USER MOD reduce.3.24.130724 H: found=0, std=0, add=835, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 821 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 90 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 93 GLN : amide:sc= -1.14 K(o=-1.1,f=-3.3!) USER MOD Set 2.1: A 81 ASN : amide:sc= -3.96! C(o=-11!,f=-11!) USER MOD Set 2.2: A 98 HIS : no HD1:sc= -6.62! C(o=-11!,f=-9.8!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 157:sc= -1.01 (180deg=-3.48!) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ -120:sc= -0.0494 (180deg=-0.322) USER MOD Single : A 47 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0275) USER MOD Single : A 48 LYS NZ :NH3+ -110:sc= -0.0081 (180deg=-0.245) USER MOD Single : A 49 TYR OH : rot 15:sc= 0 USER MOD Single : A 53 SER OG : rot 180:sc= -1.03 USER MOD Single : A 56 THR OG1 : rot 180:sc= -2.42! USER MOD Single : A 59 GLN : amide:sc= -0.181 X(o=-0.18,f=-0.58) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 HIS : no HD1:sc= -1.02! C(o=-1!,f=-1.9!) USER MOD Single : A 82 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0.126 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 91 MET CE :methyl -172:sc= -5.1 (180deg=-5.92!) USER MOD Single : A 95 TYR OH : rot 180:sc= -0.781 USER MOD Single : A 96 GLN : amide:sc= -0.514 X(o=-0.51,f=-0.2) USER MOD Single : A 99 HIS : no HD1:sc= -4.84! C(o=-4.8!,f=-12!) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 10:sc= -8.58! USER MOD Single : A 110 SER OG : rot -160:sc= -1.64 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 18 -6.771 12.008 9.766 1.00 0.00 N ATOM 2 CA GLY A 18 -6.568 12.308 8.321 1.00 0.00 C ATOM 3 C GLY A 18 -6.327 13.808 8.143 1.00 0.00 C ATOM 4 O GLY A 18 -5.242 14.235 7.804 1.00 0.00 O ATOM 0 HA2 GLY A 18 -5.718 11.744 7.937 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -7.442 11.998 7.748 1.00 0.00 H new ATOM 8 N GLU A 19 -7.330 14.611 8.372 1.00 0.00 N ATOM 9 CA GLU A 19 -7.153 16.084 8.217 1.00 0.00 C ATOM 10 C GLU A 19 -5.858 16.528 8.901 1.00 0.00 C ATOM 11 O GLU A 19 -5.203 17.456 8.471 1.00 0.00 O ATOM 12 CB GLU A 19 -8.367 16.710 8.907 1.00 0.00 C ATOM 13 CG GLU A 19 -8.961 17.796 8.008 1.00 0.00 C ATOM 14 CD GLU A 19 -10.386 18.114 8.466 1.00 0.00 C ATOM 15 OE1 GLU A 19 -11.160 17.184 8.621 1.00 0.00 O ATOM 16 OE2 GLU A 19 -10.678 19.284 8.653 1.00 0.00 O ATOM 0 H GLU A 19 -8.262 14.312 8.659 1.00 0.00 H new ATOM 0 HA GLU A 19 -7.084 16.385 7.172 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -9.115 15.945 9.114 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -8.074 17.137 9.866 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -8.345 18.694 8.049 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -8.967 17.461 6.971 1.00 0.00 H new ATOM 23 N LYS A 20 -5.484 15.869 9.963 1.00 0.00 N ATOM 24 CA LYS A 20 -4.231 16.250 10.674 1.00 0.00 C ATOM 25 C LYS A 20 -3.011 15.716 9.916 1.00 0.00 C ATOM 26 O LYS A 20 -1.997 16.377 9.812 1.00 0.00 O ATOM 27 CB LYS A 20 -4.340 15.589 12.050 1.00 0.00 C ATOM 28 CG LYS A 20 -3.600 16.438 13.086 1.00 0.00 C ATOM 29 CD LYS A 20 -4.553 16.794 14.229 1.00 0.00 C ATOM 30 CE LYS A 20 -4.204 18.180 14.772 1.00 0.00 C ATOM 31 NZ LYS A 20 -5.226 18.451 15.822 1.00 0.00 N ATOM 0 H LYS A 20 -5.992 15.083 10.369 1.00 0.00 H new ATOM 0 HA LYS A 20 -4.110 17.331 10.750 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -5.388 15.484 12.332 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -3.916 14.585 12.017 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -2.740 15.891 13.472 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -3.217 17.347 12.621 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -5.584 16.780 13.875 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -4.478 16.051 15.023 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -3.197 18.199 15.188 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -4.238 18.933 13.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -5.052 19.386 16.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -6.175 18.433 15.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -5.165 17.723 16.562 1.00 0.00 H new ATOM 45 N ILE A 21 -3.101 14.527 9.385 1.00 0.00 N ATOM 46 CA ILE A 21 -1.946 13.952 8.635 1.00 0.00 C ATOM 47 C ILE A 21 -1.586 14.851 7.454 1.00 0.00 C ATOM 48 O ILE A 21 -0.532 14.724 6.866 1.00 0.00 O ATOM 49 CB ILE A 21 -2.429 12.588 8.145 1.00 0.00 C ATOM 50 CG1 ILE A 21 -2.505 11.614 9.326 1.00 0.00 C ATOM 51 CG2 ILE A 21 -1.451 12.043 7.103 1.00 0.00 C ATOM 52 CD1 ILE A 21 -1.189 11.647 10.103 1.00 0.00 C ATOM 0 H ILE A 21 -3.925 13.928 9.438 1.00 0.00 H new ATOM 0 HA ILE A 21 -1.053 13.867 9.254 1.00 0.00 H new ATOM 0 HB ILE A 21 -3.417 12.696 7.698 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -3.333 11.885 9.981 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -2.701 10.604 8.966 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -1.796 11.070 6.754 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -1.396 12.732 6.260 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -0.463 11.938 7.551 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -1.245 10.954 10.942 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -0.371 11.355 9.445 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -1.012 12.656 10.476 1.00 0.00 H new ATOM 64 N ARG A 22 -2.446 15.765 7.107 1.00 0.00 N ATOM 65 CA ARG A 22 -2.135 16.674 5.972 1.00 0.00 C ATOM 66 C ARG A 22 -1.341 17.878 6.482 1.00 0.00 C ATOM 67 O ARG A 22 -0.280 18.193 5.980 1.00 0.00 O ATOM 68 CB ARG A 22 -3.489 17.118 5.422 1.00 0.00 C ATOM 69 CG ARG A 22 -3.513 16.911 3.906 1.00 0.00 C ATOM 70 CD ARG A 22 -2.230 17.477 3.286 1.00 0.00 C ATOM 71 NE ARG A 22 -2.684 18.601 2.422 1.00 0.00 N ATOM 72 CZ ARG A 22 -2.523 18.536 1.128 1.00 0.00 C ATOM 73 NH1 ARG A 22 -1.339 18.707 0.608 1.00 0.00 N ATOM 74 NH2 ARG A 22 -3.548 18.299 0.355 1.00 0.00 N ATOM 0 H ARG A 22 -3.347 15.922 7.558 1.00 0.00 H new ATOM 0 HA ARG A 22 -1.534 16.188 5.204 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -4.290 16.546 5.891 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -3.665 18.167 5.660 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -3.602 15.849 3.676 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -4.385 17.404 3.476 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -1.540 17.824 4.055 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -1.705 16.719 2.705 1.00 0.00 H new ATOM 0 HE ARG A 22 -3.121 19.422 2.841 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -0.538 18.892 1.212 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -1.214 18.656 -0.403 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -4.474 18.165 0.762 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -3.423 18.248 -0.656 1.00 0.00 H new ATOM 86 N LYS A 23 -1.842 18.546 7.485 1.00 0.00 N ATOM 87 CA LYS A 23 -1.108 19.720 8.034 1.00 0.00 C ATOM 88 C LYS A 23 0.322 19.308 8.391 1.00 0.00 C ATOM 89 O LYS A 23 1.253 20.076 8.254 1.00 0.00 O ATOM 90 CB LYS A 23 -1.885 20.122 9.290 1.00 0.00 C ATOM 91 CG LYS A 23 -3.054 21.028 8.898 1.00 0.00 C ATOM 92 CD LYS A 23 -4.338 20.524 9.563 1.00 0.00 C ATOM 93 CE LYS A 23 -5.219 21.717 9.941 1.00 0.00 C ATOM 94 NZ LYS A 23 -6.311 21.725 8.927 1.00 0.00 N ATOM 0 H LYS A 23 -2.726 18.330 7.947 1.00 0.00 H new ATOM 0 HA LYS A 23 -1.040 20.544 7.324 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -2.255 19.234 9.802 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -1.227 20.640 9.987 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -2.851 22.054 9.205 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -3.173 21.038 7.815 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -4.876 19.862 8.885 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -4.095 19.941 10.452 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -5.618 21.610 10.950 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -4.653 22.648 9.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -6.958 22.516 9.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -5.902 21.835 7.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -6.837 20.829 8.976 1.00 0.00 H new ATOM 108 N LYS A 24 0.501 18.096 8.843 1.00 0.00 N ATOM 109 CA LYS A 24 1.869 17.627 9.202 1.00 0.00 C ATOM 110 C LYS A 24 2.580 17.114 7.951 1.00 0.00 C ATOM 111 O LYS A 24 3.717 17.454 7.688 1.00 0.00 O ATOM 112 CB LYS A 24 1.668 16.482 10.198 1.00 0.00 C ATOM 113 CG LYS A 24 0.533 16.822 11.162 1.00 0.00 C ATOM 114 CD LYS A 24 1.023 16.667 12.604 1.00 0.00 C ATOM 115 CE LYS A 24 -0.174 16.703 13.556 1.00 0.00 C ATOM 116 NZ LYS A 24 0.402 16.447 14.905 1.00 0.00 N ATOM 0 H LYS A 24 -0.242 17.410 8.979 1.00 0.00 H new ATOM 0 HA LYS A 24 2.476 18.426 9.627 1.00 0.00 H new ATOM 0 HB2 LYS A 24 1.438 15.560 9.664 1.00 0.00 H new ATOM 0 HB3 LYS A 24 2.589 16.307 10.754 1.00 0.00 H new ATOM 0 HG2 LYS A 24 0.190 17.842 10.991 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -0.319 16.165 10.984 1.00 0.00 H new ATOM 0 HD2 LYS A 24 1.563 15.727 12.717 1.00 0.00 H new ATOM 0 HD3 LYS A 24 1.721 17.467 12.850 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -0.680 17.668 13.519 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -0.912 15.946 13.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -0.358 16.456 15.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 0.871 15.519 14.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 1.096 17.187 15.132 1.00 0.00 H new ATOM 130 N TYR A 25 1.921 16.291 7.182 1.00 0.00 N ATOM 131 CA TYR A 25 2.566 15.750 5.951 1.00 0.00 C ATOM 132 C TYR A 25 1.927 16.334 4.679 1.00 0.00 C ATOM 133 O TYR A 25 1.465 15.595 3.832 1.00 0.00 O ATOM 134 CB TYR A 25 2.318 14.245 6.023 1.00 0.00 C ATOM 135 CG TYR A 25 2.891 13.699 7.310 1.00 0.00 C ATOM 136 CD1 TYR A 25 4.278 13.653 7.494 1.00 0.00 C ATOM 137 CD2 TYR A 25 2.035 13.242 8.319 1.00 0.00 C ATOM 138 CE1 TYR A 25 4.809 13.148 8.688 1.00 0.00 C ATOM 139 CE2 TYR A 25 2.567 12.738 9.512 1.00 0.00 C ATOM 140 CZ TYR A 25 3.953 12.691 9.697 1.00 0.00 C ATOM 141 OH TYR A 25 4.476 12.194 10.873 1.00 0.00 O ATOM 0 H TYR A 25 0.968 15.971 7.351 1.00 0.00 H new ATOM 0 HA TYR A 25 3.625 16.005 5.903 1.00 0.00 H new ATOM 0 HB2 TYR A 25 1.249 14.039 5.973 1.00 0.00 H new ATOM 0 HB3 TYR A 25 2.778 13.749 5.169 1.00 0.00 H new ATOM 0 HD1 TYR A 25 4.938 14.007 6.716 1.00 0.00 H new ATOM 0 HD2 TYR A 25 0.965 13.278 8.177 1.00 0.00 H new ATOM 0 HE1 TYR A 25 5.879 13.111 8.830 1.00 0.00 H new ATOM 0 HE2 TYR A 25 1.907 12.385 10.290 1.00 0.00 H new ATOM 0 HH TYR A 25 3.745 11.921 11.466 1.00 0.00 H new ATOM 151 N PRO A 26 1.928 17.641 4.576 1.00 0.00 N ATOM 152 CA PRO A 26 1.342 18.306 3.382 1.00 0.00 C ATOM 153 C PRO A 26 2.242 18.109 2.158 1.00 0.00 C ATOM 154 O PRO A 26 1.871 18.430 1.047 1.00 0.00 O ATOM 155 CB PRO A 26 1.305 19.780 3.775 1.00 0.00 C ATOM 156 CG PRO A 26 2.382 19.926 4.802 1.00 0.00 C ATOM 157 CD PRO A 26 2.460 18.616 5.538 1.00 0.00 C ATOM 0 HA PRO A 26 0.363 17.907 3.115 1.00 0.00 H new ATOM 0 HB2 PRO A 26 1.488 20.424 2.915 1.00 0.00 H new ATOM 0 HB3 PRO A 26 0.332 20.058 4.180 1.00 0.00 H new ATOM 0 HG2 PRO A 26 3.336 20.162 4.331 1.00 0.00 H new ATOM 0 HG3 PRO A 26 2.154 20.742 5.488 1.00 0.00 H new ATOM 0 HD2 PRO A 26 3.485 18.378 5.823 1.00 0.00 H new ATOM 0 HD3 PRO A 26 1.870 18.636 6.454 1.00 0.00 H new ATOM 165 N ASP A 27 3.429 17.601 2.353 1.00 0.00 N ATOM 166 CA ASP A 27 4.352 17.408 1.196 1.00 0.00 C ATOM 167 C ASP A 27 4.358 15.947 0.734 1.00 0.00 C ATOM 168 O ASP A 27 5.090 15.579 -0.163 1.00 0.00 O ATOM 169 CB ASP A 27 5.732 17.805 1.722 1.00 0.00 C ATOM 170 CG ASP A 27 6.558 18.407 0.583 1.00 0.00 C ATOM 171 OD1 ASP A 27 5.989 18.656 -0.467 1.00 0.00 O ATOM 172 OD2 ASP A 27 7.745 18.606 0.781 1.00 0.00 O ATOM 0 H ASP A 27 3.799 17.312 3.259 1.00 0.00 H new ATOM 0 HA ASP A 27 4.049 18.003 0.334 1.00 0.00 H new ATOM 0 HB2 ASP A 27 5.630 18.527 2.533 1.00 0.00 H new ATOM 0 HB3 ASP A 27 6.241 16.933 2.133 1.00 0.00 H new ATOM 177 N ARG A 28 3.553 15.109 1.328 1.00 0.00 N ATOM 178 CA ARG A 28 3.537 13.681 0.896 1.00 0.00 C ATOM 179 C ARG A 28 2.124 13.099 0.998 1.00 0.00 C ATOM 180 O ARG A 28 1.175 13.791 1.307 1.00 0.00 O ATOM 181 CB ARG A 28 4.498 12.964 1.849 1.00 0.00 C ATOM 182 CG ARG A 28 