USER MOD reduce.3.24.130724 H: found=0, std=0, add=1050, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1050 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 Single : A 7 THR OG1 : rot 67:sc= 0.76 USER MOD Single : A 11 SER OG : rot 138:sc= 1.37 USER MOD Single : A 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 22 LYS NZ :NH3+ -168:sc= 1.01 (180deg=0.719) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 SER OG : rot 96:sc= 1.28 USER MOD Single : A 26 TYR OH : rot 180:sc= 1.22 USER MOD Single : A 28 MET CE :methyl -162:sc= -0.117 (180deg=-0.53) USER MOD Single : A 29 MET CE :methyl -124:sc= -0.524 (180deg=-1.24) USER MOD Single : A 30 CYS SG : rot 91:sc= -0.751 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ -176:sc= 1.44 (180deg=1.32) USER MOD Single : A 41 THR OG1 : rot -70:sc= -0.0073 USER MOD Single : A 47 SER OG : rot 94:sc= 1.24 USER MOD Single : A 49 ASN : amide:sc= -1.7 K(o=-1.7,f=-5.2!) USER MOD Single : A 50 TYR OH : rot 112:sc= 0.128 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ 156:sc= 1.84 (180deg=0.641) USER MOD Single : A 56 LYS NZ :NH3+ -178:sc= 0.173 (180deg=-0.0274) USER MOD Single : A 58 SER OG : rot 180:sc= -0.032 USER MOD Single : A 59 THR OG1 : rot 180:sc= -0.0135 USER MOD Single : A 61 LYS NZ :NH3+ -168:sc= -0.0301 (180deg=-0.259) USER MOD Single : A 63 CYS SG : rot 180:sc= 0.17 USER MOD Single : A 64 TYR OH : rot 78:sc= 0.932 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 127:sc= 1.25 (180deg=0.801) USER MOD Single : A 85 GLN : amide:sc= -4.46! K(o=-4.5!,f=-1.6) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0.182 USER MOD Single : A 96 LYS NZ :NH3+ -179:sc= 1.21 (180deg=1.2) USER MOD Single : A 97 MET CE :methyl 139:sc= -0.0997 (180deg=-0.451) USER MOD Single : A 98 MET CE :methyl -152:sc= -0.217 (180deg=-1.76!) USER MOD Single : A 99 TYR OH : rot 60:sc= 1.23 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 23:sc= -0.772 USER MOD Single : A 107 SER OG : rot 57:sc= 1.18 USER MOD Single : A 108 SER OG : rot -24:sc= 0.249 USER MOD Single : A 110 SER OG : rot 79:sc= 0.818 USER MOD Single : A 113 TYR OH : rot 110:sc= -0.256 USER MOD Single : A 117 GLN : amide:sc= -0.561 K(o=-0.56,f=-2.2) USER MOD Single : A 119 ASN : amide:sc= 0 K(o=0,f=-0.76) USER MOD Single : A 122 SER OG : rot 98:sc= 1.25 USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 HIS : no HD1:sc= -1.19 K(o=-1.2,f=-0.31) USER MOD ----------------------------------------------------------------- ATOM 58 N GLY A 5 -8.485 -16.694 -7.747 1.00 31.44 N ATOM 59 CA GLY A 5 -8.067 -15.967 -8.908 1.00 63.30 C ATOM 60 C GLY A 5 -8.111 -14.507 -8.597 1.00 33.15 C ATOM 61 O GLY A 5 -9.103 -13.830 -8.897 1.00 45.25 O ATOM 0 HA2 GLY A 5 -7.058 -16.262 -9.196 1.00 63.30 H new ATOM 0 HA3 GLY A 5 -8.719 -16.194 -9.752 1.00 63.30 H new ATOM 65 N VAL A 6 -7.045 -14.031 -7.982 1.00 13.01 N ATOM 66 CA VAL A 6 -6.938 -12.674 -7.458 1.00 21.20 C ATOM 67 C VAL A 6 -7.255 -11.591 -8.492 1.00 72.12 C ATOM 68 O VAL A 6 -6.540 -11.413 -9.501 1.00 23.23 O ATOM 69 CB VAL A 6 -5.556 -12.434 -6.800 1.00 61.20 C ATOM 70 CG1 VAL A 6 -5.389 -10.989 -6.393 1.00 52.50 C ATOM 71 CG2 VAL A 6 -5.404 -13.324 -5.580 1.00 61.52 C ATOM 0 H VAL A 6 -6.205 -14.589 -7.827 1.00 13.01 H new ATOM 0 HA VAL A 6 -7.707 -12.589 -6.690 1.00 21.20 H new ATOM 0 HB VAL A 6 -4.786 -12.677 -7.533 1.00 61.20 H new ATOM 0 HG11 VAL A 6 -4.410 -10.851 -5.934 1.00 52.50 H new ATOM 0 HG12 VAL A 6 -5.470 -10.351 -7.273 1.00 52.50 H new ATOM 0 HG13 VAL A 6 -6.166 -10.720 -5.677 1.00 52.50 H new ATOM 0 HG21 VAL A 6 -4.430 -13.150 -5.122 1.00 61.52 H new ATOM 0 HG22 VAL A 6 -6.190 -13.093 -4.861 1.00 61.52 H new ATOM 0 HG23 VAL A 6 -5.483 -14.369 -5.880 1.00 61.52 H new ATOM 81 N THR A 7 -8.350 -10.903 -8.239 1.00 43.55 N ATOM 82 CA THR A 7 -8.825 -9.818 -9.070 1.00 41.14 C ATOM 83 C THR A 7 -9.175 -8.624 -8.145 1.00 33.34 C ATOM 84 O THR A 7 -9.373 -8.829 -6.940 1.00 52.53 O ATOM 85 CB THR A 7 -10.114 -10.294 -9.791 1.00 13.10 C ATOM 86 OG1 THR A 7 -9.893 -11.602 -10.334 1.00 13.01 O ATOM 87 CG2 THR A 7 -10.500 -9.361 -10.931 1.00 43.34 C ATOM 0 H THR A 7 -8.946 -11.088 -7.432 1.00 43.55 H new ATOM 0 HA THR A 7 -8.072 -9.522 -9.800 1.00 41.14 H new ATOM 0 HB THR A 7 -10.922 -10.302 -9.059 1.00 13.10 H new ATOM 0 HG1 THR A 7 -9.775 -12.244 -9.603 1.00 13.01 H new ATOM 0 HG21 THR A 7 -11.407 -9.728 -11.411 1.00 43.34 H new ATOM 0 HG22 THR A 7 -10.677 -8.360 -10.538 1.00 43.34 H new ATOM 0 HG23 THR A 7 -9.692 -9.326 -11.662 1.00 43.34 H new ATOM 95 N LEU A 8 -9.201 -7.405 -8.663 1.00 61.51 N ATOM 96 CA LEU A 8 -9.664 -6.279 -7.870 1.00 45.01 C ATOM 97 C LEU A 8 -11.137 -6.106 -8.102 1.00 20.01 C ATOM 98 O LEU A 8 -11.617 -6.312 -9.228 1.00 20.13 O ATOM 99 CB LEU A 8 -9.012 -4.910 -8.231 1.00 21.24 C ATOM 100 CG LEU A 8 -7.511 -4.659 -8.003 1.00 35.45 C ATOM 101 CD1 LEU A 8 -7.325 -3.192 -7.713 1.00 25.01 C ATOM 102 CD2 LEU A 8 -6.953 -5.500 -6.876 1.00 64.44 C ATOM 0 H LEU A 8 -8.912 -7.173 -9.613 1.00 61.51 H new ATOM 0 HA LEU A 8 -9.394 -6.520 -6.842 1.00 45.01 H new ATOM 0 HB2 LEU A 8 -9.208 -4.733 -9.289 1.00 21.24 H new ATOM 0 HB3 LEU A 8 -9.551 -4.144 -7.674 1.00 21.24 H new ATOM 0 HG LEU A 8 -6.962 -4.948 -8.899 1.00 35.45 H new ATOM 0 HD11 LEU A 8 -6.268 -2.985 -7.547 1.00 25.01 H new ATOM 0 HD12 LEU A 8 -7.681 -2.606 -8.560 1.00 25.01 H new ATOM 0 HD13 LEU A 8 -7.892 -2.923 -6.822 1.00 25.01 H new ATOM 0 HD21 LEU A 8 -5.891 -5.287 -6.754 1.00 64.44 H new ATOM 0 HD22 LEU A 8 -7.479 -5.264 -5.951 1.00 64.44 H new ATOM 0 HD23 LEU A 8 -7.087 -6.556 -7.110 1.00 64.44 H new ATOM 114 N GLU A 9 -11.867 -5.751 -7.079 1.00 71.44 N ATOM 115 CA GLU A 9 -13.237 -5.385 -7.286 1.00 3.43 C ATOM 116 C GLU A 9 -13.275 -3.886 -7.583 1.00 51.12 C ATOM 117 O GLU A 9 -12.292 -3.165 -7.284 1.00 52.14 O ATOM 118 CB GLU A 9 -14.139 -5.757 -6.095 1.00 12.44 C ATOM 119 CG GLU A 9 -13.795 -5.076 -4.793 1.00 12.10 C ATOM 120 CD GLU A 9 -14.794 -5.377 -3.707 1.00 43.33 C ATOM 121 OE1 GLU A 9 -15.941 -4.926 -3.796 1.00 70.44 O ATOM 122 OE2 GLU A 9 -14.455 -6.057 -2.734 1.00 50.50 O ATOM 0 H GLU A 9 -11.542 -5.708 -6.113 1.00 71.44 H new ATOM 0 HA GLU A 9 -13.639 -5.948 -8.128 1.00 3.43 H new ATOM 0 HB2 GLU A 9 -15.171 -5.516 -6.352 1.00 12.44 H new ATOM 0 HB3 GLU A 9 -14.091 -6.836 -5.946 1.00 12.44 H new ATOM 0 HG2 GLU A 9 -12.804 -5.395 -4.470 1.00 12.10 H new ATOM 0 HG3 GLU A 9 -13.748 -3.999 -4.951 1.00 12.10 H new ATOM 129 N GLU A 10 -14.367 -3.409 -8.160 1.00 31.12 N ATOM 130 CA GLU A 10 -14.485 -1.997 -8.546 1.00 53.44 C ATOM 131 C GLU A 10 -14.334 -1.077 -7.325 1.00 74.01 C ATOM 132 O GLU A 10 -13.741 -0.004 -7.417 1.00 34.00 O ATOM 133 CB GLU A 10 -15.821 -1.733 -9.265 1.00 61.41 C ATOM 134 CG GLU A 10 -15.921 -0.349 -9.914 1.00 54.33 C ATOM 135 CD GLU A 10 -14.881 -0.143 -10.995 1.00 55.01 C ATOM 136 OE1 GLU A 10 -13.760 0.319 -10.692 1.00 23.15 O ATOM 137 OE2 GLU A 10 -15.141 -0.499 -12.166 1.00 71.51 O ATOM 0 H GLU A 10 -15.189 -3.973 -8.375 1.00 31.12 H new ATOM 0 HA GLU A 10 -13.675 -1.772 -9.240 1.00 53.44 H new ATOM 0 HB2 GLU A 10 -15.964 -2.493 -10.033 1.00 61.41 H new ATOM 0 HB3 GLU A 10 -16.635 -1.846 -8.549 1.00 61.41 H new ATOM 0 HG2 GLU A 10 -16.916 -0.222 -10.341 1.00 54.33 H new ATOM 0 HG3 GLU A 10 -15.803 0.418 -9.149 1.00 54.33 H new ATOM 144 N SER A 11 -14.817 -1.547 -6.186 1.00 51.30 N ATOM 145 CA SER A 11 -14.761 -0.823 -4.929 1.00 34.22 C ATOM 146 C SER A 11 -13.310 -0.455 -4.563 1.00 74.41 C ATOM 147 O SER A 11 -13.035 0.654 -4.096 1.00 2.20 O ATOM 148 CB SER A 11 -15.335 -1.719 -3.859 1.00 74.21 C ATOM 149 OG SER A 11 -16.483 -2.407 -4.358 1.00 31.41 O ATOM 0 H SER A 11 -15.267 -2.459 -6.109 1.00 51.30 H new ATOM 0 HA SER A 11 -15.328 0.104 -5.017 1.00 34.22 H new ATOM 0 HB2 SER A 11 -14.583 -2.438 -3.534 1.00 74.21 H new ATOM 0 HB3 SER A 11 -15.608 -1.127 -2.986 1.00 74.21 H new ATOM 0 HG SER A 11 -16.460 -3.341 -4.061 1.00 31.41 H new ATOM 155 N VAL A 12 -12.383 -1.378 -4.827 1.00 23.23 N ATOM 156 CA VAL A 12 -10.981 -1.161 -4.516 1.00 55.44 C ATOM 157 C VAL A 12 -10.425 -0.085 -5.418 1.00 12.33 C ATOM 158 O VAL A 12 -9.729 0.807 -4.966 1.00 25.45 O ATOM 159 CB VAL A 12 -10.142 -2.459 -4.658 1.00 34.14 C ATOM 160 CG1 VAL A 12 -8.672 -2.204 -4.333 1.00 31.23 C ATOM 161 CG2 VAL A 12 -10.687 -3.526 -3.743 1.00 41.41 C ATOM 0 H VAL A 12 -12.585 -2.281 -5.256 1.00 23.23 H new ATOM 0 HA VAL A 12 -10.916 -0.846 -3.475 1.00 55.44 H new ATOM 0 HB VAL A 12 -10.211 -2.795 -5.693 1.00 34.14 H new ATOM 0 HG11 VAL A 12 -8.109 -3.131 -4.441 1.00 31.23 H new ATOM 0 HG12 VAL A 12 -8.273 -1.455 -5.017 1.00 31.23 H new ATOM 0 HG13 VAL A 12 -8.583 -1.843 -3.308 1.00 31.23 H new ATOM 0 HG21 VAL A 12 -10.093 -4.434 -3.848 1.00 41.41 H new ATOM 0 HG22 VAL A 12 -10.640 -3.179 -2.711 1.00 41.41 H new ATOM 0 HG23 VAL A 12 -11.723 -3.738 -4.007 1.00 41.41 H new ATOM 171 N ARG A 13 -10.800 -0.141 -6.682 1.00 11.24 N ATOM 172 CA ARG A 13 -10.341 0.837 -7.654 1.00 63.54 C ATOM 173 C ARG A 13 -10.899 2.217 -7.321 1.00 14.14 C ATOM 174 O ARG A 13 -10.214 3.235 -7.487 1.00 52.43 O ATOM 175 CB ARG A 13 -10.695 0.404 -9.076 1.00 43.41 C ATOM 176 CG ARG A 13 -10.010 -0.891 -9.486 1.00 65.52 C ATOM 177 CD ARG A 13 -10.340 -1.303 -10.913 1.00 62.03 C ATOM 178 NE ARG A 13 -11.771 -1.574 -11.112 1.00 5.23 N ATOM 179 CZ ARG A 13 -12.277 -2.747 -11.523 1.00 20.44 C ATOM 180 NH1 ARG A 13 -11.491 -3.814 -11.650 1.00 64.42 N ATOM 181 NH2 ARG A 13 -13.566 -2.847 -11.824 1.00 54.13 N ATOM 0 H ARG A 13 -11.422 -0.854 -7.062 1.00 11.24 H new ATOM 0 HA ARG A 13 -9.254 0.898 -7.602 1.00 63.54 H new ATOM 0 HB2 ARG A 13 -11.775 0.279 -9.155 1.00 43.41 H new ATOM 0 HB3 ARG A 13 -10.414 1.194 -9.772 1.00 43.41 H new ATOM 0 HG2 ARG A 13 -8.931 -0.774 -9.386 1.00 65.52 H new ATOM 0 HG3 ARG A 13 -10.309 -1.687 -8.804 1.00 65.52 H new ATOM 0 HD2 ARG A 13 -10.026 -0.514 -11.596 1.00 62.03 H new ATOM 0 HD3 ARG A 13 -9.767 -2.194 -11.171 1.00 62.03 H new ATOM 0 HE ARG A 13 -12.427 -0.816 -10.924 1.00 5.23 H new ATOM 0 HH11 ARG A 13 -10.497 -3.743 -11.434 1.00 64.42 H new ATOM 0 HH12 ARG A 13 -11.883 -4.702 -11.963 1.00 64.42 H new ATOM 0 HH21 ARG A 13 -14.173 -2.032 -11.743 1.00 54.13 H new ATOM 0 HH22 ARG A 13 -13.949 -3.739 -12.136 1.00 54.13 H new ATOM 195 N GLY A 14 -12.117 2.237 -6.803 1.00 74.51 N ATOM 196 CA GLY A 14 -12.728 3.464 -6.347 1.00 15.44 C ATOM 197 C GLY A 14 -11.974 4.049 -5.173 1.00 62.32 C ATOM 198 O GLY A 14 -11.727 5.253 -5.126 1.00 31.34 O ATOM 0 H GLY A 14 -12.701 1.408 -6.690 1.00 74.51 H new ATOM 0 HA2 GLY A 14 -12.752 4.186 -7.163 1.00 15.44 H new ATOM 0 HA3 GLY A 14 -13.762 3.273 -6.060 1.00 15.44 H new ATOM 202 N ALA A 15 -11.578 3.186 -4.240 1.00 3.00 N ATOM 203 CA ALA A 15 -10.793 3.597 -3.082 1.00 30.21 C ATOM 204 C ALA A 15 -9.399 4.086 -3.506 1.00 64.21 C ATOM 205 O ALA A 15 -8.857 5.026 -2.921 1.00 64.40 O ATOM 206 CB ALA A 15 -10.690 2.460 -2.079 1.00 33.12 C ATOM 0 H ALA A 15 -11.791 2.189 -4.266 1.00 3.00 H new ATOM 0 HA ALA A 15 -11.304 4.431 -2.602 1.00 30.21 H new ATOM 0 HB1 ALA A 15 -10.101 2.784 -1.221 1.00 33.12 H new ATOM 0 HB2 ALA A 15 -11.689 2.176 -1.747 1.00 33.12 H new ATOM 0 HB3 ALA A 15 -10.206 1.603 -2.549 1.00 33.12 H new ATOM 212 N ILE A 16 -8.830 3.449 -4.527 1.00 55.31 N ATOM 213 CA ILE A 16 -7.549 3.875 -5.095 1.00 11.42 C ATOM 214 C ILE A 16 -7.689 5.303 -5.640 1.00 64.33 C ATOM 215 O ILE A 16 -6.859 6.173 -5.378 1.00 41.33 O ATOM 216 CB ILE A 16 -7.069 2.906 -6.235 1.00 33.21 C ATOM 217 CG1 ILE A 16 -6.795 1.487 -5.693 1.00 64.02 C ATOM 218 CG2 ILE A 16 -5.841 3.444 -6.959 1.00 64.24 C ATOM 219 CD1 ILE A 16 -5.725 1.408 -4.613 1.00 71.21 C ATOM 0 H ILE A 16 -9.237 2.631 -4.981 1.00 55.31 H new ATOM 0 HA ILE A 16 -6.797 3.849 -4.306 1.00 11.42 H new ATOM 0 HB ILE A 16 -7.883 2.845 -6.957 1.00 33.21 H new ATOM 0 HG12 ILE A 16 -7.724 1.081 -5.293 1.00 64.02 H new ATOM 0 HG13 ILE A 16 -6.499 0.847 -6.524 1.00 64.02 H new ATOM 0 HG21 ILE A 16 -5.543 2.744 -7.739 1.00 64.24 H new ATOM 0 HG22 ILE A 16 -6.077 4.409 -7.408 1.00 64.24 H new ATOM 0 HG23 ILE A 16 -5.024 3.565 -6.248 1.00 64.24 H new ATOM 0 HD11 ILE A 16 -5.604 0.372 -4.296 1.00 71.21 H new ATOM 0 HD12 ILE A 16 -4.780 1.779 -5.009 1.00 71.21 H new ATOM 0 HD13 ILE A 16 -6.024 2.016 -3.759 1.00 71.21 H new ATOM 231 N ASP A 17 -8.779 5.537 -6.347 1.00 42.31 N ATOM 232 CA ASP A 17 -9.100 6.852 -6.910 1.00 3.23 C ATOM 233 C ASP A 17 -9.356 7.868 -5.806 1.00 62.44 C ATOM 234 O ASP A 17 -8.952 9.032 -5.894 1.00 43.51 O ATOM 235 CB ASP A 17 -10.324 6.746 -7.824 1.00 55.33 C ATOM 236 CG ASP A 17 -10.870 8.089 -8.232 1.00 0.40 C ATOM 237 OD1 ASP A 17 -10.259 8.765 -9.079 1.00 41.12 O ATOM 238 OD2 ASP A 17 -11.941 8.482 -7.722 1.00 43.50 O ATOM 0 H ASP A 17 -9.476 4.821 -6.553 1.00 42.31 H new ATOM 0 HA ASP A 17 -8.246 7.193 -7.495 1.00 3.23 H new ATOM 0 HB2 ASP A 17 -10.056 6.182 -8.717 1.00 55.33 H new ATOM 0 HB3 ASP A 17 -11.105 6.182 -7.313 1.00 55.33 H new ATOM 243 N ASP A 18 -9.992 7.403 -4.767 1.00 50.21 N ATOM 244 CA ASP A 18 -10.331 8.200 -3.601 1.00 55.35 C ATOM 245 C ASP A 18 -9.051 8.725 -2.939 1.00 54.33 C ATOM 246 O ASP A 18 -8.952 9.905 -2.575 1.00 1.25 O ATOM 247 CB ASP A 18 -11.109 7.323 -2.624 1.00 4.30 C ATOM 248 CG ASP A 18 -11.768 8.082 -1.524 1.00 51.23 C ATOM 249 OD1 ASP A 18 -11.100 8.480 -0.588 1.00 65.30 O ATOM 250 OD2 ASP A 18 -12.998 8.254 -1.567 1.00 13.34 O ATOM 0 H ASP A 18 -10.301 6.434 -4.697 1.00 50.21 H new ATOM 0 HA ASP A 18 -10.941 9.054 -3.895 1.00 55.35 H new ATOM 0 HB2 ASP A 18 -11.868 6.768 -3.175 1.00 4.30 H new ATOM 0 HB3 ASP A 18 -10.430 6.589 -2.190 1.00 4.30 H new ATOM 255 N LEU A 19 -8.066 7.847 -2.832 1.00 21.24 N ATOM 256 CA LEU A 19 -6.759 8.169 -2.268 1.00 73.22 C ATOM 257 C LEU A 19 -6.001 9.124 -3.227 1.00 54.32 C ATOM 258 O LEU A 19 -5.330 10.068 -2.787 1.00 54.55 O ATOM 259 CB LEU A 19 -5.991 6.839 -2.004 1.00 42.44 C ATOM 260 CG LEU A 19 -4.657 6.868 -1.206 1.00 60.42 C ATOM 261 CD1 LEU A 19 -4.287 5.472 -0.803 1.00 43.30 C ATOM 262 CD2 LEU A 19 -3.521 7.447 -2.018 1.00 14.41 C ATOM 0 H LEU A 19 -8.150 6.878 -3.138 1.00 21.24 H new ATOM 0 HA LEU A 19 -6.857 8.691 -1.316 1.00 73.22 H new ATOM 0 HB2 LEU A 19 -6.671 6.169 -1.478 1.00 42.44 H new ATOM 0 HB3 LEU A 19 -5.782 6.385 -2.973 1.00 42.44 H new ATOM 0 HG LEU A 19 -4.814 7.501 -0.333 1.00 60.42 H new ATOM 0 HD11 LEU A 19 -3.352 5.491 -0.243 1.00 43.30 H new ATOM 0 HD12 LEU A 19 -5.076 5.053 -0.178 1.00 43.30 H new ATOM 0 HD13 LEU A 19 -4.164 4.856 -1.694 1.00 43.30 H new ATOM 0 HD21 LEU A 19 -2.610 7.447 -1.420 1.00 14.41 H new ATOM 0 HD22 LEU A 19 -3.368 6.843 -2.912 1.00 14.41 H new ATOM 0 HD23 LEU A 19 -3.765 8.469 -2.308 1.00 14.41 H new ATOM 274 N ARG A 20 -6.138 8.885 -4.535 1.00 53.31 N ATOM 275 CA ARG A 20 -5.546 9.760 -5.568 1.00 13.13 C ATOM 276 C ARG A 20 -6.091 11.179 -5.439 1.00 74.30 C ATOM 277 O ARG A 20 -5.347 12.150 -5.495 1.00 14.32 O ATOM 278 CB ARG A 20 -5.816 9.217 -6.983 1.00 4.22 C ATOM 279 CG ARG A 20 -5.091 7.920 -7.311 1.00 11.15 C ATOM 280 CD ARG A 20 -5.554 7.322 -8.634 1.00 3.42 C ATOM 281 NE ARG A 20 -5.299 8.182 -9.803 1.00 15.42 N ATOM 