USER MOD reduce.3.24.130724 H: found=0, std=0, add=867, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 865 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 137 ASN : amide:sc= -4.12! C(o=-3!,f=-4.2!) USER MOD Set 1.2: A 138 SER OG : rot -0:sc= 1.09 USER MOD Set 2.1: A 103 GLN : amide:sc= -0.45 K(o=0.0089,f=-3!) USER MOD Set 2.2: A 106 MET CE :methyl -163:sc= -0.737 (180deg=-1.35) USER MOD Set 2.3: A 107 TYR OH : rot -131:sc= 1.2 USER MOD Single : A 44 SER OG : rot -10:sc= 0.883 USER MOD Single : A 52 LYS NZ :NH3+ -171:sc= 0.717 (180deg=0.664) USER MOD Single : A 62 THR OG1 : rot 142:sc= 1.49 USER MOD Single : A 63 ASN : amide:sc= -5.01! C(o=-5!,f=-1.4!) USER MOD Single : A 67 CYS SG : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot -80:sc= 0.364 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 GLN : amide:sc= -0.193 K(o=-0.19,f=-1.8!) USER MOD Single : A 74 SER OG : rot -108:sc= 0.342 USER MOD Single : A 78 GLN : amide:sc= 0 K(o=0,f=-0.95) USER MOD Single : A 79 ASN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 80 GLN : amide:sc= -2.97! C(o=-3!,f=-4.4!) USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=-0.00097) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 ASN : amide:sc= -3.79! C(o=-3.8!,f=-12!) USER MOD Single : A 92 TYR OH : rot 180:sc= -0.0454 USER MOD Single : A 93 LYS NZ :NH3+ 139:sc= -0.315 (180deg=-1.44!) USER MOD Single : A 94 HIS : no HE2:sc= -5.13! C(o=-5.1!,f=-7.6!) USER MOD Single : A 95 ASN : amide:sc= -4.04! C(o=-4!,f=-9!) USER MOD Single : A 96 ASN : amide:sc= -0.0214 K(o=-0.021,f=-1.2) USER MOD Single : A 97 MET CE :methyl 177:sc=-0.00898 (180deg=-0.0281) USER MOD Single : A 99 SER OG : rot 180:sc= 0.679 USER MOD Single : A 105 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 111 LYS NZ :NH3+ 168:sc= -8.85! (180deg=-9.45!) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 ASN : amide:sc= 0.14 K(o=0.14,f=-2.6!) USER MOD Single : A 130 SER OG : rot -170:sc= 0 USER MOD Single : A 131 HIS : no HE2:sc= -2.92 X(o=-2.9,f=-3.3!) USER MOD Single : A 135 LYS NZ :NH3+ -151:sc= -7.9! (180deg=-9.46!) USER MOD Single : A 144 GLN : amide:sc= -0.235 K(o=-0.24,f=-1.6!) USER MOD Single : A 146 LYS NZ :NH3+ -157:sc= -0.112 (180deg=-0.646) USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 43 22.408 1.361 -5.256 1.00 0.00 N ATOM 2 CA GLY A 43 23.081 2.578 -4.719 1.00 0.00 C ATOM 3 C GLY A 43 22.144 3.291 -3.743 1.00 0.00 C ATOM 4 O GLY A 43 21.885 4.472 -3.867 1.00 0.00 O ATOM 0 HA2 GLY A 43 24.007 2.302 -4.215 1.00 0.00 H new ATOM 0 HA3 GLY A 43 23.351 3.248 -5.536 1.00 0.00 H new ATOM 8 N SER A 44 21.635 2.584 -2.771 1.00 0.00 N ATOM 9 CA SER A 44 20.716 3.222 -1.787 1.00 0.00 C ATOM 10 C SER A 44 20.654 2.367 -0.520 1.00 0.00 C ATOM 11 O SER A 44 20.544 2.875 0.578 1.00 0.00 O ATOM 12 CB SER A 44 19.318 3.336 -2.395 1.00 0.00 C ATOM 13 OG SER A 44 19.357 4.231 -3.498 1.00 0.00 O ATOM 0 H SER A 44 21.816 1.592 -2.616 1.00 0.00 H new ATOM 0 HA SER A 44 21.085 4.217 -1.536 1.00 0.00 H new ATOM 0 HB2 SER A 44 18.969 2.356 -2.720 1.00 0.00 H new ATOM 0 HB3 SER A 44 18.611 3.694 -1.646 1.00 0.00 H new ATOM 0 HG SER A 44 20.222 4.692 -3.515 1.00 0.00 H new ATOM 19 N GLY A 45 20.723 1.073 -0.665 1.00 0.00 N ATOM 20 CA GLY A 45 20.668 0.184 0.531 1.00 0.00 C ATOM 21 C GLY A 45 19.268 0.237 1.144 1.00 0.00 C ATOM 22 O GLY A 45 19.106 0.469 2.326 1.00 0.00 O ATOM 0 H GLY A 45 20.815 0.592 -1.560 1.00 0.00 H new ATOM 0 HA2 GLY A 45 20.914 -0.839 0.248 1.00 0.00 H new ATOM 0 HA3 GLY A 45 21.410 0.498 1.265 1.00 0.00 H new ATOM 26 N VAL A 46 18.254 0.022 0.353 1.00 0.00 N ATOM 27 CA VAL A 46 16.866 0.058 0.894 1.00 0.00 C ATOM 28 C VAL A 46 16.588 -1.273 1.632 1.00 0.00 C ATOM 29 O VAL A 46 16.907 -2.318 1.100 1.00 0.00 O ATOM 30 CB VAL A 46 15.886 0.207 -0.277 1.00 0.00 C ATOM 31 CG1 VAL A 46 14.455 0.359 0.247 1.00 0.00 C ATOM 32 CG2 VAL A 46 16.258 1.447 -1.094 1.00 0.00 C ATOM 0 H VAL A 46 18.326 -0.177 -0.645 1.00 0.00 H new ATOM 0 HA VAL A 46 16.746 0.894 1.583 1.00 0.00 H new ATOM 0 HB VAL A 46 15.944 -0.683 -0.904 1.00 0.00 H new ATOM 0 HG11 VAL A 46 13.769 0.464 -0.594 1.00 0.00 H new ATOM 0 HG12 VAL A 46 14.185 -0.523 0.828 1.00 0.00 H new ATOM 0 HG13 VAL A 46 14.391 1.244 0.880 1.00 0.00 H new ATOM 0 HG21 VAL A 46 15.563 1.556 -1.927 1.00 0.00 H new ATOM 0 HG22 VAL A 46 16.204 2.331 -0.459 1.00 0.00 H new ATOM 0 HG23 VAL A 46 17.272 1.338 -1.479 1.00 0.00 H new ATOM 42 N PRO A 47 16.006 -1.234 2.823 1.00 0.00 N ATOM 43 CA PRO A 47 15.719 -2.483 3.559 1.00 0.00 C ATOM 44 C PRO A 47 14.846 -3.406 2.697 1.00 0.00 C ATOM 45 O PRO A 47 14.235 -2.982 1.736 1.00 0.00 O ATOM 46 CB PRO A 47 14.978 -2.035 4.844 1.00 0.00 C ATOM 47 CG PRO A 47 14.868 -0.483 4.802 1.00 0.00 C ATOM 48 CD PRO A 47 15.591 0.003 3.526 1.00 0.00 C ATOM 0 HA PRO A 47 16.620 -3.046 3.802 1.00 0.00 H new ATOM 0 HB2 PRO A 47 13.988 -2.489 4.894 1.00 0.00 H new ATOM 0 HB3 PRO A 47 15.521 -2.357 5.732 1.00 0.00 H new ATOM 0 HG2 PRO A 47 13.823 -0.174 4.791 1.00 0.00 H new ATOM 0 HG3 PRO A 47 15.322 -0.043 5.690 1.00 0.00 H new ATOM 0 HD2 PRO A 47 14.930 0.607 2.904 1.00 0.00 H new ATOM 0 HD3 PRO A 47 16.452 0.624 3.773 1.00 0.00 H new ATOM 56 N ALA A 48 14.784 -4.666 3.037 1.00 0.00 N ATOM 57 CA ALA A 48 13.954 -5.613 2.241 1.00 0.00 C ATOM 58 C ALA A 48 12.489 -5.494 2.667 1.00 0.00 C ATOM 59 O ALA A 48 11.945 -6.369 3.311 1.00 0.00 O ATOM 60 CB ALA A 48 14.439 -7.045 2.484 1.00 0.00 C ATOM 0 H ALA A 48 15.272 -5.079 3.831 1.00 0.00 H new ATOM 0 HA ALA A 48 14.045 -5.371 1.182 1.00 0.00 H new ATOM 0 HB1 ALA A 48 13.832 -7.738 1.902 1.00 0.00 H new ATOM 0 HB2 ALA A 48 15.482 -7.132 2.180 1.00 0.00 H new ATOM 0 HB3 ALA A 48 14.349 -7.285 3.543 1.00 0.00 H new ATOM 66 N PHE A 49 11.845 -4.415 2.311 1.00 0.00 N ATOM 67 CA PHE A 49 10.415 -4.240 2.693 1.00 0.00 C ATOM 68 C PHE A 49 9.771 -3.197 1.778 1.00 0.00 C ATOM 69 O PHE A 49 8.851 -3.488 1.040 1.00 0.00 O ATOM 70 CB PHE A 49 10.329 -3.765 4.147 1.00 0.00 C ATOM 71 CG PHE A 49 8.879 -3.625 4.549 1.00 0.00 C ATOM 72 CD1 PHE A 49 8.146 -2.490 4.155 1.00 0.00 C ATOM 73 CD2 PHE A 49 8.259 -4.626 5.320 1.00 0.00 C ATOM 74 CE1 PHE A 49 6.797 -2.354 4.527 1.00 0.00 C ATOM 75 CE2 PHE A 49 6.908 -4.491 5.694 1.00 0.00 C ATOM 76 CZ PHE A 49 6.176 -3.356 5.297 1.00 0.00 C ATOM 0 H PHE A 49 12.248 -3.648 1.773 1.00 0.00 H new ATOM 0 HA PHE A 49 9.891 -5.190 2.590 1.00 0.00 H new ATOM 0 HB2 PHE A 49 10.832 -4.476 4.803 1.00 0.00 H new ATOM 0 HB3 PHE A 49 10.842 -2.810 4.259 1.00 0.00 H new ATOM 0 HD1 PHE A 49 8.622 -1.721 3.565 1.00 0.00 H new ATOM 0 HD2 PHE A 49 8.819 -5.498 5.625 1.00 0.00 H new ATOM 0 HE1 PHE A 49 6.238 -1.482 4.222 1.00 0.00 H new ATOM 0 HE2 PHE A 49 6.433 -5.259 6.286 1.00 0.00 H new ATOM 0 HZ PHE A 49 5.139 -3.254 5.583 1.00 0.00 H new ATOM 86 N LEU A 50 10.245 -1.982 1.821 1.00 0.00 N ATOM 87 CA LEU A 50 9.654 -0.926 0.952 1.00 0.00 C ATOM 88 C LEU A 50 9.937 -1.297 -0.507 1.00 0.00 C ATOM 89 O LEU A 50 9.187 -0.957 -1.401 1.00 0.00 O ATOM 90 CB LEU A 50 10.290 0.452 1.268 1.00 0.00 C ATOM 91 CG LEU A 50 9.671 1.144 2.518 1.00 0.00 C ATOM 92 CD1 LEU A 50 8.129 1.189 2.432 1.00 0.00 C ATOM 93 CD2 LEU A 50 10.140 0.451 3.831 1.00 0.00 C ATOM 0 H LEU A 50 11.013 -1.676 2.418 1.00 0.00 H new ATOM 0 HA LEU A 50 8.581 -0.859 1.131 1.00 0.00 H new ATOM 0 HB2 LEU A 50 11.361 0.323 1.426 1.00 0.00 H new ATOM 0 HB3 LEU A 50 10.172 1.106 0.404 1.00 0.00 H new ATOM 0 HG LEU A 50 10.029 2.173 2.536 1.00 0.00 H new ATOM 0 HD11 LEU A 50 7.729 1.678 3.320 1.00 0.00 H new ATOM 0 HD12 LEU A 50 7.830 1.747 1.545 1.00 0.00 H new ATOM 0 HD13 LEU A 50 7.738 0.173 2.370 1.00 0.00 H new ATOM 0 HD21 LEU A 50 9.693 0.955 4.688 1.00 0.00 H new ATOM 0 HD22 LEU A 50 9.830 -0.594 3.822 1.00 0.00 H new ATOM 0 HD23 LEU A 50 11.226 0.507 3.904 1.00 0.00 H new ATOM 105 N ALA A 51 11.010 -1.998 -0.751 1.00 0.00 N ATOM 106 CA ALA A 51 11.334 -2.398 -2.147 1.00 0.00 C ATOM 107 C ALA A 51 10.336 -3.462 -2.607 1.00 0.00 C ATOM 108 O ALA A 51 9.970 -3.524 -3.764 1.00 0.00 O ATOM 109 CB ALA A 51 12.753 -2.969 -2.200 1.00 0.00 C ATOM 0 H ALA A 51 11.675 -2.310 -0.044 1.00 0.00 H new ATOM 0 HA ALA A 51 11.272 -1.529 -2.802 1.00 0.00 H new ATOM 0 HB1 ALA A 51 12.989 -3.262 -3.223 1.00 0.00 H new ATOM 0 HB2 ALA A 51 13.463 -2.212 -1.866 1.00 0.00 H new ATOM 0 HB3 ALA A 51 12.819 -3.841 -1.549 1.00 0.00 H new ATOM 115 N LYS A 52 9.887 -4.295 -1.708 1.00 0.00 N ATOM 116 CA LYS A 52 8.907 -5.348 -2.094 1.00 0.00 C ATOM 117 C LYS A 52 7.652 -4.681 -2.660 1.00 0.00 C ATOM 118 O LYS A 52 7.147 -5.065 -3.695 1.00 0.00 O ATOM 119 CB LYS A 52 8.530 -6.180 -0.864 1.00 0.00 C ATOM 120 CG LYS A 52 9.674 -7.136 -0.517 1.00 0.00 C ATOM 121 CD LYS A 52 9.321 -7.911 0.755 1.00 0.00 C ATOM 122 CE LYS A 52 10.254 -9.115 0.899 1.00 0.00 C ATOM 123 NZ LYS A 52 10.168 -9.646 2.289 1.00 0.00 N ATOM 0 H LYS A 52 10.156 -4.291 -0.724 1.00 0.00 H new ATOM 0 HA LYS A 52 9.351 -6.000 -2.846 1.00 0.00 H new ATOM 0 HB2 LYS A 52 8.323 -5.524 -0.019 1.00 0.00 H new ATOM 0 HB3 LYS A 52 7.618 -6.744 -1.060 1.00 0.00 H new ATOM 0 HG2 LYS A 52 9.847 -7.828 -1.341 1.00 0.00 H new ATOM 0 HG3 LYS A 52 10.598 -6.577 -0.371 1.00 0.00 H new ATOM 0 HD2 LYS A 52 9.412 -7.261 1.626 1.00 0.00 H new ATOM 0 HD3 LYS A 52 8.284 -8.245 0.714 1.00 0.00 H new ATOM 0 HE2 LYS A 52 9.978 -9.890 0.184 1.00 0.00 H new ATOM 0 HE3 LYS A 52 11.279 -8.823 0.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 10.908 -10.363 2.433 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 10.302 -8.868 2.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 9.234 -10.078 2.438 1.00 0.00 H new ATOM 137 N LEU A 53 7.147 -3.682 -1.988 1.00 0.00 N ATOM 138 CA LEU A 53 5.925 -2.990 -2.490 1.00 0.00 C ATOM 139 C LEU A 53 6.158 -2.532 -3.929 1.00 0.00 C ATOM 140 O LEU A 53 5.443 -2.909 -4.835 1.00 0.00 O ATOM 141 CB LEU A 53 5.621 -1.772 -1.613 1.00 0.00 C ATOM 142 CG LEU A 53 5.599 -2.181 -0.137 1.00 0.00 C ATOM 143 CD1 LEU A 53 5.428 -0.931 0.731 1.00 0.00 C ATOM 144 CD2 LEU A 53 4.434 -3.146 0.121 1.00 0.00 C ATOM 0 H LEU A 53 7.527 -3.316 -1.115 1.00 0.00 H new ATOM 0 HA LEU A 53 5.081 -3.679 -2.455 1.00 0.00 H new ATOM 0 HB2 LEU A 53 6.374 -1.001 -1.774 1.00 0.00 H new ATOM 0 HB3 LEU A 53 4.660 -1.342 -1.894 1.00 0.00 H new ATOM 0 HG LEU A 53 6.536 -2.678 0.113 1.00 0.00 H new ATOM 0 HD11 LEU A 53 5.412 -1.218 1.783 1.00 0.00 H new ATOM 0 HD12 LEU A 53 6.259 -0.248 0.554 1.00 0.00 H new ATOM 0 HD13 LEU A 53 4.491 -0.436 0.475 1.00 0.00 H new ATOM 0 HD21 LEU A 53 4.425 -3.432 1.173 1.00 0.00 H new ATOM 0 HD22 LEU A 53 3.493 -2.656 -0.130 1.00 0.00 H new ATOM 0 HD23 LEU A 53 4.555 -4.036 -0.496 1.00 0.00 H new ATOM 156 N TRP A 54 7.155 -1.722 -4.146 1.00 0.00 N ATOM 157 CA TRP A 54 7.434 -1.243 -5.529 1.00 0.00 C ATOM 158 C TRP A 54 7.536 -2.448 -6.467 1.00 0.00 C ATOM 159 O TRP A 54 7.321 -2.342 -7.658 1.00 0.00 O ATOM 160 CB TRP A 54 8.752 -0.463 -5.543 1.00 0.00 C ATOM 161 CG TRP A 54 8.860 0.327 -6.810 1.00 0.00 C ATOM 162 CD1 TRP A 54 7.962 1.251 -7.230 1.00 0.00 C ATOM 163 CD2 TRP A 54 9.905 0.283 -7.824 1.00 0.00 C ATOM 164 NE1 TRP A 54 8.389 1.776 -8.438 1.00 0.00 N ATOM 165 CE2 TRP A 54 9.581 1.213 -8.848 1.00 0.00 C ATOM 166 CE3 TRP A 54 11.097 -0.469 -7.955 1.00 0.00 C ATOM 167 CZ2 TRP A 54 10.409 1.393 -9.964 1.00 0.00 C ATOM 168 CZ3 TRP A 54 11.934 -0.291 -9.079 1.00 0.00 C ATOM 169 CH2 TRP A 54 11.590 0.638 -10.081 1.00 0.00 C ATOM 0 H TRP A 54 7.788 -1.371 -3.428 1.00 0.00 H new ATOM 0 HA TRP A 54 6.628 -0.590 -5.863 1.00 0.00 H new ATOM 0 HB2 TRP A 54 8.799 0.204 -4.682 1.00 0.00 H new ATOM 0 HB3 TRP A 54 9.593 -1.151 -5.460 1.00 0.00 H new ATOM 0 HD1 TRP A 54 7.060 1.532 -6.707 1.00 0.00 H new ATOM 0 HE1 TRP A 54 7.884 2.492 -8.961 1.00 0.00 H new ATOM 0 HE3 TRP A 54 11.368 -1.183 -7.191 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 10.142 2.107 -10.729 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 12.841 -0.869 -9.171 1.00 0.00 H new ATOM 0 HH2 TRP A 54 12.233 0.770 -10.939 1.00 0.00 H new ATOM 180 N ARG A 55 7.859 -3.599 -5.934 1.00 0.00 N ATOM 181 CA ARG A 55 7.975 -4.826 -6.782 1.00 0.00 C ATOM 182 C ARG A 55 6.662 -5.615 -6.688 1.00 0.00 C ATOM 183 O ARG A 55 6.397 -6.495 -7.483 1.00 0.00 O ATOM 184 CB ARG A 55 9.152 -5.691 -6.266 1.00 0.00 C ATOM 185 CG ARG A 55 10.426 -5.436 -7.098 1.00 0.00 C ATOM 186 CD ARG A 55 10.952 -4.000 -6.871 1.00 0.00 C ATOM 187 NE ARG A 55 11.334 -3.385 -8.183 1.00 0.00 N ATOM 188 CZ ARG A 55 12.066 -4.034 -9.052 1.00 0.00 C ATOM 189 NH1 ARG A 55 12.576 -5.196 -8.752 1.00 0.00 N ATOM 190 NH2 ARG A 55 12.314 -3.499 -10.217 1.00 0.00 N ATOM 0 H ARG A 55 8.049 -3.743 -4.942 1.00 0.00 H new ATOM 0 HA ARG A 55 8.162 -4.553 -7.821 1.00 0.00 H new ATOM 0 HB2 ARG A 55 9.345 -5.462 -5.218 1.00 0.00 H new ATOM 0 HB3 ARG A 55 8.884 -6.746 -6.318 1.00 0.00 H new ATOM 0 HG2 ARG A 55 11.195 -6.158 -6.823 1.00 0.00 H new ATOM 0 HG3 ARG A 55 10.211 -5.586 -8.156 1.00 0.00 H new ATOM 0 HD2 ARG A 55 10.186 -3.395 -6.385 1.00 0.00 H new ATOM 0 HD3 ARG A 55 11.814 -4.020 -6.204 1.00 0.00 H new ATOM 0 HE ARG A 55 11.017 -2.441 -8.403 1.00 0.00 H new ATOM 0 HH11 ARG A 55 12.406 -5.606 -7.834 1.00 0.00 H new ATOM 0 HH12 ARG A 55 13.145 -5.695 -9.436 1.00 0.00 H new ATOM 0 HH21 ARG A 55 11.938 -2.579 -10.446 1.00 0.00 H new ATOM 0 HH22 ARG A 55 12.884 -4.001 -10.898 1.00 0.00 H new ATOM 204 N LEU A 56 5.841 -5.309 -5.718 1.00 0.00 N ATOM 205 CA LEU A 56 4.546 -6.039 -5.564 1.00 0.00 C ATOM 206 C LEU A 56 3.455 -5.303 -6.354 1.00 0.00 C ATOM 207 O LEU A 56 2.759 -5.883 -7.161 1.00 0.00 O ATOM 208 CB LEU A 56 4.175 -6.088 -4.069 1.00 0.00 C ATOM 209 CG LEU A 56 3.273 -7.298 -3.776 1.00 0.00 C ATOM 210 CD1 LEU A 56 3.061 -7.413 -2.264 1.00 0.00 C ATOM 211 CD2 LEU A 56 1.916 -7.120 -4.470 1.00 0.00 C ATOM 0 H LEU A 56 6.011 -4.582 -5.023 1.00 0.00 H new ATOM 0 HA LEU A 56 4.638 -7.055 -5.947 1.00 0.00 H new ATOM 0 HB2 LEU A 56 5.081 -6.148 -3.466 1.00 0.00 H new ATOM 0 HB3 LEU A 56 3.663 -5.168 -3.785 1.00 0.00 H new ATOM 0 HG LEU A 56 3.750 -8.203 -4.153 1.00 0.00 H new ATOM 0 HD11 LEU A 56 2.422 -8.270 -2.050 1.00 0.00 H new ATOM 0 HD12 LEU A 56 4.024 -7.547 -1.771 1.00 0.00 H new ATOM 0 HD13 LEU A 56 2.586 -6.505 -1.893 1.00 0.00 H new ATOM 0 HD21 LEU A 56 1.283 -7.981 -4.257 1.00 0.00 H new ATOM 0 HD22 LEU A 56 1.434 -6.215 -4.100 1.00 0.00 H new ATOM 0 HD23 LEU A 56 2.066 -7.037 -5.546 1.00 0.00 H new ATOM 223 N VAL A 57 3.305 -4.027 -6.124 1.00 0.00 N ATOM 224 CA VAL A 57 2.262 -3.250 -6.855 1.00 0.00 C ATOM 225 C VAL A 57 2.290 -3.602 -8.346 1.00 0.00 C ATOM 226 O VAL A 57 1.429 -4.300 -8.844 1.00 0.00 O ATOM 227 CB VAL A 57 2.530 -1.754 -6.682 1.00 0.00 C ATOM 228 CG1 VAL A 57 1.459 -0.956 -7.429 1.00 0.00 C ATOM 229 CG2 VAL A 57 2.488 -1.395 -5.194 1.00 0.00 C ATOM 0 H VAL A 57 3.861 -3.487 -5.460 1.00 0.00 H new ATOM 0 HA VAL A 57 1.282 -3.500 -6.449 1.00 0.00 H new ATOM 0 HB VAL A 57 3.513 -1.512 -7.086 1.00 0.00 H new ATOM 0 HG11 VAL A 57 1.648 0.110 -7.307 1.00 0.00 H new ATOM 0 HG12 VAL A 57 1.488 -1.211 -8.488 1.00 0.00 H new ATOM 0 HG13 VAL A 57 0.476 -1.199 -7.025 1.00 0.00 H new ATOM 0 HG21 VAL A 57 2.679 -0.329 -5.071 1.00 0.00 H new ATOM 0 HG22 VAL A 57 1.505 -1.636 -4.789 1.00 0.00 H new ATOM 0 HG23 VAL A 57 3.250 -1.964 -4.661 1.00 0.00 H new ATOM 239 N ASP A 58 3.267 -3.115 -9.067 1.00 0.00 N ATOM 240 CA ASP A 58 3.344 -3.412 -10.530 1.00 0.00 C ATOM 241 C ASP A 58 4.155 -4.693 -10.764 1.00 0.00 C ATOM 242 O ASP A 58 3.880 -5.727 -10.189 1.00 0.00 O ATOM 243 CB ASP A 58 4.020 -2.241 -11.246 1.00 0.00 C ATOM 244 CG ASP A 58 3.857 -2.404 -12.759 1.00 0.00 C ATOM 245 OD1 ASP A 58 3.681 -3.528 -13.199 1.00 0.00 O ATOM 246 OD2 ASP A 58 3.909 -1.401 -13.452 1.00 0.00 O ATOM 0 H ASP A 58 4.016 -2.524 -8.706 1.00 0.00 H new ATOM 0 HA ASP A 58 2.337 -3.553 -10.923 1.00 0.00 H new ATOM 0 HB2 ASP A 58 3.578 -1.299 -10.922 1.00 0.00 H new ATOM 0 HB3 ASP A 58 5.078 -2.204 -10.986 1.00 0.00 H new ATOM 251 N ASP A 59 5.149 -4.627 -11.611 1.00 0.00 N ATOM 252 CA ASP A 59 5.983 -5.831 -11.896 1.00 0.00 C ATOM 253 C ASP A 59 5.085 -6.996 -12.311 1.00 0.00 C ATOM 254 O ASP A 59 5.410 -8.148 -12.104 1.00 0.00 O ATOM 255 CB ASP A 59 6.783 -6.215 -10.650 1.00 0.00 C ATOM 256 CG ASP A 59 7.801 -5.116 -10.338 1.00 0.00 C ATOM 257 OD1 ASP A 59 7.378 -4.005 -10.067 1.00 0.00 O ATOM 258 OD2 ASP A 59 8.986 -5.405 -10.374 1.00 0.00 O ATOM 0 H ASP A 59 5.420 -3.786 -12.120 1.00 0.00 H new ATOM 0 HA ASP A 59 6.673 -5.603 -12.708 1.00 0.00 H new ATOM 0 HB2 ASP A 59 6.112 -6.355 -9.803 1.00 0.00 H new ATOM 0 HB3 ASP A 59 7.294 -7.164 -10.811 1.00 0.00 H new ATOM 263 N ALA A 60 3.964 -6.699 -12.907 1.00 0.00 N ATOM 264 CA ALA A 60 3.029 -7.776 -13.357 1.00 0.00 C ATOM 265 C ALA A 60 2.908 -8.857 -12.280 1.00 0.00 C ATOM 266 O ALA A 60 3.313 -8.674 -11.149 1.00 0.00 O ATOM 267 CB ALA A 60 3.561 -8.408 -14.643 1.00 0.00 C ATOM 0 H ALA A 60 3.650 -5.749 -13.105 1.00 0.00 H new ATOM 0 HA ALA A 60 2.047 -7.337 -13.536 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.880 -9.193 -14.971 1.00 0.00 H new ATOM 0 HB2 ALA A 60 3.637 -7.646 -15.419 1.00 0.00 H new ATOM 0 HB3 ALA A 60 4.546 -8.836 -14.457 1.00 0.00 H new ATOM 273 N ASP A 61 2.353 -9.987 -12.629 1.00 0.00 N ATOM 274 CA ASP A 61 2.203 -11.089 -11.638 1.00 0.00 C ATOM 275 C ASP A 61 1.504 -10.568 -10.380 1.00 0.00 C ATOM 276 O ASP A 61 1.384 -11.266 -9.393 1.00 0.00 O ATOM 277 CB ASP A 61 3.586 -11.629 -11.265 1.00 0.00 C ATOM 278 CG ASP A 61 3.429 -12.869 -10.382 1.00 0.00 C ATOM 279 OD1 ASP A 61 2.734 -13.783 -10.797 1.00 0.00 O ATOM 280 OD2 ASP A 61 4.005 -12.883 -9.308 1.00 0.00 O ATOM 0 H ASP A 61 1.996 -10.194 -13.562 1.00 0.00 H new ATOM 0 HA ASP A 61 1.603 -11.886 -12.077 1.00 0.00 H new ATOM 0 HB2 ASP A 61 4.145 -11.880 -12.166 1.00 0.00 H new ATOM 0 HB3 ASP A 61 4.157 -10.864 -10.738 1.00 0.00 H new ATOM 285 N THR A 62 1.042 -9.343 -10.405 1.00 0.00 N ATOM 286 CA THR A 62 0.351 -8.768 -9.209 1.00 0.00 C ATOM 287 C THR A 62 -0.837 -7.921 -9.669 1.00 0.00 C ATOM 288 O THR A 62 -1.827 -7.807 -8.975 1.00 0.00 O ATOM 289 CB THR A 62 1.337 -7.902 -8.424 1.00 0.00 C ATOM 290 OG1 THR A 62 1.798 -6.842 -9.250 1.00 0.00 O ATOM 291 CG2 THR A 62 2.522 -8.764 -7.982 1.00 0.00 C ATOM 0 H THR A 62 1.114 -8.714 -11.205 1.00 0.00 H new ATOM 0 HA THR A 62 -0.010 -9.572 -8.568 1.00 0.00 H new ATOM 0 HB THR A 62 0.843 -7.485 -7.547 1.00 0.00 H new ATOM 0 HG1 THR A 62 1.885 -6.025 -8.716 1.00 0.00 H new ATOM 0 HG21 THR A 62 3.228 -8.152 -7.422 1.00 0.00 H new ATOM 0 HG22 THR A 62 2.165 -9.577 -7.349 1.00 0.00 H new ATOM 0 HG23 THR A 62 3.018 -9.179 -8.860 1.00 0.00 H new ATOM 299 N ASN A 63 -0.758 -7.336 -10.837 1.00 0.00 N ATOM 300 CA ASN A 63 -1.900 -6.517 -11.332 1.00 0.00 C ATOM 301 C ASN A 63 -3.155 -7.389 -11.327 1.00 0.00 C ATOM 302 O ASN A 63 -3.481 -8.034 -12.304 1.00 0.00 O ATOM 303 CB ASN A 63 -1.610 -6.038 -12.758 1.00 0.00 C ATOM 304 CG ASN A 63 -1.379 -7.246 -13.666 1.00 0.00 C ATOM 305 OD1 ASN A 63 -2.174 -7.524 -14.541 1.00 0.00 O ATOM 306 ND2 ASN A 63 -0.315 -7.982 -13.494 1.00 0.00 N ATOM 0 H ASN A 63 0.044 -7.391 -11.465 1.00 0.00 H new ATOM 0 HA ASN A 63 -2.045 -5.647 -10.691 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -2.445 -5.445 -13.130 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -0.732 -5.392 -12.764 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -0.151 -8.790 -14.094 1.00 0.00 H new ATOM 0 HD22 ASN A 63 0.353 -7.749 -12.759 1.00 0.00 H new ATOM 313 N ARG A 64 -3.843 -7.435 -10.222 1.00 0.00 N ATOM 314 CA ARG A 64 -5.060 -8.291 -10.132 1.00 0.00 C ATOM 315 C ARG A 64 -5.784 -7.969 -8.813 1.00 0.00 C ATOM 316 O ARG A 64 -6.986 -8.101 -8.694 1.00 0.00 O ATOM 317 CB ARG A 64 -4.605 -9.786 -10.244 1.00 0.00 C ATOM 318 CG ARG A 64 -4.855 -10.627 -8.960 1.00 0.00 C ATOM 319 CD ARG A 64 -6.255 -11.259 -9.016 1.00 0.00 C ATOM 320 NE ARG A 64 -7.192 -10.330 -9.710 1.00 0.00 N ATOM 321 CZ ARG A 64 -8.365 -10.754 -10.097 1.00 0.00 C ATOM 322 NH1 ARG A 64 -8.723 -11.986 -9.861 1.00 0.00 N ATOM 323 NH2 ARG A 64 -9.178 -9.945 -10.719 1.00 0.00 N ATOM 0 H ARG A 64 -3.615 -6.916 -9.374 1.00 0.00 H new ATOM 0 HA ARG A 64 -5.768 -8.101 -10.939 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -5.130 -10.252 -11.078 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -3.542 -9.813 -10.481 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -4.098 -11.406 -8.871 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -4.767 -9.994 -8.077 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -6.215 -12.212 -9.543 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -6.612 -11.467 -8.008 1.00 0.00 H new ATOM 0 HE ARG A 64 -6.917 -9.363 -9.883 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -8.087 -12.618 -9.374 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -9.639 -12.318 -10.163 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -8.897 -8.982 -10.903 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -10.094 -10.276 -11.021 1.00 0.00 H new ATOM 337 N LEU A 65 -5.040 -7.552 -7.820 1.00 0.00 N ATOM 338 CA LEU A 65 -5.638 -7.222 -6.492 1.00 0.00 C ATOM 339 C LEU A 65 -5.040 -5.904 -5.990 1.00 0.00 C ATOM 340 O LEU A 65 -5.275 -5.490 -4.872 1.00 0.00 O ATOM 341 CB LEU A 65 -5.283 -8.354 -5.517 1.00 0.00 C ATOM 342 CG LEU A 65 -6.276 -9.525 -5.676 1.00 0.00 C ATOM 343 CD1 LEU A 65 -5.595 -10.838 -5.257 1.00 0.00 C ATOM 344 CD2 LEU A 65 -7.517 -9.291 -4.794 1.00 0.00 C ATOM 0 H LEU A 65 -4.029 -7.425 -7.875 1.00 0.00 H new ATOM 0 HA LEU A 65 -6.720 -7.118 -6.570 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -4.267 -8.701 -5.705 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -5.308 -7.983 -4.492 1.00 0.00 H new ATOM 0 HG LEU A 65 -6.585 -9.587 -6.719 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -6.297 -11.664 -5.370 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -4.724 -11.014 -5.888 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -5.281 -10.769 -4.216 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -8.211 -10.123 -4.914 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -7.213 -9.220 -3.750 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -8.007 -8.364 -5.093 1.00 0.00 H new ATOM 356 N ILE A 66 -4.261 -5.244 -6.806 1.00 0.00 N ATOM 357 CA ILE A 66 -3.642 -3.960 -6.369 1.00 0.00 C ATOM 358 C ILE A 66 -3.269 -3.119 -7.593 1.00 0.00 C ATOM 359 O ILE A 66 -2.928 -3.641 -8.636 1.00 0.00 O ATOM 360 CB ILE A 66 -2.384 -4.262 -5.549 1.00 0.00 C ATOM 361 CG1 ILE A 66 -1.691 -2.944 -5.163 1.00 0.00 C ATOM 362 CG2 ILE A 66 -1.434 -5.131 -6.381 1.00 0.00 C ATOM 363 CD1 ILE A 66 -0.743 -3.174 -3.980 1.00 0.00 C ATOM 0 H ILE A 66 -4.027 -5.538 -7.754 1.00 0.00 H new ATOM 0 HA ILE A 66 -4.353 -3.403 -5.759 1.00 0.00 H new ATOM 0 HB ILE A 66 -2.658 -4.797 -4.640 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -1.134 -2.554 -6.015 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -2.438 -2.195 -4.900 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -0.537 -5.348 -5.801 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -1.931 -6.065 -6.644 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -1.157 -4.599 -7.291 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -0.258 -2.235 -3.715 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -1.310 -3.543 -3.126 1.00 0.00 H new ATOM 0 HD13 ILE A 66 0.014 -3.908 -4.257 1.00 0.00 H new ATOM 375 N CYS A 67 -3.331 -1.819 -7.471 1.00 0.00 N ATOM 376 CA CYS A 67 -2.981 -0.942 -8.626 1.00 0.00 C ATOM 377 C CYS A 67 -2.631 0.460 -8.116 1.00 0.00 C ATOM 378 O CYS A 67 -2.788 0.763 -6.949 1.00 0.00 O ATOM 379 CB CYS A 67 -4.175 -0.855 -9.579 1.00 0.00 C ATOM 380 SG CYS A 67 -5.662 -0.417 -8.645 1.00 0.00 S ATOM 0 H CYS A 67 -3.609 -1.327 -6.622 1.00 0.00 H new ATOM 0 HA CYS A 67 -2.124 -1.360 -9.154 1.00 0.00 H new ATOM 0 HB2 CYS A 67 -3.984 -0.109 -10.351 1.00 0.00 H new ATOM 0 HB3 CYS A 67 -4.319 -1.809 -10.086 1.00 0.00 H new ATOM 0 HG CYS A 67 -6.676 -0.341 -9.455 1.00 0.00 H new ATOM 386 N TRP A 68 -2.158 1.317 -8.982 1.00 0.00 N ATOM 387 CA TRP A 68 -1.796 2.700 -8.550 1.00 0.00 C ATOM 388 C TRP A 68 -3.034 3.600 -8.612 1.00 0.00 C ATOM 389 O TRP A 68 -4.036 3.253 -9.207 1.00 0.00 O ATOM 390 CB TRP A 68 -0.719 3.260 -9.485 1.00 0.00 C ATOM 391 CG TRP A 68 0.589 2.591 -9.202 1.00 0.00 C ATOM 392 CD1 TRP A 68 0.988 1.411 -9.732 1.00 0.00 C ATOM 393 CD2 TRP A 68 1.673 3.043 -8.341 1.00 0.00 C ATOM 394 NE1 TRP A 68 2.249 1.106 -9.248 1.00 0.00 N ATOM 395 CE2 TRP A 68 2.716 2.079 -8.387 1.00 0.00 C ATOM 396 CE3 TRP A 68 1.854 4.185 -7.526 1.00 0.00 C ATOM 397 CZ2 TRP A 68 3.899 2.241 -7.651 1.00 0.00 C ATOM 398 CZ3 TRP A 68 3.043 4.353 -6.784 1.00 0.00 C ATOM 399 CH2 TRP A 68 4.063 3.382 -6.846 1.00 0.00 C ATOM 0 H TRP A 68 -2.006 1.119 -9.971 1.00 0.00 H new ATOM 0 HA TRP A 68 -1.418 2.671 -7.528 1.00 0.00 H new ATOM 0 HB2 TRP A 68 -1.005 3.097 -10.524 1.00 0.00 H new ATOM 0 HB3 TRP A 68 -0.626 4.337 -9.345 1.00 0.00 H new ATOM 0 HD1 TRP A 68 0.416 0.806 -10.420 1.00 0.00 H new ATOM 0 HE1 TRP A 68 2.769 0.265 -9.497 1.00 0.00 H new ATOM 0 HE3 TRP A 68 1.077 4.933 -7.471 1.00 0.00 H new ATOM 0 HZ2 TRP A 68 4.678 1.495 -7.702 1.00 0.00 H new ATOM 0 HZ3 TRP A 68 3.172 5.229 -6.166 1.00 0.00 H new ATOM 0 HH2 TRP A 68 4.970 3.514 -6.275 1.00 0.00 H new ATOM 410 N THR A 69 -2.971 4.755 -8.007 1.00 0.00 N ATOM 411 CA THR A 69 -4.141 5.681 -8.036 1.00 0.00 C ATOM 412 C THR A 69 -4.165 6.423 -9.373 1.00 0.00 C ATOM 413 O THR A 69 -3.831 5.872 -10.403 1.00 0.00 O ATOM 414 CB THR A 69 -4.025 6.686 -6.882 1.00 0.00 C ATOM 415 OG1 THR A 69 -2.809 7.409 -7.005 1.00 0.00 O ATOM 416 CG2 THR A 69 -4.044 5.941 -5.542 1.00 0.00 C ATOM 0 H THR A 69 -2.159 5.098 -7.493 1.00 0.00 H new ATOM 0 HA THR A 69 -5.064 5.113 -7.923 1.00 0.00 H new ATOM 0 HB THR A 69 -4.866 7.378 -6.921 1.00 0.00 H new ATOM 0 HG1 THR A 69 -2.070 6.868 -6.656 1.00 0.00 H new ATOM 0 HG21 THR A 69 -3.961 6.658 -4.726 1.00 0.00 H new ATOM 0 HG22 THR A 69 -4.979 5.388 -5.446 1.00 0.00 H new ATOM 0 HG23 THR A 69 -3.205 5.246 -5.500 1.00 0.00 H new ATOM 424 N LYS A 70 -4.569 7.664 -9.363 1.00 0.00 N ATOM 425 CA LYS A 70 -4.630 8.457 -10.629 1.00 0.00 C ATOM 426 C LYS A 70 -3.383 8.193 -11.480 1.00 0.00 C ATOM 427 O LYS A 70 -3.416 7.423 -12.420 1.00 0.00 O ATOM 428 CB LYS A 70 -4.712 9.948 -10.285 1.00 0.00 C ATOM 429 CG LYS A 70 -6.140 10.290 -9.843 1.00 0.00 C ATOM 430 CD LYS A 70 -6.141 11.628 -9.106 1.00 0.00 C ATOM 431 CE LYS A 70 -5.713 12.743 -10.063 1.00 0.00 C ATOM 432 NZ LYS A 70 -6.053 14.065 -9.466 1.00 0.00 N ATOM 0 H LYS A 70 -4.862 8.168 -8.526 1.00 0.00 H new ATOM 0 HA LYS A 70 -5.512 8.159 -11.197 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -4.006 10.189 -9.490 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -4.434 10.548 -11.151 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -6.798 10.341 -10.711 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -6.528 9.505 -9.194 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -7.135 11.836 -8.711 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -5.462 11.586 -8.254 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -4.641 12.682 -10.254 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -6.215 12.625 -11.