USER MOD reduce.3.24.130724 H: found=0, std=0, add=923, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 920 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 52 THR OG1 : rot 110:sc= -0.0886 USER MOD Set 1.2: A 55 ASN : amide:sc= 0.418 X(o=0.33,f=-0.094) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 THR OG1 : rot 112:sc= 0.947 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 MET CE :methyl 159:sc= -4.73! (180deg=-5.94!) USER MOD Single : A 19 HIS :FLIP no HD1:sc= -0.546 F(o=-2.6!,f=-0.55) USER MOD Single : A 21 THR OG1 : rot 69:sc= 0.442 USER MOD Single : A 24 GLN : amide:sc= -0.104 X(o=-0.1,f=-0.1) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 GLN : amide:sc= -0.661 K(o=-0.66,f=-4!) USER MOD Single : A 56 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 70 GLN : amide:sc= -0.167 X(o=-0.17,f=0) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 74 TYR OH : rot 169:sc= 0.247 USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot -170:sc= -0.172 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0.1 USER MOD Single : A 91 LYS NZ :NH3+ -111:sc= -0.0406 (180deg=-0.593) USER MOD Single : A 100 THR OG1 : rot -170:sc= 0 USER MOD Single : A 105 LYS NZ :NH3+ 153:sc= 1.2 (180deg=0.751) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot -57:sc= 1.15 USER MOD Single : A 125 ASN : amide:sc= -0.169 X(o=-0.17,f=-0.46) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.339 -0.890 -0.665 1.00 12.24 N ATOM 2 CA MET A 1 2.190 0.290 -0.562 1.00 21.20 C ATOM 3 C MET A 1 3.652 -0.109 -0.383 1.00 53.53 C ATOM 4 O MET A 1 4.141 -0.220 0.741 1.00 10.12 O ATOM 5 CB MET A 1 1.742 1.168 0.608 1.00 40.23 C ATOM 6 CG MET A 1 2.660 2.352 0.866 1.00 64.34 C ATOM 7 SD MET A 1 1.975 3.515 2.061 1.00 65.11 S ATOM 8 CE MET A 1 2.543 2.793 3.599 1.00 51.41 C ATOM 0 H1 MET A 1 0.349 -0.595 -0.786 1.00 12.24 H new ATOM 0 H2 MET A 1 1.633 -1.460 -1.484 1.00 12.24 H new ATOM 0 H3 MET A 1 1.427 -1.458 0.202 1.00 12.24 H new ATOM 0 HA MET A 1 2.097 0.857 -1.488 1.00 21.20 H new ATOM 0 HB2 MET A 1 0.735 1.536 0.411 1.00 40.23 H new ATOM 0 HB3 MET A 1 1.688 0.558 1.510 1.00 40.23 H new ATOM 0 HG2 MET A 1 3.622 1.989 1.229 1.00 64.34 H new ATOM 0 HG3 MET A 1 2.849 2.872 -0.073 1.00 64.34 H new ATOM 0 HE1 MET A 1 2.198 3.401 4.435 1.00 51.41 H new ATOM 0 HE2 MET A 1 2.145 1.783 3.696 1.00 51.41 H new ATOM 0 HE3 MET A 1 3.632 2.755 3.603 1.00 51.41 H new ATOM 18 N ILE A 2 4.343 -0.322 -1.498 1.00 14.11 N ATOM 19 CA ILE A 2 5.748 -0.707 -1.463 1.00 40.10 C ATOM 20 C ILE A 2 6.618 0.435 -0.948 1.00 61.23 C ATOM 21 O ILE A 2 6.377 1.601 -1.260 1.00 4.33 O ATOM 22 CB ILE A 2 6.250 -1.132 -2.855 1.00 70.45 C ATOM 23 CG1 ILE A 2 5.328 -2.198 -3.450 1.00 75.43 C ATOM 24 CG2 ILE A 2 7.678 -1.649 -2.769 1.00 4.24 C ATOM 25 CD1 ILE A 2 5.311 -3.490 -2.663 1.00 75.13 C ATOM 0 H ILE A 2 3.953 -0.234 -2.436 1.00 14.11 H new ATOM 0 HA ILE A 2 5.826 -1.555 -0.783 1.00 40.10 H new ATOM 0 HB ILE A 2 6.239 -0.261 -3.510 1.00 70.45 H new ATOM 0 HG12 ILE A 2 4.314 -1.801 -3.503 1.00 75.43 H new ATOM 0 HG13 ILE A 2 5.642 -2.409 -4.472 1.00 75.43 H new ATOM 0 HG21 ILE A 2 8.018 -1.945 -3.761 1.00 4.24 H new ATOM 0 HG22 ILE A 2 8.327 -0.863 -2.383 1.00 4.24 H new ATOM 0 HG23 ILE A 2 7.714 -2.510 -2.101 1.00 4.24 H new ATOM 0 HD11 ILE A 2 4.636 -4.199 -3.143 1.00 75.13 H new ATOM 0 HD12 ILE A 2 6.316 -3.910 -2.631 1.00 75.13 H new ATOM 0 HD13 ILE A 2 4.968 -3.293 -1.647 1.00 75.13 H new ATOM 37 N ARG A 3 7.631 0.090 -0.160 1.00 44.34 N ATOM 38 CA ARG A 3 8.538 1.086 0.397 1.00 5.32 C ATOM 39 C ARG A 3 9.991 0.645 0.245 1.00 61.44 C ATOM 40 O ARG A 3 10.847 1.421 -0.181 1.00 53.51 O ATOM 41 CB ARG A 3 8.220 1.327 1.874 1.00 50.21 C ATOM 42 CG ARG A 3 7.045 2.265 2.098 1.00 31.24 C ATOM 43 CD ARG A 3 7.478 3.722 2.053 1.00 22.24 C ATOM 44 NE ARG A 3 8.184 4.121 3.268 1.00 30.31 N ATOM 45 CZ ARG A 3 8.395 5.386 3.614 1.00 71.14 C ATOM 46 NH1 ARG A 3 7.956 6.370 2.840 1.00 23.45 N ATOM 47 NH2 ARG A 3 9.046 5.669 4.735 1.00 55.12 N ATOM 0 H ARG A 3 7.844 -0.871 0.107 1.00 44.34 H new ATOM 0 HA ARG A 3 8.399 2.016 -0.155 1.00 5.32 H new ATOM 0 HB2 ARG A 3 8.007 0.371 2.352 1.00 50.21 H new ATOM 0 HB3 ARG A 3 9.102 1.739 2.364 1.00 50.21 H new ATOM 0 HG2 ARG A 3 6.285 2.086 1.337 1.00 31.24 H new ATOM 0 HG3 ARG A 3 6.586 2.051 3.063 1.00 31.24 H new ATOM 0 HD2 ARG A 3 8.124 3.882 1.190 1.00 22.24 H new ATOM 0 HD3 ARG A 3 6.602 4.356 1.918 1.00 22.24 H new ATOM 0 HE ARG A 3 8.534 3.388 3.885 1.00 30.31 H new ATOM 0 HH11 ARG A 3 7.455 6.156 1.977 1.00 23.45 H new ATOM 0 HH12 ARG A 3 8.119 7.341 3.107 1.00 23.45 H new ATOM 0 HH21 ARG A 3 9.385 4.915 5.332 1.00 55.12 H new ATOM 0 HH22 ARG A 3 9.207 6.641 5.000 1.00 55.12 H new ATOM 61 N THR A 4 10.263 -0.608 0.596 1.00 64.44 N ATOM 62 CA THR A 4 11.612 -1.153 0.500 1.00 73.25 C ATOM 63 C THR A 4 11.594 -2.566 -0.073 1.00 44.11 C ATOM 64 O THR A 4 10.622 -3.302 0.096 1.00 21.32 O ATOM 65 CB THR A 4 12.307 -1.177 1.874 1.00 62.03 C ATOM 66 OG1 THR A 4 11.588 -2.029 2.772 1.00 14.43 O ATOM 67 CG2 THR A 4 12.398 0.224 2.459 1.00 41.35 C ATOM 0 H THR A 4 9.567 -1.265 0.949 1.00 64.44 H new ATOM 0 HA THR A 4 12.171 -0.499 -0.170 1.00 73.25 H new ATOM 0 HB THR A 4 13.317 -1.563 1.739 1.00 62.03 H new ATOM 0 HG1 THR A 4 12.129 -2.821 2.975 1.00 14.43 H new ATOM 0 HG21 THR A 4 12.893 0.182 3.429 1.00 41.35 H new ATOM 0 HG22 THR A 4 12.972 0.862 1.787 1.00 41.35 H new ATOM 0 HG23 THR A 4 11.395 0.633 2.580 1.00 41.35 H new ATOM 75 N ILE A 5 12.675 -2.938 -0.750 1.00 43.03 N ATOM 76 CA ILE A 5 12.784 -4.264 -1.346 1.00 41.21 C ATOM 77 C ILE A 5 14.127 -4.906 -1.016 1.00 31.53 C ATOM 78 O ILE A 5 15.153 -4.228 -0.952 1.00 23.50 O ATOM 79 CB ILE A 5 12.616 -4.209 -2.876 1.00 45.11 C ATOM 80 CG1 ILE A 5 11.296 -3.527 -3.242 1.00 64.43 C ATOM 81 CG2 ILE A 5 12.677 -5.610 -3.466 1.00 41.11 C ATOM 82 CD1 ILE A 5 11.158 -3.233 -4.720 1.00 11.05 C ATOM 0 H ILE A 5 13.488 -2.340 -0.900 1.00 43.03 H new ATOM 0 HA ILE A 5 11.981 -4.868 -0.922 1.00 41.21 H new ATOM 0 HB ILE A 5 13.434 -3.623 -3.296 1.00 45.11 H new ATOM 0 HG12 ILE A 5 10.468 -4.163 -2.927 1.00 64.43 H new ATOM 0 HG13 ILE A 5 11.211 -2.594 -2.685 1.00 64.43 H new ATOM 0 HG21 ILE A 5 12.557 -5.555 -4.548 1.00 41.11 H new ATOM 0 HG22 ILE A 5 13.640 -6.062 -3.231 1.00 41.11 H new ATOM 0 HG23 ILE A 5 11.878 -6.218 -3.043 1.00 41.11 H new ATOM 0 HD11 ILE A 5 10.199 -2.750 -4.907 1.00 11.05 H new ATOM 0 HD12 ILE A 5 11.965 -2.572 -5.036 1.00 11.05 H new ATOM 0 HD13 ILE A 5 11.210 -4.165 -5.283 1.00 11.05 H new ATOM 94 N LEU A 6 14.113 -6.218 -0.808 1.00 63.51 N ATOM 95 CA LEU A 6 15.331 -6.955 -0.486 1.00 52.20 C ATOM 96 C LEU A 6 15.604 -8.037 -1.526 1.00 41.51 C ATOM 97 O LEU A 6 14.707 -8.790 -1.902 1.00 63.53 O ATOM 98 CB LEU A 6 15.217 -7.584 0.903 1.00 21.35 C ATOM 99 CG LEU A 6 16.527 -7.749 1.675 1.00 61.32 C ATOM 100 CD1 LEU A 6 17.460 -8.703 0.944 1.00 2.45 C ATOM 101 CD2 LEU A 6 17.197 -6.399 1.883 1.00 42.13 C ATOM 0 H LEU A 6 13.272 -6.794 -0.856 1.00 63.51 H new ATOM 0 HA LEU A 6 16.164 -6.252 -0.493 1.00 52.20 H new ATOM 0 HB2 LEU A 6 14.540 -6.974 1.502 1.00 21.35 H new ATOM 0 HB3 LEU A 6 14.754 -8.565 0.799 1.00 21.35 H new ATOM 0 HG LEU A 6 16.300 -8.173 2.653 1.00 61.32 H new ATOM 0 HD11 LEU A 6 18.387 -8.808 1.508 1.00 2.45 H new ATOM 0 HD12 LEU A 6 16.981 -9.677 0.847 1.00 2.45 H new ATOM 0 HD13 LEU A 6 17.681 -8.307 -0.047 1.00 2.45 H new ATOM 0 HD21 LEU A 6 18.128 -6.536 2.434 1.00 42.13 H new ATOM 0 HD22 LEU A 6 17.412 -5.946 0.915 1.00 42.13 H new ATOM 0 HD23 LEU A 6 16.533 -5.746 2.449 1.00 42.13 H new ATOM 113 N ALA A 7 16.849 -8.108 -1.985 1.00 43.31 N ATOM 114 CA ALA A 7 17.242 -9.100 -2.978 1.00 51.22 C ATOM 115 C ALA A 7 18.514 -9.826 -2.555 1.00 60.42 C ATOM 116 O ALA A 7 19.386 -9.245 -1.908 1.00 73.30 O ATOM 117 CB ALA A 7 17.435 -8.440 -4.336 1.00 21.04 C ATOM 0 H ALA A 7 17.603 -7.490 -1.685 1.00 43.31 H new ATOM 0 HA ALA A 7 16.443 -9.837 -3.055 1.00 51.22 H new ATOM 0 HB1 ALA A 7 17.728 -9.193 -5.068 1.00 21.04 H new ATOM 0 HB2 ALA A 7 16.501 -7.973 -4.650 1.00 21.04 H new ATOM 0 HB3 ALA A 7 18.214 -7.681 -4.264 1.00 21.04 H new ATOM 123 N ILE A 8 18.613 -11.099 -2.924 1.00 24.00 N ATOM 124 CA ILE A 8 19.780 -11.904 -2.583 1.00 14.05 C ATOM 125 C ILE A 8 20.175 -12.816 -3.738 1.00 63.54 C ATOM 126 O ILE A 8 19.489 -13.795 -4.034 1.00 15.34 O ATOM 127 CB ILE A 8 19.524 -12.763 -1.330 1.00 12.42 C ATOM 128 CG1 ILE A 8 18.985 -11.894 -0.191 1.00 23.31 C ATOM 129 CG2 ILE A 8 20.801 -13.472 -0.904 1.00 54.02 C ATOM 130 CD1 ILE A 8 17.475 -11.814 -0.154 1.00 22.40 C ATOM 0 H ILE A 8 17.900 -11.595 -3.459 1.00 24.00 H new ATOM 0 HA ILE A 8 20.594 -11.209 -2.378 1.00 14.05 H new ATOM 0 HB ILE A 8 18.776 -13.518 -1.571 1.00 12.42 H new ATOM 0 HG12 ILE A 8 19.343 -12.291 0.759 1.00 23.31 H new ATOM 0 HG13 ILE A 8 19.392 -10.887 -0.289 1.00 23.31 H new ATOM 0 HG21 ILE A 8 20.604 -14.075 -0.018 1.00 54.02 H new ATOM 0 HG22 ILE A 8 21.146 -14.117 -1.712 1.00 54.02 H new ATOM 0 HG23 ILE A 8 21.569 -12.733 -0.677 1.00 54.02 H new ATOM 0 HD11 ILE A 8 17.164 -11.182 0.678 1.00 22.40 H new ATOM 0 HD12 ILE A 8 17.110 -11.388 -1.089 1.00 22.40 H new ATOM 0 HD13 ILE A 8 17.061 -12.814 -0.025 1.00 22.40 H new ATOM 142 N ASP A 9 21.287 -12.491 -4.388 1.00 3.31 N ATOM 143 CA ASP A 9 21.777 -13.283 -5.510 1.00 40.43 C ATOM 144 C ASP A 9 23.300 -13.371 -5.490 1.00 11.14 C ATOM 145 O ASP A 9 23.960 -12.693 -4.702 1.00 42.12 O ATOM 146 CB ASP A 9 21.307 -12.676 -6.833 1.00 71.45 C ATOM 147 CG ASP A 9 19.916 -12.082 -6.736 1.00 13.10 C ATOM 148 OD1 ASP A 9 18.937 -12.815 -6.993 1.00 5.12 O ATOM 149 OD2 ASP A 9 19.805 -10.884 -6.402 1.00 50.10 O ATOM 0 H ASP A 9 21.866 -11.684 -4.157 1.00 3.31 H new ATOM 0 HA ASP A 9 21.372 -14.290 -5.416 1.00 40.43 H new ATOM 0 HB2 ASP A 9 22.009 -11.902 -7.144 1.00 71.45 H new ATOM 0 HB3 ASP A 9 21.318 -13.444 -7.606 1.00 71.45 H new ATOM 154 N ASP A 10 23.850 -14.211 -6.359 1.00 24.01 N ATOM 155 CA ASP A 10 25.296 -14.388 -6.441 1.00 34.33 C ATOM 156 C ASP A 10 25.865 -13.656 -7.652 1.00 22.22 C ATOM 157 O ASP A 10 26.852 -12.928 -7.542 1.00 70.51 O ATOM 158 CB ASP A 10 25.645 -15.875 -6.517 1.00 71.44 C ATOM 159 CG ASP A 10 27.102 -16.145 -6.199 1.00 4.12 C ATOM 160 OD1 ASP A 10 27.910 -15.194 -6.261 1.00 55.24 O ATOM 161 OD2 ASP A 10 27.436 -17.307 -5.886 1.00 12.21 O ATOM 0 H ASP A 10 23.317 -14.780 -7.017 1.00 24.01 H new ATOM 0 HA ASP A 10 25.741 -13.964 -5.541 1.00 34.33 H new ATOM 0 HB2 ASP A 10 25.016 -16.429 -5.821 1.00 71.44 H new ATOM 0 HB3 ASP A 10 25.419 -16.248 -7.516 1.00 71.44 H new ATOM 166 N SER A 11 25.237 -13.855 -8.806 1.00 44.03 N ATOM 167 CA SER A 11 25.685 -13.218 -10.039 1.00 54.43 C ATOM 168 C SER A 11 25.829 -11.711 -9.850 1.00 54.55 C ATOM 169 O SER A 11 24.839 -10.996 -9.693 1.00 30.43 O ATOM 170 CB SER A 11 24.702 -13.509 -11.175 1.00 35.23 C ATOM 171 OG SER A 11 25.043 -14.708 -11.849 1.00 54.35 O ATOM 0 H SER A 11 24.417 -14.452 -8.913 1.00 44.03 H new ATOM 0 HA SER A 11 26.661 -13.630 -10.298 1.00 54.43 H new ATOM 0 HB2 SER A 11 23.691 -13.588 -10.774 1.00 35.23 H new ATOM 0 HB3 SER A 11 24.701 -12.679 -11.881 1.00 35.23 H new ATOM 0 HG SER A 11 24.399 -14.873 -12.569 1.00 54.35 H new ATOM 177 N ALA A 12 27.069 -11.234 -9.868 1.00 22.31 N ATOM 178 CA ALA A 12 27.344 -9.813 -9.701 1.00 2.42 C ATOM 179 C ALA A 12 26.516 -8.976 -10.670 1.00 12.33 C ATOM 180 O ALA A 12 26.074 -7.876 -10.336 1.00 40.41 O ATOM 181 CB ALA A 12 28.827 -9.535 -9.896 1.00 25.52 C ATOM 0 H ALA A 12 27.900 -11.812 -9.997 1.00 22.31 H new ATOM 0 HA ALA A 12 27.063 -9.531 -8.686 1.00 2.42 H new ATOM 0 HB1 ALA A 12 29.017 -8.469 -9.768 1.00 25.52 H new ATOM 0 HB2 ALA A 12 29.402 -10.097 -9.160 1.00 25.52 H new ATOM 0 HB3 ALA A 12 29.125 -9.839 -10.899 1.00 25.52 H new ATOM 187 N THR A 13 26.309 -9.503 -11.873 1.00 12.05 N ATOM 188 CA THR A 13 25.535 -8.804 -12.891 1.00 2.23 C ATOM 189 C THR A 13 24.057 -8.757 -12.522 1.00 53.12 C ATOM 190 O THR A 13 23.383 -7.752 -12.748 1.00 72.32 O ATOM 191 CB THR A 13 25.688 -9.472 -14.270 1.00 32.41 C ATOM 192 OG1 THR A 13 27.075 -9.647 -14.579 1.00 1.11 O ATOM 193 CG2 THR A 13 25.023 -8.636 -15.353 1.00 61.31 C ATOM 0 H THR A 13 26.667 -10.412 -12.166 1.00 12.05 H new ATOM 0 HA THR A 13 25.926 -7.788 -12.943 1.00 2.23 H new ATOM 0 HB THR A 13 25.199 -10.446 -14.234 1.00 32.41 H new ATOM 0 HG1 THR A 13 27.163 -10.074 -15.457 1.00 1.11 H new ATOM 0 HG21 THR A 13 25.144 -9.128 -16.318 1.00 61.31 H new ATOM 0 HG22 THR A 13 23.961 -8.530 -15.130 1.00 61.31 H new ATOM 0 HG23 THR A 13 25.486 -7.650 -15.388 1.00 61.31 H new ATOM 201 N MET A 14 23.559 -9.850 -11.953 1.00 54.40 N ATOM 202 CA MET A 14 22.159 -9.931 -11.551 1.00 60.34 C ATOM 203 C MET A 14 21.876 -9.004 -10.374 1.00 4.22 C ATOM 204 O MET A 14 20.936 -8.210 -10.409 1.00 30.12 O ATOM 205 CB MET A 14 21.796 -11.371 -11.181 1.00 12.54 C ATOM 206 CG MET A 14 20.343 -11.721 -11.457 1.00 13.15 C ATOM 207 SD MET A 14 20.027 -12.050 -13.201 1.00 14.20 S ATOM 208 CE MET A 14 19.186 -10.543 -13.683 1.00 32.53 C ATOM 0 H MET A 14 24.103 -10.691 -11.760 1.00 54.40 H new ATOM 0 HA MET A 14 21.546 -9.614 -12.394 1.00 60.34 H new ATOM 0 HB2 MET A 14 22.438 -12.053 -11.738 1.00 12.54 H new ATOM 0 HB3 MET A 14 22.005 -11.529 -10.123 1.00 