0.00 H new ATOM 456 N ARG A 31 2.872 8.646 1.709 1.00 0.00 N ATOM 457 CA ARG A 31 2.217 9.196 0.531 1.00 0.00 C ATOM 458 C ARG A 31 3.200 9.267 -0.629 1.00 0.00 C ATOM 459 O ARG A 31 2.843 8.955 -1.760 1.00 0.00 O ATOM 460 CB ARG A 31 1.668 10.586 0.876 1.00 0.00 C ATOM 461 CG ARG A 31 1.044 11.308 -0.323 1.00 0.00 C ATOM 462 CD ARG A 31 -0.092 10.493 -0.948 1.00 0.00 C ATOM 463 NE ARG A 31 -0.759 11.257 -2.011 1.00 0.00 N ATOM 464 CZ ARG A 31 -0.204 11.557 -3.189 1.00 0.00 C ATOM 465 NH1 ARG A 31 1.022 11.144 -3.485 1.00 0.00 N ATOM 466 NH2 ARG A 31 -0.877 12.275 -4.084 1.00 0.00 N ATOM 0 H ARG A 31 2.958 9.299 2.488 1.00 0.00 H new ATOM 0 HA ARG A 31 1.392 8.553 0.227 1.00 0.00 H new ATOM 0 HB2 ARG A 31 0.919 10.488 1.662 1.00 0.00 H new ATOM 0 HB3 ARG A 31 2.475 11.198 1.279 1.00 0.00 H new ATOM 0 HG2 ARG A 31 0.663 12.279 -0.005 1.00 0.00 H new ATOM 0 HG3 ARG A 31 1.812 11.497 -1.073 1.00 0.00 H new ATOM 0 HD2 ARG A 31 0.304 9.563 -1.356 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -0.816 10.222 -0.180 1.00 0.00 H new ATOM 0 HE ARG A 31 -1.711 11.581 -1.838 1.00 0.00 H new ATOM 0 HH11 ARG A 31 1.551 10.591 -2.810 1.00 0.00 H new ATOM 0 HH12 ARG A 31 1.435 11.379 -4.387 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -1.821 12.599 -3.872 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -0.449 12.502 -4.982 1.00 0.00 H new ATOM 480 N ARG A 32 4.439 9.673 -0.347 1.00 0.00 N ATOM 481 CA ARG A 32 5.463 9.835 -1.378 1.00 0.00 C ATOM 482 C ARG A 32 6.157 8.505 -1.665 1.00 0.00 C ATOM 483 O ARG A 32 6.443 8.192 -2.818 1.00 0.00 O ATOM 484 CB ARG A 32 6.477 10.865 -0.876 1.00 0.00 C ATOM 485 CG ARG A 32 7.609 11.072 -1.884 1.00 0.00 C ATOM 486 CD ARG A 32 8.636 12.046 -1.312 1.00 0.00 C ATOM 487 NE ARG A 32 8.061 13.386 -1.133 1.00 0.00 N ATOM 488 CZ ARG A 32 8.673 14.389 -0.496 1.00 0.00 C ATOM 489 NH1 ARG A 32 9.883 14.225 0.041 1.00 0.00 N ATOM 490 NH2 ARG A 32 8.074 15.573 -0.395 1.00 0.00 N ATOM 0 H ARG A 32 4.758 9.897 0.595 1.00 0.00 H new ATOM 0 HA ARG A 32 5.005 10.174 -2.307 1.00 0.00 H new ATOM 0 HB2 ARG A 32 5.973 11.814 -0.693 1.00 0.00 H new ATOM 0 HB3 ARG A 32 6.892 10.535 0.076 1.00 0.00 H new ATOM 0 HG2 ARG A 32 8.085 10.118 -2.111 1.00 0.00 H new ATOM 0 HG3 ARG A 32 7.208 11.460 -2.821 1.00 0.00 H new ATOM 0 HD2 ARG A 32 8.999 11.673 -0.354 1.00 0.00 H new ATOM 0 HD3 ARG A 32 9.496 12.103 -1.979 1.00 0.00 H new ATOM 0 HE ARG A 32 7.134 13.562 -1.520 1.00 0.00 H new ATOM 0 HH11 ARG A 32 10.355 13.324 -0.031 1.00 0.00 H new ATOM 0 HH12 ARG A 32 10.336 15.001 0.524 1.00 0.00 H new ATOM 0 HH21 ARG A 32 7.150 15.713 -0.803 1.00 0.00 H new ATOM 0 HH22 ARG A 32 8.539 16.340 0.091 1.00 0.00 H new ATOM 504 N VAL A 33 6.424 7.725 -0.618 1.00 0.00 N ATOM 505 CA VAL A 33 7.037 6.408 -0.741 1.00 0.00 C ATOM 506 C VAL A 33 6.205 5.487 -1.629 1.00 0.00 C ATOM 507 O VAL A 33 6.769 4.676 -2.358 1.00 0.00 O ATOM 508 CB VAL A 33 7.163 5.802 0.656 1.00 0.00 C ATOM 509 CG1 VAL A 33 7.489 4.312 0.609 1.00 0.00 C ATOM 510 CG2 VAL A 33 8.256 6.525 1.443 1.00 0.00 C ATOM 0 H VAL A 33 6.219 7.993 0.344 1.00 0.00 H new ATOM 0 HA VAL A 33 8.018 6.515 -1.204 1.00 0.00 H new ATOM 0 HB VAL A 33 6.197 5.924 1.147 1.00 0.00 H new ATOM 0 HG11 VAL A 33 7.569 3.925 1.625 1.00 0.00 H new ATOM 0 HG12 VAL A 33 6.696 3.783 0.080 1.00 0.00 H new ATOM 0 HG13 VAL A 33 8.435 4.163 0.088 1.00 0.00 H new ATOM 0 HG21 VAL A 33 8.339 6.087 2.437 1.00 0.00 H new ATOM 0 HG22 VAL A 33 9.208 6.424 0.921 1.00 0.00 H new ATOM 0 HG23 VAL A 33 8.002 7.581 1.532 1.00 0.00 H new ATOM 520 N PHE A 34 4.878 5.611 -1.571 1.00 0.00 N ATOM 521 CA PHE A 34 3.998 4.730 -2.324 1.00 0.00 C ATOM 522 C PHE A 34 3.486 5.379 -3.605 1.00 0.00 C ATOM 523 O PHE A 34 2.911 4.701 -4.453 1.00 0.00 O ATOM 524 CB PHE A 34 2.837 4.305 -1.429 1.00 0.00 C ATOM 525 CG PHE A 34 3.209 3.160 -0.513 1.00 0.00 C ATOM 526 CD1 PHE A 34 3.877 3.403 0.695 1.00 0.00 C ATOM 527 CD2 PHE A 34 2.891 1.847 -0.887 1.00 0.00 C ATOM 528 CE1 PHE A 34 4.244 2.331 1.517 1.00 0.00 C ATOM 529 CE2 PHE A 34 3.254 0.774 -0.061 1.00 0.00 C ATOM 530 CZ PHE A 34 3.934 1.019 1.139 1.00 0.00 C ATOM 0 H PHE A 34 4.394 6.313 -1.010 1.00 0.00 H new ATOM 0 HA PHE A 34 4.570 3.854 -2.631 1.00 0.00 H new ATOM 0 HB2 PHE A 34 2.512 5.156 -0.830 1.00 0.00 H new ATOM 0 HB3 PHE A 34 1.991 4.011 -2.050 1.00 0.00 H new ATOM 0 HD1 PHE A 34 4.108 4.416 0.991 1.00 0.00 H new ATOM 0 HD2 PHE A 34 2.366 1.662 -1.812 1.00 0.00 H new ATOM 0 HE1 PHE A 34 4.767 2.516 2.444 1.00 0.00 H new ATOM 0 HE2 PHE A 34 3.010 -0.238 -0.349 1.00 0.00 H new ATOM 0 HZ PHE A 34 4.220 0.194 1.774 1.00 0.00 H new ATOM 540 N GLU A 35 3.696 6.690 -3.748 1.00 0.00 N ATOM 541 CA GLU A 35 3.299 7.411 -4.956 1.00 0.00 C ATOM 542 C GLU A 35 3.990 6.847 -6.201 1.00 0.00 C ATOM 543 O GLU A 35 3.439 6.918 -7.298 1.00 0.00 O ATOM 544 CB GLU A 35 3.634 8.898 -4.798 1.00 0.00 C ATOM 545 CG GLU A 35 3.354 9.683 -6.076 1.00 0.00 C ATOM 546 CD GLU A 35 3.527 11.184 -5.850 1.00 0.00 C ATOM 547 OE1 GLU A 35 4.693 11.638 -5.840 1.00 0.00 O ATOM 548 OE2 GLU A 35 2.491 11.866 -5.690 1.00 0.00 O ATOM 0 H GLU A 35 4.140 7.274 -3.039 1.00 0.00 H new ATOM 0 HA GLU A 35 2.224 7.287 -5.089 1.00 0.00 H new ATOM 0 HB2 GLU A 35 3.049 9.317 -3.979 1.00 0.00 H new ATOM 0 HB3 GLU A 35 4.684 9.007 -4.528 1.00 0.00 H new ATOM 0 HG2 GLU A 35 4.029 9.351 -6.865 1.00 0.00 H new ATOM 0 HG3 GLU A 35 2.339 9.478 -6.417 1.00 0.00 H new ATOM 555 N LYS A 36 5.193 6.284 -6.046 1.00 0.00 N ATOM 556 CA LYS A 36 5.976 5.791 -7.174 1.00 0.00 C ATOM 557 C LYS A 36 5.422 4.496 -7.747 1.00 0.00 C ATOM 558 O LYS A 36 5.702 4.161 -8.898 1.00 0.00 O ATOM 559 CB LYS A 36 7.421 5.607 -6.720 1.00 0.00 C ATOM 560 CG LYS A 36 7.599 4.398 -5.794 1.00 0.00 C ATOM 561 CD LYS A 36 9.049 4.277 -5.324 1.00 0.00 C ATOM 562 CE LYS A 36 9.465 5.485 -4.485 1.00 0.00 C ATOM 563 NZ LYS A 36 10.858 5.352 -4.018 1.00 0.00 N ATOM 0 H LYS A 36 5.645 6.160 -5.140 1.00 0.00 H new ATOM 0 HA LYS A 36 5.923 6.526 -7.978 1.00 0.00 H new ATOM 0 HB2 LYS A 36 8.060 5.487 -7.595 1.00 0.00 H new ATOM 0 HB3 LYS A 36 7.753 6.508 -6.203 1.00 0.00 H new ATOM 0 HG2 LYS A 36 6.940 4.496 -4.931 1.00 0.00 H new ATOM 0 HG3 LYS A 36 7.305 3.488 -6.317 1.00 0.00 H new ATOM 0 HD2 LYS A 36 9.168 3.366 -4.737 1.00 0.00 H new ATOM 0 HD3 LYS A 36 9.707 4.188 -6.188 1.00 0.00 H new ATOM 0 HE2 LYS A 36 9.361 6.395 -5.076 1.00 0.00 H new ATOM 0 HE3 LYS A 36 8.799 5.584 -3.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 11.115 6.185 -3.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 10.949 4.495 -3.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 11.494 5.282 -4.838 1.00 0.00 H new ATOM 577 N TYR A 37 4.642 3.764 -6.954 1.00 0.00 N ATOM 578 CA TYR A 37 4.048 2.509 -7.391 1.00 0.00 C ATOM 579 C TYR A 37 2.766 2.747 -8.176 1.00 0.00 C ATOM 580 O TYR A 37 2.307 1.850 -8.878 1.00 0.00 O ATOM 581 CB TYR A 37 3.750 1.627 -6.182 1.00 0.00 C ATOM 582 CG TYR A 37 4.994 1.235 -5.422 1.00 0.00 C ATOM 583 CD1 TYR A 37 5.582 2.136 -4.529 1.00 0.00 C ATOM 584 CD2 TYR A 37 5.561 -0.028 -5.628 1.00 0.00 C ATOM 585 CE1 TYR A 37 6.759 1.788 -3.846 1.00 0.00 C ATOM 586 CE2 TYR A 37 6.732 -0.385 -4.951 1.00 0.00 C ATOM 587 CZ TYR A 37 7.346 0.526 -4.066 1.00 0.00 C ATOM 588 OH TYR A 37 8.505 0.183 -3.437 1.00 0.00 O ATOM 0 H TYR A 37 4.407 4.025 -5.996 1.00 0.00 H new ATOM 0 HA TYR A 37 4.762 2.009 -8.045 1.00 0.00 H new ATOM 0 HB2 TYR A 37 3.072 2.155 -5.512 1.00 0.00 H new ATOM 0 HB3 TYR A 37 3.234 0.726 -6.514 1.00 0.00 H new ATOM 0 HD1 TYR A 37 5.130 3.103 -4.364 1.00 0.00 H new ATOM 0 HD2 TYR A 37 5.095 -0.726 -6.308 1.00 0.00 H new ATOM 0 HE1 TYR A 37 7.212 2.484 -3.156 1.00 0.00 H new ATOM 0 HE2 TYR A 37 7.167 -1.361 -5.106 1.00 0.00 H new ATOM 0 HH TYR A 37 8.313 -0.063 -2.508 1.00 0.00 H new ATOM 598 N GLY A 38 2.189 3.945 -8.054 1.00 0.00 N ATOM 599 CA GLY A 38 0.954 4.271 -8.732 1.00 0.00 C ATOM 600 C GLY A 38 0.056 5.137 -7.858 1.00 0.00 C ATOM 601 O GLY A 38 0.509 5.793 -6.920 1.00 0.00 O ATOM 0 H GLY A 38 2.568 4.703 -7.486 1.00 0.00 H new ATOM 0 HA2 GLY A 38 1.174 4.795 -9.662 1.00 0.00 H new ATOM 0 HA3 GLY A 38 0.430 3.353 -8.999 1.00 0.00 H new ATOM 605 N ARG A 39 -1.230 5.120 -8.195 1.00 0.00 N ATOM 606 CA ARG A 39 -2.284 5.881 -7.539 1.00 0.00 C ATOM 607 C ARG A 39 -2.443 5.511 -6.065 1.00 0.00 C ATOM 608 O ARG A 39 -3.239 4.647 -5.708 1.00 0.00 O ATOM 609 CB ARG A 39 -3.584 5.739 -8.345 1.00 0.00 C ATOM 610 CG ARG A 39 -4.189 4.334 -8.319 1.00 0.00 C ATOM 611 CD ARG A 39 -5.112 4.132 -9.516 1.00 0.00 C ATOM 612 NE ARG A 39 -4.330 3.944 -10.743 1.00 0.00 N ATOM 613 CZ ARG A 39 -4.793 4.157 -11.976 1.00 0.00 C ATOM 614 NH1 ARG A 39 -6.037 4.584 -12.179 1.00 0.00 N ATOM 615 NH2 ARG A 39 -3.999 3.944 -13.021 1.00 0.00 N ATOM 0 H ARG A 39 -1.579 4.551 -8.966 1.00 0.00 H new ATOM 0 HA ARG A 39 -2.006 6.935 -7.526 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -4.318 6.445 -7.957 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -3.389 6.019 -9.380 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -3.394 3.588 -8.334 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -4.746 4.188 -7.393 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -5.750 3.264 -9.348 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -5.769 4.995 -9.625 1.00 0.00 H new ATOM 0 HE ARG A 39 -3.365 3.628 -10.647 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -6.654 4.754 -11.385 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -6.374 4.741 -13.129 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -3.043 3.620 -12.877 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -4.346 4.105 -13.967 1.00 0.00 H new ATOM 629 N VAL A 40 -1.669 