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 30 THR OG1 : rot 83:sc= 0.793 USER MOD Set 1.2: A 86 ASN : amide:sc= -6.6! C(o=-5.9!,f=-19!) USER MOD Set 1.3: A 88 SER OG : rot 180:sc= -0.0975 USER MOD Single : A 8 GLN : amide:sc= -0.0932 X(o=-0.093,f=-0.022) USER MOD Single : A 15 LYS NZ :NH3+ 144:sc= 0.0744 (180deg=0) USER MOD Single : A 17 THR OG1 : rot 77:sc= 0.0264 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 HIS :FLIP no HE2:sc= -1.41 F(o=-3.9!,f=-1.4) 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 31 CYS SG : rot 180:sc= -0.592 USER MOD Single : A 44 GLN : amide:sc= 0 K(o=0,f=-1.7!) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 MET CE :methyl -114:sc= -1.95! (180deg=-5.82!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 42:sc= 1.22 USER MOD Single : A 52 HIS : no HD1:sc= 0 X(o=0,f=-0.0058) USER MOD Single : A 55 LYS NZ :NH3+ -162:sc= -0.0215 (180deg=-0.27) USER MOD Single : A 56 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 57 GLN :FLIP amide:sc= -2.28! C(o=-3.4!,f=-2.3!) USER MOD Single : A 60 TYR OH : rot 30:sc= -0.452 USER MOD Single : A 61 TYR OH : rot 146:sc= -1.86! USER MOD Single : A 63 THR OG1 : rot 180:sc= -1.46! USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 GLN : amide:sc= -0.573 K(o=-0.57,f=-1.4!) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot -120:sc= -0.472! USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 TYR OH : rot 10:sc= -3.2 USER MOD Single : A 94 MET CE :methyl -149:sc= -0.288 (180deg=-1.99) 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 -11.652 -24.765 -24.751 1.00 0.00 N ATOM 2 CA GLN A 8 -13.096 -25.066 -24.534 1.00 0.00 C ATOM 3 C GLN A 8 -13.327 -25.419 -23.063 1.00 0.00 C ATOM 4 O GLN A 8 -13.491 -26.569 -22.709 1.00 0.00 O ATOM 5 CB GLN A 8 -13.509 -26.247 -25.414 1.00 0.00 C ATOM 6 CG GLN A 8 -14.489 -25.767 -26.486 1.00 0.00 C ATOM 7 CD GLN A 8 -13.757 -24.864 -27.483 1.00 0.00 C ATOM 8 OE1 GLN A 8 -14.157 -23.740 -27.710 1.00 0.00 O ATOM 9 NE2 GLN A 8 -12.693 -25.313 -28.092 1.00 0.00 N ATOM 0 HA GLN A 8 -13.693 -24.193 -24.796 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -12.630 -26.690 -25.882 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -13.972 -27.024 -24.805 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -14.924 -26.621 -27.005 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -15.312 -25.223 -26.023 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -12.357 -26.257 -27.902 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -12.198 -24.720 -28.758 1.00 0.00 H new ATOM 18 N PRO A 9 -13.343 -24.400 -22.192 1.00 0.00 N ATOM 19 CA PRO A 9 -13.554 -24.589 -20.751 1.00 0.00 C ATOM 20 C PRO A 9 -14.990 -25.018 -20.435 1.00 0.00 C ATOM 21 O PRO A 9 -15.921 -24.665 -21.130 1.00 0.00 O ATOM 22 CB PRO A 9 -13.281 -23.204 -20.164 1.00 0.00 C ATOM 23 CG PRO A 9 -13.549 -22.260 -21.288 1.00 0.00 C ATOM 24 CD PRO A 9 -13.155 -22.982 -22.545 1.00 0.00 C ATOM 0 HA PRO A 9 -12.915 -25.373 -20.345 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -13.929 -23.000 -19.312 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -12.253 -23.119 -19.811 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -14.601 -21.976 -21.316 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -12.974 -21.341 -21.170 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -13.780 -22.691 -23.389 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -12.123 -22.770 -22.824 1.00 0.00 H new ATOM 32 N LEU A 10 -15.175 -25.777 -19.390 1.00 0.00 N ATOM 33 CA LEU A 10 -16.548 -26.228 -19.028 1.00 0.00 C ATOM 34 C LEU A 10 -17.250 -25.132 -18.223 1.00 0.00 C ATOM 35 O LEU A 10 -16.716 -24.058 -18.024 1.00 0.00 O ATOM 36 CB LEU A 10 -16.460 -27.501 -18.183 1.00 0.00 C ATOM 37 CG LEU A 10 -15.735 -28.591 -18.975 1.00 0.00 C ATOM 38 CD1 LEU A 10 -15.885 -29.931 -18.252 1.00 0.00 C ATOM 39 CD2 LEU A 10 -16.343 -28.696 -20.374 1.00 0.00 C ATOM 0 H LEU A 10 -14.434 -26.105 -18.771 1.00 0.00 H new ATOM 0 HA LEU A 10 -17.114 -26.432 -19.937 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -15.928 -27.297 -17.254 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -17.460 -27.839 -17.910 1.00 0.00 H new ATOM 0 HG LEU A 10 -14.678 -28.338 -19.057 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -15.369 -30.708 -18.816 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -15.451 -29.857 -17.255 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -16.942 -30.184 -18.170 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -15.826 -29.473 -20.938 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -17.400 -28.949 -20.293 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -16.237 -27.742 -20.890 1.00 0.00 H new ATOM 51 N GLU A 11 -18.440 -25.393 -17.759 1.00 0.00 N ATOM 52 CA GLU A 11 -19.172 -24.365 -16.967 1.00 0.00 C ATOM 53 C GLU A 11 -19.322 -24.845 -15.522 1.00 0.00 C ATOM 54 O GLU A 11 -19.621 -25.995 -15.268 1.00 0.00 O ATOM 55 CB GLU A 11 -20.558 -24.142 -17.574 1.00 0.00 C ATOM 56 CG GLU A 11 -21.198 -22.906 -16.939 1.00 0.00 C ATOM 57 CD GLU A 11 -22.643 -22.771 -17.426 1.00 0.00 C ATOM 58 OE1 GLU A 11 -23.006 -23.487 -18.345 1.00 0.00 O ATOM 59 OE2 GLU A 11 -23.361 -21.956 -16.870 1.00 0.00 O ATOM 0 H GLU A 11 -18.937 -26.273 -17.894 1.00 0.00 H new ATOM 0 HA GLU A 11 -18.613 -23.430 -16.984 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -20.478 -24.010 -18.653 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -21.186 -25.017 -17.406 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -21.176 -22.990 -15.852 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -20.630 -22.014 -17.202 1.00 0.00 H new ATOM 66 N ALA A 12 -19.114 -23.975 -14.573 1.00 0.00 N ATOM 67 CA ALA A 12 -19.245 -24.384 -13.146 1.00 0.00 C ATOM 68 C ALA A 12 -19.763 -23.206 -12.320 1.00 0.00 C ATOM 69 O ALA A 12 -19.404 -22.068 -12.550 1.00 0.00 O ATOM 70 CB ALA A 12 -17.878 -24.818 -12.613 1.00 0.00 C ATOM 0 H ALA A 12 -18.859 -22.999 -14.723 1.00 0.00 H new ATOM 0 HA ALA A 12 -19.946 -25.215 -13.071 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -17.973 -25.117 -11.569 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -17.509 -25.659 -13.200 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -17.177 -23.987 -12.690 1.00 0.00 H new ATOM 76 N GLU A 13 -20.601 -23.469 -11.355 1.00 0.00 N ATOM 77 CA GLU A 13 -21.139 -22.366 -10.510 1.00 0.00 C ATOM 78 C GLU A 13 -20.669 -22.560 -9.068 1.00 0.00 C ATOM 79 O GLU A 13 -20.950 -23.564 -8.444 1.00 0.00 O ATOM 80 CB GLU A 13 -22.668 -22.385 -10.557 1.00 0.00 C ATOM 81 CG GLU A 13 -23.208 -21.022 -10.119 1.00 0.00 C ATOM 82 CD GLU A 13 -24.738 -21.064 -10.094 1.00 0.00 C ATOM 83 OE1 GLU A 13 -25.296 -21.973 -10.685 1.00 0.00 O ATOM 84 OE2 GLU A 13 -25.325 -20.186 -9.483 1.00 0.00 O ATOM 0 H GLU A 13 -20.937 -24.402 -11.115 1.00 0.00 H new ATOM 0 HA GLU A 13 -20.779 -21.408 -10.886 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -23.009 -22.616 -11.566 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -23.053 -23.168 -9.904 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -22.824 -20.767 -9.131 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -22.866 -20.246 -10.804 1.00 0.00 H new ATOM 91 N ILE A 14 -19.954 -21.610 -8.532 1.00 0.00 N ATOM 92 CA ILE A 14 -19.467 -21.746 -7.130 1.00 0.00 C ATOM 93 C ILE A 14 -20.182 -20.731 -6.238 1.00 0.00 C ATOM 94 O ILE A 14 -20.234 -19.555 -6.536 1.00 0.00 O ATOM 95 CB ILE A 14 -17.959 -21.491 -7.087 1.00 0.00 C ATOM 96 CG1 ILE A 14 -17.251 -22.457 -8.040 1.00 0.00 C ATOM 97 CG2 ILE A 14 -17.449 -21.713 -5.662 1.00 0.00 C ATOM 98 CD1 ILE A 14 -15.736 -22.284 -7.913 1.00 0.00 C ATOM 0 H ILE A 14 -19.686 -20.746 -9.003 1.00 0.00 H new ATOM 0 HA ILE A 14 -19.676 -22.754 -6.770 1.00 0.00 H new ATOM 0 HB ILE A 14 -17.753 -20.465 -7.392 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -17.531 -23.484 -7.807 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -17.564 -22.266 -9.066 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -16.375 -21.532 -5.628 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -17.954 -21.026 -4.983 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -17.654 -22.739 -5.358 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -15.233 -22.972 -8.592 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -15.464 -21.260 -8.168 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -15.430 -22.497 -6.889 1.00 0.00 H new ATOM 110 N LYS A 15 -20.734 -21.178 -5.143 1.00 0.00 N ATOM 111 CA LYS A 15 -21.445 -20.242 -4.231 1.00 0.00 C ATOM 112 C LYS A 15 -22.468 -19.427 -5.025 1.00 0.00 C ATOM 113 O LYS A 15 -22.848 -18.340 -4.635 1.00 0.00 O ATOM 114 CB LYS A 15 -20.434 -19.297 -3.582 1.00 0.00 C ATOM 115 CG LYS A 15 -19.371 -20.113 -2.846 1.00 0.00 C ATOM 116 CD LYS A 15 -18.466 -19.172 -2.049 1.00 0.00 C ATOM 117 CE LYS A 15 -17.424 -19.991 -1.286 1.00 0.00 C ATOM 118 NZ LYS A 15 -17.915 -20.256 0.096 1.00 0.00 N ATOM 0 H LYS A 15 -20.722 -22.152 -4.842 1.00 0.00 H new ATOM 0 HA LYS A 15 -21.960 -20.812 -3.458 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -19.966 -18.671 -4.342 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -20.940 -18.628 -2.886 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -19.847 -20.830 -2.177 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -18.779 -20.686 -3.559 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -17.972 -18.470 -2.721 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -19.061 -18.581 -1.352 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -17.236 -20.932 -1.803 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -16.477 -19.452 -1.250 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -17.613 -21.205 0.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -17.522 -19.546 0.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -18.953 -20.202 0.112 1.00 0.00 H new ATOM 132 N GLY A 16 -22.920 -19.942 -6.135 1.00 0.00 N ATOM 133 CA GLY A 16 -23.920 -19.196 -6.949 1.00 0.00 C ATOM 134 C GLY A 16 -23.199 -18.333 -7.988 1.00 0.00 C ATOM 135 O GLY A 16 -23.819 -17.699 -8.819 1.00 0.00 O ATOM 0 H GLY A 16 -22.640 -20.847 -6.513 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -24.593 -19.895 -7.446 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -24.533 -18.568 -6.303 1.00 0.00 H new ATOM 139 N THR A 17 -21.895 -18.300 -7.948 1.00 0.00 N ATOM 140 CA THR A 17 -21.141 -17.477 -8.935 1.00 0.00 C ATOM 141 C THR A 17 -20.870 -18.306 -10.191 1.00 0.00 C ATOM 142 O THR A 17 -20.370 -19.412 -10.121 1.00 0.00 O ATOM 143 CB THR A 17 -19.811 -17.032 -8.321 1.00 0.00 C ATOM 144 OG1 THR A 17 -20.043 -16.511 -7.019 1.00 0.00 O ATOM 145 CG2 THR A 17 -19.177 -15.953 -9.199 1.00 0.00 C ATOM 0 H THR A 17 -21.320 -18.807 -7.275 1.00 0.00 H new ATOM 0 HA THR A 17 -21.731 -16.599 -9.199 1.00 0.00 H new ATOM 0 HB THR A 17 -19.137 -17.886 -8.256 1.00 0.00 H new ATOM 0 HG1 THR A 17 -20.189 -17.250 -6.392 1.00 0.00 H new ATOM 0 HG21 THR A 17 -18.230 -15.637 -8.761 1.00 0.00 H new ATOM 0 HG22 THR A 17 -18.999 -16.354 -10.197 1.00 0.00 H new ATOM 0 HG23 THR A 17 -19.849 -15.097 -9.266 1.00 0.00 H new ATOM 153 N LYS A 18 -21.196 -17.783 -11.340 1.00 0.00 N ATOM 154 CA LYS A 18 -20.956 -18.544 -12.599 1.00 0.00 C ATOM 155 C LYS A 18 -19.533 -18.279 -13.092 1.00 0.00 C ATOM 156 O LYS A 18 -19.151 -17.152 -13.339 1.00 0.00 O ATOM 157 CB LYS A 18 -21.956 -18.095 -13.666 1.00 0.00 C ATOM 158 CG LYS A 18 -21.805 -18.977 -14.907 1.00 0.00 C ATOM 159 CD LYS A 18 -22.714 -18.453 -16.021 1.00 0.00 C ATOM 160 CE LYS A 18 -22.699 -19.437 -17.194 1.00 0.00 C ATOM 161 NZ LYS A 18 -22.213 -18.741 -18.419 1.00 0.00 N ATOM 0 H LYS A 18 -21.618 -16.862 -11.462 1.00 0.00 H new ATOM 0 HA LYS A 18 -21.082 -19.610 -12.408 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -22.973 -18.164 -13.279 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -21.783 -17.050 -13.925 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -20.767 -18.979 -15.241 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -22.064 -20.008 -14.667 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -23.731 -18.330 -15.648 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -22.374 -17.471 -16.351 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -22.053 -20.284 -16.964 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -23.700 -19.835 -17.