12.54 H new ATOM 0 HG2 MET A 14 20.067 -12.597 -10.870 1.00 13.15 H new ATOM 0 HG3 MET A 14 19.706 -10.901 -11.125 1.00 13.15 H new ATOM 0 HE1 MET A 14 19.254 -10.418 -14.764 1.00 32.53 H new ATOM 0 HE2 MET A 14 18.138 -10.602 -13.390 1.00 32.53 H new ATOM 0 HE3 MET A 14 19.654 -9.691 -13.189 1.00 32.53 H new ATOM 218 N ARG A 15 22.696 -9.110 -9.333 1.00 13.22 N ATOM 219 CA ARG A 15 22.532 -8.281 -8.144 1.00 61.43 C ATOM 220 C ARG A 15 22.583 -6.799 -8.504 1.00 30.34 C ATOM 221 O ARG A 15 21.865 -5.985 -7.924 1.00 60.00 O ATOM 222 CB ARG A 15 23.618 -8.606 -7.117 1.00 43.31 C ATOM 223 CG ARG A 15 23.301 -9.819 -6.258 1.00 44.10 C ATOM 224 CD ARG A 15 24.069 -9.788 -4.946 1.00 11.04 C ATOM 225 NE ARG A 15 25.451 -10.231 -5.109 1.00 50.32 N ATOM 226 CZ ARG A 15 26.213 -10.646 -4.104 1.00 64.40 C ATOM 227 NH1 ARG A 15 25.730 -10.676 -2.870 1.00 23.43 N ATOM 228 NH2 ARG A 15 27.462 -11.034 -4.333 1.00 12.33 N ATOM 0 H ARG A 15 23.480 -9.761 -9.289 1.00 13.22 H new ATOM 0 HA ARG A 15 21.556 -8.498 -7.711 1.00 61.43 H new ATOM 0 HB2 ARG A 15 24.560 -8.777 -7.639 1.00 43.31 H new ATOM 0 HB3 ARG A 15 23.764 -7.741 -6.470 1.00 43.31 H new ATOM 0 HG2 ARG A 15 22.231 -9.852 -6.054 1.00 44.10 H new ATOM 0 HG3 ARG A 15 23.549 -10.729 -6.805 1.00 44.10 H new ATOM 0 HD2 ARG A 15 24.058 -8.775 -4.544 1.00 11.04 H new ATOM 0 HD3 ARG A 15 23.568 -10.425 -4.218 1.00 11.04 H new ATOM 0 HE ARG A 15 25.853 -10.221 -6.046 1.00 50.32 H new ATOM 0 HH11 ARG A 15 24.771 -10.380 -2.691 1.00 23.43 H new ATOM 0 HH12 ARG A 15 26.318 -10.995 -2.100 1.00 23.43 H new ATOM 0 HH21 ARG A 15 27.837 -11.013 -5.281 1.00 12.33 H new ATOM 0 HH22 ARG A 15 28.047 -11.353 -3.560 1.00 12.33 H new ATOM 242 N ALA A 16 23.437 -6.457 -9.463 1.00 31.22 N ATOM 243 CA ALA A 16 23.580 -5.074 -9.900 1.00 64.21 C ATOM 244 C ALA A 16 22.430 -4.665 -10.813 1.00 53.11 C ATOM 245 O ALA A 16 21.860 -3.583 -10.664 1.00 34.22 O ATOM 246 CB ALA A 16 24.913 -4.880 -10.608 1.00 61.22 C ATOM 0 H ALA A 16 24.040 -7.119 -9.952 1.00 31.22 H new ATOM 0 HA ALA A 16 23.553 -4.435 -9.017 1.00 64.21 H new ATOM 0 HB1 ALA A 16 25.007 -3.843 -10.929 1.00 61.22 H new ATOM 0 HB2 ALA A 16 25.727 -5.123 -9.925 1.00 61.22 H new ATOM 0 HB3 ALA A 16 24.962 -5.535 -11.478 1.00 61.22 H new ATOM 252 N LEU A 17 22.093 -5.535 -11.759 1.00 10.21 N ATOM 253 CA LEU A 17 21.010 -5.263 -12.698 1.00 33.45 C ATOM 254 C LEU A 17 19.680 -5.115 -11.966 1.00 14.22 C ATOM 255 O LEU A 17 19.049 -4.058 -12.011 1.00 12.35 O ATOM 256 CB LEU A 17 20.913 -6.385 -13.733 1.00 35.21 C ATOM 257 CG LEU A 17 19.700 -6.337 -14.663 1.00 42.45 C ATOM 258 CD1 LEU A 17 19.873 -5.245 -15.708 1.00 73.34 C ATOM 259 CD2 LEU A 17 19.486 -7.687 -15.331 1.00 35.33 C ATOM 0 H LEU A 17 22.554 -6.435 -11.896 1.00 10.21 H new ATOM 0 HA LEU A 17 21.230 -4.325 -13.207 1.00 33.45 H new ATOM 0 HB2 LEU A 17 21.815 -6.367 -14.344 1.00 35.21 H new ATOM 0 HB3 LEU A 17 20.904 -7.339 -13.206 1.00 35.21 H new ATOM 0 HG LEU A 17 18.817 -6.106 -14.067 1.00 42.45 H new ATOM 0 HD11 LEU A 17 19.001 -5.225 -16.361 1.00 73.34 H new ATOM 0 HD12 LEU A 17 19.977 -4.280 -15.212 1.00 73.34 H new ATOM 0 HD13 LEU A 17 20.765 -5.447 -16.301 1.00 73.34 H new ATOM 0 HD21 LEU A 17 18.619 -7.634 -15.989 1.00 35.33 H new ATOM 0 HD22 LEU A 17 20.369 -7.948 -15.915 1.00 35.33 H new ATOM 0 HD23 LEU A 17 19.317 -8.447 -14.569 1.00 35.33 H new ATOM 271 N LEU A 18 19.260 -6.179 -11.291 1.00 34.02 N ATOM 272 CA LEU A 18 18.005 -6.167 -10.547 1.00 10.15 C ATOM 273 C LEU A 18 17.936 -4.961 -9.615 1.00 50.23 C ATOM 274 O LEU A 18 16.870 -4.377 -9.416 1.00 30.44 O ATOM 275 CB LEU A 18 17.855 -7.458 -9.740 1.00 3.23 C ATOM 276 CG LEU A 18 17.713 -8.745 -10.553 1.00 11.12 C ATOM 277 CD1 LEU A 18 17.790 -9.962 -9.644 1.00 15.31 C ATOM 278 CD2 LEU A 18 16.406 -8.741 -11.333 1.00 23.00 C ATOM 0 H LEU A 18 19.770 -7.061 -11.243 1.00 34.02 H new ATOM 0 HA LEU A 18 17.187 -6.097 -11.264 1.00 10.15 H new ATOM 0 HB2 LEU A 18 18.723 -7.558 -9.088 1.00 3.23 H new ATOM 0 HB3 LEU A 18 16.981 -7.361 -9.096 1.00 3.23 H new ATOM 0 HG LEU A 18 18.537 -8.796 -11.264 1.00 11.12 H new ATOM 0 HD11 LEU A 18 17.687 -10.869 -10.240 1.00 15.31 H new ATOM 0 HD12 LEU A 18 18.752 -9.973 -9.131 1.00 15.31 H new ATOM 0 HD13 LEU A 18 16.987 -9.918 -8.909 1.00 15.31 H new ATOM 0 HD21 LEU A 18 16.321 -9.664 -11.906 1.00 23.00 H new ATOM 0 HD22 LEU A 18 15.569 -8.666 -10.639 1.00 23.00 H new ATOM 0 HD23 LEU A 18 16.391 -7.889 -12.013 1.00 23.00 H new ATOM 290 N HIS A 19 19.080 -4.590 -9.049 1.00 62.51 N ATOM 291 CA HIS A 19 19.150 -3.451 -8.141 1.00 23.42 C ATOM 292 C HIS A 19 18.787 -2.157 -8.863 1.00 62.41 C ATOM 293 O HIS A 19 18.080 -1.310 -8.320 1.00 13.31 O ATOM 294 CB HIS A 19 20.551 -3.337 -7.539 1.00 63.41 C ATOM 295 CG HIS A 19 20.726 -2.144 -6.651 1.00 65.01 C ATOM 296 ND1 HIS A 19 19.982 -1.696 -5.614 1.00 33.54 N flip ATOM 297 CD2 HIS A 19 21.771 -1.253 -6.785 1.00 13.53 C flip ATOM 298 CE1 HIS A 19 20.584 -0.555 -5.143 1.00 13.24 C flip ATOM 299 NE2 HIS A 19 21.662 -0.310 -5.867 1.00 50.43 N flip ATOM 0 H HIS A 19 19.971 -5.062 -9.203 1.00 62.51 H new ATOM 0 HA HIS A 19 18.430 -3.613 -7.339 1.00 23.42 H new ATOM 0 HB2 HIS A 19 20.766 -4.240 -6.967 1.00 63.41 H new ATOM 0 HB3 HIS A 19 21.282 -3.289 -8.346 1.00 63.41 H new ATOM 0 HD2 HIS A 19 22.555 -1.317 -7.525 1.00 13.53 H new ATOM 0 HE1 HIS A 19 20.234 0.044 -4.316 1.00 13.24 H new ATOM 0 HE2 HIS A 19 22.301 0.474 -5.739 1.00 50.43 H new ATOM 307 N ALA A 20 19.277 -2.013 -10.090 1.00 41.20 N ATOM 308 CA ALA A 20 19.003 -0.823 -10.887 1.00 21.34 C ATOM 309 C ALA A 20 17.590 -0.859 -11.458 1.00 71.05 C ATOM 310 O ALA A 20 16.890 0.154 -11.476 1.00 72.04 O ATOM 311 CB ALA A 20 20.025 -0.691 -12.007 1.00 35.34 C ATOM 0 H ALA A 20 19.865 -2.705 -10.554 1.00 41.20 H new ATOM 0 HA ALA A 20 19.081 0.047 -10.235 1.00 21.34 H new ATOM 0 HB1 ALA A 20 19.808 0.202 -12.594 1.00 35.34 H new ATOM 0 HB2 ALA A 20 21.025 -0.611 -11.580 1.00 35.34 H new ATOM 0 HB3 ALA A 20 19.975 -1.569 -12.651 1.00 35.34 H new ATOM 317 N THR A 21 17.175 -2.032 -11.926 1.00 62.35 N ATOM 318 CA THR A 21 15.846 -2.200 -12.501 1.00 3.42 C ATOM 319 C THR A 21 14.770 -1.665 -11.562 1.00 64.52 C ATOM 320 O THR A 21 13.842 -0.980 -11.992 1.00 12.41 O ATOM 321 CB THR A 21 15.551 -3.679 -12.813 1.00 1.13 C ATOM 322 OG1 THR A 21 16.744 -4.333 -13.259 1.00 23.03 O ATOM 323 CG2 THR A 21 14.471 -3.803 -13.877 1.00 10.53 C ATOM 0 H THR A 21 17.741 -2.881 -11.918 1.00 62.35 H new ATOM 0 HA THR A 21 15.829 -1.631 -13.431 1.00 3.42 H new ATOM 0 HB THR A 21 15.195 -4.156 -11.900 1.00 1.13 H new ATOM 0 HG1 THR A 21 17.377 -4.401 -12.514 1.00 23.03 H new ATOM 0 HG21 THR A 21 14.280 -4.857 -14.080 1.00 10.53 H new ATOM 0 HG22 THR A 21 13.555 -3.330 -13.523 1.00 10.53 H new ATOM 0 HG23 THR A 21 14.803 -3.311 -14.791 1.00 10.53 H new ATOM 331 N LEU A 22 14.901 -1.983 -10.279 1.00 11.21 N ATOM 332 CA LEU A 22 13.939 -1.534 -9.278 1.00 43.30 C ATOM 333 C LEU A 22 14.271 -0.125 -8.798 1.00 3.52 C ATOM 334 O LEU A 22 13.377 0.678 -8.532 1.00 21.02 O ATOM 335 CB LEU A 22 13.921 -2.498 -8.091 1.00 31.21 C ATOM 336 CG LEU A 22 12.898 -3.633 -8.164 1.00 4.22 C ATOM 337 CD1 LEU A 22 13.252 -4.734 -7.176 1.00 72.14 C ATOM 338 CD2 LEU A 22 11.496 -3.105 -7.897 1.00 42.04 C ATOM 0 H LEU A 22 15.663 -2.550 -9.907 1.00 11.21 H new ATOM 0 HA LEU A 22 12.952 -1.518 -9.740 1.00 43.30 H new ATOM 0 HB2 LEU A 22 14.914 -2.936 -7.989 1.00 31.21 H new ATOM 0 HB3 LEU A 22 13.732 -1.923 -7.184 1.00 31.21 H new ATOM 0 HG LEU A 22 12.921 -4.054 -9.169 1.00 4.22 H new ATOM 0 HD11 LEU A 22 12.514 -5.533 -7.242 1.00 72.14 H new ATOM 0 HD12 LEU A 22 14.239 -5.132 -7.413 1.00 72.14 H new ATOM 0 HD13 LEU A 22 13.258 -4.327 -6.165 1.00 72.14 H new ATOM 0 HD21 LEU A 22 10.781 -3.926 -7.953 1.00 42.04 H new ATOM 0 HD22 LEU A 22 11.459 -2.658 -6.903 1.00 42.04 H new ATOM 0 HD23 LEU A 22 11.243 -2.352 -8.643 1.00 42.04 H new ATOM 350 N ALA A 23 15.563 0.170 -8.691 1.00 71.23 N ATOM 351 CA ALA A 23 16.013 1.483 -8.248 1.00 0.35 C ATOM 352 C ALA A 23 15.471 2.584 -9.153 1.00 45.12 C ATOM 353 O ALA A 23 14.863 3.544 -8.682 1.00 4.44 O ATOM 354 CB ALA A 23 17.533 1.533 -8.204 1.00 1.32 C ATOM 0 H ALA A 23 16.316 -0.484 -8.905 1.00 71.23 H new ATOM 0 HA ALA A 23 15.626 1.652 -7.243 1.00 0.35 H new ATOM 0 HB1 ALA A 23 17.855 2.520 -7.871 1.00 1.32 H new ATOM 0 HB2 ALA A 23 17.902 0.778 -7.510 1.00 1.32 H new ATOM 0 HB3 ALA A 23 17.932 1.337 -9.199 1.00 1.32 H new ATOM 360 N GLN A 24 15.697 2.438 -10.455 1.00 22.42 N ATOM 361 CA GLN A 24 15.232 3.421 -11.426 1.00 5.34 C ATOM 362 C GLN A 24 13.727 3.634 -11.307 1.00 71.11 C ATOM 363 O GLN A 24 13.227 4.737 -11.524 1.00 2.43 O ATOM 364 CB GLN A 24 15.586 2.975 -12.845 1.00 62.52 C ATOM 365 CG GLN A 24 17.073 3.046 -13.153 1.00 3.13 C ATOM 366 CD GLN A 24 17.605 4.466 -13.135 1.00 62.44 C ATOM 367 OE1 GLN A 24 18.310 4.865 -12.208 1.00 50.42 O ATOM 368 NE2 GLN A 24 17.270 5.236 -14.163 1.00 51.25 N ATOM 0 H GLN A 24 16.199 1.649 -10.861 1.00 22.42 H new ATOM 0 HA GLN A 24 15.732 4.367 -11.215 1.00 5.34 H new ATOM 0 HB2 GLN A 24 15.242 1.951 -12.991 1.00 62.52 H new ATOM 0 HB3 GLN A 24 15.046 3.598 -13.558 1.00 62.52 H new ATOM 0 HG2 GLN A 24 17.620 2.448 -12.424 1.00 3.13 H new ATOM 0 HG3 GLN A 24 17.259 2.605 -14.132 1.00 3.13 H new ATOM 0 HE21 GLN A 24 16.683 4.863 -14.910 1.00 51.25 H new ATOM 0 HE22 GLN A 24 17.599 6.200 -14.206 1.00 51.25 H new ATOM 377 N ALA A 25 13.009 2.570 -10.962 1.00 64.33 N ATOM 378 CA ALA A 25 11.561 2.640 -10.813 1.00 41.44 C ATOM 379 C ALA A 25 11.174 3.505 -9.619 1.00 14.42 C ATOM 380 O ALA A 25 10.049 3.998 -9.535 1.00 63.32 O ATOM 381 CB ALA A 25 10.977 1.243 -10.667 1.00 53.25 C ATOM 0 H ALA A 25 13.407 1.649 -10.780 1.00 64.33 H new ATOM 0 HA ALA A 25 11.150 3.101 -11.711 1.00 41.44 H new ATOM 0 HB1 ALA A 25 9.895 1.311 -10.557 1.00 53.25 H new ATOM 0 HB2 ALA A 25 11.215 0.655 -11.553 1.00 53.25 H new ATOM 0 HB3 ALA A 25 11.402 0.761 -9.787 1.00 53.25 H new ATOM 387 N GLY A 26 12.113 3.686 -8.695 1.00 72.00 N ATOM 388 CA GLY A 26 11.849 4.491 -7.517 1.00 4.22 C ATOM 389 C GLY A 26 11.916 3.684 -6.236 1.00 20.52 C ATOM 390 O GLY A 26 12.319 4.196 -5.191 1.00 61.42 O ATOM 0 H GLY A 26 13.052 3.289 -8.741 1.00 72.00 H new ATOM 0 HA2 GLY A 26 12.572 5.305 -7.468 1.00 4.22 H new ATOM 0 HA3 GLY A 26 10.862 4.946 -7.605 1.00 4.22 H new ATOM 394 N TYR A 27 11.519 2.419 -6.315 1.00 35.43 N ATOM 395 CA TYR A 27 11.531 1.540 -5.151 1.00 70.45 C ATOM 396 C TYR A 27 12.916 1.501 -4.513 1.00 31.32 C ATOM 397 O TYR A 27 13.924 1.734 -5.178 1.00 43.41 O ATOM 398 CB TYR A 27 11.101 0.127 -5.549 1.00 74.41 C ATOM 399 CG TYR A 27 9.827 0.088 -6.362 1.00 54.04 C ATOM 400 CD1 TYR A 27 9.839 -0.319 -7.691 1.00 10.51 C ATOM 401 CD2 TYR A 27 8.610 0.457 -5.802 1.00 0.33 C ATOM 402 CE1 TYR A 27 8.677 -0.354 -8.438 1.00 25.53 C ATOM 403 CE2 TYR A 27 7.443 0.423 -6.541 1.00 2.04 C ATOM 404 CZ TYR A 27 7.482 0.017 -7.858 1.00 62.02 C ATOM 405 OH TYR A 27 6.323 -0.019 -8.598 1.00 53.15 O ATOM 0 H TYR A 27 11.185 1.979 -7.172 1.00 35.43 H new ATOM 0 HA TYR A 27 10.825 1.936 -4.421 1.00 70.45 H new ATOM 0 HB2 TYR A 27 11.902 -0.340 -6.122 1.00 74.41 H new ATOM 0 HB3 TYR A 27 10.965 -0.470 -4.647 1.00 74.41 H new ATOM 0 HD1 TYR A 27 10.773 -0.613 -8.148 1.00 10.51 H new ATOM 0 HD2 TYR A 27 8.576 0.776 -4.771 1.00 0.33 H new ATOM 0 HE1 TYR A 27 8.704 -0.670 -9.470 1.00 25.53 H new ATOM 0 HE2 TYR A 27 6.506 0.713 -6.090 1.00 2.04 H new ATOM 0 HH TYR A 27 5.570 0.271 -8.042 1.00 53.15 H new ATOM 415 N GLU A 28 12.955 1.203 -3.218 1.00 21.12 N ATOM 416 CA GLU A 28 14.216 1.133 -2.488 1.00 51.35 C ATOM 417 C GLU A 28 14.684 -0.312 -2.348 1.00 31.35 C ATOM 418 O GLU A 28 14.493 -0.940 -1.306 1.00 2.34 O ATOM 419 CB GLU A 28 14.066 1.770 -1.105 1.00 22.40 C ATOM 420 CG GLU A 28 15.388 2.178 -0.477 1.00 30.35 C ATOM 421 CD GLU A 28 15.210 3.126 0.693 1.00 14.30 C ATOM 422 OE1 GLU A 28 14.497 2.761 1.651 1.00 72.32 O ATOM 423 OE2 GLU A 28 15.784 4.235 0.650 1.00 33.40 O ATOM 0 H GLU A 28 12.129 1.006 -2.653 1.00 21.12 H new ATOM 0 HA GLU A 28 14.966 1.685 -3.054 1.00 51.35 H new ATOM 0 HB2 GLU A 28 13.425 2.648 -1.186 1.00 22.40 H new ATOM 0 HB3 GLU A 28 13.560 1.067 -0.443 1.00 22.40 H new ATOM 0 HG2 GLU A 28 15.916 1.286 -0.140 1.00 30.35 H new ATOM 0 HG3 GLU A 28 16.014 2.653 -1.233 1.00 30.35 H new ATOM 430 N VAL A 29 15.297 -0.835 -3.405 1.00 22.34 N ATOM 431 CA VAL A 29 15.793 -2.206 -3.400 1.00 22.42 C ATOM 432 C VAL A 29 17.227 -2.270 -2.886 1.00 22.20 C ATOM 433 O VAL A 29 18.034 -1.377 -3.149 1.00 34.32 O ATOM 434 CB VAL A 29 15.736 -2.829 -4.807 1.00 53.14 C ATOM 435 CG1 VAL A 29 16.471 -1.952 -5.810 1.00 31.23 C ATOM 436 CG2 VAL A 29 16.315 -4.236 -4.791 1.00 51.55 C ATOM 0 H VAL A 29 15.462 -0.330 -4.276 1.00 22.34 H new ATOM 0 HA VAL A 29 15.145 -2.774 -2.733 1.00 22.42 H new ATOM 0 HB VAL A 29 14.692 -2.894 -5.114 1.00 53.14 H new ATOM 0 HG11 VAL A 29 16.420 -2.408 -6.799 1.00 31.23 H new ATOM 0 HG12 VAL A 29 16.006 -0.967 -5.841 1.00 31.23 H new ATOM 0 HG13 VAL A 29 17.514 -1.852 -5.510 1.00 31.23 H new ATOM 0 HG21 VAL A 29 16.267 -4.661 -5.794 1.00 51.55 H new ATOM 0 HG22 VAL A 29 17.354 -4.198 -4.463 1.00 51.55 H new ATOM 0 HG23 VAL A 29 15.740 -4.858 -4.105 1.00 51.55 H new ATOM 446 N