USER MOD reduce.3.24.130724 H: found=0, std=0, add=932, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 933 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 5 MET CE :methyl -110:sc= -0.348 (180deg=-2.8!) USER MOD Single : A 8 GLN : amide:sc= -0.0102 K(o=-0.01,f=-0.84) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 171:sc= 0.0174 (180deg=0.0101) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc= -0.028 X(o=-0.028,f=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 SER OG : rot 180:sc= -0.205 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 LYS NZ :NH3+ -136:sc= 0.344 (180deg=-0.622) USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 63 MET CE :methyl 152:sc= -1.79 (180deg=-4.28!) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 ASN : amide:sc= -0.651 K(o=-0.65,f=-4.1!) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot -46:sc= 0.187 USER MOD Single : A 84 GLN : amide:sc= -0.467 X(o=-0.47,f=-0.66) USER MOD Single : A 86 TYR OH : rot 96:sc= -2.56! USER MOD Single : A 90 TYR OH : rot 180:sc= -0.0605 USER MOD Single : A 94 LYS NZ :NH3+ -157:sc= 0 (180deg=-0.138) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 17 N GLU A 2 -15.022 1.409 7.453 1.00 0.00 N ATOM 18 CA GLU A 2 -14.863 0.408 6.412 1.00 0.00 C ATOM 19 C GLU A 2 -14.689 1.083 5.050 1.00 0.00 C ATOM 20 O GLU A 2 -15.592 1.770 4.573 1.00 0.00 O ATOM 21 CB GLU A 2 -16.048 -0.559 6.397 1.00 0.00 C ATOM 22 CG GLU A 2 -15.697 -1.845 5.646 1.00 0.00 C ATOM 23 CD GLU A 2 -16.834 -2.864 5.741 1.00 0.00 C ATOM 24 OE1 GLU A 2 -16.827 -3.632 6.727 1.00 0.00 O ATOM 25 OE2 GLU A 2 -17.685 -2.852 4.825 1.00 0.00 O ATOM 0 HA GLU A 2 -13.965 -0.172 6.626 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -16.339 -0.799 7.420 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -16.906 -0.081 5.925 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -15.496 -1.616 4.600 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -14.784 -2.274 6.059 1.00 0.00 H new ATOM 32 N TRP A 3 -13.523 0.863 4.461 1.00 0.00 N ATOM 33 CA TRP A 3 -13.219 1.442 3.163 1.00 0.00 C ATOM 34 C TRP A 3 -13.381 0.346 2.108 1.00 0.00 C ATOM 35 O TRP A 3 -13.073 -0.817 2.363 1.00 0.00 O ATOM 36 CB TRP A 3 -11.826 2.076 3.158 1.00 0.00 C ATOM 37 CG TRP A 3 -11.498 2.867 4.425 1.00 0.00 C ATOM 38 CD1 TRP A 3 -10.840 2.445 5.514 1.00 0.00 C ATOM 39 CD2 TRP A 3 -11.841 4.243 4.693 1.00 0.00 C ATOM 40 NE1 TRP A 3 -10.734 3.444 6.460 1.00 0.00 N ATOM 41 CE2 TRP A 3 -11.362 4.572 5.945 1.00 0.00 C ATOM 42 CE3 TRP A 3 -12.533 5.178 3.904 1.00 0.00 C ATOM 43 CZ2 TRP A 3 -11.524 5.839 6.519 1.00 0.00 C ATOM 44 CZ3 TRP A 3 -12.686 6.440 4.492 1.00 0.00 C ATOM 45 CH2 TRP A 3 -12.211 6.787 5.751 1.00 0.00 C ATOM 0 H TRP A 3 -12.777 0.292 4.858 1.00 0.00 H new ATOM 0 HA TRP A 3 -13.909 2.254 2.931 1.00 0.00 H new ATOM 0 HB2 TRP A 3 -11.081 1.291 3.029 1.00 0.00 H new ATOM 0 HB3 TRP A 3 -11.743 2.739 2.297 1.00 0.00 H new ATOM 0 HD1 TRP A 3 -10.443 1.448 5.636 1.00 0.00 H new ATOM 0 HE1 TRP A 3 -10.279 3.369 7.370 1.00 0.00 H new ATOM 0 HE3 TRP A 3 -12.916 4.942 2.922 1.00 0.00 H new ATOM 0 HZ2 TRP A 3 -11.140 6.072 7.501 1.00 0.00 H new ATOM 0 HZ3 TRP A 3 -13.210 7.197 3.927 1.00 0.00 H new ATOM 0 HH2 TRP A 3 -12.371 7.784 6.135 1.00 0.00 H new ATOM 56 N GLU A 4 -13.864 0.756 0.944 1.00 0.00 N ATOM 57 CA GLU A 4 -14.070 -0.176 -0.151 1.00 0.00 C ATOM 58 C GLU A 4 -13.211 0.219 -1.354 1.00 0.00 C ATOM 59 O GLU A 4 -12.924 1.398 -1.555 1.00 0.00 O ATOM 60 CB GLU A 4 -15.549 -0.253 -0.535 1.00 0.00 C ATOM 61 CG GLU A 4 -15.987 1.007 -1.284 1.00 0.00 C ATOM 62 CD GLU A 4 -17.360 0.812 -1.931 1.00 0.00 C ATOM 63 OE1 GLU A 4 -18.226 0.217 -1.254 1.00 0.00 O ATOM 64 OE2 GLU A 4 -17.512 1.261 -3.087 1.00 0.00 O ATOM 0 H GLU A 4 -14.119 1.722 0.736 1.00 0.00 H new ATOM 0 HA GLU A 4 -13.762 -1.168 0.180 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -15.721 -1.130 -1.159 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -16.155 -0.376 0.362 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -16.023 1.850 -0.594 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -15.252 1.253 -2.050 1.00 0.00 H new ATOM 71 N MET A 5 -12.826 -0.789 -2.123 1.00 0.00 N ATOM 72 CA MET A 5 -12.006 -0.561 -3.300 1.00 0.00 C ATOM 73 C MET A 5 -12.253 -1.640 -4.357 1.00 0.00 C ATOM 74 O MET A 5 -12.660 -2.753 -4.030 1.00 0.00 O ATOM 75 CB MET A 5 -10.529 -0.565 -2.902 1.00 0.00 C ATOM 76 CG MET A 5 -9.954 0.853 -2.915 1.00 0.00 C ATOM 77 SD MET A 5 -8.171 0.790 -2.870 1.00 0.00 S ATOM 78 CE MET A 5 -7.892 1.143 -1.142 1.00 0.00 C ATOM 0 H MET A 5 -13.067 -1.766 -1.954 1.00 0.00 H new ATOM 0 HA MET A 5 -12.274 0.406 -3.725 1.00 0.00 H new ATOM 0 HB2 MET A 5 -10.418 -0.997 -1.908 1.00 0.00 H new ATOM 0 HB3 MET A 5 -9.965 -1.196 -3.589 1.00 0.00 H new ATOM 0 HG2 MET A 5 -10.285 1.380 -3.810 1.00 0.00 H new ATOM 0 HG3 MET A 5 -10.328 1.414 -2.058 1.00 0.00 H new ATOM 0 HE1 MET A 5 -7.450 2.134 -1.040 1.00 0.00 H new ATOM 0 HE2 MET A 5 -8.841 1.112 -0.606 1.00 0.00 H new ATOM 0 HE3 MET A 5 -7.215 0.399 -0.723 1.00 0.00 H new ATOM 88 N GLY A 6 -11.996 -1.271 -5.604 1.00 0.00 N ATOM 89 CA GLY A 6 -12.185 -2.193 -6.711 1.00 0.00 C ATOM 90 C GLY A 6 -10.918 -2.296 -7.562 1.00 0.00 C ATOM 91 O GLY A 6 -10.880 -1.800 -8.687 1.00 0.00 O ATOM 0 H GLY A 6 -11.659 -0.346 -5.872 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -12.450 -3.178 -6.327 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -13.017 -1.857 -7.330 1.00 0.00 H new ATOM 95 N LEU A 7 -9.911 -2.942 -6.992 1.00 0.00 N ATOM 96 CA LEU A 7 -8.646 -3.115 -7.684 1.00 0.00 C ATOM 97 C LEU A 7 -8.798 -4.201 -8.751 1.00 0.00 C ATOM 98 O LEU A 7 -9.530 -4.022 -9.723 1.00 0.00 O ATOM 99 CB LEU A 7 -7.521 -3.390 -6.684 1.00 0.00 C ATOM 100 CG LEU A 7 -7.849 -4.375 -5.560 1.00 0.00 C ATOM 101 CD1 LEU A 7 -6.624 -5.214 -5.190 1.00 0.00 C ATOM 102 CD2 LEU A 7 -8.433 -3.648 -4.347 1.00 0.00 C ATOM 0 H LEU A 7 -9.946 -3.352 -6.059 1.00 0.00 H new ATOM 0 HA LEU A 7 -8.366 -2.197 -8.200 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -6.659 -3.769 -7.233 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -7.222 -2.443 -6.235 1.00 0.00 H new ATOM 0 HG LEU A 7 -8.613 -5.063 -5.922 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -6.885 -5.905 -4.389 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -6.292 -5.778 -6.062 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -5.821 -4.557 -4.855 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -8.657 -4.371 -3.563 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -7.710 -2.922 -3.975 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -9.348 -3.132 -4.638 1.00 0.00 H new ATOM 114 N GLN A 8 -8.094 -5.302 -8.535 1.00 0.00 N ATOM 115 CA GLN A 8 -8.142 -6.416 -9.466 1.00 0.00 C ATOM 116 C GLN A 8 -7.600 -7.685 -8.804 1.00 0.00 C ATOM 117 O GLN A 8 -6.882 -7.612 -7.808 1.00 0.00 O ATOM 118 CB GLN A 8 -7.370 -6.094 -10.747 1.00 0.00 C ATOM 119 CG GLN A 8 -8.215 -6.393 -11.987 1.00 0.00 C ATOM 120 CD GLN A 8 -7.371 -6.303 -13.260 1.00 0.00 C ATOM 121 OE1 GLN A 8 -6.202 -6.651 -13.287 1.00 0.00 O ATOM 122 NE2 GLN A 8 -8.027 -5.817 -14.310 1.00 0.00 N ATOM 0 H GLN A 8 -7.487 -5.446 -7.728 1.00 0.00 H new ATOM 0 HA GLN A 8 -9.182 -6.589 -9.741 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -7.079 -5.044 -10.746 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -6.451 -6.680 -10.779 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -8.649 -7.389 -11.904 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -9.044 -5.688 -12.045 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -9.006 -5.545 -14.218 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -7.551 -5.717 -15.207 1.00 0.00 H new ATOM 131 N GLU A 9 -7.966 -8.819 -9.384 1.00 0.00 N ATOM 132 CA GLU A 9 -7.526 -10.102 -8.863 1.00 0.00 C ATOM 133 C GLU A 9 -6.004 -10.117 -8.704 1.00 0.00 C ATOM 134 O GLU A 9 -5.492 -10.393 -7.621 1.00 0.00 O ATOM 135 CB GLU A 9 -7.994 -11.248 -9.761 1.00 0.00 C ATOM 136 CG GLU A 9 -7.935 -12.585 -9.019 1.00 0.00 C ATOM 137 CD GLU A 9 -8.412 -13.731 -9.915 1.00 0.00 C ATOM 138 OE1 GLU A 9 -9.517 -13.586 -10.481 1.00 0.00 O ATOM 139 OE2 GLU A 9 -7.661 -14.725 -10.012 1.00 0.00 O ATOM 0 H GLU A 9 -8.562 -8.876 -10.210 1.00 0.00 H new ATOM 0 HA GLU A 9 -7.976 -10.246 -7.881 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -9.014 -11.059 -10.096 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -7.369 -11.295 -10.653 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -6.914 -12.777 -8.689 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -8.555 -12.536 -8.124 1.00 0.00 H new ATOM 146 N GLU A 10 -5.324 -9.815 -9.801 1.00 0.00 N ATOM 147 CA GLU A 10 -3.871 -9.790 -9.797 1.00 0.00 C ATOM 148 C GLU A 10 -3.358 -8.893 -8.668 1.00 0.00 C ATOM 149 O GLU A 10 -2.399 -9.241 -7.981 1.00 0.00 O ATOM 150 CB GLU A 10 -3.327 -9.331 -11.151 1.00 0.00 C ATOM 151 CG GLU A 10 -2.693 -10.498 -11.911 1.00 0.00 C ATOM 152 CD GLU A 10 -1.720 -9.993 -12.979 1.00 0.00 C ATOM 153 OE1 GLU A 10 -2.203 -9.318 -13.913 1.00 0.00 O ATOM 154 OE2 GLU A 10 -0.515 -10.294 -12.836 1.00 0.00 O ATOM 0 H GLU A 10 -5.752 -9.586 -10.698 1.00 0.00 H new ATOM 0 HA GLU A 10 -3.511 -10.804 -9.622 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -4.134 -8.901 -11.745 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.587 -8.544 -11.002 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -2.166 -11.148 -11.212 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -3.473 -11.098 -12.379 1.00 0.00 H new ATOM 161 N PHE A 11 -4.021 -7.757 -8.511 1.00 0.00 N ATOM 162 CA PHE A 11 -3.645 -6.808 -7.477 1.00 0.00 C ATOM 163 C PHE A 11 -4.089 -7.295 -6.097 1.00 0.00 C ATOM 164 O PHE A 11 -3.487 -6.939 -5.085 1.00 0.00 O ATOM 165 CB PHE A 11 -4.360 -5.493 -7.795 1.00 0.00 C ATOM 166 CG PHE A 11 -3.440 -4.270 -7.804 1.00 0.00 C ATOM 167 CD1 PHE A 11 -2.430 -4.185 -8.711 1.00 0.00 C ATOM 168 CD2 PHE A 11 -3.632 -3.269 -6.904 1.00 0.00 C ATOM 169 CE1 PHE A 11 -1.576 -3.051 -8.719 1.00 0.00 C ATOM 170 CE2 PHE A 11 -2.778 -2.134 -6.912 1.00 0.00 C ATOM 171 CZ PHE A 11 -1.768 -2.049 -7.819 1.00 0.00 C ATOM 0 H PHE A 11 -4.816 -7.472 -9.083 1.00 0.00 H new ATOM 0 HA PHE A 11 -2.562 -6.688 -7.459 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -4.842 -5.580 -8.769 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -5.151 -5.335 -7.061 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -2.278 -4.981 -9.425 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -4.434 -3.337 -6.183 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -0.774 -2.984 -9.439 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -2.931 -1.338 -6.198 1.00 0.00 H new ATOM 0 HZ PHE A 11 -1.118 -1.186 -7.825 1.00 0.00 H new ATOM 181 N LEU A 12 -5.139 -8.103 -6.100 1.00 0.00 N ATOM 182 CA LEU A 12 -5.671 -8.644 -4.860 1.00 0.00 C ATOM 183 C LEU A 12 -4.638 -9.581 -4.232 1.00 0.00 C ATOM 184 O LEU A 12 -4.373 -9.505 -3.034 1.00 0.00 O ATOM 185 CB LEU A 12 -7.031 -9.302 -5.103 1.00 0.00 C ATOM 186 CG LEU A 12 -8.235 -8.358 -5.147 1.00 0.00 C ATOM 187 CD1 LEU A 12 -9.490 -9.093 -5.622 1.00 0.00 C ATOM 188 CD2 LEU A 12 -8.447 -7.676 -3.794 1.00 0.00 C ATOM 0 H LEU A 12 -5.636 -8.396 -6.941 1.00 0.00 H new ATOM 0 HA LEU A 12 -5.853 -7.844 -4.143 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -6.986 -9.845 -6.047 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -7.201 -10.039 -4.318 1.00 0.00 H new ATOM 0 HG LEU A 12 -8.027 -7.573 -5.874 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -10.331 -8.400 -5.644 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -9.322 -9.491 -6.622 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -9.713 -9.912 -4.938 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -9.309 -7.011 -3.853 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -8.624 -8.432 -3.029 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -7.560 -7.098 -3.535 1.00 0.00 H new ATOM 200 N GLU A 13 -4.081 -10.443 -5.071 1.00 0.00 N ATOM 201 CA GLU A 13 -3.083 -11.394 -4.612 1.00 0.00 C ATOM 202 C GLU A 13 -1.831 -10.658 -4.130 1.00 0.00 C ATOM 203 O GLU A 13 -1.094 -11.166 -3.287 1.00 0.00 O ATOM 204 CB GLU A 13 -2.737 -12.399 -5.713 1.00 0.00 C ATOM 205 CG GLU A 13 -1.827 -13.507 -5.178 1.00 0.00 C ATOM 206 CD GLU A 13 -2.476 -14.882 -5.353 1.00 0.00 C ATOM 207 OE1 GLU A 13 -3.454 -15.145 -4.621 1.00 0.00 O ATOM 208 OE2 GLU A 13 -1.978 -15.638 -6.214 1.00 0.00 O ATOM 0 H GLU A 13 -4.302 -10.502 -6.065 1.00 0.00 H new ATOM 0 HA GLU A 13 -3.499 -11.952 -3.773 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -3.652 -12.836 -6.112 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -2.244 -11.885 -6.538 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -0.872 -13.483 -5.702 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -1.616 -13.332 -4.123 1.00 0.00 H new ATOM 215 N LEU A 14 -1.629 -9.472 -4.686 1.00 0.00 N ATOM 216 CA LEU A 14 -0.480 -8.661 -4.323 1.00 0.00 C ATOM 217 C LEU A 14 -0.586 -8.264 -2.849 1.00 0.00 C ATOM 218 O LEU A 14 0.401 -8.313 -2.117 1.00 0.00 O ATOM 219 CB LEU A 14 -0.343 -7.469 -5.273 1.00 0.00 C ATOM 220 CG LEU A 14 0.287 -7.766 -6.635 1.00 0.00 C ATOM 221 CD1 LEU A 14 0.665 -6.472 -7.358 1.00 0.00 C ATOM 222 CD2 LEU A 14 1.480 -8.713 -6.493 1.00 0.00 C ATOM 0 H LEU A 14 -2.242 -9.054 -5.385 1.00 0.00 H new ATOM 0 HA LEU A 14 0.441 -9.234 -4.434 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -1.334 -7.045 -5.438 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.253 -6.702 -4.778 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.455 -8.274 -7.251 1.00 0.00 H new ATOM 0 HD11 LEU A 14 1.111 -6.712 -8.323 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -0.228 -5.866 -7.511 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.382 -5.915 -6.755 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.909 -8.908 -7.476 1.00 0.00 H new ATOM 0 HD22 LEU A 14 2.234 -8.255 -5.852 1.00 0.00 H new ATOM 0 HD23 LEU A 14 1.148 -9.652 -6.050 1.00 0.00 H new ATOM 234 N ILE A 15 -1.792 -7.880 -2.458 1.00 0.00 N ATOM 235 CA ILE A 15 -2.040 -7.475 -1.085 1.00 0.00 C ATOM 236 C ILE A 15 -1.633 -8.608 -0.142 1.00 0.00 C ATOM 237 O ILE A 15 -0.970 -8.373 0.867 1.00 0.00 O ATOM 238 CB ILE A 15 -3.492 -7.024 -0.914 1.00 0.00 C ATOM 239 CG1 ILE A 15 -3.646 -5.536 -1.236 1.00 0.00 C ATOM 240 CG2 ILE A 15 -4.011 -7.364 0.485 1.00 0.00 C ATOM 241 CD1 ILE A 15 -3.489 -5.280 -2.736 1.00 0.00 C ATOM 0 H ILE A 15 -2.608 -7.841 -3.068 1.00 0.00 H new ATOM 0 HA ILE A 15 -1.429 -6.610 -0.827 1.00 0.00 H new ATOM 0 HB ILE A 15 -4.106 -7.573 -1.628 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.624 -5.188 -0.905 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -2.900 -4.962 -0.686 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -5.045 -7.033 0.580 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -3.960 -8.442 0.640 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -3.399 -6.860 1.233 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -3.603 -4.215 -2.937 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -2.501 -5.607 -3.059 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -4.251 -5.836 -3.282 1.00 0.00 H new ATOM 253 N LYS A 16 -2.047 -9.814 -0.504 1.00 0.00 N ATOM 254 CA LYS A 16 -1.733 -10.984 0.298 1.00 0.00 C ATOM 255 C LYS A 16 -0.227 -11.248 0.240 1.00 0.00 C ATOM 256 O LYS A 16 0.335 -11.857 1.149 1.00 0.00 O ATOM 257 CB LYS A 16 -2.583 -12.178 -0.142 1.00 0.00 C ATOM 258 CG LYS A 16 -3.471 -12.670 1.003 1.00 0.00 C ATOM 259 CD LYS A 16 -4.070 -14.041 0.682 1.00 0.00 C ATOM 260 CE LYS A 16 -5.310 -13.903 -0.204 1.00 0.00 C ATOM 261 NZ LYS A 16 -5.683 -15.215 -0.780 1.00 0.00 N ATOM 0 H LYS A 16 -2.597 -10.006 -1.341 1.00 0.00 H new ATOM 0 HA LYS A 16 -1.986 -10.808 1.343 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -3.203 -11.894 -0.992 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -1.934 -12.987 -0.477 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -2.887 -12.730 1.921 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -4.272 -11.952 1.181 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -3.326 -14.658 0.179 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -4.335 -14.552 1.608 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -6.140 -13.507 0.381 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -5.115 -13.190 -1.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -6.526 -15.104 -1.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -4.896 -15.578 -1.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -5.889 -15.885 -0.012 1.00 0.00 H new ATOM 275 N LEU A 17 0.383 -10.775 -0.836 1.00 0.00 N ATOM 276 CA LEU A 17 1.813 -10.952 -1.024 1.00 0.00 C ATOM 277 C LEU A 17 2.565 -9.900 -0.206 1.00 0.00 C ATOM 278 O LEU A 17 3.497 -10.227 0.526 1.00 0.00 O ATOM 279 CB LEU A 17 2.164 -10.940 -2.513 1.00 0.00 C ATOM 280 CG LEU A 17 1.737 -12.172 -3.313 1.00 0.00 C ATOM 281 CD1 LEU A 17 1.652 -11.853 -4.807 1.00 0.00 C ATOM 282 CD2 LEU A 17 2.662 -13.357 -3.031 1.00 0.00 C ATOM 0 H LEU A 17 -0.087 -10.269 -1.587 1.00 0.00 H new ATOM 0 HA LEU A 17 2.127 -11.928 -0.655 1.00 0.00 H new ATOM 0 HB2 LEU A 17 1.707 -10.061 -2.967 1.00 0.00 H new ATOM 0 HB3 LEU A 17 3.243 -10.824 -2.611 1.00 0.00 H new ATOM 0 HG LEU A 17 0.737 -12.461 -2.988 1.00 0.00 H new ATOM 0 HD11 LEU A 17 1.347 -12.746 -5.353 1.00 0.00 H new ATOM 0 HD12 LEU A 17 0.921 -11.061 -4.969 1.00 0.00 H new ATOM 0 HD13 LEU A 17 2.628 -11.525 -5.165 1.00 0.00 H new ATOM 0 HD21 LEU A 17 2.336 -14.219 -3.612 1.00 0.00 H new ATOM 0 HD22 LEU A 17 3.683 -13.096 -3.310 1.00 0.00 H new ATOM 0 HD23 LEU A 17 2.627 -13.601 -1.969 1.00 0.00 H new ATOM 294 N ARG A 18 2.131 -8.657 -0.359 1.00 0.00 N ATOM 295 CA ARG A 18 2.751 -7.554 0.356 1.00 0.00 C ATOM 296 C ARG A 18 2.305 -7.553 1.819 1.00 0.00 C ATOM 297 O ARG A 18 2.669 -6.660 2.582 1.00 0.00 O ATOM 298 CB ARG A 18 2.389 -6.212 -0.282 1.00 0.00 C ATOM 299 CG ARG A 18 0.886 -6.123 -0.557 1.00 0.00 C ATOM 300 CD ARG A 18 0.310 -4.805 -0.034 1.00 0.00 C ATOM 301 NE ARG A 18 -0.001 -3.904 -1.166 1.00 0.00 N ATOM 302 CZ ARG A 18 -0.886 -2.899 -1.104 1.00 0.00 C ATOM 303 NH1 ARG A 18 -1.552 -2.662 0.034 1.00 0.00 N ATOM 304 NH2 ARG A 18 -1.104 -2.132 -2.181 1.00 0.00 N ATOM 0 H ARG A 18 1.357 -8.389 -0.968 1.00 0.00 H new ATOM 0 HA ARG A 18 3.831 -7.689 0.302 1.00 0.00 H new ATOM 0 HB2 ARG A 18 2.690 -5.399 0.378 1.00 0.00 H new ATOM 0 HB3 ARG A 18 2.941 -6.088 -1.214 1.00 0.00 H new ATOM 0 HG2 ARG A 18 0.703 -6.204 -1.629 1.00 0.00 H new ATOM 0 HG3 ARG A 18 0.376 -6.961 -0.082 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -0.592 -4.998 0.547 1.00 0.00 H new ATOM 0 HD3 ARG A 18 1.024 -4.327 0.636 1.00 0.00 H new ATOM 0 HE ARG A 18 0.488 -4.057 -2.048 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -1.386 -3.246 0.853 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -2.225 -1.897 0.081 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -0.597 -2.313 -3.047 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -1.777 -1.367 -2.135 1.00 0.00 H new ATOM 318 N LYS A 19 1.521 -8.564 2.167 1.00 0.00 N ATOM 319 CA LYS A 19 1.022 -8.690 3.525 1.00 0.00 C ATOM 320 C LYS A 19 2.179 -9.053 4.458 1.00 0.00 C ATOM 321 O LYS A 19 2.166 -8.699 5.636 1.00 0.00 O ATOM 322 CB LYS A 19 -0.144 -9.680 3.577 1.00 0.00 C ATOM 323 CG LYS A 19 -0.218 -10.369 4.942 1.00 0.00 C ATOM 324 CD LYS A 19 -1.211 -11.532 4.916 1.00 0.00 C ATOM 325 CE LYS A 19 -0.499 -12.866 5.146 1.00 0.00 C ATOM 326 NZ LYS A 19 -0.705 -13.331 6.536 1.00 0.00 N ATOM 0 H LYS A 19 1.220 -9.303 1.531 1.00 0.00 H new ATOM 0 HA LYS A 19 0.619 -7.739 3.873 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -1.079 -9.157 3.379 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -0.025 -10.429 2.794 1.00 0.00 H new ATOM 0 HG2 LYS A 19 0.770 -10.736 5.222 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -0.518 -9.647 5.702 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -1.970 -11.384 5.684 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -1.728 -11.552 3.957 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -0.877 -13.612 4.447 1.00 0.00 H new ATOM 0 HE3 LYS A 19 0.567 -12.755 4.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -0.215 -14.238 6.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -0.323 -12.626 7.198 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -1.722 -13.457 6.713 1.00 0.00 H new ATOM 340 N LYS A 20 3.152 -9.754 3.896 1.00 0.00 N ATOM 341 CA LYS A 20 4.315 -10.169 4.663 1.00 0.00 C ATOM 342 C LYS A 20 5.421 -9.123 4.510 1.00 0.00 C ATOM 343 O LYS A 20 6.553 -9.345 4.936 1.00 0.00 O ATOM 344 CB LYS A 20 4.745 -11.582 4.263 1.00 0.00 C ATOM 345 CG LYS A 20 5.157 -11.633 2.790 1.00 0.00 C ATOM 346 CD LYS A 20 4.494 -12.813 2.076 1.00 0.00 C ATOM 347 CE LYS A 20 5.416 -14.034 2.065 1.00 0.00 C ATOM 348 NZ LYS A 20 4.642 -15.271 2.313 1.00 0.00 N ATOM 0 H LYS A 20 3.160 -10.045 2.919 1.00 0.00 H new ATOM 0 HA LYS A 20 4.072 -10.224 5.724 1.00 0.00 H new ATOM 0 HB2 LYS A 20 5.578 -11.903 4.889 1.00 0.00 H new ATOM 0 HB3 LYS A 20 3.926 -12.279 4.440 1.00 0.00 H new ATOM 0 HG2 LYS A 20 4.877 -10.702 2.298 1.00 0.00 H new ATOM 0 HG3 LYS A 20 6.241 -11.720 2.715 1.00 0.00 H new ATOM 0 HD2 LYS A 20 3.557 -13.064 2.574 1.00 0.00 H new ATOM 0 HD3 LYS A 20 4.246 -12.531 1.053 1.00 0.00 H new ATOM 0 HE2 LYS A 20 5.926 -14.103 1.104 1.00 0.00 H new ATOM 0 HE3 LYS A 20 6.187 -13.922 2.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 5.283 -16.090 2.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 4.176 -15.209 3.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 3.922 -15.385 1.571 1.00 0.00 H new ATOM 362 N LYS A 21 5.054 -8.005 3.900 1.00 0.00 N ATOM 363 CA LYS A 21 6.001 -6.924 3.686 1.00 0.00 C ATOM 364 C LYS A 21 5.375 -5.605 4.142 1.00 0.00 C ATOM 365 O LYS A 21 5.259 -5.351 5.340 1.00 0.00 O ATOM 366 CB LYS A 21 6.475 -6.909 2.231 1.00 0.00 C ATOM 367 CG LYS A 21 7.204 -8.207 1.878 1.00 0.00 C ATOM 368 CD LYS A 21 6.568 -8.879 0.660 1.00 0.00 C ATOM 369 CE LYS A 21 7.548 -9.848 -0.005 1.00 0.00 C ATOM 370 NZ LYS A 21 7.480 -9.724 -1.479 1.00 0.00 N ATOM 0 H LYS A 21 4.114 -7.825 3.547 1.00 0.00 H new ATOM 0 HA LYS A 21 6.896 -7.077 4.288 1.00 0.00 H new ATOM 0 HB2 LYS A 21 5.620 -6.776 1.568 1.00 0.00 H new ATOM 0 HB3 LYS A 21 7.139 -6.060 2.070 1.00 0.00 H new ATOM 0 HG2 LYS A 21 8.254 -7.995 1.674 1.00 0.00 H new ATOM 0 HG3 LYS A 21 7.176 -8.887 2.729 1.00 0.00 H new ATOM 0 HD2 LYS A 21 5.670 -9.416 0.964 1.00 0.00 H new ATOM 0 HD3 LYS A 21 6.258 -8.120 -0.058 1.00 0.00 H new ATOM 0 HE2 LYS A 21 8.562 -9.641 0.337 1.00 0.00 H new ATOM 0 HE3 LYS A 21 7.315 -10.871 0.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 8.252 -10.272 -1.909 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 6.566 -10.089 -1.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 7.574 -8.724 -1.748 1.00 0.00 H new ATOM 384 N ILE A 22 4.987 -4.801 3.163 1.00 0.00 N ATOM 385 CA ILE A 22 4.375 -3.514 3.450 1.00 0.00 C ATOM 386 C ILE A 22 3.705 -2.980 2.183 1.00 0.00 C ATOM 387 O ILE A 22 3.739 -3.628 1.138 1.00 0.00 O ATOM 388 CB ILE A 22 5.403 -2.555 4.054 1.00 0.00 C ATOM 389 CG1 ILE A 22 4.981 -2.111 5.456 1.00 0.00 C ATOM 390 CG2 ILE A 22 5.653 -1.365 3.126 1.00 0.00 C ATOM 391 CD1 ILE A 22 3.639 -1.376 5.417 1.00 0.00 C ATOM 0 H ILE A 22 5.084 -5.015 2.171 1.00 0.00 H new ATOM 0 HA ILE A 22 3.594 -3.622 4.203 1.00 0.00 H new ATOM 0 HB ILE A 22 6.349 -3.087 4.157 1.00 0.00 H new ATOM 0 HG12 ILE A 22 4.905 -2.980 6.109 1.00 0.00 H new ATOM 0 HG13 ILE A 22 5.745 -1.459 5.880 1.00 0.00 H new ATOM 0 HG21 ILE A 22 6.387 -0.699 3.579 1.00 0.00 H new ATOM 0 HG22 ILE A 22 6.030 -1.723 2.168 1.00 0.00 H new ATOM 0 HG23 ILE A 22 4.720 -0.824 2.969 1.00 0.00 H new ATOM 0 HD11 ILE A 22 3.362 -1.071 6.426 1.00 0.00 H new ATOM 0 HD12 ILE A 22 3.725 -0.494 4.782 1.00 0.00 H new ATOM 0 HD13 ILE A 22 2.873 -2.039 5.015 1.00 0.00 H new ATOM 403 N GLU A 23 3.112 -1.802 2.317 1.00 0.00 N ATOM 404 CA GLU A 23 2.436 -1.173 1.196 1.00 0.00 C ATOM 405 C GLU A 23 2.643 0.342 1.233 1.00 0.00 C ATOM 406 O GLU A 23 2.597 0.953 2.300 1.00 0.00 O ATOM 407 CB GLU A 23 0.946 -1.522 1.188 1.00 0.00 C ATOM 408 CG GLU A 23 0.158 -0.580 2.100 1.00 0.00 C ATOM 409 CD GLU A 23 -0.296 0.667 1.339 1.00 0.00 C ATOM 410 OE1 GLU A 23 -0.561 0.527 0.126 1.00 0.00 O ATOM 411 OE2 GLU A 23 -0.366 1.734 1.988 1.00 0.00 O ATOM 0 H GLU A 23 3.086 -1.267 3.185 1.00 0.00 H new ATOM 0 HA GLU A 23 2.871 -1.557 0.273 1.00 0.00 H new ATOM 0 HB2 GLU A 23 0.559 -1.458 0.171 1.00 0.00 H new ATOM 0 HB3 GLU A 23 0.808 -2.552 1.517 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -0.711 -1.101 2.503 1.00 0.00 H new ATOM 0 HG3 GLU A 23 0.777 -0.288 2.948 1.00 0.00 H new ATOM 418 N GLY A 24 2.868 0.906 0.055 1.00 0.00 N ATOM 419 CA GLY A 24 3.083 2.338 -0.060 1.00 0.00 C ATOM 420 C GLY A 24 1.786 3.059 -0.434 1.00 0.00 C ATOM 421 O GLY A 24 0.923 2.487 -1.098 1.00 0.00 O ATOM 0 H GLY A 24 2.906 0.397 -0.828 1.00 0.00 H new ATOM 0 HA2 GLY A 24 3.462 2.729 0.884 1.00 0.00 H new ATOM 0 HA3 GLY A 24 3.844 2.536 -0.815 1.00 0.00 H new ATOM 425 N ARG A 25 1.690 4.304 0.008 1.00 0.00 N ATOM 426 CA ARG A 25 0.513 5.109 -0.272 1.00 0.00 C ATOM 427 C ARG A 25 0.652 6.493 0.366 1.00 0.00 C ATOM 428 O ARG A 25 0.416 6.655 1.562 1.00 0.00 O ATOM 429 CB ARG A 25 -0.754 4.435 0.258 1.00 0.00 C ATOM 430 CG ARG A 25 -2.009 5.134 -0.269 1.00 0.00 C ATOM 431 CD ARG A 25 -1.888 5.420 -1.768 1.00 0.00 C ATOM 432 NE ARG A 25 -3.233 5.603 -2.358 1.00 0.00 N ATOM 433 CZ ARG A 25 -4.092 4.602 -2.594 1.00 0.00 C ATOM 434 NH1 ARG A 25 -3.753 3.342 -2.291 1.00 0.00 N ATOM 435 NH2 ARG A 25 -5.292 4.862 -3.132 1.00 0.00 N ATOM 0 H ARG A 25 2.408 4.775 0.558 1.00 0.00 H new ATOM 0 HA ARG A 25 0.431 5.211 -1.354 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -0.765 3.387 -0.041 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -0.752 4.456 1.348 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -2.883 4.509 -0.084 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -2.164 6.068 0.272 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -1.286 6.315 -1.929 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -1.373 4.597 -2.263 1.00 0.00 H new ATOM 0 HE ARG A 25 -3.524 6.550 -2.600 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -2.841 3.144 -1.880 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -4.407 2.581 -2.471 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -5.551 5.822 -3.362 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -5.946 4.100 -3.312 1.00 0.00 H new ATOM 449 N LEU A 26 1.034 7.455 -0.461 1.00 0.00 N ATOM 450 CA LEU A 26 1.208 8.819 0.007 1.00 0.00 C ATOM 451 C LEU A 26 0.128 9.139 1.043 1.00 0.00 C ATOM 452 O LEU A 26 -1.009 8.686 0.920 1.00 0.00 O ATOM 453 CB LEU A 26 1.234 9.792 -1.173 1.00 0.00 