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -22.202 -19.409 -19.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -22.846 -17.946 -18.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -21.251 -18.382 -18.256 1.00 0.00 H new ATOM 175 N LEU A 19 -18.745 -19.308 -13.237 1.00 0.00 N ATOM 176 CA LEU A 19 -17.348 -19.112 -13.715 1.00 0.00 C ATOM 177 C LEU A 19 -16.978 -20.237 -14.682 1.00 0.00 C ATOM 178 O LEU A 19 -17.614 -21.272 -14.719 1.00 0.00 O ATOM 179 CB LEU A 19 -16.393 -19.128 -12.520 1.00 0.00 C ATOM 180 CG LEU A 19 -16.737 -17.973 -11.579 1.00 0.00 C ATOM 181 CD1 LEU A 19 -17.960 -18.347 -10.737 1.00 0.00 C ATOM 182 CD2 LEU A 19 -15.549 -17.695 -10.656 1.00 0.00 C ATOM 0 H LEU A 19 -19.008 -20.275 -13.045 1.00 0.00 H new ATOM 0 HA LEU A 19 -17.270 -18.153 -14.228 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -16.471 -20.078 -11.991 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -15.362 -19.038 -12.863 1.00 0.00 H new ATOM 0 HG LEU A 19 -16.958 -17.081 -12.165 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -18.205 -17.524 -10.066 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -18.807 -18.545 -11.394 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -17.739 -19.239 -10.151 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -15.794 -16.872 -9.985 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -15.327 -18.587 -10.070 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -14.678 -17.428 -11.254 1.00 0.00 H new ATOM 194 N LYS A 20 -15.954 -20.044 -15.467 1.00 0.00 N ATOM 195 CA LYS A 20 -15.546 -21.101 -16.431 1.00 0.00 C ATOM 196 C LYS A 20 -14.565 -22.059 -15.751 1.00 0.00 C ATOM 197 O LYS A 20 -13.891 -21.704 -14.805 1.00 0.00 O ATOM 198 CB LYS A 20 -14.869 -20.455 -17.640 1.00 0.00 C ATOM 199 CG LYS A 20 -15.884 -19.588 -18.390 1.00 0.00 C ATOM 200 CD LYS A 20 -15.233 -19.015 -19.649 1.00 0.00 C ATOM 201 CE LYS A 20 -16.251 -18.158 -20.405 1.00 0.00 C ATOM 202 NZ LYS A 20 -15.729 -17.854 -21.768 1.00 0.00 N ATOM 0 H LYS A 20 -15.383 -19.199 -15.482 1.00 0.00 H new ATOM 0 HA LYS A 20 -16.427 -21.653 -16.759 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -14.025 -19.847 -17.316 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -14.472 -21.224 -18.302 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -16.758 -20.182 -18.658 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -16.233 -18.779 -17.748 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -14.364 -18.414 -19.381 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -14.877 -19.824 -20.287 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -17.203 -18.684 -20.477 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -16.439 -17.232 -19.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -16.420 -17.272 -22.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -14.831 -17.336 -21.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -15.571 -18.742 -22.285 1.00 0.00 H new ATOM 216 N ALA A 21 -14.480 -23.271 -16.226 1.00 0.00 N ATOM 217 CA ALA A 21 -13.543 -24.249 -15.608 1.00 0.00 C ATOM 218 C ALA A 21 -12.858 -25.062 -16.708 1.00 0.00 C ATOM 219 O ALA A 21 -13.146 -24.905 -17.879 1.00 0.00 O ATOM 220 CB ALA A 21 -14.321 -25.191 -14.687 1.00 0.00 C ATOM 0 H ALA A 21 -15.019 -23.626 -17.016 1.00 0.00 H new ATOM 0 HA ALA A 21 -12.791 -23.715 -15.028 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -13.635 -25.907 -14.235 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -14.810 -24.612 -13.903 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -15.074 -25.726 -15.266 1.00 0.00 H new ATOM 226 N HIS A 22 -11.954 -25.927 -16.344 1.00 0.00 N ATOM 227 CA HIS A 22 -11.253 -26.747 -17.372 1.00 0.00 C ATOM 228 C HIS A 22 -11.201 -28.206 -16.916 1.00 0.00 C ATOM 229 O HIS A 22 -10.686 -28.520 -15.861 1.00 0.00 O ATOM 230 CB HIS A 22 -9.827 -26.223 -17.558 1.00 0.00 C ATOM 231 CG HIS A 22 -9.852 -24.995 -18.424 1.00 0.00 C ATOM 232 ND1 HIS A 22 -9.662 -23.666 -18.138 1.00 0.00 N flip ATOM 233 CD2 HIS A 22 -10.098 -25.057 -19.787 1.00 0.00 C flip ATOM 234 CE1 HIS A 22 -9.786 -22.913 -19.302 1.00 0.00 C flip ATOM 235 NE2 HIS A 22 -10.049 -23.800 -20.266 1.00 0.00 N flip ATOM 0 H HIS A 22 -11.670 -26.102 -15.380 1.00 0.00 H new ATOM 0 HA HIS A 22 -11.793 -26.680 -18.317 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -9.385 -25.989 -16.589 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -9.203 -26.991 -18.016 1.00 0.00 H new ATOM 0 HD1 HIS A 22 -9.460 -23.288 -17.213 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -10.293 -25.951 -20.360 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -9.690 -21.842 -19.404 1.00 0.00 H new ATOM 243 N TRP A 23 -11.730 -29.102 -17.704 1.00 0.00 N ATOM 244 CA TRP A 23 -11.709 -30.540 -17.315 1.00 0.00 C ATOM 245 C TRP A 23 -10.329 -31.126 -17.619 1.00 0.00 C ATOM 246 O TRP A 23 -9.821 -31.005 -18.717 1.00 0.00 O ATOM 247 CB TRP A 23 -12.772 -31.299 -18.110 1.00 0.00 C ATOM 248 CG TRP A 23 -12.920 -32.678 -17.552 1.00 0.00 C ATOM 249 CD1 TRP A 23 -13.700 -33.009 -16.497 1.00 0.00 C ATOM 250 CD2 TRP A 23 -12.289 -33.912 -17.999 1.00 0.00 C ATOM 251 NE1 TRP A 23 -13.587 -34.368 -16.268 1.00 0.00 N ATOM 252 CE2 TRP A 23 -12.730 -34.970 -17.168 1.00 0.00 C ATOM 253 CE3 TRP A 23 -11.388 -34.214 -19.035 1.00 0.00 C ATOM 254 CZ2 TRP A 23 -12.289 -36.280 -17.358 1.00 0.00 C ATOM 255 CZ3 TRP A 23 -10.943 -35.533 -19.230 1.00 0.00 C ATOM 256 CH2 TRP A 23 -11.394 -36.563 -18.393 1.00 0.00 C ATOM 0 H TRP A 23 -12.175 -28.900 -18.599 1.00 0.00 H new ATOM 0 HA TRP A 23 -11.919 -30.633 -16.249 1.00 0.00 H new ATOM 0 HB2 TRP A 23 -13.724 -30.771 -18.061 1.00 0.00 H new ATOM 0 HB3 TRP A 23 -12.489 -31.349 -19.161 1.00 0.00 H new ATOM 0 HD1 TRP A 23 -14.311 -32.324 -15.927 1.00 0.00 H new ATOM 0 HE1 TRP A 23 -14.077 -34.865 -15.525 1.00 0.00 H new ATOM 0 HE3 TRP A 23 -11.035 -33.427 -19.685 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 -12.637 -37.070 -16.709 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 -10.250 -35.754 -20.029 1.00 0.00 H new ATOM 0 HH2 TRP A 23 -11.050 -37.575 -18.548 1.00 0.00 H new ATOM 267 N ASP A 24 -9.718 -31.761 -16.657 1.00 0.00 N ATOM 268 CA ASP A 24 -8.371 -32.353 -16.896 1.00 0.00 C ATOM 269 C ASP A 24 -8.268 -33.698 -16.176 1.00 0.00 C ATOM 270 O ASP A 24 -8.214 -33.763 -14.964 1.00 0.00 O ATOM 271 CB ASP A 24 -7.295 -31.404 -16.361 1.00 0.00 C ATOM 272 CG ASP A 24 -5.911 -31.952 -16.715 1.00 0.00 C ATOM 273 OD1 ASP A 24 -5.463 -31.700 -17.822 1.00 0.00 O ATOM 274 OD2 ASP A 24 -5.325 -32.613 -15.875 1.00 0.00 O ATOM 0 H ASP A 24 -10.092 -31.896 -15.718 1.00 0.00 H new ATOM 0 HA ASP A 24 -8.225 -32.503 -17.966 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -7.425 -30.410 -16.790 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -7.391 -31.300 -15.280 1.00 0.00 H new ATOM 279 N SER A 25 -8.241 -34.774 -16.914 1.00 0.00 N ATOM 280 CA SER A 25 -8.141 -36.116 -16.273 1.00 0.00 C ATOM 281 C SER A 25 -6.840 -36.203 -15.475 1.00 0.00 C ATOM 282 O SER A 25 -6.740 -36.938 -14.511 1.00 0.00 O ATOM 283 CB SER A 25 -8.152 -37.197 -17.355 1.00 0.00 C ATOM 284 OG SER A 25 -8.255 -38.476 -16.745 1.00 0.00 O ATOM 0 H SER A 25 -8.284 -34.782 -17.933 1.00 0.00 H new ATOM 0 HA SER A 25 -8.987 -36.265 -15.602 1.00 0.00 H new ATOM 0 HB2 SER A 25 -8.989 -37.038 -18.035 1.00 0.00 H new ATOM 0 HB3 SER A 25 -7.242 -37.139 -17.952 1.00 0.00 H new ATOM 0 HG SER A 25 -8.264 -39.169 -17.438 1.00 0.00 H new ATOM 290 N GLY A 26 -5.841 -35.461 -15.867 1.00 0.00 N ATOM 291 CA GLY A 26 -4.548 -35.504 -15.129 1.00 0.00 C ATOM 292 C GLY A 26 -4.756 -34.992 -13.703 1.00 0.00 C ATOM 293 O GLY A 26 -4.043 -35.361 -12.790 1.00 0.00 O ATOM 0 H GLY A 26 -5.864 -34.827 -16.666 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -4.163 -36.524 -15.108 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -3.805 -34.893 -15.641 1.00 0.00 H new ATOM 297 N ALA A 27 -5.728 -34.145 -13.501 1.00 0.00 N ATOM 298 CA ALA A 27 -5.981 -33.612 -12.133 1.00 0.00 C ATOM 299 C ALA A 27 -6.761 -34.647 -11.318 1.00 0.00 C ATOM 300 O ALA A 27 -7.789 -35.136 -11.742 1.00 0.00 O ATOM 301 CB ALA A 27 -6.794 -32.319 -12.231 1.00 0.00 C ATOM 0 H ALA A 27 -6.358 -33.799 -14.225 1.00 0.00 H new ATOM 0 HA ALA A 27 -5.030 -33.406 -11.642 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -6.979 -31.929 -11.230 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -6.237 -31.582 -12.810 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -7.745 -32.524 -12.722 1.00 0.00 H new ATOM 307 N THR A 28 -6.279 -34.984 -10.153 1.00 0.00 N ATOM 308 CA THR A 28 -6.993 -35.989 -9.315 1.00 0.00 C ATOM 309 C THR A 28 -7.900 -35.267 -8.316 1.00 0.00 C ATOM 310 O THR A 28 -8.796 -35.853 -7.741 1.00 0.00 O ATOM 311 CB THR A 28 -5.970 -36.837 -8.555 1.00 0.00 C ATOM 312 OG1 THR A 28 -5.047 -37.400 -9.478 1.00 0.00 O ATOM 313 CG2 THR A 28 -6.691 -37.958 -7.804 1.00 0.00 C ATOM 0 H THR A 28 -5.423 -34.608 -9.746 1.00 0.00 H new ATOM 0 HA THR A 28 -7.597 -36.633 -9.954 1.00 0.00 H new ATOM 0 HB THR A 28 -5.435 -36.210 -7.841 1.00 0.00 H new ATOM 0 HG1 THR A 28 -4.390 -37.942 -8.994 1.00 0.00 H new ATOM 0 HG21 THR A 28 -5.962 -38.561 -7.263 1.00 0.00 H new ATOM 0 HG22 THR A 28 -7.400 -37.526 -7.098 1.00 0.00 H new ATOM 0 HG23 THR A 28 -7.226 -38.587 -8.515 1.00 0.00 H new ATOM 321 N ILE A 29 -7.676 -33.999 -8.105 1.00 0.00 N ATOM 322 CA ILE A 29 -8.526 -33.242 -7.142 1.00 0.00 C ATOM 323 C ILE A 29 -8.910 -31.893 -7.751 1.00 0.00 C ATOM 324 O ILE A 29 -8.077 -31.166 -8.253 1.00 0.00 O ATOM 325 CB ILE A 29 -7.749 -33.013 -5.844 1.00 0.00 C ATOM 326 CG1 ILE A 29 -8.673 -32.386 -4.798 1.00 0.00 C ATOM 327 CG2 ILE A 29 -6.572 -32.074 -6.114 1.00 0.00 C ATOM 328 CD1 ILE A 29 -8.004 -32.449 -3.424 1.00 0.00 C ATOM 0 H ILE A 29 -6.942 -33.454 -8.557 1.00 0.00 H new ATOM 0 HA ILE A 29 -9.429 -33.814 -6.928 1.00 0.00 H new ATOM 0 HB ILE A 29 -7.375 -33.967 -5.472 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -8.889 -31.351 -5.062 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -9.626 -32.915 -4.775 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -6.018 -31.910 -5.190 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -5.913 -32.521 -6.858 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -6.946 -31.120 -6.487 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -8.662 -32.002 -2.678 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -7.810 -33.489 -3.161 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -7.062 -31.901 -3.452 1.00 0.00 H new ATOM 340 N THR A 30 -10.170 -31.554 -7.713 1.00 0.00 N ATOM 341 CA THR A 30 -10.612 -30.254 -8.290 1.00 0.00 C ATOM 342 C THR A 30 -9.743 -29.123 -7.733 1.00 0.00 C ATOM 343 O THR A 30 -9.413 -29.095 -6.564 1.00 0.00 O ATOM 344 CB THR A 30 -12.076 -30.006 -7.917 1.00 0.00 C ATOM 345 OG1 THR A 30 -12.871 -31.084 -8.392 1.00 0.00 O ATOM 346 CG2 THR A 30 -12.555 -28.699 -8.550 1.00 0.00 C ATOM 0 H THR A 30 -10.913 -32.123 -7.307 1.00 0.00 H new ATOM 0 HA THR A 