USER MOD reduce.3.24.130724 H: found=0, std=0, add=682, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 681 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 Set 1.1: A 38 ASN : amide:sc= -0.0943 K(o=-0.094,f=-1.4) USER MOD Set 1.2: A 47 MET CE :methyl -161:sc= 0 (180deg=-0.0625) USER MOD Set 2.1: A 5 THR OG1 : rot 50:sc= -2.01! USER MOD Set 2.2: A 76 GLN : amide:sc= -1.7! K(o=-3.7!,f=0.66) USER MOD Single : A 10 LYS NZ :NH3+ -163:sc= -0.528 (180deg=-0.632) USER MOD Single : A 14 SER OG : rot 71:sc= 0.216 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 SER OG : rot -28:sc= 0.024 USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ -157:sc=-0.00846 (180deg=-0.428) USER MOD Single : A 30 LYS NZ :NH3+ -132:sc= -0.356 (180deg=-2.87!) USER MOD Single : A 32 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 HIS : no HD1:sc= -2.42 K(o=-2.4,f=-6.4!) USER MOD Single : A 36 ASN : amide:sc= -2.21! C(o=-2.2!,f=-4.2!) USER MOD Single : A 37 SER OG : rot 99:sc= 0.615 USER MOD Single : A 44 GLN : amide:sc= -2.13 K(o=-2.1,f=-0.83) USER MOD Single : A 48 HIS : no HD1:sc= -0.416 K(o=-0.42,f=-2.9!) USER MOD Single : A 51 MET CE :methyl 154:sc= -0.154 (180deg=-1.15) USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 GLN : amide:sc= -0.0319 K(o=-0.032,f=-1.1) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= -0.107 K(o=-0.11,f=-2.3!) USER MOD Single : A 75 THR OG1 : rot 71:sc= 0.0225 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 27 N VAL A 3 -4.065 -14.646 13.954 1.00 0.00 N ATOM 28 CA VAL A 3 -3.838 -15.065 15.335 1.00 0.00 C ATOM 29 C VAL A 3 -2.350 -15.292 15.593 1.00 0.00 C ATOM 30 O VAL A 3 -1.690 -16.041 14.873 1.00 0.00 O ATOM 31 CB VAL A 3 -4.614 -16.350 15.623 1.00 0.00 C ATOM 32 CG1 VAL A 3 -4.094 -17.479 14.728 1.00 0.00 C ATOM 33 CG2 VAL A 3 -4.430 -16.734 17.092 1.00 0.00 C ATOM 0 HA VAL A 3 -4.189 -14.274 15.997 1.00 0.00 H new ATOM 0 HB VAL A 3 -5.672 -16.189 15.418 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -4.649 -18.393 14.936 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -4.226 -17.204 13.682 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -3.035 -17.644 14.929 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -4.982 -17.650 17.301 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -3.371 -16.894 17.296 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -4.805 -15.932 17.728 1.00 0.00 H new ATOM 43 N TRP A 4 -1.826 -14.633 16.625 1.00 0.00 N ATOM 44 CA TRP A 4 -0.412 -14.762 16.983 1.00 0.00 C ATOM 45 C TRP A 4 -0.260 -15.097 18.465 1.00 0.00 C ATOM 46 O TRP A 4 -1.071 -14.676 19.291 1.00 0.00 O ATOM 47 CB TRP A 4 0.319 -13.465 16.664 1.00 0.00 C ATOM 48 CG TRP A 4 -0.304 -12.347 17.431 1.00 0.00 C ATOM 49 CD1 TRP A 4 -0.114 -12.109 18.749 1.00 0.00 C ATOM 50 CD2 TRP A 4 -1.218 -11.317 16.956 1.00 0.00 C ATOM 51 NE1 TRP A 4 -0.854 -10.999 19.113 1.00 0.00 N ATOM 52 CE2 TRP A 4 -1.552 -10.475 18.043 1.00 0.00 C ATOM 53 CE3 TRP A 4 -1.786 -11.036 15.700 1.00 0.00 C ATOM 54 CZ2 TRP A 4 -2.416 -9.391 17.889 1.00 0.00 C ATOM 55 CZ3 TRP A 4 -2.656 -9.945 15.542 1.00 0.00 C ATOM 56 CH2 TRP A 4 -2.970 -9.125 16.635 1.00 0.00 C ATOM 0 H TRP A 4 -2.357 -14.005 17.228 1.00 0.00 H new ATOM 0 HA TRP A 4 0.023 -15.574 16.401 1.00 0.00 H new ATOM 0 HB2 TRP A 4 1.374 -13.555 16.923 1.00 0.00 H new ATOM 0 HB3 TRP A 4 0.270 -13.260 15.595 1.00 0.00 H new ATOM 0 HD1 TRP A 4 0.513 -12.691 19.409 1.00 0.00 H new ATOM 0 HE1 TRP A 4 -0.881 -10.614 20.057 1.00 0.00 H new ATOM 0 HE3 TRP A 4 -1.552 -11.663 14.852 1.00 0.00 H new ATOM 0 HZ2 TRP A 4 -2.655 -8.762 18.734 1.00 0.00 H new ATOM 0 HZ3 TRP A 4 -3.086 -9.736 14.573 1.00 0.00 H new ATOM 0 HH2 TRP A 4 -3.640 -8.288 16.507 1.00 0.00 H new ATOM 67 N THR A 5 0.794 -15.841 18.792 1.00 0.00 N ATOM 68 CA THR A 5 1.067 -16.227 20.176 1.00 0.00 C ATOM 69 C THR A 5 2.567 -16.456 20.366 1.00 0.00 C ATOM 70 O THR A 5 3.002 -17.563 20.682 1.00 0.00 O ATOM 71 CB THR A 5 0.297 -17.510 20.514 1.00 0.00 C ATOM 72 OG1 THR A 5 0.375 -18.394 19.407 1.00 0.00 O ATOM 73 CG2 THR A 5 -1.172 -17.187 20.804 1.00 0.00 C ATOM 0 H THR A 5 1.475 -16.190 18.117 1.00 0.00 H new ATOM 0 HA THR A 5 0.743 -15.427 20.842 1.00 0.00 H new ATOM 0 HB THR A 5 0.735 -17.972 21.398 1.00 0.00 H new ATOM 0 HG1 THR A 5 1.309 -18.482 19.124 1.00 0.00 H new ATOM 0 HG21 THR A 5 -1.707 -18.107 21.042 1.00 0.00 H new ATOM 0 HG22 THR A 5 -1.234 -16.502 21.649 1.00 0.00 H new ATOM 0 HG23 THR A 5 -1.622 -16.722 19.927 1.00 0.00 H new ATOM 81 N PRO A 6 3.353 -15.427 20.174 1.00 0.00 N ATOM 82 CA PRO A 6 4.834 -15.480 20.315 1.00 0.00 C ATOM 83 C PRO A 6 5.252 -15.349 21.769 1.00 0.00 C ATOM 84 O PRO A 6 4.403 -15.328 22.659 1.00 0.00 O ATOM 85 CB PRO A 6 5.308 -14.286 19.487 1.00 0.00 C ATOM 86 CG PRO A 6 4.212 -13.276 19.627 1.00 0.00 C ATOM 87 CD PRO A 6 2.907 -14.069 19.804 1.00 0.00 C ATOM 0 HA PRO A 6 5.262 -16.424 19.979 1.00 0.00 H new ATOM 0 HB2 PRO A 6 6.256 -13.897 19.858 1.00 0.00 H new ATOM 0 HB3 PRO A 6 5.463 -14.562 18.444 1.00 0.00 H new ATOM 0 HG2 PRO A 6 4.390 -12.626 20.484 1.00 0.00 H new ATOM 0 HG3 PRO A 6 4.160 -12.635 18.747 1.00 0.00 H new ATOM 0 HD2 PRO A 6 2.278 -13.632 20.579 1.00 0.00 H new ATOM 0 HD3 PRO A 6 2.320 -14.079 18.886 1.00 0.00 H new ATOM 95 N GLU A 7 6.561 -15.265 22.002 1.00 0.00 N ATOM 96 CA GLU A 7 7.093 -15.119 23.359 1.00 0.00 C ATOM 97 C GLU A 7 6.208 -14.191 24.197 1.00 0.00 C ATOM 98 O GLU A 7 6.289 -14.191 25.420 1.00 0.00 O ATOM 99 CB GLU A 7 8.510 -14.550 23.309 1.00 0.00 C ATOM 100 CG GLU A 7 9.451 -15.571 22.673 1.00 0.00 C ATOM 101 CD GLU A 7 10.851 -14.980 22.562 1.00 0.00 C ATOM 102 OE1 GLU A 7 11.028 -13.846 22.979 1.00 0.00 O ATOM 103 OE2 GLU A 7 11.726 -15.668 22.064 1.00 0.00 O ATOM 0 H GLU A 7 7.272 -15.295 21.272 1.00 0.00 H new ATOM 0 HA GLU A 7 7.108 -16.106 23.822 1.00 0.00 H new ATOM 0 HB2 GLU A 7 8.521 -13.624 22.735 1.00 0.00 H new ATOM 0 HB3 GLU A 7 8.850 -14.305 24.315 1.00 0.00 H new ATOM 0 HG2 GLU A 7 9.476 -16.480 23.274 1.00 0.00 H new ATOM 0 HG3 GLU A 7 9.085 -15.852 21.685 1.00 0.00 H new ATOM 110 N VAL A 8 5.357 -13.410 23.530 1.00 0.00 N ATOM 111 CA VAL A 8 4.457 -12.502 24.225 1.00 0.00 C ATOM 112 C VAL A 8 3.598 -13.294 25.208 1.00 0.00 C ATOM 113 O VAL A 8 3.467 -12.916 26.373 1.00 0.00 O ATOM 114 CB VAL A 8 3.548 -11.813 23.195 1.00 0.00 C ATOM 115 CG1 VAL A 8 2.419 -11.061 23.903 1.00 0.00 C ATOM 116 CG2 VAL A 8 4.368 -10.828 22.354 1.00 0.00 C ATOM 0 H VAL A 8 5.276 -13.391 22.513 1.00 0.00 H new ATOM 0 HA VAL A 8 5.034 -11.754 24.768 1.00 0.00 H new ATOM 0 HB VAL A 8 3.116 -12.575 22.546 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.783 -10.578 23.162 1.00 0.00 H new ATOM 0 HG12 VAL A 8 1.825 -11.763 24.488 1.00 0.00 H new ATOM 0 HG13 VAL A 8 2.844 -10.306 24.564 1.00 0.00 H new ATOM 0 HG21 VAL A 8 3.718 -10.343 21.626 1.00 0.00 H new ATOM 0 HG22 VAL A 8 4.810 -10.074 23.005 1.00 0.00 H new ATOM 0 HG23 VAL A 8 5.160 -11.366 21.832 1.00 0.00 H new ATOM 126 N LEU A 9 3.030 -14.404 24.739 1.00 0.00 N ATOM 127 CA LEU A 9 2.209 -15.243 25.604 1.00 0.00 C ATOM 128 C LEU A 9 3.064 -15.818 26.727 1.00 0.00 C ATOM 129 O LEU A 9 2.656 -15.833 27.888 1.00 0.00 O ATOM 130 CB LEU A 9 1.578 -16.386 24.796 1.00 0.00 C ATOM 131 CG LEU A 9 0.779 -17.319 25.724 1.00 0.00 C ATOM 132 CD1 LEU A 9 -0.280 -16.520 26.501 1.00 0.00 C ATOM 133 CD2 LEU A 9 0.090 -18.393 24.879 1.00 0.00 C ATOM 0 H LEU A 9 3.122 -14.738 23.780 1.00 0.00 H new ATOM 0 HA LEU A 9 1.413 -14.633 26.031 1.00 0.00 H new ATOM 0 HB2 LEU A 9 0.922 -15.978 24.027 1.00 0.00 H new ATOM 0 HB3 LEU A 9 2.357 -16.951 24.284 1.00 0.00 H new ATOM 0 HG LEU A 9 1.460 -17.784 26.437 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -0.837 -17.193 27.153 1.00 0.00 H new ATOM 0 HD12 LEU A 9 0.211 -15.755 27.103 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -0.965 -16.045 25.799 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -0.478 -19.058 25.529 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -0.585 -17.918 24.167 1.00 0.00 H new ATOM 0 HD23 LEU A 9 0.842 -18.969 24.339 1.00 0.00 H new ATOM 145 N LYS A 10 4.256 -16.290 26.373 1.00 0.00 N ATOM 146 CA LYS A 10 5.162 -16.859 27.363 1.00 0.00 C ATOM 147 C LYS A 10 5.580 -15.797 28.370 1.00 0.00 C ATOM 148 O LYS A 10 5.577 -16.032 29.577 1.00 0.00 O ATOM 149 CB LYS A 10 6.409 -17.430 26.677 1.00 0.00 C ATOM 150 CG LYS A 10 7.147 -18.384 27.642 1.00 0.00 C ATOM 151 CD LYS A 10 6.566 -19.808 27.534 1.00 0.00 C ATOM 152 CE LYS A 10 7.257 -20.572 26.397 1.00 0.00 C ATOM 153 NZ LYS A 10 6.729 -21.962 26.339 1.00 0.00 N ATOM 0 H LYS A 10 4.614 -16.290 25.418 1.00 0.00 H new ATOM 0 HA LYS A 10 4.639 -17.661 27.884 1.00 0.00 H new ATOM 0 HB2 LYS A 10 6.124 -17.964 25.770 1.00 0.00 H new ATOM 0 HB3 LYS A 10 7.072 -16.619 26.375 1.00 0.00 H new ATOM 0 HG2 LYS A 10 8.211 -18.399 27.406 1.00 0.00 H new ATOM 0 HG3 LYS A 10 7.052 -18.022 28.666 1.00 0.00 H new ATOM 0 HD2 LYS A 10 6.704 -20.338 28.476 1.00 0.00 H new ATOM 0 HD3 LYS A 10 5.493 -19.759 27.350 1.00 0.00 H new ATOM 0 HE2 LYS A 10 7.084 -20.066 25.447 1.00 0.00 H new ATOM 0 HE3 LYS A 10 8.335 -20.588 26.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 7.376 -22.556 25.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 6.650 -22.344 27.