USER MOD reduce.3.24.130724 H: found=0, std=0, add=932, rem=0, adj=11 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 -158:sc= 0 (180deg=-0.526) USER MOD Single : A 8 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 16 LYS NZ :NH3+ 168:sc= 0.46 (180deg=0.395) 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+ 180:sc= 0 (180deg=0) 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= -0.284 X(o=-0.28,f=-0.053) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 SER OG : rot 32:sc= 0.298 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 TYR OH : rot 18:sc= 1.1 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 150:sc= -2.2 (180deg=-5.86!) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 ASN : amide:sc= -0.507 K(o=-0.51,f=-4.1!) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 20:sc= 1.06 USER MOD Single : A 84 GLN : amide:sc= -0.587 X(o=-0.59,f=-0.7) USER MOD Single : A 86 TYR OH : rot -2:sc= -1.84 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 -15.995 1.403 8.190 1.00 0.00 N ATOM 18 CA GLU A 2 -15.211 0.509 7.355 1.00 0.00 C ATOM 19 C GLU A 2 -14.971 1.139 5.982 1.00 0.00 C ATOM 20 O GLU A 2 -15.824 1.863 5.470 1.00 0.00 O ATOM 21 CB GLU A 2 -15.892 -0.854 7.222 1.00 0.00 C ATOM 22 CG GLU A 2 -14.972 -1.861 6.528 1.00 0.00 C ATOM 23 CD GLU A 2 -14.871 -3.158 7.334 1.00 0.00 C ATOM 24 OE1 GLU A 2 -14.647 -3.048 8.559 1.00 0.00 O ATOM 25 OE2 GLU A 2 -15.020 -4.229 6.708 1.00 0.00 O ATOM 0 HA GLU A 2 -14.245 0.350 7.833 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -16.165 -1.226 8.209 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -16.816 -0.749 6.654 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -15.352 -2.078 5.530 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -13.980 -1.427 6.404 1.00 0.00 H new ATOM 32 N TRP A 3 -13.807 0.841 5.424 1.00 0.00 N ATOM 33 CA TRP A 3 -13.445 1.369 4.120 1.00 0.00 C ATOM 34 C TRP A 3 -13.659 0.262 3.085 1.00 0.00 C ATOM 35 O TRP A 3 -13.435 -0.913 3.373 1.00 0.00 O ATOM 36 CB TRP A 3 -12.014 1.912 4.126 1.00 0.00 C ATOM 37 CG TRP A 3 -11.589 2.530 5.460 1.00 0.00 C ATOM 38 CD1 TRP A 3 -10.663 2.082 6.319 1.00 0.00 C ATOM 39 CD2 TRP A 3 -12.116 3.734 6.055 1.00 0.00 C ATOM 40 NE1 TRP A 3 -10.554 2.907 7.420 1.00 0.00 N ATOM 41 CE2 TRP A 3 -11.466 3.943 7.255 1.00 0.00 C ATOM 42 CE3 TRP A 3 -13.108 4.618 5.596 1.00 0.00 C ATOM 43 CZ2 TRP A 3 -11.736 5.031 8.094 1.00 0.00 C ATOM 44 CZ3 TRP A 3 -13.367 5.700 6.447 1.00 0.00 C ATOM 45 CH2 TRP A 3 -12.722 5.924 7.657 1.00 0.00 C ATOM 0 H TRP A 3 -13.102 0.240 5.851 1.00 0.00 H new ATOM 0 HA TRP A 3 -14.078 2.217 3.859 1.00 0.00 H new ATOM 0 HB2 TRP A 3 -11.328 1.102 3.877 1.00 0.00 H new ATOM 0 HB3 TRP A 3 -11.918 2.663 3.342 1.00 0.00 H new ATOM 0 HD1 TRP A 3 -10.076 1.188 6.169 1.00 0.00 H new ATOM 0 HE1 TRP A 3 -9.921 2.780 8.209 1.00 0.00 H new ATOM 0 HE3 TRP A 3 -13.629 4.474 4.661 1.00 0.00 H new ATOM 0 HZ2 TRP A 3 -11.212 5.174 9.028 1.00 0.00 H new ATOM 0 HZ3 TRP A 3 -14.121 6.410 6.141 1.00 0.00 H new ATOM 0 HH2 TRP A 3 -12.980 6.783 8.258 1.00 0.00 H new ATOM 56 N GLU A 4 -14.091 0.676 1.903 1.00 0.00 N ATOM 57 CA GLU A 4 -14.339 -0.265 0.825 1.00 0.00 C ATOM 58 C GLU A 4 -13.888 0.328 -0.511 1.00 0.00 C ATOM 59 O GLU A 4 -14.086 1.515 -0.766 1.00 0.00 O ATOM 60 CB GLU A 4 -15.814 -0.668 0.776 1.00 0.00 C ATOM 61 CG GLU A 4 -16.688 0.506 0.333 1.00 0.00 C ATOM 62 CD GLU A 4 -17.164 0.321 -1.110 1.00 0.00 C ATOM 63 OE1 GLU A 4 -17.972 -0.607 -1.326 1.00 0.00 O ATOM 64 OE2 GLU A 4 -16.708 1.113 -1.964 1.00 0.00 O ATOM 0 H GLU A 4 -14.276 1.651 1.668 1.00 0.00 H new ATOM 0 HA GLU A 4 -13.757 -1.167 1.015 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -15.944 -1.503 0.087 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -16.133 -1.013 1.759 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -17.549 0.593 0.995 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -16.125 1.436 0.418 1.00 0.00 H new ATOM 71 N MET A 5 -13.289 -0.526 -1.329 1.00 0.00 N ATOM 72 CA MET A 5 -12.809 -0.101 -2.633 1.00 0.00 C ATOM 73 C MET A 5 -13.080 -1.171 -3.693 1.00 0.00 C ATOM 74 O MET A 5 -13.755 -2.162 -3.421 1.00 0.00 O ATOM 75 CB MET A 5 -11.306 0.175 -2.558 1.00 0.00 C ATOM 76 CG MET A 5 -10.976 1.105 -1.389 1.00 0.00 C ATOM 77 SD MET A 5 -9.484 2.020 -1.739 1.00 0.00 S ATOM 78 CE MET A 5 -9.071 2.578 -0.094 1.00 0.00 C ATOM 0 H MET A 5 -13.125 -1.510 -1.114 1.00 0.00 H new ATOM 0 HA MET A 5 -13.341 0.807 -2.917 1.00 0.00 H new ATOM 0 HB2 MET A 5 -10.766 -0.765 -2.443 1.00 0.00 H new ATOM 0 HB3 MET A 5 -10.968 0.625 -3.492 1.00 0.00 H new ATOM 0 HG2 MET A 5 -11.803 1.794 -1.217 1.00 0.00 H new ATOM 0 HG3 MET A 5 -10.850 0.524 -0.476 1.00 0.00 H new ATOM 0 HE1 MET A 5 -8.426 3.454 -0.158 1.00 0.00 H new ATOM 0 HE2 MET A 5 -9.984 2.838 0.442 1.00 0.00 H new ATOM 0 HE3 MET A 5 -8.551 1.783 0.440 1.00 0.00 H new ATOM 88 N GLY A 6 -12.539 -0.934 -4.879 1.00 0.00 N ATOM 89 CA GLY A 6 -12.714 -1.865 -5.981 1.00 0.00 C ATOM 90 C GLY A 6 -11.527 -1.804 -6.944 1.00 0.00 C ATOM 91 O GLY A 6 -11.687 -1.452 -8.112 1.00 0.00 O ATOM 0 H GLY A 6 -11.979 -0.111 -5.101 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -12.820 -2.878 -5.593 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -13.634 -1.631 -6.517 1.00 0.00 H new ATOM 95 N LEU A 7 -10.361 -2.152 -6.419 1.00 0.00 N ATOM 96 CA LEU A 7 -9.147 -2.141 -7.217 1.00 0.00 C ATOM 97 C LEU A 7 -9.139 -3.360 -8.142 1.00 0.00 C ATOM 98 O LEU A 7 -10.107 -4.118 -8.183 1.00 0.00 O ATOM 99 CB LEU A 7 -7.914 -2.043 -6.317 1.00 0.00 C ATOM 100 CG LEU A 7 -7.902 -2.963 -5.094 1.00 0.00 C ATOM 101 CD1 LEU A 7 -6.632 -3.816 -5.063 1.00 0.00 C ATOM 102 CD2 LEU A 7 -8.087 -2.163 -3.804 1.00 0.00 C ATOM 0 H LEU A 7 -10.232 -2.443 -5.450 1.00 0.00 H new ATOM 0 HA LEU A 7 -9.118 -1.257 -7.854 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -7.031 -2.260 -6.919 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -7.820 -1.013 -5.973 1.00 0.00 H new ATOM 0 HG LEU A 7 -8.747 -3.647 -5.172 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -6.648 -4.461 -4.184 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -6.584 -4.430 -5.963 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -5.758 -3.166 -5.020 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -8.075 -2.841 -2.951 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -7.277 -1.440 -3.705 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -9.041 -1.637 -3.836 1.00 0.00 H new ATOM 114 N GLN A 8 -8.036 -3.511 -8.860 1.00 0.00 N ATOM 115 CA GLN A 8 -7.889 -4.625 -9.781 1.00 0.00 C ATOM 116 C GLN A 8 -7.610 -5.917 -9.011 1.00 0.00 C ATOM 117 O GLN A 8 -7.050 -5.883 -7.916 1.00 0.00 O ATOM 118 CB GLN A 8 -6.787 -4.348 -10.805 1.00 0.00 C ATOM 119 CG GLN A 8 -7.360 -4.273 -12.221 1.00 0.00 C ATOM 120 CD GLN A 8 -7.780 -2.843 -12.568 1.00 0.00 C ATOM 121 OE1 GLN A 8 -8.224 -2.078 -11.728 1.00 0.00 O ATOM 122 NE2 GLN A 8 -7.616 -2.527 -13.849 1.00 0.00 N ATOM 0 H GLN A 8 -7.235 -2.880 -8.823 1.00 0.00 H new ATOM 0 HA GLN A 8 -8.825 -4.745 -10.327 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -6.287 -3.411 -10.561 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -6.033 -5.134 -10.755 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -6.616 -4.621 -12.937 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -8.219 -4.939 -12.305 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -7.239 -3.216 -14.500 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -7.867 -1.596 -14.181 1.00 0.00 H new ATOM 131 N GLU A 9 -8.013 -7.026 -9.613 1.00 0.00 N ATOM 132 CA GLU A 9 -7.813 -8.327 -8.997 1.00 0.00 C ATOM 133 C GLU A 9 -6.319 -8.608 -8.823 1.00 0.00 C ATOM 134 O GLU A 9 -5.877 -8.987 -7.740 1.00 0.00 O ATOM 135 CB GLU A 9 -8.487 -9.430 -9.815 1.00 0.00 C ATOM 136 CG GLU A 9 -9.221 -10.417 -8.905 1.00 0.00 C ATOM 137 CD GLU A 9 -10.524 -10.894 -9.551 1.00 0.00 C ATOM 138 OE1 GLU A 9 -11.465 -10.073 -9.602 1.00 0.00 O ATOM 139 OE2 GLU A 9 -10.549 -12.068 -9.979 1.00 0.00 O ATOM 0 H GLU A 9 -8.477 -7.051 -10.521 1.00 0.00 H new ATOM 0 HA GLU A 9 -8.278 -8.316 -8.011 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -9.191 -8.987 -10.519 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -7.738 -9.960 -10.404 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -8.579 -11.273 -8.698 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -9.438 -9.943 -7.948 1.00 0.00 H new ATOM 146 N GLU A 10 -5.583 -8.413 -9.907 1.00 0.00 N ATOM 147 CA GLU A 10 -4.148 -8.640 -9.888 1.00 0.00 C ATOM 148 C GLU A 10 -3.503 -7.867 -8.736 1.00 0.00 C ATOM 149 O GLU A 10 -2.513 -8.316 -8.160 1.00 0.00 O ATOM 150 CB GLU A 10 -3.514 -8.258 -11.227 1.00 0.00 C ATOM 151 CG GLU A 10 -2.690 -9.416 -11.794 1.00 0.00 C ATOM 152 CD GLU A 10 -1.655 -8.910 -12.801 1.00 0.00 C ATOM 153 OE1 GLU A 10 -0.561 -8.516 -12.342 1.00 0.00 O ATOM 154 OE2 GLU A 10 -1.981 -8.930 -14.008 1.00 0.00 O ATOM 0 H GLU A 10 -5.954 -8.100 -10.804 1.00 0.00 H new ATOM 0 HA GLU A 10 -3.971 -9.704 -9.730 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -4.294 -7.980 -11.936 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.877 -7.384 -11.095 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -2.187 -9.941 -10.982 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -3.351 -10.136 -12.277 1.00 0.00 H new ATOM 161 N PHE A 11 -4.090 -6.719 -8.435 1.00 0.00 N ATOM 162 CA PHE A 11 -3.585 -5.879 -7.362 1.00 0.00 C ATOM 163 C PHE A 11 -3.949 -6.459 -5.993 1.00 0.00 C ATOM 164 O PHE A 11 -3.197 -6.310 -5.032 1.00 0.00 O ATOM 165 CB PHE A 11 -4.250 -4.509 -7.515 1.00 0.00 C ATOM 166 CG PHE A 11 -3.272 -3.334 -7.460 1.00 0.00 C ATOM 167 CD1 PHE A 11 -2.929 -2.790 -6.261 1.00 0.00 C ATOM 168 CD2 PHE A 11 -2.746 -2.833 -8.609 1.00 0.00 C ATOM 169 CE1 PHE A 11 -2.022 -1.698 -6.210 1.00 0.00 C ATOM 170 CE2 PHE A 11 -1.839 -1.741 -8.559 1.00 0.00 C ATOM 171 CZ PHE A 11 -1.496 -1.197 -7.360 1.00 0.00 C ATOM 0 H PHE A 11 -4.911 -6.350 -8.915 1.00 0.00 H new ATOM 0 HA PHE A 11 -2.499 -5.813 -7.422 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -4.784 -4.480 -8.465 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -4.993 -4.387 -6.727 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -3.346 -3.188 -5.348 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -3.018 -3.266 -9.561 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -1.750 -1.266 -5.258 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -1.422 -1.343 -9.472 1.00 0.00 H new ATOM 0 HZ PHE A 11 -0.806 -0.367 -7.321 1.00 0.00 H new ATOM 181 N LEU A 12 -5.103 -7.109 -5.950 1.00 0.00 N ATOM 182 CA LEU A 12 -5.576 -7.712 -4.716 1.00 0.00 C ATOM 183 C LEU A 12 -4.572 -8.769 -4.252 1.00 0.00 C ATOM 184 O LEU A 12 -4.216 -8.819 -3.076 1.00 0.00 O ATOM 185 CB LEU A 12 -6.997 -8.251 -4.893 1.00 0.00 C ATOM 186 CG LEU A 12 -8.122 -7.218 -4.801 1.00 0.00 C ATOM 187 CD1 LEU A 12 -9.422 -7.769 -5.391 1.00 0.00 C ATOM 188 CD2 LEU A 12 -8.306 -6.734 -3.361 1.00 0.00 C ATOM 0 H LEU A 12 -5.724 -7.231 -6.750 1.00 0.00 H new ATOM 0 HA LEU A 12 -5.639 -6.963 -3.927 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -7.060 -8.742 -5.864 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -7.171 -9.017 -4.137 1.00 0.00 H new ATOM 0 HG LEU A 12 -7.839 -6.351 -5.398 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -10.205 -7.015 -5.313 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -9.267 -8.024 -6.439 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -9.721 -8.661 -4.841 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -9.112 -6.001 -3.324 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -8.556 -7.581 -2.722 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -7.381 -6.275 -3.010 1.00 0.00 H new ATOM 200 N GLU A 13 -4.143 -9.589 -5.201 1.00 0.00 N ATOM 201 CA GLU A 13 -3.186 -10.641 -4.904 1.00 0.00 C ATOM 202 C GLU A 13 -1.918 -10.048 -4.287 1.00 0.00 C ATOM 203 O GLU A 13 -1.289 -10.671 -3.433 1.00 0.00 O ATOM 204 CB GLU A 13 -2.857 -11.453 -6.159 1.00 0.00 C ATOM 205 CG GLU A 13 -2.468 -12.887 -5.798 1.00 0.00 C ATOM 206 CD GLU A 13 -3.699 -13.709 -5.411 1.00 0.00 C ATOM 207 OE1 GLU A 13 -4.709 -13.594 -6.138 1.00 0.00 O ATOM 208 OE2 GLU A 13 -3.603 -14.432 -4.396 1.00 0.00 O ATOM 0 H GLU A 13 -4.441 -9.546 -6.176 1.00 0.00 H new ATOM 0 HA GLU A 13 -3.636 -11.319 -4.179 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -3.719 -11.463 -6.826 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -2.040 -10.976 -6.701 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -1.965 -13.355 -6.644 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -1.758 -12.878 -4.971 1.00 0.00 H new ATOM 215 N LEU A 14 -1.581 -8.851 -4.743 1.00 0.00 N ATOM 216 CA LEU A 14 -0.399 -8.166 -4.246 1.00 0.00 C ATOM 217 C LEU A 14 -0.532 -7.960 -2.736 1.00 0.00 C ATOM 218 O LEU A 14 0.415 -8.197 -1.988 1.00 0.00 O ATOM 219 CB LEU A 14 -0.163 -6.871 -5.026 1.00 0.00 C ATOM 220 CG LEU A 14 0.077 -7.027 -6.529 1.00 0.00 C ATOM 221 CD1 LEU A 14 0.647 -5.740 -7.129 1.00 0.00 C ATOM 222 CD2 LEU A 14 0.964 -8.238 -6.820 1.00 0.00 C ATOM 0 H LEU A 14 -2.105 -8.337 -5.451 1.00 0.00 H new ATOM 0 HA LEU A 14 0.491 -8.774 -4.408 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -1.026 -6.221 -4.882 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.697 -6.360 -4.592 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.883 -7.209 -7.012 