USER MOD reduce.3.24.130724 H: found=0, std=0, add=745, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 747 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 101 HIS : no HD1:sc= -0.634 K(o=-2.7,f=-0.91) USER MOD Set 1.2: A 106 HIS : no HD1:sc= -2.07 K(o=-2.7,f=-0.91) USER MOD Set 2.1: A 94 CYS SG : rot 21:sc= -0.272 USER MOD Set 2.2: A 124 ASN : amide:sc= -0.804 K(o=-1.1,f=-2.8) USER MOD Set 3.1: A 87 LYS NZ :NH3+ -157:sc= -1.12 (180deg=-3.13!) USER MOD Set 3.2: A 89 ASN : amide:sc= -0.375 K(o=-1.5,f=-10!) USER MOD Set 4.1: A 76 LYS NZ :NH3+ 149:sc= 0 (180deg=-0.0225) USER MOD Set 4.2: A 82 MET CE :methyl -115:sc= -5.63! (180deg=-2.82) USER MOD Set 4.3: A 137 MET CE :methyl -124:sc= -4.33! (180deg=-3.42!) USER MOD Set 5.1: A 73 GLN : amide:sc= 0.465 K(o=-1.1,f=-5.4) USER MOD Set 5.2: A 143 MET CE :methyl 141:sc= -2.2! (180deg=-2.07) USER MOD Set 5.3: A 145 SER OG : rot -38:sc= 0.621 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0.0296 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 GLN : amide:sc= -1.76 K(o=-1.8,f=-4.6!) USER MOD Single : A 93 SER OG : rot 34:sc= 0.812 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 MET CE :methyl 172:sc= -2 (180deg=-2.23) USER MOD Single : A 108 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 112 HIS : no HD1:sc= -0.197 X(o=-0.2,f=-0.24) USER MOD Single : A 121 ASN : amide:sc= -0.582 K(o=-0.58,f=-2.5!) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 126 THR OG1 : rot 180:sc= 0.0749 USER MOD Single : A 127 ASN : amide:sc= -0.0147 X(o=-0.015,f=-0.015) USER MOD Single : A 128 HIS : no HD1:sc= -0.0104 X(o=-0.01,f=0) USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 132 GLN : amide:sc= -0.143 X(o=-0.14,f=-0.0076) USER MOD Single : A 134 GLN : amide:sc= -1.51 K(o=-1.5,f=-4!) USER MOD Single : A 135 LYS NZ :NH3+ -145:sc= -0.0391 (180deg=-0.434) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 ASN : amide:sc= -0.0851 K(o=-0.085,f=-0.87) USER MOD Single : A 152 GLN : amide:sc= -0.0952 K(o=-0.095,f=-2.7!) USER MOD Single : A 153 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 126 TYR OH : rot 180:sc=-0.00475 USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 69 7.927 12.741 3.258 1.00 0.00 N ATOM 2 CA VAL A 69 7.472 11.355 3.545 1.00 0.00 C ATOM 3 C VAL A 69 6.418 11.342 4.648 1.00 0.00 C ATOM 4 O VAL A 69 6.695 11.710 5.789 1.00 0.00 O ATOM 5 CB VAL A 69 8.653 10.456 3.964 1.00 0.00 C ATOM 6 CG1 VAL A 69 9.305 10.979 5.235 1.00 0.00 C ATOM 7 CG2 VAL A 69 8.193 9.016 4.143 1.00 0.00 C ATOM 0 HA VAL A 69 7.035 10.964 2.626 1.00 0.00 H new ATOM 0 HB VAL A 69 9.399 10.478 3.169 1.00 0.00 H new ATOM 0 HG11 VAL A 69 10.135 10.329 5.512 1.00 0.00 H new ATOM 0 HG12 VAL A 69 9.676 11.990 5.064 1.00 0.00 H new ATOM 0 HG13 VAL A 69 8.571 10.993 6.041 1.00 0.00 H new ATOM 0 HG21 VAL A 69 9.040 8.397 4.439 1.00 0.00 H new ATOM 0 HG22 VAL A 69 7.425 8.973 4.915 1.00 0.00 H new ATOM 0 HG23 VAL A 69 7.784 8.645 3.203 1.00 0.00 H new ATOM 17 N ARG A 70 5.210 10.914 4.298 1.00 0.00 N ATOM 18 CA ARG A 70 4.114 10.851 5.259 1.00 0.00 C ATOM 19 C ARG A 70 3.998 9.452 5.856 1.00 0.00 C ATOM 20 O ARG A 70 3.786 8.475 5.138 1.00 0.00 O ATOM 21 CB ARG A 70 2.796 11.246 4.587 1.00 0.00 C ATOM 22 CG ARG A 70 1.992 12.263 5.381 1.00 0.00 C ATOM 23 CD ARG A 70 0.747 12.701 4.626 1.00 0.00 C ATOM 24 NE ARG A 70 0.222 13.969 5.125 1.00 0.00 N ATOM 25 CZ ARG A 70 -0.384 14.111 6.301 1.00 0.00 C ATOM 26 NH1 ARG A 70 -0.543 13.064 7.103 1.00 0.00 N ATOM 27 NH2 ARG A 70 -0.832 15.300 6.677 1.00 0.00 N ATOM 0 H ARG A 70 4.965 10.606 3.357 1.00 0.00 H new ATOM 0 HA ARG A 70 4.326 11.554 6.065 1.00 0.00 H new ATOM 0 HB2 ARG A 70 3.009 11.654 3.599 1.00 0.00 H new ATOM 0 HB3 ARG A 70 2.191 10.352 4.439 1.00 0.00 H new ATOM 0 HG2 ARG A 70 1.704 11.832 6.340 1.00 0.00 H new ATOM 0 HG3 ARG A 70 2.613 13.132 5.595 1.00 0.00 H new ATOM 0 HD2 ARG A 70 0.981 12.798 3.566 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -0.020 11.931 4.714 1.00 0.00 H new ATOM 0 HE ARG A 70 0.326 14.796 4.537 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -0.200 12.147 6.818 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -1.008 13.177 8.004 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -0.712 16.107 6.065 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -1.296 15.408 7.579 1.00 0.00 H new ATOM 41 N LEU A 71 4.141 9.363 7.174 1.00 0.00 N ATOM 42 CA LEU A 71 4.057 8.084 7.867 1.00 0.00 C ATOM 43 C LEU A 71 2.676 7.884 8.482 1.00 0.00 C ATOM 44 O LEU A 71 2.384 8.403 9.560 1.00 0.00 O ATOM 45 CB LEU A 71 5.128 8.000 8.956 1.00 0.00 C ATOM 46 CG LEU A 71 5.741 6.613 9.155 1.00 0.00 C ATOM 47 CD1 LEU A 71 6.767 6.638 10.277 1.00 0.00 C ATOM 48 CD2 LEU A 71 4.655 5.589 9.448 1.00 0.00 C ATOM 0 H LEU A 71 4.316 10.162 7.783 1.00 0.00 H new ATOM 0 HA LEU A 71 4.226 7.293 7.136 1.00 0.00 H new ATOM 0 HB2 LEU A 71 5.926 8.702 8.714 1.00 0.00 H new ATOM 0 HB3 LEU A 71 4.691 8.326 9.900 1.00 0.00 H new ATOM 0 HG LEU A 71 6.247 6.325 8.234 1.00 0.00 H new ATOM 0 HD11 LEU A 71 7.192 5.642 10.404 1.00 0.00 H new ATOM 0 HD12 LEU A 71 7.561 7.343 10.029 1.00 0.00 H new ATOM 0 HD13 LEU A 71 6.285 6.947 11.204 1.00 0.00 H new ATOM 0 HD21 LEU A 71 5.108 4.608 9.587 1.00 0.00 H new ATOM 0 HD22 LEU A 71 4.121 5.874 10.355 1.00 0.00 H new ATOM 0 HD23 LEU A 71 3.956 5.551 8.613 1.00 0.00 H new ATOM 60 N ILE A 72 1.833 7.121 7.795 1.00 0.00 N ATOM 61 CA ILE A 72 0.487 6.842 8.277 1.00 0.00 C ATOM 62 C ILE A 72 0.438 5.482 8.961 1.00 0.00 C ATOM 63 O ILE A 72 1.174 4.567 8.592 1.00 0.00 O ATOM 64 CB ILE A 72 -0.543 6.868 7.131 1.00 0.00 C ATOM 65 CG1 ILE A 72 -0.364 8.131 6.284 1.00 0.00 C ATOM 66 CG2 ILE A 72 -1.957 6.792 7.688 1.00 0.00 C ATOM 67 CD1 ILE A 72 0.375 7.887 4.987 1.00 0.00 C ATOM 0 H ILE A 72 2.059 6.684 6.901 1.00 0.00 H new ATOM 0 HA ILE A 72 0.232 7.624 8.992 1.00 0.00 H new ATOM 0 HB ILE A 72 -0.378 6.000 6.493 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -1.345 8.551 6.061 1.00 0.00 H new ATOM 0 HG13 ILE A 72 0.177 8.876 6.867 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.673 6.811 6.867 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -2.077 5.867 8.252 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -2.135 7.643 8.345 1.00 0.00 H new ATOM 0 HD11 ILE A 72 0.466 8.824 4.438 1.00 0.00 H new ATOM 0 HD12 ILE A 72 1.369 7.495 5.203 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -0.176 7.165 4.384 1.00 0.00 H new ATOM 79 N GLN A 73 -0.425 5.350 9.962 1.00 0.00 N ATOM 80 CA GLN A 73 -0.547 4.093 10.691 1.00 0.00 C ATOM 81 C GLN A 73 -2.006 3.710 10.905 1.00 0.00 C ATOM 82 O GLN A 73 -2.781 4.468 11.491 1.00 0.00 O ATOM 83 CB GLN A 73 0.169 4.193 12.039 1.00 0.00 C ATOM 84 CG GLN A 73 1.673 4.379 11.915 1.00 0.00 C ATOM 85 CD GLN A 73 2.443 3.619 12.977 1.00 0.00 C ATOM 86 OE1 GLN A 73 2.301 2.404 13.114 1.00 0.00 O ATOM 87 NE2 GLN A 73 3.266 4.333 13.737 1.00 0.00 N ATOM 0 H GLN A 73 -1.046 6.092 10.285 1.00 0.00 H new ATOM 0 HA GLN A 73 -0.079 3.314 10.089 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -0.247 5.029 12.601 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -0.031 3.290 12.616 1.00 0.00 H new ATOM 0 HG2 GLN A 73 1.997 4.046 10.929 1.00 0.00 H new ATOM 0 HG3 GLN A 73 1.912 5.440 11.988 1.00 0.00 H new ATOM 0 HE21 GLN A 73 3.353 5.338 13.589 1.00 0.00 H new ATOM 0 HE22 GLN A 73 3.811 3.876 14.468 1.00 0.00 H new ATOM 96 N PHE A 74 -2.369 2.521 10.436 1.00 0.00 N ATOM 97 CA PHE A 74 -3.731 2.019 10.582 1.00 0.00 C ATOM 98 C PHE A 74 -3.719 0.638 11.229 1.00 0.00 C ATOM 99 O PHE A 74 -2.937 -0.231 10.842 1.00 0.00 O ATOM 100 CB PHE A 74 -4.428 1.957 9.222 1.00 0.00 C ATOM 101 CG PHE A 74 -3.698 1.122 8.211 1.00 0.00 C ATOM 102 CD1 PHE A 74 -2.498 1.557 7.671 1.00 0.00 C ATOM 103 CD2 PHE A 74 -4.210 -0.099 7.799 1.00 0.00 C ATOM 104 CE1 PHE A 74 -1.822 0.791 6.741 1.00 0.00 C ATOM 105 CE2 PHE A 74 -3.538 -0.870 6.870 1.00 0.00 C ATOM 106 CZ PHE A 74 -2.344 -0.425 6.340 1.00 0.00 C ATOM 0 H PHE A 74 -1.737 1.885 9.950 1.00 0.00 H new ATOM 0 HA PHE A 74 -4.284 2.704 11.225 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -5.432 1.555 9.356 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -4.539 2.969 8.833 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -2.086 2.506 7.981 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -5.145 -0.451 8.209 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -0.888 1.141 6.328 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -3.947 -1.820 6.559 1.00 0.00 H new ATOM 0 HZ PHE A 74 -1.818 -1.026 5.613 1.00 0.00 H new ATOM 116 N GLU A 75 -4.579 0.445 12.222 1.00 0.00 N ATOM 117 CA GLU A 75 -4.653 -0.828 12.928 1.00 0.00 C ATOM 118 C GLU A 75 -5.467 -1.852 12.142 1.00 0.00 C ATOM 119 O GLU A 75 -6.539 -1.545 11.623 1.00 0.00 O ATOM 120 CB GLU A 75 -5.266 -0.631 14.315 1.00 0.00 C ATOM 121 CG GLU A 75 -4.825 -1.672 15.330 1.00 0.00 C ATOM 122 CD GLU A 75 -4.906 -1.166 16.757 1.00 0.00 C ATOM 123 OE1 GLU A 75 -6.007 -0.760 17.181 1.00 0.00 O ATOM 124 OE2 GLU A 75 -3.866 -1.178 17.450 1.00 0.00 O ATOM 0 H GLU A 75 -5.234 1.152 12.556 1.00 0.00 H new ATOM 0 HA GLU A 75 -3.637 -1.209 13.034 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -4.999 0.359 14.684 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -6.352 -0.657 14.230 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -5.448 -2.561 15.228 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -3.800 -1.974 15.113 1.00 0.00 H new ATOM 131 N LYS A 76 -4.947 -3.073 12.067 1.00 0.00 N ATOM 132 CA LYS A 76 -5.618 -4.153 11.355 1.00 0.00 C ATOM 133 C LYS A 76 -5.722 -5.392 12.240 1.00 0.00 C ATOM 134 O LYS A 76 -4.710 -6.005 12.587 1.00 0.00 O ATOM 135 CB LYS A 76 -4.864 -4.489 10.067 1.00 0.00 C ATOM 136 CG LYS A 76 -5.776 -4.730 8.873 1.00 0.00 C ATOM 137 CD LYS A 76 -5.036 -5.412 7.734 1.00 0.00 C ATOM 138 CE LYS A 76 -5.418 -4.819 6.387 1.00 0.00 C ATOM 139 NZ LYS A 76 -4.287 -4.864 5.420 1.00 0.00 N ATOM 0 H LYS A 76 -4.059 -3.339 12.493 1.00 0.00 H new ATOM 0 HA LYS A 76 -6.624 -3.823 11.097 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -4.180 -3.673 9.833 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -4.255 -5.377 10.234 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -6.622 -5.346 9.179 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -6.182 -3.780 8.527 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -3.961 -5.312 7.885 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -5.260 -6.479 7.740 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -6.268 -5.365 5.978 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -5.739 -3.786 6.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -4.660 -4.966 4.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -3.737 -3.984 5.