3.822 12.732 3.202 1.00 0.00 C ATOM 183 CD ARG A 28 4.826 13.010 4.322 1.00 0.00 C ATOM 184 NE ARG A 28 4.643 11.894 5.290 1.00 0.00 N ATOM 185 CZ ARG A 28 5.598 11.023 5.470 1.00 0.00 C ATOM 186 NH1 ARG A 28 6.015 10.293 4.471 1.00 0.00 N ATOM 187 NH2 ARG A 28 6.138 10.882 6.650 1.00 0.00 N ATOM 0 H ARG A 28 2.912 15.346 2.085 1.00 0.00 H new ATOM 0 HA ARG A 28 3.840 13.565 -0.145 1.00 0.00 H new ATOM 0 HB2 ARG A 28 4.805 12.011 1.419 1.00 0.00 H new ATOM 0 HB3 ARG A 28 5.401 13.559 1.982 1.00 0.00 H new ATOM 0 HG2 ARG A 28 2.955 13.384 3.305 1.00 0.00 H new ATOM 0 HG3 ARG A 28 3.459 11.706 3.269 1.00 0.00 H new ATOM 0 HD2 ARG A 28 5.846 13.037 3.939 1.00 0.00 H new ATOM 0 HD3 ARG A 28 4.636 13.975 4.792 1.00 0.00 H new ATOM 0 HE ARG A 28 3.771 11.810 5.813 1.00 0.00 H new ATOM 0 HH11 ARG A 28 5.594 10.403 3.548 1.00 0.00 H new ATOM 0 HH12 ARG A 28 6.762 9.613 4.613 1.00 0.00 H new ATOM 0 HH21 ARG A 28 5.813 11.452 7.431 1.00 0.00 H new ATOM 0 HH22 ARG A 28 6.884 10.201 6.791 1.00 0.00 H new ATOM 199 N VAL A 29 1.981 11.830 0.726 1.00 0.00 N ATOM 200 CA VAL A 29 0.634 11.197 0.790 1.00 0.00 C ATOM 201 C VAL A 29 0.609 10.068 1.831 1.00 0.00 C ATOM 202 O VAL A 29 1.500 9.231 1.872 1.00 0.00 O ATOM 203 CB VAL A 29 0.402 10.626 -0.613 1.00 0.00 C ATOM 204 CG1 VAL A 29 -0.740 9.607 -0.571 1.00 0.00 C ATOM 205 CG2 VAL A 29 0.033 11.754 -1.580 1.00 0.00 C ATOM 0 H VAL A 29 2.741 11.204 0.462 1.00 0.00 H new ATOM 0 HA VAL A 29 -0.136 11.911 1.083 1.00 0.00 H new ATOM 0 HB VAL A 29 1.316 10.140 -0.954 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -0.903 9.202 -1.570 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -0.480 8.797 0.111 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -1.651 10.095 -0.224 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -0.130 11.341 -2.575 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -0.878 12.244 -1.236 1.00 0.00 H new ATOM 0 HG23 VAL A 29 0.844 12.481 -1.618 1.00 0.00 H new ATOM 215 N PRO A 30 -0.432 10.076 2.626 1.00 0.00 N ATOM 216 CA PRO A 30 -0.613 9.036 3.659 1.00 0.00 C ATOM 217 C PRO A 30 -1.206 7.777 3.018 1.00 0.00 C ATOM 218 O PRO A 30 -2.339 7.769 2.562 1.00 0.00 O ATOM 219 CB PRO A 30 -1.606 9.662 4.628 1.00 0.00 C ATOM 220 CG PRO A 30 -2.374 10.663 3.820 1.00 0.00 C ATOM 221 CD PRO A 30 -1.519 11.058 2.639 1.00 0.00 C ATOM 0 HA PRO A 30 0.316 8.739 4.146 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -2.269 8.908 5.053 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -1.093 10.141 5.462 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -3.319 10.237 3.482 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -2.617 11.537 4.425 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -2.089 11.031 1.710 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -1.136 12.072 2.749 1.00 0.00 H new ATOM 229 N VAL A 31 -0.449 6.720 2.967 1.00 0.00 N ATOM 230 CA VAL A 31 -0.964 5.470 2.342 1.00 0.00 C ATOM 231 C VAL A 31 -1.434 4.479 3.410 1.00 0.00 C ATOM 232 O VAL A 31 -0.693 4.108 4.298 1.00 0.00 O ATOM 233 CB VAL A 31 0.226 4.897 1.569 1.00 0.00 C ATOM 234 CG1 VAL A 31 -0.214 3.646 0.807 1.00 0.00 C ATOM 235 CG2 VAL A 31 0.743 5.940 0.576 1.00 0.00 C ATOM 0 H VAL A 31 0.503 6.666 3.330 1.00 0.00 H new ATOM 0 HA VAL A 31 -1.822 5.662 1.698 1.00 0.00 H new ATOM 0 HB VAL A 31 1.020 4.637 2.270 1.00 0.00 H new ATOM 0 HG11 VAL A 31 0.634 3.238 0.257 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -0.581 2.901 1.512 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -1.009 3.906 0.108 1.00 0.00 H new ATOM 0 HG21 VAL A 31 1.590 5.530 0.026 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -0.051 6.201 -0.123 1.00 0.00 H new ATOM 0 HG23 VAL A 31 1.058 6.832 1.117 1.00 0.00 H new ATOM 245 N ILE A 32 -2.658 4.033 3.317 1.00 0.00 N ATOM 246 CA ILE A 32 -3.172 3.049 4.312 1.00 0.00 C ATOM 247 C ILE A 32 -2.916 1.636 3.786 1.00 0.00 C ATOM 248 O ILE A 32 -2.928 1.404 2.594 1.00 0.00 O ATOM 249 CB ILE A 32 -4.673 3.327 4.413 1.00 0.00 C ATOM 250 CG1 ILE A 32 -4.897 4.818 4.672 1.00 0.00 C ATOM 251 CG2 ILE A 32 -5.267 2.515 5.567 1.00 0.00 C ATOM 252 CD1 ILE A 32 -4.347 5.186 6.051 1.00 0.00 C ATOM 0 H ILE A 32 -3.324 4.308 2.595 1.00 0.00 H new ATOM 0 HA ILE A 32 -2.689 3.134 5.286 1.00 0.00 H new ATOM 0 HB ILE A 32 -5.159 3.041 3.480 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -4.402 5.410 3.902 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -5.960 5.051 4.619 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -6.336 2.713 5.639 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -5.106 1.452 5.385 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -4.782 2.800 6.500 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -4.507 6.248 6.235 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -4.862 4.604 6.815 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -3.280 4.968 6.087 1.00 0.00 H new ATOM 264 N VAL A 33 -2.664 0.692 4.648 1.00 0.00 N ATOM 265 CA VAL A 33 -2.388 -0.682 4.154 1.00 0.00 C ATOM 266 C VAL A 33 -3.229 -1.726 4.895 1.00 0.00 C ATOM 267 O VAL A 33 -3.483 -1.625 6.079 1.00 0.00 O ATOM 268 CB VAL A 33 -0.894 -0.882 4.413 1.00 0.00 C ATOM 269 CG1 VAL A 33 -0.559 -2.372 4.425 1.00 0.00 C ATOM 270 CG2 VAL A 33 -0.104 -0.197 3.298 1.00 0.00 C ATOM 0 H VAL A 33 -2.637 0.811 5.661 1.00 0.00 H new ATOM 0 HA VAL A 33 -2.646 -0.802 3.102 1.00 0.00 H new ATOM 0 HB VAL A 33 -0.633 -0.452 5.380 1.00 0.00 H new ATOM 0 HG11 VAL A 33 0.507 -2.504 4.610 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -1.128 -2.867 5.212 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -0.817 -2.811 3.461 1.00 0.00 H new ATOM 0 HG21 VAL A 33 0.963 -0.333 3.472 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -0.374 -0.637 2.338 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -0.337 0.868 3.288 1.00 0.00 H new ATOM 280 N GLU A 34 -3.648 -2.733 4.182 1.00 0.00 N ATOM 281 CA GLU A 34 -4.469 -3.821 4.791 1.00 0.00 C ATOM 282 C GLU A 34 -4.329 -5.100 3.954 1.00 0.00 C ATOM 283 O GLU A 34 -3.824 -5.075 2.846 1.00 0.00 O ATOM 284 CB GLU A 34 -5.907 -3.305 4.753 1.00 0.00 C ATOM 285 CG GLU A 34 -6.685 -3.878 5.940 1.00 0.00 C ATOM 286 CD GLU A 34 -8.168 -3.978 5.577 1.00 0.00 C ATOM 287 OE1 GLU A 34 -8.673 -3.046 4.974 1.00 0.00 O ATOM 288 OE2 GLU A 34 -8.772 -4.984 5.910 1.00 0.00 O ATOM 0 H GLU A 34 -3.454 -2.852 3.188 1.00 0.00 H new ATOM 0 HA GLU A 34 -4.158 -4.063 5.807 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -5.915 -2.216 4.791 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -6.384 -3.595 3.817 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -6.297 -4.862 6.202 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -6.556 -3.241 6.815 1.00 0.00 H new ATOM 295 N LYS A 35 -4.767 -6.218 4.467 1.00 0.00 N ATOM 296 CA LYS A 35 -4.647 -7.486 3.688 1.00 0.00 C ATOM 297 C LYS A 35 -5.949 -7.800 2.953 1.00 0.00 C ATOM 298 O LYS A 35 -6.998 -7.270 3.259 1.00 0.00 O ATOM 299 CB LYS A 35 -4.364 -8.573 4.720 1.00 0.00 C ATOM 300 CG LYS A 35 -3.313 -9.535 4.164 1.00 0.00 C ATOM 301 CD LYS A 35 -1.953 -8.839 4.141 1.00 0.00 C ATOM 302 CE LYS A 35 -1.519 -8.523 5.574 1.00 0.00 C ATOM 303 NZ LYS A 35 -1.777 -9.774 6.339 1.00 0.00 N ATOM 0 H LYS A 35 -5.200 -6.309 5.386 1.00 0.00 H new ATOM 0 HA LYS A 35 -3.862 -7.414 2.935 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -4.009 -8.126 5.649 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -5.280 -9.114 4.956 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -3.264 -10.433 4.779 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -3.589 -9.852 3.158 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -1.214 -9.478 3.658 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -2.012 -7.921 3.556 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -0.466 -8.245 5.615 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -2.086 -7.686 5.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -1.176 -9.792 7.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -2.777 -9.808 6.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -1.558 -10.597 5.742 1.00 0.00 H new ATOM 317 N ALA A 36 -5.883 -8.676 1.990 1.00 0.00 N ATOM 318 CA ALA A 36 -7.110 -9.057 1.231 1.00 0.00 C ATOM 319 C ALA A 36 -8.086 -9.784 2.160 1.00 0.00 C ATOM 320 O ALA A 36 -7.848 -9.882 3.347 1.00 0.00 O ATOM 321 CB ALA A 36 -6.615 -9.992 0.125 1.00 0.00 C ATOM 0 H ALA A 36 -5.029 -9.148 1.693 1.00 0.00 H new ATOM 0 HA ALA A 36 -7.638 -8.195 0.823 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -7.460 -10.318 -0.481 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -5.900 -9.464 -0.505 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -6.132 -10.861 0.572 1.00 0.00 H new ATOM 327 N PRO A 37 -9.154 -10.282 1.593 1.00 0.00 N ATOM 328 CA PRO A 37 -10.160 -11.014 2.397 1.00 0.00 C ATOM 329 C PRO A 37 -9.622 -12.398 2.774 1.00 0.00 C ATOM 330 O PRO A 37 -9.366 -13.227 1.922 1.00 0.00 O ATOM 331 CB PRO A 37 -11.359 -11.127 1.461 1.00 0.00 C ATOM 332 CG PRO A 37 -10.787 -11.032 0.082 1.00 0.00 C ATOM 333 CD PRO A 37 -9.525 -10.212 0.173 1.00 0.00 C ATOM 0 HA PRO A 37 -10.411 -10.517 3.334 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -11.884 -12.071 1.606 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -12.079 -10.330 1.645 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -10.572 -12.025 -0.314 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -11.500 -10.565 -0.598 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -8.739 -10.617 -0.465 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -9.694 -9.183 -0.145 1.00 0.00 H new ATOM 341 N LYS A 38 -9.445 -12.653 4.041 1.00 0.00 N ATOM 342 CA LYS A 38 -8.920 -13.981 4.468 1.00 0.00 C ATOM 343 C LYS A 38 -7.533 -14.217 3.861 1.00 0.00 C ATOM 344 O LYS A 38 -7.206 -15.309 3.441 1.00 0.00 O ATOM 345 CB LYS A 38 -9.929 -14.988 3.921 1.00 0.00 C ATOM 346 CG LYS A 38 -10.756 -15.563 5.073 1.00 0.00 C ATOM 347 CD LYS A 38 -9.825 -16.186 6.113 1.00 0.00 C ATOM 348 CE LYS A 38 -10.242 -15.728 7.512 1.00 0.00 C ATOM 349 NZ LYS A 38 -9.155 -16.205 8.412 1.00 0.00 N ATOM 0 H LYS A 38 -9.641 -11.999 4.799 1.00 0.00 H new ATOM 0 HA LYS A 38 -8.808 -14.061 5.549 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -10.584 -14.505 3.196 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -9.410 -15.790 3.397 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -11.355 -14.776 5.532 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -11.450 -16.314 4.696 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -9.866 -17.273 6.048 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -8.794 -15.893 5.915 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -10.346 -14.644 7.558 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -11.205 -16.153 7.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -9.369 -15.929 9.392 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -9.084 -17.241 8.