THR A 30 17.540 -3.333 -2.151 1.00 60.12 N ATOM 447 CA THR A 30 18.877 -3.514 -1.599 1.00 73.13 C ATOM 448 C THR A 30 19.324 -4.967 -1.708 1.00 21.33 C ATOM 449 O THR A 30 18.547 -5.887 -1.453 1.00 72.43 O ATOM 450 CB THR A 30 18.939 -3.079 -0.123 1.00 53.51 C ATOM 451 OG1 THR A 30 18.580 -1.697 -0.004 1.00 61.34 O ATOM 452 CG2 THR A 30 20.332 -3.297 0.447 1.00 11.24 C ATOM 0 H THR A 30 16.885 -4.082 -1.924 1.00 60.12 H new ATOM 0 HA THR A 30 19.548 -2.885 -2.184 1.00 73.13 H new ATOM 0 HB THR A 30 18.233 -3.687 0.442 1.00 53.51 H new ATOM 0 HG1 THR A 30 18.620 -1.428 0.938 1.00 61.34 H new ATOM 0 HG21 THR A 30 20.351 -2.983 1.490 1.00 11.24 H new ATOM 0 HG22 THR A 30 20.591 -4.354 0.382 1.00 11.24 H new ATOM 0 HG23 THR A 30 21.054 -2.711 -0.122 1.00 11.24 H new ATOM 460 N VAL A 31 20.583 -5.168 -2.086 1.00 55.44 N ATOM 461 CA VAL A 31 21.134 -6.510 -2.227 1.00 3.14 C ATOM 462 C VAL A 31 21.903 -6.921 -0.976 1.00 64.33 C ATOM 463 O VAL A 31 22.636 -6.122 -0.395 1.00 4.20 O ATOM 464 CB VAL A 31 22.069 -6.608 -3.447 1.00 4.34 C ATOM 465 CG1 VAL A 31 21.313 -6.286 -4.727 1.00 31.44 C ATOM 466 CG2 VAL A 31 23.264 -5.682 -3.277 1.00 43.31 C ATOM 0 H VAL A 31 21.240 -4.418 -2.300 1.00 55.44 H new ATOM 0 HA VAL A 31 20.291 -7.186 -2.371 1.00 3.14 H new ATOM 0 HB VAL A 31 22.438 -7.631 -3.519 1.00 4.34 H new ATOM 0 HG11 VAL A 31 21.990 -6.360 -5.578 1.00 31.44 H new ATOM 0 HG12 VAL A 31 20.493 -6.993 -4.853 1.00 31.44 H new ATOM 0 HG13 VAL A 31 20.913 -5.274 -4.669 1.00 31.44 H new ATOM 0 HG21 VAL A 31 23.914 -5.764 -4.148 1.00 43.31 H new ATOM 0 HG22 VAL A 31 22.916 -4.654 -3.179 1.00 43.31 H new ATOM 0 HG23 VAL A 31 23.819 -5.964 -2.382 1.00 43.31 H new ATOM 476 N ALA A 32 21.731 -8.174 -0.568 1.00 23.30 N ATOM 477 CA ALA A 32 22.411 -8.693 0.612 1.00 23.32 C ATOM 478 C ALA A 32 23.644 -9.502 0.224 1.00 23.31 C ATOM 479 O ALA A 32 23.948 -9.660 -0.958 1.00 33.31 O ATOM 480 CB ALA A 32 21.458 -9.544 1.439 1.00 4.21 C ATOM 0 H ALA A 32 21.127 -8.848 -1.037 1.00 23.30 H new ATOM 0 HA ALA A 32 22.739 -7.845 1.214 1.00 23.32 H new ATOM 0 HB1 ALA A 32 21.979 -9.925 2.317 1.00 4.21 H new ATOM 0 HB2 ALA A 32 20.610 -8.937 1.755 1.00 4.21 H new ATOM 0 HB3 ALA A 32 21.102 -10.380 0.837 1.00 4.21 H new ATOM 486 N ALA A 33 24.352 -10.012 1.227 1.00 13.01 N ATOM 487 CA ALA A 33 25.551 -10.806 0.990 1.00 0.31 C ATOM 488 C ALA A 33 25.202 -12.273 0.762 1.00 3.35 C ATOM 489 O ALA A 33 25.847 -12.958 -0.032 1.00 53.30 O ATOM 490 CB ALA A 33 26.516 -10.666 2.158 1.00 0.41 C ATOM 0 H ALA A 33 24.115 -9.889 2.212 1.00 13.01 H new ATOM 0 HA ALA A 33 26.033 -10.430 0.088 1.00 0.31 H new ATOM 0 HB1 ALA A 33 27.407 -11.264 1.968 1.00 0.41 H new ATOM 0 HB2 ALA A 33 26.799 -9.620 2.273 1.00 0.41 H new ATOM 0 HB3 ALA A 33 26.034 -11.014 3.072 1.00 0.41 H new ATOM 496 N ASP A 34 24.180 -12.749 1.465 1.00 41.33 N ATOM 497 CA ASP A 34 23.746 -14.135 1.339 1.00 74.12 C ATOM 498 C ASP A 34 22.290 -14.289 1.767 1.00 33.23 C ATOM 499 O ASP A 34 21.736 -13.423 2.443 1.00 73.02 O ATOM 500 CB ASP A 34 24.637 -15.050 2.180 1.00 43.21 C ATOM 501 CG ASP A 34 25.942 -15.385 1.485 1.00 44.31 C ATOM 502 OD1 ASP A 34 26.962 -14.730 1.788 1.00 13.42 O ATOM 503 OD2 ASP A 34 25.945 -16.302 0.638 1.00 33.43 O ATOM 0 H ASP A 34 23.637 -12.195 2.128 1.00 41.33 H new ATOM 0 HA ASP A 34 23.831 -14.422 0.291 1.00 74.12 H new ATOM 0 HB2 ASP A 34 24.850 -14.568 3.134 1.00 43.21 H new ATOM 0 HB3 ASP A 34 24.100 -15.972 2.402 1.00 43.21 H new ATOM 508 N GLY A 35 21.675 -15.399 1.368 1.00 13.34 N ATOM 509 CA GLY A 35 20.288 -15.645 1.719 1.00 24.53 C ATOM 510 C GLY A 35 20.034 -15.508 3.207 1.00 15.51 C ATOM 511 O GLY A 35 18.948 -15.102 3.622 1.00 45.31 O ATOM 0 H GLY A 35 22.112 -16.131 0.809 1.00 13.34 H new ATOM 0 HA2 GLY A 35 19.650 -14.946 1.179 1.00 24.53 H new ATOM 0 HA3 GLY A 35 20.007 -16.647 1.396 1.00 24.53 H new ATOM 515 N GLU A 36 21.036 -15.848 4.012 1.00 54.22 N ATOM 516 CA GLU A 36 20.913 -15.762 5.462 1.00 14.32 C ATOM 517 C GLU A 36 20.909 -14.307 5.923 1.00 52.24 C ATOM 518 O GLU A 36 20.033 -13.886 6.678 1.00 50.04 O ATOM 519 CB GLU A 36 22.057 -16.519 6.139 1.00 33.31 C ATOM 520 CG GLU A 36 22.137 -16.288 7.639 1.00 73.03 C ATOM 521 CD GLU A 36 20.906 -16.785 8.372 1.00 22.42 C ATOM 522 OE1 GLU A 36 19.889 -16.061 8.383 1.00 41.45 O ATOM 523 OE2 GLU A 36 20.960 -17.898 8.936 1.00 61.33 O ATOM 0 H GLU A 36 21.941 -16.185 3.684 1.00 54.22 H new ATOM 0 HA GLU A 36 19.965 -16.218 5.748 1.00 14.32 H new ATOM 0 HB2 GLU A 36 21.937 -17.586 5.950 1.00 33.31 H new ATOM 0 HB3 GLU A 36 23.000 -16.218 5.683 1.00 33.31 H new ATOM 0 HG2 GLU A 36 23.019 -16.792 8.034 1.00 73.03 H new ATOM 0 HG3 GLU A 36 22.265 -15.223 7.833 1.00 73.03 H new ATOM 530 N ALA A 37 21.895 -13.544 5.462 1.00 21.22 N ATOM 531 CA ALA A 37 22.005 -12.137 5.825 1.00 43.32 C ATOM 532 C ALA A 37 20.781 -11.353 5.364 1.00 70.44 C ATOM 533 O ALA A 37 20.345 -10.416 6.030 1.00 53.32 O ATOM 534 CB ALA A 37 23.272 -11.537 5.233 1.00 50.24 C ATOM 0 H ALA A 37 22.629 -13.877 4.837 1.00 21.22 H new ATOM 0 HA ALA A 37 22.058 -12.071 6.912 1.00 43.32 H new ATOM 0 HB1 ALA A 37 23.341 -10.486 5.512 1.00 50.24 H new ATOM 0 HB2 ALA A 37 24.141 -12.072 5.616 1.00 50.24 H new ATOM 0 HB3 ALA A 37 23.242 -11.623 4.147 1.00 50.24 H new ATOM 540 N GLY A 38 20.231 -11.744 4.218 1.00 72.40 N ATOM 541 CA GLY A 38 19.062 -11.067 3.687 1.00 22.21 C ATOM 542 C GLY A 38 17.802 -11.391 4.464 1.00 75.22 C ATOM 543 O GLY A 38 17.081 -10.491 4.896 1.00 63.00 O ATOM 0 H GLY A 38 20.574 -12.517 3.648 1.00 72.40 H new ATOM 0 HA2 GLY A 38 19.230 -9.990 3.706 1.00 22.21 H new ATOM 0 HA3 GLY A 38 18.925 -11.350 2.643 1.00 22.21 H new ATOM 547 N PHE A 39 17.532 -12.680 4.641 1.00 64.53 N ATOM 548 CA PHE A 39 16.348 -13.121 5.368 1.00 21.44 C ATOM 549 C PHE A 39 16.424 -12.704 6.834 1.00 33.02 C ATOM 550 O PHE A 39 15.465 -12.164 7.387 1.00 22.53 O ATOM 551 CB PHE A 39 16.197 -14.641 5.266 1.00 12.51 C ATOM 552 CG PHE A 39 15.255 -15.077 4.181 1.00 62.55 C ATOM 553 CD1 PHE A 39 13.919 -14.712 4.216 1.00 62.24 C ATOM 554 CD2 PHE A 39 15.706 -15.854 3.125 1.00 2.13 C ATOM 555 CE1 PHE A 39 13.050 -15.112 3.218 1.00 61.30 C ATOM 556 CE2 PHE A 39 14.842 -16.257 2.125 1.00 50.43 C ATOM 557 CZ PHE A 39 13.512 -15.886 2.172 1.00 61.43 C ATOM 0 H PHE A 39 18.118 -13.438 4.291 1.00 64.53 H new ATOM 0 HA PHE A 39 15.477 -12.645 4.917 1.00 21.44 H new ATOM 0 HB2 PHE A 39 17.176 -15.084 5.086 1.00 12.51 H new ATOM 0 HB3 PHE A 39 15.843 -15.028 6.221 1.00 12.51 H new ATOM 0 HD1 PHE A 39 13.552 -14.108 5.033 1.00 62.24 H new ATOM 0 HD2 PHE A 39 16.745 -16.148 3.084 1.00 2.13 H new ATOM 0 HE1 PHE A 39 12.011 -14.819 3.256 1.00 61.30 H new ATOM 0 HE2 PHE A 39 15.206 -16.861 1.307 1.00 50.43 H new ATOM 0 HZ PHE A 39 12.835 -16.201 1.392 1.00 61.43 H new ATOM 567 N ASP A 40 17.569 -12.958 7.457 1.00 61.30 N ATOM 568 CA ASP A 40 17.771 -12.609 8.858 1.00 24.23 C ATOM 569 C ASP A 40 17.417 -11.147 9.111 1.00 41.03 C ATOM 570 O ASP A 40 16.885 -10.799 10.166 1.00 61.12 O ATOM 571 CB ASP A 40 19.221 -12.874 9.268 1.00 41.42 C ATOM 572 CG ASP A 40 19.486 -12.523 10.719 1.00 42.54 C ATOM 573 OD1 ASP A 40 18.961 -13.228 11.606 1.00 41.13 O ATOM 574 OD2 ASP A 40 20.219 -11.543 10.967 1.00 4.11 O ATOM 0 H ASP A 40 18.372 -13.405 7.014 1.00 61.30 H new ATOM 0 HA ASP A 40 17.111 -13.233 9.461 1.00 24.23 H new ATOM 0 HB2 ASP A 40 19.456 -13.926 9.103 1.00 41.42 H new ATOM 0 HB3 ASP A 40 19.888 -12.295 8.629 1.00 41.42 H new ATOM 579 N LEU A 41 17.716 -10.295 8.137 1.00 42.34 N ATOM 580 CA LEU A 41 17.430 -8.869 8.253 1.00 4.10 C ATOM 581 C LEU A 41 16.002 -8.562 7.814 1.00 62.20 C ATOM 582 O LEU A 41 15.357 -7.663 8.351 1.00 13.33 O ATOM 583 CB LEU A 41 18.419 -8.060 7.412 1.00 64.01 C ATOM 584 CG LEU A 41 19.869 -8.059 7.897 1.00 25.13 C ATOM 585 CD1 LEU A 41 20.761 -7.315 6.915 1.00 14.31 C ATOM 586 CD2 LEU A 41 19.967 -7.440 9.284 1.00 43.11 C ATOM 0 H LEU A 41 18.156 -10.566 7.258 1.00 42.34 H new ATOM 0 HA LEU A 41 17.537 -8.587 9.300 1.00 4.10 H new ATOM 0 HB2 LEU A 41 18.398 -8.445 6.393 1.00 64.01 H new ATOM 0 HB3 LEU A 41 18.070 -7.028 7.370 1.00 64.01 H new ATOM 0 HG LEU A 41 20.212 -9.092 7.956 1.00 25.13 H new ATOM 0 HD11 LEU A 41 21.789 -7.325 7.277 1.00 14.31 H new ATOM 0 HD12 LEU A 41 20.715 -7.802 5.941 1.00 14.31 H new ATOM 0 HD13 LEU A 41 20.419 -6.284 6.822 1.00 14.31 H new ATOM 0 HD21 LEU A 41 21.006 -7.448 9.613 1.00 43.11 H new ATOM 0 HD22 LEU A 41 19.605 -6.413 9.250 1.00 43.11 H new ATOM 0 HD23 LEU A 41 19.361 -8.016 9.983 1.00 43.11 H new ATOM 598 N ALA A 42 15.514 -9.318 6.835 1.00 3.34 N ATOM 599 CA ALA A 42 14.161 -9.129 6.327 1.00 22.53 C ATOM 600 C ALA A 42 13.138 -9.185 7.457 1.00 41.54 C ATOM 601 O ALA A 42 12.057 -8.605 7.356 1.00 2.13 O ATOM 602 CB ALA A 42 13.843 -10.179 5.272 1.00 11.15 C ATOM 0 H ALA A 42 16.036 -10.066 6.379 1.00 3.34 H new ATOM 0 HA ALA A 42 14.105 -8.141 5.870 1.00 22.53 H new ATOM 0 HB1 ALA A 42 12.830 -10.027 4.901 1.00 11.15 H new ATOM 0 HB2 ALA A 42 14.549 -10.091 4.446 1.00 11.15 H new ATOM 0 HB3 ALA A 42 13.922 -11.173 5.712 1.00 11.15 H new ATOM 608 N ALA A 43 13.486 -9.886 8.531 1.00 42.34 N ATOM 609 CA ALA A 43 12.598 -10.015 9.679 1.00 23.13 C ATOM 610 C ALA A 43 12.750 -8.830 10.627 1.00 40.13 C ATOM 611 O ALA A 43 11.810 -8.460 11.331 1.00 1.12 O ATOM 612 CB ALA A 43 12.872 -11.319 10.414 1.00 64.00 C ATOM 0 H ALA A 43 14.377 -10.373 8.630 1.00 42.34 H new ATOM 0 HA ALA A 43 11.571 -10.025 9.313 1.00 23.13 H new ATOM 0 HB1 ALA A 43 12.202 -11.402 11.269 1.00 64.00 H new ATOM 0 HB2 ALA A 43 12.706 -12.159 9.739 1.00 64.00 H new ATOM 0 HB3 ALA A 43 13.905 -11.331 10.760 1.00 64.00 H new ATOM 618 N THR A 44 13.940 -8.237 10.640 1.00 21.30 N ATOM 619 CA THR A 44 14.215 -7.095 11.502 1.00 24.13 C ATOM 620 C THR A 44 13.780 -5.791 10.843 1.00 23.24 C ATOM 621 O THR A 44 13.446 -4.820 11.524 1.00 63.35 O ATOM 622 CB THR A 44 15.712 -7.005 11.854 1.00 4.21 C ATOM 623 OG1 THR A 44 15.871 -6.605 13.220 1.00 64.21 O ATOM 624 CG2 THR A 44 16.423 -6.014 10.944 1.00 1.05 C ATOM 0 H THR A 44 14.729 -8.529 10.063 1.00 21.30 H new ATOM 0 HA THR A 44 13.642 -7.245 12.417 1.00 24.13 H new ATOM 0 HB THR A 44 16.156 -7.990 11.710 1.00 4.21 H new ATOM 0 HG1 THR A 44 16.825 -6.552 13.436 1.00 64.21 H new ATOM 0 HG21 THR A 44 17.479 -5.967 11.211 1.00 1.05 H new ATOM 0 HG22 THR A 44 16.325 -6.337 9.908 1.00 1.05 H new ATOM 0 HG23 THR A 44 15.975 -5.027 11.060 1.00 1.05 H new ATOM 632 N THR A 45 13.785 -5.775 9.514 1.00 4.40 N ATOM 633 CA THR A 45 13.392 -4.589 8.763 1.00 74.41 C ATOM 634 C THR A 45 11.975 -4.730 8.217 1.00 2.22 C ATOM 635 O THR A 45 11.221 -3.759 8.164 1.00 3.31 O ATOM 636 CB THR A 45 14.356 -4.320 7.593 1.00 41.15 C ATOM 637 OG1 THR A 45 15.584 -3.774 8.086 1.00 44.52 O ATOM 638 CG2 THR A 45 13.735 -3.360 6.589 1.00 12.24 C ATOM 0 H THR A 45 14.057 -6.570 8.935 1.00 4.40 H new ATOM 0 HA THR A 45 13.430 -3.748 9.456 1.00 74.41 H new ATOM 0 HB THR A 45 14.555 -5.267 7.091 1.00 41.15 H new ATOM 0 HG1 THR A 45 16.192 -3.607 7.336 1.00 44.52 H new ATOM 0 HG21 THR A 45 14.435 -3.185 5.772 1.00 12.24 H new ATOM 0 HG22 THR A 45 12.816 -3.792 6.193 1.00 12.24 H new ATOM 0 HG23 THR A 45 13.509 -2.414 7.082 1.00 12.24 H new ATOM 646 N ALA A 46 11.619 -5.945 7.813 1.00 5.11 N ATOM 647 CA ALA A 46 10.292 -6.212 7.274 1.00 71.51 C ATOM 648 C ALA A 46 10.064 -5.451 5.972 1.00 24.43 C ATOM 649 O ALA A 46 9.248 -4.532 5.914 1.00 10.42 O ATOM 650 CB ALA A 46 9.224 -5.847 8.295 1.00 63.33 C ATOM 0 H ALA A 46 12.232 -6.760 7.849 1.00 5.11 H new ATOM 0 HA ALA A 46 10.223 -7.278 7.058 1.00 71.51 H new ATOM 0 HB1 ALA A 46 8.238 -6.052 7.879 1.00 63.33 H new ATOM 0 HB2 ALA A 46 9.367 -6.440 9.199 1.00 63.33 H new ATOM 0 HB3 ALA A 46 9.302 -4.788 8.540 1.00 63.33 H new ATOM 656 N TYR A 47 10.791 -5.840 4.931 1.00 44.14 N ATOM 657 CA TYR A 47 10.671 -5.192 3.630 1.00 12.31 C ATOM 658 C TYR A 47 9.311 -5.481 3.001 1.00 2.22 C ATOM 659 O TYR A 47 8.521 -6.259 3.535 1.00 14.12 O ATOM 660 CB TYR A 47 11.787 -5.662 2.697 1.00 64.52 C ATOM 661 CG TYR A 47 13.170 -5.253 3.152 1.00 50.23 C ATOM 662 CD1 TYR A 47 13.829 -5.954 4.154 1.00 60.31 C ATOM 663 CD2 TYR A 47 13.817 -4.164 2.580 1.00 13.15 C ATOM 664 CE1 TYR A 47 15.092 -5.583 4.573 1.00 31.44 C ATOM 665 CE2 TYR A 47 15.080 -3.787 2.993 1.00 41.24 C ATOM 666 CZ TYR A 47 15.713 -4.499 3.989 1.00 24.44 C ATOM 667 OH TYR A 47 16.971 -4.126 4.404 1.00 44.12 O ATOM 0 H TYR A 47 11.470 -6.601 4.962 1.00 44.14 H new ATOM 0 HA TYR A 47 10.761 -4.116 3.779 1.00 12.31 H new ATOM 0 HB2 TYR A 47 11.747 -6.748 2.615 1.00 64.52 H new ATOM 0 HB3 TYR A 47 11.608 -5.260 1.700 1.00 64.52 H new ATOM 0 HD1 TYR A 47 13.346 -6.804 4.613 1.00 60.31 H new ATOM 0 HD2 TYR A 47 13.324 -3.603 1.800 1.00 13.15 H new ATOM 0 HE1 TYR A 47 15.590 -6.139 5.354 1.00 31.44 H new ATOM 0 HE2 TYR A 47 15.569 -2.939 2.538 1.00 41.24 H new ATOM 0 HH TYR A 47 17.266 -3.345 3.892 1.00 44.12 H new ATOM 677 N ASP A 48 9.047 -4.849 1.863 1.00 1.10 N ATOM 678 CA ASP A 48 7.784 -5.038 1.159 1.00 63.34 C ATOM 679 C ASP A 48 7.861 -6.237 0.218 1.00 43.21 C ATOM 680 O ASP A 48 6.877 -6.951 0.023 1.00 53.22 O ATOM 681 CB ASP A 48 7.421 -3.779 0.371 1.00 42.51 C ATOM 682 CG ASP A 48 6.716 -2.744 1.226 1.00 32.31 C ATOM 683 OD1 ASP A 