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -3.673 -5.674 5.641 1.00 0.00 H new ATOM 153 N VAL A 77 -6.947 -5.751 12.605 1.00 0.00 N ATOM 154 CA VAL A 77 -7.183 -6.912 13.454 1.00 0.00 C ATOM 155 C VAL A 77 -7.863 -8.037 12.677 1.00 0.00 C ATOM 156 O VAL A 77 -7.711 -9.213 13.008 1.00 0.00 O ATOM 157 CB VAL A 77 -8.039 -6.534 14.690 1.00 0.00 C ATOM 158 CG1 VAL A 77 -9.461 -7.081 14.582 1.00 0.00 C ATOM 159 CG2 VAL A 77 -7.371 -7.021 15.966 1.00 0.00 C ATOM 0 H VAL A 77 -7.793 -5.254 12.326 1.00 0.00 H new ATOM 0 HA VAL A 77 -6.210 -7.265 13.796 1.00 0.00 H new ATOM 0 HB VAL A 77 -8.110 -5.447 14.724 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -10.029 -6.795 15.467 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -9.942 -6.671 13.694 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -9.428 -8.168 14.508 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -7.984 -6.748 16.825 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -7.261 -8.105 15.928 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -6.388 -6.560 16.061 1.00 0.00 H new ATOM 169 N THR A 78 -8.621 -7.666 11.653 1.00 0.00 N ATOM 170 CA THR A 78 -9.336 -8.641 10.840 1.00 0.00 C ATOM 171 C THR A 78 -8.494 -9.102 9.658 1.00 0.00 C ATOM 172 O THR A 78 -7.579 -8.403 9.221 1.00 0.00 O ATOM 173 CB THR A 78 -10.653 -8.047 10.341 1.00 0.00 C ATOM 174 OG1 THR A 78 -10.858 -6.749 10.869 1.00 0.00 O ATOM 175 CG2 THR A 78 -11.853 -8.885 10.709 1.00 0.00 C ATOM 0 H THR A 78 -8.756 -6.697 11.366 1.00 0.00 H new ATOM 0 HA THR A 78 -9.545 -9.509 11.466 1.00 0.00 H new ATOM 0 HB THR A 78 -10.563 -8.016 9.255 1.00 0.00 H new ATOM 0 HG1 THR A 78 -11.706 -6.390 10.534 1.00 0.00 H new ATOM 0 HG21 THR A 78 -12.758 -8.412 10.327 1.00 0.00 H new ATOM 0 HG22 THR A 78 -11.751 -9.878 10.272 1.00 0.00 H new ATOM 0 HG23 THR A 78 -11.918 -8.971 11.794 1.00 0.00 H new ATOM 183 N GLU A 79 -8.817 -10.283 9.139 1.00 0.00 N ATOM 184 CA GLU A 79 -8.096 -10.835 8.002 1.00 0.00 C ATOM 185 C GLU A 79 -8.777 -10.450 6.703 1.00 0.00 C ATOM 186 O GLU A 79 -9.665 -11.149 6.215 1.00 0.00 O ATOM 187 CB GLU A 79 -7.981 -12.357 8.118 1.00 0.00 C ATOM 188 CG GLU A 79 -6.556 -12.871 7.983 1.00 0.00 C ATOM 189 CD GLU A 79 -6.321 -14.152 8.760 1.00 0.00 C ATOM 190 OE1 GLU A 79 -6.755 -14.225 9.929 1.00 0.00 O ATOM 191 OE2 GLU A 79 -5.704 -15.081 8.200 1.00 0.00 O ATOM 0 H GLU A 79 -9.572 -10.873 9.488 1.00 0.00 H new ATOM 0 HA GLU A 79 -7.089 -10.417 8.001 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -8.382 -12.671 9.082 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -8.600 -12.820 7.349 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -6.334 -13.044 6.930 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -5.863 -12.106 8.333 1.00 0.00 H new ATOM 198 N GLU A 80 -8.362 -9.316 6.166 1.00 0.00 N ATOM 199 CA GLU A 80 -8.930 -8.800 4.938 1.00 0.00 C ATOM 200 C GLU A 80 -7.989 -7.792 4.282 1.00 0.00 C ATOM 201 O GLU A 80 -7.196 -7.140 4.961 1.00 0.00 O ATOM 202 CB GLU A 80 -10.268 -8.151 5.263 1.00 0.00 C ATOM 203 CG GLU A 80 -11.455 -8.846 4.620 1.00 0.00 C ATOM 204 CD GLU A 80 -12.743 -8.633 5.390 1.00 0.00 C ATOM 205 OE1 GLU A 80 -12.829 -9.103 6.544 1.00 0.00 O ATOM 206 OE2 GLU A 80 -13.666 -7.996 4.840 1.00 0.00 O ATOM 0 H GLU A 80 -7.628 -8.733 6.567 1.00 0.00 H new ATOM 0 HA GLU A 80 -9.075 -9.617 4.231 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -10.405 -8.143 6.344 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -10.246 -7.111 4.937 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -11.580 -8.477 3.602 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -11.251 -9.914 4.549 1.00 0.00 H new ATOM 213 N PRO A 81 -8.063 -7.649 2.948 1.00 0.00 N ATOM 214 CA PRO A 81 -7.210 -6.714 2.207 1.00 0.00 C ATOM 215 C PRO A 81 -7.409 -5.271 2.658 1.00 0.00 C ATOM 216 O PRO A 81 -8.507 -4.879 3.052 1.00 0.00 O ATOM 217 CB PRO A 81 -7.657 -6.887 0.749 1.00 0.00 C ATOM 218 CG PRO A 81 -8.999 -7.530 0.825 1.00 0.00 C ATOM 219 CD PRO A 81 -8.977 -8.383 2.060 1.00 0.00 C ATOM 0 HA PRO A 81 -6.151 -6.921 2.364 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -7.709 -5.926 0.237 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -6.954 -7.507 0.193 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -9.789 -6.781 0.882 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -9.194 -8.132 -0.062 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -9.970 -8.486 2.498 1.00 0.00 H new ATOM 0 HD3 PRO A 81 -8.615 -9.389 1.850 1.00 0.00 H new ATOM 227 N MET A 82 -6.338 -4.486 2.598 1.00 0.00 N ATOM 228 CA MET A 82 -6.392 -3.084 3.000 1.00 0.00 C ATOM 229 C MET A 82 -7.479 -2.337 2.236 1.00 0.00 C ATOM 230 O MET A 82 -8.207 -1.524 2.805 1.00 0.00 O ATOM 231 CB MET A 82 -5.039 -2.414 2.756 1.00 0.00 C ATOM 232 CG MET A 82 -4.746 -1.265 3.706 1.00 0.00 C ATOM 233 SD MET A 82 -3.261 -0.349 3.246 1.00 0.00 S ATOM 234 CE MET A 82 -2.136 -1.690 2.863 1.00 0.00 C ATOM 0 H MET A 82 -5.422 -4.797 2.275 1.00 0.00 H new ATOM 0 HA MET A 82 -6.629 -3.047 4.063 1.00 0.00 H new ATOM 0 HB2 MET A 82 -4.251 -3.161 2.850 1.00 0.00 H new ATOM 0 HB3 MET A 82 -5.006 -2.044 1.731 1.00 0.00 H new ATOM 0 HG2 MET A 82 -5.598 -0.585 3.722 1.00 0.00 H new ATOM 0 HG3 MET A 82 -4.630 -1.655 4.717 1.00 0.00 H new ATOM 0 HE1 MET A 82 -1.313 -1.689 3.577 1.00 0.00 H new ATOM 0 HE2 MET A 82 -2.668 -2.640 2.923 1.00 0.00 H new ATOM 0 HE3 MET A 82 -1.742 -1.558 1.855 1.00 0.00 H new ATOM 244 N GLY A 83 -7.579 -2.614 0.940 1.00 0.00 N ATOM 245 CA GLY A 83 -8.574 -1.958 0.115 1.00 0.00 C ATOM 246 C GLY A 83 -7.955 -1.112 -0.983 1.00 0.00 C ATOM 247 O GLY A 83 -8.666 -0.464 -1.751 1.00 0.00 O ATOM 0 H GLY A 83 -6.987 -3.282 0.447 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -9.223 -2.711 -0.333 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -9.204 -1.328 0.743 1.00 0.00 H new ATOM 251 N ILE A 84 -6.627 -1.120 -1.057 1.00 0.00 N ATOM 252 CA ILE A 84 -5.911 -0.353 -2.068 1.00 0.00 C ATOM 253 C ILE A 84 -5.033 -1.262 -2.917 1.00 0.00 C ATOM 254 O ILE A 84 -4.775 -2.409 -2.549 1.00 0.00 O ATOM 255 CB ILE A 84 -5.031 0.740 -1.426 1.00 0.00 C ATOM 256 CG1 ILE A 84 -4.305 0.193 -0.194 1.00 0.00 C ATOM 257 CG2 ILE A 84 -5.875 1.947 -1.053 1.00 0.00 C ATOM 258 CD1 ILE A 84 -3.296 -0.889 -0.512 1.00 0.00 C ATOM 0 H ILE A 84 -6.025 -1.651 -0.427 1.00 0.00 H new ATOM 0 HA ILE A 84 -6.661 0.122 -2.700 1.00 0.00 H new ATOM 0 HB ILE A 84 -4.282 1.051 -2.155 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -3.797 1.014 0.311 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -5.042 -0.204 0.504 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -5.240 2.709 -0.601 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -6.347 2.352 -1.948 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -6.644 1.647 -0.341 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -2.822 -1.227 0.410 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -3.801 -1.729 -0.990 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -2.537 -0.492 -1.186 1.00 0.00 H new ATOM 270 N CYS A 85 -4.571 -0.747 -4.051 1.00 0.00 N ATOM 271 CA CYS A 85 -3.716 -1.522 -4.941 1.00 0.00 C ATOM 272 C CYS A 85 -2.536 -0.677 -5.413 1.00 0.00 C ATOM 273 O CYS A 85 -2.717 0.453 -5.860 1.00 0.00 O ATOM 274 CB CYS A 85 -4.519 -2.047 -6.135 1.00 0.00 C ATOM 275 SG CYS A 85 -6.158 -2.712 -5.689 1.00 0.00 S ATOM 0 H CYS A 85 -4.773 0.199 -4.374 1.00 0.00 H new ATOM 0 HA CYS A 85 -3.327 -2.378 -4.390 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -4.649 -1.240 -6.856 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -3.944 -2.828 -6.632 1.00 0.00 H new ATOM 280 N LEU A 86 -1.333 -1.236 -5.288 1.00 0.00 N ATOM 281 CA LEU A 86 -0.103 -0.547 -5.673 1.00 0.00 C ATOM 282 C LEU A 86 0.667 -1.339 -6.729 1.00 0.00 C ATOM 283 O LEU A 86 0.470 -2.543 -6.877 1.00 0.00 O ATOM 284 CB LEU A 86 0.791 -0.339 -4.445 1.00 0.00 C ATOM 285 CG LEU A 86 0.235 0.597 -3.369 1.00 0.00 C ATOM 286 CD1 LEU A 86 -1.091 0.080 -2.833 1.00 0.00 C ATOM 287 CD2 LEU A 86 1.240 0.755 -2.237 1.00 0.00 C ATOM 0 H LEU A 86 -1.184 -2.175 -4.919 1.00 0.00 H new ATOM 0 HA LEU A 86 -0.380 0.419 -6.095 1.00 0.00 H new ATOM 0 HB2 LEU A 86 0.984 -1.311 -3.990 1.00 0.00 H new ATOM 0 HB3 LEU A 86 1.751 0.053 -4.780 1.00 0.00 H new ATOM 0 HG LEU A 86 0.060 1.573 -3.822 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -1.466 0.762 -2.070 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -1.812 0.015 -3.648 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -0.947 -0.908 -2.397 1.00 0.00 H new ATOM 0 HD21 LEU A 86 0.832 1.423 -1.479 1.00 0.00 H new ATOM 0 HD22 LEU A 86 1.442 -0.219 -1.791 1.00 0.00 H new ATOM 0 HD23 LEU A 86 2.167 1.174 -2.629 1.00 0.00 H new ATOM 299 N LYS A 87 1.548 -0.656 -7.456 1.00 0.00 N ATOM 300 CA LYS A 87 2.349 -1.301 -8.495 1.00 0.00 C ATOM 301 C LYS A 87 3.798 -0.823 -8.453 1.00 0.00 C ATOM 302 O LYS A 87 4.080 0.294 -8.016 1.00 0.00 O ATOM 303 CB LYS A 87 1.755 -1.033 -9.883 1.00 0.00 C ATOM 304 CG LYS A 87 1.037 0.304 -10.012 1.00 0.00 C ATOM 305 CD LYS A 87 1.958 1.383 -10.556 1.00 0.00 C ATOM 306 CE LYS A 87 2.232 1.189 -12.039 1.00 0.00 C ATOM 307 NZ LYS A 87 3.438 0.348 -12.276 1.00 0.00 N ATOM 0 H LYS A 87 1.726 0.342 -7.346 1.00 0.00 H new ATOM 0 HA LYS A 87 2.333 -2.374 -8.302 1.00 0.00 H new ATOM 0 HB2 LYS A 87 2.555 -1.075 -10.622 1.00 0.00 H new ATOM 0 HB3 LYS A 87 1.055 -1.833 -10.126 1.00 0.00 H new ATOM 0 HG2 LYS A 87 0.176 0.193 -10.671 1.00 0.00 H new ATOM 0 HG3 LYS A 87 0.655 0.608 -9.037 1.00 0.00 H new ATOM 0 HD2 LYS A 87 1.508 2.362 -10.394 1.00 0.00 H new ATOM 0 HD3 LYS A 87 2.899 1.370 -10.007 1.00 0.00 H new ATOM 0 HE2 LYS A 87 1.366 0.723 -12.510 1.00 0.00 H new ATOM 0 HE3 LYS A 87 2.368 2.161 -12.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 3.820 0.547 -13.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 4.159 0.566 -11.