USER MOD reduce.3.24.130724 H: found=0, std=0, add=747, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 746 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 86 ASN : amide:sc= -14.4! C(o=-15!,f=-20!) USER MOD Set 1.2: A 88 SER OG : rot 180:sc= -0.133! USER MOD Single : A 8 GLN : amide:sc= -0.0614 X(o=-0.061,f=-0.3) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 THR OG1 : rot 85:sc= 0.188 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 173:sc= 1.03 (180deg=0.839) USER MOD Single : A 22 HIS :FLIP no HE2:sc= -0.123 F(o=-2!,f=-0.12) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot -48:sc= 0.273 USER MOD Single : A 31 CYS SG : rot 61:sc= -1.05 USER MOD Single : A 44 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 MET CE :methyl -163:sc= -0.761 (180deg=-1.68) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 41:sc= 1.03 USER MOD Single : A 52 HIS : no HD1:sc= -0.074 X(o=-0.074,f=-0.025) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 GLN :FLIP amide:sc= 0 F(o=-0.6,f=0) USER MOD Single : A 57 GLN :FLIP amide:sc= -2.24 F(o=-4.4,f=-2.2) USER MOD Single : A 60 TYR OH : rot 165:sc= -0.347 USER MOD Single : A 61 TYR OH : rot 180:sc= -1 USER MOD Single : A 63 THR OG1 : rot 180:sc= -1.4! USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 GLN : amide:sc= -2.91! C(o=-2.9!,f=-4.8!) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot -98:sc= -2.93! USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 TYR OH : rot 30:sc= -3.48! USER MOD Single : A 94 MET CE :methyl -148:sc= -0.271 (180deg=-1.36!) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 8 -11.543 -24.466 -25.228 1.00 0.00 N ATOM 2 CA GLN A 8 -12.944 -24.294 -24.751 1.00 0.00 C ATOM 3 C GLN A 8 -13.039 -24.716 -23.283 1.00 0.00 C ATOM 4 O GLN A 8 -13.095 -25.888 -22.968 1.00 0.00 O ATOM 5 CB GLN A 8 -13.880 -25.162 -25.593 1.00 0.00 C ATOM 6 CG GLN A 8 -15.307 -25.047 -25.051 1.00 0.00 C ATOM 7 CD GLN A 8 -16.100 -24.062 -25.911 1.00 0.00 C ATOM 8 OE1 GLN A 8 -16.144 -24.189 -27.118 1.00 0.00 O ATOM 9 NE2 GLN A 8 -16.736 -23.077 -25.336 1.00 0.00 N ATOM 0 HA GLN A 8 -13.234 -23.248 -24.848 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -13.849 -24.844 -26.635 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -13.552 -26.201 -25.566 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -15.790 -26.024 -25.058 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -15.288 -24.709 -24.015 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -16.700 -22.969 -24.322 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -17.269 -22.415 -25.901 1.00 0.00 H new ATOM 18 N PRO A 9 -13.060 -23.734 -22.372 1.00 0.00 N ATOM 19 CA PRO A 9 -13.150 -23.993 -20.929 1.00 0.00 C ATOM 20 C PRO A 9 -14.530 -24.528 -20.534 1.00 0.00 C ATOM 21 O PRO A 9 -15.523 -24.239 -21.173 1.00 0.00 O ATOM 22 CB PRO A 9 -12.926 -22.616 -20.304 1.00 0.00 C ATOM 23 CG PRO A 9 -13.342 -21.652 -21.362 1.00 0.00 C ATOM 24 CD PRO A 9 -12.996 -22.294 -22.675 1.00 0.00 C ATOM 0 HA PRO A 9 -12.433 -24.746 -20.602 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -13.519 -22.491 -19.398 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -11.882 -22.472 -20.025 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -14.410 -21.444 -21.300 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -12.824 -20.700 -21.246 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -13.701 -22.015 -23.458 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -12.005 -21.998 -23.019 1.00 0.00 H new ATOM 32 N LEU A 10 -14.600 -25.306 -19.489 1.00 0.00 N ATOM 33 CA LEU A 10 -15.917 -25.855 -19.059 1.00 0.00 C ATOM 34 C LEU A 10 -16.628 -24.837 -18.167 1.00 0.00 C ATOM 35 O LEU A 10 -16.033 -23.889 -17.694 1.00 0.00 O ATOM 36 CB LEU A 10 -15.698 -27.151 -18.276 1.00 0.00 C ATOM 37 CG LEU A 10 -14.960 -28.160 -19.159 1.00 0.00 C ATOM 38 CD1 LEU A 10 -13.463 -28.106 -18.853 1.00 0.00 C ATOM 39 CD2 LEU A 10 -15.489 -29.568 -18.875 1.00 0.00 C ATOM 0 H LEU A 10 -13.804 -25.585 -18.915 1.00 0.00 H new ATOM 0 HA LEU A 10 -16.529 -26.059 -19.938 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -15.121 -26.950 -17.373 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -16.656 -27.562 -17.957 1.00 0.00 H new ATOM 0 HG LEU A 10 -15.125 -27.914 -20.208 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -12.937 -28.824 -19.482 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -13.086 -27.103 -19.055 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -13.297 -28.352 -17.804 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -14.964 -30.288 -19.503 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -15.324 -29.814 -17.826 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -16.556 -29.607 -19.093 1.00 0.00 H new ATOM 51 N GLU A 11 -17.898 -25.023 -17.931 1.00 0.00 N ATOM 52 CA GLU A 11 -18.644 -24.063 -17.071 1.00 0.00 C ATOM 53 C GLU A 11 -18.857 -24.679 -15.687 1.00 0.00 C ATOM 54 O GLU A 11 -19.065 -25.868 -15.550 1.00 0.00 O ATOM 55 CB GLU A 11 -20.001 -23.755 -17.705 1.00 0.00 C ATOM 56 CG GLU A 11 -19.789 -23.038 -19.040 1.00 0.00 C ATOM 57 CD GLU A 11 -19.075 -21.707 -18.798 1.00 0.00 C ATOM 58 OE1 GLU A 11 -19.067 -21.260 -17.662 1.00 0.00 O ATOM 59 OE2 GLU A 11 -18.548 -21.158 -19.750 1.00 0.00 O ATOM 0 H GLU A 11 -18.451 -25.798 -18.297 1.00 0.00 H new ATOM 0 HA GLU A 11 -18.071 -23.141 -16.976 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -20.560 -24.678 -17.860 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -20.594 -23.132 -17.036 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -19.199 -23.663 -19.710 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -20.748 -22.865 -19.528 1.00 0.00 H new ATOM 66 N ALA A 12 -18.806 -23.878 -14.659 1.00 0.00 N ATOM 67 CA ALA A 12 -19.008 -24.415 -13.285 1.00 0.00 C ATOM 68 C ALA A 12 -19.474 -23.287 -12.363 1.00 0.00 C ATOM 69 O ALA A 12 -19.112 -22.141 -12.536 1.00 0.00 O ATOM 70 CB ALA A 12 -17.689 -24.989 -12.763 1.00 0.00 C ATOM 0 H ALA A 12 -18.633 -22.874 -14.712 1.00 0.00 H new ATOM 0 HA ALA A 12 -19.762 -25.202 -13.308 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -17.836 -25.382 -11.757 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -17.356 -25.791 -13.421 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -16.934 -24.203 -12.738 1.00 0.00 H new ATOM 76 N GLU A 13 -20.275 -23.603 -11.384 1.00 0.00 N ATOM 77 CA GLU A 13 -20.764 -22.549 -10.452 1.00 0.00 C ATOM 78 C GLU A 13 -20.343 -22.897 -9.024 1.00 0.00 C ATOM 79 O GLU A 13 -20.691 -23.936 -8.501 1.00 0.00 O ATOM 80 CB GLU A 13 -22.290 -22.469 -10.531 1.00 0.00 C ATOM 81 CG GLU A 13 -22.773 -21.204 -9.821 1.00 0.00 C ATOM 82 CD GLU A 13 -24.302 -21.152 -9.855 1.00 0.00 C ATOM 83 OE1 GLU A 13 -24.890 -22.026 -10.471 1.00 0.00 O ATOM 84 OE2 GLU A 13 -24.858 -20.241 -9.266 1.00 0.00 O ATOM 0 H GLU A 13 -20.612 -24.546 -11.189 1.00 0.00 H new ATOM 0 HA GLU A 13 -20.335 -21.587 -10.732 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -22.611 -22.459 -11.573 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -22.735 -23.350 -10.069 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -22.421 -21.196 -8.789 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -22.358 -20.321 -10.306 1.00 0.00 H new ATOM 91 N ILE A 14 -19.599 -22.035 -8.388 1.00 0.00 N ATOM 92 CA ILE A 14 -19.158 -22.318 -6.993 1.00 0.00 C ATOM 93 C ILE A 14 -19.844 -21.342 -6.035 1.00 0.00 C ATOM 94 O ILE A 14 -19.806 -20.142 -6.224 1.00 0.00 O ATOM 95 CB ILE A 14 -17.641 -22.152 -6.895 1.00 0.00 C ATOM 96 CG1 ILE A 14 -16.960 -23.070 -7.912 1.00 0.00 C ATOM 97 CG2 ILE A 14 -17.177 -22.521 -5.484 1.00 0.00 C ATOM 98 CD1 ILE A 14 -15.441 -22.973 -7.754 1.00 0.00 C ATOM 0 H ILE A 14 -19.277 -21.147 -8.774 1.00 0.00 H new ATOM 0 HA ILE A 14 -19.428 -23.339 -6.725 1.00 0.00 H new ATOM 0 HB ILE A 14 -17.375 -21.116 -7.106 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -17.286 -24.099 -7.764 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -17.249 -22.787 -8.924 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -16.096 -22.403 -5.414 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -17.661 -21.867 -4.759 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -17.443 -23.557 -5.273 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -14.957 -23.627 -8.479 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -15.122 -21.945 -7.924 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -15.160 -23.278 -6.746 1.00 0.00 H new ATOM 110 N LYS A 15 -20.475 -21.847 -5.011 1.00 0.00 N ATOM 111 CA LYS A 15 -21.165 -20.949 -4.042 1.00 0.00 C ATOM 112 C LYS A 15 -22.140 -20.042 -4.794 1.00 0.00 C ATOM 113 O LYS A 15 -22.464 -18.959 -4.349 1.00 0.00 O ATOM 114 CB LYS A 15 -20.129 -20.091 -3.315 1.00 0.00 C ATOM 115 CG LYS A 15 -19.013 -20.987 -2.774 1.00 0.00 C ATOM 116 CD LYS A 15 -18.169 -20.199 -1.770 1.00 0.00 C ATOM 117 CE LYS A 15 -17.309 -19.179 -2.518 1.00 0.00 C ATOM 118 NZ LYS A 15 -17.521 -17.826 -1.931 1.00 0.00 N ATOM 0 H LYS A 15 -20.543 -22.843 -4.803 1.00 0.00 H new ATOM 0 HA LYS A 15 -21.713 -21.550 -3.316 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -19.715 -19.347 -3.996 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -20.601 -19.547 -2.497 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -19.439 -21.868 -2.295 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -18.387 -21.341 -3.593 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -18.816 -19.691 -1.055 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -17.534 -20.878 -1.200 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -16.257 -19.456 -2.451 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -17.570 -19.173 -3.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -16.937 -17.132 -2.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -18.524 -17.564 -2.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -17.251 -17.837 -0.927 1.00 0.00 H new ATOM 132 N GLY A 16 -22.612 -20.475 -5.931 1.00 0.00 N ATOM 133 CA GLY A 16 -23.567 -19.635 -6.708 1.00 0.00 C ATOM 134 C GLY A 16 -22.795 -18.792 -7.724 1.00 0.00 C ATOM 135 O GLY A 16 -23.361 -18.249 -8.652 1.00 0.00 O ATOM 0 H GLY A 16 -22.378 -21.373 -6.355 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -24.291 -20.268 -7.220 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -24.129 -18.988 -6.035 1.00 0.00 H new ATOM 139 N THR A 17 -21.504 -18.677 -7.558 1.00 0.00 N ATOM 140 CA THR A 17 -20.701 -17.869 -8.516 1.00 0.00 C ATOM 141 C THR A 17 -20.433 -18.696 -9.775 1.00 0.00 C ATOM 142 O THR A 17 -19.930 -19.800 -9.707 1.00 0.00 O ATOM 143 CB THR A 17 -19.371 -17.480 -7.866 1.00 0.00 C ATOM 144 OG1 THR A 17 -19.588 -17.178 -6.494 1.00 0.00 O ATOM 145 CG2 THR A 17 -18.793 -16.256 -8.576 1.00 0.00 C ATOM 0 H THR A 17 -20.973 -19.108 -6.801 1.00 0.00 H new ATOM 0 HA THR A 17 -21.250 -16.966 -8.783 1.00 0.00 H new ATOM 0 HB THR A 17 -18.668 -18.309 -7.949 1.00 0.00 H new ATOM 0 HG1 THR A 17 -19.564 -18.005 -5.969 1.00 0.00 H new ATOM 0 HG21 THR A 17 -17.846 -15.980 -8.112 1.00 0.00 H new ATOM 0 HG22 THR A 17 -18.628 -16.490 -9.628 1.00 0.00 H new ATOM 0 HG23 THR A 17 -19.493 -15.424 -8.495 1.00 0.00 H new ATOM 153 N LYS A 18 -20.767 -18.173 -10.922 1.00 0.00 N ATOM 154 CA LYS A 18 -20.533 -18.934 -12.182 1.00 0.00 C ATOM 155 C LYS A 18 -19.188 -18.528 -12.785 1.00 0.00 C ATOM 156 O LYS A 18 -18.983 -17.391 -13.163 1.00 0.00 O ATOM 157 CB LYS A 18 -21.651 -18.628 -13.180 1.00 0.00 C ATOM 158 CG LYS A 18 -21.458 -19.481 -14.435 1.00 0.00 C ATOM 159 CD LYS A 18 -22.492 -19.081 -15.489 1.00 0.00 C ATOM 160 CE LYS A 18 -22.411 -20.045 -16.674 1.00 0.00 C ATOM 161 NZ LYS A 18 -23.785 -20.350 -17.163 1.00 0.00 N ATOM 0 H LYS A 18 -21.191 -17.253 -11.042 1.00 0.00 H new ATOM 0 HA LYS A 18 -20.524 -20.001 -11.962 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -22.622 -18.837 -12.731 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -21.641 -17.570 -13.441 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -20.451 -19.345 -14.829 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -21.564 -20.538 -14.189 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -23.493 -19.101 -15.058 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -22.309 -18.060 -15.824 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -21.818 -19.604 -17.475 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -21.908 -20.964 -16.