48 5.468 -2.699 1.193 1.00 5.12 O ATOM 684 OD2 ASP A 48 7.411 -1.980 1.927 1.00 2.35 O ATOM 0 H ASP A 48 9.691 -4.201 1.408 1.00 1.10 H new ATOM 0 HA ASP A 48 7.008 -5.229 1.901 1.00 63.34 H new ATOM 0 HB2 ASP A 48 8.327 -3.343 -0.049 1.00 42.51 H new ATOM 0 HB3 ASP A 48 6.780 -4.051 -0.468 1.00 42.51 H new ATOM 689 N LEU A 49 9.036 -6.451 -0.364 1.00 23.34 N ATOM 690 CA LEU A 49 9.242 -7.563 -1.285 1.00 61.14 C ATOM 691 C LEU A 49 10.620 -8.187 -1.087 1.00 41.44 C ATOM 692 O LEU A 49 11.630 -7.484 -1.038 1.00 13.01 O ATOM 693 CB LEU A 49 9.088 -7.088 -2.731 1.00 53.02 C ATOM 694 CG LEU A 49 8.439 -8.079 -3.698 1.00 32.32 C ATOM 695 CD1 LEU A 49 8.140 -7.408 -5.029 1.00 71.55 C ATOM 696 CD2 LEU A 49 9.335 -9.292 -3.899 1.00 21.51 C ATOM 0 H LEU A 49 9.860 -5.869 -0.214 1.00 23.34 H new ATOM 0 HA LEU A 49 8.487 -8.321 -1.075 1.00 61.14 H new ATOM 0 HB2 LEU A 49 8.497 -6.172 -2.730 1.00 53.02 H new ATOM 0 HB3 LEU A 49 10.075 -6.830 -3.115 1.00 53.02 H new ATOM 0 HG LEU A 49 7.497 -8.416 -3.265 1.00 32.32 H new ATOM 0 HD11 LEU A 49 7.679 -8.129 -5.704 1.00 71.55 H new ATOM 0 HD12 LEU A 49 7.459 -6.572 -4.870 1.00 71.55 H new ATOM 0 HD13 LEU A 49 9.068 -7.042 -5.468 1.00 71.55 H new ATOM 0 HD21 LEU A 49 8.857 -9.987 -4.590 1.00 21.51 H new ATOM 0 HD22 LEU A 49 10.293 -8.973 -4.310 1.00 21.51 H new ATOM 0 HD23 LEU A 49 9.498 -9.787 -2.942 1.00 21.51 H new ATOM 708 N VAL A 50 10.654 -9.511 -0.977 1.00 5.11 N ATOM 709 CA VAL A 50 11.909 -10.230 -0.788 1.00 13.10 C ATOM 710 C VAL A 50 12.245 -11.079 -2.009 1.00 13.02 C ATOM 711 O VAL A 50 11.353 -11.571 -2.701 1.00 34.31 O ATOM 712 CB VAL A 50 11.854 -11.137 0.455 1.00 34.34 C ATOM 713 CG1 VAL A 50 13.221 -11.740 0.738 1.00 4.41 C ATOM 714 CG2 VAL A 50 11.345 -10.360 1.660 1.00 41.31 C ATOM 0 H VAL A 50 9.828 -10.108 -1.015 1.00 5.11 H new ATOM 0 HA VAL A 50 12.686 -9.479 -0.646 1.00 13.10 H new ATOM 0 HB VAL A 50 11.158 -11.952 0.257 1.00 34.34 H new ATOM 0 HG11 VAL A 50 13.162 -12.378 1.620 1.00 4.41 H new ATOM 0 HG12 VAL A 50 13.541 -12.334 -0.118 1.00 4.41 H new ATOM 0 HG13 VAL A 50 13.941 -10.941 0.915 1.00 4.41 H new ATOM 0 HG21 VAL A 50 11.313 -11.017 2.529 1.00 41.31 H new ATOM 0 HG22 VAL A 50 12.013 -9.523 1.862 1.00 41.31 H new ATOM 0 HG23 VAL A 50 10.344 -9.983 1.453 1.00 41.31 H new ATOM 724 N LEU A 51 13.537 -11.247 -2.268 1.00 34.42 N ATOM 725 CA LEU A 51 13.992 -12.038 -3.406 1.00 20.31 C ATOM 726 C LEU A 51 15.142 -12.957 -3.005 1.00 43.55 C ATOM 727 O LEU A 51 16.238 -12.494 -2.684 1.00 35.44 O ATOM 728 CB LEU A 51 14.431 -11.120 -4.547 1.00 43.34 C ATOM 729 CG LEU A 51 13.417 -10.916 -5.673 1.00 14.50 C ATOM 730 CD1 LEU A 51 13.061 -12.246 -6.319 1.00 12.43 C ATOM 731 CD2 LEU A 51 12.167 -10.225 -5.146 1.00 21.22 C ATOM 0 H LEU A 51 14.288 -10.846 -1.706 1.00 34.42 H new ATOM 0 HA LEU A 51 13.160 -12.655 -3.745 1.00 20.31 H new ATOM 0 HB2 LEU A 51 14.679 -10.145 -4.127 1.00 43.34 H new ATOM 0 HB3 LEU A 51 15.347 -11.523 -4.979 1.00 43.34 H new ATOM 0 HG LEU A 51 13.869 -10.277 -6.432 1.00 14.50 H new ATOM 0 HD11 LEU A 51 12.338 -12.081 -7.118 1.00 12.43 H new ATOM 0 HD12 LEU A 51 13.961 -12.702 -6.732 1.00 12.43 H new ATOM 0 HD13 LEU A 51 12.629 -12.910 -5.570 1.00 12.43 H new ATOM 0 HD21 LEU A 51 11.456 -10.088 -5.961 1.00 21.22 H new ATOM 0 HD22 LEU A 51 11.713 -10.838 -4.368 1.00 21.22 H new ATOM 0 HD23 LEU A 51 12.436 -9.253 -4.732 1.00 21.22 H new ATOM 743 N THR A 52 14.887 -14.261 -3.029 1.00 64.24 N ATOM 744 CA THR A 52 15.901 -15.245 -2.670 1.00 40.32 C ATOM 745 C THR A 52 16.251 -16.133 -3.859 1.00 1.23 C ATOM 746 O THR A 52 15.434 -16.333 -4.758 1.00 22.22 O ATOM 747 CB THR A 52 15.434 -16.132 -1.501 1.00 55.01 C ATOM 748 OG1 THR A 52 16.326 -17.240 -1.340 1.00 32.22 O ATOM 749 CG2 THR A 52 14.021 -16.643 -1.741 1.00 13.45 C ATOM 0 H THR A 52 13.987 -14.661 -3.293 1.00 64.24 H new ATOM 0 HA THR A 52 16.786 -14.689 -2.363 1.00 40.32 H new ATOM 0 HB THR A 52 15.437 -15.529 -0.593 1.00 55.01 H new ATOM 0 HG1 THR A 52 16.840 -17.129 -0.513 1.00 32.22 H new ATOM 0 HG21 THR A 52 13.712 -17.267 -0.902 1.00 13.45 H new ATOM 0 HG22 THR A 52 13.339 -15.798 -1.834 1.00 13.45 H new ATOM 0 HG23 THR A 52 13.998 -17.231 -2.659 1.00 13.45 H new ATOM 757 N ASP A 53 17.469 -16.663 -3.857 1.00 0.05 N ATOM 758 CA ASP A 53 17.927 -17.532 -4.935 1.00 14.04 C ATOM 759 C ASP A 53 18.185 -18.945 -4.421 1.00 74.11 C ATOM 760 O ASP A 53 17.409 -19.863 -4.688 1.00 3.05 O ATOM 761 CB ASP A 53 19.198 -16.967 -5.569 1.00 41.43 C ATOM 762 CG ASP A 53 18.951 -15.657 -6.293 1.00 23.34 C ATOM 763 OD1 ASP A 53 17.941 -14.991 -5.985 1.00 72.40 O ATOM 764 OD2 ASP A 53 19.768 -15.299 -7.167 1.00 1.21 O ATOM 0 H ASP A 53 18.157 -16.506 -3.121 1.00 0.05 H new ATOM 0 HA ASP A 53 17.143 -17.577 -5.691 1.00 14.04 H new ATOM 0 HB2 ASP A 53 19.950 -16.815 -4.795 1.00 41.43 H new ATOM 0 HB3 ASP A 53 19.605 -17.695 -6.270 1.00 41.43 H new ATOM 769 N GLN A 54 19.279 -19.111 -3.685 1.00 73.31 N ATOM 770 CA GLN A 54 19.639 -20.413 -3.136 1.00 62.23 C ATOM 771 C GLN A 54 18.624 -20.863 -2.090 1.00 45.13 C ATOM 772 O GLN A 54 18.249 -20.095 -1.205 1.00 61.05 O ATOM 773 CB GLN A 54 21.037 -20.360 -2.518 1.00 63.20 C ATOM 774 CG GLN A 54 21.627 -21.731 -2.229 1.00 21.20 C ATOM 775 CD GLN A 54 22.100 -22.439 -3.483 1.00 64.11 C ATOM 776 OE1 GLN A 54 21.348 -22.590 -4.446 1.00 70.21 O ATOM 777 NE2 GLN A 54 23.354 -22.878 -3.478 1.00 52.34 N ATOM 0 H GLN A 54 19.931 -18.361 -3.455 1.00 73.31 H new ATOM 0 HA GLN A 54 19.637 -21.136 -3.952 1.00 62.23 H new ATOM 0 HB2 GLN A 54 21.703 -19.822 -3.192 1.00 63.20 H new ATOM 0 HB3 GLN A 54 20.994 -19.789 -1.590 1.00 63.20 H new ATOM 0 HG2 GLN A 54 22.464 -21.624 -1.539 1.00 21.20 H new ATOM 0 HG3 GLN A 54 20.879 -22.346 -1.729 1.00 21.20 H new ATOM 0 HE21 GLN A 54 23.942 -22.731 -2.658 1.00 52.34 H new ATOM 0 HE22 GLN A 54 23.728 -23.362 -4.294 1.00 52.34 H new ATOM 786 N ASN A 55 18.184 -22.112 -2.199 1.00 22.22 N ATOM 787 CA ASN A 55 17.212 -22.664 -1.262 1.00 53.15 C ATOM 788 C ASN A 55 17.610 -24.072 -0.832 1.00 32.34 C ATOM 789 O ASN A 55 17.580 -25.008 -1.630 1.00 74.21 O ATOM 790 CB ASN A 55 15.819 -22.687 -1.896 1.00 0.34 C ATOM 791 CG ASN A 55 14.891 -21.652 -1.288 1.00 71.55 C ATOM 792 OD1 ASN A 55 13.741 -21.949 -0.963 1.00 3.04 O ATOM 793 ND2 ASN A 55 15.387 -20.431 -1.134 1.00 2.50 N ATOM 0 H ASN A 55 18.485 -22.761 -2.926 1.00 22.22 H new ATOM 0 HA ASN A 55 17.192 -22.026 -0.379 1.00 53.15 H new ATOM 0 HB2 ASN A 55 15.907 -22.507 -2.967 1.00 0.34 H new ATOM 0 HB3 ASN A 55 15.383 -23.679 -1.774 1.00 0.34 H new ATOM 0 HD21 ASN A 55 14.809 -19.693 -0.732 1.00 2.50 H new ATOM 0 HD22 ASN A 55 16.346 -20.231 -1.418 1.00 2.50 H new ATOM 800 N MET A 56 17.982 -24.214 0.436 1.00 30.33 N ATOM 801 CA MET A 56 18.384 -25.509 0.974 1.00 42.12 C ATOM 802 C MET A 56 17.961 -25.647 2.433 1.00 61.02 C ATOM 803 O MET A 56 17.684 -24.663 3.120 1.00 65.44 O ATOM 804 CB MET A 56 19.899 -25.688 0.851 1.00 54.04 C ATOM 805 CG MET A 56 20.321 -26.455 -0.392 1.00 32.12 C ATOM 806 SD MET A 56 21.900 -27.300 -0.183 1.00 71.23 S ATOM 807 CE MET A 56 22.946 -26.337 -1.272 1.00 51.32 C ATOM 0 H MET A 56 18.013 -23.449 1.110 1.00 30.33 H new ATOM 0 HA MET A 56 17.885 -26.286 0.395 1.00 42.12 H new ATOM 0 HB2 MET A 56 20.373 -24.707 0.841 1.00 54.04 H new ATOM 0 HB3 MET A 56 20.268 -26.211 1.733 1.00 54.04 H new ATOM 0 HG2 MET A 56 19.552 -27.186 -0.642 1.00 32.12 H new ATOM 0 HG3 MET A 56 20.391 -25.766 -1.234 1.00 32.12 H new ATOM 0 HE1 MET A 56 23.959 -26.738 -1.252 1.00 51.32 H new ATOM 0 HE2 MET A 56 22.556 -26.387 -2.289 1.00 51.32 H new ATOM 0 HE3 MET A 56 22.960 -25.299 -0.939 1.00 51.32 H new ATOM 817 N PRO A 57 17.909 -26.896 2.919 1.00 14.01 N ATOM 818 CA PRO A 57 17.520 -27.192 4.301 1.00 1.43 C ATOM 819 C PRO A 57 18.572 -26.739 5.308 1.00 13.15 C ATOM 820 O PRO A 57 19.745 -27.095 5.198 1.00 71.14 O ATOM 821 CB PRO A 57 17.389 -28.717 4.314 1.00 13.44 C ATOM 822 CG PRO A 57 18.279 -29.183 3.215 1.00 43.00 C ATOM 823 CD PRO A 57 18.225 -28.116 2.157 1.00 10.31 C ATOM 0 HA PRO A 57 16.607 -26.670 4.589 1.00 1.43 H new ATOM 0 HB2 PRO A 57 17.695 -29.132 5.274 1.00 13.44 H new ATOM 0 HB3 PRO A 57 16.358 -29.027 4.147 1.00 13.44 H new ATOM 0 HG2 PRO A 57 19.299 -29.326 3.573 1.00 43.00 H new ATOM 0 HG3 PRO A 57 17.942 -30.141 2.820 1.00 43.00 H new ATOM 0 HD2 PRO A 57 19.174 -28.025 1.629 1.00 10.31 H new ATOM 0 HD3 PRO A 57 17.463 -28.331 1.408 1.00 10.31 H new ATOM 831 N ARG A 58 18.144 -25.952 6.291 1.00 72.43 N ATOM 832 CA ARG A 58 19.049 -25.451 7.317 1.00 3.42 C ATOM 833 C ARG A 58 18.270 -24.914 8.514 1.00 22.25 C ATOM 834 O ARG A 58 17.234 -24.269 8.356 1.00 35.12 O ATOM 835 CB ARG A 58 19.945 -24.351 6.744 1.00 41.01 C ATOM 836 CG ARG A 58 21.272 -24.205 7.471 1.00 32.31 C ATOM 837 CD ARG A 58 22.224 -25.340 7.126 1.00 51.33 C ATOM 838 NE ARG A 58 23.037 -25.740 8.271 1.00 13.00 N ATOM 839 CZ ARG A 58 24.132 -25.095 8.656 1.00 1.33 C ATOM 840 NH1 ARG A 58 24.543 -24.024 7.991 1.00 0.23 N ATOM 841 NH2 ARG A 58 24.819 -25.520 9.709 1.00 35.21 N ATOM 0 H ARG A 58 17.176 -25.648 6.397 1.00 72.43 H new ATOM 0 HA ARG A 58 19.672 -26.280 7.653 1.00 3.42 H new ATOM 0 HB2 ARG A 58 20.138 -24.563 5.692 1.00 41.01 H new ATOM 0 HB3 ARG A 58 19.411 -23.401 6.785 1.00 41.01 H new ATOM 0 HG2 ARG A 58 21.730 -23.252 7.207 1.00 32.31 H new ATOM 0 HG3 ARG A 58 21.099 -24.188 8.547 1.00 32.31 H new ATOM 0 HD2 ARG A 58 21.652 -26.197 6.770 1.00 51.33 H new ATOM 0 HD3 ARG A 58 22.876 -25.031 6.309 1.00 51.33 H new ATOM 0 HE ARG A 58 22.748 -26.560 8.804 1.00 13.00 H new ATOM 0 HH11 ARG A 58 24.018 -23.694 7.182 1.00 0.23 H new ATOM 0 HH12 ARG A 58 25.384 -23.530 8.289 1.00 0.23 H new ATOM 0 HH21 ARG A 58 24.506 -26.343 10.224 1.00 35.21 H new ATOM 0 HH22 ARG A 58 25.660 -25.024 10.004 1.00 35.21 H new ATOM 855 N LYS A 59 18.776 -25.186 9.713 1.00 50.13 N ATOM 856 CA LYS A 59 18.129 -24.731 10.938 1.00 43.12 C ATOM 857 C LYS A 59 17.920 -23.220 10.914 1.00 62.12 C ATOM 858 O LYS A 59 16.900 -22.718 11.385 1.00 2.34 O ATOM 859 CB LYS A 59 18.968 -25.121 12.157 1.00 42.01 C ATOM 860 CG LYS A 59 18.217 -25.013 13.472 1.00 14.43 C ATOM 861 CD LYS A 59 18.647 -26.092 14.451 1.00 32.30 C ATOM 862 CE LYS A 59 20.076 -25.878 14.924 1.00 24.21 C ATOM 863 NZ LYS A 59 20.286 -26.391 16.306 1.00 21.52 N ATOM 0 H LYS A 59 19.632 -25.720 9.862 1.00 50.13 H new ATOM 0 HA LYS A 59 17.154 -25.214 11.006 1.00 43.12 H new ATOM 0 HB2 LYS A 59 19.320 -26.145 12.033 1.00 42.01 H new ATOM 0 HB3 LYS A 59 19.851 -24.483 12.199 1.00 42.01 H new ATOM 0 HG2 LYS A 59 18.392 -24.031 13.912 1.00 14.43 H new ATOM 0 HG3 LYS A 59 17.146 -25.094 13.288 1.00 14.43 H new ATOM 0 HD2 LYS A 59 17.975 -26.095 15.309 1.00 32.30 H new ATOM 0 HD3 LYS A 59 18.562 -27.070 13.977 1.00 32.30 H new ATOM 0 HE2 LYS A 59 20.763 -26.379 14.242 1.00 24.21 H new ATOM 0 HE3 LYS A 59 20.314 -24.815 14.891 1.00 24.21 H new ATOM 0 HZ1 LYS A 59 21.272 -26.226 16.591 1.00 21.52 H new ATOM 0 HZ2 LYS A 59 19.649 -25.895 16.961 1.00 21.52 H new ATOM 0 HZ3 LYS A 59 20.084 -27.411 16.332 1.00 21.52 H new ATOM 877 N SER A 60 18.892 -22.501 10.360 1.00 33.44 N ATOM 878 CA SER A 60 18.815 -21.048 10.277 1.00 14.41 C ATOM 879 C SER A 60 19.000 -20.575 8.838 1.00 35.42 C ATOM 880 O SER A 60 19.604 -21.266 8.019 1.00 3.11 O ATOM 881 CB SER A 60 19.874 -20.407 11.176 1.00 31.21 C ATOM 882 OG SER A 60 19.836 -20.959 12.481 1.00 3.40 O ATOM 0 H SER A 60 19.741 -22.902 9.962 1.00 33.44 H new ATOM 0 HA SER A 60 17.826 -20.742 10.618 1.00 14.41 H new ATOM 0 HB2 SER A 60 20.863 -20.557 10.743 1.00 31.21 H new ATOM 0 HB3 SER A 60 19.709 -19.331 11.228 1.00 31.21 H new ATOM 0 HG SER A 60 20.523 -20.534 13.036 1.00 3.40 H new ATOM 888 N GLY A 61 18.473 -19.392 8.538 1.00 40.20 N ATOM 889 CA GLY A 61 18.590 -18.846 7.198 1.00 32.33 C ATOM 890 C GLY A 61 17.279 -18.890 6.438 1.00 22.40 C ATOM 891 O GLY A 61 16.363 -18.116 6.719 1.00 44.01 O ATOM 0 H GLY A 61 17.967 -18.802 9.199 1.00 40.20 H new ATOM 0 HA2 GLY A 61 18.937 -17.815 7.258 1.00 32.33 H new ATOM 0 HA3 GLY A 61 19.346 -19.405 6.646 1.00 32.33 H new ATOM 895 N LEU A 62 17.188 -19.797 5.471 1.00 22.14 N ATOM 896 CA LEU A 62 15.980 -19.938 4.666 1.00 31.43 C ATOM 897 C LEU A 62 14.801 -20.384 5.526 1.00 4.53 C ATOM 898 O LEU A 62 13.663 -19.977 5.294 1.00 5.02 O ATOM 899 CB LEU A 62 16.210 -20.944 3.537 1.00 25.21 C ATOM 900 CG LEU A 62 16.968 -20.421 2.316 1.00 10.23 C ATOM 901 CD1 LEU A 62 16.249 -19.223 1.716 1.00 45.53 C ATOM 902 CD2 LEU A 62 18.397 -20.055 2.692 1.00 73.25 C ATOM 0 H LEU A 62 17.936 -20.445 5.226 1.00 22.14 H new ATOM 0 HA LEU A 62 15.745 -18.965 4.235 1.00 31.43 H new ATOM 0 HB2 LEU A 62 16.757 -21.795 3.942 1.00 25.21 H new ATOM 0 HB3 LEU A 62 15.240 -21.316 3.206 1.00 25.21 H new ATOM 0 HG LEU A 62 17.002 -21.212 1.566 1.00 10.23 H new ATOM 0 HD11 LEU A 62 16.802 -18.864 0.848 1.00 45.53 H new ATOM 0 HD12 LEU A 62 15.245 -19.517 1.410 1.00 45.53 H new ATOM 0 HD13 LEU A 62 16.184 -18.428 2.459 1.00 45.53 H new ATOM 0 HD21 LEU A 62 18.922 -19.685 1.811 1.00 73.25 H new ATOM 0 HD22 LEU A 62 18.384 -19.281 3.459 1.00 73.25 H new ATOM 0 HD23 LEU A 62 18.910 -20.937 3.075 1.00 73.25 H new ATOM 914 N GLU A 63 15.083 -21.219 6.521 1.00 65.20 N ATOM 915 CA GLU A 63 14.046 -21.718 7.416 