282 CZ ARG A 20 -6.258 8.716 -10.589 1.00 23.42 C ATOM 283 NH1 ARG A 20 -7.534 8.712 -10.204 1.00 35.22 N ATOM 284 NH2 ARG A 20 -5.930 9.266 -11.740 1.00 71.21 N ATOM 0 H ARG A 20 -6.655 8.090 -4.911 1.00 53.31 H new ATOM 0 HA ARG A 20 -4.467 9.777 -5.411 1.00 13.13 H new ATOM 0 HB2 ARG A 20 -6.888 9.058 -7.099 1.00 4.22 H new ATOM 0 HB3 ARG A 20 -5.525 9.975 -7.711 1.00 4.22 H new ATOM 0 HG2 ARG A 20 -4.018 8.106 -7.354 1.00 11.15 H new ATOM 0 HG3 ARG A 20 -5.258 7.200 -6.510 1.00 11.15 H new ATOM 0 HD2 ARG A 20 -5.053 6.366 -8.784 1.00 3.42 H new ATOM 0 HD3 ARG A 20 -6.623 7.116 -8.574 1.00 3.42 H new ATOM 0 HE ARG A 20 -4.328 8.389 -10.035 1.00 15.42 H new ATOM 0 HH11 ARG A 20 -7.795 8.303 -9.307 1.00 35.22 H new ATOM 0 HH12 ARG A 20 -8.250 9.118 -10.806 1.00 35.22 H new ATOM 0 HH21 ARG A 20 -4.954 9.288 -12.035 1.00 71.21 H new ATOM 0 HH22 ARG A 20 -6.652 9.670 -12.336 1.00 71.21 H new ATOM 298 N MET A 21 -7.390 11.283 -5.206 1.00 41.01 N ATOM 299 CA MET A 21 -8.042 12.580 -5.043 1.00 64.40 C ATOM 300 C MET A 21 -7.932 13.099 -3.614 1.00 3.31 C ATOM 301 O MET A 21 -8.552 14.108 -3.252 1.00 62.14 O ATOM 302 CB MET A 21 -9.492 12.545 -5.519 1.00 14.31 C ATOM 303 CG MET A 21 -9.610 12.309 -7.013 1.00 61.11 C ATOM 304 SD MET A 21 -8.677 13.531 -7.960 1.00 74.12 S ATOM 305 CE MET A 21 -8.967 12.960 -9.631 1.00 63.12 C ATOM 0 H MET A 21 -8.018 10.484 -5.125 1.00 41.01 H new ATOM 0 HA MET A 21 -7.508 13.286 -5.679 1.00 64.40 H new ATOM 0 HB2 MET A 21 -10.026 11.758 -4.987 1.00 14.31 H new ATOM 0 HB3 MET A 21 -9.977 13.487 -5.264 1.00 14.31 H new ATOM 0 HG2 MET A 21 -9.248 11.309 -7.253 1.00 61.11 H new ATOM 0 HG3 MET A 21 -10.659 12.346 -7.305 1.00 61.11 H new ATOM 0 HE1 MET A 21 -8.453 13.616 -10.334 1.00 63.12 H new ATOM 0 HE2 MET A 21 -8.588 11.944 -9.739 1.00 63.12 H new ATOM 0 HE3 MET A 21 -10.037 12.972 -9.839 1.00 63.12 H new ATOM 315 N LYS A 22 -7.155 12.383 -2.813 1.00 11.21 N ATOM 316 CA LYS A 22 -6.764 12.763 -1.452 1.00 4.21 C ATOM 317 C LYS A 22 -7.948 12.839 -0.492 1.00 34.54 C ATOM 318 O LYS A 22 -7.924 13.594 0.481 1.00 65.54 O ATOM 319 CB LYS A 22 -5.985 14.089 -1.484 1.00 54.21 C ATOM 320 CG LYS A 22 -4.743 14.107 -0.601 1.00 63.14 C ATOM 321 CD LYS A 22 -3.765 13.008 -1.005 1.00 63.11 C ATOM 322 CE LYS A 22 -3.340 13.116 -2.465 1.00 55.10 C ATOM 323 NZ LYS A 22 -2.483 11.991 -2.861 1.00 3.12 N ATOM 0 H LYS A 22 -6.762 11.486 -3.099 1.00 11.21 H new ATOM 0 HA LYS A 22 -6.117 11.975 -1.066 1.00 4.21 H new ATOM 0 HB2 LYS A 22 -5.689 14.298 -2.512 1.00 54.21 H new ATOM 0 HB3 LYS A 22 -6.650 14.895 -1.173 1.00 54.21 H new ATOM 0 HG2 LYS A 22 -4.254 15.078 -0.676 1.00 63.14 H new ATOM 0 HG3 LYS A 22 -5.032 13.975 0.442 1.00 63.14 H new ATOM 0 HD2 LYS A 22 -2.882 13.059 -0.368 1.00 63.11 H new ATOM 0 HD3 LYS A 22 -4.226 12.035 -0.835 1.00 63.11 H new ATOM 0 HE2 LYS A 22 -4.225 13.142 -3.101 1.00 55.10 H new ATOM 0 HE3 LYS A 22 -2.807 14.054 -2.621 1.00 55.10 H new ATOM 0 HZ1 LYS A 22 -2.049 12.194 -3.784 1.00 3.12 H new ATOM 0 HZ2 LYS A 22 -1.737 11.856 -2.149 1.00 3.12 H new ATOM 0 HZ3 LYS A 22 -3.056 11.126 -2.931 1.00 3.12 H new ATOM 337 N LYS A 23 -8.954 12.044 -0.740 1.00 43.33 N ATOM 338 CA LYS A 23 -10.093 12.000 0.146 1.00 42.22 C ATOM 339 C LYS A 23 -9.780 11.063 1.305 1.00 3.22 C ATOM 340 O LYS A 23 -10.081 11.358 2.464 1.00 33.20 O ATOM 341 CB LYS A 23 -11.363 11.605 -0.612 1.00 1.31 C ATOM 342 CG LYS A 23 -11.756 12.625 -1.674 1.00 41.34 C ATOM 343 CD LYS A 23 -13.007 12.230 -2.450 1.00 61.21 C ATOM 344 CE LYS A 23 -12.785 11.020 -3.349 1.00 44.33 C ATOM 345 NZ LYS A 23 -13.975 10.720 -4.173 1.00 2.41 N ATOM 0 H LYS A 23 -9.011 11.419 -1.544 1.00 43.33 H new ATOM 0 HA LYS A 23 -10.287 12.991 0.555 1.00 42.22 H new ATOM 0 HB2 LYS A 23 -11.212 10.634 -1.085 1.00 1.31 H new ATOM 0 HB3 LYS A 23 -12.183 11.490 0.097 1.00 1.31 H new ATOM 0 HG2 LYS A 23 -11.922 13.591 -1.197 1.00 41.34 H new ATOM 0 HG3 LYS A 23 -10.928 12.751 -2.372 1.00 41.34 H new ATOM 0 HD2 LYS A 23 -13.812 12.013 -1.747 1.00 61.21 H new ATOM 0 HD3 LYS A 23 -13.334 13.074 -3.058 1.00 61.21 H new ATOM 0 HE2 LYS A 23 -11.930 11.203 -3.999 1.00 44.33 H new ATOM 0 HE3 LYS A 23 -12.540 10.153 -2.736 1.00 44.33 H new ATOM 0 HZ1 LYS A 23 -13.783 9.890 -4.770 1.00 2.41 H new ATOM 0 HZ2 LYS A 23 -14.785 10.520 -3.553 1.00 2.41 H new ATOM 0 HZ3 LYS A 23 -14.194 11.538 -4.777 1.00 2.41 H new ATOM 359 N SER A 24 -9.164 9.951 0.993 1.00 51.40 N ATOM 360 CA SER A 24 -8.652 9.061 1.998 1.00 3.42 C ATOM 361 C SER A 24 -7.142 9.270 2.122 1.00 52.13 C ATOM 362 O SER A 24 -6.562 10.093 1.411 1.00 60.51 O ATOM 363 CB SER A 24 -8.977 7.602 1.657 1.00 65.15 C ATOM 364 OG SER A 24 -10.382 7.405 1.592 1.00 52.42 O ATOM 0 H SER A 24 -9.004 9.639 0.035 1.00 51.40 H new ATOM 0 HA SER A 24 -9.128 9.283 2.953 1.00 3.42 H new ATOM 0 HB2 SER A 24 -8.522 7.336 0.703 1.00 65.15 H new ATOM 0 HB3 SER A 24 -8.546 6.942 2.410 1.00 65.15 H new ATOM 0 HG SER A 24 -10.679 7.469 0.660 1.00 52.42 H new ATOM 370 N ARG A 25 -6.524 8.561 3.026 1.00 51.54 N ATOM 371 CA ARG A 25 -5.087 8.668 3.230 1.00 4.23 C ATOM 372 C ARG A 25 -4.474 7.298 3.087 1.00 15.22 C ATOM 373 O ARG A 25 -3.390 7.153 2.540 1.00 41.54 O ATOM 374 CB ARG A 25 -4.799 9.240 4.613 1.00 45.32 C ATOM 375 CG ARG A 25 -3.334 9.506 4.970 1.00 42.35 C ATOM 376 CD ARG A 25 -2.686 10.593 4.110 1.00 63.51 C ATOM 377 NE ARG A 25 -1.523 11.157 4.802 1.00 31.23 N ATOM 378 CZ ARG A 25 -0.890 12.288 4.480 1.00 54.34 C ATOM 379 NH1 ARG A 25 -0.924 12.767 3.240 1.00 74.42 N ATOM 380 NH2 ARG A 25 -0.110 12.868 5.387 1.00 2.15 N ATOM 0 H ARG A 25 -6.989 7.895 3.643 1.00 51.54 H new ATOM 0 HA ARG A 25 -4.654 9.338 2.487 1.00 4.23 H new ATOM 0 HB2 ARG A 25 -5.346 10.178 4.711 1.00 45.32 H new ATOM 0 HB3 ARG A 25 -5.208 8.553 5.354 1.00 45.32 H new ATOM 0 HG2 ARG A 25 -3.270 9.797 6.019 1.00 42.35 H new ATOM 0 HG3 ARG A 25 -2.768 8.581 4.861 1.00 42.35 H new ATOM 0 HD2 ARG A 25 -2.381 10.175 3.151 1.00 63.51 H new ATOM 0 HD3 ARG A 25 -3.410 11.380 3.899 1.00 63.51 H new ATOM 0 HE ARG A 25 -1.164 10.638 5.603 1.00 31.23 H new ATOM 0 HH11 ARG A 25 -1.440 12.269 2.515 1.00 74.42 H new ATOM 0 HH12 ARG A 25 -0.434 13.633 3.014 1.00 74.42 H new ATOM 0 HH21 ARG A 25 -0.003 12.449 6.311 1.00 2.15 H new ATOM 0 HH22 ARG A 25 0.381 13.732 5.159 1.00 2.15 H new ATOM 394 N TYR A 26 -5.174 6.287 3.575 1.00 40.33 N ATOM 395 CA TYR A 26 -4.691 4.948 3.427 1.00 53.11 C ATOM 396 C TYR A 26 -5.856 4.038 3.113 1.00 74.44 C ATOM 397 O TYR A 26 -6.983 4.267 3.586 1.00 62.11 O ATOM 398 CB TYR A 26 -3.945 4.454 4.704 1.00 0.21 C ATOM 399 CG TYR A 26 -4.805 3.778 5.762 1.00 32.33 C ATOM 400 CD1 TYR A 26 -5.500 4.513 6.700 1.00 41.31 C ATOM 401 CD2 TYR A 26 -4.914 2.389 5.802 1.00 1.50 C ATOM 402 CE1 TYR A 26 -6.284 3.888 7.649 1.00 32.05 C ATOM 403 CE2 TYR A 26 -5.701 1.763 6.746 1.00 41.52 C ATOM 404 CZ TYR A 26 -6.385 2.522 7.666 1.00 72.24 C ATOM 405 OH TYR A 26 -7.182 1.916 8.620 1.00 4.33 O ATOM 0 H TYR A 26 -6.063 6.377 4.067 1.00 40.33 H new ATOM 0 HA TYR A 26 -3.970 4.929 2.609 1.00 53.11 H new ATOM 0 HB2 TYR A 26 -3.166 3.756 4.398 1.00 0.21 H new ATOM 0 HB3 TYR A 26 -3.446 5.308 5.162 1.00 0.21 H new ATOM 0 HD1 TYR A 26 -5.430 5.591 6.692 1.00 41.31 H new ATOM 0 HD2 TYR A 26 -4.373 1.793 5.082 1.00 1.50 H new ATOM 0 HE1 TYR A 26 -6.819 4.477 8.379 1.00 32.05 H new ATOM 0 HE2 TYR A 26 -5.779 0.686 6.762 1.00 41.52 H new ATOM 0 HH TYR A 26 -7.152 0.944 8.502 1.00 4.33 H new ATOM 415 N VAL A 27 -5.589 3.048 2.332 1.00 33.53 N ATOM 416 CA VAL A 27 -6.528 2.020 2.005 1.00 63.34 C ATOM 417 C VAL A 27 -5.788 0.710 2.184 1.00 14.01 C ATOM 418 O VAL A 27 -4.773 0.474 1.530 1.00 13.02 O ATOM 419 CB VAL A 27 -7.032 2.112 0.524 1.00 75.35 C ATOM 420 CG1 VAL A 27 -8.107 1.073 0.260 1.00 14.15 C ATOM 421 CG2 VAL A 27 -7.556 3.503 0.181 1.00 44.45 C ATOM 0 H VAL A 27 -4.680 2.924 1.886 1.00 33.53 H new ATOM 0 HA VAL A 27 -7.407 2.113 2.643 1.00 63.34 H new ATOM 0 HB VAL A 27 -6.174 1.914 -0.118 1.00 75.35 H new ATOM 0 HG11 VAL A 27 -8.444 1.153 -0.773 1.00 14.15 H new ATOM 0 HG12 VAL A 27 -7.700 0.077 0.433 1.00 14.15 H new ATOM 0 HG13 VAL A 27 -8.949 1.243 0.931 1.00 14.15 H new ATOM 0 HG21 VAL A 27 -7.894 3.519 -0.855 1.00 44.45 H new ATOM 0 HG22 VAL A 27 -8.389 3.750 0.839 1.00 44.45 H new ATOM 0 HG23 VAL A 27 -6.759 4.235 0.314 1.00 44.45 H new ATOM 431 N MET A 28 -6.218 -0.094 3.102 1.00 3.22 N ATOM 432 CA MET A 28 -5.580 -1.366 3.313 1.00 45.03 C ATOM 433 C MET A 28 -6.423 -2.438 2.699 1.00 2.04 C ATOM 434 O MET A 28 -7.635 -2.543 2.993 1.00 65.44 O ATOM 435 CB MET A 28 -5.345 -1.644 4.799 1.00 40.51 C ATOM 436 CG MET A 28 -4.707 -3.005 5.083 1.00 71.40 C ATOM 437 SD MET A 28 -4.397 -3.302 6.840 1.00 12.31 S ATOM 438 CE MET A 28 -3.239 -1.985 7.231 1.00 61.40 C ATOM 0 H MET A 28 -7.006 0.101 3.720 1.00 3.22 H new ATOM 0 HA MET A 28 -4.599 -1.350 2.837 1.00 45.03 H new ATOM 0 HB2 MET A 28 -4.705 -0.862 5.208 1.00 40.51 H new ATOM 0 HB3 MET A 28 -6.298 -1.584 5.325 1.00 40.51 H new ATOM 0 HG2 MET A 28 -5.358 -3.790 4.699 1.00 71.40 H new ATOM 0 HG3 MET A 28 -3.765 -3.077 4.539 1.00 71.40 H new ATOM 0 HE1 MET A 28 -2.721 -2.220 8.160 1.00 61.40 H new ATOM 0 HE2 MET A 28 -2.512 -1.888 6.425 1.00 61.40 H new ATOM 0 HE3 MET A 28 -3.781 -1.046 7.346 1.00 61.40 H new ATOM 448 N MET A 29 -5.828 -3.209 1.839 1.00 43.33 N ATOM 449 CA MET A 29 -6.531 -4.246 1.180 1.00 11.13 C ATOM 450 C MET A 29 -6.025 -5.570 1.654 1.00 41.32 C ATOM 451 O MET A 29 -4.916 -5.669 2.170 1.00 4.53 O ATOM 452 CB MET A 29 -6.394 -4.168 -0.350 1.00 74.03 C ATOM 453 CG MET A 29 -6.993 -2.932 -1.022 1.00 44.04 C ATOM 454 SD MET A 29 -6.004 -1.435 -0.833 1.00 5.24 S ATOM 455 CE MET A 29 -4.537 -1.856 -1.773 1.00 3.05 C ATOM 0 H MET A 29 -4.844 -3.130 1.581 1.00 43.33 H new ATOM 0 HA MET A 29 -7.587 -4.129 1.422 1.00 11.13 H new ATOM 0 HB2 MET A 29 -5.334 -4.214 -0.601 1.00 74.03 H new ATOM 0 HB3 MET A 29 -6.863 -5.053 -0.781 1.00 74.03 H new ATOM 0 HG2 MET A 29 -7.122 -3.137 -2.085 1.00 44.04 H new ATOM 0 HG3 MET A 29 -7.986 -2.753 -0.609 1.00 44.04 H new ATOM 0 HE1 MET A 29 -3.656 -1.752 -1.139 1.00 3.05 H new ATOM 0 HE2 MET A 29 -4.612 -2.885 -2.123 1.00 3.05 H new ATOM 0 HE3 MET A 29 -4.449 -1.187 -2.629 1.00 3.05 H new ATOM 465 N CYS A 30 -6.836 -6.554 1.491 1.00 21.24 N ATOM 466 CA CYS A 30 -6.534 -7.908 1.800 1.00 21.12 C ATOM 467 C CYS A 30 -7.416 -8.721 0.876 1.00 53.11 C ATOM 468 O CYS A 30 -8.338 -8.157 0.257 1.00 72.04 O ATOM 469 CB CYS A 30 -6.824 -8.209 3.290 1.00 0.54 C ATOM 470 SG CYS A 30 -6.282 -9.841 3.871 1.00 62.01 S ATOM 0 H CYS A 30 -7.778 -6.431 1.119 1.00 21.24 H new ATOM 0 HA CYS A 30 -5.480 -8.145 1.655 1.00 21.12 H new ATOM 0 HB2 CYS A 30 -6.340 -7.446 3.899 1.00 0.54 H new ATOM 0 HB3 CYS A 30 -7.897 -8.119 3.460 1.00 0.54 H new ATOM 0 HG CYS A 30 -5.070 -9.757 4.333 1.00 62.01 H new ATOM 476 N ILE A 31 -7.157 -9.978 0.746 1.00 43.34 N ATOM 477 CA ILE A 31 -7.916 -10.796 -0.168 1.00 52.42 C ATOM 478 C ILE A 31 -9.085 -11.412 0.588 1.00 40.53 C ATOM 479 O ILE A 31 -9.041 -11.512 1.822 1.00 14.31 O ATOM 480 CB ILE A 31 -7.034 -11.919 -0.791 1.00 74.34 C ATOM 481 CG1 ILE A 31 -5.709 -11.339 -1.292 1.00 74.22 C ATOM 482 CG2 ILE A 31 -7.762 -12.574 -1.964 1.00 45.43 C ATOM 483 CD1 ILE A 31 -4.771 -12.376 -1.859 1.00 4.45 C ATOM 0 H ILE A 31 -6.426 -10.472 1.258 1.00 43.34 H new ATOM 0 HA ILE A 31 -8.279 -10.172 -0.985 1.00 52.42 H new ATOM 0 HB ILE A 31 -6.838 -12.664 -0.020 1.00 74.34 H new ATOM 0 HG12 ILE A 31 -5.916 -10.591 -2.058 1.00 74.22 H new ATOM 0 HG13 ILE A 31 -5.213 -10.824 -0.469 1.00 74.22 H new ATOM 0 HG21 ILE A 31 -7.135 -13.357 -2.390 1.00 45.43 H new ATOM 0 HG22 ILE A 31 -8.698 -13.009 -1.614 1.00 45.43 H new ATOM 0 HG23 ILE A 31 -7.973 -11.824 -2.726 1.00 45.43 H new ATOM 0 HD11 ILE A 31 -3.853 -11.892 -2.194 1.00 4.45 H new ATOM 0 HD12 ILE A 31 -4.534 -13.111 -1.090 1.00 4.45 H new ATOM 0 HD13 ILE A 31 -5.247 -12.875 -2.703 1.00 4.45 H new ATOM 495 N GLY A 32 -10.149 -11.742 -0.120 1.00 74.11 N ATOM 496 CA GLY A 32 -11.271 -12.426 0.487 1.00 71.42 C ATOM 497 C GLY A 32 -10.871 -13.805 1.019 1.00 71.42 C ATOM 498 O GLY A 32 -9.797 -14.320 0.683 1.00 73.05 O ATOM 0 H GLY A 32 -10.258 -11.547 -1.115 1.00 74.11 H new ATOM 0 HA2 GLY A 32 -11.668 -11.822 1.303 1.00 71.42 H new ATOM 0 HA3 GLY A 32 -12.070 -12.536 -0.246 1.00 71.42 H new ATOM 502 N ALA A 33 -11.754 -14.410 1.787 1.00 21.54 N ATOM 503 CA ALA A 33 -11.483 -15.663 2.497 1.00 63.30 C ATOM 504 C ALA A 33 -11.084 -16.851 1.595 1.00 52.51 C ATOM 505 O ALA A 33 -10.387 -17.755 2.044 1.00 64.13 O ATOM 506 CB ALA A 33 -12.665 -16.034 3.378 1.00 12.13 C ATOM 0 H ALA A 33 -12.695 -14.048 1.944 1.00 21.54 H new ATOM 0 HA ALA A 33 -10.603 -15.465 3.109 1.00 63.30 H new ATOM 0 HB1 ALA A 33 -12.451 -16.967 3.900 1.00 12.13 H new ATOM 0 HB2 ALA A 33 -12.839 -15.242 4.106 1.00 12.13 H new ATOM 0 HB3 ALA A 33 -13.554 -16.160 2.760 1.00 12.13 H new ATOM 512 N ASP A 34 -11.508 -16.860 0.354 1.00 74.11 N ATOM 513 CA ASP A 34 -11.175 -17.983 -0.537 1.00 54.25 C ATOM 514 C ASP A 34 -10.038 -17.624 -1.498 1.00 53.14 C ATOM 515 O ASP A 34 -9.392 -18.501 -2.098 1.00 74.31 O ATOM 516 CB ASP A 34 -12.412 -18.470 -1.300 1.00 42.44 C ATOM 517 CG ASP A 34 -12.155 -19.731 -2.105 1.00 64.24 C ATOM 518 OD1 ASP A 34 -11.910 -20.796 -1.493 1.00 22.22 O ATOM 519 OD2 ASP A 34 -12.229 -19.692 -3.348 1.00 13.04 O ATOM 0 H ASP A 34 -12.074 -16.125 -0.070 1.00 74.11 H new ATOM 0 HA ASP A 34 -10.824 -18.803 0.090 1.00 54.25 H new ATOM 0 HB2 ASP A 34 -13.219 -18.656 -0.591 1.00 42.44 H new ATOM 0 HB3 ASP A 34 -12.752 -17.681 -1.970 1.00 42.44 H new ATOM 524 N GLY A 35 -9.754 -16.350 -1.603 1.00 53.34 N ATOM 525 CA GLY A 35 -8.692 -15.905 -2.480 1.00 20.34 C ATOM 526 C GLY A 35 -9.216 -15.444 -3.821 1.00 42.03 C ATOM 527 O GLY A 35 -8.501 -15.477 -4.823 1.00 45.14 O ATOM 0 H GLY A 35 -10.236 -15.606 -1.099 1.00 53.34 H new ATOM 0 HA2 GLY A 35 -8.148 -15.089 -2.004 1.00 20.34 H new ATOM 0 HA3 GLY A 35 -7.981 -16.718 -2.629 1.00 20.34 H new ATOM 531 N LYS A 36 -10.458 -15.020 -3.833 1.00 13.12 N ATOM 532 CA LYS A 36 -11.121 -14.574 -5.048 1.00 34.42 C ATOM 533 C LYS A 36 -10.711 -13.150 -5.419 1.00 21.42 C ATOM 534 O LYS A 36 -10.012 -12.920 -6.408 1.00 23.03 O ATOM 535 CB LYS A 36 -12.639 -14.649 -4.872 1.00 44.34 C ATOM 536 CG LYS A 36 -13.153 -16.047 -4.573 1.00 52.33 C ATOM 537 CD LYS A 36 -14.619 -16.047 -4.151 1.00 21.44 C ATOM 538 CE LYS A 36 -15.541 -15.512 -5.233 1.00 21.15 C ATOM 539 NZ LYS A 36 -16.950 -15.462 -4.782 1.00 52.33 N ATOM 0 H LYS A 36 -11.044 -14.972 -3.000 1.00 13.12 H new ATOM 0 HA LYS A 36 -10.814 -15.235 -5.859 1.00 34.42 H new ATOM 0 HB2 LYS A 36 -12.935 -13.982 -4.062 1.00 44.34 H new ATOM 0 HB3 LYS A 36 -13.119 -14.282 -5.779 1.00 44.34 H new ATOM 0 HG2 LYS A 36 -13.032 -16.673 -5.457 1.00 52.33 H new ATOM 0 HG3 LYS A 36 -12.550 -16.492 -3.782 1.00 52.33 H new ATOM 0 HD2 LYS A 36 -14.919 -17.063 -3.894 1.00 21.44 H new ATOM 0 HD3 LYS A 36 -14.734 -15.443 -3.251 1.00 21.44 H new ATOM 0 HE2 LYS A 36 -15.217 -14.513 -5.524 1.00 21.15 H new ATOM 0 HE3 LYS A 36 -15.465 -16.143 -6.119 1.00 