USER MOD reduce.3.24.130724 H: found=0, std=0, add=747, rem=0, adj=21 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 -19:sc= 0.453 USER MOD Set 1.2: A 86 ASN : amide:sc= -7.88! C(o=-7.4!,f=-18!) USER MOD Single : A 8 GLN : amide:sc= -0.461 K(o=-0.46,f=-2.6!) USER MOD Single : A 15 LYS NZ :NH3+ 177:sc= -1.03 (180deg=-1.19) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ -168:sc=-0.00567 (180deg=-0.199) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 HIS :FLIP no HE2:sc= 0.191 F(o=-1.6!,f=0.19) 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= -0.38 USER MOD Single : A 44 GLN : amide:sc=-0.00401 K(o=-0.004,f=-1.5!) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 MET CE :methyl -146:sc= 0 (180deg=-1.71!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot -63:sc= 1.3 USER MOD Single : A 52 HIS : no HD1:sc= 0 X(o=0,f=-0.00077) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 GLN :FLIP amide:sc= -0.134 F(o=-0.76,f=-0.13) USER MOD Single : A 57 GLN :FLIP amide:sc= -0.0304 F(o=-1.9,f=-0.03) USER MOD Single : A 60 TYR OH : rot 165:sc= -0.136 USER MOD Single : A 61 TYR OH : rot -14:sc= -1.63! USER MOD Single : A 63 THR OG1 : rot 180:sc= -1.33! USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 GLN : amide:sc= -1.12 X(o=-1.1,f=-0.74) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot -111:sc= -1.64! USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 TYR OH : rot -107:sc= -5.34! USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 94 MET CE :methyl 142:sc= -0.147 (180deg=-1.05) 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 -12.371 -24.991 -25.312 1.00 0.00 N ATOM 2 CA GLN A 8 -13.797 -24.840 -24.906 1.00 0.00 C ATOM 3 C GLN A 8 -13.927 -25.087 -23.402 1.00 0.00 C ATOM 4 O GLN A 8 -13.980 -26.214 -22.951 1.00 0.00 O ATOM 5 CB GLN A 8 -14.654 -25.855 -25.664 1.00 0.00 C ATOM 6 CG GLN A 8 -15.574 -25.118 -26.639 1.00 0.00 C ATOM 7 CD GLN A 8 -15.328 -25.631 -28.059 1.00 0.00 C ATOM 8 OE1 GLN A 8 -14.287 -26.190 -28.343 1.00 0.00 O ATOM 9 NE2 GLN A 8 -16.248 -25.465 -28.968 1.00 0.00 N ATOM 0 HA GLN A 8 -14.136 -23.831 -25.140 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -14.016 -26.553 -26.206 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -15.246 -26.443 -24.963 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -16.616 -25.273 -26.360 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -15.388 -24.045 -26.591 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -17.122 -24.996 -28.730 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -16.094 -25.804 -29.917 1.00 0.00 H new ATOM 18 N PRO A 9 -13.979 -24.004 -22.613 1.00 0.00 N ATOM 19 CA PRO A 9 -14.103 -24.092 -21.153 1.00 0.00 C ATOM 20 C PRO A 9 -15.489 -24.590 -20.731 1.00 0.00 C ATOM 21 O PRO A 9 -16.479 -24.328 -21.385 1.00 0.00 O ATOM 22 CB PRO A 9 -13.903 -22.650 -20.690 1.00 0.00 C ATOM 23 CG PRO A 9 -14.299 -21.819 -21.864 1.00 0.00 C ATOM 24 CD PRO A 9 -13.920 -22.610 -23.084 1.00 0.00 C ATOM 0 HA PRO A 9 -13.390 -24.795 -20.722 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -14.518 -22.424 -19.819 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -12.867 -22.465 -20.405 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -15.369 -21.612 -21.851 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -13.788 -20.856 -21.850 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -14.611 -22.434 -23.909 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -12.924 -22.347 -23.441 1.00 0.00 H new ATOM 32 N LEU A 10 -15.566 -25.307 -19.644 1.00 0.00 N ATOM 33 CA LEU A 10 -16.885 -25.820 -19.182 1.00 0.00 C ATOM 34 C LEU A 10 -17.545 -24.784 -18.270 1.00 0.00 C ATOM 35 O LEU A 10 -16.919 -23.838 -17.835 1.00 0.00 O ATOM 36 CB LEU A 10 -16.682 -27.125 -18.409 1.00 0.00 C ATOM 37 CG LEU A 10 -15.978 -28.144 -19.306 1.00 0.00 C ATOM 38 CD1 LEU A 10 -14.479 -28.143 -19.002 1.00 0.00 C ATOM 39 CD2 LEU A 10 -16.551 -29.538 -19.040 1.00 0.00 C ATOM 0 H LEU A 10 -14.772 -25.560 -19.056 1.00 0.00 H new ATOM 0 HA LEU A 10 -17.525 -26.004 -20.045 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -16.088 -26.941 -17.514 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -17.644 -27.518 -18.079 1.00 0.00 H new ATOM 0 HG LEU A 10 -16.136 -27.878 -20.351 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -13.978 -28.869 -19.642 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -14.070 -27.150 -19.191 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -14.320 -28.409 -17.957 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -16.050 -30.265 -19.679 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -16.393 -29.803 -17.995 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -17.619 -29.540 -19.257 1.00 0.00 H new ATOM 51 N GLU A 11 -18.805 -24.955 -17.977 1.00 0.00 N ATOM 52 CA GLU A 11 -19.503 -23.979 -17.094 1.00 0.00 C ATOM 53 C GLU A 11 -19.681 -24.588 -15.702 1.00 0.00 C ATOM 54 O GLU A 11 -19.988 -25.755 -15.559 1.00 0.00 O ATOM 55 CB GLU A 11 -20.874 -23.645 -17.685 1.00 0.00 C ATOM 56 CG GLU A 11 -20.693 -23.008 -19.064 1.00 0.00 C ATOM 57 CD GLU A 11 -22.056 -22.585 -19.615 1.00 0.00 C ATOM 58 OE1 GLU A 11 -23.054 -22.953 -19.017 1.00 0.00 O ATOM 59 OE2 GLU A 11 -22.079 -21.900 -20.624 1.00 0.00 O ATOM 0 H GLU A 11 -19.381 -25.728 -18.311 1.00 0.00 H new ATOM 0 HA GLU A 11 -18.909 -23.068 -17.019 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -21.477 -24.549 -17.767 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -21.410 -22.963 -17.025 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -20.034 -22.143 -18.993 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -20.218 -23.716 -19.744 1.00 0.00 H new ATOM 66 N ALA A 12 -19.491 -23.808 -14.673 1.00 0.00 N ATOM 67 CA ALA A 12 -19.650 -24.343 -13.292 1.00 0.00 C ATOM 68 C ALA A 12 -20.084 -23.214 -12.356 1.00 0.00 C ATOM 69 O ALA A 12 -19.795 -22.057 -12.588 1.00 0.00 O ATOM 70 CB ALA A 12 -18.316 -24.920 -12.812 1.00 0.00 C ATOM 0 H ALA A 12 -19.232 -22.823 -14.730 1.00 0.00 H new ATOM 0 HA ALA A 12 -20.407 -25.128 -13.290 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -18.432 -25.312 -11.801 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -18.006 -25.724 -13.480 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -17.559 -24.136 -12.813 1.00 0.00 H new ATOM 76 N GLU A 13 -20.776 -23.540 -11.298 1.00 0.00 N ATOM 77 CA GLU A 13 -21.227 -22.484 -10.349 1.00 0.00 C ATOM 78 C GLU A 13 -20.717 -22.810 -8.944 1.00 0.00 C ATOM 79 O GLU A 13 -21.022 -23.845 -8.387 1.00 0.00 O ATOM 80 CB GLU A 13 -22.756 -22.430 -10.337 1.00 0.00 C ATOM 81 CG GLU A 13 -23.223 -21.438 -9.270 1.00 0.00 C ATOM 82 CD GLU A 13 -24.717 -21.160 -9.451 1.00 0.00 C ATOM 83 OE1 GLU A 13 -25.381 -21.977 -10.067 1.00 0.00 O ATOM 84 OE2 GLU A 13 -25.171 -20.136 -8.969 1.00 0.00 O ATOM 0 H GLU A 13 -21.048 -24.491 -11.051 1.00 0.00 H new ATOM 0 HA GLU A 13 -20.831 -21.518 -10.664 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -23.128 -22.129 -11.316 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -23.164 -23.420 -10.132 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -23.035 -21.842 -8.275 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -22.657 -20.510 -9.349 1.00 0.00 H new ATOM 91 N ILE A 14 -19.940 -21.935 -8.367 1.00 0.00 N ATOM 92 CA ILE A 14 -19.410 -22.198 -6.999 1.00 0.00 C ATOM 93 C ILE A 14 -20.044 -21.219 -6.008 1.00 0.00 C ATOM 94 O ILE A 14 -20.039 -20.022 -6.213 1.00 0.00 O ATOM 95 CB ILE A 14 -17.891 -22.014 -6.997 1.00 0.00 C ATOM 96 CG1 ILE A 14 -17.263 -22.931 -8.049 1.00 0.00 C ATOM 97 CG2 ILE A 14 -17.337 -22.369 -5.615 1.00 0.00 C ATOM 98 CD1 ILE A 14 -15.738 -22.858 -7.947 1.00 0.00 C ATOM 0 H ILE A 14 -19.649 -21.050 -8.783 1.00 0.00 H new ATOM 0 HA ILE A 14 -19.653 -23.219 -6.706 1.00 0.00 H new ATOM 0 HB ILE A 14 -17.651 -20.977 -7.230 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -17.599 -23.957 -7.899 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -17.586 -22.632 -9.046 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -16.255 -22.238 -5.612 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -17.783 -21.716 -4.865 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -17.578 -23.406 -5.382 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -15.292 -23.511 -8.697 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -15.411 -21.833 -8.118 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -15.424 -23.178 -6.953 1.00 0.00 H new ATOM 110 N LYS A 15 -20.590 -21.721 -4.934 1.00 0.00 N ATOM 111 CA LYS A 15 -21.223 -20.822 -3.929 1.00 0.00 C ATOM 112 C LYS A 15 -22.200 -19.876 -4.631 1.00 0.00 C ATOM 113 O LYS A 15 -22.426 -18.766 -4.193 1.00 0.00 O ATOM 114 CB LYS A 15 -20.140 -20.003 -3.224 1.00 0.00 C ATOM 115 CG LYS A 15 -19.092 -20.945 -2.627 1.00 0.00 C ATOM 116 CD LYS A 15 -18.118 -20.140 -1.763 1.00 0.00 C ATOM 117 CE LYS A 15 -17.107 -21.089 -1.116 1.00 0.00 C ATOM 118 NZ LYS A 15 -17.714 -21.712 0.094 1.00 0.00 N ATOM 0 H LYS A 15 -20.625 -22.715 -4.709 1.00 0.00 H new ATOM 0 HA LYS A 15 -21.762 -21.422 -3.196 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -19.669 -19.319 -3.930 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -20.585 -19.393 -2.438 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -19.578 -21.714 -2.026 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -18.551 -21.457 -3.423 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -17.600 -19.400 -2.373 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -18.664 -19.593 -0.994 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -16.811 -21.861 -1.826 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -16.203 -20.544 -0.843 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -17.046 -22.395 0.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -17.929 -20.973 0.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -18.592 -22.203 -0.171 1.00 0.00 H new ATOM 132 N GLY A 16 -22.781 -20.306 -5.719 1.00 0.00 N ATOM 133 CA GLY A 16 -23.741 -19.430 -6.447 1.00 0.00 C ATOM 134 C GLY A 16 -22.982 -18.587 -7.474 1.00 0.00 C ATOM 135 O GLY A 16 -23.570 -17.958 -8.332 1.00 0.00 O ATOM 0 H GLY A 16 -22.632 -21.226 -6.134 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -24.497 -20.036 -6.945 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -24.264 -18.782 -5.744 1.00 0.00 H new ATOM 139 N THR A 17 -21.680 -18.569 -7.392 1.00 0.00 N ATOM 140 CA THR A 17 -20.881 -17.768 -8.362 1.00 0.00 C ATOM 141 C THR A 17 -20.736 -18.549 -9.671 1.00 0.00 C ATOM 142 O THR A 17 -20.367 -19.706 -9.677 1.00 0.00 O ATOM 143 CB THR A 17 -19.494 -17.493 -7.775 1.00 0.00 C ATOM 144 OG1 THR A 17 -19.636 -16.926 -6.480 1.00 0.00 O ATOM 145 CG2 THR A 17 -18.737 -16.519 -8.680 1.00 0.00 C ATOM 0 H THR A 17 -21.134 -19.075 -6.694 1.00 0.00 H new ATOM 0 HA THR A 17 -21.387 -16.823 -8.557 1.00 0.00 H new ATOM 0 HB THR A 17 -18.936 -18.427 -7.706 1.00 0.00 H new ATOM 0 HG1 THR A 17 -18.750 -16.750 -6.101 1.00 0.00 H new ATOM 0 HG21 THR A 17 -17.750 -16.325 -8.260 1.00 0.00 H new ATOM 0 HG22 THR A 17 -18.630 -16.954 -9.674 1.00 0.00 H new ATOM 0 HG23 THR A 17 -19.291 -15.583 -8.752 1.00 0.00 H new ATOM 153 N LYS A 18 -21.026 -17.925 -10.779 1.00 0.00 N ATOM 154 CA LYS A 18 -20.907 -18.632 -12.086 1.00 0.00 C ATOM 155 C LYS A 18 -19.557 -18.304 -12.726 1.00 0.00 C ATOM 156 O LYS A 18 -19.211 -17.155 -12.916 1.00 0.00 O ATOM 157 CB LYS A 18 -22.034 -18.178 -13.016 1.00 0.00 C ATOM 158 CG LYS A 18 -22.048 -19.058 -14.268 1.00 0.00 C ATOM 159 CD LYS A 18 -23.107 -18.540 -15.244 1.00 0.00 C ATOM 160 CE LYS A 18 -23.275 -19.537 -16.392 1.00 0.00 C ATOM 161 NZ LYS A 18 -22.011 -19.608 -17.178 1.00 0.00 N ATOM 0 H LYS A 18 -21.340 -16.956 -10.836 1.00 0.00 H new ATOM 0 HA LYS A 18 -20.979 -19.707 -11.923 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -22.993 -18.243 -12.502 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -21.892 -17.134 -13.294 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -21.066 -19.050 -14.742 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -22.263 -20.092 -13.997 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -24.056 -18.401 -14.727 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -22.812 -17.566 -15.634 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -23.527 -20.522 -15.998 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -24.099 -19.231 -17.