1.00 2.23 C ATOM 916 C GLU A 63 13.225 -20.567 7.991 1.00 35.50 C ATOM 917 O GLU A 63 12.042 -20.726 8.296 1.00 33.03 O ATOM 918 CB GLU A 63 14.670 -22.531 8.553 1.00 73.15 C ATOM 919 CG GLU A 63 13.680 -22.917 9.639 1.00 3.43 C ATOM 920 CD GLU A 63 13.994 -24.263 10.263 1.00 1.42 C ATOM 921 OE1 GLU A 63 15.094 -24.795 10.005 1.00 13.12 O ATOM 922 OE2 GLU A 63 13.139 -24.783 11.010 1.00 22.31 O ATOM 0 H GLU A 63 16.020 -21.564 6.727 1.00 65.20 H new ATOM 0 HA GLU A 63 13.383 -22.363 6.839 1.00 2.23 H new ATOM 0 HB2 GLU A 63 15.114 -23.436 8.140 1.00 73.15 H new ATOM 0 HB3 GLU A 63 15.480 -21.954 8.999 1.00 73.15 H new ATOM 0 HG2 GLU A 63 13.681 -22.152 10.415 1.00 3.43 H new ATOM 0 HG3 GLU A 63 12.675 -22.942 9.217 1.00 3.43 H new ATOM 929 N LEU A 64 13.860 -19.410 8.136 1.00 15.24 N ATOM 930 CA LEU A 64 13.189 -18.232 8.675 1.00 12.40 C ATOM 931 C LEU A 64 11.856 -17.995 7.972 1.00 12.03 C ATOM 932 O LEU A 64 10.899 -17.514 8.581 1.00 62.24 O ATOM 933 CB LEU A 64 14.083 -16.999 8.526 1.00 35.04 C ATOM 934 CG LEU A 64 13.981 -15.958 9.642 1.00 50.14 C ATOM 935 CD1 LEU A 64 15.361 -15.444 10.019 1.00 5.31 C ATOM 936 CD2 LEU A 64 13.079 -14.808 9.217 1.00 2.02 C ATOM 0 H LEU A 64 14.838 -19.262 7.888 1.00 15.24 H new ATOM 0 HA LEU A 64 12.995 -18.407 9.733 1.00 12.40 H new ATOM 0 HB2 LEU A 64 15.119 -17.332 8.460 1.00 35.04 H new ATOM 0 HB3 LEU A 64 13.843 -16.513 7.580 1.00 35.04 H new ATOM 0 HG LEU A 64 13.541 -16.434 10.518 1.00 50.14 H new ATOM 0 HD11 LEU A 64 15.269 -14.704 10.814 1.00 5.31 H new ATOM 0 HD12 LEU A 64 15.977 -16.274 10.365 1.00 5.31 H new ATOM 0 HD13 LEU A 64 15.828 -14.984 9.148 1.00 5.31 H new ATOM 0 HD21 LEU A 64 13.018 -14.077 10.023 1.00 2.02 H new ATOM 0 HD22 LEU A 64 13.490 -14.333 8.326 1.00 2.02 H new ATOM 0 HD23 LEU A 64 12.082 -15.190 8.997 1.00 2.02 H new ATOM 948 N ILE A 65 11.800 -18.338 6.690 1.00 41.43 N ATOM 949 CA ILE A 65 10.583 -18.166 5.906 1.00 44.52 C ATOM 950 C ILE A 65 9.377 -18.759 6.625 1.00 21.14 C ATOM 951 O ILE A 65 8.276 -18.212 6.568 1.00 3.13 O ATOM 952 CB ILE A 65 10.711 -18.819 4.517 1.00 22.11 C ATOM 953 CG1 ILE A 65 11.886 -18.210 3.749 1.00 61.10 C ATOM 954 CG2 ILE A 65 9.417 -18.656 3.734 1.00 44.34 C ATOM 955 CD1 ILE A 65 12.367 -19.068 2.600 1.00 75.33 C ATOM 0 H ILE A 65 12.583 -18.737 6.172 1.00 41.43 H new ATOM 0 HA ILE A 65 10.437 -17.093 5.782 1.00 44.52 H new ATOM 0 HB ILE A 65 10.901 -19.884 4.649 1.00 22.11 H new ATOM 0 HG12 ILE A 65 11.591 -17.234 3.364 1.00 61.10 H new ATOM 0 HG13 ILE A 65 12.713 -18.044 4.439 1.00 61.10 H new ATOM 0 HG21 ILE A 65 9.523 -19.123 2.755 1.00 44.34 H new ATOM 0 HG22 ILE A 65 8.601 -19.133 4.277 1.00 44.34 H new ATOM 0 HG23 ILE A 65 9.199 -17.595 3.609 1.00 44.34 H new ATOM 0 HD11 ILE A 65 13.201 -18.574 2.101 1.00 75.33 H new ATOM 0 HD12 ILE A 65 12.693 -20.036 2.980 1.00 75.33 H new ATOM 0 HD13 ILE A 65 11.554 -19.213 1.889 1.00 75.33 H new ATOM 967 N ALA A 66 9.593 -19.881 7.304 1.00 20.12 N ATOM 968 CA ALA A 66 8.525 -20.547 8.039 1.00 73.23 C ATOM 969 C ALA A 66 8.060 -19.701 9.219 1.00 31.23 C ATOM 970 O ALA A 66 6.863 -19.584 9.478 1.00 55.03 O ATOM 971 CB ALA A 66 8.987 -21.916 8.517 1.00 13.31 C ATOM 0 H ALA A 66 10.498 -20.348 7.360 1.00 20.12 H new ATOM 0 HA ALA A 66 7.679 -20.677 7.364 1.00 73.23 H new ATOM 0 HB1 ALA A 66 8.179 -22.402 9.064 1.00 13.31 H new ATOM 0 HB2 ALA A 66 9.262 -22.528 7.658 1.00 13.31 H new ATOM 0 HB3 ALA A 66 9.851 -21.800 9.172 1.00 13.31 H new ATOM 977 N ALA A 67 9.015 -19.114 9.933 1.00 41.01 N ATOM 978 CA ALA A 67 8.703 -18.278 11.085 1.00 11.22 C ATOM 979 C ALA A 67 7.937 -17.028 10.665 1.00 11.03 C ATOM 980 O ALA A 67 7.085 -16.532 11.404 1.00 51.02 O ATOM 981 CB ALA A 67 9.979 -17.895 11.821 1.00 52.04 C ATOM 0 H ALA A 67 10.011 -19.202 9.733 1.00 41.01 H new ATOM 0 HA ALA A 67 8.067 -18.853 11.758 1.00 11.22 H new ATOM 0 HB1 ALA A 67 9.731 -17.271 12.679 1.00 52.04 H new ATOM 0 HB2 ALA A 67 10.486 -18.797 12.163 1.00 52.04 H new ATOM 0 HB3 ALA A 67 10.635 -17.343 11.148 1.00 52.04 H new ATOM 987 N LEU A 68 8.245 -16.523 9.476 1.00 1.40 N ATOM 988 CA LEU A 68 7.586 -15.329 8.958 1.00 74.14 C ATOM 989 C LEU A 68 6.203 -15.666 8.408 1.00 22.12 C ATOM 990 O LEU A 68 5.272 -14.868 8.512 1.00 52.33 O ATOM 991 CB LEU A 68 8.439 -14.686 7.863 1.00 11.32 C ATOM 992 CG LEU A 68 9.916 -14.477 8.199 1.00 20.32 C ATOM 993 CD1 LEU A 68 10.750 -14.423 6.929 1.00 51.45 C ATOM 994 CD2 LEU A 68 10.103 -13.208 9.017 1.00 0.21 C ATOM 0 H LEU A 68 8.947 -16.921 8.852 1.00 1.40 H new ATOM 0 HA LEU A 68 7.468 -14.623 9.780 1.00 74.14 H new ATOM 0 HB2 LEU A 68 8.375 -15.306 6.969 1.00 11.32 H new ATOM 0 HB3 LEU A 68 8.004 -13.719 7.612 1.00 11.32 H new ATOM 0 HG LEU A 68 10.256 -15.323 8.796 1.00 20.32 H new ATOM 0 HD11 LEU A 68 11.798 -14.274 7.188 1.00 51.45 H new ATOM 0 HD12 LEU A 68 10.641 -15.360 6.382 1.00 51.45 H new ATOM 0 HD13 LEU A 68 10.409 -13.597 6.305 1.00 51.45 H new ATOM 0 HD21 LEU A 68 11.160 -13.076 9.247 1.00 0.21 H new ATOM 0 HD22 LEU A 68 9.746 -12.351 8.446 1.00 0.21 H new ATOM 0 HD23 LEU A 68 9.537 -13.287 9.945 1.00 0.21 H new ATOM 1006 N ARG A 69 6.077 -16.854 7.826 1.00 31.10 N ATOM 1007 CA ARG A 69 4.808 -17.297 7.261 1.00 31.24 C ATOM 1008 C ARG A 69 3.724 -17.348 8.334 1.00 53.40 C ATOM 1009 O ARG A 69 2.644 -16.783 8.164 1.00 14.13 O ATOM 1010 CB ARG A 69 4.966 -18.675 6.616 1.00 50.03 C ATOM 1011 CG ARG A 69 3.680 -19.215 6.011 1.00 65.31 C ATOM 1012 CD ARG A 69 3.411 -20.643 6.459 1.00 64.44 C ATOM 1013 NE ARG A 69 3.895 -21.622 5.488 1.00 0.40 N ATOM 1014 CZ ARG A 69 3.623 -22.920 5.555 1.00 32.12 C ATOM 1015 NH1 ARG A 69 2.874 -23.394 6.542 1.00 42.43 N ATOM 1016 NH2 ARG A 69 4.099 -23.748 4.634 1.00 44.40 N ATOM 0 H ARG A 69 6.838 -17.527 7.733 1.00 31.10 H new ATOM 0 HA ARG A 69 4.508 -16.578 6.498 1.00 31.24 H new ATOM 0 HB2 ARG A 69 5.727 -18.618 5.838 1.00 50.03 H new ATOM 0 HB3 ARG A 69 5.328 -19.378 7.366 1.00 50.03 H new ATOM 0 HG2 ARG A 69 2.844 -18.578 6.301 1.00 65.31 H new ATOM 0 HG3 ARG A 69 3.745 -19.180 4.924 1.00 65.31 H new ATOM 0 HD2 ARG A 69 3.893 -20.818 7.421 1.00 64.44 H new ATOM 0 HD3 ARG A 69 2.340 -20.780 6.609 1.00 64.44 H new ATOM 0 HE ARG A 69 4.474 -21.290 4.716 1.00 0.40 H new ATOM 0 HH11 ARG A 69 2.505 -22.761 7.252 1.00 42.43 H new ATOM 0 HH12 ARG A 69 2.667 -24.391 6.591 1.00 42.43 H new ATOM 0 HH21 ARG A 69 4.675 -23.388 3.873 1.00 44.40 H new ATOM 0 HH22 ARG A 69 3.889 -24.745 4.687 1.00 44.40 H new ATOM 1030 N GLN A 70 4.020 -18.028 9.437 1.00 45.05 N ATOM 1031 CA GLN A 70 3.070 -18.153 10.535 1.00 3.25 C ATOM 1032 C GLN A 70 2.627 -16.780 11.030 1.00 34.11 C ATOM 1033 O GLN A 70 1.474 -16.592 11.421 1.00 73.01 O ATOM 1034 CB GLN A 70 3.691 -18.947 11.686 1.00 11.44 C ATOM 1035 CG GLN A 70 4.987 -18.348 12.209 1.00 14.13 C ATOM 1036 CD GLN A 70 5.523 -19.085 13.420 1.00 25.41 C ATOM 1037 OE1 GLN A 70 5.231 -18.725 14.561 1.00 72.52 O ATOM 1038 NE2 GLN A 70 6.314 -20.124 13.178 1.00 21.52 N ATOM 0 H GLN A 70 4.910 -18.501 9.594 1.00 45.05 H new ATOM 0 HA GLN A 70 2.194 -18.686 10.166 1.00 3.25 H new ATOM 0 HB2 GLN A 70 2.973 -19.008 12.504 1.00 11.44 H new ATOM 0 HB3 GLN A 70 3.881 -19.967 11.352 1.00 11.44 H new ATOM 0 HG2 GLN A 70 5.736 -18.365 11.417 1.00 14.13 H new ATOM 0 HG3 GLN A 70 4.821 -17.303 12.469 1.00 14.13 H new ATOM 0 HE21 GLN A 70 6.530 -20.388 12.217 1.00 21.52 H new ATOM 0 HE22 GLN A 70 6.706 -20.658 13.954 1.00 21.52 H new ATOM 1047 N LEU A 71 3.548 -15.824 11.011 1.00 4.31 N ATOM 1048 CA LEU A 71 3.252 -14.467 11.458 1.00 5.11 C ATOM 1049 C LEU A 71 2.349 -13.749 10.460 1.00 65.51 C ATOM 1050 O LEU A 71 2.380 -14.035 9.263 1.00 62.20 O ATOM 1051 CB LEU A 71 4.549 -13.678 11.649 1.00 12.33 C ATOM 1052 CG LEU A 71 5.076 -13.589 13.082 1.00 72.30 C ATOM 1053 CD1 LEU A 71 4.182 -12.693 13.925 1.00 32.52 C ATOM 1054 CD2 LEU A 71 5.178 -14.977 13.699 1.00 1.51 C ATOM 0 H LEU A 71 4.506 -15.963 10.691 1.00 4.31 H new ATOM 0 HA LEU A 71 2.729 -14.531 12.412 1.00 5.11 H new ATOM 0 HB2 LEU A 71 5.321 -14.131 11.027 1.00 12.33 H new ATOM 0 HB3 LEU A 71 4.393 -12.665 11.277 1.00 12.33 H new ATOM 0 HG LEU A 71 6.073 -13.150 13.056 1.00 72.30 H new ATOM 0 HD11 LEU A 71 4.573 -12.642 14.941 1.00 32.52 H new ATOM 0 HD12 LEU A 71 4.160 -11.692 13.494 1.00 32.52 H new ATOM 0 HD13 LEU A 71 3.172 -13.102 13.945 1.00 32.52 H new ATOM 0 HD21 LEU A 71 5.555 -14.895 14.719 1.00 1.51 H new ATOM 0 HD22 LEU A 71 4.192 -15.443 13.712 1.00 1.51 H new ATOM 0 HD23 LEU A 71 5.860 -15.589 13.108 1.00 1.51 H new ATOM 1066 N SER A 72 1.548 -12.815 10.960 1.00 13.14 N ATOM 1067 CA SER A 72 0.635 -12.057 10.113 1.00 74.12 C ATOM 1068 C SER A 72 1.259 -10.730 9.692 1.00 31.11 C ATOM 1069 O SER A 72 0.570 -9.717 9.574 1.00 20.30 O ATOM 1070 CB SER A 72 -0.684 -11.804 10.846 1.00 1.42 C ATOM 1071 OG SER A 72 -0.458 -11.195 12.106 1.00 20.30 O ATOM 0 H SER A 72 1.512 -12.564 11.948 1.00 13.14 H new ATOM 0 HA SER A 72 0.437 -12.646 9.217 1.00 74.12 H new ATOM 0 HB2 SER A 72 -1.324 -11.164 10.239 1.00 1.42 H new ATOM 0 HB3 SER A 72 -1.214 -12.747 10.984 1.00 1.42 H new ATOM 0 HG SER A 72 -1.316 -11.042 12.554 1.00 20.30 H new ATOM 1077 N ALA A 73 2.569 -10.745 9.467 1.00 13.44 N ATOM 1078 CA ALA A 73 3.287 -9.544 9.058 1.00 32.00 C ATOM 1079 C ALA A 73 3.987 -9.753 7.719 1.00 14.43 C ATOM 1080 O ALA A 73 4.130 -8.818 6.930 1.00 35.33 O ATOM 1081 CB ALA A 73 4.294 -9.142 10.125 1.00 11.32 C ATOM 0 H ALA A 73 3.154 -11.575 9.561 1.00 13.44 H new ATOM 0 HA ALA A 73 2.561 -8.740 8.938 1.00 32.00 H new ATOM 0 HB1 ALA A 73 4.823 -8.244 9.806 1.00 11.32 H new ATOM 0 HB2 ALA A 73 3.772 -8.943 11.061 1.00 11.32 H new ATOM 0 HB3 ALA A 73 5.009 -9.951 10.273 1.00 11.32 H new ATOM 1087 N TYR A 74 4.422 -10.983 7.470 1.00 54.40 N ATOM 1088 CA TYR A 74 5.110 -11.313 6.228 1.00 53.24 C ATOM 1089 C TYR A 74 4.268 -12.255 5.372 1.00 12.23 C ATOM 1090 O TYR A 74 4.422 -12.308 4.153 1.00 73.05 O ATOM 1091 CB TYR A 74 6.467 -11.953 6.526 1.00 14.41 C ATOM 1092 CG TYR A 74 7.247 -11.241 7.608 1.00 33.04 C ATOM 1093 CD1 TYR A 74 6.983 -11.478 8.952 1.00 61.31 C ATOM 1094 CD2 TYR A 74 8.246 -10.331 7.288 1.00 42.12 C ATOM 1095 CE1 TYR A 74 7.693 -10.830 9.944 1.00 13.03 C ATOM 1096 CE2 TYR A 74 8.962 -9.679 8.273 1.00 32.24 C ATOM 1097 CZ TYR A 74 8.681 -9.932 9.600 1.00 2.11 C ATOM 1098 OH TYR A 74 9.391 -9.284 10.585 1.00 52.41 O ATOM 0 H TYR A 74 4.310 -11.768 8.112 1.00 54.40 H new ATOM 0 HA TYR A 74 5.266 -10.388 5.673 1.00 53.24 H new ATOM 0 HB2 TYR A 74 6.313 -12.990 6.824 1.00 14.41 H new ATOM 0 HB3 TYR A 74 7.061 -11.969 5.612 1.00 14.41 H new ATOM 0 HD1 TYR A 74 6.210 -12.181 9.225 1.00 61.31 H new ATOM 0 HD2 TYR A 74 8.467 -10.129 6.250 1.00 42.12 H new ATOM 0 HE1 TYR A 74 7.475 -11.026 10.984 1.00 13.03 H new ATOM 0 HE2 TYR A 74 9.737 -8.976 8.006 1.00 32.24 H new ATOM 0 HH TYR A 74 10.160 -8.825 10.186 1.00 52.41 H new ATOM 1108 N ALA A 75 3.377 -12.996 6.022 1.00 33.23 N ATOM 1109 CA ALA A 75 2.508 -13.934 5.323 1.00 72.43 C ATOM 1110 C ALA A 75 1.851 -13.277 4.114 1.00 73.33 C ATOM 1111 O ALA A 75 1.700 -13.900 3.062 1.00 0.13 O ATOM 1112 CB ALA A 75 1.449 -14.480 6.270 1.00 62.04 C ATOM 0 H ALA A 75 3.238 -12.965 7.032 1.00 33.23 H new ATOM 0 HA ALA A 75 3.121 -14.761 4.966 1.00 72.43 H new ATOM 0 HB1 ALA A 75 0.807 -15.179 5.734 1.00 62.04 H new ATOM 0 HB2 ALA A 75 1.933 -14.995 7.100 1.00 62.04 H new ATOM 0 HB3 ALA A 75 0.847 -13.657 6.656 1.00 62.04 H new ATOM 1118 N ASP A 76 1.461 -12.017 4.270 1.00 21.03 N ATOM 1119 CA ASP A 76 0.820 -11.275 3.191 1.00 70.22 C ATOM 1120 C ASP A 76 1.844 -10.840 2.148 1.00 44.15 C ATOM 1121 O ASP A 76 1.552 -10.803 0.952 1.00 63.13 O ATOM 1122 CB ASP A 76 0.089 -10.052 3.747 1.00 23.34 C ATOM 1123 CG ASP A 76 -0.582 -10.334 5.077 1.00 23.43 C ATOM 1124 OD1 ASP A 76 -0.020 -9.941 6.120 1.00 4.43 O ATOM 1125 OD2 ASP A 76 -1.669 -10.950 5.075 1.00 4.11 O ATOM 0 H ASP A 76 1.578 -11.488 5.134 1.00 21.03 H new ATOM 0 HA ASP A 76 0.096 -11.934 2.711 1.00 70.22 H new ATOM 0 HB2 ASP A 76 0.797 -9.232 3.867 1.00 23.34 H new ATOM 0 HB3 ASP A 76 -0.661 -9.722 3.028 1.00 23.34 H new ATOM 1130 N THR A 77 3.047 -10.509 2.608 1.00 31.31 N ATOM 1131 CA THR A 77 4.114 -10.074 1.716 1.00 60.31 C ATOM 1132 C THR A 77 4.417 -11.135 0.663 1.00 2.54 C ATOM 1133 O THR A 77 4.678 -12.297 0.975 1.00 3.44 O ATOM 1134 CB THR A 77 5.404 -9.758 2.496 1.00 41.54 C ATOM 1135 OG1 THR A 77 5.174 -8.675 3.404 1.00 1.21 O ATOM 1136 CG2 THR A 77 6.536 -9.397 1.545 1.00 21.24 C ATOM 0 H THR A 77 3.306 -10.534 3.594 1.00 31.31 H new ATOM 0 HA THR A 77 3.764 -9.167 1.224 1.00 60.31 H new ATOM 0 HB THR A 77 5.691 -10.647 3.057 1.00 41.54 H new ATOM 0 HG1 THR A 77 5.998 -8.481 3.897 1.00 1.21 H new ATOM 0 HG21 THR A 77 7.437 -9.178 2.118 1.00 21.24 H new ATOM 0 HG22 THR A 77 6.728 -10.234 0.873 1.00 21.24 H new ATOM 0 HG23 THR A 77 6.255 -8.520 0.961 1.00 21.24 H new ATOM 1144 N PRO A 78 4.383 -10.728 -0.614 1.00 44.23 N ATOM 1145 CA PRO A 78 4.654 -11.628 -1.739 1.00 74.21 C ATOM 1146 C PRO A 78 6.119 -12.046 -1.808 1.00 55.13 C ATOM 1147 O PRO A 78 7.004 -11.209 -1.988 1.00 61.40 O ATOM 1148 CB PRO A 78 4.278 -10.789 -2.963 1.00 63.21 C ATOM 1149 CG PRO A 78 4.441 -9.377 -2.519 1.00 3.34 C ATOM 1150 CD PRO A 78 4.079 -9.357 -1.059 1.00 64.43 C ATOM 0 HA