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 103 GLN : amide:sc= -0.254 K(o=-1.4,f=-3.8!) USER MOD Set 1.2: A 107 TYR OH : rot -123:sc= -1.12 USER MOD Set 2.1: A 94 HIS : no HE2:sc= -13.3! C(o=-29!,f=-31!) USER MOD Set 2.2: A 96 ASN : amide:sc= -12.5! C(o=-29!,f=-27!) USER MOD Set 2.3: A 99 SER OG : rot 130:sc= -3.28! USER MOD Set 3.1: A 70 LYS NZ :NH3+ -132:sc= -2.72! (180deg=-5.68!) USER MOD Set 3.2: A 73 GLN : amide:sc= -0.904 K(o=-3.6,f=-13!) USER MOD Set 4.1: A 69 THR OG1 : rot -31:sc= 0.7! USER MOD Set 4.2: A 74 SER OG : rot -88:sc= -1.17! USER MOD Single : A 44 SER OG : rot 180:sc= 0.521 USER MOD Single : A 52 LYS NZ :NH3+ -125:sc= -0.269 (180deg=-1.02) USER MOD Single : A 62 THR OG1 : rot -166:sc= 0.8 USER MOD Single : A 63 ASN : amide:sc= -0.904 X(o=-0.9,f=-0.5) USER MOD Single : A 67 CYS SG : rot 180:sc= -0.3 USER MOD Single : A 78 GLN : amide:sc= -0.0407 K(o=-0.041,f=-1.6!) USER MOD Single : A 79 ASN : amide:sc= -0.0143 X(o=-0.014,f=0) USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=-0.09) USER MOD Single : A 82 GLN : amide:sc= -0.895 K(o=-0.89,f=-0.12) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 ASN : amide:sc= -5.89! C(o=-5.9!,f=-3.1!) USER MOD Single : A 92 TYR OH : rot 180:sc= -0.445 USER MOD Single : A 93 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0809) USER MOD Single : A 95 ASN : amide:sc= -6.55! C(o=-6.5!,f=-1.5!) USER MOD Single : A 97 MET CE :methyl -144:sc= -0.281 (180deg=-2.32!) USER MOD Single : A 105 ASN : amide:sc= -5.59! C(o=-5.6!,f=-12!) USER MOD Single : A 106 MET CE :methyl 148:sc= -0.63 (180deg=-1.5) USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 111 LYS NZ :NH3+ 165:sc= -1.04 (180deg=-1.65) USER MOD Single : A 113 THR OG1 : rot 170:sc= -1.1 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 ASN : amide:sc= -4.59! C(o=-4.6!,f=-2.9!) USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 131 HIS : no HD1:sc= -2.53 K(o=-2.5,f=-3.1) USER MOD Single : A 135 LYS NZ :NH3+ -141:sc= -0.711! (180deg=-2.49!) USER MOD Single : A 137 ASN : amide:sc= -2.11! C(o=-2.1!,f=-9.2!) USER MOD Single : A 138 SER OG : rot 180:sc= -0.016 USER MOD Single : A 144 GLN : amide:sc= -1.83 X(o=-1.8,f=-2.1) USER MOD Single : A 146 LYS NZ :NH3+ 160:sc= -0.0257 (180deg=-0.728) USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 43 18.831 -1.941 -3.012 1.00 0.00 N ATOM 2 CA GLY A 43 18.870 -0.505 -3.405 1.00 0.00 C ATOM 3 C GLY A 43 19.288 0.344 -2.203 1.00 0.00 C ATOM 4 O GLY A 43 18.527 0.546 -1.278 1.00 0.00 O ATOM 0 HA2 GLY A 43 19.572 -0.361 -4.226 1.00 0.00 H new ATOM 0 HA3 GLY A 43 17.890 -0.189 -3.764 1.00 0.00 H new ATOM 8 N SER A 44 20.495 0.842 -2.206 1.00 0.00 N ATOM 9 CA SER A 44 20.960 1.675 -1.063 1.00 0.00 C ATOM 10 C SER A 44 20.665 0.947 0.252 1.00 0.00 C ATOM 11 O SER A 44 20.774 -0.259 0.341 1.00 0.00 O ATOM 12 CB SER A 44 20.228 3.018 -1.079 1.00 0.00 C ATOM 13 OG SER A 44 20.763 3.857 -0.063 1.00 0.00 O ATOM 0 H SER A 44 21.178 0.707 -2.951 1.00 0.00 H new ATOM 0 HA SER A 44 22.033 1.846 -1.151 1.00 0.00 H new ATOM 0 HB2 SER A 44 20.337 3.493 -2.054 1.00 0.00 H new ATOM 0 HB3 SER A 44 19.161 2.866 -0.916 1.00 0.00 H new ATOM 0 HG SER A 44 20.297 4.719 -0.072 1.00 0.00 H new ATOM 19 N GLY A 45 20.295 1.672 1.274 1.00 0.00 N ATOM 20 CA GLY A 45 19.995 1.024 2.585 1.00 0.00 C ATOM 21 C GLY A 45 18.529 0.593 2.627 1.00 0.00 C ATOM 22 O GLY A 45 18.078 0.003 3.587 1.00 0.00 O ATOM 0 H GLY A 45 20.187 2.686 1.258 1.00 0.00 H new ATOM 0 HA2 GLY A 45 20.642 0.159 2.730 1.00 0.00 H new ATOM 0 HA3 GLY A 45 20.203 1.718 3.400 1.00 0.00 H new ATOM 26 N VAL A 46 17.782 0.884 1.590 1.00 0.00 N ATOM 27 CA VAL A 46 16.337 0.496 1.556 1.00 0.00 C ATOM 28 C VAL A 46 16.165 -0.940 2.106 1.00 0.00 C ATOM 29 O VAL A 46 16.521 -1.880 1.423 1.00 0.00 O ATOM 30 CB VAL A 46 15.854 0.524 0.104 1.00 0.00 C ATOM 31 CG1 VAL A 46 14.376 0.134 0.049 1.00 0.00 C ATOM 32 CG2 VAL A 46 16.029 1.936 -0.463 1.00 0.00 C ATOM 0 H VAL A 46 18.113 1.377 0.761 1.00 0.00 H new ATOM 0 HA VAL A 46 15.761 1.192 2.166 1.00 0.00 H new ATOM 0 HB VAL A 46 16.438 -0.182 -0.487 1.00 0.00 H new ATOM 0 HG11 VAL A 46 14.033 0.154 -0.985 1.00 0.00 H new ATOM 0 HG12 VAL A 46 14.249 -0.870 0.454 1.00 0.00 H new ATOM 0 HG13 VAL A 46 13.791 0.840 0.639 1.00 0.00 H new ATOM 0 HG21 VAL A 46 15.686 1.958 -1.497 1.00 0.00 H new ATOM 0 HG22 VAL A 46 15.444 2.641 0.129 1.00 0.00 H new ATOM 0 HG23 VAL A 46 17.082 2.216 -0.424 1.00 0.00 H new ATOM 42 N PRO A 47 15.639 -1.102 3.314 1.00 0.00 N ATOM 43 CA PRO A 47 15.464 -2.454 3.883 1.00 0.00 C ATOM 44 C PRO A 47 14.482 -3.259 3.021 1.00 0.00 C ATOM 45 O PRO A 47 13.911 -2.752 2.076 1.00 0.00 O ATOM 46 CB PRO A 47 14.913 -2.225 5.312 1.00 0.00 C ATOM 47 CG PRO A 47 14.767 -0.688 5.516 1.00 0.00 C ATOM 48 CD PRO A 47 15.186 0.000 4.198 1.00 0.00 C ATOM 0 HA PRO A 47 16.393 -3.024 3.908 1.00 0.00 H new ATOM 0 HB2 PRO A 47 13.951 -2.721 5.436 1.00 0.00 H new ATOM 0 HB3 PRO A 47 15.588 -2.648 6.056 1.00 0.00 H new ATOM 0 HG2 PRO A 47 13.739 -0.432 5.772 1.00 0.00 H new ATOM 0 HG3 PRO A 47 15.394 -0.350 6.341 1.00 0.00 H new ATOM 0 HD2 PRO A 47 14.352 0.544 3.755 1.00 0.00 H new ATOM 0 HD3 PRO A 47 15.984 0.723 4.367 1.00 0.00 H new ATOM 56 N ALA A 48 14.283 -4.507 3.344 1.00 0.00 N ATOM 57 CA ALA A 48 13.339 -5.343 2.548 1.00 0.00 C ATOM 58 C ALA A 48 11.904 -5.055 2.992 1.00 0.00 C ATOM 59 O ALA A 48 11.318 -5.800 3.753 1.00 0.00 O ATOM 60 CB ALA A 48 13.655 -6.823 2.775 1.00 0.00 C ATOM 0 H ALA A 48 14.733 -4.985 4.125 1.00 0.00 H new ATOM 0 HA ALA A 48 13.446 -5.106 1.490 1.00 0.00 H new ATOM 0 HB1 ALA A 48 12.966 -7.436 2.194 1.00 0.00 H new ATOM 0 HB2 ALA A 48 14.678 -7.029 2.460 1.00 0.00 H new ATOM 0 HB3 ALA A 48 13.547 -7.060 3.833 1.00 0.00 H new ATOM 66 N PHE A 49 11.332 -3.978 2.526 1.00 0.00 N ATOM 67 CA PHE A 49 9.937 -3.645 2.924 1.00 0.00 C ATOM 68 C PHE A 49 9.346 -2.649 1.918 1.00 0.00 C ATOM 69 O PHE A 49 8.703 -3.036 0.962 1.00 0.00 O ATOM 70 CB PHE A 49 9.944 -3.048 4.338 1.00 0.00 C ATOM 71 CG PHE A 49 8.548 -3.088 4.946 1.00 0.00 C ATOM 72 CD1 PHE A 49 7.491 -2.326 4.392 1.00 0.00 C ATOM 73 CD2 PHE A 49 8.306 -3.885 6.084 1.00 0.00 C ATOM 74 CE1 PHE A 49 6.212 -2.366 4.970 1.00 0.00 C ATOM 75 CE2 PHE A 49 7.023 -3.920 6.661 1.00 0.00 C ATOM 76 CZ PHE A 49 5.976 -3.162 6.105 1.00 0.00 C ATOM 0 H PHE A 49 11.771 -3.315 1.887 1.00 0.00 H new ATOM 0 HA PHE A 49 9.322 -4.545 2.926 1.00 0.00 H new ATOM 0 HB2 PHE A 49 10.637 -3.604 4.969 1.00 0.00 H new ATOM 0 HB3 PHE A 49 10.301 -2.019 4.302 1.00 0.00 H new ATOM 0 HD1 PHE A 49 7.669 -1.712 3.522 1.00 0.00 H new ATOM 0 HD2 PHE A 49 9.106 -4.469 6.513 1.00 0.00 H new ATOM 0 HE1 PHE A 49 5.408 -1.785 4.542 1.00 0.00 H new ATOM 0 HE2 PHE A 49 6.841 -4.530 7.533 1.00 0.00 H new ATOM 0 HZ PHE A 49 4.992 -3.192 6.549 1.00 0.00 H new ATOM 86 N LEU A 50 9.545 -1.367 2.114 1.00 0.00 N ATOM 87 CA LEU A 50 8.973 -0.382 1.153 1.00 0.00 C ATOM 88 C LEU A 50 9.353 -0.805 -0.268 1.00 0.00 C ATOM 89 O LEU A 50 8.733 -0.409 -1.235 1.00 0.00 O ATOM 90 CB LEU A 50 9.526 1.027 1.432 1.00 0.00 C ATOM 91 CG LEU A 50 9.054 1.571 2.803 1.00 0.00 C ATOM 92 CD1 LEU A 50 7.517 1.533 2.909 1.00 0.00 C ATOM 93 CD2 LEU A 50 9.699 0.775 3.958 1.00 0.00 C ATOM 0 H LEU A 50 10.073 -0.967 2.890 1.00 0.00 H new ATOM 0 HA LEU A 50 7.889 -0.358 1.265 1.00 0.00 H new ATOM 0 HB2 LEU A 50 10.615 1.001 1.407 1.00 0.00 H new ATOM 0 HB3 LEU A 50 9.205 1.706 0.642 1.00 0.00 H new ATOM 0 HG LEU A 50 9.374 2.610 2.883 1.00 0.00 H new ATOM 0 HD11 LEU A 50 7.210 1.920 3.881 1.00 0.00 H new ATOM 0 HD12 LEU A 50 7.083 2.147 2.120 1.00 0.00 H new ATOM 0 HD13 LEU A 50 7.170 0.505 2.802 1.00 0.00 H new ATOM 0 HD21 LEU A 50 9.354 1.174 4.912 1.00 0.00 H new ATOM 0 HD22 LEU A 50 9.415 -0.275 3.879 1.00 0.00 H new ATOM 0 HD23 LEU A 50 10.784 0.863 3.899 1.00 0.00 H new ATOM 105 N ALA A 51 10.361 -1.625 -0.397 1.00 0.00 N ATOM 106 CA ALA A 51 10.773 -2.092 -1.749 1.00 0.00 C ATOM 107 C ALA A 51 9.816 -3.196 -2.202 1.00 0.00 C ATOM 108 O ALA A 51 9.479 -3.302 -3.364 1.00 0.00 O ATOM 109 CB ALA A 51 12.202 -2.637 -1.689 1.00 0.00 C ATOM 0 H ALA A 51 10.916 -1.991 0.376 1.00 0.00 H new ATOM 0 HA ALA A 51 10.739 -1.263 -2.456 1.00 0.00 H new ATOM 0 HB1 ALA A 51 12.503 -2.979 -2.679 1.00 0.00 H new ATOM 0 HB2 ALA A 51 12.878 -1.850 -1.356 1.00 0.00 H new ATOM 0 HB3 ALA A 51 12.244 -3.471 -0.989 1.00 0.00 H new ATOM 115 N LYS A 52 9.363 -4.014 -1.287 1.00 0.00 N ATOM 116 CA LYS A 52 8.415 -5.103 -1.664 1.00 0.00 C ATOM 117 C LYS A 52 7.200 -4.467 -2.352 1.00 0.00 C ATOM 118 O LYS A 52 6.712 -4.954 -3.352 1.00 0.00 O ATOM 119 CB LYS A 52 7.972 -5.861 -0.386 1.00 0.00 C ATOM 120 CG LYS A 52 8.640 -7.240 -0.311 1.00 0.00 C ATOM 121 CD LYS A 52 10.152 -7.079 -0.125 1.00 0.00 C ATOM 122 CE LYS A 52 10.753 -8.412 0.327 1.00 0.00 C ATOM 123 NZ LYS A 52 10.204 -8.776 1.665 1.00 0.00 N ATOM 0 H LYS A 52 9.608 -3.975 -0.298 1.00 0.00 H new ATOM 0 HA LYS A 52 8.892 -5.810 -2.342 1.00 0.00 H new ATOM 0 HB2 LYS A 52 8.232 -5.277 0.497 1.00 0.00 H new ATOM 0 HB3 LYS A 52 6.888 -5.976 -0.384 1.00 0.00 H new ATOM 0 HG2 LYS A 52 8.222 -7.811 0.518 1.00 0.00 H new ATOM 0 HG3 LYS A 52 8.435 -7.803 -1.222 1.00 0.00 H new ATOM 0 HD2 LYS A 52 10.612 -6.758 -1.059 1.00 0.00 H new ATOM 0 HD3 LYS A 52 10.358 -6.305 0.614 1.00 0.00 H new ATOM 0 HE2 LYS A 52 10.521 -9.192 -0.398 1.00 0.00 H new ATOM 0 HE3 LYS A 52 11.839 -8.335 0.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 10.988 -8.939 2.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 9.607 -8.001 2.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 9.634 -9.642 1.583 1.00 0.00 H new ATOM 137 N LEU A 53 6.711 -3.382 -1.817 1.00 0.00 N ATOM 138 CA LEU A 53 5.531 -2.712 -2.430 1.00 0.00 C ATOM 139 C LEU A 53 5.878 -2.276 -3.854 1.00 0.00 C ATOM 140 O LEU A 53 5.329 -2.770 -4.817 1.00 0.00 O ATOM 141 CB LEU A 53 5.148 -1.477 -1.605 1.00 0.00 C ATOM 142 CG LEU A 53 5.067 -1.841 -0.119 1.00 0.00 C ATOM 143 CD1 LEU A 53 4.807 -0.573 0.699 1.00 0.00 C ATOM 144 CD2 LEU A 53 3.924 -2.837 0.109 1.00 0.00 C ATOM 0 H LEU A 53 7.079 -2.930 -0.980 1.00 0.00 H new ATOM 0 HA LEU A 53 4.693 -3.409 -2.450 1.00 0.00 H new ATOM 0 HB2 LEU A 53 5.885 -0.688 -1.754 1.00 0.00 H new ATOM 0 HB3 LEU A 53 4.189 -1.086 -1.945 1.00 0.00 H new ATOM 0 HG LEU A 53 6.007 -2.295 0.194 1.00 0.00 H new ATOM 0 HD11 LEU A 53 4.749 -0.828 1.757 1.00 0.00 H new ATOM 0 HD12 LEU A 53 5.620 0.135 0.541 1.00 0.00 H new ATOM 0 HD13 LEU A 53 3.867 -0.122 0.382 1.00 0.00 H new ATOM 0 HD21 LEU A 53 3.870 -3.093 1.167 1.00 0.00 H new ATOM 0 HD22 LEU A 53 2.982 -2.387 -0.204 1.00 0.00 H new ATOM 0 HD23 LEU A 53 4.106 -3.740 -0.474 1.00 0.00 H new ATOM 156 N TRP A 54 6.784 -1.349 -3.988 1.00 0.00 N ATOM 157 CA TRP A 54 7.170 -0.871 -5.345 1.00 0.00 C ATOM 158 C TRP A 54 7.547 -2.065 -6.229 1.00 0.00 C ATOM 159 O TRP A 54 7.719 -1.929 -7.424 1.00 0.00 O ATOM 160 CB TRP A 54 8.366 0.081 -5.222 1.00 0.00 C ATOM 161 CG TRP A 54 8.882 0.434 -6.583 1.00 0.00 C ATOM 162 CD1 TRP A 54 8.117 0.831 -7.627 1.00 0.00 C ATOM 163 CD2 TRP A 54 10.257 0.427 -7.063 1.00 0.00 C ATOM 164 NE1 TRP A 54 8.933 1.070 -8.718 1.00 0.00 N ATOM 165 CE2 TRP A 54 10.261 0.836 -8.424 1.00 0.00 C ATOM 166 CE3 TRP A 54 11.496 0.109 -6.457 1.00 0.00 C ATOM 167 CZ2 TRP A 54 11.451 0.926 -9.160 1.00 0.00 C ATOM 168 CZ3 TRP A 54 12.696 0.199 -7.194 1.00 0.00 C ATOM 169 CH2 TRP A 54 12.672 0.607 -8.543 1.00 0.00 C ATOM 0 H TRP A 54 7.275 -0.900 -3.215 1.00 0.00 H new ATOM 0 HA TRP A 54 6.330 -0.346 -5.799 1.00 0.00 H new ATOM 0 HB2 TRP A 54 8.068 0.985 -4.691 1.00 0.00 H new ATOM 0 HB3 TRP A 54 9.156 -0.388 -4.635 1.00 0.00 H new ATOM 0 HD1 TRP A 54 7.043 0.943 -7.611 1.00 0.00 H new ATOM 0 HE1 TRP A 54 8.595 1.381 -9.629 1.00 0.00 H new ATOM 0 HE3 TRP A 54 11.523 -0.205 -5.424 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 11.429 1.238 -10.194 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 13.636 -0.046 -6.723 1.00 0.00 H new ATOM 0 HH2 TRP A 54 13.593 0.674 -9.103 1.00 0.00 H new ATOM 180 N ARG A 55 7.685 -3.232 -5.654 1.00 0.00 N ATOM 181 CA ARG A 55 8.059 -4.436 -6.464 1.00 0.00 C ATOM 182 C ARG A 55 6.804 -5.236 -6.819 1.00 0.00 C ATOM 183 O ARG A 55 6.353 -5.220 -7.948 1.00 0.00 O ATOM 184 CB ARG A 55 9.016 -5.318 -5.649 1.00 0.00 C ATOM 185 CG ARG A 55 10.433 -4.686 -5.600 1.00 0.00 C ATOM 186 CD ARG A 55 11.370 -5.372 -6.607 1.00 0.00 C ATOM 187 NE ARG A 55 10.900 -5.110 -7.998 1.00 0.00 N ATOM 188 CZ ARG A 55 11.697 -5.330 -9.008 1.00 0.00 C ATOM 189 NH1 ARG A 55 12.905 -5.781 -8.801 1.00 0.00 N ATOM 190 NH2 ARG A 55 11.286 -5.102 -10.225 1.00 0.00 N ATOM 0 H ARG A 55 7.555 -3.406 -4.657 1.00 0.00 H new ATOM 0 HA ARG A 55 8.548 -4.114 -7.383 1.00 0.00 H new ATOM 0 HB2 ARG A 55 8.632 -5.442 -4.636 1.00 0.00 H new ATOM 0 HB3 ARG A 55 9.070 -6.312 -6.093 1.00 0.00 H new ATOM 0 HG2 ARG A 55 10.369 -3.621 -5.823 1.00 0.00 