USER MOD reduce.3.24.130724 H: found=0, std=0, add=1315, rem=0, adj=49 USER MOD reduce.3.24.130724 removed 1313 hydrogens (52 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 68 LYS NZ :NH3+ -125:sc= 0.743 (180deg=-0.376) USER MOD Set 1.2: A 76 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 31 LYS NZ :NH3+ -139:sc= -3.05 (180deg=-3.63!) USER MOD Set 2.2: A 32 MET CE :methyl -108:sc= -2.95 (180deg=-7.33!) USER MOD Set 3.1: A 21 ASN : amide:sc= -0.0123 X(o=-0.58,f=-0.71) USER MOD Set 3.2: A 142 MET CE :methyl -112:sc= -0.568 (180deg=-3.55!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -165:sc= -0.081 (180deg=-0.324) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ -156:sc= -1.08 (180deg=-1.85) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot -87:sc= -1.45 USER MOD Single : A 22 THR OG1 : rot -82:sc= -0.714! USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ -158:sc= -0.0247 (180deg=-0.384) USER MOD Single : A 34 MET CE :methyl -166:sc= -4.06! (180deg=-4.76!) USER MOD Single : A 36 MET CE :methyl -174:sc= -1.92 (180deg=-2.05!) USER MOD Single : A 40 SER OG : rot 180:sc= -0.41 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 SER OG : rot 15:sc= 0.287 USER MOD Single : A 51 TYR OH : rot 66:sc= -0.87 USER MOD Single : A 55 LYS NZ :NH3+ 144:sc= 1.05 (180deg=0.436) USER MOD Single : A 57 ASN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 THR OG1 : rot -33:sc= -0.601! USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ -145:sc= -0.597 (180deg=-1.3) USER MOD Single : A 69 THR OG1 : rot 180:sc= -0.347 USER MOD Single : A 70 SER OG : rot -34:sc= 0.357 USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 68:sc= 0.581 USER MOD Single : A 82 LYS NZ :NH3+ -159:sc= -0.297 (180deg=-0.939) USER MOD Single : A 83 LYS NZ :NH3+ -141:sc= 0.0447 (180deg=-5.77!) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= -1.15 (180deg=-1.15) USER MOD Single : A 90 THR OG1 : rot -136:sc= 0.66 USER MOD Single : A 92 TYR OH : rot -90:sc= -2.36! USER MOD Single : A 93 LYS NZ :NH3+ -112:sc= -2.53! (180deg=-5.1!) USER MOD Single : A 94 SER OG : rot 109:sc= -2.32! USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 TYR OH : rot -140:sc= -0.889 USER MOD Single : A 101 THR OG1 : rot 67:sc= 0.765 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 HIS : no HD1:sc= -4.44! C(o=-4.4!,f=-5.5!) USER MOD Single : A 111 MET CE :methyl 166:sc= -2.25 (180deg=-3.67) USER MOD Single : A 112 MET CE :methyl -130:sc= -1.34 (180deg=-2.98!) USER MOD Single : A 115 TYR OH : rot 80:sc= -0.392 USER MOD Single : A 116 SER OG : rot -152:sc= 1.77 USER MOD Single : A 118 SER OG : rot -75:sc= 0.229 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 126 THR OG1 : rot 180:sc= 0.00774 USER MOD Single : A 131 LYS NZ :NH3+ 163:sc= -0.011 (180deg=-0.214) USER MOD Single : A 137 ASN : amide:sc= -0.183 X(o=-0.18,f=0) USER MOD Single : A 138 TYR OH : rot 180:sc= -0.349 USER MOD Single : A 139 THR OG1 : rot 180:sc= -0.59 USER MOD Single : A 145 MET CE :methyl -146:sc= -0.22 (180deg=-1.37) USER MOD Single : A 149 GLN : amide:sc= -5.96! C(o=-6!,f=-13!) USER MOD Single : A 153 THR OG1 : rot 180:sc= 0 USER MOD Single : A 300 ACD O2 : rot 130:sc= -0.598 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.073 14.692 -27.028 1.00 0.00 N ATOM 2 CA MET A 1 3.058 15.456 -26.211 1.00 52.33 C ATOM 3 C MET A 1 2.349 16.077 -25.013 1.00 51.04 C ATOM 4 O MET A 1 2.977 16.384 -23.999 1.00 30.31 O ATOM 5 CB MET A 1 3.688 16.554 -27.074 1.00 13.13 C ATOM 6 CG MET A 1 4.810 17.238 -26.291 1.00 61.45 C ATOM 7 SD MET A 1 5.509 18.578 -27.286 1.00 3.13 S ATOM 8 CE MET A 1 6.461 19.367 -25.965 1.00 53.23 C ATOM 0 H1 MET A 1 2.579 14.068 -27.688 1.00 0.00 H new ATOM 0 H2 MET A 1 1.472 14.119 -26.401 1.00 0.00 H new ATOM 0 H3 MET A 1 1.479 15.355 -27.566 1.00 0.00 H new ATOM 0 HA MET A 1 3.841 14.786 -25.855 1.00 52.33 H new ATOM 0 HB2 MET A 1 4.082 16.126 -27.996 1.00 13.13 H new ATOM 0 HB3 MET A 1 2.932 17.285 -27.360 1.00 13.13 H new ATOM 0 HG2 MET A 1 4.424 17.632 -25.351 1.00 61.45 H new ATOM 0 HG3 MET A 1 5.586 16.515 -26.039 1.00 61.45 H new ATOM 0 HE1 MET A 1 6.985 20.236 -26.363 1.00 53.23 H new ATOM 0 HE2 MET A 1 5.786 19.683 -25.169 1.00 53.23 H new ATOM 0 HE3 MET A 1 7.186 18.658 -25.566 1.00 53.23 H new ATOM 20 N THR A 2 1.039 16.259 -25.134 1.00 3.32 N ATOM 21 CA THR A 2 0.255 16.845 -24.052 1.00 31.51 C ATOM 22 C THR A 2 0.363 15.994 -22.790 1.00 71.12 C ATOM 23 O THR A 2 0.260 14.768 -22.846 1.00 74.10 O ATOM 24 CB THR A 2 -1.213 16.955 -24.472 1.00 64.55 C ATOM 25 OG1 THR A 2 -1.300 17.649 -25.708 1.00 52.22 O ATOM 26 CG2 THR A 2 -1.996 17.717 -23.401 1.00 22.21 C ATOM 0 H THR A 2 0.500 16.011 -25.964 1.00 3.32 H new ATOM 0 HA THR A 2 0.648 17.839 -23.840 1.00 31.51 H new ATOM 0 HB THR A 2 -1.634 15.956 -24.586 1.00 64.55 H new ATOM 0 HG1 THR A 2 -2.239 17.718 -25.979 1.00 52.22 H new ATOM 0 HG21 THR A 2 -3.041 17.795 -23.701 1.00 22.21 H new ATOM 0 HG22 THR A 2 -1.929 17.183 -22.453 1.00 22.21 H new ATOM 0 HG23 THR A 2 -1.576 18.716 -23.285 1.00 22.21 H new ATOM 34 N VAL A 3 0.572 16.652 -21.653 1.00 51.41 N ATOM 35 CA VAL A 3 0.693 15.948 -20.379 1.00 50.35 C ATOM 36 C VAL A 3 0.205 16.839 -19.235 1.00 51.14 C ATOM 37 O VAL A 3 0.311 18.063 -19.310 1.00 15.20 O ATOM 38 CB VAL A 3 2.156 15.561 -20.140 1.00 31.51 C ATOM 39 CG1 VAL A 3 2.529 14.372 -21.028 1.00 44.41 C ATOM 40 CG2 VAL A 3 3.057 16.751 -20.480 1.00 4.21 C ATOM 0 H VAL A 3 0.661 17.666 -21.587 1.00 51.41 H new ATOM 0 HA VAL A 3 0.080 15.048 -20.414 1.00 50.35 H new ATOM 0 HB VAL A 3 2.290 15.285 -19.094 1.00 31.51 H new ATOM 0 HG11 VAL A 3 3.570 14.101 -20.854 1.00 44.41 H new ATOM 0 HG12 VAL A 3 1.888 13.524 -20.788 1.00 44.41 H new ATOM 0 HG13 VAL A 3 2.395 14.644 -22.075 1.00 44.41 H new ATOM 0 HG21 VAL A 3 4.099 16.479 -20.311 1.00 4.21 H new ATOM 0 HG22 VAL A 3 2.919 17.025 -21.526 1.00 4.21 H new ATOM 0 HG23 VAL A 3 2.796 17.598 -19.846 1.00 4.21 H new ATOM 50 N PRO A 4 -0.322 16.259 -18.182 1.00 73.12 N ATOM 51 CA PRO A 4 -0.827 17.036 -17.009 1.00 12.34 C ATOM 52 C PRO A 4 0.311 17.671 -16.211 1.00 15.51 C ATOM 53 O PRO A 4 1.451 17.209 -16.263 1.00 74.25 O ATOM 54 CB PRO A 4 -1.573 15.986 -16.174 1.00 35.35 C ATOM 55 CG PRO A 4 -0.929 14.686 -16.526 1.00 23.14 C ATOM 56 CD PRO A 4 -0.496 14.807 -17.987 1.00 53.44 C ATOM 0 HA PRO A 4 -1.460 17.872 -17.308 1.00 12.34 H new ATOM 0 HB2 PRO A 4 -1.485 16.194 -15.108 1.00 35.35 H new ATOM 0 HB3 PRO A 4 -2.637 15.977 -16.410 1.00 35.35 H new ATOM 0 HG2 PRO A 4 -0.073 14.489 -15.881 1.00 23.14 H new ATOM 0 HG3 PRO A 4 -1.625 13.858 -16.394 1.00 23.14 H new ATOM 0 HD2 PRO A 4 0.430 14.264 -18.176 1.00 53.44 H new ATOM 0 HD3 PRO A 4 -1.248 14.400 -18.662 1.00 53.44 H new ATOM 64 N ASP A 5 -0.008 18.731 -15.475 1.00 12.22 N ATOM 65 CA ASP A 5 0.996 19.419 -14.672 1.00 22.15 C ATOM 66 C ASP A 5 1.398 18.565 -13.473 1.00 22.21 C ATOM 67 O ASP A 5 1.053 18.875 -12.333 1.00 60.12 O ATOM 68 CB ASP A 5 0.445 20.762 -14.185 1.00 34.44 C ATOM 69 CG ASP A 5 1.584 21.646 -13.692 1.00 21.53 C ATOM 70 OD1 ASP A 5 2.721 21.209 -13.763 1.00 32.44 O ATOM 71 OD2 ASP A 5 1.304 22.749 -13.250 1.00 50.33 O ATOM 0 H ASP A 5 -0.945 19.129 -15.418 1.00 12.22 H new ATOM 0 HA ASP A 5 1.876 19.592 -15.292 1.00 22.15 H new ATOM 0 HB2 ASP A 5 -0.089 21.260 -14.994 1.00 34.44 H new ATOM 0 HB3 ASP A 5 -0.274 20.600 -13.382 1.00 34.44 H new ATOM 76 N ARG A 6 2.129 17.490 -13.743 1.00 61.24 N ATOM 77 CA ARG A 6 2.577 16.591 -12.685 1.00 11.45 C ATOM 78 C ARG A 6 3.482 17.322 -11.699 1.00 51.04 C ATOM 79 O ARG A 6 3.465 17.044 -10.500 1.00 22.12 O ATOM 80 CB ARG A 6 3.333 15.409 -13.293 1.00 11.40 C ATOM 81 CG ARG A 6 4.421 15.932 -14.235 1.00 43.01 C ATOM 82 CD ARG A 6 5.150 14.755 -14.885 1.00 14.15 C ATOM 83 NE ARG A 6 4.196 13.871 -15.547 1.00 25.21 N ATOM 84 CZ ARG A 6 4.596 12.988 -16.456 1.00 74.32 C ATOM 85 NH1 ARG A 6 5.860 12.903 -16.771 1.00 62.45 N ATOM 86 NH2 ARG A 6 3.726 12.207 -17.034 1.00 72.43 N ATOM 0 H ARG A 6 2.423 17.220 -14.681 1.00 61.24 H new ATOM 0 HA ARG A 6 1.699 16.228 -12.150 1.00 11.45 H new ATOM 0 HB2 ARG A 6 3.780 14.804 -12.504 1.00 11.40 H new ATOM 0 HB3 ARG A 6 2.644 14.764 -13.838 1.00 11.40 H new ATOM 0 HG2 ARG A 6 3.977 16.566 -15.003 1.00 43.01 H new ATOM 0 HG3 ARG A 6 5.128 16.550 -13.682 1.00 43.01 H new ATOM 0 HD2 ARG A 6 5.877 15.124 -15.609 1.00 14.15 H new ATOM 0 HD3 ARG A 6 5.706 14.200 -14.129 1.00 14.15 H new ATOM 0 HE ARG A 6 3.206 13.932 -15.308 1.00 25.21 H new ATOM 0 HH11 ARG A 6 6.540 13.514 -16.319 1.00 62.45 H new ATOM 0 HH12 ARG A 6 6.167 12.225 -17.469 1.00 62.45 H new ATOM 0 HH21 ARG A 6 2.738 12.274 -16.788 1.00 72.43 H new ATOM 0 HH22 ARG A 6 4.033 11.529 -17.732 1.00 72.43 H new ATOM 100 N SER A 7 4.277 18.252 -12.215 1.00 24.50 N ATOM 101 CA SER A 7 5.191 19.013 -11.373 1.00 15.21 C ATOM 102 C SER A 7 4.437 19.726 -10.253 1.00 62.44 C ATOM 103 O SER A 7 4.966 19.909 -9.157 1.00 0.01 O ATOM 104 CB SER A 7 5.942 20.042 -12.218 1.00 52.42 C ATOM 105 OG SER A 7 6.649 19.373 -13.253 1.00 23.24 O ATOM 0 H SER A 7 4.307 18.496 -13.205 1.00 24.50 H new ATOM 0 HA SER A 7 5.901 18.317 -10.926 1.00 15.21 H new ATOM 0 HB2 SER A 7 5.242 20.760 -12.645 1.00 52.42 H new ATOM 0 HB3 SER A 7 6.635 20.606 -11.594 1.00 52.42 H new ATOM 0 HG SER A 7 7.130 20.030 -13.798 1.00 23.24 H new ATOM 111 N GLU A 8 3.205 20.139 -10.538 1.00 55.43 N ATOM 112 CA GLU A 8 2.397 20.847 -9.551 1.00 74.40 C ATOM 113 C GLU A 8 2.163 19.998 -8.303 1.00 61.42 C ATOM 114 O GLU A 8 2.409 20.449 -7.186 1.00 24.35 O ATOM 115 CB GLU A 8 1.049 21.229 -10.170 1.00 43.14 C ATOM 116 CG GLU A 8 0.287 22.165 -9.226 1.00 42.40 C ATOM 117 CD GLU A 8 1.002 23.508 -9.130 1.00 53.01 C ATOM 118 OE1 GLU A 8 1.718 23.843 -10.059 1.00 45.21 O ATOM 119 OE2 GLU A 8 0.824 24.182 -8.130 1.00 42.34 O ATOM 0 H GLU A 8 2.747 19.997 -11.438 1.00 55.43 H new ATOM 0 HA GLU A 8 2.940 21.744 -9.252 1.00 74.40 H new ATOM 0 HB2 GLU A 8 1.206 21.718 -11.132 1.00 43.14 H new ATOM 0 HB3 GLU A 8 0.460 20.332 -10.361 1.00 43.14 H new ATOM 0 HG2 GLU A 8 -0.730 22.311 -9.589 1.00 42.40 H new ATOM 0 HG3 GLU A 8 0.211 21.713 -8.237 1.00 42.40 H new ATOM 126 N ILE A 9 1.679 18.773 -8.492 1.00 32.20 N ATOM 127 CA ILE A 9 1.413 17.892 -7.356 1.00 44.52 C ATOM 128 C ILE A 9 2.680 17.168 -6.909 1.00 71.22 C ATOM 129 O ILE A 9 2.818 16.818 -5.737 1.00 34.23 O ATOM 130 CB ILE A 9 0.339 16.856 -7.717 1.00 12.34 C ATOM 131 CG1 ILE A 9 -0.089 16.117 -6.431 1.00 51.22 C ATOM 132 CG2 ILE A 9 0.918 15.871 -8.738 1.00 71.51 C ATOM 133 CD1 ILE A 9 -1.014 14.927 -6.739 1.00 22.25 C ATOM 0 H ILE A 9 1.466 18.372 -9.405 1.00 32.20 H new ATOM 0 HA ILE A 9 1.057 18.515 -6.536 1.00 44.52 H new ATOM 0 HB ILE A 9 -0.533 17.343 -8.155 1.00 12.34 H new ATOM 0 HG12 ILE A 9 0.796 15.762 -5.903 1.00 51.22 H new ATOM 0 HG13 ILE A 9 -0.600 16.812 -5.765 1.00 51.22 H new ATOM 0 HG21 ILE A 9 0.161 15.132 -9.000 1.00 71.51 H new ATOM 0 HG22 ILE A 9 1.222 16.412 -9.634 1.00 71.51 H new ATOM 0 HG23 ILE A 9 1.784 15.368 -8.307 1.00 71.51 H new ATOM 0 HD11 ILE A 9 -1.293 14.433 -5.808 1.00 22.25 H new ATOM 0 HD12 ILE A 9 -1.912 15.285 -7.243 1.00 22.25 H new ATOM 0 HD13 ILE A 9 -0.493 14.219 -7.384 1.00 22.25 H new ATOM 145 N ALA A 10 3.606 16.937 -7.837 1.00 72.21 N ATOM 146 CA ALA A 10 4.833 16.241 -7.472 1.00 65.35 C ATOM 147 C ALA A 10 5.739 17.145 -6.656 1.00 33.31 C ATOM 148 O ALA A 10 5.872 18.337 -6.937 1.00 3.55 O ATOM 149 CB ALA A 10 5.574 15.693 -8.698 1.00 40.42 C ATOM 0 H ALA A 10 3.534 17.212 -8.817 1.00 72.21 H new ATOM 0 HA ALA A 10 4.549 15.385 -6.860 1.00 65.35 H new ATOM 0 HB1 ALA A 10 6.482 15.183 -8.376 1.00 40.42 H new ATOM 0 HB2 ALA A 10 4.931 14.990 -9.228 1.00 40.42 H new ATOM 0 HB3 ALA A 10 5.837 16.516 -9.362 1.00 40.42 H new ATOM 155 N GLY A 11 6.348 16.564 -5.626 1.00 73.14 N ATOM 156 CA GLY A 11 7.234 17.299 -4.734 1.00 23.13 C ATOM 157 C GLY A 11 6.683 17.269 -3.313 1.00 62.21 C ATOM 158 O GLY A 11 7.441 17.259 -2.344 1.00 2.41 O ATOM 0 H GLY A 11 6.241 15.578 -5.389 1.00 73.14 H new ATOM 0 HA2 GLY A 11 8.232 16.860 -4.756 1.00 23.13 H new ATOM 0 HA3 GLY A 11 7.332 18.330 -5.073 1.00 23.13 H new ATOM 162 N LYS A 12 5.354 17.244 -3.194 1.00 50.22 N ATOM 163 CA LYS A 12 4.718 17.202 -1.880 1.00 64.23 C ATOM 164 C LYS A 12 3.249 16.785 -1.977 1.00 33.14 C ATOM 165 O LYS A 12 2.408 17.560 -2.431 1.00 23.54 O ATOM 166 CB LYS A 12 4.817 18.575 -1.214 1.00 54.11 C ATOM 167 CG LYS A 12 4.439 18.459 0.265 1.00 51.14 C ATOM 168 CD LYS A 12 4.213 19.855 0.848 1.00 1.44 C ATOM 169 CE LYS A 12 5.469 20.707 0.652 1.00 14.14 C ATOM 170 NZ LYS A 12 6.679 19.885 0.939 1.00 61.31 N ATOM 0 H LYS A 12 4.706 17.252 -3.982 1.00 50.22 H new ATOM 0 HA LYS A 12 5.241 16.458 -1.280 1.00 64.23 H new ATOM 0 HB2 LYS A 12 5.830 18.965 -1.311 1.00 54.11 H new ATOM 0 HB3 LYS A 12 4.155 19.281 -1.714 1.00 54.11 H new ATOM 0 HG2 LYS A 12 3.536 17.858 0.374 1.00 51.14 H new ATOM 0 HG3 LYS A 12 5.230 17.948 0.814 1.00 51.14 H new ATOM 0 HD2 LYS A 12 3.361 20.329 0.361 1.00 1.44 H new ATOM 0 HD3 LYS A 12 3.974 19.782 1.909 1.00 1.44 H new ATOM 0 HE2 LYS A 12 5.508 21.086 -0.369 1.00 14.14 H new ATOM 0 HE3 LYS A 12 5.440 21.573 1.313 1.00 14.14 H new ATOM 0 HZ1 LYS A 12 7.467 20.509 1.206 1.00 61.31 H new ATOM 0 HZ2 LYS A 12 6.476 19.230 1.721 1.00 61.31 H new ATOM 0 HZ3 LYS A 12 6.939 19.342 0.091 1.00 61.31 H new ATOM 184 N TRP A 13 2.937 15.575 -1.507 1.00 70.35 N ATOM 185 CA TRP A 13 1.556 15.080 -1.501 1.00 13.43 C ATOM 186 C TRP A 13 1.118 14.961 -0.042 1.00 24.03 C ATOM 187 O TRP A 13 1.831 14.360 0.762 1.00 52.23 O ATOM 188 CB TRP A 13 1.523 13.675 -2.135 1.00 71.25 C ATOM 189 CG TRP A 13 1.709 13.727 -3.594 1.00 54.10 C ATOM 190 CD1 TRP A 13 2.671 14.399 -4.249 1.00 2.22 C ATOM 191 CD2 TRP A 13 0.922 13.034 -4.594 1.00 25.22 C ATOM 192 NE1 TRP A 13 2.533 14.145 -5.592 1.00 24.14 N ATOM 193 CE2 TRP A 13 1.481 13.295 -5.849 1.00 45.02 C ATOM 194 CE3 TRP A 13 -0.203 12.193 -4.528 1.00 10.34 C ATOM 195 CZ2 TRP A 13 0.964 12.744 -7.009 1.00 1.41 C ATOM 196 CZ3 TRP A 13 -0.741 11.638 -5.699 1.00 62.30 C ATOM 197 CH2 TRP A 13 -0.152 11.907 -6.941 1.00 42.33 C ATOM 0 H TRP A 13 3.620 14.920 -1.126 1.00 70.35 H new ATOM 0 HA TRP A 13 0.903 15.752 -2.057 1.00 13.43 H new ATOM 0 HB2 TRP A 13 2.304 13.058 -1.691 1.00 71.25 H new ATOM 0 HB3 TRP A 13 0.571 13.196 -1.907 1.00 71.25 H new ATOM 0 HD1 TRP A 13 3.423 15.030 -3.798 1.00 2.22 H new ATOM 0 HE1 TRP A 13 3.138 14.539 -6.313 1.00 24.14 H new ATOM 0 HE3 TRP A 13 -0.655 11.973 -3.572 1.00 10.34 H new ATOM 0 HZ2 TRP A 13 1.422 12.961 -7.963 1.00 1.41 H new ATOM 0 HZ3 TRP A 13 -1.612 11.002 -5.643 1.00 62.30 H new ATOM 0 HH2 TRP A 13 -0.558 11.470 -7.841 1.00 42.33 H new ATOM 208 N TYR A 14 -0.015 15.560 0.327 1.00 55.13 N ATOM 209 CA TYR A 14 -0.459 15.528 1.724 1.00 3.33 C ATOM 210 C TYR A 14 -1.552 14.485 1.950 1.00 31.42 C ATOM 211 O TYR A 14 -2.616 14.548 1.343 1.00 34.32 O ATOM 212 CB TYR A 14 -0.983 16.929 2.106 1.00 20.12 C ATOM 213 CG TYR A 14 -0.267 17.468 3.327 1.00 42.10 C ATOM 214 CD1 TYR A 14 1.133 17.534 3.350 1.00 33.50 C ATOM 215 CD2 TYR A 14 -1.005 17.912 4.432 1.00 62.44 C ATOM 216 CE1 TYR A 14 1.792 18.043 4.474 1.00 51.12 C ATOM 217 CE2 TYR A 14 -0.345 18.420 5.555 1.00 44.23 C ATOM 218 CZ TYR A 14 1.053 18.487 5.577 1.00 0.24 C ATOM 219 OH TYR A 14 1.703 18.989 6.686 1.00 12.22 O ATOM 0 H TYR A 14 -0.633 16.065 -0.308 1.00 55.13 H new ATOM 0 HA TYR A 14 0.388 15.250 2.352 1.00 3.33 H new ATOM 0 HB2 TYR A 14 -0.844 17.613 1.269 1.00 20.12 H new ATOM 0 HB3 TYR A 14 -2.054 16.878 2.302 1.00 20.12 H new ATOM 0 HD1 TYR A 14 1.703 17.192 2.499 1.00 33.50 H new ATOM 0 HD2 TYR A 14 -2.084 17.862 4.416 1.00 62.44 H new ATOM 0 HE1 TYR A 14 2.871 18.093 4.491 1.00 51.12 H new ATOM 0 HE2 TYR A 14 -0.915 18.761 6.407 1.00 44.23 H new ATOM 0 HH TYR A 14 1.043 19.253 7.360 1.00 12.22 H new ATOM 229 N VAL A 15 -1.285 13.559 2.869 1.00 31.05 N ATOM 230 CA VAL A 15 -2.253 12.520 3.224 1.00 33.51 C ATOM 231 C VAL A 15 -3.046 12.975 4.443 1.00 44.40 C ATOM 232 O VAL A 15 -2.455 13.391 5.441 1.00 12.25 O ATOM 233 CB VAL A 15 -1.530 11.209 3.547 1.00 30.14 C ATOM 234 CG1 VAL A 15 -2.544 10.175 4.043 1.00 11.52 C ATOM 235 CG2 VAL A 15 -0.833 10.678 2.293 1.00 55.14 C ATOM 0 H VAL A 15 -0.405 13.506 3.383 1.00 31.05 H new ATOM 0 HA VAL A 15 -2.925 12.353 2.382 1.00 33.51 H new ATOM 0 HB VAL A 15 -0.786 11.392 4.322 1.00 30.14 H new ATOM 0 HG11 VAL A 15 -2.029 9.242 4.273 1.00 11.52 H new ATOM 0 HG12 VAL A 15 -3.035 10.549 4.941 1.00 11.52 H new ATOM 0 HG13 VAL A 15 -3.290 9.997 3.269 1.00 11.52 H new ATOM 0 HG21 VAL A 15 -0.320 9.745 2.529 1.00 55.14 H new ATOM 0 HG22 VAL A 15 -1.574 10.498 1.514 1.00 55.14 H new ATOM 0 HG23 VAL A 15 -0.108 11.412 1.942 1.00 55.14 H new ATOM 245 N VAL A 16 -4.379 12.927 4.365 1.00 72.41 N ATOM 246 CA VAL A 16 -5.199 13.380 5.491 1.00 62.20 C ATOM 247 C VAL A 16 -6.414 12.505 5.747 1.00 74.34 C ATOM 248 O VAL A 16 -7.253 12.860 6.573 1.00 14.05 O ATOM 249 CB VAL A 16 -5.694 14.795 5.236 1.00 71.13 C ATOM 250 CG1 VAL A 16 -4.500 15.755 5.093 1.00 21.45 C ATOM 251 CG2 VAL A 16 -6.534 14.813 3.953 1.00 41.30 C ATOM 0 H VAL A 16 -4.902 12.589 3.557 1.00 72.41 H new ATOM 0 HA VAL A 16 -4.553 13.328 6.368 1.00 62.20 H new ATOM 0 HB VAL A 16 -6.306 15.121 6.077 1.00 71.13 H new ATOM 0 HG11 VAL A 16 -4.865 16.766 4.911 1.00 21.45 H new ATOM 0 HG12 VAL A 16 -3.911 15.742 6.010 1.00 21.45 H new ATOM 0 HG13 VAL A 16 -3.877 15.438 4.257 1.00 21.45 H new ATOM 0 HG21 VAL A 16 -6.891 15.826 3.766 1.00 41.30 H new ATOM 0 HG22 VAL A 16 -5.923 14.483 3.113 1.00 41.30 H new ATOM 0 HG23 VAL A 16 -7.386 14.143 4.067 1.00 41.30 H new ATOM 261 N ALA A 17 -6.503 11.355 5.103 1.00 31.30 N ATOM 262 CA ALA A 17 -7.635 10.474 5.370 1.00 63.12 C ATOM 263 C ALA A 17 -7.557 9.226 4.516 1.00 50.22 C ATOM 264 O ALA A 17 -7.202 9.298 3.341 1.00 25.22 O ATOM 265 CB ALA A 17 -8.938 11.218 5.065 1.00 40.12 C ATOM 0 H ALA A 17 -5.833 11.014 4.414 1.00 31.30 H new ATOM 0 HA ALA A 17 -7.609 10.180 6.419 1.00 63.12 H new ATOM 0 HB1 ALA A 17 -9.786 10.563 5.263 1.00 40.12 H new ATOM 0 HB2 ALA A 17 -9.008 12.103 5.697 1.00 40.12 H new ATOM 0 HB3 ALA A 17 -8.949 11.518 4.017 1.00 40.12 H new ATOM 271 N LEU A 18 -7.862 8.070 5.103 1.00 41.03 N ATOM 272 CA LEU A 18 -7.782 6.819 4.356 1.00 14.30 C ATOM 273 C LEU A 18 -8.799 5.810 4.892 1.00 1.41 C ATOM 274 O LEU A 18 -9.101 5.785 6.085 1.00 54.35 O ATOM 275 CB LEU A 18 -6.334 6.278 4.468 1.00 13.23 C ATOM 276 CG LEU A 18 -6.283 4.733 4.434 1.00 44.51 C ATOM 277 CD1 LEU A 18 -4.957 4.276 3.814 1.00 73.45 C ATOM 278 CD2 LEU A 18 -6.389 4.169 5.862 1.00 42.33 C ATOM 0 H LEU A 18 -8.161 7.974 6.074 1.00 41.03 H new ATOM 0 HA LEU A 18 -8.023 6.989 3.307 1.00 14.30 H new ATOM 0 HB2 LEU A 18 -5.734 6.678 3.650 1.00 13.23 H new ATOM 0 HB3 LEU A 18 -5.886 6.634 5.395 1.00 13.23 H new ATOM 0 HG LEU A 18 -7.118 4.367 3.837 1.00 44.51 H new ATOM 0 HD11 LEU A 18 -4.922 3.187 3.791 1.00 73.45 H new ATOM 0 HD12 LEU A 18 -4.878 4.663 2.798 1.00 73.45 H new ATOM 0 HD13 LEU A 18 -4.127 4.653 4.412 1.00 73.45 H new ATOM 0 HD21 LEU A 18 -6.352 3.080 5.827 1.00 42.33 H new ATOM 0 HD22 LEU A 18 -5.559 4.541 6.463 1.00 42.33 H new ATOM 0 HD23 LEU A 18 -7.331 4.486 6.309 1.00 42.33 H new ATOM 290 N ALA A 19 -9.315 4.975 3.990 1.00 72.11 N ATOM 291 CA ALA A 19 -10.288 3.949 4.355 1.00 31.11 C ATOM 292 C ALA A 19 -9.721 2.570 4.058 1.00 13.13 C ATOM 293 O ALA A 19 -8.747 2.437 3.321 1.00 23.53 O ATOM 294 CB ALA A 19 -11.592 4.134 3.579 1.00 4.41 C ATOM 0 H ALA A 19 -9.074 4.990 2.999 1.00 72.11 H new ATOM 0 HA ALA A 19 -10.496 4.042 5.421 1.00 31.11 H new ATOM 0 HB1 ALA A 19 -12.301 3.358 3.868 1.00 4.41 H new ATOM 0 HB2 ALA A 19 -12.014 5.113 3.805 1.00 4.41 H new ATOM 0 HB3 ALA A 19 -11.392 4.063 2.510 1.00 4.41 H new ATOM 300 N SER A 20 -10.331 1.549 4.640 1.00 62.30 N ATOM 301 CA SER A 20 -9.870 0.185 4.433 1.00 12.45 C ATOM 302 C SER A 20 -10.908 -0.814 4.904 1.00 24.04 C ATOM 303 O SER A 20 -11.958 -0.444 5.427 1.00 71.24 O ATOM 304 CB SER A 20 -8.561 -0.041 5.189 1.00 43.13 C ATOM 305 OG SER A 20 -8.781 0.168 6.577 1.00 1.05 O ATOM 0 H SER A 20 -11.140 1.637 5.255 1.00 62.30 H new ATOM 0 HA SER A 20 -9.706 0.038 3.365 1.00 12.45 H new ATOM 0 HB2 SER A 20 -8.197 -1.053 5.015 1.00 43.13 H new ATOM 0 HB3 SER A 20 -7.794 0.641 4.823 1.00 43.13 H new ATOM 0 HG SER A 20 -8.664 1.118 6.787 1.00 1.05 H new ATOM 311 N ASN A 21 -10.586 -2.087 4.734 1.00 54.23 N ATOM 312 CA ASN A 21 -11.467 -3.167 5.161 1.00 53.10 C ATOM 313 C ASN A 21 -10.794 -3.929 6.290 1.00 74.32 C ATOM 314 O ASN A 21 -11.426 -4.714 6.996 1.00 11.43 O ATOM 315 CB ASN A 21 -11.750 -4.113 3.993 1.00 23.03 C ATOM 316 CG ASN A 21 -12.899 -5.052 4.348 1.00 70.51 C ATOM 317 OD1 ASN A 21 -14.033 -4.606 4.525 1.00 72.43 O ATOM 318 ND2 ASN A 21 -12.672 -6.332 4.460 1.00 32.42 N ATOM 0 H ASN A 21 -9.717 -2.400 4.301 1.00 54.23 H new ATOM 0 HA ASN A 21 -12.414 -2.751 5.505 1.00 53.10 H new ATOM 0 HB2 ASN A 21 -12.001 -3.538 3.102 1.00 23.03 H new ATOM 0 HB3 ASN A 21 -10.856 -4.691 3.758 1.00 23.03 H new ATOM 0 HD21 ASN A 21 -13.435 -6.967 4.695 1.00 32.42 H new ATOM 0 HD22 ASN A 21 -11.731 -6.698 4.313 1.00 32.42 H new ATOM 325 N THR A 22 -9.500 -3.668 6.462 1.00 11.02 N ATOM 326 CA THR A 22 -8.729 -4.306 7.518 1.00 40.13 C ATOM 327 C THR A 22 -8.804 -3.459 8.785 1.00 24.02 C ATOM 328 O THR A 22 -8.230 -2.373 8.862 1.00 72.43 O ATOM 329 CB THR A 22 -7.270 -4.492 7.075 1.00 71.12 C ATOM 330 OG1 THR A 22 -6.611 -5.350 7.993 1.00 52.53 O ATOM 331 CG2 THR A 22 -6.547 -3.142 7.031 1.00 44.44 C ATOM 0 H THR A 22 -8.967 -3.019 5.883 1.00 11.02 H new ATOM 0 HA THR A 22 -9.147 -5.291 7.726 1.00 40.13 H new ATOM 0 HB THR A 22 -7.255 -4.930 6.077 1.00 71.12 H new ATOM 0 HG1 THR A 22 -6.323 -4.834 8.774 1.00 52.53 H new ATOM 0 HG21 THR A 22 -5.515 -3.292 6.715 1.00 44.44 H new ATOM 0 HG22 THR A 22 -7.050 -2.483 6.324 1.00 44.44 H new ATOM 0 HG23 THR A 22 -6.561 -2.689 8.022 1.00 44.44 H new ATOM 339 N GLU A 23 -9.560 -3.945 9.756 1.00 50.22 N ATOM 340 CA GLU A 23 -9.761 -3.216 11.002 1.00 21.22 C ATOM 341 C GLU A 23 -8.463 -2.604 11.513 1.00 33.42 C ATOM 342 O GLU A 23 -8.483 -1.575 12.185 1.00 60.34 O ATOM 343 CB GLU A 23 -10.335 -4.154 12.066 1.00 55.34 C ATOM 344 CG GLU A 23 -11.739 -4.599 11.651 1.00 23.42 C ATOM 345 CD GLU A 23 -12.338 -5.501 12.723 1.00 42.13 C ATOM 346 OE1 GLU A 23 -11.612 -5.873 13.632 1.00 72.44 O ATOM 347 OE2 GLU A 23 -13.515 -5.808 12.623 1.00 64.13 O ATOM 0 H GLU A 23 -10.045 -4.841 9.707 1.00 50.22 H new ATOM 0 HA GLU A 23 -10.462 -2.405 10.802 1.00 21.22 H new ATOM 0 HB2 GLU A 23 -9.688 -5.023 12.187 1.00 55.34 H new ATOM 0 HB3 GLU A 23 -10.373 -3.647 13.030 1.00 55.34 H new ATOM 0 HG2 GLU A 23 -12.376 -3.727 11.500 1.00 23.42 H new ATOM 0 HG3 GLU A 23 -11.695 -5.130 10.700 1.00 23.42 H new ATOM 354 N PHE A 24 -7.343 -3.233 11.206 1.00 12.32 N ATOM 355 CA PHE A 24 -6.055 -2.726 11.663 1.00 62.34 C ATOM 356 C PHE A 24 -5.809 -1.277 11.221 1.00 43.04 C ATOM 357 O PHE A 24 -5.398 -0.446 12.030 1.00 34.23 O ATOM 358 CB PHE A 24 -4.923 -3.619 11.138 1.00 11.12 C ATOM 359 CG PHE A 24 -5.358 -5.069 11.149 1.00 35.23 C ATOM 360 CD1 PHE A 24 -6.024 -5.603 12.263 1.00 51.11 C ATOM 361 CD2 PHE A 24 -5.091 -5.884 10.041 1.00 74.23 C ATOM 362 CE1 PHE A 24 -6.420 -6.946 12.264 1.00 43.22 C ATOM 363 CE2 PHE A 24 -5.488 -7.226 10.045 1.00 62.52 C ATOM 364 CZ PHE A 24 -6.152 -7.757 11.155 1.00 60.21 C ATOM 0 H PHE A 24 -7.295 -4.086 10.649 1.00 12.32 H new ATOM 0 HA PHE A 24 -6.072 -2.743 12.753 1.00 62.34 H new ATOM 0 HB2 PHE A 24 -4.653 -3.320 10.125 1.00 11.12 H new ATOM 0 HB3 PHE A 24 -4.034 -3.493 11.755 1.00 11.12 H new ATOM 0 HD1 PHE A 24 -6.231 -4.978 13.119 1.00 51.11 H new ATOM 0 HD2 PHE A 24 -4.578 -5.476 9.183 1.00 74.23 H new ATOM 0 HE1 PHE A 24 -6.933 -7.357 13.121 1.00 43.22 H new ATOM 0 HE2 PHE A 24 -5.281 -7.852 9.190 1.00 62.52 H new ATOM 0 HZ PHE A 24 -6.458 -8.793 11.157 1.00 60.21 H new ATOM 374 N PHE A 25 -6.004 -0.985 9.934 1.00 4.22 N ATOM 375 CA PHE A 25 -5.733 0.360 9.407 1.00 53.40 C ATOM 376 C PHE A 25 -6.731 1.425 9.886 1.00 44.12 C ATOM 377 O PHE A 25 -6.325 2.495 10.335 1.00 73.34 O ATOM 378 CB PHE A 25 -5.751 0.304 7.865 1.00 14.51 C ATOM 379 CG PHE A 25 -4.619 1.125 7.272 1.00 12.54 C ATOM 380 CD1 PHE A 25 -4.258 2.356 7.836 1.00 75.12 C ATOM 381 CD2 PHE A 25 -3.935 0.647 6.147 1.00 23.01 C ATOM 382 CE1 PHE A 25 -3.217 3.106 7.276 1.00 44.54 C ATOM 383 CE2 PHE A 25 -2.895 1.397 5.588 1.00 21.51 C ATOM 384 CZ PHE A 25 -2.536 2.625 6.152 1.00 1.40 C ATOM 0 H PHE A 25 -6.345 -1.651 9.241 1.00 4.22 H new ATOM 0 HA PHE A 25 -4.756 0.658 9.787 1.00 53.40 H new ATOM 0 HB2 PHE A 25 -5.664 -0.731 7.535 1.00 14.51 H new ATOM 0 HB3 PHE A 25 -6.706 0.677 7.496 1.00 14.51 H new ATOM 0 HD1 PHE A 25 -4.784 2.727 8.704 1.00 75.12 H new ATOM 0 HD2 PHE A 25 -4.211 -0.302 5.711 1.00 23.01 H new ATOM 0 HE1 PHE A 25 -2.940 4.055 7.711 1.00 44.54 H new ATOM 0 HE2 PHE A 25 -2.369 1.027 4.720 1.00 21.51 H new ATOM 0 HZ PHE A 25 -1.732 3.203 5.720 1.00 1.40 H new ATOM 394 N LEU A 26 -8.028 1.146 9.796 1.00 51.21 N ATOM 395 CA LEU A 26 -9.016 2.135 10.232 1.00 24.04 C ATOM 396 C LEU A 26 -8.956 2.315 11.743 1.00 24.21 C ATOM 397 O LEU A 26 -9.075 3.428 12.257 1.00 34.11 O ATOM 398 CB LEU A 26 -10.436 1.741 9.790 1.00 11.33 C ATOM 399 CG LEU A 26 -10.726 0.249 10.097 1.00 54.15 C ATOM 400 CD1 LEU A 26 -11.860 0.136 11.124 1.00 52.55 C ATOM 401 CD2 LEU A 26 -11.155 -0.476 8.812 1.00 64.21 C ATOM 0 H LEU A 26 -8.414 0.273 9.437 1.00 51.21 H new ATOM 0 HA LEU A 26 -8.772 3.085 9.756 1.00 24.04 H new ATOM 0 HB2 LEU A 26 -11.166 2.369 10.301 1.00 11.33 H new ATOM 0 HB3 LEU A 26 -10.551 1.924 8.722 1.00 11.33 H new ATOM 0 HG LEU A 26 -9.819 -0.206 10.495 1.00 54.15 H new ATOM 0 HD11 LEU A 26 -12.057 -0.915 11.334 1.00 52.55 H new ATOM 0 HD12 LEU A 26 -11.569 0.641 12.045 1.00 52.55 H new ATOM 0 HD13 LEU A 26 -12.761 0.601 10.724 1.00 52.55 H new ATOM 0 HD21 LEU A 26 -11.357 -1.524 9.035 1.00 64.21 H new ATOM 0 HD22 LEU A 26 -12.056 -0.009 8.415 1.00 64.21 H new ATOM 0 HD23 LEU A 26 -10.356 -0.410 8.073 1.00 64.21 H new ATOM 413 N ARG A 27 -8.754 1.211 12.443 1.00 34.32 N ATOM 414 CA ARG A 27 -8.663 1.258 13.895 1.00 64.22 C ATOM 415 C ARG A 27 -7.536 2.198 14.318 1.00 1.05 C ATOM 416 O ARG A 27 -7.716 3.042 15.195 1.00 3.25 O ATOM 417 CB ARG A 27 -8.403 -0.140 14.461 1.00 51.33 C ATOM 418 CG ARG A 27 -8.238 -0.055 15.981 1.00 52.22 C ATOM 419 CD ARG A 27 -8.241 -1.465 16.574 1.00 54.13 C ATOM 420 NE ARG A 27 -7.059 -2.199 16.138 1.00 14.32 N ATOM 421 CZ ARG A 27 -5.862 -1.939 16.652 1.00 52.13 C ATOM 422 NH1 ARG A 27 -5.728 -1.015 17.562 1.00 34.32 N ATOM 423 NH2 ARG A 27 -4.818 -2.610 16.245 1.00 70.23 N ATOM 0 H ARG A 27 -8.651 0.281 12.037 1.00 34.32 H new ATOM 0 HA ARG A 27 -9.610 1.628 14.288 1.00 64.22 H new ATOM 0 HB2 ARG A 27 -9.230 -0.804 14.211 1.00 51.33 H new ATOM 0 HB3 ARG A 27 -7.506 -0.565 14.011 1.00 51.33 H new ATOM 0 HG2 ARG A 27 -7.306 0.453 16.228 1.00 52.22 H new ATOM 0 HG3 ARG A 27 -9.047 0.534 16.413 1.00 52.22 H new ATOM 0 HD2 ARG A 27 -8.262 -1.409 17.662 1.00 54.13 H new ATOM 0 HD3 ARG A 27 -9.142 -1.995 16.265 1.00 54.13 H new ATOM 0 HE ARG A 27 -7.153 -2.924 15.427 1.00 14.32 H new ATOM 0 HH11 ARG A 27 -6.543 -0.491 17.880 1.00 34.32 H new ATOM 0 HH12 ARG A 27 -4.808 -0.817 17.956 1.00 34.32 H new ATOM 0 HH21 ARG A 27 -4.922 -3.333 15.533 1.00 70.23 H new ATOM 0 HH22 ARG A 27 -3.898 -2.411 16.639 1.00 70.23 H new ATOM 437 N GLU A 28 -6.364 2.024 13.708 1.00 12.43 N ATOM 438 CA GLU A 28 -5.205 2.842 14.056 1.00 52.20 C ATOM 439 C GLU A 28 -5.225 4.216 13.374 1.00 15.22 C ATOM 440 O GLU A 28 -4.900 5.224 14.000 1.00 34.35 O ATOM 441 CB GLU A 28 -3.923 2.100 13.665 1.00 33.00 C ATOM 442 CG GLU A 28 -2.736 2.669 14.447 1.00 20.23 C ATOM 443 CD GLU A 28 -1.432 2.097 13.903 1.00 43.21 C ATOM 444 OE1 GLU A 28 -1.492 1.341 12.947 1.00 1.12 O ATOM 445 OE2 GLU A 28 -0.391 2.423 14.449 1.00 0.13 O ATOM 0 H GLU A 28 -6.194 1.332 12.979 1.00 12.43 H new ATOM 0 HA GLU A 28 -5.240 3.013 15.132 1.00 52.20 H new ATOM 0 HB2 GLU A 28 -4.030 1.035 13.873 1.00 33.00 H new ATOM 0 HB3 GLU A 28 -3.746 2.200 12.594 1.00 33.00 H new ATOM 0 HG2 GLU A 28 -2.726 3.756 14.370 1.00 20.23 H new ATOM 0 HG3 GLU A 28 -2.836 2.426 15.505 1.00 20.23 H new ATOM 452 N LYS A 29 -5.600 4.285 12.100 1.00 53.01 N ATOM 453 CA LYS A 29 -5.612 5.578 11.422 1.00 53.24 C ATOM 454 C LYS A 29 -6.330 6.609 12.280 1.00 15.32 C ATOM 455 O LYS A 29 -6.042 7.804 12.214 1.00 61.42 O ATOM 456 CB LYS A 29 -6.311 5.459 10.061 1.00 64.24 C ATOM 457 CG LYS A 29 -6.106 6.744 9.240 1.00 14.12 C ATOM 458 CD LYS A 29 -4.778 6.674 8.476 1.00 44.31 C ATOM 459 CE LYS A 29 -4.611 7.936 7.628 1.00 43.22 C ATOM 460 NZ LYS A 29 -3.544 7.713 6.612 1.00 33.11 N ATOM 0 H LYS A 29 -5.891 3.490 11.531 1.00 53.01 H new ATOM 0 HA LYS A 29 -4.582 5.898 11.263 1.00 53.24 H new ATOM 0 HB2 LYS A 29 -5.914 4.603 9.515 1.00 64.24 H new ATOM 0 HB3 LYS A 29 -7.376 5.278 10.206 1.00 64.24 H new ATOM 0 HG2 LYS A 29 -6.931 6.873 8.540 1.00 14.12 H new ATOM 0 HG3 LYS A 29 -6.110 7.611 9.900 1.00 14.12 H new ATOM 0 HD2 LYS A 29 -3.948 6.581 9.176 1.00 44.31 H new ATOM 0 HD3 LYS A 29 -4.759 5.790 7.839 1.00 44.31 H new ATOM 0 HE2 LYS A 29 -5.551 8.183 7.135 1.00 43.22 H new ATOM 0 HE3 LYS A 29 -4.352 8.783 8.264 1.00 43.22 H new ATOM 0 HZ1 LYS A 29 -3.430 8.571 6.035 1.00 33.11 H new ATOM 0 HZ2 LYS A 29 -2.647 7.497 7.092 1.00 33.11 H new ATOM 0 HZ3 LYS A 29 -3.810 6.916 5.999 1.00 33.11 H new ATOM 474 N ASP A 30 -7.271 6.135 13.080 1.00 25.34 N ATOM 475 CA ASP A 30 -8.040 7.015 13.944 1.00 24.43 C ATOM 476 C ASP A 30 -7.176 7.658 15.032 1.00 2.55 C ATOM 477 O ASP A 30 -7.534 8.716 15.550 1.00 42.30 O ATOM 478 CB ASP A 30 -9.175 6.228 14.600 1.00 21.02 C ATOM 479 CG ASP A 30 -10.105 7.178 15.346 1.00 23.24 C ATOM 480 OD1 ASP A 30 -10.041 8.368 15.081 1.00 64.35 O ATOM 481 OD2 ASP A 30 -10.869 6.703 16.171 1.00 74.02 O ATOM 0 H ASP A 30 -7.520 5.148 13.149 1.00 25.34 H new ATOM 0 HA ASP A 30 -8.441 7.815 13.321 1.00 24.43 H new ATOM 0 HB2 ASP A 30 -9.734 5.680 13.842 1.00 21.02 H new ATOM 0 HB3 ASP A 30 -8.766 5.490 15.290 1.00 21.02 H new ATOM 486 N LYS A 31 -6.060 7.017 15.414 1.00 21.32 N ATOM 487 CA LYS A 31 -5.221 7.575 16.484 1.00 0.23 C ATOM 488 C LYS A 31 -4.043 8.414 15.977 1.00 11.45 C ATOM 489 O LYS A 31 -3.512 9.223 16.738 1.00 4.11 O ATOM 490 CB LYS A 31 -4.737 6.469 17.447 1.00 43.32 C ATOM 491 CG LYS A 31 -3.614 5.624 16.826 1.00 62.53 C ATOM 492 CD LYS A 31 -2.232 6.312 16.993 1.00 44.01 C ATOM 493 CE LYS A 31 -1.531 6.454 15.629 1.00 10.32 C ATOM 494 NZ LYS A 31 -0.691 5.250 15.376 1.00 12.43 N ATOM 0 H LYS A 31 -5.726 6.141 15.013 1.00 21.32 H new ATOM 0 HA LYS A 31 -5.864 8.265 17.031 1.00 0.23 H new ATOM 0 HB2 LYS A 31 -4.382 6.922 18.372 1.00 43.32 H new ATOM 0 HB3 LYS A 31 -5.575 5.823 17.710 1.00 43.32 H new ATOM 0 HG2 LYS A 31 -3.593 4.641 17.297 1.00 62.53 H new ATOM 0 HG3 LYS A 31 -3.818 5.466 15.767 1.00 62.53 H new ATOM 0 HD2 LYS A 31 -2.361 7.295 17.446 1.00 44.01 H new ATOM 0 HD3 LYS A 31 -1.608 5.728 17.670 1.00 44.01 H new ATOM 0 HE2 LYS A 31 -2.272 6.567 14.837 1.00 10.32 H new ATOM 0 HE3 LYS A 31 -0.912 7.351 15.617 1.00 10.32 H new ATOM 0 HZ1 LYS A 31 0.214 5.540 14.953 1.00 12.43 H new ATOM 0 HZ2 LYS A 31 -0.511 4.757 16.274 1.00 12.43 H new ATOM 0 HZ3 LYS A 31 -1.188 4.610 14.724 1.00 12.43 H new ATOM 508 N MET A 32 -3.615 8.262 14.719 1.00 31.34 N ATOM 509 CA MET A 32 -2.483 9.081 14.240 1.00 70.41 C ATOM 510 C MET A 32 -2.957 10.454 13.813 1.00 62.31 C ATOM 511 O MET A 32 -4.139 10.780 13.903 1.00 70.22 O ATOM 512 CB MET A 32 -1.744 8.436 13.043 1.00 62.10 C ATOM 513 CG MET A 32 -2.734 7.987 11.960 1.00 13.23 C ATOM 514 SD MET A 32 -2.024 6.592 11.044 1.00 11.22 S ATOM 515 CE MET A 32 -2.192 5.346 12.346 1.00 23.44 C ATOM 0 H MET A 32 -4.009 7.613 14.038 1.00 31.34 H new ATOM 0 HA MET A 32 -1.792 9.155 15.080 1.00 70.41 H new ATOM 0 HB2 MET A 32 -1.037 9.150 12.620 1.00 62.10 H new ATOM 0 HB3 MET A 32 -1.164 7.580 13.388 1.00 62.10 H new ATOM 0 HG2 MET A 32 -3.681 7.695 12.414 1.00 13.23 H new ATOM 0 HG3 MET A 32 -2.948 8.812 11.281 1.00 13.23 H new ATOM 0 HE1 MET A 32 -1.209 5.109 12.752 1.00 23.44 H new ATOM 0 HE2 MET A 32 -2.829 5.734 13.141 1.00 23.44 H new ATOM 0 HE3 MET A 32 -2.640 4.443 11.930 1.00 23.44 H new ATOM 525 N LYS A 33 -2.012 11.245 13.313 1.00 42.12 N ATOM 526 CA LYS A 33 -2.312 12.578 12.823 1.00 30.03 C ATOM 527 C LYS A 33 -2.168 12.575 11.308 1.00 12.20 C ATOM 528 O LYS A 33 -1.890 11.533 10.712 1.00 73.25 O ATOM 529 CB LYS A 33 -1.369 13.606 13.454 1.00 20.23 C ATOM 530 CG LYS A 33 -1.127 13.244 14.922 1.00 61.45 C ATOM 531 CD LYS A 33 -0.606 14.470 15.675 1.00 71.34 C ATOM 532 CE LYS A 33 0.018 14.032 17.000 1.00 23.54 C ATOM 533 NZ LYS A 33 0.598 15.217 17.692 1.00 3.44 N ATOM 0 H LYS A 33 -1.030 10.981 13.238 1.00 42.12 H new ATOM 0 HA LYS A 33 -3.330 12.854 13.096 1.00 30.03 H new ATOM 0 HB2 LYS A 33 -0.423 13.628 12.913 1.00 20.23 H new ATOM 0 HB3 LYS A 33 -1.801 14.604 13.381 1.00 20.23 H new ATOM 0 HG2 LYS A 33 -2.053 12.892 15.377 1.00 61.45 H new ATOM 0 HG3 LYS A 33 -0.407 12.429 14.992 1.00 61.45 H new ATOM 0 HD2 LYS A 33 0.133 14.994 15.069 1.00 71.34 H new ATOM 0 HD3 LYS A 33 -1.421 15.170 15.859 1.00 71.34 H new ATOM 0 HE2 LYS A 33 -0.736 13.562 17.631 1.00 23.54 H new ATOM 0 HE3 LYS A 33 0.793 13.287 16.820 1.00 23.54 H new ATOM 0 HZ1 LYS A 33 1.322 14.903 18.370 1.00 3.44 H new ATOM 0 HZ2 LYS A 33 1.032 15.851 16.991 1.00 3.44 H new ATOM 0 HZ3 LYS A 33 -0.154 15.725 18.200 1.00 3.44 H new ATOM 547 N MET A 34 -2.370 13.716 10.684 1.00 41.31 N ATOM 548 CA MET A 34 -2.293 13.788 9.236 1.00 33.10 C ATOM 549 C MET A 34 -0.909 13.337 8.749 1.00 63.21 C ATOM 550 O MET A 34 0.092 13.547 9.431 1.00 52.35 O ATOM 551 CB MET A 34 -2.595 15.225 8.825 1.00 34.15 C ATOM 552 CG MET A 34 -1.311 16.047 8.683 1.00 52.42 C ATOM 553 SD MET A 34 -1.736 17.803 8.741 1.00 55.42 S ATOM 554 CE MET A 34 -3.115 17.722 7.572 1.00 62.44 C ATOM 0 H MET A 34 -2.586 14.598 11.148 1.00 41.31 H new ATOM 0 HA MET A 34 -3.020 13.118 8.777 1.00 33.10 H new ATOM 0 HB2 MET A 34 -3.137 15.228 7.880 1.00 34.15 H new ATOM 0 HB3 MET A 34 -3.245 15.688 9.567 1.00 34.15 H new ATOM 0 HG2 MET A 34 -0.614 15.800 9.484 1.00 52.42 H new ATOM 0 HG3 MET A 34 -0.813 15.810 7.743 1.00 52.42 H new ATOM 0 HE1 MET A 34 -3.384 18.730 7.256 1.00 62.44 H new ATOM 0 HE2 MET A 34 -2.820 17.135 6.702 1.00 62.44 H new ATOM 0 HE3 MET A 34 -3.973 17.252 8.053 1.00 62.44 H new ATOM 564 N ALA A 35 -0.866 12.688 7.578 1.00 21.44 N ATOM 565 CA ALA A 35 0.392 12.177 7.028 1.00 44.20 C ATOM 566 C ALA A 35 0.751 12.891 5.730 1.00 64.15 C ATOM 567 O ALA A 35 -0.087 13.560 5.127 1.00 44.52 O ATOM 568 CB ALA A 35 0.260 10.671 6.775 1.00 54.02 C ATOM 0 H ALA A 35 -1.685 12.506 6.997 1.00 21.44 H new ATOM 0 HA ALA A 35 1.189 12.363 7.748 1.00 44.20 H new ATOM 0 HB1 ALA A 35 1.195 10.288 6.366 1.00 54.02 H new ATOM 0 HB2 ALA A 35 0.039 10.162 7.713 1.00 54.02 H new ATOM 0 HB3 ALA A 35 -0.548 10.491 6.066 1.00 54.02 H new ATOM 574 N MET A 36 2.010 12.749 5.309 1.00 5.10 N ATOM 575 CA MET A 36 2.479 13.394 4.080 1.00 73.22 C ATOM 576 C MET A 36 3.221 12.393 3.200 1.00 60.32 C ATOM 577 O MET A 36 3.626 11.321 3.649 1.00 53.43 O ATOM 578 CB MET A 36 3.412 14.587 4.395 1.00 61.43 C ATOM 579 CG MET A 36 3.559 14.771 5.904 1.00 31.25 C ATOM 580 SD MET A 36 2.001 15.384 6.588 1.00 13.52 S ATOM 581 CE MET A 36 2.459 15.216 8.326 1.00 33.51 C ATOM 0 H MET A 36 2.717 12.198 5.796 1.00 5.10 H new ATOM 0 HA MET A 36 1.602 13.765 3.549 1.00 73.22 H new ATOM 0 HB2 MET A 36 4.391 14.418 3.947 1.00 61.43 H new ATOM 0 HB3 MET A 36 3.010 15.497 3.950 1.00 61.43 H new ATOM 0 HG2 MET A 36 3.827 13.824 6.373 1.00 31.25 H new ATOM 0 HG3 MET A 36 4.365 15.473 6.119 1.00 31.25 H new ATOM 0 HE1 MET A 36 1.596 15.442 8.953 1.00 33.51 H new ATOM 0 HE2 MET A 36 2.790 14.195 8.518 1.00 33.51 H new ATOM 0 HE3 MET A 36 3.267 15.909 8.558 1.00 33.51 H new ATOM 591 N ALA A 37 3.392 12.773 1.943 1.00 51.34 N ATOM 592 CA ALA A 37 4.085 11.934 0.978 1.00 13.33 C ATOM 593 C ALA A 37 4.638 12.782 -0.157 1.00 20.11 C ATOM 594 O ALA A 37 4.184 13.899 -0.376 1.00 53.12 O ATOM 595 CB ALA A 37 3.118 10.897 0.407 1.00 24.41 C ATOM 0 H ALA A 37 3.059 13.661 1.567 1.00 51.34 H new ATOM 0 HA ALA A 37 4.909 11.430 1.483 1.00 13.33 H new ATOM 0 HB1 ALA A 37 3.641 10.271 -0.315 1.00 24.41 H new ATOM 0 HB2 ALA A 37 2.733 10.275 1.215 1.00 24.41 H new ATOM 0 HB3 ALA A 37 2.289 11.405 -0.086 1.00 24.41 H new ATOM 601 N ARG A 38 5.605 12.242 -0.888 1.00 10.24 N ATOM 602 CA ARG A 38 6.186 12.976 -2.023 1.00 73.45 C ATOM 603 C ARG A 38 6.430 12.022 -3.179 1.00 34.33 C ATOM 604 O ARG A 38 6.873 10.893 -2.978 1.00 62.01 O ATOM 605 CB ARG A 38 7.486 13.695 -1.633 1.00 70.14 C ATOM 606 CG ARG A 38 8.462 12.723 -0.971 1.00 11.32 C ATOM 607 CD ARG A 38 9.880 13.298 -1.032 1.00 44.30 C ATOM 608 NE ARG A 38 10.829 12.365 -0.434 1.00 70.55 N ATOM 609 CZ ARG A 38 12.121 12.664 -0.343 1.00 72.44 C ATOM 610 NH1 ARG A 38 12.559 13.808 -0.791 1.00 51.41 N ATOM 611 NH2 ARG A 38 12.950 11.813 0.196 1.00 42.02 N ATOM 0 H ARG A 38 6.003 11.317 -0.726 1.00 10.24 H new ATOM 0 HA ARG A 38 5.474 13.742 -2.330 1.00 73.45 H new ATOM 0 HB2 ARG A 38 7.946 14.133 -2.519 1.00 70.14 H new ATOM 0 HB3 ARG A 38 7.263 14.516 -0.951 1.00 70.14 H new ATOM 0 HG2 ARG A 38 8.173 12.551 0.066 1.00 11.32 H new ATOM 0 HG3 ARG A 38 8.428 11.758 -1.476 1.00 11.32 H new ATOM 0 HD2 ARG A 38 10.156 13.495 -2.068 1.00 44.30 H new ATOM 0 HD3 ARG A 38 9.916 14.252 -0.506 1.00 44.30 H new ATOM 0 HE ARG A 38 10.496 11.468 -0.080 1.00 70.55 H new ATOM 0 HH11 ARG A 38 11.910 14.473 -1.211 1.00 51.41 H new ATOM 0 HH12 ARG A 38 13.550 14.037 -0.721 1.00 51.41 H new ATOM 0 HH21 ARG A 38 12.607 10.919 0.547 1.00 42.02 H new ATOM 0 HH22 ARG A 38 13.942 12.042 0.266 1.00 42.02 H new ATOM 625 N ILE A 39 6.095 12.461 -4.390 1.00 25.42 N ATOM 626 CA ILE A 39 6.221 11.648 -5.591 1.00 20.44 C ATOM 627 C ILE A 39 7.169 12.315 -6.578 1.00 41.22 C ATOM 628 O ILE A 39 7.192 13.541 -6.684 1.00 34.24 O ATOM 629 CB ILE A 39 4.838 11.549 -6.182 1.00 51.52 C ATOM 630 CG1 ILE A 39 4.715 10.497 -7.281 1.00 72.33 C ATOM 631 CG2 ILE A 39 4.461 12.871 -6.754 1.00 52.40 C ATOM 632 CD1 ILE A 39 