21.15 H new ATOM 0 HZ1 LYS A 36 -17.547 -15.091 -5.549 1.00 52.33 H new ATOM 0 HZ2 LYS A 36 -17.267 -16.419 -4.528 1.00 52.33 H new ATOM 0 HZ3 LYS A 36 -17.027 -14.840 -3.952 1.00 52.33 H new ATOM 553 N LYS A 37 -11.121 -12.194 -4.643 1.00 4.43 N ATOM 554 CA LYS A 37 -10.814 -10.842 -4.975 1.00 62.42 C ATOM 555 C LYS A 37 -10.232 -10.081 -3.821 1.00 33.22 C ATOM 556 O LYS A 37 -10.427 -10.447 -2.651 1.00 55.21 O ATOM 557 CB LYS A 37 -12.017 -10.114 -5.660 1.00 64.12 C ATOM 558 CG LYS A 37 -13.377 -10.155 -4.936 1.00 1.40 C ATOM 559 CD LYS A 37 -13.425 -9.303 -3.670 1.00 41.13 C ATOM 560 CE LYS A 37 -14.816 -9.332 -3.054 1.00 24.32 C ATOM 561 NZ LYS A 37 -14.914 -8.489 -1.848 1.00 14.44 N ATOM 0 H LYS A 37 -11.661 -12.324 -3.788 1.00 4.43 H new ATOM 0 HA LYS A 37 -10.023 -10.874 -5.724 1.00 62.42 H new ATOM 0 HB2 LYS A 37 -11.742 -9.069 -5.801 1.00 64.12 H new ATOM 0 HB3 LYS A 37 -12.151 -10.545 -6.652 1.00 64.12 H new ATOM 0 HG2 LYS A 37 -14.154 -9.815 -5.621 1.00 1.40 H new ATOM 0 HG3 LYS A 37 -13.610 -11.188 -4.677 1.00 1.40 H new ATOM 0 HD2 LYS A 37 -12.695 -9.672 -2.949 1.00 41.13 H new ATOM 0 HD3 LYS A 37 -13.148 -8.276 -3.906 1.00 41.13 H new ATOM 0 HE2 LYS A 37 -15.544 -8.993 -3.791 1.00 24.32 H new ATOM 0 HE3 LYS A 37 -15.076 -10.359 -2.798 1.00 24.32 H new ATOM 0 HZ1 LYS A 37 -15.859 -8.594 -1.427 1.00 14.44 H new ATOM 0 HZ2 LYS A 37 -14.193 -8.784 -1.159 1.00 14.44 H new ATOM 0 HZ3 LYS A 37 -14.759 -7.494 -2.107 1.00 14.44 H new ATOM 575 N ILE A 38 -9.481 -9.069 -4.152 1.00 44.52 N ATOM 576 CA ILE A 38 -8.910 -8.187 -3.186 1.00 54.24 C ATOM 577 C ILE A 38 -9.971 -7.186 -2.831 1.00 1.11 C ATOM 578 O ILE A 38 -10.658 -6.671 -3.723 1.00 25.03 O ATOM 579 CB ILE A 38 -7.658 -7.451 -3.747 1.00 3.54 C ATOM 580 CG1 ILE A 38 -6.579 -8.456 -4.152 1.00 25.40 C ATOM 581 CG2 ILE A 38 -7.110 -6.461 -2.737 1.00 31.14 C ATOM 582 CD1 ILE A 38 -5.299 -7.824 -4.679 1.00 62.52 C ATOM 0 H ILE A 38 -9.247 -8.834 -5.117 1.00 44.52 H new ATOM 0 HA ILE A 38 -8.581 -8.754 -2.315 1.00 54.24 H new ATOM 0 HB ILE A 38 -7.964 -6.895 -4.633 1.00 3.54 H new ATOM 0 HG12 ILE A 38 -6.335 -9.077 -3.290 1.00 25.40 H new ATOM 0 HG13 ILE A 38 -6.985 -9.118 -4.917 1.00 25.40 H new ATOM 0 HG21 ILE A 38 -6.236 -5.961 -3.155 1.00 31.14 H new ATOM 0 HG22 ILE A 38 -7.874 -5.720 -2.502 1.00 31.14 H new ATOM 0 HG23 ILE A 38 -6.825 -6.989 -1.827 1.00 31.14 H new ATOM 0 HD11 ILE A 38 -4.588 -8.607 -4.943 1.00 62.52 H new ATOM 0 HD12 ILE A 38 -5.525 -7.227 -5.562 1.00 62.52 H new ATOM 0 HD13 ILE A 38 -4.866 -7.185 -3.910 1.00 62.52 H new ATOM 594 N GLU A 39 -10.133 -6.941 -1.575 1.00 24.30 N ATOM 595 CA GLU A 39 -11.138 -6.053 -1.113 1.00 3.14 C ATOM 596 C GLU A 39 -10.582 -5.065 -0.124 1.00 52.34 C ATOM 597 O GLU A 39 -9.547 -5.319 0.528 1.00 25.12 O ATOM 598 CB GLU A 39 -12.292 -6.844 -0.509 1.00 24.20 C ATOM 599 CG GLU A 39 -11.889 -7.869 0.538 1.00 33.44 C ATOM 600 CD GLU A 39 -13.074 -8.627 1.042 1.00 60.44 C ATOM 601 OE1 GLU A 39 -13.648 -9.423 0.280 1.00 35.14 O ATOM 602 OE2 GLU A 39 -13.495 -8.400 2.184 1.00 13.21 O ATOM 0 H GLU A 39 -9.566 -7.356 -0.836 1.00 24.30 H new ATOM 0 HA GLU A 39 -11.513 -5.483 -1.963 1.00 3.14 H new ATOM 0 HB2 GLU A 39 -12.996 -6.144 -0.059 1.00 24.20 H new ATOM 0 HB3 GLU A 39 -12.821 -7.356 -1.312 1.00 24.20 H new ATOM 0 HG2 GLU A 39 -11.166 -8.563 0.110 1.00 33.44 H new ATOM 0 HG3 GLU A 39 -11.395 -7.367 1.370 1.00 33.44 H new ATOM 609 N VAL A 40 -11.247 -3.940 -0.028 1.00 41.01 N ATOM 610 CA VAL A 40 -10.905 -2.925 0.918 1.00 44.43 C ATOM 611 C VAL A 40 -11.245 -3.458 2.289 1.00 61.22 C ATOM 612 O VAL A 40 -12.403 -3.770 2.584 1.00 44.32 O ATOM 613 CB VAL A 40 -11.677 -1.598 0.652 1.00 60.33 C ATOM 614 CG1 VAL A 40 -11.319 -0.538 1.685 1.00 11.33 C ATOM 615 CG2 VAL A 40 -11.389 -1.084 -0.750 1.00 73.21 C ATOM 0 H VAL A 40 -12.049 -3.708 -0.614 1.00 41.01 H new ATOM 0 HA VAL A 40 -9.844 -2.691 0.835 1.00 44.43 H new ATOM 0 HB VAL A 40 -12.743 -1.809 0.736 1.00 60.33 H new ATOM 0 HG11 VAL A 40 -11.873 0.377 1.474 1.00 11.33 H new ATOM 0 HG12 VAL A 40 -11.578 -0.898 2.681 1.00 11.33 H new ATOM 0 HG13 VAL A 40 -10.249 -0.333 1.641 1.00 11.33 H new ATOM 0 HG21 VAL A 40 -11.937 -0.157 -0.917 1.00 73.21 H new ATOM 0 HG22 VAL A 40 -10.320 -0.898 -0.857 1.00 73.21 H new ATOM 0 HG23 VAL A 40 -11.703 -1.828 -1.482 1.00 73.21 H new ATOM 625 N THR A 41 -10.246 -3.630 3.087 1.00 64.33 N ATOM 626 CA THR A 41 -10.414 -4.172 4.391 1.00 10.41 C ATOM 627 C THR A 41 -10.677 -3.037 5.379 1.00 0.34 C ATOM 628 O THR A 41 -11.562 -3.121 6.230 1.00 75.03 O ATOM 629 CB THR A 41 -9.150 -4.953 4.739 1.00 42.21 C ATOM 630 OG1 THR A 41 -8.834 -5.765 3.600 1.00 54.32 O ATOM 631 CG2 THR A 41 -9.371 -5.860 5.933 1.00 62.43 C ATOM 0 H THR A 41 -9.282 -3.396 2.850 1.00 64.33 H new ATOM 0 HA THR A 41 -11.268 -4.848 4.437 1.00 10.41 H new ATOM 0 HB THR A 41 -8.348 -4.258 4.989 1.00 42.21 H new ATOM 0 HG1 THR A 41 -9.499 -6.479 3.513 1.00 54.32 H new ATOM 0 HG21 THR A 41 -8.451 -6.401 6.154 1.00 62.43 H new ATOM 0 HG22 THR A 41 -9.656 -5.260 6.798 1.00 62.43 H new ATOM 0 HG23 THR A 41 -10.165 -6.571 5.707 1.00 62.43 H new ATOM 639 N GLU A 42 -9.951 -1.956 5.209 1.00 53.04 N ATOM 640 CA GLU A 42 -10.101 -0.785 6.031 1.00 12.20 C ATOM 641 C GLU A 42 -9.593 0.421 5.269 1.00 4.41 C ATOM 642 O GLU A 42 -8.615 0.319 4.509 1.00 31.33 O ATOM 643 CB GLU A 42 -9.369 -0.962 7.372 1.00 62.34 C ATOM 644 CG GLU A 42 -7.912 -1.345 7.236 1.00 14.44 C ATOM 645 CD GLU A 42 -7.248 -1.568 8.557 1.00 75.52 C ATOM 646 OE1 GLU A 42 -7.279 -2.703 9.065 1.00 5.43 O ATOM 647 OE2 GLU A 42 -6.677 -0.614 9.123 1.00 72.15 O ATOM 0 H GLU A 42 -9.234 -1.867 4.489 1.00 53.04 H new ATOM 0 HA GLU A 42 -11.155 -0.632 6.264 1.00 12.20 H new ATOM 0 HB2 GLU A 42 -9.438 -0.032 7.936 1.00 62.34 H new ATOM 0 HB3 GLU A 42 -9.882 -1.727 7.955 1.00 62.34 H new ATOM 0 HG2 GLU A 42 -7.833 -2.252 6.637 1.00 14.44 H new ATOM 0 HG3 GLU A 42 -7.383 -0.560 6.696 1.00 14.44 H new ATOM 654 N VAL A 43 -10.261 1.528 5.421 1.00 11.15 N ATOM 655 CA VAL A 43 -9.890 2.738 4.736 1.00 1.02 C ATOM 656 C VAL A 43 -10.120 3.946 5.638 1.00 54.31 C ATOM 657 O VAL A 43 -11.207 4.116 6.232 1.00 62.34 O ATOM 658 CB VAL A 43 -10.611 2.885 3.345 1.00 11.12 C ATOM 659 CG1 VAL A 43 -12.120 2.801 3.472 1.00 12.32 C ATOM 660 CG2 VAL A 43 -10.218 4.179 2.655 1.00 24.01 C ATOM 0 H VAL A 43 -11.079 1.620 6.023 1.00 11.15 H new ATOM 0 HA VAL A 43 -8.825 2.683 4.511 1.00 1.02 H new ATOM 0 HB VAL A 43 -10.280 2.046 2.733 1.00 11.12 H new ATOM 0 HG11 VAL A 43 -12.575 2.908 2.487 1.00 12.32 H new ATOM 0 HG12 VAL A 43 -12.396 1.836 3.897 1.00 12.32 H new ATOM 0 HG13 VAL A 43 -12.475 3.599 4.124 1.00 12.32 H new ATOM 0 HG21 VAL A 43 -10.733 4.251 1.697 1.00 24.01 H new ATOM 0 HG22 VAL A 43 -10.498 5.025 3.282 1.00 24.01 H new ATOM 0 HG23 VAL A 43 -9.141 4.191 2.490 1.00 24.01 H new ATOM 670 N GLY A 44 -9.097 4.753 5.761 1.00 63.14 N ATOM 671 CA GLY A 44 -9.144 5.898 6.619 1.00 1.22 C ATOM 672 C GLY A 44 -8.614 7.109 5.919 1.00 72.32 C ATOM 673 O GLY A 44 -7.925 6.992 4.881 1.00 45.43 O ATOM 0 H GLY A 44 -8.212 4.631 5.268 1.00 63.14 H new ATOM 0 HA2 GLY A 44 -10.171 6.077 6.938 1.00 1.22 H new ATOM 0 HA3 GLY A 44 -8.559 5.708 7.519 1.00 1.22 H new ATOM 677 N GLU A 45 -8.876 8.254 6.466 1.00 3.44 N ATOM 678 CA GLU A 45 -8.510 9.477 5.832 1.00 51.42 C ATOM 679 C GLU A 45 -7.347 10.191 6.548 1.00 52.14 C ATOM 680 O GLU A 45 -6.566 9.552 7.258 1.00 72.11 O ATOM 681 CB GLU A 45 -9.763 10.352 5.547 1.00 54.40 C ATOM 682 CG GLU A 45 -10.629 10.759 6.736 1.00 72.45 C ATOM 683 CD GLU A 45 -9.981 11.787 7.592 1.00 63.45 C ATOM 684 OE1 GLU A 45 -9.746 12.907 7.093 1.00 11.42 O ATOM 685 OE2 GLU A 45 -9.659 11.495 8.753 1.00 75.42 O ATOM 0 H GLU A 45 -9.349 8.365 7.363 1.00 3.44 H new ATOM 0 HA GLU A 45 -8.094 9.250 4.851 1.00 51.42 H new ATOM 0 HB2 GLU A 45 -9.430 11.262 5.047 1.00 54.40 H new ATOM 0 HB3 GLU A 45 -10.395 9.813 4.841 1.00 54.40 H new ATOM 0 HG2 GLU A 45 -11.582 11.143 6.372 1.00 72.45 H new ATOM 0 HG3 GLU A 45 -10.850 9.878 7.338 1.00 72.45 H new ATOM 692 N ARG A 46 -7.256 11.499 6.374 1.00 12.44 N ATOM 693 CA ARG A 46 -6.086 12.283 6.758 1.00 75.12 C ATOM 694 C ARG A 46 -5.825 12.367 8.275 1.00 40.21 C ATOM 695 O ARG A 46 -4.789 12.891 8.691 1.00 44.13 O ATOM 696 CB ARG A 46 -6.081 13.691 6.092 1.00 43.52 C ATOM 697 CG ARG A 46 -6.050 13.668 4.553 1.00 73.25 C ATOM 698 CD ARG A 46 -7.438 13.472 3.922 1.00 0.13 C ATOM 699 NE ARG A 46 -8.162 14.746 3.733 1.00 1.24 N ATOM 700 CZ ARG A 46 -9.498 14.918 3.838 1.00 32.44 C ATOM 701 NH1 ARG A 46 -10.224 14.143 4.646 1.00 33.25 N ATOM 702 NH2 ARG A 46 -10.079 15.954 3.233 1.00 12.41 N ATOM 0 H ARG A 46 -8.001 12.057 5.957 1.00 12.44 H new ATOM 0 HA ARG A 46 -5.242 11.717 6.364 1.00 75.12 H new ATOM 0 HB2 ARG A 46 -6.967 14.236 6.417 1.00 43.52 H new ATOM 0 HB3 ARG A 46 -5.215 14.247 6.452 1.00 43.52 H new ATOM 0 HG2 ARG A 46 -5.622 14.603 4.191 1.00 73.25 H new ATOM 0 HG3 ARG A 46 -5.391 12.866 4.221 1.00 73.25 H new ATOM 0 HD2 ARG A 46 -7.328 12.975 2.958 1.00 0.13 H new ATOM 0 HD3 ARG A 46 -8.031 12.812 4.555 1.00 0.13 H new ATOM 0 HE ARG A 46 -7.604 15.568 3.503 1.00 1.24 H new ATOM 0 HH11 ARG A 46 -9.771 13.411 5.193 1.00 33.25 H new ATOM 0 HH12 ARG A 46 -11.232 14.283 4.717 1.00 33.25 H new ATOM 0 HH21 ARG A 46 -9.515 16.612 2.694 1.00 12.41 H new ATOM 0 HH22 ARG A 46 -11.087 16.089 3.309 1.00 12.41 H new ATOM 716 N SER A 47 -6.732 11.858 9.091 1.00 60.35 N ATOM 717 CA SER A 47 -6.506 11.832 10.526 1.00 10.25 C ATOM 718 C SER A 47 -5.537 10.706 10.914 1.00 70.05 C ATOM 719 O SER A 47 -4.890 10.767 11.964 1.00 60.41 O ATOM 720 CB SER A 47 -7.826 11.672 11.275 1.00 1.54 C ATOM 721 OG SER A 47 -8.721 12.729 10.947 1.00 51.44 O ATOM 0 H SER A 47 -7.622 11.461 8.789 1.00 60.35 H new ATOM 0 HA SER A 47 -6.055 12.783 10.809 1.00 10.25 H new ATOM 0 HB2 SER A 47 -8.279 10.713 11.023 1.00 1.54 H new ATOM 0 HB3 SER A 47 -7.642 11.665 12.349 1.00 1.54 H new ATOM 0 HG SER A 47 -9.310 12.444 10.217 1.00 51.44 H new ATOM 727 N VAL A 48 -5.420 9.706 10.054 1.00 2.05 N ATOM 728 CA VAL A 48 -4.569 8.561 10.329 1.00 20.15 C ATOM 729 C VAL A 48 -3.117 8.910 10.072 1.00 32.30 C ATOM 730 O VAL A 48 -2.745 9.337 8.972 1.00 61.24 O ATOM 731 CB VAL A 48 -4.983 7.327 9.494 1.00 2.15 C ATOM 732 CG1 VAL A 48 -4.116 6.114 9.835 1.00 0.20 C ATOM 733 CG2 VAL A 48 -6.446 7.017 9.731 1.00 23.04 C ATOM 0 H VAL A 48 -5.905 9.665 9.158 1.00 2.05 H new ATOM 0 HA VAL A 48 -4.692 8.303 11.381 1.00 20.15 H new ATOM 0 HB VAL A 48 -4.832 7.556 8.439 1.00 2.15 H new ATOM 0 HG11 VAL A 48 -4.430 5.261 9.233 1.00 0.20 H new ATOM 0 HG12 VAL A 48 -3.071 6.343 9.624 1.00 0.20 H new ATOM 0 HG13 VAL A 48 -4.228 5.872 10.892 1.00 0.20 H new ATOM 0 HG21 VAL A 48 -6.734 6.147 9.141 1.00 23.04 H new ATOM 0 HG22 VAL A 48 -6.607 6.808 10.789 1.00 23.04 H new ATOM 0 HG23 VAL A 48 -7.052 7.873 9.434 1.00 23.04 H new ATOM 743 N ASN A 49 -2.312 8.750 11.087 1.00 60.14 N ATOM 744 CA ASN A 49 -0.911 9.088 11.018 1.00 44.03 C ATOM 745 C ASN A 49 -0.073 7.830 10.724 1.00 53.30 C ATOM 746 O ASN A 49 -0.555 6.706 10.897 1.00 25.43 O ATOM 747 CB ASN A 49 -0.482 9.746 12.340 1.00 45.43 C ATOM 748 CG ASN A 49 0.916 10.321 12.294 1.00 34.51 C ATOM 749 OD1 ASN A 49 1.882 9.645 12.610 1.00 62.20 O ATOM 750 ND2 ASN A 49 1.034 11.554 11.871 1.00 72.04 N ATOM 0 H ASN A 49 -2.608 8.380 11.990 1.00 60.14 H new ATOM 0 HA ASN A 49 -0.743 9.795 10.205 1.00 44.03 H new ATOM 0 HB2 ASN A 49 -1.186 10.540 12.588 1.00 45.43 H new ATOM 0 HB3 ASN A 49 -0.538 9.008 13.140 1.00 45.43 H new ATOM 0 HD21 ASN A 49 1.957 11.981 11.796 1.00 72.04 H new ATOM 0 HD22 ASN A 49 0.203 12.087 11.616 1.00 72.04 H new ATOM 757 N TYR A 50 1.173 8.040 10.299 1.00 13.31 N ATOM 758 CA TYR A 50 2.124 6.982 9.937 1.00 51.00 C ATOM 759 C TYR A 50 2.276 5.968 11.061 1.00 31.35 C ATOM 760 O TYR A 50 2.034 4.777 10.870 1.00 45.24 O ATOM 761 CB TYR A 50 3.499 7.592 9.647 1.00 42.34 C ATOM 762 CG TYR A 50 3.520 8.625 8.554 1.00 55.02 C ATOM 763 CD1 TYR A 50 3.238 9.963 8.816 1.00 35.32 C ATOM 764 CD2 TYR A 50 3.828 8.267 7.264 1.00 45.32 C ATOM 765 CE1 TYR A 50 3.264 10.902 7.808 1.00 64.52 C ATOM 766 CE2 TYR A 50 3.855 9.200 6.261 1.00 33.23 C ATOM 767 CZ TYR A 50 3.573 10.503 6.530 1.00 52.45 C ATOM 768 OH TYR A 50 3.611 11.411 5.519 1.00 55.42 O ATOM 0 H TYR A 50 1.562 8.977 10.193 1.00 13.31 H new ATOM 0 HA TYR A 50 1.735 6.479 9.052 1.00 51.00 H new ATOM 0 HB2 TYR A 50 3.878 8.046 10.562 1.00 42.34 H new ATOM 0 HB3 TYR A 50 4.187 6.789 9.381 1.00 42.34 H new ATOM 0 HD1 TYR A 50 2.996 10.269 9.823 1.00 35.32 H new ATOM 0 HD2 TYR A 50 4.052 7.235 7.037 1.00 45.32 H new ATOM 0 HE1 TYR A 50 3.044 11.938 8.020 1.00 64.52 H new ATOM 0 HE2 TYR A 50 4.101 8.900 5.253 1.00 33.23 H new ATOM 0 HH TYR A 50 4.535 11.519 5.211 1.00 55.42 H new ATOM 778 N THR A 51 2.642 6.455 12.240 1.00 72.44 N ATOM 779 CA THR A 51 2.855 5.602 13.393 1.00 22.25 C ATOM 780 C THR A 51 1.570 4.858 13.789 1.00 33.20 C ATOM 781 O THR A 51 1.631 3.762 14.341 1.00 31.22 O ATOM 782 CB THR A 51 3.434 6.402 14.613 1.00 20.54 C ATOM 783 OG1 THR A 51 3.661 5.534 15.747 1.00 71.52 O ATOM 784 CG2 THR A 51 2.507 7.537 15.030 1.00 21.02 C ATOM 0 H THR A 51 2.798 7.447 12.419 1.00 72.44 H new ATOM 0 HA THR A 51 3.598 4.859 13.103 1.00 22.25 H new ATOM 0 HB THR A 51 4.385 6.825 14.288 1.00 20.54 H new ATOM 0 HG1 THR A 51 4.023 6.057 16.492 1.00 71.52 H new ATOM 0 HG21 THR A 51 2.941 8.068 15.877 1.00 21.02 H new ATOM 0 HG22 THR A 51 2.379 8.227 14.196 1.00 21.02 H new ATOM 0 HG23 THR A 51 1.538 7.129 15.316 1.00 21.02 H new ATOM 792 N ASP A 52 0.410 5.415 13.431 1.00 44.01 N ATOM 793 CA ASP A 52 -0.856 4.826 13.828 1.00 41.24 C ATOM 794 C ASP A 52 -1.108 3.514 13.120 1.00 11.54 C ATOM 795 O ASP A 52 -1.446 2.531 13.751 1.00 43.41 O ATOM 796 CB ASP A 52 -2.037 5.761 13.615 1.00 55.11 C ATOM 797 CG ASP A 52 -3.305 5.156 14.170 1.00 30.33 C ATOM 798 OD1 ASP A 52 -3.563 5.322 15.374 1.00 75.54 O ATOM 799 OD2 ASP A 52 -4.048 4.472 13.433 1.00 61.03 O ATOM 0 H ASP A 52 0.329 6.265 12.872 1.00 44.01 H new ATOM 0 HA ASP A 52 -0.770 4.641 14.899 1.00 41.24 H new ATOM 0 HB2 ASP A 52 -1.842 6.717 14.100 1.00 55.11 H new ATOM 0 HB3 ASP A 52 -2.160 5.963 12.551 1.00 55.11 H new ATOM 804 N LEU A 53 -0.899 3.481 11.824 1.00 24.55 N ATOM 805 CA LEU A 53 -1.134 2.250 11.083 1.00 1.34 C ATOM 806 C LEU A 53 -0.074 1.192 11.401 1.00 74.11 C ATOM 807 O LEU A 53 -0.304 -0.001 11.258 1.00 44.43 O ATOM 808 CB LEU A 53 -1.330 2.514 9.561 1.00 1.44 C ATOM 809 CG LEU A 53 -0.235 3.287 8.792 1.00 14.53 C ATOM 810 CD1 LEU A 53 1.001 2.436 8.535 1.00 72.32 C ATOM 811 CD2 LEU A 53 -0.793 3.828 7.490 1.00 65.42 C ATOM 0 H LEU A 53 -0.574 4.270 11.265 1.00 24.55 H new ATOM 0 HA LEU A 53 -2.080 1.829 11.422 1.00 1.34 H new ATOM 0 HB2 LEU A 53 -1.457 1.548 9.072 1.00 1.44 H new ATOM 0 HB3 LEU A 53 -2.266 3.059 9.438 1.00 1.44 H new ATOM 0 HG LEU A 53 0.079 4.120 9.421 1.00 14.53 H new ATOM 0 HD11 LEU A 53 1.741 3.024 7.992 1.00 72.32 H new ATOM 0 HD12 LEU A 53 1.423 2.110 9.486 1.00 72.32 H new ATOM 0 HD13 LEU A 53 0.725 1.563 7.943 1.00 72.32 H new ATOM 0 