H new ATOM 0 HG3 ARG A 55 10.843 -4.778 -4.594 1.00 0.00 H new ATOM 0 HD2 ARG A 55 12.387 -5.001 -6.482 1.00 0.00 H new ATOM 0 HD3 ARG A 55 11.397 -6.445 -6.419 1.00 0.00 H new ATOM 0 HE ARG A 55 9.956 -4.759 -8.160 1.00 0.00 H new ATOM 0 HH11 ARG A 55 13.226 -5.961 -7.850 1.00 0.00 H new ATOM 0 HH12 ARG A 55 13.527 -5.953 -9.591 1.00 0.00 H new ATOM 0 HH21 ARG A 55 10.342 -4.752 -10.387 1.00 0.00 H new ATOM 0 HH22 ARG A 55 11.909 -5.274 -11.014 1.00 0.00 H new ATOM 204 N LEU A 56 6.236 -5.944 -5.877 1.00 0.00 N ATOM 205 CA LEU A 56 5.018 -6.745 -6.193 1.00 0.00 C ATOM 206 C LEU A 56 4.018 -5.864 -6.944 1.00 0.00 C ATOM 207 O LEU A 56 3.222 -6.342 -7.726 1.00 0.00 O ATOM 208 CB LEU A 56 4.403 -7.308 -4.894 1.00 0.00 C ATOM 209 CG LEU A 56 3.576 -6.230 -4.137 1.00 0.00 C ATOM 210 CD1 LEU A 56 2.079 -6.367 -4.462 1.00 0.00 C ATOM 211 CD2 LEU A 56 3.756 -6.406 -2.623 1.00 0.00 C ATOM 0 H LEU A 56 6.560 -6.002 -4.911 1.00 0.00 H new ATOM 0 HA LEU A 56 5.284 -7.590 -6.828 1.00 0.00 H new ATOM 0 HB2 LEU A 56 3.763 -8.157 -5.132 1.00 0.00 H new ATOM 0 HB3 LEU A 56 5.197 -7.679 -4.246 1.00 0.00 H new ATOM 0 HG LEU A 56 3.931 -5.249 -4.453 1.00 0.00 H new ATOM 0 HD11 LEU A 56 1.518 -5.604 -3.922 1.00 0.00 H new ATOM 0 HD12 LEU A 56 1.926 -6.240 -5.534 1.00 0.00 H new ATOM 0 HD13 LEU A 56 1.730 -7.355 -4.160 1.00 0.00 H new ATOM 0 HD21 LEU A 56 3.175 -5.649 -2.097 1.00 0.00 H new ATOM 0 HD22 LEU A 56 3.411 -7.397 -2.328 1.00 0.00 H new ATOM 0 HD23 LEU A 56 4.810 -6.297 -2.367 1.00 0.00 H new ATOM 223 N VAL A 57 4.069 -4.575 -6.734 1.00 0.00 N ATOM 224 CA VAL A 57 3.138 -3.669 -7.462 1.00 0.00 C ATOM 225 C VAL A 57 3.538 -3.665 -8.941 1.00 0.00 C ATOM 226 O VAL A 57 4.702 -3.757 -9.274 1.00 0.00 O ATOM 227 CB VAL A 57 3.243 -2.246 -6.889 1.00 0.00 C ATOM 228 CG1 VAL A 57 2.572 -1.245 -7.836 1.00 0.00 C ATOM 229 CG2 VAL A 57 2.546 -2.185 -5.526 1.00 0.00 C ATOM 0 H VAL A 57 4.713 -4.113 -6.092 1.00 0.00 H new ATOM 0 HA VAL A 57 2.110 -4.013 -7.350 1.00 0.00 H new ATOM 0 HB VAL A 57 4.297 -1.991 -6.778 1.00 0.00 H new ATOM 0 HG11 VAL A 57 2.652 -0.241 -7.420 1.00 0.00 H new ATOM 0 HG12 VAL A 57 3.065 -1.276 -8.807 1.00 0.00 H new ATOM 0 HG13 VAL A 57 1.520 -1.505 -7.955 1.00 0.00 H new ATOM 0 HG21 VAL A 57 2.623 -1.175 -5.123 1.00 0.00 H new ATOM 0 HG22 VAL A 57 1.495 -2.451 -5.642 1.00 0.00 H new ATOM 0 HG23 VAL A 57 3.024 -2.886 -4.841 1.00 0.00 H new ATOM 239 N ASP A 58 2.586 -3.558 -9.827 1.00 0.00 N ATOM 240 CA ASP A 58 2.915 -3.543 -11.282 1.00 0.00 C ATOM 241 C ASP A 58 3.577 -4.869 -11.681 1.00 0.00 C ATOM 242 O ASP A 58 2.959 -5.723 -12.284 1.00 0.00 O ATOM 243 CB ASP A 58 3.866 -2.372 -11.581 1.00 0.00 C ATOM 244 CG ASP A 58 3.806 -2.023 -13.070 1.00 0.00 C ATOM 245 OD1 ASP A 58 4.525 -2.645 -13.834 1.00 0.00 O ATOM 246 OD2 ASP A 58 3.040 -1.139 -13.421 1.00 0.00 O ATOM 0 H ASP A 58 1.593 -3.480 -9.607 1.00 0.00 H new ATOM 0 HA ASP A 58 1.998 -3.419 -11.858 1.00 0.00 H new ATOM 0 HB2 ASP A 58 3.588 -1.504 -10.983 1.00 0.00 H new ATOM 0 HB3 ASP A 58 4.885 -2.639 -11.301 1.00 0.00 H new ATOM 251 N ASP A 59 4.830 -5.043 -11.358 1.00 0.00 N ATOM 252 CA ASP A 59 5.531 -6.306 -11.724 1.00 0.00 C ATOM 253 C ASP A 59 4.671 -7.512 -11.342 1.00 0.00 C ATOM 254 O ASP A 59 3.634 -7.378 -10.723 1.00 0.00 O ATOM 255 CB ASP A 59 6.867 -6.379 -10.981 1.00 0.00 C ATOM 256 CG ASP A 59 7.681 -7.562 -11.508 1.00 0.00 C ATOM 257 OD1 ASP A 59 7.955 -7.584 -12.696 1.00 0.00 O ATOM 258 OD2 ASP A 59 8.016 -8.426 -10.714 1.00 0.00 O ATOM 0 H ASP A 59 5.399 -4.363 -10.855 1.00 0.00 H new ATOM 0 HA ASP A 59 5.706 -6.319 -12.800 1.00 0.00 H new ATOM 0 HB2 ASP A 59 7.423 -5.452 -11.119 1.00 0.00 H new ATOM 0 HB3 ASP A 59 6.694 -6.491 -9.911 1.00 0.00 H new ATOM 263 N ALA A 60 5.098 -8.690 -11.707 1.00 0.00 N ATOM 264 CA ALA A 60 4.316 -9.912 -11.368 1.00 0.00 C ATOM 265 C ALA A 60 2.865 -9.734 -11.809 1.00 0.00 C ATOM 266 O ALA A 60 2.526 -8.804 -12.514 1.00 0.00 O ATOM 267 CB ALA A 60 4.358 -10.145 -9.858 1.00 0.00 C ATOM 0 H ALA A 60 5.959 -8.859 -12.228 1.00 0.00 H new ATOM 0 HA ALA A 60 4.751 -10.769 -11.883 1.00 0.00 H new ATOM 0 HB1 ALA A 60 3.785 -11.039 -9.612 1.00 0.00 H new ATOM 0 HB2 ALA A 60 5.392 -10.277 -9.539 1.00 0.00 H new ATOM 0 HB3 ALA A 60 3.927 -9.285 -9.345 1.00 0.00 H new ATOM 273 N ASP A 61 2.002 -10.627 -11.394 1.00 0.00 N ATOM 274 CA ASP A 61 0.565 -10.531 -11.776 1.00 0.00 C ATOM 275 C ASP A 61 -0.233 -9.912 -10.629 1.00 0.00 C ATOM 276 O ASP A 61 -1.196 -10.482 -10.154 1.00 0.00 O ATOM 277 CB ASP A 61 0.025 -11.932 -12.071 1.00 0.00 C ATOM 278 CG ASP A 61 0.566 -12.417 -13.416 1.00 0.00 C ATOM 279 OD1 ASP A 61 0.629 -11.613 -14.331 1.00 0.00 O ATOM 280 OD2 ASP A 61 0.909 -13.584 -13.509 1.00 0.00 O ATOM 0 H ASP A 61 2.236 -11.424 -10.802 1.00 0.00 H new ATOM 0 HA ASP A 61 0.468 -9.905 -12.663 1.00 0.00 H new ATOM 0 HB2 ASP A 61 0.320 -12.621 -11.279 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -1.065 -11.916 -12.090 1.00 0.00 H new ATOM 285 N THR A 62 0.157 -8.748 -10.179 1.00 0.00 N ATOM 286 CA THR A 62 -0.578 -8.081 -9.059 1.00 0.00 C ATOM 287 C THR A 62 -1.517 -7.018 -9.631 1.00 0.00 C ATOM 288 O THR A 62 -2.358 -6.483 -8.936 1.00 0.00 O ATOM 289 CB THR A 62 0.430 -7.422 -8.117 1.00 0.00 C ATOM 290 OG1 THR A 62 1.122 -6.394 -8.811 1.00 0.00 O ATOM 291 CG2 THR A 62 1.428 -8.474 -7.627 1.00 0.00 C ATOM 0 H THR A 62 0.956 -8.227 -10.540 1.00 0.00 H new ATOM 0 HA THR A 62 -1.161 -8.820 -8.509 1.00 0.00 H new ATOM 0 HB THR A 62 -0.093 -6.992 -7.262 1.00 0.00 H new ATOM 0 HG1 THR A 62 1.910 -6.124 -8.295 1.00 0.00 H new ATOM 0 HG21 THR A 62 2.148 -8.007 -6.955 1.00 0.00 H new ATOM 0 HG22 THR A 62 0.894 -9.262 -7.096 1.00 0.00 H new ATOM 0 HG23 THR A 62 1.953 -8.903 -8.481 1.00 0.00 H new ATOM 299 N ASN A 63 -1.389 -6.713 -10.895 1.00 0.00 N ATOM 300 CA ASN A 63 -2.286 -5.691 -11.508 1.00 0.00 C ATOM 301 C ASN A 63 -3.734 -6.155 -11.361 1.00 0.00 C ATOM 302 O ASN A 63 -4.308 -6.734 -12.262 1.00 0.00 O ATOM 303 CB ASN A 63 -1.947 -5.533 -12.991 1.00 0.00 C ATOM 304 CG ASN A 63 -2.944 -4.572 -13.643 1.00 0.00 C ATOM 305 OD1 ASN A 63 -2.732 -3.377 -13.660 1.00 0.00 O ATOM 306 ND2 ASN A 63 -4.033 -5.049 -14.182 1.00 0.00 N ATOM 0 H ASN A 63 -0.704 -7.126 -11.528 1.00 0.00 H new ATOM 0 HA ASN A 63 -2.151 -4.732 -11.007 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -0.932 -5.153 -13.104 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -1.982 -6.502 -13.488 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -4.705 -4.418 -14.617 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -4.211 -6.053 -14.168 1.00 0.00 H new ATOM 313 N ARG A 64 -4.324 -5.922 -10.222 1.00 0.00 N ATOM 314 CA ARG A 64 -5.728 -6.363 -9.997 1.00 0.00 C ATOM 315 C ARG A 64 -6.066 -6.162 -8.515 1.00 0.00 C ATOM 316 O ARG A 64 -6.899 -5.351 -8.161 1.00 0.00 O ATOM 317 CB ARG A 64 -5.852 -7.845 -10.422 1.00 0.00 C ATOM 318 CG ARG A 64 -6.826 -8.628 -9.508 1.00 0.00 C ATOM 319 CD ARG A 64 -7.355 -9.903 -10.216 1.00 0.00 C ATOM 320 NE ARG A 64 -8.843 -10.004 -10.060 1.00 0.00 N ATOM 321 CZ ARG A 64 -9.419 -9.834 -8.899 1.00 0.00 C ATOM 322 NH1 ARG A 64 -8.701 -9.653 -7.827 1.00 0.00 N ATOM 323 NH2 ARG A 64 -10.721 -9.872 -8.809 1.00 0.00 N ATOM 0 H ARG A 64 -3.891 -5.442 -9.433 1.00 0.00 H new ATOM 0 HA ARG A 64 -6.433 -5.781 -10.590 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -6.200 -7.899 -11.454 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -4.869 -8.315 -10.392 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -6.319 -8.906 -8.584 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -7.664 -7.988 -9.232 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -7.094 -9.875 -11.274 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -6.877 -10.787 -9.794 1.00 0.00 H new ATOM 0 HE ARG A 64 -9.418 -10.210 -10.877 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -7.683 -9.643 -7.891 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -9.157 -9.521 -6.924 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -11.285 -10.034 -9.643 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -11.174 -9.740 -7.905 1.00 0.00 H new ATOM 337 N LEU A 65 -5.425 -6.895 -7.651 1.00 0.00 N ATOM 338 CA LEU A 65 -5.706 -6.748 -6.199 1.00 0.00 C ATOM 339 C LEU A 65 -4.972 -5.504 -5.688 1.00 0.00 C ATOM 340 O LEU A 65 -5.101 -5.112 -4.545 1.00 0.00 O ATOM 341 CB LEU A 65 -5.216 -8.010 -5.467 1.00 0.00 C ATOM 342 CG LEU A 65 -6.302 -9.108 -5.500 1.00 0.00 C ATOM 343 CD1 LEU A 65 -5.647 -10.489 -5.345 1.00 0.00 C ATOM 344 CD2 LEU A 65 -7.315 -8.890 -4.359 1.00 0.00 C ATOM 0 H LEU A 65 -4.718 -7.590 -7.888 1.00 0.00 H new ATOM 0 HA LEU A 65 -6.774 -6.632 -6.017 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -4.303 -8.378 -5.935 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -4.968 -7.766 -4.434 1.00 0.00 H new ATOM 0 HG LEU A 65 -6.825 -9.056 -6.455 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -6.416 -11.261 -5.369 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -4.944 -10.652 -6.162 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -5.116 -10.535 -4.394 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -8.075 -9.670 -4.393 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -6.797 -8.929 -3.401 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -7.790 -7.916 -4.475 1.00 0.00 H new ATOM 356 N ILE A 66 -4.213 -4.873 -6.545 1.00 0.00 N ATOM 357 CA ILE A 66 -3.476 -3.639 -6.148 1.00 0.00 C ATOM 358 C ILE A 66 -3.088 -2.866 -7.412 1.00 0.00 C ATOM 359 O ILE A 66 -2.735 -3.447 -8.419 1.00 0.00 O ATOM 360 CB ILE A 66 -2.210 -4.008 -5.364 1.00 0.00 C ATOM 361 CG1 ILE A 66 -1.376 -2.736 -5.119 1.00 0.00 C ATOM 362 CG2 ILE A 66 -1.392 -5.025 -6.170 1.00 0.00 C ATOM 363 CD1 ILE A 66 -0.393 -2.964 -3.966 1.00 0.00 C ATOM 0 H ILE A 66 -4.072 -5.164 -7.512 1.00 0.00 H new ATOM 0 HA ILE A 66 -4.114 -3.024 -5.514 1.00 0.00 H new ATOM 0 HB ILE A 66 -2.483 -4.449 -4.405 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -0.831 -2.469 -6.024 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -2.035 -1.899 -4.885 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -0.492 -5.289 -5.615 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -1.990 -5.921 -6.339 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -1.112 -4.589 -7.129 1.00 0.00 H new ATOM 0 HD11 ILE A 66 0.191 -2.059 -3.802 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -0.946 -3.209 -3.059 1.00 0.00 H new ATOM 0 HD13 ILE A 66 0.276 -3.787 -4.216 1.00 0.00 H new ATOM 375 N CYS A 67 -3.151 -1.563 -7.373 1.00 0.00 N ATOM 376 CA CYS A 67 -2.785 -0.766 -8.581 1.00 0.00 C ATOM 377 C CYS A 67 -2.459 0.672 -8.172 1.00 0.00 C ATOM 378 O CYS A 67 -2.813 1.118 -7.099 1.00 0.00 O ATOM 379 CB CYS A 67 -3.959 -0.762 -9.562 1.00 0.00 C ATOM 380 SG CYS A 67 -3.393 -0.170 -11.176 1.00 0.00 S ATOM 0 H CYS A 67 -3.439 -1.017 -6.561 1.00 0.00 H new ATOM 0 HA CYS A 67 -1.912 -1.212 -9.057 1.00 0.00 H new ATOM 0 HB2 CYS A 67 -4.372 -1.766 -9.655 1.00 0.00 H new ATOM 0 HB3 CYS A 67 -4.758 -0.122 -9.187 1.00 0.00 H new ATOM 0 HG CYS A 67 -4.389 -0.168 -12.011 1.00 0.00 H new ATOM 386 N TRP A 68 -1.787 1.402 -9.022 1.00 0.00 N ATOM 387 CA TRP A 68 -1.442 2.811 -8.683 1.00 0.00 C ATOM 388 C TRP A 68 -2.688 3.687 -8.822 1.00 0.00 C ATOM 389 O TRP A 68 -3.636 3.327 -9.491 1.00 0.00 O ATOM 390 CB TRP A 68 -0.369 3.324 -9.647 1.00 0.00 C ATOM 391 CG TRP A 68 0.858 2.483 -9.534 1.00 0.00 C ATOM 392 CD1 TRP A 68 1.060 1.312 -10.182 1.00 0.00 C ATOM 393 CD2 TRP A 68 2.058 2.728 -8.745 1.00 0.00 C ATOM 394 NE1 TRP A 68 2.307 0.819 -9.842 1.00 0.00 N ATOM 395 CE2 TRP A 68 2.963 1.653 -8.958 1.00 0.00 C ATOM 396 CE3 TRP A 68 2.448 3.768 -7.870 1.00 0.00 C ATOM 397 CZ2 TRP A 68 4.212 1.612 -8.326 1.00 0.00 C ATOM 398 CZ3 TRP A 68 3.706 3.730 -7.231 1.00 0.00 C ATOM 399 CH2 TRP A 68 4.586 2.653 -7.459 1.00 0.00 C ATOM 0 H TRP A 68 -1.463 1.083 -9.935 1.00 0.00 H new ATOM 0 HA TRP A 68 -1.069 2.852 -7.660 1.00 0.00 H new ATOM 0 HB2 TRP A 68 -0.745 3.299 -10.670 1.00 0.00 H new ATOM 0 HB3 TRP A 68 -0.131 4.363 -9.420 1.00 0.00 H new ATOM 0 HD1 TRP A 68 0.361 0.839 -10.856 1.00 0.00 H new ATOM 0 HE1 TRP A 68 2.695 -0.054 -10.200 1.00 0.00 H new ATOM 0 HE3 TRP A 68 1.779 4.597 -7.689 1.00 0.00 H new ATOM 0 HZ2 TRP A 68 4.884 0.785 -8.504 1.00 0.00 H new ATOM 0 HZ3 TRP A 68 3.995 4.529 -6.565 1.00 0.00 H new ATOM 0 HH2 TRP A 68 5.547 2.628 -6.968 1.00 0.00 H new ATOM 410 N THR A 69 -2.687 4.841 -8.203 1.00 0.00 N ATOM 411 CA THR A 69 -3.864 5.763 -8.300 1.00 0.00 C ATOM 412 C THR A 69 -3.483 6.958 -9.176 1.00 0.00 C ATOM 413 O THR A 69 -2.361 7.422 -9.151 1.00 0.00 O ATOM 414 CB THR A 69 -4.238 6.265 -6.903 1.00 0.00 C ATOM 415 OG1 THR A 69 -3.414 7.372 -6.567 1.00 0.00 O ATOM 416 CG2 THR A 69 -4.032 5.144 -5.883 1.00 0.00 C ATOM 0 H THR A 69 -1.917 5.188 -7.631 1.00 0.00 H new ATOM 0 HA THR A 69 -4.712 5.233 -8.734 1.00 0.00 H new ATOM 0 HB THR A 69 -5.284 6.572 -6.893 1.00 0.00 H new ATOM 0 HG1 THR A 69 -2.538 7.269 -6.994 1.00 0.00 H new ATOM 0 HG21 THR A 69 -4.299 5.503 -4.889 1.00 0.00 H new ATOM 0 HG22 THR A 69 -4.663 4.295 -6.143 1.00 0.00 H new ATOM 0 HG23 THR A 69 -2.987 4.834 -5.889 1.00 0.00 H new ATOM 424 N LYS A 70 -4.408 7.459 -9.948 1.00 0.00 N ATOM 425 CA LYS A 70 -4.103 8.625 -10.827 1.00 0.00 C ATOM 426 C LYS A 70 -2.923 8.287 -11.747 1.00 0.00 C ATOM 427 O LYS A 70 -3.107 7.925 -12.892 1.00 0.00 O ATOM 428 CB LYS A 70 -3.758 9.844 -9.964 1.00 0.00 C ATOM 429 CG LYS A 70 -3.716 11.102 -10.837 1.00 0.00 C ATOM 430 CD LYS A 70 -3.691 12.347 -9.944 1.00 0.00 C ATOM 431 CE LYS A 70 -2.552 12.237 -8.922 1.00 0.00 C ATOM 432 NZ LYS A 70 -2.986 11.374 -7.787 1.00 0.00 N ATOM 0 H LYS A 70 -5.365 7.111 -10.009 1.00 0.00 H new ATOM 0 HA LYS A 70 -4.976 8.854 -11.438 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -4.499 9.963 -9.174 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -2.794 9.696 -9.477 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -2.834 11.083 -11.477 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -4.586 11.130 -11.494 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -3.558 13.240 -10.555 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -4.645 12.453 -9.428 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -1.664 11.816 -9.394 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -2.280 13.227 -8.