USER MOD reduce.3.24.130724 H: found=0, std=0, add=960, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 958 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 75 SER OG : rot 180:sc= 0.0447 USER MOD Set 1.2: A 78 HIS : no HD1:sc= -0.0351 X(o=0.0096,f=-0.15) USER MOD Set 2.1: A 58 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 69 HIS : no HD1:sc= -0.0932 X(o=-0.093,f=0.0078) USER MOD Set 3.1: A 55 SER OG : rot -6:sc= -1.76! USER MOD Set 3.2: A 99 HIS : no HD1:sc= -8.01! C(o=-9.8!,f=-6.6!) USER MOD Set 4.1: A 15 GLN : amide:sc= -1.67 X(o=-0.46,f=-0.14) USER MOD Set 4.2: A 16 SER OG : rot 40:sc= 1.21 USER MOD Single : A 1 GLY N :NH3+ -139:sc= 0.0622 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 27:sc= 0.957 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 56:sc= 0.112 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 23 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 27 CYS SG : rot 70:sc= -4.78! USER MOD Single : A 29 SER OG : rot 180:sc= -0.16 USER MOD Single : A 30 MET CE :methyl -153:sc= -0.0277 (180deg=-0.234) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 180:sc= -0.382 USER MOD Single : A 38 SER OG : rot 180:sc= -1.4 USER MOD Single : A 46 SER OG : rot -15:sc= 0.463 USER MOD Single : A 48 ASN : amide:sc= -2.79 K(o=-2.8,f=-4.2!) USER MOD Single : A 52 THR OG1 : rot -120:sc= -1.18 USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 SER OG : rot -71:sc= 0.55 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 TYR OH : rot 110:sc= -0.0274 USER MOD Single : A 100 THR OG1 : rot 35:sc= -0.945 USER MOD Single : A 108 SER OG : rot -125:sc= 0.798 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 115 THR OG1 : rot 170:sc= 1.21 USER MOD Single : A 121 SER OG : rot 170:sc= -0.0507 USER MOD Single : A 126 LYS NZ :NH3+ -147:sc= -0.452 (180deg=-1.72!) USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.812 -27.990 -18.390 1.00 0.00 N ATOM 2 CA GLY A 1 3.995 -27.151 -18.329 1.00 0.00 C ATOM 3 C GLY A 1 5.279 -27.956 -18.353 1.00 0.00 C ATOM 4 O GLY A 1 5.282 -29.120 -18.753 1.00 0.00 O ATOM 0 H1 GLY A 1 2.110 -27.554 -19.021 1.00 0.00 H new ATOM 0 H2 GLY A 1 3.071 -28.929 -18.755 1.00 0.00 H new ATOM 0 H3 GLY A 1 2.407 -28.089 -17.437 1.00 0.00 H new ATOM 0 HA2 GLY A 1 3.989 -26.458 -19.170 1.00 0.00 H new ATOM 0 HA3 GLY A 1 3.964 -26.550 -17.420 1.00 0.00 H new ATOM 8 N SER A 2 6.373 -27.336 -17.924 1.00 0.00 N ATOM 9 CA SER A 2 7.671 -28.001 -17.903 1.00 0.00 C ATOM 10 C SER A 2 8.493 -27.549 -16.700 1.00 0.00 C ATOM 11 O SER A 2 8.111 -26.623 -15.985 1.00 0.00 O ATOM 12 CB SER A 2 8.436 -27.713 -19.196 1.00 0.00 C ATOM 13 OG SER A 2 7.811 -28.330 -20.308 1.00 0.00 O ATOM 0 H SER A 2 6.387 -26.374 -17.586 1.00 0.00 H new ATOM 0 HA SER A 2 7.501 -29.075 -17.822 1.00 0.00 H new ATOM 0 HB2 SER A 2 8.491 -26.636 -19.357 1.00 0.00 H new ATOM 0 HB3 SER A 2 9.460 -28.074 -19.104 1.00 0.00 H new ATOM 0 HG SER A 2 8.319 -28.129 -21.122 1.00 0.00 H new ATOM 19 N SER A 3 9.626 -28.210 -16.484 1.00 0.00 N ATOM 20 CA SER A 3 10.502 -27.880 -15.366 1.00 0.00 C ATOM 21 C SER A 3 11.796 -27.239 -15.860 1.00 0.00 C ATOM 22 O SER A 3 12.177 -27.397 -17.019 1.00 0.00 O ATOM 23 CB SER A 3 10.820 -29.136 -14.552 1.00 0.00 C ATOM 24 OG SER A 3 11.064 -28.814 -13.193 1.00 0.00 O ATOM 0 H SER A 3 9.959 -28.977 -17.068 1.00 0.00 H new ATOM 0 HA SER A 3 9.983 -27.164 -14.729 1.00 0.00 H new ATOM 0 HB2 SER A 3 9.988 -29.837 -14.619 1.00 0.00 H new ATOM 0 HB3 SER A 3 11.693 -29.635 -14.973 1.00 0.00 H new ATOM 0 HG SER A 3 11.263 -29.633 -12.693 1.00 0.00 H new ATOM 30 N GLY A 4 12.467 -26.515 -14.970 1.00 0.00 N ATOM 31 CA GLY A 4 13.711 -25.861 -15.333 1.00 0.00 C ATOM 32 C GLY A 4 14.902 -26.424 -14.585 1.00 0.00 C ATOM 33 O GLY A 4 15.262 -27.588 -14.762 1.00 0.00 O ATOM 0 H GLY A 4 12.172 -26.369 -14.005 1.00 0.00 H new ATOM 0 HA2 GLY A 4 13.875 -25.969 -16.405 1.00 0.00 H new ATOM 0 HA3 GLY A 4 13.629 -24.793 -15.129 1.00 0.00 H new ATOM 37 N SER A 5 15.518 -25.596 -13.746 1.00 0.00 N ATOM 38 CA SER A 5 16.680 -26.017 -12.972 1.00 0.00 C ATOM 39 C SER A 5 16.292 -27.073 -11.941 1.00 0.00 C ATOM 40 O SER A 5 15.663 -26.767 -10.928 1.00 0.00 O ATOM 41 CB SER A 5 17.315 -24.814 -12.272 1.00 0.00 C ATOM 42 OG SER A 5 16.424 -24.242 -11.330 1.00 0.00 O ATOM 0 H SER A 5 15.232 -24.630 -13.585 1.00 0.00 H new ATOM 0 HA SER A 5 17.405 -26.454 -13.659 1.00 0.00 H new ATOM 0 HB2 SER A 5 18.231 -25.124 -11.769 1.00 0.00 H new ATOM 0 HB3 SER A 5 17.596 -24.065 -13.013 1.00 0.00 H new ATOM 0 HG SER A 5 15.806 -24.930 -11.004 1.00 0.00 H new ATOM 48 N SER A 6 16.673 -28.318 -12.208 1.00 0.00 N ATOM 49 CA SER A 6 16.363 -29.422 -11.307 1.00 0.00 C ATOM 50 C SER A 6 17.573 -29.779 -10.449 1.00 0.00 C ATOM 51 O SER A 6 18.433 -30.556 -10.862 1.00 0.00 O ATOM 52 CB SER A 6 15.908 -30.646 -12.103 1.00 0.00 C ATOM 53 OG SER A 6 15.929 -31.814 -11.301 1.00 0.00 O ATOM 0 H SER A 6 17.197 -28.588 -13.041 1.00 0.00 H new ATOM 0 HA SER A 6 15.554 -29.105 -10.649 1.00 0.00 H new ATOM 0 HB2 SER A 6 14.900 -30.481 -12.484 1.00 0.00 H new ATOM 0 HB3 SER A 6 16.558 -30.783 -12.968 1.00 0.00 H new ATOM 0 HG SER A 6 15.632 -32.582 -11.833 1.00 0.00 H new ATOM 59 N GLY A 7 17.632 -29.205 -9.251 1.00 0.00 N ATOM 60 CA GLY A 7 18.740 -29.475 -8.354 1.00 0.00 C ATOM 61 C GLY A 7 18.601 -28.752 -7.029 1.00 0.00 C ATOM 62 O GLY A 7 17.581 -28.117 -6.762 1.00 0.00 O ATOM 0 H GLY A 7 16.933 -28.558 -8.886 1.00 0.00 H new ATOM 0 HA2 GLY A 7 18.805 -30.548 -8.174 1.00 0.00 H new ATOM 0 HA3 GLY A 7 19.672 -29.175 -8.832 1.00 0.00 H new ATOM 66 N THR A 8 19.631 -28.849 -6.193 1.00 0.00 N ATOM 67 CA THR A 8 19.619 -28.202 -4.887 1.00 0.00 C ATOM 68 C THR A 8 20.482 -26.945 -4.888 1.00 0.00 C ATOM 69 O THR A 8 21.581 -26.936 -4.333 1.00 0.00 O ATOM 70 CB THR A 8 20.118 -29.153 -3.784 1.00 0.00 C ATOM 71 OG1 THR A 8 21.331 -29.792 -4.199 1.00 0.00 O ATOM 72 CG2 THR A 8 19.070 -30.207 -3.462 1.00 0.00 C ATOM 0 H THR A 8 20.484 -29.370 -6.398 1.00 0.00 H new ATOM 0 HA THR A 8 18.584 -27.929 -4.679 1.00 0.00 H new ATOM 0 HB THR A 8 20.306 -28.564 -2.886 1.00 0.00 H new ATOM 0 HG1 THR A 8 21.997 -29.111 -4.428 1.00 0.00 H new ATOM 0 HG21 THR A 8 19.446 -30.867 -2.680 1.00 0.00 H new ATOM 0 HG22 THR A 8 18.158 -29.720 -3.118 1.00 0.00 H new ATOM 0 HG23 THR A 8 18.854 -30.791 -4.357 1.00 0.00 H new ATOM 80 N ILE A 9 19.977 -25.887 -5.513 1.00 0.00 N ATOM 81 CA ILE A 9 20.703 -24.625 -5.584 1.00 0.00 C ATOM 82 C ILE A 9 20.306 -23.698 -4.440 1.00 0.00 C ATOM 83 O ILE A 9 19.158 -23.697 -3.999 1.00 0.00 O ATOM 84 CB ILE A 9 20.452 -23.906 -6.923 1.00 0.00 C ATOM 85 CG1 ILE A 9 20.970 -24.752 -8.087 1.00 0.00 C ATOM 86 CG2 ILE A 9 21.114 -22.536 -6.921 1.00 0.00 C ATOM 87 CD1 ILE A 9 20.460 -24.301 -9.437 1.00 0.00 C ATOM 0 H ILE A 9 19.069 -25.878 -5.977 1.00 0.00 H new ATOM 0 HA ILE A 9 21.763 -24.865 -5.503 1.00 0.00 H new ATOM 0 HB ILE A 9 19.378 -23.769 -7.049 1.00 0.00 H new ATOM 0 HG12 ILE A 9 22.060 -24.721 -8.091 1.00 0.00 H new ATOM 0 HG13 ILE A 9 20.681 -25.791 -7.927 1.00 0.00 H new ATOM 0 HG21 ILE A 9 20.928 -22.040 -7.874 1.00 0.00 H new ATOM 0 HG22 ILE A 9 20.701 -21.934 -6.112 1.00 0.00 H new ATOM 0 HG23 ILE A 9 22.188 -22.651 -6.776 1.00 0.00 H new ATOM 0 HD11 ILE A 9 20.868 -24.947 -10.214 1.00 0.00 H new ATOM 0 HD12 ILE A 9 19.372 -24.358 -9.452 1.00 0.00 H new ATOM 0 HD13 ILE A 9 20.772 -23.272 -9.619 1.00 0.00 H new ATOM 99 N GLU A 10 21.266 -22.910 -3.965 1.00 0.00 N ATOM 100 CA GLU A 10 21.016 -21.977 -2.872 1.00 0.00 C ATOM 101 C GLU A 10 21.802 -20.684 -3.069 1.00 0.00 C ATOM 102 O GLU A 10 23.024 -20.660 -2.922 1.00 0.00 O ATOM 103 CB GLU A 10 21.389 -22.615 -1.532 1.00 0.00 C ATOM 104 CG GLU A 10 20.443 -23.723 -1.100 1.00 0.00 C ATOM 105 CD GLU A 10 20.612 -24.098 0.359 1.00 0.00 C ATOM 106 OE1 GLU A 10 20.420 -23.217 1.223 1.00 0.00 O ATOM 107 OE2 GLU A 10 20.935 -25.271 0.637 1.00 0.00 O ATOM 0 H GLU A 10 22.222 -22.899 -4.319 1.00 0.00 H new ATOM 0 HA GLU A 10 19.953 -21.738 -2.869 1.00 0.00 H new ATOM 0 HB2 GLU A 10 22.400 -23.018 -1.600 1.00 0.00 H new ATOM 0 HB3 GLU A 10 21.405 -21.842 -0.763 1.00 0.00 H new ATOM 0 HG2 GLU A 10 19.415 -23.406 -1.273 1.00 0.00 H new ATOM 0 HG3 GLU A 10 20.613 -24.603 -1.720 1.00 0.00 H new ATOM 114 N ALA A 11 21.092 -19.612 -3.405 1.00 0.00 N ATOM 115 CA ALA A 11 21.722 -18.316 -3.621 1.00 0.00 C ATOM 116 C ALA A 11 20.754 -17.177 -3.318 1.00 0.00 C ATOM 117 O ALA A 11 19.617 -17.410 -2.906 1.00 0.00 O ATOM 118 CB ALA A 11 22.234 -18.209 -5.050 1.00 0.00 C ATOM 0 H ALA A 11 20.080 -19.616 -3.533 1.00 0.00 H new ATOM 0 HA ALA A 11 22.566 -18.232 -2.937 1.00 0.00 H new ATOM 0 HB1 ALA A 11 22.702 -17.236 -5.197 1.00 0.00 H new ATOM 0 HB2 ALA A 11 22.966 -18.995 -5.234 1.00 0.00 H new ATOM 0 HB3 ALA A 11 21.401 -18.319 -5.744 1.00 0.00 H new ATOM 124 N ARG A 12 21.212 -15.947 -3.523 1.00 0.00 N ATOM 125 CA ARG A 12 20.386 -14.772 -3.270 1.00 0.00 C ATOM 126 C ARG A 12 19.512 -14.451 -4.478 1.00 0.00 C ATOM 127 O ARG A 12 18.316 -14.190 -4.342 1.00 0.00 O ATOM 128 CB ARG A 12 21.266 -13.568 -2.929 1.00 0.00 C ATOM 129 CG ARG A 12 20.545 -12.492 -2.133 1.00 0.00 C ATOM 130 CD ARG A 12 20.480 -12.842 -0.655 1.00 0.00 C ATOM 131 NE ARG A 12 21.635 -12.334 0.079 1.00 0.00 N ATOM 132 CZ ARG A 12 21.910 -11.041 0.213 1.00 0.00 C ATOM 133 NH1 ARG A 12 21.116 -10.131 -0.334 1.00 0.00 N ATOM 134 NH2 ARG A 12 22.980 -10.656 0.897 1.00 0.00 N ATOM 0 H ARG A 12 22.150 -15.738 -3.864 1.00 0.00 H new ATOM 0 HA ARG A 12 19.737 -14.991 -2.422 1.00 0.00 H new ATOM 0 HB2 ARG A 12 22.131 -13.910 -2.361 1.00 0.00 H new ATOM 0 HB3 ARG A 12 21.644 -13.132 -3.854 1.00 0.00 H new ATOM 0 HG2 ARG A 12 21.058 -11.539 -2.260 1.00 0.00 H new ATOM 0 HG3 ARG A 12 19.535 -12.365 -2.523 1.00 0.00 H new ATOM 0 HD2 ARG A 12 19.567 -12.430 -0.225 1.00 0.00 H new ATOM 0 HD3 ARG A 12 20.426 -13.925 -0.541 1.00 0.00 H new ATOM 0 HE ARG A 12 22.265 -13.008 0.513 1.00 0.00 H new ATOM 0 HH11 ARG A 12 20.292 -10.423 -0.859 1.00 0.00 H new ATOM 0 HH12 ARG A 12 21.329 -9.139 -0.230 1.00 0.00 H new ATOM 0 HH21 ARG A 12 23.592 -11.353 1.321 1.00 0.00 H new ATOM 0 HH22 ARG A 12 23.190 -9.663 0.999 1.00 0.00 H new ATOM 148 N THR A 13 20.116 -14.472 -5.662 1.00 0.00 N ATOM 149 CA THR A 13 19.394 -14.182 -6.894 1.00 0.00 C ATOM 150 C THR A 13 17.956 -14.682 -6.820 1.00 0.00 C ATOM 151 O THR A 13 17.687 -15.863 -7.041 1.00 0.00 O ATOM 152 CB THR A 13 20.085 -14.820 -8.114 1.00 0.00 C ATOM 153 OG1 THR A 13 21.446 -14.383 -8.190 1.00 0.00 O ATOM 154 CG2 THR A 13 19.358 -14.457 -9.400 1.00 0.00 C ATOM 0 H THR A 13 21.104 -14.687 -5.793 1.00 0.00 H new ATOM 0 HA THR A 13 19.393 -13.098 -7.012 1.00 0.00 H new ATOM 0 HB THR A 13 20.058 -15.903 -7.994 1.00 0.00 H new ATOM 0 HG1 THR A 13 21.879 -14.794 -8.967 1.00 0.00 H new ATOM 0 HG21 THR A 13 19.865 -14.919 -10.247 1.00 0.00 H new ATOM 0 HG22 THR A 13 18.330 -14.817 -9.351 1.00 0.00 H new ATOM 0 HG23 THR A 13 19.357 -13.374 -9.524 1.00 0.00 H new ATOM 162 N ALA A 14 17.035 -13.777 -6.506 1.00 0.00 N ATOM 163 CA ALA A 14 15.623 -14.127 -6.405 1.00 0.00 C ATOM 164 C ALA A 14 15.173 -14.945 -7.611 1.00 0.00 C ATOM 165 O ALA A 14 15.813 -14.922 -8.661 1.00 0.00 O ATOM 166 CB ALA A 14 14.776 -12.870 -6.272 1.00 0.00 C ATOM 0 H ALA A 14 17.241 -12.796 -6.317 1.00 0.00 H new ATOM 0 HA ALA A 14 15.488 -14.739 -5.513 1.00 0.00 H new ATOM 0 HB1 ALA A 14 13.724 -13.146 -6.198 1.00 0.00 H new ATOM 0 HB2 ALA A 14 15.072 -12.325 -5.376 1.00 0.00 H new ATOM 0 HB3 ALA A 14 14.924 -12.237 -7.147 1.00 0.00 H new ATOM 172 N GLN A 15 14.068 -15.667 -7.451 1.00 0.00 N ATOM 173 CA GLN A 15 13.534 -16.494 -8.526 1.00 0.00 C ATOM 174 C GLN A 15 12.540 -15.707 -9.375 1.00 0.00 C ATOM 175 O GLN A 15 12.667 -15.644 -10.598 1.00 0.00 O ATOM 176 CB GLN A 15 12.859 -17.740 -7.953 1.00 0.00 C ATOM 177 CG GLN A 15 12.686 -18.860 -8.966 1.00 0.00 C ATOM 178 CD GLN A 15 11.627 -18.549 -10.005 1.00 0.00 C ATOM 179 OE1 GLN A 15 11.936 -18.318 -11.174 1.00 0.00 O ATOM 180 NE2 GLN A 15 10.368 -18.541 -9.583 1.00 0.00 N ATOM 0 H GLN A 15 13.526 -15.696 -6.588 1.00 0.00 H new ATOM 0 HA GLN A 15 14.365 -16.800 -9.162 1.00 0.00 H new ATOM 0 HB2 GLN A 15 13.449 -18.109 -7.114 1.00 0.00 H new ATOM 0 HB3 GLN A 15 11.881 -17.464 -7.559 1.00 0.00 H new ATOM 0 HG2 GLN A 15 13.637 -19.043 -9.466 1.00 0.00 H new ATOM 0 HG3 GLN A 15 12.419 -19.779 -8.444 1.00 0.00 H new ATOM 0 HE21 GLN A 15 10.157 -18.738 -8.605 1.00 0.00 H new ATOM 0 HE22 GLN A 15 9.612 -18.338 -10.237 1.00 0.00 H new ATOM 189 N SER A 16 11.552 -15.110 -8.718 1.00 0.00 N ATOM 190 CA SER A 16 10.533 -14.331 -9.413 1.00 0.00 C ATOM 191 C SER A 16 9.686 -13.537 -8.422 1.00 0.00 C ATOM 192 O SER A 16 9.396 -14.005 -7.321 1.00 0.00 O ATOM 193 CB SER A 16 9.638 -15.250 -10.245 1.00 0.00 C ATOM 194 OG SER A 16 10.172 -15.443 -11.543 1.00 0.00 O ATOM 0 H SER A 16 11.435 -15.150 -7.706 1.00 0.00 H new ATOM 0 HA SER A 16 11.037 -13.629 -10.077 1.00 0.00 H new ATOM 0 HB2 SER A 16 9.534 -16.213 -9.744 1.00 0.00 H new ATOM 0 HB3 SER A 16 8.639 -14.820 -10.319 1.00 0.00 H new ATOM 0 HG SER A 16 11.146 -15.535 -11.486 1.00 0.00 H new ATOM 200 N THR A 17 9.293 -12.332 -8.822 1.00 0.00 N ATOM 201 CA THR A 17 8.481 -11.472 -7.971 1.00 0.00 C ATOM 202 C THR A 17 7.344 -12.254 -7.323 1.00 0.00 C ATOM 203 O THR A 17 6.857 -13.249 -7.862 1.00 0.00 O ATOM 204 CB THR A 17 7.889 -10.292 -8.765 1.00 0.00 C ATOM 205 OG1 THR A 17 7.271 -10.770 -9.965 1.00 0.00 O ATOM 206 CG2 THR A 17 8.970 -9.279 -9.114 1.00 0.00 C ATOM 0 H THR A 17 9.524 -11.930 -9.730 1.00 0.00 H new ATOM 0 HA THR A 17 9.140 -11.084 -7.195 1.00 0.00 H new ATOM 0 HB THR A 17 7.141 -9.802 -8.142 1.00 0.00 H new ATOM 0 HG1 THR A 17 6.896 -10.014 -10.463 1.00 0.00 H new ATOM 0 HG21 THR A 17 8.529 -8.455 -9.674 1.00 0.00 H new ATOM 0 HG22 THR A 17 9.419 -8.896 -8.198 1.00 0.00 H new ATOM 0 HG23 THR A 17 9.738 -9.760 -9.720 1.00 0.00 H new ATOM 214 N PRO A 18 6.908 -11.797 -6.140 1.00 0.00 N ATOM 215 CA PRO A 18 5.822 -12.440 -5.394 1.00 0.00 C ATOM 216 C PRO A 18 4.468 -12.260 -6.072 1.00 0.00 C ATOM 217 O PRO A 18 4.313 -11.417 -6.956 1.00 0.00 O ATOM 218 CB PRO A 18 5.844 -11.719 -4.044 1.00 0.00 C ATOM 219 CG PRO A 18 6.448 -10.388 -4.335 1.00 0.00 C ATOM 220 CD PRO A 18 7.443 -10.618 -5.439 1.00 0.00 C ATOM 0 HA PRO A 