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 Single : A 5 THR OG1 : rot -80:sc= -0.367! USER MOD Single : A 10 LYS NZ :NH3+ 148:sc= -0.251 (180deg=-1.3!) USER MOD Single : A 14 SER OG : rot -45:sc= 0.506 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 24 TYR OH : rot 180:sc= -1.22 USER MOD Single : A 25 LYS NZ :NH3+ -159:sc= -0.0969 (180deg=-0.606) USER MOD Single : A 30 LYS NZ :NH3+ -158:sc= -1.17 (180deg=-1.23) USER MOD Single : A 32 GLN : amide:sc=-0.00441 K(o=-0.0044,f=-1.5!) USER MOD Single : A 35 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 36 ASN : amide:sc= -0.0668 K(o=-0.067,f=-2!) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 ASN : amide:sc= -0.727 K(o=-0.73,f=-1.9!) USER MOD Single : A 44 GLN : amide:sc= -0.429 X(o=-0.43,f=-0.33) USER MOD Single : A 47 MET CE :methyl -173:sc=-0.00581 (180deg=-0.101) USER MOD Single : A 48 HIS : no HD1:sc= -1.44 K(o=-1.4,f=-4.7!) USER MOD Single : A 51 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 180:sc= -0.0261 USER MOD Single : A 61 GLN : amide:sc= -0.103 X(o=-0.1,f=-0.42) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot -51:sc= 0.995 USER MOD Single : A 68 ASN : amide:sc= -0.0622 X(o=-0.062,f=-0.45) USER MOD Single : A 75 THR OG1 : rot 72:sc= 0.127 USER MOD Single : A 76 GLN : amide:sc= -0.421 K(o=-0.42,f=-2.4!) USER MOD Single : A 79 LYS NZ :NH3+ -160:sc= -0.0148 (180deg=-0.373) USER MOD ----------------------------------------------------------------- ATOM 27 N VAL A 3 -3.097 -15.541 15.943 1.00 0.00 N ATOM 28 CA VAL A 3 -2.802 -16.748 16.724 1.00 0.00 C ATOM 29 C VAL A 3 -1.643 -16.496 17.682 1.00 0.00 C ATOM 30 O VAL A 3 -0.608 -15.954 17.294 1.00 0.00 O ATOM 31 CB VAL A 3 -2.453 -17.908 15.786 1.00 0.00 C ATOM 32 CG1 VAL A 3 -3.705 -18.328 15.016 1.00 0.00 C ATOM 33 CG2 VAL A 3 -1.373 -17.466 14.794 1.00 0.00 C ATOM 0 HA VAL A 3 -3.687 -17.007 17.305 1.00 0.00 H new ATOM 0 HB VAL A 3 -2.081 -18.748 16.373 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -3.461 -19.153 14.347 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -4.475 -18.646 15.719 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -4.073 -17.484 14.432 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -1.128 -18.295 14.129 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -1.741 -16.625 14.206 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -0.480 -17.163 15.340 1.00 0.00 H new ATOM 43 N TRP A 4 -1.827 -16.892 18.939 1.00 0.00 N ATOM 44 CA TRP A 4 -0.794 -16.709 19.955 1.00 0.00 C ATOM 45 C TRP A 4 0.132 -17.919 19.987 1.00 0.00 C ATOM 46 O TRP A 4 -0.310 -19.061 19.864 1.00 0.00 O ATOM 47 CB TRP A 4 -1.445 -16.510 21.324 1.00 0.00 C ATOM 48 CG TRP A 4 -2.546 -15.508 21.201 1.00 0.00 C ATOM 49 CD1 TRP A 4 -2.457 -14.328 20.542 1.00 0.00 C ATOM 50 CD2 TRP A 4 -3.897 -15.577 21.735 1.00 0.00 C ATOM 51 NE1 TRP A 4 -3.669 -13.670 20.641 1.00 0.00 N ATOM 52 CE2 TRP A 4 -4.589 -14.399 21.366 1.00 0.00 C ATOM 53 CE3 TRP A 4 -4.583 -16.539 22.496 1.00 0.00 C ATOM 54 CZ2 TRP A 4 -5.916 -14.183 21.742 1.00 0.00 C ATOM 55 CZ3 TRP A 4 -5.918 -16.326 22.875 1.00 0.00 C ATOM 56 CH2 TRP A 4 -6.583 -15.151 22.499 1.00 0.00 C ATOM 0 H TRP A 4 -2.678 -17.340 19.278 1.00 0.00 H new ATOM 0 HA TRP A 4 -0.206 -15.825 19.708 1.00 0.00 H new ATOM 0 HB2 TRP A 4 -1.838 -17.457 21.695 1.00 0.00 H new ATOM 0 HB3 TRP A 4 -0.704 -16.168 22.046 1.00 0.00 H new ATOM 0 HD1 TRP A 4 -1.583 -13.961 20.024 1.00 0.00 H new ATOM 0 HE1 TRP A 4 -3.860 -12.757 20.228 1.00 0.00 H new ATOM 0 HE3 TRP A 4 -4.080 -17.448 22.791 1.00 0.00 H new ATOM 0 HZ2 TRP A 4 -6.423 -13.275 21.450 1.00 0.00 H new ATOM 0 HZ3 TRP A 4 -6.436 -17.072 23.460 1.00 0.00 H new ATOM 0 HH2 TRP A 4 -7.610 -14.993 22.794 1.00 0.00 H new ATOM 67 N THR A 5 1.423 -17.649 20.139 1.00 0.00 N ATOM 68 CA THR A 5 2.436 -18.700 20.175 1.00 0.00 C ATOM 69 C THR A 5 3.826 -18.089 20.373 1.00 0.00 C ATOM 70 O THR A 5 4.632 -18.606 21.148 1.00 0.00 O ATOM 71 CB THR A 5 2.412 -19.523 18.856 1.00 0.00 C ATOM 72 OG1 THR A 5 1.295 -19.141 18.070 1.00 0.00 O ATOM 73 CG2 THR A 5 2.321 -21.021 19.160 1.00 0.00 C ATOM 0 H THR A 5 1.796 -16.705 20.240 1.00 0.00 H new ATOM 0 HA THR A 5 2.213 -19.363 21.011 1.00 0.00 H new ATOM 0 HB THR A 5 3.334 -19.324 18.310 1.00 0.00 H new ATOM 0 HG1 THR A 5 0.490 -19.589 18.406 1.00 0.00 H new ATOM 0 HG21 THR A 5 2.305 -21.582 18.225 1.00 0.00 H new ATOM 0 HG22 THR A 5 3.185 -21.325 19.751 1.00 0.00 H new ATOM 0 HG23 THR A 5 1.408 -21.224 19.720 1.00 0.00 H new ATOM 81 N PRO A 6 4.120 -17.014 19.684 1.00 0.00 N ATOM 82 CA PRO A 6 5.445 -16.339 19.781 1.00 0.00 C ATOM 83 C PRO A 6 5.786 -15.950 21.215 1.00 0.00 C ATOM 84 O PRO A 6 4.905 -15.885 22.074 1.00 0.00 O ATOM 85 CB PRO A 6 5.295 -15.104 18.875 1.00 0.00 C ATOM 86 CG PRO A 6 4.201 -15.464 17.925 1.00 0.00 C ATOM 87 CD PRO A 6 3.233 -16.318 18.733 1.00 0.00 C ATOM 0 HA PRO A 6 6.264 -16.988 19.473 1.00 0.00 H new ATOM 0 HB2 PRO A 6 5.041 -14.216 19.454 1.00 0.00 H new ATOM 0 HB3 PRO A 6 6.223 -14.885 18.346 1.00 0.00 H new ATOM 0 HG2 PRO A 6 3.709 -14.573 17.536 1.00 0.00 H new ATOM 0 HG3 PRO A 6 4.589 -16.014 17.068 1.00 0.00 H new ATOM 0 HD2 PRO A 6 2.489 -15.709 19.246 1.00 0.00 H new ATOM 0 HD3 PRO A 6 2.689 -17.020 18.101 1.00 0.00 H new ATOM 95 N GLU A 7 7.070 -15.709 21.466 1.00 0.00 N ATOM 96 CA GLU A 7 7.526 -15.339 22.802 1.00 0.00 C ATOM 97 C GLU A 7 6.556 -14.351 23.442 1.00 0.00 C ATOM 98 O GLU A 7 6.532 -14.186 24.662 1.00 0.00 O ATOM 99 CB GLU A 7 8.918 -14.708 22.724 1.00 0.00 C ATOM 100 CG GLU A 7 9.919 -15.712 22.128 1.00 0.00 C ATOM 101 CD GLU A 7 9.846 -15.697 20.602 1.00 0.00 C ATOM 102 OE1 GLU A 7 8.990 -15.008 20.073 1.00 0.00 O ATOM 103 OE2 GLU A 7 10.659 -16.366 19.985 1.00 0.00 O ATOM 0 H GLU A 7 7.810 -15.763 20.766 1.00 0.00 H new ATOM 0 HA GLU A 7 7.569 -16.240 23.413 1.00 0.00 H new ATOM 0 HB2 GLU A 7 8.884 -13.808 22.110 1.00 0.00 H new ATOM 0 HB3 GLU A 7 9.244 -14.404 23.718 1.00 0.00 H new ATOM 0 HG2 GLU A 7 10.930 -15.463 22.452 1.00 0.00 H new ATOM 0 HG3 GLU A 7 9.703 -16.714 22.499 1.00 0.00 H new ATOM 110 N VAL A 8 5.746 -13.708 22.606 1.00 0.00 N ATOM 111 CA VAL A 8 4.763 -12.754 23.093 1.00 0.00 C ATOM 112 C VAL A 8 3.792 -13.458 24.031 1.00 0.00 C ATOM 113 O VAL A 8 3.470 -12.945 25.099 1.00 0.00 O ATOM 114 CB VAL A 8 3.993 -12.146 21.918 1.00 0.00 C ATOM 115 CG1 VAL A 8 2.870 -11.250 22.448 1.00 0.00 C ATOM 116 CG2 VAL A 8 4.947 -11.313 21.059 1.00 0.00 C ATOM 0 H VAL A 8 5.753 -13.831 21.594 1.00 0.00 H new ATOM 0 HA VAL A 8 5.276 -11.957 23.631 1.00 0.00 H new ATOM 0 HB VAL A 8 3.564 -12.946 21.315 1.00 0.00 H new ATOM 0 HG11 VAL A 8 2.323 -10.818 21.610 1.00 0.00 H new ATOM 0 HG12 VAL A 8 2.189 -11.843 23.059 1.00 0.00 H new ATOM 0 HG13 VAL A 8 3.297 -10.450 23.053 1.00 0.00 H new ATOM 0 HG21 VAL A 8 4.399 -10.880 20.222 1.00 0.00 H new ATOM 0 HG22 VAL A 8 5.377 -10.514 21.663 1.00 0.00 H new ATOM 0 HG23 VAL A 8 5.745 -11.951 20.679 1.00 0.00 H new ATOM 126 N LEU A 9 3.336 -14.642 23.628 1.00 0.00 N ATOM 127 CA LEU A 9 2.408 -15.401 24.457 1.00 0.00 C ATOM 128 C LEU A 9 3.057 -15.745 25.788 1.00 0.00 C ATOM 129 O LEU A 9 2.452 -15.580 26.846 1.00 0.00 O ATOM 130 CB LEU A 9 1.997 -16.696 23.740 1.00 0.00 C ATOM 131 CG LEU A 9 1.108 -17.558 24.654 1.00 0.00 C ATOM 132 CD1 LEU A 9 -0.109 -16.749 25.134 1.00 0.00 C ATOM 133 CD2 LEU A 9 0.635 -18.788 23.873 1.00 0.00 C ATOM 0 H LEU A 9 3.590 -15.089 22.747 1.00 0.00 H new ATOM 0 HA LEU A 9 1.522 -14.791 24.635 1.00 0.00 H new ATOM 0 HB2 LEU A 9 1.461 -16.456 22.822 1.00 0.00 H new ATOM 0 HB3 LEU A 9 2.886 -17.257 23.452 1.00 0.00 H new ATOM 0 HG LEU A 9 1.683 -17.870 25.526 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -0.728 -17.372 25.779 1.00 0.00 H new ATOM 0 HD12 LEU A 9 0.231 -15.876 25.690 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -0.693 -16.425 24.273 1.00 0.00 H new ATOM 0 HD21 LEU A 9 0.004 -19.405 24.513 1.00 0.00 H new ATOM 0 HD22 LEU A 9 0.065 -18.468 23.001 1.00 0.00 H new ATOM 0 HD23 LEU A 9 1.499 -19.367 23.548 1.00 0.00 H new ATOM 145 N LYS A 10 4.297 -16.219 25.730 1.00 0.00 N ATOM 146 CA LYS A 10 5.018 -16.576 26.945 1.00 0.00 C ATOM 147 C LYS A 10 5.237 -15.341 27.798 1.00 0.00 C ATOM 148 O LYS A 10 5.029 -15.363 29.009 1.00 0.00 O ATOM 149 CB LYS A 10 6.367 -17.195 26.590 1.00 0.00 C ATOM 150 CG LYS A 10 6.138 -18.556 25.934 1.00 0.00 C ATOM 151 CD LYS A 10 7.475 -19.156 25.474 1.00 0.00 C ATOM 152 CE LYS A 10 8.169 -19.862 26.642 1.00 0.00 C ATOM 153 NZ LYS A 10 7.290 -20.951 27.154 1.00 0.00 N ATOM 0 H LYS A 10 4.818 -16.363 24.865 1.00 0.00 H new ATOM 0 HA LYS A 10 4.426 -17.301 27.504 1.00 0.00 H new ATOM 0 HB2 LYS A 10 6.915 -16.539 25.913 1.00 0.00 H new ATOM 0 HB3 LYS A 10 6.976 -17.308 27.487 1.00 0.00 H new ATOM 0 HG2 LYS A 10 5.652 -19.230 26.639 1.00 0.00 H new ATOM 0 HG3 LYS A 10 5.467 -18.449 25.082 1.00 0.00 H new ATOM 0 HD2 LYS A 10 7.304 -19.863 24.662 1.00 0.00 H new ATOM 0 HD3 LYS A 10 8.119 -18.369 25.081 1.00 0.00 H new ATOM 0 HE2 LYS A 10 9.125 -20.273 26.317 1.00 0.00 H new ATOM 0 HE3 LYS A 10 8.383 -19.148 27.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 7.877 -21.731 27.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 6.694 -20.584 27.