HD21 LEU A 53 -0.012 4.371 6.957 1.00 65.42 H new ATOM 0 HD22 LEU A 53 -1.145 3.001 6.874 1.00 65.42 H new ATOM 0 HD23 LEU A 53 -1.623 4.502 7.702 1.00 65.42 H new ATOM 823 N LYS A 54 1.063 1.649 11.892 1.00 22.53 N ATOM 824 CA LYS A 54 2.148 0.765 12.270 1.00 24.05 C ATOM 825 C LYS A 54 1.902 0.154 13.642 1.00 22.45 C ATOM 826 O LYS A 54 2.338 -0.959 13.921 1.00 23.44 O ATOM 827 CB LYS A 54 3.461 1.508 12.296 1.00 2.02 C ATOM 828 CG LYS A 54 3.880 2.101 10.966 1.00 15.25 C ATOM 829 CD LYS A 54 5.206 2.826 11.092 1.00 32.50 C ATOM 830 CE LYS A 54 6.330 1.870 11.456 1.00 72.23 C ATOM 831 NZ LYS A 54 6.582 0.888 10.389 1.00 74.14 N ATOM 0 H LYS A 54 1.259 2.639 12.039 1.00 22.53 H new ATOM 0 HA LYS A 54 2.193 -0.029 11.525 1.00 24.05 H new ATOM 0 HB2 LYS A 54 3.394 2.310 13.031 1.00 2.02 H new ATOM 0 HB3 LYS A 54 4.241 0.827 12.637 1.00 2.02 H new ATOM 0 HG2 LYS A 54 3.962 1.310 10.220 1.00 15.25 H new ATOM 0 HG3 LYS A 54 3.115 2.793 10.614 1.00 15.25 H new ATOM 0 HD2 LYS A 54 5.441 3.324 10.151 1.00 32.50 H new ATOM 0 HD3 LYS A 54 5.127 3.603 11.853 1.00 32.50 H new ATOM 0 HE2 LYS A 54 7.240 2.437 11.650 1.00 72.23 H new ATOM 0 HE3 LYS A 54 6.078 1.347 12.378 1.00 72.23 H new ATOM 0 HZ1 LYS A 54 7.558 0.537 10.463 1.00 74.14 H new ATOM 0 HZ2 LYS A 54 5.920 0.092 10.486 1.00 74.14 H new ATOM 0 HZ3 LYS A 54 6.446 1.340 9.462 1.00 74.14 H new ATOM 845 N GLU A 55 1.230 0.889 14.508 1.00 4.41 N ATOM 846 CA GLU A 55 0.914 0.386 15.835 1.00 4.14 C ATOM 847 C GLU A 55 -0.314 -0.516 15.781 1.00 43.52 C ATOM 848 O GLU A 55 -0.596 -1.279 16.717 1.00 33.03 O ATOM 849 CB GLU A 55 0.784 1.537 16.857 1.00 11.20 C ATOM 850 CG GLU A 55 -0.281 2.566 16.550 1.00 43.14 C ATOM 851 CD GLU A 55 -1.533 2.416 17.364 1.00 2.24 C ATOM 852 OE1 GLU A 55 -2.379 1.563 17.053 1.00 70.40 O ATOM 853 OE2 GLU A 55 -1.706 3.195 18.313 1.00 2.52 O ATOM 0 H GLU A 55 0.893 1.833 14.319 1.00 4.41 H new ATOM 0 HA GLU A 55 1.742 -0.229 16.188 1.00 4.14 H new ATOM 0 HB2 GLU A 55 0.577 1.107 17.837 1.00 11.20 H new ATOM 0 HB3 GLU A 55 1.745 2.046 16.929 1.00 11.20 H new ATOM 0 HG2 GLU A 55 0.131 3.561 16.718 1.00 43.14 H new ATOM 0 HG3 GLU A 55 -0.538 2.502 15.493 1.00 43.14 H new ATOM 860 N LYS A 56 -1.016 -0.445 14.657 1.00 40.53 N ATOM 861 CA LYS A 56 -2.156 -1.298 14.381 1.00 1.14 C ATOM 862 C LYS A 56 -1.682 -2.618 13.783 1.00 54.12 C ATOM 863 O LYS A 56 -2.505 -3.462 13.428 1.00 61.24 O ATOM 864 CB LYS A 56 -3.125 -0.635 13.376 1.00 44.02 C ATOM 865 CG LYS A 56 -3.817 0.639 13.843 1.00 74.44 C ATOM 866 CD LYS A 56 -4.740 0.394 15.013 1.00 61.10 C ATOM 867 CE LYS A 56 -5.428 1.675 15.463 1.00 31.34 C ATOM 868 NZ LYS A 56 -4.457 2.715 15.856 1.00 32.33 N ATOM 0 H LYS A 56 -0.805 0.213 13.907 1.00 40.53 H new ATOM 0 HA LYS A 56 -2.676 -1.466 15.324 1.00 1.14 H new ATOM 0 HB2 LYS A 56 -2.571 -0.409 12.465 1.00 44.02 H new ATOM 0 HB3 LYS A 56 -3.892 -1.363 13.110 1.00 44.02 H new ATOM 0 HG2 LYS A 56 -3.065 1.376 14.125 1.00 74.44 H new ATOM 0 HG3 LYS A 56 -4.386 1.064 13.017 1.00 74.44 H new ATOM 0 HD2 LYS A 56 -5.492 -0.345 14.735 1.00 61.10 H new ATOM 0 HD3 LYS A 56 -4.172 -0.025 15.843 1.00 61.10 H new ATOM 0 HE2 LYS A 56 -6.056 2.052 14.656 1.00 31.34 H new ATOM 0 HE3 LYS A 56 -6.086 1.457 16.304 1.00 31.34 H new ATOM 0 HZ1 LYS A 56 -4.967 3.558 16.188 1.00 32.33 H new ATOM 0 HZ2 LYS A 56 -3.851 2.354 16.620 1.00 32.33 H new ATOM 0 HZ3 LYS A 56 -3.867 2.967 15.037 1.00 32.33 H new ATOM 882 N PHE A 57 -0.354 -2.779 13.653 1.00 31.53 N ATOM 883 CA PHE A 57 0.233 -3.965 13.056 1.00 65.13 C ATOM 884 C PHE A 57 -0.235 -5.284 13.690 1.00 20.43 C ATOM 885 O PHE A 57 0.118 -5.631 14.812 1.00 42.10 O ATOM 886 CB PHE A 57 1.775 -3.875 13.077 1.00 43.23 C ATOM 887 CG PHE A 57 2.498 -5.111 12.586 1.00 73.41 C ATOM 888 CD1 PHE A 57 2.471 -5.467 11.251 1.00 33.11 C ATOM 889 CD2 PHE A 57 3.202 -5.917 13.472 1.00 23.43 C ATOM 890 CE1 PHE A 57 3.127 -6.596 10.805 1.00 40.43 C ATOM 891 CE2 PHE A 57 3.860 -7.046 13.030 1.00 1.43 C ATOM 892 CZ PHE A 57 3.822 -7.387 11.695 1.00 42.22 C ATOM 0 H PHE A 57 0.330 -2.088 13.961 1.00 31.53 H new ATOM 0 HA PHE A 57 -0.123 -3.986 12.026 1.00 65.13 H new ATOM 0 HB2 PHE A 57 2.082 -3.027 12.465 1.00 43.23 H new ATOM 0 HB3 PHE A 57 2.097 -3.666 14.097 1.00 43.23 H new ATOM 0 HD1 PHE A 57 1.929 -4.853 10.547 1.00 33.11 H new ATOM 0 HD2 PHE A 57 3.235 -5.656 14.520 1.00 23.43 H new ATOM 0 HE1 PHE A 57 3.096 -6.860 9.758 1.00 40.43 H new ATOM 0 HE2 PHE A 57 4.405 -7.662 13.730 1.00 1.43 H new ATOM 0 HZ PHE A 57 4.335 -8.271 11.347 1.00 42.22 H new ATOM 902 N SER A 58 -1.060 -5.962 12.952 1.00 60.41 N ATOM 903 CA SER A 58 -1.445 -7.336 13.167 1.00 74.35 C ATOM 904 C SER A 58 -1.838 -7.767 11.772 1.00 42.13 C ATOM 905 O SER A 58 -2.903 -8.304 11.498 1.00 31.22 O ATOM 906 CB SER A 58 -2.652 -7.398 14.111 1.00 54.30 C ATOM 907 OG SER A 58 -2.392 -6.692 15.334 1.00 31.25 O ATOM 0 H SER A 58 -1.512 -5.553 12.134 1.00 60.41 H new ATOM 0 HA SER A 58 -0.672 -7.957 13.619 1.00 74.35 H new ATOM 0 HB2 SER A 58 -3.524 -6.968 13.619 1.00 54.30 H new ATOM 0 HB3 SER A 58 -2.891 -8.438 14.332 1.00 54.30 H new ATOM 0 HG SER A 58 -3.178 -6.746 15.916 1.00 31.25 H new ATOM 913 N THR A 59 -0.875 -7.595 10.941 1.00 42.14 N ATOM 914 CA THR A 59 -0.973 -7.698 9.528 1.00 1.12 C ATOM 915 C THR A 59 -0.626 -9.092 8.999 1.00 3.55 C ATOM 916 O THR A 59 -0.501 -9.246 7.833 1.00 13.34 O ATOM 917 CB THR A 59 -0.081 -6.599 8.902 1.00 2.51 C ATOM 918 OG1 THR A 59 -0.235 -5.413 9.707 1.00 4.32 O ATOM 919 CG2 THR A 59 -0.520 -6.256 7.476 1.00 23.10 C ATOM 0 H THR A 59 0.069 -7.362 11.251 1.00 42.14 H new ATOM 0 HA THR A 59 -2.012 -7.545 9.236 1.00 1.12 H new ATOM 0 HB THR A 59 0.948 -6.956 8.869 1.00 2.51 H new ATOM 0 HG1 THR A 59 0.320 -4.694 9.339 1.00 4.32 H new ATOM 0 HG21 THR A 59 0.131 -5.481 7.071 1.00 23.10 H new ATOM 0 HG22 THR A 59 -0.455 -7.147 6.851 1.00 23.10 H new ATOM 0 HG23 THR A 59 -1.549 -5.896 7.489 1.00 23.10 H new ATOM 927 N GLU A 60 -0.431 -10.094 9.881 1.00 60.01 N ATOM 928 CA GLU A 60 0.087 -11.437 9.466 1.00 31.54 C ATOM 929 C GLU A 60 -0.672 -12.234 8.343 1.00 13.01 C ATOM 930 O GLU A 60 -0.308 -13.356 8.026 1.00 31.35 O ATOM 931 CB GLU A 60 0.581 -12.306 10.640 1.00 1.23 C ATOM 932 CG GLU A 60 -0.351 -12.458 11.827 1.00 4.42 C ATOM 933 CD GLU A 60 -1.654 -13.147 11.515 1.00 44.43 C ATOM 934 OE1 GLU A 60 -1.684 -14.399 11.460 1.00 11.32 O ATOM 935 OE2 GLU A 60 -2.670 -12.461 11.358 1.00 62.13 O ATOM 0 H GLU A 60 -0.619 -10.011 10.880 1.00 60.01 H new ATOM 0 HA GLU A 60 0.970 -11.135 8.903 1.00 31.54 H new ATOM 0 HB2 GLU A 60 0.803 -13.301 10.254 1.00 1.23 H new ATOM 0 HB3 GLU A 60 1.521 -11.887 10.999 1.00 1.23 H new ATOM 0 HG2 GLU A 60 0.164 -13.018 12.607 1.00 4.42 H new ATOM 0 HG3 GLU A 60 -0.566 -11.470 12.233 1.00 4.42 H new ATOM 942 N LYS A 61 -1.671 -11.629 7.745 1.00 32.33 N ATOM 943 CA LYS A 61 -2.197 -12.067 6.452 1.00 31.51 C ATOM 944 C LYS A 61 -2.041 -10.858 5.506 1.00 3.12 C ATOM 945 O LYS A 61 -3.013 -10.183 5.133 1.00 30.14 O ATOM 946 CB LYS A 61 -3.662 -12.612 6.485 1.00 72.53 C ATOM 947 CG LYS A 61 -4.766 -11.677 7.031 1.00 5.10 C ATOM 948 CD LYS A 61 -4.733 -11.525 8.546 1.00 51.00 C ATOM 949 CE LYS A 61 -4.989 -12.852 9.249 1.00 61.43 C ATOM 950 NZ LYS A 61 -6.287 -13.446 8.866 1.00 0.23 N ATOM 0 H LYS A 61 -2.150 -10.817 8.133 1.00 32.33 H new ATOM 0 HA LYS A 61 -1.634 -12.934 6.107 1.00 31.51 H new ATOM 0 HB2 LYS A 61 -3.936 -12.897 5.469 1.00 72.53 H new ATOM 0 HB3 LYS A 61 -3.667 -13.523 7.084 1.00 72.53 H new ATOM 0 HG2 LYS A 61 -4.660 -10.694 6.572 1.00 5.10 H new ATOM 0 HG3 LYS A 61 -5.740 -12.064 6.733 1.00 5.10 H new ATOM 0 HD2 LYS A 61 -3.763 -11.132 8.852 1.00 51.00 H new ATOM 0 HD3 LYS A 61 -5.484 -10.798 8.856 1.00 51.00 H new ATOM 0 HE2 LYS A 61 -4.187 -13.550 9.008 1.00 61.43 H new ATOM 0 HE3 LYS A 61 -4.965 -12.700 10.328 1.00 61.43 H new ATOM 0 HZ1 LYS A 61 -6.513 -14.232 9.509 1.00 0.23 H new ATOM 0 HZ2 LYS A 61 -7.032 -12.723 8.928 1.00 0.23 H new ATOM 0 HZ3 LYS A 61 -6.231 -13.802 7.891 1.00 0.23 H new ATOM 964 N PRO A 62 -0.778 -10.516 5.173 1.00 23.51 N ATOM 965 CA PRO A 62 -0.454 -9.262 4.563 1.00 65.33 C ATOM 966 C PRO A 62 -0.671 -9.179 3.087 1.00 51.41 C ATOM 967 O PRO A 62 -0.212 -10.006 2.304 1.00 60.34 O ATOM 968 CB PRO A 62 1.035 -9.063 4.888 1.00 72.13 C ATOM 969 CG PRO A 62 1.445 -10.271 5.658 1.00 33.14 C ATOM 970 CD PRO A 62 0.422 -11.320 5.335 1.00 73.11 C ATOM 0 HA PRO A 62 -1.120 -8.492 4.953 1.00 65.33 H new ATOM 0 HB2 PRO A 62 1.624 -8.961 3.977 1.00 72.13 H new ATOM 0 HB3 PRO A 62 1.190 -8.155 5.471 1.00 72.13 H new ATOM 0 HG2 PRO A 62 2.445 -10.597 5.373 1.00 33.14 H new ATOM 0 HG3 PRO A 62 1.470 -10.064 6.728 1.00 33.14 H new ATOM 0 HD2 PRO A 62 0.672 -11.871 4.428 1.00 73.11 H new ATOM 0 HD3 PRO A 62 0.320 -12.053 6.135 1.00 73.11 H new ATOM 978 N CYS A 63 -1.330 -8.145 2.746 1.00 65.41 N ATOM 979 CA CYS A 63 -1.561 -7.722 1.437 1.00 42.12 C ATOM 980 C CYS A 63 -1.038 -6.293 1.419 1.00 63.14 C ATOM 981 O CYS A 63 -0.607 -5.797 2.470 1.00 61.14 O ATOM 982 CB CYS A 63 -3.049 -7.863 1.104 1.00 34.15 C ATOM 983 SG CYS A 63 -3.554 -7.275 -0.537 1.00 75.22 S ATOM 0 H CYS A 63 -1.754 -7.526 3.436 1.00 65.41 H new ATOM 0 HA CYS A 63 -1.060 -8.311 0.669 1.00 42.12 H new ATOM 0 HB2 CYS A 63 -3.323 -8.914 1.192 1.00 34.15 H new ATOM 0 HB3 CYS A 63 -3.623 -7.320 1.855 1.00 34.15 H new ATOM 0 HG CYS A 63 -4.833 -7.455 -0.688 1.00 75.22 H new ATOM 989 N TYR A 64 -1.060 -5.623 0.312 1.00 20.14 N ATOM 990 CA TYR A 64 -0.435 -4.405 0.199 1.00 33.34 C ATOM 991 C TYR A 64 -1.372 -3.285 0.568 1.00 33.35 C ATOM 992 O TYR A 64 -2.586 -3.355 0.346 1.00 63.35 O ATOM 993 CB TYR A 64 -0.112 -4.251 -1.261 1.00 12.23 C ATOM 994 CG TYR A 64 0.198 -5.556 -1.988 1.00 53.03 C ATOM 995 CD1 TYR A 64 1.189 -6.422 -1.555 1.00 41.23 C ATOM 996 CD2 TYR A 64 -0.497 -5.890 -3.124 1.00 51.23 C ATOM 997 CE1 TYR A 64 1.472 -7.563 -2.234 1.00 20.22 C ATOM 998 CE2 TYR A 64 -0.223 -7.037 -3.802 1.00 2.24 C ATOM 999 CZ TYR A 64 0.765 -7.867 -3.355 1.00 33.11 C ATOM 1000 OH TYR A 64 1.063 -8.996 -4.042 1.00 34.14 O ATOM 0 H TYR A 64 -1.529 -5.938 -0.537 1.00 20.14 H new ATOM 0 HA TYR A 64 0.438 -4.364 0.851 1.00 33.34 H new ATOM 0 HB2 TYR A 64 -0.954 -3.767 -1.756 1.00 12.23 H new ATOM 0 HB3 TYR A 64 0.744 -3.583 -1.361 1.00 12.23 H new ATOM 0 HD1 TYR A 64 1.747 -6.185 -0.661 1.00 41.23 H new ATOM 0 HD2 TYR A 64 -1.273 -5.232 -3.485 1.00 51.23 H new ATOM 0 HE1 TYR A 64 2.252 -8.224 -1.887 1.00 20.22 H new ATOM 0 HE2 TYR A 64 -0.784 -7.290 -4.689 1.00 2.24 H new ATOM 0 HH TYR A 64 0.675 -9.770 -3.583 1.00 34.14 H new ATOM 1010 N VAL A 65 -0.785 -2.281 1.157 1.00 41.01 N ATOM 1011 CA VAL A 65 -1.488 -1.134 1.654 1.00 51.34 C ATOM 1012 C VAL A 65 -1.225 0.041 0.736 1.00 33.33 C ATOM 1013 O VAL A 65 -0.071 0.303 0.367 1.00 43.11 O ATOM 1014 CB VAL A 65 -0.998 -0.755 3.087 1.00 40.34 C ATOM 1015 CG1 VAL A 65 -1.838 0.369 3.693 1.00 64.34 C ATOM 1016 CG2 VAL A 65 -0.973 -1.969 4.008 1.00 21.02 C ATOM 0 H VAL A 65 0.223 -2.238 1.308 1.00 41.01 H new ATOM 0 HA VAL A 65 -2.551 -1.372 1.692 1.00 51.34 H new ATOM 0 HB VAL A 65 0.024 -0.388 2.987 1.00 40.34 H new ATOM 0 HG11 VAL A 65 -1.466 0.604 4.690 1.00 64.34 H new ATOM 0 HG12 VAL A 65 -1.770 1.255 3.062 1.00 64.34 H new ATOM 0 HG13 VAL A 65 -2.878 0.050 3.760 1.00 64.34 H new ATOM 0 HG21 VAL A 65 -0.627 -1.668 4.997 1.00 21.02 H new ATOM 0 HG22 VAL A 65 -1.977 -2.387 4.086 1.00 21.02 H new ATOM 0 HG23 VAL A 65 -0.297 -2.721 3.600 1.00 21.02 H new ATOM 1026 N ALA A 66 -2.264 0.709 0.356 1.00 51.25 N ATOM 1027 CA ALA A 66 -2.167 1.898 -0.431 1.00 44.05 C ATOM 1028 C ALA A 66 -2.150 3.059 0.524 1.00 34.40 C ATOM 1029 O ALA A 66 -3.091 3.247 1.292 1.00 24.24 O ATOM 1030 CB ALA A 66 -3.348 1.988 -1.383 1.00 43.23 C ATOM 0 H ALA A 66 -3.221 0.441 0.586 1.00 51.25 H new ATOM 0 HA ALA A 66 -1.262 1.899 -1.038 1.00 44.05 H new ATOM 0 HB1 ALA A 66 -3.266 2.897 -1.979 1.00 43.23 H new ATOM 0 HB2 ALA A 66 -3.350 1.120 -2.043 1.00 43.23 H new ATOM 0 HB3 ALA A 66 -4.276 2.011 -0.811 1.00 43.23 H new ATOM 1036 N PHE A 67 -1.080 3.785 0.542 1.00 15.02 N ATOM 1037 CA PHE A 67 -0.961 4.896 1.443 1.00 70.24 C ATOM 1038 C PHE A 67 -0.422 6.125 0.729 1.00 33.20 C ATOM 1039 O PHE A 67 0.463 6.027 -0.123 1.00 61.21 O ATOM 1040 CB PHE A 67 -0.066 4.497 2.633 1.00 44.44 C ATOM 1041 CG PHE A 67 0.180 5.578 3.650 1.00 21.24 C ATOM 1042 CD1 PHE A 67 -0.843 6.028 4.456 1.00 42.11 C ATOM 1043 CD2 PHE A 67 1.432 6.138 3.800 1.00 15.11 C ATOM 1044 CE1 PHE A 67 -0.631 7.014 5.396 1.00 75.12 C ATOM 1045 CE2 PHE A 67 1.653 7.121 4.734 1.00 71.12 C ATOM 1046 CZ PHE A 67 0.619 7.561 5.536 1.00 52.22 C ATOM 0 H PHE A 67 -0.270 3.632 -0.058 1.00 15.02 H new ATOM 0 HA PHE A 67 -1.950 5.156 1.821 1.00 70.24 H new ATOM 0 HB2 PHE A 67 -0.521 3.645 3.137 1.00 44.44 H new ATOM 0 HB3 PHE A 67 0.896 4.162 2.245 1.00 44.44 H new ATOM 0 HD1 PHE A 67 -1.829 5.600 4.349 1.00 42.11 H new ATOM 0 HD2 PHE A 67 2.247 5.800 3.177 1.00 15.11 H new ATOM 0 HE1 PHE A 67 -1.445 7.354 6.019 1.00 75.12 H new ATOM 0 HE2 PHE A 67 2.638 7.551 4.841 1.00 71.12 H new ATOM 0 HZ PHE A 67 0.794 8.333 6.271 1.00 52.22 H new ATOM 1056 N ASP A 68 -0.997 7.251 1.040 1.00 43.44 N ATOM 1057 CA ASP A 68 -0.537 8.529 0.542 1.00 13.54 C ATOM 1058 C ASP A 68 0.498 9.056 1.505 1.00 62.42 C ATOM 1059 O ASP A 68 0.216 9.258 2.685 1.00 73.32 O ATOM 1060 CB ASP A 68 -1.705 9.502 0.403 1.00 24.35 C ATOM 1061 CG ASP A 68 -1.283 10.902 0.043 1.00 34.04 C ATOM 1062 OD1 ASP A 68 -0.814 11.126 -1.100 1.00 43.23 O ATOM 1063 OD2 ASP A 68 -1.466 11.804 0.875 1.00 34.02 O ATOM 0 H ASP A 68 -1.809 7.315 1.654 1.00 43.44 H new ATOM 0 HA ASP A 68 -0.096 8.414 -0.448 1.00 13.54 H new ATOM 0 HB2 ASP A 68 -2.388 9.130 -0.360 1.00 24.35 H new ATOM 0 HB3 ASP A 68 -2.259 9.528 1.341 1.00 24.35 H new ATOM 1068 N PHE A 69 1.685 9.228 1.020 1.00 32.22 N ATOM 1069 CA PHE A 69 2.810 9.587 1.833 1.00 32.01 C ATOM 1070 C PHE A 69 3.220 11.011 1.527 1.00 2.11 C ATOM 1071 O PHE A 69 3.400 11.373 0.358 1.00 22.31 O ATOM 1072 CB PHE A 69 3.967 8.620 1.509 1.00 52.33 C ATOM 1073 CG PHE A 69 5.189 8.760 2.372 1.00 22.34 C ATOM 1074 CD1 PHE A 69 6.202 9.647 2.043 1.00 44.31 C ATOM 1075 CD2 PHE A 69 5.323 7.994 3.510 1.00 30.13 C ATOM 1076 CE1 PHE A 69 7.318 9.765 2.841 1.00 33.31 C ATOM 1077 CE2 PHE A 69 6.437 8.108 4.312 1.00 5.45 C ATOM 1078 CZ PHE A 69 7.434 8.993 3.978 1.00 31.35 C ATOM 0 H PHE A 69 1.908 9.122 0.030 1.00 32.22 H new ATOM 0 HA PHE A 69 2.555 9.518 2.890 1.00 32.01 H new ATOM 0 HB2 PHE A 69 3.598 7.598 1.595 1.00 52.33 H new ATOM 0 HB3 PHE A 69 4.259 8.767 0.469 1.00 52.33 H new ATOM 0 HD1 PHE A 69 6.115 10.251 1.152 1.00 44.31 H new ATOM 0 HD2 PHE A 69 4.544 7.295 3.776 1.00 30.13 H new ATOM 0 HE1 PHE A 69 8.101 10.461 2.577 1.00 33.31 H new ATOM 0 HE2 PHE A 69 6.527 7.503 5.202 1.00 5.45 H new ATOM 0 HZ PHE A 69 8.308 9.084 4.606 1.00 31.35 H new ATOM 1088 N GLU A 70 3.372 11.822 2.540 1.00 42.21 N ATOM 1089 CA GLU A 70 3.813 13.160 2.311 1.00 53.54 C ATOM 1090 C GLU A 70 5.222 13.331 2.817 1.00 21.44 C ATOM 1091 O GLU A 70 5.642 12.689 3.793 1.00 64.11 O ATOM 1092 CB