USER MOD reduce.3.24.130724 H: found=0, std=0, add=918, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 920 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 39 TYR OH : rot 130:sc= -0.595 USER MOD Set 1.2: B 4 LYS NZ :NH3+ 179:sc= 1.26 (180deg=0.298) USER MOD Single : A 3 MET CE :methyl -145:sc= -0.271 (180deg=-1.68!) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 178:sc= 0.00395 USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.693 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot 93:sc= 0.981 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ -136:sc= 0.121 (180deg=-0.156) USER MOD Single : A 48 LYS NZ :NH3+ 161:sc= 0.874 (180deg=-0.141) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 3 MET CE :methyl 128:sc= -0.169 (180deg=-0.957) USER MOD Single : B 5 SER OG : rot -140:sc= 1.28 USER MOD Single : B 6 THR OG1 : rot 180:sc= -0.131 USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 27 THR OG1 : rot 92:sc= 0.966 USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 39 TYR OH : rot 180:sc= -0.0177 USER MOD Single : B 44 LYS NZ :NH3+ -133:sc= 0.179 (180deg=-0.15) USER MOD Single : B 48 LYS NZ :NH3+ 150:sc= 1.19 (180deg=0.167) USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 TYR OH : rot 180:sc= -0.145 USER MOD Single : B 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 53 ASN : amide:sc= -0.105 K(o=-0.1,f=-1.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N PHE A 2 8.114 -17.924 34.823 1.00 8.91 N ATOM 2 CA PHE A 2 7.795 -16.702 34.030 1.00 8.45 C ATOM 3 C PHE A 2 7.615 -17.064 32.554 1.00 7.63 C ATOM 4 O PHE A 2 6.856 -16.439 31.840 1.00 7.72 O ATOM 5 CB PHE A 2 9.004 -15.784 34.214 1.00 8.96 C ATOM 6 CG PHE A 2 9.092 -15.350 35.658 1.00 9.49 C ATOM 7 CD1 PHE A 2 8.343 -14.257 36.107 1.00 9.97 C ATOM 8 CD2 PHE A 2 9.923 -16.042 36.547 1.00 9.80 C ATOM 9 CE1 PHE A 2 8.425 -13.855 37.446 1.00 10.72 C ATOM 10 CE2 PHE A 2 10.005 -15.640 37.885 1.00 10.54 C ATOM 11 CZ PHE A 2 9.256 -14.546 38.336 1.00 10.99 C ATOM 0 HA PHE A 2 6.870 -16.227 34.356 1.00 8.45 H new ATOM 0 HB2 PHE A 2 9.917 -16.304 33.923 1.00 8.96 H new ATOM 0 HB3 PHE A 2 8.914 -14.912 33.566 1.00 8.96 H new ATOM 0 HD1 PHE A 2 7.702 -13.723 35.421 1.00 9.97 H new ATOM 0 HD2 PHE A 2 10.501 -16.886 36.200 1.00 9.80 H new ATOM 0 HE1 PHE A 2 7.847 -13.011 37.792 1.00 10.72 H new ATOM 0 HE2 PHE A 2 10.647 -16.174 38.570 1.00 10.54 H new ATOM 0 HZ PHE A 2 9.319 -14.236 39.369 1.00 10.99 H new ATOM 21 N MET A 3 8.383 -18.000 32.067 1.00 7.11 N ATOM 22 CA MET A 3 8.338 -18.321 30.609 1.00 6.57 C ATOM 23 C MET A 3 6.889 -18.465 30.113 1.00 5.78 C ATOM 24 O MET A 3 6.562 -18.048 29.020 1.00 5.66 O ATOM 25 CB MET A 3 9.081 -19.650 30.477 1.00 6.89 C ATOM 26 CG MET A 3 10.552 -19.453 30.847 1.00 7.83 C ATOM 27 SD MET A 3 11.468 -20.978 30.517 1.00 8.58 S ATOM 28 CE MET A 3 10.529 -22.052 31.630 1.00 8.76 C ATOM 0 H MET A 3 9.040 -18.557 32.614 1.00 7.11 H new ATOM 0 HA MET A 3 8.788 -17.530 30.009 1.00 6.57 H new ATOM 0 HB2 MET A 3 8.628 -20.398 31.128 1.00 6.89 H new ATOM 0 HB3 MET A 3 8.999 -20.025 29.457 1.00 6.89 H new ATOM 0 HG2 MET A 3 10.976 -18.630 30.271 1.00 7.83 H new ATOM 0 HG3 MET A 3 10.640 -19.184 31.900 1.00 7.83 H new ATOM 0 HE1 MET A 3 11.197 -22.791 32.072 1.00 8.76 H new ATOM 0 HE2 MET A 3 10.078 -21.452 32.420 1.00 8.76 H new ATOM 0 HE3 MET A 3 9.745 -22.561 31.069 1.00 8.76 H new ATOM 38 N LYS A 4 6.023 -19.073 30.884 1.00 5.58 N ATOM 39 CA LYS A 4 4.619 -19.256 30.416 1.00 5.16 C ATOM 40 C LYS A 4 3.778 -18.022 30.758 1.00 4.32 C ATOM 41 O LYS A 4 3.875 -17.474 31.837 1.00 4.43 O ATOM 42 CB LYS A 4 4.105 -20.478 31.177 1.00 5.73 C ATOM 43 CG LYS A 4 4.916 -21.712 30.774 1.00 6.53 C ATOM 44 CD LYS A 4 4.328 -22.952 31.450 1.00 7.41 C ATOM 45 CE LYS A 4 5.211 -24.166 31.150 1.00 8.29 C ATOM 46 NZ LYS A 4 4.617 -25.278 31.943 1.00 8.85 N ATOM 0 H LYS A 4 6.227 -19.448 31.811 1.00 5.58 H new ATOM 0 HA LYS A 4 4.560 -19.390 29.336 1.00 5.16 H new ATOM 0 HB2 LYS A 4 4.187 -20.311 32.251 1.00 5.73 H new ATOM 0 HB3 LYS A 4 3.049 -20.637 30.959 1.00 5.73 H new ATOM 0 HG2 LYS A 4 4.900 -21.833 29.691 1.00 6.53 H new ATOM 0 HG3 LYS A 4 5.959 -21.586 31.065 1.00 6.53 H new ATOM 0 HD2 LYS A 4 4.261 -22.795 32.527 1.00 7.41 H new ATOM 0 HD3 LYS A 4 3.314 -23.129 31.090 1.00 7.41 H new ATOM 0 HE2 LYS A 4 5.215 -24.398 30.085 1.00 8.29 H new ATOM 0 HE3 LYS A 4 6.246 -23.983 31.440 1.00 8.29 H new ATOM 0 HZ1 LYS A 4 5.168 -26.147 31.790 1.00 8.85 H new ATOM 0 HZ2 LYS A 4 4.633 -25.031 32.953 1.00 8.85 H new ATOM 0 HZ3 LYS A 4 3.634 -25.434 31.641 1.00 8.85 H new ATOM 60 N SER A 5 2.934 -17.600 29.856 1.00 3.84 N ATOM 61 CA SER A 5 2.063 -16.424 30.141 1.00 3.10 C ATOM 62 C SER A 5 0.919 -16.829 31.076 1.00 2.34 C ATOM 63 O SER A 5 0.626 -17.996 31.243 1.00 2.87 O ATOM 64 CB SER A 5 1.516 -15.997 28.780 1.00 3.66 C ATOM 65 OG SER A 5 0.546 -16.941 28.346 1.00 4.20 O ATOM 0 H SER A 5 2.810 -18.019 28.934 1.00 3.84 H new ATOM 0 HA SER A 5 2.606 -15.617 30.633 1.00 3.10 H new ATOM 0 HB2 SER A 5 1.069 -15.005 28.850 1.00 3.66 H new ATOM 0 HB3 SER A 5 2.326 -15.931 28.054 1.00 3.66 H new ATOM 0 HG SER A 5 0.170 -16.653 27.488 1.00 4.20 H new ATOM 71 N THR A 6 0.268 -15.875 31.683 1.00 1.82 N ATOM 72 CA THR A 6 -0.859 -16.210 32.600 1.00 1.98 C ATOM 73 C THR A 6 -1.980 -16.908 31.825 1.00 1.52 C ATOM 74 O THR A 6 -2.570 -17.862 32.292 1.00 2.20 O ATOM 75 CB THR A 6 -1.342 -14.865 33.144 1.00 2.86 C ATOM 76 OG1 THR A 6 -1.902 -14.101 32.083 1.00 3.36 O ATOM 77 CG2 THR A 6 -0.163 -14.106 33.754 1.00 3.77 C ATOM 0 H THR A 6 0.467 -14.879 31.584 1.00 1.82 H new ATOM 0 HA THR A 6 -0.554 -16.886 33.399 1.00 1.98 H new ATOM 0 HB THR A 6 -2.098 -15.033 33.911 1.00 2.86 H new ATOM 0 HG1 THR A 6 -2.214 -13.239 32.430 1.00 3.36 H new ATOM 0 HG21 THR A 6 -0.509 -13.148 34.141 1.00 3.77 H new ATOM 0 HG22 THR A 6 0.266 -14.692 34.567 1.00 3.77 H new ATOM 0 HG23 THR A 6 0.595 -13.936 32.989 1.00 3.77 H new ATOM 85 N GLY A 7 -2.242 -16.472 30.623 1.00 0.83 N ATOM 86 CA GLY A 7 -3.283 -17.146 29.798 1.00 0.46 C ATOM 87 C GLY A 7 -4.664 -16.903 30.410 1.00 0.43 C ATOM 88 O GLY A 7 -5.472 -17.805 30.514 1.00 0.49 O ATOM 0 H GLY A 7 -1.780 -15.679 30.177 1.00 0.83 H new ATOM 0 HA2 GLY A 7 -3.255 -16.765 28.777 1.00 0.46 H new ATOM 0 HA3 GLY A 7 -3.082 -18.216 29.744 1.00 0.46 H new ATOM 92 N ILE A 8 -4.956 -15.689 30.794 1.00 0.37 N ATOM 93 CA ILE A 8 -6.305 -15.401 31.372 1.00 0.37 C ATOM 94 C ILE A 8 -7.041 -14.383 30.501 1.00 0.32 C ATOM 95 O ILE A 8 -6.470 -13.416 30.055 1.00 0.30 O ATOM 96 CB ILE A 8 -6.033 -14.816 32.754 1.00 0.40 C ATOM 97 CG1 ILE A 8 -5.146 -15.778 33.552 1.00 0.45 C ATOM 98 CG2 ILE A 8 -7.357 -14.615 33.494 1.00 0.43 C ATOM 99 CD1 ILE A 8 -4.777 -15.141 34.892 1.00 1.36 C ATOM 0 H ILE A 8 -4.326 -14.889 30.734 1.00 0.37 H new ATOM 0 HA ILE A 8 -6.929 -16.293 31.424 1.00 0.37 H new ATOM 0 HB ILE A 8 -5.526 -13.857 32.647 1.00 0.40 H new ATOM 0 HG12 ILE A 8 -5.670 -16.720 33.717 1.00 0.45 H new ATOM 0 HG13 ILE A 8 -4.243 -16.010 32.987 1.00 0.45 H new ATOM 0 HG21 ILE A 8 -7.162 -14.197 34.482 1.00 0.43 H new ATOM 0 HG22 ILE A 8 -7.990 -13.931 32.929 1.00 0.43 H new ATOM 0 HG23 ILE A 8 -7.864 -15.574 33.600 1.00 0.43 H new ATOM 0 HD11 ILE A 8 -4.146 -15.826 35.459 1.00 1.36 H new ATOM 0 HD12 ILE A 8 -4.236 -14.211 34.716 1.00 1.36 H new ATOM 0 HD13 ILE A 8 -5.685 -14.932 35.458 1.00 1.36 H new ATOM 111 N VAL A 9 -8.282 -14.628 30.197 1.00 0.32 N ATOM 112 CA VAL A 9 -9.016 -13.705 29.279 1.00 0.29 C ATOM 113 C VAL A 9 -10.178 -13.022 30.007 1.00 0.32 C ATOM 114 O VAL A 9 -10.859 -13.621 30.817 1.00 0.37 O ATOM 115 CB VAL A 9 -9.533 -14.590 28.146 1.00 0.29 C ATOM 116 CG1 VAL A 9 -10.366 -13.747 27.179 1.00 0.27 C ATOM 117 CG2 VAL A 9 -8.345 -15.199 27.392 1.00 0.30 C ATOM 0 H VAL A 9 -8.822 -15.422 30.540 1.00 0.32 H new ATOM 0 HA VAL A 9 -8.372 -12.907 28.909 1.00 0.29 H new ATOM 0 HB VAL A 9 -10.151 -15.386 28.561 1.00 0.29 H new ATOM 0 HG11 VAL A 9 -10.735 -14.378 26.371 1.00 0.27 H new ATOM 0 HG12 VAL A 9 -11.210 -13.310 27.712 1.00 0.27 H new ATOM 0 HG13 VAL A 9 -9.747 -12.951 26.764 1.00 0.27 H new ATOM 0 HG21 VAL A 9 -8.713 -15.831 26.583 1.00 0.30 H new ATOM 0 HG22 VAL A 9 -7.729 -14.401 26.978 1.00 0.30 H new ATOM 0 HG23 VAL A 9 -7.748 -15.799 28.078 1.00 0.30 H new ATOM 127 N ARG A 10 -10.438 -11.785 29.678 1.00 0.31 N ATOM 128 CA ARG A 10 -11.589 -11.065 30.294 1.00 0.36 C ATOM 129 C ARG A 10 -12.439 -10.419 29.197 1.00 0.31 C ATOM 130 O ARG A 10 -11.998 -10.254 28.079 1.00 0.27 O ATOM 131 CB ARG A 10 -10.958 -9.997 31.190 1.00 0.40 C ATOM 132 CG ARG A 10 -12.053 -9.292 31.991 1.00 0.73 C ATOM 133 CD ARG A 10 -11.427 -8.188 32.848 1.00 0.86 C ATOM 134 NE ARG A 10 -12.549 -7.663 33.677 1.00 1.13 N ATOM 135 CZ ARG A 10 -13.477 -6.923 33.131 1.00 1.36 C ATOM 136 NH1 ARG A 10 -13.427 -6.638 31.857 1.00 1.61 N ATOM 137 NH2 ARG A 10 -14.458 -6.466 33.861 1.00 1.91 N ATOM 0 H ARG A 10 -9.899 -11.240 29.005 1.00 0.31 H new ATOM 0 HA ARG A 10 -12.243 -11.728 30.860 1.00 0.36 H new ATOM 0 HB2 ARG A 10 -10.236 -10.455 31.866 1.00 0.40 H new ATOM 0 HB3 ARG A 10 -10.413 -9.274 30.583 1.00 0.40 H new ATOM 0 HG2 ARG A 10 -12.796 -8.866 31.316 1.00 0.73 H new ATOM 0 HG3 ARG A 10 -12.573 -10.009 32.626 1.00 0.73 H new ATOM 0 HD2 ARG A 10 -10.624 -8.580 33.472 1.00 0.86 H new ATOM 0 HD3 ARG A 10 -10.994 -7.404 32.227 1.00 0.86 H new ATOM 0 HE ARG A 10 -12.592 -7.882 34.672 1.00 1.13 H new ATOM 0 HH11 ARG A 10 -12.661 -6.994 31.285 1.00 1.61 H new ATOM 0 HH12 ARG A 10 -14.154 -6.060 31.435 1.00 1.61 H new ATOM 0 HH21 ARG A 10 -14.499 -6.687 34.856 1.00 1.91 H new ATOM 0 HH22 ARG A 10 -15.183 -5.888 33.436 1.00 1.91 H new ATOM 151 N LYS A 11 -13.667 -10.090 29.491 1.00 0.32 N ATOM 152 CA LYS A 11 -14.547 -9.500 28.440 1.00 0.29 C ATOM 153 C LYS A 11 -14.339 -7.984 28.361 1.00 0.26 C ATOM 154 O LYS A 11 -14.065 -7.332 29.348 1.00 0.27 O ATOM 155 CB LYS A 11 -15.972 -9.826 28.887 1.00 0.33 C ATOM 156 CG LYS A 11 -16.173 -11.343 28.884 1.00 1.02 C ATOM 157 CD LYS A 11 -17.631 -11.668 29.218 1.00 1.03 C ATOM 158 CE LYS A 11 -17.803 -13.183 29.336 1.00 1.81 C ATOM 159 NZ LYS A 11 -18.794 -13.541 28.283 1.00 2.21 N ATOM 0 H LYS A 11 -14.098 -10.203 30.408 1.00 0.32 H new ATOM 0 HA LYS A 11 -14.330 -9.899 27.449 1.00 0.29 H new ATOM 0 HB2 LYS A 11 -16.152 -9.427 29.885 1.00 0.33 H new ATOM 0 HB3 LYS A 11 -16.691 -9.352 28.219 1.00 0.33 H new ATOM 0 HG2 LYS A 11 -15.913 -11.753 27.908 1.00 1.02 H new ATOM 0 HG3 LYS A 11 -15.510 -11.809 29.612 1.00 1.02 H new ATOM 0 HD2 LYS A 11 -17.917 -11.185 30.152 1.00 1.03 H new ATOM 0 HD3 LYS A 11 -18.289 -11.276 28.442 1.00 1.03 H new ATOM 0 HE2 LYS A 11 -16.857 -13.701 29.180 1.00 1.81 H new ATOM 0 HE3 LYS A 11 -18.161 -13.464 30.327 1.00 1.81 H new ATOM 0 HZ1 LYS A 11 -18.965 -14.567 28.301 1.00 2.21 H new ATOM 0 HZ2 LYS A 11 -19.687 -13.038 28.461 1.00 2.21 H new ATOM 0 HZ3 LYS A 11 -18.423 -13.268 27.350 1.00 2.21 H new ATOM 173 N VAL A 12 -14.477 -7.419 27.190 1.00 0.22 N ATOM 174 CA VAL A 12 -14.298 -5.944 27.046 1.00 0.21 C ATOM 175 C VAL A 12 -15.588 -5.224 27.441 1.00 0.20 C ATOM 176 O VAL A 12 -16.659 -5.568 26.987 1.00 0.20 O ATOM 177 CB VAL A 12 -14.008 -5.716 25.560 1.00 0.20 C ATOM 178 CG1 VAL A 12 -13.418 -4.319 25.364 1.00 0.28 C ATOM 179 CG2 VAL A 12 -13.016 -6.767 25.057 1.00 0.28 C ATOM 0 H VAL A 12 -14.706 -7.915 26.328 1.00 0.22 H new ATOM 0 HA VAL A 12 -13.499 -5.564 27.682 1.00 0.21 H new ATOM 0 HB VAL A 12 -14.936 -5.802 24.995 1.00 0.20 H new ATOM 0 HG11 VAL A 12 -13.211 -4.156 24.306 1.00 0.28 H new ATOM 0 HG12 VAL A 12 -14.130 -3.571 25.714 1.00 0.28 H new ATOM 0 HG13 VAL A 12 -12.492 -4.232 25.932 1.00 0.28 H new ATOM 0 HG21 VAL A 12 -12.814 -6.600 23.999 1.00 0.28 H new ATOM 0 HG22 VAL A 12 -12.086 -6.689 25.621 1.00 0.28 H new ATOM 0 HG23 VAL A 12 -13.440 -7.762 25.192 1.00 0.28 H new ATOM 189 N ASP A 13 -15.499 -4.227 28.277 1.00 0.20 N ATOM 190 CA ASP A 13 -16.734 -3.501 28.687 1.00 0.21 C ATOM 191 C ASP A 13 -17.087 -2.432 27.642 1.00 0.22 C ATOM 192 O ASP A 13 -16.522 -2.394 26.567 1.00 0.22 O ATOM 193 CB ASP A 13 -16.408 -2.883 30.053 1.00 0.21 C ATOM 194 CG ASP A 13 -15.817 -1.484 29.882 1.00 0.32 C ATOM 195 OD1 ASP A 13 -14.622 -1.382 29.673 1.00 0.26 O ATOM 196 OD2 ASP A 13 -16.572 -0.531 29.963 1.00 0.55 O ATOM 0 H ASP A 13 -14.632 -3.885 28.691 1.00 0.20 H new ATOM 0 HA ASP A 13 -17.603 -4.156 28.757 1.00 0.21 H new ATOM 0 HB2 ASP A 13 -17.312 -2.830 30.660 