18 5.961 -13.518 -5.319 1.00 0.00 H new ATOM 0 HB2 PRO A 18 4.839 -11.617 -3.633 1.00 0.00 H new ATOM 0 HB3 PRO A 18 6.433 -12.269 -3.311 1.00 0.00 H new ATOM 0 HG2 PRO A 18 5.685 -9.671 -4.640 1.00 0.00 H new ATOM 0 HG3 PRO A 18 6.935 -9.978 -3.450 1.00 0.00 H new ATOM 0 HD2 PRO A 18 7.515 -9.755 -6.101 1.00 0.00 H new ATOM 0 HD3 PRO A 18 8.443 -10.803 -5.047 1.00 0.00 H new ATOM 228 N SER A 19 3.491 -13.058 -5.653 1.00 0.00 N ATOM 229 CA SER A 19 2.150 -12.989 -6.223 1.00 0.00 C ATOM 230 C SER A 19 1.177 -12.339 -5.244 1.00 0.00 C ATOM 231 O SER A 19 0.686 -11.236 -5.481 1.00 0.00 O ATOM 232 CB SER A 19 1.659 -14.389 -6.595 1.00 0.00 C ATOM 233 OG SER A 19 0.295 -14.365 -6.980 1.00 0.00 O ATOM 0 H SER A 19 3.603 -13.760 -4.921 1.00 0.00 H new ATOM 0 HA SER A 19 2.195 -12.377 -7.124 1.00 0.00 H new ATOM 0 HB2 SER A 19 2.264 -14.785 -7.411 1.00 0.00 H new ATOM 0 HB3 SER A 19 1.789 -15.061 -5.747 1.00 0.00 H new ATOM 0 HG SER A 19 0.005 -15.271 -7.215 1.00 0.00 H new ATOM 239 N ALA A 20 0.904 -13.032 -4.143 1.00 0.00 N ATOM 240 CA ALA A 20 -0.009 -12.522 -3.127 1.00 0.00 C ATOM 241 C ALA A 20 0.583 -11.311 -2.415 1.00 0.00 C ATOM 242 O ALA A 20 0.055 -10.201 -2.483 1.00 0.00 O ATOM 243 CB ALA A 20 -0.344 -13.615 -2.123 1.00 0.00 C ATOM 0 H ALA A 20 1.302 -13.947 -3.932 1.00 0.00 H new ATOM 0 HA ALA A 20 -0.926 -12.206 -3.624 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -1.026 -13.221 -1.370 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -0.817 -14.451 -2.639 1.00 0.00 H new ATOM 0 HB3 ALA A 20 0.571 -13.958 -1.640 1.00 0.00 H new ATOM 249 N PRO A 21 1.707 -11.526 -1.715 1.00 0.00 N ATOM 250 CA PRO A 21 2.395 -10.463 -0.976 1.00 0.00 C ATOM 251 C PRO A 21 3.051 -9.445 -1.902 1.00 0.00 C ATOM 252 O PRO A 21 3.497 -9.768 -3.003 1.00 0.00 O ATOM 253 CB PRO A 21 3.457 -11.219 -0.174 1.00 0.00 C ATOM 254 CG PRO A 21 3.706 -12.464 -0.954 1.00 0.00 C ATOM 255 CD PRO A 21 2.392 -12.823 -1.590 1.00 0.00 C ATOM 0 HA PRO A 21 1.707 -9.884 -0.359 1.00 0.00 H new ATOM 0 HB2 PRO A 21 4.368 -10.629 -0.068 1.00 0.00 H new ATOM 0 HB3 PRO A 21 3.106 -11.446 0.833 1.00 0.00 H new ATOM 0 HG2 PRO A 21 4.475 -12.304 -1.710 1.00 0.00 H new ATOM 0 HG3 PRO A 21 4.058 -13.267 -0.306 1.00 0.00 H new ATOM 0 HD2 PRO A 21 2.532 -13.298 -2.561 1.00 0.00 H new ATOM 0 HD3 PRO A 21 1.824 -13.519 -0.973 1.00 0.00 H new ATOM 263 N PRO A 22 3.113 -8.184 -1.449 1.00 0.00 N ATOM 264 CA PRO A 22 2.585 -7.787 -0.140 1.00 0.00 C ATOM 265 C PRO A 22 1.061 -7.834 -0.092 1.00 0.00 C ATOM 266 O PRO A 22 0.390 -7.474 -1.058 1.00 0.00 O ATOM 267 CB PRO A 22 3.081 -6.348 0.021 1.00 0.00 C ATOM 268 CG PRO A 22 3.272 -5.855 -1.372 1.00 0.00 C ATOM 269 CD PRO A 22 3.703 -7.049 -2.178 1.00 0.00 C ATOM 0 HA PRO A 22 2.915 -8.457 0.654 1.00 0.00 H new ATOM 0 HB2 PRO A 22 2.357 -5.738 0.561 1.00 0.00 H new ATOM 0 HB3 PRO A 22 4.013 -6.311 0.585 1.00 0.00 H new ATOM 0 HG2 PRO A 22 2.348 -5.431 -1.766 1.00 0.00 H new ATOM 0 HG3 PRO A 22 4.025 -5.068 -1.408 1.00 0.00 H new ATOM 0 HD2 PRO A 22 3.336 -6.995 -3.203 1.00 0.00 H new ATOM 0 HD3 PRO A 22 4.789 -7.127 -2.232 1.00 0.00 H new ATOM 277 N GLN A 23 0.523 -8.278 1.040 1.00 0.00 N ATOM 278 CA GLN A 23 -0.922 -8.371 1.213 1.00 0.00 C ATOM 279 C GLN A 23 -1.370 -7.622 2.463 1.00 0.00 C ATOM 280 O GLN A 23 -0.553 -7.044 3.180 1.00 0.00 O ATOM 281 CB GLN A 23 -1.353 -9.836 1.299 1.00 0.00 C ATOM 282 CG GLN A 23 -0.302 -10.744 1.917 1.00 0.00 C ATOM 283 CD GLN A 23 -0.814 -12.151 2.158 1.00 0.00 C ATOM 284 OE1 GLN A 23 -2.017 -12.368 2.310 1.00 0.00 O ATOM 285 NE2 GLN A 23 0.098 -13.115 2.194 1.00 0.00 N ATOM 0 H GLN A 23 1.065 -8.579 1.850 1.00 0.00 H new ATOM 0 HA GLN A 23 -1.397 -7.910 0.347 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -2.269 -9.903 1.886 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -1.589 -10.196 0.298 1.00 0.00 H new ATOM 0 HG2 GLN A 23 0.568 -10.785 1.261 1.00 0.00 H new ATOM 0 HG3 GLN A 23 0.032 -10.316 2.862 1.00 0.00 H new ATOM 0 HE21 GLN A 23 1.084 -12.889 2.063 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -0.187 -14.081 2.353 1.00 0.00 H new ATOM 294 N LYS A 24 -2.673 -7.637 2.721 1.00 0.00 N ATOM 295 CA LYS A 24 -3.231 -6.960 3.885 1.00 0.00 C ATOM 296 C LYS A 24 -2.812 -5.494 3.916 1.00 0.00 C ATOM 297 O LYS A 24 -2.733 -4.883 4.981 1.00 0.00 O ATOM 298 CB LYS A 24 -2.780 -7.658 5.171 1.00 0.00 C ATOM 299 CG LYS A 24 -2.990 -9.162 5.153 1.00 0.00 C ATOM 300 CD LYS A 24 -2.685 -9.783 6.505 1.00 0.00 C ATOM 301 CE LYS A 24 -2.278 -11.243 6.369 1.00 0.00 C ATOM 302 NZ LYS A 24 -3.456 -12.153 6.403 1.00 0.00 N ATOM 0 H LYS A 24 -3.363 -8.111 2.139 1.00 0.00 H new ATOM 0 HA LYS A 24 -4.318 -7.007 3.815 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -1.723 -7.449 5.336 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -3.324 -7.234 6.015 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -4.020 -9.383 4.874 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -2.350 -9.611 4.393 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -1.885 -9.225 6.991 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -3.562 -9.707 7.148 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -1.738 -11.384 5.433 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -1.593 -11.506 7.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -3.137 -13.138 6.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -3.958 -12.038 7.307 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -4.098 -11.920 5.619 1.00 0.00 H new ATOM 316 N VAL A 25 -2.546 -4.935 2.739 1.00 0.00 N ATOM 317 CA VAL A 25 -2.137 -3.539 2.631 1.00 0.00 C ATOM 318 C VAL A 25 -3.201 -2.610 3.205 1.00 0.00 C ATOM 319 O VAL A 25 -4.276 -2.450 2.629 1.00 0.00 O ATOM 320 CB VAL A 25 -1.864 -3.147 1.167 1.00 0.00 C ATOM 321 CG1 VAL A 25 -1.344 -1.719 1.086 1.00 0.00 C ATOM 322 CG2 VAL A 25 -0.881 -4.118 0.530 1.00 0.00 C ATOM 0 H VAL A 25 -2.606 -5.427 1.848 1.00 0.00 H new ATOM 0 HA VAL A 25 -1.217 -3.432 3.206 1.00 0.00 H new ATOM 0 HB VAL A 25 -2.801 -3.200 0.613 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -1.156 -1.459 0.044 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -2.086 -1.037 1.502 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -0.417 -1.637 1.653 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -0.700 -3.826 -0.504 1.00 0.00 H new ATOM 0 HG22 VAL A 25 0.058 -4.099 1.082 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -1.297 -5.125 0.555 1.00 0.00 H new ATOM 332 N MET A 26 -2.891 -1.998 4.344 1.00 0.00 N ATOM 333 CA MET A 26 -3.820 -1.081 4.995 1.00 0.00 C ATOM 334 C MET A 26 -3.220 0.317 5.102 1.00 0.00 C ATOM 335 O MET A 26 -2.173 0.507 5.722 1.00 0.00 O ATOM 336 CB MET A 26 -4.189 -1.599 6.387 1.00 0.00 C ATOM 337 CG MET A 26 -5.104 -2.812 6.362 1.00 0.00 C ATOM 338 SD MET A 26 -6.624 -2.516 5.437 1.00 0.00 S ATOM 339 CE MET A 26 -7.253 -4.185 5.277 1.00 0.00 C ATOM 0 H MET A 26 -2.005 -2.120 4.834 1.00 0.00 H new ATOM 0 HA MET A 26 -4.722 -1.023 4.385 1.00 0.00 H new ATOM 0 HB2 MET A 26 -3.276 -1.854 6.924 1.00 0.00 H new ATOM 0 HB3 MET A 26 -4.675 -0.799 6.946 1.00 0.00 H new ATOM 0 HG2 MET A 26 -4.572 -3.654 5.920 1.00 0.00 H new ATOM 0 HG3 MET A 26 -5.355 -3.095 7.384 1.00 0.00 H new ATOM 0 HE1 MET A 26 -8.193 -4.168 4.726 1.00 0.00 H new ATOM 0 HE2 MET A 26 -6.528 -4.797 4.740 1.00 0.00 H new ATOM 0 HE3 MET A 26 -7.421 -4.607 6.268 1.00 0.00 H new ATOM 349 N CYS A 27 -3.888 1.290 4.493 1.00 0.00 N ATOM 350 CA CYS A 27 -3.419 2.671 4.519 1.00 0.00 C ATOM 351 C CYS A 27 -4.294 3.525 5.432 1.00 0.00 C ATOM 352 O CYS A 27 -5.519 3.406 5.424 1.00 0.00 O ATOM 353 CB CYS A 27 -3.412 3.256 3.106 1.00 0.00 C ATOM 354 SG CYS A 27 -2.326 2.384 1.953 1.00 0.00 S ATOM 0 H CYS A 27 -4.756 1.149 3.975 1.00 0.00 H new ATOM 0 HA CYS A 27 -2.402 2.676 4.911 1.00 0.00 H new ATOM 0 HB2 CYS A 27 -4.429 3.241 2.713 1.00 0.00 H new ATOM 0 HB3 CYS A 27 -3.105 4.301 3.158 1.00 0.00 H new ATOM 0 HG CYS A 27 -2.823 1.212 1.690 1.00 0.00 H new ATOM 360 N VAL A 28 -3.656 4.386 6.218 1.00 0.00 N ATOM 361 CA VAL A 28 -4.375 5.260 7.137 1.00 0.00 C ATOM 362 C VAL A 28 -3.810 6.676 7.105 1.00 0.00 C ATOM 363 O VAL A 28 -2.603 6.877 7.238 1.00 0.00 O ATOM 364 CB VAL A 28 -4.314 4.728 8.581 1.00 0.00 C ATOM 365 CG1 VAL A 28 -5.450 3.749 8.838 1.00 0.00 C ATOM 366 CG2 VAL A 28 -2.967 4.077 8.853 1.00 0.00 C ATOM 0 H VAL A 28 -2.642 4.497 6.237 1.00 0.00 H new ATOM 0 HA VAL A 28 -5.414 5.279 6.808 1.00 0.00 H new ATOM 0 HB VAL A 28 -4.429 5.569 9.264 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -5.391 3.384 9.863 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -6.405 4.252 8.687 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -5.369 2.909 8.148 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -2.942 3.707 9.878 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -2.819 3.246 8.163 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -2.173 4.811 8.713 1.00 0.00 H new ATOM 376 N SER A 29 -4.692 7.655 6.928 1.00 0.00 N ATOM 377 CA SER A 29 -4.281 9.053 6.875 1.00 0.00 C ATOM 378 C SER A 29 -3.796 9.529 8.241 1.00 0.00 C ATOM 379 O SER A 29 -4.503 9.406 9.240 1.00 0.00 O ATOM 380 CB SER A 29 -5.442 9.930 6.400 1.00 0.00 C ATOM 381 OG SER A 29 -5.606 9.841 4.995 1.00 0.00 O ATOM 0 H SER A 29 -5.695 7.506 6.819 1.00 0.00 H new ATOM 0 HA SER A 29 -3.457 9.137 6.166 1.00 0.00 H new ATOM 0 HB2 SER A 29 -6.362 9.622 6.897 1.00 0.00 H new ATOM 0 HB3 SER A 29 -5.259 10.966 6.683 1.00 0.00 H new ATOM 0 HG SER A 29 -6.355 10.409 4.716 1.00 0.00 H new ATOM 387 N MET A 30 -2.584 10.073 8.274 1.00 0.00 N ATOM 388 CA MET A 30 -2.003 10.569 9.516 1.00 0.00 C ATOM 389 C MET A 30 -2.540 11.956 9.852 1.00 0.00 C ATOM 390 O MET A 30 -3.097 12.174 10.927 1.00 0.00 O ATOM 391 CB MET A 30 -0.477 10.611 9.410 1.00 0.00 C ATOM 392 CG MET A 30 0.196 9.303 9.790 1.00 0.00 C ATOM 393 SD MET A 30 0.055 8.936 11.550 1.00 0.00 S ATOM 394 CE MET A 30 -1.081 7.551 11.518 1.00 0.00 C ATOM 0 H MET A 30 -1.985 10.181 7.455 1.00 0.00 H new ATOM 0 HA MET A 30 -2.285 9.886 10.317 1.00 0.00 H new ATOM 0 HB2 MET A 30 -0.199 10.869 8.388 1.00 0.00 H new ATOM 0 HB3 MET A 30 -0.098 11.405 10.054 1.00 0.00 H new ATOM 0 HG2 MET A 30 -0.249 8.490 9.216 1.00 0.00 H new ATOM 0 HG3 MET A 30 1.250 9.348 9.515 1.00 0.00 H new ATOM 0 HE1 MET A 30 -1.633 7.511 12.457 1.00 0.00 H new ATOM 0 HE2 MET A 30 -1.780 7.673 10.691 1.00 0.00 H new ATOM 0 HE3 MET A 30 -0.522 6.625 11.386 1.00 0.00 H new ATOM 404 N GLY A 31 -2.368 12.893 8.924 1.00 0.00 N ATOM 405 CA GLY A 31 -2.841 14.248 9.141 1.00 0.00 C ATOM 406 C GLY A 31 -3.673 14.764 7.984 1.00 0.00 C ATOM 407 O GLY A 31 -4.743 14.230 7.693 1.00 0.00 O ATOM 0 H GLY A 31 -1.910 12.738 8.026 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -3.435 14.280 10.054 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -1.987 14.908 9.293 1.00 0.00 H new ATOM 411 N SER A 32 -3.181 15.807 7.322 1.00 0.00 N ATOM 412 CA SER A 32 -3.890 16.399 6.193 1.00 0.00 C ATOM 413 C SER A 32 -3.046 16.327 4.924 1.00 0.00 C ATOM 414 O SER A 32 -3.575 16.313 3.812 1.00 0.00 O ATOM 415 CB SER A 32 -4.251 17.854 6.498 1.00 0.00 C ATOM 416 OG SER A 32 -3.122 18.573 6.964 1.00 0.00 O ATOM 0 H SER A 32 -2.295 16.259 7.548 1.00 0.00 H new ATOM 0 HA SER A 32 -4.806 15.831 6.031 1.00 0.00 H new ATOM 0 HB2 SER A 32 -4.644 18.330 5.600 1.00 0.00 H new ATOM 0 HB3 SER A 32 -5.041 17.886 7.248 1.00 0.00 H new ATOM 0 HG SER A 32 -3.379 19.500 7.150 1.00 0.00 H new ATOM 422 N THR A 33 -1.729 16.282 5.098 1.00 0.00 N ATOM 423 CA THR A 33 -0.810 16.213 3.969 1.00 0.00 C ATOM 424 C THR A 33 0.154 15.041 4.115 1.00 0.00 C ATOM 425 O THR A 33 1.129 14.929 3.371 1.00 0.00 O ATOM 426 CB THR A 33 0.000 17.515 3.824 1.00 0.00 C ATOM 427 OG1 THR A 33 0.801 17.726 4.992 1.00 0.00 O ATOM 428 CG2 THR A 33 -0.922 18.706 3.612 1.00 0.00 C ATOM 0 H THR A 33 -1.275 16.292 6.011 1.00 0.00 H new ATOM 0 HA THR A 33 -1.417 16.070 3.075 1.00 0.00 H new ATOM 0 HB THR A 33 0.648 17.419 2.953 1.00 0.00 H new ATOM 0 HG1 THR A 33 1.314 18.555 4.891 1.00 0.00 H new ATOM 0 HG21 THR A 33 -0.327 19.614 3.512 1.00 0.00 H new ATOM 0 HG22 THR A 33 -1.508 18.555 2.706 1.00 0.00 H new ATOM 0 HG23 THR A 33 -1.592 18.804 4.466 1.00 0.00 H new ATOM 436 N THR A 34 -0.125 14.169 5.079 1.00 0.00 N ATOM 437 CA THR A 34 0.718 13.005 5.323 1.00 0.00 C ATOM 438 C THR A 34 -0.122 11.748 5.515 1.00 0.00 C ATOM 439 O THR A 34 -1.181 11.786 6.142 1.00 0.00 O ATOM 440 CB THR A 34 1.610 13.207 6.563 1.00 0.00 C ATOM 441 OG1 THR A 34 2.627 14.175 6.282 1.00 0.00 O ATOM 442 CG2 THR A 34 2.253 11.895 6.986 1.00 0.00 C ATOM 0 H THR A 34 -0.928 14.247 5.703 1.00 0.00 H new ATOM 0 HA THR A 34 1.352 12.884 4.444 1.00 0.00 H new ATOM 0 HB THR A 34 0.984 13.566 7.380 1.00 0.00 H new ATOM 0 HG1 THR A 34 3.189 14.299 7.075 1.00 0.00 H new ATOM 0 HG21 THR A 34 2.878 12.062 7.863 1.00 0.00 H new ATOM 0 HG22 THR A 34 1.476 11.170 7.227 1.00 0.00 H new ATOM 0 HG23 THR A 34 2.867 11.511 6.171 1.00 0.00 H new ATOM 450 N VAL A 35 0.356 10.633 4.971 1.00 0.00 N ATOM 451 CA VAL A 35 -0.351 9.363 5.084 1.00 0.00 C ATOM 452 C VAL A 35 0.596 8.241 5.494 1.00 0.00 C ATOM 453 O VAL A 35 1.785 8.271 5.175 1.00 0.00 O ATOM 454 CB VAL A 35 -1.037 8.982 3.759 1.00 0.00 C ATOM 455 CG1 VAL A 35 -1.775 7.660 3.900 1.00 0.00 C ATOM 456 CG2 VAL A 35 -1.984 10.086 3.313 1.00 0.00 C ATOM 0 H VAL A 35 1.230 10.584 4.448 1.00 0.00 H new ATOM 0 HA VAL A 35 -1.112 9.492 5.854 1.00 0.00 H new ATOM 0 HB VAL A 35 -0.270 8.862 2.994 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -2.253 7.408 2.954 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -1.068 6.876 4.170 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -2.534 7.748 4.678 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -2.460 9.800 2.375 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -2.748 10.240 4.075 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -1.424 11.010 3.169 1.00 0.00 H new ATOM 466 N ARG A 36 0.062 7.252 6.203 1.00 0.00 N ATOM 467 CA ARG A 36 0.860 6.120 6.657 1.00 0.00 C ATOM 468 C ARG A 36 0.307 4.809 6.108 1.00 0.00 C ATOM 469 O ARG A 36 -0.838 4.444 6.377 1.00 0.00 O ATOM 470 CB ARG A 36 0.892 6.072 8.186 1.00 0.00 C ATOM 471 CG ARG A 36 1.899 5.080 8.744 1.00 0.00 C ATOM 472 CD ARG A 36 1.638 4.786 10.213 