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.808 -5.877 -8.198 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -0.056 -4.922 -6.970 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.595 -5.502 -6.646 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.119 -8.326 -7.895 1.00 0.00 H new ATOM 0 HD22 LEU A 14 1.926 -8.112 -6.324 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.480 -9.141 -6.448 1.00 0.00 H new ATOM 234 N ILE A 15 -1.715 -7.520 -2.333 1.00 0.00 N ATOM 235 CA ILE A 15 -1.983 -7.279 -0.925 1.00 0.00 C ATOM 236 C ILE A 15 -1.719 -8.561 -0.133 1.00 0.00 C ATOM 237 O ILE A 15 -1.219 -8.509 0.990 1.00 0.00 O ATOM 238 CB ILE A 15 -3.395 -6.720 -0.738 1.00 0.00 C ATOM 239 CG1 ILE A 15 -3.467 -5.254 -1.170 1.00 0.00 C ATOM 240 CG2 ILE A 15 -3.876 -6.918 0.701 1.00 0.00 C ATOM 241 CD1 ILE A 15 -3.487 -5.132 -2.694 1.00 0.00 C ATOM 0 H ILE A 15 -2.498 -7.324 -2.956 1.00 0.00 H new ATOM 0 HA ILE A 15 -1.308 -6.518 -0.533 1.00 0.00 H new ATOM 0 HB ILE A 15 -4.072 -7.279 -1.384 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.362 -4.792 -0.753 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -2.611 -4.711 -0.769 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -4.882 -6.512 0.807 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -3.887 -7.982 0.938 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -3.202 -6.401 1.384 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -3.538 -4.080 -2.974 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -2.580 -5.573 -3.106 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -4.357 -5.656 -3.090 1.00 0.00 H new ATOM 253 N LYS A 16 -2.065 -9.681 -0.750 1.00 0.00 N ATOM 254 CA LYS A 16 -1.871 -10.975 -0.116 1.00 0.00 C ATOM 255 C LYS A 16 -0.375 -11.218 0.088 1.00 0.00 C ATOM 256 O LYS A 16 0.024 -11.892 1.037 1.00 0.00 O ATOM 257 CB LYS A 16 -2.570 -12.074 -0.918 1.00 0.00 C ATOM 258 CG LYS A 16 -3.537 -12.866 -0.036 1.00 0.00 C ATOM 259 CD LYS A 16 -4.109 -14.068 -0.791 1.00 0.00 C ATOM 260 CE LYS A 16 -5.389 -13.687 -1.539 1.00 0.00 C ATOM 261 NZ LYS A 16 -5.832 -14.800 -2.408 1.00 0.00 N ATOM 0 H LYS A 16 -2.478 -9.720 -1.682 1.00 0.00 H new ATOM 0 HA LYS A 16 -2.334 -10.990 0.871 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -3.113 -11.631 -1.752 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -1.826 -12.747 -1.344 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -3.020 -13.208 0.861 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -4.350 -12.218 0.292 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -3.369 -14.444 -1.497 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -4.320 -14.876 -0.090 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -6.175 -13.440 -0.825 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -5.214 -12.795 -2.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -6.796 -14.612 -2.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -5.188 -14.884 -3.220 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -5.823 -15.688 -1.867 1.00 0.00 H new ATOM 275 N LEU A 17 0.413 -10.657 -0.818 1.00 0.00 N ATOM 276 CA LEU A 17 1.856 -10.805 -0.749 1.00 0.00 C ATOM 277 C LEU A 17 2.430 -9.737 0.183 1.00 0.00 C ATOM 278 O LEU A 17 3.531 -9.893 0.710 1.00 0.00 O ATOM 279 CB LEU A 17 2.464 -10.787 -2.153 1.00 0.00 C ATOM 280 CG LEU A 17 2.387 -12.101 -2.934 1.00 0.00 C ATOM 281 CD1 LEU A 17 1.837 -11.869 -4.343 1.00 0.00 C ATOM 282 CD2 LEU A 17 3.745 -12.805 -2.958 1.00 0.00 C ATOM 0 H LEU A 17 0.079 -10.099 -1.604 1.00 0.00 H new ATOM 0 HA LEU A 17 2.120 -11.774 -0.325 1.00 0.00 H new ATOM 0 HB2 LEU A 17 1.964 -10.012 -2.734 1.00 0.00 H new ATOM 0 HB3 LEU A 17 3.512 -10.497 -2.070 1.00 0.00 H new ATOM 0 HG LEU A 17 1.690 -12.763 -2.421 1.00 0.00 H new ATOM 0 HD11 LEU A 17 1.792 -12.818 -4.877 1.00 0.00 H new ATOM 0 HD12 LEU A 17 0.836 -11.442 -4.277 1.00 0.00 H new ATOM 0 HD13 LEU A 17 2.490 -11.181 -4.880 1.00 0.00 H new ATOM 0 HD21 LEU A 17 3.662 -13.736 -3.519 1.00 0.00 H new ATOM 0 HD22 LEU A 17 4.482 -12.158 -3.434 1.00 0.00 H new ATOM 0 HD23 LEU A 17 4.060 -13.023 -1.938 1.00 0.00 H new ATOM 294 N ARG A 18 1.659 -8.674 0.359 1.00 0.00 N ATOM 295 CA ARG A 18 2.077 -7.580 1.219 1.00 0.00 C ATOM 296 C ARG A 18 1.860 -7.946 2.689 1.00 0.00 C ATOM 297 O ARG A 18 2.124 -7.140 3.579 1.00 0.00 O ATOM 298 CB ARG A 18 1.301 -6.301 0.900 1.00 0.00 C ATOM 299 CG ARG A 18 1.630 -5.796 -0.507 1.00 0.00 C ATOM 300 CD ARG A 18 0.532 -4.867 -1.027 1.00 0.00 C ATOM 301 NE ARG A 18 1.137 -3.700 -1.709 1.00 0.00 N ATOM 302 CZ ARG A 18 0.436 -2.664 -2.189 1.00 0.00 C ATOM 303 NH1 ARG A 18 -0.898 -2.643 -2.066 1.00 0.00 N ATOM 304 NH2 ARG A 18 1.069 -1.649 -2.793 1.00 0.00 N ATOM 0 H ARG A 18 0.747 -8.547 -0.080 1.00 0.00 H new ATOM 0 HA ARG A 18 3.137 -7.404 1.038 1.00 0.00 H new ATOM 0 HB2 ARG A 18 0.231 -6.491 0.981 1.00 0.00 H new ATOM 0 HB3 ARG A 18 1.544 -5.531 1.633 1.00 0.00 H new ATOM 0 HG2 ARG A 18 2.583 -5.267 -0.494 1.00 0.00 H new ATOM 0 HG3 ARG A 18 1.745 -6.643 -1.183 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -0.116 -5.407 -1.718 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -0.094 -4.531 -0.200 1.00 0.00 H new ATOM 0 HE ARG A 18 2.151 -3.684 -1.820 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -1.380 -3.416 -1.607 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -1.431 -1.854 -2.431 1.00 0.00 H new ATOM 0 HH21 ARG A 18 2.084 -1.665 -2.887 1.00 0.00 H new ATOM 0 HH22 ARG A 18 0.535 -0.860 -3.158 1.00 0.00 H new ATOM 318 N LYS A 19 1.380 -9.164 2.897 1.00 0.00 N ATOM 319 CA LYS A 19 1.124 -9.647 4.243 1.00 0.00 C ATOM 320 C LYS A 19 2.456 -9.930 4.941 1.00 0.00 C ATOM 321 O LYS A 19 2.494 -10.141 6.152 1.00 0.00 O ATOM 322 CB LYS A 19 0.179 -10.850 4.210 1.00 0.00 C ATOM 323 CG LYS A 19 -0.269 -11.235 5.621 1.00 0.00 C ATOM 324 CD LYS A 19 -0.388 -12.753 5.764 1.00 0.00 C ATOM 325 CE LYS A 19 -1.709 -13.257 5.179 1.00 0.00 C ATOM 326 NZ LYS A 19 -2.224 -14.398 5.969 1.00 0.00 N ATOM 0 H LYS A 19 1.162 -9.830 2.156 1.00 0.00 H new ATOM 0 HA LYS A 19 0.612 -8.885 4.830 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -0.693 -10.615 3.599 1.00 0.00 H new ATOM 0 HB3 LYS A 19 0.679 -11.697 3.740 1.00 0.00 H new ATOM 0 HG2 LYS A 19 0.445 -10.853 6.350 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -1.230 -10.769 5.841 1.00 0.00 H new ATOM 0 HD2 LYS A 19 0.447 -13.236 5.256 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -0.323 -13.029 6.817 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -2.442 -12.451 5.173 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -1.562 -13.561 4.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -3.121 -14.728 5.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -1.530 -15.173 5.953 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -2.383 -14.096 6.951 1.00 0.00 H new ATOM 340 N LYS A 20 3.516 -9.925 4.146 1.00 0.00 N ATOM 341 CA LYS A 20 4.847 -10.178 4.672 1.00 0.00 C ATOM 342 C LYS A 20 5.803 -9.094 4.173 1.00 0.00 C ATOM 343 O LYS A 20 7.012 -9.181 4.384 1.00 0.00 O ATOM 344 CB LYS A 20 5.296 -11.600 4.329 1.00 0.00 C ATOM 345 CG LYS A 20 6.196 -12.170 5.428 1.00 0.00 C ATOM 346 CD LYS A 20 5.469 -13.256 6.224 1.00 0.00 C ATOM 347 CE LYS A 20 5.154 -12.778 7.642 1.00 0.00 C ATOM 348 NZ LYS A 20 3.739 -13.050 7.979 1.00 0.00 N ATOM 0 H LYS A 20 3.480 -9.750 3.142 1.00 0.00 H new ATOM 0 HA LYS A 20 4.844 -10.123 5.761 1.00 0.00 H new ATOM 0 HB2 LYS A 20 4.423 -12.240 4.200 1.00 0.00 H new ATOM 0 HB3 LYS A 20 5.832 -11.597 3.380 1.00 0.00 H new ATOM 0 HG2 LYS A 20 7.101 -12.584 4.983 1.00 0.00 H new ATOM 0 HG3 LYS A 20 6.508 -11.370 6.099 1.00 0.00 H new ATOM 0 HD2 LYS A 20 4.545 -13.528 5.714 1.00 0.00 H new ATOM 0 HD3 LYS A 20 6.085 -14.154 6.268 1.00 0.00 H new ATOM 0 HE2 LYS A 20 5.807 -13.281 8.355 1.00 0.00 H new ATOM 0 HE3 LYS A 20 5.355 -11.710 7.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 3.542 -12.719 8.945 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 3.120 -12.550 7.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 3.558 -14.072 7.920 1.00 0.00 H new ATOM 362 N LYS A 21 5.226 -8.096 3.519 1.00 0.00 N ATOM 363 CA LYS A 21 6.012 -6.996 2.987 1.00 0.00 C ATOM 364 C LYS A 21 5.442 -5.672 3.502 1.00 0.00 C ATOM 365 O LYS A 21 5.472 -5.404 4.702 1.00 0.00 O ATOM 366 CB LYS A 21 6.090 -7.080 1.462 1.00 0.00 C ATOM 367 CG LYS A 21 6.956 -8.262 1.021 1.00 0.00 C ATOM 368 CD LYS A 21 6.809 -8.520 -0.479 1.00 0.00 C ATOM 369 CE LYS A 21 6.369 -9.961 -0.747 1.00 0.00 C ATOM 370 NZ LYS A 21 7.233 -10.585 -1.774 1.00 0.00 N ATOM 0 H LYS A 21 4.223 -8.027 3.346 1.00 0.00 H new ATOM 0 HA LYS A 21 7.042 -7.059 3.339 1.00 0.00 H new ATOM 0 HB2 LYS A 21 5.087 -7.185 1.048 1.00 0.00 H new ATOM 0 HB3 LYS A 21 6.503 -6.153 1.064 1.00 0.00 H new ATOM 0 HG2 LYS A 21 8.001 -8.060 1.258 1.00 0.00 H new ATOM 0 HG3 LYS A 21 6.669 -9.155 1.577 1.00 0.00 H new ATOM 0 HD2 LYS A 21 6.079 -7.829 -0.901 1.00 0.00 H new ATOM 0 HD3 LYS A 21 7.758 -8.327 -0.980 1.00 0.00 H new ATOM 0 HE2 LYS A 21 6.416 -10.539 0.176 1.00 0.00 H new ATOM 0 HE3 LYS A 21 5.331 -9.975 -1.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 6.920 -11.562 -1.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 7.168 -10.042 -2.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 8.219 -10.589 -1.442 1.00 0.00 H new ATOM 384 N ILE A 22 4.936 -4.880 2.568 1.00 0.00 N ATOM 385 CA ILE A 22 4.360 -3.591 2.912 1.00 0.00 C ATOM 386 C ILE A 22 3.602 -3.037 1.704 1.00 0.00 C ATOM 387 O ILE A 22 3.572 -3.663 0.646 1.00 0.00 O ATOM 388 CB ILE A 22 5.440 -2.647 3.446 1.00 0.00 C ATOM 389 CG1 ILE A 22 5.138 -2.227 4.886 1.00 0.00 C ATOM 390 CG2 ILE A 22 5.618 -1.440 2.523 1.00 0.00 C ATOM 391 CD1 ILE A 22 3.810 -1.472 4.970 1.00 0.00 C ATOM 0 H ILE A 22 4.913 -5.106 1.574 1.00 0.00 H new ATOM 0 HA ILE A 22 3.637 -3.701 3.720 1.00 0.00 H new ATOM 0 HB ILE A 22 6.388 -3.185 3.459 1.00 0.00 H new ATOM 0 HG12 ILE A 22 5.100 -3.109 5.525 1.00 0.00 H new ATOM 0 HG13 ILE A 22 5.944 -1.596 5.261 1.00 0.00 H new ATOM 0 HG21 ILE A 22 6.391 -0.785 2.925 1.00 0.00 H new ATOM 0 HG22 ILE A 22 5.912 -1.781 1.530 1.00 0.00 H new ATOM 0 HG23 ILE A 22 4.678 -0.892 2.455 1.00 0.00 H new ATOM 0 HD11 ILE A 22 3.619 -1.185 6.004 1.00 0.00 H new ATOM 0 HD12 ILE A 22 3.860 -0.578 4.349 1.00 0.00 H new ATOM 0 HD13 ILE A 22 3.003 -2.114 4.617 1.00 0.00 H new ATOM 403 N GLU A 23 3.008 -1.870 1.903 1.00 0.00 N ATOM 404 CA GLU A 23 2.252 -1.225 0.843 1.00 0.00 C ATOM 405 C GLU A 23 2.420 0.294 0.920 1.00 0.00 C ATOM 406 O GLU A 23 2.301 0.882 1.994 1.00 0.00 O ATOM 407 CB GLU A 23 0.774 -1.617 0.907 1.00 0.00 C ATOM 408 CG GLU A 23 0.011 -0.722 1.886 1.00 0.00 C ATOM 409 CD GLU A 23 -1.489 -1.017 1.843 1.00 0.00 C ATOM 410 OE1 GLU A 23 -1.832 -2.168 1.497 1.00 0.00 O ATOM 411 OE2 GLU A 23 -2.260 -0.084 2.157 1.00 0.00 O ATOM 0 H GLU A 23 3.035 -1.354 2.783 1.00 0.00 H new ATOM 0 HA GLU A 23 2.643 -1.566 -0.115 1.00 0.00 H new ATOM 0 HB2 GLU A 23 0.330 -1.538 -0.085 1.00 0.00 H new ATOM 0 HB3 GLU A 23 0.683 -2.659 1.215 1.00 0.00 H new ATOM 0 HG2 GLU A 23 0.387 -0.879 2.897 1.00 0.00 H new ATOM 0 HG3 GLU A 23 0.187 0.325 1.640 1.00 0.00 H new ATOM 418 N GLY A 24 2.693 0.886 -0.234 1.00 0.00 N ATOM 419 CA GLY A 24 2.879 2.325 -0.311 1.00 0.00 C ATOM 420 C GLY A 24 1.578 3.025 -0.711 1.00 0.00 C ATOM 421 O GLY A 24 0.711 2.419 -1.338 1.00 0.00 O ATOM 0 H GLY A 24 2.790 0.395 -1.123 1.00 0.00 H new ATOM 0 HA2 GLY A 24 3.218 2.704 0.653 1.00 0.00 H new ATOM 0 HA3 GLY A 24 3.659 2.556 -1.037 1.00 0.00 H new ATOM 425 N ARG A 25 1.484 4.291 -0.331 1.00 0.00 N ATOM 426 CA ARG A 25 0.304 5.079 -0.643 1.00 0.00 C ATOM 427 C ARG A 25 0.409 6.466 -0.005 1.00 0.00 C ATOM 428 O ARG A 25 0.167 6.623 1.191 1.00 0.00 O ATOM 429 CB ARG A 25 -0.967 4.390 -0.142 1.00 0.00 C ATOM 430 CG ARG A 25 -2.200 5.257 -0.404 1.00 0.00 C ATOM 431 CD ARG A 25 -2.715 5.061 -1.831 1.00 0.00 C ATOM 432 NE ARG A 25 -4.044 5.696 -1.982 1.00 0.00 N ATOM 433 CZ ARG A 25 -4.786 5.630 -3.095 1.00 0.00 C ATOM 434 NH1 ARG A 25 -4.334 4.958 -4.163 1.00 0.00 N ATOM 435 NH2 ARG A 25 -5.980 6.237 -3.142 1.00 0.00 N ATOM 0 H ARG A 25 2.205 4.790 0.190 1.00 0.00 H new ATOM 0 HA ARG A 25 0.247 5.177 -1.727 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -1.083 3.427 -0.639 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -0.879 4.189 0.926 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -2.985 5.003 0.308 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -1.952 6.306 -0.244 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -2.013 5.495 -2.543 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -2.783 3.997 -2.059 1.00 0.00 H new ATOM 0 HE ARG A 25 -4.418 6.216 -1.188 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -3.425 4.497 -4.128 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -4.899 4.908 -5.011 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -6.324 6.749 -2.330 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -6.545 6.186 -3.990 1.00 0.00 H new ATOM 449 N LEU A 26 0.769 7.437 -0.831 1.00 0.00 N ATOM 450 CA LEU A 26 0.909 8.805 -0.363 1.00 0.00 C ATOM 451 C LEU A 26 -0.200 9.110 0.646 1.00 0.00 C ATOM 452 O LEU A 26 -1.337 8.674 0.475 1.00 0.00 O ATOM 453 CB LEU A 26 0.948 9.775 -1.546 1.00 0.00 C ATOM 454 CG LEU A 26 -0.221 10.756 -1.647 1.00 0.00 C ATOM 455 CD1 LEU A 26 -0.065 11.901 -0.643 1.00 0.00 C ATOM 456 CD2 LEU A 26 -0.384 11.269 -3.080 1.00 0.00 C ATOM 0 H LEU