30 -10.512 -30.284 -9.375 1.00 0.00 H new ATOM 0 HB THR A 30 -12.167 -29.934 -6.833 1.00 0.00 H new ATOM 0 HG1 THR A 30 -12.837 -31.823 -7.750 1.00 0.00 H new ATOM 0 HG21 THR A 30 -13.597 -28.526 -8.282 1.00 0.00 H new ATOM 0 HG22 THR A 30 -11.945 -27.873 -8.185 1.00 0.00 H new ATOM 0 HG23 THR A 30 -12.465 -28.765 -9.634 1.00 0.00 H new ATOM 354 N CYS A 31 -9.370 -28.187 -8.563 1.00 0.00 N ATOM 355 CA CYS A 31 -8.525 -27.059 -8.083 1.00 0.00 C ATOM 356 C CYS A 31 -9.269 -25.740 -8.306 1.00 0.00 C ATOM 357 O CYS A 31 -9.748 -25.463 -9.386 1.00 0.00 O ATOM 358 CB CYS A 31 -7.207 -27.041 -8.860 1.00 0.00 C ATOM 359 SG CYS A 31 -5.824 -27.185 -7.700 1.00 0.00 S ATOM 0 H CYS A 31 -9.614 -28.156 -9.553 1.00 0.00 H new ATOM 0 HA CYS A 31 -8.316 -27.185 -7.021 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -7.183 -27.863 -9.576 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -7.122 -26.117 -9.432 1.00 0.00 H new ATOM 0 HG CYS A 31 -4.703 -27.172 -8.358 1.00 0.00 H new ATOM 365 N VAL A 32 -9.371 -24.927 -7.292 1.00 0.00 N ATOM 366 CA VAL A 32 -10.086 -23.629 -7.448 1.00 0.00 C ATOM 367 C VAL A 32 -9.143 -22.482 -7.086 1.00 0.00 C ATOM 368 O VAL A 32 -8.132 -22.678 -6.444 1.00 0.00 O ATOM 369 CB VAL A 32 -11.303 -23.602 -6.520 1.00 0.00 C ATOM 370 CG1 VAL A 32 -12.349 -24.598 -7.021 1.00 0.00 C ATOM 371 CG2 VAL A 32 -10.871 -23.987 -5.102 1.00 0.00 C ATOM 0 H VAL A 32 -8.991 -25.105 -6.362 1.00 0.00 H new ATOM 0 HA VAL A 32 -10.415 -23.517 -8.481 1.00 0.00 H new ATOM 0 HB VAL A 32 -11.731 -22.600 -6.511 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -13.216 -24.579 -6.360 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -12.656 -24.326 -8.031 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -11.922 -25.601 -7.030 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -11.737 -23.968 -4.440 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -10.443 -24.990 -5.112 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -10.125 -23.278 -4.744 1.00 0.00 H new ATOM 381 N PRO A 33 -9.491 -21.257 -7.506 1.00 0.00 N ATOM 382 CA PRO A 33 -8.680 -20.070 -7.226 1.00 0.00 C ATOM 383 C PRO A 33 -8.892 -19.566 -5.794 1.00 0.00 C ATOM 384 O PRO A 33 -10.009 -19.416 -5.339 1.00 0.00 O ATOM 385 CB PRO A 33 -9.203 -19.037 -8.219 1.00 0.00 C ATOM 386 CG PRO A 33 -10.608 -19.455 -8.516 1.00 0.00 C ATOM 387 CD PRO A 33 -10.693 -20.942 -8.296 1.00 0.00 C ATOM 0 HA PRO A 33 -7.613 -20.272 -7.321 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -9.172 -18.033 -7.796 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -8.597 -19.020 -9.125 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -11.309 -18.931 -7.867 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -10.874 -19.203 -9.543 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -11.604 -21.215 -7.762 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -10.703 -21.485 -9.241 1.00 0.00 H new ATOM 395 N GLU A 34 -7.828 -19.309 -5.082 1.00 0.00 N ATOM 396 CA GLU A 34 -7.964 -18.819 -3.681 1.00 0.00 C ATOM 397 C GLU A 34 -9.069 -17.763 -3.613 1.00 0.00 C ATOM 398 O GLU A 34 -9.698 -17.572 -2.590 1.00 0.00 O ATOM 399 CB GLU A 34 -6.642 -18.193 -3.230 1.00 0.00 C ATOM 400 CG GLU A 34 -5.539 -19.253 -3.255 1.00 0.00 C ATOM 401 CD GLU A 34 -4.186 -18.584 -3.002 1.00 0.00 C ATOM 402 OE1 GLU A 34 -4.155 -17.367 -2.924 1.00 0.00 O ATOM 403 OE2 GLU A 34 -3.205 -19.301 -2.890 1.00 0.00 O ATOM 0 H GLU A 34 -6.869 -19.418 -5.411 1.00 0.00 H new ATOM 0 HA GLU A 34 -8.217 -19.655 -3.029 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -6.378 -17.363 -3.886 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -6.745 -17.784 -2.225 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -5.730 -20.011 -2.495 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -5.531 -19.763 -4.219 1.00 0.00 H new ATOM 410 N ALA A 35 -9.307 -17.075 -4.693 1.00 0.00 N ATOM 411 CA ALA A 35 -10.367 -16.027 -4.697 1.00 0.00 C ATOM 412 C ALA A 35 -11.647 -16.583 -4.069 1.00 0.00 C ATOM 413 O ALA A 35 -12.308 -15.919 -3.294 1.00 0.00 O ATOM 414 CB ALA A 35 -10.654 -15.599 -6.137 1.00 0.00 C ATOM 0 H ALA A 35 -8.812 -17.193 -5.577 1.00 0.00 H new ATOM 0 HA ALA A 35 -10.025 -15.168 -4.120 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -11.429 -14.833 -6.141 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -9.745 -15.198 -6.585 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -10.993 -16.461 -6.712 1.00 0.00 H new ATOM 420 N PHE A 36 -12.011 -17.791 -4.402 1.00 0.00 N ATOM 421 CA PHE A 36 -13.253 -18.381 -3.828 1.00 0.00 C ATOM 422 C PHE A 36 -12.946 -19.010 -2.469 1.00 0.00 C ATOM 423 O PHE A 36 -13.834 -19.452 -1.767 1.00 0.00 O ATOM 424 CB PHE A 36 -13.793 -19.454 -4.774 1.00 0.00 C ATOM 425 CG PHE A 36 -14.660 -18.806 -5.826 1.00 0.00 C ATOM 426 CD1 PHE A 36 -14.069 -18.143 -6.908 1.00 0.00 C ATOM 427 CD2 PHE A 36 -16.055 -18.868 -5.721 1.00 0.00 C ATOM 428 CE1 PHE A 36 -14.873 -17.541 -7.884 1.00 0.00 C ATOM 429 CE2 PHE A 36 -16.858 -18.267 -6.696 1.00 0.00 C ATOM 430 CZ PHE A 36 -16.268 -17.602 -7.778 1.00 0.00 C ATOM 0 H PHE A 36 -11.502 -18.395 -5.047 1.00 0.00 H new ATOM 0 HA PHE A 36 -13.999 -17.596 -3.702 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -12.968 -19.987 -5.246 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -14.370 -20.190 -4.215 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -12.993 -18.096 -6.990 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -16.511 -19.380 -4.887 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -14.417 -17.030 -8.719 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -17.934 -18.316 -6.614 1.00 0.00 H new ATOM 0 HZ PHE A 36 -16.888 -17.137 -8.530 1.00 0.00 H new ATOM 440 N LEU A 37 -11.700 -19.057 -2.090 1.00 0.00 N ATOM 441 CA LEU A 37 -11.352 -19.664 -0.776 1.00 0.00 C ATOM 442 C LEU A 37 -11.315 -18.577 0.300 1.00 0.00 C ATOM 443 O LEU A 37 -10.755 -18.766 1.361 1.00 0.00 O ATOM 444 CB LEU A 37 -9.985 -20.342 -0.865 1.00 0.00 C ATOM 445 CG LEU A 37 -10.163 -21.785 -1.345 1.00 0.00 C ATOM 446 CD1 LEU A 37 -11.064 -22.543 -0.365 1.00 0.00 C ATOM 447 CD2 LEU A 37 -10.809 -21.783 -2.732 1.00 0.00 C ATOM 0 H LEU A 37 -10.911 -18.703 -2.630 1.00 0.00 H new ATOM 0 HA LEU A 37 -12.106 -20.407 -0.514 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -9.340 -19.795 -1.553 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -9.496 -20.329 0.109 1.00 0.00 H new ATOM 0 HG LEU A 37 -9.190 -22.274 -1.396 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -11.191 -23.570 -0.707 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -10.606 -22.544 0.624 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -12.037 -22.055 -0.314 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -10.937 -22.810 -3.075 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -11.782 -21.294 -2.680 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -10.169 -21.244 -3.431 1.00 0.00 H new ATOM 459 N GLU A 38 -11.913 -17.442 0.041 1.00 0.00 N ATOM 460 CA GLU A 38 -11.914 -16.355 1.061 1.00 0.00 C ATOM 461 C GLU A 38 -12.228 -16.970 2.424 1.00 0.00 C ATOM 462 O GLU A 38 -11.483 -16.820 3.373 1.00 0.00 O ATOM 463 CB GLU A 38 -12.982 -15.318 0.704 1.00 0.00 C ATOM 464 CG GLU A 38 -12.450 -14.401 -0.401 1.00 0.00 C ATOM 465 CD GLU A 38 -13.385 -13.200 -0.562 1.00 0.00 C ATOM 466 OE1 GLU A 38 -14.362 -13.134 0.166 1.00 0.00 O ATOM 467 OE2 GLU A 38 -13.108 -12.368 -1.410 1.00 0.00 O ATOM 0 H GLU A 38 -12.398 -17.223 -0.829 1.00 0.00 H new ATOM 0 HA GLU A 38 -10.941 -15.865 1.088 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -13.892 -15.817 0.371 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -13.244 -14.731 1.584 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -11.444 -14.062 -0.154 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -12.380 -14.949 -1.341 1.00 0.00 H new ATOM 474 N ASP A 39 -13.314 -17.684 2.519 1.00 0.00 N ATOM 475 CA ASP A 39 -13.669 -18.339 3.806 1.00 0.00 C ATOM 476 C ASP A 39 -13.245 -19.805 3.725 1.00 0.00 C ATOM 477 O ASP A 39 -13.918 -20.691 4.214 1.00 0.00 O ATOM 478 CB ASP A 39 -15.179 -18.249 4.033 1.00 0.00 C ATOM 479 CG ASP A 39 -15.912 -18.695 2.766 1.00 0.00 C ATOM 480 OD1 ASP A 39 -15.252 -19.178 1.862 1.00 0.00 O ATOM 481 OD2 ASP A 39 -17.123 -18.546 2.722 1.00 0.00 O ATOM 0 H ASP A 39 -13.973 -17.842 1.757 1.00 0.00 H new ATOM 0 HA ASP A 39 -13.162 -17.844 4.634 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -15.469 -18.878 4.875 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -15.459 -17.227 4.287 1.00 0.00 H new ATOM 486 N GLU A 40 -12.131 -20.058 3.091 1.00 0.00 N ATOM 487 CA GLU A 40 -11.634 -21.450 2.940 1.00 0.00 C ATOM 488 C GLU A 40 -11.888 -22.252 4.219 1.00 0.00 C ATOM 489 O GLU A 40 -11.623 -21.800 5.316 1.00 0.00 O ATOM 490 CB GLU A 40 -10.134 -21.407 2.642 1.00 0.00 C ATOM 491 CG GLU A 40 -9.358 -21.108 3.928 1.00 0.00 C ATOM 492 CD GLU A 40 -7.869 -20.967 3.605 1.00 0.00 C ATOM 493 OE1 GLU A 40 -7.497 -21.251 2.480 1.00 0.00 O ATOM 494 OE2 GLU A 40 -7.126 -20.576 4.491 1.00 0.00 O ATOM 0 H GLU A 40 -11.538 -19.345 2.666 1.00 0.00 H new ATOM 0 HA GLU A 40 -12.164 -21.937 2.121 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -9.810 -22.360 2.224 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -9.924 -20.643 1.894 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -9.730 -20.191 4.385 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -9.510 -21.909 4.651 1.00 0.00 H new ATOM 501 N ARG A 41 -12.392 -23.447 4.078 1.00 0.00 N ATOM 502 CA ARG A 41 -12.661 -24.300 5.269 1.00 0.00 C ATOM 503 C ARG A 41 -12.011 -25.665 5.049 1.00 0.00 C ATOM 504 O ARG A 41 -12.646 -26.603 4.609 1.00 0.00 O ATOM 505 CB ARG A 41 -14.171 -24.473 5.446 1.00 0.00 C ATOM 506 CG ARG A 41 -14.831 -23.100 5.587 1.00 0.00 C ATOM 507 CD ARG A 41 -16.216 -23.262 6.220 1.00 0.00 C ATOM 508 NE ARG A 41 -16.106 -23.113 7.698 1.00 0.00 N ATOM 509 CZ ARG A 41 -16.386 -21.969 8.261 1.00 0.00 C ATOM 510 NH1 ARG A 41 -15.709 -20.901 7.940 1.00 0.00 N ATOM 511 NH2 ARG A 41 -17.343 -21.894 9.145 1.00 0.00 N ATOM 0 H ARG A 41 -12.631 -23.872 3.182 1.00 0.00 H new ATOM 0 HA ARG A 41 -12.250 -23.831 6.163 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -14.589 -25.003 4.590 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -14.377 -25.079 6.328 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -14.212 -22.448 6.203 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -14.919 -22.625 4.610 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -16.901 -22.515 5.818 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -16.629 -24.240 5.972 1.00 0.00 H new ATOM 0 HE ARG A 41 -15.812 -23.905 8.270 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -14.961 -20.960 7.249 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -15.928 -20.007 8.380 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -17.872 -22.729 9.396 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -17.562 -21.000 9.585 1.00 0.00 H new ATOM 525 N PRO A 42 -10.708 -25.768 5.347 1.00 0.00 N ATOM 526 CA PRO A 42 -9.946 -27.011 5.169 1.00 0.00 C ATOM 527 C PRO A 42 -10.379 -28.105 6.150 1.00 0.00 C ATOM 528 O PRO A 42 -10.245 -27.966 7.350 1.00 0.00 O ATOM 529 CB PRO A 42 -8.505 -26.591 5.457 1.00 0.00 C ATOM 530 CG PRO A 42 -8.634 -25.395 6.337 1.00 0.00 C ATOM 531 CD PRO A 42 -9.874 -24.679 5.884 1.00 0.00 C ATOM 0 HA PRO A 42 -10.094 -27.436 4.176 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -7.950 -27.389 5.950 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -7.970 -26.352 4.538 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -8.713 -25.688 7.384 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -7.759 -24.751 6.251 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -10.366 -24.163 6.708 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -9.652 -23.929 5.125 1.00 0.00 H new ATOM 539 N ILE A 43 -10.889 -29.194 5.645 1.00 0.00 N ATOM 540 CA ILE A 43 -11.320 -30.303 6.541 1.00 0.00 C ATOM 541 C ILE A 43 -10.151 -31.271 6.735 1.00 0.00 C ATOM 542 O ILE A 43 -10.031 -31.920 7.755 1.00 0.00 O ATOM 543 CB ILE A 43 -12.497 -31.045 5.904 1.00 0.00 C ATOM 544 CG1 ILE A 43 -12.052 -31.666 4.577 1.00 0.00 C ATOM 545 CG2 ILE A 43 -13.642 -30.064 5.648 1.00 0.00 C ATOM 546 CD1 ILE A 43 -13.210 -32.459 3.970 1.00 0.00 C ATOM 0 H ILE A 43 -11.026 -29.364 4.649 1.00 0.00 H new ATOM 0 HA ILE A 43 -11.628 -29.899 7.506 1.00 0.00 H new ATOM 0 HB ILE A 43 -12.836 -31.831 6.578 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -11.731 -30.885 3.887 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -11.195 -32.320 4.739 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -14.480 -30.593 5.194 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -13.960 -29.622 6.592 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -13.303 -29.277 4.975 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -12.893 -32.901 3.025 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -13.510 -33.250 4.658 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -14.054 -31.793 3.793 1.00 0.00 H new ATOM 558 N GLN A 44 -9.287 -31.365 5.762 1.00 0.00 N ATOM 559 CA GLN A 44 -8.120 -32.282 5.880 1.00 0.00 C ATOM 560 C GLN A 44 -6.891 -31.614 5.260 1.00 0.00 C ATOM 561 O GLN A 44 -7.006 -30.731 4.434 1.00 0.00 O ATOM 562 CB GLN A 44 -8.417 -33.589 5.140 1.00 0.00 C ATOM 563 CG GLN A 44 -9.545 -34.336 5.855 1.00 0.00 C ATOM 564 CD GLN A 44 -9.921 -35.581 5.048 1.00 0.00 C ATOM 565 OE1 GLN A 44 -9.525 -35.724 3.909 1.00 0.00 O ATOM 566 NE2 GLN A 44 -10.676 -36.494 5.596 1.00 0.00 N ATOM 0 H GLN A 44 -9.340 -30.844 4.887 1.00 0.00 H new ATOM 0 HA GLN A 44 -7.930 -32.498 6.931 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -8.702 -33.379 4.109 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -7.522 -34.210 5.103 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -9.229 -34.621 6.858 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -10.413 -33.686 5.967 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -11.009 -36.374 6.553 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -10.933 -37.328 5.067 1.00 0.00 H new ATOM 575 N THR A 45 -5.715 -32.022 5.652 1.00 0.00 N ATOM 576 CA THR A 45 -4.486 -31.403 5.080 1.00 0.00 C ATOM 577 C THR A 45 -3.642 -32.476 4.391 1.00 0.00 C ATOM 578 O THR A 45 -3.711 -33.643 4.723 1.00 0.00 O ATOM 579 CB THR A 45 -3.670 -30.756 6.203 1.00 0.00 C ATOM 580 OG1 THR A 45 -3.280 -31.752 7.137 1.00 0.00 O ATOM 581 CG2 THR A 45 -4.519 -29.697 6.907 1.00 0.00 C ATOM 0 H THR A 45 -5.552 -32.755 6.342 1.00 0.00 H new ATOM 0 HA THR A 45 -4.770 -30.644 4.351 1.00 0.00 H new ATOM 0 HB THR A 45 -2.781 -30.285 5.783 1.00 0.00 H new ATOM 0 HG1 THR A 45 -2.756 -31.340 7.855 1.00 0.00 H new ATOM 0 HG21 THR A 45 -3.938 -29.237 7.706 1.00 0.00 H new ATOM 0 HG22 THR A 45 -4.817 -28.933 6.189 1.00 0.00 H new ATOM 0 HG23 THR A 45 -5.409 -30.165 7.329 1.00 0.00 H new ATOM 589 N MET A 46 -2.842 -32.089 3.436 1.00 0.00 N ATOM 590 CA MET A 46 -1.990 -33.084 2.726 1.00 0.00 C ATOM 591 C MET A 46 -0.614 -32.474 2.456 1.00 0.00 C ATOM 592 O MET A 46 -0.491 -31.302 2.158 1.00 0.00 O ATOM 593 CB MET A 46 -2.649 -33.465 1.398 1.00 0.00 C ATOM 594 CG MET A 46 -3.963 -34.197 1.671 1.00 0.00 C ATOM 595 SD MET A 46 -4.639 -34.823 0.114 1.00 0.00 S ATOM 596 CE MET A 46 -6.201 -35.451 0.778 1.00 0.00 C ATOM 0 H MET A 46 -2.741 -31.126 3.116 1.00 0.00 H new ATOM 0 HA MET A 46 -1.878 -33.975 3.344 1.00 0.00 H new ATOM 0 HB2 MET A 46 -2.836 -32.571 0.803 1.00 0.00 H new ATOM 0 HB3 MET A 46 -1.980 -34.101 0.817 1.00 0.00 H new ATOM 0 HG2 MET A 46 -3.795 -35.021 2.365 1.00 0.00 H new ATOM 0 HG3 MET A 46 -4.676 -33.522 2.144 1.00 0.00 H new ATOM 0 HE1 MET A 46 -6.224 -36.537 0.689 1.00 0.00 H new ATOM 0 HE2 MET A 46 -6.289 -35.171 1.828 1.00 0.00 H new ATOM 0 HE3 MET A 46 -7.033 -35.024 0.217 1.00 0.00 H new ATOM 606 N LEU A 47 0.424 -33.258 2.559 1.00 0.00 N ATOM 607 CA LEU A 47 1.791 -32.719 2.308 1.00 0.00 C ATOM 608 C LEU A 47 2.203 -33.025 0.867 1.00 0.00 C ATOM 609 O LEU A 47 2.143 -34.154 0.420 1.00 0.00 O ATOM 610 CB LEU A 47 2.781 -33.378 3.272 1.00 0.00 C ATOM 611 CG LEU A 47 4.156 -32.724 3.118 1.00 0.00 C ATOM 612 CD1 LEU A 47 4.115 -31.305 3.689 1.00 0.00 C ATOM 613 CD2 LEU A 47 5.200 -33.547 3.875 1.00 0.00 C ATOM 0 H LEU A 47 0.385 -34.247 2.806 1.00 0.00 H new ATOM 0 HA LEU A 47 1.792 -31.640 2.465 1.00 0.00 H new ATOM 0 HB2 LEU A 47 2.430 -33.273 4.299 1.00 0.00 H new ATOM 0 HB3 LEU A 47 2.849 -34.446 3.066 1.00 0.00 H new ATOM 0 HG LEU A 47 4.421 -32.683 2.061 1.00 0.00 H new ATOM 0 HD11 LEU A 47 5.095 -30.840 3.579 1.00 0.00 H new ATOM 0 HD12 LEU A 47 3.372 -30.717 3.150 1.00 0.00 H new ATOM 0 HD13 LEU A 47 3.849 -31.345 4.745 1.00 0.00 H new ATOM 0 HD21 LEU A 47 6.180 -33.081 3.766 1.00 0.00 H new ATOM 0 HD22 LEU A 47 4.934 -33.589 4.931 1.00 0.00 H new ATOM 0 HD23 LEU A 47 5.231 -34.558 3.468 1.00 0.00 H new ATOM 625 N ILE A 48 2.618 -32.029 0.134 1.00 0.00 N ATOM 626 CA ILE A 48 3.031 -32.263 -1.279 1.00 0.00 C ATOM 627 C ILE A 48 4.531 -31.997 -1.425 1.00 0.00 C ATOM 628 O ILE A 48 5.041 -30.994 -0.966 1.00 0.00 O ATOM 629 CB ILE A 48 2.253 -31.320 -2.200 1.00 0.00 C ATOM 630 CG1 ILE A 48 0.758 -31.420 -1.886 1.00 0.00 C ATOM 631 CG2 ILE A 48 2.497 -31.715 -3.657 1.00 0.00 C ATOM 632 CD1 ILE A 48 0.321 -32.885 -1.947 1.00 0.00 C ATOM 0 H ILE A 48 2.689 -31.063 0.452 1.00 0.00 H new ATOM 0 HA ILE A 48 2.818 -33.296 -1.553 1.00 0.00 H new ATOM 0 HB ILE A 48 2.590 -30.296 -2.041 1.00 0.00 H new ATOM 0 HG12 ILE A 48 0.555 -31.010 -0.897 1.00 0.00 H new ATOM 0 HG13 ILE A 48 0.185 -30.828 -2.600 1.00 0.00 H new ATOM 0 HG21 ILE A 48 1.943 -31.044 -4.314 1.00 0.00 H new ATOM 0 HG22 ILE A 48 3.562 -31.644 -3.880 1.00 0.00 H new ATOM 0 HG23 ILE A 48 2.160 -32.739 -3.818 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -0.743 -32.957 -1.723 1.00 0.00 H new ATOM 0 HD12 ILE A 48 0.510 -33.280 -2.945 1.00 0.00 H new ATOM 0 HD13 ILE A 48 0.885 -33.464 -1.216 1.00 0.00 H new ATOM 644 N LYS A 49 5.243 -32.888 -2.060 1.00 0.00 N ATOM 645 CA LYS A 49 6.709 -32.686 -2.233 1.00 0.00 C ATOM 646 C LYS A 49 7.016 -32.408 -3.707 1.00 0.00 C ATOM 647 O LYS A 49 6.542 -33.097 -4.589 1.00 0.00 O ATOM 648 CB LYS A 49 7.454 -33.946 -1.789 1.00 0.00 C ATOM 649 CG LYS A 49 7.208 -34.187 -0.298 1.00 0.00 C ATOM 650 CD LYS A 49 8.031 -35.391 0.166 1.00 0.00 C ATOM 651 CE LYS A 49 7.647 -35.749 1.602 1.00 0.00 C ATOM 652 NZ LYS A 49 6.827 -36.994 1.602 1.00 0.00 N ATOM 0 H LYS A 49 4.872 -33.747 -2.466 1.00 0.00 H new ATOM 0 HA LYS A 49 7.032 -31.839 -1.627 1.00 0.00 H new ATOM 0 HB2 LYS A 49 7.114 -34.805 -2.368 1.00 0.00 H new ATOM 0 HB3 LYS A 49 8.522 -33.836 -1.979 1.00 0.00 H new ATOM 0 HG2 LYS A 49 7.484 -33.302 0.275 1.00 0.00 H new ATOM 0 HG3 LYS A 49 6.148 -34.366 -0.117 1.00 0.00 H new ATOM 0 HD2 LYS A 49 7.853 -36.242 -0.492 1.00 0.00 H new ATOM 0 HD3 LYS A 49 9.095 -35.161 0.109 1.00 0.00 H new ATOM 0 HE2 LYS A 49 8.544 -35.892 2.205 1.00 0.00 H new ATOM 0 HE3 LYS A 49 7.086 -34.931 2.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 6.566 -37.238 2.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 5.965 -36.842 1.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 7.378 -37.772 1.187 1.00 0.00 H new ATOM 666 N THR A 50 7.808 -31.408 -3.982 1.00 0.00 N ATOM 667 CA THR A 50 8.145 -31.093 -5.399 1.00 0.00 C ATOM 668 C THR A 50 9.663 -31.132 -5.582 1.00 0.00 C ATOM 669 O THR A 50 10.404 -31.378 -4.651 1.00 0.00 O ATOM 670 CB THR A 50 7.626 -29.696 -5.752 1.00 0.00 C ATOM 671 OG1 THR A 50 7.657 -28.875 -4.593 1.00 0.00 O ATOM 672 CG2 THR A 50 6.191 -29.798 -6.271 1.00 0.00 C ATOM 0 H THR A 50 8.236 -30.796 -3.287 1.00 0.00 H new ATOM 0 HA THR A 50 7.679 -31.829 -6.054 1.00 0.00 H new ATOM 0 HB THR A 50 8.257 -29.258 -6.525 1.00 0.00 H new ATOM 0 HG1 THR A 50 8.492 -29.031 -4.104 1.00 0.00 H new ATOM 0 HG21 THR A 50 5.823 -28.803 -6.522 1.00 0.00 H new ATOM 0 HG22 THR A 50 6.170 -30.428 -7.161 1.00 0.00 H new ATOM 0 HG23 THR A 50 5.556 -30.236 -5.501 1.00 0.00 H new ATOM 680 N ILE A 51 10.132 -30.890 -6.774 1.00 0.00 N ATOM 681 CA ILE A 51 11.602 -30.912 -7.014 1.00 0.00 C ATOM 682 C ILE A 51 12.253 -29.725 -6.300 1.00 0.00 C ATOM 683 O ILE A 51 13.221 -29.876 -5.581 1.00 0.00 O ATOM 684 CB ILE A 51 11.873 -30.821 -8.519 1.00 0.00 C ATOM 685 CG1 ILE A 51 11.534 -32.158 -9.180 1.00 0.00 C ATOM 686 CG2 ILE A 51 13.349 -30.497 -8.755 1.00 0.00 C ATOM 687 CD1 ILE A 51 11.653 -32.020 -10.700 1.00 0.00 C ATOM 0 H ILE A 51 9.561 -30.678 -7.592 1.00 0.00 H new ATOM 0 HA ILE A 51 12.022 -31.840 -6.626 1.00 0.00 H new ATOM 0 HB ILE A 51 11.255 -30.034 -8.951 1.00 0.00 H new ATOM 0 HG12 ILE A 51 12.209 -32.935 -8.821 1.00 0.00 H new ATOM 0 HG13 ILE A 51 10.523 -32.464 -8.910 1.00 0.00 H new ATOM 0 HG21 ILE A 51 13.541 -30.433 -9.826 1.00 0.00 H new ATOM 0 HG22 ILE A 51 13.592 -29.544 -8.285 1.00 0.00 H new ATOM 0 HG23 ILE A 51 13.968 -31.283 -8.322 1.00 0.00 H new ATOM 0 HD11 ILE A 51 11.412 -32.972 -11.172 1.00 0.00 H new ATOM 0 HD12 ILE A 51 10.960 -31.255 -11.051 1.00 0.00 H new ATOM 0 HD13 ILE A 51 12.672 -31.734 -10.961 1.00 0.00 H new ATOM 699 N HIS A 52 11.732 -28.544 -6.492 1.00 0.00 N ATOM 700 CA HIS A 52 12.324 -27.351 -5.823 1.00 0.00 C ATOM 701 C HIS A 52 12.403 -27.599 -4.315 1.00 0.00 C ATOM 702 O HIS A 52 13.421 -27.365 -3.692 1.00 0.00 O ATOM 703 CB HIS A 52 11.448 -26.125 -6.094 1.00 0.00 C ATOM 704 CG HIS A 52 12.078 -24.913 -5.465 1.00 0.00 C ATOM 705 ND1 HIS A 52 13.283 -24.390 -5.910 1.00 0.00 N ATOM 706 CD2 HIS A 52 11.684 -24.109 -4.425 1.00 0.00 C ATOM 707 CE1 HIS A 52 13.568 -23.320 -5.146 1.00 0.00 C ATOM 708 NE2 HIS A 52 12.625 -23.104 -4.225 1.00 0.00 N ATOM 0 H HIS A 52 10.923 -28.354 -7.083 1.00 0.00 H new ATOM 0 HA HIS A 52 13.326 -27.175 -6.215 1.00 0.00 H new ATOM 0 HB2 HIS A 52 11.336 -25.974 -7.168 1.00 0.00 H new ATOM 0 HB3 HIS A 52 10.449 -26.281 -5.688 1.00 0.00 H new ATOM 0 HD2 HIS A 52 10.780 -24.237 -3.849 1.00 0.00 H new ATOM 0 HE1 HIS A 52 14.452 -22.710 -5.263 1.00 0.00 H new ATOM 0 HE2 HIS A 52 12.600 -22.362 -3.526 1.00 0.00 H new ATOM 716 N GLY A 53 11.340 -28.067 -3.723 1.00 0.00 N ATOM 717 CA GLY A 53 11.359 -28.326 -2.256 1.00 0.00 C ATOM 718 C GLY A 53 10.057 -29.013 -1.840 1.00 0.00 C ATOM 719 O GLY A 53 9.340 -29.554 -2.659 1.00 0.00 O ATOM 0 H GLY A 53 10.459 -28.281 -4.191 1.00 0.00 H new ATOM 0 HA2 GLY A 53 12.212 -28.954 -1.998 1.00 0.00 H new ATOM 0 HA3 GLY A 53 11.477 -27.389 -1.712 1.00 0.00 H new ATOM 723 N GLU A 54 9.747 -28.998 -0.572 1.00 0.00 N ATOM 724 CA GLU A 54 8.493 -29.651 -0.104 1.00 0.00 C ATOM 725 C GLU A 54 7.416 -28.586 0.117 1.00 0.00 C ATOM 726 O GLU A 54 7.653 -27.571 0.740 1.00 0.00 O ATOM 727 CB GLU A 54 8.761 -30.385 1.211 1.00 0.00 C ATOM 728 CG GLU A 54 9.727 -31.546 0.961 1.00 0.00 C ATOM 729 CD GLU A 54 9.901 -32.352 2.250 1.00 0.00 C ATOM 730 OE1 GLU A 54 9.398 -31.914 3.271 1.00 0.00 O ATOM 731 OE2 GLU A 54 10.534 -33.393 2.194 1.00 0.00 O ATOM 0 H GLU A 54 10.308 -28.562 0.159 1.00 0.00 H new ATOM 0 HA GLU A 54 8.152 -30.363 -0.855 1.00 0.00 H new ATOM 0 HB2 GLU A 54 9.184 -29.698 1.944 1.00 0.00 H new ATOM 0 HB3 GLU A 54 7.826 -30.759 1.628 1.00 0.00 H new ATOM 0 HG2 GLU A 54 9.344 -32.187 0.167 1.00 0.00 H new ATOM 0 HG3 GLU A 54 10.691 -31.165 0.625 1.00 0.00 H new ATOM 738 N LYS A 55 6.234 -28.813 -0.387 1.00 0.00 N ATOM 739 CA LYS A 55 5.143 -27.814 -0.205 1.00 0.00 C ATOM 740 C LYS A 55 3.972 -28.467 0.531 1.00 0.00 C ATOM 741 O LYS A 55 3.594 -29.586 0.247 1.00 0.00 O ATOM 742 CB LYS A 55 4.672 -27.317 -1.574 1.00 0.00 C ATOM 743 CG LYS A 55 3.711 -26.141 -1.385 1.00 0.00 C ATOM 744 CD LYS A 55 4.495 -24.910 -0.927 1.00 0.00 C ATOM 745 CE LYS A 55 3.556 -23.704 -0.858 1.00 0.00 C ATOM 746 NZ LYS A 55 3.208 -23.265 -2.239 1.00 0.00 N ATOM 0 H LYS A 55 5.977 -29.646 -0.916 1.00 0.00 H new ATOM 0 HA LYS A 55 5.515 -26.972 0.379 1.00 0.00 H new ATOM 0 HB2 LYS A 55 5.527 -27.009 -2.175 1.00 0.00 H new ATOM 0 HB3 LYS A 55 4.176 -28.123 -2.115 1.00 0.00 H new ATOM 0 HG2 LYS A 55 3.192 -25.928 -2.320 1.00 0.00 H new ATOM 0 HG3 LYS A 55 2.949 -26.395 -0.648 1.00 0.00 H new ATOM 0 HD2 LYS A 55 4.942 -25.093 0.050 1.00 0.00 H new ATOM 0 HD3 LYS A 55 5.313 -24.708 -1.619 1.00 0.00 H new ATOM 0 HE2 LYS A 55 2.651 -23.965 -0.309 1.00 0.00 H new ATOM 0 HE3 LYS A 55 4.034 -22.888 -0.