USER MOD reduce.3.24.130724 H: found=0, std=0, add=1140, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1140 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 48 TYR OH : rot 41:sc= 1.14 USER MOD Set 1.2: B 38 ASN : amide:sc= 0.976 K(o=2.1,f=-0.44) USER MOD Set 2.1: B 16 ASN : amide:sc= -0.325 K(o=0.76,f=-0.84!) USER MOD Set 2.2: B 20 THR OG1 : rot 83:sc= 1.09 USER MOD Set 3.1: A 38 ASN : amide:sc= 0.725 K(o=1.5,f=-0.73) USER MOD Set 3.2: B 48 TYR OH : rot 28:sc= 0.819 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 166:sc= -0.0306 (180deg=-0.269) USER MOD Single : A 16 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 GLN : amide:sc= -1.28 K(o=-1.3,f=-0.017) USER MOD Single : A 20 THR OG1 : rot 73:sc= 0.191 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 MET CE :methyl -120:sc= -0.048 (180deg=-2.38!) USER MOD Single : A 27 HIS : no HD1:sc= 0.48 K(o=0.48,f=-3.9!) USER MOD Single : A 35 THR OG1 : rot 145:sc= 1.15 USER MOD Single : A 41 MET CE :methyl 143:sc= -0.24 (180deg=-1.93) USER MOD Single : A 46 LYS NZ :NH3+ -157:sc= 1.86 (180deg=0.676) USER MOD Single : A 47 THR OG1 : rot 83:sc= 1.31 USER MOD Single : A 51 TYR OH : rot 100:sc= -0.174 USER MOD Single : A 53 GLN : amide:sc= -1.12 K(o=-1.1,f=-0.2) USER MOD Single : A 59 LYS NZ :NH3+ 144:sc= 0.627 (180deg=0.109) USER MOD Single : A 60 SER OG : rot 180:sc= 0.00813 USER MOD Single : A 61 THR OG1 : rot 80:sc= 0.0706 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 66 HIS : no HD1:sc= -0.0167 X(o=-0.017,f=-0.017) USER MOD Single : A 67 HIS : no HD1:sc= 0 X(o=0,f=-0.003) USER MOD Single : A 68 HIS : no HD1:sc= -0.0572 X(o=-0.057,f=0) USER MOD Single : A 69 HIS : no HD1:sc= -0.52 K(o=-0.52,f=0.012) USER MOD Single : A 70 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 71 HIS : no HD1:sc= -0.105 K(o=-0.11,f=-0.76) USER MOD Single : B 1 MET CE :methyl -160:sc= -0.167 (180deg=-0.777) USER MOD Single : B 1 MET N :NH3+ -120:sc= 0.0668 (180deg=-0.182) USER MOD Single : B 2 SER OG : rot 180:sc= 0 USER MOD Single : B 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 11 LYS NZ :NH3+ -166:sc=-0.00702 (180deg=-0.154) USER MOD Single : B 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 24 MET CE :methyl 145:sc= -0.184 (180deg=-0.698) USER MOD Single : B 27 HIS : no HD1:sc= 0.465 K(o=0.47,f=-2.4!) USER MOD Single : B 35 THR OG1 : rot 35:sc= 1.15 USER MOD Single : B 41 MET CE :methyl -131:sc= -0.696 (180deg=-2) USER MOD Single : B 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 47 THR OG1 : rot 71:sc= 0.561 USER MOD Single : B 51 TYR OH : rot 30:sc= -2.08! USER MOD Single : B 53 GLN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : B 59 LYS NZ :NH3+ 141:sc= 0.00885 (180deg=0) USER MOD Single : B 60 SER OG : rot 180:sc= 0 USER MOD Single : B 61 THR OG1 : rot 77:sc= 1.22 USER MOD Single : B 63 SER OG : rot 78:sc= 1.27 USER MOD Single : B 66 HIS : no HD1:sc= -0.395 X(o=-0.39,f=-0.21) USER MOD Single : B 67 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 68 HIS : no HD1:sc= -0.0089 X(o=-0.0089,f=-0.4) USER MOD Single : B 69 HIS : no HE2:sc= 0.0451 X(o=0.045,f=-0.37) USER MOD Single : B 70 HIS : no HE2:sc= -0.0753 K(o=-0.075,f=-0.95) USER MOD Single : B 71 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 29.303 0.912 -18.683 1.00 0.00 N ATOM 2 CA MET A 1 30.674 0.632 -19.159 1.00 0.00 C ATOM 3 C MET A 1 31.088 -0.751 -18.685 1.00 0.00 C ATOM 4 O MET A 1 31.500 -0.920 -17.533 1.00 0.00 O ATOM 5 CB MET A 1 31.642 1.703 -18.634 1.00 0.00 C ATOM 6 CG MET A 1 32.994 1.733 -19.336 1.00 0.00 C ATOM 7 SD MET A 1 34.037 0.311 -18.956 1.00 0.00 S ATOM 8 CE MET A 1 35.517 0.732 -19.875 1.00 0.00 C ATOM 0 H1 MET A 1 29.011 1.857 -19.003 1.00 0.00 H new ATOM 0 H2 MET A 1 28.650 0.199 -19.067 1.00 0.00 H new ATOM 0 H3 MET A 1 29.282 0.876 -17.644 1.00 0.00 H new ATOM 0 HA MET A 1 30.702 0.658 -20.248 1.00 0.00 H new ATOM 0 HB2 MET A 1 31.172 2.681 -18.737 1.00 0.00 H new ATOM 0 HB3 MET A 1 31.804 1.537 -17.569 1.00 0.00 H new ATOM 0 HG2 MET A 1 32.834 1.778 -20.413 1.00 0.00 H new ATOM 0 HG3 MET A 1 33.520 2.645 -19.054 1.00 0.00 H new ATOM 0 HE1 MET A 1 36.263 -0.052 -19.743 1.00 0.00 H new ATOM 0 HE2 MET A 1 35.274 0.826 -20.933 1.00 0.00 H new ATOM 0 HE3 MET A 1 35.916 1.678 -19.509 1.00 0.00 H new ATOM 20 N SER A 2 30.953 -1.737 -19.575 1.00 0.00 N ATOM 21 CA SER A 2 31.159 -3.144 -19.235 1.00 0.00 C ATOM 22 C SER A 2 30.092 -3.608 -18.235 1.00 0.00 C ATOM 23 O SER A 2 29.422 -2.792 -17.595 1.00 0.00 O ATOM 24 CB SER A 2 32.573 -3.370 -18.677 1.00 0.00 C ATOM 25 OG SER A 2 32.868 -4.754 -18.544 1.00 0.00 O ATOM 0 H SER A 2 30.698 -1.581 -20.550 1.00 0.00 H new ATOM 0 HA SER A 2 31.062 -3.739 -20.143 1.00 0.00 H new ATOM 0 HB2 SER A 2 33.304 -2.903 -19.337 1.00 0.00 H new ATOM 0 HB3 SER A 2 32.664 -2.883 -17.706 1.00 0.00 H new ATOM 0 HG SER A 2 33.775 -4.863 -18.188 1.00 0.00 H new ATOM 31 N GLU A 3 29.918 -4.915 -18.113 1.00 0.00 N ATOM 32 CA GLU A 3 28.919 -5.464 -17.212 1.00 0.00 C ATOM 33 C GLU A 3 29.235 -6.917 -16.901 1.00 0.00 C ATOM 34 O GLU A 3 29.280 -7.766 -17.793 1.00 0.00 O ATOM 35 CB GLU A 3 27.527 -5.315 -17.825 1.00 0.00 C ATOM 36 CG GLU A 3 26.382 -5.614 -16.875 1.00 0.00 C ATOM 37 CD GLU A 3 25.077 -5.007 -17.353 1.00 0.00 C ATOM 38 OE1 GLU A 3 24.821 -3.821 -17.040 1.00 0.00 O ATOM 39 OE2 GLU A 3 24.306 -5.700 -18.054 1.00 0.00 O ATOM 0 H GLU A 3 30.455 -5.614 -18.626 1.00 0.00 H new ATOM 0 HA GLU A 3 28.937 -4.911 -16.273 1.00 0.00 H new ATOM 0 HB2 GLU A 3 27.416 -4.297 -18.198 1.00 0.00 H new ATOM 0 HB3 GLU A 3 27.450 -5.980 -18.686 1.00 0.00 H new ATOM 0 HG2 GLU A 3 26.265 -6.693 -16.775 1.00 0.00 H new ATOM 0 HG3 GLU A 3 26.621 -5.227 -15.885 1.00 0.00 H new ATOM 46 N GLY A 4 29.465 -7.185 -15.632 1.00 0.00 N ATOM 47 CA GLY A 4 29.912 -8.494 -15.218 1.00 0.00 C ATOM 48 C GLY A 4 28.993 -9.128 -14.197 1.00 0.00 C ATOM 49 O GLY A 4 28.278 -8.434 -13.472 1.00 0.00 O ATOM 0 H GLY A 4 29.349 -6.514 -14.873 1.00 0.00 H new ATOM 0 HA2 GLY A 4 29.981 -9.143 -16.091 1.00 0.00 H new ATOM 0 HA3 GLY A 4 30.915 -8.415 -14.799 1.00 0.00 H new ATOM 53 N ALA A 5 29.034 -10.451 -14.132 1.00 0.00 N ATOM 54 CA ALA A 5 28.164 -11.220 -13.250 1.00 0.00 C ATOM 55 C ALA A 5 28.423 -10.929 -11.776 1.00 0.00 C ATOM 56 O ALA A 5 27.536 -11.101 -10.949 1.00 0.00 O ATOM 57 CB ALA A 5 28.324 -12.707 -13.523 1.00 0.00 C ATOM 0 H ALA A 5 29.670 -11.022 -14.688 1.00 0.00 H new ATOM 0 HA ALA A 5 27.140 -10.915 -13.464 1.00 0.00 H new ATOM 0 HB1 ALA A 5 27.670 -13.271 -12.859 1.00 0.00 H new ATOM 0 HB2 ALA A 5 28.058 -12.917 -14.559 1.00 0.00 H new ATOM 0 HB3 ALA A 5 29.359 -13.000 -13.347 1.00 0.00 H new ATOM 63 N GLU A 6 29.631 -10.489 -11.442 1.00 0.00 N ATOM 64 CA GLU A 6 29.973 -10.221 -10.049 1.00 0.00 C ATOM 65 C GLU A 6 29.185 -9.040 -9.503 1.00 0.00 C ATOM 66 O GLU A 6 28.476 -9.166 -8.505 1.00 0.00 O ATOM 67 CB GLU A 6 31.470 -9.959 -9.904 1.00 0.00 C ATOM 68 CG GLU A 6 32.325 -11.150 -10.282 1.00 0.00 C ATOM 69 CD GLU A 6 33.763 -10.978 -9.862 1.00 0.00 C ATOM 70 OE1 GLU A 6 34.027 -10.940 -8.641 1.00 0.00 O ATOM 71 OE2 GLU A 6 34.640 -10.870 -10.742 1.00 0.00 O ATOM 0 H GLU A 6 30.383 -10.312 -12.108 1.00 0.00 H new ATOM 0 HA GLU A 6 29.709 -11.106 -9.469 1.00 0.00 H new ATOM 0 HB2 GLU A 6 31.745 -9.110 -10.529 1.00 0.00 H new ATOM 0 HB3 GLU A 6 31.685 -9.679 -8.873 1.00 0.00 H new ATOM 0 HG2 GLU A 6 31.918 -12.048 -9.818 1.00 0.00 H new ATOM 0 HG3 GLU A 6 32.279 -11.300 -11.361 1.00 0.00 H new ATOM 78 N GLU A 7 29.304 -7.903 -10.174 1.00 0.00 N ATOM 79 CA GLU A 7 28.572 -6.697 -9.794 1.00 0.00 C ATOM 80 C GLU A 7 27.077 -6.952 -9.887 1.00 0.00 C ATOM 81 O GLU A 7 26.296 -6.519 -9.041 1.00 0.00 O ATOM 82 CB GLU A 7 28.964 -5.543 -10.719 1.00 0.00 C ATOM 83 CG GLU A 7 28.376 -4.193 -10.327 1.00 0.00 C ATOM 84 CD GLU A 7 28.837 -3.709 -8.964 1.00 0.00 C ATOM 85 OE1 GLU A 7 30.018 -3.327 -8.830 1.00 0.00 O ATOM 86 OE2 GLU A 7 28.012 -3.675 -8.030 1.00 0.00 O ATOM 0 H GLU A 7 29.904 -7.788 -10.990 1.00 0.00 H new ATOM 0 HA GLU A 7 28.823 -6.432 -8.767 1.00 0.00 H new ATOM 0 HB2 GLU A 7 30.051 -5.461 -10.736 1.00 0.00 H new ATOM 0 HB3 GLU A 7 28.646 -5.783 -11.734 1.00 0.00 H new ATOM 0 HG2 GLU A 7 28.650 -3.453 -11.079 1.00 0.00 H new ATOM 0 HG3 GLU A 7 27.288 -4.264 -10.331 1.00 0.00 H new ATOM 93 N LEU A 8 26.701 -7.689 -10.919 1.00 0.00 N ATOM 94 CA LEU A 8 25.325 -8.045 -11.166 1.00 0.00 C ATOM 95 C LEU A 8 24.756 -8.856 -10.001 1.00 0.00 C ATOM 96 O LEU A 8 23.707 -8.527 -9.450 1.00 0.00 O ATOM 97 CB LEU A 8 25.269 -8.856 -12.461 1.00 0.00 C ATOM 98 CG LEU A 8 23.937 -9.511 -12.755 1.00 0.00 C ATOM 99 CD1 LEU A 8 22.903 -8.476 -13.164 1.00 0.00 C ATOM 100 CD2 LEU A 8 24.090 -10.577 -13.827 1.00 0.00 C ATOM 0 H LEU A 8 27.353 -8.057 -11.612 1.00 0.00 H new ATOM 0 HA LEU A 8 24.721 -7.143 -11.261 1.00 0.00 H new ATOM 0 HB2 LEU A 8 25.524 -8.200 -13.293 1.00 0.00 H new ATOM 0 HB3 LEU A 8 26.035 -9.630 -12.419 1.00 0.00 H new ATOM 0 HG LEU A 8 23.586 -9.993 -11.843 1.00 0.00 H new ATOM 0 HD11 LEU A 8 21.954 -8.971 -13.370 1.00 0.00 H new ATOM 0 HD12 LEU A 8 22.769 -7.757 -12.356 1.00 0.00 H new ATOM 0 HD13 LEU A 8 23.243 -7.956 -14.060 1.00 0.00 H new ATOM 0 HD21 LEU A 8 23.121 -11.036 -14.024 1.00 0.00 H new ATOM 0 HD22 LEU A 8 24.469 -10.121 -14.742 1.00 0.00 H new ATOM 0 HD23 LEU A 8 24.790 -11.339 -13.485 1.00 0.00 H new ATOM 112 N LYS A 9 25.475 -9.902 -9.622 1.00 0.00 N ATOM 113 CA LYS A 9 25.036 -10.812 -8.572 1.00 0.00 C ATOM 114 C LYS A 9 25.084 -10.137 -7.206 1.00 0.00 C ATOM 115 O LYS A 9 24.219 -10.367 -6.362 1.00 0.00 O ATOM 116 CB LYS A 9 25.922 -12.057 -8.583 1.00 0.00 C ATOM 117 CG LYS A 9 25.253 -13.308 -8.045 1.00 0.00 C ATOM 118 CD LYS A 9 26.070 -14.543 -8.396 1.00 0.00 C ATOM 119 CE LYS A 9 25.383 -15.823 -7.959 1.00 0.00 C ATOM 120 NZ LYS A 9 26.112 -17.031 -8.438 1.00 0.00 N ATOM 0 H LYS A 9 26.377 -10.144 -10.032 1.00 0.00 H new ATOM 0 HA LYS A 9 24.002 -11.098 -8.763 1.00 0.00 H new ATOM 0 HB2 LYS A 9 26.249 -12.246 -9.605 1.00 0.00 H new ATOM 0 HB3 LYS A 9 26.817 -11.856 -7.994 1.00 0.00 H new ATOM 0 HG2 LYS A 9 25.144 -13.232 -6.963 1.00 0.00 H new ATOM 0 HG3 LYS A 9 24.250 -13.398 -8.461 1.00 0.00 H new ATOM 0 HD2 LYS A 9 26.239 -14.572 -9.472 1.00 0.00 H new ATOM 0 HD3 LYS A 9 27.049 -14.477 -7.921 1.00 0.00 H new ATOM 0 HE2 LYS A 9 25.315 -15.846 -6.871 1.00 0.00 H new ATOM 0 HE3 LYS A 9 24.363 -15.838 -8.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 25.613 -17.886 -8.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 26.155 -17.021 -9.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 27.078 -17.030 -8.052 1.00 0.00 H new ATOM 134 N ALA A 10 26.095 -9.300 -6.996 1.00 0.00 N ATOM 135 CA ALA A 10 26.233 -8.564 -5.743 1.00 0.00 C ATOM 136 C ALA A 10 25.098 -7.560 -5.576 1.00 0.00 C ATOM 137 O ALA A 10 24.552 -7.395 -4.483 1.00 0.00 O ATOM 138 CB ALA A 10 27.581 -7.859 -5.681 1.00 0.00 C ATOM 0 H ALA A 10 26.831 -9.114 -7.677 1.00 0.00 H new ATOM 0 HA ALA A 10 26.179 -9.279 -4.922 1.00 0.00 H new ATOM 0 HB1 ALA A 10 27.665 -7.316 -4.740 1.00 0.00 H new ATOM 0 HB2 ALA A 10 28.381 -8.597 -5.747 1.00 0.00 H new ATOM 0 HB3 ALA A 10 27.664 -7.159 -6.512 1.00 0.00 H new ATOM 144 N LYS A 11 24.737 -6.897 -6.668 1.00 0.00 N ATOM 145 CA LYS A 11 23.642 -5.939 -6.649 1.00 0.00 C ATOM 146 C LYS A 11 22.315 -6.672 -6.500 1.00 0.00 C ATOM 147 O LYS A 11 21.430 -6.235 -5.764 1.00 0.00 O ATOM 148 CB LYS A 11 23.646 -5.094 -7.923 1.00 0.00 C ATOM 149 CG LYS A 11 22.786 -3.848 -7.829 1.00 0.00 C ATOM 150 CD LYS A 11 22.999 -2.939 -9.025 1.00 0.00 C ATOM 151 CE LYS A 11 22.175 -1.666 -8.910 1.00 0.00 C ATOM 152 NZ LYS A 11 22.433 -0.726 -10.034 1.00 0.00 N ATOM 0 H LYS A 11 25.187 -7.006 -7.577 1.00 0.00 H new ATOM 0 HA LYS A 11 23.774 -5.271 -5.797 1.00 0.00 H new ATOM 0 HB2 LYS A 11 24.671 -4.801 -8.151 1.00 0.00 H new ATOM 0 HB3 LYS A 11 23.296 -5.705 -8.755 1.00 0.00 H new ATOM 0 HG2 LYS A 11 21.736 -4.132 -7.768 1.00 0.00 H new ATOM 0 HG3 LYS A 11 23.023 -3.308 -6.912 1.00 0.00 H new ATOM 0 HD2 LYS A 11 24.056 -2.684 -9.106 1.00 0.00 H new ATOM 0 HD3 LYS A 11 22.728 -3.468 -9.939 1.00 0.00 H new ATOM 0 HE2 LYS A 11 21.116 -1.922 -8.888 1.00 0.00 H new ATOM 0 HE3 LYS A 11 22.403 -1.172 -7.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 21.850 0.127 -9.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 23.438 -0.460 -10.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 22.191 -1.187 -10.934 1.00 0.00 H new ATOM 166 N LEU A 12 22.190 -7.793 -7.200 1.00 0.00 N ATOM 167 CA LEU A 12 21.015 -8.650 -7.075 1.00 0.00 C ATOM 168 C LEU A 12 20.853 -9.110 -5.631 1.00 0.00 C ATOM 169 O LEU A 12 19.750 -9.114 -5.097 1.00 0.00 O ATOM 170 CB LEU A 12 21.123 -9.863 -8.004 1.00 0.00 C ATOM 171 CG LEU A 12 19.918 -10.811 -7.982 1.00 0.00 C ATOM 172 CD1 LEU A 12 18.654 -10.092 -8.432 1.00 0.00 C ATOM 173 CD2 LEU A 12 20.184 -12.026 -8.857 1.00 0.00 C ATOM 0 H LEU A 12 22.889 -8.131 -7.862 1.00 0.00 H new ATOM 0 HA LEU A 12 20.138 -8.072 -7.366 1.00 0.00 H new ATOM 0 HB2 LEU A 12 21.267 -9.508 -9.024 1.00 0.00 H new ATOM 0 HB3 LEU A 12 22.015 -10.429 -7.735 1.00 0.00 H new ATOM 0 HG LEU A 12 19.767 -11.149 -6.957 1.00 0.00 H new ATOM 0 HD11 LEU A 12 17.813 -10.785 -8.408 1.00 0.00 H new ATOM 0 HD12 LEU A 12 18.454 -9.255 -7.763 1.00 0.00 H new ATOM 0 HD13 LEU A 12 18.789 -9.720 -9.448 1.00 0.00 H new ATOM 0 HD21 LEU A 12 19.320 -12.689 -8.831 1.00 0.00 H new ATOM 0 HD22 LEU A 12 20.363 -11.704 -9.883 1.00 0.00 H new ATOM 0 HD23 LEU A 12 21.060 -12.557 -8.485 1.00 0.00 H new ATOM 185 N LYS A 13 21.967 -9.492 -5.014 1.00 0.00 N ATOM 186 CA LYS A 13 21.996 -9.845 -3.597 1.00 0.00 C ATOM 187 C LYS A 13 21.394 -8.726 -2.758 1.00 0.00 C ATOM 188 O LYS A 13 20.482 -8.951 -1.961 1.00 0.00 O ATOM 189 CB LYS A 13 23.443 -10.086 -3.159 1.00 0.00 C ATOM 190 CG LYS A 13 23.614 -10.369 -1.673 1.00 0.00 C ATOM 191 CD LYS A 13 23.086 -11.739 -1.284 1.00 0.00 C ATOM 192 CE LYS A 13 23.304 -12.001 0.196 1.00 0.00 C ATOM 193 NZ LYS A 13 22.961 -13.396 0.580 1.00 0.00 N ATOM 0 H LYS A 13 22.872 -9.566 -5.479 1.00 0.00 H new ATOM 0 HA LYS A 13 21.409 -10.752 -3.450 1.00 0.00 H new ATOM 0 HB2 LYS A 13 23.845 -10.926 -3.725 1.00 0.00 H new ATOM 0 HB3 LYS A 13 24.039 -9.211 -3.420 1.00 0.00 H new ATOM 0 HG2 LYS A 13 24.670 -10.301 -1.411 1.00 0.00 H new ATOM 0 HG3 LYS A 13 23.093 -9.604 -1.097 1.00 0.00 H new ATOM 0 HD2 LYS A 13 22.023 -11.803 -1.517 1.00 0.00 H new ATOM 0 HD3 LYS A 13 23.588 -12.507 -1.872 1.00 0.00 H new ATOM 0 HE2 LYS A 13 24.346 -11.803 0.448 1.00 0.00 H new ATOM 0 HE3 LYS A 13 22.698 -11.307 0.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 23.126 -13.526 1.599 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 21.960 -13.579 0.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 23.557 -14.060 0.045 1.00 0.00 H new ATOM 207 N LYS A 14 21.920 -7.522 -2.952 1.00 0.00 N ATOM 208 CA LYS A 14 21.456 -6.343 -2.244 1.00 0.00 C ATOM 209 C LYS A 14 19.954 -6.127 -2.427 1.00 0.00 C ATOM 210 O LYS A 14 19.219 -5.998 -1.447 1.00 0.00 O ATOM 211 CB LYS A 14 22.230 -5.119 -2.735 1.00 0.00 C ATOM 212 CG LYS A 14 21.857 -3.838 -2.018 1.00 0.00 C ATOM 213 CD LYS A 14 22.098 -3.953 -0.523 1.00 0.00 C ATOM 214 CE LYS A 14 23.578 -4.050 -0.183 1.00 0.00 C ATOM 215 NZ LYS A 14 24.327 -2.841 -0.607 1.00 0.00 N ATOM 0 H LYS A 14 22.681 -7.340 -3.606 1.00 0.00 H new ATOM 0 HA LYS A 14 21.636 -6.491 -1.179 1.00 0.00 H new ATOM 0 HB2 LYS A 14 23.297 -5.299 -2.607 1.00 0.00 H new ATOM 0 HB3 LYS A 14 22.053 -4.992 -3.803 1.00 0.00 H new ATOM 0 HG2 LYS A 14 22.441 -3.010 -2.420 1.00 0.00 H new ATOM 0 HG3 LYS A 14 20.808 -3.607 -2.203 1.00 0.00 H new ATOM 0 HD2 LYS A 14 21.668 -3.087 -0.020 1.00 0.00 H new ATOM 0 HD3 LYS A 14 21.581 -4.833 -0.140 1.00 0.00 H new ATOM 0 HE2 LYS A 14 23.695 -4.190 0.892 1.00 0.00 H new ATOM 0 HE3 LYS A 14 24.004 -4.929 -0.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 25.264 -2.837 -0.156 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 24.440 -2.848 -1.