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -23.729 -21.005 -17.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -24.337 -20.788 -16.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -24.250 -19.470 -17.464 1.00 0.00 H new ATOM 175 N LEU A 19 -18.270 -19.450 -12.880 1.00 0.00 N ATOM 176 CA LEU A 19 -16.938 -19.123 -13.462 1.00 0.00 C ATOM 177 C LEU A 19 -16.529 -20.226 -14.441 1.00 0.00 C ATOM 178 O LEU A 19 -17.111 -21.293 -14.467 1.00 0.00 O ATOM 179 CB LEU A 19 -15.900 -19.025 -12.342 1.00 0.00 C ATOM 180 CG LEU A 19 -16.023 -17.668 -11.648 1.00 0.00 C ATOM 181 CD1 LEU A 19 -17.319 -17.627 -10.837 1.00 0.00 C ATOM 182 CD2 LEU A 19 -14.830 -17.460 -10.712 1.00 0.00 C ATOM 0 H LEU A 19 -18.385 -20.418 -12.579 1.00 0.00 H new ATOM 0 HA LEU A 19 -16.994 -18.170 -13.987 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -16.051 -19.829 -11.621 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -14.897 -19.147 -12.750 1.00 0.00 H new ATOM 0 HG LEU A 19 -16.037 -16.878 -12.398 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -17.408 -16.660 -10.342 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -18.170 -17.773 -11.503 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -17.305 -18.418 -10.088 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -14.919 -16.492 -10.218 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -14.814 -18.250 -9.961 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -13.906 -17.489 -11.289 1.00 0.00 H new ATOM 194 N LYS A 20 -15.534 -19.979 -15.247 1.00 0.00 N ATOM 195 CA LYS A 20 -15.093 -21.016 -16.222 1.00 0.00 C ATOM 196 C LYS A 20 -14.206 -22.039 -15.511 1.00 0.00 C ATOM 197 O LYS A 20 -13.588 -21.748 -14.506 1.00 0.00 O ATOM 198 CB LYS A 20 -14.302 -20.352 -17.351 1.00 0.00 C ATOM 199 CG LYS A 20 -15.134 -19.221 -17.961 1.00 0.00 C ATOM 200 CD LYS A 20 -16.369 -19.809 -18.646 1.00 0.00 C ATOM 201 CE LYS A 20 -17.097 -18.704 -19.416 1.00 0.00 C ATOM 202 NZ LYS A 20 -17.427 -19.187 -20.787 1.00 0.00 N ATOM 0 H LYS A 20 -15.008 -19.106 -15.273 1.00 0.00 H new ATOM 0 HA LYS A 20 -15.966 -21.519 -16.638 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -13.360 -19.959 -16.967 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -14.052 -21.087 -18.116 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -15.436 -18.518 -17.185 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -14.536 -18.663 -18.682 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -16.075 -20.609 -19.326 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -17.035 -20.250 -17.904 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -18.008 -18.420 -18.890 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -16.471 -17.813 -19.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -18.023 -18.484 -21.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -16.549 -19.325 -21.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -17.939 -20.090 -20.723 1.00 0.00 H new ATOM 216 N ALA A 21 -14.136 -23.237 -16.024 1.00 0.00 N ATOM 217 CA ALA A 21 -13.289 -24.278 -15.377 1.00 0.00 C ATOM 218 C ALA A 21 -12.598 -25.115 -16.454 1.00 0.00 C ATOM 219 O ALA A 21 -12.989 -25.108 -17.605 1.00 0.00 O ATOM 220 CB ALA A 21 -14.168 -25.184 -14.511 1.00 0.00 C ATOM 0 H ALA A 21 -14.629 -23.540 -16.864 1.00 0.00 H new ATOM 0 HA ALA A 21 -12.536 -23.798 -14.752 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -13.549 -25.946 -14.037 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -14.660 -24.587 -13.743 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -14.921 -25.665 -15.135 1.00 0.00 H new ATOM 226 N HIS A 22 -11.573 -25.838 -16.093 1.00 0.00 N ATOM 227 CA HIS A 22 -10.859 -26.674 -17.099 1.00 0.00 C ATOM 228 C HIS A 22 -10.806 -28.123 -16.615 1.00 0.00 C ATOM 229 O HIS A 22 -10.543 -28.392 -15.459 1.00 0.00 O ATOM 230 CB HIS A 22 -9.436 -26.147 -17.284 1.00 0.00 C ATOM 231 CG HIS A 22 -9.464 -24.931 -18.167 1.00 0.00 C ATOM 232 ND1 HIS A 22 -9.404 -23.589 -17.882 1.00 0.00 N flip ATOM 233 CD2 HIS A 22 -9.562 -25.020 -19.547 1.00 0.00 C flip ATOM 234 CE1 HIS A 22 -9.465 -22.855 -19.062 1.00 0.00 C flip ATOM 235 NE2 HIS A 22 -9.559 -23.767 -20.035 1.00 0.00 N flip ATOM 0 H HIS A 22 -11.199 -25.886 -15.145 1.00 0.00 H new ATOM 0 HA HIS A 22 -11.390 -26.628 -18.050 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -9.000 -25.897 -16.317 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -8.806 -26.918 -17.728 1.00 0.00 H new ATOM 0 HD1 HIS A 22 -9.326 -23.191 -16.946 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -9.629 -25.930 -20.125 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -9.442 -21.781 -19.169 1.00 0.00 H new ATOM 243 N TRP A 23 -11.053 -29.058 -17.489 1.00 0.00 N ATOM 244 CA TRP A 23 -11.017 -30.489 -17.080 1.00 0.00 C ATOM 245 C TRP A 23 -9.581 -31.007 -17.168 1.00 0.00 C ATOM 246 O TRP A 23 -8.930 -30.889 -18.187 1.00 0.00 O ATOM 247 CB TRP A 23 -11.912 -31.306 -18.014 1.00 0.00 C ATOM 248 CG TRP A 23 -12.153 -32.655 -17.417 1.00 0.00 C ATOM 249 CD1 TRP A 23 -12.999 -32.912 -16.393 1.00 0.00 C ATOM 250 CD2 TRP A 23 -11.560 -33.933 -17.790 1.00 0.00 C ATOM 251 NE1 TRP A 23 -12.963 -34.266 -16.113 1.00 0.00 N ATOM 252 CE2 TRP A 23 -12.091 -34.938 -16.947 1.00 0.00 C ATOM 253 CE3 TRP A 23 -10.623 -34.314 -18.767 1.00 0.00 C ATOM 254 CZ2 TRP A 23 -11.706 -36.273 -17.068 1.00 0.00 C ATOM 255 CZ3 TRP A 23 -10.233 -35.658 -18.892 1.00 0.00 C ATOM 256 CH2 TRP A 23 -10.774 -36.634 -18.045 1.00 0.00 C ATOM 0 H TRP A 23 -11.278 -28.893 -18.470 1.00 0.00 H new ATOM 0 HA TRP A 23 -11.376 -30.585 -16.055 1.00 0.00 H new ATOM 0 HB2 TRP A 23 -12.860 -30.791 -18.170 1.00 0.00 H new ATOM 0 HB3 TRP A 23 -11.440 -31.408 -18.991 1.00 0.00 H new ATOM 0 HD1 TRP A 23 -13.604 -32.180 -15.878 1.00 0.00 H new ATOM 0 HE1 TRP A 23 -13.513 -34.714 -15.380 1.00 0.00 H new ATOM 0 HE3 TRP A 23 -10.201 -33.569 -19.425 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 -12.125 -37.022 -16.412 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 -9.512 -35.940 -19.645 1.00 0.00 H new ATOM 0 HH2 TRP A 23 -10.471 -37.666 -18.147 1.00 0.00 H new ATOM 267 N ASP A 24 -9.079 -31.578 -16.107 1.00 0.00 N ATOM 268 CA ASP A 24 -7.685 -32.101 -16.132 1.00 0.00 C ATOM 269 C ASP A 24 -7.657 -33.506 -15.529 1.00 0.00 C ATOM 270 O ASP A 24 -7.667 -33.675 -14.325 1.00 0.00 O ATOM 271 CB ASP A 24 -6.780 -31.179 -15.314 1.00 0.00 C ATOM 272 CG ASP A 24 -5.326 -31.632 -15.460 1.00 0.00 C ATOM 273 OD1 ASP A 24 -5.082 -32.530 -16.249 1.00 0.00 O ATOM 274 OD2 ASP A 24 -4.481 -31.074 -14.780 1.00 0.00 O ATOM 0 H ASP A 24 -9.575 -31.705 -15.224 1.00 0.00 H new ATOM 0 HA ASP A 24 -7.330 -32.140 -17.162 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -6.888 -30.149 -15.656 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -7.075 -31.199 -14.265 1.00 0.00 H new ATOM 279 N SER A 25 -7.621 -34.515 -16.354 1.00 0.00 N ATOM 280 CA SER A 25 -7.593 -35.907 -15.823 1.00 0.00 C ATOM 281 C SER A 25 -6.320 -36.114 -15.000 1.00 0.00 C ATOM 282 O SER A 25 -6.291 -36.900 -14.073 1.00 0.00 O ATOM 283 CB SER A 25 -7.613 -36.899 -16.989 1.00 0.00 C ATOM 284 OG SER A 25 -6.355 -36.881 -17.648 1.00 0.00 O ATOM 0 H SER A 25 -7.610 -34.437 -17.371 1.00 0.00 H new ATOM 0 HA SER A 25 -8.465 -36.072 -15.191 1.00 0.00 H new ATOM 0 HB2 SER A 25 -7.829 -37.903 -16.623 1.00 0.00 H new ATOM 0 HB3 SER A 25 -8.406 -36.637 -17.689 1.00 0.00 H new ATOM 0 HG SER A 25 -6.367 -37.517 -18.393 1.00 0.00 H new ATOM 290 N GLY A 26 -5.269 -35.415 -15.329 1.00 0.00 N ATOM 291 CA GLY A 26 -3.999 -35.571 -14.565 1.00 0.00 C ATOM 292 C GLY A 26 -4.252 -35.276 -13.085 1.00 0.00 C ATOM 293 O GLY A 26 -3.641 -35.859 -12.213 1.00 0.00 O ATOM 0 H GLY A 26 -5.235 -34.742 -16.095 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -3.613 -36.583 -14.684 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -3.241 -34.893 -14.957 1.00 0.00 H new ATOM 297 N ALA A 27 -5.150 -34.373 -12.796 1.00 0.00 N ATOM 298 CA ALA A 27 -5.440 -34.041 -11.372 1.00 0.00 C ATOM 299 C ALA A 27 -6.243 -35.180 -10.737 1.00 0.00 C ATOM 300 O ALA A 27 -7.118 -35.753 -11.353 1.00 0.00 O ATOM 301 CB ALA A 27 -6.254 -32.747 -11.306 1.00 0.00 C ATOM 0 H ALA A 27 -5.694 -33.852 -13.483 1.00 0.00 H new ATOM 0 HA ALA A 27 -4.503 -33.910 -10.831 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -6.467 -32.504 -10.265 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -5.685 -31.936 -11.760 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -7.191 -32.879 -11.846 1.00 0.00 H new ATOM 307 N THR A 28 -5.949 -35.513 -9.510 1.00 0.00 N ATOM 308 CA THR A 28 -6.694 -36.614 -8.838 1.00 0.00 C ATOM 309 C THR A 28 -7.759 -36.023 -7.910 1.00 0.00 C ATOM 310 O THR A 28 -8.552 -36.736 -7.328 1.00 0.00 O ATOM 311 CB THR A 28 -5.720 -37.462 -8.018 1.00 0.00 C ATOM 312 OG1 THR A 28 -4.718 -37.992 -8.876 1.00 0.00 O ATOM 313 CG2 THR A 28 -6.478 -38.607 -7.346 1.00 0.00 C ATOM 0 H THR A 28 -5.225 -35.070 -8.944 1.00 0.00 H new ATOM 0 HA THR A 28 -7.176 -37.237 -9.592 1.00 0.00 H new ATOM 0 HB THR A 28 -5.253 -36.842 -7.253 1.00 0.00 H new ATOM 0 HG1 THR A 28 -4.092 -38.534 -8.352 1.00 0.00 H new ATOM 0 HG21 THR A 28 -5.783 -39.210 -6.762 1.00 0.00 H new ATOM 0 HG22 THR A 28 -7.245 -38.199 -6.688 1.00 0.00 H new ATOM 0 HG23 THR A 28 -6.947 -39.229 -8.108 1.00 0.00 H new ATOM 321 N ILE A 29 -7.783 -34.726 -7.767 1.00 0.00 N ATOM 322 CA ILE A 29 -8.798 -34.095 -6.876 1.00 0.00 C ATOM 323 C ILE A 29 -9.200 -32.733 -7.444 1.00 0.00 C ATOM 324 O ILE A 29 -8.418 -32.061 -8.086 1.00 0.00 O ATOM 325 CB ILE A 29 -8.206 -33.912 -5.477 1.00 0.00 C ATOM 326 CG1 ILE A 29 -9.311 -33.492 -4.505 1.00 0.00 C ATOM 327 CG2 ILE A 29 -7.123 -32.831 -5.516 1.00 0.00 C ATOM 328 CD1 ILE A 29 -8.800 -33.612 -3.068 1.00 0.00 C ATOM 0 H ILE A 29 -7.145 -34.077 -8.228 1.00 0.00 H new ATOM 0 HA ILE A 29 -9.677 -34.736 -6.816 1.00 0.00 H new ATOM 0 HB ILE A 29 -7.767 -34.853 -5.144 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -9.618 -32.466 -4.708 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -10.190 -34.121 -4.643 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -6.702 -32.702 -4.519 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -6.335 -33.131 -6.207 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -7.560 -31.890 -5.850 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -9.587 -33.313 -2.376 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -8.515 -34.645 -2.868 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -7.934 -32.964 -2.935 1.00 0.00 H new ATOM 340 N THR A 30 -10.418 -32.322 -7.215 1.00 0.00 N ATOM 341 CA THR A 30 -10.873 -31.004 -7.742 1.00 0.00 C ATOM 342 C THR A 30 -9.887 -29.913 -7.319 1.00 0.00 C ATOM 343 O THR A 30 -9.250 -30.002 -6.287 1.00 0.00 O ATOM 344 CB THR A 30 -12.260 -30.682 -7.181 1.00 0.00 C ATOM 345 OG1 THR A 30 -13.162 -31.724 -7.524 1.00 0.00 O ATOM 346 CG2 THR A 30 -12.754 -29.360 -7.769 1.00 0.00 C ATOM 0 H THR A 30 -11.118 -32.842 -6.686 1.00 0.00 H new ATOM 0 HA