1.00 0.21 H new ATOM 0 HB3 ASP A 13 -15.702 -3.519 30.587 1.00 0.21 H new ATOM 201 N GLU A 14 -18.095 -1.649 27.901 1.00 0.23 N ATOM 202 CA GLU A 14 -18.583 -0.691 26.866 1.00 0.26 C ATOM 203 C GLU A 14 -17.457 0.220 26.359 1.00 0.26 C ATOM 204 O GLU A 14 -17.432 0.593 25.203 1.00 0.29 O ATOM 205 CB GLU A 14 -19.660 0.135 27.571 1.00 0.28 C ATOM 206 CG GLU A 14 -20.334 1.065 26.561 1.00 1.22 C ATOM 207 CD GLU A 14 -21.341 1.961 27.284 1.00 1.57 C ATOM 208 OE1 GLU A 14 -21.444 1.845 28.495 1.00 2.19 O ATOM 209 OE2 GLU A 14 -21.990 2.748 26.616 1.00 1.99 O ATOM 0 H GLU A 14 -18.604 -1.629 28.785 1.00 0.23 H new ATOM 0 HA GLU A 14 -18.963 -1.215 25.989 1.00 0.26 H new ATOM 0 HB2 GLU A 14 -20.400 -0.524 28.024 1.00 0.28 H new ATOM 0 HB3 GLU A 14 -19.216 0.718 28.378 1.00 0.28 H new ATOM 0 HG2 GLU A 14 -19.585 1.675 26.057 1.00 1.22 H new ATOM 0 HG3 GLU A 14 -20.839 0.480 25.792 1.00 1.22 H new ATOM 216 N LEU A 15 -16.606 0.688 27.229 1.00 0.23 N ATOM 217 CA LEU A 15 -15.591 1.695 26.797 1.00 0.24 C ATOM 218 C LEU A 15 -14.360 1.022 26.178 1.00 0.22 C ATOM 219 O LEU A 15 -13.457 1.687 25.711 1.00 0.24 O ATOM 220 CB LEU A 15 -15.203 2.447 28.069 1.00 0.28 C ATOM 221 CG LEU A 15 -14.070 3.426 27.752 1.00 0.38 C ATOM 222 CD1 LEU A 15 -14.411 4.216 26.485 1.00 1.28 C ATOM 223 CD2 LEU A 15 -13.895 4.397 28.921 1.00 1.38 C ATOM 0 H LEU A 15 -16.567 0.421 28.213 1.00 0.23 H new ATOM 0 HA LEU A 15 -15.993 2.357 26.031 1.00 0.24 H new ATOM 0 HB2 LEU A 15 -16.064 2.985 28.464 1.00 0.28 H new ATOM 0 HB3 LEU A 15 -14.886 1.743 28.839 1.00 0.28 H new ATOM 0 HG LEU A 15 -13.146 2.870 27.595 1.00 0.38 H new ATOM 0 HD11 LEU A 15 -13.603 4.912 26.262 1.00 1.28 H new ATOM 0 HD12 LEU A 15 -14.538 3.527 25.650 1.00 1.28 H new ATOM 0 HD13 LEU A 15 -15.336 4.772 26.641 1.00 1.28 H new ATOM 0 HD21 LEU A 15 -13.088 5.095 28.697 1.00 1.38 H new ATOM 0 HD22 LEU A 15 -14.821 4.951 29.076 1.00 1.38 H new ATOM 0 HD23 LEU A 15 -13.651 3.838 29.825 1.00 1.38 H new ATOM 235 N GLY A 16 -14.285 -0.280 26.199 1.00 0.21 N ATOM 236 CA GLY A 16 -13.075 -0.947 25.643 1.00 0.19 C ATOM 237 C GLY A 16 -11.943 -0.906 26.674 1.00 0.20 C ATOM 238 O GLY A 16 -10.825 -0.529 26.372 1.00 0.20 O ATOM 0 H GLY A 16 -15.000 -0.904 26.572 1.00 0.21 H new ATOM 0 HA2 GLY A 16 -13.305 -1.980 25.382 1.00 0.19 H new ATOM 0 HA3 GLY A 16 -12.762 -0.449 24.725 1.00 0.19 H new ATOM 242 N ARG A 17 -12.233 -1.234 27.903 1.00 0.24 N ATOM 243 CA ARG A 17 -11.187 -1.158 28.958 1.00 0.26 C ATOM 244 C ARG A 17 -10.879 -2.560 29.492 1.00 0.26 C ATOM 245 O ARG A 17 -11.703 -3.451 29.434 1.00 0.26 O ATOM 246 CB ARG A 17 -11.795 -0.282 30.052 1.00 0.28 C ATOM 247 CG ARG A 17 -11.963 1.145 29.524 1.00 0.28 C ATOM 248 CD ARG A 17 -12.527 2.039 30.629 1.00 0.29 C ATOM 249 NE ARG A 17 -13.927 1.576 30.820 1.00 0.57 N ATOM 250 CZ ARG A 17 -14.789 2.338 31.444 1.00 0.79 C ATOM 251 NH1 ARG A 17 -14.411 3.489 31.935 1.00 0.73 N ATOM 252 NH2 ARG A 17 -16.028 1.953 31.578 1.00 1.15 N ATOM 0 H ARG A 17 -13.149 -1.551 28.221 1.00 0.24 H new ATOM 0 HA ARG A 17 -10.248 -0.748 28.587 1.00 0.26 H new ATOM 0 HB2 ARG A 17 -12.760 -0.684 30.361 1.00 0.28 H new ATOM 0 HB3 ARG A 17 -11.153 -0.283 30.933 1.00 0.28 H new ATOM 0 HG2 ARG A 17 -11.003 1.533 29.184 1.00 0.28 H new ATOM 0 HG3 ARG A 17 -12.632 1.148 28.663 1.00 0.28 H new ATOM 0 HD2 ARG A 17 -11.950 1.942 31.549 1.00 0.29 H new ATOM 0 HD3 ARG A 17 -12.494 3.090 30.342 1.00 0.29 H new ATOM 0 HE ARG A 17 -14.216 0.664 30.465 1.00 0.57 H new ATOM 0 HH11 ARG A 17 -13.443 3.794 31.832 1.00 0.73 H new ATOM 0 HH12 ARG A 17 -15.084 4.082 32.421 1.00 0.73 H new ATOM 0 HH21 ARG A 17 -16.327 1.056 31.196 1.00 1.15 H new ATOM 0 HH22 ARG A 17 -16.697 2.549 32.065 1.00 1.15 H new ATOM 266 N VAL A 18 -9.700 -2.760 30.011 1.00 0.26 N ATOM 267 CA VAL A 18 -9.340 -4.103 30.550 1.00 0.25 C ATOM 268 C VAL A 18 -8.908 -3.975 32.011 1.00 0.24 C ATOM 269 O VAL A 18 -8.490 -2.923 32.452 1.00 0.24 O ATOM 270 CB VAL A 18 -8.175 -4.581 29.684 1.00 0.26 C ATOM 271 CG1 VAL A 18 -8.582 -4.536 28.210 1.00 0.28 C ATOM 272 CG2 VAL A 18 -6.966 -3.668 29.907 1.00 0.26 C ATOM 0 H VAL A 18 -8.969 -2.052 30.086 1.00 0.26 H new ATOM 0 HA VAL A 18 -10.176 -4.802 30.521 1.00 0.25 H new ATOM 0 HB VAL A 18 -7.915 -5.603 29.958 1.00 0.26 H new ATOM 0 HG11 VAL A 18 -7.751 -4.877 27.593 1.00 0.28 H new ATOM 0 HG12 VAL A 18 -9.443 -5.185 28.050 1.00 0.28 H new ATOM 0 HG13 VAL A 18 -8.842 -3.514 27.936 1.00 0.28 H new ATOM 0 HG21 VAL A 18 -6.134 -4.008 29.290 1.00 0.26 H new ATOM 0 HG22 VAL A 18 -7.227 -2.646 29.633 1.00 0.26 H new ATOM 0 HG23 VAL A 18 -6.675 -3.699 30.957 1.00 0.26 H new ATOM 282 N VAL A 19 -9.093 -5.006 32.787 1.00 0.22 N ATOM 283 CA VAL A 19 -8.790 -4.900 34.242 1.00 0.21 C ATOM 284 C VAL A 19 -7.574 -5.753 34.605 1.00 0.22 C ATOM 285 O VAL A 19 -7.504 -6.922 34.278 1.00 0.23 O ATOM 286 CB VAL A 19 -10.041 -5.432 34.942 1.00 0.22 C ATOM 287 CG1 VAL A 19 -9.903 -5.241 36.453 1.00 0.23 C ATOM 288 CG2 VAL A 19 -11.268 -4.669 34.440 1.00 0.24 C ATOM 0 H VAL A 19 -9.440 -5.914 32.479 1.00 0.22 H new ATOM 0 HA VAL A 19 -8.553 -3.878 34.536 1.00 0.21 H new ATOM 0 HB VAL A 19 -10.157 -6.493 34.721 1.00 0.22 H new ATOM 0 HG11 VAL A 19 -10.795 -5.621 36.951 1.00 0.23 H new ATOM 0 HG12 VAL A 19 -9.029 -5.785 36.810 1.00 0.23 H new ATOM 0 HG13 VAL A 19 -9.786 -4.181 36.677 1.00 0.23 H new ATOM 0 HG21 VAL A 19 -12.161 -5.047 34.938 1.00 0.24 H new ATOM 0 HG22 VAL A 19 -11.152 -3.608 34.660 1.00 0.24 H new ATOM 0 HG23 VAL A 19 -11.367 -4.807 33.363 1.00 0.24 H new ATOM 298 N ILE A 20 -6.674 -5.211 35.378 1.00 0.22 N ATOM 299 CA ILE A 20 -5.534 -6.027 35.877 1.00 0.24 C ATOM 300 C ILE A 20 -5.981 -6.848 37.090 1.00 0.24 C ATOM 301 O ILE A 20 -6.565 -6.317 38.008 1.00 0.23 O ATOM 302 CB ILE A 20 -4.473 -4.996 36.274 1.00 0.23 C ATOM 303 CG1 ILE A 20 -3.719 -4.539 35.024 1.00 0.29 C ATOM 304 CG2 ILE A 20 -3.488 -5.615 37.266 1.00 0.24 C ATOM 305 CD1 ILE A 20 -2.996 -3.223 35.317 1.00 1.38 C ATOM 0 H ILE A 20 -6.679 -4.238 35.685 1.00 0.22 H new ATOM 0 HA ILE A 20 -5.157 -6.734 35.138 1.00 0.24 H new ATOM 0 HB ILE A 20 -4.961 -4.141 36.743 1.00 0.23 H new ATOM 0 HG12 ILE A 20 -3.001 -5.301 34.720 1.00 0.29 H new ATOM 0 HG13 ILE A 20 -4.414 -4.408 34.195 1.00 0.29 H new ATOM 0 HG21 ILE A 20 -2.737 -4.875 37.543 1.00 0.24 H new ATOM 0 HG22 ILE A 20 -4.025 -5.939 38.158 1.00 0.24 H new ATOM 0 HG23 ILE A 20 -2.999 -6.473 36.806 1.00 0.24 H new ATOM 0 HD11 ILE A 20 -2.459 -2.897 34.426 1.00 1.38 H new ATOM 0 HD12 ILE A 20 -3.724 -2.463 35.600 1.00 1.38 H new ATOM 0 HD13 ILE A 20 -2.289 -3.370 36.134 1.00 1.38 H new ATOM 317 N PRO A 21 -5.639 -8.108 37.081 1.00 0.28 N ATOM 318 CA PRO A 21 -5.958 -8.988 38.233 1.00 0.30 C ATOM 319 C PRO A 21 -5.314 -8.436 39.507 1.00 0.28 C ATOM 320 O PRO A 21 -4.232 -7.890 39.477 1.00 0.27 O ATOM 321 CB PRO A 21 -5.354 -10.341 37.854 1.00 0.35 C ATOM 322 CG PRO A 21 -4.454 -10.079 36.685 1.00 0.35 C ATOM 323 CD PRO A 21 -4.935 -8.820 36.016 1.00 0.32 C ATOM 0 HA PRO A 21 -7.027 -9.059 38.432 1.00 0.30 H new ATOM 0 HB2 PRO A 21 -4.796 -10.767 38.688 1.00 0.35 H new ATOM 0 HB3 PRO A 21 -6.133 -11.057 37.593 1.00 0.35 H new ATOM 0 HG2 PRO A 21 -3.421 -9.967 37.014 1.00 0.35 H new ATOM 0 HG3 PRO A 21 -4.478 -10.917 35.988 1.00 0.35 H new ATOM 0 HD2 PRO A 21 -4.105 -8.233 35.623 1.00 0.32 H new ATOM 0 HD3 PRO A 21 -5.595 -9.040 35.177 1.00 0.32 H new ATOM 331 N ILE A 22 -5.977 -8.550 40.625 1.00 0.30 N ATOM 332 CA ILE A 22 -5.402 -7.997 41.886 1.00 0.30 C ATOM 333 C ILE A 22 -4.009 -8.571 42.130 1.00 0.32 C ATOM 334 O ILE A 22 -3.138 -7.904 42.653 1.00 0.32 O ATOM 335 CB ILE A 22 -6.367 -8.438 42.988 1.00 0.35 C ATOM 336 CG1 ILE A 22 -6.047 -7.682 44.280 1.00 0.41 C ATOM 337 CG2 ILE A 22 -6.214 -9.941 43.229 1.00 0.42 C ATOM 338 CD1 ILE A 22 -6.313 -6.189 44.078 1.00 1.11 C ATOM 0 H ILE A 22 -6.888 -9.000 40.721 1.00 0.30 H new ATOM 0 HA ILE A 22 -5.294 -6.913 41.849 1.00 0.30 H new ATOM 0 HB ILE A 22 -7.390 -8.220 42.682 1.00 0.35 H new ATOM 0 HG12 ILE A 22 -6.658 -8.064 45.098 1.00 0.41 H new ATOM 0 HG13 ILE A 22 -5.006 -7.842 44.559 1.00 0.41 H new ATOM 0 HG21 ILE A 22 -6.902 -10.255 44.014 1.00 0.42 H new ATOM 0 HG22 ILE A 22 -6.441 -10.482 42.310 1.00 0.42 H new ATOM 0 HG23 ILE A 22 -5.190 -10.158 43.535 1.00 0.42 H new ATOM 0 HD11 ILE A 22 -6.085 -5.651 44.998 1.00 1.11 H new ATOM 0 HD12 ILE A 22 -5.683 -5.813 43.272 1.00 1.11 H new ATOM 0 HD13 ILE A 22 -7.361 -6.038 43.820 1.00 1.11 H new ATOM 350 N GLU A 23 -3.777 -9.788 41.734 1.00 0.36 N ATOM 351 CA GLU A 23 -2.423 -10.377 41.925 1.00 0.40 C ATOM 352 C GLU A 23 -1.375 -9.513 41.216 1.00 0.37 C ATOM 353 O GLU A 23 -0.275 -9.326 41.698 1.00 0.39 O ATOM 354 CB GLU A 23 -2.500 -11.759 41.274 1.00 0.44 C ATOM 355 CG GLU A 23 -1.196 -12.518 41.530 1.00 1.22 C ATOM 356 CD GLU A 23 -1.234 -13.861 40.797 1.00 1.62 C ATOM 357 OE1 GLU A 23 -2.220 -14.121 40.130 1.00 2.37 O ATOM 358 OE2 GLU A 23 -0.274 -14.605 40.917 1.00 2.01 O ATOM 0 H GLU A 23 -4.461 -10.399 41.288 1.00 0.36 H new ATOM 0 HA GLU A 23 -2.138 -10.435 42.976 1.00 0.40 H new ATOM 0 HB2 GLU A 23 -3.344 -12.317 41.680 1.00 0.44 H new ATOM 0 HB3 GLU A 23 -2.670 -11.659 40.202 1.00 0.44 H new ATOM 0 HG2 GLU A 23 -0.346 -11.928 41.186 1.00 1.22 H new ATOM 0 HG3 GLU A 23 -1.061 -12.679 42.599 1.00 1.22 H new ATOM 365 N LEU A 24 -1.728 -8.956 40.092 1.00 0.34 N ATOM 366 CA LEU A 24 -0.778 -8.077 39.355 1.00 0.33 C ATOM 367 C LEU A 24 -0.801 -6.659 39.927 1.00 0.29 C ATOM 368 O LEU A 24 0.205 -5.985 39.959 1.00 0.29 O ATOM 369 CB LEU A 24 -1.264 -8.085 37.906 1.00 0.33 C ATOM 370 CG LEU A 24 -1.122 -9.494 37.326 1.00 0.94 C ATOM 371 CD1 LEU A 24 -1.488 -9.474 35.839 1.00 1.41 C ATOM 372 CD2 LEU A 24 0.325 -9.965 37.486 1.00 1.75 C ATOM 0 H LEU A 24 -2.639 -9.072 39.649 1.00 0.34 H new ATOM 0 HA LEU A 24 0.250 -8.429 39.439 1.00 0.33 H new ATOM 0 HB2 LEU A 24 -2.305 -7.764 37.859 1.00 0.33 H new ATOM 0 HB3 LEU A 24 -0.685 -7.377 37.313 1.00 0.33 H new ATOM 0 HG LEU A 24 -1.789 -10.174 37.856 1.00 0.94 H new ATOM 0 HD11 LEU A 24 -1.387 -10.478 35.426 1.00 1.41 H new ATOM 0 HD12 LEU A 24 -2.518 -9.136 35.722 1.00 1.41 H new ATOM 0 HD13 LEU A 24 -0.820 -8.795 35.309 1.00 1.41 H new ATOM 0 HD21 LEU A 24 0.429 -10.969 37.074 1.00 1.75 H new ATOM 0 HD22 LEU A 24 0.990 -9.284 36.955 1.00 1.75 H new ATOM 0 HD23 LEU A 24 0.588 -9.978 38.544 1.00 1.75 H new ATOM 384 N ARG A 25 -1.913 -6.229 40.459 1.00 0.25 N ATOM 385 CA ARG A 25 -1.932 -4.889 41.111 1.00 0.23 C ATOM 386 C ARG A 25 -0.881 -4.855 42.217 1.00 0.25 C ATOM 387 O ARG A 25 -0.171 -3.885 42.386 1.00 0.25 O ATOM 388 CB ARG A 25 -3.329 -4.727 41.720 1.00 0.22 C ATOM 389 CG ARG A 25 -4.406 -4.774 40.633 1.00 0.21 C ATOM 390 CD ARG A 25 -5.756 -4.385 41.253 1.00 0.22 C ATOM 391 NE ARG A 25 -6.786 -4.918 40.325 1.00 0.23 N ATOM 392 CZ ARG A 25 -8.011 -5.101 40.740 1.00 0.26 C ATOM 393 NH1 ARG A 25 -8.341 -4.802 41.968 1.00 0.30 N ATOM 394 NH2 ARG A 25 -8.909 -5.582 39.924 1.00 0.27 N ATOM 0 H ARG A 25 -2.796 -6.739 40.471 1.00 0.25 H new ATOM 0 HA ARG A 25 -1.714 -4.090 40.402 1.00 0.23 H new ATOM 0 HB2 ARG A 25 -3.507 -5.518 42.449 1.00 0.22 H new ATOM 0 HB3 ARG A 25 -3.389 -3.780 42.257 1.00 0.22 H new ATOM 0 HG2 ARG A 25 -4.153 -4.091 39.822 1.00 0.21 H new ATOM 0 HG3 ARG A 25 -4.463 -5.774 40.202 1.00 0.21 H new ATOM 0 HD2 ARG A 25 -5.868 -4.811 42.250 1.00 0.22 H new ATOM 0 HD3 ARG A 25 -5.843 -3.303 41.357 1.00 0.22 H new ATOM 0 HE ARG A 25 -6.536 -5.142 39.362 1.00 0.23 H new ATOM 0 HH11 ARG A 25 -7.641 -4.424 42.607 1.00 0.30 H new ATOM 0 HH12 ARG A 25 -9.299 -4.946 42.288 1.00 0.30 H new ATOM 0 HH21 ARG A 25 -8.654 -5.814 38.964 1.00 0.27 H new ATOM 0 HH22 ARG A 25 -9.866 -5.726 40.246 1.00 0.27 H new ATOM 408 N ARG A 26 -0.809 -5.897 42.997 1.00 0.29 N ATOM 409 CA ARG A 26 0.162 -5.913 44.130 1.00 0.33 C ATOM 410 C ARG A 26 1.594 -6.086 43.612 1.00 0.35 C ATOM 411 O ARG A 26 2.491 -5.355 43.981 1.00 0.35 O ATOM 412 CB ARG A 26 -0.244 -7.118 44.978 1.00 0.37 C ATOM 413 CG ARG A 26 0.611 -7.162 46.246 1.00 1.07 C ATOM 414 CD ARG A 26 0.184 -6.036 47.190 1.00 1.25 C ATOM 415 NE ARG A 26 1.115 -6.130 48.348 1.00 1.85 N ATOM 416 CZ ARG A 26 0.962 -5.344 49.380 1.00 2.32 C ATOM 417 NH1 ARG A 26 -0.010 -4.471 49.401 1.00 2.40 N ATOM 418 NH2 ARG A 26 1.780 -5.432 50.392 1.00 3.26 N ATOM 0 H ARG A 26 -1.379 -6.738 42.901 1.00 0.29 H new ATOM 0 HA ARG A 26 0.143 -4.982 44.697 1.00 0.33 H new ATOM 0 HB2 ARG A 26 -1.300 -7.052 45.241 1.00 