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -22.183 -20.121 -18.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -21.681 -18.645 -17.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -21.286 -20.107 -16.625 1.00 0.00 H new ATOM 175 N LEU A 19 -18.793 -19.307 -13.065 1.00 0.00 N ATOM 176 CA LEU A 19 -17.467 -19.055 -13.697 1.00 0.00 C ATOM 177 C LEU A 19 -17.156 -20.181 -14.685 1.00 0.00 C ATOM 178 O LEU A 19 -17.836 -21.187 -14.729 1.00 0.00 O ATOM 179 CB LEU A 19 -16.382 -19.012 -12.619 1.00 0.00 C ATOM 180 CG LEU A 19 -16.792 -18.036 -11.515 1.00 0.00 C ATOM 181 CD1 LEU A 19 -15.803 -18.142 -10.353 1.00 0.00 C ATOM 182 CD2 LEU A 19 -16.782 -16.608 -12.065 1.00 0.00 C ATOM 0 H LEU A 19 -19.030 -20.290 -12.931 1.00 0.00 H new ATOM 0 HA LEU A 19 -17.492 -18.100 -14.223 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -16.232 -20.007 -12.201 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -15.433 -18.703 -13.057 1.00 0.00 H new ATOM 0 HG LEU A 19 -17.795 -18.282 -11.165 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -16.092 -17.447 -9.564 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -15.810 -19.159 -9.961 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -14.801 -17.895 -10.704 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -17.074 -15.913 -11.278 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -15.780 -16.360 -12.415 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -17.485 -16.533 -12.895 1.00 0.00 H new ATOM 194 N LYS A 20 -16.132 -20.021 -15.477 1.00 0.00 N ATOM 195 CA LYS A 20 -15.779 -21.084 -16.459 1.00 0.00 C ATOM 196 C LYS A 20 -14.856 -22.107 -15.794 1.00 0.00 C ATOM 197 O LYS A 20 -14.148 -21.801 -14.855 1.00 0.00 O ATOM 198 CB LYS A 20 -15.065 -20.453 -17.656 1.00 0.00 C ATOM 199 CG LYS A 20 -16.018 -19.488 -18.365 1.00 0.00 C ATOM 200 CD LYS A 20 -15.338 -18.925 -19.615 1.00 0.00 C ATOM 201 CE LYS A 20 -16.295 -17.965 -20.325 1.00 0.00 C ATOM 202 NZ LYS A 20 -15.529 -16.805 -20.863 1.00 0.00 N ATOM 0 H LYS A 20 -15.525 -19.201 -15.487 1.00 0.00 H new ATOM 0 HA LYS A 20 -16.687 -21.583 -16.799 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -14.173 -19.922 -17.323 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -14.735 -21.229 -18.347 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -16.938 -20.005 -18.640 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -16.297 -18.676 -17.693 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -14.421 -18.404 -19.340 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -15.055 -19.737 -20.286 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -16.810 -18.481 -21.135 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -17.060 -17.618 -19.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -16.180 -16.153 -21.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -15.057 -16.308 -20.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -14.815 -17.144 -21.539 1.00 0.00 H new ATOM 216 N ALA A 21 -14.859 -23.321 -16.273 1.00 0.00 N ATOM 217 CA ALA A 21 -13.982 -24.363 -15.668 1.00 0.00 C ATOM 218 C ALA A 21 -13.312 -25.170 -16.782 1.00 0.00 C ATOM 219 O ALA A 21 -13.669 -25.064 -17.938 1.00 0.00 O ATOM 220 CB ALA A 21 -14.826 -25.297 -14.798 1.00 0.00 C ATOM 0 H ALA A 21 -15.431 -23.636 -17.057 1.00 0.00 H new ATOM 0 HA ALA A 21 -13.219 -23.886 -15.053 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -14.185 -26.060 -14.355 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -15.306 -24.722 -14.006 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -15.589 -25.776 -15.412 1.00 0.00 H new ATOM 226 N HIS A 22 -12.342 -25.976 -16.444 1.00 0.00 N ATOM 227 CA HIS A 22 -11.653 -26.786 -17.487 1.00 0.00 C ATOM 228 C HIS A 22 -11.574 -28.245 -17.035 1.00 0.00 C ATOM 229 O HIS A 22 -11.178 -28.541 -15.925 1.00 0.00 O ATOM 230 CB HIS A 22 -10.239 -26.243 -17.703 1.00 0.00 C ATOM 231 CG HIS A 22 -10.303 -25.006 -18.557 1.00 0.00 C ATOM 232 ND1 HIS A 22 -10.349 -23.673 -18.236 1.00 0.00 N flip ATOM 233 CD2 HIS A 22 -10.327 -25.064 -19.941 1.00 0.00 C flip ATOM 234 CE1 HIS A 22 -10.401 -22.912 -19.400 1.00 0.00 C flip ATOM 235 NE2 HIS A 22 -10.385 -23.800 -20.398 1.00 0.00 N flip ATOM 0 H HIS A 22 -11.998 -26.108 -15.493 1.00 0.00 H new ATOM 0 HA HIS A 22 -12.213 -26.726 -18.420 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -9.776 -26.012 -16.744 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -9.617 -26.998 -18.184 1.00 0.00 H new ATOM 0 HD1 HIS A 22 -10.346 -23.297 -17.288 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -10.303 -25.960 -20.543 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -10.445 -21.836 -19.479 1.00 0.00 H new ATOM 243 N TRP A 23 -11.946 -29.158 -17.889 1.00 0.00 N ATOM 244 CA TRP A 23 -11.891 -30.598 -17.513 1.00 0.00 C ATOM 245 C TRP A 23 -10.491 -31.144 -17.802 1.00 0.00 C ATOM 246 O TRP A 23 -9.978 -31.013 -18.895 1.00 0.00 O ATOM 247 CB TRP A 23 -12.922 -31.376 -18.334 1.00 0.00 C ATOM 248 CG TRP A 23 -13.046 -32.765 -17.797 1.00 0.00 C ATOM 249 CD1 TRP A 23 -13.742 -33.110 -16.688 1.00 0.00 C ATOM 250 CD2 TRP A 23 -12.476 -33.999 -18.322 1.00 0.00 C ATOM 251 NE1 TRP A 23 -13.635 -34.476 -16.501 1.00 0.00 N ATOM 252 CE2 TRP A 23 -12.864 -35.069 -17.482 1.00 0.00 C ATOM 253 CE3 TRP A 23 -11.667 -34.291 -19.436 1.00 0.00 C ATOM 254 CZ2 TRP A 23 -12.465 -36.381 -17.736 1.00 0.00 C ATOM 255 CZ3 TRP A 23 -11.263 -35.611 -19.695 1.00 0.00 C ATOM 256 CH2 TRP A 23 -11.662 -36.654 -18.847 1.00 0.00 C ATOM 0 H TRP A 23 -12.286 -28.969 -18.832 1.00 0.00 H new ATOM 0 HA TRP A 23 -12.113 -30.708 -16.452 1.00 0.00 H new ATOM 0 HB2 TRP A 23 -13.888 -30.873 -18.295 1.00 0.00 H new ATOM 0 HB3 TRP A 23 -12.621 -31.406 -19.381 1.00 0.00 H new ATOM 0 HD1 TRP A 23 -14.291 -32.430 -16.053 1.00 0.00 H new ATOM 0 HE1 TRP A 23 -14.072 -34.984 -15.732 1.00 0.00 H new ATOM 0 HE3 TRP A 23 -11.355 -33.495 -20.096 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 -12.774 -37.180 -17.079 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 -10.641 -35.824 -20.552 1.00 0.00 H new ATOM 0 HH2 TRP A 23 -11.349 -37.667 -19.052 1.00 0.00 H new ATOM 267 N ASP A 24 -9.867 -31.752 -16.830 1.00 0.00 N ATOM 268 CA ASP A 24 -8.500 -32.301 -17.054 1.00 0.00 C ATOM 269 C ASP A 24 -8.392 -33.682 -16.404 1.00 0.00 C ATOM 270 O ASP A 24 -8.272 -33.805 -15.201 1.00 0.00 O ATOM 271 CB ASP A 24 -7.466 -31.362 -16.432 1.00 0.00 C ATOM 272 CG ASP A 24 -7.432 -30.049 -17.218 1.00 0.00 C ATOM 273 OD1 ASP A 24 -7.909 -30.042 -18.341 1.00 0.00 O ATOM 274 OD2 ASP A 24 -6.928 -29.075 -16.684 1.00 0.00 O ATOM 0 H ASP A 24 -10.244 -31.892 -15.893 1.00 0.00 H new ATOM 0 HA ASP A 24 -8.314 -32.388 -18.124 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -7.716 -31.168 -15.389 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -6.482 -31.830 -16.442 1.00 0.00 H new ATOM 279 N SER A 25 -8.434 -34.722 -17.190 1.00 0.00 N ATOM 280 CA SER A 25 -8.334 -36.094 -16.617 1.00 0.00 C ATOM 281 C SER A 25 -7.007 -36.240 -15.869 1.00 0.00 C ATOM 282 O SER A 25 -6.897 -36.994 -14.922 1.00 0.00 O ATOM 283 CB SER A 25 -8.400 -37.124 -17.746 1.00 0.00 C ATOM 284 OG SER A 25 -8.466 -38.430 -17.192 1.00 0.00 O ATOM 0 H SER A 25 -8.533 -34.681 -18.204 1.00 0.00 H new ATOM 0 HA SER A 25 -9.160 -36.260 -15.925 1.00 0.00 H new ATOM 0 HB2 SER A 25 -9.273 -36.938 -18.372 1.00 0.00 H new ATOM 0 HB3 SER A 25 -7.523 -37.033 -18.387 1.00 0.00 H new ATOM 0 HG SER A 25 -8.510 -39.090 -17.915 1.00 0.00 H new ATOM 290 N GLY A 26 -5.997 -35.526 -16.285 1.00 0.00 N ATOM 291 CA GLY A 26 -4.679 -35.626 -15.597 1.00 0.00 C ATOM 292 C GLY A 26 -4.834 -35.214 -14.131 1.00 0.00 C ATOM 293 O GLY A 26 -4.093 -35.651 -13.272 1.00 0.00 O ATOM 0 H GLY A 26 -6.028 -34.878 -17.072 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -4.300 -36.646 -15.661 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -3.950 -34.984 -16.091 1.00 0.00 H new ATOM 297 N ALA A 27 -5.790 -34.376 -13.838 1.00 0.00 N ATOM 298 CA ALA A 27 -5.990 -33.938 -12.428 1.00 0.00 C ATOM 299 C ALA A 27 -6.841 -34.971 -11.686 1.00 0.00 C ATOM 300 O ALA A 27 -7.877 -35.391 -12.161 1.00 0.00 O ATOM 301 CB ALA A 27 -6.702 -32.584 -12.411 1.00 0.00 C ATOM 0 H ALA A 27 -6.441 -33.976 -14.514 1.00 0.00 H new ATOM 0 HA ALA A 27 -5.021 -33.846 -11.936 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -6.849 -32.263 -11.380 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -6.095 -31.847 -12.938 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -7.670 -32.676 -12.904 1.00 0.00 H new ATOM 307 N THR A 28 -6.412 -35.383 -10.525 1.00 0.00 N ATOM 308 CA THR A 28 -7.197 -36.388 -9.754 1.00 0.00 C ATOM 309 C THR A 28 -8.074 -35.671 -8.726 1.00 0.00 C ATOM 310 O THR A 28 -8.952 -36.260 -8.127 1.00 0.00 O ATOM 311 CB THR A 28 -6.239 -37.340 -9.032 1.00 0.00 C ATOM 312 OG1 THR A 28 -5.524 -36.623 -8.036 1.00 0.00 O ATOM 313 CG2 THR A 28 -5.256 -37.939 -10.039 1.00 0.00 C ATOM 0 H THR A 28 -5.552 -35.067 -10.077 1.00 0.00 H new ATOM 0 HA THR A 28 -7.828 -36.957 -10.437 1.00 0.00 H new ATOM 0 HB THR A 28 -6.808 -38.143 -8.564 1.00 0.00 H new ATOM 0 HG1 THR A 28 -4.912 -37.231 -7.572 1.00 0.00 H new ATOM 0 HG21 THR A 28 -4.575 -38.616 -9.524 1.00 0.00 H new ATOM 0 HG22 THR A 28 -5.807 -38.489 -10.802 1.00 0.00 H new ATOM 0 HG23 THR A 28 -4.685 -37.139 -10.510 1.00 0.00 H new ATOM 321 N ILE A 29 -7.844 -34.404 -8.517 1.00 0.00 N ATOM 322 CA ILE A 29 -8.665 -33.652 -7.527 1.00 0.00 C ATOM 323 C ILE A 29 -9.094 -32.315 -8.134 1.00 0.00 C ATOM 324 O ILE A 29 -8.369 -31.706 -8.895 1.00 0.00 O ATOM 325 CB ILE A 29 -7.839 -33.398 -6.265 1.00 0.00 C ATOM 326 CG1 ILE A 29 -8.756 -32.896 -5.147 1.00 0.00 C ATOM 327 CG2 ILE A 29 -6.769 -32.344 -6.558 1.00 0.00 C ATOM 328 CD1 ILE A 29 -8.141 -33.242 -3.790 1.00 0.00 C ATOM 0 H ILE A 29 -7.124 -33.857 -8.989 1.00 0.00 H new ATOM 0 HA ILE A 29 -9.549 -34.236 -7.269 1.00 0.00 H new ATOM 0 HB ILE A 29 -7.359 -34.326 -5.953 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -8.894 -31.818 -5.232 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -9.742 -33.352 -5.238 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -6.181 -32.163 -5.659 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -6.115 -32.701 -7.354 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -7.248 -31.416 -6.871 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -8.793 -32.885 -2.993 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -8.026 -34.323 -3.708 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -7.165 -32.765 -3.701 1.00 0.00 H new ATOM 340 N THR A 30 -10.269 -31.853 -7.804 1.00 0.00 N ATOM 341 CA THR A 30 -10.741 -30.555 -8.363 1.00 0.00 C ATOM 342 C THR A 30 -9.825 -29.428 -7.878 1.00 0.00 C ATOM 343 O THR A 30 -9.387 -29.414 -6.744 1.00 0.00 O ATOM 344 CB THR A 30 -12.174 -30.288 -7.895 1.00 0.00 C ATOM 345 OG1 THR A 30 -13.009 -31.366 -8.294 1.00 0.00 O ATOM 346 CG2 THR A 30 -12.682 -28.988 -8.520 1.00 0.00 C ATOM 0 H THR A 30 -10.922 -32.318 -7.172 1.00 0.00 