USER MOD reduce.3.24.130724 H: found=0, std=0, add=840, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 839 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: F 83 GLN : amide:sc= -0.857 K(o=-11,f=-8.9) USER MOD Set 1.2: F 84 GLN : amide:sc= -9.73! C(o=-11!,f=-17!) USER MOD Set 1.3: F 87 GLN : amide:sc= -0.0962 K(o=-11,f=-12!) USER MOD Set 2.1: F 61 TYR OH : rot 151:sc= 0.436 USER MOD Set 2.2: F 97 SER OG : rot 180:sc= 1.02 USER MOD Set 3.1: F 54 LYS NZ :NH3+ -144:sc= -3.06! (180deg=0) USER MOD Set 3.2: F 57 HIS : no HD1:sc= -8.81! C(o=-12!,f=-9.4!) USER MOD Set 4.1: F 46 SER OG : rot -47:sc= -5.71! USER MOD Set 4.2: F 60 HIS : no HD1:sc= -11.4! C(o=-17!,f=-18!) USER MOD Set 5.1: F 36 SER OG : rot 92:sc= -0.437! USER MOD Set 5.2: F 44 SER OG : rot -40:sc= -0.509! USER MOD Set 6.1: F 26 ASN : amide:sc= -1.81 X(o=-1.9,f=-1.5) USER MOD Set 6.2: F 30 THR OG1 : rot 78:sc= -0.103 USER MOD Set 7.1: F 8 TYR OH : rot 41:sc= -0.184 USER MOD Set 7.2: F 43 TYR OH : rot -66:sc= 0.181! USER MOD Single : F 3 GLN : amide:sc= -0.197 K(o=-0.2,f=-2.7!) USER MOD Single : F 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 15 LYS NZ :NH3+ 157:sc= 0.186 (180deg=0.00724) USER MOD Single : F 20 GLN : amide:sc= -1.81 K(o=-1.8,f=-3.2!) USER MOD Single : F 23 SER OG : rot 180:sc= 0 USER MOD Single : F 38 THR OG1 : rot 180:sc= 0 USER MOD Single : F 39 THR OG1 : rot 180:sc= 0.04 USER MOD Single : F 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 53 MET CE :methyl 144:sc= -6.65! (180deg=-12.3!) USER MOD Single : F 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 62 LYS NZ :NH3+ -146:sc= -0.371 (180deg=-0.881) USER MOD Single : F 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 68 ASN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : F 71 TYR OH : rot 180:sc= 0 USER MOD Single : F 72 TYR OH : rot 180:sc= -0.0268 USER MOD Single : F 74 THR OG1 : rot 100:sc= 0.0232 USER MOD Single : F 75 THR OG1 : rot 180:sc= 0 USER MOD Single : F 78 GLN : amide:sc= -1.61! C(o=-1.6!,f=-1.3!) USER MOD Single : F 81 THR OG1 : rot 180:sc= -0.715! USER MOD Single : F 88 HIS : no HE2:sc= -2.44! C(o=-2.4!,f=-4.1!) USER MOD Single : F 89 TYR OH : rot 180:sc= 0 USER MOD Single : F 90 SER OG : rot -40:sc= -1.81! USER MOD Single : F 98 SER OG : rot -103:sc= 0.78! USER MOD ----------------------------------------------------------------- ATOM 14 N ILE F 2 -6.202 -8.529 -22.322 1.00 0.00 N ATOM 15 CA ILE F 2 -6.848 -7.264 -21.872 1.00 0.00 C ATOM 16 C ILE F 2 -6.169 -6.072 -22.554 1.00 0.00 C ATOM 17 O ILE F 2 -5.246 -6.231 -23.327 1.00 0.00 O ATOM 18 CB ILE F 2 -6.711 -7.134 -20.354 1.00 0.00 C ATOM 19 CG1 ILE F 2 -5.233 -7.224 -19.965 1.00 0.00 C ATOM 20 CG2 ILE F 2 -7.484 -8.265 -19.672 1.00 0.00 C ATOM 21 CD1 ILE F 2 -5.102 -7.205 -18.440 1.00 0.00 C ATOM 0 HA ILE F 2 -7.904 -7.279 -22.140 1.00 0.00 H new ATOM 0 HB ILE F 2 -7.115 -6.173 -20.035 1.00 0.00 H new ATOM 0 HG12 ILE F 2 -4.796 -8.138 -20.366 1.00 0.00 H new ATOM 0 HG13 ILE F 2 -4.681 -6.390 -20.398 1.00 0.00 H new ATOM 0 HG21 ILE F 2 -7.386 -8.172 -18.590 1.00 0.00 H new ATOM 0 HG22 ILE F 2 -8.537 -8.204 -19.948 1.00 0.00 H new ATOM 0 HG23 ILE F 2 -7.080 -9.226 -19.992 1.00 0.00 H new ATOM 0 HD11 ILE F 2 -4.049 -7.269 -18.164 1.00 0.00 H new ATOM 0 HD12 ILE F 2 -5.523 -6.278 -18.050 1.00 0.00 H new ATOM 0 HD13 ILE F 2 -5.640 -8.054 -18.018 1.00 0.00 H new ATOM 33 N GLN F 3 -6.621 -4.879 -22.275 1.00 0.00 N ATOM 34 CA GLN F 3 -6.006 -3.678 -22.909 1.00 0.00 C ATOM 35 C GLN F 3 -4.486 -3.781 -22.841 1.00 0.00 C ATOM 36 O GLN F 3 -3.799 -3.718 -23.841 1.00 0.00 O ATOM 37 CB GLN F 3 -6.457 -2.418 -22.166 1.00 0.00 C ATOM 38 CG GLN F 3 -6.511 -1.241 -23.143 1.00 0.00 C ATOM 39 CD GLN F 3 -7.792 -1.327 -23.975 1.00 0.00 C ATOM 40 OE1 GLN F 3 -8.724 -2.015 -23.607 1.00 0.00 O ATOM 41 NE2 GLN F 3 -7.878 -0.653 -25.089 1.00 0.00 N ATOM 0 H GLN F 3 -7.391 -4.684 -21.635 1.00 0.00 H new ATOM 0 HA GLN F 3 -6.322 -3.623 -23.951 1.00 0.00 H new ATOM 0 HB2 GLN F 3 -7.438 -2.578 -21.719 1.00 0.00 H new ATOM 0 HB3 GLN F 3 -5.767 -2.197 -21.351 1.00 0.00 H new ATOM 0 HG2 GLN F 3 -6.483 -0.299 -22.596 1.00 0.00 H new ATOM 0 HG3 GLN F 3 -5.639 -1.257 -23.796 1.00 0.00 H new ATOM 0 HE21 GLN F 3 -7.096 -0.076 -25.397 1.00 0.00 H new ATOM 0 HE22 GLN F 3 -8.728 -0.703 -25.651 1.00 0.00 H new ATOM 50 N ALA F 4 -3.959 -3.934 -21.664 1.00 0.00 N ATOM 51 CA ALA F 4 -2.483 -4.038 -21.508 1.00 0.00 C ATOM 52 C ALA F 4 -1.801 -2.998 -22.394 1.00 0.00 C ATOM 53 O ALA F 4 -1.396 -3.282 -23.504 1.00 0.00 O ATOM 54 CB ALA F 4 -2.022 -5.431 -21.916 1.00 0.00 C ATOM 0 H ALA F 4 -4.490 -3.992 -20.795 1.00 0.00 H new ATOM 0 HA ALA F 4 -2.218 -3.859 -20.466 1.00 0.00 H new ATOM 0 HB1 ALA F 4 -0.941 -5.505 -21.801 1.00 0.00 H new ATOM 0 HB2 ALA F 4 -2.506 -6.174 -21.283 1.00 0.00 H new ATOM 0 HB3 ALA F 4 -2.289 -5.612 -22.957 1.00 0.00 H new ATOM 60 N GLU F 5 -1.675 -1.798 -21.910 1.00 0.00 N ATOM 61 CA GLU F 5 -1.022 -0.729 -22.719 1.00 0.00 C ATOM 62 C GLU F 5 -0.649 0.453 -21.821 1.00 0.00 C ATOM 63 O GLU F 5 0.355 1.105 -22.030 1.00 0.00 O ATOM 64 CB GLU F 5 -1.988 -0.251 -23.804 1.00 0.00 C ATOM 65 CG GLU F 5 -2.016 -1.264 -24.949 1.00 0.00 C ATOM 66 CD GLU F 5 -2.403 -0.555 -26.248 1.00 0.00 C ATOM 67 OE1 GLU F 5 -2.064 0.610 -26.388 1.00 0.00 O ATOM 68 OE2 GLU F 5 -3.031 -1.187 -27.081 1.00 0.00 O ATOM 0 H GLU F 5 -1.996 -1.507 -20.987 1.00 0.00 H new ATOM 0 HA GLU F 5 -0.119 -1.131 -23.178 1.00 0.00 H new ATOM 0 HB2 GLU F 5 -2.988 -0.130 -23.387 1.00 0.00 H new ATOM 0 HB3 GLU F 5 -1.678 0.725 -24.176 1.00 0.00 H new ATOM 0 HG2 GLU F 5 -1.039 -1.735 -25.056 1.00 0.00 H new ATOM 0 HG3 GLU F 5 -2.730 -2.058 -24.729 1.00 0.00 H new ATOM 75 N GLU F 6 -1.451 0.748 -20.832 1.00 0.00 N ATOM 76 CA GLU F 6 -1.129 1.902 -19.945 1.00 0.00 C ATOM 77 C GLU F 6 -1.442 1.558 -18.486 1.00 0.00 C ATOM 78 O GLU F 6 -0.723 1.938 -17.585 1.00 0.00 O ATOM 79 CB GLU F 6 -1.960 3.113 -20.374 1.00 0.00 C ATOM 80 CG GLU F 6 -1.709 3.401 -21.856 1.00 0.00 C ATOM 81 CD GLU F 6 -2.657 2.556 -22.708 1.00 0.00 C ATOM 82 OE1 GLU F 6 -3.478 1.860 -22.134 1.00 0.00 O ATOM 83 OE2 GLU F 6 -2.545 2.619 -23.922 1.00 0.00 O ATOM 0 H GLU F 6 -2.308 0.244 -20.602 1.00 0.00 H new ATOM 0 HA GLU F 6 -0.067 2.131 -20.030 1.00 0.00 H new ATOM 0 HB2 GLU F 6 -3.019 2.920 -20.204 1.00 0.00 H new ATOM 0 HB3 GLU F 6 -1.694 3.982 -19.773 1.00 0.00 H new ATOM 0 HG2 GLU F 6 -1.864 4.460 -22.063 1.00 0.00 H new ATOM 0 HG3 GLU F 6 -0.674 3.174 -22.111 1.00 0.00 H new ATOM 90 N TRP F 7 -2.505 0.843 -18.243 1.00 0.00 N ATOM 91 CA TRP F 7 -2.851 0.483 -16.845 1.00 0.00 C ATOM 92 C TRP F 7 -2.407 -0.953 -16.564 1.00 0.00 C ATOM 93 O TRP F 7 -2.556 -1.445 -15.467 1.00 0.00 O ATOM 94 CB TRP F 7 -4.364 0.605 -16.643 1.00 0.00 C ATOM 95 CG TRP F 7 -5.081 -0.184 -17.692 1.00 0.00 C ATOM 96 CD1 TRP F 7 -5.617 0.331 -18.822 1.00 0.00 C ATOM 97 CD2 TRP F 7 -5.349 -1.614 -17.726 1.00 0.00 C ATOM 98 NE1 TRP F 7 -6.199 -0.694 -19.547 1.00 0.00 N ATOM 99 CE2 TRP F 7 -6.060 -1.913 -18.912 1.00 0.00 C ATOM 100 CE3 TRP F 7 -5.048 -2.671 -16.851 1.00 0.00 C ATOM 101 CZ2 TRP F 7 -6.456 -3.215 -19.218 1.00 0.00 C ATOM 102 CZ3 TRP F 7 -5.445 -3.983 -17.156 1.00 0.00 C ATOM 103 CH2 TRP F 7 -6.148 -4.254 -18.336 1.00 0.00 C ATOM 0 H TRP F 7 -3.148 0.494 -18.954 1.00 0.00 H new ATOM 0 HA TRP F 7 -2.342 1.159 -16.159 1.00 0.00 H new ATOM 0 HB2 TRP F 7 -4.638 0.243 -15.652 1.00 0.00 H new ATOM 0 HB3 TRP F 7 -4.664 1.652 -16.694 1.00 0.00 H new ATOM 0 HD1 TRP F 7 -5.594 1.371 -19.111 1.00 0.00 H new ATOM 0 HE1 TRP F 7 -6.673 -0.565 -20.441 1.00 0.00 H new ATOM 0 HE3 TRP F 7 -4.507 -2.473 -15.937 1.00 0.00 H new ATOM 0 HZ2 TRP F 7 -6.997 -3.419 -20.130 1.00 0.00 H new ATOM 0 HZ3 TRP F 7 -5.207 -4.788 -16.476 1.00 0.00 H new ATOM 0 HH2 TRP F 7 -6.452 -5.265 -18.564 1.00 0.00 H new ATOM 114 N TYR F 8 -1.872 -1.629 -17.553 1.00 0.00 N ATOM 115 CA TYR F 8 -1.427 -3.036 -17.348 1.00 0.00 C ATOM 116 C TYR F 8 -0.330 -3.381 -18.356 1.00 0.00 C ATOM 117 O TYR F 8 -0.480 -3.212 -19.549 1.00 0.00 O ATOM 118 CB TYR F 8 -2.646 -3.941 -17.496 1.00 0.00 C ATOM 119 CG TYR F 8 -2.262 -5.343 -17.894 1.00 0.00 C ATOM 120 CD1 TYR F 8 -1.465 -6.118 -17.051 1.00 0.00 C ATOM 121 CD2 TYR F 8 -2.724 -5.870 -19.104 1.00 0.00 C ATOM 122 CE1 TYR F 8 -1.125 -7.423 -17.420 1.00 0.00 C ATOM 123 CE2 TYR F 8 -2.388 -7.175 -19.473 1.00 0.00 C ATOM 124 CZ TYR F 8 -1.586 -7.952 -18.631 1.00 0.00 C ATOM 125 OH TYR F 8 -1.252 -9.241 -18.993 1.00 0.00 O ATOM 0 H TYR F 8 -1.726 -1.263 -18.494 1.00 0.00 H new ATOM 0 HA TYR F 8 -1.004 -3.176 -16.353 1.00 0.00 H new ATOM 0 HB2 TYR F 8 -3.194 -3.969 -16.554 1.00 0.00 H new ATOM 0 HB3 TYR F 8 -3.319 -3.523 -18.244 1.00 0.00 H new ATOM 0 HD1 TYR F 8 -1.111 -5.711 -16.115 1.00 0.00 H new ATOM 0 HD2 TYR F 8 -3.341 -5.268 -19.754 1.00 0.00 H new ATOM 0 HE1 TYR F 8 -0.506 -8.023 -16.770 1.00 0.00 H new ATOM 0 HE2 TYR F 8 -2.747 -7.583 -20.406 1.00 0.00 H new ATOM 0 HH TYR F 8 -1.310 -9.826 -18.209 1.00 0.00 H new ATOM 135 N PHE F 9 0.793 -3.834 -17.864 1.00 0.00 N ATOM 136 CA PHE F 9 1.935 -4.166 -18.758 1.00 0.00 C ATOM 137 C PHE F 9 1.964 -5.667 -19.049 1.00 0.00 C ATOM 138 O PHE F 9 2.278 -6.087 -20.146 1.00 0.00 O ATOM 139 CB PHE F 9 3.238 -3.752 -18.064 1.00 0.00 C ATOM 140 CG PHE F 9 3.470 -2.267 -18.259 1.00 0.00 C ATOM 141 CD1 PHE F 9 2.384 -1.410 -18.490 1.00 0.00 C ATOM 142 CD2 PHE F 9 4.771 -1.746 -18.208 1.00 0.00 C ATOM 143 CE1 PHE F 9 2.598 -0.039 -18.670 1.00 0.00 C ATOM 144 CE2 PHE F 9 4.983 -0.374 -18.388 1.00 0.00 C ATOM 145 CZ PHE F 9 3.897 0.479 -18.619 1.00 0.00 C ATOM 0 H PHE F 9 0.967 -3.989 -16.871 1.00 0.00 H new ATOM 0 HA PHE F 9 1.824 -3.632 -19.702 1.00 0.00 H new ATOM 0 HB2 PHE F 9 3.185 -3.985 -17.001 1.00 0.00 H new ATOM 0 HB3 PHE F 9 4.075 -4.318 -18.473 1.00 0.00 H new ATOM 0 HD1 PHE F 9 1.381 -1.809 -18.529 1.00 0.00 H new ATOM 0 HD2 PHE F 9 5.609 -2.403 -18.030 1.00 0.00 H new ATOM 0 HE1 PHE F 9 1.761 0.619 -18.848 1.00 0.00 H new ATOM 0 HE2 PHE F 9 5.985 0.027 -18.349 1.00 0.00 H new ATOM 0 HZ PHE F 9 4.062 1.537 -18.758 1.00 0.00 H new ATOM 155 N GLY F 10 1.650 -6.482 -18.082 1.00 0.00 N ATOM 156 CA GLY F 10 1.674 -7.953 -18.320 1.00 0.00 C ATOM 157 C GLY F 10 2.169 -8.672 -17.065 1.00 0.00 C ATOM 158 O GLY F 10 1.544 -8.638 -16.023 1.00 0.00 O ATOM 0 H GLY F 10 1.379 -6.196 -17.141 1.00 0.00 H new ATOM 0 HA2 GLY F 10 0.676 -8.305 -18.582 1.00 0.00 H new ATOM 0 HA3 GLY F 10 2.325 -8.184 -19.163 1.00 0.00 H new ATOM 162 N LYS F 11 3.292 -9.319 -17.166 1.00 0.00 N ATOM 163 CA LYS F 11 3.854 -10.045 -15.997 1.00 0.00 C ATOM 164 C LYS F 11 5.087 -9.288 -15.523 1.00 0.00 C ATOM 165 O LYS F 11 6.209 -9.718 -15.706 1.00 0.00 O ATOM 166 CB LYS F 11 4.235 -11.461 -16.425 1.00 0.00 C ATOM 167 CG LYS F 11 3.081 -12.069 -17.226 1.00 0.00 C ATOM 168 CD LYS F 11 3.642 -12.861 -18.408 1.00 0.00 C ATOM 169 CE LYS F 11 4.241 -14.175 -17.904 1.00 0.00 C ATOM 170 NZ LYS F 11 4.241 -15.179 -19.007 1.00 0.00 N ATOM 0 H LYS F 11 3.851 -9.377 -18.017 1.00 0.00 H new ATOM 0 HA LYS F 11 3.125 -10.108 -15.189 1.00 0.00 H new ATOM 0 HB2 LYS F 11 5.142 -11.440 -17.029 1.00 0.00 H new ATOM 0 HB3 LYS F 11 4.449 -12.074 -15.549 1.00 0.00 H new ATOM 0 HG2 LYS F 11 2.485 -12.721 -16.588 1.00 0.00 H new ATOM 0 HG3 LYS F 11 2.418 -11.281 -17.584 1.00 0.00 H new ATOM 0 HD2 LYS F 11 2.852 -13.063 -19.132 1.00 0.00 H new ATOM 0 HD3 LYS F 11 4.404 -12.276 -18.923 1.00 0.00 H new ATOM 0 HE2 LYS F 11 5.258 -14.010 -17.548 1.00 0.00 H new ATOM 0 HE3 LYS F 11 3.664 -14.549 -17.058 1.00 0.00 H new ATOM 0 HZ1 LYS F 11 4.648 -16.072 -18.663 1.00 0.00 H new ATOM 0 HZ2 LYS F 11 3.265 -15.344 -19.326 1.00 0.00 H new ATOM 0 HZ3 LYS F 11 4.810 -14.822 -19.801 1.00 0.00 H new ATOM 184 N LEU F 12 4.881 -8.143 -14.944 1.00 0.00 N ATOM 185 CA LEU F 12 6.030 -7.319 -14.485 1.00 0.00 C ATOM 186 C LEU F 12 6.100 -7.301 -12.957 1.00 0.00 C ATOM 187 O LEU F 12 5.182 -7.711 -12.277 1.00 0.00 O ATOM 188 CB LEU F 12 5.842 -5.896 -15.008 1.00 0.00 C ATOM 189 CG LEU F 12 7.118 -5.093 -14.791 1.00 0.00 C ATOM 190 CD1 LEU F 12 8.306 -5.841 -15.400 1.00 0.00 C ATOM 191 CD2 LEU F 12 6.970 -3.729 -15.461 1.00 0.00 C ATOM 0 H LEU F 12 3.961 -7.739 -14.767 1.00 0.00 H new ATOM 0 HA LEU F 12 6.959 -7.744 -14.865 1.00 0.00 H new ATOM 0 HB2 LEU F 12 5.592 -5.919 -16.069 1.00 0.00 H new ATOM 0 HB3 LEU F 12 5.008 -5.417 -14.494 1.00 0.00 H new ATOM 0 HG LEU F 12 7.291 -4.959 -13.723 1.00 0.00 H new ATOM 0 HD11 LEU F 12 9.218 -5.265 -15.244 1.00 0.00 H new ATOM 0 HD12 LEU F 12 8.406 -6.815 -14.922 1.00 0.00 H new ATOM 0 HD13 LEU F 12 8.141 -5.977 -16.469 1.00 0.00 H new ATOM 0 HD21 LEU F 12 7.880 -3.149 -15.310 1.00 0.00 H new ATOM 0 HD22 LEU F 12 6.800 -3.865 -16.529 1.00 0.00 H new ATOM 0 HD23 LEU F 12 6.124 -3.198 -15.023 1.00 0.00 H new ATOM 203 N GLY F 13 7.189 -6.824 -12.414 1.00 0.00 N ATOM 204 CA GLY F 13 7.326 -6.776 -10.932 1.00 0.00 C ATOM 205 C GLY F 13 7.258 -5.322 -10.460 1.00 0.00 C ATOM 206 O GLY F 13 6.959 -4.424 -11.220 1.00 0.00 O ATOM 0 H GLY F 13 7.989 -6.466 -12.935 1.00 0.00 H new ATOM 0 HA2 GLY F 13 6.533 -7.359 -10.464 1.00 0.00 H new ATOM 0 HA3 GLY F 13 8.272 -7.224 -10.629 1.00 0.00 H new ATOM 210 N ARG F 14 7.529 -5.086 -9.206 1.00 0.00 N ATOM 211 CA ARG F 14 7.473 -3.694 -8.676 1.00 0.00 C ATOM 212 C ARG F 14 8.784 -2.967 -8.977 1.00 0.00 C ATOM 213 O ARG F 14 8.850 -1.754 -8.966 1.00 0.00 O ATOM 214 CB ARG F 14 7.270 -3.743 -7.164 1.00 0.00 C ATOM 215 CG ARG F 14 8.408 -4.536 -6.521 1.00 0.00 C ATOM 216 CD ARG F 14 9.437 -3.568 -5.934 1.00 0.00 C ATOM 217 NE ARG F 14 9.269 -3.500 -4.455 1.00 0.00 N ATOM 218 CZ ARG F 14 8.378 -2.700 -3.935 1.00 0.00 C ATOM 219 NH1 ARG F 14 8.483 -1.410 -4.103 1.00 0.00 N ATOM 220 NH2 ARG F 14 7.384 -3.189 -3.247 1.00 0.00 N ATOM 0 H ARG F 14 7.787 -5.799 -8.524 1.00 0.00 H new ATOM 0 HA ARG F 14 6.648 -3.163 -9.150 1.00 0.00 H new ATOM 0 HB2 ARG F 14 7.242 -2.732 -6.757 1.00 0.00 H new ATOM 0 HB3 ARG F 14 6.312 -4.207 -6.930 1.00 0.00 H new ATOM 0 HG2 ARG F 14 8.016 -5.185 -5.738 1.00 0.00 H new ATOM 0 HG3 ARG F 14 8.881 -5.180 -7.262 1.00 0.00 H new ATOM 0 HD2 ARG F 14 10.446 -3.899 -6.181 1.00 0.00 H new ATOM 0 HD3 ARG F 14 9.311 -2.577 -6.371 1.00 0.00 H new ATOM 0 HE ARG F 14 9.850 -4.079 -3.849 1.00 0.00 H new ATOM 0 HH11 ARG F 14 9.261 -1.027 -4.640 1.00 0.00 H new ATOM 0 HH12 ARG F 14 7.787 -0.785 -3.697 1.00 0.00 H new ATOM 0 HH21 ARG F 14 7.302 -4.197 -3.115 1.00 0.00 H new ATOM 0 HH22 ARG F 14 6.688 -2.563 -2.841 1.00 0.00 H new ATOM 234 N LYS F 15 9.829 -3.697 -9.233 1.00 0.00 N ATOM 235 CA LYS F 15 11.134 -3.059 -9.520 1.00 0.00 C ATOM 236 C LYS F 15 11.147 -2.554 -10.957 1.00 0.00 C ATOM 237 O LYS F 15 11.635 -1.477 -11.248 1.00 0.00 O ATOM 238 CB LYS F 15 12.258 -4.076 -9.323 1.00 0.00 C ATOM 239 CG LYS F 15 13.587 -3.458 -9.762 1.00 0.00 C ATOM 240 CD LYS F 15 14.637 -3.678 -8.671 1.00 0.00 C ATOM 241 CE LYS F 15 14.866 -2.368 -7.914 1.00 0.00 C ATOM 242 NZ LYS F 15 13.814 -2.206 -6.872 1.00 0.00 N ATOM 0 H LYS F 15 9.833 -4.717 -9.255 1.00 0.00 H new ATOM 0 HA LYS F 15 11.285 -2.221 -8.840 1.00 0.00 H new ATOM 0 HB2 LYS F 15 12.312 -4.376 -8.277 1.00 0.00 H new ATOM 0 HB3 LYS F 15 12.054 -4.976 -9.903 1.00 0.00 H new ATOM 0 HG2 LYS F 15 13.919 -3.909 -10.697 1.00 0.00 H new ATOM 0 HG3 LYS F 15 13.460 -2.392 -9.950 1.00 0.00 H new ATOM 0 HD2 LYS F 15 14.305 -4.455 -7.983 1.00 0.00 H new ATOM 0 HD3 LYS F 15 15.571 -4.023 -9.114 1.00 0.00 H new ATOM 0 HE2 LYS F 15 15.853 -2.370 -7.452 1.00 0.00 H new ATOM 0 HE3 LYS F 15 14.840 -1.526 -8.606 1.00 0.00 H new ATOM 0 HZ1 LYS F 15 14.159 -1.568 -6.127 1.00 0.00 H new ATOM 0 HZ2 LYS F 15 12.957 -1.804 -7.303 1.00 0.00 H new ATOM 0 HZ3 LYS F 15 13.590 -3.133 -6.458 1.00 0.00 H new ATOM 256 N ASP F 16 10.611 -3.318 -11.864 1.00 0.00 N ATOM 257 CA ASP F 16 10.594 -2.885 -13.265 1.00 0.00 C ATOM 258 C ASP F 16 9.560 -1.782 -13.419 1.00 0.00 C ATOM 259 O ASP F 16 9.727 -0.858 -14.184 1.00 0.00 O ATOM 260 CB ASP F 16 10.202 -4.062 -14.138 1.00 0.00 C ATOM 261 CG ASP F 16 10.759 -3.870 -15.550 1.00 0.00 C ATOM 262 OD1 ASP F 16 10.578 -2.793 -16.095 1.00 0.00 O ATOM 263 OD2 ASP F 16 11.358 -4.801 -16.062 1.00 0.00 O ATOM 0 H ASP F 16 10.184 -4.227 -11.684 1.00 0.00 H new ATOM 0 HA ASP F 16 11.577 -2.519 -13.560 1.00 0.00 H new ATOM 0 HB2 ASP F 16 10.585 -4.988 -13.709 1.00 0.00 H new ATOM 0 HB3 ASP F 16 9.116 -4.153 -14.175 1.00 0.00 H new ATOM 268 N ALA F 17 8.486 -1.890 -12.693 1.00 0.00 N ATOM 269 CA ALA F 17 7.418 -0.861 -12.780 1.00 0.00 C ATOM 270 C ALA F 17 7.978 0.494 -12.355 1.00 0.00 C ATOM 271 O ALA F 17 7.791 1.491 -13.023 1.00 0.00 O ATOM 272 CB ALA F 17 6.258 -1.250 -11.864 1.00 0.00 C ATOM 0 H ALA F 17 8.301 -2.651 -12.040 1.00 0.00 H new ATOM 0 HA ALA F 17 7.059 -0.796 -13.807 1.00 0.00 H new ATOM 0 HB1 ALA F 17 5.475 -0.495 -11.928 1.00 0.00 H new ATOM 0 HB2 ALA F 17 5.858 -2.215 -12.174 1.00 0.00 H new ATOM 0 HB3 ALA F 17 6.613 -1.318 -10.836 1.00 0.00 H new ATOM 278 N GLU F 18 8.667 0.538 -11.253 1.00 0.00 N ATOM 279 CA GLU F 18 9.243 1.830 -10.793 1.00 0.00 C ATOM 280 C GLU F 18 10.179 2.373 -11.872 1.00 0.00 C ATOM 281 O GLU F 18 10.183 3.551 -12.170 1.00 0.00 O ATOM 282 CB GLU F 18 10.024 1.617 -9.493 1.00 0.00 C ATOM 283 CG GLU F 18 10.997 0.448 -9.663 1.00 0.00 C ATOM 284 CD GLU F 18 11.822 0.282 -8.385 1.00 0.00 C ATOM 285 OE1 GLU F 18 11.355 -0.399 -7.487 1.00 0.00 O ATOM 286 OE2 GLU F 18 12.905 0.839 -8.326 1.00 0.00 O ATOM 0 H GLU F 18 8.857 -0.263 -10.651 1.00 0.00 H new ATOM 0 HA GLU F 18 8.439 2.543 -10.611 1.00 0.00 H new ATOM 0 HB2 GLU F 18 10.571 2.523 -9.233 1.00 0.00 H new ATOM 0 HB3 GLU F 18 9.336 1.414 -8.673 1.00 0.00 H new ATOM 0 HG2 GLU F 18 10.447 -0.469 -9.876 1.00 0.00 H new ATOM 0 HG3 GLU F 18 11.655 0.629 -10.513 1.00 0.00 H new ATOM 293 N ARG F 19 10.971 1.523 -12.468 1.00 0.00 N ATOM 294 CA ARG F 19 11.901 1.996 -13.533 1.00 0.00 C ATOM 295 C ARG F 19 11.149 2.097 -14.863 1.00 0.00 C ATOM 296 O ARG F 19 11.652 2.629 -15.833 1.00 0.00 O ATOM 297 CB ARG F 19 13.058 1.006 -13.675 1.00 0.00 C ATOM 298 CG ARG F 19 14.284 1.731 -14.232 1.00 0.00 C ATOM 299 CD ARG F 19 14.356 1.525 -15.746 1.00 0.00 C ATOM 300 NE ARG F 19 15.676 0.936 -16.107 1.00 0.00 N ATOM 301 CZ ARG F 19 15.732 -0.210 -16.727 1.00 0.00 C ATOM 302 NH1 ARG F 19 14.864 -1.144 -16.453 1.00 0.00 N ATOM 303 NH2 ARG F 19 16.657 -0.423 -17.622 1.00 0.00 N ATOM 0 H ARG F 19 11.014 0.524 -12.264 1.00 0.00 H new ATOM 0 HA ARG F 19 12.292 2.977 -13.263 1.00 0.00 H new ATOM 0 HB2 ARG F 19 13.293 0.563 -12.707 1.00 0.00 H new ATOM 0 HB3 ARG F 19 12.773 0.189 -14.338 1.00 0.00 H new ATOM 0 HG2 ARG F 19 14.226 2.795 -14.002 1.00 0.00 H new ATOM 0 HG3 ARG F 19 15.190 1.351 -13.759 1.00 0.00 H new ATOM 0 HD2 ARG F 19 13.551 0.867 -16.072 1.00 0.00 H new ATOM 0 HD3 ARG F 19 14.218 2.476 -16.260 1.00 0.00 H new ATOM 0 HE ARG F 19 16.536 1.429 -15.869 1.00 0.00 H new ATOM 0 HH11 ARG F 19 14.141 -0.978 -15.753 1.00 0.00 H new ATOM 0 HH12 ARG F 19 14.909 -2.040 -16.938 1.00 0.00 H new ATOM 0 HH21 ARG F 19 17.336 0.307 -17.837 1.00 0.00 H new ATOM 0 HH22 ARG F 19 16.701 -1.319 -18.107 1.00 0.00 H new ATOM 317 N GLN F 20 9.944 1.595 -14.916 1.00 0.00 N ATOM 318 CA GLN F 20 9.160 1.663 -16.183 1.00 0.00 C ATOM 319 C GLN F 20 8.455 3.016 -16.260 1.00 0.00 C ATOM 320 O GLN F 20 8.259 3.566 -17.325 1.00 0.00 O ATOM 321 CB GLN F 20 8.122 0.536 -16.209 1.00 0.00 C ATOM 322 CG GLN F 20 8.809 -0.780 -16.582 1.00 0.00 C ATOM 323 CD GLN F 20 8.622 -1.046 -18.078 1.00 0.00 C ATOM 324 OE1 GLN F 20 7.600 -1.554 -18.494 1.00 0.00 O ATOM 325 NE2 GLN F 20 9.574 -0.722 -18.909 1.00 0.00 N ATOM 0 H GLN F 20 9.469 1.141 -14.136 1.00 0.00 H new ATOM 0 HA GLN F 20 9.829 1.549 -17.036 1.00 0.00 H new ATOM 0 HB2 GLN F 20 7.643 0.445 -15.234 1.00 0.00 H new ATOM 0 HB3 GLN F 20 7.337 0.766 -16.930 1.00 0.00 H new ATOM 0 HG2 GLN F 20 9.871 -0.730 -16.340 1.00 0.00 H new ATOM 0 HG3 GLN F 20 8.388 -1.600 -16.000 1.00 0.00 H new ATOM 0 HE21 GLN F 20 10.432 -0.295 -18.560 1.00 0.00 H new ATOM 0 HE22 GLN F 20 9.460 -0.895 -19.908 1.00 0.00 H new ATOM 334 N LEU F 21 8.083 3.562 -15.135 1.00 0.00 N ATOM 335 CA LEU F 21 7.403 4.884 -15.141 1.00 0.00 C ATOM 336 C LEU F 21 8.461 5.984 -15.171 1.00 0.00 C ATOM 337 O LEU F 21 8.393 6.907 -15.959 1.00 0.00 O ATOM 338 CB LEU F 21 6.546 5.028 -13.882 1.00 0.00 C ATOM 339 CG LEU F 21 5.693 3.772 -13.696 1.00 0.00 C ATOM 340 CD1 LEU F 21 4.622 4.035 -12.635 1.00 0.00 C ATOM 341 CD2 LEU F 21 5.019 3.409 -15.021 1.00 0.00 C ATOM 0 H LEU F 21 8.221 3.148 -14.213 1.00 0.00 H new ATOM 0 HA LEU F 21 6.761 4.965 -16.018 1.00 0.00 H new ATOM 0 HB2 LEU F 21 7.184 5.179 -13.011 1.00 0.00 H new ATOM 0 HB3 LEU F 21 5.905 5.906 -13.964 1.00 0.00 H new ATOM 0 HG LEU F 21 6.329 2.947 -13.375 1.00 0.00 H new ATOM 0 HD11 LEU F 21 4.014 3.140 -12.502 1.00 0.00 H new ATOM 0 HD12 LEU F 21 5.101 4.292 -11.690 1.00 0.00 H new ATOM 0 HD13 LEU F 21 3.987 4.861 -12.956 1.00 0.00 H new ATOM 0 HD21 LEU F 21 4.412 2.514 -14.887 1.00 0.00 H new ATOM 0 HD22 LEU F 21 4.384 4.234 -15.344 1.00 0.00 H new ATOM 0 HD23 LEU F 21 5.781 3.220 -15.777 1.00 0.00 H new ATOM 353 N LEU F 22 9.446 5.889 -14.322 1.00 0.00 N ATOM 354 CA LEU F 22 10.516 6.923 -14.304 1.00 0.00 C ATOM 355 C LEU F 22 11.226 6.936 -15.659 1.00 0.00 C ATOM 356 O LEU F 22 11.465 7.980 -16.233 1.00 0.00 O ATOM 357 CB LEU F 22 11.527 6.599 -13.200 1.00 0.00 C ATOM 358 CG LEU F 22 10.812 6.529 -11.846 1.00 0.00 C ATOM 359 CD1 LEU F 22 11.847 6.597 -10.721 1.00 0.00 C ATOM 360 CD2 LEU F 22 9.840 7.702 -11.714 1.00 0.00 C ATOM 0 H LEU F 22 9.556 5.139 -13.639 1.00 0.00 H new ATOM 0 HA LEU F 22 10.075 7.901 -14.111 1.00 0.00 H new ATOM 0 HB2 LEU F 22 12.019 5.649 -13.412 1.00 0.00 H new ATOM 0 HB3 LEU F 22 12.305 7.362 -13.172 1.00 0.00 H new ATOM 0 HG LEU F 22 10.258 5.593 -11.778 1.00 0.00 H new ATOM 0 HD11 LEU F 22 11.340 6.547 -9.757 1.00 0.00 H new ATOM 0 HD12 LEU F 22 12.538 5.759 -10.811 1.00 0.00 H new ATOM 0 HD13 LEU F 22 12.401 7.533 -10.792 1.00 0.00 H new ATOM 0 HD21 LEU F 22 9.334 7.648 -10.750 1.00 0.00 H new ATOM 0 HD22 LEU F 22 10.390 8.640 -11.783 1.00 0.00 H new ATOM 0 HD23 LEU F 22 9.102 7.655 -12.515 1.00 0.00 H new ATOM 372 N SER F 23 11.563 5.785 -16.178 1.00 0.00 N ATOM 373 CA SER F 23 12.252 5.742 -17.499 1.00 0.00 C ATOM 374 C SER F 23 11.424 6.520 -18.523 1.00 0.00 C ATOM 375 O SER F 23 10.221 6.637 -18.402 1.00 0.00 O ATOM 376 CB SER F 23 12.394 4.288 -17.953 1.00 0.00 C ATOM 377 OG SER F 23 13.069 4.247 -19.202 1.00 0.00 O ATOM 0 H SER F 23 11.392 4.877 -15.746 1.00 0.00 H new ATOM 0 HA SER F 23 13.242 6.191 -17.412 1.00 0.00 H new ATOM 0 HB2 SER F 23 12.948 3.716 -17.209 1.00 0.00 H new ATOM 0 HB3 SER F 23 11.411 3.826 -18.043 1.00 0.00 H new ATOM 0 HG SER F 23 13.162 3.316 -19.493 1.00 0.00 H new ATOM 383 N PHE F 24 12.059 7.056 -19.531 1.00 0.00 N ATOM 384 CA PHE F 24 11.305 7.827 -20.560 1.00 0.00 C ATOM 385 C PHE F 24 10.021 7.077 -20.924 1.00 0.00 C ATOM 386 O PHE F 24 10.022 6.192 -21.755 1.00 0.00 O ATOM 387 CB PHE F 24 12.171 7.990 -21.811 1.00 0.00 C ATOM 388 CG PHE F 24 13.450 8.705 -21.449 1.00 0.00 C ATOM 389 CD1 PHE F 24 13.411 10.040 -21.029 1.00 0.00 C ATOM 390 CD2 PHE F 24 14.676 8.033 -21.532 1.00 0.00 C ATOM 391 CE1 PHE F 24 14.598 10.703 -20.693 1.00 0.00 C ATOM 392 CE2 PHE F 24 15.862 8.696 -21.197 1.00 0.00 C ATOM 393 CZ PHE F 24 15.824 10.031 -20.777 1.00 0.00 C ATOM 0 H PHE F 24 13.065 6.993 -19.686 1.00 0.00 H new ATOM 0 HA PHE F 24 11.051 8.809 -20.162 1.00 0.00 H new ATOM 0 HB2 PHE F 24 12.397 7.014 -22.240 1.00 0.00 H new ATOM 0 HB3 PHE F 24 11.629 8.554 -22.570 1.00 0.00 H new ATOM 0 HD1 PHE F 24 12.466 10.558 -20.964 1.00 0.00 H new ATOM 0 HD2 PHE F 24 14.706 7.003 -21.855 1.00 0.00 H new ATOM 0 HE1 PHE F 24 14.568 11.733 -20.369 1.00 0.00 H new ATOM 0 HE2 PHE F 24 16.807 8.178 -21.262 1.00 0.00 H new ATOM 0 HZ PHE F 24 16.739 10.542 -20.518 1.00 0.00 H new ATOM 403 N GLY F 25 8.925 7.423 -20.304 1.00 0.00 N ATOM 404 CA GLY F 25 7.644 6.730 -20.612 1.00 0.00 C ATOM 405 C GLY F 25 6.469 7.639 -20.252 1.00 0.00 C ATOM 406 O GLY F 25 5.850 8.241 -21.108 1.00 0.00 O ATOM 0 H GLY F 25 8.863 8.156 -19.597 1.00 0.00 H new ATOM 0 HA2 GLY F 25 7.605 6.470 -21.670 1.00 0.00 H new ATOM 0 HA3 GLY F 25 7.580 5.797 -20.052 1.00 0.00 H new ATOM 410 N ASN F 26 6.156 7.742 -18.992 1.00 0.00 N ATOM 411 CA