0.37 H new ATOM 0 HB3 ARG A 26 -0.115 -8.038 44.407 1.00 0.37 H new ATOM 0 HG2 ARG A 26 0.498 -8.127 46.740 1.00 1.07 H new ATOM 0 HG3 ARG A 26 1.665 -7.056 45.990 1.00 1.07 H new ATOM 0 HD2 ARG A 26 0.257 -5.064 46.703 1.00 1.25 H new ATOM 0 HD3 ARG A 26 -0.852 -6.157 47.506 1.00 1.25 H new ATOM 0 HE ARG A 26 1.875 -6.810 48.335 1.00 1.85 H new ATOM 0 HH11 ARG A 26 -0.651 -4.402 48.611 1.00 2.40 H new ATOM 0 HH12 ARG A 26 -0.128 -3.858 50.208 1.00 2.40 H new ATOM 0 HH21 ARG A 26 2.538 -6.114 50.377 1.00 3.26 H new ATOM 0 HH22 ARG A 26 1.661 -4.819 51.198 1.00 3.26 H new ATOM 432 N THR A 27 1.819 -7.069 42.786 1.00 0.37 N ATOM 433 CA THR A 27 3.200 -7.324 42.280 1.00 0.41 C ATOM 434 C THR A 27 3.710 -6.146 41.445 1.00 0.39 C ATOM 435 O THR A 27 4.897 -5.894 41.376 1.00 0.42 O ATOM 436 CB THR A 27 3.078 -8.579 41.414 1.00 0.44 C ATOM 437 OG1 THR A 27 2.493 -9.624 42.178 1.00 0.61 O ATOM 438 CG2 THR A 27 4.466 -9.009 40.935 1.00 0.77 C ATOM 0 H THR A 27 1.106 -7.709 42.438 1.00 0.37 H new ATOM 0 HA THR A 27 3.911 -7.451 43.097 1.00 0.41 H new ATOM 0 HB THR A 27 2.449 -8.365 40.550 1.00 0.44 H new ATOM 0 HG1 THR A 27 1.522 -9.619 42.049 1.00 0.61 H new ATOM 0 HG21 THR A 27 4.377 -9.903 40.318 1.00 0.77 H new ATOM 0 HG22 THR A 27 4.913 -8.207 40.348 1.00 0.77 H new ATOM 0 HG23 THR A 27 5.098 -9.224 41.797 1.00 0.77 H new ATOM 446 N LEU A 28 2.836 -5.455 40.769 1.00 0.35 N ATOM 447 CA LEU A 28 3.293 -4.340 39.893 1.00 0.34 C ATOM 448 C LEU A 28 3.388 -3.031 40.684 1.00 0.32 C ATOM 449 O LEU A 28 3.840 -2.024 40.176 1.00 0.33 O ATOM 450 CB LEU A 28 2.227 -4.236 38.799 1.00 0.32 C ATOM 451 CG LEU A 28 2.715 -3.293 37.699 1.00 0.44 C ATOM 452 CD1 LEU A 28 3.828 -3.975 36.898 1.00 0.70 C ATOM 453 CD2 LEU A 28 1.551 -2.955 36.764 1.00 1.05 C ATOM 0 H LEU A 28 1.828 -5.613 40.784 1.00 0.35 H new ATOM 0 HA LEU A 28 4.286 -4.523 39.482 1.00 0.34 H new ATOM 0 HB2 LEU A 28 2.021 -5.222 38.382 1.00 0.32 H new ATOM 0 HB3 LEU A 28 1.292 -3.867 39.221 1.00 0.32 H new ATOM 0 HG LEU A 28 3.099 -2.378 38.150 1.00 0.44 H new ATOM 0 HD11 LEU A 28 4.176 -3.303 36.114 1.00 0.70 H new ATOM 0 HD12 LEU A 28 4.658 -4.218 37.562 1.00 0.70 H new ATOM 0 HD13 LEU A 28 3.444 -4.890 36.447 1.00 0.70 H new ATOM 0 HD21 LEU A 28 1.898 -2.283 35.979 1.00 1.05 H new ATOM 0 HD22 LEU A 28 1.168 -3.871 36.314 1.00 1.05 H new ATOM 0 HD23 LEU A 28 0.757 -2.470 37.332 1.00 1.05 H new ATOM 465 N GLY A 29 2.984 -3.037 41.925 1.00 0.32 N ATOM 466 CA GLY A 29 3.074 -1.790 42.738 1.00 0.32 C ATOM 467 C GLY A 29 2.142 -0.729 42.155 1.00 0.29 C ATOM 468 O GLY A 29 2.494 0.430 42.049 1.00 0.29 O ATOM 0 H GLY A 29 2.597 -3.847 42.410 1.00 0.32 H new ATOM 0 HA2 GLY A 29 2.802 -1.998 43.773 1.00 0.32 H new ATOM 0 HA3 GLY A 29 4.100 -1.422 42.746 1.00 0.32 H new ATOM 472 N ILE A 30 0.964 -1.115 41.760 1.00 0.27 N ATOM 473 CA ILE A 30 0.018 -0.128 41.162 1.00 0.24 C ATOM 474 C ILE A 30 -1.230 0.020 42.035 1.00 0.23 C ATOM 475 O ILE A 30 -1.750 -0.939 42.569 1.00 0.26 O ATOM 476 CB ILE A 30 -0.350 -0.694 39.795 1.00 0.26 C ATOM 477 CG1 ILE A 30 0.920 -0.888 38.963 1.00 0.41 C ATOM 478 CG2 ILE A 30 -1.286 0.277 39.073 1.00 0.33 C ATOM 479 CD1 ILE A 30 1.729 0.413 38.960 1.00 0.29 C ATOM 0 H ILE A 30 0.612 -2.070 41.824 1.00 0.27 H new ATOM 0 HA ILE A 30 0.466 0.863 41.083 1.00 0.24 H new ATOM 0 HB ILE A 30 -0.851 -1.653 39.925 1.00 0.26 H new ATOM 0 HG12 ILE A 30 1.518 -1.700 39.376 1.00 0.41 H new ATOM 0 HG13 ILE A 30 0.660 -1.170 37.943 1.00 0.41 H new ATOM 0 HG21 ILE A 30 -1.548 -0.129 38.096 1.00 0.33 H new ATOM 0 HG22 ILE A 30 -2.192 0.416 39.663 1.00 0.33 H new ATOM 0 HG23 ILE A 30 -0.786 1.237 38.945 1.00 0.33 H new ATOM 0 HD11 ILE A 30 2.634 0.277 38.368 1.00 0.29 H new ATOM 0 HD12 ILE A 30 1.129 1.214 38.527 1.00 0.29 H new ATOM 0 HD13 ILE A 30 2.000 0.675 39.983 1.00 0.29 H new ATOM 491 N ALA A 31 -1.682 1.227 42.210 1.00 0.22 N ATOM 492 CA ALA A 31 -2.864 1.475 43.084 1.00 0.23 C ATOM 493 C ALA A 31 -3.733 2.584 42.487 1.00 0.20 C ATOM 494 O ALA A 31 -3.324 3.290 41.586 1.00 0.18 O ATOM 495 CB ALA A 31 -2.280 1.925 44.421 1.00 0.23 C ATOM 0 H ALA A 31 -1.281 2.062 41.782 1.00 0.22 H new ATOM 0 HA ALA A 31 -3.493 0.591 43.188 1.00 0.23 H new ATOM 0 HB1 ALA A 31 -3.090 2.128 45.122 1.00 0.23 H new ATOM 0 HB2 ALA A 31 -1.641 1.138 44.822 1.00 0.23 H new ATOM 0 HB3 ALA A 31 -1.691 2.831 44.275 1.00 0.23 H new ATOM 501 N GLU A 32 -4.930 2.744 42.976 1.00 0.22 N ATOM 502 CA GLU A 32 -5.822 3.804 42.427 1.00 0.21 C ATOM 503 C GLU A 32 -5.117 5.166 42.451 1.00 0.19 C ATOM 504 O GLU A 32 -4.363 5.468 43.354 1.00 0.20 O ATOM 505 CB GLU A 32 -7.036 3.816 43.357 1.00 0.25 C ATOM 506 CG GLU A 32 -8.093 4.774 42.803 1.00 0.27 C ATOM 507 CD GLU A 32 -9.263 4.865 43.784 1.00 0.32 C ATOM 508 OE1 GLU A 32 -9.194 4.225 44.820 1.00 1.12 O ATOM 509 OE2 GLU A 32 -10.210 5.574 43.482 1.00 1.13 O ATOM 0 H GLU A 32 -5.330 2.188 43.732 1.00 0.22 H new ATOM 0 HA GLU A 32 -6.098 3.611 41.390 1.00 0.21 H new ATOM 0 HB2 GLU A 32 -7.450 2.812 43.445 1.00 0.25 H new ATOM 0 HB3 GLU A 32 -6.737 4.126 44.358 1.00 0.25 H new ATOM 0 HG2 GLU A 32 -7.658 5.761 42.646 1.00 0.27 H new ATOM 0 HG3 GLU A 32 -8.444 4.423 41.833 1.00 0.27 H new ATOM 516 N LYS A 33 -5.400 6.000 41.484 1.00 0.19 N ATOM 517 CA LYS A 33 -4.809 7.377 41.445 1.00 0.20 C ATOM 518 C LYS A 33 -3.333 7.333 41.027 1.00 0.18 C ATOM 519 O LYS A 33 -2.729 8.355 40.771 1.00 0.21 O ATOM 520 CB LYS A 33 -4.946 7.928 42.869 1.00 0.23 C ATOM 521 CG LYS A 33 -4.788 9.449 42.841 1.00 0.29 C ATOM 522 CD LYS A 33 -4.860 9.996 44.268 1.00 0.87 C ATOM 523 CE LYS A 33 -4.857 11.527 44.230 1.00 1.35 C ATOM 524 NZ LYS A 33 -3.434 11.914 44.436 1.00 1.88 N ATOM 0 H LYS A 33 -6.025 5.784 40.707 1.00 0.19 H new ATOM 0 HA LYS A 33 -5.320 8.005 40.716 1.00 0.20 H new ATOM 0 HB2 LYS A 33 -5.918 7.660 43.283 1.00 0.23 H new ATOM 0 HB3 LYS A 33 -4.190 7.484 43.517 1.00 0.23 H new ATOM 0 HG2 LYS A 33 -3.835 9.718 42.385 1.00 0.29 H new ATOM 0 HG3 LYS A 33 -5.572 9.895 42.229 1.00 0.29 H new ATOM 0 HD2 LYS A 33 -5.763 9.636 44.762 1.00 0.87 H new ATOM 0 HD3 LYS A 33 -4.012 9.635 44.850 1.00 0.87 H new ATOM 0 HE2 LYS A 33 -5.233 11.899 43.277 1.00 1.35 H new ATOM 0 HE3 LYS A 33 -5.496 11.943 45.009 1.00 1.35 H new ATOM 0 HZ1 LYS A 33 -3.351 12.951 44.423 1.00 1.88 H new ATOM 0 HZ2 LYS A 33 -3.105 11.552 45.354 1.00 1.88 H new ATOM 0 HZ3 LYS A 33 -2.851 11.510 43.676 1.00 1.88 H new ATOM 538 N ASP A 34 -2.773 6.165 40.859 1.00 0.16 N ATOM 539 CA ASP A 34 -1.375 6.085 40.344 1.00 0.16 C ATOM 540 C ASP A 34 -1.358 6.319 38.833 1.00 0.19 C ATOM 541 O ASP A 34 -2.390 6.361 38.194 1.00 0.20 O ATOM 542 CB ASP A 34 -0.903 4.673 40.677 1.00 0.17 C ATOM 543 CG ASP A 34 -0.636 4.574 42.179 1.00 0.18 C ATOM 544 OD1 ASP A 34 -0.694 5.596 42.843 1.00 1.10 O ATOM 545 OD2 ASP A 34 -0.378 3.476 42.638 1.00 1.08 O ATOM 0 H ASP A 34 -3.219 5.269 41.054 1.00 0.16 H new ATOM 0 HA ASP A 34 -0.728 6.840 40.790 1.00 0.16 H new ATOM 0 HB2 ASP A 34 -1.658 3.945 40.381 1.00 0.17 H new ATOM 0 HB3 ASP A 34 0.003 4.438 40.118 1.00 0.17 H new ATOM 550 N ALA A 35 -0.203 6.545 38.267 1.00 0.22 N ATOM 551 CA ALA A 35 -0.141 6.864 36.810 1.00 0.28 C ATOM 552 C ALA A 35 0.352 5.654 36.010 1.00 0.20 C ATOM 553 O ALA A 35 1.403 5.106 36.277 1.00 0.16 O ATOM 554 CB ALA A 35 0.853 8.021 36.703 1.00 0.36 C ATOM 0 H ALA A 35 0.697 6.523 38.747 1.00 0.22 H new ATOM 0 HA ALA A 35 -1.120 7.124 36.406 1.00 0.28 H new ATOM 0 HB1 ALA A 35 0.956 8.317 35.659 1.00 0.36 H new ATOM 0 HB2 ALA A 35 0.490 8.868 37.286 1.00 0.36 H new ATOM 0 HB3 ALA A 35 1.822 7.705 37.088 1.00 0.36 H new ATOM 560 N LEU A 36 -0.347 5.309 34.963 1.00 0.24 N ATOM 561 CA LEU A 36 0.131 4.222 34.059 1.00 0.21 C ATOM 562 C LEU A 36 0.624 4.832 32.747 1.00 0.20 C ATOM 563 O LEU A 36 -0.014 5.704 32.194 1.00 0.23 O ATOM 564 CB LEU A 36 -1.100 3.357 33.789 1.00 0.34 C ATOM 565 CG LEU A 36 -1.801 3.016 35.103 1.00 0.45 C ATOM 566 CD1 LEU A 36 -3.236 2.583 34.803 1.00 0.55 C ATOM 567 CD2 LEU A 36 -1.058 1.871 35.796 1.00 0.56 C ATOM 0 H LEU A 36 -1.233 5.735 34.693 1.00 0.24 H new ATOM 0 HA LEU A 36 0.949 3.650 34.496 1.00 0.21 H new ATOM 0 HB2 LEU A 36 -1.787 3.885 33.128 1.00 0.34 H new ATOM 0 HB3 LEU A 36 -0.805 2.441 33.277 1.00 0.34 H new ATOM 0 HG LEU A 36 -1.807 3.889 35.755 1.00 0.45 H new ATOM 0 HD11 LEU A 36 -3.744 2.337 35.735 1.00 0.55 H new ATOM 0 HD12 LEU A 36 -3.765 3.396 34.305 1.00 0.55 H new ATOM 0 HD13 LEU A 36 -3.224 1.707 34.155 1.00 0.55 H new ATOM 0 HD21 LEU A 36 -1.558 1.628 36.734 1.00 0.56 H new ATOM 0 HD22 LEU A 36 -1.055 0.994 35.148 1.00 0.56 H new ATOM 0 HD23 LEU A 36 -0.031 2.175 36.001 1.00 0.56 H new ATOM 579 N GLU A 37 1.663 4.296 32.170 1.00 0.19 N ATOM 580 CA GLU A 37 2.065 4.771 30.818 1.00 0.21 C ATOM 581 C GLU A 37 1.719 3.706 29.777 1.00 0.19 C ATOM 582 O GLU A 37 1.783 2.521 30.043 1.00 0.20 O ATOM 583 CB GLU A 37 3.576 4.998 30.898 1.00 0.25 C ATOM 584 CG GLU A 37 4.065 5.650 29.603 1.00 0.26 C ATOM 585 CD GLU A 37 5.583 5.837 29.669 1.00 0.37 C ATOM 586 OE1 GLU A 37 6.167 5.440 30.663 1.00 1.08 O ATOM 587 OE2 GLU A 37 6.135 6.374 28.722 1.00 1.17 O ATOM 0 H GLU A 37 2.244 3.559 32.570 1.00 0.19 H new ATOM 0 HA GLU A 37 1.548 5.684 30.523 1.00 0.21 H new ATOM 0 HB2 GLU A 37 3.814 5.635 31.750 1.00 0.25 H new ATOM 0 HB3 GLU A 37 4.089 4.049 31.056 1.00 0.25 H new ATOM 0 HG2 GLU A 37 3.801 5.028 28.748 1.00 0.26 H new ATOM 0 HG3 GLU A 37 3.575 6.613 29.460 1.00 0.26 H new ATOM 594 N ILE A 38 1.199 4.122 28.659 1.00 0.21 N ATOM 595 CA ILE A 38 0.664 3.146 27.671 1.00 0.20 C ATOM 596 C ILE A 38 1.573 3.069 26.446 1.00 0.20 C ATOM 597 O ILE A 38 2.013 4.075 25.916 1.00 0.24 O ATOM 598 CB ILE A 38 -0.712 3.688 27.282 1.00 0.26 C ATOM 599 CG1 ILE A 38 -1.573 3.839 28.539 1.00 0.80 C ATOM 600 CG2 ILE A 38 -1.391 2.716 26.315 1.00 0.73 C ATOM 601 CD1 ILE A 38 -2.903 4.498 28.172 1.00 0.84 C ATOM 0 H ILE A 38 1.121 5.101 28.385 1.00 0.21 H new ATOM 0 HA ILE A 38 0.606 2.139 28.083 1.00 0.20 H new ATOM 0 HB ILE A 38 -0.596 4.658 26.799 1.00 0.26 H new ATOM 0 HG12 ILE A 38 -1.751 2.863 28.990 1.00 0.80 H new ATOM 0 HG13 ILE A 38 -1.049 4.442 29.281 1.00 0.80 H new ATOM 0 HG21 ILE A 38 -2.372 3.103 26.039 1.00 0.73 H new ATOM 0 HG22 ILE A 38 -0.779 2.606 25.420 1.00 0.73 H new ATOM 0 HG23 ILE A 38 -1.507 1.745 26.797 1.00 0.73 H new ATOM 0 HD11 ILE A 38 -3.515 4.605 29.067 1.00 0.84 H new ATOM 0 HD12 ILE A 38 -2.715 5.481 27.741 1.00 0.84 H new ATOM 0 HD13 ILE A 38 -3.428 3.878 27.445 1.00 0.84 H new ATOM 613 N TYR A 39 1.875 1.873 26.025 1.00 0.19 N ATOM 614 CA TYR A 39 2.786 1.666 24.866 1.00 0.21 C ATOM 615 C TYR A 39 2.057 0.903 23.756 1.00 0.20 C ATOM 616 O TYR A 39 1.150 0.139 24.016 1.00 0.20 O ATOM 617 CB TYR A 39 3.912 0.802 25.426 1.00 0.24 C ATOM 618 CG TYR A 39 4.908 1.647 26.169 1.00 0.28 C ATOM 619 CD1 TYR A 39 4.516 2.368 27.300 1.00 0.32 C ATOM 620 CD2 TYR A 39 6.232 1.688 25.733 1.00 0.31 C ATOM 621 CE1 TYR A 39 5.454 3.135 27.998 1.00 0.37 C ATOM 622 CE2 TYR A 39 7.172 2.455 26.426 1.00 0.36 C ATOM 623 CZ TYR A 39 6.784 3.180 27.562 1.00 0.39 C ATOM 624 OH TYR A 39 7.711 3.938 28.248 1.00 0.45 O ATOM 0 H TYR A 39 1.521 1.013 26.444 1.00 0.19 H new ATOM 0 HA TYR A 39 3.141 2.604 24.439 1.00 0.21 H new ATOM 0 HB2 TYR A 39 3.499 0.045 26.093 1.00 0.24 H new ATOM 0 HB3 TYR A 39 4.410 0.273 24.614 1.00 0.24 H new ATOM 0 HD1 TYR A 39 3.490 2.333 27.635 1.00 0.32 H new ATOM 0 HD2 TYR A 39 6.531 1.127 24.860 1.00 0.31 H new ATOM 0 HE1 TYR A 39 5.153 3.692 28.873 1.00 0.37 H new ATOM 0 HE2 TYR A 39 8.197 2.490 26.087 1.00 0.36 H new ATOM 0 HH TYR A 39 8.504 3.394 28.436 1.00 0.45 H new ATOM 634 N VAL A 40 2.534 0.987 22.546 1.00 0.21 N ATOM 635 CA VAL A 40 1.956 0.133 21.467 1.00 0.22 C ATOM 636 C VAL A 40 3.068 -0.536 20.653 1.00 0.22 C ATOM 637 O VAL A 40 3.931 0.122 20.108 1.00 0.23 O ATOM 638 CB VAL A 40 1.152 1.087 20.586 1.00 0.25 C ATOM 639 CG1 VAL A 40 0.625 0.330 19.366 1.00 0.27 C ATOM 640 CG2 VAL A 40 -0.027 1.642 21.388 1.00 0.27 C ATOM 0 H VAL A 40 3.293 1.604 22.257 1.00 0.21 H new ATOM 0 HA VAL A 40 1.338 -0.668 21.873 1.00 0.22 H new ATOM 0 HB VAL A 40 1.790 1.907 20.257 1.00 0.25 H new ATOM 0 HG11 VAL A 40 0.051 1.010 18.736 1.00 0.27 H new ATOM 0 HG12 VAL A 40 1.463 -0.071 18.797 1.00 0.27 H new ATOM 0 HG13 VAL A 40 -0.015 -0.489 19.694 1.00 0.27 H new ATOM 0 HG21 VAL A 40 -0.604 2.324 20.763 1.00 0.27 H new ATOM 0 HG22 VAL A 40 -0.665 0.820 21.713 1.00 0.27 H new ATOM 0 HG23 VAL A 40 0.347 2.178 22.260 