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -8.252 -15.779 8.122 1.00 0.00 H new ATOM 363 N ALA A 39 -6.716 -13.199 3.812 1.00 0.00 N ATOM 364 CA ALA A 39 -5.351 -13.360 3.232 1.00 0.00 C ATOM 365 C ALA A 39 -4.539 -14.367 4.052 1.00 0.00 C ATOM 366 O ALA A 39 -4.978 -14.840 5.082 1.00 0.00 O ATOM 367 CB ALA A 39 -4.720 -11.971 3.317 1.00 0.00 C ATOM 0 H ALA A 39 -6.935 -12.262 4.149 1.00 0.00 H new ATOM 0 HA ALA A 39 -5.380 -13.735 2.209 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -3.710 -12.005 2.909 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.320 -11.263 2.745 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -4.680 -11.653 4.359 1.00 0.00 H new ATOM 373 N ARG A 40 -3.358 -14.700 3.604 1.00 0.00 N ATOM 374 CA ARG A 40 -2.526 -15.678 4.362 1.00 0.00 C ATOM 375 C ARG A 40 -1.034 -15.396 4.150 1.00 0.00 C ATOM 376 O ARG A 40 -0.220 -16.298 4.159 1.00 0.00 O ATOM 377 CB ARG A 40 -2.898 -17.044 3.782 1.00 0.00 C ATOM 378 CG ARG A 40 -2.293 -17.188 2.384 1.00 0.00 C ATOM 379 CD ARG A 40 -1.261 -18.318 2.387 1.00 0.00 C ATOM 380 NE ARG A 40 -0.100 -17.781 1.624 1.00 0.00 N ATOM 381 CZ ARG A 40 0.946 -18.532 1.414 1.00 0.00 C ATOM 382 NH1 ARG A 40 1.313 -19.406 2.311 1.00 0.00 N ATOM 383 NH2 ARG A 40 1.624 -18.412 0.306 1.00 0.00 N ATOM 0 H ARG A 40 -2.935 -14.338 2.749 1.00 0.00 H new ATOM 0 HA ARG A 40 -2.706 -15.623 5.436 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -2.531 -17.839 4.432 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -3.982 -17.147 3.733 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -3.077 -17.400 1.657 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -1.822 -16.252 2.082 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -0.974 -18.588 3.403 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -1.659 -19.218 1.918 1.00 0.00 H new ATOM 0 HE ARG A 40 -0.123 -16.826 1.266 1.00 0.00 H new ATOM 0 HH11 ARG A 40 0.782 -19.502 3.177 1.00 0.00 H new ATOM 0 HH12 ARG A 40 2.131 -19.993 2.146 1.00 0.00 H new ATOM 0 HH21 ARG A 40 1.336 -17.731 -0.397 1.00 0.00 H new ATOM 0 HH22 ARG A 40 2.442 -18.999 0.142 1.00 0.00 H new ATOM 395 N ILE A 41 -0.665 -14.157 3.962 1.00 0.00 N ATOM 396 CA ILE A 41 0.779 -13.847 3.755 1.00 0.00 C ATOM 397 C ILE A 41 1.493 -13.670 5.104 1.00 0.00 C ATOM 398 O ILE A 41 0.893 -13.773 6.155 1.00 0.00 O ATOM 399 CB ILE A 41 0.842 -12.572 2.888 1.00 0.00 C ATOM 400 CG1 ILE A 41 0.149 -11.370 3.557 1.00 0.00 C ATOM 401 CG2 ILE A 41 0.159 -12.845 1.547 1.00 0.00 C ATOM 402 CD1 ILE A 41 0.906 -10.950 4.809 1.00 0.00 C ATOM 0 H ILE A 41 -1.294 -13.354 3.943 1.00 0.00 H new ATOM 0 HA ILE A 41 1.294 -14.663 3.249 1.00 0.00 H new ATOM 0 HB ILE A 41 1.894 -12.320 2.754 1.00 0.00 H new ATOM 0 HG12 ILE A 41 0.099 -10.536 2.858 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -0.877 -11.631 3.815 1.00 0.00 H new ATOM 0 HG21 ILE A 41 0.200 -11.948 0.929 1.00 0.00 H new ATOM 0 HG22 ILE A 41 0.671 -13.661 1.037 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -0.882 -13.121 1.718 1.00 0.00 H new ATOM 0 HD11 ILE A 41 0.404 -10.100 5.270 1.00 0.00 H new ATOM 0 HD12 ILE A 41 0.933 -11.781 5.514 1.00 0.00 H new ATOM 0 HD13 ILE A 41 1.924 -10.668 4.541 1.00 0.00 H new ATOM 414 N GLY A 42 2.779 -13.435 5.073 1.00 0.00 N ATOM 415 CA GLY A 42 3.559 -13.281 6.343 1.00 0.00 C ATOM 416 C GLY A 42 2.870 -12.302 7.293 1.00 0.00 C ATOM 417 O GLY A 42 1.802 -11.801 7.025 1.00 0.00 O ATOM 0 H GLY A 42 3.328 -13.342 4.218 1.00 0.00 H new ATOM 0 HA2 GLY A 42 3.665 -14.251 6.829 1.00 0.00 H new ATOM 0 HA3 GLY A 42 4.564 -12.926 6.116 1.00 0.00 H new ATOM 421 N ASP A 43 3.482 -12.032 8.412 1.00 0.00 N ATOM 422 CA ASP A 43 2.871 -11.081 9.388 1.00 0.00 C ATOM 423 C ASP A 43 3.286 -9.646 9.051 1.00 0.00 C ATOM 424 O ASP A 43 3.969 -9.402 8.075 1.00 0.00 O ATOM 425 CB ASP A 43 3.428 -11.498 10.751 1.00 0.00 C ATOM 426 CG ASP A 43 2.294 -11.531 11.777 1.00 0.00 C ATOM 427 OD1 ASP A 43 1.146 -11.516 11.362 1.00 0.00 O ATOM 428 OD2 ASP A 43 2.592 -11.570 12.959 1.00 0.00 O ATOM 0 H ASP A 43 4.379 -12.428 8.695 1.00 0.00 H new ATOM 0 HA ASP A 43 1.782 -11.110 9.370 1.00 0.00 H new ATOM 0 HB2 ASP A 43 3.897 -12.480 10.679 1.00 0.00 H new ATOM 0 HB3 ASP A 43 4.201 -10.798 11.070 1.00 0.00 H new ATOM 433 N LEU A 44 2.881 -8.692 9.845 1.00 0.00 N ATOM 434 CA LEU A 44 3.252 -7.287 9.565 1.00 0.00 C ATOM 435 C LEU A 44 3.388 -6.499 10.871 1.00 0.00 C ATOM 436 O LEU A 44 2.702 -6.757 11.840 1.00 0.00 O ATOM 437 CB LEU A 44 2.101 -6.738 8.722 1.00 0.00 C ATOM 438 CG LEU A 44 2.661 -6.011 7.499 1.00 0.00 C ATOM 439 CD1 LEU A 44 1.603 -5.068 6.938 1.00 0.00 C ATOM 440 CD2 LEU A 44 3.877 -5.193 7.920 1.00 0.00 C ATOM 0 H LEU A 44 2.307 -8.832 10.677 1.00 0.00 H new ATOM 0 HA LEU A 44 4.210 -7.208 9.051 1.00 0.00 H new ATOM 0 HB2 LEU A 44 1.448 -7.552 8.406 1.00 0.00 H new ATOM 0 HB3 LEU A 44 1.495 -6.055 9.317 1.00 0.00 H new ATOM 0 HG LEU A 44 2.943 -6.740 6.739 1.00 0.00 H new ATOM 0 HD11 LEU A 44 2.003 -4.550 6.066 1.00 0.00 H new ATOM 0 HD12 LEU A 44 0.722 -5.641 6.648 1.00 0.00 H new ATOM 0 HD13 LEU A 44 1.326 -4.338 7.699 1.00 0.00 H new ATOM 0 HD21 LEU A 44 4.282 -4.671 7.053 1.00 0.00 H new ATOM 0 HD22 LEU A 44 3.582 -4.465 8.676 1.00 0.00 H new ATOM 0 HD23 LEU A 44 4.637 -5.857 8.332 1.00 0.00 H new ATOM 452 N ASP A 45 4.273 -5.541 10.901 1.00 0.00 N ATOM 453 CA ASP A 45 4.463 -4.731 12.142 1.00 0.00 C ATOM 454 C ASP A 45 3.485 -3.552 12.172 1.00 0.00 C ATOM 455 O ASP A 45 3.100 -3.080 13.223 1.00 0.00 O ATOM 456 CB ASP A 45 5.906 -4.227 12.066 1.00 0.00 C ATOM 457 CG ASP A 45 6.832 -5.228 12.758 1.00 0.00 C ATOM 458 OD1 ASP A 45 6.401 -6.347 12.984 1.00 0.00 O ATOM 459 OD2 ASP A 45 7.957 -4.859 13.052 1.00 0.00 O ATOM 0 H ASP A 45 4.875 -5.282 10.119 1.00 0.00 H new ATOM 0 HA ASP A 45 4.277 -5.314 13.044 1.00 0.00 H new ATOM 0 HB2 ASP A 45 6.204 -4.099 11.025 1.00 0.00 H new ATOM 0 HB3 ASP A 45 5.987 -3.250 12.543 1.00 0.00 H new ATOM 464 N LYS A 46 3.087 -3.069 11.027 1.00 0.00 N ATOM 465 CA LYS A 46 2.140 -1.917 10.991 1.00 0.00 C ATOM 466 C LYS A 46 1.314 -1.958 9.703 1.00 0.00 C ATOM 467 O LYS A 46 1.717 -2.540 8.718 1.00 0.00 O ATOM 468 CB LYS A 46 3.030 -0.675 11.020 1.00 0.00 C ATOM 469 CG LYS A 46 3.527 -0.436 12.445 1.00 0.00 C ATOM 470 CD LYS A 46 4.909 -1.071 12.619 1.00 0.00 C ATOM 471 CE LYS A 46 5.982 0.018 12.566 1.00 0.00 C ATOM 472 NZ LYS A 46 5.884 0.718 13.878 1.00 0.00 N ATOM 0 H LYS A 46 3.376 -3.422 10.115 1.00 0.00 H new ATOM 0 HA LYS A 46 1.435 -1.931 11.822 1.00 0.00 H new ATOM 0 HB2 LYS A 46 3.876 -0.805 10.346 1.00 0.00 H new ATOM 0 HB3 LYS A 46 2.473 0.193 10.668 1.00 0.00 H new ATOM 0 HG2 LYS A 46 3.579 0.634 12.649 1.00 0.00 H new ATOM 0 HG3 LYS A 46 2.826 -0.863 13.162 1.00 0.00 H new ATOM 0 HD2 LYS A 46 4.960 -1.601 13.570 1.00 0.00 H new ATOM 0 HD3 LYS A 46 5.084 -1.807 11.834 1.00 0.00 H new ATOM 0 HE2 LYS A 46 6.973 -0.411 12.420 1.00 0.00 H new ATOM 0 HE3 LYS A 46 5.807 0.705 11.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 5.661 1.721 13.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 5.132 0.281 14.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 6.791 0.640 14.382 1.00 0.00 H new ATOM 486 N LYS A 47 0.161 -1.343 9.698 1.00 0.00 N ATOM 487 CA LYS A 47 -0.679 -1.355 8.466 1.00 0.00 C ATOM 488 C LYS A 47 -0.925 0.077 7.994 1.00 0.00 C ATOM 489 O LYS A 47 -2.024 0.445 7.626 1.00 0.00 O ATOM 490 CB LYS A 47 -1.992 -2.020 8.884 1.00 0.00 C ATOM 491 CG LYS A 47 -1.720 -3.458 9.333 1.00 0.00 C ATOM 492 CD LYS A 47 -1.322 -4.307 8.126 1.00 0.00 C ATOM 493 CE LYS A 47 -2.580 -4.726 7.363 1.00 0.00 C ATOM 494 NZ LYS A 47 -2.980 -6.027 7.967 1.00 0.00 N ATOM 0 H LYS A 47 -0.234 -0.835 10.490 1.00 0.00 H new ATOM 0 HA LYS A 47 -0.204 -1.887 7.642 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -2.455 -1.457 9.694 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -2.695 -2.015 8.051 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -0.925 -3.472 10.078 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -2.608 -3.876 9.807 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -0.658 -3.741 7.472 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -0.771 -5.189 8.453 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -3.371 -3.983 7.467 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -2.379 -4.831 6.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -3.786 -6.421 7.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -2.180 -6.691 7.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -3.253 -5.880 8.960 1.00 0.00 H new ATOM 508 N LYS A 48 0.095 0.888 8.001 1.00 0.00 N ATOM 509 CA LYS A 48 -0.067 2.300 7.552 1.00 0.00 C ATOM 510 C LYS A 48 1.291 2.868 7.132 1.00 0.00 C ATOM 511 O LYS A 48 2.161 3.094 7.949 1.00 0.00 O ATOM 512 CB LYS A 48 -0.610 3.046 8.772 1.00 0.00 C ATOM 513 CG LYS A 48 0.452 3.071 9.873 1.00 0.00 C ATOM 514 CD LYS A 48 -0.222 2.914 11.237 1.00 0.00 C ATOM 515 CE LYS A 48 -0.745 4.272 11.709 1.00 0.00 C ATOM 516 NZ LYS A 48 0.450 4.975 12.253 1.00 0.00 N ATOM 0 H LYS A 48 1.037 0.634 8.299 1.00 0.00 H new ATOM 0 HA LYS A 48 -0.734 2.392 6.694 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -0.886 4.064 8.496 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -1.514 2.559 9.136 1.00 0.00 H new ATOM 0 HG2 LYS A 48 1.172 2.268 9.717 1.00 0.00 H new ATOM 0 HG3 LYS A 48 1.007 4.008 9.836 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -1.043 2.200 11.168 1.00 0.00 H new ATOM 0 HD3 LYS A 48 0.488 2.514 11.961 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -1.192 4.831 10.887 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -1.516 4.155 12.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 0.368 5.050 13.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 1.308 4.439 12.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 0.510 5.928 11.841 1.00 0.00 H new ATOM 530 N TYR A 49 1.483 3.089 5.859 1.00 0.00 N ATOM 531 CA TYR A 49 2.790 3.630 5.388 1.00 0.00 C ATOM 532 C TYR A 49 2.673 5.111 5.035 1.00 0.00 C ATOM 533 O TYR A 49 1.657 5.572 4.557 1.00 0.00 O ATOM 534 CB TYR A 49 3.128 2.828 4.130 1.00 0.00 C ATOM 535 CG TYR A 49 3.467 1.407 4.506 1.00 0.00 C ATOM 536 CD1 TYR A 49 2.463 0.547 4.962 1.00 0.00 C ATOM 537 CD2 TYR A 49 4.785 0.952 4.398 1.00 0.00 C ATOM 538 CE1 TYR A 49 2.775 -0.771 5.314 1.00 0.00 C ATOM 539 CE2 TYR A 49 5.100 -0.367 4.748 1.00 0.00 C ATOM 540 CZ TYR A 49 4.095 -1.228 5.207 1.00 0.00 C ATOM 541 OH TYR A 49 4.404 -2.528 5.554 1.00 0.00 O ATOM 0 H TYR A 49 0.793 2.919 5.127 1.00 0.00 H new ATOM 0 HA TYR A 49 3.556 3.544 6.159 1.00 0.00 H new ATOM 0 HB2 TYR A 49 2.283 2.840 3.442 1.00 0.00 H new ATOM 0 HB3 TYR A 49 3.969 3.287 3.610 1.00 0.00 H new ATOM 0 HD1 TYR A 49 1.446 0.900 5.043 1.00 0.00 H new ATOM 0 HD2 TYR A 49 5.559 1.617 4.045 1.00 0.00 H new ATOM 0 HE1 TYR A 49 2.000 -1.435 5.667 1.00 0.00 H new ATOM 0 HE2 TYR A 49 6.117 -0.720 4.664 1.00 0.00 H new ATOM 0 HH TYR A 49 3.580 -3.054 5.620 1.00 0.00 H new ATOM 551 N LEU A 50 3.723 5.849 5.242 1.00 0.00 N ATOM 552 CA LEU A 50 3.716 7.297 4.896 1.00 0.00 C ATOM 553 C LEU A 50 4.820 7.542 3.870 1.00 0.00 C ATOM 554 O LEU A 50 5.988 7.373 4.159 1.00 0.00 O ATOM 555 CB LEU A 50 4.018 8.028 6.204 1.00 0.00 C ATOM 556 CG LEU A 50 2.726 8.201 7.004 1.00 0.00 C ATOM 557 CD1 LEU A 50 2.857 7.482 8.348 1.00 0.00 C ATOM 558 CD2 LEU A 50 2.473 9.691 7.246 1.00 0.00 C ATOM 0 H LEU A 50 4.598 5.508 5.641 1.00 0.00 H new ATOM 0 HA LEU A 50 2.772 7.638 4.471 1.00 0.00 H new ATOM 0 HB2 LEU A 50 4.746 7.465 6.787 1.00 0.00 H new ATOM 0 HB3 LEU A 50 4.461 9.002 5.995 1.00 0.00 H new ATOM 0 HG LEU A 50 1.893 7.776 6.445 1.00 0.00 H new ATOM 0 HD11 LEU A 50 1.936 7.605 8.918 1.00 0.00 H new ATOM 0 HD12 LEU A 50 3.038 6.421 8.177 1.00 0.00 H new ATOM 0 HD13 LEU A 50 3.690 7.907 8.908 1.00 0.00 H new ATOM 0 HD21 LEU A 50 1.552 9.816 7.816 1.00 0.00 H new ATOM 0 HD22 LEU A 50 3.307 10.115 7.805 1.00 0.00 H new ATOM 0 HD23 LEU A 50 2.380 10.204 6.289 1.00 0.00 H new ATOM 570 N VAL A 51 4.478 7.909 2.666 1.00 0.00 N ATOM 571 CA VAL A 51 5.548 8.116 1.648 1.00 0.00 C ATOM 572 C VAL A 51 5.236 9.325 0.768 1.00 0.00 C ATOM 573 O VAL A 51 4.127 9.812 0.760 1.00 0.00 O ATOM 574 CB VAL A 51 5.551 6.823 0.826 1.00 0.00 C ATOM 575 CG1 VAL A 51 5.452 5.613 1.763 1.00 0.00 C ATOM 576 CG2 VAL A 51 4.353 6.824 -0.129 1.00 0.00 C ATOM 0 H VAL A 51 3.523 8.072 2.346 1.00 0.00 H new ATOM 0 HA VAL A 51 6.518 8.318 2.102 1.00 0.00 H new ATOM 0 HB VAL A 51 6.477 6.762 0.254 1.00 0.00 H new ATOM 0 HG11 VAL A 51 5.454 4.696 1.174 1.00 0.00 H new ATOM 0 HG12 VAL A 51 6.303 5.609 2.444 1.00 0.00 H new ATOM 0 HG13 VAL A 51 4.528 5.673 2.338 1.00 0.00 H new ATOM 0 HG21 VAL A 51 4.354 5.905 -0.715 1.00 0.00 H new ATOM 0 HG22 VAL A 51 3.429 6.887 0.446 1.00 0.00 H new ATOM 0 HG23 VAL A 51 4.422 7.681 -0.799 1.00 0.00 H new ATOM 586 N PRO A 52 6.237 9.768 0.054 1.00 0.00 N ATOM 587 CA PRO A 52 6.075 10.939 -0.844 1.00 0.00 C ATOM 588 C PRO A 52 5.173 10.582 -2.034 1.00 0.00 C ATOM 589 O PRO A 52 5.136 9.453 -2.484 1.00 0.00 O ATOM 590 CB PRO A 52 7.507 11.246 -1.287 1.00 0.00 C ATOM 591 CG PRO A 52 8.241 9.955 -1.137 1.00 0.00 C ATOM 592 CD PRO A 52 7.600 9.224 0.013 1.00 0.00 C ATOM 0 HA PRO A 52 5.598 11.794 -0.365 1.00 0.00 H new ATOM 0 HB2 PRO A 52 7.534 11.599 -2.318 1.00 0.00 H new ATOM 0 HB3 PRO A 52 7.952 12.027 -0.671 1.00 0.00 H new ATOM 0 HG2 PRO A 52 8.180 9.366 -2.052 1.00 0.00 H new ATOM 0 HG3 PRO A 52 9.299 10.132 -0.942 1.00 0.00 H new ATOM 0 HD2 PRO A 52 7.596 8.146 -0.150 1.00 0.00 H new ATOM 0 HD3 PRO A 52 8.131 9.404 0.948 1.00 0.00 H new ATOM 600 N SER A 53 4.429 