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 23.802 -1.990 -0.322 1.00 0.00 H new ATOM 229 N LEU A 15 19.504 -6.096 -3.678 1.00 0.00 N ATOM 230 CA LEU A 15 18.088 -5.879 -3.979 1.00 0.00 C ATOM 231 C LEU A 15 17.226 -7.002 -3.414 1.00 0.00 C ATOM 232 O LEU A 15 16.123 -6.763 -2.922 1.00 0.00 O ATOM 233 CB LEU A 15 17.862 -5.760 -5.493 1.00 0.00 C ATOM 234 CG LEU A 15 17.968 -4.344 -6.077 1.00 0.00 C ATOM 235 CD1 LEU A 15 16.976 -3.411 -5.398 1.00 0.00 C ATOM 236 CD2 LEU A 15 19.384 -3.800 -5.952 1.00 0.00 C ATOM 0 H LEU A 15 20.096 -6.218 -4.500 1.00 0.00 H new ATOM 0 HA LEU A 15 17.793 -4.943 -3.504 1.00 0.00 H new ATOM 0 HB2 LEU A 15 18.587 -6.397 -6.000 1.00 0.00 H new ATOM 0 HB3 LEU A 15 16.873 -6.155 -5.725 1.00 0.00 H new ATOM 0 HG LEU A 15 17.724 -4.400 -7.138 1.00 0.00 H new ATOM 0 HD11 LEU A 15 17.065 -2.412 -5.825 1.00 0.00 H new ATOM 0 HD12 LEU A 15 15.963 -3.782 -5.553 1.00 0.00 H new ATOM 0 HD13 LEU A 15 17.188 -3.370 -4.330 1.00 0.00 H new ATOM 0 HD21 LEU A 15 19.427 -2.796 -6.374 1.00 0.00 H new ATOM 0 HD22 LEU A 15 19.668 -3.764 -4.900 1.00 0.00 H new ATOM 0 HD23 LEU A 15 20.073 -4.450 -6.492 1.00 0.00 H new ATOM 248 N ASN A 16 17.740 -8.222 -3.481 1.00 0.00 N ATOM 249 CA ASN A 16 17.017 -9.395 -3.001 1.00 0.00 C ATOM 250 C ASN A 16 16.788 -9.311 -1.494 1.00 0.00 C ATOM 251 O ASN A 16 15.675 -9.530 -1.013 1.00 0.00 O ATOM 252 CB ASN A 16 17.794 -10.668 -3.351 1.00 0.00 C ATOM 253 CG ASN A 16 17.037 -11.935 -3.021 1.00 0.00 C ATOM 254 OD1 ASN A 16 17.157 -12.476 -1.926 1.00 0.00 O ATOM 255 ND2 ASN A 16 16.255 -12.423 -3.974 1.00 0.00 N ATOM 0 H ASN A 16 18.662 -8.428 -3.866 1.00 0.00 H new ATOM 0 HA ASN A 16 16.044 -9.427 -3.491 1.00 0.00 H new ATOM 0 HB2 ASN A 16 18.032 -10.661 -4.415 1.00 0.00 H new ATOM 0 HB3 ASN A 16 18.742 -10.668 -2.813 1.00 0.00 H new ATOM 0 HD21 ASN A 16 15.725 -13.279 -3.810 1.00 0.00 H new ATOM 0 HD22 ASN A 16 16.183 -11.942 -4.871 1.00 0.00 H new ATOM 262 N ALA A 17 17.840 -8.981 -0.755 1.00 0.00 N ATOM 263 CA ALA A 17 17.741 -8.833 0.692 1.00 0.00 C ATOM 264 C ALA A 17 16.896 -7.616 1.058 1.00 0.00 C ATOM 265 O ALA A 17 16.130 -7.647 2.022 1.00 0.00 O ATOM 266 CB ALA A 17 19.127 -8.725 1.308 1.00 0.00 C ATOM 0 H ALA A 17 18.772 -8.811 -1.134 1.00 0.00 H new ATOM 0 HA ALA A 17 17.249 -9.719 1.094 1.00 0.00 H new ATOM 0 HB1 ALA A 17 19.037 -8.615 2.389 1.00 0.00 H new ATOM 0 HB2 ALA A 17 19.697 -9.626 1.081 1.00 0.00 H new ATOM 0 HB3 ALA A 17 19.641 -7.857 0.896 1.00 0.00 H new ATOM 272 N GLN A 18 17.043 -6.552 0.276 1.00 0.00 N ATOM 273 CA GLN A 18 16.283 -5.326 0.490 1.00 0.00 C ATOM 274 C GLN A 18 14.790 -5.592 0.330 1.00 0.00 C ATOM 275 O GLN A 18 13.987 -5.190 1.169 1.00 0.00 O ATOM 276 CB GLN A 18 16.734 -4.245 -0.495 1.00 0.00 C ATOM 277 CG GLN A 18 16.046 -2.905 -0.295 1.00 0.00 C ATOM 278 CD GLN A 18 16.547 -1.841 -1.255 1.00 0.00 C ATOM 279 OE1 GLN A 18 15.815 -0.923 -1.625 1.00 0.00 O ATOM 280 NE2 GLN A 18 17.802 -1.952 -1.666 1.00 0.00 N ATOM 0 H GLN A 18 17.685 -6.514 -0.516 1.00 0.00 H new ATOM 0 HA GLN A 18 16.468 -4.976 1.505 1.00 0.00 H new ATOM 0 HB2 GLN A 18 17.811 -4.107 -0.400 1.00 0.00 H new ATOM 0 HB3 GLN A 18 16.545 -4.591 -1.511 1.00 0.00 H new ATOM 0 HG2 GLN A 18 14.971 -3.030 -0.426 1.00 0.00 H new ATOM 0 HG3 GLN A 18 16.205 -2.569 0.729 1.00 0.00 H new ATOM 0 HE21 GLN A 18 18.379 -2.726 -1.338 1.00 0.00 H new ATOM 0 HE22 GLN A 18 18.191 -1.263 -2.310 1.00 0.00 H new ATOM 289 N ALA A 19 14.429 -6.287 -0.742 1.00 0.00 N ATOM 290 CA ALA A 19 13.036 -6.617 -1.012 1.00 0.00 C ATOM 291 C ALA A 19 12.413 -7.375 0.155 1.00 0.00 C ATOM 292 O ALA A 19 11.280 -7.103 0.547 1.00 0.00 O ATOM 293 CB ALA A 19 12.925 -7.432 -2.288 1.00 0.00 C ATOM 0 H ALA A 19 15.086 -6.634 -1.441 1.00 0.00 H new ATOM 0 HA ALA A 19 12.488 -5.684 -1.139 1.00 0.00 H new ATOM 0 HB1 ALA A 19 11.879 -7.671 -2.477 1.00 0.00 H new ATOM 0 HB2 ALA A 19 13.322 -6.856 -3.124 1.00 0.00 H new ATOM 0 HB3 ALA A 19 13.495 -8.355 -2.181 1.00 0.00 H new ATOM 299 N THR A 20 13.163 -8.316 0.714 1.00 0.00 N ATOM 300 CA THR A 20 12.700 -9.079 1.864 1.00 0.00 C ATOM 301 C THR A 20 12.496 -8.169 3.078 1.00 0.00 C ATOM 302 O THR A 20 11.529 -8.324 3.831 1.00 0.00 O ATOM 303 CB THR A 20 13.696 -10.200 2.213 1.00 0.00 C ATOM 304 OG1 THR A 20 13.884 -11.046 1.072 1.00 0.00 O ATOM 305 CG2 THR A 20 13.201 -11.035 3.389 1.00 0.00 C ATOM 0 H THR A 20 14.096 -8.569 0.388 1.00 0.00 H new ATOM 0 HA THR A 20 11.743 -9.528 1.600 1.00 0.00 H new ATOM 0 HB THR A 20 14.642 -9.739 2.496 1.00 0.00 H new ATOM 0 HG1 THR A 20 14.428 -10.578 0.404 1.00 0.00 H new ATOM 0 HG21 THR A 20 13.927 -11.818 3.610 1.00 0.00 H new ATOM 0 HG22 THR A 20 13.079 -10.396 4.263 1.00 0.00 H new ATOM 0 HG23 THR A 20 12.243 -11.489 3.135 1.00 0.00 H new ATOM 313 N ALA A 21 13.396 -7.206 3.249 1.00 0.00 N ATOM 314 CA ALA A 21 13.312 -6.262 4.357 1.00 0.00 C ATOM 315 C ALA A 21 12.039 -5.421 4.266 1.00 0.00 C ATOM 316 O ALA A 21 11.427 -5.092 5.283 1.00 0.00 O ATOM 317 CB ALA A 21 14.541 -5.367 4.384 1.00 0.00 C ATOM 0 H ALA A 21 14.195 -7.059 2.632 1.00 0.00 H new ATOM 0 HA ALA A 21 13.274 -6.831 5.286 1.00 0.00 H new ATOM 0 HB1 ALA A 21 14.464 -4.668 5.217 1.00 0.00 H new ATOM 0 HB2 ALA A 21 15.434 -5.979 4.506 1.00 0.00 H new ATOM 0 HB3 ALA A 21 14.607 -4.811 3.449 1.00 0.00 H new ATOM 323 N LEU A 22 11.644 -5.081 3.049 1.00 0.00 N ATOM 324 CA LEU A 22 10.414 -4.331 2.836 1.00 0.00 C ATOM 325 C LEU A 22 9.196 -5.249 2.846 1.00 0.00 C ATOM 326 O LEU A 22 8.102 -4.830 3.215 1.00 0.00 O ATOM 327 CB LEU A 22 10.468 -3.539 1.524 1.00 0.00 C ATOM 328 CG LEU A 22 11.233 -2.212 1.582 1.00 0.00 C ATOM 329 CD1 LEU A 22 10.731 -1.360 2.735 1.00 0.00 C ATOM 330 CD2 LEU A 22 12.731 -2.438 1.700 1.00 0.00 C ATOM 0 H LEU A 22 12.154 -5.311 2.196 1.00 0.00 H new ATOM 0 HA LEU A 22 10.319 -3.626 3.662 1.00 0.00 H new ATOM 0 HB2 LEU A 22 10.925 -4.168 0.760 1.00 0.00 H new ATOM 0 HB3 LEU A 22 9.447 -3.335 1.201 1.00 0.00 H new ATOM 0 HG LEU A 22 11.050 -1.681 0.648 1.00 0.00 H new ATOM 0 HD11 LEU A 22 11.285 -0.421 2.762 1.00 0.00 H new ATOM 0 HD12 LEU A 22 9.670 -1.152 2.598 1.00 0.00 H new ATOM 0 HD13 LEU A 22 10.878 -1.895 3.673 1.00 0.00 H new ATOM 0 HD21 LEU A 22 13.242 -1.476 1.739 1.00 0.00 H new ATOM 0 HD22 LEU A 22 12.944 -2.999 2.610 1.00 0.00 H new ATOM 0 HD23 LEU A 22 13.083 -3.002 0.836 1.00 0.00 H new ATOM 342 N LYS A 23 9.389 -6.502 2.448 1.00 0.00 N ATOM 343 CA LYS A 23 8.300 -7.472 2.428 1.00 0.00 C ATOM 344 C LYS A 23 7.782 -7.704 3.843 1.00 0.00 C ATOM 345 O LYS A 23 6.574 -7.739 4.074 1.00 0.00 O ATOM 346 CB LYS A 23 8.765 -8.790 1.796 1.00 0.00 C ATOM 347 CG LYS A 23 7.658 -9.553 1.073 1.00 0.00 C ATOM 348 CD LYS A 23 6.765 -10.338 2.021 1.00 0.00 C ATOM 349 CE LYS A 23 7.362 -11.695 2.354 1.00 0.00 C ATOM 350 NZ LYS A 23 6.456 -12.508 3.206 1.00 0.00 N ATOM 0 H LYS A 23 10.288 -6.869 2.135 1.00 0.00 H new ATOM 0 HA LYS A 23 7.486 -7.075 1.821 1.00 0.00 H new ATOM 0 HB2 LYS A 23 9.569 -8.580 1.090 1.00 0.00 H new ATOM 0 HB3 LYS A 23 9.183 -9.427 2.575 1.00 0.00 H new ATOM 0 HG2 LYS A 23 7.048 -8.849 0.507 1.00 0.00 H new ATOM 0 HG3 LYS A 23 8.106 -10.238 0.353 1.00 0.00 H new ATOM 0 HD2 LYS A 23 6.618 -9.769 2.939 1.00 0.00 H new ATOM 0 HD3 LYS A 23 5.782 -10.473 1.569 1.00 0.00 H new ATOM 0 HE2 LYS A 23 7.573 -12.235 1.431 1.00 0.00 H new ATOM 0 HE3 LYS A 23 8.314 -11.556 2.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 6.901 -13.425 3.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 6.275 -12.005 4.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 5.557 -12.663 2.707 1.00 0.00 H new ATOM 364 N MET A 24 8.702 -7.842 4.792 1.00 0.00 N ATOM 365 CA MET A 24 8.325 -8.021 6.189 1.00 0.00 C ATOM 366 C MET A 24 7.852 -6.702 6.795 1.00 0.00 C ATOM 367 O MET A 24 7.054 -6.694 7.733 1.00 0.00 O ATOM 368 CB MET A 24 9.488 -8.603 7.006 1.00 0.00 C ATOM 369 CG MET A 24 10.701 -7.692 7.118 1.00 0.00 C ATOM 370 SD MET A 24 12.028 -8.428 8.096 1.00 0.00 S ATOM 371 CE MET A 24 13.232 -7.102 8.079 1.00 0.00 C ATOM 0 H MET A 24 9.708 -7.833 4.621 1.00 0.00 H new ATOM 0 HA MET A 24 7.499 -8.732 6.223 1.00 0.00 H new ATOM 0 HB2 MET A 24 9.130 -8.835 8.009 1.00 0.00 H new ATOM 0 HB3 MET A 24 9.798 -9.545 6.553 1.00 0.00 H new ATOM 0 HG2 MET A 24 11.073 -7.463 6.119 1.00 0.00 H new ATOM 0 HG3 MET A 24 10.401 -6.747 7.571 1.00 0.00 H new ATOM 0 HE1 MET A 24 14.155 -7.454 7.619 1.00 0.00 H new ATOM 0 HE2 MET A 24 12.839 -6.261 7.507 1.00 0.00 H new ATOM 0 HE3 MET A 24 13.436 -6.782 9.101 1.00 0.00 H new ATOM 381 N ASP A 25 8.334 -5.591 6.242 1.00 0.00 N ATOM 382 CA ASP A 25 7.938 -4.261 6.707 1.00 0.00 C ATOM 383 C ASP A 25 6.478 -4.001 6.351 1.00 0.00 C ATOM 384 O ASP A 25 5.678 -3.608 7.201 1.00 0.00 O ATOM 385 CB ASP A 25 8.843 -3.188 6.081 1.00 0.00 C ATOM 386 CG ASP A 25 8.613 -1.794 6.645 1.00 0.00 C ATOM 387 OD1 ASP A 25 8.789 -1.604 7.868 1.00 0.00 O ATOM 388 OD2 ASP A 25 8.301 -0.870 5.862 1.00 0.00 O ATOM 0 H ASP A 25 9.001 -5.584 5.470 1.00 0.00 H new ATOM 0 HA ASP A 25 8.049 -4.216 7.790 1.00 0.00 H new ATOM 0 HB2 ASP A 25 9.885 -3.467 6.237 1.00 0.00 H new ATOM 0 HB3 ASP A 25 8.677 -3.167 5.004 1.00 0.00 H new ATOM 393 N LEU A 26 6.137 -4.254 5.090 1.00 0.00 N ATOM 394 CA LEU A 26 4.764 -4.130 4.624 1.00 0.00 C ATOM 395 C LEU A 26 3.871 -5.137 5.330 1.00 0.00 C ATOM 396 O LEU A 26 2.766 -4.811 5.750 1.00 0.00 O ATOM 397 CB LEU A 26 4.691 -4.343 3.108 1.00 0.00 C ATOM 398 CG LEU A 26 3.284 -4.274 2.503 1.00 0.00 C ATOM 399 CD1 LEU A 26 2.663 -2.905 2.721 1.00 0.00 C ATOM 400 CD2 LEU A 26 3.326 -4.605 1.020 1.00 0.00 C ATOM 0 H LEU A 26 6.799 -4.547 4.371 1.00 0.00 H new ATOM 0 HA LEU A 26 4.414 -3.124 4.856 1.00 0.00 H new ATOM 0 HB2 LEU A 26 5.315 -3.593 2.622 1.00 0.00 H new ATOM 0 HB3 LEU A 26 5.122 -5.316 2.873 1.00 0.00 H new ATOM 0 HG LEU A 26 2.663 -5.013 3.009 1.00 0.00 H new ATOM 0 HD11 LEU A 26 1.666 -2.884 2.282 1.00 0.00 H new ATOM 0 HD12 LEU A 26 2.593 -2.703 3.790 1.00 0.00 H new ATOM 0 HD13 LEU A 26 3.284 -2.144 2.248 1.00 0.00 H new ATOM 0 HD21 LEU A 26 2.319 -4.551 0.607 1.00 0.00 H new ATOM 0 HD22 LEU A 26 3.968 -3.890 0.506 1.00 0.00 H new ATOM 0 HD23 LEU A 26 3.721 -5.611 0.883 1.00 0.00 H new ATOM 412 N HIS A 27 4.366 -6.361 5.469 1.00 0.00 N ATOM 413 CA HIS A 27 3.607 -7.428 6.111 1.00 0.00 C ATOM 414 C HIS A 27 3.246 -7.055 7.546 1.00 0.00 C ATOM 415 O HIS A 27 2.138 -7.329 8.004 1.00 0.00 O ATOM 416 CB HIS A 27 4.404 -8.738 6.088 1.00 0.00 C ATOM 417 CG HIS A 27 3.666 -9.897 6.683 1.00 0.00 C ATOM 418 ND1 HIS A 27 4.018 -10.482 7.878 1.00 0.00 N ATOM 419 CD2 HIS A 27 2.585 -10.574 6.236 1.00 0.00 C ATOM 420 CE1 HIS A 27 3.184 -11.471 8.141 1.00 0.00 C ATOM 421 NE2 HIS A 27 2.306 -11.545 7.160 1.00 0.00 N ATOM 0 H HIS A 27 5.292 -6.640 5.145 1.00 0.00 H new ATOM 0 HA HIS A 27 2.682 -7.568 5.552 1.00 0.00 H new ATOM 0 HB2 HIS A 27 4.667 -8.976 5.057 1.00 0.00 H new ATOM 0 HB3 HIS A 27 5.338 -8.595 6.631 1.00 0.00 H new ATOM 0 HD2 HIS A 27 2.043 -10.385 5.321 1.00 0.00 H new ATOM 0 HE1 HIS A 27 3.215 -12.110 9.011 1.00 0.00 H new ATOM 0 HE2 HIS A 27 1.542 -12.218 7.099 1.00 0.00 H new ATOM 430 N ASP A 28 4.181 -6.415 8.237 1.00 0.00 N ATOM 431 CA ASP A 28 3.982 -6.049 9.632 1.00 0.00 C ATOM 432 C ASP A 28 2.957 -4.930 9.755 1.00 0.00 C ATOM 433 O ASP A 28 2.065 -4.989 10.599 1.00 0.00 O ATOM 434 CB ASP A 28 5.306 -5.621 10.269 1.00 0.00 C ATOM 435 CG ASP A 28 5.199 -5.472 11.771 1.00 0.00 C ATOM 436 OD1 ASP A 28 5.169 -6.509 12.470 1.00 0.00 O ATOM 437 OD2 ASP A 28 5.170 -4.325 12.265 1.00 0.00 O ATOM 0 H ASP A 28 5.085 -6.139 7.853 1.00 0.00 H new ATOM 0 HA ASP A 28 3.605 -6.924 10.161 1.00 0.00 H new ATOM 0 HB2 ASP A 28 6.075 -6.357 10.033 1.00 0.00 H new ATOM 0 HB3 ASP A 28 5.627 -4.674 9.834 1.00 0.00 H new ATOM 442 N LEU A 29 3.076 -3.927 8.889 1.00 0.00 N ATOM 443 CA LEU A 29 2.167 -2.784 8.903 1.00 0.00 C ATOM 444 C LEU A 29 0.781 -3.180 8.397 1.00 0.00 C ATOM 445 O LEU A 29 -0.225 -2.635 8.838 1.00 0.00 O ATOM 446 CB LEU A 29 2.726 -1.641 8.049 1.00 0.00 C ATOM 447 CG LEU A 29 1.881 -0.363 8.033 1.00 0.00 C ATOM 448 CD1 LEU A 29 1.829 0.267 9.418 1.00 0.00 C ATOM 449 CD2 LEU A 29 2.433 0.622 7.022 1.00 0.00 C ATOM 0 H LEU A 29 3.795 -3.883 8.167 1.00 0.00 H new ATOM 0 HA LEU A 29 2.075 -2.444 9.935 1.00 0.00 H new ATOM 0 HB2 LEU A 29 3.724 -1.393 8.411 1.00 0.00 H new ATOM 0 HB3 LEU A 29 2.838 -1.996 7.024 1.00 0.00 H new ATOM 0 HG LEU A 29 0.865 -0.628 7.741 1.00 0.00 H new ATOM 0 HD11 LEU A 29 1.224 1.173 9.383 1.00 0.00 H new ATOM 0 HD12 LEU A 29 1.387 -0.438 10.122 1.00 0.00 H new ATOM 0 HD13 LEU A 29 2.839 0.518 9.742 1.00 0.00 H new ATOM 0 HD21 LEU A 29 1.822 1.525 7.022 1.00 0.00 H new ATOM 0 HD22 LEU A 29 3.459 0.878 7.286 1.00 0.00 H new ATOM 0 HD23 LEU A 29 2.416 0.173 6.029 1.00 0.00 H new ATOM 461 N ALA A 30 0.736 -4.132 7.469 1.00 0.00 N ATOM 462 CA ALA A 30 -0.531 -4.615 6.932 1.00 0.00 C ATOM 463 C ALA A 30 -1.309 -5.385 7.990 1.00 0.00 C ATOM 464 O ALA A 30 -2.536 -5.453 7.951 1.00 0.00 O ATOM 465 CB ALA A 30 -0.296 -5.487 5.706 1.00 0.00 C ATOM 0 H ALA A 30 1.561 -4.583 7.074 1.00 0.00 H new ATOM 0 HA ALA A 30 -1.124 -3.750 6.633 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -1.253 -5.838 5.320 1.00 0.00 H new ATOM 0 HB2 ALA A 30 0.214 -4.905 4.938 1.00 0.00 H new ATOM 0 HB3 ALA A 30 0.320 -6.343 5.981 1.00 0.00 H new ATOM 471 N GLU A 31 -0.587 -5.985 8.926 1.00 0.00 N ATOM 472 CA GLU A 31 -1.217 -6.683 10.029 1.00 0.00 C ATOM 473 C GLU A 31 -1.522 -5.693 11.152 1.00 0.00 C ATOM 474 O GLU A 31 -2.614 -5.691 11.725 1.00 0.00 O ATOM 475 CB GLU A 31 -0.309 -7.807 10.527 1.00 0.00 C ATOM 476 CG GLU A 31 -1.048 -9.099 10.843 1.00 0.00 C ATOM 477 CD GLU A 31 -2.067 -8.941 11.948 1.00 0.00 C ATOM 478 OE1 GLU A 31 -1.671 -8.984 13.133 1.00 0.00 O ATOM 479 OE2 GLU A 31 -3.267 -8.783 11.645 1.00 0.00 O ATOM 0 H GLU A 31 0.433 -6.001 8.941 1.00 0.00 H new ATOM 0 HA GLU A 31 -2.153 -7.128 9.691 1.00 0.00 H new ATOM 0 HB2 GLU A 31 0.451 -8.009 9.772 1.00 0.00 H new ATOM 0 HB3 GLU A 31 0.213 -7.470 11.422 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -1.549 -9.454 9.942 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -0.326 -9.864 11.129 1.00 0.00 H new ATOM 486 N ASP A 32 -0.552 -4.831 11.444 1.00 0.00 N ATOM 487 CA ASP A 32 -0.714 -3.808 12.470 1.00 0.00 C ATOM 488 C ASP A 32 -1.309 -2.547 11.848 1.00 0.00 C ATOM 489 O ASP A 32 -0.653 -1.511 11.725 1.00 0.00 O ATOM 490 CB ASP A 32 0.629 -3.496 13.143 1.00 0.00 C ATOM 491 CG ASP A 32 0.474 -2.768 14.467 1.00 0.00 C ATOM 492 OD1 ASP A 32 0.186 -3.436 15.488 1.00 0.00 O ATOM 493 OD2 ASP A 32 0.668 -1.534 14.505 1.00 0.00 O ATOM 0 H ASP A 32 0.357 -4.822 10.982 1.00 0.00 H new ATOM 0 HA ASP A 32 -1.394 -4.181 13.236 1.00 0.00 H new ATOM 0 HB2 ASP A 32 1.172 -4.427 13.308 1.00 0.00 H new ATOM 0 HB3 ASP A 32 1.234 -2.889 12.470 1.00 0.00 H new ATOM 498 N LEU A 33 -2.551 -2.674 11.411 1.00 0.00 N ATOM 499 CA LEU A 33 -3.276 -1.581 10.784 1.00 0.00 C ATOM 500 C LEU A 33 -3.983 -0.727 11.826 1.00 0.00 C ATOM 501 O LEU A 33 -4.093 -1.139 12.980 1.00 0.00 O ATOM 502 CB LEU A 33 -4.198 -2.100 9.680 1.00 0.00 C ATOM 503 CG LEU A 33 -3.508 -2.239 8.319 1.00 0.00 C ATOM 504 CD1 LEU A 33 -4.484 -2.725 7.260 1.00 0.00 C ATOM 505 CD2 LEU A 33 -2.894 -0.907 7.905 1.00 0.00 C ATOM 0 H LEU A 33 -3.086 -3.540 11.481 1.00 0.00 H new ATOM 0 HA LEU A 33 -2.565 -0.918 10.291 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -4.596 -3.070 9.977 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -5.047 -1.424 9.580 1.00 0.00 H new ATOM 0 HG LEU A 33 -2.715 -2.981 8.411 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -3.968 -2.815 6.304 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -4.882 -3.697 7.551 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -5.303 -2.012 7.165 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -2.406 -1.017 6.936 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -3.677 -0.152 7.834 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -2.159 -0.598 8.649 1.00 0.00 H new ATOM 517 N PRO A 34 -4.544 0.429 11.401 1.00 0.00 N ATOM 518 CA PRO A 34 -4.452 1.689 12.090 1.00 0.00 C ATOM 519 C PRO A 34 -3.702 1.654 13.412 1.00 0.00 C ATOM 520 O PRO A 34 -4.118 1.047 14.396 1.00 0.00 O ATOM 521 CB PRO A 34 -5.928 2.024 12.239 1.00 0.00 C ATOM 522 CG PRO A 34 -6.534 1.523 10.951 1.00 0.00 C ATOM 523 CD PRO A 34 -5.506 0.600 10.312 1.00 0.00 C ATOM 0 HA PRO A 34 -3.860 2.431 11.555 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -6.366 1.531 13.107 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -6.086 3.095 12.367 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -7.465 0.990 11.143 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -6.773 2.354 10.287 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -5.945 -0.348 10.001 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -5.049 1.045 9.428 1.00 0.00 H new ATOM 531 N THR A 35 -2.659 2.472 13.398 1.00 0.00 N ATOM 532 CA THR A 35 -1.676 2.642 14.466 1.00 0.00 C ATOM 533 C THR A 35 -0.525 3.441 13.871 1.00 0.00 C ATOM 534 O THR A 35 -0.072 4.442 14.427 1.00 0.00 O ATOM 