1.00 0.27 H new ATOM 650 N ASP A 41 3.043 -1.838 20.552 1.00 0.21 N ATOM 651 CA ASP A 41 4.084 -2.542 19.750 1.00 0.22 C ATOM 652 C ASP A 41 3.502 -3.804 19.100 1.00 0.25 C ATOM 653 O ASP A 41 2.743 -4.528 19.705 1.00 0.27 O ATOM 654 CB ASP A 41 5.175 -2.910 20.756 1.00 0.20 C ATOM 655 CG ASP A 41 4.613 -3.886 21.791 1.00 1.01 C ATOM 656 OD1 ASP A 41 3.402 -4.005 21.869 1.00 1.69 O ATOM 657 OD2 ASP A 41 5.405 -4.495 22.491 1.00 1.77 O ATOM 0 H ASP A 41 2.348 -2.443 20.989 1.00 0.21 H new ATOM 0 HA ASP A 41 4.466 -1.922 18.939 1.00 0.22 H new ATOM 0 HB2 ASP A 41 6.023 -3.361 20.240 1.00 0.20 H new ATOM 0 HB3 ASP A 41 5.544 -2.012 21.251 1.00 0.20 H new ATOM 662 N ASP A 42 3.944 -4.132 17.918 1.00 0.27 N ATOM 663 CA ASP A 42 3.519 -5.414 17.284 1.00 0.33 C ATOM 664 C ASP A 42 2.015 -5.658 17.474 1.00 0.33 C ATOM 665 O ASP A 42 1.587 -6.767 17.720 1.00 0.37 O ATOM 666 CB ASP A 42 4.331 -6.487 18.007 1.00 0.38 C ATOM 667 CG ASP A 42 3.947 -7.868 17.474 1.00 0.45 C ATOM 668 OD1 ASP A 42 3.211 -7.923 16.502 1.00 1.22 O ATOM 669 OD2 ASP A 42 4.396 -8.849 18.044 1.00 1.14 O ATOM 0 H ASP A 42 4.584 -3.566 17.361 1.00 0.27 H new ATOM 0 HA ASP A 42 3.691 -5.412 16.208 1.00 0.33 H new ATOM 0 HB2 ASP A 42 5.397 -6.312 17.859 1.00 0.38 H new ATOM 0 HB3 ASP A 42 4.146 -6.436 19.080 1.00 0.38 H new ATOM 674 N GLU A 43 1.207 -4.649 17.284 1.00 0.30 N ATOM 675 CA GLU A 43 -0.274 -4.844 17.363 1.00 0.31 C ATOM 676 C GLU A 43 -0.684 -5.315 18.763 1.00 0.30 C ATOM 677 O GLU A 43 -1.830 -5.640 19.008 1.00 0.31 O ATOM 678 CB GLU A 43 -0.592 -5.919 16.321 1.00 0.35 C ATOM 679 CG GLU A 43 -2.108 -6.028 16.144 1.00 1.17 C ATOM 680 CD GLU A 43 -2.636 -4.761 15.468 1.00 1.34 C ATOM 681 OE1 GLU A 43 -1.864 -4.114 14.781 1.00 1.93 O ATOM 682 OE2 GLU A 43 -3.805 -4.459 15.650 1.00 1.68 O ATOM 0 H GLU A 43 1.507 -3.696 17.077 1.00 0.30 H new ATOM 0 HA GLU A 43 -0.816 -3.918 17.174 1.00 0.31 H new ATOM 0 HB2 GLU A 43 -0.122 -5.669 15.370 1.00 0.35 H new ATOM 0 HB3 GLU A 43 -0.182 -6.879 16.637 1.00 0.35 H new ATOM 0 HG2 GLU A 43 -2.352 -6.903 15.542 1.00 1.17 H new ATOM 0 HG3 GLU A 43 -2.589 -6.163 17.113 1.00 1.17 H new ATOM 689 N LYS A 44 0.218 -5.271 19.699 1.00 0.29 N ATOM 690 CA LYS A 44 -0.141 -5.622 21.103 1.00 0.30 C ATOM 691 C LYS A 44 -0.124 -4.368 21.977 1.00 0.27 C ATOM 692 O LYS A 44 0.614 -3.437 21.728 1.00 0.26 O ATOM 693 CB LYS A 44 0.937 -6.602 21.567 1.00 0.34 C ATOM 694 CG LYS A 44 0.768 -7.940 20.848 1.00 1.29 C ATOM 695 CD LYS A 44 1.755 -8.953 21.431 1.00 1.23 C ATOM 696 CE LYS A 44 1.574 -10.304 20.738 1.00 1.90 C ATOM 697 NZ LYS A 44 2.561 -10.301 19.623 1.00 2.01 N ATOM 0 H LYS A 44 1.192 -5.007 19.555 1.00 0.29 H new ATOM 0 HA LYS A 44 -1.139 -6.055 21.172 1.00 0.30 H new ATOM 0 HB2 LYS A 44 1.926 -6.192 21.363 1.00 0.34 H new ATOM 0 HB3 LYS A 44 0.869 -6.747 22.645 1.00 0.34 H new ATOM 0 HG2 LYS A 44 -0.254 -8.302 20.963 1.00 1.29 H new ATOM 0 HG3 LYS A 44 0.944 -7.817 19.779 1.00 1.29 H new ATOM 0 HD2 LYS A 44 2.777 -8.598 21.297 1.00 1.23 H new ATOM 0 HD3 LYS A 44 1.592 -9.059 22.504 1.00 1.23 H new ATOM 0 HE2 LYS A 44 1.759 -11.129 21.426 1.00 1.90 H new ATOM 0 HE3 LYS A 44 0.557 -10.423 20.364 1.00 1.90 H new ATOM 0 HZ1 LYS A 44 2.112 -10.671 18.761 1.00 2.01 H new ATOM 0 HZ2 LYS A 44 2.889 -9.329 19.452 1.00 2.01 H new ATOM 0 HZ3 LYS A 44 3.372 -10.901 19.876 1.00 2.01 H new ATOM 711 N ILE A 45 -0.886 -4.363 23.034 1.00 0.28 N ATOM 712 CA ILE A 45 -0.859 -3.197 23.960 1.00 0.27 C ATOM 713 C ILE A 45 0.142 -3.456 25.089 1.00 0.27 C ATOM 714 O ILE A 45 0.099 -4.479 25.744 1.00 0.29 O ATOM 715 CB ILE A 45 -2.280 -3.107 24.512 1.00 0.30 C ATOM 716 CG1 ILE A 45 -3.268 -2.986 23.349 1.00 0.34 C ATOM 717 CG2 ILE A 45 -2.401 -1.876 25.411 1.00 0.29 C ATOM 718 CD1 ILE A 45 -4.690 -3.194 23.867 1.00 1.25 C ATOM 0 H ILE A 45 -1.525 -5.114 23.297 1.00 0.28 H new ATOM 0 HA ILE A 45 -0.554 -2.274 23.467 1.00 0.27 H new ATOM 0 HB ILE A 45 -2.504 -4.003 25.091 1.00 0.30 H new ATOM 0 HG12 ILE A 45 -3.179 -2.005 22.883 1.00 0.34 H new ATOM 0 HG13 ILE A 45 -3.037 -3.726 22.582 1.00 0.34 H new ATOM 0 HG21 ILE A 45 -3.415 -1.812 25.805 1.00 0.29 H new ATOM 0 HG22 ILE A 45 -1.695 -1.958 26.237 1.00 0.29 H new ATOM 0 HG23 ILE A 45 -2.179 -0.979 24.832 1.00 0.29 H new ATOM 0 HD11 ILE A 45 -5.395 -3.108 23.040 1.00 1.25 H new ATOM 0 HD12 ILE A 45 -4.773 -4.185 24.313 1.00 1.25 H new ATOM 0 HD13 ILE A 45 -4.918 -2.438 24.618 1.00 1.25 H new ATOM 730 N ILE A 46 1.037 -2.536 25.317 1.00 0.26 N ATOM 731 CA ILE A 46 2.046 -2.719 26.400 1.00 0.29 C ATOM 732 C ILE A 46 1.810 -1.694 27.512 1.00 0.29 C ATOM 733 O ILE A 46 1.880 -0.505 27.295 1.00 0.31 O ATOM 734 CB ILE A 46 3.398 -2.479 25.716 1.00 0.32 C ATOM 735 CG1 ILE A 46 3.585 -3.493 24.584 1.00 0.44 C ATOM 736 CG2 ILE A 46 4.536 -2.624 26.733 1.00 0.37 C ATOM 737 CD1 ILE A 46 3.230 -4.892 25.085 1.00 0.50 C ATOM 0 H ILE A 46 1.114 -1.661 24.798 1.00 0.26 H new ATOM 0 HA ILE A 46 1.993 -3.704 26.863 1.00 0.29 H new ATOM 0 HB ILE A 46 3.417 -1.469 25.307 1.00 0.32 H new ATOM 0 HG12 ILE A 46 2.953 -3.228 23.737 1.00 0.44 H new ATOM 0 HG13 ILE A 46 4.616 -3.473 24.231 1.00 0.44 H new ATOM 0 HG21 ILE A 46 5.491 -2.452 26.237 1.00 0.37 H new ATOM 0 HG22 ILE A 46 4.405 -1.894 27.532 1.00 0.37 H new ATOM 0 HG23 ILE A 46 4.522 -3.629 27.154 1.00 0.37 H new ATOM 0 HD11 ILE A 46 3.364 -5.612 24.278 1.00 0.50 H new ATOM 0 HD12 ILE A 46 3.881 -5.156 25.919 1.00 0.50 H new ATOM 0 HD13 ILE A 46 2.192 -4.907 25.417 1.00 0.50 H new ATOM 749 N LEU A 47 1.521 -2.143 28.703 1.00 0.28 N ATOM 750 CA LEU A 47 1.276 -1.181 29.817 1.00 0.29 C ATOM 751 C LEU A 47 2.344 -1.340 30.899 1.00 0.31 C ATOM 752 O LEU A 47 2.688 -2.437 31.287 1.00 0.39 O ATOM 753 CB LEU A 47 -0.097 -1.549 30.372 1.00 0.34 C ATOM 754 CG LEU A 47 -1.139 -1.487 29.253 1.00 0.90 C ATOM 755 CD1 LEU A 47 -1.058 -2.756 28.404 1.00 1.66 C ATOM 756 CD2 LEU A 47 -2.537 -1.374 29.866 1.00 1.24 C ATOM 0 H LEU A 47 1.444 -3.129 28.953 1.00 0.28 H new ATOM 0 HA LEU A 47 1.315 -0.146 29.477 1.00 0.29 H new ATOM 0 HB2 LEU A 47 -0.070 -2.550 30.802 1.00 0.34 H new ATOM 0 HB3 LEU A 47 -0.371 -0.865 31.175 1.00 0.34 H new ATOM 0 HG LEU A 47 -0.943 -0.618 28.624 1.00 0.90 H new ATOM 0 HD11 LEU A 47 -1.801 -2.709 27.608 1.00 1.66 H new ATOM 0 HD12 LEU A 47 -0.063 -2.839 27.967 1.00 1.66 H new ATOM 0 HD13 LEU A 47 -1.252 -3.626 29.031 1.00 1.66 H new ATOM 0 HD21 LEU A 47 -3.281 -1.330 29.070 1.00 1.24 H new ATOM 0 HD22 LEU A 47 -2.730 -2.243 30.495 1.00 1.24 H new ATOM 0 HD23 LEU A 47 -2.597 -0.469 30.470 1.00 1.24 H new ATOM 768 N LYS A 48 2.878 -0.252 31.377 1.00 0.29 N ATOM 769 CA LYS A 48 3.939 -0.339 32.422 1.00 0.35 C ATOM 770 C LYS A 48 3.781 0.796 33.435 1.00 0.28 C ATOM 771 O LYS A 48 3.178 1.811 33.152 1.00 0.25 O ATOM 772 CB LYS A 48 5.259 -0.197 31.660 1.00 0.47 C ATOM 773 CG LYS A 48 5.279 1.135 30.907 1.00 0.65 C ATOM 774 CD LYS A 48 6.587 1.255 30.124 1.00 0.85 C ATOM 775 CE LYS A 48 6.554 0.302 28.926 1.00 1.54 C ATOM 776 NZ LYS A 48 7.958 0.259 28.431 1.00 1.74 N ATOM 0 H LYS A 48 2.627 0.694 31.091 1.00 0.29 H new ATOM 0 HA LYS A 48 3.889 -1.273 32.982 1.00 0.35 H new ATOM 0 HB2 LYS A 48 6.098 -0.246 32.354 1.00 0.47 H new ATOM 0 HB3 LYS A 48 5.376 -1.024 30.959 1.00 0.47 H new ATOM 0 HG2 LYS A 48 4.429 1.194 30.228 1.00 0.65 H new ATOM 0 HG3 LYS A 48 5.185 1.964 31.609 1.00 0.65 H new ATOM 0 HD2 LYS A 48 6.726 2.281 29.783 1.00 0.85 H new ATOM 0 HD3 LYS A 48 7.433 1.016 30.769 1.00 0.85 H new ATOM 0 HE2 LYS A 48 6.208 -0.689 29.219 1.00 1.54 H new ATOM 0 HE3 LYS A 48 5.874 0.662 28.154 1.00 1.54 H new ATOM 0 HZ1 LYS A 48 8.092 -0.587 27.841 1.00 1.74 H new ATOM 0 HZ2 LYS A 48 8.153 1.110 27.866 1.00 1.74 H new ATOM 0 HZ3 LYS A 48 8.610 0.224 29.240 1.00 1.74 H new ATOM 790 N LYS A 49 4.367 0.662 34.594 1.00 0.28 N ATOM 791 CA LYS A 49 4.301 1.770 35.588 1.00 0.25 C ATOM 792 C LYS A 49 4.855 3.053 34.973 1.00 0.22 C ATOM 793 O LYS A 49 5.691 3.021 34.093 1.00 0.24 O ATOM 794 CB LYS A 49 5.172 1.316 36.756 1.00 0.29 C ATOM 795 CG LYS A 49 5.097 2.346 37.884 1.00 0.30 C ATOM 796 CD LYS A 49 6.021 1.922 39.028 1.00 0.54 C ATOM 797 CE LYS A 49 5.827 2.864 40.218 1.00 1.08 C ATOM 798 NZ LYS A 49 6.603 2.244 41.328 1.00 1.65 N ATOM 0 H LYS A 49 4.886 -0.163 34.894 1.00 0.28 H new ATOM 0 HA LYS A 49 3.280 1.980 35.906 1.00 0.25 H new ATOM 0 HB2 LYS A 49 4.837 0.343 37.116 1.00 0.29 H new ATOM 0 HB3 LYS A 49 6.204 1.196 36.428 1.00 0.29 H new ATOM 0 HG2 LYS A 49 5.388 3.329 37.513 1.00 0.30 H new ATOM 0 HG3 LYS A 49 4.072 2.432 38.244 1.00 0.30 H new ATOM 0 HD2 LYS A 49 5.803 0.896 39.324 1.00 0.54 H new ATOM 0 HD3 LYS A 49 7.060 1.945 38.698 1.00 0.54 H new ATOM 0 HE2 LYS A 49 6.192 3.866 39.992 1.00 1.08 H new ATOM 0 HE3 LYS A 49 4.773 2.960 40.478 1.00 1.08 H new ATOM 0 HZ1 LYS A 49 6.519 2.833 42.181 1.00 1.65 H new ATOM 0 HZ2 LYS A 49 6.229 1.294 41.525 1.00 1.65 H new ATOM 0 HZ3 LYS A 49 7.604 2.172 41.054 1.00 1.65 H new ATOM 812 N TYR A 50 4.332 4.178 35.366 1.00 0.20 N ATOM 813 CA TYR A 50 4.762 5.455 34.730 1.00 0.21 C ATOM 814 C TYR A 50 5.736 6.209 35.638 1.00 0.22 C ATOM 815 O TYR A 50 5.382 6.655 36.712 1.00 0.22 O ATOM 816 CB TYR A 50 3.472 6.256 34.547 1.00 0.20 C ATOM 817 CG TYR A 50 3.787 7.584 33.905 1.00 0.23 C ATOM 818 CD1 TYR A 50 4.877 7.704 33.035 1.00 0.26 C ATOM 819 CD2 TYR A 50 2.990 8.700 34.184 1.00 0.24 C ATOM 820 CE1 TYR A 50 5.168 8.939 32.443 1.00 0.30 C ATOM 821 CE2 TYR A 50 3.280 9.935 33.594 1.00 0.28 C ATOM 822 CZ TYR A 50 4.371 10.055 32.722 1.00 0.30 C ATOM 823 OH TYR A 50 4.657 11.272 32.140 1.00 0.35 O ATOM 0 H TYR A 50 3.627 4.271 36.098 1.00 0.20 H new ATOM 0 HA TYR A 50 5.281 5.288 33.786 1.00 0.21 H new ATOM 0 HB2 TYR A 50 2.771 5.698 33.927 1.00 0.20 H new ATOM 0 HB3 TYR A 50 2.989 6.413 35.512 1.00 0.20 H new ATOM 0 HD1 TYR A 50 5.494 6.844 32.820 1.00 0.26 H new ATOM 0 HD2 TYR A 50 2.150 8.608 34.856 1.00 0.24 H new ATOM 0 HE1 TYR A 50 6.008 9.030 31.771 1.00 0.30 H new ATOM 0 HE2 TYR A 50 2.664 10.795 33.810 1.00 0.28 H new ATOM 0 HH TYR A 50 4.005 11.939 32.440 1.00 0.35 H new ATOM 833 N LYS A 51 6.926 6.452 35.160 1.00 0.25 N ATOM 834 CA LYS A 51 7.882 7.297 35.930 1.00 0.29 C ATOM 835 C LYS A 51 7.874 8.724 35.374 1.00 0.32 C ATOM 836 O LYS A 51 8.090 8.930 34.196 1.00 0.35 O ATOM 837 CB LYS A 51 9.250 6.644 35.723 1.00 0.33 C ATOM 838 CG LYS A 51 9.480 6.389 34.232 1.00 1.43 C ATOM 839 CD LYS A 51 10.946 6.654 33.887 1.00 1.91 C ATOM 840 CE LYS A 51 11.188 8.164 33.812 1.00 2.76 C ATOM 841 NZ LYS A 51 11.831 8.385 32.488 1.00 3.21 N ATOM 0 H LYS A 51 7.277 6.102 34.269 1.00 0.25 H new ATOM 0 HA LYS A 51 7.624 7.362 36.987 1.00 0.29 H new ATOM 0 HB2 LYS A 51 10.035 7.290 36.117 1.00 0.33 H new ATOM 0 HB3 LYS A 51 9.303 5.705 36.275 1.00 0.33 H new ATOM 0 HG2 LYS A 51 9.218 5.361 33.984 1.00 1.43 H new ATOM 0 HG3 LYS A 51 8.834 7.035 33.638 1.00 1.43 H new ATOM 0 HD2 LYS A 51 11.594 6.208 34.641 1.00 1.91 H new ATOM 0 HD3 LYS A 51 11.197 6.187 32.935 1.00 1.91 H new ATOM 0 HE2 LYS A 51 10.253 8.718 33.894 1.00 2.76 H new ATOM 0 HE3 LYS A 51 11.831 8.502 34.625 1.00 2.76 H new ATOM 0 HZ1 LYS A 51 12.028 9.398 32.363 1.00 3.21 H new ATOM 0 HZ2 LYS A 51 12.722 7.851 32.441 1.00 3.21 H new ATOM 0 HZ3 LYS A 51 11.193 8.061 31.734 1.00 3.21 H new ATOM 855 N PRO A 52 7.597 9.666 36.234 1.00 0.33 N ATOM 856 CA PRO A 52 7.527 11.084 35.806 1.00 0.39 C ATOM 857 C PRO A 52 8.876 11.534 35.238 1.00 0.46 C ATOM 858 O PRO A 52 9.923 11.122 35.696 1.00 0.48 O ATOM 859 CB PRO A 52 7.192 11.850 37.087 1.00 0.41 C ATOM 860 CG PRO A 52 7.457 10.897 38.213 1.00 0.40 C ATOM 861 CD PRO A 52 7.328 9.503 37.662 1.00 0.33 C ATOM 0 HA PRO A 52 6.790 11.252 35.021 1.00 0.39 H new ATOM 0 HB2 PRO A 52 7.807 12.745 37.179 1.00 0.41 H new ATOM 0 HB3 PRO A 52 6.152 12.176 37.087 1.00 0.41 H new ATOM 0 HG2 PRO A 52 8.454 11.056 38.624 1.00 0.40 H new ATOM 0 HG3 PRO A 52 6.748 11.056 39.025 1.00 0.40 H new ATOM 0 HD2 PRO A 52 8.040 8.821 38.128 1.00 0.33 H new ATOM 0 HD3 PRO A 52 6.333 9.094 37.838 1.00 0.33 H new ATOM 869 N ASN A 53 8.859 12.374 34.239 1.00 0.61 N ATOM 870 CA ASN A 53 10.141 12.844 33.638 1.00 0.71 C ATOM 871 C ASN A 53 11.148 13.185 34.740 1.00 1.19 C ATOM 872 O ASN A 53 12.315 12.873 34.566 1.00 1.61 O ATOM 873 CB ASN A 53 9.770 14.098 32.845 1.00 1.36 C ATOM 874 CG ASN A 53 10.992 14.594 32.072 1.00 1.76 C ATOM 875 OD1 ASN A 53 11.605 15.574 32.445 1.00 2.14 O ATOM 876 ND2 ASN A 53 11.376 13.954 31.001 1.00 2.41 N ATOM 877 OXT