GLU A 70 2.906 14.218 2.952 1.00 54.21 C ATOM 1093 CG GLU A 70 2.916 14.204 4.461 1.00 33.25 C ATOM 1094 CD GLU A 70 2.254 15.395 5.059 1.00 13.22 C ATOM 1095 OE1 GLU A 70 1.028 15.366 5.243 1.00 74.21 O ATOM 1096 OE2 GLU A 70 2.939 16.373 5.372 1.00 2.31 O ATOM 0 H GLU A 70 3.199 11.579 3.515 1.00 42.21 H new ATOM 0 HA GLU A 70 3.772 13.318 1.233 1.00 53.54 H new ATOM 0 HB2 GLU A 70 3.215 15.204 2.606 1.00 54.21 H new ATOM 0 HB3 GLU A 70 1.884 14.064 2.604 1.00 54.21 H new ATOM 0 HG2 GLU A 70 2.416 13.302 4.814 1.00 33.25 H new ATOM 0 HG3 GLU A 70 3.947 14.154 4.811 1.00 33.25 H new ATOM 1103 N TYR A 71 5.938 14.173 2.178 1.00 54.02 N ATOM 1104 CA TYR A 71 7.268 14.492 2.573 1.00 31.15 C ATOM 1105 C TYR A 71 7.482 15.956 2.332 1.00 72.14 C ATOM 1106 O TYR A 71 6.898 16.523 1.394 1.00 42.55 O ATOM 1107 CB TYR A 71 8.310 13.628 1.811 1.00 20.41 C ATOM 1108 CG TYR A 71 8.340 13.798 0.292 1.00 63.44 C ATOM 1109 CD1 TYR A 71 7.329 13.283 -0.510 1.00 43.21 C ATOM 1110 CD2 TYR A 71 9.395 14.454 -0.334 1.00 61.31 C ATOM 1111 CE1 TYR A 71 7.366 13.417 -1.880 1.00 41.31 C ATOM 1112 CE2 TYR A 71 9.435 14.592 -1.710 1.00 64.24 C ATOM 1113 CZ TYR A 71 8.419 14.073 -2.479 1.00 70.23 C ATOM 1114 OH TYR A 71 8.457 14.199 -3.857 1.00 13.11 O ATOM 0 H TYR A 71 5.618 14.674 1.349 1.00 54.02 H new ATOM 0 HA TYR A 71 7.405 14.268 3.631 1.00 31.15 H new ATOM 0 HB2 TYR A 71 9.301 13.860 2.202 1.00 20.41 H new ATOM 0 HB3 TYR A 71 8.116 12.579 2.035 1.00 20.41 H new ATOM 0 HD1 TYR A 71 6.499 12.768 -0.050 1.00 43.21 H new ATOM 0 HD2 TYR A 71 10.196 14.862 0.264 1.00 61.31 H new ATOM 0 HE1 TYR A 71 6.570 13.008 -2.485 1.00 41.31 H new ATOM 0 HE2 TYR A 71 10.261 15.106 -2.179 1.00 64.24 H new ATOM 0 HH TYR A 71 9.265 14.689 -4.119 1.00 13.11 H new ATOM 1124 N ASN A 72 8.232 16.590 3.185 1.00 62.30 N ATOM 1125 CA ASN A 72 8.535 17.980 2.980 1.00 4.35 C ATOM 1126 C ASN A 72 9.604 18.078 1.927 1.00 11.22 C ATOM 1127 O ASN A 72 10.596 17.349 1.976 1.00 1.33 O ATOM 1128 CB ASN A 72 8.951 18.708 4.282 1.00 60.42 C ATOM 1129 CG ASN A 72 10.215 18.180 4.950 1.00 21.14 C ATOM 1130 OD1 ASN A 72 10.163 17.292 5.790 1.00 50.41 O ATOM 1131 ND2 ASN A 72 11.345 18.723 4.595 1.00 12.35 N ATOM 0 H ASN A 72 8.642 16.174 4.021 1.00 62.30 H new ATOM 0 HA ASN A 72 7.630 18.488 2.647 1.00 4.35 H new ATOM 0 HB2 ASN A 72 9.093 19.765 4.058 1.00 60.42 H new ATOM 0 HB3 ASN A 72 8.129 18.641 4.994 1.00 60.42 H new ATOM 0 HD21 ASN A 72 12.217 18.409 5.020 1.00 12.35 H new ATOM 0 HD22 ASN A 72 11.357 19.462 3.892 1.00 12.35 H new ATOM 1138 N ASP A 73 9.377 18.898 0.957 1.00 63.40 N ATOM 1139 CA ASP A 73 10.307 19.057 -0.135 1.00 50.22 C ATOM 1140 C ASP A 73 10.285 20.500 -0.557 1.00 10.14 C ATOM 1141 O ASP A 73 9.209 21.048 -0.831 1.00 44.02 O ATOM 1142 CB ASP A 73 9.893 18.155 -1.293 1.00 62.21 C ATOM 1143 CG ASP A 73 10.906 18.080 -2.401 1.00 34.12 C ATOM 1144 OD1 ASP A 73 11.837 17.258 -2.296 1.00 12.33 O ATOM 1145 OD2 ASP A 73 10.776 18.823 -3.412 1.00 0.42 O ATOM 0 H ASP A 73 8.544 19.482 0.889 1.00 63.40 H new ATOM 0 HA ASP A 73 11.315 18.777 0.172 1.00 50.22 H new ATOM 0 HB2 ASP A 73 9.712 17.150 -0.911 1.00 62.21 H new ATOM 0 HB3 ASP A 73 8.949 18.515 -1.701 1.00 62.21 H new ATOM 1150 N ALA A 74 11.450 21.136 -0.514 1.00 31.32 N ATOM 1151 CA ALA A 74 11.641 22.559 -0.857 1.00 21.12 C ATOM 1152 C ALA A 74 10.863 23.486 0.083 1.00 64.10 C ATOM 1153 O ALA A 74 10.673 24.676 -0.206 1.00 21.10 O ATOM 1154 CB ALA A 74 11.275 22.830 -2.314 1.00 23.03 C ATOM 0 H ALA A 74 12.315 20.674 -0.234 1.00 31.32 H new ATOM 0 HA ALA A 74 12.701 22.778 -0.726 1.00 21.12 H new ATOM 0 HB1 ALA A 74 11.426 23.886 -2.537 1.00 23.03 H new ATOM 0 HB2 ALA A 74 11.907 22.228 -2.966 1.00 23.03 H new ATOM 0 HB3 ALA A 74 10.230 22.570 -2.481 1.00 23.03 H new ATOM 1160 N GLY A 75 10.461 22.954 1.222 1.00 31.12 N ATOM 1161 CA GLY A 75 9.694 23.714 2.182 1.00 23.11 C ATOM 1162 C GLY A 75 8.194 23.553 1.995 1.00 64.42 C ATOM 1163 O GLY A 75 7.403 24.152 2.726 1.00 21.42 O ATOM 0 H GLY A 75 10.656 21.993 1.503 1.00 31.12 H new ATOM 0 HA2 GLY A 75 9.966 23.399 3.189 1.00 23.11 H new ATOM 0 HA3 GLY A 75 9.955 24.769 2.096 1.00 23.11 H new ATOM 1167 N SER A 76 7.800 22.765 1.021 1.00 3.53 N ATOM 1168 CA SER A 76 6.399 22.531 0.743 1.00 61.24 C ATOM 1169 C SER A 76 6.040 21.075 1.054 1.00 45.54 C ATOM 1170 O SER A 76 6.928 20.217 1.136 1.00 40.13 O ATOM 1171 CB SER A 76 6.126 22.844 -0.725 1.00 11.14 C ATOM 1172 OG SER A 76 6.555 24.162 -1.046 1.00 34.23 O ATOM 0 H SER A 76 8.439 22.269 0.400 1.00 3.53 H new ATOM 0 HA SER A 76 5.785 23.177 1.371 1.00 61.24 H new ATOM 0 HB2 SER A 76 6.644 22.123 -1.358 1.00 11.14 H new ATOM 0 HB3 SER A 76 5.061 22.742 -0.932 1.00 11.14 H new ATOM 0 HG SER A 76 6.373 24.344 -1.992 1.00 34.23 H new ATOM 1178 N LYS A 77 4.763 20.791 1.228 1.00 73.34 N ATOM 1179 CA LYS A 77 4.331 19.434 1.499 1.00 1.34 C ATOM 1180 C LYS A 77 4.067 18.736 0.187 1.00 15.22 C ATOM 1181 O LYS A 77 3.218 19.165 -0.590 1.00 33.22 O ATOM 1182 CB LYS A 77 3.040 19.354 2.355 1.00 64.55 C ATOM 1183 CG LYS A 77 3.104 19.870 3.799 1.00 61.34 C ATOM 1184 CD LYS A 77 3.149 21.387 3.893 1.00 10.31 C ATOM 1185 CE LYS A 77 3.027 21.841 5.342 1.00 24.34 C ATOM 1186 NZ LYS A 77 3.049 23.314 5.480 1.00 72.44 N ATOM 0 H LYS A 77 4.010 21.478 1.187 1.00 73.34 H new ATOM 0 HA LYS A 77 5.130 18.958 2.067 1.00 1.34 H new ATOM 0 HB2 LYS A 77 2.259 19.909 1.836 1.00 64.55 H new ATOM 0 HB3 LYS A 77 2.723 18.312 2.386 1.00 64.55 H new ATOM 0 HG2 LYS A 77 2.236 19.504 4.347 1.00 61.34 H new ATOM 0 HG3 LYS A 77 3.986 19.456 4.287 1.00 61.34 H new ATOM 0 HD2 LYS A 77 4.083 21.755 3.469 1.00 10.31 H new ATOM 0 HD3 LYS A 77 2.340 21.817 3.303 1.00 10.31 H new ATOM 0 HE2 LYS A 77 2.099 21.454 5.763 1.00 24.34 H new ATOM 0 HE3 LYS A 77 3.844 21.413 5.923 1.00 24.34 H new ATOM 0 HZ1 LYS A 77 2.963 23.570 6.484 1.00 72.44 H new ATOM 0 HZ2 LYS A 77 3.945 23.685 5.104 1.00 72.44 H new ATOM 0 HZ3 LYS A 77 2.254 23.724 4.949 1.00 72.44 H new ATOM 1200 N ARG A 78 4.794 17.706 -0.085 1.00 71.31 N ATOM 1201 CA ARG A 78 4.575 16.954 -1.292 1.00 5.33 C ATOM 1202 C ARG A 78 3.918 15.651 -0.930 1.00 45.33 C ATOM 1203 O ARG A 78 4.369 14.983 -0.011 1.00 72.51 O ATOM 1204 CB ARG A 78 5.908 16.709 -2.000 1.00 21.24 C ATOM 1205 CG ARG A 78 6.636 17.979 -2.402 1.00 1.24 C ATOM 1206 CD ARG A 78 5.784 18.837 -3.307 1.00 5.25 C ATOM 1207 NE ARG A 78 6.430 20.094 -3.656 1.00 60.30 N ATOM 1208 CZ ARG A 78 5.779 21.207 -3.990 1.00 11.34 C ATOM 1209 NH1 ARG A 78 4.441 21.222 -4.030 1.00 55.44 N ATOM 1210 NH2 ARG A 78 6.457 22.300 -4.298 1.00 73.02 N ATOM 0 H ARG A 78 5.548 17.358 0.507 1.00 71.31 H new ATOM 0 HA ARG A 78 3.928 17.509 -1.971 1.00 5.33 H new ATOM 0 HB2 ARG A 78 6.554 16.124 -1.345 1.00 21.24 H new ATOM 0 HB3 ARG A 78 5.729 16.107 -2.891 1.00 21.24 H new ATOM 0 HG2 ARG A 78 6.906 18.544 -1.510 1.00 1.24 H new ATOM 0 HG3 ARG A 78 7.566 17.723 -2.910 1.00 1.24 H new ATOM 0 HD2 ARG A 78 5.557 18.284 -4.218 1.00 5.25 H new ATOM 0 HD3 ARG A 78 4.834 19.045 -2.816 1.00 5.25 H new ATOM 0 HE ARG A 78 7.449 20.124 -3.644 1.00 60.30 H new ATOM 0 HH11 ARG A 78 3.915 20.378 -3.804 1.00 55.44 H new ATOM 0 HH12 ARG A 78 3.948 22.077 -4.286 1.00 55.44 H new ATOM 0 HH21 ARG A 78 7.477 22.290 -4.280 1.00 73.02 H new ATOM 0 HH22 ARG A 78 5.960 23.153 -4.554 1.00 73.02 H new ATOM 1224 N GLU A 79 2.877 15.295 -1.632 1.00 13.51 N ATOM 1225 CA GLU A 79 2.150 14.084 -1.350 1.00 64.15 C ATOM 1226 C GLU A 79 2.281 13.112 -2.519 1.00 61.45 C ATOM 1227 O GLU A 79 1.961 13.442 -3.657 1.00 11.33 O ATOM 1228 CB GLU A 79 0.655 14.373 -1.002 1.00 54.32 C ATOM 1229 CG GLU A 79 -0.221 14.992 -2.117 1.00 14.51 C ATOM 1230 CD GLU A 79 0.165 16.397 -2.532 1.00 1.14 C ATOM 1231 OE1 GLU A 79 1.110 16.560 -3.331 1.00 11.24 O ATOM 1232 OE2 GLU A 79 -0.501 17.361 -2.101 1.00 70.32 O ATOM 0 H GLU A 79 2.508 15.834 -2.415 1.00 13.51 H new ATOM 0 HA GLU A 79 2.588 13.619 -0.467 1.00 64.15 H new ATOM 0 HB2 GLU A 79 0.193 13.436 -0.690 1.00 54.32 H new ATOM 0 HB3 GLU A 79 0.631 15.042 -0.142 1.00 54.32 H new ATOM 0 HG2 GLU A 79 -0.176 14.346 -2.994 1.00 14.51 H new ATOM 0 HG3 GLU A 79 -1.258 15.001 -1.780 1.00 14.51 H new ATOM 1239 N LYS A 80 2.799 11.954 -2.252 1.00 72.34 N ATOM 1240 CA LYS A 80 2.992 10.941 -3.262 1.00 64.52 C ATOM 1241 C LYS A 80 2.412 9.635 -2.775 1.00 11.35 C ATOM 1242 O LYS A 80 2.468 9.324 -1.600 1.00 20.02 O ATOM 1243 CB LYS A 80 4.479 10.764 -3.608 1.00 64.22 C ATOM 1244 CG LYS A 80 5.173 11.940 -4.334 1.00 42.02 C ATOM 1245 CD LYS A 80 4.998 11.928 -5.871 1.00 12.21 C ATOM 1246 CE LYS A 80 3.594 12.276 -6.368 1.00 34.20 C ATOM 1247 NZ LYS A 80 3.182 13.641 -6.003 1.00 51.11 N ATOM 0 H LYS A 80 3.105 11.675 -1.320 1.00 72.34 H new ATOM 0 HA LYS A 80 2.480 11.258 -4.170 1.00 64.52 H new ATOM 0 HB2 LYS A 80 5.022 10.569 -2.683 1.00 64.22 H new ATOM 0 HB3 LYS A 80 4.579 9.875 -4.230 1.00 64.22 H new ATOM 0 HG2 LYS A 80 4.779 12.878 -3.942 1.00 42.02 H new ATOM 0 HG3 LYS A 80 6.237 11.919 -4.101 1.00 42.02 H new ATOM 0 HD2 LYS A 80 5.706 12.633 -6.307 1.00 12.21 H new ATOM 0 HD3 LYS A 80 5.263 10.939 -6.243 1.00 12.21 H new ATOM 0 HE2 LYS A 80 3.560 12.169 -7.452 1.00 34.20 H new ATOM 0 HE3 LYS A 80 2.880 11.563 -5.955 1.00 34.20 H new ATOM 0 HZ1 LYS A 80 2.871 14.149 -6.855 1.00 51.11 H new ATOM 0 HZ2 LYS A 80 2.398 13.596 -5.321 1.00 51.11 H new ATOM 0 HZ3 LYS A 80 3.986 14.143 -5.575 1.00 51.11 H new ATOM 1261 N LEU A 81 1.883 8.885 -3.672 1.00 10.14 N ATOM 1262 CA LEU A 81 1.219 7.655 -3.344 1.00 45.50 C ATOM 1263 C LEU A 81 2.226 6.519 -3.296 1.00 20.41 C ATOM 1264 O LEU A 81 3.093 6.415 -4.166 1.00 2.12 O ATOM 1265 CB LEU A 81 0.123 7.357 -4.384 1.00 13.24 C ATOM 1266 CG LEU A 81 -1.131 8.269 -4.423 1.00 21.11 C ATOM 1267 CD1 LEU A 81 -0.803 9.718 -4.712 1.00 44.35 C ATOM 1268 CD2 LEU A 81 -2.098 7.767 -5.461 1.00 14.34 C ATOM 0 H LEU A 81 1.893 9.101 -4.669 1.00 10.14 H new ATOM 0 HA LEU A 81 0.754 7.750 -2.363 1.00 45.50 H new ATOM 0 HB2 LEU A 81 0.586 7.388 -5.370 1.00 13.24 H new ATOM 0 HB3 LEU A 81 -0.217 6.334 -4.223 1.00 13.24 H new ATOM 0 HG LEU A 81 -1.576 8.227 -3.429 1.00 21.11 H new ATOM 0 HD11 LEU A 81 -1.722 10.303 -4.726 1.00 44.35 H new ATOM 0 HD12 LEU A 81 -0.140 10.102 -3.937 1.00 44.35 H new ATOM 0 HD13 LEU A 81 -0.310 9.793 -5.681 1.00 44.35 H new ATOM 0 HD21 LEU A 81 -2.976 8.412 -5.483 1.00 14.34 H new ATOM 0 HD22 LEU A 81 -1.618 7.775 -6.440 1.00 14.34 H new ATOM 0 HD23 LEU A 81 -2.401 6.750 -5.214 1.00 14.34 H new ATOM 1280 N ILE A 82 2.150 5.694 -2.281 1.00 53.15 N ATOM 1281 CA ILE A 82 3.038 4.566 -2.158 1.00 64.34 C ATOM 1282 C ILE A 82 2.244 3.269 -1.943 1.00 60.45 C ATOM 1283 O ILE A 82 1.191 3.264 -1.285 1.00 63.00 O ATOM 1284 CB ILE A 82 4.175 4.785 -1.059 1.00 40.43 C ATOM 1285 CG1 ILE A 82 3.635 5.044 0.367 1.00 23.13 C ATOM 1286 CG2 ILE A 82 5.110 5.923 -1.449 1.00 5.41 C ATOM 1287 CD1 ILE A 82 3.204 3.813 1.127 1.00 63.42 C ATOM 0 H ILE A 82 1.475 5.785 -1.522 1.00 53.15 H new ATOM 0 HA ILE A 82 3.573 4.470 -3.103 1.00 64.34 H new ATOM 0 HB ILE A 82 4.719 3.841 -1.032 1.00 40.43 H new ATOM 0 HG12 ILE A 82 4.407 5.555 0.943 1.00 23.13 H new ATOM 0 HG13 ILE A 82 2.786 5.724 0.298 1.00 23.13 H new ATOM 0 HG21 ILE A 82 5.873 6.047 -0.680 1.00 5.41 H new ATOM 0 HG22 ILE A 82 5.588 5.691 -2.401 1.00 5.41 H new ATOM 0 HG23 ILE A 82 4.539 6.846 -1.545 1.00 5.41 H new ATOM 0 HD11 ILE A 82 2.842 4.103 2.114 1.00 63.42 H new ATOM 0 HD12 ILE A 82 2.406 3.309 0.581 1.00 63.42 H new ATOM 0 HD13 ILE A 82 4.052 3.137 1.236 1.00 63.42 H new ATOM 1299 N LEU A 83 2.703 2.202 -2.547 1.00 34.41 N ATOM 1300 CA LEU A 83 2.079 0.903 -2.395 1.00 13.12 C ATOM 1301 C LEU A 83 2.956 -0.003 -1.600 1.00 11.24 C ATOM 1302 O LEU A 83 3.943 -0.521 -2.131 1.00 71.41 O ATOM 1303 CB LEU A 83 1.819 0.226 -3.743 1.00 71.02 C ATOM 1304 CG LEU A 83 0.563 0.585 -4.508 1.00 15.03 C ATOM 1305 CD1 LEU A 83 0.553 -0.173 -5.819 1.00 64.35 C ATOM 1306 CD2 LEU A 83 -0.681 0.236 -3.698 1.00 21.52 C ATOM 0 H LEU A 83 3.519 2.205 -3.159 1.00 34.41 H new ATOM 0 HA LEU A 83 1.129 1.075 -1.889 1.00 13.12 H new ATOM 0 HB2 LEU A 83 2.671 0.438 -4.389 1.00 71.02 H new ATOM 0 HB3 LEU A 83 1.807 -0.851 -3.575 1.00 71.02 H new ATOM 0 HG LEU A 83 0.555 1.658 -4.698 1.00 15.03 H new ATOM 0 HD11 LEU A 83 -0.348 0.079 -6.378 1.00 64.35 H new ATOM 0 HD12 LEU A 83 1.431 0.100 -6.404 1.00 64.35 H new ATOM 0 HD13 LEU A 83 0.569 -1.245 -5.620 1.00 64.35 H new ATOM 0 HD21 LEU A 83 -1.572 0.502 -4.267 1.00 21.52 H new ATOM 0 HD22 LEU A 83 -0.691 -0.834 -3.489 1.00 21.52 H new ATOM 0 HD23 LEU A 83 -0.671 0.790 -2.759 1.00 21.52 H new ATOM 1318 N ILE A 84 2.615 -0.218 -0.353 1.00 54.53 N ATOM 1319 CA ILE A 84 3.385 -1.117 0.474 1.00 44.12 C ATOM 1320 C ILE A 84 3.026 -2.539 0.084 1.00 33.42 C ATOM 1321 O ILE A 84 2.018 -3.053 0.492 1.00 72.41 O ATOM 1322 CB ILE A 84 3.073 -0.915 1.987 1.00 23.22 C ATOM 1323 CG1 ILE A 84 3.468 0.492 2.471 1.00 40.34 C ATOM 1324 CG2 ILE A 84 3.755 -1.974 2.835 1.00 71.43 C ATOM 1325 CD1 ILE A 84 4.958 0.793 2.394 1.00 14.34 C ATOM 0 H ILE A 84 1.815 0.213 0.110 1.00 54.53 H new ATOM 0 HA ILE A 84 4.445 -0.915 0.319 1.00 44.12 H new ATOM 0 HB ILE A 84 1.994 -1.018 2.104 1.00 23.22 H new ATOM 0 HG12 ILE A 84 2.930 1.231 1.877 1.00 40.34 H new ATOM 0 HG13 ILE A 84 3.139 0.613 3.503 1.00 40.34 H new ATOM 0 HG21 ILE A 84 3.519 -1.807 3.886 1.00 71.43 H new ATOM 0 HG22 ILE A 84 3.403 -2.961 2.537 1.00 71.43 H new ATOM 0 HG23 ILE A 84 4.834 -1.915 2.692 1.00 71.43 H new ATOM 0 HD11 ILE A 84 5.144 1.805 2.755 1.00 14.34 H new ATOM 0 HD12 ILE A 84 5.505 0.081 3.012 1.00 14.34 H new ATOM 0 HD13 ILE A 84 5.293 0.709 1.360 1.00 14.34 H new ATOM 1337 N GLN A 85 3.848 -3.127 -0.713 1.00 72.14 N ATOM 1338 CA GLN A 85 3.699 -4.447 -1.197 1.00 51.01 C ATOM 1339 C GLN A 85 4.449 -5.398 -0.287 1.00 50.41 C ATOM 1340 O GLN A 85 5.673 -5.463 -0.338 1.00 64.13 O ATOM 1341 CB GLN A 85 4.308 -4.573 -2.601 1.00 44.12 C ATOM 1342 CG GLN A 85 3.806 -3.595 -3.657 1.00 23.53 C ATOM 1343 CD GLN A 85 2.386 -3.791 -4.086 1.00 44.24 C ATOM 1344 OE1 GLN A 85 2.095 -4.568 -4.976 1.00 33.43 O ATOM 1345 NE2 GLN A 85 1.510 -3.038 -3.518 1.00 63.25 N ATOM 0 H GLN A 85 4.690 -2.669 -1.062 1.00 72.14 H new ATOM 0 HA GLN A 85 2.636 -4.686 -1.228 1.00 51.01 H new ATOM 0 HB2 GLN A 85 5.388 -4.455 -2.515 1.00 44.12 H new ATOM 0 HB3 GLN A 85 4.125 -5.585 -2.961 1.00 44.12 H new ATOM 0 HG2 GLN A 85 3.915 -2.581 -3.271 1.00 23.53 H new ATOM 0 HG3 GLN A 85 4.448 -3.673 -4.535 1.00 23.53 H new ATOM 0 HE21 GLN A 85 1.792 -2.399 -2.775 1.00 63.25 H new ATOM 0 HE22 GLN A 85 0.534 -3.081 -3.811 1.00 63.25 H new ATOM 1354 N TRP A 86 3.742 -6.119 0.516 1.00 10.23 N ATOM 1355 CA TRP A 86 4.350 -7.097 1.382 1.00 43.53 C ATOM 1356 C TRP A 86 4.733 -8.380 0.654 1.00 75.34 C ATOM 1357 O TRP A 86 4.057 -8.828 -0.281 1.00 61.02 O ATOM 1358 CB TRP A 86 3.377 -7.515 2.469 1.00 63.33 C ATOM 1359 CG TRP A 86 3.228 -6.602 3.632 1.00 64.33 C ATOM 1360 CD1 TRP A 86 2.490 -5.460 3.711 1.00 51.31 C ATOM 1361 CD2 TRP A 86 3.795 -6.814 4.925 1.00 21.10 C ATOM 1362 NE1 TRP A 86 2.574 -4.944 4.981 1.00 14.34 N