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 3.178 -0.657 -12.212 1.00 0.00 H new ATOM 321 N LEU A 88 4.715 -1.677 -8.914 1.00 0.00 N ATOM 322 CA LEU A 88 6.135 -1.345 -8.935 1.00 0.00 C ATOM 323 C LEU A 88 6.580 -0.956 -10.341 1.00 0.00 C ATOM 324 O LEU A 88 6.765 -1.814 -11.204 1.00 0.00 O ATOM 325 CB LEU A 88 6.979 -2.524 -8.433 1.00 0.00 C ATOM 326 CG LEU A 88 6.319 -3.425 -7.381 1.00 0.00 C ATOM 327 CD1 LEU A 88 5.503 -2.606 -6.390 1.00 0.00 C ATOM 328 CD2 LEU A 88 5.450 -4.476 -8.054 1.00 0.00 C ATOM 0 H LEU A 88 4.495 -2.604 -9.278 1.00 0.00 H new ATOM 0 HA LEU A 88 6.286 -0.495 -8.269 1.00 0.00 H new ATOM 0 HB2 LEU A 88 7.252 -3.140 -9.290 1.00 0.00 H new ATOM 0 HB3 LEU A 88 7.905 -2.130 -8.015 1.00 0.00 H new ATOM 0 HG LEU A 88 7.108 -3.931 -6.825 1.00 0.00 H new ATOM 0 HD11 LEU A 88 5.047 -3.271 -5.657 1.00 0.00 H new ATOM 0 HD12 LEU A 88 6.155 -1.896 -5.881 1.00 0.00 H new ATOM 0 HD13 LEU A 88 4.722 -2.063 -6.923 1.00 0.00 H new ATOM 0 HD21 LEU A 88 4.989 -5.107 -7.295 1.00 0.00 H new ATOM 0 HD22 LEU A 88 4.672 -3.985 -8.639 1.00 0.00 H new ATOM 0 HD23 LEU A 88 6.065 -5.090 -8.712 1.00 0.00 H new ATOM 340 N ASN A 89 6.752 0.343 -10.563 1.00 0.00 N ATOM 341 CA ASN A 89 7.178 0.847 -11.863 1.00 0.00 C ATOM 342 C ASN A 89 8.582 0.355 -12.200 1.00 0.00 C ATOM 343 O ASN A 89 9.224 -0.315 -11.392 1.00 0.00 O ATOM 344 CB ASN A 89 7.146 2.377 -11.877 1.00 0.00 C ATOM 345 CG ASN A 89 5.804 2.931 -11.438 1.00 0.00 C ATOM 346 OD1 ASN A 89 4.985 2.220 -10.856 1.00 0.00 O ATOM 347 ND2 ASN A 89 5.573 4.209 -11.716 1.00 0.00 N ATOM 0 H ASN A 89 6.603 1.066 -9.859 1.00 0.00 H new ATOM 0 HA ASN A 89 6.487 0.470 -12.616 1.00 0.00 H new ATOM 0 HB2 ASN A 89 7.927 2.760 -11.220 1.00 0.00 H new ATOM 0 HB3 ASN A 89 7.372 2.733 -12.882 1.00 0.00 H new ATOM 0 HD21 ASN A 89 4.688 4.638 -11.445 1.00 0.00 H new ATOM 0 HD22 ASN A 89 6.281 4.762 -12.200 1.00 0.00 H new ATOM 354 N GLU A 90 9.054 0.690 -13.398 1.00 0.00 N ATOM 355 CA GLU A 90 10.384 0.281 -13.839 1.00 0.00 C ATOM 356 C GLU A 90 11.444 0.668 -12.810 1.00 0.00 C ATOM 357 O GLU A 90 12.474 0.005 -12.685 1.00 0.00 O ATOM 358 CB GLU A 90 10.712 0.920 -15.190 1.00 0.00 C ATOM 359 CG GLU A 90 11.506 0.013 -16.116 1.00 0.00 C ATOM 360 CD GLU A 90 11.703 0.617 -17.493 1.00 0.00 C ATOM 361 OE1 GLU A 90 10.746 0.588 -18.296 1.00 0.00 O ATOM 362 OE2 GLU A 90 12.813 1.118 -17.770 1.00 0.00 O ATOM 0 H GLU A 90 8.535 1.243 -14.080 1.00 0.00 H new ATOM 0 HA GLU A 90 10.387 -0.804 -13.945 1.00 0.00 H new ATOM 0 HB2 GLU A 90 9.782 1.204 -15.683 1.00 0.00 H new ATOM 0 HB3 GLU A 90 11.277 1.837 -15.021 1.00 0.00 H new ATOM 0 HG2 GLU A 90 12.479 -0.193 -15.671 1.00 0.00 H new ATOM 0 HG3 GLU A 90 10.991 -0.943 -16.212 1.00 0.00 H new ATOM 369 N LYS A 91 11.180 1.743 -12.075 1.00 0.00 N ATOM 370 CA LYS A 91 12.105 2.220 -11.052 1.00 0.00 C ATOM 371 C LYS A 91 11.955 1.423 -9.754 1.00 0.00 C ATOM 372 O LYS A 91 12.679 1.657 -8.788 1.00 0.00 O ATOM 373 CB LYS A 91 11.867 3.712 -10.787 1.00 0.00 C ATOM 374 CG LYS A 91 12.620 4.258 -9.583 1.00 0.00 C ATOM 375 CD LYS A 91 14.106 3.937 -9.659 1.00 0.00 C ATOM 376 CE LYS A 91 14.959 5.158 -9.350 1.00 0.00 C ATOM 377 NZ LYS A 91 15.511 5.115 -7.967 1.00 0.00 N ATOM 0 H LYS A 91 10.332 2.302 -12.169 1.00 0.00 H new ATOM 0 HA LYS A 91 13.121 2.077 -11.419 1.00 0.00 H new ATOM 0 HB2 LYS A 91 12.159 4.278 -11.672 1.00 0.00 H new ATOM 0 HB3 LYS A 91 10.800 3.878 -10.640 1.00 0.00 H new ATOM 0 HG2 LYS A 91 12.483 5.338 -9.526 1.00 0.00 H new ATOM 0 HG3 LYS A 91 12.202 3.835 -8.669 1.00 0.00 H new ATOM 0 HD2 LYS A 91 14.343 3.139 -8.955 1.00 0.00 H new ATOM 0 HD3 LYS A 91 14.348 3.566 -10.655 1.00 0.00 H new ATOM 0 HE2 LYS A 91 15.778 5.219 -10.066 1.00 0.00 H new ATOM 0 HE3 LYS A 91 14.360 6.060 -9.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 16.086 5.965 -7.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 14.729 5.083 -7.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 16.104 4.268 -7.856 1.00 0.00 H new ATOM 391 N GLN A 92 11.009 0.487 -9.735 1.00 0.00 N ATOM 392 CA GLN A 92 10.770 -0.333 -8.554 1.00 0.00 C ATOM 393 C GLN A 92 10.295 0.531 -7.390 1.00 0.00 C ATOM 394 O GLN A 92 11.097 0.988 -6.575 1.00 0.00 O ATOM 395 CB GLN A 92 12.038 -1.093 -8.159 1.00 0.00 C ATOM 396 CG GLN A 92 12.542 -2.037 -9.239 1.00 0.00 C ATOM 397 CD GLN A 92 13.690 -1.449 -10.037 1.00 0.00 C ATOM 398 OE1 GLN A 92 14.098 -0.310 -9.813 1.00 0.00 O ATOM 399 NE2 GLN A 92 14.217 -2.227 -10.976 1.00 0.00 N ATOM 0 H GLN A 92 10.397 0.279 -10.524 1.00 0.00 H new ATOM 0 HA GLN A 92 9.991 -1.056 -8.795 1.00 0.00 H new ATOM 0 HB2 GLN A 92 12.823 -0.375 -7.920 1.00 0.00 H new ATOM 0 HB3 GLN A 92 11.842 -1.664 -7.251 1.00 0.00 H new ATOM 0 HG2 GLN A 92 12.865 -2.971 -8.779 1.00 0.00 H new ATOM 0 HG3 GLN A 92 11.722 -2.281 -9.915 1.00 0.00 H new ATOM 0 HE21 GLN A 92 13.847 -3.165 -11.128 1.00 0.00 H new ATOM 0 HE22 GLN A 92 14.992 -1.886 -11.545 1.00 0.00 H new ATOM 408 N SER A 93 8.986 0.752 -7.321 1.00 0.00 N ATOM 409 CA SER A 93 8.403 1.563 -6.258 1.00 0.00 C ATOM 410 C SER A 93 6.915 1.272 -6.128 1.00 0.00 C ATOM 411 O SER A 93 6.215 1.136 -7.127 1.00 0.00 O ATOM 412 CB SER A 93 8.625 3.051 -6.538 1.00 0.00 C ATOM 413 OG SER A 93 9.890 3.477 -6.058 1.00 0.00 O ATOM 0 H SER A 93 8.309 0.381 -7.988 1.00 0.00 H new ATOM 0 HA SER A 93 8.895 1.307 -5.319 1.00 0.00 H new ATOM 0 HB2 SER A 93 8.558 3.237 -7.610 1.00 0.00 H new ATOM 0 HB3 SER A 93 7.837 3.635 -6.063 1.00 0.00 H new ATOM 0 HG SER A 93 10.537 2.746 -6.148 1.00 0.00 H new ATOM 419 N CYS A 94 6.436 1.168 -4.897 1.00 0.00 N ATOM 420 CA CYS A 94 5.029 0.873 -4.662 1.00 0.00 C ATOM 421 C CYS A 94 4.191 2.144 -4.626 1.00 0.00 C ATOM 422 O CYS A 94 4.341 2.982 -3.738 1.00 0.00 O ATOM 423 CB CYS A 94 4.857 0.096 -3.355 1.00 0.00 C ATOM 424 SG CYS A 94 5.633 0.876 -1.920 1.00 0.00 S ATOM 0 H CYS A 94 6.995 1.282 -4.051 1.00 0.00 H new ATOM 0 HA CYS A 94 4.678 0.260 -5.492 1.00 0.00 H new ATOM 0 HB2 CYS A 94 3.792 -0.027 -3.156 1.00 0.00 H new ATOM 0 HB3 CYS A 94 5.275 -0.903 -3.482 1.00 0.00 H new ATOM 0 HG CYS A 94 5.813 2.141 -2.158 1.00 0.00 H new ATOM 430 N THR A 95 3.294 2.266 -5.598 1.00 0.00 N ATOM 431 CA THR A 95 2.403 3.413 -5.694 1.00 0.00 C ATOM 432 C THR A 95 0.985 2.919 -5.920 1.00 0.00 C ATOM 433 O THR A 95 0.756 2.067 -6.776 1.00 0.00 O ATOM 434 CB THR A 95 2.828 4.328 -6.841 1.00 0.00 C ATOM 435 OG1 THR A 95 4.226 4.554 -6.813 1.00 0.00 O ATOM 436 CG2 THR A 95 2.144 5.678 -6.820 1.00 0.00 C ATOM 0 H THR A 95 3.165 1.575 -6.338 1.00 0.00 H new ATOM 0 HA THR A 95 2.451 3.985 -4.767 1.00 0.00 H new ATOM 0 HB THR A 95 2.531 3.804 -7.749 1.00 0.00 H new ATOM 0 HG1 THR A 95 4.477 5.141 -7.557 1.00 0.00 H new ATOM 0 HG21 THR A 95 2.493 6.276 -7.662 1.00 0.00 H new ATOM 0 HG22 THR A 95 1.065 5.541 -6.895 1.00 0.00 H new ATOM 0 HG23 THR A 95 2.381 6.191 -5.888 1.00 0.00 H new ATOM 444 N VAL A 96 0.034 3.434 -5.151 1.00 0.00 N ATOM 445 CA VAL A 96 -1.344 2.997 -5.292 1.00 0.00 C ATOM 446 C VAL A 96 -1.845 3.248 -6.707 1.00 0.00 C ATOM 447 O VAL A 96 -2.105 4.385 -7.099 1.00 0.00 O ATOM 448 CB VAL A 96 -2.275 3.675 -4.268 1.00 0.00 C ATOM 449 CG1 VAL A 96 -2.151 5.183 -4.316 1.00 0.00 C ATOM 450 CG2 VAL A 96 -3.719 3.234 -4.474 1.00 0.00 C ATOM 0 H VAL A 96 0.190 4.143 -4.435 1.00 0.00 H new ATOM 0 HA VAL A 96 -1.362 1.925 -5.093 1.00 0.00 H new ATOM 0 HB VAL A 96 -1.962 3.356 -3.274 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -2.822 5.627 -3.581 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -1.124 5.471 -4.091 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -2.418 5.538 -5.311 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -4.358 3.725 -3.740 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -4.043 3.507 -5.478 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -3.790 2.153 -4.351 1.00 0.00 H new ATOM 460 N ALA A 97 -1.965 2.168 -7.468 1.00 0.00 N ATOM 461 CA ALA A 97 -2.422 2.248 -8.844 1.00 0.00 C ATOM 462 C ALA A 97 -3.915 2.549 -8.916 1.00 0.00 C ATOM 463 O ALA A 97 -4.402 3.068 -9.921 1.00 0.00 O ATOM 464 CB ALA A 97 -2.095 0.953 -9.570 1.00 0.00 C ATOM 0 H ALA A 97 -1.750 1.223 -7.151 1.00 0.00 H new ATOM 0 HA ALA A 97 -1.901 3.071 -9.334 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -2.440 1.017 -10.602 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -1.017 0.791 -9.557 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -2.593 0.121 -9.072 1.00 0.00 H new ATOM 470 N ARG A 98 -4.641 2.224 -7.848 1.00 0.00 N ATOM 471 CA ARG A 98 -6.079 2.472 -7.811 1.00 0.00 C ATOM 472 C ARG A 98 -6.661 2.185 -6.430 1.00 0.00 C ATOM 473 O ARG A 98 -6.409 1.131 -5.846 1.00 0.00 O ATOM 474 CB ARG A 98 -6.789 1.615 -8.861 1.00 0.00 C ATOM 475 CG ARG A 98 -8.144 2.165 -9.278 1.00 0.00 C ATOM 476 CD ARG A 98 -8.462 1.827 -10.727 1.00 0.00 C ATOM 477 NE ARG A 98 -9.507 0.811 -10.836 1.00 0.00 N ATOM 478 CZ ARG A 98 -10.805 1.065 -10.686 1.00 0.00 C ATOM 479 NH1 ARG A 98 -11.221 2.296 -10.421 1.00 0.00 N ATOM 480 NH2 ARG A 98 -11.690 0.083 -10.803 1.00 0.00 N ATOM 0 H ARG A 98 -4.261 1.793 -7.005 1.00 0.00 H new ATOM 0 HA ARG A 98 -6.239 3.527 -8.033 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -6.152 1.533 -9.742 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -6.920 0.607 -8.467 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -8.919 1.756 -8.630 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -8.155 3.247 -9.145 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -8.779 2.730 -11.249 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -7.559 1.472 -11.223 1.00 0.00 H new ATOM 0 HE ARG A 98 -9.225 -0.148 -11.039 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -10.545 3.054 -10.331 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -12.217 2.484 -10.307 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -11.375 -0.865 -11.008 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -12.685 0.277 -10.688 1.00 0.00 H new ATOM 494 N ILE A 99 -7.452 3.126 -5.920 1.00 0.00 N ATOM 495 CA ILE A 99 -8.082 2.967 -4.615 1.00 0.00 C ATOM 496 C ILE A 99 -9.446 2.296 -4.758 1.00 0.00 C ATOM 497 O ILE A 99 -10.417 2.930 -5.172 1.00 0.00 O ATOM 498 CB ILE A 99 -8.267 4.321 -3.901 1.00 0.00 C ATOM 499 CG1 ILE A 99 -6.931 5.063 -3.810 1.00 0.00 C ATOM 500 CG2 ILE A 99 -8.862 4.116 -2.512 1.00 0.00 C ATOM 501 CD1 ILE A 99 -5.940 4.410 -2.871 1.00 0.00 C ATOM 0 H ILE A 99 -7.671 4.004 -6.391 1.00 0.00 H new ATOM 0 HA ILE A 99 -7.419 2.343 -4.016 1.00 0.00 H new ATOM 0 HB ILE A 99 -8.960 4.928 -4.484 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -6.490 5.125 -4.805 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -7.114 6.085 -3.479 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -8.986 5.082 -2.023 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -9.832 3.627 -2.600 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -8.194 3.492 -1.919 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -5.017 4.989 -2.856 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -6.361 4.373 -1.866 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -5.727 3.397 -3.213 1.00 0.00 H new ATOM 513 N LEU A 100 -9.513 1.013 -4.422 1.00 0.00 N ATOM 514 CA LEU A 100 -10.759 0.263 -4.523 1.00 0.00 C ATOM 515 C LEU A 100 -11.801 0.786 -3.542 1.00 0.00 C ATOM 516 O LEU A 100 -11.467 1.252 -2.452 1.00 0.00 O ATOM 517 CB LEU A 100 -10.503 -1.222 -4.267 1.00 0.00 C ATOM 518 CG LEU A 100 -10.068 -2.024 -5.493 1.00 0.00 C ATOM 519 CD1 LEU A 100 -8.927 -1.323 -6.216 1.00 0.00 C ATOM 520 CD2 LEU A 100 -9.662 -3.434 -5.088 1.00 0.00 C ATOM 0 H LEU A 100 -8.720 0.471 -4.078 1.00 0.00 H new ATOM 0 HA LEU A 100 -11.147 0.394 -5.533 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -9.735 -1.316 -3.499 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -11.412 -1.668 -3.864 1.00 0.00 H new ATOM 0 HG LEU A 100 -10.913 -2.092 -6.178 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -8.632 -1.910 -7.086 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -9.254 -0.335 -6.539 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -8.077 -1.221 -5.542 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -9.355 -3.992 -5.972 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -8.832 -3.385 -4.383 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -10.508 -3.935 -4.618 1.00 0.00 H new ATOM 532 N HIS A 101 -13.067 0.701 -3.938 1.00 0.00 N ATOM 533 CA HIS A 101 -14.166 1.160 -3.097 1.00 0.00 C ATOM 534 C HIS A 101 -14.596 0.066 -2.126 1.00 0.00 C ATOM 535 O HIS A 101 -14.610 -1.115 -2.473 1.00 0.00 O ATOM 536 CB HIS A 101 -15.352 1.586 -3.964 1.00 0.00 C ATOM 537 CG HIS A 101 -16.519 2.095 -3.177 1.00 0.00 C ATOM 538 ND1 HIS A 101 -17.595 1.304 -2.827 1.00 0.00 N ATOM 539 CD2 HIS A 101 -16.779 3.324 -2.668 1.00 0.00 C ATOM 540 CE1 HIS A 101 -18.464 2.024 -2.140 1.00 0.00 C ATOM 541 NE2 HIS A 101 -17.992 3.253 -2.030 1.00 0.00 N ATOM 0 H HIS A 101 -13.357 0.318 -4.838 1.00 0.00 H new ATOM 0 HA HIS A 101 -13.820 2.018 -2.520 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -15.025 2.362 -4.656 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -15.674 0.737 -4.567 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -16.149 4.197 -2.749 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -19.401 1.668 -1.737 1.00 0.00 H new ATOM 0 HE2 HIS A 101 -18.454 4.024 -1.549 1.00 0.00 H new ATOM 550 N GLY A 102 -14.945 0.466 -0.908 1.00 0.00 N ATOM 551 CA GLY A 102 -15.369 -0.494 0.093 1.00 0.00 C ATOM 552 C GLY A 102 -14.307 -0.739 1.147 1.00 0.00 C ATOM 553 O GLY A 102 -14.615 -0.871 2.331 1.00 0.00 O ATOM 0 H GLY A 102 -14.942 1.437 -0.597 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -16.278 -0.135 0.575 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -15.617 -1.437 -0.394 1.00 0.00 H new ATOM 557 N GLY A 103 -13.050 -0.798 0.714 1.00 0.00 N ATOM 558 CA GLY A 103 -11.956 -1.028 1.640 1.00 0.00 C ATOM 559 C GLY A 103 -11.946 -0.038 2.790 1.00 0.00 C ATOM 560 O GLY A 103 -12.819 0.824 2.882 1.00 0.00 O ATOM 0 H GLY A 103 -12.771 -0.691 -0.261 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -12.028 -2.040 2.038 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -11.010 -0.964 1.102 1.00 0.00 H new ATOM 564 N MET A 104 -10.959 -0.167 3.671 1.00 0.00 N ATOM 565 CA MET A 104 -10.842 0.723 4.822 1.00 0.00 C ATOM 566 C MET A 104 -10.113 2.010 4.451 1.00 0.00 C ATOM 567 O MET A 104 -10.358 3.064 5.038 1.00 0.00 O ATOM 568 CB MET A 104 -10.110 0.018 5.966 1.00 0.00 C ATOM 569 CG MET A 104 -8.773 -0.580 5.560 1.00 0.00 C ATOM 570 SD MET A 104 -7.802 -1.137 6.973 1.00 0.00 S ATOM 571 CE MET A 104 -7.473 0.421 7.795 1.00 0.00 C ATOM 0 H MET A 104 -10.230 -0.878 3.611 1.00 0.00 H new ATOM 0 HA MET A 104 -11.849 0.983 5.149 1.00 0.00 H new ATOM 0 HB2 MET A 104 -9.949 0.730 6.775 1.00 0.00 H new ATOM 0 HB3 MET A 104 -10.747 -0.774 6.360 1.00 0.00 H new ATOM 0 HG2 MET A 104 -8.945 -1.421 4.888 1.00 0.00 H new ATOM 0 HG3 MET A 104 -8.202 0.162 5.002 1.00 0.00 H new ATOM 0 HE1 MET A 104 -7.004 0.231 8.760 1.00 0.00 H new ATOM 0 HE2 MET A 104 -6.805 1.023 7.179 1.00 0.00 H new ATOM 0 HE3 MET A 104 -8.410 0.958 7.946 1.00 0.00 H new ATOM 581 N ILE A 105 -9.216 1.921 3.473 1.00 0.00 N ATOM 582 CA ILE A 105 -8.456 3.081 3.027 1.00 0.00 C ATOM 583 C ILE A 105 -9.352 4.070 2.290 1.00 0.00 C ATOM 584 O ILE A 105 -9.201 5.283 2.430 1.00 0.00 O ATOM 585 CB ILE A 105 -7.291 2.668 2.107 1.00 0.00 C ATOM 586 CG1 ILE A 105 -6.453 1.574 2.771 1.00 0.00 C ATOM 587 CG2 ILE A 105 -6.425 3.875 1.772 1.00 0.00 C ATOM 588 CD1 ILE A 105 -5.769 2.027 4.043 1.00 0.00 C ATOM 0 H ILE A 105 -8.999 1.057 2.975 1.00 0.00 H new ATOM 0 HA ILE A 105 -8.049 3.559 3.918 1.00 0.00 H new ATOM 0 HB ILE A 105 -7.703 2.273 1.179 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -7.095 0.722 2.996 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -5.698 1.227 2.066 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -5.607 3.566 1.122 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -7.029 4.626 1.264 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -6.018 4.297 2.691 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -5.193 1.201 4.460 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -5.102 2.860 3.821 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -6.520 2.347 4.766 1.00 0.00 H new ATOM 600 N HIS A 106 -10.288 3.542 1.508 1.00 0.00 N ATOM 601 CA HIS A 106 -11.212 4.381 0.756 1.00 0.00 C ATOM 602 C HIS A 106 -12.309 4.918 1.668 1.00 0.00 C ATOM 603 O HIS A 106 -12.655 6.098 1.613 1.00 0.00 O ATOM 604 CB HIS A 106 -11.833 3.590 -0.397 1.00 0.00 C ATOM 605 CG HIS A 106 -12.509 4.451 -1.417 1.00 0.00 C ATOM 606 ND1 HIS A 106 -11.875 5.492 -2.063 1.00 0.00 N ATOM 607 CD2 HIS A 106 -13.774 4.425 -1.902 1.00 0.00 C ATOM 608 CE1 HIS A 106 -12.720 6.068 -2.900 1.00 0.00 C ATOM 609 NE2 HIS A 106 -13.877 5.439 -2.822 1.00 0.00 N ATOM 0 H HIS A 106 -10.426 2.540 1.379 1.00 0.00 H new ATOM 0 HA HIS A 106 -10.654 5.223 0.346 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -11.054 3.005 -0.886 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -12.557 2.883 0.007 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -14.555 3.736 -1.618 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -12.501 6.910 -3.539 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -14.713 5.669 -3.359 1.00 0.00 H new ATOM 618 N ARG A 107 -12.846 4.044 2.513 1.00 0.00 N ATOM 619 CA ARG A 107 -13.897 4.429 3.445 1.00 0.00 C ATOM 620 C ARG A 107 -13.374 5.452 4.447 1.00 0.00 C ATOM 621 O ARG A 107 -13.987 6.498 4.661 1.00 0.00 O ATOM 622 CB ARG A 107 -14.431 3.199 4.183 1.00 0.00 C ATOM 623 CG ARG A 107 -15.696 2.620 3.569 1.00 0.00 C ATOM 624 CD ARG A 107 -16.372 1.636 4.511 1.00 0.00 C ATOM 625 NE ARG A 107 -17.825 1.789 4.511 1.00 0.00 N ATOM 626 CZ ARG A 107 -18.624 1.286 3.573 1.00 0.00 C ATOM 627 NH1 ARG A 107 -18.117 0.599 2.557 1.00 0.00 N ATOM 628 NH2 ARG A 107 -19.935 1.468 3.651 1.00 0.00 N ATOM 0 H ARG A 107 -12.570 3.064 2.571 1.00 0.00 H new ATOM 0 HA ARG A 107 -14.711 4.880 2.877 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -13.659 2.430 4.195 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -14.631 3.467 5.220 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -16.387 3.428 3.327 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -15.451 2.119 2.632 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -16.115 0.618 4.218 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -15.992 1.782 5.522 1.00 0.00 H new ATOM 0 HE ARG A 107 -18.252 2.312 5.275 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -17.109 0.454 2.492 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -18.735 0.216 1.841 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -20.331 1.994 4.430 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -20.547 1.082 2.932 1.00 0.00 H new ATOM 642 N GLN A 108 -12.234 5.142 5.056 1.00 0.00 N ATOM 643 CA GLN A 108 -11.622 6.034 6.032 1.00 0.00 C ATOM 644 C GLN A 108 -10.880 7.168 5.334 1.00 0.00 C ATOM 645 O GLN A 108 -10.991 8.330 5.726 1.00 0.00 O ATOM 646 CB GLN A 108 -10.660 5.256 6.935 1.00 0.00 C ATOM 647 CG GLN A 108 -10.086 6.087 8.071 1.00 0.00 C ATOM 648 CD GLN A 108 -10.078 5.342 9.391 1.00 0.00 C ATOM 649 OE1 GLN A 108 -10.999 5.475 10.198 1.00 0.00 O ATOM 650 NE2 GLN A 108 -9.035 4.553 9.619 1.00 0.00 N ATOM 0 H GLN A 108 -11.716 4.279 4.890 1.00 0.00 H new ATOM 0 HA GLN A 108 -12.414 6.463 6.646 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -11.183 4.396 7.353 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -9.841 4.868 6.330 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -9.068 6.385 7.820 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -10.669 7.002 8.178 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -8.294 4.473 8.922 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -8.974 4.027 10.491 1.00 0.00 H new ATOM 659 N GLY A 109 -10.127 6.823 4.293 1.00 0.00 N ATOM 660 CA GLY A 109 -9.382 7.825 3.555 1.00 0.00 C ATOM 661 C GLY A 109 -7.979 8.023 4.094 1.00 0.00 C ATOM 662 O GLY A 109 -7.710 8.996 4.800 1.00 0.00 O ATOM 0 H GLY A 109 -10.020 5.869 3.949 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -9.326 7.532 2.507 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -9.919 8.773 3.593 1.00 0.00 H new ATOM 666 N SER A 110 -7.084 7.099 3.763 1.00 0.00 N ATOM 667 CA SER A 110 -5.701 7.176 4.220 1.00 0.00 C ATOM 668 C SER A 110 -4.743 7.367 3.047 1.00 0.00 C ATOM 669 O SER A 110 -3.668 7.948 3.202 1.00 0.00 O ATOM 670 CB SER A 110 -5.328 5.910 4.994 1.00 0.00 C ATOM 671 OG SER A 110 -5.904 5.916 6.289 1.00 0.00 O ATOM 0 H SER A 110 -7.291 6.288 3.180 1.00 0.00 H new ATOM 0 HA SER A 110 -5.613 8.040 4.879 1.00 0.00 H new ATOM 0 HB2 SER A 110 -5.668 5.031 4.446 1.00 0.00 H new ATOM 0 HB3 SER A 110 -4.244 5.836 5.075 1.00 0.00 H new ATOM 0 HG SER A 110 -5.652 5.096 6.763 1.00 0.00 H new ATOM 677 N LEU A 111 -5.136 6.874 1.875 1.00 0.00 N ATOM 678 CA LEU A 111 -4.306 6.991 0.682 1.00 0.00 C ATOM 679 C LEU A 111 -5.122 7.486 -0.509 1.00 0.00 C ATOM 680 O LEU A 111 -6.346 7.595 -0.434 1.00 0.00 O ATOM 681 CB LEU A 111 -3.664 5.640 0.353 1.00 0.00 C ATOM 682 CG LEU A 111 -2.179 5.526 0.708 1.00 0.00 C ATOM 683 CD1 LEU A 111 -1.887 4.188 1.371 1.00 0.00 C ATOM 684 CD2 LEU A 111 -1.320 5.705 -0.535 1.00 0.00 C ATOM 0 H LEU A 111 -6.022 6.391 1.727 1.00 0.00 H new ATOM 0 HA LEU A 111 -3.522 7.721 0.884 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -4.209 4.857 0.880 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -3.783 5.448 -0.713 1.00 0.00 H new ATOM 0 HG LEU A 111 -1.933 6.318 1.415 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.827 4.127 1.615 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -2.476 4.098 2.284 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -2.149 3.379 0.689 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -0.267 5.621 -0.265 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -1.570 4.934 -1.264 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -1.506 6.688 -0.968 1.00 0.00 H new ATOM 696 N HIS A 112 -4.434 7.782 -1.607 1.00 0.00 N ATOM 697 CA HIS A 112 -5.088 8.263 -2.818 1.00 0.00 C ATOM 698 C HIS A 112 -4.417 7.686 -4.061 1.00 0.00 C ATOM 699 O HIS A 112 -3.192 7.705 -4.178 1.00 0.00 O ATOM 700 CB HIS A 112 -5.054 9.793 -2.871 1.00 0.00 C ATOM 701 CG HIS A 112 -5.622 10.447 -1.650 1.00 0.00 C ATOM 702 ND1 HIS A 112 -6.965 10.426 -1.341 1.00 0.00 N ATOM 703 CD2 HIS A 112 -5.020 11.145 -0.657 1.00 0.00 C