ASN A 53 10.734 13.751 35.739 1.00 1.98 O ATOM 0 H ASN A 53 8.014 12.755 33.813 1.00 0.61 H new ATOM 0 HA ASN A 53 10.605 12.085 33.008 1.00 0.71 H new ATOM 0 HB2 ASN A 53 8.955 13.877 32.155 1.00 1.36 H new ATOM 0 HB3 ASN A 53 9.414 14.876 33.520 1.00 1.36 H new ATOM 0 HD21 ASN A 53 12.190 14.277 30.478 1.00 2.41 H new ATOM 0 HD22 ASN A 53 10.862 13.131 30.687 1.00 2.41 H new TER 884 ASN A 53 ATOM 885 N PHE B 2 15.218 0.353 26.478 1.00 9.08 N ATOM 886 CA PHE B 2 13.868 0.217 25.859 1.00 8.67 C ATOM 887 C PHE B 2 13.458 1.533 25.192 1.00 7.72 C ATOM 888 O PHE B 2 14.013 2.578 25.465 1.00 7.64 O ATOM 889 CB PHE B 2 12.931 -0.109 27.023 1.00 9.22 C ATOM 890 CG PHE B 2 12.851 1.079 27.952 1.00 10.46 C ATOM 891 CD1 PHE B 2 13.817 1.253 28.950 1.00 10.89 C ATOM 892 CD2 PHE B 2 11.810 2.005 27.816 1.00 10.87 C ATOM 893 CE1 PHE B 2 13.742 2.354 29.812 1.00 11.66 C ATOM 894 CE2 PHE B 2 11.736 3.106 28.677 1.00 11.64 C ATOM 895 CZ PHE B 2 12.702 3.280 29.676 1.00 11.60 C ATOM 0 HA PHE B 2 13.842 -0.552 25.087 1.00 8.67 H new ATOM 0 HB2 PHE B 2 11.939 -0.357 26.647 1.00 9.22 H new ATOM 0 HB3 PHE B 2 13.295 -0.983 27.563 1.00 9.22 H new ATOM 0 HD1 PHE B 2 14.620 0.538 29.055 1.00 10.89 H new ATOM 0 HD2 PHE B 2 11.064 1.870 27.047 1.00 10.87 H new ATOM 0 HE1 PHE B 2 14.487 2.488 30.582 1.00 11.66 H new ATOM 0 HE2 PHE B 2 10.934 3.821 28.571 1.00 11.64 H new ATOM 0 HZ PHE B 2 12.644 4.129 30.341 1.00 11.60 H new ATOM 905 N MET B 3 12.484 1.489 24.324 1.00 7.25 N ATOM 906 CA MET B 3 12.033 2.739 23.646 1.00 6.59 C ATOM 907 C MET B 3 10.532 2.946 23.863 1.00 5.73 C ATOM 908 O MET B 3 9.793 2.009 24.092 1.00 5.45 O ATOM 909 CB MET B 3 12.337 2.517 22.164 1.00 6.98 C ATOM 910 CG MET B 3 13.847 2.379 21.967 1.00 7.76 C ATOM 911 SD MET B 3 14.222 2.321 20.197 1.00 8.62 S ATOM 912 CE MET B 3 13.906 4.067 19.841 1.00 8.70 C ATOM 0 H MET B 3 11.981 0.643 24.055 1.00 7.25 H new ATOM 0 HA MET B 3 12.534 3.625 24.036 1.00 6.59 H new ATOM 0 HB2 MET B 3 11.830 1.620 21.808 1.00 6.98 H new ATOM 0 HB3 MET B 3 11.958 3.352 21.575 1.00 6.98 H new ATOM 0 HG2 MET B 3 14.363 3.219 22.432 1.00 7.76 H new ATOM 0 HG3 MET B 3 14.207 1.474 22.456 1.00 7.76 H new ATOM 0 HE1 MET B 3 14.763 4.493 19.320 1.00 8.70 H new ATOM 0 HE2 MET B 3 13.019 4.156 19.213 1.00 8.70 H new ATOM 0 HE3 MET B 3 13.745 4.605 20.775 1.00 8.70 H new ATOM 922 N LYS B 4 10.076 4.167 23.800 1.00 5.69 N ATOM 923 CA LYS B 4 8.624 4.433 24.011 1.00 5.34 C ATOM 924 C LYS B 4 7.894 4.478 22.666 1.00 4.61 C ATOM 925 O LYS B 4 8.408 4.981 21.687 1.00 4.72 O ATOM 926 CB LYS B 4 8.568 5.799 24.697 1.00 6.20 C ATOM 927 CG LYS B 4 9.241 5.710 26.068 1.00 6.74 C ATOM 928 CD LYS B 4 9.084 7.044 26.801 1.00 7.81 C ATOM 929 CE LYS B 4 9.865 6.999 28.116 1.00 8.51 C ATOM 930 NZ LYS B 4 9.049 6.140 29.019 1.00 9.17 N ATOM 0 H LYS B 4 10.646 4.992 23.612 1.00 5.69 H new ATOM 0 HA LYS B 4 8.144 3.657 24.607 1.00 5.34 H new ATOM 0 HB2 LYS B 4 9.069 6.547 24.082 1.00 6.20 H new ATOM 0 HB3 LYS B 4 7.532 6.119 24.809 1.00 6.20 H new ATOM 0 HG2 LYS B 4 8.794 4.907 26.653 1.00 6.74 H new ATOM 0 HG3 LYS B 4 10.298 5.469 25.951 1.00 6.74 H new ATOM 0 HD2 LYS B 4 9.449 7.859 26.177 1.00 7.81 H new ATOM 0 HD3 LYS B 4 8.030 7.241 26.998 1.00 7.81 H new ATOM 0 HE2 LYS B 4 10.862 6.583 27.969 1.00 8.51 H new ATOM 0 HE3 LYS B 4 9.995 7.998 28.532 1.00 8.51 H new ATOM 0 HZ1 LYS B 4 9.529 6.047 29.937 1.00 9.17 H new ATOM 0 HZ2 LYS B 4 8.114 6.573 29.159 1.00 9.17 H new ATOM 0 HZ3 LYS B 4 8.934 5.199 28.592 1.00 9.17 H new ATOM 944 N SER B 5 6.695 3.965 22.613 1.00 4.27 N ATOM 945 CA SER B 5 5.931 3.989 21.333 1.00 3.86 C ATOM 946 C SER B 5 4.958 5.174 21.320 1.00 2.80 C ATOM 947 O SER B 5 5.323 6.280 20.976 1.00 3.02 O ATOM 948 CB SER B 5 5.172 2.662 21.300 1.00 4.70 C ATOM 949 OG SER B 5 5.928 1.708 20.567 1.00 5.20 O ATOM 0 H SER B 5 6.212 3.531 23.399 1.00 4.27 H new ATOM 0 HA SER B 5 6.579 4.105 20.465 1.00 3.86 H new ATOM 0 HB2 SER B 5 4.998 2.304 22.315 1.00 4.70 H new ATOM 0 HB3 SER B 5 4.194 2.800 20.839 1.00 4.70 H new ATOM 0 HG SER B 5 5.326 1.175 20.007 1.00 5.20 H new ATOM 955 N THR B 6 3.727 4.959 21.704 1.00 2.20 N ATOM 956 CA THR B 6 2.750 6.086 21.724 1.00 1.59 C ATOM 957 C THR B 6 3.119 7.084 22.823 1.00 1.19 C ATOM 958 O THR B 6 3.050 8.283 22.636 1.00 1.95 O ATOM 959 CB THR B 6 1.399 5.435 22.021 1.00 2.29 C ATOM 960 OG1 THR B 6 1.414 4.897 23.336 1.00 2.98 O ATOM 961 CG2 THR B 6 1.137 4.315 21.013 1.00 2.91 C ATOM 0 H THR B 6 3.358 4.056 22.003 1.00 2.20 H new ATOM 0 HA THR B 6 2.737 6.639 20.785 1.00 1.59 H new ATOM 0 HB THR B 6 0.610 6.183 21.942 1.00 2.29 H new ATOM 0 HG1 THR B 6 0.548 4.481 23.529 1.00 2.98 H new ATOM 0 HG21 THR B 6 0.174 3.852 21.226 1.00 2.91 H new ATOM 0 HG22 THR B 6 1.126 4.728 20.005 1.00 2.91 H new ATOM 0 HG23 THR B 6 1.925 3.565 21.089 1.00 2.91 H new ATOM 969 N GLY B 7 3.556 6.600 23.954 1.00 0.83 N ATOM 970 CA GLY B 7 3.982 7.522 25.043 1.00 0.45 C ATOM 971 C GLY B 7 2.765 8.266 25.597 1.00 0.43 C ATOM 972 O GLY B 7 2.806 9.460 25.820 1.00 0.49 O ATOM 0 H GLY B 7 3.636 5.606 24.170 1.00 0.83 H new ATOM 0 HA2 GLY B 7 4.469 6.959 25.839 1.00 0.45 H new ATOM 0 HA3 GLY B 7 4.714 8.235 24.663 1.00 0.45 H new ATOM 976 N ILE B 8 1.688 7.571 25.845 1.00 0.37 N ATOM 977 CA ILE B 8 0.483 8.251 26.411 1.00 0.37 C ATOM 978 C ILE B 8 0.144 7.660 27.780 1.00 0.32 C ATOM 979 O ILE B 8 0.181 6.467 27.969 1.00 0.30 O ATOM 980 CB ILE B 8 -0.642 7.970 25.418 1.00 0.40 C ATOM 981 CG1 ILE B 8 -0.211 8.418 24.019 1.00 0.45 C ATOM 982 CG2 ILE B 8 -1.894 8.745 25.835 1.00 0.43 C ATOM 983 CD1 ILE B 8 -1.290 8.030 23.005 1.00 1.36 C ATOM 0 H ILE B 8 1.588 6.569 25.682 1.00 0.37 H new ATOM 0 HA ILE B 8 0.642 9.320 26.551 1.00 0.37 H new ATOM 0 HB ILE B 8 -0.860 6.902 25.408 1.00 0.40 H new ATOM 0 HG12 ILE B 8 -0.053 9.496 24.003 1.00 0.45 H new ATOM 0 HG13 ILE B 8 0.738 7.953 23.753 1.00 0.45 H new ATOM 0 HG21 ILE B 8 -2.698 8.545 25.127 1.00 0.43 H new ATOM 0 HG22 ILE B 8 -2.202 8.430 26.832 1.00 0.43 H new ATOM 0 HG23 ILE B 8 -1.675 9.813 25.844 1.00 0.43 H new ATOM 0 HD11 ILE B 8 -0.984 8.349 22.008 1.00 1.36 H new ATOM 0 HD12 ILE B 8 -1.426 6.949 23.014 1.00 1.36 H new ATOM 0 HD13 ILE B 8 -2.229 8.516 23.269 1.00 1.36 H new ATOM 995 N VAL B 9 -0.116 8.486 28.753 1.00 0.32 N ATOM 996 CA VAL B 9 -0.372 7.956 30.125 1.00 0.29 C ATOM 997 C VAL B 9 -1.806 8.258 30.570 1.00 0.32 C ATOM 998 O VAL B 9 -2.347 9.311 30.297 1.00 0.37 O ATOM 999 CB VAL B 9 0.634 8.673 31.026 1.00 0.30 C ATOM 1000 CG1 VAL B 9 0.410 8.248 32.478 1.00 0.27 C ATOM 1001 CG2 VAL B 9 2.055 8.294 30.603 1.00 0.30 C ATOM 0 H VAL B 9 -0.163 9.501 28.661 1.00 0.32 H new ATOM 0 HA VAL B 9 -0.259 6.873 30.167 1.00 0.29 H new ATOM 0 HB VAL B 9 0.499 9.751 30.935 1.00 0.30 H new ATOM 0 HG11 VAL B 9 1.127 8.759 33.121 1.00 0.27 H new ATOM 0 HG12 VAL B 9 -0.603 8.512 32.782 1.00 0.27 H new ATOM 0 HG13 VAL B 9 0.546 7.170 32.567 1.00 0.27 H new ATOM 0 HG21 VAL B 9 2.774 8.804 31.244 1.00 0.30 H new ATOM 0 HG22 VAL B 9 2.187 7.216 30.696 1.00 0.30 H new ATOM 0 HG23 VAL B 9 2.218 8.591 29.567 1.00 0.30 H new ATOM 1011 N ARG B 10 -2.401 7.354 31.299 1.00 0.31 N ATOM 1012 CA ARG B 10 -3.777 7.590 31.824 1.00 0.36 C ATOM 1013 C ARG B 10 -3.813 7.300 33.328 1.00 0.31 C ATOM 1014 O ARG B 10 -2.938 6.649 33.860 1.00 0.28 O ATOM 1015 CB ARG B 10 -4.670 6.610 31.064 1.00 0.40 C ATOM 1016 CG ARG B 10 -6.135 6.872 31.417 1.00 0.74 C ATOM 1017 CD ARG B 10 -7.024 5.857 30.696 1.00 0.87 C ATOM 1018 NE ARG B 10 -8.419 6.283 31.001 1.00 1.14 N ATOM 1019 CZ ARG B 10 -8.915 6.097 32.195 1.00 1.37 C ATOM 1020 NH1 ARG B 10 -8.193 5.536 33.127 1.00 1.62 N ATOM 1021 NH2 ARG B 10 -10.138 6.474 32.456 1.00 1.92 N ATOM 0 H ARG B 10 -1.991 6.456 31.555 1.00 0.31 H new ATOM 0 HA ARG B 10 -4.105 8.620 31.686 1.00 0.36 H new ATOM 0 HB2 ARG B 10 -4.518 6.722 29.990 1.00 0.40 H new ATOM 0 HB3 ARG B 10 -4.402 5.585 31.319 1.00 0.40 H new ATOM 0 HG2 ARG B 10 -6.279 6.797 32.495 1.00 0.74 H new ATOM 0 HG3 ARG B 10 -6.414 7.885 31.128 1.00 0.74 H new ATOM 0 HD2 ARG B 10 -6.836 5.860 29.622 1.00 0.87 H new ATOM 0 HD3 ARG B 10 -6.834 4.844 31.050 1.00 0.87 H new ATOM 0 HE ARG B 10 -8.988 6.721 30.276 1.00 1.14 H new ATOM 0 HH11 ARG B 10 -7.238 5.241 32.924 1.00 1.62 H new ATOM 0 HH12 ARG B 10 -8.584 5.393 34.058 1.00 1.62 H new ATOM 0 HH21 ARG B 10 -10.703 6.912 31.728 1.00 1.92 H new ATOM 0 HH22 ARG B 10 -10.528 6.330 33.387 1.00 1.92 H new ATOM 1035 N LYS B 11 -4.788 7.813 34.024 1.00 0.33 N ATOM 1036 CA LYS B 11 -4.838 7.596 35.500 1.00 0.30 C ATOM 1037 C LYS B 11 -5.532 6.267 35.822 1.00 0.26 C ATOM 1038 O LYS B 11 -6.428 5.838 35.122 1.00 0.28 O ATOM 1039 CB LYS B 11 -5.649 8.772 36.047 1.00 0.34 C ATOM 1040 CG LYS B 11 -4.897 10.077 35.780 1.00 1.03 C ATOM 1041 CD LYS B 11 -5.648 11.242 36.428 1.00 1.03 C ATOM 1042 CE LYS B 11 -4.964 12.559 36.058 1.00 1.81 C ATOM 1043 NZ LYS B 11 -4.537 13.150 37.357 1.00 2.21 N ATOM 0 H LYS B 11 -5.550 8.371 33.639 1.00 0.33 H new ATOM 0 HA LYS B 11 -3.843 7.546 35.942 1.00 0.30 H new ATOM 0 HB2 LYS B 11 -6.631 8.802 35.574 1.00 0.34 H new ATOM 0 HB3 LYS B 11 -5.814 8.647 37.117 1.00 0.34 H new ATOM 0 HG2 LYS B 11 -3.885 10.015 36.181 1.00 1.03 H new ATOM 0 HG3 LYS B 11 -4.804 10.242 34.707 1.00 1.03 H new ATOM 0 HD2 LYS B 11 -6.685 11.252 36.092 1.00 1.03 H new ATOM 0 HD3 LYS B 11 -5.665 11.120 37.511 1.00 1.03 H new ATOM 0 HE2 LYS B 11 -4.110 12.390 35.402 1.00 1.81 H new ATOM 0 HE3 LYS B 11 -5.647 13.223 35.528 1.00 1.81 H new ATOM 0 HZ1 LYS B 11 -4.059 14.057 37.185 1.00 2.21 H new ATOM 0 HZ2 LYS B 11 -5.371 13.307 37.958 1.00 2.21 H new ATOM 0 HZ3 LYS B 11 -3.882 12.499 37.836 1.00 2.21 H new ATOM 1057 N VAL B 12 -5.127 5.617 36.880 1.00 0.23 N ATOM 1058 CA VAL B 12 -5.766 4.321 37.253 1.00 0.22 C ATOM 1059 C VAL B 12 -7.060 4.586 38.024 1.00 0.20 C ATOM 1060 O VAL B 12 -7.082 5.355 38.963 1.00 0.20 O ATOM 1061 CB VAL B 12 -4.755 3.618 38.161 1.00 0.21 C ATOM 1062 CG1 VAL B 12 -5.116 2.138 38.277 1.00 0.29 C ATOM 1063 CG2 VAL B 12 -3.348 3.757 37.578 1.00 0.29 C ATOM 0 H VAL B 12 -4.381 5.927 37.503 1.00 0.23 H new ATOM 0 HA VAL B 12 -6.017 3.720 36.379 1.00 0.22 H new ATOM 0 HB VAL B 12 -4.780 4.078 39.149 1.00 0.21 H new ATOM 0 HG11 VAL B 12 -4.396 1.637 38.924 1.00 0.29 H new ATOM 0 HG12 VAL B 12 -6.115 2.039 38.702 1.00 0.29 H new ATOM 0 HG13 VAL B 12 -5.095 1.680 37.288 1.00 0.29 H new ATOM 0 HG21 VAL B 12 -2.633 3.254 38.229 1.00 0.29 H new ATOM 0 HG22 VAL B 12 -3.318 3.303 36.587 1.00 0.29 H new ATOM 0 HG23 VAL B 12 -3.089 4.813 37.501 1.00 0.29 H new ATOM 1073 N ASP B 13 -8.136 3.956 37.646 1.00 0.21 N ATOM 1074 CA ASP B 13 -9.415 4.186 38.375 1.00 0.21 C ATOM 1075 C ASP B 13 -9.482 3.290 39.619 1.00 0.22 C ATOM 1076 O ASP B 13 -8.505 2.684 40.010 1.00 0.23 O ATOM 1077 CB ASP B 13 -10.523 3.848 37.366 1.00 0.22 C ATOM 1078 CG ASP B 13 -10.904 2.369 37.462 1.00 0.32 C ATOM 1079 OD1 ASP B 13 -10.239 1.558 36.843 1.00 0.27 O ATOM 1080 OD2 ASP B 13 -11.856 2.069 38.161 1.00 0.55 O ATOM 0 H ASP B 13 -8.187 3.296 36.870 1.00 0.21 H new ATOM 0 HA ASP B 13 -9.515 5.210 38.734 1.00 0.21 H new ATOM 0 HB2 ASP B 13 -11.399 4.468 37.558 1.00 0.22 H new ATOM 0 HB3 ASP B 13 -10.185 4.077 36.355 1.00 0.22 H new ATOM 1085 N GLU B 14 -10.584 3.313 40.315 1.00 0.23 N ATOM 1086 CA GLU B 14 -10.658 2.590 41.619 1.00 0.26 C ATOM 1087 C GLU B 14 -10.281 1.110 41.468 1.00 0.26 C ATOM 1088 O GLU B 14 -9.698 0.523 42.358 1.00 0.30 O ATOM 1089 CB GLU B 14 -12.117 2.723 42.059 1.00 0.28 C ATOM 1090 CG GLU B 14 -12.284 2.132 43.460 1.00 1.22 C ATOM 1091 CD GLU B 14 -13.760 2.175 43.860 1.00 1.57 C ATOM 1092 OE1 GLU B 14 -14.560 2.619 43.053 1.00 2.19 O ATOM 1093 OE2 GLU B 14 -14.065 1.765 44.968 1.00 1.99 O ATOM 0 H GLU B 14 -11.437 3.800 40.039 1.00 0.23 H new ATOM 0 HA GLU B 14 -9.960 3.007 42.345 1.00 0.26 H new ATOM 0 HB2 GLU B 14 -12.414 3.772 42.057 1.00 0.28 H new ATOM 0 HB3 GLU B 14 -12.769 2.206 41.355 1.00 0.28 H new ATOM 0 HG2 GLU B 14 -11.921 1.104 43.478 1.00 1.22 H new ATOM 0 HG3 GLU B 14 -11.686 2.694 44.177 1.00 1.22 H new ATOM 1100 N LEU B 15 -10.715 0.469 40.419 1.00 0.23 N ATOM 1101 CA LEU B 15 -10.493 -1.005 40.314 1.00 0.25 C ATOM 1102 C LEU B 15 -9.104 -1.328 39.750 1.00 0.23 C ATOM 1103 O LEU B 15 -8.722 -2.477 39.654 1.00 0.25 O ATOM 1104 CB LEU B 15 -11.581 -1.510 39.367 1.00 0.28 C ATOM 1105 CG LEU B 15 -11.365 -3.000 39.095 1.00 0.38 C ATOM 1106 CD1 LEU B 15 -11.114 -3.733 40.418 1.00 1.28 C ATOM 1107 CD2 LEU B 15 -12.610 -3.579 