A 26 0.968 7.303 -1.822 1.00 0.00 H new ATOM 0 HA LEU A 26 1.858 8.935 0.157 1.00 0.00 H new ATOM 0 HB2 LEU A 26 1.874 10.348 -1.490 1.00 0.00 H new ATOM 0 HB3 LEU A 26 0.989 9.193 -2.467 1.00 0.00 H new ATOM 0 HG LEU A 26 -1.137 10.224 -1.389 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -0.909 12.584 -0.736 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -0.035 11.496 0.369 1.00 0.00 H new ATOM 0 HD13 LEU A 26 0.861 12.439 -0.846 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -1.222 11.965 -3.124 1.00 0.00 H new ATOM 0 HD22 LEU A 26 0.528 11.779 -3.390 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -0.574 10.429 -3.748 1.00 0.00 H new ATOM 468 N TYR A 27 0.170 9.857 1.676 1.00 0.00 N ATOM 469 CA TYR A 27 -0.779 10.225 2.713 1.00 0.00 C ATOM 470 C TYR A 27 -1.798 11.239 2.188 1.00 0.00 C ATOM 471 O TYR A 27 -1.612 12.446 2.337 1.00 0.00 O ATOM 472 CB TYR A 27 0.044 10.877 3.826 1.00 0.00 C ATOM 473 CG TYR A 27 -0.601 10.786 5.210 1.00 0.00 C ATOM 474 CD1 TYR A 27 -1.224 9.620 5.607 1.00 0.00 C ATOM 475 CD2 TYR A 27 -0.559 11.871 6.063 1.00 0.00 C ATOM 476 CE1 TYR A 27 -1.831 9.535 6.910 1.00 0.00 C ATOM 477 CE2 TYR A 27 -1.166 11.785 7.366 1.00 0.00 C ATOM 478 CZ TYR A 27 -1.772 10.622 7.725 1.00 0.00 C ATOM 479 OH TYR A 27 -2.345 10.542 8.956 1.00 0.00 O ATOM 0 H TYR A 27 1.114 10.217 1.815 1.00 0.00 H new ATOM 0 HA TYR A 27 -1.329 9.350 3.058 1.00 0.00 H new ATOM 0 HB2 TYR A 27 1.026 10.405 3.862 1.00 0.00 H new ATOM 0 HB3 TYR A 27 0.204 11.927 3.579 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -1.256 8.771 4.940 1.00 0.00 H new ATOM 0 HD2 TYR A 27 -0.071 12.783 5.753 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -2.322 8.629 7.233 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -1.140 12.626 8.043 1.00 0.00 H new ATOM 0 HH TYR A 27 -2.225 11.392 9.429 1.00 0.00 H new ATOM 489 N ASP A 28 -2.853 10.711 1.585 1.00 0.00 N ATOM 490 CA ASP A 28 -3.902 11.555 1.037 1.00 0.00 C ATOM 491 C ASP A 28 -4.857 11.967 2.159 1.00 0.00 C ATOM 492 O ASP A 28 -4.615 11.665 3.327 1.00 0.00 O ATOM 493 CB ASP A 28 -4.712 10.808 -0.024 1.00 0.00 C ATOM 494 CG ASP A 28 -3.895 10.258 -1.194 1.00 0.00 C ATOM 495 OD1 ASP A 28 -3.561 11.069 -2.084 1.00 0.00 O ATOM 496 OD2 ASP A 28 -3.622 9.038 -1.172 1.00 0.00 O ATOM 0 H ASP A 28 -3.004 9.710 1.464 1.00 0.00 H new ATOM 0 HA ASP A 28 -3.431 12.427 0.583 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -5.234 9.980 0.456 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -5.474 11.480 -0.417 1.00 0.00 H new ATOM 501 N GLU A 29 -5.922 12.650 1.765 1.00 0.00 N ATOM 502 CA GLU A 29 -6.914 13.106 2.723 1.00 0.00 C ATOM 503 C GLU A 29 -7.683 11.916 3.299 1.00 0.00 C ATOM 504 O GLU A 29 -7.940 11.860 4.500 1.00 0.00 O ATOM 505 CB GLU A 29 -7.868 14.118 2.084 1.00 0.00 C ATOM 506 CG GLU A 29 -7.141 15.422 1.751 1.00 0.00 C ATOM 507 CD GLU A 29 -8.118 16.476 1.226 1.00 0.00 C ATOM 508 OE1 GLU A 29 -8.343 16.479 -0.004 1.00 0.00 O ATOM 509 OE2 GLU A 29 -8.618 17.255 2.066 1.00 0.00 O ATOM 0 H GLU A 29 -6.119 12.898 0.796 1.00 0.00 H new ATOM 0 HA GLU A 29 -6.397 13.609 3.540 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -8.298 13.695 1.176 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -8.696 14.322 2.763 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -6.637 15.799 2.641 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -6.370 15.232 1.005 1.00 0.00 H new ATOM 516 N LYS A 30 -8.029 10.992 2.414 1.00 0.00 N ATOM 517 CA LYS A 30 -8.764 9.806 2.819 1.00 0.00 C ATOM 518 C LYS A 30 -7.889 8.962 3.749 1.00 0.00 C ATOM 519 O LYS A 30 -8.358 8.475 4.776 1.00 0.00 O ATOM 520 CB LYS A 30 -9.270 9.044 1.593 1.00 0.00 C ATOM 521 CG LYS A 30 -10.581 9.642 1.079 1.00 0.00 C ATOM 522 CD LYS A 30 -11.787 8.931 1.696 1.00 0.00 C ATOM 523 CE LYS A 30 -13.056 9.197 0.883 1.00 0.00 C ATOM 524 NZ LYS A 30 -14.086 9.845 1.725 1.00 0.00 N ATOM 0 H LYS A 30 -7.814 11.041 1.418 1.00 0.00 H new ATOM 0 HA LYS A 30 -9.655 10.084 3.383 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -8.518 9.076 0.805 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -9.420 7.995 1.849 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -10.619 10.705 1.319 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -10.622 9.559 -0.007 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -11.598 7.859 1.741 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -11.930 9.272 2.721 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -12.822 9.834 0.030 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -13.442 8.259 0.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -14.940 10.018 1.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -14.322 9.223 2.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -13.721 10.750 2.086 1.00 0.00 H new ATOM 538 N ARG A 31 -6.632 8.816 3.355 1.00 0.00 N ATOM 539 CA ARG A 31 -5.688 8.040 4.140 1.00 0.00 C ATOM 540 C ARG A 31 -5.599 8.594 5.564 1.00 0.00 C ATOM 541 O ARG A 31 -5.610 7.835 6.531 1.00 0.00 O ATOM 542 CB ARG A 31 -4.296 8.060 3.505 1.00 0.00 C ATOM 543 CG ARG A 31 -4.286 7.291 2.183 1.00 0.00 C ATOM 544 CD ARG A 31 -4.227 5.782 2.427 1.00 0.00 C ATOM 545 NE ARG A 31 -5.011 5.071 1.392 1.00 0.00 N ATOM 546 CZ ARG A 31 -4.871 3.769 1.106 1.00 0.00 C ATOM 547 NH1 ARG A 31 -3.978 3.028 1.775 1.00 0.00 N ATOM 548 NH2 ARG A 31 -5.625 3.208 0.151 1.00 0.00 N ATOM 0 H ARG A 31 -6.246 9.222 2.503 1.00 0.00 H new ATOM 0 HA ARG A 31 -6.048 7.011 4.168 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -3.986 9.091 3.333 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -3.573 7.620 4.191 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -5.180 7.536 1.609 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -3.429 7.600 1.585 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -3.191 5.442 2.408 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -4.620 5.550 3.417 1.00 0.00 H new ATOM 0 HE ARG A 31 -5.701 5.605 0.864 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -3.404 3.454 2.502 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -3.872 2.037 1.557 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -6.306 3.772 -0.358 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -5.518 2.217 -0.067 1.00 0.00 H new ATOM 562 N ARG A 32 -5.513 9.914 5.647 1.00 0.00 N ATOM 563 CA ARG A 32 -5.422 10.578 6.936 1.00 0.00 C ATOM 564 C ARG A 32 -6.546 10.102 7.859 1.00 0.00 C ATOM 565 O ARG A 32 -6.348 9.969 9.065 1.00 0.00 O ATOM 566 CB ARG A 32 -5.510 12.098 6.779 1.00 0.00 C ATOM 567 CG ARG A 32 -4.139 12.696 6.457 1.00 0.00 C ATOM 568 CD ARG A 32 -4.213 14.222 6.373 1.00 0.00 C ATOM 569 NE ARG A 32 -4.062 14.811 7.722 1.00 0.00 N ATOM 570 CZ ARG A 32 -5.083 15.045 8.558 1.00 0.00 C ATOM 571 NH1 ARG A 32 -6.335 14.741 8.189 1.00 0.00 N ATOM 572 NH2 ARG A 32 -4.852 15.583 9.763 1.00 0.00 N ATOM 0 H ARG A 32 -5.504 10.541 4.843 1.00 0.00 H new ATOM 0 HA ARG A 32 -4.456 10.324 7.373 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -6.214 12.345 5.984 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -5.897 12.540 7.697 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -3.422 12.405 7.224 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -3.775 12.293 5.512 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -3.430 14.597 5.714 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -5.166 14.525 5.940 1.00 0.00 H new ATOM 0 HE ARG A 32 -3.122 15.054 8.035 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -6.511 14.331 7.272 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -7.112 14.919 8.826 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -3.899 15.814 10.044 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -5.629 15.761 10.399 1.00 0.00 H new ATOM 586 N GLN A 33 -7.700 9.858 7.256 1.00 0.00 N ATOM 587 CA GLN A 33 -8.855 9.399 8.009 1.00 0.00 C ATOM 588 C GLN A 33 -8.680 7.933 8.408 1.00 0.00 C ATOM 589 O GLN A 33 -9.238 7.488 9.410 1.00 0.00 O ATOM 590 CB GLN A 33 -10.145 9.599 7.210 1.00 0.00 C ATOM 591 CG GLN A 33 -11.013 10.692 7.836 1.00 0.00 C ATOM 592 CD GLN A 33 -12.479 10.530 7.427 1.00 0.00 C ATOM 593 OE1 GLN A 33 -13.095 11.420 6.864 1.00 0.00 O ATOM 594 NE2 GLN A 33 -13.000 9.347 7.739 1.00 0.00 N ATOM 0 H GLN A 33 -7.860 9.969 6.255 1.00 0.00 H new ATOM 0 HA GLN A 33 -8.932 9.996 8.918 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -9.902 9.867 6.182 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -10.703 8.663 7.173 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -10.928 10.651 8.922 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -10.651 11.672 7.524 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -12.428 8.646 8.211 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -13.971 9.140 7.507 1.00 0.00 H new ATOM 603 N ILE A 34 -7.902 7.222 7.604 1.00 0.00 N ATOM 604 CA ILE A 34 -7.646 5.815 7.862 1.00 0.00 C ATOM 605 C ILE A 34 -6.701 5.684 9.057 1.00 0.00 C ATOM 606 O ILE A 34 -5.831 6.529 9.262 1.00 0.00 O ATOM 607 CB ILE A 34 -7.137 5.123 6.596 1.00 0.00 C ATOM 608 CG1 ILE A 34 -8.104 5.333 5.429 1.00 0.00 C ATOM 609 CG2 ILE A 34 -6.863 3.640 6.854 1.00 0.00 C ATOM 610 CD1 ILE A 34 -7.454 4.941 4.101 1.00 0.00 C ATOM 0 H ILE A 34 -7.441 7.594 6.774 1.00 0.00 H new ATOM 0 HA ILE A 34 -8.570 5.302 8.129 1.00 0.00 H new ATOM 0 HB ILE A 34 -6.189 5.581 6.314 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -9.004 4.739 5.587 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -8.414 6.377 5.392 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -6.502 3.172 5.938 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -6.108 3.540 7.634 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -7.783 3.150 7.174 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -8.163 5.100 3.288 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -6.568 5.554 3.935 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -7.168 3.890 4.132 1.00 0.00 H new ATOM 622 N LYS A 35 -6.904 4.617 9.816 1.00 0.00 N ATOM 623 CA LYS A 35 -6.081 4.364 10.987 1.00 0.00 C ATOM 624 C LYS A 35 -5.922 2.854 11.177 1.00 0.00 C ATOM 625 O LYS A 35 -6.678 2.070 10.605 1.00 0.00 O ATOM 626 CB LYS A 35 -6.654 5.081 12.211 1.00 0.00 C ATOM 627 CG LYS A 35 -7.805 4.281 12.825 1.00 0.00 C ATOM 628 CD LYS A 35 -7.938 4.575 14.321 1.00 0.00 C ATOM 629 CE LYS A 35 -9.171 3.884 14.907 1.00 0.00 C ATOM 630 NZ LYS A 35 -9.494 4.442 16.239 1.00 0.00 N ATOM 0 H LYS A 35 -7.626 3.918 9.643 1.00 0.00 H new ATOM 0 HA LYS A 35 -5.081 4.775 10.845 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -5.869 5.224 12.954 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -7.007 6.072 11.925 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -8.737 4.529 12.317 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -7.634 3.215 12.674 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -7.044 4.235 14.843 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -8.010 5.651 14.479 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -10.021 4.013 14.236 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -8.990 2.812 14.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -10.333 3.962 16.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -8.689 4.297 16.881 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -9.687 5.460 16.151 1.00 0.00 H new ATOM 644 N PRO A 36 -4.909 2.482 12.003 1.00 0.00 N ATOM 645 CA PRO A 36 -4.642 1.079 12.276 1.00 0.00 C ATOM 646 C PRO A 36 -5.683 0.499 13.235 1.00 0.00 C ATOM 647 O PRO A 36 -5.582 0.677 14.448 1.00 0.00 O ATOM 648 CB PRO A 36 -3.231 1.050 12.842 1.00 0.00 C ATOM 649 CG PRO A 36 -2.936 2.470 13.298 1.00 0.00 C ATOM 650 CD PRO A 36 -3.993 3.382 12.698 1.00 0.00 C ATOM 0 HA PRO A 36 -4.712 0.456 11.384 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -3.158 0.349 13.674 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -2.514 0.725 12.088 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -2.951 2.532 14.386 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -1.941 2.775 12.975 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -4.509 3.952 13.471 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -3.550 4.103 12.011 1.00 0.00 H new ATOM 658 N GLY A 37 -6.660 -0.183 12.655 1.00 0.00 N ATOM 659 CA GLY A 37 -7.718 -0.790 13.443 1.00 0.00 C ATOM 660 C GLY A 37 -8.936 -1.110 12.573 1.00 0.00 C ATOM 661 O GLY A 37 -9.622 -2.105 12.800 1.00 0.00 O ATOM 0 H GLY A 37 -6.741 -0.328 11.649 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -7.350 -1.704 13.910 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -8.009 -0.116 14.248 1.00 0.00 H new ATOM 665 N ASP A 38 -9.166 -0.247 11.594 1.00 0.00 N ATOM 666 CA ASP A 38 -10.288 -0.424 10.688 1.00 0.00 C ATOM 667 C ASP A 38 -9.964 -1.541 9.694 1.00 0.00 C ATOM 668 O ASP A 38 -8.942 -2.213 9.822 1.00 0.00 O ATOM 669 CB ASP A 38 -10.561 0.853 9.892 1.00 0.00 C ATOM 670 CG ASP A 38 -10.812 2.102 10.739 1.00 0.00 C ATOM 671 OD1 ASP A 38 -9.807 2.697 11.185 1.00 0.00 O ATOM 672 OD2 ASP A 38 -12.003 2.434 10.921 1.00 0.00 O ATOM 0 H ASP A 38 -8.594 0.577 11.409 1.00 0.00 H new ATOM 0 HA ASP A 38 -11.166 -0.671 11.284 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -9.712 1.042 9.235 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -11.428 0.686 9.252 1.00 0.00 H new ATOM 677 N VAL A 39 -10.854 -1.705 8.726 1.00 0.00 N ATOM 678 CA VAL A 39 -10.675 -2.728 7.711 1.00 0.00 C ATOM 