USER MOD reduce.3.24.130724 H: found=0, std=0, add=932, rem=0, adj=12 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 -168:sc= -4.63! (180deg=-4.86!) USER MOD Single : A 8 GLN : amide:sc= -0.17 X(o=-0.17,f=-0.2) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 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=-0.00599 X(o=-0.006,f=0) USER MOD Single : A 35 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0169) USER MOD Single : A 41 SER OG : rot -110:sc= 1.2 USER MOD Single : A 46 LYS NZ :NH3+ -158:sc= 0 (180deg=-0.323) 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 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 SER OG : rot 180:sc= -0.0729 USER MOD Single : A 63 MET CE :methyl 166:sc= -4.09! (180deg=-4.58!) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 ASN : amide:sc= -3.74! C(o=-3.7!,f=-8.7!) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 180:sc= -0.0898 USER MOD Single : A 84 GLN : amide:sc= 0.102 K(o=0.1,f=-0.54) USER MOD Single : A 86 TYR OH : rot -50:sc= -3.61! 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 -16.661 0.956 7.926 1.00 0.00 N ATOM 18 CA GLU A 2 -15.721 0.152 7.163 1.00 0.00 C ATOM 19 C GLU A 2 -15.395 0.834 5.834 1.00 0.00 C ATOM 20 O GLU A 2 -16.249 1.497 5.246 1.00 0.00 O ATOM 21 CB GLU A 2 -16.267 -1.260 6.936 1.00 0.00 C ATOM 22 CG GLU A 2 -15.168 -2.197 6.431 1.00 0.00 C ATOM 23 CD GLU A 2 -15.741 -3.253 5.484 1.00 0.00 C ATOM 24 OE1 GLU A 2 -16.083 -2.868 4.345 1.00 0.00 O ATOM 25 OE2 GLU A 2 -15.825 -4.421 5.920 1.00 0.00 O ATOM 0 HA GLU A 2 -14.799 0.062 7.738 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -16.681 -1.648 7.867 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -17.082 -1.227 6.213 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -14.401 -1.619 5.916 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -14.685 -2.686 7.277 1.00 0.00 H new ATOM 32 N TRP A 3 -14.158 0.649 5.398 1.00 0.00 N ATOM 33 CA TRP A 3 -13.708 1.239 4.148 1.00 0.00 C ATOM 34 C TRP A 3 -13.884 0.196 3.043 1.00 0.00 C ATOM 35 O TRP A 3 -13.711 -0.999 3.279 1.00 0.00 O ATOM 36 CB TRP A 3 -12.270 1.747 4.268 1.00 0.00 C ATOM 37 CG TRP A 3 -12.034 2.669 5.466 1.00 0.00 C ATOM 38 CD1 TRP A 3 -11.519 2.352 6.662 1.00 0.00 C ATOM 39 CD2 TRP A 3 -12.325 4.081 5.535 1.00 0.00 C ATOM 40 NE1 TRP A 3 -11.458 3.451 7.494 1.00 0.00 N ATOM 41 CE2 TRP A 3 -11.964 4.536 6.787 1.00 0.00 C ATOM 42 CE3 TRP A 3 -12.876 4.945 4.572 1.00 0.00 C ATOM 43 CZ2 TRP A 3 -12.114 5.868 7.191 1.00 0.00 C ATOM 44 CZ3 TRP A 3 -13.020 6.273 4.992 1.00 0.00 C ATOM 45 CH2 TRP A 3 -12.661 6.747 6.248 1.00 0.00 C ATOM 0 H TRP A 3 -13.453 0.099 5.888 1.00 0.00 H new ATOM 0 HA TRP A 3 -14.306 2.115 3.898 1.00 0.00 H new ATOM 0 HB2 TRP A 3 -11.598 0.892 4.343 1.00 0.00 H new ATOM 0 HB3 TRP A 3 -12.006 2.280 3.355 1.00 0.00 H new ATOM 0 HD1 TRP A 3 -11.193 1.361 6.940 1.00 0.00 H new ATOM 0 HE1 TRP A 3 -11.106 3.465 8.451 1.00 0.00 H new ATOM 0 HE3 TRP A 3 -13.165 4.611 3.587 1.00 0.00 H new ATOM 0 HZ2 TRP A 3 -11.823 6.200 8.177 1.00 0.00 H new ATOM 0 HZ3 TRP A 3 -13.440 6.979 4.290 1.00 0.00 H new ATOM 0 HH2 TRP A 3 -12.803 7.789 6.496 1.00 0.00 H new ATOM 56 N GLU A 4 -14.224 0.685 1.860 1.00 0.00 N ATOM 57 CA GLU A 4 -14.425 -0.190 0.717 1.00 0.00 C ATOM 58 C GLU A 4 -13.769 0.406 -0.530 1.00 0.00 C ATOM 59 O GLU A 4 -14.002 1.567 -0.863 1.00 0.00 O ATOM 60 CB GLU A 4 -15.914 -0.452 0.482 1.00 0.00 C ATOM 61 CG GLU A 4 -16.685 0.861 0.337 1.00 0.00 C ATOM 62 CD GLU A 4 -17.833 0.937 1.346 1.00 0.00 C ATOM 63 OE1 GLU A 4 -18.758 0.107 1.217 1.00 0.00 O ATOM 64 OE2 GLU A 4 -17.759 1.825 2.224 1.00 0.00 O ATOM 0 H GLU A 4 -14.366 1.677 1.668 1.00 0.00 H new ATOM 0 HA GLU A 4 -13.951 -1.148 0.930 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -16.043 -1.055 -0.417 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -16.321 -1.027 1.313 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -16.009 1.703 0.486 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -17.080 0.945 -0.676 1.00 0.00 H new ATOM 71 N MET A 5 -12.961 -0.415 -1.184 1.00 0.00 N ATOM 72 CA MET A 5 -12.270 0.016 -2.387 1.00 0.00 C ATOM 73 C MET A 5 -12.437 -1.007 -3.513 1.00 0.00 C ATOM 74 O MET A 5 -13.166 -1.986 -3.363 1.00 0.00 O ATOM 75 CB MET A 5 -10.782 0.202 -2.083 1.00 0.00 C ATOM 76 CG MET A 5 -10.580 1.142 -0.892 1.00 0.00 C ATOM 77 SD MET A 5 -9.004 1.969 -1.028 1.00 0.00 S ATOM 78 CE MET A 5 -8.323 1.605 0.581 1.00 0.00 C ATOM 0 H MET A 5 -12.769 -1.377 -0.903 1.00 0.00 H new ATOM 0 HA MET A 5 -12.704 0.961 -2.713 1.00 0.00 H new ATOM 0 HB2 MET A 5 -10.327 -0.765 -1.869 1.00 0.00 H new ATOM 0 HB3 MET A 5 -10.275 0.606 -2.960 1.00 0.00 H new ATOM 0 HG2 MET A 5 -11.384 1.877 -0.858 1.00 0.00 H new ATOM 0 HG3 MET A 5 -10.625 0.577 0.039 1.00 0.00 H new ATOM 0 HE1 MET A 5 -7.438 2.219 0.749 1.00 0.00 H new ATOM 0 HE2 MET A 5 -9.066 1.822 1.348 1.00 0.00 H new ATOM 0 HE3 MET A 5 -8.048 0.551 0.630 1.00 0.00 H new ATOM 88 N GLY A 6 -11.748 -0.745 -4.614 1.00 0.00 N ATOM 89 CA GLY A 6 -11.811 -1.631 -5.764 1.00 0.00 C ATOM 90 C GLY A 6 -10.495 -1.611 -6.544 1.00 0.00 C ATOM 91 O GLY A 6 -9.812 -0.589 -6.590 1.00 0.00 O ATOM 0 H GLY A 6 -11.144 0.068 -4.734 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -12.027 -2.647 -5.433 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -12.630 -1.328 -6.417 1.00 0.00 H new ATOM 95 N LEU A 7 -10.178 -2.753 -7.137 1.00 0.00 N ATOM 96 CA LEU A 7 -8.956 -2.879 -7.912 1.00 0.00 C ATOM 97 C LEU A 7 -8.996 -4.184 -8.711 1.00 0.00 C ATOM 98 O LEU A 7 -9.976 -4.924 -8.647 1.00 0.00 O ATOM 99 CB LEU A 7 -7.730 -2.751 -7.006 1.00 0.00 C ATOM 100 CG LEU A 7 -7.749 -3.595 -5.729 1.00 0.00 C ATOM 101 CD1 LEU A 7 -6.341 -4.067 -5.363 1.00 0.00 C ATOM 102 CD2 LEU A 7 -8.416 -2.836 -4.580 1.00 0.00 C ATOM 0 H LEU A 7 -10.746 -3.599 -7.096 1.00 0.00 H new ATOM 0 HA LEU A 7 -8.877 -2.065 -8.633 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -6.846 -3.021 -7.584 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -7.619 -1.704 -6.724 1.00 0.00 H new ATOM 0 HG LEU A 7 -8.348 -4.486 -5.917 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -6.383 -4.664 -4.452 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -5.937 -4.671 -6.175 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -5.698 -3.202 -5.200 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -8.416 -3.458 -3.685 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -7.865 -1.917 -4.383 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -9.443 -2.592 -4.853 1.00 0.00 H new ATOM 114 N GLN A 8 -7.920 -4.425 -9.444 1.00 0.00 N ATOM 115 CA GLN A 8 -7.820 -5.627 -10.254 1.00 0.00 C ATOM 116 C GLN A 8 -7.576 -6.848 -9.364 1.00 0.00 C ATOM 117 O GLN A 8 -7.051 -6.720 -8.259 1.00 0.00 O ATOM 118 CB GLN A 8 -6.720 -5.488 -11.308 1.00 0.00 C ATOM 119 CG GLN A 8 -7.207 -4.669 -12.505 1.00 0.00 C ATOM 120 CD GLN A 8 -7.142 -3.170 -12.207 1.00 0.00 C ATOM 121 OE1 GLN A 8 -6.104 -2.621 -11.877 1.00 0.00 O ATOM 122 NE2 GLN A 8 -8.306 -2.541 -12.340 1.00 0.00 N ATOM 0 H GLN A 8 -7.109 -3.808 -9.494 1.00 0.00 H new ATOM 0 HA GLN A 8 -8.765 -5.768 -10.779 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -5.847 -5.008 -10.866 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -6.406 -6.476 -11.643 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -6.596 -4.896 -13.378 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -8.231 -4.951 -12.750 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -9.138 -3.061 -12.620 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -8.367 -1.538 -12.162 1.00 0.00 H new ATOM 131 N GLU A 9 -7.967 -8.004 -9.880 1.00 0.00 N ATOM 132 CA GLU A 9 -7.797 -9.246 -9.146 1.00 0.00 C ATOM 133 C GLU A 9 -6.315 -9.498 -8.865 1.00 0.00 C ATOM 134 O GLU A 9 -5.935 -9.791 -7.732 1.00 0.00 O ATOM 135 CB GLU A 9 -8.419 -10.421 -9.905 1.00 0.00 C ATOM 136 CG GLU A 9 -7.898 -11.756 -9.370 1.00 0.00 C ATOM 137 CD GLU A 9 -6.584 -12.145 -10.051 1.00 0.00 C ATOM 138 OE1 GLU A 9 -6.553 -12.086 -11.299 1.00 0.00 O ATOM 139 OE2 GLU A 9 -5.641 -12.493 -9.308 1.00 0.00 O ATOM 0 H GLU A 9 -8.401 -8.106 -10.797 1.00 0.00 H new ATOM 0 HA GLU A 9 -8.317 -9.156 -8.192 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -9.504 -10.386 -9.811 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -8.188 -10.336 -10.967 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -7.747 -11.686 -8.293 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -8.643 -12.534 -9.537 1.00 0.00 H new ATOM 146 N GLU A 10 -5.517 -9.376 -9.916 1.00 0.00 N ATOM 147 CA GLU A 10 -4.084 -9.587 -9.796 1.00 0.00 C ATOM 148 C GLU A 10 -3.504 -8.683 -8.706 1.00 0.00 C ATOM 149 O GLU A 10 -2.556 -9.063 -8.019 1.00 0.00 O ATOM 150 CB GLU A 10 -3.382 -9.351 -11.134 1.00 0.00 C ATOM 151 CG GLU A 10 -2.517 -10.554 -11.519 1.00 0.00 C ATOM 152 CD GLU A 10 -1.496 -10.174 -12.593 1.00 0.00 C ATOM 153 OE1 GLU A 10 -0.417 -9.679 -12.202 1.00 0.00 O ATOM 154 OE2 GLU A 10 -1.818 -10.387 -13.782 1.00 0.00 O ATOM 0 H GLU A 10 -5.835 -9.134 -10.854 1.00 0.00 H new ATOM 0 HA GLU A 10 -3.912 -10.625 -9.510 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -4.124 -9.169 -11.911 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.761 -8.457 -11.070 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -1.999 -10.931 -10.637 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -3.152 -11.361 -11.885 1.00 0.00 H new ATOM 161 N PHE A 11 -4.097 -7.505 -8.580 1.00 0.00 N ATOM 162 CA PHE A 11 -3.651 -6.545 -7.585 1.00 0.00 C ATOM 163 C PHE A 11 -4.106 -6.956 -6.184 1.00 0.00 C ATOM 164 O PHE A 11 -3.443 -6.644 -5.195 1.00 0.00 O ATOM 165 CB PHE A 11 -4.290 -5.201 -7.943 1.00 0.00 C ATOM 166 CG PHE A 11 -3.287 -4.056 -8.094 1.00 0.00 C ATOM 167 CD1 PHE A 11 -2.651 -3.861 -9.281 1.00 0.00 C ATOM 168 CD2 PHE A 11 -3.030 -3.233 -7.043 1.00 0.00 C ATOM 169 CE1 PHE A 11 -1.720 -2.798 -9.422 1.00 0.00 C ATOM 170 CE2 PHE A 11 -2.099 -2.170 -7.183 1.00 0.00 C ATOM 171 CZ PHE A 11 -1.464 -1.975 -8.370 1.00 0.00 C ATOM 0 H PHE A 11 -4.883 -7.194 -9.151 1.00 0.00 H new ATOM 0 HA PHE A 11 -2.562 -6.490 -7.582 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -4.844 -5.311 -8.875 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -5.013 -4.937 -7.172 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -2.854 -4.515 -10.116 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -3.534 -3.388 -6.101 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -1.215 -2.643 -10.364 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -1.895 -1.517 -6.347 1.00 0.00 H new ATOM 0 HZ PHE A 11 -0.756 -1.166 -8.477 1.00 0.00 H new ATOM 181 N LEU A 12 -5.234 -7.649 -6.142 1.00 0.00 N ATOM 182 CA LEU A 12 -5.786 -8.106 -4.878 1.00 0.00 C ATOM 183 C LEU A 12 -4.829 -9.119 -4.245 1.00 0.00 C ATOM 184 O LEU A 12 -4.487 -9.004 -3.069 1.00 0.00 O ATOM 185 CB LEU A 12 -7.205 -8.642 -5.075 1.00 0.00 C ATOM 186 CG LEU A 12 -8.321 -7.595 -5.091 1.00 0.00 C ATOM 187 CD1 LEU A 12 -9.597 -8.164 -5.715 1.00 0.00 C ATOM 188 CD2 LEU A 12 -8.569 -7.037 -3.689 1.00 0.00 C ATOM 0 H LEU A 12 -5.781 -7.905 -6.964 1.00 0.00 H new ATOM 0 HA LEU A 12 -5.878 -7.274 -4.180 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -7.237 -9.193 -6.015 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -7.416 -9.357 -4.280 1.00 0.00 H new ATOM 0 HG LEU A 12 -8.000 -6.762 -5.717 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -10.374 -7.400 -5.714 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -9.394 -8.474 -6.740 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -9.933 -9.024 -5.136 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -9.367 -6.295 -3.728 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -8.860 -7.848 -3.021 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -7.657 -6.570 -3.317 1.00 0.00 H new ATOM 200 N GLU A 13 -4.424 -10.087 -5.054 1.00 0.00 N ATOM 201 CA GLU A 13 -3.513 -11.119 -4.587 1.00 0.00 C ATOM 202 C GLU A 13 -2.185 -10.496 -4.149 1.00 0.00 C ATOM 203 O GLU A 13 -1.521 -11.011 -3.251 1.00 0.00 O ATOM 204 CB GLU A 13 -3.291 -12.182 -5.665 1.00 0.00 C ATOM 205 CG GLU A 13 -2.812 -13.497 -5.047 1.00 0.00 C ATOM 206 CD GLU A 13 -3.929 -14.542 -5.048 1.00 0.00 C ATOM 207 OE1 GLU A 13 -4.496 -14.766 -6.139 1.00 0.00 O ATOM 208 OE2 GLU A 13 -4.191 -15.094 -3.957 1.00 0.00 O ATOM 0 H GLU A 13 -4.709 -10.179 -6.029 1.00 0.00 H new ATOM 0 HA GLU A 13 -3.963 -11.611 -3.725 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -4.219 -12.350 -6.212 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -2.556 -11.826 -6.386 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -1.955 -13.875 -5.605 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -2.474 -13.321 -4.026 1.00 0.00 H new ATOM 215 N LEU A 14 -1.839 -9.398 -4.804 1.00 0.00 N ATOM 216 CA LEU A 14 -0.603 -8.700 -4.493 1.00 0.00 C ATOM 217 C LEU A 14 -0.620 -8.271 -3.024 1.00 0.00 C ATOM 218 O LEU A 14 0.408 -8.312 -2.350 1.00 0.00 O ATOM 219 CB LEU A 14 -0.381 -7.543 -5.469 1.00 0.00 C ATOM 220 CG LEU A 14 0.264 -7.908 -6.807 1.00 0.00 C ATOM 221 CD1 LEU A 14 0.717 -6.655 -7.558 1.00 0.00 C ATOM 222 CD2 LEU A 14 1.409 -8.904 -6.610 1.00 0.00 C ATOM 0 H LEU A 14 -2.393 -8.974 -5.549 1.00 0.00 H new ATOM 0 HA LEU A 14 0.252 -9.364 -4.622 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -1.344 -7.073 -5.669 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.243 -6.796 -4.979 