6.178 -5.208 1.00 0.00 N ATOM 630 CA VAL A 40 -1.819 6.138 -3.757 1.00 0.00 C ATOM 631 C VAL A 40 -3.103 6.894 -3.394 1.00 0.00 C ATOM 632 O VAL A 40 -3.090 7.907 -2.696 1.00 0.00 O ATOM 633 CB VAL A 40 -0.544 6.688 -3.107 1.00 0.00 C ATOM 634 CG1 VAL A 40 -0.170 8.062 -3.665 1.00 0.00 C ATOM 635 CG2 VAL A 40 -0.649 6.737 -1.581 1.00 0.00 C ATOM 0 H VAL A 40 -0.901 6.776 -5.514 1.00 0.00 H new ATOM 0 HA VAL A 40 -1.931 5.124 -3.372 1.00 0.00 H new ATOM 0 HB VAL A 40 0.255 5.991 -3.361 1.00 0.00 H new ATOM 0 HG11 VAL A 40 0.739 8.417 -3.179 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -0.001 7.985 -4.739 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -0.981 8.765 -3.475 1.00 0.00 H new ATOM 0 HG21 VAL A 40 0.277 7.133 -1.165 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -1.480 7.381 -1.294 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -0.819 5.732 -1.196 1.00 0.00 H new ATOM 645 N GLY A 41 -4.225 6.378 -3.896 1.00 0.00 N ATOM 646 CA GLY A 41 -5.545 6.984 -3.789 1.00 0.00 C ATOM 647 C GLY A 41 -6.011 7.172 -2.349 1.00 0.00 C ATOM 648 O GLY A 41 -6.973 7.902 -2.107 1.00 0.00 O ATOM 0 H GLY A 41 -4.236 5.495 -4.406 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -5.533 7.953 -4.289 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -6.266 6.361 -4.318 1.00 0.00 H new ATOM 652 N ASP A 42 -5.343 6.527 -1.390 1.00 0.00 N ATOM 653 CA ASP A 42 -5.606 6.751 0.024 1.00 0.00 C ATOM 654 C ASP A 42 -4.331 6.490 0.819 1.00 0.00 C ATOM 655 O ASP A 42 -3.401 5.862 0.315 1.00 0.00 O ATOM 656 CB ASP A 42 -6.750 5.856 0.495 1.00 0.00 C ATOM 657 CG ASP A 42 -7.576 6.527 1.586 1.00 0.00 C ATOM 658 OD1 ASP A 42 -6.967 7.049 2.544 1.00 0.00 O ATOM 659 OD2 ASP A 42 -8.817 6.512 1.451 1.00 0.00 O ATOM 0 H ASP A 42 -4.611 5.841 -1.575 1.00 0.00 H new ATOM 0 HA ASP A 42 -5.910 7.785 0.185 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -7.393 5.612 -0.350 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -6.346 4.916 0.870 1.00 0.00 H new ATOM 664 N VAL A 43 -4.288 6.975 2.057 1.00 0.00 N ATOM 665 CA VAL A 43 -3.073 7.000 2.858 1.00 0.00 C ATOM 666 C VAL A 43 -3.441 7.091 4.344 1.00 0.00 C ATOM 667 O VAL A 43 -2.702 7.653 5.150 1.00 0.00 O ATOM 668 CB VAL A 43 -2.222 8.175 2.351 1.00 0.00 C ATOM 669 CG1 VAL A 43 -2.851 9.523 2.701 1.00 0.00 C ATOM 670 CG2 VAL A 43 -0.776 8.058 2.831 1.00 0.00 C ATOM 0 H VAL A 43 -5.102 7.364 2.533 1.00 0.00 H new ATOM 0 HA VAL A 43 -2.484 6.088 2.758 1.00 0.00 H new ATOM 0 HB VAL A 43 -2.198 8.124 1.262 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -2.219 10.328 2.325 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -3.838 9.593 2.244 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -2.945 9.611 3.783 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -0.199 8.903 2.456 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -0.753 8.057 3.921 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -0.343 7.130 2.459 1.00 0.00 H new ATOM 680 N TYR A 44 -4.604 6.534 4.707 1.00 0.00 N ATOM 681 CA TYR A 44 -5.207 6.761 6.009 1.00 0.00 C ATOM 682 C TYR A 44 -4.409 6.208 7.186 1.00 0.00 C ATOM 683 O TYR A 44 -3.596 5.293 7.054 1.00 0.00 O ATOM 684 CB TYR A 44 -6.653 6.273 6.019 1.00 0.00 C ATOM 685 CG TYR A 44 -7.486 7.054 7.015 1.00 0.00 C ATOM 686 CD1 TYR A 44 -7.433 8.455 7.009 1.00 0.00 C ATOM 687 CD2 TYR A 44 -8.303 6.380 7.934 1.00 0.00 C ATOM 688 CE1 TYR A 44 -8.164 9.190 7.946 1.00 0.00 C ATOM 689 CE2 TYR A 44 -9.047 7.113 8.870 1.00 0.00 C ATOM 690 CZ TYR A 44 -8.967 8.523 8.885 1.00 0.00 C ATOM 691 OH TYR A 44 -9.660 9.257 9.796 1.00 0.00 O ATOM 0 H TYR A 44 -5.145 5.916 4.102 1.00 0.00 H new ATOM 0 HA TYR A 44 -5.195 7.840 6.161 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -7.082 6.376 5.022 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -6.680 5.213 6.270 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -6.825 8.968 6.278 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -8.359 5.302 7.921 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -8.111 10.269 7.948 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -9.680 6.600 9.578 1.00 0.00 H new ATOM 0 HH TYR A 44 -9.698 8.772 10.646 1.00 0.00 H new ATOM 701 N ILE A 45 -4.681 6.797 8.351 1.00 0.00 N ATOM 702 CA ILE A 45 -4.192 6.400 9.666 1.00 0.00 C ATOM 703 C ILE A 45 -5.338 6.658 10.641 1.00 0.00 C ATOM 704 O ILE A 45 -5.471 7.763 11.166 1.00 0.00 O ATOM 705 CB ILE A 45 -2.930 7.168 10.080 1.00 0.00 C ATOM 706 CG1 ILE A 45 -1.766 6.785 9.154 1.00 0.00 C ATOM 707 CG2 ILE A 45 -2.574 6.827 11.536 1.00 0.00 C ATOM 708 CD1 ILE A 45 -0.473 7.504 9.528 1.00 0.00 C ATOM 0 H ILE A 45 -5.287 7.616 8.401 1.00 0.00 H new ATOM 0 HA ILE A 45 -3.898 5.350 9.659 1.00 0.00 H new ATOM 0 HB ILE A 45 -3.114 8.239 9.998 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -1.607 5.708 9.199 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -2.029 7.025 8.124 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -1.677 7.373 11.829 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -3.400 7.110 12.188 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -2.392 5.756 11.625 1.00 0.00 H new ATOM 0 HD11 ILE A 45 0.322 7.202 8.846 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -0.622 8.581 9.457 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -0.194 7.243 10.549 1.00 0.00 H new ATOM 720 N PRO A 46 -6.168 5.636 10.876 1.00 0.00 N ATOM 721 CA PRO A 46 -7.342 5.684 11.737 1.00 0.00 C ATOM 722 C PRO A 46 -7.072 5.977 13.212 1.00 0.00 C ATOM 723 O PRO A 46 -7.911 5.632 14.043 1.00 0.00 O ATOM 724 CB PRO A 46 -8.003 4.318 11.624 1.00 0.00 C ATOM 725 CG PRO A 46 -7.421 3.707 10.354 1.00 0.00 C ATOM 726 CD PRO A 46 -6.037 4.326 10.266 1.00 0.00 C ATOM 0 HA PRO A 46 -7.960 6.516 11.399 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -7.786 3.700 12.495 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -9.087 4.408 11.559 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -7.371 2.620 10.418 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -8.025 3.948 9.479 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -5.300 3.719 10.791 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -5.706 4.405 9.231 1.00 0.00 H new ATOM 734 N ARG A 47 -5.939 6.590 13.566 1.00 0.00 N ATOM 735 CA ARG A 47 -5.645 6.877 14.964 1.00 0.00 C ATOM 736 C ARG A 47 -6.856 7.561 15.605 1.00 0.00 C ATOM 737 O ARG A 47 -7.555 8.329 14.943 1.00 0.00 O ATOM 738 CB ARG A 47 -4.352 7.679 15.100 1.00 0.00 C ATOM 739 CG ARG A 47 -4.454 9.061 14.455 1.00 0.00 C ATOM 740 CD ARG A 47 -3.089 9.739 14.532 1.00 0.00 C ATOM 741 NE ARG A 47 -3.112 11.045 13.861 1.00 0.00 N ATOM 742 CZ ARG A 47 -2.225 12.019 14.086 1.00 0.00 C ATOM 743 NH1 ARG A 47 -1.245 11.866 14.974 1.00 0.00 N ATOM 744 NH2 ARG A 47 -2.318 13.163 13.418 1.00 0.00 N ATOM 0 H ARG A 47 -5.220 6.893 12.909 1.00 0.00 H new ATOM 0 HA ARG A 47 -5.470 5.948 15.506 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -4.106 7.791 16.156 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -3.534 7.125 14.639 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -4.773 8.971 13.417 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -5.204 9.663 14.968 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -2.801 9.867 15.575 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -2.336 9.102 14.069 1.00 0.00 H new ATOM 0 HE ARG A 47 -3.851 11.220 13.180 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -1.162 10.994 15.496 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -0.577 12.621 15.132 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -3.065 13.296 12.736 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -1.643 13.909 13.587 1.00 0.00 H new ATOM 758 N ASP A 48 -7.093 7.276 16.888 1.00 0.00 N ATOM 759 CA ASP A 48 -8.313 7.652 17.595 1.00 0.00 C ATOM 760 C ASP A 48 -8.774 9.054 17.229 1.00 0.00 C ATOM 761 O ASP A 48 -8.036 10.023 17.405 1.00 0.00 O ATOM 762 CB ASP A 48 -8.106 7.534 19.101 1.00 0.00 C ATOM 763 CG ASP A 48 -7.605 6.148 19.482 1.00 0.00 C ATOM 764 OD1 ASP A 48 -6.394 5.907 19.279 1.00 0.00 O ATOM 765 OD2 ASP A 48 -8.432 5.349 19.971 1.00 0.00 O ATOM 0 H ASP A 48 -6.429 6.768 17.472 1.00 0.00 H new ATOM 0 HA ASP A 48 -9.099 6.962 17.287 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -7.390 8.286 19.432 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -9.044 7.739 19.617 1.00 0.00 H new ATOM 770 N ARG A 49 -10.003 9.163 16.721 1.00 0.00 N ATOM 771 CA ARG A 49 -10.558 10.425 16.253 1.00 0.00 C ATOM 772 C ARG A 49 -10.860 11.397 17.400 1.00 0.00 C ATOM 773 O ARG A 49 -11.537 12.399 17.183 1.00 0.00 O ATOM 774 CB ARG A 49 -11.780 10.152 15.368 1.00 0.00 C ATOM 775 CG ARG A 49 -13.011 9.742 16.181 1.00 0.00 C ATOM 776 CD ARG A 49 -14.190 9.484 15.243 1.00 0.00 C ATOM 777 NE ARG A 49 -14.472 10.657 14.411 1.00 0.00 N ATOM 778 CZ ARG A 49 -15.306 11.646 14.744 1.00 0.00 C ATOM 779 NH1 ARG A 49 -15.987 11.622 15.886 1.00 0.00 N ATOM 780 NH2 ARG A 49 -15.461 12.679 13.922 1.00 0.00 N ATOM 0 H ARG A 49 -10.640 8.373 16.624 1.00 0.00 H new ATOM 0 HA ARG A 49 -9.805 10.930 15.648 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -12.012 11.046 14.788 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -11.540 9.363 14.655 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -12.793 8.845 16.761 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -13.266 10.527 16.893 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -13.970 8.627 14.606 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -15.074 9.228 15.827 1.00 0.00 H new ATOM 0 HE ARG A 49 -13.996 10.723 13.511 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -15.878 