C ATOM 454 CG LEU A 26 0.147 10.869 -1.180 1.00 0.00 C ATOM 455 CD1 LEU A 26 0.545 12.055 -0.299 1.00 0.00 C ATOM 456 CD2 LEU A 26 -0.186 11.302 -2.609 1.00 0.00 C ATOM 0 H LEU A 26 1.228 7.316 -1.453 1.00 0.00 H new ATOM 0 HA LEU A 26 2.172 8.931 0.504 1.00 0.00 H new ATOM 0 HB2 LEU A 26 2.206 10.285 -1.190 1.00 0.00 H new ATOM 0 HB3 LEU A 26 1.153 9.216 -2.095 1.00 0.00 H new ATOM 0 HG LEU A 26 -0.761 10.442 -0.754 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -0.245 12.806 -0.321 1.00 0.00 H new ATOM 0 HD12 LEU A 26 0.692 11.714 0.726 1.00 0.00 H new ATOM 0 HD13 LEU A 26 1.471 12.491 -0.673 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -0.961 12.068 -2.586 1.00 0.00 H new ATOM 0 HD22 LEU A 26 0.708 11.705 -3.085 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -0.543 10.442 -3.176 1.00 0.00 H new ATOM 468 N TYR A 27 0.522 9.917 2.041 1.00 0.00 N ATOM 469 CA TYR A 27 -0.398 10.303 3.097 1.00 0.00 C ATOM 470 C TYR A 27 -1.438 11.300 2.582 1.00 0.00 C ATOM 471 O TYR A 27 -1.412 12.474 2.949 1.00 0.00 O ATOM 472 CB TYR A 27 0.454 10.982 4.171 1.00 0.00 C ATOM 473 CG TYR A 27 -0.129 10.885 5.582 1.00 0.00 C ATOM 474 CD1 TYR A 27 -0.730 9.715 6.002 1.00 0.00 C ATOM 475 CD2 TYR A 27 -0.055 11.967 6.435 1.00 0.00 C ATOM 476 CE1 TYR A 27 -1.279 9.624 7.330 1.00 0.00 C ATOM 477 CE2 TYR A 27 -0.604 11.876 7.763 1.00 0.00 C ATOM 478 CZ TYR A 27 -1.189 10.709 8.145 1.00 0.00 C ATOM 479 OH TYR A 27 -1.707 10.623 9.399 1.00 0.00 O ATOM 0 H TYR A 27 1.466 10.290 2.140 1.00 0.00 H new ATOM 0 HA TYR A 27 -0.933 9.433 3.476 1.00 0.00 H new ATOM 0 HB2 TYR A 27 1.448 10.535 4.168 1.00 0.00 H new ATOM 0 HB3 TYR A 27 0.577 12.033 3.911 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -0.788 8.868 5.334 1.00 0.00 H new ATOM 0 HD2 TYR A 27 0.415 12.882 6.107 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -1.752 8.715 7.671 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -0.552 12.715 8.441 1.00 0.00 H new ATOM 0 HH TYR A 27 -1.570 11.472 9.868 1.00 0.00 H new ATOM 489 N ASP A 28 -2.328 10.795 1.740 1.00 0.00 N ATOM 490 CA ASP A 28 -3.374 11.627 1.171 1.00 0.00 C ATOM 491 C ASP A 28 -4.350 12.039 2.275 1.00 0.00 C ATOM 492 O ASP A 28 -4.169 11.675 3.436 1.00 0.00 O ATOM 493 CB ASP A 28 -4.163 10.866 0.103 1.00 0.00 C ATOM 494 CG ASP A 28 -3.312 10.225 -0.995 1.00 0.00 C ATOM 495 OD1 ASP A 28 -2.886 9.070 -0.780 1.00 0.00 O ATOM 496 OD2 ASP A 28 -3.107 10.905 -2.024 1.00 0.00 O ATOM 0 H ASP A 28 -2.346 9.821 1.439 1.00 0.00 H new ATOM 0 HA ASP A 28 -2.902 12.499 0.719 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -4.747 10.086 0.591 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -4.872 11.552 -0.361 1.00 0.00 H new ATOM 501 N GLU A 29 -5.364 12.792 1.875 1.00 0.00 N ATOM 502 CA GLU A 29 -6.368 13.258 2.816 1.00 0.00 C ATOM 503 C GLU A 29 -7.109 12.069 3.431 1.00 0.00 C ATOM 504 O GLU A 29 -7.335 12.032 4.640 1.00 0.00 O ATOM 505 CB GLU A 29 -7.345 14.224 2.143 1.00 0.00 C ATOM 506 CG GLU A 29 -6.995 15.676 2.473 1.00 0.00 C ATOM 507 CD GLU A 29 -8.114 16.623 2.035 1.00 0.00 C ATOM 508 OE1 GLU A 29 -8.164 16.918 0.821 1.00 0.00 O ATOM 509 OE2 GLU A 29 -8.893 17.031 2.923 1.00 0.00 O ATOM 0 H GLU A 29 -5.512 13.091 0.911 1.00 0.00 H new ATOM 0 HA GLU A 29 -5.865 13.802 3.615 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -7.322 14.077 1.063 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -8.361 14.007 2.472 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -6.826 15.778 3.545 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -6.065 15.952 1.976 1.00 0.00 H new ATOM 516 N LYS A 30 -7.468 11.126 2.572 1.00 0.00 N ATOM 517 CA LYS A 30 -8.179 9.940 3.016 1.00 0.00 C ATOM 518 C LYS A 30 -7.267 9.115 3.927 1.00 0.00 C ATOM 519 O LYS A 30 -7.674 8.706 5.013 1.00 0.00 O ATOM 520 CB LYS A 30 -8.719 9.158 1.817 1.00 0.00 C ATOM 521 CG LYS A 30 -10.207 9.441 1.603 1.00 0.00 C ATOM 522 CD LYS A 30 -10.784 8.545 0.505 1.00 0.00 C ATOM 523 CE LYS A 30 -11.290 9.379 -0.673 1.00 0.00 C ATOM 524 NZ LYS A 30 -12.750 9.595 -0.567 1.00 0.00 N ATOM 0 H LYS A 30 -7.279 11.160 1.570 1.00 0.00 H new ATOM 0 HA LYS A 30 -9.053 10.219 3.605 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -8.161 9.429 0.921 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -8.567 8.090 1.976 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -10.750 9.276 2.534 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -10.347 10.488 1.334 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -10.020 7.848 0.160 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -11.601 7.948 0.910 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -10.775 10.339 -0.694 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -11.059 8.873 -1.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -13.076 10.163 -1.375 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -13.238 8.677 -0.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -12.963 10.098 0.318 1.00 0.00 H new ATOM 538 N ARG A 31 -6.050 8.896 3.451 1.00 0.00 N ATOM 539 CA ARG A 31 -5.077 8.127 4.209 1.00 0.00 C ATOM 540 C ARG A 31 -4.857 8.759 5.585 1.00 0.00 C ATOM 541 O ARG A 31 -4.579 8.059 6.557 1.00 0.00 O ATOM 542 CB ARG A 31 -3.740 8.051 3.470 1.00 0.00 C ATOM 543 CG ARG A 31 -3.042 6.715 3.736 1.00 0.00 C ATOM 544 CD ARG A 31 -3.622 5.608 2.853 1.00 0.00 C ATOM 545 NE ARG A 31 -3.733 4.351 3.625 1.00 0.00 N ATOM 546 CZ ARG A 31 -4.080 3.171 3.093 1.00 0.00 C ATOM 547 NH1 ARG A 31 -4.352 3.080 1.784 1.00 0.00 N ATOM 548 NH2 ARG A 31 -4.156 2.082 3.870 1.00 0.00 N ATOM 0 H ARG A 31 -5.715 9.238 2.550 1.00 0.00 H new ATOM 0 HA ARG A 31 -5.471 7.118 4.328 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -3.905 8.173 2.399 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -3.097 8.871 3.789 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -1.973 6.815 3.546 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -3.155 6.444 4.786 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -4.603 5.904 2.482 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -2.985 5.455 1.982 1.00 0.00 H new ATOM 0 HE ARG A 31 -3.533 4.385 4.625 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -4.295 3.909 1.192 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -4.616 2.182 1.379 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -3.950 2.151 4.867 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -4.420 1.184 3.465 1.00 0.00 H new ATOM 562 N ARG A 32 -4.990 10.077 5.623 1.00 0.00 N ATOM 563 CA ARG A 32 -4.809 10.812 6.864 1.00 0.00 C ATOM 564 C ARG A 32 -5.883 10.413 7.878 1.00 0.00 C ATOM 565 O ARG A 32 -5.598 10.274 9.067 1.00 0.00 O ATOM 566 CB ARG A 32 -4.878 12.321 6.625 1.00 0.00 C ATOM 567 CG ARG A 32 -3.486 12.898 6.359 1.00 0.00 C ATOM 568 CD ARG A 32 -3.413 14.368 6.778 1.00 0.00 C ATOM 569 NE ARG A 32 -2.847 14.478 8.141 1.00 0.00 N ATOM 570 CZ ARG A 32 -2.338 15.606 8.655 1.00 0.00 C ATOM 571 NH1 ARG A 32 -2.322 16.728 7.922 1.00 0.00 N ATOM 572 NH2 ARG A 32 -1.846 15.613 9.901 1.00 0.00 N ATOM 0 H ARG A 32 -5.221 10.655 4.815 1.00 0.00 H new ATOM 0 HA ARG A 32 -3.823 10.563 7.257 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -5.530 12.529 5.777 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -5.319 12.811 7.493 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -2.739 12.323 6.906 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -3.246 12.806 5.300 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -2.796 14.925 6.073 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -4.408 14.812 6.752 1.00 0.00 H new ATOM 0 HE ARG A 32 -2.844 13.642 8.726 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -2.697 16.723 6.974 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -1.935 17.587 8.313 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -1.859 14.759 10.459 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -1.459 16.472 10.292 1.00 0.00 H new ATOM 586 N GLN A 33 -7.095 10.241 7.372 1.00 0.00 N ATOM 587 CA GLN A 33 -8.213 9.861 8.219 1.00 0.00 C ATOM 588 C GLN A 33 -8.118 8.380 8.590 1.00 0.00 C ATOM 589 O GLN A 33 -8.675 7.952 9.600 1.00 0.00 O ATOM 590 CB GLN A 33 -9.547 10.171 7.537 1.00 0.00 C ATOM 591 CG GLN A 33 -10.564 10.715 8.543 1.00 0.00 C ATOM 592 CD GLN A 33 -11.838 11.181 7.838 1.00 0.00 C ATOM 593 OE1 GLN A 33 -12.139 12.361 7.759 1.00 0.00 O ATOM 594 NE2 GLN A 33 -12.568 10.192 7.330 1.00 0.00 N ATOM 0 H GLN A 33 -7.328 10.358 6.386 1.00 0.00 H new ATOM 0 HA GLN A 33 -8.166 10.449 9.136 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -9.392 10.900 6.741 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -9.939 9.268 7.070 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -10.809 9.942 9.271 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -10.125 11.546 9.096 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -12.258 9.225 7.432 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -13.437 10.400 6.839 1.00 0.00 H new ATOM 603 N ILE A 34 -7.409 7.637 7.754 1.00 0.00 N ATOM 604 CA ILE A 34 -7.234 6.212 7.981 1.00 0.00 C ATOM 605 C ILE A 34 -6.460 6.000 9.284 1.00 0.00 C ATOM 606 O ILE A 34 -5.625 6.823 9.656 1.00 0.00 O ATOM 607 CB ILE A 34 -6.582 5.551 6.765 1.00 0.00 C ATOM 608 CG1 ILE A 34 -7.531 5.556 5.565 1.00 0.00 C ATOM 609 CG2 ILE A 34 -6.093 4.141 7.103 1.00 0.00 C ATOM 610 CD1 ILE A 34 -6.824 5.052 4.305 1.00 0.00 C ATOM 0 H ILE A 34 -6.948 7.995 6.917 1.00 0.00 H new ATOM 0 HA ILE A 34 -8.201 5.724 8.100 1.00 0.00 H new ATOM 0 HB ILE A 34 -5.706 6.137 6.486 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -8.395 4.927 5.778 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -7.905 6.566 5.397 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -5.634 3.694 6.221 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -5.359 4.193 7.907 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -6.937 3.530 7.422 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -7.521 5.066 3.467 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -5.975 5.698 4.081 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -6.472 4.033 4.468 1.00 0.00 H new ATOM 622 N LYS A 35 -6.767 4.892 9.943 1.00 0.00 N ATOM 623 CA LYS A 35 -6.111 4.561 11.197 1.00 0.00 C ATOM 624 C LYS A 35 -5.989 3.040 11.318 1.00 0.00 C ATOM 625 O LYS A 35 -6.661 2.301 10.600 1.00 0.00 O ATOM 626 CB LYS A 35 -6.840 5.215 12.372 1.00 0.00 C ATOM 627 CG LYS A 35 -8.003 4.343 12.849 1.00 0.00 C ATOM 628 CD LYS A 35 -7.634 3.589 14.128 1.00 0.00 C ATOM 629 CE LYS A 35 -8.862 2.905 14.735 1.00 0.00 C ATOM 630 NZ LYS A 35 -9.593 3.842 15.617 1.00 0.00 N ATOM 0 H LYS A 35 -7.461 4.212 9.632 1.00 0.00 H new ATOM 0 HA LYS A 35 -5.099 4.965 11.216 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -6.142 5.377 13.193 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -7.214 6.194 12.073 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -8.879 4.966 13.030 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -8.273 3.632 12.068 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -6.870 2.844 13.907 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -7.204 4.282 14.852 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -9.521 2.555 13.940 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -8.553 2.027 15.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -10.423 3.363 16.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -8.966 4.156 16.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -9.904 4.667 15.065 1.00 0.00 H new ATOM 644 N PRO A 36 -5.104 2.607 12.255 1.00 0.00 N ATOM 645 CA PRO A 36 -4.886 1.188 12.480 1.00 0.00 C ATOM 646 C PRO A 36 -6.055 0.568 13.247 1.00 0.00 C ATOM 647 O PRO A 36 -6.070 0.577 14.477 1.00 0.00 O ATOM 648 CB PRO A 36 -3.570 1.108 13.236 1.00 0.00 C ATOM 649 CG PRO A 36 -3.334 2.494 13.812 1.00 0.00 C ATOM 650 CD PRO A 36 -4.291 3.454 13.123 1.00 0.00 C ATOM 0 HA PRO A 36 -4.833 0.618 11.552 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -3.619 0.360 14.027 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -2.756 0.817 12.572 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -3.503 2.494 14.889 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -2.301 2.803 13.651 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -4.908 3.986 13.847 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -3.751 4.207 12.549 1.00 0.00 H new ATOM 658 N GLY A 37 -7.008 0.045 12.489 1.00 0.00 N ATOM 659 CA GLY A 37 -8.178 -0.578 13.082 1.00 0.00 C ATOM 660 C GLY A 37 -9.303 -0.721 12.055 1.00 0.00 C ATOM 661 O GLY A 37 -10.139 -1.617 12.165 1.00 0.00 O ATOM 0 H GLY A 37 -6.993 0.040 11.469 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -7.912 -1.560 13.474 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -8.524 0.019 13.925 1.00 0.00 H new ATOM 665 N ASP A 38 -9.288 0.175 11.080 1.00 0.00 N ATOM 666 CA ASP A 38 -10.297 0.161 10.034 1.00 0.00 C ATOM 667 C ASP A 38 -10.060 -1.043 9.120 1.00 0.00 C ATOM 668 O ASP A 38 -9.132 -1.820 9.339 1.00 0.00 O ATOM 669 CB ASP A 38 -10.221 1.426 9.178 1.00 0.00 C ATOM 670 CG ASP A 38 -10.664 2.711 9.883 1.00 0.00 C ATOM 671 OD1 ASP A 38 -11.654 2.630 10.642 1.00 0.00 O ATOM 672 OD2 ASP A 38 -10.002 3.744 9.646 1.00 0.00 O ATOM 0 H ASP A 38 -8.593 0.916 10.992 1.00 0.00 H new ATOM 0 HA ASP A 38 -11.276 0.107 10.510 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -9.194 1.553 8.834 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -10.839 