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 5.791 -21.959 25.890 1.00 0.00 H new ATOM 167 N ALA A 11 5.939 -14.628 27.860 1.00 0.00 N ATOM 168 CA ALA A 11 6.361 -13.524 28.712 1.00 0.00 C ATOM 169 C ALA A 11 5.226 -13.102 29.638 1.00 0.00 C ATOM 170 O ALA A 11 5.460 -12.576 30.725 1.00 0.00 O ATOM 171 CB ALA A 11 6.791 -12.334 27.852 1.00 0.00 C ATOM 0 H ALA A 11 5.947 -14.419 26.862 1.00 0.00 H new ATOM 0 HA ALA A 11 7.205 -13.857 29.316 1.00 0.00 H new ATOM 0 HB1 ALA A 11 7.105 -11.513 28.497 1.00 0.00 H new ATOM 0 HB2 ALA A 11 7.622 -12.630 27.211 1.00 0.00 H new ATOM 0 HB3 ALA A 11 5.953 -12.010 27.234 1.00 0.00 H new ATOM 177 N ARG A 12 3.994 -13.333 29.197 1.00 0.00 N ATOM 178 CA ARG A 12 2.830 -12.966 29.994 1.00 0.00 C ATOM 179 C ARG A 12 2.848 -13.711 31.325 1.00 0.00 C ATOM 180 O ARG A 12 2.657 -13.115 32.385 1.00 0.00 O ATOM 181 CB ARG A 12 1.549 -13.319 29.230 1.00 0.00 C ATOM 182 CG ARG A 12 0.328 -12.660 29.902 1.00 0.00 C ATOM 183 CD ARG A 12 0.146 -11.232 29.375 1.00 0.00 C ATOM 184 NE ARG A 12 -1.061 -10.638 29.937 1.00 0.00 N ATOM 185 CZ ARG A 12 -1.474 -9.437 29.550 1.00 0.00 C ATOM 186 NH1 ARG A 12 -0.794 -8.773 28.655 1.00 0.00 N ATOM 187 NH2 ARG A 12 -2.558 -8.921 30.063 1.00 0.00 N ATOM 0 H ARG A 12 3.777 -13.769 28.301 1.00 0.00 H new ATOM 0 HA ARG A 12 2.858 -11.893 30.185 1.00 0.00 H new ATOM 0 HB2 ARG A 12 1.629 -12.983 28.196 1.00 0.00 H new ATOM 0 HB3 ARG A 12 1.419 -14.401 29.204 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -0.568 -13.247 29.702 1.00 0.00 H new ATOM 0 HG3 ARG A 12 0.463 -12.643 30.983 1.00 0.00 H new ATOM 0 HD2 ARG A 12 1.014 -10.627 29.637 1.00 0.00 H new ATOM 0 HD3 ARG A 12 0.082 -11.244 28.287 1.00 0.00 H new ATOM 0 HE ARG A 12 -1.596 -11.152 30.637 1.00 0.00 H new ATOM 0 HH11 ARG A 12 0.053 -9.177 28.255 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -1.109 -7.850 28.356 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -3.089 -9.441 30.762 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -2.874 -7.998 29.765 1.00 0.00 H new ATOM 201 N ALA A 13 3.091 -15.019 31.260 1.00 0.00 N ATOM 202 CA ALA A 13 3.147 -15.848 32.464 1.00 0.00 C ATOM 203 C ALA A 13 4.560 -15.850 33.041 1.00 0.00 C ATOM 204 O ALA A 13 4.749 -15.806 34.256 1.00 0.00 O ATOM 205 CB ALA A 13 2.728 -17.280 32.130 1.00 0.00 C ATOM 0 H ALA A 13 3.252 -15.527 30.390 1.00 0.00 H new ATOM 0 HA ALA A 13 2.462 -15.434 33.204 1.00 0.00 H new ATOM 0 HB1 ALA A 13 2.772 -17.892 33.031 1.00 0.00 H new ATOM 0 HB2 ALA A 13 1.710 -17.280 31.741 1.00 0.00 H new ATOM 0 HB3 ALA A 13 3.403 -17.691 31.379 1.00 0.00 H new ATOM 211 N SER A 14 5.546 -15.900 32.152 1.00 0.00 N ATOM 212 CA SER A 14 6.948 -15.905 32.558 1.00 0.00 C ATOM 213 C SER A 14 7.431 -14.482 32.806 1.00 0.00 C ATOM 214 O SER A 14 8.608 -14.258 33.081 1.00 0.00 O ATOM 215 CB SER A 14 7.804 -16.560 31.473 1.00 0.00 C ATOM 216 OG SER A 14 7.170 -17.752 31.028 1.00 0.00 O ATOM 0 H SER A 14 5.400 -15.938 31.143 1.00 0.00 H new ATOM 0 HA SER A 14 7.042 -16.476 33.482 1.00 0.00 H new ATOM 0 HB2 SER A 14 7.940 -15.873 30.637 1.00 0.00 H new ATOM 0 HB3 SER A 14 8.796 -16.787 31.864 1.00 0.00 H new ATOM 0 HG SER A 14 6.368 -17.523 30.513 1.00 0.00 H new ATOM 222 N VAL A 15 6.510 -13.527 32.696 1.00 0.00 N ATOM 223 CA VAL A 15 6.835 -12.118 32.903 1.00 0.00 C ATOM 224 C VAL A 15 7.864 -11.645 31.884 1.00 0.00 C ATOM 225 O VAL A 15 7.550 -10.855 30.992 1.00 0.00 O ATOM 226 CB VAL A 15 7.382 -11.907 34.316 1.00 0.00 C ATOM 227 CG1 VAL A 15 7.493 -10.410 34.604 1.00 0.00 C ATOM 228 CG2 VAL A 15 6.435 -12.553 35.331 1.00 0.00 C ATOM 0 H VAL A 15 5.532 -13.704 32.465 1.00 0.00 H new ATOM 0 HA VAL A 15 5.922 -11.536 32.776 1.00 0.00 H new ATOM 0 HB VAL A 15 8.368 -12.365 34.395 1.00 0.00 H new ATOM 0 HG11 VAL A 15 7.883 -10.261 35.611 1.00 0.00 H new ATOM 0 HG12 VAL A 15 8.167 -9.950 33.882 1.00 0.00 H new ATOM 0 HG13 VAL A 15 6.508 -9.950 34.525 1.00 0.00 H new ATOM 0 HG21 VAL A 15 6.824 -12.403 36.338 1.00 0.00 H new ATOM 0 HG22 VAL A 15 5.449 -12.095 35.251 1.00 0.00 H new ATOM 0 HG23 VAL A 15 6.357 -13.621 35.127 1.00 0.00 H new ATOM 238 N ILE A 16 9.096 -12.130 32.020 1.00 0.00 N ATOM 239 CA ILE A 16 10.179 -11.753 31.108 1.00 0.00 C ATOM 240 C ILE A 16 10.539 -12.922 30.200 1.00 0.00 C ATOM 241 O ILE A 16 10.669 -14.058 30.657 1.00 0.00 O ATOM 242 CB ILE A 16 11.408 -11.329 31.912 1.00 0.00 C ATOM 243 CG1 ILE A 16 12.491 -10.817 30.960 1.00 0.00 C ATOM 244 CG2 ILE A 16 11.944 -12.528 32.696 1.00 0.00 C ATOM 245 CD1 ILE A 16 13.592 -10.123 31.766 1.00 0.00 C ATOM 0 H ILE A 16 9.372 -12.785 32.752 1.00 0.00 H new ATOM 0 HA ILE A 16 9.843 -10.919 30.492 1.00 0.00 H new ATOM 0 HB ILE A 16 11.130 -10.536 32.606 1.00 0.00 H new ATOM 0 HG12 ILE A 16 12.910 -11.646 30.390 1.00 0.00 H new ATOM 0 HG13 ILE A 16 12.059 -10.122 30.241 1.00 0.00 H new ATOM 0 HG21 ILE A 16 12.820 -12.226 33.269 1.00 0.00 H new ATOM 0 HG22 ILE A 16 11.174 -12.892 33.376 1.00 0.00 H new ATOM 0 HG23 ILE A 16 12.221 -13.322 32.002 1.00 0.00 H new ATOM 0 HD11 ILE A 16 14.364 -9.758 31.088 1.00 0.00 H new ATOM 0 HD12 ILE A 16 13.166 -9.284 32.316 1.00 0.00 H new ATOM 0 HD13 ILE A 16 14.031 -10.832 32.468 1.00 0.00 H new ATOM 257 N GLY A 17 10.695 -12.639 28.911 1.00 0.00 N ATOM 258 CA GLY A 17 11.035 -13.679 27.949 1.00 0.00 C ATOM 259 C GLY A 17 12.240 -14.483 28.422 1.00 0.00 C ATOM 260 O GLY A 17 13.106 -13.968 29.129 1.00 0.00 O ATOM 0 H GLY A 17 10.592 -11.706 28.512 1.00 0.00 H new ATOM 0 HA2 GLY A 17 10.182 -14.343 27.808 1.00 0.00 H new ATOM 0 HA3 GLY A 17 11.251 -13.228 26.981 1.00 0.00 H new ATOM 264 N LYS A 18 12.284 -15.750 28.028 1.00 0.00 N ATOM 265 CA LYS A 18 13.383 -16.625 28.418 1.00 0.00 C ATOM 266 C LYS A 18 13.454 -17.835 27.489 1.00 0.00 C ATOM 267 O LYS A 18 13.010 -18.926 27.845 1.00 0.00 O ATOM 268 CB LYS A 18 13.184 -17.096 29.858 1.00 0.00 C ATOM 269 CG LYS A 18 14.400 -17.912 30.299 1.00 0.00 C ATOM 270 CD LYS A 18 14.289 -18.230 31.792 1.00 0.00 C ATOM 271 CE LYS A 18 15.360 -19.252 32.177 1.00 0.00 C ATOM 272 NZ LYS A 18 15.489 -19.299 33.661 1.00 0.00 N ATOM 0 H LYS A 18 11.576 -16.193 27.442 1.00 0.00 H new ATOM 0 HA LYS A 18 14.317 -16.067 28.344 1.00 0.00 H new ATOM 0 HB2 LYS A 18 13.049 -16.238 30.517 1.00 0.00 H new ATOM 0 HB3 LYS A 18 12.280 -17.701 29.933 1.00 0.00 H new ATOM 0 HG2 LYS A 18 14.459 -18.836 29.723 1.00 0.00 H new ATOM 0 HG3 LYS A 18 15.316 -17.355 30.102 1.00 0.00 H new ATOM 0 HD2 LYS A 18 14.412 -17.320 32.379 1.00 0.00 H new ATOM 0 HD3 LYS A 18 13.298 -18.623 32.018 1.00 0.00 H new ATOM 0 HE2 LYS A 18 15.094 -20.237 31.793 1.00 0.00 H new ATOM 0 HE3 LYS A 18 16.315 -18.982 31.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 16.217 -19.994 33.924 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 15.762 -18.360 34.016 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 14.578 -19.576 34.080 1.00 0.00 H new ATOM 286 N PRO A 19 14.000 -17.661 26.313 1.00 0.00 N ATOM 287 CA PRO A 19 14.128 -18.765 25.316 1.00 0.00 C ATOM 288 C PRO A 19 14.912 -19.950 25.873 1.00 0.00 C ATOM 289 O PRO A 19 15.856 -19.779 26.645 1.00 0.00 O ATOM 290 CB PRO A 19 14.869 -18.113 24.132 1.00 0.00 C ATOM 291 CG PRO A 19 14.657 -16.640 24.297 1.00 0.00 C ATOM 292 CD PRO A 19 14.547 -16.397 25.801 1.00 0.00 C ATOM 0 HA PRO A 19 13.159 -19.177 25.034 1.00 0.00 H new ATOM 0 HB2 PRO A 19 15.930 -18.362 24.147 1.00 0.00 H new ATOM 0 HB3 PRO A 19 14.473 -18.463 23.179 1.00 0.00 H new ATOM 0 HG2 PRO A 19 15.486 -16.076 23.870 1.00 0.00 H new ATOM 0 HG3 PRO A 19 13.753 -16.316 23.782 1.00 0.00 H new ATOM 0 HD2 PRO A 19 15.517 -16.171 26.243 1.00 0.00 H new ATOM 0 HD3 PRO A 19 13.891 -15.556 26.025 1.00 0.00 H new ATOM 300 N ILE A 20 14.510 -21.150 25.472 1.00 0.00 N ATOM 301 CA ILE A 20 15.174 -22.362 25.933 1.00 0.00 C ATOM 302 C ILE A 20 16.577 -22.470 25.346 1.00 0.00 C ATOM 303 O ILE A 20 16.862 -21.938 24.271 1.00 0.00 O ATOM 304 CB ILE A 20 14.356 -23.594 25.537 1.00 0.00 C ATOM 305 CG1 ILE A 20 15.037 -24.855 26.087 1.00 0.00 C ATOM 306 CG2 ILE A 20 14.268 -23.680 24.008 1.00 0.00 C ATOM 307 CD1 ILE A 20 14.079 -26.049 25.995 1.00 0.00 C ATOM 0 H ILE A 20 13.732 -21.309 24.832 1.00 0.00 H new ATOM 0 HA ILE A 20 15.253 -22.313 27.019 1.00 0.00 H new ATOM 0 HB ILE A 20 13.351 -23.515 25.952 1.00 0.00 H new ATOM 0 HG12 ILE A 20 15.946 -25.063 25.523 1.00 0.00 H new ATOM 0 HG13 ILE A 20 15.334 -24.695 27.123 1.00 0.00 H new ATOM 0 HG21 ILE A 20 13.686 -24.557 23.726 1.00 0.00 H new ATOM 0 HG22 ILE A 20 13.784 -22.783 23.620 1.00 0.00 H new ATOM 0 HG23 ILE A 20 15.271 -23.761 23.590 1.00 0.00 H new ATOM 0 HD11 ILE A 20 14.569 -26.940 26.387 1.00 0.00 H new ATOM 0 HD12 ILE A 20 13.182 -25.842 26.579 1.00 0.00 H new ATOM 0 HD13 ILE A 20 13.804 -26.215 24.954 1.00 0.00 H new ATOM 319 N GLY A 21 17.446 -23.168 26.062 1.00 0.00 N ATOM 320 CA GLY A 21 18.823 -23.362 25.624 1.00 0.00 C ATOM 321 C GLY A 21 18.904 -24.467 24.583 1.00 0.00 C ATOM 322 O GLY A 21 18.036 -25.332 24.544 1.00 0.00 O ATOM 0 H GLY A 21 17.222 -23.612 26.953 1.00 0.00 H new ATOM 0 HA2 GLY A 21 19.212 -22.433 25.207 1.00 0.00 H new ATOM 0 HA3 GLY A 21 19.450 -23.614 26.479 1.00 0.00 H new ATOM 326 N GLU A 22 19.944 -24.414 23.740 1.00 0.00 N ATOM 327 CA GLU A 22 20.159 -25.410 22.680 1.00 0.00 C ATOM 328 C GLU A 22 19.219 -25.162 21.504 1.00 0.00 C ATOM 329 O GLU A 22 18.360 -24.283 21.558 1.00 0.00 O ATOM 330 CB GLU A 22 19.953 -26.838 23.207 1.00 0.00 C ATOM 331 CG GLU A 22 20.844 -27.072 24.429 1.00 0.00 C ATOM 332 CD GLU A 22 22.311 -27.034 24.021 1.00 0.00 C ATOM 333 OE1 GLU A 22 22.582 -27.187 22.842 1.00 0.00 O ATOM 334 OE2 GLU A 22 23.142 -26.844 24.893 1.00 0.00 O ATOM 0 H GLU A 22 20.656 -23.685 23.772 1.00 0.00 H new ATOM 0 HA GLU A 22 21.190 -25.307 22.343 1.00 0.00 H new ATOM 0 HB2 GLU A 22 18.907 -26.990 23.473 1.00 0.00 H new ATOM 0 HB3 GLU A 22 20.192 -27.561 22.427 1.00 0.00 H new ATOM 0 HG2 GLU A 22 20.648 -26.310 25.183 1.00 0.00 H new ATOM 0 HG3 GLU A 22 20.609 -28.035 24.881 1.00 0.00 H new ATOM 341 N SER A 23 19.395 -25.945 20.439 1.00 0.00 N ATOM 342 CA SER A 23 18.562 -25.802 19.248 1.00 0.00 C ATOM 343 C SER A 23 17.103 -26.104 19.569 1.00 0.00 C ATOM 344 O SER A 23 16.201 -25.721 18.824 1.00 0.00 O ATOM 345 CB SER A 23 19.049 -26.740 18.144 1.00 0.00 C ATOM 346 OG SER A 23 18.516 -26.313 16.897 1.00 0.00 O ATOM 0 H SER A 23 20.101 -26.678 20.378 1.00 0.00 H new ATOM 