10.837 16.528 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -16.618 12.388 16.120 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -14.945 12.713 13.043 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -16.096 13.437 14.170 1.00 0.00 H new ATOM 794 N TYR A 50 -10.366 11.110 18.610 1.00 0.00 N ATOM 795 CA TYR A 50 -10.584 11.970 19.774 1.00 0.00 C ATOM 796 C TYR A 50 -9.312 12.140 20.607 1.00 0.00 C ATOM 797 O TYR A 50 -9.220 13.085 21.391 1.00 0.00 O ATOM 798 CB TYR A 50 -11.654 11.377 20.694 1.00 0.00 C ATOM 799 CG TYR A 50 -12.832 10.701 20.038 1.00 0.00 C ATOM 800 CD1 TYR A 50 -13.931 11.446 19.586 1.00 0.00 C ATOM 801 CD2 TYR A 50 -12.830 9.305 19.906 1.00 0.00 C ATOM 802 CE1 TYR A 50 -15.038 10.796 19.020 1.00 0.00 C ATOM 803 CE2 TYR A 50 -13.932 8.650 19.345 1.00 0.00 C ATOM 804 CZ TYR A 50 -15.044 9.393 18.897 1.00 0.00 C ATOM 805 OH TYR A 50 -16.113 8.744 18.352 1.00 0.00 O ATOM 0 H TYR A 50 -9.807 10.280 18.807 1.00 0.00 H new ATOM 0 HA TYR A 50 -10.899 12.937 19.382 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -11.171 10.652 21.350 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -12.035 12.177 21.329 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -13.925 12.522 19.674 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -11.976 8.734 20.238 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -15.886 11.372 18.679 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -13.931 7.574 19.255 1.00 0.00 H new ATOM 0 HH TYR A 50 -16.657 9.380 17.842 1.00 0.00 H new ATOM 815 N THR A 51 -8.333 11.240 20.454 1.00 0.00 N ATOM 816 CA THR A 51 -7.133 11.240 21.291 1.00 0.00 C ATOM 817 C THR A 51 -5.866 10.895 20.509 1.00 0.00 C ATOM 818 O THR A 51 -4.776 10.905 21.074 1.00 0.00 O ATOM 819 CB THR A 51 -7.307 10.241 22.439 1.00 0.00 C ATOM 820 OG1 THR A 51 -7.422 8.940 21.910 1.00 0.00 O ATOM 821 CG2 THR A 51 -8.558 10.528 23.266 1.00 0.00 C ATOM 0 H THR A 51 -8.352 10.499 19.753 1.00 0.00 H new ATOM 0 HA THR A 51 -7.012 12.252 21.676 1.00 0.00 H new ATOM 0 HB THR A 51 -6.434 10.333 23.086 1.00 0.00 H new ATOM 0 HG1 THR A 51 -7.038 8.295 22.541 1.00 0.00 H new ATOM 0 HG21 THR A 51 -8.640 9.795 24.068 1.00 0.00 H new ATOM 0 HG22 THR A 51 -8.490 11.528 23.694 1.00 0.00 H new ATOM 0 HG23 THR A 51 -9.439 10.467 22.627 1.00 0.00 H new ATOM 828 N LYS A 52 -6.008 10.595 19.211 1.00 0.00 N ATOM 829 CA LYS A 52 -4.918 10.306 18.288 1.00 0.00 C ATOM 830 C LYS A 52 -3.781 9.503 18.925 1.00 0.00 C ATOM 831 O LYS A 52 -2.630 9.936 18.897 1.00 0.00 O ATOM 832 CB LYS A 52 -4.415 11.623 17.688 1.00 0.00 C ATOM 833 CG LYS A 52 -5.550 12.348 16.961 1.00 0.00 C ATOM 834 CD LYS A 52 -5.051 13.668 16.377 1.00 0.00 C ATOM 835 CE LYS A 52 -6.197 14.372 15.652 1.00 0.00 C ATOM 836 NZ LYS A 52 -5.757 15.668 15.097 1.00 0.00 N ATOM 0 H LYS A 52 -6.924 10.547 18.764 1.00 0.00 H new ATOM 0 HA LYS A 52 -5.306 9.665 17.497 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -4.015 12.260 18.477 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -3.598 11.425 16.994 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -5.942 11.716 16.164 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -6.371 12.536 17.652 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -4.663 14.306 17.172 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -4.228 13.484 15.686 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -6.569 13.736 14.849 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -7.026 14.531 16.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -6.554 16.126 14.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -5.425 16.281 15.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -4.982 15.511 14.421 1.00 0.00 H new ATOM 850 N GLU A 53 -4.091 8.337 19.502 1.00 0.00 N ATOM 851 CA GLU A 53 -3.112 7.537 20.233 1.00 0.00 C ATOM 852 C GLU A 53 -2.910 6.139 19.634 1.00 0.00 C ATOM 853 O GLU A 53 -2.421 5.242 20.318 1.00 0.00 O ATOM 854 CB GLU A 53 -3.484 7.477 21.720 1.00 0.00 C ATOM 855 CG GLU A 53 -4.790 6.719 21.957 1.00 0.00 C ATOM 856 CD GLU A 53 -5.137 6.668 23.446 1.00 0.00 C ATOM 857 OE1 GLU A 53 -4.400 5.977 24.186 1.00 0.00 O ATOM 858 OE2 GLU A 53 -6.135 7.314 23.834 1.00 0.00 O ATOM 0 H GLU A 53 -5.024 7.926 19.474 1.00 0.00 H new ATOM 0 HA GLU A 53 -2.147 8.034 20.136 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -2.680 6.994 22.275 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -3.578 8.490 22.111 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -5.599 7.202 21.409 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -4.701 5.705 21.567 1.00 0.00 H new ATOM 865 N SER A 54 -3.286 5.948 18.363 1.00 0.00 N ATOM 866 CA SER A 54 -3.133 4.669 17.674 1.00 0.00 C ATOM 867 C SER A 54 -2.420 4.850 16.333 1.00 0.00 C ATOM 868 O SER A 54 -2.694 4.131 15.375 1.00 0.00 O ATOM 869 CB SER A 54 -4.487 3.976 17.501 1.00 0.00 C ATOM 870 OG SER A 54 -5.065 3.695 18.758 1.00 0.00 O ATOM 0 H SER A 54 -3.704 6.678 17.787 1.00 0.00 H new ATOM 0 HA SER A 54 -2.509 4.023 18.292 1.00 0.00 H new ATOM 0 HB2 SER A 54 -5.156 4.612 16.921 1.00 0.00 H new ATOM 0 HB3 SER A 54 -4.359 3.051 16.938 1.00 0.00 H new ATOM 0 HG SER A 54 -5.313 4.534 19.199 1.00 0.00 H new ATOM 876 N ARG A 55 -1.501 5.823 16.263 1.00 0.00 N ATOM 877 CA ARG A 55 -0.653 6.088 15.100 1.00 0.00 C ATOM 878 C ARG A 55 0.226 4.880 14.744 1.00 0.00 C ATOM 879 O ARG A 55 0.936 4.900 13.741 1.00 0.00 O ATOM 880 CB ARG A 55 0.193 7.327 15.432 1.00 0.00 C ATOM 881 CG ARG A 55 1.164 7.734 14.319 1.00 0.00 C ATOM 882 CD ARG A 55 1.865 9.027 14.727 1.00 0.00 C ATOM 883 NE ARG A 55 2.952 9.361 13.799 1.00 0.00 N ATOM 884 CZ ARG A 55 3.846 10.331 14.017 1.00 0.00 C ATOM 885 NH1 ARG A 55 3.778 11.087 15.109 1.00 0.00 N ATOM 886 NH2 ARG A 55 4.819 10.547 13.135 1.00 0.00 N ATOM 0 H ARG A 55 -1.325 6.463 17.037 1.00 0.00 H new ATOM 0 HA ARG A 55 -1.268 6.270 14.219 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -0.473 8.164 15.643 1.00 0.00 H new ATOM 0 HB3 ARG A 55 0.760 7.134 16.343 1.00 0.00 H new ATOM 0 HG2 ARG A 55 1.896 6.945 14.150 1.00 0.00 H new ATOM 0 HG3 ARG A 55 0.626 7.876 13.382 1.00 0.00 H new ATOM 0 HD2 ARG A 55 1.142 9.843 14.752 1.00 0.00 H new ATOM 0 HD3 ARG A 55 2.264 8.924 15.736 1.00 0.00 H new ATOM 0 HE ARG A 55 3.030 8.821 12.937 1.00 0.00 H new ATOM 0 HH11 ARG A 55 3.037 10.930 15.793 1.00 0.00 H new ATOM 0 HH12 ARG A 55 4.467 11.824 15.263 1.00 0.00 H new ATOM 0 HH21 ARG A 55 4.882 9.973 12.294 1.00 0.00 H new ATOM 0 HH22 ARG A 55 5.502 11.287 13.300 1.00 0.00 H new ATOM 900 N GLY A 56 0.179 3.829 15.564 1.00 0.00 N ATOM 901 CA GLY A 56 1.004 2.635 15.441 1.00 0.00 C ATOM 902 C GLY A 56 0.742 1.801 14.183 1.00 0.00 C ATOM 903 O GLY A 56 1.353 0.741 14.036 1.00 0.00 O ATOM 0 H GLY A 56 -0.459 3.788 16.359 1.00 0.00 H new ATOM 0 HA2 GLY A 56 2.053 2.932 15.451 1.00 0.00 H new ATOM 0 HA3 GLY A 56 0.842 2.007 16.317 1.00 0.00 H new ATOM 907 N PHE A 57 -0.140 2.242 13.281 1.00 0.00 N ATOM 908 CA PHE A 57 -0.439 1.507 12.063 1.00 0.00 C ATOM 909 C PHE A 57 -0.923 2.456 10.968 1.00 0.00 C ATOM 910 O PHE A 57 -1.132 3.641 11.220 1.00 0.00 O ATOM 911 CB PHE A 57 -1.464 0.419 12.382 1.00 0.00 C ATOM 912 CG PHE A 57 -2.889 0.896 12.432 1.00 0.00 C ATOM 913 CD1 PHE A 57 -3.385 1.523 13.584 1.00 0.00 C ATOM 914 CD2 PHE A 57 -3.712 0.705 11.320 1.00 0.00 C ATOM 915 CE1 PHE A 57 -4.722 1.929 13.628 1.00 0.00 C ATOM 916 CE2 PHE A 57 -5.046 1.123 11.360 1.00 0.00 C ATOM 917 CZ PHE A 57 -5.557 1.714 12.521 1.00 0.00 C ATOM 0 H PHE A 57 -0.660 3.114 13.380 1.00 0.00 H new ATOM 0 HA PHE A 57 0.463 1.028 11.682 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -1.384 -0.368 11.632 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -1.211 -0.030 13.343 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -2.738 1.691 14.432 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -3.319 0.235 10.431 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -5.112 2.408 14.514 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -5.681 0.990 10.496 1.00 0.00 H new ATOM 0 HZ PHE A 57 -6.596 2.005 12.565 1.00 0.00 H new ATOM 927 N ALA A 58 -1.095 1.934 9.751 1.00 0.00 N ATOM 928 CA ALA A 58 -1.507 2.718 8.594 1.00 0.00 C ATOM 929 C ALA A 58 -2.447 1.925 7.689 1.00 0.00 C ATOM 930 O ALA A 58 -2.708 0.743 7.916 1.00 0.00 O ATOM 931 CB ALA A 58 -0.264 3.169 7.822 1.00 0.00 C ATOM 0 H ALA A 58 -0.950 0.946 9.544 1.00 0.00 H new ATOM 0 HA ALA A 58 -2.056 3.593 8.941 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -0.567 3.756 6.955 1.00 0.00 H new ATOM 0 HB2 ALA A 58 0.366 3.778 8.470 1.00 0.00 H new ATOM 0 HB3 ALA A 58 0.295 2.294 7.490 1.00 0.00 H new ATOM 937 N PHE A 59 -2.959 2.599 6.653 1.00 0.00 N ATOM 938 CA PHE A 59 -3.912 2.067 5.693 1.00 0.00 C ATOM 939 C PHE A 59 -3.724 2.816 4.372 1.00 0.00 C ATOM 940 O PHE A 59 -4.636 3.497 3.896 1.00 0.00 O ATOM 941 CB PHE A 59 -5.321 2.245 6.267 1.00 0.00 C ATOM 942 CG PHE A 59 -6.394 1.369 5.653 1.00 0.00 C ATOM 943 CD1 PHE A 59 -6.334 0.956 4.314 1.00 0.00 C ATOM 944 CD2 PHE A 59 -7.470 0.960 6.455 1.00 0.00 C ATOM 945 CE1 PHE A 59 -7.338 0.134 3.780 1.00 0.00 C ATOM 946 CE2 PHE A 59 -8.471 0.136 5.922 1.00 0.00 C ATOM 947 CZ PHE A 59 -8.406 -0.278 4.585 1.00 0.00 C ATOM 0 H PHE A 59 -2.706 3.568 6.459 1.00 0.00 H new ATOM 0 HA PHE A 59 -3.757 1.005 5.505 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -5.285 2.047 7.338 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -5.615 3.288 6.145 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -5.511 1.272 3.691 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -7.527 1.281 7.485 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -7.287 -0.181 