THR A 30 -10.920 -31.047 -8.830 1.00 0.00 H new ATOM 0 HB THR A 30 -12.203 -30.595 -6.096 1.00 0.00 H new ATOM 0 HG1 THR A 30 -13.074 -31.932 -8.478 1.00 0.00 H new ATOM 0 HG21 THR A 30 -13.742 -29.131 -7.369 1.00 0.00 H new ATOM 0 HG22 THR A 30 -12.061 -28.562 -7.503 1.00 0.00 H new ATOM 0 HG23 THR A 30 -12.812 -29.444 -8.854 1.00 0.00 H new ATOM 354 N CYS A 31 -9.761 -28.878 -8.104 1.00 0.00 N ATOM 355 CA CYS A 31 -8.822 -27.782 -7.741 1.00 0.00 C ATOM 356 C CYS A 31 -9.562 -26.447 -7.797 1.00 0.00 C ATOM 357 O CYS A 31 -10.331 -26.187 -8.701 1.00 0.00 O ATOM 358 CB CYS A 31 -7.648 -27.763 -8.721 1.00 0.00 C ATOM 359 SG CYS A 31 -6.093 -27.867 -7.801 1.00 0.00 S ATOM 0 H CYS A 31 -10.267 -28.745 -8.979 1.00 0.00 H new ATOM 0 HA CYS A 31 -8.441 -27.946 -6.733 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -7.728 -28.598 -9.417 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -7.671 -26.849 -9.315 1.00 0.00 H new ATOM 0 HG CYS A 31 -6.059 -28.980 -7.130 1.00 0.00 H new ATOM 365 N VAL A 32 -9.343 -25.604 -6.830 1.00 0.00 N ATOM 366 CA VAL A 32 -10.038 -24.290 -6.810 1.00 0.00 C ATOM 367 C VAL A 32 -9.050 -23.206 -6.379 1.00 0.00 C ATOM 368 O VAL A 32 -8.162 -23.451 -5.590 1.00 0.00 O ATOM 369 CB VAL A 32 -11.194 -24.364 -5.809 1.00 0.00 C ATOM 370 CG1 VAL A 32 -11.788 -22.973 -5.591 1.00 0.00 C ATOM 371 CG2 VAL A 32 -12.275 -25.298 -6.355 1.00 0.00 C ATOM 0 H VAL A 32 -8.709 -25.770 -6.048 1.00 0.00 H new ATOM 0 HA VAL A 32 -10.423 -24.050 -7.801 1.00 0.00 H new ATOM 0 HB VAL A 32 -10.821 -24.745 -4.858 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -12.610 -23.036 -4.877 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -11.019 -22.306 -5.201 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -12.160 -22.583 -6.539 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -13.100 -25.354 -5.645 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -12.641 -24.914 -7.307 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -11.855 -26.293 -6.502 1.00 0.00 H new ATOM 381 N PRO A 33 -9.209 -21.980 -6.901 1.00 0.00 N ATOM 382 CA PRO A 33 -8.327 -20.866 -6.553 1.00 0.00 C ATOM 383 C PRO A 33 -8.679 -20.285 -5.178 1.00 0.00 C ATOM 384 O PRO A 33 -9.828 -20.033 -4.877 1.00 0.00 O ATOM 385 CB PRO A 33 -8.612 -19.830 -7.637 1.00 0.00 C ATOM 386 CG PRO A 33 -9.999 -20.127 -8.104 1.00 0.00 C ATOM 387 CD PRO A 33 -10.244 -21.596 -7.877 1.00 0.00 C ATOM 0 HA PRO A 33 -7.282 -21.170 -6.500 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -8.537 -18.816 -7.243 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -7.896 -19.908 -8.455 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -10.726 -19.527 -7.556 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -10.111 -19.877 -9.159 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -11.246 -21.779 -7.490 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -10.151 -22.164 -8.802 1.00 0.00 H new ATOM 395 N GLU A 34 -7.695 -20.085 -4.342 1.00 0.00 N ATOM 396 CA GLU A 34 -7.967 -19.533 -2.984 1.00 0.00 C ATOM 397 C GLU A 34 -8.999 -18.410 -3.078 1.00 0.00 C ATOM 398 O GLU A 34 -9.734 -18.151 -2.146 1.00 0.00 O ATOM 399 CB GLU A 34 -6.672 -18.984 -2.386 1.00 0.00 C ATOM 400 CG GLU A 34 -6.890 -18.667 -0.906 1.00 0.00 C ATOM 401 CD GLU A 34 -5.613 -18.058 -0.324 1.00 0.00 C ATOM 402 OE1 GLU A 34 -4.665 -17.890 -1.074 1.00 0.00 O ATOM 403 OE2 GLU A 34 -5.605 -17.770 0.862 1.00 0.00 O ATOM 0 H GLU A 34 -6.714 -20.280 -4.542 1.00 0.00 H new ATOM 0 HA GLU A 34 -8.356 -20.327 -2.347 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -5.869 -19.712 -2.499 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -6.364 -18.085 -2.920 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -7.723 -17.973 -0.790 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -7.153 -19.575 -0.363 1.00 0.00 H new ATOM 410 N ALA A 35 -9.064 -17.740 -4.194 1.00 0.00 N ATOM 411 CA ALA A 35 -10.054 -16.637 -4.339 1.00 0.00 C ATOM 412 C ALA A 35 -11.428 -17.126 -3.875 1.00 0.00 C ATOM 413 O ALA A 35 -12.275 -16.348 -3.483 1.00 0.00 O ATOM 414 CB ALA A 35 -10.132 -16.208 -5.806 1.00 0.00 C ATOM 0 H ALA A 35 -8.476 -17.908 -5.010 1.00 0.00 H new ATOM 0 HA ALA A 35 -9.745 -15.787 -3.731 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -10.857 -15.401 -5.911 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -9.153 -15.862 -6.136 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -10.442 -17.056 -6.417 1.00 0.00 H new ATOM 420 N PHE A 36 -11.656 -18.411 -3.919 1.00 0.00 N ATOM 421 CA PHE A 36 -12.974 -18.951 -3.483 1.00 0.00 C ATOM 422 C PHE A 36 -12.878 -19.435 -2.034 1.00 0.00 C ATOM 423 O PHE A 36 -13.871 -19.763 -1.414 1.00 0.00 O ATOM 424 CB PHE A 36 -13.363 -20.127 -4.381 1.00 0.00 C ATOM 425 CG PHE A 36 -14.211 -19.629 -5.526 1.00 0.00 C ATOM 426 CD1 PHE A 36 -15.603 -19.568 -5.391 1.00 0.00 C ATOM 427 CD2 PHE A 36 -13.605 -19.230 -6.724 1.00 0.00 C ATOM 428 CE1 PHE A 36 -16.390 -19.108 -6.453 1.00 0.00 C ATOM 429 CE2 PHE A 36 -14.393 -18.769 -7.786 1.00 0.00 C ATOM 430 CZ PHE A 36 -15.786 -18.709 -7.651 1.00 0.00 C ATOM 0 H PHE A 36 -10.985 -19.110 -4.238 1.00 0.00 H new ATOM 0 HA PHE A 36 -13.727 -18.166 -3.556 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -12.468 -20.617 -4.764 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -13.912 -20.872 -3.805 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -16.070 -19.876 -4.467 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -12.531 -19.278 -6.829 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -17.464 -19.061 -6.348 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -13.926 -18.460 -8.710 1.00 0.00 H new ATOM 0 HZ PHE A 36 -16.394 -18.355 -8.471 1.00 0.00 H new ATOM 440 N LEU A 37 -11.694 -19.488 -1.489 1.00 0.00 N ATOM 441 CA LEU A 37 -11.544 -19.957 -0.082 1.00 0.00 C ATOM 442 C LEU A 37 -11.203 -18.770 0.822 1.00 0.00 C ATOM 443 O LEU A 37 -10.872 -18.936 1.979 1.00 0.00 O ATOM 444 CB LEU A 37 -10.420 -20.993 0.001 1.00 0.00 C ATOM 445 CG LEU A 37 -10.818 -22.257 -0.767 1.00 0.00 C ATOM 446 CD1 LEU A 37 -12.255 -22.646 -0.412 1.00 0.00 C ATOM 447 CD2 LEU A 37 -10.715 -21.998 -2.271 1.00 0.00 C ATOM 0 H LEU A 37 -10.825 -19.227 -1.956 1.00 0.00 H new ATOM 0 HA LEU A 37 -12.480 -20.409 0.245 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -9.501 -20.579 -0.414 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -10.217 -21.239 1.043 1.00 0.00 H new ATOM 0 HG LEU A 37 -10.146 -23.070 -0.493 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -12.534 -23.546 -0.960 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -12.326 -22.837 0.659 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -12.929 -21.833 -0.681 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -10.999 -22.899 -2.816 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -11.383 -21.182 -2.546 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -9.690 -21.729 -2.524 1.00 0.00 H new ATOM 459 N GLU A 38 -11.280 -17.573 0.308 1.00 0.00 N ATOM 460 CA GLU A 38 -10.958 -16.384 1.148 1.00 0.00 C ATOM 461 C GLU A 38 -11.895 -16.351 2.356 1.00 0.00 C ATOM 462 O GLU A 38 -11.502 -15.998 3.450 1.00 0.00 O ATOM 463 CB GLU A 38 -11.141 -15.108 0.324 1.00 0.00 C ATOM 464 CG GLU A 38 -10.700 -13.899 1.152 1.00 0.00 C ATOM 465 CD GLU A 38 -9.179 -13.920 1.319 1.00 0.00 C ATOM 466 OE1 GLU A 38 -8.521 -14.530 0.492 1.00 0.00 O ATOM 467 OE2 GLU A 38 -8.699 -13.326 2.269 1.00 0.00 O ATOM 0 H GLU A 38 -11.551 -17.367 -0.654 1.00 0.00 H new ATOM 0 HA GLU A 38 -9.924 -16.447 1.488 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -10.555 -15.167 -0.593 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -12.185 -14.999 0.029 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -11.010 -12.976 0.661 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -11.184 -13.918 2.129 1.00 0.00 H new ATOM 474 N ASP A 39 -13.132 -16.717 2.167 1.00 0.00 N ATOM 475 CA ASP A 39 -14.093 -16.711 3.304 1.00 0.00 C ATOM 476 C ASP A 39 -14.514 -18.148 3.616 1.00 0.00 C ATOM 477 O ASP A 39 -15.592 -18.395 4.117 1.00 0.00 O ATOM 478 CB ASP A 39 -15.327 -15.887 2.926 1.00 0.00 C ATOM 479 CG ASP A 39 -14.911 -14.434 2.682 1.00 0.00 C ATOM 480 OD1 ASP A 39 -13.820 -14.074 3.093 1.00 0.00 O ATOM 481 OD2 ASP A 39 -15.690 -13.707 2.088 1.00 0.00 O ATOM 0 H ASP A 39 -13.519 -17.020 1.273 1.00 0.00 H new ATOM 0 HA ASP A 39 -13.619 -16.270 4.181 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -15.793 -16.299 2.031 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -16.069 -15.936 3.723 1.00 0.00 H new ATOM 486 N GLU A 40 -13.669 -19.097 3.320 1.00 0.00 N ATOM 487 CA GLU A 40 -14.019 -20.519 3.597 1.00 0.00 C ATOM 488 C GLU A 40 -13.039 -21.100 4.616 1.00 0.00 C ATOM 489 O GLU A 40 -12.249 -20.392 5.208 1.00 0.00 O ATOM 490 CB GLU A 40 -13.931 -21.326 2.301 1.00 0.00 C ATOM 491 CG GLU A 40 -14.878 -20.731 1.259 1.00 0.00 C ATOM 492 CD GLU A 40 -16.321 -20.848 1.756 1.00 0.00 C ATOM 493 OE1 GLU A 40 -16.547 -21.607 2.684 1.00 0.00 O ATOM 494 OE2 GLU A 40 -17.175 -20.177 1.199 1.00 0.00 O ATOM 0 H GLU A 40 -12.752 -18.950 2.899 1.00 0.00 H new ATOM 0 HA GLU A 40 -15.032 -20.569 3.995 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -12.908 -21.317 1.924 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -14.192 -22.367 2.491 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -14.628 -19.686 1.079 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -14.766 -21.254 0.309 1.00 0.00 H new ATOM 501 N ARG A 41 -13.083 -22.387 4.819 1.00 0.00 N ATOM 502 CA ARG A 41 -12.153 -23.023 5.795 1.00 0.00 C ATOM 503 C ARG A 41 -11.818 -24.438 5.321 1.00 0.00 C ATOM 504 O ARG A 41 -12.691 -25.204 4.960 1.00 0.00 O ATOM 505 CB ARG A 41 -12.820 -23.085 7.171 1.00 0.00 C ATOM 506 CG ARG A 41 -12.769 -21.700 7.821 1.00 0.00 C ATOM 507 CD ARG A 41 -13.113 -21.822 9.307 1.00 0.00 C ATOM 508 NE ARG A 41 -14.265 -20.932 9.624 1.00 0.00 N ATOM 509 CZ ARG A 41 -14.080 -19.647 9.758 1.00 0.00 C ATOM 510 NH1 ARG A 41 -13.054 -19.203 10.430 1.00 0.00 N ATOM 511 NH2 ARG A 41 -14.921 -18.807 9.220 1.00 0.00 N ATOM 0 H ARG A 41 -13.724 -23.028 4.351 1.00 0.00 H new ATOM 0 HA ARG A 41 -11.237 -22.436 5.866 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -13.854 -23.415 7.072 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -12.312 -23.814 7.802 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -11.776 -21.266 7.701 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -13.472 -21.029 7.328 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -13.360 -22.855 9.551 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -12.250 -21.549 9.915 1.00 0.00 H new ATOM 0 HE ARG A 41 -15.199 -21.327 9.736 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -12.397 -19.860 10.850 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -12.909 -18.199 10.535 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -15.723 -19.155 8.695 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -14.776 -17.803 9.325 1.00 0.00 H new ATOM 525 N PRO A 42 -10.524 -24.787 5.319 1.00 0.00 N ATOM 526 CA PRO A 42 -10.061 -26.110 4.882 1.00 0.00 C ATOM 527 C PRO A 42 -10.442 -27.207 5.880 1.00 0.00 C ATOM 528 O PRO A 42 -10.119 -27.134 7.050 1.00 0.00 O ATOM 529 CB PRO A 42 -8.541 -25.960 4.835 1.00 0.00 C ATOM 530 CG PRO A 42 -8.241 -24.860 5.796 1.00 0.00 C ATOM 531 CD PRO A 42 -9.412 -23.918 5.741 1.00 0.00 C ATOM 0 HA PRO A 42 -10.507 -26.403 3.931 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -8.042 -26.885 5.124 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -8.198 -25.713 3.830 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -8.104 -25.251 6.804 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -7.318 -24.348 5.525 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -9.605 -23.459 6.711 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -9.243 -23.107 5.032 1.00 0.00 H new ATOM 539 N ILE A 43 -11.121 -28.224 5.427 1.00 0.00 N ATOM 540 CA ILE A 43 -11.515 -29.324 6.352 1.00 0.00 C ATOM 541 C ILE A 43 -10.299 -30.210 6.630 1.00 0.00 C ATOM 542 O ILE A 43 -10.148 -30.755 7.706 1.00 0.00 O ATOM 543 CB ILE A 43 -12.624 -30.162 5.712 1.00 0.00 C ATOM 544 CG1 ILE A 43 -12.080 -30.868 4.468 1.00 0.00 C ATOM 545 CG2 ILE A 43 -13.786 -29.250 5.314 1.00 0.00 C ATOM 546 CD1 ILE A 43 -13.114 -31.874 3.962 1.00 0.00 C ATOM 0 H ILE A 43 -11.420 -28.341 4.459 1.00 0.00 H new ATOM 0 HA ILE A 43 -11.880 -28.900 7.287 1.00 0.00 H new ATOM 0 HB ILE A 43 -12.974 -30.907 6.427 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -11.856 -30.138 3.690 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -11.146 -31.378 4.705 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -14.577 -29.846 4.858 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -14.175 -28.748 6.200 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -13.436 -28.505 4.600 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -12.728 -32.378 3.076 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -13.316 -32.611 4.740 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -14.037 -31.352 3.709 1.00 0.00 H new ATOM 558 N GLN A 44 -9.428 -30.355 5.669 1.00 0.00 N ATOM 559 CA GLN A 44 -8.220 -31.202 5.876 1.00 0.00 C ATOM 560 C GLN A 44 -7.044 -30.608 5.098 1.00 0.00 C ATOM 561 O GLN A 44 -7.197 -29.658 4.356 1.00 0.00 O ATOM 562 CB GLN A 44 -8.499 -32.622 5.378 1.00 0.00 C ATOM 563 CG GLN A 44 -9.557 -33.276 6.269 1.00 0.00 C ATOM 564 CD GLN A 44 -9.848 -34.690 5.762 1.00 0.00 C ATOM 565 OE1 GLN A 44 -9.560 -35.012 4.627 1.00 0.00 O ATOM 566 NE2 GLN A 44 -10.411 -35.553 6.562 1.00 0.00 N ATOM 0 H GLN A 44 -9.501 -29.923 4.748 1.00 0.00 H new ATOM 0 HA GLN A 44 -7.975 -31.234 6.938 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -8.845 -32.595 4.345 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -7.582 -33.211 5.392 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -9.207 -33.313 7.300 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -10.470 -32.681 6.264 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -10.653 -35.282 7.515 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -10.609 -36.498 6.234 1.00 0.00 H new ATOM 575 N THR A 45 -5.872 -31.157 5.262 1.00 0.00 N ATOM 576 CA THR A 45 -4.691 -30.618 4.531 1.00 0.00 C ATOM 577 C THR A 45 -4.099 -31.709 3.637 1.00 0.00 C ATOM 578 O THR A 45 -4.326 -32.885 3.841 1.00 0.00 O ATOM 579 CB THR A 45 -3.636 -30.155 5.539 1.00 0.00 C ATOM 580 OG1 THR A 45 -3.096 -31.285 6.210 1.00 0.00 O ATOM 581 CG2 THR A 45 -4.280 -29.214 6.558 1.00 0.00 C ATOM 0 H THR A 45 -5.681 -31.954 5.869 1.00 0.00 H new ATOM 0 HA THR A 45 -5.001 -29.774 3.914 1.00 0.00 H new ATOM 0 HB THR A 45 -2.839 -29.628 5.015 1.00 0.00 H new ATOM 0 HG1 THR A 45 -2.419 -30.990 6.854 1.00 0.00 H new ATOM 0 HG21 THR A 45 -3.528 -28.885 7.275 1.00 0.00 H new ATOM 0 HG22 THR A 45 -4.694 -28.347 6.042 1.00 0.00 H new ATOM 0 HG23 THR A 45 -5.078 -29.738 7.084 1.00 0.00 H new ATOM 589 N MET A 46 -3.340 -31.328 2.646 1.00 0.00 N ATOM 590 CA MET A 46 -2.734 -32.342 1.738 1.00 0.00 C ATOM 591 C MET A 46 -1.262 -31.998 1.502 1.00 0.00 C ATOM 592 O MET A 46 -0.895 -30.846 1.378 1.00 0.00 O ATOM 593 CB MET A 46 -3.479 -32.339 0.401 1.00 0.00 C ATOM 594 CG MET A 46 -3.002 -33.516 -0.451 1.00 0.00 C ATOM 595 SD MET A 46 -3.738 -33.406 -2.100 1.00 0.00 S ATOM 596 CE MET A 46 -5.444 -33.760 -1.609 1.00 0.00 C ATOM 0 H MET A 46 -3.113 -30.358 2.426 1.00 0.00 H new ATOM 0 HA MET A 46 -2.809 -33.330 2.193 1.00 0.00 H new ATOM 0 HB2 MET A 46 -4.553 -32.411 0.571 1.00 0.00 H new ATOM 0 HB3 MET A 46 -3.302 -31.401 -0.124 1.00 0.00 H new ATOM 0 HG2 MET A 46 -1.915 -33.508 -0.525 1.00 0.00 H new ATOM 0 HG3 MET A 46 -3.282 -34.458 0.022 1.00 0.00 H new ATOM 0 HE1 MET A 46 -6.025 -34.040 -2.488 1.00 0.00 H new ATOM 0 HE2 MET A 46 -5.453 -34.580 -0.891 1.00 0.00 H new ATOM 0 HE3 MET A 46 -5.883 -32.873 -1.152 1.00 0.00 H new ATOM 606 N LEU A 47 -0.415 -32.989 1.438 1.00 0.00 N ATOM 607 CA LEU A 47 1.032 -32.718 1.209 1.00 0.00 C ATOM 608 C LEU A 47 1.330 -32.762 -0.292 1.00 0.00 C ATOM 609 O LEU A 47 0.926 -33.672 -0.987 1.00 0.00 O ATOM 610 CB LEU A 47 1.869 -33.778 1.926 1.00 0.00 C ATOM 611 CG LEU A 47 1.555 -33.751 3.424 1.00 0.00 C ATOM 612 CD1 LEU A 47 0.409 -34.721 3.723 1.00 0.00 C ATOM 613 CD2 LEU A 47 2.797 -34.169 4.214 1.00 0.00 C ATOM 0 H LEU A 47 -0.663 -33.974 1.534 1.00 0.00 H new ATOM 0 HA LEU A 47 1.282 -31.732 1.600 1.00 0.00 H new ATOM 0 HB2 LEU A 47 1.653 -34.765 1.516 1.00 0.00 H new ATOM 0 HB3 LEU A 47 2.930 -33.590 1.763 1.00 0.00 H new ATOM 0 HG LEU A 47 1.262 -32.742 3.715 1.00 0.00 H new ATOM 0 HD11 LEU A 47 0.185 -34.702 4.790 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -0.476 -34.423 3.161 1.00 0.00 H new ATOM 0 HD13 LEU A 47 0.701 -35.730 3.431 1.00 0.00 H new ATOM 0 HD21 LEU A 47 2.573 -34.150 5.281 1.00 0.00 H new ATOM 0 HD22 LEU A 47 3.091 -35.177 3.923 1.00 0.00 H new ATOM 0 HD23 LEU A 47 3.613 -33.478 4.002 1.00 0.00 H new ATOM 625 N ILE A 48 2.036 -31.786 -0.794 1.00 0.00 N ATOM 626 CA ILE A 48 2.360 -31.773 -2.249 1.00 0.00 C ATOM 627 C ILE A 48 3.880 -31.781 -2.429 1.00 0.00 C ATOM 628 O ILE A 48 4.595 -31.033 -1.794 1.00 0.00 O ATOM 629 CB ILE A 48 1.777 -30.512 -2.891 1.00 0.00 C ATOM 630 CG1 ILE A 48 0.258 -30.502 -2.709 1.00 0.00 C ATOM 631 CG2 ILE A 48 2.111 -30.500 -4.384 1.00 0.00 C ATOM 632 CD1 ILE A 48 -0.314 -29.194 -3.261 1.00 0.00 C ATOM 0 H ILE A 48 2.402 -30.998 -0.260 1.00 0.00 H new ATOM 0 HA ILE A 48 1.931 -32.654 -2.726 1.00 0.00 H new ATOM 0 HB ILE A 48 2.206 -29.630 -2.415 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -0.186 -31.352 -3.226 1.00 0.00 H new ATOM 0 HG13 ILE A 48 0.007 -30.604 -1.653 1.00 0.00 H new ATOM 0 HG21 ILE A 48 1.696 -29.602 -4.842 1.00 0.00 H new ATOM 0 HG22 ILE A 48 3.193 -30.507 -4.515 1.00 0.00 H new ATOM 0 HG23 ILE A 48 1.682 -31.382 -4.860 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -1.396 -29.187 -3.131 1.00 0.00 H new ATOM 0 HD12 ILE A 48 0.121 -28.351 -2.724 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -0.075 -29.111 -4.321 1.00 0.00 H new ATOM 644 N LYS A 49 4.380 -32.624 -3.291 1.00 0.00 N ATOM 645 CA LYS A 49 5.853 -32.680 -3.509 1.00 0.00 C ATOM 646 C LYS A 49 6.170 -32.319 -4.962 1.00 0.00 C ATOM 647 O LYS A 49 5.592 -32.859 -5.884 1.00 0.00 O ATOM 648 CB LYS A 49 6.358 -34.094 -3.212 1.00 0.00 C ATOM 649 CG LYS A 49 7.886 -34.115 -3.277 1.00 0.00 C ATOM 650 CD LYS A 49 8.384 -35.545 -3.055 1.00 0.00 C ATOM 651 CE LYS A 49 9.912 -35.546 -2.971 1.00 0.00 C ATOM 652 NZ LYS A 49 10.373 -36.810 -2.332 1.00 0.00 N ATOM 0 H LYS A 49 3.833 -33.276 -3.853 1.00 0.00 H new ATOM 0 HA LYS A 49 6.346 -31.970 -2.844 1.00 0.00 H new ATOM 0 HB2 LYS A 49 6.021 -34.412 -2.225 1.00 0.00 H new ATOM 0 HB3 LYS A 49 5.943 -34.799 -3.933 1.00 0.00 H new ATOM 0 HG2 LYS A 49 8.225 -33.746 -4.245 1.00 0.00 H new ATOM 0 HG3 LYS A 49 8.302 -33.451 -2.519 1.00 0.00 H new ATOM 0 HD2 LYS A 49 7.958 -35.951 -2.137 1.00 0.00 H new ATOM 0 HD3 LYS A 49 8.054 -36.187 -3.871 1.00 0.00 H new ATOM 0 HE2 LYS A 49 10.342 -35.452 -3.968 1.00 0.00 H new ATOM 0 HE3 LYS A 49 10.256 -34.688 -2.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 11.411 -36.811 -2.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 9.973 -36.881 -1.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 10.057 -37.622 -2.900 1.00 0.00 H new ATOM 666 N THR A 50 7.083 -31.411 -5.172 1.00 0.00 N ATOM 667 CA THR A 50 7.435 -31.018 -6.566 1.00 0.00 C ATOM 668 C THR A 50 8.932 -31.229 -6.794 1.00 0.00 C ATOM 669 O THR A 50 9.653 -31.650 -5.911 1.00 0.00 O ATOM 670 CB THR A 50 7.095 -29.543 -6.783 1.00 0.00 C ATOM 671 OG1 THR A 50 7.286 -28.831 -5.567 1.00 0.00 O ATOM 672 CG2 THR A 50 5.640 -29.411 -7.231 1.00 0.00 C ATOM 0 H THR A 50 7.600 -30.925 -4.440 1.00 0.00 H new ATOM 0 HA THR A 50 6.868 -31.631 -7.267 1.00 0.00 H new ATOM 0 HB THR A 50 7.747 -29.130 -7.553 1.00 0.00 H new ATOM 0 HG1 THR A 50 8.105 -29.144 -5.130 1.00 0.00 H new ATOM 0 HG21 THR A 50 5.401 -28.359 -7.385 1.00 0.00 H new ATOM 0 HG22 THR A 50 5.496 -29.956 -8.164 1.00 0.00 H new ATOM 0 HG23 THR A 50 4.984 -29.824 -6.464 1.00 0.00 H new ATOM 680 N ILE A 51 9.406 -30.936 -7.974 1.00 0.00 N ATOM 681 CA ILE A 51 10.856 -31.115 -8.260 1.00 0.00 C ATOM 682 C ILE A 51 11.659 -30.069 -7.484 1.00 0.00 C ATOM 683 O ILE A 51 12.623 -30.382 -6.815 1.00 0.00 O ATOM 684 CB ILE A 51 11.102 -30.939 -9.761 1.00 0.00 C ATOM 685 CG1 ILE A 51 10.566 -32.158 -10.514 1.00 0.00 C ATOM 686 CG2 ILE A 51 12.604 -30.802 -10.019 1.00 0.00 C ATOM 687 CD1 ILE A 51 10.675 -31.916 -12.021 1.00 0.00 C ATOM 0 H ILE A 51 8.851 -30.580 -8.752 1.00 0.00 H new ATOM 0 HA ILE A 51 11.169 -32.113 -7.955 1.00 0.00 H new ATOM 0 HB ILE A 51 10.589 -30.043 -10.109 1.00 0.00 H new ATOM 0 HG12 ILE A 51 11.131 -33.048 -10.236 1.00 0.00 H new ATOM 0 HG13 ILE A 51 9.527 -32.341 -10.239 1.00 0.00 H new ATOM 0 HG21 ILE A 51 12.780 -30.677 -11.087 1.00 0.00 H new ATOM 0 HG22 ILE A 51 12.987 -29.933 -9.484 1.00 0.00 H new ATOM 0 HG23 ILE A 51 13.116 -31.698 -9.670 1.00 0.00 H new ATOM 0 HD11 ILE A 51 10.293 -32.785 -12.558 1.00 0.00 H new ATOM 0 HD12 ILE A 51 10.091 -31.037 -12.291 1.00 0.00 H new ATOM 0 HD13 ILE A 51 11.719 -31.754 -12.289 1.00 0.00 H new ATOM 699 N HIS A 52 11.267 -28.827 -7.569 1.00 0.00 N ATOM 700 CA HIS A 52 12.006 -27.760 -6.837 1.00 0.00 C ATOM 701 C HIS A 52 12.040 -28.095 -5.346 1.00 0.00 C ATOM 702 O HIS A 52 13.049 -27.934 -4.687 1.00 0.00 O ATOM 703 CB HIS A 52 11.298 -26.419 -7.044 1.00 0.00 C ATOM 704 CG HIS A 52 11.313 -26.063 -8.505 1.00 0.00 C ATOM 705 ND1 HIS A 52 10.431 -25.144 -9.051 1.00 0.00 N ATOM 706 CD2 HIS A 52 12.099 -26.493 -9.546 1.00 0.00 C ATOM 707 CE1 HIS A 52 10.704 -25.052 -10.366 1.00 0.00 C ATOM 708 NE2 HIS A 52 11.712 -25.854 -10.720 1.00 0.00 N ATOM 0 H HIS A 52 10.467 -28.505 -8.114 1.00 0.00 H new ATOM 0 HA HIS A 52 13.026 -27.696 -7.217 1.00 0.00 H new ATOM 0 HB2 HIS A 52 10.271 -26.479 -6.684 1.00 0.00 H new ATOM 0 HB3 HIS A 52 11.794 -25.641 -6.464 1.00 0.00 H new ATOM 0 HD2 HIS A 52 12.896 -27.217 -9.466 1.00 0.00 H new ATOM 0 HE1 HIS A 52 10.173 -24.408 -11.051 1.00 0.00 H new ATOM 0 HE2 HIS A 52 12.112 -25.972 -11.651 1.00 0.00 H new ATOM 716 N GLY A 53 10.947 -28.558 -4.805 1.00 0.00 N ATOM 717 CA GLY A 53 10.919 -28.902 -3.356 1.00 0.00 C ATOM 718 C GLY A 53 9.540 -29.453 -2.988 1.00 0.00 C ATOM 719 O GLY A 53 8.725 -29.735 -3.844 1.00 0.00 O ATOM 0 H GLY A 53 10.071 -28.713 -5.305 1.00 0.00 H new ATOM 0 HA2 GLY A 53 11.689 -29.640 -3.132 1.00 0.00 H new ATOM 0 HA3 GLY A 53 11.141 -28.018 -2.757 1.00 0.00 H new ATOM 723 N GLU A 54 9.271 -29.609 -1.720 1.00 0.00 N ATOM 724 CA GLU A 54 7.946 -30.142 -1.300 1.00 0.00 C ATOM 725 C GLU A 54 7.129 -29.025 -0.647 1.00 0.00 C ATOM 726 O GLU A 54 7.619 -28.291 0.188 1.00 0.00 O ATOM 727 CB GLU A 54 8.147 -31.278 -0.296 1.00 0.00 C ATOM 728 CG GLU A 54 6.798 -31.935 0.007 1.00 0.00 C ATOM 729 CD GLU A 54 6.971 -32.963 1.126 1.00 0.00 C ATOM 730 OE1 GLU A 54 8.085 -33.111 1.602 1.00 0.00 O ATOM 731 OE2 GLU A 54 5.987 -33.587 1.487 1.00 0.00 O ATOM 0 H GLU A 54 9.912 -29.390 -0.958 1.00 0.00 H new ATOM 0 HA GLU A 54 7.414 -30.519 -2.174 1.00 0.00 H new ATOM 0 HB2 GLU A 54 8.841 -32.016 -0.699 1.00 0.00 H new ATOM 0 HB3 GLU A 54 8.590 -30.892 0.622 1.00 0.00 H new ATOM 0 HG2 GLU A 54 6.071 -31.178 0.303 1.00 0.00 H new ATOM 0 HG3 GLU A 54 6.408 -32.419 -0.888 1.00 0.00 H new ATOM 738 N LYS A 55 5.885 -28.893 -1.020 1.00 0.00 N ATOM 739 CA LYS A 55 5.036 -27.826 -0.419 1.00 0.00 C ATOM 740 C LYS A 55 3.745 -28.447 0.115 1.00 0.00 C ATOM 741 O LYS A 55 3.268 -29.444 -0.391 1.00 0.00 O ATOM 742 CB LYS A 55 4.696 -26.783 -1.486 1.00 0.00 C ATOM 743 CG LYS A 55 5.986 -26.135 -1.995 1.00 0.00 C ATOM 744 CD LYS A 55 5.640 -25.020 -2.983 1.00 0.00 C ATOM 745 CE LYS A 55 6.928 -24.435 -3.564 1.00 0.00 C ATOM 746 NZ LYS A 55 6.614 -23.183 -4.309 1.00 0.00 N ATOM 0 H LYS A 55 5.420 -29.478 -1.715 1.00 0.00 H new ATOM 0 HA LYS A 55 5.576 -27.347 0.398 1.00 0.00 H new ATOM 0 HB2 LYS A 55 4.162 -27.253 -2.312 1.00 0.00 H new ATOM 0 HB3 LYS A 55 4.034 -26.023 -1.070 1.00 0.00 H new ATOM 0 HG2 LYS A 55 6.557 -25.731 -1.159 1.00 0.00 H new ATOM 0 HG3 LYS A 55 6.615 -26.882 -2.479 1.00 0.00 H new ATOM 0 HD2 LYS A 55 5.012 -25.411 -3.784 1.00 0.00 H new ATOM 0 HD3 LYS A 55 5.068 -24.240 -2.481 1.00 0.00 H new ATOM 0 HE2 LYS A 55 7.638 -24.226 -2.764 1.00 0.00 H new ATOM 0 HE3 LYS A 55 7.400 -25.158 -4.