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -5.763 14.824 -10.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -7.079 14.120 -9.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -5.555 14.175 -8.560 1.00 0.00 H new ATOM 446 N ASP A 71 -2.284 8.824 -11.164 1.00 0.00 N ATOM 447 CA ASP A 71 -1.048 8.598 -11.965 1.00 0.00 C ATOM 448 C ASP A 71 0.150 9.242 -11.264 1.00 0.00 C ATOM 449 O ASP A 71 1.282 9.067 -11.669 1.00 0.00 O ATOM 450 CB ASP A 71 -1.221 9.221 -13.352 1.00 0.00 C ATOM 451 CG ASP A 71 0.086 9.090 -14.137 1.00 0.00 C ATOM 452 OD1 ASP A 71 0.930 9.960 -13.994 1.00 0.00 O ATOM 453 OD2 ASP A 71 0.221 8.122 -14.867 1.00 0.00 O ATOM 0 H ASP A 71 -2.189 9.482 -10.391 1.00 0.00 H new ATOM 0 HA ASP A 71 -0.873 7.527 -12.063 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -2.030 8.724 -13.887 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -1.498 10.271 -13.259 1.00 0.00 H new ATOM 458 N GLY A 72 -0.085 9.986 -10.218 1.00 0.00 N ATOM 459 CA GLY A 72 1.051 10.636 -9.502 1.00 0.00 C ATOM 460 C GLY A 72 0.563 11.208 -8.172 1.00 0.00 C ATOM 461 O GLY A 72 0.573 12.405 -7.960 1.00 0.00 O ATOM 0 H GLY A 72 -1.009 10.172 -9.829 1.00 0.00 H new ATOM 0 HA2 GLY A 72 1.846 9.911 -9.327 1.00 0.00 H new ATOM 0 HA3 GLY A 72 1.474 11.430 -10.117 1.00 0.00 H new ATOM 465 N GLN A 73 0.141 10.364 -7.267 1.00 0.00 N ATOM 466 CA GLN A 73 -0.343 10.861 -5.945 1.00 0.00 C ATOM 467 C GLN A 73 -0.077 9.800 -4.875 1.00 0.00 C ATOM 468 O GLN A 73 0.447 10.091 -3.819 1.00 0.00 O ATOM 469 CB GLN A 73 -1.845 11.146 -6.023 1.00 0.00 C ATOM 470 CG GLN A 73 -2.298 11.869 -4.753 1.00 0.00 C ATOM 471 CD GLN A 73 -1.722 13.287 -4.739 1.00 0.00 C ATOM 472 OE1 GLN A 73 -1.466 13.861 -5.779 1.00 0.00 O ATOM 473 NE2 GLN A 73 -1.507 13.880 -3.597 1.00 0.00 N ATOM 0 H GLN A 73 0.111 9.351 -7.386 1.00 0.00 H new ATOM 0 HA GLN A 73 0.185 11.779 -5.686 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -2.064 11.757 -6.899 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -2.397 10.213 -6.139 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -3.387 11.907 -4.712 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -1.965 11.321 -3.872 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -1.722 13.398 -2.724 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -1.124 14.825 -3.577 1.00 0.00 H new ATOM 482 N SER A 74 -0.426 8.568 -5.139 1.00 0.00 N ATOM 483 CA SER A 74 -0.179 7.495 -4.133 1.00 0.00 C ATOM 484 C SER A 74 -0.506 6.129 -4.748 1.00 0.00 C ATOM 485 O SER A 74 -0.400 5.936 -5.944 1.00 0.00 O ATOM 486 CB SER A 74 -1.046 7.741 -2.890 1.00 0.00 C ATOM 487 OG SER A 74 -0.357 7.257 -1.745 1.00 0.00 O ATOM 0 H SER A 74 -0.870 8.260 -6.004 1.00 0.00 H new ATOM 0 HA SER A 74 0.870 7.507 -3.837 1.00 0.00 H new ATOM 0 HB2 SER A 74 -1.256 8.805 -2.782 1.00 0.00 H new ATOM 0 HB3 SER A 74 -2.006 7.235 -2.994 1.00 0.00 H new ATOM 0 HG SER A 74 -0.794 6.442 -1.420 1.00 0.00 H new ATOM 493 N PHE A 75 -0.903 5.179 -3.938 1.00 0.00 N ATOM 494 CA PHE A 75 -1.236 3.819 -4.472 1.00 0.00 C ATOM 495 C PHE A 75 -2.467 3.274 -3.739 1.00 0.00 C ATOM 496 O PHE A 75 -2.552 3.338 -2.529 1.00 0.00 O ATOM 497 CB PHE A 75 -0.043 2.880 -4.248 1.00 0.00 C ATOM 498 CG PHE A 75 0.118 2.609 -2.769 1.00 0.00 C ATOM 499 CD1 PHE A 75 0.561 3.634 -1.914 1.00 0.00 C ATOM 500 CD2 PHE A 75 -0.187 1.336 -2.247 1.00 0.00 C ATOM 501 CE1 PHE A 75 0.702 3.387 -0.536 1.00 0.00 C ATOM 502 CE2 PHE A 75 -0.047 1.090 -0.869 1.00 0.00 C ATOM 503 CZ PHE A 75 0.398 2.115 -0.013 1.00 0.00 C ATOM 0 H PHE A 75 -1.011 5.285 -2.929 1.00 0.00 H new ATOM 0 HA PHE A 75 -1.450 3.884 -5.539 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -0.198 1.944 -4.785 1.00 0.00 H new ATOM 0 HB3 PHE A 75 0.866 3.329 -4.647 1.00 0.00 H new ATOM 0 HD1 PHE A 75 0.793 4.610 -2.315 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -0.528 0.550 -2.904 1.00 0.00 H new ATOM 0 HE1 PHE A 75 1.044 4.173 0.121 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -0.281 0.115 -0.468 1.00 0.00 H new ATOM 0 HZ PHE A 75 0.506 1.926 1.045 1.00 0.00 H new ATOM 513 N VAL A 76 -3.417 2.736 -4.465 1.00 0.00 N ATOM 514 CA VAL A 76 -4.651 2.178 -3.823 1.00 0.00 C ATOM 515 C VAL A 76 -4.680 0.662 -4.008 1.00 0.00 C ATOM 516 O VAL A 76 -3.980 0.108 -4.832 1.00 0.00 O ATOM 517 CB VAL A 76 -5.894 2.796 -4.480 1.00 0.00 C ATOM 518 CG1 VAL A 76 -5.756 2.724 -6.000 1.00 0.00 C ATOM 519 CG2 VAL A 76 -7.158 2.038 -4.052 1.00 0.00 C ATOM 0 H VAL A 76 -3.391 2.659 -5.482 1.00 0.00 H new ATOM 0 HA VAL A 76 -4.646 2.415 -2.759 1.00 0.00 H new ATOM 0 HB VAL A 76 -5.978 3.835 -4.163 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -6.638 3.163 -6.467 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -4.869 3.275 -6.311 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -5.663 1.683 -6.308 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -8.030 2.488 -4.526 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -7.077 0.995 -4.357 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -7.265 2.092 -2.969 1.00 0.00 H new ATOM 529 N ILE A 77 -5.507 0.000 -3.247 1.00 0.00 N ATOM 530 CA ILE A 77 -5.638 -1.485 -3.347 1.00 0.00 C ATOM 531 C ILE A 77 -7.119 -1.807 -3.566 1.00 0.00 C ATOM 532 O ILE A 77 -7.988 -1.081 -3.129 1.00 0.00 O ATOM 533 CB ILE A 77 -5.121 -2.123 -2.049 1.00 0.00 C ATOM 534 CG1 ILE A 77 -3.691 -1.628 -1.796 1.00 0.00 C ATOM 535 CG2 ILE A 77 -5.125 -3.652 -2.163 1.00 0.00 C ATOM 536 CD1 ILE A 77 -3.089 -2.347 -0.580 1.00 0.00 C ATOM 0 H ILE A 77 -6.110 0.432 -2.546 1.00 0.00 H new ATOM 0 HA ILE A 77 -5.053 -1.882 -4.176 1.00 0.00 H new ATOM 0 HB ILE A 77 -5.771 -1.839 -1.222 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -3.075 -1.809 -2.677 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -3.696 -0.551 -1.626 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -4.756 -4.087 -1.234 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -6.141 -4.000 -2.348 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -4.481 -3.957 -2.988 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -2.074 -1.987 -0.410 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -3.698 -2.144 0.301 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -3.067 -3.421 -0.766 1.00 0.00 H new ATOM 548 N GLN A 78 -7.422 -2.864 -4.267 1.00 0.00 N ATOM 549 CA GLN A 78 -8.854 -3.189 -4.531 1.00 0.00 C ATOM 550 C GLN A 78 -9.488 -3.832 -3.300 1.00 0.00 C ATOM 551 O GLN A 78 -9.768 -3.176 -2.316 1.00 0.00 O ATOM 552 CB GLN A 78 -8.945 -4.151 -5.718 1.00 0.00 C ATOM 553 CG GLN A 78 -8.565 -3.414 -7.004 1.00 0.00 C ATOM 554 CD GLN A 78 -8.667 -4.373 -8.191 1.00 0.00 C ATOM 555 OE1 GLN A 78 -9.496 -5.262 -8.200 1.00 0.00 O ATOM 556 NE2 GLN A 78 -7.853 -4.231 -9.201 1.00 0.00 N ATOM 0 H GLN A 78 -6.745 -3.514 -4.667 1.00 0.00 H new ATOM 0 HA GLN A 78 -9.391 -2.269 -4.761 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -8.280 -5.000 -5.563 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -9.956 -4.549 -5.800 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -9.225 -2.560 -7.155 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -7.551 -3.023 -6.925 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -7.157 -3.485 -9.194 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -7.913 -4.866 -9.997 1.00 0.00 H new ATOM 565 N ASN A 79 -9.730 -5.113 -3.352 1.00 0.00 N ATOM 566 CA ASN A 79 -10.362 -5.806 -2.193 1.00 0.00 C ATOM 567 C ASN A 79 -9.283 -6.234 -1.202 1.00 0.00 C ATOM 568 O ASN A 79 -8.311 -6.865 -1.563 1.00 0.00 O ATOM 569 CB ASN A 79 -11.114 -7.043 -2.691 1.00 0.00 C ATOM 570 CG ASN A 79 -12.221 -6.613 -3.656 1.00 0.00 C ATOM 571 OD1 ASN A 79 -12.974 -5.704 -3.369 1.00 0.00 O ATOM 572 ND2 ASN A 79 -12.352 -7.234 -4.796 1.00 0.00 N ATOM 0 H ASN A 79 -9.517 -5.712 -4.150 1.00 0.00 H new ATOM 0 HA ASN A 79 -11.058 -5.127 -1.700 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -10.425 -7.724 -3.191 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -11.542 -7.585 -1.848 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -13.087 -6.956 -5.447 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -11.720 -7.997 -5.037 1.00 0.00 H new ATOM 579 N GLN A 80 -9.452 -5.904 0.050 1.00 0.00 N ATOM 580 CA GLN A 80 -8.439 -6.299 1.068 1.00 0.00 C ATOM 581 C GLN A 80 -8.684 -7.754 1.480 1.00 0.00 C ATOM 582 O GLN A 80 -8.031 -8.280 2.359 1.00 0.00 O ATOM 583 CB GLN A 80 -8.560 -5.391 2.299 1.00 0.00 C ATOM 584 CG GLN A 80 -10.036 -5.225 2.693 1.00 0.00 C ATOM 585 CD GLN A 80 -10.683 -4.113 1.861 1.00 0.00 C ATOM 586 OE1 GLN A 80 -11.552 -4.370 1.051 1.00 0.00 O ATOM 587 NE2 GLN A 80 -10.296 -2.878 2.031 1.00 0.00 N ATOM 0 H GLN A 80 -10.248 -5.378 0.411 1.00 0.00 H new ATOM 0 HA GLN A 80 -7.439 -6.198 0.646 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -8.000 -5.818 3.131 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -8.121 -4.416 2.086 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -10.569 -6.163 2.538 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -10.112 -4.987 3.754 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -9.567 -2.661 2.710 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -10.723 -2.130 1.484 1.00 0.00 H new ATOM 596 N ALA A 81 -9.630 -8.406 0.856 1.00 0.00 N ATOM 597 CA ALA A 81 -9.930 -9.822 1.212 1.00 0.00 C ATOM 598 C ALA A 81 -9.000 -10.767 0.449 1.00 0.00 C ATOM 599 O ALA A 81 -8.066 -11.316 0.999 1.00 0.00 O ATOM 600 CB ALA A 81 -11.378 -10.144 0.839 1.00 0.00 C ATOM 0 H ALA A 81 -10.209 -8.016 0.112 1.00 0.00 H new ATOM 0 HA ALA A 81 -9.780 -9.955 2.283 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -11.599 -11.179 1.099 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -12.050 -9.482 1.384 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -11.518 -10.001 -0.232 1.00 0.00 H new ATOM 606 N GLN A 82 -9.264 -10.972 -0.810 1.00 0.00 N ATOM 607 CA GLN A 82 -8.414 -11.896 -1.616 1.00 0.00 C ATOM 608 C GLN A 82 -7.034 -11.268 -1.843 1.00 0.00 C ATOM 609 O GLN A 82 -6.298 -11.679 -2.712 1.00 0.00 O ATOM 610 CB GLN A 82 -9.118 -12.169 -2.969 1.00 0.00 C ATOM 611 CG GLN A 82 -9.201 -13.676 -3.236 1.00 0.00 C ATOM 612 CD GLN A 82 -9.544 -13.924 -4.706 1.00 0.00 C ATOM 613 OE1 GLN A 82 -10.465 -13.334 -5.236 1.00 0.00 O ATOM 614 NE2 GLN A 82 -8.836 -14.778 -5.391 1.00 0.00 N ATOM 0 H GLN A 82 -10.034 -10.539 -1.319 1.00 0.00 H new ATOM 0 HA GLN A 82 -8.277 -12.838 -1.085 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -10.120 -11.740 -2.958 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -8.571 -11.680 -3.775 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -8.251 -14.151 -2.990 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -9.959 -14.127 -2.595 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -8.063 -15.273 -4.946 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -9.055 -14.951 -6.372 1.00 0.00 H new ATOM 623 N PHE A 83 -6.690 -10.271 -1.077 1.00 0.00 N ATOM 624 CA PHE A 83 -5.369 -9.589 -1.239 1.00 0.00 C ATOM 625 C PHE A 83 -4.472 -9.928 -0.040 1.00 0.00 C ATOM 626 O PHE A 83 -3.407 -9.366 0.129 1.00 0.00 O ATOM 627 CB PHE A 83 -5.645 -8.080 -1.310 1.00 0.00 C ATOM 628 CG PHE A 83 -4.412 -7.271 -0.989 1.00 0.00 C ATOM 629 CD1 PHE A 83 -3.503 -6.909 -2.004 1.00 0.00 C ATOM 630 CD2 PHE A 83 -4.184 -6.872 0.337 1.00 0.00 C ATOM 631 CE1 PHE A 83 -2.366 -6.140 -1.681 1.00 0.00 C ATOM 632 CE2 PHE A 83 -3.049 -6.109 0.660 1.00 0.00 C ATOM 633 CZ PHE A 83 -2.141 -5.743 -0.346 1.00 0.00 C ATOM 0 H PHE A 83 -7.276 -9.892 -0.333 1.00 0.00 H new