535 CB THR A 35 -1.110 1.305 15.000 1.00 0.00 C ATOM 536 OG1 THR A 35 -1.140 0.314 13.969 1.00 0.00 O ATOM 537 CG2 THR A 35 -1.864 0.816 16.227 1.00 0.00 C ATOM 0 H THR A 35 -2.462 3.071 12.596 1.00 0.00 H new ATOM 0 HA THR A 35 -2.163 3.136 15.307 1.00 0.00 H new ATOM 0 HB THR A 35 -0.078 1.481 15.303 1.00 0.00 H new ATOM 0 HG1 THR A 35 -0.363 -0.276 14.060 1.00 0.00 H new ATOM 0 HG21 THR A 35 -1.433 -0.125 16.568 1.00 0.00 H new ATOM 0 HG22 THR A 35 -1.787 1.559 17.021 1.00 0.00 H new ATOM 0 HG23 THR A 35 -2.913 0.664 15.973 1.00 0.00 H new ATOM 545 N GLY A 36 -0.083 2.973 12.707 1.00 0.00 N ATOM 546 CA GLY A 36 0.911 3.674 11.920 1.00 0.00 C ATOM 547 C GLY A 36 0.509 3.741 10.458 1.00 0.00 C ATOM 548 O GLY A 36 1.359 3.751 9.566 1.00 0.00 O ATOM 0 H GLY A 36 -0.406 2.100 12.289 1.00 0.00 H new ATOM 0 HA2 GLY A 36 1.041 4.683 12.310 1.00 0.00 H new ATOM 0 HA3 GLY A 36 1.873 3.170 12.012 1.00 0.00 H new ATOM 552 N TRP A 37 -0.802 3.799 10.220 1.00 0.00 N ATOM 553 CA TRP A 37 -1.369 3.793 8.871 1.00 0.00 C ATOM 554 C TRP A 37 -0.957 5.020 8.063 1.00 0.00 C ATOM 555 O TRP A 37 -1.116 5.049 6.844 1.00 0.00 O ATOM 556 CB TRP A 37 -2.901 3.698 8.937 1.00 0.00 C ATOM 557 CG TRP A 37 -3.548 4.760 9.777 1.00 0.00 C ATOM 558 CD1 TRP A 37 -3.756 4.720 11.124 1.00 0.00 C ATOM 559 CD2 TRP A 37 -4.083 6.012 9.328 1.00 0.00 C ATOM 560 NE1 TRP A 37 -4.389 5.860 11.540 1.00 0.00 N ATOM 561 CE2 TRP A 37 -4.593 6.677 10.460 1.00 0.00 C ATOM 562 CE3 TRP A 37 -4.170 6.638 8.083 1.00 0.00 C ATOM 563 CZ2 TRP A 37 -5.192 7.929 10.379 1.00 0.00 C ATOM 564 CZ3 TRP A 37 -4.761 7.884 8.003 1.00 0.00 C ATOM 565 CH2 TRP A 37 -5.261 8.521 9.146 1.00 0.00 C ATOM 0 H TRP A 37 -1.502 3.852 10.960 1.00 0.00 H new ATOM 0 HA TRP A 37 -0.970 2.917 8.360 1.00 0.00 H new ATOM 0 HB2 TRP A 37 -3.301 3.757 7.925 1.00 0.00 H new ATOM 0 HB3 TRP A 37 -3.176 2.720 9.332 1.00 0.00 H new ATOM 0 HD1 TRP A 37 -3.463 3.906 11.770 1.00 0.00 H new ATOM 0 HE1 TRP A 37 -4.664 6.068 12.500 1.00 0.00 H new ATOM 0 HE3 TRP A 37 -3.782 6.156 7.198 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 -5.589 8.417 11.257 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 -4.839 8.375 7.044 1.00 0.00 H new ATOM 0 HH2 TRP A 37 -5.710 9.499 9.053 1.00 0.00 H new ATOM 576 N ASN A 38 -0.416 6.024 8.735 1.00 0.00 N ATOM 577 CA ASN A 38 0.054 7.220 8.052 1.00 0.00 C ATOM 578 C ASN A 38 1.275 6.884 7.199 1.00 0.00 C ATOM 579 O ASN A 38 1.602 7.587 6.243 1.00 0.00 O ATOM 580 CB ASN A 38 0.409 8.310 9.066 1.00 0.00 C ATOM 581 CG ASN A 38 0.742 9.636 8.408 1.00 0.00 C ATOM 582 OD1 ASN A 38 0.179 9.990 7.370 1.00 0.00 O ATOM 583 ND2 ASN A 38 1.670 10.371 9.001 1.00 0.00 N ATOM 0 H ASN A 38 -0.292 6.036 9.747 1.00 0.00 H new ATOM 0 HA ASN A 38 -0.743 7.591 7.407 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -0.427 8.449 9.751 1.00 0.00 H new ATOM 0 HB3 ASN A 38 1.260 7.982 9.663 1.00 0.00 H new ATOM 0 HD21 ASN A 38 1.944 11.268 8.600 1.00 0.00 H new ATOM 0 HD22 ASN A 38 2.111 10.040 9.859 1.00 0.00 H new ATOM 590 N ARG A 39 1.934 5.780 7.538 1.00 0.00 N ATOM 591 CA ARG A 39 3.156 5.377 6.853 1.00 0.00 C ATOM 592 C ARG A 39 2.864 4.339 5.764 1.00 0.00 C ATOM 593 O ARG A 39 3.780 3.823 5.121 1.00 0.00 O ATOM 594 CB ARG A 39 4.163 4.827 7.866 1.00 0.00 C ATOM 595 CG ARG A 39 5.595 4.818 7.357 1.00 0.00 C ATOM 596 CD ARG A 39 6.570 4.389 8.438 1.00 0.00 C ATOM 597 NE ARG A 39 7.945 4.728 8.082 1.00 0.00 N ATOM 598 CZ ARG A 39 8.827 5.239 8.935 1.00 0.00 C ATOM 599 NH1 ARG A 39 8.513 5.367 10.218 1.00 0.00 N ATOM 600 NH2 ARG A 39 10.024 5.611 8.504 1.00 0.00 N ATOM 0 H ARG A 39 1.641 5.149 8.284 1.00 0.00 H new ATOM 0 HA ARG A 39 3.584 6.254 6.367 1.00 0.00 H new ATOM 0 HB2 ARG A 39 4.114 5.425 8.776 1.00 0.00 H new ATOM 0 HB3 ARG A 39 3.876 3.811 8.136 1.00 0.00 H new ATOM 0 HG2 ARG A 39 5.675 4.142 6.505 1.00 0.00 H new ATOM 0 HG3 ARG A 39 5.861 5.813 7.000 1.00 0.00 H new ATOM 0 HD2 ARG A 39 6.307 4.872 9.379 1.00 0.00 H new ATOM 0 HD3 ARG A 39 6.489 3.314 8.597 1.00 0.00 H new ATOM 0 HE ARG A 39 8.247 4.563 7.122 1.00 0.00 H new ATOM 0 HH11 ARG A 39 7.594 5.073 10.550 1.00 0.00 H new ATOM 0 HH12 ARG A 39 9.190 5.759 10.872 1.00 0.00 H new ATOM 0 HH21 ARG A 39 10.267 5.505 7.519 1.00 0.00 H new ATOM 0 HH22 ARG A 39 10.702 6.003 9.157 1.00 0.00 H new ATOM 614 N ILE A 40 1.582 4.055 5.551 1.00 0.00 N ATOM 615 CA ILE A 40 1.163 3.079 4.543 1.00 0.00 C ATOM 616 C ILE A 40 1.673 3.463 3.154 1.00 0.00 C ATOM 617 O ILE A 40 2.203 2.622 2.426 1.00 0.00 O ATOM 618 CB ILE A 40 -0.380 2.914 4.504 1.00 0.00 C ATOM 619 CG1 ILE A 40 -0.872 2.179 5.754 1.00 0.00 C ATOM 620 CG2 ILE A 40 -0.813 2.167 3.249 1.00 0.00 C ATOM 621 CD1 ILE A 40 -2.374 1.984 5.786 1.00 0.00 C ATOM 0 H ILE A 40 0.812 4.486 6.063 1.00 0.00 H new ATOM 0 HA ILE A 40 1.603 2.125 4.832 1.00 0.00 H new ATOM 0 HB ILE A 40 -0.827 3.908 4.484 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -0.386 1.205 5.809 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -0.567 2.738 6.639 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -1.898 2.063 3.243 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -0.497 2.724 2.367 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -0.354 1.178 3.237 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -2.653 1.457 6.698 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -2.868 2.956 5.763 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -2.683 1.399 4.920 1.00 0.00 H new ATOM 633 N MET A 41 1.537 4.739 2.807 1.00 0.00 N ATOM 634 CA MET A 41 1.951 5.227 1.494 1.00 0.00 C ATOM 635 C MET A 41 3.453 5.040 1.292 1.00 0.00 C ATOM 636 O MET A 41 3.900 4.667 0.208 1.00 0.00 O ATOM 637 CB MET A 41 1.572 6.702 1.331 1.00 0.00 C ATOM 638 CG MET A 41 1.764 7.230 -0.085 1.00 0.00 C ATOM 639 SD MET A 41 0.653 6.459 -1.283 1.00 0.00 S ATOM 640 CE MET A 41 -0.942 6.991 -0.662 1.00 0.00 C ATOM 0 H MET A 41 1.143 5.455 3.417 1.00 0.00 H new ATOM 0 HA MET A 41 1.430 4.644 0.734 1.00 0.00 H new ATOM 0 HB2 MET A 41 0.530 6.834 1.621 1.00 0.00 H new ATOM 0 HB3 MET A 41 2.172 7.300 2.017 1.00 0.00 H new ATOM 0 HG2 MET A 41 1.603 8.308 -0.090 1.00 0.00 H new ATOM 0 HG3 MET A 41 2.796 7.061 -0.393 1.00 0.00 H new ATOM 0 HE1 MET A 41 -1.607 7.201 -1.500 1.00 0.00 H new ATOM 0 HE2 MET A 41 -1.373 6.203 -0.045 1.00 0.00 H new ATOM 0 HE3 MET A 41 -0.817 7.893 -0.063 1.00 0.00 H new ATOM 650 N GLU A 42 4.222 5.277 2.350 1.00 0.00 N ATOM 651 CA GLU A 42 5.668 5.097 2.300 1.00 0.00 C ATOM 652 C GLU A 42 6.008 3.651 1.997 1.00 0.00 C ATOM 653 O GLU A 42 6.730 3.351 1.052 1.00 0.00 O ATOM 654 CB GLU A 42 6.307 5.475 3.632 1.00 0.00 C ATOM 655 CG GLU A 42 7.826 5.361 3.623 1.00 0.00 C ATOM 656 CD GLU A 42 8.437 5.406 5.007 1.00 0.00 C ATOM 657 OE1 GLU A 42 8.570 6.511 5.568 1.00 0.00 O ATOM 658 OE2 GLU A 42 8.796 4.331 5.540 1.00 0.00 O ATOM 0 H GLU A 42 3.868 5.594 3.252 1.00 0.00 H new ATOM 0 HA GLU A 42 6.055 5.744 1.513 1.00 0.00 H new ATOM 0 HB2 GLU A 42 6.027 6.498 3.884 1.00 0.00 H new ATOM 0 HB3 GLU A 42 5.906 4.832 4.416 1.00 0.00 H new ATOM 0 HG2 GLU A 42 8.111 4.427 3.138 1.00 0.00 H new ATOM 0 HG3 GLU A 42 8.241 6.171 3.024 1.00 0.00 H new ATOM 665 N VAL A 43 5.482 2.760 2.820 1.00 0.00 N ATOM 666 CA VAL A 43 5.768 1.341 2.690 1.00 0.00 C ATOM 667 C VAL A 43 5.304 0.807 1.336 1.00 0.00 C ATOM 668 O VAL A 43 5.990 -0.007 0.716 1.00 0.00 O ATOM 669 CB VAL A 43 5.123 0.530 3.828 1.00 0.00 C ATOM 670 CG1 VAL A 43 5.526 -0.931 3.743 1.00 0.00 C ATOM 671 CG2 VAL A 43 5.509 1.109 5.181 1.00 0.00 C ATOM 0 H VAL A 43 4.853 2.995 3.588 1.00 0.00 H new ATOM 0 HA VAL A 43 6.850 1.224 2.758 1.00 0.00 H new ATOM 0 HB VAL A 43 4.040 0.593 3.720 1.00 0.00 H new ATOM 0 HG11 VAL A 43 5.059 -1.485 4.557 1.00 0.00 H new ATOM 0 HG12 VAL A 43 5.199 -1.344 2.788 1.00 0.00 H new ATOM 0 HG13 VAL A 43 6.610 -1.015 3.822 1.00 0.00 H new ATOM 0 HG21 VAL A 43 5.044 0.523 5.974 1.00 0.00 H new ATOM 0 HG22 VAL A 43 6.593 1.077 5.295 1.00 0.00 H new ATOM 0 HG23 VAL A 43 5.167 2.142 5.246 1.00 0.00 H new ATOM 681 N ALA A 44 4.154 1.279 0.876 1.00 0.00 N ATOM 682 CA ALA A 44 3.650 0.908 -0.440 1.00 0.00 C ATOM 683 C ALA A 44 4.635 1.322 -1.524 1.00 0.00 C ATOM 684 O ALA A 44 4.965 0.538 -2.416 1.00 0.00 O ATOM 685 CB ALA A 44 2.296 1.548 -0.688 1.00 0.00 C ATOM 0 H ALA A 44 3.552 1.919 1.394 1.00 0.00 H new ATOM 0 HA ALA A 44 3.535 -0.175 -0.471 1.00 0.00 H new ATOM 0 HB1 ALA A 44 1.933 1.261 -1.675 1.00 0.00 H new ATOM 0 HB2 ALA A 44 1.590 1.210 0.070 1.00 0.00 H new ATOM 0 HB3 ALA A 44 2.392 2.633 -0.638 1.00 0.00 H new ATOM 691 N GLU A 45 5.106 2.559 -1.431 1.00 0.00 N ATOM 692 CA GLU A 45 6.098 3.080 -2.363 1.00 0.00 C ATOM 693 C GLU A 45 7.382 2.253 -2.299 1.00 0.00 C ATOM 694 O GLU A 45 7.885 1.791 -3.324 1.00 0.00 O ATOM 695 CB GLU A 45 6.407 4.541 -2.038 1.00 0.00 C ATOM 696 CG GLU A 45 7.304 5.212 -3.062 1.00 0.00 C ATOM 697 CD GLU A 45 7.844 6.541 -2.578 1.00 0.00 C ATOM 698 OE1 GLU A 45 7.118 7.554 -2.665 1.00 0.00 O ATOM 699 OE2 GLU A 45 9.004 6.583 -2.118 1.00 0.00 O ATOM 0 H GLU A 45 4.815 3.224 -0.715 1.00 0.00 H new ATOM 0 HA GLU A 45 5.690 3.015 -3.372 1.00 0.00 H new ATOM 0 HB2 GLU A 45 5.471 5.095 -1.968 1.00 0.00 H new ATOM 0 HB3 GLU A 45 6.883 4.594 -1.059 1.00 0.00 H new ATOM 0 HG2 GLU A 45 8.137 4.550 -3.300 1.00 0.00 H new ATOM 0 HG3 GLU A 45 6.745 5.365 -3.985 1.00 0.00 H new ATOM 706 N LYS A 46 7.886 2.052 -1.085 1.00 0.00 N ATOM 707 CA LYS A 46 9.133 1.323 -0.865 1.00 0.00 C ATOM 708 C LYS A 46 9.079 -0.075 -1.467 1.00 0.00 C ATOM 709 O LYS A 46 9.972 -0.480 -2.212 1.00 0.00 O ATOM 710 CB LYS A 46 9.425 1.204 0.624 1.00 0.00 C ATOM 711 CG LYS A 46 9.727 2.531 1.288 1.00 0.00 C ATOM 712 CD LYS A 46 10.119 2.347 2.740 1.00 0.00 C ATOM 713 CE LYS A 46 9.016 1.676 3.545 1.00 0.00 C ATOM 714 NZ LYS A 46 9.377 1.516 4.976 1.00 0.00 N ATOM 0 H LYS A 46 7.445 2.388 -0.229 1.00 0.00 H new ATOM 0 HA LYS A 46 9.925 1.888 -1.356 1.00 0.00 H new ATOM 0 HB2 LYS A 46 8.569 0.746 1.119 1.00 0.00 H new ATOM 0 HB3 LYS A 46 10.272 0.534 0.768 1.00 0.00 H new ATOM 0 HG2 LYS A 46 10.534 3.032 0.753 1.00 0.00 H new ATOM 0 HG3 LYS A 46 8.852 3.178 1.225 1.00 0.00 H new ATOM 0 HD2 LYS A 46 11.027 1.747 2.798 1.00 0.00 H new ATOM 0 HD3 LYS A 46 10.350 3.317 3.179 1.00 0.00 H new ATOM 0 HE2 LYS A 46 8.103 2.266 3.467 1.00 0.00 H new ATOM 0 HE3 LYS A 46 8.801 0.697 3.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 8.816 0.745 5.392 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 10.389 1.289 5.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 9.180 2.401 5.485 1.00 0.00 H new ATOM 728 N THR A 47 8.013 -0.799 -1.149 1.00 0.00 N ATOM 729 CA THR A 47 7.874 -2.184 -1.569 1.00 0.00 C ATOM 730 C THR A 47 7.764 -2.295 -3.087 1.00 0.00 C ATOM 731 O THR A 47 8.416 -3.140 -3.704 1.00 0.00 O ATOM 732 CB THR A 47 6.645 -2.831 -0.907 1.00 0.00 C ATOM 733 OG1 THR A 47 6.691 -2.604 0.505 1.00 0.00 O ATOM 734 CG2 THR A 47 6.602 -4.328 -1.176 1.00 0.00 C ATOM 0 H THR A 47 7.230 -0.446 -0.599 1.00 0.00 H new ATOM 0 HA THR A 47 8.771 -2.715 -1.250 1.00 0.00 H new ATOM 0 HB THR A 47 5.748 -2.379 -1.331 1.00 0.00 H new ATOM 0 HG1 THR A 47 6.329 -1.716 0.705 1.00 0.00 H new ATOM 0 HG21 THR A 47 5.723 -4.759 -0.696 1.00 0.00 H new ATOM 0 HG22 THR A 47 6.551 -4.503 -2.251 1.00 0.00 H new ATOM 0 HG23 THR A 47 7.501 -4.796 -0.774 1.00 0.00 H new ATOM 742 N TYR A 48 6.966 -1.423 -3.690 1.00 0.00 N ATOM 743 CA TYR A 48 6.768 -1.461 -5.131 1.00 0.00 C ATOM 744 C TYR A 48 8.041 -1.047 -5.862 1.00 0.00 C ATOM 745 O TYR A 48 8.415 -1.664 -6.858 1.00 0.00 O ATOM 746 CB TYR A 48 5.598 -0.563 -5.550 1.00 0.00 C ATOM 747 CG TYR A 48 5.257 -0.676 -7.018 1.00 0.00 C ATOM 748 CD1 TYR A 48 4.873 -1.895 -7.562 1.00 0.00 C ATOM 749 CD2 TYR A 48 5.318 0.428 -7.862 1.00 0.00 C ATOM 750 CE1 TYR A 48 4.563 -2.014 -8.902 1.00 0.00 C ATOM 751 CE2 TYR A 48 5.007 0.318 -9.205 1.00 0.00 C ATOM 752 CZ TYR A 48 4.628 -0.907 -9.719 1.00 0.00 C ATOM 753 OH TYR A 48 4.318 -1.027 -11.056 1.00 0.00 O ATOM 0 H TYR A 48 6.450 -0.687 -3.208 1.00 0.00 H new ATOM 0 HA TYR A 48 6.527 -2.487 -5.407 1.00 0.00 H new ATOM 0 HB2 TYR A 48 4.720 -0.822 -4.959 1.00 0.00 H new ATOM 0 HB3 TYR A 48 5.843 0.474 -5.319 1.00 0.00 H new ATOM 0 HD1 TYR A 48 4.816 -2.765 -6.925 1.00 0.00 H new ATOM 0 HD2 TYR A 48 5.613 1.387 -7.462 1.00 0.00 H new ATOM 0 HE1 TYR A 48 4.271 -2.971 -9.308 1.00 0.00 H new ATOM 0 HE2 TYR A 48 5.060 1.184 -9.848 1.00 0.00 H new ATOM 0 HH TYR A 48 3.537 -1.610 -11.160 1.00 0.00 H new ATOM 763 N GLU A 49 8.709 -0.018 -5.355 1.00 0.00 N ATOM 764 CA GLU A 49 9.927 0.491 -5.973 1.00 0.00 C ATOM 765 C GLU A 49 11.022 -0.570 -5.969 1.00 0.00 C ATOM 766 O GLU A 49 11.646 -0.841 -7.003 1.00 0.00 O ATOM 767 CB GLU A 49 10.402 1.739 -5.228 1.00 0.00 C ATOM 768 CG GLU A 49 11.595 2.421 -5.873 1.00 0.00 C ATOM 769 CD GLU A 49 11.970 3.715 -5.181 1.00 0.00 C ATOM 770 OE1 GLU A 49 12.755 3.673 -4.209 1.00 0.00 O ATOM 771 OE2 GLU A 49 11.485 4.784 -5.609 1.00 0.00 O ATOM 0 H GLU A 49 8.426 0.483 -4.513 1.00 0.00 H new ATOM 0 HA GLU A 49 9.708 0.750 -7.009 1.00 0.00 H new ATOM 0 HB2 GLU A 49 9.578 2.450 -5.167 1.00 0.00 H new ATOM 0 HB3 GLU A 49 10.662 1.464 -4.206 1.00 0.00 H new ATOM 0 HG2 GLU A 49 12.449 1.744 -5.856 1.00 0.00 H new ATOM 0 HG3 GLU A 49 11.370 2.625 -6.920 1.00 0.00 H new ATOM 778 N ALA A 50 11.243 -1.168 -4.809 1.00 0.00 N ATOM 779 CA ALA A 50 12.279 -2.178 -4.652 1.00 0.00 C ATOM 780 C ALA A 50 11.968 -3.429 -5.466 1.00 0.00 C ATOM 781 O ALA A 50 12.816 -3.918 -6.214 1.00 0.00 O ATOM 782 CB ALA A 50 12.456 -2.532 -3.182 1.00 0.00 C ATOM 0 H ALA A 50 10.716 -0.970 -3.958 1.00 0.00 H new ATOM 0 HA ALA A 50 13.212 -1.759 -5.030 1.00 0.00 H new ATOM 0 HB1 ALA A 50 13.234 -3.289 -3.081 1.00 0.00 H new ATOM 0 HB2 ALA A 50 12.743 -1.640 -2.625 1.00 0.00 H new ATOM 0 HB3 ALA A 50 11.518 -2.921 -2.786 1.00 0.00 H new ATOM 788 N TYR A 51 10.748 -3.942 -5.336 1.00 0.00 N ATOM 789 CA TYR A 51 10.370 -5.162 -6.037 1.00 0.00 C ATOM 790 C TYR A 51 10.333 -4.958 -7.546 1.00 0.00 C ATOM 791 O TYR A 51 10.647 -5.878 -8.301 1.00 0.00 O ATOM 792 CB TYR A 51 9.033 -5.703 -5.533 1.00 0.00 C ATOM 793 CG TYR A 51 9.194 -6.705 -4.413 1.00 0.00 C ATOM 794 CD1 TYR A 51 9.666 -7.985 -4.678 1.00 0.00 C ATOM 795 CD2 TYR A 51 8.882 -6.380 -3.098 1.00 0.00 C ATOM 796 CE1 TYR A 51 9.824 -8.912 -3.669 1.00 0.00 C ATOM 797 CE2 TYR A 51 9.038 -7.304 -2.081 1.00 0.00 C ATOM 798 CZ TYR A 51 9.507 -8.569 -2.373 1.00 0.00 C ATOM 799 OH TYR A 51 9.660 -9.492 -1.366 1.00 0.00 O ATOM 0 H TYR A 51 10.012 -3.536 -4.758 1.00 0.00 H new ATOM 0 HA TYR A 51 11.139 -5.904 -5.821 1.00 0.00 H new ATOM 0 HB2 TYR A 51 8.417 -4.873 -5.187 1.00 0.00 H new ATOM 0 HB3 TYR A 51 8.500 -6.172 -6.360 1.00 0.00 H new ATOM 0 HD1 TYR A 51 9.914 -8.259 -5.693 1.00 0.00 H new ATOM 0 HD2 TYR A 51 8.512 -5.392 -2.867 1.00 0.00 H new ATOM 0 HE1 TYR A 51 10.194 -9.901 -3.894 1.00 0.00 H new ATOM 0 HE2 TYR A 51 8.794 -7.037 -1.063 1.00 0.00 H new ATOM 0 HH TYR A 51 10.497 -9.318 -0.887 1.00 0.00 H new ATOM 809 N ARG A 52 9.966 -3.761 -7.992 1.00 0.00 N ATOM 810 CA ARG A 52 9.996 -3.467 -9.415 1.00 0.00 C ATOM 811 C ARG A 52 11.418 -3.552 -9.941 1.00 0.00 C ATOM 812 O ARG A 52 11.681 -4.236 -10.923 1.00 0.00 O ATOM 813 CB ARG A 52 9.409 -2.092 -9.740 1.00 0.00 C ATOM 814 CG ARG A 52 9.639 -1.704 -11.191 1.00 0.00 C ATOM 815 CD ARG A 52 8.919 -0.430 -11.586 1.00 0.00 C ATOM 816 NE ARG A 52 9.256 -0.050 -12.959 1.00 0.00 N ATOM 817 CZ ARG A 52 8.775 -0.659 -14.046 1.00 0.00 C ATOM 818 NH1 ARG A 52 7.841 -1.594 -13.929 1.00 0.00 N ATOM 819 NH2 ARG A 52 9.222 -0.320 -15.249 1.00 0.00 N ATOM 0 H ARG A 52 9.650 -2.993 -7.399 1.00 0.00 H new ATOM 0 HA ARG A 52 9.374 -4.215 -9.906 1.00 0.00 H new ATOM 0 HB2 ARG A 52 8.339 -2.096 -9.531 1.00 0.00 H new ATOM 0 HB3 ARG A 52 9.859 -1.343 -9.089 1.00 0.00 H new ATOM 0 HG2 ARG A 52 10.708 -1.578 -11.362 1.00 0.00 H new ATOM 0 HG3 ARG A 52 9.306 -2.517 -11.836 1.00 0.00 H new ATOM 0 HD2 ARG A 52 7.842 -0.572 -11.497 1.00 0.00 H new ATOM 0 HD3 ARG A 52 9.192 0.375 -10.903 1.00 0.00 H new ATOM 0 HE ARG A 52 9.899 0.730 -13.094 1.00 0.00 H new ATOM 0 HH11 ARG A 52 7.488 -1.850 -13.007 1.00 0.00 H new ATOM 0 HH12 ARG A 52 7.476 -2.057 -14.761 1.00 0.00 H new ATOM 0 HH21 ARG A 52 9.933 0.405 -15.343 1.00 0.00 H new ATOM 0 HH22 ARG A 52 8.855 -0.785 -16.079 1.00 0.00 H new ATOM 833 N GLN A 53 12.337 -2.872 -9.267 1.00 0.00 N ATOM 834 CA GLN A 53 13.727 -2.854 -9.698 1.00 0.00 C ATOM 835 C GLN A 53 14.324 -4.251 -9.620 1.00 0.00 C ATOM 836 O GLN A 53 15.131 -4.628 -10.460 1.00 0.00 O ATOM 837 CB GLN