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.487 -8.399 -7.425 1.00 0.00 H new ATOM 0 HD11 LEU A 14 1.172 -6.943 -8.506 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -0.144 -6.014 -7.749 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.446 -6.113 -6.955 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.850 -9.147 -7.577 1.00 0.00 H new ATOM 0 HD22 LEU A 14 2.169 -8.462 -5.965 1.00 0.00 H new ATOM 0 HD23 LEU A 14 1.025 -9.813 -6.148 1.00 0.00 H new ATOM 234 N ILE A 15 -1.799 -7.870 -2.572 1.00 0.00 N ATOM 235 CA ILE A 15 -1.963 -7.434 -1.195 1.00 0.00 C ATOM 236 C ILE A 15 -1.612 -8.588 -0.254 1.00 0.00 C ATOM 237 O ILE A 15 -0.910 -8.394 0.737 1.00 0.00 O ATOM 238 CB ILE A 15 -3.367 -6.867 -0.977 1.00 0.00 C ATOM 239 CG1 ILE A 15 -3.410 -5.371 -1.295 1.00 0.00 C ATOM 240 CG2 ILE A 15 -3.865 -7.166 0.439 1.00 0.00 C ATOM 241 CD1 ILE A 15 -3.472 -5.133 -2.805 1.00 0.00 C ATOM 0 H ILE A 15 -2.650 -7.838 -3.134 1.00 0.00 H new ATOM 0 HA ILE A 15 -1.276 -6.618 -0.969 1.00 0.00 H new ATOM 0 HB ILE A 15 -4.047 -7.363 -1.670 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.278 -4.919 -0.816 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -2.527 -4.882 -0.882 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -4.865 -6.752 0.568 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -3.896 -8.245 0.594 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -3.189 -6.714 1.165 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -3.502 -4.062 -3.004 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -2.590 -5.565 -3.278 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -4.368 -5.602 -3.211 1.00 0.00 H new ATOM 253 N LYS A 16 -2.117 -9.764 -0.597 1.00 0.00 N ATOM 254 CA LYS A 16 -1.866 -10.949 0.205 1.00 0.00 C ATOM 255 C LYS A 16 -0.383 -11.314 0.117 1.00 0.00 C ATOM 256 O LYS A 16 0.173 -11.898 1.046 1.00 0.00 O ATOM 257 CB LYS A 16 -2.804 -12.084 -0.209 1.00 0.00 C ATOM 258 CG LYS A 16 -3.658 -12.548 0.973 1.00 0.00 C ATOM 259 CD LYS A 16 -4.376 -13.860 0.649 1.00 0.00 C ATOM 260 CE LYS A 16 -5.527 -13.627 -0.332 1.00 0.00 C ATOM 261 NZ LYS A 16 -6.135 -14.916 -0.733 1.00 0.00 N ATOM 0 H LYS A 16 -2.699 -9.921 -1.420 1.00 0.00 H new ATOM 0 HA LYS A 16 -2.085 -10.752 1.255 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -3.451 -11.749 -1.020 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -2.221 -12.921 -0.592 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -3.027 -12.682 1.852 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -4.391 -11.780 1.221 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -3.668 -14.571 0.222 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -4.760 -14.305 1.567 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -6.282 -12.990 0.129 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -5.161 -13.101 -1.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -6.914 -14.740 -1.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -5.416 -15.511 -1.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -6.502 -15.403 0.109 1.00 0.00 H new ATOM 275 N LEU A 17 0.217 -10.954 -1.008 1.00 0.00 N ATOM 276 CA LEU A 17 1.625 -11.236 -1.229 1.00 0.00 C ATOM 277 C LEU A 17 2.471 -10.194 -0.496 1.00 0.00 C ATOM 278 O LEU A 17 3.416 -10.542 0.211 1.00 0.00 O ATOM 279 CB LEU A 17 1.925 -11.327 -2.727 1.00 0.00 C ATOM 280 CG LEU A 17 1.578 -12.657 -3.401 1.00 0.00 C ATOM 281 CD1 LEU A 17 0.952 -12.427 -4.778 1.00 0.00 C ATOM 282 CD2 LEU A 17 2.803 -13.570 -3.473 1.00 0.00 C ATOM 0 H LEU A 17 -0.247 -10.469 -1.777 1.00 0.00 H new ATOM 0 HA LEU A 17 1.887 -12.209 -0.815 1.00 0.00 H new ATOM 0 HB2 LEU A 17 1.380 -10.532 -3.235 1.00 0.00 H new ATOM 0 HB3 LEU A 17 2.987 -11.132 -2.877 1.00 0.00 H new ATOM 0 HG LEU A 17 0.832 -13.166 -2.790 1.00 0.00 H new ATOM 0 HD11 LEU A 17 0.715 -13.388 -5.235 1.00 0.00 H new ATOM 0 HD12 LEU A 17 0.039 -11.842 -4.669 1.00 0.00 H new ATOM 0 HD13 LEU A 17 1.656 -11.887 -5.412 1.00 0.00 H new ATOM 0 HD21 LEU A 17 2.530 -14.508 -3.956 1.00 0.00 H new ATOM 0 HD22 LEU A 17 3.588 -13.081 -4.049 1.00 0.00 H new ATOM 0 HD23 LEU A 17 3.165 -13.773 -2.465 1.00 0.00 H new ATOM 294 N ARG A 18 2.102 -8.936 -0.689 1.00 0.00 N ATOM 295 CA ARG A 18 2.815 -7.841 -0.054 1.00 0.00 C ATOM 296 C ARG A 18 2.408 -7.723 1.416 1.00 0.00 C ATOM 297 O ARG A 18 2.846 -6.810 2.114 1.00 0.00 O ATOM 298 CB ARG A 18 2.530 -6.514 -0.762 1.00 0.00 C ATOM 299 CG ARG A 18 1.035 -6.194 -0.745 1.00 0.00 C ATOM 300 CD ARG A 18 0.775 -4.823 -0.117 1.00 0.00 C ATOM 301 NE ARG A 18 1.481 -3.772 -0.883 1.00 0.00 N ATOM 302 CZ ARG A 18 1.094 -3.336 -2.090 1.00 0.00 C ATOM 303 NH1 ARG A 18 0.007 -3.856 -2.674 1.00 0.00 N ATOM 304 NH2 ARG A 18 1.796 -2.379 -2.712 1.00 0.00 N ATOM 0 H ARG A 18 1.318 -8.651 -1.276 1.00 0.00 H new ATOM 0 HA ARG A 18 3.881 -8.056 -0.123 1.00 0.00 H new ATOM 0 HB2 ARG A 18 3.083 -5.711 -0.274 1.00 0.00 H new ATOM 0 HB3 ARG A 18 2.883 -6.564 -1.792 1.00 0.00 H new ATOM 0 HG2 ARG A 18 0.644 -6.212 -1.762 1.00 0.00 H new ATOM 0 HG3 ARG A 18 0.501 -6.962 -0.185 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -0.295 -4.617 -0.103 1.00 0.00 H new ATOM 0 HD3 ARG A 18 1.114 -4.819 0.919 1.00 0.00 H new ATOM 0 HE ARG A 18 2.313 -3.354 -0.467 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -0.527 -4.584 -2.200 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -0.287 -3.524 -3.592 1.00 0.00 H new ATOM 0 HH21 ARG A 18 2.624 -1.983 -2.267 1.00 0.00 H new ATOM 0 HH22 ARG A 18 1.502 -2.047 -3.631 1.00 0.00 H new ATOM 318 N LYS A 19 1.575 -8.661 1.843 1.00 0.00 N ATOM 319 CA LYS A 19 1.104 -8.674 3.217 1.00 0.00 C ATOM 320 C LYS A 19 2.267 -9.026 4.147 1.00 0.00 C ATOM 321 O LYS A 19 2.308 -8.581 5.293 1.00 0.00 O ATOM 322 CB LYS A 19 -0.102 -9.605 3.362 1.00 0.00 C ATOM 323 CG LYS A 19 -0.065 -10.346 4.700 1.00 0.00 C ATOM 324 CD LYS A 19 -1.063 -11.506 4.711 1.00 0.00 C ATOM 325 CE LYS A 19 -0.404 -12.791 5.216 1.00 0.00 C ATOM 326 NZ LYS A 19 -0.270 -12.760 6.690 1.00 0.00 N ATOM 0 H LYS A 19 1.214 -9.417 1.261 1.00 0.00 H new ATOM 0 HA LYS A 19 0.751 -7.685 3.507 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -1.023 -9.027 3.288 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -0.111 -10.325 2.544 1.00 0.00 H new ATOM 0 HG2 LYS A 19 0.941 -10.725 4.883 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -0.297 -9.654 5.510 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -1.912 -11.254 5.347 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -1.454 -11.664 3.706 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -0.999 -13.654 4.917 1.00 0.00 H new ATOM 0 HE3 LYS A 19 0.578 -12.907 4.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 0.179 -13.639 7.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 0.317 -11.948 6.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -1.212 -12.671 7.122 1.00 0.00 H new ATOM 340 N LYS A 20 3.185 -9.823 3.619 1.00 0.00 N ATOM 341 CA LYS A 20 4.346 -10.240 4.387 1.00 0.00 C ATOM 342 C LYS A 20 5.433 -9.169 4.282 1.00 0.00 C ATOM 343 O LYS A 20 6.546 -9.358 4.771 1.00 0.00 O ATOM 344 CB LYS A 20 4.808 -11.631 3.948 1.00 0.00 C ATOM 345 CG LYS A 20 3.643 -12.623 3.956 1.00 0.00 C ATOM 346 CD LYS A 20 3.844 -13.713 2.901 1.00 0.00 C ATOM 347 CE LYS A 20 2.827 -13.571 1.767 1.00 0.00 C ATOM 348 NZ LYS A 20 2.683 -14.850 1.036 1.00 0.00 N ATOM 0 H LYS A 20 3.148 -10.191 2.668 1.00 0.00 H new ATOM 0 HA LYS A 20 4.091 -10.333 5.443 1.00 0.00 H new ATOM 0 HB2 LYS A 20 5.237 -11.577 2.948 1.00 0.00 H new ATOM 0 HB3 LYS A 20 5.595 -11.984 4.614 1.00 0.00 H new ATOM 0 HG2 LYS A 20 3.555 -13.078 4.942 1.00 0.00 H new ATOM 0 HG3 LYS A 20 2.709 -12.094 3.765 1.00 0.00 H new ATOM 0 HD2 LYS A 20 4.855 -13.652 2.498 1.00 0.00 H new ATOM 0 HD3 LYS A 20 3.744 -14.695 3.363 1.00 0.00 H new ATOM 0 HE2 LYS A 20 1.862 -13.266 2.172 1.00 0.00 H new ATOM 0 HE3 LYS A 20 3.146 -12.787 1.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 1.989 -14.736 0.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 3.602 -15.125 0.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 2.357 -15.589 1.691 1.00 0.00 H new ATOM 362 N LYS A 21 5.073 -8.067 3.640 1.00 0.00 N ATOM 363 CA LYS A 21 6.005 -6.966 3.464 1.00 0.00 C ATOM 364 C LYS A 21 5.368 -5.676 3.987 1.00 0.00 C ATOM 365 O LYS A 21 5.301 -5.458 5.195 1.00 0.00 O ATOM 366 CB LYS A 21 6.462 -6.878 2.006 1.00 0.00 C ATOM 367 CG LYS A 21 7.190 -8.156 1.583 1.00 0.00 C ATOM 368 CD LYS A 21 8.582 -8.229 2.213 1.00 0.00 C ATOM 369 CE LYS A 21 9.435 -9.304 1.537 1.00 0.00 C ATOM 370 NZ LYS A 21 10.619 -9.623 2.365 1.00 0.00 N ATOM 0 H LYS A 21 4.149 -7.913 3.236 1.00 0.00 H new ATOM 0 HA LYS A 21 6.910 -7.136 4.048 1.00 0.00 H new ATOM 0 HB2 LYS A 21 5.599 -6.715 1.360 1.00 0.00 H new ATOM 0 HB3 LYS A 21 7.122 -6.020 1.879 1.00 0.00 H new ATOM 0 HG2 LYS A 21 6.606 -9.027 1.881 1.00 0.00 H new ATOM 0 HG3 LYS A 21 7.277 -8.187 0.497 1.00 0.00 H new ATOM 0 HD2 LYS A 21 9.075 -7.261 2.126 1.00 0.00 H new ATOM 0 HD3 LYS A 21 8.492 -8.447 3.277 1.00 0.00 H new ATOM 0 HE2 LYS A 21 8.840 -10.204 1.381 1.00 0.00 H new ATOM 0 HE3 LYS A 21 9.754 -8.958 0.554 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 11.187 -10.354 1.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 11.195 -8.766 2.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 10.309 -9.973 3.294 1.00 0.00 H new ATOM 384 N ILE A 22 4.915 -4.856 3.050 1.00 0.00 N ATOM 385 CA ILE A 22 4.286 -3.594 3.401 1.00 0.00 C ATOM 386 C ILE A 22 3.516 -3.059 2.192 1.00 0.00 C ATOM 387 O ILE A 22 3.511 -3.680 1.130 1.00 0.00 O ATOM 388 CB ILE A 22 5.323 -2.613 3.952 1.00 0.00 C ATOM 389 CG1 ILE A 22 4.989 -2.212 5.390 1.00 0.00 C ATOM 390 CG2 ILE A 22 5.467 -1.396 3.036 1.00 0.00 C ATOM 391 CD1 ILE A 22 3.629 -1.514 5.463 1.00 0.00 C ATOM 0 H ILE A 22 4.971 -5.041 2.048 1.00 0.00 H new ATOM 0 HA ILE A 22 3.562 -3.740 4.202 1.00 0.00 H new ATOM 0 HB ILE A 22 6.290 -3.115 3.975 1.00 0.00 H new ATOM 0 HG12 ILE A 22 4.982 -3.097 6.026 1.00 0.00 H new ATOM 0 HG13 ILE A 22 5.763 -1.549 5.776 1.00 0.00 H new ATOM 0 HG21 ILE A 22 6.210 -0.715 3.450 1.00 0.00 H new ATOM 0 HG22 ILE A 22 5.786 -1.722 2.046 1.00 0.00 H new ATOM 0 HG23 ILE A 22 4.508 -0.884 2.958 1.00 0.00 H new ATOM 0 HD11 ILE A 22 3.416 -1.239 6.496 1.00 0.00 H new ATOM 0 HD12 ILE A 22 3.647 -0.616 4.845 1.00 0.00 H new ATOM 0 HD13 ILE A 22 2.854 -2.189 5.100 1.00 0.00 H new ATOM 403 N GLU A 23 2.882 -1.913 2.394 1.00 0.00 N ATOM 404 CA GLU A 23 2.110 -1.288 1.334 1.00 0.00 C ATOM 405 C GLU A 23 2.245 0.234 1.405 1.00 0.00 C ATOM 406 O GLU A 23 1.763 0.860 2.347 1.00 0.00 O ATOM 407 CB GLU A 23 0.641 -1.712 1.402 1.00 0.00 C ATOM 408 CG GLU A 23 -0.250 -0.722 0.649 1.00 0.00 C ATOM 409 CD GLU A 23 -1.629 -1.326 0.375 1.00 0.00 C ATOM 410 OE1 GLU A 23 -1.658 -2.455 -0.159 1.00 0.00 O ATOM 411 OE2 GLU A 23 -2.623 -0.644 0.706 1.00 0.00 O ATOM 0 H GLU A 23 2.887 -1.401 3.276 1.00 0.00 H new ATOM 0 HA GLU A 23 2.507 -1.624 0.376 1.00 0.00 H new ATOM 0 HB2 GLU A 23 0.526 -2.708 0.975 1.00 0.00 H new ATOM 0 HB3 GLU A 23 0.324 -1.773 2.443 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -0.359 0.192 1.233 1.00 0.00 H new ATOM 0 HG3 GLU A 23 0.223 -0.444 -0.293 1.00 0.00 H new ATOM 418 N GLY A 24 2.905 0.785 0.396 1.00 0.00 N ATOM 419 CA GLY A 24 3.110 2.222 0.333 1.00 0.00 C ATOM 420 C GLY A 24 1.865 2.931 -0.205 1.00 0.00 C ATOM 421 O GLY A 24 0.970 2.290 -0.754 1.00 0.00 O ATOM 0 H GLY A 24 3.304 0.262 -0.384 1.00 0.00 H new ATOM 0 HA2 GLY A 24 3.349 2.603 1.326 1.00 0.00 H new ATOM 0 HA3 GLY A 24 3.964 2.443 -0.307 1.00 0.00 H new ATOM 425 N ARG A 25 1.847 4.244 -0.028 1.00 0.00 N ATOM 426 CA ARG A 25 0.727 5.046 -0.489 1.00 0.00 C ATOM 427 C ARG A 25 0.841 6.475 0.047 1.00 0.00 C ATOM 428 O ARG A 25 0.677 6.707 1.243 1.00 0.00 O ATOM 429 CB ARG A 25 -0.605 4.444 -0.036 1.00 0.00 C ATOM 430 CG ARG A 25 -1.550 4.249 -1.224 1.00 0.00 C ATOM 431 CD ARG A 25 -1.844 2.765 -1.453 1.00 0.00 C ATOM 432 NE ARG A 25 -2.950 2.613 -2.425 1.00 0.00 N ATOM 433 CZ ARG A 25 -3.222 1.477 -3.082 1.00 0.00 C ATOM 434 NH1 ARG A 25 -2.469 0.388 -2.876 1.00 0.00 N ATOM 435 NH2 ARG A 25 -4.246 1.431 -3.945 1.00 0.00 N ATOM 0 H ARG A 25 2.591 4.772 0.429 1.00 0.00 H new ATOM 0 HA ARG A 25 0.755 5.059 -1.579 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -0.428 3.486 0.453 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -1.072 5.097 0.701 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -2.482 4.784 -1.043 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -1.105 4.678 -2.122 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -0.951 2.262 -1.824 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -2.110 2.288 -0.509 1.00 0.00 H new ATOM 0 HE ARG A 25 -3.542 3.424 -2.606 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -1.689 0.424 -2.219 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -2.676 -0.477 -3.376 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -4.818 2.261 -4.102 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -4.453 0.566 -4.445 1.00 0.00 H new ATOM 449 N LEU A 26 1.121 7.394 -0.865 1.00 0.00 N ATOM 450 CA LEU A 26 1.259 8.793 -0.500 1.00 0.00 C ATOM 451 C LEU A 26 0.210 9.146 0.556 1.00 0.00 C ATOM 452 O LEU A 26 -0.952 8.761 0.435 1.00 0.00 O ATOM 453 CB LEU A 26 1.201 9.681 -1.745 1.00 0.00 C ATOM 454 CG LEU A 26 0.187 10.825 -1.706 1.00 0.00 C ATOM 455 CD1 LEU A 26 0.697 11.981 -0.843 1.00 0.00 C ATOM 456 CD2 