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 6.685 -21.300 26.384 1.00 0.00 H new ATOM 167 N ALA A 11 5.650 -14.262 27.150 1.00 0.00 N ATOM 168 CA ALA A 11 5.885 -13.010 27.855 1.00 0.00 C ATOM 169 C ALA A 11 4.570 -12.456 28.387 1.00 0.00 C ATOM 170 O ALA A 11 4.522 -11.870 29.466 1.00 0.00 O ATOM 171 CB ALA A 11 6.535 -11.988 26.920 1.00 0.00 C ATOM 0 H ALA A 11 5.828 -14.227 26.146 1.00 0.00 H new ATOM 0 HA ALA A 11 6.557 -13.203 28.691 1.00 0.00 H new ATOM 0 HB1 ALA A 11 6.705 -11.057 27.460 1.00 0.00 H new ATOM 0 HB2 ALA A 11 7.487 -12.378 26.561 1.00 0.00 H new ATOM 0 HB3 ALA A 11 5.876 -11.800 26.072 1.00 0.00 H new ATOM 177 N ARG A 12 3.503 -12.640 27.617 1.00 0.00 N ATOM 178 CA ARG A 12 2.191 -12.148 28.018 1.00 0.00 C ATOM 179 C ARG A 12 1.756 -12.800 29.325 1.00 0.00 C ATOM 180 O ARG A 12 1.252 -12.130 30.225 1.00 0.00 O ATOM 181 CB ARG A 12 1.163 -12.456 26.921 1.00 0.00 C ATOM 182 CG ARG A 12 -0.205 -11.859 27.288 1.00 0.00 C ATOM 183 CD ARG A 12 -0.114 -10.328 27.363 1.00 0.00 C ATOM 184 NE ARG A 12 -1.413 -9.735 27.073 1.00 0.00 N ATOM 185 CZ ARG A 12 -1.627 -8.438 27.257 1.00 0.00 C ATOM 186 NH1 ARG A 12 -0.665 -7.681 27.707 1.00 0.00 N ATOM 187 NH2 ARG A 12 -2.795 -7.923 26.988 1.00 0.00 N ATOM 0 H ARG A 12 3.520 -13.122 26.718 1.00 0.00 H new ATOM 0 HA ARG A 12 2.253 -11.070 28.166 1.00 0.00 H new ATOM 0 HB2 ARG A 12 1.503 -12.046 25.970 1.00 0.00 H new ATOM 0 HB3 ARG A 12 1.073 -13.534 26.790 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -0.948 -12.150 26.545 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -0.539 -12.258 28.246 1.00 0.00 H new ATOM 0 HD2 ARG A 12 0.220 -10.024 28.355 1.00 0.00 H new ATOM 0 HD3 ARG A 12 0.627 -9.965 26.652 1.00 0.00 H new ATOM 0 HE ARG A 12 -2.168 -10.325 26.724 1.00 0.00 H new ATOM 0 HH11 ARG A 12 0.247 -8.086 27.916 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -0.825 -6.684 27.850 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -3.545 -8.517 26.636 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -2.958 -6.926 27.130 1.00 0.00 H new ATOM 201 N ALA A 13 1.955 -14.111 29.422 1.00 0.00 N ATOM 202 CA ALA A 13 1.579 -14.847 30.625 1.00 0.00 C ATOM 203 C ALA A 13 2.672 -14.735 31.680 1.00 0.00 C ATOM 204 O ALA A 13 2.393 -14.567 32.867 1.00 0.00 O ATOM 205 CB ALA A 13 1.353 -16.320 30.280 1.00 0.00 C ATOM 0 H ALA A 13 2.372 -14.683 28.687 1.00 0.00 H new ATOM 0 HA ALA A 13 0.659 -14.419 31.022 1.00 0.00 H new ATOM 0 HB1 ALA A 13 1.073 -16.866 31.181 1.00 0.00 H new ATOM 0 HB2 ALA A 13 0.555 -16.403 29.542 1.00 0.00 H new ATOM 0 HB3 ALA A 13 2.270 -16.743 29.871 1.00 0.00 H new ATOM 211 N SER A 14 3.919 -14.830 31.233 1.00 0.00 N ATOM 212 CA SER A 14 5.064 -14.739 32.133 1.00 0.00 C ATOM 213 C SER A 14 5.489 -13.287 32.312 1.00 0.00 C ATOM 214 O SER A 14 6.549 -13.012 32.869 1.00 0.00 O ATOM 215 CB SER A 14 6.235 -15.546 31.573 1.00 0.00 C ATOM 216 OG SER A 14 7.222 -15.698 32.584 1.00 0.00 O ATOM 0 H SER A 14 4.164 -14.970 30.253 1.00 0.00 H new ATOM 0 HA SER A 14 4.773 -15.145 33.102 1.00 0.00 H new ATOM 0 HB2 SER A 14 5.890 -16.523 31.234 1.00 0.00 H new ATOM 0 HB3 SER A 14 6.660 -15.040 30.706 1.00 0.00 H new ATOM 0 HG SER A 14 7.364 -14.839 33.035 1.00 0.00 H new ATOM 222 N VAL A 15 4.648 -12.370 31.832 1.00 0.00 N ATOM 223 CA VAL A 15 4.927 -10.937 31.929 1.00 0.00 C ATOM 224 C VAL A 15 6.118 -10.557 31.053 1.00 0.00 C ATOM 225 O VAL A 15 6.069 -9.572 30.316 1.00 0.00 O ATOM 226 CB VAL A 15 5.211 -10.542 33.383 1.00 0.00 C ATOM 227 CG1 VAL A 15 5.135 -9.020 33.525 1.00 0.00 C ATOM 228 CG2 VAL A 15 4.172 -11.194 34.303 1.00 0.00 C ATOM 0 H VAL A 15 3.766 -12.595 31.371 1.00 0.00 H new ATOM 0 HA VAL A 15 4.046 -10.399 31.579 1.00 0.00 H new ATOM 0 HB VAL A 15 6.208 -10.882 33.662 1.00 0.00 H new ATOM 0 HG11 VAL A 15 5.337 -8.741 34.559 1.00 0.00 H new ATOM 0 HG12 VAL A 15 5.875 -8.556 32.873 1.00 0.00 H new ATOM 0 HG13 VAL A 15 4.139 -8.678 33.245 1.00 0.00 H new ATOM 0 HG21 VAL A 15 4.374 -10.913 35.337 1.00 0.00 H new ATOM 0 HG22 VAL A 15 3.175 -10.855 34.023 1.00 0.00 H new ATOM 0 HG23 VAL A 15 4.228 -12.278 34.204 1.00 0.00 H new ATOM 238 N ILE A 16 7.186 -11.345 31.135 1.00 0.00 N ATOM 239 CA ILE A 16 8.389 -11.091 30.347 1.00 0.00 C ATOM 240 C ILE A 16 8.957 -12.402 29.811 1.00 0.00 C ATOM 241 O ILE A 16 9.159 -13.356 30.561 1.00 0.00 O ATOM 242 CB ILE A 16 9.431 -10.391 31.220 1.00 0.00 C ATOM 243 CG1 ILE A 16 10.634 -9.986 30.365 1.00 0.00 C ATOM 244 CG2 ILE A 16 9.892 -11.337 32.335 1.00 0.00 C ATOM 245 CD1 ILE A 16 11.501 -8.997 31.144 1.00 0.00 C ATOM 0 H ILE A 16 7.243 -12.165 31.739 1.00 0.00 H new ATOM 0 HA ILE A 16 8.133 -10.451 29.502 1.00 0.00 H new ATOM 0 HB ILE A 16 8.985 -9.500 31.662 1.00 0.00 H new ATOM 0 HG12 ILE A 16 11.218 -10.867 30.099 1.00 0.00 H new ATOM 0 HG13 ILE A 16 10.296 -9.534 29.433 1.00 0.00 H new ATOM 0 HG21 ILE A 16 10.634 -10.834 32.955 1.00 0.00 H new ATOM 0 HG22 ILE A 16 9.037 -11.619 32.950 1.00 0.00 H new ATOM 0 HG23 ILE A 16 10.333 -12.231 31.894 1.00 0.00 H new ATOM 0 HD11 ILE A 16 12.358 -8.708 30.536 1.00 0.00 H new ATOM 0 HD12 ILE A 16 10.914 -8.112 31.388 1.00 0.00 H new ATOM 0 HD13 ILE A 16 11.850 -9.465 32.064 1.00 0.00 H new ATOM 257 N GLY A 17 9.211 -12.441 28.506 1.00 0.00 N ATOM 258 CA GLY A 17 9.757 -13.640 27.878 1.00 0.00 C ATOM 259 C GLY A 17 11.272 -13.686 28.037 1.00 0.00 C ATOM 260 O GLY A 17 11.949 -12.666 27.905 1.00 0.00 O ATOM 0 H GLY A 17 9.049 -11.663 27.867 1.00 0.00 H new ATOM 0 HA2 GLY A 17 9.312 -14.528 28.327 1.00 0.00 H new ATOM 0 HA3 GLY A 17 9.496 -13.654 26.820 1.00 0.00 H new ATOM 264 N LYS A 18 11.798 -14.871 28.319 1.00 0.00 N ATOM 265 CA LYS A 18 13.237 -15.039 28.491 1.00 0.00 C ATOM 266 C LYS A 18 13.635 -16.498 28.280 1.00 0.00 C ATOM 267 O LYS A 18 14.299 -17.099 29.124 1.00 0.00 O ATOM 268 CB LYS A 18 13.653 -14.591 29.895 1.00 0.00 C ATOM 269 CG LYS A 18 12.743 -15.249 30.932 1.00 0.00 C ATOM 270 CD LYS A 18 13.172 -14.816 32.336 1.00 0.00 C ATOM 271 CE LYS A 18 12.178 -15.357 33.364 1.00 0.00 C ATOM 272 NZ LYS A 18 12.403 -14.681 34.673 1.00 0.00 N ATOM 0 H LYS A 18 11.254 -15.726 28.433 1.00 0.00 H new ATOM 0 HA LYS A 18 13.747 -14.424 27.749 1.00 0.00 H new ATOM 0 HB2 LYS A 18 14.692 -14.864 30.082 1.00 0.00 H new ATOM 0 HB3 LYS A 18 13.589 -13.506 29.976 1.00 0.00 H new ATOM 0 HG2 LYS A 18 11.706 -14.965 30.753 1.00 0.00 H new ATOM 0 HG3 LYS A 18 12.797 -16.334 30.842 1.00 0.00 H new ATOM 0 HD2 LYS A 18 14.173 -15.188 32.552 1.00 0.00 H new ATOM 0 HD3 LYS A 18 13.216 -13.728 32.395 1.00 0.00 H new ATOM 0 HE2 LYS A 18 11.157 -15.185 33.024 1.00 0.00 H new ATOM 0 HE3 LYS A 18 12.301 -16.435 33.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 11.728 -15.048 35.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 13.374 -14.867 34.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 12.265 -13.656 34.563 1.00 0.00 H new ATOM 286 N PRO A 19 13.242 -17.069 27.170 1.00 0.00 N ATOM 287 CA PRO A 19 13.562 -18.489 26.833 1.00 0.00 C ATOM 288 C PRO A 19 15.053 -18.693 26.568 1.00 0.00 C ATOM 289 O PRO A 19 15.773 -17.749 26.243 1.00 0.00 O ATOM 290 CB PRO A 19 12.722 -18.761 25.576 1.00 0.00 C ATOM 291 CG PRO A 19 12.526 -17.419 24.952 1.00 0.00 C ATOM 292 CD PRO A 19 12.447 -16.425 26.110 1.00 0.00 C ATOM 0 HA PRO A 19 13.333 -19.172 27.651 1.00 0.00 H new ATOM 0 HB2 PRO A 19 13.235 -19.442 24.897 1.00 0.00 H new ATOM 0 HB3 PRO A 19 11.768 -19.223 25.830 1.00 0.00 H new ATOM 0 HG2 PRO A 19 13.352 -17.175 24.284 1.00 0.00 H new ATOM 0 HG3 PRO A 19 11.615 -17.396 24.355 1.00 0.00 H new ATOM 0 HD2 PRO A 19 12.858 -15.454 25.834 1.00 0.00 H new ATOM 0 HD3 PRO A 19 11.417 -16.258 26.426 1.00 0.00 H new ATOM 300 N ILE A 20 15.507 -19.935 26.714 1.00 0.00 N ATOM 301 CA ILE A 20 16.910 -20.259 26.491 1.00 0.00 C ATOM 302 C ILE A 20 17.207 -20.355 25.002 1.00 0.00 C ATOM 303 O ILE A 20 16.389 -20.841 24.226 1.00 0.00 O ATOM 304 CB ILE A 20 17.265 -21.578 27.188 1.00 0.00 C ATOM 305 CG1 ILE A 20 16.249 -22.647 26.785 1.00 0.00 C ATOM 306 CG2 ILE A 20 17.235 -21.383 28.709 1.00 0.00 C ATOM 307 CD1 ILE A 20 16.782 -24.040 27.137 1.00 0.00 C ATOM 0 H ILE A 20 14.926 -20.729 26.984 1.00 0.00 H new ATOM 0 HA ILE A 20 17.520 -19.461 26.914 1.00 0.00 H new ATOM 0 HB ILE A 20 18.265 -21.893 26.889 1.00 0.00 H new ATOM 0 HG12 ILE A 20 15.303 -22.471 27.296 1.00 0.00 H new ATOM 0 HG13 ILE A 20 16.049 -22.585 25.715 1.00 0.00 H new ATOM 0 HG21 ILE A 20 17.488 -22.322 29.201 1.00 0.00 H new ATOM 0 HG22 ILE A 20 17.959 -20.619 28.992 1.00 0.00 H new ATOM 0 HG23 ILE A 20 16.237 -21.069 29.016 1.00 0.00 H new ATOM 0 HD11 ILE A 20 16.050 -24.794 26.846 1.00 0.00 H new ATOM 0 HD12 ILE A 20 17.717 -24.217 26.605 1.00 0.00 H new ATOM 0 HD13 ILE A 20 16.958 -24.101 28.211 1.00 0.00 H new ATOM 319 N GLY A 21 18.379 -19.872 24.602 1.00 0.00 N ATOM 320 CA GLY A 21 18.765 -19.905 23.196 1.00 0.00 C ATOM 321 C GLY A 21 19.383 -21.251 22.838 1.00 0.00 C ATOM 322 O GLY A 21 20.452 -21.605 23.331 1.00 0.00 O ATOM 0 H GLY A 21 19.072 -19.457 25.225 1.00 0.00 H new ATOM 0 HA2 GLY A 21 17.892 -19.722 22.570 1.00 0.00 H new ATOM 0 HA3 GLY A 21 19.477 -19.106 22.991 1.00 0.00 H new ATOM 326 N GLU A 22 18.699 -21.999 21.977 1.00 0.00 N ATOM 327 CA GLU A 22 19.191 -23.310 21.558 1.00 0.00 C ATOM 328 C GLU A 22 18.189 -23.972 20.611 1.00 0.00 C ATOM 329 O GLU A 22 17.165 -23.385 20.260 1.00 0.00 O ATOM 330 CB GLU A 22 19.435 -24.208 22.802 1.00 0.00 C ATOM 331 CG GLU A 22 20.925 -24.564 22.933 1.00 0.00 C ATOM 332 CD GLU A 22 21.345 -25.473 21.781 1.00 0.00 C ATOM 333 OE1 GLU A 22 20.561 -26.335 21.417 1.00 0.00 O ATOM 334 OE2 GLU A 22 22.441 -25.292 21.279 1.00 0.00 O ATOM 0 H GLU A 22 17.810 -21.724 21.558 1.00 0.00 H new ATOM 0 HA GLU A 22 20.135 -23.181 21.028 1.00 0.00 H new ATOM 0 HB2 GLU A 22 19.099 -23.691 23.701 1.00 0.00 H new ATOM 0 HB3 GLU A 22 18.844 -25.120 22.719 1.00 0.00 H new ATOM 0 HG2 GLU A 22 21.527 -23.655 22.929 1.00 0.00 H new ATOM 0 HG3 GLU A 22 21.107 -25.062 23.885 1.00 0.00 H new ATOM 341 N SER A 23 18.494 -25.201 20.210 1.00 0.00 N ATOM 342 CA SER A 23 17.619 -25.944 19.315 1.00 0.00 C ATOM 343 C SER A 23 16.246 -26.128 19.951 1.00 0.00 C ATOM 344 O SER A 23 15.223 -26.039 19.277 1.00 0.00 O ATOM 345 CB SER A 23 18.230 -27.310 19.002 1.00 0.00 C ATOM 346 OG SER A 23 19.512 -27.127 18.413 1.00 0.00 O ATOM 0 H SER A 23 19.338 -25.701 20.490 1.00 0.00 H new ATOM 0 HA SER A 23 17.507 -25.380 18.389 1.00 0.00 H new ATOM 0 HB2 SER A 23 