A 53 14.540 -1.879 -8.843 1.00 0.00 C ATOM 838 CG GLN A 53 15.940 -1.612 -9.376 1.00 0.00 C ATOM 839 CD GLN A 53 15.936 -1.014 -10.774 1.00 0.00 C ATOM 840 OE1 GLN A 53 16.863 -1.232 -11.556 1.00 0.00 O ATOM 841 NE2 GLN A 53 14.900 -0.248 -11.098 1.00 0.00 N ATOM 0 H GLN A 53 12.146 -2.329 -8.425 1.00 0.00 H new ATOM 0 HA GLN A 53 13.763 -2.518 -10.734 1.00 0.00 H new ATOM 0 HB2 GLN A 53 14.001 -0.934 -8.775 1.00 0.00 H new ATOM 0 HB3 GLN A 53 14.617 -2.276 -7.831 1.00 0.00 H new ATOM 0 HG2 GLN A 53 16.459 -0.934 -8.698 1.00 0.00 H new ATOM 0 HG3 GLN A 53 16.503 -2.545 -9.387 1.00 0.00 H new ATOM 0 HE21 GLN A 53 14.151 -0.091 -10.423 1.00 0.00 H new ATOM 0 HE22 GLN A 53 14.853 0.183 -12.021 1.00 0.00 H new ATOM 850 N LEU A 54 13.915 -5.017 -8.615 1.00 0.00 N ATOM 851 CA LEU A 54 14.362 -6.397 -8.484 1.00 0.00 C ATOM 852 C LEU A 54 13.871 -7.226 -9.672 1.00 0.00 C ATOM 853 O LEU A 54 14.656 -7.923 -10.315 1.00 0.00 O ATOM 854 CB LEU A 54 13.866 -6.998 -7.157 1.00 0.00 C ATOM 855 CG LEU A 54 14.559 -8.296 -6.704 1.00 0.00 C ATOM 856 CD1 LEU A 54 14.258 -8.567 -5.243 1.00 0.00 C ATOM 857 CD2 LEU A 54 14.118 -9.491 -7.540 1.00 0.00 C ATOM 0 H LEU A 54 13.277 -4.707 -7.882 1.00 0.00 H new ATOM 0 HA LEU A 54 15.452 -6.414 -8.479 1.00 0.00 H new ATOM 0 HB2 LEU A 54 13.990 -6.251 -6.373 1.00 0.00 H new ATOM 0 HB3 LEU A 54 12.797 -7.192 -7.246 1.00 0.00 H new ATOM 0 HG LEU A 54 15.631 -8.159 -6.842 1.00 0.00 H new ATOM 0 HD11 LEU A 54 14.753 -9.487 -4.934 1.00 0.00 H new ATOM 0 HD12 LEU A 54 14.622 -7.738 -4.637 1.00 0.00 H new ATOM 0 HD13 LEU A 54 13.182 -8.671 -5.106 1.00 0.00 H new ATOM 0 HD21 LEU A 54 14.629 -10.388 -7.190 1.00 0.00 H new ATOM 0 HD22 LEU A 54 13.041 -9.625 -7.443 1.00 0.00 H new ATOM 0 HD23 LEU A 54 14.369 -9.316 -8.586 1.00 0.00 H new ATOM 869 N ASP A 55 12.577 -7.139 -9.969 1.00 0.00 N ATOM 870 CA ASP A 55 11.991 -7.907 -11.068 1.00 0.00 C ATOM 871 C ASP A 55 12.570 -7.450 -12.403 1.00 0.00 C ATOM 872 O ASP A 55 12.862 -8.263 -13.275 1.00 0.00 O ATOM 873 CB ASP A 55 10.466 -7.768 -11.079 1.00 0.00 C ATOM 874 CG ASP A 55 9.799 -8.782 -11.995 1.00 0.00 C ATOM 875 OD1 ASP A 55 9.712 -8.530 -13.215 1.00 0.00 O ATOM 876 OD2 ASP A 55 9.363 -9.845 -11.497 1.00 0.00 O ATOM 0 H ASP A 55 11.915 -6.547 -9.467 1.00 0.00 H new ATOM 0 HA ASP A 55 12.239 -8.958 -10.917 1.00 0.00 H new ATOM 0 HB2 ASP A 55 10.085 -7.892 -10.065 1.00 0.00 H new ATOM 0 HB3 ASP A 55 10.198 -6.761 -11.399 1.00 0.00 H new ATOM 881 N GLU A 56 12.750 -6.142 -12.541 1.00 0.00 N ATOM 882 CA GLU A 56 13.366 -5.558 -13.728 1.00 0.00 C ATOM 883 C GLU A 56 14.826 -5.998 -13.858 1.00 0.00 C ATOM 884 O GLU A 56 15.312 -6.249 -14.961 1.00 0.00 O ATOM 885 CB GLU A 56 13.275 -4.029 -13.673 1.00 0.00 C ATOM 886 CG GLU A 56 11.890 -3.475 -13.997 1.00 0.00 C ATOM 887 CD GLU A 56 11.379 -3.904 -15.362 1.00 0.00 C ATOM 888 OE1 GLU A 56 11.962 -3.483 -16.385 1.00 0.00 O ATOM 889 OE2 GLU A 56 10.377 -4.646 -15.422 1.00 0.00 O ATOM 0 H GLU A 56 12.475 -5.458 -11.837 1.00 0.00 H new ATOM 0 HA GLU A 56 12.824 -5.913 -14.604 1.00 0.00 H new ATOM 0 HB2 GLU A 56 13.565 -3.694 -12.677 1.00 0.00 H new ATOM 0 HB3 GLU A 56 13.996 -3.607 -14.373 1.00 0.00 H new ATOM 0 HG2 GLU A 56 11.186 -3.804 -13.233 1.00 0.00 H new ATOM 0 HG3 GLU A 56 11.922 -2.386 -13.954 1.00 0.00 H new ATOM 896 N PHE A 57 15.513 -6.101 -12.728 1.00 0.00 N ATOM 897 CA PHE A 57 16.907 -6.535 -12.702 1.00 0.00 C ATOM 898 C PHE A 57 16.997 -8.023 -13.038 1.00 0.00 C ATOM 899 O PHE A 57 17.938 -8.477 -13.692 1.00 0.00 O ATOM 900 CB PHE A 57 17.498 -6.261 -11.318 1.00 0.00 C ATOM 901 CG PHE A 57 18.995 -6.143 -11.291 1.00 0.00 C ATOM 902 CD1 PHE A 57 19.629 -5.097 -11.942 1.00 0.00 C ATOM 903 CD2 PHE A 57 19.766 -7.062 -10.599 1.00 0.00 C ATOM 904 CE1 PHE A 57 21.004 -4.973 -11.906 1.00 0.00 C ATOM 905 CE2 PHE A 57 21.140 -6.943 -10.561 1.00 0.00 C ATOM 906 CZ PHE A 57 21.760 -5.897 -11.216 1.00 0.00 C ATOM 0 H PHE A 57 15.125 -5.888 -11.809 1.00 0.00 H new ATOM 0 HA PHE A 57 17.476 -5.979 -13.447 1.00 0.00 H new ATOM 0 HB2 PHE A 57 17.067 -5.339 -10.929 1.00 0.00 H new ATOM 0 HB3 PHE A 57 17.197 -7.063 -10.644 1.00 0.00 H new ATOM 0 HD1 PHE A 57 19.041 -4.371 -12.484 1.00 0.00 H new ATOM 0 HD2 PHE A 57 19.286 -7.881 -10.083 1.00 0.00 H new ATOM 0 HE1 PHE A 57 21.487 -4.153 -12.418 1.00 0.00 H new ATOM 0 HE2 PHE A 57 21.730 -7.667 -10.019 1.00 0.00 H new ATOM 0 HZ PHE A 57 22.836 -5.803 -11.188 1.00 0.00 H new ATOM 916 N ARG A 58 16.005 -8.777 -12.585 1.00 0.00 N ATOM 917 CA ARG A 58 15.886 -10.184 -12.928 1.00 0.00 C ATOM 918 C ARG A 58 15.524 -10.324 -14.404 1.00 0.00 C ATOM 919 O ARG A 58 16.002 -11.219 -15.090 1.00 0.00 O ATOM 920 CB ARG A 58 14.826 -10.842 -12.038 1.00 0.00 C ATOM 921 CG ARG A 58 14.251 -12.125 -12.604 1.00 0.00 C ATOM 922 CD ARG A 58 13.114 -12.644 -11.748 1.00 0.00 C ATOM 923 NE ARG A 58 13.575 -13.557 -10.705 1.00 0.00 N ATOM 924 CZ ARG A 58 12.769 -14.131 -9.811 1.00 0.00 C ATOM 925 NH1 ARG A 58 11.472 -13.845 -9.798 1.00 0.00 N ATOM 926 NH2 ARG A 58 13.259 -14.994 -8.929 1.00 0.00 N ATOM 0 H ARG A 58 15.265 -8.432 -11.973 1.00 0.00 H new ATOM 0 HA ARG A 58 16.838 -10.687 -12.759 1.00 0.00 H new ATOM 0 HB2 ARG A 58 15.266 -11.053 -11.063 1.00 0.00 H new ATOM 0 HB3 ARG A 58 14.014 -10.134 -11.875 1.00 0.00 H new ATOM 0 HG2 ARG A 58 13.894 -11.949 -13.619 1.00 0.00 H new ATOM 0 HG3 ARG A 58 15.035 -12.880 -12.668 1.00 0.00 H new ATOM 0 HD2 ARG A 58 12.596 -11.803 -11.288 1.00 0.00 H new ATOM 0 HD3 ARG A 58 12.390 -13.156 -12.382 1.00 0.00 H new ATOM 0 HE ARG A 58 14.572 -13.768 -10.658 1.00 0.00 H new ATOM 0 HH11 ARG A 58 11.089 -13.184 -10.474 1.00 0.00 H new ATOM 0 HH12 ARG A 58 10.859 -14.286 -9.112 1.00 0.00 H new ATOM 0 HH21 ARG A 58 14.254 -15.219 -8.934 1.00 0.00 H new ATOM 0 HH22 ARG A 58 12.641 -15.432 -8.246 1.00 0.00 H new ATOM 940 N LYS A 59 14.679 -9.420 -14.870 1.00 0.00 N ATOM 941 CA LYS A 59 14.262 -9.364 -16.268 1.00 0.00 C ATOM 942 C LYS A 59 15.458 -9.229 -17.209 1.00 0.00 C ATOM 943 O LYS A 59 15.557 -9.959 -18.199 1.00 0.00 O ATOM 944 CB LYS A 59 13.299 -8.188 -16.438 1.00 0.00 C ATOM 945 CG LYS A 59 13.085 -7.729 -17.866 1.00 0.00 C ATOM 946 CD LYS A 59 12.324 -6.422 -17.883 1.00 0.00 C ATOM 947 CE LYS A 59 12.342 -5.777 -19.252 1.00 0.00 C ATOM 948 NZ LYS A 59 11.722 -4.427 -19.222 1.00 0.00 N ATOM 0 H LYS A 59 14.258 -8.697 -14.287 1.00 0.00 H new ATOM 0 HA LYS A 59 13.762 -10.296 -16.530 1.00 0.00 H new ATOM 0 HB2 LYS A 59 12.334 -8.466 -16.014 1.00 0.00 H new ATOM 0 HB3 LYS A 59 13.673 -7.346 -15.855 1.00 0.00 H new ATOM 0 HG2 LYS A 59 14.046 -7.606 -18.365 1.00 0.00 H new ATOM 0 HG3 LYS A 59 12.533 -8.487 -18.421 1.00 0.00 H new ATOM 0 HD2 LYS A 59 11.292 -6.598 -17.578 1.00 0.00 H new ATOM 0 HD3 LYS A 59 12.759 -5.739 -17.154 1.00 0.00 H new ATOM 0 HE2 LYS A 59 13.370 -5.699 -19.606 1.00 0.00 H new ATOM 0 HE3 LYS A 59 11.807 -6.409 -19.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 12.230 -3.797 -19.875 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 10.726 -4.496 -19.513 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 11.775 -4.042 -18.257 1.00 0.00 H new ATOM 962 N SER A 60 16.360 -8.308 -16.902 1.00 0.00 N ATOM 963 CA SER A 60 17.544 -8.115 -17.722 1.00 0.00 C ATOM 964 C SER A 60 18.479 -9.314 -17.604 1.00 0.00 C ATOM 965 O SER A 60 18.986 -9.824 -18.604 1.00 0.00 O ATOM 966 CB SER A 60 18.256 -6.823 -17.318 1.00 0.00 C ATOM 967 OG SER A 60 18.392 -6.740 -15.910 1.00 0.00 O ATOM 0 H SER A 60 16.294 -7.687 -16.096 1.00 0.00 H new ATOM 0 HA SER A 60 17.240 -8.029 -18.765 1.00 0.00 H new ATOM 0 HB2 SER A 60 19.240 -6.784 -17.785 1.00 0.00 H new ATOM 0 HB3 SER A 60 17.695 -5.964 -17.684 1.00 0.00 H new ATOM 0 HG SER A 60 18.851 -5.907 -15.674 1.00 0.00 H new ATOM 973 N THR A 61 18.671 -9.777 -16.377 1.00 0.00 N ATOM 974 CA THR A 61 19.524 -10.928 -16.110 1.00 0.00 C ATOM 975 C THR A 61 18.999 -12.183 -16.810 1.00 0.00 C ATOM 976 O THR A 61 19.766 -12.926 -17.414 1.00 0.00 O ATOM 977 CB THR A 61 19.631 -11.194 -14.593 1.00 0.00 C ATOM 978 OG1 THR A 61 20.107 -10.019 -13.925 1.00 0.00 O ATOM 979 CG2 THR A 61 20.568 -12.357 -14.302 1.00 0.00 C ATOM 0 H THR A 61 18.244 -9.370 -15.545 1.00 0.00 H new ATOM 0 HA THR A 61 20.513 -10.695 -16.504 1.00 0.00 H new ATOM 0 HB THR A 61 18.638 -11.452 -14.225 1.00 0.00 H new ATOM 0 HG1 THR A 61 19.365 -9.391 -13.799 1.00 0.00 H new ATOM 0 HG21 THR A 61 20.623 -12.520 -13.226 1.00 0.00 H new ATOM 0 HG22 THR A 61 20.191 -13.258 -14.787 1.00 0.00 H new ATOM 0 HG23 THR A 61 21.562 -12.128 -14.685 1.00 0.00 H new ATOM 987 N ALA A 62 17.687 -12.396 -16.745 1.00 0.00 N ATOM 988 CA ALA A 62 17.061 -13.571 -17.342 1.00 0.00 C ATOM 989 C ALA A 62 17.302 -13.632 -18.846 1.00 0.00 C ATOM 990 O ALA A 62 17.435 -14.716 -19.412 1.00 0.00 O ATOM 991 CB ALA A 62 15.569 -13.586 -17.055 1.00 0.00 C ATOM 0 H ALA A 62 17.034 -11.765 -16.281 1.00 0.00 H new ATOM 0 HA ALA A 62 17.520 -14.450 -16.890 1.00 0.00 H new ATOM 0 HB1 ALA A 62 15.120 -14.470 -17.508 1.00 0.00 H new ATOM 0 HB2 ALA A 62 15.406 -13.608 -15.977 1.00 0.00 H new ATOM 0 HB3 ALA A 62 15.109 -12.691 -17.473 1.00 0.00 H new ATOM 997 N SER A 63 17.351 -12.467 -19.486 1.00 0.00 N ATOM 998 CA SER A 63 17.641 -12.392 -20.912 1.00 0.00 C ATOM 999 C SER A 63 19.061 -12.886 -21.192 1.00 0.00 C ATOM 1000 O SER A 63 19.304 -13.584 -22.175 1.00 0.00 O ATOM 1001 CB SER A 63 17.469 -10.952 -21.410 1.00 0.00 C ATOM 1002 OG SER A 63 17.656 -10.857 -22.814 1.00 0.00 O ATOM 0 H SER A 63 17.194 -11.564 -19.039 1.00 0.00 H new ATOM 0 HA SER A 63 16.940 -13.033 -21.447 1.00 0.00 H new ATOM 0 HB2 SER A 63 16.473 -10.593 -21.150 1.00 0.00 H new ATOM 0 HB3 SER A 63 18.183 -10.304 -20.903 1.00 0.00 H new ATOM 0 HG SER A 63 17.538 -9.926 -23.098 1.00 0.00 H new ATOM 1008 N LEU A 64 19.985 -12.544 -20.301 1.00 0.00 N ATOM 1009 CA LEU A 64 21.389 -12.916 -20.461 1.00 0.00 C ATOM 1010 C LEU A 64 21.645 -14.346 -19.994 1.00 0.00 C ATOM 1011 O LEU A 64 22.459 -15.064 -20.572 1.00 0.00 O ATOM 1012 CB LEU A 64 22.292 -11.945 -19.688 1.00 0.00 C ATOM 1013 CG LEU A 64 22.680 -10.661 -20.434 1.00 0.00 C ATOM 1014 CD1 LEU A 64 23.381 -10.996 -21.741 1.00 0.00 C ATOM 1015 CD2 LEU A 64 21.464 -9.785 -20.691 1.00 0.00 C ATOM 0 H LEU A 64 19.787 -12.007 -19.456 1.00 0.00 H new ATOM 0 HA LEU A 64 21.626 -12.858 -21.523 1.00 0.00 H new ATOM 0 HB2 LEU A 64 21.788 -11.667 -18.762 1.00 0.00 H new ATOM 0 HB3 LEU A 64 23.205 -12.471 -19.408 1.00 0.00 H new ATOM 0 HG LEU A 64 23.369 -10.101 -19.802 1.00 0.00 H new ATOM 0 HD11 LEU A 64 23.649 -10.074 -22.257 1.00 0.00 H new ATOM 0 HD12 LEU A 64 24.283 -11.571 -21.533 1.00 0.00 H new ATOM 0 HD13 LEU A 64 22.714 -11.584 -22.371 1.00 0.00 H new ATOM 0 HD21 LEU A 64 21.771 -8.883 -21.221 1.00 0.00 H new ATOM 0 HD22 LEU A 64 20.742 -10.333 -21.296 1.00 0.00 H new ATOM 0 HD23 LEU A 64 21.007 -9.510 -19.741 1.00 0.00 H new ATOM 1027 N GLU A 65 20.936 -14.749 -18.951 1.00 0.00 N ATOM 1028 CA GLU A 65 21.085 -16.077 -18.364 1.00 0.00 C ATOM 1029 C GLU A 65 20.369 -17.119 -19.206 1.00 0.00 C ATOM 1030 O GLU A 65 20.618 -18.319 -19.088 1.00 0.00 O ATOM 1031 CB GLU A 65 20.509 -16.063 -16.948 1.00 0.00 C ATOM 1032 CG GLU A 65 20.690 -17.362 -16.181 1.00 0.00 C ATOM 1033 CD GLU A 65 20.128 -17.293 -14.776 1.00 0.00 C ATOM 1034 OE1 GLU A 65 18.886 -17.314 -14.622 1.00 0.00 O ATOM 1035 OE2 GLU A 65 20.927 -17.225 -13.817 1.00 0.00 O ATOM 0 H GLU A 65 20.240 -14.166 -18.485 1.00 0.00 H new ATOM 0 HA GLU A 65 22.143 -16.336 -18.330 1.00 0.00 H new ATOM 0 HB2 GLU A 65 20.979 -15.256 -16.386 1.00 0.00 H new ATOM 0 HB3 GLU A 65 19.445 -15.835 -17.005 1.00 0.00 H new ATOM 0 HG2 GLU A 65 20.202 -18.171 -16.724 1.00 0.00 H new ATOM 0 HG3 GLU A 65 21.751 -17.606 -16.132 1.00 0.00 H new ATOM 1042 N HIS A 66 19.502 -16.628 -20.067 1.00 0.00 N ATOM 1043 CA HIS A 66 18.655 -17.471 -20.904 1.00 0.00 C ATOM 1044 C HIS A 66 17.757 -18.332 -20.021 1.00 0.00 C ATOM 1045 O HIS A 66 17.971 -19.536 -19.874 1.00 0.00 O ATOM 1046 CB HIS A 66 19.496 -18.342 -21.854 1.00 0.00 C ATOM 1047 CG HIS A 66 18.688 -19.186 -22.801 1.00 0.00 C ATOM 1048 ND1 HIS A 66 18.036 -18.672 -23.900 1.00 0.00 N ATOM 1049 CD2 HIS A 66 18.434 -20.516 -22.806 1.00 0.00 C ATOM 1050 CE1 HIS A 66 17.416 -19.648 -24.538 1.00 0.00 C ATOM 1051 NE2 HIS A 66 17.642 -20.780 -23.896 1.00 0.00 N ATOM 0 H HIS A 66 19.360 -15.628 -20.211 1.00 0.00 H new ATOM 0 HA HIS A 66 18.030 -16.830 -21.525 1.00 0.00 H new ATOM 0 HB2 HIS A 66 20.154 -17.695 -22.434 1.00 0.00 H new ATOM 0 HB3 HIS A 66 20.135 -18.995 -21.259 1.00 0.00 H new ATOM 0 HD2 HIS A 66 18.789 -21.237 -22.085 1.00 0.00 H new ATOM 0 HE1 HIS A 66 16.824 -19.539 -25.434 1.00 0.00 H new ATOM 0 HE2 HIS A 66 17.287 -21.698 -24.165 1.00 0.00 H new ATOM 1060 N HIS A 67 16.770 -17.693 -19.408 1.00 0.00 N ATOM 1061 CA HIS A 67 15.848 -18.387 -18.521 1.00 0.00 C ATOM 1062 C HIS A 67 14.691 -18.968 -19.328 1.00 0.00 C ATOM 1063 O HIS A 67 13.821 -18.238 -19.804 1.00 0.00 O ATOM 1064 CB HIS A 67 15.323 -17.436 -17.438 1.00 0.00 C ATOM 1065 CG HIS A 67 14.527 -18.124 -16.372 1.00 0.00 C ATOM 1066 ND1 HIS A 67 13.229 -17.781 -16.052 1.00 0.00 N ATOM 1067 CD2 HIS A 67 14.859 -19.144 -15.546 1.00 0.00 C ATOM 1068 CE1 HIS A 67 12.801 -18.560 -15.074 1.00 0.00 C ATOM 1069 NE2 HIS A 67 13.771 -19.396 -14.751 1.00 0.00 N ATOM 0 H HIS A 67 16.588 -16.695 -19.509 1.00 0.00 H new ATOM 0 HA HIS A 67 16.380 -19.202 -18.029 1.00 0.00 H new ATOM 0 HB2 HIS A 67 16.167 -16.923 -16.976 1.00 0.00 H new ATOM 0 HB3 HIS A 67 14.703 -16.672 -17.907 1.00 0.00 H new ATOM 0 HD2 HIS A 67 15.806 -19.663 -15.518 1.00 0.00 H new ATOM 0 HE1 HIS A 67 11.824 -18.520 -14.616 1.00 0.00 H new ATOM 0 HE2 HIS A 67 13.719 -20.113 -14.027 1.00 0.00 H new ATOM 1078 N HIS A 68 14.701 -20.281 -19.488 1.00 0.00 N ATOM 1079 CA HIS A 68 13.695 -20.973 -20.280 1.00 0.00 C ATOM 1080 C HIS A 68 12.542 -21.430 -19.392 1.00 0.00 C ATOM 1081 O HIS A 68 12.643 -22.444 -18.702 1.00 0.00 O ATOM 1082 CB HIS A 68 14.335 -22.172 -20.999 1.00 0.00 C ATOM 1083 CG HIS A 68 13.393 -22.987 -21.836 1.00 0.00 C ATOM 1084 ND1 HIS A 68 13.275 -22.845 -23.202 1.00 0.00 N ATOM 1085 CD2 HIS A 68 12.555 -23.992 -21.495 1.00 0.00 C ATOM 1086 CE1 HIS A 68 12.404 -23.725 -23.657 1.00 0.00 C ATOM 1087 NE2 HIS A 68 11.953 -24.434 -22.642 1.00 0.00 N ATOM 0 H HIS A 68 15.403 -20.896 -19.075 1.00 0.00 H new ATOM 0 HA HIS A 68 13.296 -20.288 -21.028 1.00 0.00 H new ATOM 0 HB2 HIS A 68 15.140 -21.807 -21.637 1.00 0.00 H new ATOM 0 HB3 HIS A 68 14.790 -22.823 -20.253 1.00 0.00 H new ATOM 0 HD2 HIS A 68 12.391 -24.376 -20.499 1.00 0.00 H new ATOM 0 HE1 HIS A 68 12.110 -23.844 -24.689 1.00 0.00 H new ATOM 0 HE2 HIS A 68 11.268 -25.188 -22.701 1.00 0.00 H new ATOM 1096 N HIS A 69 11.466 -20.653 -19.384 1.00 0.00 N ATOM 1097 CA HIS A 69 10.252 -21.054 -18.681 1.00 0.00 C ATOM 1098 C HIS A 69 9.648 -22.271 -19.371 1.00 0.00 C ATOM 1099 O HIS A 69 9.596 -22.333 -20.597 1.00 0.00 O ATOM 1100 CB HIS A 69 9.237 -19.899 -18.591 1.00 0.00 C ATOM 1101 CG HIS A 69 8.790 -19.329 -19.908 1.00 0.00 C ATOM 1102 ND1 HIS A 69 7.496 -19.430 -20.367 1.00 0.00 N ATOM 1103 CD2 HIS A 69 9.461 -18.614 -20.840 1.00 0.00 C ATOM 1104 CE1 HIS A 69 7.392 -18.805 -21.525 1.00 0.00 C ATOM 1105 NE2 HIS A 69 8.571 -18.299 -21.835 1.00 0.00 N ATOM 0 H HIS A 69 11.408 -19.749 -19.852 1.00 0.00 H new ATOM 0 HA HIS A 69 10.513 -21.318 -17.656 1.00 0.00 H new ATOM 0 HB2 HIS A 69 8.359 -20.251 -18.050 1.00 0.00 H new ATOM 0 HB3 HIS A 69 9.676 -19.097 -17.998 1.00 0.00 H new ATOM 0 HD2 HIS A 69 10.505 -18.341 -20.807 1.00 0.00 H new ATOM 0 HE1 HIS A 69 6.494 -18.722 -22.119 1.00 0.00 H new ATOM 0 HE2 HIS A 69 8.785 -17.762 -22.676 1.00 0.00 H new ATOM 1114 N HIS A 70 9.214 -23.241 -18.586 1.00 0.00 N ATOM 1115 CA HIS A 70 8.863 -24.544 -19.127 1.00 0.00 C ATOM 1116 C HIS A 70 7.385 -24.880 -18.945 1.00 0.00 C ATOM 1117 O HIS A 70 6.851 -24.829 -17.836 1.00 0.00 O ATOM 1118 CB HIS A 70 9.733 -25.621 -18.463 1.00 0.00 C ATOM 1119 CG HIS A 70 9.338 -27.029 -18.801 1.00 0.00 C ATOM 1120 ND1 HIS A 70 8.644 -27.840 -17.932 1.00 0.00 N ATOM 1121 CD2 HIS A 70 9.534 -27.765 -19.921 1.00 0.00 C ATOM 1122 CE1 HIS A 70 8.432 -29.011 -18.500 1.00 0.00 C ATOM 1123 NE2 HIS A 70 8.959 -28.993 -19.709 1.00 0.00 N ATOM 0 H HIS A 70 9.096 -23.153 -17.577 1.00 0.00 H new ATOM 0 HA HIS A 70 9.049 -24.515 -20.201 1.00 0.00 H new ATOM 0 HB2 HIS A 70 10.771 -25.466 -18.759 1.00 0.00 H new ATOM 0 HB3 HIS A 70 9.687 -25.493 -17.382 1.00 0.00 H new ATOM 0 HD2 HIS A 70 10.048 -27.445 -20.815 1.00 0.00 H new ATOM 0 HE1 HIS