38.421 1.00 1.39 C ATOM 0 H LEU B 15 -11.210 0.895 39.635 1.00 0.23 H new ATOM 0 HA LEU B 15 -10.541 -1.481 41.294 1.00 0.25 H new ATOM 0 HB2 LEU B 15 -12.565 -1.348 39.807 1.00 0.28 H new ATOM 0 HB3 LEU B 15 -11.553 -0.950 38.432 1.00 0.28 H new ATOM 0 HG LEU B 15 -10.502 -3.128 38.441 1.00 0.38 H new ATOM 0 HD11 LEU B 15 -10.960 -4.794 40.223 1.00 1.28 H new ATOM 0 HD12 LEU B 15 -10.227 -3.321 40.900 1.00 1.28 H new ATOM 0 HD13 LEU B 15 -11.976 -3.606 41.074 1.00 1.28 H new ATOM 0 HD21 LEU B 15 -12.458 -4.641 38.226 1.00 1.39 H new ATOM 0 HD22 LEU B 15 -13.472 -3.450 39.076 1.00 1.39 H new ATOM 0 HD23 LEU B 15 -12.789 -3.060 37.480 1.00 1.39 H new ATOM 1119 N GLY B 16 -8.357 -0.343 39.340 1.00 0.21 N ATOM 1120 CA GLY B 16 -7.021 -0.635 38.746 1.00 0.20 C ATOM 1121 C GLY B 16 -7.191 -1.070 37.288 1.00 0.21 C ATOM 1122 O GLY B 16 -6.655 -2.076 36.857 1.00 0.21 O ATOM 0 H GLY B 16 -8.609 0.644 39.389 1.00 0.21 H new ATOM 0 HA2 GLY B 16 -6.386 0.250 38.800 1.00 0.20 H new ATOM 0 HA3 GLY B 16 -6.523 -1.420 39.315 1.00 0.20 H new ATOM 1126 N ARG B 17 -7.972 -0.348 36.534 1.00 0.24 N ATOM 1127 CA ARG B 17 -8.217 -0.746 35.121 1.00 0.27 C ATOM 1128 C ARG B 17 -7.644 0.310 34.173 1.00 0.26 C ATOM 1129 O ARG B 17 -7.507 1.465 34.523 1.00 0.26 O ATOM 1130 CB ARG B 17 -9.739 -0.824 34.993 1.00 0.29 C ATOM 1131 CG ARG B 17 -10.262 -1.976 35.853 1.00 0.29 C ATOM 1132 CD ARG B 17 -11.778 -2.092 35.691 1.00 0.29 C ATOM 1133 NE ARG B 17 -12.327 -0.884 36.365 1.00 0.57 N ATOM 1134 CZ ARG B 17 -13.591 -0.842 36.703 1.00 0.79 C ATOM 1135 NH1 ARG B 17 -14.381 -1.842 36.414 1.00 0.73 N ATOM 1136 NH2 ARG B 17 -14.067 0.199 37.330 1.00 1.14 N ATOM 0 H ARG B 17 -8.451 0.500 36.836 1.00 0.24 H new ATOM 0 HA ARG B 17 -7.741 -1.692 34.864 1.00 0.27 H new ATOM 0 HB2 ARG B 17 -10.190 0.116 35.311 1.00 0.29 H new ATOM 0 HB3 ARG B 17 -10.020 -0.977 33.951 1.00 0.29 H new ATOM 0 HG2 ARG B 17 -9.782 -2.909 35.558 1.00 0.29 H new ATOM 0 HG3 ARG B 17 -10.010 -1.805 36.900 1.00 0.29 H new ATOM 0 HD2 ARG B 17 -12.062 -2.121 34.639 1.00 0.29 H new ATOM 0 HD3 ARG B 17 -12.156 -3.006 36.149 1.00 0.29 H new ATOM 0 HE ARG B 17 -11.719 -0.089 36.563 1.00 0.57 H new ATOM 0 HH11 ARG B 17 -14.013 -2.657 35.924 1.00 0.73 H new ATOM 0 HH12 ARG B 17 -15.366 -1.807 36.678 1.00 0.73 H new ATOM 0 HH21 ARG B 17 -13.454 0.982 37.557 1.00 1.14 H new ATOM 0 HH22 ARG B 17 -15.052 0.230 37.592 1.00 1.14 H new ATOM 1150 N VAL B 18 -7.311 -0.078 32.974 1.00 0.26 N ATOM 1151 CA VAL B 18 -6.749 0.902 32.001 1.00 0.26 C ATOM 1152 C VAL B 18 -7.593 0.909 30.726 1.00 0.24 C ATOM 1153 O VAL B 18 -8.274 -0.048 30.420 1.00 0.25 O ATOM 1154 CB VAL B 18 -5.334 0.404 31.706 1.00 0.26 C ATOM 1155 CG1 VAL B 18 -4.564 0.244 33.018 1.00 0.28 C ATOM 1156 CG2 VAL B 18 -5.406 -0.946 30.990 1.00 0.26 C ATOM 0 H VAL B 18 -7.403 -1.032 32.625 1.00 0.26 H new ATOM 0 HA VAL B 18 -6.746 1.920 32.390 1.00 0.26 H new ATOM 0 HB VAL B 18 -4.822 1.126 31.070 1.00 0.26 H new ATOM 0 HG11 VAL B 18 -3.555 -0.111 32.807 1.00 0.28 H new ATOM 0 HG12 VAL B 18 -4.511 1.206 33.528 1.00 0.28 H new ATOM 0 HG13 VAL B 18 -5.076 -0.477 33.655 1.00 0.28 H new ATOM 0 HG21 VAL B 18 -4.397 -1.301 30.780 1.00 0.26 H new ATOM 0 HG22 VAL B 18 -5.919 -1.668 31.625 1.00 0.26 H new ATOM 0 HG23 VAL B 18 -5.953 -0.833 30.054 1.00 0.26 H new ATOM 1166 N VAL B 19 -7.628 2.013 30.032 1.00 0.23 N ATOM 1167 CA VAL B 19 -8.520 2.110 28.843 1.00 0.22 C ATOM 1168 C VAL B 19 -7.699 2.176 27.555 1.00 0.22 C ATOM 1169 O VAL B 19 -6.792 2.975 27.427 1.00 0.24 O ATOM 1170 CB VAL B 19 -9.300 3.409 29.043 1.00 0.22 C ATOM 1171 CG1 VAL B 19 -10.357 3.545 27.946 1.00 0.23 C ATOM 1172 CG2 VAL B 19 -9.983 3.387 30.412 1.00 0.24 C ATOM 0 H VAL B 19 -7.080 2.849 30.236 1.00 0.23 H new ATOM 0 HA VAL B 19 -9.175 1.243 28.752 1.00 0.22 H new ATOM 0 HB VAL B 19 -8.615 4.256 28.992 1.00 0.22 H new ATOM 0 HG11 VAL B 19 -10.913 4.472 28.089 1.00 0.23 H new ATOM 0 HG12 VAL B 19 -9.870 3.561 26.971 1.00 0.23 H new ATOM 0 HG13 VAL B 19 -11.043 2.699 27.995 1.00 0.23 H new ATOM 0 HG21 VAL B 19 -10.540 4.313 30.556 1.00 0.24 H new ATOM 0 HG22 VAL B 19 -10.668 2.540 30.464 1.00 0.24 H new ATOM 0 HG23 VAL B 19 -9.229 3.292 31.193 1.00 0.24 H new ATOM 1182 N ILE B 20 -8.085 1.426 26.561 1.00 0.22 N ATOM 1183 CA ILE B 20 -7.411 1.537 25.240 1.00 0.24 C ATOM 1184 C ILE B 20 -7.984 2.731 24.469 1.00 0.24 C ATOM 1185 O ILE B 20 -9.182 2.869 24.357 1.00 0.23 O ATOM 1186 CB ILE B 20 -7.739 0.220 24.530 1.00 0.23 C ATOM 1187 CG1 ILE B 20 -6.787 -0.872 25.024 1.00 0.29 C ATOM 1188 CG2 ILE B 20 -7.581 0.386 23.018 1.00 0.25 C ATOM 1189 CD1 ILE B 20 -7.370 -2.246 24.691 1.00 1.38 C ATOM 0 H ILE B 20 -8.839 0.741 26.608 1.00 0.22 H new ATOM 0 HA ILE B 20 -6.336 1.697 25.321 1.00 0.24 H new ATOM 0 HB ILE B 20 -8.769 -0.059 24.752 1.00 0.23 H new ATOM 0 HG12 ILE B 20 -5.810 -0.757 24.555 1.00 0.29 H new ATOM 0 HG13 ILE B 20 -6.638 -0.780 26.100 1.00 0.29 H new ATOM 0 HG21 ILE B 20 -7.816 -0.556 22.522 1.00 0.25 H new ATOM 0 HG22 ILE B 20 -8.260 1.162 22.664 1.00 0.25 H new ATOM 0 HG23 ILE B 20 -6.554 0.670 22.789 1.00 0.25 H new ATOM 0 HD11 ILE B 20 -6.692 -3.024 25.043 1.00 1.38 H new ATOM 0 HD12 ILE B 20 -8.337 -2.359 25.180 1.00 1.38 H new ATOM 0 HD13 ILE B 20 -7.497 -2.336 23.612 1.00 1.38 H new ATOM 1201 N PRO B 21 -7.109 3.523 23.915 1.00 0.28 N ATOM 1202 CA PRO B 21 -7.547 4.676 23.089 1.00 0.30 C ATOM 1203 C PRO B 21 -8.399 4.185 21.915 1.00 0.28 C ATOM 1204 O PRO B 21 -8.161 3.130 21.365 1.00 0.27 O ATOM 1205 CB PRO B 21 -6.244 5.305 22.593 1.00 0.35 C ATOM 1206 CG PRO B 21 -5.166 4.303 22.883 1.00 0.36 C ATOM 1207 CD PRO B 21 -5.654 3.425 24.003 1.00 0.32 C ATOM 0 HA PRO B 21 -8.159 5.387 23.643 1.00 0.30 H new ATOM 0 HB2 PRO B 21 -6.297 5.523 21.526 1.00 0.35 H new ATOM 0 HB3 PRO B 21 -6.047 6.248 23.102 1.00 0.35 H new ATOM 0 HG2 PRO B 21 -4.947 3.708 21.997 1.00 0.36 H new ATOM 0 HG3 PRO B 21 -4.241 4.806 23.165 1.00 0.36 H new ATOM 0 HD2 PRO B 21 -5.314 2.396 23.882 1.00 0.32 H new ATOM 0 HD3 PRO B 21 -5.288 3.770 24.970 1.00 0.32 H new ATOM 1215 N ILE B 22 -9.410 4.923 21.545 1.00 0.30 N ATOM 1216 CA ILE B 22 -10.290 4.467 20.430 1.00 0.30 C ATOM 1217 C ILE B 22 -9.460 4.184 19.177 1.00 0.33 C ATOM 1218 O ILE B 22 -9.760 3.290 18.412 1.00 0.32 O ATOM 1219 CB ILE B 22 -11.252 5.629 20.181 1.00 0.36 C ATOM 1220 CG1 ILE B 22 -12.388 5.166 19.266 1.00 0.41 C ATOM 1221 CG2 ILE B 22 -10.500 6.781 19.512 1.00 0.43 C ATOM 1222 CD1 ILE B 22 -13.215 4.095 19.979 1.00 1.11 C ATOM 0 H ILE B 22 -9.664 5.818 21.964 1.00 0.30 H new ATOM 0 HA ILE B 22 -10.817 3.545 20.676 1.00 0.30 H new ATOM 0 HB ILE B 22 -11.665 5.966 21.132 1.00 0.36 H new ATOM 0 HG12 ILE B 22 -13.022 6.012 18.999 1.00 0.41 H new ATOM 0 HG13 ILE B 22 -11.981 4.767 18.337 1.00 0.41 H new ATOM 0 HG21 ILE B 22 -11.186 7.609 19.335 1.00 0.43 H new ATOM 0 HG22 ILE B 22 -9.691 7.113 20.162 1.00 0.43 H new ATOM 0 HG23 ILE B 22 -10.087 6.443 18.562 1.00 0.43 H new ATOM 0 HD11 ILE B 22 -14.024 3.766 19.327 1.00 1.11 H new ATOM 0 HD12 ILE B 22 -12.577 3.246 20.223 1.00 1.11 H new ATOM 0 HD13 ILE B 22 -13.634 4.509 20.896 1.00 1.11 H new ATOM 1234 N GLU B 23 -8.399 4.912 18.978 1.00 0.36 N ATOM 1235 CA GLU B 23 -7.538 4.649 17.790 1.00 0.40 C ATOM 1236 C GLU B 23 -7.041 3.203 17.822 1.00 0.37 C ATOM 1237 O GLU B 23 -6.935 2.547 16.803 1.00 0.39 O ATOM 1238 CB GLU B 23 -6.367 5.623 17.929 1.00 0.44 C ATOM 1239 CG GLU B 23 -5.484 5.539 16.683 1.00 1.22 C ATOM 1240 CD GLU B 23 -4.259 6.437 16.865 1.00 1.62 C ATOM 1241 OE1 GLU B 23 -4.143 7.043 17.918 1.00 2.37 O ATOM 1242 OE2 GLU B 23 -3.458 6.506 15.947 1.00 2.00 O ATOM 0 H GLU B 23 -8.090 5.674 19.582 1.00 0.36 H new ATOM 0 HA GLU B 23 -8.070 4.786 16.848 1.00 0.40 H new ATOM 0 HB2 GLU B 23 -6.739 6.640 18.057 1.00 0.44 H new ATOM 0 HB3 GLU B 23 -5.784 5.383 18.818 1.00 0.44 H new ATOM 0 HG2 GLU B 23 -5.171 4.509 16.515 1.00 1.22 H new ATOM 0 HG3 GLU B 23 -6.048 5.849 15.803 1.00 1.22 H new ATOM 1249 N LEU B 24 -6.758 2.697 18.991 1.00 0.34 N ATOM 1250 CA LEU B 24 -6.295 1.285 19.107 1.00 0.33 C ATOM 1251 C LEU B 24 -7.486 0.324 19.094 1.00 0.29 C ATOM 1252 O LEU B 24 -7.396 -0.773 18.582 1.00 0.30 O ATOM 1253 CB LEU B 24 -5.554 1.216 20.440 1.00 0.33 C ATOM 1254 CG LEU B 24 -4.308 2.102 20.377 1.00 0.93 C ATOM 1255 CD1 LEU B 24 -3.497 1.936 21.664 1.00 1.41 C ATOM 1256 CD2 LEU B 24 -3.451 1.688 19.179 1.00 1.75 C ATOM 0 H LEU B 24 -6.828 3.203 19.874 1.00 0.34 H new ATOM 0 HA LEU B 24 -5.656 0.994 18.273 1.00 0.33 H new ATOM 0 HB2 LEU B 24 -6.207 1.545 21.249 1.00 0.33 H new ATOM 0 HB3 LEU B 24 -5.271 0.186 20.658 1.00 0.33 H new ATOM 0 HG LEU B 24 -4.608 3.144 20.269 1.00 0.93 H new ATOM 0 HD11 LEU B 24 -2.610 2.567 21.619 1.00 1.41 H new ATOM 0 HD12 LEU B 24 -4.107 2.228 22.519 1.00 1.41 H new ATOM 0 HD13 LEU B 24 -3.196 0.894 21.773 1.00 1.41 H new ATOM 0 HD21 LEU B 24 -2.563 2.318 19.132 1.00 1.75 H new ATOM 0 HD22 LEU B 24 -3.151 0.646 19.289 1.00 1.75 H new ATOM 0 HD23 LEU B 24 -4.028 1.805 18.261 1.00 1.75 H new ATOM 1268 N ARG B 25 -8.625 0.747 19.577 1.00 0.26 N ATOM 1269 CA ARG B 25 -9.821 -0.139 19.493 1.00 0.23 C ATOM 1270 C ARG B 25 -10.076 -0.497 18.028 1.00 0.26 C ATOM 1271 O ARG B 25 -10.387 -1.623 17.697 1.00 0.25 O ATOM 1272 CB ARG B 25 -10.997 0.682 20.033 1.00 0.22 C ATOM 1273 CG ARG B 25 -10.764 1.063 21.497 1.00 0.21 C ATOM 1274 CD ARG B 25 -12.053 1.675 22.061 1.00 0.22 C ATOM 1275 NE ARG B 25 -11.632 2.455 23.256 1.00 0.23 N ATOM 1276 CZ ARG B 25 -12.401 3.398 23.729 1.00 0.26 C ATOM 1277 NH1 ARG B 25 -13.554 3.648 23.170 1.00 0.30 N ATOM 1278 NH2 ARG B 25 -12.019 4.089 24.768 1.00 0.27 N ATOM 0 H ARG B 25 -8.777 1.653 20.019 1.00 0.26 H new ATOM 0 HA ARG B 25 -9.685 -1.061 20.058 1.00 0.23 H new ATOM 0 HB2 ARG B 25 -11.123 1.583 19.433 1.00 0.22 H new ATOM 0 HB3 ARG B 25 -11.919 0.108 19.944 1.00 0.22 H new ATOM 0 HG2 ARG B 25 -10.480 0.184 22.075 1.00 0.21 H new ATOM 0 HG3 ARG B 25 -9.943 1.775 21.575 1.00 0.21 H new ATOM 0 HD2 ARG B 25 -12.538 2.316 21.325 1.00 0.22 H new ATOM 0 HD3 ARG B 25 -12.770 0.900 22.331 1.00 0.22 H new ATOM 0 HE ARG B 25 -10.740 2.252 23.707 1.00 0.23 H new ATOM 0 HH11 ARG B 25 -13.857 3.106 22.361 1.00 0.30 H new ATOM 0 HH12 ARG B 25 -14.152 4.386 23.542 1.00 0.30 H new ATOM 0 HH21 ARG B 25 -11.121 3.892 25.209 1.00 0.27 H new ATOM 0 HH22 ARG B 25 -12.619 4.826 25.139 1.00 0.27 H new ATOM 1292 N ARG B 26 -9.983 0.469 17.155 1.00 0.29 N ATOM 1293 CA ARG B 26 -10.263 0.204 15.716 1.00 0.33 C ATOM 1294 C ARG B 26 -9.124 -0.602 15.085 1.00 0.35 C ATOM 1295 O ARG B 26 -9.346 -1.594 14.420 1.00 0.35 O ATOM 1296 CB ARG B 26 -10.359 1.588 15.074 1.00 0.37 C ATOM 1297 CG ARG B 26 -10.772 1.444 13.609 1.00 1.07 C ATOM 1298 CD ARG B 26 -12.244 1.030 13.531 1.00 1.25 C ATOM 1299 NE ARG B 26 -12.518 0.855 12.078 1.00 1.86 N ATOM 1300 CZ ARG B 26 -13.726 0.575 11.667 1.00 2.33 C ATOM 1301 NH1 ARG B 26 -14.699 0.446 12.529 1.00 2.42 N ATOM 1302 NH2 ARG B 26 -13.961 0.422 10.393 1.00 3.27 N ATOM 0 H ARG B 26 -9.725 1.431 17.377 1.00 0.29 H new ATOM 0 HA ARG B 26 -11.173 -0.379 15.576 1.00 0.33 H new ATOM 0 HB2 ARG B 26 -11.086 2.199 15.609 1.00 0.37 H new ATOM 0 HB3 ARG B 26 -9.399 2.100 15.144 1.00 0.37 H new ATOM 0 HG2 ARG B 26 -10.620 2.387 13.083 1.00 1.07 H new ATOM 0 HG3 ARG B 26 -10.147 0.699 13.116 1.00 1.07 H new ATOM 0 HD2 ARG B 26 -12.424 0.106 14.081 1.00 1.25 H new ATOM 0 HD3 ARG B 26 -12.892 1.791 13.966 1.00 1.25 H new ATOM 0 HE ARG B 26 -11.761 0.954 11.402 1.00 1.86 H new ATOM 0 HH11 ARG B 26 -14.516 0.564 13.526 1.00 2.42 H new ATOM 0 HH12 ARG B 26 -15.641 0.227 12.205 1.00 2.42 H new ATOM 0 HH21 ARG B 26 -13.202 0.521 9.719 1.00 3.27 H new ATOM 0 HH22 ARG B 26 -14.904 0.203 10.071 1.00 3.27 H new ATOM 1316 N THR B 27 -7.909 -0.156 15.251 1.00 0.37 N ATOM 1317 CA THR B 27 -6.756 -0.862 14.618 1.00 0.41 C ATOM 1318 C THR B 27 -6.611 -2.282 15.174 1.00 0.39 C ATOM 1319 O THR B 27 -6.129 -3.172 14.503 1.00 0.42 O ATOM 1320 CB THR B 27 -5.532 -0.017 14.973 1.00 0.44 C ATOM 1321 OG1 THR B 27 -5.746 1.323 14.550 1.00 0.61 O ATOM 1322 CG2 THR B 27 -4.298 -0.584 14.272 1.00 0.77 C ATOM 0 H THR B 27 -7.663 0.669 15.799 1.00 0.37 H new ATOM 0 HA THR B 27 -6.886 -0.966 13.541 1.00 0.41 H new ATOM 0 HB THR B 27 -5.375 -0.038 16.051 1.00 0.44 H new ATOM 0 HG1 THR B 27 -6.148 1.837 15.281 1.00 0.61 H new ATOM 0 HG21 THR B 27 -3.426 0.019 14.526 1.00 0.77 H new ATOM 0 HG22 THR B 27 -4.135 -1.612 14.597 1.00 0.77 H new ATOM 0 HG23 THR B 27 -4.451 -0.564 13.193 1.00 0.77 H new ATOM 1330 N LEU B 28 -6.960 -2.488 16.414 1.00 0.35 N ATOM 1331 CA LEU B 28 -6.772 -3.837 17.022 1.00 0.35 C ATOM 1332 C LEU B 28 -7.989 -4.730 16.749 1.00 0.33 C ATOM 1333 O LEU B 28 -7.991 -5.902 17.070 1.00 0.33 O ATOM 1334 CB LEU B 28 -6.615 -3.579 18.520 1.00 0.33 C ATOM 1335 CG LEU B 28 -6.163 -4.864 19.214 1.00 0.44 C ATOM 1336 CD1 LEU B 28 -4.704 -5.155 18.854 1.00 0.70 C ATOM 1337 CD2 LEU B 28 -6.288 -4.693 20.730 1.00 1.05 C ATOM 0 H LEU B 28 -7.366 -1.784 17.031 1.00 0.35 H new ATOM 0 HA LEU B 28 -5.909 -4.356 16.605 1.00 0.35 H new ATOM 0 HB2 LEU B 28 -5.886 -2.786 18.689 1.00 0.33 H new ATOM 0 HB3 LEU B 28 -7.560 -3.238 18.942 1.00 0.33 H new ATOM 0 HG LEU B 28 -6.790 -5.693 18.886 1.00 0.44 H new ATOM 0 HD11 LEU B 28 -4.383 -6.071 19.349 1.00 0.70 H new ATOM 0 HD12 LEU B 28 -4.613 -5.275 17.774 1.00 0.70 H new ATOM 0 HD13 LEU B 28 -4.076 -4.326 19.182 1.00 0.70 H new ATOM 0 HD21 LEU B 28 -5.966 -5.608 21.227 1.00 1.05 H new ATOM 0 HD22 LEU B 28 -5.661 -3.863 21.056 1.00 1.05 H new ATOM 0 HD23 LEU B 28 -7.326 -4.486 20.988 1.00 1.05 H new ATOM 1349 N GLY B 29 -9.018 -4.194 16.151 1.00 0.32 N ATOM 1350 CA GLY B 29 -10.217 -5.028 15.851 1.00 0.32 C ATOM 1351 C GLY B 29 -10.872 -5.472 17.159 1.00 0.29 C ATOM 1352 O GLY B 29 -11.277 -6.608 17.307 1.00 0.29 O ATOM 0 H GLY B 29 -9.081 -3.219 15.858 1.00 0.32 H new ATOM 0 HA2 GLY B 29 -10.928 -4.459 15.251 1.00 0.32 H new ATOM 0 HA3 GLY B 29 -9.929 -5.899 15.263 1.00 0.32 H new ATOM 1356 N ILE B 30 -10.961 -4.594 18.118 1.00 0.27 N ATOM 1357 CA ILE B 30 -11.569 -4.978 19.424 1.00 0.24 C ATOM 1358 C ILE B 30 -12.844 -4.172 19.682 1.00 0.23 C ATOM 1359 O ILE B 30 -12.919 -2.993 19.400 1.00 0.26 O ATOM 1360 CB ILE B 30 -10.509 -4.652 20.474 1.00 0.27 C ATOM 1361 CG1 ILE B 30 -9.227 -5.425 20.160 1.00 0.41 C ATOM 1362 CG2 ILE B 30 -11.022 -5.059 21.857 1.00 0.33 C ATOM 1363 CD1 ILE B 30 -9.559 -6.907 19.969 1.00 0.30 C ATOM 0 H ILE B 30 -10.640 -3.628 18.055 1.00 0.27 H new ATOM 0 HA ILE B 30 -11.852 -6.030 19.445 1.00 0.24 H new ATOM 0 HB ILE B 30 -10.301 -3.582 20.462 1.00 0.27 H new ATOM 0 HG12 ILE B 30 -8.761 -5.027 19.259 1.00 0.41 H new ATOM 0 HG13 ILE B 30 -8.509 -5.304 20.971 1.00 0.41 H new ATOM 0 HG21 ILE B 30 -10.267 -4.827 22.608 1.00 0.33 H new ATOM 0 HG22 ILE B 30 -11.937 -4.511 22.081 1.00 0.33 H new ATOM 0 HG23 ILE B 30 -11.228 -6.129 21.868 1.00 0.33 H new ATOM 0 HD11 ILE B 30 -8.646 -7.459 19.745 1.00 0.30 H new ATOM 0 HD12 ILE B 30 -10.006 -7.300 20.882 1.00 0.30 H new ATOM 0 HD13 ILE B 30 -10.262 -7.019 19.144 1.00 0.30 H new ATOM 1375 N ALA B 31 -13.859 -4.822 20.177 1.00 0.22 N ATOM 1376 CA ALA B 31 -15.156 -4.132 20.418 1.00 0.23 C ATOM 1377 C ALA B 31 -15.794 -4.654 21.708 1.00 0.20 C ATOM 1378 O ALA B 31 -15.382 -5.658 22.253 1.00 0.19 O ATOM 1379 CB ALA B 31 -16.024 -4.491 19.213 1.00 0.23 C ATOM 0 H ALA B 31 -13.845 -5.811 20.427 1.00 0.22 H new ATOM 0 HA ALA B 31 -15.038 -3.054 20.530 1.00 0.23 H new ATOM 0 HB1 ALA B 31 -17.001 -4.019 19.315 1.00 0.23 H new ATOM 0 HB2 ALA B 31 -15.544 -4.138 18.300 1.00 0.23 H new ATOM 0 HB3 ALA B 31 -16.147 -5.573 19.163 1.00 0.23 H new ATOM 1385 N GLU B 32 -16.794 -3.979 22.203 1.00 0.22 N ATOM 1386 CA GLU B 32 -17.450 -4.437 23.461 1.00 0.21 C ATOM 1387 C GLU B 32 -17.884 -5.903 23.337 1.00 0.19 C ATOM 1388 O GLU B 32 -18.294 -6.350 22.286 1.00 0.20 O ATOM 1389 CB GLU B 32 -18.671 -3.530 23.621 1.00 0.25 C ATOM 1390 CG GLU B 32 -19.346 -3.815 24.963 1.00 0.27 C ATOM 1391 CD GLU B 32 -20.625 -2.983 25.078 1.00 0.32 C ATOM 1392 OE1 GLU B 32 -20.930 -2.269 24.138 1.00 1.12 O ATOM 1393 OE2 GLU B 32 -21.277 -3.074 26.106 1.00 1.13 O ATOM 0 H GLU B 32 -17.185 -3.131 21.792 1.00 0.22 H new ATOM 0 HA GLU B 32 -16.779 -4.379 24.318 1.00 0.21 H new ATOM 0 HB2 GLU B 32 -18.369 -2.484 23.569 1.00 0.25 H new ATOM 0 HB3 GLU B 32 -19.373 -3.701 22.805 1.00 0.25 H new ATOM 0 HG2 GLU B 32 -19.581 -4.876 25.046 1.00 0.27 H new ATOM 0 HG3 GLU B 32 -18.668 -3.574 25.782 1.00 0.27 H new ATOM 1400 N LYS B 33 -17.838 -6.632 24.422 1.00 0.19 N ATOM 1401 CA LYS B 33 -18.294 -8.059 24.420 1.00 0.20 C ATOM 1402 C LYS B 33 -17.272 -8.966 23.724 1.00 0.18 C ATOM 1403 O LYS B 33 -17.377 -10.175 23.773 1.00 0.21 O ATOM 1404 CB LYS B 33 -19.625 -8.069 23.663 1.00 0.23 C ATOM 1405 CG LYS B 33 -20.379 -9.361 23.983 1.00 0.29 C ATOM 1406 CD LYS B 33 -21.680 -9.404 23.178 1.00 0.86 C ATOM 1407 CE LYS B 33 -22.508 -10.618 23.609 1.00 1.35 C ATOM 1408 NZ LYS B 33 -22.174 -11.681 22.623 1.00 1.88 N ATOM 0 H LYS B 33 -17.499 -6.296 25.323 1.00 0.19 H new ATOM 0 HA LYS B 33 -18.403 -8.439 25.436 1.00 0.20 H new ATOM 0 HB2 LYS B 33 -20.225 -7.204 23.947 1.00 0.23 H new ATOM 0 HB3 LYS B 33 -19.447 -7.994 22.590 1.00 0.23 H new ATOM 0 HG2 LYS B 33 -19.760 -10.225 23.741 1.00 0.29 H new ATOM 0 HG3 LYS B 33 -20.597 -9.413 25.050 1.00 0.29 H new ATOM 0 HD2 LYS B 33 -22.249 -8.488 23.337 1.00 0.86 H new ATOM 0 HD3 LYS B 33 -21.459 -9.461 22.112 1.00 0.86 H new ATOM 0 HE2 LYS B 33 -22.256 -10.927 24.623 1.00 1.35 H new ATOM 0 HE3 LYS B 33 -23.574 -10.392 23.600 1.00 1.35 H new ATOM 0 HZ1 LYS B 33 -22.704 -12.546 22.852 1.00 1.88 H new ATOM 0 HZ2 LYS B 33 -22.431 -11.361 21.667 1.00 1.88 H new ATOM 0 HZ3 LYS B 33 -21.154 -11.880 22.659 1.00 1.88 H new ATOM 1422 N ASP B 34 -16.236 -8.408 23.161 1.00 0.16 N ATOM 1423 CA ASP B 34 -15.166 -9.264 22.571 1.00 0.16 C ATOM 1424 C ASP B 34 -14.270 -9.823 23.678 1.00 0.19 C ATOM 1425 O ASP B 34 -14.364 -9.422 24.820 1.00 0.20 O ATOM 1426 CB ASP B 34 -14.372 -8.344 21.648 1.00 0.17 C ATOM 1427 CG ASP B 34 -15.198 -8.053 20.395 1.00 0.18 C ATOM 1428 OD1 ASP B 34 -16.243 -8.663 20.241 1.00 1.10 O ATOM 1429 OD2 ASP B 34 -14.768 -7.226 19.612 1.00 1.09 O ATOM 0 H ASP B 34 -16.083 -7.402 23.084 1.00 0.16 H new ATOM 0 HA ASP B 34 -15.575 -10.117 22.030 1.00 0.16 H new ATOM 0 HB2 ASP B 34 -14.130 -7.414 22.162 1.00 0.17 H new ATOM 0 HB3 ASP B 34 -13.427 -8.812 21.374 1.00 0.17 H new ATOM 1434 N ALA B 35 -13.458 -10.797 23.367 1.00 0.22 N ATOM 1435 CA ALA B 35 -12.626 -11.434 24.428 1.00 0.28 C ATOM 1436 C ALA B 35 -11.171 -10.960 24.338 1.00 0.20 C ATOM 1437 O ALA B 35 -10.534 -11.061 23.309 1.00 0.16 O ATOM 1438 CB ALA B 35 -12.716 -12.934 24.149 1.00 0.36 C ATOM 0 H ALA B 35 -13.335 -11.178 22.429 1.00 0.22 H new ATOM 0 HA ALA B 35 -12.975 -11.177 25.428 1.00 0.28 H new ATOM 0 HB1 ALA B 35 -12.128 -13.478 24.889 1.00 0.36 H new ATOM 0 HB2 ALA B 35 -13.757 -13.253 24.207 1.00 0.36 H new ATOM 0 HB3 ALA B 35 -12.327 -13.143 23.152 1.00 0.36 H new ATOM 1444 N LEU B 36 -10.613 -10.543 25.442 1.00 0.24 N ATOM 1445 CA LEU B 36 -9.166 -10.181 25.468 1.00 0.21 C ATOM 1446 C LEU B 36 -8.385 -11.257 26.221 1.00 0.19 C ATOM 1447 O LEU B 36 -8.807 -11.712 27.263 1.00 0.23 O ATOM 1448 CB LEU B 36 -9.098 -8.865 26.244 1.00 0.34 C ATOM 1449 CG LEU B 36 -10.131 -7.880 25.702 1.00 0.45 C ATOM 1450 CD1 LEU B 36 -10.381 -6.802 26.753 1.00 0.55 C ATOM 1451 CD2 LEU B 36 -9.598 -7.235 24.420 1.00 0.56 C ATOM 0 H LEU B 36 -11.100 -10.437 26.332 1.00 0.24 H new ATOM 0 HA LEU B 36 -8.744 -10.093 24.467 1.00 0.21 H new ATOM 0 HB2 LEU B 36 -9.280 -9.049 27.303 1.00 0.34 H new ATOM 0 HB3 LEU B 36 -8.099 -8.437 26.162 1.00 0.34 H new ATOM 0 HG LEU B 36 -11.062 -8.402 25.479 1.00 0.45 H new ATOM 0 HD11 LEU B 36 -11.118 -6.092 26.378 1.00 0.55 H new ATOM 0 HD12 LEU B 36 -10.755 -7.264 27.666 1.00 0.55 H new ATOM 0 HD13 LEU B 36 -9.449 -6.279 26.967 1.00 0.55 H new ATOM 0 HD21 LEU B 36 -10.335 -6.532 24.033 1.00 0.56 H new ATOM 0 HD22 LEU B 36 -8.671 -6.705 24.638 1.00 0.56 H new ATOM 0 HD23 LEU B 36 -9.408 -8.008 23.675 1.00 0.56 H new ATOM 1463 N GLU B 37 -7.196 -11.569 25.791 1.00 0.18 N ATOM 1464 CA GLU B 37 -6.354 -12.497 26.596 1.00 0.20 C ATOM 1465 C GLU B 37 -5.226 -11.715 27.271 1.00 0.18 C ATOM 1466 O GLU B 37 -4.712 -10.756 26.729 1.00 0.19 O ATOM 1467 CB GLU B 37 -5.806 -13.518 25.599 1.00 0.24 C ATOM 1468 CG GLU B 37 -5.057 -14.620 26.350 1.00 0.26 C ATOM 1469 CD GLU B 37 -4.470 -15.615 25.347 1.00 0.36 C ATOM 1470 OE1 GLU B 37 -4.634 -15.395 24.158 1.00 1.07 O ATOM 1471 OE2 GLU B 37 -3.865 -16.580 25.785 1.00 1.17 O ATOM 0 H GLU B 37 -6.774 -11.227 24.928 1.00 0.18 H new ATOM 0 HA GLU B 37 -6.915 -12.990 27.390 1.00 0.20 H new ATOM 0 HB2 GLU B 37 -6.622 -13.949 25.020 1.00 0.24 H new ATOM 0 HB3 GLU B 37 -5.137 -13.027 24.892 1.00 0.24 H new ATOM 0 HG2 GLU B 37 -4.261 -14.186 26.955 1.00 0.26 H new ATOM 0 HG3 GLU B 37 -5.734 -15.133 27.033 1.00 0.26 H new ATOM 1478 N ILE B 38 -4.957 -12.017 28.510 1.00 0.20 N ATOM 1479 CA ILE B 38 -4.007 -11.183 29.295 1.00 0.20 C ATOM 1480 C ILE B 38 -2.699 -11.937 29.528 1.00 0.19 C ATOM 1481 O ILE B 38 -2.691 -13.107 29.871 1.00 0.23 O ATOM 1482 CB ILE B 38 -4.717 -10.922 30.624 1.00 0.25 C ATOM 1483 CG1 ILE B 38 -6.064 -10.247 30.357 1.00 0.80 C ATOM 1484 CG2 ILE B 38 -3.853 -10.007 31.493 1.00 0.73 C ATOM 1485 CD1 ILE B 38 -6.830 -10.096 31.673 1.00 0.84 C ATOM 0 H ILE B 38 -5.356 -12.809 29.014 1.00 0.20 H new ATOM 0 HA ILE B 38 -3.749 -10.259 28.778 1.00 0.20 H new ATOM 0 HB ILE B 38 -4.879 -11.868 31.141 1.00 0.25 H new ATOM 0 HG12 ILE B 38 -5.909 -9.270 29.900 1.00 0.80 H new ATOM 0 HG13 ILE B 38 -6.646 -10.840 29.651 1.00 0.80 H new ATOM 0 HG21 ILE B 38 -4.359 -9.821 32.440 1.00 0.73 H new ATOM 0 HG22 ILE B 38 -2.892 -10.486 31.683 1.00 0.73 H new ATOM 0 HG23 ILE B 38 -3.691 -9.061 30.976 1.00 0.73 H new ATOM 0 HD11 ILE B 38 -7.789 -9.615 31.482 1.00 0.84 H new ATOM 0 HD12 ILE B 38 -6.998 -11.080 32.111 1.00 0.84 H new ATOM 0 HD13 ILE B 38 -6.249 -9.485 32.364 1.00 0.84 H new ATOM 1497 N TYR B 39 -1.602 -11.270 29.304 1.00 0.18 N ATOM 1498 CA TYR B 39 -0.264 -11.908 29.455 1.00 0.20 C ATOM 1499 C TYR B 39 0.555 -11.162 30.512 1.00 0.20 C ATOM 1500 O TYR B 39 0.366 -9.981 30.729 1.00 0.19 O ATOM 1501 CB TYR B 39 0.389 -11.735 28.086 1.00 0.23 C ATOM 1502 CG TYR B 39 -0.099 -12.786 27.130 1.00 0.28 C ATOM 1503 CD1 TYR B 39 -1.455 -12.855 26.790 1.00 0.31 C ATOM 1504 CD2 TYR B 39 0.812 -13.682 26.564 1.00 0.31 C ATOM 1505 CE1 TYR B 39 -1.898 -13.824 25.884 1.00 0.37 C ATOM 1506 CE2 TYR B 39 0.370 -14.651 25.660 1.00 0.36 C ATOM 1507 CZ TYR B 39 -0.986 -14.723 25.319 1.00 0.39 C ATOM 1508 OH TYR B 39 -1.421 -15.679 24.423 1.00 0.45 O ATOM 0 H TYR B 39 -1.576 -10.291 29.017 1.00 0.18 H new ATOM 0 HA TYR B 39 -0.329 -12.950 29.767 1.00 0.20 H new ATOM 0 HB2 TYR B 39 0.163 -10.744 27.692 1.00 0.23 H new ATOM 0 HB3 TYR B 39 1.473 -11.799 28.183 1.00 0.23 H new ATOM 0 HD1 TYR B 39 -2.158 -12.161 27.227 1.00 0.31 H new ATOM 0 HD2 TYR B 39 1.858 -13.625 26.826 1.00 0.31 H new ATOM 0 HE1 TYR B 39 -2.944 -13.879 25.620 1.00 0.37 H new ATOM 0 HE2 TYR B 39 1.074 -15.344 25.224 1.00 0.36 H new ATOM 0 HH TYR B 39 -0.660 -16.220 24.126 1.00 0.45 H new ATOM 1518 N VAL B 40 1.554 -11.793 31.065 1.00 0.21 N ATOM 1519 CA VAL B 40 2.477 -11.053 31.976 1.00 0.21 C ATOM 1520 C VAL B 40 3.935 -11.359 31.624 1.00 0.21 C ATOM 1521 O VAL B 40 4.354 -12.499 31.609 1.00 0.23 O ATOM 1522 CB VAL B 40 2.146 -11.560 33.379 1.00 0.24 C ATOM 1523 CG1 VAL B 40 3.132 -10.960 34.382 1.00 0.26 C ATOM 1524 CG2 VAL B 40 0.723 -11.132 33.747 1.00 0.26 C ATOM 0 H VAL B 40 1.771 -12.780 30.928 1.00 0.21 H new ATOM 0 HA VAL B 40 2.353 -9.973 31.894 1.00 0.21 H new ATOM 0 HB VAL B 40 2.220 -12.647 33.403 1.00 0.24 H new ATOM 0 HG11 VAL B 40 2.897 -11.321 35.383 1.00 0.26 H new ATOM 0 HG12 VAL B 40 4.147 -11.258 34.118 1.00 0.26 H new ATOM 0 HG13 VAL B 40 3.056 -9.873 34.361 1.00 0.26 H new ATOM 0 HG21 VAL B 40 0.482 -11.492 34.747 1.00 0.26 H new ATOM 0 HG22 VAL B 40 0.653 -10.044 33.726 1.00 0.26 H new ATOM 0 HG23 VAL B 40 0.019 -11.555 33.030 1.00 0.26 H new ATOM 1534 N ASP B 41 4.720 -10.345 31.372 1.00 0.21 N ATOM 1535 CA ASP B 41 6.159 -10.579 31.055 1.00 0.21 C ATOM 1536 C ASP B 41 7.017 -9.413 31.557 1.00 0.24 C ATOM 1537 O ASP B 41 6.645 -8.263 31.446 1.00 0.26 O ATOM 1538 CB ASP B 41 6.216 -10.669 29.528 1.00 0.19 C ATOM 1539 CG ASP B 41 5.793 -9.331 28.917 1.00 1.00 C ATOM 1540 OD1 ASP B 41 5.219 -8.529 29.635 1.00 1.68 O ATOM 1541 OD2 ASP B 41 6.046 -9.133 27.740 1.00 1.77 O ATOM 0 H ASP B 41 4.428 -9.368 31.372 1.00 0.21 H new ATOM 0 HA ASP B 41 6.544 -11.479 31.534 1.00 0.21 H new ATOM 0 HB2 ASP B 41 7.226 -10.924 29.206 1.00 0.19 H new ATOM 0 HB3 ASP B 41 5.559 -11.465 29.176 1.00 0.19 H new ATOM 1546 N ASP B 42 8.211 -9.695 32.004 1.00 0.27 N ATOM 1547 CA ASP B 42 9.147 -8.597 32.388 1.00 0.32 C ATOM 