H new ATOM 0 HA THR A 30 -10.718 -30.598 -9.452 1.00 0.00 H new ATOM 0 HB THR A 30 -12.192 -30.197 -6.809 1.00 0.00 H new ATOM 0 HG1 THR A 30 -12.572 -31.869 -9.013 1.00 0.00 H new ATOM 0 HG21 THR A 30 -13.702 -28.798 -8.187 1.00 0.00 H new ATOM 0 HG22 THR A 30 -12.041 -28.162 -8.213 1.00 0.00 H new ATOM 0 HG23 THR A 30 -12.666 -29.076 -9.606 1.00 0.00 H new ATOM 354 N CYS A 31 -9.530 -28.484 -8.728 1.00 0.00 N ATOM 355 CA CYS A 31 -8.642 -27.361 -8.314 1.00 0.00 C ATOM 356 C CYS A 31 -9.383 -26.033 -8.489 1.00 0.00 C ATOM 357 O CYS A 31 -9.922 -25.746 -9.539 1.00 0.00 O ATOM 358 CB CYS A 31 -7.383 -27.359 -9.183 1.00 0.00 C ATOM 359 SG CYS A 31 -5.918 -27.440 -8.123 1.00 0.00 S ATOM 0 H CYS A 31 -9.865 -28.441 -9.691 1.00 0.00 H new ATOM 0 HA CYS A 31 -8.362 -27.487 -7.268 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -7.398 -28.208 -9.866 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -7.352 -26.458 -9.796 1.00 0.00 H new ATOM 0 HG CYS A 31 -4.848 -27.441 -8.861 1.00 0.00 H new ATOM 365 N VAL A 32 -9.411 -25.221 -7.469 1.00 0.00 N ATOM 366 CA VAL A 32 -10.115 -23.912 -7.578 1.00 0.00 C ATOM 367 C VAL A 32 -9.171 -22.789 -7.142 1.00 0.00 C ATOM 368 O VAL A 32 -8.164 -23.026 -6.506 1.00 0.00 O ATOM 369 CB VAL A 32 -11.353 -23.919 -6.677 1.00 0.00 C ATOM 370 CG1 VAL A 32 -12.144 -25.208 -6.907 1.00 0.00 C ATOM 371 CG2 VAL A 32 -10.919 -23.841 -5.212 1.00 0.00 C ATOM 0 H VAL A 32 -8.977 -25.407 -6.565 1.00 0.00 H new ATOM 0 HA VAL A 32 -10.421 -23.749 -8.611 1.00 0.00 H new ATOM 0 HB VAL A 32 -11.980 -23.060 -6.916 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -13.025 -25.213 -6.266 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -12.454 -25.263 -7.950 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -11.517 -26.067 -6.669 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -11.800 -23.846 -4.571 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -10.291 -24.699 -4.972 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -10.356 -22.922 -5.048 1.00 0.00 H new ATOM 381 N PRO A 33 -9.509 -21.540 -7.496 1.00 0.00 N ATOM 382 CA PRO A 33 -8.695 -20.375 -7.145 1.00 0.00 C ATOM 383 C PRO A 33 -8.918 -19.937 -5.694 1.00 0.00 C ATOM 384 O PRO A 33 -10.029 -19.924 -5.202 1.00 0.00 O ATOM 385 CB PRO A 33 -9.199 -19.291 -8.093 1.00 0.00 C ATOM 386 CG PRO A 33 -10.602 -19.682 -8.429 1.00 0.00 C ATOM 387 CD PRO A 33 -10.707 -21.177 -8.270 1.00 0.00 C ATOM 0 HA PRO A 33 -7.629 -20.582 -7.234 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -9.167 -18.309 -7.621 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -8.581 -19.234 -8.989 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -11.309 -19.176 -7.771 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -10.848 -19.387 -9.449 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -11.621 -21.459 -7.747 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -10.725 -21.681 -9.237 1.00 0.00 H new ATOM 395 N GLU A 34 -7.868 -19.576 -5.006 1.00 0.00 N ATOM 396 CA GLU A 34 -8.016 -19.138 -3.590 1.00 0.00 C ATOM 397 C GLU A 34 -9.171 -18.141 -3.483 1.00 0.00 C ATOM 398 O GLU A 34 -9.770 -17.979 -2.438 1.00 0.00 O ATOM 399 CB GLU A 34 -6.722 -18.466 -3.123 1.00 0.00 C ATOM 400 CG GLU A 34 -5.564 -19.461 -3.216 1.00 0.00 C ATOM 401 CD GLU A 34 -4.237 -18.698 -3.243 1.00 0.00 C ATOM 402 OE1 GLU A 34 -4.277 -17.479 -3.230 1.00 0.00 O ATOM 403 OE2 GLU A 34 -3.204 -19.347 -3.277 1.00 0.00 O ATOM 0 H GLU A 34 -6.913 -19.566 -5.365 1.00 0.00 H new ATOM 0 HA GLU A 34 -8.222 -20.006 -2.963 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -6.513 -17.591 -3.738 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -6.832 -18.116 -2.097 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -5.587 -20.142 -2.366 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -5.664 -20.069 -4.115 1.00 0.00 H new ATOM 410 N ALA A 35 -9.487 -17.470 -4.556 1.00 0.00 N ATOM 411 CA ALA A 35 -10.602 -16.482 -4.513 1.00 0.00 C ATOM 412 C ALA A 35 -11.841 -17.137 -3.900 1.00 0.00 C ATOM 413 O ALA A 35 -12.702 -16.472 -3.360 1.00 0.00 O ATOM 414 CB ALA A 35 -10.922 -16.010 -5.933 1.00 0.00 C ATOM 0 H ALA A 35 -9.022 -17.563 -5.459 1.00 0.00 H new ATOM 0 HA ALA A 35 -10.306 -15.627 -3.905 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -11.738 -15.287 -5.901 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -10.039 -15.542 -6.368 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -11.218 -16.864 -6.542 1.00 0.00 H new ATOM 420 N PHE A 36 -11.938 -18.436 -3.978 1.00 0.00 N ATOM 421 CA PHE A 36 -13.123 -19.128 -3.398 1.00 0.00 C ATOM 422 C PHE A 36 -12.775 -19.666 -2.009 1.00 0.00 C ATOM 423 O PHE A 36 -13.632 -20.124 -1.280 1.00 0.00 O ATOM 424 CB PHE A 36 -13.530 -20.291 -4.304 1.00 0.00 C ATOM 425 CG PHE A 36 -14.430 -19.779 -5.403 1.00 0.00 C ATOM 426 CD1 PHE A 36 -15.788 -19.553 -5.148 1.00 0.00 C ATOM 427 CD2 PHE A 36 -13.906 -19.532 -6.677 1.00 0.00 C ATOM 428 CE1 PHE A 36 -16.622 -19.079 -6.168 1.00 0.00 C ATOM 429 CE2 PHE A 36 -14.740 -19.057 -7.697 1.00 0.00 C ATOM 430 CZ PHE A 36 -16.098 -18.831 -7.442 1.00 0.00 C ATOM 0 H PHE A 36 -11.249 -19.047 -4.417 1.00 0.00 H new ATOM 0 HA PHE A 36 -13.949 -18.421 -3.318 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -12.644 -20.760 -4.733 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -14.046 -21.056 -3.723 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -16.192 -19.744 -4.165 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -12.859 -19.708 -6.874 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -17.670 -18.905 -5.972 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -14.336 -18.865 -8.680 1.00 0.00 H new ATOM 0 HZ PHE A 36 -16.741 -18.465 -8.229 1.00 0.00 H new ATOM 440 N LEU A 37 -11.525 -19.614 -1.633 1.00 0.00 N ATOM 441 CA LEU A 37 -11.136 -20.126 -0.288 1.00 0.00 C ATOM 442 C LEU A 37 -10.588 -18.978 0.562 1.00 0.00 C ATOM 443 O LEU A 37 -10.161 -19.175 1.683 1.00 0.00 O ATOM 444 CB LEU A 37 -10.059 -21.204 -0.435 1.00 0.00 C ATOM 445 CG LEU A 37 -10.642 -22.435 -1.137 1.00 0.00 C ATOM 446 CD1 LEU A 37 -12.020 -22.763 -0.555 1.00 0.00 C ATOM 447 CD2 LEU A 37 -10.773 -22.152 -2.635 1.00 0.00 C ATOM 0 H LEU A 37 -10.761 -19.241 -2.196 1.00 0.00 H new ATOM 0 HA LEU A 37 -12.014 -20.553 0.197 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -9.218 -20.813 -1.007 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -9.675 -21.483 0.546 1.00 0.00 H new ATOM 0 HG LEU A 37 -9.978 -23.285 -0.982 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -12.429 -23.639 -1.059 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -11.925 -22.969 0.511 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -12.689 -21.915 -0.703 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -11.188 -23.027 -3.136 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -11.434 -21.299 -2.788 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -9.790 -21.928 -3.050 1.00 0.00 H new ATOM 459 N GLU A 38 -10.593 -17.781 0.043 1.00 0.00 N ATOM 460 CA GLU A 38 -10.069 -16.631 0.832 1.00 0.00 C ATOM 461 C GLU A 38 -10.781 -16.580 2.185 1.00 0.00 C ATOM 462 O GLU A 38 -10.167 -16.368 3.212 1.00 0.00 O ATOM 463 CB GLU A 38 -10.321 -15.329 0.070 1.00 0.00 C ATOM 464 CG GLU A 38 -9.635 -14.171 0.798 1.00 0.00 C ATOM 465 CD GLU A 38 -9.949 -12.857 0.080 1.00 0.00 C ATOM 466 OE1 GLU A 38 -10.670 -12.900 -0.903 1.00 0.00 O ATOM 467 OE2 GLU A 38 -9.462 -11.831 0.525 1.00 0.00 O ATOM 0 H GLU A 38 -10.936 -17.550 -0.890 1.00 0.00 H new ATOM 0 HA GLU A 38 -8.997 -16.754 0.988 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -9.938 -15.411 -0.947 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -11.392 -15.141 -0.006 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -9.978 -14.124 1.832 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -8.558 -14.333 0.827 1.00 0.00 H new ATOM 474 N ASP A 39 -12.070 -16.777 2.194 1.00 0.00 N ATOM 475 CA ASP A 39 -12.820 -16.745 3.480 1.00 0.00 C ATOM 476 C ASP A 39 -13.307 -18.155 3.816 1.00 0.00 C ATOM 477 O ASP A 39 -14.282 -18.336 4.518 1.00 0.00 O ATOM 478 CB ASP A 39 -14.023 -15.808 3.348 1.00 0.00 C ATOM 479 CG ASP A 39 -13.536 -14.384 3.075 1.00 0.00 C ATOM 480 OD1 ASP A 39 -12.365 -14.126 3.302 1.00 0.00 O ATOM 481 OD2 ASP A 39 -14.342 -13.575 2.645 1.00 0.00 O ATOM 0 H ASP A 39 -12.637 -16.959 1.366 1.00 0.00 H new ATOM 0 HA ASP A 39 -12.166 -16.384 4.274 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -14.671 -16.143 2.538 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -14.617 -15.831 4.262 1.00 0.00 H new ATOM 486 N GLU A 40 -12.635 -19.158 3.320 1.00 0.00 N ATOM 487 CA GLU A 40 -13.061 -20.557 3.609 1.00 0.00 C ATOM 488 C GLU A 40 -12.059 -21.213 4.560 1.00 0.00 C ATOM 489 O GLU A 40 -11.198 -20.563 5.119 1.00 0.00 O ATOM 490 CB GLU A 40 -13.117 -21.357 2.306 1.00 0.00 C ATOM 491 CG GLU A 40 -14.095 -20.691 1.337 1.00 0.00 C ATOM 492 CD GLU A 40 -15.484 -20.629 1.974 1.00 0.00 C ATOM 493 OE1 GLU A 40 -15.700 -21.333 2.947 1.00 0.00 O ATOM 494 OE2 GLU A 40 -16.309 -19.879 1.478 1.00 0.00 O ATOM 0 H GLU A 40 -11.810 -19.069 2.727 1.00 0.00 H new ATOM 0 HA GLU A 40 -14.048 -20.542 4.071 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -12.125 -21.411 1.858 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -13.431 -22.381 2.509 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -13.751 -19.686 1.091 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -14.136 -21.252 0.403 1.00 0.00 H new ATOM 501 N ARG A 41 -12.166 -22.499 4.742 1.00 0.00 N ATOM 502 CA ARG A 41 -11.224 -23.208 5.652 1.00 0.00 C ATOM 503 C ARG A 41 -11.029 -24.642 5.158 1.00 0.00 C ATOM 504 O ARG A 41 -11.981 -25.354 4.904 1.00 0.00 O ATOM 505 CB ARG A 41 -11.800 -23.231 7.069 1.00 0.00 C ATOM 506 CG ARG A 41 -13.028 -24.143 7.103 1.00 0.00 C ATOM 507 CD ARG A 41 -13.989 -23.664 8.193 1.00 0.00 C ATOM 508 NE ARG A 41 -14.666 -24.839 8.810 1.00 0.00 N ATOM 509 CZ ARG A 41 -14.508 -25.090 10.081 1.00 0.00 C ATOM 510 NH1 ARG A 41 -15.250 -24.480 10.963 1.00 0.00 N ATOM 511 NH2 ARG A 41 -13.609 -25.953 10.468 1.00 0.00 N ATOM 0 H ARG A 41 -12.868 -23.092 4.298 1.00 0.00 H new ATOM 0 HA ARG A 41 -10.265 -22.689 5.660 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -11.049 -23.588 7.773 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -12.074 -22.222 7.379 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -13.527 -24.135 6.134 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -12.725 -25.172 7.297 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -13.444 -23.104 8.953 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -14.729 -22.986 7.768 1.00 0.00 H new ATOM 0 HE ARG A 41 -15.253 -25.447 8.239 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -15.954 -23.807 10.660 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -15.127 -24.676 11.956 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -13.030 -26.431 9.777 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -13.485 -26.150 11.461 1.00 0.00 H new ATOM 525 N PRO A 42 -9.767 -25.070 5.015 1.00 0.00 N ATOM 526 CA PRO A 42 -9.439 -26.421 4.545 1.00 0.00 C ATOM 527 C PRO A 42 -9.772 -27.488 5.591 1.00 0.00 C ATOM 528 O PRO A 42 -9.311 -27.437 6.714 1.00 0.00 O ATOM 529 CB PRO A 42 -7.928 -26.364 4.322 1.00 0.00 C ATOM 530 CG PRO A 42 -7.453 -25.280 5.230 1.00 0.00 C ATOM 531 CD PRO A 42 -8.563 -24.270 5.301 1.00 0.00 C ATOM 0 HA PRO A 42 -10.007 -26.692 3.655 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -7.456 -27.317 4.562 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -7.689 -26.143 3.282 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -7.223 -25.675 6.220 