ATOM 0 HA PHE A 83 -4.856 -9.917 -2.143 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -6.000 -7.822 -2.308 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -6.441 -7.822 -0.612 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -3.677 -7.219 -3.024 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -4.883 -7.152 1.111 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -1.668 -5.855 -2.455 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -2.875 -5.804 1.682 1.00 0.00 H new ATOM 0 HZ PHE A 83 -1.269 -5.157 -0.098 1.00 0.00 H new ATOM 643 N ALA A 84 -4.896 -10.847 0.797 1.00 0.00 N ATOM 644 CA ALA A 84 -4.078 -11.225 1.996 1.00 0.00 C ATOM 645 C ALA A 84 -3.659 -12.698 1.923 1.00 0.00 C ATOM 646 O ALA A 84 -2.492 -13.021 2.005 1.00 0.00 O ATOM 647 CB ALA A 84 -4.915 -11.008 3.257 1.00 0.00 C ATOM 0 H ALA A 84 -5.776 -11.353 0.701 1.00 0.00 H new ATOM 0 HA ALA A 84 -3.182 -10.605 2.020 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -4.328 -11.280 4.134 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -5.205 -9.959 3.325 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -5.809 -11.629 3.211 1.00 0.00 H new ATOM 653 N LYS A 85 -4.601 -13.592 1.803 1.00 0.00 N ATOM 654 CA LYS A 85 -4.259 -15.045 1.766 1.00 0.00 C ATOM 655 C LYS A 85 -3.705 -15.465 0.398 1.00 0.00 C ATOM 656 O LYS A 85 -3.910 -16.582 -0.032 1.00 0.00 O ATOM 657 CB LYS A 85 -5.516 -15.856 2.066 1.00 0.00 C ATOM 658 CG LYS A 85 -6.538 -15.658 0.942 1.00 0.00 C ATOM 659 CD LYS A 85 -7.913 -16.159 1.397 1.00 0.00 C ATOM 660 CE LYS A 85 -7.776 -17.550 2.023 1.00 0.00 C ATOM 661 NZ LYS A 85 -9.115 -18.200 2.096 1.00 0.00 N ATOM 0 H LYS A 85 -5.596 -13.380 1.729 1.00 0.00 H new ATOM 0 HA LYS A 85 -3.488 -15.232 2.513 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -5.265 -16.912 2.161 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -5.944 -15.543 3.019 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -6.596 -14.604 0.672 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -6.221 -16.198 0.050 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -8.342 -15.465 2.120 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -8.596 -16.198 0.548 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -7.096 -18.161 1.430 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -7.345 -17.470 3.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -9.020 -19.144 2.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -9.751 -17.620 2.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -9.510 -18.290 1.138 1.00 0.00 H new ATOM 675 N GLU A 86 -3.009 -14.603 -0.296 1.00 0.00 N ATOM 676 CA GLU A 86 -2.471 -15.011 -1.627 1.00 0.00 C ATOM 677 C GLU A 86 -1.309 -14.098 -2.062 1.00 0.00 C ATOM 678 O GLU A 86 -0.781 -14.250 -3.147 1.00 0.00 O ATOM 679 CB GLU A 86 -3.606 -14.958 -2.666 1.00 0.00 C ATOM 680 CG GLU A 86 -4.661 -13.928 -2.250 1.00 0.00 C ATOM 681 CD GLU A 86 -3.986 -12.598 -1.904 1.00 0.00 C ATOM 682 OE1 GLU A 86 -3.707 -11.844 -2.818 1.00 0.00 O ATOM 683 OE2 GLU A 86 -3.766 -12.354 -0.730 1.00 0.00 O ATOM 0 H GLU A 86 -2.792 -13.650 -0.005 1.00 0.00 H new ATOM 0 HA GLU A 86 -2.084 -16.027 -1.553 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -3.201 -14.699 -3.644 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -4.066 -15.941 -2.762 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -5.377 -13.782 -3.058 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -5.221 -14.296 -1.390 1.00 0.00 H new ATOM 690 N LEU A 87 -0.899 -13.158 -1.244 1.00 0.00 N ATOM 691 CA LEU A 87 0.231 -12.255 -1.643 1.00 0.00 C ATOM 692 C LEU A 87 1.153 -11.991 -0.445 1.00 0.00 C ATOM 693 O LEU A 87 2.319 -11.697 -0.611 1.00 0.00 O ATOM 694 CB LEU A 87 -0.337 -10.926 -2.158 1.00 0.00 C ATOM 695 CG LEU A 87 -0.854 -11.095 -3.596 1.00 0.00 C ATOM 696 CD1 LEU A 87 -1.627 -9.835 -4.001 1.00 0.00 C ATOM 697 CD2 LEU A 87 0.323 -11.322 -4.576 1.00 0.00 C ATOM 0 H LEU A 87 -1.295 -12.976 -0.322 1.00 0.00 H new ATOM 0 HA LEU A 87 0.810 -12.738 -2.430 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -1.146 -10.592 -1.509 1.00 0.00 H new ATOM 0 HB3 LEU A 87 0.434 -10.156 -2.128 1.00 0.00 H new ATOM 0 HG LEU A 87 -1.510 -11.965 -3.638 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -1.997 -9.947 -5.020 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.468 -9.691 -3.323 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -0.966 -8.970 -3.948 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -0.064 -11.439 -5.588 1.00 0.00 H new ATOM 0 HD22 LEU A 87 0.996 -10.465 -4.542 1.00 0.00 H new ATOM 0 HD23 LEU A 87 0.867 -12.222 -4.289 1.00 0.00 H new ATOM 709 N LEU A 88 0.651 -12.081 0.759 1.00 0.00 N ATOM 710 CA LEU A 88 1.524 -11.821 1.946 1.00 0.00 C ATOM 711 C LEU A 88 2.313 -13.082 2.374 1.00 0.00 C ATOM 712 O LEU A 88 3.426 -12.950 2.842 1.00 0.00 O ATOM 713 CB LEU A 88 0.680 -11.316 3.126 1.00 0.00 C ATOM 714 CG LEU A 88 -0.310 -10.252 2.641 1.00 0.00 C ATOM 715 CD1 LEU A 88 -1.235 -9.856 3.793 1.00 0.00 C ATOM 716 CD2 LEU A 88 0.452 -9.016 2.153 1.00 0.00 C ATOM 0 H LEU A 88 -0.317 -12.321 0.973 1.00 0.00 H new ATOM 0 HA LEU A 88 2.245 -11.057 1.655 1.00 0.00 H new ATOM 0 HB2 LEU A 88 0.141 -12.147 3.581 1.00 0.00 H new ATOM 0 HB3 LEU A 88 1.329 -10.898 3.896 1.00 0.00 H new ATOM 0 HG LEU A 88 -0.900 -10.658 1.819 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -1.940 -9.099 3.450 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -1.783 -10.733 4.137 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -0.642 -9.453 4.614 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -0.258 -8.263 1.809 1.00 0.00 H new ATOM 0 HD22 LEU A 88 1.046 -8.608 2.971 1.00 0.00 H new ATOM 0 HD23 LEU A 88 1.111 -9.296 1.331 1.00 0.00 H new ATOM 728 N PRO A 89 1.744 -14.269 2.237 1.00 0.00 N ATOM 729 CA PRO A 89 2.448 -15.498 2.652 1.00 0.00 C ATOM 730 C PRO A 89 3.586 -15.810 1.667 1.00 0.00 C ATOM 731 O PRO A 89 4.388 -16.694 1.895 1.00 0.00 O ATOM 732 CB PRO A 89 1.364 -16.603 2.627 1.00 0.00 C ATOM 733 CG PRO A 89 0.068 -15.967 2.042 1.00 0.00 C ATOM 734 CD PRO A 89 0.395 -14.502 1.679 1.00 0.00 C ATOM 0 HA PRO A 89 2.907 -15.410 3.637 1.00 0.00 H new ATOM 0 HB2 PRO A 89 1.688 -17.446 2.016 1.00 0.00 H new ATOM 0 HB3 PRO A 89 1.184 -16.988 3.631 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -0.265 -16.516 1.161 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -0.743 -16.010 2.769 1.00 0.00 H new ATOM 0 HD2 PRO A 89 0.381 -14.349 0.600 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -0.335 -13.815 2.108 1.00 0.00 H new ATOM 742 N LEU A 90 3.652 -15.098 0.571 1.00 0.00 N ATOM 743 CA LEU A 90 4.726 -15.357 -0.439 1.00 0.00 C ATOM 744 C LEU A 90 5.852 -14.328 -0.292 1.00 0.00 C ATOM 745 O LEU A 90 6.874 -14.423 -0.941 1.00 0.00 O ATOM 746 CB LEU A 90 4.127 -15.252 -1.845 1.00 0.00 C ATOM 747 CG LEU A 90 2.777 -15.974 -1.881 1.00 0.00 C ATOM 748 CD1 LEU A 90 2.240 -15.977 -3.314 1.00 0.00 C ATOM 749 CD2 LEU A 90 2.953 -17.418 -1.398 1.00 0.00 C ATOM 0 H LEU A 90 3.007 -14.346 0.330 1.00 0.00 H new ATOM 0 HA LEU A 90 5.134 -16.355 -0.278 1.00 0.00 H new ATOM 0 HB2 LEU A 90 3.999 -14.205 -2.120 1.00 0.00 H new ATOM 0 HB3 LEU A 90 4.806 -15.692 -2.575 1.00 0.00 H new ATOM 0 HG LEU A 90 2.072 -15.458 -1.229 1.00 0.00 H new ATOM 0 HD11 LEU A 90 1.279 -16.491 -3.341 1.00 0.00 H new ATOM 0 HD12 LEU A 90 2.113 -14.950 -3.657 1.00 0.00 H new ATOM 0 HD13 LEU A 90 2.945 -16.492 -3.966 1.00 0.00 H new ATOM 0 HD21 LEU A 90 1.991 -17.930 -1.424 1.00 0.00 H new ATOM 0 HD22 LEU A 90 3.658 -17.936 -2.048 1.00 0.00 H new ATOM 0 HD23 LEU A 90 3.335 -17.416 -0.377 1.00 0.00 H new ATOM 761 N ASN A 91 5.680 -13.340 0.550 1.00 0.00 N ATOM 762 CA ASN A 91 6.756 -12.313 0.717 1.00 0.00 C ATOM 763 C ASN A 91 6.730 -11.743 2.140 1.00 0.00 C ATOM 764 O ASN A 91 7.442 -10.809 2.450 1.00 0.00 O ATOM 765 CB ASN A 91 6.532 -11.180 -0.287 1.00 0.00 C ATOM 766 CG ASN A 91 5.061 -10.765 -0.268 1.00 0.00 C ATOM 767 OD1 ASN A 91 4.307 -11.198 0.580 1.00 0.00 O ATOM 768 ND2 ASN A 91 4.617 -9.938 -1.175 1.00 0.00 N ATOM 0 H ASN A 91 4.849 -13.200 1.125 1.00 0.00 H new ATOM 0 HA ASN A 91 7.725 -12.781 0.541 1.00 0.00 H new ATOM 0 HB2 ASN A 91 7.164 -10.328 -0.037 1.00 0.00 H new ATOM 0 HB3 ASN A 91 6.816 -11.505 -1.288 1.00 0.00 H new ATOM 0 HD21 ASN A 91 3.637 -9.655 -1.172 1.00 0.00 H new ATOM 0 HD22 ASN A 91 5.250 -9.574 -1.887 1.00 0.00 H new ATOM 775 N TYR A 92 5.924 -12.291 3.011 1.00 0.00 N ATOM 776 CA TYR A 92 5.871 -11.768 4.411 1.00 0.00 C ATOM 777 C TYR A 92 5.502 -12.900 5.373 1.00 0.00 C ATOM 778 O TYR A 92 5.227 -12.672 6.534 1.00 0.00 O ATOM 779 CB TYR A 92 4.823 -10.655 4.502 1.00 0.00 C ATOM 780 CG TYR A 92 5.347 -9.413 3.818 1.00 0.00 C ATOM 781 CD1 TYR A 92 6.425 -8.702 4.382 1.00 0.00 C ATOM 782 CD2 TYR A 92 4.761 -8.965 2.617 1.00 0.00 C ATOM 783 CE1 TYR A 92 6.915 -7.546 3.747 1.00 0.00 C ATOM 784 CE2 TYR A 92 5.252 -7.808 1.983 1.00 0.00 C ATOM 785 CZ TYR A 92 6.329 -7.099 2.548 1.00 0.00 C ATOM 786 OH TYR A 92 6.810 -5.965 1.925 1.00 0.00 O ATOM 0 H TYR A 92 5.302 -13.075 2.816 1.00 0.00 H new ATOM 0 HA TYR A 92 6.848 -11.370 4.684 1.00 0.00 H new ATOM 0 HB2 TYR A 92 3.893 -10.977 4.033 1.00 0.00 H new ATOM 0 HB3 TYR A 92 4.595 -10.440 5.546 1.00 0.00 H new ATOM 0 HD1 TYR A 92 6.875 -9.045 5.302 1.00 0.00 H new ATOM 0 HD2 TYR A 92 3.935 -9.509 2.183 1.00 0.00 H new ATOM 0 HE1 TYR A 92 7.741 -7.001 4.180 1.00 0.00 H new ATOM 0 HE2 TYR A 92 4.802 -7.464 1.063 1.00 0.00 H new ATOM 0 HH TYR A 92 6.295 -5.797 1.109 1.00 0.00 H new ATOM 796 N LYS A 93 5.500 -14.118 4.903 1.00 0.00 N ATOM 797 CA LYS A 93 5.157 -15.266 5.792 1.00 0.00 C ATOM 798 C LYS A 93 3.807 -15.016 6.472 1.00 0.00 C ATOM 799 O LYS A 93 2.777 -15.459 6.006 1.00 0.00 O ATOM 800 CB LYS A 93 6.246 -15.432 6.854 1.00 0.00 C ATOM 801 CG LYS A 93 5.934 -16.666 7.710 1.00 0.00 C ATOM 802 CD LYS A 93 7.120 -16.985 8.635 1.00 0.00 C ATOM 803 CE LYS A 93 7.089 -16.074 9.867 1.00 0.00 C ATOM 804 NZ LYS A 93 5.791 -16.242 10.581 1.00 0.00 N ATOM 0 H LYS A 93 5.722 -14.369 3.939 1.00 0.00 H new ATOM 0 HA LYS A 93 5.090 -16.175 5.194 1.00 0.00 H new ATOM 0 HB2 LYS A 93 7.221 -15.542 6.378 1.00 0.00 H new ATOM 0 HB3 LYS A 93 6.296 -14.543 7.482 1.00 0.00 H new ATOM 0 HG2 LYS A 93 5.038 -16.488 8.304 1.00 0.00 H new ATOM 0 HG3 LYS A 93 5.725 -17.521 7.066 1.00 0.00 H new ATOM 0 HD2 LYS A 93 7.079 -18.029 8.945 1.00 0.00 H new ATOM 0 HD3 LYS A 93 8.058 -16.849 8.096 1.00 0.00 H new ATOM 0 HE2 LYS A 93 7.916 -16.318 10.533 1.00 0.00 H new ATOM 0 HE3 LYS A 93 7.218 -15.034 9.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 5.959 -16.256 11.607 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 5.159 -15.451 10.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 5.348 -17.137 10.291 1.00 0.00 H new ATOM 818 N HIS A 94 3.801 -14.314 7.575 1.00 0.00 N ATOM 819 CA HIS A 94 2.516 -14.044 8.284 1.00 0.00 C ATOM 820 C HIS A 94 1.457 -13.583 7.280 1.00 0.00 C ATOM 821 O HIS A 94 1.700 -12.723 6.456 1.00 0.00 O ATOM 822 CB HIS A 94 2.732 -12.955 9.336 1.00 0.00 C ATOM 823 CG HIS A 94 3.099 -11.663 8.659 1.00 0.00 C ATOM 824 ND1 HIS A 94 2.167 -10.895 7.979 1.00 0.00 N ATOM 825 CD2 HIS A 94 4.291 -10.991 8.549 1.00 0.00 C ATOM 826 CE1 HIS A 94 2.808 -9.814 7.495 1.00 0.00 C ATOM 827 NE2 HIS A 94 4.105 -9.823 7.815 1.00 0.00 N ATOM 0 H HIS A 94 4.631 -13.916 8.015 1.00 0.00 H new ATOM 0 HA HIS A 94 2.175 -14.958 8.771 1.00 0.00 H new ATOM 0 HB2 HIS A 94 1.826 -12.822 9.928 1.00 0.00 H new ATOM 0 HB3 HIS A 94 3.522 -13.253 10.025 1.00 0.00 H new ATOM 0 HD1 HIS A 94 1.176 -11.109 7.866 1.00 0.00 H new ATOM 0 HD2 HIS A 94 5.231 -11.319 8.968 1.00 0.00 H new ATOM 0 HE1 HIS A 94 2.332 -9.035 6.918 1.00 0.00 H new ATOM 835 N ASN A 95 0.281 -14.151 7.341 1.00 0.00 N ATOM 836 CA ASN A 95 -0.801 -13.752 6.392 1.00 0.00 C ATOM 837 C ASN A 95 -1.610 -12.601 6.995 1.00 0.00 C ATOM 838 O ASN A 95 -1.164 -11.471 7.038 1.00 0.00 O ATOM 839 CB ASN A 95 -1.724 -14.947 6.145 1.00 0.00 C ATOM 840 CG ASN A 95 -2.901 -14.511 5.269 1.00 0.00 C ATOM 841 OD1 ASN A 95 -3.005 -13.358 4.901 1.00 0.00 O ATOM 842 ND2 ASN A 95 -3.798 -15.392 4.919 1.00 0.00 N ATOM 0 H ASN A 95 0.022 -14.877 8.010 1.00 0.00 H new ATOM 0 HA ASN A 95 -0.359 -13.430 5.449 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -1.173 -15.751 5.658 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -2.089 -15.340 7.094 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -4.587 -15.113 4.336 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -3.710 -16.360 5.228 1.00 0.00 H new ATOM 849 N ASN A 96 -2.798 -12.878 7.461 1.00 0.00 N ATOM 850 CA ASN A 96 -3.634 -11.800 8.060 1.00 0.00 C ATOM 851 C ASN A 96 -3.707 -10.615 7.094 1.00 0.00 C ATOM 852 O ASN A 96 -3.234 -10.682 5.978 1.00 0.00 O ATOM 853 CB ASN A 96 -3.010 -11.343 9.380 1.00 0.00 C ATOM 854 CG ASN A 96 -3.257 -12.404 10.455 1.00 0.00 C ATOM 855 OD1 ASN A 96 -2.911 -13.555 10.279 1.00 0.00 O ATOM 856 ND2 ASN A 96 -3.844 -12.062 11.569 1.00 0.00 N ATOM 0 H ASN A 96 -3.225 -13.804 7.452 1.00 0.00 H new ATOM 0 HA ASN A 96 -4.638 -12.181 8.246 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -1.940 -11.182 9.252 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -3.441 -10.390 9.688 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -4.012 -12.761 12.292 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -4.134 -11.095 11.717 1.00 0.00 H new ATOM 863 N MET A 97 -4.295 -9.527 7.517 1.00 0.00 N ATOM 864 CA MET A 97 -4.399 -8.330 6.628 1.00 0.00 C ATOM 865 C MET A 97 -4.337 -7.066 7.488 1.00 0.00 C ATOM 866 O MET A 97 -3.391 -6.305 7.421 1.00 0.00 O ATOM 867 CB MET A 97 -5.732 -8.375 5.867 1.00 0.00 C ATOM 868 CG MET A 97 -5.670 -7.454 4.643 1.00 0.00 C ATOM 869 SD MET A 97 -5.580 -5.726 5.178 1.00 0.00 S ATOM 870 CE MET A 97 -4.728 -5.083 3.717 1.00 0.00 C ATOM 0 H MET A 97 -4.709 -9.415 8.442 1.00 0.00 H new ATOM 0 HA MET A 97 -3.578 -8.326 5.911 1.00 0.00 H new ATOM 0 HB2 MET A 97 -5.946 -9.397 5.553 1.00 0.00 H new ATOM 0 HB3 MET A 97 -6.545 -8.066 6.524 1.00 0.00 H new ATOM 0 HG2 MET A 97 -4.800 -7.701 4.034 1.00 0.00 H new ATOM 0 HG3 MET A 97 -6.550 -7.605 4.018 1.00 0.00 H new ATOM 0 HE1 MET A 97 -4.613 -4.003 3.809 1.00 0.00 H new ATOM 0 HE2 MET A 97 -3.745 -5.547 3.635 1.00 0.00 H new ATOM 0 HE3 MET A 97 -5.312 -5.311 2.825 1.00 0.00 H new ATOM 880 N ALA A 98 -5.333 -6.837 8.300 1.00 0.00 N ATOM 881 CA ALA A 98 -5.322 -5.625 9.167 1.00 0.00 C ATOM 882 C ALA A 98 -3.967 -5.521 9.866 1.00 0.00 C ATOM 883 O ALA A 98 -3.576 -4.470 10.331 1.00 0.00 O ATOM 884 CB ALA A 98 -6.432 -5.734 10.215 1.00 0.00 C ATOM 0 H ALA A 98 -6.153 -7.436 8.400 1.00 0.00 H new ATOM 0 HA ALA A 98 -5.489 -4.737 8.558 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -6.423 -4.847 10.848 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -7.398 -5.813 9.715 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -6.267 -6.620 10.829 1.00 0.00 H new ATOM 890 N SER A 99 -3.240 -6.604 9.930 1.00 0.00 N ATOM 891 CA SER A 99 -1.904 -6.563 10.584 1.00 0.00 C ATOM 892 C SER A 99 -0.936 -5.833 9.656 1.00 0.00 C ATOM 893 O SER A 99 -0.122 -5.039 10.086 1.00 0.00 O ATOM 894 CB SER A 99 -1.408 -7.988 10.830 1.00 0.00 C ATOM 895 OG SER A 99 -0.250 -7.946 11.653 1.00 0.00 O ATOM 0 H SER A 99 -3.514 -7.513 9.558 1.00 0.00 H new ATOM 0 HA SER A 99 -1.969 -6.044 11.540 1.00 0.00 H new ATOM 0 HB2 SER A 99 -2.188 -8.579 11.310 1.00 0.00 H new ATOM 0 HB3 SER A 99 -1.177 -8.474 9.882 1.00 0.00 H new ATOM 0 HG SER A 99 0.070 -8.858 11.814 1.00 0.00 H new ATOM 901 N PHE A 100 -1.031 -6.088 8.381 1.00 0.00 N ATOM 902 CA PHE A 100 -0.133 -5.405 7.414 1.00 0.00 C ATOM 903 C PHE A 100 -0.450 -3.908 7.424 1.00 0.00 C ATOM 904 O PHE A 100 0.431 -3.075 7.358 1.00 0.00 O ATOM 905 CB PHE A 100 -0.369 -5.973 6.009 1.00 0.00 C ATOM 906 CG PHE A 100 0.357 -5.121 4.989 1.00 0.00 C ATOM 907 CD1 PHE A 100 1.759 -5.011 5.037 1.00 0.00 C ATOM 908 CD2 PHE A 100 -0.369 -4.425 4.000 1.00 0.00 C ATOM 909 CE1 PHE A 100 2.437 -4.208 4.101 1.00 0.00 C ATOM 910 CE2 PHE A 100 0.310 -3.624 3.061 1.00 0.00 C ATOM 911 CZ PHE A 100 1.713 -3.514 3.114 1.00 0.00 C ATOM 0 H PHE A 100 -1.695 -6.743 7.967 1.00 0.00 H new ATOM 0 HA PHE A 100 0.908 -5.565 7.693 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -0.014 -7.002 5.957 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -1.436 -5.993 5.788 1.00 0.00 H new ATOM 0 HD1 PHE A 100 2.316 -5.544 5.794 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -1.445 -4.506 3.963 1.00 0.00 H new ATOM 0 HE1 PHE A 100 3.513 -4.124 4.140 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -0.245 -3.094 2.301 1.00 0.00 H new ATOM 0 HZ PHE A 100 2.233 -2.897 2.397 1.00 0.00 H new ATOM 921 N ILE A 101 -1.705 -3.563 7.504 1.00 0.00 N ATOM 922 CA ILE A 101 -2.077 -2.124 7.516 1.00 0.00 C ATOM 923 C ILE A 101 -1.438 -1.450 8.730 1.00 0.00 C ATOM 924 O ILE A 101 -0.916 -0.358 8.633 1.00 0.00 O ATOM 925 CB ILE A 101 -3.606 -1.998 7.552 1.00 0.00 C ATOM 926 CG1 ILE A 101 -4.173 -2.729 6.326 1.00 0.00 C ATOM 927 CG2 ILE A 101 -4.023 -0.518 7.515 1.00 0.00 C ATOM 928 CD1 ILE A 101 -5.668 -2.435 6.169 1.00 0.00 C ATOM 0 H ILE A 101 -2.487 -4.215 7.561 1.00 0.00 H new ATOM 0 HA ILE A 101 -1.712 -1.629 6.616 1.00 0.00 H new ATOM 0 HB ILE A 101 -3.993 -2.437 8.471 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -3.639 -2.415 5.429 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -4.017 -3.803 6.431 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -5.110 -0.446 7.541 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -3.604 -0.000 8.378 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -3.651 -0.058 6.600 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -6.053 -2.961 5.295 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -6.200 -2.771 7.059 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -5.816 -1.363 6.041 1.00 0.00 H new ATOM 940 N ARG A 102 -1.451 -2.088 9.871 1.00 0.00 N ATOM 941 CA ARG A 102 -0.815 -1.463 11.064 1.00 0.00 C ATOM 942 C ARG A 102 0.589 -1.002 10.680 1.00 0.00 C ATOM 943 O ARG A 102 0.941 0.152 10.830 1.00 0.00 O ATOM 944 CB ARG A 102 -0.724 -2.490 12.189 1.00 0.00 C ATOM 945 CG ARG A 102 -2.109 -2.689 12.798 1.00 0.00 C ATOM 946 CD ARG A 102 -2.015 -3.670 13.963 1.00 0.00 C ATOM 947 NE ARG A 102 -1.181 -4.838 13.566 1.00 0.00 N ATOM 948 CZ ARG A 102 -0.719 -5.650 14.477 1.00 0.00 C ATOM 949 NH1 ARG A 102 -0.989 -5.438 15.736 1.00 0.00 N ATOM 950 NH2 ARG A 102 0.011 -6.674 14.130 1.00 0.00 N ATOM 0 H ARG A 102 -1.870 -3.005 10.026 1.00 0.00 H new ATOM 0 HA ARG A 102 -1.408 -0.614 11.403 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -0.343 -3.436 11.804 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -0.023 -2.151 12.952 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -2.507 -1.735 13.143 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -2.799 -3.068 12.044 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -1.579 -3.177 14.832 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -3.012 -4.003 14.252 1.00 0.00 H new ATOM 0 HE ARG A 102 -0.971 -5.003 12.582 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -1.561 -4.638 16.007 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -0.628 -6.072 16.449 1.00 0.00 H new ATOM 0 HH21 ARG A 102 0.221 -6.840 13.146 1.00 0.00 H new ATOM 0 HH22 ARG A 102 0.372 -7.308 14.843 1.00 0.00 H new ATOM 964 N GLN A 103 1.388 -1.898 10.166 1.00 0.00 N ATOM 965 CA GLN A 103 2.766 -1.528 9.750 1.00 0.00 C ATOM 966 C GLN A 103 2.722 -0.238 8.929 1.00 0.00 C ATOM 967 O GLN A 103 3.510 0.665 9.133 1.00 0.00 O ATOM 968 CB GLN A 103 3.348 -2.658 8.902 1.00 0.00 C ATOM 969 CG GLN A 103 3.569 -3.894 9.777 1.00 0.00 C ATOM 970 CD GLN A 103 4.777 -3.666 10.687 1.00 0.00 C ATOM 971 OE1 GLN A 103 5.391 -2.618 10.651 1.00 0.00 O ATOM 972 NE2 GLN A 103 5.146 -4.610 11.509 1.00 0.00 N ATOM 0 H GLN A 103 1.141 -2.876 10.017 1.00 0.00 H new ATOM 0 HA GLN A 103 3.389 -1.371 10.630 1.00 0.00 H new ATOM 0 HB2 GLN A 103 2.671 -2.897 8.082 1.00 0.00 H new ATOM 0 HB3 GLN A 103 4.291 -2.343 8.455 1.00 0.00 H new ATOM 0 HG2 GLN A 103 2.681 -4.091 10.377 1.00 0.00 H new ATOM 0 HG3 GLN A 103 3.732 -4.771 9.151 1.00 0.00 H new ATOM 0 HE21 GLN A 103 4.631 -5.490 11.540 1.00 0.00 H new ATOM 0 HE22 GLN A 103 5.950 -4.468 12.121 1.00 0.00 H new ATOM 981 N LEU A 104 1.804 -0.139 8.006 1.00 0.00 N ATOM 982 CA LEU A 104 1.713 1.100 7.185 1.00 0.00 C ATOM 983 C LEU A 104 1.493 2.297 8.110 1.00 0.00 C ATOM 984 O LEU A 104 1.933 3.394 7.837 1.00 0.00 O ATOM 985 CB LEU A 104 0.543 0.995 6.201 1.00 0.00 C ATOM 986 CG LEU A 104 0.679 -0.267 5.337 1.00 0.00 C ATOM 987 CD1 LEU A 104 -0.457 -0.290 4.316 1.00 0.00 C ATOM 988 CD2 LEU A 104 2.032 -0.261 4.601 1.00 0.00 C ATOM 0 H LEU A 104 1.116 -0.860 7.786 1.00 0.00 H new ATOM 0 HA LEU A 104 2.638 1.228 6.623 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -0.399 0.968 6.749 1.00 0.00 H new ATOM 0 HB3 LEU A 104 0.516 1.878 5.563 1.00 0.00 H new ATOM 0 HG LEU A 104 0.629 -1.151 5.973 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -0.371 -1.182 3.696 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -1.414 -0.301 4.837 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -0.397 0.597 3.685 1.00 0.00 H new ATOM 0 HD21 LEU A 104 2.118 -1.160 3.991 1.00 0.00 H new ATOM 0 HD22 LEU A 104 2.094 0.619 3.961 1.00 0.00 H new ATOM 0 HD23 LEU A 104 2.842 -0.237 5.330 1.00 0.00 H new ATOM 1000 N ASN A 105 0.815 2.098 9.206 1.00 0.00 N ATOM 1001 CA ASN A 105 0.571 3.230 10.141 1.00 0.00 C ATOM 1002 C ASN A 105 1.823 3.483 10.983 1.00 0.00 C ATOM 1003 O ASN A 105 2.092 4.596 11.390 1.00 0.00 O ATOM 1004 CB ASN A 105 -0.603 2.890 11.061 1.00 0.00 C ATOM 1005 CG ASN A 105 -1.883 2.776 10.231 1.00 0.00 C ATOM 1006 OD1 ASN A 105 -2.371 1.690 9.990 1.00 0.00 O ATOM 1007 ND2 ASN A 105 -2.453 3.861 9.781 1.00 0.00 N ATOM 0 H ASN A 105 0.420 1.202 9.494 1.00 0.00 H new ATOM 0 HA ASN A 105 0.335 4.126 9.567 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -0.410 1.953 11.583 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -0.718 3.661 11.822 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -3.307 3.796 9.228 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -2.044 4.773 9.983 1.00 0.00 H new ATOM 1014 N MET A 106 2.596 2.464 11.250 1.00 0.00 N ATOM 1015 CA MET A 106 3.826 2.668 12.065 1.00 0.00 C ATOM 1016 C MET A 106 4.864 3.432 11.234 1.00 0.00 C ATOM 1017 O MET A 106 5.673 4.164 11.767 1.00 0.00 O ATOM 1018 CB MET A 106 4.404 1.307 12.500 1.00 0.00 C ATOM 1019 CG MET A 106 3.645 0.744 13.720 1.00 0.00 C ATOM 1020 SD MET A 106 2.225 -0.227 13.158 1.00 0.00 S ATOM 1021 CE MET A 106 3.032 -1.847 13.164 1.00 0.00 C ATOM 0 H MET A 106 2.430 1.506 10.941 1.00 0.00 H new ATOM 0 HA MET A 106 3.576 3.244 12.956 1.00 0.00 H new ATOM 0 HB2 MET A 106 4.342 0.601 11.672 1.00 0.00 H new ATOM 0 HB3 MET A 106 5.460 1.419 12.745 1.00 0.00 H new ATOM 0 HG2 MET A 106 4.310 0.121 14.319 1.00 0.00 H new ATOM 0 HG3 MET A 106 3.310 1.560 14.360 1.00 0.00 H new ATOM 0 HE1 MET A 106 2.444 -2.548 12.572 1.00 0.00 H new ATOM 0 HE2 MET A 106 4.030 -1.758 12.736 1.00 0.00 H new ATOM 0 HE3 MET A 106 3.108 -2.212 14.188 1.00 0.00 H new ATOM 1031 N TYR A 107 4.849 3.283 9.933 1.00 0.00 N ATOM 1032 CA TYR A 107 5.837 4.020 9.099 1.00 0.00 C ATOM 1033 C TYR A 107 5.368 5.469 8.920 1.00 0.00 C ATOM 1034 O TYR A 107 6.096 6.399 9.205 1.00 0.00 O ATOM 1035 CB TYR A 107 5.978 3.360 7.722 1.00 0.00 C ATOM 1036 CG TYR A 107 6.137 1.850 7.825 1.00 0.00 C ATOM 1037 CD1 TYR A 107 6.942 1.266 8.830 1.00 0.00 C ATOM 1038 CD2 TYR A 107 5.484 1.023 6.887 1.00 0.00 C ATOM 1039 CE1 TYR A 107 7.084 -0.135 8.892 1.00 0.00 C ATOM 1040 CE2 TYR A 107 5.630 -0.375 6.950 1.00 0.00 C ATOM 1041 CZ TYR A 107 6.429 -0.953 7.953 1.00 0.00 C ATOM 1042 OH TYR A 107 6.578 -2.325 8.014 1.00 0.00 O ATOM 0 H TYR A 107 4.200 2.687 9.419 1.00 0.00 H new ATOM 0 HA TYR A 107 6.805 3.999 9.600 1.00 0.00 H new ATOM 0 HB2 TYR A 107 5.101 3.591 7.118 1.00 0.00 H new ATOM 0 HB3 TYR A 107 6.841 3.781 7.205 1.00 0.00 H new ATOM 0 HD1 TYR A 107 7.448 1.893 9.550 1.00 0.00 H new ATOM 0 HD2 TYR A 107 4.869 1.465 6.117 1.00 0.00 H new ATOM 0 HE1 TYR A 107 7.697 -0.581 9.661 1.00 0.00 H new ATOM 0 HE2 TYR A 107 5.129 -1.004 6.229 1.00 0.00 H new ATOM 0 HH TYR A 107 6.800 -2.670 7.124 1.00 0.00 H new ATOM 1052 N GLY A 108 4.158 5.681 8.460 1.00 0.00 N ATOM 1053 CA GLY A 108 3.668 7.084 8.282 1.00 0.00 C ATOM 1054 C GLY A 108 2.674 7.165 7.117 1.00 0.00 C ATOM 1055 O GLY A 108 2.591 8.167 6.434 1.00 0.00 O ATOM 0 H GLY A 108 3.494 4.951 8.202 1.00 0.00 H new ATOM 0 HA2 GLY A 108 3.190 7.427 9.200 1.00 0.00 H new ATOM 0 HA3 GLY A 108 4.511 7.748 8.094 1.00 0.00 H new ATOM 1059 N PHE A 109 1.914 6.130 6.885 1.00 0.00 N ATOM 1060 CA PHE A 109 0.925 6.164 5.769 1.00 0.00 C ATOM 1061 C PHE A 109 -0.365 6.805 6.288 1.00 0.00 C ATOM 1062 O PHE A 109 -0.502 7.068 7.466 1.00 0.00 O ATOM 1063 CB PHE A 109 0.622 4.737 5.302 1.00 0.00 C ATOM 1064 CG PHE A 109 1.785 4.178 4.502 1.00 0.00 C ATOM 1065 CD1 PHE A 109 3.052 4.038 5.101 1.00 0.00 C ATOM 1066 CD2 PHE A 109 1.597 3.778 3.162 1.00 0.00 C ATOM 1067 CE1 PHE A 109 4.125 3.496 4.368 1.00 0.00 C ATOM 1068 CE2 PHE A 109 2.677 3.241 2.431 1.00 0.00 C ATOM 1069 CZ PHE A 109 3.936 3.098 3.036 1.00 0.00 C ATOM 0 H PHE A 109 1.935 5.262 7.420 1.00 0.00 H new ATOM 0 HA PHE A 109 1.328 6.736 4.933 1.00 0.00 H new ATOM 0 HB2 PHE A 109 0.428 4.100 6.165 1.00 0.00 H new ATOM 0 HB3 PHE A 109 -0.281 4.732 4.692 1.00 0.00 H new ATOM 0 HD1 PHE A 109 3.201 4.347 6.125 1.00 0.00 H new ATOM 0 HD2 PHE A 109 0.628 3.883 2.697 1.00 0.00 H new ATOM 0 HE1 PHE A 109 5.094 3.387 4.831 1.00 0.00 H new ATOM 0 HE2 PHE A 109 2.535 2.939 1.404 1.00 0.00 H new ATOM 0 HZ PHE A 109 4.760 2.681 2.475 1.00 0.00 H new ATOM 1079 