1.00 0.00 C ATOM 473 NE ARG A 36 2.343 5.717 11.090 1.00 0.00 N ATOM 474 CZ ARG A 36 2.390 5.589 12.412 1.00 0.00 C ATOM 475 NH1 ARG A 36 1.776 4.575 13.005 1.00 0.00 N ATOM 476 NH2 ARG A 36 3.052 6.477 13.142 1.00 0.00 N ATOM 0 H ARG A 36 -0.920 7.212 6.475 1.00 0.00 H new ATOM 0 HA ARG A 36 1.875 6.251 6.283 1.00 0.00 H new ATOM 0 HB2 ARG A 36 1.125 7.066 8.567 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -0.101 5.814 8.554 1.00 0.00 H new ATOM 0 HG2 ARG A 36 1.853 4.153 8.173 1.00 0.00 H new ATOM 0 HG3 ARG A 36 2.907 5.478 8.625 1.00 0.00 H new ATOM 0 HD2 ARG A 36 0.567 4.843 10.410 1.00 0.00 H new ATOM 0 HD3 ARG A 36 1.950 3.767 10.440 1.00 0.00 H new ATOM 0 HE ARG A 36 2.826 6.509 10.665 1.00 0.00 H new ATOM 0 HH11 ARG A 36 1.266 3.891 12.447 1.00 0.00 H new ATOM 0 HH12 ARG A 36 1.814 4.479 14.020 1.00 0.00 H new ATOM 0 HH21 ARG A 36 3.525 7.259 12.689 1.00 0.00 H new ATOM 0 HH22 ARG A 36 3.088 6.378 14.157 1.00 0.00 H new ATOM 490 N VAL A 37 1.127 4.103 5.335 1.00 0.00 N ATOM 491 CA VAL A 37 0.720 2.833 4.748 1.00 0.00 C ATOM 492 C VAL A 37 1.613 1.694 5.228 1.00 0.00 C ATOM 493 O VAL A 37 2.839 1.790 5.177 1.00 0.00 O ATOM 494 CB VAL A 37 0.759 2.887 3.209 1.00 0.00 C ATOM 495 CG1 VAL A 37 2.068 3.497 2.729 1.00 0.00 C ATOM 496 CG2 VAL A 37 0.562 1.498 2.622 1.00 0.00 C ATOM 0 H VAL A 37 2.077 4.390 5.101 1.00 0.00 H new ATOM 0 HA VAL A 37 -0.304 2.649 5.072 1.00 0.00 H new ATOM 0 HB VAL A 37 -0.058 3.521 2.864 1.00 0.00 H new ATOM 0 HG11 VAL A 37 2.078 3.527 1.639 1.00 0.00 H new ATOM 0 HG12 VAL A 37 2.163 4.510 3.121 1.00 0.00 H new ATOM 0 HG13 VAL A 37 2.903 2.892 3.083 1.00 0.00 H new ATOM 0 HG21 VAL A 37 0.592 1.555 1.534 1.00 0.00 H new ATOM 0 HG22 VAL A 37 1.356 0.839 2.973 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -0.404 1.103 2.938 1.00 0.00 H new ATOM 506 N SER A 38 0.989 0.617 5.694 1.00 0.00 N ATOM 507 CA SER A 38 1.728 -0.540 6.187 1.00 0.00 C ATOM 508 C SER A 38 1.137 -1.836 5.638 1.00 0.00 C ATOM 509 O SER A 38 -0.045 -1.898 5.303 1.00 0.00 O ATOM 510 CB SER A 38 1.712 -0.567 7.717 1.00 0.00 C ATOM 511 OG SER A 38 2.153 0.668 8.253 1.00 0.00 O ATOM 0 H SER A 38 -0.025 0.521 5.741 1.00 0.00 H new ATOM 0 HA SER A 38 2.759 -0.456 5.843 1.00 0.00 H new ATOM 0 HB2 SER A 38 0.703 -0.781 8.070 1.00 0.00 H new ATOM 0 HB3 SER A 38 2.352 -1.373 8.076 1.00 0.00 H new ATOM 0 HG SER A 38 2.132 0.626 9.232 1.00 0.00 H new ATOM 517 N TRP A 39 1.970 -2.866 5.550 1.00 0.00 N ATOM 518 CA TRP A 39 1.532 -4.161 5.041 1.00 0.00 C ATOM 519 C TRP A 39 2.035 -5.293 5.930 1.00 0.00 C ATOM 520 O TRP A 39 2.874 -5.083 6.805 1.00 0.00 O ATOM 521 CB TRP A 39 2.026 -4.363 3.608 1.00 0.00 C ATOM 522 CG TRP A 39 3.425 -3.873 3.387 1.00 0.00 C ATOM 523 CD1 TRP A 39 4.549 -4.636 3.253 1.00 0.00 C ATOM 524 CD2 TRP A 39 3.848 -2.509 3.277 1.00 0.00 C ATOM 525 NE1 TRP A 39 5.646 -3.829 3.067 1.00 0.00 N ATOM 526 CE2 TRP A 39 5.242 -2.520 3.076 1.00 0.00 C ATOM 527 CE3 TRP A 39 3.184 -1.281 3.326 1.00 0.00 C ATOM 528 CZ2 TRP A 39 5.981 -1.350 2.926 1.00 0.00 C ATOM 529 CZ3 TRP A 39 3.919 -0.120 3.177 1.00 0.00 C ATOM 530 CH2 TRP A 39 5.306 -0.161 2.978 1.00 0.00 C ATOM 0 H TRP A 39 2.952 -2.830 5.824 1.00 0.00 H new ATOM 0 HA TRP A 39 0.442 -4.176 5.047 1.00 0.00 H new ATOM 0 HB2 TRP A 39 1.977 -5.423 3.361 1.00 0.00 H new ATOM 0 HB3 TRP A 39 1.355 -3.844 2.923 1.00 0.00 H new ATOM 0 HD1 TRP A 39 4.573 -5.715 3.288 1.00 0.00 H new ATOM 0 HE1 TRP A 39 6.605 -4.152 2.942 1.00 0.00 H new ATOM 0 HE3 TRP A 39 2.115 -1.240 3.478 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 7.050 -1.380 2.774 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 3.416 0.835 3.215 1.00 0.00 H new ATOM 0 HH2 TRP A 39 5.852 0.764 2.864 1.00 0.00 H new ATOM 541 N VAL A 40 1.516 -6.496 5.700 1.00 0.00 N ATOM 542 CA VAL A 40 1.914 -7.662 6.479 1.00 0.00 C ATOM 543 C VAL A 40 3.241 -8.227 5.984 1.00 0.00 C ATOM 544 O VAL A 40 3.400 -8.570 4.813 1.00 0.00 O ATOM 545 CB VAL A 40 0.844 -8.768 6.420 1.00 0.00 C ATOM 546 CG1 VAL A 40 0.691 -9.289 4.999 1.00 0.00 C ATOM 547 CG2 VAL A 40 1.193 -9.898 7.377 1.00 0.00 C ATOM 0 H VAL A 40 0.819 -6.688 4.980 1.00 0.00 H new ATOM 0 HA VAL A 40 2.026 -7.330 7.511 1.00 0.00 H new ATOM 0 HB VAL A 40 -0.111 -8.343 6.729 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -0.069 -10.070 4.978 1.00 0.00 H new ATOM 0 HG12 VAL A 40 0.391 -8.472 4.342 1.00 0.00 H new ATOM 0 HG13 VAL A 40 1.642 -9.699 4.657 1.00 0.00 H new ATOM 0 HG21 VAL A 40 0.426 -10.671 7.322 1.00 0.00 H new ATOM 0 HG22 VAL A 40 2.158 -10.324 7.101 1.00 0.00 H new ATOM 0 HG23 VAL A 40 1.245 -9.510 8.394 1.00 0.00 H new ATOM 557 N PRO A 41 4.218 -8.327 6.897 1.00 0.00 N ATOM 558 CA PRO A 41 5.550 -8.851 6.577 1.00 0.00 C ATOM 559 C PRO A 41 5.529 -10.349 6.292 1.00 0.00 C ATOM 560 O PRO A 41 5.248 -11.168 7.166 1.00 0.00 O ATOM 561 CB PRO A 41 6.359 -8.559 7.843 1.00 0.00 C ATOM 562 CG PRO A 41 5.347 -8.499 8.935 1.00 0.00 C ATOM 563 CD PRO A 41 4.099 -7.936 8.312 1.00 0.00 C ATOM 0 HA PRO A 41 5.963 -8.396 5.677 1.00 0.00 H new ATOM 0 HB2 PRO A 41 7.097 -9.339 8.030 1.00 0.00 H new ATOM 0 HB3 PRO A 41 6.904 -7.619 7.756 1.00 0.00 H new ATOM 0 HG2 PRO A 41 5.163 -9.489 9.351 1.00 0.00 H new ATOM 0 HG3 PRO A 41 5.693 -7.868 9.754 1.00 0.00 H new ATOM 0 HD2 PRO A 41 3.200 -8.350 8.769 1.00 0.00 H new ATOM 0 HD3 PRO A 41 4.046 -6.853 8.427 1.00 0.00 H new ATOM 571 N PRO A 42 5.835 -10.717 5.039 1.00 0.00 N ATOM 572 CA PRO A 42 5.859 -12.118 4.609 1.00 0.00 C ATOM 573 C PRO A 42 7.020 -12.892 5.224 1.00 0.00 C ATOM 574 O PRO A 42 8.121 -12.370 5.404 1.00 0.00 O ATOM 575 CB PRO A 42 6.026 -12.021 3.091 1.00 0.00 C ATOM 576 CG PRO A 42 6.692 -10.708 2.866 1.00 0.00 C ATOM 577 CD PRO A 42 6.180 -9.794 3.945 1.00 0.00 C ATOM 0 HA PRO A 42 4.963 -12.655 4.919 1.00 0.00 H new ATOM 0 HB2 PRO A 42 6.630 -12.842 2.706 1.00 0.00 H new ATOM 0 HB3 PRO A 42 5.063 -12.068 2.583 1.00 0.00 H new ATOM 0 HG2 PRO A 42 7.776 -10.806 2.920 1.00 0.00 H new ATOM 0 HG3 PRO A 42 6.456 -10.315 1.877 1.00 0.00 H new ATOM 0 HD2 PRO A 42 6.936 -9.072 4.252 1.00 0.00 H new ATOM 0 HD3 PRO A 42 5.313 -9.225 3.611 1.00 0.00 H new ATOM 585 N PRO A 43 6.773 -14.169 5.554 1.00 0.00 N ATOM 586 CA PRO A 43 7.786 -15.042 6.153 1.00 0.00 C ATOM 587 C PRO A 43 8.890 -15.409 5.168 1.00 0.00 C ATOM 588 O PRO A 43 8.699 -16.254 4.293 1.00 0.00 O ATOM 589 CB PRO A 43 6.990 -16.287 6.552 1.00 0.00 C ATOM 590 CG PRO A 43 5.819 -16.299 5.632 1.00 0.00 C ATOM 591 CD PRO A 43 5.484 -14.857 5.368 1.00 0.00 C ATOM 0 HA PRO A 43 8.297 -14.561 6.987 1.00 0.00 H new ATOM 0 HB2 PRO A 43 7.589 -17.191 6.443 1.00 0.00 H new ATOM 0 HB3 PRO A 43 6.674 -16.238 7.594 1.00 0.00 H new ATOM 0 HG2 PRO A 43 6.057 -16.820 4.705 1.00 0.00 H new ATOM 0 HG3 PRO A 43 4.974 -16.820 6.083 1.00 0.00 H new ATOM 0 HD2 PRO A 43 5.093 -14.713 4.361 1.00 0.00 H new ATOM 0 HD3 PRO A 43 4.727 -14.487 6.060 1.00 0.00 H new ATOM 599 N ALA A 44 10.046 -14.770 5.316 1.00 0.00 N ATOM 600 CA ALA A 44 11.181 -15.031 4.441 1.00 0.00 C ATOM 601 C ALA A 44 11.282 -16.514 4.101 1.00 0.00 C ATOM 602 O ALA A 44 11.643 -16.881 2.982 1.00 0.00 O ATOM 603 CB ALA A 44 12.470 -14.547 5.089 1.00 0.00 C ATOM 0 H ALA A 44 10.221 -14.067 6.035 1.00 0.00 H new ATOM 0 HA ALA A 44 11.026 -14.482 3.512 1.00 0.00 H new ATOM 0 HB1 ALA A 44 13.310 -14.749 4.424 1.00 0.00 H new ATOM 0 HB2 ALA A 44 12.404 -13.475 5.275 1.00 0.00 H new ATOM 0 HB3 ALA A 44 12.621 -15.070 6.033 1.00 0.00 H new ATOM 609 N ASP A 45 10.962 -17.362 5.072 1.00 0.00 N ATOM 610 CA ASP A 45 11.017 -18.806 4.875 1.00 0.00 C ATOM 611 C ASP A 45 9.986 -19.253 3.843 1.00 0.00 C ATOM 612 O ASP A 45 8.875 -18.724 3.791 1.00 0.00 O ATOM 613 CB ASP A 45 10.778 -19.532 6.200 1.00 0.00 C ATOM 614 CG ASP A 45 11.826 -19.193 7.242 1.00 0.00 C ATOM 615 OD1 ASP A 45 11.691 -18.139 7.897 1.00 0.00 O ATOM 616 OD2 ASP A 45 12.781 -19.982 7.403 1.00 0.00 O ATOM 0 H ASP A 45 10.662 -17.075 6.003 1.00 0.00 H new ATOM 0 HA ASP A 45 12.010 -19.060 4.504 1.00 0.00 H new ATOM 0 HB2 ASP A 45 9.791 -19.270 6.582 1.00 0.00 H new ATOM 0 HB3 ASP A 45 10.777 -20.608 6.027 1.00 0.00 H new ATOM 621 N SER A 46 10.362 -20.229 3.023 1.00 0.00 N ATOM 622 CA SER A 46 9.472 -20.744 1.989 1.00 0.00 C ATOM 623 C SER A 46 8.927 -19.610 1.127 1.00 0.00 C ATOM 624 O SER A 46 7.715 -19.467 0.963 1.00 0.00 O ATOM 625 CB SER A 46 8.314 -21.520 2.622 1.00 0.00 C ATOM 626 OG SER A 46 7.320 -20.639 3.116 1.00 0.00 O ATOM 0 H SER A 46 11.277 -20.679 3.055 1.00 0.00 H new ATOM 0 HA SER A 46 10.047 -21.417 1.353 1.00 0.00 H new ATOM 0 HB2 SER A 46 7.875 -22.191 1.884 1.00 0.00 H new ATOM 0 HB3 SER A 46 8.690 -22.142 3.435 1.00 0.00 H new ATOM 0 HG SER A 46 7.683 -19.730 3.165 1.00 0.00 H new ATOM 632 N ARG A 47 9.832 -18.806 0.578 1.00 0.00 N ATOM 633 CA ARG A 47 9.443 -17.683 -0.267 1.00 0.00 C ATOM 634 C ARG A 47 9.967 -17.865 -1.688 1.00 0.00 C ATOM 635 O ARG A 47 10.968 -18.546 -1.909 1.00 0.00 O ATOM 636 CB ARG A 47 9.970 -16.371 0.318 1.00 0.00 C ATOM 637 CG ARG A 47 8.992 -15.687 1.258 1.00 0.00 C ATOM 638 CD ARG A 47 7.791 -15.133 0.507 1.00 0.00 C ATOM 639 NE ARG A 47 6.584 -15.133 1.328 1.00 0.00 N ATOM 640 CZ ARG A 47 5.354 -15.183 0.828 1.00 0.00 C ATOM 641 NH1 ARG A 47 5.171 -15.237 -0.484 1.00 0.00 N ATOM 642 NH2 ARG A 47 4.305 -15.179 1.640 1.00 0.00 N ATOM 0 H ARG A 47 10.839 -18.911 0.703 1.00 0.00 H new ATOM 0 HA ARG A 47 8.354 -17.647 -0.301 1.00 0.00 H new ATOM 0 HB2 ARG A 47 10.898 -16.569 0.854 1.00 0.00 H new ATOM 0 HB3 ARG A 47 10.213 -15.691 -0.498 1.00 0.00 H new ATOM 0 HG2 ARG A 47 8.654 -16.397 2.013 1.00 0.00 H new ATOM 0 HG3 ARG A 47 9.498 -14.878 1.785 1.00 0.00 H new ATOM 0 HD2 ARG A 47 8.006 -14.116 0.179 1.00 0.00 H new ATOM 0 HD3 ARG A 47 7.619 -15.727 -0.390 1.00 0.00 H new ATOM 0 HE ARG A 47 6.691 -15.092 2.342 1.00 0.00 H new ATOM 0 HH11 ARG A 47 5.975 -15.240 -1.111 1.00 0.00 H new ATOM 0 HH12 ARG A 47 4.226 -15.275 -0.866 1.00 0.00 H new ATOM 0 HH21 ARG A 47 4.442 -15.137 2.650 1.00 0.00 H new ATOM 0 HH22 ARG A 47 3.361 -15.217 1.254 1.00 0.00 H new ATOM 656 N ASN A 48 9.283 -17.252 -2.649 1.00 0.00 N ATOM 657 CA ASN A 48 9.679 -17.347 -4.049 1.00 0.00 C ATOM 658 C ASN A 48 10.525 -16.145 -4.459 1.00 0.00 C ATOM 659 O ASN A 48 11.073 -16.105 -5.559 1.00 0.00 O ATOM 660 CB ASN A 48 8.442 -17.443 -4.945 1.00 0.00 C ATOM 661 CG ASN A 48 7.691 -16.129 -5.036 1.00 0.00 C ATOM 662 OD1 ASN A 48 8.194 -15.151 -5.588 1.00 0.00 O ATOM 663 ND2 ASN A 48 6.479 -16.101 -4.493 1.00 0.00 N ATOM 0 H ASN A 48 8.452 -16.684 -2.483 1.00 0.00 H new ATOM 0 HA ASN A 48 10.279 -18.249 -4.170 1.00 0.00 H new ATOM 0 HB2 ASN A 48 8.744 -17.756 -5.945 1.00 0.00 H new ATOM 0 HB3 ASN A 48 7.775 -18.213 -4.558 1.00 0.00 H new ATOM 0 HD21 ASN A 48 5.926 -15.244 -4.524 1.00 0.00 H new ATOM 0 HD22 ASN A 48 6.101 -16.936 -4.045 1.00 0.00 H new ATOM 670 N GLY A 49 10.626 -15.167 -3.564 1.00 0.00 N ATOM 671 CA GLY A 49 11.407 -13.978 -3.850 1.00 0.00 C ATOM 672 C GLY A 49 11.944 -13.321 -2.594 1.00 0.00 C ATOM 673 O GLY A 49 11.260 -13.266 -1.572 1.00 0.00 O ATOM 0 H GLY A 49 10.181 -15.177 -2.646 1.00 0.00 H new ATOM 0 HA2 GLY A 49 12.239 -14.242 -4.502 1.00 0.00 H new ATOM 0 HA3 GLY A 49 10.789 -13.264 -4.394 1.00 0.00 H new ATOM 677 N VAL A 50 13.174 -12.822 -2.669 1.00 0.00 N ATOM 678 CA VAL A 50 13.803 -12.166 -1.529 1.00 0.00 C ATOM 679 C VAL A 50 13.489 -10.675 -1.511 1.00 0.00 C ATOM 680 O VAL A 50 14.157 -9.881 -2.174 1.00 0.00 O ATOM 681 CB VAL A 50 15.332 -12.357 -1.544 1.00 0.00 C ATOM 682 CG1 VAL A 50 15.898 -12.021 -2.915 1.00 0.00 C ATOM 683 CG2 VAL A 50 15.985 -11.508 -0.465 1.00 0.00 C ATOM 0 H VAL A 50 13.754 -12.860 -3.507 1.00 0.00 H new ATOM 0 HA VAL A 50 13.395 -12.631 -0.632 1.00 0.00 H new ATOM 0 HB VAL A 50 15.553 -13.403 -1.333 1.00 0.00 H new ATOM 0 HG11 VAL A 50 16.979 -12.162 -2.907 1.00 0.00 H new ATOM 0 HG12 VAL A 50 15.452 -12.677 -3.663 1.00 0.00 H new ATOM 0 HG13 VAL A 50 15.669 -10.984 -3.159 1.00 0.00 H new ATOM 0 HG21 VAL A 50 17.065 -11.655 -0.490 1.00 0.00 H new ATOM 0 HG22 VAL A 50 15.758 -10.457 -0.642 1.00 0.00 H new ATOM 0 HG23 VAL A 50 15.601 -11.803 0.512 1.00 0.00 H new ATOM 693 N ILE A 51 12.468 -10.300 -0.747 1.00 0.00 N ATOM 694 CA ILE A 51 12.066 -8.903 -0.641 1.00 0.00 C ATOM 695 C ILE A 51 13.281 -7.987 -0.550 1.00 0.00 C ATOM 696 O ILE A 51 13.785 -7.711 0.540 1.00 0.00 O ATOM 697 CB ILE A 51 11.166 -8.668 0.586 1.00 0.00 C ATOM 698 CG1 ILE A 51 10.030 -9.692 0.616 1.00 0.00 C ATOM 699 CG2 ILE A 51 10.610 -7.252 0.571 1.00 0.00 C ATOM 700 CD1 ILE A 51 9.286 -9.808 -0.695 1.00 0.00 C ATOM 0 H ILE A 51 11.904 -10.944 -0.192 1.00 0.00 H new ATOM 0 HA ILE A 51 11.503 -8.667 -1.544 1.00 0.00 H new ATOM 0 HB ILE A 51 11.766 -8.793 1.488 1.00 0.00 H new ATOM 0 HG12 ILE A 51 10.438 -10.668 0.880 1.00 0.00 H new ATOM 0 HG13 ILE A 51 9.325 -9.418 1.401 1.00 0.00 H new ATOM 0 HG21 ILE A 51 9.976 -7.101 1.444 1.00 0.00 H new ATOM 0 HG22 ILE A 51 11.433 -6.538 0.592 1.00 0.00 H new ATOM 0 HG23 ILE A 51 10.022 -7.101 -0.335 1.00 0.00 H new ATOM 0 HD11 ILE A 51 8.495 -10.552 -0.600 1.00 0.00 H new ATOM 0 HD12 ILE A 51 8.848 -8.843 -0.951 1.00 0.00 H new ATOM 0 HD13 ILE A 51 9.978 -10.112 -1.480 1.00 0.00 H new ATOM 712 N THR A 52 13.748 -7.515 -1.702 1.00 0.00 N ATOM 713 CA THR A 52 14.904 -6.629 -1.753 1.00 0.00 C ATOM 714 C THR A 52 14.565 -5.251 -1.196 1.00 0.00 C ATOM 715 O THR A 52 15.368 -4.643 -0.490 1.00 0.00 O ATOM 716 CB THR A 52 15.430 -6.474 -3.192 1.00 0.00 C ATOM 717 OG1 THR A 52 15.330 -7.722 -3.887 1.00 0.00 O ATOM 718 CG2 THR A 52 16.877 -6.002 -3.191 1.00 0.00 C ATOM 0 H THR A 52 13.343 -7.732 -2.613 1.00 0.00 H new ATOM 0 HA THR A 52 15.680 -7.086 -1.138 1.00 0.00 H new ATOM 0 HB THR A 52 14.821 -5.726 -3.700 1.00 0.00 H new ATOM 0 HG1 THR A 52 16.222 -8.007 -4.177 1.00 0.00 H new ATOM 0 HG21 THR A 52 17.227 -5.900 -4.218 1.00 0.00 H new ATOM 0 HG22 THR A 52 16.945 -5.038 -2.687 1.00 0.00 H new ATOM 0 HG23 THR A 52 17.497 -6.730 -2.667 1.00 0.00 H new ATOM 726 N GLN A 53 13.371 -4.764 -1.520 1.00 0.00 N ATOM 727 CA GLN A 53 12.927 -3.457 -1.051 1.00 0.00 C ATOM 728 C GLN A 53 11.435 -3.266 -1.304 1.00 0.00 C ATOM 729 O GLN A 53 10.792 -4.100 -1.943 1.00 0.00 O ATOM 730 CB GLN A 53 13.719 -2.347 -1.744 1.00 0.00 C ATOM 731 CG GLN A 53 13.783 -2.498 -3.256 1.00 