1.284 8.291 1.00 0.00 H new ATOM 677 N VAL A 39 -10.915 -1.160 8.115 1.00 0.00 N ATOM 678 CA VAL A 39 -10.810 -2.256 7.166 1.00 0.00 C ATOM 679 C VAL A 39 -11.018 -1.719 5.749 1.00 0.00 C ATOM 680 O VAL A 39 -11.812 -0.804 5.538 1.00 0.00 O ATOM 681 CB VAL A 39 -11.796 -3.365 7.537 1.00 0.00 C ATOM 682 CG1 VAL A 39 -11.703 -4.533 6.553 1.00 0.00 C ATOM 683 CG2 VAL A 39 -11.573 -3.839 8.974 1.00 0.00 C ATOM 0 H VAL A 39 -11.684 -0.514 7.937 1.00 0.00 H new ATOM 0 HA VAL A 39 -9.815 -2.699 7.202 1.00 0.00 H new ATOM 0 HB VAL A 39 -12.803 -2.953 7.473 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -12.414 -5.308 6.840 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -11.935 -4.181 5.548 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -10.693 -4.943 6.570 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -12.287 -4.627 9.212 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -10.559 -4.225 9.077 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -11.714 -3.003 9.659 1.00 0.00 H new ATOM 693 N ILE A 40 -10.292 -2.313 4.813 1.00 0.00 N ATOM 694 CA ILE A 40 -10.387 -1.906 3.421 1.00 0.00 C ATOM 695 C ILE A 40 -10.817 -3.105 2.573 1.00 0.00 C ATOM 696 O ILE A 40 -10.001 -3.968 2.253 1.00 0.00 O ATOM 697 CB ILE A 40 -9.078 -1.264 2.960 1.00 0.00 C ATOM 698 CG1 ILE A 40 -8.587 -0.229 3.974 1.00 0.00 C ATOM 699 CG2 ILE A 40 -9.224 -0.668 1.558 1.00 0.00 C ATOM 700 CD1 ILE A 40 -7.088 -0.386 4.237 1.00 0.00 C ATOM 0 H ILE A 40 -9.635 -3.073 4.991 1.00 0.00 H new ATOM 0 HA ILE A 40 -11.151 -1.138 3.299 1.00 0.00 H new ATOM 0 HB ILE A 40 -8.318 -2.043 2.902 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -8.791 0.775 3.602 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -9.137 -0.341 4.908 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -8.279 -0.218 1.254 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -9.494 -1.455 0.854 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -10.003 0.094 1.566 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -6.765 0.362 4.961 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -6.890 -1.383 4.632 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -6.539 -0.249 3.305 1.00 0.00 H new ATOM 712 N SER A 41 -12.097 -3.119 2.231 1.00 0.00 N ATOM 713 CA SER A 41 -12.645 -4.197 1.426 1.00 0.00 C ATOM 714 C SER A 41 -12.273 -3.993 -0.044 1.00 0.00 C ATOM 715 O SER A 41 -12.170 -2.860 -0.511 1.00 0.00 O ATOM 716 CB SER A 41 -14.165 -4.284 1.582 1.00 0.00 C ATOM 717 OG SER A 41 -14.560 -4.317 2.950 1.00 0.00 O ATOM 0 H SER A 41 -12.770 -2.401 2.497 1.00 0.00 H new ATOM 0 HA SER A 41 -12.217 -5.137 1.776 1.00 0.00 H new ATOM 0 HB2 SER A 41 -14.629 -3.429 1.091 1.00 0.00 H new ATOM 0 HB3 SER A 41 -14.531 -5.178 1.077 1.00 0.00 H new ATOM 0 HG SER A 41 -15.537 -4.371 3.007 1.00 0.00 H new ATOM 723 N PHE A 42 -12.081 -5.109 -0.733 1.00 0.00 N ATOM 724 CA PHE A 42 -11.722 -5.067 -2.140 1.00 0.00 C ATOM 725 C PHE A 42 -12.641 -5.969 -2.967 1.00 0.00 C ATOM 726 O PHE A 42 -12.941 -7.092 -2.565 1.00 0.00 O ATOM 727 CB PHE A 42 -10.286 -5.582 -2.252 1.00 0.00 C ATOM 728 CG PHE A 42 -9.236 -4.623 -1.688 1.00 0.00 C ATOM 729 CD1 PHE A 42 -9.390 -3.281 -1.839 1.00 0.00 C ATOM 730 CD2 PHE A 42 -8.148 -5.114 -1.036 1.00 0.00 C ATOM 731 CE1 PHE A 42 -8.414 -2.391 -1.316 1.00 0.00 C ATOM 732 CE2 PHE A 42 -7.172 -4.224 -0.513 1.00 0.00 C ATOM 733 CZ PHE A 42 -7.326 -2.881 -0.664 1.00 0.00 C ATOM 0 H PHE A 42 -12.167 -6.047 -0.343 1.00 0.00 H new ATOM 0 HA PHE A 42 -11.819 -4.049 -2.518 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -10.211 -6.535 -1.729 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -10.061 -5.775 -3.301 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -10.254 -2.891 -2.356 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -8.026 -6.180 -0.916 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -8.536 -1.325 -1.436 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -6.308 -4.614 0.004 1.00 0.00 H new ATOM 0 HZ PHE A 42 -6.584 -2.204 -0.266 1.00 0.00 H new ATOM 743 N GLU A 43 -13.063 -5.443 -4.108 1.00 0.00 N ATOM 744 CA GLU A 43 -13.941 -6.187 -4.995 1.00 0.00 C ATOM 745 C GLU A 43 -15.159 -6.702 -4.226 1.00 0.00 C ATOM 746 O GLU A 43 -15.563 -7.852 -4.394 1.00 0.00 O ATOM 747 CB GLU A 43 -13.192 -7.338 -5.670 1.00 0.00 C ATOM 748 CG GLU A 43 -12.016 -6.816 -6.498 1.00 0.00 C ATOM 749 CD GLU A 43 -12.434 -6.564 -7.948 1.00 0.00 C ATOM 750 OE1 GLU A 43 -12.477 -7.557 -8.706 1.00 0.00 O ATOM 751 OE2 GLU A 43 -12.701 -5.385 -8.265 1.00 0.00 O ATOM 0 H GLU A 43 -12.813 -4.511 -4.438 1.00 0.00 H new ATOM 0 HA GLU A 43 -14.288 -5.514 -5.779 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -12.828 -8.033 -4.913 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -13.875 -7.894 -6.312 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -11.639 -5.892 -6.059 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -11.200 -7.538 -6.472 1.00 0.00 H new ATOM 758 N GLY A 44 -15.711 -5.826 -3.400 1.00 0.00 N ATOM 759 CA GLY A 44 -16.875 -6.177 -2.605 1.00 0.00 C ATOM 760 C GLY A 44 -16.461 -6.815 -1.277 1.00 0.00 C ATOM 761 O GLY A 44 -16.724 -6.263 -0.210 1.00 0.00 O ATOM 0 H GLY A 44 -15.373 -4.873 -3.264 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -17.471 -5.285 -2.414 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -17.506 -6.868 -3.163 1.00 0.00 H new ATOM 765 N GLY A 45 -15.819 -7.970 -1.387 1.00 0.00 N ATOM 766 CA GLY A 45 -15.365 -8.689 -0.209 1.00 0.00 C ATOM 767 C GLY A 45 -14.460 -9.860 -0.596 1.00 0.00 C ATOM 768 O GLY A 45 -14.391 -10.858 0.119 1.00 0.00 O ATOM 0 H GLY A 45 -15.603 -8.425 -2.274 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -14.825 -8.010 0.450 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -16.225 -9.059 0.350 1.00 0.00 H new ATOM 772 N LYS A 46 -13.789 -9.698 -1.727 1.00 0.00 N ATOM 773 CA LYS A 46 -12.891 -10.730 -2.218 1.00 0.00 C ATOM 774 C LYS A 46 -11.591 -10.694 -1.412 1.00 0.00 C ATOM 775 O LYS A 46 -10.997 -11.736 -1.139 1.00 0.00 O ATOM 776 CB LYS A 46 -12.682 -10.585 -3.727 1.00 0.00 C ATOM 777 CG LYS A 46 -12.502 -11.953 -4.389 1.00 0.00 C ATOM 778 CD LYS A 46 -11.023 -12.336 -4.463 1.00 0.00 C ATOM 779 CE LYS A 46 -10.695 -12.999 -5.802 1.00 0.00 C ATOM 780 NZ LYS A 46 -11.002 -14.446 -5.753 1.00 0.00 N ATOM 0 H LYS A 46 -13.849 -8.868 -2.317 1.00 0.00 H new ATOM 0 HA LYS A 46 -13.330 -11.717 -2.073 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -13.537 -10.073 -4.169 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -11.806 -9.966 -3.919 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -13.049 -12.709 -3.825 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -12.927 -11.934 -5.393 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -10.406 -11.447 -4.333 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -10.778 -13.016 -3.647 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -11.269 -12.526 -6.599 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -9.641 -12.853 -6.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -10.774 -14.881 -6.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -10.436 -14.896 -5.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -12.013 -14.580 -5.549 1.00 0.00 H new ATOM 794 N LEU A 47 -11.187 -9.484 -1.053 1.00 0.00 N ATOM 795 CA LEU A 47 -9.969 -9.300 -0.283 1.00 0.00 C ATOM 796 C LEU A 47 -10.183 -8.185 0.743 1.00 0.00 C ATOM 797 O LEU A 47 -10.336 -7.021 0.378 1.00 0.00 O ATOM 798 CB LEU A 47 -8.779 -9.058 -1.214 1.00 0.00 C ATOM 799 CG LEU A 47 -7.448 -9.672 -0.775 1.00 0.00 C ATOM 800 CD1 LEU A 47 -6.806 -8.848 0.343 1.00 0.00 C ATOM 801 CD2 LEU A 47 -7.626 -11.138 -0.376 1.00 0.00 C ATOM 0 H LEU A 47 -11.682 -8.622 -1.281 1.00 0.00 H new ATOM 0 HA LEU A 47 -9.730 -10.206 0.275 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -9.029 -9.449 -2.200 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -8.642 -7.982 -1.323 1.00 0.00 H new ATOM 0 HG LEU A 47 -6.765 -9.650 -1.624 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -5.862 -9.306 0.636 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -6.623 -7.834 -0.012 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -7.476 -8.816 1.202 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -6.665 -11.551 -0.068 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -8.332 -11.207 0.451 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -8.008 -11.703 -1.227 1.00 0.00 H new ATOM 813 N LYS A 48 -10.187 -8.582 2.007 1.00 0.00 N ATOM 814 CA LYS A 48 -10.380 -7.631 3.089 1.00 0.00 C ATOM 815 C LYS A 48 -9.067 -7.465 3.857 1.00 0.00 C ATOM 816 O LYS A 48 -8.394 -8.449 4.163 1.00 0.00 O ATOM 817 CB LYS A 48 -11.558 -8.054 3.970 1.00 0.00 C ATOM 818 CG LYS A 48 -12.788 -8.380 3.120 1.00 0.00 C ATOM 819 CD LYS A 48 -13.702 -7.160 2.988 1.00 0.00 C ATOM 820 CE LYS A 48 -15.175 -7.566 3.071 1.00 0.00 C ATOM 821 NZ LYS A 48 -15.603 -7.677 4.484 1.00 0.00 N ATOM 0 H LYS A 48 -10.060 -9.549 2.306 1.00 0.00 H new ATOM 0 HA LYS A 48 -10.644 -6.651 2.692 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -11.279 -8.926 4.562 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -11.798 -7.255 4.672 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -12.473 -8.712 2.131 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -13.339 -9.205 3.572 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -13.474 -6.443 3.777 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -13.512 -6.660 2.038 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -15.791 -6.830 2.555 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -15.325 -8.519 2.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -16.605 -7.953 4.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -15.027 -8.396 4.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -15.478 -6.759 4.958 1.00 0.00 H new ATOM 835 N VAL A 49 -8.742 -6.214 4.146 1.00 0.00 N ATOM 836 CA VAL A 49 -7.521 -5.907 4.872 1.00 0.00 C ATOM 837 C VAL A 49 -7.818 -4.845 5.933 1.00 0.00 C ATOM 838 O VAL A 49 -8.660 -3.973 5.725 1.00 0.00 O ATOM 839 CB VAL A 49 -6.423 -5.484 3.894 1.00 0.00 C ATOM 840 CG1 VAL A 49 -6.286 -6.495 2.754 1.00 0.00 C ATOM 841 CG2 VAL A 49 -6.683 -4.078 3.351 1.00 0.00 C ATOM 0 H VAL A 49 -9.303 -5.401 3.891 1.00 0.00 H new ATOM 0 HA VAL A 49 -7.152 -6.792 5.391 1.00 0.00 H new ATOM 0 HB VAL A 49 -5.479 -5.463 4.439 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -5.499 -6.171 2.073 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -6.032 -7.473 3.163 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -7.229 -6.563 2.212 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -5.888 -3.803 2.658 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -7.640 -4.060 2.830 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -6.707 -3.368 4.177 1.00 0.00 H new ATOM 851 N ARG A 50 -7.109 -4.953 7.047 1.00 0.00 N ATOM 852 CA ARG A 50 -7.286 -4.013 8.141 1.00 0.00 C ATOM 853 C ARG A 50 -5.937 -3.421 8.555 1.00 0.00 C ATOM 854 O ARG A 50 -4.997 -4.157 8.853 1.00 0.00 O ATOM 855 CB ARG A 50 -7.930 -4.692 9.351 1.00 0.00 C ATOM 856 CG ARG A 50 -7.918 -3.766 10.569 1.00 0.00 C ATOM 857 CD ARG A 50 -7.210 -4.428 11.754 1.00 0.00 C ATOM 858 NE ARG A 50 -7.777 -3.926 13.026 1.00 0.00 N ATOM 859 CZ ARG A 50 -9.042 -4.131 13.418 1.00 0.00 C ATOM 860 NH1 ARG A 50 -9.880 -4.828 12.638 1.00 0.00 N ATOM 861 NH2 ARG A 50 -9.469 -3.639 14.588 1.00 0.00 N ATOM 0 H ARG A 50 -6.411 -5.677 7.216 1.00 0.00 H new ATOM 0 HA ARG A 50 -7.944 -3.217 7.792 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -8.956 -4.972 9.112 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -7.395 -5.612 9.584 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -7.415 -2.833 10.316 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -8.941 -3.512 10.847 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -7.324 -5.511 11.698 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -6.141 -4.217 11.714 1.00 0.00 H new ATOM 0 HE ARG A 50 -7.166 -3.390 13.643 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -9.555 -5.202 11.747 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -10.843 -4.984 12.936 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -8.831 -3.108 15.181 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -10.432 -3.795 14.886 1.00 0.00 H new ATOM 875 N VAL A 51 -5.885 -2.097 8.560 1.00 0.00 N ATOM 876 CA VAL A 51 -4.667 -1.398 8.933 1.00 0.00 C ATOM 877 C VAL A 51 -4.184 -1.911 10.291 1.00 0.00 C ATOM 878 O VAL A 51 -4.993 -2.254 11.152 1.00 0.00 O ATOM 879 CB VAL A 51 -4.905 0.113 8.915 1.00 0.00 C ATOM 880 CG1 VAL A 51 -3.588 0.877 9.067 1.00 0.00 C ATOM 881 CG2 VAL A 51 -5.641 0.537 7.642 1.00 0.00 C ATOM 0 H VAL A 51 -6.666 -1.490 8.312 1.00 0.00 H new ATOM 0 HA VAL A 51 -3.876 -1.598 8.211 1.00 0.00 H new ATOM 0 HB VAL A 51 -5.538 0.363 9.767 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -3.785 1.949 9.051 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -3.119 0.608 10.013 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -2.921 0.619 8.245 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -5.798 1.616 7.654 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -5.045 0.267 6.770 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.605 0.031 7.594 1.00 0.00 H new ATOM 891 N LYS A 52 -2.868 -1.947 10.441 1.00 0.00 N ATOM 892 CA LYS A 52 -2.268 -2.413 11.680 1.00 0.00 C ATOM 893 C LYS A 52 -1.561 -1.244 12.369 1.00 0.00 C ATOM 894 O LYS A 52 -1.625 -1.108 13.590 1.00 0.00 O ATOM 895 CB LYS A 52 -1.358 -3.614 11.416 1.00 0.00 C ATOM 896 CG LYS A 52 -2.093 -4.928 11.689 1.00 0.00 C ATOM 897 CD LYS A 52 -1.775 -5.452 13.092 1.00 0.00 C ATOM 898 CE LYS A 52 -3.012 -5.397 13.990 1.00 0.00 C ATOM 899 NZ LYS A 52 -3.686 -6.715 14.026 1.00 0.00 N ATOM 0 H LYS A 52 -2.200 -1.661 9.725 1.00 0.00 H new ATOM 0 HA LYS A 52 -3.036 -2.770 12.366 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -1.013 -3.594 10.382 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -0.472 -3.550 12.048 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -3.168 -4.776 11.589 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.806 -5.671 10.945 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -1.413 -6.478 13.028 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -0.974 -4.859 13.533 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -2.723 -5.102 14.999 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -3.703 -4.639 13.