679 C VAL A 39 -11.003 -2.141 6.337 1.00 0.00 C ATOM 680 O VAL A 39 -11.750 -1.168 6.236 1.00 0.00 O ATOM 681 CB VAL A 39 -11.519 -3.958 8.052 1.00 0.00 C ATOM 682 CG1 VAL A 39 -11.354 -5.048 6.992 1.00 0.00 C ATOM 683 CG2 VAL A 39 -11.175 -4.489 9.445 1.00 0.00 C ATOM 0 H VAL A 39 -11.701 -1.146 8.624 1.00 0.00 H new ATOM 0 HA VAL A 39 -9.637 -3.060 7.683 1.00 0.00 H new ATOM 0 HB VAL A 39 -12.566 -3.655 8.058 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -11.965 -5.911 7.259 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -11.672 -4.664 6.023 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -10.307 -5.347 6.938 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -11.789 -5.363 9.663 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -10.122 -4.768 9.478 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -11.369 -3.715 10.188 1.00 0.00 H new ATOM 693 N ILE A 40 -10.430 -2.756 5.313 1.00 0.00 N ATOM 694 CA ILE A 40 -10.652 -2.306 3.949 1.00 0.00 C ATOM 695 C ILE A 40 -11.156 -3.478 3.106 1.00 0.00 C ATOM 696 O ILE A 40 -10.420 -4.434 2.861 1.00 0.00 O ATOM 697 CB ILE A 40 -9.391 -1.644 3.391 1.00 0.00 C ATOM 698 CG1 ILE A 40 -8.825 -0.622 4.379 1.00 0.00 C ATOM 699 CG2 ILE A 40 -9.659 -1.025 2.017 1.00 0.00 C ATOM 700 CD1 ILE A 40 -7.299 -0.715 4.449 1.00 0.00 C ATOM 0 H ILE A 40 -9.812 -3.563 5.400 1.00 0.00 H new ATOM 0 HA ILE A 40 -11.425 -1.538 3.922 1.00 0.00 H new ATOM 0 HB ILE A 40 -8.632 -2.415 3.255 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -9.118 0.383 4.076 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -9.249 -0.793 5.368 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -8.746 -0.561 1.643 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -9.981 -1.802 1.324 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -10.440 -0.270 2.104 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -6.922 0.022 5.158 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -7.010 -1.714 4.775 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -6.877 -0.519 3.463 1.00 0.00 H new ATOM 712 N SER A 41 -12.407 -3.368 2.684 1.00 0.00 N ATOM 713 CA SER A 41 -13.018 -4.407 1.872 1.00 0.00 C ATOM 714 C SER A 41 -12.822 -4.095 0.388 1.00 0.00 C ATOM 715 O SER A 41 -13.276 -3.060 -0.098 1.00 0.00 O ATOM 716 CB SER A 41 -14.507 -4.551 2.192 1.00 0.00 C ATOM 717 OG SER A 41 -15.269 -3.454 1.695 1.00 0.00 O ATOM 0 H SER A 41 -13.015 -2.575 2.889 1.00 0.00 H new ATOM 0 HA SER A 41 -12.530 -5.354 2.105 1.00 0.00 H new ATOM 0 HB2 SER A 41 -14.883 -5.478 1.760 1.00 0.00 H new ATOM 0 HB3 SER A 41 -14.640 -4.625 3.271 1.00 0.00 H new ATOM 0 HG SER A 41 -14.862 -3.121 0.868 1.00 0.00 H new ATOM 723 N PHE A 42 -12.145 -5.009 -0.292 1.00 0.00 N ATOM 724 CA PHE A 42 -11.883 -4.845 -1.712 1.00 0.00 C ATOM 725 C PHE A 42 -12.843 -5.693 -2.548 1.00 0.00 C ATOM 726 O PHE A 42 -13.247 -6.776 -2.128 1.00 0.00 O ATOM 727 CB PHE A 42 -10.451 -5.321 -1.960 1.00 0.00 C ATOM 728 CG PHE A 42 -9.377 -4.379 -1.412 1.00 0.00 C ATOM 729 CD1 PHE A 42 -9.567 -3.033 -1.457 1.00 0.00 C ATOM 730 CD2 PHE A 42 -8.233 -4.887 -0.881 1.00 0.00 C ATOM 731 CE1 PHE A 42 -8.571 -2.158 -0.948 1.00 0.00 C ATOM 732 CE2 PHE A 42 -7.237 -4.012 -0.373 1.00 0.00 C ATOM 733 CZ PHE A 42 -7.426 -2.666 -0.417 1.00 0.00 C ATOM 0 H PHE A 42 -11.770 -5.866 0.114 1.00 0.00 H new ATOM 0 HA PHE A 42 -12.020 -3.802 -1.998 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -10.323 -6.304 -1.507 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -10.300 -5.442 -3.033 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -10.475 -2.630 -1.880 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -8.082 -5.956 -0.846 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -8.722 -1.089 -0.982 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -6.328 -4.416 0.049 1.00 0.00 H new ATOM 0 HZ PHE A 42 -6.668 -2.001 -0.031 1.00 0.00 H new ATOM 743 N GLU A 43 -13.179 -5.169 -3.718 1.00 0.00 N ATOM 744 CA GLU A 43 -14.084 -5.865 -4.617 1.00 0.00 C ATOM 745 C GLU A 43 -15.290 -6.403 -3.845 1.00 0.00 C ATOM 746 O GLU A 43 -15.832 -7.453 -4.186 1.00 0.00 O ATOM 747 CB GLU A 43 -13.361 -6.990 -5.359 1.00 0.00 C ATOM 748 CG GLU A 43 -12.203 -6.442 -6.194 1.00 0.00 C ATOM 749 CD GLU A 43 -11.834 -7.408 -7.322 1.00 0.00 C ATOM 750 OE1 GLU A 43 -12.382 -8.531 -7.308 1.00 0.00 O ATOM 751 OE2 GLU A 43 -11.013 -7.001 -8.172 1.00 0.00 O ATOM 0 H GLU A 43 -12.841 -4.271 -4.064 1.00 0.00 H new ATOM 0 HA GLU A 43 -14.443 -5.155 -5.362 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -12.984 -7.719 -4.642 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -14.064 -7.514 -6.006 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -12.479 -5.475 -6.614 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -11.336 -6.276 -5.555 1.00 0.00 H new ATOM 758 N GLY A 44 -15.676 -5.658 -2.819 1.00 0.00 N ATOM 759 CA GLY A 44 -16.808 -6.047 -1.996 1.00 0.00 C ATOM 760 C GLY A 44 -16.349 -6.848 -0.775 1.00 0.00 C ATOM 761 O GLY A 44 -16.546 -6.422 0.362 1.00 0.00 O ATOM 0 H GLY A 44 -15.225 -4.787 -2.539 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -17.348 -5.158 -1.670 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -17.503 -6.644 -2.586 1.00 0.00 H new ATOM 765 N GLY A 45 -15.746 -7.995 -1.053 1.00 0.00 N ATOM 766 CA GLY A 45 -15.257 -8.859 0.008 1.00 0.00 C ATOM 767 C GLY A 45 -14.323 -9.935 -0.548 1.00 0.00 C ATOM 768 O GLY A 45 -14.195 -11.012 0.033 1.00 0.00 O ATOM 0 H GLY A 45 -15.585 -8.346 -1.997 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -14.729 -8.263 0.753 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -16.099 -9.330 0.515 1.00 0.00 H new ATOM 772 N LYS A 46 -13.693 -9.607 -1.666 1.00 0.00 N ATOM 773 CA LYS A 46 -12.774 -10.531 -2.307 1.00 0.00 C ATOM 774 C LYS A 46 -11.452 -10.547 -1.537 1.00 0.00 C ATOM 775 O LYS A 46 -10.817 -11.592 -1.408 1.00 0.00 O ATOM 776 CB LYS A 46 -12.617 -10.190 -3.791 1.00 0.00 C ATOM 777 CG LYS A 46 -12.282 -11.438 -4.609 1.00 0.00 C ATOM 778 CD LYS A 46 -10.773 -11.563 -4.825 1.00 0.00 C ATOM 779 CE LYS A 46 -10.466 -12.294 -6.134 1.00 0.00 C ATOM 780 NZ LYS A 46 -10.819 -13.727 -6.023 1.00 0.00 N ATOM 0 H LYS A 46 -13.801 -8.713 -2.145 1.00 0.00 H new ATOM 0 HA LYS A 46 -13.173 -11.545 -2.277 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -13.538 -9.743 -4.164 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -11.829 -9.447 -3.915 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -12.654 -12.324 -4.095 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -12.788 -11.392 -5.573 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -10.321 -10.571 -4.843 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -10.326 -12.102 -3.990 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -11.025 -11.838 -6.951 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -9.408 -12.192 -6.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -10.604 -14.208 -6.920 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -10.267 -14.162 -5.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -11.834 -13.819 -5.815 1.00 0.00 H new ATOM 794 N LEU A 47 -11.078 -9.375 -1.044 1.00 0.00 N ATOM 795 CA LEU A 47 -9.844 -9.240 -0.289 1.00 0.00 C ATOM 796 C LEU A 47 -10.043 -8.213 0.827 1.00 0.00 C ATOM 797 O LEU A 47 -10.227 -7.027 0.558 1.00 0.00 O ATOM 798 CB LEU A 47 -8.677 -8.915 -1.224 1.00 0.00 C ATOM 799 CG LEU A 47 -7.339 -9.571 -0.881 1.00 0.00 C ATOM 800 CD1 LEU A 47 -6.705 -8.914 0.347 1.00 0.00 C ATOM 801 CD2 LEU A 47 -7.499 -11.082 -0.703 1.00 0.00 C ATOM 0 H LEU A 47 -11.608 -8.510 -1.153 1.00 0.00 H new ATOM 0 HA LEU A 47 -9.585 -10.184 0.190 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -8.955 -9.211 -2.236 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -8.537 -7.834 -1.235 1.00 0.00 H new ATOM 0 HG LEU A 47 -6.658 -9.415 -1.718 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -5.755 -9.399 0.569 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -6.534 -7.856 0.146 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -7.374 -9.018 1.201 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -6.533 -11.524 -0.460 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -8.203 -11.281 0.105 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -7.876 -11.519 -1.628 1.00 0.00 H new ATOM 813 N LYS A 48 -10.000 -8.706 2.056 1.00 0.00 N ATOM 814 CA LYS A 48 -10.173 -7.846 3.214 1.00 0.00 C ATOM 815 C LYS A 48 -8.829 -7.678 3.925 1.00 0.00 C ATOM 816 O LYS A 48 -8.098 -8.648 4.115 1.00 0.00 O ATOM 817 CB LYS A 48 -11.284 -8.383 4.118 1.00 0.00 C ATOM 818 CG LYS A 48 -12.511 -8.789 3.299 1.00 0.00 C ATOM 819 CD LYS A 48 -13.390 -7.575 2.990 1.00 0.00 C ATOM 820 CE LYS A 48 -14.873 -7.923 3.133 1.00 0.00 C ATOM 821 NZ LYS A 48 -15.264 -7.951 4.561 1.00 0.00 N ATOM 0 H LYS A 48 -9.848 -9.691 2.275 1.00 0.00 H new ATOM 0 HA LYS A 48 -10.497 -6.852 2.905 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -10.917 -9.242 4.680 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -11.564 -7.622 4.846 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -12.192 -9.258 2.368 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -13.090 -9.531 3.848 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -13.138 -6.757 3.665 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -13.191 -7.225 1.977 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -15.478 -7.190 2.599 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -15.071 -8.893 2.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -16.273 -8.189 4.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -14.700 -8.667 5.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -15.094 -7.017 4.986 1.00 0.00 H new ATOM 835 N VAL A 49 -8.544 -6.439 4.298 1.00 0.00 N ATOM 836 CA VAL A 49 -7.300 -6.131 4.984 1.00 0.00 C ATOM 837 C VAL A 49 -7.589 -5.194 6.158 1.00 0.00 C ATOM 838 O VAL A 49 -8.547 -4.424 6.121 1.00 0.00 O ATOM 839 CB VAL A 49 -6.286 -5.555 3.994 1.00 0.00 C ATOM 840 CG1 VAL A 49 -6.070 -6.504 2.814 1.00 0.00 C ATOM 841 CG2 VAL A 49 -6.718 -4.169 3.511 1.00 0.00 C ATOM 0 H VAL A 49 -9.153 -5.636 4.138 1.00 0.00 H new ATOM 0 HA VAL A 49 -6.855 -7.037 5.394 1.00 0.00 H new ATOM 0 HB VAL A 49 -5.334 -5.447 4.515 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -5.345 -6.070 2.126 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -5.696 -7.460 3.180 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -7.015 -6.659 2.294 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -5.980 -3.782 2.808 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -7.687 -4.242 3.016 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -6.796 -3.494 4.364 1.00 0.00 H new ATOM 851 N ARG A 50 -6.742 -5.291 7.173 1.00 0.00 N ATOM 852 CA ARG A 50 -6.894 -4.461 8.356 1.00 0.00 C ATOM 853 C ARG A 50 -5.583 -3.737 8.669 1.00 0.00 C ATOM 854 O ARG A 50 -4.552 -4.375 8.877 1.00 0.00 O ATOM 855 CB ARG A 50 -7.308 -5.300 9.567 1.00 0.00 C ATOM 856 CG ARG A 50 -7.059 -4.539 10.871 1.00 0.00 C ATOM 857 CD ARG A 50 -7.572 -5.332 12.075 1.00 0.00 C ATOM 858 NE ARG A 50 -9.037 -5.513 11.975 1.00 0.00 N ATOM 859 CZ ARG A 50 -9.784 -6.125 12.904 1.00 0.00 C ATOM 860 NH1 ARG A 50 -9.207 -6.618 14.008 1.00 0.00 N ATOM 861 NH2 ARG A 50 -11.107 -6.244 12.729 1.00 0.00 N ATOM 0 H ARG A 50 -5.949 -5.932 7.200 1.00 0.00 H new ATOM 0 HA ARG A 50 -7.676 -3.730 8.150 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -8.363 -5.561 9.490 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -6.748 -6.235 9.575 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -5.992 -4.346 10.986 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -7.556 -3.570 10.831 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -7.079 -6.303 12.118 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -7.324 -4.808 12.998 1.00 0.00 H new ATOM 0 HE ARG A 50 -9.508 -5.149 11.147 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -8.200 -6.527 14.141 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -9.775 -7.084 14.716 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -11.546 -5.869 11.888 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -11.675 -6.710 13.436 1.00 0.00 H new ATOM 875 N VAL A 51 -5.665 -2.415 8.692 1.00 0.00 N ATOM 876 CA VAL A 51 -4.498 -1.598 8.976 1.00 0.00 C ATOM 877 C VAL A 51 -3.883 -2.039 10.305 1.00 0.00 C ATOM 878 O VAL A 51 -4.601 -2.316 11.265 1.00 0.00 O ATOM 879 CB VAL A 51 -4.879 -0.116 8.956 1.00 0.00 C ATOM 880 CG1 VAL A 51 -3.666 0.766 9.261 1.00 0.00 C ATOM 881 CG2 VAL A 51 -5.515 0.269 7.619 1.00 0.00 C ATOM 0 H VAL A 51 -6.522 -1.889 8.519 1.00 0.00 H new ATOM 0 HA VAL A 51 -3.739 -1.735 8.205 1.00 0.00 H new ATOM 0 HB VAL A 51 -5.619 0.050 9.739 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -3.964 1.814 9.241 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -3.276 0.519 10.248 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -2.893 0.594 8.512 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -5.776 1.327 7.632 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -4.808 0.079 6.812 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.415 -0.325 7.460 1.00 0.00 H new ATOM 891 N LYS A 52 -2.559 -2.092 10.320 1.00 0.00 N ATOM 892 CA LYS A 52 -1.839 -2.495 11.516 1.00 0.00 C ATOM 893 C LYS A 52 -1.188 -1.265 12.153 1.00 0.00 C ATOM 894 O LYS A 52 -1.212 -1.108 13.373 1.00 0.00 O ATOM 895 CB LYS A 52 -0.850 -3.616 11.194 1.00 0.00 C ATOM 896 CG LYS A 52 -1.386 -4.972 11.659 1.00 0.00 C ATOM 897 CD LYS A 52 -0.515 -5.553 12.774 1.00 0.00 C ATOM 898 CE LYS A 52 -1.213 -5.438 14.131 1.00 0.00 C ATOM 899 NZ LYS A 52 -2.205 -6.524 14.298 1.00 0.00 N ATOM 0 H LYS A 52 -1.966 -1.862 9.522 1.00 0.00 H new ATOM 0 HA LYS A 52 -2.527 -2.910 12.253 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -0.663 -3.644 10.120 1.00 0.00 H new ATOM 0 HB3 LYS A 52 0.105 -3.413 11.678 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -2.410 -4.860 12.014 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.415 -5.664 10.817 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -0.296 -6.599 12.561 1.00 0.00 H new ATOM 0 HD3 LYS A 52 0.439 -5.027 12.806 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -0.475 -5.486 14.931 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -1.708 -4.470 14.