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 7.490 -22.785 -4.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 5.951 -23.396 -5.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 6.182 -22.493 -3.662 1.00 0.00 H new ATOM 760 N GLN A 56 3.174 -27.869 1.135 1.00 0.00 N ATOM 761 CA GLN A 56 1.914 -28.430 1.699 1.00 0.00 C ATOM 762 C GLN A 56 0.769 -27.439 1.477 1.00 0.00 C ATOM 763 O GLN A 56 0.944 -26.241 1.576 1.00 0.00 O ATOM 764 CB GLN A 56 2.091 -28.675 3.199 1.00 0.00 C ATOM 765 CG GLN A 56 3.119 -29.788 3.416 1.00 0.00 C ATOM 766 CD GLN A 56 3.259 -30.068 4.913 1.00 0.00 C ATOM 767 OE1 GLN A 56 2.444 -30.911 5.486 1.00 0.00 O flip ATOM 768 NE2 GLN A 56 4.118 -29.514 5.570 1.00 0.00 N flip ATOM 0 H GLN A 56 3.525 -27.033 1.602 1.00 0.00 H new ATOM 0 HA GLN A 56 1.682 -29.371 1.201 1.00 0.00 H new ATOM 0 HB2 GLN A 56 2.420 -27.760 3.691 1.00 0.00 H new ATOM 0 HB3 GLN A 56 1.138 -28.953 3.648 1.00 0.00 H new ATOM 0 HG2 GLN A 56 2.807 -30.692 2.894 1.00 0.00 H new ATOM 0 HG3 GLN A 56 4.082 -29.495 2.998 1.00 0.00 H new ATOM 0 HE21 GLN A 56 4.756 -28.855 5.124 1.00 0.00 H new ATOM 0 HE22 GLN A 56 4.201 -29.708 6.568 1.00 0.00 H new ATOM 777 N GLN A 57 -0.402 -27.931 1.178 1.00 0.00 N ATOM 778 CA GLN A 57 -1.558 -27.019 0.949 1.00 0.00 C ATOM 779 C GLN A 57 -2.779 -27.548 1.706 1.00 0.00 C ATOM 780 O GLN A 57 -2.785 -28.661 2.190 1.00 0.00 O ATOM 781 CB GLN A 57 -1.869 -26.953 -0.547 1.00 0.00 C ATOM 782 CG GLN A 57 -0.668 -26.367 -1.289 1.00 0.00 C ATOM 783 CD GLN A 57 -1.032 -26.144 -2.758 1.00 0.00 C ATOM 784 OE1 GLN A 57 -1.966 -26.873 -3.304 1.00 0.00 O flip ATOM 785 NE2 GLN A 57 -0.459 -25.297 -3.416 1.00 0.00 N flip ATOM 0 H GLN A 57 -0.608 -28.925 1.082 1.00 0.00 H new ATOM 0 HA GLN A 57 -1.312 -26.020 1.309 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -2.095 -27.949 -0.927 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -2.752 -26.338 -0.719 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -0.369 -25.424 -0.831 1.00 0.00 H new ATOM 0 HG3 GLN A 57 0.184 -27.043 -1.213 1.00 0.00 H new ATOM 0 HE21 GLN A 57 0.271 -24.727 -2.989 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -0.709 -25.156 -4.395 1.00 0.00 H new ATOM 794 N ASP A 58 -3.812 -26.757 1.815 1.00 0.00 N ATOM 795 CA ASP A 58 -5.026 -27.218 2.546 1.00 0.00 C ATOM 796 C ASP A 58 -6.148 -27.514 1.550 1.00 0.00 C ATOM 797 O ASP A 58 -6.230 -26.917 0.495 1.00 0.00 O ATOM 798 CB ASP A 58 -5.482 -26.128 3.516 1.00 0.00 C ATOM 799 CG ASP A 58 -4.358 -25.823 4.509 1.00 0.00 C ATOM 800 OD1 ASP A 58 -3.468 -26.648 4.636 1.00 0.00 O ATOM 801 OD2 ASP A 58 -4.407 -24.771 5.124 1.00 0.00 O ATOM 0 H ASP A 58 -3.867 -25.814 1.430 1.00 0.00 H new ATOM 0 HA ASP A 58 -4.788 -28.125 3.101 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -5.750 -25.226 2.966 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -6.375 -26.452 4.050 1.00 0.00 H new ATOM 806 N VAL A 59 -7.018 -28.429 1.880 1.00 0.00 N ATOM 807 CA VAL A 59 -8.140 -28.762 0.960 1.00 0.00 C ATOM 808 C VAL A 59 -9.415 -28.074 1.452 1.00 0.00 C ATOM 809 O VAL A 59 -9.577 -27.820 2.629 1.00 0.00 O ATOM 810 CB VAL A 59 -8.351 -30.276 0.939 1.00 0.00 C ATOM 811 CG1 VAL A 59 -7.028 -30.972 0.612 1.00 0.00 C ATOM 812 CG2 VAL A 59 -8.845 -30.741 2.310 1.00 0.00 C ATOM 0 H VAL A 59 -6.999 -28.961 2.750 1.00 0.00 H new ATOM 0 HA VAL A 59 -7.903 -28.417 -0.047 1.00 0.00 H new ATOM 0 HB VAL A 59 -9.092 -30.528 0.180 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -7.179 -32.051 0.597 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -6.675 -30.641 -0.365 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -6.287 -30.720 1.370 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -8.996 -31.820 2.296 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -8.104 -30.488 3.069 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -9.788 -30.246 2.544 1.00 0.00 H new ATOM 822 N TYR A 60 -10.321 -27.768 0.566 1.00 0.00 N ATOM 823 CA TYR A 60 -11.580 -27.095 0.994 1.00 0.00 C ATOM 824 C TYR A 60 -12.785 -27.822 0.392 1.00 0.00 C ATOM 825 O TYR A 60 -12.902 -27.956 -0.810 1.00 0.00 O ATOM 826 CB TYR A 60 -11.577 -25.644 0.510 1.00 0.00 C ATOM 827 CG TYR A 60 -10.551 -24.847 1.280 1.00 0.00 C ATOM 828 CD1 TYR A 60 -9.191 -25.162 1.169 1.00 0.00 C ATOM 829 CD2 TYR A 60 -10.961 -23.791 2.102 1.00 0.00 C ATOM 830 CE1 TYR A 60 -8.241 -24.420 1.883 1.00 0.00 C ATOM 831 CE2 TYR A 60 -10.011 -23.050 2.815 1.00 0.00 C ATOM 832 CZ TYR A 60 -8.652 -23.365 2.705 1.00 0.00 C ATOM 833 OH TYR A 60 -7.715 -22.634 3.408 1.00 0.00 O ATOM 0 H TYR A 60 -10.245 -27.954 -0.434 1.00 0.00 H new ATOM 0 HA TYR A 60 -11.645 -27.119 2.082 1.00 0.00 H new ATOM 0 HB2 TYR A 60 -11.353 -25.608 -0.556 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -12.566 -25.205 0.643 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -8.875 -25.976 0.534 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -12.010 -23.548 2.186 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -7.192 -24.662 1.799 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -10.327 -22.235 3.450 1.00 0.00 H new ATOM 0 HH TYR A 60 -8.124 -21.805 3.733 1.00 0.00 H new ATOM 843 N TYR A 61 -13.686 -28.281 1.214 1.00 0.00 N ATOM 844 CA TYR A 61 -14.887 -28.983 0.681 1.00 0.00 C ATOM 845 C TYR A 61 -15.949 -27.944 0.323 1.00 0.00 C ATOM 846 O TYR A 61 -16.521 -27.308 1.186 1.00 0.00 O ATOM 847 CB TYR A 61 -15.439 -29.937 1.741 1.00 0.00 C ATOM 848 CG TYR A 61 -16.474 -30.840 1.114 1.00 0.00 C ATOM 849 CD1 TYR A 61 -17.807 -30.422 1.031 1.00 0.00 C ATOM 850 CD2 TYR A 61 -16.101 -32.094 0.616 1.00 0.00 C ATOM 851 CE1 TYR A 61 -18.769 -31.259 0.449 1.00 0.00 C ATOM 852 CE2 TYR A 61 -17.062 -32.931 0.035 1.00 0.00 C ATOM 853 CZ TYR A 61 -18.395 -32.513 -0.048 1.00 0.00 C ATOM 854 OH TYR A 61 -19.342 -33.337 -0.623 1.00 0.00 O ATOM 0 H TYR A 61 -13.644 -28.201 2.230 1.00 0.00 H new ATOM 0 HA TYR A 61 -14.616 -29.556 -0.206 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -14.631 -30.532 2.166 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -15.883 -29.371 2.560 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -18.094 -29.455 1.415 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -15.072 -32.416 0.680 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -19.798 -30.937 0.384 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -16.774 -33.899 -0.349 1.00 0.00 H new ATOM 0 HH TYR A 61 -18.916 -34.169 -0.917 1.00 0.00 H new ATOM 864 N LEU A 62 -16.210 -27.751 -0.942 1.00 0.00 N ATOM 865 CA LEU A 62 -17.227 -26.734 -1.337 1.00 0.00 C ATOM 866 C LEU A 62 -18.299 -27.370 -2.225 1.00 0.00 C ATOM 867 O LEU A 62 -18.177 -28.499 -2.661 1.00 0.00 O ATOM 868 CB LEU A 62 -16.540 -25.602 -2.104 1.00 0.00 C ATOM 869 CG LEU A 62 -15.349 -25.088 -1.294 1.00 0.00 C ATOM 870 CD1 LEU A 62 -14.630 -23.990 -2.081 1.00 0.00 C ATOM 871 CD2 LEU A 62 -15.845 -24.518 0.037 1.00 0.00 C ATOM 0 H LEU A 62 -15.767 -28.249 -1.714 1.00 0.00 H new ATOM 0 HA LEU A 62 -17.701 -26.340 -0.438 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -16.205 -25.959 -3.078 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -17.246 -24.792 -2.287 1.00 0.00 H new ATOM 0 HG LEU A 62 -14.659 -25.910 -1.104 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -13.781 -23.624 -1.503 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -14.276 -24.394 -3.029 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -15.320 -23.168 -2.272 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -14.996 -24.152 0.615 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -16.536 -23.697 -0.154 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -16.356 -25.299 0.599 1.00 0.00 H new ATOM 883 N THR A 63 -19.349 -26.641 -2.497 1.00 0.00 N ATOM 884 CA THR A 63 -20.442 -27.176 -3.357 1.00 0.00 C ATOM 885 C THR A 63 -20.528 -26.340 -4.634 1.00 0.00 C ATOM 886 O THR A 63 -20.765 -25.149 -4.591 1.00 0.00 O ATOM 887 CB THR A 63 -21.771 -27.086 -2.604 1.00 0.00 C ATOM 888 OG1 THR A 63 -21.684 -27.834 -1.400 1.00 0.00 O ATOM 889 CG2 THR A 63 -22.895 -27.647 -3.478 1.00 0.00 C ATOM 0 H THR A 63 -19.496 -25.691 -2.157 1.00 0.00 H new ATOM 0 HA THR A 63 -20.236 -28.216 -3.609 1.00 0.00 H new ATOM 0 HB THR A 63 -21.985 -26.044 -2.368 1.00 0.00 H new ATOM 0 HG1 THR A 63 -22.534 -27.776 -0.916 1.00 0.00 H new ATOM 0 HG21 THR A 63 -23.841 -27.582 -2.940 1.00 0.00 H new ATOM 0 HG22 THR A 63 -22.962 -27.070 -4.400 1.00 0.00 H new ATOM 0 HG23 THR A 63 -22.684 -28.689 -3.717 1.00 0.00 H new ATOM 897 N PHE A 64 -20.335 -26.947 -5.773 1.00 0.00 N ATOM 898 CA PHE A 64 -20.407 -26.172 -7.044 1.00 0.00 C ATOM 899 C PHE A 64 -21.205 -26.959 -8.086 1.00 0.00 C ATOM 900 O PHE A 64 -21.282 -28.171 -8.041 1.00 0.00 O ATOM 901 CB PHE A 64 -18.992 -25.920 -7.569 1.00 0.00 C ATOM 902 CG PHE A 64 -18.269 -27.236 -7.724 1.00 0.00 C ATOM 903 CD1 PHE A 64 -17.785 -27.905 -6.593 1.00 0.00 C ATOM 904 CD2 PHE A 64 -18.080 -27.786 -8.997 1.00 0.00 C ATOM 905 CE1 PHE A 64 -17.114 -29.126 -6.736 1.00 0.00 C ATOM 906 CE2 PHE A 64 -17.407 -29.006 -9.139 1.00 0.00 C ATOM 907 CZ PHE A 64 -16.925 -29.675 -8.009 1.00 0.00 C ATOM 0 H PHE A 64 -20.132 -27.941 -5.879 1.00 0.00 H new ATOM 0 HA PHE A 64 -20.902 -25.219 -6.856 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -19.035 -25.402 -8.527 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -18.448 -25.273 -6.881 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -17.929 -27.480 -5.611 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -18.453 -27.270 -9.869 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -16.743 -29.644 -5.864 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -17.260 -29.430 -10.121 1.00 0.00 H new ATOM 0 HZ PHE A 64 -16.407 -30.616 -8.119 1.00 0.00 H new ATOM 917 N LYS A 65 -21.800 -26.275 -9.026 1.00 0.00 N ATOM 918 CA LYS A 65 -22.592 -26.978 -10.074 1.00 0.00 C ATOM 919 C LYS A 65 -21.686 -27.306 -11.261 1.00 0.00 C ATOM 920 O LYS A 65 -21.017 -26.446 -11.801 1.00 0.00 O ATOM 921 CB LYS A 65 -23.735 -26.072 -10.540 1.00 0.00 C ATOM 922 CG LYS A 65 -24.652 -25.755 -9.357 1.00 0.00 C ATOM 923 CD LYS A 65 -25.829 -24.903 -9.837 1.00 0.00 C ATOM 924 CE LYS A 65 -26.628 -24.411 -8.628 1.00 0.00 C ATOM 925 NZ LYS A 65 -27.642 -25.435 -8.250 1.00 0.00 N ATOM 0 H LYS A 65 -21.771 -25.259 -9.113 1.00 0.00 H new ATOM 0 HA LYS A 65 -23.002 -27.901 -9.664 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -23.334 -25.150 -10.960 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -24.302 -26.562 -11.332 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -25.017 -26.679 -8.909 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -24.096 -25.224 -8.584 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -25.465 -24.054 -10.416 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -26.470 -25.488 -10.497 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -25.958 -24.221 -7.789 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -27.120 -23.467 -8.