0 HA SER A 23 18.639 -24.771 18.904 1.00 0.00 H new ATOM 0 HB2 SER A 23 20.138 -26.741 18.106 1.00 0.00 H new ATOM 0 HB3 SER A 23 18.736 -27.763 18.355 1.00 0.00 H new ATOM 0 HG SER A 23 17.660 -25.859 17.045 1.00 0.00 H new ATOM 352 N TYR A 24 16.876 -26.786 20.688 1.00 0.00 N ATOM 353 CA TYR A 24 15.519 -27.126 21.103 1.00 0.00 C ATOM 354 C TYR A 24 14.617 -25.894 21.025 1.00 0.00 C ATOM 355 O TYR A 24 13.393 -26.002 21.107 1.00 0.00 O ATOM 356 CB TYR A 24 15.536 -27.672 22.538 1.00 0.00 C ATOM 357 CG TYR A 24 16.009 -29.111 22.534 1.00 0.00 C ATOM 358 CD1 TYR A 24 17.357 -29.406 22.299 1.00 0.00 C ATOM 359 CD2 TYR A 24 15.097 -30.149 22.765 1.00 0.00 C ATOM 360 CE1 TYR A 24 17.794 -30.736 22.297 1.00 0.00 C ATOM 361 CE2 TYR A 24 15.534 -31.479 22.763 1.00 0.00 C ATOM 362 CZ TYR A 24 16.884 -31.772 22.531 1.00 0.00 C ATOM 363 OH TYR A 24 17.316 -33.083 22.528 1.00 0.00 O ATOM 0 H TYR A 24 17.608 -27.112 21.319 1.00 0.00 H new ATOM 0 HA TYR A 24 15.126 -27.890 20.433 1.00 0.00 H new ATOM 0 HB2 TYR A 24 16.194 -27.065 23.160 1.00 0.00 H new ATOM 0 HB3 TYR A 24 14.538 -27.609 22.973 1.00 0.00 H new ATOM 0 HD1 TYR A 24 18.061 -28.607 22.119 1.00 0.00 H new ATOM 0 HD2 TYR A 24 14.056 -29.923 22.945 1.00 0.00 H new ATOM 0 HE1 TYR A 24 18.834 -30.962 22.115 1.00 0.00 H new ATOM 0 HE2 TYR A 24 14.830 -32.279 22.940 1.00 0.00 H new ATOM 0 HH TYR A 24 16.558 -33.678 22.708 1.00 0.00 H new ATOM 373 N LYS A 25 15.233 -24.730 20.857 1.00 0.00 N ATOM 374 CA LYS A 25 14.492 -23.482 20.755 1.00 0.00 C ATOM 375 C LYS A 25 13.930 -23.313 19.348 1.00 0.00 C ATOM 376 O LYS A 25 13.342 -22.282 19.019 1.00 0.00 O ATOM 377 CB LYS A 25 15.412 -22.308 21.100 1.00 0.00 C ATOM 378 CG LYS A 25 16.505 -22.159 20.036 1.00 0.00 C ATOM 379 CD LYS A 25 17.461 -21.039 20.451 1.00 0.00 C ATOM 380 CE LYS A 25 18.451 -20.762 19.319 1.00 0.00 C ATOM 381 NZ LYS A 25 19.340 -21.943 19.139 1.00 0.00 N ATOM 0 H LYS A 25 16.245 -24.626 20.789 1.00 0.00 H new ATOM 0 HA LYS A 25 13.660 -23.504 21.459 1.00 0.00 H new ATOM 0 HB2 LYS A 25 14.831 -21.388 21.165 1.00 0.00 H new ATOM 0 HB3 LYS A 25 15.866 -22.468 22.078 1.00 0.00 H new ATOM 0 HG2 LYS A 25 17.050 -23.096 19.924 1.00 0.00 H new ATOM 0 HG3 LYS A 25 16.058 -21.932 19.068 1.00 0.00 H new ATOM 0 HD2 LYS A 25 16.898 -20.135 20.685 1.00 0.00 H new ATOM 0 HD3 LYS A 25 17.998 -21.323 21.356 1.00 0.00 H new ATOM 0 HE2 LYS A 25 17.913 -20.553 18.394 1.00 0.00 H new ATOM 0 HE3 LYS A 25 19.045 -19.878 19.549 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 20.224 -21.645 18.680 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 19.555 -22.360 20.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 18.862 -22.650 18.544 1.00 0.00 H new ATOM 395 N ARG A 26 14.118 -24.338 18.525 1.00 0.00 N ATOM 396 CA ARG A 26 13.632 -24.314 17.157 1.00 0.00 C ATOM 397 C ARG A 26 12.115 -24.267 17.138 1.00 0.00 C ATOM 398 O ARG A 26 11.521 -23.555 16.332 1.00 0.00 O ATOM 399 CB ARG A 26 14.120 -25.554 16.410 1.00 0.00 C ATOM 400 CG ARG A 26 13.670 -25.480 14.947 1.00 0.00 C ATOM 401 CD ARG A 26 14.216 -26.683 14.179 1.00 0.00 C ATOM 402 NE ARG A 26 13.661 -27.921 14.716 1.00 0.00 N ATOM 403 CZ ARG A 26 14.065 -29.105 14.270 1.00 0.00 C ATOM 404 NH1 ARG A 26 14.964 -29.176 13.326 1.00 0.00 N ATOM 405 NH2 ARG A 26 13.562 -30.198 14.775 1.00 0.00 N ATOM 0 H ARG A 26 14.605 -25.196 18.785 1.00 0.00 H new ATOM 0 HA ARG A 26 14.018 -23.422 16.664 1.00 0.00 H new ATOM 0 HB2 ARG A 26 15.207 -25.620 16.464 1.00 0.00 H new ATOM 0 HB3 ARG A 26 13.722 -26.454 16.879 1.00 0.00 H new ATOM 0 HG2 ARG A 26 12.582 -25.464 14.892 1.00 0.00 H new ATOM 0 HG3 ARG A 26 14.026 -24.555 14.493 1.00 0.00 H new ATOM 0 HD2 ARG A 26 13.965 -26.593 13.122 1.00 0.00 H new ATOM 0 HD3 ARG A 26 15.304 -26.704 14.248 1.00 0.00 H new ATOM 0 HE ARG A 26 12.951 -27.876 15.446 1.00 0.00 H new ATOM 0 HH11 ARG A 26 15.357 -28.322 12.930 1.00 0.00 H new ATOM 0 HH12 ARG A 26 15.274 -30.086 12.984 1.00 0.00 H new ATOM 0 HH21 ARG A 26 12.859 -30.143 15.512 1.00 0.00 H new ATOM 0 HH22 ARG A 26 13.872 -31.108 14.433 1.00 0.00 H new ATOM 419 N ILE A 27 11.493 -25.034 18.025 1.00 0.00 N ATOM 420 CA ILE A 27 10.043 -25.070 18.084 1.00 0.00 C ATOM 421 C ILE A 27 9.501 -23.686 18.423 1.00 0.00 C ATOM 422 O ILE A 27 8.530 -23.224 17.828 1.00 0.00 O ATOM 423 CB ILE A 27 9.586 -26.084 19.139 1.00 0.00 C ATOM 424 CG1 ILE A 27 8.073 -26.285 19.050 1.00 0.00 C ATOM 425 CG2 ILE A 27 9.944 -25.570 20.531 1.00 0.00 C ATOM 426 CD1 ILE A 27 7.689 -26.954 17.720 1.00 0.00 C ATOM 0 H ILE A 27 11.965 -25.631 18.704 1.00 0.00 H new ATOM 0 HA ILE A 27 9.657 -25.373 17.111 1.00 0.00 H new ATOM 0 HB ILE A 27 10.087 -27.035 18.957 1.00 0.00 H new ATOM 0 HG12 ILE A 27 7.734 -26.900 19.883 1.00 0.00 H new ATOM 0 HG13 ILE A 27 7.568 -25.323 19.138 1.00 0.00 H new ATOM 0 HG21 ILE A 27 9.619 -26.292 21.280 1.00 0.00 H new ATOM 0 HG22 ILE A 27 11.023 -25.434 20.602 1.00 0.00 H new ATOM 0 HG23 ILE A 27 9.446 -24.616 20.706 1.00 0.00 H new ATOM 0 HD11 ILE A 27 6.608 -27.087 17.679 1.00 0.00 H new ATOM 0 HD12 ILE A 27 8.009 -26.324 16.890 1.00 0.00 H new ATOM 0 HD13 ILE A 27 8.177 -27.926 17.647 1.00 0.00 H new ATOM 438 N LEU A 28 10.145 -23.027 19.375 1.00 0.00 N ATOM 439 CA LEU A 28 9.735 -21.690 19.777 1.00 0.00 C ATOM 440 C LEU A 28 10.055 -20.680 18.672 1.00 0.00 C ATOM 441 O LEU A 28 9.304 -19.732 18.445 1.00 0.00 O ATOM 442 CB LEU A 28 10.441 -21.291 21.077 1.00 0.00 C ATOM 443 CG LEU A 28 9.925 -19.931 21.569 1.00 0.00 C ATOM 444 CD1 LEU A 28 8.416 -20.009 21.881 1.00 0.00 C ATOM 445 CD2 LEU A 28 10.692 -19.543 22.835 1.00 0.00 C ATOM 0 H LEU A 28 10.950 -23.395 19.882 1.00 0.00 H new ATOM 0 HA LEU A 28 8.658 -21.691 19.946 1.00 0.00 H new ATOM 0 HB2 LEU A 28 10.269 -22.050 21.840 1.00 0.00 H new ATOM 0 HB3 LEU A 28 11.518 -21.242 20.914 1.00 0.00 H new ATOM 0 HG LEU A 28 10.079 -19.183 20.792 1.00 0.00 H new ATOM 0 HD11 LEU A 28 8.066 -19.037 22.229 1.00 0.00 H new ATOM 0 HD12 LEU A 28 7.872 -20.290 20.979 1.00 0.00 H new ATOM 0 HD13 LEU A 28 8.243 -20.756 22.656 1.00 0.00 H new ATOM 0 HD21 LEU A 28 10.335 -18.578 23.195 1.00 0.00 H new ATOM 0 HD22 LEU A 28 10.532 -20.299 23.604 1.00 0.00 H new ATOM 0 HD23 LEU A 28 11.756 -19.475 22.609 1.00 0.00 H new ATOM 457 N ALA A 29 11.185 -20.886 17.999 1.00 0.00 N ATOM 458 CA ALA A 29 11.610 -19.988 16.926 1.00 0.00 C ATOM 459 C ALA A 29 10.582 -19.955 15.796 1.00 0.00 C ATOM 460 O ALA A 29 10.505 -18.984 15.044 1.00 0.00 O ATOM 461 CB ALA A 29 12.961 -20.440 16.371 1.00 0.00 C ATOM 0 H ALA A 29 11.821 -21.663 18.176 1.00 0.00 H new ATOM 0 HA ALA A 29 11.700 -18.985 17.343 1.00 0.00 H new ATOM 0 HB1 ALA A 29 13.270 -19.766 15.572 1.00 0.00 H new ATOM 0 HB2 ALA A 29 13.705 -20.425 17.167 1.00 0.00 H new ATOM 0 HB3 ALA A 29 12.872 -21.452 15.977 1.00 0.00 H new ATOM 467 N LYS A 30 9.794 -21.019 15.684 1.00 0.00 N ATOM 468 CA LYS A 30 8.773 -21.098 14.641 1.00 0.00 C ATOM 469 C LYS A 30 7.763 -19.972 14.791 1.00 0.00 C ATOM 470 O LYS A 30 7.261 -19.444 13.802 1.00 0.00 O ATOM 471 CB LYS A 30 8.037 -22.441 14.719 1.00 0.00 C ATOM 472 CG LYS A 30 8.952 -23.591 14.267 1.00 0.00 C ATOM 473 CD LYS A 30 8.951 -23.693 12.738 1.00 0.00 C ATOM 474 CE LYS A 30 9.819 -24.874 12.303 1.00 0.00 C ATOM 475 NZ LYS A 30 9.788 -24.991 10.817 1.00 0.00 N ATOM 0 H LYS A 30 9.840 -21.833 16.296 1.00 0.00 H new ATOM 0 HA LYS A 30 9.272 -21.007 13.676 1.00 0.00 H new ATOM 0 HB2 LYS A 30 7.701 -22.618 15.741 1.00 0.00 H new ATOM 0 HB3 LYS A 30 7.147 -22.410 14.091 1.00 0.00 H new ATOM 0 HG2 LYS A 30 9.967 -23.422 14.628 1.00 0.00 H new ATOM 0 HG3 LYS A 30 8.611 -24.530 14.702 1.00 0.00 H new ATOM 0 HD2 LYS A 30 7.932 -23.823 12.373 1.00 0.00 H new ATOM 0 HD3 LYS A 30 9.331 -22.769 12.301 1.00 0.00 H new ATOM 0 HE2 LYS A 30 10.844 -24.732 12.646 1.00 0.00 H new ATOM 0 HE3 LYS A 30 9.455 -25.795 12.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 9.603 -25.979 10.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 9.035 -24.383 10.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 10.704 -24.693 10.426 1.00 0.00 H new ATOM 489 N LEU A 31 7.470 -19.611 16.029 1.00 0.00 N ATOM 490 CA LEU A 31 6.507 -18.551 16.285 1.00 0.00 C ATOM 491 C LEU A 31 6.850 -17.324 15.444 1.00 0.00 C ATOM 492 O LEU A 31 5.958 -16.628 14.957 1.00 0.00 O ATOM 493 CB LEU A 31 6.515 -18.182 17.777 1.00 0.00 C ATOM 494 CG LEU A 31 5.650 -19.172 18.579 1.00 0.00 C ATOM 495 CD1 LEU A 31 4.153 -19.006 18.225 1.00 0.00 C ATOM 496 CD2 LEU A 31 6.096 -20.609 18.271 1.00 0.00 C ATOM 0 H LEU A 31 7.879 -20.030 16.864 1.00 0.00 H new ATOM 0 HA LEU A 31 5.512 -18.903 16.013 1.00 0.00 H new ATOM 0 HB2 LEU A 31 7.537 -18.193 18.155 1.00 0.00 H new ATOM 0 HB3 LEU A 31 6.137 -17.168 17.910 1.00 0.00 H new ATOM 0 HG LEU A 31 5.779 -18.965 19.641 1.00 0.00 H new ATOM 0 HD11 LEU A 31 3.561 -19.716 18.804 1.00 0.00 H new ATOM 0 HD12 LEU A 31 3.834 -17.991 18.460 1.00 0.00 H new ATOM 0 HD13 LEU A 31 4.008 -19.195 17.161 1.00 0.00 H new ATOM 0 HD21 LEU A 31 5.484 -21.310 18.839 1.00 0.00 H new ATOM 0 HD22 LEU A 31 5.979 -20.806 17.205 1.00 0.00 H new ATOM 0 HD23 LEU A 31 7.142 -20.733 18.550 1.00 0.00 H new ATOM 508 N GLN A 32 8.142 -17.070 15.270 1.00 0.00 N ATOM 509 CA GLN A 32 8.578 -15.927 14.476 1.00 0.00 C ATOM 510 C GLN A 32 8.104 -16.076 13.033 1.00 0.00 C ATOM 511 O GLN A 32 7.456 -15.183 12.488 1.00 0.00 O ATOM 512 CB GLN A 32 10.105 -15.827 14.508 1.00 0.00 C ATOM 513 CG GLN A 32 10.558 -14.597 13.721 1.00 0.00 C ATOM 514 CD GLN A 32 12.069 -14.445 13.831 1.00 0.00 C ATOM 515 OE1 GLN A 32 12.817 -15.313 13.382 1.00 0.00 O ATOM 516 NE2 GLN A 32 12.566 -13.390 14.414 1.00 0.00 N ATOM 0 H GLN A 32 8.898 -17.632 15.662 1.00 0.00 H new ATOM 0 HA GLN A 32 8.146 -15.020 14.899 1.00 0.00 H new ATOM 0 HB2 GLN A 32 10.453 -15.759 15.539 1.00 0.00 H new ATOM 0 HB3 GLN A 32 