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -4.713 -6.582 13.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -3.342 -7.303 13.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -3.477 -7.187 14.929 1.00 0.00 H new ATOM 913 N ALA A 53 -0.901 -0.431 11.557 1.00 0.00 N ATOM 914 CA ALA A 53 -0.182 0.721 12.073 1.00 0.00 C ATOM 915 C ALA A 53 0.117 1.686 10.925 1.00 0.00 C ATOM 916 O ALA A 53 0.086 1.298 9.758 1.00 0.00 O ATOM 917 CB ALA A 53 1.088 0.252 12.787 1.00 0.00 C ATOM 0 H ALA A 53 -0.849 -0.548 10.545 1.00 0.00 H new ATOM 0 HA ALA A 53 -0.788 1.256 12.804 1.00 0.00 H new ATOM 0 HB1 ALA A 53 1.628 1.116 13.174 1.00 0.00 H new ATOM 0 HB2 ALA A 53 0.819 -0.408 13.612 1.00 0.00 H new ATOM 0 HB3 ALA A 53 1.723 -0.287 12.084 1.00 0.00 H new ATOM 923 N ILE A 54 0.401 2.926 11.295 1.00 0.00 N ATOM 924 CA ILE A 54 0.706 3.950 10.311 1.00 0.00 C ATOM 925 C ILE A 54 2.145 4.431 10.509 1.00 0.00 C ATOM 926 O ILE A 54 2.655 4.427 11.628 1.00 0.00 O ATOM 927 CB ILE A 54 -0.331 5.074 10.368 1.00 0.00 C ATOM 928 CG1 ILE A 54 -0.505 5.730 8.997 1.00 0.00 C ATOM 929 CG2 ILE A 54 0.026 6.095 11.450 1.00 0.00 C ATOM 930 CD1 ILE A 54 -1.929 5.535 8.472 1.00 0.00 C ATOM 0 H ILE A 54 0.426 3.245 12.264 1.00 0.00 H new ATOM 0 HA ILE A 54 0.643 3.539 9.303 1.00 0.00 H new ATOM 0 HB ILE A 54 -1.292 4.638 10.641 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -0.283 6.795 9.069 1.00 0.00 H new ATOM 0 HG13 ILE A 54 0.208 5.302 8.292 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -0.727 6.883 11.469 1.00 0.00 H new ATOM 0 HG22 ILE A 54 0.058 5.600 12.421 1.00 0.00 H new ATOM 0 HG23 ILE A 54 1.001 6.530 11.232 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -2.025 6.011 7.496 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -2.140 4.470 8.378 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -2.638 5.985 9.167 1.00 0.00 H new ATOM 942 N ARG A 55 2.758 4.833 9.406 1.00 0.00 N ATOM 943 CA ARG A 55 4.128 5.315 9.445 1.00 0.00 C ATOM 944 C ARG A 55 4.306 6.487 8.478 1.00 0.00 C ATOM 945 O ARG A 55 3.505 6.668 7.562 1.00 0.00 O ATOM 946 CB ARG A 55 5.114 4.204 9.075 1.00 0.00 C ATOM 947 CG ARG A 55 5.076 3.072 10.104 1.00 0.00 C ATOM 948 CD ARG A 55 6.481 2.745 10.611 1.00 0.00 C ATOM 949 NE ARG A 55 6.478 2.656 12.088 1.00 0.00 N ATOM 950 CZ ARG A 55 7.559 2.366 12.826 1.00 0.00 C ATOM 951 NH1 ARG A 55 8.736 2.135 12.228 1.00 0.00 N ATOM 952 NH2 ARG A 55 7.463 2.308 14.161 1.00 0.00 N ATOM 0 H ARG A 55 2.331 4.835 8.480 1.00 0.00 H new ATOM 0 HA ARG A 55 4.334 5.644 10.463 1.00 0.00 H new ATOM 0 HB2 ARG A 55 4.871 3.811 8.088 1.00 0.00 H new ATOM 0 HB3 ARG A 55 6.123 4.613 9.016 1.00 0.00 H new ATOM 0 HG2 ARG A 55 4.441 3.359 10.942 1.00 0.00 H new ATOM 0 HG3 ARG A 55 4.631 2.183 9.656 1.00 0.00 H new ATOM 0 HD2 ARG A 55 6.821 1.802 10.182 1.00 0.00 H new ATOM 0 HD3 ARG A 55 7.182 3.514 10.286 1.00 0.00 H new ATOM 0 HE ARG A 55 5.598 2.826 12.575 1.00 0.00 H new ATOM 0 HH11 ARG A 55 8.809 2.180 11.212 1.00 0.00 H new ATOM 0 HH12 ARG A 55 9.559 1.914 12.789 1.00 0.00 H new ATOM 0 HH21 ARG A 55 6.567 2.484 14.616 1.00 0.00 H new ATOM 0 HH22 ARG A 55 8.286 2.087 14.722 1.00 0.00 H new ATOM 966 N VAL A 56 5.360 7.254 8.715 1.00 0.00 N ATOM 967 CA VAL A 56 5.653 8.404 7.877 1.00 0.00 C ATOM 968 C VAL A 56 7.146 8.418 7.542 1.00 0.00 C ATOM 969 O VAL A 56 7.981 8.130 8.398 1.00 0.00 O ATOM 970 CB VAL A 56 5.183 9.687 8.566 1.00 0.00 C ATOM 971 CG1 VAL A 56 4.752 10.734 7.538 1.00 0.00 C ATOM 972 CG2 VAL A 56 4.055 9.394 9.557 1.00 0.00 C ATOM 0 H VAL A 56 6.022 7.101 9.476 1.00 0.00 H new ATOM 0 HA VAL A 56 5.109 8.339 6.935 1.00 0.00 H new ATOM 0 HB VAL A 56 6.024 10.095 9.127 1.00 0.00 H new ATOM 0 HG11 VAL A 56 4.422 11.636 8.054 1.00 0.00 H new ATOM 0 HG12 VAL A 56 5.594 10.974 6.889 1.00 0.00 H new ATOM 0 HG13 VAL A 56 3.932 10.339 6.938 1.00 0.00 H new ATOM 0 HG21 VAL A 56 3.739 10.322 10.033 1.00 0.00 H new ATOM 0 HG22 VAL A 56 3.211 8.952 9.027 1.00 0.00 H new ATOM 0 HG23 VAL A 56 4.410 8.699 10.318 1.00 0.00 H new ATOM 982 N TYR A 57 7.437 8.757 6.294 1.00 0.00 N ATOM 983 CA TYR A 57 8.814 8.813 5.836 1.00 0.00 C ATOM 984 C TYR A 57 9.085 10.109 5.069 1.00 0.00 C ATOM 985 O TYR A 57 8.190 10.937 4.908 1.00 0.00 O ATOM 986 CB TYR A 57 8.991 7.626 4.886 1.00 0.00 C ATOM 987 CG TYR A 57 8.987 6.265 5.584 1.00 0.00 C ATOM 988 CD1 TYR A 57 7.824 5.782 6.148 1.00 0.00 C ATOM 989 CD2 TYR A 57 10.147 5.520 5.650 1.00 0.00 C ATOM 990 CE1 TYR A 57 7.820 4.500 6.805 1.00 0.00 C ATOM 991 CE2 TYR A 57 10.143 4.238 6.307 1.00 0.00 C ATOM 992 CZ TYR A 57 8.980 3.792 6.852 1.00 0.00 C ATOM 993 OH TYR A 57 8.976 2.582 7.473 1.00 0.00 O ATOM 0 H TYR A 57 6.742 8.996 5.586 1.00 0.00 H new ATOM 0 HA TYR A 57 9.501 8.778 6.681 1.00 0.00 H new ATOM 0 HB2 TYR A 57 8.192 7.645 4.144 1.00 0.00 H new ATOM 0 HB3 TYR A 57 9.930 7.743 4.346 1.00 0.00 H new ATOM 0 HD1 TYR A 57 6.916 6.365 6.097 1.00 0.00 H new ATOM 0 HD2 TYR A 57 11.058 5.898 5.209 1.00 0.00 H new ATOM 0 HE1 TYR A 57 6.916 4.110 7.250 1.00 0.00 H new ATOM 0 HE2 TYR A 57 11.043 3.645 6.365 1.00 0.00 H new ATOM 0 HH TYR A 57 9.873 2.189 7.429 1.00 0.00 H new ATOM 1003 N ASN A 58 10.323 10.244 4.617 1.00 0.00 N ATOM 1004 CA ASN A 58 10.722 11.425 3.871 1.00 0.00 C ATOM 1005 C ASN A 58 10.170 11.335 2.447 1.00 0.00 C ATOM 1006 O ASN A 58 9.612 12.302 1.931 1.00 0.00 O ATOM 1007 CB ASN A 58 12.246 11.531 3.781 1.00 0.00 C ATOM 1008 CG ASN A 58 12.792 12.490 4.840 1.00 0.00 C ATOM 1009 OD1 ASN A 58 12.660 13.699 4.746 1.00 0.00 O ATOM 1010 ND2 ASN A 58 13.412 11.886 5.849 1.00 0.00 N ATOM 0 H ASN A 58 11.063 9.555 4.753 1.00 0.00 H new ATOM 0 HA ASN A 58 10.329 12.299 4.390 1.00 0.00 H new ATOM 0 HB2 ASN A 58 12.691 10.545 3.914 1.00 0.00 H new ATOM 0 HB3 ASN A 58 12.532 11.879 2.788 1.00 0.00 H new ATOM 0 HD21 ASN A 58 13.812 12.440 6.606 1.00 0.00 H new ATOM 0 HD22 ASN A 58 13.487 10.869 5.866 1.00 0.00 H new ATOM 1017 N SER A 59 10.345 10.164 1.851 1.00 0.00 N ATOM 1018 CA SER A 59 9.871 9.935 0.497 1.00 0.00 C ATOM 1019 C SER A 59 9.736 8.433 0.237 1.00 0.00 C ATOM 1020 O SER A 59 10.207 7.618 1.029 1.00 0.00 O ATOM 1021 CB SER A 59 10.810 10.569 -0.530 1.00 0.00 C ATOM 1022 OG SER A 59 10.096 11.241 -1.564 1.00 0.00 O ATOM 0 H SER A 59 10.809 9.364 2.282 1.00 0.00 H new ATOM 0 HA SER A 59 8.893 10.405 0.393 1.00 0.00 H new ATOM 0 HB2 SER A 59 11.472 11.275 -0.029 1.00 0.00 H new ATOM 0 HB3 SER A 59 11.442 9.797 -0.969 1.00 0.00 H new ATOM 0 HG SER A 59 10.731 11.634 -2.198 1.00 0.00 H new ATOM 1028 N PHE A 60 9.092 8.113 -0.876 1.00 0.00 N ATOM 1029 CA PHE A 60 8.889 6.724 -1.250 1.00 0.00 C ATOM 1030 C PHE A 60 10.224 5.985 -1.357 1.00 0.00 C ATOM 1031 O PHE A 60 10.324 4.817 -0.984 1.00 0.00 O ATOM 1032 CB PHE A 60 8.209 6.725 -2.620 1.00 0.00 C ATOM 1033 CG PHE A 60 6.690 6.550 -2.561 1.00 0.00 C ATOM 1034 CD1 PHE A 60 6.156 5.403 -2.063 1.00 0.00 C ATOM 1035 CD2 PHE A 60 5.873 7.543 -3.006 1.00 0.00 C ATOM 1036 CE1 PHE A 60 4.746 5.241 -2.008 1.00 0.00 C ATOM 1037 CE2 PHE A 60 4.464 7.381 -2.951 1.00 0.00 C ATOM 1038 CZ PHE A 60 3.930 6.233 -2.453 1.00 0.00 C ATOM 0 H PHE A 60 8.704 8.792 -1.531 1.00 0.00 H new ATOM 0 HA PHE A 60 8.284 6.220 -0.496 1.00 0.00 H new ATOM 0 HB2 PHE A 60 8.437 7.663 -3.127 1.00 0.00 H new ATOM 0 HB3 PHE A 60 8.633 5.924 -3.225 1.00 0.00 H new ATOM 0 HD1 PHE A 60 6.804 4.615 -1.709 1.00 0.00 H new ATOM 0 HD2 PHE A 60 6.297 8.454 -3.401 1.00 0.00 H new ATOM 0 HE1 PHE A 60 4.322 4.330 -1.613 1.00 0.00 H new ATOM 0 HE2 PHE A 60 3.816 8.169 -3.305 1.00 0.00 H new ATOM 0 HZ PHE A 60 2.858 6.110 -2.411 1.00 0.00 H new ATOM 1048 N ARG A 61 11.218 6.696 -1.870 1.00 0.00 N ATOM 1049 CA ARG A 61 12.543 6.122 -2.031 1.00 0.00 C ATOM 1050 C ARG A 61 13.056 5.587 -0.692 1.00 0.00 C ATOM 1051 O ARG A 61 13.530 4.454 -0.613 1.00 0.00 O ATOM 1052 CB ARG A 61 13.531 7.159 -2.570 1.00 0.00 C ATOM 1053 CG ARG A 61 14.806 6.487 -3.083 1.00 0.00 C ATOM 1054 CD ARG A 61 14.713 6.209 -4.585 1.00 0.00 C ATOM 1055 NE ARG A 61 14.852 7.472 -5.343 1.00 0.00 N ATOM 1056 CZ ARG A 61 15.273 7.544 -6.613 1.00 0.00 C ATOM 1057 NH1 ARG A 61 15.600 6.425 -7.274 1.00 0.00 N ATOM 1058 NH2 ARG A 61 15.368 8.734 -7.221 1.00 0.00 N ATOM 0 H ARG A 61 11.132 7.664 -2.179 1.00 0.00 H new ATOM 0 HA ARG A 61 12.465 5.304 -2.747 1.00 0.00 H new ATOM 0 HB2 ARG A 61 13.065 7.726 -3.376 1.00 0.00 H new ATOM 0 HB3 ARG A 61 13.782 7.871 -1.783 1.00 0.00 H new ATOM 0 HG2 ARG A 61 15.665 7.126 -2.880 1.00 0.00 H new ATOM 0 HG3 ARG A 61 14.970 5.553 -2.546 1.00 0.00 H new ATOM 0 HD2 ARG A 61 15.494 5.509 -4.883 1.00 0.00 H new ATOM 0 HD3 ARG A 61 13.758 5.739 -4.818 1.00 0.00 H new ATOM 0 HE ARG A 61 14.612 8.343 -4.869 1.00 0.00 H new ATOM 0 HH11 ARG A 61 15.528 5.519 -6.810 1.00 0.00 H new ATOM 0 HH12 ARG A 61 15.921 6.479 -8.241 1.00 0.00 H new ATOM 0 HH21 ARG A 61 15.120 9.585 -6.717 1.00 0.00 H new ATOM 0 HH22 ARG A 61 15.689 8.789 -8.188 1.00 0.00 H new ATOM 1072 N GLU A 62 12.945 6.426 0.326 1.00 0.00 N ATOM 1073 CA GLU A 62 13.391 6.052 1.657 1.00 0.00 C ATOM 1074 C GLU A 62 12.587 4.855 2.170 1.00 0.00 C ATOM 1075 O GLU A 62 13.096 4.048 2.947 1.00 0.00 O ATOM 1076 CB GLU A 62 13.289 7.234 2.623 1.00 0.00 C ATOM 1077 CG GLU A 62 14.607 8.009 2.681 1.00 0.00 C ATOM 1078 CD GLU A 62 14.609 9.164 1.678 1.00 0.00 C ATOM 1079 OE1 GLU A 62 14.451 8.870 0.474 1.00 0.00 O ATOM 1080 OE2 GLU A 62 14.768 10.315 2.139 1.00 0.00 O ATOM 0 H GLU A 62 12.552 7.365 0.256 1.00 0.00 H new ATOM 0 HA GLU A 62 14.440 5.763 1.598 1.00 0.00 H new ATOM 0 HB2 GLU A 62 12.485 7.899 2.306 1.00 0.00 H new ATOM 0 HB3 GLU A 62 13.031 6.873 3.619 1.00 0.00 H new ATOM 0 HG2 GLU A 62 14.761 8.397 3.688 1.00 0.00 H new ATOM 0 HG3 GLU A 62 15.438 7.337 2.468 1.00 0.00 H new ATOM 1087 N MET A 63 11.346 4.777 1.714 1.00 0.00 N ATOM 1088 CA MET A 63 10.467 3.693 2.116 1.00 0.00 C ATOM 1089 C MET A 63 10.832 2.394 1.394 1.00 0.00 C ATOM 1090 O MET A 63 10.948 1.342 2.021 1.00 0.00 O ATOM 1091 CB MET A 63 9.018 4.064 1.797 1.00 0.00 C ATOM 1092 CG MET A 63 8.332 4.693 3.012 1.00 0.00 C ATOM 1093 SD MET A 63 6.637 5.092 2.618 1.00 0.00 S ATOM 1094 CE MET A 63 6.154 3.594 1.776 1.00 0.00 C ATOM 0 H MET A 63 10.928 5.448 1.069 1.00 0.00 H new ATOM 0 HA MET A 63 10.583 3.536 3.188 1.00 0.00 H new ATOM 0 HB2 MET A 63 8.993 4.761 0.960 1.00 0.00 H new ATOM 0 HB3 MET A 63 8.471 3.174 1.487 1.00 0.00 H new ATOM 0 HG2 MET A 63 8.365 4.004 3.856 1.00 0.00 H new ATOM 0 HG3 MET A 63 8.865 5.594 3.315 1.00 0.00 H new ATOM 0 HE1 MET A 63 5.082 3.439 1.896 1.00 0.00 H new ATOM 0 HE2 MET A 63 6.391 3.680 0.716 1.00 0.00 H new ATOM 0 HE3 MET A 63 6.693 2.748 2.201 1.00 0.00 H new ATOM 1104 N LEU A 64 11.003 2.511 0.085 1.00 0.00 N ATOM 1105 CA LEU A 64 11.353 1.359 -0.729 1.00 0.00 C ATOM 1106 C LEU A 64 12.775 0.911 -0.387 1.00 0.00 C ATOM 1107 O LEU A 64 13.073 -0.282 -0.395 1.00 0.00 O ATOM 1108 CB LEU A 64 11.146 1.670 -2.213 1.00 0.00 C ATOM 1109 CG LEU A 64 9.757 2.178 -2.605 1.00 0.00 C ATOM 1110 CD1 LEU A 64 9.727 2.616 -4.070 1.00 0.00 C ATOM 1111 CD2 LEU A 64 8.683 1.133 -2.296 1.00 0.00 C ATOM 0 H LEU A 64 10.906 3.385 -0.432 1.00 0.00 H new ATOM 0 HA LEU A 64 10.693 0.521 -0.507 1.00 0.00 H new ATOM 0 HB2 LEU A 64 11.882 2.416 -2.514 1.00 0.00 H new ATOM 0 HB3 LEU A 64 11.356 0.767 -2.786 1.00 0.00 H new ATOM 0 HG LEU A 64 9.532 3.058 -2.002 1.00 0.00 H new ATOM 0 HD11 LEU A 64 8.728 2.973 -4.323 1.00 0.00 H new ATOM 0 HD12 LEU A 64 10.449 3.418 -4.225 1.00 0.00 H new ATOM 0 HD13 LEU A 64 9.982 1.770 -4.708 1.00 0.00 H new ATOM 0 HD21 LEU A 64 7.706 1.520 -2.584 1.00 0.00 H new ATOM 0 HD22 LEU A 64 8.892 0.221 -2.855 1.00 0.00 H new ATOM 0 HD23 LEU A 64 8.686 0.913 -1.228 1.00 0.00 H new ATOM 1123 N GLU A 65 13.616 1.892 -0.094 1.00 0.00 N ATOM 1124 CA GLU A 65 15.000 1.614 0.250 1.00 0.00 C ATOM 1125 C GLU A 65 15.094 1.081 1.681 1.00 0.00 C ATOM 1126 O GLU A 65 15.785 0.096 1.937 1.00 0.00 O ATOM 1127 CB GLU A 65 15.871 2.859 0.070 1.00 0.00 C ATOM 1128 CG GLU A 65 16.277 3.036 -1.394 1.00 0.00 C ATOM 1129 CD GLU A 65 17.770 3.349 -1.515 1.00 0.00 C ATOM 1130 OE1 GLU A 65 18.164 4.433 -1.033 1.00 0.00 O ATOM 1131 OE2 GLU A 65 18.484 2.496 -2.085 1.00 0.00 O ATOM 0 H GLU A 65 13.365 2.881 -0.088 1.00 0.00 H new ATOM 0 HA GLU A 65 15.376 0.848 -0.428 1.00 0.00 H new ATOM 0 HB2 GLU A 65 15.327 3.740 0.409 1.00 0.00 H new ATOM 0 HB3 GLU A 65 16.763 2.776 0.691 1.00 0.00 H new ATOM 0 HG2 GLU A 65 16.046 2.128 -1.952 1.00 0.00 H new ATOM 0 HG3 GLU A 65 15.695 3.842 -1.842 1.00 0.00 H new ATOM 1138 N LYS A 66 14.389 1.756 2.577 1.00 0.00 N ATOM 1139 CA LYS A 66 14.384 1.363 3.976 1.00 0.00 C ATOM 1140 C LYS A 66 13.443 0.170 4.163 1.00 0.00 C ATOM 1141 O LYS A 66 13.886 -0.928 4.496 1.00 0.00 O ATOM 1142 CB LYS A 66 14.045 2.559 4.868 1.00 0.00 C ATOM 1143 CG LYS A 66 14.390 2.268 6.330 1.00 0.00 C ATOM 1144 CD LYS A 66 14.590 3.566 7.115 1.00 0.00 C ATOM 1145 CE LYS A 66 13.487 3.752 8.158 1.00 0.00 C ATOM 1146 NZ LYS A 66 13.840 3.058 9.416 1.00 0.00 N ATOM 0 H LYS A 66 13.817 2.573 2.361 1.00 0.00 H new ATOM 0 HA LYS A 66 15.378 1.037 4.283 1.00 0.00 H new ATOM 0 HB2 LYS A 66 14.594 3.437 4.529 1.00 0.00 H new ATOM 0 HB3 LYS A 66 12.984 2.793 4.781 1.00 0.00 H new ATOM 0 HG2 LYS A 66 13.592 1.682 6.786 1.00 0.00 H new ATOM 0 HG3 LYS A 66 15.297 1.665 6.380 1.00 0.00 H new ATOM 0 HD2 LYS A 66 15.562 3.551 7.608 1.00 0.00 H new ATOM 0 HD3 LYS A 66 14.593 4.413 6.429 1.00 0.00 H new ATOM 0 HE2 LYS A 66 13.337 4.814 8.352 1.00 0.00 H new ATOM 0 HE3 LYS A 66 12.545 3.362 7.