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -6.539 -24.826 4.848 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -8.616 -23.799 6.283 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -8.428 -23.471 4.571 1.00 0.00 H new ATOM 539 N ILE A 43 -10.566 -28.458 5.228 1.00 0.00 N ATOM 540 CA ILE A 43 -10.924 -29.532 6.196 1.00 0.00 C ATOM 541 C ILE A 43 -9.713 -30.441 6.411 1.00 0.00 C ATOM 542 O ILE A 43 -9.471 -30.925 7.499 1.00 0.00 O ATOM 543 CB ILE A 43 -12.087 -30.354 5.636 1.00 0.00 C ATOM 544 CG1 ILE A 43 -11.615 -31.138 4.410 1.00 0.00 C ATOM 545 CG2 ILE A 43 -13.227 -29.416 5.232 1.00 0.00 C ATOM 546 CD1 ILE A 43 -12.737 -32.060 3.928 1.00 0.00 C ATOM 0 H ILE A 43 -10.982 -28.553 4.302 1.00 0.00 H new ATOM 0 HA ILE A 43 -11.219 -29.087 7.146 1.00 0.00 H new ATOM 0 HB ILE A 43 -12.440 -31.049 6.398 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -11.328 -30.450 3.614 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -10.730 -31.724 4.659 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -14.056 -30.001 4.833 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -13.565 -28.857 6.105 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -12.874 -28.721 4.470 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -12.399 -32.618 3.055 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -13.002 -32.757 4.723 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -13.610 -31.463 3.662 1.00 0.00 H new ATOM 558 N GLN A 44 -8.947 -30.673 5.379 1.00 0.00 N ATOM 559 CA GLN A 44 -7.749 -31.548 5.520 1.00 0.00 C ATOM 560 C GLN A 44 -6.586 -30.949 4.727 1.00 0.00 C ATOM 561 O GLN A 44 -6.769 -30.079 3.899 1.00 0.00 O ATOM 562 CB GLN A 44 -8.070 -32.943 4.979 1.00 0.00 C ATOM 563 CG GLN A 44 -9.097 -33.619 5.889 1.00 0.00 C ATOM 564 CD GLN A 44 -9.477 -34.981 5.307 1.00 0.00 C ATOM 565 OE1 GLN A 44 -9.165 -35.277 4.170 1.00 0.00 O ATOM 566 NE2 GLN A 44 -10.142 -35.829 6.043 1.00 0.00 N ATOM 0 H GLN A 44 -9.100 -30.294 4.444 1.00 0.00 H new ATOM 0 HA GLN A 44 -7.473 -31.621 6.572 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -8.460 -32.870 3.964 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -7.162 -33.543 4.929 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -8.686 -33.742 6.891 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -9.984 -32.992 5.983 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -10.404 -35.581 6.997 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -10.400 -36.740 5.664 1.00 0.00 H new ATOM 575 N THR A 45 -5.389 -31.408 4.974 1.00 0.00 N ATOM 576 CA THR A 45 -4.215 -30.864 4.234 1.00 0.00 C ATOM 577 C THR A 45 -3.405 -32.020 3.643 1.00 0.00 C ATOM 578 O THR A 45 -3.540 -33.157 4.049 1.00 0.00 O ATOM 579 CB THR A 45 -3.333 -30.064 5.196 1.00 0.00 C ATOM 580 OG1 THR A 45 -2.718 -30.950 6.120 1.00 0.00 O ATOM 581 CG2 THR A 45 -4.190 -29.048 5.953 1.00 0.00 C ATOM 0 H THR A 45 -5.174 -32.136 5.656 1.00 0.00 H new ATOM 0 HA THR A 45 -4.561 -30.214 3.430 1.00 0.00 H new ATOM 0 HB THR A 45 -2.564 -29.537 4.631 1.00 0.00 H new ATOM 0 HG1 THR A 45 -2.152 -30.439 6.735 1.00 0.00 H new ATOM 0 HG21 THR A 45 -3.561 -28.479 6.637 1.00 0.00 H new ATOM 0 HG22 THR A 45 -4.661 -28.368 5.243 1.00 0.00 H new ATOM 0 HG23 THR A 45 -4.960 -29.572 6.519 1.00 0.00 H new ATOM 589 N MET A 46 -2.561 -31.739 2.688 1.00 0.00 N ATOM 590 CA MET A 46 -1.743 -32.821 2.073 1.00 0.00 C ATOM 591 C MET A 46 -0.269 -32.410 2.078 1.00 0.00 C ATOM 592 O MET A 46 0.063 -31.252 1.922 1.00 0.00 O ATOM 593 CB MET A 46 -2.203 -33.053 0.632 1.00 0.00 C ATOM 594 CG MET A 46 -3.627 -33.614 0.636 1.00 0.00 C ATOM 595 SD MET A 46 -4.103 -34.064 -1.051 1.00 0.00 S ATOM 596 CE MET A 46 -5.794 -34.587 -0.677 1.00 0.00 C ATOM 0 H MET A 46 -2.403 -30.806 2.307 1.00 0.00 H new ATOM 0 HA MET A 46 -1.867 -33.740 2.646 1.00 0.00 H new ATOM 0 HB2 MET A 46 -2.171 -32.118 0.073 1.00 0.00 H new ATOM 0 HB3 MET A 46 -1.528 -33.747 0.131 1.00 0.00 H new ATOM 0 HG2 MET A 46 -3.684 -34.487 1.286 1.00 0.00 H new ATOM 0 HG3 MET A 46 -4.320 -32.873 1.036 1.00 0.00 H new ATOM 0 HE1 MET A 46 -6.074 -35.411 -1.334 1.00 0.00 H new ATOM 0 HE2 MET A 46 -5.852 -34.914 0.361 1.00 0.00 H new ATOM 0 HE3 MET A 46 -6.476 -33.751 -0.833 1.00 0.00 H new ATOM 606 N LEU A 47 0.619 -33.350 2.259 1.00 0.00 N ATOM 607 CA LEU A 47 2.070 -33.011 2.277 1.00 0.00 C ATOM 608 C LEU A 47 2.693 -33.357 0.923 1.00 0.00 C ATOM 609 O LEU A 47 2.545 -34.454 0.422 1.00 0.00 O ATOM 610 CB LEU A 47 2.767 -33.814 3.377 1.00 0.00 C ATOM 611 CG LEU A 47 2.150 -33.465 4.733 1.00 0.00 C ATOM 612 CD1 LEU A 47 0.814 -34.194 4.887 1.00 0.00 C ATOM 613 CD2 LEU A 47 3.099 -33.898 5.852 1.00 0.00 C ATOM 0 H LEU A 47 0.402 -34.337 2.395 1.00 0.00 H new ATOM 0 HA LEU A 47 2.191 -31.945 2.471 1.00 0.00 H new ATOM 0 HB2 LEU A 47 2.665 -34.882 3.183 1.00 0.00 H new ATOM 0 HB3 LEU A 47 3.834 -33.592 3.383 1.00 0.00 H new ATOM 0 HG LEU A 47 1.986 -32.389 4.792 1.00 0.00 H new ATOM 0 HD11 LEU A 47 0.373 -33.946 5.853 1.00 0.00 H new ATOM 0 HD12 LEU A 47 0.137 -33.886 4.090 1.00 0.00 H new ATOM 0 HD13 LEU A 47 0.978 -35.270 4.828 1.00 0.00 H new ATOM 0 HD21 LEU A 47 2.660 -33.649 6.818 1.00 0.00 H new ATOM 0 HD22 LEU A 47 3.263 -34.974 5.794 1.00 0.00 H new ATOM 0 HD23 LEU A 47 4.051 -33.379 5.742 1.00 0.00 H new ATOM 625 N ILE A 48 3.392 -32.430 0.327 1.00 0.00 N ATOM 626 CA ILE A 48 4.025 -32.707 -0.993 1.00 0.00 C ATOM 627 C ILE A 48 5.525 -32.416 -0.911 1.00 0.00 C ATOM 628 O ILE A 48 5.942 -31.392 -0.406 1.00 0.00 O ATOM 629 CB ILE A 48 3.392 -31.815 -2.063 1.00 0.00 C ATOM 630 CG1 ILE A 48 1.897 -32.128 -2.169 1.00 0.00 C ATOM 631 CG2 ILE A 48 4.069 -32.080 -3.410 1.00 0.00 C ATOM 632 CD1 ILE A 48 1.299 -31.372 -3.356 1.00 0.00 C ATOM 0 H ILE A 48 3.552 -31.493 0.697 1.00 0.00 H new ATOM 0 HA ILE A 48 3.870 -33.754 -1.255 1.00 0.00 H new ATOM 0 HB ILE A 48 3.523 -30.768 -1.791 1.00 0.00 H new ATOM 0 HG12 ILE A 48 1.747 -33.200 -2.295 1.00 0.00 H new ATOM 0 HG13 ILE A 48 1.389 -31.841 -1.248 1.00 0.00 H new ATOM 0 HG21 ILE A 48 3.620 -31.446 -4.174 1.00 0.00 H new ATOM 0 HG22 ILE A 48 5.133 -31.857 -3.333 1.00 0.00 H new ATOM 0 HG23 ILE A 48 3.937 -33.127 -3.684 1.00 0.00 H new ATOM 0 HD11 ILE A 48 0.235 -31.595 -3.431 1.00 0.00 H new ATOM 0 HD12 ILE A 48 1.436 -30.300 -3.211 1.00 0.00 H new ATOM 0 HD13 ILE A 48 1.800 -31.681 -4.274 1.00 0.00 H new ATOM 644 N LYS A 49 6.340 -33.307 -1.404 1.00 0.00 N ATOM 645 CA LYS A 49 7.812 -33.080 -1.354 1.00 0.00 C ATOM 646 C LYS A 49 8.298 -32.585 -2.718 1.00 0.00 C ATOM 647 O LYS A 49 7.982 -33.154 -3.744 1.00 0.00 O ATOM 648 CB LYS A 49 8.519 -34.391 -1.005 1.00 0.00 C ATOM 649 CG LYS A 49 9.993 -34.110 -0.705 1.00 0.00 C ATOM 650 CD LYS A 49 10.682 -35.406 -0.273 1.00 0.00 C ATOM 651 CE LYS A 49 10.795 -36.349 -1.473 1.00 0.00 C ATOM 652 NZ LYS A 49 12.164 -36.251 -2.054 1.00 0.00 N ATOM 0 H LYS A 49 6.050 -34.183 -1.839 1.00 0.00 H new ATOM 0 HA LYS A 49 8.039 -32.332 -0.594 1.00 0.00 H new ATOM 0 HB2 LYS A 49 8.043 -34.855 -0.141 1.00 0.00 H new ATOM 0 HB3 LYS A 49 8.433 -35.095 -1.833 1.00 0.00 H new ATOM 0 HG2 LYS A 49 10.484 -33.702 -1.589 1.00 0.00 H new ATOM 0 HG3 LYS A 49 10.079 -33.360 0.082 1.00 0.00 H new ATOM 0 HD2 LYS A 49 11.673 -35.188 0.126 1.00 0.00 H new ATOM 0 HD3 LYS A 49 10.114 -35.883 0.526 1.00 0.00 H new ATOM 0 HE2 LYS A 49 10.592 -37.374 -1.164 1.00 0.00 H new ATOM 0 HE3 LYS A 49 10.050 -36.089 -2.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 12.242 -36.892 -2.870 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 12.341 -35.274 -2.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 12.866 -36.519 -1.335 1.00 0.00 H new ATOM 666 N THR A 50 9.064 -31.528 -2.738 1.00 0.00 N ATOM 667 CA THR A 50 9.569 -30.999 -4.036 1.00 0.00 C ATOM 668 C THR A 50 11.096 -30.901 -3.989 1.00 0.00 C ATOM 669 O THR A 50 11.697 -30.935 -2.933 1.00 0.00 O ATOM 670 CB THR A 50 8.977 -29.610 -4.287 1.00 0.00 C ATOM 671 OG1 THR A 50 9.669 -28.651 -3.500 1.00 0.00 O ATOM 672 CG2 THR A 50 7.495 -29.610 -3.909 1.00 0.00 C ATOM 0 H THR A 50 9.361 -31.009 -1.912 1.00 0.00 H new ATOM 0 HA THR A 50 9.273 -31.671 -4.841 1.00 0.00 H new ATOM 0 HB THR A 50 9.081 -29.356 -5.342 1.00 0.00 H new ATOM 0 HG1 THR A 50 9.542 -28.855 -2.550 1.00 0.00 H new ATOM 0 HG21 THR A 50 7.074 -28.621 -4.088 1.00 0.00 H new ATOM 0 HG22 THR A 50 6.965 -30.345 -4.515 1.00 0.00 H new ATOM 0 HG23 THR A 50 7.388 -29.864 -2.854 1.00 0.00 H new ATOM 680 N ILE A 51 11.728 -30.781 -5.124 1.00 0.00 N ATOM 681 CA ILE A 51 13.214 -30.682 -5.142 1.00 0.00 C ATOM 682 C ILE A 51 13.652 -29.432 -4.377 1.00 0.00 C ATOM 683 O ILE A 51 14.634 -29.442 -3.661 1.00 0.00 O ATOM 684 CB ILE A 51 13.702 -30.591 -6.590 1.00 0.00 C ATOM 685 CG1 ILE A 51 13.322 -29.229 -7.173 1.00 0.00 C ATOM 686 CG2 ILE A 51 13.051 -31.701 -7.418 1.00 0.00 C ATOM 687 CD1 ILE A 51 13.844 -29.125 -8.608 1.00 0.00 C ATOM 0 H ILE A 51 11.279 -30.747 -6.039 1.00 0.00 H new ATOM 0 HA ILE A 51 13.642 -31.566 -4.669 1.00 0.00 H new ATOM 0 HB ILE A 51 14.786 -30.706 -6.616 1.00 0.00 H new ATOM 0 HG12 ILE A 51 12.239 -29.105 -7.159 1.00 0.00 H new ATOM 0 HG13 ILE A 51 13.743 -28.430 -6.563 1.00 0.00 H new ATOM 0 HG21 ILE A 51 13.398 -31.637 -8.449 1.00 0.00 H new ATOM 0 HG22 ILE A 51 13.323 -32.672 -7.003 1.00 0.00 H new ATOM 0 HG23 ILE A 51 11.967 -31.586 -7.392 1.00 0.00 H new ATOM 0 HD11 ILE A 51 13.574 -28.155 -9.024 1.00 0.00 H new ATOM 0 HD12 ILE A 51 14.929 -29.231 -8.609 1.00 0.00 H new ATOM 0 HD13 ILE A 51 13.402 -29.916 -9.214 1.00 0.00 H new ATOM 699 N HIS A 52 12.930 -28.354 -4.520 1.00 0.00 N ATOM 700 CA HIS A 52 13.306 -27.105 -3.800 1.00 0.00 C ATOM 701 C HIS A 52 13.062 -27.288 -2.300 1.00 0.00 C ATOM 702 O HIS A 52 13.786 -26.767 -1.475 1.00 0.00 O ATOM 703 CB HIS A 52 12.455 -25.942 -4.316 1.00 0.00 C ATOM 704 CG HIS A 52 12.866 -24.673 -3.622 1.00 0.00 C ATOM 705 ND1 HIS A 52 14.091 -24.068 -3.852 1.00 0.00 N ATOM 706 CD2 HIS A 52 12.225 -23.883 -2.700 1.00 0.00 C ATOM 707 CE1 HIS A 52 14.148 -22.964 -3.084 1.00 0.00 C ATOM 708 NE2 HIS A 52 13.036 -22.805 -2.361 1.00 0.00 N ATOM 0 H HIS A 52 12.097 -28.285 -5.104 1.00 0.00 H new ATOM 0 HA HIS A 52 14.360 -26.889 -3.974 1.00 0.00 H new ATOM 0 HB2 HIS A 52 12.580 -25.836 -5.394 1.00 0.00 H new ATOM 0 HB3 HIS A 52 11.399 -26.142 -4.135 1.00 0.00 H new ATOM 0 HD2 HIS A 52 11.240 -24.070 -2.299 1.00 0.00 H new ATOM 0 HE1 HIS A 52 14.990 -22.289 -3.056 1.00 0.00 H new ATOM 0 HE2 HIS A 52 12.827 -22.055 -1.702 1.00 0.00 H new ATOM 716 N GLY A 53 12.048 -28.027 -1.941 1.00 0.00 N ATOM 717 CA GLY A 53 11.759 -28.243 -0.495 1.00 0.00 C ATOM 718 C GLY A 53 10.432 -28.989 -0.346 1.00 0.00 C ATOM 719 O GLY A 53 9.850 -29.441 -1.313 1.00 0.00 O ATOM 0 H GLY A 53 11.408 -28.490 -2.586 1.00 0.00 H new ATOM 0 HA2 GLY A 53 12.564 -28.815 -0.034 1.00 0.00 H new ATOM 0 HA3 GLY A 53 11.711 -27.286 0.024 1.00 0.00 H new ATOM 723 N GLU A 54 9.947 -29.122 0.858 1.00 0.00 N ATOM 724 CA GLU A 54 8.657 -29.838 1.066 1.00 0.00 C ATOM 725 C GLU A 54 7.519 -28.819 1.162 1.00 0.00 C ATOM 726 O GLU A 54 7.587 -27.868 1.915 1.00 0.00 O ATOM 727 CB GLU A 54 8.727 -30.649 2.362 1.00 0.00 C ATOM 728 CG GLU A 54 7.514 -31.577 2.451 1.00 0.00 C ATOM 729 CD GLU A 54 7.447 -32.196 3.848 1.00 0.00 C ATOM 730 OE1 GLU A 54 8.343 -31.935 4.634 1.00 0.00 O ATOM 731 OE2 GLU A 54 6.501 -32.921 4.109 1.00 0.00 O ATOM 0 H GLU A 54 10.388 -28.766 1.706 1.00 0.00 H new ATOM 0 HA GLU A 54 8.474 -30.510 0.227 1.00 0.00 H new ATOM 0 HB2 GLU A 54 9.647 -31.233 2.389 1.00 0.00 H new ATOM 0 HB3 GLU A 54 8.749 -29.979 3.222 1.00 0.00 H new ATOM 0 HG2 GLU A 54 6.600 -31.020 2.244 1.00 0.00 H new ATOM 0 HG3 GLU A 54 7.586 -32.361 1.697 1.00 0.00 H new ATOM 738 N LYS A 55 6.475 -29.009 0.403 1.00 0.00 N ATOM 739 CA LYS A 55 5.336 -28.049 0.451 1.00 0.00 C ATOM 740 C LYS A 55 4.054 -28.795 0.825 1.00 0.00 C ATOM 741 O LYS A 55 3.868 -29.944 0.476 1.00 0.00 O ATOM 742 CB LYS A 55 5.163 -27.395 -0.922 1.00 0.00 C ATOM 743 CG LYS A 55 6.430 -26.615 -1.278 1.00 0.00 C ATOM 744 CD LYS A 55 6.225 -25.892 -2.611 1.00 0.00 C ATOM 745 CE LYS A 55 7.524 -25.193 -3.016 1.00 0.00 C ATOM 746 NZ LYS A 55 7.577 -23.842 -2.389 1.00 0.00 N ATOM 0 H LYS A 55 6.361 -29.786 -0.248 1.00 0.00 H new ATOM 0 HA LYS A 55 5.540 -27.281 1.197 1.00 0.00 H new ATOM 0 HB2 LYS A 55 4.967 -28.156 -1.677 1.00 0.00 H new ATOM 0 HB3 LYS A 55 4.302 -26.727 -0.913 1.00 0.00 H new ATOM 0 HG2 LYS A 55 6.659 -25.895 -0.493 1.00 0.00 H new ATOM 0 HG3 LYS A 55 7.280 -27.293 -1.347 1.00 0.00 H new ATOM 0 HD2 LYS A 55 5.927 -26.604 -3.381 1.00 0.00 H new ATOM 0 HD3 LYS A 55 5.420 -25.163 -2.522 1.00 0.00 H new ATOM 0 HE2 LYS A 55 8.382 -25.786 -2.701 1.00 0.00 H new ATOM 0 HE3 LYS A 55 7.579 -25.105 -4.