10.547 -16.727 14.081 1.00 0.00 H new ATOM 0 HG2 GLN A 32 10.268 -14.696 12.675 1.00 0.00 H new ATOM 0 HG3 GLN A 32 10.064 -13.705 14.106 1.00 0.00 H new ATOM 0 HE21 GLN A 32 11.944 -12.672 14.785 1.00 0.00 H new ATOM 0 HE22 GLN A 32 13.577 -13.283 14.499 1.00 0.00 H new ATOM 525 N ARG A 33 8.421 -17.217 12.424 1.00 0.00 N ATOM 526 CA ARG A 33 8.009 -17.478 11.045 1.00 0.00 C ATOM 527 C ARG A 33 6.494 -17.578 10.942 1.00 0.00 C ATOM 528 O ARG A 33 5.895 -17.046 10.016 1.00 0.00 O ATOM 529 CB ARG A 33 8.650 -18.785 10.542 1.00 0.00 C ATOM 530 CG ARG A 33 10.108 -18.539 10.113 1.00 0.00 C ATOM 531 CD ARG A 33 10.151 -18.061 8.654 1.00 0.00 C ATOM 532 NE ARG A 33 11.530 -17.814 8.245 1.00 0.00 N ATOM 533 CZ ARG A 33 11.806 -17.083 7.170 1.00 0.00 C ATOM 534 NH1 ARG A 33 10.835 -16.590 6.452 1.00 0.00 N ATOM 535 NH2 ARG A 33 13.047 -16.860 6.830 1.00 0.00 N ATOM 0 H ARG A 33 8.956 -17.969 12.858 1.00 0.00 H new ATOM 0 HA ARG A 33 8.345 -16.647 10.425 1.00 0.00 H new ATOM 0 HB2 ARG A 33 8.618 -19.539 11.329 1.00 0.00 H new ATOM 0 HB3 ARG A 33 8.078 -19.177 9.701 1.00 0.00 H new ATOM 0 HG2 ARG A 33 10.566 -17.793 10.763 1.00 0.00 H new ATOM 0 HG3 ARG A 33 10.688 -19.456 10.222 1.00 0.00 H new ATOM 0 HD2 ARG A 33 9.700 -18.811 8.004 1.00 0.00 H new ATOM 0 HD3 ARG A 33 9.563 -17.150 8.545 1.00 0.00 H new ATOM 0 HE ARG A 33 12.294 -18.209 8.793 1.00 0.00 H new ATOM 0 HH11 ARG A 33 9.866 -16.766 6.716 1.00 0.00 H new ATOM 0 HH12 ARG A 33 11.045 -16.029 5.627 1.00 0.00 H new ATOM 0 HH21 ARG A 33 13.807 -17.247 7.390 1.00 0.00 H new ATOM 0 HH22 ARG A 33 13.257 -16.299 6.005 1.00 0.00 H new ATOM 549 N ILE A 34 5.885 -18.259 11.899 1.00 0.00 N ATOM 550 CA ILE A 34 4.439 -18.423 11.896 1.00 0.00 C ATOM 551 C ILE A 34 3.758 -17.065 12.044 1.00 0.00 C ATOM 552 O ILE A 34 2.782 -16.774 11.355 1.00 0.00 O ATOM 553 CB ILE A 34 4.020 -19.347 13.045 1.00 0.00 C ATOM 554 CG1 ILE A 34 4.562 -20.775 12.799 1.00 0.00 C ATOM 555 CG2 ILE A 34 2.492 -19.374 13.165 1.00 0.00 C ATOM 556 CD1 ILE A 34 4.026 -21.369 11.487 1.00 0.00 C ATOM 0 H ILE A 34 6.364 -18.704 12.682 1.00 0.00 H new ATOM 0 HA ILE A 34 4.133 -18.869 10.949 1.00 0.00 H new ATOM 0 HB ILE A 34 4.439 -18.968 13.977 1.00 0.00 H new ATOM 0 HG12 ILE A 34 5.651 -20.750 12.769 1.00 0.00 H new ATOM 0 HG13 ILE A 34 4.281 -21.419 13.632 1.00 0.00 H new ATOM 0 HG21 ILE A 34 2.203 -20.033 13.984 1.00 0.00 H new ATOM 0 HG22 ILE A 34 2.125 -18.367 13.363 1.00 0.00 H new ATOM 0 HG23 ILE A 34 2.060 -19.741 12.234 1.00 0.00 H new ATOM 0 HD11 ILE A 34 4.430 -22.372 11.350 1.00 0.00 H new ATOM 0 HD12 ILE A 34 2.938 -21.418 11.528 1.00 0.00 H new ATOM 0 HD13 ILE A 34 4.330 -20.739 10.651 1.00 0.00 H new ATOM 568 N HIS A 35 4.276 -16.240 12.948 1.00 0.00 N ATOM 569 CA HIS A 35 3.701 -14.917 13.176 1.00 0.00 C ATOM 570 C HIS A 35 3.762 -14.069 11.906 1.00 0.00 C ATOM 571 O HIS A 35 2.744 -13.546 11.452 1.00 0.00 O ATOM 572 CB HIS A 35 4.465 -14.208 14.298 1.00 0.00 C ATOM 573 CG HIS A 35 3.868 -12.849 14.533 1.00 0.00 C ATOM 574 ND1 HIS A 35 2.608 -12.683 15.083 1.00 0.00 N ATOM 575 CD2 HIS A 35 4.347 -11.583 14.302 1.00 0.00 C ATOM 576 CE1 HIS A 35 2.371 -11.362 15.164 1.00 0.00 C ATOM 577 NE2 HIS A 35 3.399 -10.645 14.702 1.00 0.00 N ATOM 0 H HIS A 35 5.084 -16.460 13.530 1.00 0.00 H new ATOM 0 HA HIS A 35 2.656 -15.042 13.461 1.00 0.00 H new ATOM 0 HB2 HIS A 35 4.420 -14.799 15.213 1.00 0.00 H new ATOM 0 HB3 HIS A 35 5.518 -14.113 14.031 1.00 0.00 H new ATOM 0 HD2 HIS A 35 5.312 -11.350 13.875 1.00 0.00 H new ATOM 0 HE1 HIS A 35 1.460 -10.933 15.555 1.00 0.00 H new ATOM 0 HE2 HIS A 35 3.473 -9.629 14.653 1.00 0.00 H new ATOM 585 N ASN A 36 4.957 -13.939 11.337 1.00 0.00 N ATOM 586 CA ASN A 36 5.131 -13.157 10.116 1.00 0.00 C ATOM 587 C ASN A 36 4.553 -13.895 8.913 1.00 0.00 C ATOM 588 O ASN A 36 3.885 -13.302 8.066 1.00 0.00 O ATOM 589 CB ASN A 36 6.617 -12.879 9.883 1.00 0.00 C ATOM 590 CG ASN A 36 6.809 -12.066 8.605 1.00 0.00 C ATOM 591 OD1 ASN A 36 5.879 -11.927 7.810 1.00 0.00 O ATOM 592 ND2 ASN A 36 7.967 -11.517 8.361 1.00 0.00 N ATOM 0 H ASN A 36 5.813 -14.361 11.698 1.00 0.00 H new ATOM 0 HA ASN A 36 4.598 -12.214 10.234 1.00 0.00 H new ATOM 0 HB2 ASN A 36 7.030 -12.336 10.733 1.00 0.00 H new ATOM 0 HB3 ASN A 36 7.163 -13.820 9.809 1.00 0.00 H new ATOM 0 HD21 ASN A 36 8.104 -10.971 7.510 1.00 0.00 H new ATOM 0 HD22 ASN A 36 8.736 -11.634 9.021 1.00 0.00 H new ATOM 599 N SER A 37 4.827 -15.194 8.841 1.00 0.00 N ATOM 600 CA SER A 37 4.344 -16.019 7.734 1.00 0.00 C ATOM 601 C SER A 37 2.964 -16.588 8.048 1.00 0.00 C ATOM 602 O SER A 37 2.510 -17.534 7.404 1.00 0.00 O ATOM 603 CB SER A 37 5.336 -17.162 7.463 1.00 0.00 C ATOM 604 OG SER A 37 6.649 -16.721 7.781 1.00 0.00 O ATOM 0 H SER A 37 5.380 -15.699 9.534 1.00 0.00 H new ATOM 0 HA SER A 37 4.264 -15.394 6.844 1.00 0.00 H new ATOM 0 HB2 SER A 37 5.077 -18.035 8.062 1.00 0.00 H new ATOM 0 HB3 SER A 37 5.284 -17.466 6.417 1.00 0.00 H new ATOM 0 HG SER A 37 6.895 -17.043 8.673 1.00 0.00 H new ATOM 610 N ASN A 38 2.304 -16.011 9.046 1.00 0.00 N ATOM 611 CA ASN A 38 0.980 -16.477 9.438 1.00 0.00 C ATOM 612 C ASN A 38 0.097 -16.614 8.208 1.00 0.00 C ATOM 613 O ASN A 38 0.270 -15.879 7.237 1.00 0.00 O ATOM 614 CB ASN A 38 0.342 -15.488 10.416 1.00 0.00 C ATOM 615 CG ASN A 38 -0.850 -16.136 11.108 1.00 0.00 C ATOM 616 OD1 ASN A 38 -0.799 -17.316 11.458 1.00 0.00 O ATOM 617 ND2 ASN A 38 -1.930 -15.434 11.324 1.00 0.00 N ATOM 0 H ASN A 38 2.660 -15.227 9.593 1.00 0.00 H new ATOM 0 HA ASN A 38 1.079 -17.447 9.924 1.00 0.00 H new ATOM 0 HB2 ASN A 38 1.076 -15.172 11.157 1.00 0.00 H new ATOM 0 HB3 ASN A 38 0.021 -14.593 9.883 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -2.734 -15.863 11.783 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -1.970 -14.457 11.033 1.00 0.00 H new ATOM 624 N ILE A 39 -0.847 -17.558 8.260 1.00 0.00 N ATOM 625 CA ILE A 39 -1.769 -17.799 7.145 1.00 0.00 C ATOM 626 C ILE A 39 -1.123 -17.501 5.792 1.00 0.00 C ATOM 627 O ILE A 39 -1.691 -16.784 4.968 1.00 0.00 O ATOM 628 CB ILE A 39 -3.022 -16.952 7.316 1.00 0.00 C ATOM 629 CG1 ILE A 39 -2.624 -15.506 7.520 1.00 0.00 C ATOM 630 CG2 ILE A 39 -3.817 -17.438 8.530 1.00 0.00 C ATOM 631 CD1 ILE A 39 -3.862 -14.623 7.423 1.00 0.00 C ATOM 0 H ILE A 39 -0.993 -18.169 9.063 1.00 0.00 H new ATOM 0 HA ILE A 39 -2.032 -18.857 7.160 1.00 0.00 H new ATOM 0 HB ILE A 39 -3.642 -17.041 6.424 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -2.150 -15.381 8.494 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -1.892 -15.209 6.769 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -4.712 -16.828 8.647 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -4.104 -18.479 8.384 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -3.201 -17.354 9.426 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -3.578 -13.581 7.570 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -4.316 -14.740 6.439 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -4.578 -14.915 8.191 1.00 0.00 H new ATOM 643 N LEU A 40 0.072 -18.051 5.573 1.00 0.00 N ATOM 644 CA LEU A 40 0.800 -17.838 4.319 1.00 0.00 C ATOM 645 C LEU A 40 0.839 -19.129 3.515 1.00 0.00 C ATOM 646 O LEU A 40 1.264 -20.166 4.017 1.00 0.00 O ATOM 647 CB LEU A 40 2.231 -17.383 4.622 1.00 0.00 C ATOM 648 CG LEU A 40 2.945 -16.981 3.323 1.00 0.00 C ATOM 649 CD1 LEU A 40 2.275 -15.736 2.702 1.00 0.00 C ATOM 650 CD2 LEU A 40 4.410 -16.676 3.641 1.00 0.00 C ATOM 0 H LEU A 40 0.556 -18.646 6.245 1.00 0.00 H new ATOM 0 HA LEU A 40 0.289 -17.069 3.740 1.00 0.00 H new ATOM 0 HB2 LEU A 40 2.214 -16.540 5.312 1.00 0.00 H new ATOM 0 HB3 LEU A 40 2.780 -18.186 5.114 1.00 0.00 H new ATOM 0 HG LEU A 40 2.880 -17.800 2.606 1.00 0.00 H new ATOM 0 HD11 LEU A 40 2.793 -15.465 1.782 1.00 0.00 H new ATOM 0 HD12 LEU A 40 1.231 -15.958 2.479 1.00 0.00 H new ATOM 0 HD13 LEU A 40 2.327 -14.906 3.406 1.00 0.00 H new ATOM 0 HD21 LEU A 40 4.929 -16.389 2.726 1.00 0.00 H new ATOM 0 HD22 LEU A 40 4.464 -15.859 4.360 1.00 0.00 H new ATOM 0 HD23 LEU A 40 4.883 -17.563 4.063 1.00 0.00 H new ATOM 662 N ASP A 41 0.394 -19.055 2.266 1.00 0.00 N ATOM 663 CA ASP A 41 0.373 -20.227 1.397 1.00 0.00 C ATOM 664 C ASP A 41 1.680 -20.995 1.479 1.00 0.00 C ATOM 665 O ASP A 41 1.691 -22.225 1.485 1.00 0.00 O ATOM 666 CB ASP A 41 0.113 -19.792 -0.047 1.00 0.00 C ATOM 667 CG ASP A 41 1.151 -18.761 -0.477 1.00 0.00 C ATOM 668 OD1 ASP A 41 1.925 -18.340 0.367 1.00 0.00 O ATOM 669 OD2 ASP A 41 1.160 -18.407 -1.645 1.00 0.00 O ATOM 0 H ASP A 41 0.044 -18.200 1.833 1.00 0.00 H new ATOM 0 HA ASP A 41 -0.428 -20.887 1.731 1.00 0.00 H new ATOM 0 HB2 ASP A 41 0.152 -20.657 -0.709 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -0.888 -19.370 -0.133 1.00 0.00 H new ATOM 674 N GLU A 42 2.775 -20.268 1.551 1.00 0.00 N ATOM 675 CA GLU A 42 4.082 -20.893 1.645 1.00 0.00 C ATOM 676 C GLU A 42 4.263 -21.581 2.995 1.00 0.00 C ATOM 677 O GLU A 42 4.881 -22.642 3.081 1.00 0.00 O ATOM 678 CB GLU A 42 5.158 -19.835 1.456 1.00 0.00 C ATOM 679 CG GLU A 42 5.186 -19.386 -0.007 1.00 0.00 C ATOM 680 CD GLU A 42 6.255 -18.315 -0.204 1.00 0.00 C ATOM 681 OE1 GLU A 42 6.934 -17.999 0.760 1.00 0.00 O ATOM 682 OE2 GLU A 42 6.380 -17.830 -1.316 1.00 0.00 O ATOM 0 H GLU A 42 2.789 -19.248 1.546 1.00 0.00 H new ATOM 0 HA GLU A 42 4.165 -21.650 0.865 1.00 0.00 H new ATOM 0 HB2 GLU A 42 4.961 -18.982 2.105 1.00 0.00 H new ATOM 0 HB3 GLU A 42 6.130 -20.236 1.743 1.00 0.00 H new ATOM 0 HG2 GLU A 42 5.391 -20.239 -0.654 1.00 0.00 H new ATOM 0 HG3 GLU A 42 4.210 -18.995 -0.295 1.00 0.00 H new ATOM 689 N ARG A 43 3.731 -20.965 4.050 1.00 0.00 N ATOM 690 CA ARG A 43 3.845 -21.519 5.401 1.00 0.00 C ATOM 691 C ARG A 43 2.708 -22.496 5.702 1.00 0.00 C ATOM 692 O ARG A 43 2.815 -23.318 6.613 1.00 0.00 O ATOM 693 CB ARG A 43 3.838 -20.377 6.425 1.00 0.00 C ATOM 694 CG ARG A 43 4.379 -20.861 7.782 1.00 0.00 C ATOM 695 CD ARG A 43 5.914 -20.997 7.746 1.00 0.00 C ATOM 696 NE ARG A 43 6.516 -19.857 7.065 1.00 0.00 N ATOM 697 CZ ARG A 43 7.754 -19.907 6.591 1.00 0.00 C ATOM 698 NH1 ARG A 43 8.463 -20.996 6.719 1.00 0.00 N ATOM 699 NH2 ARG A 43 8.258 -18.866 5.990 1.00 0.00 N ATOM 0 H ARG A 43 3.218 -20.085 3.997 1.00 0.00 H new ATOM 0 HA ARG A 43 4.784 -22.069 5.467 1.00 0.00 H new ATOM 0 HB2 ARG A 43 4.446 -19.550 6.059 1.00 0.00 H new ATOM 0 HB3 ARG A 43 2.824 -19.997 6.547 1.00 0.00 H new ATOM 0 HG2 ARG A 43 4.090 -20.159 8.564 1.00 0.00 H new ATOM 0 HG3 ARG A 43 3.931 -21.822 8.035 1.00 0.00 H new ATOM 0 HD2 ARG A 43 6.302 -21.066 8.762 1.00 0.00 H new ATOM 0 HD3 ARG A 43 6.191 -21.920 7.236 1.00 0.00 H new ATOM 0 HE ARG A 43 5.973 -19.001 6.950 1.00 0.00 H new ATOM 0 HH11 ARG A 43 8.065 -21.812 7.185 1.00 0.00 H new ATOM 0 HH12 ARG A 43 9.415 -21.031 6.353 1.00 0.00 H new ATOM 0 HH21 ARG A 43 7.701 -18.018 5.886 1.00 0.00 H new ATOM 0 HH22 ARG A 43 9.209 -18.899 5.624 1.00 0.00 H new ATOM 713 N GLN A 44 1.621 -22.408 4.940 1.00 0.00 N ATOM 714 CA GLN A 44 0.481 -23.299 5.154 1.00 0.00 C ATOM 715 C GLN A 44 0.955 -24.735 5.375 1.00 0.00 C ATOM 716 O GLN A 44 0.379 -25.469 6.178 1.00 0.00 O ATOM 717 CB GLN A 44 -0.477 -23.250 3.946 1.00 0.00 C ATOM 718 CG GLN A 44 -1.417 -22.046 4.062 1.00 0.00 C ATOM 719 CD GLN A 44 -2.407 -22.052 2.903 1.00 0.00 C ATOM 720 OE1 GLN A 44 -3.412 -21.345 2.941 1.00 0.00 O ATOM 721 NE2 GLN A 44 -2.180 -22.815 1.870 1.00 0.00 N ATOM 0 H GLN A 44 1.504 -21.739 4.179 1.00 0.00 H new ATOM 0 HA GLN A 44 -0.050 -22.960 6.044 1.00 0.00 H new ATOM 0 HB2 GLN A 44 0.096 -23.185 3.021 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -1.058 -24.171 3.897 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -1.953 -22.081 5.011 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -0.841 -21.121 4.056 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -1.345 -23.400 1.842 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -2.837 -22.826 1.090 1.00 0.00 H new ATOM 730 N GLY A 45 2.008 -25.125 4.664 1.00 0.00 N ATOM 731 CA GLY A 45 2.542 -26.467 4.800 1.00 0.00 C ATOM 732 C GLY A 45 3.210 -26.638 6.157 1.00 0.00 C ATOM 733 O GLY A 45 2.987 -27.630 6.851 1.00 0.00 O ATOM 0 H GLY A 45 2.502 -24.534 3.995 1.00 0.00 H new ATOM 0 HA2 GLY A 45 1.741 -27.197 4.688 1.00 0.00 H new ATOM 0 HA3 GLY A 45 3.263 -26.660 4.006 1.00 0.00 H new ATOM 737 N LEU A 46 4.036 -25.664 6.527 1.00 0.00 N ATOM 738 CA LEU A 46 4.738 -25.718 7.803 1.00 0.00 C ATOM 739 C LEU A 46 3.736 -25.651 8.964 1.00 0.00 C ATOM 740 O LEU A 46 3.858 -26.367 9.956 1.00 0.00 O ATOM 741 CB LEU A 46 5.738 -24.548 7.890 1.00 0.00 C ATOM 742 CG LEU A 46 6.953 -24.925 8.760 1.00 0.00 C ATOM 743 CD1 LEU A 46 6.482 -25.402 10.138 1.00 0.00 C ATOM 744 CD2 LEU A 46 7.779 -26.044 8.077 1.00 0.00 C ATOM 0 H LEU A 46 4.234 -24.835 5.966 1.00 0.00 H new ATOM 0 HA LEU A 46 5.283 -26.660 7.873 1.00 0.00 H new ATOM 0 HB2 LEU A 46 6.073 -24.276 6.889 1.00 0.00 H new ATOM 0 HB3 LEU A 46 5.243 -23.672 8.310 1.00 0.00 H new ATOM 0 HG LEU A 46 7.582 -24.043 8.879 1.00 0.00 H new ATOM 0 HD11 LEU A 46 7.347 -25.667 10.747 1.00 0.00 H new ATOM 0 HD12 LEU A 46 5.924 -24.604 10.628 1.00 0.00 H new ATOM 0 HD13 LEU A 46 5.840 -26.275 10.021 1.00 0.00 H new ATOM 0 HD21 LEU A 46 8.634 -26.299 8.703 1.00 0.00 H new ATOM 0 HD22 LEU A 46 7.153 -26.926 7.940 1.00 0.00 H new ATOM 0 HD23 LEU A 46 8.132 -25.695 7.107 1.00 0.00 H new ATOM 756 N MET A 47 2.740 -24.779 8.828 1.00 0.00 N ATOM 757 CA MET A 47 1.733 -24.618 9.872 1.00 0.00 C ATOM 758 C MET A 47 1.072 -25.959 10.175 1.00 0.00 C ATOM 759 O MET A 47 0.903 -26.331 11.338 1.00 0.00 O ATOM 760 CB MET A 47 0.664 -23.616 9.417 1.00 0.00 C ATOM 761 CG MET A 47 -0.239 -23.226 10.598 1.00 0.00 C ATOM 762 SD MET A 47 0.513 -21.840 11.487 1.00 0.00 S ATOM 763 CE MET A 47 -0.199 -20.513 10.484 1.00 0.00 C ATOM 0 H MET A 47 2.609 -24.179 8.014 1.00 0.00 H new ATOM 0 HA MET A 47 2.221 -24.245 10.773 1.00 0.00 H new ATOM 0 HB2 MET A 47 1.141 -22.726 9.006 1.00 0.00 H new ATOM 0 HB3 MET A 47 0.063 -24.052 8.619 1.00 0.00 H new ATOM 0 HG2 MET A 47 -1.230 -22.949 10.238 1.00 0.00 H new ATOM 0 HG3 MET A 47 -0.370 -24.076 11.268 1.00 0.00 H new ATOM 0 HE1 MET A 47 0.378 -19.599 10.627 1.00 0.00 H new ATOM 0 HE2 MET A 47 -0.173 -20.798 9.432 1.00 0.00 H new ATOM 0 HE3 MET A 47 -1.232 -20.341 10.788 1.00 0.00 H new ATOM 773 N HIS A 48 0.706 -26.686 9.125 1.00 0.00 N ATOM 774 CA HIS A 48 0.072 -27.989 9.298 1.00 0.00 C ATOM 775 C HIS A 48 1.051 -28.991 9.910 1.00 0.00 C ATOM 776 O HIS A 48 0.710 -29.713 10.846 1.00 0.00 O ATOM 777 CB HIS A 48 -0.418 -28.515 7.949 1.00 0.00 C ATOM 778 CG HIS A 48 -1.087 -29.844 8.147 1.00 0.00 C ATOM 779 ND1 HIS A 48 -2.272 -29.976 8.854 1.00 0.00 N ATOM 780 CD2 HIS A 48 -0.750 -31.111 7.740 1.00 0.00 C ATOM 781 CE1 HIS A 48 -2.604 -31.280 8.851 1.00 0.00 C ATOM 782 NE2 HIS A 48 -1.709 -32.016 8.186 1.00 0.00 N ATOM 0 H HIS A 48 0.835 -26.400 8.155 1.00 0.00 H new ATOM 0 HA HIS A 48 -0.775 -27.869 9.973 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -1.116 -27.807 7.502 1.00 0.00 H new ATOM 0 HB3 HIS A 48 0.420 -28.616 7.259 1.00 0.00 H new ATOM 0 HD2 HIS A 48 0.126 -31.367 7.162 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -3.486 -31.682 9.328 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -1.725 -33.025 8.037 1.00 0.00 H new ATOM 790 N GLU A 49 2.269 -29.023 9.378 1.00 0.00 N ATOM 791 CA GLU A 49 3.290 -29.935 9.881 1.00 0.00 C ATOM 792 C GLU A 49 3.697 -29.549 11.299 1.00 0.00 C ATOM 793 O GLU A 49 4.070 -30.402 12.104 1.00 0.00 O ATOM 794 CB GLU A 49 4.519 -29.908 8.970 1.00 0.00 C ATOM 795 CG GLU A 49 4.162 -30.515 7.612 1.00 0.00 C ATOM 796 CD GLU A 49 5.358 -30.424 6.671 1.00 0.00 C ATOM 797 OE1 GLU A 49 6.399 -29.964 7.110 1.00 0.00 O ATOM 798 OE2 GLU A 49 5.215 -30.816 5.524 1.00 0.00 O ATOM 0 H GLU A 49 2.572 -28.432 8.604 1.00 0.00 H new ATOM 0 HA GLU A 49 2.874 -30.942 9.893 1.00 0.00 H new ATOM 0 HB2 GLU A 49 4.867 -28.883 8.842 1.00 0.00 H new ATOM 0 HB3 GLU A 49 5.336 -30.467 9.427 1.00 0.00 H new ATOM 0 HG2 GLU A 49 3.865 -31.556 7.736 1.00 0.00 H new ATOM 0 HG3 GLU A 49 3.309 -29.989 7.182 1.00 0.00 H new ATOM 805 N LEU A 50 3.622 -28.257 11.592 1.00 0.00 N ATOM 806 CA LEU A 50 3.984 -27.757 12.912 1.00 0.00 C ATOM 807 C LEU A 50 3.067 -28.354 13.975 1.00 0.00 C ATOM 808 O LEU A 50 3.508 -28.687 15.076 1.00 0.00 O ATOM 809 CB LEU A 50 3.876 -26.229 12.940 1.00 0.00 C ATOM 810 CG LEU A 50 4.359 -25.679 14.292 1.00 0.00 C ATOM 811 CD1 LEU A 50 5.841 -26.040 14.519 1.00 0.00 C ATOM 812 CD2 LEU A 50 4.195 -24.153 14.301 1.00 0.00 C ATOM 0 H LEU A 50 3.315 -27.539 10.936 1.00 0.00 H new ATOM 0 HA LEU A 50 5.012 -28.051 13.125 1.00 0.00 H new ATOM 0 HB2 LEU A 50 4.472 -25.802 12.133 1.00 0.00 H new ATOM 0 HB3 LEU A 50 2.843 -25.928 12.767 1.00 0.00 H new ATOM 0 HG LEU A 50 3.765 -26.122 15.091 1.00 0.00 H new ATOM 0 HD11 LEU A 50 6.169 -25.644 15.480 1.00 0.00 H new ATOM 0 HD12 LEU A 50 5.956 -27.124 14.515 1.00 0.00 H new ATOM 0 HD13 LEU A 50 6.447 -25.608 13.723 1.00 0.00 H new ATOM 0 HD21 LEU A 50 4.536 -23.756 15.257 1.00 0.00 H new ATOM 0 HD22 LEU A 50 4.788 -23.719 13.496 1.00 0.00 H new ATOM 0 HD23 LEU A 50 3.145 -23.899 14.156 1.00 0.00 H new ATOM 824 N MET A 51 1.787 -28.478 13.638 1.00 0.00 N ATOM 825 CA MET A 51 0.812 -29.026 14.573 1.00 0.00 C ATOM 826 C MET A 51 1.280 -30.378 15.093 1.00 0.00 C ATOM 827 O MET A 51 1.244 -30.636 16.296 1.00 0.00 O ATOM 828 CB MET A 51 -0.542 -29.184 13.874 1.00 0.00 C ATOM 829 CG MET A 51 -1.579 -29.713 14.868 1.00 0.00 C ATOM 830 SD MET A 51 -3.200 -29.784 14.063 1.00 0.00 S ATOM 831 CE MET A 51 -2.813 -31.081 12.860 1.00 0.00 C ATOM 0 H MET A 51 1.403 -28.209 12.732 1.00 0.00 H new ATOM 0 HA MET A 51 0.709 -28.341 15.415 1.00 0.00 H new ATOM 0 HB2 MET A 51 -0.867 -28.225 13.470 1.00 0.00 H new ATOM 0 HB3 MET A 51 -0.449 -29.870 13.032 1.00 0.00 H new ATOM 0 HG2 MET A 51 -1.291 -30.704 15.219 1.00 0.00 H new ATOM 0 HG3 MET A 51 -1.623 -29.066 15.744 1.00 0.00 H new ATOM 0 HE1 MET A 51 -3.728 -31.603 12.581 1.00 0.00 H new ATOM 0 HE2 MET A 51 -2.366 -30.633 11.973 1.00 0.00 H new ATOM 0 HE3 MET A 51 -2.111 -31.789 13.301 1.00 0.00 H new ATOM 841 N GLU A 52 1.726 -31.237 14.185 1.00 0.00 N ATOM 842 CA GLU A 52 2.204 -32.556 14.576 1.00 0.00 C ATOM 843 C GLU A 52 3.496 -32.434 15.377 1.00 0.00 C ATOM 844 O GLU A 52 3.698 -33.151 16.358 1.00 0.00 O ATOM 845 CB GLU A 52 2.451 -33.412 13.332 1.00 0.00 C ATOM 846 CG GLU A 52 1.131 -33.630 12.586 1.00 0.00 C ATOM 847 CD GLU A 52 0.174 -34.456 13.438 1.00 0.00 C ATOM 848 OE1 GLU A 52 0.644 -35.118 14.348 1.00 0.00 O ATOM 849 OE2 GLU A 52 -1.015 -34.418 13.166 1.00 0.00 O ATOM 0 H GLU A 52 1.767 -31.047 13.184 1.00 0.00 H new ATOM 0 HA GLU A 52 1.445 -33.032 15.197 1.00 0.00 H new ATOM 0 HB2 GLU A 52 3.173 -32.922 12.679 1.00 0.00 H new ATOM 0 HB3 GLU A 52 2.881 -34.372 13.618 1.00 0.00 H new ATOM 0 HG2 GLU A 52 0.678 -32.668 12.346 1.00 0.00 H new ATOM 0 HG3 GLU A 52 1.319 -34.139 11.641 1.00 0.00 H new ATOM 856 N LEU A 53 4.368 -31.523 14.952 1.00 0.00 N ATOM 857 CA LEU A 53 5.638 -31.318 15.638 1.00 0.00 C ATOM 858 C LEU A 53 5.407 -30.840 17.069 1.00 0.00 C ATOM 859 O LEU A 53 6.049 -31.316 18.005 1.00 0.00 O ATOM 860 CB LEU A 53 6.480 -30.283 14.880 1.00 0.00 C ATOM 861 CG LEU A 53 7.819 -30.044 15.602 1.00 0.00 C ATOM 862 CD1 LEU A 53 8.603 -31.361 15.719 1.00 0.00 C ATOM 863 CD2 LEU A 53 8.641 -29.026 14.807 1.00 0.00 C ATOM 0 H LEU A 53 4.219 -30.920 14.143 1.00 0.00 H new ATOM 0 HA LEU A 53 6.170 -32.269 15.668 1.00 0.00 H new ATOM 0 HB2 LEU A 53 6.665 -30.630 13.863 1.00 0.00 H new ATOM 0 HB3 LEU A 53 5.930 -29.345 14.801 1.00 0.00 H new ATOM 0 HG LEU A 53 7.624 -29.663 16.604 1.00 0.00 H new ATOM 0 HD11 LEU A 53 9.548 -31.178 16.231 1.00 0.00 H new ATOM 0 HD12 LEU A 53 8.017 -32.084 16.286 1.00 0.00 H new ATOM 0 HD13 LEU A 53 8.801 -31.756 14.723 1.00 0.00 H new ATOM 0 HD21 LEU A 53 9.591 -28.851 15.312 1.00 0.00 H new ATOM 0 HD22 LEU A 53 8.828 -29.412 13.805 1.00 0.00 H new ATOM 0 HD23 LEU A 53 8.090 -28.088 14.737 1.00 0.00 H new ATOM 875 N ILE A 54 4.490 -29.891 17.229 1.00 0.00 N ATOM 876 CA ILE A 54 4.191 -29.352 18.549 1.00 0.00 C ATOM 877 C ILE A 54 3.603 -30.436 19.453 1.00 0.00 C ATOM 878 O ILE A 54 3.975 -30.557 20.618 1.00 0.00 O ATOM 879 CB ILE A 54 3.207 -28.185 18.428 1.00 0.00 C ATOM 880 CG1 ILE A 54 3.887 -26.993 17.722 1.00 0.00 C ATOM 881 CG2 ILE A 54 2.731 -27.758 19.824 1.00 0.00 C ATOM 882 CD1 ILE A 54 4.726 -26.152 18.702 1.00 0.00 C ATOM 0 H ILE A 54 3.946 -29.483 16.468 1.00 0.00 H new ATOM 0 HA ILE A 54 5.119 -28.994 18.994 1.00 0.00 H new ATOM 0 HB ILE A 54 2.348 -28.505 17.838 1.00 0.00 H new ATOM 0 HG12 ILE A 54 4.526 -27.362 16.920 1.00 0.00 H new ATOM 0 HG13 ILE A 54 3.127 -26.363 17.260 1.00 0.00 H new ATOM 0 HG21 ILE A 54 2.031 -26.927 19.732 1.00 0.00 H new ATOM 0 HG22 ILE A 54 2.236 -28.597 20.312 1.00 0.00 H new ATOM 0 HG23 ILE A 54 3.588 -27.446 20.421 1.00 0.00 H new ATOM 0 HD11 ILE A 54 5.188 -25.323 18.166 1.00 0.00 H new ATOM 0 HD12 ILE A 54 4.082 -25.761 19.490 1.00 0.00 H new ATOM 0 HD13 ILE A 54 5.503 -26.776 19.144 1.00 0.00 H new ATOM 894 N ASP A 55 2.680 -31.219 18.904 1.00 0.00 N ATOM 895 CA ASP A 55 2.042 -32.285 19.664 1.00 0.00 C ATOM 896 C ASP A 55 3.054 -33.355 20.048 1.00 0.00 C ATOM 897 O ASP A 55 2.966 -33.944 21.123 1.00 0.00 O ATOM 898 CB ASP A 55 0.919 -32.916 18.838 1.00 0.00 C ATOM 899 CG ASP A 55 0.299 -34.078 19.607 1.00 0.00 C ATOM 900 OD1 ASP A 55 0.594 -34.210 20.783 1.00 0.00 O ATOM 901 OD2 ASP A 55 -0.462 -34.819 19.007 1.00 0.00 O ATOM 0 H ASP A 55 2.359 -31.135 17.940 1.00 0.00 H new ATOM 0 HA ASP A 55 1.627 -31.854 20.575 1.00 0.00 H new ATOM 0 HB2 ASP A 55 0.157 -32.169 18.614 1.00 0.00 H new ATOM 0 HB3 ASP A 55 1.311 -33.268 17.884 1.00 0.00 H new ATOM 906 N LEU A 56 4.009 -33.609 19.160 1.00 0.00 N ATOM 907 CA LEU A 56 5.022 -34.623 19.422 1.00 0.00 C ATOM 908 C LEU A 56 5.847 -34.266 20.657 1.00 0.00 C ATOM 909 O LEU A 56 6.111 -35.121 21.503 1.00 0.00 O ATOM 910 CB LEU A 56 5.946 -34.768 18.200 1.00 0.00 C ATOM 911 CG LEU A 56 5.295 -35.677 17.133 1.00 0.00 C ATOM 912 CD1 LEU A 56 5.876 -35.353 15.750 1.00 0.00 C ATOM 913 CD2 LEU A 56 5.578 -37.153 17.457 1.00 0.00 C ATOM 0 H LEU A 56 4.102 -33.133 18.263 1.00 0.00 H new ATOM 0 HA LEU A 56 4.517 -35.571 19.610 1.00 0.00 H new ATOM 0 HB2 LEU A 56 6.151 -33.786 17.773 1.00 0.00 H new ATOM 0 HB3 LEU A 56 6.903 -35.188 18.509 1.00 0.00 H new ATOM 0 HG LEU A 56 4.219 -35.501 17.133 1.00 0.00 H new ATOM 0 HD11 LEU A 56 5.414 -35.996 15.001 1.00 0.00 H new ATOM 0 HD12 LEU A 56 5.675 -34.310 15.506 1.00 0.00 H new ATOM 0 HD13 LEU A 56 6.953 -35.522 15.759 1.00 0.00 H new ATOM 0 HD21 LEU A 56 5.116 -37.787 16.700 1.00 0.00 H new ATOM 0 HD22 LEU A 56 6.655 -37.324 17.465 1.00 0.00 H new ATOM 0 HD23 LEU A 56 5.165 -37.396 18.436 1.00 0.00 H new ATOM 925 N TYR A 57 6.242 -33.003 20.761 1.00 0.00 N ATOM 926 CA TYR A 57 7.027 -32.551 21.906 1.00 0.00 C ATOM 927 C TYR A 57 6.118 -32.290 23.103 1.00 0.00 C ATOM 928 O TYR A 57 6.270 -32.913 24.154 1.00 0.00 O ATOM 929 CB TYR A 57 7.798 -31.274 21.535 1.00 0.00 C ATOM 930 CG TYR A 57 9.047 -31.641 20.758 1.00 0.00 C ATOM 931 CD1 TYR A 57 8.939 -32.149 19.457 1.00 0.00 C ATOM 932 CD2 TYR A 57 10.309 -31.485 21.346 1.00 0.00 C ATOM 933 CE1 TYR A 57 10.094 -32.499 18.745 1.00 0.00 C ATOM 934 CE2 TYR A 57 11.463 -31.833 20.632 1.00 0.00 C ATOM 935 CZ TYR A 57 11.354 -32.341 19.333 1.00 0.00 C ATOM 936 OH TYR A 57 12.491 -32.687 18.629 1.00 0.00 O ATOM 0 H TYR A 57 6.035 -32.278 20.074 1.00 0.00 H new ATOM 0 HA TYR A 57 7.739 -33.331 22.177 1.00 0.00 H new ATOM 0 HB2 TYR A 57 7.166 -30.616 20.938 1.00 0.00 H new ATOM 0 HB3 TYR A 57 8.067 -30.725 22.437 1.00 0.00 H new ATOM 0 HD1 TYR A 57 7.967 -32.271 19.003 1.00 0.00 H new ATOM 0 HD2 TYR A 57 10.392 -31.096 22.350 1.00 0.00 H new ATOM 0 HE1 TYR A 57 10.012 -32.891 17.742 1.00 0.00 H new ATOM 0 HE2 TYR A 57 12.436 -31.709 21.084 1.00 0.00 H new ATOM 0 HH TYR A 57 13.282 -32.514 19.181 1.00 0.00 H new ATOM 946 N GLU A 58 5.157 -31.388 22.927 1.00 0.00 N ATOM 947 CA GLU A 58 4.214 -31.059 23.992 1.00 0.00 C ATOM 948 C GLU A 58 3.740 -32.320 24.701 1.00 0.00 C ATOM 949 O GLU A 58 3.214 -32.262 25.807 1.00 0.00 O ATOM 950 CB GLU A 58 3.021 -30.278 23.432 1.00 0.00 C ATOM 951 CG GLU A 58 3.481 -28.883 22.989 1.00 0.00 C ATOM 952 CD GLU A 58 3.928 -28.059 24.193 1.00 0.00 C ATOM 953 OE1 GLU A 58 3.515 -28.383 25.294 1.00 0.00 O ATOM 954 OE2 GLU A 58 4.677 -27.117 23.994 1.00 0.00 O ATOM 0 H GLU A 58 5.010 -30.873 22.059 1.00 0.00 H new ATOM 0 HA GLU A 58 4.728 -30.430 24.719 1.00 0.00 H new ATOM 0 HB2 GLU A 58 2.587 -30.814 22.588 1.00 0.00 H new ATOM 0 HB3 GLU A 58 2.242 -30.192 24.190 1.00 0.00 H new ATOM 0 HG2 GLU A 58 4.302 -28.973 22.278 1.00 0.00 H new ATOM 0 HG3 GLU A 58 2.668 -28.372 22.473 1.00 0.00 H new ATOM 961 N GLU A 59 3.912 -33.459 24.062 1.00 0.00 N ATOM 962 CA GLU A 59 3.497 -34.712 24.677 1.00 0.00 C ATOM 963 C GLU A 59 4.429 -35.067 25.843 1.00 0.00 C ATOM 964 O GLU A 59 3.979 -35.248 26.975 1.00 0.00 O ATOM 965 CB GLU A 59 3.520 -35.829 23.634 1.00 0.00 C ATOM 966 CG GLU A 59 3.036 -37.135 24.260 1.00 0.00 C ATOM 967 CD GLU A 59 2.943 -38.217 23.189 1.00 0.00 C ATOM 968 OE1 GLU A 59 3.465 -37.999 22.108 1.00 0.00 O ATOM 969 OE2 GLU A 59 2.349 -39.248 23.462 1.00 0.00 O ATOM 0 H GLU A 59 4.328 -33.548 23.135 1.00 0.00 H new ATOM 0 HA GLU A 59 2.484 -34.598 25.062 1.00 0.00 H new ATOM 0 HB2 GLU A 59 2.884 -35.563 22.789 1.00 0.00 H new ATOM 0 HB3 GLU A 59 4.531 -35.955 23.245 1.00 0.00 H new ATOM 0 HG2 GLU A 59 3.722 -37.448 25.047 1.00 0.00 H new ATOM 0 HG3 GLU A 59 2.062 -36.987 24.726 1.00 0.00 H new ATOM 976 N SER A 60 5.733 -35.173 25.554 1.00 0.00 N ATOM 977 CA SER A 60 6.737 -35.518 26.575 1.00 0.00 C ATOM 978 C SER A 60 7.366 -34.284 27.241 1.00 0.00 C ATOM 979 O SER A 60 8.038 -34.405 28.264 1.00 0.00 O ATOM 980 CB SER A 60 7.841 -36.357 25.940 1.00 0.00 C ATOM 981 OG SER A 60 8.542 -35.568 24.988 1.00 0.00 O ATOM 0 H SER A 60 6.120 -35.025 24.622 1.00 0.00 H new ATOM 0 HA SER A 60 6.218 -36.078 27.353 1.00 0.00 H new ATOM 0 HB2 SER A 60 8.527 -36.717 26.707 1.00 0.00 H new ATOM 0 HB3 SER A 60 7.414 -37.236 25.457 1.00 0.00 H new ATOM 0 HG SER A 60 9.253 -36.104 24.579 1.00 0.00 H new ATOM 987 N GLN A 61 7.171 -33.111 26.646 1.00 0.00 N ATOM 988 CA GLN A 61 7.756 -31.872 27.181 1.00 0.00 C ATOM 989 C GLN A 61 7.178 -31.511 28.561 1.00 0.00 C ATOM 990 O GLN A 61 7.912 -31.062 29.444 1.00 0.00 O ATOM 991 CB GLN A 61 7.511 -30.717 26.180 1.00 0.00 C ATOM 992 CG GLN A 61 8.810 -29.963 25.873 1.00 0.00 C ATOM 993 CD GLN A 61 8.497 -28.727 25.037 1.00 0.00 C ATOM 994 OE1 GLN A 61 7.475 -28.077 25.251 1.00 0.00 O ATOM 995 NE2 GLN A 61 9.320 -28.357 24.092 1.00 0.00 N ATOM 0 H GLN A 61 6.617 -32.986 25.799 1.00 0.00 H new ATOM 0 HA GLN A 61 8.826 -32.031 27.312 1.00 0.00 H new ATOM 0 HB2 GLN A 61 7.092 -31.116 25.256 1.00 0.00 H new ATOM 0 HB3 GLN A 61 6.775 -30.026 26.591 1.00 0.00 H new ATOM 0 HG2 GLN A 61 9.302 -29.672 26.801 1.00 0.00 H new ATOM 0 HG3 GLN A 61 9.501 -30.612 25.336 1.00 0.00 H new ATOM 0 HE21 GLN A 61 10.168 -28.896 23.914 1.00 0.00 H new ATOM 0 HE22 GLN A 61 9.115 -27.529 23.532 1.00 0.00 H new ATOM 1004 N PRO A 62 5.901 -31.701 28.762 1.00 0.00 N ATOM 1005 CA PRO A 62 5.226 -31.402 30.041 1.00 0.00 C ATOM 1006 C PRO A 62 4.950 -32.661 30.856 1.00 0.00 C ATOM 1007 O PRO A 62 3.930 -33.325 30.697 1.00 0.00 O ATOM 1008 CB PRO A 62 3.910 -30.787 29.553 1.00 0.00 C ATOM 1009 CG PRO A 62 3.647 -31.416 28.201 1.00 0.00 C ATOM 1010 CD PRO A 62 4.930 -32.157 27.779 1.00 0.00 C ATOM 0 HA PRO A 62 5.817 -30.766 30.700 1.00 0.00 H new ATOM 0 HB2 PRO A 62 3.097 -30.997 30.248 1.00 0.00 H new ATOM 0 HB3 PRO A 62 3.989 -29.703 29.473 1.00 0.00 H new ATOM 0 HG2 PRO A 62 2.806 -32.107 28.256 1.00 0.00 H new ATOM 0 HG3 PRO A 62 3.386 -30.653 27.467 1.00 0.00 H new ATOM 0 HD2 PRO A 62 4.801 -33.239 27.809 1.00 0.00 H new ATOM 0 HD3 PRO A 62 5.231 -31.900 26.763 1.00 0.00 H new ATOM 1018 N SER A 63 5.897 -32.958 31.738 1.00 0.00 N ATOM 1019 CA SER A 63 5.818 -34.112 32.616 1.00 0.00 C ATOM 1020 C SER A 63 4.868 -33.827 33.775 1.00 0.00 C ATOM 1021 O SER A 63 4.609 -34.696 34.609 1.00 0.00 O ATOM 1022 CB SER A 63 7.214 -34.429 33.160 1.00 0.00 C ATOM 1023 OG SER A 63 7.617 -33.385 34.039 1.00 0.00 O ATOM 0 H SER A 63 6.743 -32.401 31.862 1.00 0.00 H new ATOM 0 HA SER A 63 5.440 -34.966 32.053 1.00 0.00 H new ATOM 0 HB2 SER A 63 7.205 -35.383 33.688 1.00 0.00 H new ATOM 0 HB3 SER A 63 7.925 -34.526 32.339 1.00 0.00 H new ATOM 0 HG SER A 63 8.509 -33.582 34.393 1.00 0.00 H new ATOM 1029 N SER A 64 4.357 -32.593 33.823 1.00 0.00 N ATOM 1030 CA SER A 64 3.433 -32.176 34.884 1.00 0.00 C ATOM 1031 C SER A 64 2.053 -31.869 34.308 1.00 0.00 C ATOM 1032 O SER A 64 1.275 -31.126 34.906 1.00 0.00 O ATOM 1033 CB SER A 64 3.974 -30.932 35.589 1.00 0.00 C ATOM 1034 OG SER A 64 3.931 -29.827 34.695 1.00 0.00 O ATOM 0 H SER A 64 4.567 -31.865 33.140 1.00 0.00 H new ATOM 0 HA SER A 64 3.344 -32.994 35.599 1.00 0.00 H new ATOM 0 HB2 SER A 64 3.381 -30.718 36.478 1.00 0.00 H new ATOM 0 HB3 SER A 64 4.997 -31.105 35.922 1.00 0.00 H new ATOM 0 HG SER A 64 4.276 -29.028 35.146 1.00 0.00 H new ATOM 1040 N GLU A 65 1.760 -32.441 33.144 1.00 0.00 N ATOM 1041 CA GLU A 65 0.473 -32.227 32.492 1.00 0.00 C ATOM 1042 C GLU A 65 0.220 -30.738 32.264 1.00 0.00 C ATOM 1043 O GLU A 65 -0.905 -30.261 32.409 1.00 0.00 O ATOM 1044 CB GLU A 65 -0.653 -32.817 33.345 1.00 0.00 C ATOM 1045 CG GLU A 65 -0.522 -34.341 33.369 1.00 0.00 C ATOM 1046 CD GLU A 65 -1.592 -34.947 34.271 1.00 0.00 C ATOM 1047 OE1 GLU A 65 -1.834 -34.388 35.328 1.00 0.00 O ATOM 1048 OE2 GLU A 65 -2.154 -35.962 33.891 1.00 0.00 O ATOM 0 H GLU A 65 2.395 -33.055 32.634 1.00 0.00 H new ATOM 0 HA GLU A 65 0.494 -32.728 31.524 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -0.603 -32.420 34.359 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -1.622 -32.530 32.938 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -0.620 -34.738 32.359 1.00 0.00 H new ATOM 0 HG3 GLU A 65 0.468 -34.623 33.727 1.00 0.00 H new ATOM 1055 N ARG A 66 1.278 -30.008 31.919 1.00 0.00 N ATOM 1056 CA ARG A 66 1.166 -28.568 31.685 1.00 0.00 C ATOM 1057 C ARG A 66 0.686 -28.267 30.264 1.00 0.00 C ATOM 1058 O ARG A 66 0.253 -27.152 29.973 1.00 0.00 O ATOM 1059 CB ARG A 66 2.521 -27.900 31.919 1.00 0.00 C ATOM 1060 CG ARG A 66 2.336 -26.385 32.025 1.00 0.00 C ATOM 1061 CD ARG A 66 3.678 -25.729 32.343 1.00 0.00 C ATOM 1062 NE ARG A 66 4.602 -25.909 31.231 1.00 0.00 N ATOM 1063 CZ ARG A 66 5.868 -25.520 31.323 1.00 0.00 C ATOM 1064 NH1 ARG A 66 6.298 -24.960 32.421 1.00 0.00 N ATOM 1065 NH2 ARG A 66 6.679 -25.697 30.317 1.00 0.00 N ATOM 0 H ARG A 66 2.217 -30.386 31.796 1.00 0.00 H new ATOM 0 HA ARG A 66 0.430 -28.171 32.384 1.00 0.00 H new ATOM 0 HB2 ARG A 66 2.975 -28.286 32.832 1.00 0.00 H new ATOM 0 HB3 ARG A 66 3.201 -28.137 31.100 1.00 0.00 H new ATOM 0 HG2 ARG A 66 1.939 -25.990 31.090 1.00 0.00 H new ATOM 0 HG3 ARG A 66 1.611 -26.150 32.804 1.00 0.00 H new ATOM 0 HD2 ARG A 66 3.534 -24.666 32.538 1.00 0.00 H new ATOM 0 HD3 ARG A 66 4.099 -26.165 33.249 1.00 0.00 H new ATOM 0 HE ARG A 66 4.271 -26.341 30.368 1.00 0.00 H new ATOM 0 HH11 ARG A 66 5.662 -24.822 33.206 1.00 0.00 H new ATOM 0 HH12 ARG A 66 7.270 -24.660 32.494 1.00 0.00 H new ATOM 0 HH21 ARG A 66 6.341 -26.134 29.460 1.00 0.00 H new ATOM 0 HH22 ARG A 66 7.652 -25.398 30.387 1.00 0.00 H new ATOM 1079 N LEU A 67 0.770 -29.258 29.377 1.00 0.00 N ATOM 1080 CA LEU A 67 0.347 -29.062 27.990 1.00 0.00 C ATOM 1081 C LEU A 67 -0.961 -28.284 27.931 1.00 0.00 C ATOM 1082 O LEU A 67 -1.266 -27.641 26.933 1.00 0.00 O ATOM 1083 CB LEU A 67 0.147 -30.414 27.294 1.00 0.00 C ATOM 1084 CG LEU A 67 -0.741 -31.344 28.172 1.00 0.00 C ATOM 1085 CD1 LEU A 67 -1.811 -32.029 27.315 1.00 0.00 C ATOM 1086 CD2 LEU A 67 0.127 -32.416 28.835 1.00 0.00 C ATOM 0 H LEU A 67 1.122 -30.192 29.589 1.00 0.00 H new ATOM 0 HA LEU A 67 1.129 -28.498 27.481 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -0.321 -30.265 26.321 1.00 0.00 H new ATOM 0 HB3 LEU A 67 1.113 -30.885 27.114 1.00 0.00 H new ATOM 0 HG LEU A 67 -1.227 -30.736 28.935 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -2.423 -32.675 27.945 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -2.443 -31.273 26.849 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -1.330 -32.627 26.541 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -0.500 -33.064 29.448 1.00 0.00 H new ATOM 0 HD22 LEU A 67 0.621 -33.011 28.067 1.00 0.00 H new ATOM 0 HD23 LEU A 67 0.879 -31.938 29.463 1.00 0.00 H new ATOM 1098 N ASN A 68 -1.729 -28.342 29.011 1.00 0.00 N ATOM 1099 CA ASN A 68 -3.003 -27.632 29.061 1.00 0.00 C ATOM 1100 C ASN A 68 -2.827 -26.199 28.562 1.00 0.00 C ATOM 1101 O ASN A 68 -3.748 -25.611 27.995 1.00 0.00 O ATOM 1102 CB ASN A 68 -3.537 -27.623 30.498 1.00 0.00 C ATOM 1103 CG ASN A 68 -4.115 -28.990 30.850 1.00 0.00 C ATOM 1104 OD1 ASN A 68 -4.414 -29.786 29.960 1.00 0.00 O ATOM 1105 ND2 ASN A 68 -4.289 -29.312 32.103 1.00 0.00 N ATOM 0 H ASN A 68 -1.498 -28.866 29.855 1.00 0.00 H new ATOM 0 HA ASN A 68 -3.718 -28.143 28.417 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -2.735 -27.369 31.191 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -4.305 -26.856 30.604 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -4.673 -30.225 32.346 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -4.040 -28.651 32.839 1.00 0.00 H new ATOM 1112 N ALA A 69 -1.633 -25.646 28.769 1.00 0.00 N ATOM 1113 CA ALA A 69 -1.337 -24.283 28.328 1.00 0.00 C ATOM 1114 C ALA A 69 -0.905 -24.267 26.860 1.00 0.00 C ATOM 1115 O ALA A 69 -1.387 -23.455 26.070 1.00 0.00 O ATOM 1116 CB ALA A 69 -0.223 -23.693 29.193 1.00 0.00 C ATOM 0 H ALA A 69 -0.859 -26.117 29.237 1.00 0.00 H new ATOM 0 HA ALA A 69 -2.242 -23.684 28.431 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -0.005 -22.678 28.862 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -0.543 -23.674 30.235 1.00 0.00 H new ATOM 0 HB3 ALA A 69 0.674 -24.306 29.099 1.00 0.00 H new ATOM 1122 N PHE A 70 0.005 -25.172 26.504 1.00 0.00 N ATOM 1123 CA PHE A 70 0.499 -25.260 25.130 1.00 0.00 C ATOM 1124 C PHE A 70 -0.617 -25.664 24.176 1.00 0.00 C ATOM 1125 O PHE A 70 -0.668 -25.205 23.034 1.00 0.00 O ATOM 1126 CB PHE A 70 1.645 -26.271 25.041 1.00 0.00 C ATOM 1127 CG PHE A 70 2.880 -25.698 25.696 1.00 0.00 C ATOM 1128 CD1 PHE A 70 3.736 -24.869 24.960 1.00 0.00 C ATOM 1129 CD2 PHE A 70 3.173 -25.996 27.032 1.00 0.00 C ATOM 1130 CE1 PHE A 70 4.883 -24.338 25.559 1.00 0.00 C ATOM 1131 CE2 PHE A 70 4.321 -25.465 27.632 1.00 0.00 C ATOM 1132 CZ PHE A 70 5.177 -24.635 26.895 1.00 0.00 C ATOM 0 H PHE A 70 0.414 -25.852 27.144 1.00 0.00 H new ATOM 0 HA PHE A 70 0.865 -24.275 24.840 1.00 0.00 H new ATOM 0 HB2 PHE A 70 1.360 -27.202 25.531 1.00 0.00 H new ATOM 0 HB3 PHE A 70 1.852 -26.510 23.998 1.00 0.00 H new ATOM 0 HD1 PHE A 70 3.510 -24.640 23.929 1.00 0.00 H new ATOM 0 HD2 PHE A 70 2.513 -26.636 27.600 1.00 0.00 H new ATOM 0 HE1 PHE A 70 5.542 -23.699 24.991 1.00 0.00 H new ATOM 0 HE2 PHE A 70 4.547 -25.695 28.663 1.00 0.00 H new ATOM 0 HZ PHE A 70 6.063 -24.225 27.358 1.00 0.00 H new ATOM 1142 N ARG A 71 -1.506 -26.525 24.649 1.00 0.00 N ATOM 1143 CA ARG A 71 -2.618 -26.989 23.831 1.00 0.00 C ATOM 1144 C ARG A 71 -3.307 -25.805 23.172 1.00 0.00 C ATOM 1145 O ARG A 71 -3.944 -25.948 22.129 1.00 0.00 O ATOM 1146 CB ARG A 71 -3.621 -27.753 24.701 1.00 0.00 C ATOM 1147 CG ARG A 71 -2.971 -29.050 25.260 1.00 0.00 C ATOM 1148 CD ARG A 71 -3.486 -30.275 24.503 1.00 0.00 C ATOM 1149 NE ARG A 71 -4.877 -30.532 24.859 1.00 0.00 N ATOM 1150 CZ ARG A 71 -5.499 -31.633 24.452 1.00 0.00 C ATOM 1151 NH1 ARG A 71 -4.862 -32.509 23.725 1.00 0.00 N ATOM 1152 NH2 ARG A 71 -6.744 -31.839 24.782 1.00 0.00 N ATOM 0 H ARG A 71 -1.480 -26.915 25.591 1.00 0.00 H new ATOM 0 HA ARG A 71 -2.235 -27.654 23.057 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -3.954 -27.121 25.524 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -4.504 -28.004 24.114 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -1.886 -28.989 25.170 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -3.197 -29.149 26.322 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -3.401 -30.111 23.429 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -2.874 -31.145 24.742 1.00 0.00 H new ATOM 0 HE ARG A 71 -5.381 -29.854 25.431 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -3.888 -32.348 23.470 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -5.338 -33.355 23.412 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -7.240 -31.155 25.353 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -7.221 -32.684 24.469 1.00 0.00 H new ATOM 1166 N GLU A 72 -3.157 -24.632 23.778 1.00 0.00 N ATOM 1167 CA GLU A 72 -3.756 -23.426 23.225 1.00 0.00 C ATOM 1168 C GLU A 72 -3.144 -23.135 21.861 1.00 0.00 C ATOM 1169 O GLU A 72 -3.850 -22.823 20.902 1.00 0.00 O ATOM 1170 CB GLU A 72 -3.514 -22.240 24.163 1.00 0.00 C ATOM 1171 CG GLU A 72 -4.312 -22.439 25.453 1.00 0.00 C ATOM 1172 CD GLU A 72 -4.005 -21.311 26.432 1.00 0.00 C ATOM 1173 OE1 GLU A 72 -3.192 -20.466 26.096 1.00 0.00 O ATOM 1174 OE2 GLU A 72 -4.586 -21.309 27.505 1.00 0.00 O ATOM 0 H GLU A 72 -2.632 -24.492 24.641 1.00 0.00 H new ATOM 0 HA GLU A 72 -4.830 -23.578 23.118 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -2.451 -22.153 24.390 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -3.813 -21.311 23.677 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -5.379 -22.460 25.231 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -4.061 -23.400 25.902 1.00 0.00 H new ATOM 1181 N LEU A 73 -1.822 -23.262 21.780 1.00 0.00 N ATOM 1182 CA LEU A 73 -1.115 -23.035 20.528 1.00 0.00 C ATOM 1183 C LEU A 73 -1.491 -24.113 19.518 1.00 0.00 C ATOM 1184 O LEU A 73 -1.570 -23.853 18.321 1.00 0.00 O ATOM 1185 CB LEU A 73 0.404 -23.049 20.756 1.00 0.00 C ATOM 1186 CG LEU A 73 1.134 -22.653 19.456 1.00 0.00 C ATOM 1187 CD1 LEU A 73 0.783 -21.201 19.065 1.00 0.00 C ATOM 1188 CD2 LEU A 73 2.648 -22.774 19.671 1.00 0.00 C ATOM 0 H LEU A 73 -1.223 -23.520 22.564 1.00 0.00 H new ATOM 0 HA LEU A 73 -1.402 -22.058 20.140 1.00 0.00 H new ATOM 0 HB2 LEU A 73 0.667 -22.357 21.556 1.00 0.00 H new ATOM 0 HB3 LEU A 73 0.723 -24.041 21.075 1.00 0.00 H new ATOM 0 HG LEU A 73 0.819 -23.319 18.653 1.00 0.00 H new ATOM 0 HD11 LEU A 73 1.305 -20.935 18.146 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -0.292 -21.116 18.909 1.00 0.00 H new ATOM 0 HD13 LEU A 73 1.088 -20.525 19.864 1.00 0.00 H new ATOM 0 HD21 LEU A 73 3.169 -22.495 18.755 1.00 0.00 H new ATOM 0 HD22 LEU A 73 2.955 -22.110 20.479 1.00 0.00 H new ATOM 0 HD23 LEU A 73 2.897 -23.803 19.932 1.00 0.00 H new ATOM 1200 N ARG A 74 -1.715 -25.327 20.014 1.00 0.00 N ATOM 1201 CA ARG A 74 -2.070 -26.442 19.147 1.00 0.00 C ATOM 1202 C ARG A 74 -3.353 -26.116 18.403 1.00 0.00 C ATOM 1203 O ARG A 74 -3.467 -26.345 17.199 1.00 0.00 O ATOM 1204 CB ARG A 74 -2.265 -27.714 19.981 1.00 0.00 C ATOM 1205 CG ARG A 74 -2.515 -28.902 19.050 1.00 0.00 C ATOM 1206 CD ARG A 74 -2.764 -30.166 19.871 1.00 0.00 C ATOM 1207 NE ARG A 74 -4.058 -30.086 20.534 1.00 0.00 N ATOM 1208 CZ ARG A 74 -4.501 -31.075 21.300 1.00 0.00 C ATOM 1209 NH1 ARG A 74 -3.761 -32.135 21.487 1.00 