USER MOD reduce.3.24.130724 H: found=0, std=0, add=959, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 956 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 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 MET CE :methyl 149:sc= -1.65 (180deg=-5.88!) USER MOD Single : A 8 GLN : amide:sc= -0.0174 X(o=-0.017,f=0) USER MOD Single : A 16 LYS NZ :NH3+ -151:sc= -0.657 (180deg=-0.88) 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= -1.14 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc= 0.0652 X(o=0.065,f=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 SER OG : rot 156:sc= -0.733 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 TYR OH : rot 100:sc= -0.0918 USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 63 MET CE :methyl 151:sc= -4.16! (180deg=-8.25!) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 ASN :FLIP amide:sc= -0.72 F(o=-4.9!,f=-0.72) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 37:sc= 1.05 USER MOD Single : A 84 GLN : amide:sc= -1.07 K(o=-1.1,f=-5.6!) USER MOD Single : A 86 TYR OH : rot -17:sc= -2.14! 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 Single : A 110 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -17.711 0.751 11.410 1.00 0.00 N ATOM 2 CA MET A 1 -16.733 1.517 10.655 1.00 0.00 C ATOM 3 C MET A 1 -15.871 0.599 9.786 1.00 0.00 C ATOM 4 O MET A 1 -15.020 -0.127 10.299 1.00 0.00 O ATOM 5 CB MET A 1 -15.838 2.295 11.621 1.00 0.00 C ATOM 6 CG MET A 1 -16.561 3.528 12.167 1.00 0.00 C ATOM 7 SD MET A 1 -16.569 3.492 13.951 1.00 0.00 S ATOM 8 CE MET A 1 -16.069 5.170 14.297 1.00 0.00 C ATOM 0 H1 MET A 1 -18.283 1.396 11.991 1.00 0.00 H new ATOM 0 H2 MET A 1 -18.331 0.235 10.753 1.00 0.00 H new ATOM 0 H3 MET A 1 -17.220 0.073 12.027 1.00 0.00 H new ATOM 0 HA MET A 1 -17.266 2.209 10.003 1.00 0.00 H new ATOM 0 HB2 MET A 1 -15.540 1.649 12.447 1.00 0.00 H new ATOM 0 HB3 MET A 1 -14.925 2.601 11.110 1.00 0.00 H new ATOM 0 HG2 MET A 1 -16.067 4.434 11.816 1.00 0.00 H new ATOM 0 HG3 MET A 1 -17.584 3.556 11.791 1.00 0.00 H new ATOM 0 HE1 MET A 1 -16.022 5.321 15.376 1.00 0.00 H new ATOM 0 HE2 MET A 1 -15.087 5.354 13.862 1.00 0.00 H new ATOM 0 HE3 MET A 1 -16.792 5.862 13.865 1.00 0.00 H new ATOM 17 N GLU A 2 -16.120 0.660 8.487 1.00 0.00 N ATOM 18 CA GLU A 2 -15.377 -0.156 7.542 1.00 0.00 C ATOM 19 C GLU A 2 -14.960 0.680 6.331 1.00 0.00 C ATOM 20 O GLU A 2 -15.566 1.711 6.045 1.00 0.00 O ATOM 21 CB GLU A 2 -16.194 -1.376 7.111 1.00 0.00 C ATOM 22 CG GLU A 2 -15.332 -2.641 7.112 1.00 0.00 C ATOM 23 CD GLU A 2 -15.985 -3.749 7.941 1.00 0.00 C ATOM 24 OE1 GLU A 2 -15.927 -3.636 9.185 1.00 0.00 O ATOM 25 OE2 GLU A 2 -16.527 -4.683 7.313 1.00 0.00 O ATOM 0 H GLU A 2 -16.827 1.263 8.066 1.00 0.00 H new ATOM 0 HA GLU A 2 -14.475 -0.519 8.036 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -17.041 -1.508 7.785 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -16.603 -1.211 6.114 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -15.185 -2.986 6.089 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -14.346 -2.413 7.516 1.00 0.00 H new ATOM 32 N TRP A 3 -13.927 0.204 5.651 1.00 0.00 N ATOM 33 CA TRP A 3 -13.421 0.895 4.477 1.00 0.00 C ATOM 34 C TRP A 3 -13.504 -0.066 3.290 1.00 0.00 C ATOM 35 O TRP A 3 -13.457 -1.283 3.468 1.00 0.00 O ATOM 36 CB TRP A 3 -12.006 1.425 4.720 1.00 0.00 C ATOM 37 CG TRP A 3 -11.848 2.201 6.028 1.00 0.00 C ATOM 38 CD1 TRP A 3 -11.142 1.854 7.113 1.00 0.00 C ATOM 39 CD2 TRP A 3 -12.440 3.478 6.348 1.00 0.00 C ATOM 40 NE1 TRP A 3 -11.236 2.810 8.104 1.00 0.00 N ATOM 41 CE2 TRP A 3 -12.050 3.829 7.624 1.00 0.00 C ATOM 42 CE3 TRP A 3 -13.278 4.309 5.583 1.00 0.00 C ATOM 43 CZ2 TRP A 3 -12.449 5.017 8.248 1.00 0.00 C ATOM 44 CZ3 TRP A 3 -13.668 5.492 6.222 1.00 0.00 C ATOM 45 CH2 TRP A 3 -13.284 5.860 7.506 1.00 0.00 C ATOM 0 H TRP A 3 -13.427 -0.652 5.891 1.00 0.00 H new ATOM 0 HA TRP A 3 -14.027 1.774 4.256 1.00 0.00 H new ATOM 0 HB2 TRP A 3 -11.310 0.586 4.721 1.00 0.00 H new ATOM 0 HB3 TRP A 3 -11.724 2.072 3.889 1.00 0.00 H new ATOM 0 HD1 TRP A 3 -10.571 0.941 7.201 1.00 0.00 H new ATOM 0 HE1 TRP A 3 -10.790 2.775 9.021 1.00 0.00 H new ATOM 0 HE3 TRP A 3 -13.595 4.055 4.582 1.00 0.00 H new ATOM 0 HZ2 TRP A 3 -12.130 5.269 9.248 1.00 0.00 H new ATOM 0 HZ3 TRP A 3 -14.313 6.167 5.679 1.00 0.00 H new ATOM 0 HH2 TRP A 3 -13.628 6.792 7.929 1.00 0.00 H new ATOM 56 N GLU A 4 -13.628 0.515 2.106 1.00 0.00 N ATOM 57 CA GLU A 4 -13.718 -0.275 0.890 1.00 0.00 C ATOM 58 C GLU A 4 -12.937 0.398 -0.240 1.00 0.00 C ATOM 59 O GLU A 4 -12.601 1.578 -0.150 1.00 0.00 O ATOM 60 CB GLU A 4 -15.177 -0.500 0.490 1.00 0.00 C ATOM 61 CG GLU A 4 -15.401 -1.939 0.021 1.00 0.00 C ATOM 62 CD GLU A 4 -16.170 -1.972 -1.302 1.00 0.00 C ATOM 63 OE1 GLU A 4 -15.537 -1.664 -2.334 1.00 0.00 O ATOM 64 OE2 GLU A 4 -17.374 -2.304 -1.250 1.00 0.00 O ATOM 0 H GLU A 4 -13.668 1.524 1.963 1.00 0.00 H new ATOM 0 HA GLU A 4 -13.273 -1.252 1.081 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -15.828 -0.284 1.338 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -15.451 0.193 -0.306 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -14.440 -2.439 -0.100 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -15.954 -2.491 0.781 1.00 0.00 H new ATOM 71 N MET A 5 -12.671 -0.380 -1.278 1.00 0.00 N ATOM 72 CA MET A 5 -11.936 0.126 -2.425 1.00 0.00 C ATOM 73 C MET A 5 -12.180 -0.742 -3.661 1.00 0.00 C ATOM 74 O MET A 5 -13.070 -1.592 -3.660 1.00 0.00 O ATOM 75 CB MET A 5 -10.440 0.147 -2.104 1.00 0.00 C ATOM 76 CG MET A 5 -9.963 1.570 -1.804 1.00 0.00 C ATOM 77 SD MET A 5 -8.321 1.529 -1.105 1.00 0.00 S ATOM 78 CE MET A 5 -8.682 2.046 0.565 1.00 0.00 C ATOM 0 H MET A 5 -12.951 -1.358 -1.349 1.00 0.00 H new ATOM 0 HA MET A 5 -12.286 1.136 -2.639 1.00 0.00 H new ATOM 0 HB2 MET A 5 -10.239 -0.496 -1.247 1.00 0.00 H new ATOM 0 HB3 MET A 5 -9.878 -0.259 -2.945 1.00 0.00 H new ATOM 0 HG2 MET A 5 -9.963 2.163 -2.719 1.00 0.00 H new ATOM 0 HG3 MET A 5 -10.650 2.054 -1.110 1.00 0.00 H new ATOM 0 HE1 MET A 5 -7.974 1.581 1.251 1.00 0.00 H new ATOM 0 HE2 MET A 5 -8.598 3.130 0.636 1.00 0.00 H new ATOM 0 HE3 MET A 5 -9.695 1.743 0.829 1.00 0.00 H new ATOM 88 N GLY A 6 -11.376 -0.498 -4.685 1.00 0.00 N ATOM 89 CA GLY A 6 -11.494 -1.247 -5.924 1.00 0.00 C ATOM 90 C GLY A 6 -10.164 -1.268 -6.681 1.00 0.00 C ATOM 91 O GLY A 6 -9.470 -0.255 -6.750 1.00 0.00 O ATOM 0 H GLY A 6 -10.640 0.208 -4.682 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -11.809 -2.268 -5.707 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -12.266 -0.801 -6.551 1.00 0.00 H new ATOM 95 N LEU A 7 -9.851 -2.432 -7.230 1.00 0.00 N ATOM 96 CA LEU A 7 -8.617 -2.598 -7.979 1.00 0.00 C ATOM 97 C LEU A 7 -8.682 -3.901 -8.780 1.00 0.00 C ATOM 98 O LEU A 7 -9.573 -4.721 -8.565 1.00 0.00 O ATOM 99 CB LEU A 7 -7.407 -2.509 -7.047 1.00 0.00 C ATOM 100 CG LEU A 7 -7.356 -3.538 -5.915 1.00 0.00 C ATOM 101 CD1 LEU A 7 -6.092 -3.362 -5.071 1.00 0.00 C ATOM 102 CD2 LEU A 7 -8.626 -3.480 -5.063 1.00 0.00 C ATOM 0 H LEU A 7 -10.430 -3.269 -7.171 1.00 0.00 H new ATOM 0 HA LEU A 7 -8.497 -1.787 -8.697 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -6.503 -2.613 -7.647 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -7.385 -1.512 -6.607 1.00 0.00 H new ATOM 0 HG LEU A 7 -7.311 -4.532 -6.359 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -6.080 -4.105 -4.274 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -5.212 -3.492 -5.701 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -6.081 -2.363 -4.636 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -8.564 -4.221 -4.266 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -8.727 -2.486 -4.627 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -9.494 -3.691 -5.688 1.00 0.00 H new ATOM 114 N GLN A 8 -7.727 -4.050 -9.685 1.00 0.00 N ATOM 115 CA GLN A 8 -7.665 -5.239 -10.519 1.00 0.00 C ATOM 116 C GLN A 8 -7.388 -6.475 -9.660 1.00 0.00 C ATOM 117 O GLN A 8 -6.899 -6.358 -8.538 1.00 0.00 O ATOM 118 CB GLN A 8 -6.609 -5.085 -11.615 1.00 0.00 C ATOM 119 CG GLN A 8 -7.066 -5.752 -12.914 1.00 0.00 C ATOM 120 CD GLN A 8 -6.450 -5.060 -14.132 1.00 0.00 C ATOM 121 OE1 GLN A 8 -5.248 -5.070 -14.341 1.00 0.00 O ATOM 122 NE2 GLN A 8 -7.337 -4.461 -14.920 1.00 0.00 N ATOM 0 H GLN A 8 -6.989 -3.367 -9.860 1.00 0.00 H new ATOM 0 HA GLN A 8 -8.631 -5.368 -11.007 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -6.416 -4.027 -11.793 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -5.670 -5.529 -11.285 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -6.781 -6.804 -12.906 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -8.153 -5.716 -12.982 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -8.329 -4.491 -14.686 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -7.025 -3.971 -15.759 1.00 0.00 H new ATOM 131 N GLU A 9 -7.714 -7.630 -10.221 1.00 0.00 N ATOM 132 CA GLU A 9 -7.507 -8.886 -9.521 1.00 0.00 C ATOM 133 C GLU A 9 -6.038 -9.035 -9.120 1.00 0.00 C ATOM 134 O GLU A 9 -5.734 -9.391 -7.982 1.00 0.00 O ATOM 135 CB GLU A 9 -7.965 -10.071 -10.374 1.00 0.00 C ATOM 136 CG GLU A 9 -7.707 -11.397 -9.654 1.00 0.00 C ATOM 137 CD GLU A 9 -6.800 -12.305 -10.486 1.00 0.00 C ATOM 138 OE1 GLU A 9 -5.568 -12.186 -10.316 1.00 0.00 O ATOM 139 OE2 GLU A 9 -7.360 -13.099 -11.273 1.00 0.00 O ATOM 0 H GLU A 9 -8.120 -7.722 -11.152 1.00 0.00 H new ATOM 0 HA GLU A 9 -8.112 -8.878 -8.614 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -9.028 -9.975 -10.596 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -7.438 -10.062 -11.328 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -7.246 -11.205 -8.685 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -8.654 -11.901 -9.462 1.00 0.00 H new ATOM 146 N GLU A 10 -5.165 -8.754 -10.076 1.00 0.00 N ATOM 147 CA GLU A 10 -3.735 -8.851 -9.837 1.00 0.00 C ATOM 148 C GLU A 10 -3.343 -8.013 -8.619 1.00 0.00 C ATOM 149 O GLU A 10 -2.704 -8.515 -7.695 1.00 0.00 O ATOM 150 CB GLU A 10 -2.942 -8.426 -11.074 1.00 0.00 C ATOM 151 CG GLU A 10 -2.314 -9.637 -11.766 1.00 0.00 C ATOM 152 CD GLU A 10 -1.310 -9.199 -12.834 1.00 0.00 C ATOM 153 OE1 GLU A 10 -0.186 -8.823 -12.437 1.00 0.00 O ATOM 154 OE2 GLU A 10 -1.689 -9.250 -14.024 1.00 0.00 O ATOM 0 H GLU A 10 -5.421 -8.459 -11.018 1.00 0.00 H new ATOM 0 HA GLU A 10 -3.491 -9.893 -9.631 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -3.599 -7.905 -11.770 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.161 -7.722 -10.786 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -1.814 -10.264 -11.027 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -3.095 -10.244 -12.223 1.00 0.00 H new ATOM 161 N PHE A 11 -3.740 -6.750 -8.656 1.00 0.00 N ATOM 162 CA PHE A 11 -3.438 -5.837 -7.567 1.00 0.00 C ATOM 163 C PHE A 11 -4.037 -6.336 -6.251 1.00 0.00 C ATOM 164 O PHE A 11 -3.461 -6.128 -5.184 1.00 0.00 O ATOM 165 CB PHE A 11 -4.071 -4.490 -7.923 1.00 0.00 C ATOM 166 CG PHE A 11 -3.057 -3.401 -8.280 1.00 0.00 C ATOM 167 CD1 PHE A 11 -2.334 -3.495 -9.428 1.00 0.00 C ATOM 168 CD2 PHE A 11 -2.880 -2.339 -7.449 1.00 0.00 C ATOM 169 CE1 PHE A 11 -1.393 -2.484 -9.758 1.00 0.00 C ATOM 170 CE2 PHE A 11 -1.939 -1.328 -7.780 1.00 0.00 C ATOM 171 CZ PHE A 11 -1.215 -1.422 -8.928 1.00 0.00 C ATOM 0 H PHE A 11 -4.269 -6.337 -9.424 1.00 0.00 H new ATOM 0 HA PHE A 11 -2.359 -5.758 -7.437 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -4.750 -4.630 -8.764 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -4.673 -4.149 -7.081 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -2.475 -4.338 -10.088 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -3.455 -2.264 -6.538 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -0.818 -2.559 -10.669 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -1.798 -0.485 -7.120 1.00 0.00 H new ATOM 0 HZ PHE A 11 -0.499 -0.653 -9.180 1.00 0.00 H new ATOM 181 N LEU A 12 -5.186 -6.986 -6.369 1.00 0.00 N ATOM 182 CA LEU A 12 -5.869 -7.517 -5.202 1.00 0.00 C ATOM 183 C LEU A 12 -4.997 -8.592 -4.551 1.00 0.00 C ATOM 184 O LEU A 12 -4.897 -8.658 -3.327 1.00 0.00 O ATOM 185 CB LEU A 12 -7.270 -8.005 -5.577 1.00 0.00 C ATOM 186 CG LEU A 12 -8.422 -7.055 -5.245 1.00 0.00 C ATOM 187 CD1 LEU A 12 -9.514 -7.122 -6.315 1.00 0.00 C ATOM 188 CD2 LEU A 12 -8.974 -7.331 -3.845 1.00 0.00 C ATOM 0 H LEU A 12 -5.661 -7.157 -7.255 1.00 0.00 H new ATOM 0 HA LEU A 12 -6.018 -6.734 -4.459 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -7.288 -8.206 -6.648 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -7.450 -8.954 -5.071 1.00 0.00 H new ATOM 0 HG LEU A 12 -8.035 -6.036 -5.244 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -10.321 -6.437 -6.055 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -9.095 -6.839 -7.281 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -9.905 -8.138 -6.373 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -9.792 -6.642 -3.634 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -9.341 -8.356 -3.794 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -8.183 -7.192 -3.108 1.00 0.00 H new ATOM 200 N GLU A 13 -4.388 -9.408 -5.399 1.00 0.00 N ATOM 201 CA GLU A 13 -3.527 -10.477 -4.921 1.00 0.00 C ATOM 202 C GLU A 13 -2.236 -9.899 -4.340 1.00 0.00 C ATOM 203 O GLU A 13 -1.665 -10.460 -3.405 1.00 0.00 O ATOM 204 CB GLU A 13 -3.226 -11.478 -6.038 1.00 0.00 C ATOM 205 CG GLU A 13 -1.823 -11.258 -6.607 1.00 0.00 C ATOM 206 CD GLU A 13 -1.619 -12.066 -7.891 1.00 0.00 C ATOM 207 OE1 GLU A 13 -2.631 -12.278 -8.594 1.00 0.00 O ATOM 208 OE2 GLU A 13 -0.457 -12.452 -8.141 1.00 0.00 O ATOM 0 H GLU A 13 -4.474 -9.351 -6.414 1.00 0.00 H new ATOM 0 HA GLU A 13 -4.050 -11.013 -4.129 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -3.311 -12.494 -5.653 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -3.965 -11.375 -6.833 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -1.672 -10.198 -6.812 