A 70 7.914 -29.845 -18.051 1.00 0.00 H new ATOM 0 HE2 HIS A 70 8.942 -29.764 -20.376 1.00 0.00 H new ATOM 1132 N HIS A 71 6.739 -25.217 -20.053 1.00 0.00 N ATOM 1133 CA HIS A 71 5.427 -25.841 -20.027 1.00 0.00 C ATOM 1134 C HIS A 71 5.301 -26.766 -21.235 1.00 0.00 C ATOM 1135 O HIS A 71 5.602 -26.318 -22.363 1.00 0.00 O ATOM 1136 CB HIS A 71 4.281 -24.804 -19.978 1.00 0.00 C ATOM 1137 CG HIS A 71 3.996 -24.083 -21.267 1.00 0.00 C ATOM 1138 ND1 HIS A 71 3.214 -24.619 -22.266 1.00 0.00 N ATOM 1139 CD2 HIS A 71 4.365 -22.855 -21.703 1.00 0.00 C ATOM 1140 CE1 HIS A 71 3.117 -23.758 -23.257 1.00 0.00 C ATOM 1141 NE2 HIS A 71 3.803 -22.674 -22.944 1.00 0.00 N ATOM 1142 OXT HIS A 71 4.935 -27.943 -21.055 1.00 0.00 O ATOM 0 H HIS A 71 7.110 -25.065 -20.991 1.00 0.00 H new ATOM 0 HA HIS A 71 5.334 -26.424 -19.110 1.00 0.00 H new ATOM 0 HB2 HIS A 71 3.371 -25.311 -19.658 1.00 0.00 H new ATOM 0 HB3 HIS A 71 4.519 -24.064 -19.214 1.00 0.00 H new ATOM 0 HD2 HIS A 71 4.986 -22.148 -21.173 1.00 0.00 H new ATOM 0 HE1 HIS A 71 2.568 -23.913 -24.174 1.00 0.00 H new ATOM 0 HE2 HIS A 71 3.900 -21.842 -23.526 1.00 0.00 H new TER 1151 HIS A 71 ATOM 1152 N MET B 1 -30.809 21.357 -1.065 1.00 0.00 N ATOM 1153 CA MET B 1 -30.096 20.127 -0.655 1.00 0.00 C ATOM 1154 C MET B 1 -30.551 19.695 0.729 1.00 0.00 C ATOM 1155 O MET B 1 -31.146 20.480 1.469 1.00 0.00 O ATOM 1156 CB MET B 1 -28.584 20.361 -0.654 1.00 0.00 C ATOM 1157 CG MET B 1 -28.000 20.583 -2.039 1.00 0.00 C ATOM 1158 SD MET B 1 -26.250 21.019 -2.000 1.00 0.00 S ATOM 1159 CE MET B 1 -26.313 22.595 -1.148 1.00 0.00 C ATOM 0 H1 MET B 1 -31.347 21.173 -1.936 1.00 0.00 H new ATOM 0 H2 MET B 1 -31.462 21.648 -0.310 1.00 0.00 H new ATOM 0 H3 MET B 1 -30.120 22.116 -1.238 1.00 0.00 H new ATOM 0 HA MET B 1 -30.329 19.338 -1.370 1.00 0.00 H new ATOM 0 HB2 MET B 1 -28.360 21.227 -0.032 1.00 0.00 H new ATOM 0 HB3 MET B 1 -28.093 19.503 -0.195 1.00 0.00 H new ATOM 0 HG2 MET B 1 -28.131 19.678 -2.632 1.00 0.00 H new ATOM 0 HG3 MET B 1 -28.556 21.376 -2.540 1.00 0.00 H new ATOM 0 HE1 MET B 1 -25.400 23.155 -1.350 1.00 0.00 H new ATOM 0 HE2 MET B 1 -27.173 23.165 -1.500 1.00 0.00 H new ATOM 0 HE3 MET B 1 -26.404 22.425 -0.075 1.00 0.00 H new ATOM 1171 N SER B 2 -30.290 18.444 1.072 1.00 0.00 N ATOM 1172 CA SER B 2 -30.718 17.897 2.348 1.00 0.00 C ATOM 1173 C SER B 2 -29.542 17.771 3.317 1.00 0.00 C ATOM 1174 O SER B 2 -28.388 17.663 2.901 1.00 0.00 O ATOM 1175 CB SER B 2 -31.371 16.530 2.122 1.00 0.00 C ATOM 1176 OG SER B 2 -32.432 16.628 1.188 1.00 0.00 O ATOM 0 H SER B 2 -29.781 17.786 0.481 1.00 0.00 H new ATOM 0 HA SER B 2 -31.443 18.578 2.794 1.00 0.00 H new ATOM 0 HB2 SER B 2 -30.626 15.821 1.760 1.00 0.00 H new ATOM 0 HB3 SER B 2 -31.748 16.141 3.068 1.00 0.00 H new ATOM 0 HG SER B 2 -32.835 15.744 1.056 1.00 0.00 H new ATOM 1182 N GLU B 3 -29.845 17.804 4.605 1.00 0.00 N ATOM 1183 CA GLU B 3 -28.849 17.596 5.637 1.00 0.00 C ATOM 1184 C GLU B 3 -29.443 16.707 6.717 1.00 0.00 C ATOM 1185 O GLU B 3 -30.605 16.301 6.627 1.00 0.00 O ATOM 1186 CB GLU B 3 -28.383 18.926 6.244 1.00 0.00 C ATOM 1187 CG GLU B 3 -29.498 19.734 6.891 1.00 0.00 C ATOM 1188 CD GLU B 3 -28.974 20.852 7.771 1.00 0.00 C ATOM 1189 OE1 GLU B 3 -28.566 21.902 7.232 1.00 0.00 O ATOM 1190 OE2 GLU B 3 -28.963 20.681 9.010 1.00 0.00 O ATOM 0 H GLU B 3 -30.785 17.975 4.961 1.00 0.00 H new ATOM 0 HA GLU B 3 -27.976 17.117 5.193 1.00 0.00 H new ATOM 0 HB2 GLU B 3 -27.614 18.724 6.990 1.00 0.00 H new ATOM 0 HB3 GLU B 3 -27.918 19.527 5.463 1.00 0.00 H new ATOM 0 HG2 GLU B 3 -30.134 20.157 6.113 1.00 0.00 H new ATOM 0 HG3 GLU B 3 -30.123 19.070 7.488 1.00 0.00 H new ATOM 1197 N GLY B 4 -28.650 16.394 7.719 1.00 0.00 N ATOM 1198 CA GLY B 4 -29.135 15.595 8.820 1.00 0.00 C ATOM 1199 C GLY B 4 -28.420 14.267 8.933 1.00 0.00 C ATOM 1200 O GLY B 4 -27.475 13.992 8.190 1.00 0.00 O ATOM 0 H GLY B 4 -27.673 16.679 7.793 1.00 0.00 H new ATOM 0 HA2 GLY B 4 -29.011 16.151 9.750 1.00 0.00 H new ATOM 0 HA3 GLY B 4 -30.203 15.419 8.694 1.00 0.00 H new ATOM 1204 N ALA B 5 -28.881 13.448 9.864 1.00 0.00 N ATOM 1205 CA ALA B 5 -28.285 12.147 10.125 1.00 0.00 C ATOM 1206 C ALA B 5 -28.537 11.160 8.988 1.00 0.00 C ATOM 1207 O ALA B 5 -27.849 10.151 8.878 1.00 0.00 O ATOM 1208 CB ALA B 5 -28.806 11.583 11.439 1.00 0.00 C ATOM 0 H ALA B 5 -29.679 13.666 10.461 1.00 0.00 H new ATOM 0 HA ALA B 5 -27.207 12.291 10.196 1.00 0.00 H new ATOM 0 HB1 ALA B 5 -28.352 10.609 11.622 1.00 0.00 H new ATOM 0 HB2 ALA B 5 -28.550 12.261 12.253 1.00 0.00 H new ATOM 0 HB3 ALA B 5 -29.889 11.474 11.384 1.00 0.00 H new ATOM 1214 N GLU B 6 -29.521 11.455 8.149 1.00 0.00 N ATOM 1215 CA GLU B 6 -29.926 10.543 7.080 1.00 0.00 C ATOM 1216 C GLU B 6 -28.792 10.263 6.100 1.00 0.00 C ATOM 1217 O GLU B 6 -28.429 9.104 5.878 1.00 0.00 O ATOM 1218 CB GLU B 6 -31.128 11.123 6.335 1.00 0.00 C ATOM 1219 CG GLU B 6 -32.409 11.136 7.153 1.00 0.00 C ATOM 1220 CD GLU B 6 -33.126 9.805 7.113 1.00 0.00 C ATOM 1221 OE1 GLU B 6 -32.822 8.924 7.946 1.00 0.00 O ATOM 1222 OE2 GLU B 6 -34.002 9.632 6.236 1.00 0.00 O ATOM 0 H GLU B 6 -30.057 12.322 8.186 1.00 0.00 H new ATOM 0 HA GLU B 6 -30.197 9.594 7.542 1.00 0.00 H new ATOM 0 HB2 GLU B 6 -30.895 12.142 6.026 1.00 0.00 H new ATOM 0 HB3 GLU B 6 -31.294 10.544 5.426 1.00 0.00 H new ATOM 0 HG2 GLU B 6 -32.175 11.390 8.187 1.00 0.00 H new ATOM 0 HG3 GLU B 6 -33.071 11.915 6.775 1.00 0.00 H new ATOM 1229 N GLU B 7 -28.228 11.313 5.520 1.00 0.00 N ATOM 1230 CA GLU B 7 -27.120 11.147 4.589 1.00 0.00 C ATOM 1231 C GLU B 7 -25.864 10.770 5.353 1.00 0.00 C ATOM 1232 O GLU B 7 -25.024 10.021 4.864 1.00 0.00 O ATOM 1233 CB GLU B 7 -26.879 12.426 3.789 1.00 0.00 C ATOM 1234 CG GLU B 7 -26.103 12.193 2.501 1.00 0.00 C ATOM 1235 CD GLU B 7 -25.808 13.470 1.740 1.00 0.00 C ATOM 1236 OE1 GLU B 7 -26.517 14.476 1.946 1.00 0.00 O ATOM 1237 OE2 GLU B 7 -24.867 13.469 0.914 1.00 0.00 O ATOM 0 H GLU B 7 -28.515 12.279 5.675 1.00 0.00 H new ATOM 0 HA GLU B 7 -27.374 10.352 3.889 1.00 0.00 H new ATOM 0 HB2 GLU B 7 -27.839 12.883 3.549 1.00 0.00 H new ATOM 0 HB3 GLU B 7 -26.334 13.137 4.410 1.00 0.00 H new ATOM 0 HG2 GLU B 7 -25.163 11.693 2.736 1.00 0.00 H new ATOM 0 HG3 GLU B 7 -26.671 11.519 1.860 1.00 0.00 H new ATOM 1244 N LEU B 8 -25.762 11.290 6.566 1.00 0.00 N ATOM 1245 CA LEU B 8 -24.651 11.002 7.450 1.00 0.00 C ATOM 1246 C LEU B 8 -24.546 9.498 7.688 1.00 0.00 C ATOM 1247 O LEU B 8 -23.462 8.924 7.637 1.00 0.00 O ATOM 1248 CB LEU B 8 -24.903 11.740 8.754 1.00 0.00 C ATOM 1249 CG LEU B 8 -23.687 12.316 9.457 1.00 0.00 C ATOM 1250 CD1 LEU B 8 -22.802 11.216 10.029 1.00 0.00 C ATOM 1251 CD2 LEU B 8 -22.899 13.213 8.512 1.00 0.00 C ATOM 0 H LEU B 8 -26.453 11.926 6.964 1.00 0.00 H new ATOM 0 HA LEU B 8 -23.709 11.330 7.010 1.00 0.00 H new ATOM 0 HB2 LEU B 8 -25.599 12.555 8.555 1.00 0.00 H new ATOM 0 HB3 LEU B 8 -25.401 11.056 9.441 1.00 0.00 H new ATOM 0 HG LEU B 8 -24.038 12.921 10.293 1.00 0.00 H new ATOM 0 HD11 LEU B 8 -21.941 11.663 10.525 1.00 0.00 H new ATOM 0 HD12 LEU B 8 -23.371 10.629 10.749 1.00 0.00 H new ATOM 0 HD13 LEU B 8 -22.460 10.568 9.222 1.00 0.00 H new ATOM 0 HD21 LEU B 8 -22.031 13.617 9.033 1.00 0.00 H new ATOM 0 HD22 LEU B 8 -22.568 12.632 7.651 1.00 0.00 H new ATOM 0 HD23 LEU B 8 -23.533 14.033 8.175 1.00 0.00 H new ATOM 1263 N LYS B 9 -25.693 8.878 7.927 1.00 0.00 N ATOM 1264 CA LYS B 9 -25.788 7.440 8.143 1.00 0.00 C ATOM 1265 C LYS B 9 -25.294 6.672 6.927 1.00 0.00 C ATOM 1266 O LYS B 9 -24.420 5.813 7.037 1.00 0.00 O ATOM 1267 CB LYS B 9 -27.247 7.077 8.433 1.00 0.00 C ATOM 1268 CG LYS B 9 -27.491 5.611 8.745 1.00 0.00 C ATOM 1269 CD LYS B 9 -28.978 5.335 8.883 1.00 0.00 C ATOM 1270 CE LYS B 9 -29.258 3.869 9.161 1.00 0.00 C ATOM 1271 NZ LYS B 9 -30.712 3.567 9.110 1.00 0.00 N ATOM 0 H LYS B 9 -26.590 9.361 7.977 1.00 0.00 H new ATOM 0 HA LYS B 9 -25.159 7.167 8.990 1.00 0.00 H new ATOM 0 HB2 LYS B 9 -27.595 7.675 9.275 1.00 0.00 H new ATOM 0 HB3 LYS B 9 -27.854 7.356 7.572 1.00 0.00 H new ATOM 0 HG2 LYS B 9 -27.072 4.990 7.953 1.00 0.00 H new ATOM 0 HG3 LYS B 9 -26.978 5.340 9.668 1.00 0.00 H new ATOM 0 HD2 LYS B 9 -29.387 5.942 9.691 1.00 0.00 H new ATOM 0 HD3 LYS B 9 -29.489 5.635 7.968 1.00 0.00 H new ATOM 0 HE2 LYS B 9 -28.733 3.254 8.431 1.00 0.00 H new ATOM 0 HE3 LYS B 9 -28.866 3.603 10.143 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 -30.864 2.557 9.305 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 -31.210 4.136 9.824 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 -31.081 3.797 8.165 1.00 0.00 H new ATOM 1285 N ALA B 10 -25.854 6.990 5.770 1.00 0.00 N ATOM 1286 CA ALA B 10 -25.473 6.325 4.531 1.00 0.00 C ATOM 1287 C ALA B 10 -23.991 6.536 4.230 1.00 0.00 C ATOM 1288 O ALA B 10 -23.297 5.618 3.796 1.00 0.00 O ATOM 1289 CB ALA B 10 -26.329 6.827 3.379 1.00 0.00 C ATOM 0 H ALA B 10 -26.574 7.704 5.662 1.00 0.00 H new ATOM 0 HA ALA B 10 -25.642 5.255 4.652 1.00 0.00 H new ATOM 0 HB1 ALA B 10 -26.034 6.322 2.459 1.00 0.00 H new ATOM 0 HB2 ALA B 10 -27.378 6.618 3.587 1.00 0.00 H new ATOM 0 HB3 ALA B 10 -26.189 7.902 3.263 1.00 0.00 H new ATOM 1295 N LYS B 11 -23.513 7.744 4.488 1.00 0.00 N ATOM 1296 CA LYS B 11 -22.130 8.097 4.206 1.00 0.00 C ATOM 1297 C LYS B 11 -21.179 7.411 5.184 1.00 0.00 C ATOM 1298 O LYS B 11 -20.148 6.872 4.781 1.00 0.00 O ATOM 1299 CB LYS B 11 -21.956 9.616 4.263 1.00 0.00 C ATOM 1300 CG LYS B 11 -20.765 10.132 3.473 1.00 0.00 C ATOM 1301 CD LYS B 11 -20.833 9.682 2.023 1.00 0.00 C ATOM 1302 CE LYS B 11 -19.846 10.439 1.150 1.00 0.00 C ATOM 1303 NZ LYS B 11 -20.254 11.855 0.952 1.00 0.00 N ATOM 0 H LYS B 11 -24.065 8.499 4.894 1.00 0.00 H new ATOM 0 HA LYS B 11 -21.884 7.750 3.202 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -22.862 10.090 3.885 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -21.848 9.920 5.304 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -20.739 11.221 3.518 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -19.841 9.772 3.926 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -20.625 8.614 1.964 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -21.844 9.832 1.643 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -18.857 10.407 1.608 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -19.765 9.946 0.181 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -19.702 12.270 0.175 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -21.266 11.895 0.717 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -20.080 12.392 1.826 1.00 0.00 H new ATOM 1317 N LEU B 12 -21.533 7.423 6.464 1.00 0.00 N ATOM 1318 CA LEU B 12 -20.728 6.764 7.487 1.00 0.00 C ATOM 1319 C LEU B 12 -20.673 5.265 7.225 1.00 0.00 C ATOM 1320 O LEU B 12 -19.618 4.643 7.353 1.00 0.00 O ATOM 1321 CB LEU B 12 -21.304 7.035 8.881 1.00 0.00 C ATOM 1322 CG LEU B 12 -20.522 6.422 10.045 1.00 0.00 C ATOM 1323 CD1 LEU B 12 -19.120 7.006 10.121 1.00 0.00 C ATOM 1324 CD2 LEU B 12 -21.263 6.642 11.354 1.00 0.00 C ATOM 0 H LEU B 12 -22.372 7.882 6.819 1.00 0.00 H new ATOM 0 HA LEU B 12 -19.716 7.168 7.446 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -21.358 8.113 9.030 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -22.326 6.657 8.913 1.00 0.00 H new ATOM 0 HG LEU B 12 -20.434 5.350 9.871 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -18.583 6.555 10.956 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -18.588 6.798 9.193 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -19.182 8.084 10.269 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -20.695 6.200 12.173 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -21.381 7.711 11.530 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -22.245 6.172 11.300 1.00 0.00 H new ATOM 1336 N LYS B 13 -21.814 4.697 6.852 1.00 0.00 N ATOM 1337 CA LYS B 13 -21.884 3.285 6.488 1.00 0.00 C ATOM 1338 C LYS B 13 -20.909 2.982 5.356 1.00 0.00 C ATOM 1339 O LYS B 13 -20.134 2.025 5.423 1.00 0.00 O ATOM 1340 CB LYS B 13 -23.308 2.917 6.060 1.00 0.00 C ATOM 1341 CG LYS B 13 -23.501 1.441 5.739 1.00 0.00 C ATOM 1342 CD LYS B 13 -23.078 0.553 6.898 1.00 0.00 C ATOM 1343 CE LYS B 13 -23.292 -0.919 6.582 1.00 0.00 C ATOM 1344 NZ LYS B 13 -22.680 -1.794 7.615 1.00 0.00 N ATOM 0 H LYS B 13 -22.704 5.192 6.793 1.00 0.00 H new ATOM 0 HA LYS B 13 -21.611 2.689 7.359 1.00 0.00 H new ATOM 0 HB2 LYS B 13 -23.998 3.198 6.855 1.00 0.00 H new ATOM 0 HB3 LYS B 13 -23.576 3.506 5.183 1.00 0.00 H new ATOM 0 HG2 LYS B 13 -24.548 1.254 5.501 1.00 0.00 H new ATOM 0 HG3 LYS B 13 -22.922 1.183 4.853 1.00 0.00 H new ATOM 0 HD2 LYS B 13 -22.027 0.728 7.126 1.00 0.00 H new ATOM 0 HD3 LYS B 13 -23.646 0.821 7.789 1.00 0.00 H new ATOM 0 HE2 LYS B 13 -24.360 -1.126 6.515 1.00 0.00 H new ATOM 0 HE3 LYS B 13 -22.861 -1.149 5.608 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 -22.845 -2.791 7.368 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 -21.657 -1.614 7.661 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 -23.109 -1.591 8.540 1.00 0.00 H new ATOM 1358 N LYS B 14 -20.963 3.818 4.327 1.00 0.00 N ATOM 1359 CA LYS B 14 -20.095 3.702 3.162 1.00 0.00 C ATOM 1360 C LYS B 14 -18.619 3.708 3.563 1.00 0.00 C ATOM 1361 O LYS B 14 -17.869 2.794 3.218 1.00 0.00 O ATOM 1362 CB LYS B 14 -20.377 4.866 2.210 1.00 0.00 C ATOM 1363 CG LYS B 14 -19.812 4.675 0.816 1.00 0.00 C ATOM 1364 CD LYS B 14 -20.509 3.539 0.090 1.00 0.00 C ATOM 1365 CE LYS B 14 -22.008 3.780 -0.025 1.00 0.00 C ATOM 1366 NZ LYS B 14 -22.680 2.726 -0.826 1.00 0.00 N ATOM 0 H LYS B 14 -21.615 4.601 4.277 1.00 0.00 H new ATOM 0 HA LYS B 14 -20.303 2.753 2.668 1.00 0.00 H new ATOM 0 HB2 LYS B 14 -21.455 5.009 2.137 1.00 0.00 H new ATOM 0 HB3 LYS B 14 -19.962 5.779 2.637 1.00 0.00 H new ATOM 0 HG2 LYS B 14 -19.925 5.597 0.246 1.00 0.00 H new ATOM 0 HG3 LYS B 14 -18.744 4.468 0.879 1.00 0.00 H new ATOM 0 HD2 LYS B 14 -20.081 3.427 -0.906 1.00 0.00 H new ATOM 0 HD3 LYS B 14 -20.330 2.604 0.621 1.00 0.00 H new ATOM 0 HE2 LYS B 14 -22.448 3.813 0.972 1.00 0.00 H new ATOM 0 HE3 LYS B 14 -22.185 4.753 -0.484 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 -23.699 2.928 -0.880 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 -22.279 2.710 -1.785 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 -22.534 1.801 -0.375 1.00 0.00 H new ATOM 1380 N LEU B 15 -18.217 4.737 4.302 1.00 0.00 N ATOM 1381 CA LEU B 15 -16.821 4.901 4.704 1.00 0.00 C ATOM 1382 C LEU B 15 -16.363 3.765 5.617 1.00 0.00 C ATOM 1383 O LEU B 15 -15.251 3.256 5.469 1.00 0.00 O ATOM 1384 CB LEU B 15 -16.613 6.254 5.396 1.00 0.00 C ATOM 1385 CG LEU B 15 -16.291 7.435 4.470 1.00 0.00 C ATOM 1386 CD1 LEU B 15 -15.011 7.167 3.693 1.00 0.00 C ATOM 1387 CD2 LEU B 15 -17.444 7.722 3.518 1.00 0.00 C ATOM 0 H LEU B 15 -18.839 5.473 4.636 1.00 0.00 H new ATOM 0 HA LEU B 15 -16.214 4.870 3.799 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -17.514 6.494 5.961 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -15.803 6.151 6.118 1.00 0.00 H new ATOM 0 HG LEU B 15 -16.144 8.318 5.092 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -14.797 8.014 3.041 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -14.185 7.028 4.390 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -15.133 6.267 3.090 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -17.185 8.564 2.876 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -17.636 6.842 2.904 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -18.338 7.966 4.092 1.00 0.00 H new ATOM 1399 N ASN B 16 -17.225 3.366 6.548 1.00 0.00 N ATOM 1400 CA ASN B 16 -16.913 2.273 7.473 1.00 0.00 C ATOM 1401 C ASN B 16 -16.665 0.983 6.692 1.00 0.00 C ATOM 1402 O ASN B 16 -15.684 0.273 6.933 1.00 0.00 O ATOM 1403 CB ASN B 16 -18.065 2.080 8.474 1.00 0.00 C ATOM 1404 CG ASN B 16 -17.740 1.117 9.610 1.00 0.00 C ATOM 1405 OD1 ASN B 16 -16.967 0.174 9.456 1.00 0.00 O ATOM 1406 ND2 ASN B 16 -18.341 1.353 10.768 1.00 0.00 N ATOM 0 H ASN B 16 -18.146 3.782 6.684 1.00 0.00 H new ATOM 0 HA ASN B 16 -16.010 2.526 8.028 1.00 0.00 H new ATOM 0 HB2 ASN B 16 -18.332 3.048 8.897 1.00 0.00 H new ATOM 0 HB3 ASN B 16 -18.941 1.713 7.939 1.00 0.00 H new ATOM 0 HD21 ASN B 16 -18.167 0.742 11.566 1.00 0.00 H new ATOM 0 HD22 ASN B 16 -18.977 2.145 10.860 1.00 0.00 H new ATOM 1413 N ALA B 17 -17.545 0.702 5.737 1.00 0.00 N ATOM 1414 CA ALA B 17 -17.430 -0.501 4.927 1.00 0.00 C ATOM 1415 C ALA B 17 -16.174 -0.461 4.065 1.00 0.00 C ATOM 1416 O ALA B 17 -15.448 -1.450 3.968 1.00 0.00 O ATOM 1417 CB ALA B 17 -18.665 -0.673 4.055 1.00 0.00 C ATOM 0 H ALA B 17 -18.345 1.292 5.506 1.00 0.00 H new ATOM 0 