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -28.184 -25.100 -7.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -28.288 -25.596 -9.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -27.163 -26.326 -8.008 1.00 0.00 H new ATOM 939 N VAL A 66 -21.656 -28.544 -11.673 1.00 0.00 N ATOM 940 CA VAL A 66 -20.792 -28.924 -12.826 1.00 0.00 C ATOM 941 C VAL A 66 -21.648 -29.058 -14.087 1.00 0.00 C ATOM 942 O VAL A 66 -22.325 -30.047 -14.286 1.00 0.00 O ATOM 943 CB VAL A 66 -20.109 -30.261 -12.528 1.00 0.00 C ATOM 944 CG1 VAL A 66 -19.052 -30.544 -13.599 1.00 0.00 C ATOM 945 CG2 VAL A 66 -19.438 -30.196 -11.154 1.00 0.00 C ATOM 0 H VAL A 66 -22.192 -29.308 -11.261 1.00 0.00 H new ATOM 0 HA VAL A 66 -20.036 -28.154 -12.983 1.00 0.00 H new ATOM 0 HB VAL A 66 -20.853 -31.058 -12.532 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -18.565 -31.496 -13.387 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -19.529 -30.590 -14.578 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -18.308 -29.747 -13.595 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -18.951 -31.148 -10.941 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -18.694 -29.399 -11.150 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -20.190 -29.994 -10.391 1.00 0.00 H new ATOM 955 N GLN A 67 -21.625 -28.070 -14.939 1.00 0.00 N ATOM 956 CA GLN A 67 -22.437 -28.143 -16.186 1.00 0.00 C ATOM 957 C GLN A 67 -23.920 -28.212 -15.820 1.00 0.00 C ATOM 958 O GLN A 67 -24.710 -28.839 -16.499 1.00 0.00 O ATOM 959 CB GLN A 67 -22.046 -29.391 -16.980 1.00 0.00 C ATOM 960 CG GLN A 67 -20.571 -29.301 -17.374 1.00 0.00 C ATOM 961 CD GLN A 67 -20.172 -30.557 -18.152 1.00 0.00 C ATOM 962 OE1 GLN A 67 -20.860 -31.557 -18.107 1.00 0.00 O ATOM 963 NE2 GLN A 67 -19.080 -30.548 -18.868 1.00 0.00 N ATOM 0 H GLN A 67 -21.079 -27.216 -14.825 1.00 0.00 H new ATOM 0 HA GLN A 67 -22.252 -27.257 -16.794 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -22.220 -30.285 -16.382 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -22.667 -29.478 -17.871 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -20.400 -28.413 -17.983 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -19.951 -29.200 -16.483 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -18.502 -29.708 -18.906 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -18.805 -31.381 -19.389 1.00 0.00 H new ATOM 972 N GLY A 68 -24.305 -27.572 -14.750 1.00 0.00 N ATOM 973 CA GLY A 68 -25.735 -27.598 -14.338 1.00 0.00 C ATOM 974 C GLY A 68 -25.986 -28.816 -13.446 1.00 0.00 C ATOM 975 O GLY A 68 -27.092 -29.309 -13.347 1.00 0.00 O ATOM 0 H GLY A 68 -23.689 -27.031 -14.143 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -25.987 -26.683 -13.802 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -26.377 -27.639 -15.218 1.00 0.00 H new ATOM 979 N ARG A 69 -24.966 -29.306 -12.795 1.00 0.00 N ATOM 980 CA ARG A 69 -25.146 -30.491 -11.910 1.00 0.00 C ATOM 981 C ARG A 69 -24.600 -30.171 -10.516 1.00 0.00 C ATOM 982 O ARG A 69 -23.436 -29.869 -10.351 1.00 0.00 O ATOM 983 CB ARG A 69 -24.387 -31.684 -12.493 1.00 0.00 C ATOM 984 CG ARG A 69 -24.977 -32.048 -13.859 1.00 0.00 C ATOM 985 CD ARG A 69 -24.296 -33.312 -14.387 1.00 0.00 C ATOM 986 NE ARG A 69 -24.772 -33.592 -15.771 1.00 0.00 N ATOM 987 CZ ARG A 69 -23.914 -33.896 -16.706 1.00 0.00 C ATOM 988 NH1 ARG A 69 -23.021 -33.022 -17.083 1.00 0.00 N ATOM 989 NH2 ARG A 69 -23.950 -35.076 -17.265 1.00 0.00 N ATOM 0 H ARG A 69 -24.016 -28.937 -12.838 1.00 0.00 H new ATOM 0 HA ARG A 69 -26.206 -30.735 -11.840 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -23.329 -31.441 -12.595 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -24.454 -32.537 -11.817 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -26.051 -32.210 -13.772 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -24.835 -31.225 -14.560 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -23.214 -33.184 -14.382 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -24.520 -34.157 -13.736 1.00 0.00 H new ATOM 0 HE ARG A 69 -25.768 -33.546 -15.987 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -22.993 -32.100 -16.647 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -22.351 -33.261 -17.814 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -24.648 -35.759 -16.971 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -23.280 -35.315 -17.996 1.00 0.00 H new ATOM 1003 N LYS A 70 -25.432 -30.235 -9.513 1.00 0.00 N ATOM 1004 CA LYS A 70 -24.958 -29.935 -8.133 1.00 0.00 C ATOM 1005 C LYS A 70 -23.970 -31.017 -7.688 1.00 0.00 C ATOM 1006 O LYS A 70 -24.316 -32.175 -7.571 1.00 0.00 O ATOM 1007 CB LYS A 70 -26.152 -29.910 -7.177 1.00 0.00 C ATOM 1008 CG LYS A 70 -25.710 -29.349 -5.824 1.00 0.00 C ATOM 1009 CD LYS A 70 -26.893 -29.367 -4.853 1.00 0.00 C ATOM 1010 CE LYS A 70 -26.471 -28.732 -3.526 1.00 0.00 C ATOM 1011 NZ LYS A 70 -27.295 -29.298 -2.420 1.00 0.00 N ATOM 0 H LYS A 70 -26.419 -30.482 -9.590 1.00 0.00 H new ATOM 0 HA LYS A 70 -24.464 -28.964 -8.121 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -26.952 -29.297 -7.593 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -26.553 -30.916 -7.052 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -24.888 -29.942 -5.423 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -25.340 -28.331 -5.944 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -27.735 -28.821 -5.278 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -27.227 -30.391 -4.689 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -25.414 -28.921 -3.340 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -26.598 -27.650 -3.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -27.009 -28.867 -1.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -28.300 -29.096 -2.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -27.152 -30.327 -2.372 1.00 0.00 H new ATOM 1025 N VAL A 71 -22.743 -30.649 -7.437 1.00 0.00 N ATOM 1026 CA VAL A 71 -21.737 -31.657 -7.001 1.00 0.00 C ATOM 1027 C VAL A 71 -20.834 -31.046 -5.929 1.00 0.00 C ATOM 1028 O VAL A 71 -20.317 -29.958 -6.085 1.00 0.00 O ATOM 1029 CB VAL A 71 -20.892 -32.086 -8.203 1.00 0.00 C ATOM 1030 CG1 VAL A 71 -19.778 -33.026 -7.738 1.00 0.00 C ATOM 1031 CG2 VAL A 71 -21.781 -32.811 -9.216 1.00 0.00 C ATOM 0 H VAL A 71 -22.394 -29.694 -7.515 1.00 0.00 H new ATOM 0 HA VAL A 71 -22.248 -32.527 -6.589 1.00 0.00 H new ATOM 0 HB VAL A 71 -20.451 -31.205 -8.669 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -19.177 -33.330 -8.595 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -19.145 -32.511 -7.016 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -20.217 -33.908 -7.271 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -21.181 -33.117 -10.073 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -22.222 -33.691 -8.749 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -22.574 -32.141 -9.549 1.00 0.00 H new ATOM 1041 N GLU A 72 -20.643 -31.735 -4.837 1.00 0.00 N ATOM 1042 CA GLU A 72 -19.778 -31.192 -3.752 1.00 0.00 C ATOM 1043 C GLU A 72 -18.505 -32.030 -3.644 1.00 0.00 C ATOM 1044 O GLU A 72 -18.546 -33.245 -3.672 1.00 0.00 O ATOM 1045 CB GLU A 72 -20.533 -31.243 -2.423 1.00 0.00 C ATOM 1046 CG GLU A 72 -21.906 -30.594 -2.597 1.00 0.00 C ATOM 1047 CD GLU A 72 -22.805 -30.975 -1.419 1.00 0.00 C ATOM 1048 OE1 GLU A 72 -22.439 -31.881 -0.689 1.00 0.00 O ATOM 1049 OE2 GLU A 72 -23.844 -30.353 -1.267 1.00 0.00 O ATOM 0 H GLU A 72 -21.049 -32.652 -4.649 1.00 0.00 H new ATOM 0 HA GLU A 72 -19.515 -30.160 -3.983 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -20.645 -32.276 -2.095 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -19.967 -30.723 -1.650 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -21.803 -29.510 -2.654 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -22.358 -30.921 -3.533 1.00 0.00 H new ATOM 1056 N ALA A 73 -17.374 -31.394 -3.521 1.00 0.00 N ATOM 1057 CA ALA A 73 -16.102 -32.162 -3.413 1.00 0.00 C ATOM 1058 C ALA A 73 -15.012 -31.278 -2.804 1.00 0.00 C ATOM 1059 O ALA A 73 -15.150 -30.074 -2.715 1.00 0.00 O ATOM 1060 CB ALA A 73 -15.663 -32.619 -4.806 1.00 0.00 C ATOM 0 H ALA A 73 -17.275 -30.379 -3.491 1.00 0.00 H new ATOM 0 HA ALA A 73 -16.261 -33.031 -2.774 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -14.732 -33.181 -4.728 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -16.435 -33.254 -5.241 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -15.509 -31.748 -5.443 1.00 0.00 H new ATOM 1066 N GLU A 74 -13.925 -31.870 -2.389 1.00 0.00 N ATOM 1067 CA GLU A 74 -12.819 -31.072 -1.792 1.00 0.00 C ATOM 1068 C GLU A 74 -11.989 -30.446 -2.913 1.00 0.00 C ATOM 1069 O GLU A 74 -11.670 -31.091 -3.893 1.00 0.00 O ATOM 1070 CB GLU A 74 -11.927 -31.984 -0.948 1.00 0.00 C ATOM 1071 CG GLU A 74 -12.747 -32.588 0.194 1.00 0.00 C ATOM 1072 CD GLU A 74 -11.834 -33.429 1.088 1.00 0.00 C ATOM 1073 OE1 GLU A 74 -10.685 -33.616 0.719 1.00 0.00 O ATOM 1074 OE2 GLU A 74 -12.297 -33.871 2.126 1.00 0.00 O ATOM 0 H GLU A 74 -13.756 -32.875 -2.438 1.00 0.00 H new ATOM 0 HA GLU A 74 -13.235 -30.287 -1.160 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -11.509 -32.777 -1.568 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -11.087 -31.418 -0.546 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -13.216 -31.796 0.778 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -13.550 -33.206 -0.208 1.00 0.00 H new ATOM 1081 N VAL A 75 -11.636 -29.198 -2.781 1.00 0.00 N ATOM 1082 CA VAL A 75 -10.828 -28.542 -3.846 1.00 0.00 C ATOM 1083 C VAL A 75 -9.536 -27.988 -3.245 1.00 0.00 C ATOM 1084 O VAL A 75 -9.509 -27.533 -2.118 1.00 0.00 O ATOM 1085 CB VAL A 75 -11.627 -27.396 -4.468 1.00 0.00 C ATOM 1086 CG1 VAL A 75 -12.902 -27.950 -5.109 1.00 0.00 C ATOM 1087 CG2 VAL A 75 -12.000 -26.383 -3.383 1.00 0.00 C ATOM 0 H VAL A 75 -11.871 -28.606 -1.985 1.00 0.00 H new ATOM 0 HA VAL A 75 -10.587 -29.277 -4.614 1.00 0.00 H new ATOM 0 HB VAL A 75 -11.021 -26.905 -5.230 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -13.471 -27.133 -5.552 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -12.637 -28.669 -5.884 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -13.507 -28.443 -4.348 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -12.569 -25.567 -3.828 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -12.604 -26.873 -2.620 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -11.092 -25.986 -2.928 1.00 0.00 H new ATOM 1097 N LEU A 76 -8.466 -28.016 -3.990 1.00 0.00 N ATOM 1098 CA LEU A 76 -7.178 -27.484 -3.463 1.00 0.00 C ATOM 1099 C LEU A 76 -7.067 -25.998 -3.818 1.00 0.00 C ATOM 1100 O LEU A 76 -7.495 -25.570 -4.871 1.00 0.00 O ATOM 1101 CB LEU A 76 -6.012 -28.250 -4.092 1.00 0.00 C ATOM 1102 CG LEU A 76 -6.111 -29.730 -3.716 1.00 0.00 C ATOM 1103 CD1 LEU A 76 -5.049 -30.523 -4.480 1.00 0.00 C ATOM 1104 CD2 LEU A 76 -5.883 -29.890 -2.212 1.00 0.00 C ATOM 0 H LEU A 76 -8.428 -28.384 -4.941 1.00 0.00 H new ATOM 0 HA LEU A 76 -7.145 -27.606 -2.380 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -6.032 -28.137 -5.176 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -5.064 -27.839 -3.746 1.00 0.00 H new ATOM 0 HG LEU A 76 -7.101 -30.105 -3.976 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -5.119 -31.577 -4.212 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -5.211 -30.409 -5.552 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -4.059 -30.148 -4.221 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -5.953 -30.944 -1.943 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -4.893 -29.515 -1.952 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -6.640 -29.325 -1.667 1.00 0.00 H new ATOM 1116 N ALA A 77 -6.499 -25.206 -2.949 1.00 0.00 N ATOM 1117 CA ALA A 77 -6.369 -23.751 -3.245 1.00 0.00 C ATOM 1118 C ALA A 77 -5.186 -23.527 -4.189 1.00 0.00 C ATOM 1119 O ALA A 77 -4.124 -24.092 -4.015 1.00 0.00 O ATOM 1120 CB ALA A 77 -6.141 -22.980 -1.944 1.00 0.00 C ATOM 0 H ALA A 77 -6.120 -25.503 -2.050 1.00 0.00 H new ATOM 0 HA ALA A 77 -7.284 -23.394 -3.718 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -6.046 -21.916 -2.163 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -6.986 -23.139 -1.274 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -5.228 -23.335 -1.466 1.00 0.00 H new ATOM 1126 N SER A 78 -5.362 -22.710 -5.192 1.00 0.00 N ATOM 1127 CA SER A 78 -4.251 -22.453 -6.152 1.00 0.00 C ATOM 1128 C SER A 78 -4.290 -20.988 -6.600 1.00 0.00 C ATOM 1129 O SER A 78 -5.336 -20.373 -6.648 1.00 0.00 O ATOM 1130 CB SER A 78 -4.416 -23.368 -7.366 1.00 0.00 C ATOM 1131 OG SER A 78 -3.168 -23.515 -8.026 1.00 0.00 O ATOM 0 H SER A 78 -6.228 -22.209 -5.388 1.00 0.00 H new ATOM 0 HA SER A 78 -3.294 -22.655 -5.670 1.00 0.00 H new ATOM 0 HB2 SER A 78 -4.789 -24.343 -7.051 1.00 0.00 H new ATOM 0 HB3 SER A 78 -5.154 -22.950 -8.051 1.00 0.00 H new ATOM 0 HG SER A 78 -3.126 -22.900 -8.788 1.00 0.00 H new ATOM 1137 N PRO A 79 -3.119 -20.421 -6.933 1.00 0.00 N ATOM 1138 CA PRO A 79 -3.012 -19.024 -7.378 1.00 0.00 C ATOM 1139 C PRO A 79 -3.566 -18.820 -8.794 1.00 0.00 C ATOM 1140 O PRO A 79 -3.457 -17.751 -9.360 1.00 0.00 O ATOM 1141 CB PRO A 79 -1.508 -18.761 -7.369 1.00 0.00 C ATOM 1142 CG PRO A 79 -0.883 -20.105 -7.542 1.00 0.00 C ATOM 1143 CD PRO A 79 -1.810 -21.097 -6.897 1.00 0.00 C ATOM 0 HA PRO A 79 -3.585 -18.353 -6.739 1.00 0.00 H new ATOM 0 HB2 PRO A 79 -1.220 -18.085 -8.174 1.00 0.00 H new ATOM 0 HB3 PRO A 79 -1.194 -18.296 -6.435 1.00 0.00 H new ATOM 0 HG2 PRO A 79 -0.744 -20.335 -8.599 1.00 0.00 H new ATOM 0 HG3 PRO A 79 0.102 -20.137 -7.077 1.00 0.00 H new ATOM 0 HD2 PRO A 79 -1.831 -22.040 -7.443 1.00 0.00 H new ATOM 0 HD3 PRO A 79 -1.505 -21.326 -5.876 1.00 0.00 H new ATOM 1151 N TYR A 80 -4.156 -19.831 -9.372 1.00 0.00 N ATOM 1152 CA TYR A 80 -4.709 -19.680 -10.750 1.00 0.00 C ATOM 1153 C TYR A 80 -5.954 -18.791 -10.707 1.00 0.00 C ATOM 1154 O TYR A 80 -6.490 -18.506 -9.656 1.00 0.00 O ATOM 1155 CB TYR A 80 -5.083 -21.055 -11.306 1.00 0.00 C ATOM 1156 CG TYR A 80 -3.837 -21.898 -11.437 1.00 0.00 C ATOM 1157 CD1 TYR A 80 -2.918 -21.633 -12.459 1.00 0.00 C ATOM 1158 CD2 TYR A 80 -3.602 -22.944 -10.537 1.00 0.00 C ATOM 1159 CE1 TYR A 80 -1.763 -22.414 -12.581 1.00 0.00 C ATOM 1160 CE2 TYR A 80 -2.447 -23.725 -10.658 1.00 0.00 C ATOM 1161 CZ TYR A 80 -1.527 -23.460 -11.679 1.00 0.00 C ATOM 1162 OH TYR A 80 -0.387 -24.230 -11.799 1.00 0.00 O ATOM 0 H TYR A 80 -4.279 -20.752 -8.952 1.00 0.00 H new ATOM 0 HA TYR A 80 -3.957 -19.222 -11.393 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -5.799 -21.544 -10.645 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -5.567 -20.948 -12.277 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -3.100 -20.826 -13.153 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -4.312 -23.148 -9.749 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -1.054 -22.211 -13.370 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -2.266 -24.532 -9.964 1.00 0.00 H new ATOM 0 HH TYR A 80 -0.376 -24.911 -11.094 1.00 0.00 H new ATOM 1172 N ASP A 81 -6.418 -18.351 -11.846 1.00 0.00 N ATOM 1173 CA ASP A 81 -7.627 -17.481 -11.871 1.00 0.00 C ATOM 1174 C ASP A 81 -8.817 -18.269 -12.423 1.00 0.00 C ATOM 1175 O ASP A 81 -9.817 -17.704 -12.819 1.00 0.00 O ATOM 1176 CB ASP A 81 -7.363 -16.266 -12.763 1.00 0.00 C ATOM 1177 CG ASP A 81 -6.398 -15.313 -12.056 1.00 0.00 C ATOM 1178 OD1 ASP A 81 -6.123 -15.538 -10.889 1.00 0.00 O ATOM 1179 OD2 ASP A 81 -5.951 -14.374 -12.694 1.00 0.00 O ATOM 0 H ASP A 81 -6.012 -18.557 -12.759 1.00 0.00 H new ATOM 0 HA ASP A 81 -7.853 -17.148 -10.858 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -6.942 -16.586 -13.716 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -8.299 -15.754 -12.984 1.00 0.00 H new ATOM 1184 N TYR A 82 -8.721 -19.570 -12.450 1.00 0.00 N ATOM 1185 CA TYR A 82 -9.852 -20.386 -12.975 1.00 0.00 C ATOM 1186 C TYR A 82 -10.074 -21.597 -12.066 1.00 0.00 C ATOM 1187 O TYR A 82 -9.608 -21.636 -10.944 1.00 0.00 O ATOM 1188 CB TYR A 82 -9.527 -20.856 -14.396 1.00 0.00 C ATOM 1189 CG TYR A 82 -8.485 -21.948 -14.348 1.00 0.00 C ATOM 1190 CD1 TYR A 82 -7.153 -21.633 -14.054 1.00 0.00 C ATOM 1191 CD2 TYR A 82 -8.851 -23.274 -14.599 1.00 0.00 C ATOM 1192 CE1 TYR A 82 -6.187 -22.646 -14.011 1.00 0.00 C ATOM 1193 CE2 TYR A 82 -7.887 -24.287 -14.556 1.00 0.00 C ATOM 1194 CZ TYR A 82 -6.555 -23.974 -14.262 1.00 0.00 C ATOM 1195 OH TYR A 82 -5.604 -24.974 -14.219 1.00 0.00 O ATOM 0 H TYR A 82 -7.911 -20.102 -12.132 1.00 0.00 H new ATOM 0 HA TYR A 82 -10.759 -19.782 -12.995 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -10.430 -21.224 -14.883 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -9.163 -20.019 -14.991 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -6.870 -20.609 -13.860 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -9.879 -23.516 -14.826 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -5.159 -22.404 -13.785 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -8.171 -25.311 -14.750 1.00 0.00 H new ATOM 0 HH TYR A 82 -4.902 -24.731 -13.580 1.00 0.00 H new ATOM 1205 N ILE A 83 -10.787 -22.584 -12.535 1.00 0.00 N ATOM 1206 CA ILE A 83 -11.040 -23.784 -11.689 1.00 0.00 C ATOM 1207 C ILE A 83 -10.646 -25.049 -12.455 1.00 0.00 C ATOM 1208 O ILE A 83 -10.643 -25.080 -13.669 1.00 0.00 O ATOM 1209 CB ILE A 83 -12.527 -23.857 -11.331 1.00 0.00 C ATOM 1210 CG1 ILE A 83 -13.035 -22.468 -10.935 1.00 0.00 C ATOM 1211 CG2 ILE A 83 -12.719 -24.821 -10.160 1.00 0.00 C ATOM 1212 CD1 ILE A 83 -14.500 -22.325 -11.354 1.00 0.00 C ATOM 0 H ILE A 83 -11.204 -22.611 -13.465 1.00 0.00 H new ATOM 0 HA ILE A 83 -10.446 -23.709 -10.778 1.00 0.00 H new ATOM 0 HB ILE A 83 -13.089 -24.212 -12.195 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -12.937 -22.326 -9.859 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -12.431 -21.697 -11.414 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -13.777 -24.875 -9.903 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -12.363 -25.812 -10.442 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -12.154 -24.464 -9.299 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -14.864 -21.337 -11.073 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -14.583 -22.449 -12.434 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -15.097 -23.087 -10.854 1.00 0.00 H new ATOM 1224 N LEU A 84 -10.323 -26.098 -11.750 1.00 0.00 N ATOM 1225 CA LEU A 84 -9.937 -27.367 -12.429 1.00 0.00 C ATOM 1226 C LEU A 84 -10.947 -28.454 -12.064 1.00 0.00 C ATOM 1227 O LEU A 84 -11.291 -28.628 -10.911 1.00 0.00 O ATOM 1228 CB LEU A 84 -8.545 -27.795 -11.963 1.00 0.00 C ATOM 1229 CG LEU A 84 -7.500 -26.822 -12.511 1.00 0.00 C ATOM 1230 CD1 LEU A 84 -6.603 -26.341 -11.370 1.00 0.00 C ATOM 1231 CD2 LEU A 84 -6.648 -27.530 -13.565 1.00 0.00 C ATOM 0 H LEU A 84 -10.310 -26.131 -10.731 1.00 0.00 H new ATOM 0 HA LEU A 84 -9.927 -27.216 -13.508 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -8.504 -27.813 -10.874 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -8.330 -28.807 -12.307 1.00 0.00 H new ATOM 0 HG LEU A 84 -8.002 -25.967 -12.964 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -5.858 -25.648 -11.760 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -7.210 -25.836 -10.618 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -6.101 -27.196 -10.917 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -5.903 -26.837 -13.956 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -6.146 -28.385 -13.113 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -7.287 -27.873 -14.379 1.00 0.00 H new ATOM 1243 N LEU A 85 -11.429 -29.187 -13.028 1.00 0.00 N ATOM 1244 CA LEU A 85 -12.417 -30.255 -12.715 1.00 0.00 C ATOM 1245 C LEU A 85 -11.703 -31.604 -12.622 1.00 0.00 C ATOM 1246 O LEU A 85 -11.060 -32.044 -13.553 1.00 0.00 O ATOM 1247 CB LEU A 85 -13.488 -30.316 -13.814 1.00 0.00 C ATOM 1248 CG LEU A 85 -14.026 -28.911 -14.156 1.00 0.00 C ATOM 1249 CD1 LEU A 85 -13.784 -27.928 -13.003 1.00 0.00 C ATOM 1250 CD2 LEU A 85 -13.327 -28.396 -15.416 1.00 0.00 C ATOM 0 H LEU A 85 -11.183 -29.094 -14.014 1.00 0.00 H new ATOM 0 HA LEU A 85 -12.895 -30.030 -11.761 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -13.067 -30.774 -14.709 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -14.310 -30.952 -13.487 1.00 0.00 H new ATOM 0 HG LEU A 85 -15.101 -28.985 -14.323 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -14.174 -26.947 -13.274 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -14.292 -28.286 -12.107 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -12.714 -27.852 -12.808 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -13.704 -27.403 -15.661 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -12.253 -28.343 -15.240 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -13.526 -29.075 -16.245 1.00 0.00 H new ATOM 1262 N ASN A 86 -11.820 -32.265 -11.503 1.00 0.00 N ATOM 1263 CA ASN A 86 -11.156 -33.589 -11.344 1.00 0.00 C ATOM 1264 C ASN A 86 -12.002 -34.660 -12.037 1.00 0.00 C ATOM 1265 O ASN A 86 -13.216 -34.618 -12.003 1.00 0.00 O ATOM 1266 CB ASN A 86 -11.033 -33.914 -9.853 1.00 0.00 C ATOM 1267 CG ASN A 86 -9.955 -34.980 -9.647 1.00 0.00 C ATOM 1268 OD1 ASN A 86 -8.808 -34.775 -9.995 1.00 0.00 O ATOM 1269 ND2 ASN A 86 -10.276 -36.115 -9.092 1.00 0.00 N ATOM 0 H ASN A 86 -12.348 -31.945 -10.691 1.00 0.00 H new ATOM 0 HA ASN A 86 -10.163 -33.564 -11.792 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -10.779 -33.013 -9.294 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -11.989 -34.270 -9.468 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -9.565 -36.832 -8.949 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -11.238 -36.286 -8.800 1.00 0.00 H new ATOM 1276 N PRO A 87 -11.349 -35.640 -12.680 1.00 0.00 N ATOM 1277 CA PRO A 87 -12.047 -36.725 -13.383 1.00 0.00 C ATOM 1278 C PRO A 87 -12.792 -37.643 -12.409 1.00 0.00 C ATOM 1279 O PRO A 87 -13.740 -38.311 -12.772 1.00 0.00 O ATOM 1280 CB PRO A 87 -10.915 -37.490 -14.072 1.00 0.00 C ATOM 1281 CG PRO A 87 -9.711 -37.189 -13.248 1.00 0.00 C ATOM 1282 CD PRO A 87 -9.884 -35.776 -12.772 1.00 0.00 C ATOM 0 HA PRO A 87 -12.803 -36.350 -14.073 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -11.119 -38.560 -14.102 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -10.783 -37.162 -15.103 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -9.631 -37.878 -12.407 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -8.799 -37.295 -13.835 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -9.401 -35.612 -11.809 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -9.454 -35.058 -13.471 1.00 0.00 H new ATOM 1290 N SER A 88 -12.372 -37.678 -11.175 1.00 0.00 N ATOM 1291 CA SER A 88 -13.058 -38.547 -10.178 1.00 0.00 C ATOM 1292 C SER A 88 -14.323 -37.846 -9.679 1.00 0.00 C ATOM 1293 O SER A 88 -15.319 -38.476 -9.385 1.00 0.00 O ATOM 1294 CB SER A 88 -12.121 -38.807 -8.998 1.00 0.00 C ATOM 1295 OG SER A 88 -12.052 -37.646 -8.182 1.00 0.00 O ATOM 0 H SER A 88 -11.583 -37.142 -10.814 1.00 0.00 H new ATOM 0 HA SER A 88 -13.326 -39.495 -10.644 