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -1.077 -11.549 -5.868 1.00 0.00 H new ATOM 215 N LEU A 14 -1.812 -8.784 -4.916 1.00 0.00 N ATOM 216 CA LEU A 14 -0.598 -8.123 -4.466 1.00 0.00 C ATOM 217 C LEU A 14 -0.675 -7.897 -2.955 1.00 0.00 C ATOM 218 O LEU A 14 0.287 -8.160 -2.235 1.00 0.00 O ATOM 219 CB LEU A 14 -0.356 -6.843 -5.268 1.00 0.00 C ATOM 220 CG LEU A 14 0.052 -7.034 -6.730 1.00 0.00 C ATOM 221 CD1 LEU A 14 0.870 -5.842 -7.231 1.00 0.00 C ATOM 222 CD2 LEU A 14 0.792 -8.359 -6.924 1.00 0.00 C ATOM 0 H LEU A 14 -2.287 -8.321 -5.691 1.00 0.00 H new ATOM 0 HA LEU A 14 0.270 -8.756 -4.650 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -1.266 -6.244 -5.241 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.421 -6.266 -4.767 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.854 -7.080 -7.334 1.00 0.00 H new ATOM 0 HD11 LEU A 14 1.147 -6.003 -8.273 1.00 0.00 H new ATOM 0 HD12 LEU A 14 0.275 -4.933 -7.150 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.772 -5.740 -6.627 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.071 -8.470 -7.972 1.00 0.00 H new ATOM 0 HD22 LEU A 14 1.690 -8.368 -6.307 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.143 -9.184 -6.632 1.00 0.00 H new ATOM 234 N ILE A 15 -1.829 -7.413 -2.520 1.00 0.00 N ATOM 235 CA ILE A 15 -2.044 -7.149 -1.107 1.00 0.00 C ATOM 236 C ILE A 15 -1.866 -8.447 -0.317 1.00 0.00 C ATOM 237 O ILE A 15 -1.205 -8.460 0.720 1.00 0.00 O ATOM 238 CB ILE A 15 -3.402 -6.477 -0.889 1.00 0.00 C ATOM 239 CG1 ILE A 15 -3.385 -5.031 -1.388 1.00 0.00 C ATOM 240 CG2 ILE A 15 -3.831 -6.573 0.577 1.00 0.00 C ATOM 241 CD1 ILE A 15 -3.751 -4.959 -2.872 1.00 0.00 C ATOM 0 H ILE A 15 -2.625 -7.197 -3.121 1.00 0.00 H new ATOM 0 HA ILE A 15 -1.301 -6.444 -0.733 1.00 0.00 H new ATOM 0 HB ILE A 15 -4.147 -7.012 -1.479 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.088 -4.434 -0.807 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -2.396 -4.600 -1.232 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -4.799 -6.088 0.705 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -3.909 -7.621 0.865 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -3.091 -6.078 1.206 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -3.732 -3.920 -3.202 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -3.032 -5.537 -3.452 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -4.750 -5.368 -3.021 1.00 0.00 H new ATOM 253 N LYS A 16 -2.466 -9.507 -0.838 1.00 0.00 N ATOM 254 CA LYS A 16 -2.382 -10.806 -0.194 1.00 0.00 C ATOM 255 C LYS A 16 -0.913 -11.149 0.064 1.00 0.00 C ATOM 256 O LYS A 16 -0.587 -11.782 1.066 1.00 0.00 O ATOM 257 CB LYS A 16 -3.124 -11.861 -1.017 1.00 0.00 C ATOM 258 CG LYS A 16 -4.518 -12.124 -0.443 1.00 0.00 C ATOM 259 CD LYS A 16 -5.540 -12.337 -1.562 1.00 0.00 C ATOM 260 CE LYS A 16 -6.784 -13.058 -1.038 1.00 0.00 C ATOM 261 NZ LYS A 16 -7.984 -12.638 -1.796 1.00 0.00 N ATOM 0 H LYS A 16 -3.012 -9.492 -1.699 1.00 0.00 H new ATOM 0 HA LYS A 16 -2.880 -10.783 0.776 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -3.210 -11.527 -2.051 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -2.551 -12.788 -1.028 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -4.490 -13.003 0.201 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -4.824 -11.283 0.179 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -5.825 -11.375 -1.987 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -5.089 -12.919 -2.365 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -6.650 -14.136 -1.125 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -6.920 -12.838 0.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -8.823 -12.709 -1.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -7.868 -11.654 -2.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -8.105 -13.255 -2.624 1.00 0.00 H new ATOM 275 N LEU A 17 -0.067 -10.714 -0.858 1.00 0.00 N ATOM 276 CA LEU A 17 1.359 -10.966 -0.743 1.00 0.00 C ATOM 277 C LEU A 17 1.989 -9.907 0.164 1.00 0.00 C ATOM 278 O LEU A 17 3.066 -10.121 0.719 1.00 0.00 O ATOM 279 CB LEU A 17 2.002 -11.049 -2.129 1.00 0.00 C ATOM 280 CG LEU A 17 2.058 -12.442 -2.760 1.00 0.00 C ATOM 281 CD1 LEU A 17 1.756 -12.377 -4.258 1.00 0.00 C ATOM 282 CD2 LEU A 17 3.400 -13.120 -2.474 1.00 0.00 C ATOM 0 H LEU A 17 -0.342 -10.189 -1.688 1.00 0.00 H new ATOM 0 HA LEU A 17 1.538 -11.934 -0.275 1.00 0.00 H new ATOM 0 HB2 LEU A 17 1.455 -10.389 -2.802 1.00 0.00 H new ATOM 0 HB3 LEU A 17 3.019 -10.662 -2.060 1.00 0.00 H new ATOM 0 HG LEU A 17 1.283 -13.057 -2.302 1.00 0.00 H new ATOM 0 HD11 LEU A 17 1.802 -13.380 -4.682 1.00 0.00 H new ATOM 0 HD12 LEU A 17 0.759 -11.964 -4.411 1.00 0.00 H new ATOM 0 HD13 LEU A 17 2.491 -11.741 -4.750 1.00 0.00 H new ATOM 0 HD21 LEU A 17 3.414 -14.108 -2.933 1.00 0.00 H new ATOM 0 HD22 LEU A 17 4.208 -12.516 -2.888 1.00 0.00 H new ATOM 0 HD23 LEU A 17 3.536 -13.219 -1.397 1.00 0.00 H new ATOM 294 N ARG A 18 1.290 -8.788 0.287 1.00 0.00 N ATOM 295 CA ARG A 18 1.767 -7.696 1.118 1.00 0.00 C ATOM 296 C ARG A 18 1.592 -8.039 2.599 1.00 0.00 C ATOM 297 O ARG A 18 1.931 -7.239 3.469 1.00 0.00 O ATOM 298 CB ARG A 18 1.013 -6.400 0.810 1.00 0.00 C ATOM 299 CG ARG A 18 1.446 -5.822 -0.539 1.00 0.00 C ATOM 300 CD ARG A 18 0.463 -4.752 -1.018 1.00 0.00 C ATOM 301 NE ARG A 18 1.202 -3.564 -1.500 1.00 0.00 N ATOM 302 CZ ARG A 18 0.621 -2.410 -1.853 1.00 0.00 C ATOM 303 NH1 ARG A 18 -0.711 -2.280 -1.780 1.00 0.00 N ATOM 304 NH2 ARG A 18 1.371 -1.384 -2.279 1.00 0.00 N ATOM 0 H ARG A 18 0.397 -8.614 -0.175 1.00 0.00 H new ATOM 0 HA ARG A 18 2.825 -7.550 0.898 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -0.060 -6.593 0.800 1.00 0.00 H new ATOM 0 HB3 ARG A 18 1.198 -5.671 1.599 1.00 0.00 H new ATOM 0 HG2 ARG A 18 2.443 -5.391 -0.451 1.00 0.00 H new ATOM 0 HG3 ARG A 18 1.508 -6.621 -1.278 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -0.161 -5.152 -1.818 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -0.205 -4.469 -0.204 1.00 0.00 H new ATOM 0 HE ARG A 18 2.218 -3.628 -1.568 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -1.283 -3.060 -1.456 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -1.153 -1.401 -2.049 1.00 0.00 H new ATOM 0 HH21 ARG A 18 2.385 -1.482 -2.335 1.00 0.00 H new ATOM 0 HH22 ARG A 18 0.928 -0.505 -2.548 1.00 0.00 H new ATOM 318 N LYS A 19 1.063 -9.230 2.839 1.00 0.00 N ATOM 319 CA LYS A 19 0.839 -9.689 4.199 1.00 0.00 C ATOM 320 C LYS A 19 2.185 -10.010 4.852 1.00 0.00 C ATOM 321 O LYS A 19 2.260 -10.204 6.065 1.00 0.00 O ATOM 322 CB LYS A 19 -0.146 -10.860 4.214 1.00 0.00 C ATOM 323 CG LYS A 19 -0.601 -11.175 5.641 1.00 0.00 C ATOM 324 CD LYS A 19 0.042 -12.468 6.147 1.00 0.00 C ATOM 325 CE LYS A 19 -0.686 -13.695 5.594 1.00 0.00 C ATOM 326 NZ LYS A 19 -0.579 -14.830 6.537 1.00 0.00 N ATOM 0 H LYS A 19 0.783 -9.891 2.114 1.00 0.00 H new ATOM 0 HA LYS A 19 0.374 -8.903 4.794 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -1.012 -10.620 3.597 1.00 0.00 H new ATOM 0 HB3 LYS A 19 0.323 -11.741 3.775 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -0.336 -10.350 6.302 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -1.687 -11.269 5.668 1.00 0.00 H new ATOM 0 HD2 LYS A 19 1.090 -12.498 5.849 1.00 0.00 H new ATOM 0 HD3 LYS A 19 0.019 -12.488 7.237 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -1.735 -13.456 5.422 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -0.260 -13.974 4.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -1.078 -15.654 6.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 0.423 -15.068 6.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -1.006 -14.566 7.448 1.00 0.00 H new ATOM 340 N LYS A 20 3.215 -10.055 4.020 1.00 0.00 N ATOM 341 CA LYS A 20 4.554 -10.349 4.501 1.00 0.00 C ATOM 342 C LYS A 20 5.506 -9.235 4.061 1.00 0.00 C ATOM 343 O LYS A 20 6.706 -9.299 4.322 1.00 0.00 O ATOM 344 CB LYS A 20 4.991 -11.745 4.052 1.00 0.00 C ATOM 345 CG LYS A 20 5.252 -12.652 5.256 1.00 0.00 C ATOM 346 CD LYS A 20 6.746 -12.710 5.584 1.00 0.00 C ATOM 347 CE LYS A 20 7.492 -13.599 4.587 1.00 0.00 C ATOM 348 NZ LYS A 20 8.801 -13.002 4.240 1.00 0.00 N ATOM 0 H LYS A 20 3.149 -9.893 3.015 1.00 0.00 H new ATOM 0 HA LYS A 20 4.571 -10.371 5.591 1.00 0.00 H new ATOM 0 HB2 LYS A 20 4.220 -12.186 3.421 1.00 0.00 H new ATOM 0 HB3 LYS A 20 5.894 -11.670 3.446 1.00 0.00 H new ATOM 0 HG2 LYS A 20 4.700 -12.283 6.120 1.00 0.00 H new ATOM 0 HG3 LYS A 20 4.883 -13.656 5.047 1.00 0.00 H new ATOM 0 HD2 LYS A 20 7.166 -11.704 5.565 1.00 0.00 H new ATOM 0 HD3 LYS A 20 6.886 -13.094 6.594 1.00 0.00 H new ATOM 0 HE2 LYS A 20 7.640 -14.591 5.014 1.00 0.00 H new ATOM 0 HE3 LYS A 20 6.893 -13.727 3.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 9.295 -13.618 3.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 8.653 -12.065 3.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 9.376 -12.903 5.101 1.00 0.00 H new ATOM 362 N LYS A 21 4.934 -8.239 3.400 1.00 0.00 N ATOM 363 CA LYS A 21 5.716 -7.112 2.920 1.00 0.00 C ATOM 364 C LYS A 21 5.181 -5.823 3.546 1.00 0.00 C ATOM 365 O LYS A 21 5.252 -5.642 4.760 1.00 0.00 O ATOM 366 CB LYS A 21 5.742 -7.090 1.391 1.00 0.00 C ATOM 367 CG LYS A 21 6.349 -8.379 0.833 1.00 0.00 C ATOM 368 CD LYS A 21 5.838 -8.658 -0.582 1.00 0.00 C ATOM 369 CE LYS A 21 5.979 -10.140 -0.933 1.00 0.00 C ATOM 370 NZ LYS A 21 7.392 -10.473 -1.222 1.00 0.00 N ATOM 0 H LYS A 21 3.938 -8.189 3.186 1.00 0.00 H new ATOM 0 HA LYS A 21 6.756 -7.209 3.231 1.00 0.00 H new ATOM 0 HB2 LYS A 21 4.729 -6.966 1.009 1.00 0.00 H new ATOM 0 HB3 LYS A 21 6.320 -6.233 1.046 1.00 0.00 H new ATOM 0 HG2 LYS A 21 7.436 -8.298 0.822 1.00 0.00 H new ATOM 0 HG3 LYS A 21 6.098 -9.215 1.486 1.00 0.00 H new ATOM 0 HD2 LYS A 21 4.792 -8.360 -0.660 1.00 0.00 H new ATOM 0 HD3 LYS A 21 6.396 -8.056 -1.299 1.00 0.00 H new ATOM 0 HE2 LYS A 21 5.617 -10.751 -0.106 1.00 0.00 H new ATOM 0 HE3 LYS A 21 5.360 -10.375 -1.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 7.469 -11.483 -1.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 7.726 -9.903 -2.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 7.975 -10.268 -0.386 1.00 0.00 H new ATOM 384 N ILE A 22 4.659 -4.959 2.688 1.00 0.00 N ATOM 385 CA ILE A 22 4.112 -3.691 3.141 1.00 0.00 C ATOM 386 C ILE A 22 3.326 -3.043 2.000 1.00 0.00 C ATOM 387 O ILE A 22 3.330 -3.543 0.876 1.00 0.00 O ATOM 388 CB ILE A 22 5.220 -2.802 3.707 1.00 0.00 C ATOM 389 CG1 ILE A 22 5.169 -2.768 5.236 1.00 0.00 C ATOM 390 CG2 ILE A 22 5.161 -1.399 3.100 1.00 0.00 C ATOM 391 CD1 ILE A 22 3.787 -2.333 5.728 1.00 0.00 C ATOM 0 H ILE A 22 4.603 -5.112 1.681 1.00 0.00 H new ATOM 0 HA ILE A 22 3.412 -3.849 3.961 1.00 0.00 H new ATOM 0 HB ILE A 22 6.181 -3.234 3.427 1.00 0.00 H new ATOM 0 HG12 ILE A 22 5.407 -3.755 5.634 1.00 0.00 H new ATOM 0 HG13 ILE A 22 5.926 -2.081 5.614 1.00 0.00 H new ATOM 0 HG21 ILE A 22 5.960 -0.787 3.520 1.00 0.00 H new ATOM 0 HG22 ILE A 22 5.284 -1.465 2.019 1.00 0.00 H new ATOM 0 HG23 ILE A 22 4.197 -0.944 3.328 1.00 0.00 H new ATOM 0 HD11 ILE A 22 3.777 -2.317 6.818 1.00 0.00 H new ATOM 0 HD12 ILE A 22 3.563 -1.336 5.348 1.00 0.00 H new ATOM 0 HD13 ILE A 22 3.035 -3.036 5.369 1.00 0.00 H new ATOM 403 N GLU A 23 2.670 -1.939 2.328 1.00 0.00 N ATOM 404 CA GLU A 23 1.881 -1.217 1.344 1.00 0.00 C ATOM 405 C GLU A 23 1.985 0.290 1.583 1.00 0.00 C ATOM 406 O GLU A 23 1.477 0.801 2.580 1.00 0.00 O ATOM 407 CB GLU A 23 0.421 -1.677 1.368 1.00 0.00 C ATOM 408 CG GLU A 23 -0.468 -0.718 0.574 1.00 0.00 C ATOM 409 CD GLU A 23 -1.889 -1.271 0.441 1.00 0.00 C ATOM 410 OE1 GLU A 23 -2.173 -2.275 1.129 1.00 0.00 O ATOM 411 OE2 GLU A 23 -2.657 -0.677 -0.345 1.00 0.00 O ATOM 0 H GLU A 23 2.669 -1.527 3.261 1.00 0.00 H new ATOM 0 HA GLU A 23 2.281 -1.436 0.354 1.00 0.00 H new ATOM 0 HB2 GLU A 23 0.345 -2.680 0.949 1.00 0.00 H new ATOM 0 HB3 GLU A 23 0.071 -1.735 2.399 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -0.496 0.252 1.070 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -0.042 -0.557 -0.416 1.00 0.00 H new ATOM 418 N GLY A 24 2.648 0.960 0.652 1.00 0.00 N ATOM 419 CA GLY A 24 2.825 2.399 0.749 1.00 0.00 C ATOM 420 C GLY A 24 1.800 3.137 -0.115 1.00 0.00 C ATOM 421 O GLY A 24 1.153 2.534 -0.969 1.00 0.00 O ATOM 0 H GLY A 24 3.069 0.533 -0.173 1.00 0.00 H new ATOM 0 HA2 GLY A 24 2.723 2.712 1.788 1.00 0.00 H new ATOM 0 HA3 GLY A 24 3.833 2.667 0.433 1.00 0.00 H new ATOM 425 N ARG A 25 1.684 4.433 0.139 1.00 0.00 N ATOM 426 CA ARG A 25 0.748 5.260 -0.604 1.00 0.00 C ATOM 427 C ARG A 25 0.744 6.686 -0.050 1.00 0.00 C ATOM 428 O ARG A 25 0.454 6.898 1.126 1.00 0.00 O ATOM 429 CB ARG A 25 -0.670 4.688 -0.532 1.00 0.00 C ATOM 430 CG ARG A 25 -1.670 5.616 -1.224 1.00 0.00 C ATOM 431 CD ARG A 25 -3.109 5.229 -0.875 1.00 0.00 C ATOM 432 NE ARG A 25 -3.739 4.537 -2.022 1.00 0.00 N ATOM 433 CZ ARG A 25 -5.059 4.341 -2.148 1.00 0.00 C ATOM 434 NH1 ARG A 25 -5.895 4.783 -1.199 1.00 0.00 N ATOM 435 NH2 ARG A 25 -5.542 3.703 -3.223 1.00 0.00 N ATOM 0 H ARG A 25 2.222 4.930 0.849 1.00 0.00 H new ATOM 0 HA ARG A 25 1.070 5.272 -1.645 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -0.694 3.705 -1.003 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -0.958 4.549 0.510 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -1.484 6.647 -0.923 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -1.529 5.569 -2.304 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -3.118 4.581 0.001 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -3.682 6.120 -0.618 1.00 0.00 H new ATOM 0 HE ARG A 25 -3.131 4.188 -2.763 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -5.527 5.269 -0.381 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -6.900 4.634 -1.295 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -4.905 3.367 -3.945 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -6.546 3.554 -3.319 1.00 