3.255 10.022 -7.304 1.00 61.20 C ATOM 0 H ILE A 39 5.727 13.396 -4.564 1.00 25.42 H new ATOM 0 HA ILE A 39 6.625 10.662 -5.363 1.00 20.44 H new ATOM 0 HB ILE A 39 4.174 11.248 -5.372 1.00 51.52 H new ATOM 0 HG12 ILE A 39 4.997 10.917 -8.247 1.00 72.33 H new ATOM 0 HG13 ILE A 39 5.387 9.661 -7.088 1.00 72.33 H new ATOM 0 HG21 ILE A 39 3.461 12.810 -7.184 1.00 52.40 H new ATOM 0 HG22 ILE A 39 4.471 13.625 -5.966 1.00 52.40 H new ATOM 0 HG23 ILE A 39 5.174 13.148 -7.531 1.00 52.40 H new ATOM 0 HD11 ILE A 39 3.130 9.267 -8.080 1.00 61.20 H new ATOM 0 HD12 ILE A 39 2.997 9.593 -6.336 1.00 61.20 H new ATOM 0 HD13 ILE A 39 2.600 10.868 -7.512 1.00 61.20 H new ATOM 644 N SER A 40 7.935 11.531 -7.306 1.00 55.20 N ATOM 645 CA SER A 40 8.847 12.103 -8.283 1.00 63.41 C ATOM 646 C SER A 40 9.070 11.122 -9.424 1.00 50.51 C ATOM 647 O SER A 40 8.790 9.931 -9.289 1.00 24.20 O ATOM 648 CB SER A 40 10.157 12.468 -7.614 1.00 72.31 C ATOM 649 OG SER A 40 9.890 13.216 -6.435 1.00 21.15 O ATOM 0 H SER A 40 7.948 10.513 -7.245 1.00 55.20 H new ATOM 0 HA SER A 40 8.410 13.012 -8.697 1.00 63.41 H new ATOM 0 HB2 SER A 40 10.716 11.566 -7.367 1.00 72.31 H new ATOM 0 HB3 SER A 40 10.777 13.051 -8.296 1.00 72.31 H new ATOM 0 HG SER A 40 10.735 13.452 -5.999 1.00 21.15 H new ATOM 655 N PHE A 41 9.532 11.629 -10.564 1.00 13.21 N ATOM 656 CA PHE A 41 9.730 10.776 -11.733 1.00 73.23 C ATOM 657 C PHE A 41 11.179 10.341 -11.927 1.00 22.01 C ATOM 658 O PHE A 41 11.931 10.967 -12.675 1.00 31.42 O ATOM 659 CB PHE A 41 9.257 11.515 -12.984 1.00 43.55 C ATOM 660 CG PHE A 41 7.761 11.710 -12.911 1.00 32.33 C ATOM 661 CD1 PHE A 41 7.219 12.628 -12.002 1.00 3.33 C ATOM 662 CD2 PHE A 41 6.914 10.972 -13.749 1.00 22.43 C ATOM 663 CE1 PHE A 41 5.833 12.808 -11.932 1.00 21.03 C ATOM 664 CE2 PHE A 41 5.528 11.152 -13.678 1.00 14.24 C ATOM 665 CZ PHE A 41 4.988 12.070 -12.769 1.00 11.12 C ATOM 0 H PHE A 41 9.773 12.610 -10.703 1.00 13.21 H new ATOM 0 HA PHE A 41 9.146 9.871 -11.565 1.00 73.23 H new ATOM 0 HB2 PHE A 41 9.758 12.480 -13.062 1.00 43.55 H new ATOM 0 HB3 PHE A 41 9.518 10.947 -13.877 1.00 43.55 H new ATOM 0 HD1 PHE A 41 7.871 13.197 -11.355 1.00 3.33 H new ATOM 0 HD2 PHE A 41 7.331 10.264 -14.450 1.00 22.43 H new ATOM 0 HE1 PHE A 41 5.415 13.516 -11.232 1.00 21.03 H new ATOM 0 HE2 PHE A 41 4.875 10.583 -14.324 1.00 14.24 H new ATOM 0 HZ PHE A 41 3.918 12.209 -12.714 1.00 11.12 H new ATOM 675 N LEU A 42 11.543 9.231 -11.293 1.00 72.14 N ATOM 676 CA LEU A 42 12.887 8.689 -11.458 1.00 3.31 C ATOM 677 C LEU A 42 13.104 8.453 -12.945 1.00 2.14 C ATOM 678 O LEU A 42 14.181 8.683 -13.494 1.00 13.22 O ATOM 679 CB LEU A 42 13.025 7.352 -10.722 1.00 63.03 C ATOM 680 CG LEU A 42 13.066 7.568 -9.202 1.00 43.54 C ATOM 681 CD1 LEU A 42 12.620 6.280 -8.492 1.00 20.50 C ATOM 682 CD2 LEU A 42 14.494 7.923 -8.762 1.00 1.35 C ATOM 0 H LEU A 42 10.938 8.696 -10.670 1.00 72.14 H new ATOM 0 HA LEU A 42 13.619 9.386 -11.050 1.00 3.31 H new ATOM 0 HB2 LEU A 42 12.188 6.702 -10.979 1.00 63.03 H new ATOM 0 HB3 LEU A 42 13.934 6.845 -11.047 1.00 63.03 H new ATOM 0 HG LEU A 42 12.395 8.386 -8.938 1.00 43.54 H new ATOM 0 HD11 LEU A 42 12.648 6.431 -7.413 1.00 20.50 H new ATOM 0 HD12 LEU A 42 11.604 6.030 -8.797 1.00 20.50 H new ATOM 0 HD13 LEU A 42 13.291 5.465 -8.762 1.00 20.50 H new ATOM 0 HD21 LEU A 42 14.515 8.075 -7.683 1.00 1.35 H new ATOM 0 HD22 LEU A 42 15.169 7.110 -9.027 1.00 1.35 H new ATOM 0 HD23 LEU A 42 14.813 8.837 -9.263 1.00 1.35 H new ATOM 694 N GLY A 43 12.028 7.996 -13.571 1.00 24.41 N ATOM 695 CA GLY A 43 11.997 7.712 -14.998 1.00 32.34 C ATOM 696 C GLY A 43 10.551 7.481 -15.421 1.00 5.31 C ATOM 697 O GLY A 43 9.694 7.216 -14.579 1.00 55.24 O ATOM 0 H GLY A 43 11.144 7.810 -13.097 1.00 24.41 H new ATOM 0 HA2 GLY A 43 12.426 8.543 -15.558 1.00 32.34 H new ATOM 0 HA3 GLY A 43 12.601 6.832 -15.221 1.00 32.34 H new ATOM 701 N GLU A 44 10.268 7.587 -16.713 1.00 61.02 N ATOM 702 CA GLU A 44 8.903 7.387 -17.187 1.00 43.32 C ATOM 703 C GLU A 44 8.340 6.080 -16.641 1.00 4.12 C ATOM 704 O GLU A 44 7.142 5.972 -16.375 1.00 13.41 O ATOM 705 CB GLU A 44 8.871 7.367 -18.716 1.00 42.22 C ATOM 706 CG GLU A 44 7.420 7.428 -19.199 1.00 2.53 C ATOM 707 CD GLU A 44 6.835 8.809 -18.920 1.00 3.44 C ATOM 708 OE1 GLU A 44 7.581 9.771 -18.992 1.00 73.24 O ATOM 709 OE2 GLU A 44 5.650 8.883 -18.639 1.00 22.15 O ATOM 0 H GLU A 44 10.950 7.806 -17.440 1.00 61.02 H new ATOM 0 HA GLU A 44 8.288 8.213 -16.830 1.00 43.32 H new ATOM 0 HB2 GLU A 44 9.433 8.212 -19.113 1.00 42.22 H new ATOM 0 HB3 GLU A 44 9.351 6.462 -19.088 1.00 42.22 H new ATOM 0 HG2 GLU A 44 7.374 7.213 -20.267 1.00 2.53 H new ATOM 0 HG3 GLU A 44 6.828 6.664 -18.695 1.00 2.53 H new ATOM 716 N ASP A 45 9.214 5.091 -16.463 1.00 41.50 N ATOM 717 CA ASP A 45 8.797 3.794 -15.934 1.00 21.20 C ATOM 718 C ASP A 45 9.310 3.619 -14.510 1.00 63.11 C ATOM 719 O ASP A 45 9.312 2.511 -13.971 1.00 64.22 O ATOM 720 CB ASP A 45 9.332 2.666 -16.824 1.00 33.33 C ATOM 721 CG ASP A 45 10.687 3.057 -17.403 1.00 41.45 C ATOM 722 OD1 ASP A 45 11.317 3.938 -16.843 1.00 62.25 O ATOM 723 OD2 ASP A 45 11.074 2.469 -18.400 1.00 71.02 O ATOM 0 H ASP A 45 10.209 5.162 -16.676 1.00 41.50 H new ATOM 0 HA ASP A 45 7.708 3.753 -15.925 1.00 21.20 H new ATOM 0 HB2 ASP A 45 9.426 1.748 -16.244 1.00 33.33 H new ATOM 0 HB3 ASP A 45 8.628 2.463 -17.631 1.00 33.33 H new ATOM 728 N GLU A 46 9.742 4.720 -13.902 1.00 61.05 N ATOM 729 CA GLU A 46 10.254 4.679 -12.536 1.00 11.53 C ATOM 730 C GLU A 46 9.833 5.925 -11.765 1.00 61.35 C ATOM 731 O GLU A 46 10.205 7.041 -12.120 1.00 31.14 O ATOM 732 CB GLU A 46 11.781 4.589 -12.558 1.00 1.23 C ATOM 733 CG GLU A 46 12.212 3.403 -13.423 1.00 54.41 C ATOM 734 CD GLU A 46 13.725 3.229 -13.352 1.00 4.10 C ATOM 735 OE1 GLU A 46 14.378 4.108 -12.814 1.00 35.14 O ATOM 736 OE2 GLU A 46 14.209 2.220 -13.837 1.00 24.22 O ATOM 0 H GLU A 46 9.748 5.646 -14.330 1.00 61.05 H new ATOM 0 HA GLU A 46 9.840 3.801 -12.040 1.00 11.53 H new ATOM 0 HB2 GLU A 46 12.204 5.513 -12.952 1.00 1.23 H new ATOM 0 HB3 GLU A 46 12.163 4.471 -11.544 1.00 1.23 H new ATOM 0 HG2 GLU A 46 11.717 2.494 -13.081 1.00 54.41 H new ATOM 0 HG3 GLU A 46 11.904 3.565 -14.456 1.00 54.41 H new ATOM 743 N LEU A 47 9.062 5.721 -10.700 1.00 71.31 N ATOM 744 CA LEU A 47 8.596 6.828 -9.865 1.00 10.13 C ATOM 745 C LEU A 47 8.915 6.541 -8.403 1.00 4.12 C ATOM 746 O LEU A 47 8.812 5.401 -7.955 1.00 72.11 O ATOM 747 CB LEU A 47 7.080 7.014 -9.997 1.00 22.32 C ATOM 748 CG LEU A 47 6.640 6.903 -11.459 1.00 12.11 C ATOM 749 CD1 LEU A 47 5.117 6.854 -11.503 1.00 62.32 C ATOM 750 CD2 LEU A 47 7.126 8.118 -12.255 1.00 41.54 C ATOM 0 H LEU A 47 8.746 4.801 -10.394 1.00 71.31 H new ATOM 0 HA LEU A 47 9.103 7.734 -10.198 1.00 10.13 H new ATOM 0 HB2 LEU A 47 6.564 6.262 -9.400 1.00 22.32 H new ATOM 0 HB3 LEU A 47 6.793 7.988 -9.600 1.00 22.32 H new ATOM 0 HG LEU A 47 7.067 6.001 -11.899 1.00 12.11 H new ATOM 0 HD11 LEU A 47 4.785 6.775 -12.538 1.00 62.32 H new ATOM 0 HD12 LEU A 47 4.764 5.989 -10.942 1.00 62.32 H new ATOM 0 HD13 LEU A 47 4.711 7.764 -11.060 1.00 62.32 H new ATOM 0 HD21 LEU A 47 6.806 8.025 -13.293 1.00 41.54 H new ATOM 0 HD22 LEU A 47 6.705 9.027 -11.825 1.00 41.54 H new ATOM 0 HD23 LEU A 47 8.214 8.168 -12.214 1.00 41.54 H new ATOM 762 N LYS A 48 9.297 7.576 -7.665 1.00 22.02 N ATOM 763 CA LYS A 48 9.621 7.416 -6.250 1.00 31.55 C ATOM 764 C LYS A 48 8.516 8.012 -5.386 1.00 12.40 C ATOM 765 O LYS A 48 8.261 9.211 -5.453 1.00 65.42 O ATOM 766 CB LYS A 48 10.948 8.125 -5.948 1.00 74.40 C ATOM 767 CG LYS A 48 11.567 7.571 -4.661 1.00 43.45 C ATOM 768 CD LYS A 48 13.012 8.063 -4.540 1.00 31.23 C ATOM 769 CE LYS A 48 13.029 9.586 -4.380 1.00 60.11 C ATOM 770 NZ LYS A 48 14.341 10.009 -3.814 1.00 23.24 N ATOM 0 H LYS A 48 9.390 8.529 -8.018 1.00 22.02 H new ATOM 0 HA LYS A 48 9.712 6.354 -6.024 1.00 31.55 H new ATOM 0 HB2 LYS A 48 11.639 7.988 -6.780 1.00 74.40 H new ATOM 0 HB3 LYS A 48 10.780 9.197 -5.846 1.00 74.40 H new ATOM 0 HG2 LYS A 48 10.987 7.895 -3.797 1.00 43.45 H new ATOM 0 HG3 LYS A 48 11.542 6.481 -4.672 1.00 43.45 H new ATOM 0 HD2 LYS A 48 13.496 7.593 -3.684 1.00 31.23 H new ATOM 0 HD3 LYS A 48 13.579 7.775 -5.425 1.00 31.23 H new ATOM 0 HE2 LYS A 48 12.865 10.066 -5.345 1.00 60.11 H new ATOM 0 HE3 LYS A 48 12.218 9.903 -3.724 1.00 60.11 H new ATOM 0 HZ1 LYS A 48 14.355 11.043 -3.705 1.00 23.24 H new ATOM 0 HZ2 LYS A 48 14.479 9.561 -2.886 1.00 23.24 H new ATOM 0 HZ3 LYS A 48 15.106 9.719 -4.456 1.00 23.24 H new ATOM 784 N VAL A 49 7.878 7.179 -4.555 1.00 14.01 N ATOM 785 CA VAL A 49 6.817 7.659 -3.664 1.00 20.43 C ATOM 786 C VAL A 49 7.207 7.403 -2.220 1.00 3.24 C ATOM 787 O VAL A 49 7.800 6.378 -1.882 1.00 52.54 O ATOM 788 CB VAL A 49 5.453 7.023 -4.027 1.00 44.02 C ATOM 789 CG1 VAL A 49 4.588 6.763 -2.795 1.00 75.03 C ATOM 790 CG2 VAL A 49 4.680 7.980 -4.925 1.00 0.14 C ATOM 0 H VAL A 49 8.075 6.181 -4.481 1.00 14.01 H new ATOM 0 HA VAL A 49 6.699 8.735 -3.794 1.00 20.43 H new ATOM 0 HB VAL A 49 5.663 6.074 -4.520 1.00 44.02 H new ATOM 0 HG11 VAL A 49 3.642 6.317 -3.102 1.00 75.03 H new ATOM 0 HG12 VAL A 49 5.109 6.082 -2.122 1.00 75.03 H new ATOM 0 HG13 VAL A 49 4.395 7.704 -2.281 1.00 75.03 H new ATOM 0 HG21 VAL A 49 3.718 7.538 -5.185 1.00 0.14 H new ATOM 0 HG22 VAL A 49 4.517 8.921 -4.399 1.00 0.14 H new ATOM 0 HG23 VAL A 49 5.251 8.167 -5.835 1.00 0.14 H new ATOM 800 N SER A 50 6.923 8.395 -1.399 1.00 72.14 N ATOM 801 CA SER A 50 7.290 8.367 0.007 1.00 75.02 C ATOM 802 C SER A 50 6.091 8.557 0.920 1.00 4.34 C ATOM 803 O SER A 50 5.136 9.250 0.562 1.00 74.01 O ATOM 804 CB SER A 50 8.242 9.515 0.229 1.00 34.44 C ATOM 805 OG SER A 50 8.863 9.392 1.502 1.00 73.43 O ATOM 0 H SER A 50 6.432 9.242 -1.685 1.00 72.14 H new ATOM 0 HA SER A 50 7.729 7.397 0.242 1.00 75.02 H new ATOM 0 HB2 SER A 50 8.999 9.527 -0.555 1.00 34.44 H new ATOM 0 HB3 SER A 50 7.704 10.461 0.167 1.00 34.44 H new ATOM 0 HG SER A 50 8.728 8.484 1.845 1.00 73.43 H new ATOM 811 N TYR A 51 6.170 7.967 2.117 1.00 10.20 N ATOM 812 CA TYR A 51 5.099 8.094 3.105 1.00 41.44 C ATOM 813 C TYR A 51 5.638 8.613 4.436 1.00 60.13 C ATOM 814 O TYR A 51 6.641 8.113 4.948 1.00 44.53 O ATOM 815 CB TYR A 51 4.440 6.737 3.379 1.00 53.10 C ATOM 816 CG TYR A 51 4.265 5.950 2.106 1.00 1.24 C ATOM 817 CD1 TYR A 51 3.613 6.525 1.018 1.00 1.03 C ATOM 818 CD2 TYR A 51 4.729 4.630 2.029 1.00 14.40 C ATOM 819 CE1 TYR A 51 3.424 5.785 -0.151 1.00 5.12 C ATOM 820 CE2 TYR A 51 4.545 3.892 0.857 1.00 23.14 C ATOM 821 CZ TYR A 51 3.890 4.470 -0.234 1.00 5.10 C ATOM 822 OH TYR A 51 3.699 3.742 -1.389 1.00 41.31 O ATOM 0 H TYR A 51 6.961 7.400 2.422 1.00 10.20 H new ATOM 0 HA TYR A 51 4.373 8.794 2.690 1.00 41.44 H new ATOM 0 HB2 TYR A 51 5.050 6.168 4.080 1.00 53.10 H new ATOM 0 HB3 TYR A 51 3.470 6.890 3.852 1.00 53.10 H new ATOM 0 HD1 TYR A 51 3.254 7.542 1.078 1.00 1.03 H new ATOM 0 HD2 TYR A 51 5.229 4.183 2.876 1.00 14.40 H new ATOM 0 HE1 TYR A 51 2.916 6.230 -0.994 1.00 5.12 H new ATOM 0 HE2 TYR A 51 4.908 2.877 0.794 1.00 23.14 H new ATOM 0 HH TYR A 51 4.212 4.147 -2.119 1.00 41.31 H new ATOM 832 N ALA A 52 4.938 9.583 5.012 1.00 1.20 N ATOM 833 CA ALA A 52 5.311 10.135 6.312 1.00 61.54 C ATOM 834 C ALA A 52 4.118 9.997 7.248 1.00 33.01 C ATOM 835 O ALA A 52 3.106 10.675 7.067 1.00 4.12 O ATOM 836 CB ALA A 52 5.705 11.611 6.171 1.00 64.52 C ATOM 0 H ALA A 52 4.106 10.006 4.599 1.00 1.20 H new ATOM 0 HA ALA A 52 6.168 9.594 6.714 1.00 61.54 H new ATOM 0 HB1 ALA A 52 5.980 12.009 7.148 1.00 64.52 H new ATOM 0 HB2 ALA A 52 6.553 11.698 5.491 1.00 64.52 H new ATOM 0 HB3 ALA A 52 4.862 12.176 5.774 1.00 64.52 H new ATOM 842 N VAL A 53 4.218 9.098 8.230 1.00 1.11 N ATOM 843 CA VAL A 53 3.113 8.866 9.160 1.00 2.13 C ATOM 844 C VAL A 53 3.509 9.240 10.593 1.00 53.41 C ATOM 845 O VAL A 53 4.434 8.650 11.150 1.00 65.45 O ATOM 846 CB VAL A 53 2.728 7.383 9.126 1.00 3.43 C ATOM 847 CG1 VAL A 53 1.336 7.198 9.734 1.00 41.12 C ATOM 848 CG2 VAL A 53 2.720 6.887 7.678 1.00 53.35 C ATOM 0 H VAL A 53 5.044 8.525 8.400 1.00 1.11 H new ATOM 0 HA VAL A 53 2.272 9.489 8.855 1.00 2.13 H new ATOM 0 HB VAL A 53 3.455 6.811 9.703 1.00 3.43 H new ATOM 0 HG11 VAL A 53 1.065 6.143 9.708 1.00 41.12 H new ATOM 0 HG12 VAL A 53 1.341 7.546 10.767 1.00 41.12 H new ATOM 0 HG13 VAL A 53 0.609 7.773 9.160 1.00 41.12 H new ATOM 0 HG21 VAL A 53 2.446 5.832 7.656 1.00 53.35 H new ATOM 0 HG22 VAL A 53 1.996 7.462 7.100 1.00 53.35 H new ATOM 0 HG23 VAL A 53 3.712 7.013 7.245 1.00 53.35 H new ATOM 858 N PRO A 54 2.829 10.180 11.212 1.00 24.31 N ATOM 859 CA PRO A 54 3.136 10.585 12.611 1.00 4.44 C ATOM 860 C PRO A 54 2.547 9.599 13.617 1.00 44.22 C ATOM 861 O PRO A 54 1.384 9.211 13.510 1.00 43.31 O ATOM 862 CB PRO A 54 2.477 11.958 12.737 1.00 70.12 C ATOM 863 CG PRO A 54 1.320 11.920 11.794 1.00 63.40 C ATOM 864 CD PRO A 54 1.705 10.964 10.660 1.00 21.22 C ATOM 0 HA PRO A 54 4.206 10.605 12.819 1.00 4.44 H new ATOM 0 HB2 PRO A 54 2.147 12.145 13.759 1.00 70.12 H new ATOM 0 HB3 PRO A 54 3.173 12.755 12.476 1.00 70.12 H new ATOM 0 HG2 PRO A 54 0.419 11.575 12.301 1.00 63.40 H new ATOM 0 HG3 PRO A 54 1.106 12.915 11.405 1.00 63.40 H new ATOM 0 HD2 PRO A 54 0.870 10.321 10.381 1.00 21.22 H new ATOM 0 HD3 PRO A 54 2.002 11.509 9.764 1.00 21.22 H new ATOM 872 N LYS A 55 3.354 9.197 14.593 1.00 32.12 N ATOM 873 CA LYS A 55 2.899 8.258 15.610 1.00 22.13 C ATOM 874 C LYS A 55 3.555 8.572 16.949 1.00 34.53 C ATOM 875 O LYS A 55 4.557 7.960 17.302 1.00 63.23 O ATOM 876 CB LYS A 55 3.257 6.829 15.195 1.00 52.02 C ATOM 877 CG LYS A 55 2.552 5.838 16.123 1.00 33.05 C ATOM 878 CD LYS A 55 2.784 4.412 15.621 1.00 65.33 C ATOM 879 CE LYS A 55 2.054 3.424 16.532 1.00 43.42 C ATOM 880 NZ LYS A 55 2.009 2.085 15.878 1.00 50.10 N ATOM 0 H LYS A 55 4.320 9.505 14.701 1.00 32.12 H new ATOM 0 HA LYS A 55 1.818 8.350 15.710 1.00 22.13 H new ATOM 0 HB2 LYS A 55 2.957 6.653 14.162 1.00 52.02 H new ATOM 0 HB3 LYS A 55 4.336 6.684 15.243 1.00 52.02 H new ATOM 0 HG2 LYS A 55 2.931 5.943 17.139 1.00 33.05 H new ATOM 0 HG3 LYS A 55 1.484 6.053 16.158 1.00 33.05 H new ATOM 0 HD2 LYS A 55 2.424 4.313 14.597 1.00 65.33 H new ATOM 0 HD3 LYS A 55 3.851 4.189 15.607 1.00 65.33 H new ATOM 0 HE2 LYS A 55 2.564 3.354 17.493 1.00 43.42 H new ATOM 0 HE3 LYS A 55 1.042 3.777 16.732 1.00 43.42 H new ATOM 0 HZ1 LYS A 55 2.106 1.343 16.600 1.00 50.10 H new ATOM 0 HZ2 LYS A 55 1.101 1.971 15.383 1.00 50.10 H new ATOM 0 HZ3 LYS A 55 2.789 2.006 15.194 1.00 50.10 H new ATOM 894 N PRO A 56 3.027 9.510 17.694 1.00 52.11 N ATOM 895 CA PRO A 56 3.596 9.894 19.016 1.00 72.53 C ATOM 896 C PRO A 56 4.121 8.690 19.800 1.00 42.15 C ATOM 897 O PRO A 56 4.966 8.837 20.684 1.00 61.53 O ATOM 898 CB PRO A 56 2.407 10.542 19.722 1.00 62.43 C ATOM 899 CG PRO A 56 1.614 11.177 18.624 1.00 42.35 C ATOM 900 CD PRO A 56 1.833 10.320 17.368 1.00 12.24 C ATOM 0 HA PRO A 56 4.461 10.551 18.924 1.00 72.53 H new ATOM 0 HB2 PRO A 56 1.815 9.802 20.261 1.00 62.43 H new ATOM 0 HB3 PRO A 56 2.735 11.282 20.452 1.00 62.43 H new ATOM 0 HG2 PRO A 56 0.556 11.218 18.885 1.00 42.35 H new ATOM 0 HG3 PRO A 56 1.941 12.203 18.454 1.00 42.35 H new ATOM 0 HD2 PRO A 56 0.968 9.690 17.158 1.00 12.24 H new ATOM 0 HD3 PRO A 56 1.999 10.939 16.486 1.00 12.24 H new ATOM 908 N ASN A 57 3.617 7.503 19.472 1.00 21.20 N ATOM 909 CA ASN A 57 4.043 6.280 20.152 1.00 5.00 C ATOM 910 C ASN A 57 5.173 5.599 19.383 1.00 71.00 C ATOM 911 O ASN A 57 5.469 4.425 19.608 1.00 41.55 O ATOM 912 CB ASN A 57 2.860 5.318 20.278 1.00 61.55 C ATOM 913 CG ASN A 57 1.735 5.977 21.070 1.00 51.04 C ATOM 914 OD1 ASN A 57 1.992 6.675 22.050 1.00 74.33 O ATOM 915 ND2 ASN A 57 0.497 5.794 20.700 1.00 63.44 N ATOM 0 H ASN A 57 2.917 7.361 18.744 1.00 21.20 H new ATOM 0 HA ASN A 57 4.406 6.547 21.144 1.00 5.00 H new ATOM 0 HB2 ASN A 57 2.502 5.036 19.288 1.00 61.55 H new ATOM 0 HB3 ASN A 57 3.177 4.401 20.775 1.00 61.55 H new ATOM 0 HD21 ASN A 57 -0.262 6.230 21.224 1.00 63.44 H new ATOM 0 HD22 ASN A 57 0.288 5.215 19.887 1.00 63.44 H new ATOM 922 N GLY A 58 5.798 6.341 18.473 1.00 21.40 N ATOM 923 CA GLY A 58 6.894 5.805 17.668 1.00 65.22 C ATOM 924 C GLY A 58 6.760 6.250 16.215 1.00 22.03 C ATOM 925 O GLY A 58 6.399 5.459 15.345 1.00 54.50 O ATOM 0 H GLY A 58 5.565 7.314 18.274 1.00 21.40 H new ATOM 0 HA2 GLY A 58 7.848 6.144 18.071 1.00 65.22 H new ATOM 0 HA3 GLY A 58 6.894 4.716 17.722 1.00 65.22 H new ATOM 929 N CYS A 59 7.049 7.522 15.962 1.00 54.34 N ATOM 930 CA CYS A 59 6.955 8.067 14.611 1.00 51.21 C ATOM 931 C CYS A 59 7.696 7.177 13.618 1.00 31.45 C ATOM 932 O CYS A 59 8.759 6.638 13.925 1.00 44.11 O ATOM 933 CB CYS A 59 7.548 9.477 14.577 1.00 1.22 C ATOM 934 SG CYS A 59 7.271 10.208 12.945 1.00 70.24 S ATOM 0 H CYS A 59 7.349 8.192 16.670 1.00 54.34 H new ATOM 0 HA CYS A 59 5.903 8.106 14.328 1.00 51.21 H new ATOM 0 HB2 CYS A 59 7.087 10.096 15.347 1.00 1.22 H new ATOM 0 HB3 CYS A 59 8.615 9.440 14.794 1.00 1.22 H new ATOM 939 N ARG A 60 7.125 7.027 12.421 1.00 40.34 N ATOM 940 CA ARG A 60 7.736 6.199 11.381 1.00 42.44 C ATOM 941 C ARG A 60 7.767 6.946 10.049 1.00 63.14 C ATOM 942 O ARG A 60 6.729 7.360 9.532 1.00 64.13 O ATOM 943 CB ARG A 60 6.949 4.895 11.217 1.00 33.31 C ATOM 944 CG ARG A 60 7.243 3.964 12.395 1.00 55.20 C ATOM 945 CD ARG A 60 6.575 2.609 12.153 1.00 43.01 C ATOM 946 NE ARG A 60 6.878 1.693 13.249 1.00 23.22 N ATOM 947 CZ ARG A 60 6.164 1.699 14.370 1.00 44.41 C ATOM 948 NH1 ARG A 60 5.170 2.533 14.507 1.00 33.41 N ATOM 949 NH2 ARG A 60 6.458 0.872 15.335 1.00 34.22 N ATOM 0 H ARG A 60 6.245 7.466 12.149 1.00 40.34 H new ATOM 0 HA ARG A 60 8.758 5.970 11.682 1.00 42.44 H new ATOM 0 HB2 ARG A 60 5.881 5.107 11.166 1.00 33.31 H new ATOM 0 HB3 ARG A 60 7.222 4.409 10.280 1.00 33.31 H new ATOM 0 HG2 ARG A 60 8.319 3.835 12.511 1.00 55.20 H new ATOM 0 HG3 ARG A 60 6.873 4.404 13.321 1.00 55.20 H new ATOM 0 HD2 ARG A 60 5.496 2.738 12.065 1.00 43.01 H new ATOM 0 HD3 ARG A 60 6.923 2.187 11.210 1.00 43.01 H new ATOM 0 HE ARG A 60 7.652 1.036 13.152 1.00 23.22 H new ATOM 0 HH11 ARG A 60 4.940 3.181 13.753 1.00 33.41 H new ATOM 0 HH12 ARG A 60 4.623 2.537 15.368 1.00 33.41 H new ATOM 0 HH21 ARG A 60 7.236 0.221 15.229 1.00 34.22 H new ATOM 0 HH22 ARG A 60 5.910 0.877 16.195 1.00 34.22 H new ATOM 963 N LYS A 61 8.967 7.101 9.496 1.00 74.25 N ATOM 964 CA LYS A 61 9.141 7.787 8.216 1.00 1.21 C ATOM 965 C LYS A 61 10.072 6.985 7.312 1.00 72.44 C ATOM 966 O LYS A 61 11.134 6.539 7.746 1.00 43.24 O ATOM 967 CB LYS A 61 9.721 9.186 8.446 1.00 73.32 C ATOM 968 CG LYS A 61 10.835 9.112 9.493 1.00 34.44 C ATOM 969 CD LYS A 61 11.603 10.437 9.519 1.00 35.33 C ATOM 970 CE LYS A 61 10.682 11.561 10.000 1.00 45.45 C ATOM 971 NZ LYS A 61 11.506 12.721 10.444 1.00 23.33 N ATOM 0 H LYS A 61 9.834 6.762 9.913 1.00 74.25 H new ATOM 0 HA LYS A 61 8.168 7.878 7.732 1.00 1.21 H new ATOM 0 HB2 LYS A 61 10.112 9.587 7.511 1.00 73.32 H new ATOM 0 HB3 LYS A 61 8.937 9.865 8.781 1.00 73.32 H new ATOM 0 HG2 LYS A 61 10.411 8.906 10.476 1.00 34.44 H new ATOM 0 HG3 LYS A 61 11.513 8.291 9.260 1.00 34.44 H new ATOM 0 HD2 LYS A 61 12.466 10.354 10.179 1.00 35.33 H new ATOM 0 HD3 LYS A 61 11.983 10.667 8.524 1.00 35.33 H new ATOM 0 HE2 