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 8.460 -23.366 -2.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 6.765 -23.278 -2.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 7.543 -23.938 -1.354 1.00 0.00 H new ATOM 760 N GLN A 56 3.166 -28.150 1.532 1.00 0.00 N ATOM 761 CA GLN A 56 1.896 -28.822 1.926 1.00 0.00 C ATOM 762 C GLN A 56 0.722 -28.152 1.214 1.00 0.00 C ATOM 763 O GLN A 56 0.636 -26.942 1.140 1.00 0.00 O ATOM 764 CB GLN A 56 1.705 -28.707 3.440 1.00 0.00 C ATOM 765 CG GLN A 56 2.755 -29.558 4.155 1.00 0.00 C ATOM 766 CD GLN A 56 2.703 -29.274 5.658 1.00 0.00 C ATOM 767 OE1 GLN A 56 2.548 -30.265 6.493 1.00 0.00 O flip ATOM 768 NE2 GLN A 56 2.804 -28.138 6.076 1.00 0.00 N flip ATOM 0 H GLN A 56 3.266 -27.187 1.853 1.00 0.00 H new ATOM 0 HA GLN A 56 1.941 -29.874 1.644 1.00 0.00 H new ATOM 0 HB2 GLN A 56 1.794 -27.666 3.750 1.00 0.00 H new ATOM 0 HB3 GLN A 56 0.704 -29.038 3.717 1.00 0.00 H new ATOM 0 HG2 GLN A 56 2.571 -30.616 3.967 1.00 0.00 H new ATOM 0 HG3 GLN A 56 3.748 -29.333 3.765 1.00 0.00 H new ATOM 0 HE21 GLN A 56 2.925 -27.363 5.424 1.00 0.00 H new ATOM 0 HE22 GLN A 56 2.768 -27.959 7.079 1.00 0.00 H new ATOM 777 N GLN A 57 -0.184 -28.928 0.689 1.00 0.00 N ATOM 778 CA GLN A 57 -1.352 -28.335 -0.018 1.00 0.00 C ATOM 779 C GLN A 57 -2.603 -28.491 0.849 1.00 0.00 C ATOM 780 O GLN A 57 -2.914 -29.567 1.319 1.00 0.00 O ATOM 781 CB GLN A 57 -1.561 -29.054 -1.353 1.00 0.00 C ATOM 782 CG GLN A 57 -0.360 -28.794 -2.266 1.00 0.00 C ATOM 783 CD GLN A 57 -0.620 -27.541 -3.105 1.00 0.00 C ATOM 784 OE1 GLN A 57 -1.464 -26.646 -2.672 1.00 0.00 O flip ATOM 785 NE2 GLN A 57 -0.049 -27.376 -4.165 1.00 0.00 N flip ATOM 0 H GLN A 57 -0.166 -29.947 0.719 1.00 0.00 H new ATOM 0 HA GLN A 57 -1.167 -27.277 -0.203 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -1.680 -30.125 -1.187 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -2.476 -28.702 -1.829 1.00 0.00 H new ATOM 0 HG2 GLN A 57 0.543 -28.664 -1.669 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -0.192 -29.652 -2.917 1.00 0.00 H new ATOM 0 HE21 GLN A 57 0.611 -28.076 -4.503 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -0.230 -26.537 -4.716 1.00 0.00 H new ATOM 794 N ASP A 58 -3.321 -27.423 1.067 1.00 0.00 N ATOM 795 CA ASP A 58 -4.549 -27.510 1.905 1.00 0.00 C ATOM 796 C ASP A 58 -5.710 -28.042 1.062 1.00 0.00 C ATOM 797 O ASP A 58 -5.748 -27.868 -0.140 1.00 0.00 O ATOM 798 CB ASP A 58 -4.900 -26.120 2.439 1.00 0.00 C ATOM 799 CG ASP A 58 -3.953 -25.760 3.585 1.00 0.00 C ATOM 800 OD1 ASP A 58 -3.225 -26.637 4.023 1.00 0.00 O ATOM 801 OD2 ASP A 58 -3.972 -24.616 4.006 1.00 0.00 O ATOM 0 H ASP A 58 -3.110 -26.495 0.701 1.00 0.00 H new ATOM 0 HA ASP A 58 -4.370 -28.187 2.741 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -4.820 -25.381 1.641 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -5.933 -26.103 2.787 1.00 0.00 H new ATOM 806 N VAL A 59 -6.656 -28.689 1.684 1.00 0.00 N ATOM 807 CA VAL A 59 -7.816 -29.233 0.923 1.00 0.00 C ATOM 808 C VAL A 59 -9.094 -28.521 1.373 1.00 0.00 C ATOM 809 O VAL A 59 -9.352 -28.379 2.552 1.00 0.00 O ATOM 810 CB VAL A 59 -7.943 -30.733 1.195 1.00 0.00 C ATOM 811 CG1 VAL A 59 -9.009 -31.330 0.274 1.00 0.00 C ATOM 812 CG2 VAL A 59 -6.600 -31.416 0.929 1.00 0.00 C ATOM 0 H VAL A 59 -6.676 -28.865 2.689 1.00 0.00 H new ATOM 0 HA VAL A 59 -7.664 -29.070 -0.144 1.00 0.00 H new ATOM 0 HB VAL A 59 -8.231 -30.890 2.235 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -9.100 -32.399 0.467 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -9.966 -30.844 0.463 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -8.721 -31.173 -0.765 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -6.691 -32.485 1.123 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -6.311 -31.259 -0.110 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -5.840 -30.992 1.585 1.00 0.00 H new ATOM 822 N TYR A 60 -9.895 -28.067 0.447 1.00 0.00 N ATOM 823 CA TYR A 60 -11.150 -27.359 0.833 1.00 0.00 C ATOM 824 C TYR A 60 -12.362 -28.083 0.243 1.00 0.00 C ATOM 825 O TYR A 60 -12.401 -28.396 -0.929 1.00 0.00 O ATOM 826 CB TYR A 60 -11.119 -25.928 0.293 1.00 0.00 C ATOM 827 CG TYR A 60 -10.010 -25.151 0.959 1.00 0.00 C ATOM 828 CD1 TYR A 60 -8.676 -25.523 0.757 1.00 0.00 C ATOM 829 CD2 TYR A 60 -10.316 -24.056 1.775 1.00 0.00 C ATOM 830 CE1 TYR A 60 -7.647 -24.799 1.371 1.00 0.00 C ATOM 831 CE2 TYR A 60 -9.287 -23.333 2.390 1.00 0.00 C ATOM 832 CZ TYR A 60 -7.953 -23.704 2.188 1.00 0.00 C ATOM 833 OH TYR A 60 -6.938 -22.991 2.794 1.00 0.00 O ATOM 0 H TYR A 60 -9.736 -28.155 -0.557 1.00 0.00 H new ATOM 0 HA TYR A 60 -11.226 -27.346 1.920 1.00 0.00 H new ATOM 0 HB2 TYR A 60 -10.968 -25.941 -0.786 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -12.077 -25.440 0.475 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -8.440 -26.368 0.128 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -11.346 -23.769 1.930 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -6.617 -25.085 1.214 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -9.523 -22.489 3.021 1.00 0.00 H new ATOM 0 HH TYR A 60 -7.289 -22.137 3.122 1.00 0.00 H new ATOM 843 N TYR A 61 -13.361 -28.332 1.044 1.00 0.00 N ATOM 844 CA TYR A 61 -14.581 -29.015 0.526 1.00 0.00 C ATOM 845 C TYR A 61 -15.619 -27.950 0.168 1.00 0.00 C ATOM 846 O TYR A 61 -16.178 -27.304 1.032 1.00 0.00 O ATOM 847 CB TYR A 61 -15.146 -29.942 1.604 1.00 0.00 C ATOM 848 CG TYR A 61 -16.230 -30.808 1.009 1.00 0.00 C ATOM 849 CD1 TYR A 61 -17.558 -30.364 1.004 1.00 0.00 C ATOM 850 CD2 TYR A 61 -15.908 -32.056 0.463 1.00 0.00 C ATOM 851 CE1 TYR A 61 -18.563 -31.168 0.454 1.00 0.00 C ATOM 852 CE2 TYR A 61 -16.913 -32.860 -0.088 1.00 0.00 C ATOM 853 CZ TYR A 61 -18.241 -32.416 -0.092 1.00 0.00 C ATOM 854 OH TYR A 61 -19.232 -33.208 -0.635 1.00 0.00 O ATOM 0 H TYR A 61 -13.386 -28.092 2.035 1.00 0.00 H new ATOM 0 HA TYR A 61 -14.333 -29.606 -0.356 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -14.352 -30.566 2.014 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -15.548 -29.354 2.429 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -17.807 -29.401 1.425 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -14.884 -32.399 0.467 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -19.587 -30.825 0.451 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -16.664 -33.823 -0.510 1.00 0.00 H new ATOM 0 HH TYR A 61 -20.109 -32.866 -0.363 1.00 0.00 H new ATOM 864 N LEU A 62 -15.870 -27.743 -1.096 1.00 0.00 N ATOM 865 CA LEU A 62 -16.858 -26.699 -1.490 1.00 0.00 C ATOM 866 C LEU A 62 -18.003 -27.320 -2.293 1.00 0.00 C ATOM 867 O LEU A 62 -17.938 -28.456 -2.720 1.00 0.00 O ATOM 868 CB LEU A 62 -16.158 -25.638 -2.342 1.00 0.00 C ATOM 869 CG LEU A 62 -14.961 -25.075 -1.573 1.00 0.00 C ATOM 870 CD1 LEU A 62 -14.343 -23.922 -2.366 1.00 0.00 C ATOM 871 CD2 LEU A 62 -15.427 -24.565 -0.209 1.00 0.00 C ATOM 0 H LEU A 62 -15.437 -28.248 -1.869 1.00 0.00 H new ATOM 0 HA LEU A 62 -17.268 -26.244 -0.589 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -15.826 -26.074 -3.284 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -16.855 -24.837 -2.589 1.00 0.00 H new ATOM 0 HG LEU A 62 -14.217 -25.859 -1.433 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -13.490 -23.520 -1.819 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -14.012 -24.286 -3.339 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -15.086 -23.137 -2.506 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -14.575 -24.164 0.340 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -16.171 -23.781 -0.349 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -15.868 -25.387 0.356 1.00 0.00 H new ATOM 883 N THR A 63 -19.051 -26.568 -2.500 1.00 0.00 N ATOM 884 CA THR A 63 -20.213 -27.086 -3.275 1.00 0.00 C ATOM 885 C THR A 63 -20.399 -26.231 -4.531 1.00 0.00 C ATOM 886 O THR A 63 -20.509 -25.023 -4.458 1.00 0.00 O ATOM 887 CB THR A 63 -21.476 -26.999 -2.413 1.00 0.00 C ATOM 888 OG1 THR A 63 -21.294 -27.762 -1.228 1.00 0.00 O ATOM 889 CG2 THR A 63 -22.672 -27.542 -3.197 1.00 0.00 C ATOM 0 H THR A 63 -19.151 -25.611 -2.163 1.00 0.00 H new ATOM 0 HA THR A 63 -20.034 -28.123 -3.558 1.00 0.00 H new ATOM 0 HB THR A 63 -21.663 -25.958 -2.148 1.00 0.00 H new ATOM 0 HG1 THR A 63 -22.101 -27.705 -0.675 1.00 0.00 H new ATOM 0 HG21 THR A 63 -23.569 -27.479 -2.582 1.00 0.00 H new ATOM 0 HG22 THR A 63 -22.811 -26.952 -4.103 1.00 0.00 H new ATOM 0 HG23 THR A 63 -22.489 -28.582 -3.466 1.00 0.00 H new ATOM 897 N PHE A 64 -20.434 -26.843 -5.683 1.00 0.00 N ATOM 898 CA PHE A 64 -20.611 -26.054 -6.935 1.00 0.00 C ATOM 899 C PHE A 64 -21.445 -26.856 -7.936 1.00 0.00 C ATOM 900 O PHE A 64 -21.489 -28.069 -7.893 1.00 0.00 O ATOM 901 CB PHE A 64 -19.242 -25.746 -7.545 1.00 0.00 C ATOM 902 CG PHE A 64 -18.492 -27.036 -7.777 1.00 0.00 C ATOM 903 CD1 PHE A 64 -17.779 -27.630 -6.728 1.00 0.00 C ATOM 904 CD2 PHE A 64 -18.511 -27.639 -9.040 1.00 0.00 C ATOM 905 CE1 PHE A 64 -17.083 -28.826 -6.943 1.00 0.00 C ATOM 906 CE2 PHE A 64 -17.816 -28.835 -9.255 1.00 0.00 C ATOM 907 CZ PHE A 64 -17.102 -29.429 -8.207 1.00 0.00 C ATOM 0 H PHE A 64 -20.348 -27.851 -5.811 1.00 0.00 H new ATOM 0 HA PHE A 64 -21.124 -25.121 -6.702 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -19.364 -25.210 -8.486 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -18.673 -25.097 -6.879 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -17.766 -27.166 -5.753 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -19.062 -27.182 -9.849 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -16.532 -29.283 -6.135 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -17.830 -29.300 -10.230 1.00 0.00 H new ATOM 0 HZ PHE A 64 -16.566 -30.352 -8.373 1.00 0.00 H new ATOM 917 N LYS A 65 -22.106 -26.185 -8.840 1.00 0.00 N ATOM 918 CA LYS A 65 -22.936 -26.907 -9.845 1.00 0.00 C ATOM 919 C LYS A 65 -22.076 -27.248 -11.063 1.00 0.00 C ATOM 920 O LYS A 65 -21.404 -26.401 -11.617 1.00 0.00 O ATOM 921 CB LYS A 65 -24.104 -26.018 -10.277 1.00 0.00 C ATOM 922 CG LYS A 65 -24.958 -25.668 -9.056 1.00 0.00 C ATOM 923 CD LYS A 65 -26.207 -24.908 -9.507 1.00 0.00 C ATOM 924 CE LYS A 65 -26.993 -24.444 -8.279 1.00 0.00 C ATOM 925 NZ LYS A 65 -28.435 -24.775 -8.457 1.00 0.00 N ATOM 0 H LYS A 65 -22.107 -25.169 -8.926 1.00 0.00 H new ATOM 0 HA LYS A 65 -23.324 -27.825 -9.404 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -23.729 -25.108 -10.744 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -24.710 -26.533 -11.023 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -25.244 -26.577 -8.526 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -24.382 -25.060 -8.358 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -25.923 -24.050 -10.116 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -26.831 -25.549 -10.130 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -26.606 -24.928 -7.382 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -26.870 -23.370 -8.