0.00 H new ATOM 449 N LEU A 26 1.070 7.627 -0.924 1.00 0.00 N ATOM 450 CA LEU A 26 1.109 9.027 -0.537 1.00 0.00 C ATOM 451 C LEU A 26 -0.039 9.315 0.432 1.00 0.00 C ATOM 452 O LEU A 26 -1.196 9.016 0.137 1.00 0.00 O ATOM 453 CB LEU A 26 1.108 9.925 -1.776 1.00 0.00 C ATOM 454 CG LEU A 26 0.301 11.221 -1.664 1.00 0.00 C ATOM 455 CD1 LEU A 26 1.030 12.246 -0.794 1.00 0.00 C ATOM 456 CD2 LEU A 26 -0.034 11.779 -3.049 1.00 0.00 C ATOM 0 H LEU A 26 1.310 7.447 -1.899 1.00 0.00 H new ATOM 0 HA LEU A 26 2.036 9.251 -0.010 1.00 0.00 H new ATOM 0 HB2 LEU A 26 2.140 10.182 -2.015 1.00 0.00 H new ATOM 0 HB3 LEU A 26 0.720 9.350 -2.617 1.00 0.00 H new ATOM 0 HG LEU A 26 -0.644 10.994 -1.171 1.00 0.00 H new ATOM 0 HD11 LEU A 26 0.436 13.158 -0.730 1.00 0.00 H new ATOM 0 HD12 LEU A 26 1.175 11.837 0.206 1.00 0.00 H new ATOM 0 HD13 LEU A 26 1.999 12.475 -1.237 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -0.608 12.700 -2.941 1.00 0.00 H new ATOM 0 HD22 LEU A 26 0.889 11.988 -3.590 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -0.622 11.048 -3.603 1.00 0.00 H new ATOM 468 N TYR A 27 0.320 9.892 1.569 1.00 0.00 N ATOM 469 CA TYR A 27 -0.666 10.224 2.584 1.00 0.00 C ATOM 470 C TYR A 27 -1.632 11.298 2.079 1.00 0.00 C ATOM 471 O TYR A 27 -1.265 12.466 1.970 1.00 0.00 O ATOM 472 CB TYR A 27 0.122 10.781 3.771 1.00 0.00 C ATOM 473 CG TYR A 27 -0.668 10.818 5.081 1.00 0.00 C ATOM 474 CD1 TYR A 27 -1.510 9.775 5.408 1.00 0.00 C ATOM 475 CD2 TYR A 27 -0.540 11.895 5.934 1.00 0.00 C ATOM 476 CE1 TYR A 27 -2.254 9.810 6.640 1.00 0.00 C ATOM 477 CE2 TYR A 27 -1.284 11.930 7.166 1.00 0.00 C ATOM 478 CZ TYR A 27 -2.104 10.885 7.459 1.00 0.00 C ATOM 479 OH TYR A 27 -2.807 10.918 8.623 1.00 0.00 O ATOM 0 H TYR A 27 1.280 10.138 1.810 1.00 0.00 H new ATOM 0 HA TYR A 27 -1.255 9.346 2.849 1.00 0.00 H new ATOM 0 HB2 TYR A 27 1.017 10.176 3.916 1.00 0.00 H new ATOM 0 HB3 TYR A 27 0.455 11.791 3.531 1.00 0.00 H new ATOM 0 HD1 TYR A 27 -1.611 8.933 4.740 1.00 0.00 H new ATOM 0 HD2 TYR A 27 0.118 12.712 5.677 1.00 0.00 H new ATOM 0 HE1 TYR A 27 -2.917 9.000 6.908 1.00 0.00 H new ATOM 0 HE2 TYR A 27 -1.193 12.767 7.842 1.00 0.00 H new ATOM 0 HH TYR A 27 -2.600 11.745 9.107 1.00 0.00 H new ATOM 489 N ASP A 28 -2.849 10.862 1.785 1.00 0.00 N ATOM 490 CA ASP A 28 -3.871 11.772 1.295 1.00 0.00 C ATOM 491 C ASP A 28 -4.866 12.067 2.419 1.00 0.00 C ATOM 492 O ASP A 28 -4.563 11.859 3.592 1.00 0.00 O ATOM 493 CB ASP A 28 -4.643 11.154 0.128 1.00 0.00 C ATOM 494 CG ASP A 28 -3.881 10.086 -0.659 1.00 0.00 C ATOM 495 OD1 ASP A 28 -2.760 10.406 -1.110 1.00 0.00 O ATOM 496 OD2 ASP A 28 -4.437 8.975 -0.793 1.00 0.00 O ATOM 0 H ASP A 28 -3.150 9.892 1.877 1.00 0.00 H new ATOM 0 HA ASP A 28 -3.379 12.684 0.958 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -5.562 10.713 0.513 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -4.934 11.950 -0.557 1.00 0.00 H new ATOM 501 N GLU A 29 -6.035 12.546 2.019 1.00 0.00 N ATOM 502 CA GLU A 29 -7.078 12.871 2.978 1.00 0.00 C ATOM 503 C GLU A 29 -7.757 11.594 3.477 1.00 0.00 C ATOM 504 O GLU A 29 -8.065 11.474 4.662 1.00 0.00 O ATOM 505 CB GLU A 29 -8.100 13.834 2.370 1.00 0.00 C ATOM 506 CG GLU A 29 -7.507 15.236 2.216 1.00 0.00 C ATOM 507 CD GLU A 29 -8.183 16.225 3.168 1.00 0.00 C ATOM 508 OE1 GLU A 29 -8.252 15.896 4.372 1.00 0.00 O ATOM 509 OE2 GLU A 29 -8.614 17.288 2.671 1.00 0.00 O ATOM 0 H GLU A 29 -6.283 12.717 1.044 1.00 0.00 H new ATOM 0 HA GLU A 29 -6.618 13.371 3.830 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -8.422 13.462 1.397 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -8.986 13.877 3.003 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -6.436 15.206 2.417 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -7.628 15.575 1.187 1.00 0.00 H new ATOM 516 N LYS A 30 -7.970 10.674 2.549 1.00 0.00 N ATOM 517 CA LYS A 30 -8.607 9.410 2.880 1.00 0.00 C ATOM 518 C LYS A 30 -7.692 8.611 3.809 1.00 0.00 C ATOM 519 O LYS A 30 -8.162 7.966 4.746 1.00 0.00 O ATOM 520 CB LYS A 30 -9.000 8.658 1.607 1.00 0.00 C ATOM 521 CG LYS A 30 -10.421 9.021 1.172 1.00 0.00 C ATOM 522 CD LYS A 30 -10.816 8.263 -0.097 1.00 0.00 C ATOM 523 CE LYS A 30 -12.191 7.609 0.061 1.00 0.00 C ATOM 524 NZ LYS A 30 -12.544 6.844 -1.155 1.00 0.00 N ATOM 0 H LYS A 30 -7.713 10.778 1.567 1.00 0.00 H new ATOM 0 HA LYS A 30 -9.538 9.583 3.420 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -8.299 8.898 0.808 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -8.932 7.584 1.779 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -11.122 8.786 1.973 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -10.488 10.094 0.995 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -10.830 8.948 -0.945 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -10.069 7.500 -0.317 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -12.188 6.946 0.926 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -12.945 8.374 0.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -13.480 6.407 -1.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -12.567 7.485 -1.974 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -11.834 6.102 -1.316 1.00 0.00 H new ATOM 538 N ARG A 31 -6.401 8.678 3.518 1.00 0.00 N ATOM 539 CA ARG A 31 -5.415 7.969 4.316 1.00 0.00 C ATOM 540 C ARG A 31 -5.355 8.553 5.728 1.00 0.00 C ATOM 541 O ARG A 31 -5.063 7.840 6.687 1.00 0.00 O ATOM 542 CB ARG A 31 -4.027 8.051 3.677 1.00 0.00 C ATOM 543 CG ARG A 31 -4.002 7.335 2.326 1.00 0.00 C ATOM 544 CD ARG A 31 -3.707 5.844 2.501 1.00 0.00 C ATOM 545 NE ARG A 31 -4.884 5.044 2.091 1.00 0.00 N ATOM 546 CZ ARG A 31 -5.022 3.734 2.334 1.00 0.00 C ATOM 547 NH1 ARG A 31 -4.059 3.067 2.984 1.00 0.00 N ATOM 548 NH2 ARG A 31 -6.124 3.090 1.925 1.00 0.00 N ATOM 0 H ARG A 31 -6.015 9.213 2.740 1.00 0.00 H new ATOM 0 HA ARG A 31 -5.718 6.923 4.365 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -3.745 9.096 3.544 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -3.289 7.604 4.343 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -4.961 7.463 1.825 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -3.245 7.786 1.685 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -2.840 5.564 1.903 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -3.458 5.634 3.541 1.00 0.00 H new ATOM 0 HE ARG A 31 -5.636 5.520 1.593 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -3.220 3.557 3.294 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -4.165 2.069 3.169 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -6.857 3.597 1.429 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -6.230 2.092 2.110 1.00 0.00 H new ATOM 562 N ARG A 32 -5.636 9.845 5.812 1.00 0.00 N ATOM 563 CA ARG A 32 -5.618 10.534 7.091 1.00 0.00 C ATOM 564 C ARG A 32 -6.678 9.946 8.026 1.00 0.00 C ATOM 565 O ARG A 32 -6.463 9.853 9.233 1.00 0.00 O ATOM 566 CB ARG A 32 -5.877 12.031 6.915 1.00 0.00 C ATOM 567 CG ARG A 32 -4.563 12.806 6.801 1.00 0.00 C ATOM 568 CD ARG A 32 -4.807 14.229 6.297 1.00 0.00 C ATOM 569 NE ARG A 32 -4.392 15.209 7.326 1.00 0.00 N ATOM 570 CZ ARG A 32 -4.733 16.505 7.310 1.00 0.00 C ATOM 571 NH1 ARG A 32 -5.496 16.985 6.319 1.00 0.00 N ATOM 572 NH2 ARG A 32 -4.310 17.321 8.285 1.00 0.00 N ATOM 0 H ARG A 32 -5.878 10.433 5.014 1.00 0.00 H new ATOM 0 HA ARG A 32 -4.628 10.398 7.527 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -6.480 12.197 6.022 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -6.452 12.406 7.762 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -4.072 12.840 7.773 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -3.888 12.286 6.121 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -4.249 14.398 5.376 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -5.862 14.364 6.060 1.00 0.00 H new ATOM 0 HE ARG A 32 -3.810 14.877 8.095 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -5.818 16.364 5.576 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -5.755 17.971 6.307 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -3.729 16.956 9.039 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -4.569 18.307 8.273 1.00 0.00 H new ATOM 586 N GLN A 33 -7.799 9.565 7.431 1.00 0.00 N ATOM 587 CA GLN A 33 -8.892 8.989 8.195 1.00 0.00 C ATOM 588 C GLN A 33 -8.548 7.561 8.621 1.00 0.00 C ATOM 589 O GLN A 33 -9.060 7.068 9.625 1.00 0.00 O ATOM 590 CB GLN A 33 -10.197 9.024 7.397 1.00 0.00 C ATOM 591 CG GLN A 33 -11.267 9.836 8.130 1.00 0.00 C ATOM 592 CD GLN A 33 -12.341 10.330 7.159 1.00 0.00 C ATOM 593 OE1 GLN A 33 -12.424 11.502 6.829 1.00 0.00 O ATOM 594 NE2 GLN A 33 -13.156 9.375 6.721 1.00 0.00 N ATOM 0 H GLN A 33 -7.974 9.644 6.429 1.00 0.00 H new ATOM 0 HA GLN A 33 -9.037 9.590 9.093 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -10.015 9.459 6.414 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -10.555 8.007 7.234 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -11.727 9.223 8.905 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -10.804 10.687 8.630 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -13.031 8.413 7.037 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -13.906 9.604 6.069 1.00 0.00 H new ATOM 603 N ILE A 34 -7.683 6.936 7.836 1.00 0.00 N ATOM 604 CA ILE A 34 -7.264 5.573 8.119 1.00 0.00 C ATOM 605 C ILE A 34 -6.379 5.565 9.367 1.00 0.00 C ATOM 606 O ILE A 34 -5.484 6.397 9.503 1.00 0.00 O ATOM 607 CB ILE A 34 -6.599 4.951 6.889 1.00 0.00 C ATOM 608 CG1 ILE A 34 -7.600 4.798 5.743 1.00 0.00 C ATOM 609 CG2 ILE A 34 -5.925 3.624 7.243 1.00 0.00 C ATOM 610 CD1 ILE A 34 -6.879 4.576 4.411 1.00 0.00 C ATOM 0 H ILE A 34 -7.261 7.348 7.004 1.00 0.00 H new ATOM 0 HA ILE A 34 -8.128 4.946 8.337 1.00 0.00 H new ATOM 0 HB ILE A 34 -5.817 5.628 6.544 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -8.264 3.958 5.945 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -8.224 5.690 5.679 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -5.460 3.203 6.352 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -5.163 3.794 8.004 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -6.671 2.928 7.626 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -7.614 4.470 3.613 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -6.234 5.429 4.200 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -6.275 3.670 4.471 1.00 0.00 H new ATOM 622 N LYS A 35 -6.661 4.615 10.247 1.00 0.00 N ATOM 623 CA LYS A 35 -5.902 4.488 11.479 1.00 0.00 C ATOM 624 C LYS A 35 -5.792 3.009 11.855 1.00 0.00 C ATOM 625 O LYS A 35 -6.437 2.159 11.242 1.00 0.00 O ATOM 626 CB LYS A 35 -6.516 5.357 12.578 1.00 0.00 C ATOM 627 CG LYS A 35 -7.546 4.569 13.390 1.00 0.00 C ATOM 628 CD LYS A 35 -8.805 5.403 13.635 1.00 0.00 C ATOM 629 CE LYS A 35 -8.563 6.457 14.718 1.00 0.00 C ATOM 630 NZ LYS A 35 -9.786 7.259 14.944 1.00 0.00 N ATOM 0 H LYS A 35 -7.404 3.926 10.131 1.00 0.00 H new ATOM 0 HA LYS A 35 -4.886 4.859 11.341 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -5.730 5.723 13.239 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -6.991 6.231 12.132 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -7.809 3.654 12.860 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -7.111 4.271 14.344 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -9.108 5.891 12.709 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -9.625 4.750 13.934 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -8.263 5.971 15.646 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -7.742 7.110 14.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -9.604 7.969 15.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -10.055 7.738 14.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -10.560 6.634 15.248 1.00 0.00 H new ATOM 644 N PRO A 36 -4.949 2.739 12.886 1.00 0.00 N ATOM 645 CA PRO A 36 -4.746 1.377 13.351 1.00 0.00 C ATOM 646 C PRO A 36 -5.948 0.889 14.161 1.00 0.00 C ATOM 647 O PRO A 36 -6.185 1.361 15.272 1.00 0.00 O ATOM 648 CB PRO A 36 -3.462 1.426 14.163 1.00 0.00 C ATOM 649 CG PRO A 36 -3.245 2.889 14.512 1.00 0.00 C ATOM 650 CD PRO A 36 -4.168 3.719 13.636 1.00 0.00 C ATOM 0 HA PRO A 36 -4.657 0.662 12.533 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -3.546 0.818 15.064 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -2.622 1.032 13.590 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -3.458 3.066 15.566 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -2.205 3.171 14.346 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -4.811 4.362 14.237 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -3.602 4.369 12.968 1.00 0.00 H new ATOM 658 N GLY A 37 -6.676 -0.049 13.573 1.00 0.00 N ATOM 659 CA GLY A 37 -7.848 -0.606 14.227 1.00 0.00 C ATOM 660 C GLY A 37 -9.074 -0.527 13.315 1.00 0.00 C ATOM 661 O GLY A 37 -10.111 0.007 13.707 1.00 0.00 O ATOM 0 H GLY A 37 -6.477 -0.437 12.651 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -7.658 -1.645 14.498 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -8.044 -0.065 15.153 1.00 0.00 H new ATOM 665 N ASP A 38 -8.915 -1.066 12.115 1.00 0.00 N ATOM 666 CA ASP A 38 -9.996 -1.063 11.144 1.00 0.00 C ATOM 667 C ASP A 38 -9.697 -2.091 10.051 1.00 0.00 C ATOM 668 O ASP A 38 -8.628 -2.699 10.042 1.00 0.00 O ATOM 669 CB ASP A 38 -10.135 0.307 10.478 1.00 0.00 C ATOM 670 CG ASP A 38 -8.860 1.153 10.468 1.00 0.00 C ATOM 671 OD1 ASP A 38 -7.924 0.761 9.738 1.00 0.00 O ATOM 672 OD2 ASP A 38 -8.850 2.173 11.190 1.00 0.00 O ATOM 0 H ASP A 38 -8.054 -1.508 11.793 1.00 0.00 H new ATOM 0 HA ASP A 38 -10.920 -1.305 11.669 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -10.465 0.162 9.449 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -10.919 0.865 10.989 1.00 0.00 H new ATOM 677 N VAL A 39 -10.661 -2.255 9.157 1.00 0.00 N ATOM 678 CA VAL A 39 -10.514 -3.199 8.063 1.00 0.00 C ATOM 679 C VAL A 39 -10.967 -2.537 6.760 1.00 0.00 C ATOM 680 O VAL A 39 -11.965 -1.818 6.739 1.00 0.00 O ATOM 681 CB VAL A 39 -11.279 -4.487 8.376 1.00 0.00 C ATOM 682 CG1 VAL A 39 -10.945 -5.583 7.363 1.00 0.00 C ATOM 683 CG2 VAL A 39 -10.997 -4.957 9.805 1.00 0.00 C ATOM 0 H VAL A 39 -11.547 -1.750 9.168 1.00 0.00 H new ATOM 0 HA VAL A 39 -9.468 -3.480 7.939 1.00 0.00 H new ATOM 0 HB VAL A 39 -12.345 -4.272 8.297 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -11.502 -6.487 7.608 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -11.218 -5.249 6.362 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -9.876 -5.795 7.395 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -11.552 -5.874 10.003 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -9.930 -5.147 9.922 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -11.308 -4.186 10.510 1.00 0.00 H new ATOM 693 N ILE A 40 -10.212 -2.804 5.704 1.00 0.00 N ATOM 694 CA ILE A 40 -10.523 -2.243 4.400 1.00 0.00 C ATOM 695 C ILE A 40 -10.967 -3.366 3.460 1.00 0.00 C ATOM 696 O ILE A 40 -10.453 -4.481 3.532 1.00 0.00 O ATOM 697 CB ILE A 40 -9.341 -1.429 3.871 1.00 0.00 C ATOM 698 CG1 ILE A 40 -8.776 -0.512 4.958 1.00 0.00 C ATOM 699 CG2 ILE A 40 -9.730 -0.653 2.611 1.00 0.00 C ATOM 700 CD1 ILE A 40 -7.302 -0.197 4.697 1.00 0.00 C ATOM 0 H ILE A 40 -9.386 -3.401 5.725 1.00 0.00 H new ATOM 0 HA ILE A 40 -11.354 -1.542 4.475 1.00 0.00 H new ATOM 0 HB ILE A 40 -8.548 -2.122 3.590 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -9.349 0.414 4.991 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -8.883 -0.988 5.933 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -8.872 -0.083 2.255 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -10.047 -1.352 1.837 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -10.548 0.029 2.842 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -6.925 0.456 5.484 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -6.728 -1.124 4.688 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -7.202 0.301 3.733 1.00 0.00 H new ATOM 712 N SER A 41 -11.918 -3.032 2.599 1.00 0.00 N ATOM 713 CA SER A 41 -12.437 -3.998 1.646 1.00 0.00 C ATOM 714 C SER A 41 -12.022 -3.607 0.226 1.00 0.00 C ATOM 715 O SER A 41 -11.897 -2.423 -0.084 1.00 0.00 O ATOM 716 CB SER A 41 -13.960 -4.105 1.744 1.00 0.00 C ATOM 717 OG SER A 41 -14.544 -4.540 0.519 1.00 0.00 O ATOM 0 H SER A 41 -12.342 -2.106 2.542 1.00 0.00 H new ATOM 0 HA SER A 41 -12.016 -4.974 1.885 1.00 0.00 H new ATOM 0 HB2 SER A 41 -14.224 -4.802 2.539 1.00 0.00 H new ATOM 0 HB3 SER A 41 -14.375 -3.135 2.019 1.00 0.00 H new ATOM 0 HG SER A 41 -15.410 -4.961 0.701 1.00 0.00 H new ATOM 723 N PHE A 42 -11.820 -4.624 -0.598 1.00 0.00 N ATOM 724 CA PHE A 42 -11.422 -4.402 -1.978 1.00 0.00 C ATOM 725 C PHE A 42 -12.332 -5.166 -2.941 1.00 0.00 C ATOM 726 O PHE A 42 -12.581 -6.356 -2.754 1.00 0.00 O ATOM 727 CB PHE A 42 -9.992 -4.927 -2.121 1.00 0.00 C ATOM 728 CG PHE A 42 -8.920 -3.961 -1.612 1.00 0.00 C ATOM 729 CD1 PHE A 42 -8.827 -2.711 -2.138 1.00 0.00 C ATOM 730 CD2 PHE A 42 -8.061 -4.353 -0.634 1.00 0.00 C ATOM 731 CE1 PHE A 42 -7.832 -1.814 -1.666 1.00 0.00 C ATOM 732 CE2 PHE A 42 -7.066 -3.457 -0.162 1.00 0.00 C ATOM 733 CZ PHE A 42 -6.972 -2.206 -0.688 1.00 0.00 C ATOM 0 H PHE A 42 -11.924 -5.604 -0.337 1.00 0.00 H new ATOM 0 HA PHE A 42 -11.492 -3.341 -2.219 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -9.906 -5.868 -1.578 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -9.800 -5.146 -3.171 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -9.510 -2.400 -2.915 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -8.135 -5.346 -0.216 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -7.758 -0.821 -2.084 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -6.384 -3.769 0.615 1.00 0.00 H new ATOM 0 HZ PHE A 42 -6.215 -1.524 -0.329 1.00 0.00 H new ATOM 743 N GLU A 43 -12.805 -4.450 -3.952 1.00 0.00 N ATOM 744 CA GLU A 43 -13.682 -5.046 -4.945 1.00 0.00 C ATOM 745 C GLU A 43 -14.936 -5.610 -4.275 1.00 0.00 C ATOM 746 O GLU A 43 -15.443 -6.656 -4.679 1.00 0.00 O ATOM 747 CB GLU A 43 -12.952 -6.128 -5.743 1.00 0.00 C ATOM 748 CG GLU A 43 -12.283 -5.536 -6.985 1.00 0.00 C ATOM 749 CD GLU A 43 -13.324 -4.956 -7.945 1.00 0.00 C ATOM 750 OE1 GLU A 43 -13.907 -5.760 -8.703 1.00 0.00 O ATOM 751 OE2 GLU A 43 -13.512 -3.721 -7.899 1.00 0.00 O ATOM 0 H GLU A 43 -12.597 -3.463 -4.104 1.00 0.00 H new ATOM 0 HA GLU A 43 -13.987 -4.269 -5.646 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -12.201 -6.605 -5.113 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -13.658 -6.904 -6.040 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -11.582 -4.756 -6.688 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -11.704 -6.307 -7.493 1.00 0.00 H new ATOM 758 N GLY A 44 -15.400 -4.894 -3.261 1.00 0.00 N ATOM 759 CA GLY A 44 -16.586 -5.311 -2.531 1.00 0.00 C ATOM 760 C GLY A 44 -16.209 -6.151 -1.309 1.00 0.00 C ATOM 761 O GLY A 44 -16.483 -5.761 -0.175 1.00 0.00 O ATOM 0 H GLY A 44 -14.976 -4.028 -2.928 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -17.150 -4.434 -2.214 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -17.237 -5.888 -3.187 1.00 0.00 H new ATOM 765 N GLY A 45 -15.588 -7.289 -1.582 1.00 0.00 N ATOM 766 CA GLY A 45 -15.171 -8.188 -0.519 1.00 0.00 C ATOM 767 C GLY A 45 -14.298 -9.318 -1.067 1.00 0.00 C ATOM 768 O GLY A 45 -14.306 -10.427 -0.536 1.00 0.00 O ATOM 0 H GLY A 45 -15.363 -7.609 -2.524 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -14.618 -7.631 0.237 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -16.049 -8.608 -0.028 1.00 0.00 H new ATOM 772 N LYS A 46 -13.565 -8.997 -2.124 1.00 0.00 N ATOM 773 CA LYS A 46 -12.688 -9.972 -2.750 1.00 0.00 C ATOM 774 C LYS A 46 -11.444 -10.165 -1.880 1.00 0.00 C ATOM 775 O LYS A 46 -10.896 -11.263 -1.810 1.00 0.00 O ATOM 776 CB LYS A 46 -12.375 -9.563 -4.190 1.00 0.00 C ATOM 777 CG LYS A 46 -12.117 -10.791 -5.065 1.00 0.00 C ATOM 778 CD LYS A 46 -10.617 -11.054 -5.214 1.00 0.00 C ATOM 779 CE LYS A 46 -10.327 -11.885 -6.465 1.00 0.00 C ATOM 780 NZ LYS A 46 -9.189 -12.801 -6.227 1.00 0.00 N ATOM 0 H LYS A 46 -13.561 -8.076 -2.562 1.00 0.00 H new ATOM 0 HA LYS A 46 -13.182 -10.941 -2.819 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -13.207 -8.990 -4.598 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -11.501 -8.911 -4.205 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -12.601 -11.663 -4.625 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -12.563 -10.641 -6.048 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -10.082 -10.106 -5.271 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -10.247 -11.577 -4.332 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -11.212 -12.459 -6.741 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -10.101 -11.225 -7.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -9.006 -13.357 -7.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -8.342 -12.247 -5.986 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -9.418 -13.443 -5.441 1.00 0.00 H new ATOM 794 N LEU A 47 -11.035 -9.079 -1.240 1.00 0.00 N ATOM 795 CA LEU A 47 -9.865 -9.115 -0.379 1.00 0.00 C ATOM 796 C LEU A 47 -10.010 -8.054 0.714 1.00 0.00 C ATOM 797 O LEU A 47 -10.163 -6.870 0.419 1.00 0.00 O ATOM 798 CB LEU A 47 -8.586 -8.975 -1.206 1.00 0.00 C ATOM 799 CG LEU A 47 -7.278 -9.282 -0.474 1.00 0.00 C ATOM 800 CD1 LEU A 47 -6.649 -8.004 0.085 1.00 0.00 C ATOM 801 CD2 LEU A 47 -7.491 -10.338 0.612 1.00 0.00 C ATOM 0 H LEU A 47 -11.493 -8.169 -1.300 1.00 0.00 H new ATOM 0 HA LEU A 47 -9.789 -10.081 0.121 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -8.660 -9.637 -2.069 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -8.534 -7.956 -1.589 1.00 0.00 H new ATOM 0 HG LEU A 47 -6.574 -9.699 -1.194 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -5.721 -8.251 0.600 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -6.438 -7.315 -0.733 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -7.340 -7.535 0.786 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -6.545 -10.537 1.116 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -8.219 -9.973 1.337 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -7.861 -11.257 0.158 1.00 0.00 H new ATOM 813 N LYS A 48 -9.957 -8.517 1.955 1.00 0.00 N ATOM 814 CA LYS A 48 -10.080 -7.622 3.093 1.00 0.00 C ATOM 815 C LYS A 48 -8.727 -7.511 3.797 1.00 0.00 C ATOM 816 O LYS A 48 -7.981 -8.486 3.876 1.00 0.00 O ATOM 817 CB LYS A 48 -11.216 -8.078 4.012 1.00 0.00 C ATOM 818 CG LYS A 48 -12.498 -8.329 3.216 1.00 0.00 C ATOM 819 CD LYS A 48 -13.341 -7.055 3.120 1.00 0.00 C ATOM 820 CE LYS A 48 -14.826 -7.364 3.320 1.00 0.00 C ATOM 821 NZ LYS A 48 -15.328 -6.722 4.555 1.00 0.00 N ATOM 0 H LYS A 48 -9.831 -9.500 2.197 1.00 0.00 H new ATOM 0 HA LYS A 48 -10.351 -6.619 2.762 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -10.923 -8.989 4.533 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -11.399 -7.320 4.773 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -12.246 -8.679 2.215 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -13.078 -9.119 3.693 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -13.010 -6.338 3.872 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -13.191 -6.588 2.147 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -15.396 -7.009 2.461 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -14.974 -8.442 3.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -16.337 -6.942 4.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -14.796 -7.080 5.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -15.204 -5.692 4.486 1.00 0.00 H new ATOM 835 N VAL A 49 -8.450 -6.313 4.291 1.00 0.00 N ATOM 836 CA VAL A 49 -7.199 -6.061 4.986 1.00 0.00 C ATOM 837 C VAL A 49 -7.489 -5.336 6.302 1.00 0.00 C ATOM 838 O VAL A 49 -8.537 -4.711 6.453 1.00 0.00 O ATOM 839 CB VAL A 49 -6.242 -5.288 4.076 1.00 0.00 C ATOM 840 CG1 VAL A 49 -6.081 -5.991 2.727 1.00 0.00 C ATOM 841 CG2 VAL A 49 -6.708 -3.843 3.891 1.00 0.00 C ATOM 0 H VAL A 49 -9.071 -5.506 4.224 1.00 0.00 H new ATOM 0 HA VAL A 49 -6.704 -7.000 5.234 1.00 0.00 H new ATOM 0 HB VAL A 49 -5.265 -5.264 4.559 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -5.396 -5.421 2.099 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -5.681 -6.993 2.884 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -7.051 -6.061 2.235 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -6.010 -3.316 3.240 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -7.701 -3.836 3.441 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -6.746 -3.346 4.860 1.00 0.00 H new ATOM 851 N ARG A 50 -6.540 -5.444 7.221 1.00 0.00 N ATOM 852 CA ARG A 50 -6.681 -4.807 8.519 1.00 0.00 C ATOM 853 C ARG A 50 -5.443 -3.964 8.834 1.00 0.00 C ATOM 854 O ARG A 50 -4.332 -4.489 8.906 1.00 0.00 O ATOM 855 CB ARG A 50 -6.876 -5.846 9.625 1.00 0.00 C ATOM 856 CG ARG A 50 -6.577 -5.246 11.001 1.00 0.00 C ATOM 857 CD ARG A 50 -7.396 -5.940 12.091 1.00 0.00 C ATOM 858 NE ARG A 50 -6.538 -6.876 12.851 1.00 0.00 N ATOM 859 CZ ARG A 50 -6.989 -7.704 13.802 1.00 0.00 C ATOM 860 NH1 ARG A 50 -8.291 -7.718 14.117 1.00 0.00 N ATOM 861 NH2 ARG A 50 -6.137 -8.519 14.440 1.00 0.00 N ATOM 0 H ARG A 50 -5.671 -5.963 7.092 1.00 0.00 H new ATOM 0 HA ARG A 50 -7.562 -4.166 8.479 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -7.900 -6.219 9.602 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -6.222 -6.699 9.447 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -5.514 -5.344 11.221 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -6.804 -4.180 10.994 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -7.823 -5.197 12.765 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -8.229 -6.481 11.642 1.00 0.00 H new ATOM 0 HE ARG A 50 -5.541 -6.891 12.637 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -8.940 -7.098 13.632 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -8.634 -8.349 14.841 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -5.145 -8.508 14.201 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -6.480 -9.150 15.164 1.00 0.00 H new ATOM 875 N VAL A 51 -5.675 -2.672 9.012 1.00 0.00 N ATOM 876 CA VAL A 51 -4.593 -1.752 9.317 1.00 0.00 C ATOM 877 C VAL A 51 -3.924 -2.174 10.627 1.00 0.00 C ATOM 878 O VAL A 51 -4.603 -2.539 11.585 1.00 0.00 O ATOM 879 CB VAL A 51 -5.120 -0.316 9.351 1.00 0.00 C ATOM 880 CG1 VAL A 51 -4.028 0.659 9.795 1.00 0.00 C ATOM 881 CG2 VAL A 51 -5.697 0.088 7.993 1.00 0.00 C ATOM 0 H VAL A 51 -6.597 -2.240 8.951 1.00 0.00 H new ATOM 0 HA VAL A 51 -3.832 -1.786 8.537 1.00 0.00 H new ATOM 0 HB VAL A 51 -5.926 -0.272 10.084 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -4.429 1.672 9.810 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -3.684 0.390 10.794 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -3.192 0.611 9.098 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -6.065 1.113 8.044 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -4.919 0.019 7.232 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.519 -0.580 7.734 1.00 0.00 H new ATOM 891 N LYS A 52 -2.601 -2.110 10.626 1.00 0.00 N ATOM 892 CA LYS A 52 -1.832 -2.481 11.802 1.00 0.00 C ATOM 893 C LYS A 52 -1.253 -1.220 12.446 1.00 0.00 C ATOM 894 O LYS A 52 -1.290 -1.068 13.667 1.00 0.00 O ATOM 895 CB LYS A 52 -0.777 -3.529 11.444 1.00 0.00 C ATOM 896 CG LYS A 52 -1.262 -4.937 11.795 1.00 0.00 C ATOM 897 CD LYS A 52 -0.313 -5.612 12.787 1.00 0.00 C ATOM 898 CE LYS A 52 -0.698 -5.277 14.229 1.00 0.00 C ATOM 899 NZ LYS A 52 -0.541 -6.465 15.097 1.00 0.00 N ATOM 0 H LYS A 52 -2.041 -1.807 9.829 1.00 0.00 H new ATOM 0 HA LYS A 52 -2.476 -2.952 12.545 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -0.551 -3.473 10.379 1.00 0.00 H new ATOM 0 HB3 LYS A 52 0.149 -3.316 11.978 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -2.263 -4.885 12.222 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.333 -5.538 10.888 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -0.338 -6.692 12.642 1.00 0.00 H new ATOM 0 HD3 LYS A 52 0.710 -5.288 12.595 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -0.073 -4.464 14.599 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -1.730 -4.927 14.