LYS A 61 10.010 11.864 9.197 1.00 45.45 H new ATOM 0 HE3 LYS A 61 10.058 11.208 10.821 1.00 45.45 H new ATOM 0 HZ1 LYS A 61 10.881 13.486 10.771 1.00 23.33 H new ATOM 0 HZ2 LYS A 61 12.129 12.426 11.222 1.00 23.33 H new ATOM 0 HZ3 LYS A 61 12.083 13.062 9.649 1.00 23.33 H new ATOM 985 N TRP A 62 9.676 6.802 6.054 1.00 45.33 N ATOM 986 CA TRP A 62 10.502 6.049 5.118 1.00 74.52 C ATOM 987 C TRP A 62 10.141 6.388 3.672 1.00 14.12 C ATOM 988 O TRP A 62 9.226 7.171 3.412 1.00 0.00 O ATOM 989 CB TRP A 62 10.372 4.536 5.403 1.00 72.22 C ATOM 990 CG TRP A 62 9.479 3.859 4.407 1.00 40.11 C ATOM 991 CD1 TRP A 62 8.218 4.239 4.097 1.00 73.32 C ATOM 992 CD2 TRP A 62 9.762 2.681 3.599 1.00 70.44 C ATOM 993 NE1 TRP A 62 7.710 3.367 3.149 1.00 14.14 N ATOM 994 CE2 TRP A 62 8.625 2.390 2.810 1.00 2.15 C ATOM 995 CE3 TRP A 62 10.887 1.844 3.474 1.00 11.01 C ATOM 996 CZ2 TRP A 62 8.603 1.308 1.929 1.00 14.44 C ATOM 997 CZ3 TRP A 62 10.869 0.755 2.589 1.00 24.14 C ATOM 998 CH2 TRP A 62 9.728 0.487 1.819 1.00 70.52 C ATOM 0 H TRP A 62 8.803 7.159 5.666 1.00 45.33 H new ATOM 0 HA TRP A 62 11.545 6.332 5.259 1.00 74.52 H new ATOM 0 HB2 TRP A 62 11.359 4.075 5.379 1.00 72.22 H new ATOM 0 HB3 TRP A 62 9.975 4.388 6.407 1.00 72.22 H new ATOM 0 HD1 TRP A 62 7.694 5.084 4.519 1.00 73.32 H new ATOM 0 HE1 TRP A 62 6.774 3.438 2.750 1.00 14.14 H new ATOM 0 HE3 TRP A 62 11.770 2.041 4.063 1.00 11.01 H new ATOM 0 HZ2 TRP A 62 7.723 1.107 1.337 1.00 14.44 H new ATOM 0 HZ3 TRP A 62 11.738 0.120 2.500 1.00 24.14 H new ATOM 0 HH2 TRP A 62 9.719 -0.354 1.141 1.00 70.52 H new ATOM 1009 N GLU A 63 10.882 5.795 2.743 1.00 12.11 N ATOM 1010 CA GLU A 63 10.664 6.031 1.315 1.00 40.41 C ATOM 1011 C GLU A 63 10.319 4.733 0.592 1.00 43.12 C ATOM 1012 O GLU A 63 10.527 3.641 1.122 1.00 43.41 O ATOM 1013 CB GLU A 63 11.923 6.647 0.700 1.00 23.13 C ATOM 1014 CG GLU A 63 11.647 7.061 -0.748 1.00 20.21 C ATOM 1015 CD GLU A 63 12.732 8.019 -1.227 1.00 53.42 C ATOM 1016 OE1 GLU A 63 13.868 7.590 -1.338 1.00 63.30 O ATOM 1017 OE2 GLU A 63 12.410 9.170 -1.478 1.00 2.33 O ATOM 0 H GLU A 63 11.641 5.146 2.950 1.00 12.11 H new ATOM 0 HA GLU A 63 9.825 6.718 1.203 1.00 40.41 H new ATOM 0 HB2 GLU A 63 12.236 7.514 1.282 1.00 23.13 H new ATOM 0 HB3 GLU A 63 12.743 5.929 0.732 1.00 23.13 H new ATOM 0 HG2 GLU A 63 11.619 6.180 -1.389 1.00 20.21 H new ATOM 0 HG3 GLU A 63 10.670 7.539 -0.819 1.00 20.21 H new ATOM 1024 N THR A 64 9.784 4.862 -0.620 1.00 42.12 N ATOM 1025 CA THR A 64 9.403 3.697 -1.413 1.00 71.14 C ATOM 1026 C THR A 64 9.507 4.007 -2.905 1.00 41.23 C ATOM 1027 O THR A 64 9.216 5.121 -3.339 1.00 12.21 O ATOM 1028 CB THR A 64 7.968 3.293 -1.074 1.00 35.44 C ATOM 1029 OG1 THR A 64 7.821 3.222 0.337 1.00 34.22 O ATOM 1030 CG2 THR A 64 7.656 1.930 -1.693 1.00 54.24 C ATOM 0 H THR A 64 9.605 5.758 -1.073 1.00 42.12 H new ATOM 0 HA THR A 64 10.081 2.877 -1.177 1.00 71.14 H new ATOM 0 HB THR A 64 7.277 4.034 -1.476 1.00 35.44 H new ATOM 0 HG1 THR A 64 8.662 2.920 0.739 1.00 34.22 H new ATOM 0 HG21 THR A 64 6.632 1.645 -1.449 1.00 54.24 H new ATOM 0 HG22 THR A 64 7.769 1.988 -2.776 1.00 54.24 H new ATOM 0 HG23 THR A 64 8.344 1.184 -1.296 1.00 54.24 H new ATOM 1038 N THR A 65 9.927 3.012 -3.688 1.00 41.52 N ATOM 1039 CA THR A 65 10.071 3.188 -5.135 1.00 24.34 C ATOM 1040 C THR A 65 8.922 2.516 -5.886 1.00 43.03 C ATOM 1041 O THR A 65 8.629 1.342 -5.663 1.00 10.41 O ATOM 1042 CB THR A 65 11.400 2.585 -5.598 1.00 43.01 C ATOM 1043 OG1 THR A 65 12.458 3.118 -4.815 1.00 31.24 O ATOM 1044 CG2 THR A 65 11.632 2.925 -7.072 1.00 44.02 C ATOM 0 H THR A 65 10.172 2.082 -3.348 1.00 41.52 H new ATOM 0 HA THR A 65 10.051 4.256 -5.352 1.00 24.34 H new ATOM 0 HB THR A 65 11.369 1.502 -5.479 1.00 43.01 H new ATOM 0 HG1 THR A 65 13.309 2.732 -5.109 1.00 31.24 H new ATOM 0 HG21 THR A 65 12.578 2.495 -7.400 1.00 44.02 H new ATOM 0 HG22 THR A 65 10.820 2.515 -7.672 1.00 44.02 H new ATOM 0 HG23 THR A 65 11.663 4.008 -7.195 1.00 44.02 H new ATOM 1052 N PHE A 66 8.272 3.271 -6.777 1.00 12.55 N ATOM 1053 CA PHE A 66 7.152 2.749 -7.561 1.00 53.42 C ATOM 1054 C PHE A 66 7.479 2.819 -9.052 1.00 14.12 C ATOM 1055 O PHE A 66 7.983 3.831 -9.532 1.00 11.14 O ATOM 1056 CB PHE A 66 5.898 3.594 -7.288 1.00 20.52 C ATOM 1057 CG PHE A 66 5.205 3.113 -6.037 1.00 41.12 C ATOM 1058 CD1 PHE A 66 5.767 3.373 -4.783 1.00 62.12 C ATOM 1059 CD2 PHE A 66 3.997 2.413 -6.133 1.00 51.21 C ATOM 1060 CE1 PHE A 66 5.119 2.931 -3.625 1.00 10.11 C ATOM 1061 CE2 PHE A 66 3.351 1.972 -4.975 1.00 13.11 C ATOM 1062 CZ PHE A 66 3.912 2.231 -3.721 1.00 21.23 C ATOM 0 H PHE A 66 8.503 4.245 -6.972 1.00 12.55 H new ATOM 0 HA PHE A 66 6.974 1.712 -7.275 1.00 53.42 H new ATOM 0 HB2 PHE A 66 6.174 4.643 -7.178 1.00 20.52 H new ATOM 0 HB3 PHE A 66 5.217 3.531 -8.137 1.00 20.52 H new ATOM 0 HD1 PHE A 66 6.699 3.914 -4.709 1.00 62.12 H new ATOM 0 HD2 PHE A 66 3.564 2.214 -7.102 1.00 51.21 H new ATOM 0 HE1 PHE A 66 5.551 3.130 -2.656 1.00 10.11 H new ATOM 0 HE2 PHE A 66 2.419 1.431 -5.049 1.00 13.11 H new ATOM 0 HZ PHE A 66 3.413 1.890 -2.826 1.00 21.23 H new ATOM 1072 N LYS A 67 7.187 1.740 -9.779 1.00 4.55 N ATOM 1073 CA LYS A 67 7.454 1.696 -11.219 1.00 22.14 C ATOM 1074 C LYS A 67 6.153 1.560 -12.001 1.00 51.00 C ATOM 1075 O LYS A 67 5.210 0.914 -11.545 1.00 74.14 O ATOM 1076 CB LYS A 67 8.358 0.510 -11.555 1.00 64.21 C ATOM 1077 CG LYS A 67 9.748 0.709 -10.935 1.00 74.21 C ATOM 1078 CD LYS A 67 10.775 -0.090 -11.735 1.00 73.23 C ATOM 1079 CE LYS A 67 12.115 -0.088 -10.998 1.00 12.53 C ATOM 1080 NZ LYS A 67 12.454 1.304 -10.589 1.00 31.10 N ATOM 0 H LYS A 67 6.769 0.891 -9.399 1.00 4.55 H new ATOM 0 HA LYS A 67 7.949 2.626 -11.497 1.00 22.14 H new ATOM 0 HB2 LYS A 67 7.914 -0.412 -11.181 1.00 64.21 H new ATOM 0 HB3 LYS A 67 8.446 0.406 -12.636 1.00 64.21 H new ATOM 0 HG2 LYS A 67 10.012 1.767 -10.936 1.00 74.21 H new ATOM 0 HG3 LYS A 67 9.745 0.382 -9.895 1.00 74.21 H new ATOM 0 HD2 LYS A 67 10.426 -1.113 -11.874 1.00 73.23 H new ATOM 0 HD3 LYS A 67 10.894 0.343 -12.728 1.00 73.23 H new ATOM 0 HE2 LYS A 67 12.061 -0.733 -10.121 1.00 12.53 H new ATOM 0 HE3 LYS A 67 12.897 -0.490 -11.642 1.00 12.53 H new ATOM 0 HZ1 LYS A 67 13.483 1.443 -10.649 1.00 31.10 H new ATOM 0 HZ2 LYS A 67 11.976 1.978 -11.221 1.00 31.10 H new ATOM 0 HZ3 LYS A 67 12.140 1.465 -9.611 1.00 31.10 H new ATOM 1094 N LYS A 68 6.102 2.186 -13.172 1.00 42.54 N ATOM 1095 CA LYS A 68 4.898 2.139 -13.997 1.00 11.20 C ATOM 1096 C LYS A 68 4.709 0.757 -14.615 1.00 14.51 C ATOM 1097 O LYS A 68 5.630 0.199 -15.212 1.00 52.12 O ATOM 1098 CB LYS A 68 4.981 3.187 -15.111 1.00 72.34 C ATOM 1099 CG LYS A 68 3.582 3.456 -15.670 1.00 60.01 C ATOM 1100 CD LYS A 68 3.681 4.425 -16.850 1.00 21.14 C ATOM 1101 CE LYS A 68 2.276 4.770 -17.349 1.00 14.22 C ATOM 1102 NZ LYS A 68 1.567 5.579 -16.317 1.00 41.20 N ATOM 0 H LYS A 68 6.871 2.727 -13.569 1.00 42.54 H new ATOM 0 HA LYS A 68 4.044 2.353 -13.355 1.00 11.20 H new ATOM 0 HB2 LYS A 68 5.412 4.110 -14.724 1.00 72.34 H new ATOM 0 HB3 LYS A 68 5.640 2.836 -15.906 1.00 72.34 H new ATOM 0 HG2 LYS A 68 3.121 2.522 -15.991 1.00 60.01 H new ATOM 0 HG3 LYS A 68 2.943 3.876 -14.893 1.00 60.01 H new ATOM 0 HD2 LYS A 68 4.203 5.332 -16.546 1.00 21.14 H new ATOM 0 HD3 LYS A 68 4.264 3.976 -17.654 1.00 21.14 H new ATOM 0 HE2 LYS A 68 2.337 5.327 -18.284 1.00 14.22 H new ATOM 0 HE3 LYS A 68 1.718 3.857 -17.557 1.00 14.22 H new ATOM 0 HZ1 LYS A 68 0.665 5.120 -16.076 1.00 41.20 H new ATOM 0 HZ2 LYS A 68 2.159 5.650 -15.465 1.00 41.20 H new ATOM 0 HZ3 LYS A 68 1.382 6.532 -16.690 1.00 41.20 H new ATOM 1116 N THR A 69 3.502 0.216 -14.470 1.00 33.34 N ATOM 1117 CA THR A 69 3.178 -1.099 -15.017 1.00 0.52 C ATOM 1118 C THR A 69 1.896 -1.025 -15.838 1.00 24.32 C ATOM 1119 O THR A 69 1.215 0.001 -15.849 1.00 12.35 O ATOM 1120 CB THR A 69 2.997 -2.106 -13.879 1.00 72.31 C ATOM 1121 OG1 THR A 69 2.575 -3.352 -14.415 1.00 33.32 O ATOM 1122 CG2 THR A 69 1.943 -1.585 -12.901 1.00 43.53 C ATOM 0 H THR A 69 2.731 0.668 -13.978 1.00 33.34 H new ATOM 0 HA THR A 69 3.997 -1.422 -15.660 1.00 0.52 H new ATOM 0 HB THR A 69 3.943 -2.239 -13.354 1.00 72.31 H new ATOM 0 HG1 THR A 69 2.460 -3.999 -13.688 1.00 33.32 H new ATOM 0 HG21 THR A 69 1.813 -2.302 -12.090 1.00 43.53 H new ATOM 0 HG22 THR A 69 2.268 -0.628 -12.492 1.00 43.53 H new ATOM 0 HG23 THR A 69 0.996 -1.453 -13.423 1.00 43.53 H new ATOM 1130 N SER A 70 1.567 -2.117 -16.522 1.00 73.34 N ATOM 1131 CA SER A 70 0.356 -2.163 -17.339 1.00 21.14 C ATOM 1132 C SER A 70 -0.774 -2.836 -16.574 1.00 62.34 C ATOM 1133 O SER A 70 -1.857 -3.056 -17.115 1.00 33.02 O ATOM 1134 CB SER A 70 0.627 -2.927 -18.635 1.00 1.13 C ATOM 1135 OG SER A 70 -0.443 -2.706 -19.544 1.00 23.12 O ATOM 0 H SER A 70 2.116 -2.976 -16.528 1.00 73.34 H new ATOM 0 HA SER A 70 0.061 -1.142 -17.579 1.00 21.14 H new ATOM 0 HB2 SER A 70 1.568 -2.596 -19.076 1.00 1.13 H new ATOM 0 HB3 SER A 70 0.729 -3.992 -18.428 1.00 1.13 H new ATOM 0 HG SER A 70 -1.282 -2.618 -19.046 1.00 23.12 H new ATOM 1141 N ASP A 71 -0.492 -3.173 -15.318 1.00 22.24 N ATOM 1142 CA ASP A 71 -1.458 -3.845 -14.440 1.00 64.20 C ATOM 1143 C ASP A 71 -2.900 -3.666 -14.913 1.00 33.31 C ATOM 1144 O ASP A 71 -3.656 -4.634 -14.972 1.00 53.13 O ATOM 1145 CB ASP A 71 -1.325 -3.309 -13.014 1.00 73.54 C ATOM 1146 CG ASP A 71 -2.064 -4.223 -12.043 1.00 60.01 C ATOM 1147 OD1 ASP A 71 -3.273 -4.328 -12.162 1.00 13.14 O ATOM 1148 OD2 ASP A 71 -1.409 -4.805 -11.194 1.00 12.33 O ATOM 0 H ASP A 71 0.409 -2.990 -14.877 1.00 22.24 H new ATOM 0 HA ASP A 71 -1.229 -4.910 -14.469 1.00 64.20 H new ATOM 0 HB2 ASP A 71 -0.273 -3.245 -12.737 1.00 73.54 H new ATOM 0 HB3 ASP A 71 -1.731 -2.299 -12.957 1.00 73.54 H new ATOM 1153 N ASP A 72 -3.280 -2.436 -15.252 1.00 44.42 N ATOM 1154 CA ASP A 72 -4.638 -2.175 -15.717 1.00 32.43 C ATOM 1155 C ASP A 72 -4.776 -0.724 -16.155 1.00 74.41 C ATOM 1156 O ASP A 72 -5.176 0.140 -15.375 1.00 20.14 O ATOM 1157 CB ASP A 72 -5.643 -2.479 -14.608 1.00 3.42 C ATOM 1158 CG ASP A 72 -7.042 -2.040 -15.030 1.00 4.12 C ATOM 1159 OD1 ASP A 72 -7.698 -2.803 -15.719 1.00 4.42 O ATOM 1160 OD2 ASP A 72 -7.437 -0.948 -14.656 1.00 4.41 O ATOM 0 H ASP A 72 -2.675 -1.615 -15.214 1.00 44.42 H new ATOM 0 HA ASP A 72 -4.843 -2.823 -16.569 1.00 32.43 H new ATOM 0 HB2 ASP A 72 -5.640 -3.546 -14.387 1.00 3.42 H new ATOM 0 HB3 ASP A 72 -5.353 -1.963 -13.693 1.00 3.42 H new ATOM 1165 N GLY A 73 -4.445 -0.470 -17.411 1.00 74.51 N ATOM 1166 CA GLY A 73 -4.534 0.877 -17.961 1.00 13.45 C ATOM 1167 C GLY A 73 -3.335 1.724 -17.543 1.00 4.30 C ATOM 1168 O GLY A 73 -2.235 1.562 -18.070 1.00 13.04 O ATOM 0 H GLY A 73 -4.113 -1.175 -18.069 1.00 74.51 H new ATOM 0 HA2 GLY A 73 -4.585 0.826 -19.049 1.00 13.45 H new ATOM 0 HA3 GLY A 73 -5.454 1.352 -17.621 1.00 13.45 H new ATOM 1172 N GLU A 74 -3.556 2.616 -16.579 1.00 34.54 N ATOM 1173 CA GLU A 74 -2.490 3.482 -16.070 1.00 24.41 C ATOM 1174 C GLU A 74 -2.328 3.289 -14.565 1.00 21.41 C ATOM 1175 O GLU A 74 -3.008 3.947 -13.777 1.00 30.23 O ATOM 1176 CB GLU A 74 -2.826 4.945 -16.361 1.00 14.11 C ATOM 1177 CG GLU A 74 -2.855 5.174 -17.874 1.00 32.41 C ATOM 1178 CD GLU A 74 -4.111 4.551 -18.474 1.00 32.24 C ATOM 1179 OE1 GLU A 74 -5.026 4.265 -17.720 1.00 33.22 O ATOM 1180 OE2 GLU A 74 -4.139 4.368 -19.680 1.00 13.01 O ATOM 0 H GLU A 74 -4.463 2.759 -16.134 1.00 34.54 H new ATOM 0 HA GLU A 74 -1.557 3.217 -16.567 1.00 24.41 H new ATOM 0 HB2 GLU A 74 -3.792 5.200 -15.926 1.00 14.11 H new ATOM 0 HB3 GLU A 74 -2.086 5.598 -15.898 1.00 14.11 H new ATOM 0 HG2 GLU A 74 -2.831 6.242 -18.088 1.00 32.41 H new ATOM 0 HG3 GLU A 74 -1.968 4.737 -18.333 1.00 32.41 H new ATOM 1187 N VAL A 75 -1.445 2.378 -14.163 1.00 54.24 N ATOM 1188 CA VAL A 75 -1.231 2.104 -12.742 1.00 74.13 C ATOM 1189 C VAL A 75 0.251 1.994 -12.409 1.00 54.35 C ATOM 1190 O VAL A 75 1.059 1.584 -13.243 1.00 22.34 O ATOM 1191 CB VAL A 75 -1.935 0.812 -12.337 1.00 62.25 C ATOM 1192 CG1 VAL A 75 -1.792 0.610 -10.818 1.00 64.10 C ATOM 1193 CG2 VAL A 75 -3.418 0.895 -12.725 1.00 23.10 C ATOM 0 H VAL A 75 -0.870 1.820 -14.794 1.00 54.24 H new ATOM 0 HA VAL A 75 -1.650 2.942 -12.184 1.00 74.13 H new ATOM 0 HB VAL A 75 -1.482 -0.035 -12.853 1.00 62.25 H new ATOM 0 HG11 VAL A 75 -2.294 -0.312 -10.525 1.00 64.10 H new ATOM 0 HG12 VAL A 75 -0.736 0.547 -10.557 1.00 64.10 H new ATOM 0 HG13 VAL A 75 -2.245 1.452 -10.295 1.00 64.10 H new ATOM 0 HG21 VAL A 75 -3.922 -0.027 -12.436 1.00 23.10 H new ATOM 0 HG22 VAL A 75 -3.882 1.738 -12.212 1.00 23.10 H new ATOM 0 HG23 VAL A 75 -3.505 1.034 -13.803 1.00 23.10 H new ATOM 1203 N TYR A 76 0.598 2.353 -11.174 1.00 20.31 N ATOM 1204 CA TYR A 76 1.984 2.286 -10.712 1.00 54.31 C ATOM 1205 C TYR A 76 2.095 1.236 -9.605 1.00 3.43 C ATOM 1206 O TYR A 76 1.115 0.955 -8.919 1.00 71.11 O ATOM 1207 CB TYR A 76 2.412 3.663 -10.212 1.00 25.33 C ATOM 1208 CG TYR A 76 2.002 4.685 -11.245 1.00 1.12 C ATOM 1209 CD1 TYR A 76 2.855 4.981 -12.315 1.00 73.11 C ATOM 1210 CD2 TYR A 76 0.759 5.321 -11.147 1.00 11.12 C ATOM 1211 CE1 TYR A 76 2.467 5.914 -13.284 1.00 11.35 C ATOM 1212 CE2 TYR A 76 0.372 6.257 -12.115 1.00 72.52 C ATOM 1213 CZ TYR A 76 1.226 6.552 -13.184 1.00 4.34 C ATOM 1214 OH TYR A 76 0.843 7.472 -14.139 1.00 23.33 O ATOM 0 H TYR A 76 -0.062 2.694 -10.475 1.00 20.31 H new ATOM 0 HA TYR A 76 2.645 1.995 -11.529 1.00 54.31 H new ATOM 0 HB2 TYR A 76 1.943 3.882 -9.253 1.00 25.33 H new ATOM 0 HB3 TYR A 76 3.490 3.693 -10.054 1.00 25.33 H new ATOM 0 HD1 TYR A 76 3.813 4.489 -12.393 1.00 73.11 H new ATOM 0 HD2 TYR A 76 0.098 5.090 -10.325 1.00 11.12 H new ATOM 0 HE1 TYR A 76 3.126 6.141 -14.109 1.00 11.35 H new ATOM 0 HE2 TYR A 76 -0.585 6.751 -12.036 1.00 72.52 H new ATOM 0 HH TYR A 76 -0.047 7.820 -13.920 1.00 23.33 H new ATOM 1224 N TYR A 77 3.285 0.655 -9.435 1.00 13.23 N ATOM 1225 CA TYR A 77 3.468 -0.369 -8.400 1.00 64.31 C ATOM 1226 C TYR A 77 4.920 -0.495 -7.941 1.00 23.13 C ATOM 1227 O TYR A 77 5.846 -0.412 -8.748 1.00 24.02 O ATOM 1228 CB TYR A 77 2.963 -1.727 -8.928 1.00 54.32 C ATOM 1229 CG TYR A 77 4.091 -2.494 -9.589 1.00 1.44 C ATOM 1230 CD1 TYR A 77 4.608 -2.060 -10.815 1.00 24.12 C ATOM 1231 CD2 TYR A 77 4.618 -3.636 -8.973 1.00 72.44 C ATOM 1232 CE1 TYR A 77 5.650 -2.769 -11.425 1.00 15.25 C ATOM 1233 CE2 TYR A 77 5.660 -4.345 -9.583 1.00 14.12 C ATOM 1234 CZ TYR A 77 6.176 -3.910 -10.809 1.00 23.33 C ATOM 1235 OH TYR A 77 7.203 -4.607 -11.412 1.00 34.21 O ATOM 0 H TYR A 77 4.118 0.868 -9.984 1.00 13.23 H new ATOM 0 HA TYR A 77 2.888 -0.060 -7.530 1.00 64.31 H new ATOM 0 HB2 TYR A 77 2.550 -2.312 -8.106 1.00 54.32 H new ATOM 0 HB3 TYR A 77 2.156 -1.568 -9.643 1.00 54.32 H new ATOM 0 HD1 TYR A 77 4.203 -1.179 -11.290 1.00 24.12 H new ATOM 0 HD2 TYR A 77 4.220 -3.970 -8.026 1.00 72.44 H new ATOM 0 HE1 TYR A 77 6.048 -2.435 -12.372 1.00 15.25 H new ATOM 0 HE2 TYR A 77 6.065 -5.226 -9.108 1.00 14.12 H new ATOM 0 HH TYR A 77 7.452 -5.372 -10.852 1.00 34.21 H new ATOM 1245 N SER A 78 5.107 -0.740 -6.641 1.00 34.12 N ATOM 1246 CA SER A 78 6.444 -0.926 -6.083 1.00 44.32 C ATOM 1247 C SER A 78 6.686 -2.415 -5.845 1.00 31.35 C ATOM 1248 O SER A 78 6.168 -2.997 -4.892 1.00 51.51 O ATOM 1249 CB SER A 78 6.569 -0.170 -4.761 1.00 72.53 C ATOM 1250 OG SER A 78 7.853 -0.410 -4.201 1.00 63.21 O ATOM 0 H SER A 78 4.351 -0.813 -5.960 1.00 34.12 H new ATOM 0 HA SER A 78 7.184 -0.539 -6.784 1.00 44.32 H new ATOM 0 HB2 SER A 78 6.425 0.898 -4.925 1.00 72.53 H new ATOM 0 HB3 SER A 78 5.792 -0.494 -4.069 1.00 72.53 H new ATOM 0 HG SER A 78 8.538 0.011 -4.761 1.00 63.21 H new ATOM 1256 N GLU A 79 7.454 -3.026 -6.736 1.00 62.43 N ATOM 1257 CA GLU A 79 7.743 -4.456 -6.645 1.00 61.20 C ATOM 1258 C GLU A 79 8.323 -4.837 -5.283 1.00 63.04 C ATOM 1259 O GLU A 79 8.022 -5.906 -4.752 1.00 34.22 O ATOM 1260 CB GLU A 79 8.729 -4.852 -7.744 1.00 63.42 C ATOM 1261 CG GLU A 79 8.801 -6.377 -7.842 1.00 51.11 C ATOM 1262 CD GLU A 79 9.804 -6.784 -8.916 1.00 61.44 C ATOM 1263 OE1 GLU A 79 9.637 -6.358 -10.047 1.00 14.04 O ATOM 1264 OE2 GLU A 79 10.724 -7.517 -8.591 1.00 33.42 O ATOM 0 H GLU A 79 7.889 -2.557 -7.530 1.00 62.43 H new ATOM 0 HA GLU A 79 6.802 -4.991 -6.770 1.00 61.20 H new ATOM 0 HB2 GLU A 79 8.414 -4.430 -8.699 1.00 63.42 H new ATOM 0 HB3 GLU A 79 9.716 -4.444 -7.526 1.00 63.42 H new ATOM 0 HG2 GLU A 79 9.095 -6.798 -6.880 1.00 51.11 H new ATOM 0 HG3 GLU A 79 7.817 -6.781 -8.080 1.00 51.11 H new ATOM 1271 N GLU A 80 9.174 -3.979 -4.736 1.00 52.34 N ATOM 1272 CA GLU A 80 9.808 -4.262 -3.450 1.00 52.25 C ATOM 1273 C GLU A 80 8.832 -4.133 -2.280 1.00 12.04 C ATOM 1274 O GLU A 80 8.978 -4.823 -1.271 1.00 24.00 O ATOM 1275 CB GLU A 80 10.985 -3.308 -3.235 1.00 55.45 C ATOM 1276 CG GLU A 80 10.470 -1.869 -3.153 1.00 30.33 C ATOM 1277 CD GLU A 80 11.645 -0.897 -3.113 1.00 21.44 C ATOM 1278 OE1 GLU A 80 12.769 -1.359 -3.005 1.00 35.03 O ATOM 1279 OE2 GLU A 80 11.403 0.297 -3.190 1.00 63.24 O ATOM 0 H GLU A 80 9.441 -3.089 -5.156 1.00 52.34 H new ATOM 0 HA GLU A 80 10.155 -5.295 -3.479 1.00 52.25 H new ATOM 0 HB2 GLU A 80 11.515 -3.568 -2.319 1.00 55.45 H new ATOM 0 HB3 GLU A 80 11.698 -3.404 -4.054 1.00 55.45 H new ATOM 0 HG2 GLU A 80 9.836 -1.651 -4.013 1.00 30.33 H new ATOM 0 HG3 GLU A 80 9.854 -1.745 -2.263 1.00 30.33 H new ATOM 1286 N ALA A 81 7.855 -3.236 -2.400 1.00 65.34 N ATOM 1287 CA ALA A 81 6.887 -3.020 -1.320 1.00 42.10 C ATOM 1288 C ALA A 81 5.529 -3.652 -1.624 1.00 0.31 C ATOM 1289 O ALA A 81 4.565 -3.423 -0.894 1.00 12.34 O ATOM 1290 CB ALA A 81 6.703 -1.518 -1.088 1.00 60.53 C ATOM 0 H ALA A 81 7.711 -2.652 -3.224 1.00 65.34 H new ATOM 0 HA ALA A 81 7.285 -3.500 -0.426 1.00 42.10 H new ATOM 0 HB1 ALA A 81 5.983 -1.359 -0.285 1.00 60.53 H new ATOM 0 HB2 ALA A 81 7.659 -1.073 -0.812 1.00 60.53 H new ATOM 0 HB3 ALA A 81 6.336 -1.051 -2.002 1.00 60.53 H new ATOM 1296 N LYS A 82 5.453 -4.446 -2.693 1.00 21.31 N ATOM 1297 CA LYS A 82 4.191 -5.098 -3.067 1.00 52.21 C ATOM 1298 C LYS A 82 3.007 -4.185 -2.760 1.00 44.35 C ATOM 1299 O LYS A 82 2.111 -4.533 -1.984 1.00 2.02 O ATOM 1300 CB LYS A 82 4.036 -6.418 -2.306 1.00 74.04 C ATOM 1301 CG LYS A 82 5.158 -7.375 -2.712 1.00 42.22 C ATOM 1302 CD LYS A 82 4.827 -8.792 -2.234 1.00 33.13 C ATOM 1303 CE LYS A 82 4.708 -8.812 -0.707 1.00 64.01 C ATOM 1304 NZ LYS A 82 5.825 -8.028 -0.107 1.00 52.33 N ATOM 0 H LYS A 82 6.238 -4.653 -3.310 1.00 21.31 H new ATOM 0 HA LYS A 82 4.211 -5.301 -4.138 1.00 52.21 H new ATOM 0 HB2 LYS A 82 4.069 -6.237 -1.232 1.00 74.04 H new ATOM 0 HB3 LYS A 82 3.066 -6.864 -2.524 1.00 74.04 H new ATOM 0 HG2 LYS A 82 5.282 -7.366 -3.795 1.00 42.22 H new ATOM 0 HG3 LYS A 82 6.103 -7.047 -2.280 1.00 42.22 H new ATOM 0 HD2 LYS A 82 3.893 -9.129 -2.685 1.00 33.13 H new ATOM 0 HD3 LYS A 82 5.604 -9.485 -2.556 1.00 33.13 H new ATOM 0 HE2 LYS A 82 3.750 -8.391 -0.401 1.00 64.01 H new ATOM 0 HE3 LYS A 82 4.735 -9.839 -0.344 1.00 64.01 H new ATOM 0 HZ1 LYS A 82 5.962 -8.320 0.882 1.00 52.33 H new ATOM 0 HZ2 LYS A 82 6.699 -8.202 -0.644 1.00 52.33 H new ATOM 0 HZ3 LYS A 82 5.594 -7.014 -0.139 1.00 52.33 H new ATOM 1318 N LYS A 83 3.026 -3.013 -3.386 1.00 4.20 N ATOM 1319 CA LYS A 83 1.974 -2.016 -3.199 1.00 70.41 C ATOM 1320 C LYS A 83 1.656 -1.324 -4.521 1.00 2.53 C ATOM 1321 O LYS A 83 