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -2.669 -6.431 15.224 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -2.919 -6.461 13.545 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -1.724 -7.445 14.243 1.00 0.00 H new ATOM 913 N ALA A 53 -0.623 -0.425 11.299 1.00 0.00 N ATOM 914 CA ALA A 53 0.033 0.786 11.763 1.00 0.00 C ATOM 915 C ALA A 53 0.304 1.704 10.570 1.00 0.00 C ATOM 916 O ALA A 53 0.300 1.256 9.424 1.00 0.00 O ATOM 917 CB ALA A 53 1.313 0.416 12.517 1.00 0.00 C ATOM 0 H ALA A 53 -0.606 -0.559 10.288 1.00 0.00 H new ATOM 0 HA ALA A 53 -0.609 1.329 12.457 1.00 0.00 H new ATOM 0 HB1 ALA A 53 1.805 1.324 12.865 1.00 0.00 H new ATOM 0 HB2 ALA A 53 1.063 -0.212 13.372 1.00 0.00 H new ATOM 0 HB3 ALA A 53 1.983 -0.128 11.851 1.00 0.00 H new ATOM 923 N ILE A 54 0.532 2.972 10.879 1.00 0.00 N ATOM 924 CA ILE A 54 0.804 3.957 9.846 1.00 0.00 C ATOM 925 C ILE A 54 2.204 4.536 10.056 1.00 0.00 C ATOM 926 O ILE A 54 2.683 4.617 11.186 1.00 0.00 O ATOM 927 CB ILE A 54 -0.301 5.015 9.811 1.00 0.00 C ATOM 928 CG1 ILE A 54 -0.294 5.770 8.480 1.00 0.00 C ATOM 929 CG2 ILE A 54 -0.192 5.962 11.008 1.00 0.00 C ATOM 930 CD1 ILE A 54 -1.720 6.012 7.980 1.00 0.00 C ATOM 0 H ILE A 54 0.534 3.340 11.830 1.00 0.00 H new ATOM 0 HA ILE A 54 0.797 3.489 8.861 1.00 0.00 H new ATOM 0 HB ILE A 54 -1.263 4.508 9.889 1.00 0.00 H new ATOM 0 HG12 ILE A 54 0.220 6.724 8.601 1.00 0.00 H new ATOM 0 HG13 ILE A 54 0.264 5.200 7.737 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -0.989 6.704 10.959 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -0.284 5.392 11.932 1.00 0.00 H new ATOM 0 HG23 ILE A 54 0.774 6.466 10.987 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -1.687 6.550 7.033 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -2.223 5.055 7.837 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -2.268 6.603 8.714 1.00 0.00 H new ATOM 942 N ARG A 55 2.821 4.925 8.950 1.00 0.00 N ATOM 943 CA ARG A 55 4.156 5.495 8.998 1.00 0.00 C ATOM 944 C ARG A 55 4.294 6.615 7.965 1.00 0.00 C ATOM 945 O ARG A 55 3.471 6.732 7.058 1.00 0.00 O ATOM 946 CB ARG A 55 5.220 4.429 8.729 1.00 0.00 C ATOM 947 CG ARG A 55 5.373 3.492 9.928 1.00 0.00 C ATOM 948 CD ARG A 55 6.837 3.393 10.364 1.00 0.00 C ATOM 949 NE ARG A 55 7.464 2.196 9.761 1.00 0.00 N ATOM 950 CZ ARG A 55 8.733 1.823 9.978 1.00 0.00 C ATOM 951 NH1 ARG A 55 9.517 2.551 10.785 1.00 0.00 N ATOM 952 NH2 ARG A 55 9.218 0.722 9.388 1.00 0.00 N ATOM 0 H ARG A 55 2.420 4.856 8.015 1.00 0.00 H new ATOM 0 HA ARG A 55 4.307 5.899 9.999 1.00 0.00 H new ATOM 0 HB2 ARG A 55 4.947 3.853 7.845 1.00 0.00 H new ATOM 0 HB3 ARG A 55 6.175 4.909 8.514 1.00 0.00 H new ATOM 0 HG2 ARG A 55 4.767 3.855 10.758 1.00 0.00 H new ATOM 0 HG3 ARG A 55 4.999 2.501 9.670 1.00 0.00 H new ATOM 0 HD2 ARG A 55 7.377 4.289 10.059 1.00 0.00 H new ATOM 0 HD3 ARG A 55 6.899 3.338 11.451 1.00 0.00 H new ATOM 0 HE ARG A 55 6.895 1.619 9.142 1.00 0.00 H new ATOM 0 HH11 ARG A 55 9.148 3.389 11.234 1.00 0.00 H new ATOM 0 HH12 ARG A 55 10.483 2.267 10.950 1.00 0.00 H new ATOM 0 HH21 ARG A 55 8.621 0.168 8.774 1.00 0.00 H new ATOM 0 HH22 ARG A 55 10.184 0.438 9.553 1.00 0.00 H new ATOM 966 N VAL A 56 5.339 7.411 8.137 1.00 0.00 N ATOM 967 CA VAL A 56 5.595 8.517 7.231 1.00 0.00 C ATOM 968 C VAL A 56 7.083 8.549 6.879 1.00 0.00 C ATOM 969 O VAL A 56 7.933 8.327 7.740 1.00 0.00 O ATOM 970 CB VAL A 56 5.098 9.826 7.850 1.00 0.00 C ATOM 971 CG1 VAL A 56 4.716 10.835 6.765 1.00 0.00 C ATOM 972 CG2 VAL A 56 3.927 9.573 8.801 1.00 0.00 C ATOM 0 H VAL A 56 6.019 7.312 8.891 1.00 0.00 H new ATOM 0 HA VAL A 56 5.044 8.383 6.300 1.00 0.00 H new ATOM 0 HB VAL A 56 5.915 10.253 8.432 1.00 0.00 H new ATOM 0 HG11 VAL A 56 4.366 11.756 7.231 1.00 0.00 H new ATOM 0 HG12 VAL A 56 5.587 11.050 6.145 1.00 0.00 H new ATOM 0 HG13 VAL A 56 3.923 10.419 6.144 1.00 0.00 H new ATOM 0 HG21 VAL A 56 3.593 10.519 9.227 1.00 0.00 H new ATOM 0 HG22 VAL A 56 3.106 9.112 8.252 1.00 0.00 H new ATOM 0 HG23 VAL A 56 4.247 8.907 9.603 1.00 0.00 H new ATOM 982 N TYR A 57 7.353 8.828 5.612 1.00 0.00 N ATOM 983 CA TYR A 57 8.724 8.892 5.136 1.00 0.00 C ATOM 984 C TYR A 57 8.959 10.157 4.307 1.00 0.00 C ATOM 985 O TYR A 57 8.039 10.948 4.102 1.00 0.00 O ATOM 986 CB TYR A 57 8.917 7.667 4.239 1.00 0.00 C ATOM 987 CG TYR A 57 9.110 6.358 5.008 1.00 0.00 C ATOM 988 CD1 TYR A 57 8.014 5.669 5.484 1.00 0.00 C ATOM 989 CD2 TYR A 57 10.382 5.866 5.224 1.00 0.00 C ATOM 990 CE1 TYR A 57 8.195 4.437 6.207 1.00 0.00 C ATOM 991 CE2 TYR A 57 10.563 4.635 5.948 1.00 0.00 C ATOM 992 CZ TYR A 57 9.461 3.981 6.403 1.00 0.00 C ATOM 993 OH TYR A 57 9.633 2.817 7.086 1.00 0.00 O ATOM 0 H TYR A 57 6.645 9.012 4.901 1.00 0.00 H new ATOM 0 HA TYR A 57 9.420 8.911 5.975 1.00 0.00 H new ATOM 0 HB2 TYR A 57 8.051 7.568 3.585 1.00 0.00 H new ATOM 0 HB3 TYR A 57 9.783 7.831 3.598 1.00 0.00 H new ATOM 0 HD1 TYR A 57 7.019 6.054 5.314 1.00 0.00 H new ATOM 0 HD2 TYR A 57 11.240 6.404 4.850 1.00 0.00 H new ATOM 0 HE1 TYR A 57 7.345 3.888 6.585 1.00 0.00 H new ATOM 0 HE2 TYR A 57 11.552 4.240 6.126 1.00 0.00 H new ATOM 0 HH TYR A 57 8.789 2.319 7.101 1.00 0.00 H new ATOM 1003 N ASN A 58 10.194 10.309 3.854 1.00 0.00 N ATOM 1004 CA ASN A 58 10.561 11.464 3.053 1.00 0.00 C ATOM 1005 C ASN A 58 10.021 11.287 1.632 1.00 0.00 C ATOM 1006 O ASN A 58 9.444 12.212 1.063 1.00 0.00 O ATOM 1007 CB ASN A 58 12.081 11.614 2.965 1.00 0.00 C ATOM 1008 CG ASN A 58 12.576 12.732 3.885 1.00 0.00 C ATOM 1009 OD1 ASN A 58 12.900 13.827 3.454 1.00 0.00 O ATOM 1010 ND2 ASN A 58 12.616 12.397 5.171 1.00 0.00 N ATOM 0 H ASN A 58 10.954 9.651 4.026 1.00 0.00 H new ATOM 0 HA ASN A 58 10.138 12.350 3.527 1.00 0.00 H new ATOM 0 HB2 ASN A 58 12.559 10.674 3.240 1.00 0.00 H new ATOM 0 HB3 ASN A 58 12.370 11.830 1.936 1.00 0.00 H new ATOM 0 HD21 ASN A 58 12.932 13.074 5.865 1.00 0.00 H new ATOM 0 HD22 ASN A 58 12.330 11.463 5.464 1.00 0.00 H new ATOM 1017 N SER A 59 10.226 10.090 1.101 1.00 0.00 N ATOM 1018 CA SER A 59 9.767 9.780 -0.242 1.00 0.00 C ATOM 1019 C SER A 59 9.643 8.265 -0.416 1.00 0.00 C ATOM 1020 O SER A 59 9.945 7.504 0.504 1.00 0.00 O ATOM 1021 CB SER A 59 10.713 10.359 -1.296 1.00 0.00 C ATOM 1022 OG SER A 59 10.017 10.771 -2.469 1.00 0.00 O ATOM 0 H SER A 59 10.703 9.324 1.576 1.00 0.00 H new ATOM 0 HA SER A 59 8.788 10.237 -0.382 1.00 0.00 H new ATOM 0 HB2 SER A 59 11.248 11.210 -0.874 1.00 0.00 H new ATOM 0 HB3 SER A 59 11.461 9.612 -1.562 1.00 0.00 H new ATOM 0 HG SER A 59 10.655 11.136 -3.117 1.00 0.00 H new ATOM 1028 N PHE A 60 9.200 7.871 -1.600 1.00 0.00 N ATOM 1029 CA PHE A 60 9.033 6.460 -1.906 1.00 0.00 C ATOM 1030 C PHE A 60 10.369 5.718 -1.817 1.00 0.00 C ATOM 1031 O PHE A 60 10.419 4.576 -1.363 1.00 0.00 O ATOM 1032 CB PHE A 60 8.509 6.372 -3.341 1.00 0.00 C ATOM 1033 CG PHE A 60 7.212 7.148 -3.578 1.00 0.00 C ATOM 1034 CD1 PHE A 60 6.015 6.584 -3.266 1.00 0.00 C ATOM 1035 CD2 PHE A 60 7.257 8.403 -4.101 1.00 0.00 C ATOM 1036 CE1 PHE A 60 4.811 7.304 -3.486 1.00 0.00 C ATOM 1037 CE2 PHE A 60 6.053 9.123 -4.321 1.00 0.00 C ATOM 1038 CZ PHE A 60 4.856 8.559 -4.009 1.00 0.00 C ATOM 0 H PHE A 60 8.951 8.504 -2.360 1.00 0.00 H new ATOM 0 HA PHE A 60 8.346 6.004 -1.193 1.00 0.00 H new ATOM 0 HB2 PHE A 60 9.274 6.748 -4.020 1.00 0.00 H new ATOM 0 HB3 PHE A 60 8.345 5.324 -3.594 1.00 0.00 H new ATOM 0 HD1 PHE A 60 5.980 5.588 -2.851 1.00 0.00 H new ATOM 0 HD2 PHE A 60 8.208 8.851 -4.349 1.00 0.00 H new ATOM 0 HE1 PHE A 60 3.860 6.856 -3.238 1.00 0.00 H new ATOM 0 HE2 PHE A 60 6.088 10.119 -4.736 1.00 0.00 H new ATOM 0 HZ PHE A 60 3.941 9.107 -4.176 1.00 0.00 H new ATOM 1048 N ARG A 61 11.417 6.398 -2.258 1.00 0.00 N ATOM 1049 CA ARG A 61 12.749 5.817 -2.234 1.00 0.00 C ATOM 1050 C ARG A 61 13.106 5.367 -0.816 1.00 0.00 C ATOM 1051 O ARG A 61 13.421 4.199 -0.592 1.00 0.00 O ATOM 1052 CB ARG A 61 13.796 6.821 -2.722 1.00 0.00 C ATOM 1053 CG ARG A 61 14.765 6.166 -3.708 1.00 0.00 C ATOM 1054 CD ARG A 61 16.052 5.730 -3.004 1.00 0.00 C ATOM 1055 NE ARG A 61 16.790 6.917 -2.518 1.00 0.00 N ATOM 1056 CZ ARG A 61 18.032 6.876 -2.016 1.00 0.00 C ATOM 1057 NH1 ARG A 61 18.682 5.707 -1.931 1.00 0.00 N ATOM 1058 NH2 ARG A 61 18.623 8.004 -1.599 1.00 0.00 N ATOM 0 H ARG A 61 11.371 7.345 -2.634 1.00 0.00 H new ATOM 0 HA ARG A 61 12.748 4.956 -2.903 1.00 0.00 H new ATOM 0 HB2 ARG A 61 13.300 7.666 -3.200 1.00 0.00 H new ATOM 0 HB3 ARG A 61 14.350 7.217 -1.871 1.00 0.00 H new ATOM 0 HG2 ARG A 61 14.289 5.302 -4.171 1.00 0.00 H new ATOM 0 HG3 ARG A 61 15.003 6.866 -4.509 1.00 0.00 H new ATOM 0 HD2 ARG A 61 15.814 5.072 -2.168 1.00 0.00 H new ATOM 0 HD3 ARG A 61 16.677 5.159 -3.691 1.00 0.00 H new ATOM 0 HE ARG A 61 16.324 7.823 -2.568 1.00 0.00 H new ATOM 0 HH11 ARG A 61 18.231 4.849 -2.248 1.00 0.00 H new ATOM 0 HH12 ARG A 61 19.627 5.676 -1.549 1.00 0.00 H new ATOM 0 HH21 ARG A 61 18.128 8.893 -1.664 1.00 0.00 H new ATOM 0 HH22 ARG A 61 19.568 7.973 -1.217 1.00 0.00 H new ATOM 1072 N GLU A 62 13.046 6.318 0.105 1.00 0.00 N ATOM 1073 CA GLU A 62 13.359 6.034 1.495 1.00 0.00 C ATOM 1074 C GLU A 62 12.514 4.863 2.002 1.00 0.00 C ATOM 1075 O GLU A 62 12.960 4.092 2.850 1.00 0.00 O ATOM 1076 CB GLU A 62 13.156 7.274 2.368 1.00 0.00 C ATOM 1077 CG GLU A 62 14.469 8.038 2.549 1.00 0.00 C ATOM 1078 CD GLU A 62 14.454 8.856 3.842 1.00 0.00 C ATOM 1079 OE1 GLU A 62 13.768 8.410 4.787 1.00 0.00 O ATOM 1080 OE2 GLU A 62 15.129 9.908 3.856 1.00 0.00 O ATOM 0 H GLU A 62 12.785 7.286 -0.084 1.00 0.00 H new ATOM 0 HA GLU A 62 14.410 5.753 1.559 1.00 0.00 H new ATOM 0 HB2 GLU A 62 12.411 7.926 1.912 1.00 0.00 H new ATOM 0 HB3 GLU A 62 12.766 6.978 3.342 1.00 0.00 H new ATOM 0 HG2 GLU A 62 15.303 7.336 2.568 1.00 0.00 H new ATOM 0 HG3 GLU A 62 14.629 8.700 1.698 1.00 0.00 H new ATOM 1087 N MET A 63 11.308 4.767 1.460 1.00 0.00 N ATOM 1088 CA MET A 63 10.397 3.704 1.846 1.00 0.00 C ATOM 1089 C MET A 63 10.815 2.370 1.223 1.00 0.00 C ATOM 1090 O MET A 63 10.795 1.336 1.889 1.00 0.00 O ATOM 1091 CB MET A 63 8.979 4.057 1.392 1.00 0.00 C ATOM 1092 CG MET A 63 8.178 4.685 2.535 1.00 0.00 C ATOM 1093 SD MET A 63 6.474 4.890 2.046 1.00 0.00 S ATOM 1094 CE MET A 63 6.129 3.251 1.430 1.00 0.00 C ATOM 0 H MET A 63 10.941 5.408 0.757 1.00 0.00 H new ATOM 0 HA MET A 63 10.426 3.602 2.931 1.00 0.00 H new ATOM 0 HB2 MET A 63 9.024 4.749 0.551 1.00 0.00 H new ATOM 0 HB3 MET A 63 8.472 3.159 1.038 1.00 0.00 H new ATOM 0 HG2 MET A 63 8.237 4.053 3.421 1.00 0.00 H new ATOM 0 HG3 MET A 63 8.607 5.651 2.803 1.00 0.00 H new ATOM 0 HE1 MET A 63 5.074 3.020 1.580 1.00 0.00 H new ATOM 0 HE2 MET A 63 6.363 3.205 0.366 1.00 0.00 H new ATOM 0 HE3 MET A 63 6.739 2.525 1.967 1.00 0.00 H new ATOM 1104 N LEU A 64 11.183 2.437 -0.048 1.00 0.00 N ATOM 1105 CA LEU A 64 11.605 1.248 -0.769 1.00 0.00 C ATOM 1106 C LEU A 64 12.996 0.831 -0.286 1.00 0.00 C ATOM 1107 O LEU A 64 13.314 -0.356 -0.251 1.00 0.00 O ATOM 1108 CB LEU A 64 11.521 1.478 -2.279 1.00 0.00 C ATOM 1109 CG LEU A 64 10.162 1.932 -2.814 1.00 0.00 C ATOM 1110 CD1 LEU A 64 10.312 2.646 -4.159 1.00 0.00 C ATOM 1111 CD2 LEU A 64 9.184 0.758 -2.894 1.00 0.00 C ATOM 0 H LEU A 64 11.198 3.296 -0.597 1.00 0.00 H new ATOM 0 HA LEU A 64 10.932 0.417 -0.560 1.00 0.00 H new ATOM 0 HB2 LEU A 64 12.266 2.225 -2.555 1.00 0.00 H new ATOM 0 HB3 LEU A 64 11.797 0.552 -2.783 1.00 0.00 H new ATOM 0 HG LEU A 64 9.743 2.653 -2.112 1.00 0.00 H new ATOM 0 HD11 LEU A 64 9.331 2.958 -4.517 1.00 0.00 H new ATOM 0 HD12 LEU A 64 10.949 3.522 -4.037 1.00 0.00 H new ATOM 0 HD13 LEU A 64 10.763 1.967 -4.883 1.00 0.00 H new ATOM 0 HD21 LEU A 64 8.226 1.108 -3.277 1.00 0.00 H new ATOM 0 HD22 LEU A 64 9.585 -0.005 -3.561 1.00 0.00 H new ATOM 0 HD23 LEU A 64 9.044 0.333 -1.900 1.00 0.00 H new ATOM 1123 N GLU A 65 13.787 1.831 0.073 1.00 0.00 N ATOM 1124 CA GLU A 65 15.136 1.584 0.551 1.00 0.00 C ATOM 1125 C GLU A 65 15.102 1.070 1.992 1.00 0.00 C ATOM 1126 O GLU A 65 15.792 0.108 2.328 1.00 0.00 O ATOM 1127 CB GLU A 65 15.998 2.843 0.439 1.00 0.00 C ATOM 1128 CG GLU A 65 17.272 2.566 -0.361 1.00 0.00 C ATOM 1129 CD GLU A 65 18.508 2.626 0.539 1.00 0.00 C ATOM 1130 OE1 GLU A 65 18.597 1.763 1.439 1.00 0.00 O ATOM 1131 OE2 GLU A 65 19.335 3.534 0.308 1.00 0.00 O ATOM 0 H GLU A 65 13.519 2.815 0.042 1.00 0.00 H new ATOM 0 HA GLU A 65 15.588 0.817 -0.078 1.00 0.00 H new ATOM 0 HB2 GLU A 65 15.427 3.637 -0.043 1.00 0.00 H new ATOM 0 HB3 GLU A 65 16.260 3.198 1.436 1.00 0.00 H new ATOM 0 HG2 GLU A 65 17.206 1.584 -0.829 1.00 0.00 H new ATOM 0 HG3 GLU A 65 17.367 3.296 -1.165 1.00 0.00 H new ATOM 1138 N LYS A 66 14.293 1.734 2.805 1.00 0.00 N ATOM 1139 CA LYS A 66 14.161 1.356 4.201 1.00 0.00 C ATOM 1140 C LYS A 66 13.204 0.168 4.315 1.00 0.00 C ATOM 1141 O LYS A 66 13.608 -0.923 4.716 1.00 0.00 O ATOM 1142 CB LYS A 66 13.746 2.563 5.046 1.00 0.00 C ATOM 1143 CG LYS A 66 14.293 2.450 6.470 1.00 0.00 C ATOM 1144 CD LYS A 66 15.535 3.325 6.651 1.00 0.00 C ATOM 1145 CE LYS A 66 15.153 4.802 6.765 1.00 0.00 C ATOM 1146 NZ LYS A 66 16.365 5.641 6.902 1.00 0.00 N ATOM 0 H LYS A 66 13.723 2.531 2.523 1.00 0.00 H new ATOM 0 HA LYS A 66 15.122 1.031 4.600 1.00 0.00 H new ATOM 0 HB2 LYS A 66 14.113 3.479 4.583 1.00 0.00 H new ATOM 0 HB3 LYS A 66 12.659 2.634 5.075 1.00 0.00 H new ATOM 0 HG2 LYS A 66 13.525 2.750 7.183 1.00 0.00 H new ATOM 0 HG3 LYS A 66 14.541 1.411 6.687 1.00 0.00 H new ATOM 0 HD2 LYS A 66 16.075 3.015 7.546 1.00 0.00 H new ATOM 0 HD3 LYS A 66 16.210 3.184 5.807 1.00 0.00 H new ATOM 0 HE2 LYS A 66 14.590 5.107 5.883 1.00 0.00 H new ATOM 0 HE3 LYS A 66 14.502 4.950 7.