2.748 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -9.295 -0.181 6.544 1.00 0.00 H new ATOM 0 HZ PHE A 59 -9.178 -0.913 4.177 1.00 0.00 H new ATOM 957 N VAL A 60 -2.530 2.700 3.772 1.00 0.00 N ATOM 958 CA VAL A 60 -2.319 3.278 2.449 1.00 0.00 C ATOM 959 C VAL A 60 -3.004 2.367 1.444 1.00 0.00 C ATOM 960 O VAL A 60 -3.008 1.155 1.641 1.00 0.00 O ATOM 961 CB VAL A 60 -0.825 3.417 2.127 1.00 0.00 C ATOM 962 CG1 VAL A 60 -0.632 4.264 0.875 1.00 0.00 C ATOM 963 CG2 VAL A 60 -0.070 4.064 3.286 1.00 0.00 C ATOM 0 H VAL A 60 -1.721 2.225 4.172 1.00 0.00 H new ATOM 0 HA VAL A 60 -2.739 4.283 2.410 1.00 0.00 H new ATOM 0 HB VAL A 60 -0.428 2.416 1.961 1.00 0.00 H new ATOM 0 HG11 VAL A 60 0.432 4.355 0.658 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -1.135 3.789 0.033 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -1.055 5.255 1.038 1.00 0.00 H new ATOM 0 HG21 VAL A 60 0.986 4.150 3.030 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -0.479 5.056 3.478 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -0.178 3.449 4.179 1.00 0.00 H new ATOM 973 N ARG A 61 -3.585 2.920 0.374 1.00 0.00 N ATOM 974 CA ARG A 61 -4.385 2.110 -0.534 1.00 0.00 C ATOM 975 C ARG A 61 -4.274 2.534 -1.990 1.00 0.00 C ATOM 976 O ARG A 61 -3.918 3.665 -2.310 1.00 0.00 O ATOM 977 CB ARG A 61 -5.846 2.131 -0.049 1.00 0.00 C ATOM 978 CG ARG A 61 -6.869 1.746 -1.131 1.00 0.00 C ATOM 979 CD ARG A 61 -8.266 1.610 -0.539 1.00 0.00 C ATOM 980 NE ARG A 61 -8.676 2.831 0.177 1.00 0.00 N ATOM 981 CZ ARG A 61 -9.299 2.810 1.358 1.00 0.00 C ATOM 982 NH1 ARG A 61 -9.608 1.654 1.931 1.00 0.00 N ATOM 983 NH2 ARG A 61 -9.615 3.944 1.969 1.00 0.00 N ATOM 0 H ARG A 61 -3.516 3.906 0.123 1.00 0.00 H new ATOM 0 HA ARG A 61 -3.994 1.093 -0.511 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -5.948 1.447 0.793 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -6.081 3.129 0.320 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -6.875 2.502 -1.916 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -6.574 0.805 -1.597 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -8.980 1.398 -1.335 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -8.290 0.762 0.145 1.00 0.00 H new ATOM 0 HE ARG A 61 -8.474 3.735 -0.250 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -9.370 0.776 1.469 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -10.084 1.643 2.833 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -9.382 4.838 1.537 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -10.091 3.922 2.871 1.00 0.00 H new ATOM 997 N PHE A 62 -4.597 1.568 -2.859 1.00 0.00 N ATOM 998 CA PHE A 62 -4.620 1.749 -4.306 1.00 0.00 C ATOM 999 C PHE A 62 -5.971 1.309 -4.870 1.00 0.00 C ATOM 1000 O PHE A 62 -6.696 0.542 -4.235 1.00 0.00 O ATOM 1001 CB PHE A 62 -3.494 0.941 -4.953 1.00 0.00 C ATOM 1002 CG PHE A 62 -2.111 1.387 -4.540 1.00 0.00 C ATOM 1003 CD1 PHE A 62 -1.648 1.117 -3.246 1.00 0.00 C ATOM 1004 CD2 PHE A 62 -1.293 2.078 -5.445 1.00 0.00 C ATOM 1005 CE1 PHE A 62 -0.371 1.535 -2.851 1.00 0.00 C ATOM 1006 CE2 PHE A 62 -0.009 2.486 -5.058 1.00 0.00 C ATOM 1007 CZ PHE A 62 0.453 2.210 -3.761 1.00 0.00 C ATOM 0 H PHE A 62 -4.853 0.625 -2.566 1.00 0.00 H new ATOM 0 HA PHE A 62 -4.472 2.805 -4.531 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -3.619 -0.111 -4.695 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -3.582 1.016 -6.037 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -2.279 0.584 -2.550 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -1.652 2.296 -6.440 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -0.023 1.338 -1.848 1.00 0.00 H new ATOM 0 HE2 PHE A 62 0.624 3.012 -5.757 1.00 0.00 H new ATOM 0 HZ PHE A 62 1.445 2.518 -3.465 1.00 0.00 H new ATOM 1017 N HIS A 63 -6.298 1.805 -6.070 1.00 0.00 N ATOM 1018 CA HIS A 63 -7.595 1.588 -6.694 1.00 0.00 C ATOM 1019 C HIS A 63 -7.470 1.022 -8.110 1.00 0.00 C ATOM 1020 O HIS A 63 -8.442 1.028 -8.860 1.00 0.00 O ATOM 1021 CB HIS A 63 -8.382 2.899 -6.688 1.00 0.00 C ATOM 1022 CG HIS A 63 -8.617 3.436 -5.301 1.00 0.00 C ATOM 1023 ND1 HIS A 63 -9.785 3.267 -4.552 1.00 0.00 N ATOM 1024 CD2 HIS A 63 -7.723 4.170 -4.579 1.00 0.00 C ATOM 1025 CE1 HIS A 63 -9.560 3.902 -3.392 1.00 0.00 C ATOM 1026 NE2 HIS A 63 -8.333 4.457 -3.381 1.00 0.00 N ATOM 0 H HIS A 63 -5.662 2.370 -6.633 1.00 0.00 H new ATOM 0 HA HIS A 63 -8.134 0.839 -6.114 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -7.842 3.643 -7.274 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -9.343 2.742 -7.179 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -6.732 4.467 -4.887 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -10.267 3.960 -2.578 1.00 0.00 H new ATOM 0 HE2 HIS A 63 -7.927 4.997 -2.617 1.00 0.00 H new ATOM 1034 N ASP A 64 -6.285 0.530 -8.482 1.00 0.00 N ATOM 1035 CA ASP A 64 -6.095 -0.160 -9.748 1.00 0.00 C ATOM 1036 C ASP A 64 -5.192 -1.366 -9.524 1.00 0.00 C ATOM 1037 O ASP A 64 -4.188 -1.274 -8.817 1.00 0.00 O ATOM 1038 CB ASP A 64 -5.517 0.797 -10.797 1.00 0.00 C ATOM 1039 CG ASP A 64 -5.428 0.133 -12.169 1.00 0.00 C ATOM 1040 OD1 ASP A 64 -4.608 -0.797 -12.317 1.00 0.00 O ATOM 1041 OD2 ASP A 64 -6.182 0.558 -13.073 1.00 0.00 O ATOM 0 H ASP A 64 -5.440 0.601 -7.915 1.00 0.00 H new ATOM 0 HA ASP A 64 -7.054 -0.511 -10.129 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -6.142 1.688 -10.862 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -4.525 1.125 -10.485 1.00 0.00 H new ATOM 1046 N LYS A 65 -5.558 -2.500 -10.127 1.00 0.00 N ATOM 1047 CA LYS A 65 -4.905 -3.777 -9.873 1.00 0.00 C ATOM 1048 C LYS A 65 -3.444 -3.785 -10.297 1.00 0.00 C ATOM 1049 O LYS A 65 -2.647 -4.504 -9.704 1.00 0.00 O ATOM 1050 CB LYS A 65 -5.683 -4.895 -10.575 1.00 0.00 C ATOM 1051 CG LYS A 65 -5.639 -4.747 -12.103 1.00 0.00 C ATOM 1052 CD LYS A 65 -6.416 -5.870 -12.791 1.00 0.00 C ATOM 1053 CE LYS A 65 -7.892 -5.830 -12.398 1.00 0.00 C ATOM 1054 NZ LYS A 65 -8.658 -6.882 -13.096 1.00 0.00 N ATOM 0 H LYS A 65 -6.318 -2.554 -10.806 1.00 0.00 H new ATOM 0 HA LYS A 65 -4.910 -3.945 -8.796 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -5.266 -5.861 -10.291 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -6.720 -4.883 -10.238 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -6.059 -3.783 -12.390 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -4.603 -4.757 -12.442 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -6.321 -5.774 -13.873 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -5.988 -6.835 -12.517 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -7.988 -5.961 -11.320 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -8.309 -4.852 -12.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -9.657 -6.832 -12.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -8.584 -6.741 -14.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -8.273 -7.815 -12.846 1.00 0.00 H new ATOM 1068 N ARG A 66 -3.066 -3.005 -11.312 1.00 0.00 N ATOM 1069 CA ARG A 66 -1.703 -3.067 -11.816 1.00 0.00 C ATOM 1070 C ARG A 66 -0.750 -2.388 -10.836 1.00 0.00 C ATOM 1071 O ARG A 66 0.345 -2.885 -10.573 1.00 0.00 O ATOM 1072 CB ARG A 66 -1.652 -2.455 -13.224 1.00 0.00 C ATOM 1073 CG ARG A 66 -1.474 -0.932 -13.220 1.00 0.00 C ATOM 1074 CD ARG A 66 -1.837 -0.339 -14.578 1.00 0.00 C ATOM 1075 NE ARG A 66 -3.293 -0.215 -14.708 1.00 0.00 N ATOM 1076 CZ ARG A 66 -3.932 0.176 -15.813 1.00 0.00 C ATOM 1077 NH1 ARG A 66 -3.260 0.421 -16.939 1.00 0.00 N ATOM 1078 NH2 ARG A 66 -5.252 0.318 -15.789 1.00 0.00 N ATOM 0 H ARG A 66 -3.673 -2.338 -11.789 1.00 0.00 H new ATOM 0 HA ARG A 66 -1.376 -4.103 -11.900 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -0.831 -2.908 -13.779 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -2.571 -2.705 -13.754 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -2.102 -0.490 -12.446 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -0.442 -0.683 -12.974 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -1.371 0.640 -14.691 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -1.447 -0.972 -15.375 1.00 0.00 H new ATOM 0 HE ARG A 66 -3.860 -0.445 -13.892 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -2.246 0.310 -16.962 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -3.760 0.719 -17.777 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -5.770 0.129 -14.931 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -5.748 0.616 -16.629 1.00 0.00 H new ATOM 1092 N ASP A 67 -1.177 -1.246 -10.289 1.00 0.00 N ATOM 1093 CA ASP A 67 -0.385 -0.507 -9.326 1.00 0.00 C ATOM 1094 C ASP A 67 -0.397 -1.254 -7.993 1.00 0.00 C ATOM 1095 O ASP A 67 0.562 -1.173 -7.224 1.00 0.00 O ATOM 1096 CB ASP A 67 -0.989 0.888 -9.132 1.00 0.00 C ATOM 1097 CG ASP A 67 -0.981 1.732 -10.404 1.00 0.00 C ATOM 1098 OD1 ASP A 67 -0.147 1.453 -11.293 1.00 0.00 O ATOM 1099 OD2 ASP A 67 -1.820 2.660 -10.475 1.00 0.00 O ATOM 0 H ASP A 67 -2.077 -0.817 -10.505 1.00 0.00 H new ATOM 0 HA ASP A 67 0.639 -0.412 -9.687 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -2.015 0.786 -8.778 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -0.434 1.411 -8.353 1.00 0.00 H new ATOM 1104 N ALA A 68 -1.483 -1.986 -7.719 1.00 0.00 N ATOM 1105 CA ALA A 68 -1.640 -2.690 -6.465 1.00 0.00 C ATOM 1106 C ALA A 68 -0.862 -4.004 -6.439 1.00 0.00 C ATOM 1107 O ALA A 68 -0.307 -4.365 -5.402 1.00 0.00 O ATOM 1108 CB ALA A 68 -3.125 -2.981 -6.249 1.00 0.00 C ATOM 0 H ALA A 68 -2.266 -2.099 -8.363 1.00 0.00 H new ATOM 0 HA ALA A 68 -1.244 -2.058 -5.671 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -3.258 -3.512 -5.306 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -3.679 -2.043 -6.218 