2.554 -0.865 -5.224 1.00 64.44 O ATOM 1322 CB LYS A 83 2.430 -0.981 -2.169 1.00 33.14 C ATOM 1323 CG LYS A 83 1.377 0.122 -2.038 1.00 34.14 C ATOM 1324 CD LYS A 83 1.696 0.990 -0.817 1.00 35.04 C ATOM 1325 CE LYS A 83 0.990 2.342 -0.947 1.00 11.14 C ATOM 1326 NZ LYS A 83 0.996 3.033 0.375 1.00 33.21 N ATOM 0 H LYS A 83 3.763 -2.728 -4.031 1.00 4.20 H new ATOM 0 HA LYS A 83 1.073 -2.515 -2.842 1.00 70.41 H new ATOM 0 HB2 LYS A 83 2.588 -1.461 -1.203 1.00 33.14 H new ATOM 0 HB3 LYS A 83 3.385 -0.550 -2.471 1.00 33.14 H new ATOM 0 HG2 LYS A 83 1.363 0.735 -2.939 1.00 34.14 H new ATOM 0 HG3 LYS A 83 0.385 -0.318 -1.936 1.00 34.14 H new ATOM 0 HD2 LYS A 83 1.373 0.486 0.094 1.00 35.04 H new ATOM 0 HD3 LYS A 83 2.773 1.137 -0.735 1.00 35.04 H new ATOM 0 HE2 LYS A 83 1.493 2.957 -1.693 1.00 11.14 H new ATOM 0 HE3 LYS A 83 -0.035 2.198 -1.290 1.00 11.14 H new ATOM 0 HZ1 LYS A 83 0.086 3.516 0.519 1.00 33.21 H new ATOM 0 HZ2 LYS A 83 1.140 2.334 1.131 1.00 33.21 H new ATOM 0 HZ3 LYS A 83 1.766 3.732 0.398 1.00 33.21 H new ATOM 1340 N LYS A 84 0.372 -1.289 -4.867 1.00 61.33 N ATOM 1341 CA LYS A 84 -0.068 -0.688 -6.126 1.00 15.13 C ATOM 1342 C LYS A 84 -1.095 0.408 -5.900 1.00 33.04 C ATOM 1343 O LYS A 84 -2.051 0.231 -5.146 1.00 5.31 O ATOM 1344 CB LYS A 84 -0.678 -1.784 -7.005 1.00 63.23 C ATOM 1345 CG LYS A 84 -0.884 -1.266 -8.426 1.00 1.24 C ATOM 1346 CD LYS A 84 -1.632 -2.319 -9.256 1.00 22.24 C ATOM 1347 CE LYS A 84 -3.121 -2.334 -8.885 1.00 73.10 C ATOM 1348 NZ LYS A 84 -3.900 -2.942 -10.001 1.00 24.43 N ATOM 0 H LYS A 84 -0.382 -1.669 -4.295 1.00 61.33 H new ATOM 0 HA LYS A 84 0.796 -0.236 -6.613 1.00 15.13 H new ATOM 0 HB2 LYS A 84 -0.023 -2.655 -7.019 1.00 63.23 H new ATOM 0 HB3 LYS A 84 -1.631 -2.108 -6.586 1.00 63.23 H new ATOM 0 HG2 LYS A 84 -1.451 -0.335 -8.406 1.00 1.24 H new ATOM 0 HG3 LYS A 84 0.079 -1.043 -8.886 1.00 1.24 H new ATOM 0 HD2 LYS A 84 -1.518 -2.103 -10.318 1.00 22.24 H new ATOM 0 HD3 LYS A 84 -1.198 -3.304 -9.083 1.00 22.24 H new ATOM 0 HE2 LYS A 84 -3.273 -2.903 -7.968 1.00 73.10 H new ATOM 0 HE3 LYS A 84 -3.470 -1.319 -8.693 1.00 73.10 H new ATOM 0 HZ1 LYS A 84 -4.910 -2.954 -9.753 1.00 24.43 H new ATOM 0 HZ2 LYS A 84 -3.762 -2.381 -10.866 1.00 24.43 H new ATOM 0 HZ3 LYS A 84 -3.572 -3.915 -10.163 1.00 24.43 H new ATOM 1362 N VAL A 85 -0.906 1.538 -6.589 1.00 54.21 N ATOM 1363 CA VAL A 85 -1.846 2.648 -6.481 1.00 33.14 C ATOM 1364 C VAL A 85 -2.191 3.183 -7.870 1.00 25.24 C ATOM 1365 O VAL A 85 -1.313 3.466 -8.684 1.00 41.14 O ATOM 1366 CB VAL A 85 -1.264 3.743 -5.556 1.00 5.13 C ATOM 1367 CG1 VAL A 85 -0.425 3.072 -4.467 1.00 50.04 C ATOM 1368 CG2 VAL A 85 -0.382 4.775 -6.309 1.00 32.55 C ATOM 0 H VAL A 85 -0.120 1.703 -7.218 1.00 54.21 H new ATOM 0 HA VAL A 85 -2.776 2.301 -6.030 1.00 33.14 H new ATOM 0 HB VAL A 85 -2.106 4.291 -5.134 1.00 5.13 H new ATOM 0 HG11 VAL A 85 -0.009 3.833 -3.808 1.00 50.04 H new ATOM 0 HG12 VAL A 85 -1.054 2.395 -3.888 1.00 50.04 H new ATOM 0 HG13 VAL A 85 0.386 2.508 -4.928 1.00 50.04 H new ATOM 0 HG21 VAL A 85 -0.005 5.515 -5.603 1.00 32.55 H new ATOM 0 HG22 VAL A 85 0.457 4.262 -6.779 1.00 32.55 H new ATOM 0 HG23 VAL A 85 -0.978 5.273 -7.074 1.00 32.55 H new ATOM 1378 N GLU A 86 -3.497 3.262 -8.143 1.00 74.44 N ATOM 1379 CA GLU A 86 -3.990 3.703 -9.451 1.00 64.25 C ATOM 1380 C GLU A 86 -4.919 4.898 -9.326 1.00 40.21 C ATOM 1381 O GLU A 86 -5.800 4.929 -8.468 1.00 1.22 O ATOM 1382 CB GLU A 86 -4.761 2.561 -10.119 1.00 73.23 C ATOM 1383 CG GLU A 86 -5.892 2.100 -9.200 1.00 21.42 C ATOM 1384 CD GLU A 86 -6.492 0.800 -9.724 1.00 24.03 C ATOM 1385 OE1 GLU A 86 -7.184 0.852 -10.728 1.00 42.40 O ATOM 1386 OE2 GLU A 86 -6.251 -0.229 -9.114 1.00 20.02 O ATOM 0 H GLU A 86 -4.232 3.026 -7.476 1.00 74.44 H new ATOM 0 HA GLU A 86 -3.125 3.991 -10.049 1.00 64.25 H new ATOM 0 HB2 GLU A 86 -5.167 2.893 -11.074 1.00 73.23 H new ATOM 0 HB3 GLU A 86 -4.089 1.730 -10.330 1.00 73.23 H new ATOM 0 HG2 GLU A 86 -5.513 1.954 -8.189 1.00 21.42 H new ATOM 0 HG3 GLU A 86 -6.662 2.869 -9.144 1.00 21.42 H new ATOM 1393 N VAL A 87 -4.716 5.879 -10.195 1.00 1.04 N ATOM 1394 CA VAL A 87 -5.543 7.075 -10.173 1.00 71.31 C ATOM 1395 C VAL A 87 -7.023 6.715 -10.330 1.00 43.10 C ATOM 1396 O VAL A 87 -7.523 6.546 -11.442 1.00 5.40 O ATOM 1397 CB VAL A 87 -5.104 8.024 -11.300 1.00 4.05 C ATOM 1398 CG1 VAL A 87 -4.784 7.209 -12.556 1.00 21.34 C ATOM 1399 CG2 VAL A 87 -6.218 9.041 -11.613 1.00 45.42 C ATOM 0 H VAL A 87 -3.994 5.870 -10.916 1.00 1.04 H new ATOM 0 HA VAL A 87 -5.416 7.573 -9.212 1.00 71.31 H new ATOM 0 HB VAL A 87 -4.216 8.568 -10.977 1.00 4.05 H new ATOM 0 HG11 VAL A 87 -4.473 7.881 -13.356 1.00 21.34 H new ATOM 0 HG12 VAL A 87 -3.980 6.506 -12.339 1.00 21.34 H new ATOM 0 HG13 VAL A 87 -5.672 6.659 -12.869 1.00 21.34 H new ATOM 0 HG21 VAL A 87 -5.890 9.705 -12.413 1.00 45.42 H new ATOM 0 HG22 VAL A 87 -7.117 8.511 -11.927 1.00 45.42 H new ATOM 0 HG23 VAL A 87 -6.436 9.628 -10.721 1.00 45.42 H new ATOM 1409 N LEU A 88 -7.715 6.623 -9.198 1.00 5.13 N ATOM 1410 CA LEU A 88 -9.142 6.313 -9.189 1.00 14.04 C ATOM 1411 C LEU A 88 -9.914 7.625 -9.273 1.00 60.34 C ATOM 1412 O LEU A 88 -11.086 7.671 -9.645 1.00 4.54 O ATOM 1413 CB LEU A 88 -9.495 5.557 -7.892 1.00 42.12 C ATOM 1414 CG LEU A 88 -10.610 4.522 -8.139 1.00 42.32 C ATOM 1415 CD1 LEU A 88 -11.840 5.218 -8.727 1.00 72.52 C ATOM 1416 CD2 LEU A 88 -10.119 3.422 -9.100 1.00 14.00 C ATOM 0 H LEU A 88 -7.309 6.759 -8.272 1.00 5.13 H new ATOM 0 HA LEU A 88 -9.405 5.680 -10.036 1.00 14.04 H new ATOM 0 HB2 LEU A 88 -8.607 5.055 -7.507 1.00 42.12 H new ATOM 0 HB3 LEU A 88 -9.816 6.267 -7.129 1.00 42.12 H new ATOM 0 HG LEU A 88 -10.877 4.060 -7.189 1.00 42.32 H new ATOM 0 HD11 LEU A 88 -12.626 4.483 -8.900 1.00 72.52 H new ATOM 0 HD12 LEU A 88 -12.198 5.975 -8.029 1.00 72.52 H new ATOM 0 HD13 LEU A 88 -11.573 5.693 -9.671 1.00 72.52 H new ATOM 0 HD21 LEU A 88 -10.918 2.699 -9.264 1.00 14.00 H new ATOM 0 HD22 LEU A 88 -9.835 3.871 -10.052 1.00 14.00 H new ATOM 0 HD23 LEU A 88 -9.257 2.917 -8.665 1.00 14.00 H new ATOM 1428 N ASP A 89 -9.205 8.689 -8.937 1.00 63.45 N ATOM 1429 CA ASP A 89 -9.729 10.044 -8.963 1.00 52.10 C ATOM 1430 C ASP A 89 -8.599 10.955 -8.502 1.00 22.01 C ATOM 1431 O ASP A 89 -8.074 10.783 -7.402 1.00 32.14 O ATOM 1432 CB ASP A 89 -10.949 10.182 -8.034 1.00 0.24 C ATOM 1433 CG ASP A 89 -12.008 11.078 -8.672 1.00 3.14 C ATOM 1434 OD1 ASP A 89 -12.417 10.781 -9.783 1.00 22.13 O ATOM 1435 OD2 ASP A 89 -12.395 12.048 -8.041 1.00 3.45 O ATOM 0 H ASP A 89 -8.233 8.635 -8.633 1.00 63.45 H new ATOM 0 HA ASP A 89 -10.065 10.309 -9.965 1.00 52.10 H new ATOM 0 HB2 ASP A 89 -11.371 9.198 -7.830 1.00 0.24 H new ATOM 0 HB3 ASP A 89 -10.639 10.600 -7.076 1.00 0.24 H new ATOM 1440 N THR A 90 -8.193 11.896 -9.344 1.00 61.52 N ATOM 1441 CA THR A 90 -7.086 12.773 -8.983 1.00 2.42 C ATOM 1442 C THR A 90 -7.275 14.169 -9.575 1.00 13.23 C ATOM 1443 O THR A 90 -7.381 14.339 -10.789 1.00 1.21 O ATOM 1444 CB THR A 90 -5.770 12.113 -9.456 1.00 74.32 C ATOM 1445 OG1 THR A 90 -4.696 12.410 -8.563 1.00 32.24 O ATOM 1446 CG2 THR A 90 -5.407 12.585 -10.869 1.00 23.33 C ATOM 0 H THR A 90 -8.602 12.070 -10.262 1.00 61.52 H new ATOM 0 HA THR A 90 -7.049 12.905 -7.902 1.00 2.42 H new ATOM 0 HB THR A 90 -5.928 11.035 -9.467 1.00 74.32 H new ATOM 0 HG1 THR A 90 -3.898 12.649 -9.079 1.00 32.24 H new ATOM 0 HG21 THR A 90 -4.478 12.110 -11.184 1.00 23.33 H new ATOM 0 HG22 THR A 90 -6.206 12.314 -11.560 1.00 23.33 H new ATOM 0 HG23 THR A 90 -5.279 13.667 -10.869 1.00 23.33 H new ATOM 1454 N ASP A 91 -7.305 15.161 -8.694 1.00 74.13 N ATOM 1455 CA ASP A 91 -7.466 16.547 -9.113 1.00 21.22 C ATOM 1456 C ASP A 91 -6.112 17.119 -9.499 1.00 33.12 C ATOM 1457 O ASP A 91 -6.012 18.009 -10.343 1.00 15.43 O ATOM 1458 CB ASP A 91 -8.052 17.370 -7.972 1.00 40.13 C ATOM 1459 CG ASP A 91 -8.393 18.774 -8.460 1.00 21.25 C ATOM 1460 OD1 ASP A 91 -9.102 18.881 -9.446 1.00 51.45 O ATOM 1461 OD2 ASP A 91 -7.939 19.721 -7.840 1.00 24.44 O ATOM 0 H ASP A 91 -7.220 15.032 -7.686 1.00 74.13 H new ATOM 0 HA ASP A 91 -8.141 16.585 -9.968 1.00 21.22 H new ATOM 0 HB2 ASP A 91 -8.947 16.884 -7.585 1.00 40.13 H new ATOM 0 HB3 ASP A 91 -7.339 17.426 -7.150 1.00 40.13 H new ATOM 1466 N TYR A 92 -5.072 16.586 -8.868 1.00 32.54 N ATOM 1467 CA TYR A 92 -3.707 17.022 -9.134 1.00 12.11 C ATOM 1468 C TYR A 92 -3.516 18.489 -8.757 1.00 0.24 C ATOM 1469 O TYR A 92 -2.537 19.108 -9.174 1.00 12.25 O ATOM 1470 CB TYR A 92 -3.373 16.818 -10.632 1.00 43.41 C ATOM 1471 CG TYR A 92 -2.492 15.601 -10.833 1.00 55.33 C ATOM 1472 CD1 TYR A 92 -2.717 14.428 -10.100 1.00 31.44 C ATOM 1473 CD2 TYR A 92 -1.450 15.651 -11.768 1.00 71.13 C ATOM 1474 CE1 TYR A 92 -1.901 13.310 -10.302 1.00 43.34 C ATOM 1475 CE2 TYR A 92 -0.635 14.532 -11.969 1.00 15.14 C ATOM 1476 CZ TYR A 92 -0.859 13.363 -11.236 1.00 41.01 C ATOM 1477 OH TYR A 92 -0.056 12.264 -11.437 1.00 3.13 O ATOM 0 H TYR A 92 -5.149 15.849 -8.167 1.00 32.54 H new ATOM 0 HA TYR A 92 -3.032 16.421 -8.524 1.00 12.11 H new ATOM 0 HB2 TYR A 92 -4.295 16.701 -11.201 1.00 43.41 H new ATOM 0 HB3 TYR A 92 -2.869 17.704 -11.020 1.00 43.41 H new ATOM 0 HD1 TYR A 92 -3.520 14.387 -9.379 1.00 31.44 H new ATOM 0 HD2 TYR A 92 -1.276 16.554 -12.334 1.00 71.13 H new ATOM 0 HE1 TYR A 92 -2.075 12.406 -9.738 1.00 43.34 H new ATOM 0 HE2 TYR A 92 0.168 14.571 -12.691 1.00 15.14 H new ATOM 0 HH TYR A 92 0.710 12.303 -10.827 1.00 3.13 H new ATOM 1487 N LYS A 93 -4.437 19.062 -7.980 1.00 72.45 N ATOM 1488 CA LYS A 93 -4.309 20.462 -7.593 1.00 2.32 C ATOM 1489 C LYS A 93 -5.083 20.743 -6.306 1.00 43.41 C ATOM 1490 O LYS A 93 -4.677 21.583 -5.502 1.00 54.34 O ATOM 1491 CB LYS A 93 -4.862 21.354 -8.706 1.00 54.15 C ATOM 1492 CG LYS A 93 -3.923 21.324 -9.917 1.00 14.21 C ATOM 1493 CD LYS A 93 -4.260 22.487 -10.855 1.00 4.50 C ATOM 1494 CE LYS A 93 -5.685 22.326 -11.392 1.00 33.33 C ATOM 1495 NZ LYS A 93 -6.658 22.791 -10.364 1.00 22.14 N ATOM 0 H LYS A 93 -5.262 18.587 -7.614 1.00 72.45 H new ATOM 0 HA LYS A 93 -3.253 20.675 -7.427 1.00 2.32 H new ATOM 0 HB2 LYS A 93 -5.855 21.013 -8.997 1.00 54.15 H new ATOM 0 HB3 LYS A 93 -4.970 22.377 -8.344 1.00 54.15 H new ATOM 0 HG2 LYS A 93 -2.886 21.397 -9.588 1.00 14.21 H new ATOM 0 HG3 LYS A 93 -4.024 20.376 -10.445 1.00 14.21 H new ATOM 0 HD2 LYS A 93 -4.167 23.434 -10.323 1.00 4.50 H new ATOM 0 HD3 LYS A 93 -3.551 22.516 -11.682 1.00 4.50 H new ATOM 0 HE2 LYS A 93 -5.806 22.901 -12.310 1.00 33.33 H new ATOM 0 HE3 LYS A 93 -5.875 21.282 -11.642 1.00 33.33 H new ATOM 0 HZ1 LYS A 93 -7.198 21.978 -10.004 1.00 22.14 H new ATOM 0 HZ2 LYS A 93 -6.145 23.241 -9.579 1.00 22.14 H new ATOM 0 HZ3 LYS A 93 -7.311 23.479 -10.790 1.00 22.14 H new ATOM 1509 N SER A 94 -6.209 20.050 -6.122 1.00 53.35 N ATOM 1510 CA SER A 94 -7.044 20.249 -4.934 1.00 43.51 C ATOM 1511 C SER A 94 -7.042 19.015 -4.035 1.00 32.43 C ATOM 1512 O SER A 94 -6.612 19.078 -2.883 1.00 70.12 O ATOM 1513 CB SER A 94 -8.479 20.561 -5.360 1.00 31.12 C ATOM 1514 OG SER A 94 -9.106 19.365 -5.806 1.00 62.14 O ATOM 0 H SER A 94 -6.562 19.351 -6.775 1.00 53.35 H new ATOM 0 HA SER A 94 -6.629 21.084 -4.369 1.00 43.51 H new ATOM 0 HB2 SER A 94 -9.034 20.987 -4.524 1.00 31.12 H new ATOM 0 HB3 SER A 94 -8.481 21.305 -6.156 1.00 31.12 H new ATOM 0 HG SER A 94 -9.773 19.080 -5.147 1.00 62.14 H new ATOM 1520 N TYR A 95 -7.529 17.894 -4.563 1.00 15.34 N ATOM 1521 CA TYR A 95 -7.581 16.654 -3.790 1.00 5.52 C ATOM 1522 C TYR A 95 -7.619 15.450 -4.725 1.00 54.54 C ATOM 1523 O TYR A 95 -7.931 15.588 -5.907 1.00 1.12 O ATOM 1524 CB TYR A 95 -8.822 16.650 -2.897 1.00 44.14 C ATOM 1525 CG TYR A 95 -10.018 17.101 -3.702 1.00 23.33 C ATOM 1526 CD1 TYR A 95 -10.752 16.169 -4.446 1.00 54.52 C ATOM 1527 CD2 TYR A 95 -10.391 18.449 -3.706 1.00 23.14 C ATOM 1528 CE1 TYR A 95 -11.860 16.586 -5.192 1.00 52.44 C ATOM 1529 CE2 TYR A 95 -11.500 18.867 -4.453 1.00 51.23 C ATOM 1530 CZ TYR A 95 -12.234 17.935 -5.196 1.00 65.22 C ATOM 1531 OH TYR A 95 -13.326 18.346 -5.932 1.00 65.12 O ATOM 0 H TYR A 95 -7.890 17.818 -5.514 1.00 15.34 H new ATOM 0 HA TYR A 95 -6.688 16.592 -3.168 1.00 5.52 H new ATOM 0 HB2 TYR A 95 -8.994 15.650 -2.498 1.00 44.14 H new ATOM 0 HB3 TYR A 95 -8.673 17.312 -2.044 1.00 44.14 H new ATOM 0 HD1 TYR A 95 -10.463 15.128 -4.444 1.00 54.52 H new ATOM 0 HD2 TYR A 95 -9.824 19.168 -3.133 1.00 23.14 H new ATOM 0 HE1 TYR A 95 -12.427 15.867 -5.765 1.00 52.44 H new ATOM 0 HE2 TYR A 95 -11.788 19.908 -4.456 1.00 51.23 H new ATOM 0 HH TYR A 95 -13.448 19.312 -5.824 1.00 65.12 H new ATOM 1541 N ALA A 96 -7.293 14.268 -4.202 1.00 1.44 N ATOM 1542 CA ALA A 96 -7.292 13.066 -5.034 1.00 22.30 C ATOM 1543 C ALA A 96 -7.696 11.823 -4.251 1.00 13.33 C ATOM 1544 O ALA A 96 -7.320 11.648 -3.092 1.00 32.15 O ATOM 1545 CB ALA A 96 -5.897 12.846 -5.627 1.00 34.42 C ATOM 0 H ALA A 96 -7.032 14.118 -3.228 1.00 1.44 H new ATOM 0 HA ALA A 96 -8.025 13.222 -5.825 1.00 22.30 H new ATOM 0 HB1 ALA A 96 -5.902 11.949 -6.246 1.00 34.42 H new ATOM 0 HB2 ALA A 96 -5.621 13.706 -6.237 1.00 34.42 H new ATOM 0 HB3 ALA A 96 -5.174 12.726 -4.821 1.00 34.42 H new ATOM 1551 N VAL A 97 -8.433 10.942 -4.925 1.00 41.15 N ATOM 1552 CA VAL A 97 -8.864 9.674 -4.334 1.00 53.33 C ATOM 1553 C VAL A 97 -8.265 8.558 -5.165 1.00 34.43 C ATOM 1554 O VAL A 97 -8.463 8.509 -6.380 1.00 45.11 O ATOM 1555 CB VAL A 97 -10.393 9.563 -4.316 1.00 73.01 C ATOM 1556 CG1 VAL A 97 -10.819 8.524 -3.274 1.00 52.51 C ATOM 1557 CG2 VAL A 97 -10.997 10.923 -3.957 1.00 45.23 C ATOM 0 H VAL A 97 -8.746 11.083 -5.885 1.00 41.15 H new ATOM 0 HA VAL A 97 -8.526 9.611 -3.300 1.00 53.33 H new ATOM 0 HB VAL A 97 -10.747 9.255 -5.300 1.00 73.01 H new ATOM 0 HG11 VAL A 97 -11.906 8.446 -3.262 1.00 52.51 H new ATOM 0 HG12 VAL A 97 -10.388 7.556 -3.529 1.00 52.51 H new ATOM 0 HG13 VAL A 97 -10.466 8.830 -2.289 1.00 52.51 H new ATOM 0 HG21 VAL A 97 -12.084 10.846 -3.944 1.00 45.23 H new ATOM 0 HG22 VAL A 97 -10.643 11.230 -2.973 1.00 45.23 H new ATOM 0 HG23 VAL A 97 -10.695 11.663 -4.698 1.00 45.23 H new ATOM 1567 N ILE A 98 -7.477 7.701 -4.531 1.00 64.01 N ATOM 1568 CA ILE A 98 -6.789 6.639 -5.250 1.00 32.23 C ATOM 1569 C ILE A 98 -7.026 5.276 -4.612 1.00 22.44 C ATOM 1570 O ILE A 98 -7.222 5.166 -3.403 1.00 0.24 O ATOM 1571 CB ILE A 98 -5.298 6.969 -5.243 1.00 42.23 C ATOM 1572 CG1 ILE A 98 -5.122 8.466 -5.552 1.00 5.33 C ATOM 1573 CG2 ILE A 98 -4.562 6.133 -6.293 1.00 35.45 C ATOM 1574 CD1 ILE A 98 -3.649 8.848 -5.462 1.00 53.14 C ATOM 0 H ILE A 98 -7.299 7.720 -3.527 1.00 64.01 H new ATOM 0 HA ILE A 98 -7.175 6.582 -6.268 1.00 32.23 H new ATOM 0 HB ILE A 98 -4.879 6.738 -4.264 1.00 42.23 H new ATOM 0 HG12 ILE A 98 -5.503 8.687 -6.549 1.00 5.33 H new ATOM 0 HG13 ILE A 98 -5.704 9.062 -4.849 1.00 5.33 H new ATOM 0 HG21 ILE A 98 -3.500 6.380 -6.276 1.00 35.45 H new ATOM 0 HG22 ILE A 98 -4.692 5.074 -6.071 1.00 35.45 H new ATOM 0 HG23 ILE A 98 -4.969 6.349 -7.281 1.00 35.45 H new ATOM 0 HD11 ILE A 98 -3.534 9.909 -5.682 1.00 53.14 H new ATOM 0 HD12 ILE A 98 -3.281 8.644 -4.456 1.00 53.14 H new ATOM 0 HD13 ILE A 98 -3.077 8.264 -6.183 1.00 53.14 H new ATOM 1586 N TYR A 99 -7.009 4.243 -5.449 1.00 12.11 N ATOM 1587 CA TYR A 99 -7.225 2.880 -4.981 1.00 44.33 C ATOM 1588 C TYR A 99 -5.885 2.197 -4.720 1.00 11.43 C ATOM 1589 O TYR A 99 -5.163 1.833 -5.648 1.00 12.40 O ATOM 1590 CB TYR A 99 -8.008 2.102 -6.042 1.00 52.14 C ATOM 1591 CG TYR A 99 -8.137 0.654 -5.635 1.00 72.42 C ATOM 1592 CD1 TYR A 99 -9.229 0.238 -4.864 1.00 23.34 C ATOM 1593 CD2 TYR A 99 -7.171 -0.275 -6.039 1.00 23.22 C ATOM 1594 CE1 TYR A 99 -9.353 -1.107 -4.496 1.00 31.33 C ATOM 1595 CE2 TYR A 99 -7.294 -1.619 -5.670 1.00 21.51 C ATOM 1596 CZ TYR A 99 -8.386 -2.035 -4.899 1.00 43.45 C ATOM 1597 OH TYR A 99 -8.510 -3.361 -4.539 1.00 3.02 O ATOM 0 H TYR A 99 -6.848 4.325 -6.453 1.00 12.11 H new ATOM 0 HA TYR A 99 -7.793 2.902 -4.051 1.00 44.33 H new ATOM 0 HB2 TYR A 99 -8.997 2.541 -6.170 1.00 52.14 H new ATOM 0 HB3 TYR A 99 -7.501 2.173 -7.004 1.00 52.14 H new ATOM 0 HD1 TYR A 99 -9.975 0.954 -4.553 1.00 23.34 H new ATOM 0 HD2 TYR A 99 -6.330 0.046 -6.636 1.00 23.22 H new ATOM 0 HE1 TYR A 99 -10.195 -1.429 -3.901 1.00 31.33 H new ATOM 0 HE2 TYR A 99 -6.547 -2.335 -5.980 1.00 21.51 H new ATOM 0 HH TYR A 99 -7.629 -3.719 -4.300 1.00 3.02 H new ATOM 1607 N ALA A 100 -5.565 2.044 -3.437 1.00 60.31 N ATOM 1608 CA ALA A 100 -4.307 1.419 -3.029 1.00 51.13 C ATOM 1609 C ALA A 100 -4.546 -0.014 -2.578 1.00 41.03 C ATOM 1610 O ALA A 100 -5.537 -0.310 -1.911 1.00 31.34 O ATOM 1611 CB ALA A 100 -3.673 2.212 -1.884 1.00 1.40 C ATOM 0 H ALA A 100 -6.158 2.343 -2.663 1.00 60.31 H new ATOM 0 HA ALA A 100 -3.633 1.415 -3.885 1.00 51.13 H new ATOM 0 HB1 ALA A 100 -2.737 1.738 -1.588 1.00 1.40 H new ATOM 0 HB2 ALA A 100 -3.475 3.232 -2.214 1.00 1.40 H new ATOM 0 HB3 ALA A 100 -4.355 2.231 -1.034 1.00 1.40 H new ATOM 1617 N THR A 101 -3.631 -0.903 -2.953 1.00 24.01 N ATOM 1618 CA THR A 101 -3.752 -2.310 -2.588 1.00 73.20 C ATOM 1619 C THR A 101 -2.385 -2.917 -2.291 1.00 43.22 C ATOM 1620 O THR A 101 -1.448 -2.792 -3.080 1.00 4.25 O ATOM 1621 CB THR A 101 -4.420 -3.088 -3.726 1.00 75.11 C ATOM 1622 OG1 THR A 101 -4.429 -4.473 -3.408 1.00 62.23 O ATOM 1623 CG2 THR A 101 -3.646 -2.868 -5.026 1.00 74.44 C ATOM 0 H THR A 101 -2.804 -0.676 -3.505 1.00 24.01 H new ATOM 0 HA THR A 101 -4.364 -2.376 -1.689 1.00 73.20 H new ATOM 0 HB THR A 101 -5.443 -2.735 -3.853 1.00 75.11 H new ATOM 0 HG1 THR A 101 -5.018 -4.629 -2.640 1.00 62.23 H new ATOM 0 HG21 THR A 101 -4.125 -3.423 -5.833 1.00 74.44 H new ATOM 0 HG22 THR A 101 -3.640 -1.806 -5.270 1.00 74.44 H new ATOM 0 HG23 THR A 101 -2.621 -3.218 -4.903 1.00 74.44 H new ATOM 1631 N ARG A 102 -2.292 -3.598 -1.152 1.00 61.03 N ATOM 1632 CA ARG A 102 -1.056 -4.258 -0.744 1.00 5.41 C ATOM 1633 C ARG A 102 -1.318 -5.751 -0.655 1.00 54.23 C ATOM 1634 O ARG A 102 -2.270 -6.167 0.003 1.00 15.34 O ATOM 1635 CB ARG A 102 -0.603 -3.731 0.620 1.00 60.00 C ATOM 1636 CG ARG A 102 0.749 -4.350 0.985 1.00 14.52 C ATOM 1637 CD ARG A 102 1.194 -3.832 2.353 1.00 72.51 C ATOM 1638 NE ARG A 102 2.521 -4.345 2.680 1.00 20.24 N ATOM 1639 CZ ARG A 102 3.610 -3.849 2.103 1.00 30.11 C ATOM 1640 NH1 ARG A 102 3.505 -2.888 1.227 1.00 54.53 N ATOM 1641 NH2 ARG A 102 4.785 -4.323 2.413 1.00 50.21 N ATOM 0 H ARG A 102 -3.062 -3.707 -0.492 1.00 61.03 H new ATOM 0 HA ARG A 102 -0.270 -4.055 -1.472 1.00 5.41 H new ATOM 0 HB2 ARG A 102 -0.522 -2.644 0.593 1.00 60.00 H new ATOM 0 HB3 ARG A 102 -1.344 -3.976 1.381 1.00 60.00 H new ATOM 0 HG2 ARG A 102 0.670 -5.437 1.004 1.00 14.52 H new ATOM 0 HG3 ARG A 102 1.493 -4.097 0.229 1.00 14.52 H new ATOM 0 HD2 ARG A 102 1.208 -2.742 2.350 1.00 72.51 H new ATOM 0 HD3 ARG A 102 0.479 -4.139 3.116 1.00 72.51 H new ATOM 0 HE ARG A 102 2.614 -5.097 3.363 1.00 20.24 H new ATOM 0 HH11 ARG A 102 2.586 -2.517 0.985 1.00 54.53 H new ATOM 0 HH12 ARG A 102 4.342 -2.508 0.784 1.00 54.53 H new ATOM 0 HH21 ARG A 102 4.867 -5.074 3.098 1.00 50.21 H new ATOM 0 HH22 ARG A 102 5.621 -3.943 1.970 1.00 50.21 H new ATOM 1655 N VAL A 103 -0.511 -6.571 -1.330 1.00 61.31 N ATOM 1656 CA VAL A 103 -0.737 -8.017 -1.307 1.00 22.05 C ATOM 1657 C VAL A 103 0.436 -8.742 -0.664 