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 13.080 3.195 10.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 13.960 2.042 9.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 14.728 3.449 9.791 1.00 0.00 H new ATOM 1160 N GLU A 67 12.162 0.427 3.941 1.00 0.00 N ATOM 1161 CA GLU A 67 11.156 -0.611 4.081 1.00 0.00 C ATOM 1162 C GLU A 67 11.435 -1.756 3.105 1.00 0.00 C ATOM 1163 O GLU A 67 11.467 -2.920 3.501 1.00 0.00 O ATOM 1164 CB GLU A 67 9.750 -0.043 3.873 1.00 0.00 C ATOM 1165 CG GLU A 67 8.809 -0.484 4.997 1.00 0.00 C ATOM 1166 CD GLU A 67 8.777 -2.009 5.118 1.00 0.00 C ATOM 1167 OE1 GLU A 67 8.802 -2.664 4.054 1.00 0.00 O ATOM 1168 OE2 GLU A 67 8.726 -2.485 6.273 1.00 0.00 O ATOM 0 H GLU A 67 11.798 1.339 3.665 1.00 0.00 H new ATOM 0 HA GLU A 67 11.207 -1.005 5.096 1.00 0.00 H new ATOM 0 HB2 GLU A 67 9.795 1.045 3.838 1.00 0.00 H new ATOM 0 HB3 GLU A 67 9.357 -0.377 2.913 1.00 0.00 H new ATOM 0 HG2 GLU A 67 9.135 -0.047 5.941 1.00 0.00 H new ATOM 0 HG3 GLU A 67 7.804 -0.110 4.803 1.00 0.00 H new ATOM 1175 N GLY A 68 11.629 -1.385 1.848 1.00 0.00 N ATOM 1176 CA GLY A 68 11.904 -2.367 0.813 1.00 0.00 C ATOM 1177 C GLY A 68 10.986 -2.163 -0.394 1.00 0.00 C ATOM 1178 O GLY A 68 9.764 -2.155 -0.254 1.00 0.00 O ATOM 0 H GLY A 68 11.601 -0.419 1.523 1.00 0.00 H new ATOM 0 HA2 GLY A 68 12.945 -2.289 0.500 1.00 0.00 H new ATOM 0 HA3 GLY A 68 11.766 -3.371 1.214 1.00 0.00 H new ATOM 1182 N LEU A 69 11.610 -2.002 -1.552 1.00 0.00 N ATOM 1183 CA LEU A 69 10.863 -1.799 -2.782 1.00 0.00 C ATOM 1184 C LEU A 69 9.879 -2.955 -2.973 1.00 0.00 C ATOM 1185 O LEU A 69 8.669 -2.741 -3.027 1.00 0.00 O ATOM 1186 CB LEU A 69 11.818 -1.602 -3.961 1.00 0.00 C ATOM 1187 CG LEU A 69 11.193 -1.700 -5.354 1.00 0.00 C ATOM 1188 CD1 LEU A 69 10.353 -0.460 -5.666 1.00 0.00 C ATOM 1189 CD2 LEU A 69 12.262 -1.951 -6.419 1.00 0.00 C ATOM 0 H LEU A 69 12.624 -2.008 -1.664 1.00 0.00 H new ATOM 0 HA LEU A 69 10.272 -0.885 -2.723 1.00 0.00 H new ATOM 0 HB2 LEU A 69 12.287 -0.623 -3.863 1.00 0.00 H new ATOM 0 HB3 LEU A 69 12.612 -2.345 -3.888 1.00 0.00 H new ATOM 0 HG LEU A 69 10.520 -2.557 -5.366 1.00 0.00 H new ATOM 0 HD11 LEU A 69 9.920 -0.555 -6.662 1.00 0.00 H new ATOM 0 HD12 LEU A 69 9.554 -0.367 -4.930 1.00 0.00 H new ATOM 0 HD13 LEU A 69 10.986 0.427 -5.628 1.00 0.00 H new ATOM 0 HD21 LEU A 69 11.790 -2.016 -7.400 1.00 0.00 H new ATOM 0 HD22 LEU A 69 12.979 -1.130 -6.415 1.00 0.00 H new ATOM 0 HD23 LEU A 69 12.779 -2.886 -6.202 1.00 0.00 H new ATOM 1201 N GLU A 70 10.435 -4.153 -3.072 1.00 0.00 N ATOM 1202 CA GLU A 70 9.622 -5.343 -3.256 1.00 0.00 C ATOM 1203 C GLU A 70 8.806 -5.629 -1.993 1.00 0.00 C ATOM 1204 O GLU A 70 7.868 -6.424 -2.023 1.00 0.00 O ATOM 1205 CB GLU A 70 10.487 -6.546 -3.634 1.00 0.00 C ATOM 1206 CG GLU A 70 10.473 -6.779 -5.146 1.00 0.00 C ATOM 1207 CD GLU A 70 11.263 -8.035 -5.516 1.00 0.00 C ATOM 1208 OE1 GLU A 70 12.484 -7.891 -5.745 1.00 0.00 O ATOM 1209 OE2 GLU A 70 10.629 -9.112 -5.561 1.00 0.00 O ATOM 0 H GLU A 70 11.439 -4.325 -3.028 1.00 0.00 H new ATOM 0 HA GLU A 70 8.930 -5.163 -4.079 1.00 0.00 H new ATOM 0 HB2 GLU A 70 11.511 -6.382 -3.297 1.00 0.00 H new ATOM 0 HB3 GLU A 70 10.122 -7.436 -3.122 1.00 0.00 H new ATOM 0 HG2 GLU A 70 9.444 -6.877 -5.493 1.00 0.00 H new ATOM 0 HG3 GLU A 70 10.899 -5.914 -5.654 1.00 0.00 H new ATOM 1216 N ASN A 71 9.194 -4.966 -0.914 1.00 0.00 N ATOM 1217 CA ASN A 71 8.511 -5.139 0.357 1.00 0.00 C ATOM 1218 C ASN A 71 7.404 -4.090 0.483 1.00 0.00 C ATOM 1219 O ASN A 71 6.772 -3.973 1.531 1.00 0.00 O ATOM 1220 CB ASN A 71 9.475 -4.953 1.530 1.00 0.00 C ATOM 1221 CG ASN A 71 10.687 -5.877 1.395 1.00 0.00 C ATOM 1222 OD1 ASN A 71 10.876 -6.555 0.399 1.00 0.00 O ATOM 1223 ND2 ASN A 71 11.497 -5.865 2.451 1.00 0.00 N ATOM 0 H ASN A 71 9.973 -4.308 -0.893 1.00 0.00 H new ATOM 0 HA ASN A 71 8.100 -6.148 0.385 1.00 0.00 H new ATOM 0 HB2 ASN A 71 9.807 -3.916 1.572 1.00 0.00 H new ATOM 0 HB3 ASN A 71 8.958 -5.160 2.467 1.00 0.00 H new ATOM 0 HD21 ASN A 71 12.335 -6.447 2.458 1.00 0.00 H new ATOM 0 HD22 ASN A 71 11.280 -5.274 3.253 1.00 0.00 H new ATOM 1230 N VAL A 72 7.205 -3.353 -0.600 1.00 0.00 N ATOM 1231 CA VAL A 72 6.186 -2.318 -0.623 1.00 0.00 C ATOM 1232 C VAL A 72 5.398 -2.413 -1.931 1.00 0.00 C ATOM 1233 O VAL A 72 4.168 -2.374 -1.923 1.00 0.00 O ATOM 1234 CB VAL A 72 6.829 -0.946 -0.412 1.00 0.00 C ATOM 1235 CG1 VAL A 72 5.782 0.168 -0.484 1.00 0.00 C ATOM 1236 CG2 VAL A 72 7.593 -0.896 0.913 1.00 0.00 C ATOM 0 H VAL A 72 7.732 -3.452 -1.468 1.00 0.00 H new ATOM 0 HA VAL A 72 5.479 -2.460 0.194 1.00 0.00 H new ATOM 0 HB VAL A 72 7.545 -0.785 -1.218 1.00 0.00 H new ATOM 0 HG11 VAL A 72 6.266 1.133 -0.331 1.00 0.00 H new ATOM 0 HG12 VAL A 72 5.303 0.154 -1.463 1.00 0.00 H new ATOM 0 HG13 VAL A 72 5.031 0.012 0.290 1.00 0.00 H new ATOM 0 HG21 VAL A 72 8.040 0.090 1.038 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.906 -1.090 1.737 1.00 0.00 H new ATOM 0 HG23 VAL A 72 8.378 -1.652 0.909 1.00 0.00 H new ATOM 1246 N LEU A 73 6.138 -2.537 -3.023 1.00 0.00 N ATOM 1247 CA LEU A 73 5.523 -2.639 -4.336 1.00 0.00 C ATOM 1248 C LEU A 73 6.027 -3.904 -5.033 1.00 0.00 C ATOM 1249 O LEU A 73 7.061 -3.880 -5.700 1.00 0.00 O ATOM 1250 CB LEU A 73 5.760 -1.358 -5.139 1.00 0.00 C ATOM 1251 CG LEU A 73 4.806 -1.115 -6.310 1.00 0.00 C ATOM 1252 CD1 LEU A 73 3.574 -0.328 -5.860 1.00 0.00 C ATOM 1253 CD2 LEU A 73 5.529 -0.432 -7.473 1.00 0.00 C ATOM 0 H LEU A 73 7.157 -2.569 -3.026 1.00 0.00 H new ATOM 0 HA LEU A 73 4.441 -2.735 -4.244 1.00 0.00 H new ATOM 0 HB2 LEU A 73 5.693 -0.509 -4.459 1.00 0.00 H new ATOM 0 HB3 LEU A 73 6.779 -1.378 -5.525 1.00 0.00 H new ATOM 0 HG LEU A 73 4.456 -2.082 -6.671 1.00 0.00 H new ATOM 0 HD11 LEU A 73 2.913 -0.169 -6.712 1.00 0.00 H new ATOM 0 HD12 LEU A 73 3.045 -0.889 -5.090 1.00 0.00 H new ATOM 0 HD13 LEU A 73 3.885 0.636 -5.457 1.00 0.00 H new ATOM 0 HD21 LEU A 73 4.829 -0.271 -8.292 1.00 0.00 H new ATOM 0 HD22 LEU A 73 5.927 0.527 -7.141 1.00 0.00 H new ATOM 0 HD23 LEU A 73 6.348 -1.065 -7.815 1.00 0.00 H new ATOM 1265 N PRO A 74 5.253 -5.007 -4.852 1.00 0.00 N ATOM 1266 CA PRO A 74 5.610 -6.279 -5.456 1.00 0.00 C ATOM 1267 C PRO A 74 5.314 -6.276 -6.957 1.00 0.00 C ATOM 1268 O PRO A 74 4.160 -6.155 -7.365 1.00 0.00 O ATOM 1269 CB PRO A 74 4.803 -7.317 -4.694 1.00 0.00 C ATOM 1270 CG PRO A 74 3.682 -6.553 -4.009 1.00 0.00 C ATOM 1271 CD PRO A 74 4.022 -5.073 -4.070 1.00 0.00 C ATOM 0 HA PRO A 74 6.677 -6.493 -5.386 1.00 0.00 H new ATOM 0 HB2 PRO A 74 4.404 -8.074 -5.369 1.00 0.00 H new ATOM 0 HB3 PRO A 74 5.424 -7.836 -3.964 1.00 0.00 H new ATOM 0 HG2 PRO A 74 2.730 -6.747 -4.504 1.00 0.00 H new ATOM 0 HG3 PRO A 74 3.575 -6.878 -2.974 1.00 0.00 H new ATOM 0 HD2 PRO A 74 3.222 -4.502 -4.542 1.00 0.00 H new ATOM 0 HD3 PRO A 74 4.164 -4.658 -3.072 1.00 0.00 H new ATOM 1279 N GLY A 75 6.376 -6.411 -7.738 1.00 0.00 N ATOM 1280 CA GLY A 75 6.244 -6.424 -9.185 1.00 0.00 C ATOM 1281 C GLY A 75 7.063 -5.300 -9.821 1.00 0.00 C ATOM 1282 O GLY A 75 7.520 -5.425 -10.956 1.00 0.00 O ATOM 0 H GLY A 75 7.332 -6.512 -7.396 1.00 0.00 H new ATOM 0 HA2 GLY A 75 6.576 -7.386 -9.575 1.00 0.00 H new ATOM 0 HA3 GLY A 75 5.195 -6.314 -9.459 1.00 0.00 H new ATOM 1286 N VAL A 76 7.225 -4.226 -9.062 1.00 0.00 N ATOM 1287 CA VAL A 76 7.981 -3.081 -9.537 1.00 0.00 C ATOM 1288 C VAL A 76 9.209 -3.570 -10.309 1.00 0.00 C ATOM 1289 O VAL A 76 9.746 -4.637 -10.016 1.00 0.00 O ATOM 1290 CB VAL A 76 8.339 -2.166 -8.363 1.00 0.00 C ATOM 1291 CG1 VAL A 76 9.146 -2.921 -7.306 1.00 0.00 C ATOM 1292 CG2 VAL A 76 9.092 -0.925 -8.845 1.00 0.00 C ATOM 0 H VAL A 76 6.845 -4.125 -8.121 1.00 0.00 H new ATOM 0 HA VAL A 76 7.380 -2.486 -10.225 1.00 0.00 H new ATOM 0 HB VAL A 76 7.409 -1.835 -7.901 1.00 0.00 H new ATOM 0 HG11 VAL A 76 9.387 -2.248 -6.483 1.00 0.00 H new ATOM 0 HG12 VAL A 76 8.559 -3.759 -6.930 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.068 -3.295 -7.751 1.00 0.00 H new ATOM 0 HG21 VAL A 76 9.334 -0.292 -7.991 1.00 0.00 H new ATOM 0 HG22 VAL A 76 10.012 -1.229 -9.344 1.00 0.00 H new ATOM 0 HG23 VAL A 76 8.467 -0.369 -9.543 1.00 0.00 H new ATOM 1302 N LYS A 77 9.616 -2.766 -11.280 1.00 0.00 N ATOM 1303 CA LYS A 77 10.770 -3.104 -12.096 1.00 0.00 C ATOM 1304 C LYS A 77 12.043 -2.632 -11.391 1.00 0.00 C ATOM 1305 O LYS A 77 13.079 -3.292 -11.465 1.00 0.00 O ATOM 1306 CB LYS A 77 10.607 -2.545 -13.511 1.00 0.00 C ATOM 1307 CG LYS A 77 9.604 -3.374 -14.316 1.00 0.00 C ATOM 1308 CD LYS A 77 9.969 -3.384 -15.802 1.00 0.00 C ATOM 1309 CE LYS A 77 8.841 -2.790 -16.647 1.00 0.00 C ATOM 1310 NZ LYS A 77 9.396 -1.987 -17.760 1.00 0.00 N ATOM 0 H LYS A 77 9.168 -1.882 -11.520 1.00 0.00 H new ATOM 0 HA LYS A 77 10.852 -4.185 -12.212 1.00 0.00 H new ATOM 0 HB2 LYS A 77 10.271 -1.509 -13.460 1.00 0.00 H new ATOM 0 HB3 LYS A 77 11.572 -2.542 -14.018 1.00 0.00 H new ATOM 0 HG2 LYS A 77 9.583 -4.395 -13.936 1.00 0.00 H new ATOM 0 HG3 LYS A 77 8.602 -2.965 -14.187 1.00 0.00 H new ATOM 0 HD2 LYS A 77 10.885 -2.814 -15.959 1.00 0.00 H new ATOM 0 HD3 LYS A 77 10.170 -4.406 -16.124 1.00 0.00 H new ATOM 0 HE2 LYS A 77 8.216 -3.590 -17.044 1.00 0.00 H new ATOM 0 HE3 LYS A 77 8.201 -2.165 -16.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 8.617 -1.591 -18.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 9.974 -1.213 -17.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 9.987 -2.593 -18.364 1.00 0.00 H new ATOM 1324 N SER A 78 11.925 -1.494 -10.724 1.00 0.00 N ATOM 1325 CA SER A 78 13.054 -0.926 -10.007 1.00 0.00 C ATOM 1326 C SER A 78 12.578 0.203 -9.091 1.00 0.00 C ATOM 1327 O SER A 78 11.454 0.685 -9.226 1.00 0.00 O ATOM 1328 CB SER A 78 14.119 -0.409 -10.976 1.00 0.00 C ATOM 1329 OG SER A 78 14.316 -1.296 -12.074 1.00 0.00 O ATOM 0 H SER A 78 11.065 -0.949 -10.665 1.00 0.00 H new ATOM 0 HA SER A 78 13.504 -1.712 -9.401 1.00 0.00 H new ATOM 0 HB2 SER A 78 13.824 0.571 -11.350 1.00 0.00 H new ATOM 0 HB3 SER A 78 15.061 -0.277 -10.443 1.00 0.00 H new ATOM 0 HG SER A 78 14.385 -2.216 -11.743 1.00 0.00 H new ATOM 1335 N ILE A 79 13.456 0.593 -8.179 1.00 0.00 N ATOM 1336 CA ILE A 79 13.140 1.656 -7.241 1.00 0.00 C ATOM 1337 C ILE A 79 12.666 2.888 -8.014 1.00 0.00 C ATOM 1338 O ILE A 79 11.722 3.560 -7.601 1.00 0.00 O ATOM 1339 CB ILE A 79 14.329 1.929 -6.318 1.00 0.00 C ATOM 1340 CG1 ILE A 79 14.694 0.683 -5.510 1.00 0.00 C ATOM 1341 CG2 ILE A 79 14.060 3.138 -5.419 1.00 0.00 C ATOM 1342 CD1 ILE A 79 14.194 0.799 -4.068 1.00 0.00 C ATOM 0 H ILE A 79 14.387 0.191 -8.070 1.00 0.00 H new ATOM 0 HA ILE A 79 12.322 1.355 -6.587 1.00 0.00 H new ATOM 0 HB ILE A 79 15.192 2.175 -6.937 1.00 0.00 H new ATOM 0 HG12 ILE A 79 14.260 -0.200 -5.980 1.00 0.00 H new ATOM 0 HG13 ILE A 79 15.775 0.546 -5.514 1.00 0.00 H new ATOM 0 HG21 ILE A 79 14.921 3.310 -4.773 1.00 0.00 H new ATOM 0 HG22 ILE A 79 13.888 4.020 -6.037 1.00 0.00 H new ATOM 0 HG23 ILE A 79 13.179 2.947 -4.806 1.00 0.00 H new ATOM 0 HD11 ILE A 79 14.466 -0.100 -3.515 1.00 0.00 H new ATOM 0 HD12 ILE A 79 14.649 1.669 -3.594 1.00 0.00 H new ATOM 0 HD13 ILE A 79 13.110 0.911 -4.067 1.00 0.00 H new ATOM 1354 N GLU A 80 13.343 3.148 -9.123 1.00 0.00 N ATOM 1355 CA GLU A 80 13.003 4.288 -9.958 1.00 0.00 C ATOM 1356 C GLU A 80 11.602 4.114 -10.548 1.00 0.00 C ATOM 1357 O GLU A 80 10.811 5.056 -10.567 1.00 0.00 O ATOM 1358 CB GLU A 80 14.042 4.487 -11.063 1.00 0.00 C ATOM 1359 CG GLU A 80 14.881 5.741 -10.806 1.00 0.00 C ATOM 1360 CD GLU A 80 14.608 6.810 -11.866 1.00 0.00 C ATOM 1361 OE1 GLU A 80 13.411 7.101 -12.083 1.00 0.00 O ATOM 1362 OE2 GLU A 80 15.601 7.312 -12.435 1.00 0.00 O ATOM 0 H GLU A 80 14.125 2.589 -9.463 1.00 0.00 H new ATOM 0 HA GLU A 80 13.006 5.183 -9.336 1.00 0.00 H new ATOM 0 HB2 GLU A 80 14.693 3.614 -11.117 1.00 0.00 H new ATOM 0 HB3 GLU A 80 13.541 4.571 -12.027 1.00 0.00 H new ATOM 0 HG2 GLU A 80 14.654 6.138 -9.817 1.00 0.00 H new ATOM 0 HG3 GLU A 80 15.940 5.482 -10.810 1.00 0.00 H new ATOM 1369 N GLU A 81 11.337 2.903 -11.015 1.00 0.00 N ATOM 1370 CA GLU A 81 10.045 2.594 -11.604 1.00 0.00 C ATOM 1371 C GLU A 81 8.940 2.716 -10.554 1.00 0.00 C ATOM 1372 O GLU A 81 7.847 3.196 -10.851 1.00 0.00 O ATOM 1373 CB GLU A 81 10.050 1.200 -12.236 1.00 0.00 C ATOM 1374 CG GLU A 81 10.246 1.285 -13.751 1.00 0.00 C ATOM 1375 CD GLU A 81 8.900 1.310 -14.477 1.00 0.00 C ATOM 1376 OE1 GLU A 81 8.054 2.139 -14.077 1.00 0.00 O ATOM 1377 OE2 GLU A 81 8.746 0.499 -15.416 1.00 0.00 O ATOM 0 H GLU A 81 11.995 2.124 -10.998 1.00 0.00 H new ATOM 0 HA GLU A 81 9.847 3.316 -12.397 1.00 0.00 H new ATOM 0 HB2 GLU A 81 10.847 0.600 -11.796 1.00 0.00 H new ATOM 0 HB3 GLU A 81 9.110 0.693 -12.015 1.00 0.00 H new ATOM 0 HG2 GLU A 81 10.813 2.182 -13.998 1.00 0.00 H new ATOM 0 HG3 GLU A 81 10.832 0.433 -14.094 1.00 0.00 H new ATOM 1384 N GLY A 82 9.263 2.275 -9.347 1.00 0.00 N ATOM 1385 CA GLY A 82 8.311 2.329 -8.251 1.00 0.00 C ATOM 1386 C GLY A 82 7.793 3.754 -8.044 1.00 0.00 C ATOM 1387 O GLY A 82 6.585 3.976 -7.978 1.00 0.00 O ATOM 0 H GLY A 82 10.171 1.879 -9.104 1.00 0.00 H new ATOM 0 HA2 GLY A 82 7.475 1.661 -8.458 1.00 0.00 H new ATOM 0 HA3 GLY A 82 8.784 1.974 -7.336 1.00 0.00 H new ATOM 1391 N ILE A 83 8.733 4.683 -7.949 1.00 0.00 N ATOM 1392 CA ILE A 83 8.387 6.080 -7.751 1.00 0.00 C ATOM 1393 C ILE A 83 7.449 6.532 -8.873 1.00 0.00 C ATOM 1394 O ILE A 83 6.514 7.295 -8.635 1.00 0.00 O ATOM 1395 CB ILE A 83 9.651 6.933 -7.625 1.00 0.00 C ATOM 1396 CG1 ILE A 83 10.363 6.664 -6.298 1.00 0.00 C ATOM 1397 CG2 ILE A 83 9.332 8.417 -7.815 1.00 0.00 C ATOM 1398 CD1 ILE A 83 11.880 6.614 -6.490 1.00 0.00 C ATOM 0 H ILE A 83 9.734 4.495 -8.006 1.00 0.00 H new ATOM 0 HA ILE A 83 7.848 6.210 -6.812 1.00 0.00 H new ATOM 0 HB ILE A 83 10.337 6.647 -8.422 1.00 0.00 H new ATOM 0 HG12 ILE A 83 10.109 7.444 -5.580 1.00 0.00 H new ATOM 0 HG13 ILE A 83 10.015 5.720 -5.879 1.00 0.00 H new ATOM 0 HG21 ILE A 83 10.248 9.001 -7.721 1.00 0.00 H new ATOM 0 HG22 ILE A 83 8.903 8.573 -8.805 1.00 0.00 H new ATOM 0 HG23 ILE A 83 8.618 8.736 -7.055 1.00 0.00 H new ATOM 0 HD11 ILE A 83 12.362 6.421 -5.531 1.00 0.00 H new ATOM 0 HD12 ILE A 83 12.132 5.817 -7.189 1.00 0.00 H new ATOM 0 HD13 ILE A 83 12.228 7.568 -6.886 1.00 0.00 H new ATOM 1410 N GLN A 84 7.733 6.043 -10.071 1.00 0.00 N ATOM 1411 CA GLN A 84 6.927 6.388 -11.230 1.00 0.00 C ATOM 1412 C GLN A 84 5.480 5.938 -11.022 1.00 0.00 C ATOM 1413 O GLN A 84 4.546 6.679 -11.324 1.00 0.00 O ATOM 1414 CB GLN A 84 7.513 5.779 -12.505 1.00 0.00 C ATOM 1415 CG GLN A 84 8.453 6.766 -13.202 1.00 0.00 C ATOM 1416 CD GLN A 84 7.700 8.024 -13.640 1.00 0.00 C ATOM 1417 OE1 GLN A 84 6.596 7.969 -14.156 1.00 0.00 O ATOM 1418 NE2 GLN A 84 8.357 9.156 -13.408 1.00 0.00 N ATOM 0 H GLN A 84 8.510 5.411 -10.264 1.00 0.00 H new ATOM 0 HA GLN A 84 6.937 7.472 -11.347 1.00 0.00 H new ATOM 0 HB2 GLN A 84 8.055 4.866 -12.260 1.00 0.00 H new ATOM 0 HB3 GLN A 84 6.706 5.499 -13.183 1.00 0.00 H new ATOM 0 HG2 GLN A 84 9.264 7.040 -12.527 1.00 0.00 H new ATOM 0 HG3 GLN A 84 8.908 6.289 -14.070 1.00 0.00 H new ATOM 0 HE21 GLN A 84 9.279 9.131 -12.972 1.00 0.00 H new ATOM 0 HE22 GLN A 84 7.939 10.050 -13.666 1.00 0.00 H new ATOM 1427 N VAL A 85 5.339 4.725 -10.508 1.00 0.00 N ATOM 1428 CA VAL A 85 4.021 4.167 -10.256 1.00 0.00 C ATOM 1429 C VAL A 85 3.252 5.092 -9.311 1.00 0.00 C ATOM 1430 O VAL A 85 2.040 5.254 -9.445 1.00 0.00 O ATOM 1431 CB VAL A 85 4.150 2.739 -9.722 1.00 0.00 C ATOM 1432 CG1 VAL A 85 2.964 2.380 -8.825 1.00 0.00 C ATOM 1433 CG2 VAL A 85 4.295 1.736 -10.867 1.00 0.00 C ATOM 0 H VAL A 85 6.116 4.113 -10.259 1.00 0.00 H new ATOM 0 HA VAL A 85 3.450 4.102 -11.183 1.00 0.00 H new ATOM 0 HB VAL A 85 5.055 2.688 -9.117 1.00 0.00 H new ATOM 0 HG11 VAL A 85 3.080 1.360 -8.459 1.00 0.00 H new ATOM 0 HG12 VAL A 85 2.926 3.067 -7.980 1.00 0.00 H new ATOM 0 HG13 VAL A 85 2.039 2.457 -9.397 1.00 0.00 H new ATOM 0 HG21 VAL A 85 4.385 0.729 -10.459 1.00 0.00 H new ATOM 0 HG22 VAL A 85 3.417 1.790 -11.511 1.00 0.00 H new ATOM 0 HG23 VAL A 85 5.186 1.973 -11.448 1.00 0.00 H new ATOM 1443 N TYR A 86 3.988 5.675 -8.376 1.00 0.00 N ATOM 1444 CA TYR A 86 3.391 6.579 -7.409 1.00 0.00 C ATOM 1445 C TYR A 86 3.064 7.930 -8.050 1.00 0.00 C ATOM 1446 O TYR A 86 2.162 8.633 -7.598 1.00 0.00 O ATOM 1447 CB TYR A 86 4.445 6.787 -6.319 1.00 0.00 C ATOM 1448 CG TYR A 86 5.005 5.487 -5.739 1.00 0.00 C ATOM 1449 CD1 TYR A 86 4.303 4.308 -5.884 1.00 0.00 C ATOM 1450 CD2 TYR A 86 6.213 5.493 -5.071 1.00 0.00 C ATOM 1451 CE1 TYR A 86 4.830 3.084 -5.338 1.00 0.00 C ATOM 1452 CE2 TYR A 86 6.740 4.269 -4.526 1.00 0.00 C ATOM 1453 CZ TYR A 86 6.023 3.125 -4.686 1.00 0.00 C ATOM 1454 OH TYR A 86 6.521 1.969 -4.171 1.00 0.00 O ATOM 0 H TYR A 86 4.993 5.538 -8.268 1.00 0.00 H new ATOM 0 HA TYR A 86 2.462 6.164 -7.018 1.00 0.00 H new ATOM 0 HB2 TYR A 86 5.267 7.373 -6.730 1.00 0.00 H new ATOM 0 HB3 TYR A 86 4.007 7.374 -5.512 1.00 0.00 H new ATOM 0 HD1 TYR A 86 3.358 4.303 -6.407 1.00 0.00 H new ATOM 0 HD2 TYR A 86 6.763 6.416 -4.957 1.00 0.00 H new ATOM 0 HE1 TYR A 86 4.290 2.155 -5.444 1.00 0.00 H new ATOM 0 HE2 TYR A 86 7.684 4.260 -4.002 1.00 0.00 H new ATOM 0 HH TYR A 86 7.155 1.575 -4.806 1.00 0.00 H new ATOM 1464 N ARG A 87 3.816 8.251 -9.092 1.00 0.00 N ATOM 1465 CA ARG A 87 3.618 9.505 -9.800 1.00 0.00 C ATOM 1466 C ARG A 87 2.367 9.427 -10.677 1.00 0.00 C ATOM 1467 O ARG A 87 1.608 10.391 -10.770 1.00 0.00 O ATOM 1468 CB ARG A 87 4.826 9.840 -10.676 1.00 0.00 C ATOM 1469 CG ARG A 87 5.629 11.000 -10.083 1.00 0.00 C ATOM 1470 CD ARG A 87 6.284 10.594 -8.761 1.00 0.00 C ATOM 1471 NE ARG A 87 7.566 11.313 -8.590 1.00 0.00 N ATOM 1472 CZ ARG A 87 8.619 11.176 -9.408 1.00 0.00 C ATOM 1473 NH1 ARG A 87 8.548 10.347 -10.458 1.00 0.00 N ATOM 1474 NH2 ARG A 87 9.742 11.868 -9.175 1.00 0.00 N ATOM 0 H ARG A 87 4.564 7.665 -9.463 1.00 0.00 H new ATOM 0 HA ARG A 87 3.495 10.291 -9.055 1.00 0.00 H new ATOM 0 HB2 ARG A 87 5.465 8.962 -10.772 1.00 0.00 H new ATOM 0 HB3 ARG A 87 4.491 10.101 -11.680 1.00 0.00 H new ATOM 0 HG2 ARG A 87 6.395 11.316 -10.791 1.00 0.00 H new ATOM 0 HG3 ARG A 87 4.973 11.855 -9.921 1.00 0.00 H new ATOM 0 HD2 ARG A 87 5.616 10.821 -7.930 1.00 0.00 H new ATOM 0 HD3 ARG A 87 6.456 9.518 -8.746 1.00 0.00 H new ATOM 0 HE ARG A 87 7.654 11.953 -7.800 1.00 0.00 H new ATOM 0 HH11 ARG A 87 7.693 9.820 -10.635 1.00 0.00 H new ATOM 0 HH12 ARG A 87 9.349 10.243 -11.081 1.00 0.00 H new ATOM 0 HH21 ARG A 87 9.796 12.499 -8.375 1.00 0.00 H new ATOM 0 HH22 ARG A 87 10.544 11.764 -9.797 1.00 0.00 H new ATOM 1488 N ARG A 88 2.189 8.270 -11.298 1.00 0.00 N ATOM 1489 CA ARG A 88 1.043 8.054 -12.164 1.00 0.00 C ATOM 1490 C ARG A 88 -0.257 8.195 -11.369 1.00 0.00 C ATOM 1491 O ARG A 88 -1.184 8.878 -11.804 1.00 0.00 O ATOM 1492 CB ARG A 88 1.091 6.666 -12.806 1.00 0.00 C ATOM 1493 CG ARG A 88 2.388 6.471 -13.594 1.00 0.00 C ATOM 1494 CD ARG A 88 2.685 4.985 -13.804 1.00 0.00 C ATOM 1495 NE ARG A 88 2.686 4.668 -15.249 1.00 0.00 N ATOM 1496 CZ ARG A 88 3.087 3.497 -15.762 1.00 0.00 C ATOM 1497 NH1 ARG A 88 3.521 2.524 -14.949 1.00 0.00 N ATOM 1498 NH2 ARG A 88 3.054 3.299 -17.086 1.00 0.00 N ATOM 0 H ARG A 88 2.820 7.472 -11.218 1.00 0.00 H new ATOM 0 HA ARG A 88 1.076 8.807 -12.951 1.00 0.00 H new ATOM 0 HB2 ARG A 88 1.012 5.901 -12.033 1.00 0.00 H new ATOM 0 HB3 ARG A 88 0.236 6.538 -13.469 1.00 0.00 H new ATOM 0 HG2 ARG A 88 2.309 6.970 -14.560 1.00 0.00 H new ATOM 0 HG3 ARG A 88 3.215 6.939 -13.061 1.00 0.00 H new ATOM 0 HD2 ARG A 88 3.652 4.734 -13.368 1.00 0.00 H new ATOM 0 HD3 ARG A 88 1.937 4.380 -13.291 1.00 0.00 H new ATOM 0 HE ARG A 88 2.361 5.386 -15.896 1.00 0.00 H new ATOM 0 HH11 ARG A 88 3.546 2.675 -13.941 1.00 0.00 H new ATOM 0 HH12 ARG A 88 3.826 1.632 -15.339 1.00 0.00 H new ATOM 0 HH21 ARG A 88 2.724 4.040 -17.704 1.00 0.00 H new ATOM 0 HH22 ARG A 88 3.359 2.407 -17.476 1.00 0.00 H new ATOM 1512 N PHE A 89 -0.284 7.539 -10.218 1.00 0.00 N ATOM 1513 CA PHE A 89 -1.455 7.583 -9.359 1.00 0.00 C ATOM 1514 C PHE A 89 -1.458 8.850 -8.501 1.00 0.00 C ATOM 1515 O PHE A 89 -2.429 9.605 -8.505 1.00 0.00 O ATOM 1516 CB PHE A 89 -1.384 6.360 -8.443 1.00 0.00 C ATOM 1517 CG PHE A 89 -1.450 5.023 -9.184 1.00 0.00 C ATOM 1518 CD1 PHE A 89 -2.354 4.843 -10.184 1.00 0.00 C ATOM 1519 CD2 PHE A 89 -0.605 4.014 -8.842 1.00 0.00 C ATOM 1520 CE1 PHE A 89 -2.415 3.602 -10.871 1.00 0.00 C ATOM 1521 CE2 PHE A 89 -0.666 2.773 -9.529 1.00 0.00 C ATOM 1522 CZ PHE A 89 -1.569 2.593 -10.529 1.00 0.00 C ATOM 0 H PHE A 89 0.486 6.974 -9.860 1.00 0.00 H new ATOM 0 HA PHE A 89 -2.361 7.585 -9.965 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -0.457 6.401 -7.870 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -2.204 6.407 -7.726 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -3.026 5.644 -10.456 1.00 0.00 H new ATOM 0 HD2 PHE A 89 0.113 4.157 -8.048 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -3.133 3.459 -11.665 1.00 0.00 H new ATOM 0 HE2 PHE A 89 0.005 1.972 -9.257 1.00 0.00 H new ATOM 0 HZ PHE A 89 -1.615 1.649 -11.052 1.00 0.00 H new ATOM 1532 N TYR A 90 -0.360 9.043 -7.784 1.00 0.00 N ATOM 1533 CA TYR A 90 -0.223 10.205 -6.923 1.00 0.00 C ATOM 1534 C TYR A 90 0.618 11.291 -7.596 1.00 0.00 C ATOM 1535 O TYR A 90 1.511 10.989 -8.386 1.00 0.00 O ATOM 1536 CB TYR A 90 0.505 9.716 -5.669 1.00 0.00 C ATOM 1537 CG TYR A 90 0.277 8.237 -5.353 1.00 0.00 C ATOM 1538 CD1 TYR A 90 -0.960 7.667 -5.575 1.00 0.00 C ATOM 1539 CD2 TYR A 90 1.308 7.472 -4.847 1.00 0.00 C ATOM 1540 CE1 TYR A 90 -1.175 6.274 -5.277 1.00 0.00 C ATOM 1541 CE2 TYR A 90 1.094 6.080 -4.550 1.00 0.00 C ATOM 1542 CZ TYR A 90 -0.138 5.550 -4.779 1.00 0.00 C ATOM 1543 OH TYR A 90 -0.340 4.234 -4.499 1.00 0.00 O ATOM 0 H TYR A 90 0.443 8.414 -7.782 1.00 0.00 H new ATOM 0 HA TYR A 90 -1.200 10.634 -6.699 1.00 0.00 H new ATOM 0 HB2 TYR A 90 1.574 9.890 -5.791 1.00 0.00 H new ATOM 0 HB3 TYR A 90 0.180 10.313 -4.817 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -1.767 8.265 -5.972 1.00 0.00 H new ATOM 0 HD2 TYR A 90 2.276 7.918 -4.674 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -2.138 5.815 -5.445 1.00 0.00 H new ATOM 0 HE2 TYR A 90 1.893 5.470 -4.155 1.00 0.00 H new ATOM 0 HH TYR A 90 0.488 3.843 -4.151 1.00 0.00 H new ATOM 1553 N ASP A 91 0.302 12.533 -7.259 1.00 0.00 N ATOM 1554 CA ASP A 91 1.018 13.666 -7.821 1.00 0.00 C ATOM 1555 C ASP A 91 2.423 13.726 -7.218 1.00 0.00 C ATOM 1556 O ASP A 91 2.634 13.301 -6.083 1.00 0.00 O ATOM 1557 CB ASP A 91 0.307 14.981 -7.497 1.00 0.00 C ATOM 1558 CG ASP A 91 -1.215 14.947 -7.640 1.00 0.00 C ATOM 1559 OD1 ASP A 91 -1.790 13.879 -7.337 1.00 0.00 O ATOM 1560 OD2 ASP A 91 -1.771 15.989 -8.050 1.00 0.00 O ATOM 0 H ASP A 91 -0.440 12.780 -6.604 1.00 0.00 H new ATOM 0 HA ASP A 91 1.061 13.536 -8.902 1.00 0.00 H new ATOM 0 HB2 ASP A 91 0.554 15.268 -6.475 1.00 0.00 H new ATOM 0 HB3 ASP A 91 0.701 15.760 -8.150 1.00 0.00 H new ATOM 1565 N GLU A 92 3.347 14.258 -8.004 1.00 0.00 N ATOM 1566 CA GLU A 92 4.726 14.379 -7.563 1.00 0.00 C ATOM 1567 C GLU A 92 4.862 15.522 -6.555 1.00 0.00 C ATOM 1568 O GLU A 92 5.661 15.442 -5.624 1.00 0.00 O ATOM 1569 CB GLU A 92 5.667 14.582 -8.752 1.00 0.00 C ATOM 1570 CG GLU A 92 7.098 14.846 -8.280 1.00 0.00 C ATOM 1571 CD GLU A 92 7.581 16.224 -8.739 1.00 0.00 C ATOM 1572 OE1 GLU A 92 7.016 17.220 -8.237 1.00 0.00 O ATOM 1573 OE2 GLU A 92 8.504 16.250 -9.581 1.00 0.00 O ATOM 0 H GLU A 92 3.168 14.610 -8.944 1.00 0.00 H new ATOM 0 HA GLU A 92 5.012 13.450 -7.071 1.00 0.00 H new ATOM 0 HB2 GLU A 92 5.648 13.699 -9.390 1.00 0.00 H new ATOM 0 HB3 GLU A 92 5.319 15.420 -9.357 1.00 0.00 H new ATOM 0 HG2 GLU A 92 7.143 14.784 -7.193 1.00 0.00 H new ATOM 0 HG3 GLU A 92 7.762 14.075 -8.671 1.00 0.00 H new ATOM 1580 N GLU A 93 4.068 16.560 -6.775 1.00 0.00 N ATOM 1581 CA GLU A 93 4.090 17.718 -5.898 1.00 0.00 C ATOM 1582 C GLU A 93 3.382 17.399 -4.579 1.00 0.00 C ATOM 1583 O GLU A 93 3.936 17.621 -3.504 1.00 0.00 O ATOM 1584 CB GLU A 93 3.457 18.934 -6.579 1.00 0.00 C ATOM 1585 CG GLU A 93 4.383 20.150 -6.499 1.00 0.00 C ATOM 1586 CD GLU A 93 3.663 21.346 -5.874 1.00 0.00 C ATOM 1587 OE1 GLU A 93 2.735 21.860 -6.535 1.00 0.00 O ATOM 1588 OE2 GLU A 93 4.057 21.720 -4.748 1.00 0.00 O ATOM 0 H GLU A 93 3.405 16.623 -7.548 1.00 0.00 H new ATOM 0 HA GLU A 93 5.129 17.964 -5.680 1.00 0.00 H new ATOM 0 HB2 GLU A 93 3.245 18.702 -7.623 1.00 0.00 H new ATOM 0 HB3 GLU A 93 2.504 19.166 -6.104 1.00 0.00 H new ATOM 0 HG2 GLU A 93 5.265 19.902 -5.908 1.00 0.00 H new ATOM 0 HG3 GLU A 93 4.732 20.412 -7.498 1.00 0.00 H new ATOM 1595 N LYS A 94 2.169 16.882 -4.706 1.00 0.00 N ATOM 1596 CA LYS A 94 1.380 16.530 -3.538 1.00 0.00 C ATOM 1597 C LYS A 94 2.187 15.579 -2.651 1.00 0.00 C ATOM 1598 O LYS A 94 2.185 15.714 -1.428 1.00 0.00 O ATOM 1599 CB LYS A 94 0.019 15.971 -3.959 1.00 0.00 C ATOM 1600 CG LYS A 94 0.050 14.443 -4.027 1.00 0.00 C ATOM 1601 CD LYS A 94 -1.346 13.878 -4.291 1.00 0.00 C ATOM 1602 CE LYS A 94 -2.246 14.044 -3.064 1.00 0.00 C ATOM 1603 NZ LYS A 94 -3.238 15.118 -3.291 1.00 0.00 N ATOM 0 H LYS A 94 1.713 16.698 -5.600 1.00 0.00 H new ATOM 0 HA LYS A 94 1.164 17.417 -2.943 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -0.745 16.291 -3.250 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -0.259 16.376 -4.932 1.00 0.00 H new ATOM 0 HG2 LYS A 94 0.731 14.124 -4.817 1.00 0.00 H new ATOM 0 HG3 LYS A 94 0.438 14.042 -3.091 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -1.792 14.387 -5.145 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -1.272 12.822 -4.552 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -2.759 13.106 -2.852 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -1.639 14.280 -2.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -3.566 15.486 -2.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -2.799 15.887 -3.