ATOM 1363 CE2 TRP A 86 3.374 -5.763 5.744 1.00 32.41 C ATOM 1364 CE3 TRP A 86 4.629 -7.801 5.464 1.00 62.23 C ATOM 1365 CZ2 TRP A 86 3.748 -5.670 7.080 1.00 51.52 C ATOM 1366 CZ3 TRP A 86 5.002 -7.705 6.786 1.00 23.23 C ATOM 1367 CH2 TRP A 86 4.563 -6.647 7.580 1.00 61.41 C ATOM 0 H TRP A 86 2.727 -6.055 0.598 1.00 10.23 H new ATOM 0 HA TRP A 86 5.243 -6.615 1.781 1.00 43.53 H new ATOM 0 HB2 TRP A 86 2.396 -7.645 2.013 1.00 63.33 H new ATOM 0 HB3 TRP A 86 3.686 -8.491 2.843 1.00 63.33 H new ATOM 0 HD1 TRP A 86 1.925 -5.026 2.899 1.00 51.31 H new ATOM 0 HE1 TRP A 86 2.117 -4.092 5.306 1.00 14.34 H new ATOM 0 HE3 TRP A 86 4.974 -8.623 4.854 1.00 62.23 H new ATOM 0 HZ2 TRP A 86 3.407 -4.855 7.701 1.00 51.52 H new ATOM 0 HZ3 TRP A 86 5.644 -8.461 7.214 1.00 23.23 H new ATOM 0 HH2 TRP A 86 4.874 -6.598 8.613 1.00 61.41 H new ATOM 1378 N ILE A 87 5.858 -8.895 1.056 1.00 11.42 N ATOM 1379 CA ILE A 87 6.310 -10.225 0.749 1.00 22.51 C ATOM 1380 C ILE A 87 6.202 -10.907 2.100 1.00 11.51 C ATOM 1381 O ILE A 87 7.093 -10.756 2.937 1.00 74.24 O ATOM 1382 CB ILE A 87 7.808 -10.249 0.289 1.00 54.31 C ATOM 1383 CG1 ILE A 87 8.035 -9.371 -0.960 1.00 32.33 C ATOM 1384 CG2 ILE A 87 8.276 -11.684 0.029 1.00 54.44 C ATOM 1385 CD1 ILE A 87 7.323 -9.850 -2.209 1.00 54.45 C ATOM 0 H ILE A 87 6.518 -8.376 1.635 1.00 11.42 H new ATOM 0 HA ILE A 87 5.741 -10.684 -0.060 1.00 22.51 H new ATOM 0 HB ILE A 87 8.404 -9.831 1.101 1.00 54.31 H new ATOM 0 HG12 ILE A 87 7.707 -8.356 -0.738 1.00 32.33 H new ATOM 0 HG13 ILE A 87 9.105 -9.323 -1.164 1.00 32.33 H new ATOM 0 HG21 ILE A 87 9.319 -11.675 -0.289 1.00 54.44 H new ATOM 0 HG22 ILE A 87 8.181 -12.269 0.944 1.00 54.44 H new ATOM 0 HG23 ILE A 87 7.662 -12.131 -0.753 1.00 54.44 H new ATOM 0 HD11 ILE A 87 7.541 -9.172 -3.034 1.00 54.45 H new ATOM 0 HD12 ILE A 87 7.668 -10.853 -2.462 1.00 54.45 H new ATOM 0 HD13 ILE A 87 6.248 -9.870 -2.030 1.00 54.45 H new ATOM 1397 N PRO A 88 5.078 -11.573 2.390 1.00 72.41 N ATOM 1398 CA PRO A 88 4.798 -11.982 3.757 1.00 40.40 C ATOM 1399 C PRO A 88 5.707 -13.074 4.306 1.00 0.35 C ATOM 1400 O PRO A 88 5.727 -14.218 3.824 1.00 1.21 O ATOM 1401 CB PRO A 88 3.375 -12.545 3.653 1.00 3.22 C ATOM 1402 CG PRO A 88 2.839 -12.066 2.348 1.00 0.32 C ATOM 1403 CD PRO A 88 4.018 -11.961 1.452 1.00 15.13 C ATOM 0 HA PRO A 88 4.943 -11.141 4.435 1.00 40.40 H new ATOM 0 HB2 PRO A 88 3.382 -13.634 3.696 1.00 3.22 H new ATOM 0 HB3 PRO A 88 2.756 -12.197 4.480 1.00 3.22 H new ATOM 0 HG2 PRO A 88 2.102 -12.761 1.947 1.00 0.32 H new ATOM 0 HG3 PRO A 88 2.342 -11.102 2.457 1.00 0.32 H new ATOM 0 HD2 PRO A 88 4.238 -12.906 0.955 1.00 15.13 H new ATOM 0 HD3 PRO A 88 3.872 -11.216 0.670 1.00 15.13 H new ATOM 1411 N ASP A 89 6.417 -12.721 5.357 1.00 74.45 N ATOM 1412 CA ASP A 89 7.179 -13.665 6.144 1.00 70.34 C ATOM 1413 C ASP A 89 6.314 -14.370 7.182 1.00 52.51 C ATOM 1414 O ASP A 89 6.262 -15.585 7.239 1.00 43.32 O ATOM 1415 CB ASP A 89 8.391 -13.000 6.795 1.00 24.11 C ATOM 1416 CG ASP A 89 9.057 -13.889 7.828 1.00 5.13 C ATOM 1417 OD1 ASP A 89 9.776 -14.843 7.447 1.00 64.13 O ATOM 1418 OD2 ASP A 89 8.862 -13.646 9.041 1.00 32.31 O ATOM 0 H ASP A 89 6.481 -11.760 5.692 1.00 74.45 H new ATOM 0 HA ASP A 89 7.547 -14.428 5.458 1.00 70.34 H new ATOM 0 HB2 ASP A 89 9.116 -12.739 6.024 1.00 24.11 H new ATOM 0 HB3 ASP A 89 8.080 -12.069 7.268 1.00 24.11 H new ATOM 1423 N THR A 90 5.548 -13.580 7.908 1.00 65.31 N ATOM 1424 CA THR A 90 4.784 -14.018 9.068 1.00 2.24 C ATOM 1425 C THR A 90 3.394 -14.515 8.714 1.00 13.32 C ATOM 1426 O THR A 90 2.528 -14.658 9.576 1.00 64.13 O ATOM 1427 CB THR A 90 4.681 -12.838 10.032 1.00 64.42 C ATOM 1428 OG1 THR A 90 4.924 -11.618 9.283 1.00 20.14 O ATOM 1429 CG2 THR A 90 5.686 -12.967 11.169 1.00 54.22 C ATOM 0 H THR A 90 5.434 -12.587 7.705 1.00 65.31 H new ATOM 0 HA THR A 90 5.304 -14.863 9.519 1.00 2.24 H new ATOM 0 HB THR A 90 3.686 -12.819 10.477 1.00 64.42 H new ATOM 0 HG1 THR A 90 4.861 -10.847 9.884 1.00 20.14 H new ATOM 0 HG21 THR A 90 5.589 -12.113 11.839 1.00 54.22 H new ATOM 0 HG22 THR A 90 5.493 -13.886 11.723 1.00 54.22 H new ATOM 0 HG23 THR A 90 6.696 -12.995 10.760 1.00 54.22 H new ATOM 1437 N ALA A 91 3.195 -14.814 7.474 1.00 74.20 N ATOM 1438 CA ALA A 91 1.919 -15.252 7.027 1.00 12.35 C ATOM 1439 C ALA A 91 1.840 -16.764 7.001 1.00 52.53 C ATOM 1440 O ALA A 91 2.824 -17.452 7.266 1.00 42.21 O ATOM 1441 CB ALA A 91 1.604 -14.656 5.683 1.00 2.24 C ATOM 0 H ALA A 91 3.909 -14.762 6.747 1.00 74.20 H new ATOM 0 HA ALA A 91 1.166 -14.904 7.734 1.00 12.35 H new ATOM 0 HB1 ALA A 91 0.624 -15.000 5.353 1.00 2.24 H new ATOM 0 HB2 ALA A 91 1.600 -13.569 5.759 1.00 2.24 H new ATOM 0 HB3 ALA A 91 2.359 -14.967 4.961 1.00 2.24 H new ATOM 1447 N ARG A 92 0.695 -17.263 6.675 1.00 41.21 N ATOM 1448 CA ARG A 92 0.429 -18.690 6.639 1.00 21.25 C ATOM 1449 C ARG A 92 0.711 -19.156 5.202 1.00 23.10 C ATOM 1450 O ARG A 92 0.805 -18.302 4.321 1.00 12.51 O ATOM 1451 CB ARG A 92 -1.032 -18.894 7.073 1.00 63.52 C ATOM 1452 CG ARG A 92 -1.315 -18.123 8.349 1.00 64.42 C ATOM 1453 CD ARG A 92 -2.781 -17.994 8.691 1.00 35.53 C ATOM 1454 NE ARG A 92 -2.943 -17.012 9.773 1.00 15.41 N ATOM 1455 CZ ARG A 92 -4.095 -16.618 10.319 1.00 30.13 C ATOM 1456 NH1 ARG A 92 -5.240 -17.193 9.968 1.00 13.42 N ATOM 1457 NH2 ARG A 92 -4.089 -15.632 11.212 1.00 73.20 N ATOM 0 H ARG A 92 -0.109 -16.691 6.418 1.00 41.21 H new ATOM 0 HA ARG A 92 1.054 -19.276 7.312 1.00 21.25 H new ATOM 0 HB2 ARG A 92 -1.703 -18.560 6.282 1.00 63.52 H new ATOM 0 HB3 ARG A 92 -1.227 -19.955 7.230 1.00 63.52 H new ATOM 0 HG2 ARG A 92 -0.804 -18.615 9.177 1.00 64.42 H new ATOM 0 HG3 ARG A 92 -0.887 -17.125 8.258 1.00 64.42 H new ATOM 0 HD2 ARG A 92 -3.345 -17.681 7.812 1.00 35.53 H new ATOM 0 HD3 ARG A 92 -3.181 -18.960 8.998 1.00 35.53 H new ATOM 0 HE ARG A 92 -2.091 -16.590 10.143 1.00 15.41 H new ATOM 0 HH11 ARG A 92 -5.243 -17.942 9.276 1.00 13.42 H new ATOM 0 HH12 ARG A 92 -6.116 -16.885 10.391 1.00 13.42 H new ATOM 0 HH21 ARG A 92 -3.210 -15.185 11.473 1.00 73.20 H new ATOM 0 HH22 ARG A 92 -4.964 -15.323 11.636 1.00 73.20 H new ATOM 1471 N PRO A 93 0.878 -20.476 4.938 1.00 5.30 N ATOM 1472 CA PRO A 93 1.305 -20.996 3.614 1.00 2.15 C ATOM 1473 C PRO A 93 0.647 -20.348 2.375 1.00 14.00 C ATOM 1474 O PRO A 93 1.358 -19.830 1.507 1.00 62.32 O ATOM 1475 CB PRO A 93 0.939 -22.468 3.697 1.00 53.32 C ATOM 1476 CG PRO A 93 1.131 -22.804 5.128 1.00 31.30 C ATOM 1477 CD PRO A 93 0.713 -21.582 5.907 1.00 51.22 C ATOM 0 HA PRO A 93 2.360 -20.775 3.454 1.00 2.15 H new ATOM 0 HB2 PRO A 93 -0.089 -22.642 3.380 1.00 53.32 H new ATOM 0 HB3 PRO A 93 1.577 -23.075 3.055 1.00 53.32 H new ATOM 0 HG2 PRO A 93 0.530 -23.669 5.409 1.00 31.30 H new ATOM 0 HG3 PRO A 93 2.171 -23.059 5.332 1.00 31.30 H new ATOM 0 HD2 PRO A 93 -0.318 -21.661 6.253 1.00 51.22 H new ATOM 0 HD3 PRO A 93 1.336 -21.437 6.790 1.00 51.22 H new ATOM 1485 N ARG A 94 -0.688 -20.304 2.311 1.00 74.52 N ATOM 1486 CA ARG A 94 -1.325 -19.720 1.127 1.00 5.13 C ATOM 1487 C ARG A 94 -1.209 -18.190 1.160 1.00 61.40 C ATOM 1488 O ARG A 94 -1.070 -17.549 0.124 1.00 10.21 O ATOM 1489 CB ARG A 94 -2.804 -20.140 0.942 1.00 63.32 C ATOM 1490 CG ARG A 94 -3.742 -19.438 1.876 1.00 74.33 C ATOM 1491 CD ARG A 94 -5.198 -19.633 1.542 1.00 73.23 C ATOM 1492 NE ARG A 94 -5.975 -18.698 2.338 1.00 31.41 N ATOM 1493 CZ ARG A 94 -7.272 -18.493 2.298 1.00 54.24 C ATOM 1494 NH1 ARG A 94 -8.057 -19.218 1.507 1.00 62.30 N ATOM 1495 NH2 ARG A 94 -7.795 -17.545 3.061 1.00 10.22 N ATOM 0 H ARG A 94 -1.324 -20.649 3.030 1.00 74.52 H new ATOM 0 HA ARG A 94 -0.786 -20.117 0.267 1.00 5.13 H new ATOM 0 HB2 ARG A 94 -3.106 -19.937 -0.085 1.00 63.32 H new ATOM 0 HB3 ARG A 94 -2.890 -21.216 1.093 1.00 63.32 H new ATOM 0 HG2 ARG A 94 -3.562 -19.793 2.891 1.00 74.33 H new ATOM 0 HG3 ARG A 94 -3.517 -18.371 1.867 1.00 74.33 H new ATOM 0 HD2 ARG A 94 -5.370 -19.463 0.479 1.00 73.23 H new ATOM 0 HD3 ARG A 94 -5.503 -20.658 1.754 1.00 73.23 H new ATOM 0 HE ARG A 94 -5.451 -18.134 3.007 1.00 31.41 H new ATOM 0 HH11 ARG A 94 -7.654 -19.947 0.918 1.00 62.30 H new ATOM 0 HH12 ARG A 94 -9.062 -19.045 1.489 1.00 62.30 H new ATOM 0 HH21 ARG A 94 -7.193 -16.988 3.667 1.00 10.22 H new ATOM 0 HH22 ARG A 94 -8.800 -17.372 3.043 1.00 10.22 H new ATOM 1509 N GLU A 95 -1.222 -17.629 2.373 1.00 23.12 N ATOM 1510 CA GLU A 95 -1.184 -16.179 2.588 1.00 43.55 C ATOM 1511 C GLU A 95 0.155 -15.638 2.090 1.00 50.44 C ATOM 1512 O GLU A 95 0.217 -14.601 1.483 1.00 52.22 O ATOM 1513 CB GLU A 95 -1.310 -15.856 4.081 1.00 33.32 C ATOM 1514 CG GLU A 95 -2.410 -16.582 4.854 1.00 43.11 C ATOM 1515 CD GLU A 95 -3.823 -16.336 4.398 1.00 14.14 C ATOM 1516 OE1 GLU A 95 -4.346 -15.239 4.591 1.00 21.35 O ATOM 1517 OE2 GLU A 95 -4.451 -17.282 3.931 1.00 1.03 O ATOM 0 H GLU A 95 -1.259 -18.170 3.237 1.00 23.12 H new ATOM 0 HA GLU A 95 -2.013 -15.722 2.047 1.00 43.55 H new ATOM 0 HB2 GLU A 95 -0.356 -16.079 4.558 1.00 33.32 H new ATOM 0 HB3 GLU A 95 -1.474 -14.783 4.184 1.00 33.32 H new ATOM 0 HG2 GLU A 95 -2.215 -17.653 4.800 1.00 43.11 H new ATOM 0 HG3 GLU A 95 -2.335 -16.297 5.903 1.00 43.11 H new ATOM 1524 N LYS A 96 1.222 -16.373 2.343 1.00 71.14 N ATOM 1525 CA LYS A 96 2.539 -15.945 1.897 1.00 40.10 C ATOM 1526 C LYS A 96 2.625 -15.961 0.371 1.00 4.02 C ATOM 1527 O LYS A 96 2.911 -14.943 -0.256 1.00 42.23 O ATOM 1528 CB LYS A 96 3.625 -16.879 2.446 1.00 24.44 C ATOM 1529 CG LYS A 96 3.797 -16.898 3.953 1.00 75.53 C ATOM 1530 CD LYS A 96 4.746 -18.020 4.393 1.00 12.14 C ATOM 1531 CE LYS A 96 6.124 -17.936 3.726 1.00 22.41 C ATOM 1532 NZ LYS A 96 6.885 -16.725 4.108 1.00 20.14 N ATOM 0 H LYS A 96 1.207 -17.259 2.848 1.00 71.14 H new ATOM 0 HA LYS A 96 2.695 -14.932 2.267 1.00 40.10 H new ATOM 0 HB2 LYS A 96 3.403 -17.893 2.114 1.00 24.44 H new ATOM 0 HB3 LYS A 96 4.577 -16.598 1.997 1.00 24.44 H new ATOM 0 HG2 LYS A 96 4.187 -15.937 4.289 1.00 75.53 H new ATOM 0 HG3 LYS A 96 2.826 -17.032 4.430 1.00 75.53 H new ATOM 0 HD2 LYS A 96 4.869 -17.980 5.475 1.00 12.14 H new ATOM 0 HD3 LYS A 96 4.293 -18.984 4.159 1.00 12.14 H new ATOM 0 HE2 LYS A 96 6.703 -18.820 3.992 1.00 22.41 H new ATOM 0 HE3 LYS A 96 5.998 -17.951 2.643 1.00 22.41 H new ATOM 0 HZ1 LYS A 96 7.799 -16.718 3.612 1.00 20.14 H new ATOM 0 HZ2 LYS A 96 6.343 -15.877 3.846 1.00 20.14 H new ATOM 0 HZ3 LYS A 96 7.049 -16.728 5.135 1.00 20.14 H new ATOM 1546 N MET A 97 2.263 -17.087 -0.214 1.00 23.24 N ATOM 1547 CA MET A 97 2.431 -17.294 -1.647 1.00 55.12 C ATOM 1548 C MET A 97 1.428 -16.517 -2.500 1.00 21.33 C ATOM 1549 O MET A 97 1.818 -15.813 -3.438 1.00 33.43 O ATOM 1550 CB MET A 97 2.415 -18.800 -2.013 1.00 12.12 C ATOM 1551 CG MET A 97 1.123 -19.533 -1.669 1.00 23.13 C ATOM 1552 SD MET A 97 1.136 -21.286 -2.105 1.00 12.21 S ATOM 1553 CE MET A 97 2.465 -21.896 -1.063 1.00 14.31 C ATOM 0 H MET A 97 1.849 -17.877 0.280 1.00 23.24 H new ATOM 0 HA MET A 97 3.415 -16.889 -1.885 1.00 55.12 H new ATOM 0 HB2 MET A 97 2.598 -18.900 -3.083 1.00 12.12 H new ATOM 0 HB3 MET A 97 3.242 -19.292 -1.500 1.00 12.12 H new ATOM 0 HG2 MET A 97 0.936 -19.436 -0.600 1.00 23.13 H new ATOM 0 HG3 MET A 97 0.294 -19.047 -2.183 1.00 23.13 H new ATOM 0 HE1 MET A 97 2.183 -22.860 -0.640 1.00 14.31 H new ATOM 0 HE2 MET A 97 3.370 -22.012 -1.659 1.00 14.31 H new ATOM 0 HE3 MET A 97 2.650 -21.186 -0.257 1.00 14.31 H new ATOM 1563 N MET A 98 0.157 -16.587 -2.150 1.00 1.24 N ATOM 1564 CA MET A 98 -0.869 -16.019 -3.000 1.00 34.52 C ATOM 1565 C MET A 98 -0.880 -14.513 -2.890 1.00 70.12 C ATOM 1566 O MET A 98 -0.969 -13.818 -3.896 1.00 64.10 O ATOM 1567 CB MET A 98 -2.254 -16.590 -2.677 1.00 65.04 C ATOM 1568 CG MET A 98 -3.282 -16.335 -3.772 1.00 14.33 C ATOM 1569 SD MET A 98 -2.795 -17.130 -5.323 1.00 4.54 S ATOM 1570 CE MET A 98 -4.156 -16.699 -6.400 1.00 22.04 C ATOM 0 H MET A 98 -0.185 -17.025 -1.295 1.00 1.24 H new ATOM 0 HA MET A 98 -0.630 -16.293 -4.027 1.00 34.52 H new ATOM 0 HB2 MET A 98 -2.167 -17.664 -2.513 1.00 65.04 H new ATOM 0 HB3 MET A 98 -2.611 -16.153 -1.744 1.00 65.04 H new ATOM 0 HG2 MET A 98 -4.255 -16.712 -3.456 1.00 14.33 H new ATOM 0 HG3 MET A 98 -3.392 -15.262 -3.929 1.00 14.33 H new ATOM 0 HE1 MET A 98 -4.271 -17.466 -7.166 1.00 22.04 H new ATOM 0 HE2 MET A 98 -5.074 -16.629 -5.816 1.00 22.04 H new ATOM 0 HE3 MET A 98 -3.954 -15.739 -6.875 1.00 22.04 H new ATOM 1580 N TYR A 99 -0.722 -14.010 -1.671 1.00 0.22 N ATOM 1581 CA TYR A 99 -0.729 -12.567 -1.427 1.00 2.44 C ATOM 1582 C TYR A 99 0.529 -11.939 -1.974 1.00 40.32 C ATOM 1583 O TYR A 99 0.540 -10.771 -2.268 1.00 3.41 O ATOM 1584 CB TYR A 99 -0.874 -12.214 0.060 1.00 31.14 C ATOM 1585 CG TYR A 99 -2.185 -12.601 0.753 1.00 13.31 C ATOM 1586 CD1 TYR A 99 -2.701 -13.889 0.689 1.00 22.43 C ATOM 1587 CD2 TYR A 99 -2.860 -11.676 1.532 1.00 13.11 C ATOM 1588 CE1 TYR A 99 -3.843 -14.238 1.378 1.00 1.44 C ATOM 1589 CE2 TYR A 99 -4.009 -12.014 2.213 1.00 24.22 C ATOM 1590 CZ TYR A 99 -4.492 -13.296 2.138 1.00 14.43 C ATOM 1591 OH TYR A 99 -5.614 -13.649 2.845 1.00 44.34 O ATOM 0 H TYR A 99 -0.587 -14.578 -0.834 1.00 0.22 H new ATOM 0 HA TYR A 99 -1.603 -12.168 -1.943 1.00 2.44 H new ATOM 0 HB2 TYR A 99 -0.055 -12.689 0.600 1.00 31.14 H new ATOM 0 HB3 TYR A 99 -0.743 -11.137 0.165 1.00 31.14 H new ATOM 0 HD1 TYR A 99 -2.198 -14.632 0.088 1.00 22.43 H new ATOM 0 HD2 TYR A 99 -2.478 -10.669 1.607 1.00 13.11 H new ATOM 0 HE1 TYR A 99 -4.225 -15.247 1.320 1.00 1.44 H new ATOM 0 HE2 TYR A 99 -4.527 -11.273 2.803 1.00 24.22 H new ATOM 0 HH TYR A 99 -5.388 -14.356 3.485 1.00 44.34 H new ATOM 1601 N SER A 100 1.598 -12.710 -2.096 1.00 10.40 N ATOM 1602 CA SER A 100 2.806 -12.198 -2.701 1.00 45.24 C ATOM 1603 C SER A 100 2.568 -11.974 -4.218 1.00 60.54 C ATOM 1604 O SER A 100 2.949 -10.942 -4.773 1.00 3.41 O ATOM 1605 CB SER A 100 3.961 -13.181 -2.466 1.00 20.02 C ATOM 1606 OG SER A 100 5.223 -12.631 -2.802 1.00 64.03 O ATOM 0 H SER A 100 1.649 -13.681 -1.787 1.00 10.40 H new ATOM 0 HA SER A 100 3.072 -11.244 -2.246 1.00 45.24 H new ATOM 0 HB2 SER A 100 3.968 -13.484 -1.419 1.00 20.02 H new ATOM 0 HB3 SER A 100 3.793 -14.081 -3.057 1.00 20.02 H new ATOM 0 HG SER A 100 5.924 -13.294 -2.633 1.00 64.03 H new ATOM 1612 N ALA A 101 1.896 -12.927 -4.854 1.00 4.13 N ATOM 1613 CA ALA A 101 1.619 -12.889 -6.300 1.00 1.02 C ATOM 1614 C ALA A 101 0.386 -12.029 -6.681 1.00 44.12 C ATOM 1615 O ALA A 101 0.073 -11.872 -7.866 1.00 55.34 O ATOM 1616 CB ALA A 101 1.457 -14.304 -6.830 1.00 11.53 C ATOM 0 H ALA A 101 1.523 -13.754 -4.387 1.00 4.13 H new ATOM 0 HA ALA A 101 2.477 -12.405 -6.766 1.00 1.02 H new ATOM 0 HB1 ALA A 101 1.252 -14.271 -7.900 1.00 11.53 H new ATOM 0 HB2 ALA A 101 2.374 -14.866 -6.653 1.00 11.53 H new ATOM 0 HB3 ALA A 101 0.628 -14.792 -6.317 1.00 11.53 H new ATOM 1622 N SER A 102 -0.293 -11.472 -5.696 1.00 4.21 N ATOM 1623 CA SER A 102 -1.534 -10.704 -5.922 1.00 52.31 C ATOM 1624 C SER A 102 -1.291 -9.355 -6.630 1.00 41.21 C ATOM 1625 O SER A 102 -2.207 -8.757 -7.211 1.00 0.22 O ATOM 1626 CB SER A 102 -2.215 -10.463 -4.584 1.00 55.03 C ATOM 1627 OG SER A 102 -2.543 -11.683 -3.961 1.00 1.20 O ATOM 0 H SER A 102 -0.014 -11.530 -4.717 1.00 4.21 