PRO A 78 4.097 -12.561 -1.658 1.00 74.21 H new ATOM 0 HB2 PRO A 78 4.924 -11.014 -3.811 1.00 63.21 H new ATOM 0 HB3 PRO A 78 3.255 -10.989 -3.280 1.00 63.21 H new ATOM 0 HG2 PRO A 78 5.465 -9.036 -2.672 1.00 3.34 H new ATOM 0 HG3 PRO A 78 3.794 -8.711 -3.090 1.00 3.34 H new ATOM 0 HD2 PRO A 78 4.662 -8.618 -0.510 1.00 64.43 H new ATOM 0 HD3 PRO A 78 3.028 -9.109 -0.909 1.00 64.43 H new ATOM 1158 N ILE A 79 6.366 -13.343 -1.665 1.00 64.42 N ATOM 1159 CA ILE A 79 7.724 -13.871 -1.713 1.00 63.03 C ATOM 1160 C ILE A 79 8.006 -14.543 -3.053 1.00 33.11 C ATOM 1161 O ILE A 79 7.253 -15.412 -3.495 1.00 35.05 O ATOM 1162 CB ILE A 79 7.975 -14.884 -0.581 1.00 21.13 C ATOM 1163 CG1 ILE A 79 7.783 -14.216 0.782 1.00 23.03 C ATOM 1164 CG2 ILE A 79 9.373 -15.472 -0.696 1.00 64.43 C ATOM 1165 CD1 ILE A 79 8.776 -13.108 1.057 1.00 21.44 C ATOM 0 H ILE A 79 5.644 -14.048 -1.515 1.00 64.42 H new ATOM 0 HA ILE A 79 8.396 -13.023 -1.586 1.00 63.03 H new ATOM 0 HB ILE A 79 7.253 -15.695 -0.673 1.00 21.13 H new ATOM 0 HG12 ILE A 79 6.773 -13.810 0.840 1.00 23.03 H new ATOM 0 HG13 ILE A 79 7.868 -14.971 1.563 1.00 23.03 H new ATOM 0 HG21 ILE A 79 9.535 -16.186 0.111 1.00 64.43 H new ATOM 0 HG22 ILE A 79 9.477 -15.979 -1.655 1.00 64.43 H new ATOM 0 HG23 ILE A 79 10.111 -14.673 -0.627 1.00 64.43 H new ATOM 0 HD11 ILE A 79 8.580 -12.680 2.040 1.00 21.44 H new ATOM 0 HD12 ILE A 79 9.788 -13.512 1.032 1.00 21.44 H new ATOM 0 HD13 ILE A 79 8.676 -12.333 0.297 1.00 21.44 H new ATOM 1177 N LEU A 80 9.096 -14.137 -3.695 1.00 14.03 N ATOM 1178 CA LEU A 80 9.479 -14.701 -4.984 1.00 71.13 C ATOM 1179 C LEU A 80 10.884 -15.291 -4.924 1.00 63.05 C ATOM 1180 O LEU A 80 11.866 -14.568 -4.752 1.00 13.00 O ATOM 1181 CB LEU A 80 9.409 -13.629 -6.073 1.00 64.01 C ATOM 1182 CG LEU A 80 8.061 -12.927 -6.238 1.00 43.53 C ATOM 1183 CD1 LEU A 80 6.922 -13.930 -6.150 1.00 21.12 C ATOM 1184 CD2 LEU A 80 7.896 -11.836 -5.190 1.00 43.22 C ATOM 0 H LEU A 80 9.730 -13.419 -3.344 1.00 14.03 H new ATOM 0 HA LEU A 80 8.779 -15.501 -5.225 1.00 71.13 H new ATOM 0 HB2 LEU A 80 10.166 -12.874 -5.861 1.00 64.01 H new ATOM 0 HB3 LEU A 80 9.676 -14.088 -7.025 1.00 64.01 H new ATOM 0 HG LEU A 80 8.033 -12.463 -7.224 1.00 43.53 H new ATOM 0 HD11 LEU A 80 5.971 -13.412 -6.270 1.00 21.12 H new ATOM 0 HD12 LEU A 80 7.031 -14.675 -6.938 1.00 21.12 H new ATOM 0 HD13 LEU A 80 6.946 -14.424 -5.179 1.00 21.12 H new ATOM 0 HD21 LEU A 80 6.931 -11.347 -5.323 1.00 43.22 H new ATOM 0 HD22 LEU A 80 7.945 -12.277 -4.195 1.00 43.22 H new ATOM 0 HD23 LEU A 80 8.693 -11.101 -5.301 1.00 43.22 H new ATOM 1196 N VAL A 81 10.974 -16.609 -5.070 1.00 60.22 N ATOM 1197 CA VAL A 81 12.259 -17.296 -5.036 1.00 65.42 C ATOM 1198 C VAL A 81 12.699 -17.709 -6.436 1.00 44.14 C ATOM 1199 O VAL A 81 11.872 -18.044 -7.286 1.00 23.15 O ATOM 1200 CB VAL A 81 12.204 -18.547 -4.138 1.00 51.34 C ATOM 1201 CG1 VAL A 81 11.241 -19.574 -4.713 1.00 33.43 C ATOM 1202 CG2 VAL A 81 13.593 -19.142 -3.969 1.00 23.43 C ATOM 0 H VAL A 81 10.172 -17.222 -5.213 1.00 60.22 H new ATOM 0 HA VAL A 81 12.982 -16.593 -4.623 1.00 65.42 H new ATOM 0 HB VAL A 81 11.838 -18.252 -3.154 1.00 51.34 H new ATOM 0 HG11 VAL A 81 11.215 -20.451 -4.066 1.00 33.43 H new ATOM 0 HG12 VAL A 81 10.243 -19.141 -4.777 1.00 33.43 H new ATOM 0 HG13 VAL A 81 11.574 -19.868 -5.708 1.00 33.43 H new ATOM 0 HG21 VAL A 81 13.536 -20.025 -3.332 1.00 23.43 H new ATOM 0 HG22 VAL A 81 13.989 -19.424 -4.945 1.00 23.43 H new ATOM 0 HG23 VAL A 81 14.251 -18.405 -3.509 1.00 23.43 H new ATOM 1212 N LEU A 82 14.007 -17.683 -6.671 1.00 55.44 N ATOM 1213 CA LEU A 82 14.558 -18.055 -7.970 1.00 1.42 C ATOM 1214 C LEU A 82 15.113 -19.475 -7.939 1.00 32.20 C ATOM 1215 O LEU A 82 15.548 -19.962 -6.895 1.00 13.45 O ATOM 1216 CB LEU A 82 15.659 -17.074 -8.378 1.00 53.13 C ATOM 1217 CG LEU A 82 15.435 -15.613 -7.986 1.00 41.15 C ATOM 1218 CD1 LEU A 82 16.529 -14.731 -8.567 1.00 45.04 C ATOM 1219 CD2 LEU A 82 14.065 -15.140 -8.449 1.00 72.24 C ATOM 0 H LEU A 82 14.705 -17.408 -5.980 1.00 55.44 H new ATOM 0 HA LEU A 82 13.753 -18.015 -8.704 1.00 1.42 H new ATOM 0 HB2 LEU A 82 16.598 -17.408 -7.936 1.00 53.13 H new ATOM 0 HB3 LEU A 82 15.780 -17.125 -9.460 1.00 53.13 H new ATOM 0 HG LEU A 82 15.475 -15.539 -6.899 1.00 41.15 H new ATOM 0 HD11 LEU A 82 16.353 -13.695 -8.278 1.00 45.04 H new ATOM 0 HD12 LEU A 82 17.498 -15.055 -8.186 1.00 45.04 H new ATOM 0 HD13 LEU A 82 16.521 -14.810 -9.654 1.00 45.04 H new ATOM 0 HD21 LEU A 82 13.923 -14.098 -8.161 1.00 72.24 H new ATOM 0 HD22 LEU A 82 13.996 -15.230 -9.533 1.00 72.24 H new ATOM 0 HD23 LEU A 82 13.292 -15.753 -7.985 1.00 72.24 H new ATOM 1231 N THR A 83 15.097 -20.137 -9.092 1.00 54.52 N ATOM 1232 CA THR A 83 15.599 -21.501 -9.198 1.00 55.40 C ATOM 1233 C THR A 83 16.447 -21.679 -10.452 1.00 55.32 C ATOM 1234 O THR A 83 16.372 -20.877 -11.384 1.00 72.44 O ATOM 1235 CB THR A 83 14.447 -22.523 -9.222 1.00 15.14 C ATOM 1236 OG1 THR A 83 14.973 -23.853 -9.296 1.00 11.53 O ATOM 1237 CG2 THR A 83 13.524 -22.271 -10.404 1.00 55.13 C ATOM 0 H THR A 83 14.741 -19.750 -9.966 1.00 54.52 H new ATOM 0 HA THR A 83 16.216 -21.680 -8.317 1.00 55.40 H new ATOM 0 HB THR A 83 13.872 -22.411 -8.303 1.00 15.14 H new ATOM 0 HG1 THR A 83 14.244 -24.484 -9.469 1.00 11.53 H new ATOM 0 HG21 THR A 83 12.718 -23.005 -10.400 1.00 55.13 H new ATOM 0 HG22 THR A 83 13.102 -21.269 -10.329 1.00 55.13 H new ATOM 0 HG23 THR A 83 14.089 -22.358 -11.332 1.00 55.13 H new ATOM 1245 N THR A 84 17.254 -22.735 -10.470 1.00 74.04 N ATOM 1246 CA THR A 84 18.116 -23.018 -11.610 1.00 65.13 C ATOM 1247 C THR A 84 17.563 -24.165 -12.448 1.00 34.24 C ATOM 1248 O THR A 84 17.525 -24.087 -13.675 1.00 70.20 O ATOM 1249 CB THR A 84 19.546 -23.371 -11.159 1.00 3.13 C ATOM 1250 OG1 THR A 84 19.502 -24.325 -10.092 1.00 14.12 O ATOM 1251 CG2 THR A 84 20.292 -22.126 -10.702 1.00 21.21 C ATOM 0 H THR A 84 17.328 -23.408 -9.708 1.00 74.04 H new ATOM 0 HA THR A 84 18.146 -22.112 -12.215 1.00 65.13 H new ATOM 0 HB THR A 84 20.075 -23.801 -12.009 1.00 3.13 H new ATOM 0 HG1 THR A 84 20.415 -24.545 -9.812 1.00 14.12 H new ATOM 0 HG21 THR A 84 21.299 -22.400 -10.388 1.00 21.21 H new ATOM 0 HG22 THR A 84 20.349 -21.414 -11.525 1.00 21.21 H new ATOM 0 HG23 THR A 84 19.762 -21.671 -9.865 1.00 21.21 H new ATOM 1259 N GLU A 85 17.133 -25.229 -11.776 1.00 2.24 N ATOM 1260 CA GLU A 85 16.581 -26.392 -12.460 1.00 22.22 C ATOM 1261 C GLU A 85 15.176 -26.102 -12.979 1.00 32.24 C ATOM 1262 O GLU A 85 14.928 -26.134 -14.183 1.00 41.32 O ATOM 1263 CB GLU A 85 16.551 -27.598 -11.519 1.00 35.25 C ATOM 1264 CG GLU A 85 17.908 -28.252 -11.322 1.00 60.05 C ATOM 1265 CD GLU A 85 17.833 -29.510 -10.479 1.00 3.11 C ATOM 1266 OE1 GLU A 85 16.889 -29.625 -9.669 1.00 62.35 O ATOM 1267 OE2 GLU A 85 18.718 -30.378 -10.628 1.00 23.14 O ATOM 0 H GLU A 85 17.156 -25.309 -10.759 1.00 2.24 H new ATOM 0 HA GLU A 85 17.223 -26.620 -13.311 1.00 22.22 H new ATOM 0 HB2 GLU A 85 16.166 -27.282 -10.550 1.00 35.25 H new ATOM 0 HB3 GLU A 85 15.854 -28.338 -11.913 1.00 35.25 H new ATOM 0 HG2 GLU A 85 18.334 -28.496 -12.295 1.00 60.05 H new ATOM 0 HG3 GLU A 85 18.584 -27.541 -10.847 1.00 60.05 H new ATOM 1274 N GLY A 86 14.258 -25.820 -12.059 1.00 1.03 N ATOM 1275 CA GLY A 86 12.889 -25.529 -12.442 1.00 32.24 C ATOM 1276 C GLY A 86 12.024 -26.773 -12.493 1.00 24.32 C ATOM 1277 O GLY A 86 11.115 -26.872 -13.316 1.00 70.05 O ATOM 0 H GLY A 86 14.438 -25.788 -11.056 1.00 1.03 H new ATOM 0 HA2 GLY A 86 12.460 -24.821 -11.734 1.00 32.24 H new ATOM 0 HA3 GLY A 86 12.883 -25.046 -13.419 1.00 32.24 H new ATOM 1281 N SER A 87 12.309 -27.727 -11.612 1.00 3.35 N ATOM 1282 CA SER A 87 11.554 -28.973 -11.563 1.00 64.43 C ATOM 1283 C SER A 87 10.259 -28.794 -10.778 1.00 54.24 C ATOM 1284 O SER A 87 10.139 -27.886 -9.955 1.00 62.21 O ATOM 1285 CB SER A 87 12.398 -30.081 -10.930 1.00 24.03 C ATOM 1286 OG SER A 87 13.405 -29.539 -10.093 1.00 23.34 O ATOM 0 H SER A 87 13.058 -27.660 -10.922 1.00 3.35 H new ATOM 0 HA SER A 87 11.302 -29.256 -12.585 1.00 64.43 H new ATOM 0 HB2 SER A 87 11.757 -30.745 -10.350 1.00 24.03 H new ATOM 0 HB3 SER A 87 12.857 -30.685 -11.713 1.00 24.03 H new ATOM 0 HG SER A 87 13.930 -30.267 -9.699 1.00 23.34 H new ATOM 1292 N ASP A 88 9.291 -29.665 -11.040 1.00 34.23 N ATOM 1293 CA ASP A 88 8.003 -29.605 -10.358 1.00 11.11 C ATOM 1294 C ASP A 88 8.161 -29.904 -8.870 1.00 41.14 C ATOM 1295 O ASP A 88 7.473 -29.321 -8.033 1.00 40.54 O ATOM 1296 CB ASP A 88 7.021 -30.594 -10.988 1.00 63.21 C ATOM 1297 CG ASP A 88 5.811 -30.847 -10.111 1.00 31.11 C ATOM 1298 OD1 ASP A 88 5.663 -31.985 -9.618 1.00 14.04 O ATOM 1299 OD2 ASP A 88 5.012 -29.907 -9.917 1.00 5.10 O ATOM 0 H ASP A 88 9.373 -30.421 -11.720 1.00 34.23 H new ATOM 0 HA ASP A 88 7.609 -28.595 -10.467 1.00 11.11 H new ATOM 0 HB2 ASP A 88 6.692 -30.210 -11.954 1.00 63.21 H new ATOM 0 HB3 ASP A 88 7.532 -31.538 -11.178 1.00 63.21 H new ATOM 1304 N ALA A 89 9.071 -30.817 -8.549 1.00 64.52 N ATOM 1305 CA ALA A 89 9.320 -31.193 -7.163 1.00 64.31 C ATOM 1306 C ALA A 89 9.835 -30.006 -6.356 1.00 51.13 C ATOM 1307 O ALA A 89 9.494 -29.844 -5.184 1.00 72.34 O ATOM 1308 CB ALA A 89 10.311 -32.346 -7.099 1.00 31.43 C ATOM 0 H ALA A 89 9.648 -31.310 -9.230 1.00 64.52 H new ATOM 0 HA ALA A 89 8.375 -31.515 -6.725 1.00 64.31 H new ATOM 0 HB1 ALA A 89 10.488 -32.616 -6.058 1.00 31.43 H new ATOM 0 HB2 ALA A 89 9.905 -33.205 -7.633 1.00 31.43 H new ATOM 0 HB3 ALA A 89 11.251 -32.044 -7.560 1.00 31.43 H new ATOM 1314 N PHE A 90 10.658 -29.178 -6.991 1.00 10.44 N ATOM 1315 CA PHE A 90 11.221 -28.005 -6.331 1.00 21.32 C ATOM 1316 C PHE A 90 10.116 -27.077 -5.836 1.00 2.24 C ATOM 1317 O PHE A 90 10.227 -26.475 -4.767 1.00 43.45 O ATOM 1318 CB PHE A 90 12.146 -27.251 -7.288 1.00 4.44 C ATOM 1319 CG PHE A 90 13.179 -26.413 -6.588 1.00 35.54 C ATOM 1320 CD1 PHE A 90 12.821 -25.232 -5.958 1.00 71.12 C ATOM 1321 CD2 PHE A 90 14.507 -26.808 -6.560 1.00 15.23 C ATOM 1322 CE1 PHE A 90 13.768 -24.460 -5.313 1.00 2.41 C ATOM 1323 CE2 PHE A 90 15.458 -26.040 -5.916 1.00 0.34 C ATOM 1324 CZ PHE A 90 15.089 -24.864 -5.293 1.00 13.45 C ATOM 0 H PHE A 90 10.950 -29.297 -7.961 1.00 10.44 H new ATOM 0 HA PHE A 90 11.798 -28.344 -5.471 1.00 21.32 H new ATOM 0 HB2 PHE A 90 12.650 -27.969 -7.935 1.00 4.44 H new ATOM 0 HB3 PHE A 90 11.545 -26.609 -7.932 1.00 4.44 H new ATOM 0 HD1 PHE A 90 11.790 -24.911 -5.971 1.00 71.12 H new ATOM 0 HD2 PHE A 90 14.802 -27.726 -7.047 1.00 15.23 H new ATOM 0 HE1 PHE A 90 13.476 -23.542 -4.825 1.00 2.41 H new ATOM 0 HE2 PHE A 90 16.490 -26.359 -5.900 1.00 0.34 H new ATOM 0 HZ PHE A 90 15.832 -24.261 -4.791 1.00 13.45 H new ATOM 1334 N LYS A 91 9.050 -26.965 -6.620 1.00 74.20 N ATOM 1335 CA LYS A 91 7.923 -26.111 -6.263 1.00 72.43 C ATOM 1336 C LYS A 91 7.428 -26.424 -4.855 1.00 2.54 C ATOM 1337 O LYS A 91 7.015 -25.528 -4.119 1.00 52.31 O ATOM 1338 CB LYS A 91 6.782 -26.291 -7.267 1.00 70.44 C ATOM 1339 CG LYS A 91 7.145 -25.873 -8.682 1.00 14.54 C ATOM 1340 CD LYS A 91 6.138 -26.394 -9.693 1.00 55.51 C ATOM 1341 CE LYS A 91 4.769 -25.760 -9.494 1.00 42.13 C ATOM 1342 NZ LYS A 91 3.902 -26.581 -8.605 1.00 13.32 N ATOM 0 H LYS A 91 8.942 -27.455 -7.508 1.00 74.20 H new ATOM 0 HA LYS A 91 8.262 -25.075 -6.289 1.00 72.43 H new ATOM 0 HB2 LYS A 91 6.476 -27.337 -7.273 1.00 70.44 H new ATOM 0 HB3 LYS A 91 5.922 -25.710 -6.935 1.00 70.44 H new ATOM 0 HG2 LYS A 91 7.191 -24.786 -8.741 1.00 14.54 H new ATOM 0 HG3 LYS A 91 8.138 -26.248 -8.930 1.00 14.54 H new ATOM 0 HD2 LYS A 91 6.493 -26.186 -10.702 1.00 55.51 H new ATOM 0 HD3 LYS A 91 6.055 -27.477 -9.601 1.00 55.51 H new ATOM 0 HE2 LYS A 91 4.888 -24.765 -9.066 1.00 42.13 H new ATOM 0 HE3 LYS A 91 4.282 -25.635 -10.461 1.00 42.13 H new ATOM 0 HZ1 LYS A 91 3.125 -26.992 -9.161 1.00 13.32 H new ATOM 0 HZ2 LYS A 91 4.465 -27.345 -8.180 1.00 13.32 H new ATOM 0 HZ3 LYS A 91 3.509 -25.981 -7.852 1.00 13.32 H new ATOM 1356 N ALA A 92 7.475 -27.699 -4.485 1.00 72.30 N ATOM 1357 CA ALA A 92 7.035 -28.128 -3.163 1.00 72.33 C ATOM 1358 C ALA A 92 7.921 -27.538 -2.071 1.00 72.34 C ATOM 1359 O ALA A 92 7.447 -27.210 -0.984 1.00 53.24 O ATOM 1360 CB ALA A 92 7.028 -29.647 -3.077 1.00 30.43 C ATOM 0 H ALA A 92 7.813 -28.453 -5.082 1.00 72.30 H new ATOM 0 HA ALA A 92 6.020 -27.761 -3.008 1.00 72.33 H new ATOM 0 HB1 ALA A 92 6.698 -29.954 -2.085 1.00 30.43 H new ATOM 0 HB2 ALA A 92 6.348 -30.051 -3.827 1.00 30.43 H new ATOM 0 HB3 ALA A 92 8.034 -30.026 -3.258 1.00 30.43 H new ATOM 1366 N ALA A 93 9.210 -27.407 -2.368 1.00 74.30 N ATOM 1367 CA ALA A 93 10.161 -26.856 -1.412 1.00 3.43 C ATOM 1368 C ALA A 93 9.840 -25.399 -1.096 1.00 2.31 C ATOM 1369 O ALA A 93 9.632 -25.036 0.061 1.00 20.15 O ATOM 1370 CB ALA A 93 11.580 -26.981 -1.947 1.00 21.33 C ATOM 0 H ALA A 93 9.619 -27.675 -3.263 1.00 74.30 H new ATOM 0 HA ALA A 93 10.081 -27.428 -0.487 1.00 3.43 H new ATOM 0 HB1 ALA A 93 12.280 -26.565 -1.222 1.00 21.33 H new ATOM 0 HB2 ALA A 93 11.814 -28.032 -2.116 1.00 21.33 H new ATOM 0 HB3 ALA A 93 11.664 -26.435 -2.887 1.00 21.33 H new ATOM 1376 N ALA A 94 9.802 -24.568 -2.132 1.00 45.24 N ATOM 1377 CA ALA A 94 9.505 -23.151 -1.965 1.00 5.40 C ATOM 1378 C ALA A 94 8.219 -22.949 -1.171 1.00 24.32 C ATOM 1379 O ALA A 94 8.186 -22.179 -0.211 1.00 34.32 O ATOM 1380 CB