1.00 4.11 C ATOM 1658 O VAL A 103 1.558 -8.704 -1.170 1.00 23.25 O ATOM 1659 CB VAL A 103 -0.938 -8.520 -2.743 1.00 35.21 C ATOM 1660 CG1 VAL A 103 0.313 -8.227 -3.579 1.00 4.22 C ATOM 1661 CG2 VAL A 103 -1.207 -10.030 -2.737 1.00 62.12 C ATOM 0 H VAL A 103 0.288 -6.268 -1.888 1.00 61.31 H new ATOM 0 HA VAL A 103 -1.628 -8.223 -0.714 1.00 22.05 H new ATOM 0 HB VAL A 103 -1.793 -8.004 -3.180 1.00 35.21 H new ATOM 0 HG11 VAL A 103 0.163 -8.587 -4.597 1.00 4.22 H new ATOM 0 HG12 VAL A 103 0.495 -7.152 -3.597 1.00 4.22 H new ATOM 0 HG13 VAL A 103 1.172 -8.733 -3.138 1.00 4.22 H new ATOM 0 HG21 VAL A 103 -1.348 -10.378 -3.760 1.00 62.12 H new ATOM 0 HG22 VAL A 103 -0.359 -10.549 -2.291 1.00 62.12 H new ATOM 0 HG23 VAL A 103 -2.105 -10.237 -2.156 1.00 62.12 H new ATOM 1671 N LYS A 104 0.168 -9.412 0.451 1.00 3.15 N ATOM 1672 CA LYS A 104 1.193 -10.162 1.162 1.00 32.13 C ATOM 1673 C LYS A 104 1.110 -11.624 0.752 1.00 22.11 C ATOM 1674 O LYS A 104 0.155 -12.036 0.096 1.00 10.01 O ATOM 1675 CB LYS A 104 0.981 -10.025 2.675 1.00 14.51 C ATOM 1676 CG LYS A 104 2.265 -10.400 3.422 1.00 2.35 C ATOM 1677 CD LYS A 104 2.092 -10.099 4.912 1.00 64.04 C ATOM 1678 CE LYS A 104 3.417 -10.338 5.640 1.00 0.02 C ATOM 1679 NZ LYS A 104 3.344 -9.751 7.007 1.00 4.41 N ATOM 0 H LYS A 104 -0.755 -9.450 0.883 1.00 3.15 H new ATOM 0 HA LYS A 104 2.179 -9.770 0.911 1.00 32.13 H new ATOM 0 HB2 LYS A 104 0.695 -9.002 2.919 1.00 14.51 H new ATOM 0 HB3 LYS A 104 0.163 -10.670 2.995 1.00 14.51 H new ATOM 0 HG2 LYS A 104 2.488 -11.457 3.277 1.00 2.35 H new ATOM 0 HG3 LYS A 104 3.109 -9.838 3.022 1.00 2.35 H new ATOM 0 HD2 LYS A 104 1.770 -9.067 5.050 1.00 64.04 H new ATOM 0 HD3 LYS A 104 1.314 -10.735 5.334 1.00 64.04 H new ATOM 0 HE2 LYS A 104 3.623 -11.407 5.702 1.00 0.02 H new ATOM 0 HE3 LYS A 104 4.238 -9.887 5.082 1.00 0.02 H new ATOM 0 HZ1 LYS A 104 4.244 -9.913 7.503 1.00 4.41 H new ATOM 0 HZ2 LYS A 104 3.166 -8.729 6.937 1.00 4.41 H new ATOM 0 HZ3 LYS A 104 2.571 -10.201 7.537 1.00 4.41 H new ATOM 1693 N ASP A 105 2.109 -12.406 1.126 1.00 4.52 N ATOM 1694 CA ASP A 105 2.115 -13.814 0.766 1.00 33.04 C ATOM 1695 C ASP A 105 0.862 -14.508 1.295 1.00 40.01 C ATOM 1696 O ASP A 105 0.723 -14.739 2.496 1.00 25.42 O ATOM 1697 CB ASP A 105 3.359 -14.495 1.338 1.00 54.53 C ATOM 1698 CG ASP A 105 4.613 -13.926 0.683 1.00 72.43 C ATOM 1699 OD1 ASP A 105 4.480 -13.287 -0.348 1.00 31.34 O ATOM 1700 OD2 ASP A 105 5.687 -14.137 1.222 1.00 4.54 O ATOM 0 H ASP A 105 2.914 -12.097 1.670 1.00 4.52 H new ATOM 0 HA ASP A 105 2.128 -13.891 -0.321 1.00 33.04 H new ATOM 0 HB2 ASP A 105 3.402 -14.345 2.417 1.00 54.53 H new ATOM 0 HB3 ASP A 105 3.306 -15.570 1.168 1.00 54.53 H new ATOM 1705 N GLY A 106 -0.031 -14.868 0.374 1.00 64.04 N ATOM 1706 CA GLY A 106 -1.259 -15.574 0.730 1.00 22.21 C ATOM 1707 C GLY A 106 -2.401 -14.630 1.110 1.00 71.13 C ATOM 1708 O GLY A 106 -3.513 -15.088 1.376 1.00 62.32 O ATOM 0 H GLY A 106 0.074 -14.682 -0.623 1.00 64.04 H new ATOM 0 HA2 GLY A 106 -1.572 -16.194 -0.110 1.00 22.21 H new ATOM 0 HA3 GLY A 106 -1.057 -16.246 1.564 1.00 22.21 H new ATOM 1712 N ARG A 107 -2.137 -13.323 1.155 1.00 52.25 N ATOM 1713 CA ARG A 107 -3.184 -12.363 1.532 1.00 30.51 C ATOM 1714 C ARG A 107 -3.226 -11.164 0.586 1.00 45.05 C ATOM 1715 O ARG A 107 -2.192 -10.675 0.132 1.00 5.05 O ATOM 1716 CB ARG A 107 -2.939 -11.871 2.959 1.00 72.11 C ATOM 1717 CG ARG A 107 -4.184 -11.143 3.470 1.00 50.40 C ATOM 1718 CD ARG A 107 -3.941 -10.656 4.899 1.00 41.32 C ATOM 1719 NE ARG A 107 -5.170 -10.111 5.462 1.00 31.44 N ATOM 1720 CZ ARG A 107 -5.588 -8.889 5.148 1.00 60.31 C ATOM 1721 NH1 ARG A 107 -4.893 -8.155 4.323 1.00 52.42 N ATOM 1722 NH2 ARG A 107 -6.692 -8.423 5.665 1.00 73.55 N ATOM 0 H ARG A 107 -1.230 -12.909 0.941 1.00 52.25 H new ATOM 0 HA ARG A 107 -4.143 -12.877 1.467 1.00 30.51 H new ATOM 0 HB2 ARG A 107 -2.705 -12.713 3.610 1.00 72.11 H new ATOM 0 HB3 ARG A 107 -2.079 -11.202 2.981 1.00 72.11 H new ATOM 0 HG2 ARG A 107 -4.416 -10.298 2.821 1.00 50.40 H new ATOM 0 HG3 ARG A 107 -5.045 -11.811 3.444 1.00 50.40 H new ATOM 0 HD2 ARG A 107 -3.584 -11.481 5.516 1.00 41.32 H new ATOM 0 HD3 ARG A 107 -3.161 -9.894 4.904 1.00 41.32 H new ATOM 0 HE ARG A 107 -5.719 -10.678 6.109 1.00 31.44 H new ATOM 0 HH11 ARG A 107 -4.030 -8.519 3.920 1.00 52.42 H new ATOM 0 HH12 ARG A 107 -5.213 -7.217 4.081 1.00 52.42 H new ATOM 0 HH21 ARG A 107 -7.235 -8.997 6.311 1.00 73.55 H new ATOM 0 HH22 ARG A 107 -7.012 -7.485 5.424 1.00 73.55 H new ATOM 1736 N THR A 108 -4.445 -10.686 0.319 1.00 4.34 N ATOM 1737 CA THR A 108 -4.659 -9.527 -0.552 1.00 63.42 C ATOM 1738 C THR A 108 -5.393 -8.439 0.224 1.00 41.25 C ATOM 1739 O THR A 108 -6.169 -8.740 1.132 1.00 23.14 O ATOM 1740 CB THR A 108 -5.487 -9.935 -1.774 1.00 61.41 C ATOM 1741 OG1 THR A 108 -4.851 -11.022 -2.432 1.00 42.34 O ATOM 1742 CG2 THR A 108 -5.601 -8.751 -2.735 1.00 65.12 C ATOM 0 H THR A 108 -5.304 -11.087 0.696 1.00 4.34 H new ATOM 0 HA THR A 108 -3.694 -9.148 -0.888 1.00 63.42 H new ATOM 0 HB THR A 108 -6.484 -10.236 -1.454 1.00 61.41 H new ATOM 0 HG1 THR A 108 -5.380 -11.286 -3.214 1.00 42.34 H new ATOM 0 HG21 THR A 108 -6.191 -9.043 -3.604 1.00 65.12 H new ATOM 0 HG22 THR A 108 -6.089 -7.918 -2.229 1.00 65.12 H new ATOM 0 HG23 THR A 108 -4.605 -8.447 -3.058 1.00 65.12 H new ATOM 1750 N LEU A 109 -5.137 -7.175 -0.111 1.00 43.23 N ATOM 1751 CA LEU A 109 -5.782 -6.074 0.605 1.00 64.43 C ATOM 1752 C LEU A 109 -6.054 -4.890 -0.296 1.00 14.32 C ATOM 1753 O LEU A 109 -5.303 -4.604 -1.229 1.00 21.44 O ATOM 1754 CB LEU A 109 -4.872 -5.616 1.740 1.00 3.33 C ATOM 1755 CG LEU A 109 -5.453 -4.404 2.485 1.00 55.33 C ATOM 1756 CD1 LEU A 109 -6.752 -4.798 3.197 1.00 64.01 C ATOM 1757 CD2 LEU A 109 -4.429 -3.930 3.523 1.00 13.03 C ATOM 0 H LEU A 109 -4.502 -6.891 -0.857 1.00 43.23 H new ATOM 0 HA LEU A 109 -6.736 -6.442 0.984 1.00 64.43 H new ATOM 0 HB2 LEU A 109 -4.725 -6.437 2.441 1.00 3.33 H new ATOM 0 HB3 LEU A 109 -3.891 -5.360 1.339 1.00 3.33 H new ATOM 0 HG LEU A 109 -5.668 -3.606 1.774 1.00 55.33 H new ATOM 0 HD11 LEU A 109 -7.156 -3.932 3.722 1.00 64.01 H new ATOM 0 HD12 LEU A 109 -7.478 -5.148 2.463 1.00 64.01 H new ATOM 0 HD13 LEU A 109 -6.547 -5.594 3.913 1.00 64.01 H new ATOM 0 HD21 LEU A 109 -4.827 -3.069 4.060 1.00 13.03 H new ATOM 0 HD22 LEU A 109 -4.226 -4.736 4.228 1.00 13.03 H new ATOM 0 HD23 LEU A 109 -3.505 -3.647 3.019 1.00 13.03 H new ATOM 1769 N HIS A 110 -7.126 -4.181 0.030 1.00 4.52 N ATOM 1770 CA HIS A 110 -7.498 -2.990 -0.705 1.00 62.11 C ATOM 1771 C HIS A 110 -7.871 -1.882 0.276 1.00 21.10 C ATOM 1772 O HIS A 110 -8.429 -2.156 1.338 1.00 1.34 O ATOM 1773 CB HIS A 110 -8.670 -3.285 -1.642 1.00 64.31 C ATOM 1774 CG HIS A 110 -9.865 -3.706 -0.831 1.00 54.24 C ATOM 1775 ND1 HIS A 110 -10.068 -5.020 -0.442 1.00 13.34 N ATOM 1776 CD2 HIS A 110 -10.930 -2.998 -0.331 1.00 63.31 C ATOM 1777 CE1 HIS A 110 -11.215 -5.063 0.261 1.00 5.01 C ATOM 1778 NE2 HIS A 110 -11.780 -3.857 0.358 1.00 62.11 N ATOM 0 H HIS A 110 -7.752 -4.414 0.801 1.00 4.52 H new ATOM 0 HA HIS A 110 -6.651 -2.665 -1.309 1.00 62.11 H new ATOM 0 HB2 HIS A 110 -8.910 -2.400 -2.231 1.00 64.31 H new ATOM 0 HB3 HIS A 110 -8.398 -4.072 -2.345 1.00 64.31 H new ATOM 0 HD2 HIS A 110 -11.084 -1.936 -0.454 1.00 63.31 H new ATOM 0 HE1 HIS A 110 -11.628 -5.962 0.694 1.00 5.01 H new ATOM 0 HE2 HIS A 110 -12.649 -3.617 0.835 1.00 62.11 H new ATOM 1786 N MET A 111 -7.565 -0.631 -0.070 1.00 60.55 N ATOM 1787 CA MET A 111 -7.884 0.488 0.811 1.00 21.20 C ATOM 1788 C MET A 111 -7.955 1.797 0.021 1.00 44.45 C ATOM 1789 O MET A 111 -7.297 1.945 -1.009 1.00 23.21 O ATOM 1790 CB MET A 111 -6.832 0.603 1.919 1.00 70.05 C ATOM 1791 CG MET A 111 -5.442 0.317 1.349 1.00 54.42 C ATOM 1792 SD MET A 111 -4.188 0.917 2.512 1.00 4.41 S ATOM 1793 CE MET A 111 -3.703 2.406 1.602 1.00 62.20 C ATOM 0 H MET A 111 -7.103 -0.371 -0.942 1.00 60.55 H new ATOM 0 HA MET A 111 -8.859 0.302 1.261 1.00 21.20 H new ATOM 0 HB2 MET A 111 -6.858 1.602 2.354 1.00 70.05 H new ATOM 0 HB3 MET A 111 -7.057 -0.100 2.721 1.00 70.05 H new ATOM 0 HG2 MET A 111 -5.318 -0.753 1.181 1.00 54.42 H new ATOM 0 HG3 MET A 111 -5.324 0.807 0.383 1.00 54.42 H new ATOM 0 HE1 MET A 111 -3.120 3.057 2.254 1.00 62.20 H new ATOM 0 HE2 MET A 111 -3.101 2.124 0.738 1.00 62.20 H new ATOM 0 HE3 MET A 111 -4.595 2.934 1.266 1.00 62.20 H new ATOM 1803 N MET A 112 -8.739 2.753 0.521 1.00 1.24 N ATOM 1804 CA MET A 112 -8.861 4.056 -0.142 1.00 41.25 C ATOM 1805 C MET A 112 -7.991 5.073 0.584 1.00 62.23 C ATOM 1806 O MET A 112 -7.924 5.074 1.812 1.00 24.34 O ATOM 1807 CB MET A 112 -10.315 4.579 -0.131 1.00 1.31 C ATOM 1808 CG MET A 112 -11.333 3.437 -0.092 1.00 72.30 C ATOM 1809 SD MET A 112 -11.516 2.729 -1.750 1.00 21.22 S ATOM 1810 CE MET A 112 -12.278 4.167 -2.552 1.00 60.13 C ATOM 0 H MET A 112 -9.293 2.654 1.372 1.00 1.24 H new ATOM 0 HA MET A 112 -8.544 3.925 -1.177 1.00 41.25 H new ATOM 0 HB2 MET A 112 -10.462 5.225 0.734 1.00 1.31 H new ATOM 0 HB3 MET A 112 -10.488 5.189 -1.018 1.00 1.31 H new ATOM 0 HG2 MET A 112 -11.006 2.669 0.608 1.00 72.30 H new ATOM 0 HG3 MET A 112 -12.295 3.806 0.265 1.00 72.30 H new ATOM 0 HE1 MET A 112 -13.173 3.853 -3.088 1.00 60.13 H new ATOM 0 HE2 MET A 112 -12.548 4.904 -1.796 1.00 60.13 H new ATOM 0 HE3 MET A 112 -11.571 4.609 -3.254 1.00 60.13 H new ATOM 1820 N ARG A 113 -7.332 5.942 -0.173 1.00 24.51 N ATOM 1821 CA ARG A 113 -6.474 6.961 0.425 1.00 61.01 C ATOM 1822 C ARG A 113 -6.849 8.337 -0.106 1.00 42.32 C ATOM 1823 O ARG A 113 -6.968 8.537 -1.315 1.00 50.01 O ATOM 1824 CB ARG A 113 -5.009 6.647 0.090 1.00 13.15 C ATOM 1825 CG ARG A 113 -4.095 7.828 0.485 1.00 5.41 C ATOM 1826 CD ARG A 113 -3.752 8.684 -0.744 1.00 24.14 C ATOM 1827 NE ARG A 113 -2.597 9.524 -0.455 1.00 43.44 N ATOM 1828 CZ ARG A 113 -1.985 10.207 -1.417 1.00 42.21 C ATOM 1829 NH1 ARG A 113 -2.426 10.145 -2.644 1.00 24.31 N ATOM 1830 NH2 ARG A 113 -0.945 10.943 -1.134 1.00 10.22 N ATOM 0 H ARG A 113 -7.373 5.963 -1.192 1.00 24.51 H new ATOM 0 HA ARG A 113 -6.607 6.959 1.507 1.00 61.01 H new ATOM 0 HB2 ARG A 113 -4.695 5.746 0.616 1.00 13.15 H new ATOM 0 HB3 ARG A 113 -4.910 6.444 -0.976 1.00 13.15 H new ATOM 0 HG2 ARG A 113 -4.591 8.443 1.236 1.00 5.41 H new ATOM 0 HG3 ARG A 113 -3.179 7.449 0.938 1.00 5.41 H new ATOM 0 HD2 ARG A 113 -3.541 8.041 -1.599 1.00 24.14 H new ATOM 0 HD3 ARG A 113 -4.606 9.305 -1.016 1.00 24.14 H new ATOM 0 HE ARG A 113 -2.252 9.589 0.503 1.00 43.44 H new ATOM 0 HH11 ARG A 113 -3.241 9.572 -2.865 1.00 24.31 H new ATOM 0 HH12 ARG A 113 -1.956 10.669 -3.382 1.00 24.31 H new ATOM 0 HH21 ARG A 113 -0.602 10.994 -0.175 1.00 10.22 H new ATOM 0 HH22 ARG A 113 -0.475 11.467 -1.872 1.00 10.22 H new ATOM 1844 N LEU A 114 -7.051 9.282 0.812 1.00 44.05 N ATOM 1845 CA LEU A 114 -7.432 10.643 0.448 1.00 33.01 C ATOM 1846 C LEU A 114 -6.333 11.618 0.841 1.00 22.40 C ATOM 1847 O LEU A 114 -5.891 11.649 2.002 1.00 63.31 O ATOM 1848 CB LEU A 114 -8.736 11.009 1.165 1.00 60.50 C ATOM 1849 CG LEU A 114 -9.055 12.500 0.983 1.00 65.24 C ATOM 1850 CD1 LEU A 114 -9.107 12.843 -0.510 1.00 31.23 C ATOM 1851 CD2 LEU A 114 -10.414 12.810 1.625 1.00 32.04 C ATOM 0 H LEU A 114 -6.956 9.127 1.816 1.00 44.05 H new ATOM 0 HA LEU A 114 -7.579 10.701 -0.631 1.00 33.01 H new ATOM 0 HB2 LEU A 114 -9.555 10.406 0.772 1.00 60.50 H new ATOM 0 HB3 LEU A 114 -8.651 10.777 2.227 1.00 60.50 H new ATOM 0 HG LEU A 114 -8.277 13.096 1.461 1.00 65.24 H new ATOM 0 HD11 LEU A 114 -9.334 13.902 -0.632 1.00 31.23 H new ATOM 0 HD12 LEU A 114 -8.142 12.623 -0.968 1.00 31.23 H new ATOM 0 HD13 LEU A 114 -9.882 12.248 -0.993 1.00 31.23 H new ATOM 0 HD21 LEU A 114 -10.644 13.868 1.498 1.00 32.04 H new ATOM 0 HD22 LEU A 114 -11.188 12.210 1.146 1.00 32.04 H new ATOM 0 HD23 LEU A 114 -10.377 12.572 2.688 1.00 32.04 H new ATOM 1863 N TYR A 115 -5.888 12.399 -0.143 1.00 44.23 N ATOM 1864 CA TYR A 115 -4.825 13.374 0.065 1.00 40.14 C ATOM 1865 C TYR A 115 -5.305 14.791 -0.263 1.00 22.21 C ATOM 1866 O TYR A 115 -6.277 14.978 -0.996 1.00 31.11 O ATOM 1867 CB TYR A 115 -3.615 12.985 -0.821 1.00 72.13 C ATOM 1868 CG TYR A 115 -3.403 13.993 -1.937 1.00 45.11 C ATOM 1869 CD1 TYR A 115 -4.429 14.238 -2.858 1.00 0.14 C ATOM 1870 CD2 TYR A 115 -2.185 14.677 -2.051 1.00 5.33 C ATOM 1871 CE1 TYR A 115 -4.240 15.163 -3.890 1.00 24.35 C ATOM 1872 CE2 TYR A 115 -1.998 15.604 -3.085 1.00 60.25 C ATOM 1873 CZ TYR A 115 -3.025 15.846 -4.004 1.00 33.12 C ATOM 1874 OH TYR A 115 -2.839 16.759 -5.022 1.00 75.14 O ATOM 0 H TYR A 115 -6.251 12.373 -1.096 1.00 44.23 H new ATOM 0 HA TYR A 115 -4.529 13.368 1.114 1.00 40.14 H new ATOM 0 HB2 TYR A 115 -2.716 12.924 -0.207 1.00 72.13 H new ATOM 0 HB3 TYR A 115 -3.777 11.995 -1.248 1.00 72.13 H new ATOM 0 HD1 TYR A 115 -5.368 13.712 -2.771 1.00 0.14 H new ATOM 0 HD2 TYR A 115 -1.391 14.490 -1.343 1.00 5.33 H new ATOM 0 HE1 TYR A 115 -5.033 15.350 -4.599 1.00 24.35 H new ATOM 0 HE2 TYR A 115 -1.060 16.132 -3.173 1.00 60.25 H new ATOM 0 HH TYR A 115 -3.266 17.608 -4.782 1.00 75.14 H new ATOM 1884 N SER A 116 -4.592 15.780 0.272 1.00 70.41 N ATOM 1885 CA SER A 116 -4.912 17.187 0.031 1.00 12.03 C ATOM 1886 C SER A 116 -3.689 17.895 -0.540 1.00 55.25 C ATOM 1887 O SER A 116 -2.558 17.543 -0.214 1.00 2.11 O ATOM 1888 CB SER A 116 -5.323 17.867 1.337 1.00 21.23 C ATOM 1889 OG SER A 116 -5.504 19.256 1.102 1.00 45.04 O ATOM 0 H SER A 116 -3.785 15.633 0.878 1.00 70.41 H new ATOM 0 HA SER A 116 -5.739 17.245 -0.677 1.00 12.03 H new ATOM 0 HB2 SER A 116 -6.245 17.427 1.716 1.00 21.23 H new ATOM 0 HB3 SER A 116 -4.559 17.711 2.099 1.00 21.23 H new ATOM 0 HG SER A 116 -5.330 19.753 1.929 1.00 45.04 H new ATOM 1895 N ARG A 117 -3.908 18.895 -1.388 1.00 43.54 N ATOM 1896 CA ARG A 117 -2.795 19.634 -1.977 1.00 25.41 C ATOM 1897 C ARG A 117 -2.298 20.685 -0.998 1.00 54.24 C ATOM 1898 O ARG A 117 -1.143 21.108 -1.051 1.00 55.14 O ATOM 1899 CB ARG A 117 -3.254 20.318 -3.268 1.00 32.42 C ATOM 1900 CG ARG A 117 -2.087 21.077 -3.923 1.00 15.50 C ATOM 1901 CD ARG A 117 -0.991 20.099 -4.361 1.00 50.14 C ATOM 1902 NE ARG A 117 -0.138 20.724 -5.366 1.00 63.53 N ATOM 1903 CZ ARG A 117 0.663 21.737 -5.050 1.00 63.54 C ATOM 1904 NH1 ARG A 117 0.697 22.186 -3.826 1.00 72.23 N ATOM 1905 NH2 ARG A 117 1.417 22.284 -5.965 1.00 71.13 N ATOM 0 H ARG A 117 -4.833 19.210 -1.680 1.00 43.54 H new ATOM 0 HA ARG A 117 -1.986 18.939 -2.202 1.00 25.41 H new ATOM 0 HB2 ARG A 117 -3.645 19.573 -3.961 1.00 32.42 H new ATOM 0 HB3 ARG A 117 -4.068 21.009 -3.050 1.00 32.42 H new ATOM 0 HG2 ARG A 117 -2.448 21.638 -4.785 1.00 15.50 H new ATOM 0 HG3 ARG A 117 -1.676 21.802 -3.220 1.00 15.50 H new ATOM 0 HD2 ARG A 117 -0.393 19.800 -3.500 1.00 50.14 H new ATOM 0 HD3 ARG A 117 -1.441 19.193 -4.767 1.00 50.14 H new ATOM 0 HE ARG A 117 -0.156 20.379 -6.326 1.00 63.53 H new ATOM 0 HH11 ARG A 117 0.109 21.760 -3.110 1.00 72.23 H new ATOM 0 HH12 ARG A 117 1.312 22.963 -3.585 1.00 72.23 H new ATOM 0 HH21 ARG A 117 1.392 21.934 -6.923 1.00 71.13 H new ATOM 0 HH22 ARG A 117 2.031 23.061 -5.722 1.00 71.13 H new ATOM 1919 N SER A 118 -3.187 21.098 -0.103 1.00 24.42 N ATOM 1920 CA SER A 118 -2.859 22.106 0.902 1.00 34.12 C ATOM 1921 C SER A 118 -3.100 21.549 2.308 1.00 61.40 C ATOM 1922 O SER A 118 -4.040 20.783 2.519 1.00 0.21 O ATOM 1923 CB SER A 118 -3.731 23.341 0.680 1.00 11.54 C ATOM 1924 OG SER A 118 -3.380 24.347 1.618 1.00 62.22 O ATOM 0 H SER A 118 -4.144 20.750 -0.051 1.00 24.42 H new ATOM 0 HA SER A 118 -1.807 22.377 0.808 1.00 34.12 H new ATOM 0 HB2 SER A 118 -3.598 23.714 -0.335 1.00 11.54 H new ATOM 0 HB3 SER A 118 -4.784 23.080 0.789 1.00 11.54 H new ATOM 0 HG SER A 118 -3.740 24.113 2.499 1.00 62.22 H new ATOM 1930 N PRO A 119 -2.282 21.911 3.267 1.00 14.32 N ATOM 1931 CA PRO A 119 -2.427 21.429 4.669 1.00 30.02 C ATOM 1932 C PRO A 119 -3.888 21.296 5.098 1.00 14.44 C ATOM 1933 O PRO A 119 -4.209 20.529 6.004 1.00 34.41 O ATOM 1934 CB PRO A 119 -1.709 22.511 5.477 1.00 55.11 C ATOM 1935 CG PRO A 119 -0.632 23.023 4.570 1.00 1.31 C ATOM 1936 CD PRO A 119 -1.124 22.815 3.130 1.00 1.25 C ATOM 0 HA PRO A 119 -2.015 20.430 4.809 1.00 30.02 H new ATOM 0 HB2 PRO A 119 -2.394 23.308 5.765 1.00 55.11 H new ATOM 0 HB3 PRO A 119 -1.289 22.103 6.397 1.00 55.11 H new ATOM 0 HG2 PRO A 119 -0.435 24.078 4.762 1.00 1.31 H new ATOM 0 HG3 PRO A 119 0.302 22.488 4.740 1.00 1.31 H new ATOM 0 HD2 PRO A 119 -1.409 23.760 2.667 1.00 1.25 H new ATOM 0 HD3 PRO A 119 -0.348 22.375 2.504 1.00 1.25 H new ATOM 1944 N GLU A 120 -4.770 22.047 4.441 1.00 24.15 N ATOM 1945 CA GLU A 120 -6.190 22.006 4.762 1.00 14.33 C ATOM 1946 C GLU A 120 -6.907 20.997 3.876 1.00 33.04 C ATOM 1947 O GLU A 120 -6.361 20.529 2.877 1.00 2.01 O ATOM 1948 CB GLU A 120 -6.809 23.388 4.557 1.00 72.33 C ATOM 1949 CG GLU A 120 -6.083 24.409 5.435 1.00 42.31 C ATOM 1950 CD GLU A 120 -4.707 24.716 4.853 1.00 41.13 C ATOM 1951 OE1 GLU A 120 -4.470 24.341 3.717 1.00 32.14 O ATOM 1952 OE2 GLU A 120 -3.912 25.321 5.552 1.00 41.25 O ATOM 0 H GLU A 120 -4.525 22.688 3.686 1.00 24.15 H new ATOM 0 HA GLU A 120 -6.300 21.706 5.804 1.00 14.33 H new ATOM 0 HB2 GLU A 120 -6.737 23.678 3.509 1.00 72.33 H new ATOM 0 HB3 GLU A 120 -7.869 23.364 4.809 1.00 72.33 H new ATOM 0 HG2 GLU A 120 -6.670 25.325 5.503 1.00 42.31 H new ATOM 0 HG3 GLU A 120 -5.980 24.021 6.448 1.00 42.31 H new ATOM 1959 N VAL A 121 -8.136 20.672 4.252 1.00 32.41 N ATOM 1960 CA VAL A 121 -8.947 19.717 3.496 1.00 31.23 C ATOM 1961 C VAL A 121 -10.199 20.395 2.950 1.00 11.20 C ATOM 1962 O VAL A 121 -10.956 21.015 3.698 1.00 54.50 O ATOM 1963 CB VAL A 121 -9.352 18.550 4.399 1.00 24.01 C ATOM 1964 CG1 VAL A 121 -9.935 17.422 3.545 1.00 44.14 C ATOM 1965 CG2 VAL A 121 -8.120 18.036 5.149 1.00 23.14 C ATOM 0 H VAL A 121 -8.598 21.054 5.077 1.00 32.41 H new ATOM 0 HA VAL A 121 -8.354 19.344 2.661 1.00 31.23 H new ATOM 0 HB VAL A 121 -10.101 18.887 5.115 1.00 24.01 H new ATOM 0 HG11 VAL A 121 -10.224 16.591 4.188 1.00 44.14 H new ATOM 0 HG12 VAL A 121 -10.811 17.787 3.009 1.00 44.14 H new ATOM 0 HG13 VAL A 121 -9.186 17.084 2.829 1.00 44.14 H new ATOM 0 HG21 VAL A 121 -8.407 17.205 5.793 1.00 23.14 H new ATOM 0 HG22 VAL A 121 -7.372 17.698 4.432 1.00 23.14 H new ATOM 0 HG23 VAL A 121 -7.703 18.839 5.757 1.00 23.14 H new ATOM 1975 N SER A 122 -10.413 20.272 1.644 1.00 22.43 N ATOM 1976 CA SER A 122 -11.579 20.878 1.012 1.00 34.13 C ATOM 1977 C SER A 122 -12.834 20.039 1.289 1.00 33.32 C ATOM 1978 O SER A 122 -12.884 18.867 0.913 1.00 72.35 O ATOM 1979 CB SER A 122 -11.356 20.968 -0.498 1.00 1.24 C ATOM 1980 OG SER A 122 -12.316 21.851 -1.063 1.00 2.34 O ATOM 0 H SER A 122 -9.800 19.763 1.007 1.00 22.43 H new ATOM 0 HA SER A 122 -11.720 21.877 1.425 1.00 34.13 H new ATOM 0 HB2 SER A 122 -10.348 21.326 -0.708 1.00 1.24 H new ATOM 0 HB3 SER A 122 -11.444 19.980 -0.950 1.00 1.24 H new ATOM 0 HG SER A 122 -12.175 21.912 -2.031 1.00 2.34 H new ATOM 1986 N PRO A 123 -13.845 20.593 1.927 1.00 54.42 N ATOM 1987 CA PRO A 123 -15.097 19.840 2.229 1.00 11.10 C ATOM 1988 C PRO A 123 -15.555 18.984 1.049 1.00 22.23 C ATOM 1989 O PRO A 123 -16.192 17.947 1.233 1.00 75.20 O ATOM 1990 CB PRO A 123 -16.109 20.945 2.536 1.00 22.35 C ATOM 1991 CG PRO A 