18.317 -27.900 19.914 1.00 0.00 H new ATOM 0 HB3 SER A 23 17.581 -27.865 18.324 1.00 0.00 H new ATOM 0 HG SER A 23 19.908 -28.001 18.212 1.00 0.00 H new ATOM 352 N TYR A 24 16.232 -26.384 21.253 1.00 0.00 N ATOM 353 CA TYR A 24 14.975 -26.579 21.967 1.00 0.00 C ATOM 354 C TYR A 24 14.067 -25.365 21.787 1.00 0.00 C ATOM 355 O TYR A 24 12.851 -25.457 21.962 1.00 0.00 O ATOM 356 CB TYR A 24 15.243 -26.805 23.459 1.00 0.00 C ATOM 357 CG TYR A 24 13.930 -27.019 24.175 1.00 0.00 C ATOM 358 CD1 TYR A 24 13.326 -28.283 24.173 1.00 0.00 C ATOM 359 CD2 TYR A 24 13.317 -25.953 24.843 1.00 0.00 C ATOM 360 CE1 TYR A 24 12.110 -28.479 24.839 1.00 0.00 C ATOM 361 CE2 TYR A 24 12.102 -26.149 25.509 1.00 0.00 C ATOM 362 CZ TYR A 24 11.498 -27.412 25.507 1.00 0.00 C ATOM 363 OH TYR A 24 10.301 -27.604 26.165 1.00 0.00 O ATOM 0 H TYR A 24 17.068 -26.461 21.832 1.00 0.00 H new ATOM 0 HA TYR A 24 14.478 -27.458 21.555 1.00 0.00 H new ATOM 0 HB2 TYR A 24 15.891 -27.671 23.597 1.00 0.00 H new ATOM 0 HB3 TYR A 24 15.765 -25.946 23.881 1.00 0.00 H new ATOM 0 HD1 TYR A 24 13.798 -29.106 23.658 1.00 0.00 H new ATOM 0 HD2 TYR A 24 13.782 -24.978 24.845 1.00 0.00 H new ATOM 0 HE1 TYR A 24 11.644 -29.453 24.837 1.00 0.00 H new ATOM 0 HE2 TYR A 24 11.630 -25.326 26.025 1.00 0.00 H new ATOM 0 HH TYR A 24 10.015 -26.762 26.576 1.00 0.00 H new ATOM 373 N LYS A 25 14.664 -24.226 21.432 1.00 0.00 N ATOM 374 CA LYS A 25 13.904 -22.992 21.222 1.00 0.00 C ATOM 375 C LYS A 25 13.494 -22.858 19.758 1.00 0.00 C ATOM 376 O LYS A 25 12.686 -22.001 19.399 1.00 0.00 O ATOM 377 CB LYS A 25 14.754 -21.786 21.645 1.00 0.00 C ATOM 378 CG LYS A 25 13.982 -20.488 21.397 1.00 0.00 C ATOM 379 CD LYS A 25 14.741 -19.310 22.005 1.00 0.00 C ATOM 380 CE LYS A 25 13.941 -18.029 21.770 1.00 0.00 C ATOM 381 NZ LYS A 25 13.812 -17.786 20.305 1.00 0.00 N ATOM 0 H LYS A 25 15.669 -24.132 21.284 1.00 0.00 H new ATOM 0 HA LYS A 25 13.000 -23.027 21.830 1.00 0.00 H new ATOM 0 HB2 LYS A 25 15.015 -21.867 22.700 1.00 0.00 H new ATOM 0 HB3 LYS A 25 15.689 -21.775 21.085 1.00 0.00 H new ATOM 0 HG2 LYS A 25 13.848 -20.333 20.326 1.00 0.00 H new ATOM 0 HG3 LYS A 25 12.987 -20.557 21.836 1.00 0.00 H new ATOM 0 HD2 LYS A 25 14.891 -19.470 23.073 1.00 0.00 H new ATOM 0 HD3 LYS A 25 15.729 -19.225 21.553 1.00 0.00 H new ATOM 0 HE2 LYS A 25 12.954 -18.116 22.223 1.00 0.00 H new ATOM 0 HE3 LYS A 25 14.438 -17.184 22.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 13.600 -16.782 20.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 14.704 -18.035 19.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 13.042 -18.371 19.922 1.00 0.00 H new ATOM 395 N ARG A 26 14.039 -23.725 18.917 1.00 0.00 N ATOM 396 CA ARG A 26 13.718 -23.694 17.500 1.00 0.00 C ATOM 397 C ARG A 26 12.227 -23.911 17.293 1.00 0.00 C ATOM 398 O ARG A 26 11.664 -23.494 16.285 1.00 0.00 O ATOM 399 CB ARG A 26 14.521 -24.777 16.759 1.00 0.00 C ATOM 400 CG ARG A 26 13.917 -26.183 17.015 1.00 0.00 C ATOM 401 CD ARG A 26 13.033 -26.611 15.836 1.00 0.00 C ATOM 402 NE ARG A 26 13.867 -27.108 14.748 1.00 0.00 N ATOM 403 CZ ARG A 26 14.284 -28.370 14.722 1.00 0.00 C ATOM 404 NH1 ARG A 26 13.943 -29.191 15.680 1.00 0.00 N ATOM 405 NH2 ARG A 26 15.038 -28.786 13.743 1.00 0.00 N ATOM 0 H ARG A 26 14.700 -24.452 19.189 1.00 0.00 H new ATOM 0 HA ARG A 26 13.985 -22.717 17.098 1.00 0.00 H new ATOM 0 HB2 ARG A 26 14.523 -24.566 15.690 1.00 0.00 H new ATOM 0 HB3 ARG A 26 15.559 -24.757 17.090 1.00 0.00 H new ATOM 0 HG2 ARG A 26 14.718 -26.908 17.159 1.00 0.00 H new ATOM 0 HG3 ARG A 26 13.329 -26.171 17.933 1.00 0.00 H new ATOM 0 HD2 ARG A 26 12.336 -27.386 16.155 1.00 0.00 H new ATOM 0 HD3 ARG A 26 12.436 -25.767 15.492 1.00 0.00 H new ATOM 0 HE ARG A 26 14.135 -26.476 13.994 1.00 0.00 H new ATOM 0 HH11 ARG A 26 13.357 -28.863 16.448 1.00 0.00 H new ATOM 0 HH12 ARG A 26 14.263 -30.159 15.660 1.00 0.00 H new ATOM 0 HH21 ARG A 26 15.307 -28.143 12.998 1.00 0.00 H new ATOM 0 HH22 ARG A 26 15.359 -29.754 13.722 1.00 0.00 H new ATOM 419 N ILE A 27 11.595 -24.573 18.257 1.00 0.00 N ATOM 420 CA ILE A 27 10.171 -24.846 18.163 1.00 0.00 C ATOM 421 C ILE A 27 9.368 -23.550 18.171 1.00 0.00 C ATOM 422 O ILE A 27 8.613 -23.275 17.246 1.00 0.00 O ATOM 423 CB ILE A 27 9.731 -25.737 19.328 1.00 0.00 C ATOM 424 CG1 ILE A 27 8.215 -25.962 19.255 1.00 0.00 C ATOM 425 CG2 ILE A 27 10.088 -25.078 20.673 1.00 0.00 C ATOM 426 CD1 ILE A 27 7.807 -27.075 20.230 1.00 0.00 C ATOM 0 H ILE A 27 12.043 -24.926 19.103 1.00 0.00 H new ATOM 0 HA ILE A 27 9.983 -25.363 17.222 1.00 0.00 H new ATOM 0 HB ILE A 27 10.250 -26.693 19.256 1.00 0.00 H new ATOM 0 HG12 ILE A 27 7.689 -25.040 19.501 1.00 0.00 H new ATOM 0 HG13 ILE A 27 7.927 -26.232 18.239 1.00 0.00 H new ATOM 0 HG21 ILE A 27 9.769 -25.724 21.491 1.00 0.00 H new ATOM 0 HG22 ILE A 27 11.166 -24.927 20.729 1.00 0.00 H new ATOM 0 HG23 ILE A 27 9.582 -24.116 20.752 1.00 0.00 H new ATOM 0 HD11 ILE A 27 6.730 -27.231 20.174 1.00 0.00 H new ATOM 0 HD12 ILE A 27 8.321 -27.998 19.964 1.00 0.00 H new ATOM 0 HD13 ILE A 27 8.080 -26.787 21.245 1.00 0.00 H new ATOM 438 N LEU A 28 9.547 -22.759 19.217 1.00 0.00 N ATOM 439 CA LEU A 28 8.846 -21.484 19.341 1.00 0.00 C ATOM 440 C LEU A 28 9.248 -20.538 18.210 1.00 0.00 C ATOM 441 O LEU A 28 8.407 -19.848 17.636 1.00 0.00 O ATOM 442 CB LEU A 28 9.185 -20.850 20.703 1.00 0.00 C ATOM 443 CG LEU A 28 8.292 -21.450 21.813 1.00 0.00 C ATOM 444 CD1 LEU A 28 9.012 -21.364 23.165 1.00 0.00 C ATOM 445 CD2 LEU A 28 6.976 -20.662 21.905 1.00 0.00 C ATOM 0 H LEU A 28 10.171 -22.975 19.994 1.00 0.00 H new ATOM 0 HA LEU A 28 7.772 -21.660 19.275 1.00 0.00 H new ATOM 0 HB2 LEU A 28 10.235 -21.021 20.940 1.00 0.00 H new ATOM 0 HB3 LEU A 28 9.041 -19.771 20.655 1.00 0.00 H new ATOM 0 HG LEU A 28 8.084 -22.492 21.570 1.00 0.00 H new ATOM 0 HD11 LEU A 28 8.377 -21.788 23.943 1.00 0.00 H new ATOM 0 HD12 LEU A 28 9.947 -21.922 23.115 1.00 0.00 H new ATOM 0 HD13 LEU A 28 9.224 -20.321 23.399 1.00 0.00 H new ATOM 0 HD21 LEU A 28 6.350 -21.089 22.689 1.00 0.00 H new ATOM 0 HD22 LEU A 28 7.192 -19.620 22.140 1.00 0.00 H new ATOM 0 HD23 LEU A 28 6.451 -20.718 20.951 1.00 0.00 H new ATOM 457 N ALA A 29 10.538 -20.508 17.901 1.00 0.00 N ATOM 458 CA ALA A 29 11.037 -19.639 16.844 1.00 0.00 C ATOM 459 C ALA A 29 10.443 -20.033 15.495 1.00 0.00 C ATOM 460 O ALA A 29 10.307 -19.200 14.600 1.00 0.00 O ATOM 461 CB ALA A 29 12.560 -19.718 16.777 1.00 0.00 C ATOM 0 H ALA A 29 11.252 -21.071 18.363 1.00 0.00 H new ATOM 0 HA ALA A 29 10.737 -18.616 17.072 1.00 0.00 H new ATOM 0 HB1 ALA A 29 12.924 -19.065 15.984 1.00 0.00 H new ATOM 0 HB2 ALA A 29 12.983 -19.401 17.730 1.00 0.00 H new ATOM 0 HB3 ALA A 29 12.862 -20.744 16.569 1.00 0.00 H new ATOM 467 N LYS A 30 10.094 -21.306 15.354 1.00 0.00 N ATOM 468 CA LYS A 30 9.519 -21.796 14.107 1.00 0.00 C ATOM 469 C LYS A 30 8.200 -21.091 13.816 1.00 0.00 C ATOM 470 O LYS A 30 7.883 -20.808 12.662 1.00 0.00 O ATOM 471 CB LYS A 30 9.300 -23.307 14.193 1.00 0.00 C ATOM 472 CG LYS A 30 8.814 -23.841 12.846 1.00 0.00 C ATOM 473 CD LYS A 30 8.958 -25.369 12.818 1.00 0.00 C ATOM 474 CE LYS A 30 8.323 -25.982 14.068 1.00 0.00 C ATOM 475 NZ LYS A 30 8.058 -27.429 13.831 1.00 0.00 N ATOM 0 H LYS A 30 10.198 -22.013 16.082 1.00 0.00 H new ATOM 0 HA LYS A 30 10.213 -21.582 13.294 1.00 0.00 H new ATOM 0 HB2 LYS A 30 10.229 -23.802 14.476 1.00 0.00 H new ATOM 0 HB3 LYS A 30 8.569 -23.533 14.969 1.00 0.00 H new ATOM 0 HG2 LYS A 30 7.773 -23.560 12.686 1.00 0.00 H new ATOM 0 HG3 LYS A 30 9.392 -23.396 12.036 1.00 0.00 H new ATOM 0 HD2 LYS A 30 8.480 -25.770 11.924 1.00 0.00 H new ATOM 0 HD3 LYS A 30 10.012 -25.641 12.766 1.00 0.00 H new ATOM 0 HE2 LYS A 30 8.986 -25.858 14.924 1.00 0.00 H new ATOM 0 HE3 LYS A 30 7.394 -25.465 14.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 7.319 -27.758 14.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 7.739 -27.568 12.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 8.930 -27.972 13.992 1.00 0.00 H new ATOM 489 N LEU A 31 7.440 -20.803 14.868 1.00 0.00 N ATOM 490 CA LEU A 31 6.158 -20.123 14.717 1.00 0.00 C ATOM 491 C LEU A 31 6.363 -18.739 14.112 1.00 0.00 C ATOM 492 O LEU A 31 5.555 -18.278 13.307 1.00 0.00 O ATOM 493 CB LEU A 31 5.456 -20.000 16.080 1.00 0.00 C ATOM 494 CG LEU A 31 4.722 -21.309 16.420 1.00 0.00 C ATOM 495 CD1 LEU A 31 3.512 -21.520 15.481 1.00 0.00 C ATOM 496 CD2 LEU A 31 5.702 -22.480 16.283 1.00 0.00 C ATOM 0 H LEU A 31 7.688 -21.029 15.831 1.00 0.00 H new ATOM 0 HA LEU A 31 5.530 -20.712 14.048 1.00 0.00 H new ATOM 0 HB2 LEU A 31 6.188 -19.773 16.855 1.00 0.00 H new ATOM 0 HB3 LEU A 31 4.747 -19.172 16.059 1.00 0.00 H new ATOM 0 HG LEU A 31 4.350 -21.254 17.443 1.00 0.00 H new ATOM 0 HD11 LEU A 31 3.009 -22.451 15.740 1.00 0.00 H new ATOM 0 HD12 LEU A 31 2.816 -20.688 15.592 1.00 0.00 H new ATOM 0 HD13 LEU A 31 3.857 -21.569 14.448 1.00 0.00 H new ATOM 0 HD21 LEU A 31 5.191 -23.412 16.522 1.00 0.00 H new ATOM 0 HD22 LEU A 31 6.076 -22.523 15.260 1.00 0.00 H new ATOM 0 HD23 LEU A 31 6.537 -22.338 16.969 1.00 0.00 H new ATOM 508 N GLN A 32 7.447 -18.077 14.504 1.00 0.00 N ATOM 509 CA GLN A 32 7.737 -16.743 13.991 1.00 0.00 C ATOM 510 C GLN A 32 7.499 -16.692 12.484 1.00 0.00 C ATOM 511 O GLN A 32 6.846 -15.777 11.982 1.00 0.00 O ATOM 512 CB GLN A 32 9.192 -16.388 14.293 1.00 0.00 C ATOM 513 CG GLN A 32 9.466 -14.948 13.863 1.00 0.00 C ATOM 514 CD GLN A 32 10.892 -14.563 14.231 1.00 0.00 C ATOM 515 OE1 GLN A 32 11.516 -15.212 15.071 1.00 0.00 O ATOM 516 NE2 GLN A 32 11.450 -13.540 13.647 1.00 0.00 N ATOM 0 H GLN A 32 8.132 -18.438 15.168 1.00 0.00 H new ATOM 0 HA GLN A 32 7.076 -16.025 14.476 1.00 0.00 H new ATOM 0 HB2 GLN A 32 9.392 -16.505 15.358 1.00 0.00 H new ATOM 0 HB3 GLN A 32 9.860 -17.069 13.766 1.00 0.00 H new ATOM 0 HG2 GLN A 32 9.318 -14.845 12.788 1.00 0.00 H new ATOM 