N HIS A 110 -1.315 7.056 5.429 1.00 0.00 N ATOM 1080 CA HIS A 110 -2.594 7.678 5.892 1.00 0.00 C ATOM 1081 C HIS A 110 -3.741 7.237 4.981 1.00 0.00 C ATOM 1082 O HIS A 110 -4.115 7.939 4.063 1.00 0.00 O ATOM 1083 CB HIS A 110 -2.464 9.202 5.847 1.00 0.00 C ATOM 1084 CG HIS A 110 -3.700 9.828 6.430 1.00 0.00 C ATOM 1085 ND1 HIS A 110 -3.920 9.897 7.796 1.00 0.00 N ATOM 1086 CD2 HIS A 110 -4.793 10.420 5.843 1.00 0.00 C ATOM 1087 CE1 HIS A 110 -5.104 10.510 7.986 1.00 0.00 C ATOM 1088 NE2 HIS A 110 -5.678 10.848 6.828 1.00 0.00 N ATOM 0 H HIS A 110 -1.264 6.859 4.429 1.00 0.00 H new ATOM 0 HA HIS A 110 -2.802 7.359 6.913 1.00 0.00 H new ATOM 0 HB2 HIS A 110 -1.584 9.519 6.407 1.00 0.00 H new ATOM 0 HB3 HIS A 110 -2.325 9.536 4.819 1.00 0.00 H new ATOM 0 HD2 HIS A 110 -4.942 10.535 4.780 1.00 0.00 H new ATOM 0 HE1 HIS A 110 -5.537 10.705 8.956 1.00 0.00 H new ATOM 0 HE2 HIS A 110 -6.573 11.319 6.694 1.00 0.00 H new ATOM 1096 N LYS A 111 -4.309 6.085 5.221 1.00 0.00 N ATOM 1097 CA LYS A 111 -5.427 5.631 4.354 1.00 0.00 C ATOM 1098 C LYS A 111 -6.616 6.572 4.525 1.00 0.00 C ATOM 1099 O LYS A 111 -6.553 7.535 5.262 1.00 0.00 O ATOM 1100 CB LYS A 111 -5.821 4.194 4.713 1.00 0.00 C ATOM 1101 CG LYS A 111 -6.473 4.140 6.102 1.00 0.00 C ATOM 1102 CD LYS A 111 -6.781 2.680 6.464 1.00 0.00 C ATOM 1103 CE LYS A 111 -7.734 2.067 5.426 1.00 0.00 C ATOM 1104 NZ LYS A 111 -8.671 3.111 4.918 1.00 0.00 N ATOM 0 H LYS A 111 -4.048 5.447 5.973 1.00 0.00 H new ATOM 0 HA LYS A 111 -5.109 5.648 3.312 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -6.512 3.804 3.966 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -4.938 3.555 4.695 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -5.807 4.578 6.846 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -7.390 4.729 6.109 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -5.856 2.105 6.504 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -7.231 2.630 7.456 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -7.163 1.645 4.599 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -8.297 1.248 5.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -9.172 2.750 4.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -9.361 3.348 5.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -8.134 3.963 4.660 1.00 0.00 H new ATOM 1118 N ILE A 112 -7.697 6.314 3.833 1.00 0.00 N ATOM 1119 CA ILE A 112 -8.885 7.211 3.936 1.00 0.00 C ATOM 1120 C ILE A 112 -10.177 6.391 3.873 1.00 0.00 C ATOM 1121 O ILE A 112 -11.060 6.673 3.087 1.00 0.00 O ATOM 1122 CB ILE A 112 -8.848 8.205 2.775 1.00 0.00 C ATOM 1123 CG1 ILE A 112 -7.405 8.683 2.583 1.00 0.00 C ATOM 1124 CG2 ILE A 112 -9.749 9.404 3.088 1.00 0.00 C ATOM 1125 CD1 ILE A 112 -7.369 9.818 1.565 1.00 0.00 C ATOM 0 H ILE A 112 -7.807 5.521 3.201 1.00 0.00 H new ATOM 0 HA ILE A 112 -8.860 7.743 4.887 1.00 0.00 H new ATOM 0 HB ILE A 112 -9.206 7.723 1.865 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -6.995 9.022 3.534 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -6.781 7.857 2.243 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -9.718 10.109 2.257 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -10.773 9.061 3.235 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -9.397 9.897 3.995 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -6.341 10.155 1.432 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -7.761 9.464 0.612 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -7.979 10.647 1.923 1.00 0.00 H new ATOM 1137 N THR A 113 -10.304 5.385 4.698 1.00 0.00 N ATOM 1138 CA THR A 113 -11.553 4.568 4.680 1.00 0.00 C ATOM 1139 C THR A 113 -11.681 3.806 6.008 1.00 0.00 C ATOM 1140 O THR A 113 -12.346 2.796 6.106 1.00 0.00 O ATOM 1141 CB THR A 113 -11.535 3.646 3.428 1.00 0.00 C ATOM 1142 OG1 THR A 113 -12.732 3.857 2.693 1.00 0.00 O ATOM 1143 CG2 THR A 113 -11.425 2.144 3.761 1.00 0.00 C ATOM 0 H THR A 113 -9.602 5.095 5.379 1.00 0.00 H new ATOM 0 HA THR A 113 -12.440 5.196 4.597 1.00 0.00 H new ATOM 0 HB THR A 113 -10.646 3.910 2.856 1.00 0.00 H new ATOM 0 HG1 THR A 113 -12.734 3.283 1.899 1.00 0.00 H new ATOM 0 HG21 THR A 113 -11.418 1.566 2.837 1.00 0.00 H new ATOM 0 HG22 THR A 113 -10.502 1.960 4.311 1.00 0.00 H new ATOM 0 HG23 THR A 113 -12.277 1.843 4.371 1.00 0.00 H new ATOM 1151 N SER A 114 -11.052 4.311 7.037 1.00 0.00 N ATOM 1152 CA SER A 114 -11.119 3.655 8.382 1.00 0.00 C ATOM 1153 C SER A 114 -11.522 4.693 9.432 1.00 0.00 C ATOM 1154 O SER A 114 -12.623 4.675 9.944 1.00 0.00 O ATOM 1155 CB SER A 114 -9.744 3.087 8.738 1.00 0.00 C ATOM 1156 OG SER A 114 -9.704 2.789 10.127 1.00 0.00 O ATOM 0 H SER A 114 -10.487 5.160 7.005 1.00 0.00 H new ATOM 0 HA SER A 114 -11.854 2.850 8.359 1.00 0.00 H new ATOM 0 HB2 SER A 114 -9.548 2.187 8.155 1.00 0.00 H new ATOM 0 HB3 SER A 114 -8.964 3.806 8.486 1.00 0.00 H new ATOM 0 HG SER A 114 -8.825 2.423 10.358 1.00 0.00 H new ATOM 1162 N ILE A 115 -10.639 5.598 9.755 1.00 0.00 N ATOM 1163 CA ILE A 115 -10.973 6.637 10.770 1.00 0.00 C ATOM 1164 C ILE A 115 -12.317 7.278 10.412 1.00 0.00 C ATOM 1165 O ILE A 115 -12.951 7.914 11.231 1.00 0.00 O ATOM 1166 CB ILE A 115 -9.872 7.704 10.780 1.00 0.00 C ATOM 1167 CG1 ILE A 115 -10.248 8.858 11.723 1.00 0.00 C ATOM 1168 CG2 ILE A 115 -9.685 8.252 9.364 1.00 0.00 C ATOM 1169 CD1 ILE A 115 -10.567 8.320 13.123 1.00 0.00 C ATOM 0 H ILE A 115 -9.701 5.663 9.360 1.00 0.00 H new ATOM 0 HA ILE A 115 -11.043 6.183 11.758 1.00 0.00 H new ATOM 0 HB ILE A 115 -8.946 7.249 11.131 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -9.427 9.573 11.779 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -11.111 9.394 11.327 1.00 0.00 H new ATOM 0 HG21 ILE A 115 -8.903 9.011 9.368 1.00 0.00 H new ATOM 0 HG22 ILE A 115 -9.400 7.440 8.695 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -10.619 8.696 9.019 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -10.831 9.149 13.780 1.00 0.00 H new ATOM 0 HD12 ILE A 115 -11.403 7.623 13.063 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -9.693 7.805 13.523 1.00 0.00 H new ATOM 1181 N ASP A 116 -12.760 7.112 9.194 1.00 0.00 N ATOM 1182 CA ASP A 116 -14.063 7.709 8.778 1.00 0.00 C ATOM 1183 C ASP A 116 -14.691 6.844 7.683 1.00 0.00 C ATOM 1184 O ASP A 116 -14.562 7.123 6.507 1.00 0.00 O ATOM 1185 CB ASP A 116 -13.828 9.122 8.239 1.00 0.00 C ATOM 1186 CG ASP A 116 -12.632 9.113 7.286 1.00 0.00 C ATOM 1187 OD1 ASP A 116 -12.402 8.087 6.665 1.00 0.00 O ATOM 1188 OD2 ASP A 116 -11.965 10.130 7.192 1.00 0.00 O ATOM 0 H ASP A 116 -12.274 6.587 8.467 1.00 0.00 H new ATOM 0 HA ASP A 116 -14.733 7.755 9.636 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -14.718 9.477 7.719 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -13.644 9.811 9.063 1.00 0.00 H new ATOM 1193 N ASN A 117 -15.372 5.796 8.060 1.00 0.00 N ATOM 1194 CA ASN A 117 -16.008 4.914 7.041 1.00 0.00 C ATOM 1195 C ASN A 117 -16.799 5.767 6.049 1.00 0.00 C ATOM 1196 O ASN A 117 -17.709 6.483 6.417 1.00 0.00 O ATOM 1197 CB ASN A 117 -16.953 3.932 7.736 1.00 0.00 C ATOM 1198 CG ASN A 117 -16.149 3.016 8.660 1.00 0.00 C ATOM 1199 OD1 ASN A 117 -15.627 3.456 9.666 1.00 0.00 O ATOM 1200 ND2 ASN A 117 -16.024 1.752 8.361 1.00 0.00 N ATOM 0 H ASN A 117 -15.515 5.513 9.029 1.00 0.00 H new ATOM 0 HA ASN A 117 -15.236 4.360 6.507 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -17.703 4.477 8.309 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -17.488 3.339 6.994 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -15.489 1.134 8.971 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -16.462 1.382 7.517 1.00 0.00 H new ATOM 1207 N GLY A 118 -16.459 5.696 4.792 1.00 0.00 N ATOM 1208 CA GLY A 118 -17.192 6.502 3.776 1.00 0.00 C ATOM 1209 C GLY A 118 -16.748 6.084 2.374 1.00 0.00 C ATOM 1210 O GLY A 118 -16.084 5.082 2.195 1.00 0.00 O ATOM 0 H GLY A 118 -15.706 5.115 4.424 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -18.266 6.356 3.887 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -16.997 7.563 3.929 1.00 0.00 H new ATOM 1214 N GLY A 119 -17.108 6.844 1.376 1.00 0.00 N ATOM 1215 CA GLY A 119 -16.706 6.488 -0.014 1.00 0.00 C ATOM 1216 C GLY A 119 -17.337 5.148 -0.400 1.00 0.00 C ATOM 1217 O GLY A 119 -16.662 4.235 -0.831 1.00 0.00 O ATOM 0 H GLY A 119 -17.663 7.695 1.463 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -17.026 7.266 -0.707 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -15.620 6.425 -0.085 1.00 0.00 H new ATOM 1221 N LEU A 120 -18.627 5.025 -0.250 1.00 0.00 N ATOM 1222 CA LEU A 120 -19.300 3.744 -0.610 1.00 0.00 C ATOM 1223 C LEU A 120 -19.443 3.662 -2.132 1.00 0.00 C ATOM 1224 O LEU A 120 -19.136 2.656 -2.740 1.00 0.00 O ATOM 1225 CB LEU A 120 -20.692 3.697 0.040 1.00 0.00 C ATOM 1226 CG LEU A 120 -20.588 3.362 1.542 1.00 0.00 C ATOM 1227 CD1 LEU A 120 -20.259 1.871 1.750 1.00 0.00 C ATOM 1228 CD2 LEU A 120 -19.503 4.229 2.199 1.00 0.00 C ATOM 0 H LEU A 120 -19.244 5.755 0.106 1.00 0.00 H new ATOM 0 HA LEU A 120 -18.706 2.903 -0.252 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -21.190 4.658 -0.089 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -21.307 2.950 -0.462 1.00 0.00 H new ATOM 0 HG LEU A 120 -21.551 3.572 2.007 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -20.191 1.659 2.817 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -21.046 1.260 1.308 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -19.307 1.638 1.272 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -19.436 3.986 3.260 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -18.543 4.035 1.721 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -19.759 5.282 2.083 1.00 0.00 H new ATOM 1240 N ARG A 121 -19.905 4.714 -2.751 1.00 0.00 N ATOM 1241 CA ARG A 121 -20.067 4.697 -4.232 1.00 0.00 C ATOM 1242 C ARG A 121 -18.752 4.260 -4.882 1.00 0.00 C ATOM 1243 O ARG A 121 -17.706 4.297 -4.267 1.00 0.00 O ATOM 1244 CB ARG A 121 -20.439 6.101 -4.718 1.00 0.00 C ATOM 1245 CG ARG A 121 -20.461 6.127 -6.256 1.00 0.00 C ATOM 1246 CD ARG A 121 -21.190 7.393 -6.776 1.00 0.00 C ATOM 1247 NE ARG A 121 -20.356 8.086 -7.817 1.00 0.00 N ATOM 1248 CZ ARG A 121 -19.126 8.460 -7.574 1.00 0.00 C ATOM 1249 NH1 ARG A 121 -18.617 8.317 -6.381 1.00 0.00 N ATOM 1250 NH2 ARG A 121 -18.414 9.002 -8.524 1.00 0.00 N ATOM 0 H ARG A 121 -20.177 5.585 -2.295 1.00 0.00 H new ATOM 0 HA ARG A 121 -20.856 3.997 -4.506 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -21.415 6.386 -4.326 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -19.720 6.829 -4.342 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -19.441 6.107 -6.639 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -20.961 5.234 -6.632 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -22.156 7.117 -7.199 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -21.388 8.073 -5.947 1.00 0.00 H new ATOM 0 HE ARG A 121 -20.759 8.269 -8.736 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -19.179 7.912 -5.632 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -17.658 8.610 -6.197 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -18.817 9.133 -9.452 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -17.455 9.295 -8.339 1.00 0.00 H new ATOM 1264 N PHE A 122 -18.802 3.845 -6.120 1.00 0.00 N ATOM 1265 CA PHE A 122 -17.560 3.402 -6.819 1.00 0.00 C ATOM 1266 C PHE A 122 -16.960 2.198 -6.088 1.00 0.00 C ATOM 1267 O PHE A 122 -16.832 2.192 -4.879 1.00 0.00 O ATOM 1268 CB PHE A 122 -16.543 4.553 -6.845 1.00 0.00 C ATOM 1269 CG PHE A 122 -15.508 4.298 -7.917 1.00 0.00 C ATOM 1270 CD1 PHE A 122 -14.439 3.417 -7.669 1.00 0.00 C ATOM 1271 CD2 PHE A 122 -15.614 4.942 -9.165 1.00 0.00 C ATOM 1272 CE1 PHE A 122 -13.476 3.179 -8.668 1.00 0.00 C ATOM 1273 CE2 PHE A 122 -14.650 4.705 -10.164 1.00 0.00 C ATOM 1274 CZ PHE A 122 -13.581 3.823 -9.915 1.00 0.00 C ATOM 0 H PHE A 122 -19.653 3.794 -6.680 1.00 0.00 H new ATOM 0 HA PHE A 122 -17.804 3.116 -7.842 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -17.053 5.497 -7.037 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -16.058 4.644 -5.873 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -14.357 2.923 -6.712 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -16.435 5.618 -9.356 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -12.656 2.502 -8.477 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -14.731 5.200 -11.121 1.00 0.00 H new ATOM 0 HZ PHE A 122 -12.842 3.641 -10.681 1.00 0.00 H new ATOM 1284 N ASP A 123 -16.593 1.176 -6.812 1.00 0.00 N ATOM 1285 CA ASP A 123 -16.003 -0.028 -6.162 1.00 0.00 C ATOM 1286 C ASP A 123 -16.924 -0.506 -5.036 1.00 0.00 C ATOM 1287 O ASP A 123 -18.049 -0.898 -5.267 1.00 0.00 O ATOM 1288 CB ASP A 123 -14.627 0.322 -5.589 1.00 0.00 C ATOM 1289 CG ASP A 123 -14.040 -0.906 -4.890 1.00 0.00 C ATOM 1290 OD1 ASP A 123 -13.909 -1.928 -5.543 1.00 0.00 O ATOM 1291 OD2 ASP A 123 -13.733 -0.803 -3.715 1.00 0.00 O ATOM 0 H