ASN F 26 5.020 8.611 -18.572 1.00 0.00 C ATOM 412 C ASN F 26 5.406 9.383 -17.306 1.00 0.00 C ATOM 413 O ASN F 26 6.151 8.888 -16.483 1.00 0.00 O ATOM 414 CB ASN F 26 3.795 7.741 -18.285 1.00 0.00 C ATOM 415 CG ASN F 26 2.595 8.277 -19.068 1.00 0.00 C ATOM 416 OD1 ASN F 26 1.493 8.318 -18.559 1.00 0.00 O ATOM 417 ND2 ASN F 26 2.762 8.693 -20.293 1.00 0.00 N ATOM 0 H ASN F 26 6.638 7.262 -18.232 1.00 0.00 H new ATOM 0 HA ASN F 26 4.788 9.317 -19.370 1.00 0.00 H new ATOM 0 HB2 ASN F 26 3.995 6.708 -18.568 1.00 0.00 H new ATOM 0 HB3 ASN F 26 3.576 7.743 -17.217 1.00 0.00 H new ATOM 0 HD21 ASN F 26 1.968 9.052 -20.822 1.00 0.00 H new ATOM 0 HD22 ASN F 26 3.687 8.659 -20.721 1.00 0.00 H new ATOM 424 N PRO F 27 4.883 10.579 -17.191 1.00 0.00 N ATOM 425 CA PRO F 27 5.149 11.455 -16.037 1.00 0.00 C ATOM 426 C PRO F 27 4.308 11.025 -14.831 1.00 0.00 C ATOM 427 O PRO F 27 3.723 9.960 -14.818 1.00 0.00 O ATOM 428 CB PRO F 27 4.723 12.840 -16.531 1.00 0.00 C ATOM 429 CG PRO F 27 3.728 12.599 -17.693 1.00 0.00 C ATOM 430 CD PRO F 27 3.980 11.167 -18.202 1.00 0.00 C ATOM 0 HA PRO F 27 6.188 11.425 -15.708 1.00 0.00 H new ATOM 0 HB2 PRO F 27 4.254 13.412 -15.730 1.00 0.00 H new ATOM 0 HB3 PRO F 27 5.585 13.414 -16.870 1.00 0.00 H new ATOM 0 HG2 PRO F 27 2.699 12.713 -17.351 1.00 0.00 H new ATOM 0 HG3 PRO F 27 3.881 13.326 -18.491 1.00 0.00 H new ATOM 0 HD2 PRO F 27 3.051 10.603 -18.282 1.00 0.00 H new ATOM 0 HD3 PRO F 27 4.437 11.170 -19.191 1.00 0.00 H new ATOM 438 N ARG F 28 4.242 11.846 -13.819 1.00 0.00 N ATOM 439 CA ARG F 28 3.439 11.486 -12.616 1.00 0.00 C ATOM 440 C ARG F 28 1.969 11.329 -13.014 1.00 0.00 C ATOM 441 O ARG F 28 1.560 11.737 -14.083 1.00 0.00 O ATOM 442 CB ARG F 28 3.566 12.592 -11.566 1.00 0.00 C ATOM 443 CG ARG F 28 2.991 13.895 -12.125 1.00 0.00 C ATOM 444 CD ARG F 28 2.306 14.673 -11.000 1.00 0.00 C ATOM 445 NE ARG F 28 1.617 15.865 -11.570 1.00 0.00 N ATOM 446 CZ ARG F 28 2.316 16.875 -12.010 1.00 0.00 C ATOM 447 NH1 ARG F 28 2.952 16.783 -13.144 1.00 0.00 N ATOM 448 NH2 ARG F 28 2.379 17.977 -11.313 1.00 0.00 N ATOM 0 H ARG F 28 4.710 12.751 -13.773 1.00 0.00 H new ATOM 0 HA ARG F 28 3.807 10.548 -12.201 1.00 0.00 H new ATOM 0 HB2 ARG F 28 3.035 12.308 -10.657 1.00 0.00 H new ATOM 0 HB3 ARG F 28 4.612 12.731 -11.294 1.00 0.00 H new ATOM 0 HG2 ARG F 28 3.786 14.496 -12.566 1.00 0.00 H new ATOM 0 HG3 ARG F 28 2.277 13.679 -12.920 1.00 0.00 H new ATOM 0 HD2 ARG F 28 1.587 14.034 -10.487 1.00 0.00 H new ATOM 0 HD3 ARG F 28 3.042 14.985 -10.258 1.00 0.00 H new ATOM 0 HE ARG F 28 0.598 15.891 -11.616 1.00 0.00 H new ATOM 0 HH11 ARG F 28 2.903 15.921 -13.688 1.00 0.00 H new ATOM 0 HH12 ARG F 28 3.498 17.573 -13.488 1.00 0.00 H new ATOM 0 HH21 ARG F 28 1.882 18.048 -10.425 1.00 0.00 H new ATOM 0 HH22 ARG F 28 2.925 18.767 -11.656 1.00 0.00 H new ATOM 462 N GLY F 29 1.172 10.740 -12.165 1.00 0.00 N ATOM 463 CA GLY F 29 -0.266 10.559 -12.501 1.00 0.00 C ATOM 464 C GLY F 29 -0.435 9.298 -13.352 1.00 0.00 C ATOM 465 O GLY F 29 -1.441 9.110 -14.004 1.00 0.00 O ATOM 0 H GLY F 29 1.455 10.377 -11.255 1.00 0.00 H new ATOM 0 HA2 GLY F 29 -0.856 10.477 -11.588 1.00 0.00 H new ATOM 0 HA3 GLY F 29 -0.636 11.429 -13.043 1.00 0.00 H new ATOM 469 N THR F 30 0.544 8.435 -13.350 1.00 0.00 N ATOM 470 CA THR F 30 0.437 7.191 -14.157 1.00 0.00 C ATOM 471 C THR F 30 0.019 6.034 -13.248 1.00 0.00 C ATOM 472 O THR F 30 0.187 6.083 -12.046 1.00 0.00 O ATOM 473 CB THR F 30 1.793 6.881 -14.796 1.00 0.00 C ATOM 474 OG1 THR F 30 2.237 8.015 -15.529 1.00 0.00 O ATOM 475 CG2 THR F 30 1.658 5.684 -15.738 1.00 0.00 C ATOM 0 H THR F 30 1.412 8.539 -12.824 1.00 0.00 H new ATOM 0 HA THR F 30 -0.309 7.324 -14.941 1.00 0.00 H new ATOM 0 HB THR F 30 2.516 6.643 -14.016 1.00 0.00 H new ATOM 0 HG1 THR F 30 2.590 8.687 -14.909 1.00 0.00 H new ATOM 0 HG21 THR F 30 2.625 5.466 -16.191 1.00 0.00 H new ATOM 0 HG22 THR F 30 1.317 4.815 -15.175 1.00 0.00 H new ATOM 0 HG23 THR F 30 0.935 5.916 -16.520 1.00 0.00 H new ATOM 483 N PHE F 31 -0.533 4.997 -13.810 1.00 0.00 N ATOM 484 CA PHE F 31 -0.965 3.841 -12.979 1.00 0.00 C ATOM 485 C PHE F 31 -0.988 2.578 -13.843 1.00 0.00 C ATOM 486 O PHE F 31 -1.993 2.255 -14.442 1.00 0.00 O ATOM 487 CB PHE F 31 -2.377 4.087 -12.442 1.00 0.00 C ATOM 488 CG PHE F 31 -2.455 5.431 -11.757 1.00 0.00 C ATOM 489 CD1 PHE F 31 -2.611 6.599 -12.513 1.00 0.00 C ATOM 490 CD2 PHE F 31 -2.379 5.508 -10.362 1.00 0.00 C ATOM 491 CE1 PHE F 31 -2.690 7.842 -11.874 1.00 0.00 C ATOM 492 CE2 PHE F 31 -2.459 6.751 -9.722 1.00 0.00 C ATOM 493 CZ PHE F 31 -2.614 7.919 -10.478 1.00 0.00 C ATOM 0 H PHE F 31 -0.704 4.900 -14.811 1.00 0.00 H new ATOM 0 HA PHE F 31 -0.269 3.720 -12.149 1.00 0.00 H new ATOM 0 HB2 PHE F 31 -3.096 4.047 -13.260 1.00 0.00 H new ATOM 0 HB3 PHE F 31 -2.648 3.298 -11.740 1.00 0.00 H new ATOM 0 HD1 PHE F 31 -2.670 6.541 -13.590 1.00 0.00 H new ATOM 0 HD2 PHE F 31 -2.258 4.608 -9.778 1.00 0.00 H new ATOM 0 HE1 PHE F 31 -2.810 8.742 -12.458 1.00 0.00 H new ATOM 0 HE2 PHE F 31 -2.401 6.809 -8.645 1.00 0.00 H new ATOM 0 HZ PHE F 31 -2.675 8.878 -9.985 1.00 0.00 H new ATOM 503 N LEU F 32 0.100 1.861 -13.923 1.00 0.00 N ATOM 504 CA LEU F 32 0.101 0.629 -14.763 1.00 0.00 C ATOM 505 C LEU F 32 -0.147 -0.601 -13.878 1.00 0.00 C ATOM 506 O LEU F 32 -0.133 -0.521 -12.667 1.00 0.00 O ATOM 507 CB LEU F 32 1.445 0.519 -15.515 1.00 0.00 C ATOM 508 CG LEU F 32 2.376 -0.503 -14.850 1.00 0.00 C ATOM 509 CD1 LEU F 32 3.727 -0.504 -15.565 1.00 0.00 C ATOM 510 CD2 LEU F 32 2.577 -0.129 -13.384 1.00 0.00 C ATOM 0 H LEU F 32 0.979 2.071 -13.449 1.00 0.00 H new ATOM 0 HA LEU F 32 -0.700 0.681 -15.501 1.00 0.00 H new ATOM 0 HB2 LEU F 32 1.262 0.228 -16.549 1.00 0.00 H new ATOM 0 HB3 LEU F 32 1.931 1.494 -15.539 1.00 0.00 H new ATOM 0 HG LEU F 32 1.930 -1.496 -14.915 1.00 0.00 H new ATOM 0 HD11 LEU F 32 4.388 -1.230 -15.092 1.00 0.00 H new ATOM 0 HD12 LEU F 32 3.584 -0.771 -16.612 1.00 0.00 H new ATOM 0 HD13 LEU F 32 4.173 0.488 -15.501 1.00 0.00 H new ATOM 0 HD21 LEU F 32 3.238 -0.855 -12.911 1.00 0.00 H new ATOM 0 HD22 LEU F 32 3.022 0.864 -13.320 1.00 0.00 H new ATOM 0 HD23 LEU F 32 1.614 -0.129 -12.873 1.00 0.00 H new ATOM 522 N ILE F 33 -0.372 -1.735 -14.482 1.00 0.00 N ATOM 523 CA ILE F 33 -0.619 -2.976 -13.689 1.00 0.00 C ATOM 524 C ILE F 33 0.501 -3.977 -13.990 1.00 0.00 C ATOM 525 O ILE F 33 1.316 -3.761 -14.863 1.00 0.00 O ATOM 526 CB ILE F 33 -2.000 -3.561 -14.060 1.00 0.00 C ATOM 527 CG1 ILE F 33 -3.081 -2.843 -13.249 1.00 0.00 C ATOM 528 CG2 ILE F 33 -2.066 -5.064 -13.765 1.00 0.00 C ATOM 529 CD1 ILE F 33 -4.461 -3.330 -13.696 1.00 0.00 C ATOM 0 H ILE F 33 -0.396 -1.858 -15.494 1.00 0.00 H new ATOM 0 HA ILE F 33 -0.622 -2.754 -12.622 1.00 0.00 H new ATOM 0 HB ILE F 33 -2.160 -3.414 -15.128 1.00 0.00 H new ATOM 0 HG12 ILE F 33 -2.942 -3.037 -12.185 1.00 0.00 H new ATOM 0 HG13 ILE F 33 -3.001 -1.765 -13.390 1.00 0.00 H new ATOM 0 HG21 ILE F 33 -3.050 -5.445 -14.037 1.00 0.00 H new ATOM 0 HG22 ILE F 33 -1.303 -5.583 -14.345 1.00 0.00 H new ATOM 0 HG23 ILE F 33 -1.892 -5.234 -12.703 1.00 0.00 H new ATOM 0 HD11 ILE F 33 -5.232 -2.819 -13.119 1.00 0.00 H new ATOM 0 HD12 ILE F 33 -4.598 -3.113 -14.755 1.00 0.00 H new ATOM 0 HD13 ILE F 33 -4.538 -4.405 -13.533 1.00 0.00 H new ATOM 541 N ARG F 34 0.556 -5.060 -13.272 1.00 0.00 N ATOM 542 CA ARG F 34 1.635 -6.060 -13.518 1.00 0.00 C ATOM 543 C ARG F 34 1.505 -7.213 -12.523 1.00 0.00 C ATOM 544 O ARG F 34 1.038 -7.043 -11.415 1.00 0.00 O ATOM 545 CB ARG F 34 2.998 -5.391 -13.343 1.00 0.00 C ATOM 546 CG ARG F 34 3.012 -4.589 -12.042 1.00 0.00 C ATOM 547 CD ARG F 34 4.324 -3.809 -11.943 1.00 0.00 C ATOM 548 NE ARG F 34 4.556 -3.399 -10.529 1.00 0.00 N ATOM 549 CZ ARG F 34 4.603 -4.300 -9.586 1.00 0.00 C ATOM 550 NH1 ARG F 34 4.665 -5.567 -9.892 1.00 0.00 N ATOM 551 NH2 ARG F 34 4.590 -3.933 -8.333 1.00 0.00 N ATOM 0 H ARG F 34 -0.097 -5.299 -12.526 1.00 0.00 H new ATOM 0 HA ARG F 34 1.544 -6.446 -14.533 1.00 0.00 H new ATOM 0 HB2 ARG F 34 3.785 -6.145 -13.326 1.00 0.00 H new ATOM 0 HB3 ARG F 34 3.204 -4.735 -14.189 1.00 0.00 H new ATOM 0 HG2 ARG F 34 2.165 -3.903 -12.015 1.00 0.00 H new ATOM 0 HG3 ARG F 34 2.908 -5.258 -11.188 1.00 0.00 H new ATOM 0 HD2 ARG F 34 5.152 -4.424 -12.294 1.00 0.00 H new ATOM 0 HD3 ARG F 34 4.285 -2.929 -12.586 1.00 0.00 H new ATOM 0 HE ARG F 34 4.678 -2.413 -10.298 1.00 0.00 H new ATOM 0 HH11 ARG F 34 4.677 -5.855 -10.870 1.00 0.00 H new ATOM 0 HH12 ARG F 34 4.702 -6.269 -9.153 1.00 0.00 H new ATOM 0 HH21 ARG F 34 4.543 -2.943 -8.092 1.00 0.00 H new ATOM 0 HH22 ARG F 34 4.627 -4.636 -7.595 1.00 0.00 H new ATOM 565 N GLU F 35 1.909 -8.386 -12.918 1.00 0.00 N ATOM 566 CA GLU F 35 1.802 -9.562 -12.010 1.00 0.00 C ATOM 567 C GLU F 35 2.711 -9.382 -10.784 1.00 0.00 C ATOM 568 O GLU F 35 3.877 -9.063 -10.905 1.00 0.00 O ATOM 569 CB GLU F 35 2.200 -10.828 -12.791 1.00 0.00 C ATOM 570 CG GLU F 35 3.706 -11.096 -12.666 1.00 0.00 C ATOM 571 CD GLU F 35 4.034 -12.452 -13.292 1.00 0.00 C ATOM 572 OE1 GLU F 35 3.105 -13.174 -13.615 1.00 0.00 O ATOM 573 OE2 GLU F 35 5.209 -12.747 -13.436 1.00 0.00 O ATOM 0 H GLU F 35 2.311 -8.583 -13.835 1.00 0.00 H new ATOM 0 HA GLU F 35 0.776 -9.656 -11.655 1.00 0.00 H new ATOM 0 HB2 GLU F 35 1.641 -11.684 -12.413 1.00 0.00 H new ATOM 0 HB3 GLU F 35 1.933 -10.712 -13.841 1.00 0.00 H new ATOM 0 HG2 GLU F 35 4.270 -10.307 -13.164 1.00 0.00 H new ATOM 0 HG3 GLU F 35 4.003 -11.086 -11.617 1.00 0.00 H new ATOM 580 N SER F 36 2.187 -9.602 -9.608 1.00 0.00 N ATOM 581 CA SER F 36 3.013 -9.465 -8.380 1.00 0.00 C ATOM 582 C SER F 36 3.995 -10.630 -8.291 1.00 0.00 C ATOM 583 O SER F 36 3.853 -11.635 -8.958 1.00 0.00 O ATOM 584 CB SER F 36 2.109 -9.510 -7.147 1.00 0.00 C ATOM 585 OG SER F 36 1.248 -8.384 -7.138 1.00 0.00 O ATOM 0 H SER F 36 1.217 -9.872 -9.447 1.00 0.00 H new ATOM 0 HA SER F 36 3.552 -8.518 -8.421 1.00 0.00 H new ATOM 0 HB2 SER F 36 1.521 -10.428 -7.150 1.00 0.00 H new ATOM 0 HB3 SER F 36 2.715 -9.522 -6.241 1.00 0.00 H new ATOM 0 HG SER F 36 0.410 -8.610 -7.593 1.00 0.00 H new ATOM 591 N GLU F 37 4.975 -10.507 -7.445 1.00 0.00 N ATOM 592 CA GLU F 37 5.958 -11.608 -7.269 1.00 0.00 C ATOM 593 C GLU F 37 5.983 -11.993 -5.793 1.00 0.00 C ATOM 594 O GLU F 37 6.881 -12.665 -5.325 1.00 0.00 O ATOM 595 CB GLU F 37 7.341 -11.124 -7.675 1.00 0.00 C ATOM 596 CG GLU F 37 7.404 -10.957 -9.195 1.00 0.00 C ATOM 597 CD GLU F 37 7.450 -12.334 -9.858 1.00 0.00 C ATOM 598 OE1 GLU F 37 6.428 -13.002 -9.863 1.00 0.00 O ATOM 599 OE2 GLU F 37 8.505 -12.698 -10.350 1.00 0.00 O ATOM 0 H GLU F 37 5.139 -9.685 -6.863 1.00 0.00 H new ATOM 0 HA GLU F 37 5.678 -12.462 -7.885 1.00 0.00 H new ATOM 0 HB2 GLU F 37 7.563 -10.176 -7.186 1.00 0.00 H new ATOM 0 HB3 GLU F 37 8.097 -11.837 -7.346 1.00 0.00 H new ATOM 0 HG2 GLU F 37 6.535 -10.401 -9.547 1.00 0.00 H new ATOM 0 HG3 GLU F 37 8.286 -10.379 -9.472 1.00 0.00 H new ATOM 606 N THR F 38 5.000 -11.559 -5.059 1.00 0.00 N ATOM 607 CA THR F 38 4.946 -11.874 -3.608 1.00 0.00 C ATOM 608 C THR F 38 4.227 -13.202 -3.415 1.00 0.00 C ATOM 609 O THR F 38 4.598 -14.016 -2.594 1.00 0.00 O ATOM 610 CB THR F 38 4.184 -10.758 -2.882 1.00 0.00 C ATOM 611 OG1 THR F 38 4.559 -10.743 -1.512 1.00 0.00 O ATOM 612 CG2 THR F 38 2.671 -10.981 -2.998 1.00 0.00 C ATOM 0 H THR F 38 4.225 -10.994 -5.406 1.00 0.00 H new ATOM 0 HA THR F 38 5.954 -11.947 -3.201 1.00 0.00 H new ATOM 0 HB THR F 38 4.434 -9.802 -3.343 1.00 0.00 H new ATOM 0 HG1 THR F 38 4.074 -10.029 -1.048 1.00 0.00 H new ATOM 0 HG21 THR F 38 2.144 -10.181 -2.478 1.00 0.00 H new ATOM 0 HG22 THR F 38 2.383 -10.982 -4.049 1.00 0.00 H new ATOM 0 HG23 THR F 38 2.409 -11.939 -2.549 1.00 0.00 H new ATOM 620 N THR F 39 3.191 -13.415 -4.168 1.00 0.00 N ATOM 621 CA THR F 39 2.430 -14.689 -4.028 1.00 0.00 C ATOM 622 C THR F 39 2.656 -15.566 -5.262 1.00 0.00 C ATOM 623 O THR F 39 3.455 -15.250 -6.120 1.00 0.00 O ATOM 624 CB THR F 39 0.936 -14.376 -3.864 1.00 0.00 C ATOM 625 OG1 THR F 39 0.289 -15.478 -3.244 1.00 0.00 O ATOM 626 CG2 THR F 39 0.296 -14.111 -5.229 1.00 0.00 C ATOM 0 H THR F 39 2.836 -12.768 -4.872 1.00 0.00 H new ATOM 0 HA THR F 39 2.780 -15.228 -3.147 1.00 0.00 H new ATOM 0 HB THR F 39 0.826 -13.486 -3.244 