0.00 C ATOM 732 CD GLN A 53 14.876 -1.653 -3.881 1.00 0.00 C ATOM 733 OE1 GLN A 53 16.037 -2.059 -3.933 1.00 0.00 O ATOM 734 NE2 GLN A 53 14.509 -0.470 -4.359 1.00 0.00 N ATOM 0 H GLN A 53 12.695 -5.255 -2.105 1.00 0.00 H new ATOM 0 HA GLN A 53 13.105 -3.405 0.023 1.00 0.00 H new ATOM 0 HB2 GLN A 53 13.268 -1.385 -1.502 1.00 0.00 H new ATOM 0 HB3 GLN A 53 14.733 -2.333 -1.345 1.00 0.00 H new ATOM 0 HG2 GLN A 53 13.951 -3.546 -3.506 1.00 0.00 H new ATOM 0 HG3 GLN A 53 12.822 -2.218 -3.686 1.00 0.00 H new ATOM 0 HE21 GLN A 53 13.535 -0.174 -4.295 1.00 0.00 H new ATOM 0 HE22 GLN A 53 15.201 0.143 -4.791 1.00 0.00 H new ATOM 743 N TYR A 54 10.891 -2.165 -0.799 1.00 0.00 N ATOM 744 CA TYR A 54 9.473 -1.866 -0.968 1.00 0.00 C ATOM 745 C TYR A 54 9.279 -0.531 -1.681 1.00 0.00 C ATOM 746 O TYR A 54 9.752 0.507 -1.218 1.00 0.00 O ATOM 747 CB TYR A 54 8.771 -1.838 0.391 1.00 0.00 C ATOM 748 CG TYR A 54 8.457 -3.212 0.938 1.00 0.00 C ATOM 749 CD1 TYR A 54 7.340 -3.915 0.505 1.00 0.00 C ATOM 750 CD2 TYR A 54 9.277 -3.807 1.890 1.00 0.00 C ATOM 751 CE1 TYR A 54 7.048 -5.171 1.003 1.00 0.00 C ATOM 752 CE2 TYR A 54 8.994 -5.062 2.392 1.00 0.00 C ATOM 753 CZ TYR A 54 7.879 -5.740 1.946 1.00 0.00 C ATOM 754 OH TYR A 54 7.593 -6.990 2.445 1.00 0.00 O ATOM 0 H TYR A 54 11.410 -1.464 -0.269 1.00 0.00 H new ATOM 0 HA TYR A 54 9.032 -2.652 -1.581 1.00 0.00 H new ATOM 0 HB2 TYR A 54 9.401 -1.307 1.105 1.00 0.00 H new ATOM 0 HB3 TYR A 54 7.844 -1.272 0.300 1.00 0.00 H new ATOM 0 HD1 TYR A 54 6.688 -3.473 -0.234 1.00 0.00 H new ATOM 0 HD2 TYR A 54 10.150 -3.279 2.243 1.00 0.00 H new ATOM 0 HE1 TYR A 54 6.175 -5.704 0.656 1.00 0.00 H new ATOM 0 HE2 TYR A 54 9.643 -5.510 3.130 1.00 0.00 H new ATOM 0 HH TYR A 54 8.277 -7.246 3.099 1.00 0.00 H new ATOM 764 N SER A 55 8.579 -0.568 -2.810 1.00 0.00 N ATOM 765 CA SER A 55 8.324 0.638 -3.590 1.00 0.00 C ATOM 766 C SER A 55 6.922 1.174 -3.318 1.00 0.00 C ATOM 767 O SER A 55 5.927 0.476 -3.519 1.00 0.00 O ATOM 768 CB SER A 55 8.491 0.349 -5.084 1.00 0.00 C ATOM 769 OG SER A 55 7.311 -0.215 -5.629 1.00 0.00 O ATOM 0 H SER A 55 8.179 -1.419 -3.205 1.00 0.00 H new ATOM 0 HA SER A 55 9.048 1.395 -3.290 1.00 0.00 H new ATOM 0 HB2 SER A 55 8.734 1.272 -5.611 1.00 0.00 H new ATOM 0 HB3 SER A 55 9.327 -0.334 -5.234 1.00 0.00 H new ATOM 0 HG SER A 55 6.667 -0.384 -4.910 1.00 0.00 H new ATOM 775 N VAL A 56 6.850 2.420 -2.859 1.00 0.00 N ATOM 776 CA VAL A 56 5.571 3.052 -2.560 1.00 0.00 C ATOM 777 C VAL A 56 5.282 4.194 -3.528 1.00 0.00 C ATOM 778 O VAL A 56 6.195 4.888 -3.974 1.00 0.00 O ATOM 779 CB VAL A 56 5.536 3.594 -1.119 1.00 0.00 C ATOM 780 CG1 VAL A 56 4.125 4.016 -0.741 1.00 0.00 C ATOM 781 CG2 VAL A 56 6.069 2.552 -0.146 1.00 0.00 C ATOM 0 H VAL A 56 7.663 3.011 -2.686 1.00 0.00 H new ATOM 0 HA VAL A 56 4.805 2.284 -2.670 1.00 0.00 H new ATOM 0 HB VAL A 56 6.179 4.473 -1.064 1.00 0.00 H new ATOM 0 HG11 VAL A 56 4.120 4.396 0.281 1.00 0.00 H new ATOM 0 HG12 VAL A 56 3.785 4.797 -1.421 1.00 0.00 H new ATOM 0 HG13 VAL A 56 3.457 3.157 -0.812 1.00 0.00 H new ATOM 0 HG21 VAL A 56 6.037 2.951 0.868 1.00 0.00 H new ATOM 0 HG22 VAL A 56 5.454 1.654 -0.202 1.00 0.00 H new ATOM 0 HG23 VAL A 56 7.098 2.304 -0.406 1.00 0.00 H new ATOM 791 N ALA A 57 4.006 4.383 -3.848 1.00 0.00 N ATOM 792 CA ALA A 57 3.597 5.442 -4.761 1.00 0.00 C ATOM 793 C ALA A 57 2.198 5.947 -4.424 1.00 0.00 C ATOM 794 O ALA A 57 1.395 5.228 -3.829 1.00 0.00 O ATOM 795 CB ALA A 57 3.650 4.950 -6.200 1.00 0.00 C ATOM 0 H ALA A 57 3.238 3.816 -3.488 1.00 0.00 H new ATOM 0 HA ALA A 57 4.293 6.273 -4.648 1.00 0.00 H new ATOM 0 HB1 ALA A 57 3.342 5.752 -6.870 1.00 0.00 H new ATOM 0 HB2 ALA A 57 4.668 4.645 -6.443 1.00 0.00 H new ATOM 0 HB3 ALA A 57 2.978 4.100 -6.319 1.00 0.00 H new ATOM 801 N TYR A 58 1.913 7.187 -4.807 1.00 0.00 N ATOM 802 CA TYR A 58 0.612 7.789 -4.543 1.00 0.00 C ATOM 803 C TYR A 58 0.217 8.748 -5.662 1.00 0.00 C ATOM 804 O TYR A 58 1.074 9.302 -6.349 1.00 0.00 O ATOM 805 CB TYR A 58 0.631 8.529 -3.205 1.00 0.00 C ATOM 806 CG TYR A 58 1.825 9.442 -3.035 1.00 0.00 C ATOM 807 CD1 TYR A 58 3.083 8.926 -2.750 1.00 0.00 C ATOM 808 CD2 TYR A 58 1.695 10.819 -3.159 1.00 0.00 C ATOM 809 CE1 TYR A 58 4.177 9.755 -2.593 1.00 0.00 C ATOM 810 CE2 TYR A 58 2.783 11.656 -3.006 1.00 0.00 C ATOM 811 CZ TYR A 58 4.022 11.120 -2.723 1.00 0.00 C ATOM 812 OH TYR A 58 5.108 11.950 -2.568 1.00 0.00 O ATOM 0 H TYR A 58 2.566 7.795 -5.302 1.00 0.00 H new ATOM 0 HA TYR A 58 -0.127 6.989 -4.498 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -0.282 9.117 -3.112 1.00 0.00 H new ATOM 0 HB3 TYR A 58 0.624 7.799 -2.395 1.00 0.00 H new ATOM 0 HD1 TYR A 58 3.208 7.858 -2.649 1.00 0.00 H new ATOM 0 HD2 TYR A 58 0.726 11.243 -3.379 1.00 0.00 H new ATOM 0 HE1 TYR A 58 5.148 9.337 -2.370 1.00 0.00 H new ATOM 0 HE2 TYR A 58 2.664 12.725 -3.107 1.00 0.00 H new ATOM 0 HH TYR A 58 4.829 12.881 -2.692 1.00 0.00 H new ATOM 822 N GLU A 59 -1.087 8.938 -5.838 1.00 0.00 N ATOM 823 CA GLU A 59 -1.595 9.829 -6.873 1.00 0.00 C ATOM 824 C GLU A 59 -3.037 10.235 -6.582 1.00 0.00 C ATOM 825 O GLU A 59 -3.867 9.400 -6.223 1.00 0.00 O ATOM 826 CB GLU A 59 -1.510 9.156 -8.244 1.00 0.00 C ATOM 827 CG GLU A 59 -1.772 10.102 -9.404 1.00 0.00 C ATOM 828 CD GLU A 59 -1.991 9.371 -10.715 1.00 0.00 C ATOM 829 OE1 GLU A 59 -2.755 8.383 -10.721 1.00 0.00 O ATOM 830 OE2 GLU A 59 -1.400 9.787 -11.733 1.00 0.00 O ATOM 0 H GLU A 59 -1.810 8.487 -5.277 1.00 0.00 H new ATOM 0 HA GLU A 59 -0.977 10.727 -6.878 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -0.520 8.715 -8.362 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -2.230 8.338 -8.283 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -2.648 10.711 -9.181 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -0.928 10.784 -9.509 1.00 0.00 H new ATOM 837 N ALA A 60 -3.327 11.522 -6.738 1.00 0.00 N ATOM 838 CA ALA A 60 -4.668 12.039 -6.494 1.00 0.00 C ATOM 839 C ALA A 60 -5.638 11.585 -7.580 1.00 0.00 C ATOM 840 O ALA A 60 -5.362 11.727 -8.771 1.00 0.00 O ATOM 841 CB ALA A 60 -4.641 13.558 -6.409 1.00 0.00 C ATOM 0 H ALA A 60 -2.651 12.227 -7.033 1.00 0.00 H new ATOM 0 HA ALA A 60 -5.017 11.639 -5.542 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -5.649 13.930 -6.227 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -3.987 13.865 -5.593 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -4.267 13.968 -7.347 1.00 0.00 H new ATOM 847 N VAL A 61 -6.774 11.036 -7.161 1.00 0.00 N ATOM 848 CA VAL A 61 -7.785 10.562 -8.098 1.00 0.00 C ATOM 849 C VAL A 61 -8.843 11.629 -8.352 1.00 0.00 C ATOM 850 O VAL A 61 -9.291 11.817 -9.483 1.00 0.00 O ATOM 851 CB VAL A 61 -8.473 9.284 -7.581 1.00 0.00 C ATOM 852 CG1 VAL A 61 -9.092 9.527 -6.212 1.00 0.00 C ATOM 853 CG2 VAL A 61 -9.523 8.807 -8.572 1.00 0.00 C ATOM 0 H VAL A 61 -7.017 10.909 -6.179 1.00 0.00 H new ATOM 0 HA VAL A 61 -7.270 10.337 -9.032 1.00 0.00 H new ATOM 0 HB VAL A 61 -7.720 8.502 -7.479 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -9.573 8.613 -5.863 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -8.313 9.819 -5.507 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -9.833 10.323 -6.284 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -9.999 7.903 -8.191 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -10.275 9.584 -8.707 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -9.048 8.591 -9.529 1.00 0.00 H new ATOM 863 N ASP A 62 -9.239 12.326 -7.292 1.00 0.00 N ATOM 864 CA ASP A 62 -10.244 13.377 -7.400 1.00 0.00 C ATOM 865 C ASP A 62 -9.669 14.724 -6.976 1.00 0.00 C ATOM 866 O ASP A 62 -10.365 15.549 -6.385 1.00 0.00 O ATOM 867 CB ASP A 62 -11.463 13.035 -6.542 1.00 0.00 C ATOM 868 CG ASP A 62 -12.738 13.663 -7.072 1.00 0.00 C ATOM 869 OD1 ASP A 62 -13.187 13.260 -8.165 1.00 0.00 O ATOM 870 OD2 ASP A 62 -13.285 14.558 -6.394 1.00 0.00 O ATOM 0 H ASP A 62 -8.879 12.182 -6.348 1.00 0.00 H new ATOM 0 HA ASP A 62 -10.552 13.447 -8.443 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -11.584 11.952 -6.502 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -11.292 13.374 -5.520 1.00 0.00 H new ATOM 875 N GLY A 63 -8.393 14.940 -7.280 1.00 0.00 N ATOM 876 CA GLY A 63 -7.746 16.189 -6.921 1.00 0.00 C ATOM 877 C GLY A 63 -7.369 17.016 -8.134 1.00 0.00 C ATOM 878 O GLY A 63 -7.418 16.530 -9.264 1.00 0.00 O ATOM 0 H GLY A 63 -7.796 14.273 -7.768 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -8.412 16.769 -6.282 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -6.850 15.976 -6.338 1.00 0.00 H new ATOM 882 N GLU A 64 -6.994 18.270 -7.900 1.00 0.00 N ATOM 883 CA GLU A 64 -6.611 19.167 -8.984 1.00 0.00 C ATOM 884 C GLU A 64 -5.406 18.618 -9.744 1.00 0.00 C ATOM 885 O GLU A 64 -5.422 18.527 -10.972 1.00 0.00 O ATOM 886 CB GLU A 64 -6.290 20.558 -8.436 1.00 0.00 C ATOM 887 CG GLU A 64 -7.519 21.426 -8.221 1.00 0.00 C ATOM 888 CD GLU A 64 -8.539 21.278 -9.333 1.00 0.00 C ATOM 889 OE1 GLU A 64 -8.168 21.480 -10.508 1.00 0.00 O ATOM 890 OE2 GLU A 64 -9.708 20.962 -9.029 1.00 0.00 O ATOM 0 H GLU A 64 -6.947 18.687 -6.970 1.00 0.00 H new ATOM 0 HA GLU A 64 -7.452 19.241 -9.674 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -5.760 20.453 -7.490 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -5.614 21.064 -9.126 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -7.983 21.163 -7.270 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -7.214 22.470 -8.149 1.00 0.00 H new ATOM 897 N ASP A 65 -4.364 18.254 -9.005 1.00 0.00 N ATOM 898 CA ASP A 65 -3.151 17.714 -9.607 1.00 0.00 C ATOM 899 C ASP A 65 -3.145 16.190 -9.545 1.00 0.00 C ATOM 900 O ASP A 65 -3.217 15.603 -8.466 1.00 0.00 O ATOM 901 CB ASP A 65 -1.913 18.270 -8.901 1.00 0.00 C ATOM 902 CG ASP A 65 -0.625 17.880 -9.597 1.00 0.00 C ATOM 903 OD1 ASP A 65 -0.386 18.368 -10.722 1.00 0.00 O ATOM 904 OD2 ASP A 65 0.146 17.087 -9.017 1.00 0.00 O ATOM 0 H ASP A 65 -4.335 18.323 -7.988 1.00 0.00 H new ATOM 0 HA ASP A 65 -3.129 18.017 -10.654 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -1.983 19.357 -8.854 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -1.891 17.908 -7.873 1.00 0.00 H new ATOM 909 N ARG A 66 -3.061 15.555 -10.710 1.00 0.00 N ATOM 910 CA ARG A 66 -3.049 14.100 -10.788 1.00 0.00 C ATOM 911 C ARG A 66 -1.623 13.574 -10.919 1.00 0.00 C ATOM 912 O ARG A 66 -1.400 12.472 -11.417 1.00 0.00 O ATOM 913 CB ARG A 66 -3.890 13.624 -11.975 1.00 0.00 C ATOM 914 CG ARG A 66 -5.369 13.479 -11.654 1.00 0.00 C ATOM 915 CD ARG A 66 -6.108 14.796 -11.828 1.00 0.00 C ATOM 916 NE ARG A 66 -7.515 14.689 -11.450 1.00 0.00 N ATOM 917 CZ ARG A 66 -8.389 15.680 -11.580 1.00 0.00 C ATOM 918 NH1 ARG A 66 -8.003 16.848 -12.076 1.00 0.00 N ATOM 919 NH2 ARG A 66 -9.652 15.505 -11.213 1.00 0.00 N ATOM 0 H ARG A 66 -3.000 16.026 -11.613 1.00 0.00 H new ATOM 0 HA ARG A 66 -3.479 13.709 -9.866 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -3.773 14.329 -12.798 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -3.506 12.664 -12.320 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -5.811 12.724 -12.304 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -5.487 13.127 -10.629 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -5.627 15.564 -11.222 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -6.035 15.118 -12.867 1.00 0.00 H new ATOM 0 HE ARG A 66 -7.844 13.804 -11.065 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -7.033 16.986 -12.359 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -8.676 17.608 -12.175 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -9.952 14.608 -10.831 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -10.323 16.267 -11.313 1.00 0.00 H new ATOM 933 N GLY A 67 -0.660 14.372 -10.467 1.00 0.00 N ATOM 934 CA GLY A 67 0.733 13.970 -10.543 1.00 0.00 C ATOM 935 C GLY A 67 1.070 12.860 -9.568 1.00 0.00 C ATOM 936 O GLY A 67 1.104 13.077 -8.357 1.00 0.00 O ATOM 0 H GLY A 67 -0.819 15.289 -10.050 1.00 0.00 H new ATOM 0 HA2 GLY A 67 0.958 13.639 -11.557 1.00 0.00 H new ATOM 0 HA3 GLY A 67 1.368 14.832 -10.341 1.00 0.00 H new ATOM 940 N ARG A 68 1.317 11.666 -10.097 1.00 0.00 N ATOM 941 CA ARG A 68 1.650 10.516 -9.264 1.00 0.00 C ATOM 942 C ARG A 68 3.097 10.593 -8.785 1.00 0.00 C ATOM 943 O ARG A 68 4.011 10.836 -9.573 1.00 0.00 O ATOM 944 CB ARG A 68 1.427 9.216 -10.040 1.00 0.00 C ATOM 945 CG ARG A 68 1.962 7.984 -9.329 1.00 0.00 C ATOM 946 CD ARG A 68 2.422 6.925 -10.319 1.00 0.00 C ATOM 947 NE ARG A 68 3.594 7.357 -11.076 1.00 0.00 N ATOM 948 CZ ARG A 68 4.319 6.543 -11.837 1.00 0.00 C ATOM 949 NH1 ARG A 68 3.992 5.263 -11.942 1.00 0.00 N ATOM 950 NH2 ARG A 68 5.372 7.011 -12.495 1.00 0.00 N ATOM 0 H ARG A 68 1.293 11.470 -11.098 1.00 0.00 H new ATOM 0 HA ARG A 68 0.995 10.528 -8.393 1.00 0.00 H new ATOM 0 HB2 ARG A 68 0.359 9.088 -10.218 1.00 0.00 H new ATOM 0 HB3 ARG A 68 1.905 9.299 -11.016 1.00 0.00 H new ATOM 0 HG2 ARG A 68 2.794 8.267 -8.685 1.00 0.00 H new ATOM 0 HG3 ARG A 68 1.187 7.569 -8.685 1.00 0.00 H new ATOM 0 HD2 ARG A 68 2.655 6.005 -9.783 1.00 0.00 H new ATOM 0 HD3 ARG A 68 1.609 6.695 -11.008 1.00 0.00 H new ATOM 0 HE ARG A 68 3.871 8.337 -11.018 1.00 0.00 H new ATOM 0 HH11 ARG A 68 3.183 4.900 -11.438 1.00 0.00 H new ATOM 0 HH12 ARG A 68 4.550 4.640 -12.527 1.00 0.00 H new ATOM 0 HH21 ARG A 68 5.626 7.996 -12.417 1.00 0.00 H new ATOM 0 HH22 ARG A 68 5.928 6.386 -13.079 1.00 0.00 H new ATOM 964 N HIS A 69 3.297 10.384 -7.487 1.00 0.00 N ATOM 965 CA HIS A 69 4.632 10.429 -6.902 1.00 0.00 C ATOM 966 C HIS A 69 5.127 9.025 -6.567 1.00 0.00 C ATOM 967 O HIS A 69 4.337 8.086 -6.464 1.00 0.00 O ATOM 968 CB HIS A 69 4.631 11.296 -5.643 1.00 0.00 C ATOM 969 CG HIS A 69 4.735 12.763 -5.925 1.00 0.00 C ATOM 970 ND1 HIS A 69 5.814 13.529 -5.538 1.00 0.00 N ATOM 971 CD2 HIS A 69 3.888 13.605 -6.563 1.00 0.00 C ATOM 972 CE1 HIS A 69 5.625 14.779 -5.924 1.00 0.00 C ATOM 973 NE2 HIS A 69 4.464 14.851 -6.548 1.00 0.00 N ATOM 0 H HIS A 69 2.551 10.182 -6.821 1.00 0.00 H new ATOM 0 HA HIS A 69 5.308 10.868 -7.636 1.00 0.00 H new ATOM 0 HB2 HIS A 69 3.716 11.106 -5.082 1.00 0.00 H new ATOM 0 HB3 HIS A 69 5.463 10.997 -5.006 1.00 0.00 H new ATOM 0 HD2 HIS A 69 2.936 13.345 -7.002 1.00 0.00 H new ATOM 0 HE1 HIS A 69 6.305 15.601 -5.757 1.00 0.00 H new ATOM 0 HE2 HIS A 69 4.060 15.695 -6.953 1.00 0.00 H new ATOM 982 N