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -3.498 -3.596 -7.068 1.00 0.00 H new ATOM 1114 N GLU A 69 -0.804 -4.732 -7.558 1.00 0.00 N ATOM 1115 CA GLU A 69 -0.071 -5.986 -7.584 1.00 0.00 C ATOM 1116 C GLU A 69 1.432 -5.727 -7.493 1.00 0.00 C ATOM 1117 O GLU A 69 2.153 -6.536 -6.914 1.00 0.00 O ATOM 1118 CB GLU A 69 -0.393 -6.788 -8.846 1.00 0.00 C ATOM 1119 CG GLU A 69 -1.794 -7.404 -8.762 1.00 0.00 C ATOM 1120 CD GLU A 69 -2.085 -8.263 -9.991 1.00 0.00 C ATOM 1121 OE1 GLU A 69 -1.666 -9.444 -9.978 1.00 0.00 O ATOM 1122 OE2 GLU A 69 -2.723 -7.745 -10.937 1.00 0.00 O ATOM 0 H GLU A 69 -1.249 -4.475 -8.439 1.00 0.00 H new ATOM 0 HA GLU A 69 -0.381 -6.574 -6.720 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -0.329 -6.140 -9.720 1.00 0.00 H new ATOM 0 HB3 GLU A 69 0.348 -7.577 -8.979 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -1.875 -8.012 -7.861 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -2.539 -6.613 -8.681 1.00 0.00 H new ATOM 1129 N ASP A 70 1.917 -4.616 -8.052 1.00 0.00 N ATOM 1130 CA ASP A 70 3.329 -4.285 -7.920 1.00 0.00 C ATOM 1131 C ASP A 70 3.634 -3.798 -6.505 1.00 0.00 C ATOM 1132 O ASP A 70 4.684 -4.116 -5.949 1.00 0.00 O ATOM 1133 CB ASP A 70 3.699 -3.175 -8.904 1.00 0.00 C ATOM 1134 CG ASP A 70 3.764 -3.657 -10.352 1.00 0.00 C ATOM 1135 OD1 ASP A 70 3.912 -4.885 -10.564 1.00 0.00 O ATOM 1136 OD2 ASP A 70 3.666 -2.790 -11.249 1.00 0.00 O ATOM 0 H ASP A 70 1.364 -3.947 -8.588 1.00 0.00 H new ATOM 0 HA ASP A 70 3.909 -5.183 -8.131 1.00 0.00 H new ATOM 0 HB2 ASP A 70 2.967 -2.371 -8.827 1.00 0.00 H new ATOM 0 HB3 ASP A 70 4.665 -2.755 -8.623 1.00 0.00 H new ATOM 1141 N ALA A 71 2.721 -3.023 -5.919 1.00 0.00 N ATOM 1142 CA ALA A 71 2.918 -2.449 -4.605 1.00 0.00 C ATOM 1143 C ALA A 71 3.122 -3.528 -3.548 1.00 0.00 C ATOM 1144 O ALA A 71 3.882 -3.312 -2.608 1.00 0.00 O ATOM 1145 CB ALA A 71 1.721 -1.569 -4.245 1.00 0.00 C ATOM 0 H ALA A 71 1.828 -2.781 -6.348 1.00 0.00 H new ATOM 0 HA ALA A 71 3.822 -1.840 -4.629 1.00 0.00 H new ATOM 0 HB1 ALA A 71 1.871 -1.138 -3.255 1.00 0.00 H new ATOM 0 HB2 ALA A 71 1.624 -0.769 -4.979 1.00 0.00 H new ATOM 0 HB3 ALA A 71 0.813 -2.172 -4.244 1.00 0.00 H new ATOM 1151 N MET A 72 2.467 -4.685 -3.681 1.00 0.00 N ATOM 1152 CA MET A 72 2.666 -5.753 -2.707 1.00 0.00 C ATOM 1153 C MET A 72 3.840 -6.641 -3.114 1.00 0.00 C ATOM 1154 O MET A 72 4.506 -7.213 -2.255 1.00 0.00 O ATOM 1155 CB MET A 72 1.385 -6.576 -2.538 1.00 0.00 C ATOM 1156 CG MET A 72 1.119 -7.381 -3.806 1.00 0.00 C ATOM 1157 SD MET A 72 -0.472 -8.239 -3.853 1.00 0.00 S ATOM 1158 CE MET A 72 -0.234 -9.146 -5.401 1.00 0.00 C ATOM 0 H MET A 72 1.812 -4.900 -4.433 1.00 0.00 H new ATOM 0 HA MET A 72 2.904 -5.301 -1.744 1.00 0.00 H new ATOM 0 HB2 MET A 72 1.482 -7.246 -1.684 1.00 0.00 H new ATOM 0 HB3 MET A 72 0.542 -5.916 -2.331 1.00 0.00 H new ATOM 0 HG2 MET A 72 1.177 -6.709 -4.663 1.00 0.00 H new ATOM 0 HG3 MET A 72 1.914 -8.117 -3.924 1.00 0.00 H new ATOM 0 HE1 MET A 72 -1.185 -9.220 -5.929 1.00 0.00 H new ATOM 0 HE2 MET A 72 0.487 -8.618 -6.025 1.00 0.00 H new ATOM 0 HE3 MET A 72 0.139 -10.147 -5.183 1.00 0.00 H new ATOM 1168 N ASP A 73 4.103 -6.763 -4.418 1.00 0.00 N ATOM 1169 CA ASP A 73 5.208 -7.571 -4.913 1.00 0.00 C ATOM 1170 C ASP A 73 6.556 -6.930 -4.580 1.00 0.00 C ATOM 1171 O ASP A 73 7.599 -7.548 -4.789 1.00 0.00 O ATOM 1172 CB ASP A 73 5.052 -7.757 -6.423 1.00 0.00 C ATOM 1173 CG ASP A 73 6.117 -8.687 -7.002 1.00 0.00 C ATOM 1174 OD1 ASP A 73 6.135 -9.871 -6.596 1.00 0.00 O ATOM 1175 OD2 ASP A 73 6.909 -8.206 -7.848 1.00 0.00 O ATOM 0 H ASP A 73 3.558 -6.307 -5.150 1.00 0.00 H new ATOM 0 HA ASP A 73 5.185 -8.544 -4.423 1.00 0.00 H new ATOM 0 HB2 ASP A 73 4.063 -8.162 -6.637 1.00 0.00 H new ATOM 0 HB3 ASP A 73 5.113 -6.786 -6.915 1.00 0.00 H new ATOM 1180 N ALA A 74 6.541 -5.697 -4.066 1.00 0.00 N ATOM 1181 CA ALA A 74 7.761 -4.975 -3.747 1.00 0.00 C ATOM 1182 C ALA A 74 7.735 -4.314 -2.362 1.00 0.00 C ATOM 1183 O ALA A 74 8.760 -3.793 -1.928 1.00 0.00 O ATOM 1184 CB ALA A 74 7.957 -3.922 -4.826 1.00 0.00 C ATOM 0 H ALA A 74 5.686 -5.180 -3.863 1.00 0.00 H new ATOM 0 HA ALA A 74 8.587 -5.686 -3.716 1.00 0.00 H new ATOM 0 HB1 ALA A 74 8.866 -3.356 -4.622 1.00 0.00 H new ATOM 0 HB2 ALA A 74 8.043 -4.408 -5.798 1.00 0.00 H new ATOM 0 HB3 ALA A 74 7.103 -3.245 -4.833 1.00 0.00 H new ATOM 1190 N MET A 75 6.594 -4.329 -1.665 1.00 0.00 N ATOM 1191 CA MET A 75 6.519 -3.802 -0.302 1.00 0.00 C ATOM 1192 C MET A 75 6.001 -4.812 0.714 1.00 0.00 C ATOM 1193 O MET A 75 6.184 -4.587 1.909 1.00 0.00 O ATOM 1194 CB MET A 75 5.605 -2.581 -0.230 1.00 0.00 C ATOM 1195 CG MET A 75 6.047 -1.407 -1.106 1.00 0.00 C ATOM 1196 SD MET A 75 7.527 -0.544 -0.514 1.00 0.00 S ATOM 1197 CE MET A 75 6.924 1.167 -0.611 1.00 0.00 C ATOM 0 H MET A 75 5.713 -4.699 -2.022 1.00 0.00 H new ATOM 0 HA MET A 75 7.547 -3.543 -0.050 1.00 0.00 H new ATOM 0 HB2 MET A 75 4.598 -2.878 -0.523 1.00 0.00 H new ATOM 0 HB3 MET A 75 5.549 -2.245 0.805 1.00 0.00 H new ATOM 0 HG2 MET A 75 6.235 -1.773 -2.115 1.00 0.00 H new ATOM 0 HG3 MET A 75 5.227 -0.692 -1.174 1.00 0.00 H new ATOM 0 HE1 MET A 75 7.659 1.783 -1.130 1.00 0.00 H new ATOM 0 HE2 MET A 75 5.981 1.190 -1.157 1.00 0.00 H new ATOM 0 HE3 MET A 75 6.770 1.556 0.395 1.00 0.00 H new ATOM 1207 N ASP A 76 5.363 -5.910 0.292 1.00 0.00 N ATOM 1208 CA ASP A 76 4.882 -6.910 1.241 1.00 0.00 C ATOM 1209 C ASP A 76 6.028 -7.767 1.788 1.00 0.00 C ATOM 1210 O ASP A 76 6.033 -8.990 1.643 1.00 0.00 O ATOM 1211 CB ASP A 76 3.792 -7.781 0.609 1.00 0.00 C ATOM 1212 CG ASP A 76 3.110 -8.661 1.650 1.00 0.00 C ATOM 1213 OD1 ASP A 76 2.842 -8.140 2.756 1.00 0.00 O ATOM 1214 OD2 ASP A 76 2.862 -9.849 1.337 1.00 0.00 O ATOM 0 H ASP A 76 5.172 -6.123 -0.687 1.00 0.00 H new ATOM 0 HA ASP A 76 4.444 -6.379 2.086 1.00 0.00 H new ATOM 0 HB2 ASP A 76 3.050 -7.145 0.126 1.00 0.00 H new ATOM 0 HB3 ASP A 76 4.230 -8.407 -0.168 1.00 0.00 H new ATOM 1219 N GLY A 77 7.007 -7.118 2.419 1.00 0.00 N ATOM 1220 CA GLY A 77 8.204 -7.762 2.940 1.00 0.00 C ATOM 1221 C GLY A 77 9.398 -6.808 2.989 1.00 0.00 C ATOM 1222 O GLY A 77 10.458 -7.183 3.485 1.00 0.00 O ATOM 0 H GLY A 77 6.986 -6.112 2.583 1.00 0.00 H new ATOM 0 HA2 GLY A 77 8.003 -8.142 3.942 1.00 0.00 H new ATOM 0 HA3 GLY A 77 8.453 -8.621 2.317 1.00 0.00 H new ATOM 1226 N ALA A 78 9.227 -5.585 2.476 1.00 0.00 N ATOM 1227 CA ALA A 78 10.265 -4.564 2.458 1.00 0.00 C ATOM 1228 C ALA A 78 10.581 -4.044 3.862 1.00 0.00 C ATOM 1229 O ALA A 78 10.025 -4.517 4.854 1.00 0.00 O ATOM 1230 CB ALA A 78 9.802 -3.417 1.557 1.00 0.00 C ATOM 0 H ALA A 78 8.349 -5.278 2.057 1.00 0.00 H new ATOM 0 HA ALA A 78 11.184 -5.005 2.071 1.00 0.00 H new ATOM 0 HB1 ALA A 78 10.568 -2.642 1.532 1.00 0.00 H new ATOM 0 HB2 ALA A 78 9.632 -3.793 0.548 1.00 0.00 H new ATOM 0 HB3 ALA A 78 8.875 -2.998 1.949 1.00 0.00 H new ATOM 1236 N VAL A 79 11.483 -3.062 3.934 1.00 0.00 N ATOM 1237 CA VAL A 79 11.936 -2.468 5.184 1.00 0.00 C ATOM 1238 C VAL A 79 11.885 -0.949 5.058 1.00 0.00 C ATOM 1239 O VAL A 79 12.302 -0.394 4.044 1.00 0.00 O ATOM 1240 CB VAL A 79 13.366 -2.943 5.487 1.00 0.00 C ATOM 1241 CG1 VAL A 79 13.947 -2.260 6.726 1.00 0.00 C ATOM 1242 CG2 VAL A 79 13.394 -4.458 5.698 1.00 0.00 C ATOM 0 H VAL A 79 11.923 -2.654 3.109 1.00 0.00 H new ATOM 0 HA VAL A 79 11.289 -2.776 6.005 1.00 0.00 H new ATOM 0 HB VAL A 79 13.977 -2.674 4.625 1.00 0.00 H new ATOM 0 HG11 VAL A 79 14.959 -2.626 6.902 1.00 0.00 H new ATOM 0 HG12 VAL A 79 13.973 -1.182 6.568 1.00 0.00 H new ATOM 0 HG13 VAL A 79 13.324 -2.485 7.591 1.00 0.00 H new ATOM 0 HG21 VAL A 79 14.414 -4.777 5.911 1.00 0.00 H new ATOM 0 HG22 VAL A 79 12.749 -4.721 6.536 1.00 0.00 H new ATOM 0 HG23 VAL A 79 13.039 -4.958 4.797 1.00 0.00 H new ATOM 1252 N LEU A 80 11.373 -0.274 6.095 1.00 0.00 N ATOM 1253 CA LEU A 80 11.236 1.176 6.098 1.00 0.00 C ATOM 1254 C LEU A 80 12.467 1.827 6.730 1.00 0.00 C ATOM 1255 O LEU A 80 13.063 2.732 6.145 1.00 0.00 O ATOM 1256 CB LEU A 80 9.956 1.526 6.866 1.00 0.00 C ATOM 1257 CG LEU A 80 9.542 2.990 6.712 1.00 0.00 C ATOM 1258 CD1 LEU A 80 8.051 3.107 7.022 1.00 0.00 C ATOM 1259 CD2 LEU A 80 10.299 3.927 7.656 1.00 0.00 C ATOM 0 H LEU A 80 11.045 -0.722 6.950 1.00 0.00 H new ATOM 0 HA LEU A 80 11.164 1.557 5.079 1.00 0.00 H new ATOM 0 HB2 LEU A 80 9.145 0.887 6.517 1.00 0.00 H new ATOM 0 HB3 LEU A 80 10.103 1.306 7.923 1.00 0.00 H new ATOM 0 HG LEU A 80 9.776 3.288 5.690 1.00 0.00 H new ATOM 0 HD11 LEU A 80 7.738 4.146 6.917 1.00 0.00 H new ATOM 0 HD12 LEU A 80 7.485 2.486 6.328 1.00 0.00 H new ATOM 0 HD13 LEU A 80 7.864 2.773 8.043 1.00 0.00 H new ATOM 0 HD21 LEU A 80 9.962 4.952 7.500 1.00 0.00 H new ATOM 0 HD22 LEU A 80 10.107 3.636 8.689 1.00 0.00 H new ATOM 0 HD23 LEU A 80 11.368 3.862 7.453 1.00 0.00 H new ATOM 1271 N ASP A 81 12.850 1.363 7.921 1.00 0.00 N ATOM 1272 CA ASP A 81 14.033 1.848 8.617 1.00 0.00 C ATOM 1273 C ASP A 81 14.698 0.750 9.460 1.00 0.00 C ATOM 1274 O ASP A 81 15.734 1.001 10.079 1.00 0.00 O ATOM 1275 CB ASP A 81 13.632 3.028 9.502 1.00 0.00 C ATOM 1276 CG ASP A 81 14.847 3.717 10.124 1.00 0.00 C ATOM 1277 OD1 ASP A 81 15.714 4.184 9.352 1.00 0.00 O ATOM 1278 OD2 ASP A 81 14.903 3.773 11.376 1.00 0.00 O ATOM 0 H ASP A 81 12.343 0.637 8.428 1.00 0.00 H new ATOM 0 HA ASP A 81 14.766 2.163 7.875 1.00 0.00 H new ATOM 0 HB2 ASP A 81 13.069 3.750 8.910 1.00 0.00 H new ATOM 0 HB3 ASP A 81 12.969 2.679 10.293 1.00 0.00 H new ATOM 1283 N GLY A 82 14.135 -0.460 9.498 1.00 0.00 N ATOM 1284 CA GLY A 82 14.722 -1.561 10.251 1.00 0.00 C ATOM 1285 C GLY A 82 13.724 -2.658 10.614 1.00 0.00 C ATOM 1286 O GLY A 82 14.127 -3.696 11.141 1.00 0.00 O ATOM 0 H GLY A 82 13.270 -0.698 9.013 1.00 0.00 H new ATOM 0 HA2 GLY A 82 