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -28.969 -24.460 -7.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -28.800 -24.294 -9.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -28.544 -25.803 -8.569 1.00 0.00 H new ATOM 939 N VAL A 66 -22.090 -28.483 -11.483 1.00 0.00 N ATOM 940 CA VAL A 66 -21.271 -28.879 -12.663 1.00 0.00 C ATOM 941 C VAL A 66 -22.176 -29.027 -13.888 1.00 0.00 C ATOM 942 O VAL A 66 -22.809 -30.046 -14.083 1.00 0.00 O ATOM 943 CB VAL A 66 -20.579 -30.213 -12.377 1.00 0.00 C ATOM 944 CG1 VAL A 66 -19.328 -30.338 -13.248 1.00 0.00 C ATOM 945 CG2 VAL A 66 -20.182 -30.275 -10.901 1.00 0.00 C ATOM 0 H VAL A 66 -22.633 -29.235 -11.060 1.00 0.00 H new ATOM 0 HA VAL A 66 -20.520 -28.113 -12.857 1.00 0.00 H new ATOM 0 HB VAL A 66 -21.262 -31.032 -12.605 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -18.836 -31.289 -13.043 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -19.611 -30.295 -14.300 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -18.644 -29.520 -13.022 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -19.689 -31.225 -10.696 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -19.500 -29.456 -10.673 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -21.074 -30.188 -10.280 1.00 0.00 H new ATOM 955 N GLN A 67 -22.244 -28.020 -14.715 1.00 0.00 N ATOM 956 CA GLN A 67 -23.110 -28.108 -15.924 1.00 0.00 C ATOM 957 C GLN A 67 -24.573 -28.209 -15.489 1.00 0.00 C ATOM 958 O GLN A 67 -25.346 -28.964 -16.044 1.00 0.00 O ATOM 959 CB GLN A 67 -22.731 -29.349 -16.734 1.00 0.00 C ATOM 960 CG GLN A 67 -21.227 -29.333 -17.016 1.00 0.00 C ATOM 961 CD GLN A 67 -20.861 -30.525 -17.904 1.00 0.00 C ATOM 962 OE1 GLN A 67 -21.447 -31.583 -17.791 1.00 0.00 O ATOM 963 NE2 GLN A 67 -19.911 -30.397 -18.789 1.00 0.00 N ATOM 0 H GLN A 67 -21.738 -27.141 -14.606 1.00 0.00 H new ATOM 0 HA GLN A 67 -22.972 -27.219 -16.539 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -22.999 -30.251 -16.184 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -23.288 -29.369 -17.671 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -20.948 -28.401 -17.507 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -20.670 -29.379 -16.080 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -19.419 -29.509 -18.884 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -19.660 -31.185 -19.386 1.00 0.00 H new ATOM 972 N GLY A 68 -24.956 -27.454 -14.496 1.00 0.00 N ATOM 973 CA GLY A 68 -26.367 -27.507 -14.021 1.00 0.00 C ATOM 974 C GLY A 68 -26.563 -28.751 -13.153 1.00 0.00 C ATOM 975 O GLY A 68 -27.624 -29.345 -13.132 1.00 0.00 O ATOM 0 H GLY A 68 -24.353 -26.803 -13.993 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -26.604 -26.610 -13.449 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -27.048 -27.532 -14.872 1.00 0.00 H new ATOM 979 N ARG A 69 -25.549 -29.151 -12.436 1.00 0.00 N ATOM 980 CA ARG A 69 -25.675 -30.356 -11.569 1.00 0.00 C ATOM 981 C ARG A 69 -25.006 -30.082 -10.220 1.00 0.00 C ATOM 982 O ARG A 69 -23.798 -30.007 -10.120 1.00 0.00 O ATOM 983 CB ARG A 69 -24.991 -31.545 -12.246 1.00 0.00 C ATOM 984 CG ARG A 69 -25.804 -31.971 -13.470 1.00 0.00 C ATOM 985 CD ARG A 69 -25.300 -33.325 -13.974 1.00 0.00 C ATOM 986 NE ARG A 69 -25.907 -33.616 -15.303 1.00 0.00 N ATOM 987 CZ ARG A 69 -25.445 -34.596 -16.030 1.00 0.00 C ATOM 988 NH1 ARG A 69 -24.822 -35.592 -15.462 1.00 0.00 N ATOM 989 NH2 ARG A 69 -25.607 -34.580 -17.325 1.00 0.00 N ATOM 0 H ARG A 69 -24.637 -28.694 -12.413 1.00 0.00 H new ATOM 0 HA ARG A 69 -26.729 -30.585 -11.413 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -23.978 -31.274 -12.545 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -24.905 -32.376 -11.546 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -26.861 -32.038 -13.212 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -25.715 -31.222 -14.257 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -24.213 -33.314 -14.053 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -25.560 -34.110 -13.264 1.00 0.00 H new ATOM 0 HE ARG A 69 -26.683 -33.049 -15.644 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -24.696 -35.604 -14.450 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -24.461 -36.358 -16.030 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -26.095 -33.802 -17.768 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -25.246 -35.346 -17.894 1.00 0.00 H new ATOM 1003 N LYS A 70 -25.782 -29.932 -9.182 1.00 0.00 N ATOM 1004 CA LYS A 70 -25.190 -29.662 -7.842 1.00 0.00 C ATOM 1005 C LYS A 70 -24.231 -30.793 -7.467 1.00 0.00 C ATOM 1006 O LYS A 70 -24.606 -31.948 -7.416 1.00 0.00 O ATOM 1007 CB LYS A 70 -26.307 -29.574 -6.800 1.00 0.00 C ATOM 1008 CG LYS A 70 -25.758 -28.949 -5.516 1.00 0.00 C ATOM 1009 CD LYS A 70 -26.874 -28.867 -4.473 1.00 0.00 C ATOM 1010 CE LYS A 70 -26.352 -28.156 -3.222 1.00 0.00 C ATOM 1011 NZ LYS A 70 -27.249 -27.014 -2.890 1.00 0.00 N ATOM 0 H LYS A 70 -26.800 -29.985 -9.204 1.00 0.00 H new ATOM 0 HA LYS A 70 -24.643 -28.719 -7.871 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -27.132 -28.975 -7.185 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -26.705 -30.567 -6.593 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -24.930 -29.546 -5.133 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -25.364 -27.954 -5.722 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -27.729 -28.327 -4.881 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -27.221 -29.868 -4.217 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -26.309 -28.854 -2.386 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -25.337 -27.798 -3.391 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -26.895 -26.530 -2.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -27.269 -26.345 -3.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -28.210 -27.368 -2.712 1.00 0.00 H new ATOM 1025 N VAL A 71 -22.994 -30.470 -7.202 1.00 0.00 N ATOM 1026 CA VAL A 71 -22.010 -31.525 -6.829 1.00 0.00 C ATOM 1027 C VAL A 71 -20.990 -30.941 -5.849 1.00 0.00 C ATOM 1028 O VAL A 71 -20.477 -29.857 -6.046 1.00 0.00 O ATOM 1029 CB VAL A 71 -21.289 -32.018 -8.085 1.00 0.00 C ATOM 1030 CG1 VAL A 71 -20.256 -33.078 -7.698 1.00 0.00 C ATOM 1031 CG2 VAL A 71 -22.308 -32.627 -9.051 1.00 0.00 C ATOM 0 H VAL A 71 -22.623 -29.520 -7.228 1.00 0.00 H new ATOM 0 HA VAL A 71 -22.530 -32.360 -6.360 1.00 0.00 H new ATOM 0 HB VAL A 71 -20.786 -31.180 -8.568 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -19.742 -33.429 -8.593 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -19.530 -32.645 -7.010 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -20.758 -33.916 -7.215 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -21.795 -32.979 -9.946 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -22.811 -33.465 -8.568 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -23.044 -31.872 -9.327 1.00 0.00 H new ATOM 1041 N GLU A 72 -20.693 -31.648 -4.793 1.00 0.00 N ATOM 1042 CA GLU A 72 -19.708 -31.128 -3.803 1.00 0.00 C ATOM 1043 C GLU A 72 -18.430 -31.963 -3.862 1.00 0.00 C ATOM 1044 O GLU A 72 -18.469 -33.169 -4.001 1.00 0.00 O ATOM 1045 CB GLU A 72 -20.304 -31.212 -2.398 1.00 0.00 C ATOM 1046 CG GLU A 72 -21.634 -30.460 -2.369 1.00 0.00 C ATOM 1047 CD GLU A 72 -22.316 -30.678 -1.017 1.00 0.00 C ATOM 1048 OE1 GLU A 72 -21.850 -31.523 -0.270 1.00 0.00 O ATOM 1049 OE2 GLU A 72 -23.292 -29.996 -0.751 1.00 0.00 O ATOM 0 H GLU A 72 -21.089 -32.562 -4.573 1.00 0.00 H new ATOM 0 HA GLU A 72 -19.474 -30.090 -4.039 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -20.456 -32.254 -2.116 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -19.614 -30.783 -1.671 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -21.466 -29.396 -2.536 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -22.279 -30.811 -3.174 1.00 0.00 H new ATOM 1056 N ALA A 73 -17.296 -31.329 -3.754 1.00 0.00 N ATOM 1057 CA ALA A 73 -16.015 -32.086 -3.802 1.00 0.00 C ATOM 1058 C ALA A 73 -14.900 -31.246 -3.178 1.00 0.00 C ATOM 1059 O ALA A 73 -15.026 -30.047 -3.019 1.00 0.00 O ATOM 1060 CB ALA A 73 -15.663 -32.401 -5.257 1.00 0.00 C ATOM 0 H ALA A 73 -17.201 -30.320 -3.635 1.00 0.00 H new ATOM 0 HA ALA A 73 -16.123 -33.016 -3.244 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -14.725 -32.955 -5.293 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -16.457 -33.002 -5.701 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -15.556 -31.471 -5.815 1.00 0.00 H new ATOM 1066 N GLU A 74 -13.808 -31.866 -2.826 1.00 0.00 N ATOM 1067 CA GLU A 74 -12.683 -31.104 -2.217 1.00 0.00 C ATOM 1068 C GLU A 74 -11.877 -30.426 -3.326 1.00 0.00 C ATOM 1069 O GLU A 74 -11.592 -31.017 -4.348 1.00 0.00 O ATOM 1070 CB GLU A 74 -11.779 -32.063 -1.440 1.00 0.00 C ATOM 1071 CG GLU A 74 -12.579 -32.717 -0.313 1.00 0.00 C ATOM 1072 CD GLU A 74 -11.664 -33.638 0.496 1.00 0.00 C ATOM 1073 OE1 GLU A 74 -10.564 -33.899 0.038 1.00 0.00 O ATOM 1074 OE2 GLU A 74 -12.079 -34.067 1.560 1.00 0.00 O ATOM 0 H GLU A 74 -13.646 -32.867 -2.934 1.00 0.00 H new ATOM 0 HA GLU A 74 -13.077 -30.349 -1.537 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -11.381 -32.827 -2.108 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -10.926 -31.523 -1.029 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -13.007 -31.952 0.335 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -13.411 -33.286 -0.727 1.00 0.00 H new ATOM 1081 N VAL A 75 -11.511 -29.189 -3.136 1.00 0.00 N ATOM 1082 CA VAL A 75 -10.730 -28.477 -4.184 1.00 0.00 C ATOM 1083 C VAL A 75 -9.495 -27.831 -3.556 1.00 0.00 C ATOM 1084 O VAL A 75 -9.494 -27.464 -2.398 1.00 0.00 O ATOM 1085 CB VAL A 75 -11.604 -27.393 -4.816 1.00 0.00 C ATOM 1086 CG1 VAL A 75 -12.920 -28.012 -5.289 1.00 0.00 C ATOM 1087 CG2 VAL A 75 -11.894 -26.306 -3.779 1.00 0.00 C ATOM 0 H VAL A 75 -11.719 -28.641 -2.301 1.00 0.00 H new ATOM 0 HA VAL A 75 -10.416 -29.188 -4.948 1.00 0.00 H new ATOM 0 HB VAL A 75 -11.083 -26.954 -5.667 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -13.544 -27.240 -5.740 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -12.713 -28.788 -6.026 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -13.442 -28.450 -4.439 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -12.517 -25.532 -4.228 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -12.416 -26.744 -2.929 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -10.956 -25.866 -3.441 1.00 0.00 H new ATOM 1097 N LEU A 76 -8.442 -27.685 -4.314 1.00 0.00 N ATOM 1098 CA LEU A 76 -7.209 -27.058 -3.761 1.00 0.00 C ATOM 1099 C LEU A 76 -7.141 -25.596 -4.209 1.00 0.00 C ATOM 1100 O LEU A 76 -7.629 -25.236 -5.262 1.00 0.00 O ATOM 1101 CB LEU A 76 -5.979 -27.809 -4.276 1.00 0.00 C ATOM 1102 CG LEU A 76 -6.008 -29.248 -3.758 1.00 0.00 C ATOM 1103 CD1 LEU A 76 -7.051 -30.049 -4.540 1.00 0.00 C ATOM 1104 CD2 LEU A 76 -4.629 -29.885 -3.945 1.00 0.00 C ATOM 0 H LEU A 76 -8.383 -27.973 -5.291 1.00 0.00 H new ATOM 0 HA LEU A 76 -7.231 -27.105 -2.672 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -5.966 -27.803 -5.366 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -5.069 -27.310 -3.944 1.00 0.00 H new ATOM 0 HG LEU A 76 -6.268 -29.249 -2.699 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -7.073 -31.075 -4.172 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -8.033 -29.595 -4.407 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -6.791 -30.049 -5.599 