VAL A 70 6.438 8.890 -6.399 1.00 0.00 N ATOM 983 CA VAL A 70 7.038 7.601 -6.076 1.00 0.00 C ATOM 984 C VAL A 70 8.159 7.757 -5.055 1.00 0.00 C ATOM 985 O VAL A 70 9.026 8.620 -5.196 1.00 0.00 O ATOM 986 CB VAL A 70 7.597 6.910 -7.334 1.00 0.00 C ATOM 987 CG1 VAL A 70 8.252 5.586 -6.971 1.00 0.00 C ATOM 988 CG2 VAL A 70 6.494 6.704 -8.362 1.00 0.00 C ATOM 0 H VAL A 70 7.105 9.657 -6.481 1.00 0.00 H new ATOM 0 HA VAL A 70 6.247 6.982 -5.652 1.00 0.00 H new ATOM 0 HB VAL A 70 8.358 7.555 -7.774 1.00 0.00 H new ATOM 0 HG11 VAL A 70 8.641 5.113 -7.873 1.00 0.00 H new ATOM 0 HG12 VAL A 70 9.070 5.764 -6.273 1.00 0.00 H new ATOM 0 HG13 VAL A 70 7.515 4.931 -6.507 1.00 0.00 H new ATOM 0 HG21 VAL A 70 6.906 6.215 -9.245 1.00 0.00 H new ATOM 0 HG22 VAL A 70 5.710 6.080 -7.934 1.00 0.00 H new ATOM 0 HG23 VAL A 70 6.075 7.670 -8.645 1.00 0.00 H new ATOM 998 N VAL A 71 8.137 6.916 -4.026 1.00 0.00 N ATOM 999 CA VAL A 71 9.153 6.959 -2.981 1.00 0.00 C ATOM 1000 C VAL A 71 10.319 6.033 -3.310 1.00 0.00 C ATOM 1001 O VAL A 71 10.120 4.882 -3.700 1.00 0.00 O ATOM 1002 CB VAL A 71 8.568 6.564 -1.613 1.00 0.00 C ATOM 1003 CG1 VAL A 71 9.658 6.542 -0.552 1.00 0.00 C ATOM 1004 CG2 VAL A 71 7.448 7.515 -1.218 1.00 0.00 C ATOM 0 H VAL A 71 7.426 6.196 -3.894 1.00 0.00 H new ATOM 0 HA VAL A 71 9.512 7.987 -2.931 1.00 0.00 H new ATOM 0 HB VAL A 71 8.151 5.560 -1.692 1.00 0.00 H new ATOM 0 HG11 VAL A 71 9.225 6.261 0.408 1.00 0.00 H new ATOM 0 HG12 VAL A 71 10.423 5.818 -0.831 1.00 0.00 H new ATOM 0 HG13 VAL A 71 10.107 7.532 -0.471 1.00 0.00 H new ATOM 0 HG21 VAL A 71 7.046 7.221 -0.248 1.00 0.00 H new ATOM 0 HG22 VAL A 71 7.838 8.531 -1.156 1.00 0.00 H new ATOM 0 HG23 VAL A 71 6.656 7.475 -1.966 1.00 0.00 H new ATOM 1014 N ASP A 72 11.535 6.542 -3.149 1.00 0.00 N ATOM 1015 CA ASP A 72 12.735 5.761 -3.427 1.00 0.00 C ATOM 1016 C ASP A 72 13.625 5.674 -2.191 1.00 0.00 C ATOM 1017 O ASP A 72 13.641 6.581 -1.360 1.00 0.00 O ATOM 1018 CB ASP A 72 13.513 6.378 -4.589 1.00 0.00 C ATOM 1019 CG ASP A 72 13.694 7.875 -4.436 1.00 0.00 C ATOM 1020 OD1 ASP A 72 12.812 8.630 -4.898 1.00 0.00 O ATOM 1021 OD2 ASP A 72 14.716 8.292 -3.853 1.00 0.00 O ATOM 0 H ASP A 72 11.716 7.493 -2.827 1.00 0.00 H new ATOM 0 HA ASP A 72 12.427 4.752 -3.702 1.00 0.00 H new ATOM 0 HB2 ASP A 72 14.491 5.902 -4.660 1.00 0.00 H new ATOM 0 HB3 ASP A 72 12.990 6.172 -5.523 1.00 0.00 H new ATOM 1026 N GLY A 73 14.365 4.575 -2.077 1.00 0.00 N ATOM 1027 CA GLY A 73 15.246 4.389 -0.939 1.00 0.00 C ATOM 1028 C GLY A 73 14.516 3.866 0.282 1.00 0.00 C ATOM 1029 O GLY A 73 14.630 4.429 1.371 1.00 0.00 O ATOM 0 H GLY A 73 14.370 3.811 -2.752 1.00 0.00 H new ATOM 0 HA2 GLY A 73 16.040 3.693 -1.209 1.00 0.00 H new ATOM 0 HA3 GLY A 73 15.723 5.338 -0.694 1.00 0.00 H new ATOM 1033 N ILE A 74 13.761 2.787 0.100 1.00 0.00 N ATOM 1034 CA ILE A 74 13.009 2.189 1.196 1.00 0.00 C ATOM 1035 C ILE A 74 13.592 0.835 1.588 1.00 0.00 C ATOM 1036 O ILE A 74 13.680 -0.076 0.766 1.00 0.00 O ATOM 1037 CB ILE A 74 11.525 2.008 0.826 1.00 0.00 C ATOM 1038 CG1 ILE A 74 10.861 3.369 0.607 1.00 0.00 C ATOM 1039 CG2 ILE A 74 10.800 1.228 1.913 1.00 0.00 C ATOM 1040 CD1 ILE A 74 9.484 3.278 -0.010 1.00 0.00 C ATOM 0 H ILE A 74 13.654 2.310 -0.795 1.00 0.00 H new ATOM 0 HA ILE A 74 13.084 2.873 2.041 1.00 0.00 H new ATOM 0 HB ILE A 74 11.464 1.442 -0.103 1.00 0.00 H new ATOM 0 HG12 ILE A 74 10.788 3.886 1.564 1.00 0.00 H new ATOM 0 HG13 ILE A 74 11.499 3.976 -0.036 1.00 0.00 H new ATOM 0 HG21 ILE A 74 9.752 1.108 1.637 1.00 0.00 H new ATOM 0 HG22 ILE A 74 11.260 0.246 2.025 1.00 0.00 H new ATOM 0 HG23 ILE A 74 10.867 1.770 2.856 1.00 0.00 H new ATOM 0 HD11 ILE A 74 9.075 4.280 -0.136 1.00 0.00 H new ATOM 0 HD12 ILE A 74 9.552 2.789 -0.982 1.00 0.00 H new ATOM 0 HD13 ILE A 74 8.831 2.699 0.642 1.00 0.00 H new ATOM 1052 N SER A 75 13.987 0.711 2.852 1.00 0.00 N ATOM 1053 CA SER A 75 14.563 -0.530 3.354 1.00 0.00 C ATOM 1054 C SER A 75 13.538 -1.659 3.318 1.00 0.00 C ATOM 1055 O SER A 75 12.353 -1.445 3.576 1.00 0.00 O ATOM 1056 CB SER A 75 15.077 -0.338 4.782 1.00 0.00 C ATOM 1057 OG SER A 75 15.526 0.990 4.988 1.00 0.00 O ATOM 0 H SER A 75 13.918 1.455 3.546 1.00 0.00 H new ATOM 0 HA SER A 75 15.398 -0.801 2.708 1.00 0.00 H new ATOM 0 HB2 SER A 75 14.283 -0.571 5.492 1.00 0.00 H new ATOM 0 HB3 SER A 75 15.892 -1.035 4.975 1.00 0.00 H new ATOM 0 HG SER A 75 15.848 1.087 5.909 1.00 0.00 H new ATOM 1063 N ARG A 76 14.002 -2.862 2.995 1.00 0.00 N ATOM 1064 CA ARG A 76 13.126 -4.025 2.923 1.00 0.00 C ATOM 1065 C ARG A 76 12.590 -4.387 4.305 1.00 0.00 C ATOM 1066 O ARG A 76 11.553 -5.039 4.427 1.00 0.00 O ATOM 1067 CB ARG A 76 13.875 -5.218 2.326 1.00 0.00 C ATOM 1068 CG ARG A 76 15.132 -5.594 3.094 1.00 0.00 C ATOM 1069 CD ARG A 76 16.059 -6.460 2.255 1.00 0.00 C ATOM 1070 NE ARG A 76 17.421 -6.473 2.782 1.00 0.00 N ATOM 1071 CZ ARG A 76 18.444 -7.047 2.158 1.00 0.00 C ATOM 1072 NH1 ARG A 76 18.261 -7.650 0.992 1.00 0.00 N ATOM 1073 NH2 ARG A 76 19.654 -7.018 2.702 1.00 0.00 N ATOM 0 H ARG A 76 14.980 -3.056 2.779 1.00 0.00 H new ATOM 0 HA ARG A 76 12.283 -3.775 2.279 1.00 0.00 H new ATOM 0 HB2 ARG A 76 13.206 -6.078 2.297 1.00 0.00 H new ATOM 0 HB3 ARG A 76 14.144 -4.988 1.295 1.00 0.00 H new ATOM 0 HG2 ARG A 76 15.656 -4.689 3.401 1.00 0.00 H new ATOM 0 HG3 ARG A 76 14.858 -6.128 4.004 1.00 0.00 H new ATOM 0 HD2 ARG A 76 15.673 -7.479 2.223 1.00 0.00 H new ATOM 0 HD3 ARG A 76 16.071 -6.091 1.229 1.00 0.00 H new ATOM 0 HE ARG A 76 17.596 -6.017 3.677 1.00 0.00 H new ATOM 0 HH11 ARG A 76 17.332 -7.674 0.571 1.00 0.00 H new ATOM 0 HH12 ARG A 76 19.049 -8.090 0.516 1.00 0.00 H new ATOM 0 HH21 ARG A 76 19.799 -6.555 3.599 1.00 0.00 H new ATOM 0 HH22 ARG A 76 20.439 -7.459 2.223 1.00 0.00 H new ATOM 1087 N GLU A 77 13.303 -3.960 5.342 1.00 0.00 N ATOM 1088 CA GLU A 77 12.899 -4.242 6.715 1.00 0.00 C ATOM 1089 C GLU A 77 11.847 -3.242 7.187 1.00 0.00 C ATOM 1090 O GLU A 77 11.588 -3.116 8.385 1.00 0.00 O ATOM 1091 CB GLU A 77 14.112 -4.200 7.646 1.00 0.00 C ATOM 1092 CG GLU A 77 15.043 -5.390 7.486 1.00 0.00 C ATOM 1093 CD GLU A 77 14.506 -6.644 8.148 1.00 0.00 C ATOM 1094 OE1 GLU A 77 13.651 -6.519 9.050 1.00 0.00 O ATOM 1095 OE2 GLU A 77 14.940 -7.751 7.765 1.00 0.00 O ATOM 0 H GLU A 77 14.163 -3.418 5.258 1.00 0.00 H new ATOM 0 HA GLU A 77 12.465 -5.241 6.742 1.00 0.00 H new ATOM 0 HB2 GLU A 77 14.672 -3.284 7.459 1.00 0.00 H new ATOM 0 HB3 GLU A 77 13.766 -4.157 8.679 1.00 0.00 H new ATOM 0 HG2 GLU A 77 15.201 -5.583 6.425 1.00 0.00 H new ATOM 0 HG3 GLU A 77 16.015 -5.146 7.914 1.00 0.00 H new ATOM 1102 N HIS A 78 11.243 -2.534 6.238 1.00 0.00 N ATOM 1103 CA HIS A 78 10.219 -1.546 6.556 1.00 0.00 C ATOM 1104 C HIS A 78 8.932 -1.830 5.787 1.00 0.00 C ATOM 1105 O HIS A 78 8.775 -1.404 4.643 1.00 0.00 O ATOM 1106 CB HIS A 78 10.720 -0.138 6.233 1.00 0.00 C ATOM 1107 CG HIS A 78 11.493 0.494 7.349 1.00 0.00 C ATOM 1108 ND1 HIS A 78 10.989 0.642 8.624 1.00 0.00 N ATOM 1109 CD2 HIS A 78 12.742 1.015 7.377 1.00 0.00 C ATOM 1110 CE1 HIS A 78 11.894 1.229 9.387 1.00 0.00 C ATOM 1111 NE2 HIS A 78 12.967 1.466 8.655 1.00 0.00 N ATOM 0 H HIS A 78 11.445 -2.626 5.243 1.00 0.00 H new ATOM 0 HA HIS A 78 10.006 -1.611 7.623 1.00 0.00 H new ATOM 0 HB2 HIS A 78 11.350 -0.180 5.344 1.00 0.00 H new ATOM 0 HB3 HIS A 78 9.867 0.495 5.989 1.00 0.00 H new ATOM 0 HD2 HIS A 78 13.433 1.067 6.549 1.00 0.00 H new ATOM 0 HE1 HIS A 78 11.776 1.474 10.432 1.00 0.00 H new ATOM 0 HE2 HIS A 78 13.823 1.911 8.985 1.00 0.00 H new ATOM 1120 N SER A 79 8.015 -2.552 6.423 1.00 0.00 N ATOM 1121 CA SER A 79 6.744 -2.897 5.796 1.00 0.00 C ATOM 1122 C SER A 79 5.736 -1.763 5.953 1.00 0.00 C ATOM 1123 O SER A 79 4.526 -1.978 5.879 1.00 0.00 O ATOM 1124 CB SER A 79 6.182 -4.182 6.407 1.00 0.00 C ATOM 1125 OG SER A 79 6.628 -5.323 5.694 1.00 0.00 O ATOM 0 H SER A 79 8.128 -2.909 7.372 1.00 0.00 H new ATOM 0 HA SER A 79 6.923 -3.057 4.733 1.00 0.00 H new ATOM 0 HB2 SER A 79 6.490 -4.258 7.450 1.00 0.00 H new ATOM 0 HB3 SER A 79 5.093 -4.147 6.398 1.00 0.00 H new ATOM 0 HG SER A 79 6.189 -5.354 4.818 1.00 0.00 H new ATOM 1131 N SER A 80 6.244 -0.554 6.172 1.00 0.00 N ATOM 1132 CA SER A 80 5.389 0.615 6.343 1.00 0.00 C ATOM 1133 C SER A 80 6.119 1.888 5.926 1.00 0.00 C ATOM 1134 O SER A 80 7.347 1.956 5.973 1.00 0.00 O ATOM 1135 CB SER A 80 4.932 0.729 7.799 1.00 0.00 C ATOM 1136 OG SER A 80 6.039 0.722 8.683 1.00 0.00 O ATOM 0 H SER A 80 7.243 -0.359 6.235 1.00 0.00 H new ATOM 0 HA SER A 80 4.515 0.493 5.703 1.00 0.00 H new ATOM 0 HB2 SER A 80 4.361 1.648 7.933 1.00 0.00 H new ATOM 0 HB3 SER A 80 4.265 -0.099 8.040 1.00 0.00 H new ATOM 0 HG SER A 80 5.720 0.798 9.607 1.00 0.00 H new ATOM 1142 N TRP A 81 5.354 2.894 5.517 1.00 0.00 N ATOM 1143 CA TRP A 81 5.927 4.166 5.091 1.00 0.00 C ATOM 1144 C TRP A 81 4.956 5.313 5.347 1.00 0.00 C ATOM 1145 O TRP A 81 3.739 5.128 5.312 1.00 0.00 O ATOM 1146 CB TRP A 81 6.293 4.112 3.607 1.00 0.00 C ATOM 1147 CG TRP A 81 7.076 5.303 3.145 1.00 0.00 C ATOM 1148 CD1 TRP A 81 6.587 6.408 2.508 1.00 0.00 C ATOM 1149 CD2 TRP A 81 8.486 5.508 3.282 1.00 0.00 C ATOM 1150 NE1 TRP A 81 7.609 7.287 2.241 1.00 0.00 N ATOM 1151 CE2 TRP A 81 8.784 6.758 2.706 1.00 0.00 C ATOM 1152 CE3 TRP A 81 9.526 4.757 3.836 1.00 0.00 C ATOM 1153 CZ2 TRP A 81 10.077 7.272 2.670 1.00 0.00 C ATOM 1154 CZ3 TRP A 81 10.810 5.268 3.799 1.00 0.00 C ATOM 1155 CH2 TRP A 81 11.076 6.516 3.220 1.00 0.00 C ATOM 0 H TRP A 81 4.336 2.854 5.471 1.00 0.00 H new ATOM 0 HA TRP A 81 6.831 4.343 5.674 1.00 0.00 H new ATOM 0 HB2 TRP A 81 6.872 3.209 3.416 1.00 0.00 H new ATOM 0 HB3 TRP A 81 5.379 4.036 3.017 1.00 0.00 H new ATOM 0 HD1 TRP A 81 5.550 6.567 2.252 1.00 0.00 H new ATOM 0 HE1 TRP A 81 7.509 8.187 1.772 1.00 0.00 H new ATOM 0 HE3 TRP A 81 9.330 3.795 4.285 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 10.284 8.233 2.224 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 11.622 4.696 4.223 1.00 0.00 H new ATOM 0 HH2 TRP A 81 12.090 6.889 3.208 1.00 0.00 H new ATOM 1166 N ASP A 82 5.500 6.497 5.603 1.00 0.00 N ATOM 1167 CA ASP A 82 4.681 7.675 5.863 1.00 0.00 C ATOM 1168 C ASP A 82 4.841 8.705 4.749 1.00 0.00 C ATOM 1169 O ASP A 82 5.833 9.434 4.700 1.00 0.00 O ATOM 1170 CB ASP A 82 5.058 8.298 7.208 1.00 0.00 C ATOM 1171 CG ASP A 82 6.531 8.136 7.528 1.00 0.00 C ATOM 1172 OD1 ASP A 82 7.368 8.598 6.724 1.00 0.00 O ATOM 1173 OD2 ASP A 82 6.847 7.549 8.584 1.00 0.00 O ATOM 0 H ASP A 82 6.505 6.667 5.636 1.00 0.00 H new ATOM 0 HA ASP A 82 3.638 7.361 5.896 1.00 0.00 H new ATOM 0 HB2 ASP A 82 4.806 9.358 7.197 1.00 0.00 H new ATOM 0 HB3 ASP A 82 4.465 7.837 7.998 1.00 0.00 H new ATOM 1178 N LEU A 83 3.860 8.759 3.855 1.00 0.00 N ATOM 1179 CA LEU A 83 3.892 9.699 2.740 1.00 0.00 C ATOM 1180 C LEU A 83 3.736 11.134 3.232 1.00 0.00 C ATOM 1181 O LEU A 83 2.965 11.405 4.153 1.00 0.00 O ATOM 1182 CB LEU A 83 2.785 9.369 1.737 1.00 0.00 C ATOM 1183 CG LEU A 83 2.759 7.932 1.214 1.00 0.00 C ATOM 1184 CD1 LEU A 83 1.455 7.653 0.483 1.00 0.00 C ATOM 1185 CD2 LEU A 83 3.950 7.675 0.302 1.00 0.00 C ATOM 0 H LEU A 83 3.033 8.163 3.880 1.00 0.00 H new ATOM 0 HA LEU A 83 4.860 9.607 2.248 1.00 0.00 H new ATOM 0 HB2 LEU A 83 1.824 9.582 2.205 1.00 0.00 H new ATOM 0 HB3 LEU A 83 2.881 10.043 0.885 1.00 0.00 H new ATOM 0 HG LEU A 83 2.826 7.255 2.065 1.00 0.00 H new ATOM 0 HD11 LEU A 83 1.455 6.626 0.118 1.00 0.00 H new ATOM 0 HD12 LEU A 83 0.617 7.796 1.166 1.00 0.00 H new ATOM 0 HD13 LEU A 83 1.357 8.337 -0.360 1.00 0.00 H new ATOM 0 HD21 LEU A 83 3.915 6.648 -0.061 1.00 0.00 H new ATOM 0 HD22 LEU A 83 3.914 8.360 -0.545 1.00 0.00 H new ATOM 0 HD23 LEU A 83 4.874 7.833 0.858 1.00 0.00 H new ATOM 1197 N VAL A 84 4.471 12.051 2.612 1.00 0.00 N ATOM 1198 CA VAL A 84 4.412 13.460 2.984 1.00 0.00 C ATOM 1199 C VAL A 84 4.408 14.355 1.751 1.00 0.00 C ATOM 1200 O VAL A 84 5.246 14.209 0.862 1.00 0.00 O ATOM 1201 CB VAL A 84 5.598 13.852 3.885 1.00 0.00 C ATOM 1202 CG1 VAL A 84 5.612 13.005 5.149 1.00 0.00 C ATOM 1203 CG2 VAL A 84 6.910 13.716 3.128 1.00 0.00 C ATOM 0 H VAL A 84 5.115 11.844 1.849 1.00 0.00 H new ATOM 0 HA VAL A 84 3.483 13.603 3.535 1.00 0.00 H new ATOM 0 HB VAL A 84 5.480 14.895 4.177 1.00 0.00 H new ATOM 0 HG11 VAL A 84 6.457 13.296 5.773 1.00 0.00 H new ATOM 0 HG12 VAL A 84 4.684 13.158 5.700 1.00 0.00 H new ATOM 0 HG13 VAL A 84 5.705 11.953 4.881 1.00 0.00 H new ATOM 0 HG21 VAL A 84 7.737 13.997 3.780 1.00 0.00 H new ATOM 0 HG22 VAL A 84 7.038 12.683 2.804 1.00 0.00 H new ATOM 0 HG23 VAL A 84 6.897 14.370 2.256 1.00 0.00 H new ATOM 1213 N GLY A 85 3.457 15.284 1.703 1.00 0.00 N ATOM 1214 CA GLY A 85 3.361 16.190 0.574 1.00 0.00 C ATOM 1215 C GLY A 85 2.130 15.933 -0.273 1.00 0.00 C ATOM 1216 O GLY A 85 2.234 15.701 -1.478 1.00 0.00 O ATOM 0 H GLY A 85 2.752 15.425 2.426 1.00 0.00 H new ATOM 0 HA2 GLY A 85 3.340 17.217 0.937 1.00 0.00 H new ATOM 0 HA3 GLY A 85 4.252 16.089 -0.046 1.00 0.00 H new ATOM 1220 N LEU A 86 0.962 15.973 0.358 1.00 0.00 N ATOM 1221 CA LEU A 86 -0.295 15.741 -0.345 1.00 0.00 C ATOM 1222 C LEU A 86 -1.305 16.841 -0.033 1.00 0.00 C ATOM 1223 O LEU A 86 -1.002 17.786 0.695 1.00 0.00 O ATOM 1224 CB LEU A 86 -0.874 14.378 0.040 1.00 0.00 C ATOM 1225 CG LEU A 86 0.132 13.233 0.164 1.00 0.00 C ATOM 1226 CD1 LEU A 86 -0.488 12.056 0.901 1.00 0.00 C ATOM 1227 CD2 LEU A 86 0.624 12.804 -1.211 1.00 0.00 C ATOM 0 H LEU A 86 0.859 16.164 1.355 1.00 0.00 H new ATOM 0 HA LEU A 86 -0.091 15.753 -1.416 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -1.395 14.482 0.992 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -1.621 14.100 -0.703 1.00 0.00 H new ATOM 0 HG LEU A 86 0.987 13.587 0.740 1.00 0.00 H new ATOM 0 HD11 LEU A 86 0.242 11.251 0.980 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -0.791 12.371 1.900 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -1.361 11.702 0.352 1.00 0.00 H new ATOM 0 HD21 LEU A 86 1.339 11.988 -1.103 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -0.221 12.469 -1.812 1.00 0.00 H new ATOM 0 HD23 LEU A 86 1.107 13.648 -1.704 1.00 0.00 H new ATOM 1239 N GLU A 87 -2.505 16.710 -0.588 1.00 0.00 N ATOM 1240 CA GLU A 87 -3.560 17.693 -0.367 1.00 0.00 C ATOM 1241 C GLU A 87 -4.420 17.308 0.833 1.00 0.00 C ATOM 1242 O GLU A 87 -4.306 16.204 1.365 1.00 0.00 O ATOM 1243 CB GLU A 87 -4.435 17.824 -1.615 1.00 0.00 C ATOM 1244 CG GLU A 87 -5.050 19.203 -1.786 1.00 0.00 C ATOM 1245 CD GLU A 87 -4.033 20.318 -1.635 1.00 0.00 C ATOM 1246 OE1 GLU A 87 -3.246 20.535 -2.580 1.00 0.00 O ATOM 1247 OE2 GLU A 87 -4.023 20.973 -0.572 1.00 0.00 O ATOM 0 H GLU A 87 -2.771 15.934 -1.194 1.00 0.00 H new ATOM 0 HA GLU A 87 -3.089 18.654 -0.160 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -3.835 17.591 -2.495 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -5.233 17.083 -1.568 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -5.514 19.270 -2.770 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -5.843 19.337 -1.050 1.00 0.00 H new ATOM 1254 N LYS A 88 -5.281 18.228 1.255 1.00 0.00 N ATOM 1255 CA LYS A 88 -6.162 17.987 2.391 1.00 0.00 C ATOM 1256 C LYS A 88 -7.597 17.756 1.928 1.00 0.00 C ATOM 1257 O LYS A 88 -8.092 18.451 1.040 1.00 0.00 O ATOM 1258 CB LYS A 88 -6.113 19.169 3.361 1.00 0.00 C ATOM 1259 CG LYS A 88 -4.717 19.736 3.559 1.00 0.00 C ATOM 1260 CD LYS A 88 -4.466 20.929 2.653 1.00 0.00 C ATOM 1261 CE LYS A 88 -3.005 21.352 2.679 1.00 0.00 C ATOM 1262 NZ LYS A 88 -2.677 22.137 3.902 1.00 0.00 N ATOM 0 H LYS A 88 -5.387 19.148 0.827 1.00 0.00 H new ATOM 0 HA LYS A 88 -5.815 17.090 2.903 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -6.768 19.958 2.992 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -6.508 18.853 4.326 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -4.589 20.035 4.599 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -3.977 18.962 3.356 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -4.755 20.679 1.632 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -5.093 21.764 2.967 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -2.370 20.467 2.634 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -2.784 21.949 1.