1.00 0.00 H new ATOM 0 HG1 THR F 39 -0.665 -15.279 -3.137 1.00 0.00 H new ATOM 0 HG21 THR F 39 -0.763 -13.890 -5.098 1.00 0.00 H new ATOM 0 HG22 THR F 39 0.788 -13.261 -5.702 1.00 0.00 H new ATOM 0 HG23 THR F 39 0.407 -14.992 -5.860 1.00 0.00 H new ATOM 634 N LYS F 40 1.956 -16.665 -5.354 1.00 0.00 N ATOM 635 CA LYS F 40 2.124 -17.562 -6.529 1.00 0.00 C ATOM 636 C LYS F 40 2.187 -16.709 -7.791 1.00 0.00 C ATOM 637 O LYS F 40 2.924 -16.990 -8.715 1.00 0.00 O ATOM 638 CB LYS F 40 0.931 -18.511 -6.618 1.00 0.00 C ATOM 639 CG LYS F 40 0.568 -19.011 -5.221 1.00 0.00 C ATOM 640 CD LYS F 40 -0.293 -20.271 -5.336 1.00 0.00 C ATOM 641 CE LYS F 40 -1.590 -20.074 -4.548 1.00 0.00 C ATOM 642 NZ LYS F 40 -1.968 -21.354 -3.885 1.00 0.00 N ATOM 0 H LYS F 40 1.274 -16.979 -4.663 1.00 0.00 H new ATOM 0 HA LYS F 40 3.040 -18.143 -6.426 1.00 0.00 H new ATOM 0 HB2 LYS F 40 0.079 -17.999 -7.065 1.00 0.00 H new ATOM 0 HB3 LYS F 40 1.172 -19.354 -7.266 1.00 0.00 H new ATOM 0 HG2 LYS F 40 1.474 -19.227 -4.654 1.00 0.00 H new ATOM 0 HG3 LYS F 40 0.028 -18.237 -4.676 1.00 0.00 H new ATOM 0 HD2 LYS F 40 -0.518 -20.477 -6.382 1.00 0.00 H new ATOM 0 HD3 LYS F 40 0.252 -21.133 -4.952 1.00 0.00 H new ATOM 0 HE2 LYS F 40 -1.459 -19.290 -3.802 1.00 0.00 H new ATOM 0 HE3 LYS F 40 -2.388 -19.748 -5.216 1.00 0.00 H new ATOM 0 HZ1 LYS F 40 -2.849 -21.220 -3.349 1.00 0.00 H new ATOM 0 HZ2 LYS F 40 -2.109 -22.090 -4.606 1.00 0.00 H new ATOM 0 HZ3 LYS F 40 -1.210 -21.646 -3.236 1.00 0.00 H new ATOM 656 N GLY F 41 1.415 -15.663 -7.825 1.00 0.00 N ATOM 657 CA GLY F 41 1.416 -14.771 -9.010 1.00 0.00 C ATOM 658 C GLY F 41 0.132 -13.942 -9.023 1.00 0.00 C ATOM 659 O GLY F 41 -0.746 -14.143 -9.839 1.00 0.00 O ATOM 0 H GLY F 41 0.779 -15.387 -7.077 1.00 0.00 H new ATOM 0 HA2 GLY F 41 2.286 -14.114 -8.984 1.00 0.00 H new ATOM 0 HA3 GLY F 41 1.490 -15.361 -9.923 1.00 0.00 H new ATOM 663 N ALA F 42 0.029 -12.999 -8.132 1.00 0.00 N ATOM 664 CA ALA F 42 -1.175 -12.130 -8.084 1.00 0.00 C ATOM 665 C ALA F 42 -0.998 -11.037 -9.120 1.00 0.00 C ATOM 666 O ALA F 42 -0.213 -11.168 -10.037 1.00 0.00 O ATOM 667 CB ALA F 42 -1.283 -11.507 -6.689 1.00 0.00 C ATOM 0 H ALA F 42 0.736 -12.791 -7.427 1.00 0.00 H new ATOM 0 HA ALA F 42 -2.079 -12.703 -8.290 1.00 0.00 H new ATOM 0 HB1 ALA F 42 -2.164 -10.867 -6.644 1.00 0.00 H new ATOM 0 HB2 ALA F 42 -1.370 -12.297 -5.943 1.00 0.00 H new ATOM 0 HB3 ALA F 42 -0.392 -10.913 -6.486 1.00 0.00 H new ATOM 673 N TYR F 43 -1.699 -9.956 -8.991 1.00 0.00 N ATOM 674 CA TYR F 43 -1.519 -8.864 -9.977 1.00 0.00 C ATOM 675 C TYR F 43 -1.065 -7.606 -9.253 1.00 0.00 C ATOM 676 O TYR F 43 -0.729 -7.646 -8.087 1.00 0.00 O ATOM 677 CB TYR F 43 -2.809 -8.596 -10.737 1.00 0.00 C ATOM 678 CG TYR F 43 -2.548 -8.846 -12.198 1.00 0.00 C ATOM 679 CD1 TYR F 43 -1.447 -8.240 -12.824 1.00 0.00 C ATOM 680 CD2 TYR F 43 -3.391 -9.694 -12.924 1.00 0.00 C ATOM 681 CE1 TYR F 43 -1.198 -8.485 -14.180 1.00 0.00 C ATOM 682 CE2 TYR F 43 -3.138 -9.940 -14.276 1.00 0.00 C ATOM 683 CZ TYR F 43 -2.043 -9.336 -14.905 1.00 0.00 C ATOM 684 OH TYR F 43 -1.796 -9.586 -16.238 1.00 0.00 O ATOM 0 H TYR F 43 -2.382 -9.780 -8.255 1.00 0.00 H new ATOM 0 HA TYR F 43 -0.762 -9.165 -10.701 1.00 0.00 H new ATOM 0 HB2 TYR F 43 -3.606 -9.246 -10.376 1.00 0.00 H new ATOM 0 HB3 TYR F 43 -3.138 -7.569 -10.579 1.00 0.00 H new ATOM 0 HD1 TYR F 43 -0.795 -7.588 -12.262 1.00 0.00 H new ATOM 0 HD2 TYR F 43 -4.237 -10.158 -12.440 1.00 0.00 H new ATOM 0 HE1 TYR F 43 -0.355 -8.018 -14.667 1.00 0.00 H new ATOM 0 HE2 TYR F 43 -3.788 -10.596 -14.836 1.00 0.00 H new ATOM 0 HH TYR F 43 -1.918 -8.761 -16.753 1.00 0.00 H new ATOM 694 N SER F 44 -1.012 -6.492 -9.930 1.00 0.00 N ATOM 695 CA SER F 44 -0.536 -5.261 -9.254 1.00 0.00 C ATOM 696 C SER F 44 -0.924 -4.000 -10.026 1.00 0.00 C ATOM 697 O SER F 44 -1.294 -4.049 -11.178 1.00 0.00 O ATOM 698 CB SER F 44 0.970 -5.344 -9.161 1.00 0.00 C ATOM 699 OG SER F 44 1.343 -6.580 -8.576 1.00 0.00 O ATOM 0 H SER F 44 -1.275 -6.384 -10.910 1.00 0.00 H new ATOM 0 HA SER F 44 -0.998 -5.195 -8.269 1.00 0.00 H new ATOM 0 HB2 SER F 44 1.411 -5.252 -10.153 1.00 0.00 H new ATOM 0 HB3 SER F 44 1.354 -4.517 -8.564 1.00 0.00 H new ATOM 0 HG SER F 44 0.725 -6.797 -7.847 1.00 0.00 H new ATOM 705 N LEU F 45 -0.810 -2.864 -9.391 1.00 0.00 N ATOM 706 CA LEU F 45 -1.138 -1.579 -10.078 1.00 0.00 C ATOM 707 C LEU F 45 -0.125 -0.512 -9.651 1.00 0.00 C ATOM 708 O LEU F 45 -0.342 0.223 -8.709 1.00 0.00 O ATOM 709 CB LEU F 45 -2.552 -1.118 -9.707 1.00 0.00 C ATOM 710 CG LEU F 45 -2.743 0.355 -10.102 1.00 0.00 C ATOM 711 CD1 LEU F 45 -2.079 0.629 -11.455 1.00 0.00 C ATOM 712 CD2 LEU F 45 -4.235 0.665 -10.210 1.00 0.00 C ATOM 0 H LEU F 45 -0.503 -2.770 -8.423 1.00 0.00 H new ATOM 0 HA LEU F 45 -1.092 -1.730 -11.157 1.00 0.00 H new ATOM 0 HB2 LEU F 45 -3.291 -1.738 -10.214 1.00 0.00 H new ATOM 0 HB3 LEU F 45 -2.714 -1.240 -8.636 1.00 0.00 H new ATOM 0 HG LEU F 45 -2.285 0.985 -9.340 1.00 0.00 H new ATOM 0 HD11 LEU F 45 -2.221 1.676 -11.725 1.00 0.00 H new ATOM 0 HD12 LEU F 45 -1.013 0.413 -11.387 1.00 0.00 H new ATOM 0 HD13 LEU F 45 -2.530 -0.006 -12.217 1.00 0.00 H new ATOM 0 HD21 LEU F 45 -4.370 1.710 -10.490 1.00 0.00 H new ATOM 0 HD22 LEU F 45 -4.686 0.025 -10.968 1.00 0.00 H new ATOM 0 HD23 LEU F 45 -4.715 0.482 -9.249 1.00 0.00 H new ATOM 724 N SER F 46 0.979 -0.424 -10.340 1.00 0.00 N ATOM 725 CA SER F 46 2.009 0.592 -9.980 1.00 0.00 C ATOM 726 C SER F 46 1.539 1.976 -10.422 1.00 0.00 C ATOM 727 O SER F 46 0.771 2.109 -11.351 1.00 0.00 O ATOM 728 CB SER F 46 3.328 0.258 -10.676 1.00 0.00 C ATOM 729 OG SER F 46 3.300 -1.090 -11.122 1.00 0.00 O ATOM 0 H SER F 46 1.213 -1.013 -11.139 1.00 0.00 H new ATOM 0 HA SER F 46 2.157 0.585 -8.900 1.00 0.00 H new ATOM 0 HB2 SER F 46 3.486 0.929 -11.521 1.00 0.00 H new ATOM 0 HB3 SER F 46 4.162 0.408 -9.990 1.00 0.00 H new ATOM 0 HG SER F 46 2.975 -1.667 -10.400 1.00 0.00 H new ATOM 735 N ILE F 47 1.993 3.007 -9.763 1.00 0.00 N ATOM 736 CA ILE F 47 1.565 4.383 -10.151 1.00 0.00 C ATOM 737 C ILE F 47 2.771 5.331 -10.121 1.00 0.00 C ATOM 738 O ILE F 47 3.567 5.309 -9.206 1.00 0.00 O ATOM 739 CB ILE F 47 0.476 4.873 -9.184 1.00 0.00 C ATOM 740 CG1 ILE F 47 1.107 5.514 -7.940 1.00 0.00 C ATOM 741 CG2 ILE F 47 -0.385 3.686 -8.749 1.00 0.00 C ATOM 742 CD1 ILE F 47 0.008 6.145 -7.081 1.00 0.00 C ATOM 0 H ILE F 47 2.639 2.958 -8.975 1.00 0.00 H new ATOM 0 HA ILE F 47 1.160 4.367 -11.163 1.00 0.00 H new ATOM 0 HB ILE F 47 -0.135 5.617 -9.695 1.00 0.00 H new ATOM 0 HG12 ILE F 47 1.647 4.762 -7.364 1.00 0.00 H new ATOM 0 HG13 ILE F 47 1.833 6.272 -8.236 1.00 0.00 H new ATOM 0 HG21 ILE F 47 -1.159 4.030 -8.063 1.00 0.00 H new ATOM 0 HG22 ILE F 47 -0.851 3.234 -9.625 1.00 0.00 H new ATOM 0 HG23 ILE F 47 0.241 2.947 -8.249 1.00 0.00 H new ATOM 0 HD11 ILE F 47 0.454 6.601 -6.197 1.00 0.00 H new ATOM 0 HD12 ILE F 47 -0.513 6.908 -7.659 1.00 0.00 H new ATOM 0 HD13 ILE F 47 -0.701 5.376 -6.774 1.00 0.00 H new ATOM 754 N ARG F 48 2.903 6.167 -11.113 1.00 0.00 N ATOM 755 CA ARG F 48 4.047 7.123 -11.142 1.00 0.00 C ATOM 756 C ARG F 48 3.766 8.290 -10.193 1.00 0.00 C ATOM 757 O ARG F 48 2.899 9.103 -10.438 1.00 0.00 O ATOM 758 CB ARG F 48 4.221 7.660 -12.563 1.00 0.00 C ATOM 759 CG ARG F 48 5.298 8.745 -12.571 1.00 0.00 C ATOM 760 CD ARG F 48 6.677 8.090 -12.508 1.00 0.00 C ATOM 761 NE ARG F 48 7.550 8.662 -13.572 1.00 0.00 N ATOM 762 CZ ARG F 48 7.570 9.951 -13.776 1.00 0.00 C ATOM 763 NH1 ARG F 48 7.206 10.768 -12.826 1.00 0.00 N ATOM 764 NH2 ARG F 48 7.955 10.423 -14.930 1.00 0.00 N ATOM 0 H ARG F 48 2.266 6.230 -11.907 1.00 0.00 H new ATOM 0 HA ARG F 48 4.956 6.610 -10.827 1.00 0.00 H new ATOM 0 HB2 ARG F 48 4.501 6.850 -13.237 1.00 0.00 H new ATOM 0 HB3 ARG F 48 3.278 8.067 -12.927 1.00 0.00 H new ATOM 0 HG2 ARG F 48 5.212 9.352 -13.472 1.00 0.00 H new ATOM 0 HG3 ARG F 48 5.162 9.415 -11.722 1.00 0.00 H new ATOM 0 HD2 ARG F 48 7.125 8.255 -11.528 1.00 0.00 H new ATOM 0 HD3 ARG F 48 6.585 7.012 -12.639 1.00 0.00 H new ATOM 0 HE ARG F 48 8.132 8.046 -14.140 1.00 0.00 H new ATOM 0 HH11 ARG F 48 6.906 10.399 -11.924 1.00 0.00 H new ATOM 0 HH12 ARG F 48 7.222 11.775 -12.986 1.00 0.00 H new ATOM 0 HH21 ARG F 48 8.240 9.785 -15.673 1.00 0.00 H new ATOM 0 HH22 ARG F 48 7.971 11.430 -15.089 1.00 0.00 H new ATOM 778 N ASP F 49 4.490 8.380 -9.111 1.00 0.00 N ATOM 779 CA ASP F 49 4.255 9.497 -8.152 1.00 0.00 C ATOM 780 C ASP F 49 5.526 10.340 -8.012 1.00 0.00 C ATOM 781 O ASP F 49 6.519 9.902 -7.468 1.00 0.00 O ATOM 782 CB ASP F 49 3.866 8.939 -6.778 1.00 0.00 C ATOM 783 CG ASP F 49 4.239 7.459 -6.678 1.00 0.00 C ATOM 784 OD1 ASP F 49 5.419 7.158 -6.751 1.00 0.00 O ATOM 785 OD2 ASP F 49 3.336 6.654 -6.531 1.00 0.00 O ATOM 0 H ASP F 49 5.232 7.731 -8.850 1.00 0.00 H new ATOM 0 HA ASP F 49 3.444 10.119 -8.532 1.00 0.00 H new ATOM 0 HB2 ASP F 49 4.372 9.502 -5.993 1.00 0.00 H new ATOM 0 HB3 ASP F 49 2.795 9.062 -6.618 1.00 0.00 H new ATOM 790 N TRP F 50 5.491 11.554 -8.488 1.00 0.00 N ATOM 791 CA TRP F 50 6.682 12.444 -8.377 1.00 0.00 C ATOM 792 C TRP F 50 6.345 13.591 -7.412 1.00 0.00 C ATOM 793 O TRP F 50 5.197 13.819 -7.084 1.00 0.00 O ATOM 794 CB TRP F 50 7.033 12.998 -9.768 1.00 0.00 C ATOM 795 CG TRP F 50 7.872 14.226 -9.628 1.00 0.00 C ATOM 796 CD1 TRP F 50 9.208 14.298 -9.808 1.00 0.00 C ATOM 797 CD2 TRP F 50 7.436 15.561 -9.284 1.00 0.00 C ATOM 798 NE1 TRP F 50 9.621 15.598 -9.570 1.00 0.00 N ATOM 799 CE2 TRP F 50 8.558 16.417 -9.254 1.00 0.00 C ATOM 800 CE3 TRP F 50 6.182 16.095 -8.994 1.00 0.00 C ATOM 801 CZ2 TRP F 50 8.431 17.770 -8.946 1.00 0.00 C ATOM 802 CZ3 TRP F 50 6.042 17.454 -8.684 1.00 0.00 C ATOM 803 CH2 TRP F 50 7.167 18.293 -8.661 1.00 0.00 C ATOM 0 H TRP F 50 4.684 11.971 -8.952 1.00 0.00 H new ATOM 0 HA TRP F 50 7.540 11.890 -7.996 1.00 0.00 H new ATOM 0 HB2 TRP F 50 7.569 12.244 -10.345 1.00 0.00 H new ATOM 0 HB3 TRP F 50 6.121 13.231 -10.317 1.00 0.00 H new ATOM 0 HD1 TRP F 50 9.849 13.476 -10.091 1.00 0.00 H new ATOM 0 HE1 TRP F 50 10.591 15.911 -9.622 1.00 0.00 H new ATOM 0 HE3 TRP F 50 5.311 15.456 -9.008 1.00 0.00 H new ATOM 0 HZ2 TRP F 50 9.302 18.409 -8.928 1.00 0.00 H new ATOM 0 HZ3 TRP F 50 5.065 17.857 -8.462 1.00 0.00 H new ATOM 0 HH2 TRP F 50 7.056 19.341 -8.424 1.00 0.00 H new ATOM 814 N ASP F 51 7.333 14.308 -6.952 1.00 0.00 N ATOM 815 CA ASP F 51 7.066 15.430 -6.005 1.00 0.00 C ATOM 816 C ASP F 51 8.074 16.559 -6.244 1.00 0.00 C ATOM 817 O ASP F 51 9.148 16.345 -6.770 1.00 0.00 O ATOM 818 CB ASP F 51 7.197 14.926 -4.566 1.00 0.00 C ATOM 819 CG ASP F 51 6.030 15.457 -3.732 1.00 0.00 C ATOM 820 OD1 ASP F 51 4.935 15.539 -4.265 1.00 0.00 O ATOM 821 OD2 ASP F 51 6.250 15.773 -2.575 1.00 0.00 O ATOM 0 H ASP F 51 8.315 14.166 -7.190 1.00 0.00 H new ATOM 0 HA ASP F 51 6.056 15.807 -6.169 1.00 0.00 H new ATOM 0 HB2 ASP F 51 7.203 13.836 -4.550 1.00 0.00 H new ATOM 0 HB3 ASP F 51 8.144 15.256 -4.138 1.00 0.00 H new ATOM 826 N ASP F 52 7.735 17.761 -5.859 1.00 0.00 N ATOM 827 CA ASP F 52 8.667 18.909 -6.065 1.00 0.00 C ATOM 828 C ASP F 52 9.676 18.982 -4.916 1.00 0.00 C ATOM 829 O ASP F 52 10.078 20.054 -4.505 1.00 0.00 O ATOM 830 CB ASP F 52 7.862 20.212 -6.116 1.00 0.00 C ATOM 831 CG ASP F 52 7.409 20.596 -4.704 1.00 0.00 C ATOM 832 OD1 ASP F 52 6.775 19.774 -4.063 1.00 0.00 O ATOM 833 OD2 ASP F 52 7.704 21.705 -4.290 1.00 0.00 O ATOM 0 H ASP F 52 6.851 17.998 -5.410 1.00 0.00 H new ATOM 0 HA ASP F 52 9.205 18.768 -7.003 1.00 0.00 H new ATOM 0 HB2 ASP F 52 8.470 21.010 -6.543 1.00 0.00 H new ATOM 0 HB3 ASP F 52 6.995 20.090 -6.766 1.00 0.00 H new ATOM 838 N MET F 53 10.096 17.864 -4.394 1.00 0.00 N ATOM 839 CA MET F 53 11.077 17.900 -3.283 1.00 0.00 C ATOM 840 C MET F 53 11.754 16.535 -3.136 1.00 0.00 C ATOM 841 O MET F 53 12.042 16.097 -2.040 1.00 0.00 O ATOM 842 CB MET F 53 10.367 18.268 -1.978 1.00 0.00 C ATOM 843 CG MET F 53 9.046 17.504 -1.872 1.00 0.00 C ATOM 844 SD MET F 53 9.195 16.213 -0.613 1.00 0.00 S ATOM 845 CE MET F 53 9.165 14.798 -1.740 1.00 0.00 C ATOM 0 H MET F 53 9.802 16.933 -4.689 1.00 0.00 H new ATOM 0 HA MET F 53 11.836 18.650 -3.504 1.00 0.00 H new ATOM 0 HB2 MET F 53 11.005 18.029 -1.127 1.00 0.00 H new ATOM 0 HB3 MET F 53 10.180 19.341 -1.945 