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 16.088 6.641 6.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 16.887 5.360 7.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 16.972 5.513 6.068 1.00 0.00 H new ATOM 1160 N GLU A 67 11.954 0.419 3.956 1.00 0.00 N ATOM 1161 CA GLU A 67 10.936 -0.617 4.012 1.00 0.00 C ATOM 1162 C GLU A 67 11.311 -1.780 3.091 1.00 0.00 C ATOM 1163 O GLU A 67 11.315 -2.935 3.513 1.00 0.00 O ATOM 1164 CB GLU A 67 9.560 -0.054 3.653 1.00 0.00 C ATOM 1165 CG GLU A 67 8.485 -0.587 4.602 1.00 0.00 C ATOM 1166 CD GLU A 67 8.774 -0.172 6.046 1.00 0.00 C ATOM 1167 OE1 GLU A 67 9.495 -0.937 6.723 1.00 0.00 O ATOM 1168 OE2 GLU A 67 8.268 0.900 6.441 1.00 0.00 O ATOM 0 H GLU A 67 11.622 1.325 3.625 1.00 0.00 H new ATOM 0 HA GLU A 67 10.883 -0.992 5.034 1.00 0.00 H new ATOM 0 HB2 GLU A 67 9.585 1.035 3.701 1.00 0.00 H new ATOM 0 HB3 GLU A 67 9.310 -0.323 2.627 1.00 0.00 H new ATOM 0 HG2 GLU A 67 7.508 -0.209 4.300 1.00 0.00 H new ATOM 0 HG3 GLU A 67 8.441 -1.674 4.534 1.00 0.00 H new ATOM 1175 N GLY A 68 11.616 -1.434 1.849 1.00 0.00 N ATOM 1176 CA GLY A 68 11.991 -2.434 0.864 1.00 0.00 C ATOM 1177 C GLY A 68 11.180 -2.267 -0.423 1.00 0.00 C ATOM 1178 O GLY A 68 9.951 -2.240 -0.388 1.00 0.00 O ATOM 0 H GLY A 68 11.611 -0.475 1.502 1.00 0.00 H new ATOM 0 HA2 GLY A 68 13.055 -2.349 0.641 1.00 0.00 H new ATOM 0 HA3 GLY A 68 11.829 -3.431 1.273 1.00 0.00 H new ATOM 1182 N LEU A 69 11.902 -2.159 -1.529 1.00 0.00 N ATOM 1183 CA LEU A 69 11.265 -1.996 -2.825 1.00 0.00 C ATOM 1184 C LEU A 69 10.306 -3.162 -3.068 1.00 0.00 C ATOM 1185 O LEU A 69 9.105 -2.958 -3.241 1.00 0.00 O ATOM 1186 CB LEU A 69 12.319 -1.827 -3.922 1.00 0.00 C ATOM 1187 CG LEU A 69 11.829 -2.023 -5.358 1.00 0.00 C ATOM 1188 CD1 LEU A 69 10.895 -0.886 -5.778 1.00 0.00 C ATOM 1189 CD2 LEU A 69 13.006 -2.183 -6.322 1.00 0.00 C ATOM 0 H LEU A 69 12.921 -2.181 -1.554 1.00 0.00 H new ATOM 0 HA LEU A 69 10.669 -1.084 -2.844 1.00 0.00 H new ATOM 0 HB2 LEU A 69 12.745 -0.827 -3.838 1.00 0.00 H new ATOM 0 HB3 LEU A 69 13.126 -2.535 -3.735 1.00 0.00 H new ATOM 0 HG LEU A 69 11.252 -2.947 -5.399 1.00 0.00 H new ATOM 0 HD11 LEU A 69 10.561 -1.049 -6.803 1.00 0.00 H new ATOM 0 HD12 LEU A 69 10.031 -0.861 -5.114 1.00 0.00 H new ATOM 0 HD13 LEU A 69 11.427 0.063 -5.717 1.00 0.00 H new ATOM 0 HD21 LEU A 69 12.630 -2.321 -7.336 1.00 0.00 H new ATOM 0 HD22 LEU A 69 13.631 -1.290 -6.285 1.00 0.00 H new ATOM 0 HD23 LEU A 69 13.597 -3.052 -6.033 1.00 0.00 H new ATOM 1201 N GLU A 70 10.872 -4.361 -3.074 1.00 0.00 N ATOM 1202 CA GLU A 70 10.081 -5.560 -3.293 1.00 0.00 C ATOM 1203 C GLU A 70 9.140 -5.799 -2.111 1.00 0.00 C ATOM 1204 O GLU A 70 8.183 -6.565 -2.220 1.00 0.00 O ATOM 1205 CB GLU A 70 10.982 -6.774 -3.531 1.00 0.00 C ATOM 1206 CG GLU A 70 11.087 -7.095 -5.023 1.00 0.00 C ATOM 1207 CD GLU A 70 12.018 -8.285 -5.263 1.00 0.00 C ATOM 1208 OE1 GLU A 70 13.244 -8.044 -5.317 1.00 0.00 O ATOM 1209 OE2 GLU A 70 11.484 -9.408 -5.388 1.00 0.00 O ATOM 0 H GLU A 70 11.868 -4.527 -2.931 1.00 0.00 H new ATOM 0 HA GLU A 70 9.477 -5.415 -4.189 1.00 0.00 H new ATOM 0 HB2 GLU A 70 11.975 -6.579 -3.127 1.00 0.00 H new ATOM 0 HB3 GLU A 70 10.584 -7.637 -2.997 1.00 0.00 H new ATOM 0 HG2 GLU A 70 10.097 -7.317 -5.422 1.00 0.00 H new ATOM 0 HG3 GLU A 70 11.459 -6.223 -5.561 1.00 0.00 H new ATOM 1216 N ASN A 71 9.443 -5.129 -1.009 1.00 0.00 N ATOM 1217 CA ASN A 71 8.636 -5.258 0.192 1.00 0.00 C ATOM 1218 C ASN A 71 7.517 -4.215 0.164 1.00 0.00 C ATOM 1219 O ASN A 71 6.838 -4.001 1.167 1.00 0.00 O ATOM 1220 CB ASN A 71 9.475 -5.018 1.448 1.00 0.00 C ATOM 1221 CG ASN A 71 10.663 -5.980 1.507 1.00 0.00 C ATOM 1222 OD1 ASN A 71 11.033 -6.610 0.530 1.00 0.00 O ATOM 1223 ND2 ASN A 71 11.237 -6.059 2.704 1.00 0.00 N ATOM 0 H ASN A 71 10.237 -4.495 -0.923 1.00 0.00 H new ATOM 0 HA ASN A 71 8.230 -6.269 0.218 1.00 0.00 H new ATOM 0 HB2 ASN A 71 9.835 -3.989 1.458 1.00 0.00 H new ATOM 0 HB3 ASN A 71 8.854 -5.147 2.334 1.00 0.00 H new ATOM 0 HD21 ASN A 71 12.038 -6.675 2.846 1.00 0.00 H new ATOM 0 HD22 ASN A 71 10.877 -5.504 3.480 1.00 0.00 H new ATOM 1230 N VAL A 72 7.359 -3.594 -0.996 1.00 0.00 N ATOM 1231 CA VAL A 72 6.334 -2.579 -1.167 1.00 0.00 C ATOM 1232 C VAL A 72 5.644 -2.780 -2.518 1.00 0.00 C ATOM 1233 O VAL A 72 4.431 -2.978 -2.576 1.00 0.00 O ATOM 1234 CB VAL A 72 6.946 -1.185 -1.011 1.00 0.00 C ATOM 1235 CG1 VAL A 72 5.915 -0.096 -1.314 1.00 0.00 C ATOM 1236 CG2 VAL A 72 7.543 -1.002 0.386 1.00 0.00 C ATOM 0 H VAL A 72 7.924 -3.774 -1.826 1.00 0.00 H new ATOM 0 HA VAL A 72 5.571 -2.673 -0.394 1.00 0.00 H new ATOM 0 HB VAL A 72 7.755 -1.091 -1.736 1.00 0.00 H new ATOM 0 HG11 VAL A 72 6.376 0.885 -1.196 1.00 0.00 H new ATOM 0 HG12 VAL A 72 5.558 -0.208 -2.338 1.00 0.00 H new ATOM 0 HG13 VAL A 72 5.076 -0.188 -0.625 1.00 0.00 H new ATOM 0 HG21 VAL A 72 7.971 -0.003 0.471 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.761 -1.126 1.135 1.00 0.00 H new ATOM 0 HG23 VAL A 72 8.323 -1.746 0.549 1.00 0.00 H new ATOM 1246 N LEU A 73 6.446 -2.723 -3.571 1.00 0.00 N ATOM 1247 CA LEU A 73 5.928 -2.896 -4.917 1.00 0.00 C ATOM 1248 C LEU A 73 6.437 -4.221 -5.488 1.00 0.00 C ATOM 1249 O LEU A 73 7.563 -4.299 -5.977 1.00 0.00 O ATOM 1250 CB LEU A 73 6.268 -1.682 -5.783 1.00 0.00 C ATOM 1251 CG LEU A 73 5.320 -1.404 -6.951 1.00 0.00 C ATOM 1252 CD1 LEU A 73 4.356 -0.265 -6.616 1.00 0.00 C ATOM 1253 CD2 LEU A 73 6.101 -1.133 -8.239 1.00 0.00 C ATOM 0 H LEU A 73 7.451 -2.559 -3.519 1.00 0.00 H new ATOM 0 HA LEU A 73 4.840 -2.952 -4.902 1.00 0.00 H new ATOM 0 HB2 LEU A 73 6.293 -0.800 -5.143 1.00 0.00 H new ATOM 0 HB3 LEU A 73 7.274 -1.815 -6.181 1.00 0.00 H new ATOM 0 HG LEU A 73 4.718 -2.296 -7.121 1.00 0.00 H new ATOM 0 HD11 LEU A 73 3.693 -0.088 -7.463 1.00 0.00 H new ATOM 0 HD12 LEU A 73 3.763 -0.535 -5.742 1.00 0.00 H new ATOM 0 HD13 LEU A 73 4.923 0.641 -6.404 1.00 0.00 H new ATOM 0 HD21 LEU A 73 5.403 -0.938 -9.053 1.00 0.00 H new ATOM 0 HD22 LEU A 73 6.745 -0.265 -8.098 1.00 0.00 H new ATOM 0 HD23 LEU A 73 6.711 -2.002 -8.484 1.00 0.00 H new ATOM 1265 N PRO A 74 5.560 -5.257 -5.406 1.00 0.00 N ATOM 1266 CA PRO A 74 5.910 -6.575 -5.908 1.00 0.00 C ATOM 1267 C PRO A 74 5.860 -6.610 -7.437 1.00 0.00 C ATOM 1268 O PRO A 74 4.794 -6.454 -8.031 1.00 0.00 O ATOM 1269 CB PRO A 74 4.912 -7.521 -5.260 1.00 0.00 C ATOM 1270 CG PRO A 74 3.758 -6.650 -4.789 1.00 0.00 C ATOM 1271 CD PRO A 74 4.218 -5.202 -4.834 1.00 0.00 C ATOM 0 HA PRO A 74 6.931 -6.863 -5.658 1.00 0.00 H new ATOM 0 HB2 PRO A 74 4.569 -8.273 -5.970 1.00 0.00 H new ATOM 0 HB3 PRO A 74 5.365 -8.054 -4.424 1.00 0.00 H new ATOM 0 HG2 PRO A 74 2.886 -6.794 -5.427 1.00 0.00 H new ATOM 0 HG3 PRO A 74 3.461 -6.925 -3.777 1.00 0.00 H new ATOM 0 HD2 PRO A 74 3.552 -4.594 -5.445 1.00 0.00 H new ATOM 0 HD3 PRO A 74 4.230 -4.759 -3.838 1.00 0.00 H new ATOM 1279 N GLY A 75 7.027 -6.815 -8.031 1.00 0.00 N ATOM 1280 CA GLY A 75 7.130 -6.872 -9.479 1.00 0.00 C ATOM 1281 C GLY A 75 8.001 -5.732 -10.012 1.00 0.00 C ATOM 1282 O GLY A 75 8.582 -5.842 -11.090 1.00 0.00 O ATOM 0 H GLY A 75 7.909 -6.944 -7.535 1.00 0.00 H new ATOM 0 HA2 GLY A 75 7.555 -7.830 -9.780 1.00 0.00 H new ATOM 0 HA3 GLY A 75 6.135 -6.812 -9.921 1.00 0.00 H new ATOM 1286 N VAL A 76 8.063 -4.663 -9.232 1.00 0.00 N ATOM 1287 CA VAL A 76 8.853 -3.504 -9.612 1.00 0.00 C ATOM 1288 C VAL A 76 10.152 -3.972 -10.270 1.00 0.00 C ATOM 1289 O VAL A 76 10.697 -5.013 -9.906 1.00 0.00 O ATOM 1290 CB VAL A 76 9.088 -2.609 -8.393 1.00 0.00 C ATOM 1291 CG1 VAL A 76 9.939 -3.325 -7.343 1.00 0.00 C ATOM 1292 CG2 VAL A 76 9.726 -1.281 -8.804 1.00 0.00 C ATOM 0 H VAL A 76 7.579 -4.575 -8.338 1.00 0.00 H new ATOM 0 HA VAL A 76 8.318 -2.899 -10.344 1.00 0.00 H new ATOM 0 HB VAL A 76 8.119 -2.391 -7.945 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.091 -2.667 -6.487 1.00 0.00 H new ATOM 0 HG12 VAL A 76 9.429 -4.231 -7.017 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.905 -3.588 -7.775 1.00 0.00 H new ATOM 0 HG21 VAL A 76 9.882 -0.663 -7.920 1.00 0.00 H new ATOM 0 HG22 VAL A 76 10.684 -1.472 -9.287 1.00 0.00 H new ATOM 0 HG23 VAL A 76 9.067 -0.760 -9.498 1.00 0.00 H new ATOM 1302 N LYS A 77 10.612 -3.179 -11.227 1.00 0.00 N ATOM 1303 CA LYS A 77 11.838 -3.499 -11.939 1.00 0.00 C ATOM 1304 C LYS A 77 13.035 -2.972 -11.146 1.00 0.00 C ATOM 1305 O LYS A 77 14.073 -3.628 -11.072 1.00 0.00 O ATOM 1306 CB LYS A 77 11.774 -2.978 -13.376 1.00 0.00 C ATOM 1307 CG LYS A 77 11.017 -3.953 -14.280 1.00 0.00 C ATOM 1308 CD LYS A 77 11.622 -3.980 -15.685 1.00 0.00 C ATOM 1309 CE LYS A 77 11.845 -5.418 -16.158 1.00 0.00 C ATOM 1310 NZ LYS A 77 13.292 -5.697 -16.302 1.00 0.00 N ATOM 0 H LYS A 77 10.158 -2.316 -11.526 1.00 0.00 H new ATOM 0 HA LYS A 77 11.961 -4.579 -12.021 1.00 0.00 H new ATOM 0 HB2 LYS A 77 11.283 -2.005 -13.392 1.00 0.00 H new ATOM 0 HB3 LYS A 77 12.784 -2.831 -13.759 1.00 0.00 H new ATOM 0 HG2 LYS A 77 11.047 -4.953 -13.848 1.00 0.00 H new ATOM 0 HG3 LYS A 77 9.968 -3.662 -14.337 1.00 0.00 H new ATOM 0 HD2 LYS A 77 10.960 -3.463 -16.380 1.00 0.00 H new ATOM 0 HD3 LYS A 77 12.570 -3.441 -15.687 1.00 0.00 H new ATOM 0 HE2 LYS A 77 11.403 -6.114 -15.445 1.00 0.00 H new ATOM 0 HE3 LYS A 77 11.341 -5.576 -17.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 13.426 -6.677 -16.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 13.704 -5.044 -16.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 13.764 -5.566 -15.384 1.00 0.00 H new ATOM 1324 N SER A 78 12.852 -1.792 -10.572 1.00 0.00 N ATOM 1325 CA SER A 78 13.904 -1.169 -9.788 1.00 0.00 C ATOM 1326 C SER A 78 13.314 -0.075 -8.896 1.00 0.00 C ATOM 1327 O SER A 78 12.175 0.344 -9.093 1.00 0.00 O ATOM 1328 CB SER A 78 14.994 -0.588 -10.691 1.00 0.00 C ATOM 1329 OG SER A 78 15.897 -1.589 -11.150 1.00 0.00 O ATOM 0 H SER A 78 11.990 -1.251 -10.635 1.00 0.00 H new ATOM 0 HA SER A 78 14.361 -1.934 -9.160 1.00 0.00 H new ATOM 0 HB2 SER A 78 14.532 -0.097 -11.547 1.00 0.00 H new ATOM 0 HB3 SER A 78 15.547 0.177 -10.145 1.00 0.00 H new ATOM 0 HG SER A 78 15.479 -2.471 -11.064 1.00 0.00 H new ATOM 1335 N ILE A 79 14.117 0.357 -7.934 1.00 0.00 N ATOM 1336 CA ILE A 79 13.689 1.394 -7.011 1.00 0.00 C ATOM 1337 C ILE A 79 13.249 2.626 -7.804 1.00 0.00 C ATOM 1338 O ILE A 79 12.216 3.225 -7.506 1.00 0.00 O ATOM 1339 CB ILE A 79 14.785 1.684 -5.984 1.00 0.00 C ATOM 1340 CG1 ILE A 79 15.174 0.413 -5.225 1.00 0.00 C ATOM 1341 CG2 ILE A 79 14.366 2.811 -5.038 1.00 0.00 C ATOM 1342 CD1 ILE A 79 16.176 0.725 -4.111 1.00 0.00 C ATOM 0 H ILE A 79 15.062 0.007 -7.774 1.00 0.00 H new ATOM 0 HA ILE A 79 12.826 1.059 -6.436 1.00 0.00 H new ATOM 0 HB ILE A 79 15.672 2.025 -6.518 1.00 0.00 H new ATOM 0 HG12 ILE A 79 14.283 -0.048 -4.799 1.00 0.00 H new ATOM 0 HG13 ILE A 79 15.607 -0.310 -5.917 1.00 0.00 H new ATOM 0 HG21 ILE A 79 15.163 2.997 -4.318 1.00 0.00 H new ATOM 0 HG22 ILE A 79 14.178 3.718 -5.613 1.00 0.00 H new ATOM 0 HG23 ILE A 79 13.458 2.522 -4.508 1.00 0.00 H new ATOM 0 HD11 ILE A 79 16.436 -0.195 -3.587 1.00 0.00 H new ATOM 0 HD12 ILE A 79 17.076 1.163 -4.543 1.00 0.00 H new ATOM 0 HD13 ILE A 79 15.731 1.429 -3.408 1.00 0.00 H new ATOM 1354 N GLU A 80 14.054 2.969 -8.799 1.00 0.00 N ATOM 1355 CA GLU A 80 13.760 4.119 -9.638 1.00 0.00 C ATOM 1356 C GLU A 80 12.437 3.913 -10.377 1.00 0.00 C ATOM 1357 O GLU A 80 11.580 4.796 -10.381 1.00 0.00 O ATOM 1358 CB GLU A 80 14.902 4.386 -10.621 1.00 0.00 C ATOM 1359 CG GLU A 80 15.656 5.665 -10.252 1.00 0.00 C ATOM 1360 CD GLU A 80 15.472 6.739 -11.325 1.00 0.00 C ATOM 1361 OE1 GLU A 80 14.306 6.955 -11.719 1.00 0.00 O ATOM 1362 OE2 GLU A 80 16.503 7.321 -11.728 1.00 0.00 O ATOM 0 H GLU A 80 14.910 2.471 -9.043 1.00 0.00 H new ATOM 0 HA GLU A 80 13.663 4.996 -8.998 1.00 0.00 H new ATOM 0 HB2 GLU A 80 15.591 3.541 -10.622 1.00 0.00 H new ATOM 0 HB3 GLU A 80 14.503 4.473 -11.632 1.00 0.00 H new ATOM 0 HG2 GLU A 80 15.297 6.039 -9.293 1.00 0.00 H new ATOM 0 HG3 GLU A 80 16.717 5.444 -10.132 1.00 0.00 H new ATOM 1369 N GLU A 81 12.310 2.742 -10.983 1.00 0.00 N ATOM 1370 CA GLU A 81 11.105 2.409 -11.724 1.00 0.00 C ATOM 1371 C GLU A 81 9.894 2.400 -10.790 1.00 0.00 C ATOM 1372 O GLU A 81 8.787 2.750 -11.198 1.00 0.00 O ATOM 1373 CB GLU A 81 11.255 1.065 -12.440 1.00 0.00 C ATOM 1374 CG GLU A 81 11.846 1.252 -13.839 1.00 0.00 C ATOM 1375 CD GLU A 81 12.256 -0.091 -14.445 1.00 0.00 C ATOM 1376 OE1 GLU A 81 13.364 -0.555 -14.101 1.00 0.00 O ATOM 1377 OE2 GLU A 81 11.451 -0.624 -15.239 1.00 0.00 O ATOM 0 H GLU A 81 