ATOM 704 CE1 HIS A 112 -7.165 11.084 -0.212 1.00 0.00 C ATOM 705 NE2 HIS A 112 -6.002 11.529 0.223 1.00 0.00 N ATOM 0 H HIS A 112 -3.420 7.697 -1.683 1.00 0.00 H new ATOM 0 HA HIS A 112 -6.126 7.931 -2.797 1.00 0.00 H new ATOM 0 HB2 HIS A 112 -4.023 10.121 -3.002 1.00 0.00 H new ATOM 0 HB3 HIS A 112 -5.610 10.131 -3.746 1.00 0.00 H new ATOM 0 HD2 HIS A 112 -3.965 11.359 -0.573 1.00 0.00 H new ATOM 0 HE1 HIS A 112 -8.119 11.232 0.272 1.00 0.00 H new ATOM 0 HE2 HIS A 112 -5.856 12.071 1.075 1.00 0.00 H new ATOM 714 N VAL A 113 -5.229 7.172 -4.983 1.00 0.00 N ATOM 715 CA VAL A 113 -4.722 6.582 -6.221 1.00 0.00 C ATOM 716 C VAL A 113 -3.628 7.440 -6.849 1.00 0.00 C ATOM 717 O VAL A 113 -3.889 8.541 -7.334 1.00 0.00 O ATOM 718 CB VAL A 113 -5.852 6.380 -7.244 1.00 0.00 C ATOM 719 CG1 VAL A 113 -6.533 7.702 -7.525 1.00 0.00 C ATOM 720 CG2 VAL A 113 -5.321 5.756 -8.527 1.00 0.00 C ATOM 0 H VAL A 113 -6.245 7.152 -4.896 1.00 0.00 H new ATOM 0 HA VAL A 113 -4.299 5.614 -5.954 1.00 0.00 H new ATOM 0 HB VAL A 113 -6.585 5.692 -6.824 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -7.333 7.552 -8.250 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -6.952 8.099 -6.600 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -5.806 8.408 -7.927 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -6.140 5.624 -9.234 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -4.567 6.410 -8.964 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -4.875 4.787 -8.303 1.00 0.00 H new ATOM 730 N GLY A 114 -2.401 6.926 -6.840 1.00 0.00 N ATOM 731 CA GLY A 114 -1.289 7.660 -7.418 1.00 0.00 C ATOM 732 C GLY A 114 -0.224 8.015 -6.400 1.00 0.00 C ATOM 733 O GLY A 114 0.952 8.136 -6.742 1.00 0.00 O ATOM 0 H GLY A 114 -2.158 6.018 -6.444 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -0.841 7.064 -8.213 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -1.664 8.574 -7.878 1.00 0.00 H new ATOM 737 N ASP A 115 -0.631 8.184 -5.144 1.00 0.00 N ATOM 738 CA ASP A 115 0.305 8.528 -4.076 1.00 0.00 C ATOM 739 C ASP A 115 1.521 7.604 -4.103 1.00 0.00 C ATOM 740 O ASP A 115 1.387 6.397 -4.302 1.00 0.00 O ATOM 741 CB ASP A 115 -0.390 8.445 -2.717 1.00 0.00 C ATOM 742 CG ASP A 115 -1.617 9.333 -2.638 1.00 0.00 C ATOM 743 OD1 ASP A 115 -1.877 10.077 -3.607 1.00 0.00 O ATOM 744 OD2 ASP A 115 -2.320 9.283 -1.606 1.00 0.00 O ATOM 0 H ASP A 115 -1.600 8.089 -4.841 1.00 0.00 H new ATOM 0 HA ASP A 115 0.647 9.550 -4.236 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -0.680 7.412 -2.523 1.00 0.00 H new ATOM 0 HB3 ASP A 115 0.313 8.731 -1.935 1.00 0.00 H new ATOM 749 N GLU A 116 2.705 8.178 -3.914 1.00 0.00 N ATOM 750 CA GLU A 116 3.940 7.400 -3.933 1.00 0.00 C ATOM 751 C GLU A 116 4.292 6.872 -2.547 1.00 0.00 C ATOM 752 O GLU A 116 4.648 7.638 -1.652 1.00 0.00 O ATOM 753 CB GLU A 116 5.091 8.251 -4.473 1.00 0.00 C ATOM 754 CG GLU A 116 5.223 8.206 -5.986 1.00 0.00 C ATOM 755 CD GLU A 116 6.416 8.994 -6.491 1.00 0.00 C ATOM 756 OE1 GLU A 116 6.803 9.978 -5.827 1.00 0.00 O ATOM 757 OE2 GLU A 116 6.963 8.626 -7.552 1.00 0.00 O ATOM 0 H GLU A 116 2.836 9.176 -3.746 1.00 0.00 H new ATOM 0 HA GLU A 116 3.782 6.544 -4.589 1.00 0.00 H new ATOM 0 HB2 GLU A 116 4.945 9.285 -4.160 1.00 0.00 H new ATOM 0 HB3 GLU A 116 6.025 7.911 -4.025 1.00 0.00 H new ATOM 0 HG2 GLU A 116 5.315 7.169 -6.308 1.00 0.00 H new ATOM 0 HG3 GLU A 116 4.313 8.601 -6.438 1.00 0.00 H new ATOM 764 N ILE A 117 4.198 5.556 -2.378 1.00 0.00 N ATOM 765 CA ILE A 117 4.517 4.924 -1.104 1.00 0.00 C ATOM 766 C ILE A 117 5.996 4.557 -1.040 1.00 0.00 C ATOM 767 O ILE A 117 6.454 3.658 -1.745 1.00 0.00 O ATOM 768 CB ILE A 117 3.668 3.657 -0.866 1.00 0.00 C ATOM 769 CG1 ILE A 117 2.179 3.983 -0.998 1.00 0.00 C ATOM 770 CG2 ILE A 117 3.965 3.063 0.504 1.00 0.00 C ATOM 771 CD1 ILE A 117 1.624 3.725 -2.381 1.00 0.00 C ATOM 0 H ILE A 117 3.903 4.908 -3.108 1.00 0.00 H new ATOM 0 HA ILE A 117 4.285 5.648 -0.322 1.00 0.00 H new ATOM 0 HB ILE A 117 3.930 2.918 -1.623 1.00 0.00 H new ATOM 0 HG12 ILE A 117 1.620 3.390 -0.275 1.00 0.00 H new ATOM 0 HG13 ILE A 117 2.021 5.030 -0.741 1.00 0.00 H new ATOM 0 HG21 ILE A 117 3.357 2.171 0.653 1.00 0.00 H new ATOM 0 HG22 ILE A 117 5.020 2.797 0.564 1.00 0.00 H new ATOM 0 HG23 ILE A 117 3.731 3.795 1.277 1.00 0.00 H new ATOM 0 HD11 ILE A 117 0.564 3.978 -2.401 1.00 0.00 H new ATOM 0 HD12 ILE A 117 2.157 4.338 -3.107 1.00 0.00 H new ATOM 0 HD13 ILE A 117 1.750 2.672 -2.633 1.00 0.00 H new ATOM 783 N LEU A 118 6.739 5.261 -0.195 1.00 0.00 N ATOM 784 CA LEU A 118 8.166 5.014 -0.042 1.00 0.00 C ATOM 785 C LEU A 118 8.422 3.655 0.601 1.00 0.00 C ATOM 786 O LEU A 118 9.444 3.019 0.340 1.00 0.00 O ATOM 787 CB LEU A 118 8.810 6.119 0.797 1.00 0.00 C ATOM 788 CG LEU A 118 9.294 7.333 0.002 1.00 0.00 C ATOM 789 CD1 LEU A 118 10.456 6.950 -0.900 1.00 0.00 C ATOM 790 CD2 LEU A 118 8.155 7.922 -0.815 1.00 0.00 C ATOM 0 H LEU A 118 6.375 6.009 0.396 1.00 0.00 H new ATOM 0 HA LEU A 118 8.615 5.013 -1.035 1.00 0.00 H new ATOM 0 HB2 LEU A 118 8.090 6.455 1.543 1.00 0.00 H new ATOM 0 HB3 LEU A 118 9.656 5.697 1.339 1.00 0.00 H new ATOM 0 HG LEU A 118 9.640 8.090 0.705 1.00 0.00 H new ATOM 0 HD11 LEU A 118 10.787 7.826 -1.458 1.00 0.00 H new ATOM 0 HD12 LEU A 118 11.279 6.574 -0.293 1.00 0.00 H new ATOM 0 HD13 LEU A 118 10.136 6.176 -1.597 1.00 0.00 H new ATOM 0 HD21 LEU A 118 8.517 8.785 -1.374 1.00 0.00 H new ATOM 0 HD22 LEU A 118 7.779 7.171 -1.510 1.00 0.00 H new ATOM 0 HD23 LEU A 118 7.351 8.233 -0.147 1.00 0.00 H new ATOM 802 N GLU A 119 7.494 3.210 1.444 1.00 0.00 N ATOM 803 CA GLU A 119 7.639 1.923 2.116 1.00 0.00 C ATOM 804 C GLU A 119 6.308 1.429 2.676 1.00 0.00 C ATOM 805 O GLU A 119 5.459 2.223 3.081 1.00 0.00 O ATOM 806 CB GLU A 119 8.672 2.030 3.241 1.00 0.00 C ATOM 807 CG GLU A 119 9.771 0.984 3.159 1.00 0.00 C ATOM 808 CD GLU A 119 11.123 1.525 3.581 1.00 0.00 C ATOM 809 OE1 GLU A 119 11.348 2.744 3.428 1.00 0.00 O ATOM 810 OE2 GLU A 119 11.956 0.730 4.064 1.00 0.00 O ATOM 0 H GLU A 119 6.640 3.717 1.676 1.00 0.00 H new ATOM 0 HA GLU A 119 7.981 1.199 1.377 1.00 0.00 H new ATOM 0 HB2 GLU A 119 9.123 3.022 3.215 1.00 0.00 H new ATOM 0 HB3 GLU A 119 8.163 1.936 4.200 1.00 0.00 H new ATOM 0 HG2 GLU A 119 9.509 0.137 3.792 1.00 0.00 H new ATOM 0 HG3 GLU A 119 9.836 0.610 2.137 1.00 0.00 H new ATOM 817 N ILE A 120 6.141 0.110 2.701 1.00 0.00 N ATOM 818 CA ILE A 120 4.922 -0.502 3.218 1.00 0.00 C ATOM 819 C ILE A 120 5.234 -1.407 4.405 1.00 0.00 C ATOM 820 O ILE A 120 5.786 -2.496 4.240 1.00 0.00 O ATOM 821 CB ILE A 120 4.198 -1.328 2.135 1.00 0.00 C ATOM 822 CG1 ILE A 120 3.991 -0.488 0.874 1.00 0.00 C ATOM 823 CG2 ILE A 120 2.863 -1.839 2.660 1.00 0.00 C ATOM 824 CD1 ILE A 120 3.405 -1.269 -0.283 1.00 0.00 C ATOM 0 H ILE A 120 6.837 -0.557 2.368 1.00 0.00 H new ATOM 0 HA ILE A 120 4.268 0.310 3.536 1.00 0.00 H new ATOM 0 HB ILE A 120 4.820 -2.186 1.880 1.00 0.00 H new ATOM 0 HG12 ILE A 120 3.332 0.348 1.108 1.00 0.00 H new ATOM 0 HG13 ILE A 120 4.948 -0.064 0.568 1.00 0.00 H new ATOM 0 HG21 ILE A 120 2.365 -2.420 1.884 1.00 0.00 H new ATOM 0 HG22 ILE A 120 3.033 -2.470 3.533 1.00 0.00 H new ATOM 0 HG23 ILE A 120 2.235 -0.994 2.940 1.00 0.00 H new ATOM 0 HD11 ILE A 120 3.286 -0.610 -1.143 1.00 0.00 H new ATOM 0 HD12 ILE A 120 4.074 -2.089 -0.544 1.00 0.00 H new ATOM 0 HD13 ILE A 120 2.433 -1.671 0.004 1.00 0.00 H new ATOM 836 N ASN A 121 4.881 -0.949 5.602 1.00 0.00 N ATOM 837 CA ASN A 121 5.127 -1.716 6.818 1.00 0.00 C ATOM 838 C ASN A 121 6.624 -1.832 7.093 1.00 0.00 C ATOM 839 O ASN A 121 7.082 -2.805 7.690 1.00 0.00 O ATOM 840 CB ASN A 121 4.504 -3.110 6.708 1.00 0.00 C ATOM 841 CG ASN A 121 3.672 -3.469 7.924 1.00 0.00 C ATOM 842 OD1 ASN A 121 3.697 -2.770 8.936 1.00 0.00 O ATOM 843 ND2 ASN A 121 2.931 -4.567 7.831 1.00 0.00 N ATOM 0 H ASN A 121 4.424 -0.050 5.756 1.00 0.00 H new ATOM 0 HA ASN A 121 4.662 -1.187 7.650 1.00 0.00 H new ATOM 0 HB2 ASN A 121 3.878 -3.156 5.817 1.00 0.00 H new ATOM 0 HB3 ASN A 121 5.295 -3.849 6.581 1.00 0.00 H new ATOM 0 HD21 ASN A 121 2.352 -4.860 8.618 1.00 0.00 H new ATOM 0 HD22 ASN A 121 2.940 -5.117 6.972 1.00 0.00 H new ATOM 850 N GLY A 122 7.380 -0.830 6.654 1.00 0.00 N ATOM 851 CA GLY A 122 8.817 -0.837 6.861 1.00 0.00 C ATOM 852 C GLY A 122 9.569 -1.560 5.758 1.00 0.00 C ATOM 853 O GLY A 122 10.772 -1.794 5.875 1.00 0.00 O ATOM 0 H GLY A 122 7.023 -0.013 6.158 1.00 0.00 H new ATOM 0 HA2 GLY A 122 9.175 0.191 6.925 1.00 0.00 H new ATOM 0 HA3 GLY A 122 9.039 -1.312 7.817 1.00 0.00 H new ATOM 857 N THR A 123 8.865 -1.917 4.686 1.00 0.00 N ATOM 858 CA THR A 123 9.485 -2.616 3.567 1.00 0.00 C ATOM 859 C THR A 123 9.072 -1.995 2.236 1.00 0.00 C ATOM 860 O THR A 123 7.884 -1.882 1.934 1.00 0.00 O ATOM 861 CB THR A 123 9.103 -4.097 3.591 1.00 0.00 C ATOM 862 OG1 THR A 123 8.900 -4.540 4.922 1.00 0.00 O ATOM 863 CG2 THR A 123 10.147 -4.994 2.963 1.00 0.00 C ATOM 0 H THR A 123 7.868 -1.734 4.570 1.00 0.00 H new ATOM 0 HA THR A 123 10.566 -2.523 3.669 1.00 0.00 H new ATOM 0 HB THR A 123 8.186 -4.169 3.006 1.00 0.00 H new ATOM 0 HG1 THR A 123 8.655 -5.489 4.917 1.00 0.00 H new ATOM 0 HG21 THR A 123 9.814 -6.031 3.013 1.00 0.00 H new ATOM 0 HG22 THR A 123 10.292 -4.709 1.921 1.00 0.00 H new ATOM 0 HG23 THR A 123 11.089 -4.889 3.502 1.00 0.00 H new ATOM 871 N ASN A 124 10.062 -1.597 1.442 1.00 0.00 N ATOM 872 CA ASN A 124 9.802 -0.990 0.141 1.00 0.00 C ATOM 873 C ASN A 124 9.691 -2.059 -0.941 1.00 0.00 C ATOM 874 O ASN A 124 10.686 -2.667 -1.333 1.00 0.00 O ATOM 875 CB ASN A 124 10.915 -0.003 -0.215 1.00 0.00 C ATOM 876 CG ASN A 124 10.497 0.970 -1.301 1.00 0.00 C ATOM 877 OD1 ASN A 124 9.409 0.859 -1.866 1.00 0.00 O ATOM 878 ND2 ASN A 124 11.364 1.931 -1.599 1.00 0.00 N ATOM 0 H ASN A 124 11.051 -1.684 1.677 1.00 0.00 H new ATOM 0 HA ASN A 124 8.855 -0.454 0.198 1.00 0.00 H new ATOM 0 HB2 ASN A 124 11.203 0.553 0.677 1.00 0.00 H new ATOM 0 HB3 ASN A 124 11.795 -0.555 -0.544 1.00 0.00 H new ATOM 0 HD21 ASN A 124 11.139 2.615 -2.322 1.00 0.00 H new ATOM 0 HD22 ASN A 124 12.255 1.985 -1.105 1.00 0.00 H new ATOM 885 N VAL A 125 8.471 -2.286 -1.417 1.00 0.00 N ATOM 886 CA VAL A 125 8.226 -3.284 -2.450 1.00 0.00 C ATOM 887 C VAL A 125 9.020 -2.972 -3.715 1.00 0.00 C ATOM 888 O VAL A 125 8.938 -1.870 -4.255 1.00 0.00 O ATOM 889 CB VAL A 125 6.731 -3.372 -2.809 1.00 0.00 C ATOM 890 CG1 VAL A 125 6.458 -4.601 -3.664 1.00 0.00 C ATOM 891 CG2 VAL A 125 5.876 -3.388 -1.549 1.00 0.00 C ATOM 0 H VAL A 125 7.636 -1.791 -1.103 1.00 0.00 H new ATOM 0 HA VAL A 125 8.551 -4.242 -2.043 1.00 0.00 H new ATOM 0 HB VAL A 125 6.464 -2.488 -3.388 1.00 0.00 H new ATOM 0 HG11 VAL A 125 5.397 -4.646 -3.908 1.00 0.00 H new ATOM 0 HG12 VAL A 125 7.039 -4.541 -4.584 1.00 0.00 H new ATOM 0 HG13 VAL A 125 6.742 -5.498 -3.113 1.00 0.00 H new ATOM 0 HG21 VAL A 125 4.823 -3.450 -1.824 1.00 0.00 H new ATOM 0 HG22 VAL A 125 6.143 -4.251 -0.939 1.00 0.00 H new ATOM 0 HG23 VAL A 125 6.049 -2.474 -0.981 1.00 0.00 H new ATOM 901 N THR A 126 9.788 -3.952 -4.181 1.00 0.00 N ATOM 902 CA THR A 126 10.596 -3.784 -5.382 1.00 0.00 C ATOM 903 C THR A 126 10.092 -4.684 -6.505 1.00 0.00 C ATOM 904 O THR A 126 9.039 -5.311 -6.387 1.00 0.00 O ATOM 905 CB THR A 126 12.064 -4.094 -5.084 1.00 0.00 C ATOM 906 OG1 THR A 126 12.271 -5.492 -4.986 1.00 0.00 O ATOM 907 CG2 THR A 126 12.559 -3.466 -3.799 1.00 0.00 C ATOM 0 H THR A 126 9.867 -4.870 -3.745 1.00 0.00 H new ATOM 0 HA THR A 126 10.511 -2.746 -5.705 1.00 0.00 H new ATOM 0 HB THR A 126 12.624 -3.669 -5.917 1.00 0.00 H new ATOM 0 HG1 THR A 126 13.216 -5.670 -4.797 1.00 0.00 H new ATOM 0 HG21 THR A 126 13.607 -3.725 -3.647 1.00 0.00 H new ATOM 0 HG22 THR A 126 12.459 -2.382 -3.861 1.00 0.00 H new ATOM 0 HG23 THR A 126 11.969 -3.838 -2.961 1.00 0.00 H new ATOM 915 N ASN A 127 10.850 -4.745 -7.595 1.00 0.00 N ATOM 916 CA ASN A 127 10.479 -5.569 -8.739 1.00 0.00 C ATOM 917 C ASN A 127 10.378 -7.040 -8.345 1.00 0.00 C ATOM 918 O ASN A 127 9.682 -7.819 -8.998 1.00 0.00 O ATOM 919 CB ASN A 127 11.495 -5.397 -9.870 1.00 0.00 C ATOM 920 CG ASN A 127 11.130 -6.196 -11.106 1.00 0.00 C ATOM 921 OD1 ASN A 127 11.847 -7.115 -11.499 1.00 0.00 O ATOM 922 ND2 ASN A 127 10.008 -5.849 -11.725 1.00 0.00 N ATOM 0 H ASN A 127 11.725 -4.233 -7.710 1.00 0.00 H new ATOM 0 HA ASN A 127 9.500 -5.240 -9.088 1.00 0.00 H new ATOM 0 HB2 ASN A 127 11.567 -4.341 -10.132 1.00 0.00 H new ATOM 0 HB3 ASN A 127 12.480 -5.706 -9.519 1.00 0.00 H new ATOM 0 HD21 ASN A 127 9.711 -6.351 -12.561 1.00 0.00 H new ATOM 0 HD22 ASN A 127 9.443 -5.080 -11.364 1.00 0.00 H new ATOM 929 N HIS A 128 11.071 -7.416 -7.273 1.00 0.00 N ATOM 930 CA HIS A 128 11.051 -8.796 -6.796 1.00 0.00 C ATOM 931 C HIS A 128 9.620 -9.259 -6.542 1.00 0.00 C ATOM 932 O HIS A 128 8.667 -8.526 -6.810 1.00 0.00 O ATOM 933 CB HIS A 128 11.879 -8.928 -5.515 1.00 0.00 C ATOM 934 CG HIS A 128 13.337 -9.157 -5.769 1.00 0.00 C ATOM 935 ND1 HIS A 128 14.158 -9.828 -4.888 1.00 0.00 N ATOM 936 CD2 HIS A 128 14.121 -8.800 -6.814 1.00 0.00 C ATOM 937 CE1 HIS A 128 15.384 -9.874 -5.379 1.00 0.00 C ATOM 938 NE2 HIS A 128 15.388 -9.258 -6.547 1.00 0.00 N ATOM 0 H HIS A 128 11.652 -6.786 -6.720 1.00 0.00 H new ATOM 0 HA HIS A 128 11.489 -9.429 -7.568 1.00 0.00 H new ATOM 0 HB2 HIS A 128 11.760 -8.023 -4.919 1.00 0.00 H new ATOM 0 HB3 HIS A 128 11.487 -9.754 -4.922 1.00 0.00 H new ATOM 0 HD2 HIS A 128 13.808 -8.257 -7.693 1.00 0.00 H new ATOM 0 HE1 HIS A 128 16.237 -10.337 -4.906 1.00 0.00 H new ATOM 0 HE2 HIS A 128 16.200 -9.141 -7.153 1.00 0.00 H new ATOM 947 N SER A 129 9.469 -10.475 -6.029 1.00 0.00 N ATOM 948 CA SER A 129 8.146 -11.019 -5.751 1.00 0.00 C ATOM 949 C SER A 129 7.440 -10.206 -4.671 1.00 0.00 C ATOM 950 O SER A 129 8.027 -9.881 -3.638 1.00 0.00 O ATOM 951 CB SER A 129 8.253 -12.482 -5.318 1.00 0.00 C ATOM 952 OG SER A 129 8.105 -13.355 -6.425 1.00 0.00 O ATOM 0 H SER A 129 10.242 -11.099 -5.798 1.00 0.00 H new ATOM 0 HA SER A 129 7.557 -10.962 -6.666 1.00 0.00 H new ATOM 0 HB2 SER A 129 9.219 -12.654 -4.842 1.00 0.00 H new ATOM 0 HB3 SER A 129 7.487 -12.701 -4.574 1.00 0.00 H new ATOM 0 HG SER A 129 8.179 -14.284 -6.121 1.00 0.00 H new ATOM 958 N VAL A 130 6.175 -9.888 -4.917 1.00 0.00 N ATOM 959 CA VAL A 130 5.374 -9.118 -3.969 1.00 0.00 C ATOM 960 C VAL A 130 4.664 -10.033 -2.980 1.00 0.00 C ATOM 961 O VAL A 130 4.273 -9.606 -1.893 1.00 0.00 O ATOM 962 CB VAL A 130 4.324 -8.240 -4.681 1.00 0.00 C ATOM 963 CG1 VAL A 130 4.112 -6.939 -3.921 1.00 0.00 C ATOM 964 CG2 VAL A 130 4.740 -7.963 -6.115 1.00 0.00 C ATOM 0 H VAL A 130 5.679 -10.152 -5.768 1.00 0.00 H new ATOM 0 HA VAL A 130 6.068 -8.470 -3.434 1.00 0.00 H new ATOM 0 HB VAL A 130 3.379 -8.783 -4.700 1.00 0.00 H new ATOM 0 HG11 VAL A 130 3.368 -6.333 -4.438 1.00 0.00 H new ATOM 0 HG12 VAL A 130 3.763 -7.160 -2.912 1.00 0.00 H new ATOM 0 HG13 VAL A 130 5.053 -6.391 -3.868 1.00 0.00 H new ATOM 0 HG21 VAL A 130 3.986 -7.342 -6.599 1.00 0.00 H new ATOM 0 HG22 VAL A 130 5.698 -7.442 -6.122 1.00 0.00 H new ATOM 0 HG23 VAL A 130 4.835 -8.905 -6.655 1.00 0.00 H new ATOM 974 N ASP A 131 4.492 -11.296 -3.368 1.00 0.00 N ATOM 975 CA ASP A 131 3.821 -12.277 -2.522 1.00 0.00 C ATOM 976 C ASP A 131 4.344 -12.230 -1.088 1.00 0.00 C ATOM 977 O ASP A 131 3.642 -12.605 -0.150 1.00 0.00 O ATOM 978 CB ASP A 131 4.004 -13.683 -3.096 1.00 0.00 C ATOM 979 CG ASP A 131 2.789 -14.562 -2.872 1.00 0.00 C ATOM 980 OD1 ASP A 131 2.100 -14.372 -1.847 1.00 0.00 O ATOM 981 OD2 ASP A 131 2.527 -15.441 -3.720 1.00 0.00 O ATOM 0 H ASP A 131 4.810 -11.663 -4.265 1.00 0.00 H new ATOM 0 HA ASP A 131 2.760 -12.028 -2.503 1.00 0.00 H new ATOM 0 HB2 ASP A 131 4.206 -13.613 -4.165 1.00 0.00 H new ATOM 0 HB3 ASP A 131 4.876 -14.149 -2.637 1.00 0.00 H new ATOM 986 N GLN A 132 5.582 -11.771 -0.926 1.00 0.00 N ATOM 987 CA GLN A 132 6.193 -11.680 0.394 1.00 0.00 C ATOM 988 C GLN A 132 5.645 -10.487 1.175 1.00 0.00 C ATOM 989 O GLN A 132 5.375 -10.588 2.372 1.00 0.00 O ATOM 990 CB GLN A 132 7.715 -11.569 0.267 1.00 0.00 C ATOM 991 CG GLN A 132 8.472 -12.558 1.138 1.00 0.00 C ATOM 992 CD GLN A 132 8.725 -12.030 2.537 1.00 0.00 C ATOM 993 OE1 GLN A 132 8.315 -12.636 3.526 1.00 0.00 O ATOM 994 NE2 GLN A 132 9.404 -10.892 2.625 1.00 0.00 N ATOM 0 H GLN A 132 6.179 -11.457 -1.691 1.00 0.00 H new ATOM 0 HA GLN A 132 5.945 -12.589 0.942 1.00 0.00 H new ATOM 0 HB2 GLN A 132 7.997 -11.725 -0.774 1.00 0.00 H new ATOM 0 HB3 GLN A 132 8.020 -10.557 0.532 1.00 0.00 H new ATOM 0 HG2 GLN A 132 7.906 -13.488 1.201 1.00 0.00 H new ATOM 0 HG3 GLN A 132 9.425 -12.797 0.666 1.00 0.00 H new ATOM 0 HE21 GLN A 132 9.725 -10.423 1.778 1.00 0.00 H new ATOM 0 HE22 GLN A 132 9.604 -10.487 3.539 1.00 0.00 H new ATOM 1003 N LEU A 133 5.490 -9.358 0.492 1.00 0.00 N ATOM 1004 CA LEU A 133 4.981 -8.145 1.124 1.00 0.00 C ATOM 1005 C LEU A 133 3.482 -8.247 1.394 1.00 0.00 C ATOM 1006 O LEU A 133 3.014 -7.883 2.471 1.00 0.00 O ATOM 1007 CB LEU A 133 5.266 -6.926 0.243 1.00 0.00 C ATOM 1008 CG LEU A 133 6.739 -6.520 0.159 1.00 0.00 C ATOM 1009 CD1 LEU A 133 7.282 -6.194 1.542 1.00 0.00 C ATOM 1010 CD2 LEU A 133 7.559 -7.623 -0.492 1.00 0.00 C ATOM 0 H LEU A 133 5.709 -9.257 -0.499 1.00 0.00 H new ATOM 0 HA LEU A 133 5.494 -8.028 2.079 1.00 0.00 H new ATOM 0 HB2 LEU A 133 4.903 -7.131 -0.764 1.00 0.00 H new ATOM 0 HB3 LEU A 133 4.692 -6.080 0.622 1.00 0.00 H new ATOM 0 HG LEU A 133 6.816 -5.625 -0.459 1.00 0.00 H new ATOM 0 HD11 LEU A 133 8.331 -5.907 1.463 1.00 0.00 H new ATOM 0 HD12 LEU A 133 6.712 -5.370 1.972 1.00 0.00 H new ATOM 0 HD13 LEU A 133 7.193 -7.071 2.184 1.00 0.00 H new ATOM 0 HD21 LEU A 133 8.604 -7.317 -0.544 1.00 0.00 H new ATOM 0 HD22 LEU A 133 7.476 -8.535 0.099 1.00 0.00 H new ATOM 0 HD23 LEU A 133 7.185 -7.808 -1.499 1.00 0.00 H new ATOM 1022 N GLN A 134 2.736 -8.736 0.411 1.00 0.00 N ATOM 1023 CA GLN A 134 1.289 -8.875 0.546 1.00 0.00 C ATOM 1024 C GLN A 134 0.924 -9.950 1.566 1.00 0.00 C ATOM 1025 O GLN A 134 0.076 -9.735 2.431 1.00 0.00 O ATOM 1026 CB GLN A 134 0.659 -9.206 -0.808 1.00 0.00 C ATOM 1027 CG GLN A 134 1.044 -10.573 -1.346 1.00 0.00 C ATOM 1028 CD GLN A 134 0.567 -10.792 -2.768 1.00 0.00 C ATOM 1029 OE1 GLN A 134 1.362 -10.802 -3.709 1.00 0.00 O ATOM 1030 NE2 GLN A 134 -0.739 -10.968 -2.933 1.00 0.00 N ATOM 0 H GLN A 134 3.107 -9.043 -0.488 1.00 0.00 H new ATOM 0 HA GLN A 134 0.897 -7.923 0.903 1.00 0.00 H new ATOM 0 HB2 GLN A 134 -0.426 -9.155 -0.716 1.00 0.00 H new ATOM 0 HB3 GLN A 134 0.954 -8.445 -1.531 1.00 0.00 H new ATOM 0 HG2 GLN A 134 2.128 -10.683 -1.309 1.00 0.00 H new ATOM 0 HG3 GLN A 134 0.623 -11.345 -0.702 1.00 0.00 H new ATOM 0 HE21 GLN A 134 -1.362 -10.952 -2.125 1.00 0.00 H new ATOM 0 HE22 GLN A 134 -1.119 -11.119 -3.867 1.00 0.00 H new ATOM 1039 N LYS A 135 1.563 -11.108 1.454 1.00 0.00 N ATOM 1040 CA LYS A 135 1.297 -12.219 2.362 1.00 0.00 C ATOM 1041 C LYS A 135 1.664 -11.864 3.801 1.00 0.00 C ATOM 1042 O LYS A 135 0.999 -12.295 4.743 1.00 0.00 O ATOM 1043 CB LYS A 135 2.073 -13.461 1.922 1.00 0.00 C ATOM 1044 CG LYS A 135 1.719 -14.711 2.710 1.00 0.00 C ATOM 1045 CD LYS A 135 2.684 -14.931 3.865 1.00 0.00 C ATOM 1046 CE LYS A 135 4.073 -15.302 3.371 1.00 0.00 C ATOM 1047 NZ LYS A 135 5.056 -14.208 3.605 1.00 0.00 N ATOM 0 H LYS A 135 2.269 -11.303 0.744 1.00 0.00 H new ATOM 0 HA LYS A 135 0.228 -12.428 2.325 1.00 0.00 H new ATOM 0 HB2 LYS A 135 1.882 -13.642 0.864 1.00 0.00 H new ATOM 0 HB3 LYS A 135 3.141 -13.267 2.025 1.00 0.00 H new ATOM 0 HG2 LYS A 135 0.703 -14.625 3.094 1.00 0.00 H new ATOM 0 HG3 LYS A 135 1.737 -15.577 2.049 1.00 0.00 H new ATOM 0 HD2 LYS A 135 2.742 -14.025 4.469 1.00 0.00 H new ATOM 0 HD3 LYS A 135 2.304 -15.722 4.512 1.00 0.00 H new ATOM 0 HE2 LYS A 135 4.409 -16.207 3.878 1.00 0.00 H new ATOM 0 HE3 LYS A 135 4.031 -15.530 2.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 5.741 -14.184 2.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 4.556 -13.297 3.655 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 5.558 -14.378 4.500 1.00 0.00 H new ATOM 1061 N ALA A 136 2.728 -11.086 3.966 1.00 0.00 N ATOM 1062 CA ALA A 136 3.183 -10.690 5.294 1.00 0.00 C ATOM 1063 C ALA A 136 2.402 -9.491 5.826 1.00 0.00 C ATOM 1064 O ALA A 136 1.996 -9.471 6.988 1.00 0.00 O ATOM 1065 CB ALA A 136 4.672 -10.378 5.266 1.00 0.00 C ATOM 0 H ALA A 136 3.291 -10.718 3.199 1.00 0.00 H new ATOM 0 HA ALA A 136 3.003 -11.526 5.969 1.00 0.00 H new ATOM 0 HB1 ALA A 136 5.001 -10.083 6.263 1.00 0.00 H new ATOM 0 HB2 ALA A 136 5.223 -11.263 4.949 1.00 0.00 H new ATOM 0 HB3 ALA A 136 4.860 -9.563 4.566 1.00 0.00 H new ATOM 1071 N MET A 137 2.206 -8.487 4.976 1.00 0.00 N ATOM 1072 CA MET A 137 1.485 -7.282 5.374 1.00 0.00 C ATOM 1073 C MET A 137 0.006 -7.573 5.632 1.00 0.00 C ATOM 1074 O MET A 137 -0.654 -6.858 6.384 1.00 0.00 O ATOM 1075 CB MET A 137 1.649 -6.186 4.307 1.00 0.00 C ATOM 1076 CG MET A 137 0.690 -6.298 3.125 1.00 0.00 C ATOM 1077 SD MET A 137 -0.210 -4.767 2.803 1.00 0.00 S ATOM 1078 CE MET A 137 -0.719 -4.306 4.458 1.00 0.00 C ATOM 0 H MET A 137 2.535 -8.484 4.011 1.00 0.00 H new ATOM 0 HA MET A 137 1.915 -6.926 6.310 1.00 0.00 H new ATOM 0 HB2 MET A 137 1.509 -5.214 4.780 1.00 0.00 H new ATOM 0 HB3 MET A 137 2.672 -6.214 3.931 1.00 0.00 H new ATOM 0 HG2 MET A 137 1.251 -6.578 2.234 1.00 0.00 H new ATOM 0 HG3 MET A 137 -0.023 -7.099 3.317 1.00 0.00 H new ATOM 0 HE1 MET A 137 -1.802 -4.189 4.486 1.00 0.00 H new ATOM 0 HE2 MET A 137 -0.420 -5.084 5.161 1.00 0.00 H new ATOM 0 HE3 MET A 137 -0.245 -3.364 4.735 1.00 0.00 H new ATOM 1088 N LYS A 138 -0.511 -8.624 5.001 1.00 0.00 N ATOM 1089 CA LYS A 138 -1.912 -8.995 5.168 1.00 0.00 C ATOM 1090 C LYS A 138 -2.107 -9.873 6.401 1.00 0.00 C ATOM 1091 O LYS A 138 -3.005 -9.635 7.209 1.00 0.00 O ATOM 1092 CB LYS A 138 -2.421 -9.725 3.924 1.00 0.00 C ATOM 1093 CG LYS A 138 -3.937 -9.717 3.793 1.00 0.00 C ATOM 1094 CD LYS A 138 -4.475 -11.084 3.399 1.00 0.00 C ATOM 1095 CE LYS A 138 -4.934 -11.107 1.950 1.00 0.00 C ATOM 1096 NZ LYS A 138 -6.123 -11.983 1.758 1.00 0.00 N ATOM 0 H LYS A 138 0.016 -9.230 4.373 1.00 0.00 H new ATOM 0 HA LYS A 138 -2.486 -8.079 5.306 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -1.985 -9.263 3.038 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -2.072 -10.757 3.950 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -4.382 -9.410 4.739 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -4.234 -8.980 3.047 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -3.701 -11.837 3.548 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -5.308 -11.349 4.050 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -5.174 -10.093 1.629 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -4.119 -11.457 1.