15.532 -1.998 9.667 1.00 0.00 H new ATOM 0 HA3 GLY A 82 15.165 -1.168 11.166 1.00 0.00 H new ATOM 1290 N ARG A 83 12.431 -2.456 10.336 1.00 0.00 N ATOM 1291 CA ARG A 83 11.398 -3.462 10.562 1.00 0.00 C ATOM 1292 C ARG A 83 10.797 -3.871 9.225 1.00 0.00 C ATOM 1293 O ARG A 83 11.354 -3.577 8.173 1.00 0.00 O ATOM 1294 CB ARG A 83 10.339 -2.941 11.540 1.00 0.00 C ATOM 1295 CG ARG A 83 9.586 -1.744 10.957 1.00 0.00 C ATOM 1296 CD ARG A 83 8.487 -1.285 11.913 1.00 0.00 C ATOM 1297 NE ARG A 83 9.023 -0.978 13.248 1.00 0.00 N ATOM 1298 CZ ARG A 83 8.269 -0.764 14.327 1.00 0.00 C ATOM 1299 NH1 ARG A 83 6.941 -0.755 14.241 1.00 0.00 N ATOM 1300 NH2 ARG A 83 8.846 -0.554 15.506 1.00 0.00 N ATOM 0 H ARG A 83 12.074 -1.584 9.946 1.00 0.00 H new ATOM 0 HA ARG A 83 11.838 -4.347 11.022 1.00 0.00 H new ATOM 0 HB2 ARG A 83 9.634 -3.738 11.774 1.00 0.00 H new ATOM 0 HB3 ARG A 83 10.816 -2.652 12.476 1.00 0.00 H new ATOM 0 HG2 ARG A 83 10.281 -0.925 10.772 1.00 0.00 H new ATOM 0 HG3 ARG A 83 9.150 -2.015 9.995 1.00 0.00 H new ATOM 0 HD2 ARG A 83 7.996 -0.401 11.506 1.00 0.00 H new ATOM 0 HD3 ARG A 83 7.728 -2.063 11.995 1.00 0.00 H new ATOM 0 HE ARG A 83 10.036 -0.925 13.355 1.00 0.00 H new ATOM 0 HH11 ARG A 83 6.487 -0.913 13.341 1.00 0.00 H new ATOM 0 HH12 ARG A 83 6.377 -0.590 15.075 1.00 0.00 H new ATOM 0 HH21 ARG A 83 9.863 -0.557 15.584 1.00 0.00 H new ATOM 0 HH22 ARG A 83 8.272 -0.390 16.333 1.00 0.00 H new ATOM 1314 N GLU A 84 9.660 -4.555 9.260 1.00 0.00 N ATOM 1315 CA GLU A 84 9.051 -5.127 8.075 1.00 0.00 C ATOM 1316 C GLU A 84 7.869 -4.274 7.652 1.00 0.00 C ATOM 1317 O GLU A 84 7.426 -3.410 8.406 1.00 0.00 O ATOM 1318 CB GLU A 84 8.560 -6.541 8.391 1.00 0.00 C ATOM 1319 CG GLU A 84 9.731 -7.517 8.472 1.00 0.00 C ATOM 1320 CD GLU A 84 9.232 -8.944 8.685 1.00 0.00 C ATOM 1321 OE1 GLU A 84 8.606 -9.482 7.744 1.00 0.00 O ATOM 1322 OE2 GLU A 84 9.478 -9.489 9.784 1.00 0.00 O ATOM 0 H GLU A 84 9.135 -4.727 10.118 1.00 0.00 H new ATOM 0 HA GLU A 84 9.785 -5.162 7.270 1.00 0.00 H new ATOM 0 HB2 GLU A 84 8.016 -6.539 9.336 1.00 0.00 H new ATOM 0 HB3 GLU A 84 7.861 -6.868 7.622 1.00 0.00 H new ATOM 0 HG2 GLU A 84 10.318 -7.465 7.555 1.00 0.00 H new ATOM 0 HG3 GLU A 84 10.392 -7.232 9.290 1.00 0.00 H new ATOM 1329 N LEU A 85 7.359 -4.523 6.450 1.00 0.00 N ATOM 1330 CA LEU A 85 6.162 -3.873 5.948 1.00 0.00 C ATOM 1331 C LEU A 85 5.201 -4.936 5.426 1.00 0.00 C ATOM 1332 O LEU A 85 5.619 -6.045 5.089 1.00 0.00 O ATOM 1333 CB LEU A 85 6.537 -2.864 4.863 1.00 0.00 C ATOM 1334 CG LEU A 85 7.405 -1.723 5.404 1.00 0.00 C ATOM 1335 CD1 LEU A 85 7.717 -0.765 4.260 1.00 0.00 C ATOM 1336 CD2 LEU A 85 6.692 -0.950 6.513 1.00 0.00 C ATOM 0 H LEU A 85 7.771 -5.187 5.795 1.00 0.00 H new ATOM 0 HA LEU A 85 5.664 -3.324 6.748 1.00 0.00 H new ATOM 0 HB2 LEU A 85 7.072 -3.376 4.063 1.00 0.00 H new ATOM 0 HB3 LEU A 85 5.629 -2.450 4.425 1.00 0.00 H new ATOM 0 HG LEU A 85 8.317 -2.152 5.820 1.00 0.00 H new ATOM 0 HD11 LEU A 85 8.335 0.054 4.629 1.00 0.00 H new ATOM 0 HD12 LEU A 85 8.253 -1.298 3.475 1.00 0.00 H new ATOM 0 HD13 LEU A 85 6.787 -0.364 3.857 1.00 0.00 H new ATOM 0 HD21 LEU A 85 7.338 -0.149 6.872 1.00 0.00 H new ATOM 0 HD22 LEU A 85 5.768 -0.523 6.123 1.00 0.00 H new ATOM 0 HD23 LEU A 85 6.460 -1.626 7.336 1.00 0.00 H new ATOM 1348 N ARG A 86 3.914 -4.590 5.357 1.00 0.00 N ATOM 1349 CA ARG A 86 2.869 -5.513 4.947 1.00 0.00 C ATOM 1350 C ARG A 86 1.938 -4.821 3.973 1.00 0.00 C ATOM 1351 O ARG A 86 1.561 -3.670 4.192 1.00 0.00 O ATOM 1352 CB ARG A 86 2.074 -5.978 6.174 1.00 0.00 C ATOM 1353 CG ARG A 86 2.916 -6.841 7.106 1.00 0.00 C ATOM 1354 CD ARG A 86 3.333 -8.116 6.382 1.00 0.00 C ATOM 1355 NE ARG A 86 4.035 -9.011 7.300 1.00 0.00 N ATOM 1356 CZ ARG A 86 5.358 -9.199 7.324 1.00 0.00 C ATOM 1357 NH1 ARG A 86 6.167 -8.546 6.493 1.00 0.00 N ATOM 1358 NH2 ARG A 86 5.895 -10.049 8.191 1.00 0.00 N ATOM 0 H ARG A 86 3.572 -3.657 5.586 1.00 0.00 H new ATOM 0 HA ARG A 86 3.323 -6.379 4.465 1.00 0.00 H new ATOM 0 HB2 ARG A 86 1.706 -5.108 6.719 1.00 0.00 H new ATOM 0 HB3 ARG A 86 1.201 -6.542 5.848 1.00 0.00 H new ATOM 0 HG2 ARG A 86 3.798 -6.290 7.431 1.00 0.00 H new ATOM 0 HG3 ARG A 86 2.347 -7.089 8.002 1.00 0.00 H new ATOM 0 HD2 ARG A 86 2.454 -8.616 5.976 1.00 0.00 H new ATOM 0 HD3 ARG A 86 3.978 -7.870 5.538 1.00 0.00 H new ATOM 0 HE ARG A 86 3.473 -9.531 7.973 1.00 0.00 H new ATOM 0 HH11 ARG A 86 5.780 -7.885 5.819 1.00 0.00 H new ATOM 0 HH12 ARG A 86 7.174 -8.706 6.530 1.00 0.00 H new ATOM 0 HH21 ARG A 86 5.298 -10.560 8.841 1.00 0.00 H new ATOM 0 HH22 ARG A 86 6.905 -10.191 8.207 1.00 0.00 H new ATOM 1372 N VAL A 87 1.571 -5.526 2.905 1.00 0.00 N ATOM 1373 CA VAL A 87 0.726 -4.975 1.862 1.00 0.00 C ATOM 1374 C VAL A 87 -0.130 -6.089 1.268 1.00 0.00 C ATOM 1375 O VAL A 87 0.397 -7.061 0.731 1.00 0.00 O ATOM 1376 CB VAL A 87 1.599 -4.344 0.776 1.00 0.00 C ATOM 1377 CG1 VAL A 87 0.707 -3.723 -0.292 1.00 0.00 C ATOM 1378 CG2 VAL A 87 2.493 -3.254 1.356 1.00 0.00 C ATOM 0 H VAL A 87 1.853 -6.493 2.744 1.00 0.00 H new ATOM 0 HA VAL A 87 0.075 -4.208 2.281 1.00 0.00 H new ATOM 0 HB VAL A 87 2.226 -5.126 0.347 1.00 0.00 H new ATOM 0 HG11 VAL A 87 1.327 -3.273 -1.067 1.00 0.00 H new ATOM 0 HG12 VAL A 87 0.077 -4.495 -0.734 1.00 0.00 H new ATOM 0 HG13 VAL A 87 0.078 -2.956 0.160 1.00 0.00 H new ATOM 0 HG21 VAL A 87 3.103 -2.823 0.562 1.00 0.00 H new ATOM 0 HG22 VAL A 87 1.874 -2.475 1.802 1.00 0.00 H new ATOM 0 HG23 VAL A 87 3.142 -3.684 2.119 1.00 0.00 H new ATOM 1388 N GLN A 88 -1.455 -5.942 1.365 1.00 0.00 N ATOM 1389 CA GLN A 88 -2.403 -6.924 0.854 1.00 0.00 C ATOM 1390 C GLN A 88 -3.776 -6.276 0.678 1.00 0.00 C ATOM 1391 O GLN A 88 -4.000 -5.163 1.153 1.00 0.00 O ATOM 1392 CB GLN A 88 -2.503 -8.122 1.813 1.00 0.00 C ATOM 1393 CG GLN A 88 -2.984 -7.729 3.216 1.00 0.00 C ATOM 1394 CD GLN A 88 -1.917 -6.994 4.015 1.00 0.00 C ATOM 1395 OE1 GLN A 88 -0.792 -7.465 4.153 1.00 0.00 O ATOM 1396 NE2 GLN A 88 -2.255 -5.825 4.553 1.00 0.00 N ATOM 0 H GLN A 88 -1.897 -5.134 1.803 1.00 0.00 H new ATOM 0 HA GLN A 88 -2.051 -7.283 -0.113 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -3.187 -8.860 1.394 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -1.527 -8.601 1.891 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -3.868 -7.097 3.129 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -3.285 -8.626 3.758 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -3.197 -5.457 4.422 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -1.572 -5.297 5.096 1.00 0.00 H new ATOM 1405 N MET A 89 -4.701 -6.959 0.000 1.00 0.00 N ATOM 1406 CA MET A 89 -6.022 -6.408 -0.277 1.00 0.00 C ATOM 1407 C MET A 89 -6.818 -6.191 1.011 1.00 0.00 C ATOM 1408 O MET A 89 -6.652 -6.916 1.990 1.00 0.00 O ATOM 1409 CB MET A 89 -6.768 -7.334 -1.243 1.00 0.00 C ATOM 1410 CG MET A 89 -5.935 -7.550 -2.512 1.00 0.00 C ATOM 1411 SD MET A 89 -5.510 -6.028 -3.407 1.00 0.00 S ATOM 1412 CE MET A 89 -4.184 -6.671 -4.461 1.00 0.00 C ATOM 0 H MET A 89 -4.555 -7.899 -0.367 1.00 0.00 H new ATOM 0 HA MET A 89 -5.904 -5.430 -0.744 1.00 0.00 H new ATOM 0 HB2 MET A 89 -6.967 -8.291 -0.761 1.00 0.00 H new ATOM 0 HB3 MET A 89 -7.734 -6.901 -1.502 1.00 0.00 H new ATOM 0 HG2 MET A 89 -5.014 -8.066 -2.242 1.00 0.00 H new ATOM 0 HG3 MET A 89 -6.485 -8.209 -3.184 1.00 0.00 H new ATOM 0 HE1 MET A 89 -3.796 -5.868 -5.088 1.00 0.00 H new ATOM 0 HE2 MET A 89 -3.381 -7.064 -3.837 1.00 0.00 H new ATOM 0 HE3 MET A 89 -4.576 -7.468 -5.093 1.00 0.00 H new ATOM 1422 N ALA A 90 -7.694 -5.180 1.003 1.00 0.00 N ATOM 1423 CA ALA A 90 -8.477 -4.787 2.163 1.00 0.00 C ATOM 1424 C ALA A 90 -9.812 -5.535 2.247 1.00 0.00 C ATOM 1425 O ALA A 90 -10.098 -6.401 1.422 1.00 0.00 O ATOM 1426 CB ALA A 90 -8.720 -3.277 2.102 1.00 0.00 C ATOM 0 H ALA A 90 -7.876 -4.610 0.177 1.00 0.00 H new ATOM 0 HA ALA A 90 -7.915 -5.048 3.059 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -9.307 -2.968 2.967 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -7.764 -2.754 2.107 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -9.263 -3.032 1.189 1.00 0.00 H new ATOM 1432 N ARG A 91 -10.625 -5.184 3.251 1.00 0.00 N ATOM 1433 CA ARG A 91 -11.944 -5.769 3.477 1.00 0.00 C ATOM 1434 C ARG A 91 -12.944 -4.689 3.902 1.00 0.00 C ATOM 1435 O ARG A 91 -12.577 -3.526 4.057 1.00 0.00 O ATOM 1436 CB ARG A 91 -11.839 -6.870 4.540 1.00 0.00 C ATOM 1437 CG ARG A 91 -11.517 -6.268 5.907 1.00 0.00 C ATOM 1438 CD ARG A 91 -11.254 -7.347 6.951 1.00 0.00 C ATOM 1439 NE ARG A 91 -10.967 -6.738 8.256 1.00 0.00 N ATOM 1440 CZ ARG A 91 -10.530 -7.413 9.324 1.00 0.00 C ATOM 1441 NH1 ARG A 91 -10.331 -8.728 9.271 1.00 0.00 N ATOM 1442 NH2 ARG A 91 -10.291 -6.758 10.457 1.00 0.00 N ATOM 0 H ARG A 91 -10.376 -4.473 3.939 1.00 0.00 H new ATOM 0 HA ARG A 91 -12.307 -6.210 2.549 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -12.777 -7.424 4.592 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -11.063 -7.582 4.258 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -10.643 -5.622 5.823 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -12.347 -5.641 6.233 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -12.121 -8.003 7.031 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -10.413 -7.967 6.639 1.00 0.00 H new ATOM 0 HE ARG A 91 -11.111 -5.733 8.354 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -10.512 -9.237 8.406 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -9.997 -9.227 10.096 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -10.441 -5.750 10.505 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -9.957 -7.264 11.278 1.00 0.00 H new ATOM 1456 N TYR A 92 -14.207 -5.083 4.088 1.00 0.00 N ATOM 1457 CA TYR A 92 -15.297 -4.183 4.460 1.00 0.00 C ATOM 1458 C TYR A 92 -15.371 -2.954 3.545 1.00 0.00 C ATOM 1459 O TYR A 92 -14.793 -2.933 2.457 1.00 0.00 O ATOM 1460 CB TYR A 92 -15.141 -3.766 5.927 1.00 0.00 C ATOM 1461 CG TYR A 92 -14.932 -4.885 6.918 1.00 0.00 C ATOM 1462 CD1 TYR A 92 -15.577 -6.121 6.759 1.00 0.00 C ATOM 1463 CD2 TYR A 92 -14.078 -4.676 8.011 1.00 0.00 C ATOM 1464 CE1 TYR A 92 -15.374 -7.148 7.693 1.00 0.00 C ATOM 1465 CE2 TYR A 92 -13.863 -5.698 8.948 1.00 0.00 C ATOM 1466 CZ TYR A 92 -14.513 -6.940 8.792 1.00 0.00 C ATOM 1467 OH TYR A 92 -14.308 -7.935 9.702 1.00 0.00 O ATOM 0 H TYR A 92 -14.503 -6.053 3.982 1.00 0.00 H new ATOM 0 HA TYR A 92 -16.237 -4.721 4.335 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -14.297 -3.081 6.001 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -16.030 -3.209 6.222 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -16.232 -6.282 5.915 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -13.583 -3.724 8.132 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -15.876 -8.097 7.571 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -13.202 -5.534 9.786 1.00 0.00 H new ATOM 0 HH TYR A 92 -13.687 -7.624 10.393 1.00 0.00 H new ATOM 1477 N GLY A 93 -16.085 -1.920 4.001 1.00 0.00 N ATOM 1478 CA GLY A 93 -16.156 -0.632 3.328 1.00 0.00 C ATOM 1479 C GLY A 93 -15.937 0.488 4.342 1.00 0.00 C ATOM 1480 O GLY A 93 -15.351 1.516 4.008 1.00 0.00 O ATOM 0 H GLY A 93 -16.635 -1.961 4.859 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -15.402 -0.578 2.543 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -17.127 -0.515 2.846 1.00 0.00 H new ATOM 1484 N ARG A 94 -16.399 0.288 5.582 1.00 0.00 N ATOM 1485 CA ARG A 94 -16.105 1.125 6.716 1.00 0.00 C ATOM 1486 C ARG A 94 -16.394 0.275 7.959 1.00 0.00 C ATOM 1487 O ARG A 94 -17.306 -0.550 7.933 1.00 0.00 O ATOM 1488 CB ARG A 94 -16.981 2.382 6.664 1.00 0.00 C ATOM 1489 CG ARG A 94 -17.602 2.681 8.027 1.00 0.00 C ATOM 1490 CD ARG A 94 -18.380 3.991 8.008 1.00 0.00 C ATOM 1491 NE ARG A 94 -19.416 4.013 9.049 1.00 0.00 N ATOM 1492 CZ ARG A 94 -19.204 4.161 10.363 1.00 0.00 C ATOM 1493 NH1 ARG A 94 -17.988 4.341 10.863 1.00 0.00 N ATOM 1494 NH2 ARG A 94 -20.240 4.131 11.195 1.00 0.00 N ATOM 0 H ARG A 94 -17.010 -0.495 5.816 1.00 0.00 H new ATOM 0 HA ARG A 94 -15.069 1.464 6.728 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -16.381 3.233 6.340 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -17.770 2.248 5.924 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -18.267 1.866 8.313 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -16.818 2.733 8.782 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -17.695 4.825 8.157 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -18.841 4.128 7.030 1.00 0.00 H new ATOM 0 HE ARG A 94 -20.383 3.906 8.744 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -17.180 4.370 10.241 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -17.861 4.450 11.869 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -21.183 3.996 10.830 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -20.092 4.242 12.198 1.00 0.00 H new ATOM 1508 N PRO A 95 -15.626 0.466 9.035 1.00 0.00 N ATOM 1509 CA PRO A 95 -15.812 -0.161 10.333 1.00 0.00 C ATOM 1510 C PRO A 95 -17.197 0.153 10.903 1.00 0.00 C ATOM 1511 O PRO A 95 -17.508 1.314 11.158 1.00 0.00 O ATOM 1512 CB PRO A 95 -14.688 0.392 11.211 1.00 0.00 C ATOM 1513 CG PRO A 95 -14.272 1.692 10.516 1.00 0.00 C ATOM 1514 CD PRO A 95 -14.490 1.348 9.051 1.00 0.00 C ATOM 0 HA PRO A 95 -15.766 -1.248 10.275 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -15.032 0.577 12.229 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -13.855 -0.308 11.279 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -14.883 2.538 10.832 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -13.234 1.953 10.724 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -14.679 2.244 8.460 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -13.611 0.865 8.625 1.00 0.00 H new ATOM 1522 N PRO A 96 -18.038 -0.871 11.106 1.00 0.00 N ATOM 1523 CA PRO A 96 -19.383 -0.729 11.639 1.00 0.00 C ATOM 1524 C PRO A 96 -19.383 -0.547 13.156 1.00 0.00 C ATOM 1525 O PRO A 96 -20.442 -0.391 13.767 1.00 0.00 O ATOM 1526 CB PRO A 96 -20.072 -2.041 11.288 1.00 0.00 C ATOM 1527 CG PRO A 96 -18.935 -3.058 11.361 1.00 0.00 C ATOM 1528 CD PRO A 96 -17.747 -2.265 10.816 1.00 0.00 C ATOM 0 HA PRO A 96 -19.878 0.150 11.225 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -20.871 -2.278 11.991 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -20.521 -2.008 10.295 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -18.761 -3.400 12.381 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -19.143 -3.943 10.759 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -16.817 -2.578 11.291 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -17.628 -2.425 9.744 1.00 0.00 H new ATOM 1536 N ASP A 97 -18.196 -0.567 13.766 1.00 0.00 N ATOM 1537 CA ASP A 97 -18.036 -0.533 15.212 1.00 0.00 C ATOM 1538 C ASP A 97 -17.209 0.681 15.646 1.00 0.00 C ATOM 1539 O ASP A 97 -16.587 0.667 16.705 1.00 0.00 O ATOM 1540 CB ASP A 97 -17.415 -1.856 15.667 1.00 0.00 C ATOM 1541 CG ASP A 97 -17.419 -2.011 17.188 1.00 0.00 C ATOM 1542 OD1 ASP A 97 -18.486 -1.760 17.795 1.00 0.00 O ATOM 1543 OD2 ASP A 97 -16.353 -2.377 17.734 1.00 0.00 O ATOM 0 H ASP A 97 -17.312 -0.608 13.259 1.00 0.00 H new ATOM 0 HA ASP A 97 -19.008 -0.422 15.692 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -17.964 -2.684 15.219 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -16.390 -1.918 15.301 1.00 0.00 H new ATOM 1548 N SER A 98 -17.207 1.737 14.824 1.00 0.00 N ATOM 1549 CA SER A 98 -16.455 2.954 15.105 1.00 0.00 C ATOM 1550 C SER A 98 -17.228 4.191 14.655 1.00 0.00 C ATOM 1551 O SER A 98 -18.183 4.093 13.883 1.00 0.00 O ATOM 1552 CB SER A 98 -15.109 2.905 14.372 1.00 0.00 C ATOM 1553 OG SER A 98 -14.341 1.806 14.813 1.00 0.00 O ATOM 0 H SER A 98 -17.728 1.767 13.947 1.00 0.00 H new ATOM 0 HA SER A 98 -16.294 3.017 16.181 1.00 0.00 H new ATOM 0 HB2 SER A 98 -15.277 2.830 13.298 1.00 0.00 H new ATOM 0 HB3 SER A 98 -14.561 3.831 14.545 1.00 0.00 H new ATOM 0 HG SER A 98 -13.487 1.790 14.333 1.00 0.00 H new ATOM 1559 N HIS A 99 -16.808 5.361 15.147 1.00 0.00 N ATOM 1560 CA HIS A 99 -17.418 6.651 14.842 1.00 0.00 C ATOM 1561 C HIS A 99 -18.942 6.643 14.987 1.00 0.00 C ATOM 1562 O HIS A 99 -19.656 7.258 14.194 1.00 0.00 O ATOM 1563 CB HIS A 99 -16.931 7.116 13.467 1.00 0.00 C ATOM 1564 CG HIS A 99 -17.409 8.489 13.063 1.00 0.00 C ATOM 1565 ND1 HIS A 99 -17.663 8.905 11.752 1.00 0.00 N ATOM 1566 CD2 HIS A 99 -17.664 9.523 13.920 1.00 0.00 C ATOM 1567 CE1 HIS A 99 -18.062 10.180 11.855 1.00 0.00 C ATOM 1568 NE2 HIS A 99 -18.072 10.577 13.141 1.00 0.00 N ATOM 0 H HIS A 99 -16.015 5.435 15.784 1.00 0.00 H new ATOM 0 HA HIS A 99 -17.094 7.381 15.583 1.00 0.00 H new ATOM 0 HB2 HIS A 99 -15.841 7.109 13.460 1.00 0.00 H new ATOM 0 HB3 HIS A 99 -17.259 6.396 12.717 1.00 0.00 H new ATOM 0 HD2 HIS A 99 -17.564 9.513 14.995 1.00 0.00 H new ATOM 0 HE1 HIS A 99 -18.338 10.805 11.019 1.00 0.00 H new ATOM 0 HE2 HIS A 99 -18.337 11.502 13.479 1.00 0.00 H new ATOM 1576 N HIS A 100 -19.458 5.947 16.003 1.00 0.00 N ATOM 1577 CA HIS A 100 -20.881 5.976 16.326 1.00 0.00 C ATOM 1578 C HIS A 100 -21.311 7.378 16.785 1.00 0.00 C ATOM 1579 O HIS A 100 -22.508 7.652 16.882 1.00 0.00 O ATOM 1580 CB HIS A 100 -21.186 4.958 17.423 1.00 0.00 C ATOM 1581 CG HIS A 100 -20.868 3.539 17.032 1.00 0.00 C ATOM 1582 ND1 HIS A 100 -20.243 2.600 17.858 1.00 0.00 N ATOM 1583 CD2 HIS A 100 -21.150 2.962 15.825 1.00 0.00 C ATOM 1584 CE1 HIS A 100 -20.169 1.477 17.125 1.00 0.00 C ATOM 1585 NE2 HIS A 100 -20.705 1.665 15.908 1.00 0.00 N ATOM 0 H HIS A 100 -18.903 5.353 16.619 1.00 0.00 H new ATOM 0 HA HIS A 100 -21.441 5.720 15.427 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -20.617 5.217 18.316 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -22.241 5.026 17.687 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -21.627 3.431 14.977 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -19.737 0.548 17.468 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -20.771 0.964 15.170 1.00 0.00 H new ATOM 1593 N SER A 101 -20.340 8.257 17.066 1.00 0.00 N ATOM 1594 CA SER A 101 -20.579 9.628 17.501 1.00 0.00 C ATOM 1595 C SER A 101 -19.390 10.513 17.151 1.00 0.00 C ATOM 1596 O SER A 101 -18.246 10.095 17.443 1.00 0.00 O ATOM 1597 CB SER A 101 -20.836 9.650 19.006 1.00 0.00 C ATOM 1598 OG SER A 101 -19.764 9.037 19.695 1.00 0.00 O ATOM 1599 OXT SER A 101 -19.634 11.605 16.597 1.00 0.00 O ATOM 0 H SER A 101 -19.349 8.025 16.994 1.00 0.00 H new ATOM 0 HA SER A 101 -21.456 10.018 16.984 1.00 0.00 H new ATOM 0 HB2 SER A 101 -20.956 10.678 19.347 1.00 0.00 H new ATOM 0 HB3 SER A 101 -21.767 9.129 19.231 1.00 0.00 H new ATOM 0 HG SER A 101 -18.932 9.176 19.196 1.00 0.00 H new TER 1605 SER A 101 ATOM 1606 O5' U B 102 -7.479 -3.910 15.311 1.00 0.00 O ATOM 1607 C5' U B 102 -7.833 -2.874 14.417 1.00 0.00 C ATOM 1608 C4' U B 102 -6.607 -2.194 13.831 1.00 0.00 C ATOM 1609 O4' U B 102 -6.114 -1.287 14.800 1.00 0.00 O ATOM 1610 C3' U B 102 -5.488 -3.182 13.486 1.00 0.00 C ATOM 1611 O3' U B 102 -4.835 -2.757 12.302 1.00 0.00 O ATOM 1612 C2' U B 102 -4.551 -2.999 14.671 1.00 0.00 C ATOM 1613 O2' U B 102 -3.221 -3.366 14.366 1.00 0.00 O ATOM 1614 C1' U B 102 -4.728 -1.509 14.894 1.00 0.00 C ATOM 1615 N1 U B 102 -4.147 -1.061 16.174 1.00 0.00 N ATOM 1616 C2 U B 102 -4.818 -1.242 17.377 1.00 0.00 C ATOM 1617 O2 U B 102 -5.916 -1.788 17.464 1.00 0.00 O ATOM 1618 N3 U B 102 -4.174 -0.758 18.506 1.00 