1.00 0.00 H new ATOM 0 HG2 MET F 53 8.238 18.188 -1.613 1.00 0.00 H new ATOM 0 HG3 MET F 53 8.792 17.060 -2.835 1.00 0.00 H new ATOM 0 HE1 MET F 53 9.831 14.021 -1.366 1.00 0.00 H new ATOM 0 HE2 MET F 53 8.150 14.406 -1.805 1.00 0.00 H new ATOM 0 HE3 MET F 53 9.496 15.114 -2.729 1.00 0.00 H new ATOM 855 N LYS F 54 12.019 15.860 -4.222 1.00 0.00 N ATOM 856 CA LYS F 54 12.681 14.535 -4.118 1.00 0.00 C ATOM 857 C LYS F 54 12.870 13.924 -5.508 1.00 0.00 C ATOM 858 O LYS F 54 13.784 13.156 -5.733 1.00 0.00 O ATOM 859 CB LYS F 54 11.824 13.596 -3.266 1.00 0.00 C ATOM 860 CG LYS F 54 10.579 13.184 -4.056 1.00 0.00 C ATOM 861 CD LYS F 54 10.728 11.734 -4.522 1.00 0.00 C ATOM 862 CE LYS F 54 9.661 10.870 -3.849 1.00 0.00 C ATOM 863 NZ LYS F 54 10.239 10.225 -2.636 1.00 0.00 N ATOM 0 H LYS F 54 11.806 16.169 -5.170 1.00 0.00 H new ATOM 0 HA LYS F 54 13.657 14.668 -3.651 1.00 0.00 H new ATOM 0 HB2 LYS F 54 12.400 12.713 -2.987 1.00 0.00 H new ATOM 0 HB3 LYS F 54 11.533 14.092 -2.340 1.00 0.00 H new ATOM 0 HG2 LYS F 54 9.690 13.288 -3.434 1.00 0.00 H new ATOM 0 HG3 LYS F 54 10.446 13.842 -4.915 1.00 0.00 H new ATOM 0 HD2 LYS F 54 10.627 11.677 -5.606 1.00 0.00 H new ATOM 0 HD3 LYS F 54 11.722 11.362 -4.274 1.00 0.00 H new ATOM 0 HE2 LYS F 54 8.802 11.482 -3.575 1.00 0.00 H new ATOM 0 HE3 LYS F 54 9.302 10.110 -4.543 1.00 0.00 H new ATOM 0 HZ1 LYS F 54 9.843 9.269 -2.529 1.00 0.00 H new ATOM 0 HZ2 LYS F 54 11.272 10.163 -2.735 1.00 0.00 H new ATOM 0 HZ3 LYS F 54 10.005 10.792 -1.796 1.00 0.00 H new ATOM 877 N GLY F 55 12.016 14.240 -6.442 1.00 0.00 N ATOM 878 CA GLY F 55 12.157 13.659 -7.790 1.00 0.00 C ATOM 879 C GLY F 55 10.931 12.807 -8.083 1.00 0.00 C ATOM 880 O GLY F 55 9.935 12.878 -7.392 1.00 0.00 O ATOM 0 H GLY F 55 11.228 14.877 -6.322 1.00 0.00 H new ATOM 0 HA2 GLY F 55 12.255 14.449 -8.534 1.00 0.00 H new ATOM 0 HA3 GLY F 55 13.061 13.053 -7.848 1.00 0.00 H new ATOM 884 N ASP F 56 10.984 12.005 -9.102 1.00 0.00 N ATOM 885 CA ASP F 56 9.809 11.162 -9.430 1.00 0.00 C ATOM 886 C ASP F 56 9.861 9.881 -8.597 1.00 0.00 C ATOM 887 O ASP F 56 10.865 9.565 -7.990 1.00 0.00 O ATOM 888 CB ASP F 56 9.833 10.809 -10.918 1.00 0.00 C ATOM 889 CG ASP F 56 11.264 10.470 -11.344 1.00 0.00 C ATOM 890 OD1 ASP F 56 11.927 9.760 -10.607 1.00 0.00 O ATOM 891 OD2 ASP F 56 11.671 10.928 -12.399 1.00 0.00 O ATOM 0 H ASP F 56 11.787 11.896 -9.721 1.00 0.00 H new ATOM 0 HA ASP F 56 8.892 11.707 -9.205 1.00 0.00 H new ATOM 0 HB2 ASP F 56 9.175 9.962 -11.111 1.00 0.00 H new ATOM 0 HB3 ASP F 56 9.456 11.646 -11.506 1.00 0.00 H new ATOM 896 N HIS F 57 8.792 9.139 -8.567 1.00 0.00 N ATOM 897 CA HIS F 57 8.782 7.879 -7.781 1.00 0.00 C ATOM 898 C HIS F 57 7.706 6.963 -8.348 1.00 0.00 C ATOM 899 O HIS F 57 7.157 7.213 -9.402 1.00 0.00 O ATOM 900 CB HIS F 57 8.474 8.182 -6.315 1.00 0.00 C ATOM 901 CG HIS F 57 9.722 8.007 -5.494 1.00 0.00 C ATOM 902 ND1 HIS F 57 9.697 7.980 -4.109 1.00 0.00 N ATOM 903 CD2 HIS F 57 11.039 7.848 -5.850 1.00 0.00 C ATOM 904 CE1 HIS F 57 10.963 7.809 -3.685 1.00 0.00 C ATOM 905 NE2 HIS F 57 11.821 7.722 -4.705 1.00 0.00 N ATOM 0 H HIS F 57 7.922 9.352 -9.055 1.00 0.00 H new ATOM 0 HA HIS F 57 9.758 7.397 -7.843 1.00 0.00 H new ATOM 0 HB2 HIS F 57 8.099 9.201 -6.214 1.00 0.00 H new ATOM 0 HB3 HIS F 57 7.691 7.517 -5.952 1.00 0.00 H new ATOM 0 HD2 HIS F 57 11.411 7.824 -6.864 1.00 0.00 H new ATOM 0 HE1 HIS F 57 11.250 7.749 -2.646 1.00 0.00 H new ATOM 0 HE2 HIS F 57 12.831 7.591 -4.656 1.00 0.00 H new ATOM 913 N VAL F 58 7.401 5.903 -7.664 1.00 0.00 N ATOM 914 CA VAL F 58 6.366 4.971 -8.168 1.00 0.00 C ATOM 915 C VAL F 58 5.849 4.103 -7.016 1.00 0.00 C ATOM 916 O VAL F 58 6.580 3.334 -6.424 1.00 0.00 O ATOM 917 CB VAL F 58 6.989 4.107 -9.275 1.00 0.00 C ATOM 918 CG1 VAL F 58 6.466 2.665 -9.215 1.00 0.00 C ATOM 919 CG2 VAL F 58 6.626 4.705 -10.627 1.00 0.00 C ATOM 0 H VAL F 58 7.826 5.641 -6.774 1.00 0.00 H new ATOM 0 HA VAL F 58 5.520 5.522 -8.578 1.00 0.00 H new ATOM 0 HB VAL F 58 8.070 4.090 -9.134 1.00 0.00 H new ATOM 0 HG11 VAL F 58 6.925 2.078 -10.011 1.00 0.00 H new ATOM 0 HG12 VAL F 58 6.718 2.227 -8.249 1.00 0.00 H new ATOM 0 HG13 VAL F 58 5.383 2.665 -9.342 1.00 0.00 H new ATOM 0 HG21 VAL F 58 7.063 4.100 -11.422 1.00 0.00 H new ATOM 0 HG22 VAL F 58 5.542 4.722 -10.738 1.00 0.00 H new ATOM 0 HG23 VAL F 58 7.013 5.722 -10.691 1.00 0.00 H new ATOM 929 N LYS F 59 4.586 4.205 -6.722 1.00 0.00 N ATOM 930 CA LYS F 59 4.000 3.372 -5.637 1.00 0.00 C ATOM 931 C LYS F 59 3.378 2.142 -6.284 1.00 0.00 C ATOM 932 O LYS F 59 3.574 1.890 -7.456 1.00 0.00 O ATOM 933 CB LYS F 59 2.923 4.171 -4.898 1.00 0.00 C ATOM 934 CG LYS F 59 2.953 3.814 -3.411 1.00 0.00 C ATOM 935 CD LYS F 59 2.210 4.888 -2.613 1.00 0.00 C ATOM 936 CE LYS F 59 3.041 6.174 -2.592 1.00 0.00 C ATOM 937 NZ LYS F 59 2.224 7.283 -2.022 1.00 0.00 N ATOM 0 H LYS F 59 3.930 4.832 -7.188 1.00 0.00 H new ATOM 0 HA LYS F 59 4.767 3.080 -4.920 1.00 0.00 H new ATOM 0 HB2 LYS F 59 3.093 5.240 -5.030 1.00 0.00 H new ATOM 0 HB3 LYS F 59 1.941 3.951 -5.316 1.00 0.00 H new ATOM 0 HG2 LYS F 59 2.489 2.841 -3.250 1.00 0.00 H new ATOM 0 HG3 LYS F 59 3.984 3.737 -3.065 1.00 0.00 H new ATOM 0 HD2 LYS F 59 1.235 5.080 -3.061 1.00 0.00 H new ATOM 0 HD3 LYS F 59 2.031 4.541 -1.595 1.00 0.00 H new ATOM 0 HE2 LYS F 59 3.942 6.028 -1.996 1.00 0.00 H new ATOM 0 HE3 LYS F 59 3.364 6.428 -3.602 1.00 0.00 H new ATOM 0 HZ1 LYS F 59 2.787 8.157 -2.007 1.00 0.00 H new ATOM 0 HZ2 LYS F 59 1.377 7.427 -2.608 1.00 0.00 H new ATOM 0 HZ3 LYS F 59 1.937 7.040 -1.052 1.00 0.00 H new ATOM 951 N HIS F 60 2.633 1.366 -5.556 1.00 0.00 N ATOM 952 CA HIS F 60 2.024 0.166 -6.188 1.00 0.00 C ATOM 953 C HIS F 60 0.794 -0.295 -5.416 1.00 0.00 C ATOM 954 O HIS F 60 0.682 -0.117 -4.219 1.00 0.00 O ATOM 955 CB HIS F 60 3.037 -0.975 -6.238 1.00 0.00 C ATOM 956 CG HIS F 60 4.385 -0.447 -6.646 1.00 0.00 C ATOM 957 ND1 HIS F 60 4.855 -0.553 -7.946 1.00 0.00 N ATOM 958 CD2 HIS F 60 5.375 0.192 -5.940 1.00 0.00 C ATOM 959 CE1 HIS F 60 6.077 0.008 -7.983 1.00 0.00 C ATOM 960 NE2 HIS F 60 6.443 0.478 -6.787 1.00 0.00 N ATOM 0 H HIS F 60 2.421 1.505 -4.568 1.00 0.00 H new ATOM 0 HA HIS F 60 1.725 0.439 -7.200 1.00 0.00 H new ATOM 0 HB2 HIS F 60 3.105 -1.455 -5.262 1.00 0.00 H new ATOM 0 HB3 HIS F 60 2.706 -1.736 -6.945 1.00 0.00 H new ATOM 0 HD2 HIS F 60 5.332 0.435 -4.889 1.00 0.00 H new ATOM 0 HE1 HIS F 60 6.688 0.071 -8.871 1.00 0.00 H new ATOM 0 HE2 HIS F 60 7.317 0.946 -6.546 1.00 0.00 H new ATOM 968 N TYR F 61 -0.115 -0.909 -6.112 1.00 0.00 N ATOM 969 CA TYR F 61 -1.351 -1.426 -5.464 1.00 0.00 C ATOM 970 C TYR F 61 -1.465 -2.915 -5.781 1.00 0.00 C ATOM 971 O TYR F 61 -2.019 -3.306 -6.790 1.00 0.00 O ATOM 972 CB TYR F 61 -2.579 -0.683 -6.008 1.00 0.00 C ATOM 973 CG TYR F 61 -2.889 0.490 -5.108 1.00 0.00 C ATOM 974 CD1 TYR F 61 -3.417 0.271 -3.830 1.00 0.00 C ATOM 975 CD2 TYR F 61 -2.648 1.795 -5.552 1.00 0.00 C ATOM 976 CE1 TYR F 61 -3.701 1.357 -2.995 1.00 0.00 C ATOM 977 CE2 TYR F 61 -2.933 2.882 -4.717 1.00 0.00 C ATOM 978 CZ TYR F 61 -3.460 2.663 -3.438 1.00 0.00 C ATOM 979 OH TYR F 61 -3.740 3.734 -2.615 1.00 0.00 O ATOM 0 H TYR F 61 -0.055 -1.078 -7.116 1.00 0.00 H new ATOM 0 HA TYR F 61 -1.303 -1.271 -4.386 1.00 0.00 H new ATOM 0 HB2 TYR F 61 -2.389 -0.337 -7.024 1.00 0.00 H new ATOM 0 HB3 TYR F 61 -3.435 -1.356 -6.056 1.00 0.00 H new ATOM 0 HD1 TYR F 61 -3.605 -0.736 -3.489 1.00 0.00 H new ATOM 0 HD2 TYR F 61 -2.242 1.964 -6.539 1.00 0.00 H new ATOM 0 HE1 TYR F 61 -4.106 1.188 -2.008 1.00 0.00 H new ATOM 0 HE2 TYR F 61 -2.746 3.889 -5.059 1.00 0.00 H new ATOM 0 HH TYR F 61 -3.135 4.476 -2.826 1.00 0.00 H new ATOM 989 N LYS F 62 -0.933 -3.750 -4.934 1.00 0.00 N ATOM 990 CA LYS F 62 -0.995 -5.211 -5.193 1.00 0.00 C ATOM 991 C LYS F 62 -2.427 -5.593 -5.550 1.00 0.00 C ATOM 992 O LYS F 62 -3.334 -5.475 -4.751 1.00 0.00 O ATOM 993 CB LYS F 62 -0.536 -5.970 -3.947 1.00 0.00 C ATOM 994 CG LYS F 62 -0.393 -7.456 -4.266 1.00 0.00 C ATOM 995 CD LYS F 62 -1.243 -8.273 -3.291 1.00 0.00 C ATOM 996 CE LYS F 62 -0.971 -7.803 -1.860 1.00 0.00 C ATOM 997 NZ LYS F 62 -2.198 -7.170 -1.302 1.00 0.00 N ATOM 0 H LYS F 62 -0.457 -3.482 -4.073 1.00 0.00 H new ATOM 0 HA LYS F 62 -0.338 -5.472 -6.023 1.00 0.00 H new ATOM 0 HB2 LYS F 62 0.416 -5.571 -3.598 1.00 0.00 H new ATOM 0 HB3 LYS F 62 -1.255 -5.830 -3.140 1.00 0.00 H new ATOM 0 HG2 LYS F 62 -0.709 -7.650 -5.291 1.00 0.00 H new ATOM 0 HG3 LYS F 62 0.652 -7.755 -4.192 1.00 0.00 H new ATOM 0 HD2 LYS F 62 -2.300 -8.157 -3.528 1.00 0.00 H new ATOM 0 HD3 LYS F 62 -1.009 -9.333 -3.388 1.00 0.00 H new ATOM 0 HE2 LYS F 62 -0.671 -8.647 -1.240 1.00 0.00 H new ATOM 0 HE3 LYS F 62 -0.146 -7.091 -1.851 1.00 0.00 H new ATOM 0 HZ1 LYS F 62 -1.929 -6.393 -0.665 1.00 0.00 H new ATOM 0 HZ2 LYS F 62 -2.779 -6.795 -2.079 1.00 0.00 H new ATOM 0 HZ3 LYS F 62 -2.744 -7.879 -0.772 1.00 0.00 H new ATOM 1011 N ILE F 63 -2.635 -6.034 -6.756 1.00 0.00 N ATOM 1012 CA ILE F 63 -4.007 -6.407 -7.187 1.00 0.00 C ATOM 1013 C ILE F 63 -4.336 -7.832 -6.734 1.00 0.00 C ATOM 1014 O ILE F 63 -3.533 -8.737 -6.835 1.00 0.00 O ATOM 1015 CB ILE F 63 -4.091 -6.301 -8.711 1.00 0.00 C ATOM 1016 CG1 ILE F 63 -4.422 -4.862 -9.087 1.00 0.00 C ATOM 1017 CG2 ILE F 63 -5.181 -7.229 -9.264 1.00 0.00 C ATOM 1018 CD1 ILE F 63 -3.718 -4.513 -10.390 1.00 0.00 C ATOM 0 H ILE F 63 -1.911 -6.153 -7.465 1.00 0.00 H new ATOM 0 HA ILE F 63 -4.731 -5.731 -6.733 1.00 0.00 H new ATOM 0 HB ILE F 63 -3.133 -6.598 -9.138 1.00 0.00 H new ATOM 0 HG12 ILE F 63 -5.500 -4.741 -9.198 1.00 0.00 H new ATOM 0 HG13 ILE F 63 -4.105 -4.184 -8.295 1.00 0.00 H new ATOM 0 HG21 ILE F 63 -5.222 -7.136 -10.349 1.00 0.00 H new ATOM 0 HG22 ILE F 63 -4.951 -8.260 -8.996 1.00 0.00 H new ATOM 0 HG23 ILE F 63 -6.146 -6.951 -8.840 1.00 0.00 H new ATOM 0 HD11 ILE F 63 -3.951 -3.484 -10.665 1.00 0.00 H new ATOM 0 HD12 ILE F 63 -2.641 -4.620 -10.261 1.00 0.00 H new ATOM 0 HD13 ILE F 63 -4.058 -5.185 -11.178 1.00 0.00 H new ATOM 1030 N ARG F 64 -5.530 -8.026 -6.255 1.00 0.00 N ATOM 1031 CA ARG F 64 -5.963 -9.373 -5.808 1.00 0.00 C ATOM 1032 C ARG F 64 -7.286 -9.693 -6.498 1.00 0.00 C ATOM 1033 O ARG F 64 -8.251 -8.966 -6.371 1.00 0.00 O ATOM 1034 CB ARG F 64 -6.165 -9.375 -4.291 1.00 0.00 C ATOM 1035 CG ARG F 64 -4.852 -9.012 -3.599 1.00 0.00 C ATOM 1036 CD ARG F 64 -3.723 -9.865 -4.175 1.00 0.00 C ATOM 1037 NE ARG F 64 -2.879 -10.383 -3.062 1.00 0.00 N ATOM 1038 CZ ARG F 64 -2.395 -11.594 -3.118 1.00 0.00 C ATOM 1039 NH1 ARG F 64 -3.121 -12.565 -3.599 1.00 0.00 N ATOM 1040 NH2 ARG F 64 -1.186 -11.834 -2.691 1.00 0.00 N ATOM 0 H ARG F 64 -6.234 -7.295 -6.153 1.00 0.00 H new ATOM 0 HA ARG F 64 -5.208 -10.117 -6.062 1.00 0.00 H new ATOM 0 HB2 ARG F 64 -6.942 -8.661 -4.016 1.00 0.00 H new ATOM 0 HB3 ARG F 64 -6.503 -10.357 -3.960 1.00 0.00 H new ATOM 0 HG2 ARG F 64 -4.633 -7.954 -3.742 1.00 0.00 H new ATOM 0 HG3 ARG F 64 -4.936 -9.177 -2.525 1.00 0.00 H new ATOM 0 HD2 ARG F 64 -4.135 -10.694 -4.750 1.00 0.00 H new ATOM 0 HD3 ARG F 64 -3.117 -9.272 -4.860 1.00 0.00 H new ATOM 0 HE ARG F 64 -2.679 -9.791 -2.256 1.00 0.00 H new ATOM 0 HH11 ARG F 64 -4.067 -12.378 -3.931 1.00 0.00 H new ATOM 0 HH12 ARG F 64 -2.743 -13.511 -3.643 1.00 0.00 H new ATOM 0 HH21 ARG F 64 -0.619 -11.075 -2.313 1.00 0.00 H new ATOM 0 HH22 ARG F 64 -0.808 -12.780 -2.735 1.00 0.00 H new ATOM 1054 N LYS F 65 -7.343 -10.763 -7.235 1.00 0.00 N ATOM 1055 CA LYS F 65 -8.606 -11.102 -7.933 1.00 0.00 C ATOM 1056 C LYS F 65 -9.208 -12.347 -7.299 1.00 0.00 C ATOM 1057 O LYS F 65 -8.506 -13.233 -6.853 1.00 0.00 O ATOM 1058 CB LYS F 65 -8.323 -11.358 -9.417 1.00 0.00 C ATOM 1059 CG LYS F 65 -7.484 -12.629 -9.582 1.00 0.00 C ATOM 1060 CD LYS F 65 -6.002 -12.256 -9.643 1.00 0.00 C ATOM 1061 CE LYS F 65 -5.202 -13.193 -8.736 1.00 0.00 C ATOM 1062 NZ LYS F 65 -4.509 -14.217 -9.566 1.00 0.00 N ATOM 0 H LYS F 65 -6.572 -11.414 -7.383 1.00 0.00 H new ATOM 0 HA LYS F 65 -9.308 -10.273 -7.844 1.00 0.00 H new ATOM 0 HB2 LYS F 65 -9.262 -11.459 -9.962 1.00 0.00 H new ATOM 0 HB3 LYS F 65 -7.795 -10.506 -9.847 1.00 0.00 H new ATOM 0 HG2 LYS F 65 -7.665 -13.308 -8.749 1.00 0.00 H new ATOM 0 HG3 LYS F 65 -7.776 -13.155 -10.491 1.00 0.00 H new ATOM 0 