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -1.673 22.407 3.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -3.265 22.994 3.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -2.864 21.559 4.746 1.00 0.00 H new ATOM 1276 N TRP A 89 -8.259 16.778 2.535 1.00 0.00 N ATOM 1277 CA TRP A 89 -9.638 16.457 2.184 1.00 0.00 C ATOM 1278 C TRP A 89 -9.732 15.952 0.749 1.00 0.00 C ATOM 1279 O TRP A 89 -10.663 16.294 0.019 1.00 0.00 O ATOM 1280 CB TRP A 89 -10.531 17.685 2.366 1.00 0.00 C ATOM 1281 CG TRP A 89 -11.853 17.370 2.998 1.00 0.00 C ATOM 1282 CD1 TRP A 89 -12.130 16.339 3.850 1.00 0.00 C ATOM 1283 CD2 TRP A 89 -13.079 18.091 2.827 1.00 0.00 C ATOM 1284 NE1 TRP A 89 -13.453 16.376 4.219 1.00 0.00 N ATOM 1285 CE2 TRP A 89 -14.056 17.441 3.605 1.00 0.00 C ATOM 1286 CE3 TRP A 89 -13.444 19.223 2.094 1.00 0.00 C ATOM 1287 CZ2 TRP A 89 -15.374 17.887 3.668 1.00 0.00 C ATOM 1288 CZ3 TRP A 89 -14.753 19.663 2.157 1.00 0.00 C ATOM 1289 CH2 TRP A 89 -15.704 18.997 2.940 1.00 0.00 C ATOM 0 H TRP A 89 -7.864 16.194 3.272 1.00 0.00 H new ATOM 0 HA TRP A 89 -9.981 15.665 2.850 1.00 0.00 H new ATOM 0 HB2 TRP A 89 -10.008 18.418 2.981 1.00 0.00 H new ATOM 0 HB3 TRP A 89 -10.702 18.148 1.394 1.00 0.00 H new ATOM 0 HD1 TRP A 89 -11.414 15.603 4.185 1.00 0.00 H new ATOM 0 HE1 TRP A 89 -13.912 15.717 4.848 1.00 0.00 H new ATOM 0 HE3 TRP A 89 -12.717 19.745 1.489 1.00 0.00 H new ATOM 0 HZ2 TRP A 89 -16.109 17.375 4.270 1.00 0.00 H new ATOM 0 HZ3 TRP A 89 -15.047 20.535 1.593 1.00 0.00 H new ATOM 0 HH2 TRP A 89 -16.718 19.367 2.970 1.00 0.00 H new ATOM 1300 N THR A 90 -8.762 15.136 0.348 1.00 0.00 N ATOM 1301 CA THR A 90 -8.735 14.586 -1.001 1.00 0.00 C ATOM 1302 C THR A 90 -8.282 13.130 -0.992 1.00 0.00 C ATOM 1303 O THR A 90 -7.274 12.789 -0.375 1.00 0.00 O ATOM 1304 CB THR A 90 -7.802 15.396 -1.921 1.00 0.00 C ATOM 1305 OG1 THR A 90 -8.309 16.726 -2.084 1.00 0.00 O ATOM 1306 CG2 THR A 90 -7.669 14.729 -3.281 1.00 0.00 C ATOM 0 H THR A 90 -7.985 14.842 0.939 1.00 0.00 H new ATOM 0 HA THR A 90 -9.753 14.645 -1.386 1.00 0.00 H new ATOM 0 HB THR A 90 -6.817 15.437 -1.457 1.00 0.00 H new ATOM 0 HG1 THR A 90 -7.710 17.235 -2.669 1.00 0.00 H new ATOM 0 HG21 THR A 90 -7.005 15.320 -3.913 1.00 0.00 H new ATOM 0 HG22 THR A 90 -7.256 13.728 -3.157 1.00 0.00 H new ATOM 0 HG23 THR A 90 -8.650 14.660 -3.750 1.00 0.00 H new ATOM 1314 N GLU A 91 -9.033 12.277 -1.682 1.00 0.00 N ATOM 1315 CA GLU A 91 -8.707 10.858 -1.752 1.00 0.00 C ATOM 1316 C GLU A 91 -7.415 10.634 -2.534 1.00 0.00 C ATOM 1317 O GLU A 91 -7.167 11.292 -3.544 1.00 0.00 O ATOM 1318 CB GLU A 91 -9.852 10.080 -2.404 1.00 0.00 C ATOM 1319 CG GLU A 91 -9.943 8.633 -1.948 1.00 0.00 C ATOM 1320 CD GLU A 91 -11.314 8.032 -2.185 1.00 0.00 C ATOM 1321 OE1 GLU A 91 -11.558 7.535 -3.304 1.00 0.00 O ATOM 1322 OE2 GLU A 91 -12.144 8.059 -1.252 1.00 0.00 O ATOM 0 H GLU A 91 -9.870 12.544 -2.200 1.00 0.00 H new ATOM 0 HA GLU A 91 -8.563 10.494 -0.735 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -10.794 10.582 -2.182 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -9.726 10.104 -3.486 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -9.195 8.042 -2.476 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -9.704 8.575 -0.886 1.00 0.00 H new ATOM 1329 N TYR A 92 -6.597 9.702 -2.058 1.00 0.00 N ATOM 1330 CA TYR A 92 -5.329 9.394 -2.710 1.00 0.00 C ATOM 1331 C TYR A 92 -5.128 7.886 -2.822 1.00 0.00 C ATOM 1332 O TYR A 92 -5.293 7.152 -1.848 1.00 0.00 O ATOM 1333 CB TYR A 92 -4.168 10.018 -1.934 1.00 0.00 C ATOM 1334 CG TYR A 92 -3.882 11.451 -2.322 1.00 0.00 C ATOM 1335 CD1 TYR A 92 -3.010 11.750 -3.362 1.00 0.00 C ATOM 1336 CD2 TYR A 92 -4.486 12.507 -1.649 1.00 0.00 C ATOM 1337 CE1 TYR A 92 -2.746 13.058 -3.719 1.00 0.00 C ATOM 1338 CE2 TYR A 92 -4.228 13.818 -2.001 1.00 0.00 C ATOM 1339 CZ TYR A 92 -3.357 14.088 -3.035 1.00 0.00 C ATOM 1340 OH TYR A 92 -3.098 15.393 -3.389 1.00 0.00 O ATOM 0 H TYR A 92 -6.789 9.147 -1.224 1.00 0.00 H new ATOM 0 HA TYR A 92 -5.354 9.815 -3.715 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -4.391 9.976 -0.868 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -3.271 9.420 -2.096 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -2.531 10.946 -3.900 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -5.168 12.299 -0.838 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -2.065 13.273 -4.529 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -4.706 14.627 -1.469 1.00 0.00 H new ATOM 0 HH TYR A 92 -3.894 15.783 -3.808 1.00 0.00 H new ATOM 1350 N ARG A 93 -4.770 7.431 -4.018 1.00 0.00 N ATOM 1351 CA ARG A 93 -4.546 6.011 -4.260 1.00 0.00 C ATOM 1352 C ARG A 93 -3.088 5.639 -4.007 1.00 0.00 C ATOM 1353 O ARG A 93 -2.200 6.006 -4.777 1.00 0.00 O ATOM 1354 CB ARG A 93 -4.934 5.648 -5.695 1.00 0.00 C ATOM 1355 CG ARG A 93 -6.417 5.370 -5.873 1.00 0.00 C ATOM 1356 CD ARG A 93 -6.689 4.597 -7.154 1.00 0.00 C ATOM 1357 NE ARG A 93 -8.111 4.312 -7.330 1.00 0.00 N ATOM 1358 CZ ARG A 93 -8.766 3.389 -6.635 1.00 0.00 C ATOM 1359 NH1 ARG A 93 -8.132 2.667 -5.722 1.00 0.00 N ATOM 1360 NH2 ARG A 93 -10.060 3.188 -6.852 1.00 0.00 N ATOM 0 H ARG A 93 -4.629 8.025 -4.835 1.00 0.00 H new ATOM 0 HA ARG A 93 -5.172 5.448 -3.568 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -4.644 6.463 -6.358 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -4.369 4.769 -6.004 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -6.787 4.803 -5.019 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -6.965 6.312 -5.892 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -6.326 5.170 -8.007 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -6.131 3.661 -7.138 1.00 0.00 H new ATOM 0 HE ARG A 93 -8.629 4.851 -8.024 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -7.138 2.819 -5.551 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -8.638 1.959 -5.190 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -10.552 3.743 -7.553 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -10.563 2.479 -6.318 1.00 0.00 H new ATOM 1374 N VAL A 94 -2.848 4.909 -2.922 1.00 0.00 N ATOM 1375 CA VAL A 94 -1.498 4.487 -2.567 1.00 0.00 C ATOM 1376 C VAL A 94 -1.218 3.071 -3.058 1.00 0.00 C ATOM 1377 O VAL A 94 -2.028 2.165 -2.862 1.00 0.00 O ATOM 1378 CB VAL A 94 -1.274 4.545 -1.045 1.00 0.00 C ATOM 1379 CG1 VAL A 94 0.086 3.970 -0.682 1.00 0.00 C ATOM 1380 CG2 VAL A 94 -1.409 5.974 -0.541 1.00 0.00 C ATOM 0 H VAL A 94 -3.571 4.598 -2.274 1.00 0.00 H new ATOM 0 HA VAL A 94 -0.811 5.179 -3.054 1.00 0.00 H new ATOM 0 HB VAL A 94 -2.039 3.938 -0.560 1.00 0.00 H new ATOM 0 HG11 VAL A 94 0.226 4.020 0.398 1.00 0.00 H new ATOM 0 HG12 VAL A 94 0.140 2.931 -1.007 1.00 0.00 H new ATOM 0 HG13 VAL A 94 0.868 4.546 -1.176 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -1.248 5.996 0.537 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -0.668 6.605 -1.032 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -2.408 6.346 -0.766 1.00 0.00 H new ATOM 1390 N TRP A 95 -0.067 2.888 -3.694 1.00 0.00 N ATOM 1391 CA TRP A 95 0.320 1.581 -4.212 1.00 0.00 C ATOM 1392 C TRP A 95 1.668 1.149 -3.646 1.00 0.00 C ATOM 1393 O TRP A 95 2.703 1.738 -3.960 1.00 0.00 O ATOM 1394 CB TRP A 95 0.382 1.614 -5.740 1.00 0.00 C ATOM 1395 CG TRP A 95 -0.952 1.837 -6.385 1.00 0.00 C ATOM 1396 CD1 TRP A 95 -1.918 0.899 -6.616 1.00 0.00 C ATOM 1397 CD2 TRP A 95 -1.467 3.077 -6.881 1.00 0.00 C ATOM 1398 NE1 TRP A 95 -3.002 1.482 -7.227 1.00 0.00 N ATOM 1399 CE2 TRP A 95 -2.751 2.818 -7.400 1.00 0.00 C ATOM 1400 CE3 TRP A 95 -0.970 4.382 -6.936 1.00 0.00 C ATOM 1401 CZ2 TRP A 95 -3.541 3.815 -7.966 1.00 0.00 C ATOM 1402 CZ3 TRP A 95 -1.755 5.371 -7.498 1.00 0.00 C ATOM 1403 CH2 TRP A 95 -3.029 5.083 -8.007 1.00 0.00 C ATOM 0 H TRP A 95 0.615 3.628 -3.863 1.00 0.00 H new ATOM 0 HA TRP A 95 -0.433 0.857 -3.901 1.00 0.00 H new ATOM 0 HB2 TRP A 95 1.065 2.405 -6.052 1.00 0.00 H new ATOM 0 HB3 TRP A 95 0.799 0.673 -6.100 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -1.841 -0.147 -6.357 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -3.855 0.998 -7.507 1.00 0.00 H new ATOM 0 HE3 TRP A 95 0.010 4.614 -6.546 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -4.523 3.595 -8.359 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -1.381 6.383 -7.546 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -3.618 5.878 -8.440 1.00 0.00 H new ATOM 1414 N VAL A 96 1.649 0.116 -2.809 1.00 0.00 N ATOM 1415 CA VAL A 96 2.871 -0.396 -2.199 1.00 0.00 C ATOM 1416 C VAL A 96 3.069 -1.872 -2.522 1.00 0.00 C ATOM 1417 O VAL A 96 2.249 -2.714 -2.155 1.00 0.00 O ATOM 1418 CB VAL A 96 2.854 -0.214 -0.670 1.00 0.00 C ATOM 1419 CG1 VAL A 96 1.622 -0.872 -0.067 1.00 0.00 C ATOM 1420 CG2 VAL A 96 4.125 -0.778 -0.052 1.00 0.00 C ATOM 0 H VAL A 96 0.801 -0.382 -2.538 1.00 0.00 H new ATOM 0 HA VAL A 96 3.698 0.178 -2.616 1.00 0.00 H new ATOM 0 HB VAL A 96 2.812 0.853 -0.450 1.00 0.00 H new ATOM 0 HG11 VAL A 96 1.628 -0.733 1.014 1.00 0.00 H new ATOM 0 HG12 VAL A 96 0.725 -0.418 -0.487 1.00 0.00 H new ATOM 0 HG13 VAL A 96 1.630 -1.938 -0.296 1.00 0.00 H new ATOM 0 HG21 VAL A 96 4.096 -0.641 1.029 1.00 0.00 H new ATOM 0 HG22 VAL A 96 4.200 -1.841 -0.281 1.00 0.00 H new ATOM 0 HG23 VAL A 96 4.991 -0.257 -0.461 1.00 0.00 H new ATOM 1430 N ARG A 97 4.163 -2.180 -3.211 1.00 0.00 N ATOM 1431 CA ARG A 97 4.469 -3.556 -3.584 1.00 0.00 C ATOM 1432 C ARG A 97 5.840 -3.970 -3.057 1.00 0.00 C ATOM 1433 O ARG A 97 6.584 -3.149 -2.523 1.00 0.00 O ATOM 1434 CB ARG A 97 4.427 -3.715 -5.105 1.00 0.00 C ATOM 1435 CG ARG A 97 5.754 -3.423 -5.786 1.00 0.00 C ATOM 1436 CD ARG A 97 5.730 -3.828 -7.251 1.00 0.00 C ATOM 1437 NE ARG A 97 5.351 -5.228 -7.426 1.00 0.00 N ATOM 1438 CZ ARG A 97 6.194 -6.242 -7.271 1.00 0.00 C ATOM 1439 NH1 ARG A 97 7.458 -6.014 -6.940 1.00 0.00 N ATOM 1440 NH2 ARG A 97 5.775 -7.488 -7.448 1.00 0.00 N ATOM 0 H ARG A 97 4.852 -1.495 -3.522 1.00 0.00 H new ATOM 0 HA ARG A 97 3.716 -4.204 -3.136 1.00 0.00 H new ATOM 0 HB2 ARG A 97 4.121 -4.733 -5.347 1.00 0.00 H new ATOM 0 HB3 ARG A 97 3.666 -3.048 -5.510 1.00 0.00 H new ATOM 0 HG2 ARG A 97 5.979 -2.360 -5.705 1.00 0.00 H new ATOM 0 HG3 ARG A 97 6.553 -3.958 -5.273 1.00 0.00 H new ATOM 0 HD2 ARG A 97 5.029 -3.192 -7.791 1.00 0.00 H new ATOM 0 HD3 ARG A 97 6.714 -3.661 -7.689 1.00 0.00 H new ATOM 0 HE ARG A 97 4.386 -5.438 -7.681 1.00 0.00 H new ATOM 0 HH11 ARG A 97 7.785 -5.057 -6.804 1.00 0.00 H new ATOM 0 HH12 ARG A 97 8.103 -6.795 -6.822 1.00 0.00 H new ATOM 0 HH21 ARG A 97 4.804 -7.668 -7.704 1.00 0.00 H new ATOM 0 HH22 ARG A 97 6.424 -8.266 -7.329 1.00 0.00 H new ATOM 1454 N ALA A 98 6.165 -5.250 -3.210 1.00 0.00 N ATOM 1455 CA ALA A 98 7.446 -5.773 -2.751 1.00 0.00 C ATOM 1456 C ALA A 98 8.373 -6.062 -3.926 1.00 0.00 C ATOM 1457 O ALA A 98 8.124 -6.971 -4.719 1.00 0.00 O ATOM 1458 CB ALA A 98 7.235 -7.030 -1.921 1.00 0.00 C ATOM 0 H ALA A 98 5.559 -5.943 -3.648 1.00 0.00 H new ATOM 0 HA ALA A 98 7.919 -5.014 -2.127 1.00 0.00 H new ATOM 0 HB1 ALA A 98 8.200 -7.410 -1.585 1.00 0.00 H new ATOM 0 HB2 ALA A 98 6.616 -6.795 -1.055 1.00 0.00 H new ATOM 0 HB3 ALA A 98 6.738 -7.787 -2.527 1.00 0.00 H new ATOM 1464 N HIS A 99 9.445 -5.283 -4.034 1.00 0.00 N ATOM 1465 CA HIS A 99 10.411 -5.456 -5.113 1.00 0.00 C ATOM 1466 C HIS A 99 11.411 -6.557 -4.776 1.00 0.00 C ATOM 1467 O HIS A 99 11.807 -6.719 -3.621 1.00 0.00 O ATOM 1468 CB HIS A 99 11.149 -4.144 -5.381 1.00 0.00 C ATOM 1469 CG HIS A 99 10.333 -3.140 -6.136 1.00 0.00 C ATOM 1470 ND1 HIS A 99 8.955 -3.152 -6.155 1.00 0.00 N ATOM 1471 CD2 HIS A 99 10.710 -2.089 -6.901 1.00 0.00 C ATOM 1472 CE1 HIS A 99 8.518 -2.152 -6.900 1.00 0.00 C ATOM 1473 NE2 HIS A 99 9.563 -1.492 -7.365 1.00 0.00 N ATOM 0 H HIS A 99 9.666 -4.526 -3.387 1.00 0.00 H new ATOM 0 HA HIS A 99 9.867 -5.747 -6.011 1.00 0.00 H new ATOM 0 HB2 HIS A 99 11.456 -3.709 -4.430 1.00 0.00 H new ATOM 0 HB3 HIS A 99 12.059 -4.357 -5.943 1.00 0.00 H new ATOM 0 HD2 HIS A 99 11.723 -1.778 -7.108 1.00 0.00 H new ATOM 0 HE1 HIS A 99 7.483 -1.915 -7.095 1.00 0.00 H new ATOM 0 HE2 HIS A 99 9.525 -0.672 -7.970 1.00 0.00 H new ATOM 1482 N THR A 100 11.817 -7.313 -5.791 1.00 0.00 N ATOM 1483 CA THR A 100 12.769 -8.400 -5.602 1.00 0.00 C ATOM 1484 C THR A 100 13.981 -8.234 -6.513 1.00 0.00 C ATOM 1485 O THR A 100 13.951 -7.455 -7.466 1.00 0.00 O ATOM 1486 CB THR A 100 12.120 -9.769 -5.875 1.00 0.00 C ATOM 1487 OG1 THR A 100 11.175 -9.659 -6.945 1.00 0.00 O ATOM 1488 CG2 THR A 100 11.424 -10.296 -4.629 1.00 0.00 C ATOM 0 H THR A 100 11.501 -7.192 -6.753 1.00 0.00 H new ATOM 0 HA THR A 100 13.091 -8.360 -4.562 1.00 0.00 H new ATOM 0 HB THR A 100 12.906 -10.469 -6.156 1.00 0.00 H new ATOM 0 HG1 THR A 100 11.498 -9.007 -7.601 1.00 0.00 H new ATOM 0 HG21 THR A 100 10.973 -11.264 -4.846 1.00 0.00 H new ATOM 0 HG22 THR A 100 12.152 -10.407 -3.825 1.00 0.00 H new ATOM 0 HG23 THR A 100 10.648 -9.595 -4.322 1.00 0.00 H new ATOM 1496 N ASP A 101 15.044 -8.972 -6.215 1.00 0.00 N ATOM 1497 CA ASP A 101 16.266 -8.908 -7.009 1.00 0.00 C ATOM 1498 C ASP A 101 15.974 -9.190 -8.479 1.00 0.00 C ATOM 1499 O ASP A 101 16.675 -8.704 -9.367 1.00 0.00 O ATOM 1500 CB ASP A 101 17.296 -9.907 -6.480 1.00 0.00 C ATOM 1501 CG ASP A 101 18.477 -10.071 -7.416 1.00 0.00 C ATOM 1502 OD1 ASP A 101 18.270 -10.538 -8.555 1.00 0.00 O ATOM 1503 OD2 ASP A 101 19.609 -9.734 -7.009 1.00 0.00 O ATOM 0 H ASP A 101 15.085 -9.622 -5.430 1.00 0.00 H new ATOM 0 HA ASP A 101 16.672 -7.900 -6.925 1.00 0.00 H new ATOM 0 HB2 ASP A 101 17.652 -9.575 -5.505 1.00 0.00 H new ATOM 0 HB3 ASP A 101 16.817 -10.875 -6.332 1.00 0.00 H new ATOM 1508 N VAL A 102 14.935 -9.980 -8.730 1.00 0.00 N ATOM 1509 CA VAL A 102 14.550 -10.328 -10.093 1.00 0.00 C ATOM 1510 C VAL A 102 13.934 -9.132 -10.811 1.00 0.00 C ATOM 1511 O VAL A 102 13.924 -9.071 -12.040 1.00 0.00 O ATOM 1512 CB VAL A 102 13.547 -11.496 -10.112 1.00 0.00 C ATOM 1513 CG1 VAL A 102 14.264 -12.819 -9.889 1.00 0.00 C ATOM 1514 CG2 VAL A 102 12.463 -11.285 -9.065 1.00 0.00 C ATOM 0 H VAL A 102 14.344 -10.391 -8.007 1.00 0.00 H new ATOM 0 HA VAL A 102 15.459 -10.632 -10.612 1.00 0.00 H new ATOM 0 HB VAL A 102 13.072 -11.528 -11.092 1.00 0.00 H new ATOM 0 HG11 VAL A 102 13.539 -13.633 -9.906 1.00 0.00 H new ATOM 0 HG12 VAL A 102 15.000 -12.972 -10.679 1.00 0.00 H new ATOM 0 HG13 VAL A 102 14.768 -12.801 -8.923 1.00 0.00 H new ATOM 0 HG21 VAL A 102 11.763 -12.120 -9.093 1.00 0.00 H new ATOM 0 HG22 VAL A 102 12.918 -11.226 -8.076 1.00 0.00 H new ATOM 0 HG23 VAL A 102 11.930 -10.358 -9.275 1.00 0.00 H new ATOM 1524 N GLY A 103 13.421 -8.182 -10.036 1.00 0.00 N ATOM 1525 CA GLY A 103 12.811 -7.000 -10.616 1.00 0.00 C ATOM 1526 C GLY A 103 11.468 -6.675 -9.991 1.00 0.00 C ATOM 1527 O GLY A 103 10.860 -7.501 -9.311 1.00 0.00 O ATOM 0 H GLY A 103 13.417 -8.210 -9.016 1.00 0.00 H new ATOM 0 HA2 GLY A 103 13.482 -6.150 -10.491 1.00 0.00 H new ATOM 0 HA3 GLY A 103 12.683 -7.150 -11.688 1.00 0.00 H new ATOM 1531 N PRO A 104 10.987 -5.444 -10.220 1.00 0.00 N ATOM 1532 CA PRO A 104 9.704 -4.983 -9.683 1.00 0.00 C ATOM 1533 C PRO A 104 8.517 -5.676 -10.343 1.00 0.00 C ATOM 1534 O PRO A 104 8.661 -6.327 -11.376 1.00 0.00 O ATOM 1535 CB PRO A 104 9.699 -3.488 -10.010 1.00 0.00 C ATOM 1536 CG PRO A 104 10.599 -3.355 -11.190 1.00 0.00 C ATOM 1537 CD PRO A 104 11.659 -4.408 -11.022 1.00 0.00 C ATOM 0 HA PRO A 104 9.605 -5.201 -8.620 1.00 0.00 H new ATOM 0 HB2 PRO A 104 8.693 -3.136 -10.238 1.00 0.00 H new ATOM 0 HB3 PRO A 104 10.060 -2.897 -9.168 1.00 0.00 H new ATOM 0 HG2 PRO A 104 10.048 -3.500 -12.119 1.00 0.00 H new ATOM 0 HG3 PRO A 104 11.041 -2.360 -11.234 1.00 0.00 H new ATOM 0 HD2 PRO A 104 11.994 -4.798 -11.983 1.00 0.00 H new ATOM 0 HD3 PRO A 104 12.539 -4.014 -10.514 1.00 0.00 H new ATOM 1545 N GLY A 105 7.341 -5.531 -9.738 1.00 0.00 N ATOM 1546 CA GLY A 105 6.146 -6.149 -10.281 1.00 0.00 C ATOM 1547 C GLY A 105 4.955 -5.212 -10.274 1.00 0.00 C ATOM 1548 O GLY A 105 5.098 -3.992 -10.191 1.00 0.00 O ATOM 0 H GLY A 105 7.195 -4.996 -8.882 1.00 0.00 H new ATOM 0 HA2 GLY A 105 6.342 -6.476 -11.302 1.00 0.00 H new ATOM 0 HA3 GLY A 105 5.906 -7.041 -9.702 1.00 0.00 H new ATOM 1552 N PRO A 106 3.745 -5.785 -10.364 1.00 0.00 N ATOM 1553 CA PRO A 106 2.501 -5.011 -10.371 1.00 0.00 C ATOM 1554 C PRO A 106 2.206 -4.374 -9.017 1.00 0.00 C ATOM 1555 O PRO A 106 2.782 -4.762 -8.001 1.00 0.00 O ATOM 1556 CB PRO A 106 1.435 -6.055 -10.714 1.00 0.00 C ATOM 1557 CG PRO A 106 2.015 -7.350 -10.262 1.00 0.00 C ATOM 1558 CD PRO A 106 3.500 -7.233 -10.466 1.00 0.00 C ATOM 0 HA PRO A 106 2.544 -4.178 -11.073 1.00 0.00 H new ATOM 0 HB2 PRO A 106 0.495 -5.843 -10.205 1.00 0.00 H new ATOM 0 HB3 PRO A 106 1.223 -6.068 -11.783 1.00 0.00 H new ATOM 0 HG2 PRO A 106 1.779 -7.539 -9.215 1.00 0.00 H new ATOM 0 HG3 PRO A 106 1.607 -8.182 -10.836 1.00 0.00 H new ATOM 0 HD2 PRO A 106 4.055 -7.789 -9.710 1.00 0.00 H new ATOM 0 HD3 PRO A 106 3.804 -7.625 -11.437 1.00 0.00 H new ATOM 1566 N GLU A 107 1.306 -3.396 -9.011 1.00 0.00 N ATOM 1567 CA GLU A 107 0.937 -2.707 -7.780 1.00 0.00 C ATOM 1568 C GLU A 107 -0.009 -3.561 -6.941 1.00 0.00 C ATOM 1569 O GLU A 107 -0.729 -4.409 -7.467 1.00 0.00 O ATOM 1570 CB GLU A 107 0.279 -1.363 -8.100 1.00 0.00 C ATOM 1571 CG GLU A 107 1.148 -0.445 -8.944 1.00 0.00 C ATOM 1572 CD GLU A 107 0.345 0.623 -9.660 1.00 0.00 C ATOM 1573 OE1 GLU A 107 -0.330 0.288 -10.657 1.00 0.00 O ATOM 1574 OE2 GLU A 107 0.390 1.792 -9.225 1.00 0.00 O ATOM 0 H GLU A 107 0.819 -3.063 -9.843 1.00 0.00 H new ATOM 0 HA GLU A 107 1.846 -2.531 -7.205 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -0.660 -1.543 -8.624 1.00 0.00 H new ATOM 0 HB3 GLU A 107 0.031 -0.858 -7.166 1.00 0.00 H new ATOM 0 HG2 GLU A 107 1.892 0.032 -8.306 1.00 0.00 H new ATOM 0 HG3 GLU A 107 1.691 -1.039 -9.679 1.00 0.00 H new ATOM 1581 N SER A 108 0.000 -3.331 -5.632 1.00 0.00 N ATOM 1582 CA SER A 108 -0.853 -4.082 -4.718 1.00 0.00 C ATOM 1583 C SER A 108 -2.225 -3.426 -4.593 1.00 0.00 C ATOM 1584 O SER A 108 -2.508 -2.423 -5.248 1.00 0.00 O ATOM 1585 CB SER A 108 -0.196 -4.182 -3.340 1.00 0.00 C ATOM 1586 OG SER A 108 -0.269 -2.948 -2.648 1.00 0.00 O ATOM 0 H SER A 108 0.588 -2.631 -5.180 1.00 0.00 H new ATOM 0 HA SER A 108 -0.984 -5.085 -5.124 1.00 0.00 H new ATOM 0 HB2 SER A 108 -0.687 -4.960 -2.755 1.00 0.00 H new ATOM 0 HB3 SER A 108 0.847 -4.478 -3.452 1.00 0.00 H new ATOM 0 HG SER A 108 0.631 -2.670 -2.378 1.00 0.00 H new ATOM 1592 N SER A 109 -3.073 -4.001 -3.747 1.00 0.00 N ATOM 1593 CA SER A 109 -4.418 -3.476 -3.538 1.00 0.00 C ATOM 1594 C SER A 109 -4.367 -2.041 -3.023 1.00 0.00 C ATOM 1595 O SER A 109 -3.958 -1.774 -1.892 1.00 0.00 O ATOM 1596 CB SER A 109 -5.184 -4.358 -2.549 1.00 0.00 C ATOM 1597 OG SER A 109 -6.501 -3.874 -2.349 1.00 0.00 O ATOM 0 H SER A 109 -2.853 -4.830 -3.195 1.00 0.00 H new ATOM 0 HA SER A 109 -4.937 -3.481 -4.497 1.00 0.00 H new ATOM 0 HB2 SER A 109 -5.222 -5.381 -2.923 1.00 0.00 H new ATOM 0 HB3 SER A 109 -4.655 -4.386 -1.596 1.00 0.00 H new ATOM 0 HG SER A 109 -6.970 -4.455 -1.715 1.00 0.00 H new ATOM 1603 N PRO A 110 -4.791 -1.093 -3.871 1.00 0.00 N ATOM 1604 CA PRO A 110 -4.805 0.331 -3.525 1.00 0.00 C ATOM 1605 C PRO A 110 -5.858 0.662 -2.474 1.00 0.00 C ATOM 1606 O PRO A 110 -6.997 0.200 -2.554 1.00 0.00 O ATOM 1607 CB PRO A 110 -5.140 1.015 -4.853 1.00 0.00 C ATOM 1608 CG PRO A 110 -5.881 -0.015 -5.634 1.00 0.00 C ATOM 1609 CD PRO A 110 -5.292 -1.340 -5.234 1.00 0.00 C ATOM 0 HA PRO A 110 -3.859 0.654 -3.090 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -5.748 1.906 -4.697 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -4.237 1.332 -5.374 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -6.948 0.021 -5.413 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -5.771 0.154 -6.705 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -6.039 -2.133 -5.250 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -4.491 -1.643 -5.908 1.00 0.00 H new ATOM 1617 N VAL A 111 -5.472 1.466 -1.488 1.00 0.00 N ATOM 1618 CA VAL A 111 -6.384 1.860 -0.421 1.00 0.00 C ATOM 1619 C VAL A 111 -6.739 3.340 -0.520 1.00 0.00 C ATOM 1620 O VAL A 111 -5.859 4.195 -0.623 1.00 0.00 O ATOM 1621 CB VAL A 111 -5.779 1.581 0.967 1.00 0.00 C ATOM 1622 CG1 VAL A 111 -6.690 2.110 2.064 1.00 0.00 C ATOM 1623 CG2 VAL A 111 -5.524 0.092 1.147 1.00 0.00 C ATOM 0 H VAL A 111 -4.534 1.857 -1.406 1.00 0.00 H new ATOM 0 HA VAL A 111 -7.288 1.263 -0.542 1.00 0.00 H new ATOM 0 HB VAL A 111 -4.824 2.102 1.039 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -6.245 1.903 3.037 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -6.817 3.186 1.944 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -7.662 1.620 1.998 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -5.096 -0.087 2.133 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -6.464 -0.452 1.055 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -4.829 -0.253 0.382 1.00 0.00 H new ATOM 1633 N LEU A 112 -8.034 3.635 -0.489 1.00 0.00 N ATOM 1634 CA LEU A 112 -8.506 5.013 -0.575 1.00 0.00 C ATOM 1635 C LEU A 112 -8.610 5.640 0.811 1.00 0.00 C ATOM 1636 O LEU A 112 -9.285 5.112 1.695 1.00 0.00 O ATOM 1637 CB LEU A 112 -9.867 5.063 -1.273 1.00 0.00 C ATOM 1638 CG LEU A 112 -9.973 4.296 -2.592 1.00 0.00 C ATOM 1639 CD1 LEU A 112 -11.413 4.274 -3.081 1.00 0.00 C ATOM 1640 CD2 LEU A 112 -9.061 4.912 -3.642 1.00 0.00 C ATOM 0 H LEU A 112 -8.775 2.939 -0.405 1.00 0.00 H new ATOM 0 HA LEU A 112 -7.783 5.583 -1.158 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -10.619 4.673 -0.587 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -10.118 6.107 -1.461 1.00 0.00 H new ATOM 0 HG LEU A 112 -9.653 3.268 -2.420 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -11.470 3.724 -4.020 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -12.043 3.787 -2.337 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -11.760 5.295 -3.237 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -9.150 4.353 -4.574 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -9.350 5.949 -3.812 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -8.029 4.876 -3.294 1.00 0.00 H new ATOM 1652 N VAL A 113 -7.937 6.772 0.995 1.00 0.00 N ATOM 1653 CA VAL A 113 -7.956 7.474 2.273 1.00 0.00 C ATOM 1654 C VAL A 113 -8.221 8.962 2.078 1.00 0.00 C ATOM 1655 O VAL A 113 -7.579 9.615 1.254 1.00 0.00 O ATOM 1656 CB VAL A 113 -6.627 7.295 3.031 1.00 0.00 C ATOM 1657 CG1 VAL A 113 -6.448 5.847 3.460 1.00 0.00 C ATOM 1658 CG2 VAL A 113 -5.458 7.753 2.172 1.00 0.00 C ATOM 0 H VAL A 113 -7.372 7.222 0.275 1.00 0.00 H new ATOM 0 HA VAL A 113 -8.763 7.038 2.862 1.00 0.00 H new ATOM 0 HB VAL A 113 -6.654 7.914 3.928 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -5.504 5.740 3.994 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -7.270 5.557 4.115 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -6.442 5.205 2.579 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -4.527 7.619 2.723 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -5.426 7.162 1.257 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -5.582 8.806 1.920 1.00 0.00 H new ATOM 1668 N ARG A 114 -9.170 9.494 2.842 1.00 0.00 N ATOM 1669 CA ARG A 114 -9.521 10.906 2.753 1.00 0.00 C ATOM 1670 C ARG A 114 -8.775 11.719 3.808 1.00 0.00 C ATOM 1671 O ARG A 114 -9.089 11.651 4.997 1.00 0.00 O ATOM 1672 CB ARG A 114 -11.029 11.090 2.924 1.00 0.00 C ATOM 1673 CG ARG A 114 -11.451 12.541 3.086 1.00 0.00 C ATOM 1674 CD ARG A 114 -12.902 12.654 3.529 1.00 0.00 C ATOM 1675 NE ARG A 114 -13.030 12.668 4.984 1.00 0.00 N ATOM 1676 CZ ARG A 114 -13.203 11.573 5.717 1.00 0.00 C ATOM 1677 NH1 ARG A 114 -13.267 10.384 5.134 1.00 0.00 N ATOM 1678 NH2 ARG A 114 -13.311 11.667 7.036 1.00 0.00 N ATOM 0 H ARG A 114 -9.709 8.968 3.530 1.00 0.00 H new ATOM 0 HA ARG A 114 -9.228 11.266 1.767 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -11.539 10.667 2.058 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -11.359 10.525 3.796 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -10.807 13.029 3.818 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -11.316 13.068 2.141 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -13.337 13.565 3.118 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -13.471 11.818 3.123 1.00 0.00 H new ATOM 0 HE ARG A 114 -12.984 13.567 5.464 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -13.183 10.308 4.120 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -13.400 9.545 5.699 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -13.261 12.580 7.488 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -13.444 10.826 7.598 1.00 0.00 H new ATOM 1692 N THR A 115 -7.785 12.487 3.365 1.00 0.00 N ATOM 1693 CA THR A 115 -6.994 13.311 4.269 1.00 0.00 C ATOM 1694 C THR A 115 -7.876 14.288 5.037 1.00 0.00 C ATOM 1695 O THR A 115 -8.948 14.672 4.568 1.00 0.00 O ATOM 1696 CB THR A 115 -5.913 14.103 3.508 1.00 0.00 C ATOM 1697 OG1 THR A 115 -6.386 14.444 2.201 1.00 0.00 O ATOM 1698 CG2 THR A 115 -4.630 13.294 3.394 1.00 0.00 C ATOM 0 H THR A 115 -7.512 12.555 2.385 1.00 0.00 H new ATOM 0 HA THR A 115 -6.510 12.633 4.972 1.00 0.00 H new ATOM 0 HB THR A 115 -5.700 15.015 4.066 1.00 0.00 H new ATOM 0 HG1 THR A 115 -5.765 15.076 1.783 1.00 0.00 H new ATOM 0 HG21 THR A 115 -3.882 13.873 2.853 1.00 0.00 H new ATOM 0 HG22 THR A 115 -4.257 13.061 4.391 1.00 0.00 H new ATOM 0 HG23 THR A 115 -4.831 12.368 2.856 1.00 0.00 H new ATOM 1706 N ASP A 116 -7.420 14.687 6.219 1.00 0.00 N ATOM 1707 CA ASP A 116 -8.168 15.621 7.052 1.00 0.00 C ATOM 1708 C ASP A 116 -8.578 16.854 6.253 1.00 0.00 C ATOM 1709 O ASP A 116 -7.908 17.233 5.292 1.00 0.00 O ATOM 1710 CB ASP A 116 -7.334 16.038 8.265 1.00 0.00 C ATOM 1711 CG ASP A 116 -7.477 15.074 9.425 1.00 0.00 C ATOM 1712 OD1 ASP A 116 -8.618 14.875 9.895 1.00 0.00 O ATOM 1713 OD2 ASP A 116 -6.449 14.517 9.864 1.00 0.00 O ATOM 0 H ASP A 116 -6.535 14.378 6.622 1.00 0.00 H new ATOM 0 HA ASP A 116 -9.071 15.117 7.398 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -6.285 16.101 7.976 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -7.637 17.035 8.585 1.00 0.00 H new ATOM 1718 N GLU A 117 -9.682 17.475 6.656 1.00 0.00 N ATOM 1719 CA GLU A 117 -10.181 18.664 5.975 1.00 0.00 C ATOM 1720 C GLU A 117 -9.548 19.928 6.552 1.00 0.00 C ATOM 1721 O GLU A 117 -9.395 20.059 7.767 1.00 0.00 O ATOM 1722 CB GLU A 117 -11.704 18.745 6.092 1.00 0.00 C ATOM 1723 CG GLU A 117 -12.184 19.328 7.411 1.00 0.00 C ATOM 1724 CD GLU A 117 -13.523 18.765 7.845 1.00 0.00 C ATOM 1725 OE1 GLU A 117 -14.553 19.174 7.271 1.00 0.00 O ATOM 1726 OE2 GLU A 117 -13.540 17.915 8.760 1.00 0.00 O ATOM 0 H GLU A 117 -10.248 17.175 7.450 1.00 0.00 H new ATOM 0 HA GLU A 117 -9.908 18.589 4.922 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -12.091 