LEU A 26 -0.178 11.283 -3.119 1.00 0.00 C ATOM 0 H LEU A 26 1.256 7.197 -1.857 1.00 0.00 H new ATOM 0 HA LEU A 26 2.236 8.975 -0.053 1.00 0.00 H new ATOM 0 HB2 LEU A 26 2.191 10.105 -1.911 1.00 0.00 H new ATOM 0 HB3 LEU A 26 0.976 9.051 -2.606 1.00 0.00 H new ATOM 0 HG LEU A 26 -0.727 10.455 -1.241 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -0.043 12.781 -0.832 1.00 0.00 H new ATOM 0 HD12 LEU A 26 0.865 11.629 0.175 1.00 0.00 H new ATOM 0 HD13 LEU A 26 1.633 12.358 -1.256 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -0.901 12.097 -3.062 1.00 0.00 H new ATOM 0 HD22 LEU A 26 0.719 11.629 -3.632 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -0.613 10.450 -3.671 1.00 0.00 H new ATOM 468 N TYR A 27 0.657 9.874 1.569 1.00 0.00 N ATOM 469 CA TYR A 27 -0.229 10.283 2.645 1.00 0.00 C ATOM 470 C TYR A 27 -1.216 11.351 2.168 1.00 0.00 C ATOM 471 O TYR A 27 -0.963 12.545 2.317 1.00 0.00 O ATOM 472 CB TYR A 27 0.670 10.884 3.727 1.00 0.00 C ATOM 473 CG TYR A 27 0.067 10.841 5.132 1.00 0.00 C ATOM 474 CD1 TYR A 27 -0.615 9.719 5.557 1.00 0.00 C ATOM 475 CD2 TYR A 27 0.205 11.925 5.975 1.00 0.00 C ATOM 476 CE1 TYR A 27 -1.182 9.679 6.880 1.00 0.00 C ATOM 477 CE2 TYR A 27 -0.363 11.885 7.298 1.00 0.00 C ATOM 478 CZ TYR A 27 -1.028 10.764 7.685 1.00 0.00 C ATOM 479 OH TYR A 27 -1.564 10.727 8.934 1.00 0.00 O ATOM 0 H TYR A 27 1.622 10.191 1.667 1.00 0.00 H new ATOM 0 HA TYR A 27 -0.809 9.434 3.007 1.00 0.00 H new ATOM 0 HB2 TYR A 27 1.620 10.349 3.734 1.00 0.00 H new ATOM 0 HB3 TYR A 27 0.889 11.920 3.468 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -0.723 8.871 4.897 1.00 0.00 H new ATOM 0 HD2 TYR A 27 0.739 12.803 5.643 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -1.717 8.807 7.225 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -0.263 12.726 7.968 1.00 0.00 H new ATOM 0 HH TYR A 27 -1.375 11.570 9.396 1.00 0.00 H new ATOM 489 N ASP A 28 -2.319 10.882 1.604 1.00 0.00 N ATOM 490 CA ASP A 28 -3.345 11.781 1.104 1.00 0.00 C ATOM 491 C ASP A 28 -4.311 12.128 2.238 1.00 0.00 C ATOM 492 O ASP A 28 -4.009 11.896 3.408 1.00 0.00 O ATOM 493 CB ASP A 28 -4.151 11.128 -0.020 1.00 0.00 C ATOM 494 CG ASP A 28 -3.314 10.416 -1.086 1.00 0.00 C ATOM 495 OD1 ASP A 28 -2.972 9.238 -0.845 1.00 0.00 O ATOM 496 OD2 ASP A 28 -3.037 11.066 -2.117 1.00 0.00 O ATOM 0 H ASP A 28 -2.525 9.890 1.482 1.00 0.00 H new ATOM 0 HA ASP A 28 -2.851 12.674 0.721 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -4.841 10.408 0.419 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -4.756 11.894 -0.506 1.00 0.00 H new ATOM 501 N GLU A 29 -5.453 12.677 1.853 1.00 0.00 N ATOM 502 CA GLU A 29 -6.465 13.058 2.824 1.00 0.00 C ATOM 503 C GLU A 29 -7.151 11.813 3.391 1.00 0.00 C ATOM 504 O GLU A 29 -7.302 11.682 4.605 1.00 0.00 O ATOM 505 CB GLU A 29 -7.488 14.012 2.204 1.00 0.00 C ATOM 506 CG GLU A 29 -7.008 15.463 2.293 1.00 0.00 C ATOM 507 CD GLU A 29 -8.190 16.434 2.275 1.00 0.00 C ATOM 508 OE1 GLU A 29 -8.806 16.596 3.351 1.00 0.00 O ATOM 509 OE2 GLU A 29 -8.451 16.991 1.188 1.00 0.00 O ATOM 0 H GLU A 29 -5.700 12.867 0.882 1.00 0.00 H new ATOM 0 HA GLU A 29 -5.975 13.585 3.643 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -7.655 13.744 1.161 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -8.444 13.909 2.717 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -6.431 15.604 3.207 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -6.341 15.681 1.459 1.00 0.00 H new ATOM 516 N LYS A 30 -7.547 10.930 2.486 1.00 0.00 N ATOM 517 CA LYS A 30 -8.213 9.701 2.881 1.00 0.00 C ATOM 518 C LYS A 30 -7.227 8.814 3.643 1.00 0.00 C ATOM 519 O LYS A 30 -7.586 8.199 4.646 1.00 0.00 O ATOM 520 CB LYS A 30 -8.842 9.018 1.665 1.00 0.00 C ATOM 521 CG LYS A 30 -10.282 9.490 1.454 1.00 0.00 C ATOM 522 CD LYS A 30 -10.558 9.766 -0.025 1.00 0.00 C ATOM 523 CE LYS A 30 -11.510 10.951 -0.194 1.00 0.00 C ATOM 524 NZ LYS A 30 -12.790 10.507 -0.789 1.00 0.00 N ATOM 0 H LYS A 30 -7.419 11.042 1.480 1.00 0.00 H new ATOM 0 HA LYS A 30 -9.039 9.916 3.559 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -8.251 9.235 0.775 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -8.826 7.937 1.802 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -10.974 8.732 1.821 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -10.461 10.394 2.036 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -9.620 9.972 -0.541 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -10.989 8.879 -0.490 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -11.695 11.418 0.774 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -11.050 11.707 -0.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -13.425 11.324 -0.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -12.611 10.082 -1.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -13.236 9.802 -0.168 1.00 0.00 H new ATOM 538 N ARG A 31 -6.003 8.776 3.138 1.00 0.00 N ATOM 539 CA ARG A 31 -4.962 7.974 3.759 1.00 0.00 C ATOM 540 C ARG A 31 -4.758 8.403 5.213 1.00 0.00 C ATOM 541 O ARG A 31 -4.786 7.571 6.119 1.00 0.00 O ATOM 542 CB ARG A 31 -3.638 8.110 3.004 1.00 0.00 C ATOM 543 CG ARG A 31 -3.812 7.762 1.524 1.00 0.00 C ATOM 544 CD ARG A 31 -4.375 6.349 1.356 1.00 0.00 C ATOM 545 NE ARG A 31 -4.420 5.989 -0.079 1.00 0.00 N ATOM 546 CZ ARG A 31 -5.221 5.046 -0.592 1.00 0.00 C ATOM 547 NH1 ARG A 31 -6.050 4.362 0.209 1.00 0.00 N ATOM 548 NH2 ARG A 31 -5.194 4.787 -1.907 1.00 0.00 N ATOM 0 H ARG A 31 -5.708 9.287 2.306 1.00 0.00 H new ATOM 0 HA ARG A 31 -5.281 6.932 3.725 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -3.264 9.129 3.100 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -2.892 7.453 3.450 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -4.481 8.482 1.053 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -2.852 7.838 1.013 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -3.756 5.635 1.899 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -5.376 6.294 1.785 1.00 0.00 H new ATOM 0 HE ARG A 31 -3.802 6.490 -0.717 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -6.071 4.560 1.209 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -6.660 3.644 -0.182 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -4.564 5.308 -2.517 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -5.804 4.069 -2.298 1.00 0.00 H new ATOM 562 N ARG A 32 -4.557 9.701 5.392 1.00 0.00 N ATOM 563 CA ARG A 32 -4.349 10.250 6.721 1.00 0.00 C ATOM 564 C ARG A 32 -5.609 10.076 7.570 1.00 0.00 C ATOM 565 O ARG A 32 -5.537 10.056 8.798 1.00 0.00 O ATOM 566 CB ARG A 32 -3.988 11.735 6.653 1.00 0.00 C ATOM 567 CG ARG A 32 -5.175 12.565 6.157 1.00 0.00 C ATOM 568 CD ARG A 32 -4.957 14.053 6.437 1.00 0.00 C ATOM 569 NE ARG A 32 -5.023 14.309 7.893 1.00 0.00 N ATOM 570 CZ ARG A 32 -5.023 15.532 8.442 1.00 0.00 C ATOM 571 NH1 ARG A 32 -4.963 16.618 7.659 1.00 0.00 N ATOM 572 NH2 ARG A 32 -5.085 15.669 9.773 1.00 0.00 N ATOM 0 H ARG A 32 -4.534 10.388 4.638 1.00 0.00 H new ATOM 0 HA ARG A 32 -3.521 9.708 7.178 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -3.682 12.084 7.639 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -3.137 11.876 5.987 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -5.311 12.409 5.087 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -6.089 12.229 6.647 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -3.988 14.367 6.048 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -5.714 14.643 5.921 1.00 0.00 H new ATOM 0 HE ARG A 32 -5.072 13.504 8.518 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -4.917 16.514 6.645 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -4.963 17.549 8.077 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -5.132 14.843 10.369 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -5.085 16.600 10.190 1.00 0.00 H new ATOM 586 N GLN A 33 -6.736 9.955 6.883 1.00 0.00 N ATOM 587 CA GLN A 33 -8.010 9.784 7.560 1.00 0.00 C ATOM 588 C GLN A 33 -8.115 8.375 8.145 1.00 0.00 C ATOM 589 O GLN A 33 -8.729 8.178 9.193 1.00 0.00 O ATOM 590 CB GLN A 33 -9.176 10.073 6.612 1.00 0.00 C ATOM 591 CG GLN A 33 -9.899 11.362 7.009 1.00 0.00 C ATOM 592 CD GLN A 33 -10.928 11.098 8.110 1.00 0.00 C ATOM 593 OE1 GLN A 33 -10.736 11.433 9.268 1.00 0.00 O ATOM 594 NE2 GLN A 33 -12.027 10.480 7.687 1.00 0.00 N ATOM 0 H GLN A 33 -6.793 9.972 5.865 1.00 0.00 H new ATOM 0 HA GLN A 33 -8.064 10.501 8.379 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -8.806 10.159 5.590 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -9.877 9.239 6.628 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -9.173 12.099 7.354 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -10.396 11.788 6.137 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -12.124 10.228 6.703 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -12.773 10.259 8.346 1.00 0.00 H new ATOM 603 N ILE A 34 -7.507 7.430 7.444 1.00 0.00 N ATOM 604 CA ILE A 34 -7.524 6.045 7.881 1.00 0.00 C ATOM 605 C ILE A 34 -6.558 5.873 9.055 1.00 0.00 C ATOM 606 O ILE A 34 -5.534 6.549 9.125 1.00 0.00 O ATOM 607 CB ILE A 34 -7.237 5.108 6.706 1.00 0.00 C ATOM 608 CG1 ILE A 34 -8.338 5.201 5.648 1.00 0.00 C ATOM 609 CG2 ILE A 34 -7.025 3.672 7.188 1.00 0.00 C ATOM 610 CD1 ILE A 34 -7.963 4.409 4.394 1.00 0.00 C ATOM 0 H ILE A 34 -6.999 7.597 6.575 1.00 0.00 H new ATOM 0 HA ILE A 34 -8.516 5.772 8.241 1.00 0.00 H new ATOM 0 HB ILE A 34 -6.309 5.429 6.233 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -9.273 4.819 6.057 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -8.508 6.245 5.386 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -6.823 3.027 6.333 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -6.179 3.640 7.875 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -7.922 3.324 7.701 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -8.763 4.492 3.658 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -7.040 4.809 3.973 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -7.818 3.361 4.655 1.00 0.00 H new ATOM 622 N LYS A 35 -6.919 4.963 9.948 1.00 0.00 N ATOM 623 CA LYS A 35 -6.098 4.694 11.116 1.00 0.00 C ATOM 624 C LYS A 35 -5.981 3.181 11.314 1.00 0.00 C ATOM 625 O LYS A 35 -6.766 2.416 10.756 1.00 0.00 O ATOM 626 CB LYS A 35 -6.644 5.434 12.338 1.00 0.00 C ATOM 627 CG LYS A 35 -7.742 4.620 13.027 1.00 0.00 C ATOM 628 CD LYS A 35 -7.267 4.095 14.383 1.00 0.00 C ATOM 629 CE LYS A 35 -8.340 4.296 15.455 1.00 0.00 C ATOM 630 NZ LYS A 35 -9.521 3.450 15.171 1.00 0.00 N ATOM 0 H LYS A 35 -7.769 4.403 9.886 1.00 0.00 H new ATOM 0 HA LYS A 35 -5.088 5.076 10.967 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -5.835 5.628 13.042 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -7.041 6.402 12.034 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -8.628 5.240 13.163 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -8.033 3.784 12.391 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -7.023 3.036 14.302 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -6.353 4.611 14.677 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -7.934 4.047 16.435 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -8.636 5.344 15.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -10.204 3.534 15.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -9.967 3.763 14.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -9.223 2.458 15.077 1.00 0.00 H new ATOM 644 N PRO A 36 -4.969 2.785 12.132 1.00 0.00 N ATOM 645 CA PRO A 36 -4.740 1.377 12.411 1.00 0.00 C ATOM 646 C PRO A 36 -5.787 0.834 13.385 1.00 0.00 C ATOM 647 O PRO A 36 -5.544 0.768 14.590 1.00 0.00 O ATOM 648 CB PRO A 36 -3.325 1.311 12.961 1.00 0.00 C ATOM 649 CG PRO A 36 -2.983 2.724 13.405 1.00 0.00 C ATOM 650 CD PRO A 36 -4.020 3.663 12.810 1.00 0.00 C ATOM 0 HA PRO A 36 -4.838 0.750 11.525 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -3.263 0.614 13.796 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -2.627 0.961 12.201 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -2.985 2.793 14.493 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -1.983 2.998 13.070 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -4.510 4.253 13.584 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -3.564 4.366 12.113 1.00 0.00 H new ATOM 658 N GLY A 37 -6.929 0.458 12.828 1.00 0.00 N ATOM 659 CA GLY A 37 -8.013 -0.077 13.633 1.00 0.00 C ATOM 660 C GLY A 37 -9.316 -0.130 12.833 1.00 0.00 C ATOM 661 O GLY A 37 -10.346 0.369 13.282 1.00 0.00 O ATOM 0 H GLY A 37 -7.127 0.513 11.829 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -7.754 -1.077 13.979 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -8.152 0.541 14.520 1.00 0.00 H new ATOM 665 N ASP A 38 -9.228 -0.740 11.660 1.00 0.00 N ATOM 666 CA ASP A 38 -10.387 -0.865 10.792 1.00 0.00 C ATOM 667 C ASP A 38 -10.109 -1.928 9.728 1.00 0.00 C ATOM 668 O ASP A 38 -9.110 -2.642 9.803 1.00 0.00 O ATOM 669 CB ASP A 38 -10.684 0.454 10.077 1.00 0.00 C ATOM 670 CG ASP A 38 -11.974 1.150 10.513 1.00 0.00 C ATOM 671 OD1 ASP A 38 -13.042 0.523 10.346 1.00 0.00 O ATOM 672 OD2 ASP A 38 -11.864 2.295 11.004 1.00 0.00 O ATOM 0 H ASP A 38 -8.372 -1.153 11.290 1.00 0.00 H new ATOM 0 HA ASP A 38 -11.242 -1.141 11.409 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -9.849 1.135 10.241 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -10.736 0.265 9.005 1.00 0.00 H new ATOM 677 N VAL A 39 -11.012 -2.000 8.760 1.00 0.00 N ATOM 678 CA