HA ALA B 17 -17.353 -1.356 5.599 1.00 0.00 H new ATOM 0 HB1 ALA B 17 -18.564 -1.577 3.455 1.00 0.00 H new ATOM 0 HB2 ALA B 17 -19.549 -0.754 4.688 1.00 0.00 H new ATOM 0 HB3 ALA B 17 -18.769 0.189 3.397 1.00 0.00 H new ATOM 1423 N GLN B 18 -15.923 0.692 3.452 1.00 0.00 N ATOM 1424 CA GLN B 18 -14.774 0.864 2.570 1.00 0.00 C ATOM 1425 C GLN B 18 -13.465 0.692 3.338 1.00 0.00 C ATOM 1426 O GLN B 18 -12.600 -0.090 2.940 1.00 0.00 O ATOM 1427 CB GLN B 18 -14.824 2.240 1.901 1.00 0.00 C ATOM 1428 CG GLN B 18 -13.667 2.509 0.954 1.00 0.00 C ATOM 1429 CD GLN B 18 -13.857 3.782 0.151 1.00 0.00 C ATOM 1430 OE1 GLN B 18 -13.446 4.867 0.564 1.00 0.00 O ATOM 1431 NE2 GLN B 18 -14.477 3.655 -1.013 1.00 0.00 N ATOM 0 H GLN B 18 -16.503 1.525 3.551 1.00 0.00 H new ATOM 0 HA GLN B 18 -14.816 0.095 1.799 1.00 0.00 H new ATOM 0 HB2 GLN B 18 -15.760 2.331 1.350 1.00 0.00 H new ATOM 0 HB3 GLN B 18 -14.834 3.008 2.674 1.00 0.00 H new ATOM 0 HG2 GLN B 18 -12.742 2.579 1.526 1.00 0.00 H new ATOM 0 HG3 GLN B 18 -13.557 1.666 0.272 1.00 0.00 H new ATOM 0 HE21 GLN B 18 -14.803 2.738 -1.320 1.00 0.00 H new ATOM 0 HE22 GLN B 18 -14.629 4.474 -1.602 1.00 0.00 H new ATOM 1440 N ALA B 19 -13.339 1.410 4.451 1.00 0.00 N ATOM 1441 CA ALA B 19 -12.134 1.357 5.274 1.00 0.00 C ATOM 1442 C ALA B 19 -11.846 -0.064 5.751 1.00 0.00 C ATOM 1443 O ALA B 19 -10.700 -0.515 5.741 1.00 0.00 O ATOM 1444 CB ALA B 19 -12.274 2.294 6.463 1.00 0.00 C ATOM 0 H ALA B 19 -14.060 2.038 4.805 1.00 0.00 H new ATOM 0 HA ALA B 19 -11.292 1.679 4.661 1.00 0.00 H new ATOM 0 HB1 ALA B 19 -11.371 2.248 7.071 1.00 0.00 H new ATOM 0 HB2 ALA B 19 -12.420 3.314 6.107 1.00 0.00 H new ATOM 0 HB3 ALA B 19 -13.132 1.993 7.064 1.00 0.00 H new ATOM 1450 N THR B 20 -12.894 -0.766 6.162 1.00 0.00 N ATOM 1451 CA THR B 20 -12.751 -2.132 6.645 1.00 0.00 C ATOM 1452 C THR B 20 -12.403 -3.094 5.504 1.00 0.00 C ATOM 1453 O THR B 20 -11.570 -3.991 5.669 1.00 0.00 O ATOM 1454 CB THR B 20 -14.039 -2.599 7.351 1.00 0.00 C ATOM 1455 OG1 THR B 20 -14.371 -1.684 8.406 1.00 0.00 O ATOM 1456 CG2 THR B 20 -13.870 -3.997 7.928 1.00 0.00 C ATOM 0 H THR B 20 -13.851 -0.412 6.170 1.00 0.00 H new ATOM 0 HA THR B 20 -11.931 -2.141 7.363 1.00 0.00 H new ATOM 0 HB THR B 20 -14.842 -2.623 6.615 1.00 0.00 H new ATOM 0 HG1 THR B 20 -14.851 -0.915 8.033 1.00 0.00 H new ATOM 0 HG21 THR B 20 -14.794 -4.302 8.420 1.00 0.00 H new ATOM 0 HG22 THR B 20 -13.639 -4.697 7.125 1.00 0.00 H new ATOM 0 HG23 THR B 20 -13.056 -3.995 8.653 1.00 0.00 H new ATOM 1464 N ALA B 21 -13.023 -2.888 4.346 1.00 0.00 N ATOM 1465 CA ALA B 21 -12.798 -3.750 3.191 1.00 0.00 C ATOM 1466 C ALA B 21 -11.367 -3.622 2.679 1.00 0.00 C ATOM 1467 O ALA B 21 -10.718 -4.624 2.374 1.00 0.00 O ATOM 1468 CB ALA B 21 -13.791 -3.426 2.088 1.00 0.00 C ATOM 0 H ALA B 21 -13.686 -2.130 4.183 1.00 0.00 H new ATOM 0 HA ALA B 21 -12.950 -4.783 3.505 1.00 0.00 H new ATOM 0 HB1 ALA B 21 -13.610 -4.077 1.233 1.00 0.00 H new ATOM 0 HB2 ALA B 21 -14.806 -3.581 2.455 1.00 0.00 H new ATOM 0 HB3 ALA B 21 -13.670 -2.386 1.784 1.00 0.00 H new ATOM 1474 N LEU B 22 -10.877 -2.388 2.606 1.00 0.00 N ATOM 1475 CA LEU B 22 -9.525 -2.124 2.120 1.00 0.00 C ATOM 1476 C LEU B 22 -8.475 -2.740 3.040 1.00 0.00 C ATOM 1477 O LEU B 22 -7.417 -3.163 2.580 1.00 0.00 O ATOM 1478 CB LEU B 22 -9.280 -0.618 1.966 1.00 0.00 C ATOM 1479 CG LEU B 22 -9.570 -0.041 0.573 1.00 0.00 C ATOM 1480 CD1 LEU B 22 -8.678 -0.694 -0.473 1.00 0.00 C ATOM 1481 CD2 LEU B 22 -11.038 -0.211 0.207 1.00 0.00 C ATOM 0 H LEU B 22 -11.396 -1.553 2.878 1.00 0.00 H new ATOM 0 HA LEU B 22 -9.434 -2.591 1.139 1.00 0.00 H new ATOM 0 HB2 LEU B 22 -9.896 -0.091 2.694 1.00 0.00 H new ATOM 0 HB3 LEU B 22 -8.240 -0.409 2.218 1.00 0.00 H new ATOM 0 HG LEU B 22 -9.350 1.026 0.597 1.00 0.00 H new ATOM 0 HD11 LEU B 22 -8.898 -0.272 -1.454 1.00 0.00 H new ATOM 0 HD12 LEU B 22 -7.632 -0.510 -0.225 1.00 0.00 H new ATOM 0 HD13 LEU B 22 -8.864 -1.768 -0.490 1.00 0.00 H new ATOM 0 HD21 LEU B 22 -11.217 0.206 -0.784 1.00 0.00 H new ATOM 0 HD22 LEU B 22 -11.292 -1.271 0.206 1.00 0.00 H new ATOM 0 HD23 LEU B 22 -11.658 0.310 0.937 1.00 0.00 H new ATOM 1493 N LYS B 23 -8.771 -2.794 4.332 1.00 0.00 N ATOM 1494 CA LYS B 23 -7.875 -3.437 5.287 1.00 0.00 C ATOM 1495 C LYS B 23 -7.711 -4.915 4.949 1.00 0.00 C ATOM 1496 O LYS B 23 -6.595 -5.438 4.895 1.00 0.00 O ATOM 1497 CB LYS B 23 -8.405 -3.297 6.715 1.00 0.00 C ATOM 1498 CG LYS B 23 -7.543 -4.016 7.739 1.00 0.00 C ATOM 1499 CD LYS B 23 -8.107 -3.917 9.145 1.00 0.00 C ATOM 1500 CE LYS B 23 -7.214 -4.650 10.139 1.00 0.00 C ATOM 1501 NZ LYS B 23 -7.782 -4.657 11.512 1.00 0.00 N ATOM 0 H LYS B 23 -9.619 -2.403 4.742 1.00 0.00 H new ATOM 0 HA LYS B 23 -6.907 -2.941 5.222 1.00 0.00 H new ATOM 0 HB2 LYS B 23 -8.462 -2.240 6.974 1.00 0.00 H new ATOM 0 HB3 LYS B 23 -9.420 -3.692 6.761 1.00 0.00 H new ATOM 0 HG2 LYS B 23 -7.453 -5.066 7.460 1.00 0.00 H new ATOM 0 HG3 LYS B 23 -6.538 -3.594 7.724 1.00 0.00 H new ATOM 0 HD2 LYS B 23 -8.196 -2.870 9.433 1.00 0.00 H new ATOM 0 HD3 LYS B 23 -9.111 -4.341 9.170 1.00 0.00 H new ATOM 0 HE2 LYS B 23 -7.068 -5.677 9.804 1.00 0.00 H new ATOM 0 HE3 LYS B 23 -6.232 -4.178 10.157 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 -7.139 -5.167 12.151 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 -7.897 -3.679 11.845 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 -8.708 -5.131 11.502 1.00 0.00 H new ATOM 1515 N MET B 24 -8.837 -5.576 4.713 1.00 0.00 N ATOM 1516 CA MET B 24 -8.848 -7.006 4.427 1.00 0.00 C ATOM 1517 C MET B 24 -8.171 -7.296 3.097 1.00 0.00 C ATOM 1518 O MET B 24 -7.451 -8.287 2.957 1.00 0.00 O ATOM 1519 CB MET B 24 -10.286 -7.529 4.401 1.00 0.00 C ATOM 1520 CG MET B 24 -11.041 -7.294 5.699 1.00 0.00 C ATOM 1521 SD MET B 24 -12.763 -7.820 5.611 1.00 0.00 S ATOM 1522 CE MET B 24 -12.562 -9.559 5.235 1.00 0.00 C ATOM 0 H MET B 24 -9.760 -5.142 4.714 1.00 0.00 H new ATOM 0 HA MET B 24 -8.295 -7.515 5.217 1.00 0.00 H new ATOM 0 HB2 MET B 24 -10.824 -7.048 3.585 1.00 0.00 H new ATOM 0 HB3 MET B 24 -10.272 -8.598 4.187 1.00 0.00 H new ATOM 0 HG2 MET B 24 -10.543 -7.831 6.506 1.00 0.00 H new ATOM 0 HG3 MET B 24 -11.002 -6.234 5.950 1.00 0.00 H new ATOM 0 HE1 MET B 24 -13.349 -10.131 5.726 1.00 0.00 H new ATOM 0 HE2 MET B 24 -12.624 -9.708 4.157 1.00 0.00 H new ATOM 0 HE3 MET B 24 -11.590 -9.899 5.592 1.00 0.00 H new ATOM 1532 N ASP B 25 -8.392 -6.419 2.128 1.00 0.00 N ATOM 1533 CA ASP B 25 -7.832 -6.589 0.792 1.00 0.00 C ATOM 1534 C ASP B 25 -6.318 -6.390 0.818 1.00 0.00 C ATOM 1535 O ASP B 25 -5.571 -7.132 0.179 1.00 0.00 O ATOM 1536 CB ASP B 25 -8.479 -5.599 -0.183 1.00 0.00 C ATOM 1537 CG ASP B 25 -8.320 -6.011 -1.632 1.00 0.00 C ATOM 1538 OD1 ASP B 25 -9.188 -6.757 -2.137 1.00 0.00 O ATOM 1539 OD2 ASP B 25 -7.344 -5.583 -2.283 1.00 0.00 O ATOM 0 H ASP B 25 -8.958 -5.578 2.242 1.00 0.00 H new ATOM 0 HA ASP B 25 -8.043 -7.604 0.455 1.00 0.00 H new ATOM 0 HB2 ASP B 25 -9.540 -5.508 0.050 1.00 0.00 H new ATOM 0 HB3 ASP B 25 -8.036 -4.613 -0.040 1.00 0.00 H new ATOM 1544 N LEU B 26 -5.877 -5.401 1.591 1.00 0.00 N ATOM 1545 CA LEU B 26 -4.460 -5.073 1.697 1.00 0.00 C ATOM 1546 C LEU B 26 -3.662 -6.235 2.286 1.00 0.00 C ATOM 1547 O LEU B 26 -2.665 -6.667 1.704 1.00 0.00 O ATOM 1548 CB LEU B 26 -4.265 -3.817 2.554 1.00 0.00 C ATOM 1549 CG LEU B 26 -2.817 -3.349 2.707 1.00 0.00 C ATOM 1550 CD1 LEU B 26 -2.223 -2.984 1.356 1.00 0.00 C ATOM 1551 CD2 LEU B 26 -2.740 -2.168 3.659 1.00 0.00 C ATOM 0 H LEU B 26 -6.486 -4.810 2.156 1.00 0.00 H new ATOM 0 HA LEU B 26 -4.088 -4.881 0.691 1.00 0.00 H new ATOM 0 HB2 LEU B 26 -4.848 -3.006 2.118 1.00 0.00 H new ATOM 0 HB3 LEU B 26 -4.675 -4.007 3.546 1.00 0.00 H new ATOM 0 HG LEU B 26 -2.234 -4.170 3.124 1.00 0.00 H new ATOM 0 HD11 LEU B 26 -1.193 -2.654 1.489 1.00 0.00 H new ATOM 0 HD12 LEU B 26 -2.243 -3.856 0.702 1.00 0.00 H new ATOM 0 HD13 LEU B 26 -2.807 -2.180 0.907 1.00 0.00 H new ATOM 0 HD21 LEU B 26 -1.703 -1.847 3.757 1.00 0.00 H new ATOM 0 HD22 LEU B 26 -3.339 -1.346 3.268 1.00 0.00 H new ATOM 0 HD23 LEU B 26 -3.123 -2.463 4.636 1.00 0.00 H new ATOM 1563 N HIS B 27 -4.105 -6.750 3.435 1.00 0.00 N ATOM 1564 CA HIS B 27 -3.385 -7.839 4.100 1.00 0.00 C ATOM 1565 C HIS B 27 -3.352 -9.089 3.226 1.00 0.00 C ATOM 1566 O HIS B 27 -2.354 -9.807 3.206 1.00 0.00 O ATOM 1567 CB HIS B 27 -3.997 -8.173 5.471 1.00 0.00 C ATOM 1568 CG HIS B 27 -3.347 -9.353 6.141 1.00 0.00 C ATOM 1569 ND1 HIS B 27 -4.057 -10.410 6.653 1.00 0.00 N ATOM 1570 CD2 HIS B 27 -2.038 -9.655 6.337 1.00 0.00 C ATOM 1571 CE1 HIS B 27 -3.222 -11.311 7.133 1.00 0.00 C ATOM 1572 NE2 HIS B 27 -1.985 -10.883 6.953 1.00 0.00 N ATOM 0 H HIS B 27 -4.946 -6.436 3.919 1.00 0.00 H new ATOM 0 HA HIS B 27 -2.363 -7.494 4.259 1.00 0.00 H new ATOM 0 HB2 HIS B 27 -3.912 -7.302 6.121 1.00 0.00 H new ATOM 0 HB3 HIS B 27 -5.061 -8.375 5.347 1.00 0.00 H new ATOM 0 HD2 HIS B 27 -1.193 -9.043 6.060 1.00 0.00 H new ATOM 0 HE1 HIS B 27 -3.503 -12.245 7.597 1.00 0.00 H new ATOM 0 HE2 HIS B 27 -1.136 -11.379 7.225 1.00 0.00 H new ATOM 1581 N ASP B 28 -4.431 -9.335 2.500 1.00 0.00 N ATOM 1582 CA ASP B 28 -4.510 -10.501 1.628 1.00 0.00 C ATOM 1583 C ASP B 28 -3.449 -10.417 0.535 1.00 0.00 C ATOM 1584 O ASP B 28 -2.728 -11.381 0.281 1.00 0.00 O ATOM 1585 CB ASP B 28 -5.903 -10.617 1.008 1.00 0.00 C ATOM 1586 CG ASP B 28 -6.017 -11.799 0.068 1.00 0.00 C ATOM 1587 OD1 ASP B 28 -6.058 -12.950 0.553 1.00 0.00 O ATOM 1588 OD2 ASP B 28 -6.064 -11.581 -1.159 1.00 0.00 O ATOM 0 H ASP B 28 -5.264 -8.746 2.496 1.00 0.00 H new ATOM 0 HA ASP B 28 -4.325 -11.392 2.228 1.00 0.00 H new ATOM 0 HB2 ASP B 28 -6.644 -10.714 1.801 1.00 0.00 H new ATOM 0 HB3 ASP B 28 -6.134 -9.700 0.465 1.00 0.00 H new ATOM 1593 N LEU B 29 -3.330 -9.244 -0.079 1.00 0.00 N ATOM 1594 CA LEU B 29 -2.341 -9.020 -1.131 1.00 0.00 C ATOM 1595 C LEU B 29 -0.921 -9.049 -0.562 1.00 0.00 C ATOM 1596 O LEU B 29 0.014 -9.510 -1.220 1.00 0.00 O ATOM 1597 CB LEU B 29 -2.604 -7.680 -1.825 1.00 0.00 C ATOM 1598 CG LEU B 29 -1.695 -7.373 -3.015 1.00 0.00 C ATOM 1599 CD1 LEU B 29 -1.903 -8.393 -4.126 1.00 0.00 C ATOM 1600 CD2 LEU B 29 -1.949 -5.966 -3.523 1.00 0.00 C ATOM 0 H LEU B 29 -3.908 -8.431 0.134 1.00 0.00 H new ATOM 0 HA LEU B 29 -2.432 -9.824 -1.862 1.00 0.00 H new ATOM 0 HB2 LEU B 29 -3.639 -7.663 -2.165 1.00 0.00 H new ATOM 0 HB3 LEU B 29 -2.496 -6.882 -1.091 1.00 0.00 H new ATOM 0 HG LEU B 29 -0.658 -7.438 -2.685 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -1.247 -8.157 -4.964 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -1.670 -9.390 -3.753 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -2.941 -8.363 -4.458 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -1.295 -5.761 -4.370 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -2.989 -5.875 -3.837 1.00 0.00 H new ATOM 0 HD23 LEU B 29 -1.746 -5.250 -2.727 1.00 0.00 H new ATOM 1612 N ALA B 30 -0.773 -8.564 0.667 1.00 0.00 N ATOM 1613 CA ALA B 30 0.533 -8.502 1.319 1.00 0.00 C ATOM 1614 C ALA B 30 0.995 -9.878 1.797 1.00 0.00 C ATOM 1615 O ALA B 30 2.193 -10.133 1.923 1.00 0.00 O ATOM 1616 CB ALA B 30 0.495 -7.529 2.489 1.00 0.00 C ATOM 0 H ALA B 30 -1.543 -8.207 1.233 1.00 0.00 H new ATOM 0 HA ALA B 30 1.251 -8.148 0.579 1.00 0.00 H new ATOM 0 HB1 ALA B 30 1.475 -7.494 2.965 1.00 0.00 H new ATOM 0 HB2 ALA B 30 0.231 -6.535 2.127 1.00 0.00 H new ATOM 0 HB3 ALA B 30 -0.248 -7.861 3.214 1.00 0.00 H new ATOM 1622 N GLU B 31 0.049 -10.763 2.076 1.00 0.00 N ATOM 1623 CA GLU B 31 0.378 -12.104 2.537 1.00 0.00 C ATOM 1624 C GLU B 31 0.769 -12.978 1.345 1.00 0.00 C ATOM 1625 O GLU B 31 1.543 -13.927 1.475 1.00 0.00 O ATOM 1626 CB GLU B 31 -0.818 -12.714 3.275 1.00 0.00 C ATOM 1627 CG GLU B 31 -0.456 -13.850 4.219 1.00 0.00 C ATOM 1628 CD GLU B 31 0.442 -13.398 5.357 1.00 0.00 C ATOM 1629 OE1 GLU B 31 -0.020 -12.610 6.215 1.00 0.00 O ATOM 1630 OE2 GLU B 31 1.617 -13.826 5.406 1.00 0.00 O ATOM 0 H GLU B 31 -0.950 -10.577 1.991 1.00 0.00 H new ATOM 0 HA GLU B 31 1.220 -12.049 3.227 1.00 0.00 H new ATOM 0 HB2 GLU B 31 -1.318 -11.930 3.843 1.00 0.00 H new ATOM 0 HB3 GLU B 31 -1.535 -13.082 2.541 1.00 0.00 H new ATOM 0 HG2 GLU B 31 -1.369 -14.281 4.630 1.00 0.00 H new ATOM 0 HG3 GLU B 31 0.044 -14.639 3.657 1.00 0.00 H new ATOM 1637 N ASP B 32 0.241 -12.626 0.179 1.00 0.00 N ATOM 1638 CA ASP B 32 0.490 -13.371 -1.051 1.00 0.00 C ATOM 1639 C ASP B 32 1.424 -12.578 -1.969 1.00 0.00 C ATOM 1640 O ASP B 32 1.376 -12.709 -3.193 1.00 0.00 O ATOM 1641 CB ASP B 32 -0.830 -13.677 -1.765 1.00 0.00 C ATOM 1642 CG ASP B 32 -0.730 -14.887 -2.677 1.00 0.00 C ATOM 1643 OD1 ASP B 32 -0.864 -16.026 -2.177 1.00 0.00 O ATOM 1644 OD2 ASP B 32 -0.520 -14.716 -3.893 1.00 0.00 O ATOM 0 H ASP B 32 -0.370 -11.818 0.058 1.00 0.00 H new ATOM 0 HA ASP B 32 0.971 -14.315 -0.797 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -1.610 -13.849 -1.023 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -1.133 -12.809 -2.350 1.00 0.00 H new ATOM 1649 N LEU B 33 2.249 -11.727 -1.353 1.00 0.00 N ATOM 1650 CA LEU B 33 3.204 -10.866 -2.063 1.00 0.00 C ATOM 1651 C LEU B 33 3.986 -11.595 -3.159 1.00 0.00 C ATOM 1652 O LEU B 33 4.058 -12.822 -3.177 1.00 0.00 O ATOM 1653 CB LEU B 33 4.116 -10.147 -1.067 1.00 0.00 C ATOM 1654 CG LEU B 33 3.521 -8.856 -0.494 1.00 0.00 C ATOM 1655 CD1 LEU B 33 4.552 -8.097 0.325 1.00 0.00 C ATOM 1656 CD2 LEU B 33 2.980 -7.981 -1.617 1.00 0.00 C ATOM 0 H LEU B 33 2.275 -11.614 -0.340 1.00 0.00 H new ATOM 0 HA LEU B 33 2.623 -10.113 -2.595 1.00 0.00 H new ATOM 0 HB2 LEU B 33 4.345 -10.825 -0.245 1.00 0.00 H new ATOM 0 HB3 LEU B 33 5.060 -9.912 -1.559 1.00 0.00 H new ATOM 0 HG LEU B 33 2.698 -9.124 0.168 1.00 0.00 H new ATOM 0 HD11 LEU B 33 4.104 -7.185 0.720 1.00 0.00 H new ATOM 0 HD12 LEU B 33 4.892 -8.722 1.151 1.00 0.00 H new ATOM 0 HD13 LEU B 33 5.401 -7.839 -0.308 1.00 0.00 H new ATOM 0 HD21 LEU B 33 2.560 -7.067 -1.196 1.00 0.00 H new ATOM 0 HD22 LEU B 33 3.789 -7.727 -2.302 1.00 0.00 H new ATOM 0 HD23 LEU B 33 2.203 -8.522 -2.158 1.00 0.00 H new ATOM 1668 N PRO B 34 4.702 -10.816 -4.000 1.00 0.00 N ATOM 1669 CA PRO B 34 4.737 -10.956 -5.432 1.00 0.00 C ATOM 1670 C PRO B 34 3.876 -12.070 -6.010 1.00 0.00 C ATOM 1671 O PRO B 34 4.058 -13.258 -5.752 1.00 0.00 O ATOM 1672 CB PRO B 34 6.228 -11.162 -5.641 1.00 0.00 C ATOM 1673 CG PRO B 34 6.851 -10.249 -4.614 1.00 0.00 C ATOM 1674 CD PRO B 34 5.744 -9.858 -3.644 1.00 0.00 C ATOM 0 HA PRO B 34 4.305 -10.105 -5.959 1.00 0.00 H new ATOM 0 HB2 PRO B 34 6.517 -12.201 -5.483 1.00 0.00 H new ATOM 0 HB3 PRO B 34 6.533 -10.896 -6.653 1.00 0.00 H new ATOM 0 HG2 PRO B 34 7.663 -10.753 -4.091 1.00 0.00 H new ATOM 0 HG3 PRO B 34 7.278 -9.366 -5.090 1.00 0.00 H new ATOM 0 HD2 PRO B 34 6.055 -9.956 -2.604 1.00 0.00 H new ATOM 0 HD3 PRO B 34 5.420 -8.827 -3.784 1.00 0.00 H new ATOM 1682 N THR B 35 3.009 -11.596 -6.890 1.00 0.00 N ATOM 1683 CA THR B 35 2.041 -12.361 -7.674 1.00 0.00 C ATOM 1684 C THR B 35 1.080 -11.337 -8.274 1.00 0.00 C ATOM 1685 O THR B 35 0.740 -11.383 -9.457 1.00 0.00 O ATOM 1686 CB THR B 35 1.245 -13.408 -6.843 1.00 0.00 C ATOM 1687 OG1 THR B 35 2.069 -14.548 -6.565 1.00 0.00 O ATOM 1688 CG2 THR B 35 -0.012 -13.867 -7.576 1.00 0.00 C ATOM 0 H THR B 35 2.956 -10.598 -7.093 1.00 0.00 H new ATOM 0 HA THR B 35 2.574 -12.941 -8.428 1.00 0.00 H new ATOM 0 HB THR B 35 0.947 -12.928 -5.911 1.00 0.00 H new ATOM 0 HG1 THR B 35 2.997 -14.258 -6.438 1.00 0.00 H new ATOM 0 HG21 THR B 35 -0.543 -14.598 -6.966 1.00 0.00 H new ATOM 0 HG22 THR B 35 -0.659 -13.010 -7.760 1.00 0.00 H new ATOM 0 HG23 THR B 35 0.267 -14.322 -8.526 1.00 0.00 H new ATOM 1696 N GLY B 36 0.696 -10.383 -7.430 1.00 0.00 N ATOM 1697 CA GLY B 36 -0.065 -9.228 -7.864 1.00 0.00 C ATOM 1698 C GLY B 36 0.504 -7.957 -7.259 1.00 0.00 C ATOM 1699 O GLY B 36 -0.223 -7.013 -6.955 1.00 0.00 O ATOM 0 H GLY B 36 0.905 -10.394 -6.432 1.00 0.00 H new ATOM 0 HA2 GLY B 36 -0.045 -9.160 -8.952 1.00 0.00 H new ATOM 0 HA3 GLY B 36 -1.109 -9.342 -7.571 1.00 0.00 H new ATOM 1703 N TRP B 37 1.826 -7.955 -7.087 1.00 0.00 N ATOM 1704 CA TRP B 37 2.549 -6.872 -6.426 1.00 0.00 C ATOM 1705 C TRP B 37 2.469 -5.562 -7.206 1.00 0.00 C ATOM 1706 O TRP B 37 2.775 -4.495 -6.674 1.00 0.00 O ATOM 1707 CB TRP B 37 4.017 -7.275 -6.219 1.00 0.00 C ATOM 1708 CG TRP B 37 4.755 -7.573 -7.495 1.00 0.00 C ATOM 1709 CD1 TRP B 37 4.792 -8.761 -8.169 1.00 0.00 C ATOM 1710 CD2 TRP B 37 5.571 -6.664 -8.242 1.00 0.00 C ATOM 1711 NE1 TRP B 37 5.577 -8.642 -9.289 1.00 0.00 N ATOM 1712 CE2 TRP B 37 6.065 -7.366 -9.356 1.00 0.00 C ATOM 1713 CE3 TRP B 37 5.929 -5.325 -8.081 1.00 0.00 C ATOM 1714 