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -2.759 11.844 -6.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -4.012 11.214 -7.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -2.490 10.461 -7.836 1.00 0.00 H new ATOM 446 N ASP A 71 -1.712 8.400 -11.262 1.00 0.00 N ATOM 447 CA ASP A 71 -0.538 8.082 -12.126 1.00 0.00 C ATOM 448 C ASP A 71 0.750 8.116 -11.295 1.00 0.00 C ATOM 449 O ASP A 71 1.291 9.167 -11.015 1.00 0.00 O ATOM 450 CB ASP A 71 -0.441 9.114 -13.252 1.00 0.00 C ATOM 451 CG ASP A 71 -0.448 10.523 -12.656 1.00 0.00 C ATOM 452 OD1 ASP A 71 -0.516 10.632 -11.443 1.00 0.00 O ATOM 453 OD2 ASP A 71 -0.384 11.470 -13.423 1.00 0.00 O ATOM 0 H ASP A 71 -1.488 8.697 -10.312 1.00 0.00 H new ATOM 0 HA ASP A 71 -0.666 7.085 -12.548 1.00 0.00 H new ATOM 0 HB2 ASP A 71 0.471 8.956 -13.827 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -1.277 8.995 -13.941 1.00 0.00 H new ATOM 458 N GLY A 72 1.248 6.972 -10.908 1.00 0.00 N ATOM 459 CA GLY A 72 2.505 6.937 -10.105 1.00 0.00 C ATOM 460 C GLY A 72 2.346 7.799 -8.852 1.00 0.00 C ATOM 461 O GLY A 72 3.218 8.568 -8.500 1.00 0.00 O ATOM 0 H GLY A 72 0.839 6.060 -11.113 1.00 0.00 H new ATOM 0 HA2 GLY A 72 2.739 5.910 -9.823 1.00 0.00 H new ATOM 0 HA3 GLY A 72 3.340 7.301 -10.704 1.00 0.00 H new ATOM 465 N GLN A 73 1.236 7.676 -8.176 1.00 0.00 N ATOM 466 CA GLN A 73 1.013 8.488 -6.943 1.00 0.00 C ATOM 467 C GLN A 73 0.104 7.708 -5.987 1.00 0.00 C ATOM 468 O GLN A 73 -1.092 7.626 -6.186 1.00 0.00 O ATOM 469 CB GLN A 73 0.346 9.815 -7.330 1.00 0.00 C ATOM 470 CG GLN A 73 -0.175 10.533 -6.077 1.00 0.00 C ATOM 471 CD GLN A 73 -0.443 12.005 -6.399 1.00 0.00 C ATOM 472 OE1 GLN A 73 -1.433 12.562 -5.969 1.00 0.00 O ATOM 473 NE2 GLN A 73 0.406 12.662 -7.141 1.00 0.00 N ATOM 0 H GLN A 73 0.472 7.047 -8.424 1.00 0.00 H new ATOM 0 HA GLN A 73 1.964 8.692 -6.451 1.00 0.00 H new ATOM 0 HB2 GLN A 73 1.061 10.451 -7.851 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -0.477 9.629 -8.020 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -1.090 10.055 -5.726 1.00 0.00 H new ATOM 0 HG3 GLN A 73 0.555 10.454 -5.271 1.00 0.00 H new ATOM 0 HE21 GLN A 73 1.237 12.194 -7.502 1.00 0.00 H new ATOM 0 HE22 GLN A 73 0.238 13.644 -7.360 1.00 0.00 H new ATOM 482 N SER A 74 0.659 7.139 -4.949 1.00 0.00 N ATOM 483 CA SER A 74 -0.174 6.369 -3.977 1.00 0.00 C ATOM 484 C SER A 74 -0.581 5.030 -4.597 1.00 0.00 C ATOM 485 O SER A 74 -0.385 4.798 -5.774 1.00 0.00 O ATOM 486 CB SER A 74 -1.430 7.182 -3.629 1.00 0.00 C ATOM 487 OG SER A 74 -2.499 6.791 -4.479 1.00 0.00 O ATOM 0 H SER A 74 1.655 7.174 -4.732 1.00 0.00 H new ATOM 0 HA SER A 74 0.401 6.183 -3.070 1.00 0.00 H new ATOM 0 HB2 SER A 74 -1.703 7.021 -2.586 1.00 0.00 H new ATOM 0 HB3 SER A 74 -1.230 8.247 -3.745 1.00 0.00 H new ATOM 0 HG SER A 74 -2.473 7.321 -5.303 1.00 0.00 H new ATOM 493 N PHE A 75 -1.152 4.145 -3.817 1.00 0.00 N ATOM 494 CA PHE A 75 -1.575 2.820 -4.374 1.00 0.00 C ATOM 495 C PHE A 75 -2.830 2.332 -3.648 1.00 0.00 C ATOM 496 O PHE A 75 -2.842 2.170 -2.444 1.00 0.00 O ATOM 497 CB PHE A 75 -0.452 1.793 -4.202 1.00 0.00 C ATOM 498 CG PHE A 75 0.039 1.792 -2.775 1.00 0.00 C ATOM 499 CD1 PHE A 75 -0.577 0.964 -1.817 1.00 0.00 C ATOM 500 CD2 PHE A 75 1.121 2.611 -2.406 1.00 0.00 C ATOM 501 CE1 PHE A 75 -0.108 0.955 -0.489 1.00 0.00 C ATOM 502 CE2 PHE A 75 1.589 2.605 -1.078 1.00 0.00 C ATOM 503 CZ PHE A 75 0.975 1.776 -0.119 1.00 0.00 C ATOM 0 H PHE A 75 -1.343 4.280 -2.824 1.00 0.00 H new ATOM 0 HA PHE A 75 -1.791 2.937 -5.436 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -0.813 0.800 -4.471 1.00 0.00 H new ATOM 0 HB3 PHE A 75 0.371 2.027 -4.877 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -1.409 0.336 -2.100 1.00 0.00 H new ATOM 0 HD2 PHE A 75 1.593 3.245 -3.142 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -0.579 0.319 0.246 1.00 0.00 H new ATOM 0 HE2 PHE A 75 2.419 3.236 -0.795 1.00 0.00 H new ATOM 0 HZ PHE A 75 1.334 1.770 0.899 1.00 0.00 H new ATOM 513 N VAL A 76 -3.891 2.101 -4.376 1.00 0.00 N ATOM 514 CA VAL A 76 -5.156 1.624 -3.743 1.00 0.00 C ATOM 515 C VAL A 76 -5.178 0.096 -3.730 1.00 0.00 C ATOM 516 O VAL A 76 -4.351 -0.554 -4.336 1.00 0.00 O ATOM 517 CB VAL A 76 -6.353 2.150 -4.542 1.00 0.00 C ATOM 518 CG1 VAL A 76 -6.235 1.704 -6.002 1.00 0.00 C ATOM 519 CG2 VAL A 76 -7.664 1.617 -3.947 1.00 0.00 C ATOM 0 H VAL A 76 -3.936 2.223 -5.388 1.00 0.00 H new ATOM 0 HA VAL A 76 -5.213 1.992 -2.719 1.00 0.00 H new ATOM 0 HB VAL A 76 -6.358 3.239 -4.493 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -7.088 2.080 -6.567 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -5.314 2.099 -6.430 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -6.219 0.615 -6.050 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -8.507 1.998 -4.524 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -7.663 0.528 -3.982 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -7.754 1.946 -2.912 1.00 0.00 H new ATOM 529 N ILE A 77 -6.123 -0.478 -3.039 1.00 0.00 N ATOM 530 CA ILE A 77 -6.221 -1.968 -2.966 1.00 0.00 C ATOM 531 C ILE A 77 -7.706 -2.357 -2.934 1.00 0.00 C ATOM 532 O ILE A 77 -8.263 -2.646 -1.895 1.00 0.00 O ATOM 533 CB ILE A 77 -5.501 -2.458 -1.696 1.00 0.00 C ATOM 534 CG1 ILE A 77 -4.279 -1.562 -1.434 1.00 0.00 C ATOM 535 CG2 ILE A 77 -5.042 -3.909 -1.874 1.00 0.00 C ATOM 536 CD1 ILE A 77 -3.464 -2.111 -0.259 1.00 0.00 C ATOM 0 H ILE A 77 -6.840 0.024 -2.516 1.00 0.00 H new ATOM 0 HA ILE A 77 -5.749 -2.430 -3.833 1.00 0.00 H new ATOM 0 HB ILE A 77 -6.188 -2.407 -0.851 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -3.656 -1.513 -2.327 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -4.604 -0.545 -1.217 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -4.534 -4.244 -0.969 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -5.908 -4.544 -2.060 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -4.357 -3.973 -2.719 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -2.601 -1.468 -0.083 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -4.087 -2.136 0.635 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -3.123 -3.120 -0.492 1.00 0.00 H new ATOM 548 N GLN A 78 -8.341 -2.339 -4.079 1.00 0.00 N ATOM 549 CA GLN A 78 -9.800 -2.670 -4.179 1.00 0.00 C ATOM 550 C GLN A 78 -10.222 -3.720 -3.146 1.00 0.00 C ATOM 551 O GLN A 78 -10.866 -3.409 -2.164 1.00 0.00 O ATOM 552 CB GLN A 78 -10.096 -3.205 -5.583 1.00 0.00 C ATOM 553 CG GLN A 78 -9.385 -2.336 -6.622 1.00 0.00 C ATOM 554 CD GLN A 78 -9.901 -2.685 -8.019 1.00 0.00 C ATOM 555 OE1 GLN A 78 -11.035 -3.095 -8.175 1.00 0.00 O ATOM 556 NE2 GLN A 78 -9.113 -2.539 -9.049 1.00 0.00 N ATOM 0 H GLN A 78 -7.902 -2.104 -4.969 1.00 0.00 H new ATOM 0 HA GLN A 78 -10.365 -1.759 -3.982 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -9.761 -4.239 -5.668 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -11.171 -3.202 -5.765 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -9.561 -1.281 -6.411 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -8.308 -2.496 -6.570 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -8.162 -2.195 -8.919 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -9.449 -2.769 -9.984 1.00 0.00 H new ATOM 565 N ASN A 79 -9.888 -4.961 -3.367 1.00 0.00 N ATOM 566 CA ASN A 79 -10.299 -6.030 -2.404 1.00 0.00 C ATOM 567 C ASN A 79 -9.213 -6.238 -1.346 1.00 0.00 C ATOM 568 O ASN A 79 -8.035 -6.262 -1.642 1.00 0.00 O ATOM 569 CB ASN A 79 -10.525 -7.339 -3.167 1.00 0.00 C ATOM 570 CG ASN A 79 -11.851 -7.266 -3.929 1.00 0.00 C ATOM 571 OD1 ASN A 79 -11.869 -7.280 -5.144 1.00 0.00 O ATOM 572 ND2 ASN A 79 -12.969 -7.189 -3.261 1.00 0.00 N ATOM 0 H ASN A 79 -9.349 -5.284 -4.170 1.00 0.00 H new ATOM 0 HA ASN A 79 -11.221 -5.726 -1.908 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -9.704 -7.513 -3.862 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -10.539 -8.179 -2.473 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -13.858 -7.141 -3.759 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -12.954 -7.177 -2.241 1.00 0.00 H new ATOM 579 N GLN A 80 -9.611 -6.395 -0.109 1.00 0.00 N ATOM 580 CA GLN A 80 -8.622 -6.615 0.989 1.00 0.00 C ATOM 581 C GLN A 80 -8.557 -8.109 1.313 1.00 0.00 C ATOM 582 O GLN A 80 -7.724 -8.554 2.078 1.00 0.00 O ATOM 583 CB GLN A 80 -9.074 -5.850 2.236 1.00 0.00 C ATOM 584 CG GLN A 80 -8.848 -4.352 2.026 1.00 0.00 C ATOM 585 CD GLN A 80 -9.578 -3.569 3.119 1.00 0.00 C ATOM 586 OE1 GLN A 80 -10.496 -2.823 2.838 1.00 0.00 O ATOM 587 NE2 GLN A 80 -9.206 -3.706 4.362 1.00 0.00 N ATOM 0 H GLN A 80 -10.586 -6.380 0.189 1.00 0.00 H new ATOM 0 HA GLN A 80 -7.640 -6.261 0.676 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -10.128 -6.045 2.433 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -8.518 -6.194 3.108 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -7.782 -4.127 2.053 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -9.213 -4.052 1.044 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -8.436 -4.332 4.598 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -9.685 -3.187 5.098 1.00 0.00 H new ATOM 596 N ALA A 81 -9.439 -8.885 0.742 1.00 0.00 N ATOM 597 CA ALA A 81 -9.444 -10.347 1.020 1.00 0.00 C ATOM 598 C ALA A 81 -8.334 -11.038 0.226 1.00 0.00 C ATOM 599 O ALA A 81 -7.224 -11.190 0.695 1.00 0.00 O ATOM 600 CB ALA A 81 -10.797 -10.936 0.617 1.00 0.00 C ATOM 0 H ALA A 81 -10.158 -8.566 0.093 1.00 0.00 H new ATOM 0 HA ALA A 81 -9.273 -10.507 2.085 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -10.803 -12.007 0.820 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -11.589 -10.454 1.190 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -10.965 -10.767 -0.447 1.00 0.00 H new ATOM 606 N GLN A 82 -8.628 -11.468 -0.971 1.00 0.00 N ATOM 607 CA GLN A 82 -7.593 -12.162 -1.790 1.00 0.00 C ATOM 608 C GLN A 82 -6.327 -11.321 -1.857 1.00 0.00 C ATOM 609 O GLN A 82 -5.317 -11.750 -2.370 1.00 0.00 O ATOM 610 CB GLN A 82 -8.118 -12.389 -3.210 1.00 0.00 C ATOM 611 CG GLN A 82 -9.570 -12.862 -3.149 1.00 0.00 C ATOM 612 CD GLN A 82 -9.955 -13.516 -4.480 1.00 0.00 C ATOM 613 OE1 GLN A 82 -11.041 -13.305 -4.982 1.00 0.00 O ATOM 614 NE2 GLN A 82 -9.104 -14.309 -5.073 1.00 0.00 N ATOM 0 H GLN A 82 -9.540 -11.369 -1.417 1.00 0.00 H new ATOM 0 HA GLN A 82 -7.367 -13.121 -1.324 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -8.049 -11.466 -3.786 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -7.504 -13.131 -3.721 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -9.697 -13.573 -2.333 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -10.229 -12.019 -2.943 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -8.192 -14.486 -4.651 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -9.351 -14.752 -5.958 1.00 0.00 H new ATOM 623 N PHE A 83 -6.367 -10.120 -1.365 1.00 0.00 N ATOM 624 CA PHE A 83 -5.157 -9.263 -1.435 1.00 0.00 C ATOM 625 C PHE A 83 -4.233 -9.610 -0.260 1.00 0.00 C ATOM 626 O PHE A 83 -3.194 -9.005 -0.075 1.00 0.00 O ATOM 627 CB PHE A 83 -5.585 -7.784 -1.388 1.00 0.00 C ATOM 628 CG PHE A 83 -4.416 -6.914 -0.985 1.00 0.00 C ATOM 629 CD1 PHE A 83 -3.474 -6.480 -1.940 1.00 0.00 C ATOM 630 CD2 PHE A 83 -4.263 -6.565 0.363 1.00 0.00 C ATOM 631 CE1 PHE A 83 -2.379 -5.693 -1.534 1.00 0.00 C ATOM 632 CE2 PHE A 83 -3.171 -5.775 0.769 1.00 0.00 C ATOM 633 CZ PHE A 83 -2.228 -5.343 -0.177 1.00 0.00 C ATOM 0 H PHE A 83 -7.180 -9.695 -0.919 1.00 0.00 H new ATOM 