1548 C ASP B 42 8.425 -7.506 33.190 1.00 0.32 C ATOM 1549 O ASP B 42 8.672 -6.330 33.007 1.00 0.37 O ATOM 1550 CB ASP B 42 9.653 -8.040 31.059 1.00 0.37 C ATOM 1551 CG ASP B 42 10.599 -6.868 31.322 1.00 0.45 C ATOM 1552 OD1 ASP B 42 10.926 -6.642 32.475 1.00 1.21 O ATOM 1553 OD2 ASP B 42 10.981 -6.215 30.364 1.00 1.14 O ATOM 0 H ASP B 42 8.580 -10.639 32.120 1.00 0.27 H new ATOM 0 HA ASP B 42 9.955 -8.956 33.026 1.00 0.32 H new ATOM 0 HB2 ASP B 42 10.170 -8.820 30.500 1.00 0.37 H new ATOM 0 HB3 ASP B 42 8.813 -7.712 30.447 1.00 0.37 H new ATOM 1558 N GLU B 43 7.599 -7.885 34.129 1.00 0.29 N ATOM 1559 CA GLU B 43 6.936 -6.868 35.004 1.00 0.30 C ATOM 1560 C GLU B 43 6.059 -5.927 34.172 1.00 0.29 C ATOM 1561 O GLU B 43 5.520 -4.961 34.674 1.00 0.30 O ATOM 1562 CB GLU B 43 8.083 -6.096 35.658 1.00 0.34 C ATOM 1563 CG GLU B 43 7.528 -5.190 36.760 1.00 1.17 C ATOM 1564 CD GLU B 43 7.018 -6.048 37.919 1.00 1.34 C ATOM 1565 OE1 GLU B 43 7.494 -7.163 38.058 1.00 1.92 O ATOM 1566 OE2 GLU B 43 6.161 -5.576 38.647 1.00 1.68 O ATOM 0 H GLU B 43 7.353 -8.854 34.330 1.00 0.29 H new ATOM 0 HA GLU B 43 6.282 -7.331 35.742 1.00 0.30 H new ATOM 0 HB2 GLU B 43 8.811 -6.791 36.077 1.00 0.34 H new ATOM 0 HB3 GLU B 43 8.606 -5.499 34.911 1.00 0.34 H new ATOM 0 HG2 GLU B 43 8.304 -4.510 37.111 1.00 1.17 H new ATOM 0 HG3 GLU B 43 6.719 -4.574 36.366 1.00 1.17 H new ATOM 1573 N LYS B 44 5.841 -6.250 32.928 1.00 0.29 N ATOM 1574 CA LYS B 44 4.919 -5.428 32.094 1.00 0.30 C ATOM 1575 C LYS B 44 3.639 -6.211 31.805 1.00 0.27 C ATOM 1576 O LYS B 44 3.643 -7.424 31.738 1.00 0.26 O ATOM 1577 CB LYS B 44 5.677 -5.159 30.793 1.00 0.34 C ATOM 1578 CG LYS B 44 6.826 -4.185 31.054 1.00 1.29 C ATOM 1579 CD LYS B 44 7.478 -3.810 29.721 1.00 1.23 C ATOM 1580 CE LYS B 44 8.610 -2.813 29.965 1.00 1.90 C ATOM 1581 NZ LYS B 44 9.837 -3.646 30.092 1.00 2.00 N ATOM 0 H LYS B 44 6.261 -7.048 32.452 1.00 0.29 H new ATOM 0 HA LYS B 44 4.631 -4.503 32.594 1.00 0.30 H new ATOM 0 HB2 LYS B 44 6.065 -6.093 30.388 1.00 0.34 H new ATOM 0 HB3 LYS B 44 5.000 -4.745 30.046 1.00 0.34 H new ATOM 0 HG2 LYS B 44 6.455 -3.291 31.555 1.00 1.29 H new ATOM 0 HG3 LYS B 44 7.561 -4.640 31.717 1.00 1.29 H new ATOM 0 HD2 LYS B 44 7.866 -4.703 29.231 1.00 1.23 H new ATOM 0 HD3 LYS B 44 6.736 -3.376 29.051 1.00 1.23 H new ATOM 0 HE2 LYS B 44 8.697 -2.105 29.141 1.00 1.90 H new ATOM 0 HE3 LYS B 44 8.434 -2.229 30.869 1.00 1.90 H new ATOM 0 HZ1 LYS B 44 10.380 -3.339 30.924 1.00 2.00 H new ATOM 0 HZ2 LYS B 44 9.569 -4.645 30.203 1.00 2.00 H new ATOM 0 HZ3 LYS B 44 10.420 -3.537 29.238 1.00 2.00 H new ATOM 1595 N ILE B 45 2.556 -5.526 31.571 1.00 0.28 N ATOM 1596 CA ILE B 45 1.295 -6.231 31.216 1.00 0.26 C ATOM 1597 C ILE B 45 1.163 -6.325 29.695 1.00 0.26 C ATOM 1598 O ILE B 45 1.274 -5.340 28.993 1.00 0.29 O ATOM 1599 CB ILE B 45 0.182 -5.360 31.799 1.00 0.29 C ATOM 1600 CG1 ILE B 45 0.419 -5.174 33.299 1.00 0.33 C ATOM 1601 CG2 ILE B 45 -1.169 -6.041 31.578 1.00 0.28 C ATOM 1602 CD1 ILE B 45 -0.505 -4.077 33.828 1.00 1.24 C ATOM 0 H ILE B 45 2.490 -4.509 31.610 1.00 0.28 H new ATOM 0 HA ILE B 45 1.260 -7.249 31.604 1.00 0.26 H new ATOM 0 HB ILE B 45 0.183 -4.388 31.305 1.00 0.29 H new ATOM 0 HG12 ILE B 45 0.231 -6.109 33.827 1.00 0.33 H new ATOM 0 HG13 ILE B 45 1.460 -4.908 33.484 1.00 0.33 H new ATOM 0 HG21 ILE B 45 -1.962 -5.420 31.994 1.00 0.28 H new ATOM 0 HG22 ILE B 45 -1.337 -6.177 30.510 1.00 0.28 H new ATOM 0 HG23 ILE B 45 -1.172 -7.012 32.073 1.00 0.28 H new ATOM 0 HD11 ILE B 45 -0.337 -3.944 34.897 1.00 1.24 H new ATOM 0 HD12 ILE B 45 -0.295 -3.142 33.308 1.00 1.24 H new ATOM 0 HD13 ILE B 45 -1.543 -4.362 33.657 1.00 1.24 H new ATOM 1614 N ILE B 46 0.931 -7.503 29.185 1.00 0.26 N ATOM 1615 CA ILE B 46 0.794 -7.671 27.710 1.00 0.29 C ATOM 1616 C ILE B 46 -0.642 -8.073 27.361 1.00 0.28 C ATOM 1617 O ILE B 46 -1.126 -9.102 27.783 1.00 0.31 O ATOM 1618 CB ILE B 46 1.776 -8.792 27.354 1.00 0.32 C ATOM 1619 CG1 ILE B 46 3.194 -8.377 27.753 1.00 0.44 C ATOM 1620 CG2 ILE B 46 1.726 -9.076 25.851 1.00 0.37 C ATOM 1621 CD1 ILE B 46 3.468 -6.955 27.265 1.00 0.50 C ATOM 0 H ILE B 46 0.830 -8.360 29.728 1.00 0.26 H new ATOM 0 HA ILE B 46 1.007 -6.754 27.160 1.00 0.29 H new ATOM 0 HB ILE B 46 1.496 -9.696 27.895 1.00 0.32 H new ATOM 0 HG12 ILE B 46 3.308 -8.429 28.836 1.00 0.44 H new ATOM 0 HG13 ILE B 46 3.920 -9.066 27.323 1.00 0.44 H new ATOM 0 HG21 ILE B 46 2.427 -9.874 25.608 1.00 0.37 H new ATOM 0 HG22 ILE B 46 0.718 -9.382 25.572 1.00 0.37 H new ATOM 0 HG23 ILE B 46 1.997 -8.175 25.301 1.00 0.37 H new ATOM 0 HD11 ILE B 46 4.478 -6.661 27.550 1.00 0.50 H new ATOM 0 HD12 ILE B 46 3.372 -6.918 26.180 1.00 0.50 H new ATOM 0 HD13 ILE B 46 2.750 -6.271 27.717 1.00 0.50 H new ATOM 1633 N LEU B 47 -1.331 -7.267 26.602 1.00 0.28 N ATOM 1634 CA LEU B 47 -2.738 -7.611 26.240 1.00 0.29 C ATOM 1635 C LEU B 47 -2.857 -7.835 24.732 1.00 0.31 C ATOM 1636 O LEU B 47 -2.340 -7.072 23.940 1.00 0.38 O ATOM 1637 CB LEU B 47 -3.571 -6.403 26.666 1.00 0.34 C ATOM 1638 CG LEU B 47 -3.359 -6.136 28.158 1.00 0.90 C ATOM 1639 CD1 LEU B 47 -2.040 -5.389 28.361 1.00 1.66 C ATOM 1640 CD2 LEU B 47 -4.513 -5.281 28.688 1.00 1.23 C ATOM 0 H LEU B 47 -0.984 -6.388 26.217 1.00 0.28 H new ATOM 0 HA LEU B 47 -3.073 -8.527 26.727 1.00 0.29 H new ATOM 0 HB2 LEU B 47 -3.284 -5.527 26.085 1.00 0.34 H new ATOM 0 HB3 LEU B 47 -4.626 -6.587 26.465 1.00 0.34 H new ATOM 0 HG LEU B 47 -3.327 -7.083 28.696 1.00 0.90 H new ATOM 0 HD11 LEU B 47 -1.889 -5.199 29.424 1.00 1.66 H new ATOM 0 HD12 LEU B 47 -1.217 -5.994 27.980 1.00 1.66 H new ATOM 0 HD13 LEU B 47 -2.072 -4.441 27.824 1.00 1.66 H new ATOM 0 HD21 LEU B 47 -4.365 -5.089 29.751 1.00 1.23 H new ATOM 0 HD22 LEU B 47 -4.542 -4.334 28.149 1.00 1.23 H new ATOM 0 HD23 LEU B 47 -5.455 -5.810 28.543 1.00 1.23 H new ATOM 1652 N LYS B 48 -3.525 -8.880 24.330 1.00 0.28 N ATOM 1653 CA LYS B 48 -3.668 -9.160 22.874 1.00 0.34 C ATOM 1654 C LYS B 48 -5.062 -9.716 22.573 1.00 0.27 C ATOM 1655 O LYS B 48 -5.730 -10.239 23.442 1.00 0.24 O ATOM 1656 CB LYS B 48 -2.595 -10.206 22.567 1.00 0.47 C ATOM 1657 CG LYS B 48 -2.824 -11.447 23.432 1.00 0.65 C ATOM 1658 CD LYS B 48 -1.728 -12.476 23.147 1.00 0.85 C ATOM 1659 CE LYS B 48 -0.407 -11.998 23.752 1.00 1.54 C ATOM 1660 NZ LYS B 48 0.632 -12.883 23.154 1.00 1.74 N ATOM 0 H LYS B 48 -3.979 -9.553 24.948 1.00 0.28 H new ATOM 0 HA LYS B 48 -3.550 -8.262 22.268 1.00 0.34 H new ATOM 0 HB2 LYS B 48 -2.627 -10.475 21.511 1.00 0.47 H new ATOM 0 HB3 LYS B 48 -1.605 -9.793 22.761 1.00 0.47 H new ATOM 0 HG2 LYS B 48 -2.816 -11.174 24.487 1.00 0.65 H new ATOM 0 HG3 LYS B 48 -3.804 -11.875 23.220 1.00 0.65 H new ATOM 0 HD2 LYS B 48 -2.004 -13.443 23.568 1.00 0.85 H new ATOM 0 HD3 LYS B 48 -1.618 -12.617 22.072 1.00 0.85 H new ATOM 0 HE2 LYS B 48 -0.219 -10.951 23.513 1.00 1.54 H new ATOM 0 HE3 LYS B 48 -0.418 -12.080 24.839 1.00 1.54 H new ATOM 0 HZ1 LYS B 48 1.531 -12.364 23.082 1.00 1.74 H new ATOM 0 HZ2 LYS B 48 0.763 -13.721 23.756 1.00 1.74 H new ATOM 0 HZ3 LYS B 48 0.329 -13.183 22.205 1.00 1.74 H new ATOM 1674 N LYS B 49 -5.481 -9.664 21.337 1.00 0.28 N ATOM 1675 CA LYS B 49 -6.801 -10.255 20.980 1.00 0.25 C ATOM 1676 C LYS B 49 -6.837 -11.729 21.383 1.00 0.22 C ATOM 1677 O LYS B 49 -5.820 -12.392 21.434 1.00 0.24 O ATOM 1678 CB LYS B 49 -6.909 -10.113 19.462 1.00 0.28 C ATOM 1679 CG LYS B 49 -8.282 -10.603 19.000 1.00 0.30 C ATOM 1680 CD LYS B 49 -8.366 -10.521 17.475 1.00 0.54 C ATOM 1681 CE LYS B 49 -9.787 -10.863 17.021 1.00 1.08 C ATOM 1682 NZ LYS B 49 -9.812 -10.549 15.565 1.00 1.65 N ATOM 0 H LYS B 49 -4.969 -9.240 20.563 1.00 0.28 H new ATOM 0 HA LYS B 49 -7.627 -9.760 21.491 1.00 0.25 H new ATOM 0 HB2 LYS B 49 -6.766 -9.072 19.172 1.00 0.28 H new ATOM 0 HB3 LYS B 49 -6.123 -10.690 18.975 1.00 0.28 H new ATOM 0 HG2 LYS B 49 -8.443 -11.630 19.329 1.00 0.30 H new ATOM 0 HG3 LYS B 49 -9.067 -9.996 19.451 1.00 0.30 H new ATOM 0 HD2 LYS B 49 -8.097 -9.520 17.139 1.00 0.54 H new ATOM 0 HD3 LYS B 49 -7.653 -11.211 17.024 1.00 0.54 H new ATOM 0 HE2 LYS B 49 -10.017 -11.913 17.202 1.00 1.08 H new ATOM 0 HE3 LYS B 49 -10.527 -10.276 17.564 1.00 1.08 H new ATOM 0 HZ1 LYS B 49 -10.756 -10.758 15.181 1.00 1.65 H new ATOM 0 HZ2 LYS B 49 -9.596 -9.542 15.423 1.00 1.65 H new ATOM 0 HZ3 LYS B 49 -9.102 -11.128 15.073 1.00 1.65 H new ATOM 1696 N TYR B 50 -7.983 -12.221 21.756 1.00 0.20 N ATOM 1697 CA TYR B 50 -8.059 -13.624 22.254 1.00 0.22 C ATOM 1698 C TYR B 50 -8.620 -14.550 21.171 1.00 0.25 C ATOM 1699 O TYR B 50 -9.761 -14.435 20.771 1.00 0.20 O ATOM 1700 CB TYR B 50 -9.007 -13.562 23.451 1.00 0.22 C ATOM 1701 CG TYR B 50 -9.166 -14.941 24.042 1.00 0.30 C ATOM 1702 CD1 TYR B 50 -8.118 -15.865 23.959 1.00 0.38 C ATOM 1703 CD2 TYR B 50 -10.365 -15.297 24.672 1.00 0.41 C ATOM 1704 CE1 TYR B 50 -8.269 -17.145 24.507 1.00 0.48 C ATOM 1705 CE2 TYR B 50 -10.516 -16.575 25.220 1.00 0.52 C ATOM 1706 CZ TYR B 50 -9.468 -17.500 25.136 1.00 0.53 C ATOM 1707 OH TYR B 50 -9.617 -18.761 25.676 1.00 0.65 O ATOM 0 H TYR B 50 -8.869 -11.716 21.739 1.00 0.20 H new ATOM 0 HA TYR B 50 -7.080 -14.019 22.524 1.00 0.22 H new ATOM 0 HB2 TYR B 50 -8.616 -12.876 24.202 1.00 0.22 H new ATOM 0 HB3 TYR B 50 -9.977 -13.175 23.140 1.00 0.22 H new ATOM 0 HD1 TYR B 50 -7.193 -15.591 23.473 1.00 0.38 H new ATOM 0 HD2 TYR B 50 -11.174 -14.584 24.735 1.00 0.41 H new ATOM 0 HE1 TYR B 50 -7.460 -17.858 24.444 1.00 0.48 H new ATOM 0 HE2 TYR B 50 -11.440 -16.848 25.708 1.00 0.52 H new ATOM 0 HH TYR B 50 -10.508 -18.843 26.076 1.00 0.65 H new ATOM 1717 N LYS B 51 -7.837 -15.494 20.725 1.00 0.38 N ATOM 1718 CA LYS B 51 -8.337 -16.457 19.701 1.00 0.44 C ATOM 1719 C LYS B 51 -8.088 -17.896 20.164 1.00 1.25 C ATOM 1720 O LYS B 51 -7.132 -18.523 19.755 1.00 2.08 O ATOM 1721 CB LYS B 51 -7.526 -16.151 18.441 1.00 1.27 C ATOM 1722 CG LYS B 51 -6.035 -16.134 18.784 1.00 2.06 C ATOM 1723 CD LYS B 51 -5.278 -17.047 17.818 1.00 2.71 C ATOM 1724 CE LYS B 51 -4.582 -16.197 16.752 1.00 3.57 C ATOM 1725 NZ LYS B 51 -5.113 -16.699 15.454 1.00 4.35 N ATOM 0 H LYS B 51 -6.873 -15.641 21.025 1.00 0.38 H new ATOM 0 HA LYS B 51 -9.409 -16.359 19.529 1.00 0.44 H new ATOM 0 HB2 LYS B 51 -7.725 -16.902 17.676 1.00 1.27 H new ATOM 0 HB3 LYS B 51 -7.826 -15.188 18.028 1.00 1.27 H new ATOM 0 HG2 LYS B 51 -5.648 -15.117 18.719 1.00 2.06 H new ATOM 0 HG3 LYS B 51 -5.883 -16.468 19.811 1.00 2.06 H new ATOM 0 HD2 LYS B 51 -4.543 -17.640 18.362 1.00 2.71 H new ATOM 0 HD3 LYS B 51 -5.968 -17.747 17.347 1.00 2.71 H new ATOM 0 HE2 LYS B 51 -4.802 -15.138 16.886 1.00 3.57 H new ATOM 0 HE3 LYS B 51 -3.499 -16.307 16.805 1.00 3.57 H new ATOM 0 HZ1 LYS B 51 -4.682 -16.165 14.673 1.00 4.35 H new ATOM 0 HZ2 LYS B 51 -4.883 -17.708 15.352 1.00 4.35 H new ATOM 0 HZ3 LYS B 51 -6.145 -16.575 15.430 1.00 4.35 H new ATOM 1739 N PRO B 52 -8.955 -18.363 21.020 1.00 1.79 N ATOM 1740 CA PRO B 52 -8.825 -19.737 21.563 1.00 2.79 C ATOM 1741 C PRO B 52 -8.828 -20.762 20.426 1.00 2.90 C ATOM 1742 O PRO B 52 -9.504 -20.596 19.430 1.00 3.05 O ATOM 1743 CB PRO B 52 -10.058 -19.909 22.455 1.00 3.58 C ATOM 1744 CG PRO B 52 -10.974 -18.773 22.114 1.00 3.28 C ATOM 1745 CD PRO B 52 -10.125 -17.666 21.552 1.00 2.28 C ATOM 0 HA PRO B 52 -7.895 -19.887 22.110 1.00 2.79 H new ATOM 0 HB2 PRO B 52 -10.541 -20.869 22.272 1.00 3.58 H new ATOM 0 HB3 PRO B 52 -9.783 -19.886 23.510 1.00 3.58 H new ATOM 0 HG2 PRO B 52 -11.724 -19.089 21.388 1.00 3.28 H new ATOM 0 HG3 PRO B 52 -11.511 -18.433 23.000 1.00 3.28 H new ATOM 0 HD2 PRO B 52 -10.651 -17.114 20.773 1.00 2.28 H new ATOM 0 HD3 PRO B 52 -9.847 -16.945 22.321 1.00 2.28 H new ATOM 1753 N ASN B 53 -8.074 -21.817 20.564 1.00 3.43 N ATOM 1754 CA ASN B 53 -8.029 -22.850 19.489 1.00 4.01 C ATOM 1755 C ASN B 53 -9.448 -23.294 19.123 1.00 4.61 C ATOM 1756 O ASN B 53 -10.058 -22.639 18.295 1.00 5.09 O ATOM 1757 CB ASN B 53 -7.239 -24.013 20.089 1.00 4.59 C ATOM 1758 CG ASN B 53 -5.809 -23.560 20.386 1.00 5.20 C ATOM 1759 OD1 ASN B 53 -5.355 -22.561 19.863 1.00 5.34 O ATOM 1760 ND2 ASN B 53 -5.074 -24.257 21.209 1.00 5.97 N ATOM 1761 OXT ASN B 53 -9.899 -24.283 19.678 1.00 4.97 O ATOM 0 H ASN B 53 -7.486 -22.009 21.375 1.00 3.43 H new ATOM 0 HA ASN B 53 -7.569 -22.475 18.575 1.00 4.01 H new ATOM 0 HB2 ASN B 53 -7.720 -24.359 21.004 1.00 4.59 H new ATOM 0 HB3 ASN B 53 -7.229 -24.855 19.397 1.00 4.59 H new ATOM 0 HD21 ASN B 53 -4.119 -23.963 21.413 1.00 5.97 H new ATOM 0 HD22 ASN B 53 -5.455 -25.095 21.648 1.00 5.97 H new TER 1768 ASN B 53