0.00 N ATOM 1619 C4 U B 102 -2.936 -0.137 18.535 1.00 0.00 C ATOM 1620 O4 U B 102 -2.454 0.254 19.597 1.00 0.00 O ATOM 1621 C5 U B 102 -2.306 -0.013 17.239 1.00 0.00 C ATOM 1622 C6 U B 102 -2.924 -0.472 16.125 1.00 0.00 C ATOM 0 H5' U B 102 -8.444 -2.137 14.938 1.00 0.00 H new ATOM 0 H5'' U B 102 -8.443 -3.282 13.611 1.00 0.00 H new ATOM 0 H4' U B 102 -6.904 -1.700 12.906 1.00 0.00 H new ATOM 0 H3' U B 102 -5.821 -4.207 13.324 1.00 0.00 H new ATOM 0 H2' U B 102 -4.766 -3.618 15.542 1.00 0.00 H new ATOM 0 HO2' U B 102 -3.027 -3.145 13.431 1.00 0.00 H new ATOM 0 HO5' U B 102 -8.291 -4.324 15.670 1.00 0.00 H new ATOM 0 H1' U B 102 -4.190 -0.918 14.153 1.00 0.00 H new ATOM 0 H3 U B 102 -4.657 -0.870 19.398 1.00 0.00 H new ATOM 0 H5 U B 102 -1.334 0.450 17.159 1.00 0.00 H new ATOM 0 H6 U B 102 -2.430 -0.367 15.170 1.00 0.00 H new ATOM 1634 P C B 103 -5.218 -3.370 10.865 1.00 0.00 P ATOM 1635 OP1 C B 103 -5.292 -4.845 11.003 1.00 0.00 O ATOM 1636 OP2 C B 103 -4.303 -2.782 9.863 1.00 0.00 O ATOM 1637 O5' C B 103 -6.706 -2.829 10.560 1.00 0.00 O ATOM 1638 C5' C B 103 -6.932 -1.480 10.208 1.00 0.00 C ATOM 1639 C4' C B 103 -8.379 -1.243 9.763 1.00 0.00 C ATOM 1640 O4' C B 103 -8.544 -1.632 8.409 1.00 0.00 O ATOM 1641 C3' C B 103 -9.372 -2.049 10.598 1.00 0.00 C ATOM 1642 O3' C B 103 -10.605 -1.361 10.715 1.00 0.00 O ATOM 1643 C2' C B 103 -9.526 -3.319 9.772 1.00 0.00 C ATOM 1644 O2' C B 103 -10.799 -3.909 9.934 1.00 0.00 O ATOM 1645 C1' C B 103 -9.305 -2.824 8.343 1.00 0.00 C ATOM 1646 N1 C B 103 -8.601 -3.811 7.491 1.00 0.00 N ATOM 1647 C2 C B 103 -8.962 -3.866 6.150 1.00 0.00 C ATOM 1648 O2 C B 103 -9.817 -3.106 5.700 1.00 0.00 O ATOM 1649 N3 C B 103 -8.356 -4.776 5.346 1.00 0.00 N ATOM 1650 C4 C B 103 -7.423 -5.598 5.828 1.00 0.00 C ATOM 1651 N4 C B 103 -6.864 -6.486 5.011 1.00 0.00 N ATOM 1652 C5 C B 103 -7.012 -5.537 7.192 1.00 0.00 C ATOM 1653 C6 C B 103 -7.626 -4.637 7.985 1.00 0.00 C ATOM 0 H5' C B 103 -6.253 -1.195 9.404 1.00 0.00 H new ATOM 0 H5'' C B 103 -6.704 -0.839 11.060 1.00 0.00 H new ATOM 0 H4' C B 103 -8.577 -0.179 9.894 1.00 0.00 H new ATOM 0 H3' C B 103 -9.045 -2.231 11.622 1.00 0.00 H new ATOM 0 H2' C B 103 -8.830 -4.105 10.067 1.00 0.00 H new ATOM 0 HO2' C B 103 -11.432 -3.237 10.263 1.00 0.00 H new ATOM 0 H1' C B 103 -10.281 -2.658 7.886 1.00 0.00 H new ATOM 0 H41 C B 103 -6.149 -7.123 5.362 1.00 0.00 H new ATOM 0 H42 C B 103 -7.151 -6.530 4.033 1.00 0.00 H new ATOM 0 H5 C B 103 -6.239 -6.187 7.575 1.00 0.00 H new ATOM 0 H6 C B 103 -7.345 -4.566 9.025 1.00 0.00 H new ATOM 1665 P C B 104 -10.689 -0.001 11.568 1.00 0.00 P ATOM 1666 OP1 C B 104 -9.369 0.219 12.205 1.00 0.00 O ATOM 1667 OP2 C B 104 -11.896 -0.057 12.420 1.00 0.00 O ATOM 1668 O5' C B 104 -10.898 1.146 10.451 1.00 0.00 O ATOM 1669 C5' C B 104 -10.651 2.493 10.802 1.00 0.00 C ATOM 1670 C4' C B 104 -10.757 3.486 9.642 1.00 0.00 C ATOM 1671 O4' C B 104 -9.952 3.064 8.561 1.00 0.00 O ATOM 1672 C3' C B 104 -12.153 3.712 9.078 1.00 0.00 C ATOM 1673 O3' C B 104 -12.973 4.593 9.823 1.00 0.00 O ATOM 1674 C2' C B 104 -11.828 4.260 7.700 1.00 0.00 C ATOM 1675 O2' C B 104 -11.591 5.652 7.733 1.00 0.00 O ATOM 1676 C1' C B 104 -10.528 3.550 7.364 1.00 0.00 C ATOM 1677 N1 C B 104 -10.890 2.409 6.494 1.00 0.00 N ATOM 1678 C2 C B 104 -10.678 2.514 5.129 1.00 0.00 C ATOM 1679 O2 C B 104 -10.132 3.509 4.653 1.00 0.00 O ATOM 1680 N3 C B 104 -11.085 1.495 4.326 1.00 0.00 N ATOM 1681 C4 C B 104 -11.646 0.401 4.844 1.00 0.00 C ATOM 1682 N4 C B 104 -12.013 -0.574 4.016 1.00 0.00 N ATOM 1683 C5 C B 104 -11.849 0.261 6.250 1.00 0.00 C ATOM 1684 C6 C B 104 -11.460 1.290 7.031 1.00 0.00 C ATOM 0 H5' C B 104 -9.653 2.565 11.234 1.00 0.00 H new ATOM 0 H5'' C B 104 -11.356 2.787 11.580 1.00 0.00 H new ATOM 0 H4' C B 104 -10.430 4.426 10.087 1.00 0.00 H new ATOM 0 H3' C B 104 -12.754 2.803 9.090 1.00 0.00 H new ATOM 0 H2' C B 104 -12.639 4.103 6.989 1.00 0.00 H new ATOM 0 HO2' C B 104 -10.663 5.820 8.000 1.00 0.00 H new ATOM 0 H1' C B 104 -9.817 4.214 6.872 1.00 0.00 H new ATOM 0 H41 C B 104 -12.444 -1.421 4.385 1.00 0.00 H new ATOM 0 H42 C B 104 -11.863 -0.474 3.012 1.00 0.00 H new ATOM 0 H5 C B 104 -12.294 -0.629 6.670 1.00 0.00 H new ATOM 0 H6 C B 104 -11.602 1.228 8.100 1.00 0.00 H new ATOM 1696 P A B 105 -14.424 5.056 9.269 1.00 0.00 P ATOM 1697 OP1 A B 105 -15.405 4.881 10.360 1.00 0.00 O ATOM 1698 OP2 A B 105 -14.673 4.394 7.971 1.00 0.00 O ATOM 1699 O5' A B 105 -14.272 6.635 8.966 1.00 0.00 O ATOM 1700 C5' A B 105 -15.033 7.592 9.676 1.00 0.00 C ATOM 1701 C4' A B 105 -14.354 8.024 10.978 1.00 0.00 C ATOM 1702 O4' A B 105 -14.177 6.938 11.875 1.00 0.00 O ATOM 1703 C3' A B 105 -12.978 8.653 10.721 1.00 0.00 C ATOM 1704 O3' A B 105 -12.885 9.896 11.389 1.00 0.00 O ATOM 1705 C2' A B 105 -12.051 7.654 11.400 1.00 0.00 C ATOM 1706 O2' A B 105 -10.862 8.235 11.890 1.00 0.00 O ATOM 1707 C1' A B 105 -12.951 7.177 12.524 1.00 0.00 C ATOM 1708 N9 A B 105 -12.393 6.027 13.252 1.00 0.00 N ATOM 1709 C8 A B 105 -11.577 5.056 12.751 1.00 0.00 C ATOM 1710 N7 A B 105 -11.199 4.160 13.622 1.00 0.00 N ATOM 1711 C5 A B 105 -11.797 4.597 14.804 1.00 0.00 C ATOM 1712 C6 A B 105 -11.774 4.115 16.128 1.00 0.00 C ATOM 1713 N6 A B 105 -11.116 3.017 16.506 1.00 0.00 N ATOM 1714 N1 A B 105 -12.444 4.795 17.066 1.00 0.00 N ATOM 1715 C2 A B 105 -13.099 5.891 16.712 1.00 0.00 C ATOM 1716 N3 A B 105 -13.216 6.442 15.515 1.00 0.00 N ATOM 1717 C4 A B 105 -12.531 5.732 14.585 1.00 0.00 C ATOM 0 H5' A B 105 -16.015 7.177 9.901 1.00 0.00 H new ATOM 0 H5'' A B 105 -15.193 8.466 9.045 1.00 0.00 H new ATOM 0 H4' A B 105 -15.022 8.761 11.424 1.00 0.00 H new ATOM 0 H3' A B 105 -12.763 8.834 9.668 1.00 0.00 H new ATOM 0 H2' A B 105 -11.679 6.874 10.735 1.00 0.00 H new ATOM 0 HO2' A B 105 -11.010 9.189 12.060 1.00 0.00 H new ATOM 0 H1' A B 105 -13.067 7.902 13.329 1.00 0.00 H new ATOM 0 H8 A B 105 -11.268 5.030 11.716 1.00 0.00 H new ATOM 0 H61 A B 105 -11.138 2.720 17.481 1.00 0.00 H new ATOM 0 H62 A B 105 -10.591 2.475 15.819 1.00 0.00 H new ATOM 0 H2 A B 105 -13.609 6.407 17.513 1.00 0.00 H new ATOM 1729 P G B 106 -13.583 11.214 10.785 1.00 0.00 P ATOM 1730 OP1 G B 106 -13.684 12.209 11.876 1.00 0.00 O ATOM 1731 OP2 G B 106 -14.802 10.812 10.052 1.00 0.00 O ATOM 1732 O5' G B 106 -12.516 11.757 9.709 1.00 0.00 O ATOM 1733 C5' G B 106 -11.305 12.353 10.130 1.00 0.00 C ATOM 1734 C4' G B 106 -10.657 13.169 9.008 1.00 0.00 C ATOM 1735 O4' G B 106 -9.901 12.368 8.113 1.00 0.00 O ATOM 1736 C3' G B 106 -11.707 13.922 8.193 1.00 0.00 C ATOM 1737 O3' G B 106 -11.216 15.220 7.916 1.00 0.00 O ATOM 1738 C2' G B 106 -11.853 13.077 6.931 1.00 0.00 C ATOM 1739 O2' G B 106 -11.947 13.879 5.773 1.00 0.00 O ATOM 1740 C1' G B 106 -10.600 12.213 6.890 1.00 0.00 C ATOM 1741 N9 G B 106 -10.934 10.791 6.665 1.00 0.00 N ATOM 1742 C8 G B 106 -11.931 10.029 7.220 1.00 0.00 C ATOM 1743 N7 G B 106 -11.959 8.798 6.789 1.00 0.00 N ATOM 1744 C5 G B 106 -10.902 8.736 5.883 1.00 0.00 C ATOM 1745 C6 G B 106 -10.424 7.651 5.087 1.00 0.00 C ATOM 1746 O6 G B 106 -10.843 6.497 5.029 1.00 0.00 O ATOM 1747 N1 G B 106 -9.344 8.025 4.301 1.00 0.00 N ATOM 1748 C2 G B 106 -8.780 9.276 4.287 1.00 0.00 C ATOM 1749 N2 G B 106 -7.734 9.454 3.489 1.00 0.00 N ATOM 1750 N3 G B 106 -9.219 10.299 5.024 1.00 0.00 N ATOM 1751 C4 G B 106 -10.275 9.957 5.800 1.00 0.00 C ATOM 0 H5' G B 106 -10.614 11.578 10.463 1.00 0.00 H new ATOM 0 H5'' G B 106 -11.496 12.999 10.987 1.00 0.00 H new ATOM 0 H4' G B 106 -9.988 13.869 9.508 1.00 0.00 H new ATOM 0 H3' G B 106 -12.666 14.054 8.693 1.00 0.00 H new ATOM 0 H2' G B 106 -12.766 12.483 6.953 1.00 0.00 H new ATOM 0 HO2' G B 106 -11.366 14.662 5.869 1.00 0.00 H new ATOM 0 H1' G B 106 -9.973 12.535 6.058 1.00 0.00 H new ATOM 0 H8 G B 106 -12.630 10.414 7.948 1.00 0.00 H new ATOM 0 H1 G B 106 -8.939 7.318 3.688 1.00 0.00 H new ATOM 0 H21 G B 106 -7.278 10.365 3.441 1.00 0.00 H new ATOM 0 H22 G B 106 -7.386 8.680 2.923 1.00 0.00 H new ATOM 1763 P U B 107 -12.137 16.531 8.128 1.00 0.00 P ATOM 1764 OP1 U B 107 -11.239 17.703 8.253 1.00 0.00 O ATOM 1765 OP2 U B 107 -13.106 16.245 9.208 1.00 0.00 O ATOM 1766 O5' U B 107 -12.951 16.670 6.751 1.00 0.00 O ATOM 1767 C5' U B 107 -12.348 17.274 5.620 1.00 0.00 C ATOM 1768 C4' U B 107 -13.329 17.296 4.453 1.00 0.00 C ATOM 1769 O4' U B 107 -12.912 18.209 3.443 1.00 0.00 O ATOM 1770 C3' U B 107 -13.466 15.936 3.776 1.00 0.00 C ATOM 1771 O3' U B 107 -14.385 15.070 4.411 1.00 0.00 O ATOM 1772 C2' U B 107 -13.974 16.363 2.411 1.00 0.00 C ATOM 1773 O2' U B 107 -15.347 16.696 2.464 1.00 0.00 O ATOM 1774 C1' U B 107 -13.194 17.649 2.166 1.00 0.00 C ATOM 1775 N1 U B 107 -11.986 17.377 1.340 1.00 0.00 N ATOM 1776 C2 U B 107 -10.720 17.318 1.917 1.00 0.00 C ATOM 1777 O2 U B 107 -10.506 17.440 3.122 1.00 0.00 O ATOM 1778 N3 U B 107 -9.661 17.109 1.050 1.00 0.00 N ATOM 1779 C4 U B 107 -9.749 16.928 -0.315 1.00 0.00 C ATOM 1780 O4 U B 107 -8.736 16.749 -0.985 1.00 0.00 O ATOM 1781 C5 U B 107 -11.098 16.975 -0.829 1.00 0.00 C ATOM 1782 C6 U B 107 -12.149 17.192 -0.008 1.00 0.00 C ATOM 0 H5' U B 107 -11.450 16.724 5.340 1.00 0.00 H new ATOM 0 H5'' U B 107 -12.037 18.290 5.863 1.00 0.00 H new ATOM 0 H4' U B 107 -14.282 17.594 4.890 1.00 0.00 H new ATOM 0 H3' U B 107 -12.542 15.358 3.782 1.00 0.00 H new ATOM 0 H2' U B 107 -13.853 15.586 1.656 1.00 0.00 H new ATOM 0 HO2' U B 107 -15.770 16.223 3.211 1.00 0.00 H new ATOM 0 HO3' U B 107 -13.902 14.460 5.006 1.00 0.00 H new ATOM 0 H1' U B 107 -13.765 18.375 1.588 1.00 0.00 H new ATOM 0 H3 U B 107 -8.727 17.087 1.459 1.00 0.00 H new ATOM 0 H5 U B 107 -11.269 16.835 -1.886 1.00 0.00 H new ATOM 0 H6 U B 107 -13.145 17.220 -0.426 1.00 0.00 H new TER 1794 U B 107