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 2.836 -22.294 -2.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 4.059 -23.293 -2.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 2.486 -23.901 -2.634 1.00 0.00 H new ATOM 760 N GLN A 56 3.397 -27.779 1.479 1.00 0.00 N ATOM 761 CA GLN A 56 2.252 -28.362 2.233 1.00 0.00 C ATOM 762 C GLN A 56 0.946 -27.723 1.758 1.00 0.00 C ATOM 763 O GLN A 56 0.777 -26.521 1.808 1.00 0.00 O ATOM 764 CB GLN A 56 2.436 -28.094 3.728 1.00 0.00 C ATOM 765 CG GLN A 56 1.224 -28.626 4.494 1.00 0.00 C ATOM 766 CD GLN A 56 1.413 -28.371 5.990 1.00 0.00 C ATOM 767 OE1 GLN A 56 2.418 -27.828 6.403 1.00 0.00 O ATOM 768 NE2 GLN A 56 0.482 -28.742 6.826 1.00 0.00 N ATOM 0 H GLN A 56 3.671 -26.839 1.764 1.00 0.00 H new ATOM 0 HA GLN A 56 2.214 -29.437 2.058 1.00 0.00 H new ATOM 0 HB2 GLN A 56 3.346 -28.576 4.086 1.00 0.00 H new ATOM 0 HB3 GLN A 56 2.551 -27.025 3.905 1.00 0.00 H new ATOM 0 HG2 GLN A 56 0.315 -28.137 4.143 1.00 0.00 H new ATOM 0 HG3 GLN A 56 1.103 -29.693 4.309 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -0.362 -29.198 6.480 1.00 0.00 H new ATOM 0 HE22 GLN A 56 0.599 -28.576 7.826 1.00 0.00 H new ATOM 777 N GLN A 57 0.017 -28.518 1.301 1.00 0.00 N ATOM 778 CA GLN A 57 -1.279 -27.955 0.826 1.00 0.00 C ATOM 779 C GLN A 57 -2.417 -28.523 1.675 1.00 0.00 C ATOM 780 O GLN A 57 -2.380 -29.661 2.100 1.00 0.00 O ATOM 781 CB GLN A 57 -1.497 -28.336 -0.639 1.00 0.00 C ATOM 782 CG GLN A 57 -0.330 -27.815 -1.481 1.00 0.00 C ATOM 783 CD GLN A 57 -0.718 -26.480 -2.121 1.00 0.00 C ATOM 784 OE1 GLN A 57 -1.519 -25.671 -1.483 1.00 0.00 O flip ATOM 785 NE2 GLN A 57 -0.287 -26.170 -3.213 1.00 0.00 N flip ATOM 0 H GLN A 57 0.099 -29.533 1.236 1.00 0.00 H new ATOM 0 HA GLN A 57 -1.260 -26.869 0.917 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -1.575 -29.419 -0.737 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -2.436 -27.915 -0.999 1.00 0.00 H new ATOM 0 HG2 GLN A 57 0.554 -27.688 -0.857 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -0.073 -28.540 -2.254 1.00 0.00 H new ATOM 0 HE21 GLN A 57 0.339 -26.802 -3.712 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -0.551 -25.278 -3.631 1.00 0.00 H new ATOM 794 N ASP A 58 -3.430 -27.739 1.926 1.00 0.00 N ATOM 795 CA ASP A 58 -4.569 -28.237 2.748 1.00 0.00 C ATOM 796 C ASP A 58 -5.732 -28.618 1.832 1.00 0.00 C ATOM 797 O ASP A 58 -5.853 -28.127 0.726 1.00 0.00 O ATOM 798 CB ASP A 58 -5.021 -27.136 3.711 1.00 0.00 C ATOM 799 CG ASP A 58 -3.877 -26.794 4.669 1.00 0.00 C ATOM 800 OD1 ASP A 58 -2.958 -27.590 4.770 1.00 0.00 O ATOM 801 OD2 ASP A 58 -3.940 -25.744 5.284 1.00 0.00 O ATOM 0 H ASP A 58 -3.518 -26.777 1.598 1.00 0.00 H new ATOM 0 HA ASP A 58 -4.252 -29.112 3.316 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -5.319 -26.249 3.152 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -5.894 -27.466 4.274 1.00 0.00 H new ATOM 806 N VAL A 59 -6.594 -29.490 2.282 1.00 0.00 N ATOM 807 CA VAL A 59 -7.750 -29.899 1.438 1.00 0.00 C ATOM 808 C VAL A 59 -8.990 -29.119 1.875 1.00 0.00 C ATOM 809 O VAL A 59 -9.271 -28.993 3.050 1.00 0.00 O ATOM 810 CB VAL A 59 -8.002 -31.399 1.608 1.00 0.00 C ATOM 811 CG1 VAL A 59 -9.128 -31.836 0.669 1.00 0.00 C ATOM 812 CG2 VAL A 59 -6.725 -32.172 1.271 1.00 0.00 C ATOM 0 H VAL A 59 -6.546 -29.936 3.198 1.00 0.00 H new ATOM 0 HA VAL A 59 -7.534 -29.687 0.391 1.00 0.00 H new ATOM 0 HB VAL A 59 -8.289 -31.606 2.639 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -9.308 -32.904 0.789 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -10.037 -31.285 0.910 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -8.842 -31.630 -0.362 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -6.904 -33.240 1.392 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -6.437 -31.967 0.240 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -5.924 -31.860 1.941 1.00 0.00 H new ATOM 822 N TYR A 60 -9.733 -28.588 0.942 1.00 0.00 N ATOM 823 CA TYR A 60 -10.948 -27.812 1.312 1.00 0.00 C ATOM 824 C TYR A 60 -12.175 -28.428 0.639 1.00 0.00 C ATOM 825 O TYR A 60 -12.098 -28.954 -0.453 1.00 0.00 O ATOM 826 CB TYR A 60 -10.788 -26.363 0.848 1.00 0.00 C ATOM 827 CG TYR A 60 -9.548 -25.762 1.471 1.00 0.00 C ATOM 828 CD1 TYR A 60 -8.285 -26.279 1.157 1.00 0.00 C ATOM 829 CD2 TYR A 60 -9.664 -24.688 2.362 1.00 0.00 C ATOM 830 CE1 TYR A 60 -7.138 -25.721 1.736 1.00 0.00 C ATOM 831 CE2 TYR A 60 -8.517 -24.132 2.939 1.00 0.00 C ATOM 832 CZ TYR A 60 -7.254 -24.648 2.626 1.00 0.00 C ATOM 833 OH TYR A 60 -6.123 -24.098 3.196 1.00 0.00 O ATOM 0 H TYR A 60 -9.550 -28.659 -0.059 1.00 0.00 H new ATOM 0 HA TYR A 60 -11.077 -27.837 2.394 1.00 0.00 H new ATOM 0 HB2 TYR A 60 -10.715 -26.325 -0.239 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -11.666 -25.782 1.129 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -8.195 -27.107 0.469 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -10.638 -24.289 2.604 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -6.164 -26.119 1.495 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -8.606 -23.304 3.627 1.00 0.00 H new ATOM 0 HH TYR A 60 -5.366 -24.197 2.582 1.00 0.00 H new ATOM 843 N TYR A 61 -13.310 -28.360 1.280 1.00 0.00 N ATOM 844 CA TYR A 61 -14.546 -28.934 0.677 1.00 0.00 C ATOM 845 C TYR A 61 -15.424 -27.793 0.163 1.00 0.00 C ATOM 846 O TYR A 61 -15.903 -26.977 0.926 1.00 0.00 O ATOM 847 CB TYR A 61 -15.310 -29.733 1.735 1.00 0.00 C ATOM 848 CG TYR A 61 -16.323 -30.629 1.062 1.00 0.00 C ATOM 849 CD1 TYR A 61 -15.916 -31.837 0.484 1.00 0.00 C ATOM 850 CD2 TYR A 61 -17.671 -30.251 1.016 1.00 0.00 C ATOM 851 CE1 TYR A 61 -16.856 -32.669 -0.139 1.00 0.00 C ATOM 852 CE2 TYR A 61 -18.610 -31.081 0.393 1.00 0.00 C ATOM 853 CZ TYR A 61 -18.203 -32.290 -0.184 1.00 0.00 C ATOM 854 OH TYR A 61 -19.129 -33.108 -0.799 1.00 0.00 O ATOM 0 H TYR A 61 -13.435 -27.931 2.197 1.00 0.00 H new ATOM 0 HA TYR A 61 -14.281 -29.595 -0.148 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -14.616 -30.331 2.325 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -15.812 -29.055 2.425 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -14.877 -32.128 0.518 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -17.986 -29.319 1.461 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -16.542 -33.602 -0.584 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -19.649 -30.789 0.357 1.00 0.00 H new ATOM 0 HH TYR A 61 -19.986 -33.043 -0.329 1.00 0.00 H new ATOM 864 N LEU A 62 -15.635 -27.721 -1.122 1.00 0.00 N ATOM 865 CA LEU A 62 -16.475 -26.620 -1.672 1.00 0.00 C ATOM 866 C LEU A 62 -17.668 -27.200 -2.434 1.00 0.00 C ATOM 867 O LEU A 62 -17.639 -28.323 -2.902 1.00 0.00 O ATOM 868 CB LEU A 62 -15.634 -25.763 -2.623 1.00 0.00 C ATOM 869 CG LEU A 62 -14.455 -25.150 -1.860 1.00 0.00 C ATOM 870 CD1 LEU A 62 -13.836 -24.027 -2.693 1.00 0.00 C ATOM 871 CD2 LEU A 62 -14.945 -24.579 -0.526 1.00 0.00 C ATOM 0 H LEU A 62 -15.264 -28.374 -1.813 1.00 0.00 H new ATOM 0 HA LEU A 62 -16.841 -26.007 -0.848 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -15.268 -26.372 -3.449 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -16.249 -24.974 -3.057 1.00 0.00 H new ATOM 0 HG LEU A 62 -13.708 -25.922 -1.673 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -12.997 -23.591 -2.150 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -13.483 -24.430 -3.642 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -14.585 -23.258 -2.881 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -14.104 -24.144 0.014 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -15.694 -23.809 -0.713 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -15.386 -25.377 0.071 1.00 0.00 H new ATOM 883 N THR A 63 -18.716 -26.432 -2.563 1.00 0.00 N ATOM 884 CA THR A 63 -19.919 -26.913 -3.298 1.00 0.00 C ATOM 885 C THR A 63 -20.113 -26.054 -4.548 1.00 0.00 C ATOM 886 O THR A 63 -20.180 -24.844 -4.475 1.00 0.00 O ATOM 887 CB THR A 63 -21.153 -26.785 -2.399 1.00 0.00 C ATOM 888 OG1 THR A 63 -21.003 -27.631 -1.266 1.00 0.00 O ATOM 889 CG2 THR A 63 -22.401 -27.194 -3.184 1.00 0.00 C ATOM 0 H THR A 63 -18.790 -25.486 -2.188 1.00 0.00 H new ATOM 0 HA THR A 63 -19.785 -27.957 -3.581 1.00 0.00 H new ATOM 0 HB THR A 63 -21.257 -25.752 -2.068 1.00 0.00 H new ATOM 0 HG1 THR A 63 -21.791 -27.549 -0.690 1.00 0.00 H new ATOM 0 HG21 THR A 63 -23.279 -27.103 -2.545 1.00 0.00 H new ATOM 0 HG22 THR A 63 -22.515 -26.544 -4.051 1.00 0.00 H new ATOM 0 HG23 THR A 63 -22.300 -28.227 -3.516 1.00 0.00 H new ATOM 897 N PHE A 64 -20.199 -26.665 -5.697 1.00 0.00 N ATOM 898 CA PHE A 64 -20.383 -25.872 -6.944 1.00 0.00 C ATOM 899 C PHE A 64 -21.189 -26.686 -7.958 1.00 0.00 C ATOM 900 O PHE A 64 -21.148 -27.899 -7.969 1.00 0.00 O ATOM 901 CB PHE A 64 -19.014 -25.533 -7.537 1.00 0.00 C ATOM 902 CG PHE A 64 -18.224 -26.804 -7.733 1.00 0.00 C ATOM 903 CD1 PHE A 64 -17.625 -27.433 -6.634 1.00 0.00 C ATOM 904 CD2 PHE A 64 -18.090 -27.355 -9.013 1.00 0.00 C ATOM 905 CE1 PHE A 64 -16.893 -28.613 -6.815 1.00 0.00 C ATOM 906 CE2 PHE A 64 -17.358 -28.535 -9.195 1.00 0.00 C ATOM 907 CZ PHE A 64 -16.759 -29.164 -8.096 1.00 0.00 C ATOM 0 H PHE A 64 -20.150 -27.676 -5.826 1.00 0.00 H new ATOM 0 HA PHE A 64 -20.919 -24.952 -6.712 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -19.136 -25.017 -8.489 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -18.476 -24.856 -6.874 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -17.728 -27.008 -5.647 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -18.551 -26.870 -9.860 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -16.432 -29.098 -5.967 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -17.255 -28.960 -10.183 1.00 0.00 H new ATOM 0 HZ PHE A 64 -16.194 -30.074 -8.236 1.00 0.00 H new ATOM 917 N LYS A 65 -21.920 -26.024 -8.813 1.00 0.00 N ATOM 918 CA LYS A 65 -22.725 -26.758 -9.829 1.00 0.00 C ATOM 919 C LYS A 65 -21.845 -27.063 -11.044 1.00 0.00 C ATOM 920 O LYS A 65 -21.136 -26.208 -11.537 1.00 0.00 O ATOM 921 CB LYS A 65 -23.914 -25.897 -10.261 1.00 0.00 C ATOM 922 CG LYS A 65 -24.802 -25.605 -9.050 1.00 0.00 C ATOM 923 CD LYS A 65 -26.051 -24.848 -9.506 1.00 0.00 C ATOM 924 CE LYS A 65 -26.766 -24.262 -8.287 1.00 0.00 C ATOM 925 NZ LYS A 65 -28.039 -23.619 -8.720 1.00 0.00 N ATOM 0 H LYS A 65 -21.994 -25.007 -8.852 1.00 0.00 H new ATOM 0 HA LYS A 65 -23.093 -27.690 -9.400 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -23.560 -24.964 -10.699 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -24.489 -26.412 -11.031 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -25.086 -26.537 -8.561 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -24.253 -25.014 -8.317 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -25.774 -24.051 -10.196 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -26.719 -25.519 -10.045 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -26.972 -25.048 -7.560 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -26.126 -23.531 -7.