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -0.807 -6.220 16.072 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -1.155 -7.230 14.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 0.450 -6.781 15.077 1.00 0.00 H new ATOM 913 N ALA A 53 -0.731 -0.346 11.597 1.00 0.00 N ATOM 914 CA ALA A 53 -0.145 0.897 12.069 1.00 0.00 C ATOM 915 C ALA A 53 0.066 1.838 10.881 1.00 0.00 C ATOM 916 O ALA A 53 -0.188 1.466 9.737 1.00 0.00 O ATOM 917 CB ALA A 53 1.157 0.597 12.814 1.00 0.00 C ATOM 0 H ALA A 53 -0.702 -0.474 10.586 1.00 0.00 H new ATOM 0 HA ALA A 53 -0.814 1.396 12.770 1.00 0.00 H new ATOM 0 HB1 ALA A 53 1.597 1.529 13.168 1.00 0.00 H new ATOM 0 HB2 ALA A 53 0.948 -0.052 13.665 1.00 0.00 H new ATOM 0 HB3 ALA A 53 1.855 0.099 12.141 1.00 0.00 H new ATOM 923 N ILE A 54 0.529 3.040 11.194 1.00 0.00 N ATOM 924 CA ILE A 54 0.778 4.037 10.168 1.00 0.00 C ATOM 925 C ILE A 54 2.231 4.506 10.260 1.00 0.00 C ATOM 926 O ILE A 54 2.792 4.590 11.351 1.00 0.00 O ATOM 927 CB ILE A 54 -0.243 5.173 10.266 1.00 0.00 C ATOM 928 CG1 ILE A 54 -0.712 5.610 8.877 1.00 0.00 C ATOM 929 CG2 ILE A 54 0.316 6.343 11.077 1.00 0.00 C ATOM 930 CD1 ILE A 54 -1.191 7.063 8.892 1.00 0.00 C ATOM 0 H ILE A 54 0.738 3.345 12.145 1.00 0.00 H new ATOM 0 HA ILE A 54 0.645 3.605 9.176 1.00 0.00 H new ATOM 0 HB ILE A 54 -1.118 4.801 10.799 1.00 0.00 H new ATOM 0 HG12 ILE A 54 0.104 5.500 8.162 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -1.520 4.960 8.541 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -0.429 7.137 11.132 1.00 0.00 H new ATOM 0 HG22 ILE A 54 0.560 6.004 12.084 1.00 0.00 H new ATOM 0 HG23 ILE A 54 1.216 6.723 10.594 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -1.519 7.348 7.892 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -2.022 7.165 9.589 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -0.373 7.712 9.205 1.00 0.00 H new ATOM 942 N ARG A 55 2.799 4.800 9.099 1.00 0.00 N ATOM 943 CA ARG A 55 4.176 5.259 9.035 1.00 0.00 C ATOM 944 C ARG A 55 4.334 6.313 7.937 1.00 0.00 C ATOM 945 O ARG A 55 3.715 6.209 6.879 1.00 0.00 O ATOM 946 CB ARG A 55 5.132 4.096 8.758 1.00 0.00 C ATOM 947 CG ARG A 55 5.239 3.173 9.973 1.00 0.00 C ATOM 948 CD ARG A 55 6.686 3.076 10.461 1.00 0.00 C ATOM 949 NE ARG A 55 7.107 4.364 11.057 1.00 0.00 N ATOM 950 CZ ARG A 55 8.228 4.530 11.772 1.00 0.00 C ATOM 951 NH1 ARG A 55 9.047 3.492 11.985 1.00 0.00 N ATOM 952 NH2 ARG A 55 8.530 5.735 12.275 1.00 0.00 N ATOM 0 H ARG A 55 2.330 4.729 8.196 1.00 0.00 H new ATOM 0 HA ARG A 55 4.425 5.697 10.002 1.00 0.00 H new ATOM 0 HB2 ARG A 55 4.780 3.529 7.896 1.00 0.00 H new ATOM 0 HB3 ARG A 55 6.118 4.484 8.504 1.00 0.00 H new ATOM 0 HG2 ARG A 55 4.605 3.548 10.776 1.00 0.00 H new ATOM 0 HG3 ARG A 55 4.871 2.180 9.714 1.00 0.00 H new ATOM 0 HD2 ARG A 55 6.777 2.278 11.198 1.00 0.00 H new ATOM 0 HD3 ARG A 55 7.342 2.819 9.630 1.00 0.00 H new ATOM 0 HE ARG A 55 6.506 5.176 10.914 1.00 0.00 H new ATOM 0 HH11 ARG A 55 8.818 2.575 11.603 1.00 0.00 H new ATOM 0 HH12 ARG A 55 9.900 3.619 12.529 1.00 0.00 H new ATOM 0 HH21 ARG A 55 7.906 6.526 12.114 1.00 0.00 H new ATOM 0 HH22 ARG A 55 9.383 5.861 12.819 1.00 0.00 H new ATOM 966 N VAL A 56 5.166 7.302 8.226 1.00 0.00 N ATOM 967 CA VAL A 56 5.413 8.374 7.277 1.00 0.00 C ATOM 968 C VAL A 56 6.922 8.559 7.105 1.00 0.00 C ATOM 969 O VAL A 56 7.680 8.442 8.067 1.00 0.00 O ATOM 970 CB VAL A 56 4.702 9.650 7.732 1.00 0.00 C ATOM 971 CG1 VAL A 56 4.582 10.651 6.580 1.00 0.00 C ATOM 972 CG2 VAL A 56 3.329 9.331 8.326 1.00 0.00 C ATOM 0 H VAL A 56 5.678 7.384 9.104 1.00 0.00 H new ATOM 0 HA VAL A 56 5.003 8.121 6.299 1.00 0.00 H new ATOM 0 HB VAL A 56 5.306 10.109 8.514 1.00 0.00 H new ATOM 0 HG11 VAL A 56 4.073 11.549 6.930 1.00 0.00 H new ATOM 0 HG12 VAL A 56 5.577 10.914 6.222 1.00 0.00 H new ATOM 0 HG13 VAL A 56 4.010 10.203 5.767 1.00 0.00 H new ATOM 0 HG21 VAL A 56 2.845 10.255 8.641 1.00 0.00 H new ATOM 0 HG22 VAL A 56 2.713 8.837 7.574 1.00 0.00 H new ATOM 0 HG23 VAL A 56 3.449 8.673 9.186 1.00 0.00 H new ATOM 982 N TYR A 57 7.314 8.846 5.872 1.00 0.00 N ATOM 983 CA TYR A 57 8.719 9.048 5.561 1.00 0.00 C ATOM 984 C TYR A 57 8.923 10.333 4.756 1.00 0.00 C ATOM 985 O TYR A 57 7.972 11.075 4.513 1.00 0.00 O ATOM 986 CB TYR A 57 9.138 7.852 4.704 1.00 0.00 C ATOM 987 CG TYR A 57 9.530 6.614 5.513 1.00 0.00 C ATOM 988 CD1 TYR A 57 8.555 5.856 6.130 1.00 0.00 C ATOM 989 CD2 TYR A 57 10.858 6.255 5.626 1.00 0.00 C ATOM 990 CE1 TYR A 57 8.924 4.690 6.891 1.00 0.00 C ATOM 991 CE2 TYR A 57 11.226 5.090 6.388 1.00 0.00 C ATOM 992 CZ TYR A 57 10.241 4.365 6.982 1.00 0.00 C ATOM 993 OH TYR A 57 10.589 3.264 7.701 1.00 0.00 O ATOM 0 H TYR A 57 6.683 8.943 5.077 1.00 0.00 H new ATOM 0 HA TYR A 57 9.306 9.133 6.476 1.00 0.00 H new ATOM 0 HB2 TYR A 57 8.317 7.592 4.036 1.00 0.00 H new ATOM 0 HB3 TYR A 57 9.980 8.145 4.076 1.00 0.00 H new ATOM 0 HD1 TYR A 57 7.516 6.137 6.042 1.00 0.00 H new ATOM 0 HD2 TYR A 57 11.621 6.848 5.143 1.00 0.00 H new ATOM 0 HE1 TYR A 57 8.172 4.088 7.378 1.00 0.00 H new ATOM 0 HE2 TYR A 57 12.261 4.799 6.486 1.00 0.00 H new ATOM 0 HH TYR A 57 10.752 2.514 7.092 1.00 0.00 H new ATOM 1003 N ASN A 58 10.169 10.558 4.366 1.00 0.00 N ATOM 1004 CA ASN A 58 10.510 11.740 3.593 1.00 0.00 C ATOM 1005 C ASN A 58 10.045 11.552 2.148 1.00 0.00 C ATOM 1006 O ASN A 58 9.458 12.457 1.558 1.00 0.00 O ATOM 1007 CB ASN A 58 12.022 11.971 3.577 1.00 0.00 C ATOM 1008 CG ASN A 58 12.419 13.076 4.558 1.00 0.00 C ATOM 1009 OD1 ASN A 58 12.547 14.237 4.206 1.00 0.00 O ATOM 1010 ND2 ASN A 58 12.606 12.651 5.804 1.00 0.00 N ATOM 0 H ASN A 58 10.955 9.941 4.571 1.00 0.00 H new ATOM 0 HA ASN A 58 10.019 12.597 4.055 1.00 0.00 H new ATOM 0 HB2 ASN A 58 12.537 11.046 3.837 1.00 0.00 H new ATOM 0 HB3 ASN A 58 12.341 12.241 2.571 1.00 0.00 H new ATOM 0 HD21 ASN A 58 12.873 13.312 6.534 1.00 0.00 H new ATOM 0 HD22 ASN A 58 12.482 11.664 6.030 1.00 0.00 H new ATOM 1017 N SER A 59 10.324 10.369 1.619 1.00 0.00 N ATOM 1018 CA SER A 59 9.942 10.050 0.254 1.00 0.00 C ATOM 1019 C SER A 59 9.805 8.535 0.090 1.00 0.00 C ATOM 1020 O SER A 59 10.199 7.773 0.971 1.00 0.00 O ATOM 1021 CB SER A 59 10.959 10.603 -0.746 1.00 0.00 C ATOM 1022 OG SER A 59 10.431 10.660 -2.068 1.00 0.00 O ATOM 0 H SER A 59 10.810 9.620 2.112 1.00 0.00 H new ATOM 0 HA SER A 59 8.980 10.520 0.049 1.00 0.00 H new ATOM 0 HB2 SER A 59 11.267 11.601 -0.435 1.00 0.00 H new ATOM 0 HB3 SER A 59 11.852 9.977 -0.739 1.00 0.00 H new ATOM 0 HG SER A 59 11.110 11.020 -2.676 1.00 0.00 H new ATOM 1028 N PHE A 60 9.245 8.144 -1.045 1.00 0.00 N ATOM 1029 CA PHE A 60 9.051 6.734 -1.337 1.00 0.00 C ATOM 1030 C PHE A 60 10.390 5.997 -1.397 1.00 0.00 C ATOM 1031 O PHE A 60 10.494 4.852 -0.960 1.00 0.00 O ATOM 1032 CB PHE A 60 8.374 6.649 -2.706 1.00 0.00 C ATOM 1033 CG PHE A 60 6.943 6.108 -2.660 1.00 0.00 C ATOM 1034 CD1 PHE A 60 6.706 4.850 -2.200 1.00 0.00 C ATOM 1035 CD2 PHE A 60 5.909 6.884 -3.080 1.00 0.00 C ATOM 1036 CE1 PHE A 60 5.379 4.348 -2.158 1.00 0.00 C ATOM 1037 CE2 PHE A 60 4.581 6.382 -3.037 1.00 0.00 C ATOM 1038 CZ PHE A 60 4.344 5.124 -2.577 1.00 0.00 C ATOM 0 H PHE A 60 8.919 8.779 -1.774 1.00 0.00 H new ATOM 0 HA PHE A 60 8.447 6.272 -0.555 1.00 0.00 H new ATOM 0 HB2 PHE A 60 8.362 7.642 -3.156 1.00 0.00 H new ATOM 0 HB3 PHE A 60 8.972 6.011 -3.357 1.00 0.00 H new ATOM 0 HD1 PHE A 60 7.528 4.233 -1.867 1.00 0.00 H new ATOM 0 HD2 PHE A 60 6.097 7.882 -3.446 1.00 0.00 H new ATOM 0 HE1 PHE A 60 5.191 3.349 -1.793 1.00 0.00 H new ATOM 0 HE2 PHE A 60 3.759 6.999 -3.370 1.00 0.00 H new ATOM 0 HZ PHE A 60 3.334 4.742 -2.545 1.00 0.00 H new ATOM 1048 N ARG A 61 11.383 6.684 -1.942 1.00 0.00 N ATOM 1049 CA ARG A 61 12.712 6.110 -2.066 1.00 0.00 C ATOM 1050 C ARG A 61 13.230 5.670 -0.695 1.00 0.00 C ATOM 1051 O ARG A 61 13.913 4.654 -0.582 1.00 0.00 O ATOM 1052 CB ARG A 61 13.692 7.114 -2.675 1.00 0.00 C ATOM 1053 CG ARG A 61 14.696 6.413 -3.593 1.00 0.00 C ATOM 1054 CD ARG A 61 16.124 6.878 -3.300 1.00 0.00 C ATOM 1055 NE ARG A 61 16.789 7.291 -4.556 1.00 0.00 N ATOM 1056 CZ ARG A 61 17.888 8.057 -4.608 1.00 0.00 C ATOM 1057 NH1 ARG A 61 18.452 8.497 -3.475 1.00 0.00 N ATOM 1058 NH2 ARG A 61 18.423 8.382 -5.792 1.00 0.00 N ATOM 0 H ARG A 61 11.294 7.634 -2.303 1.00 0.00 H new ATOM 0 HA ARG A 61 12.639 5.246 -2.726 1.00 0.00 H new ATOM 0 HB2 ARG A 61 13.142 7.867 -3.239 1.00 0.00 H new ATOM 0 HB3 ARG A 61 14.224 7.636 -1.880 1.00 0.00 H new ATOM 0 HG2 ARG A 61 14.626 5.334 -3.458 1.00 0.00 H new ATOM 0 HG3 ARG A 61 14.449 6.620 -4.634 1.00 0.00 H new ATOM 0 HD2 ARG A 61 16.107 7.711 -2.597 1.00 0.00 H new ATOM 0 HD3 ARG A 61 16.688 6.073 -2.828 1.00 0.00 H new ATOM 0 HE ARG A 61 16.386 6.973 -5.437 1.00 0.00 H new ATOM 0 HH11 ARG A 61 18.045 8.249 -2.573 1.00 0.00 H new ATOM 0 HH12 ARG A 61 19.288 9.080 -3.514 1.00 0.00 H new ATOM 0 HH21 ARG A 61 17.994 8.047 -6.655 1.00 0.00 H new ATOM 0 HH22 ARG A 61 19.259 8.965 -5.831 1.00 0.00 H new ATOM 1072 N GLU A 62 12.883 6.457 0.314 1.00 0.00 N ATOM 1073 CA GLU A 62 13.304 6.161 1.673 1.00 0.00 C ATOM 1074 C GLU A 62 12.522 4.966 2.222 1.00 0.00 C ATOM 1075 O GLU A 62 13.076 4.135 2.941 1.00 0.00 O ATOM 1076 CB GLU A 62 13.141 7.385 2.576 1.00 0.00 C ATOM 1077 CG GLU A 62 14.451 8.167 2.681 1.00 0.00 C ATOM 1078 CD GLU A 62 14.573 9.190 1.549 1.00 0.00 C ATOM 1079 OE1 GLU A 62 14.462 8.759 0.381 1.00 0.00 O ATOM 1080 OE2 GLU A 62 14.773 10.379 1.878 1.00 0.00 O ATOM 0 H GLU A 62 12.315 7.299 0.217 1.00 0.00 H new ATOM 0 HA GLU A 62 14.362 5.901 1.657 1.00 0.00 H new ATOM 0 HB2 GLU A 62 12.358 8.032 2.180 1.00 0.00 H new ATOM 0 HB3 GLU A 62 12.821 7.069 3.569 1.00 0.00 H new ATOM 0 HG2 GLU A 62 14.498 8.677 3.643 1.00 0.00 H new ATOM 0 HG3 GLU A 62 15.294 7.477 2.645 1.00 0.00 H new ATOM 1087 N MET A 63 11.248 4.918 1.863 1.00 0.00 N ATOM 1088 CA MET A 63 10.384 3.838 2.312 1.00 0.00 C ATOM 1089 C MET A 63 10.771 2.515 1.647 1.00 0.00 C ATOM 1090 O MET A 63 10.886 1.490 2.317 1.00 0.00 O ATOM 1091 CB MET A 63 8.930 4.174 1.975 1.00 0.00 C ATOM 1092 CG MET A 63 8.149 4.553 3.234 1.00 0.00 C ATOM 1093 SD MET A 63 6.425 4.786 2.837 1.00 0.00 S ATOM 1094 CE MET A 63 6.111 3.285 1.924 1.00 0.00 C ATOM 0 H MET A 63 10.793 5.609 1.267 1.00 0.00 H new ATOM 0 HA MET A 63 10.500 3.728 3.390 1.00 0.00 H new ATOM 0 HB2 MET A 63 8.899 4.998 1.262 1.00 0.00 H new ATOM 0 HB3 MET A 63 8.457 3.318 1.494 1.00 0.00 H new ATOM 0 HG2 MET A 63 8.255 3.771 3.986 1.00 0.00 H new ATOM 0 HG3 MET A 63 8.558 5.467 3.664 1.00 0.00 H new ATOM 0 HE1 MET A 63 5.065 3.001 2.039 1.00 0.00 H new ATOM 0 HE2 MET A 63 6.329 3.449 0.869 1.00 0.00 H new ATOM 0 HE3 MET A 63 6.747 2.487 2.306 1.00 0.00 H new ATOM 1104 N LEU A 64 10.959 2.581 0.337 1.00 0.00 N ATOM 1105 CA LEU A 64 11.330 1.401 -0.426 1.00 0.00 C ATOM 1106 C LEU A 64 12.756 0.987 -0.056 1.00 0.00 C ATOM 1107 O LEU A 64 13.096 -0.194 -0.104 1.00 0.00 O ATOM 1108 CB LEU A 64 11.129 1.646 -1.923 1.00 0.00 C ATOM 1109 CG LEU A 64 9.774 2.226 -2.331 1.00 0.00 C ATOM 1110 CD1 LEU A 64 9.925 3.201 -3.501 1.00 0.00 C ATOM 1111 CD2 LEU A 64 8.771 1.112 -2.640 1.00 0.00 C ATOM 0 H LEU A 64 10.861 3.433 -0.215 1.00 0.00 H new ATOM 0 HA LEU A 64 10.679 0.564 -0.174 1.00 0.00 H new ATOM 0 HB2 LEU A 64 11.911 2.323 -2.268 1.00 0.00 H new ATOM 0 HB3 LEU A 64 11.271 0.701 -2.448 1.00 0.00 H new ATOM 0 HG LEU A 64 9.377 2.792 -1.488 1.00 0.00 H new ATOM 0 HD11 LEU A 64 8.947 3.599 -3.771 1.00 0.00 H new ATOM 0 HD12 LEU A 64 10.582 4.020 -3.209 1.00 0.00 H new ATOM 0 HD13 LEU A 64 10.354 2.679 -4.357 1.00 0.00 H new ATOM 0 HD21 LEU A 64 7.816 1.552 -2.927 1.00 0.00 H new ATOM 0 HD22 LEU A 64 9.149 0.499 -3.458 1.00 0.00 H new ATOM 0 HD23 LEU A 64 8.633 0.491 -1.755 1.00 0.00 H new ATOM 1123 N GLU A 65 13.552 1.983 0.305 1.00 0.00 N ATOM 1124 CA GLU A 65 14.934 1.737 0.682 1.00 0.00 C ATOM 1125 C GLU A 65 15.000 1.125 2.083 1.00 0.00 C ATOM 1126 O GLU A 65 15.757 0.184 2.318 1.00 0.00 O ATOM 1127 CB GLU A 65 15.760 3.023 0.606 1.00 0.00 C ATOM 1128 CG GLU A 65 16.131 3.351 -0.841 1.00 0.00 C ATOM 1129 CD GLU A 65 17.551 2.880 -1.164 1.00 0.00 C ATOM 1130 OE1 GLU A 65 18.487 3.440 -0.552 1.00 0.00 O ATOM 1131 OE2 GLU A 65 17.668 1.972 -2.014 1.00 0.00 O ATOM 0 H GLU A 65 13.267 2.961 0.344 1.00 0.00 H new ATOM 0 HA GLU A 65 15.363 1.027 -0.025 1.00 0.00 H new ATOM 0 HB2 GLU A 65 15.194 3.849 1.036 1.00 0.00 H new ATOM 0 HB3 GLU A 65 16.666 2.913 1.202 1.00 0.00 H new ATOM 0 HG2 GLU A 65 15.423 2.874 -1.519 1.00 0.00 H new ATOM 0 HG3 GLU A 65 16.055 4.426 -1.005 1.00 0.00 H new ATOM 1138 N LYS A 66 14.198 1.684 2.977 1.00 0.00 N ATOM 1139 CA LYS A 66 14.156 1.205 4.348 1.00 0.00 C ATOM 1140 C LYS A 66 13.223 -0.005 4.433 1.00 0.00 C ATOM 1141 O LYS A 66 13.663 -1.113 4.737 1.00 0.00 O ATOM 1142 CB LYS A 66 13.779 2.340 5.302 1.00 0.00 C ATOM 1143 CG LYS A 66 14.666 2.328 6.548 1.00 0.00 C ATOM 1144 CD LYS A 66 13.838 2.558 7.813 1.00 0.00 C ATOM 1145 CE LYS A 66 13.817 4.040 8.193 1.00 0.00 C ATOM 1146 NZ LYS A 66 14.719 4.293 9.340 1.00 0.00 N ATOM 0 H LYS A 66 13.572 2.464 2.779 1.00 0.00 H new ATOM 0 HA LYS A 66 15.144 0.870 4.664 1.00 0.00 H new ATOM 0 HB2 LYS A 66 13.878 3.297 4.790 1.00 0.00 H new ATOM 0 HB3 LYS A 66 12.734 2.241 5.595 1.00 0.00 H new ATOM 0 HG2 LYS A 66 15.187 1.373 6.619 1.00 0.00 H new ATOM 0 HG3 LYS A 66 15.429 3.102 6.463 1.00 0.00 H new ATOM 0 HD2 LYS A 66 12.819 2.205 7.654 1.00 0.00 H new ATOM 0 HD3 LYS A 66 14.253 1.974 8.635 1.00 0.00 H new ATOM 0 HE2 LYS A 66 14.125 4.645 7.340 1.00 0.00 H new ATOM 0 HE3 LYS A 66 12.801 4.342 8.