0 HA PHE A 83 -4.616 -9.436 -2.365 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -5.958 -7.475 -2.364 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -6.403 -7.657 -0.679 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -3.592 -6.750 -2.979 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -4.984 -6.903 1.092 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -1.655 -5.358 -2.262 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -3.059 -5.501 1.808 1.00 0.00 H new ATOM 0 HZ PHE A 83 -1.387 -4.742 0.135 1.00 0.00 H new ATOM 643 N ALA A 84 -4.607 -10.583 0.534 1.00 0.00 N ATOM 644 CA ALA A 84 -3.764 -10.981 1.706 1.00 0.00 C ATOM 645 C ALA A 84 -3.317 -12.437 1.563 1.00 0.00 C ATOM 646 O ALA A 84 -2.152 -12.747 1.692 1.00 0.00 O ATOM 647 CB ALA A 84 -4.586 -10.833 2.988 1.00 0.00 C ATOM 0 H ALA A 84 -5.465 -11.122 0.420 1.00 0.00 H new ATOM 0 HA ALA A 84 -2.884 -10.339 1.748 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -3.978 -11.121 3.845 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -4.902 -9.796 3.100 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -5.464 -11.476 2.933 1.00 0.00 H new ATOM 653 N LYS A 85 -4.233 -13.335 1.322 1.00 0.00 N ATOM 654 CA LYS A 85 -3.857 -14.776 1.201 1.00 0.00 C ATOM 655 C LYS A 85 -3.354 -15.102 -0.213 1.00 0.00 C ATOM 656 O LYS A 85 -3.466 -16.224 -0.667 1.00 0.00 O ATOM 657 CB LYS A 85 -5.075 -15.649 1.529 1.00 0.00 C ATOM 658 CG LYS A 85 -6.259 -15.290 0.609 1.00 0.00 C ATOM 659 CD LYS A 85 -7.593 -15.613 1.308 1.00 0.00 C ATOM 660 CE LYS A 85 -7.813 -14.684 2.520 1.00 0.00 C ATOM 661 NZ LYS A 85 -9.264 -14.366 2.637 1.00 0.00 N ATOM 0 H LYS A 85 -5.226 -13.135 1.203 1.00 0.00 H new ATOM 0 HA LYS A 85 -3.050 -14.982 1.904 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -4.819 -16.702 1.408 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -5.361 -15.508 2.571 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -6.222 -14.231 0.352 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -6.185 -15.847 -0.325 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -8.416 -15.499 0.602 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -7.595 -16.653 1.635 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -7.460 -15.166 3.432 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -7.236 -13.767 2.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -9.417 -13.740 3.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -9.586 -13.890 1.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -9.803 -15.246 2.770 1.00 0.00 H new ATOM 675 N GLU A 86 -2.789 -14.149 -0.911 1.00 0.00 N ATOM 676 CA GLU A 86 -2.275 -14.444 -2.288 1.00 0.00 C ATOM 677 C GLU A 86 -1.185 -13.438 -2.678 1.00 0.00 C ATOM 678 O GLU A 86 -0.760 -13.389 -3.815 1.00 0.00 O ATOM 679 CB GLU A 86 -3.419 -14.361 -3.308 1.00 0.00 C ATOM 680 CG GLU A 86 -4.396 -15.521 -3.103 1.00 0.00 C ATOM 681 CD GLU A 86 -5.315 -15.636 -4.321 1.00 0.00 C ATOM 682 OE1 GLU A 86 -4.825 -15.463 -5.426 1.00 0.00 O ATOM 683 OE2 GLU A 86 -6.491 -15.894 -4.129 1.00 0.00 O ATOM 0 H GLU A 86 -2.661 -13.188 -0.593 1.00 0.00 H new ATOM 0 HA GLU A 86 -1.856 -15.450 -2.288 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -3.943 -13.411 -3.201 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -3.016 -14.390 -4.320 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -3.847 -16.452 -2.959 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -4.987 -15.357 -2.202 1.00 0.00 H new ATOM 690 N LEU A 87 -0.725 -12.632 -1.751 1.00 0.00 N ATOM 691 CA LEU A 87 0.340 -11.629 -2.083 1.00 0.00 C ATOM 692 C LEU A 87 1.340 -11.525 -0.928 1.00 0.00 C ATOM 693 O LEU A 87 2.502 -11.233 -1.133 1.00 0.00 O ATOM 694 CB LEU A 87 -0.299 -10.256 -2.314 1.00 0.00 C ATOM 695 CG LEU A 87 -1.125 -10.266 -3.610 1.00 0.00 C ATOM 696 CD1 LEU A 87 -1.879 -8.939 -3.724 1.00 0.00 C ATOM 697 CD2 LEU A 87 -0.206 -10.445 -4.838 1.00 0.00 C ATOM 0 H LEU A 87 -1.039 -12.624 -0.781 1.00 0.00 H new ATOM 0 HA LEU A 87 0.859 -11.952 -2.985 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -0.937 -9.997 -1.469 1.00 0.00 H new ATOM 0 HB3 LEU A 87 0.476 -9.492 -2.374 1.00 0.00 H new ATOM 0 HG LEU A 87 -1.828 -11.098 -3.581 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.469 -8.934 -4.640 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.540 -8.821 -2.866 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -1.165 -8.116 -3.748 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -0.809 -10.450 -5.746 1.00 0.00 H new ATOM 0 HD22 LEU A 87 0.508 -9.623 -4.881 1.00 0.00 H new ATOM 0 HD23 LEU A 87 0.332 -11.389 -4.755 1.00 0.00 H new ATOM 709 N LEU A 88 0.909 -11.749 0.286 1.00 0.00 N ATOM 710 CA LEU A 88 1.853 -11.645 1.440 1.00 0.00 C ATOM 711 C LEU A 88 2.637 -12.959 1.667 1.00 0.00 C ATOM 712 O LEU A 88 3.778 -12.899 2.078 1.00 0.00 O ATOM 713 CB LEU A 88 1.084 -11.279 2.720 1.00 0.00 C ATOM 714 CG LEU A 88 0.070 -10.168 2.423 1.00 0.00 C ATOM 715 CD1 LEU A 88 -0.759 -9.887 3.678 1.00 0.00 C ATOM 716 CD2 LEU A 88 0.808 -8.892 2.006 1.00 0.00 C ATOM 0 H LEU A 88 -0.050 -11.998 0.528 1.00 0.00 H new ATOM 0 HA LEU A 88 2.572 -10.861 1.202 1.00 0.00 H new ATOM 0 HB2 LEU A 88 0.570 -12.158 3.109 1.00 0.00 H new ATOM 0 HB3 LEU A 88 1.781 -10.950 3.491 1.00 0.00 H new ATOM 0 HG LEU A 88 -0.586 -10.487 1.613 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -1.480 -9.097 3.468 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -1.288 -10.792 3.975 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -0.100 -9.571 4.486 1.00 0.00 H new ATOM 0 HD21 LEU A 88 0.084 -8.105 1.796 1.00 0.00 H new ATOM 0 HD22 LEU A 88 1.467 -8.573 2.813 1.00 0.00 H new ATOM 0 HD23 LEU A 88 1.399 -9.089 1.112 1.00 0.00 H new ATOM 728 N PRO A 89 2.033 -14.114 1.426 1.00 0.00 N ATOM 729 CA PRO A 89 2.730 -15.397 1.650 1.00 0.00 C ATOM 730 C PRO A 89 3.764 -15.635 0.539 1.00 0.00 C ATOM 731 O PRO A 89 4.072 -16.762 0.205 1.00 0.00 O ATOM 732 CB PRO A 89 1.609 -16.464 1.607 1.00 0.00 C ATOM 733 CG PRO A 89 0.304 -15.745 1.153 1.00 0.00 C ATOM 734 CD PRO A 89 0.649 -14.256 0.930 1.00 0.00 C ATOM 0 HA PRO A 89 3.276 -15.423 2.593 1.00 0.00 H new ATOM 0 HB2 PRO A 89 1.867 -17.265 0.915 1.00 0.00 H new ATOM 0 HB3 PRO A 89 1.475 -16.921 2.588 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -0.081 -16.191 0.236 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -0.474 -15.849 1.909 1.00 0.00 H new ATOM 0 HD2 PRO A 89 0.576 -13.986 -0.124 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -0.035 -13.605 1.474 1.00 0.00 H new ATOM 742 N LEU A 90 4.295 -14.583 -0.039 1.00 0.00 N ATOM 743 CA LEU A 90 5.304 -14.744 -1.136 1.00 0.00 C ATOM 744 C LEU A 90 6.497 -13.821 -0.879 1.00 0.00 C ATOM 745 O LEU A 90 7.424 -13.766 -1.662 1.00 0.00 O ATOM 746 CB LEU A 90 4.665 -14.367 -2.478 1.00 0.00 C ATOM 747 CG LEU A 90 3.384 -15.181 -2.704 1.00 0.00 C ATOM 748 CD1 LEU A 90 2.607 -14.583 -3.880 1.00 0.00 C ATOM 749 CD2 LEU A 90 3.734 -16.642 -3.021 1.00 0.00 C ATOM 0 H LEU A 90 4.073 -13.617 0.202 1.00 0.00 H new ATOM 0 HA LEU A 90 5.640 -15.781 -1.163 1.00 0.00 H new ATOM 0 HB2 LEU A 90 4.435 -13.302 -2.493 1.00 0.00 H new ATOM 0 HB3 LEU A 90 5.370 -14.552 -3.289 1.00 0.00 H new ATOM 0 HG LEU A 90 2.777 -15.148 -1.799 1.00 0.00 H new ATOM 0 HD11 LEU A 90 1.696 -15.158 -4.044 1.00 0.00 H new ATOM 0 HD12 LEU A 90 2.347 -13.548 -3.656 1.00 0.00 H new ATOM 0 HD13 LEU A 90 3.224 -14.616 -4.778 1.00 0.00 H new ATOM 0 HD21 LEU A 90 2.817 -17.210 -3.179 1.00 0.00 H new ATOM 0 HD22 LEU A 90 4.346 -16.682 -3.922 1.00 0.00 H new ATOM 0 HD23 LEU A 90 4.288 -17.073 -2.187 1.00 0.00 H new ATOM 761 N ASN A 91 6.489 -13.089 0.206 1.00 0.00 N ATOM 762 CA ASN A 91 7.634 -12.171 0.491 1.00 0.00 C ATOM 763 C ASN A 91 7.809 -11.998 2.003 1.00 0.00 C ATOM 764 O ASN A 91 8.909 -12.052 2.515 1.00 0.00 O ATOM 765 CB ASN A 91 7.363 -10.809 -0.148 1.00 0.00 C ATOM 766 CG ASN A 91 7.471 -10.928 -1.670 1.00 0.00 C ATOM 767 OD1 ASN A 91 8.409 -10.434 -2.264 1.00 0.00 O ATOM 768 ND2 ASN A 91 6.545 -11.569 -2.329 1.00 0.00 N ATOM 0 H ASN A 91 5.744 -13.087 0.903 1.00 0.00 H new ATOM 0 HA ASN A 91 8.546 -12.600 0.075 1.00 0.00 H new ATOM 0 HB2 ASN A 91 6.370 -10.456 0.130 1.00 0.00 H new ATOM 0 HB3 ASN A 91 8.078 -10.074 0.221 1.00 0.00 H new ATOM 0 HD21 ASN A 91 6.608 -11.656 -3.343 1.00 0.00 H new ATOM 0 HD22 ASN A 91 5.758 -11.983 -1.830 1.00 0.00 H new ATOM 775 N TYR A 92 6.741 -11.781 2.724 1.00 0.00 N ATOM 776 CA TYR A 92 6.863 -11.595 4.202 1.00 0.00 C ATOM 777 C TYR A 92 6.760 -12.952 4.904 1.00 0.00 C ATOM 778 O TYR A 92 7.217 -13.119 6.017 1.00 0.00 O ATOM 779 CB TYR A 92 5.739 -10.683 4.698 1.00 0.00 C ATOM 780 CG TYR A 92 5.713 -9.416 3.877 1.00 0.00 C ATOM 781 CD1 TYR A 92 5.076 -9.403 2.621 1.00 0.00 C ATOM 782 CD2 TYR A 92 6.325 -8.246 4.368 1.00 0.00 C ATOM 783 CE1 TYR A 92 5.049 -8.220 1.858 1.00 0.00 C ATOM 784 CE2 TYR A 92 6.299 -7.064 3.604 1.00 0.00 C ATOM 785 CZ TYR A 92 5.661 -7.051 2.349 1.00 0.00 C ATOM 786 OH TYR A 92 5.634 -5.891 1.600 1.00 0.00 O ATOM 0 H TYR A 92 5.791 -11.724 2.356 1.00 0.00 H new ATOM 0 HA TYR A 92 7.828 -11.142 4.427 1.00 0.00 H new ATOM 0 HB2 TYR A 92 4.781 -11.197 4.622 1.00 0.00 H new ATOM 0 HB3 TYR A 92 5.890 -10.443 5.750 1.00 0.00 H new ATOM 0 HD1 TYR A 92 4.608 -10.300 2.243 1.00 0.00 H new ATOM 0 HD2 TYR A 92 6.814 -8.256 5.331 1.00 0.00 H new ATOM 0 HE1 TYR A 92 4.559 -8.209 0.896 1.00 0.00 H new ATOM 0 HE2 TYR A 92 6.768 -6.167 3.981 1.00 0.00 H new ATOM 0 HH TYR A 92 6.101 -5.178 2.084 1.00 0.00 H new ATOM 796 N LYS A 93 6.172 -13.923 4.257 1.00 0.00 N ATOM 797 CA LYS A 93 6.045 -15.279 4.875 1.00 0.00 C ATOM 798 C LYS A 93 4.937 -15.266 5.939 1.00 0.00 C ATOM 799 O LYS A 93 5.132 -15.704 7.055 1.00 0.00 O ATOM 800 CB LYS A 93 7.396 -15.684 5.511 1.00 0.00 C ATOM 801 CG LYS A 93 7.608 -17.202 5.412 1.00 0.00 C ATOM 802 CD LYS A 93 6.570 -17.929 6.270 1.00 0.00 C ATOM 803 CE LYS A 93 6.894 -19.424 6.308 1.00 0.00 C ATOM 804 NZ LYS A 93 6.614 -20.027 4.975 1.00 0.00 N ATOM 0 H LYS A 93 5.772 -13.837 3.323 1.00 0.00 H new ATOM 0 HA LYS A 93 5.781 -16.006 4.107 1.00 0.00 H new ATOM 0 HB2 LYS A 93 8.211 -15.164 5.008 1.00 0.00 H new ATOM 0 HB3 LYS A 93 7.419 -15.376 6.556 1.00 0.00 H new ATOM 0 HG2 LYS A 93 7.524 -17.523 4.374 1.00 0.00 H new ATOM 0 HG3 LYS A 93 8.613 -17.460 5.745 1.00 0.00 H new ATOM 0 HD2 LYS A 93 6.568 -17.521 7.281 1.00 0.00 H new ATOM 0 HD3 LYS A 93 5.572 -17.773 5.861 1.00 0.00 H new ATOM 0 HE2 LYS A 93 7.940 -19.574 6.574 1.00 0.00 H new ATOM 0 HE3 LYS A 93 6.297 -19.917 7.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 6.670 -21.063 5.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 5.661 -19.752 4.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 7.315 -19.688 4.286 1.00 0.00 H new ATOM 818 N HIS A 94 3.773 -14.784 5.597 1.00 0.00 N ATOM 819 CA HIS A 94 2.654 -14.763 6.583 1.00 0.00 C ATOM 820 C HIS A 94 1.359 -14.362 5.873 1.00 0.00 C ATOM 821 O HIS A 94 1.364 -13.580 4.943 1.00 0.00 O ATOM 822 CB HIS A 94 2.960 -13.774 7.711 1.00 0.00 C ATOM 823 CG HIS A 94 3.053 -12.377 7.163 1.00 0.00 C ATOM 824 ND1 HIS A 94 2.026 -11.795 6.438 1.00 0.00 N ATOM 825 CD2 HIS A 94 4.043 -11.431 7.239 1.00 0.00 C ATOM 826 CE1 HIS A 94 2.419 -10.550 6.110 1.00 0.00 C ATOM 827 NE2 HIS A 94 3.641 -10.277 6.573 1.00 0.00 N ATOM 0 H HIS A 94 3.548 -14.404 4.678 1.00 0.00 H new ATOM 0 HA HIS A 94 2.538 -15.757 7.015 1.00 0.00 H new ATOM 0 HB2 HIS A 94 2.180 -13.824 8.470 1.00 0.00 H new ATOM 0 HB3 HIS A 94 3.897 -14.045 8.198 1.00 0.00 H new ATOM 0 HD1 HIS A 94 1.135 -12.230 6.197 1.00 0.00 H new ATOM 0 HD2 HIS A 94 4.991 -11.562 7.740 1.00 0.00 H new ATOM 0 HE1 HIS A 94 1.818 -9.856 5.541 1.00 0.00 H new ATOM 835 N ASN A 95 0.247 -14.906 6.297 1.00 0.00 N ATOM 836 CA ASN A 95 -1.058 -14.577 5.644 1.00 0.00 C ATOM 837 C ASN A 95 -1.775 -13.478 6.434 1.00 0.00 C ATOM 838 O ASN A 95 -2.801 -12.976 6.022 1.00 0.00 O ATOM 839 CB ASN A 95 -1.930 -15.839 5.615 1.00 0.00 C ATOM 840 CG ASN A 95 -3.047 -15.675 4.584 1.00 0.00 C ATOM 841 OD1 ASN A 95 -3.739 -14.677 4.571 1.00 0.00 O ATOM 842 ND2 ASN A 95 -3.253 -16.624 3.711 1.00 0.00 N ATOM 0 H ASN A 95 0.186 -15.567 7.071 1.00 0.00 H new ATOM 0 HA ASN A 95 -0.879 -14.223 4.629 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -1.320 -16.708 5.368 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -2.357 -16.019 6.601 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -3.995 -16.527 3.018 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -2.672 -17.462 3.722 1.00 0.00 H new ATOM 849 N ASN A 96 -1.245 -13.098 7.565 1.00 0.00 N ATOM 850 CA ASN A 96 -1.904 -12.032 8.374 1.00 0.00 C ATOM 851 C ASN A 96 -2.255 -10.845 7.472 1.00 0.00 C ATOM 852 O ASN A 96 -1.783 -10.741 6.358 1.00 0.00 O ATOM 853 CB ASN A 96 -0.951 -11.567 9.477 1.00 0.00 C ATOM 854 CG ASN A 96 0.356 -11.075 8.851 1.00 0.00 C ATOM 855 OD1 ASN A 96 1.403 -11.649 9.073 1.00 0.00 O ATOM 856 ND2 ASN A 96 0.337 -10.027 8.073 1.00 0.00 N ATOM 0 H ASN A 96 -0.386 -13.478 7.963 1.00 0.00 H new ATOM 0 HA ASN A 96 -2.815 -12.429 8.822 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -1.412 -10.767 10.057 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -0.750 -12.386 10.167 1.00 0.00 H new ATOM 0 HD21 ASN A 96 1.202 -9.689 7.651 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -0.543 -9.546 7.887 1.00 0.00 H new ATOM 863 N MET A 97 -3.080 -9.947 7.947 1.00 0.00 N ATOM 864 CA MET A 97 -3.466 -8.759 7.122 1.00 0.00 C ATOM 865 C MET A 97 -3.555 -7.528 8.029 1.00 0.00 C ATOM 866 O MET A 97 -2.758 -6.617 7.932 1.00 0.00 O ATOM 867 CB MET A 97 -4.829 -9.018 6.457 1.00 0.00 C ATOM 868 CG MET A 97 -4.980 -8.135 5.212 1.00 0.00 C ATOM 869 SD MET A 97 -4.954 -6.388 5.698 1.00 0.00 S ATOM 870 CE MET A 97 -4.918 -5.666 4.036 1.00 0.00 C ATOM 0 H MET A 97 -3.505 -9.984 8.873 1.00 0.00 H new ATOM 0 HA MET A 97 -2.719 -8.587 6.348 1.00 0.00 H new ATOM 0 HB2 MET A 97 -4.914 -10.069 6.180 1.00 0.00 H new ATOM 0 HB3 MET A 97 -5.633 -8.808 7.162 1.00 0.00 H new ATOM 0 HG2 MET A 97 -4.173 -8.339 4.509 1.00 0.00 H new ATOM 0 HG3 MET A 97 -5.914 -8.367 4.701 1.00 0.00 H new ATOM 0 HE1 MET A 97 -4.297 -4.770 4.042 1.00 0.00 H new ATOM 0 HE2 MET A 97 -4.504 -6.390 3.334 1.00 0.00 H new ATOM 0 HE3 MET A 97 -5.931 -5.403 3.731 1.00 0.00 H new ATOM 880 N ALA A 98 -4.514 -7.494 8.915 1.00 0.00 N ATOM 881 CA ALA A 98 -4.640 -6.323 9.829 1.00 0.00 C ATOM 882 C ALA A 98 -3.277 -6.030 10.455 1.00 0.00 C ATOM 883 O ALA A 98 -3.012 -4.934 10.908 1.00 0.00 O ATOM 884 CB ALA A 98 -5.654 -6.640 10.930 1.00 0.00 C ATOM 0 H ALA A 98 -5.214 -8.225 9.045 1.00 0.00 H new ATOM 0 HA ALA A 98 -4.981 -5.453 9.268 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -5.746 -5.783 11.598 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -6.624 -6.855 10.481 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -5.316 -7.508 11.497 1.00 0.00 H new ATOM 890 N SER A 99 -2.403 -7.001 10.471 1.00 0.00 N ATOM 891 CA SER A 99 -1.052 -6.774 11.052 1.00 0.00 C ATOM 892 C SER A 99 -0.258 -5.896 10.089 1.00 0.00 C ATOM 893 O SER A 99 0.489 -5.027 10.491 1.00 0.00 O ATOM 894 CB SER A 99 -0.341 -8.114 11.235 1.00 0.00 C ATOM 895 OG SER A 99 0.210 -8.528 9.990 1.00 0.00 O ATOM 0 H SER A 99 -2.568 -7.939 10.107 1.00 0.00 H new ATOM 0 HA SER A 99 -1.136 -6.285 12.023 1.00 0.00 H new ATOM 0 HB2 SER A 99 0.447 -8.021 11.982 1.00 0.00 H new ATOM 0 HB3 SER A 99 -1.042 -8.863 11.603 1.00 0.00 H new ATOM 0 HG SER A 99 1.151 -8.774 10.114 1.00 0.00 H new ATOM 901 N PHE A 100 -0.430 -6.111 8.813 1.00 0.00 N ATOM 902 CA PHE A 100 0.296 -5.284 7.814 1.00 0.00 C ATOM 903 C PHE A 100 -0.255 -3.858 7.871 1.00 0.00 C ATOM 904 O PHE A 100 0.477 -2.905 8.043 1.00 0.00 O ATOM 905 CB PHE A 100 0.078 -5.870 6.414 1.00 0.00 C ATOM 906 CG PHE A 100 0.613 -4.907 5.375 1.00 0.00 C ATOM 907 CD1 PHE A 100 1.977 -4.558 5.379 1.00 0.00 C ATOM 908 CD2 PHE A 100 -0.253 -4.350 4.412 1.00 0.00 C ATOM 909 CE1 PHE A 100 2.475 -3.653 4.423 1.00 0.00 C ATOM 910 CE2 PHE A 100 0.247 -3.446 3.454 1.00 0.00 C ATOM 911 CZ PHE A 100 1.612 -3.097 3.463 1.00 0.00 C ATOM 0 H PHE A 100 -1.043 -6.825 8.421 1.00 0.00 H new ATOM 0 HA PHE A 100 1.364 -5.277 8.033 1.00 0.00 H new ATOM 0 HB2 PHE A 100 0.583 -6.832 6.328 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -0.983 -6.051 6.245 1.00 0.00 H new ATOM 0 HD1 PHE A 100 2.641 -4.985 6.116 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -1.300 -4.616 4.409 1.00 0.00 H new ATOM 0 HE1 PHE A 100 3.521 -3.386 4.427 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -0.415 -3.021 2.714 1.00 0.00 H new ATOM 0 HZ PHE A 100 1.996 -2.401 2.731 1.00 0.00 H new ATOM 921 N ILE A 101 -1.542 -3.707 7.733 1.00 0.00 N ATOM 922 CA ILE A 101 -2.134 -2.343 7.788 1.00 0.00 C ATOM 923 C ILE A 101 -1.695 -1.673 9.092 1.00 0.00 C ATOM 924 O ILE A 101 -1.528 -0.472 9.155 1.00 0.00 O ATOM 925 CB ILE A 101 -3.667 -2.456 7.706 1.00 0.00 C ATOM 926 CG1 ILE A 101 -4.033 -3.026 6.326 1.00 0.00 C ATOM 927 CG2 ILE A 101 -4.332 -1.080 7.884 1.00 0.00 C ATOM 928 CD1 ILE A 101 -5.543 -2.935 6.092 1.00 0.00 C ATOM 0 H ILE A 101 -2.207 -4.466 7.585 1.00 0.00 H new ATOM 0 HA ILE A 101 -1.792 -1.736 6.950 1.00 0.00 H new ATOM 0 HB ILE A 101 -4.023 -3.109 8.503 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -3.505 -2.476 5.547 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -3.710 -4.065 6.258 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -5.415 -1.188 7.822 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -4.064 -0.669 8.857 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -3.989 -0.406 7.099 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -5.784 -3.343 5.110 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -6.065 -3.505 6.860 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -5.856 -1.892 6.138 1.00 0.00 H new ATOM 940 N ARG A 102 -1.496 -2.437 10.129 1.00 0.00 N ATOM 941 CA ARG A 102 -1.057 -1.834 11.415 1.00 0.00 C ATOM 942 C ARG A 102 0.367 -1.303 11.246 1.00 0.00 C ATOM 943 O ARG A 102 0.775 -0.370 11.908 1.00 0.00 O ATOM 944 CB ARG A 102 -1.100 -2.899 12.522 1.00 0.00 C ATOM 945 CG ARG A 102 -0.383 -2.391 13.803 1.00 0.00 C ATOM 946 CD ARG A 102 1.032 -2.982 13.905 1.00 0.00 C ATOM 947 NE ARG A 102 1.628 -2.615 15.221 1.00 0.00 N ATOM 948 CZ ARG A 102 2.684 -3.245 15.658 1.00 0.00 C ATOM 949 NH1 ARG A 102 3.223 -4.191 14.939 1.00 0.00 N ATOM 950 NH2 ARG A 102 3.202 -2.928 16.814 1.00 0.00 N ATOM 0 H ARG A 102 -1.618 -3.450 10.141 1.00 0.00 H new ATOM 0 HA ARG A 102 -1.720 -1.015 11.693 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -2.136 -3.148 12.754 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -0.623 -3.814 12.171 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -0.327 -1.303 13.787 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -0.962 -2.668 14.684 1.00 0.00 H new ATOM 0 HD2 ARG A 102 0.994 -4.066 13.800 1.00 0.00 H new ATOM 0 HD3 ARG A 102 1.655 -2.605 13.094 1.00 0.00 H new ATOM 0 HE ARG A 102 1.210 -1.871 15.780 1.00 0.00 H new ATOM 0 HH11 ARG A 102 2.819 -4.438 14.036 1.00 0.00 H new ATOM 0 HH12 ARG A 102 4.048 -4.684 15.280 1.00 0.00 H new ATOM 0 HH21 ARG A 102 2.781 -2.188 17.376 1.00 0.00 H new ATOM 0 HH22 ARG A 102 4.027 -3.421 17.155 1.00 0.00 H new ATOM 964 N GLN A 103 1.122 -1.881 10.351 1.00 0.00 N ATOM 965 CA GLN A 103 2.510 -1.399 10.126 1.00 0.00 C ATOM 966 C GLN A 103 2.459 -0.153 9.241 1.00 0.00 C ATOM 967 O GLN A 103 3.339 0.683 9.277 1.00 0.00 O ATOM 968 CB GLN A 103 3.326 -2.492 9.432 1.00 0.00 C ATOM 969 CG GLN A 103 3.697 -3.576 10.447 1.00 0.00 C ATOM 970 CD GLN A 103 4.776 -3.044 11.391 1.00 0.00 C ATOM 971 OE1 GLN A 103 5.283 -1.955 11.202 1.00 0.00 O ATOM 972 NE2 GLN A 103 5.154 -3.770 12.407 1.00 0.00 N ATOM 0 H GLN A 103 0.835 -2.666 9.767 1.00 0.00 H new ATOM 0 HA GLN A 103 2.980 -1.157 11.079 1.00 0.00 H new ATOM 0 HB2 GLN A 103 2.750 -2.926 8.615 1.00 0.00 H new ATOM 0 HB3 GLN A 103 4.228 -2.064 8.995 1.00 0.00 H new ATOM 0 HG2 GLN A 103 2.816 -3.873 11.016 1.00 0.00 H new ATOM 0 HG3 GLN A 103 4.058 -4.465 9.930 1.00 0.00 H new ATOM 0 HE21 GLN A 103 4.730 -4.684 12.567 1.00 0.00 H new ATOM 0 HE22 GLN A 103 5.874 -3.424 13.041 1.00 0.00 H new ATOM 981 N LEU A 104 1.425 -0.010 8.454 1.00 0.00 N ATOM 982 CA LEU A 104 1.322 1.197 7.589 1.00 0.00 C ATOM 983 C LEU A 104 1.116 2.416 8.486 1.00 0.00 C ATOM 984 O LEU A 104 1.624 3.487 8.224 1.00 0.00 O ATOM 985 CB LEU A 104 0.140 1.061 6.622 1.00 0.00 C ATOM 986 CG LEU A 104 0.377 -0.102 5.641 1.00 0.00 C ATOM 987 CD1 LEU A 104 -0.838 -0.232 4.717 1.00 0.00 C ATOM 988 CD2 LEU A 104 1.642 0.159 4.794 1.00 0.00 C ATOM 0 H LEU A 104 0.654 -0.673 8.374 1.00 0.00 H new ATOM 0 HA LEU A 104 2.234 1.308 7.003 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -0.779 0.890 7.183 1.00 0.00 H new ATOM 0 HB3 LEU A 104 0.007 1.990 6.068 1.00 0.00 H new ATOM 0 HG LEU A 104 0.518 -1.024 6.206 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -0.678 -1.054 4.019 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -1.729 -0.430 5.313 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -0.973 0.696 4.161 1.00 0.00 H new ATOM 0 HD21 LEU A 104 1.797 -0.672 4.105 1.00 0.00 H new ATOM 0 HD22 LEU A 104 1.516 1.082 4.227 1.00 0.00 H new ATOM 0 HD23 LEU A 104 2.507 0.251 5.451 1.00 0.00 H new ATOM 1000 N ASN A 105 0.388 2.258 9.559 1.00 0.00 N ATOM 1001 CA ASN A 105 0.174 3.404 10.481 1.00 0.00 C ATOM 1002 C ASN A 105 1.440 3.592 11.317 1.00 0.00 C ATOM 1003 O ASN A 105 1.537 4.482 12.139 1.00 0.00 O ATOM 1004 CB ASN A 105 -1.029 3.118 11.395 1.00 0.00 C ATOM 1005 CG ASN A 105 -0.725 1.955 12.349 1.00 0.00 C ATOM 1006 OD1 ASN A 105 0.391 1.784 12.797 1.00 0.00 O ATOM 1007 ND2 ASN A 105 -1.689 1.148 12.690 1.00 0.00 N ATOM 0 H ASN A 105 -0.065 1.387 9.834 1.00 0.00 H new ATOM 0 HA ASN A 105 -0.033 4.312 9.914 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -1.275 4.011 11.970 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -1.903 2.878 10.789 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -1.505 0.376 13.331 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -2.628 1.288 12.316 1.00 0.00 H new ATOM 1014 N MET A 106 2.410 2.742 11.108 1.00 0.00 N ATOM 1015 CA MET A 106 3.685 2.829 11.875 1.00 0.00 C ATOM 1016 C MET A 106 4.706 3.659 11.091 1.00 0.00 C ATOM 1017 O MET A 106 5.466 4.419 11.656 1.00 0.00 O ATOM 1018 CB MET A 106 4.237 1.412 12.080 1.00 0.00 C ATOM 1019 CG MET A 106 5.303 1.407 13.182 1.00 0.00 C ATOM 1020 SD MET A 106 4.503 1.205 14.791 1.00 0.00 S ATOM 1021 CE MET A 106 4.428 -0.603 14.772 1.00 0.00 C ATOM 0 H MET A 106 2.371 1.982 10.429 1.00 0.00 H new ATOM 0 HA MET A 106 3.501 3.304 12.839 1.00 0.00 H new ATOM 0 HB2 MET A 106 3.426 0.734 12.347 1.00 0.00 H new ATOM 0 HB3 MET A 106 4.667 1.044 11.148 1.00 0.00 H new ATOM 0 HG2 MET A 106 6.013 0.598 13.013 1.00 0.00 H new ATOM 0 HG3 MET A 106 5.869 2.338 13.160 1.00 0.00 H new ATOM 0 HE1 MET A 106 4.517 -0.982 15.790 1.00 0.00 H new ATOM 0 HE2 MET A 106 3.476 -0.923 14.348 1.00 0.00 H new ATOM 0 HE3 MET A 106 5.245 -0.995 14.166 1.00 0.00 H new ATOM 1031 N TYR A 107 4.736 3.511 9.793 1.00 0.00 N ATOM 1032 CA TYR A 107 5.716 4.282 8.980 1.00 0.00 C ATOM 1033 C TYR A 107 5.204 5.709 8.766 1.00 0.00 C ATOM 1034 O TYR A 107 5.969 6.608 8.473 1.00 0.00 O ATOM 1035 CB TYR A 107 5.906 3.587 7.629 1.00 0.00 C ATOM 1036 CG TYR A 107 6.068 2.093 7.837 1.00 0.00 C ATOM 1037 CD1 TYR A 107 7.054 1.599 8.717 1.00 0.00 C ATOM 1038 CD2 TYR A 107 5.227 1.191 7.152 1.00 0.00 C ATOM 1039 CE1 TYR A 107 7.197 0.211 8.909 1.00 0.00 C ATOM 1040 CE2 TYR A 107 5.370 -0.195 7.345 1.00 0.00 C ATOM 1041 CZ TYR A 107 6.355 -0.685 8.224 1.00 0.00 C ATOM 1042 OH TYR A 107 6.497 -2.045 8.416 1.00 0.00 O ATOM 0 H TYR A 107 4.124 2.890 9.263 1.00 0.00 H new ATOM 0 HA TYR A 107 6.671 4.326 9.503 1.00 0.00 H new ATOM 0 HB2 TYR A 107 5.048 3.783 6.985 1.00 0.00 H new ATOM 0 HB3 TYR A 107 6.783 3.990 7.123 1.00 0.00 H new ATOM 0 HD1 TYR A 107 7.700 2.286 9.244 1.00 0.00 H new ATOM 0 HD2 TYR A 107 4.471 1.566 6.478 1.00 0.00 H new ATOM 0 HE1 TYR A 107 7.953 -0.166 9.582 1.00 0.00 H new ATOM 0 HE2 TYR A 107 4.725 -0.883 6.819 1.00 0.00 H new ATOM 0 HH TYR A 107 6.662 -2.482 7.554 1.00 0.00 H new ATOM 1052 N GLY A 108 3.921 5.931 8.926 1.00 0.00 N ATOM 1053 CA GLY A 108 3.355 7.311 8.754 1.00 0.00 C ATOM 1054 C GLY A 108 2.517 7.393 7.473 1.00 0.00 C ATOM 1055 O GLY A 108 2.682 8.292 6.673 1.00 0.00 O ATOM 0 H GLY A 108 3.237 5.214 9.169 1.00 0.00 H new ATOM 0 HA2 GLY A 108 2.739 7.567 9.616 1.00 0.00 H new ATOM 0 HA3 GLY A 108 4.165 8.040 8.713 1.00 0.00 H new ATOM 1059 N PHE A 109 1.607 6.475 7.280 1.00 0.00 N ATOM 1060 CA PHE A 109 0.744 6.516 6.059 1.00 0.00 C ATOM 1061 C PHE A 109 -0.543 7.286 6.385 1.00 0.00 C ATOM 1062 O PHE A 109 -0.724 7.786 7.477 1.00 0.00 O ATOM 1063 CB PHE A 109 0.387 5.079 5.633 1.00 0.00 C ATOM 1064 CG PHE A 109 1.452 4.523 4.714 1.00 0.00 C ATOM 1065 CD1 PHE A 109 2.663 4.040 5.243 1.00 0.00 C ATOM 1066 CD2 PHE A 109 1.225 4.480 3.325 1.00 0.00 C ATOM 1067 CE1 PHE A 109 3.646 3.512 4.384 1.00 0.00 C ATOM 1068 CE2 PHE A 109 2.208 3.955 2.466 1.00 0.00 C ATOM 1069 CZ PHE A 109 3.417 3.469 2.996 1.00 0.00 C ATOM 0 H PHE A 109 1.423 5.698 7.914 1.00 0.00 H new ATOM 0 HA PHE A 109 1.277 7.011 5.247 1.00 0.00 H new ATOM 0 HB2 PHE A 109 0.290 4.445 6.514 1.00 0.00 H new ATOM 0 HB3 PHE A 109 -0.579 5.072 5.128 1.00 0.00 H new ATOM 0 HD1 PHE A 109 2.839 4.074 6.308 1.00 0.00 H new ATOM 0 HD2 PHE A 109 0.295 4.850 2.919 1.00 0.00 H new ATOM 0 HE1 PHE A 109 4.575 3.140 4.790 1.00 0.00 H new ATOM 0 HE2 PHE A 109 2.034 3.925 1.400 1.00 0.00 H new ATOM 0 HZ PHE A 109 4.170 3.063 2.337 1.00 0.00 H new ATOM 1079 N HIS A 110 -1.439 7.369 5.440 1.00 0.00 N ATOM 1080 CA HIS A 110 -2.727 8.088 5.672 