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -6.405 -11.971 0.757 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -5.887 -12.956 2.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -6.909 -11.634 2.343 1.00 0.00 H new ATOM 1110 N GLU A 139 -1.263 -10.891 6.539 1.00 0.00 N ATOM 1111 CA GLU A 139 -1.350 -11.805 7.675 1.00 0.00 C ATOM 1112 C GLU A 139 -0.897 -11.133 8.970 1.00 0.00 C ATOM 1113 O GLU A 139 -1.128 -11.656 10.060 1.00 0.00 O ATOM 1114 CB GLU A 139 -0.507 -13.054 7.415 1.00 0.00 C ATOM 1115 CG GLU A 139 -1.269 -14.169 6.718 1.00 0.00 C ATOM 1116 CD GLU A 139 -1.910 -15.137 7.693 1.00 0.00 C ATOM 1117 OE1 GLU A 139 -1.166 -15.824 8.423 1.00 0.00 O ATOM 1118 OE2 GLU A 139 -3.156 -15.206 7.727 1.00 0.00 O ATOM 0 H GLU A 139 -0.513 -11.104 5.881 1.00 0.00 H new ATOM 0 HA GLU A 139 -2.395 -12.092 7.790 1.00 0.00 H new ATOM 0 HB2 GLU A 139 0.355 -12.780 6.807 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -0.122 -13.427 8.364 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -2.041 -13.734 6.083 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -0.589 -14.715 6.064 1.00 0.00 H new ATOM 1125 N THR A 140 -0.248 -9.977 8.851 1.00 0.00 N ATOM 1126 CA THR A 140 0.232 -9.253 10.023 1.00 0.00 C ATOM 1127 C THR A 140 -0.923 -8.894 10.954 1.00 0.00 C ATOM 1128 O THR A 140 -2.056 -8.706 10.512 1.00 0.00 O ATOM 1129 CB THR A 140 0.977 -7.985 9.599 1.00 0.00 C ATOM 1130 OG1 THR A 140 1.638 -7.400 10.707 1.00 0.00 O ATOM 1131 CG2 THR A 140 0.077 -6.929 8.994 1.00 0.00 C ATOM 0 H THR A 140 -0.044 -9.525 7.960 1.00 0.00 H new ATOM 0 HA THR A 140 0.919 -9.904 10.563 1.00 0.00 H new ATOM 0 HB THR A 140 1.686 -8.311 8.838 1.00 0.00 H new ATOM 0 HG1 THR A 140 2.110 -6.592 10.417 1.00 0.00 H new ATOM 0 HG21 THR A 140 0.672 -6.059 8.717 1.00 0.00 H new ATOM 0 HG22 THR A 140 -0.411 -7.332 8.107 1.00 0.00 H new ATOM 0 HG23 THR A 140 -0.679 -6.635 9.722 1.00 0.00 H new ATOM 1139 N LYS A 141 -0.626 -8.800 12.246 1.00 0.00 N ATOM 1140 CA LYS A 141 -1.635 -8.463 13.242 1.00 0.00 C ATOM 1141 C LYS A 141 -1.147 -7.333 14.143 1.00 0.00 C ATOM 1142 O LYS A 141 -0.197 -7.501 14.907 1.00 0.00 O ATOM 1143 CB LYS A 141 -1.983 -9.693 14.084 1.00 0.00 C ATOM 1144 CG LYS A 141 -3.385 -10.224 13.833 1.00 0.00 C ATOM 1145 CD LYS A 141 -3.471 -10.968 12.510 1.00 0.00 C ATOM 1146 CE LYS A 141 -3.383 -12.473 12.710 1.00 0.00 C ATOM 1147 NZ LYS A 141 -4.728 -13.105 12.775 1.00 0.00 N ATOM 0 H LYS A 141 0.307 -8.953 12.628 1.00 0.00 H new ATOM 0 HA LYS A 141 -2.531 -8.127 12.720 1.00 0.00 H new ATOM 0 HB2 LYS A 141 -1.261 -10.483 13.875 1.00 0.00 H new ATOM 0 HB3 LYS A 141 -1.882 -9.441 15.140 1.00 0.00 H new ATOM 0 HG2 LYS A 141 -3.674 -10.891 14.646 1.00 0.00 H new ATOM 0 HG3 LYS A 141 -4.094 -9.396 13.833 1.00 0.00 H new ATOM 0 HD2 LYS A 141 -4.409 -10.720 12.012 1.00 0.00 H new ATOM 0 HD3 LYS A 141 -2.665 -10.639 11.854 1.00 0.00 H new ATOM 0 HE2 LYS A 141 -2.814 -12.915 11.892 1.00 0.00 H new ATOM 0 HE3 LYS A 141 -2.838 -12.685 13.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 -4.623 -14.131 12.912 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 -5.263 -12.702 13.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 -5.240 -12.925 11.888 1.00 0.00 H new ATOM 1161 N GLY A 142 -1.803 -6.180 14.047 1.00 0.00 N ATOM 1162 CA GLY A 142 -1.417 -5.040 14.860 1.00 0.00 C ATOM 1163 C GLY A 142 -1.612 -3.722 14.139 1.00 0.00 C ATOM 1164 O GLY A 142 -2.667 -3.474 13.558 1.00 0.00 O ATOM 0 H GLY A 142 -2.593 -6.015 13.423 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -2.003 -5.038 15.779 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -0.371 -5.141 15.149 1.00 0.00 H new ATOM 1168 N MET A 143 -0.592 -2.870 14.179 1.00 0.00 N ATOM 1169 CA MET A 143 -0.659 -1.567 13.525 1.00 0.00 C ATOM 1170 C MET A 143 0.245 -1.521 12.297 1.00 0.00 C ATOM 1171 O MET A 143 1.460 -1.695 12.402 1.00 0.00 O ATOM 1172 CB MET A 143 -0.263 -0.462 14.506 1.00 0.00 C ATOM 1173 CG MET A 143 -1.445 0.159 15.233 1.00 0.00 C ATOM 1174 SD MET A 143 -0.961 1.522 16.310 1.00 0.00 S ATOM 1175 CE MET A 143 -0.249 2.658 15.122 1.00 0.00 C ATOM 0 H MET A 143 0.290 -3.058 14.657 1.00 0.00 H new ATOM 0 HA MET A 143 -1.687 -1.406 13.199 1.00 0.00 H new ATOM 0 HB2 MET A 143 0.430 -0.871 15.241 1.00 0.00 H new ATOM 0 HB3 MET A 143 0.271 0.319 13.964 1.00 0.00 H new ATOM 0 HG2 MET A 143 -2.168 0.519 14.501 1.00 0.00 H new ATOM 0 HG3 MET A 143 -1.945 -0.607 15.826 1.00 0.00 H new ATOM 0 HE1 MET A 143 -0.527 3.679 15.383 1.00 0.00 H new ATOM 0 HE2 MET A 143 0.837 2.563 15.134 1.00 0.00 H new ATOM 0 HE3 MET A 143 -0.623 2.424 14.125 1.00 0.00 H new ATOM 1185 N ILE A 144 -0.353 -1.281 11.134 1.00 0.00 N ATOM 1186 CA ILE A 144 0.401 -1.206 9.888 1.00 0.00 C ATOM 1187 C ILE A 144 0.906 0.212 9.640 1.00 0.00 C ATOM 1188 O ILE A 144 0.145 1.175 9.722 1.00 0.00 O ATOM 1189 CB ILE A 144 -0.450 -1.648 8.679 1.00 0.00 C ATOM 1190 CG1 ILE A 144 -1.058 -3.029 8.931 1.00 0.00 C ATOM 1191 CG2 ILE A 144 0.393 -1.656 7.410 1.00 0.00 C ATOM 1192 CD1 ILE A 144 -1.858 -3.559 7.760 1.00 0.00 C ATOM 0 H ILE A 144 -1.357 -1.135 11.029 1.00 0.00 H new ATOM 0 HA ILE A 144 1.247 -1.885 9.993 1.00 0.00 H new ATOM 0 HB ILE A 144 -1.263 -0.934 8.547 1.00 0.00 H new ATOM 0 HG12 ILE A 144 -0.258 -3.733 9.163 1.00 0.00 H new ATOM 0 HG13 ILE A 144 -1.703 -2.979 9.808 1.00 0.00 H new ATOM 0 HG21 ILE A 144 -0.222 -1.970 6.567 1.00 0.00 H new ATOM 0 HG22 ILE A 144 0.780 -0.654 7.224 1.00 0.00 H new ATOM 0 HG23 ILE A 144 1.225 -2.350 7.530 1.00 0.00 H new ATOM 0 HD11 ILE A 144 -2.260 -4.541 8.009 1.00 0.00 H new ATOM 0 HD12 ILE A 144 -2.679 -2.876 7.541 1.00 0.00 H new ATOM 0 HD13 ILE A 144 -1.212 -3.642 6.886 1.00 0.00 H new ATOM 1204 N SER A 145 2.193 0.332 9.329 1.00 0.00 N ATOM 1205 CA SER A 145 2.795 1.634 9.061 1.00 0.00 C ATOM 1206 C SER A 145 3.117 1.781 7.579 1.00 0.00 C ATOM 1207 O SER A 145 3.837 0.965 7.006 1.00 0.00 O ATOM 1208 CB SER A 145 4.068 1.819 9.891 1.00 0.00 C ATOM 1209 OG SER A 145 3.848 1.471 11.247 1.00 0.00 O ATOM 0 H SER A 145 2.838 -0.455 9.256 1.00 0.00 H new ATOM 0 HA SER A 145 2.076 2.404 9.342 1.00 0.00 H new ATOM 0 HB2 SER A 145 4.867 1.203 9.479 1.00 0.00 H new ATOM 0 HB3 SER A 145 4.400 2.855 9.828 1.00 0.00 H new ATOM 0 HG SER A 145 2.957 1.772 11.521 1.00 0.00 H new ATOM 1215 N LEU A 146 2.573 2.824 6.963 1.00 0.00 N ATOM 1216 CA LEU A 146 2.796 3.073 5.543 1.00 0.00 C ATOM 1217 C LEU A 146 3.407 4.450 5.312 1.00 0.00 C ATOM 1218 O LEU A 146 2.906 5.457 5.815 1.00 0.00 O ATOM 1219 CB LEU A 146 1.476 2.955 4.776 1.00 0.00 C ATOM 1220 CG LEU A 146 1.123 1.551 4.276 1.00 0.00 C ATOM 1221 CD1 LEU A 146 1.496 0.495 5.306 1.00 0.00 C ATOM 1222 CD2 LEU A 146 -0.360 1.468 3.943 1.00 0.00 C ATOM 0 H LEU A 146 1.975 3.510 7.423 1.00 0.00 H new ATOM 0 HA LEU A 146 3.498 2.324 5.176 1.00 0.00 H new ATOM 0 HB2 LEU A 146 0.670 3.305 5.421 1.00 0.00 H new ATOM 0 HB3 LEU A 146 1.513 3.627 3.919 1.00 0.00 H new ATOM 0 HG LEU A 146 1.698 1.357 3.371 1.00 0.00 H new ATOM 0 HD11 LEU A 146 1.235 -0.493 4.926 1.00 0.00 H new ATOM 0 HD12 LEU A 146 2.568 0.538 5.499 1.00 0.00 H new ATOM 0 HD13 LEU A 146 0.953 0.682 6.232 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -0.598 0.465 3.589 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -0.946 1.686 4.836 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -0.600 2.194 3.166 1.00 0.00 H new ATOM 1234 N LYS A 147 4.481 4.488 4.532 1.00 0.00 N ATOM 1235 CA LYS A 147 5.153 5.740 4.211 1.00 0.00 C ATOM 1236 C LYS A 147 4.788 6.166 2.796 1.00 0.00 C ATOM 1237 O LYS A 147 5.214 5.543 1.825 1.00 0.00 O ATOM 1238 CB LYS A 147 6.669 5.586 4.341 1.00 0.00 C ATOM 1239 CG LYS A 147 7.112 5.038 5.689 1.00 0.00 C ATOM 1240 CD LYS A 147 8.261 5.848 6.274 1.00 0.00 C ATOM 1241 CE LYS A 147 9.412 4.956 6.715 1.00 0.00 C ATOM 1242 NZ LYS A 147 10.654 5.230 5.943 1.00 0.00 N ATOM 0 H LYS A 147 4.906 3.663 4.109 1.00 0.00 H new ATOM 0 HA LYS A 147 4.826 6.506 4.914 1.00 0.00 H new ATOM 0 HB2 LYS A 147 7.027 4.923 3.553 1.00 0.00 H new ATOM 0 HB3 LYS A 147 7.139 6.556 4.180 1.00 0.00 H new ATOM 0 HG2 LYS A 147 6.270 5.048 6.381 1.00 0.00 H new ATOM 0 HG3 LYS A 147 7.419 3.998 5.576 1.00 0.00 H new ATOM 0 HD2 LYS A 147 8.618 6.562 5.532 1.00 0.00 H new ATOM 0 HD3 LYS A 147 7.902 6.426 7.125 1.00 0.00 H new ATOM 0 HE2 LYS A 147 9.604 5.109 7.777 1.00 0.00 H new ATOM 0 HE3 LYS A 147 9.130 3.911 6.590 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 11.414 4.602 6.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 10.479 5.059 4.