123 -15.296 22.065 3.099 1.00 22.41 C ATOM 1992 CD PRO A 123 -13.918 21.980 2.431 1.00 4.40 C ATOM 0 HA PRO A 123 -14.968 19.133 3.049 1.00 11.10 H new ATOM 0 HB2 PRO A 123 -16.640 21.256 1.636 1.00 22.35 H new ATOM 0 HB3 PRO A 123 -16.861 20.605 3.248 1.00 22.35 H new ATOM 0 HG2 PRO A 123 -15.767 23.027 2.896 1.00 22.41 H new ATOM 0 HG3 PRO A 123 -15.209 21.975 4.182 1.00 22.41 H new ATOM 0 HD2 PRO A 123 -13.822 22.704 1.621 1.00 4.40 H new ATOM 0 HD3 PRO A 123 -13.118 22.189 3.141 1.00 4.40 H new ATOM 2000 N ALA A 124 -15.223 19.424 -0.160 1.00 61.43 N ATOM 2001 CA ALA A 124 -15.604 18.690 -1.361 1.00 54.43 C ATOM 2002 C ALA A 124 -14.760 17.427 -1.505 1.00 24.52 C ATOM 2003 O ALA A 124 -15.230 16.409 -2.012 1.00 33.51 O ATOM 2004 CB ALA A 124 -15.417 19.573 -2.596 1.00 61.51 C ATOM 0 H ALA A 124 -14.695 20.279 -0.334 1.00 61.43 H new ATOM 0 HA ALA A 124 -16.653 18.407 -1.274 1.00 54.43 H new ATOM 0 HB1 ALA A 124 -15.704 19.016 -3.488 1.00 61.51 H new ATOM 0 HB2 ALA A 124 -16.042 20.462 -2.506 1.00 61.51 H new ATOM 0 HB3 ALA A 124 -14.372 19.871 -2.675 1.00 61.51 H new ATOM 2010 N ALA A 125 -13.512 17.504 -1.054 1.00 63.15 N ATOM 2011 CA ALA A 125 -12.609 16.362 -1.136 1.00 32.45 C ATOM 2012 C ALA A 125 -13.108 15.219 -0.258 1.00 51.42 C ATOM 2013 O ALA A 125 -13.036 14.054 -0.640 1.00 53.31 O ATOM 2014 CB ALA A 125 -11.208 16.776 -0.681 1.00 71.13 C ATOM 0 H ALA A 125 -13.105 18.338 -0.631 1.00 63.15 H new ATOM 0 HA ALA A 125 -12.575 16.023 -2.171 1.00 32.45 H new ATOM 0 HB1 ALA A 125 -10.537 15.919 -0.744 1.00 71.13 H new ATOM 0 HB2 ALA A 125 -10.838 17.575 -1.324 1.00 71.13 H new ATOM 0 HB3 ALA A 125 -11.250 17.129 0.349 1.00 71.13 H new ATOM 2020 N THR A 126 -13.624 15.566 0.913 1.00 42.04 N ATOM 2021 CA THR A 126 -14.147 14.564 1.833 1.00 3.13 C ATOM 2022 C THR A 126 -15.492 14.030 1.335 1.00 51.41 C ATOM 2023 O THR A 126 -15.842 12.874 1.574 1.00 54.21 O ATOM 2024 CB THR A 126 -14.293 15.154 3.245 1.00 62.31 C ATOM 2025 OG1 THR A 126 -13.279 16.128 3.452 1.00 4.54 O ATOM 2026 CG2 THR A 126 -14.154 14.044 4.299 1.00 2.32 C ATOM 0 H THR A 126 -13.692 16.527 1.247 1.00 42.04 H new ATOM 0 HA THR A 126 -13.441 13.735 1.877 1.00 3.13 H new ATOM 0 HB THR A 126 -15.276 15.614 3.340 1.00 62.31 H new ATOM 0 HG1 THR A 126 -13.369 16.508 4.351 1.00 4.54 H new ATOM 0 HG21 THR A 126 -14.259 14.473 5.295 1.00 2.32 H new ATOM 0 HG22 THR A 126 -14.930 13.295 4.143 1.00 2.32 H new ATOM 0 HG23 THR A 126 -13.174 13.576 4.207 1.00 2.32 H new ATOM 2034 N ALA A 127 -16.266 14.882 0.667 1.00 65.22 N ATOM 2035 CA ALA A 127 -17.577 14.481 0.169 1.00 34.13 C ATOM 2036 C ALA A 127 -17.477 13.601 -1.074 1.00 11.24 C ATOM 2037 O ALA A 127 -18.098 12.541 -1.138 1.00 55.12 O ATOM 2038 CB ALA A 127 -18.379 15.723 -0.170 1.00 60.02 C ATOM 0 H ALA A 127 -16.010 15.847 0.460 1.00 65.22 H new ATOM 0 HA ALA A 127 -18.066 13.900 0.951 1.00 34.13 H new ATOM 0 HB1 ALA A 127 -19.361 15.432 -0.543 1.00 60.02 H new ATOM 0 HB2 ALA A 127 -18.498 16.335 0.724 1.00 60.02 H new ATOM 0 HB3 ALA A 127 -17.856 16.296 -0.935 1.00 60.02 H new ATOM 2044 N ILE A 128 -16.679 14.021 -2.055 1.00 55.13 N ATOM 2045 CA ILE A 128 -16.513 13.222 -3.252 1.00 51.22 C ATOM 2046 C ILE A 128 -16.006 11.859 -2.810 1.00 20.04 C ATOM 2047 O ILE A 128 -16.431 10.810 -3.296 1.00 2.22 O ATOM 2048 CB ILE A 128 -15.526 13.931 -4.196 1.00 23.31 C ATOM 2049 CG1 ILE A 128 -15.792 13.515 -5.642 1.00 74.21 C ATOM 2050 CG2 ILE A 128 -14.072 13.606 -3.827 1.00 20.33 C ATOM 2051 CD1 ILE A 128 -15.731 11.991 -5.786 1.00 35.30 C ATOM 0 H ILE A 128 -16.150 14.893 -2.040 1.00 55.13 H new ATOM 0 HA ILE A 128 -17.447 13.097 -3.799 1.00 51.22 H new ATOM 0 HB ILE A 128 -15.676 15.006 -4.091 1.00 23.31 H new ATOM 0 HG12 ILE A 128 -16.772 13.876 -5.955 1.00 74.21 H new ATOM 0 HG13 ILE A 128 -15.056 13.977 -6.300 1.00 74.21 H new ATOM 0 HG21 ILE A 128 -13.399 14.122 -4.512 1.00 20.33 H new ATOM 0 HG22 ILE A 128 -13.873 13.935 -2.807 1.00 20.33 H new ATOM 0 HG23 ILE A 128 -13.910 12.531 -3.900 1.00 20.33 H new ATOM 0 HD11 ILE A 128 -15.923 11.716 -6.823 1.00 35.30 H new ATOM 0 HD12 ILE A 128 -14.742 11.637 -5.494 1.00 35.30 H new ATOM 0 HD13 ILE A 128 -16.484 11.534 -5.144 1.00 35.30 H new ATOM 2063 N PHE A 129 -15.108 11.921 -1.844 1.00 13.41 N ATOM 2064 CA PHE A 129 -14.528 10.730 -1.261 1.00 54.25 C ATOM 2065 C PHE A 129 -15.630 9.747 -0.868 1.00 74.13 C ATOM 2066 O PHE A 129 -15.508 8.540 -1.077 1.00 74.52 O ATOM 2067 CB PHE A 129 -13.739 11.094 -0.018 1.00 73.20 C ATOM 2068 CG PHE A 129 -13.167 9.828 0.561 1.00 44.02 C ATOM 2069 CD1 PHE A 129 -13.923 9.072 1.462 1.00 2.04 C ATOM 2070 CD2 PHE A 129 -11.894 9.397 0.179 1.00 32.52 C ATOM 2071 CE1 PHE A 129 -13.404 7.887 1.987 1.00 3.25 C ATOM 2072 CE2 PHE A 129 -11.371 8.211 0.705 1.00 60.31 C ATOM 2073 CZ PHE A 129 -12.128 7.457 1.611 1.00 71.35 C ATOM 0 H PHE A 129 -14.763 12.794 -1.445 1.00 13.41 H new ATOM 0 HA PHE A 129 -13.870 10.271 -1.998 1.00 54.25 H new ATOM 0 HB2 PHE A 129 -12.941 11.794 -0.265 1.00 73.20 H new ATOM 0 HB3 PHE A 129 -14.382 11.589 0.710 1.00 73.20 H new ATOM 0 HD1 PHE A 129 -14.909 9.405 1.752 1.00 2.04 H new ATOM 0 HD2 PHE A 129 -11.314 9.979 -0.522 1.00 32.52 H new ATOM 0 HE1 PHE A 129 -13.988 7.303 2.683 1.00 3.25 H new ATOM 0 HE2 PHE A 129 -10.386 7.877 0.413 1.00 60.31 H new ATOM 0 HZ PHE A 129 -11.725 6.542 2.020 1.00 71.35 H new ATOM 2083 N ARG A 130 -16.700 10.283 -0.282 1.00 22.32 N ATOM 2084 CA ARG A 130 -17.824 9.460 0.162 1.00 74.31 C ATOM 2085 C ARG A 130 -18.617 8.890 -1.019 1.00 62.24 C ATOM 2086 O ARG A 130 -19.079 7.750 -0.964 1.00 75.33 O ATOM 2087 CB ARG A 130 -18.754 10.295 1.053 1.00 71.01 C ATOM 2088 CG ARG A 130 -20.055 9.529 1.317 1.00 0.54 C ATOM 2089 CD ARG A 130 -20.802 10.177 2.485 1.00 74.22 C ATOM 2090 NE ARG A 130 -19.977 10.156 3.688 1.00 34.41 N ATOM 2091 CZ ARG A 130 -20.271 10.916 4.737 1.00 42.40 C ATOM 2092 NH1 ARG A 130 -21.315 11.699 4.702 1.00 72.53 N ATOM 2093 NH2 ARG A 130 -19.518 10.880 5.801 1.00 73.43 N ATOM 0 H ARG A 130 -16.812 11.281 -0.104 1.00 22.32 H new ATOM 0 HA ARG A 130 -17.419 8.620 0.726 1.00 74.31 H new ATOM 0 HB2 ARG A 130 -18.259 10.523 1.997 1.00 71.01 H new ATOM 0 HB3 ARG A 130 -18.975 11.247 0.571 1.00 71.01 H new ATOM 0 HG2 ARG A 130 -20.680 9.534 0.424 1.00 0.54 H new ATOM 0 HG3 ARG A 130 -19.835 8.486 1.546 1.00 0.54 H new ATOM 0 HD2 ARG A 130 -21.063 11.205 2.233 1.00 74.22 H new ATOM 0 HD3 ARG A 130 -21.736 9.646 2.667 1.00 74.22 H new ATOM 0 HE ARG A 130 -19.160 9.547 3.724 1.00 34.41 H new ATOM 0 HH11 ARG A 130 -21.904 11.727 3.870 1.00 72.53 H new ATOM 0 HH12 ARG A 130 -21.542 12.283 5.507 1.00 72.53 H new ATOM 0 HH21 ARG A 130 -18.703 10.268 5.828 1.00 73.43 H new ATOM 0 HH22 ARG A 130 -19.744 11.464 6.606 1.00 73.43 H new ATOM 2107 N LYS A 131 -18.803 9.689 -2.066 1.00 53.31 N ATOM 2108 CA LYS A 131 -19.579 9.241 -3.220 1.00 0.30 C ATOM 2109 C LYS A 131 -19.108 7.877 -3.718 1.00 22.32 C ATOM 2110 O LYS A 131 -19.880 6.919 -3.740 1.00 55.33 O ATOM 2111 CB LYS A 131 -19.458 10.264 -4.353 1.00 73.30 C ATOM 2112 CG LYS A 131 -20.475 9.938 -5.447 1.00 45.43 C ATOM 2113 CD LYS A 131 -20.276 10.891 -6.629 1.00 3.23 C ATOM 2114 CE LYS A 131 -21.456 10.760 -7.595 1.00 41.33 C ATOM 2115 NZ LYS A 131 -22.648 11.441 -7.017 1.00 70.02 N ATOM 0 H LYS A 131 -18.433 10.637 -2.140 1.00 53.31 H new ATOM 0 HA LYS A 131 -20.619 9.149 -2.907 1.00 0.30 H new ATOM 0 HB2 LYS A 131 -19.631 11.269 -3.969 1.00 73.30 H new ATOM 0 HB3 LYS A 131 -18.449 10.249 -4.764 1.00 73.30 H new ATOM 0 HG2 LYS A 131 -20.355 8.905 -5.774 1.00 45.43 H new ATOM 0 HG3 LYS A 131 -21.488 10.032 -5.056 1.00 45.43 H new ATOM 0 HD2 LYS A 131 -20.197 11.918 -6.272 1.00 3.23 H new ATOM 0 HD3 LYS A 131 -19.344 10.659 -7.144 1.00 3.23 H new ATOM 0 HE2 LYS A 131 -21.202 11.203 -8.558 1.00 41.33 H new ATOM 0 HE3 LYS A 131 -21.677 9.708 -7.776 1.00 41.33 H new ATOM 0 HZ1 LYS A 131 -23.350 11.608 -7.766 1.00 70.02 H new ATOM 0 HZ2 LYS A 131 -23.066 10.841 -6.278 1.00 70.02 H new ATOM 0 HZ3 LYS A 131 -22.361 12.351 -6.603 1.00 70.02 H new ATOM 2129 N LEU A 132 -17.845 7.790 -4.118 1.00 1.15 N ATOM 2130 CA LEU A 132 -17.306 6.527 -4.612 1.00 21.42 C ATOM 2131 C LEU A 132 -17.340 5.471 -3.513 1.00 35.51 C ATOM 2132 O LEU A 132 -17.729 4.323 -3.747 1.00 10.52 O ATOM 2133 CB LEU A 132 -15.868 6.716 -5.114 1.00 63.20 C ATOM 2134 CG LEU A 132 -15.039 7.544 -4.099 1.00 22.31 C ATOM 2135 CD1 LEU A 132 -14.017 6.643 -3.395 1.00 35.34 C ATOM 2136 CD2 LEU A 132 -14.295 8.673 -4.828 1.00 60.02 C ATOM 0 H LEU A 132 -17.183 8.566 -4.111 1.00 1.15 H new ATOM 0 HA LEU A 132 -17.925 6.191 -5.444 1.00 21.42 H new ATOM 0 HB2 LEU A 132 -15.400 5.744 -5.266 1.00 63.20 H new ATOM 0 HB3 LEU A 132 -15.878 7.220 -6.080 1.00 63.20 H new ATOM 0 HG LEU A 132 -15.718 7.970 -3.360 1.00 22.31 H new ATOM 0 HD11 LEU A 132 -13.440 7.234 -2.684 1.00 35.34 H new ATOM 0 HD12 LEU A 132 -14.539 5.846 -2.865 1.00 35.34 H new ATOM 0 HD13 LEU A 132 -13.345 6.208 -4.135 1.00 35.34 H new ATOM 0 HD21 LEU A 132 -13.715 9.250 -4.108 1.00 60.02 H new ATOM 0 HD22 LEU A 132 -13.625 8.245 -5.574 1.00 60.02 H new ATOM 0 HD23 LEU A 132 -15.016 9.326 -5.320 1.00 60.02 H new ATOM 2148 N ALA A 133 -16.942 5.865 -2.311 1.00 22.32 N ATOM 2149 CA ALA A 133 -16.944 4.939 -1.190 1.00 1.31 C ATOM 2150 C ALA A 133 -18.326 4.324 -1.018 1.00 12.12 C ATOM 2151 O ALA A 133 -18.450 3.139 -0.707 1.00 70.21 O ATOM 2152 CB ALA A 133 -16.542 5.659 0.092 1.00 51.15 C ATOM 0 H ALA A 133 -16.618 6.807 -2.090 1.00 22.32 H new ATOM 0 HA ALA A 133 -16.223 4.148 -1.395 1.00 1.31 H new ATOM 0 HB1 ALA A 133 -16.548 4.953 0.923 1.00 51.15 H new ATOM 0 HB2 ALA A 133 -15.541 6.076 -0.023 1.00 51.15 H new ATOM 0 HB3 ALA A 133 -17.249 6.464 0.294 1.00 51.15 H new ATOM 2158 N GLY A 134 -19.366 5.124 -1.242 1.00 74.41 N ATOM 2159 CA GLY A 134 -20.728 4.623 -1.127 1.00 60.30 C ATOM 2160 C GLY A 134 -20.966 3.557 -2.182 1.00 32.05 C ATOM 2161 O GLY A 134 -21.628 2.551 -1.932 1.00 34.25 O ATOM 0 H GLY A 134 -19.292 6.108 -1.500 1.00 74.41 H new ATOM 0 HA2 GLY A 134 -20.892 4.208 -0.132 1.00 60.30 H new ATOM 0 HA3 GLY A 134 -21.439 5.439 -1.253 1.00 60.30 H new ATOM 2165 N GLU A 135 -20.396 3.783 -3.362 1.00 35.20 N ATOM 2166 CA GLU A 135 -20.526 2.832 -4.452 1.00 1.00 C ATOM 2167 C GLU A 135 -19.871 1.518 -4.055 1.00 44.10 C ATOM 2168 O GLU A 135 -20.121 0.476 -4.663 1.00 3.04 O ATOM 2169 CB GLU A 135 -19.861 3.383 -5.715 1.00 54.22 C ATOM 2170 CG GLU A 135 -20.286 2.549 -6.925 1.00 44.15 C ATOM 2171 CD GLU A 135 -19.604 3.073 -8.185 1.00 12.12 C ATOM 2172 OE1 GLU A 135 -18.622 3.784 -8.051 1.00 52.33 O ATOM 2173 OE2 GLU A 135 -20.074 2.755 -9.265 1.00 21.12 O ATOM 0 H GLU A 135 -19.844 4.612 -3.583 1.00 35.20 H new ATOM 0 HA GLU A 135 -21.583 2.665 -4.658 1.00 1.00 H new ATOM 0 HB2 GLU A 135 -20.144 4.425 -5.862 1.00 54.22 H new ATOM 0 HB3 GLU A 135 -18.777 3.359 -5.607 1.00 54.22 H new ATOM 0 HG2 GLU A 135 -20.022 1.503 -6.767 1.00 44.15 H new ATOM 0 HG3 GLU A 135 -21.369 2.590 -7.044 1.00 44.15 H new ATOM 2180 N ARG A 136 -19.037 1.573 -3.015 1.00 13.41 N ATOM 2181 CA ARG A 136 -18.354 0.381 -2.518 1.00 71.42 C ATOM 2182 C ARG A 136 -19.061 -0.142 -1.267 1.00 10.43 C ATOM 2183 O ARG A 136 -18.565 -1.041 -0.589 1.00 13.02 O ATOM 2184 CB ARG A 136 -16.893 0.718 -2.190 1.00 10.13 C ATOM 2185 CG ARG A 136 -16.045 -0.558 -2.208 1.00 20.53 C ATOM 2186 CD ARG A 136 -14.578 -0.204 -1.954 1.00 21.34 C ATOM 2187 NE ARG A 136 -13.716 -1.312 -2.350 1.00 13.15 N ATOM 2188 CZ ARG A 136 -13.713 -2.456 -1.675 1.00 61.11 C ATOM 2189 NH1 ARG A 136 -14.488 -2.603 -0.636 1.00 43.34 N ATOM 2190 NH2 ARG A 136 -12.935 -3.434 -2.052 1.00 30.20 N ATOM 0 H ARG A 136 -18.820 2.428 -2.503 1.00 13.41 H new ATOM 0 HA ARG A 136 -18.379 -0.391 -3.288 1.00 71.42 H new ATOM 0 HB2 ARG A 136 -16.504 1.433 -2.915 1.00 10.13 H new ATOM 0 HB3 ARG A 136 -16.831 1.192 -1.210 1.00 10.13 H new ATOM 0 HG2 ARG A 136 -16.399 -1.253 -1.446 1.00 20.53 H new ATOM 0 HG3 ARG A 136 -16.147 -1.061 -3.170 1.00 20.53 H new ATOM 0 HD2 ARG A 136 -14.311 0.692 -2.514 1.00 21.34 H new ATOM 0 HD3 ARG A 136 -14.429 0.023 -0.898 1.00 21.34 H new ATOM 0 HE ARG A 136 -13.105 -1.206 -3.160 1.00 13.15 H new ATOM 0 HH11 ARG A 136 -15.097 -1.839 -0.342 1.00 43.34 H new ATOM 0 HH12 ARG A 136 -14.485 -3.482 -0.118 1.00 43.34 H new ATOM 0 HH21 ARG A 136 -12.329 -3.320 -2.865 1.00 30.20 H new ATOM 0 HH22 ARG A 136 -12.933 -4.313 -1.534 1.00 30.20 H new ATOM 2204 N ASN A 137 -20.235 0.421 -0.984 1.00 22.44 N ATOM 2205 CA ASN A 137 -21.025 0.000 0.170 1.00 43.04 C ATOM 2206 C ASN A 137 -20.213 0.059 1.458 1.00 65.41 C ATOM 2207 O ASN A 137 -20.348 -0.800 2.329 1.00 70.42 O ATOM 2208 CB ASN A 137 -21.473 -1.428 -0.041 1.00 74.52 C ATOM 2209 CG ASN A 137 -22.205 -1.562 -1.372 1.00 13.34 C ATOM 2210 OD1 ASN A 137 -21.984 -2.522 -2.110 1.00 22.05 O ATOM 2211 ND2 ASN A 137 -23.071 -0.651 -1.724 1.00 54.24 N ATOM 0 H ASN A 137 -20.658 1.167 -1.536 1.00 22.44 H new ATOM 0 HA ASN A 137 -21.875 0.676 0.262 1.00 43.04 H new ATOM 0 HB2 ASN A 137 -20.610 -2.093 -0.024 1.00 74.52 H new ATOM 0 HB3 ASN A 137 -22.128 -1.735 0.774 1.00 74.52 H new ATOM 0 HD21 ASN A 137 -23.566 -0.734 -2.612 1.00 54.24 H new ATOM 0 HD22 ASN A 137 -23.253 0.144 -1.111 1.00 54.24 H new ATOM 2218 N TYR A 138 -19.381 1.075 1.575 1.00 42.33 N ATOM 2219 CA TYR A 138 -18.555 1.243 2.769 1.00 30.14 C ATOM 2220 C TYR A 138 -19.342 1.956 3.875 1.00 24.33 C ATOM 2221 O TYR A 138 -20.409 2.516 3.624 1.00 2.51 O ATOM 2222 CB TYR A 138 -17.300 2.056 2.415 1.00 0.24 C ATOM 2223 CG TYR A 138 -17.578 3.533 2.594 1.00 13.53 C ATOM 2224 CD1 TYR A 138 -18.760 4.089 2.085 1.00 30.15 C ATOM 2225 CD2 TYR A 138 -16.667 4.338 3.281 1.00 52.31 C ATOM 2226 CE1 TYR A 138 -19.027 5.451 2.265 1.00 15.32 C ATOM 2227 CE2 TYR A 138 -16.933 5.698 3.457 1.00 51.14 C ATOM 2228 CZ TYR A 138 -18.112 6.256 2.951 1.00 1.13 C ATOM 2229 OH TYR A 138 -18.371 7.598 3.133 1.00 0.33 O ATOM 0 H TYR A 138 -19.254 1.797 0.866 1.00 42.33 H new ATOM 0 HA TYR A 138 -18.262 0.259 3.134 1.00 30.14 H new ATOM 0 HB2 TYR A 138 -16.468 1.754 3.051 1.00 0.24 H new ATOM 0 HB3 TYR A 138 -17.004 1.855 1.386 1.00 0.24 H new ATOM 0 HD1 TYR A 138 -19.465 3.466 1.554 1.00 30.15 H new ATOM 0 HD2 TYR A 138 -15.758 3.910 3.676 1.00 52.31 H new ATOM 0 HE1 TYR A 138 -19.938 5.880 1.875 1.00 15.32 H new ATOM 0 HE2 TYR A 138 -16.226 6.321 3.985 1.00 51.14 H new ATOM 0 HH TYR A 138 -17.633 8.009 3.630 1.00 0.33 H new ATOM 2239 N THR A 139 -18.792 1.950 5.091 1.00 50.00 N ATOM 2240 CA THR A 139 -19.435 2.622 6.229 1.00 34.14 C ATOM 2241 C THR A 139 -18.490 3.678 6.811 1.00 42.01 C ATOM 2242 O THR A 139 -17.275 3.592 6.648 1.00 15.42 O ATOM 2243 CB THR A 139 -19.808 1.600 7.322 1.00 60.30 C ATOM 2244 OG1 THR A 139 -18.847 1.650 8.368 1.00 62.35 O ATOM 2245 CG2 THR A 139 -19.845 0.181 6.737 1.00 3.22 C ATOM 0 H THR A 139 -17.909 1.491 5.315 1.00 50.00 H new ATOM 0 HA THR A 139 -20.346 3.105 5.876 1.00 34.14 H new ATOM 0 HB THR A 139 -20.795 1.850 7.712 1.00 60.30 H new ATOM 0 HG1 THR A 139 -19.086 1.001 9.063 1.00 62.35 H new ATOM 0 HG21 THR A 139 -20.110 -0.529 7.521 1.00 3.22 H new ATOM 0 HG22 THR A 139 -20.587 0.135 5.940 1.00 3.22 H new ATOM 0 HG23 THR A 139 -18.864 -0.072 6.334 1.00 3.22 H new ATOM 2253 N ASP A 140 -19.045 4.698 7.452 1.00 40.41 N ATOM 2254 CA ASP A 140 -18.216 5.769 7.999 1.00 14.13 C ATOM 2255 C ASP A 140 -16.995 5.219 8.736 1.00 14.22 C ATOM 2256 O ASP A 140 -15.870 5.645 8.476 1.00 11.03 O ATOM 2257 CB ASP A 140 -19.043 6.632 8.954 1.00 54.23 C ATOM 2258 CG ASP A 140 -19.600 5.773 10.084 1.00 51.04 C ATOM 2259 OD1 ASP A 140 -19.694 4.572 9.896 1.00 15.14 O ATOM 2260 OD2 ASP A 140 -19.925 6.330 11.120 1.00 5.21 O ATOM 0 H ASP A 140 -20.047 4.808 7.605 1.00 40.41 H new ATOM 0 HA ASP A 140 -17.863 6.373 7.163 1.00 14.13 H new ATOM 0 HB2 ASP A 140 -18.424 7.430 9.364 1.00 54.23 H new ATOM 0 HB3 ASP A 140 -19.860 7.108 8.412 1.00 54.23 H new ATOM 2265 N GLU A 141 -17.201 4.295 9.667 1.00 33.12 N ATOM 2266 CA GLU A 141 -16.083 3.743 10.425 1.00 72.05 C ATOM 2267 C GLU A 141 -15.007 3.188 9.494 1.00 22.20 C ATOM 2268 O GLU A 141 -13.862 2.996 9.904 1.00 54.41 O ATOM 2269 CB GLU A 141 -16.582 2.630 11.350 1.00 44.22 C ATOM 2270 CG GLU A 141 -15.489 2.271 12.357 1.00 43.34 C ATOM 2271 CD GLU A 141 -16.001 1.209 13.325 1.00 64.11 C ATOM 2272 OE1 GLU A 141 -16.936 1.502 14.053 1.00 33.43 O ATOM 2273 OE2 GLU A 141 -15.451 0.121 13.324 1.00 23.12 O ATOM 0 H GLU A 141 -18.116 3.917 9.913 1.00 33.12 H new ATOM 0 HA GLU A 141 -15.646 4.547 11.017 1.00 72.05 H new ATOM 0 HB2 GLU A 141 -17.481 2.955 11.874 1.00 44.22 H new ATOM 0 HB3 GLU A 141 -16.854 1.752 10.765 1.00 44.22 H new ATOM 0 HG2 GLU A 141 -14.607 1.903 11.833 1.00 43.34 H new ATOM 0 HG3 GLU A 141 -15.184 3.161 12.908 1.00 43.34 H new ATOM 2280 N MET A 142 -15.378 2.922 8.247 1.00 62.22 N ATOM 2281 CA MET A 142 -14.428 2.377 7.283 1.00 23.02 C ATOM 2282 C MET A 142 -13.499 3.460 6.755 1.00 24.22 C ATOM 2283 O MET A 142 -12.451 3.162 6.188 1.00 74.13 O ATOM 2284 CB MET A 142 -15.177 1.735 6.121 1.00 34.54 C ATOM 2285 CG MET A 142 -16.269 0.808 6.673 1.00 74.15 C ATOM 2286 SD MET A 142 -16.494 -0.590 5.549 1.00 71.42 S ATOM 2287 CE MET A 142 -14.864 -1.330 5.798 1.00 54.20 C ATOM 0 H MET A 142 -16.319 3.072 7.882 1.00 62.22 H new ATOM 0 HA MET A 142 -13.825 1.624 7.791 1.00 23.02 H new ATOM 0 HB2 MET A 142 -15.622 2.505 5.490 1.00 34.54 H new ATOM 0 HB3 MET A 142 -14.486 1.170 5.495 1.00 34.54 H new ATOM 0 HG2 MET A 142 -15.991 0.451 7.665 1.00 74.15 H new ATOM 0 HG3 MET A 142 -17.205 1.355 6.782 1.00 74.15 H new ATOM 0 HE1 MET A 142 -14.279 -1.238 4.883 1.00 54.20 H new ATOM 0 HE2 MET A 142 -14.351 -0.815 6.610 1.00 54.20 H new ATOM 0 HE3 MET A 142 -14.978 -2.384 6.052 1.00 54.20 H new ATOM 2297 N VAL A 143 -13.875 4.715 6.975 1.00 34.03 N ATOM 2298 CA VAL A 143 -13.043 5.850 6.548 1.00 3.01 C ATOM 2299 C VAL A 143 -12.694 6.722 7.745 1.00 24.33 C ATOM 2300 O VAL A 143 -13.572 7.185 8.472 1.00 31.23 O ATOM 2301 CB VAL A 143 -13.746 6.692 5.466 1.00 62.14 C ATOM 2302 CG1 VAL A 143 -14.994 7.382 6.035 1.00 51.21 C ATOM 2303 CG2 VAL A 143 -12.774 7.761 4.932 1.00 74.23 C ATOM 0 H VAL A 143 -14.743 4.978 7.442 1.00 34.03 H new ATOM 0 HA VAL A 143 -12.127 5.448 6.115 1.00 3.01 H new ATOM 0 HB VAL A 143 -14.051 6.028 4.658 1.00 62.14 H new ATOM 0 HG11 VAL A 143 -15.473 7.970 5.252 1.00 51.21 H new ATOM 0 HG12 VAL A 143 -15.691 6.628 6.401 1.00 51.21 H new ATOM 0 HG13 VAL A 143 -14.705 8.038 6.856 1.00 51.21 H new ATOM 0 HG21 VAL A 143 -13.272 8.356 4.167 1.00 74.23 H new ATOM 0 HG22 VAL A 143 -12.462 8.410 5.750 1.00 74.23 H new ATOM 0 HG23 VAL A 143 -11.899 7.274 4.501 1.00 74.23 H new ATOM 2313 N ALA A 144 -11.398 6.921 7.964 1.00 50.10 N ATOM 2314 CA ALA A 144 -10.939 7.723 9.092 1.00 61.10 C ATOM 2315 C ALA A 144 -10.380 9.063 8.626 1.00 63.34 C ATOM 2316 O ALA A 144 -9.315 9.121 7.999 1.00 73.51 O ATOM 2317 CB ALA A 144 -9.857 6.960 9.860 1.00 1.35 C ATOM 0 H ALA A 144 -10.653 6.541 7.380 1.00 50.10 H new ATOM 0 HA ALA A 144 -11.793 7.914 9.742 1.00 61.10 H new ATOM 0 HB1 ALA A 144 -9.516 7.562 10.702 1.00 1.35 H new ATOM 0 HB2 ALA A 144 -10.267 6.020 