CZ2 TRP B 37 6.898 -6.774 -10.302 1.00 0.00 C ATOM 1715 CZ3 TRP B 37 6.756 -4.739 -9.019 1.00 0.00 C ATOM 1716 CH2 TRP B 37 7.232 -5.462 -10.117 1.00 0.00 C ATOM 0 H TRP B 37 2.429 -8.713 -7.406 1.00 0.00 H new ATOM 0 HA TRP B 37 2.073 -6.702 -5.460 1.00 0.00 H new ATOM 0 HB2 TRP B 37 4.533 -6.472 -5.692 1.00 0.00 H new ATOM 0 HB3 TRP B 37 4.055 -8.154 -5.576 1.00 0.00 H new ATOM 0 HD1 TRP B 37 4.279 -9.662 -7.865 1.00 0.00 H new ATOM 0 HE1 TRP B 37 5.766 -9.385 -9.962 1.00 0.00 H new ATOM 0 HE3 TRP B 37 5.566 -4.757 -7.237 1.00 0.00 H new ATOM 0 HZ2 TRP B 37 7.266 -7.331 -11.151 1.00 0.00 H new ATOM 0 HZ3 TRP B 37 7.040 -3.704 -8.902 1.00 0.00 H new ATOM 0 HH2 TRP B 37 7.876 -4.974 -10.833 1.00 0.00 H new ATOM 1727 N ASN B 38 2.047 -5.640 -8.458 1.00 0.00 N ATOM 1728 CA ASN B 38 1.888 -4.447 -9.281 1.00 0.00 C ATOM 1729 C ASN B 38 0.802 -3.546 -8.697 1.00 0.00 C ATOM 1730 O ASN B 38 0.801 -2.333 -8.899 1.00 0.00 O ATOM 1731 CB ASN B 38 1.525 -4.842 -10.715 1.00 0.00 C ATOM 1732 CG ASN B 38 1.391 -3.654 -11.654 1.00 0.00 C ATOM 1733 OD1 ASN B 38 2.109 -2.657 -11.535 1.00 0.00 O ATOM 1734 ND2 ASN B 38 0.457 -3.753 -12.587 1.00 0.00 N ATOM 0 H ASN B 38 1.808 -6.514 -8.928 1.00 0.00 H new ATOM 0 HA ASN B 38 2.831 -3.901 -9.293 1.00 0.00 H new ATOM 0 HB2 ASN B 38 2.288 -5.517 -11.102 1.00 0.00 H new ATOM 0 HB3 ASN B 38 0.586 -5.395 -10.705 1.00 0.00 H new ATOM 0 HD21 ASN B 38 0.309 -2.987 -13.243 1.00 0.00 H new ATOM 0 HD22 ASN B 38 -0.114 -4.596 -12.649 1.00 0.00 H new ATOM 1741 N ARG B 39 -0.101 -4.148 -7.931 1.00 0.00 N ATOM 1742 CA ARG B 39 -1.255 -3.431 -7.409 1.00 0.00 C ATOM 1743 C ARG B 39 -1.053 -3.037 -5.944 1.00 0.00 C ATOM 1744 O ARG B 39 -1.953 -2.468 -5.323 1.00 0.00 O ATOM 1745 CB ARG B 39 -2.517 -4.283 -7.568 1.00 0.00 C ATOM 1746 CG ARG B 39 -3.799 -3.468 -7.565 1.00 0.00 C ATOM 1747 CD ARG B 39 -5.024 -4.339 -7.788 1.00 0.00 C ATOM 1748 NE ARG B 39 -6.230 -3.536 -7.986 1.00 0.00 N ATOM 1749 CZ ARG B 39 -7.467 -4.028 -7.979 1.00 0.00 C ATOM 1750 NH1 ARG B 39 -7.680 -5.315 -7.731 1.00 0.00 N ATOM 1751 NH2 ARG B 39 -8.496 -3.221 -8.210 1.00 0.00 N ATOM 0 H ARG B 39 -0.055 -5.130 -7.659 1.00 0.00 H new ATOM 0 HA ARG B 39 -1.372 -2.512 -7.983 1.00 0.00 H new ATOM 0 HB2 ARG B 39 -2.453 -4.843 -8.501 1.00 0.00 H new ATOM 0 HB3 ARG B 39 -2.558 -5.013 -6.760 1.00 0.00 H new ATOM 0 HG2 ARG B 39 -3.894 -2.944 -6.614 1.00 0.00 H new ATOM 0 HG3 ARG B 39 -3.748 -2.707 -8.344 1.00 0.00 H new ATOM 0 HD2 ARG B 39 -4.864 -4.976 -8.658 1.00 0.00 H new ATOM 0 HD3 ARG B 39 -5.162 -4.998 -6.931 1.00 0.00 H new ATOM 0 HE ARG B 39 -6.116 -2.534 -8.139 1.00 0.00 H new ATOM 0 HH11 ARG B 39 -6.892 -5.935 -7.544 1.00 0.00 H new ATOM 0 HH12 ARG B 39 -8.631 -5.683 -7.728 1.00 0.00 H new ATOM 0 HH21 ARG B 39 -8.336 -2.230 -8.392 1.00 0.00 H new ATOM 0 HH22 ARG B 39 -9.446 -3.592 -8.206 1.00 0.00 H new ATOM 1765 N ILE B 40 0.133 -3.320 -5.403 1.00 0.00 N ATOM 1766 CA ILE B 40 0.432 -3.025 -3.996 1.00 0.00 C ATOM 1767 C ILE B 40 0.143 -1.563 -3.662 1.00 0.00 C ATOM 1768 O ILE B 40 -0.586 -1.267 -2.714 1.00 0.00 O ATOM 1769 CB ILE B 40 1.912 -3.323 -3.647 1.00 0.00 C ATOM 1770 CG1 ILE B 40 2.175 -4.826 -3.636 1.00 0.00 C ATOM 1771 CG2 ILE B 40 2.290 -2.715 -2.299 1.00 0.00 C ATOM 1772 CD1 ILE B 40 3.635 -5.173 -3.431 1.00 0.00 C ATOM 0 H ILE B 40 0.902 -3.752 -5.914 1.00 0.00 H new ATOM 0 HA ILE B 40 -0.214 -3.674 -3.405 1.00 0.00 H new ATOM 0 HB ILE B 40 2.532 -2.866 -4.418 1.00 0.00 H new ATOM 0 HG12 ILE B 40 1.584 -5.286 -2.844 1.00 0.00 H new ATOM 0 HG13 ILE B 40 1.835 -5.255 -4.578 1.00 0.00 H new ATOM 0 HG21 ILE B 40 3.334 -2.939 -2.079 1.00 0.00 H new ATOM 0 HG22 ILE B 40 2.151 -1.635 -2.335 1.00 0.00 H new ATOM 0 HG23 ILE B 40 1.656 -3.137 -1.519 1.00 0.00 H new ATOM 0 HD11 ILE B 40 3.755 -6.256 -3.433 1.00 0.00 H new ATOM 0 HD12 ILE B 40 4.228 -4.740 -4.237 1.00 0.00 H new ATOM 0 HD13 ILE B 40 3.974 -4.772 -2.476 1.00 0.00 H new ATOM 1784 N MET B 41 0.700 -0.658 -4.460 1.00 0.00 N ATOM 1785 CA MET B 41 0.562 0.769 -4.203 1.00 0.00 C ATOM 1786 C MET B 41 -0.897 1.196 -4.305 1.00 0.00 C ATOM 1787 O MET B 41 -1.406 1.883 -3.428 1.00 0.00 O ATOM 1788 CB MET B 41 1.423 1.578 -5.177 1.00 0.00 C ATOM 1789 CG MET B 41 1.365 3.083 -4.942 1.00 0.00 C ATOM 1790 SD MET B 41 2.459 4.008 -6.035 1.00 0.00 S ATOM 1791 CE MET B 41 4.061 3.408 -5.505 1.00 0.00 C ATOM 0 H MET B 41 1.250 -0.888 -5.288 1.00 0.00 H new ATOM 0 HA MET B 41 0.909 0.966 -3.189 1.00 0.00 H new ATOM 0 HB2 MET B 41 2.458 1.246 -5.095 1.00 0.00 H new ATOM 0 HB3 MET B 41 1.100 1.366 -6.196 1.00 0.00 H new ATOM 0 HG2 MET B 41 0.341 3.428 -5.084 1.00 0.00 H new ATOM 0 HG3 MET B 41 1.631 3.294 -3.906 1.00 0.00 H new ATOM 0 HE1 MET B 41 4.726 4.253 -5.329 1.00 0.00 H new ATOM 0 HE2 MET B 41 3.949 2.837 -4.583 1.00 0.00 H new ATOM 0 HE3 MET B 41 4.484 2.768 -6.279 1.00 0.00 H new ATOM 1801 N GLU B 42 -1.566 0.745 -5.358 1.00 0.00 N ATOM 1802 CA GLU B 42 -2.950 1.120 -5.619 1.00 0.00 C ATOM 1803 C GLU B 42 -3.850 0.762 -4.445 1.00 0.00 C ATOM 1804 O GLU B 42 -4.636 1.586 -3.979 1.00 0.00 O ATOM 1805 CB GLU B 42 -3.456 0.409 -6.869 1.00 0.00 C ATOM 1806 CG GLU B 42 -4.801 0.921 -7.345 1.00 0.00 C ATOM 1807 CD GLU B 42 -5.354 0.125 -8.503 1.00 0.00 C ATOM 1808 OE1 GLU B 42 -6.057 -0.874 -8.254 1.00 0.00 O ATOM 1809 OE2 GLU B 42 -5.100 0.507 -9.662 1.00 0.00 O ATOM 0 H GLU B 42 -1.168 0.112 -6.052 1.00 0.00 H new ATOM 0 HA GLU B 42 -2.980 2.200 -5.766 1.00 0.00 H new ATOM 0 HB2 GLU B 42 -2.725 0.530 -7.669 1.00 0.00 H new ATOM 0 HB3 GLU B 42 -3.533 -0.659 -6.666 1.00 0.00 H new ATOM 0 HG2 GLU B 42 -5.510 0.890 -6.518 1.00 0.00 H new ATOM 0 HG3 GLU B 42 -4.703 1.965 -7.642 1.00 0.00 H new ATOM 1816 N VAL B 43 -3.745 -0.476 -3.993 1.00 0.00 N ATOM 1817 CA VAL B 43 -4.532 -0.940 -2.856 1.00 0.00 C ATOM 1818 C VAL B 43 -4.212 -0.113 -1.615 1.00 0.00 C ATOM 1819 O VAL B 43 -5.113 0.419 -0.967 1.00 0.00 O ATOM 1820 CB VAL B 43 -4.290 -2.436 -2.560 1.00 0.00 C ATOM 1821 CG1 VAL B 43 -5.099 -2.889 -1.350 1.00 0.00 C ATOM 1822 CG2 VAL B 43 -4.640 -3.287 -3.773 1.00 0.00 C ATOM 0 H VAL B 43 -3.124 -1.179 -4.393 1.00 0.00 H new ATOM 0 HA VAL B 43 -5.583 -0.814 -3.118 1.00 0.00 H new ATOM 0 HB VAL B 43 -3.231 -2.566 -2.335 1.00 0.00 H new ATOM 0 HG11 VAL B 43 -4.911 -3.946 -1.162 1.00 0.00 H new ATOM 0 HG12 VAL B 43 -4.804 -2.307 -0.477 1.00 0.00 H new ATOM 0 HG13 VAL B 43 -6.161 -2.738 -1.545 1.00 0.00 H new ATOM 0 HG21 VAL B 43 -4.462 -4.338 -3.544 1.00 0.00 H new ATOM 0 HG22 VAL B 43 -5.690 -3.143 -4.027 1.00 0.00 H new ATOM 0 HG23 VAL B 43 -4.018 -2.990 -4.618 1.00 0.00 H new ATOM 1832 N ALA B 44 -2.925 0.023 -1.314 1.00 0.00 N ATOM 1833 CA ALA B 44 -2.486 0.775 -0.144 1.00 0.00 C ATOM 1834 C ALA B 44 -2.954 2.228 -0.207 1.00 0.00 C ATOM 1835 O ALA B 44 -3.295 2.823 0.818 1.00 0.00 O ATOM 1836 CB ALA B 44 -0.976 0.713 -0.022 1.00 0.00 C ATOM 0 H ALA B 44 -2.166 -0.378 -1.865 1.00 0.00 H new ATOM 0 HA ALA B 44 -2.935 0.319 0.738 1.00 0.00 H new ATOM 0 HB1 ALA B 44 -0.658 1.278 0.855 1.00 0.00 H new ATOM 0 HB2 ALA B 44 -0.662 -0.326 0.082 1.00 0.00 H new ATOM 0 HB3 ALA B 44 -0.521 1.142 -0.915 1.00 0.00 H new ATOM 1842 N GLU B 45 -2.964 2.794 -1.412 1.00 0.00 N ATOM 1843 CA GLU B 45 -3.474 4.134 -1.634 1.00 0.00 C ATOM 1844 C GLU B 45 -4.900 4.262 -1.125 1.00 0.00 C ATOM 1845 O GLU B 45 -5.191 5.110 -0.289 1.00 0.00 O ATOM 1846 CB GLU B 45 -3.437 4.466 -3.123 1.00 0.00 C ATOM 1847 CG GLU B 45 -2.058 4.808 -3.658 1.00 0.00 C ATOM 1848 CD GLU B 45 -2.092 5.165 -5.128 1.00 0.00 C ATOM 1849 OE1 GLU B 45 -2.490 6.302 -5.454 1.00 0.00 O ATOM 1850 OE2 GLU B 45 -1.740 4.312 -5.966 1.00 0.00 O ATOM 0 H GLU B 45 -2.619 2.334 -2.255 1.00 0.00 H new ATOM 0 HA GLU B 45 -2.842 4.833 -1.086 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -3.829 3.616 -3.682 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -4.105 5.307 -3.312 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -1.647 5.643 -3.092 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -1.390 3.960 -3.506 1.00 0.00 H new ATOM 1857 N LYS B 46 -5.774 3.393 -1.613 1.00 0.00 N ATOM 1858 CA LYS B 46 -7.190 3.463 -1.274 1.00 0.00 C ATOM 1859 C LYS B 46 -7.422 3.123 0.196 1.00 0.00 C ATOM 1860 O LYS B 46 -8.338 3.658 0.822 1.00 0.00 O ATOM 1861 CB LYS B 46 -8.015 2.547 -2.187 1.00 0.00 C ATOM 1862 CG LYS B 46 -8.342 3.164 -3.542 1.00 0.00 C ATOM 1863 CD LYS B 46 -7.089 3.459 -4.354 1.00 0.00 C ATOM 1864 CE LYS B 46 -7.397 4.316 -5.570 1.00 0.00 C ATOM 1865 NZ LYS B 46 -6.180 4.615 -6.370 1.00 0.00 N ATOM 0 H LYS B 46 -5.528 2.631 -2.245 1.00 0.00 H new ATOM 0 HA LYS B 46 -7.523 4.489 -1.434 1.00 0.00 H new ATOM 0 HB2 LYS B 46 -7.468 1.617 -2.344 1.00 0.00 H new ATOM 0 HB3 LYS B 46 -8.945 2.288 -1.682 1.00 0.00 H new ATOM 0 HG2 LYS B 46 -8.986 2.486 -4.103 1.00 0.00 H new ATOM 0 HG3 LYS B 46 -8.903 4.087 -3.394 1.00 0.00 H new ATOM 0 HD2 LYS B 46 -6.359 3.969 -3.725 1.00 0.00 H new ATOM 0 HD3 LYS B 46 -6.634 2.522 -4.675 1.00 0.00 H new ATOM 0 HE2 LYS B 46 -8.126 3.804 -6.198 1.00 0.00 H new ATOM 0 HE3 LYS B 46 -7.856 5.250 -5.247 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 -6.438 5.202 -7.189 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 -5.494 5.127 -5.780 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 -5.755 3.725 -6.702 1.00 0.00 H new ATOM 1879 N THR B 47 -6.593 2.245 0.742 1.00 0.00 N ATOM 1880 CA THR B 47 -6.643 1.943 2.164 1.00 0.00 C ATOM 1881 C THR B 47 -6.323 3.199 2.977 1.00 0.00 C ATOM 1882 O THR B 47 -7.027 3.533 3.934 1.00 0.00 O ATOM 1883 CB THR B 47 -5.651 0.818 2.531 1.00 0.00 C ATOM 1884 OG1 THR B 47 -5.889 -0.328 1.704 1.00 0.00 O ATOM 1885 CG2 THR B 47 -5.787 0.419 3.993 1.00 0.00 C ATOM 0 H THR B 47 -5.880 1.731 0.224 1.00 0.00 H new ATOM 0 HA THR B 47 -7.651 1.602 2.401 1.00 0.00 H new ATOM 0 HB THR B 47 -4.641 1.193 2.367 1.00 0.00 H new ATOM 0 HG1 THR B 47 -5.595 -0.137 0.789 1.00 0.00 H new ATOM 0 HG21 THR B 47 -5.076 -0.375 4.221 1.00 0.00 H new ATOM 0 HG22 THR B 47 -5.583 1.282 4.626 1.00 0.00 H new ATOM 0 HG23 THR B 47 -6.800 0.063 4.180 1.00 0.00 H new ATOM 1893 N TYR B 48 -5.273 3.907 2.567 1.00 0.00 N ATOM 1894 CA TYR B 48 -4.859 5.134 3.234 1.00 0.00 C ATOM 1895 C TYR B 48 -5.912 6.227 3.053 1.00 0.00 C ATOM 1896 O TYR B 48 -6.257 6.928 4.005 1.00 0.00 O ATOM 1897 CB TYR B 48 -3.501 5.598 2.691 1.00 0.00 C ATOM 1898 CG TYR B 48 -2.980 6.868 3.333 1.00 0.00 C ATOM 1899 CD1 TYR B 48 -2.701 6.919 4.692 1.00 0.00 C ATOM 1900 CD2 TYR B 48 -2.760 8.010 2.575 1.00 0.00 C ATOM 1901 CE1 TYR B 48 -2.217 8.075 5.278 1.00 0.00 C ATOM 1902 CE2 TYR B 48 -2.278 9.169 3.155 1.00 0.00 C ATOM 1903 CZ TYR B 48 -2.007 9.196 4.506 1.00 0.00 C ATOM 1904 OH TYR B 48 -1.517 10.347 5.086 1.00 0.00 O ATOM 0 H TYR B 48 -4.691 3.648 1.770 1.00 0.00 H new ATOM 0 HA TYR B 48 -4.758 4.933 4.301 1.00 0.00 H new ATOM 0 HB2 TYR B 48 -2.771 4.802 2.840 1.00 0.00 H new ATOM 0 HB3 TYR B 48 -3.586 5.755 1.616 1.00 0.00 H new ATOM 0 HD1 TYR B 48 -2.864 6.042 5.301 1.00 0.00 H new ATOM 0 HD2 TYR B 48 -2.969 7.993 1.515 1.00 0.00 H new ATOM 0 HE1 TYR B 48 -2.005 8.098 6.337 1.00 0.00 H new ATOM 0 HE2 TYR B 48 -2.115 10.050 2.552 1.00 0.00 H new ATOM 0 HH TYR B 48 -0.973 10.114 5.867 1.00 0.00 H new ATOM 1914 N GLU B 49 -6.422 6.361 1.829 1.00 0.00 N ATOM 1915 CA GLU B 49 -7.455 7.338 1.531 1.00 0.00 C ATOM 1916 C GLU B 49 -8.681 7.123 2.409 1.00 0.00 C ATOM 1917 O GLU B 49 -9.206 8.070 2.994 1.00 0.00 O ATOM 1918 CB GLU B 49 -7.865 7.250 0.063 1.00 0.00 C ATOM 1919 CG GLU B 49 -6.765 7.618 -0.916 1.00 0.00 C ATOM 1920 CD GLU B 49 -7.265 7.688 -2.345 1.00 0.00 C ATOM 1921 OE1 GLU B 49 -7.363 6.634 -3.003 1.00 0.00 O ATOM 1922 OE2 GLU B 49 -7.573 8.804 -2.812 1.00 0.00 O ATOM 0 H GLU B 49 -6.131 5.800 1.028 1.00 0.00 H new ATOM 0 HA GLU B 49 -7.044 8.327 1.735 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -8.199 6.234 -0.149 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -8.719 7.907 -0.104 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -6.339 8.581 -0.635 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -5.962 6.883 -0.850 1.00 0.00 H new ATOM 1929 N ALA B 50 -9.118 5.871 2.503 1.00 0.00 N ATOM 1930 CA ALA B 50 -10.306 5.527 3.272 1.00 0.00 C ATOM 1931 C ALA B 50 -10.152 5.917 4.738 1.00 0.00 C ATOM 1932 O ALA B 50 -11.006 6.603 5.294 1.00 0.00 O ATOM 1933 CB ALA B 50 -10.605 4.040 3.142 1.00 0.00 C ATOM 0 H ALA B 50 -8.664 5.076 2.054 1.00 0.00 H new ATOM 0 HA ALA B 50 -11.145 6.092 2.866 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -11.495 3.796 3.722 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -10.775 3.793 2.094 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -9.759 3.465 3.517 1.00 0.00 H new ATOM 1939 N TYR B 51 -9.053 5.497 5.356 1.00 0.00 N ATOM 1940 CA TYR B 51 -8.816 5.787 6.765 1.00 0.00 C ATOM 1941 C TYR B 51 -8.615 7.278 7.002 1.00 0.00 C ATOM 1942 O TYR B 51 -9.113 7.826 7.986 1.00 0.00 O ATOM 1943 CB TYR B 51 -7.615 5.001 7.286 1.00 0.00 C ATOM 1944 CG TYR B 51 -7.907 3.535 7.484 1.00 0.00 C ATOM 1945 CD1 TYR B 51 -8.973 3.128 8.275 1.00 0.00 C ATOM 1946 CD2 TYR B 51 -7.121 2.560 6.888 1.00 0.00 C ATOM 1947 CE1 TYR B 51 -9.247 1.791 8.465 1.00 0.00 C ATOM 1948 CE2 TYR B 51 -7.389 1.218 7.072 1.00 0.00 C ATOM 1949 CZ TYR B 51 -8.455 0.840 7.860 1.00 0.00 C ATOM 1950 OH TYR B 51 -8.727 -0.491 8.051 1.00 0.00 O ATOM 0 H TYR B 51 -8.315 4.957 4.905 1.00 0.00 H new ATOM 0 HA TYR B 51 -9.703 5.476 7.316 1.00 0.00 H new ATOM 0 HB2 TYR B 51 -6.787 5.109 6.586 1.00 0.00 H new ATOM 0 HB3 TYR B 51 -7.290 5.432 8.233 1.00 0.00 H new ATOM 0 HD1 TYR B 51 -9.597 3.871 8.749 1.00 0.00 H new ATOM 0 HD2 TYR B 51 -6.286 2.855 6.270 1.00 0.00 H new ATOM 0 HE1 TYR B 51 -10.078 1.490 9.085 1.00 0.00 H new ATOM 0 HE2 TYR B 51 -6.768 0.470 6.602 1.00 0.00 H new ATOM 0 HH TYR B 51 -9.689 -0.611 8.196 1.00 0.00 H new ATOM 1960 N ARG B 52 -7.891 7.931 6.102 1.00 0.00 N ATOM 1961 CA ARG B 52 -7.679 9.368 6.205 1.00 0.00 C ATOM 1962 C ARG B 52 -9.007 10.108 6.132 1.00 0.00 C ATOM 1963 O ARG B 52 -9.311 10.928 6.993 1.00 0.00 O ATOM 1964 CB ARG B 52 -6.744 9.866 5.100 1.00 0.00 C ATOM 1965 CG ARG B 52 -6.592 11.380 5.062 1.00 0.00 C ATOM 1966 CD ARG B 52 -6.028 11.922 6.367 1.00 0.00 C ATOM 1967 NE ARG B 52 -6.029 13.384 6.398 1.00 0.00 N ATOM 1968 CZ ARG B 52 -5.629 14.118 7.437 1.00 0.00 C ATOM 1969 NH1 ARG B 52 -5.179 13.536 8.544 1.00 0.00 N ATOM 1970 NH2 ARG B 52 -5.686 15.439 7.367 1.00 0.00 N ATOM 0 H ARG B 52 -7.443 7.492 5.298 1.00 0.00 H new ATOM 0 HA ARG B 52 -7.212 9.569 7.169 1.00 0.00 H new ATOM 0 HB2 ARG B 52 -5.761 9.415 5.237 1.00 0.00 H new ATOM 0 HB3 ARG B 52 -7.120 9.523 4.136 1.00 0.00 H new ATOM 0 HG2 ARG B 52 -5.935 11.659 4.238 1.00 0.00 H new ATOM 0 HG3 ARG B 52 -7.561 11.838 4.866 1.00 0.00 H new ATOM 0 HD2 ARG B 52 -6.616 11.541 7.202 1.00 0.00 H new ATOM 0 HD3 ARG B 52 -5.010 11.557 6.501 1.00 0.00 H new ATOM 0 HE ARG B 52 -6.358 13.876 5.568 1.00 0.00 H new ATOM 0 HH11 ARG B 52 -5.137 12.519 8.604 1.00 0.00 H new ATOM 0 HH12 ARG B 52 -4.875 14.107 9.333 1.00 0.00 H new ATOM 0 HH21 ARG B 52 -6.035 15.890 6.521 1.00 0.00 H new ATOM 0 HH22 ARG B 52 -5.381 16.005 8.159 1.00 0.00 H new ATOM 1984 N GLN B 53 -9.797 9.798 5.114 1.00 0.00 N ATOM 1985 CA GLN B 53 -11.072 10.468 4.906 1.00 0.00 C ATOM 1986 C GLN B 53 -12.057 10.133 6.023 1.00 0.00 C ATOM 1987 O GLN B 53 -12.844 10.980 6.432 1.00 0.00 O ATOM 1988 CB GLN B 53 -11.662 10.090 3.547 1.00 0.00 C ATOM 1989 CG GLN B 53 -12.856 10.941 3.146 1.00 0.00 C ATOM 1990 CD GLN B 53 -13.363 10.621 1.756 1.00 0.00 C ATOM 1991 OE1 GLN B 53 -13.259 9.485 1.285 1.00 0.00 O ATOM 1992 NE2 GLN B 53 -13.894 11.625 1.082 1.00 0.00 N ATOM 0 H GLN B 53 -9.577 9.085 4.418 1.00 0.00 H new ATOM 0 HA GLN B 53 -10.892 11.543 4.922 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -10.888 10.183 2.785 1.00 0.00 H new ATOM 0 HB3 GLN B 53 -11.963 9.043 3.569 1.00 0.00 H new ATOM 0 HG2 GLN B 53 -13.661 10.791 3.865 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -12.578 11.994 3.193 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -13.960 12.548 1.510 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -14.238 11.477 0.133 1.00 0.00 H new ATOM 2001 N LEU B 54 -12.005 8.902 6.518 1.00 0.00 N ATOM 2002 CA LEU B 54 -12.880 8.474 7.605 1.00 0.00 C ATOM 2003 C LEU B 54 -12.623 9.300 8.862 1.00 0.00 C ATOM 2004 O LEU B 54 -13.557 9.799 9.493 1.00 0.00 O ATOM 2005 CB LEU B 54 -12.678 6.985 7.906 1.00 0.00 C ATOM 2006 CG LEU B 54 -13.543 6.418 9.034 1.00 0.00 C ATOM 2007 CD1 LEU B 54 -15.020 6.513 8.685 1.00 0.00 C ATOM 2008 CD2 LEU B 