1.00 0.00 C ATOM 1081 C HIS A 110 -3.804 7.443 4.798 1.00 0.00 C ATOM 1082 O HIS A 110 -4.142 7.942 3.744 1.00 0.00 O ATOM 1083 CB HIS A 110 -2.570 9.561 5.288 1.00 0.00 C ATOM 1084 CG HIS A 110 -3.769 10.334 5.762 1.00 0.00 C ATOM 1085 ND1 HIS A 110 -3.803 10.961 6.997 1.00 0.00 N ATOM 1086 CD2 HIS A 110 -4.985 10.588 5.178 1.00 0.00 C ATOM 1087 CE1 HIS A 110 -5.005 11.557 7.116 1.00 0.00 C ATOM 1088 NE2 HIS A 110 -5.764 11.361 6.035 1.00 0.00 N ATOM 0 H HIS A 110 -1.334 6.966 4.509 1.00 0.00 H new ATOM 0 HA HIS A 110 -3.008 8.024 6.723 1.00 0.00 H new ATOM 0 HB2 HIS A 110 -1.662 9.969 5.733 1.00 0.00 H new ATOM 0 HB3 HIS A 110 -2.466 9.657 4.207 1.00 0.00 H new ATOM 0 HD2 HIS A 110 -5.291 10.241 4.202 1.00 0.00 H new ATOM 0 HE1 HIS A 110 -5.317 12.124 7.980 1.00 0.00 H new ATOM 0 HE2 HIS A 110 -6.711 11.704 5.872 1.00 0.00 H new ATOM 1096 N LYS A 111 -4.326 6.321 5.215 1.00 0.00 N ATOM 1097 CA LYS A 111 -5.356 5.632 4.394 1.00 0.00 C ATOM 1098 C LYS A 111 -6.709 6.328 4.521 1.00 0.00 C ATOM 1099 O LYS A 111 -7.117 6.731 5.591 1.00 0.00 O ATOM 1100 CB LYS A 111 -5.473 4.168 4.846 1.00 0.00 C ATOM 1101 CG LYS A 111 -6.215 4.066 6.189 1.00 0.00 C ATOM 1102 CD LYS A 111 -6.174 2.612 6.692 1.00 0.00 C ATOM 1103 CE LYS A 111 -7.142 1.715 5.884 1.00 0.00 C ATOM 1104 NZ LYS A 111 -6.368 0.608 5.262 1.00 0.00 N ATOM 0 H LYS A 111 -4.082 5.854 6.088 1.00 0.00 H new ATOM 0 HA LYS A 111 -5.053 5.670 3.348 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -6.003 3.591 4.088 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -4.479 3.732 4.941 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -5.754 4.728 6.922 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -7.248 4.392 6.071 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -5.159 2.224 6.609 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -6.441 2.582 7.748 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -7.917 1.313 6.537 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -7.646 2.301 5.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -7.022 -0.132 4.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -5.828 0.974 4.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -5.712 0.207 5.962 1.00 0.00 H new ATOM 1118 N ILE A 112 -7.416 6.441 3.428 1.00 0.00 N ATOM 1119 CA ILE A 112 -8.764 7.076 3.451 1.00 0.00 C ATOM 1120 C ILE A 112 -9.805 5.966 3.382 1.00 0.00 C ATOM 1121 O ILE A 112 -10.330 5.650 2.333 1.00 0.00 O ATOM 1122 CB ILE A 112 -8.912 8.004 2.250 1.00 0.00 C ATOM 1123 CG1 ILE A 112 -7.820 9.090 2.321 1.00 0.00 C ATOM 1124 CG2 ILE A 112 -10.303 8.651 2.291 1.00 0.00 C ATOM 1125 CD1 ILE A 112 -7.582 9.690 0.938 1.00 0.00 C ATOM 0 H ILE A 112 -7.112 6.116 2.510 1.00 0.00 H new ATOM 0 HA ILE A 112 -8.897 7.662 4.361 1.00 0.00 H new ATOM 0 HB ILE A 112 -8.803 7.445 1.321 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -8.120 9.872 3.018 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -6.894 8.660 2.703 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -10.420 9.317 1.436 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -11.067 7.874 2.253 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -10.412 9.222 3.213 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -6.809 10.456 1.002 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -7.261 8.906 0.252 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -8.506 10.137 0.571 1.00 0.00 H new ATOM 1137 N THR A 113 -10.085 5.350 4.494 1.00 0.00 N ATOM 1138 CA THR A 113 -11.065 4.234 4.504 1.00 0.00 C ATOM 1139 C THR A 113 -12.495 4.782 4.492 1.00 0.00 C ATOM 1140 O THR A 113 -13.336 4.361 5.260 1.00 0.00 O ATOM 1141 CB THR A 113 -10.834 3.393 5.762 1.00 0.00 C ATOM 1142 OG1 THR A 113 -9.453 3.415 6.090 1.00 0.00 O ATOM 1143 CG2 THR A 113 -11.277 1.952 5.516 1.00 0.00 C ATOM 0 H THR A 113 -9.675 5.573 5.401 1.00 0.00 H new ATOM 0 HA THR A 113 -10.930 3.618 3.615 1.00 0.00 H new ATOM 0 HB THR A 113 -11.416 3.807 6.585 1.00 0.00 H new ATOM 0 HG1 THR A 113 -9.321 3.017 6.976 1.00 0.00 H new ATOM 0 HG21 THR A 113 -11.109 1.361 6.416 1.00 0.00 H new ATOM 0 HG22 THR A 113 -12.337 1.935 5.264 1.00 0.00 H new ATOM 0 HG23 THR A 113 -10.701 1.530 4.692 1.00 0.00 H new ATOM 1151 N SER A 114 -12.776 5.710 3.623 1.00 0.00 N ATOM 1152 CA SER A 114 -14.150 6.279 3.557 1.00 0.00 C ATOM 1153 C SER A 114 -14.649 6.607 4.966 1.00 0.00 C ATOM 1154 O SER A 114 -15.296 5.803 5.609 1.00 0.00 O ATOM 1155 CB SER A 114 -15.090 5.261 2.909 1.00 0.00 C ATOM 1156 OG SER A 114 -16.429 5.728 3.012 1.00 0.00 O ATOM 0 H SER A 114 -12.112 6.100 2.954 1.00 0.00 H new ATOM 0 HA SER A 114 -14.131 7.193 2.963 1.00 0.00 H new ATOM 0 HB2 SER A 114 -14.822 5.116 1.862 1.00 0.00 H new ATOM 0 HB3 SER A 114 -14.991 4.293 3.400 1.00 0.00 H new ATOM 0 HG SER A 114 -17.035 5.079 2.597 1.00 0.00 H new ATOM 1162 N ILE A 115 -14.357 7.783 5.453 1.00 0.00 N ATOM 1163 CA ILE A 115 -14.818 8.161 6.819 1.00 0.00 C ATOM 1164 C ILE A 115 -16.277 8.628 6.738 1.00 0.00 C ATOM 1165 O ILE A 115 -16.831 9.120 7.701 1.00 0.00 O ATOM 1166 CB ILE A 115 -13.930 9.297 7.379 1.00 0.00 C ATOM 1167 CG1 ILE A 115 -13.482 10.236 6.225 1.00 0.00 C ATOM 1168 CG2 ILE A 115 -12.708 8.708 8.124 1.00 0.00 C ATOM 1169 CD1 ILE A 115 -12.216 9.714 5.508 1.00 0.00 C ATOM 0 H ILE A 115 -13.819 8.498 4.963 1.00 0.00 H new ATOM 0 HA ILE A 115 -14.744 7.301 7.484 1.00 0.00 H new ATOM 0 HB ILE A 115 -14.508 9.883 8.094 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -14.293 10.334 5.503 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -13.288 11.232 6.623 1.00 0.00 H new ATOM 0 HG21 ILE A 115 -12.093 9.520 8.512 1.00 0.00 H new ATOM 0 HG22 ILE A 115 -13.051 8.085 8.950 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -12.118 8.104 7.435 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -11.940 10.402 4.709 1.00 0.00 H new ATOM 0 HD12 ILE A 115 -11.397 9.641 6.223 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -12.417 8.730 5.085 1.00 0.00 H new ATOM 1181 N ASP A 116 -16.896 8.471 5.596 1.00 0.00 N ATOM 1182 CA ASP A 116 -18.321 8.898 5.431 1.00 0.00 C ATOM 1183 C ASP A 116 -18.552 10.251 6.112 1.00 0.00 C ATOM 1184 O ASP A 116 -19.532 10.450 6.800 1.00 0.00 O ATOM 1185 CB ASP A 116 -19.248 7.843 6.047 1.00 0.00 C ATOM 1186 CG ASP A 116 -19.101 7.843 7.570 1.00 0.00 C ATOM 1187 OD1 ASP A 116 -18.222 7.154 8.060 1.00 0.00 O ATOM 1188 OD2 ASP A 116 -19.868 8.534 8.221 1.00 0.00 O ATOM 0 H ASP A 116 -16.473 8.062 4.763 1.00 0.00 H new ATOM 0 HA ASP A 116 -18.540 8.998 4.368 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -20.282 8.051 5.773 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -19.005 6.857 5.650 1.00 0.00 H new ATOM 1193 N ASN A 117 -17.654 11.179 5.927 1.00 0.00 N ATOM 1194 CA ASN A 117 -17.823 12.516 6.565 1.00 0.00 C ATOM 1195 C ASN A 117 -18.802 13.354 5.741 1.00 0.00 C ATOM 1196 O ASN A 117 -18.418 14.064 4.833 1.00 0.00 O ATOM 1197 CB ASN A 117 -16.467 13.224 6.630 1.00 0.00 C ATOM 1198 CG ASN A 117 -15.734 13.049 5.299 1.00 0.00 C ATOM 1199 OD1 ASN A 117 -16.341 13.086 4.248 1.00 0.00 O ATOM 1200 ND2 ASN A 117 -14.442 12.858 5.300 1.00 0.00 N ATOM 0 H ASN A 117 -16.811 11.070 5.363 1.00 0.00 H new ATOM 0 HA ASN A 117 -18.215 12.392 7.574 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -16.608 14.284 6.843 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -15.869 12.813 7.443 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -13.943 12.740 4.418 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -13.932 12.827 6.183 1.00 0.00 H new ATOM 1207 N GLY A 118 -20.066 13.278 6.055 1.00 0.00 N ATOM 1208 CA GLY A 118 -21.071 14.070 5.294 1.00 0.00 C ATOM 1209 C GLY A 118 -21.047 13.653 3.823 1.00 0.00 C ATOM 1210 O GLY A 118 -20.493 12.633 3.466 1.00 0.00 O ATOM 0 H GLY A 118 -20.446 12.701 6.806 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -22.065 13.911 5.711 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -20.854 15.134 5.384 1.00 0.00 H new ATOM 1214 N GLY A 119 -21.645 14.435 2.966 1.00 0.00 N ATOM 1215 CA GLY A 119 -21.656 14.084 1.517 1.00 0.00 C ATOM 1216 C GLY A 119 -22.126 12.639 1.345 1.00 0.00 C ATOM 1217 O GLY A 119 -22.995 12.169 2.054 1.00 0.00 O ATOM 0 H GLY A 119 -22.126 15.302 3.206 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -22.317 14.759 0.973 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -20.658 14.206 1.095 1.00 0.00 H new ATOM 1221 N LEU A 120 -21.559 11.928 0.409 1.00 0.00 N ATOM 1222 CA LEU A 120 -21.973 10.513 0.193 1.00 0.00 C ATOM 1223 C LEU A 120 -20.877 9.771 -0.572 1.00 0.00 C ATOM 1224 O LEU A 120 -20.193 10.337 -1.402 1.00 0.00 O ATOM 1225 CB LEU A 120 -23.286 10.477 -0.603 1.00 0.00 C ATOM 1226 CG LEU A 120 -23.140 11.259 -1.940 1.00 0.00 C ATOM 1227 CD1 LEU A 120 -22.848 10.295 -3.100 1.00 0.00 C ATOM 1228 CD2 LEU A 120 -24.442 12.013 -2.249 1.00 0.00 C ATOM 0 H LEU A 120 -20.827 12.266 -0.216 1.00 0.00 H new ATOM 0 HA LEU A 120 -22.127 10.027 1.156 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -23.564 9.443 -0.809 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -24.090 10.911 -0.008 1.00 0.00 H new ATOM 0 HG LEU A 120 -22.314 11.962 -1.833 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -22.749 10.860 -4.027 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -21.920 9.758 -2.902 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -23.667 9.582 -3.196 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -24.333 12.558 -3.186 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -25.263 11.301 -2.337 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -24.656 12.715 -1.443 1.00 0.00 H new ATOM 1240 N ARG A 121 -20.701 8.506 -0.298 1.00 0.00 N ATOM 1241 CA ARG A 121 -19.648 7.722 -1.009 1.00 0.00 C ATOM 1242 C ARG A 121 -20.029 6.241 -0.998 1.00 0.00 C ATOM 1243 O ARG A 121 -20.510 5.707 -1.978 1.00 0.00 O ATOM 1244 CB ARG A 121 -18.303 7.904 -0.297 1.00 0.00 C ATOM 1245 CG ARG A 121 -17.815 9.346 -0.468 1.00 0.00 C ATOM 1246 CD ARG A 121 -16.337 9.434 -0.086 1.00 0.00 C ATOM 1247 NE ARG A 121 -15.836 10.810 -0.357 1.00 0.00 N ATOM 1248 CZ ARG A 121 -14.702 11.205 0.155 1.00 0.00 C ATOM 1249 NH1 ARG A 121 -14.007 10.392 0.904 1.00 0.00 N ATOM 1250 NH2 ARG A 121 -14.263 12.410 -0.081 1.00 0.00 N ATOM 0 H ARG A 121 -21.242 7.980 0.389 1.00 0.00 H new ATOM 0 HA ARG A 121 -19.565 8.074 -2.037 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -18.407 7.669 0.762 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -17.568 7.211 -0.706 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -17.954 9.668 -1.500 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -18.404 10.017 0.158 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -16.208 9.189 0.968 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -15.759 8.706 -0.656 1.00 0.00 H new ATOM 0 HE ARG A 121 -16.379 11.444 -0.943 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -14.350 9.449 1.088 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -13.121 10.700 1.305 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -14.806 13.045 -0.666 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -13.377 12.718 0.320 1.00 0.00 H new ATOM 1264 N PHE A 122 -19.818 5.572 0.103 1.00 0.00 N ATOM 1265 CA PHE A 122 -20.168 4.126 0.176 1.00 0.00 C ATOM 1266 C PHE A 122 -19.584 3.399 -1.036 1.00 0.00 C ATOM 1267 O PHE A 122 -20.269 2.663 -1.719 1.00 0.00 O ATOM 1268 CB PHE A 122 -21.690 3.968 0.179 1.00 0.00 C ATOM 1269 CG PHE A 122 -22.238 4.383 1.523 1.00 0.00 C ATOM 1270 CD1 PHE A 122 -22.493 5.741 1.791 1.00 0.00 C ATOM 1271 CD2 PHE A 122 -22.495 3.410 2.508 1.00 0.00 C ATOM 1272 CE1 PHE A 122 -23.005 6.127 3.044 1.00 0.00 C ATOM 1273 CE2 PHE A 122 -23.006 3.796 3.763 1.00 0.00 C ATOM 1274 CZ PHE A 122 -23.261 5.155 4.030 1.00 0.00 C ATOM 0 H PHE A 122 -19.418 5.965 0.955 1.00 0.00 H new ATOM 0 HA PHE A 122 -19.756 3.699 1.091 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -22.131 4.578 -0.609 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -21.959 2.933 -0.031 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -22.296 6.487 1.035 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -22.300 2.368 2.301 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -23.202 7.169 3.249 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -23.202 3.050 4.519 1.00 0.00 H new ATOM 0 HZ PHE A 122 -23.653 5.452 4.992 1.00 0.00 H new ATOM 1284 N ASP A 123 -18.324 3.597 -1.309 1.00 0.00 N ATOM 1285 CA ASP A 123 -17.699 2.914 -2.477 1.00 0.00 C ATOM 1286 C ASP A 123 -17.951 1.409 -2.379 1.00 0.00 C ATOM 1287 O ASP A 123 -19.012 0.925 -2.720 1.00 0.00 O ATOM 1288 CB ASP A 123 -16.193 3.181 -2.478 1.00 0.00 C ATOM 1289 CG ASP A 123 -15.938 4.670 -2.724 1.00 0.00 C ATOM 1290 OD1 ASP A 123 -16.574 5.477 -2.067 1.00 0.00 O ATOM 1291 OD2 ASP A 123 -15.109 4.977 -3.564 1.00 0.00 O ATOM 0 H ASP A 123 -17.700 4.202 -0.774 1.00 