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 14.693 5.303 9.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 14.408 3.730 10.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 15.690 4.024 9.084 1.00 0.00 H new ATOM 1160 N GLU A 67 11.952 0.248 4.158 1.00 0.00 N ATOM 1161 CA GLU A 67 10.953 -0.807 4.200 1.00 0.00 C ATOM 1162 C GLU A 67 11.312 -1.917 3.210 1.00 0.00 C ATOM 1163 O GLU A 67 11.369 -3.088 3.580 1.00 0.00 O ATOM 1164 CB GLU A 67 9.556 -0.250 3.917 1.00 0.00 C ATOM 1165 CG GLU A 67 8.540 -0.779 4.930 1.00 0.00 C ATOM 1166 CD GLU A 67 8.662 -2.296 5.089 1.00 0.00 C ATOM 1167 OE1 GLU A 67 8.790 -2.967 4.042 1.00 0.00 O ATOM 1168 OE2 GLU A 67 8.624 -2.750 6.253 1.00 0.00 O ATOM 0 H GLU A 67 11.591 1.168 3.905 1.00 0.00 H new ATOM 0 HA GLU A 67 10.942 -1.232 5.204 1.00 0.00 H new ATOM 0 HB2 GLU A 67 9.580 0.839 3.955 1.00 0.00 H new ATOM 0 HB3 GLU A 67 9.248 -0.527 2.909 1.00 0.00 H new ATOM 0 HG2 GLU A 67 8.697 -0.295 5.894 1.00 0.00 H new ATOM 0 HG3 GLU A 67 7.531 -0.524 4.606 1.00 0.00 H new ATOM 1175 N GLY A 68 11.545 -1.509 1.971 1.00 0.00 N ATOM 1176 CA GLY A 68 11.896 -2.454 0.925 1.00 0.00 C ATOM 1177 C GLY A 68 11.006 -2.267 -0.305 1.00 0.00 C ATOM 1178 O GLY A 68 9.781 -2.284 -0.198 1.00 0.00 O ATOM 0 H GLY A 68 11.497 -0.536 1.668 1.00 0.00 H new ATOM 0 HA2 GLY A 68 12.941 -2.321 0.646 1.00 0.00 H new ATOM 0 HA3 GLY A 68 11.794 -3.472 1.301 1.00 0.00 H new ATOM 1182 N LEU A 69 11.657 -2.094 -1.446 1.00 0.00 N ATOM 1183 CA LEU A 69 10.940 -1.904 -2.695 1.00 0.00 C ATOM 1184 C LEU A 69 10.030 -3.108 -2.944 1.00 0.00 C ATOM 1185 O LEU A 69 8.815 -2.958 -3.065 1.00 0.00 O ATOM 1186 CB LEU A 69 11.919 -1.627 -3.838 1.00 0.00 C ATOM 1187 CG LEU A 69 11.372 -1.827 -5.253 1.00 0.00 C ATOM 1188 CD1 LEU A 69 10.336 -0.755 -5.597 1.00 0.00 C ATOM 1189 CD2 LEU A 69 12.507 -1.876 -6.278 1.00 0.00 C ATOM 0 H LEU A 69 12.673 -2.081 -1.531 1.00 0.00 H new ATOM 0 HA LEU A 69 10.298 -1.025 -2.635 1.00 0.00 H new ATOM 0 HB2 LEU A 69 12.271 -0.599 -3.748 1.00 0.00 H new ATOM 0 HB3 LEU A 69 12.787 -2.273 -3.711 1.00 0.00 H new ATOM 0 HG LEU A 69 10.863 -2.790 -5.289 1.00 0.00 H new ATOM 0 HD11 LEU A 69 9.963 -0.920 -6.608 1.00 0.00 H new ATOM 0 HD12 LEU A 69 9.507 -0.810 -4.891 1.00 0.00 H new ATOM 0 HD13 LEU A 69 10.798 0.230 -5.537 1.00 0.00 H new ATOM 0 HD21 LEU A 69 12.091 -2.019 -7.275 1.00 0.00 H new ATOM 0 HD22 LEU A 69 13.065 -0.940 -6.248 1.00 0.00 H new ATOM 0 HD23 LEU A 69 13.175 -2.704 -6.042 1.00 0.00 H new ATOM 1201 N GLU A 70 10.652 -4.276 -3.012 1.00 0.00 N ATOM 1202 CA GLU A 70 9.913 -5.505 -3.244 1.00 0.00 C ATOM 1203 C GLU A 70 9.003 -5.811 -2.053 1.00 0.00 C ATOM 1204 O GLU A 70 8.121 -6.663 -2.143 1.00 0.00 O ATOM 1205 CB GLU A 70 10.863 -6.672 -3.522 1.00 0.00 C ATOM 1206 CG GLU A 70 11.027 -6.900 -5.026 1.00 0.00 C ATOM 1207 CD GLU A 70 11.950 -8.088 -5.303 1.00 0.00 C ATOM 1208 OE1 GLU A 70 13.048 -8.105 -4.706 1.00 0.00 O ATOM 1209 OE2 GLU A 70 11.538 -8.952 -6.107 1.00 0.00 O ATOM 0 H GLU A 70 11.660 -4.397 -2.910 1.00 0.00 H new ATOM 0 HA GLU A 70 9.289 -5.369 -4.127 1.00 0.00 H new ATOM 0 HB2 GLU A 70 11.835 -6.469 -3.073 1.00 0.00 H new ATOM 0 HB3 GLU A 70 10.479 -7.578 -3.053 1.00 0.00 H new ATOM 0 HG2 GLU A 70 10.052 -7.079 -5.479 1.00 0.00 H new ATOM 0 HG3 GLU A 70 11.434 -6.002 -5.491 1.00 0.00 H new ATOM 1216 N ASN A 71 9.250 -5.098 -0.963 1.00 0.00 N ATOM 1217 CA ASN A 71 8.464 -5.283 0.245 1.00 0.00 C ATOM 1218 C ASN A 71 7.338 -4.247 0.278 1.00 0.00 C ATOM 1219 O ASN A 71 6.678 -4.075 1.302 1.00 0.00 O ATOM 1220 CB ASN A 71 9.323 -5.087 1.496 1.00 0.00 C ATOM 1221 CG ASN A 71 10.382 -6.185 1.611 1.00 0.00 C ATOM 1222 OD1 ASN A 71 10.935 -6.527 0.450 1.00 0.00 O flip ATOM 1223 ND2 ASN A 71 10.678 -6.689 2.682 1.00 0.00 N flip ATOM 0 H ASN A 71 9.983 -4.392 -0.892 1.00 0.00 H new ATOM 0 HA ASN A 71 8.065 -6.297 0.237 1.00 0.00 H new ATOM 0 HB2 ASN A 71 9.808 -4.111 1.459 1.00 0.00 H new ATOM 0 HB3 ASN A 71 8.688 -5.095 2.382 1.00 0.00 H new ATOM 0 HD21 ASN A 71 10.215 -6.380 3.536 1.00 0.00 H new ATOM 0 HD22 ASN A 71 11.389 -7.419 2.723 1.00 0.00 H new ATOM 1230 N VAL A 72 7.153 -3.585 -0.854 1.00 0.00 N ATOM 1231 CA VAL A 72 6.118 -2.571 -0.967 1.00 0.00 C ATOM 1232 C VAL A 72 5.452 -2.680 -2.340 1.00 0.00 C ATOM 1233 O VAL A 72 4.226 -2.669 -2.442 1.00 0.00 O ATOM 1234 CB VAL A 72 6.710 -1.186 -0.698 1.00 0.00 C ATOM 1235 CG1 VAL A 72 5.709 -0.084 -1.050 1.00 0.00 C ATOM 1236 CG2 VAL A 72 7.175 -1.061 0.754 1.00 0.00 C ATOM 0 H VAL A 72 7.702 -3.731 -1.701 1.00 0.00 H new ATOM 0 HA VAL A 72 5.344 -2.730 -0.216 1.00 0.00 H new ATOM 0 HB VAL A 72 7.582 -1.064 -1.341 1.00 0.00 H new ATOM 0 HG11 VAL A 72 6.155 0.890 -0.849 1.00 0.00 H new ATOM 0 HG12 VAL A 72 5.448 -0.153 -2.106 1.00 0.00 H new ATOM 0 HG13 VAL A 72 4.810 -0.203 -0.446 1.00 0.00 H new ATOM 0 HG21 VAL A 72 7.592 -0.067 0.918 1.00 0.00 H new ATOM 0 HG22 VAL A 72 6.327 -1.214 1.422 1.00 0.00 H new ATOM 0 HG23 VAL A 72 7.938 -1.812 0.958 1.00 0.00 H new ATOM 1246 N LEU A 73 6.289 -2.782 -3.362 1.00 0.00 N ATOM 1247 CA LEU A 73 5.796 -2.892 -4.725 1.00 0.00 C ATOM 1248 C LEU A 73 6.354 -4.166 -5.362 1.00 0.00 C ATOM 1249 O LEU A 73 7.444 -4.154 -5.931 1.00 0.00 O ATOM 1250 CB LEU A 73 6.113 -1.620 -5.514 1.00 0.00 C ATOM 1251 CG LEU A 73 5.130 -1.261 -6.630 1.00 0.00 C ATOM 1252 CD1 LEU A 73 4.185 -0.142 -6.190 1.00 0.00 C ATOM 1253 CD2 LEU A 73 5.872 -0.911 -7.922 1.00 0.00 C ATOM 0 H LEU A 73 7.305 -2.791 -3.274 1.00 0.00 H new ATOM 0 HA LEU A 73 4.710 -2.981 -4.732 1.00 0.00 H new ATOM 0 HB2 LEU A 73 6.159 -0.785 -4.815 1.00 0.00 H new ATOM 0 HB3 LEU A 73 7.106 -1.725 -5.951 1.00 0.00 H new ATOM 0 HG LEU A 73 4.515 -2.137 -6.839 1.00 0.00 H new ATOM 0 HD11 LEU A 73 3.497 0.094 -7.002 1.00 0.00 H new ATOM 0 HD12 LEU A 73 3.619 -0.466 -5.317 1.00 0.00 H new ATOM 0 HD13 LEU A 73 4.765 0.746 -5.937 1.00 0.00 H new ATOM 0 HD21 LEU A 73 5.150 -0.660 -8.699 1.00 0.00 H new ATOM 0 HD22 LEU A 73 6.527 -0.058 -7.746 1.00 0.00 H new ATOM 0 HD23 LEU A 73 6.468 -1.766 -8.243 1.00 0.00 H new ATOM 1265 N PRO A 74 5.560 -5.264 -5.243 1.00 0.00 N ATOM 1266 CA PRO A 74 5.963 -6.543 -5.801 1.00 0.00 C ATOM 1267 C PRO A 74 5.805 -6.552 -7.323 1.00 0.00 C ATOM 1268 O PRO A 74 4.692 -6.453 -7.835 1.00 0.00 O ATOM 1269 CB PRO A 74 5.083 -7.570 -5.106 1.00 0.00 C ATOM 1270 CG PRO A 74 3.909 -6.794 -4.534 1.00 0.00 C ATOM 1271 CD PRO A 74 4.262 -5.316 -4.576 1.00 0.00 C ATOM 0 HA PRO A 74 7.017 -6.762 -5.632 1.00 0.00 H new ATOM 0 HB2 PRO A 74 4.743 -8.332 -5.808 1.00 0.00 H new ATOM 0 HB3 PRO A 74 5.632 -8.085 -4.318 1.00 0.00 H new ATOM 0 HG2 PRO A 74 3.006 -6.987 -5.112 1.00 0.00 H new ATOM 0 HG3 PRO A 74 3.706 -7.109 -3.510 1.00 0.00 H new ATOM 0 HD2 PRO A 74 3.512 -4.745 -5.124 1.00 0.00 H new ATOM 0 HD3 PRO A 74 4.315 -4.893 -3.573 1.00 0.00 H new ATOM 1279 N GLY A 75 6.936 -6.672 -8.002 1.00 0.00 N ATOM 1280 CA GLY A 75 6.938 -6.696 -9.455 1.00 0.00 C ATOM 1281 C GLY A 75 7.839 -5.596 -10.020 1.00 0.00 C ATOM 1282 O GLY A 75 8.445 -5.767 -11.077 1.00 0.00 O ATOM 0 H GLY A 75 7.858 -6.754 -7.573 1.00 0.00 H new ATOM 0 HA2 GLY A 75 7.282 -7.669 -9.806 1.00 0.00 H new ATOM 0 HA3 GLY A 75 5.921 -6.565 -9.826 1.00 0.00 H new ATOM 1286 N VAL A 76 7.899 -4.491 -9.291 1.00 0.00 N ATOM 1287 CA VAL A 76 8.716 -3.364 -9.706 1.00 0.00 C ATOM 1288 C VAL A 76 10.027 -3.882 -10.302 1.00 0.00 C ATOM 1289 O VAL A 76 10.518 -4.938 -9.907 1.00 0.00 O ATOM 1290 CB VAL A 76 8.930 -2.411 -8.528 1.00 0.00 C ATOM 1291 CG1 VAL A 76 9.621 -3.124 -7.364 1.00 0.00 C ATOM 1292 CG2 VAL A 76 9.720 -1.174 -8.961 1.00 0.00 C ATOM 0 H VAL A 76 7.395 -4.353 -8.415 1.00 0.00 H new ATOM 0 HA VAL A 76 8.210 -2.791 -10.483 1.00 0.00 H new ATOM 0 HB VAL A 76 7.951 -2.079 -8.183 1.00 0.00 H new ATOM 0 HG11 VAL A 76 9.761 -2.424 -6.540 1.00 0.00 H new ATOM 0 HG12 VAL A 76 9.004 -3.958 -7.030 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.591 -3.498 -7.691 1.00 0.00 H new ATOM 0 HG21 VAL A 76 9.858 -0.513 -8.106 1.00 0.00 H new ATOM 0 HG22 VAL A 76 10.693 -1.480 -9.345 1.00 0.00 H new ATOM 0 HG23 VAL A 76 9.172 -0.647 -9.742 1.00 0.00 H new ATOM 1302 N LYS A 77 10.556 -3.114 -11.243 1.00 0.00 N ATOM 1303 CA LYS A 77 11.800 -3.482 -11.897 1.00 0.00 C ATOM 1304 C LYS A 77 12.979 -2.998 -11.051 1.00 0.00 C ATOM 1305 O LYS A 77 13.998 -3.679 -10.953 1.00 0.00 O ATOM 1306 CB LYS A 77 11.823 -2.963 -13.336 1.00 0.00 C ATOM 1307 CG LYS A 77 10.725 -3.621 -14.174 1.00 0.00 C ATOM 1308 CD LYS A 77 11.125 -3.685 -15.650 1.00 0.00 C ATOM 1309 CE LYS A 77 11.401 -5.126 -16.081 1.00 0.00 C ATOM 1310 NZ LYS A 77 12.118 -5.151 -17.376 1.00 0.00 N ATOM 0 H LYS A 77 10.146 -2.239 -11.568 1.00 0.00 H new ATOM 0 HA LYS A 77 11.884 -4.566 -11.972 1.00 0.00 H new ATOM 0 HB2 LYS A 77 11.688 -1.881 -13.338 1.00 0.00 H new ATOM 0 HB3 LYS A 77 12.796 -3.164 -13.783 1.00 0.00 H new ATOM 0 HG2 LYS A 77 10.532 -4.627 -13.802 1.00 0.00 H new ATOM 0 HG3 LYS A 77 9.797 -3.059 -14.069 1.00 0.00 H new ATOM 0 HD2 LYS A 77 10.329 -3.264 -16.265 1.00 0.00 H new ATOM 0 HD3 LYS A 77 12.013 -3.075 -15.817 1.00 0.00 H new ATOM 0 HE2 LYS A 77 11.995 -5.632 -15.320 1.00 0.00 H new ATOM 0 HE3 LYS A 77 10.462 -5.672 -16.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 12.298 -6.137 -17.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 11.538 -4.686 -18.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 13.023 -4.648 -17.281 1.00 0.00 H new ATOM 1324 N SER A 78 12.800 -1.826 -10.460 1.00 0.00 N ATOM 1325 CA SER A 78 13.837 -1.243 -9.625 1.00 0.00 C ATOM 1326 C SER A 78 13.257 -0.093 -8.798 1.00 0.00 C ATOM 1327 O SER A 78 12.145 0.364 -9.058 1.00 0.00 O ATOM 1328 CB SER A 78 15.012 -0.749 -10.470 1.00 0.00 C ATOM 1329 OG SER A 78 15.966 -1.779 -10.711 1.00 0.00 O ATOM 0 H SER A 78 11.953 -1.264 -10.543 1.00 0.00 H new ATOM 0 HA SER A 78 14.209 -2.015 -8.952 1.00 0.00 H new ATOM 0 HB2 SER A 78 14.640 -0.370 -11.422 1.00 0.00 H new ATOM 0 HB3 SER A 78 15.498 0.084 -9.963 1.00 0.00 H new ATOM 0 HG SER A 78 15.501 -2.632 -10.841 1.00 0.00 H new ATOM 1335 N ILE A 79 14.037 0.341 -7.819 1.00 0.00 N ATOM 1336 CA ILE A 79 13.616 1.429 -6.952 1.00 0.00 C ATOM 1337 C ILE A 79 13.279 2.653 -7.805 1.00 0.00 C ATOM 1338 O ILE A 79 12.325 3.373 -7.514 1.00 0.00 O ATOM 1339 CB ILE A 79 14.672 1.699 -5.879 1.00 0.00 C ATOM 1340 CG1 ILE A 79 14.880 0.469 -4.993 1.00 0.00 C ATOM 1341 CG2 ILE A 79 14.317 2.941 -5.060 1.00 0.00 C ATOM 1342 CD1 ILE A 79 15.809 0.789 -3.820 1.00 0.00 C ATOM 0 H ILE A 79 14.959 -0.041 -7.607 1.00 0.00 H new ATOM 0 HA ILE A 79 12.709 1.157 -6.412 1.00 0.00 H new ATOM 0 HB ILE A 79 15.620 1.902 -6.377 1.00 0.00 H new ATOM 0 HG12 ILE A 79 13.918 0.121 -4.616 1.00 0.00 H new ATOM 0 HG13 ILE A 79 15.302 -0.343 -5.585 1.00 0.00 H new ATOM 0 HG21 ILE A 79 15.084 3.110 -4.304 1.00 0.00 H new ATOM 0 HG22 ILE A 79 14.260 3.807 -5.719 1.00 0.00 H new ATOM 0 HG23 ILE A 79 13.354 2.792 -4.572 1.00 0.00 H new ATOM 0 HD11 ILE A 79 15.940 -0.102 -3.206 1.00 0.00 H new ATOM 0 HD12 ILE A 79 16.778 1.113 -4.201 1.00 0.00 H new ATOM 0 HD13 ILE A 79 15.372 1.584 -3.216 1.00 0.00 H new ATOM 1354 N GLU A 80 14.080 2.851 -8.842 1.00 0.00 N ATOM 1355 CA GLU A 80 13.879 3.976 -9.739 1.00 0.00 C ATOM 1356 C GLU A 80 12.544 3.836 -10.475 1.00 0.00 C ATOM 1357 O GLU A 80 11.778 4.794 -10.567 1.00 0.00 O ATOM 1358 CB GLU A 80 15.039 4.104 -10.728 1.00 0.00 C ATOM 1359 CG GLU A 80 15.913 5.315 -10.394 1.00 0.00 C ATOM 1360 CD GLU A 80 15.807 6.384 -11.483 1.00 0.00 C ATOM 1361 OE1 GLU A 80 16.618 6.310 -12.432 1.00 0.00 O ATOM 1362 OE2 GLU A 80 14.918 7.251 -11.343 1.00 0.00 O ATOM 0 H GLU A 80 14.870 2.251 -9.081 1.00 0.00 H new ATOM 0 HA GLU A 80 13.850 4.889 -9.144 1.00 0.00 H new ATOM 0 HB2 GLU A 80 15.643 3.197 -10.705 1.00 0.00 H new ATOM 0 HB3 GLU A 80 14.649 4.201 -11.741 1.00 0.00 H new ATOM 0 HG2 GLU A 80 15.608 5.735 -9.436 1.00 0.00 H new ATOM 0 HG3 GLU A 80 16.951 5.001 -10.288 1.00 0.00 H new ATOM 1369 N GLU A 81 12.308 2.635 -10.981 1.00 0.00 N ATOM 1370 CA GLU A 81 11.080 2.357 -11.706 1.00 0.00 C ATOM 1371 C GLU A 81 9.869 2.532 -10.786 1.00 0.00 C ATOM 1372 O GLU A 81 8.822 3.011 -11.218 1.00 0.00 O ATOM 1373 CB GLU A 81 11.108 0.953 -12.314 1.00 0.00 C ATOM 1374 CG GLU A 81 11.728 0.974 -13.713 1.00 0.00 C ATOM 1375 CD GLU A 81 10.645 0.997 -14.793 1.00 0.00 C ATOM 1376 OE1 GLU A 81 9.657 1.736 -14.590 1.00 0.00 O ATOM 1377 OE2 GLU A 81 10.829 0.276 -15.797 1.00 0.00 O ATOM 0 H GLU A 81 12.946 1.843 -10.903 1.00 0.00 H new ATOM 0 HA GLU A 81 10.995 3.071 -12.526 1.00 0.00 H new ATOM 0 HB2 GLU A 81 11.679 0.285 -11.669 1.00 0.00 H new ATOM 0 HB3 GLU A 81 10.094 0.556 -12.367 1.00 0.00 H new ATOM 0 HG2 GLU A 81 12.369 1.849 -13.817 1.00 0.00 H new ATOM 0 HG3 GLU A 81 12.361 0.097 -13.847 1.00 0.00 H new ATOM 1384 N GLY A 82 10.053 2.133 -9.536 1.00 0.00 N ATOM 1385 CA GLY A 82 8.989 2.240 -8.552 1.00 0.00 C ATOM 1386 C GLY A 82 8.442 3.667 -8.489 1.00 0.00 C ATOM 1387 O GLY A 82 7.233 3.876 -8.571 1.00 0.00 O ATOM 0 H GLY A 82 10.923 1.735 -9.182 1.00 0.00 H new ATOM 0 HA2 GLY A 82 8.185 1.549 -8.804 1.00 0.00 H new ATOM 0 HA3 GLY A 82 9.365 1.947 -7.572 1.00 0.00 H new ATOM 1391 N ILE A 83 9.359 4.612 -8.345 1.00 0.00 N ATOM 1392 CA ILE A 83 8.984 6.014 -8.270 1.00 0.00 C ATOM 1393 C ILE A 83 8.145 6.379 -9.496 1.00 0.00 C ATOM 1394 O ILE A 83 7.158 7.104 -9.384 1.00 0.00 O ATOM 1395 CB ILE A 83 10.224 6.892 -8.089 1.00 0.00 C ATOM 1396 CG1 ILE A 83 10.669 6.917 -6.625 1.00 0.00 C ATOM 1397 CG2 ILE A 83 9.984 8.299 -8.639 1.00 0.00 C ATOM 1398 CD1 ILE A 83 12.042 6.262 -6.459 1.00 0.00 C ATOM 0 H ILE A 83 10.361 4.435 -8.278 1.00 0.00 H new ATOM 0 HA ILE A 83 8.363 6.196 -7.393 1.00 0.00 H new ATOM 0 HB ILE A 83 11.039 6.455 -8.666 1.00 0.00 H new ATOM 0 HG12 ILE A 83 10.708 7.947 -6.270 1.00 0.00 H new ATOM 0 HG13 ILE A 83 9.936 6.395 -6.009 