VAL A 39 -10.876 -2.964 7.681 1.00 0.00 C ATOM 679 C VAL A 39 -11.273 -2.303 6.359 1.00 0.00 C ATOM 680 O VAL A 39 -12.146 -1.438 6.331 1.00 0.00 O ATOM 681 CB VAL A 39 -11.698 -4.217 7.993 1.00 0.00 C ATOM 682 CG1 VAL A 39 -11.458 -5.305 6.944 1.00 0.00 C ATOM 683 CG2 VAL A 39 -11.395 -4.735 9.400 1.00 0.00 C ATOM 0 H VAL A 39 -11.840 -1.407 8.701 1.00 0.00 H new ATOM 0 HA VAL A 39 -9.839 -3.286 7.585 1.00 0.00 H new ATOM 0 HB VAL A 39 -12.753 -3.944 7.957 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -12.054 -6.184 7.189 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -11.747 -4.933 5.961 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -10.402 -5.574 6.934 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -11.992 -5.626 9.596 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -10.336 -4.984 9.476 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -11.640 -3.965 10.132 1.00 0.00 H new ATOM 693 N ILE A 40 -10.610 -2.736 5.296 1.00 0.00 N ATOM 694 CA ILE A 40 -10.882 -2.197 3.975 1.00 0.00 C ATOM 695 C ILE A 40 -11.278 -3.337 3.035 1.00 0.00 C ATOM 696 O ILE A 40 -10.433 -4.132 2.628 1.00 0.00 O ATOM 697 CB ILE A 40 -9.692 -1.374 3.476 1.00 0.00 C ATOM 698 CG1 ILE A 40 -9.062 -0.575 4.618 1.00 0.00 C ATOM 699 CG2 ILE A 40 -10.098 -0.478 2.305 1.00 0.00 C ATOM 700 CD1 ILE A 40 -7.655 -1.087 4.935 1.00 0.00 C ATOM 0 H ILE A 40 -9.886 -3.454 5.323 1.00 0.00 H new ATOM 0 HA ILE A 40 -11.725 -1.506 4.012 1.00 0.00 H new ATOM 0 HB ILE A 40 -8.931 -2.062 3.106 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -9.016 0.480 4.347 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -9.688 -0.649 5.507 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -9.234 0.096 1.970 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -10.464 -1.095 1.485 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -10.885 0.205 2.625 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -7.230 -0.502 5.750 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -7.707 -2.135 5.229 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -7.025 -0.989 4.051 1.00 0.00 H new ATOM 712 N SER A 41 -12.564 -3.381 2.719 1.00 0.00 N ATOM 713 CA SER A 41 -13.082 -4.411 1.834 1.00 0.00 C ATOM 714 C SER A 41 -12.855 -4.011 0.375 1.00 0.00 C ATOM 715 O SER A 41 -13.299 -2.948 -0.057 1.00 0.00 O ATOM 716 CB SER A 41 -14.570 -4.660 2.091 1.00 0.00 C ATOM 717 OG SER A 41 -15.363 -3.517 1.782 1.00 0.00 O ATOM 0 H SER A 41 -13.262 -2.720 3.060 1.00 0.00 H new ATOM 0 HA SER A 41 -12.545 -5.338 2.037 1.00 0.00 H new ATOM 0 HB2 SER A 41 -14.905 -5.507 1.492 1.00 0.00 H new ATOM 0 HB3 SER A 41 -14.717 -4.932 3.136 1.00 0.00 H new ATOM 0 HG SER A 41 -15.709 -3.125 2.611 1.00 0.00 H new ATOM 723 N PHE A 42 -12.165 -4.884 -0.344 1.00 0.00 N ATOM 724 CA PHE A 42 -11.873 -4.635 -1.745 1.00 0.00 C ATOM 725 C PHE A 42 -12.881 -5.348 -2.650 1.00 0.00 C ATOM 726 O PHE A 42 -13.402 -6.404 -2.293 1.00 0.00 O ATOM 727 CB PHE A 42 -10.476 -5.195 -2.018 1.00 0.00 C ATOM 728 CG PHE A 42 -9.339 -4.294 -1.532 1.00 0.00 C ATOM 729 CD1 PHE A 42 -9.279 -2.996 -1.937 1.00 0.00 C ATOM 730 CD2 PHE A 42 -8.387 -4.789 -0.696 1.00 0.00 C ATOM 731 CE1 PHE A 42 -8.224 -2.160 -1.486 1.00 0.00 C ATOM 732 CE2 PHE A 42 -7.332 -3.953 -0.246 1.00 0.00 C ATOM 733 CZ PHE A 42 -7.273 -2.656 -0.650 1.00 0.00 C ATOM 0 H PHE A 42 -11.800 -5.765 0.018 1.00 0.00 H new ATOM 0 HA PHE A 42 -11.930 -3.566 -1.952 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -10.385 -6.169 -1.536 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -10.364 -5.358 -3.090 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -10.034 -2.602 -2.601 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -8.434 -5.819 -0.374 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -8.177 -1.130 -1.807 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -6.576 -4.347 0.417 1.00 0.00 H new ATOM 0 HZ PHE A 42 -6.471 -2.020 -0.307 1.00 0.00 H new ATOM 743 N GLU A 43 -13.124 -4.743 -3.803 1.00 0.00 N ATOM 744 CA GLU A 43 -14.060 -5.306 -4.761 1.00 0.00 C ATOM 745 C GLU A 43 -15.290 -5.860 -4.039 1.00 0.00 C ATOM 746 O GLU A 43 -15.777 -6.939 -4.373 1.00 0.00 O ATOM 747 CB GLU A 43 -13.390 -6.388 -5.611 1.00 0.00 C ATOM 748 CG GLU A 43 -12.285 -5.792 -6.485 1.00 0.00 C ATOM 749 CD GLU A 43 -12.055 -6.643 -7.735 1.00 0.00 C ATOM 750 OE1 GLU A 43 -11.861 -7.865 -7.562 1.00 0.00 O ATOM 751 OE2 GLU A 43 -12.079 -6.052 -8.837 1.00 0.00 O ATOM 0 H GLU A 43 -12.689 -3.868 -4.096 1.00 0.00 H new ATOM 0 HA GLU A 43 -14.384 -4.511 -5.433 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -12.971 -7.157 -4.963 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -14.135 -6.874 -6.241 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -12.555 -4.777 -6.777 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -11.360 -5.724 -5.912 1.00 0.00 H new ATOM 758 N GLY A 44 -15.757 -5.096 -3.062 1.00 0.00 N ATOM 759 CA GLY A 44 -16.921 -5.497 -2.291 1.00 0.00 C ATOM 760 C GLY A 44 -16.506 -6.236 -1.017 1.00 0.00 C ATOM 761 O GLY A 44 -16.780 -5.774 0.090 1.00 0.00 O ATOM 0 H GLY A 44 -15.350 -4.202 -2.787 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -17.510 -4.617 -2.030 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -17.559 -6.140 -2.897 1.00 0.00 H new ATOM 765 N GLY A 45 -15.853 -7.371 -1.215 1.00 0.00 N ATOM 766 CA GLY A 45 -15.397 -8.178 -0.096 1.00 0.00 C ATOM 767 C GLY A 45 -14.531 -9.344 -0.578 1.00 0.00 C ATOM 768 O GLY A 45 -14.499 -10.400 0.052 1.00 0.00 O ATOM 0 H GLY A 45 -15.628 -7.751 -2.134 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -14.826 -7.558 0.595 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -16.256 -8.562 0.454 1.00 0.00 H new ATOM 772 N LYS A 46 -13.850 -9.113 -1.690 1.00 0.00 N ATOM 773 CA LYS A 46 -12.986 -10.131 -2.263 1.00 0.00 C ATOM 774 C LYS A 46 -11.689 -10.208 -1.454 1.00 0.00 C ATOM 775 O LYS A 46 -11.175 -11.297 -1.201 1.00 0.00 O ATOM 776 CB LYS A 46 -12.765 -9.869 -3.755 1.00 0.00 C ATOM 777 CG LYS A 46 -12.567 -11.180 -4.518 1.00 0.00 C ATOM 778 CD LYS A 46 -11.203 -11.212 -5.210 1.00 0.00 C ATOM 779 CE LYS A 46 -11.311 -11.824 -6.608 1.00 0.00 C ATOM 780 NZ LYS A 46 -11.957 -13.154 -6.543 1.00 0.00 N ATOM 0 H LYS A 46 -13.879 -8.236 -2.210 1.00 0.00 H new ATOM 0 HA LYS A 46 -13.460 -11.111 -2.201 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -13.620 -9.332 -4.164 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -11.892 -9.230 -3.890 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -12.649 -12.021 -3.830 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -13.358 -11.296 -5.259 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -10.804 -10.200 -5.282 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -10.500 -11.790 -4.610 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -11.888 -11.164 -7.257 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -10.318 -11.916 -7.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -11.700 -13.706 -7.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -11.636 -13.655 -5.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -12.990 -13.037 -6.508 1.00 0.00 H new ATOM 794 N LEU A 47 -11.198 -9.039 -1.071 1.00 0.00 N ATOM 795 CA LEU A 47 -9.972 -8.961 -0.296 1.00 0.00 C ATOM 796 C LEU A 47 -10.151 -7.942 0.832 1.00 0.00 C ATOM 797 O LEU A 47 -10.339 -6.754 0.575 1.00 0.00 O ATOM 798 CB LEU A 47 -8.779 -8.665 -1.208 1.00 0.00 C ATOM 799 CG LEU A 47 -7.460 -9.339 -0.826 1.00 0.00 C ATOM 800 CD1 LEU A 47 -6.775 -8.593 0.321 1.00 0.00 C ATOM 801 CD2 LEU A 47 -7.674 -10.819 -0.500 1.00 0.00 C ATOM 0 H LEU A 47 -11.627 -8.138 -1.283 1.00 0.00 H new ATOM 0 HA LEU A 47 -9.756 -9.921 0.172 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -9.038 -8.968 -2.222 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -8.621 -7.587 -1.228 1.00 0.00 H new ATOM 0 HG LEU A 47 -6.791 -9.292 -1.686 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -5.840 -9.093 0.573 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -6.568 -7.567 0.015 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -7.429 -8.587 1.193 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -6.721 -11.274 -0.232 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -8.368 -10.911 0.336 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -8.086 -11.328 -1.371 1.00 0.00 H new ATOM 813 N LYS A 48 -10.085 -8.444 2.056 1.00 0.00 N ATOM 814 CA LYS A 48 -10.237 -7.593 3.223 1.00 0.00 C ATOM 815 C LYS A 48 -8.881 -7.432 3.913 1.00 0.00 C ATOM 816 O LYS A 48 -8.132 -8.399 4.050 1.00 0.00 O ATOM 817 CB LYS A 48 -11.334 -8.135 4.143 1.00 0.00 C ATOM 818 CG LYS A 48 -12.711 -8.005 3.489 1.00 0.00 C ATOM 819 CD LYS A 48 -13.075 -9.276 2.720 1.00 0.00 C ATOM 820 CE LYS A 48 -14.559 -9.611 2.887 1.00 0.00 C ATOM 821 NZ LYS A 48 -14.742 -11.066 3.086 1.00 0.00 N ATOM 0 H LYS A 48 -9.928 -9.430 2.265 1.00 0.00 H new ATOM 0 HA LYS A 48 -10.565 -6.597 2.926 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -11.135 -9.181 4.375 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -11.323 -7.591 5.088 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -13.463 -7.810 4.253 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -12.716 -7.151 2.811 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -12.845 -9.144 1.663 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -12.468 -10.108 3.077 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -14.967 -9.067 3.739 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -15.113 -9.286 2.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -15.754 -11.277 3.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -14.371 -11.579 2.261 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -14.230 -11.367 3.940 1.00 0.00 H new ATOM 835 N VAL A 49 -8.605 -6.205 4.328 1.00 0.00 N ATOM 836 CA VAL A 49 -7.352 -5.905 4.999 1.00 0.00 C ATOM 837 C VAL A 49 -7.625 -4.990 6.195 1.00 0.00 C ATOM 838 O VAL A 49 -8.509 -4.137 6.139 1.00 0.00 O ATOM 839 CB VAL A 49 -6.355 -5.307 4.004 1.00 0.00 C ATOM 840 CG1 VAL A 49 -6.297 -6.137 2.720 1.00 0.00 C ATOM 841 CG2 VAL A 49 -6.695 -3.847 3.699 1.00 0.00 C ATOM 0 H VAL A 49 -9.228 -5.406 4.212 1.00 0.00 H new ATOM 0 HA VAL A 49 -6.898 -6.818 5.385 1.00 0.00 H new ATOM 0 HB VAL A 49 -5.367 -5.332 4.463 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -5.581 -5.690 2.030 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -5.986 -7.154 2.958 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -7.283 -6.159 2.256 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -5.971 -3.445 2.990 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -7.695 -3.788 3.270 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -6.661 -3.265 4.620 1.00 0.00 H new ATOM 851 N ARG A 50 -6.849 -5.200 7.249 1.00 0.00 N ATOM 852 CA ARG A 50 -6.997 -4.405 8.456 1.00 0.00 C ATOM 853 C ARG A 50 -5.684 -3.692 8.785 1.00 0.00 C ATOM 854 O ARG A 50 -4.650 -4.335 8.958 1.00 0.00 O ATOM 855 CB ARG A 50 -7.406 -5.278 9.644 1.00 0.00 C ATOM 856 CG ARG A 50 -7.114 -4.572 10.969 1.00 0.00 C ATOM 857 CD ARG A 50 -8.172 -4.917 12.019 1.00 0.00 C ATOM 858 NE ARG A 50 -7.519 -5.411 13.253 1.00 0.00 N ATOM 859 CZ ARG A 50 -8.149 -5.570 14.424 1.00 0.00 C ATOM 860 NH1 ARG A 50 -9.452 -5.275 14.529 1.00 0.00 N ATOM 861 NH2 ARG A 50 -7.477 -6.023 15.491 1.00 0.00 N ATOM 0 H ARG A 50 -6.117 -5.909 7.292 1.00 0.00 H new ATOM 0 HA ARG A 50 -7.780 -3.669 8.274 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -8.469 -5.512 9.579 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -6.868 -6.225 9.606 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -6.128 -4.864 11.331 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -7.090 -3.494 10.813 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -8.774 -4.036 12.244 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -8.850 -5.675 11.628 1.00 0.00 H new ATOM 0 HE ARG A 50 -6.527 -5.645 13.208 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -9.964 -4.929 13.717 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -9.932 -5.396 15.421 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -6.485 -6.247 15.412 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -7.957 -6.144 16.383 1.00 0.00 H new ATOM 875 N VAL A 51 -5.767 -2.371 8.862 1.00 0.00 N ATOM 876 CA VAL A 51 -4.599 -1.564 9.167 1.00 0.00 C ATOM 877 C VAL A 51 -4.011 -2.012 10.507 1.00 0.00 C ATOM 878 O VAL A 51 -4.746 -2.397 11.414 1.00 0.00 O ATOM 879 CB VAL A 51 -4.967 -0.079 9.142 1.00 0.00 C ATOM 880 CG1 VAL A 51 -3.741 0.795 9.410 1.00 0.00 C ATOM 881 CG2 VAL A 51 -5.631 0.299 7.817 1.00 0.00 C ATOM 0 H VAL A 51 -6.626 -1.840 8.718 1.00 0.00 H new ATOM 0 HA VAL A 51 -3.828 -1.706 8.410 1.00 0.00 H new ATOM 0 HB VAL A 51 -5.687 0.101 9.941 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -4.031 1.845 9.386 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -3.330 0.554 10.390 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -2.987 0.609 8.645 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -5.882 1.360 7.826 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -4.945 0.095 6.995 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.540 -0.288 7.685 1.00 0.00 H new ATOM 891 N LYS A 52 -2.690 -1.946 10.588 1.00 0.00 N ATOM 892 CA LYS A 52 -1.995 -2.340 11.802 1.00 0.00 C ATOM 893 C LYS A 52 -1.339 -1.109 12.431 1.00 0.00 C ATOM 894 O LYS A 52 -1.390 -0.928 13.647 1.00 0.00 O ATOM 895 CB LYS A 52 -1.014 -3.478 11.512 1.00 0.00 C ATOM 896 CG LYS A 52 -1.679 -4.841 11.721 1.00 0.00 C ATOM 897 CD LYS A 52 -1.526 -5.309 13.169 1.00 0.00 C ATOM 898 CE LYS A 52 -0.050 -5.474 13.539 1.00 0.00 C ATOM 899 NZ LYS A 52 0.238 -6.878 13.908 1.00 0.00 N ATOM 0 H LYS A 52 -2.083 -1.626 9.833 1.00 0.00 H new ATOM 0 HA LYS A 52 -2.700 -2.735 12.533 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -0.652 -3.399 10.487 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -0.145 -3.389 12.164 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -2.737 -4.777 11.466 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.233 -5.574 11.049 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -1.994 -4.588 13.839 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -2.047 -6.257 13.306 1.00 0.00 H new ATOM 0 HE2 LYS A 52 0.577 -5.177 12.698 1.00 0.00 H new ATOM 0 HE3 LYS A 52 0.198 -4.815 14.