1.00 0.00 H new ATOM 0 HB2 SER A 88 -12.481 -39.654 -8.414 1.00 0.00 H new ATOM 0 HB3 SER A 88 -11.127 -39.069 -9.360 1.00 0.00 H new ATOM 0 HG SER A 88 -11.452 -37.813 -7.425 1.00 0.00 H new ATOM 1301 N ASP A 89 -14.290 -36.545 -9.581 1.00 0.00 N ATOM 1302 CA ASP A 89 -15.489 -35.802 -9.100 1.00 0.00 C ATOM 1303 C ASP A 89 -16.544 -35.764 -10.207 1.00 0.00 C ATOM 1304 O ASP A 89 -17.729 -35.702 -9.946 1.00 0.00 O ATOM 1305 CB ASP A 89 -15.087 -34.372 -8.729 1.00 0.00 C ATOM 1306 CG ASP A 89 -14.755 -33.586 -9.999 1.00 0.00 C ATOM 1307 OD1 ASP A 89 -15.635 -33.444 -10.833 1.00 0.00 O ATOM 1308 OD2 ASP A 89 -13.626 -33.138 -10.116 1.00 0.00 O ATOM 0 H ASP A 89 -13.484 -35.964 -9.813 1.00 0.00 H new ATOM 0 HA ASP A 89 -15.900 -36.303 -8.224 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -15.898 -33.884 -8.189 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -14.224 -34.387 -8.063 1.00 0.00 H new ATOM 1313 N VAL A 90 -16.125 -35.799 -11.442 1.00 0.00 N ATOM 1314 CA VAL A 90 -17.107 -35.764 -12.562 1.00 0.00 C ATOM 1315 C VAL A 90 -16.928 -37.002 -13.442 1.00 0.00 C ATOM 1316 O VAL A 90 -16.336 -36.941 -14.501 1.00 0.00 O ATOM 1317 CB VAL A 90 -16.877 -34.505 -13.402 1.00 0.00 C ATOM 1318 CG1 VAL A 90 -17.437 -33.287 -12.664 1.00 0.00 C ATOM 1319 CG2 VAL A 90 -15.377 -34.315 -13.636 1.00 0.00 C ATOM 0 H VAL A 90 -15.146 -35.850 -11.724 1.00 0.00 H new ATOM 0 HA VAL A 90 -18.118 -35.752 -12.155 1.00 0.00 H new ATOM 0 HB VAL A 90 -17.384 -34.612 -14.361 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -17.273 -32.391 -13.263 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -18.506 -33.422 -12.498 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -16.932 -33.179 -11.704 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -15.213 -33.419 -14.234 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -14.870 -34.209 -12.677 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -14.978 -35.181 -14.164 1.00 0.00 H new ATOM 1329 N PRO A 91 -17.457 -38.148 -12.989 1.00 0.00 N ATOM 1330 CA PRO A 91 -17.362 -39.411 -13.731 1.00 0.00 C ATOM 1331 C PRO A 91 -18.256 -39.409 -14.976 1.00 0.00 C ATOM 1332 O PRO A 91 -18.024 -40.138 -15.919 1.00 0.00 O ATOM 1333 CB PRO A 91 -17.865 -40.451 -12.733 1.00 0.00 C ATOM 1334 CG PRO A 91 -18.752 -39.690 -11.805 1.00 0.00 C ATOM 1335 CD PRO A 91 -18.184 -38.301 -11.718 1.00 0.00 C ATOM 0 HA PRO A 91 -16.350 -39.598 -14.090 1.00 0.00 H new ATOM 0 HB2 PRO A 91 -18.410 -41.250 -13.235 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -17.038 -40.917 -12.197 1.00 0.00 H new ATOM 0 HG2 PRO A 91 -19.776 -39.668 -12.177 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -18.780 -40.160 -10.822 1.00 0.00 H new ATOM 0 HD2 PRO A 91 -18.969 -37.552 -11.612 1.00 0.00 H new ATOM 0 HD3 PRO A 91 -17.521 -38.191 -10.860 1.00 0.00 H new ATOM 1343 N TRP A 92 -19.279 -38.596 -14.982 1.00 0.00 N ATOM 1344 CA TRP A 92 -20.188 -38.552 -16.162 1.00 0.00 C ATOM 1345 C TRP A 92 -19.526 -37.756 -17.291 1.00 0.00 C ATOM 1346 O TRP A 92 -19.716 -38.041 -18.456 1.00 0.00 O ATOM 1347 CB TRP A 92 -21.503 -37.877 -15.767 1.00 0.00 C ATOM 1348 CG TRP A 92 -21.222 -36.509 -15.234 1.00 0.00 C ATOM 1349 CD1 TRP A 92 -21.104 -35.390 -15.987 1.00 0.00 C ATOM 1350 CD2 TRP A 92 -21.023 -36.093 -13.851 1.00 0.00 C ATOM 1351 NE1 TRP A 92 -20.845 -34.316 -15.154 1.00 0.00 N ATOM 1352 CE2 TRP A 92 -20.785 -34.698 -13.829 1.00 0.00 C ATOM 1353 CE3 TRP A 92 -21.025 -36.785 -12.626 1.00 0.00 C ATOM 1354 CZ2 TRP A 92 -20.558 -34.014 -12.633 1.00 0.00 C ATOM 1355 CZ3 TRP A 92 -20.797 -36.099 -11.421 1.00 0.00 C ATOM 1356 CH2 TRP A 92 -20.564 -34.717 -11.425 1.00 0.00 C ATOM 0 H TRP A 92 -19.523 -37.962 -14.221 1.00 0.00 H new ATOM 0 HA TRP A 92 -20.387 -39.568 -16.503 1.00 0.00 H new ATOM 0 HB2 TRP A 92 -22.165 -37.813 -16.631 1.00 0.00 H new ATOM 0 HB3 TRP A 92 -22.018 -38.473 -15.014 1.00 0.00 H new ATOM 0 HD1 TRP A 92 -21.197 -35.343 -17.062 1.00 0.00 H new ATOM 0 HE1 TRP A 92 -20.714 -33.358 -15.480 1.00 0.00 H new ATOM 0 HE3 TRP A 92 -21.203 -37.850 -12.612 1.00 0.00 H new ATOM 0 HZ2 TRP A 92 -20.379 -32.949 -12.641 1.00 0.00 H new ATOM 0 HZ3 TRP A 92 -20.801 -36.640 -10.486 1.00 0.00 H new ATOM 0 HH2 TRP A 92 -20.389 -34.196 -10.495 1.00 0.00 H new ATOM 1367 N LEU A 93 -18.750 -36.763 -16.954 1.00 0.00 N ATOM 1368 CA LEU A 93 -18.078 -35.952 -18.009 1.00 0.00 C ATOM 1369 C LEU A 93 -17.271 -36.874 -18.926 1.00 0.00 C ATOM 1370 O LEU A 93 -17.119 -36.616 -20.104 1.00 0.00 O ATOM 1371 CB LEU A 93 -17.139 -34.939 -17.352 1.00 0.00 C ATOM 1372 CG LEU A 93 -16.573 -34.001 -18.419 1.00 0.00 C ATOM 1373 CD1 LEU A 93 -17.719 -33.424 -19.254 1.00 0.00 C ATOM 1374 CD2 LEU A 93 -15.811 -32.860 -17.742 1.00 0.00 C ATOM 0 H LEU A 93 -18.552 -36.478 -15.995 1.00 0.00 H new ATOM 0 HA LEU A 93 -18.830 -35.424 -18.595 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -17.677 -34.366 -16.597 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -16.328 -35.457 -16.841 1.00 0.00 H new ATOM 0 HG LEU A 93 -15.896 -34.557 -19.068 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -17.315 -32.756 -20.014 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -18.262 -34.236 -19.737 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -18.397 -32.869 -18.606 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -15.407 -32.191 -18.502 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -16.488 -32.305 -17.093 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -14.994 -33.270 -17.148 1.00 0.00 H new ATOM 1386 N MET A 94 -16.750 -37.947 -18.396 1.00 0.00 N ATOM 1387 CA MET A 94 -15.951 -38.882 -19.238 1.00 0.00 C ATOM 1388 C MET A 94 -16.890 -39.858 -19.951 1.00 0.00 C ATOM 1389 O MET A 94 -17.654 -40.568 -19.327 1.00 0.00 O ATOM 1390 CB MET A 94 -14.981 -39.665 -18.351 1.00 0.00 C ATOM 1391 CG MET A 94 -13.936 -38.710 -17.772 1.00 0.00 C ATOM 1392 SD MET A 94 -12.647 -39.662 -16.931 1.00 0.00 S ATOM 1393 CE MET A 94 -13.719 -40.474 -15.719 1.00 0.00 C ATOM 0 H MET A 94 -16.843 -38.216 -17.417 1.00 0.00 H new ATOM 0 HA MET A 94 -15.389 -38.313 -19.978 1.00 0.00 H new ATOM 0 HB2 MET A 94 -15.525 -40.158 -17.545 1.00 0.00 H new ATOM 0 HB3 MET A 94 -14.492 -40.448 -18.931 1.00 0.00 H new ATOM 0 HG2 MET A 94 -13.497 -38.108 -18.568 1.00 0.00 H new ATOM 0 HG3 MET A 94 -14.407 -38.019 -17.073 1.00 0.00 H new ATOM 0 HE1 MET A 94 -13.165 -40.637 -14.795 1.00 0.00 H new ATOM 0 HE2 MET A 94 -14.584 -39.842 -15.517 1.00 0.00 H new ATOM 0 HE3 MET A 94 -14.055 -41.433 -16.115 1.00 0.00 H new ATOM 1403 N LYS A 95 -16.840 -39.899 -21.254 1.00 0.00 N ATOM 1404 CA LYS A 95 -17.729 -40.829 -22.006 1.00 0.00 C ATOM 1405 C LYS A 95 -17.477 -42.264 -21.540 1.00 0.00 C ATOM 1406 O LYS A 95 -18.384 -43.066 -21.446 1.00 0.00 O ATOM 1407 CB LYS A 95 -17.433 -40.720 -23.502 1.00 0.00 C ATOM 1408 CG LYS A 95 -17.764 -39.308 -23.989 1.00 0.00 C ATOM 1409 CD LYS A 95 -17.592 -39.239 -25.507 1.00 0.00 C ATOM 1410 CE LYS A 95 -17.819 -37.803 -25.982 1.00 0.00 C ATOM 1411 NZ LYS A 95 -16.518 -37.205 -26.396 1.00 0.00 N ATOM 0 H LYS A 95 -16.222 -39.328 -21.831 1.00 0.00 H new ATOM 0 HA LYS A 95 -18.770 -40.564 -21.821 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -16.384 -40.945 -23.693 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -18.021 -41.453 -24.054 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -18.787 -39.048 -23.716 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -17.111 -38.582 -23.505 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -16.592 -39.572 -25.786 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -18.299 -39.910 -25.995 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -18.519 -37.791 -26.817 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -18.266 -37.211 -25.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -16.672 -36.229 -26.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -15.864 -37.203 -25.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -16.109 -37.766 -27.171 1.00 0.00 H new ATOM 1425 N LYS A 96 -16.248 -42.595 -21.250 1.00 0.00 N ATOM 1426 CA LYS A 96 -15.937 -43.979 -20.793 1.00 0.00 C ATOM 1427 C LYS A 96 -16.592 -44.228 -19.434 1.00 0.00 C ATOM 1428 O LYS A 96 -16.433 -43.457 -18.508 1.00 0.00 O ATOM 1429 CB LYS A 96 -14.421 -44.146 -20.668 1.00 0.00 C ATOM 1430 CG LYS A 96 -13.883 -43.163 -19.626 1.00 0.00 C ATOM 1431 CD LYS A 96 -12.365 -43.317 -19.515 1.00 0.00 C ATOM 1432 CE LYS A 96 -11.679 -42.185 -20.283 1.00 0.00 C ATOM 1433 NZ LYS A 96 -10.507 -41.696 -19.504 1.00 0.00 N ATOM 0 H LYS A 96 -15.446 -41.967 -21.310 1.00 0.00 H new ATOM 0 HA LYS A 96 -16.323 -44.696 -21.518 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -14.180 -45.168 -20.377 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -13.944 -43.968 -21.632 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -14.136 -42.141 -19.910 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -14.350 -43.350 -18.659 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -12.062 -43.296 -18.468 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -12.056 -44.282 -19.917 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -11.356 -42.539 -21.262 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -12.381 -41.369 -20.454 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -10.040 -40.927 -20.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -10.827 -41.343 -18.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -9.834 -42.476 -19.363 1.00 0.00 H new ATOM 1447 N PRO A 97 -17.343 -45.333 -19.316 1.00 0.00 N ATOM 1448 CA PRO A 97 -18.029 -45.698 -18.071 1.00 0.00 C ATOM 1449 C PRO A 97 -17.041 -46.122 -16.981 1.00 0.00 C ATOM 1450 O PRO A 97 -16.005 -46.695 -17.257 1.00 0.00 O ATOM 1451 CB PRO A 97 -18.901 -46.885 -18.476 1.00 0.00 C ATOM 1452 CG PRO A 97 -18.211 -47.468 -19.664 1.00 0.00 C ATOM 1453 CD PRO A 97 -17.583 -46.312 -20.390 1.00 0.00 C ATOM 0 HA PRO A 97 -18.591 -44.862 -17.654 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -18.982 -47.612 -17.668 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -19.914 -46.567 -18.722 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -17.456 -48.193 -19.359 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -18.918 -47.994 -20.306 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -16.656 -46.602 -20.885 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -18.244 -45.912 -21.159 1.00 0.00 H new ATOM 1461 N LEU A 98 -17.352 -45.845 -15.743 1.00 0.00 N ATOM 1462 CA LEU A 98 -16.430 -46.233 -14.639 1.00 0.00 C ATOM 1463 C LEU A 98 -16.265 -47.754 -14.622 1.00 0.00 C ATOM 1464 O LEU A 98 -17.100 -48.485 -15.118 1.00 0.00 O ATOM 1465 CB LEU A 98 -17.012 -45.769 -13.302 1.00 0.00 C ATOM 1466 CG LEU A 98 -17.291 -44.266 -13.361 1.00 0.00 C ATOM 1467 CD1 LEU A 98 -17.736 -43.775 -11.982 1.00 0.00 C ATOM 1468 CD2 LEU A 98 -16.017 -43.528 -13.777 1.00 0.00 C ATOM 0 H LEU A 98 -18.204 -45.367 -15.450 1.00 0.00 H new ATOM 0 HA LEU A 98 -15.459 -45.764 -14.796 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -17.932 -46.312 -13.086 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -16.314 -45.989 -12.494 1.00 0.00 H new ATOM 0 HG LEU A 98 -18.079 -44.071 -14.088 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -17.935 -42.704 -12.024 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -18.643 -44.301 -11.684 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -16.948 -43.970 -11.255 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -16.214 -42.457 -13.819 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -15.229 -43.723 -13.049 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -15.698 -43.877 -14.759 1.00 0.00 H new TER 1480 LEU A 98