0 HG3 GLN A 32 8.761 -14.273 14.348 1.00 0.00 H new ATOM 0 HE21 GLN A 32 10.931 -13.004 12.951 1.00 0.00 H new ATOM 0 HE22 GLN A 32 12.406 -13.275 13.885 1.00 0.00 H new ATOM 525 N ARG A 33 8.012 -17.688 11.771 1.00 0.00 N ATOM 526 CA ARG A 33 7.828 -17.752 10.325 1.00 0.00 C ATOM 527 C ARG A 33 6.360 -17.998 9.987 1.00 0.00 C ATOM 528 O ARG A 33 5.820 -17.405 9.053 1.00 0.00 O ATOM 529 CB ARG A 33 8.688 -18.865 9.727 1.00 0.00 C ATOM 530 CG ARG A 33 8.514 -18.878 8.207 1.00 0.00 C ATOM 531 CD ARG A 33 9.485 -19.883 7.593 1.00 0.00 C ATOM 532 NE ARG A 33 10.857 -19.409 7.727 1.00 0.00 N ATOM 533 CZ ARG A 33 11.375 -18.553 6.851 1.00 0.00 C ATOM 534 NH1 ARG A 33 10.657 -18.131 5.847 1.00 0.00 N ATOM 535 NH2 ARG A 33 12.605 -18.139 6.994 1.00 0.00 N ATOM 0 H ARG A 33 8.554 -18.456 12.166 1.00 0.00 H new ATOM 0 HA ARG A 33 8.136 -16.798 9.898 1.00 0.00 H new ATOM 0 HB2 ARG A 33 9.736 -18.708 9.983 1.00 0.00 H new ATOM 0 HB3 ARG A 33 8.398 -19.829 10.146 1.00 0.00 H new ATOM 0 HG2 ARG A 33 7.488 -19.143 7.950 1.00 0.00 H new ATOM 0 HG3 ARG A 33 8.698 -17.883 7.801 1.00 0.00 H new ATOM 0 HD2 ARG A 33 9.378 -20.850 8.085 1.00 0.00 H new ATOM 0 HD3 ARG A 33 9.246 -20.033 6.540 1.00 0.00 H new ATOM 0 HE ARG A 33 11.429 -19.739 8.505 1.00 0.00 H new ATOM 0 HH11 ARG A 33 9.697 -18.458 5.733 1.00 0.00 H new ATOM 0 HH12 ARG A 33 11.055 -17.474 5.176 1.00 0.00 H new ATOM 0 HH21 ARG A 33 13.167 -18.472 7.777 1.00 0.00 H new ATOM 0 HH22 ARG A 33 13.003 -17.482 6.323 1.00 0.00 H new ATOM 549 N ILE A 34 5.721 -18.876 10.754 1.00 0.00 N ATOM 550 CA ILE A 34 4.315 -19.197 10.531 1.00 0.00 C ATOM 551 C ILE A 34 3.469 -17.933 10.618 1.00 0.00 C ATOM 552 O ILE A 34 2.491 -17.780 9.892 1.00 0.00 O ATOM 553 CB ILE A 34 3.831 -20.211 11.569 1.00 0.00 C ATOM 554 CG1 ILE A 34 4.744 -21.451 11.549 1.00 0.00 C ATOM 555 CG2 ILE A 34 2.380 -20.613 11.275 1.00 0.00 C ATOM 556 CD1 ILE A 34 4.759 -22.105 10.164 1.00 0.00 C ATOM 0 H ILE A 34 6.152 -19.376 11.532 1.00 0.00 H new ATOM 0 HA ILE A 34 4.212 -19.630 9.536 1.00 0.00 H new ATOM 0 HB ILE A 34 3.872 -19.758 12.559 1.00 0.00 H new ATOM 0 HG12 ILE A 34 5.757 -21.164 11.830 1.00 0.00 H new ATOM 0 HG13 ILE A 34 4.400 -22.172 12.291 1.00 0.00 H new ATOM 0 HG21 ILE A 34 2.045 -21.335 12.019 1.00 0.00 H new ATOM 0 HG22 ILE A 34 1.743 -19.730 11.314 1.00 0.00 H new ATOM 0 HG23 ILE A 34 2.320 -21.060 10.283 1.00 0.00 H new ATOM 0 HD11 ILE A 34 5.412 -22.978 10.181 1.00 0.00 H new ATOM 0 HD12 ILE A 34 3.748 -22.413 9.896 1.00 0.00 H new ATOM 0 HD13 ILE A 34 5.127 -21.390 9.428 1.00 0.00 H new ATOM 568 N HIS A 35 3.848 -17.028 11.513 1.00 0.00 N ATOM 569 CA HIS A 35 3.107 -15.785 11.676 1.00 0.00 C ATOM 570 C HIS A 35 3.084 -15.004 10.360 1.00 0.00 C ATOM 571 O HIS A 35 2.025 -14.571 9.906 1.00 0.00 O ATOM 572 CB HIS A 35 3.765 -14.934 12.764 1.00 0.00 C ATOM 573 CG HIS A 35 2.973 -13.674 12.964 1.00 0.00 C ATOM 574 ND1 HIS A 35 3.410 -12.446 12.495 1.00 0.00 N ATOM 575 CD2 HIS A 35 1.772 -13.436 13.583 1.00 0.00 C ATOM 576 CE1 HIS A 35 2.485 -11.531 12.836 1.00 0.00 C ATOM 577 NE2 HIS A 35 1.466 -12.081 13.501 1.00 0.00 N ATOM 0 H HIS A 35 4.654 -17.130 12.130 1.00 0.00 H new ATOM 0 HA HIS A 35 2.083 -16.021 11.965 1.00 0.00 H new ATOM 0 HB2 HIS A 35 3.817 -15.495 13.697 1.00 0.00 H new ATOM 0 HB3 HIS A 35 4.789 -14.691 12.481 1.00 0.00 H new ATOM 0 HD2 HIS A 35 1.158 -14.185 14.061 1.00 0.00 H new ATOM 0 HE1 HIS A 35 2.558 -10.479 12.601 1.00 0.00 H new ATOM 0 HE2 HIS A 35 0.640 -11.609 13.870 1.00 0.00 H new ATOM 585 N ASN A 36 4.254 -14.831 9.752 1.00 0.00 N ATOM 586 CA ASN A 36 4.349 -14.108 8.486 1.00 0.00 C ATOM 587 C ASN A 36 3.642 -14.868 7.365 1.00 0.00 C ATOM 588 O ASN A 36 2.953 -14.276 6.535 1.00 0.00 O ATOM 589 CB ASN A 36 5.819 -13.899 8.116 1.00 0.00 C ATOM 590 CG ASN A 36 6.446 -12.873 9.053 1.00 0.00 C ATOM 591 OD1 ASN A 36 5.735 -12.092 9.685 1.00 0.00 O ATOM 592 ND2 ASN A 36 7.743 -12.830 9.184 1.00 0.00 N ATOM 0 H ASN A 36 5.143 -15.178 10.111 1.00 0.00 H new ATOM 0 HA ASN A 36 3.860 -13.142 8.609 1.00 0.00 H new ATOM 0 HB2 ASN A 36 6.358 -14.844 8.183 1.00 0.00 H new ATOM 0 HB3 ASN A 36 5.899 -13.559 7.083 1.00 0.00 H new ATOM 0 HD21 ASN A 36 8.170 -12.148 9.811 1.00 0.00 H new ATOM 0 HD22 ASN A 36 8.330 -13.478 8.659 1.00 0.00 H new ATOM 599 N SER A 37 3.829 -16.187 7.350 1.00 0.00 N ATOM 600 CA SER A 37 3.224 -17.051 6.333 1.00 0.00 C ATOM 601 C SER A 37 1.940 -17.682 6.861 1.00 0.00 C ATOM 602 O SER A 37 1.483 -18.704 6.348 1.00 0.00 O ATOM 603 CB SER A 37 4.207 -18.150 5.926 1.00 0.00 C ATOM 604 OG SER A 37 5.410 -17.554 5.459 1.00 0.00 O ATOM 0 H SER A 37 4.398 -16.685 8.035 1.00 0.00 H new ATOM 0 HA SER A 37 2.984 -16.441 5.462 1.00 0.00 H new ATOM 0 HB2 SER A 37 4.416 -18.800 6.776 1.00 0.00 H new ATOM 0 HB3 SER A 37 3.770 -18.774 5.146 1.00 0.00 H new ATOM 0 HG SER A 37 6.043 -18.255 5.199 1.00 0.00 H new ATOM 610 N ASN A 38 1.373 -17.084 7.903 1.00 0.00 N ATOM 611 CA ASN A 38 0.154 -17.617 8.502 1.00 0.00 C ATOM 612 C ASN A 38 -0.856 -17.989 7.425 1.00 0.00 C ATOM 613 O ASN A 38 -1.280 -17.148 6.633 1.00 0.00 O ATOM 614 CB ASN A 38 -0.465 -16.576 9.435 1.00 0.00 C ATOM 615 CG ASN A 38 -1.542 -17.220 10.302 1.00 0.00 C ATOM 616 OD1 ASN A 38 -1.411 -18.377 10.699 1.00 0.00 O ATOM 617 ND2 ASN A 38 -2.605 -16.533 10.622 1.00 0.00 N ATOM 0 H ASN A 38 1.733 -16.239 8.347 1.00 0.00 H new ATOM 0 HA ASN A 38 0.414 -18.511 9.068 1.00 0.00 H new ATOM 0 HB2 ASN A 38 0.308 -16.138 10.067 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -0.896 -15.764 8.850 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -3.330 -16.955 11.203 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -2.711 -15.574 10.291 1.00 0.00 H new ATOM 624 N ILE A 39 -1.233 -19.262 7.406 1.00 0.00 N ATOM 625 CA ILE A 39 -2.191 -19.755 6.428 1.00 0.00 C ATOM 626 C ILE A 39 -1.700 -19.474 5.011 1.00 0.00 C ATOM 627 O ILE A 39 -2.330 -18.723 4.268 1.00 0.00 O ATOM 628 CB ILE A 39 -3.551 -19.086 6.636 1.00 0.00 C ATOM 629 CG1 ILE A 39 -3.879 -19.045 8.123 1.00 0.00 C ATOM 630 CG2 ILE A 39 -4.628 -19.887 5.902 1.00 0.00 C ATOM 631 CD1 ILE A 39 -5.240 -18.379 8.328 1.00 0.00 C ATOM 0 H ILE A 39 -0.890 -19.969 8.056 1.00 0.00 H new ATOM 0 HA ILE A 39 -2.293 -20.832 6.563 1.00 0.00 H new ATOM 0 HB ILE A 39 -3.518 -18.070 6.244 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -3.892 -20.056 8.531 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -3.108 -18.494 8.661 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -5.598 -19.412 6.049 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -4.396 -19.918 4.837 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -4.658 -20.903 6.296 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -5.474 -18.350 9.392 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -5.211 -17.363 7.935 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -6.007 -18.949 7.803 1.00 0.00 H new ATOM 643 N LEU A 40 -0.572 -20.082 4.640 1.00 0.00 N ATOM 644 CA LEU A 40 0.003 -19.892 3.302 1.00 0.00 C ATOM 645 C LEU A 40 0.001 -21.207 2.538 1.00 0.00 C ATOM 646 O LEU A 40 0.145 -22.273 3.125 1.00 0.00 O ATOM 647 CB LEU A 40 1.440 -19.373 3.412 1.00 0.00 C ATOM 648 CG LEU A 40 2.000 -19.044 2.018 1.00 0.00 C ATOM 649 CD1 LEU A 40 1.194 -17.900 1.373 1.00 0.00 C ATOM 650 CD2 LEU A 40 3.472 -18.633 2.160 1.00 0.00 C ATOM 0 H LEU A 40 -0.038 -20.708 5.243 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.604 -19.162 2.767 1.00 0.00 H new ATOM 0 HB2 LEU A 40 1.465 -18.482 4.040 1.00 0.00 H new ATOM 0 HB3 LEU A 40 2.068 -20.122 3.896 1.00 0.00 H new ATOM 0 HG LEU A 40 1.921 -19.923 1.378 1.00 0.00 H new ATOM 0 HD11 LEU A 40 1.602 -17.678 0.387 1.00 0.00 H new ATOM 0 HD12 LEU A 40 0.151 -18.200 1.275 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.258 -17.011 2.000 1.00 0.00 H new ATOM 0 HD21 LEU A 40 3.880 -18.397 1.177 1.00 0.00 H new ATOM 0 HD22 LEU A 40 3.544 -17.756 2.803 1.00 0.00 H new ATOM 0 HD23 LEU A 40 4.038 -19.454 2.601 1.00 0.00 H new ATOM 662 N ASP A 41 -0.165 -21.122 1.225 1.00 0.00 N ATOM 663 CA ASP A 41 -0.194 -22.315 0.391 1.00 0.00 C ATOM 664 C ASP A 41 1.080 -23.130 0.571 1.00 0.00 C ATOM 665 O ASP A 41 1.030 -24.353 0.689 1.00 0.00 O ATOM 666 CB ASP A 41 -0.348 -21.916 -1.078 1.00 0.00 C ATOM 667 CG ASP A 41 -1.762 -21.403 -1.336 1.00 0.00 C ATOM 668 OD1 ASP A 41 -2.590 -21.534 -0.450 1.00 0.00 O ATOM 669 OD2 ASP A 41 -1.995 -20.885 -2.416 1.00 0.00 O ATOM 0 H ASP A 41 -0.281 -20.245 0.717 1.00 0.00 H new ATOM 0 HA ASP A 41 -1.043 -22.928 0.693 1.00 0.00 H new ATOM 0 HB2 ASP A 41 0.379 -21.145 -1.332 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -0.141 -22.773 -1.719 1.00 0.00 H new ATOM 674 N GLU A 42 2.217 -22.453 0.588 1.00 0.00 N ATOM 675 CA GLU A 42 3.490 -23.141 0.754 1.00 0.00 C ATOM 676 C GLU A 42 3.658 -23.650 2.187 1.00 0.00 C ATOM 677 O GLU A 42 4.056 -24.794 2.405 1.00 0.00 O ATOM 678 CB GLU A 42 4.631 -22.184 0.414 1.00 0.00 C ATOM 679 CG GLU A 42 5.968 -22.925 0.498 1.00 0.00 C ATOM 680 CD GLU A 42 7.110 -21.990 0.115 1.00 0.00 C ATOM 681 OE1 GLU A 42 6.830 -20.943 -0.445 1.00 0.00 O ATOM 682 OE2 GLU A 42 8.248 -22.334 0.389 1.00 0.00 O ATOM 0 H GLU A 42 2.287 -21.440 0.490 1.00 0.00 H new ATOM 0 HA GLU A 42 3.509 -23.999 0.082 1.00 0.00 H new ATOM 0 HB2 GLU A 42 4.492 -21.778 -0.588 1.00 0.00 H new ATOM 0 HB3 GLU A 42 4.628 -21.340 1.103 1.00 0.00 H new ATOM 0 HG2 GLU A 42 6.120 -23.303 1.509 1.00 0.00 H new ATOM 0 HG3 GLU A 42 5.956 -23.789 -0.167 1.00 0.00 H new ATOM 689 N ARG A 43 3.367 -22.788 3.157 1.00 0.00 N ATOM 690 CA ARG A 43 3.502 -23.146 4.568 1.00 0.00 C ATOM 691 C ARG A 43 2.363 -24.065 5.009 1.00 0.00 C ATOM 692 O ARG A 43 2.466 -24.748 6.028 1.00 0.00 O ATOM 693 CB ARG A 43 3.522 -21.865 5.427 1.00 0.00 C ATOM 694 CG ARG A 43 4.361 -22.083 6.700 1.00 0.00 C ATOM 695 CD ARG A 43 5.842 -21.826 6.393 