ALA A 94 9.403 -22.469 -3.321 1.00 74.14 C ATOM 0 H ALA A 94 9.973 -24.852 -3.097 1.00 45.24 H new ATOM 0 HA ALA A 94 10.322 -22.698 -1.404 1.00 5.40 H new ATOM 0 HB1 ALA A 94 9.181 -21.411 -3.180 1.00 74.14 H new ATOM 0 HB2 ALA A 94 10.349 -22.574 -3.853 1.00 74.14 H new ATOM 0 HB3 ALA A 94 8.606 -22.933 -3.903 1.00 74.14 H new ATOM 1386 N ARG A 95 7.163 -23.646 -1.578 1.00 0.43 N ATOM 1387 CA ARG A 95 5.874 -23.541 -0.905 1.00 31.32 C ATOM 1388 C ARG A 95 5.955 -24.094 0.515 1.00 25.30 C ATOM 1389 O ARG A 95 5.312 -23.580 1.430 1.00 5.22 O ATOM 1390 CB ARG A 95 4.800 -24.292 -1.695 1.00 0.42 C ATOM 1391 CG ARG A 95 3.407 -24.165 -1.100 1.00 71.44 C ATOM 1392 CD ARG A 95 2.417 -25.084 -1.800 1.00 25.33 C ATOM 1393 NE ARG A 95 1.033 -24.730 -1.498 1.00 3.42 N ATOM 1394 CZ ARG A 95 -0.011 -25.463 -1.868 1.00 3.22 C ATOM 1395 NH1 ARG A 95 0.171 -26.585 -2.549 1.00 65.34 N ATOM 1396 NH2 ARG A 95 -1.240 -25.074 -1.555 1.00 53.24 N ATOM 0 H ARG A 95 7.175 -24.289 -2.370 1.00 0.43 H new ATOM 0 HA ARG A 95 5.606 -22.486 -0.851 1.00 31.32 H new ATOM 0 HB2 ARG A 95 4.785 -23.917 -2.718 1.00 0.42 H new ATOM 0 HB3 ARG A 95 5.069 -25.347 -1.746 1.00 0.42 H new ATOM 0 HG2 ARG A 95 3.440 -24.406 -0.037 1.00 71.44 H new ATOM 0 HG3 ARG A 95 3.068 -23.132 -1.182 1.00 71.44 H new ATOM 0 HD2 ARG A 95 2.577 -25.035 -2.877 1.00 25.33 H new ATOM 0 HD3 ARG A 95 2.602 -26.114 -1.496 1.00 25.33 H new ATOM 0 HE ARG A 95 0.858 -23.873 -0.974 1.00 3.42 H new ATOM 0 HH11 ARG A 95 1.115 -26.888 -2.790 1.00 65.34 H new ATOM 0 HH12 ARG A 95 -0.633 -27.146 -2.832 1.00 65.34 H new ATOM 0 HH21 ARG A 95 -1.384 -24.211 -1.030 1.00 53.24 H new ATOM 0 HH22 ARG A 95 -2.041 -25.637 -1.840 1.00 53.24 H new ATOM 1410 N ASP A 96 6.749 -25.145 0.690 1.00 3.14 N ATOM 1411 CA ASP A 96 6.916 -25.768 1.998 1.00 14.25 C ATOM 1412 C ASP A 96 7.471 -24.769 3.009 1.00 31.12 C ATOM 1413 O ASP A 96 7.003 -24.695 4.145 1.00 72.22 O ATOM 1414 CB ASP A 96 7.844 -26.979 1.896 1.00 4.41 C ATOM 1415 CG ASP A 96 8.125 -27.609 3.246 1.00 1.41 C ATOM 1416 OD1 ASP A 96 9.212 -28.201 3.410 1.00 25.03 O ATOM 1417 OD2 ASP A 96 7.258 -27.509 4.139 1.00 50.31 O ATOM 0 H ASP A 96 7.287 -25.583 -0.058 1.00 3.14 H new ATOM 0 HA ASP A 96 5.936 -26.100 2.342 1.00 14.25 H new ATOM 0 HB2 ASP A 96 7.395 -27.723 1.238 1.00 4.41 H new ATOM 0 HB3 ASP A 96 8.785 -26.674 1.438 1.00 4.41 H new ATOM 1422 N ALA A 97 8.472 -24.004 2.588 1.00 3.40 N ATOM 1423 CA ALA A 97 9.091 -23.009 3.456 1.00 53.02 C ATOM 1424 C ALA A 97 8.117 -21.881 3.779 1.00 33.13 C ATOM 1425 O ALA A 97 8.101 -21.362 4.895 1.00 70.24 O ATOM 1426 CB ALA A 97 10.349 -22.452 2.807 1.00 24.22 C ATOM 0 H ALA A 97 8.872 -24.054 1.651 1.00 3.40 H new ATOM 0 HA ALA A 97 9.364 -23.498 4.391 1.00 53.02 H new ATOM 0 HB1 ALA A 97 10.801 -21.710 3.466 1.00 24.22 H new ATOM 0 HB2 ALA A 97 11.057 -23.262 2.632 1.00 24.22 H new ATOM 0 HB3 ALA A 97 10.092 -21.984 1.857 1.00 24.22 H new ATOM 1432 N GLY A 98 7.305 -21.505 2.795 1.00 21.52 N ATOM 1433 CA GLY A 98 6.340 -20.440 2.995 1.00 31.55 C ATOM 1434 C GLY A 98 6.460 -19.346 1.954 1.00 51.22 C ATOM 1435 O GLY A 98 6.265 -18.169 2.256 1.00 44.25 O ATOM 0 H GLY A 98 7.299 -21.919 1.863 1.00 21.52 H new ATOM 0 HA2 GLY A 98 5.333 -20.856 2.966 1.00 31.55 H new ATOM 0 HA3 GLY A 98 6.478 -20.010 3.987 1.00 31.55 H new ATOM 1439 N ALA A 99 6.783 -19.734 0.724 1.00 11.25 N ATOM 1440 CA ALA A 99 6.928 -18.777 -0.365 1.00 44.32 C ATOM 1441 C ALA A 99 5.697 -18.778 -1.265 1.00 64.11 C ATOM 1442 O ALA A 99 5.107 -19.827 -1.526 1.00 53.21 O ATOM 1443 CB ALA A 99 8.178 -19.086 -1.176 1.00 71.43 C ATOM 0 H ALA A 99 6.949 -20.705 0.458 1.00 11.25 H new ATOM 0 HA ALA A 99 7.027 -17.782 0.069 1.00 44.32 H new ATOM 0 HB1 ALA A 99 8.274 -18.363 -1.986 1.00 71.43 H new ATOM 0 HB2 ALA A 99 9.054 -19.026 -0.531 1.00 71.43 H new ATOM 0 HB3 ALA A 99 8.102 -20.090 -1.593 1.00 71.43 H new ATOM 1449 N THR A 100 5.314 -17.596 -1.737 1.00 53.04 N ATOM 1450 CA THR A 100 4.152 -17.461 -2.607 1.00 12.34 C ATOM 1451 C THR A 100 4.418 -18.069 -3.979 1.00 32.02 C ATOM 1452 O THR A 100 3.820 -19.079 -4.348 1.00 15.34 O ATOM 1453 CB THR A 100 3.750 -15.984 -2.781 1.00 72.04 C ATOM 1454 OG1 THR A 100 3.438 -15.407 -1.508 1.00 63.14 O ATOM 1455 CG2 THR A 100 2.551 -15.856 -3.709 1.00 40.31 C ATOM 0 H THR A 100 5.791 -16.718 -1.532 1.00 53.04 H new ATOM 0 HA THR A 100 3.334 -17.999 -2.128 1.00 12.34 H new ATOM 0 HB THR A 100 4.592 -15.451 -3.224 1.00 72.04 H new ATOM 0 HG1 THR A 100 3.035 -14.524 -1.639 1.00 63.14 H new ATOM 0 HG21 THR A 100 2.285 -14.804 -3.817 1.00 40.31 H new ATOM 0 HG22 THR A 100 2.801 -16.269 -4.686 1.00 40.31 H new ATOM 0 HG23 THR A 100 1.706 -16.403 -3.290 1.00 40.31 H new ATOM 1463 N GLY A 101 5.321 -17.448 -4.732 1.00 14.33 N ATOM 1464 CA GLY A 101 5.650 -17.943 -6.055 1.00 63.23 C ATOM 1465 C GLY A 101 7.146 -18.036 -6.284 1.00 31.14 C ATOM 1466 O GLY A 101 7.936 -17.557 -5.470 1.00 14.02 O ATOM 0 H GLY A 101 5.830 -16.611 -4.449 1.00 14.33 H new ATOM 0 HA2 GLY A 101 5.203 -18.927 -6.193 1.00 63.23 H new ATOM 0 HA3 GLY A 101 5.211 -17.285 -6.805 1.00 63.23 H new ATOM 1470 N TRP A 102 7.536 -18.655 -7.392 1.00 30.00 N ATOM 1471 CA TRP A 102 8.948 -18.811 -7.724 1.00 13.32 C ATOM 1472 C TRP A 102 9.184 -18.590 -9.214 1.00 22.42 C ATOM 1473 O TRP A 102 8.240 -18.566 -10.004 1.00 42.21 O ATOM 1474 CB TRP A 102 9.438 -20.201 -7.317 1.00 60.21 C ATOM 1475 CG TRP A 102 9.065 -21.273 -8.297 1.00 4.52 C ATOM 1476 CD1 TRP A 102 7.927 -21.335 -9.049 1.00 64.22 C ATOM 1477 CD2 TRP A 102 9.832 -22.435 -8.628 1.00 64.20 C ATOM 1478 NE1 TRP A 102 7.941 -22.467 -9.828 1.00 73.12 N ATOM 1479 CE2 TRP A 102 9.099 -23.158 -9.589 1.00 72.31 C ATOM 1480 CE3 TRP A 102 11.068 -22.935 -8.208 1.00 50.12 C ATOM 1481 CZ2 TRP A 102 9.561 -24.353 -10.134 1.00 23.33 C ATOM 1482 CZ3 TRP A 102 11.525 -24.121 -8.749 1.00 65.24 C ATOM 1483 CH2 TRP A 102 10.774 -24.819 -9.704 1.00 62.33 C ATOM 0 H TRP A 102 6.895 -19.057 -8.076 1.00 30.00 H new ATOM 0 HA TRP A 102 9.511 -18.059 -7.171 1.00 13.32 H new ATOM 0 HB2 TRP A 102 10.522 -20.179 -7.209 1.00 60.21 H new ATOM 0 HB3 TRP A 102 9.025 -20.452 -6.340 1.00 60.21 H new ATOM 0 HD1 TRP A 102 7.133 -20.603 -9.034 1.00 64.22 H new ATOM 0 HE1 TRP A 102 7.207 -22.747 -10.479 1.00 73.12 H new ATOM 0 HE3 TRP A 102 11.655 -22.404 -7.474 1.00 50.12 H new ATOM 0 HZ2 TRP A 102 8.983 -24.893 -10.870 1.00 23.33 H new ATOM 0 HZ3 TRP A 102 12.478 -24.517 -8.430 1.00 65.24 H new ATOM 0 HH2 TRP A 102 11.160 -25.743 -10.109 1.00 62.33 H new ATOM 1494 N ILE A 103 10.448 -18.431 -9.591 1.00 23.03 N ATOM 1495 CA ILE A 103 10.807 -18.214 -10.987 1.00 22.33 C ATOM 1496 C ILE A 103 12.122 -18.907 -11.330 1.00 54.23 C ATOM 1497 O ILE A 103 12.854 -19.344 -10.443 1.00 41.24 O ATOM 1498 CB ILE A 103 10.931 -16.713 -11.310 1.00 30.54 C ATOM 1499 CG1 ILE A 103 11.367 -15.936 -10.066 1.00 63.21 C ATOM 1500 CG2 ILE A 103 9.611 -16.175 -11.841 1.00 72.51 C ATOM 1501 CD1 ILE A 103 10.211 -15.458 -9.216 1.00 3.02 C ATOM 0 H ILE A 103 11.241 -18.448 -8.949 1.00 23.03 H new ATOM 0 HA ILE A 103 10.005 -18.641 -11.589 1.00 22.33 H new ATOM 0 HB ILE A 103 11.690 -16.584 -12.081 1.00 30.54 H new ATOM 0 HG12 ILE A 103 12.015 -16.570 -9.460 1.00 63.21 H new ATOM 0 HG13 ILE A 103 11.961 -15.076 -10.375 1.00 63.21 H new ATOM 0 HG21 ILE A 103 9.714 -15.113 -12.065 1.00 72.51 H new ATOM 0 HG22 ILE A 103 9.338 -16.712 -12.749 1.00 72.51 H new ATOM 0 HG23 ILE A 103 8.833 -16.313 -11.090 1.00 72.51 H new ATOM 0 HD11 ILE A 103 10.595 -14.915 -8.352 1.00 3.02 H new ATOM 0 HD12 ILE A 103 9.574 -14.798 -9.805 1.00 3.02 H new ATOM 0 HD13 ILE A 103 9.630 -16.315 -8.877 1.00 3.02 H new ATOM 1513 N GLU A 104 12.414 -19.001 -12.624 1.00 20.33 N ATOM 1514 CA GLU A 104 13.641 -19.640 -13.084 1.00 24.00 C ATOM 1515 C GLU A 104 14.616 -18.607 -13.642 1.00 41.11 C ATOM 1516 O GLU A 104 14.256 -17.792 -14.491 1.00 51.44 O ATOM 1517 CB GLU A 104 13.327 -20.690 -14.152 1.00 11.31 C ATOM 1518 CG GLU A 104 12.319 -20.221 -15.188 1.00 11.01 C ATOM 1519 CD GLU A 104 12.731 -20.574 -16.604 1.00 11.31 C ATOM 1520 OE1 GLU A 104 13.601 -19.873 -17.161 1.00 40.23 O ATOM 1521 OE2 GLU A 104 12.182 -21.551 -17.154 1.00 65.55 O ATOM 0 H GLU A 104 11.818 -18.643 -13.371 1.00 20.33 H new ATOM 0 HA GLU A 104 14.107 -20.130 -12.229 1.00 24.00 H new ATOM 0 HB2 GLU A 104 14.251 -20.970 -14.657 1.00 11.31 H new ATOM 0 HB3 GLU A 104 12.945 -21.588 -13.666 1.00 11.31 H new ATOM 0 HG2 GLU A 104 11.348 -20.668 -14.974 1.00 11.01 H new ATOM 0 HG3 GLU A 104 12.197 -19.141 -15.108 1.00 11.01 H new ATOM 1528 N LYS A 105 15.853 -18.647 -13.158 1.00 32.10 N ATOM 1529 CA LYS A 105 16.881 -17.716 -13.607 1.00 64.42 C ATOM 1530 C LYS A 105 17.382 -18.089 -14.999 1.00 51.11 C ATOM 1531 O LYS A 105 17.218 -19.218 -15.462 1.00 44.12 O ATOM 1532 CB LYS A 105 18.051 -17.701 -12.620 1.00 71.52 C ATOM 1533 CG LYS A 105 18.125 -16.436 -11.784 1.00 12.31 C ATOM 1534 CD LYS A 105 18.506 -16.740 -10.345 1.00 0.42 C ATOM 1535 CE LYS A 105 19.865 -17.417 -10.259 1.00 61.14 C ATOM 1536 NZ LYS A 105 20.811 -16.656 -9.397 1.00 31.44 N ATOM 0 H LYS A 105 16.168 -19.315 -12.454 1.00 32.10 H new ATOM 0 HA LYS A 105 16.439 -16.721 -13.653 1.00 64.42 H new ATOM 0 HB2 LYS A 105 17.966 -18.561 -11.956 1.00 71.52 H new ATOM 0 HB3 LYS A 105 18.983 -17.816 -13.173 1.00 71.52 H new ATOM 0 HG2 LYS A 105 18.856 -15.754 -12.218 1.00 12.31 H new ATOM 0 HG3 LYS A 105 17.161 -15.927 -11.806 1.00 12.31 H new ATOM 0 HD2 LYS A 105 18.522 -15.815 -9.769 1.00 0.42 H new ATOM 0 HD3 LYS A 105 17.749 -17.383 -9.895 1.00 0.42 H new ATOM 0 HE2 LYS A 105 19.744 -18.425 -9.863 1.00 61.14 H new ATOM 0 HE3 LYS A 105 20.285 -17.516 -11.260 1.00 61.14 H new ATOM 0 HZ1 LYS A 105 21.512 -17.308 -8.991 1.00 31.44 H new ATOM 0 HZ2 LYS A 105 21.298 -15.935 -9.968 1.00 31.44 H new ATOM 0 HZ3 LYS A 105 20.285 -16.192 -8.629 1.00 31.44 H new ATOM 1550 N PRO A 106 18.008 -17.119 -15.683 1.00 32.51 N ATOM 1551 CA PRO A 106 18.208 -15.772 -15.142 1.00 54.31 C ATOM 1552 C PRO A 106 16.903 -14.990 -15.037 1.00 13.12 C ATOM 1553 O PRO A 106 15.844 -15.474 -15.439 1.00 23.01 O ATOM 1554 CB PRO A 106 19.143 -15.116 -16.161 1.00 2.13 C ATOM 1555 CG PRO A 106 18.893 -15.850 -17.432 1.00 62.55 C ATOM 1556 CD PRO A 106 18.568 -17.264 -17.037 1.00 20.30 C ATOM 0 HA PRO A 106 18.608 -15.795 -14.128 1.00 54.31 H new ATOM 0 HB2 PRO A 106 18.928 -14.053 -16.269 1.00 2.13 H new ATOM 0 HB3 PRO A 106 20.185 -15.200 -15.854 1.00 2.13 H new ATOM 0 HG2 PRO A 106 18.069 -15.401 -17.986 1.00 62.55 H new ATOM 0 HG3 PRO A 106 19.769 -15.817 -18.080 1.00 62.55 H new ATOM 0 HD2 PRO A 106 17.852 -17.718 -17.722 1.00 20.30 H new ATOM 0 HD3 PRO A 106 19.456 -17.896 -17.039 1.00 20.30 H new ATOM 1564 N ILE A 107 16.986 -13.780 -14.495 1.00 15.34 N ATOM 1565 CA ILE A 107 15.811 -12.931 -14.339 1.00 32.15 C ATOM 1566 C ILE A 107 15.871 -11.731 -15.277 1.00 51.05 C ATOM 1567 O ILE A 107 16.933 -11.145 -15.485 1.00 45.02 O ATOM 1568 CB ILE A 107 15.668 -12.428 -12.890 1.00 32.52 C ATOM 1569 CG1 ILE A 107 15.781 -13.597 -11.908 1.00 54.31 C ATOM 1570 CG2 ILE A 107 14.342 -11.704 -12.709 1.00 5.30 C ATOM 1571 CD1 ILE A 107 14.775 -14.698 -12.161 1.00 61.04 C ATOM 0 H ILE A 107 17.854 -13.365 -14.157 1.00 15.34 H new ATOM 0 HA ILE A 107 14.945 -13.543 -14.590 1.00 32.15 H new ATOM 0 HB ILE A 107 16.475 -11.725 -12.684 1.00 32.52 H new ATOM 0 HG12 ILE A 107 16.786 -14.014 -11.966 1.00 54.31 H new ATOM 0 HG13 ILE A 107 15.650 -13.222 -10.893 1.00 54.31 H new ATOM 0 HG21 ILE A 107 14.256 -11.355 -11.680 1.00 5.30 H new ATOM 0 HG22 ILE A 107 14.297 -10.851 -13.387 1.00 5.30 H new ATOM 0 HG23 ILE A 107 13.522 -12.387 -12.930 1.00 5.30 H new ATOM 0 HD11 ILE A 107 14.913 -15.493 -11.428 1.00 61.04 H new ATOM 0 HD12 ILE A 107 13.766 -14.296 -12.074 1.00 61.04 H new ATOM 0 HD13 ILE A 107 14.920 -15.100 -13.164 1.00 61.04 H new ATOM 1583 N ASP A 108 14.723 -11.370 -15.841 1.00 4.43 N ATOM 1584 CA ASP A 108 14.644 -10.237 -16.756 1.00 1.12 C ATOM 1585 C ASP A 108 14.119 -8.996 -16.040 1.00 63.03 C ATOM 1586 O ASP A 108 13.431 -9.081 -15.023 1.00 55.53 O ATOM 1587 CB ASP A 108 13.742 -10.576 -17.944 1.00 1.44 C ATOM 1588 CG ASP A 108 14.530 -10.841 -19.211 1.00 72.25 C ATOM 1589 OD1 ASP A 108 15.312 -11.815 -19.232 1.00 33.14 O ATOM 1590 OD2 ASP A 108 14.364 -10.076 -20.184 1.00 12.22 O ATOM 0 H ASP A 108 13.835 -11.845 -15.681 1.00 4.43 H new ATOM 0 HA ASP A 108 15.649 -10.025 -17.122 1.00 1.12 H new ATOM 0 HB2 ASP A 108 13.142 -11.453 -17.702 1.00 1.44 H new ATOM 0 HB3 ASP A 108 13.048 -9.753 -18.116 1.00 1.44 H new ATOM 1595 N PRO A 109 14.452 -7.815 -16.582 1.00 5.02 N ATOM 1596 CA PRO A 109 14.026 -6.534 -16.011 1.00 52.11 C ATOM 1597 C PRO A 109 12.528 -6.297 -16.174 1.00 3.13 C ATOM 1598 O PRO A 109 11.899 -5.646 -15.341 1.00 11.21 O ATOM 1599 CB PRO A 109 14.821 -5.504 -16.818 1.00 12.05 C ATOM 1600 CG PRO A 109 15.110 -6.179 -18.114 1.00 12.03 C ATOM 1601 CD PRO A 109 15.271 -7.639 -17.793 1.00 71.33 C ATOM 0 HA PRO A 109 14.207 -6.486 -14.937 1.00 52.11 H new ATOM 0 HB2 PRO A 109 14.247 -4.590 -16.967 1.00 12.05 H new ATOM 0 HB3 PRO A 109 15.740 -5.223 -16.304 1.00 12.05 H new ATOM 0 HG2 PRO A 109 14.299 -6.023 -18.825 1.00 12.03 H new ATOM 0 HG3 PRO A 109 16.015 -5.777 -18.570 1.00 