10.228 1.00 1.35 H new ATOM 0 HB3 ALA A 144 -9.017 6.755 9.197 1.00 1.35 H new ATOM 2323 N MET A 145 -11.105 10.140 8.945 1.00 5.25 N ATOM 2324 CA MET A 145 -10.696 11.472 8.589 1.00 54.31 C ATOM 2325 C MET A 145 -9.688 11.935 9.640 1.00 61.24 C ATOM 2326 O MET A 145 -9.828 11.598 10.817 1.00 14.51 O ATOM 2327 CB MET A 145 -11.970 12.349 8.540 1.00 10.52 C ATOM 2328 CG MET A 145 -11.713 13.794 9.000 1.00 52.54 C ATOM 2329 SD MET A 145 -12.074 14.947 7.646 1.00 52.11 S ATOM 2330 CE MET A 145 -10.929 14.245 6.429 1.00 14.23 C ATOM 0 H MET A 145 -11.987 10.097 9.456 1.00 5.25 H new ATOM 0 HA MET A 145 -10.213 11.533 7.614 1.00 54.31 H new ATOM 0 HB2 MET A 145 -12.360 12.360 7.522 1.00 10.52 H new ATOM 0 HB3 MET A 145 -12.738 11.902 9.171 1.00 10.52 H new ATOM 0 HG2 MET A 145 -12.337 14.026 9.863 1.00 52.54 H new ATOM 0 HG3 MET A 145 -10.676 13.905 9.317 1.00 52.54 H new ATOM 0 HE1 MET A 145 -10.525 15.043 5.806 1.00 14.23 H new ATOM 0 HE2 MET A 145 -10.113 13.740 6.946 1.00 14.23 H new ATOM 0 HE3 MET A 145 -11.459 13.528 5.802 1.00 14.23 H new ATOM 2340 N LEU A 146 -8.665 12.693 9.225 1.00 73.10 N ATOM 2341 CA LEU A 146 -7.661 13.160 10.139 1.00 72.43 C ATOM 2342 C LEU A 146 -7.520 14.696 10.059 1.00 21.12 C ATOM 2343 O LEU A 146 -7.567 15.271 8.972 1.00 51.00 O ATOM 2344 CB LEU A 146 -6.366 12.421 9.774 1.00 14.35 C ATOM 2345 CG LEU A 146 -5.619 11.984 11.024 1.00 51.13 C ATOM 2346 CD1 LEU A 146 -6.544 11.255 12.037 1.00 53.34 C ATOM 2347 CD2 LEU A 146 -4.519 11.008 10.643 1.00 65.41 C ATOM 0 H LEU A 146 -8.527 12.986 8.258 1.00 73.10 H new ATOM 0 HA LEU A 146 -7.925 12.950 11.176 1.00 72.43 H new ATOM 0 HB2 LEU A 146 -6.600 11.550 9.162 1.00 14.35 H new ATOM 0 HB3 LEU A 146 -5.729 13.070 9.173 1.00 14.35 H new ATOM 0 HG LEU A 146 -5.221 12.888 11.486 1.00 51.13 H new ATOM 0 HD11 LEU A 146 -5.965 10.962 12.913 1.00 53.34 H new ATOM 0 HD12 LEU A 146 -7.349 11.924 12.341 1.00 53.34 H new ATOM 0 HD13 LEU A 146 -6.968 10.367 11.569 1.00 53.34 H new ATOM 0 HD21 LEU A 146 -3.984 10.695 11.539 1.00 65.41 H new ATOM 0 HD22 LEU A 146 -4.958 10.135 10.159 1.00 65.41 H new ATOM 0 HD23 LEU A 146 -3.825 11.492 9.956 1.00 65.41 H new ATOM 2359 N PRO A 147 -7.376 15.364 11.190 1.00 43.31 N ATOM 2360 CA PRO A 147 -7.259 16.863 11.260 1.00 22.33 C ATOM 2361 C PRO A 147 -5.898 17.404 10.815 1.00 64.42 C ATOM 2362 O PRO A 147 -4.943 16.656 10.633 1.00 52.10 O ATOM 2363 CB PRO A 147 -7.473 17.144 12.750 1.00 61.44 C ATOM 2364 CG PRO A 147 -6.906 15.942 13.418 1.00 55.51 C ATOM 2365 CD PRO A 147 -7.309 14.775 12.540 1.00 41.15 C ATOM 0 HA PRO A 147 -7.968 17.348 10.589 1.00 22.33 H new ATOM 0 HB2 PRO A 147 -6.963 18.055 13.063 1.00 61.44 H new ATOM 0 HB3 PRO A 147 -8.529 17.273 12.986 1.00 61.44 H new ATOM 0 HG2 PRO A 147 -5.822 16.014 13.505 1.00 55.51 H new ATOM 0 HG3 PRO A 147 -7.300 15.830 14.428 1.00 55.51 H new ATOM 0 HD2 PRO A 147 -6.580 13.966 12.589 1.00 41.15 H new ATOM 0 HD3 PRO A 147 -8.269 14.358 12.844 1.00 41.15 H new ATOM 2373 N ARG A 148 -5.844 18.724 10.650 1.00 24.45 N ATOM 2374 CA ARG A 148 -4.632 19.426 10.225 1.00 40.13 C ATOM 2375 C ARG A 148 -3.449 19.155 11.157 1.00 1.43 C ATOM 2376 O ARG A 148 -2.334 19.612 10.904 1.00 11.51 O ATOM 2377 CB ARG A 148 -4.903 20.936 10.190 1.00 12.42 C ATOM 2378 CG ARG A 148 -5.752 21.290 8.962 1.00 5.50 C ATOM 2379 CD ARG A 148 -7.139 20.648 9.075 1.00 73.34 C ATOM 2380 NE ARG A 148 -7.651 20.767 10.435 1.00 41.10 N ATOM 2381 CZ ARG A 148 -7.988 21.948 10.943 1.00 22.24 C ATOM 2382 NH1 ARG A 148 -7.866 23.028 10.221 1.00 43.03 N ATOM 2383 NH2 ARG A 148 -8.441 22.028 12.164 1.00 2.03 N ATOM 0 H ARG A 148 -6.642 19.340 10.807 1.00 24.45 H new ATOM 0 HA ARG A 148 -4.370 19.056 9.234 1.00 40.13 H new ATOM 0 HB2 ARG A 148 -5.420 21.242 11.100 1.00 12.42 H new ATOM 0 HB3 ARG A 148 -3.960 21.482 10.160 1.00 12.42 H new ATOM 0 HG2 ARG A 148 -5.850 22.372 8.878 1.00 5.50 H new ATOM 0 HG3 ARG A 148 -5.256 20.944 8.055 1.00 5.50 H new ATOM 0 HD2 ARG A 148 -7.826 21.129 8.379 1.00 73.34 H new ATOM 0 HD3 ARG A 148 -7.083 19.597 8.793 1.00 73.34 H new ATOM 0 HE ARG A 148 -7.752 19.929 11.007 1.00 41.10 H new ATOM 0 HH11 ARG A 148 -7.512 22.966 9.266 1.00 43.03 H new ATOM 0 HH12 ARG A 148 -8.125 23.934 10.611 1.00 43.03 H new ATOM 0 HH21 ARG A 148 -8.537 21.184 12.729 1.00 2.03 H new ATOM 0 HH22 ARG A 148 -8.700 22.934 12.554 1.00 2.03 H new ATOM 2397 N GLN A 149 -3.704 18.453 12.249 1.00 52.04 N ATOM 2398 CA GLN A 149 -2.658 18.175 13.235 1.00 51.24 C ATOM 2399 C GLN A 149 -1.496 17.381 12.630 1.00 22.35 C ATOM 2400 O GLN A 149 -1.699 16.385 11.936 1.00 42.24 O ATOM 2401 CB GLN A 149 -3.261 17.408 14.429 1.00 64.14 C ATOM 2402 CG GLN A 149 -2.730 17.972 15.755 1.00 54.21 C ATOM 2403 CD GLN A 149 -1.209 18.097 15.709 1.00 0.01 C ATOM 2404 OE1 GLN A 149 -0.526 17.206 15.210 1.00 53.34 O ATOM 2405 NE2 GLN A 149 -0.638 19.160 16.207 1.00 65.01 N ATOM 0 H GLN A 149 -4.619 18.065 12.480 1.00 52.04 H new ATOM 0 HA GLN A 149 -2.257 19.130 13.575 1.00 51.24 H new ATOM 0 HB2 GLN A 149 -4.348 17.483 14.405 1.00 64.14 H new ATOM 0 HB3 GLN A 149 -3.012 16.350 14.352 1.00 64.14 H new ATOM 0 HG2 GLN A 149 -3.176 18.948 15.947 1.00 54.21 H new ATOM 0 HG3 GLN A 149 -3.023 17.320 16.578 1.00 54.21 H new ATOM 0 HE21 GLN A 149 -1.207 19.898 16.621 1.00 65.01 H new ATOM 0 HE22 GLN A 149 0.378 19.252 16.182 1.00 65.01 H new ATOM 2414 N GLU A 150 -0.273 17.846 12.902 1.00 14.32 N ATOM 2415 CA GLU A 150 0.938 17.197 12.395 1.00 22.54 C ATOM 2416 C GLU A 150 1.980 17.052 13.506 1.00 35.50 C ATOM 2417 O GLU A 150 2.130 17.937 14.349 1.00 24.24 O ATOM 2418 CB GLU A 150 1.529 18.028 11.255 1.00 54.11 C ATOM 2419 CG GLU A 150 1.916 19.412 11.778 1.00 42.13 C ATOM 2420 CD GLU A 150 2.311 20.318 10.616 1.00 70.14 C ATOM 2421 OE1 GLU A 150 2.451 19.809 9.516 1.00 41.35 O ATOM 2422 OE2 GLU A 150 2.468 21.506 10.843 1.00 23.40 O ATOM 0 H GLU A 150 -0.096 18.673 13.473 1.00 14.32 H new ATOM 0 HA GLU A 150 0.670 16.205 12.031 1.00 22.54 H new ATOM 0 HB2 GLU A 150 2.404 17.526 10.841 1.00 54.11 H new ATOM 0 HB3 GLU A 150 0.804 18.123 10.447 1.00 54.11 H new ATOM 0 HG2 GLU A 150 1.080 19.850 12.324 1.00 42.13 H new ATOM 0 HG3 GLU A 150 2.745 19.326 12.480 1.00 42.13 H new ATOM 2429 N GLU A 151 2.718 15.940 13.482 1.00 13.22 N ATOM 2430 CA GLU A 151 3.771 15.689 14.468 1.00 5.20 C ATOM 2431 C GLU A 151 5.057 15.316 13.741 1.00 62.25 C ATOM 2432 O GLU A 151 6.157 15.658 14.174 1.00 35.11 O ATOM 2433 CB GLU A 151 3.368 14.555 15.412 1.00 73.21 C ATOM 2434 CG GLU A 151 4.297 14.551 16.629 1.00 32.44 C ATOM 2435 CD GLU A 151 4.111 13.262 17.422 1.00 42.03 C ATOM 2436 OE1 GLU A 151 3.994 12.219 16.802 1.00 62.45 O ATOM 2437 OE2 GLU A 151 4.087 13.338 18.640 1.00 21.23 O ATOM 0 H GLU A 151 2.606 15.199 12.790 1.00 13.22 H new ATOM 0 HA GLU A 151 3.925 16.592 15.059 1.00 5.20 H new ATOM 0 HB2 GLU A 151 2.334 14.683 15.731 1.00 73.21 H new ATOM 0 HB3 GLU A 151 3.426 13.598 14.894 1.00 73.21 H new ATOM 0 HG2 GLU A 151 5.334 14.643 16.306 1.00 32.44 H new ATOM 0 HG3 GLU A 151 4.084 15.412 17.263 1.00 32.44 H new ATOM 2444 N CYS A 152 4.895 14.633 12.610 1.00 3.20 N ATOM 2445 CA CYS A 152 6.024 14.227 11.779 1.00 62.35 C ATOM 2446 C CYS A 152 5.834 14.794 10.381 1.00 44.42 C ATOM 2447 O CYS A 152 4.710 14.870 9.887 1.00 52.44 O ATOM 2448 CB CYS A 152 6.112 12.702 11.697 1.00 21.15 C ATOM 2449 SG CYS A 152 6.460 12.017 13.336 1.00 44.34 S ATOM 0 H CYS A 152 3.986 14.348 12.247 1.00 3.20 H new ATOM 0 HA CYS A 152 6.945 14.606 12.221 1.00 62.35 H new ATOM 0 HB2 CYS A 152 5.176 12.295 11.314 1.00 21.15 H new ATOM 0 HB3 CYS A 152 6.896 12.411 10.998 1.00 21.15 H new ATOM 2454 N THR A 153 6.925 15.202 9.748 1.00 64.12 N ATOM 2455 CA THR A 153 6.842 15.774 8.407 1.00 72.34 C ATOM 2456 C THR A 153 8.063 15.391 7.575 1.00 62.12 C ATOM 2457 O THR A 153 9.128 15.095 8.116 1.00 12.01 O ATOM 2458 CB THR A 153 6.735 17.299 8.508 1.00 53.15 C ATOM 2459 OG1 THR A 153 8.025 17.848 8.741 1.00 44.01 O ATOM 2460 CG2 THR A 153 5.800 17.673 9.664 1.00 12.22 C ATOM 0 H THR A 153 7.868 15.150 10.133 1.00 64.12 H new ATOM 0 HA THR A 153 5.956 15.377 7.912 1.00 72.34 H new ATOM 0 HB THR A 153 6.333 17.698 7.577 1.00 53.15 H new ATOM 0 HG1 THR A 153 7.959 18.824 8.804 1.00 44.01 H new ATOM 0 HG21 THR A 153 5.725 18.758 9.735 1.00 12.22 H new ATOM 0 HG22 THR A 153 4.811 17.252 9.483 1.00 12.22 H new ATOM 0 HG23 THR A 153 6.198 17.275 10.597 1.00 12.22 H new ATOM 2468 N VAL A 154 7.897 15.403 6.255 1.00 51.52 N ATOM 2469 CA VAL A 154 8.968 15.063 5.351 1.00 60.43 C ATOM 2470 C VAL A 154 9.971 16.200 5.276 1.00 12.12 C ATOM 2471 O VAL A 154 9.665 17.342 5.619 1.00 35.22 O ATOM 2472 CB VAL A 154 8.403 14.799 3.951 1.00 1.14 C ATOM 2473 CG1 VAL A 154 7.180 13.874 4.027 1.00 44.43 C ATOM 2474 CG2 VAL A 154 8.005 16.132 3.297 1.00 71.22 C ATOM 0 H VAL A 154 7.020 15.648 5.795 1.00 51.52 H new ATOM 0 HA VAL A 154 9.465 14.167 5.722 1.00 60.43 H new ATOM 0 HB VAL A 154 9.170 14.311 3.350 1.00 1.14 H new ATOM 0 HG11 VAL A 154 6.793 13.699 3.023 1.00 44.43 H new ATOM 0 HG12 VAL A 154 7.470 12.924 4.475 1.00 44.43 H new ATOM 0 HG13 VAL A 154 6.407 14.342 4.637 1.00 44.43 H new ATOM 0 HG21 VAL A 154 7.603 15.943 2.301 1.00 71.22 H new ATOM 0 HG22 VAL A 154 7.247 16.624 3.907 1.00 71.22 H new ATOM 0 HG23 VAL A 154 8.882 16.775 3.219 1.00 71.22 H new ATOM 2484 N ASP A 155 11.159 15.880 4.805 1.00 24.30 N ATOM 2485 CA ASP A 155 12.204 16.881 4.659 1.00 21.03 C ATOM 2486 C ASP A 155 12.011 17.659 3.374 1.00 14.50 C ATOM 2487 O ASP A 155 11.248 17.270 2.489 1.00 4.23 O ATOM 2488 CB ASP A 155 13.591 16.245 4.655 1.00 61.34 C ATOM 2489 CG ASP A 155 14.656 17.291 4.335 1.00 71.00 C ATOM 2490 OD1 ASP A 155 14.605 18.358 4.923 1.00 62.01 O ATOM 2491 OD2 ASP A 155 15.504 17.008 3.505 1.00 31.41 O ATOM 0 H ASP A 155 11.428 14.939 4.517 1.00 24.30 H new ATOM 0 HA ASP A 155 12.132 17.554 5.513 1.00 21.03 H new ATOM 0 HB2 ASP A 155 13.794 15.795 5.627 1.00 61.34 H new ATOM 0 HB3 ASP A 155 13.628 15.442 3.918 1.00 61.34 H new ATOM 2496 N GLU A 156 12.720 18.759 3.298 1.00 2.41 N ATOM 2497 CA GLU A 156 12.665 19.634 2.141 1.00 53.24 C ATOM 2498 C GLU A 156 13.074 18.882 0.878 1.00 51.24 C ATOM 2499 O GLU A 156 12.563 19.153 -0.209 1.00 33.03 O ATOM 2500 CB GLU A 156 13.602 20.817 2.367 1.00 2.32 C ATOM 2501 CG GLU A 156 12.985 21.770 3.392 1.00 20.22 C ATOM 2502 CD GLU A 156 13.874 22.998 3.564 1.00 12.41 C ATOM 2503 OE1 GLU A 156 14.932 23.028 2.959 1.00 14.01 O ATOM 2504 OE2 GLU A 156 13.482 23.889 4.299 1.00 74.02 O ATOM 0 H GLU A 156 13.352 19.077 4.033 1.00 2.41 H new ATOM 0 HA GLU A 156 11.643 19.990 2.011 1.00 53.24 H new ATOM 0 HB2 GLU A 156 14.571 20.464 2.720 1.00 2.32 H new ATOM 0 HB3 GLU A 156 13.777 21.341 1.427 1.00 2.32 H new ATOM 0 HG2 GLU A 156 11.990 22.074 3.066 1.00 20.22 H new ATOM 0 HG3 GLU A 156 12.865 21.261 4.348 1.00 20.22 H new ATOM 2511 N VAL A 157 13.997 17.938 1.028 1.00 61.44 N ATOM 2512 CA VAL A 157 14.466 17.155 -0.110 1.00 35.44 C ATOM 2513 C VAL A 157 15.111 15.856 0.363 1.00 20.22 C ATOM 2514 O VAL A 157 14.967 14.860 -0.328 1.00 63.22 O ATOM 2515 CB VAL A 157 15.480 17.966 -0.919 1.00 74.44 C ATOM 2516 CG1 VAL A 157 16.670 18.328 -0.029 1.00 13.45 C ATOM 2517 CG2 VAL A 157 15.966 17.131 -2.105 1.00 24.25 C ATOM 2518 OXT VAL A 157 15.739 15.875 1.409 1.00 63.22 O ATOM 0 H VAL A 157 14.432 17.698 1.919 1.00 61.44 H new ATOM 0 HA VAL A 157 13.609 16.914 -0.739 1.00 35.44 H new ATOM 0 HB VAL A 157 15.009 18.879 -1.284 1.00 74.44 H new ATOM 0 HG11 VAL A 157 17.393 18.906 -0.605 1.00 13.45 H new ATOM 0 HG12 VAL A 157 16.324 18.921 0.818 1.00 13.45 H new ATOM 0 HG13 VAL A 157 17.143 17.416 0.335 1.00 13.45 H new ATOM 0 HG21 VAL A 157 16.689 17.707 -2.683 1.00 24.25 H new ATOM 0 HG22 VAL A 157 16.438 16.219 -1.739 1.00 24.25 H new ATOM 0 HG23 VAL A 157 15.118 16.872 -2.739 1.00 24.25 H new TER 2528 VAL A 157 HETATM 2529 O6 EB4 A 200 1.797 3.456 3.480 1.00 20.00 O HETATM 2530 O4 EB4 A 200 0.731 1.745 2.479 1.00 20.00 O HETATM 2531 O5 EB4 A 200 3.058 1.725 2.907 1.00 20.00 O HETATM 2532 N1 EB4 A 200 -0.584 -1.644 5.713 1.00 20.00 N HETATM 2533 C5 EB4 A 200 4.067 0.862 3.203 1.00 20.00 C HETATM 2534 C4 EB4 A 200 -0.202 0.764 2.356 1.00 20.00 C HETATM 2535 C1 EB4 A 200 -0.330 -0.045 3.480 1.00 20.00 C HETATM 2536 C2 EB4 A 200 4.056 0.366 4.502 1.00 20.00 C HETATM 2537 C6 EB4 A 200 1.205 4.256 4.407 1.00 20.00 C HETATM 2538 C8 EB4 A 200 5.064 0.466 2.319 1.00 20.00 C HETATM 2539 N2 EB4 A 200 3.925 -0.754 6.926 1.00 20.00 N HETATM 2540 C9 EB4 A 200 0.837 5.579 4.195 1.00 20.00 C HETATM 2541 C10 EB4 A 200 -1.914 -0.517 1.243 1.00 20.00 C HETATM 2542 O3 EB4 A 200 1.329 2.345 5.714 1.00 20.00 O HETATM 2543 N3 EB4 A 200 0.381 2.440 8.061 1.00 20.00 N HETATM 2544 C16 EB4 A 200 -1.250 -1.087 3.485 1.00 20.00 C HETATM 2545 C7 EB4 A 200 -0.995 0.526 1.239 1.00 20.00 C HETATM 2546 C3 EB4 A 200 0.976 3.656 5.639 1.00 20.00 C HETATM 2547 C11 EB4 A 200 6.048 -0.424 2.734 1.00 20.00 C HETATM 2548 O1 EB4 A 200 0.497 0.285 4.508 1.00 20.00 O HETATM 2549 O2 EB4 A 200 3.040 0.815 5.287 1.00 20.00 O HETATM 2550 C12 EB4 A 200 0.269 6.313 5.230 1.00 20.00 C HETATM 2551 C15 EB4 A 200 0.071 5.723 6.474 1.00 20.00 C HETATM 2552 C14 EB4 A 200 6.035 -0.919 4.034 1.00 20.00 C HETATM 2553 C13 EB4 A 200 -2.042 -1.324 2.366 1.00 20.00 C HETATM 2554 O7 EB4 A 200 -2.198 -2.881 4.708 1.00 20.00 O HETATM 2555 C19 EB4 A 200 -1.390 -1.954 4.688 1.00 20.00 C HETATM 2556 C22 EB4 A 200 -0.602 -2.406 6.970 1.00 20.00 C HETATM 2557 C25 EB4 A 200 -0.962 -1.502 8.139 1.00 20.00 C HETATM 2558 O10 EB4 A 200 -1.595 -1.942 9.096 1.00 20.00 O HETATM 2559 O15 EB4 A 200 -0.542 -0.212 8.045 1.00 20.00 O HETATM 2560 C30 EB4 A 200 -0.897 0.656 9.134 1.00 20.00 C HETATM 2561 C24 EB4 A 200 0.205 1.685 9.310 1.00 20.00 C HETATM 2562 C21 EB4 A 200 0.210 3.768 8.015 1.00 20.00 C HETATM 2563 C18 EB4 A 200 0.425 4.395 6.680 1.00 20.00 C HETATM 2564 O9 EB4 A 200 -0.101 4.452 8.988 1.00 20.00 O HETATM 2565 C27 EB4 A 200 1.468 0.902 9.777 1.00 20.00 C HETATM 2566 O12 EB4 A 200 1.566 0.480 10.929 1.00 20.00 O HETATM 2567 C28 EB4 A 200 0.712 -3.151 7.159 1.00 20.00 C HETATM 2568 O13 EB4 A 200 1.863 -2.291 7.186 1.00 20.00 O HETATM 2569 C26 EB4 A 200 2.490 -2.096 8.378 1.00 20.00 C HETATM 2570 O11 EB4 A 200 2.114 -2.585 9.442 1.00 20.00 O HETATM 2571 C23 EB4 A 200 3.732 -1.202 8.313 1.00 20.00 C HETATM 2572 C29 EB4 A 200 3.573 -0.007 9.237 1.00 20.00 C HETATM 2573 O14 EB4 A 200 2.421 0.737 8.822 1.00 20.00 O HETATM 2574 C20 EB4 A 200 5.029 -1.023 6.217 1.00 20.00 C HETATM 2575 O8 EB4 A 200 5.985 -1.662 6.652 1.00 20.00 O HETATM 2576 C17 EB4 A 200 5.039 -0.525 4.919 1.00 20.00 C HETATM 0 H30A EB4 A 200 -1.847 1.150 8.930 1.00 20.00 H new HETATM 0 H29A EB4 A 200 3.458 -0.339 10.269 1.00 20.00 H new HETATM 0 H28A EB4 A 200 0.669 -3.716 8.090 1.00 20.00 H new HETATM 0 HN3 EB4 A 200 0.639 1.941 7.210 1.00 20.00 H new HETATM 0 HN2 EB4 A 200 3.183 -0.213 6.483 1.00 20.00 H new HETATM 0 HN1 EB4 A 200 0.059 -0.858 5.618 1.00 20.00 H new HETATM 0 H9 EB4 A 200 0.993 6.040 3.220 1.00 20.00 H new HETATM 0 H8 EB4 A 200 5.074 0.853 1.300 1.00 20.00 H new HETATM 0 H7 EB4 A 200 -0.896 1.159 0.357 1.00 20.00 H new HETATM 0 H30 EB4 A 200 -1.027 0.080 10.050 1.00 20.00 H new HETATM 0 H29 EB4 A 200 4.463 0.621 9.201 1.00 20.00 H new HETATM 0 H28 EB4 A 200 0.829 -3.875 6.352 1.00 20.00 H new HETATM 0 H24 EB4 A 200 -0.026 2.439 10.063 1.00 20.00 H new HETATM 0 H23 EB4 A 200 4.605 -1.767 8.639 1.00 20.00 H new HETATM 0 H22 EB4 A 200 -1.381 -3.167 6.924 1.00 20.00 H new HETATM 0 H15 EB4 A 200 -0.363 6.303 7.289 1.00 20.00 H new HETATM 0 H14 EB4 A 200 6.807 -1.617 4.359 1.00 20.00 H new HETATM 0 H13 EB4 A 200 -2.762 -2.142 2.371 1.00 20.00 H new HETATM 0 H12 EB4 A 200 -0.021 7.351 5.067 1.00 20.00 H new HETATM 0 H11 EB4 A 200 6.830 -0.734 2.041 1.00 20.00 H new HETATM 0 H10 EB4 A 200 -2.534 -0.701 0.365 1.00 20.00 H new HETATM 2598 GA GA A 201 1.754 1.610 4.077 1.00 20.00 GA HETATM 2599 C1 ACD A 300 -1.498 9.368 -10.698 1.00 20.00 C HETATM 2600 C2 ACD A 300 0.012 9.364 -10.945 1.00 20.00 C HETATM 2601 C3 ACD A 300 0.702 8.432 -9.946 1.00 20.00 C HETATM 2602 C4 ACD A 300 0.409 8.899 -8.520 1.00 20.00 C HETATM 2603 C5 ACD A 300 1.169 8.022 -7.523 1.00 20.00 C HETATM 2604 C6 ACD A 300 0.575 7.730 -6.143 1.00 20.00 C HETATM 2605 C7 ACD A 300 -0.785 8.315 -5.757 1.00 20.00 C HETATM 2606 C8 ACD A 300 -0.749 8.817 -4.311 1.00 20.00 C HETATM 2607 C9 ACD A 300 -0.890 7.838 -3.145 1.00 20.00 C HETATM 2608 C10 ACD A 300 -1.070 6.340 -3.401 1.00 20.00 C HETATM 2609 C11 ACD A 300 -1.849 5.727 -2.236 1.00 20.00 C HETATM 2610 C12 ACD A 300 -1.137 5.439 -0.913 1.00 20.00 C HETATM 2611 C13 ACD A 300 0.351 5.769 -0.770 1.00 20.00 C HETATM 2612 C14 ACD A 300 0.587 6.188 0.683 1.00 20.00 C HETATM 2613 C15 ACD A 300 0.688 7.666 1.071 1.00 20.00 C HETATM 2614 C16 ACD A 300 0.558 8.768 0.018 1.00 20.00 C HETATM 2615 C17 ACD A 300 1.655 8.635 -1.042 1.00 20.00 C HETATM 2616 C18 ACD A 300 1.453 9.703 -2.119 1.00 20.00 C HETATM 2617 C19 ACD A 300 2.359 9.385 -3.310 1.00 20.00 C HETATM 2618 C20 ACD A 300 2.034 10.317 -4.479 1.00 20.00 C HETATM 2619 O1 ACD A 300 -2.114 10.427 -10.944 1.00 20.00 O HETATM 2620 O2 ACD A 300 -2.003 8.308 -10.266 1.00 20.00 O HETATM 0 H203 ACD A 300 0.994 10.181 -4.774 1.00 20.00 H new HETATM 0 H202 ACD A 300 2.193 11.352 -4.175 1.00 20.00 H new HETATM 0 H201 ACD A 300 2.684 10.083 -5.322 1.00 20.00 H new HETATM 0 H192 ACD A 300 3.404 9.499 -3.023 1.00 20.00 H new HETATM 0 H191 ACD A 300 2.224 8.347 -3.613 1.00 20.00 H new HETATM 0 H182 ACD A 300 0.410 9.727 -2.435 1.00 20.00 H new HETATM 0 H181 ACD A 300 1.688 10.690 -1.720 1.00 20.00 H new HETATM 0 H172 ACD A 300 2.637 8.748 -0.582 1.00 20.00 H new HETATM 0 H171 ACD A 300 1.625 7.641 -1.489 1.00 20.00 H new HETATM 0 H162 ACD A 300 -0.422 8.711 -0.456 1.00 20.00 H new HETATM 0 H161 ACD A 300 0.624 9.745 0.497 1.00 20.00 H new HETATM 0 H132 ACD A 300 0.963 4.903 -1.024 1.00 20.00 H new HETATM 0 H131 ACD A 300 0.634 6.571 -1.452 1.00 20.00 H new HETATM 0 H102 ACD A 300 -1.604 6.179 -4.337 1.00 20.00 H new HETATM 0 H101 ACD A 300 -0.099 5.856 -3.501 1.00 20.00 H new HETATM 0 HO2 ACD A 300 -2.560 8.506 -9.485 1.00 20.00 H new HETATM 0 H9 ACD A 300 -0.862 8.211 -2.121 1.00 20.00 H new HETATM 0 H8 ACD A 300 -0.622 9.881 -4.111 1.00 20.00 H new HETATM 0 H72 ACD A 300 -1.041 9.134 -6.429 1.00 20.00 H new HETATM 0 H71 ACD A 300 -1.561 7.557 -5.868 1.00 20.00 H new HETATM 0 H6 ACD A 300 1.121 7.106 -5.436 1.00 20.00 H new HETATM 0 H5 ACD A 300 2.138 7.603 -7.797 1.00 20.00 H new HETATM 0 H42 ACD A 300 0.704 9.941 -8.401 1.00 20.00 H new HETATM 0 H41 ACD A 300 -0.662 8.846 -8.323 1.00 20.00 H new HETATM 0 H32 ACD A 300 0.350 7.410 -10.084 1.00 20.00 H new HETATM 0 H31 ACD A 300 1.777 8.425 -10.123 1.00 20.00 H new HETATM 0 H22 ACD A 300 0.222 9.038 -11.964 1.00 20.00 H new HETATM 0 H21 ACD A 300 0.408 10.375 -10.846 1.00 20.00 H new HETATM 0 H15 ACD A 300 0.855 7.937 2.113 1.00 20.00 H new HETATM 0 H14 ACD A 300 0.685 5.423 1.453 1.00 20.00 H new HETATM 0 H12 ACD A 300 -1.685 5.002 -0.078 1.00 20.00 H new HETATM 0 H11 ACD A 300 -2.908 5.496 -2.348 1.00 20.00 H new