1.00 0.00 C ATOM 696 NE ARG A 43 6.684 -22.416 7.424 1.00 0.00 N ATOM 697 CZ ARG A 43 7.948 -22.735 7.176 1.00 0.00 C ATOM 698 NH1 ARG A 43 8.451 -22.532 5.988 1.00 0.00 N ATOM 699 NH2 ARG A 43 8.687 -23.246 8.120 1.00 0.00 N ATOM 0 H ARG A 43 3.036 -21.837 2.993 1.00 0.00 H new ATOM 0 HA ARG A 43 4.440 -23.685 4.704 1.00 0.00 H new ATOM 0 HB2 ARG A 43 3.935 -21.039 4.849 1.00 0.00 H new ATOM 0 HB3 ARG A 43 2.504 -21.586 5.699 1.00 0.00 H new ATOM 0 HG2 ARG A 43 4.022 -21.413 7.490 1.00 0.00 H new ATOM 0 HG3 ARG A 43 4.227 -23.101 7.066 1.00 0.00 H new ATOM 0 HD2 ARG A 43 6.097 -22.248 5.421 1.00 0.00 H new ATOM 0 HD3 ARG A 43 6.027 -20.753 6.333 1.00 0.00 H new ATOM 0 HE ARG A 43 6.296 -22.587 8.352 1.00 0.00 H new ATOM 0 HH11 ARG A 43 7.872 -22.128 5.251 1.00 0.00 H new ATOM 0 HH12 ARG A 43 9.423 -22.777 5.797 1.00 0.00 H new ATOM 0 HH21 ARG A 43 8.294 -23.400 9.048 1.00 0.00 H new ATOM 0 HH22 ARG A 43 9.659 -23.492 7.930 1.00 0.00 H new ATOM 713 N GLN A 44 1.283 -24.076 4.239 1.00 0.00 N ATOM 714 CA GLN A 44 0.135 -24.916 4.563 1.00 0.00 C ATOM 715 C GLN A 44 0.596 -26.355 4.807 1.00 0.00 C ATOM 716 O GLN A 44 0.043 -27.054 5.653 1.00 0.00 O ATOM 717 CB GLN A 44 -0.895 -24.867 3.406 1.00 0.00 C ATOM 718 CG GLN A 44 -2.101 -23.992 3.785 1.00 0.00 C ATOM 719 CD GLN A 44 -2.928 -24.697 4.851 1.00 0.00 C ATOM 720 OE1 GLN A 44 -3.317 -25.852 4.671 1.00 0.00 O ATOM 721 NE2 GLN A 44 -3.224 -24.069 5.954 1.00 0.00 N ATOM 0 H GLN A 44 1.177 -23.518 3.392 1.00 0.00 H new ATOM 0 HA GLN A 44 -0.340 -24.543 5.470 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -0.421 -24.471 2.508 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -1.232 -25.876 3.170 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -1.760 -23.025 4.155 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -2.713 -23.798 2.904 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -2.900 -23.113 6.099 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -3.780 -24.534 6.672 1.00 0.00 H new ATOM 730 N GLY A 45 1.614 -26.787 4.069 1.00 0.00 N ATOM 731 CA GLY A 45 2.131 -28.137 4.233 1.00 0.00 C ATOM 732 C GLY A 45 2.732 -28.300 5.618 1.00 0.00 C ATOM 733 O GLY A 45 2.433 -29.259 6.331 1.00 0.00 O ATOM 0 H GLY A 45 2.091 -26.229 3.361 1.00 0.00 H new ATOM 0 HA2 GLY A 45 1.330 -28.862 4.088 1.00 0.00 H new ATOM 0 HA3 GLY A 45 2.886 -28.340 3.474 1.00 0.00 H new ATOM 737 N LEU A 46 3.576 -27.350 5.999 1.00 0.00 N ATOM 738 CA LEU A 46 4.203 -27.391 7.306 1.00 0.00 C ATOM 739 C LEU A 46 3.163 -27.216 8.405 1.00 0.00 C ATOM 740 O LEU A 46 3.236 -27.859 9.450 1.00 0.00 O ATOM 741 CB LEU A 46 5.285 -26.308 7.424 1.00 0.00 C ATOM 742 CG LEU A 46 5.856 -26.285 8.858 1.00 0.00 C ATOM 743 CD1 LEU A 46 6.384 -27.675 9.249 1.00 0.00 C ATOM 744 CD2 LEU A 46 6.999 -25.271 8.927 1.00 0.00 C ATOM 0 H LEU A 46 3.838 -26.549 5.424 1.00 0.00 H new ATOM 0 HA LEU A 46 4.675 -28.366 7.424 1.00 0.00 H new ATOM 0 HB2 LEU A 46 6.084 -26.502 6.709 1.00 0.00 H new ATOM 0 HB3 LEU A 46 4.864 -25.334 7.176 1.00 0.00 H new ATOM 0 HG LEU A 46 5.063 -26.003 9.551 1.00 0.00 H new ATOM 0 HD11 LEU A 46 6.783 -27.641 10.263 1.00 0.00 H new ATOM 0 HD12 LEU A 46 5.571 -28.399 9.203 1.00 0.00 H new ATOM 0 HD13 LEU A 46 7.173 -27.972 8.558 1.00 0.00 H new ATOM 0 HD21 LEU A 46 7.406 -25.250 9.938 1.00 0.00 H new ATOM 0 HD22 LEU A 46 7.783 -25.558 8.226 1.00 0.00 H new ATOM 0 HD23 LEU A 46 6.624 -24.281 8.667 1.00 0.00 H new ATOM 756 N MET A 47 2.204 -26.330 8.164 1.00 0.00 N ATOM 757 CA MET A 47 1.162 -26.063 9.147 1.00 0.00 C ATOM 758 C MET A 47 0.498 -27.365 9.583 1.00 0.00 C ATOM 759 O MET A 47 0.255 -27.581 10.768 1.00 0.00 O ATOM 760 CB MET A 47 0.118 -25.121 8.545 1.00 0.00 C ATOM 761 CG MET A 47 -0.939 -24.775 9.594 1.00 0.00 C ATOM 762 SD MET A 47 -2.098 -23.568 8.901 1.00 0.00 S ATOM 763 CE MET A 47 -1.366 -22.083 9.633 1.00 0.00 C ATOM 0 H MET A 47 2.126 -25.788 7.303 1.00 0.00 H new ATOM 0 HA MET A 47 1.612 -25.593 10.021 1.00 0.00 H new ATOM 0 HB2 MET A 47 0.600 -24.211 8.188 1.00 0.00 H new ATOM 0 HB3 MET A 47 -0.354 -25.591 7.682 1.00 0.00 H new ATOM 0 HG2 MET A 47 -1.473 -25.675 9.900 1.00 0.00 H new ATOM 0 HG3 MET A 47 -0.463 -24.368 10.486 1.00 0.00 H new ATOM 0 HE1 MET A 47 -2.007 -21.224 9.431 1.00 0.00 H new ATOM 0 HE2 MET A 47 -1.269 -22.218 10.710 1.00 0.00 H new ATOM 0 HE3 MET A 47 -0.381 -21.911 9.199 1.00 0.00 H new ATOM 773 N HIS A 48 0.213 -28.235 8.623 1.00 0.00 N ATOM 774 CA HIS A 48 -0.409 -29.513 8.938 1.00 0.00 C ATOM 775 C HIS A 48 0.559 -30.400 9.721 1.00 0.00 C ATOM 776 O HIS A 48 0.185 -31.019 10.718 1.00 0.00 O ATOM 777 CB HIS A 48 -0.831 -30.219 7.651 1.00 0.00 C ATOM 778 CG HIS A 48 -1.476 -31.532 7.991 1.00 0.00 C ATOM 779 ND1 HIS A 48 -2.720 -31.611 8.598 1.00 0.00 N ATOM 780 CD2 HIS A 48 -1.061 -32.828 7.819 1.00 0.00 C ATOM 781 CE1 HIS A 48 -3.007 -32.915 8.766 1.00 0.00 C ATOM 782 NE2 HIS A 48 -2.029 -33.700 8.308 1.00 0.00 N ATOM 0 H HIS A 48 0.400 -28.082 7.632 1.00 0.00 H new ATOM 0 HA HIS A 48 -1.290 -29.328 9.552 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -1.527 -29.594 7.091 1.00 0.00 H new ATOM 0 HB3 HIS A 48 0.036 -30.382 7.011 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -0.124 -33.127 7.372 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -3.917 -33.282 9.216 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -1.998 -34.720 8.315 1.00 0.00 H new ATOM 790 N GLU A 49 1.806 -30.450 9.259 1.00 0.00 N ATOM 791 CA GLU A 49 2.833 -31.256 9.916 1.00 0.00 C ATOM 792 C GLU A 49 3.253 -30.623 11.236 1.00 0.00 C ATOM 793 O GLU A 49 3.803 -31.293 12.110 1.00 0.00 O ATOM 794 CB GLU A 49 4.054 -31.400 9.007 1.00 0.00 C ATOM 795 CG GLU A 49 3.680 -32.240 7.787 1.00 0.00 C ATOM 796 CD GLU A 49 4.865 -32.334 6.833 1.00 0.00 C ATOM 797 OE1 GLU A 49 5.900 -31.768 7.146 1.00 0.00 O ATOM 798 OE2 GLU A 49 4.721 -32.970 5.802 1.00 0.00 O ATOM 0 H GLU A 49 2.130 -29.944 8.435 1.00 0.00 H new ATOM 0 HA GLU A 49 2.413 -32.242 10.116 1.00 0.00 H new ATOM 0 HB2 GLU A 49 4.405 -30.417 8.692 1.00 0.00 H new ATOM 0 HB3 GLU A 49 4.873 -31.872 9.551 1.00 0.00 H new ATOM 0 HG2 GLU A 49 3.377 -33.238 8.102 1.00 0.00 H new ATOM 0 HG3 GLU A 49 2.826 -31.794 7.276 1.00 0.00 H new ATOM 805 N LEU A 50 3.001 -29.326 11.370 1.00 0.00 N ATOM 806 CA LEU A 50 3.367 -28.608 12.585 1.00 0.00 C ATOM 807 C LEU A 50 2.669 -29.228 13.786 1.00 0.00 C ATOM 808 O LEU A 50 3.253 -29.347 14.863 1.00 0.00 O ATOM 809 CB LEU A 50 2.975 -27.130 12.463 1.00 0.00 C ATOM 810 CG LEU A 50 3.337 -26.364 13.746 1.00 0.00 C ATOM 811 CD1 LEU A 50 4.834 -26.496 14.057 1.00 0.00 C ATOM 812 CD2 LEU A 50 2.978 -24.881 13.561 1.00 0.00 C ATOM 0 H LEU A 50 2.548 -28.753 10.658 1.00 0.00 H new ATOM 0 HA LEU A 50 4.446 -28.679 12.723 1.00 0.00 H new ATOM 0 HB2 LEU A 50 3.485 -26.682 11.610 1.00 0.00 H new ATOM 0 HB3 LEU A 50 1.905 -27.047 12.274 1.00 0.00 H new ATOM 0 HG LEU A 50 2.776 -26.786 14.580 1.00 0.00 H new ATOM 0 HD11 LEU A 50 5.066 -25.946 14.969 1.00 0.00 H new ATOM 0 HD12 LEU A 50 5.086 -27.548 14.194 1.00 0.00 H new ATOM 0 HD13 LEU A 50 5.415 -26.088 13.230 1.00 0.00 H new ATOM 0 HD21 LEU A 50 3.231 -24.330 14.466 1.00 0.00 H new ATOM 0 HD22 LEU A 50 3.538 -24.473 12.719 1.00 0.00 H new ATOM 0 HD23 LEU A 50 1.910 -24.787 13.366 1.00 0.00 H new ATOM 824 N MET A 51 1.417 -29.622 13.596 1.00 0.00 N ATOM 825 CA MET A 51 0.653 -30.229 14.675 1.00 0.00 C ATOM 826 C MET A 51 1.356 -31.489 15.174 1.00 0.00 C ATOM 827 O MET A 51 1.426 -31.737 16.378 1.00 0.00 O ATOM 828 CB MET A 51 -0.752 -30.579 14.177 1.00 0.00 C ATOM 829 CG MET A 51 -1.578 -31.153 15.328 1.00 0.00 C ATOM 830 SD MET A 51 -3.257 -31.505 14.753 1.00 0.00 S ATOM 831 CE MET A 51 -3.822 -32.380 16.231 1.00 0.00 C ATOM 0 H MET A 51 0.914 -29.533 12.713 1.00 0.00 H new ATOM 0 HA MET A 51 0.577 -29.520 15.499 1.00 0.00 H new ATOM 0 HB2 MET A 51 -1.238 -29.690 13.776 1.00 0.00 H new ATOM 0 HB3 MET A 51 -0.691 -31.303 13.364 1.00 0.00 H new ATOM 0 HG2 MET A 51 -1.113 -32.064 15.704 1.00 0.00 H new ATOM 0 HG3 MET A 51 -1.607 -30.445 16.156 1.00 0.00 H new ATOM 0 HE1 MET A 51 -4.856 -32.695 16.094 1.00 0.00 H new ATOM 0 HE2 MET A 51 -3.195 -33.256 16.397 1.00 0.00 H new ATOM 0 HE3 MET A 51 -3.756 -31.717 17.094 1.00 0.00 H new ATOM 841 N GLU A 52 1.878 -32.279 14.243 1.00 0.00 N ATOM 842 CA GLU A 52 2.576 -33.508 14.602 1.00 0.00 C ATOM 843 C GLU A 52 3.887 -33.195 15.316 1.00 0.00 C ATOM 844 O GLU A 52 4.253 -33.861 16.285 1.00 0.00 O ATOM 845 CB GLU A 52 2.868 -34.324 13.342 1.00 0.00 C ATOM 846 CG GLU A 52 1.554 -34.796 12.716 1.00 0.00 C ATOM 847 CD GLU A 52 0.858 -35.790 13.640 1.00 0.00 C ATOM 848 OE1 GLU A 52 1.496 -36.754 14.027 1.00 0.00 O ATOM 849 OE2 GLU A 52 -0.303 -35.573 13.945 1.00 0.00 O ATOM 0 H GLU A 52 1.832 -32.093 13.241 1.00 0.00 H new ATOM 0 HA GLU A 52 1.938 -34.082 15.274 1.00 0.00 H new ATOM 0 HB2 GLU A 52 3.426 -33.719 12.627 1.00 0.00 H new ATOM 0 HB3 GLU A 52 3.493 -35.182 13.590 1.00 0.00 H new ATOM 0 HG2 GLU A 52 0.903 -33.942 12.532 1.00 0.00 H new ATOM 0 HG3 GLU A 52 1.749 -35.262 11.750 1.00 0.00 H new ATOM 856 N LEU A 53 4.595 -32.183 14.827 1.00 0.00 N ATOM 857 CA LEU A 53 5.868 -31.794 15.420 1.00 0.00 C ATOM 858 C LEU A 53 5.662 -31.312 16.851 1.00 0.00 C ATOM 859 O LEU A 53 6.454 -31.624 17.740 1.00 0.00 O ATOM 860 CB LEU A 53 6.516 -30.681 14.592 1.00 0.00 C ATOM 861 CG LEU A 53 6.914 -31.218 13.207 1.00 0.00 C ATOM 862 CD1 LEU A 53 7.400 -30.057 12.332 1.00 0.00 C ATOM 863 CD2 LEU A 53 8.031 -32.273 13.338 1.00 0.00 C ATOM 0 H LEU A 53 4.311 -31.620 14.026 1.00 0.00 H new ATOM 0 HA LEU A 53 6.524 -32.664 15.430 1.00 0.00 H new ATOM 0 HB2 LEU A 53 5.822 -29.848 14.482 1.00 0.00 H new ATOM 0 HB3 LEU A 53 7.396 -30.297 15.109 1.00 0.00 H new ATOM 0 HG LEU A 53 6.045 -31.687 12.746 1.00 0.00 H new ATOM 0 HD11 LEU A 53 7.683 -30.435 11.350 1.00 0.00 H new ATOM 0 HD12 