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 1.244 -6.972 14.156 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -0.347 -7.150 14.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 0.020 -7.500 13.104 1.00 0.00 H new ATOM 913 N ALA A 53 -0.739 -0.295 11.576 1.00 0.00 N ATOM 914 CA ALA A 53 -0.074 0.914 12.033 1.00 0.00 C ATOM 915 C ALA A 53 0.295 1.776 10.824 1.00 0.00 C ATOM 916 O ALA A 53 0.374 1.277 9.702 1.00 0.00 O ATOM 917 CB ALA A 53 1.146 0.538 12.875 1.00 0.00 C ATOM 0 H ALA A 53 -0.699 -0.449 10.568 1.00 0.00 H new ATOM 0 HA ALA A 53 -0.739 1.502 12.666 1.00 0.00 H new ATOM 0 HB1 ALA A 53 1.645 1.444 13.218 1.00 0.00 H new ATOM 0 HB2 ALA A 53 0.827 -0.048 13.737 1.00 0.00 H new ATOM 0 HB3 ALA A 53 1.837 -0.050 12.272 1.00 0.00 H new ATOM 923 N ILE A 54 0.511 3.055 11.093 1.00 0.00 N ATOM 924 CA ILE A 54 0.870 3.991 10.042 1.00 0.00 C ATOM 925 C ILE A 54 2.317 4.446 10.242 1.00 0.00 C ATOM 926 O ILE A 54 2.794 4.530 11.373 1.00 0.00 O ATOM 927 CB ILE A 54 -0.134 5.143 9.984 1.00 0.00 C ATOM 928 CG1 ILE A 54 -0.170 5.770 8.589 1.00 0.00 C ATOM 929 CG2 ILE A 54 0.158 6.180 11.071 1.00 0.00 C ATOM 930 CD1 ILE A 54 -1.579 5.705 7.995 1.00 0.00 C ATOM 0 H ILE A 54 0.444 3.465 12.025 1.00 0.00 H new ATOM 0 HA ILE A 54 0.820 3.506 9.067 1.00 0.00 H new ATOM 0 HB ILE A 54 -1.127 4.740 10.181 1.00 0.00 H new ATOM 0 HG12 ILE A 54 0.158 6.808 8.644 1.00 0.00 H new ATOM 0 HG13 ILE A 54 0.529 5.250 7.934 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -0.570 6.988 11.008 1.00 0.00 H new ATOM 0 HG22 ILE A 54 0.092 5.708 12.051 1.00 0.00 H new ATOM 0 HG23 ILE A 54 1.161 6.583 10.929 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -1.577 6.157 7.003 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -1.894 4.664 7.919 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -2.271 6.247 8.640 1.00 0.00 H new ATOM 942 N ARG A 55 2.975 4.727 9.127 1.00 0.00 N ATOM 943 CA ARG A 55 4.358 5.172 9.166 1.00 0.00 C ATOM 944 C ARG A 55 4.642 6.126 8.004 1.00 0.00 C ATOM 945 O ARG A 55 4.608 5.723 6.843 1.00 0.00 O ATOM 946 CB ARG A 55 5.321 3.985 9.088 1.00 0.00 C ATOM 947 CG ARG A 55 5.545 3.369 10.471 1.00 0.00 C ATOM 948 CD ARG A 55 6.986 3.583 10.939 1.00 0.00 C ATOM 949 NE ARG A 55 7.257 2.757 12.137 1.00 0.00 N ATOM 950 CZ ARG A 55 8.480 2.537 12.637 1.00 0.00 C ATOM 951 NH1 ARG A 55 9.553 3.081 12.046 1.00 0.00 N ATOM 952 NH2 ARG A 55 8.631 1.774 13.728 1.00 0.00 N ATOM 0 H ARG A 55 2.576 4.655 8.191 1.00 0.00 H new ATOM 0 HA ARG A 55 4.513 5.690 10.112 1.00 0.00 H new ATOM 0 HB2 ARG A 55 4.920 3.231 8.411 1.00 0.00 H new ATOM 0 HB3 ARG A 55 6.274 4.312 8.673 1.00 0.00 H new ATOM 0 HG2 ARG A 55 4.856 3.815 11.188 1.00 0.00 H new ATOM 0 HG3 ARG A 55 5.324 2.302 10.438 1.00 0.00 H new ATOM 0 HD2 ARG A 55 7.679 3.319 10.141 1.00 0.00 H new ATOM 0 HD3 ARG A 55 7.150 4.636 11.168 1.00 0.00 H new ATOM 0 HE ARG A 55 6.462 2.328 12.612 1.00 0.00 H new ATOM 0 HH11 ARG A 55 9.438 3.662 11.216 1.00 0.00 H new ATOM 0 HH12 ARG A 55 10.484 2.914 12.427 1.00 0.00 H new ATOM 0 HH21 ARG A 55 7.814 1.360 14.178 1.00 0.00 H new ATOM 0 HH22 ARG A 55 9.563 1.607 14.108 1.00 0.00 H new ATOM 966 N VAL A 56 4.915 7.373 8.358 1.00 0.00 N ATOM 967 CA VAL A 56 5.205 8.388 7.360 1.00 0.00 C ATOM 968 C VAL A 56 6.720 8.506 7.182 1.00 0.00 C ATOM 969 O VAL A 56 7.476 8.329 8.137 1.00 0.00 O ATOM 970 CB VAL A 56 4.545 9.712 7.752 1.00 0.00 C ATOM 971 CG1 VAL A 56 4.591 10.712 6.595 1.00 0.00 C ATOM 972 CG2 VAL A 56 3.107 9.488 8.226 1.00 0.00 C ATOM 0 H VAL A 56 4.941 7.704 9.323 1.00 0.00 H new ATOM 0 HA VAL A 56 4.786 8.104 6.395 1.00 0.00 H new ATOM 0 HB VAL A 56 5.110 10.135 8.583 1.00 0.00 H new ATOM 0 HG11 VAL A 56 4.115 11.644 6.900 1.00 0.00 H new ATOM 0 HG12 VAL A 56 5.628 10.906 6.323 1.00 0.00 H new ATOM 0 HG13 VAL A 56 4.062 10.299 5.736 1.00 0.00 H new ATOM 0 HG21 VAL A 56 2.661 10.444 8.499 1.00 0.00 H new ATOM 0 HG22 VAL A 56 2.526 9.032 7.424 1.00 0.00 H new ATOM 0 HG23 VAL A 56 3.108 8.828 9.093 1.00 0.00 H new ATOM 982 N TYR A 57 7.119 8.803 5.954 1.00 0.00 N ATOM 983 CA TYR A 57 8.530 8.946 5.640 1.00 0.00 C ATOM 984 C TYR A 57 8.795 10.254 4.892 1.00 0.00 C ATOM 985 O TYR A 57 7.879 11.045 4.673 1.00 0.00 O ATOM 986 CB TYR A 57 8.879 7.770 4.725 1.00 0.00 C ATOM 987 CG TYR A 57 9.129 6.457 5.469 1.00 0.00 C ATOM 988 CD1 TYR A 57 8.063 5.715 5.936 1.00 0.00 C ATOM 989 CD2 TYR A 57 10.420 6.013 5.672 1.00 0.00 C ATOM 990 CE1 TYR A 57 8.298 4.478 6.636 1.00 0.00 C ATOM 991 CE2 TYR A 57 10.655 4.777 6.371 1.00 0.00 C ATOM 992 CZ TYR A 57 9.582 4.070 6.819 1.00 0.00 C ATOM 993 OH TYR A 57 9.804 2.902 7.480 1.00 0.00 O ATOM 0 H TYR A 57 6.489 8.949 5.165 1.00 0.00 H new ATOM 0 HA TYR A 57 9.127 8.958 6.552 1.00 0.00 H new ATOM 0 HB2 TYR A 57 8.067 7.623 4.013 1.00 0.00 H new ATOM 0 HB3 TYR A 57 9.768 8.024 4.147 1.00 0.00 H new ATOM 0 HD1 TYR A 57 7.053 6.062 5.777 1.00 0.00 H new ATOM 0 HD2 TYR A 57 11.254 6.593 5.306 1.00 0.00 H new ATOM 0 HE1 TYR A 57 7.473 3.888 7.007 1.00 0.00 H new ATOM 0 HE2 TYR A 57 11.660 4.419 6.536 1.00 0.00 H new ATOM 0 HH TYR A 57 10.768 2.736 7.536 1.00 0.00 H new ATOM 1003 N ASN A 58 10.053 10.442 4.521 1.00 0.00 N ATOM 1004 CA ASN A 58 10.451 11.641 3.803 1.00 0.00 C ATOM 1005 C ASN A 58 9.993 11.533 2.347 1.00 0.00 C ATOM 1006 O ASN A 58 9.427 12.478 1.799 1.00 0.00 O ATOM 1007 CB ASN A 58 11.971 11.808 3.809 1.00 0.00 C ATOM 1008 CG ASN A 58 12.381 13.079 4.556 1.00 0.00 C ATOM 1009 OD1 ASN A 58 12.346 14.178 4.028 1.00 0.00 O ATOM 1010 ND2 ASN A 58 12.768 12.868 5.810 1.00 0.00 N ATOM 0 H ASN A 58 10.810 9.784 4.704 1.00 0.00 H new ATOM 0 HA ASN A 58 9.993 12.498 4.297 1.00 0.00 H new ATOM 0 HB2 ASN A 58 12.434 10.940 4.279 1.00 0.00 H new ATOM 0 HB3 ASN A 58 12.340 11.849 2.784 1.00 0.00 H new ATOM 0 HD21 ASN A 58 13.060 13.653 6.393 1.00 0.00 H new ATOM 0 HD22 ASN A 58 12.773 11.921 6.190 1.00 0.00 H new ATOM 1017 N SER A 59 10.254 10.374 1.762 1.00 0.00 N ATOM 1018 CA SER A 59 9.876 10.130 0.380 1.00 0.00 C ATOM 1019 C SER A 59 9.751 8.626 0.129 1.00 0.00 C ATOM 1020 O SER A 59 10.180 7.818 0.951 1.00 0.00 O ATOM 1021 CB SER A 59 10.889 10.748 -0.585 1.00 0.00 C ATOM 1022 OG SER A 59 10.443 10.689 -1.937 1.00 0.00 O ATOM 0 H SER A 59 10.723 9.593 2.220 1.00 0.00 H new ATOM 0 HA SER A 59 8.910 10.602 0.201 1.00 0.00 H new ATOM 0 HB2 SER A 59 11.067 11.787 -0.307 1.00 0.00 H new ATOM 0 HB3 SER A 59 11.841 10.226 -0.494 1.00 0.00 H new ATOM 0 HG SER A 59 11.117 11.095 -2.522 1.00 0.00 H new ATOM 1028 N PHE A 60 9.162 8.296 -1.011 1.00 0.00 N ATOM 1029 CA PHE A 60 8.976 6.903 -1.381 1.00 0.00 C ATOM 1030 C PHE A 60 10.319 6.176 -1.473 1.00 0.00 C ATOM 1031 O PHE A 60 10.427 5.014 -1.084 1.00 0.00 O ATOM 1032 CB PHE A 60 8.308 6.892 -2.757 1.00 0.00 C ATOM 1033 CG PHE A 60 6.863 6.387 -2.744 1.00 0.00 C ATOM 1034 CD1 PHE A 60 6.584 5.137 -2.287 1.00 0.00 C ATOM 1035 CD2 PHE A 60 5.859 7.188 -3.188 1.00 0.00 C ATOM 1036 CE1 PHE A 60 5.244 4.668 -2.274 1.00 0.00 C ATOM 1037 CE2 PHE A 60 4.518 6.720 -3.176 1.00 0.00 C ATOM 1038 CZ PHE A 60 4.239 5.470 -2.719 1.00 0.00 C ATOM 0 H PHE A 60 8.807 8.969 -1.691 1.00 0.00 H new ATOM 0 HA PHE A 60 8.370 6.396 -0.630 1.00 0.00 H new ATOM 0 HB2 PHE A 60 8.325 7.902 -3.166 1.00 0.00 H new ATOM 0 HB3 PHE A 60 8.895 6.266 -3.429 1.00 0.00 H new ATOM 0 HD1 PHE A 60 7.382 4.501 -1.934 1.00 0.00 H new ATOM 0 HD2 PHE A 60 6.081 8.181 -3.550 1.00 0.00 H new ATOM 0 HE1 PHE A 60 5.023 3.675 -1.911 1.00 0.00 H new ATOM 0 HE2 PHE A 60 3.720 7.357 -3.530 1.00 0.00 H new ATOM 0 HZ PHE A 60 3.219 5.114 -2.709 1.00 0.00 H new ATOM 1048 N ARG A 61 11.308 6.890 -1.990 1.00 0.00 N ATOM 1049 CA ARG A 61 12.639 6.327 -2.138 1.00 0.00 C ATOM 1050 C ARG A 61 13.159 5.831 -0.787 1.00 0.00 C ATOM 1051 O ARG A 61 13.835 4.806 -0.717 1.00 0.00 O ATOM 1052 CB ARG A 61 13.615 7.361 -2.703 1.00 0.00 C ATOM 1053 CG ARG A 61 14.679 6.692 -3.576 1.00 0.00 C ATOM 1054 CD ARG A 61 16.085 7.121 -3.152 1.00 0.00 C ATOM 1055 NE ARG A 61 16.541 8.255 -3.986 1.00 0.00 N ATOM 1056 CZ ARG A 61 17.508 9.110 -3.628 1.00 0.00 C ATOM 1057 NH1 ARG A 61 18.128 8.965 -2.449 1.00 0.00 N ATOM 1058 NH2 ARG A 61 17.856 10.110 -4.449 1.00 0.00 N ATOM 0 H ARG A 61 11.214 7.853 -2.312 1.00 0.00 H new ATOM 0 HA ARG A 61 12.569 5.491 -2.834 1.00 0.00 H new ATOM 0 HB2 ARG A 61 13.069 8.099 -3.291 1.00 0.00 H new ATOM 0 HB3 ARG A 61 14.096 7.898 -1.885 1.00 0.00 H new ATOM 0 HG2 ARG A 61 14.587 5.608 -3.501 1.00 0.00 H new ATOM 0 HG3 ARG A 61 14.515 6.954 -4.621 1.00 0.00 H new ATOM 0 HD2 ARG A 61 16.085 7.409 -2.101 1.00 0.00 H new ATOM 0 HD3 ARG A 61 16.776 6.284 -3.253 1.00 0.00 H new ATOM 0 HE ARG A 61 16.091 8.394 -4.890 1.00 0.00 H new ATOM 0 HH11 ARG A 61 17.864 8.203 -1.824 1.00 0.00 H new ATOM 0 HH12 ARG A 61 18.864 9.616 -2.177 1.00 0.00 H new ATOM 0 HH21 ARG A 61 17.385 10.220 -5.347 1.00 0.00 H new ATOM 0 HH22 ARG A 61 18.592 10.761 -4.176 1.00 0.00 H new ATOM 1072 N GLU A 62 12.823 6.581 0.252 1.00 0.00 N ATOM 1073 CA GLU A 62 13.247 6.230 1.597 1.00 0.00 C ATOM 1074 C GLU A 62 12.463 5.017 2.101 1.00 0.00 C ATOM 1075 O GLU A 62 13.016 4.157 2.785 1.00 0.00 O ATOM 1076 CB GLU A 62 13.091 7.418 2.548 1.00 0.00 C ATOM 1077 CG GLU A 62 14.410 8.179 2.696 1.00 0.00 C ATOM 1078 CD GLU A 62 14.526 8.811 4.084 1.00 0.00 C ATOM 1079 OE1 GLU A 62 13.488 8.848 4.780 1.00 0.00 O ATOM 1080 OE2 GLU A 62 15.650 9.244 4.419 1.00 0.00 O ATOM 0 H GLU A 62 12.262 7.431 0.190 1.00 0.00 H new ATOM 0 HA GLU A 62 14.304 5.967 1.567 1.00 0.00 H new ATOM 0 HB2 GLU A 62 12.319 8.090 2.172 1.00 0.00 H new ATOM 0 HB3 GLU A 62 12.759 7.066 3.524 1.00 0.00 H new ATOM 0 HG2 GLU A 62 15.246 7.500 2.531 1.00 0.00 H new ATOM 0 HG3 GLU A 62 14.474 8.955 1.933 1.00 0.00 H new ATOM 1087 N MET A 63 11.188 4.986 1.744 1.00 0.00 N ATOM 1088 CA MET A 63 10.322 3.893 2.152 1.00 0.00 C ATOM 1089 C MET A 63 10.774 2.573 1.525 1.00 0.00 C ATOM 1090 O MET A 63 10.921 1.569 2.221 1.00 0.00 O ATOM 1091 CB MET A 63 8.884 4.194 1.726 1.00 0.00 C ATOM 1092 CG MET A 63 8.011 4.524 2.939 1.00 0.00 C ATOM 1093 SD MET A 63 6.351 4.914 2.409 1.00 0.00 S ATOM 1094 CE MET A 63 6.091 3.608 1.220 1.00 0.00 C ATOM 0 H MET A 63 10.733 5.701 1.176 1.00 0.00 H new ATOM 0 HA MET A 63 10.376 3.797 3.236 1.00 0.00 H new ATOM 0 HB2 MET A 63 8.875 5.031 1.028 1.00 0.00 H new ATOM 0 HB3 MET A 63 8.470 3.335 1.198 1.00 0.00 H new ATOM 0 HG2 MET A 63 7.993 3.677 3.625 1.00 0.00 H new ATOM 0 HG3 MET A 63 8.435 5.367 3.484 1.00 0.00 H new ATOM 0 HE1 MET A 63 5.031 3.546 0.974 1.00 0.00 H new ATOM 0 HE2 MET A 63 6.662 3.820 0.316 1.00 0.00 H new ATOM 0 HE3 MET A 63 6.421 2.659 1.643 1.00 0.00 H new ATOM 1104 N LEU A 64 10.983 2.616 0.217 1.00 0.00 N ATOM 1105 CA LEU A 64 11.415 1.436 -0.511 1.00 0.00 C ATOM 1106 C LEU A 64 12.821 1.045 -0.052 1.00 0.00 C ATOM 1107 O LEU A 64 13.183 -0.130 -0.078 1.00 0.00 O ATOM 1108 CB LEU A 64 11.302 1.666 -2.020 1.00 0.00 C ATOM 1109 CG LEU A 64 9.927 2.099 -2.531 1.00 0.00 C ATOM 1110 CD1 LEU A 64 10.002 2.553 -3.990 1.00 0.00 C ATOM 1111 CD2 LEU A 64 8.892 0.990 -2.329 1.00 0.00 C ATOM 0 H LEU A 64 10.861 3.450 -0.357 1.00 0.00 H new ATOM 0 HA LEU A 64 10.761 0.592 -0.291 1.00 0.00 H new ATOM 0 HB2 LEU A 64 12.030 2.425 -2.307 1.00 0.00 H new ATOM 0 HB3 LEU A 64 11.584 0.745 -2.530 1.00 0.00 H new ATOM 0 HG LEU A 64 9.599 2.956 -1.943 1.00 0.00 H new ATOM 0 HD11 LEU A 64 9.011 2.855 -4.328 1.00 0.00 H new ATOM 0 HD12 LEU A 64 10.687 3.397 -4.074 1.00 0.00 H new ATOM 0 HD13 LEU A 64 10.361 1.731 -4.609 1.00 0.00 H new ATOM 0 HD21 LEU A 64 7.923 1.324 -2.701 1.00 0.00 H new ATOM 0 HD22 LEU A 64 9.202 0.099 -2.875 1.00 0.00 H new ATOM 0 HD23 LEU A 64 8.812 0.756 -1.267 1.00 0.00 H new ATOM 1123 N GLU A 65 13.577 2.054 0.357 1.00 0.00 N ATOM 1124 CA GLU A 65 14.936 1.831 0.821 1.00 0.00 C ATOM 1125 C GLU A 65 14.924 1.234 2.230 1.00 0.00 C ATOM 1126 O GLU A 65 15.672 0.302 2.520 1.00 0.00 O ATOM 1127 CB GLU A 65 15.748 3.126 0.781 1.00 0.00 C ATOM 1128 CG GLU A 65 16.088 3.516 -0.659 1.00 0.00 C ATOM 1129 CD GLU A 65 17.449 2.952 -1.074 1.00 0.00 C ATOM 1130 OE1 GLU A 65 17.724 1.794 -0.691 1.00 0.00 O ATOM 1131 OE2 GLU A 65 18.183 3.692 -1.763 1.00 0.00 O ATOM 0 H GLU A 65 13.274 3.028 0.377 1.00 0.00 H new ATOM 0 HA GLU A 65 15.417 1.119 0.150 1.00 0.00 H new ATOM 0 HB2 GLU A 65 15.183 3.929 1.255 1.00 0.00 H new ATOM 0 HB3 GLU A 65 16.667 3.001 1.354 1.00 0.00 H new ATOM 0 HG2 GLU A 65 15.316 3.144 -1.332 1.00 0.00 H new ATOM 0 HG3 GLU A 65 16.097 4.602 -0.753 1.00 0.00 H new ATOM 1138 N LYS A 66 14.067 1.797 3.069 1.00 0.00 N ATOM 1139 CA LYS A 66 13.948 1.332 4.441 1.00 0.00 C ATOM 1140 C LYS A 66 13.040 0.101 4.481 1.00 0.00 C ATOM 1141 O LYS A 66 13.491 -0.997 4.802 1.00 0.00 O ATOM 1142 CB LYS A 66 13.483 2.469 5.353 1.00 0.00 C ATOM 1143 CG LYS A 66 14.440 2.652 6.533 1.00 0.00 C ATOM 1144 CD LYS A 66 15.333 3.878 6.331 1.00 0.00 C ATOM 1145 CE LYS A 66 14.820 5.069 7.142 1.00 0.00 C ATOM 1146 NZ LYS A 66 15.663 5.281 8.340 1.00 0.00 N ATOM 0 H LYS A 66 13.448 2.571 2.826 1.00 0.00 H new ATOM 0 HA LYS A 66 14.921 1.024 4.825 1.00 0.00 H new ATOM 0 HB2 LYS A 66 13.422 3.396 4.782 1.00 0.00 H new ATOM 0 HB3 LYS A 66 12.480 2.256 5.723 1.00 0.00 H new ATOM 0 HG2 LYS A 66 13.869 2.762 7.455 1.00 0.00 H new ATOM 0 HG3 LYS A 66 15.059 1.762 6.645 1.00 0.00 H new ATOM 0 HD2 LYS A 66 16.354 3.642 6.631 1.00 0.00 H new ATOM 0 HD3 LYS A 66 15.364 4.140 5.273 1.00 0.00 H new ATOM 0 HE2 LYS A 66 14.824 5.967 6.524 1.00 0.00 H new ATOM 0 HE3 LYS A 66 13.787 4.894 7.443 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 15.301 6.093 8.