ASP A 123 -16.677 1.123 -7.827 1.00 0.00 H new ATOM 0 HA ASP A 123 -15.895 -0.822 -6.900 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -13.962 0.652 -6.387 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -14.714 1.149 -4.884 1.00 0.00 H new ATOM 1296 N ARG A 124 -16.455 -0.475 -3.817 1.00 0.00 N ATOM 1297 CA ARG A 124 -17.302 -0.928 -2.677 1.00 0.00 C ATOM 1298 C ARG A 124 -16.579 -0.595 -1.377 1.00 0.00 C ATOM 1299 O ARG A 124 -17.186 -0.312 -0.363 1.00 0.00 O ATOM 1300 CB ARG A 124 -17.522 -2.440 -2.769 1.00 0.00 C ATOM 1301 CG ARG A 124 -18.580 -2.869 -1.743 1.00 0.00 C ATOM 1302 CD ARG A 124 -18.634 -4.411 -1.636 1.00 0.00 C ATOM 1303 NE ARG A 124 -20.059 -4.877 -1.637 1.00 0.00 N ATOM 1304 CZ ARG A 124 -20.962 -4.308 -0.881 1.00 0.00 C ATOM 1305 NH1 ARG A 124 -20.622 -3.383 -0.026 1.00 0.00 N ATOM 1306 NH2 ARG A 124 -22.208 -4.688 -0.962 1.00 0.00 N ATOM 0 H ARG A 124 -15.521 -0.155 -3.562 1.00 0.00 H new ATOM 0 HA ARG A 124 -18.270 -0.427 -2.707 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -17.845 -2.710 -3.774 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -16.586 -2.966 -2.583 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -18.347 -2.439 -0.769 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -19.557 -2.484 -2.036 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -18.096 -4.860 -2.470 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -18.137 -4.738 -0.723 1.00 0.00 H new ATOM 0 HE ARG A 124 -20.330 -5.654 -2.240 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -19.646 -3.099 0.056 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -21.332 -2.944 0.560 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -22.475 -5.426 -1.613 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -22.915 -4.247 -0.374 1.00 0.00 H new ATOM 1320 N ASP A 125 -15.278 -0.619 -1.409 1.00 0.00 N ATOM 1321 CA ASP A 125 -14.487 -0.297 -0.198 1.00 0.00 C ATOM 1322 C ASP A 125 -13.030 -0.125 -0.613 1.00 0.00 C ATOM 1323 O ASP A 125 -12.116 -0.538 0.073 1.00 0.00 O ATOM 1324 CB ASP A 125 -14.609 -1.432 0.822 1.00 0.00 C ATOM 1325 CG ASP A 125 -14.476 -2.777 0.107 1.00 0.00 C ATOM 1326 OD1 ASP A 125 -13.954 -2.790 -0.997 1.00 0.00 O ATOM 1327 OD2 ASP A 125 -14.899 -3.771 0.673 1.00 0.00 O ATOM 0 H ASP A 125 -14.725 -0.851 -2.234 1.00 0.00 H new ATOM 0 HA ASP A 125 -14.858 0.620 0.261 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -13.836 -1.335 1.584 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -15.570 -1.374 1.334 1.00 0.00 H new ATOM 1332 N GLU A 126 -12.818 0.476 -1.750 1.00 0.00 N ATOM 1333 CA GLU A 126 -11.433 0.685 -2.257 1.00 0.00 C ATOM 1334 C GLU A 126 -10.532 1.178 -1.112 1.00 0.00 C ATOM 1335 O GLU A 126 -10.559 2.335 -0.739 1.00 0.00 O ATOM 1336 CB GLU A 126 -11.478 1.725 -3.406 1.00 0.00 C ATOM 1337 CG GLU A 126 -11.034 1.089 -4.733 1.00 0.00 C ATOM 1338 CD GLU A 126 -10.952 2.168 -5.815 1.00 0.00 C ATOM 1339 OE1 GLU A 126 -10.889 3.332 -5.459 1.00 0.00 O ATOM 1340 OE2 GLU A 126 -10.952 1.809 -6.981 1.00 0.00 O ATOM 0 H GLU A 126 -13.554 0.836 -2.357 1.00 0.00 H new ATOM 0 HA GLU A 126 -11.023 -0.251 -2.635 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -12.489 2.119 -3.507 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -10.830 2.568 -3.166 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -10.064 0.607 -4.611 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -11.740 0.314 -5.031 1.00 0.00 H new ATOM 1347 N ILE A 127 -9.723 0.309 -0.572 1.00 0.00 N ATOM 1348 CA ILE A 127 -8.803 0.717 0.529 1.00 0.00 C ATOM 1349 C ILE A 127 -7.690 1.565 -0.093 1.00 0.00 C ATOM 1350 O ILE A 127 -6.831 1.069 -0.796 1.00 0.00 O ATOM 1351 CB ILE A 127 -8.243 -0.559 1.205 1.00 0.00 C ATOM 1352 CG1 ILE A 127 -6.869 -0.293 1.866 1.00 0.00 C ATOM 1353 CG2 ILE A 127 -8.110 -1.670 0.152 1.00 0.00 C ATOM 1354 CD1 ILE A 127 -6.417 -1.524 2.690 1.00 0.00 C ATOM 0 H ILE A 127 -9.659 -0.671 -0.847 1.00 0.00 H new ATOM 0 HA ILE A 127 -9.312 1.304 1.293 1.00 0.00 H new ATOM 0 HB ILE A 127 -8.935 -0.867 1.989 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -6.127 -0.069 1.099 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -6.933 0.582 2.513 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -7.716 -2.571 0.622 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -9.089 -1.883 -0.278 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -7.431 -1.345 -0.636 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -5.449 -1.320 3.148 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -7.151 -1.730 3.469 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -6.332 -2.390 2.034 1.00 0.00 H new ATOM 1366 N GLU A 128 -7.722 2.846 0.139 1.00 0.00 N ATOM 1367 CA GLU A 128 -6.692 3.751 -0.455 1.00 0.00 C ATOM 1368 C GLU A 128 -5.536 3.960 0.523 1.00 0.00 C ATOM 1369 O GLU A 128 -5.655 3.730 1.710 1.00 0.00 O ATOM 1370 CB GLU A 128 -7.336 5.104 -0.768 1.00 0.00 C ATOM 1371 CG GLU A 128 -6.317 6.007 -1.467 1.00 0.00 C ATOM 1372 CD GLU A 128 -7.039 7.195 -2.105 1.00 0.00 C ATOM 1373 OE1 GLU A 128 -8.122 7.521 -1.646 1.00 0.00 O ATOM 1374 OE2 GLU A 128 -6.497 7.759 -3.041 1.00 0.00 O ATOM 0 H GLU A 128 -8.421 3.311 0.718 1.00 0.00 H new ATOM 0 HA GLU A 128 -6.305 3.297 -1.367 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -8.210 4.964 -1.404 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -7.684 5.574 0.152 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -5.577 6.361 -0.750 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -5.779 5.443 -2.229 1.00 0.00 H new ATOM 1381 N PHE A 129 -4.415 4.410 0.020 1.00 0.00 N ATOM 1382 CA PHE A 129 -3.229 4.660 0.890 1.00 0.00 C ATOM 1383 C PHE A 129 -2.528 5.934 0.419 1.00 0.00 C ATOM 1384 O PHE A 129 -2.056 6.019 -0.700 1.00 0.00 O ATOM 1385 CB PHE A 129 -2.262 3.471 0.807 1.00 0.00 C ATOM 1386 CG PHE A 129 -2.720 2.371 1.739 1.00 0.00 C ATOM 1387 CD1 PHE A 129 -2.718 2.598 3.129 1.00 0.00 C ATOM 1388 CD2 PHE A 129 -3.131 1.123 1.230 1.00 0.00 C ATOM 1389 CE1 PHE A 129 -3.128 1.583 4.009 1.00 0.00 C ATOM 1390 CE2 PHE A 129 -3.536 0.106 2.113 1.00 0.00 C ATOM 1391 CZ PHE A 129 -3.536 0.338 3.502 1.00 0.00 C ATOM 0 H PHE A 129 -4.271 4.617 -0.968 1.00 0.00 H new ATOM 0 HA PHE A 129 -3.550 4.779 1.925 1.00 0.00 H new ATOM 0 HB2 PHE A 129 -2.217 3.098 -0.216 1.00 0.00 H new ATOM 0 HB3 PHE A 129 -1.255 3.791 1.074 1.00 0.00 H new ATOM 0 HD1 PHE A 129 -2.401 3.554 3.519 1.00 0.00 H new ATOM 0 HD2 PHE A 129 -3.135 0.948 0.164 1.00 0.00 H new ATOM 0 HE1 PHE A 129 -3.130 1.759 5.074 1.00 0.00 H new ATOM 0 HE2 PHE A 129 -3.847 -0.853 1.726 1.00 0.00 H new ATOM 0 HZ PHE A 129 -3.850 -0.443 4.179 1.00 0.00 H new ATOM 1401 N SER A 130 -2.465 6.930 1.268 1.00 0.00 N ATOM 1402 CA SER A 130 -1.807 8.215 0.886 1.00 0.00 C ATOM 1403 C SER A 130 -0.374 8.242 1.420 1.00 0.00 C ATOM 1404 O SER A 130 -0.124 7.993 2.583 1.00 0.00 O ATOM 1405 CB SER A 130 -2.603 9.385 1.473 1.00 0.00 C ATOM 1406 OG SER A 130 -3.783 9.578 0.705 1.00 0.00 O ATOM 0 H SER A 130 -2.844 6.906 2.215 1.00 0.00 H new ATOM 0 HA SER A 130 -1.781 8.302 -0.200 1.00 0.00 H new ATOM 0 HB2 SER A 130 -2.860 9.181 2.512 1.00 0.00 H new ATOM 0 HB3 SER A 130 -1.998 10.292 1.467 1.00 0.00 H new ATOM 0 HG SER A 130 -4.215 10.416 0.973 1.00 0.00 H new ATOM 1412 N HIS A 131 0.567 8.541 0.566 1.00 0.00 N ATOM 1413 CA HIS A 131 1.997 8.587 0.988 1.00 0.00 C ATOM 1414 C HIS A 131 2.738 9.613 0.103 1.00 0.00 C ATOM 1415 O HIS A 131 3.207 9.254 -0.960 1.00 0.00 O ATOM 1416 CB HIS A 131 2.607 7.193 0.786 1.00 0.00 C ATOM 1417 CG HIS A 131 3.851 7.041 1.622 1.00 0.00 C ATOM 1418 ND1 HIS A 131 4.384 8.083 2.368 1.00 0.00 N ATOM 1419 CD2 HIS A 131 4.671 5.966 1.840 1.00 0.00 C ATOM 1420 CE1 HIS A 131 5.479 7.610 2.995 1.00 0.00 C ATOM 1421 NE2 HIS A 131 5.698 6.326 2.707 1.00 0.00 N ATOM 0 H HIS A 131 0.404 8.758 -0.417 1.00 0.00 H new ATOM 0 HA HIS A 131 2.083 8.878 2.035 1.00 0.00 H new ATOM 0 HB2 HIS A 131 1.881 6.428 1.060 1.00 0.00 H new ATOM 0 HB3 HIS A 131 2.847 7.043 -0.267 1.00 0.00 H new ATOM 0 HD1 HIS A 131 4.015 9.032 2.430 1.00 0.00 H new ATOM 0 HD2 HIS A 131 4.540 4.986 1.405 1.00 0.00 H new ATOM 0 HE1 HIS A 131 6.103 8.199 3.651 1.00 0.00 H new ATOM 1429 N PRO A 132 2.811 10.863 0.527 1.00 0.00 N ATOM 1430 CA PRO A 132 3.480 11.911 -0.275 1.00 0.00 C ATOM 1431 C PRO A 132 4.976 11.602 -0.473 1.00 0.00 C ATOM 1432 O PRO A 132 5.762 12.489 -0.743 1.00 0.00 O ATOM 1433 CB PRO A 132 3.272 13.220 0.528 1.00 0.00 C ATOM 1434 CG PRO A 132 2.408 12.871 1.774 1.00 0.00 C ATOM 1435 CD PRO A 132 2.242 11.336 1.809 1.00 0.00 C ATOM 0 HA PRO A 132 3.065 11.980 -1.280 1.00 0.00 H new ATOM 0 HB2 PRO A 132 4.231 13.640 0.832 1.00 0.00 H new ATOM 0 HB3 PRO A 132 2.775 13.971 -0.085 1.00 0.00 H new ATOM 0 HG2 PRO A 132 2.889 13.225 2.686 1.00 0.00 H new ATOM 0 HG3 PRO A 132 1.436 13.360 1.716 1.00 0.00 H new ATOM 0 HD2 PRO A 132 2.767 10.901 2.659 1.00 0.00 H new ATOM 0 HD3 PRO A 132 1.193 11.054 1.904 1.00 0.00 H new ATOM 1443 N PHE A 133 5.377 10.360 -0.349 1.00 0.00 N ATOM 1444 CA PHE A 133 6.820 10.002 -0.539 1.00 0.00 C ATOM 1445 C PHE A 133 6.923 8.718 -1.369 1.00 0.00 C ATOM 1446 O PHE A 133 7.967 8.393 -1.897 1.00 0.00 O ATOM 1447 CB PHE A 133 7.474 9.803 0.830 1.00 0.00 C ATOM 1448 CG PHE A 133 7.811 11.154 1.417 1.00 0.00 C ATOM 1449 CD1 PHE A 133 6.795 11.941 1.994 1.00 0.00 C ATOM 1450 CD2 PHE A 133 9.136 11.627 1.383 1.00 0.00 C ATOM 1451 CE1 PHE A 133 7.107 13.201 2.540 1.00 0.00 C ATOM 1452 CE2 PHE A 133 9.448 12.887 1.928 1.00 0.00 C ATOM 1453 CZ PHE A 133 8.433 13.673 2.508 1.00 0.00 C ATOM 0 H PHE A 133 4.766 9.575 -0.124 1.00 0.00 H new ATOM 0 HA PHE A 133 7.335 10.804 -1.067 1.00 0.00 H new ATOM 0 HB2 PHE A 133 6.800 9.262 1.494 1.00 0.00 H new ATOM 0 HB3 PHE A 133 8.377 9.200 0.732 1.00 0.00 H new ATOM 0 HD1 PHE A 133 5.778 11.578 2.018 1.00 0.00 H new ATOM 0 HD2 PHE A 133 9.914 11.023 0.939 1.00 0.00 H new ATOM 0 HE1 PHE A 133 6.329 13.805 2.983 1.00 0.00 H new ATOM 0 HE2 PHE A 133 10.465 13.251 1.901 1.00 0.00 H new ATOM 0 HZ PHE A 133 8.672 14.639 2.929 1.00 0.00 H new ATOM 1463 N PHE A 134 5.842 8.002 -1.520 1.00 0.00 N ATOM 1464 CA PHE A 134 5.877 6.765 -2.351 1.00 0.00 C ATOM 1465 C PHE A 134 5.570 7.191 -3.785 1.00 0.00 C ATOM 1466 O PHE A 134 4.805 6.566 -4.493 1.00 0.00 O ATOM 1467 CB PHE A 134 4.808 5.781 -1.846 1.00 0.00 C ATOM 1468 CG PHE A 134 5.137 4.376 -2.300 1.00 0.00 C ATOM 1469 CD1 PHE A 134 6.156 3.649 -1.655 1.00 0.00 C ATOM 1470 CD2 PHE A 134 4.422 3.794 -3.366 1.00 0.00 C ATOM 1471 CE1 PHE A 134 6.461 2.340 -2.078 1.00 0.00 C ATOM 1472 CE2 PHE A 134 4.728 2.486 -3.787 1.00 0.00 C ATOM 1473 CZ PHE A 134 5.748 1.759 -3.143 1.00 0.00 C ATOM 0 H PHE A 134 4.937 8.220 -1.104 1.00 0.00 H new ATOM 0 HA PHE A 134 6.847 6.270 -2.295 1.00 0.00 H new ATOM 0 HB2 PHE A 134 4.755 5.817 -0.758 1.00 0.00 H new ATOM 0 HB3 PHE A 134 3.828 6.073 -2.222 1.00 0.00 H new ATOM 0 HD1 PHE A 134 6.703 4.094 -0.837 1.00 0.00 H new ATOM 0 HD2 PHE A 134 3.640 4.351 -3.860 1.00 0.00 H new ATOM 0 HE1 PHE A 134 7.243 1.782 -1.584 1.00 0.00 H new ATOM 0 HE2 PHE A 134 4.180 2.040 -4.604 1.00 0.00 H new ATOM 0 HZ PHE A 134 5.983 0.756 -3.467 1.00 0.00 H new ATOM 1483 N LYS A 135 6.150 8.291 -4.192 1.00 0.00 N ATOM 1484 CA LYS A 135 5.902 8.839 -5.556 1.00 0.00 C ATOM 1485 C LYS A 135 6.898 8.207 -6.541 1.00 0.00 C ATOM 1486 O LYS A 135 7.866 7.585 -6.151 1.00 0.00 O ATOM 1487 CB LYS A 135 6.111 10.381 -5.506 1.00 0.00 C ATOM 1488 CG LYS A 135 4.773 11.162 -5.593 1.00 0.00 C ATOM 1489 CD LYS A 135 4.085 11.275 -4.216 1.00 0.00 C ATOM 1490 CE LYS A 135 3.339 9.984 -3.859 1.00 0.00 C ATOM 1491 NZ LYS A 135 2.557 9.493 -5.029 1.00 0.00 N ATOM 0 H LYS A 135 6.796 8.841 -3.625 1.00 0.00 H new ATOM 0 HA LYS A 135 4.887 8.613 -5.883 1.00 0.00 H new ATOM 0 HB2 LYS A 135 6.624 10.646 -4.581 1.00 0.00 H new ATOM 0 HB3 LYS A 135 6.760 10.684 -6.328 1.00 0.00 H new ATOM 0 HG2 LYS A 135 4.960 12.160 -5.989 1.00 0.00 H new ATOM 0 HG3 LYS A 135 4.105 10.661 -6.293 1.00 0.00 H new ATOM 0 HD2 LYS A 135 4.831 11.490 -3.451 1.00 0.00 H new ATOM 0 HD3 LYS A 135 3.386 12.111 -4.224 1.00 0.00 H new ATOM 0 HE2 LYS A 135 4.051 9.221 -3.544 1.00 0.00 H new ATOM 0 HE3 LYS A 135 2.671 10.164 -3.017 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 1.723 8.969 -4.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 2.249 10.302 -5.