H new ATOM 0 HA SER A 102 -2.168 -11.295 -6.583 1.00 52.31 H new ATOM 0 HB2 SER A 102 -1.557 -9.884 -3.936 1.00 55.03 H new ATOM 0 HB3 SER A 102 -3.118 -9.871 -4.732 1.00 55.03 H new ATOM 0 HG SER A 102 -1.971 -12.396 -4.316 1.00 1.20 H new ATOM 1633 N ARG A 103 -0.056 -8.919 -6.607 1.00 50.53 N ATOM 1634 CA ARG A 103 0.352 -7.618 -7.120 1.00 44.34 C ATOM 1635 C ARG A 103 0.153 -7.478 -8.607 1.00 51.43 C ATOM 1636 O ARG A 103 0.060 -6.360 -9.113 1.00 63.25 O ATOM 1637 CB ARG A 103 1.790 -7.335 -6.720 1.00 31.30 C ATOM 1638 CG ARG A 103 2.824 -8.280 -7.305 1.00 13.01 C ATOM 1639 CD ARG A 103 4.160 -8.066 -6.635 1.00 71.33 C ATOM 1640 NE ARG A 103 4.087 -8.387 -5.205 1.00 71.03 N ATOM 1641 CZ ARG A 103 4.830 -7.834 -4.256 1.00 55.35 C ATOM 1642 NH1 ARG A 103 5.790 -6.964 -4.572 1.00 1.15 N ATOM 1643 NH2 ARG A 103 4.624 -8.168 -2.982 1.00 23.42 N ATOM 0 H ARG A 103 0.717 -9.464 -6.225 1.00 50.53 H new ATOM 0 HA ARG A 103 -0.299 -6.870 -6.667 1.00 44.34 H new ATOM 0 HB2 ARG A 103 2.040 -6.318 -7.021 1.00 31.30 H new ATOM 0 HB3 ARG A 103 1.862 -7.372 -5.633 1.00 31.30 H new ATOM 0 HG2 ARG A 103 2.502 -9.313 -7.170 1.00 13.01 H new ATOM 0 HG3 ARG A 103 2.916 -8.112 -8.378 1.00 13.01 H new ATOM 0 HD2 ARG A 103 4.915 -8.690 -7.114 1.00 71.33 H new ATOM 0 HD3 ARG A 103 4.474 -7.030 -6.764 1.00 71.33 H new ATOM 0 HE ARG A 103 3.409 -9.093 -4.917 1.00 71.03 H new ATOM 0 HH11 ARG A 103 5.956 -6.720 -5.548 1.00 1.15 H new ATOM 0 HH12 ARG A 103 6.358 -6.542 -3.837 1.00 1.15 H new ATOM 0 HH21 ARG A 103 3.899 -8.845 -2.743 1.00 23.42 H new ATOM 0 HH22 ARG A 103 5.191 -7.747 -2.246 1.00 23.42 H new ATOM 1657 N ASP A 104 0.043 -8.603 -9.288 1.00 2.34 N ATOM 1658 CA ASP A 104 -0.171 -8.638 -10.728 1.00 72.14 C ATOM 1659 C ASP A 104 -1.396 -7.825 -11.121 1.00 0.21 C ATOM 1660 O ASP A 104 -1.322 -6.950 -11.972 1.00 62.33 O ATOM 1661 CB ASP A 104 -0.333 -10.079 -11.198 1.00 22.45 C ATOM 1662 CG ASP A 104 -0.599 -10.184 -12.683 1.00 23.34 C ATOM 1663 OD1 ASP A 104 0.330 -9.962 -13.484 1.00 55.22 O ATOM 1664 OD2 ASP A 104 -1.732 -10.540 -13.074 1.00 2.30 O ATOM 0 H ASP A 104 0.100 -9.526 -8.858 1.00 2.34 H new ATOM 0 HA ASP A 104 0.701 -8.196 -11.210 1.00 72.14 H new ATOM 0 HB2 ASP A 104 0.570 -10.640 -10.955 1.00 22.45 H new ATOM 0 HB3 ASP A 104 -1.154 -10.544 -10.653 1.00 22.45 H new ATOM 1669 N ALA A 105 -2.494 -8.059 -10.428 1.00 3.01 N ATOM 1670 CA ALA A 105 -3.755 -7.379 -10.721 1.00 30.21 C ATOM 1671 C ALA A 105 -3.738 -5.911 -10.266 1.00 42.12 C ATOM 1672 O ALA A 105 -4.459 -5.068 -10.809 1.00 33.43 O ATOM 1673 CB ALA A 105 -4.917 -8.120 -10.073 1.00 44.23 C ATOM 0 H ALA A 105 -2.544 -8.719 -9.652 1.00 3.01 H new ATOM 0 HA ALA A 105 -3.885 -7.383 -11.803 1.00 30.21 H new ATOM 0 HB1 ALA A 105 -5.850 -7.603 -10.299 1.00 44.23 H new ATOM 0 HB2 ALA A 105 -4.962 -9.137 -10.462 1.00 44.23 H new ATOM 0 HB3 ALA A 105 -4.772 -8.151 -8.993 1.00 44.23 H new ATOM 1679 N LEU A 106 -2.893 -5.609 -9.303 1.00 55.21 N ATOM 1680 CA LEU A 106 -2.851 -4.280 -8.708 1.00 12.21 C ATOM 1681 C LEU A 106 -1.886 -3.343 -9.468 1.00 71.42 C ATOM 1682 O LEU A 106 -1.938 -2.112 -9.305 1.00 45.43 O ATOM 1683 CB LEU A 106 -2.447 -4.391 -7.223 1.00 71.02 C ATOM 1684 CG LEU A 106 -2.522 -3.102 -6.384 1.00 71.35 C ATOM 1685 CD1 LEU A 106 -3.954 -2.611 -6.269 1.00 12.33 C ATOM 1686 CD2 LEU A 106 -1.941 -3.324 -5.008 1.00 5.35 C ATOM 0 H LEU A 106 -2.220 -6.267 -8.910 1.00 55.21 H new ATOM 0 HA LEU A 106 -3.846 -3.842 -8.780 1.00 12.21 H new ATOM 0 HB2 LEU A 106 -3.084 -5.140 -6.753 1.00 71.02 H new ATOM 0 HB3 LEU A 106 -1.425 -4.768 -7.176 1.00 71.02 H new ATOM 0 HG LEU A 106 -1.934 -2.339 -6.894 1.00 71.35 H new ATOM 0 HD11 LEU A 106 -3.979 -1.700 -5.672 1.00 12.33 H new ATOM 0 HD12 LEU A 106 -4.349 -2.404 -7.264 1.00 12.33 H new ATOM 0 HD13 LEU A 106 -4.564 -3.376 -5.789 1.00 12.33 H new ATOM 0 HD21 LEU A 106 -2.004 -2.400 -4.433 1.00 5.35 H new ATOM 0 HD22 LEU A 106 -2.501 -4.108 -4.499 1.00 5.35 H new ATOM 0 HD23 LEU A 106 -0.897 -3.624 -5.098 1.00 5.35 H new ATOM 1698 N SER A 107 -1.056 -3.920 -10.322 1.00 32.35 N ATOM 1699 CA SER A 107 -0.018 -3.183 -11.040 1.00 70.43 C ATOM 1700 C SER A 107 -0.575 -2.038 -11.928 1.00 51.42 C ATOM 1701 O SER A 107 -0.204 -0.875 -11.757 1.00 2.43 O ATOM 1702 CB SER A 107 0.810 -4.150 -11.901 1.00 1.13 C ATOM 1703 OG SER A 107 1.395 -5.185 -11.114 1.00 10.34 O ATOM 0 H SER A 107 -1.080 -4.916 -10.540 1.00 32.35 H new ATOM 0 HA SER A 107 0.609 -2.715 -10.282 1.00 70.43 H new ATOM 0 HB2 SER A 107 0.173 -4.591 -12.668 1.00 1.13 H new ATOM 0 HB3 SER A 107 1.595 -3.597 -12.417 1.00 1.13 H new ATOM 0 HG SER A 107 0.691 -5.665 -10.630 1.00 10.34 H new ATOM 1709 N SER A 108 -1.509 -2.369 -12.806 1.00 45.41 N ATOM 1710 CA SER A 108 -1.981 -1.440 -13.829 1.00 21.24 C ATOM 1711 C SER A 108 -3.161 -0.574 -13.348 1.00 64.43 C ATOM 1712 O SER A 108 -3.651 0.299 -14.085 1.00 12.33 O ATOM 1713 CB SER A 108 -2.358 -2.252 -15.083 1.00 54.24 C ATOM 1714 OG SER A 108 -2.733 -1.438 -16.185 1.00 21.34 O ATOM 0 H SER A 108 -1.961 -3.283 -12.833 1.00 45.41 H new ATOM 0 HA SER A 108 -1.179 -0.739 -14.061 1.00 21.24 H new ATOM 0 HB2 SER A 108 -1.512 -2.876 -15.372 1.00 54.24 H new ATOM 0 HB3 SER A 108 -3.181 -2.924 -14.839 1.00 54.24 H new ATOM 0 HG SER A 108 -3.049 -0.570 -15.858 1.00 21.34 H new ATOM 1720 N VAL A 109 -3.617 -0.805 -12.143 1.00 22.11 N ATOM 1721 CA VAL A 109 -4.733 -0.034 -11.607 1.00 12.21 C ATOM 1722 C VAL A 109 -4.262 1.053 -10.655 1.00 15.54 C ATOM 1723 O VAL A 109 -4.929 2.063 -10.471 1.00 3.40 O ATOM 1724 CB VAL A 109 -5.780 -0.924 -10.910 1.00 41.55 C ATOM 1725 CG1 VAL A 109 -6.509 -1.780 -11.922 1.00 40.54 C ATOM 1726 CG2 VAL A 109 -5.121 -1.796 -9.881 1.00 43.01 C ATOM 0 H VAL A 109 -3.243 -1.513 -11.511 1.00 22.11 H new ATOM 0 HA VAL A 109 -5.211 0.438 -12.466 1.00 12.21 H new ATOM 0 HB VAL A 109 -6.504 -0.277 -10.414 1.00 41.55 H new ATOM 0 HG11 VAL A 109 -7.244 -2.401 -11.411 1.00 40.54 H new ATOM 0 HG12 VAL A 109 -7.015 -1.139 -12.644 1.00 40.54 H new ATOM 0 HG13 VAL A 109 -5.794 -2.417 -12.442 1.00 40.54 H new ATOM 0 HG21 VAL A 109 -5.873 -2.419 -9.397 1.00 43.01 H new ATOM 0 HG22 VAL A 109 -4.379 -2.432 -10.364 1.00 43.01 H new ATOM 0 HG23 VAL A 109 -4.632 -1.171 -9.134 1.00 43.01 H new ATOM 1736 N SER A 110 -3.119 0.844 -10.060 1.00 4.32 N ATOM 1737 CA SER A 110 -2.579 1.792 -9.116 1.00 63.55 C ATOM 1738 C SER A 110 -1.749 2.883 -9.806 1.00 1.44 C ATOM 1739 O SER A 110 -0.536 2.735 -9.990 1.00 30.23 O ATOM 1740 CB SER A 110 -1.741 1.055 -8.099 1.00 72.12 C ATOM 1741 OG SER A 110 -2.479 -0.011 -7.540 1.00 34.01 O ATOM 0 H SER A 110 -2.538 0.020 -10.212 1.00 4.32 H new ATOM 0 HA SER A 110 -3.411 2.293 -8.620 1.00 63.55 H new ATOM 0 HB2 SER A 110 -0.836 0.672 -8.571 1.00 72.12 H new ATOM 0 HB3 SER A 110 -1.425 1.740 -7.312 1.00 72.12 H new ATOM 0 HG SER A 110 -2.480 -0.769 -8.161 1.00 34.01 H new ATOM 1747 N GLU A 111 -2.424 3.897 -10.298 1.00 24.53 N ATOM 1748 CA GLU A 111 -1.770 5.044 -10.899 1.00 73.11 C ATOM 1749 C GLU A 111 -1.133 5.951 -9.842 1.00 13.10 C ATOM 1750 O GLU A 111 -1.812 6.374 -8.900 1.00 63.34 O ATOM 1751 CB GLU A 111 -2.752 5.865 -11.719 1.00 73.33 C ATOM 1752 CG GLU A 111 -2.086 7.016 -12.453 1.00 32.20 C ATOM 1753 CD GLU A 111 -3.054 7.913 -13.145 1.00 13.25 C ATOM 1754 OE1 GLU A 111 -3.436 7.618 -14.280 1.00 54.42 O ATOM 1755 OE2 GLU A 111 -3.426 8.961 -12.558 1.00 74.34 O ATOM 0 H GLU A 111 -3.442 3.953 -10.294 1.00 24.53 H new ATOM 0 HA GLU A 111 -0.987 4.651 -11.548 1.00 73.11 H new ATOM 0 HB2 GLU A 111 -3.246 5.216 -12.442 1.00 73.33 H new ATOM 0 HB3 GLU A 111 -3.527 6.259 -11.062 1.00 73.33 H new ATOM 0 HG2 GLU A 111 -1.503 7.602 -11.743 1.00 32.20 H new ATOM 0 HG3 GLU A 111 -1.386 6.614 -13.186 1.00 32.20 H new ATOM 1762 N GLY A 112 0.143 6.240 -9.997 1.00 31.35 N ATOM 1763 CA GLY A 112 0.776 7.247 -9.163 1.00 1.13 C ATOM 1764 C GLY A 112 1.418 6.704 -7.916 1.00 53.30 C ATOM 1765 O GLY A 112 1.912 7.467 -7.081 1.00 3.25 O ATOM 0 H GLY A 112 0.757 5.800 -10.682 1.00 31.35 H new ATOM 0 HA2 GLY A 112 1.533 7.765 -9.751 1.00 1.13 H new ATOM 0 HA3 GLY A 112 0.029 7.989 -8.880 1.00 1.13 H new ATOM 1769 N TYR A 113 1.440 5.410 -7.789 1.00 11.13 N ATOM 1770 CA TYR A 113 2.000 4.788 -6.617 1.00 41.24 C ATOM 1771 C TYR A 113 3.429 4.372 -6.841 1.00 21.10 C ATOM 1772 O TYR A 113 3.810 3.990 -7.949 1.00 70.42 O ATOM 1773 CB TYR A 113 1.191 3.574 -6.187 1.00 74.30 C ATOM 1774 CG TYR A 113 -0.180 3.877 -5.632 1.00 52.14 C ATOM 1775 CD1 TYR A 113 -1.263 4.074 -6.465 1.00 71.12 C ATOM 1776 CD2 TYR A 113 -0.388 3.946 -4.263 1.00 62.43 C ATOM 1777 CE1 TYR A 113 -2.514 4.331 -5.958 1.00 25.13 C ATOM 1778 CE2 TYR A 113 -1.635 4.205 -3.743 1.00 23.11 C ATOM 1779 CZ TYR A 113 -2.696 4.395 -4.594 1.00 33.12 C ATOM 1780 OH TYR A 113 -3.940 4.655 -4.083 1.00 4.32 O ATOM 0 H TYR A 113 1.076 4.759 -8.484 1.00 11.13 H new ATOM 0 HA TYR A 113 1.967 5.536 -5.825 1.00 41.24 H new ATOM 0 HB2 TYR A 113 1.079 2.910 -7.044 1.00 74.30 H new ATOM 0 HB3 TYR A 113 1.758 3.028 -5.433 1.00 74.30 H new ATOM 0 HD1 TYR A 113 -1.124 4.025 -7.535 1.00 71.12 H new ATOM 0 HD2 TYR A 113 0.445 3.794 -3.592 1.00 62.43 H new ATOM 0 HE1 TYR A 113 -3.350 4.482 -6.625 1.00 25.13 H new ATOM 0 HE2 TYR A 113 -1.778 4.258 -2.674 1.00 23.11 H new ATOM 0 HH TYR A 113 -4.292 3.848 -3.652 1.00 4.32 H new ATOM 1790 N LEU A 114 4.213 4.473 -5.803 1.00 33.44 N ATOM 1791 CA LEU A 114 5.559 4.006 -5.811 1.00 72.32 C ATOM 1792 C LEU A 114 5.481 2.567 -5.343 1.00 41.50 C ATOM 1793 O LEU A 114 4.976 2.312 -4.236 1.00 10.24 O ATOM 1794 CB LEU A 114 6.374 4.838 -4.797 1.00 74.02 C ATOM 1795 CG LEU A 114 7.925 4.793 -4.834 1.00 11.04 C ATOM 1796 CD1 LEU A 114 8.473 5.717 -3.778 1.00 62.54 C ATOM 1797 CD2 LEU A 114 8.488 3.403 -4.600 1.00 21.44 C ATOM 0 H LEU A 114 3.924 4.889 -4.918 1.00 33.44 H new ATOM 0 HA LEU A 114 6.031 4.090 -6.790 1.00 72.32 H new ATOM 0 HB2 LEU A 114 6.076 5.880 -4.916 1.00 74.02 H new ATOM 0 HB3 LEU A 114 6.063 4.530 -3.799 1.00 74.02 H new ATOM 0 HG LEU A 114 8.226 5.104 -5.834 1.00 11.04 H new ATOM 0 HD11 LEU A 114 9.562 5.689 -3.800 1.00 62.54 H new ATOM 0 HD12 LEU A 114 8.132 6.734 -3.972 1.00 62.54 H new ATOM 0 HD13 LEU A 114 8.121 5.397 -2.797 1.00 62.54 H new ATOM 0 HD21 LEU A 114 9.577 3.440 -4.638 1.00 21.44 H new ATOM 0 HD22 LEU A 114 8.172 3.042 -3.621 1.00 21.44 H new ATOM 0 HD23 LEU A 114 8.121 2.727 -5.372 1.00 21.44 H new ATOM 1809 N PRO A 115 5.888 1.605 -6.161 1.00 73.22 N ATOM 1810 CA PRO A 115 5.911 0.234 -5.726 1.00 3.21 C ATOM 1811 C PRO A 115 7.063 0.032 -4.744 1.00 62.43 C ATOM 1812 O PRO A 115 8.239 0.183 -5.097 1.00 50.41 O ATOM 1813 CB PRO A 115 6.135 -0.564 -7.018 1.00 22.30 C ATOM 1814 CG PRO A 115 6.782 0.395 -7.968 1.00 33.01 C ATOM 1815 CD PRO A 115 6.338 1.774 -7.561 1.00 35.24 C ATOM 0 HA PRO A 115 5.002 -0.075 -5.211 1.00 3.21 H new ATOM 0 HB2 PRO A 115 6.772 -1.431 -6.840 1.00 22.30 H new ATOM 0 HB3 PRO A 115 5.192 -0.938 -7.418 1.00 22.30 H new ATOM 0 HG2 PRO A 115 7.868 0.310 -7.924 1.00 33.01 H new ATOM 0 HG3 PRO A 115 6.486 0.181 -8.995 1.00 33.01 H new ATOM 0 HD2 PRO A 115 7.153 2.494 -7.634 1.00 35.24 H new ATOM 0 HD3 PRO A 115 5.532 2.139 -8.198 1.00 35.24 H new ATOM 1823 N ILE A 116 6.729 -0.282 -3.532 1.00 54.02 N ATOM 1824 CA ILE A 116 7.704 -0.454 -2.499 1.00 34.21 C ATOM 1825 C ILE A 116 7.438 -1.765 -1.782 1.00 70.35 C ATOM 1826 O ILE A 116 6.316 -2.045 -1.361 1.00 65.41 O ATOM 1827 CB ILE A 116 7.735 0.782 -1.528 1.00 45.25 C ATOM 1828 CG1 ILE A 116 8.647 0.548 -0.318 1.00 4.22 C ATOM 1829 CG2 ILE A 116 6.340 1.216 -1.100 1.00 73.42 C ATOM 1830 CD1 ILE A 116 8.696 1.732 0.621 1.00 50.04 C ATOM 0 H ILE A 116 5.766 -0.427 -3.228 1.00 54.02 H new ATOM 0 HA ILE A 116 8.701 -0.505 -2.937 1.00 34.21 H new ATOM 0 HB ILE A 116 8.165 1.606 -2.098 1.00 45.25 H new ATOM 0 HG12 ILE A 116 8.299 -0.328 0.229 1.00 4.22 H new ATOM 0 HG13 ILE A 116 9.655 0.326 -0.667 1.00 4.22 H new ATOM 0 HG21 ILE A 116 6.415 2.073 -0.430 1.00 73.42 H new ATOM 0 HG22 ILE A 116 5.759 1.493 -1.980 1.00 73.42 H new ATOM 0 HG23 ILE A 116 5.846 0.394 -0.583 1.00 73.42 H new ATOM 0 HD11 ILE A 116 9.357 1.506 1.457 1.00 50.04 H new ATOM 0 HD12 ILE A 116 9.072 2.605 0.087 1.00 50.04 H new ATOM 0 HD13 ILE A 116 7.694 1.940 0.997 1.00 50.04 H new ATOM 1842 N GLN A 117 8.447 -2.583 -1.705 1.00 15.11 N ATOM 1843 CA GLN A 117 8.300 -3.908 -1.168 1.00 34.12 C ATOM 1844 C GLN A 117 8.664 -3.940 0.296 1.00 65.45 C ATOM 1845 O GLN A 117 9.732 -3.472 0.696 1.00 13.15 O ATOM 1846 CB GLN A 117 9.168 -4.940 -1.924 1.00 62.14 C ATOM 1847 CG GLN A 117 8.930 -5.061 -3.435 1.00 63.54 C ATOM 1848 CD GLN A 117 9.413 -3.856 -4.229 1.00 2.21 C ATOM 1849 OE1 GLN A 117 10.370 -3.166 -3.835 1.00 33.32 O ATOM 1850 NE2 GLN A 117 8.786 -3.601 -5.342 1.00 3.53 N ATOM 0 H GLN A 117 9.393 -2.353 -2.011 1.00 15.11 H new ATOM 0 HA GLN A 117 7.251 -4.178 -1.293 1.00 34.12 H new ATOM 0 HB2 GLN A 117 10.216 -4.687 -1.763 1.00 62.14 H new ATOM 0 HB3 GLN A 117 9.004 -5.919 -1.474 1.00 62.14 H new ATOM 0 HG2 GLN A 117 9.436 -5.954 -3.803 1.00 63.54 H new ATOM 0 HG3 GLN A 117 7.864 -5.201 -3.616 1.00 63.54 H new ATOM 0 HE21 GLN A 117 8.005 -4.189 -5.634 1.00 3.53 H new ATOM 0 HE22 GLN A 117 9.076 -2.814 -5.922 1.00 3.53 H new ATOM 1859 N ALA A 118 7.792 -4.495 1.078 1.00 71.02 N ATOM 1860 CA ALA A 118 8.022 -4.671 2.474 1.00 2.23 C ATOM 1861 C ALA A 118 8.119 -6.151 2.744 1.00 34.01 C ATOM 1862 O ALA A 118 7.228 -6.910 2.378 1.00 51.51 O ATOM 1863 CB ALA A 118 6.887 -4.057 3.280 1.00 15.43 C ATOM 0 H ALA A 118 6.888 -4.843 0.758 1.00 71.02 H new ATOM 0 HA ALA A 118 8.945 -4.173 2.770 1.00 2.23 H new ATOM 0 HB1 ALA A 118 7.077 -4.200 4.344 1.00 15.43 H new ATOM 0 HB2 ALA A 118 6.822 -2.991 3.063 1.00 15.43 H new ATOM 0 HB3 ALA A 118 5.947 -4.540 3.012 1.00 15.43 H new ATOM 1869 N ASN A 119 9.191 -6.566 3.341 1.00 64.10 N ATOM 1870 CA ASN A 119 9.376 -7.978 3.662 1.00 40.44 C ATOM 1871 C ASN A 119 9.042 -8.184 5.122 1.00 41.00 C ATOM 1872 O ASN A 119 8.752 -9.294 5.575 1.00 72.43 O ATOM 1873 CB ASN A 119 10.833 -8.423 3.432 1.00 4.44 C ATOM 1874 CG ASN A 119 11.370 -8.235 2.016 1.00 34.04 C ATOM 1875 OD1 ASN A 119 10.636 -8.265 1.021 1.00 54.14 O ATOM 1876 ND2 ASN A 119 12.663 -8.054 1.917 1.00 71.32 N ATOM 0 H ASN A 119 9.962 -5.960 3.623 1.00 64.10 H new ATOM 0 HA ASN A 119 8.727 -8.567 3.014 1.00 40.44 H new ATOM 0 HB2 ASN A 119 11.474 -7.871 4.120 1.00 4.44 H new ATOM 0 HB3 ASN A 119 10.917 -9.478 3.695 1.00 4.44 H new ATOM 0 HD21 ASN A 119 13.092 -7.933 1.000 1.00 71.32 H new ATOM 0 HD22 ASN A 119 13.241 -8.034 2.757 1.00 71.32 H new ATOM 1883 N ASP A 120 9.117 -7.099 5.845 1.00 12.25 N ATOM 1884 CA ASP A 120 8.904 -7.046 7.266 1.00 14.32 C ATOM 1885 C ASP A 120 8.151 -5.748 7.561 1.00 71.22 C ATOM 1886 O ASP A 120 7.956 -4.937 6.649 1.00 41.23 O ATOM 1887 CB ASP A 120 10.289 -7.047 7.964 1.00 42.10 C ATOM 1888 CG ASP A 120 10.237 -7.057 9.473 1.00 31.33 C ATOM 1889 OD1 ASP A 120 10.219 -8.152 10.075 1.00 23.20 O ATOM 1890 OD2 ASP A 120 10.230 -5.969 10.083 1.00 24.32 O ATOM 0 H ASP A 120 9.338 -6.188 5.442 1.00 12.25 H new ATOM 0 HA ASP A 120 