0.00 H new ATOM 0 HA ASP A 123 -18.135 3.297 -3.400 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -15.759 2.880 -1.525 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -15.708 2.586 -3.251 1.00 0.00 H new ATOM 1296 N ARG A 124 -16.985 0.663 -1.914 1.00 0.00 N ATOM 1297 CA ARG A 124 -17.172 -0.809 -1.791 1.00 0.00 C ATOM 1298 C ARG A 124 -15.960 -1.383 -1.070 1.00 0.00 C ATOM 1299 O ARG A 124 -15.550 -2.493 -1.323 1.00 0.00 O ATOM 1300 CB ARG A 124 -17.297 -1.440 -3.182 1.00 0.00 C ATOM 1301 CG ARG A 124 -16.071 -1.080 -4.028 1.00 0.00 C ATOM 1302 CD ARG A 124 -16.372 -1.330 -5.508 1.00 0.00 C ATOM 1303 NE ARG A 124 -17.096 -2.634 -5.674 1.00 0.00 N ATOM 1304 CZ ARG A 124 -16.598 -3.757 -5.228 1.00 0.00 C ATOM 1305 NH1 ARG A 124 -15.373 -3.807 -4.781 1.00 0.00 N ATOM 1306 NH2 ARG A 124 -17.314 -4.847 -5.278 1.00 0.00 N ATOM 0 H ARG A 124 -16.074 1.011 -1.614 1.00 0.00 H new ATOM 0 HA ARG A 124 -18.082 -1.026 -1.231 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -17.384 -2.523 -3.094 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -18.204 -1.086 -3.671 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -15.805 -0.034 -3.873 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -15.214 -1.677 -3.716 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -16.977 -0.516 -5.907 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -15.443 -1.346 -6.078 1.00 0.00 H new ATOM 0 HE ARG A 124 -18.000 -2.644 -6.147 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -14.796 -2.966 -4.778 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -14.992 -4.688 -4.435 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -18.258 -4.820 -5.664 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -16.930 -5.726 -4.931 1.00 0.00 H new ATOM 1320 N ASP A 125 -15.396 -0.590 -0.189 1.00 0.00 N ATOM 1321 CA ASP A 125 -14.185 -0.974 0.606 1.00 0.00 C ATOM 1322 C ASP A 125 -12.946 -0.409 -0.090 1.00 0.00 C ATOM 1323 O ASP A 125 -11.885 -1.001 -0.091 1.00 0.00 O ATOM 1324 CB ASP A 125 -14.076 -2.509 0.810 1.00 0.00 C ATOM 1325 CG ASP A 125 -13.289 -3.188 -0.328 1.00 0.00 C ATOM 1326 OD1 ASP A 125 -13.221 -2.620 -1.407 1.00 0.00 O ATOM 1327 OD2 ASP A 125 -12.769 -4.267 -0.096 1.00 0.00 O ATOM 0 H ASP A 125 -15.741 0.347 0.019 1.00 0.00 H new ATOM 0 HA ASP A 125 -14.270 -0.549 1.606 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -13.587 -2.714 1.762 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -15.076 -2.939 0.866 1.00 0.00 H new ATOM 1332 N GLU A 126 -13.091 0.740 -0.685 1.00 0.00 N ATOM 1333 CA GLU A 126 -11.950 1.372 -1.392 1.00 0.00 C ATOM 1334 C GLU A 126 -10.852 1.725 -0.374 1.00 0.00 C ATOM 1335 O GLU A 126 -10.718 2.857 0.046 1.00 0.00 O ATOM 1336 CB GLU A 126 -12.461 2.641 -2.116 1.00 0.00 C ATOM 1337 CG GLU A 126 -12.565 2.397 -3.629 1.00 0.00 C ATOM 1338 CD GLU A 126 -13.577 1.285 -3.906 1.00 0.00 C ATOM 1339 OE1 GLU A 126 -13.656 0.367 -3.106 1.00 0.00 O ATOM 1340 OE2 GLU A 126 -14.255 1.369 -4.917 1.00 0.00 O ATOM 0 H GLU A 126 -13.961 1.272 -0.711 1.00 0.00 H new ATOM 0 HA GLU A 126 -11.527 0.688 -2.128 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -13.436 2.924 -1.720 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -11.785 3.474 -1.922 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -12.870 3.313 -4.134 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -11.590 2.122 -4.030 1.00 0.00 H new ATOM 1347 N ILE A 127 -10.064 0.762 0.014 1.00 0.00 N ATOM 1348 CA ILE A 127 -8.969 1.036 0.989 1.00 0.00 C ATOM 1349 C ILE A 127 -7.858 1.804 0.258 1.00 0.00 C ATOM 1350 O ILE A 127 -7.072 1.245 -0.479 1.00 0.00 O ATOM 1351 CB ILE A 127 -8.449 -0.301 1.554 1.00 0.00 C ATOM 1352 CG1 ILE A 127 -7.050 -0.130 2.180 1.00 0.00 C ATOM 1353 CG2 ILE A 127 -8.385 -1.331 0.431 1.00 0.00 C ATOM 1354 CD1 ILE A 127 -6.624 -1.417 2.915 1.00 0.00 C ATOM 0 H ILE A 127 -10.130 -0.206 -0.302 1.00 0.00 H new ATOM 0 HA ILE A 127 -9.326 1.639 1.824 1.00 0.00 H new ATOM 0 HB ILE A 127 -9.133 -0.639 2.333 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -6.324 0.108 1.402 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -7.057 0.708 2.877 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -8.018 -2.278 0.826 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -9.381 -1.475 0.012 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -7.711 -0.977 -0.349 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -5.634 -1.277 3.350 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -7.340 -1.638 3.706 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -6.596 -2.247 2.209 1.00 0.00 H new ATOM 1366 N GLU A 128 -7.803 3.091 0.442 1.00 0.00 N ATOM 1367 CA GLU A 128 -6.762 3.907 -0.250 1.00 0.00 C ATOM 1368 C GLU A 128 -5.516 4.021 0.629 1.00 0.00 C ATOM 1369 O GLU A 128 -5.524 3.667 1.792 1.00 0.00 O ATOM 1370 CB GLU A 128 -7.317 5.306 -0.523 1.00 0.00 C ATOM 1371 CG GLU A 128 -8.731 5.192 -1.095 1.00 0.00 C ATOM 1372 CD GLU A 128 -9.228 6.578 -1.511 1.00 0.00 C ATOM 1373 OE1 GLU A 128 -8.597 7.180 -2.364 1.00 0.00 O ATOM 1374 OE2 GLU A 128 -10.230 7.014 -0.969 1.00 0.00 O ATOM 0 H GLU A 128 -8.436 3.618 1.044 1.00 0.00 H new ATOM 0 HA GLU A 128 -6.494 3.424 -1.189 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -7.332 5.889 0.398 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -6.671 5.834 -1.224 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -8.734 4.520 -1.953 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -9.402 4.762 -0.351 1.00 0.00 H new ATOM 1381 N PHE A 129 -4.444 4.524 0.078 1.00 0.00 N ATOM 1382 CA PHE A 129 -3.185 4.682 0.863 1.00 0.00 C ATOM 1383 C PHE A 129 -2.395 5.868 0.312 1.00 0.00 C ATOM 1384 O PHE A 129 -1.672 5.749 -0.659 1.00 0.00 O ATOM 1385 CB PHE A 129 -2.340 3.402 0.762 1.00 0.00 C ATOM 1386 CG PHE A 129 -2.819 2.384 1.775 1.00 0.00 C ATOM 1387 CD1 PHE A 129 -2.691 2.663 3.149 1.00 0.00 C ATOM 1388 CD2 PHE A 129 -3.374 1.159 1.355 1.00 0.00 C ATOM 1389 CE1 PHE A 129 -3.117 1.723 4.102 1.00 0.00 C ATOM 1390 CE2 PHE A 129 -3.797 0.216 2.312 1.00 0.00 C ATOM 1391 CZ PHE A 129 -3.669 0.500 3.685 1.00 0.00 C ATOM 0 H PHE A 129 -4.386 4.835 -0.892 1.00 0.00 H new ATOM 0 HA PHE A 129 -3.430 4.860 1.910 1.00 0.00 H new ATOM 0 HB2 PHE A 129 -2.411 2.988 -0.244 1.00 0.00 H new ATOM 0 HB3 PHE A 129 -1.290 3.635 0.937 1.00 0.00 H new ATOM 0 HD1 PHE A 129 -2.264 3.602 3.471 1.00 0.00 H new ATOM 0 HD2 PHE A 129 -3.475 0.943 0.302 1.00 0.00 H new ATOM 0 HE1 PHE A 129 -3.020 1.940 5.155 1.00 0.00 H new ATOM 0 HE2 PHE A 129 -4.220 -0.725 1.992 1.00 0.00 H new ATOM 0 HZ PHE A 129 -3.995 -0.223 4.418 1.00 0.00 H new ATOM 1401 N SER A 130 -2.532 7.012 0.937 1.00 0.00 N ATOM 1402 CA SER A 130 -1.800 8.226 0.472 1.00 0.00 C ATOM 1403 C SER A 130 -0.463 8.332 1.204 1.00 0.00 C ATOM 1404 O SER A 130 -0.387 8.197 2.409 1.00 0.00 O ATOM 1405 CB SER A 130 -2.643 9.467 0.768 1.00 0.00 C ATOM 1406 OG SER A 130 -1.811 10.619 0.726 1.00 0.00 O ATOM 0 H SER A 130 -3.124 7.155 1.755 1.00 0.00 H new ATOM 0 HA SER A 130 -1.618 8.153 -0.600 1.00 0.00 H new ATOM 0 HB2 SER A 130 -3.447 9.558 0.038 1.00 0.00 H new ATOM 0 HB3 SER A 130 -3.111 9.378 1.748 1.00 0.00 H new ATOM 0 HG SER A 130 -2.348 11.417 0.914 1.00 0.00 H new ATOM 1412 N HIS A 131 0.596 8.571 0.477 1.00 0.00 N ATOM 1413 CA HIS A 131 1.942 8.688 1.109 1.00 0.00 C ATOM 1414 C HIS A 131 2.811 9.641 0.259 1.00 0.00 C ATOM 1415 O HIS A 131 3.341 9.216 -0.748 1.00 0.00 O ATOM 1416 CB HIS A 131 2.590 7.299 1.135 1.00 0.00 C ATOM 1417 CG HIS A 131 3.733 7.287 2.112 1.00 0.00 C ATOM 1418 ND1 HIS A 131 3.996 8.352 2.961 1.00 0.00 N ATOM 1419 CD2 HIS A 131 4.687 6.342 2.392 1.00 0.00 C ATOM 1420 CE1 HIS A 131 5.068 8.023 3.704 1.00 0.00 C ATOM 1421 NE2 HIS A 131 5.529 6.808 3.397 1.00 0.00 N ATOM 0 H HIS A 131 0.586 8.691 -0.536 1.00 0.00 H new ATOM 0 HA HIS A 131 1.854 9.078 2.123 1.00 0.00 H new ATOM 0 HB2 HIS A 131 1.851 6.549 1.417 1.00 0.00 H new ATOM 0 HB3 HIS A 131 2.948 7.036 0.140 1.00 0.00 H new ATOM 0 HD2 HIS A 131 4.772 5.381 1.906 1.00 0.00 H new ATOM 0 HE1 HIS A 131 5.503 8.663 4.457 1.00 0.00 H new ATOM 0 HE2 HIS A 131 6.327 6.325 3.810 1.00 0.00 H new ATOM 1429 N PRO A 132 2.935 10.902 0.649 1.00 0.00 N ATOM 1430 CA PRO A 132 3.739 11.868 -0.130 1.00 0.00 C ATOM 1431 C PRO A 132 5.228 11.470 -0.136 1.00 0.00 C ATOM 1432 O PRO A 132 6.095 12.304 -0.308 1.00 0.00 O ATOM 1433 CB PRO A 132 3.522 13.231 0.574 1.00 0.00 C ATOM 1434 CG PRO A 132 2.582 12.984 1.790 1.00 0.00 C ATOM 1435 CD PRO A 132 2.297 11.468 1.860 1.00 0.00 C ATOM 0 HA PRO A 132 3.437 11.902 -1.177 1.00 0.00 H new ATOM 0 HB2 PRO A 132 4.474 13.648 0.903 1.00 0.00 H new ATOM 0 HB3 PRO A 132 3.079 13.951 -0.113 1.00 0.00 H new ATOM 0 HG2 PRO A 132 3.050 13.328 2.712 1.00 0.00 H new ATOM 0 HG3 PRO A 132 1.653 13.543 1.676 1.00 0.00 H new ATOM 0 HD2 PRO A 132 2.713 11.030 2.767 1.00 0.00 H new ATOM 0 HD3 PRO A 132 1.226 11.268 1.872 1.00 0.00 H new ATOM 1443 N PHE A 133 5.533 10.208 0.039 1.00 0.00 N ATOM 1444 CA PHE A 133 6.962 9.768 0.032 1.00 0.00 C ATOM 1445 C PHE A 133 7.057 8.392 -0.633 1.00 0.00 C ATOM 1446 O PHE A 133 7.921 7.598 -0.320 1.00 0.00 O ATOM 1447 CB PHE A 133 7.479 9.684 1.468 1.00 0.00 C ATOM 1448 CG PHE A 133 7.688 11.079 2.010 1.00 0.00 C ATOM 1449 CD1 PHE A 133 8.932 11.720 1.846 1.00 0.00 C ATOM 1450 CD2 PHE A 133 6.637 11.739 2.676 1.00 0.00 C ATOM 1451 CE1 PHE A 133 9.124 13.022 2.349 1.00 0.00 C ATOM 1452 CE2 PHE A 133 6.831 13.040 3.178 1.00 0.00 C ATOM 1453 CZ PHE A 133 8.074 13.681 3.015 1.00 0.00 C ATOM 0 H PHE A 133 4.853 9.463 0.187 1.00 0.00 H new ATOM 0 HA PHE A 133 7.566 10.486 -0.523 1.00 0.00 H new ATOM 0 HB2 PHE A 133 6.767 9.143 2.091 1.00 0.00 H new ATOM 0 HB3 PHE A 133 8.415 9.127 1.497 1.00 0.00 H new ATOM 0 HD1 PHE A 133 9.738 11.214 1.335 1.00 0.00 H new ATOM 0 HD2 PHE A 133 5.683 11.248 2.801 1.00 0.00 H new ATOM 0 HE1 PHE A 133 10.077 13.514 2.223 1.00 0.00 H new ATOM 0 HE2 PHE A 133 6.026 13.547 3.689 1.00 0.00 H new ATOM 0 HZ PHE A 133 8.222 14.679 3.401 1.00 0.00 H new ATOM 1463 N PHE A 134 6.170 8.107 -1.551 1.00 0.00 N ATOM 1464 CA PHE A 134 6.193 6.784 -2.247 1.00 0.00 C ATOM 1465 C PHE A 134 5.630 6.953 -3.660 1.00 0.00 C ATOM 1466 O PHE A 134 4.881 6.129 -4.145 1.00 0.00 O ATOM 1467 CB PHE A 134 5.330 5.790 -1.461 1.00 0.00 C ATOM 1468 CG PHE A 134 5.465 4.405 -2.052 1.00 0.00 C ATOM 1469 CD1 PHE A 134 6.608 3.628 -1.778 1.00 0.00 C ATOM 1470 CD2 PHE A 134 4.444 3.887 -2.873 1.00 0.00 C ATOM 1471 CE1 PHE A 134 6.729 2.336 -2.325 1.00 0.00 C ATOM 1472 CE2 PHE A 134 4.566 2.596 -3.421 1.00 0.00 C ATOM 1473 CZ PHE A 134 5.708 1.820 -3.147 1.00 0.00 C ATOM 0 H PHE A 134 5.426 8.737 -1.851 1.00 0.00 H new ATOM 0 HA PHE A 134 7.215 6.409 -2.306 1.00 0.00 H new ATOM 0 HB2 PHE A 134 5.636 5.779 -0.415 1.00 0.00 H new ATOM 0 HB3 PHE A 134 4.286 6.104 -1.485 1.00 0.00 H new ATOM 0 HD1 PHE A 134 7.391 4.023 -1.148 1.00 0.00 H new ATOM 0 HD2 PHE A 134 3.567 4.481 -3.082 1.00 0.00 H new ATOM 0 HE1 PHE A 134 7.605 1.740 -2.114 1.00 0.00 H new ATOM 0 HE2 PHE A 134 3.783 2.201 -4.052 1.00 0.00 H new ATOM 0 HZ PHE A 134 5.801 0.829 -3.567 1.00 0.00 H new ATOM 1483 N LYS A 135 5.979 8.024 -4.325 1.00 0.00 N ATOM 1484 CA LYS A 135 5.460 8.259 -5.708 1.00 0.00 C ATOM 1485 C LYS A 135 6.419 7.628 -6.725 1.00 0.00 C ATOM 1486 O LYS A 135 6.362 7.922 -7.901 1.00 0.00 O ATOM 1487 CB LYS A 135 5.340 9.776 -5.996 1.00 0.00 C ATOM 1488 CG LYS A 135 4.964 10.580 -4.731 1.00 0.00 C ATOM 1489 CD LYS A 135 3.457 10.470 -4.410 1.00 0.00 C ATOM 1490 CE LYS A 135 3.132 9.181 -3.629 1.00 0.00 C ATOM 1491 NZ LYS A 135 1.971 9.438 -2.730 1.00 0.00 N ATOM 0 H LYS A 135 6.603 8.749 -3.970 1.00 0.00 H new ATOM 0 HA LYS A 135 4.472 7.805 -5.791 1.00 0.00 H new ATOM 0 HB2 LYS A 135 6.286 10.145 -6.392 1.00 0.00 H new ATOM 0 HB3 LYS A 135 4.586 9.940 -6.766 1.00 0.00 H new ATOM 0 HG2 LYS A 135 5.544 10.216 -3.883 1.00 0.00 H new ATOM 0 HG3 LYS A 135 5.230 11.627 -4.873 1.00 0.00 H new ATOM 0 HD2 LYS A 135 3.145 11.337 -3.827 1.00 0.00 H new ATOM 0 HD3 LYS A 135 2.885 10.487 -5.338 1.00 0.00 H new ATOM 0 HE2 LYS A 135 2.901 8.370 -4.320 1.00 0.00 H new ATOM 0 HE3 LYS A 135 3.997 8.866 -3.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 2.121 8.954 -1.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 1.879 10.461 -2.