LEU A 53 6.600 -29.324 12.222 1.00 0.00 H new ATOM 0 HD13 LEU A 53 8.263 -29.584 12.801 1.00 0.00 H new ATOM 0 HD21 LEU A 53 8.300 -32.642 12.349 1.00 0.00 H new ATOM 0 HD22 LEU A 53 8.905 -31.821 13.807 1.00 0.00 H new ATOM 0 HD23 LEU A 53 7.678 -33.102 13.951 1.00 0.00 H new ATOM 875 N ILE A 54 4.598 -30.547 17.068 1.00 0.00 N ATOM 876 CA ILE A 54 4.313 -30.032 18.397 1.00 0.00 C ATOM 877 C ILE A 54 3.985 -31.183 19.350 1.00 0.00 C ATOM 878 O ILE A 54 4.175 -31.072 20.561 1.00 0.00 O ATOM 879 CB ILE A 54 3.142 -29.043 18.337 1.00 0.00 C ATOM 880 CG1 ILE A 54 3.549 -27.776 17.561 1.00 0.00 C ATOM 881 CG2 ILE A 54 2.706 -28.667 19.753 1.00 0.00 C ATOM 882 CD1 ILE A 54 4.394 -26.821 18.426 1.00 0.00 C ATOM 0 H ILE A 54 3.928 -30.274 16.349 1.00 0.00 H new ATOM 0 HA ILE A 54 5.195 -29.511 18.770 1.00 0.00 H new ATOM 0 HB ILE A 54 2.309 -29.518 17.819 1.00 0.00 H new ATOM 0 HG12 ILE A 54 4.115 -28.060 16.674 1.00 0.00 H new ATOM 0 HG13 ILE A 54 2.654 -27.258 17.216 1.00 0.00 H new ATOM 0 HG21 ILE A 54 1.874 -27.964 19.703 1.00 0.00 H new ATOM 0 HG22 ILE A 54 2.392 -29.564 20.287 1.00 0.00 H new ATOM 0 HG23 ILE A 54 3.541 -28.204 20.280 1.00 0.00 H new ATOM 0 HD11 ILE A 54 4.660 -25.940 17.842 1.00 0.00 H new ATOM 0 HD12 ILE A 54 3.818 -26.516 19.300 1.00 0.00 H new ATOM 0 HD13 ILE A 54 5.302 -27.330 18.749 1.00 0.00 H new ATOM 894 N ASP A 55 3.501 -32.287 18.795 1.00 0.00 N ATOM 895 CA ASP A 55 3.162 -33.452 19.600 1.00 0.00 C ATOM 896 C ASP A 55 4.419 -34.084 20.181 1.00 0.00 C ATOM 897 O ASP A 55 4.402 -34.632 21.282 1.00 0.00 O ATOM 898 CB ASP A 55 2.407 -34.475 18.751 1.00 0.00 C ATOM 899 CG ASP A 55 1.773 -35.529 19.650 1.00 0.00 C ATOM 900 OD1 ASP A 55 1.651 -35.274 20.837 1.00 0.00 O ATOM 901 OD2 ASP A 55 1.415 -36.577 19.139 1.00 0.00 O ATOM 0 H ASP A 55 3.335 -32.399 17.795 1.00 0.00 H new ATOM 0 HA ASP A 55 2.523 -33.130 20.422 1.00 0.00 H new ATOM 0 HB2 ASP A 55 1.637 -33.975 18.163 1.00 0.00 H new ATOM 0 HB3 ASP A 55 3.089 -34.949 18.045 1.00 0.00 H new ATOM 906 N LEU A 56 5.504 -34.014 19.422 1.00 0.00 N ATOM 907 CA LEU A 56 6.765 -34.592 19.858 1.00 0.00 C ATOM 908 C LEU A 56 7.276 -33.902 21.118 1.00 0.00 C ATOM 909 O LEU A 56 7.804 -34.557 22.010 1.00 0.00 O ATOM 910 CB LEU A 56 7.806 -34.464 18.746 1.00 0.00 C ATOM 911 CG LEU A 56 7.388 -35.316 17.542 1.00 0.00 C ATOM 912 CD1 LEU A 56 8.331 -35.016 16.375 1.00 0.00 C ATOM 913 CD2 LEU A 56 7.446 -36.818 17.893 1.00 0.00 C ATOM 0 H LEU A 56 5.536 -33.565 18.507 1.00 0.00 H new ATOM 0 HA LEU A 56 6.597 -35.645 20.085 1.00 0.00 H new ATOM 0 HB2 LEU A 56 7.906 -33.420 18.447 1.00 0.00 H new ATOM 0 HB3 LEU A 56 8.782 -34.786 19.110 1.00 0.00 H new ATOM 0 HG LEU A 56 6.363 -35.071 17.265 1.00 0.00 H new ATOM 0 HD11 LEU A 56 8.044 -35.616 15.512 1.00 0.00 H new ATOM 0 HD12 LEU A 56 8.268 -33.958 16.119 1.00 0.00 H new ATOM 0 HD13 LEU A 56 9.354 -35.259 16.662 1.00 0.00 H new ATOM 0 HD21 LEU A 56 7.146 -37.406 17.026 1.00 0.00 H new ATOM 0 HD22 LEU A 56 8.463 -37.086 18.179 1.00 0.00 H new ATOM 0 HD23 LEU A 56 6.770 -37.024 18.723 1.00 0.00 H new ATOM 925 N TYR A 57 7.135 -32.580 21.175 1.00 0.00 N ATOM 926 CA TYR A 57 7.593 -31.813 22.332 1.00 0.00 C ATOM 927 C TYR A 57 6.522 -31.760 23.421 1.00 0.00 C ATOM 928 O TYR A 57 6.816 -31.968 24.596 1.00 0.00 O ATOM 929 CB TYR A 57 7.954 -30.392 21.900 1.00 0.00 C ATOM 930 CG TYR A 57 9.152 -30.443 20.990 1.00 0.00 C ATOM 931 CD1 TYR A 57 10.441 -30.466 21.534 1.00 0.00 C ATOM 932 CD2 TYR A 57 8.975 -30.471 19.603 1.00 0.00 C ATOM 933 CE1 TYR A 57 11.555 -30.516 20.689 1.00 0.00 C ATOM 934 CE2 TYR A 57 10.089 -30.519 18.758 1.00 0.00 C ATOM 935 CZ TYR A 57 11.379 -30.542 19.302 1.00 0.00 C ATOM 936 OH TYR A 57 12.478 -30.587 18.469 1.00 0.00 O ATOM 0 H TYR A 57 6.709 -32.019 20.437 1.00 0.00 H new ATOM 0 HA TYR A 57 8.473 -32.310 22.741 1.00 0.00 H new ATOM 0 HB2 TYR A 57 7.111 -29.930 21.386 1.00 0.00 H new ATOM 0 HB3 TYR A 57 8.171 -29.777 22.773 1.00 0.00 H new ATOM 0 HD1 TYR A 57 10.576 -30.445 22.605 1.00 0.00 H new ATOM 0 HD2 TYR A 57 7.979 -30.456 19.185 1.00 0.00 H new ATOM 0 HE1 TYR A 57 12.550 -30.535 21.108 1.00 0.00 H new ATOM 0 HE2 TYR A 57 9.954 -30.538 17.687 1.00 0.00 H new ATOM 0 HH TYR A 57 12.180 -30.601 17.535 1.00 0.00 H new ATOM 946 N GLU A 58 5.279 -31.484 23.023 1.00 0.00 N ATOM 947 CA GLU A 58 4.171 -31.398 23.979 1.00 0.00 C ATOM 948 C GLU A 58 4.263 -32.506 25.018 1.00 0.00 C ATOM 949 O GLU A 58 3.662 -32.417 26.080 1.00 0.00 O ATOM 950 CB GLU A 58 2.810 -31.462 23.248 1.00 0.00 C ATOM 951 CG GLU A 58 2.320 -30.050 22.900 1.00 0.00 C ATOM 952 CD GLU A 58 1.956 -29.304 24.177 1.00 0.00 C ATOM 953 OE1 GLU A 58 0.981 -29.688 24.805 1.00 0.00 O ATOM 954 OE2 GLU A 58 2.666 -28.375 24.520 1.00 0.00 O ATOM 0 H GLU A 58 5.014 -31.317 22.052 1.00 0.00 H new ATOM 0 HA GLU A 58 4.245 -30.439 24.491 1.00 0.00 H new ATOM 0 HB2 GLU A 58 2.907 -32.054 22.338 1.00 0.00 H new ATOM 0 HB3 GLU A 58 2.075 -31.963 23.878 1.00 0.00 H new ATOM 0 HG2 GLU A 58 3.096 -29.508 22.359 1.00 0.00 H new ATOM 0 HG3 GLU A 58 1.454 -30.107 22.241 1.00 0.00 H new ATOM 961 N GLU A 59 4.995 -33.556 24.709 1.00 0.00 N ATOM 962 CA GLU A 59 5.135 -34.656 25.650 1.00 0.00 C ATOM 963 C GLU A 59 6.115 -34.288 26.775 1.00 0.00 C ATOM 964 O GLU A 59 5.820 -34.486 27.954 1.00 0.00 O ATOM 965 CB GLU A 59 5.609 -35.904 24.898 1.00 0.00 C ATOM 966 CG GLU A 59 7.064 -35.726 24.433 1.00 0.00 C ATOM 967 CD GLU A 59 8.041 -36.144 25.528 1.00 0.00 C ATOM 968 OE1 GLU A 59 7.590 -36.443 26.621 1.00 0.00 O ATOM 969 OE2 GLU A 59 9.230 -36.162 25.252 1.00 0.00 O ATOM 0 H GLU A 59 5.497 -33.674 23.829 1.00 0.00 H new ATOM 0 HA GLU A 59 4.169 -34.862 26.111 1.00 0.00 H new ATOM 0 HB2 GLU A 59 5.531 -36.778 25.545 1.00 0.00 H new ATOM 0 HB3 GLU A 59 4.965 -36.085 24.038 1.00 0.00 H new ATOM 0 HG2 GLU A 59 7.239 -36.322 23.537 1.00 0.00 H new ATOM 0 HG3 GLU A 59 7.239 -34.685 24.162 1.00 0.00 H new ATOM 976 N SER A 60 7.285 -33.759 26.396 1.00 0.00 N ATOM 977 CA SER A 60 8.323 -33.369 27.359 1.00 0.00 C ATOM 978 C SER A 60 8.260 -31.875 27.706 1.00 0.00 C ATOM 979 O SER A 60 8.852 -31.436 28.693 1.00 0.00 O ATOM 980 CB SER A 60 9.701 -33.697 26.766 1.00 0.00 C ATOM 981 OG SER A 60 10.674 -32.820 27.316 1.00 0.00 O ATOM 0 H SER A 60 7.538 -33.590 25.422 1.00 0.00 H new ATOM 0 HA SER A 60 8.154 -33.927 28.280 1.00 0.00 H new ATOM 0 HB2 SER A 60 9.965 -34.732 26.983 1.00 0.00 H new ATOM 0 HB3 SER A 60 9.676 -33.595 25.681 1.00 0.00 H new ATOM 0 HG SER A 60 11.554 -33.030 26.939 1.00 0.00 H new ATOM 987 N GLN A 61 7.575 -31.094 26.874 1.00 0.00 N ATOM 988 CA GLN A 61 7.473 -29.643 27.080 1.00 0.00 C ATOM 989 C GLN A 61 6.711 -29.311 28.368 1.00 0.00 C ATOM 990 O GLN A 61 7.095 -28.405 29.104 1.00 0.00 O ATOM 991 CB GLN A 61 6.771 -28.988 25.864 1.00 0.00 C ATOM 992 CG GLN A 61 7.597 -27.818 25.321 1.00 0.00 C ATOM 993 CD GLN A 61 6.759 -27.019 24.338 1.00 0.00 C ATOM 994 OE1 GLN A 61 5.969 -27.591 23.588 1.00 0.00 O ATOM 995 NE2 GLN A 61 6.877 -25.722 24.298 1.00 0.00 N ATOM 0 H GLN A 61 7.081 -31.437 26.050 1.00 0.00 H new ATOM 0 HA GLN A 61 8.483 -29.244 27.177 1.00 0.00 H new ATOM 0 HB2 GLN A 61 6.626 -29.731 25.080 1.00 0.00 H new ATOM 0 HB3 GLN A 61 5.782 -28.635 26.156 1.00 0.00 H new ATOM 0 HG2 GLN A 61 7.924 -27.178 26.141 1.00 0.00 H new ATOM 0 HG3 GLN A 61 8.496 -28.191 24.830 1.00 0.00 H new ATOM 0 HE21 GLN A 61 7.533 -25.250 24.921 1.00 0.00 H new ATOM 0 HE22 GLN A 61 6.314 -25.179 23.644 1.00 0.00 H new ATOM 1004 N PRO A 62 5.656 -30.024 28.655 1.00 0.00 N ATOM 1005 CA PRO A 62 4.846 -29.803 29.871 1.00 0.00 C ATOM 1006 C PRO A 62 5.138 -30.842 30.952 1.00 0.00 C ATOM 1007 O PRO A 62 4.527 -31.910 31.013 1.00 0.00 O ATOM 1008 CB PRO A 62 3.416 -29.981 29.332 1.00 0.00 C ATOM 1009 CG PRO A 62 3.553 -30.910 28.138 1.00 0.00 C ATOM 1010 CD PRO A 62 5.063 -31.072 27.839 1.00 0.00 C ATOM 0 HA PRO A 62 5.040 -28.841 30.345 1.00 0.00 H new ATOM 0 HB2 PRO A 62 2.760 -30.408 30.090 1.00 0.00 H new ATOM 0 HB3 PRO A 62 2.984 -29.024 29.039 1.00 0.00 H new ATOM 0 HG2 PRO A 62 3.100 -31.878 28.352 1.00 0.00 H new ATOM 0 HG3 PRO A 62 3.034 -30.499 27.272 1.00 0.00 H new ATOM 0 HD2 PRO A 62 5.429 -32.060 28.118 1.00 0.00 H new ATOM 0 HD3 PRO A 62 5.284 -30.937 26.780 1.00 0.00 H new ATOM 1018 N SER A 63 6.087 -30.478 31.806 1.00 0.00 N ATOM 1019 CA SER A 63 6.503 -31.319 32.917 1.00 0.00 C ATOM 1020 C SER A 63 5.596 -31.075 34.121 1.00 0.00 C ATOM 1021 O SER A 63 5.611 -31.835 35.088 1.00 0.00 O ATOM 1022 CB SER A 63 7.950 -30.991 33.294 1.00 0.00 C ATOM 1023 OG SER A 63 8.803 -31.294 32.198 1.00 0.00 O ATOM 0 H SER A 63 6.588 -29.592 31.746 1.00 0.00 H new ATOM 0 HA SER A 63 6.431 -32.365 32.620 1.00 0.00 H new ATOM 0 HB2 SER A 63 8.039 -29.937 33.558 1.00 0.00 H new ATOM 0 HB3 SER A 63 8.248 -31.565 34.171 1.00 0.00 H new ATOM 0 HG SER A 63 9.730 -31.083 32.437 1.00 0.00 H new ATOM 1029 N SER A 64 4.811 -29.994 34.056 1.00 0.00 N ATOM 1030 CA SER A 64 3.893 -29.630 35.143 1.00 0.00 C ATOM 1031 C SER A 64 2.439 -29.728 34.680 1.00 0.00 C ATOM 1032 O SER A 64 1.573 -29.012 35.181 1.00 0.00 O ATOM 1033 CB SER A 64 4.189 -28.208 35.632 1.00 0.00 C ATOM 1034 OG SER A 64 3.103 -27.748 36.429 1.00 0.00 O ATOM 0 H SER A 64 4.792 -29.355 33.261 1.00 0.00 H new ATOM 0 HA SER A 64 4.044 -30.330 35.965 1.00 0.00 H new ATOM 0 HB2 SER A 64 5.112 -28.196 36.212 1.00 0.00 H new ATOM 0 HB3 SER A 64 4.338 -27.543 34.782 1.00 0.00 H new ATOM 0 HG SER A 64 2.263 -27.873 35.940 1.00 0.00 H new ATOM 1040 N GLU A 65 2.186 -30.613 33.715 1.00 0.00 N ATOM 1041 CA GLU A 65 0.836 -30.806 33.180 1.00 0.00 C ATOM 1042 C GLU A 65 0.306 -29.510 32.580 1.00 0.00 C ATOM 1043 O GLU A 65 -0.893 -29.239 32.614 1.00 0.00 O ATOM 1044 CB GLU A 65 -0.114 -31.278 34.280 1.00 0.00 C ATOM 1045 CG GLU A 65 0.284 -32.685 34.733 1.00 0.00 C ATOM 1046 CD GLU A 65 -0.602 -33.132 35.890 1.00 0.00 C ATOM 1047 OE1 GLU A 65 -1.470 -32.367 36.276 1.00 0.00 O ATOM 1048 OE2 GLU A 65 -0.399 -34.234 36.374 1.00 0.00 O ATOM 0 H GLU A 65 2.897 -31.207 33.288 1.00 0.00 H new ATOM 0 HA GLU A 65 0.890 -31.566 32.400 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -0.079 -30.590 35.124 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -1.140 -31.280 33.912 1.00 0.00 H new ATOM 0 HG2 GLU A 65 0.190 -33.384 33.902 1.00 0.00 H new ATOM 0 HG3 GLU A 65 1.330 -32.694 35.041 1.00 0.00 H new ATOM 1055 N ARG A 66 1.215 -28.717 32.035 1.00 0.00 N ATOM 1056 CA ARG A 66 0.853 -27.444 31.426 1.00 0.00 C ATOM 1057 C ARG A 66 0.291 -27.650 30.027 1.00 0.00 C ATOM 1058 O ARG A 66 -0.293 -26.736 29.447 1.00 0.00 O ATOM 1059 CB ARG A 66 2.079 -26.536 31.363 1.00 0.00 C ATOM 1060 CG ARG A 66 2.601 -26.252 32.778 1.00 0.00 C ATOM 1061 CD ARG A 66 1.765 -25.157 33.451 1.00 0.00 C ATOM 1062 NE ARG A 66 2.349 -24.803 34.738 1.00 0.00 N ATOM 1063 CZ ARG A 66 1.791 -23.881 35.512 1.00 0.00 C ATOM 1064 NH1 ARG A 66 0.713 -23.267 35.112 1.00 0.00 N ATOM 1065 NH2 ARG A 66 2.321 -23.589 36.669 1.00 0.00 N ATOM 0 H ARG A 66 2.212 -28.932 32.001 1.00 0.00 H new ATOM 0 HA ARG A 66 0.083 -26.976 32.039 1.00 0.00 H new ATOM 0 HB2 ARG A 66 2.860 -27.008 30.767 1.00 0.00 H new ATOM 0 HB3 ARG A 66 1.822 -25.600 30.867 1.00 0.00 H new ATOM 0 HG2 ARG A 66 2.565 -27.163 33.375 1.00 0.00 H new ATOM 0 HG3 ARG A 66 3.645 -25.943 32.731 1.00 0.00 H new ATOM 0 HD2 ARG A 66 1.719 -24.277 32.809 1.00 0.00 H new ATOM 0 HD3 ARG A 66 0.741 -25.504 33.590 1.00 0.00 H new ATOM 0 HE ARG A 66 3.200 -25.271 35.049 1.00 0.00 H new ATOM 0 HH11 ARG A 66 0.302 -23.496 34.207 1.00 0.00 H new ATOM 0 HH12 ARG A 66 0.281 -22.558 35.704 1.00 0.00 H new ATOM 0 HH21 ARG A 66 3.165 -24.070 36.979 1.00 0.00 H new ATOM 0 HH22 ARG A 66 1.891 -22.880 37.263 1.00 0.00 H new ATOM 1079 N LEU A 67 0.479 -28.848 29.482 1.00 0.00 N ATOM 1080 CA LEU A 67 -0.011 -29.151 28.140 1.00 0.00 C ATOM 1081 C LEU A 67 -1.404 -28.564 27.935 1.00 0.00 C ATOM 1082 O LEU A 67 -1.836 -28.347 26.804 1.00 0.00 O ATOM 1083 CB LEU A 67 -0.069 -30.669 27.934 1.00 0.00 C ATOM 1084 CG LEU A 67 -0.846 -31.345 29.103 1.00 0.00 C ATOM 1085 CD1 LEU A 67 -2.134 -31.991 28.578 1.00 0.00 C ATOM 1086 CD2 LEU A 67 0.030 -32.426 29.759 1.00 0.00 C ATOM 0 H LEU A 67 0.962 -29.619 29.943 1.00 0.00 H new ATOM 0 HA LEU A 67 0.674 -28.708 27.417 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -0.556 -30.896 26.986 1.00 0.00 H new ATOM 0 HB3 LEU A 67 0.941 -31.074 27.878 1.00 0.00 H new ATOM 0 HG LEU A 67 -1.098 -30.582 29.839 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -2.669 -32.460 29.404 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -2.766 -31.227 28.124 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -1.885 -32.746 27.832 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -0.520 -32.894 30.575 1.00 0.00 H new ATOM 0 HD22 LEU A 67 0.292 -33.181 29.018 1.00 0.00 H new ATOM 0 HD23 LEU A 67 0.940 -31.970 30.149 1.00 0.00 H new ATOM 1098 N ASN A 68 -2.096 -28.299 29.038 1.00 0.00 N ATOM 1099 CA ASN A 68 -3.435 -27.730 28.966 1.00 0.00 C ATOM 1100 C ASN A 68 -3.389 -26.377 28.268 1.00 0.00 C ATOM 1101 O ASN A 68 -4.246 -26.063 27.444 1.00 0.00 O ATOM 1102 CB ASN A 68 -4.007 -27.565 30.375 1.00 0.00 C ATOM 1103 CG ASN A 68 -5.367 -26.879 30.309 1.00 0.00 C ATOM 1104 OD1 ASN A 68 -5.442 -25.651 30.277 1.00 0.00 O ATOM 1105 ND2 ASN A 68 -6.452 -27.602 30.285 1.00 0.00 N ATOM 0 H ASN A 68 -1.755 -28.468 29.984 1.00 0.00 H new ATOM 0 HA ASN A 68 -4.075 -28.404 28.396 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -4.105 -28.540 30.853 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -3.323 -26.977 30.987 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -7.365 -27.150 30.240 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -6.387 -28.620 30.312 1.00 0.00 H new ATOM 1112 N ALA A 69 -2.377 -25.582 28.595 1.00 0.00 N ATOM 1113 CA ALA A 69 -2.224 -24.272 27.977 1.00 0.00 C ATOM 1114 C ALA A 69 -1.810 -24.424 26.514 1.00 0.00 C ATOM 1115 O ALA A 69 -2.281 -23.692 25.644 1.00 0.00 O ATOM 1116 CB ALA A 69 -1.172 -23.456 28.730 1.00 0.00 C ATOM 0 H ALA A 69 -1.657 -25.819 29.278 1.00 0.00 H new ATOM 0 HA ALA A 69 -3.180 -23.751 28.023 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -1.065 -22.478 28.260 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -1.484 -23.328 29.767 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -0.216 -23.979 28.701 1.00 0.00 H new ATOM 1122 N PHE A 70 -0.923 -25.385 26.256 1.00 0.00 N ATOM 1123 CA PHE A 70 -0.443 -25.637 24.899 1.00 0.00 C ATOM 1124 C PHE A 70 -1.562 -26.178 24.019 1.00 0.00 C ATOM 1125 O PHE A 70 -1.631 -25.872 22.828 1.00 0.00 O ATOM 1126 CB PHE A 70 0.709 -26.634 24.923 1.00 0.00 C ATOM 1127 CG PHE A 70 1.917 -26.000 25.573 1.00 0.00 C ATOM 1128 CD1 PHE A 70 2.066 -26.032 26.966 1.00 0.00 C ATOM 1129 CD2 PHE A 70 2.888 -25.377 24.781 1.00 0.00 C ATOM 1130 CE1 PHE A 70 3.186 -25.442 27.564 1.00 0.00 C ATOM 1131 CE2 PHE A 70 4.007 -24.788 25.379 1.00 0.00 C ATOM 1132 CZ PHE A 70 4.157 -24.821 26.770 1.00 0.00 C ATOM 0 H PHE A 70 -0.524 -25.999 26.966 1.00 0.00 H new ATOM 0 HA PHE A 70 -0.096 -24.691 24.485 1.00 0.00 H new ATOM 0 HB2 PHE A 70 0.417 -27.529 25.472 1.00 0.00 H new ATOM 0 HB3 PHE A 70 0.953 -26.948 23.908 1.00 0.00 H new ATOM 0 HD1 PHE A 70 1.317 -26.512 27.578 1.00 0.00 H new ATOM 0 HD2 PHE A 70 2.773 -25.351 23.707 1.00 0.00 H new ATOM 0 HE1 PHE A 70 3.301 -25.466 28.638 1.00 0.00 H new ATOM 0 HE2 PHE A 70 4.756 -24.307 24.767 1.00 0.00 H new ATOM 0 HZ PHE A 70 5.022 -24.367 27.231 1.00 0.00 H new ATOM 1142 N ARG A 71 -2.437 -26.986 24.612 1.00 0.00 N ATOM 1143 CA ARG A 71 -3.550 -27.567 23.871 1.00 0.00 C ATOM 1144 C ARG A 71 -4.241 -26.486 23.048 1.00 0.00 C ATOM 1145 O ARG A 71 -4.920 -26.778 22.064 1.00 0.00 O ATOM 1146 CB ARG A 71 -4.548 -28.208 24.853 1.00 0.00 C ATOM 1147 CG ARG A 71 -4.085 -29.625 25.245 1.00 0.00 C ATOM 1148 CD ARG A 71 -4.587 -30.646 24.220 1.00 0.00 C ATOM 1149 NE ARG A 71 -4.213 -31.992 24.631 1.00 0.00 N ATOM 1150 CZ ARG A 71 -4.322 -33.014 23.794 1.00 0.00 C ATOM 1151 NH1 ARG A 71 -4.785 -32.819 22.591 1.00 0.00 N ATOM 1152 NH2 ARG A 71 -3.968 -34.212 24.174 1.00 0.00 N ATOM 0 H ARG A 71 -2.397 -27.251 25.596 1.00 0.00 H new ATOM 0 HA ARG A 71 -3.174 -28.336 23.197 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -4.638 -27.589 25.745 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -5.537 -28.255 24.397 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -2.997 -29.658 25.300 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -4.462 -29.878 26.236 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -5.670 -30.574 24.124 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -4.165 -30.426 23.239 1.00 0.00 H new ATOM 0 HE ARG A 71 -3.862 -32.150 25.576 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -5.062 -31.882 22.297 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -4.870 -33.603 21.944 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -3.607 -34.362 25.116 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -4.052 -34.997 23.529 1.00 0.00 H new ATOM 1166 N GLU A 72 -4.045 -25.234 23.445 1.00 0.00 N ATOM 1167 CA GLU A 72 -4.637 -24.122 22.718 1.00 0.00 C ATOM 1168 C GLU A 72 -4.011 -24.031 21.331 1.00 0.00 C ATOM 1169 O GLU A 72 -4.702 -23.791 20.341 1.00 0.00 O ATOM 1170 CB GLU A 72 -4.413 -22.815 23.478 1.00 0.00 C ATOM 1171 CG GLU A 72 -5.231 -22.835 24.768 1.00 0.00 C ATOM 1172 CD GLU A 72 -4.965 -21.567 25.572 1.00 0.00 C ATOM 1173 OE1 GLU A 72 -4.192 -20.746 25.107 1.00 0.00 O ATOM 1174 OE2 GLU A 72 -5.540 -21.434 26.639 1.00 0.00 O ATOM 0 H GLU A 72 -3.487 -24.967 24.256 1.00 0.00 H new ATOM 0 HA GLU A 72 -5.710 -24.289 22.621 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -3.355 -22.691 23.707 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -4.707 -21.967 22.860 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -6.293 -22.911 24.534 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -4.971 -23.712 25.360 1.00 0.00 H new ATOM 1181 N LEU A 73 -2.699 -24.241 21.267 1.00 0.00 N ATOM 1182 CA LEU A 73 -1.990 -24.197 19.994 1.00 0.00 C ATOM 1183 C LEU A 73 -2.494 -25.298 19.072 1.00 0.00 C ATOM 1184 O LEU A 73 -2.727 -25.073 17.889 1.00 0.00 O ATOM 1185 CB LEU A 73 -0.486 -24.368 20.227 1.00 0.00 C ATOM 1186 CG LEU A 73 0.253 -24.466 18.882 1.00 0.00 C ATOM 1187 CD1 LEU A 73 -0.061 -23.244 18.005 1.00 0.00 C ATOM 1188 CD2 LEU A 73 1.755 -24.538 19.146 1.00 0.00 C ATOM 0 H LEU A 73 -2.110 -24.442 22.075 1.00 0.00 H new ATOM 0 HA LEU A 73 -2.174 -23.230 19.525 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -0.101 -23.525 20.801 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -0.302 -25.266 20.817 1.00 0.00 H new ATOM 0 HG LEU A 73 -0.077 -25.362 18.356 1.00 0.00 H new ATOM 0 HD11 LEU A 73 0.470 -23.330 17.057 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -1.134 -23.197 17.817 1.00 0.00 H new ATOM 0 HD13 LEU A 73 0.257 -22.336 18.518 1.00 0.00 H new ATOM 0 HD21 LEU A 73 2.288 -24.608 18.198 1.00 0.00 H new ATOM 0 HD22 LEU A 73 2.075 -23.641 19.677 1.00 0.00 H new ATOM 0 HD23 LEU A 73 1.976 -25.417 19.752 1.00 0.00 H new ATOM 1200 N ARG A 74 -2.668 -26.487 19.628 1.00 0.00 N ATOM 1201 CA ARG A 74 -3.149 -27.620 18.852 1.00 0.00 C ATOM 1202 C ARG A 74 -4.457 -27.257 18.171 1.00 0.00 C ATOM 1203 O ARG A 74 -4.682 -27.592 17.008 1.00 0.00 O ATOM 1204 CB ARG A 74 -3.366 -28.821 19.774 1.00 0.00 C ATOM 1205 CG ARG A 74 -2.017 -29.393 20.234 1.00 0.00 C ATOM 1206 CD ARG A 74 -1.302 -30.102 19.071 1.00 0.00 C ATOM 1207 NE ARG A 74 -0.450 -31.165 19.590 1.00 0.00 N ATOM 1208 CZ ARG A 74 -0.975 -32.325 19.979 1.00 0.00 C ATOM 1209 NH1 ARG A 74 -2.262 -32.508 19.907 1.00 0.00 N ATOM 1210 NH2 