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 15.638 4.430 8.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 16.643 5.469 8.046 1.00 0.00 H new ATOM 1160 N GLU A 67 11.777 0.326 4.151 1.00 0.00 N ATOM 1161 CA GLU A 67 10.802 -0.751 4.145 1.00 0.00 C ATOM 1162 C GLU A 67 11.221 -1.842 3.158 1.00 0.00 C ATOM 1163 O GLU A 67 11.305 -3.014 3.521 1.00 0.00 O ATOM 1164 CB GLU A 67 9.404 -0.223 3.817 1.00 0.00 C ATOM 1165 CG GLU A 67 8.997 0.890 4.784 1.00 0.00 C ATOM 1166 CD GLU A 67 8.454 0.310 6.092 1.00 0.00 C ATOM 1167 OE1 GLU A 67 9.148 -0.563 6.657 1.00 0.00 O ATOM 1168 OE2 GLU A 67 7.357 0.752 6.497 1.00 0.00 O ATOM 0 H GLU A 67 11.406 1.238 3.886 1.00 0.00 H new ATOM 0 HA GLU A 67 10.765 -1.187 5.143 1.00 0.00 H new ATOM 0 HB2 GLU A 67 9.384 0.154 2.794 1.00 0.00 H new ATOM 0 HB3 GLU A 67 8.682 -1.038 3.870 1.00 0.00 H new ATOM 0 HG2 GLU A 67 9.857 1.527 4.994 1.00 0.00 H new ATOM 0 HG3 GLU A 67 8.239 1.521 4.320 1.00 0.00 H new ATOM 1175 N GLY A 68 11.475 -1.417 1.929 1.00 0.00 N ATOM 1176 CA GLY A 68 11.884 -2.343 0.886 1.00 0.00 C ATOM 1177 C GLY A 68 11.032 -2.164 -0.372 1.00 0.00 C ATOM 1178 O GLY A 68 9.805 -2.234 -0.310 1.00 0.00 O ATOM 0 H GLY A 68 11.406 -0.444 1.632 1.00 0.00 H new ATOM 0 HA2 GLY A 68 12.935 -2.182 0.644 1.00 0.00 H new ATOM 0 HA3 GLY A 68 11.793 -3.367 1.248 1.00 0.00 H new ATOM 1182 N LEU A 69 11.716 -1.936 -1.484 1.00 0.00 N ATOM 1183 CA LEU A 69 11.037 -1.746 -2.754 1.00 0.00 C ATOM 1184 C LEU A 69 10.095 -2.925 -3.005 1.00 0.00 C ATOM 1185 O LEU A 69 8.885 -2.743 -3.125 1.00 0.00 O ATOM 1186 CB LEU A 69 12.053 -1.521 -3.876 1.00 0.00 C ATOM 1187 CG LEU A 69 11.536 -1.730 -5.301 1.00 0.00 C ATOM 1188 CD1 LEU A 69 10.532 -0.641 -5.685 1.00 0.00 C ATOM 1189 CD2 LEU A 69 12.694 -1.818 -6.296 1.00 0.00 C ATOM 0 H LEU A 69 12.733 -1.879 -1.531 1.00 0.00 H new ATOM 0 HA LEU A 69 10.422 -0.846 -2.727 1.00 0.00 H new ATOM 0 HB2 LEU A 69 12.435 -0.503 -3.795 1.00 0.00 H new ATOM 0 HB3 LEU A 69 12.897 -2.192 -3.715 1.00 0.00 H new ATOM 0 HG LEU A 69 11.007 -2.683 -5.337 1.00 0.00 H new ATOM 0 HD11 LEU A 69 10.180 -0.813 -6.702 1.00 0.00 H new ATOM 0 HD12 LEU A 69 9.686 -0.668 -4.999 1.00 0.00 H new ATOM 0 HD13 LEU A 69 11.014 0.335 -5.628 1.00 0.00 H new ATOM 0 HD21 LEU A 69 12.300 -1.967 -7.301 1.00 0.00 H new ATOM 0 HD22 LEU A 69 13.271 -0.894 -6.266 1.00 0.00 H new ATOM 0 HD23 LEU A 69 13.338 -2.657 -6.031 1.00 0.00 H new ATOM 1201 N GLU A 70 10.687 -4.109 -3.078 1.00 0.00 N ATOM 1202 CA GLU A 70 9.915 -5.318 -3.313 1.00 0.00 C ATOM 1203 C GLU A 70 9.034 -5.629 -2.102 1.00 0.00 C ATOM 1204 O GLU A 70 8.179 -6.511 -2.162 1.00 0.00 O ATOM 1205 CB GLU A 70 10.832 -6.498 -3.642 1.00 0.00 C ATOM 1206 CG GLU A 70 10.964 -6.685 -5.155 1.00 0.00 C ATOM 1207 CD GLU A 70 11.834 -7.900 -5.483 1.00 0.00 C ATOM 1208 OE1 GLU A 70 12.934 -7.985 -4.896 1.00 0.00 O ATOM 1209 OE2 GLU A 70 11.379 -8.716 -6.314 1.00 0.00 O ATOM 0 H GLU A 70 11.691 -4.257 -2.979 1.00 0.00 H new ATOM 0 HA GLU A 70 9.268 -5.151 -4.174 1.00 0.00 H new ATOM 0 HB2 GLU A 70 11.817 -6.331 -3.205 1.00 0.00 H new ATOM 0 HB3 GLU A 70 10.435 -7.408 -3.193 1.00 0.00 H new ATOM 0 HG2 GLU A 70 9.976 -6.811 -5.597 1.00 0.00 H new ATOM 0 HG3 GLU A 70 11.400 -5.790 -5.599 1.00 0.00 H new ATOM 1216 N ASN A 71 9.273 -4.888 -1.030 1.00 0.00 N ATOM 1217 CA ASN A 71 8.512 -5.074 0.194 1.00 0.00 C ATOM 1218 C ASN A 71 7.350 -4.079 0.222 1.00 0.00 C ATOM 1219 O ASN A 71 6.602 -4.021 1.197 1.00 0.00 O ATOM 1220 CB ASN A 71 9.381 -4.820 1.427 1.00 0.00 C ATOM 1221 CG ASN A 71 10.672 -5.639 1.366 1.00 0.00 C ATOM 1222 OD1 ASN A 71 11.084 -6.119 0.323 1.00 0.00 O ATOM 1223 ND2 ASN A 71 11.285 -5.770 2.539 1.00 0.00 N ATOM 0 H ASN A 71 9.983 -4.157 -0.984 1.00 0.00 H new ATOM 0 HA ASN A 71 8.150 -6.102 0.214 1.00 0.00 H new ATOM 0 HB2 ASN A 71 9.622 -3.759 1.494 1.00 0.00 H new ATOM 0 HB3 ASN A 71 8.825 -5.078 2.328 1.00 0.00 H new ATOM 0 HD21 ASN A 71 12.155 -6.298 2.604 1.00 0.00 H new ATOM 0 HD22 ASN A 71 10.885 -5.342 3.374 1.00 0.00 H new ATOM 1230 N VAL A 72 7.234 -3.322 -0.859 1.00 0.00 N ATOM 1231 CA VAL A 72 6.175 -2.333 -0.970 1.00 0.00 C ATOM 1232 C VAL A 72 5.539 -2.428 -2.359 1.00 0.00 C ATOM 1233 O VAL A 72 4.315 -2.437 -2.485 1.00 0.00 O ATOM 1234 CB VAL A 72 6.726 -0.940 -0.659 1.00 0.00 C ATOM 1235 CG1 VAL A 72 5.612 0.109 -0.692 1.00 0.00 C ATOM 1236 CG2 VAL A 72 7.452 -0.926 0.687 1.00 0.00 C ATOM 0 H VAL A 72 7.856 -3.373 -1.666 1.00 0.00 H new ATOM 0 HA VAL A 72 5.391 -2.529 -0.239 1.00 0.00 H new ATOM 0 HB VAL A 72 7.450 -0.685 -1.433 1.00 0.00 H new ATOM 0 HG11 VAL A 72 6.030 1.090 -0.468 1.00 0.00 H new ATOM 0 HG12 VAL A 72 5.157 0.126 -1.683 1.00 0.00 H new ATOM 0 HG13 VAL A 72 4.854 -0.141 0.051 1.00 0.00 H new ATOM 0 HG21 VAL A 72 7.834 0.076 0.884 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.758 -1.212 1.478 1.00 0.00 H new ATOM 0 HG23 VAL A 72 8.282 -1.632 0.660 1.00 0.00 H new ATOM 1246 N LEU A 73 6.398 -2.497 -3.365 1.00 0.00 N ATOM 1247 CA LEU A 73 5.935 -2.591 -4.739 1.00 0.00 C ATOM 1248 C LEU A 73 6.495 -3.864 -5.375 1.00 0.00 C ATOM 1249 O LEU A 73 7.597 -3.857 -5.921 1.00 0.00 O ATOM 1250 CB LEU A 73 6.280 -1.315 -5.509 1.00 0.00 C ATOM 1251 CG LEU A 73 5.451 -1.045 -6.767 1.00 0.00 C ATOM 1252 CD1 LEU A 73 4.150 -0.319 -6.420 1.00 0.00 C ATOM 1253 CD2 LEU A 73 6.271 -0.284 -7.811 1.00 0.00 C ATOM 0 H LEU A 73 7.412 -2.490 -3.256 1.00 0.00 H new ATOM 0 HA LEU A 73 4.848 -2.670 -4.771 1.00 0.00 H new ATOM 0 HB2 LEU A 73 6.167 -0.466 -4.835 1.00 0.00 H new ATOM 0 HB3 LEU A 73 7.331 -1.359 -5.793 1.00 0.00 H new ATOM 0 HG LEU A 73 5.178 -2.003 -7.208 1.00 0.00 H new ATOM 0 HD11 LEU A 73 3.580 -0.139 -7.331 1.00 0.00 H new ATOM 0 HD12 LEU A 73 3.561 -0.933 -5.739 1.00 0.00 H new ATOM 0 HD13 LEU A 73 4.381 0.633 -5.943 1.00 0.00 H new ATOM 0 HD21 LEU A 73 5.659 -0.105 -8.695 1.00 0.00 H new ATOM 0 HD22 LEU A 73 6.595 0.670 -7.395 1.00 0.00 H new ATOM 0 HD23 LEU A 73 7.145 -0.874 -8.088 1.00 0.00 H new ATOM 1265 N PRO A 74 5.689 -4.956 -5.282 1.00 0.00 N ATOM 1266 CA PRO A 74 6.093 -6.234 -5.842 1.00 0.00 C ATOM 1267 C PRO A 74 5.967 -6.229 -7.367 1.00 0.00 C ATOM 1268 O PRO A 74 4.893 -5.963 -7.904 1.00 0.00 O ATOM 1269 CB PRO A 74 5.190 -7.259 -5.175 1.00 0.00 C ATOM 1270 CG PRO A 74 4.011 -6.477 -4.620 1.00 0.00 C ATOM 1271 CD PRO A 74 4.377 -5.002 -4.642 1.00 0.00 C ATOM 0 HA PRO A 74 7.142 -6.463 -5.653 1.00 0.00 H new ATOM 0 HB2 PRO A 74 4.858 -8.011 -5.891 1.00 0.00 H new ATOM 0 HB3 PRO A 74 5.718 -7.786 -4.380 1.00 0.00 H new ATOM 0 HG2 PRO A 74 3.118 -6.657 -5.218 1.00 0.00 H new ATOM 0 HG3 PRO A 74 3.784 -6.799 -3.604 1.00 0.00 H new ATOM 0 HD2 PRO A 74 3.643 -4.420 -5.200 1.00 0.00 H new ATOM 0 HD3 PRO A 74 4.413 -4.588 -3.634 1.00 0.00 H new ATOM 1279 N GLY A 75 7.080 -6.528 -8.022 1.00 0.00 N ATOM 1280 CA GLY A 75 7.107 -6.561 -9.474 1.00 0.00 C ATOM 1281 C GLY A 75 7.911 -5.386 -10.034 1.00 0.00 C ATOM 1282 O GLY A 75 8.467 -5.475 -11.128 1.00 0.00 O ATOM 0 H GLY A 75 7.969 -6.749 -7.574 1.00 0.00 H new ATOM 0 HA2 GLY A 75 7.545 -7.500 -9.812 1.00 0.00 H new ATOM 0 HA3 GLY A 75 6.089 -6.527 -9.861 1.00 0.00 H new ATOM 1286 N VAL A 76 7.947 -4.312 -9.259 1.00 0.00 N ATOM 1287 CA VAL A 76 8.674 -3.121 -9.664 1.00 0.00 C ATOM 1288 C VAL A 76 9.983 -3.532 -10.341 1.00 0.00 C ATOM 1289 O VAL A 76 10.523 -4.601 -10.057 1.00 0.00 O ATOM 1290 CB VAL A 76 8.887 -2.203 -8.459 1.00 0.00 C ATOM 1291 CG1 VAL A 76 9.723 -2.897 -7.382 1.00 0.00 C ATOM 1292 CG2 VAL A 76 9.528 -0.880 -8.884 1.00 0.00 C ATOM 0 H VAL A 76 7.484 -4.242 -8.353 1.00 0.00 H new ATOM 0 HA VAL A 76 8.097 -2.551 -10.392 1.00 0.00 H new ATOM 0 HB VAL A 76 7.910 -1.979 -8.031 1.00 0.00 H new ATOM 0 HG11 VAL A 76 9.860 -2.223 -6.537 1.00 0.00 H new ATOM 0 HG12 VAL A 76 9.210 -3.799 -7.048 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.696 -3.165 -7.793 1.00 0.00 H new ATOM 0 HG21 VAL A 76 9.668 -0.246 -8.009 1.00 0.00 H new ATOM 0 HG22 VAL A 76 10.494 -1.077 -9.348 1.00 0.00 H new ATOM 0 HG23 VAL A 76 8.878 -0.374 -9.598 1.00 0.00 H new ATOM 1302 N LYS A 77 10.455 -2.663 -11.222 1.00 0.00 N ATOM 1303 CA LYS A 77 11.690 -2.923 -11.941 1.00 0.00 C ATOM 1304 C LYS A 77 12.876 -2.458 -11.094 1.00 0.00 C ATOM 1305 O LYS A 77 13.925 -3.100 -11.082 1.00 0.00 O ATOM 1306 CB LYS A 77 11.643 -2.291 -13.334 1.00 0.00 C ATOM 1307 CG LYS A 77 10.615 -2.995 -14.221 1.00 0.00 C ATOM 1308 CD LYS A 77 11.082 -3.031 -15.678 1.00 0.00 C ATOM 1309 CE LYS A 77 10.661 -1.762 -16.421 1.00 0.00 C ATOM 1310 NZ LYS A 77 11.123 -1.806 -17.826 1.00 0.00 N ATOM 0 H LYS A 77 10.004 -1.778 -11.454 1.00 0.00 H new ATOM 0 HA LYS A 77 11.816 -3.993 -12.106 1.00 0.00 H new ATOM 0 HB2 LYS A 77 11.392 -1.234 -13.249 1.00 0.00 H new ATOM 0 HB3 LYS A 77 12.628 -2.349 -13.797 1.00 0.00 H new ATOM 0 HG2 LYS A 77 10.454 -4.011 -13.862 1.00 0.00 H new ATOM 0 HG3 LYS A 77 9.657 -2.478 -14.155 1.00 0.00 H new ATOM 0 HD2 LYS A 77 12.167 -3.134 -15.713 1.00 0.00 H new ATOM 0 HD3 LYS A 77 10.662 -3.905 -16.177 1.00 0.00 H new ATOM 0 HE2 LYS A 77 9.576 -1.660 -16.392 1.00 0.00 H new ATOM 0 HE3 LYS A 77 11.077 -0.887 -15.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 10.829 -0.937 -18.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 12.160 -1.882 -17.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 10.705 -2.630 -18.303 1.00 0.00 H new ATOM 1324 N SER A 78 12.670 -1.344 -10.406 1.00 0.00 N ATOM 1325 CA SER A 78 13.709 -0.785 -9.558 1.00 0.00 C ATOM 1326 C SER A 78 13.127 0.322 -8.678 1.00 0.00 C ATOM 1327 O SER A 78 11.980 0.728 -8.862 1.00 0.00 O ATOM 1328 CB SER A 78 14.870 -0.243 -10.395 1.00 0.00 C ATOM 1329 OG SER A 78 15.994 0.099 -9.589 1.00 0.00 O ATOM 0 H SER A 78 11.799 -0.814 -10.419 1.00 0.00 H new ATOM 0 HA SER A 78 14.096 -1.581 -8.921 1.00 0.00 H new ATOM 0 HB2 SER A 78 15.166 -0.990 -11.132 1.00 0.00 H new ATOM 0 HB3 SER A 78 14.539 0.636 -10.948 1.00 0.00 H new ATOM 0 HG SER A 78 16.714 0.439 -10.160 1.00 0.00 H new ATOM 1335 N ILE A 79 13.943 0.781 -7.741 1.00 0.00 N ATOM 1336 CA ILE A 79 13.523 1.833 -6.832 1.00 0.00 C ATOM 1337 C ILE A 79 13.123 3.069 -7.639 1.00 0.00 C ATOM 1338 O ILE A 79 12.155 3.750 -7.301 1.00 0.00 O ATOM 1339 CB ILE A 79 14.610 2.106 -5.789 1.00 0.00 C ATOM 1340 CG1 ILE A 79 14.894 0.855 -4.954 1.00 0.00 C ATOM 1341 CG2 ILE A 79 14.242 3.307 -4.915 1.00 0.00 C ATOM 1342 CD1 ILE A 79 15.940 1.143 -3.875 1.00 0.00 C ATOM 0 H ILE A 79 14.894 0.443 -7.592 1.00 0.00 H new ATOM 0 HA ILE A 79 12.644 1.520 -6.269 1.00 0.00 H new ATOM 0 HB ILE A 79 15.531 2.360 -6.313 1.00 0.00 H new ATOM 0 HG12 ILE A 79 13.972 0.507 -4.488 1.00 0.00 H new ATOM 0 HG13 ILE A 79 15.246 0.053 -5.602 1.00 0.00 H new ATOM 0 HG21 ILE A 79 15.031 3.479 -4.183 1.00 0.00 H new ATOM 0 HG22 ILE A 79 14.129 4.192 -5.541 1.00 0.00 H new ATOM 0 HG23 ILE A 79 13.304 3.107 -4.397 1.00 0.00 H new ATOM 0 HD11 ILE A 79 16.124 0.238 -3.296 1.00 0.00 H new ATOM 0 HD12 ILE A 79 16.868 1.468 -4.345 1.00 0.00 H new ATOM 0 HD13 ILE A 79 15.574 1.929 -3.214 1.00 0.00 H new ATOM 1354 N GLU A 80 13.887 3.322 -8.692 1.00 0.00 N ATOM 1355 CA GLU A 80 13.624 4.464 -9.551 1.00 0.00 C ATOM 1356 C GLU A 80 12.283 4.292 -10.267 1.00 0.00 C ATOM 1357 O GLU A 80 11.473 5.217 -10.307 1.00 0.00 O ATOM 1358 CB GLU A 80 14.760 4.668 -10.555 1.00 0.00 C ATOM 1359 CG GLU A 80 15.564 5.927 -10.225 1.00 0.00 C ATOM 1360 CD GLU A 80 15.358 7.005 -11.291 1.00 0.00 C ATOM 1361 OE1 GLU A 80 14.178 7.311 -11.568 1.00 0.00 O ATOM 1362 OE2 GLU A 80 16.385 7.499 -11.804 1.00 0.00 O ATOM 0 H GLU A 80 14.688 2.755 -8.970 1.00 0.00 H new ATOM 0 HA GLU A 80 13.569 5.357 -8.929 1.00 0.00 H new ATOM 0 HB2 GLU A 80 15.418 3.799 -10.546 1.00 0.00 H new ATOM 0 HB3 GLU A 80 14.350 4.747 -11.562 1.00 0.00 H new ATOM 0 HG2 GLU A 80 15.261 6.311 -9.251 1.00 0.00 H new ATOM 0 HG3 GLU A 80 16.623 5.678 -10.154 1.00 0.00 H new ATOM 1369 N GLU A 81 12.090 3.101 -10.815 1.00 0.00 N ATOM 1370 CA GLU A 81 10.861 2.796 -11.528 1.00 0.00 C ATOM 1371 C GLU A 81 9.665 2.858 -10.575 1.00 0.00 C ATOM 1372 O GLU A 81 8.604 3.363 -10.938 1.00 0.00 O ATOM 1373 CB GLU A 81 10.948 1.430 -12.210 1.00 0.00 C ATOM 1374 CG GLU A 81 11.635 1.540 -13.573 1.00 0.00 C ATOM 1375 CD GLU A 81 10.929 2.566 -14.462 1.00 0.00 C ATOM 1376 OE1 GLU A 81 9.710 2.389 -14.674 1.00 0.00 O ATOM 1377 OE2 GLU A 81 11.624 3.503 -14.909 1.00 0.00 O ATOM 0 H GLU A 81 