0.00 N ATOM 1210 NH2 ARG A 74 -5.673 -30.985 21.866 1.00 0.00 N ATOM 0 H ARG A 74 -1.657 -25.561 21.005 1.00 0.00 H new ATOM 0 HA ARG A 74 -1.266 -26.609 18.430 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -1.383 -27.898 20.594 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -3.106 -27.589 20.663 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -3.374 -28.699 18.410 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -1.657 -29.048 18.394 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -2.732 -31.042 19.223 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -1.974 -30.289 20.612 1.00 0.00 H new ATOM 0 HE ARG A 74 -4.635 -29.254 20.407 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -2.844 -32.202 21.045 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -4.100 -32.896 22.075 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -6.248 -30.155 21.720 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -6.015 -31.745 22.455 1.00 0.00 H new ATOM 1224 N THR A 75 -4.310 -25.564 19.131 1.00 0.00 N ATOM 1225 CA THR A 75 -5.579 -25.185 18.541 1.00 0.00 C ATOM 1226 C THR A 75 -5.364 -24.105 17.489 1.00 0.00 C ATOM 1227 O THR A 75 -5.996 -24.113 16.434 1.00 0.00 O ATOM 1228 CB THR A 75 -6.526 -24.689 19.617 1.00 0.00 C ATOM 1229 OG1 THR A 75 -6.801 -25.742 20.532 1.00 0.00 O ATOM 1230 CG2 THR A 75 -7.822 -24.215 18.972 1.00 0.00 C ATOM 0 H THR A 75 -4.231 -25.370 20.129 1.00 0.00 H new ATOM 0 HA THR A 75 -6.021 -26.058 18.061 1.00 0.00 H new ATOM 0 HB THR A 75 -6.066 -23.859 20.154 1.00 0.00 H new ATOM 0 HG1 THR A 75 -6.004 -25.922 21.073 1.00 0.00 H new ATOM 0 HG21 THR A 75 -8.504 -23.858 19.744 1.00 0.00 H new ATOM 0 HG22 THR A 75 -7.607 -23.405 18.276 1.00 0.00 H new ATOM 0 HG23 THR A 75 -8.285 -25.042 18.434 1.00 0.00 H new ATOM 1238 N GLN A 76 -4.469 -23.168 17.792 1.00 0.00 N ATOM 1239 CA GLN A 76 -4.179 -22.078 16.868 1.00 0.00 C ATOM 1240 C GLN A 76 -3.797 -22.630 15.499 1.00 0.00 C ATOM 1241 O GLN A 76 -4.309 -22.184 14.474 1.00 0.00 O ATOM 1242 CB GLN A 76 -3.022 -21.239 17.409 1.00 0.00 C ATOM 1243 CG GLN A 76 -2.899 -19.954 16.594 1.00 0.00 C ATOM 1244 CD GLN A 76 -1.666 -19.175 17.037 1.00 0.00 C ATOM 1245 OE1 GLN A 76 -0.638 -19.200 16.358 1.00 0.00 O ATOM 1246 NE2 GLN A 76 -1.702 -18.492 18.146 1.00 0.00 N ATOM 0 H GLN A 76 -3.937 -23.142 18.662 1.00 0.00 H new ATOM 0 HA GLN A 76 -5.071 -21.460 16.769 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -3.191 -21.001 18.459 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -2.092 -21.806 17.357 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -2.828 -20.192 15.533 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -3.792 -19.343 16.725 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -2.554 -18.473 18.706 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -0.878 -17.976 18.454 1.00 0.00 H new ATOM 1255 N LEU A 77 -2.904 -23.616 15.493 1.00 0.00 N ATOM 1256 CA LEU A 77 -2.472 -24.233 14.245 1.00 0.00 C ATOM 1257 C LEU A 77 -3.646 -24.943 13.582 1.00 0.00 C ATOM 1258 O LEU A 77 -3.810 -24.890 12.364 1.00 0.00 O ATOM 1259 CB LEU A 77 -1.340 -25.232 14.509 1.00 0.00 C ATOM 1260 CG LEU A 77 -0.217 -24.556 15.309 1.00 0.00 C ATOM 1261 CD1 LEU A 77 0.897 -25.571 15.581 1.00 0.00 C ATOM 1262 CD2 LEU A 77 0.348 -23.370 14.518 1.00 0.00 C ATOM 0 H LEU A 77 -2.469 -24.001 16.331 1.00 0.00 H new ATOM 0 HA LEU A 77 -2.103 -23.453 13.579 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -1.723 -26.091 15.060 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.948 -25.608 13.564 1.00 0.00 H new ATOM 0 HG LEU A 77 -0.618 -24.193 16.255 1.00 0.00 H new ATOM 0 HD11 LEU A 77 1.695 -25.092 16.149 1.00 0.00 H new ATOM 0 HD12 LEU A 77 0.496 -26.407 16.153 1.00 0.00 H new ATOM 0 HD13 LEU A 77 1.295 -25.937 14.634 1.00 0.00 H new ATOM 0 HD21 LEU A 77 1.144 -22.896 15.092 1.00 0.00 H new ATOM 0 HD22 LEU A 77 0.747 -23.724 13.568 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -0.445 -22.646 14.331 1.00 0.00 H new ATOM 1274 N GLU A 78 -4.464 -25.600 14.399 1.00 0.00 N ATOM 1275 CA GLU A 78 -5.628 -26.312 13.888 1.00 0.00 C ATOM 1276 C GLU A 78 -6.633 -25.326 13.302 1.00 0.00 C ATOM 1277 O GLU A 78 -7.253 -25.593 12.272 1.00 0.00 O ATOM 1278 CB GLU A 78 -6.286 -27.109 15.021 1.00 0.00 C ATOM 1279 CG GLU A 78 -7.311 -28.095 14.446 1.00 0.00 C ATOM 1280 CD GLU A 78 -8.552 -27.346 13.973 1.00 0.00 C ATOM 1281 OE1 GLU A 78 -8.905 -26.364 14.607 1.00 0.00 O ATOM 1282 OE2 GLU A 78 -9.129 -27.762 12.982 1.00 0.00 O ATOM 0 H GLU A 78 -4.343 -25.654 15.410 1.00 0.00 H new ATOM 0 HA GLU A 78 -5.306 -26.997 13.103 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -5.526 -27.650 15.585 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -6.776 -26.429 15.718 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -6.871 -28.646 13.615 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -7.586 -28.828 15.204 1.00 0.00 H new ATOM 1289 N LYS A 79 -6.781 -24.182 13.963 1.00 0.00 N ATOM 1290 CA LYS A 79 -7.703 -23.154 13.503 1.00 0.00 C ATOM 1291 C LYS A 79 -7.226 -22.590 12.174 1.00 0.00 C ATOM 1292 O LYS A 79 -8.020 -22.343 11.268 1.00 0.00 O ATOM 1293 CB LYS A 79 -7.795 -22.030 14.536 1.00 0.00 C ATOM 1294 CG LYS A 79 -8.875 -21.028 14.109 1.00 0.00 C ATOM 1295 CD LYS A 79 -8.967 -19.879 15.123 1.00 0.00 C ATOM 1296 CE LYS A 79 -9.653 -20.351 16.412 1.00 0.00 C ATOM 1297 NZ LYS A 79 -10.019 -19.164 17.231 1.00 0.00 N ATOM 0 H LYS A 79 -6.275 -23.946 14.816 1.00 0.00 H new ATOM 0 HA LYS A 79 -8.690 -23.598 13.372 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -8.034 -22.442 15.517 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -6.833 -21.526 14.627 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -8.643 -20.632 13.120 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -9.838 -21.532 14.032 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -7.968 -19.507 15.351 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -9.525 -19.049 14.690 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -10.544 -20.932 16.173 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -8.987 -21.005 16.975 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -10.485 -19.477 18.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -9.160 -18.628 17.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -10.668 -18.557 16.691 1.00 0.00 H new ATOM 1311 N ALA A 80 -5.917 -22.387 12.069 1.00 0.00 N ATOM 1312 CA ALA A 80 -5.341 -21.847 10.849 1.00 0.00 C ATOM 1313 C ALA A 80 -5.615 -22.781 9.676 1.00 0.00 C ATOM 1314 O ALA A 80 -5.815 -22.335 8.547 1.00 0.00 O ATOM 1315 CB ALA A 80 -3.832 -21.654 11.014 1.00 0.00 C ATOM 0 H ALA A 80 -5.243 -22.587 12.808 1.00 0.00 H new ATOM 0 HA ALA A 80 -5.803 -20.880 10.649 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -3.414 -21.249 10.092 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -3.641 -20.962 11.834 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -3.364 -22.614 11.233 1.00 0.00 H new ATOM 1321 N LEU A 81 -5.620 -24.081 9.952 1.00 0.00 N ATOM 1322 CA LEU A 81 -5.867 -25.072 8.912 1.00 0.00 C ATOM 1323 C LEU A 81 -7.273 -24.873 8.331 1.00 0.00 C ATOM 1324 O LEU A 81 -7.475 -24.938 7.119 1.00 0.00 O ATOM 1325 CB LEU A 81 -5.727 -26.487 9.504 1.00 0.00 C ATOM 1326 CG LEU A 81 -5.316 -27.492 8.414 1.00 0.00 C ATOM 1327 CD1 LEU A 81 -5.159 -28.877 9.044 1.00 0.00 C ATOM 1328 CD2 LEU A 81 -6.379 -27.545 7.303 1.00 0.00 C ATOM 0 H LEU A 81 -5.457 -24.471 10.880 1.00 0.00 H new ATOM 0 HA LEU A 81 -5.137 -24.951 8.112 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -4.983 -26.482 10.301 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -6.672 -26.795 9.952 1.00 0.00 H new ATOM 0 HG LEU A 81 -4.371 -27.175 7.974 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -4.868 -29.595 8.277 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -4.391 -28.840 9.817 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -6.106 -29.184 9.488 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -6.073 -28.261 6.540 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -7.334 -27.854 7.728 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -6.484 -26.558 6.853 1.00 0.00 H new ATOM 1340 N GLY A 82 -8.240 -24.616 9.206 1.00 0.00 N ATOM 1341 CA GLY A 82 -9.614 -24.402 8.766 1.00 0.00 C ATOM 1342 C GLY A 82 -9.706 -23.149 7.905 1.00 0.00 C ATOM 1343 O GLY A 82 -10.609 -23.015 7.079 1.00 0.00 O ATOM 0 H GLY A 82 -8.100 -24.551 10.214 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -9.960 -25.267 8.200 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -10.269 -24.305 9.632 1.00 0.00 H new ATOM 1347 N LEU A 83 -8.761 -22.236 8.099 1.00 0.00 N ATOM 1348 CA LEU A 83 -8.735 -20.999 7.329 1.00 0.00 C ATOM 1349 C LEU A 83 -10.067 -20.263 7.445 1.00 0.00 C ATOM 1350 O LEU A 83 -10.284 -19.245 6.787 1.00 0.00 O ATOM 1351 CB LEU A 83 -8.445 -21.317 5.858 1.00 0.00 C ATOM 1352 CG LEU A 83 -7.020 -21.878 5.714 1.00 0.00 C ATOM 1353 CD1 LEU A 83 -6.861 -22.486 4.316 1.00 0.00 C ATOM 1354 CD2 LEU A 83 -5.976 -20.759 5.904 1.00 0.00 C ATOM 0 H LEU A 83 -8.007 -22.328 8.779 1.00 0.00 H new ATOM 0 HA LEU A 83 -7.950 -20.356 7.727 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -9.169 -22.040 5.484 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -8.553 -20.416 5.254 1.00 0.00 H new ATOM 0 HG LEU A 83 -6.860 -22.640 6.477 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -5.853 -22.886 4.206 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -7.587 -23.289 4.184 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -7.030 -21.716 3.563 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -4.974 -21.175 5.799 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -6.129 -19.986 5.151 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -6.086 -20.324 6.897 1.00 0.00 H new