HD2 LYS F 65 -5.640 -12.328 -10.669 1.00 0.00 H new ATOM 0 HD3 LYS F 65 -5.863 -11.222 -9.328 1.00 0.00 H new ATOM 0 HE2 LYS F 65 -4.473 -12.623 -8.159 1.00 0.00 H new ATOM 0 HE3 LYS F 65 -5.866 -13.678 -8.021 1.00 0.00 H new ATOM 0 HZ1 LYS F 65 -3.965 -14.854 -8.949 1.00 0.00 H new ATOM 0 HZ2 LYS F 65 -5.213 -14.768 -10.098 1.00 0.00 H new ATOM 0 HZ3 LYS F 65 -3.864 -13.746 -10.232 1.00 0.00 H new ATOM 1076 N LEU F 66 -10.500 -12.425 -7.257 1.00 0.00 N ATOM 1077 CA LEU F 66 -11.133 -13.627 -6.652 1.00 0.00 C ATOM 1078 C LEU F 66 -10.921 -14.812 -7.576 1.00 0.00 C ATOM 1079 O LEU F 66 -10.572 -14.659 -8.730 1.00 0.00 O ATOM 1080 CB LEU F 66 -12.638 -13.411 -6.464 1.00 0.00 C ATOM 1081 CG LEU F 66 -12.900 -12.438 -5.310 1.00 0.00 C ATOM 1082 CD1 LEU F 66 -11.969 -12.741 -4.133 1.00 0.00 C ATOM 1083 CD2 LEU F 66 -12.652 -11.019 -5.799 1.00 0.00 C ATOM 0 H LEU F 66 -11.144 -11.718 -7.611 1.00 0.00 H new ATOM 0 HA LEU F 66 -10.678 -13.811 -5.678 1.00 0.00 H new ATOM 0 HB2 LEU F 66 -13.073 -13.019 -7.384 1.00 0.00 H new ATOM 0 HB3 LEU F 66 -13.126 -14.364 -6.262 1.00 0.00 H new ATOM 0 HG LEU F 66 -13.932 -12.547 -4.975 1.00 0.00 H new ATOM 0 HD11 LEU F 66 -12.168 -12.041 -3.322 1.00 0.00 H new ATOM 0 HD12 LEU F 66 -12.143 -13.759 -3.784 1.00 0.00 H new ATOM 0 HD13 LEU F 66 -10.932 -12.639 -4.454 1.00 0.00 H new ATOM 0 HD21 LEU F 66 -12.835 -10.317 -4.986 1.00 0.00 H new ATOM 0 HD22 LEU F 66 -11.619 -10.925 -6.134 1.00 0.00 H new ATOM 0 HD23 LEU F 66 -13.324 -10.797 -6.628 1.00 0.00 H new ATOM 1095 N ASP F 67 -11.151 -15.993 -7.092 1.00 0.00 N ATOM 1096 CA ASP F 67 -10.997 -17.172 -7.969 1.00 0.00 C ATOM 1097 C ASP F 67 -12.150 -17.145 -8.957 1.00 0.00 C ATOM 1098 O ASP F 67 -12.133 -17.798 -9.981 1.00 0.00 O ATOM 1099 CB ASP F 67 -11.059 -18.446 -7.136 1.00 0.00 C ATOM 1100 CG ASP F 67 -9.705 -19.157 -7.180 1.00 0.00 C ATOM 1101 OD1 ASP F 67 -9.343 -19.633 -8.243 1.00 0.00 O ATOM 1102 OD2 ASP F 67 -9.053 -19.210 -6.150 1.00 0.00 O ATOM 0 H ASP F 67 -11.437 -16.191 -6.133 1.00 0.00 H new ATOM 0 HA ASP F 67 -10.039 -17.150 -8.488 1.00 0.00 H new ATOM 0 HB2 ASP F 67 -11.321 -18.206 -6.106 1.00 0.00 H new ATOM 0 HB3 ASP F 67 -11.839 -19.104 -7.518 1.00 0.00 H new ATOM 1107 N ASN F 68 -13.144 -16.355 -8.660 1.00 0.00 N ATOM 1108 CA ASN F 68 -14.300 -16.234 -9.583 1.00 0.00 C ATOM 1109 C ASN F 68 -14.067 -15.009 -10.465 1.00 0.00 C ATOM 1110 O ASN F 68 -14.804 -14.743 -11.394 1.00 0.00 O ATOM 1111 CB ASN F 68 -15.588 -16.054 -8.777 1.00 0.00 C ATOM 1112 CG ASN F 68 -15.575 -17.000 -7.574 1.00 0.00 C ATOM 1113 OD1 ASN F 68 -15.257 -18.166 -7.707 1.00 0.00 O ATOM 1114 ND2 ASN F 68 -15.906 -16.545 -6.397 1.00 0.00 N ATOM 0 H ASN F 68 -13.203 -15.787 -7.815 1.00 0.00 H new ATOM 0 HA ASN F 68 -14.396 -17.131 -10.194 1.00 0.00 H new ATOM 0 HB2 ASN F 68 -15.677 -15.021 -8.440 1.00 0.00 H new ATOM 0 HB3 ASN F 68 -16.454 -16.260 -9.405 1.00 0.00 H new ATOM 0 HD21 ASN F 68 -15.898 -17.167 -5.589 1.00 0.00 H new ATOM 0 HD22 ASN F 68 -16.173 -15.567 -6.285 1.00 0.00 H new ATOM 1121 N GLY F 69 -13.039 -14.258 -10.168 1.00 0.00 N ATOM 1122 CA GLY F 69 -12.734 -13.049 -10.964 1.00 0.00 C ATOM 1123 C GLY F 69 -12.583 -11.855 -10.021 1.00 0.00 C ATOM 1124 O GLY F 69 -11.487 -11.489 -9.651 1.00 0.00 O ATOM 0 H GLY F 69 -12.395 -14.439 -9.398 1.00 0.00 H new ATOM 0 HA2 GLY F 69 -11.817 -13.196 -11.535 1.00 0.00 H new ATOM 0 HA3 GLY F 69 -13.531 -12.862 -11.684 1.00 0.00 H new ATOM 1128 N GLY F 70 -13.692 -11.271 -9.633 1.00 0.00 N ATOM 1129 CA GLY F 70 -13.696 -10.097 -8.699 1.00 0.00 C ATOM 1130 C GLY F 70 -12.323 -9.418 -8.643 1.00 0.00 C ATOM 1131 O GLY F 70 -11.650 -9.440 -7.638 1.00 0.00 O ATOM 0 H GLY F 70 -14.621 -11.567 -9.933 1.00 0.00 H new ATOM 0 HA2 GLY F 70 -14.447 -9.376 -9.023 1.00 0.00 H new ATOM 0 HA3 GLY F 70 -13.981 -10.427 -7.700 1.00 0.00 H new ATOM 1135 N TYR F 71 -11.897 -8.807 -9.706 1.00 0.00 N ATOM 1136 CA TYR F 71 -10.566 -8.130 -9.669 1.00 0.00 C ATOM 1137 C TYR F 71 -10.660 -6.916 -8.745 1.00 0.00 C ATOM 1138 O TYR F 71 -11.500 -6.059 -8.925 1.00 0.00 O ATOM 1139 CB TYR F 71 -10.179 -7.675 -11.073 1.00 0.00 C ATOM 1140 CG TYR F 71 -9.434 -8.784 -11.769 1.00 0.00 C ATOM 1141 CD1 TYR F 71 -8.068 -8.964 -11.531 1.00 0.00 C ATOM 1142 CD2 TYR F 71 -10.110 -9.629 -12.655 1.00 0.00 C ATOM 1143 CE1 TYR F 71 -7.375 -9.992 -12.184 1.00 0.00 C ATOM 1144 CE2 TYR F 71 -9.419 -10.656 -13.307 1.00 0.00 C ATOM 1145 CZ TYR F 71 -8.051 -10.838 -13.073 1.00 0.00 C ATOM 1146 OH TYR F 71 -7.369 -11.851 -13.716 1.00 0.00 O ATOM 0 H TYR F 71 -12.400 -8.744 -10.591 1.00 0.00 H new ATOM 0 HA TYR F 71 -9.809 -8.822 -9.300 1.00 0.00 H new ATOM 0 HB2 TYR F 71 -11.071 -7.409 -11.640 1.00 0.00 H new ATOM 0 HB3 TYR F 71 -9.557 -6.781 -11.019 1.00 0.00 H new ATOM 0 HD1 TYR F 71 -7.548 -8.312 -10.845 1.00 0.00 H new ATOM 0 HD2 TYR F 71 -11.165 -9.489 -12.836 1.00 0.00 H new ATOM 0 HE1 TYR F 71 -6.320 -10.132 -12.002 1.00 0.00 H new ATOM 0 HE2 TYR F 71 -9.941 -11.309 -13.991 1.00 0.00 H new ATOM 0 HH TYR F 71 -7.986 -12.344 -14.296 1.00 0.00 H new ATOM 1156 N TYR F 72 -9.819 -6.832 -7.751 1.00 0.00 N ATOM 1157 CA TYR F 72 -9.903 -5.668 -6.816 1.00 0.00 C ATOM 1158 C TYR F 72 -8.529 -5.319 -6.235 1.00 0.00 C ATOM 1159 O TYR F 72 -7.848 -6.163 -5.688 1.00 0.00 O ATOM 1160 CB TYR F 72 -10.838 -6.022 -5.649 1.00 0.00 C ATOM 1161 CG TYR F 72 -10.215 -7.102 -4.784 1.00 0.00 C ATOM 1162 CD1 TYR F 72 -9.351 -6.754 -3.738 1.00 0.00 C ATOM 1163 CD2 TYR F 72 -10.499 -8.453 -5.030 1.00 0.00 C ATOM 1164 CE1 TYR F 72 -8.772 -7.747 -2.946 1.00 0.00 C ATOM 1165 CE2 TYR F 72 -9.918 -9.447 -4.236 1.00 0.00 C ATOM 1166 CZ TYR F 72 -9.053 -9.095 -3.194 1.00 0.00 C ATOM 1167 OH TYR F 72 -8.479 -10.076 -2.410 1.00 0.00 O ATOM 0 H TYR F 72 -9.084 -7.509 -7.545 1.00 0.00 H new ATOM 0 HA TYR F 72 -10.280 -4.813 -7.378 1.00 0.00 H new ATOM 0 HB2 TYR F 72 -11.034 -5.134 -5.049 1.00 0.00 H new ATOM 0 HB3 TYR F 72 -11.798 -6.364 -6.034 1.00 0.00 H new ATOM 0 HD1 TYR F 72 -9.132 -5.714 -3.544 1.00 0.00 H new ATOM 0 HD2 TYR F 72 -11.167 -8.726 -5.833 1.00 0.00 H new ATOM 0 HE1 TYR F 72 -8.106 -7.474 -2.141 1.00 0.00 H new ATOM 0 HE2 TYR F 72 -10.137 -10.487 -4.427 1.00 0.00 H new ATOM 0 HH TYR F 72 -8.780 -10.957 -2.716 1.00 0.00 H new ATOM 1177 N ILE F 73 -8.138 -4.071 -6.284 1.00 0.00 N ATOM 1178 CA ILE F 73 -6.843 -3.690 -5.652 1.00 0.00 C ATOM 1179 C ILE F 73 -7.139 -3.598 -4.158 1.00 0.00 C ATOM 1180 O ILE F 73 -6.310 -3.879 -3.314 1.00 0.00 O ATOM 1181 CB ILE F 73 -6.346 -2.333 -6.191 1.00 0.00 C ATOM 1182 CG1 ILE F 73 -5.476 -2.568 -7.426 1.00 0.00 C ATOM 1183 CG2 ILE F 73 -5.522 -1.603 -5.126 1.00 0.00 C ATOM 1184 CD1 ILE F 73 -5.461 -1.304 -8.287 1.00 0.00 C ATOM 0 H ILE F 73 -8.652 -3.310 -6.728 1.00 0.00 H new ATOM 0 HA ILE F 73 -6.059 -4.415 -5.870 1.00 0.00 H new ATOM 0 HB ILE F 73 -7.209 -1.720 -6.452 1.00 0.00 H new ATOM 0 HG12 ILE F 73 -4.461 -2.828 -7.125 1.00 0.00 H new ATOM 0 HG13 ILE F 73 -5.863 -3.409 -8.002 1.00 0.00 H new ATOM 0 HG21 ILE F 73 -5.179 -0.647 -5.523 1.00 0.00 H new ATOM 0 HG22 ILE F 73 -6.139 -1.429 -4.244 1.00 0.00 H new ATOM 0 HG23 ILE F 73 -4.661 -2.212 -4.852 1.00 0.00 H new ATOM 0 HD11 ILE F 73 -4.841 -1.471 -9.168 1.00 0.00 H new ATOM 0 HD12 ILE F 73 -6.477 -1.064 -8.599 1.00 0.00 H new ATOM 0 HD13 ILE F 73 -5.054 -0.475 -7.709 1.00 0.00 H new ATOM 1196 N THR F 74 -8.356 -3.244 -3.847 1.00 0.00 N ATOM 1197 CA THR F 74 -8.798 -3.161 -2.435 1.00 0.00 C ATOM 1198 C THR F 74 -10.053 -4.020 -2.314 1.00 0.00 C ATOM 1199 O THR F 74 -10.857 -4.090 -3.222 1.00 0.00 O ATOM 1200 CB THR F 74 -9.099 -1.710 -2.038 1.00 0.00 C ATOM 1201 OG1 THR F 74 -10.327 -1.652 -1.332 1.00 0.00 O ATOM 1202 CG2 THR F 74 -9.187 -0.823 -3.282 1.00 0.00 C ATOM 0 H THR F 74 -9.074 -3.005 -4.531 1.00 0.00 H new ATOM 0 HA THR F 74 -8.014 -3.516 -1.766 1.00 0.00 H new ATOM 0 HB THR F 74 -8.291 -1.349 -1.401 1.00 0.00 H new ATOM 0 HG1 THR F 74 -10.149 -1.604 -0.370 1.00 0.00 H new ATOM 0 HG21 THR F 74 -9.401 0.203 -2.983 1.00 0.00 H new ATOM 0 HG22 THR F 74 -8.239 -0.854 -3.819 1.00 0.00 H new ATOM 0 HG23 THR F 74 -9.984 -1.185 -3.932 1.00 0.00 H new ATOM 1210 N THR F 75 -10.205 -4.706 -1.226 1.00 0.00 N ATOM 1211 CA THR F 75 -11.387 -5.605 -1.070 1.00 0.00 C ATOM 1212 C THR F 75 -12.690 -4.805 -0.981 1.00 0.00 C ATOM 1213 O THR F 75 -13.761 -5.367 -0.867 1.00 0.00 O ATOM 1214 CB THR F 75 -11.193 -6.449 0.185 1.00 0.00 C ATOM 1215 OG1 THR F 75 -11.192 -5.607 1.329 1.00 0.00 O ATOM 1216 CG2 THR F 75 -9.854 -7.174 0.069 1.00 0.00 C ATOM 0 H THR F 75 -9.565 -4.688 -0.432 1.00 0.00 H new ATOM 0 HA THR F 75 -11.464 -6.249 -1.946 1.00 0.00 H new ATOM 0 HB THR F 75 -12.002 -7.173 0.286 1.00 0.00 H new ATOM 0 HG1 THR F 75 -11.069 -6.151 2.135 1.00 0.00 H new ATOM 0 HG21 THR F 75 -9.693 -7.785 0.957 1.00 0.00 H new ATOM 0 HG22 THR F 75 -9.861 -7.812 -0.814 1.00 0.00 H new ATOM 0 HG23 THR F 75 -9.051 -6.443 -0.019 1.00 0.00 H new ATOM 1224 N ARG F 76 -12.618 -3.509 -1.048 1.00 0.00 N ATOM 1225 CA ARG F 76 -13.857 -2.695 -0.985 1.00 0.00 C ATOM 1226 C ARG F 76 -14.474 -2.603 -2.385 1.00 0.00 C ATOM 1227 O ARG F 76 -15.595 -2.164 -2.546 1.00 0.00 O ATOM 1228 CB ARG F 76 -13.522 -1.290 -0.482 1.00 0.00 C ATOM 1229 CG ARG F 76 -13.975 -1.147 0.973 1.00 0.00 C ATOM 1230 CD ARG F 76 -13.468 0.182 1.538 1.00 0.00 C ATOM 1231 NE ARG F 76 -14.446 1.261 1.221 1.00 0.00 N ATOM 1232 CZ ARG F 76 -15.681 1.163 1.631 1.00 0.00 C ATOM 1233 NH1 ARG F 76 -16.565 0.541 0.899 1.00 0.00 N ATOM 1234 NH2 ARG F 76 -16.032 1.687 2.773 1.00 0.00 N ATOM 0 H ARG F 76 -11.753 -2.977 -1.144 1.00 0.00 H new ATOM 0 HA ARG F 76 -14.566 -3.163 -0.302 1.00 0.00 H new ATOM 0 HB2 ARG F 76 -12.450 -1.111 -0.559 1.00 0.00 H new ATOM 0 HB3 ARG F 76 -14.016 -0.543 -1.103 1.00 0.00 H new ATOM 0 HG2 ARG F 76 -15.063 -1.188 1.032 1.00 0.00 H new ATOM 0 HG3 ARG F 76 -13.592 -1.977 1.567 1.00 0.00 H new ATOM 0 HD2 ARG F 76 -13.334 0.103 2.617 1.00 0.00 H new ATOM 0 HD3 ARG F 76 -12.494 0.423 1.112 1.00 0.00 H new ATOM 0 HE ARG F 76 -14.150 2.076 0.684 1.00 0.00 H new ATOM 0 HH11 ARG F 76 -16.291 0.131 0.006 1.00 0.00 H new ATOM 0 HH12 ARG F 76 -17.530 0.465 1.220 1.00 0.00 H new ATOM 0 HH21 ARG F 76 -15.341 2.173 3.345 1.00 0.00 H new ATOM 0 HH22 ARG F 76 -16.997 1.611 3.094 1.00 0.00 H new ATOM 1248 N ALA F 77 -13.754 -3.007 -3.405 1.00 0.00 N ATOM 1249 CA ALA F 77 -14.328 -2.926 -4.782 1.00 0.00 C ATOM 1250 C ALA F 77 -13.631 -3.912 -5.728 1.00 0.00 C ATOM 1251 O ALA F 77 -12.448 -3.816 -5.987 1.00 0.00 O ATOM 1252 CB ALA F 77 -14.149 -1.505 -5.322 1.00 0.00 C ATOM 0 H ALA F 77 -12.808 -3.384 -3.344 1.00 0.00 H new ATOM 0 HA ALA F 77 -15.386 -3.182 -4.729 1.00 0.00 H new ATOM 0 HB1 ALA F 77 -14.567 -1.442 -6.327 1.00 0.00 H new ATOM 0 HB2 ALA F 77 -14.665 -0.800 -4.670 1.00 0.00 H new ATOM 0 HB3 ALA F 77 -13.088 -1.259 -5.354 1.00 0.00 H new ATOM 1258 N GLN F 78 -14.374 -4.844 -6.267 1.00 0.00 N ATOM 1259 CA GLN F 78 -13.795 -5.827 -7.223 1.00 0.00 C ATOM 1260 C GLN F 78 -14.535 -5.699 -8.557 1.00 0.00 C ATOM 1261 O GLN F 78 -15.517 -4.992 -8.665 1.00 0.00 O ATOM 1262 CB GLN F 78 -13.965 -7.259 -6.696 1.00 0.00 C ATOM 1263 CG GLN F 78 -15.117 -7.316 -5.692 1.00 0.00 C ATOM 1264 CD GLN F 78 -14.617 -6.876 -4.314 1.00 0.00 C ATOM 1265 OE1 GLN F 78 -15.210 -6.024 -3.683 1.00 0.00 O ATOM 1266 NE2 GLN F 78 -13.541 -7.424 -3.819 1.00 0.00 N ATOM 0 H GLN F 78 -15.370 -4.965 -6.081 1.00 0.00 H new ATOM 0 HA GLN F 78 -12.731 -5.623 -7.346 1.00 0.00 H new ATOM 0 HB2 GLN F 78 -14.161 -7.939 -7.525 1.00 0.00 H new ATOM 0 HB3 GLN F 78 -13.042 -7.592 -6.222 1.00 0.00 H new ATOM 0 HG2 GLN F 78 -15.931 -6.668 -6.019 1.00 0.00 H new ATOM 0 HG3 GLN F 78 -15.517 -8.328 -5.639 1.00 0.00 H new ATOM 0 HE21 GLN F 78 -13.043 -8.139 -4.349 1.00 0.00 H new ATOM 0 HE22 GLN F 78 -13.198 -7.137 -2.902 1.00 0.00 H new ATOM 1275 N PHE F 79 -14.078 -6.377 -9.571 1.00 0.00 N ATOM 1276 CA PHE F 79 -14.758 -6.294 -10.893 1.00 0.00 C ATOM 1277 C PHE F 79 -14.717 -7.663 -11.558 1.00 0.00 C ATOM 1278 O PHE F 79 -14.444 -8.659 -10.929 1.00 0.00 O ATOM 1279 CB PHE F 79 -14.046 -5.263 -11.768 1.00 0.00 C ATOM 1280 CG PHE F 79 -14.357 -3.887 -11.238 1.00 0.00 C ATOM 1281 CD1 PHE F 79 -13.781 -3.458 -10.039 1.00 0.00 C ATOM 1282 CD2 PHE F 79 -15.230 -3.047 -11.936 1.00 0.00 C ATOM 1283 CE1 PHE F 79 -14.075 -2.189 -9.536 1.00 0.00 C ATOM 1284 CE2 PHE F 79 -15.527 -1.773 -11.432 1.00 0.00 C ATOM 1285 CZ PHE F 79 -14.949 -1.345 -10.230 1.00 0.00 C ATOM 0 H PHE F 79 -13.261 -6.987 -9.542 1.00 0.00 H new ATOM 0 HA PHE F 79 -15.796 -5.988 -10.760 1.00 0.00 H new ATOM 0 HB2 PHE F 79 -12.970 -5.438 -11.759 1.00 0.00 H new ATOM 0 HB3 PHE F 79 -14.375 -5.353 -12.803 1.00 0.00 H new ATOM 0 HD1 PHE F 79 -13.108 -4.109 -9.501 1.00 0.00 H new ATOM 0 HD2 PHE F 79 -15.675 -3.379 -12.862 1.00 0.00 H new ATOM 0 HE1 PHE F 79 -13.627 -1.859 -8.610 1.00 0.00 H new ATOM 0 HE2 PHE F 79 -16.201 -1.122 -11.970 1.00 0.00 H new ATOM 0 HZ PHE F 79 -15.178 -0.364 -9.839 1.00 0.00 H new ATOM 1295 N GLU F 80 -15.006 -7.736 -12.818 1.00 0.00 N ATOM 1296 CA GLU F 80 -14.991 -9.062 -13.480 1.00 0.00 C ATOM 1297 C GLU F 80 -13.655 -9.292 -14.194 1.00 0.00 C ATOM 1298 O GLU F 80 -13.190 -10.409 -14.298 1.00 0.00 O ATOM 1299 CB GLU F 80 -16.144 -9.135 -14.479 1.00 0.00 C ATOM 1300 CG GLU F 80 -16.103 -7.921 -15.408 1.00 0.00 C ATOM 1301 CD GLU F 80 -16.348 -8.378 -16.848 1.00 0.00 C ATOM 1302 OE1 GLU F 80 -15.873 -9.444 -17.199 1.00 0.00 O ATOM 1303 OE2 GLU F 80 -17.007 -7.652 -17.573 1.00 0.00 O ATOM 0 H GLU F 80 -15.250 -6.946 -13.415 1.00 0.00 H new ATOM 0 HA GLU F 80 -15.111 -9.841 -12.727 1.00 0.00 H new ATOM 0 HB2 GLU F 80 -16.074 -10.053 -15.062 1.00 0.00 H new ATOM 0 HB3 GLU F 80 -17.096 -9.166 -13.948 1.00 0.00 H new ATOM 0 HG2 GLU F 80 -16.860 -7.195 -15.111 1.00 0.00 H new ATOM 0 HG3 GLU F 80 -15.137 -7.423 -15.332 1.00 0.00 H new ATOM 1310 N THR F 81 -13.028 -8.259 -14.686 1.00 0.00 N ATOM 1311 CA THR F 81 -11.723 -8.459 -15.385 1.00 0.00 C ATOM 1312 C THR F 81 -10.794 -7.289 -15.073 1.00 0.00 C ATOM 1313 O THR F 81 -11.147 -6.373 -14.354 1.00 0.00 O ATOM 1314 CB THR F 81 -11.949 -8.545 -16.901 1.00 0.00 C ATOM 1315 OG1 THR F 81 -10.888 -7.892 -17.582 1.00 0.00 O ATOM 1316 CG2 THR F 81 -13.250 -7.854 -17.264 1.00 0.00 C ATOM 0 H THR F 81 -13.356 -7.295 -14.636 1.00 0.00 H new ATOM 0 HA THR F 81 -11.270 -9.388 -15.038 1.00 0.00 H new ATOM 0 HB THR F 81 -11.989 -9.595 -17.191 1.00 0.00 H new ATOM 0 HG1 THR F 81 -11.035 -7.950 -18.549 1.00 0.00 H new ATOM 0 HG21 THR F 81 -13.407 -7.917 -18.341 1.00 0.00 H new ATOM 0 HG22 THR F 81 -14.077 -8.341 -16.747 1.00 0.00 H new ATOM 0 HG23 THR F 81 -13.202 -6.807 -16.965 1.00 0.00 H new ATOM 1324 N LEU F 82 -9.612 -7.307 -15.615 1.00 0.00 N ATOM 1325 CA LEU F 82 -8.664 -6.194 -15.355 1.00 0.00 C ATOM 1326 C LEU F 82 -9.025 -5.029 -16.267 1.00 0.00 C ATOM 1327 O LEU F 82 -8.909 -3.881 -15.900 1.00 0.00 O ATOM 1328 CB LEU F 82 -7.229 -6.652 -15.626 1.00 0.00 C ATOM 1329 CG LEU F 82 -6.760 -7.565 -14.488 1.00 0.00 C ATOM 1330 CD1 LEU F 82 -5.257 -7.816 -14.611 1.00 0.00 C ATOM 1331 CD2 LEU F 82 -7.044 -6.900 -13.140 1.00 0.00 C ATOM 0 H LEU F 82 -9.261 -8.044 -16.227 1.00 0.00 H new ATOM 0 HA LEU F 82 -8.732 -5.883 -14.313 1.00 0.00 H new ATOM 0 HB2 LEU F 82 -7.179 -7.183 -16.577 1.00 0.00 H new ATOM 0 HB3 LEU F 82 -6.570 -5.788 -15.708 1.00 0.00 H new ATOM 0 HG LEU F 82 -7.297 -8.511 -14.552 1.00 0.00 H new ATOM 0 HD11 LEU F 82 -4.929 -8.466 -13.799 1.00 0.00 H new ATOM 0 HD12 LEU F 82 -5.045 -8.295 -15.567 1.00 0.00 H new ATOM 0 HD13 LEU F 82 -4.724 -6.867 -14.554 1.00 0.00 H new ATOM 0 HD21 LEU F 82 -6.709 -7.553 -12.334 1.00 0.00 H new ATOM 0 HD22 LEU F 82 -6.511 -5.951 -13.083 1.00 0.00 H new ATOM 0 HD23 LEU F 82 -8.115 -6.722 -13.041 1.00 0.00 H new ATOM 1343 N GLN F 83 -9.481 -5.320 -17.451 1.00 0.00 N ATOM 1344 CA GLN F 83 -9.871 -4.230 -18.379 1.00 0.00 C ATOM 1345 C GLN F 83 -11.149 -3.571 -17.853 1.00 0.00 C ATOM 1346 O GLN F 83 -11.350 -2.378 -17.978 1.00 0.00 O ATOM 1347 CB GLN F 83 -10.128 -4.807 -19.773 1.00 0.00 C ATOM 1348 CG GLN F 83 -9.675 -3.801 -20.833 1.00 0.00 C ATOM 1349 CD GLN F 83 -10.889 -3.038 -21.363 1.00 0.00 C ATOM 1350 OE1 GLN F 83 -10.964 -1.831 -21.241 1.00 0.00 O ATOM 1351 NE2 GLN F 83 -11.851 -3.694 -21.952 1.00 0.00 N ATOM 0 H GLN F 83 -9.600 -6.266 -17.815 1.00 0.00 H new ATOM 0 HA GLN F 83 -9.071 -3.493 -18.442 1.00 0.00 H new ATOM 0 HB2 GLN F 83 -9.589 -5.747 -19.894 1.00 0.00 H new ATOM 0 HB3 GLN F 83 -11.188 -5.029 -19.897 1.00 0.00 H new ATOM 0 HG2 GLN F 83 -8.953 -3.105 -20.405 1.00 0.00 H new ATOM 0 HG3 GLN F 83 -9.172 -4.319 -21.650 1.00 0.00 H new ATOM 0 HE21 GLN F 83 -11.789 -4.707 -22.055 1.00 0.00 H new ATOM 0 HE22 GLN F 83 -12.665 -3.194 -22.310 1.00 0.00 H new ATOM 1360 N GLN F 84 -12.015 -4.343 -17.257 1.00 0.00 N ATOM 1361 CA GLN F 84 -13.279 -3.770 -16.717 1.00 0.00 C ATOM 1362 C GLN F 84 -12.971 -2.931 -15.479 1.00 0.00 C ATOM 1363 O GLN F 84 -13.607 -1.928 -15.224 1.00 0.00 O ATOM 1364 CB GLN F 84 -14.241 -4.903 -16.361 1.00 0.00 C ATOM 1365 CG GLN F 84 -14.913 -5.450 -17.637 1.00 0.00 C ATOM 1366 CD GLN F 84 -13.983 -5.305 -18.852 1.00 0.00 C ATOM 1367 OE1 GLN F 84 -13.322 -6.244 -19.245 1.00 0.00 O ATOM 1368 NE2 GLN F 84 -13.911 -4.159 -19.470 1.00 0.00 N ATOM 0 H GLN F 84 -11.901 -5.347 -17.121 1.00 0.00 H new ATOM 0 HA GLN F 84 -13.744 -3.133 -17.469 1.00 0.00 H new ATOM 0 HB2 GLN F 84 -13.701 -5.703 -15.854 1.00 0.00 H new ATOM 0 HB3 GLN F 84 -15.000 -4.541 -15.668 1.00 0.00 H new ATOM 0 HG2 GLN F 84 -15.172 -6.499 -17.495 1.00 0.00 H new ATOM 0 HG3 GLN F 84 -15.844 -4.914 -17.821 1.00 0.00 H new ATOM 0 HE21 GLN F 84 -14.465 -3.367 -19.143 1.00 0.00 H new ATOM 0 HE22 GLN F 84 -13.301 -4.054 -20.281 1.00 0.00 H new ATOM 1377 N LEU F 85 -11.991 -3.319 -14.715 1.00 0.00 N ATOM 1378 CA LEU F 85 -11.642 -2.517 -13.508 1.00 0.00 C ATOM 1379 C LEU F 85 -10.888 -1.280 -13.949 1.00 0.00 C ATOM 1380 O LEU F 85 -10.992 -0.246 -13.344 1.00 0.00 O ATOM 1381 CB LEU F 85 -10.802 -3.360 -12.534 1.00 0.00 C ATOM 1382 CG LEU F 85 -9.308 -3.078 -12.729 1.00 0.00 C ATOM 1383 CD1 LEU F 85 -8.833 -2.079 -11.674 1.00 0.00 C ATOM 1384 CD2 LEU F 85 -8.526 -4.372 -12.606 1.00 0.00 C ATOM 0 H LEU F 85 -11.420 -4.149 -14.870 1.00 0.00 H new ATOM 0 HA LEU F 85 -12.549 -2.215 -12.984 1.00 0.00 H new ATOM 0 HB2 LEU F 85 -11.090 -3.134 -11.507 1.00 0.00 H new ATOM 0 HB3 LEU F 85 -11.002 -4.419 -12.695 1.00 0.00 H new ATOM 0 HG LEU F 85 -9.144 -2.655 -13.720 1.00 0.00 H new ATOM 0 HD11 LEU F 85 -7.771 -1.880 -11.814 1.00 0.00 H new ATOM 0 HD12 LEU F 85 -9.393 -1.149 -11.775 1.00 0.00 H new ATOM 0 HD13 LEU F 85 -8.996 -2.495 -10.680 1.00 0.00 H new ATOM 0 HD21 LEU F 85 -7.464 -4.170 -12.745 1.00 0.00 H new ATOM 0 HD22 LEU F 85 -8.687 -4.802 -11.617 1.00 0.00 H new ATOM 0 HD23 LEU F 85 -8.864 -5.075 -13.367 1.00 0.00 H new ATOM 1396 N VAL F 86 -10.138 -1.358 -15.003 1.00 0.00 N ATOM 1397 CA VAL F 86 -9.439 -0.141 -15.438 1.00 0.00 C ATOM 1398 C VAL F 86 -10.506 0.768 -16.033 1.00 0.00 C ATOM 1399 O VAL F 86 -10.345 1.966 -16.157 1.00 0.00 O ATOM 1400 CB VAL F 86 -8.355 -0.464 -16.469 1.00 0.00 C ATOM 1401 CG1 VAL F 86 -7.557 -1.676 -15.993 1.00 0.00 C ATOM 1402 CG2 VAL F 86 -8.994 -0.764 -17.827 1.00 0.00 C ATOM 0 H VAL F 86 -9.984 -2.193 -15.568 1.00 0.00 H new ATOM 0 HA VAL F 86 -8.930 0.340 -14.603 1.00 0.00 H new ATOM 0 HB VAL F 86 -7.691 0.393 -16.577 1.00 0.00 H new ATOM 0 HG11 VAL F 86 -6.783 -1.912 -16.723 1.00 0.00 H new ATOM 0 HG12 VAL F 86 -7.094 -1.452 -15.032 1.00 0.00 H new ATOM 0 HG13 VAL F 86 -8.224 -2.531 -15.883 1.00 0.00 H new ATOM 0 HG21 VAL F 86 -8.214 -0.993 -18.554 1.00 0.00 H new ATOM 0 HG22 VAL F 86 -9.664 -1.619 -17.733 1.00 0.00 H new ATOM 0 HG23 VAL F 86 -9.559 0.105 -18.163 1.00 0.00 H new ATOM 1412 N GLN F 87 -11.616 0.179 -16.383 1.00 0.00 N ATOM 1413 CA GLN F 87 -12.739 0.952 -16.952 1.00 0.00 C ATOM 1414 C GLN F 87 -13.388 1.789 -15.856 1.00 0.00 C ATOM 1415 O GLN F 87 -13.716 2.943 -16.043 1.00 0.00 O ATOM 1416 CB GLN F 87 -13.781 -0.018 -17.491 1.00 0.00 C ATOM 1417 CG GLN F 87 -14.861 0.760 -18.235 1.00 0.00 C ATOM 1418 CD GLN F 87 -15.665 -0.195 -19.119 1.00 0.00 C ATOM 1419 OE1 GLN F 87 -15.167 -1.222 -19.533 1.00 0.00 O ATOM 1420 NE2 GLN F 87 -16.898 0.104 -19.429 1.00 0.00 N ATOM 0 H GLN F 87 -11.788 -0.822 -16.294 1.00 0.00 H new ATOM 0 HA GLN F 87 -12.368 1.599 -17.747 1.00 0.00 H new ATOM 0 HB2 GLN F 87 -13.311 -0.739 -18.160 1.00 0.00 H new ATOM 0 HB3 GLN F 87 -14.224 -0.585 -16.672 1.00 0.00 H new ATOM 0 HG2 GLN F 87 -15.521 1.256 -17.524 1.00 0.00 H new ATOM 0 HG3 GLN F 87 -14.406 1.540 -18.845 1.00 0.00 H new ATOM 0 HE21 GLN F 87 -17.316 0.967 -19.081 1.00 0.00 H new ATOM 0 HE22 GLN F 87 -17.443 -0.525 -20.019 1.00 0.00 H new ATOM 1429 N HIS F 88 -13.587 1.196 -14.716 1.00 0.00 N ATOM 1430 CA HIS F 88 -14.227 1.921 -13.593 1.00 0.00 C ATOM 1431 C HIS F 88 -13.197 2.825 -12.932 1.00 0.00 C ATOM 1432 O HIS F 88 -13.482 3.935 -12.525 1.00 0.00 O ATOM 1433 CB HIS F 88 -14.734 0.905 -12.576 1.00 0.00 C ATOM 1434 CG HIS F 88 -15.844 1.513 -11.763 1.00 0.00 C ATOM 1435 ND1 HIS F 88 -17.175 1.180 -11.961 1.00 0.00 N ATOM 1436 CD2 HIS F 88 -15.835 2.436 -10.745 1.00 0.00 C ATOM 1437 CE1 HIS F 88 -17.905 1.891 -11.083 1.00 0.00 C ATOM 1438 NE2 HIS F 88 -17.138 2.672 -10.318 1.00 0.00 N ATOM 0 H HIS F 88 -13.330 0.230 -14.514 1.00 0.00 H new ATOM 0 HA HIS F 88 -15.058 2.522 -13.961 1.00 0.00 H new ATOM 0 HB2 HIS F 88 -15.092 0.012 -13.087 1.00 0.00 H new ATOM 0 HB3 HIS F 88 -13.920 0.593 -11.922 1.00 0.00 H new ATOM 0 HD1 HIS F 88 -17.535 0.517 -12.647 1.00 0.00 H new ATOM 0 HD2 HIS F 88 -14.952 2.906 -10.339 1.00 0.00 H new ATOM 0 HE1 HIS F 88 -18.981 1.837 -11.006 1.00 0.00 H new ATOM 1446 N TYR F 89 -12.003 2.339 -12.821 1.00 0.00 N ATOM 1447 CA TYR F 89 -10.919 3.127 -12.185 1.00 0.00 C ATOM 1448 C TYR F 89 -10.575 4.330 -13.066 1.00 0.00 C ATOM 1449 O TYR F 89 -10.016 5.307 -12.610 1.00 0.00 O ATOM 1450 CB TYR F 89 -9.682 2.242 -12.022 1.00 0.00 C ATOM 1451 CG TYR F 89 -9.881 1.280 -10.875 1.00 0.00 C ATOM 1452 CD1 TYR F 89 -11.024 0.476 -10.824 1.00 0.00 C ATOM 1453 CD2 TYR F 89 -8.914 1.183 -9.867 1.00 0.00 C ATOM 1454 CE1 TYR F 89 -11.204 -0.421 -9.775 1.00 0.00 C ATOM 1455 CE2 TYR F 89 -9.095 0.283 -8.809 1.00 0.00 C ATOM 1456 CZ TYR F 89 -10.240 -0.520 -8.763 1.00 0.00 C ATOM 1457 OH TYR F 89 -10.420 -1.410 -7.724 1.00 0.00 O ATOM 0 H TYR F 89 -11.725 1.414 -13.149 1.00 0.00 H new ATOM 0 HA TYR F 89 -11.249 3.479 -11.208 1.00 0.00 H new ATOM 0 HB2 TYR F 89 -9.497 1.689 -12.943 1.00 0.00 H new ATOM 0 HB3 TYR F 89 -8.804 2.861 -11.840 1.00 0.00 H new ATOM 0 HD1 TYR F 89 -11.770 0.551 -11.601 1.00 0.00 H new ATOM 0 HD2 TYR F 89 -8.029 1.801 -9.905 1.00 0.00 H new ATOM 0 HE1 TYR F 89 -12.087 -1.041 -9.741 1.00 0.00 H new ATOM 0 HE2 TYR F 89 -8.351 0.209 -8.029 1.00 0.00 H new ATOM 0 HH TYR F 89 -9.659 -1.353 -7.109 1.00 0.00 H new ATOM 1467 N SER F 90 -10.901 4.264 -14.328 1.00 0.00 N ATOM 1468 CA SER F 90 -10.593 5.393 -15.240 1.00 0.00 C ATOM 1469 C SER F 90 -11.529 6.560 -14.940 1.00 0.00 C ATOM 1470 O SER F 90 -11.128 7.707 -14.923 1.00 0.00 O ATOM 1471 CB SER F 90 -10.785 4.949 -16.691 1.00 0.00 C ATOM 1472 OG SER F 90 -9.617 5.250 -17.438 1.00 0.00 O ATOM 0 H SER F 90 -11.370 3.471 -14.765 1.00 0.00 H new ATOM 0 HA SER F 90 -9.560 5.706 -15.090 1.00 0.00 H new ATOM 0 HB2 SER F 90 -10.989 3.879 -16.731 1.00 0.00 H new ATOM 0 HB3 SER F 90 -11.647 5.454 -17.126 1.00 0.00 H new ATOM 0 HG SER F 90 -9.271 6.125 -17.165 1.00 0.00 H new ATOM 1478 N GLU F 91 -12.777 6.274 -14.706 1.00 0.00 N ATOM 1479 CA GLU F 91 -13.747 7.361 -14.408 1.00 0.00 C ATOM 1480 C GLU F 91 -13.727 7.662 -12.911 1.00 0.00 C ATOM 1481 O GLU F 91 -14.314 8.624 -12.456 1.00 0.00 O ATOM 1482 CB GLU F 91 -15.152 6.918 -14.821 1.00 0.00 C ATOM 1483 CG GLU F 91 -15.107 6.331 -16.233 1.00 0.00 C ATOM 1484 CD GLU F 91 -16.175 7.002 -17.099 1.00 0.00 C ATOM 1485 OE1 GLU F 91 -17.328 6.619 -16.984 1.00 0.00 O ATOM 1486 OE2 GLU F 91 -15.822 7.886 -17.861 1.00 0.00 O ATOM 0 H GLU F 91 -13.168 5.332 -14.708 1.00 0.00 H new ATOM 0 HA GLU F 91 -13.472 8.258 -14.963 1.00 0.00 H new ATOM 0 HB2 GLU F 91 -15.532 6.176 -14.119 1.00 0.00 H new ATOM 0 HB3 GLU F 91 -15.836 7.766 -14.790 1.00 0.00 H new ATOM 0 HG2 GLU F 91 -14.120 6.484 -16.670 1.00 0.00 H new ATOM 0 HG3 GLU F 91 -15.277 