ARG A 74 -0.206 -33.276 20.436 1.00 0.00 N ATOM 0 H ARG A 74 -2.484 -26.692 20.610 1.00 0.00 H new ATOM 0 HA ARG A 74 -2.408 -27.876 18.095 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -3.955 -28.521 20.640 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -3.935 -29.590 19.252 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -1.388 -28.590 20.619 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -2.174 -30.095 21.053 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -2.036 -30.516 18.379 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -0.703 -29.385 18.509 1.00 0.00 H new ATOM 0 HE ARG A 74 0.557 -31.019 19.656 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -2.864 -31.764 19.554 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -2.668 -33.395 20.204 1.00 0.00 H new ATOM 0 HH21 ARG A 74 0.802 -33.132 20.496 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -0.613 -34.163 20.733 1.00 0.00 H new ATOM 1224 N THR A 75 -5.311 -26.560 18.900 1.00 0.00 N ATOM 1225 CA THR A 75 -6.586 -26.145 18.357 1.00 0.00 C ATOM 1226 C THR A 75 -6.386 -25.201 17.174 1.00 0.00 C ATOM 1227 O THR A 75 -7.048 -25.332 16.143 1.00 0.00 O ATOM 1228 CB THR A 75 -7.400 -25.452 19.430 1.00 0.00 C ATOM 1229 OG1 THR A 75 -7.659 -26.359 20.493 1.00 0.00 O ATOM 1230 CG2 THR A 75 -8.714 -24.968 18.831 1.00 0.00 C ATOM 0 H THR A 75 -5.143 -26.272 19.864 1.00 0.00 H new ATOM 0 HA THR A 75 -7.119 -27.030 18.010 1.00 0.00 H new ATOM 0 HB THR A 75 -6.843 -24.599 19.818 1.00 0.00 H new ATOM 0 HG1 THR A 75 -6.834 -26.514 20.999 1.00 0.00 H new ATOM 0 HG21 THR A 75 -9.303 -24.469 19.601 1.00 0.00 H new ATOM 0 HG22 THR A 75 -8.509 -24.269 18.020 1.00 0.00 H new ATOM 0 HG23 THR A 75 -9.272 -25.820 18.443 1.00 0.00 H new ATOM 1238 N GLN A 76 -5.467 -24.251 17.328 1.00 0.00 N ATOM 1239 CA GLN A 76 -5.191 -23.292 16.264 1.00 0.00 C ATOM 1240 C GLN A 76 -4.786 -24.020 14.988 1.00 0.00 C ATOM 1241 O GLN A 76 -5.336 -23.766 13.916 1.00 0.00 O ATOM 1242 CB GLN A 76 -4.059 -22.357 16.690 1.00 0.00 C ATOM 1243 CG GLN A 76 -4.528 -21.463 17.839 1.00 0.00 C ATOM 1244 CD GLN A 76 -3.371 -20.597 18.326 1.00 0.00 C ATOM 1245 OE1 GLN A 76 -2.276 -20.647 17.768 1.00 0.00 O ATOM 1246 NE2 GLN A 76 -3.550 -19.798 19.343 1.00 0.00 N ATOM 0 H GLN A 76 -4.906 -24.126 18.171 1.00 0.00 H new ATOM 0 HA GLN A 76 -6.095 -22.713 16.075 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -3.192 -22.940 17.001 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -3.745 -21.744 15.845 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -5.352 -20.832 17.507 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -4.905 -22.076 18.658 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -4.458 -19.757 19.805 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -2.782 -19.215 19.675 1.00 0.00 H new ATOM 1255 N LEU A 77 -3.830 -24.935 15.113 1.00 0.00 N ATOM 1256 CA LEU A 77 -3.371 -25.704 13.962 1.00 0.00 C ATOM 1257 C LEU A 77 -4.507 -26.572 13.437 1.00 0.00 C ATOM 1258 O LEU A 77 -4.682 -26.720 12.227 1.00 0.00 O ATOM 1259 CB LEU A 77 -2.177 -26.587 14.348 1.00 0.00 C ATOM 1260 CG LEU A 77 -1.091 -25.746 15.034 1.00 0.00 C ATOM 1261 CD1 LEU A 77 0.130 -26.618 15.316 1.00 0.00 C ATOM 1262 CD2 LEU A 77 -0.693 -24.561 14.141 1.00 0.00 C ATOM 0 H LEU A 77 -3.362 -25.161 15.991 1.00 0.00 H new ATOM 0 HA LEU A 77 -3.055 -25.011 13.182 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -2.506 -27.383 15.016 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -1.768 -27.066 13.458 1.00 0.00 H new ATOM 0 HG LEU A 77 -1.483 -25.358 15.974 1.00 0.00 H new ATOM 0 HD11 LEU A 77 0.900 -26.019 15.803 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -0.155 -27.443 15.969 1.00 0.00 H new ATOM 0 HD13 LEU A 77 0.518 -27.015 14.378 1.00 0.00 H new ATOM 0 HD21 LEU A 77 0.078 -23.973 14.639 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -0.308 -24.934 13.192 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -1.566 -23.934 13.958 1.00 0.00 H new ATOM 1274 N GLU A 78 -5.279 -27.142 14.355 1.00 0.00 N ATOM 1275 CA GLU A 78 -6.399 -27.990 13.972 1.00 0.00 C ATOM 1276 C GLU A 78 -7.427 -27.183 13.186 1.00 0.00 C ATOM 1277 O GLU A 78 -7.900 -27.617 12.135 1.00 0.00 O ATOM 1278 CB GLU A 78 -7.054 -28.576 15.224 1.00 0.00 C ATOM 1279 CG GLU A 78 -8.145 -29.568 14.816 1.00 0.00 C ATOM 1280 CD GLU A 78 -8.788 -30.172 16.060 1.00 0.00 C ATOM 1281 OE1 GLU A 78 -8.208 -30.042 17.124 1.00 0.00 O ATOM 1282 OE2 GLU A 78 -9.852 -30.754 15.928 1.00 0.00 O ATOM 0 H GLU A 78 -5.151 -27.033 15.361 1.00 0.00 H new ATOM 0 HA GLU A 78 -6.029 -28.800 13.343 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -6.305 -29.076 15.838 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -7.482 -27.778 15.830 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -8.901 -29.064 14.214 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -7.718 -30.357 14.197 1.00 0.00 H new ATOM 1289 N LYS A 79 -7.760 -25.998 13.694 1.00 0.00 N ATOM 1290 CA LYS A 79 -8.717 -25.130 13.022 1.00 0.00 C ATOM 1291 C LYS A 79 -8.153 -24.648 11.697 1.00 0.00 C ATOM 1292 O LYS A 79 -8.863 -24.581 10.694 1.00 0.00 O ATOM 1293 CB LYS A 79 -9.067 -23.928 13.904 1.00 0.00 C ATOM 1294 CG LYS A 79 -9.964 -24.380 15.057 1.00 0.00 C ATOM 1295 CD LYS A 79 -10.347 -23.168 15.909 1.00 0.00 C ATOM 1296 CE LYS A 79 -11.341 -23.597 16.989 1.00 0.00 C ATOM 1297 NZ LYS A 79 -12.650 -23.922 16.351 1.00 0.00 N ATOM 0 H LYS A 79 -7.382 -25.621 14.563 1.00 0.00 H new ATOM 0 HA LYS A 79 -9.624 -25.704 12.835 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -8.156 -23.474 14.295 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -9.575 -23.166 13.313 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -10.860 -24.862 14.667 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -9.445 -25.118 15.668 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -9.457 -22.738 16.369 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -10.788 -22.393 15.281 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -10.960 -24.465 17.527 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -11.468 -22.799 17.721 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -13.404 -23.882 17.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -12.850 -23.233 15.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -12.610 -24.878 15.943 1.00 0.00 H new ATOM 1311 N ALA A 80 -6.871 -24.309 11.702 1.00 0.00 N ATOM 1312 CA ALA A 80 -6.225 -23.832 10.493 1.00 0.00 C ATOM 1313 C ALA A 80 -6.265 -24.907 9.416 1.00 0.00 C ATOM 1314 O ALA A 80 -6.414 -24.610 8.231 1.00 0.00 O ATOM 1315 CB ALA A 80 -4.774 -23.438 10.779 1.00 0.00 C ATOM 0 H ALA A 80 -6.266 -24.355 12.522 1.00 0.00 H new ATOM 0 HA ALA A 80 -6.764 -22.953 10.140 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -4.306 -23.083 9.861 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -4.753 -22.646 11.527 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -4.229 -24.305 11.153 1.00 0.00 H new ATOM 1321 N LEU A 81 -6.134 -26.162 9.836 1.00 0.00 N ATOM 1322 CA LEU A 81 -6.163 -27.271 8.894 1.00 0.00 C ATOM 1323 C LEU A 81 -7.510 -27.321 8.188 1.00 0.00 C ATOM 1324 O LEU A 81 -7.579 -27.524 6.976 1.00 0.00 O ATOM 1325 CB LEU A 81 -5.915 -28.595 9.630 1.00 0.00 C ATOM 1326 CG LEU A 81 -6.046 -29.781 8.659 1.00 0.00 C ATOM 1327 CD1 LEU A 81 -5.090 -29.603 7.468 1.00 0.00 C ATOM 1328 CD2 LEU A 81 -5.708 -31.078 9.402 1.00 0.00 C ATOM 0 H LEU A 81 -6.008 -26.433 10.811 1.00 0.00 H new ATOM 0 HA LEU A 81 -5.377 -27.122 8.154 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -4.920 -28.590 10.076 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -6.629 -28.704 10.446 1.00 0.00 H new ATOM 0 HG LEU A 81 -7.068 -29.825 8.283 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -5.193 -30.449 6.789 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -5.335 -28.682 6.939 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -4.063 -29.552 7.830 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -5.799 -31.923 8.719 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -4.687 -31.025 9.780 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -6.397 -31.210 10.236 1.00 0.00 H new ATOM 1340 N GLY A 82 -8.579 -27.134 8.952 1.00 0.00 N ATOM 1341 CA GLY A 82 -9.920 -27.159 8.388 1.00 0.00 C ATOM 1342 C GLY A 82 -10.200 -25.876 7.619 1.00 0.00 C ATOM 1343 O GLY A 82 -11.335 -25.611 7.224 1.00 0.00 O ATOM 0 H GLY A 82 -8.543 -26.965 9.957 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -10.026 -28.018 7.725 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -10.654 -27.279 9.185 1.00 0.00 H new ATOM 1347 N LEU A 83 -9.152 -25.087 7.412 1.00 0.00 N ATOM 1348 CA LEU A 83 -9.280 -23.829 6.686 1.00 0.00 C ATOM 1349 C LEU A 83 -10.294 -22.919 7.369 1.00 0.00 C ATOM 1350 O LEU A 83 -11.107 -22.273 6.708 1.00 0.00 O ATOM 1351 CB LEU A 83 -9.724 -24.104 5.249 1.00 0.00 C ATOM 1352 CG LEU A 83 -8.768 -25.106 4.594 1.00 0.00 C ATOM 1353 CD1 LEU A 83 -9.262 -25.421 3.179 1.00 0.00 C ATOM 1354 CD2 LEU A 83 -7.348 -24.519 4.533 1.00 0.00 C ATOM 0 H LEU A 83 -8.207 -25.295 7.735 1.00 0.00 H new ATOM 0 HA LEU A 83 -8.310 -23.331 6.679 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -10.740 -24.498 5.242 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -9.739 -23.175 4.679 1.00 0.00 H new ATOM 0 HG LEU A 83 -8.742 -26.021 5.185 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -8.585 -26.134 2.708 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -10.263 -25.850 3.230 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -9.290 -24.504 2.591 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -6.676 -25.239 4.066 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -7.359 -23.600 3.947 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -7.001 -24.301 5.543 1.00 0.00 H new