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -4.649 -30.910 -3.576 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -4.369 -29.885 -5.003 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -3.886 -29.314 -3.389 1.00 0.00 H new ATOM 1116 N ALA A 77 -6.541 -24.749 -3.418 1.00 0.00 N ATOM 1117 CA ALA A 77 -6.446 -23.312 -3.801 1.00 0.00 C ATOM 1118 C ALA A 77 -5.305 -23.123 -4.803 1.00 0.00 C ATOM 1119 O ALA A 77 -4.226 -23.657 -4.638 1.00 0.00 O ATOM 1120 CB ALA A 77 -6.177 -22.468 -2.555 1.00 0.00 C ATOM 0 H ALA A 77 -6.113 -24.990 -2.524 1.00 0.00 H new ATOM 0 HA ALA A 77 -7.384 -22.996 -4.257 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -6.108 -21.417 -2.835 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -6.992 -22.600 -1.843 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -5.240 -22.784 -2.097 1.00 0.00 H new ATOM 1126 N SER A 78 -5.535 -22.367 -5.842 1.00 0.00 N ATOM 1127 CA SER A 78 -4.465 -22.143 -6.855 1.00 0.00 C ATOM 1128 C SER A 78 -4.538 -20.700 -7.361 1.00 0.00 C ATOM 1129 O SER A 78 -5.594 -20.101 -7.400 1.00 0.00 O ATOM 1130 CB SER A 78 -4.667 -23.105 -8.028 1.00 0.00 C ATOM 1131 OG SER A 78 -3.430 -23.307 -8.696 1.00 0.00 O ATOM 0 H SER A 78 -6.419 -21.894 -6.033 1.00 0.00 H new ATOM 0 HA SER A 78 -3.490 -22.321 -6.402 1.00 0.00 H new ATOM 0 HB2 SER A 78 -5.057 -24.057 -7.668 1.00 0.00 H new ATOM 0 HB3 SER A 78 -5.404 -22.700 -8.721 1.00 0.00 H new ATOM 0 HG SER A 78 -3.463 -22.884 -9.580 1.00 0.00 H new ATOM 1137 N PRO A 79 -3.388 -20.135 -7.758 1.00 0.00 N ATOM 1138 CA PRO A 79 -3.315 -18.759 -8.267 1.00 0.00 C ATOM 1139 C PRO A 79 -3.957 -18.622 -9.653 1.00 0.00 C ATOM 1140 O PRO A 79 -3.951 -17.562 -10.245 1.00 0.00 O ATOM 1141 CB PRO A 79 -1.813 -18.492 -8.361 1.00 0.00 C ATOM 1142 CG PRO A 79 -1.197 -19.842 -8.510 1.00 0.00 C ATOM 1143 CD PRO A 79 -2.069 -20.793 -7.739 1.00 0.00 C ATOM 0 HA PRO A 79 -3.850 -18.060 -7.624 1.00 0.00 H new ATOM 0 HB2 PRO A 79 -1.577 -17.853 -9.212 1.00 0.00 H new ATOM 0 HB3 PRO A 79 -1.444 -17.985 -7.469 1.00 0.00 H new ATOM 0 HG2 PRO A 79 -1.142 -20.130 -9.560 1.00 0.00 H new ATOM 0 HG3 PRO A 79 -0.178 -19.849 -8.123 1.00 0.00 H new ATOM 0 HD2 PRO A 79 -2.103 -21.777 -8.207 1.00 0.00 H new ATOM 0 HD3 PRO A 79 -1.706 -20.937 -6.721 1.00 0.00 H new ATOM 1151 N TYR A 80 -4.510 -19.685 -10.174 1.00 0.00 N ATOM 1152 CA TYR A 80 -5.148 -19.608 -11.520 1.00 0.00 C ATOM 1153 C TYR A 80 -6.373 -18.693 -11.455 1.00 0.00 C ATOM 1154 O TYR A 80 -6.793 -18.276 -10.394 1.00 0.00 O ATOM 1155 CB TYR A 80 -5.578 -21.009 -11.962 1.00 0.00 C ATOM 1156 CG TYR A 80 -4.356 -21.885 -12.109 1.00 0.00 C ATOM 1157 CD1 TYR A 80 -3.410 -21.605 -13.103 1.00 0.00 C ATOM 1158 CD2 TYR A 80 -4.169 -22.976 -11.252 1.00 0.00 C ATOM 1159 CE1 TYR A 80 -2.277 -22.416 -13.238 1.00 0.00 C ATOM 1160 CE2 TYR A 80 -3.036 -23.786 -11.388 1.00 0.00 C ATOM 1161 CZ TYR A 80 -2.090 -23.507 -12.381 1.00 0.00 C ATOM 1162 OH TYR A 80 -0.973 -24.306 -12.514 1.00 0.00 O ATOM 0 H TYR A 80 -4.547 -20.601 -9.727 1.00 0.00 H new ATOM 0 HA TYR A 80 -4.433 -19.205 -12.237 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -6.262 -21.439 -11.230 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -6.116 -20.955 -12.908 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -3.554 -20.764 -13.765 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -4.899 -23.193 -10.486 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -1.547 -22.200 -14.004 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -2.891 -24.627 -10.726 1.00 0.00 H new ATOM 0 HH TYR A 80 -0.997 -25.017 -11.840 1.00 0.00 H new ATOM 1172 N ASP A 81 -6.948 -18.373 -12.584 1.00 0.00 N ATOM 1173 CA ASP A 81 -8.142 -17.481 -12.585 1.00 0.00 C ATOM 1174 C ASP A 81 -9.383 -18.277 -12.995 1.00 0.00 C ATOM 1175 O ASP A 81 -10.377 -17.720 -13.417 1.00 0.00 O ATOM 1176 CB ASP A 81 -7.922 -16.338 -13.578 1.00 0.00 C ATOM 1177 CG ASP A 81 -6.911 -15.347 -12.996 1.00 0.00 C ATOM 1178 OD1 ASP A 81 -6.560 -15.501 -11.838 1.00 0.00 O ATOM 1179 OD2 ASP A 81 -6.506 -14.452 -13.719 1.00 0.00 O ATOM 0 H ASP A 81 -6.642 -18.691 -13.504 1.00 0.00 H new ATOM 0 HA ASP A 81 -8.288 -17.075 -11.584 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -7.558 -16.731 -14.527 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -8.866 -15.833 -13.783 1.00 0.00 H new ATOM 1184 N TYR A 82 -9.338 -19.576 -12.874 1.00 0.00 N ATOM 1185 CA TYR A 82 -10.520 -20.398 -13.257 1.00 0.00 C ATOM 1186 C TYR A 82 -10.625 -21.605 -12.323 1.00 0.00 C ATOM 1187 O TYR A 82 -10.077 -21.612 -11.238 1.00 0.00 O ATOM 1188 CB TYR A 82 -10.364 -20.876 -14.701 1.00 0.00 C ATOM 1189 CG TYR A 82 -9.282 -21.927 -14.772 1.00 0.00 C ATOM 1190 CD1 TYR A 82 -7.941 -21.565 -14.598 1.00 0.00 C ATOM 1191 CD2 TYR A 82 -9.621 -23.263 -15.013 1.00 0.00 C ATOM 1192 CE1 TYR A 82 -6.939 -22.539 -14.665 1.00 0.00 C ATOM 1193 CE2 TYR A 82 -8.619 -24.238 -15.080 1.00 0.00 C ATOM 1194 CZ TYR A 82 -7.278 -23.876 -14.905 1.00 0.00 C ATOM 1195 OH TYR A 82 -6.289 -24.837 -14.972 1.00 0.00 O ATOM 0 H TYR A 82 -8.536 -20.102 -12.527 1.00 0.00 H new ATOM 0 HA TYR A 82 -11.425 -19.796 -13.173 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -11.307 -21.285 -15.063 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -10.112 -20.036 -15.348 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -7.680 -20.534 -14.412 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -10.656 -23.542 -15.147 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -5.904 -22.260 -14.532 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -8.880 -25.269 -15.267 1.00 0.00 H new ATOM 0 HH TYR A 82 -6.168 -25.118 -15.903 1.00 0.00 H new ATOM 1205 N ILE A 83 -11.327 -22.627 -12.732 1.00 0.00 N ATOM 1206 CA ILE A 83 -11.467 -23.828 -11.860 1.00 0.00 C ATOM 1207 C ILE A 83 -11.020 -25.075 -12.627 1.00 0.00 C ATOM 1208 O ILE A 83 -11.068 -25.122 -13.840 1.00 0.00 O ATOM 1209 CB ILE A 83 -12.929 -23.994 -11.440 1.00 0.00 C ATOM 1210 CG1 ILE A 83 -13.512 -22.634 -11.045 1.00 0.00 C ATOM 1211 CG2 ILE A 83 -13.009 -24.947 -10.246 1.00 0.00 C ATOM 1212 CD1 ILE A 83 -15.007 -22.610 -11.369 1.00 0.00 C ATOM 0 H ILE A 83 -11.808 -22.682 -13.630 1.00 0.00 H new ATOM 0 HA ILE A 83 -10.845 -23.700 -10.974 1.00 0.00 H new ATOM 0 HB ILE A 83 -13.500 -24.402 -12.274 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -13.356 -22.454 -9.981 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -12.999 -21.836 -11.582 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -14.050 -25.067 -9.945 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -12.599 -25.917 -10.527 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -12.436 -24.537 -9.414 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -15.425 -21.643 -11.089 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -15.150 -22.771 -12.437 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -15.513 -23.399 -10.812 1.00 0.00 H new ATOM 1224 N LEU A 84 -10.591 -26.088 -11.927 1.00 0.00 N ATOM 1225 CA LEU A 84 -10.149 -27.334 -12.612 1.00 0.00 C ATOM 1226 C LEU A 84 -11.016 -28.500 -12.136 1.00 0.00 C ATOM 1227 O LEU A 84 -11.151 -28.741 -10.953 1.00 0.00 O ATOM 1228 CB LEU A 84 -8.683 -27.612 -12.274 1.00 0.00 C ATOM 1229 CG LEU A 84 -7.795 -26.587 -12.981 1.00 0.00 C ATOM 1230 CD1 LEU A 84 -6.761 -26.039 -11.996 1.00 0.00 C ATOM 1231 CD2 LEU A 84 -7.075 -27.258 -14.153 1.00 0.00 C ATOM 0 H LEU A 84 -10.527 -26.107 -10.909 1.00 0.00 H new ATOM 0 HA LEU A 84 -10.252 -27.217 -13.691 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -8.531 -27.559 -11.196 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -8.412 -28.621 -12.585 1.00 0.00 H new ATOM 0 HG LEU A 84 -8.412 -25.769 -13.352 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -6.129 -25.309 -12.501 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -7.272 -25.560 -11.161 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -6.144 -26.857 -11.623 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -6.442 -26.528 -14.657 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -6.459 -28.077 -13.781 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -7.810 -27.648 -14.857 1.00 0.00 H new ATOM 1243 N LEU A 85 -11.609 -29.222 -13.045 1.00 0.00 N ATOM 1244 CA LEU A 85 -12.470 -30.366 -12.636 1.00 0.00 C ATOM 1245 C LEU A 85 -11.740 -31.681 -12.915 1.00 0.00 C ATOM 1246 O LEU A 85 -11.055 -31.825 -13.908 1.00 0.00 O ATOM 1247 CB LEU A 85 -13.786 -30.332 -13.425 1.00 0.00 C ATOM 1248 CG LEU A 85 -14.239 -28.881 -13.656 1.00 0.00 C ATOM 1249 CD1 LEU A 85 -13.914 -28.022 -12.429 1.00 0.00 C ATOM 1250 CD2 LEU A 85 -13.523 -28.311 -14.883 1.00 0.00 C ATOM 0 H LEU A 85 -11.535 -29.070 -14.051 1.00 0.00 H new ATOM 0 HA LEU A 85 -12.687 -30.290 -11.571 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -13.655 -30.835 -14.383 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -14.557 -30.878 -12.881 1.00 0.00 H new ATOM 0 HG LEU A 85 -15.316 -28.869 -13.821 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -14.240 -26.997 -12.606 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -14.432 -28.422 -11.557 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -12.839 -28.035 -12.250 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -13.844 -27.282 -15.047 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -12.446 -28.333 -14.718 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -13.768 -28.911 -15.759 1.00 0.00 H new ATOM 1262 N ASN A 86 -11.885 -32.642 -12.045 1.00 0.00 N ATOM 1263 CA ASN A 86 -11.201 -33.950 -12.259 1.00 0.00 C ATOM 1264 C ASN A 86 -12.211 -34.973 -12.779 1.00 0.00 C ATOM 1265 O ASN A 86 -13.407 -34.796 -12.657 1.00 0.00 O ATOM 1266 CB ASN A 86 -10.603 -34.449 -10.939 1.00 0.00 C ATOM 1267 CG ASN A 86 -11.459 -33.970 -9.765 1.00 0.00 C ATOM 1268 OD1 ASN A 86 -11.711 -32.790 -9.623 1.00 0.00 O ATOM 1269 ND2 ASN A 86 -11.918 -34.842 -8.909 1.00 0.00 N ATOM 0 H ASN A 86 -12.447 -32.579 -11.196 1.00 0.00 H new ATOM 0 HA ASN A 86 -10.401 -33.821 -12.988 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -10.551 -35.538 -10.942 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -9.583 -34.081 -10.830 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -12.488 -34.533 -8.122 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -11.707 -35.833 -9.028 1.00 0.00 H new ATOM 1276 N PRO A 87 -11.712 -36.067 -13.372 1.00 0.00 N ATOM 1277 CA PRO A 87 -12.564 -37.129 -13.917 1.00 0.00 C ATOM 1278 C PRO A 87 -13.230 -37.946 -12.806 1.00 0.00 C ATOM 1279 O PRO A 87 -14.240 -38.589 -13.015 1.00 0.00 O ATOM 1280 CB PRO A 87 -11.588 -38.006 -14.699 1.00 0.00 C ATOM 1281 CG PRO A 87 -10.264 -37.770 -14.052 1.00 0.00 C ATOM 1282 CD PRO A 87 -10.279 -36.351 -13.556 1.00 0.00 C ATOM 0 HA PRO A 87 -13.378 -36.731 -14.524 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -11.872 -39.057 -14.648 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -11.568 -37.732 -15.754 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -10.104 -38.467 -13.229 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -9.452 -37.924 -14.762 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -9.726 -36.246 -12.623 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -9.824 -35.670 -14.275 1.00 0.00 H new ATOM 1290 N SER A 88 -12.673 -37.924 -11.626 1.00 0.00 N ATOM 1291 CA SER A 88 -13.275 -38.698 -10.504 1.00 0.00 C ATOM 1292 C SER A 88 -14.487 -37.941 -9.957 1.00 0.00 C ATOM 1293 O SER A 88 -15.459 -38.532 -9.531 1.00 0.00 O ATOM 1294 CB SER A 88 -12.239 -38.874 -9.391 1.00 0.00 C ATOM 1295 OG SER A 88 -11.115 -39.578 -9.896 1.00 0.00 O ATOM 0 H SER A 88 -11.828 -37.404 -11.391 1.00 0.00 H new ATOM 0 HA SER A 88 -13.589 -39.677 -10.865 1.00 