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -28.526 -23.220 -7.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -27.831 -22.859 -9.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -28.650 -24.329 -9.172 1.00 0.00 H new ATOM 939 N VAL A 66 -21.883 -28.273 -11.529 1.00 0.00 N ATOM 940 CA VAL A 66 -21.044 -28.625 -12.709 1.00 0.00 C ATOM 941 C VAL A 66 -21.937 -28.834 -13.933 1.00 0.00 C ATOM 942 O VAL A 66 -22.712 -29.769 -13.998 1.00 0.00 O ATOM 943 CB VAL A 66 -20.269 -29.911 -12.417 1.00 0.00 C ATOM 944 CG1 VAL A 66 -19.317 -30.205 -13.578 1.00 0.00 C ATOM 945 CG2 VAL A 66 -19.463 -29.738 -11.128 1.00 0.00 C ATOM 0 H VAL A 66 -22.457 -29.032 -11.161 1.00 0.00 H new ATOM 0 HA VAL A 66 -20.344 -27.814 -12.909 1.00 0.00 H new ATOM 0 HB VAL A 66 -20.968 -30.739 -12.300 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -18.764 -31.121 -13.372 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -19.890 -30.326 -14.497 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -18.618 -29.377 -13.694 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -18.910 -30.654 -10.919 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -18.763 -28.910 -11.245 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -20.141 -29.526 -10.301 1.00 0.00 H new ATOM 955 N GLN A 67 -21.835 -27.969 -14.904 1.00 0.00 N ATOM 956 CA GLN A 67 -22.674 -28.115 -16.127 1.00 0.00 C ATOM 957 C GLN A 67 -24.150 -28.028 -15.745 1.00 0.00 C ATOM 958 O GLN A 67 -25.019 -28.478 -16.465 1.00 0.00 O ATOM 959 CB GLN A 67 -22.388 -29.467 -16.784 1.00 0.00 C ATOM 960 CG GLN A 67 -20.924 -29.517 -17.228 1.00 0.00 C ATOM 961 CD GLN A 67 -20.632 -30.872 -17.876 1.00 0.00 C ATOM 962 OE1 GLN A 67 -21.379 -31.814 -17.705 1.00 0.00 O ATOM 963 NE2 GLN A 67 -19.568 -31.009 -18.620 1.00 0.00 N ATOM 0 H GLN A 67 -21.206 -27.166 -14.903 1.00 0.00 H new ATOM 0 HA GLN A 67 -22.437 -27.316 -16.830 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -22.595 -30.275 -16.083 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -23.045 -29.613 -17.642 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -20.720 -28.713 -17.935 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -20.268 -29.363 -16.371 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -18.941 -30.218 -18.764 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -19.364 -31.907 -19.058 1.00 0.00 H new ATOM 972 N GLY A 68 -24.438 -27.449 -14.614 1.00 0.00 N ATOM 973 CA GLY A 68 -25.857 -27.326 -14.177 1.00 0.00 C ATOM 974 C GLY A 68 -26.180 -28.456 -13.200 1.00 0.00 C ATOM 975 O GLY A 68 -27.324 -28.819 -13.007 1.00 0.00 O ATOM 0 H GLY A 68 -23.751 -27.055 -13.971 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -26.021 -26.359 -13.701 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -26.521 -27.374 -15.040 1.00 0.00 H new ATOM 979 N ARG A 69 -25.176 -29.018 -12.586 1.00 0.00 N ATOM 980 CA ARG A 69 -25.413 -30.128 -11.624 1.00 0.00 C ATOM 981 C ARG A 69 -24.735 -29.789 -10.291 1.00 0.00 C ATOM 982 O ARG A 69 -23.530 -29.666 -10.210 1.00 0.00 O ATOM 983 CB ARG A 69 -24.832 -31.424 -12.210 1.00 0.00 C ATOM 984 CG ARG A 69 -24.464 -32.400 -11.089 1.00 0.00 C ATOM 985 CD ARG A 69 -23.864 -33.671 -11.694 1.00 0.00 C ATOM 986 NE ARG A 69 -23.762 -34.722 -10.641 1.00 0.00 N ATOM 987 CZ ARG A 69 -24.831 -35.103 -9.996 1.00 0.00 C ATOM 988 NH1 ARG A 69 -25.952 -35.283 -10.640 1.00 0.00 N ATOM 989 NH2 ARG A 69 -24.778 -35.305 -8.709 1.00 0.00 N ATOM 0 H ARG A 69 -24.198 -28.755 -12.710 1.00 0.00 H new ATOM 0 HA ARG A 69 -26.481 -30.263 -11.451 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -25.559 -31.886 -12.879 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -23.949 -31.197 -12.807 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -23.750 -31.936 -10.409 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -25.349 -32.647 -10.502 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -24.486 -34.024 -12.516 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -22.878 -33.459 -12.108 1.00 0.00 H new ATOM 0 HE ARG A 69 -22.858 -35.143 -10.425 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -25.993 -35.126 -11.647 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -26.787 -35.581 -10.136 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -23.901 -35.165 -8.207 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -25.613 -35.603 -8.205 1.00 0.00 H new ATOM 1003 N LYS A 70 -25.502 -29.644 -9.244 1.00 0.00 N ATOM 1004 CA LYS A 70 -24.902 -29.318 -7.920 1.00 0.00 C ATOM 1005 C LYS A 70 -24.017 -30.480 -7.464 1.00 0.00 C ATOM 1006 O LYS A 70 -24.486 -31.576 -7.231 1.00 0.00 O ATOM 1007 CB LYS A 70 -26.016 -29.093 -6.896 1.00 0.00 C ATOM 1008 CG LYS A 70 -25.421 -28.498 -5.617 1.00 0.00 C ATOM 1009 CD LYS A 70 -26.523 -28.340 -4.567 1.00 0.00 C ATOM 1010 CE LYS A 70 -25.962 -27.610 -3.345 1.00 0.00 C ATOM 1011 NZ LYS A 70 -26.991 -26.676 -2.809 1.00 0.00 N ATOM 0 H LYS A 70 -26.518 -29.737 -9.249 1.00 0.00 H new ATOM 0 HA LYS A 70 -24.300 -28.413 -8.006 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -26.771 -28.421 -7.305 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -26.516 -30.036 -6.673 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -24.631 -29.145 -5.236 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -24.966 -27.531 -5.831 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -27.361 -27.782 -4.985 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -26.906 -29.318 -4.276 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -25.674 -28.330 -2.579 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -25.062 -27.059 -3.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -26.610 -26.180 -1.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -27.245 -25.982 -3.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -27.838 -27.213 -2.533 1.00 0.00 H new ATOM 1025 N VAL A 71 -22.738 -30.249 -7.335 1.00 0.00 N ATOM 1026 CA VAL A 71 -21.824 -31.342 -6.895 1.00 0.00 C ATOM 1027 C VAL A 71 -20.816 -30.789 -5.887 1.00 0.00 C ATOM 1028 O VAL A 71 -20.246 -29.733 -6.079 1.00 0.00 O ATOM 1029 CB VAL A 71 -21.081 -31.902 -8.108 1.00 0.00 C ATOM 1030 CG1 VAL A 71 -19.964 -32.838 -7.639 1.00 0.00 C ATOM 1031 CG2 VAL A 71 -22.059 -32.679 -8.990 1.00 0.00 C ATOM 0 H VAL A 71 -22.287 -29.352 -7.515 1.00 0.00 H new ATOM 0 HA VAL A 71 -22.405 -32.137 -6.427 1.00 0.00 H new ATOM 0 HB VAL A 71 -20.649 -31.080 -8.679 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -19.435 -33.236 -8.505 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -19.266 -32.285 -7.011 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -20.394 -33.660 -7.067 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -21.530 -33.079 -9.855 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -22.491 -33.500 -8.418 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -22.854 -32.013 -9.326 1.00 0.00 H new ATOM 1041 N GLU A 72 -20.590 -31.494 -4.812 1.00 0.00 N ATOM 1042 CA GLU A 72 -19.618 -31.008 -3.792 1.00 0.00 C ATOM 1043 C GLU A 72 -18.386 -31.912 -3.790 1.00 0.00 C ATOM 1044 O GLU A 72 -18.487 -33.116 -3.911 1.00 0.00 O ATOM 1045 CB GLU A 72 -20.271 -31.038 -2.410 1.00 0.00 C ATOM 1046 CG GLU A 72 -21.589 -30.268 -2.459 1.00 0.00 C ATOM 1047 CD GLU A 72 -22.360 -30.493 -1.157 1.00 0.00 C ATOM 1048 OE1 GLU A 72 -21.968 -31.370 -0.404 1.00 0.00 O ATOM 1049 OE2 GLU A 72 -23.328 -29.786 -0.934 1.00 0.00 O ATOM 0 H GLU A 72 -21.036 -32.385 -4.596 1.00 0.00 H new ATOM 0 HA GLU A 72 -19.321 -29.987 -4.033 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -20.449 -32.068 -2.101 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -19.605 -30.595 -1.670 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -21.396 -29.205 -2.601 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -22.185 -30.600 -3.309 1.00 0.00 H new ATOM 1056 N ALA A 73 -17.223 -31.341 -3.651 1.00 0.00 N ATOM 1057 CA ALA A 73 -15.987 -32.173 -3.642 1.00 0.00 C ATOM 1058 C ALA A 73 -14.845 -31.389 -2.995 1.00 0.00 C ATOM 1059 O ALA A 73 -14.947 -30.201 -2.764 1.00 0.00 O ATOM 1060 CB ALA A 73 -15.608 -32.534 -5.079 1.00 0.00 C ATOM 0 H ALA A 73 -17.074 -30.338 -3.544 1.00 0.00 H new ATOM 0 HA ALA A 73 -16.167 -33.084 -3.072 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -14.704 -33.143 -5.075 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -16.421 -33.095 -5.540 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -15.429 -31.622 -5.648 1.00 0.00 H new ATOM 1066 N GLU A 74 -13.755 -32.046 -2.708 1.00 0.00 N ATOM 1067 CA GLU A 74 -12.604 -31.341 -2.082 1.00 0.00 C ATOM 1068 C GLU A 74 -11.830 -30.588 -3.165 1.00 0.00 C ATOM 1069 O GLU A 74 -11.663 -31.069 -4.267 1.00 0.00 O ATOM 1070 CB GLU A 74 -11.680 -32.360 -1.411 1.00 0.00 C ATOM 1071 CG GLU A 74 -12.444 -33.089 -0.303 1.00 0.00 C ATOM 1072 CD GLU A 74 -11.509 -34.076 0.397 1.00 0.00 C ATOM 1073 OE1 GLU A 74 -10.459 -34.362 -0.157 1.00 0.00 O ATOM 1074 OE2 GLU A 74 -11.856 -34.528 1.476 1.00 0.00 O ATOM 0 H GLU A 74 -13.613 -33.041 -2.881 1.00 0.00 H new ATOM 0 HA GLU A 74 -12.969 -30.639 -1.333 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -11.315 -33.076 -2.147 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -10.807 -31.857 -0.995 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -12.836 -32.370 0.417 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -13.299 -33.618 -0.724 1.00 0.00 H new ATOM 1081 N VAL A 75 -11.362 -29.407 -2.865 1.00 0.00 N ATOM 1082 CA VAL A 75 -10.608 -28.633 -3.889 1.00 0.00 C ATOM 1083 C VAL A 75 -9.393 -27.965 -3.242 1.00 0.00 C ATOM 1084 O VAL A 75 -9.309 -27.839 -2.036 1.00 0.00 O ATOM 1085 CB VAL A 75 -11.525 -27.565 -4.493 1.00 0.00 C ATOM 1086 CG1 VAL A 75 -12.896 -28.180 -4.778 1.00 0.00 C ATOM 1087 CG2 VAL A 75 -11.686 -26.402 -3.511 1.00 0.00 C ATOM 0 H VAL A 75 -11.469 -28.948 -1.961 1.00 0.00 H new ATOM 0 HA VAL A 75 -10.267 -29.307 -4.675 1.00 0.00 H new ATOM 0 HB VAL A 75 -11.086 -27.195 -5.419 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -13.552 -27.423 -5.208 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -12.785 -29.006 -5.481 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -13.329 -28.550 -3.849 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -12.339 -25.646 -3.946 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -12.123 -26.768 -2.582 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -10.710 -25.963 -3.304 1.00 0.00 H new ATOM 1097 N LEU A 76 -8.453 -27.530 -4.036 1.00 0.00 N ATOM 1098 CA LEU A 76 -7.247 -26.865 -3.467 1.00 0.00 C ATOM 1099 C LEU A 76 -7.184 -25.419 -3.962 1.00 0.00 C ATOM 1100 O LEU A 76 -7.586 -25.113 -5.067 1.00 0.00 O ATOM 1101 CB LEU A 76 -5.991 -27.613 -3.915 1.00 0.00 C ATOM 1102 CG LEU A 76 -4.770 -27.027 -3.205 1.00 0.00 C ATOM 1103 CD1 LEU A 76 -4.759 -27.487 -1.746 1.00 0.00 C ATOM 1104 CD2 LEU A 76 -3.495 -27.507 -3.901 1.00 0.00 C ATOM 0 H LEU A 76 -8.468 -27.606 -5.053 1.00 0.00 H new ATOM 0 HA LEU A 76 -7.305 -26.876 -2.379 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -6.085 -28.674 -3.684 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -5.871 -27.531 -4.995 1.00 0.00 H new ATOM 0 HG LEU A 76 -4.816 -25.939 -3.243 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -3.889 -27.070 -1.239 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -5.667 -27.144 -1.250 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -4.713 -28.575 -1.708 