11.536 -2.525 1.00 0.00 N ATOM 601 CA SER A 53 3.503 11.270 -3.667 1.00 0.00 C ATOM 602 C SER A 53 4.277 10.907 -4.940 1.00 0.00 C ATOM 603 O SER A 53 3.709 10.445 -5.910 1.00 0.00 O ATOM 604 CB SER A 53 2.738 12.581 -3.864 1.00 0.00 C ATOM 605 OG SER A 53 2.643 13.266 -2.622 1.00 0.00 O ATOM 0 H SER A 53 4.422 12.497 -2.182 1.00 0.00 H new ATOM 0 HA SER A 53 2.843 10.427 -3.461 1.00 0.00 H new ATOM 0 HB2 SER A 53 3.248 13.205 -4.598 1.00 0.00 H new ATOM 0 HB3 SER A 53 1.742 12.378 -4.256 1.00 0.00 H new ATOM 0 HG SER A 53 2.155 14.106 -2.748 1.00 0.00 H new ATOM 611 N ASP A 54 5.561 11.119 -4.951 1.00 0.00 N ATOM 612 CA ASP A 54 6.360 10.792 -6.167 1.00 0.00 C ATOM 613 C ASP A 54 6.752 9.310 -6.182 1.00 0.00 C ATOM 614 O ASP A 54 7.329 8.824 -7.134 1.00 0.00 O ATOM 615 CB ASP A 54 7.608 11.672 -6.070 1.00 0.00 C ATOM 616 CG ASP A 54 7.978 12.190 -7.461 1.00 0.00 C ATOM 617 OD1 ASP A 54 7.505 11.619 -8.430 1.00 0.00 O ATOM 618 OD2 ASP A 54 8.728 13.149 -7.533 1.00 0.00 O ATOM 0 H ASP A 54 6.094 11.505 -4.172 1.00 0.00 H new ATOM 0 HA ASP A 54 5.796 10.973 -7.082 1.00 0.00 H new ATOM 0 HB2 ASP A 54 7.424 12.509 -5.396 1.00 0.00 H new ATOM 0 HB3 ASP A 54 8.437 11.101 -5.651 1.00 0.00 H new ATOM 623 N LEU A 55 6.456 8.584 -5.136 1.00 0.00 N ATOM 624 CA LEU A 55 6.834 7.139 -5.111 1.00 0.00 C ATOM 625 C LEU A 55 6.139 6.370 -6.230 1.00 0.00 C ATOM 626 O LEU A 55 4.987 6.593 -6.533 1.00 0.00 O ATOM 627 CB LEU A 55 6.352 6.596 -3.764 1.00 0.00 C ATOM 628 CG LEU A 55 7.537 6.399 -2.821 1.00 0.00 C ATOM 629 CD1 LEU A 55 7.095 5.541 -1.636 1.00 0.00 C ATOM 630 CD2 LEU A 55 8.680 5.686 -3.548 1.00 0.00 C ATOM 0 H LEU A 55 5.973 8.925 -4.305 1.00 0.00 H new ATOM 0 HA LEU A 55 7.909 7.025 -5.247 1.00 0.00 H new ATOM 0 HB2 LEU A 55 5.636 7.287 -3.320 1.00 0.00 H new ATOM 0 HB3 LEU A 55 5.833 5.649 -3.910 1.00 0.00 H new ATOM 0 HG LEU A 55 7.883 7.374 -2.477 1.00 0.00 H new ATOM 0 HD11 LEU A 55 7.936 5.396 -0.958 1.00 0.00 H new ATOM 0 HD12 LEU A 55 6.284 6.042 -1.107 1.00 0.00 H new ATOM 0 HD13 LEU A 55 6.749 4.573 -1.997 1.00 0.00 H new ATOM 0 HD21 LEU A 55 9.518 5.552 -2.864 1.00 0.00 H new ATOM 0 HD22 LEU A 55 8.337 4.712 -3.898 1.00 0.00 H new ATOM 0 HD23 LEU A 55 8.999 6.286 -4.400 1.00 0.00 H new ATOM 642 N THR A 56 6.833 5.448 -6.826 1.00 0.00 N ATOM 643 CA THR A 56 6.219 4.630 -7.907 1.00 0.00 C ATOM 644 C THR A 56 5.611 3.356 -7.309 1.00 0.00 C ATOM 645 O THR A 56 5.970 2.931 -6.222 1.00 0.00 O ATOM 646 CB THR A 56 7.367 4.286 -8.859 1.00 0.00 C ATOM 647 OG1 THR A 56 8.574 4.166 -8.120 1.00 0.00 O ATOM 648 CG2 THR A 56 7.516 5.391 -9.906 1.00 0.00 C ATOM 0 H THR A 56 7.804 5.223 -6.612 1.00 0.00 H new ATOM 0 HA THR A 56 5.418 5.159 -8.424 1.00 0.00 H new ATOM 0 HB THR A 56 7.151 3.342 -9.360 1.00 0.00 H new ATOM 0 HG1 THR A 56 9.309 3.944 -8.728 1.00 0.00 H new ATOM 0 HG21 THR A 56 8.334 5.143 -10.582 1.00 0.00 H new ATOM 0 HG22 THR A 56 6.590 5.481 -10.474 1.00 0.00 H new ATOM 0 HG23 THR A 56 7.730 6.337 -9.409 1.00 0.00 H new ATOM 656 N VAL A 57 4.701 2.737 -8.006 1.00 0.00 N ATOM 657 CA VAL A 57 4.084 1.491 -7.475 1.00 0.00 C ATOM 658 C VAL A 57 5.172 0.445 -7.221 1.00 0.00 C ATOM 659 O VAL A 57 5.031 -0.424 -6.382 1.00 0.00 O ATOM 660 CB VAL A 57 3.131 1.022 -8.573 1.00 0.00 C ATOM 661 CG1 VAL A 57 2.526 -0.327 -8.181 1.00 0.00 C ATOM 662 CG2 VAL A 57 2.011 2.050 -8.747 1.00 0.00 C ATOM 0 H VAL A 57 4.358 3.039 -8.918 1.00 0.00 H new ATOM 0 HA VAL A 57 3.563 1.650 -6.531 1.00 0.00 H new ATOM 0 HB VAL A 57 3.679 0.917 -9.510 1.00 0.00 H new ATOM 0 HG11 VAL A 57 1.846 -0.662 -8.964 1.00 0.00 H new ATOM 0 HG12 VAL A 57 3.323 -1.060 -8.054 1.00 0.00 H new ATOM 0 HG13 VAL A 57 1.978 -0.222 -7.245 1.00 0.00 H new ATOM 0 HG21 VAL A 57 1.330 1.717 -9.530 1.00 0.00 H new ATOM 0 HG22 VAL A 57 1.464 2.154 -7.810 1.00 0.00 H new ATOM 0 HG23 VAL A 57 2.441 3.013 -9.025 1.00 0.00 H new ATOM 672 N GLY A 58 6.261 0.525 -7.938 1.00 0.00 N ATOM 673 CA GLY A 58 7.362 -0.459 -7.739 1.00 0.00 C ATOM 674 C GLY A 58 8.044 -0.199 -6.394 1.00 0.00 C ATOM 675 O GLY A 58 8.526 -1.107 -5.747 1.00 0.00 O ATOM 0 H GLY A 58 6.435 1.231 -8.654 1.00 0.00 H new ATOM 0 HA2 GLY A 58 6.966 -1.474 -7.767 1.00 0.00 H new ATOM 0 HA3 GLY A 58 8.088 -0.377 -8.548 1.00 0.00 H new ATOM 679 N GLN A 59 8.082 1.034 -5.966 1.00 0.00 N ATOM 680 CA GLN A 59 8.728 1.348 -4.657 1.00 0.00 C ATOM 681 C GLN A 59 7.881 0.784 -3.521 1.00 0.00 C ATOM 682 O GLN A 59 8.369 0.084 -2.653 1.00 0.00 O ATOM 683 CB GLN A 59 8.772 2.871 -4.579 1.00 0.00 C ATOM 684 CG GLN A 59 9.687 3.405 -5.676 1.00 0.00 C ATOM 685 CD GLN A 59 11.137 3.031 -5.361 1.00 0.00 C ATOM 686 OE1 GLN A 59 11.606 1.984 -5.762 1.00 0.00 O ATOM 687 NE2 GLN A 59 11.871 3.846 -4.653 1.00 0.00 N ATOM 0 H GLN A 59 7.695 1.836 -6.464 1.00 0.00 H new ATOM 0 HA GLN A 59 9.724 0.914 -4.573 1.00 0.00 H new ATOM 0 HB2 GLN A 59 7.769 3.282 -4.694 1.00 0.00 H new ATOM 0 HB3 GLN A 59 9.135 3.186 -3.601 1.00 0.00 H new ATOM 0 HG2 GLN A 59 9.395 2.990 -6.641 1.00 0.00 H new ATOM 0 HG3 GLN A 59 9.588 4.488 -5.751 1.00 0.00 H new ATOM 0 HE21 GLN A 59 11.478 4.725 -4.316 1.00 0.00 H new ATOM 0 HE22 GLN A 59 12.838 3.604 -4.436 1.00 0.00 H new ATOM 696 N PHE A 60 6.612 1.080 -3.520 1.00 0.00 N ATOM 697 CA PHE A 60 5.745 0.546 -2.429 1.00 0.00 C ATOM 698 C PHE A 60 5.783 -0.985 -2.451 1.00 0.00 C ATOM 699 O PHE A 60 5.729 -1.635 -1.426 1.00 0.00 O ATOM 700 CB PHE A 60 4.335 1.058 -2.717 1.00 0.00 C ATOM 701 CG PHE A 60 3.533 0.961 -1.444 1.00 0.00 C ATOM 702 CD1 PHE A 60 4.054 1.490 -0.259 1.00 0.00 C ATOM 703 CD2 PHE A 60 2.290 0.320 -1.437 1.00 0.00 C ATOM 704 CE1 PHE A 60 3.334 1.383 0.935 1.00 0.00 C ATOM 705 CE2 PHE A 60 1.571 0.207 -0.241 1.00 0.00 C ATOM 706 CZ PHE A 60 2.097 0.739 0.944 1.00 0.00 C ATOM 0 H PHE A 60 6.141 1.659 -4.215 1.00 0.00 H new ATOM 0 HA PHE A 60 6.080 0.870 -1.443 1.00 0.00 H new ATOM 0 HB2 PHE A 60 4.369 2.089 -3.068 1.00 0.00 H new ATOM 0 HB3 PHE A 60 3.869 0.468 -3.506 1.00 0.00 H new ATOM 0 HD1 PHE A 60 5.015 1.983 -0.266 1.00 0.00 H new ATOM 0 HD2 PHE A 60 1.886 -0.087 -2.352 1.00 0.00 H new ATOM 0 HE1 PHE A 60 3.735 1.798 1.848 1.00 0.00 H new ATOM 0 HE2 PHE A 60 0.612 -0.290 -0.232 1.00 0.00 H new ATOM 0 HZ PHE A 60 1.543 0.650 1.867 1.00 0.00 H new ATOM 716 N TYR A 61 5.901 -1.561 -3.613 1.00 0.00 N ATOM 717 CA TYR A 61 5.973 -3.044 -3.721 1.00 0.00 C ATOM 718 C TYR A 61 7.120 -3.578 -2.854 1.00 0.00 C ATOM 719 O TYR A 61 7.044 -4.653 -2.288 1.00 0.00 O ATOM 720 CB TYR A 61 6.284 -3.274 -5.202 1.00 0.00 C ATOM 721 CG TYR A 61 5.273 -4.210 -5.817 1.00 0.00 C ATOM 722 CD1 TYR A 61 5.371 -5.585 -5.597 1.00 0.00 C ATOM 723 CD2 TYR A 61 4.242 -3.699 -6.613 1.00 0.00 C ATOM 724 CE1 TYR A 61 4.437 -6.456 -6.171 1.00 0.00 C ATOM 725 CE2 TYR A 61 3.307 -4.567 -7.188 1.00 0.00 C ATOM 726 CZ TYR A 61 3.405 -5.946 -6.967 1.00 0.00 C ATOM 727 OH TYR A 61 2.483 -6.804 -7.534 1.00 0.00 O ATOM 0 H TYR A 61 5.951 -1.063 -4.502 1.00 0.00 H new ATOM 0 HA TYR A 61 5.064 -3.545 -3.389 1.00 0.00 H new ATOM 0 HB2 TYR A 61 6.277 -2.322 -5.733 1.00 0.00 H new ATOM 0 HB3 TYR A 61 7.286 -3.691 -5.309 1.00 0.00 H new ATOM 0 HD1 TYR A 61 6.168 -5.977 -4.983 1.00 0.00 H new ATOM 0 HD2 TYR A 61 4.168 -2.635 -6.784 1.00 0.00 H new ATOM 0 HE1 TYR A 61 4.513 -7.520 -6.000 1.00 0.00 H new ATOM 0 HE2 TYR A 61 2.510 -4.173 -7.802 1.00 0.00 H new ATOM 0 HH TYR A 61 1.833 -6.288 -8.055 1.00 0.00 H new ATOM 737 N PHE A 62 8.191 -2.837 -2.770 1.00 0.00 N ATOM 738 CA PHE A 62 9.370 -3.295 -1.979 1.00 0.00 C ATOM 739 C PHE A 62 9.196 -3.067 -0.472 1.00 0.00 C ATOM 740 O PHE A 62 9.446 -3.953 0.320 1.00 0.00 O ATOM 741 CB PHE A 62 10.536 -2.463 -2.508 1.00 0.00 C ATOM 742 CG PHE A 62 11.776 -3.320 -2.579 1.00 0.00 C ATOM 743 CD1 PHE A 62 12.625 -3.414 -1.470 1.00 0.00 C ATOM 744 CD2 PHE A 62 12.077 -4.021 -3.753 1.00 0.00 C ATOM 745 CE1 PHE A 62 13.776 -4.210 -1.536 1.00 0.00 C ATOM 746 CE2 PHE A 62 13.228 -4.816 -3.818 1.00 0.00 C ATOM 747 CZ PHE A 62 14.077 -4.911 -2.709 1.00 0.00 C ATOM 0 H PHE A 62 8.301 -1.927 -3.218 1.00 0.00 H new ATOM 0 HA PHE A 62 9.520 -4.369 -2.092 1.00 0.00 H new ATOM 0 HB2 PHE A 62 10.297 -2.069 -3.496 1.00 0.00 H new ATOM 0 HB3 PHE A 62 10.710 -1.606 -1.857 1.00 0.00 H new ATOM 0 HD1 PHE A 62 12.393 -2.873 -0.564 1.00 0.00 H new ATOM 0 HD2 PHE A 62 11.422 -3.949 -4.608 1.00 0.00 H new ATOM 0 HE1 PHE A 62 14.432 -4.283 -0.681 1.00 0.00 H new ATOM 0 HE2 PHE A 62 13.461 -5.356 -4.724 1.00 0.00 H new ATOM 0 HZ PHE A 62 14.964 -5.525 -2.759 1.00 0.00 H new ATOM 757 N LEU A 63 8.821 -1.888 -0.050 1.00 0.00 N ATOM 758 CA LEU A 63 8.710 -1.662 1.428 1.00 0.00 C ATOM 759 C LEU A 63 7.718 -2.632 2.083 1.00 0.00 C ATOM 760 O LEU A 63 7.988 -3.142 3.151 1.00 0.00 O ATOM 761 CB LEU A 63 8.306 -0.196 1.660 1.00 0.00 C ATOM 762 CG LEU A 63 7.172 0.247 0.736 1.00 0.00 C ATOM 763 CD1 LEU A 63 5.871 0.332 1.538 1.00 0.00 C ATOM 764 CD2 LEU A 63 7.522 1.633 0.181 1.00 0.00 C ATOM 0 H LEU A 63 8.592 -1.090 -0.642 1.00 0.00 H new ATOM 0 HA LEU A 63 9.673 -1.858 1.899 1.00 0.00 H new ATOM 0 HB2 LEU A 63 7.998 -0.066 2.697 1.00 0.00 H new ATOM 0 HB3 LEU A 63 9.172 0.447 1.502 1.00 0.00 H new ATOM 0 HG LEU A 63 7.044 -0.465 -0.079 1.00 0.00 H new ATOM 0 HD11 LEU A 63 5.059 0.648 0.882 1.00 0.00 H new ATOM 0 HD12 LEU A 63 5.638 -0.646 1.958 1.00 0.00 H new ATOM 0 HD13 LEU A 63 5.988 1.055 2.345 1.00 0.00 H new ATOM 0 HD21 LEU A 63 6.726 1.971 -0.483 1.00 0.00 H new ATOM 0 HD22 LEU A 63 7.631 2.338 1.005 1.00 0.00 H new ATOM 0 HD23 LEU A 63 8.458 1.577 -0.375 1.00 0.00 H new ATOM 776 N ILE A 64 6.598 -2.938 1.479 1.00 0.00 N ATOM 777 CA ILE A 64 5.696 -3.922 2.157 1.00 0.00 C ATOM 778 C ILE A 64 6.281 -5.323 1.970 1.00 0.00 C ATOM 779 O ILE A 64 6.314 -6.117 2.886 1.00 0.00 O ATOM 780 CB ILE A 64 4.303 -3.856 1.516 1.00 0.00 C ATOM 781 CG1 ILE A 64 3.974 -2.433 1.040 1.00 0.00 C ATOM 782 CG2 ILE A 64 3.275 -4.306 2.558 1.00 0.00 C ATOM 783 CD1 ILE A 64 2.458 -2.268 0.857 1.00 0.00 C ATOM 0 H ILE A 64 6.277 -2.569 0.584 1.00 0.00 H new ATOM 0 HA ILE A 64 5.613 -3.691 3.219 1.00 0.00 H new ATOM 0 HB ILE A 64 4.279 -4.509 0.643 1.00 0.00 H new ATOM 0 HG12 ILE A 64 4.341 -1.706 1.765 1.00 0.00 H new ATOM 0 HG13 ILE A 64 4.485 -2.230 0.099 1.00 0.00 H new ATOM 0 HG21 ILE A 64 2.276 -4.267 2.124 1.00 0.00 H new ATOM 0 HG22 ILE A 64 3.496 -5.327 2.870 1.00 0.00 H new ATOM 0 HG23 ILE A 64 3.321 -3.645 3.423 1.00 0.00 H new ATOM 0 HD11 ILE A 64 2.240 -1.255 0.520 1.00 0.00 H new ATOM 0 HD12 ILE A 64 2.101 -2.982 0.115 1.00 0.00 H new ATOM 0 HD13 ILE A 64 1.955 -2.450 1.807 1.00 0.00 H new ATOM 795 N ARG A 65 6.745 -5.620 0.781 1.00 0.00 N ATOM 796 CA ARG A 65 7.343 -6.968 0.510 1.00 0.00 C ATOM 797 C ARG A 65 8.113 -7.479 1.732 1.00 0.00 C ATOM 798 O ARG A 65 7.785 -8.503 2.297 1.00 0.00 O ATOM 799 CB ARG A 65 8.300 -6.744 -0.662 1.00 0.00 C ATOM 800 CG ARG A 65 7.874 -7.612 -1.850 1.00 0.00 C ATOM 801 CD ARG A 65 8.867 -7.423 -3.000 1.00 0.00 C ATOM 802 NE ARG A 65 8.085 -7.702 -4.237 1.00 0.00 N ATOM 803 CZ ARG A 65 8.360 -7.062 -5.341 1.00 0.00 C ATOM 804 NH1 ARG A 65 8.609 -5.781 -5.310 1.00 0.00 N ATOM 805 NH2 ARG A 65 8.387 -7.703 -6.478 1.00 0.00 N ATOM 0 H ARG A 65 6.736 -4.986 -0.018 1.00 0.00 H new ATOM 0 HA ARG A 65 6.579 -7.713 0.288 1.00 0.00 H new ATOM 0 HB2 ARG A 65 8.299 -5.692 -0.949 1.00 0.00 H new ATOM 0 HB3 ARG A 65 9.319 -6.992 -0.365 1.00 0.00 H new ATOM 0 HG2 ARG A 65 7.839 -8.660 -1.554 1.00 0.00 H new ATOM 0 HG3 ARG A 65 6.870 -7.338 -2.173 1.00 0.00 H new ATOM 0 HD2 ARG A 65 9.272 -6.411 -3.009 1.00 0.00 H new ATOM 0 HD3 ARG A 65 9.713 -8.104 -2.906 1.00 0.00 H new ATOM 0 HE ARG A 65 7.335 -8.393 -4.221 1.00 0.00 H new ATOM 0 HH11 ARG A 65 8.589 -5.279 -4.422 1.00 0.00 H new ATOM 0 HH12 ARG A 65 8.824 -5.282 -6.173 1.00 0.00 H new ATOM 0 HH21 ARG A 65 8.193 -8.704 -6.504 1.00 0.00 H new ATOM 0 HH22 ARG A 65 8.602 -7.203 -7.341 1.00 0.00 H new ATOM 817 N LYS A 66 9.134 -6.780 2.145 1.00 0.00 N ATOM 818 CA LYS A 66 9.912 -7.238 3.333 1.00 0.00 C ATOM 819 C LYS A 66 9.037 -7.175 4.583 1.00 0.00 C ATOM 820 O LYS A 66 9.161 -7.982 5.482 1.00 0.00 O ATOM 821 CB LYS A 66 11.086 -6.264 3.442 1.00 0.00 C ATOM 822 CG LYS A 66 12.337 -6.903 2.838 1.00 0.00 C ATOM 823 CD LYS A 66 12.732 -6.150 1.566 1.00 0.00 C ATOM 824 CE LYS A 66 13.879 -6.886 0.870 1.00 0.00 C ATOM 825 NZ LYS A 66 13.214 -7.878 -0.021 1.00 0.00 N ATOM 0 H LYS A 66 9.463 -5.916 1.715 1.00 0.00 H new ATOM 0 HA LYS A 66 10.254 -8.268 3.235 1.00 0.00 H new ATOM 0 HB2 LYS A 66 10.851 -5.336 2.921 1.00 0.00 H new ATOM 0 HB3 LYS A 66 11.264 -6.008 4.486 1.00 0.00 H new ATOM 0 HG2 LYS A 66 13.155 -6.877 3.558 1.00 0.00 H new ATOM 0 HG3 LYS A 66 12.148 -7.952 2.609 1.00 0.00 H new ATOM 0 HD2 LYS A 66 11.876 -6.073 0.896 1.00 0.00 H new ATOM 0 HD3 LYS A 66 13.036 -5.133 1.813 1.00 0.00 H new ATOM 0 HE2 LYS A 66 14.501 -6.197 0.299 1.00 0.00 H new ATOM 0 HE3 LYS A 66 14.529 -7.378 1.