0.00 H new ATOM 0 HB2 SER A 88 -11.930 -37.901 -9.010 1.00 0.00 H new ATOM 0 HB3 SER A 88 -12.677 -39.419 -8.555 1.00 0.00 H new ATOM 0 HG SER A 88 -10.451 -39.689 -9.184 1.00 0.00 H new ATOM 1301 N ASP A 89 -14.438 -36.637 -9.965 1.00 0.00 N ATOM 1302 CA ASP A 89 -15.589 -35.847 -9.446 1.00 0.00 C ATOM 1303 C ASP A 89 -16.681 -35.775 -10.515 1.00 0.00 C ATOM 1304 O ASP A 89 -17.856 -35.879 -10.223 1.00 0.00 O ATOM 1305 CB ASP A 89 -15.120 -34.432 -9.090 1.00 0.00 C ATOM 1306 CG ASP A 89 -14.913 -33.619 -10.370 1.00 0.00 C ATOM 1307 OD1 ASP A 89 -15.899 -33.311 -11.019 1.00 0.00 O ATOM 1308 OD2 ASP A 89 -13.773 -33.317 -10.678 1.00 0.00 O ATOM 0 H ASP A 89 -13.652 -36.086 -10.308 1.00 0.00 H new ATOM 0 HA ASP A 89 -15.989 -36.329 -8.554 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -15.858 -33.944 -8.453 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -14.190 -34.479 -8.523 1.00 0.00 H new ATOM 1313 N VAL A 90 -16.304 -35.595 -11.751 1.00 0.00 N ATOM 1314 CA VAL A 90 -17.325 -35.515 -12.834 1.00 0.00 C ATOM 1315 C VAL A 90 -17.254 -36.774 -13.703 1.00 0.00 C ATOM 1316 O VAL A 90 -16.840 -36.728 -14.844 1.00 0.00 O ATOM 1317 CB VAL A 90 -17.056 -34.282 -13.700 1.00 0.00 C ATOM 1318 CG1 VAL A 90 -17.596 -33.037 -12.995 1.00 0.00 C ATOM 1319 CG2 VAL A 90 -15.550 -34.132 -13.921 1.00 0.00 C ATOM 0 H VAL A 90 -15.336 -35.500 -12.058 1.00 0.00 H new ATOM 0 HA VAL A 90 -18.317 -35.438 -12.389 1.00 0.00 H new ATOM 0 HB VAL A 90 -17.553 -34.398 -14.663 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -17.405 -32.158 -13.611 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -18.669 -33.144 -12.839 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -17.099 -32.920 -12.032 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -15.358 -33.254 -14.538 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -15.051 -34.016 -12.959 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -15.166 -35.019 -14.424 1.00 0.00 H new ATOM 1329 N PRO A 91 -17.671 -37.920 -13.145 1.00 0.00 N ATOM 1330 CA PRO A 91 -17.660 -39.201 -13.863 1.00 0.00 C ATOM 1331 C PRO A 91 -18.722 -39.245 -14.967 1.00 0.00 C ATOM 1332 O PRO A 91 -18.623 -40.011 -15.905 1.00 0.00 O ATOM 1333 CB PRO A 91 -17.996 -40.223 -12.777 1.00 0.00 C ATOM 1334 CG PRO A 91 -18.752 -39.448 -11.750 1.00 0.00 C ATOM 1335 CD PRO A 91 -18.185 -38.056 -11.771 1.00 0.00 C ATOM 0 HA PRO A 91 -16.707 -39.382 -14.359 1.00 0.00 H new ATOM 0 HB2 PRO A 91 -18.595 -41.042 -13.175 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -17.093 -40.664 -12.355 1.00 0.00 H new ATOM 0 HG2 PRO A 91 -19.818 -39.437 -11.978 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -18.641 -39.898 -10.764 1.00 0.00 H new ATOM 0 HD2 PRO A 91 -18.947 -37.308 -11.551 1.00 0.00 H new ATOM 0 HD3 PRO A 91 -17.394 -37.933 -11.031 1.00 0.00 H new ATOM 1343 N TRP A 92 -19.735 -38.430 -14.862 1.00 0.00 N ATOM 1344 CA TRP A 92 -20.800 -38.427 -15.904 1.00 0.00 C ATOM 1345 C TRP A 92 -20.301 -37.679 -17.142 1.00 0.00 C ATOM 1346 O TRP A 92 -20.670 -37.989 -18.258 1.00 0.00 O ATOM 1347 CB TRP A 92 -22.048 -37.730 -15.357 1.00 0.00 C ATOM 1348 CG TRP A 92 -21.690 -36.349 -14.911 1.00 0.00 C ATOM 1349 CD1 TRP A 92 -21.681 -35.254 -15.707 1.00 0.00 C ATOM 1350 CD2 TRP A 92 -21.291 -35.895 -13.586 1.00 0.00 C ATOM 1351 NE1 TRP A 92 -21.300 -34.158 -14.954 1.00 0.00 N ATOM 1352 CE2 TRP A 92 -21.049 -34.502 -13.640 1.00 0.00 C ATOM 1353 CE3 TRP A 92 -21.116 -36.551 -12.354 1.00 0.00 C ATOM 1354 CZ2 TRP A 92 -20.648 -33.785 -12.512 1.00 0.00 C ATOM 1355 CZ3 TRP A 92 -20.713 -35.832 -11.216 1.00 0.00 C ATOM 1356 CH2 TRP A 92 -20.480 -34.452 -11.295 1.00 0.00 C ATOM 0 H TRP A 92 -19.871 -37.766 -14.100 1.00 0.00 H new ATOM 0 HA TRP A 92 -21.046 -39.454 -16.174 1.00 0.00 H new ATOM 0 HB2 TRP A 92 -22.820 -37.687 -16.125 1.00 0.00 H new ATOM 0 HB3 TRP A 92 -22.459 -38.298 -14.523 1.00 0.00 H new ATOM 0 HD1 TRP A 92 -21.930 -35.239 -16.758 1.00 0.00 H new ATOM 0 HE1 TRP A 92 -21.215 -33.211 -15.324 1.00 0.00 H new ATOM 0 HE3 TRP A 92 -21.293 -37.614 -12.282 1.00 0.00 H new ATOM 0 HZ2 TRP A 92 -20.469 -32.722 -12.579 1.00 0.00 H new ATOM 0 HZ3 TRP A 92 -20.582 -36.346 -10.275 1.00 0.00 H new ATOM 0 HH2 TRP A 92 -20.171 -33.905 -10.417 1.00 0.00 H new ATOM 1367 N LEU A 93 -19.464 -36.696 -16.956 1.00 0.00 N ATOM 1368 CA LEU A 93 -18.943 -35.930 -18.123 1.00 0.00 C ATOM 1369 C LEU A 93 -18.323 -36.897 -19.133 1.00 0.00 C ATOM 1370 O LEU A 93 -18.492 -36.755 -20.327 1.00 0.00 O ATOM 1371 CB LEU A 93 -17.879 -34.938 -17.648 1.00 0.00 C ATOM 1372 CG LEU A 93 -17.487 -34.017 -18.804 1.00 0.00 C ATOM 1373 CD1 LEU A 93 -16.973 -32.688 -18.246 1.00 0.00 C ATOM 1374 CD2 LEU A 93 -16.388 -34.681 -19.635 1.00 0.00 C ATOM 0 H LEU A 93 -19.118 -36.390 -16.046 1.00 0.00 H new ATOM 0 HA LEU A 93 -19.762 -35.387 -18.595 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -18.262 -34.350 -16.814 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -17.003 -35.475 -17.284 1.00 0.00 H new ATOM 0 HG LEU A 93 -18.358 -33.834 -19.434 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -16.693 -32.031 -19.070 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -17.756 -32.215 -17.654 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -16.102 -32.870 -17.616 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -16.108 -34.025 -20.459 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -15.517 -34.865 -19.006 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -16.754 -35.627 -20.033 1.00 0.00 H new ATOM 1386 N MET A 94 -17.605 -37.881 -18.663 1.00 0.00 N ATOM 1387 CA MET A 94 -16.976 -38.856 -19.597 1.00 0.00 C ATOM 1388 C MET A 94 -18.064 -39.553 -20.417 1.00 0.00 C ATOM 1389 O MET A 94 -17.885 -39.844 -21.583 1.00 0.00 O ATOM 1390 CB MET A 94 -16.193 -39.898 -18.797 1.00 0.00 C ATOM 1391 CG MET A 94 -15.029 -39.216 -18.073 1.00 0.00 C ATOM 1392 SD MET A 94 -14.012 -40.469 -17.253 1.00 0.00 S ATOM 1393 CE MET A 94 -13.271 -41.173 -18.746 1.00 0.00 C ATOM 0 H MET A 94 -17.427 -38.051 -17.673 1.00 0.00 H new ATOM 0 HA MET A 94 -16.297 -38.329 -20.268 1.00 0.00 H new ATOM 0 HB2 MET A 94 -16.848 -40.386 -18.075 1.00 0.00 H new ATOM 0 HB3 MET A 94 -15.816 -40.675 -19.462 1.00 0.00 H new ATOM 0 HG2 MET A 94 -14.426 -38.651 -18.783 1.00 0.00 H new ATOM 0 HG3 MET A 94 -15.409 -38.504 -17.340 1.00 0.00 H new ATOM 0 HE1 MET A 94 -12.229 -41.426 -18.551 1.00 0.00 H new ATOM 0 HE2 MET A 94 -13.815 -42.073 -19.033 1.00 0.00 H new ATOM 0 HE3 MET A 94 -13.322 -40.445 -19.556 1.00 0.00 H new ATOM 1403 N LYS A 95 -19.190 -39.823 -19.816 1.00 0.00 N ATOM 1404 CA LYS A 95 -20.288 -40.501 -20.562 1.00 0.00 C ATOM 1405 C LYS A 95 -21.139 -39.451 -21.280 1.00 0.00 C ATOM 1406 O LYS A 95 -21.340 -38.358 -20.788 1.00 0.00 O ATOM 1407 CB LYS A 95 -21.163 -41.285 -19.582 1.00 0.00 C ATOM 1408 CG LYS A 95 -20.330 -42.389 -18.927 1.00 0.00 C ATOM 1409 CD LYS A 95 -21.226 -43.236 -18.021 1.00 0.00 C ATOM 1410 CE LYS A 95 -20.370 -44.253 -17.263 1.00 0.00 C ATOM 1411 NZ LYS A 95 -20.866 -45.629 -17.546 1.00 0.00 N ATOM 0 H LYS A 95 -19.397 -39.604 -18.842 1.00 0.00 H new ATOM 0 HA LYS A 95 -19.861 -41.186 -21.295 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -21.564 -40.616 -18.820 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -22.015 -41.719 -20.105 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -19.872 -43.016 -19.692 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -19.518 -41.951 -18.346 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -21.758 -42.596 -17.317 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -21.980 -43.751 -18.616 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -19.326 -44.162 -17.564 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -20.411 -44.053 -16.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -20.284 -46.320 -17.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -21.856 -45.711 -17.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -20.804 -45.817 -18.567 1.00 0.00 H new ATOM 1425 N LYS A 96 -21.639 -39.772 -22.442 1.00 0.00 N ATOM 1426 CA LYS A 96 -22.474 -38.791 -23.191 1.00 0.00 C ATOM 1427 C LYS A 96 -23.801 -38.585 -22.459 1.00 0.00 C ATOM 1428 O LYS A 96 -24.348 -39.499 -21.875 1.00 0.00 O ATOM 1429 CB LYS A 96 -22.746 -39.322 -24.599 1.00 0.00 C ATOM 1430 CG LYS A 96 -21.427 -39.428 -25.368 1.00 0.00 C ATOM 1431 CD LYS A 96 -21.513 -40.579 -26.372 1.00 0.00 C ATOM 1432 CE LYS A 96 -22.799 -40.448 -27.189 1.00 0.00 C ATOM 1433 NZ LYS A 96 -22.624 -41.128 -28.503 1.00 0.00 N ATOM 0 H LYS A 96 -21.505 -40.671 -22.905 1.00 0.00 H new ATOM 0 HA LYS A 96 -21.944 -37.841 -23.257 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -23.227 -40.299 -24.544 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -23.433 -38.658 -25.123 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -21.221 -38.492 -25.888 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -20.602 -39.596 -24.675 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -20.646 -40.565 -27.033 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -21.498 -41.535 -25.848 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -23.634 -40.891 -26.646 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -23.040 -39.396 -27.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -23.498 -41.039 -29.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -21.838 -40.686 -29.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -22.413 -42.135 -28.348 1.00 0.00 H new ATOM 1447 N PRO A 97 -24.327 -37.352 -22.496 1.00 0.00 N ATOM 1448 CA PRO A 97 -25.595 -37.009 -21.840 1.00 0.00 C ATOM 1449 C PRO A 97 -26.792 -37.649 -22.548 1.00 0.00 C ATOM 1450 O PRO A 97 -26.810 -37.789 -23.755 1.00 0.00 O ATOM 1451 CB PRO A 97 -25.665 -35.487 -21.970 1.00 0.00 C ATOM 1452 CG PRO A 97 -24.826 -35.173 -23.162 1.00 0.00 C ATOM 1453 CD PRO A 97 -23.725 -36.195 -23.182 1.00 0.00 C ATOM 0 HA PRO A 97 -25.632 -37.365 -20.810 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -26.692 -35.148 -22.107 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -25.283 -34.995 -21.076 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -25.417 -35.220 -24.077 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -24.419 -34.164 -23.096 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -23.424 -36.442 -24.200 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -22.835 -35.838 -22.664 1.00 0.00 H new ATOM 1461 N LEU A 98 -27.794 -38.037 -21.808 1.00 0.00 N ATOM 1462 CA LEU A 98 -28.988 -38.666 -22.439 1.00 0.00 C ATOM 1463 C LEU A 98 -30.188 -37.726 -22.309 1.00 0.00 C ATOM 1464 O LEU A 98 -30.974 -37.578 -23.224 1.00 0.00 O ATOM 1465 CB LEU A 98 -29.297 -39.990 -21.738 1.00 0.00 C ATOM 1466 CG LEU A 98 -30.256 -40.811 -22.601 1.00 0.00 C ATOM 1467 CD1 LEU A 98 -30.074 -42.298 -22.292 1.00 0.00 C ATOM 1468 CD2 LEU A 98 -31.698 -40.400 -22.296 1.00 0.00 C ATOM 0 H LEU A 98 -27.837 -37.945 -20.793 1.00 0.00 H new ATOM 0 HA LEU A 98 -28.786 -38.853 -23.494 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -28.376 -40.547 -21.568 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -29.741 -39.802 -20.760 1.00 0.00 H new ATOM 0 HG LEU A 98 -30.042 -40.629 -23.654 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -30.757 -42.884 -22.907 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -29.047 -42.592 -22.510 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -30.288 -42.480 -21.239 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -32.381 -40.985 -22.911 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -31.913 -40.581 -21.243 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -31.829 -39.341 -22.516 1.00 0.00 H new TER 1480 LEU A 98