5.255 -16.197 1.00 0.00 H new ATOM 1493 N ARG F 92 -13.059 6.851 -12.135 1.00 0.00 N ATOM 1494 CA ARG F 92 -13.017 7.109 -10.666 1.00 0.00 C ATOM 1495 C ARG F 92 -11.730 6.537 -10.068 1.00 0.00 C ATOM 1496 O ARG F 92 -11.150 5.608 -10.593 1.00 0.00 O ATOM 1497 CB ARG F 92 -14.224 6.448 -10.000 1.00 0.00 C ATOM 1498 CG ARG F 92 -15.434 6.540 -10.931 1.00 0.00 C ATOM 1499 CD ARG F 92 -16.647 5.896 -10.257 1.00 0.00 C ATOM 1500 NE ARG F 92 -17.878 6.652 -10.620 1.00 0.00 N ATOM 1501 CZ ARG F 92 -18.699 7.048 -9.687 1.00 0.00 C ATOM 1502 NH1 ARG F 92 -19.417 6.174 -9.036 1.00 0.00 N ATOM 1503 NH2 ARG F 92 -18.803 8.318 -9.405 1.00 0.00 N ATOM 0 H ARG F 92 -12.545 6.028 -12.450 1.00 0.00 H new ATOM 0 HA ARG F 92 -13.043 8.185 -10.492 1.00 0.00 H new ATOM 0 HB2 ARG F 92 -14.003 5.405 -9.776 1.00 0.00 H new ATOM 0 HB3 ARG F 92 -14.443 6.938 -9.052 1.00 0.00 H new ATOM 0 HG2 ARG F 92 -15.647 7.583 -11.166 1.00 0.00 H new ATOM 0 HG3 ARG F 92 -15.219 6.038 -11.874 1.00 0.00 H new ATOM 0 HD2 ARG F 92 -16.741 4.856 -10.570 1.00 0.00 H new ATOM 0 HD3 ARG F 92 -16.516 5.892 -9.175 1.00 0.00 H new ATOM 0 HE ARG F 92 -18.079 6.860 -11.598 1.00 0.00 H new ATOM 0 HH11 ARG F 92 -19.336 5.181 -9.257 1.00 0.00 H new ATOM 0 HH12 ARG F 92 -20.059 6.483 -8.306 1.00 0.00 H new ATOM 0 HH21 ARG F 92 -18.242 9.001 -9.914 1.00 0.00 H new ATOM 0 HH22 ARG F 92 -19.445 8.627 -8.675 1.00 0.00 H new ATOM 1517 N ALA F 93 -11.285 7.081 -8.966 1.00 0.00 N ATOM 1518 CA ALA F 93 -10.041 6.561 -8.331 1.00 0.00 C ATOM 1519 C ALA F 93 -10.256 5.099 -7.942 1.00 0.00 C ATOM 1520 O ALA F 93 -9.320 4.340 -7.819 1.00 0.00 O ATOM 1521 CB ALA F 93 -9.716 7.377 -7.076 1.00 0.00 C ATOM 0 H ALA F 93 -11.728 7.861 -8.480 1.00 0.00 H new ATOM 0 HA ALA F 93 -9.212 6.643 -9.034 1.00 0.00 H new ATOM 0 HB1 ALA F 93 -8.806 6.991 -6.617 1.00 0.00 H new ATOM 0 HB2 ALA F 93 -9.570 8.422 -7.349 1.00 0.00 H new ATOM 0 HB3 ALA F 93 -10.541 7.299 -6.368 1.00 0.00 H new ATOM 1527 N ALA F 94 -11.488 4.711 -7.739 1.00 0.00 N ATOM 1528 CA ALA F 94 -11.787 3.305 -7.350 1.00 0.00 C ATOM 1529 C ALA F 94 -11.571 3.141 -5.846 1.00 0.00 C ATOM 1530 O ALA F 94 -11.911 2.127 -5.269 1.00 0.00 O ATOM 1531 CB ALA F 94 -10.876 2.341 -8.114 1.00 0.00 C ATOM 0 H ALA F 94 -12.305 5.315 -7.827 1.00 0.00 H new ATOM 0 HA ALA F 94 -12.824 3.076 -7.597 1.00 0.00 H new ATOM 0 HB1 ALA F 94 -11.104 1.316 -7.821 1.00 0.00 H new ATOM 0 HB2 ALA F 94 -11.040 2.457 -9.185 1.00 0.00 H new ATOM 0 HB3 ALA F 94 -9.835 2.562 -7.880 1.00 0.00 H new ATOM 1537 N GLY F 95 -11.022 4.134 -5.201 1.00 0.00 N ATOM 1538 CA GLY F 95 -10.806 4.029 -3.734 1.00 0.00 C ATOM 1539 C GLY F 95 -9.310 3.997 -3.413 1.00 0.00 C ATOM 1540 O GLY F 95 -8.912 4.208 -2.285 1.00 0.00 O ATOM 0 H GLY F 95 -10.716 5.009 -5.626 1.00 0.00 H new ATOM 0 HA2 GLY F 95 -11.274 4.875 -3.230 1.00 0.00 H new ATOM 0 HA3 GLY F 95 -11.285 3.127 -3.354 1.00 0.00 H new ATOM 1544 N LEU F 96 -8.472 3.735 -4.380 1.00 0.00 N ATOM 1545 CA LEU F 96 -7.015 3.690 -4.095 1.00 0.00 C ATOM 1546 C LEU F 96 -6.457 5.115 -4.059 1.00 0.00 C ATOM 1547 O LEU F 96 -7.184 6.072 -3.874 1.00 0.00 O ATOM 1548 CB LEU F 96 -6.319 2.885 -5.190 1.00 0.00 C ATOM 1549 CG LEU F 96 -6.677 3.470 -6.554 1.00 0.00 C ATOM 1550 CD1 LEU F 96 -5.407 3.649 -7.374 1.00 0.00 C ATOM 1551 CD2 LEU F 96 -7.614 2.515 -7.285 1.00 0.00 C ATOM 0 H LEU F 96 -8.734 3.552 -5.348 1.00 0.00 H new ATOM 0 HA LEU F 96 -6.840 3.217 -3.129 1.00 0.00 H new ATOM 0 HB2 LEU F 96 -5.239 2.909 -5.044 1.00 0.00 H new ATOM 0 HB3 LEU F 96 -6.625 1.840 -5.139 1.00 0.00 H new ATOM 0 HG LEU F 96 -7.168 4.434 -6.419 1.00 0.00 H new ATOM 0 HD11 LEU F 96 -5.659 4.067 -8.349 1.00 0.00 H new ATOM 0 HD12 LEU F 96 -4.730 4.326 -6.853 1.00 0.00 H new ATOM 0 HD13 LEU F 96 -4.921 2.682 -7.508 1.00 0.00 H new ATOM 0 HD21 LEU F 96 -7.870 2.931 -8.259 1.00 0.00 H new ATOM 0 HD22 LEU F 96 -7.120 1.553 -7.420 1.00 0.00 H new ATOM 0 HD23 LEU F 96 -8.523 2.377 -6.699 1.00 0.00 H new ATOM 1563 N SER F 97 -5.174 5.264 -4.230 1.00 0.00 N ATOM 1564 CA SER F 97 -4.572 6.622 -4.201 1.00 0.00 C ATOM 1565 C SER F 97 -5.196 7.481 -5.299 1.00 0.00 C ATOM 1566 O SER F 97 -5.123 8.693 -5.264 1.00 0.00 O ATOM 1567 CB SER F 97 -3.063 6.517 -4.433 1.00 0.00 C ATOM 1568 OG SER F 97 -2.431 6.068 -3.242 1.00 0.00 O ATOM 0 H SER F 97 -4.516 4.501 -4.389 1.00 0.00 H new ATOM 0 HA SER F 97 -4.760 7.080 -3.230 1.00 0.00 H new ATOM 0 HB2 SER F 97 -2.857 5.825 -5.250 1.00 0.00 H new ATOM 0 HB3 SER F 97 -2.661 7.486 -4.727 1.00 0.00 H new ATOM 0 HG SER F 97 -1.465 5.999 -3.390 1.00 0.00 H new ATOM 1574 N SER F 98 -5.811 6.868 -6.276 1.00 0.00 N ATOM 1575 CA SER F 98 -6.431 7.670 -7.365 1.00 0.00 C ATOM 1576 C SER F 98 -6.867 6.749 -8.506 1.00 0.00 C ATOM 1577 O SER F 98 -6.896 5.542 -8.376 1.00 0.00 O ATOM 1578 CB SER F 98 -5.414 8.693 -7.884 1.00 0.00 C ATOM 1579 OG SER F 98 -5.063 8.390 -9.228 1.00 0.00 O ATOM 0 H SER F 98 -5.909 5.857 -6.365 1.00 0.00 H new ATOM 0 HA SER F 98 -7.306 8.191 -6.977 1.00 0.00 H new ATOM 0 HB2 SER F 98 -5.834 9.697 -7.827 1.00 0.00 H new ATOM 0 HB3 SER F 98 -4.523 8.684 -7.256 1.00 0.00 H new ATOM 0 HG SER F 98 -4.178 7.969 -9.248 1.00 0.00 H new ATOM 1585 N ARG F 99 -7.207 7.323 -9.623 1.00 0.00 N ATOM 1586 CA ARG F 99 -7.649 6.512 -10.790 1.00 0.00 C ATOM 1587 C ARG F 99 -6.476 5.692 -11.331 1.00 0.00 C ATOM 1588 O ARG F 99 -5.587 5.298 -10.603 1.00 0.00 O ATOM 1589 CB ARG F 99 -8.165 7.449 -11.885 1.00 0.00 C ATOM 1590 CG ARG F 99 -9.197 8.409 -11.290 1.00 0.00 C ATOM 1591 CD ARG F 99 -9.961 9.101 -12.420 1.00 0.00 C ATOM 1592 NE ARG F 99 -9.510 10.517 -12.531 1.00 0.00 N ATOM 1593 CZ ARG F 99 -9.856 11.232 -13.565 1.00 0.00 C ATOM 1594 NH1 ARG F 99 -11.061 11.131 -14.055 1.00 0.00 N ATOM 1595 NH2 ARG F 99 -8.998 12.051 -14.109 1.00 0.00 N ATOM 0 H ARG F 99 -7.198 8.331 -9.780 1.00 0.00 H new ATOM 0 HA ARG F 99 -8.443 5.833 -10.479 1.00 0.00 H new ATOM 0 HB2 ARG F 99 -7.337 8.011 -12.318 1.00 0.00 H new ATOM 0 HB3 ARG F 99 -8.614 6.870 -12.692 1.00 0.00 H new ATOM 0 HG2 ARG F 99 -9.890 7.864 -10.649 1.00 0.00 H new ATOM 0 HG3 ARG F 99 -8.701 9.151 -10.664 1.00 0.00 H new ATOM 0 HD2 ARG F 99 -9.790 8.579 -13.362 1.00 0.00 H new ATOM 0 HD3 ARG F 99 -11.033 9.064 -12.225 1.00 0.00 H new ATOM 0 HE ARG F 99 -8.931 10.927 -11.798 1.00 0.00 H new ATOM 0 HH11 ARG F 99 -11.733 10.493 -13.629 1.00 0.00 H new ATOM 0 HH12 ARG F 99 -11.331 11.691 -14.864 1.00 0.00 H new ATOM 0 HH21 ARG F 99 -8.056 12.132 -13.725 1.00 0.00 H new ATOM 0 HH22 ARG F 99 -9.269 12.610 -14.918 1.00 0.00 H new ATOM 1609 N LEU F 100 -6.481 5.424 -12.607 1.00 0.00 N ATOM 1610 CA LEU F 100 -5.386 4.618 -13.219 1.00 0.00 C ATOM 1611 C LEU F 100 -4.643 5.479 -14.251 1.00 0.00 C ATOM 1612 O LEU F 100 -4.745 6.690 -14.236 1.00 0.00 O ATOM 1613 CB LEU F 100 -5.991 3.383 -13.900 1.00 0.00 C ATOM 1614 CG LEU F 100 -7.443 3.671 -14.293 1.00 0.00 C ATOM 1615 CD1 LEU F 100 -7.465 4.643 -15.470 1.00 0.00 C ATOM 1616 CD2 LEU F 100 -8.132 2.375 -14.690 1.00 0.00 C ATOM 0 H LEU F 100 -7.203 5.731 -13.258 1.00 0.00 H new ATOM 0 HA LEU F 100 -4.684 4.295 -12.451 1.00 0.00 H new ATOM 0 HB2 LEU F 100 -5.410 3.122 -14.784 1.00 0.00 H new ATOM 0 HB3 LEU F 100 -5.949 2.527 -13.226 1.00 0.00 H new ATOM 0 HG LEU F 100 -7.968 4.112 -13.446 1.00 0.00 H new ATOM 0 HD11 LEU F 100 -8.497 4.850 -15.752 1.00 0.00 H new ATOM 0 HD12 LEU F 100 -6.974 5.573 -15.183 1.00 0.00 H new ATOM 0 HD13 LEU F 100 -6.939 4.201 -16.317 1.00 0.00 H new ATOM 0 HD21 LEU F 100 -9.165 2.583 -14.969 1.00 0.00 H new ATOM 0 HD22 LEU F 100 -7.610 1.930 -15.537 1.00 0.00 H new ATOM 0 HD23 LEU F 100 -8.116 1.682 -13.849 1.00 0.00 H new ATOM 1628 N VAL F 101 -3.892 4.881 -15.145 1.00 0.00 N ATOM 1629 CA VAL F 101 -3.158 5.702 -16.151 1.00 0.00 C ATOM 1630 C VAL F 101 -4.095 6.761 -16.726 1.00 0.00 C ATOM 1631 O VAL F 101 -4.935 6.484 -17.559 1.00 0.00 O ATOM 1632 CB VAL F 101 -2.633 4.812 -17.282 1.00 0.00 C ATOM 1633 CG1 VAL F 101 -1.187 4.411 -16.980 1.00 0.00 C ATOM 1634 CG2 VAL F 101 -3.498 3.555 -17.411 1.00 0.00 C ATOM 0 H VAL F 101 -3.758 3.873 -15.219 1.00 0.00 H new ATOM 0 HA VAL F 101 -2.312 6.187 -15.663 1.00 0.00 H new ATOM 0 HB VAL F 101 -2.674 5.365 -18.220 1.00 0.00 H new ATOM 0 HG11 VAL F 101 -0.810 3.777 -17.783 1.00 0.00 H new ATOM 0 HG12 VAL F 101 -0.570 5.306 -16.904 1.00 0.00 H new ATOM 0 HG13 VAL F 101 -1.150 3.864 -16.038 1.00 0.00 H new ATOM 0 HG21 VAL F 101 -3.115 2.931 -18.218 1.00 0.00 H new ATOM 0 HG22 VAL F 101 -3.470 2.996 -16.475 1.00 0.00 H new ATOM 0 HG23 VAL F 101 -4.526 3.842 -17.631 1.00 0.00 H new ATOM 1644 N VAL F 102 -3.954 7.978 -16.278 1.00 0.00 N ATOM 1645 CA VAL F 102 -4.830 9.070 -16.784 1.00 0.00 C ATOM 1646 C VAL F 102 -4.305 9.591 -18.128 1.00 0.00 C ATOM 1647 O VAL F 102 -5.065 9.742 -19.063 1.00 0.00 O ATOM 1648 CB VAL F 102 -4.857 10.217 -15.769 1.00 0.00 C ATOM 1649 CG1 VAL F 102 -6.226 10.901 -15.814 1.00 0.00 C ATOM 1650 CG2 VAL F 102 -4.606 9.673 -14.360 1.00 0.00 C ATOM 0 H VAL F 102 -3.267 8.263 -15.580 1.00 0.00 H new ATOM 0 HA VAL F 102 -5.838 8.678 -16.924 1.00 0.00 H new ATOM 0 HB VAL F 102 -4.077 10.936 -16.019 1.00 0.00 H new ATOM 0 HG11 VAL F 102 -6.248 11.718 -15.093 1.00 0.00 H new ATOM 0 HG12 VAL F 102 -6.403 11.295 -16.815 1.00 0.00 H new ATOM 0 HG13 VAL F 102 -7.003 10.177 -15.567 1.00 0.00 H new ATOM 0 HG21 VAL F 102 -4.627 10.494 -13.644 1.00 0.00 H new ATOM 0 HG22 VAL F 102 -5.381 8.950 -14.106 1.00 0.00 H new ATOM 0 HG23 VAL F 102 -3.631 9.187 -14.326 1.00 0.00 H new ATOM 1797 N GLU P 205 0.078 -0.103 -0.247 1.00 0.00 N ATOM 1798 CA GLU P 205 -0.910 0.628 0.595 1.00 0.00 C ATOM 1799 C GLU P 205 -2.237 -0.136 0.603 1.00 0.00 C ATOM 1800 O GLU P 205 -2.461 -1.018 -0.202 1.00 0.00 O ATOM 1801 CB GLU P 205 -1.132 2.029 0.021 1.00 0.00 C ATOM 1802 CG GLU P 205 -0.080 2.985 0.588 1.00 0.00 C ATOM 1803 CD GLU P 205 -0.776 4.122 1.340 1.00 0.00 C ATOM 1804 OE1 GLU P 205 -1.202 5.063 0.690 1.00 0.00 O ATOM 1805 OE2 GLU P 205 -0.869 4.033 2.553 1.00 0.00 O ATOM 0 HA GLU P 205 -0.530 0.709 1.614 1.00 0.00 H new ATOM 0 HB2 GLU P 205 -1.066 2.003 -1.067 1.00 0.00 H new ATOM 0 HB3 GLU P 205 -2.132 2.382 0.271 1.00 0.00 H new ATOM 0 HG2 GLU P 205 0.591 2.448 1.259 1.00 0.00 H new ATOM 0 HG3 GLU P 205 0.532 3.389 -0.218 1.00 0.00 H new ATOM 1812 N GLU P 206 -3.117 0.196 1.508 1.00 0.00 N ATOM 1813 CA GLU P 206 -4.427 -0.513 1.566 1.00 0.00 C ATOM 1814 C GLU P 206 -5.545 0.500 1.823 1.00 0.00 C ATOM 1815 O GLU P 206 -5.497 1.263 2.766 1.00 0.00 O ATOM 1816 CB GLU P 206 -4.401 -1.541 2.699 1.00 0.00 C ATOM 1817 CG GLU P 206 -3.710 -2.817 2.216 1.00 0.00 C ATOM 1818 CD GLU P 206 -2.717 -3.294 3.277 1.00 0.00 C ATOM 1819 OE1 GLU P 206 -2.989 -3.090 4.449 1.00 0.00 O ATOM 1820 OE2 GLU P 206 -1.701 -3.854 2.900 1.00 0.00 O ATOM 0 H GLU P 206 -2.986 0.926 2.208 1.00 0.00 H new ATOM 0 HA GLU P 206 -4.607 -1.021 0.618 1.00 0.00 H new ATOM 0 HB2 GLU P 206 -3.874 -1.134 3.562 1.00 0.00 H new ATOM 0 HB3 GLU P 206 -5.417 -1.766 3.024 1.00 0.00 H new ATOM 0 HG2 GLU P 206 -4.451 -3.593 2.021 1.00 0.00 H new ATOM 0 HG3 GLU P 206 -3.191 -2.629 1.276 1.00 0.00 H new ATOM 1827 N ILE P 207 -6.549 0.511 0.991 1.00 0.00 N ATOM 1828 CA ILE P 207 -7.668 1.474 1.188 1.00 0.00 C ATOM 1829 C ILE P 207 -8.231 1.335 2.614 1.00 0.00 C ATOM 1830 O ILE P 207 -8.415 2.326 3.294 1.00 0.00 O ATOM 1831 CB ILE P 207 -8.763 1.210 0.140 1.00 0.00 C ATOM 1832 CG1 ILE P 207 -8.418 1.971 -1.143 1.00 0.00 C ATOM 1833 CG2 ILE P 207 -10.125 1.689 0.654 1.00 0.00 C ATOM 1834 CD1 ILE P 207 -7.401 1.171 -1.959 1.00 0.00 C ATOM 0 H ILE P 207 -6.643 -0.105 0.183 1.00 0.00 H new ATOM 0 HA ILE P 207 -7.302 2.493 1.061 1.00 0.00 H new ATOM 0 HB ILE P 207 -8.816 0.139 -0.055 1.00 0.00 H new ATOM 0 HG12 ILE P 207 -9.320 2.139 -1.732 1.00 0.00 H new ATOM 0 HG13 ILE P 207 -8.011 2.952 -0.897 1.00 0.00 H new ATOM 0 HG21 ILE P 207 -10.887 1.494 -0.100 1.00 0.00 H new ATOM 0 HG22 ILE P 207 -10.376 1.155 1.570 1.00 0.00 H new ATOM 0 HG23 ILE P 207 -10.081 2.759 0.858 1.00 0.00 H new ATOM 0 HD11 ILE P 207 -7.158 1.715 -2.871 1.00 0.00 H new ATOM 0 HD12 ILE P 207 -6.495 1.026 -1.370 1.00 0.00 H new ATOM 0 HD13 ILE P 207 -7.825 0.201 -2.218 1.00 0.00 H new