12.764 2.336 -10.780 1.00 0.00 H new ATOM 0 HA GLU A 81 10.720 3.546 -12.306 1.00 0.00 H new ATOM 0 HB2 GLU A 81 11.500 0.737 -11.575 1.00 0.00 H new ATOM 0 HB3 GLU A 81 9.947 1.018 -12.336 1.00 0.00 H new ATOM 0 HG2 GLU A 81 12.677 1.828 -13.437 1.00 0.00 H new ATOM 0 HG3 GLU A 81 11.635 0.567 -14.064 1.00 0.00 H new ATOM 1384 N GLY A 82 9.878 2.338 -9.375 1.00 0.00 N ATOM 1385 CA GLY A 82 8.831 2.328 -8.368 1.00 0.00 C ATOM 1386 C GLY A 82 8.252 3.729 -8.164 1.00 0.00 C ATOM 1387 O GLY A 82 7.035 3.902 -8.119 1.00 0.00 O ATOM 0 H GLY A 82 10.760 1.921 -9.078 1.00 0.00 H new ATOM 0 HA2 GLY A 82 8.038 1.644 -8.670 1.00 0.00 H new ATOM 0 HA3 GLY A 82 9.232 1.956 -7.425 1.00 0.00 H new ATOM 1391 N ILE A 83 9.152 4.695 -8.047 1.00 0.00 N ATOM 1392 CA ILE A 83 8.746 6.076 -7.849 1.00 0.00 C ATOM 1393 C ILE A 83 7.861 6.515 -9.018 1.00 0.00 C ATOM 1394 O ILE A 83 6.874 7.222 -8.822 1.00 0.00 O ATOM 1395 CB ILE A 83 9.970 6.969 -7.635 1.00 0.00 C ATOM 1396 CG1 ILE A 83 10.396 6.972 -6.166 1.00 0.00 C ATOM 1397 CG2 ILE A 83 9.715 8.383 -8.161 1.00 0.00 C ATOM 1398 CD1 ILE A 83 11.915 7.098 -6.036 1.00 0.00 C ATOM 0 H ILE A 83 10.161 4.548 -8.086 1.00 0.00 H new ATOM 0 HA ILE A 83 8.148 6.171 -6.942 1.00 0.00 H new ATOM 0 HB ILE A 83 10.799 6.556 -8.210 1.00 0.00 H new ATOM 0 HG12 ILE A 83 9.913 7.799 -5.645 1.00 0.00 H new ATOM 0 HG13 ILE A 83 10.061 6.053 -5.685 1.00 0.00 H new ATOM 0 HG21 ILE A 83 10.600 8.997 -7.997 1.00 0.00 H new ATOM 0 HG22 ILE A 83 9.496 8.340 -9.228 1.00 0.00 H new ATOM 0 HG23 ILE A 83 8.867 8.820 -7.634 1.00 0.00 H new ATOM 0 HD11 ILE A 83 12.191 7.098 -4.982 1.00 0.00 H new ATOM 0 HD12 ILE A 83 12.394 6.257 -6.537 1.00 0.00 H new ATOM 0 HD13 ILE A 83 12.244 8.030 -6.497 1.00 0.00 H new ATOM 1410 N GLN A 84 8.247 6.078 -10.207 1.00 0.00 N ATOM 1411 CA GLN A 84 7.501 6.417 -11.407 1.00 0.00 C ATOM 1412 C GLN A 84 6.052 5.942 -11.284 1.00 0.00 C ATOM 1413 O GLN A 84 5.130 6.627 -11.725 1.00 0.00 O ATOM 1414 CB GLN A 84 8.167 5.826 -12.652 1.00 0.00 C ATOM 1415 CG GLN A 84 8.944 6.898 -13.418 1.00 0.00 C ATOM 1416 CD GLN A 84 10.066 7.483 -12.558 1.00 0.00 C ATOM 1417 OE1 GLN A 84 9.879 8.421 -11.802 1.00 0.00 O ATOM 1418 NE2 GLN A 84 11.240 6.876 -12.714 1.00 0.00 N ATOM 0 H GLN A 84 9.067 5.492 -10.366 1.00 0.00 H new ATOM 0 HA GLN A 84 7.499 7.502 -11.515 1.00 0.00 H new ATOM 0 HB2 GLN A 84 8.842 5.021 -12.361 1.00 0.00 H new ATOM 0 HB3 GLN A 84 7.409 5.387 -13.301 1.00 0.00 H new ATOM 0 HG2 GLN A 84 9.365 6.467 -14.327 1.00 0.00 H new ATOM 0 HG3 GLN A 84 8.265 7.693 -13.726 1.00 0.00 H new ATOM 0 HE21 GLN A 84 11.328 6.095 -13.365 1.00 0.00 H new ATOM 0 HE22 GLN A 84 12.052 7.191 -12.183 1.00 0.00 H new ATOM 1427 N VAL A 85 5.895 4.773 -10.680 1.00 0.00 N ATOM 1428 CA VAL A 85 4.574 4.198 -10.493 1.00 0.00 C ATOM 1429 C VAL A 85 3.761 5.095 -9.557 1.00 0.00 C ATOM 1430 O VAL A 85 2.594 5.381 -9.823 1.00 0.00 O ATOM 1431 CB VAL A 85 4.695 2.760 -9.986 1.00 0.00 C ATOM 1432 CG1 VAL A 85 3.445 2.345 -9.209 1.00 0.00 C ATOM 1433 CG2 VAL A 85 4.969 1.794 -11.141 1.00 0.00 C ATOM 0 H VAL A 85 6.661 4.208 -10.314 1.00 0.00 H new ATOM 0 HA VAL A 85 4.041 4.149 -11.443 1.00 0.00 H new ATOM 0 HB VAL A 85 5.543 2.716 -9.303 1.00 0.00 H new ATOM 0 HG11 VAL A 85 3.558 1.319 -8.860 1.00 0.00 H new ATOM 0 HG12 VAL A 85 3.312 3.007 -8.353 1.00 0.00 H new ATOM 0 HG13 VAL A 85 2.573 2.413 -9.859 1.00 0.00 H new ATOM 0 HG21 VAL A 85 5.051 0.778 -10.754 1.00 0.00 H new ATOM 0 HG22 VAL A 85 4.151 1.844 -11.859 1.00 0.00 H new ATOM 0 HG23 VAL A 85 5.901 2.071 -11.633 1.00 0.00 H new ATOM 1443 N TYR A 86 4.409 5.514 -8.480 1.00 0.00 N ATOM 1444 CA TYR A 86 3.761 6.372 -7.503 1.00 0.00 C ATOM 1445 C TYR A 86 3.421 7.735 -8.110 1.00 0.00 C ATOM 1446 O TYR A 86 2.419 8.348 -7.745 1.00 0.00 O ATOM 1447 CB TYR A 86 4.776 6.568 -6.375 1.00 0.00 C ATOM 1448 CG TYR A 86 5.329 5.262 -5.801 1.00 0.00 C ATOM 1449 CD1 TYR A 86 4.578 4.107 -5.867 1.00 0.00 C ATOM 1450 CD2 TYR A 86 6.580 5.240 -5.219 1.00 0.00 C ATOM 1451 CE1 TYR A 86 5.099 2.878 -5.327 1.00 0.00 C ATOM 1452 CE2 TYR A 86 7.101 4.011 -4.679 1.00 0.00 C ATOM 1453 CZ TYR A 86 6.335 2.890 -4.760 1.00 0.00 C ATOM 1454 OH TYR A 86 6.827 1.729 -4.250 1.00 0.00 O ATOM 0 H TYR A 86 5.376 5.275 -8.263 1.00 0.00 H new ATOM 0 HA TYR A 86 2.831 5.923 -7.155 1.00 0.00 H new ATOM 0 HB2 TYR A 86 5.606 7.169 -6.747 1.00 0.00 H new ATOM 0 HB3 TYR A 86 4.306 7.136 -5.572 1.00 0.00 H new ATOM 0 HD1 TYR A 86 3.599 4.124 -6.324 1.00 0.00 H new ATOM 0 HD2 TYR A 86 7.168 6.144 -5.169 1.00 0.00 H new ATOM 0 HE1 TYR A 86 4.521 1.967 -5.371 1.00 0.00 H new ATOM 0 HE2 TYR A 86 8.078 3.980 -4.220 1.00 0.00 H new ATOM 0 HH TYR A 86 6.159 1.322 -3.660 1.00 0.00 H new ATOM 1464 N ARG A 87 4.275 8.168 -9.026 1.00 0.00 N ATOM 1465 CA ARG A 87 4.078 9.447 -9.687 1.00 0.00 C ATOM 1466 C ARG A 87 2.909 9.361 -10.671 1.00 0.00 C ATOM 1467 O ARG A 87 2.154 10.319 -10.829 1.00 0.00 O ATOM 1468 CB ARG A 87 5.338 9.879 -10.438 1.00 0.00 C ATOM 1469 CG ARG A 87 5.443 11.404 -10.502 1.00 0.00 C ATOM 1470 CD ARG A 87 5.526 11.887 -11.952 1.00 0.00 C ATOM 1471 NE ARG A 87 6.874 12.432 -12.228 1.00 0.00 N ATOM 1472 CZ ARG A 87 7.161 13.244 -13.254 1.00 0.00 C ATOM 1473 NH1 ARG A 87 6.195 13.611 -14.108 1.00 0.00 N ATOM 1474 NH2 ARG A 87 8.413 13.689 -13.427 1.00 0.00 N ATOM 0 H ARG A 87 5.105 7.656 -9.326 1.00 0.00 H new ATOM 0 HA ARG A 87 3.856 10.187 -8.918 1.00 0.00 H new ATOM 0 HB2 ARG A 87 6.219 9.471 -9.942 1.00 0.00 H new ATOM 0 HB3 ARG A 87 5.322 9.469 -11.448 1.00 0.00 H new ATOM 0 HG2 ARG A 87 4.578 11.853 -10.014 1.00 0.00 H new ATOM 0 HG3 ARG A 87 6.325 11.735 -9.954 1.00 0.00 H new ATOM 0 HD2 ARG A 87 5.312 11.062 -12.631 1.00 0.00 H new ATOM 0 HD3 ARG A 87 4.771 12.652 -12.133 1.00 0.00 H new ATOM 0 HE ARG A 87 7.632 12.173 -11.597 1.00 0.00 H new ATOM 0 HH11 ARG A 87 5.242 13.272 -13.976 1.00 0.00 H new ATOM 0 HH12 ARG A 87 6.413 14.229 -14.889 1.00 0.00 H new ATOM 0 HH21 ARG A 87 9.148 13.409 -12.777 1.00 0.00 H new ATOM 0 HH22 ARG A 87 8.631 14.307 -14.208 1.00 0.00 H new ATOM 1488 N ARG A 88 2.797 8.204 -11.307 1.00 0.00 N ATOM 1489 CA ARG A 88 1.734 7.981 -12.272 1.00 0.00 C ATOM 1490 C ARG A 88 0.369 8.055 -11.584 1.00 0.00 C ATOM 1491 O ARG A 88 -0.507 8.804 -12.014 1.00 0.00 O ATOM 1492 CB ARG A 88 1.883 6.617 -12.950 1.00 0.00 C ATOM 1493 CG ARG A 88 2.815 6.704 -14.159 1.00 0.00 C ATOM 1494 CD ARG A 88 2.102 6.253 -15.435 1.00 0.00 C ATOM 1495 NE ARG A 88 3.073 5.640 -16.369 1.00 0.00 N ATOM 1496 CZ ARG A 88 2.797 5.325 -17.641 1.00 0.00 C ATOM 1497 NH1 ARG A 88 1.576 5.563 -18.140 1.00 0.00 N ATOM 1498 NH2 ARG A 88 3.741 4.773 -18.415 1.00 0.00 N ATOM 0 H ARG A 88 3.425 7.411 -11.173 1.00 0.00 H new ATOM 0 HA ARG A 88 1.805 8.761 -13.030 1.00 0.00 H new ATOM 0 HB2 ARG A 88 2.275 5.893 -12.236 1.00 0.00 H new ATOM 0 HB3 ARG A 88 0.905 6.255 -13.266 1.00 0.00 H new ATOM 0 HG2 ARG A 88 3.167 7.729 -14.278 1.00 0.00 H new ATOM 0 HG3 ARG A 88 3.694 6.082 -13.990 1.00 0.00 H new ATOM 0 HD2 ARG A 88 1.319 5.536 -15.189 1.00 0.00 H new ATOM 0 HD3 ARG A 88 1.616 7.105 -15.910 1.00 0.00 H new ATOM 0 HE ARG A 88 4.012 5.445 -16.022 1.00 0.00 H new ATOM 0 HH11 ARG A 88 0.857 5.984 -17.551 1.00 0.00 H new ATOM 0 HH12 ARG A 88 1.365 5.323 -19.109 1.00 0.00 H new ATOM 0 HH21 ARG A 88 4.670 4.592 -18.035 1.00 0.00 H new ATOM 0 HH22 ARG A 88 3.530 4.533 -19.384 1.00 0.00 H new ATOM 1512 N PHE A 89 0.231 7.267 -10.528 1.00 0.00 N ATOM 1513 CA PHE A 89 -1.012 7.234 -9.777 1.00 0.00 C ATOM 1514 C PHE A 89 -1.146 8.468 -8.882 1.00 0.00 C ATOM 1515 O PHE A 89 -2.178 9.138 -8.892 1.00 0.00 O ATOM 1516 CB PHE A 89 -0.970 5.983 -8.896 1.00 0.00 C ATOM 1517 CG PHE A 89 -1.147 4.673 -9.667 1.00 0.00 C ATOM 1518 CD1 PHE A 89 -2.324 4.407 -10.293 1.00 0.00 C ATOM 1519 CD2 PHE A 89 -0.127 3.776 -9.725 1.00 0.00 C ATOM 1520 CE1 PHE A 89 -2.488 3.191 -11.008 1.00 0.00 C ATOM 1521 CE2 PHE A 89 -0.291 2.560 -10.440 1.00 0.00 C ATOM 1522 CZ PHE A 89 -1.468 2.293 -11.067 1.00 0.00 C ATOM 0 H PHE A 89 0.960 6.647 -10.175 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.859 7.221 -10.462 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -0.017 5.955 -8.367 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.752 6.057 -8.141 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -3.134 5.120 -10.247 1.00 0.00 H new ATOM 0 HD2 PHE A 89 0.808 3.988 -9.227 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -3.423 2.979 -11.505 1.00 0.00 H new ATOM 0 HE2 PHE A 89 0.519 1.847 -10.486 1.00 0.00 H new ATOM 0 HZ PHE A 89 -1.593 1.369 -11.611 1.00 0.00 H new ATOM 1532 N TYR A 90 -0.087 8.733 -8.131 1.00 0.00 N ATOM 1533 CA TYR A 90 -0.073 9.875 -7.233 1.00 0.00 C ATOM 1534 C TYR A 90 0.725 11.034 -7.833 1.00 0.00 C ATOM 1535 O TYR A 90 1.734 10.817 -8.502 1.00 0.00 O ATOM 1536 CB TYR A 90 0.624 9.399 -5.957 1.00 0.00 C ATOM 1537 CG TYR A 90 0.383 7.924 -5.630 1.00 0.00 C ATOM 1538 CD1 TYR A 90 -0.878 7.382 -5.772 1.00 0.00 C ATOM 1539 CD2 TYR A 90 1.428 7.135 -5.193 1.00 0.00 C ATOM 1540 CE1 TYR A 90 -1.104 5.993 -5.464 1.00 0.00 C ATOM 1541 CE2 TYR A 90 1.202 5.746 -4.885 1.00 0.00 C ATOM 1542 CZ TYR A 90 -0.053 5.244 -5.036 1.00 0.00 C ATOM 1543 OH TYR A 90 -0.266 3.933 -4.745 1.00 0.00 O ATOM 0 H TYR A 90 0.768 8.176 -8.126 1.00 0.00 H new ATOM 0 HA TYR A 90 -1.087 10.231 -7.048 1.00 0.00 H new ATOM 0 HB2 TYR A 90 1.696 9.568 -6.056 1.00 0.00 H new ATOM 0 HB3 TYR A 90 0.281 10.007 -5.120 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -1.696 7.999 -6.114 1.00 0.00 H new ATOM 0 HD2 TYR A 90 2.415 7.559 -5.082 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -2.086 5.556 -5.571 1.00 0.00 H new ATOM 0 HE2 TYR A 90 2.011 5.118 -4.542 1.00 0.00 H new ATOM 0 HH TYR A 90 0.574 3.522 -4.453 1.00 0.00 H new ATOM 1553 N ASP A 91 0.242 12.240 -7.572 1.00 0.00 N ATOM 1554 CA ASP A 91 0.898 13.434 -8.078 1.00 0.00 C ATOM 1555 C ASP A 91 2.236 13.619 -7.361 1.00 0.00 C ATOM 1556 O ASP A 91 2.345 13.356 -6.164 1.00 0.00 O ATOM 1557 CB ASP A 91 0.048 14.680 -7.822 1.00 0.00 C ATOM 1558 CG ASP A 91 -1.462 14.435 -7.779 1.00 0.00 C ATOM 1559 OD1 ASP A 91 -2.049 14.315 -8.876 1.00 0.00 O ATOM 1560 OD2 ASP A 91 -1.995 14.373 -6.650 1.00 0.00 O ATOM 0 H ASP A 91 -0.595 12.416 -7.017 1.00 0.00 H new ATOM 0 HA ASP A 91 1.042 13.310 -9.151 1.00 0.00 H new ATOM 0 HB2 ASP A 91 0.356 15.123 -6.875 1.00 0.00 H new ATOM 0 HB3 ASP A 91 0.260 15.412 -8.601 1.00 0.00 H new ATOM 1565 N GLU A 92 3.222 14.070 -8.122 1.00 0.00 N ATOM 1566 CA GLU A 92 4.549 14.293 -7.574 1.00 0.00 C ATOM 1567 C GLU A 92 4.542 15.509 -6.645 1.00 0.00 C ATOM 1568 O GLU A 92 5.306 15.564 -5.682 1.00 0.00 O ATOM 1569 CB GLU A 92 5.582 14.462 -8.689 1.00 0.00 C ATOM 1570 CG GLU A 92 5.118 15.497 -9.715 1.00 0.00 C ATOM 1571 CD GLU A 92 6.257 16.447 -10.090 1.00 0.00 C ATOM 1572 OE1 GLU A 92 6.878 16.987 -9.150 1.00 0.00 O ATOM 1573 OE2 GLU A 92 6.481 16.612 -11.309 1.00 0.00 O ATOM 0 H GLU A 92 3.128 14.287 -9.114 1.00 0.00 H new ATOM 0 HA GLU A 92 4.832 13.416 -6.992 1.00 0.00 H new ATOM 0 HB2 GLU A 92 6.536 14.771 -8.262 1.00 0.00 H new ATOM 0 HB3 GLU A 92 5.749 13.505 -9.183 1.00 0.00 H new ATOM 0 HG2 GLU A 92 4.753 14.990 -10.609 1.00 0.00 H new ATOM 0 HG3 GLU A 92 4.283 16.068 -9.309 1.00 0.00 H new ATOM 1580 N GLU A 93 3.671 16.454 -6.966 1.00 0.00 N ATOM 1581 CA GLU A 93 3.554 17.666 -6.172 1.00 0.00 C ATOM 1582 C GLU A 93 2.947 17.348 -4.804 1.00 0.00 C ATOM 1583 O GLU A 93 3.511 17.706 -3.772 1.00 0.00 O ATOM 1584 CB GLU A 93 2.729 18.725 -6.906 1.00 0.00 C ATOM 1585 CG GLU A 93 3.480 20.056 -6.971 1.00 0.00 C ATOM 1586 CD GLU A 93 2.747 21.055 -7.869 1.00 0.00 C ATOM 1587 OE1 GLU A 93 1.652 21.493 -7.456 1.00 0.00 O ATOM 1588 OE2 GLU A 93 3.299 21.359 -8.949 1.00 0.00 O ATOM 0 H GLU A 93 3.039 16.405 -7.765 1.00 0.00 H new ATOM 0 HA GLU A 93 4.553 18.074 -6.018 1.00 0.00 H new ATOM 0 HB2 GLU A 93 2.504 18.381 -7.915 1.00 0.00 H new ATOM 0 HB3 GLU A 93 1.775 18.866 -6.397 1.00 0.00 H new ATOM 0 HG2 GLU A 93 3.582 20.470 -5.968 1.00 0.00 H new ATOM 0 HG3 GLU A 93 4.488 19.891 -7.351 1.00 0.00 H new ATOM 1595 N LYS A 94 1.803 16.679 -4.841 1.00 0.00 N ATOM 1596 CA LYS A 94 1.113 16.309 -3.618 1.00 0.00 C ATOM 1597 C LYS A 94 2.014 15.395 -2.785 1.00 0.00 C ATOM 1598 O LYS A 94 2.053 15.505 -1.560 1.00 0.00 O ATOM 1599 CB LYS A 94 -0.254 15.699 -3.937 1.00 0.00 C ATOM 1600 CG LYS A 94 -1.386 16.629 -3.495 1.00 0.00 C ATOM 1601 CD LYS A 94 -2.033 16.128 -2.202 1.00 0.00 C ATOM 1602 CE LYS A 94 -3.352 16.854 -1.932 1.00 0.00 C ATOM 1603 NZ LYS A 94 -3.124 18.048 -1.087 1.00 0.00 N ATOM 0 H LYS A 94 1.337 16.384 -5.699 1.00 0.00 H new ATOM 0 HA LYS A 94 0.909 17.193 -3.014 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -0.331 15.510 -5.008 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -0.353 14.736 -3.435 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -0.997 17.636 -3.345 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -2.138 16.692 -4.282 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -2.212 15.055 -2.273 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -1.351 16.283 -1.366 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -3.810 17.151 -2.875 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -4.051 16.179 -1.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -4.030 18.529 -0.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -2.707 17.757 -0.