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 1.102 9.079 -3.174 1.00 0.00 H new ATOM 1505 N ARG A 136 7.297 6.769 -6.278 1.00 0.00 N ATOM 1506 CA ARG A 136 8.269 6.114 -7.208 1.00 0.00 C ATOM 1507 C ARG A 136 9.290 7.146 -7.704 1.00 0.00 C ATOM 1508 O ARG A 136 10.456 7.086 -7.367 1.00 0.00 O ATOM 1509 CB ARG A 136 7.520 5.502 -8.405 1.00 0.00 C ATOM 1510 CG ARG A 136 8.356 4.371 -9.013 1.00 0.00 C ATOM 1511 CD ARG A 136 7.589 3.738 -10.173 1.00 0.00 C ATOM 1512 NE ARG A 136 7.498 4.712 -11.298 1.00 0.00 N ATOM 1513 CZ ARG A 136 7.158 4.301 -12.490 1.00 0.00 C ATOM 1514 NH1 ARG A 136 6.901 3.039 -12.695 1.00 0.00 N ATOM 1515 NH2 ARG A 136 7.075 5.154 -13.474 1.00 0.00 N ATOM 0 H ARG A 136 7.384 6.490 -5.301 1.00 0.00 H new ATOM 0 HA ARG A 136 8.793 5.321 -6.674 1.00 0.00 H new ATOM 0 HB2 ARG A 136 6.552 5.119 -8.083 1.00 0.00 H new ATOM 0 HB3 ARG A 136 7.326 6.268 -9.156 1.00 0.00 H new ATOM 0 HG2 ARG A 136 9.312 4.759 -9.364 1.00 0.00 H new ATOM 0 HG3 ARG A 136 8.576 3.619 -8.255 1.00 0.00 H new ATOM 0 HD2 ARG A 136 8.093 2.830 -10.504 1.00 0.00 H new ATOM 0 HD3 ARG A 136 6.590 3.448 -9.847 1.00 0.00 H new ATOM 0 HE ARG A 136 7.701 5.698 -11.137 1.00 0.00 H new ATOM 0 HH11 ARG A 136 6.966 2.374 -11.925 1.00 0.00 H new ATOM 0 HH12 ARG A 136 6.635 2.717 -13.626 1.00 0.00 H new ATOM 0 HH21 ARG A 136 7.276 6.141 -13.312 1.00 0.00 H new ATOM 0 HH22 ARG A 136 6.810 4.834 -14.405 1.00 0.00 H new ATOM 1529 N ASN A 137 8.864 8.089 -8.504 1.00 0.00 N ATOM 1530 CA ASN A 137 9.812 9.119 -9.018 1.00 0.00 C ATOM 1531 C ASN A 137 10.503 9.805 -7.837 1.00 0.00 C ATOM 1532 O ASN A 137 10.429 9.347 -6.713 1.00 0.00 O ATOM 1533 CB ASN A 137 9.042 10.161 -9.832 1.00 0.00 C ATOM 1534 CG ASN A 137 8.034 10.875 -8.929 1.00 0.00 C ATOM 1535 OD1 ASN A 137 8.383 11.350 -7.866 1.00 0.00 O ATOM 1536 ND2 ASN A 137 6.789 10.971 -9.309 1.00 0.00 N ATOM 0 H ASN A 137 7.900 8.189 -8.823 1.00 0.00 H new ATOM 0 HA ASN A 137 10.559 8.643 -9.653 1.00 0.00 H new ATOM 0 HB2 ASN A 137 9.734 10.884 -10.264 1.00 0.00 H new ATOM 0 HB3 ASN A 137 8.525 9.679 -10.662 1.00 0.00 H new ATOM 0 HD21 ASN A 137 6.109 11.445 -8.714 1.00 0.00 H new ATOM 0 HD22 ASN A 137 6.496 10.573 -10.201 1.00 0.00 H new ATOM 1543 N SER A 138 11.174 10.900 -8.073 1.00 0.00 N ATOM 1544 CA SER A 138 11.861 11.597 -6.949 1.00 0.00 C ATOM 1545 C SER A 138 12.745 10.581 -6.201 1.00 0.00 C ATOM 1546 O SER A 138 12.367 10.118 -5.147 1.00 0.00 O ATOM 1547 CB SER A 138 10.800 12.176 -5.997 1.00 0.00 C ATOM 1548 OG SER A 138 10.525 13.519 -6.368 1.00 0.00 O ATOM 0 H SER A 138 11.276 11.339 -8.988 1.00 0.00 H new ATOM 0 HA SER A 138 12.484 12.408 -7.327 1.00 0.00 H new ATOM 0 HB2 SER A 138 9.889 11.579 -6.042 1.00 0.00 H new ATOM 0 HB3 SER A 138 11.157 12.136 -4.968 1.00 0.00 H new ATOM 0 HG SER A 138 9.848 13.893 -5.766 1.00 0.00 H new ATOM 1554 N PRO A 139 13.884 10.243 -6.773 1.00 0.00 N ATOM 1555 CA PRO A 139 14.800 9.263 -6.155 1.00 0.00 C ATOM 1556 C PRO A 139 15.363 9.807 -4.825 1.00 0.00 C ATOM 1557 O PRO A 139 16.541 10.075 -4.692 1.00 0.00 O ATOM 1558 CB PRO A 139 15.912 9.038 -7.214 1.00 0.00 C ATOM 1559 CG PRO A 139 15.604 9.972 -8.422 1.00 0.00 C ATOM 1560 CD PRO A 139 14.343 10.792 -8.067 1.00 0.00 C ATOM 0 HA PRO A 139 14.304 8.327 -5.898 1.00 0.00 H new ATOM 0 HB2 PRO A 139 16.892 9.264 -6.795 1.00 0.00 H new ATOM 0 HB3 PRO A 139 15.934 7.995 -7.531 1.00 0.00 H new ATOM 0 HG2 PRO A 139 16.448 10.633 -8.620 1.00 0.00 H new ATOM 0 HG3 PRO A 139 15.438 9.387 -9.326 1.00 0.00 H new ATOM 0 HD2 PRO A 139 14.572 11.855 -7.986 1.00 0.00 H new ATOM 0 HD3 PRO A 139 13.576 10.689 -8.834 1.00 0.00 H new ATOM 1568 N PHE A 140 14.527 9.953 -3.831 1.00 0.00 N ATOM 1569 CA PHE A 140 15.011 10.456 -2.512 1.00 0.00 C ATOM 1570 C PHE A 140 13.900 10.315 -1.458 1.00 0.00 C ATOM 1571 O PHE A 140 13.981 10.869 -0.381 1.00 0.00 O ATOM 1572 CB PHE A 140 15.454 11.928 -2.641 1.00 0.00 C ATOM 1573 CG PHE A 140 14.262 12.862 -2.606 1.00 0.00 C ATOM 1574 CD1 PHE A 140 13.579 13.185 -3.795 1.00 0.00 C ATOM 1575 CD2 PHE A 140 13.839 13.415 -1.379 1.00 0.00 C ATOM 1576 CE1 PHE A 140 12.474 14.059 -3.757 1.00 0.00 C ATOM 1577 CE2 PHE A 140 12.735 14.287 -1.344 1.00 0.00 C ATOM 1578 CZ PHE A 140 12.054 14.610 -2.531 1.00 0.00 C ATOM 0 H PHE A 140 13.529 9.745 -3.876 1.00 0.00 H new ATOM 0 HA PHE A 140 15.868 9.863 -2.194 1.00 0.00 H new ATOM 0 HB2 PHE A 140 16.139 12.177 -1.830 1.00 0.00 H new ATOM 0 HB3 PHE A 140 16.001 12.066 -3.574 1.00 0.00 H new ATOM 0 HD1 PHE A 140 13.902 12.763 -4.735 1.00 0.00 H new ATOM 0 HD2 PHE A 140 14.362 13.169 -0.467 1.00 0.00 H new ATOM 0 HE1 PHE A 140 11.949 14.306 -4.668 1.00 0.00 H new ATOM 0 HE2 PHE A 140 12.410 14.709 -0.404 1.00 0.00 H new ATOM 0 HZ PHE A 140 11.208 15.281 -2.502 1.00 0.00 H new ATOM 1588 N LEU A 141 12.862 9.572 -1.759 1.00 0.00 N ATOM 1589 CA LEU A 141 11.750 9.394 -0.776 1.00 0.00 C ATOM 1590 C LEU A 141 11.979 8.103 0.013 1.00 0.00 C ATOM 1591 O LEU A 141 11.983 8.099 1.228 1.00 0.00 O ATOM 1592 CB LEU A 141 10.414 9.299 -1.524 1.00 0.00 C ATOM 1593 CG LEU A 141 10.290 10.450 -2.531 1.00 0.00 C ATOM 1594 CD1 LEU A 141 9.035 10.244 -3.385 1.00 0.00 C ATOM 1595 CD2 LEU A 141 10.194 11.786 -1.783 1.00 0.00 C ATOM 0 H LEU A 141 12.738 9.081 -2.644 1.00 0.00 H new ATOM 0 HA LEU A 141 11.725 10.245 -0.095 1.00 0.00 H new ATOM 0 HB2 LEU A 141 10.346 8.343 -2.043 1.00 0.00 H new ATOM 0 HB3 LEU A 141 9.588 9.336 -0.814 1.00 0.00 H new ATOM 0 HG LEU A 141 11.169 10.465 -3.175 1.00 0.00 H new ATOM 0 HD11 LEU A 141 8.944 11.060 -4.101 1.00 0.00 H new ATOM 0 HD12 LEU A 141 9.111 9.298 -3.921 1.00 0.00 H new ATOM 0 HD13 LEU A 141 8.156 10.227 -2.741 1.00 0.00 H new ATOM 0 HD21 LEU A 141 10.106 12.600 -2.502 1.00 0.00 H new ATOM 0 HD22 LEU A 141 9.318 11.778 -1.135 1.00 0.00 H new ATOM 0 HD23 LEU A 141 11.090 11.930 -1.179 1.00 0.00 H new ATOM 1607 N LEU A 142 12.170 7.006 -0.668 1.00 0.00 N ATOM 1608 CA LEU A 142 12.400 5.718 0.038 1.00 0.00 C ATOM 1609 C LEU A 142 13.481 5.903 1.104 1.00 0.00 C ATOM 1610 O LEU A 142 13.345 5.455 2.226 1.00 0.00 O ATOM 1611 CB LEU A 142 12.864 4.667 -0.970 1.00 0.00 C ATOM 1612 CG LEU A 142 11.849 4.548 -2.114 1.00 0.00 C ATOM 1613 CD1 LEU A 142 12.380 3.558 -3.155 1.00 0.00 C ATOM 1614 CD2 LEU A 142 10.499 4.053 -1.571 1.00 0.00 C ATOM 0 H LEU A 142 12.176 6.948 -1.686 1.00 0.00 H new ATOM 0 HA LEU A 142 11.473 5.394 0.512 1.00 0.00 H new ATOM 0 HB2 LEU A 142 13.841 4.940 -1.368 1.00 0.00 H new ATOM 0 HB3 LEU A 142 12.980 3.703 -0.475 1.00 0.00 H new ATOM 0 HG LEU A 142 11.706 5.526 -2.574 1.00 0.00 H new ATOM 0 HD11 LEU A 142 11.663 3.469 -3.971 1.00 0.00 H new ATOM 0 HD12 LEU A 142 13.332 3.917 -3.546 1.00 0.00 H new ATOM 0 HD13 LEU A 142 12.523 2.583 -2.690 1.00 0.00 H new ATOM 0 HD21 LEU A 142 9.785 3.972 -2.391 1.00 0.00 H new ATOM 0 HD22 LEU A 142 10.630 3.076 -1.106 1.00 0.00 H new ATOM 0 HD23 LEU A 142 10.123 4.760 -0.831 1.00 0.00 H new ATOM 1626 N ASP A 143 14.557 6.549 0.756 1.00 0.00 N ATOM 1627 CA ASP A 143 15.656 6.760 1.738 1.00 0.00 C ATOM 1628 C ASP A 143 15.255 7.842 2.745 1.00 0.00 C ATOM 1629 O ASP A 143 16.037 8.711 3.079 1.00 0.00 O ATOM 1630 CB ASP A 143 16.921 7.200 0.996 1.00 0.00 C ATOM 1631 CG ASP A 143 17.128 6.310 -0.230 1.00 0.00 C ATOM 1632 OD1 ASP A 143 17.315 5.118 -0.048 1.00 0.00 O ATOM 1633 OD2 ASP A 143 17.098 6.835 -1.331 1.00 0.00 O ATOM 0 H ASP A 143 14.724 6.942 -0.170 1.00 0.00 H new ATOM 0 HA ASP A 143 15.846 5.828 2.270 1.00 0.00 H new ATOM 0 HB2 ASP A 143 16.833 8.243 0.691 1.00 0.00 H new ATOM 0 HB3 ASP A 143 17.785 7.133 1.657 1.00 0.00 H new ATOM 1638 N GLN A 144 14.045 7.796 3.239 1.00 0.00 N ATOM 1639 CA GLN A 144 13.597 8.817 4.229 1.00 0.00 C ATOM 1640 C GLN A 144 12.540 8.200 5.148 1.00 0.00 C ATOM 1641 O GLN A 144 12.493 8.475 6.330 1.00 0.00 O ATOM 1642 CB GLN A 144 12.995 10.015 3.494 1.00 0.00 C ATOM 1643 CG GLN A 144 12.604 11.087 4.512 1.00 0.00 C ATOM 1644 CD GLN A 144 12.318 12.404 3.789 1.00 0.00 C ATOM 1645 OE1 GLN A 144 11.393 13.113 4.136 1.00 0.00 O ATOM 1646 NE2 GLN A 144 13.077 12.767 2.792 1.00 0.00 N ATOM 0 H GLN A 144 13.347 7.093 2.998 1.00 0.00 H new ATOM 0 HA GLN A 144 14.450 9.148 4.821 1.00 0.00 H new ATOM 0 HB2 GLN A 144 13.715 10.419 2.782 1.00 0.00 H new ATOM 0 HB3 GLN A 144 12.121 9.704 2.922 1.00 0.00 H new ATOM 0 HG2 GLN A 144 11.723 10.769 5.070 1.00 0.00 H new ATOM 0 HG3 GLN A 144 13.407 11.225 5.236 1.00 0.00 H new ATOM 0 HE21 GLN A 144 13.853 12.174 2.500 1.00 0.00 H new ATOM 0 HE22 GLN A 144 12.894 13.644 2.305 1.00 0.00 H new ATOM 1655 N ILE A 145 11.693 7.364 4.613 1.00 0.00 N ATOM 1656 CA ILE A 145 10.643 6.725 5.455 1.00 0.00 C ATOM 1657 C ILE A 145 11.295 5.699 6.382 1.00 0.00 C ATOM 1658 O ILE A 145 12.160 4.946 5.978 1.00 0.00 O ATOM 1659 CB ILE A 145 9.623 6.021 4.553 1.00 0.00 C ATOM 1660 CG1 ILE A 145 8.913 7.060 3.655 1.00 0.00 C ATOM 1661 CG2 ILE A 145 8.595 5.294 5.433 1.00 0.00 C ATOM 1662 CD1 ILE A 145 8.417 6.394 2.362 1.00 0.00 C ATOM 0 H ILE A 145 11.683 7.096 3.629 1.00 0.00 H new ATOM 0 HA ILE A 145 10.137 7.486 6.049 1.00 0.00 H new ATOM 0 HB ILE A 145 10.132 5.298 3.915 1.00 0.00 H new ATOM 0 HG12 ILE A 145 8.072 7.501 4.191 1.00 0.00 H new ATOM 0 HG13 ILE A 145 9.599 7.872 3.414 1.00 0.00 H new ATOM 0 HG21 ILE A 145 7.865 4.790 4.799 1.00 0.00 H new ATOM 0 HG22 ILE A 145 9.104 4.558 6.055 1.00 0.00 H new ATOM 0 HG23 ILE A 145 8.085 6.017 6.070 1.00 0.00 H new ATOM 0 HD11 ILE A 145 7.919 7.136 1.738 1.00 0.00 H new ATOM 0 HD12 ILE A 145 9.265 5.975 1.820 1.00 0.00 H new ATOM 0 HD13 ILE A 145 7.715 5.598 2.609 1.00 0.00 H new ATOM 1674 N LYS A 146 10.889 5.658 7.624 1.00 0.00 N ATOM 1675 CA LYS A 146 11.488 4.676 8.577 1.00 0.00 C ATOM 1676 C LYS A 146 10.447 4.293 9.633 1.00 0.00 C ATOM 1677 O LYS A 146 9.334 4.782 9.630 1.00 0.00 O ATOM 1678 CB LYS A 146 12.723 5.299 9.252 1.00 0.00 C ATOM 1679 CG LYS A 146 12.505 6.802 9.460 1.00 0.00 C ATOM 1680 CD LYS A 146 11.224 7.034 10.268 1.00 0.00 C ATOM 1681 CE LYS A 146 11.223 8.459 10.828 1.00 0.00 C ATOM 1682 NZ LYS A 146 11.776 9.395 9.808 1.00 0.00 N ATOM 0 H LYS A 146 10.169 6.262 8.020 1.00 0.00 H new ATOM 0 HA LYS A 146 11.795 3.781 8.037 1.00 0.00 H new ATOM 0 HB2 LYS A 146 12.907 4.814 10.211 1.00 0.00 H new ATOM 0 HB3 LYS A 146 13.607 5.133 8.636 1.00 0.00 H new ATOM 0 HG2 LYS A 146 13.359 7.234 9.983 1.00 0.00 H new ATOM 0 HG3 LYS A 146 12.434 7.305 8.496 1.00 0.00 H new ATOM 0 HD2 LYS A 146 10.350 6.880 9.635 1.00 0.00 H new ATOM 0 HD3 LYS A 146 11.159 6.312 11.082 1.00 0.00 H new ATOM 0 HE2 LYS A 146 10.209 8.755 11.096 1.00 0.00 H new ATOM 0 HE3 LYS A 146 11.820 8.503 11.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 11.475 10.366 10.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 12.815 9.344 9.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 11.425 9.129 8.866 1.00 0.00 H new ATOM 1696 N ARG A 147 10.800 3.416 10.535 1.00 0.00 N ATOM 1697 CA ARG A 147 9.835 2.995 11.591 1.00 0.00 C ATOM 1698 C ARG A 147 9.875 3.991 12.752 1.00 0.00 C ATOM 1699 O ARG A 147 10.930 4.359 13.231 1.00 0.00 O ATOM 1700 CB ARG A 147 10.217 1.600 12.097 1.00 0.00 C ATOM 1701 CG ARG A 147 9.014 0.963 12.807 1.00 0.00 C ATOM 1702 CD ARG A 147 9.488 -0.170 13.717 1.00 0.00 C ATOM 1703 NE ARG A 147 10.548 -0.976 13.026 1.00 0.00 N ATOM 1704 CZ ARG A 147 10.338 -1.528 11.860 1.00 0.00 C ATOM 1705 NH1 ARG A 147 9.140 -1.544 11.341 1.00 0.00 N ATOM 1706 NH2 ARG A 147 11.321 -2.113 11.235 1.00 0.00 N ATOM 0 H ARG A 147 11.717 2.972 10.586 1.00 0.00 H new ATOM 0 HA ARG A 147 8.828 2.970 11.175 1.00 0.00 H new ATOM 0 HB2 ARG A 147 10.534 0.974 11.263 1.00 0.00 H new ATOM 0 HB3 ARG A 147 11.062 1.669 12.782 1.00 0.00 H new ATOM 0 HG2 ARG A 147 8.486 1.715 13.393 1.00 0.00 H new ATOM 0 HG3 ARG A 147 8.308 0.579 12.071 1.00 0.00 H new ATOM 0 HD2 ARG A 147 9.881 0.240 14.647 1.00 0.00 H new ATOM 0 HD3 ARG A 147 8.647 -0.811 13.981 1.00 0.00 H new ATOM 0 HE ARG A 147 11.455 -1.096 13.477 1.00 0.00 H new ATOM 0 HH11 ARG A 147 8.360 -1.124 11.846 1.00 0.00 H new ATOM 0 HH12 ARG A 147 8.984 -1.977 10.431 1.00 0.00 H new ATOM 0 HH21 ARG A 147 12.250 -2.139 11.656 1.00 0.00 H new ATOM 0 HH22 ARG A 147 11.162 -2.545 10.325 1.00 0.00 H new ATOM 1720 N LYS A 148 8.734 4.429 13.212 1.00 0.00 N ATOM 1721 CA LYS A 148 8.708 5.399 14.345 1.00 0.00 C ATOM 1722 C LYS A 148 9.631 4.905 15.462 1.00 0.00 C ATOM 1723 O LYS A 148 10.155 3.810 15.409 1.00 0.00 O ATOM 1724 CB LYS A 148 7.279 5.519 14.880 1.00 0.00 C ATOM 1725 CG LYS A 148 7.200 6.680 15.875 1.00 0.00 C ATOM 1726 CD LYS A 148 5.850 6.646 16.596 1.00 0.00 C ATOM 1727 CE LYS A 148 5.852 7.676 17.728 1.00 0.00 C ATOM 1728 NZ LYS A 148 4.634 7.492 18.568 1.00 0.00 N ATOM 0 H LYS A 148 7.819 4.157 12.852 1.00 0.00 H new ATOM 0 HA LYS A 148 9.049 6.374 13.997 1.00 0.00 H new ATOM 0 HB2 LYS A 148 6.584 5.684 14.057 1.00 0.00 H new ATOM 0 HB3 LYS A 148 6.982 4.589 15.366 1.00 0.00 H new ATOM 0 HG2 LYS A 148 8.012 6.608 16.598 1.00 0.00 H new ATOM 0 HG3 LYS A 148 7.321 7.629 15.353 1.00 0.00 H new ATOM 0 HD2 LYS A 148 5.045 6.863 15.894 1.00 0.00 H new ATOM 0 HD3 LYS A 148 5.664 5.649 16.997 1.00 0.00 H new ATOM 0 HE2 LYS A 148 6.748 7.561 18.338 1.00 0.00 H new ATOM 0 HE3 LYS A 148 5.874 8.685 17.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 4.634 8.191 19.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 3.785 7.623 17.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 4.632 6.533 18.971 1.00 0.00 H new TER 1742 LYS A 148