1.00 0.00 H new ATOM 0 HG21 ILE A 83 10.881 8.903 -8.498 1.00 0.00 H new ATOM 0 HG22 ILE A 83 9.750 8.239 -9.702 1.00 0.00 H new ATOM 0 HG23 ILE A 83 9.150 8.759 -8.110 1.00 0.00 H new ATOM 0 HD11 ILE A 83 12.335 6.293 -5.410 1.00 0.00 H new ATOM 0 HD12 ILE A 83 11.993 5.225 -6.792 1.00 0.00 H new ATOM 0 HD13 ILE A 83 12.777 6.801 -7.057 1.00 0.00 H new ATOM 1410 N GLN A 84 8.570 5.861 -10.639 1.00 0.00 N ATOM 1411 CA GLN A 84 7.871 6.123 -11.886 1.00 0.00 C ATOM 1412 C GLN A 84 6.404 5.704 -11.770 1.00 0.00 C ATOM 1413 O GLN A 84 5.519 6.376 -12.297 1.00 0.00 O ATOM 1414 CB GLN A 84 8.553 5.414 -13.057 1.00 0.00 C ATOM 1415 CG GLN A 84 9.394 6.395 -13.877 1.00 0.00 C ATOM 1416 CD GLN A 84 10.504 7.012 -13.024 1.00 0.00 C ATOM 1417 OE1 GLN A 84 10.264 7.630 -11.999 1.00 0.00 O ATOM 1418 NE2 GLN A 84 11.728 6.812 -13.503 1.00 0.00 N ATOM 0 H GLN A 84 9.390 5.261 -10.728 1.00 0.00 H new ATOM 0 HA GLN A 84 7.908 7.195 -12.082 1.00 0.00 H new ATOM 0 HB2 GLN A 84 9.187 4.611 -12.681 1.00 0.00 H new ATOM 0 HB3 GLN A 84 7.800 4.953 -13.696 1.00 0.00 H new ATOM 0 HG2 GLN A 84 9.832 5.879 -14.731 1.00 0.00 H new ATOM 0 HG3 GLN A 84 8.755 7.184 -14.274 1.00 0.00 H new ATOM 0 HE21 GLN A 84 11.858 6.285 -14.367 1.00 0.00 H new ATOM 0 HE22 GLN A 84 12.537 7.185 -13.007 1.00 0.00 H new ATOM 1427 N VAL A 85 6.192 4.595 -11.077 1.00 0.00 N ATOM 1428 CA VAL A 85 4.848 4.077 -10.885 1.00 0.00 C ATOM 1429 C VAL A 85 4.044 5.061 -10.032 1.00 0.00 C ATOM 1430 O VAL A 85 2.960 5.489 -10.427 1.00 0.00 O ATOM 1431 CB VAL A 85 4.909 2.673 -10.281 1.00 0.00 C ATOM 1432 CG1 VAL A 85 3.681 2.397 -9.410 1.00 0.00 C ATOM 1433 CG2 VAL A 85 5.056 1.612 -11.373 1.00 0.00 C ATOM 0 H VAL A 85 6.929 4.040 -10.641 1.00 0.00 H new ATOM 0 HA VAL A 85 4.335 3.982 -11.842 1.00 0.00 H new ATOM 0 HB VAL A 85 5.791 2.621 -9.643 1.00 0.00 H new ATOM 0 HG11 VAL A 85 3.749 1.392 -8.993 1.00 0.00 H new ATOM 0 HG12 VAL A 85 3.639 3.125 -8.599 1.00 0.00 H new ATOM 0 HG13 VAL A 85 2.779 2.477 -10.017 1.00 0.00 H new ATOM 0 HG21 VAL A 85 5.097 0.623 -10.916 1.00 0.00 H new ATOM 0 HG22 VAL A 85 4.202 1.665 -12.049 1.00 0.00 H new ATOM 0 HG23 VAL A 85 5.974 1.791 -11.933 1.00 0.00 H new ATOM 1443 N TYR A 86 4.606 5.391 -8.879 1.00 0.00 N ATOM 1444 CA TYR A 86 3.956 6.316 -7.967 1.00 0.00 C ATOM 1445 C TYR A 86 3.765 7.687 -8.619 1.00 0.00 C ATOM 1446 O TYR A 86 2.929 8.476 -8.182 1.00 0.00 O ATOM 1447 CB TYR A 86 4.897 6.461 -6.770 1.00 0.00 C ATOM 1448 CG TYR A 86 5.229 5.138 -6.075 1.00 0.00 C ATOM 1449 CD1 TYR A 86 4.242 4.194 -5.882 1.00 0.00 C ATOM 1450 CD2 TYR A 86 6.516 4.890 -5.643 1.00 0.00 C ATOM 1451 CE1 TYR A 86 4.554 2.949 -5.228 1.00 0.00 C ATOM 1452 CE2 TYR A 86 6.829 3.645 -4.990 1.00 0.00 C ATOM 1453 CZ TYR A 86 5.832 2.736 -4.815 1.00 0.00 C ATOM 1454 OH TYR A 86 6.127 1.561 -4.197 1.00 0.00 O ATOM 0 H TYR A 86 5.505 5.034 -8.555 1.00 0.00 H new ATOM 0 HA TYR A 86 2.972 5.944 -7.682 1.00 0.00 H new ATOM 0 HB2 TYR A 86 5.824 6.927 -7.104 1.00 0.00 H new ATOM 0 HB3 TYR A 86 4.444 7.137 -6.045 1.00 0.00 H new ATOM 0 HD1 TYR A 86 3.235 4.388 -6.221 1.00 0.00 H new ATOM 0 HD2 TYR A 86 7.288 5.629 -5.795 1.00 0.00 H new ATOM 0 HE1 TYR A 86 3.790 2.202 -5.069 1.00 0.00 H new ATOM 0 HE2 TYR A 86 7.832 3.438 -4.647 1.00 0.00 H new ATOM 0 HH TYR A 86 5.299 1.133 -3.896 1.00 0.00 H new ATOM 1464 N ARG A 87 4.555 7.928 -9.655 1.00 0.00 N ATOM 1465 CA ARG A 87 4.484 9.189 -10.373 1.00 0.00 C ATOM 1466 C ARG A 87 3.218 9.242 -11.230 1.00 0.00 C ATOM 1467 O ARG A 87 2.496 10.237 -11.217 1.00 0.00 O ATOM 1468 CB ARG A 87 5.708 9.383 -11.270 1.00 0.00 C ATOM 1469 CG ARG A 87 5.600 10.680 -12.074 1.00 0.00 C ATOM 1470 CD ARG A 87 5.907 11.895 -11.197 1.00 0.00 C ATOM 1471 NE ARG A 87 6.943 12.735 -11.841 1.00 0.00 N ATOM 1472 CZ ARG A 87 6.717 13.527 -12.898 1.00 0.00 C ATOM 1473 NH1 ARG A 87 5.492 13.592 -13.437 1.00 0.00 N ATOM 1474 NH2 ARG A 87 7.717 14.253 -13.416 1.00 0.00 N ATOM 0 H ARG A 87 5.248 7.271 -10.014 1.00 0.00 H new ATOM 0 HA ARG A 87 4.460 9.990 -9.634 1.00 0.00 H new ATOM 0 HB2 ARG A 87 6.611 9.404 -10.660 1.00 0.00 H new ATOM 0 HB3 ARG A 87 5.802 8.536 -11.950 1.00 0.00 H new ATOM 0 HG2 ARG A 87 6.293 10.650 -12.915 1.00 0.00 H new ATOM 0 HG3 ARG A 87 4.597 10.772 -12.490 1.00 0.00 H new ATOM 0 HD2 ARG A 87 5.000 12.479 -11.039 1.00 0.00 H new ATOM 0 HD3 ARG A 87 6.250 11.568 -10.216 1.00 0.00 H new ATOM 0 HE ARG A 87 7.887 12.709 -11.456 1.00 0.00 H new ATOM 0 HH11 ARG A 87 4.731 13.039 -13.043 1.00 0.00 H new ATOM 0 HH12 ARG A 87 5.320 14.195 -14.242 1.00 0.00 H new ATOM 0 HH21 ARG A 87 8.649 14.203 -13.006 1.00 0.00 H new ATOM 0 HH22 ARG A 87 7.546 14.856 -14.221 1.00 0.00 H new ATOM 1488 N ARG A 88 2.988 8.157 -11.956 1.00 0.00 N ATOM 1489 CA ARG A 88 1.822 8.067 -12.818 1.00 0.00 C ATOM 1490 C ARG A 88 0.559 7.849 -11.982 1.00 0.00 C ATOM 1491 O ARG A 88 -0.538 8.210 -12.403 1.00 0.00 O ATOM 1492 CB ARG A 88 1.966 6.921 -13.821 1.00 0.00 C ATOM 1493 CG ARG A 88 2.186 5.588 -13.102 1.00 0.00 C ATOM 1494 CD ARG A 88 2.037 4.412 -14.070 1.00 0.00 C ATOM 1495 NE ARG A 88 3.369 3.970 -14.538 1.00 0.00 N ATOM 1496 CZ ARG A 88 3.564 3.001 -15.443 1.00 0.00 C ATOM 1497 NH1 ARG A 88 2.514 2.368 -15.983 1.00 0.00 N ATOM 1498 NH2 ARG A 88 4.809 2.666 -15.809 1.00 0.00 N ATOM 0 H ARG A 88 3.589 7.333 -11.965 1.00 0.00 H new ATOM 0 HA ARG A 88 1.741 9.006 -13.366 1.00 0.00 H new ATOM 0 HB2 ARG A 88 1.071 6.861 -14.441 1.00 0.00 H new ATOM 0 HB3 ARG A 88 2.804 7.121 -14.489 1.00 0.00 H new ATOM 0 HG2 ARG A 88 3.180 5.572 -12.655 1.00 0.00 H new ATOM 0 HG3 ARG A 88 1.468 5.487 -12.288 1.00 0.00 H new ATOM 0 HD2 ARG A 88 1.524 3.587 -13.576 1.00 0.00 H new ATOM 0 HD3 ARG A 88 1.423 4.706 -14.921 1.00 0.00 H new ATOM 0 HE ARG A 88 4.190 4.432 -14.147 1.00 0.00 H new ATOM 0 HH11 ARG A 88 1.566 2.624 -15.705 1.00 0.00 H new ATOM 0 HH12 ARG A 88 2.662 1.630 -16.672 1.00 0.00 H new ATOM 0 HH21 ARG A 88 5.608 3.149 -15.399 1.00 0.00 H new ATOM 0 HH22 ARG A 88 4.957 1.928 -16.498 1.00 0.00 H new ATOM 1512 N PHE A 89 0.757 7.259 -10.812 1.00 0.00 N ATOM 1513 CA PHE A 89 -0.352 6.989 -9.913 1.00 0.00 C ATOM 1514 C PHE A 89 -0.629 8.190 -9.007 1.00 0.00 C ATOM 1515 O PHE A 89 -1.750 8.694 -8.965 1.00 0.00 O ATOM 1516 CB PHE A 89 0.055 5.795 -9.047 1.00 0.00 C ATOM 1517 CG PHE A 89 -0.698 4.504 -9.374 1.00 0.00 C ATOM 1518 CD1 PHE A 89 -0.208 3.650 -10.313 1.00 0.00 C ATOM 1519 CD2 PHE A 89 -1.856 4.209 -8.725 1.00 0.00 C ATOM 1520 CE1 PHE A 89 -0.907 2.452 -10.616 1.00 0.00 C ATOM 1521 CE2 PHE A 89 -2.555 3.011 -9.028 1.00 0.00 C ATOM 1522 CZ PHE A 89 -2.065 2.158 -9.968 1.00 0.00 C ATOM 0 H PHE A 89 1.669 6.960 -10.466 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.256 6.786 -10.488 1.00 0.00 H new ATOM 0 HB2 PHE A 89 1.124 5.620 -9.167 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -0.112 6.045 -7.999 1.00 0.00 H new ATOM 0 HD1 PHE A 89 0.712 3.883 -10.828 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -2.244 4.886 -7.979 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -0.518 1.774 -11.362 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -3.475 2.777 -8.513 1.00 0.00 H new ATOM 0 HZ PHE A 89 -2.597 1.247 -10.199 1.00 0.00 H new ATOM 1532 N TYR A 90 0.412 8.614 -8.306 1.00 0.00 N ATOM 1533 CA TYR A 90 0.295 9.747 -7.403 1.00 0.00 C ATOM 1534 C TYR A 90 1.036 10.966 -7.954 1.00 0.00 C ATOM 1535 O TYR A 90 2.138 10.839 -8.488 1.00 0.00 O ATOM 1536 CB TYR A 90 0.955 9.312 -6.093 1.00 0.00 C ATOM 1537 CG TYR A 90 0.760 7.832 -5.759 1.00 0.00 C ATOM 1538 CD1 TYR A 90 -0.461 7.229 -5.984 1.00 0.00 C ATOM 1539 CD2 TYR A 90 1.805 7.100 -5.233 1.00 0.00 C ATOM 1540 CE1 TYR A 90 -0.644 5.836 -5.669 1.00 0.00 C ATOM 1541 CE2 TYR A 90 1.622 5.707 -4.918 1.00 0.00 C ATOM 1542 CZ TYR A 90 0.406 5.143 -5.152 1.00 0.00 C ATOM 1543 OH TYR A 90 0.233 3.827 -4.855 1.00 0.00 O ATOM 0 H TYR A 90 1.341 8.194 -8.345 1.00 0.00 H new ATOM 0 HA TYR A 90 -0.750 10.027 -7.272 1.00 0.00 H new ATOM 0 HB2 TYR A 90 2.023 9.524 -6.148 1.00 0.00 H new ATOM 0 HB3 TYR A 90 0.553 9.914 -5.278 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -1.279 7.802 -6.396 1.00 0.00 H new ATOM 0 HD2 TYR A 90 2.760 7.572 -5.058 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -1.594 5.352 -5.840 1.00 0.00 H new ATOM 0 HE2 TYR A 90 2.431 5.123 -4.505 1.00 0.00 H new ATOM 0 HH TYR A 90 1.067 3.461 -4.495 1.00 0.00 H new ATOM 1553 N ASP A 91 0.403 12.120 -7.807 1.00 0.00 N ATOM 1554 CA ASP A 91 0.989 13.362 -8.283 1.00 0.00 C ATOM 1555 C ASP A 91 2.298 13.623 -7.535 1.00 0.00 C ATOM 1556 O ASP A 91 2.421 13.289 -6.357 1.00 0.00 O ATOM 1557 CB ASP A 91 0.054 14.546 -8.029 1.00 0.00 C ATOM 1558 CG ASP A 91 -1.438 14.224 -8.127 1.00 0.00 C ATOM 1559 OD1 ASP A 91 -1.961 14.296 -9.261 1.00 0.00 O ATOM 1560 OD2 ASP A 91 -2.023 13.912 -7.068 1.00 0.00 O ATOM 0 H ASP A 91 -0.511 12.222 -7.365 1.00 0.00 H new ATOM 0 HA ASP A 91 1.162 13.264 -9.355 1.00 0.00 H new ATOM 0 HB2 ASP A 91 0.260 14.945 -7.036 1.00 0.00 H new ATOM 0 HB3 ASP A 91 0.288 15.334 -8.744 1.00 0.00 H new ATOM 1565 N GLU A 92 3.242 14.219 -8.248 1.00 0.00 N ATOM 1566 CA GLU A 92 4.536 14.529 -7.666 1.00 0.00 C ATOM 1567 C GLU A 92 4.408 15.686 -6.674 1.00 0.00 C ATOM 1568 O GLU A 92 5.024 15.666 -5.609 1.00 0.00 O ATOM 1569 CB GLU A 92 5.564 14.850 -8.754 1.00 0.00 C ATOM 1570 CG GLU A 92 6.929 15.168 -8.141 1.00 0.00 C ATOM 1571 CD GLU A 92 7.246 16.661 -8.252 1.00 0.00 C ATOM 1572 OE1 GLU A 92 7.839 17.040 -9.285 1.00 0.00 O ATOM 1573 OE2 GLU A 92 6.889 17.389 -7.301 1.00 0.00 O ATOM 0 H GLU A 92 3.136 14.496 -9.224 1.00 0.00 H new ATOM 0 HA GLU A 92 4.890 13.651 -7.126 1.00 0.00 H new ATOM 0 HB2 GLU A 92 5.655 14.003 -9.434 1.00 0.00 H new ATOM 0 HB3 GLU A 92 5.220 15.699 -9.345 1.00 0.00 H new ATOM 0 HG2 GLU A 92 6.940 14.867 -7.093 1.00 0.00 H new ATOM 0 HG3 GLU A 92 7.702 14.590 -8.647 1.00 0.00 H new ATOM 1580 N GLU A 93 3.605 16.668 -7.058 1.00 0.00 N ATOM 1581 CA GLU A 93 3.389 17.831 -6.215 1.00 0.00 C ATOM 1582 C GLU A 93 2.813 17.407 -4.863 1.00 0.00 C ATOM 1583 O GLU A 93 3.352 17.762 -3.815 1.00 0.00 O ATOM 1584 CB GLU A 93 2.476 18.846 -6.906 1.00 0.00 C ATOM 1585 CG GLU A 93 3.103 20.242 -6.897 1.00 0.00 C ATOM 1586 CD GLU A 93 3.393 20.704 -5.468 1.00 0.00 C ATOM 1587 OE1 GLU A 93 4.437 20.272 -4.932 1.00 0.00 O ATOM 1588 OE2 GLU A 93 2.564 21.479 -4.943 1.00 0.00 O ATOM 0 H GLU A 93 3.096 16.682 -7.942 1.00 0.00 H new ATOM 0 HA GLU A 93 4.351 18.314 -6.042 1.00 0.00 H new ATOM 0 HB2 GLU A 93 2.290 18.533 -7.934 1.00 0.00 H new ATOM 0 HB3 GLU A 93 1.510 18.874 -6.402 1.00 0.00 H new ATOM 0 HG2 GLU A 93 4.027 20.233 -7.475 1.00 0.00 H new ATOM 0 HG3 GLU A 93 2.431 20.950 -7.382 1.00 0.00 H new ATOM 1595 N LYS A 94 1.725 16.653 -4.929 1.00 0.00 N ATOM 1596 CA LYS A 94 1.070 16.177 -3.723 1.00 0.00 C ATOM 1597 C LYS A 94 2.054 15.331 -2.913 1.00 0.00 C ATOM 1598 O LYS A 94 2.102 15.430 -1.688 1.00 0.00 O ATOM 1599 CB LYS A 94 -0.228 15.446 -4.071 1.00 0.00 C ATOM 1600 CG LYS A 94 -1.448 16.234 -3.589 1.00 0.00 C ATOM 1601 CD LYS A 94 -2.050 15.600 -2.334 1.00 0.00 C ATOM 1602 CE LYS A 94 -3.548 15.894 -2.235 1.00 0.00 C ATOM 1603 NZ LYS A 94 -4.152 15.135 -1.117 1.00 0.00 N ATOM 0 H LYS A 94 1.281 16.360 -5.799 1.00 0.00 H new ATOM 0 HA LYS A 94 0.777 17.016 -3.092 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -0.289 15.299 -5.149 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -0.226 14.457 -3.614 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -1.160 17.264 -3.378 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -2.198 16.268 -4.379 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -1.888 14.522 -2.353 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -1.541 15.983 -1.449 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -3.706 16.962 -2.085 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -4.040 15.628 -3.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -5.169 15.346 -1.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -4.018 14.116 -1.276 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -3.694 15.409 -0.224 1.00 0.00 H new ATOM 1617 N GLU A 95 2.816 14.518 -3.630 1.00 0.00 N ATOM 1618 CA GLU A 95 3.796 13.655 -2.994 1.00 0.00 C ATOM 1619 C GLU A 95 4.887 14.494 -2.324 1.00 0.00 C ATOM 1620 O GLU A 95 5.169 14.320 -1.140 1.00 0.00 O ATOM 1621 CB GLU A 95 4.400 12.674 -4.001 1.00 0.00 C ATOM 1622 CG GLU A 95 4.963 11.440 -3.295 1.00 0.00 C ATOM 1623 CD GLU A 95 5.934 10.683 -4.204 1.00 0.00 C ATOM 1624 OE1 GLU A 95 5.439 10.052 -5.163 1.00 0.00 O ATOM 1625 OE2 GLU A 95 7.149 10.752 -3.919 1.00 0.00 O ATOM 0 H GLU A 95 2.774 14.439 -4.646 1.00 0.00 H new ATOM 0 HA GLU A 95 3.291 13.070 -2.225 1.00 0.00 H new ATOM 0 HB2 GLU A 95 3.639 12.370 -4.720 1.00 0.00 H new ATOM 0 HB3 GLU A 95 5.192 13.168 -4.565 1.00 0.00 H new ATOM 0 HG2 GLU A 95 5.475 11.741 -2.381 1.00 0.00 H new ATOM 0 HG3 GLU A 95 4.146 10.781 -3.000 1.00 0.00 H new ATOM 1632 N LYS A 96 5.470 15.386 -3.112 1.00 0.00 N ATOM 1633 CA LYS A 96 6.523 16.252 -2.611 1.00 0.00 C ATOM 1634 C LYS A 96 5.945 17.185 -1.544 1.00 0.00 C ATOM 1635 O LYS A 96 6.691 17.805 -0.787 1.00 0.00 O ATOM 1636 CB LYS A 96 7.207 16.987 -3.765 1.00 0.00 C ATOM 1637 CG LYS A 96 8.685 16.603 -3.860 1.00 0.00 C ATOM 1638 CD LYS A 96 9.572 17.674 -3.224 1.00 0.00 C ATOM 1639 CE LYS A 96 10.759 18.012 -4.129 1.00 0.00 C ATOM 1640 NZ LYS A 96 12.007 18.093 -3.339 1.00 0.00 N ATOM 0 H LYS A 96 5.233 15.527 -4.094 1.00 0.00 H new ATOM 0 HA LYS A 96 7.305 15.663 -2.131 1.00 0.00 H new ATOM 0 HB2 LYS A 96 6.704 16.748 -4.702 1.00 0.00 H new ATOM 0 HB3 LYS A 96 7.116 18.063 -3.620 1.00 0.00 H new ATOM 0 HG2 LYS A 96 8.849 15.647 -3.362 1.00 0.00 H new ATOM 0 HG3 LYS A 96 8.963 16.469 -4.905 1.00 0.00 H new ATOM 0 HD2 LYS A 96 8.985 18.573 -3.037 1.00 0.00 H new ATOM 0 HD3 LYS A 96 9.935 17.324 -2.258 1.00 0.00 H new ATOM 0 HE2 LYS A 96 10.861 17.252 -4.904 1.00 0.00 H new ATOM 0 HE3 LYS A 96 10.580 18.961 -4.