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 3.152 8.864 -5.605 1.00 0.00 H new ATOM 1505 N ARG A 136 6.663 8.371 -7.819 1.00 0.00 N ATOM 1506 CA ARG A 136 7.588 7.794 -8.841 1.00 0.00 C ATOM 1507 C ARG A 136 8.628 8.846 -9.232 1.00 0.00 C ATOM 1508 O ARG A 136 8.749 9.875 -8.598 1.00 0.00 O ATOM 1509 CB ARG A 136 6.785 7.393 -10.084 1.00 0.00 C ATOM 1510 CG ARG A 136 6.017 6.090 -9.814 1.00 0.00 C ATOM 1511 CD ARG A 136 6.995 4.899 -9.654 1.00 0.00 C ATOM 1512 NE ARG A 136 6.533 3.734 -10.480 1.00 0.00 N ATOM 1513 CZ ARG A 136 5.285 3.340 -10.469 1.00 0.00 C ATOM 1514 NH1 ARG A 136 4.420 3.906 -9.674 1.00 0.00 N ATOM 1515 NH2 ARG A 136 4.908 2.360 -11.243 1.00 0.00 N ATOM 0 H ARG A 136 5.866 8.882 -8.199 1.00 0.00 H new ATOM 0 HA ARG A 136 8.088 6.918 -8.428 1.00 0.00 H new ATOM 0 HB2 ARG A 136 6.088 8.188 -10.349 1.00 0.00 H new ATOM 0 HB3 ARG A 136 7.455 7.261 -10.933 1.00 0.00 H new ATOM 0 HG2 ARG A 136 5.416 6.197 -8.911 1.00 0.00 H new ATOM 0 HG3 ARG A 136 5.327 5.892 -10.634 1.00 0.00 H new ATOM 0 HD2 ARG A 136 7.997 5.198 -9.962 1.00 0.00 H new ATOM 0 HD3 ARG A 136 7.057 4.609 -8.605 1.00 0.00 H new ATOM 0 HE ARG A 136 7.207 3.238 -11.063 1.00 0.00 H new ATOM 0 HH11 ARG A 136 4.714 4.661 -9.055 1.00 0.00 H new ATOM 0 HH12 ARG A 136 3.449 3.593 -9.671 1.00 0.00 H new ATOM 0 HH21 ARG A 136 5.585 1.903 -11.854 1.00 0.00 H new ATOM 0 HH22 ARG A 136 3.936 2.050 -11.237 1.00 0.00 H new ATOM 1529 N ASN A 137 9.376 8.591 -10.277 1.00 0.00 N ATOM 1530 CA ASN A 137 10.415 9.566 -10.735 1.00 0.00 C ATOM 1531 C ASN A 137 11.154 10.158 -9.531 1.00 0.00 C ATOM 1532 O ASN A 137 11.712 11.235 -9.602 1.00 0.00 O ATOM 1533 CB ASN A 137 9.747 10.690 -11.534 1.00 0.00 C ATOM 1534 CG ASN A 137 8.876 11.540 -10.606 1.00 0.00 C ATOM 1535 OD1 ASN A 137 7.732 11.213 -10.362 1.00 0.00 O ATOM 1536 ND2 ASN A 137 9.373 12.624 -10.076 1.00 0.00 N ATOM 0 H ASN A 137 9.311 7.741 -10.838 1.00 0.00 H new ATOM 0 HA ASN A 137 11.134 9.046 -11.368 1.00 0.00 H new ATOM 0 HB2 ASN A 137 10.506 11.313 -12.007 1.00 0.00 H new ATOM 0 HB3 ASN A 137 9.138 10.268 -12.333 1.00 0.00 H new ATOM 0 HD21 ASN A 137 8.801 13.197 -9.456 1.00 0.00 H new ATOM 0 HD22 ASN A 137 10.334 12.898 -10.281 1.00 0.00 H new ATOM 1543 N SER A 138 11.160 9.464 -8.427 1.00 0.00 N ATOM 1544 CA SER A 138 11.861 9.990 -7.222 1.00 0.00 C ATOM 1545 C SER A 138 12.136 8.841 -6.238 1.00 0.00 C ATOM 1546 O SER A 138 11.572 8.814 -5.163 1.00 0.00 O ATOM 1547 CB SER A 138 10.972 11.036 -6.549 1.00 0.00 C ATOM 1548 OG SER A 138 10.998 12.235 -7.313 1.00 0.00 O ATOM 0 H SER A 138 10.710 8.556 -8.307 1.00 0.00 H new ATOM 0 HA SER A 138 12.808 10.442 -7.517 1.00 0.00 H new ATOM 0 HB2 SER A 138 9.950 10.664 -6.468 1.00 0.00 H new ATOM 0 HB3 SER A 138 11.322 11.229 -5.535 1.00 0.00 H new ATOM 0 HG SER A 138 11.586 12.116 -8.088 1.00 0.00 H new ATOM 1554 N PRO A 139 12.993 7.919 -6.627 1.00 0.00 N ATOM 1555 CA PRO A 139 13.329 6.767 -5.768 1.00 0.00 C ATOM 1556 C PRO A 139 14.047 7.247 -4.495 1.00 0.00 C ATOM 1557 O PRO A 139 14.156 6.522 -3.526 1.00 0.00 O ATOM 1558 CB PRO A 139 14.256 5.879 -6.635 1.00 0.00 C ATOM 1559 CG PRO A 139 14.509 6.636 -7.973 1.00 0.00 C ATOM 1560 CD PRO A 139 13.683 7.941 -7.937 1.00 0.00 C ATOM 0 HA PRO A 139 12.446 6.220 -5.437 1.00 0.00 H new ATOM 0 HB2 PRO A 139 15.197 5.687 -6.119 1.00 0.00 H new ATOM 0 HB3 PRO A 139 13.793 4.910 -6.824 1.00 0.00 H new ATOM 0 HG2 PRO A 139 15.570 6.858 -8.092 1.00 0.00 H new ATOM 0 HG3 PRO A 139 14.214 6.020 -8.823 1.00 0.00 H new ATOM 0 HD2 PRO A 139 14.324 8.817 -8.031 1.00 0.00 H new ATOM 0 HD3 PRO A 139 12.969 7.979 -8.759 1.00 0.00 H new ATOM 1568 N PHE A 140 14.546 8.453 -4.494 1.00 0.00 N ATOM 1569 CA PHE A 140 15.260 8.957 -3.285 1.00 0.00 C ATOM 1570 C PHE A 140 14.285 9.037 -2.103 1.00 0.00 C ATOM 1571 O PHE A 140 14.688 9.108 -0.959 1.00 0.00 O ATOM 1572 CB PHE A 140 15.862 10.342 -3.580 1.00 0.00 C ATOM 1573 CG PHE A 140 14.790 11.408 -3.538 1.00 0.00 C ATOM 1574 CD1 PHE A 140 14.400 11.960 -2.303 1.00 0.00 C ATOM 1575 CD2 PHE A 140 14.183 11.851 -4.729 1.00 0.00 C ATOM 1576 CE1 PHE A 140 13.404 12.953 -2.258 1.00 0.00 C ATOM 1577 CE2 PHE A 140 13.188 12.845 -4.685 1.00 0.00 C ATOM 1578 CZ PHE A 140 12.797 13.396 -3.450 1.00 0.00 C ATOM 0 H PHE A 140 14.491 9.109 -5.273 1.00 0.00 H new ATOM 0 HA PHE A 140 16.067 8.271 -3.026 1.00 0.00 H new ATOM 0 HB2 PHE A 140 16.638 10.570 -2.850 1.00 0.00 H new ATOM 0 HB3 PHE A 140 16.339 10.336 -4.560 1.00 0.00 H new ATOM 0 HD1 PHE A 140 14.866 11.621 -1.389 1.00 0.00 H new ATOM 0 HD2 PHE A 140 14.481 11.428 -5.677 1.00 0.00 H new ATOM 0 HE1 PHE A 140 13.105 13.375 -1.310 1.00 0.00 H new ATOM 0 HE2 PHE A 140 12.724 13.185 -5.599 1.00 0.00 H new ATOM 0 HZ PHE A 140 12.032 14.158 -3.416 1.00 0.00 H new ATOM 1588 N LEU A 141 13.008 9.028 -2.372 1.00 0.00 N ATOM 1589 CA LEU A 141 12.014 9.105 -1.263 1.00 0.00 C ATOM 1590 C LEU A 141 12.062 7.810 -0.448 1.00 0.00 C ATOM 1591 O LEU A 141 12.017 7.828 0.766 1.00 0.00 O ATOM 1592 CB LEU A 141 10.606 9.287 -1.841 1.00 0.00 C ATOM 1593 CG LEU A 141 10.555 10.535 -2.740 1.00 0.00 C ATOM 1594 CD1 LEU A 141 9.372 10.425 -3.708 1.00 0.00 C ATOM 1595 CD2 LEU A 141 10.376 11.794 -1.883 1.00 0.00 C ATOM 0 H LEU A 141 12.610 8.971 -3.309 1.00 0.00 H new ATOM 0 HA LEU A 141 12.254 9.953 -0.622 1.00 0.00 H new ATOM 0 HB2 LEU A 141 10.325 8.405 -2.416 1.00 0.00 H new ATOM 0 HB3 LEU A 141 9.883 9.384 -1.031 1.00 0.00 H new ATOM 0 HG LEU A 141 11.489 10.602 -3.298 1.00 0.00 H new ATOM 0 HD11 LEU A 141 9.338 11.310 -4.343 1.00 0.00 H new ATOM 0 HD12 LEU A 141 9.491 9.537 -4.329 1.00 0.00 H new ATOM 0 HD13 LEU A 141 8.444 10.350 -3.141 1.00 0.00 H new ATOM 0 HD21 LEU A 141 10.341 12.672 -2.529 1.00 0.00 H new ATOM 0 HD22 LEU A 141 9.446 11.721 -1.319 1.00 0.00 H new ATOM 0 HD23 LEU A 141 11.213 11.885 -1.191 1.00 0.00 H new ATOM 1607 N LEU A 142 12.155 6.686 -1.106 1.00 0.00 N ATOM 1608 CA LEU A 142 12.210 5.392 -0.372 1.00 0.00 C ATOM 1609 C LEU A 142 13.240 5.488 0.754 1.00 0.00 C ATOM 1610 O LEU A 142 12.984 5.106 1.879 1.00 0.00 O ATOM 1611 CB LEU A 142 12.616 4.281 -1.340 1.00 0.00 C ATOM 1612 CG LEU A 142 11.656 4.251 -2.536 1.00 0.00 C ATOM 1613 CD1 LEU A 142 12.141 3.207 -3.544 1.00 0.00 C ATOM 1614 CD2 LEU A 142 10.237 3.893 -2.064 1.00 0.00 C ATOM 0 H LEU A 142 12.195 6.609 -2.122 1.00 0.00 H new ATOM 0 HA LEU A 142 11.231 5.169 0.051 1.00 0.00 H new ATOM 0 HB2 LEU A 142 13.637 4.444 -1.686 1.00 0.00 H new ATOM 0 HB3 LEU A 142 12.603 3.319 -0.828 1.00 0.00 H new ATOM 0 HG LEU A 142 11.634 5.234 -3.006 1.00 0.00 H new ATOM 0 HD11 LEU A 142 11.462 3.181 -4.396 1.00 0.00 H new ATOM 0 HD12 LEU A 142 13.143 3.469 -3.885 1.00 0.00 H new ATOM 0 HD13 LEU A 142 12.164 2.226 -3.069 1.00 0.00 H new ATOM 0 HD21 LEU A 142 9.563 3.874 -2.920 1.00 0.00 H new ATOM 0 HD22 LEU A 142 10.248 2.912 -1.589 1.00 0.00 H new ATOM 0 HD23 LEU A 142 9.893 4.639 -1.347 1.00 0.00 H new ATOM 1626 N ASP A 143 14.404 5.995 0.459 1.00 0.00 N ATOM 1627 CA ASP A 143 15.454 6.118 1.507 1.00 0.00 C ATOM 1628 C ASP A 143 15.069 7.223 2.496 1.00 0.00 C ATOM 1629 O ASP A 143 15.918 7.887 3.059 1.00 0.00 O ATOM 1630 CB ASP A 143 16.791 6.467 0.849 1.00 0.00 C ATOM 1631 CG ASP A 143 17.885 6.528 1.916 1.00 0.00 C ATOM 1632 OD1 ASP A 143 18.416 5.482 2.252 1.00 0.00 O ATOM 1633 OD2 ASP A 143 18.174 7.620 2.379 1.00 0.00 O ATOM 0 H ASP A 143 14.674 6.330 -0.466 1.00 0.00 H new ATOM 0 HA ASP A 143 15.545 5.172 2.040 1.00 0.00 H new ATOM 0 HB2 ASP A 143 17.044 5.720 0.096 1.00 0.00 H new ATOM 0 HB3 ASP A 143 16.716 7.425 0.335 1.00 0.00 H new ATOM 1638 N GLN A 144 13.793 7.426 2.715 1.00 0.00 N ATOM 1639 CA GLN A 144 13.343 8.483 3.669 1.00 0.00 C ATOM 1640 C GLN A 144 12.135 7.961 4.453 1.00 0.00 C ATOM 1641 O GLN A 144 11.211 8.691 4.754 1.00 0.00 O ATOM 1642 CB GLN A 144 12.949 9.739 2.881 1.00 0.00 C ATOM 1643 CG GLN A 144 12.940 10.953 3.813 1.00 0.00 C ATOM 1644 CD GLN A 144 12.639 12.217 3.004 1.00 0.00 C ATOM 1645 OE1 GLN A 144 12.836 12.246 1.806 1.00 0.00 O ATOM 1646 NE2 GLN A 144 12.167 13.269 3.614 1.00 0.00 N ATOM 0 H GLN A 144 13.040 6.901 2.270 1.00 0.00 H new ATOM 0 HA GLN A 144 14.147 8.732 4.361 1.00 0.00 H new ATOM 0 HB2 GLN A 144 13.651 9.902 2.063 1.00 0.00 H new ATOM 0 HB3 GLN A 144 11.964 9.605 2.434 1.00 0.00 H new ATOM 0 HG2 GLN A 144 12.190 10.820 4.593 1.00 0.00 H new ATOM 0 HG3 GLN A 144 13.904 11.049 4.312 1.00 0.00 H new ATOM 0 HE21 GLN A 144 12.002 13.244 4.620 1.00 0.00 H new ATOM 0 HE22 GLN A 144 11.963 14.117 3.085 1.00 0.00 H new ATOM 1655 N ILE A 145 12.140 6.696 4.786 1.00 0.00 N ATOM 1656 CA ILE A 145 11.002 6.100 5.553 1.00 0.00 C ATOM 1657 C ILE A 145 11.566 5.154 6.616 1.00 0.00 C ATOM 1658 O ILE A 145 12.457 4.370 6.349 1.00 0.00 O ATOM 1659 CB ILE A 145 10.103 5.311 4.599 1.00 0.00 C ATOM 1660 CG1 ILE A 145 9.768 6.177 3.379 1.00 0.00 C ATOM 1661 CG2 ILE A 145 8.809 4.925 5.322 1.00 0.00 C ATOM 1662 CD1 ILE A 145 8.897 5.381 2.405 1.00 0.00 C ATOM 0 H ILE A 145 12.890 6.044 4.558 1.00 0.00 H new ATOM 0 HA ILE A 145 10.420 6.890 6.028 1.00 0.00 H new ATOM 0 HB ILE A 145 10.621 4.409 4.273 1.00 0.00 H new ATOM 0 HG12 ILE A 145 9.246 7.080 3.694 1.00 0.00 H new ATOM 0 HG13 ILE A 145 10.685 6.496 2.884 1.00 0.00 H new ATOM 0 HG21 ILE A 145 8.167 4.363 4.644 1.00 0.00 H new ATOM 0 HG22 ILE A 145 9.047 4.310 6.190 1.00 0.00 H new ATOM 0 HG23 ILE A 145 8.291 5.827 5.647 1.00 0.00 H new ATOM 0 HD11 ILE A 145 8.661 6.000 1.539 1.00 0.00 H new ATOM 0 HD12 ILE A 145 9.436 4.491 2.079 1.00 0.00 H new ATOM 0 HD13 ILE A 145 7.973 5.084 2.902 1.00 0.00 H new ATOM 1674 N LYS A 146 11.064 5.220 7.820 1.00 0.00 N ATOM 1675 CA LYS A 146 11.582 4.324 8.897 1.00 0.00 C ATOM 1676 C LYS A 146 10.469 4.034 9.905 1.00 0.00 C ATOM 1677 O LYS A 146 9.497 4.756 9.999 1.00 0.00 O ATOM 1678 CB LYS A 146 12.757 5.006 9.615 1.00 0.00 C ATOM 1679 CG LYS A 146 12.365 6.433 10.069 1.00 0.00 C ATOM 1680 CD LYS A 146 12.718 7.468 8.988 1.00 0.00 C ATOM 1681 CE LYS A 146 12.526 8.877 9.554 1.00 0.00 C ATOM 1682 NZ LYS A 146 11.267 8.924 10.351 1.00 0.00 N ATOM 0 H LYS A 146 10.318 5.855 8.105 1.00 0.00 H new ATOM 0 HA LYS A 146 11.922 3.388 8.453 1.00 0.00 H new ATOM 0 HB2 LYS A 146 13.055 4.413 10.479 1.00 0.00 H new ATOM 0 HB3 LYS A 146 13.618 5.054 8.949 1.00 0.00 H new ATOM 0 HG2 LYS A 146 11.296 6.471 10.280 1.00 0.00 H new ATOM 0 HG3 LYS A 146 12.882 6.679 10.997 1.00 0.00 H new ATOM 0 HD2 LYS A 146 13.749 7.332 8.661 1.00 0.00 H new ATOM 0 HD3 LYS A 146 12.085 7.326 8.112 1.00 0.00 H new ATOM 0 HE2 LYS A 146 13.376 9.148 10.180 1.00 0.00 H new ATOM 0 HE3 LYS A 146 12.483 9.604 8.743 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 10.927 9.905 10.406 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 10.544 8.333 9.893 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 11.450 8.567 11.310 1.00 0.00 H new ATOM 1696 N ARG A 147 10.605 2.976 10.664 1.00 0.00 N ATOM 1697 CA ARG A 147 9.557 2.633 11.671 1.00 0.00 C ATOM 1698 C ARG A 147 9.847 3.380 12.977 1.00 0.00 C ATOM 1699 O ARG A 147 10.739 3.025 13.719 1.00 0.00 O ATOM 1700 CB ARG A 147 9.572 1.113 11.918 1.00 0.00 C ATOM 1701 CG ARG A 147 8.197 0.641 12.409 1.00 0.00 C ATOM 1702 CD ARG A 147 7.874 1.277 13.767 1.00 0.00 C ATOM 1703 NE ARG A 147 7.350 2.657 13.562 1.00 0.00 N ATOM 1704 CZ ARG A 147 6.735 3.273 14.535 1.00 0.00 C ATOM 1705 NH1 ARG A 147 6.580 2.680 15.688 1.00 0.00 N ATOM 1706 NH2 ARG A 147 6.274 4.481 14.355 1.00 0.00 N ATOM 0 H ARG A 147 11.398 2.335 10.629 1.00 0.00 H new ATOM 0 HA ARG A 147 8.575 2.927 11.302 1.00 0.00 H new ATOM 0 HB2 ARG A 147 9.837 0.591 10.999 1.00 0.00 H new ATOM 0 HB3 ARG A 147 10.334 0.865 12.656 1.00 0.00 H new ATOM 0 HG2 ARG A 147 7.431 0.910 11.682 1.00 0.00 H new ATOM 0 HG3 ARG A 147 8.187 -0.445 12.496 1.00 0.00 H new ATOM 0 HD2 ARG A 147 7.138 0.673 14.297 1.00 0.00 H new ATOM 0 HD3 ARG A 147 8.769 1.306 14.388 1.00 0.00 H new ATOM 0 HE ARG A 147 7.472 3.120 12.661 1.00 0.00 H new ATOM 0 HH11 ARG A 147 6.939 1.736 15.828 1.00 0.00 H new ATOM 0 HH12 ARG A 147 6.100 3.161 16.448 1.00 0.00 H new ATOM 0 HH21 ARG A 147 6.394 4.944 13.454 1.00 0.00 H new ATOM 0 HH22 ARG A 147 5.794 4.962 15.115 1.00 0.00 H new ATOM 1720 N LYS A 148 9.099 4.413 13.256 1.00 0.00 N ATOM 1721 CA LYS A 148 9.321 5.192 14.509 1.00 0.00 C ATOM 1722 C LYS A 148 8.331 6.366 14.536 1.00 0.00 C ATOM 1723 O LYS A 148 8.350 7.226 13.679 1.00 0.00 O ATOM 1724 CB LYS A 148 10.785 5.713 14.529 1.00 0.00 C ATOM 1725 CG LYS A 148 11.634 4.998 15.613 1.00 0.00 C ATOM 1726 CD LYS A 148 11.584 5.774 16.939 1.00 0.00 C ATOM 1727 CE LYS A 148 10.165 5.743 17.511 1.00 0.00 C ATOM 1728 NZ LYS A 148 10.167 6.355 18.870 1.00 0.00 N ATOM 0 H LYS A 148 8.339 4.753 12.667 1.00 0.00 H new ATOM 0 HA LYS A 148 9.160 4.566 15.387 1.00 0.00 H new ATOM 0 HB2 LYS A 148 11.240 5.559 13.550 1.00 0.00 H new ATOM 0 HB3 LYS A 148 10.787 6.787 14.715 1.00 0.00 H new ATOM 0 HG2 LYS A 148 11.262 3.985 15.764 1.00 0.00 H new ATOM 0 HG3 LYS A 148 12.667 4.911 15.275 1.00 0.00 H new ATOM 0 HD2 LYS A 148 12.282 5.336 17.653 1.00 0.00 H new ATOM 0 HD3 LYS A 148 11.898 6.805 16.778 1.00 0.00 H new ATOM 0 HE2 LYS A 148 9.485 6.287 16.856 1.00 0.00 H new ATOM 0 HE3 LYS A 148 9.804 4.716 17.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 9.204 6.335 19.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 10.804 5.818 19.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 10.495 7.340 18.807 1.00 0.00 H new TER 1742 LYS A 148