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 10.938 6.221 6.083 1.00 0.00 H new ATOM 1256 N VAL A 148 3.974 7.212 2.685 1.00 0.00 N ATOM 1257 CA VAL A 148 3.533 7.689 1.380 1.00 0.00 C ATOM 1258 C VAL A 148 3.662 9.202 1.244 1.00 0.00 C ATOM 1259 O VAL A 148 3.699 9.930 2.236 1.00 0.00 O ATOM 1260 CB VAL A 148 2.068 7.294 1.116 1.00 0.00 C ATOM 1261 CG1 VAL A 148 1.720 7.482 -0.350 1.00 0.00 C ATOM 1262 CG2 VAL A 148 1.811 5.859 1.554 1.00 0.00 C ATOM 0 H VAL A 148 3.609 7.741 3.477 1.00 0.00 H new ATOM 0 HA VAL A 148 4.185 7.216 0.646 1.00 0.00 H new ATOM 0 HB VAL A 148 1.425 7.948 1.705 1.00 0.00 H new ATOM 0 HG11 VAL A 148 0.681 7.198 -0.517 1.00 0.00 H new ATOM 0 HG12 VAL A 148 1.859 8.527 -0.626 1.00 0.00 H new ATOM 0 HG13 VAL A 148 2.370 6.856 -0.961 1.00 0.00 H new ATOM 0 HG21 VAL A 148 0.770 5.600 1.359 1.00 0.00 H new ATOM 0 HG22 VAL A 148 2.463 5.186 0.997 1.00 0.00 H new ATOM 0 HG23 VAL A 148 2.015 5.762 2.620 1.00 0.00 H new ATOM 1272 N ILE A 149 3.718 9.662 -0.003 1.00 0.00 N ATOM 1273 CA ILE A 149 3.829 11.083 -0.299 1.00 0.00 C ATOM 1274 C ILE A 149 2.707 11.522 -1.240 1.00 0.00 C ATOM 1275 O ILE A 149 2.540 10.955 -2.322 1.00 0.00 O ATOM 1276 CB ILE A 149 5.187 11.419 -0.946 1.00 0.00 C ATOM 1277 CG1 ILE A 149 6.332 10.872 -0.093 1.00 0.00 C ATOM 1278 CG2 ILE A 149 5.329 12.924 -1.131 1.00 0.00 C ATOM 1279 CD1 ILE A 149 7.691 11.015 -0.744 1.00 0.00 C ATOM 0 H ILE A 149 3.688 9.064 -0.829 1.00 0.00 H new ATOM 0 HA ILE A 149 3.748 11.619 0.647 1.00 0.00 H new ATOM 0 HB ILE A 149 5.232 10.946 -1.927 1.00 0.00 H new ATOM 0 HG12 ILE A 149 6.341 11.391 0.865 1.00 0.00 H new ATOM 0 HG13 ILE A 149 6.147 9.818 0.117 1.00 0.00 H new ATOM 0 HG21 ILE A 149 6.293 13.145 -1.589 1.00 0.00 H new ATOM 0 HG22 ILE A 149 4.529 13.288 -1.776 1.00 0.00 H new ATOM 0 HG23 ILE A 149 5.266 13.417 -0.161 1.00 0.00 H new ATOM 0 HD11 ILE A 149 8.456 10.606 -0.083 1.00 0.00 H new ATOM 0 HD12 ILE A 149 7.700 10.472 -1.689 1.00 0.00 H new ATOM 0 HD13 ILE A 149 7.897 12.069 -0.929 1.00 0.00 H new ATOM 1291 N PRO A 150 1.915 12.535 -0.841 1.00 0.00 N ATOM 1292 CA PRO A 150 0.804 13.036 -1.658 1.00 0.00 C ATOM 1293 C PRO A 150 1.282 13.767 -2.909 1.00 0.00 C ATOM 1294 O PRO A 150 2.171 14.616 -2.843 1.00 0.00 O ATOM 1295 CB PRO A 150 0.079 14.004 -0.721 1.00 0.00 C ATOM 1296 CG PRO A 150 1.121 14.445 0.248 1.00 0.00 C ATOM 1297 CD PRO A 150 2.034 13.267 0.435 1.00 0.00 C ATOM 0 HA PRO A 150 0.176 12.225 -2.026 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -0.335 14.850 -1.269 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -0.753 13.515 -0.213 1.00 0.00 H new ATOM 0 HG2 PRO A 150 1.669 15.307 -0.133 1.00 0.00 H new ATOM 0 HG3 PRO A 150 0.672 14.745 1.195 1.00 0.00 H new ATOM 0 HD2 PRO A 150 3.061 13.581 0.624 1.00 0.00 H new ATOM 0 HD3 PRO A 150 1.728 12.652 1.281 1.00 0.00 H new ATOM 1305 N ASN A 151 0.683 13.432 -4.047 1.00 0.00 N ATOM 1306 CA ASN A 151 1.044 14.058 -5.313 1.00 0.00 C ATOM 1307 C ASN A 151 -0.011 15.079 -5.730 1.00 0.00 C ATOM 1308 O ASN A 151 -1.203 14.773 -5.774 1.00 0.00 O ATOM 1309 CB ASN A 151 1.206 12.997 -6.404 1.00 0.00 C ATOM 1310 CG ASN A 151 2.662 12.690 -6.700 1.00 0.00 C ATOM 1311 OD1 ASN A 151 3.532 12.872 -5.849 1.00 0.00 O ATOM 1312 ND2 ASN A 151 2.934 12.222 -7.913 1.00 0.00 N ATOM 0 H ASN A 151 -0.054 12.731 -4.118 1.00 0.00 H new ATOM 0 HA ASN A 151 1.994 14.575 -5.179 1.00 0.00 H new ATOM 0 HB2 ASN A 151 0.700 12.082 -6.095 1.00 0.00 H new ATOM 0 HB3 ASN A 151 0.717 13.340 -7.316 1.00 0.00 H new ATOM 0 HD21 ASN A 151 3.896 11.998 -8.170 1.00 0.00 H new ATOM 0 HD22 ASN A 151 2.181 12.086 -8.588 1.00 0.00 H new ATOM 1319 N GLN A 152 0.434 16.295 -6.033 1.00 0.00 N ATOM 1320 CA GLN A 152 -0.473 17.362 -6.444 1.00 0.00 C ATOM 1321 C GLN A 152 -1.429 17.728 -5.313 1.00 0.00 C ATOM 1322 O GLN A 152 -2.075 16.858 -4.728 1.00 0.00 O ATOM 1323 CB GLN A 152 -1.267 16.940 -7.684 1.00 0.00 C ATOM 1324 CG GLN A 152 -0.706 17.498 -8.982 1.00 0.00 C ATOM 1325 CD GLN A 152 -1.076 18.951 -9.199 1.00 0.00 C ATOM 1326 OE1 GLN A 152 -0.968 19.774 -8.290 1.00 0.00 O ATOM 1327 NE2 GLN A 152 -1.515 19.276 -10.410 1.00 0.00 N ATOM 0 H GLN A 152 1.417 16.566 -6.002 1.00 0.00 H new ATOM 0 HA GLN A 152 0.126 18.239 -6.688 1.00 0.00 H new ATOM 0 HB2 GLN A 152 -1.283 15.852 -7.742 1.00 0.00 H new ATOM 0 HB3 GLN A 152 -2.300 17.268 -7.573 1.00 0.00 H new ATOM 0 HG2 GLN A 152 0.380 17.400 -8.976 1.00 0.00 H new ATOM 0 HG3 GLN A 152 -1.075 16.904 -9.818 1.00 0.00 H new ATOM 0 HE21 GLN A 152 -1.589 18.562 -11.134 1.00 0.00 H new ATOM 0 HE22 GLN A 152 -1.778 20.240 -10.615 1.00 0.00 H new ATOM 1336 N GLN A 153 -1.513 19.020 -5.010 1.00 0.00 N ATOM 1337 CA GLN A 153 -2.390 19.500 -3.948 1.00 0.00 C ATOM 1338 C GLN A 153 -3.337 20.576 -4.469 1.00 0.00 C ATOM 1339 O GLN A 153 -4.391 20.793 -3.835 1.00 0.00 O ATOM 1340 CB GLN A 153 -1.562 20.052 -2.784 1.00 0.00 C ATOM 1341 CG GLN A 153 -0.707 21.250 -3.161 1.00 0.00 C ATOM 1342 CD GLN A 153 0.542 21.367 -2.310 1.00 0.00 C ATOM 1343 OE1 GLN A 153 1.655 21.141 -2.787 1.00 0.00 O ATOM 1344 NE2 GLN A 153 0.364 21.720 -1.043 1.00 0.00 N ATOM 1345 OXT GLN A 153 -3.016 21.194 -5.507 1.00 0.00 O ATOM 0 H GLN A 153 -0.985 19.752 -5.485 1.00 0.00 H new ATOM 0 HA GLN A 153 -2.985 18.658 -3.594 1.00 0.00 H new ATOM 0 HB2 GLN A 153 -2.234 20.336 -1.974 1.00 0.00 H new ATOM 0 HB3 GLN A 153 -0.917 19.262 -2.401 1.00 0.00 H new ATOM 0 HG2 GLN A 153 -0.421 21.172 -4.210 1.00 0.00 H new ATOM 0 HG3 GLN A 153 -1.298 22.160 -3.059 1.00 0.00 H new ATOM 0 HE21 GLN A 153 -0.576 21.898 -0.690 1.00 0.00 H new ATOM 0 HE22 GLN A 153 1.168 21.814 -0.422 1.00 0.00 H new TER 1354 GLN A 153 ATOM 1355 N ARG B 123 2.238 -3.669 -17.766 1.00 0.00 N ATOM 1356 CA ARG B 123 1.752 -2.954 -16.557 1.00 0.00 C ATOM 1357 C ARG B 123 1.186 -3.929 -15.529 1.00 0.00 C ATOM 1358 O ARG B 123 0.311 -4.737 -15.841 1.00 0.00 O ATOM 1359 CB ARG B 123 0.675 -1.953 -16.981 1.00 0.00 C ATOM 1360 CG ARG B 123 0.284 -0.978 -15.883 1.00 0.00 C ATOM 1361 CD ARG B 123 -0.710 0.058 -16.385 1.00 0.00 C ATOM 1362 NE ARG B 123 -0.668 1.285 -15.594 1.00 0.00 N ATOM 1363 CZ ARG B 123 -1.113 1.376 -14.344 1.00 0.00 C ATOM 1364 NH1 ARG B 123 -1.633 0.316 -13.738 1.00 0.00 N ATOM 1365 NH2 ARG B 123 -1.038 2.531 -13.696 1.00 0.00 N ATOM 0 HA ARG B 123 2.588 -2.433 -16.091 1.00 0.00 H new ATOM 0 HB2 ARG B 123 1.033 -1.391 -17.844 1.00 0.00 H new ATOM 0 HB3 ARG B 123 -0.211 -2.500 -17.302 1.00 0.00 H new ATOM 0 HG2 ARG B 123 -0.151 -1.526 -15.047 1.00 0.00 H new ATOM 0 HG3 ARG B 123 1.175 -0.476 -15.506 1.00 0.00 H new ATOM 0 HD2 ARG B 123 -0.495 0.291 -17.428 1.00 0.00 H new ATOM 0 HD3 ARG B 123 -1.716 -0.360 -16.353 1.00 0.00 H new ATOM 0 HE ARG B 123 -0.274 2.121 -16.026 1.00 0.00 H new ATOM 0 HH11 ARG B 123 -1.693 -0.575 -14.231 1.00 0.00 H new ATOM 0 HH12 ARG B 123 -1.973 0.392 -12.779 1.00 0.00 H new ATOM 0 HH21 ARG B 123 -0.639 3.349 -14.156 1.00 0.00 H new ATOM 0 HH22 ARG B 123 -1.379 2.601 -12.737 1.00 0.00 H new ATOM 1379 N LYS B 124 1.692 -3.848 -14.302 1.00 0.00 N ATOM 1380 CA LYS B 124 1.237 -4.724 -13.229 1.00 0.00 C ATOM 1381 C LYS B 124 0.572 -3.919 -12.117 1.00 0.00 C ATOM 1382 O LYS B 124 0.668 -2.692 -12.082 1.00 0.00 O ATOM 1383 CB LYS B 124 2.411 -5.530 -12.666 1.00 0.00 C ATOM 1384 CG LYS B 124 2.340 -7.013 -12.993 1.00 0.00 C ATOM 1385 CD LYS B 124 2.560 -7.870 -11.756 1.00 0.00 C ATOM 1386 CE LYS B 124 2.320 -9.342 -12.049 1.00 0.00 C ATOM 1387 NZ LYS B 124 0.881 -9.706 -11.927 1.00 0.00 N ATOM 0 H LYS B 124 2.417 -3.185 -14.027 1.00 0.00 H new ATOM 0 HA LYS B 124 0.501 -5.414 -13.642 1.00 0.00 H new ATOM 0 HB2 LYS B 124 3.343 -5.123 -13.060 1.00 0.00 H new ATOM 0 HB3 LYS B 124 2.441 -5.406 -11.584 1.00 0.00 H new ATOM 0 HG2 LYS B 124 1.368 -7.244 -13.428 1.00 0.00 H new ATOM 0 HG3 LYS B 124 3.092 -7.257 -13.744 1.00 0.00 H new ATOM 0 HD2 LYS B 124 3.578 -7.732 -11.392 1.00 0.00 H new ATOM 0 HD3 LYS B 124 1.890 -7.542 -10.961 1.00 0.00 H new ATOM 0 HE2 LYS B 124 2.669 -9.573 -13.056 1.00 0.00 H new ATOM 0 HE3 LYS B 124 2.908 -9.950 -11.361 1.00 0.00 H new ATOM 0 HZ1 LYS B 124 0.760 -10.718 -12.135 1.00 0.00 H new ATOM 0 HZ2 LYS B 124 0.554 -9.510 -10.959 1.00 0.00 H new ATOM 0 HZ3 LYS B 124 0.323 -9.145 -12.602 1.00 0.00 H new ATOM 1401 N GLU B 125 -0.103 -4.619 -11.211 1.00 0.00 N ATOM 1402 CA GLU B 125 -0.785 -3.989 -10.102 1.00 0.00 C ATOM 1403 C GLU B 125 -1.140 -5.021 -9.045 1.00 0.00 C ATOM 1404 O GLU B 125 -1.582 -6.127 -9.359 1.00 0.00 O ATOM 1405 CB GLU B 125 -2.036 -3.269 -10.596 1.00 0.00 C ATOM 1406 CG GLU B 125 -3.252 -4.171 -10.758 1.00 0.00 C ATOM 1407 CD GLU B 125 -4.379 -3.500 -11.516 1.00 0.00 C ATOM 1408 OE1 GLU B 125 -4.222 -3.270 -12.734 1.00 0.00 O ATOM 1409 OE2 GLU B 125 -5.421 -3.204 -10.893 1.00 0.00 O ATOM 0 H GLU B 125 -0.189 -5.635 -11.230 1.00 0.00 H new ATOM 0 HA GLU B 125 -0.119 -3.254 -9.650 1.00 0.00 H new ATOM 0 HB2 GLU B 125 -2.281 -2.469 -9.897 1.00 0.00 H new ATOM 0 HB3 GLU B 125 -1.816 -2.798 -11.554 1.00 0.00 H new ATOM 0 HG2 GLU B 125 -2.958 -5.080 -11.282 1.00 0.00 H new ATOM 0 HG3 GLU B 125 -3.610 -4.472 -9.773 1.00 0.00 H new ATOM 1416 N TYR B 126 -0.933 -4.651 -7.798 1.00 0.00 N ATOM 1417 CA TYR B 126 -1.215 -5.534 -6.682 1.00 0.00 C ATOM 1418 C TYR B 126 -2.222 -4.915 -5.737 1.00 0.00 C ATOM 1419 O TYR B 126 -2.098 -3.750 -5.361 1.00 0.00 O ATOM 1420 CB TYR B 126 0.066 -5.835 -5.918 1.00 0.00 C ATOM 1421 CG TYR B 126 0.905 -6.894 -6.572 1.00 0.00 C ATOM 1422 CD1 TYR B 126 1.588 -6.628 -7.747 1.00 0.00 C ATOM 1423 CD2 TYR B 126 1.011 -8.156 -6.016 1.00 0.00 C ATOM 1424 CE1 TYR B 126 2.358 -7.595 -8.355 1.00 0.00 C ATOM 1425 CE2 TYR B 126 1.777 -9.133 -6.611 1.00 0.00 C ATOM 1426 CZ TYR B 126 2.452 -8.850 -7.784 1.00 0.00 C ATOM 1427 OH TYR B 126 3.219 -9.821 -8.384 1.00 0.00 O ATOM 0 H TYR B 126 -0.567 -3.737 -7.529 1.00 0.00 H new ATOM 0 HA TYR B 126 -1.633 -6.457 -7.084 1.00 0.00 H new ATOM 0 HB2 TYR B 126 0.652 -4.920 -5.827 1.00 0.00 H new ATOM 0 HB3 TYR B 126 -0.187 -6.153 -4.907 1.00 0.00 H new ATOM 0 HD1 TYR B 126 1.516 -5.647 -8.194 1.00 0.00 H new ATOM 0 HD2 TYR B 126 0.484 -8.379 -5.100 1.00 0.00 H new ATOM 0 HE1 TYR B 126 2.885 -7.374 -9.272 1.00 0.00 H new ATOM 0 HE2 TYR B 126 1.850 -10.114 -6.165 1.00 0.00 H new ATOM 0 HH TYR B 126 3.178 -10.644 -7.854 1.00 0.00 H new ATOM 1437 N CYS B 127 -3.197 -5.707 -5.324 1.00 0.00 N ATOM 1438 CA CYS B 127 -4.195 -5.235 -4.387 1.00 0.00 C ATOM 1439 C CYS B 127 -3.917 -5.858 -3.032 1.00 0.00 C ATOM 1440 O CYS B 127 -3.953 -7.079 -2.876 1.00 0.00 O ATOM 1441 CB CYS B 127 -5.600 -5.584 -4.875 1.00 0.00 C ATOM 1442 SG CYS B 127 -6.119 -4.635 -6.343 1.00 0.00 S ATOM 0 H CYS B 127 -3.316 -6.675 -5.623 1.00 0.00 H new ATOM 0 HA CYS B 127 -4.142 -4.149 -4.305 1.00 0.00 H new ATOM 0 HB2 CYS B 127 -5.641 -6.648 -5.107 1.00 0.00 H new ATOM 0 HB3 CYS B 127 -6.311 -5.406 -4.068 1.00 0.00 H new ATOM 1447 N ILE B 128 -3.593 -5.013 -2.069 1.00 0.00 N ATOM 1448 CA ILE B 128 -3.253 -5.474 -0.738 1.00 0.00 C ATOM 1449 C ILE B 128 -3.835 -4.561 0.336 1.00 0.00 C ATOM 1450 O ILE B 128 -3.340 -4.606 1.481 1.00 0.00 O ATOM 1451 CB ILE B 128 -1.722 -5.540 -0.588 1.00 0.00 C ATOM 1452 CG1 ILE B 128 -1.096 -4.188 -0.940 1.00 0.00 C ATOM 1453 CG2 ILE B 128 -1.157 -6.643 -1.472 1.00 0.00 C ATOM 1454 CD1 ILE B 128 -0.959 -3.954 -2.428 1.00 0.00 C ATOM 1455 OXT ILE B 128 -4.784 -3.809 0.023 1.00 0.00 O ATOM 0 H ILE B 128 -3.559 -4.000 -2.187 1.00 0.00 H new ATOM 0 HA ILE B 128 -3.683 -6.467 -0.605 1.00 0.00 H new ATOM 0 HB ILE B 128 -1.477 -5.770 0.449 1.00 0.00 H new ATOM 0 HG12 ILE B 128 -1.704 -3.392 -0.510 1.00 0.00 H new ATOM 0 HG13 ILE B 128 -0.111 -4.122 -0.478 1.00 0.00 H new ATOM 0 HG21 ILE B 128 -0.074 -6.681 -1.358 1.00 0.00 H new ATOM 0 HG22 ILE B 128 -1.587 -7.601 -1.178 1.00 0.00 H new ATOM 0 HG23 ILE B 128 -1.406 -6.438 -2.513 1.00 0.00 H new ATOM 0 HD11 ILE B 128 -0.508 -2.977 -2.603 1.00 0.00 H new ATOM 0 HD12 ILE B 128 -0.326 -4.728 -2.861 1.00 0.00 H new ATOM 0 HD13 ILE B 128 -1.944 -3.988 -2.894 1.00 0.00 H new TER 1467 ILE B 128