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 12.802 18.323 -3.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 11.912 18.834 -2.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 12.185 17.179 -2.877 1.00 0.00 H new ATOM 1654 N LYS A 97 4.622 17.254 -1.518 1.00 0.00 N ATOM 1655 CA LYS A 97 3.936 18.101 -0.557 1.00 0.00 C ATOM 1656 C LYS A 97 4.010 17.455 0.829 1.00 0.00 C ATOM 1657 O LYS A 97 4.535 18.051 1.768 1.00 0.00 O ATOM 1658 CB LYS A 97 2.509 18.394 -1.023 1.00 0.00 C ATOM 1659 CG LYS A 97 2.361 19.856 -1.451 1.00 0.00 C ATOM 1660 CD LYS A 97 1.179 20.031 -2.406 1.00 0.00 C ATOM 1661 CE LYS A 97 -0.143 20.089 -1.637 1.00 0.00 C ATOM 1662 NZ LYS A 97 -0.812 21.391 -1.854 1.00 0.00 N ATOM 0 H LYS A 97 4.007 16.737 -2.147 1.00 0.00 H new ATOM 0 HA LYS A 97 4.428 19.071 -0.485 1.00 0.00 H new ATOM 0 HB2 LYS A 97 2.253 17.740 -1.856 1.00 0.00 H new ATOM 0 HB3 LYS A 97 1.807 18.174 -0.218 1.00 0.00 H new ATOM 0 HG2 LYS A 97 2.218 20.483 -0.571 1.00 0.00 H new ATOM 0 HG3 LYS A 97 3.278 20.191 -1.936 1.00 0.00 H new ATOM 0 HD2 LYS A 97 1.307 20.945 -2.985 1.00 0.00 H new ATOM 0 HD3 LYS A 97 1.155 19.204 -3.116 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -0.796 19.279 -1.963 1.00 0.00 H new ATOM 0 HE3 LYS A 97 0.042 19.941 -0.573 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -1.707 21.414 -1.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -0.194 22.159 -1.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -1.006 21.517 -2.868 1.00 0.00 H new ATOM 1676 N TYR A 98 3.476 16.245 0.912 1.00 0.00 N ATOM 1677 CA TYR A 98 3.475 15.513 2.167 1.00 0.00 C ATOM 1678 C TYR A 98 4.585 14.459 2.188 1.00 0.00 C ATOM 1679 O TYR A 98 5.414 14.444 3.096 1.00 0.00 O ATOM 1680 CB TYR A 98 2.119 14.809 2.242 1.00 0.00 C ATOM 1681 CG TYR A 98 0.953 15.739 2.586 1.00 0.00 C ATOM 1682 CD1 TYR A 98 1.024 16.551 3.700 1.00 0.00 C ATOM 1683 CD2 TYR A 98 -0.168 15.766 1.782 1.00 0.00 C ATOM 1684 CE1 TYR A 98 -0.073 17.426 4.023 1.00 0.00 C ATOM 1685 CE2 TYR A 98 -1.265 16.641 2.106 1.00 0.00 C ATOM 1686 CZ TYR A 98 -1.163 17.428 3.210 1.00 0.00 C ATOM 1687 OH TYR A 98 -2.199 18.255 3.515 1.00 0.00 O ATOM 0 H TYR A 98 3.041 15.754 0.131 1.00 0.00 H new ATOM 0 HA TYR A 98 3.643 16.188 3.006 1.00 0.00 H new ATOM 0 HB2 TYR A 98 1.917 14.329 1.285 1.00 0.00 H new ATOM 0 HB3 TYR A 98 2.173 14.018 2.990 1.00 0.00 H new ATOM 0 HD1 TYR A 98 1.902 16.530 4.329 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -0.223 15.131 0.910 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -0.031 18.066 4.892 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -2.149 16.671 1.486 1.00 0.00 H new ATOM 0 HH TYR A 98 -2.908 18.151 2.847 1.00 0.00 H new ATOM 1697 N GLY A 99 4.564 13.605 1.176 1.00 0.00 N ATOM 1698 CA GLY A 99 5.558 12.550 1.067 1.00 0.00 C ATOM 1699 C GLY A 99 4.892 11.185 0.885 1.00 0.00 C ATOM 1700 O GLY A 99 3.889 11.068 0.183 1.00 0.00 O ATOM 0 H GLY A 99 3.875 13.622 0.424 1.00 0.00 H new ATOM 0 HA2 GLY A 99 6.217 12.752 0.223 1.00 0.00 H new ATOM 0 HA3 GLY A 99 6.181 12.538 1.962 1.00 0.00 H new ATOM 1704 N VAL A 100 5.477 10.187 1.531 1.00 0.00 N ATOM 1705 CA VAL A 100 4.952 8.834 1.450 1.00 0.00 C ATOM 1706 C VAL A 100 4.620 8.335 2.857 1.00 0.00 C ATOM 1707 O VAL A 100 5.226 8.772 3.834 1.00 0.00 O ATOM 1708 CB VAL A 100 5.945 7.931 0.715 1.00 0.00 C ATOM 1709 CG1 VAL A 100 5.255 6.670 0.191 1.00 0.00 C ATOM 1710 CG2 VAL A 100 6.639 8.688 -0.420 1.00 0.00 C ATOM 0 H VAL A 100 6.309 10.288 2.112 1.00 0.00 H new ATOM 0 HA VAL A 100 4.028 8.817 0.873 1.00 0.00 H new ATOM 0 HB VAL A 100 6.709 7.623 1.429 1.00 0.00 H new ATOM 0 HG11 VAL A 100 5.983 6.046 -0.327 1.00 0.00 H new ATOM 0 HG12 VAL A 100 4.830 6.114 1.027 1.00 0.00 H new ATOM 0 HG13 VAL A 100 4.460 6.951 -0.500 1.00 0.00 H new ATOM 0 HG21 VAL A 100 7.339 8.023 -0.926 1.00 0.00 H new ATOM 0 HG22 VAL A 100 5.893 9.039 -1.133 1.00 0.00 H new ATOM 0 HG23 VAL A 100 7.180 9.541 -0.011 1.00 0.00 H new ATOM 1720 N VAL A 101 3.657 7.427 2.916 1.00 0.00 N ATOM 1721 CA VAL A 101 3.236 6.864 4.188 1.00 0.00 C ATOM 1722 C VAL A 101 3.043 5.355 4.034 1.00 0.00 C ATOM 1723 O VAL A 101 2.124 4.910 3.348 1.00 0.00 O ATOM 1724 CB VAL A 101 1.979 7.580 4.687 1.00 0.00 C ATOM 1725 CG1 VAL A 101 0.937 7.698 3.573 1.00 0.00 C ATOM 1726 CG2 VAL A 101 1.395 6.873 5.912 1.00 0.00 C ATOM 0 H VAL A 101 3.156 7.067 2.104 1.00 0.00 H new ATOM 0 HA VAL A 101 4.004 7.018 4.946 1.00 0.00 H new ATOM 0 HB VAL A 101 2.264 8.588 4.987 1.00 0.00 H new ATOM 0 HG11 VAL A 101 0.054 8.211 3.954 1.00 0.00 H new ATOM 0 HG12 VAL A 101 1.356 8.265 2.742 1.00 0.00 H new ATOM 0 HG13 VAL A 101 0.658 6.702 3.229 1.00 0.00 H new ATOM 0 HG21 VAL A 101 0.503 7.402 6.246 1.00 0.00 H new ATOM 0 HG22 VAL A 101 1.132 5.848 5.650 1.00 0.00 H new ATOM 0 HG23 VAL A 101 2.134 6.864 6.714 1.00 0.00 H new ATOM 1736 N ALA A 102 3.924 4.608 4.684 1.00 0.00 N ATOM 1737 CA ALA A 102 3.861 3.157 4.628 1.00 0.00 C ATOM 1738 C ALA A 102 2.839 2.655 5.649 1.00 0.00 C ATOM 1739 O ALA A 102 3.143 2.547 6.836 1.00 0.00 O ATOM 1740 CB ALA A 102 5.257 2.577 4.866 1.00 0.00 C ATOM 0 H ALA A 102 4.685 4.980 5.252 1.00 0.00 H new ATOM 0 HA ALA A 102 3.533 2.824 3.643 1.00 0.00 H new ATOM 0 HB1 ALA A 102 5.211 1.489 4.824 1.00 0.00 H new ATOM 0 HB2 ALA A 102 5.938 2.941 4.097 1.00 0.00 H new ATOM 0 HB3 ALA A 102 5.618 2.887 5.847 1.00 0.00 H new ATOM 1746 N ILE A 103 1.647 2.361 5.150 1.00 0.00 N ATOM 1747 CA ILE A 103 0.578 1.873 6.004 1.00 0.00 C ATOM 1748 C ILE A 103 0.655 0.347 6.088 1.00 0.00 C ATOM 1749 O ILE A 103 0.487 -0.343 5.084 1.00 0.00 O ATOM 1750 CB ILE A 103 -0.776 2.394 5.518 1.00 0.00 C ATOM 1751 CG1 ILE A 103 -0.937 2.181 4.011 1.00 0.00 C ATOM 1752 CG2 ILE A 103 -0.975 3.858 5.915 1.00 0.00 C ATOM 1753 CD1 ILE A 103 -0.495 3.422 3.232 1.00 0.00 C ATOM 0 H ILE A 103 1.398 2.452 4.165 1.00 0.00 H new ATOM 0 HA ILE A 103 0.696 2.255 7.018 1.00 0.00 H new ATOM 0 HB ILE A 103 -1.560 1.818 6.010 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -0.347 1.320 3.697 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -1.978 1.955 3.781 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -1.945 4.203 5.557 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -0.935 3.949 7.000 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -0.187 4.466 5.470 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -0.619 3.244 2.164 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -1.104 4.275 3.531 1.00 0.00 H new ATOM 0 HD13 ILE A 103 0.553 3.631 3.445 1.00 0.00 H new ATOM 1765 N GLU A 104 0.911 -0.135 7.296 1.00 0.00 N ATOM 1766 CA GLU A 104 1.013 -1.566 7.525 1.00 0.00 C ATOM 1767 C GLU A 104 -0.379 -2.201 7.540 1.00 0.00 C ATOM 1768 O GLU A 104 -1.175 -1.941 8.441 1.00 0.00 O ATOM 1769 CB GLU A 104 1.764 -1.861 8.824 1.00 0.00 C ATOM 1770 CG GLU A 104 2.670 -3.084 8.668 1.00 0.00 C ATOM 1771 CD GLU A 104 2.795 -3.847 9.988 1.00 0.00 C ATOM 1772 OE1 GLU A 104 3.431 -3.289 10.908 1.00 0.00 O ATOM 1773 OE2 GLU A 104 2.251 -4.971 10.048 1.00 0.00 O ATOM 0 H GLU A 104 1.051 0.441 8.126 1.00 0.00 H new ATOM 0 HA GLU A 104 1.583 -2.006 6.707 1.00 0.00 H new ATOM 0 HB2 GLU A 104 2.362 -0.995 9.107 1.00 0.00 H new ATOM 0 HB3 GLU A 104 1.050 -2.033 9.630 1.00 0.00 H new ATOM 0 HG2 GLU A 104 2.267 -3.744 7.900 1.00 0.00 H new ATOM 0 HG3 GLU A 104 3.658 -2.769 8.331 1.00 0.00 H new ATOM 1780 N ILE A 105 -0.631 -3.023 6.531 1.00 0.00 N ATOM 1781 CA ILE A 105 -1.912 -3.697 6.416 1.00 0.00 C ATOM 1782 C ILE A 105 -1.696 -5.210 6.490 1.00 0.00 C ATOM 1783 O ILE A 105 -0.581 -5.691 6.294 1.00 0.00 O ATOM 1784 CB ILE A 105 -2.647 -3.242 5.154 1.00 0.00 C ATOM 1785 CG1 ILE A 105 -2.180 -4.035 3.931 1.00 0.00 C ATOM 1786 CG2 ILE A 105 -2.500 -1.733 4.948 1.00 0.00 C ATOM 1787 CD1 ILE A 105 -0.690 -3.807 3.667 1.00 0.00 C ATOM 0 H ILE A 105 0.032 -3.237 5.786 1.00 0.00 H new ATOM 0 HA ILE A 105 -2.560 -3.426 7.249 1.00 0.00 H new ATOM 0 HB ILE A 105 -3.709 -3.448 5.285 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -2.367 -5.097 4.089 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -2.758 -3.736 3.057 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -3.032 -1.436 4.044 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -2.919 -1.206 5.805 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -1.444 -1.481 4.848 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -0.383 -4.382 2.793 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -0.511 -2.747 3.486 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -0.113 -4.130 4.534 1.00 0.00 H new ATOM 1799 N GLU A 106 -2.780 -5.918 6.773 1.00 0.00 N ATOM 1800 CA GLU A 106 -2.723 -7.366 6.874 1.00 0.00 C ATOM 1801 C GLU A 106 -4.007 -7.988 6.324 1.00 0.00 C ATOM 1802 O GLU A 106 -5.046 -7.963 6.983 1.00 0.00 O ATOM 1803 CB GLU A 106 -2.477 -7.805 8.319 1.00 0.00 C ATOM 1804 CG GLU A 106 -1.252 -8.717 8.415 1.00 0.00 C ATOM 1805 CD GLU A 106 0.005 -8.001 7.917 1.00 0.00 C ATOM 1806 OE1 GLU A 106 0.170 -6.819 8.289 1.00 0.00 O ATOM 1807 OE2 GLU A 106 0.772 -8.651 7.175 1.00 0.00 O ATOM 0 H GLU A 106 -3.703 -5.515 6.935 1.00 0.00 H new ATOM 0 HA GLU A 106 -1.885 -7.720 6.273 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -2.332 -6.928 8.949 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -3.355 -8.328 8.698 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -1.110 -9.033 9.448 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -1.419 -9.619 7.826 1.00 0.00 H new ATOM 1814 N PRO A 107 -3.892 -8.546 5.089 1.00 0.00 N ATOM 1815 CA PRO A 107 -5.032 -9.174 4.442 1.00 0.00 C ATOM 1816 C PRO A 107 -5.336 -10.536 5.067 1.00 0.00 C ATOM 1817 O PRO A 107 -4.609 -11.503 4.841 1.00 0.00 O ATOM 1818 CB PRO A 107 -4.649 -9.266 2.974 1.00 0.00 C ATOM 1819 CG PRO A 107 -3.137 -9.116 2.927 1.00 0.00 C ATOM 1820 CD PRO A 107 -2.679 -8.594 4.279 1.00 0.00 C ATOM 0 HA PRO A 107 -5.952 -8.603 4.565 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -4.960 -10.220 2.548 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -5.137 -8.483 2.393 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -2.665 -10.074 2.708 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -2.846 -8.428 2.133 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -1.931 -9.251 4.724 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -2.224 -7.608 4.189 1.00 0.00 H new ATOM 1828 N LEU A 108 -6.410 -10.570 5.842 1.00 0.00 N ATOM 1829 CA LEU A 108 -6.819 -11.798 6.502 1.00 0.00 C ATOM 1830 C LEU A 108 -7.918 -12.473 5.678 1.00 0.00 C ATOM 1831 O LEU A 108 -9.097 -12.384 6.018 1.00 0.00 O ATOM 1832 CB LEU A 108 -7.221 -11.520 7.951 1.00 0.00 C ATOM 1833 CG LEU A 108 -8.093 -10.284 8.180 1.00 0.00 C ATOM 1834 CD1 LEU A 108 -9.220 -10.584 9.171 1.00 0.00 C ATOM 1835 CD2 LEU A 108 -7.246 -9.088 8.620 1.00 0.00 C ATOM 0 H LEU A 108 -7.010 -9.766 6.028 1.00 0.00 H new ATOM 0 HA LEU A 108 -5.984 -12.497 6.556 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -7.753 -12.391 8.333 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -6.313 -11.415 8.545 1.00 0.00 H new ATOM 0 HG LEU A 108 -8.560 -10.016 7.232 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -9.825 -9.689 9.316 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -9.846 -11.385 8.778 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -8.793 -10.892 10.125 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -7.891 -8.223 8.776 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -6.731 -9.329 9.550 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -6.512 -8.859 7.848 1.00 0.00 H new ATOM 1847 N GLU A 109 -7.492 -13.134 4.611 1.00 0.00 N ATOM 1848 CA GLU A 109 -8.425 -13.823 3.737 1.00 0.00 C ATOM 1849 C GLU A 109 -7.934 -15.244 3.451 1.00 0.00 C ATOM 1850 O GLU A 109 -8.460 -15.921 2.569 1.00 0.00 O ATOM 1851 CB GLU A 109 -8.636 -13.045 2.437 1.00 0.00 C ATOM 1852 CG GLU A 109 -9.905 -13.510 1.719 1.00 0.00 C ATOM 1853 CD GLU A 109 -11.066 -12.548 1.979 1.00 0.00 C ATOM 1854 OE1 GLU A 109 -11.084 -11.966 3.085 1.00 0.00 O ATOM 1855 OE2 GLU A 109 -11.911 -12.417 1.067 1.00 0.00 O ATOM 0 H GLU A 109 -6.513 -13.207 4.333 1.00 0.00 H new ATOM 0 HA GLU A 109 -9.388 -13.887 4.244 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -8.707 -11.979 2.654 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -7.774 -13.181 1.784 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -9.717 -13.577 0.647 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -10.174 -14.510 2.059 1.00 0.00 H new ATOM 1862 N TYR A 110 -6.932 -15.654 4.214 1.00 0.00 N ATOM 1863 CA TYR A 110 -6.364 -16.981 4.054 1.00 0.00 C ATOM 1864 C TYR A 110 -5.844 -17.188 2.630 1.00 0.00 C ATOM 1865 O TYR A 110 -6.405 -16.649 1.677 1.00 0.00 O ATOM 1866 CB TYR A 110 -7.507 -17.964 4.314 1.00 0.00 C ATOM 1867 CG TYR A 110 -7.128 -19.431 4.103 1.00 0.00 C ATOM 1868 CD1 TYR A 110 -6.553 -20.150 5.131 1.00 0.00 C ATOM 1869 CD2 TYR A 110 -7.362 -20.035 2.884 1.00 0.00 C ATOM 1870 CE1 TYR A 110 -6.196 -21.531 4.931 1.00 0.00 C ATOM 1871 CE2 TYR A 110 -7.005 -21.416 2.685 1.00 0.00 C ATOM 1872 CZ TYR A 110 -6.440 -22.095 3.719 1.00 0.00 C ATOM 1873 OH TYR A 110 -6.103 -23.400 3.531 1.00 0.00 O ATOM 0 H TYR A 110 -6.499 -15.090 4.945 1.00 0.00 H new ATOM 0 HA TYR A 110 -5.526 -17.124 4.737 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -7.858 -17.834 5.338 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -8.341 -17.717 3.657 1.00 0.00 H new ATOM 0 HD1 TYR A 110 -6.371 -19.677 6.085 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -7.813 -19.472 2.080 1.00 0.00 H new ATOM 0 HE1 TYR A 110 -5.745 -22.105 5.726 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -7.182 -21.901 1.736 1.00 0.00 H new ATOM 0 HH TYR A 110 -6.336 -23.670 2.618 1.00 0.00 H new TER 1883 TYR A 110