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -2.625 -27.089 -3.395 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -3.448 -28.595 -3.864 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -3.502 -27.179 -4.940 1.00 0.00 H new ATOM 1116 N ALA A 77 -6.681 -24.526 -3.154 1.00 0.00 N ATOM 1117 CA ALA A 77 -6.593 -23.102 -3.583 1.00 0.00 C ATOM 1118 C ALA A 77 -5.377 -22.920 -4.492 1.00 0.00 C ATOM 1119 O ALA A 77 -4.268 -23.269 -4.140 1.00 0.00 O ATOM 1120 CB ALA A 77 -6.450 -22.204 -2.353 1.00 0.00 C ATOM 0 H ALA A 77 -6.328 -24.721 -2.217 1.00 0.00 H new ATOM 0 HA ALA A 77 -7.498 -22.830 -4.126 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -6.386 -21.163 -2.668 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -7.317 -22.334 -1.705 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -5.546 -22.475 -1.808 1.00 0.00 H new ATOM 1126 N SER A 78 -5.577 -22.379 -5.664 1.00 0.00 N ATOM 1127 CA SER A 78 -4.435 -22.179 -6.599 1.00 0.00 C ATOM 1128 C SER A 78 -4.486 -20.759 -7.171 1.00 0.00 C ATOM 1129 O SER A 78 -5.540 -20.166 -7.284 1.00 0.00 O ATOM 1130 CB SER A 78 -4.536 -23.193 -7.740 1.00 0.00 C ATOM 1131 OG SER A 78 -3.235 -23.508 -8.213 1.00 0.00 O ATOM 0 H SER A 78 -6.483 -22.067 -6.013 1.00 0.00 H new ATOM 0 HA SER A 78 -3.495 -22.320 -6.066 1.00 0.00 H new ATOM 0 HB2 SER A 78 -5.037 -24.097 -7.393 1.00 0.00 H new ATOM 0 HB3 SER A 78 -5.140 -22.785 -8.551 1.00 0.00 H new ATOM 0 HG SER A 78 -3.164 -23.266 -9.160 1.00 0.00 H new ATOM 1137 N PRO A 79 -3.321 -20.207 -7.540 1.00 0.00 N ATOM 1138 CA PRO A 79 -3.230 -18.855 -8.105 1.00 0.00 C ATOM 1139 C PRO A 79 -3.837 -18.784 -9.510 1.00 0.00 C ATOM 1140 O PRO A 79 -3.869 -17.739 -10.131 1.00 0.00 O ATOM 1141 CB PRO A 79 -1.725 -18.594 -8.171 1.00 0.00 C ATOM 1142 CG PRO A 79 -1.112 -19.952 -8.243 1.00 0.00 C ATOM 1143 CD PRO A 79 -2.001 -20.856 -7.436 1.00 0.00 C ATOM 0 HA PRO A 79 -3.776 -18.125 -7.508 1.00 0.00 H new ATOM 0 HB2 PRO A 79 -1.464 -17.994 -9.043 1.00 0.00 H new ATOM 0 HB3 PRO A 79 -1.378 -18.048 -7.294 1.00 0.00 H new ATOM 0 HG2 PRO A 79 -1.043 -20.294 -9.276 1.00 0.00 H new ATOM 0 HG3 PRO A 79 -0.098 -19.943 -7.842 1.00 0.00 H new ATOM 0 HD2 PRO A 79 -2.017 -21.869 -7.838 1.00 0.00 H new ATOM 0 HD3 PRO A 79 -1.668 -20.929 -6.401 1.00 0.00 H new ATOM 1151 N TYR A 80 -4.322 -19.886 -10.015 1.00 0.00 N ATOM 1152 CA TYR A 80 -4.927 -19.878 -11.376 1.00 0.00 C ATOM 1153 C TYR A 80 -6.090 -18.884 -11.409 1.00 0.00 C ATOM 1154 O TYR A 80 -6.518 -18.382 -10.389 1.00 0.00 O ATOM 1155 CB TYR A 80 -5.448 -21.278 -11.712 1.00 0.00 C ATOM 1156 CG TYR A 80 -4.302 -22.262 -11.691 1.00 0.00 C ATOM 1157 CD1 TYR A 80 -3.169 -22.035 -12.480 1.00 0.00 C ATOM 1158 CD2 TYR A 80 -4.375 -23.402 -10.881 1.00 0.00 C ATOM 1159 CE1 TYR A 80 -2.108 -22.949 -12.461 1.00 0.00 C ATOM 1160 CE2 TYR A 80 -3.315 -24.316 -10.862 1.00 0.00 C ATOM 1161 CZ TYR A 80 -2.181 -24.089 -11.651 1.00 0.00 C ATOM 1162 OH TYR A 80 -1.136 -24.991 -11.633 1.00 0.00 O ATOM 0 H TYR A 80 -4.325 -20.791 -9.544 1.00 0.00 H new ATOM 0 HA TYR A 80 -4.173 -19.585 -12.107 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -6.210 -21.576 -10.992 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -5.921 -21.275 -12.694 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -3.113 -21.155 -13.104 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -5.249 -23.576 -10.271 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -1.234 -22.775 -13.071 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -3.372 -25.196 -10.239 1.00 0.00 H new ATOM 0 HH TYR A 80 -1.347 -25.724 -11.018 1.00 0.00 H new ATOM 1172 N ASP A 81 -6.606 -18.598 -12.572 1.00 0.00 N ATOM 1173 CA ASP A 81 -7.742 -17.639 -12.667 1.00 0.00 C ATOM 1174 C ASP A 81 -9.004 -18.386 -13.100 1.00 0.00 C ATOM 1175 O ASP A 81 -9.933 -17.803 -13.623 1.00 0.00 O ATOM 1176 CB ASP A 81 -7.411 -16.555 -13.695 1.00 0.00 C ATOM 1177 CG ASP A 81 -7.113 -17.206 -15.047 1.00 0.00 C ATOM 1178 OD1 ASP A 81 -7.231 -18.416 -15.138 1.00 0.00 O ATOM 1179 OD2 ASP A 81 -6.772 -16.483 -15.969 1.00 0.00 O ATOM 0 H ASP A 81 -6.290 -18.987 -13.461 1.00 0.00 H new ATOM 0 HA ASP A 81 -7.910 -17.176 -11.694 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -8.247 -15.862 -13.790 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -6.551 -15.974 -13.362 1.00 0.00 H new ATOM 1184 N TYR A 82 -9.049 -19.672 -12.885 1.00 0.00 N ATOM 1185 CA TYR A 82 -10.253 -20.452 -13.285 1.00 0.00 C ATOM 1186 C TYR A 82 -10.450 -21.618 -12.313 1.00 0.00 C ATOM 1187 O TYR A 82 -9.951 -21.605 -11.205 1.00 0.00 O ATOM 1188 CB TYR A 82 -10.064 -20.992 -14.704 1.00 0.00 C ATOM 1189 CG TYR A 82 -9.044 -22.106 -14.686 1.00 0.00 C ATOM 1190 CD1 TYR A 82 -7.684 -21.807 -14.544 1.00 0.00 C ATOM 1191 CD2 TYR A 82 -9.459 -23.436 -14.810 1.00 0.00 C ATOM 1192 CE1 TYR A 82 -6.740 -22.838 -14.524 1.00 0.00 C ATOM 1193 CE2 TYR A 82 -8.514 -24.469 -14.791 1.00 0.00 C ATOM 1194 CZ TYR A 82 -7.154 -24.170 -14.649 1.00 0.00 C ATOM 1195 OH TYR A 82 -6.222 -25.188 -14.628 1.00 0.00 O ATOM 0 H TYR A 82 -8.304 -20.216 -12.450 1.00 0.00 H new ATOM 0 HA TYR A 82 -11.131 -19.806 -13.259 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -11.013 -21.359 -15.094 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -9.734 -20.193 -15.368 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -7.364 -20.780 -14.450 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -10.508 -23.666 -14.920 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -5.691 -22.607 -14.412 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -8.834 -25.496 -14.886 1.00 0.00 H new ATOM 0 HH TYR A 82 -5.350 -24.828 -14.362 1.00 0.00 H new ATOM 1205 N ILE A 83 -11.173 -22.625 -12.717 1.00 0.00 N ATOM 1206 CA ILE A 83 -11.400 -23.787 -11.813 1.00 0.00 C ATOM 1207 C ILE A 83 -10.973 -25.078 -12.514 1.00 0.00 C ATOM 1208 O ILE A 83 -11.200 -25.261 -13.694 1.00 0.00 O ATOM 1209 CB ILE A 83 -12.885 -23.876 -11.453 1.00 0.00 C ATOM 1210 CG1 ILE A 83 -13.423 -22.482 -11.123 1.00 0.00 C ATOM 1211 CG2 ILE A 83 -13.059 -24.789 -10.237 1.00 0.00 C ATOM 1212 CD1 ILE A 83 -14.885 -22.390 -11.557 1.00 0.00 C ATOM 0 H ILE A 83 -11.616 -22.694 -13.633 1.00 0.00 H new ATOM 0 HA ILE A 83 -10.811 -23.654 -10.906 1.00 0.00 H new ATOM 0 HB ILE A 83 -13.437 -24.283 -12.300 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -13.336 -22.290 -10.054 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -12.832 -21.721 -11.633 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -14.116 -24.854 -9.979 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -12.681 -25.784 -10.472 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -12.504 -24.380 -9.393 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -15.272 -21.398 -11.324 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -14.958 -22.564 -12.631 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -15.470 -23.142 -11.027 1.00 0.00 H new ATOM 1224 N LEU A 84 -10.362 -25.977 -11.794 1.00 0.00 N ATOM 1225 CA LEU A 84 -9.925 -27.260 -12.411 1.00 0.00 C ATOM 1226 C LEU A 84 -10.850 -28.383 -11.936 1.00 0.00 C ATOM 1227 O LEU A 84 -11.111 -28.529 -10.759 1.00 0.00 O ATOM 1228 CB LEU A 84 -8.487 -27.566 -11.986 1.00 0.00 C ATOM 1229 CG LEU A 84 -7.537 -26.569 -12.653 1.00 0.00 C ATOM 1230 CD1 LEU A 84 -7.682 -25.202 -11.982 1.00 0.00 C ATOM 1231 CD2 LEU A 84 -6.095 -27.059 -12.504 1.00 0.00 C ATOM 0 H LEU A 84 -10.146 -25.878 -10.802 1.00 0.00 H new ATOM 0 HA LEU A 84 -9.970 -27.182 -13.497 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -8.395 -27.503 -10.902 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -8.221 -28.584 -12.270 1.00 0.00 H new ATOM 0 HG LEU A 84 -7.784 -26.484 -13.711 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -7.006 -24.490 -12.456 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -8.709 -24.852 -12.087 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -7.435 -25.288 -10.924 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -5.418 -26.349 -12.979 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -5.847 -27.144 -11.446 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -5.991 -28.034 -12.981 1.00 0.00 H new ATOM 1243 N LEU A 85 -11.355 -29.173 -12.844 1.00 0.00 N ATOM 1244 CA LEU A 85 -12.268 -30.279 -12.438 1.00 0.00 C ATOM 1245 C LEU A 85 -11.581 -31.625 -12.674 1.00 0.00 C ATOM 1246 O LEU A 85 -10.975 -31.852 -13.703 1.00 0.00 O ATOM 1247 CB LEU A 85 -13.556 -30.210 -13.266 1.00 0.00 C ATOM 1248 CG LEU A 85 -14.008 -28.751 -13.412 1.00 0.00 C ATOM 1249 CD1 LEU A 85 -13.868 -28.025 -12.071 1.00 0.00 C ATOM 1250 CD2 LEU A 85 -13.147 -28.050 -14.464 1.00 0.00 C ATOM 0 H LEU A 85 -11.176 -29.101 -13.846 1.00 0.00 H new ATOM 0 HA LEU A 85 -12.510 -30.177 -11.380 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -13.389 -30.648 -14.250 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -14.339 -30.796 -12.785 1.00 0.00 H new ATOM 0 HG LEU A 85 -15.052 -28.731 -13.724 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -14.191 -26.990 -12.182 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -14.487 -28.520 -11.323 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -12.826 -28.048 -11.752 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -13.469 -27.014 -14.566 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -12.102 -28.076 -14.155 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -13.255 -28.560 -15.421 1.00 0.00 H new ATOM 1262 N ASN A 86 -11.669 -32.521 -11.728 1.00 0.00 N ATOM 1263 CA ASN A 86 -11.021 -33.851 -11.896 1.00 0.00 C ATOM 1264 C ASN A 86 -12.053 -34.871 -12.375 1.00 0.00 C ATOM 1265 O ASN A 86 -13.240 -34.700 -12.191 1.00 0.00 O ATOM 1266 CB ASN A 86 -10.437 -34.318 -10.560 1.00 0.00 C ATOM 1267 CG ASN A 86 -11.434 -34.047 -9.430 1.00 0.00 C ATOM 1268 OD1 ASN A 86 -12.461 -33.436 -9.640 1.00 0.00 O ATOM 1269 ND2 ASN A 86 -11.169 -34.483 -8.228 1.00 0.00 N ATOM 0 H ASN A 86 -12.163 -32.388 -10.845 1.00 0.00 H new ATOM 0 HA ASN A 86 -10.222 -33.764 -12.632 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -10.207 -35.383 -10.606 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -9.500 -33.798 -10.362 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -11.825 -34.310 -7.467 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -10.306 -34.997 -8.051 1.00 0.00 H new ATOM 1276 N PRO A 87 -11.578 -35.961 -12.995 1.00 0.00 N ATOM 1277 CA PRO A 87 -12.450 -37.027 -13.502 1.00 0.00 C ATOM 1278 C PRO A 87 -13.100 -37.807 -12.359 1.00 0.00 C ATOM 1279 O PRO A 87 -14.105 -38.467 -12.533 1.00 0.00 O ATOM 1280 CB PRO A 87 -11.494 -37.931 -14.280 1.00 0.00 C ATOM 1281 CG PRO A 87 -10.160 -37.684 -13.661 1.00 0.00 C ATOM 1282 CD PRO A 87 -10.155 -36.239 -13.248 1.00 0.00 C ATOM 0 HA PRO A 87 -13.271 -36.639 -14.105 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -11.782 -38.979 -14.197 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -11.491 -37.685 -15.342 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -10.002 -38.336 -12.802 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -9.357 -37.890 -14.369 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -9.548 -36.076 -12.358 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -9.752 -35.597 -14.031 1.00 0.00 H new ATOM 1290 N SER A 88 -12.533 -37.731 -11.186 1.00 0.00 N ATOM 1291 CA SER A 88 -13.115 -38.459 -10.027 1.00 0.00 C ATOM 1292 C SER A 88 -14.346 -37.704 -9.529 1.00 0.00 C ATOM 1293 O SER A 88 -15.325 -38.292 -9.117 1.00 0.00 O ATOM 1294 CB SER A 88 -12.080 -38.542 -8.905 1.00 0.00 C ATOM 1295 OG SER A 88 -11.929 -37.263 -8.305 1.00 0.00 O ATOM 0 H SER A 88 -11.690 -37.194 -10.982 1.00 0.00 H new ATOM 0 HA SER A 88 -13.399 -39.466 -10.331 1.00 