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -2.474 18.699 -1.573 1.00 0.00 H new ATOM 1617 N GLU A 95 2.717 14.515 -3.482 1.00 0.00 N ATOM 1618 CA GLU A 95 3.615 13.583 -2.823 1.00 0.00 C ATOM 1619 C GLU A 95 4.763 14.338 -2.150 1.00 0.00 C ATOM 1620 O GLU A 95 5.016 14.159 -0.960 1.00 0.00 O ATOM 1621 CB GLU A 95 4.148 12.542 -3.810 1.00 0.00 C ATOM 1622 CG GLU A 95 4.817 11.380 -3.073 1.00 0.00 C ATOM 1623 CD GLU A 95 6.338 11.543 -3.058 1.00 0.00 C ATOM 1624 OE1 GLU A 95 6.824 12.247 -2.147 1.00 0.00 O ATOM 1625 OE2 GLU A 95 6.980 10.961 -3.959 1.00 0.00 O ATOM 0 H GLU A 95 2.683 14.428 -4.498 1.00 0.00 H new ATOM 0 HA GLU A 95 3.054 13.052 -2.054 1.00 0.00 H new ATOM 0 HB2 GLU A 95 3.330 12.165 -4.424 1.00 0.00 H new ATOM 0 HB3 GLU A 95 4.864 13.009 -4.486 1.00 0.00 H new ATOM 0 HG2 GLU A 95 4.443 11.330 -2.050 1.00 0.00 H new ATOM 0 HG3 GLU A 95 4.553 10.439 -3.555 1.00 0.00 H new ATOM 1632 N LYS A 96 5.428 15.167 -2.942 1.00 0.00 N ATOM 1633 CA LYS A 96 6.544 15.950 -2.438 1.00 0.00 C ATOM 1634 C LYS A 96 6.031 16.949 -1.399 1.00 0.00 C ATOM 1635 O LYS A 96 6.815 17.518 -0.640 1.00 0.00 O ATOM 1636 CB LYS A 96 7.306 16.602 -3.594 1.00 0.00 C ATOM 1637 CG LYS A 96 8.259 15.603 -4.253 1.00 0.00 C ATOM 1638 CD LYS A 96 9.129 16.290 -5.308 1.00 0.00 C ATOM 1639 CE LYS A 96 9.028 15.572 -6.655 1.00 0.00 C ATOM 1640 NZ LYS A 96 10.358 15.491 -7.300 1.00 0.00 N ATOM 0 H LYS A 96 5.215 15.313 -3.929 1.00 0.00 H new ATOM 0 HA LYS A 96 7.265 15.306 -1.934 1.00 0.00 H new ATOM 0 HB2 LYS A 96 6.600 16.979 -4.334 1.00 0.00 H new ATOM 0 HB3 LYS A 96 7.869 17.459 -3.226 1.00 0.00 H new ATOM 0 HG2 LYS A 96 8.894 15.146 -3.494 1.00 0.00 H new ATOM 0 HG3 LYS A 96 7.686 14.799 -4.716 1.00 0.00 H new ATOM 0 HD2 LYS A 96 8.817 17.328 -5.421 1.00 0.00 H new ATOM 0 HD3 LYS A 96 10.167 16.303 -4.976 1.00 0.00 H new ATOM 0 HE2 LYS A 96 8.626 14.569 -6.510 1.00 0.00 H new ATOM 0 HE3 LYS A 96 8.333 16.103 -7.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 10.272 15.001 -8.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 10.727 16.451 -7.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 11.011 14.964 -6.685 1.00 0.00 H new ATOM 1654 N LYS A 97 4.719 17.132 -1.397 1.00 0.00 N ATOM 1655 CA LYS A 97 4.093 18.053 -0.463 1.00 0.00 C ATOM 1656 C LYS A 97 4.078 17.425 0.932 1.00 0.00 C ATOM 1657 O LYS A 97 4.639 17.983 1.873 1.00 0.00 O ATOM 1658 CB LYS A 97 2.708 18.467 -0.966 1.00 0.00 C ATOM 1659 CG LYS A 97 2.135 19.604 -0.119 1.00 0.00 C ATOM 1660 CD LYS A 97 1.985 20.883 -0.946 1.00 0.00 C ATOM 1661 CE LYS A 97 0.848 20.750 -1.960 1.00 0.00 C ATOM 1662 NZ LYS A 97 0.818 21.922 -2.862 1.00 0.00 N ATOM 0 H LYS A 97 4.072 16.658 -2.027 1.00 0.00 H new ATOM 0 HA LYS A 97 4.670 18.975 -0.392 1.00 0.00 H new ATOM 0 HB2 LYS A 97 2.775 18.782 -2.007 1.00 0.00 H new ATOM 0 HB3 LYS A 97 2.035 17.610 -0.935 1.00 0.00 H new ATOM 0 HG2 LYS A 97 1.165 19.310 0.282 1.00 0.00 H new ATOM 0 HG3 LYS A 97 2.788 19.792 0.733 1.00 0.00 H new ATOM 0 HD2 LYS A 97 1.790 21.727 -0.285 1.00 0.00 H new ATOM 0 HD3 LYS A 97 2.919 21.095 -1.467 1.00 0.00 H new ATOM 0 HE2 LYS A 97 0.978 19.838 -2.543 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -0.105 20.661 -1.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 0.040 21.815 -3.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 0.672 22.787 -2.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 1.721 21.989 -3.374 1.00 0.00 H new ATOM 1676 N TYR A 98 3.429 16.273 1.021 1.00 0.00 N ATOM 1677 CA TYR A 98 3.334 15.564 2.286 1.00 0.00 C ATOM 1678 C TYR A 98 4.428 14.501 2.402 1.00 0.00 C ATOM 1679 O TYR A 98 5.194 14.497 3.365 1.00 0.00 O ATOM 1680 CB TYR A 98 1.968 14.874 2.280 1.00 0.00 C ATOM 1681 CG TYR A 98 0.798 15.807 2.599 1.00 0.00 C ATOM 1682 CD1 TYR A 98 0.536 16.889 1.782 1.00 0.00 C ATOM 1683 CD2 TYR A 98 0.005 15.568 3.702 1.00 0.00 C ATOM 1684 CE1 TYR A 98 -0.565 17.767 2.082 1.00 0.00 C ATOM 1685 CE2 TYR A 98 -1.096 16.446 4.002 1.00 0.00 C ATOM 1686 CZ TYR A 98 -1.327 17.502 3.177 1.00 0.00 C ATOM 1687 OH TYR A 98 -2.367 18.332 3.460 1.00 0.00 O ATOM 0 H TYR A 98 2.964 15.813 0.238 1.00 0.00 H new ATOM 0 HA TYR A 98 3.451 16.253 3.122 1.00 0.00 H new ATOM 0 HB2 TYR A 98 1.804 14.424 1.301 1.00 0.00 H new ATOM 0 HB3 TYR A 98 1.980 14.061 3.006 1.00 0.00 H new ATOM 0 HD1 TYR A 98 1.157 17.077 0.918 1.00 0.00 H new ATOM 0 HD2 TYR A 98 0.210 14.722 4.341 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -0.781 18.617 1.452 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -1.724 16.270 4.863 1.00 0.00 H new ATOM 0 HH TYR A 98 -2.823 18.020 4.269 1.00 0.00 H new ATOM 1697 N GLY A 99 4.468 13.627 1.408 1.00 0.00 N ATOM 1698 CA GLY A 99 5.456 12.562 1.387 1.00 0.00 C ATOM 1699 C GLY A 99 4.789 11.199 1.194 1.00 0.00 C ATOM 1700 O GLY A 99 3.702 11.111 0.625 1.00 0.00 O ATOM 0 H GLY A 99 3.832 13.634 0.611 1.00 0.00 H new ATOM 0 HA2 GLY A 99 6.169 12.739 0.582 1.00 0.00 H new ATOM 0 HA3 GLY A 99 6.020 12.566 2.320 1.00 0.00 H new ATOM 1704 N VAL A 100 5.467 10.169 1.678 1.00 0.00 N ATOM 1705 CA VAL A 100 4.954 8.815 1.566 1.00 0.00 C ATOM 1706 C VAL A 100 4.795 8.217 2.965 1.00 0.00 C ATOM 1707 O VAL A 100 5.519 8.586 3.888 1.00 0.00 O ATOM 1708 CB VAL A 100 5.865 7.983 0.661 1.00 0.00 C ATOM 1709 CG1 VAL A 100 5.088 6.843 -0.001 1.00 0.00 C ATOM 1710 CG2 VAL A 100 6.547 8.863 -0.389 1.00 0.00 C ATOM 0 H VAL A 100 6.368 10.245 2.149 1.00 0.00 H new ATOM 0 HA VAL A 100 3.969 8.818 1.099 1.00 0.00 H new ATOM 0 HB VAL A 100 6.642 7.541 1.284 1.00 0.00 H new ATOM 0 HG11 VAL A 100 5.759 6.268 -0.639 1.00 0.00 H new ATOM 0 HG12 VAL A 100 4.671 6.192 0.768 1.00 0.00 H new ATOM 0 HG13 VAL A 100 4.280 7.256 -0.604 1.00 0.00 H new ATOM 0 HG21 VAL A 100 7.189 8.247 -1.019 1.00 0.00 H new ATOM 0 HG22 VAL A 100 5.790 9.347 -1.006 1.00 0.00 H new ATOM 0 HG23 VAL A 100 7.149 9.623 0.109 1.00 0.00 H new ATOM 1720 N VAL A 101 3.842 7.303 3.079 1.00 0.00 N ATOM 1721 CA VAL A 101 3.579 6.650 4.350 1.00 0.00 C ATOM 1722 C VAL A 101 3.349 5.156 4.113 1.00 0.00 C ATOM 1723 O VAL A 101 2.393 4.770 3.443 1.00 0.00 O ATOM 1724 CB VAL A 101 2.403 7.331 5.054 1.00 0.00 C ATOM 1725 CG1 VAL A 101 1.176 7.389 4.142 1.00 0.00 C ATOM 1726 CG2 VAL A 101 2.074 6.630 6.373 1.00 0.00 C ATOM 0 H VAL A 101 3.243 6.999 2.312 1.00 0.00 H new ATOM 0 HA VAL A 101 4.438 6.746 5.014 1.00 0.00 H new ATOM 0 HB VAL A 101 2.697 8.355 5.283 1.00 0.00 H new ATOM 0 HG11 VAL A 101 0.355 7.878 4.667 1.00 0.00 H new ATOM 0 HG12 VAL A 101 1.418 7.954 3.242 1.00 0.00 H new ATOM 0 HG13 VAL A 101 0.879 6.377 3.867 1.00 0.00 H new ATOM 0 HG21 VAL A 101 1.235 7.133 6.853 1.00 0.00 H new ATOM 0 HG22 VAL A 101 1.810 5.591 6.177 1.00 0.00 H new ATOM 0 HG23 VAL A 101 2.943 6.665 7.030 1.00 0.00 H new ATOM 1736 N ALA A 102 4.242 4.356 4.677 1.00 0.00 N ATOM 1737 CA ALA A 102 4.149 2.913 4.536 1.00 0.00 C ATOM 1738 C ALA A 102 3.252 2.354 5.641 1.00 0.00 C ATOM 1739 O ALA A 102 3.700 2.158 6.770 1.00 0.00 O ATOM 1740 CB ALA A 102 5.553 2.306 4.561 1.00 0.00 C ATOM 0 H ALA A 102 5.034 4.680 5.233 1.00 0.00 H new ATOM 0 HA ALA A 102 3.697 2.649 3.580 1.00 0.00 H new ATOM 0 HB1 ALA A 102 5.483 1.223 4.455 1.00 0.00 H new ATOM 0 HB2 ALA A 102 6.140 2.714 3.738 1.00 0.00 H new ATOM 0 HB3 ALA A 102 6.037 2.548 5.507 1.00 0.00 H new ATOM 1746 N ILE A 103 2.000 2.112 5.278 1.00 0.00 N ATOM 1747 CA ILE A 103 1.036 1.579 6.225 1.00 0.00 C ATOM 1748 C ILE A 103 1.080 0.051 6.185 1.00 0.00 C ATOM 1749 O ILE A 103 1.073 -0.547 5.110 1.00 0.00 O ATOM 1750 CB ILE A 103 -0.354 2.161 5.959 1.00 0.00 C ATOM 1751 CG1 ILE A 103 -0.713 2.067 4.475 1.00 0.00 C ATOM 1752 CG2 ILE A 103 -0.458 3.595 6.484 1.00 0.00 C ATOM 1753 CD1 ILE A 103 -0.412 3.382 3.753 1.00 0.00 C ATOM 0 H ILE A 103 1.632 2.275 4.341 1.00 0.00 H new ATOM 0 HA ILE A 103 1.293 1.879 7.241 1.00 0.00 H new ATOM 0 HB ILE A 103 -1.084 1.564 6.505 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -0.150 1.257 4.012 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -1.770 1.823 4.368 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -1.456 3.985 6.282 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -0.276 3.603 7.559 1.00 0.00 H new ATOM 0 HG23 ILE A 103 0.283 4.220 5.986 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -0.676 3.288 2.700 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -0.995 4.186 4.203 1.00 0.00 H new ATOM 0 HD13 ILE A 103 0.650 3.611 3.841 1.00 0.00 H new ATOM 1765 N GLU A 104 1.125 -0.539 7.371 1.00 0.00 N ATOM 1766 CA GLU A 104 1.170 -1.987 7.486 1.00 0.00 C ATOM 1767 C GLU A 104 -0.248 -2.559 7.549 1.00 0.00 C ATOM 1768 O GLU A 104 -0.936 -2.410 8.558 1.00 0.00 O ATOM 1769 CB GLU A 104 1.989 -2.415 8.705 1.00 0.00 C ATOM 1770 CG GLU A 104 2.808 -3.671 8.401 1.00 0.00 C ATOM 1771 CD GLU A 104 1.967 -4.935 8.594 1.00 0.00 C ATOM 1772 OE1 GLU A 104 0.741 -4.841 8.365 1.00 0.00 O ATOM 1773 OE2 GLU A 104 2.567 -5.966 8.966 1.00 0.00 O ATOM 0 H GLU A 104 1.131 -0.040 8.261 1.00 0.00 H new ATOM 0 HA GLU A 104 1.663 -2.387 6.600 1.00 0.00 H new ATOM 0 HB2 GLU A 104 2.655 -1.605 9.003 1.00 0.00 H new ATOM 0 HB3 GLU A 104 1.323 -2.606 9.547 1.00 0.00 H new ATOM 0 HG2 GLU A 104 3.178 -3.629 7.377 1.00 0.00 H new ATOM 0 HG3 GLU A 104 3.680 -3.707 9.054 1.00 0.00 H new ATOM 1780 N ILE A 105 -0.642 -3.201 6.459 1.00 0.00 N ATOM 1781 CA ILE A 105 -1.965 -3.796 6.379 1.00 0.00 C ATOM 1782 C ILE A 105 -1.849 -5.312 6.557 1.00 0.00 C ATOM 1783 O ILE A 105 -0.785 -5.887 6.335 1.00 0.00 O ATOM 1784 CB ILE A 105 -2.661 -3.381 5.081 1.00 0.00 C ATOM 1785 CG1 ILE A 105 -2.242 -4.285 3.920 1.00 0.00 C ATOM 1786 CG2 ILE A 105 -2.412 -1.903 4.775 1.00 0.00 C ATOM 1787 CD1 ILE A 105 -0.744 -4.157 3.638 1.00 0.00 C ATOM 0 H ILE A 105 -0.068 -3.322 5.624 1.00 0.00 H new ATOM 0 HA ILE A 105 -2.598 -3.427 7.186 1.00 0.00 H new ATOM 0 HB ILE A 105 -3.736 -3.506 5.214 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -2.484 -5.321 4.156 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -2.808 -4.021 3.026 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -2.917 -1.633 3.848 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -2.800 -1.292 5.590 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -1.341 -1.729 4.669 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -0.473 -4.810 2.808 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -0.509 -3.125 3.379 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -0.181 -4.445 4.526 1.00 0.00 H new ATOM 1799 N GLU A 106 -2.960 -5.915 6.955 1.00 0.00 N ATOM 1800 CA GLU A 106 -2.997 -7.352 7.165 1.00 0.00 C ATOM 1801 C GLU A 106 -4.294 -7.937 6.604 1.00 0.00 C ATOM 1802 O GLU A 106 -5.346 -7.845 7.236 1.00 0.00 O ATOM 1803 CB GLU A 106 -2.837 -7.693 8.648 1.00 0.00 C ATOM 1804 CG GLU A 106 -3.728 -6.801 9.515 1.00 0.00 C ATOM 1805 CD GLU A 106 -4.047 -7.477 10.850 1.00 0.00 C ATOM 1806 OE1 GLU A 106 -3.078 -7.772 11.583 1.00 0.00 O ATOM 1807 OE2 GLU A 106 -5.252 -7.683 11.108 1.00 0.00 O ATOM 0 H GLU A 106 -3.841 -5.434 7.137 1.00 0.00 H new ATOM 0 HA GLU A 106 -2.159 -7.800 6.631 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -3.093 -8.740 8.814 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -1.795 -7.569 8.943 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -3.230 -5.849 9.695 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -4.654 -6.581 8.984 1.00 0.00 H new ATOM 1814 N PRO A 107 -4.175 -8.543 5.392 1.00 0.00 N ATOM 1815 CA PRO A 107 -5.326 -9.143 4.739 1.00 0.00 C ATOM 1816 C PRO A 107 -5.703 -10.469 5.403 1.00 0.00 C ATOM 1817 O PRO A 107 -5.007 -11.470 5.239 1.00 0.00 O ATOM 1818 CB PRO A 107 -4.914 -9.303 3.285 1.00 0.00 C ATOM 1819 CG PRO A 107 -3.396 -9.220 3.270 1.00 0.00 C ATOM 1820 CD PRO A 107 -2.946 -8.671 4.615 1.00 0.00 C ATOM 0 HA PRO A 107 -6.223 -8.529 4.820 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -5.257 -10.257 2.885 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -5.354 -8.521 2.666 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -2.962 -10.204 3.095 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -3.057 -8.573 2.461 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -2.239 -9.343 5.101 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -2.446 -7.709 4.503 1.00 0.00 H new ATOM 1828 N LEU A 108 -6.805 -10.433 6.138 1.00 0.00 N ATOM 1829 CA LEU A 108 -7.283 -11.620 6.828 1.00 0.00 C ATOM 1830 C LEU A 108 -8.387 -12.277 5.996 1.00 0.00 C ATOM 1831 O LEU A 108 -9.530 -12.373 6.441 1.00 0.00 O ATOM 1832 CB LEU A 108 -7.712 -11.274 8.255 1.00 0.00 C ATOM 1833 CG LEU A 108 -8.419 -9.929 8.436 1.00 0.00 C ATOM 1834 CD1 LEU A 108 -9.547 -10.037 9.464 1.00 0.00 C ATOM 1835 CD2 LEU A 108 -7.420 -8.828 8.795 1.00 0.00 C ATOM 0 H LEU A 108 -7.380 -9.601 6.271 1.00 0.00 H new ATOM 0 HA LEU A 108 -6.481 -12.351 6.930 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -8.374 -12.061 8.615 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -6.828 -11.286 8.892 1.00 0.00 H new ATOM 0 HG LEU A 108 -8.875 -9.652 7.485 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -10.033 -9.068 9.574 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -10.277 -10.773 9.127 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -9.136 -10.347 10.424 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -7.949 -7.883 8.918 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -6.915 -9.085 9.726 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -6.684 -8.731 7.997 1.00 0.00 H new