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 13.936 -8.423 -0.534 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 12.634 -8.524 0.551 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 12.607 -7.380 -0.703 1.00 0.00 H new ATOM 839 N ARG A 67 8.145 -6.226 4.644 1.00 0.00 N ATOM 840 CA ARG A 67 7.256 -6.122 5.833 1.00 0.00 C ATOM 841 C ARG A 67 6.266 -7.291 5.839 1.00 0.00 C ATOM 842 O ARG A 67 5.576 -7.528 6.810 1.00 0.00 O ATOM 843 CB ARG A 67 6.523 -4.792 5.667 1.00 0.00 C ATOM 844 CG ARG A 67 7.471 -3.640 6.010 1.00 0.00 C ATOM 845 CD ARG A 67 6.971 -2.920 7.265 1.00 0.00 C ATOM 846 NE ARG A 67 8.190 -2.695 8.091 1.00 0.00 N ATOM 847 CZ ARG A 67 9.153 -1.937 7.642 1.00 0.00 C ATOM 848 NH1 ARG A 67 8.910 -0.697 7.318 1.00 0.00 N ATOM 849 NH2 ARG A 67 10.360 -2.420 7.517 1.00 0.00 N ATOM 0 H ARG A 67 7.994 -5.520 3.924 1.00 0.00 H new ATOM 0 HA ARG A 67 7.806 -6.161 6.773 1.00 0.00 H new ATOM 0 HB2 ARG A 67 6.163 -4.688 4.643 1.00 0.00 H new ATOM 0 HB3 ARG A 67 5.648 -4.763 6.317 1.00 0.00 H new ATOM 0 HG2 ARG A 67 8.479 -4.022 6.175 1.00 0.00 H new ATOM 0 HG3 ARG A 67 7.527 -2.941 5.175 1.00 0.00 H new ATOM 0 HD2 ARG A 67 6.486 -1.977 7.012 1.00 0.00 H new ATOM 0 HD3 ARG A 67 6.237 -3.523 7.800 1.00 0.00 H new ATOM 0 HE ARG A 67 8.272 -3.134 9.008 1.00 0.00 H new ATOM 0 HH11 ARG A 67 7.967 -0.320 7.416 1.00 0.00 H new ATOM 0 HH12 ARG A 67 9.663 -0.105 6.967 1.00 0.00 H new ATOM 0 HH21 ARG A 67 10.550 -3.390 7.770 1.00 0.00 H new ATOM 0 HH22 ARG A 67 11.113 -1.828 7.166 1.00 0.00 H new ATOM 861 N ILE A 68 6.203 -8.034 4.763 1.00 0.00 N ATOM 862 CA ILE A 68 5.272 -9.195 4.715 1.00 0.00 C ATOM 863 C ILE A 68 6.052 -10.484 4.976 1.00 0.00 C ATOM 864 O ILE A 68 5.533 -11.575 4.854 1.00 0.00 O ATOM 865 CB ILE A 68 4.694 -9.193 3.296 1.00 0.00 C ATOM 866 CG1 ILE A 68 3.855 -7.925 3.063 1.00 0.00 C ATOM 867 CG2 ILE A 68 3.806 -10.423 3.106 1.00 0.00 C ATOM 868 CD1 ILE A 68 3.095 -7.546 4.339 1.00 0.00 C ATOM 0 H ILE A 68 6.756 -7.885 3.919 1.00 0.00 H new ATOM 0 HA ILE A 68 4.485 -9.131 5.466 1.00 0.00 H new ATOM 0 HB ILE A 68 5.517 -9.213 2.581 1.00 0.00 H new ATOM 0 HG12 ILE A 68 4.503 -7.103 2.760 1.00 0.00 H new ATOM 0 HG13 ILE A 68 3.150 -8.092 2.248 1.00 0.00 H new ATOM 0 HG21 ILE A 68 3.394 -10.422 2.097 1.00 0.00 H new ATOM 0 HG22 ILE A 68 4.398 -11.326 3.256 1.00 0.00 H new ATOM 0 HG23 ILE A 68 2.991 -10.399 3.830 1.00 0.00 H new ATOM 0 HD11 ILE A 68 2.506 -6.647 4.158 1.00 0.00 H new ATOM 0 HD12 ILE A 68 2.432 -8.363 4.624 1.00 0.00 H new ATOM 0 HD13 ILE A 68 3.806 -7.358 5.144 1.00 0.00 H new ATOM 880 N HIS A 69 7.301 -10.361 5.335 1.00 0.00 N ATOM 881 CA HIS A 69 8.124 -11.566 5.610 1.00 0.00 C ATOM 882 C HIS A 69 8.099 -12.513 4.412 1.00 0.00 C ATOM 883 O HIS A 69 8.199 -13.715 4.556 1.00 0.00 O ATOM 884 CB HIS A 69 7.481 -12.215 6.832 1.00 0.00 C ATOM 885 CG HIS A 69 7.368 -11.203 7.939 1.00 0.00 C ATOM 886 ND1 HIS A 69 7.996 -9.968 7.881 1.00 0.00 N ATOM 887 CD2 HIS A 69 6.706 -11.228 9.141 1.00 0.00 C ATOM 888 CE1 HIS A 69 7.702 -9.309 9.015 1.00 0.00 C ATOM 889 NE2 HIS A 69 6.918 -10.032 9.820 1.00 0.00 N ATOM 0 H HIS A 69 7.786 -9.471 5.449 1.00 0.00 H new ATOM 0 HA HIS A 69 9.171 -11.319 5.788 1.00 0.00 H new ATOM 0 HB2 HIS A 69 6.494 -12.600 6.575 1.00 0.00 H new ATOM 0 HB3 HIS A 69 8.079 -13.065 7.162 1.00 0.00 H new ATOM 0 HD2 HIS A 69 6.110 -12.052 9.505 1.00 0.00 H new ATOM 0 HE1 HIS A 69 8.056 -8.316 9.247 1.00 0.00 H new ATOM 0 HE2 HIS A 69 6.554 -9.765 10.735 1.00 0.00 H new ATOM 897 N LEU A 70 7.984 -11.978 3.233 1.00 0.00 N ATOM 898 CA LEU A 70 7.976 -12.853 2.026 1.00 0.00 C ATOM 899 C LEU A 70 9.262 -12.646 1.227 1.00 0.00 C ATOM 900 O LEU A 70 9.857 -11.586 1.253 1.00 0.00 O ATOM 901 CB LEU A 70 6.747 -12.453 1.207 1.00 0.00 C ATOM 902 CG LEU A 70 6.845 -10.990 0.756 1.00 0.00 C ATOM 903 CD1 LEU A 70 7.831 -10.875 -0.408 1.00 0.00 C ATOM 904 CD2 LEU A 70 5.466 -10.513 0.295 1.00 0.00 C ATOM 0 H LEU A 70 7.895 -10.979 3.050 1.00 0.00 H new ATOM 0 HA LEU A 70 7.929 -13.909 2.293 1.00 0.00 H new ATOM 0 HB2 LEU A 70 6.658 -13.102 0.336 1.00 0.00 H new ATOM 0 HB3 LEU A 70 5.845 -12.595 1.803 1.00 0.00 H new ATOM 0 HG LEU A 70 7.192 -10.376 1.587 1.00 0.00 H new ATOM 0 HD11 LEU A 70 7.899 -9.835 -0.726 1.00 0.00 H new ATOM 0 HD12 LEU A 70 8.814 -11.221 -0.088 1.00 0.00 H new ATOM 0 HD13 LEU A 70 7.484 -11.487 -1.240 1.00 0.00 H new ATOM 0 HD21 LEU A 70 5.529 -9.474 -0.027 1.00 0.00 H new ATOM 0 HD22 LEU A 70 5.127 -11.130 -0.537 1.00 0.00 H new ATOM 0 HD23 LEU A 70 4.758 -10.595 1.120 1.00 0.00 H new ATOM 916 N ARG A 71 9.706 -13.656 0.534 1.00 0.00 N ATOM 917 CA ARG A 71 10.970 -13.518 -0.249 1.00 0.00 C ATOM 918 C ARG A 71 11.140 -14.685 -1.229 1.00 0.00 C ATOM 919 O ARG A 71 10.230 -15.457 -1.455 1.00 0.00 O ATOM 920 CB ARG A 71 12.072 -13.549 0.815 1.00 0.00 C ATOM 921 CG ARG A 71 12.284 -14.990 1.296 1.00 0.00 C ATOM 922 CD ARG A 71 13.559 -15.062 2.142 1.00 0.00 C ATOM 923 NE ARG A 71 13.113 -15.584 3.462 1.00 0.00 N ATOM 924 CZ ARG A 71 13.780 -16.544 4.043 1.00 0.00 C ATOM 925 NH1 ARG A 71 13.527 -17.789 3.744 1.00 0.00 N ATOM 926 NH2 ARG A 71 14.701 -16.259 4.923 1.00 0.00 N ATOM 0 H ARG A 71 9.253 -14.568 0.474 1.00 0.00 H new ATOM 0 HA ARG A 71 10.987 -12.610 -0.852 1.00 0.00 H new ATOM 0 HB2 ARG A 71 13.000 -13.152 0.403 1.00 0.00 H new ATOM 0 HB3 ARG A 71 11.798 -12.911 1.655 1.00 0.00 H new ATOM 0 HG2 ARG A 71 11.426 -15.319 1.883 1.00 0.00 H new ATOM 0 HG3 ARG A 71 12.363 -15.662 0.442 1.00 0.00 H new ATOM 0 HD2 ARG A 71 14.299 -15.720 1.686 1.00 0.00 H new ATOM 0 HD3 ARG A 71 14.023 -14.081 2.241 1.00 0.00 H new ATOM 0 HE ARG A 71 12.286 -15.192 3.913 1.00 0.00 H new ATOM 0 HH11 ARG A 71 12.808 -18.012 3.056 1.00 0.00 H new ATOM 0 HH12 ARG A 71 14.049 -18.539 4.198 1.00 0.00 H new ATOM 0 HH21 ARG A 71 14.899 -15.286 5.157 1.00 0.00 H new ATOM 0 HH22 ARG A 71 15.222 -17.009 5.377 1.00 0.00 H new ATOM 938 N ALA A 72 12.314 -14.828 -1.788 1.00 0.00 N ATOM 939 CA ALA A 72 12.575 -15.953 -2.731 1.00 0.00 C ATOM 940 C ALA A 72 11.582 -15.935 -3.891 1.00 0.00 C ATOM 941 O ALA A 72 11.847 -15.382 -4.940 1.00 0.00 O ATOM 942 CB ALA A 72 12.394 -17.218 -1.891 1.00 0.00 C ATOM 0 H ALA A 72 13.108 -14.208 -1.629 1.00 0.00 H new ATOM 0 HA ALA A 72 13.568 -15.889 -3.175 1.00 0.00 H new ATOM 0 HB1 ALA A 72 12.569 -18.096 -2.513 1.00 0.00 H new ATOM 0 HB2 ALA A 72 13.105 -17.211 -1.065 1.00 0.00 H new ATOM 0 HB3 ALA A 72 11.379 -17.250 -1.496 1.00 0.00 H new ATOM 948 N GLU A 73 10.445 -16.546 -3.718 1.00 0.00 N ATOM 949 CA GLU A 73 9.446 -16.570 -4.825 1.00 0.00 C ATOM 950 C GLU A 73 8.023 -16.664 -4.274 1.00 0.00 C ATOM 951 O GLU A 73 7.141 -17.213 -4.905 1.00 0.00 O ATOM 952 CB GLU A 73 9.788 -17.821 -5.636 1.00 0.00 C ATOM 953 CG GLU A 73 11.249 -17.753 -6.086 1.00 0.00 C ATOM 954 CD GLU A 73 11.525 -18.872 -7.091 1.00 0.00 C ATOM 955 OE1 GLU A 73 11.768 -19.985 -6.655 1.00 0.00 O ATOM 956 OE2 GLU A 73 11.489 -18.598 -8.279 1.00 0.00 O ATOM 0 H GLU A 73 10.163 -17.028 -2.864 1.00 0.00 H new ATOM 0 HA GLU A 73 9.485 -15.662 -5.427 1.00 0.00 H new ATOM 0 HB2 GLU A 73 9.623 -18.714 -5.034 1.00 0.00 H new ATOM 0 HB3 GLU A 73 9.132 -17.896 -6.503 1.00 0.00 H new ATOM 0 HG2 GLU A 73 11.457 -16.783 -6.539 1.00 0.00 H new ATOM 0 HG3 GLU A 73 11.911 -17.851 -5.225 1.00 0.00 H new ATOM 963 N ASP A 74 7.784 -16.128 -3.111 1.00 0.00 N ATOM 964 CA ASP A 74 6.409 -16.187 -2.543 1.00 0.00 C ATOM 965 C ASP A 74 5.437 -15.492 -3.484 1.00 0.00 C ATOM 966 O ASP A 74 5.808 -14.934 -4.498 1.00 0.00 O ATOM 967 CB ASP A 74 6.499 -15.470 -1.186 1.00 0.00 C ATOM 968 CG ASP A 74 5.224 -14.673 -0.882 1.00 0.00 C ATOM 969 OD1 ASP A 74 5.092 -13.581 -1.410 1.00 0.00 O ATOM 970 OD2 ASP A 74 4.404 -15.170 -0.129 1.00 0.00 O ATOM 0 H ASP A 74 8.477 -15.654 -2.532 1.00 0.00 H new ATOM 0 HA ASP A 74 6.046 -17.207 -2.418 1.00 0.00 H new ATOM 0 HB2 ASP A 74 6.667 -16.203 -0.397 1.00 0.00 H new ATOM 0 HB3 ASP A 74 7.357 -14.798 -1.185 1.00 0.00 H new ATOM 975 N ALA A 75 4.197 -15.527 -3.138 1.00 0.00 N ATOM 976 CA ALA A 75 3.161 -14.874 -3.986 1.00 0.00 C ATOM 977 C ALA A 75 2.720 -13.555 -3.355 1.00 0.00 C ATOM 978 O ALA A 75 2.557 -13.452 -2.154 1.00 0.00 O ATOM 979 CB ALA A 75 1.996 -15.861 -4.030 1.00 0.00 C ATOM 0 H ALA A 75 3.842 -15.982 -2.297 1.00 0.00 H new ATOM 0 HA ALA A 75 3.533 -14.643 -4.984 1.00 0.00 H new ATOM 0 HB1 ALA A 75 1.192 -15.448 -4.639 1.00 0.00 H new ATOM 0 HB2 ALA A 75 2.333 -16.802 -4.464 1.00 0.00 H new ATOM 0 HB3 ALA A 75 1.631 -16.038 -3.018 1.00 0.00 H new ATOM 985 N LEU A 76 2.522 -12.544 -4.153 1.00 0.00 N ATOM 986 CA LEU A 76 2.086 -11.234 -3.597 1.00 0.00 C ATOM 987 C LEU A 76 1.475 -10.367 -4.692 1.00 0.00 C ATOM 988 O LEU A 76 1.830 -10.462 -5.851 1.00 0.00 O ATOM 989 CB LEU A 76 3.352 -10.578 -3.053 1.00 0.00 C ATOM 990 CG LEU A 76 3.063 -9.116 -2.699 1.00 0.00 C ATOM 991 CD1 LEU A 76 2.244 -9.056 -1.409 1.00 0.00 C ATOM 992 CD2 LEU A 76 4.385 -8.371 -2.497 1.00 0.00 C ATOM 0 H LEU A 76 2.643 -12.568 -5.165 1.00 0.00 H new ATOM 0 HA LEU A 76 1.328 -11.358 -2.824 1.00 0.00 H new ATOM 0 HB2 LEU A 76 3.701 -11.114 -2.170 1.00 0.00 H new ATOM 0 HB3 LEU A 76 4.149 -10.632 -3.795 1.00 0.00 H new ATOM 0 HG LEU A 76 2.501 -8.650 -3.508 1.00 0.00 H new ATOM 0 HD11 LEU A 76 2.038 -8.016 -1.157 1.00 0.00 H new ATOM 0 HD12 LEU A 76 1.303 -9.588 -1.550 1.00 0.00 H new ATOM 0 HD13 LEU A 76 2.806 -9.521 -0.599 1.00 0.00 H new ATOM 0 HD21 LEU A 76 4.181 -7.330 -2.245 1.00 0.00 H new ATOM 0 HD22 LEU A 76 4.945 -8.838 -1.687 1.00 0.00 H new ATOM 0 HD23 LEU A 76 4.971 -8.414 -3.415 1.00 0.00 H new ATOM 1004 N PHE A 77 0.564 -9.518 -4.321 1.00 0.00 N ATOM 1005 CA PHE A 77 -0.089 -8.621 -5.313 1.00 0.00 C ATOM 1006 C PHE A 77 -0.724 -7.432 -4.591 1.00 0.00 C ATOM 1007 O PHE A 77 -1.578 -7.595 -3.744 1.00 0.00 O ATOM 1008 CB PHE A 77 -1.171 -9.477 -5.971 1.00 0.00 C ATOM 1009 CG PHE A 77 -0.529 -10.559 -6.803 1.00 0.00 C ATOM 1010 CD1 PHE A 77 0.004 -10.253 -8.061 1.00 0.00 C ATOM 1011 CD2 PHE A 77 -0.464 -11.870 -6.316 1.00 0.00 C ATOM 1012 CE1 PHE A 77 0.602 -11.256 -8.831 1.00 0.00 C ATOM 1013 CE2 PHE A 77 0.134 -12.875 -7.086 1.00 0.00 C ATOM 1014 CZ PHE A 77 0.667 -12.567 -8.344 1.00 0.00 C ATOM 0 H PHE A 77 0.239 -9.404 -3.361 1.00 0.00 H new ATOM 0 HA PHE A 77 0.616 -8.224 -6.043 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -1.809 -9.922 -5.208 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -1.810 -8.854 -6.597 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -0.047 -9.242 -8.437 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -0.875 -12.106 -5.346 1.00 0.00 H new ATOM 0 HE1 PHE A 77 1.014 -11.019 -9.801 1.00 0.00 H new ATOM 0 HE2 PHE A 77 0.184 -13.886 -6.710 1.00 0.00 H new ATOM 0 HZ PHE A 77 1.128 -13.341 -8.939 1.00 0.00 H new ATOM 1024 N PHE A 78 -0.316 -6.238 -4.914 1.00 0.00 N ATOM 1025 CA PHE A 78 -0.904 -5.048 -4.237 1.00 0.00 C ATOM 1026 C PHE A 78 -2.130 -4.553 -5.008 1.00 0.00 C ATOM 1027 O PHE A 78 -2.027 -4.078 -6.122 1.00 0.00 O ATOM 1028 CB PHE A 78 0.202 -3.994 -4.248 1.00 0.00 C ATOM 1029 CG PHE A 78 1.336 -4.441 -3.355 1.00 0.00 C ATOM 1030 CD1 PHE A 78 1.202 -4.386 -1.962 1.00 0.00 C ATOM 1031 CD2 PHE A 78 2.527 -4.908 -3.922 1.00 0.00 C ATOM 1032 CE1 PHE A 78 2.261 -4.797 -1.142 1.00 0.00 C ATOM 1033 CE2 PHE A 78 3.580 -5.318 -3.097 1.00 0.00 C ATOM 1034 CZ PHE A 78 3.447 -5.262 -1.713 1.00 0.00 C ATOM 0 H PHE A 78 0.396 -6.034 -5.615 1.00 0.00 H new ATOM 0 HA PHE A 78 -1.237 -5.273 -3.224 1.00 0.00 H new ATOM 0 HB2 PHE A 78 0.564 -3.843 -5.265 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -0.190 -3.037 -3.904 1.00 0.00 H new ATOM 0 HD1 PHE A 78 0.284 -4.027 -1.521 1.00 0.00 H new ATOM 0 HD2 PHE A 78 2.633 -4.952 -4.996 1.00 0.00 H new ATOM 0 HE1 PHE A 78 2.160 -4.754 -0.068 1.00 0.00 H new ATOM 0 HE2 PHE A 78 4.499 -5.679 -3.536 1.00 0.00 H new ATOM 0 HZ PHE A 78 4.262 -5.579 -1.080 1.00 0.00 H new ATOM 1044 N PHE A 79 -3.289 -4.658 -4.420 1.00 0.00 N ATOM 1045 CA PHE A 79 -4.525 -4.194 -5.109 1.00 0.00 C ATOM 1046 C PHE A 79 -4.993 -2.870 -4.502 1.00 0.00 C ATOM 1047 O PHE A 79 -5.003 -2.699 -3.300 1.00 0.00 O ATOM 1048 CB PHE A 79 -5.562 -5.287 -4.851 1.00 0.00 C ATOM 1049 CG PHE A 79 -5.030 -6.622 -5.319 1.00 0.00 C ATOM 1050 CD1 PHE A 79 -4.303 -7.438 -4.441 1.00 0.00 C ATOM 1051 CD2 PHE A 79 -5.272 -7.049 -6.631 1.00 0.00 C ATOM 1052 CE1 PHE A 79 -3.820 -8.678 -4.876 1.00 0.00 C ATOM 1053 CE2 PHE A 79 -4.788 -8.289 -7.065 1.00 0.00 C ATOM 1054 CZ PHE A 79 -4.063 -9.103 -6.188 1.00 0.00 C ATOM 0 H PHE A 79 -3.434 -5.047 -3.488 1.00 0.00 H new ATOM 0 HA PHE A 79 -4.365 -4.027 -6.174 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -5.798 -5.332 -3.788 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -6.489 -5.052 -5.374 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -4.116 -7.110 -3.429 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -5.832 -6.421 -7.308 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -3.260 -9.307 -4.200 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -4.974 -8.617 -8.077 1.00 0.00 H new ATOM 0 HZ PHE A 79 -3.691 -10.060 -6.523 1.00 0.00 H new ATOM 1064 N VAL A 80 -5.383 -1.936 -5.319 1.00 0.00 N ATOM 1065 CA VAL A 80 -5.852 -0.628 -4.780 1.00 0.00 C ATOM 1066 C VAL A 80 -7.297 -0.370 -5.209 1.00 0.00 C ATOM 1067 O VAL A 80 -7.624 -0.408 -6.377 1.00 0.00 O ATOM 1068 CB VAL A 80 -4.917 0.414 -5.393 1.00 0.00 C ATOM 1069 CG1 VAL A 80 -5.063 1.734 -4.636 1.00 0.00 C ATOM 1070 CG2 VAL A 80 -3.471 -0.077 -5.290 1.00 0.00 C ATOM 0 H VAL A 80 -5.398 -2.019 -6.336 1.00 0.00 H new ATOM 0 HA VAL A 80 -5.833 -0.600 -3.691 1.00 0.00 H new ATOM 0 HB VAL A 80 -5.175 0.565 -6.441 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -4.397 2.479 -5.072 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -6.093 2.082 -4.708 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -4.803 1.583 -3.588 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -2.803 0.665 -5.727 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -3.211 -0.227 -4.242 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -3.368 -1.019 -5.828 1.00 0.00 H new ATOM 1080 N ASN A 81 -8.165 -0.105 -4.271 1.00 0.00 N ATOM 1081 CA ASN A 81 -9.589 0.155 -4.629 1.00 0.00 C ATOM 1082 C ASN A 81 -10.087 -0.900 -5.623 1.00 0.00 C ATOM 1083 O ASN A 81 -10.820 -0.602 -6.544 1.00 0.00 O ATOM 1084 CB ASN A 81 -9.585 1.542 -5.274 1.00 0.00 C ATOM 1085 CG ASN A 81 -9.846 2.605 -4.205 1.00 0.00 C ATOM 1086 OD1 ASN A 81 -10.414 3.641 -4.488 1.00 0.00 O ATOM 1087 ND2 ASN A 81 -9.451 2.391 -2.980 1.00 0.00 N ATOM 0 H ASN A 81 -7.951 -0.057 -3.275 1.00 0.00 H new ATOM 0 HA ASN A 81 -10.249 0.109 -3.763 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -8.626 1.726 -5.758 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -10.349 1.596 -6.049 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -9.619 3.094 -2.260 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -8.974 1.521 -2.743 1.00 0.00 H new ATOM 1094 N ASN A 82 -9.694 -2.133 -5.440 1.00 0.00 N ATOM 1095 CA ASN A 82 -10.143 -3.210 -6.372 1.00 0.00 C ATOM 1096 C ASN A 82 -9.532 -3.003 -7.761 1.00 0.00 C ATOM 1097 O ASN A 82 -10.171 -3.226 -8.770 1.00 0.00 O ATOM 1098 CB ASN A 82 -11.666 -3.077 -6.430 1.00 0.00 C ATOM 1099 CG ASN A 82 -12.300 -4.469 -6.480 1.00 0.00 C ATOM 1100 OD1 ASN A 82 -12.321 -5.175 -5.491 1.00 0.00 O ATOM 1101 ND2 ASN A 82 -12.818 -4.896 -7.598 1.00 0.00 N ATOM 0 H ASN A 82 -9.081 -2.441 -4.685 1.00 0.00 H new ATOM 0 HA ASN A 82 -9.833 -4.199 -6.036 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -12.027 -2.533 -5.558 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -11.958 -2.501 -7.308 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -13.241 -5.823 -7.643 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -12.800 -4.303 -8.428 1.00 0.00 H new ATOM 1108 N VAL A 83 -8.299 -2.579 -7.819 1.00 0.00 N ATOM 1109 CA VAL A 83 -7.645 -2.357 -9.143 1.00 0.00 C ATOM 1110 C VAL A 83 -6.227 -2.937 -9.127 1.00 0.00 C ATOM 1111 O VAL A 83 -5.703 -3.281 -8.086 1.00 0.00 O ATOM 1112 CB VAL A 83 -7.602 -0.836 -9.324 1.00 0.00 C ATOM 1113 CG1 VAL A 83 -7.409 -0.497 -10.804 1.00 0.00 C ATOM 1114 CG2 VAL A 83 -8.917 -0.217 -8.839 1.00 0.00 C ATOM 0 H VAL A 83 -7.715 -2.376 -7.008 1.00 0.00 H new ATOM 0 HA VAL A 83 -8.184 -2.843 -9.957 1.00 0.00 H new ATOM 0 HB VAL A 83 -6.772 -0.435 -8.743 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -7.379 0.585 -10.928 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -6.473 -0.929 -11.157 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -8.238 -0.906 -11.382 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -8.880 0.864 -8.970 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -9.746 -0.625 -9.417 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -9.061 -0.450 -7.784 1.00 0.00 H new ATOM 1124 N ILE A 84 -5.601 -3.033 -10.272 1.00 0.00 N ATOM 1125 CA ILE A 84 -4.217 -3.591 -10.339 1.00 0.00 C ATOM 1126 C ILE A 84 -3.495 -3.036 -11.571 1.00 0.00 C ATOM 1127 O ILE A 84 -3.233 -3.756 -12.514 1.00 0.00 O ATOM 1128 CB ILE A 84 -4.380 -5.109 -10.510 1.00 0.00 C ATOM 1129 CG1 ILE A 84 -5.523 -5.647 -9.642 1.00 0.00 C ATOM 1130 CG2 ILE A 84 -3.079 -5.807 -10.110 1.00 0.00 C ATOM 1131 CD1 ILE A 84 -6.864 -5.384 -10.331 1.00 0.00 C ATOM 0 H ILE A 84 -5.992 -2.747 -11.169 1.00 0.00 H new ATOM 0 HA ILE A 84 -3.643 -3.333 -9.449 1.00 0.00 H new ATOM 0 HB ILE A 84 -4.615 -5.310 -11.555 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -5.393 -6.716 -9.475 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -5.506 -5.167 -8.663 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -3.192 -6.884 -10.230 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -2.267 -5.454 -10.745 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -2.850 -5.580 -9.069 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -7.673 -5.768 -9.710 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -6.995 -4.312 -10.475 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -6.880 -5.885 -11.299 1.00 0.00 H new ATOM 1143 N PRO A 85 -3.198 -1.765 -11.516 1.00 0.00 N ATOM 1144 CA PRO A 85 -2.498 -1.097 -12.641 1.00 0.00 C ATOM 1145 C PRO A 85 -1.027 -1.520 -12.684 1.00 0.00 C ATOM 1146 O PRO A 85 -0.537 -2.160 -11.774 1.00 0.00 O ATOM 1147 CB PRO A 85 -2.626 0.388 -12.311 1.00 0.00 C ATOM 1148 CG PRO A 85 -2.806 0.442 -10.828 1.00 0.00 C ATOM 1149 CD PRO A 85 -3.483 -0.840 -10.414 1.00 0.00 C ATOM 0 HA PRO A 85 -2.915 -1.351 -13.616 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -1.738 0.939 -12.621 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -3.475 0.835 -12.828 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -1.844 0.548 -10.327 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -3.409 1.305 -10.545 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -3.088 -1.212 -9.469 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -4.555 -0.699 -10.279 1.00 0.00 H new ATOM 1157 N PRO A 86 -0.373 -1.142 -13.747 1.00 0.00 N ATOM 1158 CA PRO A 86 1.061 -1.479 -13.923 1.00 0.00 C ATOM 1159 C PRO A 86 1.926 -0.629 -12.990 1.00 0.00 C ATOM 1160 O PRO A 86 1.431 0.191 -12.242 1.00 0.00 O ATOM 1161 CB PRO A 86 1.332 -1.135 -15.385 1.00 0.00 C ATOM 1162 CG PRO A 86 0.305 -0.105 -15.737 1.00 0.00 C ATOM 1163 CD PRO A 86 -0.903 -0.369 -14.875 1.00 0.00 C ATOM 0 HA PRO A 86 1.292 -2.518 -13.686 1.00 0.00 H new ATOM 0 HB2 PRO A 86 2.342 -0.747 -15.519 1.00 0.00 H new ATOM 0 HB3 PRO A 86 1.242 -2.016 -16.021 1.00 0.00 H new ATOM 0 HG2 PRO A 86 0.691 0.899 -15.562 1.00 0.00 H new ATOM 0 HG3 PRO A 86 0.045 -0.166 -16.794 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -1.365 0.560 -14.540 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -1.666 -0.927 -15.418 1.00 0.00 H new ATOM 1171 N THR A 87 3.214 -0.823 -13.028 1.00 0.00 N ATOM 1172 CA THR A 87 4.112 -0.026 -12.140 1.00 0.00 C ATOM 1173 C THR A 87 4.509 1.285 -12.816 1.00 0.00 C ATOM 1174 O THR A 87 5.501 1.899 -12.476 1.00 0.00 O ATOM 1175 CB THR A 87 5.345 -0.897 -11.914 1.00 0.00 C ATOM 1176 OG1 THR A 87 5.550 -1.741 -13.038 1.00 0.00 O ATOM 1177 CG2 THR A 87 5.150 -1.749 -10.660 1.00 0.00 C ATOM 0 H THR A 87 3.685 -1.496 -13.633 1.00 0.00 H new ATOM 0 HA THR A 87 3.620 0.233 -11.202 1.00 0.00 H new ATOM 0 HB THR A 87 6.217 -0.256 -11.783 1.00 0.00 H new ATOM 0 HG1 THR A 87 6.343 -2.297 -12.889 1.00 0.00 H new ATOM 0 HG21 THR A 87 6.032 -2.370 -10.501 1.00 0.00 H new ATOM 0 HG22 THR A 87 5.004 -1.099 -9.797 1.00 0.00 H new ATOM 0 HG23 THR A 87 4.275 -2.387 -10.786 1.00 0.00 H new ATOM 1185 N SER A 88 3.738 1.715 -13.765 1.00 0.00 N ATOM 1186 CA SER A 88 4.053 2.991 -14.470 1.00 0.00 C ATOM 1187 C SER A 88 3.267 4.140 -13.837 1.00 0.00 C ATOM 1188 O SER A 88 2.764 5.013 -14.515 1.00 0.00 O ATOM 1189 CB SER A 88 3.610 2.766 -15.915 1.00 0.00 C ATOM 1190 OG SER A 88 4.333 3.641 -16.771 1.00 0.00 O ATOM 0 H SER A 88 2.896 1.239 -14.089 1.00 0.00 H new ATOM 0 HA SER A 88 5.109 3.253 -14.409 1.00 0.00 H new ATOM 0 HB2 SER A 88 3.785 1.730 -16.204 1.00 0.00 H new ATOM 0 HB3 SER A 88 2.539 2.947 -16.011 1.00 0.00 H new ATOM 0 HG SER A 88 4.052 3.497 -17.699 1.00 0.00 H new ATOM 1196 N ALA A 89 3.153 4.139 -12.536 1.00 0.00 N ATOM 1197 CA ALA A 89 2.395 5.223 -11.848 1.00 0.00 C ATOM 1198 C ALA A 89 3.031 5.540 -10.497 1.00 0.00 C ATOM 1199 O ALA A 89 4.052 4.992 -10.130 1.00 0.00 O ATOM 1200 CB ALA A 89 0.988 4.658 -11.655 1.00 0.00 C ATOM 0 H ALA A 89 3.553 3.432 -11.919 1.00 0.00 H new ATOM 0 HA ALA A 89 2.390 6.150 -12.421 1.00 0.00 H new ATOM 0 HB1 ALA A 89 0.365 5.398 -11.153 1.00 0.00 H new ATOM 0 HB2 ALA A 89 0.556 4.418 -12.626 1.00 0.00 H new ATOM 0 HB3 ALA A 89 1.039 3.754 -11.048 1.00 0.00 H new ATOM 1206 N THR A 90 2.430 6.425 -9.758 1.00 0.00 N ATOM 1207 CA THR A 90 2.992 6.792 -8.426 1.00 0.00 C ATOM 1208 C THR A 90 1.865 6.953 -7.401 1.00 0.00 C ATOM 1209 O THR A 90 0.763 7.346 -7.728 1.00 0.00 O ATOM 1210 CB THR A 90 3.704 8.127 -8.651 1.00 0.00 C ATOM 1211 OG1 THR A 90 2.744 9.127 -8.964 1.00 0.00 O ATOM 1212 CG2 THR A 90 4.698 7.991 -9.805 1.00 0.00 C ATOM 0 H THR A 90 1.572 6.913 -10.016 1.00 0.00 H new ATOM 0 HA THR A 90 3.667 6.029 -8.039 1.00 0.00 H new ATOM 0 HB THR A 90 4.241 8.409 -7.745 1.00 0.00 H new ATOM 0 HG1 THR A 90 3.198 9.983 -9.107 1.00 0.00 H new ATOM 0 HG21 THR A 90 5.204 8.943 -9.963 1.00 0.00 H new ATOM 0 HG22 THR A 90 5.434 7.225 -9.563 1.00 0.00 H new ATOM 0 HG23 THR A 90 4.165 7.708 -10.713 1.00 0.00 H new ATOM 1220 N MET A 91 2.133 6.647 -6.162 1.00 0.00 N ATOM 1221 CA MET A 91 1.078 6.778 -5.120 1.00 0.00 C ATOM 1222 C MET A 91 0.478 8.184 -5.159 1.00 0.00 C ATOM 1223 O MET A 91 -0.718 8.367 -5.039 1.00 0.00 O ATOM 1224 CB MET A 91 1.796 6.533 -3.791 1.00 0.00 C ATOM 1225 CG MET A 91 2.343 5.105 -3.758 1.00 0.00 C ATOM 1226 SD MET A 91 2.103 4.404 -2.105 1.00 0.00 S ATOM 1227 CE MET A 91 1.184 2.930 -2.614 1.00 0.00 C ATOM 0 H MET A 91 3.036 6.312 -5.827 1.00 0.00 H new ATOM 0 HA MET A 91 0.257 6.077 -5.269 1.00 0.00 H new ATOM 0 HB2 MET A 91 2.610 7.248 -3.669 1.00 0.00 H new ATOM 0 HB3 MET A 91 1.108 6.689 -2.960 1.00 0.00 H new ATOM 0 HG2 MET A 91 1.834 4.492 -4.502 1.00 0.00 H new ATOM 0 HG3 MET A 91 3.402 5.104 -4.015 1.00 0.00 H new ATOM 0 HE1 MET A 91 0.806 2.414 -1.731 1.00 0.00 H new ATOM 0 HE2 MET A 91 0.348 3.224 -3.249 1.00 0.00 H new ATOM 0 HE3 MET A 91 1.844 2.263 -3.169 1.00 0.00 H new ATOM 1237 N GLY A 92 1.303 9.179 -5.325 1.00 0.00 N ATOM 1238 CA GLY A 92 0.791 10.576 -5.374 1.00 0.00 C ATOM 1239 C GLY A 92 -0.376 10.668 -6.355 1.00 0.00 C ATOM 1240 O GLY A 92 -1.425 11.195 -6.040 1.00 0.00 O ATOM 0 H GLY A 92 2.313 9.084 -5.429 1.00 0.00 H new ATOM 0 HA2 GLY A 92 0.468 10.889 -4.381 1.00 0.00 H new ATOM 0 HA3 GLY A 92 1.588 11.254 -5.679 1.00 0.00 H new ATOM 1244 N GLN A 93 -0.203 10.165 -7.543 1.00 0.00 N ATOM 1245 CA GLN A 93 -1.308 10.233 -8.541 1.00 0.00 C ATOM 1246 C GLN A 93 -2.496 9.397 -8.053 1.00 0.00 C ATOM 1247 O GLN A 93 -3.636 9.683 -8.363 1.00 