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -4.047 14.737 -3.821 1.00 0.00 H new ATOM 1617 N GLU A 95 2.857 14.639 -3.301 1.00 0.00 N ATOM 1618 CA GLU A 95 3.666 13.667 -2.587 1.00 0.00 C ATOM 1619 C GLU A 95 4.834 14.362 -1.884 1.00 0.00 C ATOM 1620 O GLU A 95 5.037 14.181 -0.684 1.00 0.00 O ATOM 1621 CB GLU A 95 4.168 12.572 -3.531 1.00 0.00 C ATOM 1622 CG GLU A 95 4.580 11.322 -2.751 1.00 0.00 C ATOM 1623 CD GLU A 95 6.101 11.242 -2.606 1.00 0.00 C ATOM 1624 OE1 GLU A 95 6.752 10.929 -3.626 1.00 0.00 O ATOM 1625 OE2 GLU A 95 6.577 11.496 -1.479 1.00 0.00 O ATOM 0 H GLU A 95 2.856 14.530 -4.315 1.00 0.00 H new ATOM 0 HA GLU A 95 3.043 13.191 -1.830 1.00 0.00 H new ATOM 0 HB2 GLU A 95 3.386 12.317 -4.247 1.00 0.00 H new ATOM 0 HB3 GLU A 95 5.017 12.943 -4.105 1.00 0.00 H new ATOM 0 HG2 GLU A 95 4.117 11.336 -1.764 1.00 0.00 H new ATOM 0 HG3 GLU A 95 4.213 10.432 -3.263 1.00 0.00 H new ATOM 1632 N LYS A 96 5.570 15.143 -2.660 1.00 0.00 N ATOM 1633 CA LYS A 96 6.712 15.866 -2.126 1.00 0.00 C ATOM 1634 C LYS A 96 6.227 16.883 -1.090 1.00 0.00 C ATOM 1635 O LYS A 96 7.024 17.417 -0.320 1.00 0.00 O ATOM 1636 CB LYS A 96 7.531 16.487 -3.260 1.00 0.00 C ATOM 1637 CG LYS A 96 8.342 15.420 -3.997 1.00 0.00 C ATOM 1638 CD LYS A 96 9.444 16.058 -4.846 1.00 0.00 C ATOM 1639 CE LYS A 96 10.794 15.387 -4.586 1.00 0.00 C ATOM 1640 NZ LYS A 96 11.890 16.377 -4.679 1.00 0.00 N ATOM 0 H LYS A 96 5.398 15.291 -3.654 1.00 0.00 H new ATOM 0 HA LYS A 96 7.388 15.183 -1.612 1.00 0.00 H new ATOM 0 HB2 LYS A 96 6.865 16.991 -3.960 1.00 0.00 H new ATOM 0 HB3 LYS A 96 8.202 17.245 -2.856 1.00 0.00 H new ATOM 0 HG2 LYS A 96 8.785 14.733 -3.276 1.00 0.00 H new ATOM 0 HG3 LYS A 96 7.682 14.832 -4.634 1.00 0.00 H new ATOM 0 HD2 LYS A 96 9.189 15.973 -5.902 1.00 0.00 H new ATOM 0 HD3 LYS A 96 9.513 17.122 -4.619 1.00 0.00 H new ATOM 0 HE2 LYS A 96 10.794 14.927 -3.598 1.00 0.00 H new ATOM 0 HE3 LYS A 96 10.955 14.588 -5.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 12.800 15.906 -4.500 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 11.899 16.797 -5.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 11.743 17.125 -3.972 1.00 0.00 H new ATOM 1654 N LYS A 97 4.924 17.118 -1.104 1.00 0.00 N ATOM 1655 CA LYS A 97 4.323 18.061 -0.175 1.00 0.00 C ATOM 1656 C LYS A 97 4.305 17.448 1.226 1.00 0.00 C ATOM 1657 O LYS A 97 4.831 18.033 2.171 1.00 0.00 O ATOM 1658 CB LYS A 97 2.945 18.500 -0.673 1.00 0.00 C ATOM 1659 CG LYS A 97 2.793 20.020 -0.597 1.00 0.00 C ATOM 1660 CD LYS A 97 2.604 20.623 -1.991 1.00 0.00 C ATOM 1661 CE LYS A 97 1.131 20.938 -2.258 1.00 0.00 C ATOM 1662 NZ LYS A 97 0.935 22.394 -2.432 1.00 0.00 N ATOM 0 H LYS A 97 4.267 16.672 -1.744 1.00 0.00 H new ATOM 0 HA LYS A 97 4.919 18.972 -0.117 1.00 0.00 H new ATOM 0 HB2 LYS A 97 2.803 18.168 -1.701 1.00 0.00 H new ATOM 0 HB3 LYS A 97 2.169 18.023 -0.074 1.00 0.00 H new ATOM 0 HG2 LYS A 97 1.939 20.273 0.031 1.00 0.00 H new ATOM 0 HG3 LYS A 97 3.675 20.454 -0.126 1.00 0.00 H new ATOM 0 HD2 LYS A 97 3.196 21.534 -2.080 1.00 0.00 H new ATOM 0 HD3 LYS A 97 2.973 19.928 -2.745 1.00 0.00 H new ATOM 0 HE2 LYS A 97 0.797 20.411 -3.152 1.00 0.00 H new ATOM 0 HE3 LYS A 97 0.520 20.580 -1.429 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -0.070 22.590 -2.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 1.235 22.890 -1.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 1.502 22.727 -3.237 1.00 0.00 H new ATOM 1676 N TYR A 98 3.692 16.276 1.317 1.00 0.00 N ATOM 1677 CA TYR A 98 3.598 15.577 2.587 1.00 0.00 C ATOM 1678 C TYR A 98 4.672 14.493 2.697 1.00 0.00 C ATOM 1679 O TYR A 98 5.449 14.478 3.651 1.00 0.00 O ATOM 1680 CB TYR A 98 2.219 14.915 2.602 1.00 0.00 C ATOM 1681 CG TYR A 98 1.053 15.904 2.546 1.00 0.00 C ATOM 1682 CD1 TYR A 98 0.918 16.868 3.525 1.00 0.00 C ATOM 1683 CD2 TYR A 98 0.137 15.834 1.517 1.00 0.00 C ATOM 1684 CE1 TYR A 98 -0.179 17.799 3.473 1.00 0.00 C ATOM 1685 CE2 TYR A 98 -0.961 16.765 1.464 1.00 0.00 C ATOM 1686 CZ TYR A 98 -1.064 17.701 2.445 1.00 0.00 C ATOM 1687 OH TYR A 98 -2.101 18.581 2.395 1.00 0.00 O ATOM 0 H TYR A 98 3.256 15.793 0.531 1.00 0.00 H new ATOM 0 HA TYR A 98 3.739 16.269 3.417 1.00 0.00 H new ATOM 0 HB2 TYR A 98 2.145 14.234 1.754 1.00 0.00 H new ATOM 0 HB3 TYR A 98 2.127 14.311 3.505 1.00 0.00 H new ATOM 0 HD1 TYR A 98 1.636 16.924 4.330 1.00 0.00 H new ATOM 0 HD2 TYR A 98 0.243 15.081 0.750 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -0.296 18.558 4.233 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -1.685 16.721 0.664 1.00 0.00 H new ATOM 0 HH TYR A 98 -2.652 18.393 1.606 1.00 0.00 H new ATOM 1697 N GLY A 99 4.681 13.611 1.708 1.00 0.00 N ATOM 1698 CA GLY A 99 5.647 12.526 1.682 1.00 0.00 C ATOM 1699 C GLY A 99 4.953 11.179 1.473 1.00 0.00 C ATOM 1700 O GLY A 99 3.997 11.082 0.705 1.00 0.00 O ATOM 0 H GLY A 99 4.035 13.626 0.919 1.00 0.00 H new ATOM 0 HA2 GLY A 99 6.368 12.695 0.882 1.00 0.00 H new ATOM 0 HA3 GLY A 99 6.206 12.510 2.617 1.00 0.00 H new ATOM 1704 N VAL A 100 5.461 10.173 2.170 1.00 0.00 N ATOM 1705 CA VAL A 100 4.901 8.836 2.071 1.00 0.00 C ATOM 1706 C VAL A 100 4.677 8.276 3.477 1.00 0.00 C ATOM 1707 O VAL A 100 5.338 8.691 4.427 1.00 0.00 O ATOM 1708 CB VAL A 100 5.808 7.952 1.213 1.00 0.00 C ATOM 1709 CG1 VAL A 100 5.032 6.765 0.638 1.00 0.00 C ATOM 1710 CG2 VAL A 100 6.471 8.764 0.099 1.00 0.00 C ATOM 0 H VAL A 100 6.254 10.257 2.806 1.00 0.00 H new ATOM 0 HA VAL A 100 3.931 8.864 1.574 1.00 0.00 H new ATOM 0 HB VAL A 100 6.596 7.558 1.855 1.00 0.00 H new ATOM 0 HG11 VAL A 100 5.700 6.153 0.032 1.00 0.00 H new ATOM 0 HG12 VAL A 100 4.629 6.164 1.453 1.00 0.00 H new ATOM 0 HG13 VAL A 100 4.214 7.131 0.018 1.00 0.00 H new ATOM 0 HG21 VAL A 100 7.110 8.112 -0.496 1.00 0.00 H new ATOM 0 HG22 VAL A 100 5.703 9.200 -0.540 1.00 0.00 H new ATOM 0 HG23 VAL A 100 7.073 9.560 0.538 1.00 0.00 H new ATOM 1720 N VAL A 101 3.742 7.341 3.565 1.00 0.00 N ATOM 1721 CA VAL A 101 3.423 6.720 4.839 1.00 0.00 C ATOM 1722 C VAL A 101 3.262 5.211 4.640 1.00 0.00 C ATOM 1723 O VAL A 101 2.267 4.758 4.075 1.00 0.00 O ATOM 1724 CB VAL A 101 2.182 7.378 5.446 1.00 0.00 C ATOM 1725 CG1 VAL A 101 2.534 8.720 6.091 1.00 0.00 C ATOM 1726 CG2 VAL A 101 1.082 7.546 4.396 1.00 0.00 C ATOM 0 H VAL A 101 3.195 6.999 2.775 1.00 0.00 H new ATOM 0 HA VAL A 101 4.235 6.870 5.550 1.00 0.00 H new ATOM 0 HB VAL A 101 1.802 6.720 6.227 1.00 0.00 H new ATOM 0 HG11 VAL A 101 1.635 9.167 6.515 1.00 0.00 H new ATOM 0 HG12 VAL A 101 3.268 8.562 6.881 1.00 0.00 H new ATOM 0 HG13 VAL A 101 2.950 9.388 5.337 1.00 0.00 H new ATOM 0 HG21 VAL A 101 0.211 8.016 4.853 1.00 0.00 H new ATOM 0 HG22 VAL A 101 1.448 8.173 3.583 1.00 0.00 H new ATOM 0 HG23 VAL A 101 0.802 6.569 4.003 1.00 0.00 H new ATOM 1736 N ALA A 102 4.256 4.475 5.114 1.00 0.00 N ATOM 1737 CA ALA A 102 4.238 3.027 4.995 1.00 0.00 C ATOM 1738 C ALA A 102 3.256 2.448 6.016 1.00 0.00 C ATOM 1739 O ALA A 102 3.599 2.280 7.186 1.00 0.00 O ATOM 1740 CB ALA A 102 5.656 2.481 5.175 1.00 0.00 C ATOM 0 H ALA A 102 5.079 4.854 5.581 1.00 0.00 H new ATOM 0 HA ALA A 102 3.898 2.728 4.004 1.00 0.00 H new ATOM 0 HB1 ALA A 102 5.642 1.395 5.086 1.00 0.00 H new ATOM 0 HB2 ALA A 102 6.307 2.900 4.408 1.00 0.00 H new ATOM 0 HB3 ALA A 102 6.031 2.759 6.160 1.00 0.00 H new ATOM 1746 N ILE A 103 2.055 2.158 5.537 1.00 0.00 N ATOM 1747 CA ILE A 103 1.022 1.602 6.393 1.00 0.00 C ATOM 1748 C ILE A 103 1.031 0.077 6.271 1.00 0.00 C ATOM 1749 O ILE A 103 0.885 -0.463 5.176 1.00 0.00 O ATOM 1750 CB ILE A 103 -0.334 2.236 6.077 1.00 0.00 C ATOM 1751 CG1 ILE A 103 -0.231 3.762 6.042 1.00 0.00 C ATOM 1752 CG2 ILE A 103 -1.405 1.756 7.059 1.00 0.00 C ATOM 1753 CD1 ILE A 103 -0.662 4.309 4.680 1.00 0.00 C ATOM 0 H ILE A 103 1.775 2.298 4.566 1.00 0.00 H new ATOM 0 HA ILE A 103 1.224 1.840 7.437 1.00 0.00 H new ATOM 0 HB ILE A 103 -0.640 1.911 5.082 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -0.857 4.190 6.825 1.00 0.00 H new ATOM 0 HG13 ILE A 103 0.795 4.066 6.252 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -2.359 2.221 6.813 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -1.501 0.672 6.991 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -1.118 2.032 8.074 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -0.579 5.396 4.682 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -0.019 3.897 3.902 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -1.696 4.024 4.484 1.00 0.00 H new ATOM 1765 N GLU A 104 1.205 -0.575 7.412 1.00 0.00 N ATOM 1766 CA GLU A 104 1.235 -2.027 7.447 1.00 0.00 C ATOM 1767 C GLU A 104 -0.188 -2.587 7.472 1.00 0.00 C ATOM 1768 O GLU A 104 -0.873 -2.508 8.490 1.00 0.00 O ATOM 1769 CB GLU A 104 2.043 -2.530 8.645 1.00 0.00 C ATOM 1770 CG GLU A 104 2.487 -3.980 8.438 1.00 0.00 C ATOM 1771 CD GLU A 104 3.430 -4.430 9.555 1.00 0.00 C ATOM 1772 OE1 GLU A 104 4.083 -3.539 10.139 1.00 0.00 O ATOM 1773 OE2 GLU A 104 3.476 -5.655 9.799 1.00 0.00 O ATOM 0 H GLU A 104 1.327 -0.124 8.319 1.00 0.00 H new ATOM 0 HA GLU A 104 1.729 -2.382 6.542 1.00 0.00 H new ATOM 0 HB2 GLU A 104 2.917 -1.896 8.791 1.00 0.00 H new ATOM 0 HB3 GLU A 104 1.441 -2.456 9.551 1.00 0.00 H new ATOM 0 HG2 GLU A 104 1.613 -4.631 8.411 1.00 0.00 H new ATOM 0 HG3 GLU A 104 2.987 -4.077 7.474 1.00 0.00 H new ATOM 1780 N ILE A 105 -0.592 -3.142 6.338 1.00 0.00 N ATOM 1781 CA ILE A 105 -1.921 -3.715 6.217 1.00 0.00 C ATOM 1782 C ILE A 105 -1.836 -5.232 6.393 1.00 0.00 C ATOM 1783 O ILE A 105 -0.767 -5.820 6.233 1.00 0.00 O ATOM 1784 CB ILE A 105 -2.572 -3.285 4.901 1.00 0.00 C ATOM 1785 CG1 ILE A 105 -2.154 -4.207 3.754 1.00 0.00 C ATOM 1786 CG2 ILE A 105 -2.271 -1.816 4.594 1.00 0.00 C ATOM 1787 CD1 ILE A 105 -0.658 -4.074 3.461 1.00 0.00 C ATOM 0 H ILE A 105 -0.021 -3.207 5.495 1.00 0.00 H new ATOM 0 HA ILE A 105 -2.571 -3.338 7.006 1.00 0.00 H new ATOM 0 HB ILE A 105 -3.653 -3.377 5.010 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -2.388 -5.240 4.010 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -2.727 -3.963 2.859 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -2.745 -1.536 3.653 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -2.660 -1.189 5.397 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -1.193 -1.675 4.513 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -0.387 -4.740 2.642 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -0.432 -3.045 3.182 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -0.088 -4.342 4.350 1.00 0.00 H new ATOM 1799 N GLU A 106 -2.976 -5.823 6.721 1.00 0.00 N ATOM 1800 CA GLU A 106 -3.043 -7.261 6.921 1.00 0.00 C ATOM 1801 C GLU A 106 -4.387 -7.803 6.428 1.00 0.00 C ATOM 1802 O GLU A 106 -5.423 -7.557 7.044 1.00 0.00 O ATOM 1803 CB GLU A 106 -2.812 -7.621 8.389 1.00 0.00 C ATOM 1804 CG GLU A 106 -3.634 -6.719 9.312 1.00 0.00 C ATOM 1805 CD GLU A 106 -3.822 -7.365 10.686 1.00 0.00 C ATOM 1806 OE1 GLU A 106 -2.787 -7.695 11.304 1.00 0.00 O ATOM 1807 OE2 GLU A 106 -4.996 -7.514 11.087 1.00 0.00 O ATOM 0 H GLU A 106 -3.860 -5.332 6.853 1.00 0.00 H new ATOM 0 HA GLU A 106 -2.249 -7.727 6.338 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -3.083 -8.663 8.558 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -1.753 -7.524 8.629 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -3.135 -5.756 9.424 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -4.607 -6.523 8.862 1.00 0.00 H new ATOM 1814 N PRO A 107 -4.324 -8.549 5.293 1.00 0.00 N ATOM 1815 CA PRO A 107 -5.523 -9.128 4.711 1.00 0.00 C ATOM 1816 C PRO A 107 -5.997 -10.336 5.521 1.00 0.00 C ATOM 1817 O PRO A 107 -5.270 -11.318 5.660 1.00 0.00 O ATOM 1818 CB PRO A 107 -5.136 -9.483 3.285 1.00 0.00 C ATOM 1819 CG PRO A 107 -3.616 -9.521 3.263 1.00 0.00 C ATOM 1820 CD PRO A 107 -3.115 -8.860 4.537 1.00 0.00 C ATOM 0 HA PRO A 107 -6.369 -8.441 4.720 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -5.555 -10.446 2.995 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -5.519 -8.744 2.581 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -3.261 -10.550 3.201 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -3.234 -8.999 2.386 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -2.458 -9.526 5.097 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -2.543 -7.959 4.317 1.00 0.00 H new ATOM 1828 N LEU A 108 -7.214 -10.224 6.033 1.00 0.00 N ATOM 1829 CA LEU A 108 -7.794 -11.295 6.825 1.00 0.00 C ATOM 1830 C LEU A 108 -8.782 -12.084 5.963 1.00 0.00 C ATOM 1831 O LEU A 108 -9.960 -12.187 6.300 1.00 0.00 O ATOM 1832 CB LEU A 108 -8.408 -10.739 8.111 1.00 0.00 C ATOM 1833 CG LEU A 108 -8.914 -9.296 8.043 1.00 0.00 C ATOM 1834 CD1 LEU A 108 -7.747 -8.308 7.982 1.00 0.00 C ATOM 1835 CD2 LEU A 108 -9.885 -9.110 6.876 1.00 0.00 C ATOM 0 H LEU A 108 -7.814 -9.408 5.915 1.00 0.00 H new ATOM 0 HA LEU A 108 -7.021 -11.993 7.145 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -9.240 -11.381 8.401 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -7.663 -10.805 8.904 1.00 0.00 H new ATOM 0 HG LEU A 108 -9.467 -9.084 8.958 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -8.134 -7.290 7.934 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -7.129 -8.420 8.873 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -7.146 -8.509 7.095 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -10.229 -8.076 6.850 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -9.379 -9.347 5.940 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -10.740 -9.774 7.004 1.00 0.00 H new