13.022 2.012 -10.976 1.00 0.00 H new ATOM 0 HA GLU A 81 10.947 3.173 -12.485 1.00 0.00 H new ATOM 0 HB2 GLU A 81 11.897 0.407 -11.855 1.00 0.00 H new ATOM 0 HB3 GLU A 81 10.283 0.578 -12.514 1.00 0.00 H new ATOM 0 HG2 GLU A 81 11.115 1.738 -14.485 1.00 0.00 H new ATOM 0 HG3 GLU A 81 12.713 1.911 -13.786 1.00 0.00 H new ATOM 1384 N GLY A 82 10.143 1.997 -9.552 1.00 0.00 N ATOM 1385 CA GLY A 82 9.087 1.937 -8.557 1.00 0.00 C ATOM 1386 C GLY A 82 8.487 3.324 -8.310 1.00 0.00 C ATOM 1387 O GLY A 82 7.269 3.491 -8.335 1.00 0.00 O ATOM 0 H GLY A 82 11.062 1.709 -9.216 1.00 0.00 H new ATOM 0 HA2 GLY A 82 8.306 1.253 -8.891 1.00 0.00 H new ATOM 0 HA3 GLY A 82 9.484 1.537 -7.624 1.00 0.00 H new ATOM 1391 N ILE A 83 9.372 4.282 -8.077 1.00 0.00 N ATOM 1392 CA ILE A 83 8.946 5.649 -7.826 1.00 0.00 C ATOM 1393 C ILE A 83 8.119 6.147 -9.014 1.00 0.00 C ATOM 1394 O ILE A 83 7.161 6.897 -8.836 1.00 0.00 O ATOM 1395 CB ILE A 83 10.150 6.534 -7.500 1.00 0.00 C ATOM 1396 CG1 ILE A 83 10.613 6.320 -6.058 1.00 0.00 C ATOM 1397 CG2 ILE A 83 9.844 8.005 -7.792 1.00 0.00 C ATOM 1398 CD1 ILE A 83 12.029 5.742 -6.017 1.00 0.00 C ATOM 0 H ILE A 83 10.382 4.139 -8.057 1.00 0.00 H new ATOM 0 HA ILE A 83 8.301 5.692 -6.948 1.00 0.00 H new ATOM 0 HB ILE A 83 10.975 6.242 -8.150 1.00 0.00 H new ATOM 0 HG12 ILE A 83 10.587 7.267 -5.520 1.00 0.00 H new ATOM 0 HG13 ILE A 83 9.926 5.645 -5.548 1.00 0.00 H new ATOM 0 HG21 ILE A 83 10.716 8.613 -7.552 1.00 0.00 H new ATOM 0 HG22 ILE A 83 9.599 8.123 -8.848 1.00 0.00 H new ATOM 0 HG23 ILE A 83 8.998 8.328 -7.185 1.00 0.00 H new ATOM 0 HD11 ILE A 83 12.334 5.600 -4.980 1.00 0.00 H new ATOM 0 HD12 ILE A 83 12.046 4.783 -6.535 1.00 0.00 H new ATOM 0 HD13 ILE A 83 12.718 6.431 -6.506 1.00 0.00 H new ATOM 1410 N GLN A 84 8.521 5.710 -10.198 1.00 0.00 N ATOM 1411 CA GLN A 84 7.830 6.102 -11.415 1.00 0.00 C ATOM 1412 C GLN A 84 6.370 5.648 -11.365 1.00 0.00 C ATOM 1413 O GLN A 84 5.483 6.344 -11.857 1.00 0.00 O ATOM 1414 CB GLN A 84 8.537 5.544 -12.651 1.00 0.00 C ATOM 1415 CG GLN A 84 9.538 6.554 -13.214 1.00 0.00 C ATOM 1416 CD GLN A 84 8.847 7.873 -13.568 1.00 0.00 C ATOM 1417 OE1 GLN A 84 7.769 7.905 -14.138 1.00 0.00 O ATOM 1418 NE2 GLN A 84 9.525 8.955 -13.198 1.00 0.00 N ATOM 0 H GLN A 84 9.317 5.088 -10.341 1.00 0.00 H new ATOM 0 HA GLN A 84 7.849 7.189 -11.487 1.00 0.00 H new ATOM 0 HB2 GLN A 84 9.054 4.620 -12.392 1.00 0.00 H new ATOM 0 HB3 GLN A 84 7.800 5.294 -13.414 1.00 0.00 H new ATOM 0 HG2 GLN A 84 10.326 6.737 -12.483 1.00 0.00 H new ATOM 0 HG3 GLN A 84 10.017 6.141 -14.102 1.00 0.00 H new ATOM 0 HE21 GLN A 84 10.423 8.857 -12.724 1.00 0.00 H new ATOM 0 HE22 GLN A 84 9.147 9.883 -13.388 1.00 0.00 H new ATOM 1427 N VAL A 85 6.166 4.483 -10.767 1.00 0.00 N ATOM 1428 CA VAL A 85 4.828 3.928 -10.647 1.00 0.00 C ATOM 1429 C VAL A 85 3.984 4.833 -9.748 1.00 0.00 C ATOM 1430 O VAL A 85 2.820 5.098 -10.045 1.00 0.00 O ATOM 1431 CB VAL A 85 4.904 2.486 -10.142 1.00 0.00 C ATOM 1432 CG1 VAL A 85 3.746 2.176 -9.191 1.00 0.00 C ATOM 1433 CG2 VAL A 85 4.934 1.497 -11.309 1.00 0.00 C ATOM 0 H VAL A 85 6.904 3.908 -10.361 1.00 0.00 H new ATOM 0 HA VAL A 85 4.340 3.892 -11.621 1.00 0.00 H new ATOM 0 HB VAL A 85 5.834 2.375 -9.585 1.00 0.00 H new ATOM 0 HG11 VAL A 85 3.824 1.145 -8.847 1.00 0.00 H new ATOM 0 HG12 VAL A 85 3.789 2.849 -8.334 1.00 0.00 H new ATOM 0 HG13 VAL A 85 2.799 2.314 -9.713 1.00 0.00 H new ATOM 0 HG21 VAL A 85 4.988 0.479 -10.922 1.00 0.00 H new ATOM 0 HG22 VAL A 85 4.029 1.611 -11.906 1.00 0.00 H new ATOM 0 HG23 VAL A 85 5.806 1.695 -11.932 1.00 0.00 H new ATOM 1443 N TYR A 86 4.603 5.282 -8.666 1.00 0.00 N ATOM 1444 CA TYR A 86 3.922 6.152 -7.722 1.00 0.00 C ATOM 1445 C TYR A 86 3.747 7.558 -8.299 1.00 0.00 C ATOM 1446 O TYR A 86 2.838 8.286 -7.904 1.00 0.00 O ATOM 1447 CB TYR A 86 4.828 6.229 -6.491 1.00 0.00 C ATOM 1448 CG TYR A 86 5.149 4.868 -5.869 1.00 0.00 C ATOM 1449 CD1 TYR A 86 4.194 3.871 -5.859 1.00 0.00 C ATOM 1450 CD2 TYR A 86 6.393 4.638 -5.317 1.00 0.00 C ATOM 1451 CE1 TYR A 86 4.496 2.591 -5.274 1.00 0.00 C ATOM 1452 CE2 TYR A 86 6.695 3.357 -4.732 1.00 0.00 C ATOM 1453 CZ TYR A 86 5.732 2.397 -4.739 1.00 0.00 C ATOM 1454 OH TYR A 86 6.017 1.188 -4.186 1.00 0.00 O ATOM 0 H TYR A 86 5.568 5.060 -8.422 1.00 0.00 H new ATOM 0 HA TYR A 86 2.931 5.764 -7.489 1.00 0.00 H new ATOM 0 HB2 TYR A 86 5.761 6.719 -6.769 1.00 0.00 H new ATOM 0 HB3 TYR A 86 4.350 6.857 -5.739 1.00 0.00 H new ATOM 0 HD1 TYR A 86 3.220 4.052 -6.290 1.00 0.00 H new ATOM 0 HD2 TYR A 86 7.140 5.418 -5.324 1.00 0.00 H new ATOM 0 HE1 TYR A 86 3.758 1.802 -5.260 1.00 0.00 H new ATOM 0 HE2 TYR A 86 7.665 3.163 -4.298 1.00 0.00 H new ATOM 0 HH TYR A 86 5.225 0.612 -4.233 1.00 0.00 H new ATOM 1464 N ARG A 87 4.631 7.897 -9.225 1.00 0.00 N ATOM 1465 CA ARG A 87 4.585 9.203 -9.861 1.00 0.00 C ATOM 1466 C ARG A 87 3.430 9.265 -10.863 1.00 0.00 C ATOM 1467 O ARG A 87 2.758 10.289 -10.978 1.00 0.00 O ATOM 1468 CB ARG A 87 5.897 9.509 -10.586 1.00 0.00 C ATOM 1469 CG ARG A 87 5.799 10.821 -11.368 1.00 0.00 C ATOM 1470 CD ARG A 87 5.766 12.022 -10.421 1.00 0.00 C ATOM 1471 NE ARG A 87 7.132 12.566 -10.246 1.00 0.00 N ATOM 1472 CZ ARG A 87 7.871 13.074 -11.241 1.00 0.00 C ATOM 1473 NH1 ARG A 87 7.381 13.112 -12.488 1.00 0.00 N ATOM 1474 NH2 ARG A 87 9.100 13.545 -10.990 1.00 0.00 N ATOM 0 H ARG A 87 5.384 7.290 -9.551 1.00 0.00 H new ATOM 0 HA ARG A 87 4.433 9.947 -9.079 1.00 0.00 H new ATOM 0 HB2 ARG A 87 6.710 9.573 -9.863 1.00 0.00 H new ATOM 0 HB3 ARG A 87 6.139 8.693 -11.267 1.00 0.00 H new ATOM 0 HG2 ARG A 87 6.649 10.910 -12.044 1.00 0.00 H new ATOM 0 HG3 ARG A 87 4.900 10.815 -11.985 1.00 0.00 H new ATOM 0 HD2 ARG A 87 5.107 12.793 -10.821 1.00 0.00 H new ATOM 0 HD3 ARG A 87 5.358 11.723 -9.455 1.00 0.00 H new ATOM 0 HE ARG A 87 7.535 12.553 -9.309 1.00 0.00 H new ATOM 0 HH11 ARG A 87 6.445 12.754 -12.679 1.00 0.00 H new ATOM 0 HH12 ARG A 87 7.944 13.499 -13.246 1.00 0.00 H new ATOM 0 HH21 ARG A 87 9.473 13.517 -10.041 1.00 0.00 H new ATOM 0 HH22 ARG A 87 9.663 13.932 -11.748 1.00 0.00 H new ATOM 1488 N ARG A 88 3.236 8.157 -11.563 1.00 0.00 N ATOM 1489 CA ARG A 88 2.174 8.073 -12.551 1.00 0.00 C ATOM 1490 C ARG A 88 0.807 8.172 -11.871 1.00 0.00 C ATOM 1491 O ARG A 88 -0.074 8.890 -12.342 1.00 0.00 O ATOM 1492 CB ARG A 88 2.253 6.760 -13.333 1.00 0.00 C ATOM 1493 CG ARG A 88 3.447 6.763 -14.290 1.00 0.00 C ATOM 1494 CD ARG A 88 3.489 5.477 -15.118 1.00 0.00 C ATOM 1495 NE ARG A 88 2.491 5.544 -16.209 1.00 0.00 N ATOM 1496 CZ ARG A 88 2.718 6.111 -17.401 1.00 0.00 C ATOM 1497 NH1 ARG A 88 3.911 6.663 -17.664 1.00 0.00 N ATOM 1498 NH2 ARG A 88 1.754 6.126 -18.331 1.00 0.00 N ATOM 0 H ARG A 88 3.796 7.310 -11.466 1.00 0.00 H new ATOM 0 HA ARG A 88 2.299 8.905 -13.245 1.00 0.00 H new ATOM 0 HB2 ARG A 88 2.341 5.924 -12.639 1.00 0.00 H new ATOM 0 HB3 ARG A 88 1.331 6.612 -13.896 1.00 0.00 H new ATOM 0 HG2 ARG A 88 3.383 7.625 -14.954 1.00 0.00 H new ATOM 0 HG3 ARG A 88 4.372 6.865 -13.723 1.00 0.00 H new ATOM 0 HD2 ARG A 88 4.486 5.335 -15.535 1.00 0.00 H new ATOM 0 HD3 ARG A 88 3.285 4.617 -14.480 1.00 0.00 H new ATOM 0 HE ARG A 88 1.573 5.132 -16.043 1.00 0.00 H new ATOM 0 HH11 ARG A 88 4.646 6.651 -16.956 1.00 0.00 H new ATOM 0 HH12 ARG A 88 4.084 7.095 -18.572 1.00 0.00 H new ATOM 0 HH21 ARG A 88 0.846 5.705 -18.132 1.00 0.00 H new ATOM 0 HH22 ARG A 88 1.928 6.558 -19.239 1.00 0.00 H new ATOM 1512 N PHE A 89 0.673 7.441 -10.774 1.00 0.00 N ATOM 1513 CA PHE A 89 -0.572 7.438 -10.025 1.00 0.00 C ATOM 1514 C PHE A 89 -0.675 8.673 -9.127 1.00 0.00 C ATOM 1515 O PHE A 89 -1.645 9.424 -9.206 1.00 0.00 O ATOM 1516 CB PHE A 89 -0.564 6.184 -9.149 1.00 0.00 C ATOM 1517 CG PHE A 89 -0.627 4.874 -9.937 1.00 0.00 C ATOM 1518 CD1 PHE A 89 -1.472 4.757 -10.996 1.00 0.00 C ATOM 1519 CD2 PHE A 89 0.163 3.826 -9.579 1.00 0.00 C ATOM 1520 CE1 PHE A 89 -1.531 3.542 -11.727 1.00 0.00 C ATOM 1521 CE2 PHE A 89 0.104 2.610 -10.310 1.00 0.00 C ATOM 1522 CZ PHE A 89 -0.741 2.494 -11.369 1.00 0.00 C ATOM 0 H PHE A 89 1.406 6.847 -10.386 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.419 7.449 -10.711 1.00 0.00 H new ATOM 0 HB2 PHE A 89 0.339 6.186 -8.538 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.412 6.226 -8.465 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -2.099 5.589 -11.281 1.00 0.00 H new ATOM 0 HD2 PHE A 89 0.835 3.919 -8.739 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -2.203 3.449 -12.567 1.00 0.00 H new ATOM 0 HE2 PHE A 89 0.730 1.777 -10.025 1.00 0.00 H new ATOM 0 HZ PHE A 89 -0.785 1.570 -11.926 1.00 0.00 H new ATOM 1532 N TYR A 90 0.340 8.844 -8.293 1.00 0.00 N ATOM 1533 CA TYR A 90 0.377 9.974 -7.380 1.00 0.00 C ATOM 1534 C TYR A 90 1.200 11.124 -7.965 1.00 0.00 C ATOM 1535 O TYR A 90 2.223 10.895 -8.608 1.00 0.00 O ATOM 1536 CB TYR A 90 1.060 9.468 -6.109 1.00 0.00 C ATOM 1537 CG TYR A 90 0.822 7.984 -5.823 1.00 0.00 C ATOM 1538 CD1 TYR A 90 -0.372 7.394 -6.185 1.00 0.00 C ATOM 1539 CD2 TYR A 90 1.802 7.234 -5.204 1.00 0.00 C ATOM 1540 CE1 TYR A 90 -0.596 5.997 -5.916 1.00 0.00 C ATOM 1541 CE2 TYR A 90 1.578 5.838 -4.935 1.00 0.00 C ATOM 1542 CZ TYR A 90 0.390 5.288 -5.304 1.00 0.00 C ATOM 1543 OH TYR A 90 0.178 3.969 -5.051 1.00 0.00 O ATOM 0 H TYR A 90 1.143 8.219 -8.230 1.00 0.00 H new ATOM 0 HA TYR A 90 -0.629 10.349 -7.192 1.00 0.00 H new ATOM 0 HB2 TYR A 90 2.133 9.644 -6.190 1.00 0.00 H new ATOM 0 HB3 TYR A 90 0.704 10.053 -5.260 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -1.139 7.980 -6.670 1.00 0.00 H new ATOM 0 HD2 TYR A 90 2.737 7.695 -4.922 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -1.526 5.523 -6.194 1.00 0.00 H new ATOM 0 HE2 TYR A 90 2.336 5.240 -4.451 1.00 0.00 H new ATOM 0 HH TYR A 90 0.967 3.589 -4.612 1.00 0.00 H new ATOM 1553 N ASP A 91 0.724 12.335 -7.719 1.00 0.00 N ATOM 1554 CA ASP A 91 1.403 13.521 -8.213 1.00 0.00 C ATOM 1555 C ASP A 91 2.640 13.790 -7.353 1.00 0.00 C ATOM 1556 O ASP A 91 2.667 13.446 -6.173 1.00 0.00 O ATOM 1557 CB ASP A 91 0.495 14.750 -8.131 1.00 0.00 C ATOM 1558 CG ASP A 91 -0.984 14.481 -8.414 1.00 0.00 C ATOM 1559 OD1 ASP A 91 -1.314 14.322 -9.609 1.00 0.00 O ATOM 1560 OD2 ASP A 91 -1.752 14.439 -7.428 1.00 0.00 O ATOM 0 H ASP A 91 -0.124 12.521 -7.184 1.00 0.00 H new ATOM 0 HA ASP A 91 1.678 13.344 -9.253 1.00 0.00 H new ATOM 0 HB2 ASP A 91 0.586 15.184 -7.135 1.00 0.00 H new ATOM 0 HB3 ASP A 91 0.855 15.497 -8.839 1.00 0.00 H new ATOM 1565 N GLU A 92 3.635 14.401 -7.979 1.00 0.00 N ATOM 1566 CA GLU A 92 4.872 14.720 -7.287 1.00 0.00 C ATOM 1567 C GLU A 92 4.669 15.923 -6.364 1.00 0.00 C ATOM 1568 O GLU A 92 5.382 16.079 -5.375 1.00 0.00 O ATOM 1569 CB GLU A 92 6.006 14.976 -8.281 1.00 0.00 C ATOM 1570 CG GLU A 92 5.803 16.304 -9.014 1.00 0.00 C ATOM 1571 CD GLU A 92 6.372 16.239 -10.433 1.00 0.00 C ATOM 1572 OE1 GLU A 92 5.900 15.367 -11.194 1.00 0.00 O ATOM 1573 OE2 GLU A 92 7.267 17.062 -10.724 1.00 0.00 O ATOM 0 H GLU A 92 3.610 14.684 -8.959 1.00 0.00 H new ATOM 0 HA GLU A 92 5.155 13.863 -6.676 1.00 0.00 H new ATOM 0 HB2 GLU A 92 6.960 14.989 -7.754 1.00 0.00 H new ATOM 0 HB3 GLU A 92 6.052 14.161 -9.003 1.00 0.00 H new ATOM 0 HG2 GLU A 92 4.740 16.542 -9.055 1.00 0.00 H new ATOM 0 HG3 GLU A 92 6.289 17.107 -8.460 1.00 0.00 H new ATOM 1580 N GLU A 93 3.691 16.744 -6.721 1.00 0.00 N ATOM 1581 CA GLU A 93 3.385 17.928 -5.937 1.00 0.00 C ATOM 1582 C GLU A 93 2.711 17.535 -4.622 1.00 0.00 C ATOM 1583 O GLU A 93 3.182 17.899 -3.545 1.00 0.00 O ATOM 1584 CB GLU A 93 2.512 18.901 -6.732 1.00 0.00 C ATOM 1585 CG GLU A 93 3.073 20.323 -6.664 1.00 0.00 C ATOM 1586 CD GLU A 93 3.429 20.840 -8.059 1.00 0.00 C ATOM 1587 OE1 GLU A 93 4.224 20.150 -8.733 1.00 0.00 O ATOM 1588 OE2 GLU A 93 2.898 21.912 -8.420 1.00 0.00 O ATOM 0 H GLU A 93 3.101 16.612 -7.542 1.00 0.00 H new ATOM 0 HA GLU A 93 4.320 18.437 -5.704 1.00 0.00 H new ATOM 0 HB2 GLU A 93 2.455 18.578 -7.772 1.00 0.00 H new ATOM 0 HB3 GLU A 93 1.496 18.888 -6.338 1.00 0.00 H new ATOM 0 HG2 GLU A 93 2.340 20.985 -6.203 1.00 0.00 H new ATOM 0 HG3 GLU A 93 3.959 20.338 -6.030 1.00 0.00 H new ATOM 1595 N LYS A 94 1.618 16.797 -4.752 1.00 0.00 N ATOM 1596 CA LYS A 94 0.874 16.350 -3.586 1.00 0.00 C ATOM 1597 C LYS A 94 1.798 15.538 -2.677 1.00 0.00 C ATOM 1598 O LYS A 94 1.800 15.727 -1.461 1.00 0.00 O ATOM 1599 CB LYS A 94 -0.387 15.595 -4.013 1.00 0.00 C ATOM 1600 CG LYS A 94 -1.648 16.337 -3.566 1.00 0.00 C ATOM 1601 CD LYS A 94 -2.296 15.644 -2.366 1.00 0.00 C ATOM 1602 CE LYS A 94 -3.798 15.454 -2.588 1.00 0.00 C ATOM 1603 NZ LYS A 94 -4.190 14.054 -2.313 1.00 0.00 N ATOM 0 H LYS A 94 1.230 16.497 -5.646 1.00 0.00 H new ATOM 0 HA LYS A 94 0.526 17.204 -3.006 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -0.395 15.477 -5.097 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -0.379 14.593 -3.583 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -1.396 17.365 -3.304 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -2.359 16.383 -4.391 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -1.824 14.675 -2.202 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -2.130 16.236 -1.466 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -4.356 16.128 -1.938 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -4.056 15.715 -3.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -5.212 13.943 -2.469 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -3.671 13.417 -2.