8.328 -7.897 7.628 1.00 14.32 H new ATOM 0 HB2 ASP A 120 10.849 -7.920 7.628 1.00 42.10 H new ATOM 0 HB3 ASP A 120 10.845 -6.167 7.639 1.00 42.10 H new ATOM 1895 N GLU A 121 7.777 -5.528 8.816 1.00 51.01 N ATOM 1896 CA GLU A 121 7.072 -4.319 9.260 1.00 43.11 C ATOM 1897 C GLU A 121 8.020 -3.104 9.067 1.00 50.43 C ATOM 1898 O GLU A 121 7.602 -1.961 8.881 1.00 11.11 O ATOM 1899 CB GLU A 121 6.671 -4.508 10.739 1.00 2.34 C ATOM 1900 CG GLU A 121 5.547 -3.603 11.284 1.00 14.13 C ATOM 1901 CD GLU A 121 5.887 -2.143 11.407 1.00 3.34 C ATOM 1902 OE1 GLU A 121 6.775 -1.792 12.219 1.00 44.05 O ATOM 1903 OE2 GLU A 121 5.275 -1.319 10.725 1.00 14.35 O ATOM 0 H GLU A 121 7.955 -6.192 9.570 1.00 51.01 H new ATOM 0 HA GLU A 121 6.166 -4.141 8.681 1.00 43.11 H new ATOM 0 HB2 GLU A 121 6.367 -5.546 10.877 1.00 2.34 H new ATOM 0 HB3 GLU A 121 7.558 -4.352 11.353 1.00 2.34 H new ATOM 0 HG2 GLU A 121 4.679 -3.701 10.633 1.00 14.13 H new ATOM 0 HG3 GLU A 121 5.252 -3.973 12.266 1.00 14.13 H new ATOM 1910 N SER A 122 9.290 -3.408 9.032 1.00 10.13 N ATOM 1911 CA SER A 122 10.346 -2.435 8.850 1.00 54.40 C ATOM 1912 C SER A 122 10.295 -1.825 7.428 1.00 73.05 C ATOM 1913 O SER A 122 10.849 -0.761 7.177 1.00 50.34 O ATOM 1914 CB SER A 122 11.697 -3.112 9.091 1.00 54.22 C ATOM 1915 OG SER A 122 11.711 -3.795 10.352 1.00 65.13 O ATOM 0 H SER A 122 9.633 -4.363 9.132 1.00 10.13 H new ATOM 0 HA SER A 122 10.211 -1.624 9.565 1.00 54.40 H new ATOM 0 HB2 SER A 122 11.902 -3.820 8.288 1.00 54.22 H new ATOM 0 HB3 SER A 122 12.491 -2.366 9.069 1.00 54.22 H new ATOM 0 HG SER A 122 11.518 -4.746 10.211 1.00 65.13 H new ATOM 1921 N GLY A 123 9.600 -2.493 6.512 1.00 23.03 N ATOM 1922 CA GLY A 123 9.459 -1.982 5.165 1.00 21.44 C ATOM 1923 C GLY A 123 8.434 -0.874 5.106 1.00 0.30 C ATOM 1924 O GLY A 123 8.356 -0.135 4.139 1.00 31.51 O ATOM 0 H GLY A 123 9.131 -3.383 6.682 1.00 23.03 H new ATOM 0 HA2 GLY A 123 10.421 -1.610 4.812 1.00 21.44 H new ATOM 0 HA3 GLY A 123 9.164 -2.790 4.496 1.00 21.44 H new ATOM 1928 N LEU A 124 7.660 -0.750 6.168 1.00 22.01 N ATOM 1929 CA LEU A 124 6.644 0.273 6.260 1.00 24.20 C ATOM 1930 C LEU A 124 7.170 1.385 7.156 1.00 74.53 C ATOM 1931 O LEU A 124 6.410 2.101 7.814 1.00 55.12 O ATOM 1932 CB LEU A 124 5.324 -0.280 6.850 1.00 63.43 C ATOM 1933 CG LEU A 124 4.715 -1.548 6.209 1.00 72.15 C ATOM 1934 CD1 LEU A 124 5.350 -2.785 6.753 1.00 4.31 C ATOM 1935 CD2 LEU A 124 3.208 -1.577 6.401 1.00 13.43 C ATOM 0 H LEU A 124 7.720 -1.355 6.987 1.00 22.01 H new ATOM 0 HA LEU A 124 6.427 0.643 5.258 1.00 24.20 H new ATOM 0 HB2 LEU A 124 5.493 -0.489 7.907 1.00 63.43 H new ATOM 0 HB3 LEU A 124 4.577 0.512 6.797 1.00 63.43 H new ATOM 0 HG LEU A 124 4.919 -1.516 5.139 1.00 72.15 H new ATOM 0 HD11 LEU A 124 4.902 -3.661 6.284 1.00 4.31 H new ATOM 0 HD12 LEU A 124 6.419 -2.768 6.542 1.00 4.31 H new ATOM 0 HD13 LEU A 124 5.193 -2.831 7.831 1.00 4.31 H new ATOM 0 HD21 LEU A 124 2.800 -2.478 5.942 1.00 13.43 H new ATOM 0 HD22 LEU A 124 2.977 -1.576 7.466 1.00 13.43 H new ATOM 0 HD23 LEU A 124 2.765 -0.698 5.932 1.00 13.43 H new ATOM 1947 N ASP A 125 8.474 1.503 7.211 1.00 45.01 N ATOM 1948 CA ASP A 125 9.122 2.534 7.995 1.00 34.31 C ATOM 1949 C ASP A 125 9.234 3.808 7.193 1.00 44.33 C ATOM 1950 O ASP A 125 9.942 3.858 6.183 1.00 32.02 O ATOM 1951 CB ASP A 125 10.486 2.071 8.491 1.00 34.25 C ATOM 1952 CG ASP A 125 11.315 3.176 9.121 1.00 60.14 C ATOM 1953 OD1 ASP A 125 10.938 3.695 10.206 1.00 43.44 O ATOM 1954 OD2 ASP A 125 12.388 3.502 8.581 1.00 64.12 O ATOM 0 H ASP A 125 9.119 0.888 6.715 1.00 45.01 H new ATOM 0 HA ASP A 125 8.508 2.736 8.873 1.00 34.31 H new ATOM 0 HB2 ASP A 125 10.346 1.274 9.221 1.00 34.25 H new ATOM 0 HB3 ASP A 125 11.041 1.644 7.655 1.00 34.25 H new ATOM 1959 N ALA A 126 8.529 4.828 7.660 1.00 51.41 N ATOM 1960 CA ALA A 126 8.408 6.122 7.000 1.00 42.14 C ATOM 1961 C ALA A 126 9.754 6.733 6.665 1.00 1.11 C ATOM 1962 O ALA A 126 9.917 7.305 5.596 1.00 72.50 O ATOM 1963 CB ALA A 126 7.593 7.076 7.861 1.00 12.43 C ATOM 0 H ALA A 126 8.009 4.777 8.536 1.00 51.41 H new ATOM 0 HA ALA A 126 7.892 5.953 6.055 1.00 42.14 H new ATOM 0 HB1 ALA A 126 7.509 8.039 7.358 1.00 12.43 H new ATOM 0 HB2 ALA A 126 6.597 6.662 8.020 1.00 12.43 H new ATOM 0 HB3 ALA A 126 8.088 7.211 8.823 1.00 12.43 H new ATOM 1969 N GLU A 127 10.721 6.558 7.558 1.00 45.05 N ATOM 1970 CA GLU A 127 12.062 7.116 7.394 1.00 60.53 C ATOM 1971 C GLU A 127 12.677 6.654 6.078 1.00 13.45 C ATOM 1972 O GLU A 127 13.145 7.473 5.267 1.00 1.11 O ATOM 1973 CB GLU A 127 12.954 6.667 8.535 1.00 71.23 C ATOM 1974 CG GLU A 127 12.421 6.978 9.915 1.00 5.41 C ATOM 1975 CD GLU A 127 12.232 8.444 10.156 1.00 15.20 C ATOM 1976 OE1 GLU A 127 13.233 9.170 10.245 1.00 24.45 O ATOM 1977 OE2 GLU A 127 11.080 8.890 10.297 1.00 53.11 O ATOM 0 H GLU A 127 10.599 6.024 8.419 1.00 45.05 H new ATOM 0 HA GLU A 127 11.980 8.203 7.393 1.00 60.53 H new ATOM 0 HB2 GLU A 127 13.109 5.591 8.455 1.00 71.23 H new ATOM 0 HB3 GLU A 127 13.930 7.139 8.423 1.00 71.23 H new ATOM 0 HG2 GLU A 127 11.468 6.467 10.053 1.00 5.41 H new ATOM 0 HG3 GLU A 127 13.108 6.579 10.662 1.00 5.41 H new ATOM 1984 N GLU A 128 12.637 5.355 5.847 1.00 72.31 N ATOM 1985 CA GLU A 128 13.181 4.792 4.634 1.00 52.34 C ATOM 1986 C GLU A 128 12.323 5.138 3.441 1.00 41.22 C ATOM 1987 O GLU A 128 12.839 5.369 2.349 1.00 21.45 O ATOM 1988 CB GLU A 128 13.357 3.281 4.739 1.00 64.24 C ATOM 1989 CG GLU A 128 14.328 2.854 5.821 1.00 14.54 C ATOM 1990 CD GLU A 128 15.665 3.537 5.694 1.00 32.40 C ATOM 1991 OE1 GLU A 128 16.427 3.214 4.762 1.00 15.41 O ATOM 1992 OE2 GLU A 128 15.962 4.419 6.508 1.00 65.24 O ATOM 0 H GLU A 128 12.232 4.672 6.487 1.00 72.31 H new ATOM 0 HA GLU A 128 14.167 5.234 4.493 1.00 52.34 H new ATOM 0 HB2 GLU A 128 12.387 2.824 4.933 1.00 64.24 H new ATOM 0 HB3 GLU A 128 13.704 2.897 3.780 1.00 64.24 H new ATOM 0 HG2 GLU A 128 13.900 3.077 6.798 1.00 14.54 H new ATOM 0 HG3 GLU A 128 14.469 1.774 5.774 1.00 14.54 H new ATOM 1999 N ILE A 129 11.016 5.218 3.652 1.00 42.43 N ATOM 2000 CA ILE A 129 10.090 5.550 2.575 1.00 51.41 C ATOM 2001 C ILE A 129 10.369 6.967 2.047 1.00 41.41 C ATOM 2002 O ILE A 129 10.229 7.217 0.855 1.00 5.03 O ATOM 2003 CB ILE A 129 8.597 5.409 2.996 1.00 3.22 C ATOM 2004 CG1 ILE A 129 8.318 3.998 3.532 1.00 12.03 C ATOM 2005 CG2 ILE A 129 7.670 5.705 1.807 1.00 54.02 C ATOM 2006 CD1 ILE A 129 6.900 3.790 4.033 1.00 51.44 C ATOM 0 H ILE A 129 10.573 5.058 4.557 1.00 42.43 H new ATOM 0 HA ILE A 129 10.260 4.827 1.778 1.00 51.41 H new ATOM 0 HB ILE A 129 8.400 6.133 3.787 1.00 3.22 H new ATOM 0 HG12 ILE A 129 8.522 3.275 2.742 1.00 12.03 H new ATOM 0 HG13 ILE A 129 9.013 3.787 4.345 1.00 12.03 H new ATOM 0 HG21 ILE A 129 6.631 5.601 2.121 1.00 54.02 H new ATOM 0 HG22 ILE A 129 7.843 6.722 1.455 1.00 54.02 H new ATOM 0 HG23 ILE A 129 7.877 5.002 1.000 1.00 54.02 H new ATOM 0 HD11 ILE A 129 6.788 2.768 4.394 1.00 51.44 H new ATOM 0 HD12 ILE A 129 6.696 4.486 4.846 1.00 51.44 H new ATOM 0 HD13 ILE A 129 6.197 3.967 3.219 1.00 51.44 H new ATOM 2018 N ILE A 130 10.806 7.877 2.935 1.00 31.41 N ATOM 2019 CA ILE A 130 11.191 9.244 2.524 1.00 34.23 C ATOM 2020 C ILE A 130 12.316 9.163 1.485 1.00 64.21 C ATOM 2021 O ILE A 130 12.308 9.865 0.471 1.00 72.53 O ATOM 2022 CB ILE A 130 11.684 10.115 3.722 1.00 72.23 C ATOM 2023 CG1 ILE A 130 10.620 10.199 4.820 1.00 61.21 C ATOM 2024 CG2 ILE A 130 12.048 11.523 3.241 1.00 62.35 C ATOM 2025 CD1 ILE A 130 11.061 10.952 6.061 1.00 55.21 C ATOM 0 H ILE A 130 10.902 7.696 3.934 1.00 31.41 H new ATOM 0 HA ILE A 130 10.301 9.717 2.109 1.00 34.23 H new ATOM 0 HB ILE A 130 12.570 9.638 4.140 1.00 72.23 H new ATOM 0 HG12 ILE A 130 9.732 10.682 4.413 1.00 61.21 H new ATOM 0 HG13 ILE A 130 10.330 9.188 5.107 1.00 61.21 H new ATOM 0 HG21 ILE A 130 12.390 12.119 4.087 1.00 62.35 H new ATOM 0 HG22 ILE A 130 12.842 11.459 2.497 1.00 62.35 H new ATOM 0 HG23 ILE A 130 11.171 11.994 2.796 1.00 62.35 H new ATOM 0 HD11 ILE A 130 10.248 10.964 6.787 1.00 55.21 H new ATOM 0 HD12 ILE A 130 11.930 10.458 6.497 1.00 55.21 H new ATOM 0 HD13 ILE A 130 11.322 11.975 5.792 1.00 55.21 H new ATOM 2037 N ARG A 131 13.249 8.260 1.731 1.00 72.14 N ATOM 2038 CA ARG A 131 14.375 8.039 0.832 1.00 33.45 C ATOM 2039 C ARG A 131 13.861 7.477 -0.496 1.00 4.14 C ATOM 2040 O ARG A 131 14.239 7.946 -1.579 1.00 54.22 O ATOM 2041 CB ARG A 131 15.366 7.048 1.454 1.00 71.02 C ATOM 2042 CG ARG A 131 15.902 7.461 2.819 1.00 53.30 C ATOM 2043 CD ARG A 131 16.826 6.395 3.393 1.00 64.24 C ATOM 2044 NE ARG A 131 18.010 6.182 2.550 1.00 45.54 N ATOM 2045 CZ ARG A 131 18.826 5.119 2.614 1.00 20.53 C ATOM 2046 NH1 ARG A 131 18.549 4.094 3.415 1.00 52.14 N ATOM 2047 NH2 ARG A 131 19.903 5.073 1.844 1.00 1.23 N ATOM 0 H ARG A 131 13.250 7.660 2.556 1.00 72.14 H new ATOM 0 HA ARG A 131 14.884 8.988 0.661 1.00 33.45 H new ATOM 0 HB2 ARG A 131 14.879 6.077 1.548 1.00 71.02 H new ATOM 0 HB3 ARG A 131 16.206 6.918 0.772 1.00 71.02 H new ATOM 0 HG2 ARG A 131 16.441 8.404 2.731 1.00 53.30 H new ATOM 0 HG3 ARG A 131 15.070 7.632 3.503 1.00 53.30 H new ATOM 0 HD2 ARG A 131 17.142 6.689 4.394 1.00 64.24 H new ATOM 0 HD3 ARG A 131 16.279 5.457 3.494 1.00 64.24 H new ATOM 0 HE ARG A 131 18.230 6.900 1.860 1.00 45.54 H new ATOM 0 HH11 ARG A 131 17.707 4.110 3.991 1.00 52.14 H new ATOM 0 HH12 ARG A 131 19.178 3.292 3.454 1.00 52.14 H new ATOM 0 HH21 ARG A 131 20.108 5.843 1.207 1.00 1.23 H new ATOM 0 HH22 ARG A 131 20.527 4.268 1.888 1.00 1.23 H new ATOM 2061 N LYS A 132 12.956 6.500 -0.388 1.00 72.52 N ATOM 2062 CA LYS A 132 12.359 5.828 -1.545 1.00 1.20 C ATOM 2063 C LYS A 132 11.630 6.848 -2.414 1.00 43.42 C ATOM 2064 O LYS A 132 11.859 6.935 -3.615 1.00 63.44 O ATOM 2065 CB LYS A 132 11.334 4.756 -1.100 1.00 3.14 C ATOM 2066 CG LYS A 132 11.831 3.745 -0.062 1.00 74.03 C ATOM 2067 CD LYS A 132 12.958 2.853 -0.553 1.00 41.12 C ATOM 2068 CE LYS A 132 12.507 1.900 -1.660 1.00 62.52 C ATOM 2069 NZ LYS A 132 13.592 0.991 -2.090 1.00 1.22 N ATOM 0 H LYS A 132 12.616 6.152 0.508 1.00 72.52 H new ATOM 0 HA LYS A 132 13.164 5.350 -2.103 1.00 1.20 H new ATOM 0 HB2 LYS A 132 10.459 5.264 -0.694 1.00 3.14 H new ATOM 0 HB3 LYS A 132 11.004 4.209 -1.983 1.00 3.14 H new ATOM 0 HG2 LYS A 132 12.169 4.285 0.822 1.00 74.03 H new ATOM 0 HG3 LYS A 132 10.995 3.118 0.248 1.00 74.03 H new ATOM 0 HD2 LYS A 132 13.774 3.474 -0.922 1.00 41.12 H new ATOM 0 HD3 LYS A 132 13.350 2.274 0.283 1.00 41.12 H new ATOM 0 HE2 LYS A 132 11.660 1.311 -1.308 1.00 62.52 H new ATOM 0 HE3 LYS A 132 12.159 2.478 -2.516 1.00 62.52 H new ATOM 0 HZ1 LYS A 132 13.242 0.363 -2.841 1.00 1.22 H new ATOM 0 HZ2 LYS A 132 14.391 1.550 -2.451 1.00 1.22 H new ATOM 0 HZ3 LYS A 132 13.907 0.419 -1.280 1.00 1.22 H new ATOM 2083 N VAL A 133 10.761 7.628 -1.793 1.00 32.42 N ATOM 2084 CA VAL A 133 9.966 8.605 -2.508 1.00 24.44 C ATOM 2085 C VAL A 133 10.834 9.716 -3.121 1.00 24.31 C ATOM 2086 O VAL A 133 10.579 10.150 -4.255 1.00 55.43 O ATOM 2087 CB VAL A 133 8.787 9.181 -1.654 1.00 73.51 C ATOM 2088 CG1 VAL A 133 9.257 10.040 -0.499 1.00 74.43 C ATOM 2089 CG2 VAL A 133 7.794 9.925 -2.519 1.00 23.25 C ATOM 0 H VAL A 133 10.590 7.601 -0.788 1.00 32.42 H new ATOM 0 HA VAL A 133 9.501 8.068 -3.335 1.00 24.44 H new ATOM 0 HB VAL A 133 8.281 8.322 -1.213 1.00 73.51 H new ATOM 0 HG11 VAL A 133 8.394 10.409 0.054 1.00 74.43 H new ATOM 0 HG12 VAL A 133 9.886 9.446 0.164 1.00 74.43 H new ATOM 0 HG13 VAL A 133 9.830 10.884 -0.883 1.00 74.43 H new ATOM 0 HG21 VAL A 133 6.988 10.313 -1.896 1.00 23.25 H new ATOM 0 HG22 VAL A 133 8.296 10.753 -3.019 1.00 23.25 H new ATOM 0 HG23 VAL A 133 7.382 9.246 -3.266 1.00 23.25 H new ATOM 2099 N ARG A 134 11.873 10.142 -2.409 1.00 70.35 N ATOM 2100 CA ARG A 134 12.785 11.143 -2.938 1.00 22.30 C ATOM 2101 C ARG A 134 13.540 10.641 -4.149 1.00 0.21 C ATOM 2102 O ARG A 134 13.615 11.325 -5.170 1.00 74.31 O ATOM 2103 CB ARG A 134 13.789 11.653 -1.894 1.00 32.44 C ATOM 2104 CG ARG A 134 13.357 12.891 -1.109 1.00 65.34 C ATOM 2105 CD ARG A 134 13.013 14.052 -2.048 1.00 32.00 C ATOM 2106 NE ARG A 134 13.997 14.215 -3.141 1.00 61.52 N ATOM 2107 CZ ARG A 134 13.727 14.864 -4.287 1.00 33.51 C ATOM 2108 NH1 ARG A 134 12.803 15.818 -4.311 1.00 10.34 N ATOM 2109 NH2 ARG A 134 14.477 14.655 -5.363 1.00 32.45 N ATOM 0 H ARG A 134 12.101 9.811 -1.472 1.00 70.35 H new ATOM 0 HA ARG A 134 12.148 11.977 -3.233 1.00 22.30 H new ATOM 0 HB2 ARG A 134 13.990 10.848 -1.186 1.00 32.44 H new ATOM 0 HB3 ARG A 134 14.729 11.875 -2.399 1.00 32.44 H new ATOM 0 HG2 ARG A 134 12.491 12.650 -0.493 1.00 65.34 H new ATOM 0 HG3 ARG A 134 14.156 13.192 -0.432 1.00 65.34 H new ATOM 0 HD2 ARG A 134 12.025 13.886 -2.477 1.00 32.00 H new ATOM 0 HD3 ARG A 134 12.960 14.976 -1.472 1.00 32.00 H new ATOM 0 HE ARG A 134 14.927 13.815 -3.019 1.00 61.52 H new ATOM 0 HH11 ARG A 134 12.297 16.059 -3.459 1.00 10.34 H new ATOM 0 HH12 ARG A 134 12.600 16.309 -5.181 1.00 10.34 H new ATOM 0 HH21 ARG A 134 15.259 14.001 -5.321 1.00 32.45 H new ATOM 0 HH22 ARG A 134 14.271 15.148 -6.232 1.00 32.45 H new ATOM 2123 N LEU A 135 14.079 9.463 -4.055 1.00 31.23 N ATOM 2124 CA LEU A 135 14.900 8.951 -5.119 1.00 23.52 C ATOM 2125 C LEU A 135 14.068 8.402 -6.285 1.00 30.41 C ATOM 2126 O LEU A 135 14.276 8.789 -7.441 1.00 75.04 O ATOM 2127 CB LEU A 135 15.858 7.888 -4.571 1.00 50.14 C ATOM 2128 CG LEU A 135 16.892 7.325 -5.549 1.00 61.33 C ATOM 2129 CD1 LEU A 135 17.811 8.426 -6.068 1.00 70.55 C ATOM 2130 CD2 LEU A 135 17.699 6.228 -4.885 1.00 13.14 C ATOM 0 H LEU A 135 13.968 8.837 -3.257 1.00 31.23 H new ATOM 0 HA LEU A 135 15.482 9.780 -5.521 1.00 23.52 H new ATOM 0 HB2 LEU A 135 16.391 8.315 -3.721 1.00 50.14 H new ATOM 0 HB3 LEU A 135 15.263 7.058 -4.190 1.00 50.14 H new ATOM 0 HG LEU A 135 16.360 6.902 -6.401 1.00 61.33 H new ATOM 0 HD11 LEU A 135 18.536 7.998 -6.761 1.00 70.55 H new ATOM 0 HD12 LEU A 135 17.218 9.182 -6.584 1.00 70.55 H new ATOM 0 HD13 LEU A 135 18.337 8.886 -5.231 1.00 70.55 H new ATOM 0 HD21 LEU A 135 18.431 5.836 -5.591 1.00 13.14 H new ATOM 0 HD22 LEU A 135 18.215 6.632 -4.014 1.00 13.14 H new ATOM 0 HD23 LEU A 135 17.032 5.425 -4.571 1.00 13.14 H new ATOM 2142 N HIS A 136 13.106 7.563 -5.974 1.00 11.31 N ATOM 2143 CA HIS A 136 12.334 6.872 -6.995 1.00 41.43 C ATOM 2144 C HIS A 136 11.139 7.686 -7.521 1.00 42.05 C ATOM 2145 O HIS A 136 11.020 7.915 -8.720 1.00 34.33 O ATOM 2146 CB HIS A 136 11.846 5.505 -6.428 1.00 13.13 C ATOM 2147 CG HIS A 136 11.026 4.637 -7.364 1.00 60.54 C ATOM 2148 ND1 HIS A 136 11.432 3.406 -7.813 1.00 54.35 N ATOM 2149 CD2 HIS A 136 9.779 4.820 -7.878 1.00 63.33 C ATOM 2150 CE1 HIS A 136 10.453 2.894 -8.564 1.00 32.34 C ATOM 2151 NE2 HIS A 136 9.426 3.716 -8.630 1.00 45.40 N ATOM 0 H HIS A 136 12.834 7.338 -5.017 1.00 11.31 H new ATOM 0 HA HIS A 136 12.994 6.722 -7.849 1.00 41.43 H new ATOM 0 HB2 HIS A 136 12.720 4.935 -6.112 1.00 13.13 H new ATOM 0 HB3 HIS A 136 11.252 5.699 -5.535 1.00 13.13 H new ATOM 0 HD2 HIS A 136 9.162 5.692 -7.722 1.00 63.33 H new ATOM 0 HE1 HIS A 136 10.498 1.932 -9.053 1.00 32.34 H new ATOM 0 HE2 HIS A 136 8.551 3.568 -9.133 1.00 45.40 H new