12.03 H new ATOM 0 HD2 PRO A 109 14.922 -8.271 -18.610 1.00 71.33 H new ATOM 0 HD3 PRO A 109 16.314 -7.898 -17.614 1.00 71.33 H new ATOM 1609 N GLY A 110 11.963 -6.831 -17.252 1.00 53.44 N ATOM 1610 CA GLY A 110 10.543 -6.666 -17.504 1.00 0.01 C ATOM 1611 C GLY A 110 9.689 -7.525 -16.592 1.00 43.31 C ATOM 1612 O GLY A 110 8.618 -7.104 -16.155 1.00 73.43 O ATOM 0 H GLY A 110 12.463 -7.375 -17.955 1.00 53.44 H new ATOM 0 HA2 GLY A 110 10.273 -5.619 -17.370 1.00 0.01 H new ATOM 0 HA3 GLY A 110 10.329 -6.920 -18.542 1.00 0.01 H new ATOM 1616 N VAL A 111 10.163 -8.733 -16.305 1.00 4.24 N ATOM 1617 CA VAL A 111 9.436 -9.654 -15.439 1.00 51.43 C ATOM 1618 C VAL A 111 9.574 -9.256 -13.974 1.00 55.41 C ATOM 1619 O VAL A 111 8.589 -9.216 -13.235 1.00 51.40 O ATOM 1620 CB VAL A 111 9.933 -11.101 -15.616 1.00 11.34 C ATOM 1621 CG1 VAL A 111 9.155 -12.046 -14.713 1.00 71.44 C ATOM 1622 CG2 VAL A 111 9.822 -11.528 -17.071 1.00 43.15 C ATOM 0 H VAL A 111 11.047 -9.097 -16.660 1.00 4.24 H new ATOM 0 HA VAL A 111 8.387 -9.600 -15.729 1.00 51.43 H new ATOM 0 HB VAL A 111 10.983 -11.144 -15.328 1.00 11.34 H new ATOM 0 HG11 VAL A 111 9.520 -13.064 -14.851 1.00 71.44 H new ATOM 0 HG12 VAL A 111 9.291 -11.750 -13.673 1.00 71.44 H new ATOM 0 HG13 VAL A 111 8.096 -12.002 -14.967 1.00 71.44 H new ATOM 0 HG21 VAL A 111 10.177 -12.553 -17.178 1.00 43.15 H new ATOM 0 HG22 VAL A 111 8.781 -11.470 -17.389 1.00 43.15 H new ATOM 0 HG23 VAL A 111 10.428 -10.867 -17.691 1.00 43.15 H new ATOM 1632 N LEU A 112 10.801 -8.961 -13.560 1.00 32.24 N ATOM 1633 CA LEU A 112 11.068 -8.565 -12.181 1.00 44.04 C ATOM 1634 C LEU A 112 10.221 -7.360 -11.787 1.00 14.02 C ATOM 1635 O LEU A 112 9.532 -7.379 -10.767 1.00 31.55 O ATOM 1636 CB LEU A 112 12.552 -8.239 -12.003 1.00 23.44 C ATOM 1637 CG LEU A 112 12.986 -7.836 -10.593 1.00 12.31 C ATOM 1638 CD1 LEU A 112 12.713 -6.359 -10.353 1.00 45.21 C ATOM 1639 CD2 LEU A 112 12.274 -8.687 -9.552 1.00 30.13 C ATOM 0 H LEU A 112 11.626 -8.988 -14.159 1.00 32.24 H new ATOM 0 HA LEU A 112 10.804 -9.399 -11.531 1.00 44.04 H new ATOM 0 HB2 LEU A 112 13.134 -9.110 -12.306 1.00 23.44 H new ATOM 0 HB3 LEU A 112 12.810 -7.430 -12.686 1.00 23.44 H new ATOM 0 HG LEU A 112 14.059 -8.007 -10.501 1.00 12.31 H new ATOM 0 HD11 LEU A 112 13.028 -6.090 -9.345 1.00 45.21 H new ATOM 0 HD12 LEU A 112 13.269 -5.764 -11.078 1.00 45.21 H new ATOM 0 HD13 LEU A 112 11.646 -6.163 -10.464 1.00 45.21 H new ATOM 0 HD21 LEU A 112 12.595 -8.386 -8.555 1.00 30.13 H new ATOM 0 HD22 LEU A 112 11.197 -8.548 -9.644 1.00 30.13 H new ATOM 0 HD23 LEU A 112 12.519 -9.737 -9.711 1.00 30.13 H new ATOM 1651 N VAL A 113 10.274 -6.312 -12.603 1.00 61.33 N ATOM 1652 CA VAL A 113 9.509 -5.099 -12.342 1.00 34.34 C ATOM 1653 C VAL A 113 8.010 -5.376 -12.382 1.00 51.23 C ATOM 1654 O VAL A 113 7.281 -5.038 -11.450 1.00 43.52 O ATOM 1655 CB VAL A 113 9.843 -3.994 -13.360 1.00 44.33 C ATOM 1656 CG1 VAL A 113 8.991 -2.759 -13.108 1.00 60.33 C ATOM 1657 CG2 VAL A 113 11.324 -3.650 -13.305 1.00 42.41 C ATOM 0 H VAL A 113 10.840 -6.279 -13.451 1.00 61.33 H new ATOM 0 HA VAL A 113 9.787 -4.758 -11.344 1.00 34.34 H new ATOM 0 HB VAL A 113 9.616 -4.364 -14.360 1.00 44.33 H new ATOM 0 HG11 VAL A 113 9.242 -1.989 -13.838 1.00 60.33 H new ATOM 0 HG12 VAL A 113 7.937 -3.019 -13.202 1.00 60.33 H new ATOM 0 HG13 VAL A 113 9.183 -2.383 -12.103 1.00 60.33 H new ATOM 0 HG21 VAL A 113 11.543 -2.867 -14.031 1.00 42.41 H new ATOM 0 HG22 VAL A 113 11.579 -3.299 -12.305 1.00 42.41 H new ATOM 0 HG23 VAL A 113 11.913 -4.537 -13.539 1.00 42.41 H new ATOM 1667 N GLU A 114 7.557 -5.993 -13.469 1.00 32.31 N ATOM 1668 CA GLU A 114 6.144 -6.315 -13.631 1.00 12.13 C ATOM 1669 C GLU A 114 5.626 -7.109 -12.435 1.00 63.41 C ATOM 1670 O GLU A 114 4.482 -6.941 -12.012 1.00 31.14 O ATOM 1671 CB GLU A 114 5.923 -7.110 -14.919 1.00 41.23 C ATOM 1672 CG GLU A 114 5.851 -6.242 -16.165 1.00 31.42 C ATOM 1673 CD GLU A 114 4.506 -5.561 -16.324 1.00 73.00 C ATOM 1674 OE1 GLU A 114 4.142 -5.226 -17.470 1.00 53.14 O ATOM 1675 OE2 GLU A 114 3.817 -5.363 -15.301 1.00 72.32 O ATOM 0 H GLU A 114 8.147 -6.280 -14.250 1.00 32.31 H new ATOM 0 HA GLU A 114 5.589 -5.379 -13.691 1.00 12.13 H new ATOM 0 HB2 GLU A 114 6.733 -7.831 -15.035 1.00 41.23 H new ATOM 0 HB3 GLU A 114 4.999 -7.681 -14.830 1.00 41.23 H new ATOM 0 HG2 GLU A 114 6.634 -5.485 -16.122 1.00 31.42 H new ATOM 0 HG3 GLU A 114 6.049 -6.856 -17.043 1.00 31.42 H new ATOM 1682 N LEU A 115 6.476 -7.976 -11.896 1.00 5.14 N ATOM 1683 CA LEU A 115 6.106 -8.798 -10.749 1.00 3.03 C ATOM 1684 C LEU A 115 5.800 -7.930 -9.532 1.00 45.24 C ATOM 1685 O LEU A 115 4.916 -8.247 -8.737 1.00 4.15 O ATOM 1686 CB LEU A 115 7.230 -9.782 -10.418 1.00 11.24 C ATOM 1687 CG LEU A 115 7.219 -11.099 -11.194 1.00 42.14 C ATOM 1688 CD1 LEU A 115 8.471 -11.907 -10.891 1.00 61.44 C ATOM 1689 CD2 LEU A 115 5.970 -11.903 -10.864 1.00 40.31 C ATOM 0 H LEU A 115 7.426 -8.128 -12.235 1.00 5.14 H new ATOM 0 HA LEU A 115 5.207 -9.357 -11.009 1.00 3.03 H new ATOM 0 HB2 LEU A 115 8.184 -9.286 -10.597 1.00 11.24 H new ATOM 0 HB3 LEU A 115 7.184 -10.010 -9.353 1.00 11.24 H new ATOM 0 HG LEU A 115 7.208 -10.870 -12.260 1.00 42.14 H new ATOM 0 HD11 LEU A 115 8.446 -12.841 -11.452 1.00 61.44 H new ATOM 0 HD12 LEU A 115 9.352 -11.334 -11.179 1.00 61.44 H new ATOM 0 HD13 LEU A 115 8.514 -12.126 -9.824 1.00 61.44 H new ATOM 0 HD21 LEU A 115 5.980 -12.837 -11.426 1.00 40.31 H new ATOM 0 HD22 LEU A 115 5.950 -12.122 -9.796 1.00 40.31 H new ATOM 0 HD23 LEU A 115 5.085 -11.327 -11.133 1.00 40.31 H new ATOM 1701 N VAL A 116 6.536 -6.831 -9.396 1.00 23.12 N ATOM 1702 CA VAL A 116 6.342 -5.915 -8.279 1.00 13.34 C ATOM 1703 C VAL A 116 5.225 -4.920 -8.572 1.00 53.43 C ATOM 1704 O VAL A 116 4.474 -4.532 -7.678 1.00 0.24 O ATOM 1705 CB VAL A 116 7.633 -5.140 -7.957 1.00 3.31 C ATOM 1706 CG1 VAL A 116 7.474 -4.346 -6.669 1.00 35.40 C ATOM 1707 CG2 VAL A 116 8.816 -6.092 -7.863 1.00 41.21 C ATOM 0 H VAL A 116 7.272 -6.554 -10.046 1.00 23.12 H new ATOM 0 HA VAL A 116 6.067 -6.522 -7.416 1.00 13.34 H new ATOM 0 HB VAL A 116 7.825 -4.436 -8.767 1.00 3.31 H new ATOM 0 HG11 VAL A 116 8.397 -3.805 -6.459 1.00 35.40 H new ATOM 0 HG12 VAL A 116 6.654 -3.636 -6.778 1.00 35.40 H new ATOM 0 HG13 VAL A 116 7.257 -5.027 -5.846 1.00 35.40 H new ATOM 0 HG21 VAL A 116 9.720 -5.527 -7.635 1.00 41.21 H new ATOM 0 HG22 VAL A 116 8.634 -6.821 -7.073 1.00 41.21 H new ATOM 0 HG23 VAL A 116 8.942 -6.611 -8.813 1.00 41.21 H new ATOM 1717 N ALA A 117 5.121 -4.510 -9.832 1.00 74.24 N ATOM 1718 CA ALA A 117 4.093 -3.562 -10.245 1.00 44.01 C ATOM 1719 C ALA A 117 2.711 -4.019 -9.792 1.00 52.32 C ATOM 1720 O ALA A 117 1.986 -3.276 -9.128 1.00 63.42 O ATOM 1721 CB ALA A 117 4.122 -3.377 -11.755 1.00 51.01 C ATOM 0 H ALA A 117 5.736 -4.819 -10.585 1.00 74.24 H new ATOM 0 HA ALA A 117 4.304 -2.604 -9.769 1.00 44.01 H new ATOM 0 HB1 ALA A 117 3.349 -2.667 -12.049 1.00 51.01 H new ATOM 0 HB2 ALA A 117 5.098 -2.997 -12.056 1.00 51.01 H new ATOM 0 HB3 ALA A 117 3.939 -4.335 -12.242 1.00 51.01 H new ATOM 1727 N THR A 118 2.349 -5.245 -10.156 1.00 20.21 N ATOM 1728 CA THR A 118 1.052 -5.800 -9.789 1.00 24.24 C ATOM 1729 C THR A 118 0.797 -5.657 -8.293 1.00 13.23 C ATOM 1730 O THR A 118 -0.339 -5.448 -7.864 1.00 20.53 O ATOM 1731 CB THR A 118 0.948 -7.288 -10.175 1.00 50.55 C ATOM 1732 OG1 THR A 118 -0.356 -7.786 -9.857 1.00 70.11 O ATOM 1733 CG2 THR A 118 2.002 -8.111 -9.451 1.00 1.55 C ATOM 0 H THR A 118 2.936 -5.873 -10.705 1.00 20.21 H new ATOM 0 HA THR A 118 0.299 -5.236 -10.340 1.00 24.24 H new ATOM 0 HB THR A 118 1.118 -7.375 -11.248 1.00 50.55 H new ATOM 0 HG1 THR A 118 -0.415 -8.732 -10.107 1.00 70.11 H new ATOM 0 HG21 THR A 118 1.908 -9.158 -9.740 1.00 1.55 H new ATOM 0 HG22 THR A 118 2.994 -7.748 -9.719 1.00 1.55 H new ATOM 0 HG23 THR A 118 1.860 -8.018 -8.374 1.00 1.55 H new ATOM 1741 N LEU A 119 1.859 -5.769 -7.502 1.00 54.45 N ATOM 1742 CA LEU A 119 1.749 -5.650 -6.053 1.00 22.44 C ATOM 1743 C LEU A 119 1.671 -4.187 -5.630 1.00 4.11 C ATOM 1744 O LEU A 119 0.969 -3.841 -4.680 1.00 22.43 O ATOM 1745 CB LEU A 119 2.942 -6.326 -5.375 1.00 23.24 C ATOM 1746 CG LEU A 119 3.409 -7.644 -5.995 1.00 1.43 C ATOM 1747 CD1 LEU A 119 4.753 -8.060 -5.416 1.00 54.40 C ATOM 1748 CD2 LEU A 119 2.371 -8.734 -5.775 1.00 31.14 C ATOM 0 H LEU A 119 2.806 -5.942 -7.840 1.00 54.45 H new ATOM 0 HA LEU A 119 0.831 -6.148 -5.741 1.00 22.44 H new ATOM 0 HB2 LEU A 119 3.780 -5.629 -5.379 1.00 23.24 H new ATOM 0 HB3 LEU A 119 2.685 -6.509 -4.332 1.00 23.24 H new ATOM 0 HG LEU A 119 3.529 -7.496 -7.068 1.00 1.43 H new ATOM 0 HD11 LEU A 119 5.069 -9.000 -5.869 1.00 54.40 H new ATOM 0 HD12 LEU A 119 5.494 -7.289 -5.626 1.00 54.40 H new ATOM 0 HD13 LEU A 119 4.660 -8.190 -4.338 1.00 54.40 H new ATOM 0 HD21 LEU A 119 2.720 -9.665 -6.223 1.00 31.14 H new ATOM 0 HD22 LEU A 119 2.218 -8.881 -4.706 1.00 31.14 H new ATOM 0 HD23 LEU A 119 1.430 -8.439 -6.239 1.00 31.14 H new ATOM 1760 N SER A 120 2.396 -3.331 -6.343 1.00 52.15 N ATOM 1761 CA SER A 120 2.410 -1.904 -6.041 1.00 61.34 C ATOM 1762 C SER A 120 1.020 -1.299 -6.212 1.00 1.00 C ATOM 1763 O SER A 120 0.618 -0.419 -5.452 1.00 34.35 O ATOM 1764 CB SER A 120 3.409 -1.180 -6.946 1.00 52.01 C ATOM 1765 OG SER A 120 2.809 -0.812 -8.176 1.00 60.43 O ATOM 0 H SER A 120 2.981 -3.601 -7.134 1.00 52.15 H new ATOM 0 HA SER A 120 2.716 -1.780 -5.002 1.00 61.34 H new ATOM 0 HB2 SER A 120 3.784 -0.290 -6.440 1.00 52.01 H new ATOM 0 HB3 SER A 120 4.267 -1.825 -7.135 1.00 52.01 H new ATOM 0 HG SER A 120 2.455 -1.611 -8.619 1.00 60.43 H new ATOM 1771 N GLU A 121 0.292 -1.778 -7.216 1.00 42.52 N ATOM 1772 CA GLU A 121 -1.053 -1.283 -7.487 1.00 65.05 C ATOM 1773 C GLU A 121 -2.106 -2.270 -6.992 1.00 65.21 C ATOM 1774 O GLU A 121 -1.854 -3.467 -6.853 1.00 61.31 O ATOM 1775 CB GLU A 121 -1.236 -1.034 -8.986 1.00 63.31 C ATOM 1776 CG GLU A 121 -0.769 -2.189 -9.856 1.00 71.23 C ATOM 1777 CD GLU A 121 -1.612 -2.356 -11.105 1.00 73.24 C ATOM 1778 OE1 GLU A 121 -2.837 -2.122 -11.031 1.00 45.23 O ATOM 1779 OE2 GLU A 121 -1.047 -2.721 -12.158 1.00 20.34 O ATOM 0 H GLU A 121 0.610 -2.507 -7.854 1.00 42.52 H new ATOM 0 HA GLU A 121 -1.181 -0.343 -6.951 1.00 65.05 H new ATOM 0 HB2 GLU A 121 -2.290 -0.841 -9.188 1.00 63.31 H new ATOM 0 HB3 GLU A 121 -0.688 -0.134 -9.266 1.00 63.31 H new ATOM 0 HG2 GLU A 121 0.270 -2.026 -10.142 1.00 71.23 H new ATOM 0 HG3 GLU A 121 -0.799 -3.111 -9.276 1.00 71.23 H new ATOM 1786 N PRO A 122 -3.314 -1.757 -6.718 1.00 73.45 N ATOM 1787 CA PRO A 122 -4.430 -2.576 -6.234 1.00 51.43 C ATOM 1788 C PRO A 122 -4.965 -3.519 -7.306 1.00 62.22 C ATOM 1789 O PRO A 122 -4.375 -3.655 -8.377 1.00 65.13 O ATOM 1790 CB PRO A 122 -5.492 -1.540 -5.856 1.00 43.41 C ATOM 1791 CG PRO A 122 -5.180 -0.352 -6.700 1.00 71.44 C ATOM 1792 CD PRO A 122 -3.685 -0.339 -6.861 1.00 70.41 C ATOM 0 HA PRO A 122 -4.132 -3.223 -5.409 1.00 51.43 H new ATOM 0 HB2 PRO A 122 -6.497 -1.913 -6.054 1.00 43.41 H new ATOM 0 HB3 PRO A 122 -5.446 -1.295 -4.795 1.00 43.41 H new ATOM 0 HG2 PRO A 122 -5.676 -0.420 -7.668 1.00 71.44 H new ATOM 0 HG3 PRO A 122 -5.529 0.566 -6.227 1.00 71.44 H new ATOM 0 HD2 PRO A 122 -3.389 0.058 -7.832 1.00 70.41 H new ATOM 0 HD3 PRO A 122 -3.205 0.280 -6.104 1.00 70.41 H new ATOM 1800 N ALA A 123 -6.086 -4.169 -7.010 1.00 41.24 N ATOM 1801 CA ALA A 123 -6.701 -5.098 -7.950 1.00 52.31 C ATOM 1802 C ALA A 123 -6.988 -4.419 -9.285 1.00 41.21 C ATOM 1803 O ALA A 123 -7.240 -3.215 -9.339 1.00 31.54 O ATOM 1804 CB ALA A 123 -7.982 -5.672 -7.362 1.00 64.43 C ATOM 0 H ALA A 123 -6.586 -4.069 -6.127 1.00 41.24 H new ATOM 0 HA ALA A 123 -5.999 -5.912 -8.130 1.00 52.31 H new ATOM 0 HB1 ALA A 123 -8.431 -6.364 -8.074 1.00 64.43 H new ATOM 0 HB2 ALA A 123 -7.753 -6.201 -6.437 1.00 64.43 H new ATOM 0 HB3 ALA A 123 -8.681 -4.862 -7.153 1.00 64.43 H new ATOM 1810 N ALA A 124 -6.947 -5.198 -10.361 1.00 22.02 N ATOM 1811 CA ALA A 124 -7.203 -4.672 -11.696 1.00 15.34 C ATOM 1812 C ALA A 124 -7.442 -5.799 -12.694 1.00 35.41 C ATOM 1813 O ALA A 124 -6.796 -5.863 -13.739 1.00 31.44 O ATOM 1814 CB ALA A 124 -6.044 -3.798 -12.151 1.00 24.43 C ATOM 0 H ALA A 124 -6.739 -6.196 -10.334 1.00 22.02 H new ATOM 0 HA ALA A 124 -8.106 -4.064 -11.652 1.00 15.34 H new ATOM 0 HB1 ALA A 124 -6.249 -3.412 -13.150 1.00 24.43 H new ATOM 0 HB2 ALA A 124 -5.922 -2.965 -11.458 1.00 24.43 H new ATOM 0 HB3 ALA A 124 -5.129 -4.389 -12.172 1.00 24.43 H new ATOM 1820 N ASN A 125 -8.375 -6.688 -12.364 1.00 43.52 N ATOM 1821 CA ASN A 125 -8.698 -7.814 -13.232 1.00 61.21 C ATOM 1822 C ASN A 125 -9.248 -7.330 -14.570 1.00 44.14 C ATOM 1823 O ASN A 125 -10.261 -7.833 -15.055 1.00 21.04 O ATOM 1824 CB ASN A 125 -9.715 -8.733 -12.553 1.00 14.25 C ATOM 1825 CG ASN A 125 -9.828 -10.080 -13.240 1.00 50.22 C ATOM 1826 OD1 ASN A 125 -10.754 -10.318 -14.015 1.00 53.13 O ATOM 1827 ND2 ASN A 125 -8.883 -10.969 -12.958 1.00 45.44 N ATOM 0 H ASN A 125 -8.920 -6.650 -11.502 1.00 43.52 H new ATOM 0 HA ASN A 125 -7.780 -8.372 -13.417 1.00 61.21 H new ATOM 0 HB2 ASN A 125 -9.427 -8.882 -11.512 1.00 14.25 H new ATOM 0 HB3 ASN A 125 -10.691 -8.248 -12.547 1.00 14.25 H new ATOM 0 HD21 ASN A 125 -8.906 -11.893 -13.390 1.00 45.44 H new ATOM 0 HD22 ASN A 125 -8.134 -10.728 -12.309 1.00 45.44 H new TER 1834 ASN A 125