0.00 O ATOM 1248 CB GLN A 93 -0.709 9.682 -9.851 1.00 0.00 C ATOM 1249 CG GLN A 93 -1.072 8.204 -10.044 1.00 0.00 C ATOM 1250 CD GLN A 93 -0.515 7.715 -11.383 1.00 0.00 C ATOM 1251 OE1 GLN A 93 0.654 7.887 -11.666 1.00 0.00 O ATOM 1252 NE2 GLN A 93 -1.308 7.110 -12.224 1.00 0.00 N ATOM 0 H GLN A 93 0.651 9.711 -7.867 1.00 0.00 H new ATOM 0 HA GLN A 93 -1.686 11.245 -8.689 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -1.077 10.264 -10.696 1.00 0.00 H new ATOM 0 HB3 GLN A 93 0.375 9.795 -9.835 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -0.663 7.608 -9.228 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -2.154 8.078 -10.020 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -2.289 6.966 -11.986 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -0.947 6.781 -13.119 1.00 0.00 H new ATOM 1261 N LEU A 94 -2.238 8.372 -7.287 1.00 0.00 N ATOM 1262 CA LEU A 94 -3.354 7.532 -6.775 1.00 0.00 C ATOM 1263 C LEU A 94 -4.184 8.334 -5.773 1.00 0.00 C ATOM 1264 O LEU A 94 -5.334 8.038 -5.524 1.00 0.00 O ATOM 1265 CB LEU A 94 -2.665 6.329 -6.113 1.00 0.00 C ATOM 1266 CG LEU A 94 -2.718 6.427 -4.581 1.00 0.00 C ATOM 1267 CD1 LEU A 94 -4.044 5.857 -4.077 1.00 0.00 C ATOM 1268 CD2 LEU A 94 -1.561 5.629 -3.985 1.00 0.00 C ATOM 0 H LEU A 94 -1.305 8.082 -6.995 1.00 0.00 H new ATOM 0 HA LEU A 94 -4.043 7.210 -7.556 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -3.148 5.407 -6.437 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -1.627 6.277 -6.440 1.00 0.00 H new ATOM 0 HG LEU A 94 -2.636 7.471 -4.279 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -4.080 5.927 -2.990 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -4.870 6.425 -4.505 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -4.128 4.812 -4.376 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -1.595 5.696 -2.898 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -1.645 4.585 -4.287 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -0.616 6.035 -4.344 1.00 0.00 H new ATOM 1280 N TYR A 95 -3.606 9.337 -5.182 1.00 0.00 N ATOM 1281 CA TYR A 95 -4.368 10.136 -4.193 1.00 0.00 C ATOM 1282 C TYR A 95 -5.716 10.551 -4.786 1.00 0.00 C ATOM 1283 O TYR A 95 -6.753 10.268 -4.236 1.00 0.00 O ATOM 1284 CB TYR A 95 -3.491 11.354 -3.901 1.00 0.00 C ATOM 1285 CG TYR A 95 -3.567 11.673 -2.429 1.00 0.00 C ATOM 1286 CD1 TYR A 95 -3.415 10.649 -1.490 1.00 0.00 C ATOM 1287 CD2 TYR A 95 -3.795 12.987 -2.003 1.00 0.00 C ATOM 1288 CE1 TYR A 95 -3.490 10.936 -0.124 1.00 0.00 C ATOM 1289 CE2 TYR A 95 -3.870 13.275 -0.636 1.00 0.00 C ATOM 1290 CZ TYR A 95 -3.718 12.249 0.305 1.00 0.00 C ATOM 1291 OH TYR A 95 -3.792 12.533 1.654 1.00 0.00 O ATOM 0 H TYR A 95 -2.644 9.636 -5.340 1.00 0.00 H new ATOM 0 HA TYR A 95 -4.586 9.578 -3.282 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -2.459 11.153 -4.190 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -3.826 12.209 -4.489 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -3.240 9.636 -1.820 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -3.913 13.778 -2.729 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -3.372 10.144 0.601 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -4.045 14.288 -0.306 1.00 0.00 H new ATOM 0 HH TYR A 95 -3.954 13.492 1.778 1.00 0.00 H new ATOM 1301 N GLN A 96 -5.721 11.206 -5.907 1.00 0.00 N ATOM 1302 CA GLN A 96 -7.026 11.611 -6.505 1.00 0.00 C ATOM 1303 C GLN A 96 -7.797 10.381 -7.004 1.00 0.00 C ATOM 1304 O GLN A 96 -8.981 10.445 -7.264 1.00 0.00 O ATOM 1305 CB GLN A 96 -6.658 12.526 -7.675 1.00 0.00 C ATOM 1306 CG GLN A 96 -6.402 13.941 -7.154 1.00 0.00 C ATOM 1307 CD GLN A 96 -4.896 14.197 -7.085 1.00 0.00 C ATOM 1308 OE1 GLN A 96 -4.400 14.719 -6.107 1.00 0.00 O ATOM 1309 NE2 GLN A 96 -4.141 13.848 -8.092 1.00 0.00 N ATOM 0 H GLN A 96 -4.891 11.478 -6.434 1.00 0.00 H new ATOM 0 HA GLN A 96 -7.670 12.110 -5.781 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -5.770 12.147 -8.182 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -7.464 12.537 -8.409 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -6.876 14.672 -7.809 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -6.847 14.062 -6.167 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -4.557 13.410 -8.914 1.00 0.00 H new ATOM 0 HE22 GLN A 96 -3.135 14.014 -8.057 1.00 0.00 H new ATOM 1318 N GLU A 97 -7.126 9.273 -7.175 1.00 0.00 N ATOM 1319 CA GLU A 97 -7.814 8.052 -7.699 1.00 0.00 C ATOM 1320 C GLU A 97 -8.438 7.176 -6.592 1.00 0.00 C ATOM 1321 O GLU A 97 -9.645 7.074 -6.488 1.00 0.00 O ATOM 1322 CB GLU A 97 -6.724 7.282 -8.447 1.00 0.00 C ATOM 1323 CG GLU A 97 -6.753 7.672 -9.926 1.00 0.00 C ATOM 1324 CD GLU A 97 -6.338 6.472 -10.778 1.00 0.00 C ATOM 1325 OE1 GLU A 97 -5.321 5.873 -10.469 1.00 0.00 O ATOM 1326 OE2 GLU A 97 -7.043 6.172 -11.727 1.00 0.00 O ATOM 0 H GLU A 97 -6.132 9.158 -6.975 1.00 0.00 H new ATOM 0 HA GLU A 97 -8.656 8.331 -8.333 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -5.747 7.505 -8.019 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -6.882 6.209 -8.339 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -7.753 8.002 -10.206 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -6.079 8.510 -10.106 1.00 0.00 H new ATOM 1333 N HIS A 98 -7.638 6.489 -5.809 1.00 0.00 N ATOM 1334 CA HIS A 98 -8.202 5.572 -4.779 1.00 0.00 C ATOM 1335 C HIS A 98 -8.195 6.175 -3.366 1.00 0.00 C ATOM 1336 O HIS A 98 -7.956 5.482 -2.392 1.00 0.00 O ATOM 1337 CB HIS A 98 -7.274 4.369 -4.846 1.00 0.00 C ATOM 1338 CG HIS A 98 -7.351 3.762 -6.216 1.00 0.00 C ATOM 1339 ND1 HIS A 98 -8.510 3.783 -6.976 1.00 0.00 N ATOM 1340 CD2 HIS A 98 -6.416 3.114 -6.975 1.00 0.00 C ATOM 1341 CE1 HIS A 98 -8.241 3.164 -8.140 1.00 0.00 C ATOM 1342 NE2 HIS A 98 -6.977 2.736 -8.191 1.00 0.00 N ATOM 0 H HIS A 98 -6.619 6.527 -5.843 1.00 0.00 H new ATOM 0 HA HIS A 98 -9.250 5.343 -4.973 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -6.250 4.672 -4.626 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -7.557 3.634 -4.093 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -5.396 2.924 -6.676 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -8.959 3.030 -8.935 1.00 0.00 H new ATOM 0 HE2 HIS A 98 -6.521 2.239 -8.956 1.00 0.00 H new ATOM 1350 N HIS A 99 -8.468 7.440 -3.237 1.00 0.00 N ATOM 1351 CA HIS A 99 -8.491 8.050 -1.869 1.00 0.00 C ATOM 1352 C HIS A 99 -9.881 7.953 -1.250 1.00 0.00 C ATOM 1353 O HIS A 99 -10.111 8.357 -0.127 1.00 0.00 O ATOM 1354 CB HIS A 99 -8.096 9.504 -2.054 1.00 0.00 C ATOM 1355 CG HIS A 99 -8.995 10.227 -3.036 1.00 0.00 C ATOM 1356 ND1 HIS A 99 -10.045 9.619 -3.708 1.00 0.00 N ATOM 1357 CD2 HIS A 99 -8.993 11.534 -3.467 1.00 0.00 C ATOM 1358 CE1 HIS A 99 -10.623 10.546 -4.492 1.00 0.00 C ATOM 1359 NE2 HIS A 99 -10.020 11.731 -4.383 1.00 0.00 N ATOM 0 H HIS A 99 -8.675 8.077 -4.006 1.00 0.00 H new ATOM 0 HA HIS A 99 -7.810 7.529 -1.196 1.00 0.00 H new ATOM 0 HB2 HIS A 99 -8.132 10.013 -1.091 1.00 0.00 H new ATOM 0 HB3 HIS A 99 -7.065 9.556 -2.404 1.00 0.00 H new ATOM 0 HD2 HIS A 99 -8.297 12.293 -3.142 1.00 0.00 H new ATOM 0 HE1 HIS A 99 -11.472 10.355 -5.132 1.00 0.00 H new ATOM 0 HE2 HIS A 99 -10.261 12.596 -4.868 1.00 0.00 H new ATOM 1367 N GLU A 100 -10.799 7.422 -1.980 1.00 0.00 N ATOM 1368 CA GLU A 100 -12.194 7.283 -1.461 1.00 0.00 C ATOM 1369 C GLU A 100 -12.775 8.662 -1.139 1.00 0.00 C ATOM 1370 O GLU A 100 -13.412 8.857 -0.123 1.00 0.00 O ATOM 1371 CB GLU A 100 -12.060 6.447 -0.188 1.00 0.00 C ATOM 1372 CG GLU A 100 -12.976 5.225 -0.281 1.00 0.00 C ATOM 1373 CD GLU A 100 -13.076 4.556 1.091 1.00 0.00 C ATOM 1374 OE1 GLU A 100 -12.698 5.185 2.065 1.00 0.00 O ATOM 1375 OE2 GLU A 100 -13.532 3.426 1.144 1.00 0.00 O ATOM 0 H GLU A 100 -10.654 7.070 -2.926 1.00 0.00 H new ATOM 0 HA GLU A 100 -12.862 6.817 -2.186 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -11.026 6.130 -0.056 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -12.324 7.047 0.683 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -13.966 5.525 -0.624 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -12.585 4.519 -1.014 1.00 0.00 H new ATOM 1382 N GLU A 101 -12.561 9.622 -1.999 1.00 0.00 N ATOM 1383 CA GLU A 101 -13.101 10.989 -1.745 1.00 0.00 C ATOM 1384 C GLU A 101 -12.863 11.395 -0.287 1.00 0.00 C ATOM 1385 O GLU A 101 -13.767 11.385 0.525 1.00 0.00 O ATOM 1386 CB GLU A 101 -14.599 10.884 -2.035 1.00 0.00 C ATOM 1387 CG GLU A 101 -15.130 12.253 -2.468 1.00 0.00 C ATOM 1388 CD GLU A 101 -16.660 12.247 -2.414 1.00 0.00 C ATOM 1389 OE1 GLU A 101 -17.207 11.353 -1.792 1.00 0.00 O ATOM 1390 OE2 GLU A 101 -17.257 13.137 -2.997 1.00 0.00 O ATOM 0 H GLU A 101 -12.035 9.518 -2.867 1.00 0.00 H new ATOM 0 HA GLU A 101 -12.617 11.744 -2.365 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -14.778 10.148 -2.818 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -15.129 10.540 -1.147 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -14.735 13.031 -1.815 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -14.792 12.483 -3.478 1.00 0.00 H new ATOM 1397 N ASP A 102 -11.654 11.755 0.048 1.00 0.00 N ATOM 1398 CA ASP A 102 -11.359 12.164 1.451 1.00 0.00 C ATOM 1399 C ASP A 102 -9.868 12.470 1.613 1.00 0.00 C ATOM 1400 O ASP A 102 -9.216 12.933 0.698 1.00 0.00 O ATOM 1401 CB ASP A 102 -11.756 10.963 2.309 1.00 0.00 C ATOM 1402 CG ASP A 102 -12.465 11.450 3.573 1.00 0.00 C ATOM 1403 OD1 ASP A 102 -12.170 12.551 4.008 1.00 0.00 O ATOM 1404 OD2 ASP A 102 -13.293 10.714 4.086 1.00 0.00 O ATOM 0 H ASP A 102 -10.858 11.784 -0.589 1.00 0.00 H new ATOM 0 HA ASP A 102 -11.900 13.066 1.738 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -12.412 10.300 1.744 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -10.871 10.385 2.576 1.00 0.00 H new ATOM 1409 N PHE A 103 -9.324 12.216 2.771 1.00 0.00 N ATOM 1410 CA PHE A 103 -7.873 12.493 2.995 1.00 0.00 C ATOM 1411 C PHE A 103 -7.147 11.213 3.424 1.00 0.00 C ATOM 1412 O PHE A 103 -6.744 11.069 4.561 1.00 0.00 O ATOM 1413 CB PHE A 103 -7.809 13.547 4.113 1.00 0.00 C ATOM 1414 CG PHE A 103 -8.982 13.398 5.061 1.00 0.00 C ATOM 1415 CD1 PHE A 103 -9.211 12.179 5.712 1.00 0.00 C ATOM 1416 CD2 PHE A 103 -9.836 14.483 5.290 1.00 0.00 C ATOM 1417 CE1 PHE A 103 -10.296 12.046 6.588 1.00 0.00 C ATOM 1418 CE2 PHE A 103 -10.920 14.350 6.166 1.00 0.00 C ATOM 1419 CZ PHE A 103 -11.149 13.132 6.815 1.00 0.00 C ATOM 0 H PHE A 103 -9.820 11.828 3.574 1.00 0.00 H new ATOM 0 HA PHE A 103 -7.389 12.849 2.085 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -6.875 13.443 4.664 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -7.812 14.546 3.678 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -8.551 11.342 5.539 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -9.659 15.424 4.790 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -10.474 11.106 7.088 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -11.579 15.187 6.341 1.00 0.00 H new ATOM 0 HZ PHE A 103 -11.985 13.030 7.492 1.00 0.00 H new ATOM 1429 N PHE A 104 -6.976 10.283 2.521 1.00 0.00 N ATOM 1430 CA PHE A 104 -6.275 9.009 2.871 1.00 0.00 C ATOM 1431 C PHE A 104 -6.462 7.988 1.738 1.00 0.00 C ATOM 1432 O PHE A 104 -7.557 7.805 1.244 1.00 0.00 O ATOM 1433 CB PHE A 104 -6.967 8.515 4.147 1.00 0.00 C ATOM 1434 CG PHE A 104 -5.985 8.492 5.298 1.00 0.00 C ATOM 1435 CD1 PHE A 104 -4.949 9.433 5.363 1.00 0.00 C ATOM 1436 CD2 PHE A 104 -6.118 7.528 6.307 1.00 0.00 C ATOM 1437 CE1 PHE A 104 -4.048 9.409 6.435 1.00 0.00 C ATOM 1438 CE2 PHE A 104 -5.214 7.504 7.376 1.00 0.00 C ATOM 1439 CZ PHE A 104 -4.181 8.445 7.440 1.00 0.00 C ATOM 0 H PHE A 104 -7.292 10.350 1.553 1.00 0.00 H new ATOM 0 HA PHE A 104 -5.203 9.148 3.014 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -7.807 9.166 4.389 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -7.373 7.516 3.986 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -4.845 10.177 4.587 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -6.918 6.804 6.260 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -3.250 10.135 6.486 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -5.314 6.759 8.151 1.00 0.00 H new ATOM 0 HZ PHE A 104 -3.485 8.427 8.266 1.00 0.00 H new ATOM 1449 N LEU A 105 -5.418 7.314 1.319 1.00 0.00 N ATOM 1450 CA LEU A 105 -5.593 6.314 0.219 1.00 0.00 C ATOM 