19.353 5.274 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -12.123 17.746 5.973 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -11.442 19.127 8.184 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -12.263 20.411 7.318 1.00 0.00 H new ATOM 1733 N ASP A 118 -9.182 20.854 5.673 1.00 0.00 N ATOM 1734 CA ASP A 118 -8.567 22.107 6.094 1.00 0.00 C ATOM 1735 C ASP A 118 -9.623 23.095 6.580 1.00 0.00 C ATOM 1736 O ASP A 118 -9.552 23.593 7.703 1.00 0.00 O ATOM 1737 CB ASP A 118 -7.769 22.720 4.942 1.00 0.00 C ATOM 1738 CG ASP A 118 -7.080 24.011 5.338 1.00 0.00 C ATOM 1739 OD1 ASP A 118 -7.708 25.083 5.203 1.00 0.00 O ATOM 1740 OD2 ASP A 118 -5.914 23.951 5.781 1.00 0.00 O ATOM 0 H ASP A 118 -9.301 20.761 4.664 1.00 0.00 H new ATOM 0 HA ASP A 118 -7.890 21.891 6.921 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -7.023 22.003 4.599 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -8.437 22.911 4.102 1.00 0.00 H new ATOM 1745 N VAL A 119 -10.602 23.375 5.725 1.00 0.00 N ATOM 1746 CA VAL A 119 -11.673 24.304 6.067 1.00 0.00 C ATOM 1747 C VAL A 119 -12.553 23.742 7.178 1.00 0.00 C ATOM 1748 O VAL A 119 -12.766 22.535 7.284 1.00 0.00 O ATOM 1749 CB VAL A 119 -12.551 24.622 4.842 1.00 0.00 C ATOM 1750 CG1 VAL A 119 -11.724 25.278 3.747 1.00 0.00 C ATOM 1751 CG2 VAL A 119 -13.226 23.359 4.328 1.00 0.00 C ATOM 0 H VAL A 119 -10.675 22.972 4.791 1.00 0.00 H new ATOM 0 HA VAL A 119 -11.199 25.222 6.413 1.00 0.00 H new ATOM 0 HB VAL A 119 -13.328 25.324 5.146 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -12.362 25.495 2.890 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -11.293 26.206 4.123 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -10.924 24.604 3.442 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -13.842 23.602 3.462 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -12.467 22.632 4.040 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -13.853 22.937 5.113 1.00 0.00 H new ATOM 1761 N PRO A 120 -13.077 24.639 8.027 1.00 0.00 N ATOM 1762 CA PRO A 120 -13.944 24.257 9.145 1.00 0.00 C ATOM 1763 C PRO A 120 -15.306 23.756 8.678 1.00 0.00 C ATOM 1764 O PRO A 120 -16.177 23.448 9.492 1.00 0.00 O ATOM 1765 CB PRO A 120 -14.095 25.558 9.938 1.00 0.00 C ATOM 1766 CG PRO A 120 -13.869 26.638 8.938 1.00 0.00 C ATOM 1767 CD PRO A 120 -12.864 26.094 7.960 1.00 0.00 C ATOM 0 HA PRO A 120 -13.523 23.435 9.724 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -15.085 25.635 10.387 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -13.371 25.613 10.751 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -14.798 26.904 8.435 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -13.496 27.543 9.418 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -13.033 26.479 6.954 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -11.845 26.364 8.238 1.00 0.00 H new ATOM 1775 N SER A 121 -15.483 23.676 7.363 1.00 0.00 N ATOM 1776 CA SER A 121 -16.742 23.216 6.788 1.00 0.00 C ATOM 1777 C SER A 121 -17.178 21.898 7.420 1.00 0.00 C ATOM 1778 O SER A 121 -16.347 21.082 7.818 1.00 0.00 O ATOM 1779 CB SER A 121 -16.603 23.048 5.274 1.00 0.00 C ATOM 1780 OG SER A 121 -16.062 21.779 4.949 1.00 0.00 O ATOM 0 H SER A 121 -14.771 23.924 6.676 1.00 0.00 H new ATOM 0 HA SER A 121 -17.504 23.967 6.995 1.00 0.00 H new ATOM 0 HB2 SER A 121 -17.578 23.163 4.801 1.00 0.00 H new ATOM 0 HB3 SER A 121 -15.961 23.833 4.875 1.00 0.00 H new ATOM 0 HG SER A 121 -16.132 21.631 3.983 1.00 0.00 H new ATOM 1786 N GLY A 122 -18.489 21.696 7.509 1.00 0.00 N ATOM 1787 CA GLY A 122 -19.014 20.476 8.094 1.00 0.00 C ATOM 1788 C GLY A 122 -19.695 19.589 7.070 1.00 0.00 C ATOM 1789 O GLY A 122 -20.397 20.063 6.176 1.00 0.00 O ATOM 0 H GLY A 122 -19.197 22.356 7.186 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -18.201 19.924 8.566 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -19.725 20.730 8.880 1.00 0.00 H new ATOM 1793 N PRO A 123 -19.488 18.270 7.193 1.00 0.00 N ATOM 1794 CA PRO A 123 -20.077 17.287 6.279 1.00 0.00 C ATOM 1795 C PRO A 123 -21.587 17.165 6.454 1.00 0.00 C ATOM 1796 O PRO A 123 -22.126 17.347 7.546 1.00 0.00 O ATOM 1797 CB PRO A 123 -19.386 15.979 6.671 1.00 0.00 C ATOM 1798 CG PRO A 123 -18.984 16.174 8.092 1.00 0.00 C ATOM 1799 CD PRO A 123 -18.662 17.636 8.235 1.00 0.00 C ATOM 0 HA PRO A 123 -19.933 17.564 5.235 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -20.059 15.128 6.563 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -18.520 15.783 6.038 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -19.788 15.884 8.768 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -18.120 15.558 8.341 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -18.913 18.008 9.228 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -17.601 17.831 8.081 1.00 0.00 H new ATOM 1807 N PRO A 124 -22.287 16.850 5.355 1.00 0.00 N ATOM 1808 CA PRO A 124 -23.745 16.696 5.362 1.00 0.00 C ATOM 1809 C PRO A 124 -24.193 15.452 6.123 1.00 0.00 C ATOM 1810 O PRO A 124 -23.741 14.343 5.838 1.00 0.00 O ATOM 1811 CB PRO A 124 -24.096 16.570 3.878 1.00 0.00 C ATOM 1812 CG PRO A 124 -22.858 16.041 3.239 1.00 0.00 C ATOM 1813 CD PRO A 124 -21.710 16.620 4.020 1.00 0.00 C ATOM 0 HA PRO A 124 -24.240 17.529 5.862 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -24.939 15.896 3.726 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -24.379 17.534 3.455 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -22.839 14.952 3.267 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -22.804 16.334 2.190 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -20.865 15.933 4.061 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -21.347 17.546 3.574 1.00 0.00 H new ATOM 1821 N ARG A 125 -25.083 15.645 7.090 1.00 0.00 N ATOM 1822 CA ARG A 125 -25.591 14.538 7.892 1.00 0.00 C ATOM 1823 C ARG A 125 -27.114 14.472 7.826 1.00 0.00 C ATOM 1824 O ARG A 125 -27.809 15.131 8.599 1.00 0.00 O ATOM 1825 CB ARG A 125 -25.139 14.685 9.347 1.00 0.00 C ATOM 1826 CG ARG A 125 -25.775 13.674 10.287 1.00 0.00 C ATOM 1827 CD ARG A 125 -24.902 13.422 11.506 1.00 0.00 C ATOM 1828 NE ARG A 125 -24.657 14.645 12.266 1.00 0.00 N ATOM 1829 CZ ARG A 125 -23.758 14.737 13.240 1.00 0.00 C ATOM 1830 NH1 ARG A 125 -23.024 13.684 13.571 1.00 0.00 N ATOM 1831 NH2 ARG A 125 -23.593 15.885 13.885 1.00 0.00 N ATOM 0 H ARG A 125 -25.467 16.557 7.337 1.00 0.00 H new ATOM 0 HA ARG A 125 -25.187 13.612 7.484 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -24.055 14.581 9.394 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -25.378 15.691 9.693 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -26.752 14.037 10.606 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -25.941 12.736 9.757 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -25.382 12.685 12.150 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -23.950 12.996 11.189 1.00 0.00 H new ATOM 0 HE ARG A 125 -25.206 15.474 12.037 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -23.149 12.800 13.078 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -22.335 13.758 14.319 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -24.156 16.697 13.633 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -22.903 15.955 14.633 1.00 0.00 H new ATOM 1845 N LYS A 126 -27.626 13.673 6.896 1.00 0.00 N ATOM 1846 CA LYS A 126 -29.067 13.520 6.728 1.00 0.00 C ATOM 1847 C LYS A 126 -29.574 12.289 7.473 1.00 0.00 C ATOM 1848 O LYS A 126 -28.936 11.236 7.458 1.00 0.00 O ATOM 1849 CB LYS A 126 -29.418 13.411 5.242 1.00 0.00 C ATOM 1850 CG LYS A 126 -28.766 12.228 4.548 1.00 0.00 C ATOM 1851 CD LYS A 126 -29.643 10.989 4.617 1.00 0.00 C ATOM 1852 CE LYS A 126 -30.699 10.992 3.522 1.00 0.00 C ATOM 1853 NZ LYS A 126 -31.951 11.668 3.960 1.00 0.00 N ATOM 0 H LYS A 126 -27.065 13.121 6.247 1.00 0.00 H new ATOM 0 HA LYS A 126 -29.553 14.401 7.147 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -30.500 13.331 5.138 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -29.116 14.329 4.738 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -28.571 12.479 3.505 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -27.802 12.019 5.012 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -29.023 10.097 4.524 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -30.128 10.939 5.592 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -30.305 11.495 2.639 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -30.923 9.966 3.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -32.769 11.211 3.508 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -32.042 11.595 4.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -31.919 12.671 3.685 1.00 0.00 H new ATOM 1867 N VAL A 127 -30.725 12.429 8.123 1.00 0.00 N ATOM 1868 CA VAL A 127 -31.318 11.328 8.872 1.00 0.00 C ATOM 1869 C VAL A 127 -31.453 10.082 8.003 1.00 0.00 C ATOM 1870 O VAL A 127 -32.290 10.029 7.103 1.00 0.00 O ATOM 1871 CB VAL A 127 -32.705 11.708 9.423 1.00 0.00 C ATOM 1872 CG1 VAL A 127 -33.621 12.165 8.298 1.00 0.00 C ATOM 1873 CG2 VAL A 127 -33.317 10.537 10.177 1.00 0.00 C ATOM 0 H VAL A 127 -31.265 13.294 8.146 1.00 0.00 H new ATOM 0 HA VAL A 127 -30.649 11.115 9.706 1.00 0.00 H new ATOM 0 HB VAL A 127 -32.585 12.537 10.120 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -34.596 12.429 8.707 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -33.186 13.035 7.806 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -33.738 11.359 7.574 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -34.297 10.823 10.560 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -33.424 9.687 9.503 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -32.669 10.261 11.009 1.00 0.00 H new ATOM 1883 N GLU A 128 -30.622 9.082 8.280 1.00 0.00 N ATOM 1884 CA GLU A 128 -30.648 7.836 7.522 1.00 0.00 C ATOM 1885 C GLU A 128 -30.442 6.636 8.442 1.00 0.00 C ATOM 1886 O GLU A 128 -29.622 6.678 9.360 1.00 0.00 O ATOM 1887 CB GLU A 128 -29.571 7.851 6.435 1.00 0.00 C ATOM 1888 CG GLU A 128 -29.643 6.663 5.491 1.00 0.00 C ATOM 1889 CD GLU A 128 -28.350 6.444 4.730 1.00 0.00 C ATOM 1890 OE1 GLU A 128 -27.443 5.785 5.280 1.00 0.00 O ATOM 1891 OE2 GLU A 128 -28.244 6.932 3.585 1.00 0.00 O ATOM 0 H GLU A 128 -29.923 9.110 9.023 1.00 0.00 H new ATOM 0 HA GLU A 128 -31.627 7.747 7.051 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -29.663 8.770 5.856 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -28.589 7.869 6.908 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -29.882 5.765 6.061 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -30.456 6.816 4.782 1.00 0.00 H new ATOM 1898 N SER A 129 -31.191 5.568 8.189 1.00 0.00 N ATOM 1899 CA SER A 129 -31.094 4.358 8.996 1.00 0.00 C ATOM 1900 C SER A 129 -29.651 3.869 9.071 1.00 0.00 C ATOM 1901 O SER A 129 -28.904 3.953 8.098 1.00 0.00 O ATOM 1902 CB SER A 129 -31.987 3.259 8.414 1.00 0.00 C ATOM 1903 OG SER A 129 -32.427 2.371 9.427 1.00 0.00 O ATOM 0 H SER A 129 -31.872 5.516 7.431 1.00 0.00 H new ATOM 0 HA SER A 129 -31.432 4.596 10.005 1.00 0.00 H new ATOM 0 HB2 SER A 129 -32.849 3.709 7.921 1.00 0.00 H new ATOM 0 HB3 SER A 129 -31.438 2.705 7.653 1.00 0.00 H new ATOM 0 HG SER A 129 -32.997 1.679 9.031 1.00 0.00 H new ATOM 1909 N GLY A 130 -29.266 3.358 10.237 1.00 0.00 N ATOM 1910 CA GLY A 130 -27.914 2.863 10.419 1.00 0.00 C ATOM 1911 C GLY A 130 -27.882 1.474 11.025 1.00 0.00 C ATOM 1912 O GLY A 130 -27.418 1.274 12.148 1.00 0.00 O ATOM 0 H GLY A 130 -29.866 3.278 11.058 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -27.403 2.848 9.456 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -27.363 3.549 11.062 1.00 0.00 H new ATOM 1916 N PRO A 131 -28.385 0.485 10.273 1.00 0.00 N ATOM 1917 CA PRO A 131 -28.424 -0.910 10.723 1.00 0.00 C ATOM 1918 C PRO A 131 -27.036 -1.536 10.792 1.00 0.00 C ATOM 1919 O PRO A 131 -26.076 -1.003 10.236 1.00 0.00 O ATOM 1920 CB PRO A 131 -29.272 -1.604 9.654 1.00 0.00 C ATOM 1921 CG PRO A 131 -29.107 -0.763 8.435 1.00 0.00 C ATOM 1922 CD PRO A 131 -28.954 0.651 8.925 1.00 0.00 C ATOM 0 HA PRO A 131 -28.827 -1.002 11.732 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -28.932 -2.625 9.480 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -30.318 -1.664 9.955 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -28.234 -1.074 7.862 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -29.971 -0.857 7.776 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -28.295 1.231 8.279 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -29.911 1.172 8.954 1.00 0.00 H new ATOM 1930 N SER A 132 -26.937 -2.671 11.477 1.00 0.00 N ATOM 1931 CA SER A 132 -25.664 -3.369 11.620 1.00 0.00 C ATOM 1932 C SER A 132 -25.879 -4.793 12.122 1.00 0.00 C ATOM 1933 O SER A 132 -26.929 -5.116 12.678 1.00 0.00 O ATOM 1934 CB SER A 132 -24.748 -2.609 12.583 1.00 0.00 C ATOM 1935 OG SER A 132 -25.377 -2.413 13.837 1.00 0.00 O ATOM 0 H SER A 132 -27.722 -3.127 11.941 1.00 0.00 H new ATOM 0 HA SER A 132 -25.191 -3.416 10.639 1.00 0.00 H new ATOM 0 HB2 SER A 132 -23.820 -3.164 12.721 1.00 0.00 H new ATOM 0 HB3 SER A 132 -24.482 -1.644 12.151 1.00 0.00 H new ATOM 0 HG SER A 132 -24.771 -1.927 14.435 1.00 0.00 H new ATOM 1941 N SER A 133 -24.876 -5.642 11.922 1.00 0.00 N ATOM 1942 CA SER A 133 -24.955 -7.034 12.351 1.00 0.00 C ATOM 1943 C SER A 133 -24.212 -7.240 13.667 1.00 0.00 C ATOM 1944 O SER A 133 -23.139 -6.678 13.882 1.00 0.00 O ATOM 1945 CB SER A 133 -24.376 -7.954 11.275 1.00 0.00 C ATOM 1946 OG SER A 133 -25.030 -7.762 10.033 1.00 0.00 O ATOM 0 H SER A 133 -23.999 -5.391 11.466 1.00 0.00 H new ATOM 0 HA SER A 133 -26.005 -7.283 12.505 1.00 0.00 H new ATOM 0 HB2 SER A 133 -23.309 -7.760 11.162 1.00 0.00 H new ATOM 0 HB3 SER A 133 -24.479 -8.993 11.587 1.00 0.00 H new ATOM 0 HG SER A 133 -24.640 -8.361 9.362 1.00 0.00 H new ATOM 1952 N GLY A 134 -24.792 -8.052 14.546 1.00 0.00 N ATOM 1953 CA GLY A 134 -24.172 -8.319 15.830 1.00 0.00 C ATOM 1954 C GLY A 134 -24.451 -9.724 16.328 1.00 0.00 C ATOM 1955 O GLY A 134 -23.691 -10.268 17.129 1.00 0.00 O ATOM 0 H GLY A 134 -25.680 -8.529 14.391 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -23.095 -8.173 15.747 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -24.536 -7.598 16.562 1.00 0.00 H new TER 1959 GLY A 134