0.00 H new ATOM 0 HB2 SER A 88 -12.395 -39.271 -8.158 1.00 0.00 H new ATOM 0 HB3 SER A 88 -11.124 -38.885 -9.302 1.00 0.00 H new ATOM 0 HG SER A 88 -11.267 -37.316 -7.585 1.00 0.00 H new ATOM 1301 N ASP A 89 -14.304 -36.400 -9.571 1.00 0.00 N ATOM 1302 CA ASP A 89 -15.473 -35.603 -9.108 1.00 0.00 C ATOM 1303 C ASP A 89 -16.530 -35.588 -10.211 1.00 0.00 C ATOM 1304 O ASP A 89 -17.716 -35.545 -9.950 1.00 0.00 O ATOM 1305 CB ASP A 89 -15.031 -34.170 -8.802 1.00 0.00 C ATOM 1306 CG ASP A 89 -14.071 -34.176 -7.611 1.00 0.00 C ATOM 1307 OD1 ASP A 89 -14.001 -35.190 -6.936 1.00 0.00 O ATOM 1308 OD2 ASP A 89 -13.422 -33.166 -7.394 1.00 0.00 O ATOM 0 H ASP A 89 -13.511 -35.853 -9.906 1.00 0.00 H new ATOM 0 HA ASP A 89 -15.888 -36.049 -8.204 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -14.543 -33.735 -9.674 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -15.899 -33.550 -8.580 1.00 0.00 H new ATOM 1313 N VAL A 90 -16.107 -35.626 -11.445 1.00 0.00 N ATOM 1314 CA VAL A 90 -17.093 -35.619 -12.566 1.00 0.00 C ATOM 1315 C VAL A 90 -16.940 -36.899 -13.389 1.00 0.00 C ATOM 1316 O VAL A 90 -16.460 -36.876 -14.505 1.00 0.00 O ATOM 1317 CB VAL A 90 -16.853 -34.404 -13.464 1.00 0.00 C ATOM 1318 CG1 VAL A 90 -17.676 -33.220 -12.952 1.00 0.00 C ATOM 1319 CG2 VAL A 90 -15.369 -34.036 -13.452 1.00 0.00 C ATOM 0 H VAL A 90 -15.127 -35.661 -11.726 1.00 0.00 H new ATOM 0 HA VAL A 90 -18.101 -35.567 -12.155 1.00 0.00 H new ATOM 0 HB VAL A 90 -17.155 -34.645 -14.483 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -17.505 -32.354 -13.592 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -18.735 -33.479 -12.967 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -17.375 -32.982 -11.932 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -15.204 -33.170 -14.093 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -15.061 -33.798 -12.434 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -14.782 -34.878 -13.821 1.00 0.00 H new ATOM 1329 N PRO A 91 -17.363 -38.038 -12.821 1.00 0.00 N ATOM 1330 CA PRO A 91 -17.280 -39.340 -13.495 1.00 0.00 C ATOM 1331 C PRO A 91 -18.269 -39.441 -14.660 1.00 0.00 C ATOM 1332 O PRO A 91 -18.117 -40.257 -15.548 1.00 0.00 O ATOM 1333 CB PRO A 91 -17.663 -40.334 -12.399 1.00 0.00 C ATOM 1334 CG PRO A 91 -18.499 -39.544 -11.450 1.00 0.00 C ATOM 1335 CD PRO A 91 -17.954 -38.144 -11.476 1.00 0.00 C ATOM 0 HA PRO A 91 -16.294 -39.516 -13.925 1.00 0.00 H new ATOM 0 HB2 PRO A 91 -18.217 -41.179 -12.807 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -16.780 -40.740 -11.906 1.00 0.00 H new ATOM 0 HG2 PRO A 91 -19.547 -39.559 -11.749 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -18.448 -39.963 -10.445 1.00 0.00 H new ATOM 0 HD2 PRO A 91 -18.739 -37.403 -11.321 1.00 0.00 H new ATOM 0 HD3 PRO A 91 -17.209 -37.987 -10.695 1.00 0.00 H new ATOM 1343 N TRP A 92 -19.282 -38.617 -14.664 1.00 0.00 N ATOM 1344 CA TRP A 92 -20.279 -38.666 -15.771 1.00 0.00 C ATOM 1345 C TRP A 92 -19.724 -37.932 -16.993 1.00 0.00 C ATOM 1346 O TRP A 92 -19.999 -38.289 -18.121 1.00 0.00 O ATOM 1347 CB TRP A 92 -21.576 -37.992 -15.316 1.00 0.00 C ATOM 1348 CG TRP A 92 -21.285 -36.589 -14.890 1.00 0.00 C ATOM 1349 CD1 TRP A 92 -21.253 -35.517 -15.715 1.00 0.00 C ATOM 1350 CD2 TRP A 92 -20.985 -36.087 -13.555 1.00 0.00 C ATOM 1351 NE1 TRP A 92 -20.954 -34.389 -14.972 1.00 0.00 N ATOM 1352 CE2 TRP A 92 -20.780 -34.689 -13.634 1.00 0.00 C ATOM 1353 CE3 TRP A 92 -20.874 -36.704 -12.296 1.00 0.00 C ATOM 1354 CZ2 TRP A 92 -20.474 -33.930 -12.504 1.00 0.00 C ATOM 1355 CZ3 TRP A 92 -20.566 -35.943 -11.156 1.00 0.00 C ATOM 1356 CH2 TRP A 92 -20.367 -34.559 -11.260 1.00 0.00 C ATOM 0 H TRP A 92 -19.462 -37.912 -13.949 1.00 0.00 H new ATOM 0 HA TRP A 92 -20.480 -39.705 -16.034 1.00 0.00 H new ATOM 0 HB2 TRP A 92 -22.303 -37.994 -16.128 1.00 0.00 H new ATOM 0 HB3 TRP A 92 -22.018 -38.550 -14.491 1.00 0.00 H new ATOM 0 HD1 TRP A 92 -21.432 -35.538 -16.780 1.00 0.00 H new ATOM 0 HE1 TRP A 92 -20.872 -33.451 -15.364 1.00 0.00 H new ATOM 0 HE3 TRP A 92 -21.026 -37.769 -12.205 1.00 0.00 H new ATOM 0 HZ2 TRP A 92 -20.321 -32.864 -12.590 1.00 0.00 H new ATOM 0 HZ3 TRP A 92 -20.482 -36.427 -10.194 1.00 0.00 H new ATOM 0 HH2 TRP A 92 -20.131 -33.979 -10.380 1.00 0.00 H new ATOM 1367 N LEU A 93 -18.945 -36.907 -16.777 1.00 0.00 N ATOM 1368 CA LEU A 93 -18.371 -36.151 -17.926 1.00 0.00 C ATOM 1369 C LEU A 93 -17.872 -37.136 -18.985 1.00 0.00 C ATOM 1370 O LEU A 93 -18.067 -36.942 -20.169 1.00 0.00 O ATOM 1371 CB LEU A 93 -17.204 -35.291 -17.439 1.00 0.00 C ATOM 1372 CG LEU A 93 -16.684 -34.432 -18.593 1.00 0.00 C ATOM 1373 CD1 LEU A 93 -16.776 -32.954 -18.210 1.00 0.00 C ATOM 1374 CD2 LEU A 93 -15.225 -34.794 -18.882 1.00 0.00 C ATOM 0 H LEU A 93 -18.681 -36.561 -15.855 1.00 0.00 H new ATOM 0 HA LEU A 93 -19.138 -35.509 -18.359 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -17.527 -34.655 -16.615 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -16.405 -35.927 -17.057 1.00 0.00 H new ATOM 0 HG LEU A 93 -17.287 -34.615 -19.482 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -16.406 -32.341 -19.032 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -17.815 -32.695 -18.004 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -16.173 -32.770 -17.320 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -14.854 -34.182 -19.704 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -14.622 -34.611 -17.993 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -15.159 -35.847 -19.155 1.00 0.00 H new ATOM 1386 N MET A 94 -17.229 -38.191 -18.567 1.00 0.00 N ATOM 1387 CA MET A 94 -16.719 -39.190 -19.548 1.00 0.00 C ATOM 1388 C MET A 94 -17.851 -40.141 -19.943 1.00 0.00 C ATOM 1389 O MET A 94 -18.511 -40.719 -19.103 1.00 0.00 O ATOM 1390 CB MET A 94 -15.580 -39.991 -18.914 1.00 0.00 C ATOM 1391 CG MET A 94 -14.379 -39.071 -18.681 1.00 0.00 C ATOM 1392 SD MET A 94 -12.945 -40.064 -18.197 1.00 0.00 S ATOM 1393 CE MET A 94 -13.660 -40.778 -16.695 1.00 0.00 C ATOM 0 H MET A 94 -17.035 -38.405 -17.589 1.00 0.00 H new ATOM 0 HA MET A 94 -16.352 -38.673 -20.435 1.00 0.00 H new ATOM 0 HB2 MET A 94 -15.908 -40.425 -17.970 1.00 0.00 H new ATOM 0 HB3 MET A 94 -15.297 -40.819 -19.564 1.00 0.00 H new ATOM 0 HG2 MET A 94 -14.156 -38.509 -19.588 1.00 0.00 H new ATOM 0 HG3 MET A 94 -14.610 -38.343 -17.903 1.00 0.00 H new ATOM 0 HE1 MET A 94 -12.870 -40.958 -15.966 1.00 0.00 H new ATOM 0 HE2 MET A 94 -14.391 -40.086 -16.276 1.00 0.00 H new ATOM 0 HE3 MET A 94 -14.150 -41.721 -16.938 1.00 0.00 H new ATOM 1403 N LYS A 95 -18.082 -40.308 -21.217 1.00 0.00 N ATOM 1404 CA LYS A 95 -19.171 -41.221 -21.663 1.00 0.00 C ATOM 1405 C LYS A 95 -18.879 -42.642 -21.174 1.00 0.00 C ATOM 1406 O LYS A 95 -19.772 -43.376 -20.799 1.00 0.00 O ATOM 1407 CB LYS A 95 -19.251 -41.214 -23.190 1.00 0.00 C ATOM 1408 CG LYS A 95 -19.686 -39.828 -23.671 1.00 0.00 C ATOM 1409 CD LYS A 95 -19.916 -39.861 -25.184 1.00 0.00 C ATOM 1410 CE LYS A 95 -20.251 -38.453 -25.679 1.00 0.00 C ATOM 1411 NZ LYS A 95 -20.290 -38.448 -27.168 1.00 0.00 N ATOM 0 H LYS A 95 -17.563 -39.851 -21.967 1.00 0.00 H new ATOM 0 HA LYS A 95 -20.120 -40.882 -21.248 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -18.282 -41.471 -23.617 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -19.960 -41.968 -23.531 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -20.600 -39.524 -23.160 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -18.923 -39.090 -23.425 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -19.025 -40.234 -25.690 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -20.729 -40.546 -25.424 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -21.213 -38.134 -25.278 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -19.505 -37.743 -25.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -20.518 -37.491 -27.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -19.362 -38.735 -27.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -21.017 -39.114 -27.498 1.00 0.00 H new ATOM 1425 N LYS A 96 -17.634 -43.035 -21.175 1.00 0.00 N ATOM 1426 CA LYS A 96 -17.287 -44.407 -20.710 1.00 0.00 C ATOM 1427 C LYS A 96 -16.054 -44.344 -19.806 1.00 0.00 C ATOM 1428 O LYS A 96 -15.240 -43.448 -19.915 1.00 0.00 O ATOM 1429 CB LYS A 96 -16.989 -45.297 -21.919 1.00 0.00 C ATOM 1430 CG LYS A 96 -16.057 -44.555 -22.880 1.00 0.00 C ATOM 1431 CD LYS A 96 -16.213 -45.136 -24.288 1.00 0.00 C ATOM 1432 CE LYS A 96 -17.112 -44.221 -25.121 1.00 0.00 C ATOM 1433 NZ LYS A 96 -17.497 -44.918 -26.381 1.00 0.00 N ATOM 0 H LYS A 96 -16.844 -42.466 -21.477 1.00 0.00 H new ATOM 0 HA LYS A 96 -18.126 -44.823 -20.151 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -16.526 -46.229 -21.593 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -17.916 -45.562 -22.427 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -16.294 -43.491 -22.885 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -15.023 -44.650 -22.548 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -15.237 -45.234 -24.763 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -16.644 -46.136 -24.235 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -18.003 -43.954 -24.553 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -16.590 -43.292 -25.351 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -18.108 -44.297 -26.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -16.641 -45.151 -26.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -18.010 -45.793 -26.151 1.00 0.00 H new ATOM 1447 N PRO A 97 -15.920 -45.319 -18.896 1.00 0.00 N ATOM 1448 CA PRO A 97 -14.788 -45.384 -17.963 1.00 0.00 C ATOM 1449 C PRO A 97 -13.478 -45.727 -18.680 1.00 0.00 C ATOM 1450 O PRO A 97 -13.472 -46.107 -19.834 1.00 0.00 O ATOM 1451 CB PRO A 97 -15.173 -46.517 -17.011 1.00 0.00 C ATOM 1452 CG PRO A 97 -16.109 -47.369 -17.802 1.00 0.00 C ATOM 1453 CD PRO A 97 -16.862 -46.435 -18.705 1.00 0.00 C ATOM 0 HA PRO A 97 -14.614 -44.430 -17.465 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -14.297 -47.081 -16.691 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -15.651 -46.133 -16.110 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -15.563 -48.114 -18.380 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -16.791 -47.911 -17.147 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -17.120 -46.911 -19.651 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -17.795 -46.101 -18.251 1.00 0.00 H new ATOM 1461 N LEU A 98 -12.369 -45.593 -18.006 1.00 0.00 N ATOM 1462 CA LEU A 98 -11.063 -45.911 -18.650 1.00 0.00 C ATOM 1463 C LEU A 98 -10.743 -47.394 -18.451 1.00 0.00 C ATOM 1464 O LEU A 98 -11.612 -48.241 -18.522 1.00 0.00 O ATOM 1465 CB LEU A 98 -9.959 -45.062 -18.014 1.00 0.00 C ATOM 1466 CG LEU A 98 -10.157 -43.595 -18.401 1.00 0.00 C ATOM 1467 CD1 LEU A 98 -11.345 -43.020 -17.628 1.00 0.00 C ATOM 1468 CD2 LEU A 98 -8.893 -42.803 -18.059 1.00 0.00 C ATOM 0 H LEU A 98 -12.311 -45.277 -17.038 1.00 0.00 H new ATOM 0 HA LEU A 98 -11.122 -45.691 -19.716 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -9.982 -45.169 -16.930 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -8.981 -45.409 -18.348 1.00 0.00 H new ATOM 0 HG LEU A 98 -10.352 -43.524 -19.471 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -11.487 -41.975 -17.903 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -12.245 -43.585 -17.871 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -11.151 -43.090 -16.558 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -9.033 -41.758 -18.334 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -8.698 -42.873 -16.989 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -8.047 -43.213 -18.610 1.00 0.00 H new TER 1480 LEU A 98