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -3.962 13.817 -1.326 1.00 0.00 H new ATOM 1617 N GLU A 95 2.561 14.653 -3.300 1.00 0.00 N ATOM 1618 CA GLU A 95 3.488 13.812 -2.562 1.00 0.00 C ATOM 1619 C GLU A 95 4.542 14.671 -1.861 1.00 0.00 C ATOM 1620 O GLU A 95 4.790 14.505 -0.668 1.00 0.00 O ATOM 1621 CB GLU A 95 4.144 12.780 -3.481 1.00 0.00 C ATOM 1622 CG GLU A 95 4.793 11.656 -2.670 1.00 0.00 C ATOM 1623 CD GLU A 95 6.305 11.863 -2.559 1.00 0.00 C ATOM 1624 OE1 GLU A 95 6.856 12.519 -3.469 1.00 0.00 O ATOM 1625 OE2 GLU A 95 6.874 11.361 -1.566 1.00 0.00 O ATOM 0 H GLU A 95 2.556 14.500 -4.308 1.00 0.00 H new ATOM 0 HA GLU A 95 2.927 13.268 -1.802 1.00 0.00 H new ATOM 0 HB2 GLU A 95 3.397 12.362 -4.155 1.00 0.00 H new ATOM 0 HB3 GLU A 95 4.897 13.267 -4.101 1.00 0.00 H new ATOM 0 HG2 GLU A 95 4.353 11.621 -1.673 1.00 0.00 H new ATOM 0 HG3 GLU A 95 4.587 10.696 -3.143 1.00 0.00 H new ATOM 1632 N LYS A 96 5.133 15.571 -2.633 1.00 0.00 N ATOM 1633 CA LYS A 96 6.155 16.457 -2.102 1.00 0.00 C ATOM 1634 C LYS A 96 5.578 17.246 -0.924 1.00 0.00 C ATOM 1635 O LYS A 96 6.324 17.814 -0.128 1.00 0.00 O ATOM 1636 CB LYS A 96 6.729 17.340 -3.211 1.00 0.00 C ATOM 1637 CG LYS A 96 7.662 16.540 -4.122 1.00 0.00 C ATOM 1638 CD LYS A 96 9.065 16.442 -3.519 1.00 0.00 C ATOM 1639 CE LYS A 96 9.684 15.069 -3.790 1.00 0.00 C ATOM 1640 NZ LYS A 96 11.127 15.078 -3.465 1.00 0.00 N ATOM 0 H LYS A 96 4.924 15.706 -3.622 1.00 0.00 H new ATOM 0 HA LYS A 96 6.997 15.880 -1.719 1.00 0.00 H new ATOM 0 HB2 LYS A 96 5.916 17.765 -3.800 1.00 0.00 H new ATOM 0 HB3 LYS A 96 7.273 18.175 -2.770 1.00 0.00 H new ATOM 0 HG2 LYS A 96 7.257 15.540 -4.275 1.00 0.00 H new ATOM 0 HG3 LYS A 96 7.716 17.015 -5.101 1.00 0.00 H new ATOM 0 HD2 LYS A 96 9.701 17.221 -3.940 1.00 0.00 H new ATOM 0 HD3 LYS A 96 9.016 16.617 -2.444 1.00 0.00 H new ATOM 0 HE2 LYS A 96 9.176 14.311 -3.195 1.00 0.00 H new ATOM 0 HE3 LYS A 96 9.543 14.800 -4.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 11.531 14.139 -3.655 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 11.610 15.788 -4.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 11.255 15.314 -2.460 1.00 0.00 H new ATOM 1654 N LYS A 97 4.255 17.254 -0.851 1.00 0.00 N ATOM 1655 CA LYS A 97 3.570 17.964 0.216 1.00 0.00 C ATOM 1656 C LYS A 97 3.703 17.171 1.518 1.00 0.00 C ATOM 1657 O LYS A 97 4.247 17.672 2.501 1.00 0.00 O ATOM 1658 CB LYS A 97 2.121 18.257 -0.180 1.00 0.00 C ATOM 1659 CG LYS A 97 1.624 19.547 0.475 1.00 0.00 C ATOM 1660 CD LYS A 97 2.009 20.769 -0.360 1.00 0.00 C ATOM 1661 CE LYS A 97 3.014 21.649 0.387 1.00 0.00 C ATOM 1662 NZ LYS A 97 2.695 23.081 0.192 1.00 0.00 N ATOM 0 H LYS A 97 3.640 16.781 -1.513 1.00 0.00 H new ATOM 0 HA LYS A 97 4.033 18.936 0.385 1.00 0.00 H new ATOM 0 HB2 LYS A 97 2.047 18.343 -1.264 1.00 0.00 H new ATOM 0 HB3 LYS A 97 1.483 17.425 0.118 1.00 0.00 H new ATOM 0 HG2 LYS A 97 0.541 19.507 0.590 1.00 0.00 H new ATOM 0 HG3 LYS A 97 2.047 19.638 1.475 1.00 0.00 H new ATOM 0 HD2 LYS A 97 2.438 20.445 -1.308 1.00 0.00 H new ATOM 0 HD3 LYS A 97 1.117 21.349 -0.595 1.00 0.00 H new ATOM 0 HE2 LYS A 97 2.997 21.408 1.450 1.00 0.00 H new ATOM 0 HE3 LYS A 97 4.023 21.443 0.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 3.387 23.664 0.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 2.734 23.310 -0.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 1.740 23.277 0.555 1.00 0.00 H new ATOM 1676 N TYR A 98 3.198 15.946 1.482 1.00 0.00 N ATOM 1677 CA TYR A 98 3.254 15.079 2.647 1.00 0.00 C ATOM 1678 C TYR A 98 4.378 14.050 2.510 1.00 0.00 C ATOM 1679 O TYR A 98 5.247 13.957 3.375 1.00 0.00 O ATOM 1680 CB TYR A 98 1.911 14.348 2.693 1.00 0.00 C ATOM 1681 CG TYR A 98 0.732 15.237 3.094 1.00 0.00 C ATOM 1682 CD1 TYR A 98 0.591 15.647 4.404 1.00 0.00 C ATOM 1683 CD2 TYR A 98 -0.191 15.628 2.145 1.00 0.00 C ATOM 1684 CE1 TYR A 98 -0.519 16.484 4.781 1.00 0.00 C ATOM 1685 CE2 TYR A 98 -1.301 16.464 2.522 1.00 0.00 C ATOM 1686 CZ TYR A 98 -1.410 16.851 3.822 1.00 0.00 C ATOM 1687 OH TYR A 98 -2.458 17.641 4.178 1.00 0.00 O ATOM 0 H TYR A 98 2.748 15.534 0.665 1.00 0.00 H new ATOM 0 HA TYR A 98 3.445 15.660 3.550 1.00 0.00 H new ATOM 0 HB2 TYR A 98 1.710 13.916 1.712 1.00 0.00 H new ATOM 0 HB3 TYR A 98 1.984 13.519 3.397 1.00 0.00 H new ATOM 0 HD1 TYR A 98 1.313 15.340 5.147 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -0.081 15.307 1.120 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -0.641 16.813 5.803 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -2.031 16.777 1.790 1.00 0.00 H new ATOM 0 HH TYR A 98 -3.012 17.824 3.391 1.00 0.00 H new ATOM 1697 N GLY A 99 4.323 13.303 1.418 1.00 0.00 N ATOM 1698 CA GLY A 99 5.325 12.283 1.157 1.00 0.00 C ATOM 1699 C GLY A 99 4.674 10.913 0.958 1.00 0.00 C ATOM 1700 O GLY A 99 3.611 10.809 0.348 1.00 0.00 O ATOM 0 H GLY A 99 3.600 13.383 0.703 1.00 0.00 H new ATOM 0 HA2 GLY A 99 5.898 12.550 0.269 1.00 0.00 H new ATOM 0 HA3 GLY A 99 6.028 12.238 1.988 1.00 0.00 H new ATOM 1704 N VAL A 100 5.340 9.895 1.483 1.00 0.00 N ATOM 1705 CA VAL A 100 4.840 8.536 1.371 1.00 0.00 C ATOM 1706 C VAL A 100 4.704 7.930 2.769 1.00 0.00 C ATOM 1707 O VAL A 100 5.668 7.897 3.532 1.00 0.00 O ATOM 1708 CB VAL A 100 5.749 7.718 0.451 1.00 0.00 C ATOM 1709 CG1 VAL A 100 4.981 6.564 -0.195 1.00 0.00 C ATOM 1710 CG2 VAL A 100 6.397 8.608 -0.611 1.00 0.00 C ATOM 0 H VAL A 100 6.222 9.985 1.987 1.00 0.00 H new ATOM 0 HA VAL A 100 3.849 8.530 0.916 1.00 0.00 H new ATOM 0 HB VAL A 100 6.545 7.290 1.061 1.00 0.00 H new ATOM 0 HG11 VAL A 100 5.651 5.999 -0.844 1.00 0.00 H new ATOM 0 HG12 VAL A 100 4.589 5.908 0.582 1.00 0.00 H new ATOM 0 HG13 VAL A 100 4.155 6.962 -0.784 1.00 0.00 H new ATOM 0 HG21 VAL A 100 7.038 8.002 -1.252 1.00 0.00 H new ATOM 0 HG22 VAL A 100 5.621 9.078 -1.215 1.00 0.00 H new ATOM 0 HG23 VAL A 100 6.995 9.379 -0.124 1.00 0.00 H new ATOM 1720 N VAL A 101 3.498 7.465 3.063 1.00 0.00 N ATOM 1721 CA VAL A 101 3.223 6.862 4.356 1.00 0.00 C ATOM 1722 C VAL A 101 3.102 5.346 4.191 1.00 0.00 C ATOM 1723 O VAL A 101 2.112 4.853 3.653 1.00 0.00 O ATOM 1724 CB VAL A 101 1.977 7.497 4.975 1.00 0.00 C ATOM 1725 CG1 VAL A 101 2.268 8.920 5.456 1.00 0.00 C ATOM 1726 CG2 VAL A 101 0.806 7.480 3.991 1.00 0.00 C ATOM 0 H VAL A 101 2.701 7.494 2.428 1.00 0.00 H new ATOM 0 HA VAL A 101 4.044 7.049 5.047 1.00 0.00 H new ATOM 0 HB VAL A 101 1.694 6.901 5.843 1.00 0.00 H new ATOM 0 HG11 VAL A 101 1.365 9.348 5.892 1.00 0.00 H new ATOM 0 HG12 VAL A 101 3.057 8.896 6.207 1.00 0.00 H new ATOM 0 HG13 VAL A 101 2.589 9.531 4.612 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -0.067 7.937 4.456 1.00 0.00 H new ATOM 0 HG22 VAL A 101 1.075 8.040 3.096 1.00 0.00 H new ATOM 0 HG23 VAL A 101 0.574 6.450 3.719 1.00 0.00 H new ATOM 1736 N ALA A 102 4.124 4.648 4.664 1.00 0.00 N ATOM 1737 CA ALA A 102 4.145 3.197 4.576 1.00 0.00 C ATOM 1738 C ALA A 102 3.207 2.613 5.635 1.00 0.00 C ATOM 1739 O ALA A 102 3.585 2.478 6.798 1.00 0.00 O ATOM 1740 CB ALA A 102 5.582 2.697 4.730 1.00 0.00 C ATOM 0 H ALA A 102 4.944 5.060 5.110 1.00 0.00 H new ATOM 0 HA ALA A 102 3.788 2.866 3.601 1.00 0.00 H new ATOM 0 HB1 ALA A 102 5.598 1.609 4.664 1.00 0.00 H new ATOM 0 HB2 ALA A 102 6.201 3.118 3.937 1.00 0.00 H new ATOM 0 HB3 ALA A 102 5.973 3.007 5.699 1.00 0.00 H new ATOM 1746 N ILE A 103 2.002 2.282 5.195 1.00 0.00 N ATOM 1747 CA ILE A 103 1.008 1.716 6.090 1.00 0.00 C ATOM 1748 C ILE A 103 1.081 0.189 6.026 1.00 0.00 C ATOM 1749 O ILE A 103 0.948 -0.398 4.953 1.00 0.00 O ATOM 1750 CB ILE A 103 -0.380 2.278 5.774 1.00 0.00 C ATOM 1751 CG1 ILE A 103 -0.355 3.807 5.731 1.00 0.00 C ATOM 1752 CG2 ILE A 103 -1.423 1.749 6.760 1.00 0.00 C ATOM 1753 CD1 ILE A 103 -0.857 4.326 4.383 1.00 0.00 C ATOM 0 H ILE A 103 1.692 2.395 4.230 1.00 0.00 H new ATOM 0 HA ILE A 103 1.216 2.003 7.121 1.00 0.00 H new ATOM 0 HB ILE A 103 -0.671 1.933 4.782 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -0.976 4.207 6.533 1.00 0.00 H new ATOM 0 HG13 ILE A 103 0.660 4.163 5.906 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -2.400 2.164 6.513 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -1.464 0.662 6.698 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -1.149 2.044 7.773 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -0.829 5.416 4.379 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -0.220 3.944 3.586 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -1.881 3.989 4.222 1.00 0.00 H new ATOM 1765 N GLU A 104 1.293 -0.410 7.189 1.00 0.00 N ATOM 1766 CA GLU A 104 1.386 -1.858 7.278 1.00 0.00 C ATOM 1767 C GLU A 104 -0.012 -2.477 7.338 1.00 0.00 C ATOM 1768 O GLU A 104 -0.704 -2.361 8.348 1.00 0.00 O ATOM 1769 CB GLU A 104 2.224 -2.279 8.487 1.00 0.00 C ATOM 1770 CG GLU A 104 2.880 -3.641 8.251 1.00 0.00 C ATOM 1771 CD GLU A 104 4.269 -3.699 8.891 1.00 0.00 C ATOM 1772 OE1 GLU A 104 4.317 -3.761 10.139 1.00 0.00 O ATOM 1773 OE2 GLU A 104 5.251 -3.679 8.118 1.00 0.00 O ATOM 0 H GLU A 104 1.403 0.080 8.077 1.00 0.00 H new ATOM 0 HA GLU A 104 1.887 -2.227 6.383 1.00 0.00 H new ATOM 0 HB2 GLU A 104 2.992 -1.530 8.680 1.00 0.00 H new ATOM 0 HB3 GLU A 104 1.592 -2.324 9.374 1.00 0.00 H new ATOM 0 HG2 GLU A 104 2.251 -4.428 8.666 1.00 0.00 H new ATOM 0 HG3 GLU A 104 2.961 -3.829 7.180 1.00 0.00 H new ATOM 1780 N ILE A 105 -0.386 -3.121 6.242 1.00 0.00 N ATOM 1781 CA ILE A 105 -1.689 -3.758 6.156 1.00 0.00 C ATOM 1782 C ILE A 105 -1.509 -5.277 6.141 1.00 0.00 C ATOM 1783 O ILE A 105 -0.436 -5.775 5.802 1.00 0.00 O ATOM 1784 CB ILE A 105 -2.471 -3.219 4.957 1.00 0.00 C ATOM 1785 CG1 ILE A 105 -2.112 -3.982 3.680 1.00 0.00 C ATOM 1786 CG2 ILE A 105 -2.266 -1.711 4.800 1.00 0.00 C ATOM 1787 CD1 ILE A 105 -0.636 -3.792 3.325 1.00 0.00 C ATOM 0 H ILE A 105 0.191 -3.215 5.406 1.00 0.00 H new ATOM 0 HA ILE A 105 -2.290 -3.517 7.033 1.00 0.00 H new ATOM 0 HB ILE A 105 -3.533 -3.382 5.142 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -2.324 -5.043 3.814 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -2.736 -3.634 2.857 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -2.833 -1.354 3.940 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -2.611 -1.201 5.699 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -1.207 -1.502 4.648 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -0.407 -4.344 2.414 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -0.433 -2.733 3.168 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -0.015 -4.163 4.140 1.00 0.00 H new ATOM 1799 N GLU A 106 -2.575 -5.971 6.512 1.00 0.00 N ATOM 1800 CA GLU A 106 -2.547 -7.424 6.545 1.00 0.00 C ATOM 1801 C GLU A 106 -3.914 -7.989 6.154 1.00 0.00 C ATOM 1802 O GLU A 106 -4.891 -7.821 6.883 1.00 0.00 O ATOM 1803 CB GLU A 106 -2.117 -7.933 7.922 1.00 0.00 C ATOM 1804 CG GLU A 106 -0.997 -7.067 8.502 1.00 0.00 C ATOM 1805 CD GLU A 106 0.327 -7.326 7.779 1.00 0.00 C ATOM 1806 OE1 GLU A 106 0.424 -8.395 7.138 1.00 0.00 O ATOM 1807 OE2 GLU A 106 1.211 -6.449 7.883 1.00 0.00 O ATOM 0 H GLU A 106 -3.463 -5.555 6.792 1.00 0.00 H new ATOM 0 HA GLU A 106 -1.811 -7.771 5.820 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -2.972 -7.929 8.598 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -1.778 -8.966 7.842 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -1.264 -6.014 8.413 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -0.882 -7.279 9.565 1.00 0.00 H new ATOM 1814 N PRO A 107 -3.941 -8.665 4.974 1.00 0.00 N ATOM 1815 CA PRO A 107 -5.171 -9.257 4.478 1.00 0.00 C ATOM 1816 C PRO A 107 -5.521 -10.528 5.254 1.00 0.00 C ATOM 1817 O PRO A 107 -4.751 -11.487 5.261 1.00 0.00 O ATOM 1818 CB PRO A 107 -4.917 -9.513 3.001 1.00 0.00 C ATOM 1819 CG PRO A 107 -3.407 -9.489 2.828 1.00 0.00 C ATOM 1820 CD PRO A 107 -2.803 -8.884 4.085 1.00 0.00 C ATOM 0 HA PRO A 107 -6.035 -8.606 4.613 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -5.330 -10.474 2.694 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -5.393 -8.750 2.385 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -3.025 -10.497 2.668 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -3.132 -8.902 1.952 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -2.072 -9.555 4.536 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -2.286 -7.950 3.866 1.00 0.00 H new ATOM 1828 N LEU A 108 -6.684 -10.495 5.889 1.00 0.00 N ATOM 1829 CA LEU A 108 -7.145 -11.632 6.666 1.00 0.00 C ATOM 1830 C LEU A 108 -8.179 -12.414 5.853 1.00 0.00 C ATOM 1831 O LEU A 108 -9.066 -13.051 6.420 1.00 0.00 O ATOM 1832 CB LEU A 108 -7.656 -11.175 8.034 1.00 0.00 C ATOM 1833 CG LEU A 108 -8.207 -9.749 8.102 1.00 0.00 C ATOM 1834 CD1 LEU A 108 -7.080 -8.720 7.985 1.00 0.00 C ATOM 1835 CD2 LEU A 108 -9.294 -9.531 7.048 1.00 0.00 C ATOM 0 H LEU A 108 -7.320 -9.698 5.881 1.00 0.00 H new ATOM 0 HA LEU A 108 -6.319 -12.313 6.872 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -8.439 -11.862 8.355 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -6.841 -11.263 8.752 1.00 0.00 H new ATOM 0 HG LEU A 108 -8.672 -9.608 9.078 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -7.498 -7.715 8.036 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -6.373 -8.861 8.802 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -6.565 -8.851 7.033 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -9.669 -8.510 7.118 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -8.876 -9.697 6.055 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -10.112 -10.230 7.219 1.00 0.00 H new