1451 C LEU A 105 -5.714 4.902 0.806 1.00 0.00 C ATOM 1452 O LEU A 105 -5.234 4.627 1.888 1.00 0.00 O ATOM 1453 CB LEU A 105 -4.348 6.454 -0.680 1.00 0.00 C ATOM 1454 CG LEU A 105 -3.270 5.440 -0.281 1.00 0.00 C ATOM 1455 CD1 LEU A 105 -3.512 4.121 -1.015 1.00 0.00 C ATOM 1456 CD2 LEU A 105 -1.893 5.989 -0.658 1.00 0.00 C ATOM 0 H LEU A 105 -4.470 7.410 1.683 1.00 0.00 H new ATOM 0 HA LEU A 105 -6.502 6.488 -0.356 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -4.628 6.302 -1.722 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -3.949 7.465 -0.601 1.00 0.00 H new ATOM 0 HG LEU A 105 -3.312 5.268 0.795 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -2.745 3.400 -0.731 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -4.494 3.730 -0.747 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -3.470 4.290 -2.091 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -1.125 5.270 -0.375 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -1.852 6.160 -1.734 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -1.720 6.929 -0.134 1.00 0.00 H new ATOM 1468 N TYR A 106 -6.361 4.007 0.107 1.00 0.00 N ATOM 1469 CA TYR A 106 -6.515 2.622 0.644 1.00 0.00 C ATOM 1470 C TYR A 106 -5.861 1.591 -0.284 1.00 0.00 C ATOM 1471 O TYR A 106 -6.208 1.473 -1.443 1.00 0.00 O ATOM 1472 CB TYR A 106 -8.026 2.394 0.712 1.00 0.00 C ATOM 1473 CG TYR A 106 -8.597 3.139 1.895 1.00 0.00 C ATOM 1474 CD1 TYR A 106 -8.627 2.532 3.156 1.00 0.00 C ATOM 1475 CD2 TYR A 106 -9.099 4.436 1.731 1.00 0.00 C ATOM 1476 CE1 TYR A 106 -9.160 3.222 4.253 1.00 0.00 C ATOM 1477 CE2 TYR A 106 -9.631 5.125 2.827 1.00 0.00 C ATOM 1478 CZ TYR A 106 -9.661 4.518 4.089 1.00 0.00 C ATOM 1479 OH TYR A 106 -10.185 5.198 5.168 1.00 0.00 O ATOM 0 H TYR A 106 -6.786 4.172 -0.805 1.00 0.00 H new ATOM 0 HA TYR A 106 -6.032 2.510 1.615 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -8.498 2.737 -0.209 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -8.240 1.329 0.802 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -8.239 1.532 3.283 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -9.076 4.905 0.758 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -9.184 2.753 5.226 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -10.019 6.125 2.700 1.00 0.00 H new ATOM 0 HH TYR A 106 -10.487 6.085 4.880 1.00 0.00 H new ATOM 1489 N ILE A 107 -4.927 0.831 0.228 1.00 0.00 N ATOM 1490 CA ILE A 107 -4.257 -0.209 -0.609 1.00 0.00 C ATOM 1491 C ILE A 107 -4.038 -1.479 0.222 1.00 0.00 C ATOM 1492 O ILE A 107 -3.853 -1.423 1.421 1.00 0.00 O ATOM 1493 CB ILE A 107 -2.915 0.402 -1.022 1.00 0.00 C ATOM 1494 CG1 ILE A 107 -3.128 1.357 -2.199 1.00 0.00 C ATOM 1495 CG2 ILE A 107 -1.949 -0.709 -1.448 1.00 0.00 C ATOM 1496 CD1 ILE A 107 -1.850 2.163 -2.440 1.00 0.00 C ATOM 0 H ILE A 107 -4.599 0.886 1.192 1.00 0.00 H new ATOM 0 HA ILE A 107 -4.853 -0.488 -1.478 1.00 0.00 H new ATOM 0 HB ILE A 107 -2.496 0.946 -0.176 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -3.390 0.794 -3.095 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -3.960 2.029 -1.990 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -0.996 -0.270 -1.741 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -1.792 -1.394 -0.615 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -2.371 -1.255 -2.292 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -2.001 2.843 -3.278 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -1.608 2.737 -1.546 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -1.029 1.483 -2.668 1.00 0.00 H new ATOM 1508 N ALA A 108 -4.054 -2.623 -0.406 1.00 0.00 N ATOM 1509 CA ALA A 108 -3.842 -3.890 0.350 1.00 0.00 C ATOM 1510 C ALA A 108 -3.034 -4.874 -0.491 1.00 0.00 C ATOM 1511 O ALA A 108 -2.675 -4.594 -1.615 1.00 0.00 O ATOM 1512 CB ALA A 108 -5.244 -4.435 0.620 1.00 0.00 C ATOM 0 H ALA A 108 -4.205 -2.735 -1.409 1.00 0.00 H new ATOM 0 HA ALA A 108 -3.286 -3.731 1.274 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -5.170 -5.370 1.175 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -5.810 -3.710 1.205 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -5.753 -4.614 -0.327 1.00 0.00 H new ATOM 1518 N TYR A 109 -2.741 -6.026 0.043 1.00 0.00 N ATOM 1519 CA TYR A 109 -1.956 -7.021 -0.739 1.00 0.00 C ATOM 1520 C TYR A 109 -2.436 -8.436 -0.443 1.00 0.00 C ATOM 1521 O TYR A 109 -3.132 -8.687 0.522 1.00 0.00 O ATOM 1522 CB TYR A 109 -0.494 -6.848 -0.316 1.00 0.00 C ATOM 1523 CG TYR A 109 -0.379 -6.689 1.186 1.00 0.00 C ATOM 1524 CD1 TYR A 109 -0.887 -5.547 1.819 1.00 0.00 C ATOM 1525 CD2 TYR A 109 0.250 -7.683 1.947 1.00 0.00 C ATOM 1526 CE1 TYR A 109 -0.767 -5.403 3.206 1.00 0.00 C ATOM 1527 CE2 TYR A 109 0.367 -7.535 3.332 1.00 0.00 C ATOM 1528 CZ TYR A 109 -0.140 -6.396 3.962 1.00 0.00 C ATOM 1529 OH TYR A 109 -0.023 -6.249 5.328 1.00 0.00 O ATOM 0 H TYR A 109 -3.009 -6.321 0.982 1.00 0.00 H new ATOM 0 HA TYR A 109 -2.077 -6.862 -1.811 1.00 0.00 H new ATOM 0 HB2 TYR A 109 0.087 -7.712 -0.639 1.00 0.00 H new ATOM 0 HB3 TYR A 109 -0.069 -5.975 -0.811 1.00 0.00 H new ATOM 0 HD1 TYR A 109 -1.371 -4.777 1.236 1.00 0.00 H new ATOM 0 HD2 TYR A 109 0.645 -8.564 1.463 1.00 0.00 H new ATOM 0 HE1 TYR A 109 -1.160 -4.522 3.693 1.00 0.00 H new ATOM 0 HE2 TYR A 109 0.851 -8.303 3.917 1.00 0.00 H new ATOM 0 HH TYR A 109 -0.562 -5.485 5.622 1.00 0.00 H new ATOM 1539 N SER A 110 -2.067 -9.360 -1.278 1.00 0.00 N ATOM 1540 CA SER A 110 -2.497 -10.774 -1.069 1.00 0.00 C ATOM 1541 C SER A 110 -1.581 -11.729 -1.838 1.00 0.00 C ATOM 1542 O SER A 110 -0.699 -11.313 -2.560 1.00 0.00 O ATOM 1543 CB SER A 110 -3.919 -10.838 -1.621 1.00 0.00 C ATOM 1544 OG SER A 110 -4.679 -11.764 -0.854 1.00 0.00 O ATOM 0 H SER A 110 -1.484 -9.201 -2.100 1.00 0.00 H new ATOM 0 HA SER A 110 -2.450 -11.068 -0.020 1.00 0.00 H new ATOM 0 HB2 SER A 110 -4.381 -9.851 -1.583 1.00 0.00 H new ATOM 0 HB3 SER A 110 -3.902 -11.142 -2.668 1.00 0.00 H new ATOM 0 HG SER A 110 -5.463 -12.049 -1.368 1.00 0.00 H new ATOM 1550 N ASP A 111 -1.789 -13.010 -1.691 1.00 0.00 N ATOM 1551 CA ASP A 111 -0.935 -13.992 -2.417 1.00 0.00 C ATOM 1552 C ASP A 111 -1.764 -14.734 -3.471 1.00 0.00 C ATOM 1553 O ASP A 111 -1.519 -15.886 -3.770 1.00 0.00 O ATOM 1554 CB ASP A 111 -0.442 -14.962 -1.342 1.00 0.00 C ATOM 1555 CG ASP A 111 -1.630 -15.734 -0.766 1.00 0.00 C ATOM 1556 OD1 ASP A 111 -2.308 -15.187 0.090 1.00 0.00 O ATOM 1557 OD2 ASP A 111 -1.842 -16.858 -1.187 1.00 0.00 O ATOM 0 H ASP A 111 -2.513 -13.418 -1.100 1.00 0.00 H new ATOM 0 HA ASP A 111 -0.108 -13.512 -2.941 1.00 0.00 H new ATOM 0 HB2 ASP A 111 0.283 -15.655 -1.768 1.00 0.00 H new ATOM 0 HB3 ASP A 111 0.068 -14.414 -0.549 1.00 0.00 H new ATOM 1562 N GLU A 112 -2.742 -14.078 -4.036 1.00 0.00 N ATOM 1563 CA GLU A 112 -3.588 -14.741 -5.074 1.00 0.00 C ATOM 1564 C GLU A 112 -4.636 -13.759 -5.605 1.00 0.00 C ATOM 1565 O GLU A 112 -5.180 -12.960 -4.869 1.00 0.00 O ATOM 1566 CB GLU A 112 -4.263 -15.917 -4.358 1.00 0.00 C ATOM 1567 CG GLU A 112 -5.407 -15.406 -3.476 1.00 0.00 C ATOM 1568 CD GLU A 112 -6.198 -16.595 -2.929 1.00 0.00 C ATOM 1569 OE1 GLU A 112 -5.588 -17.623 -2.680 1.00 0.00 O ATOM 1570 OE2 GLU A 112 -7.399 -16.460 -2.767 1.00 0.00 O ATOM 0 H GLU A 112 -2.993 -13.112 -3.825 1.00 0.00 H new ATOM 0 HA GLU A 112 -3.001 -15.075 -5.930 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -4.647 -16.628 -5.090 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -3.533 -16.450 -3.749 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -5.009 -14.811 -2.654 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -6.062 -14.754 -4.053 1.00 0.00 H new ATOM 1577 N SER A 113 -4.924 -13.812 -6.876 1.00 0.00 N ATOM 1578 CA SER A 113 -5.937 -12.879 -7.448 1.00 0.00 C ATOM 1579 C SER A 113 -7.278 -13.594 -7.631 1.00 0.00 C ATOM 1580 O SER A 113 -8.313 -12.971 -7.757 1.00 0.00 O ATOM 1581 CB SER A 113 -5.366 -12.453 -8.799 1.00 0.00 C ATOM 1582 OG SER A 113 -3.950 -12.568 -8.768 1.00 0.00 O ATOM 0 H SER A 113 -4.503 -14.459 -7.543 1.00 0.00 H new ATOM 0 HA SER A 113 -6.123 -12.025 -6.797 1.00 0.00 H new ATOM 0 HB2 SER A 113 -5.776 -13.077 -9.593 1.00 0.00 H new ATOM 0 HB3 SER A 113 -5.654 -11.425 -9.021 1.00 0.00 H new ATOM 0 HG SER A 113 -3.581 -12.297 -9.634 1.00 0.00 H new ATOM 1588 N VAL A 114 -7.267 -14.898 -7.651 1.00 0.00 N ATOM 1589 CA VAL A 114 -8.542 -15.650 -7.828 1.00 0.00 C ATOM 1590 C VAL A 114 -8.551 -16.904 -6.947 1.00 0.00 C ATOM 1591 O VAL A 114 -7.549 -17.276 -6.369 1.00 0.00 O ATOM 1592 CB VAL A 114 -8.571 -16.025 -9.311 1.00 0.00 C ATOM 1593 CG1 VAL A 114 -7.651 -17.224 -9.565 1.00 0.00 C ATOM 1594 CG2 VAL A 114 -10.001 -16.386 -9.716 1.00 0.00 C ATOM 0 H VAL A 114 -6.432 -15.475 -7.553 1.00 0.00 H new ATOM 0 HA VAL A 114 -9.414 -15.063 -7.539 1.00 0.00 H new ATOM 0 HB VAL A 114 -8.225 -15.177 -9.902 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -7.677 -17.485 -10.623 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -6.631 -16.967 -9.280 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -7.990 -18.074 -8.973 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -10.023 -16.653 -10.772 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -10.345 -17.231 -9.120 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -10.655 -15.531 -9.544 1.00 0.00 H new ATOM 1604 N TYR A 115 -9.676 -17.556 -6.842 1.00 0.00 N ATOM 1605 CA TYR A 115 -9.753 -18.785 -6.002 1.00 0.00 C ATOM 1606 C TYR A 115 -10.146 -19.988 -6.862 1.00 0.00 C ATOM 1607 O TYR A 115 -10.812 -19.853 -7.870 1.00 0.00 O ATOM 1608 CB TYR A 115 -10.840 -18.487 -4.967 1.00 0.00 C ATOM 1609 CG TYR A 115 -11.062 -19.705 -4.103 1.00 0.00 C ATOM 1610 CD1 TYR A 115 -10.293 -19.891 -2.948 1.00 0.00 C ATOM 1611 CD2 TYR A 115 -12.036 -20.645 -4.456 1.00 0.00 C ATOM 1612 CE1 TYR A 115 -10.500 -21.021 -2.145 1.00 0.00 C ATOM 1613 CE2 TYR A 115 -12.243 -21.773 -3.654 1.00 0.00 C ATOM 1614 CZ TYR A 115 -11.475 -21.961 -2.498 1.00 0.00 C ATOM 1615 OH TYR A 115 -11.679 -23.073 -1.706 1.00 0.00 O ATOM 0 H TYR A 115 -10.547 -17.291 -7.302 1.00 0.00 H new ATOM 0 HA TYR A 115 -8.799 -19.028 -5.534 1.00 0.00 H new ATOM 0 HB2 TYR A 115 -10.546 -17.639 -4.349 1.00 0.00 H new ATOM 0 HB3 TYR A 115 -11.767 -18.210 -5.468 1.00 0.00 H new ATOM 0 HD1 TYR A 115 -9.541 -19.165 -2.676 1.00 0.00 H new ATOM 0 HD2 TYR A 115 -12.628 -20.500 -5.347 1.00 0.00 H new ATOM 0 HE1 TYR A 115 -9.907 -21.166 -1.254 1.00 0.00 H new ATOM 0 HE2 TYR A 115 -12.995 -22.499 -3.927 1.00 0.00 H new ATOM 0 HH TYR A 115 -12.392 -23.623 -2.092 1.00 0.00 H new ATOM 1625 N GLY A 116 -9.737 -21.166 -6.476 1.00 0.00 N ATOM 1626 CA GLY A 116 -10.088 -22.373 -7.275 1.00 0.00 C ATOM 1627 C GLY A 116 -9.703 -22.145 -8.738 1.00 0.00 C ATOM 1628 O GLY A 116 -8.826 -21.363 -9.044 1.00 0.00 O ATOM 0 H GLY A 116 -9.176 -21.344 -5.643 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -9.567 -23.246 -6.882 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -11.156 -22.577 -7.196 1.00 0.00 H new ATOM 1632 N LEU A 117 -10.353 -22.821 -9.645 1.00 0.00 N ATOM 1633 CA LEU A 117 -10.022 -22.641 -11.088 1.00 0.00 C ATOM 1634 C LEU A 117 -11.129 -21.849 -11.788 1.00 0.00 C ATOM 1635 O LEU A 117 -11.923 -22.463 -12.481 1.00 0.00 O ATOM 1636 CB LEU A 117 -9.937 -24.059 -11.653 1.00 0.00 C ATOM 1637 CG LEU A 117 -11.289 -24.755 -11.488 1.00 0.00 C ATOM 1638 CD1 LEU A 117 -11.779 -25.248 -12.850 1.00 0.00 C ATOM 1639 CD2 LEU A 117 -11.136 -25.947 -10.540 1.00 0.00 C ATOM 1640 OXT LEU A 117 -11.163 -20.640 -11.620 1.00 0.00 O ATOM 0 H LEU A 117 -11.098 -23.490 -9.450 1.00 0.00 H new ATOM 0 HA LEU A 117 -9.094 -22.088 -11.235 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -9.659 -24.026 -12.706 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -9.160 -24.622 -11.136 1.00 0.00 H new ATOM 0 HG LEU A 117 -12.012 -24.051 -11.075 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -12.742 -25.744 -12.732 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -11.888 -24.400 -13.526 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -11.057 -25.952 -13.264 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -12.099 -26.444 -10.422 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -10.413 -26.650 -10.954 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -10.787 -25.597 -9.569 1.00 0.00 H new TER 1652 LEU A 117