54 -13.155 4.976 9.329 1.00 0.00 C ATOM 0 H LEU B 54 -11.365 8.181 6.184 1.00 0.00 H new ATOM 0 HA LEU B 54 -13.911 8.631 7.289 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -12.879 6.418 6.997 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -11.630 6.822 8.158 1.00 0.00 H new ATOM 0 HG LEU B 54 -13.368 7.014 9.930 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -15.614 6.104 9.502 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -15.290 7.557 8.528 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -15.216 5.946 7.775 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -13.780 4.588 10.134 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -13.298 4.370 8.434 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -12.108 4.935 9.631 1.00 0.00 H new ATOM 2020 N ASP B 55 -11.354 9.453 9.217 1.00 0.00 N ATOM 2021 CA ASP B 55 -10.992 10.197 10.416 1.00 0.00 C ATOM 2022 C ASP B 55 -11.138 11.695 10.179 1.00 0.00 C ATOM 2023 O ASP B 55 -11.493 12.438 11.091 1.00 0.00 O ATOM 2024 CB ASP B 55 -9.567 9.848 10.861 1.00 0.00 C ATOM 2025 CG ASP B 55 -9.333 10.141 12.332 1.00 0.00 C ATOM 2026 OD1 ASP B 55 -10.039 9.551 13.181 1.00 0.00 O ATOM 2027 OD2 ASP B 55 -8.430 10.938 12.654 1.00 0.00 O ATOM 0 H ASP B 55 -10.563 9.075 8.696 1.00 0.00 H new ATOM 0 HA ASP B 55 -11.673 9.912 11.218 1.00 0.00 H new ATOM 0 HB2 ASP B 55 -9.377 8.792 10.669 1.00 0.00 H new ATOM 0 HB3 ASP B 55 -8.853 10.414 10.262 1.00 0.00 H new ATOM 2032 N GLU B 56 -10.881 12.135 8.946 1.00 0.00 N ATOM 2033 CA GLU B 56 -11.111 13.504 8.554 1.00 0.00 C ATOM 2034 C GLU B 56 -12.592 13.839 8.684 1.00 0.00 C ATOM 2035 O GLU B 56 -12.960 14.909 9.166 1.00 0.00 O ATOM 2036 CB GLU B 56 -10.665 13.699 7.112 1.00 0.00 C ATOM 2037 CG GLU B 56 -10.493 15.146 6.758 1.00 0.00 C ATOM 2038 CD GLU B 56 -10.584 15.414 5.272 1.00 0.00 C ATOM 2039 OE1 GLU B 56 -9.639 15.066 4.535 1.00 0.00 O ATOM 2040 OE2 GLU B 56 -11.599 15.994 4.833 1.00 0.00 O ATOM 0 H GLU B 56 -10.509 11.545 8.202 1.00 0.00 H new ATOM 0 HA GLU B 56 -10.539 14.166 9.204 1.00 0.00 H new ATOM 0 HB2 GLU B 56 -9.723 13.174 6.952 1.00 0.00 H new ATOM 0 HB3 GLU B 56 -11.399 13.249 6.443 1.00 0.00 H new ATOM 0 HG2 GLU B 56 -11.254 15.732 7.273 1.00 0.00 H new ATOM 0 HG3 GLU B 56 -9.525 15.490 7.123 1.00 0.00 H new ATOM 2047 N PHE B 57 -13.432 12.906 8.248 1.00 0.00 N ATOM 2048 CA PHE B 57 -14.876 13.023 8.401 1.00 0.00 C ATOM 2049 C PHE B 57 -15.222 13.232 9.869 1.00 0.00 C ATOM 2050 O PHE B 57 -16.024 14.096 10.208 1.00 0.00 O ATOM 2051 CB PHE B 57 -15.554 11.758 7.857 1.00 0.00 C ATOM 2052 CG PHE B 57 -17.056 11.747 7.967 1.00 0.00 C ATOM 2053 CD1 PHE B 57 -17.838 12.426 7.043 1.00 0.00 C ATOM 2054 CD2 PHE B 57 -17.685 11.047 8.986 1.00 0.00 C ATOM 2055 CE1 PHE B 57 -19.215 12.407 7.135 1.00 0.00 C ATOM 2056 CE2 PHE B 57 -19.061 11.025 9.082 1.00 0.00 C ATOM 2057 CZ PHE B 57 -19.827 11.707 8.155 1.00 0.00 C ATOM 0 H PHE B 57 -13.131 12.051 7.780 1.00 0.00 H new ATOM 0 HA PHE B 57 -15.237 13.882 7.836 1.00 0.00 H new ATOM 0 HB2 PHE B 57 -15.280 11.639 6.809 1.00 0.00 H new ATOM 0 HB3 PHE B 57 -15.159 10.893 8.390 1.00 0.00 H new ATOM 0 HD1 PHE B 57 -17.364 12.975 6.243 1.00 0.00 H new ATOM 0 HD2 PHE B 57 -17.091 10.513 9.713 1.00 0.00 H new ATOM 0 HE1 PHE B 57 -19.813 12.939 6.410 1.00 0.00 H new ATOM 0 HE2 PHE B 57 -19.539 10.476 9.880 1.00 0.00 H new ATOM 0 HZ PHE B 57 -20.904 11.692 8.229 1.00 0.00 H new ATOM 2067 N ARG B 58 -14.581 12.455 10.733 1.00 0.00 N ATOM 2068 CA ARG B 58 -14.765 12.579 12.166 1.00 0.00 C ATOM 2069 C ARG B 58 -14.412 13.983 12.649 1.00 0.00 C ATOM 2070 O ARG B 58 -15.144 14.567 13.449 1.00 0.00 O ATOM 2071 CB ARG B 58 -13.918 11.535 12.888 1.00 0.00 C ATOM 2072 CG ARG B 58 -14.499 10.129 12.837 1.00 0.00 C ATOM 2073 CD ARG B 58 -15.606 9.928 13.869 1.00 0.00 C ATOM 2074 NE ARG B 58 -16.756 10.813 13.655 1.00 0.00 N ATOM 2075 CZ ARG B 58 -17.453 11.378 14.647 1.00 0.00 C ATOM 2076 NH1 ARG B 58 -17.081 11.188 15.912 1.00 0.00 N ATOM 2077 NH2 ARG B 58 -18.512 12.134 14.378 1.00 0.00 N ATOM 0 H ARG B 58 -13.923 11.726 10.458 1.00 0.00 H new ATOM 0 HA ARG B 58 -15.817 12.406 12.395 1.00 0.00 H new ATOM 0 HB2 ARG B 58 -12.921 11.522 12.448 1.00 0.00 H new ATOM 0 HB3 ARG B 58 -13.802 11.832 13.930 1.00 0.00 H new ATOM 0 HG2 ARG B 58 -14.894 9.936 11.840 1.00 0.00 H new ATOM 0 HG3 ARG B 58 -13.705 9.403 13.011 1.00 0.00 H new ATOM 0 HD2 ARG B 58 -15.941 8.891 13.837 1.00 0.00 H new ATOM 0 HD3 ARG B 58 -15.202 10.101 14.866 1.00 0.00 H new ATOM 0 HE ARG B 58 -17.040 11.009 12.695 1.00 0.00 H new ATOM 0 HH11 ARG B 58 -16.266 10.612 16.123 1.00 0.00 H new ATOM 0 HH12 ARG B 58 -17.611 11.618 16.670 1.00 0.00 H new ATOM 0 HH21 ARG B 58 -18.798 12.286 13.411 1.00 0.00 H new ATOM 0 HH22 ARG B 58 -19.039 12.562 15.139 1.00 0.00 H new ATOM 2091 N LYS B 59 -13.295 14.519 12.160 1.00 0.00 N ATOM 2092 CA LYS B 59 -12.885 15.881 12.512 1.00 0.00 C ATOM 2093 C LYS B 59 -13.930 16.884 12.032 1.00 0.00 C ATOM 2094 O LYS B 59 -14.407 17.726 12.796 1.00 0.00 O ATOM 2095 CB LYS B 59 -11.538 16.246 11.877 1.00 0.00 C ATOM 2096 CG LYS B 59 -10.465 15.177 11.980 1.00 0.00 C ATOM 2097 CD LYS B 59 -10.196 14.755 13.411 1.00 0.00 C ATOM 2098 CE LYS B 59 -9.060 13.749 13.468 1.00 0.00 C ATOM 2099 NZ LYS B 59 -8.947 13.103 14.799 1.00 0.00 N ATOM 0 H LYS B 59 -12.661 14.037 11.523 1.00 0.00 H new ATOM 0 HA LYS B 59 -12.789 15.919 13.597 1.00 0.00 H new ATOM 0 HB2 LYS B 59 -11.701 16.475 10.824 1.00 0.00 H new ATOM 0 HB3 LYS B 59 -11.167 17.157 12.347 1.00 0.00 H new ATOM 0 HG2 LYS B 59 -10.769 14.306 11.399 1.00 0.00 H new ATOM 0 HG3 LYS B 59 -9.542 15.550 11.536 1.00 0.00 H new ATOM 0 HD2 LYS B 59 -9.945 15.629 14.012 1.00 0.00 H new ATOM 0 HD3 LYS B 59 -11.097 14.319 13.843 1.00 0.00 H new ATOM 0 HE2 LYS B 59 -9.216 12.984 12.707 1.00 0.00 H new ATOM 0 HE3 LYS B 59 -8.122 14.250 13.229 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 -8.714 12.097 14.678 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 -8.197 13.569 15.348 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 -9.851 13.190 15.305 1.00 0.00 H new ATOM 2113 N SER B 60 -14.284 16.767 10.758 1.00 0.00 N ATOM 2114 CA SER B 60 -15.201 17.696 10.119 1.00 0.00 C ATOM 2115 C SER B 60 -16.567 17.660 10.796 1.00 0.00 C ATOM 2116 O SER B 60 -17.163 18.706 11.075 1.00 0.00 O ATOM 2117 CB SER B 60 -15.338 17.358 8.631 1.00 0.00 C ATOM 2118 OG SER B 60 -16.027 18.379 7.928 1.00 0.00 O ATOM 0 H SER B 60 -13.944 16.028 10.143 1.00 0.00 H new ATOM 0 HA SER B 60 -14.797 18.703 10.219 1.00 0.00 H new ATOM 0 HB2 SER B 60 -14.348 17.219 8.196 1.00 0.00 H new ATOM 0 HB3 SER B 60 -15.871 16.414 8.519 1.00 0.00 H new ATOM 0 HG SER B 60 -16.097 18.135 6.982 1.00 0.00 H new ATOM 2124 N THR B 61 -17.050 16.454 11.074 1.00 0.00 N ATOM 2125 CA THR B 61 -18.337 16.279 11.726 1.00 0.00 C ATOM 2126 C THR B 61 -18.352 16.973 13.082 1.00 0.00 C ATOM 2127 O THR B 61 -19.165 17.861 13.305 1.00 0.00 O ATOM 2128 CB THR B 61 -18.704 14.786 11.900 1.00 0.00 C ATOM 2129 OG1 THR B 61 -18.722 14.130 10.628 1.00 0.00 O ATOM 2130 CG2 THR B 61 -20.069 14.634 12.560 1.00 0.00 C ATOM 0 H THR B 61 -16.566 15.583 10.856 1.00 0.00 H new ATOM 0 HA THR B 61 -19.085 16.735 11.077 1.00 0.00 H new ATOM 0 HB THR B 61 -17.949 14.328 12.539 1.00 0.00 H new ATOM 0 HG1 THR B 61 -17.803 13.954 10.338 1.00 0.00 H new ATOM 0 HG21 THR B 61 -20.304 13.575 12.671 1.00 0.00 H new ATOM 0 HG22 THR B 61 -20.053 15.107 13.542 1.00 0.00 H new ATOM 0 HG23 THR B 61 -20.828 15.111 11.940 1.00 0.00 H new ATOM 2138 N ALA B 62 -17.413 16.599 13.953 1.00 0.00 N ATOM 2139 CA ALA B 62 -17.359 17.125 15.316 1.00 0.00 C ATOM 2140 C ALA B 62 -17.315 18.649 15.328 1.00 0.00 C ATOM 2141 O ALA B 62 -17.902 19.292 16.201 1.00 0.00 O ATOM 2142 CB ALA B 62 -16.153 16.553 16.049 1.00 0.00 C ATOM 0 H ALA B 62 -16.675 15.929 13.735 1.00 0.00 H new ATOM 0 HA ALA B 62 -18.270 16.818 15.831 1.00 0.00 H new ATOM 0 HB1 ALA B 62 -16.121 16.951 17.063 1.00 0.00 H new ATOM 0 HB2 ALA B 62 -16.232 15.467 16.088 1.00 0.00 H new ATOM 0 HB3 ALA B 62 -15.241 16.832 15.521 1.00 0.00 H new ATOM 2148 N SER B 63 -16.637 19.219 14.340 1.00 0.00 N ATOM 2149 CA SER B 63 -16.509 20.667 14.235 1.00 0.00 C ATOM 2150 C SER B 63 -17.869 21.331 13.995 1.00 0.00 C ATOM 2151 O SER B 63 -18.258 22.253 14.718 1.00 0.00 O ATOM 2152 CB SER B 63 -15.533 21.028 13.110 1.00 0.00 C ATOM 2153 OG SER B 63 -14.268 20.424 13.323 1.00 0.00 O ATOM 0 H SER B 63 -16.167 18.700 13.599 1.00 0.00 H new ATOM 0 HA SER B 63 -16.118 21.042 15.181 1.00 0.00 H new ATOM 0 HB2 SER B 63 -15.939 20.702 12.152 1.00 0.00 H new ATOM 0 HB3 SER B 63 -15.419 22.111 13.056 1.00 0.00 H new ATOM 0 HG SER B 63 -14.311 19.477 13.074 1.00 0.00 H new ATOM 2159 N LEU B 64 -18.604 20.837 13.003 1.00 0.00 N ATOM 2160 CA LEU B 64 -19.894 21.420 12.635 1.00 0.00 C ATOM 2161 C LEU B 64 -20.982 20.938 13.597 1.00 0.00 C ATOM 2162 O LEU B 64 -21.987 21.611 13.816 1.00 0.00 O ATOM 2163 CB LEU B 64 -20.239 21.030 11.187 1.00 0.00 C ATOM 2164 CG LEU B 64 -20.963 22.097 10.352 1.00 0.00 C ATOM 2165 CD1 LEU B 64 -22.372 22.345 10.872 1.00 0.00 C ATOM 2166 CD2 LEU B 64 -20.165 23.394 10.338 1.00 0.00 C ATOM 0 H LEU B 64 -18.329 20.033 12.438 1.00 0.00 H new ATOM 0 HA LEU B 64 -19.834 22.506 12.703 1.00 0.00 H new ATOM 0 HB2 LEU B 64 -19.315 20.763 10.675 1.00 0.00 H new ATOM 0 HB3 LEU B 64 -20.860 20.135 11.212 1.00 0.00 H new ATOM 0 HG LEU B 64 -21.044 21.724 9.331 1.00 0.00 H new ATOM 0 HD11 LEU B 64 -22.857 23.105 10.260 1.00 0.00 H new ATOM 0 HD12 LEU B 64 -22.946 21.419 10.824 1.00 0.00 H new ATOM 0 HD13 LEU B 64 -22.323 22.688 11.905 1.00 0.00 H new ATOM 0 HD21 LEU B 64 -20.692 24.139 9.742 1.00 0.00 H new ATOM 0 HD22 LEU B 64 -20.049 23.761 11.358 1.00 0.00 H new ATOM 0 HD23 LEU B 64 -19.182 23.212 9.904 1.00 0.00 H new ATOM 2178 N GLU B 65 -20.747 19.775 14.182 1.00 0.00 N ATOM 2179 CA GLU B 65 -21.692 19.130 15.088 1.00 0.00 C ATOM 2180 C GLU B 65 -21.852 19.912 16.380 1.00 0.00 C ATOM 2181 O GLU B 65 -22.783 19.671 17.151 1.00 0.00 O ATOM 2182 CB GLU B 65 -21.182 17.730 15.414 1.00 0.00 C ATOM 2183 CG GLU B 65 -22.171 16.854 16.153 1.00 0.00 C ATOM 2184 CD GLU B 65 -21.519 15.619 16.736 1.00 0.00 C ATOM 2185 OE1 GLU B 65 -20.879 15.737 17.800 1.00 0.00 O ATOM 2186 OE2 GLU B 65 -21.656 14.529 16.143 1.00 0.00 O ATOM 0 H GLU B 65 -19.887 19.244 14.042 1.00 0.00 H new ATOM 0 HA GLU B 65 -22.664 19.087 14.596 1.00 0.00 H new ATOM 0 HB2 GLU B 65 -20.902 17.234 14.485 1.00 0.00 H new ATOM 0 HB3 GLU B 65 -20.276 17.818 16.014 1.00 0.00 H new ATOM 0 HG2 GLU B 65 -22.635 17.430 16.954 1.00 0.00 H new ATOM 0 HG3 GLU B 65 -22.968 16.555 15.472 1.00 0.00 H new ATOM 2193 N HIS B 66 -20.917 20.828 16.607 1.00 0.00 N ATOM 2194 CA HIS B 66 -20.834 21.588 17.859 1.00 0.00 C ATOM 2195 C HIS B 66 -20.292 20.668 18.959 1.00 0.00 C ATOM 2196 O HIS B 66 -20.182 21.049 20.123 1.00 0.00 O ATOM 2197 CB HIS B 66 -22.219 22.182 18.218 1.00 0.00 C ATOM 2198 CG HIS B 66 -22.300 22.918 19.526 1.00 0.00 C ATOM 2199 ND1 HIS B 66 -22.006 24.258 19.658 1.00 0.00 N ATOM 2200 CD2 HIS B 66 -22.679 22.497 20.758 1.00 0.00 C ATOM 2201 CE1 HIS B 66 -22.196 24.627 20.913 1.00 0.00 C ATOM 2202 NE2 HIS B 66 -22.605 23.576 21.599 1.00 0.00 N ATOM 0 H HIS B 66 -20.192 21.068 15.931 1.00 0.00 H new ATOM 0 HA HIS B 66 -20.150 22.430 17.749 1.00 0.00 H new ATOM 0 HB2 HIS B 66 -22.518 22.863 17.421 1.00 0.00 H new ATOM 0 HB3 HIS B 66 -22.947 21.371 18.234 1.00 0.00 H new ATOM 0 HD2 HIS B 66 -22.983 21.496 21.027 1.00 0.00 H new ATOM 0 HE1 HIS B 66 -22.043 25.620 21.310 1.00 0.00 H new ATOM 0 HE2 HIS B 66 -22.830 23.568 22.594 1.00 0.00 H new ATOM 2211 N HIS B 67 -19.904 19.463 18.536 1.00 0.00 N ATOM 2212 CA HIS B 67 -19.455 18.398 19.430 1.00 0.00 C ATOM 2213 C HIS B 67 -20.552 18.022 20.419 1.00 0.00 C ATOM 2214 O HIS B 67 -20.727 18.670 21.455 1.00 0.00 O ATOM 2215 CB HIS B 67 -18.172 18.784 20.178 1.00 0.00 C ATOM 2216 CG HIS B 67 -17.588 17.650 20.964 1.00 0.00 C ATOM 2217 ND1 HIS B 67 -17.554 17.617 22.341 1.00 0.00 N ATOM 2218 CD2 HIS B 67 -17.016 16.495 20.549 1.00 0.00 C ATOM 2219 CE1 HIS B 67 -16.988 16.493 22.738 1.00 0.00 C ATOM 2220 NE2 HIS B 67 -16.655 15.796 21.669 1.00 0.00 N ATOM 0 H HIS B 67 -19.893 19.198 17.551 1.00 0.00 H new ATOM 0 HA HIS B 67 -19.229 17.531 18.810 1.00 0.00 H new ATOM 0 HB2 HIS B 67 -17.433 19.140 19.460 1.00 0.00 H new ATOM 0 HB3 HIS B 67 -18.387 19.613 20.852 1.00 0.00 H new ATOM 0 HD2 HIS B 67 -16.872 16.183 19.525 1.00 0.00 H new ATOM 0 HE1 HIS B 67 -16.825 16.195 23.763 1.00 0.00 H new ATOM 0 HE2 HIS B 67 -16.201 14.883 21.676 1.00 0.00 H new ATOM 2229 N HIS B 68 -21.295 16.981 20.088 1.00 0.00 N ATOM 2230 CA HIS B 68 -22.333 16.475 20.967 1.00 0.00 C ATOM 2231 C HIS B 68 -21.716 15.640 22.073 1.00 0.00 C ATOM 2232 O HIS B 68 -20.558 15.226 21.983 1.00 0.00 O ATOM 2233 CB HIS B 68 -23.338 15.610 20.195 1.00 0.00 C ATOM 2234 CG HIS B 68 -24.243 16.368 19.270 1.00 0.00 C ATOM 2235 ND1 HIS B 68 -24.630 15.883 18.044 1.00 0.00 N ATOM 2236 CD2 HIS B 68 -24.874 17.555 19.418 1.00 0.00 C ATOM 2237 CE1 HIS B 68 -25.456 16.738 17.476 1.00 0.00 C ATOM 2238 NE2 HIS B 68 -25.628 17.764 18.288 1.00 0.00 N ATOM 0 H HIS B 68 -21.198 16.468 19.212 1.00 0.00 H new ATOM 0 HA HIS B 68 -22.856 17.332 21.392 1.00 0.00 H new ATOM 0 HB2 HIS B 68 -22.788 14.869 19.615 1.00 0.00 H new ATOM 0 HB3 HIS B 68 -23.950 15.063 20.912 1.00 0.00 H new ATOM 0 HD2 HIS B 68 -24.799 18.217 20.268 1.00 0.00 H new ATOM 0 HE1 HIS B 68 -25.916 16.619 16.506 1.00 0.00 H new ATOM 0 HE2 HIS B 68 -26.220 18.575 18.108 1.00 0.00 H new ATOM 2247 N HIS B 69 -22.490 15.393 23.109 1.00 0.00 N ATOM 2248 CA HIS B 69 -22.082 14.484 24.159 1.00 0.00 C ATOM 2249 C HIS B 69 -22.901 13.211 24.032 1.00 0.00 C ATOM 2250 O HIS B 69 -23.978 13.228 23.430 1.00 0.00 O ATOM 2251 CB HIS B 69 -22.266 15.115 25.550 1.00 0.00 C ATOM 2252 CG HIS B 69 -23.694 15.259 25.987 1.00 0.00 C ATOM 2253 ND1 HIS B 69 -24.320 14.343 26.802 1.00 0.00 N ATOM 2254 CD2 HIS B 69 -24.615 16.215 25.721 1.00 0.00 C ATOM 2255 CE1 HIS B 69 -25.562 14.725 27.019 1.00 0.00 C ATOM 2256 NE2 HIS B 69 -25.767 15.859 26.377 1.00 0.00 N ATOM 0 H HIS B 69 -23.410 15.812 23.247 1.00 0.00 H new ATOM 0 HA HIS B 69 -21.021 14.258 24.052 1.00 0.00 H new ATOM 0 HB2 HIS B 69 -21.735 14.508 26.283 1.00 0.00 H new ATOM 0 HB3 HIS B 69 -21.798 16.099 25.553 1.00 0.00 H new ATOM 0 HD1 HIS B 69 -23.889 13.499 27.179 1.00 0.00 H new ATOM 0 HD2 HIS B 69 -24.471 17.092 25.108 1.00 0.00 H new ATOM 0 HE1 HIS B 69 -26.289 14.199 27.620 1.00 0.00 H new ATOM 2265 N HIS B 70 -22.398 12.113 24.571 1.00 0.00 N ATOM 2266 CA HIS B 70 -23.136 10.861 24.526 1.00 0.00 C ATOM 2267 C HIS B 70 -24.450 11.019 25.273 1.00 0.00 C ATOM 2268 O HIS B 70 -24.463 11.411 26.441 1.00 0.00 O ATOM 2269 CB HIS B 70 -22.336 9.705 25.133 1.00 0.00 C ATOM 2270 CG HIS B 70 -22.917 8.357 24.810 1.00 0.00 C ATOM 2271 ND1 HIS B 70 -24.116 7.903 25.317 1.00 0.00 N ATOM 2272 CD2 HIS B 70 -22.464 7.374 23.999 1.00 0.00 C ATOM 2273 CE1 HIS B 70 -24.373 6.704 24.831 1.00 0.00 C ATOM 2274 NE2 HIS B 70 -23.389 6.360 24.026 1.00 0.00 N ATOM 0 H HIS B 70 -21.493 12.062 25.039 1.00 0.00 H new ATOM 0 HA HIS B 70 -23.324 10.622 23.479 1.00 0.00 H new ATOM 0 HB2 HIS B 70 -21.310 9.749 24.768 1.00 0.00 H new ATOM 0 HB3 HIS B 70 -22.295 9.827 26.215 1.00 0.00 H new ATOM 0 HD1 HIS B 70 -24.712 8.415 25.967 1.00 0.00 H new ATOM 0 HD2 HIS B 70 -21.544 7.385 23.434 1.00 0.00 H new ATOM 0 HE1 HIS B 70 -25.243 6.105 25.055 1.00 0.00 H new ATOM 2283 N HIS B 71 -25.546 10.730 24.593 1.00 0.00 N ATOM 2284 CA HIS B 71 -26.863 10.850 25.190 1.00 0.00 C ATOM 2285 C HIS B 71 -27.024 9.815 26.292 1.00 0.00 C ATOM 2286 O HIS B 71 -27.141 10.209 27.468 1.00 0.00 O ATOM 2287 CB HIS B 71 -27.961 10.685 24.133 1.00 0.00 C ATOM 2288 CG HIS B 71 -29.333 11.014 24.637 1.00 0.00 C ATOM 2289 ND1 HIS B 71 -29.847 12.292 24.634 1.00 0.00 N ATOM 2290 CD2 HIS B 71 -30.298 10.224 25.160 1.00 0.00 C ATOM 2291 CE1 HIS B 71 -31.068 12.273 25.133 1.00 0.00 C ATOM 2292 NE2 HIS B 71 -31.365 11.030 25.461 1.00 0.00 N ATOM 2293 OXT HIS B 71 -26.989 8.609 25.982 1.00 0.00 O ATOM 0 H HIS B 71 -25.549 10.410 23.625 1.00 0.00 H new ATOM 0 HA HIS B 71 -26.961 11.847 25.620 1.00 0.00 H new ATOM 0 HB2 HIS B 71 -27.733 11.325 23.281 1.00 0.00 H new ATOM 0 HB3 HIS B 71 -27.953 9.657 23.770 1.00 0.00 H new ATOM 0 HD2 HIS B 71 -30.239 9.156 25.312 1.00 0.00 H new ATOM 0 HE1 HIS B 71 -31.715 13.130 25.253 1.00 0.00 H new ATOM 0 HE2 HIS B 71 -32.245 10.719 25.872 1.00 0.00 H new TER 2302 HIS B 71