USER MOD reduce.3.24.130724 H: found=0, std=0, add=687, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 687 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 Single : A 1 GLY N :NH3+ 129:sc= 0.0112 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc=-0.00359 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0.0202 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0.0873 USER MOD Single : A 12 GLN : amide:sc= 1.62 K(o=1.6,f=-1.7!) USER MOD Single : A 24 SER OG : rot 68:sc= 0.573 USER MOD Single : A 28 SER OG : rot 72:sc= 1.21 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 44 GLN : amide:sc= -0.486 X(o=-0.49,f=-0.83) USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 GLN : amide:sc= 0.0559 K(o=0.056,f=-3.1!) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ -174:sc= 1.09 (180deg=1.03) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 GLN : amide:sc= 1.18 K(o=1.2,f=-0.062) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 4.188 -3.692 -10.860 1.00 0.00 N ATOM 2 CA GLY A 1 4.928 -3.787 -9.579 1.00 0.00 C ATOM 3 C GLY A 1 5.169 -2.419 -8.953 1.00 0.00 C ATOM 4 O GLY A 1 5.383 -1.434 -9.661 1.00 0.00 O ATOM 0 H1 GLY A 1 4.694 -4.228 -11.594 1.00 0.00 H new ATOM 0 H2 GLY A 1 3.233 -4.087 -10.740 1.00 0.00 H new ATOM 0 H3 GLY A 1 4.116 -2.695 -11.146 1.00 0.00 H new ATOM 0 HA2 GLY A 1 4.367 -4.410 -8.882 1.00 0.00 H new ATOM 0 HA3 GLY A 1 5.885 -4.281 -9.749 1.00 0.00 H new ATOM 10 N SER A 2 5.158 -2.348 -7.617 1.00 0.00 N ATOM 11 CA SER A 2 5.308 -1.118 -6.809 1.00 0.00 C ATOM 12 C SER A 2 6.735 -0.891 -6.265 1.00 0.00 C ATOM 13 O SER A 2 6.943 -0.116 -5.327 1.00 0.00 O ATOM 14 CB SER A 2 4.257 -1.118 -5.688 1.00 0.00 C ATOM 15 OG SER A 2 4.378 -2.279 -4.877 1.00 0.00 O ATOM 0 H SER A 2 5.039 -3.179 -7.038 1.00 0.00 H new ATOM 0 HA SER A 2 5.136 -0.270 -7.472 1.00 0.00 H new ATOM 0 HB2 SER A 2 4.376 -0.226 -5.073 1.00 0.00 H new ATOM 0 HB3 SER A 2 3.258 -1.075 -6.121 1.00 0.00 H new ATOM 0 HG SER A 2 3.700 -2.256 -4.170 1.00 0.00 H new ATOM 21 N GLU A 3 7.732 -1.562 -6.848 1.00 0.00 N ATOM 22 CA GLU A 3 9.161 -1.455 -6.513 1.00 0.00 C ATOM 23 C GLU A 3 10.044 -1.798 -7.732 1.00 0.00 C ATOM 24 O GLU A 3 9.556 -2.340 -8.731 1.00 0.00 O ATOM 25 CB GLU A 3 9.501 -2.349 -5.301 1.00 0.00 C ATOM 26 CG GLU A 3 9.321 -3.854 -5.548 1.00 0.00 C ATOM 27 CD GLU A 3 9.654 -4.655 -4.276 1.00 0.00 C ATOM 28 OE1 GLU A 3 10.842 -5.006 -4.066 1.00 0.00 O ATOM 29 OE2 GLU A 3 8.732 -4.949 -3.475 1.00 0.00 O ATOM 0 H GLU A 3 7.560 -2.227 -7.602 1.00 0.00 H new ATOM 0 HA GLU A 3 9.372 -0.422 -6.238 1.00 0.00 H new ATOM 0 HB2 GLU A 3 10.534 -2.163 -5.007 1.00 0.00 H new ATOM 0 HB3 GLU A 3 8.873 -2.054 -4.461 1.00 0.00 H new ATOM 0 HG2 GLU A 3 8.295 -4.058 -5.854 1.00 0.00 H new ATOM 0 HG3 GLU A 3 9.967 -4.174 -6.365 1.00 0.00 H new ATOM 36 N THR A 4 11.344 -1.501 -7.652 1.00 0.00 N ATOM 37 CA THR A 4 12.322 -1.756 -8.729 1.00 0.00 C ATOM 38 C THR A 4 13.176 -2.992 -8.412 1.00 0.00 C ATOM 39 O THR A 4 13.725 -3.107 -7.313 1.00 0.00 O ATOM 40 CB THR A 4 13.210 -0.522 -8.990 1.00 0.00 C ATOM 41 OG1 THR A 4 12.412 0.638 -9.136 1.00 0.00 O ATOM 42 CG2 THR A 4 14.019 -0.644 -10.284 1.00 0.00 C ATOM 0 H THR A 4 11.759 -1.069 -6.826 1.00 0.00 H new ATOM 0 HA THR A 4 11.762 -1.956 -9.643 1.00 0.00 H new ATOM 0 HB THR A 4 13.881 -0.456 -8.134 1.00 0.00 H new ATOM 0 HG1 THR A 4 12.989 1.413 -9.299 1.00 0.00 H new ATOM 0 HG21 THR A 4 14.626 0.251 -10.419 1.00 0.00 H new ATOM 0 HG22 THR A 4 14.668 -1.518 -10.226 1.00 0.00 H new ATOM 0 HG23 THR A 4 13.339 -0.752 -11.129 1.00 0.00 H new ATOM 50 N ARG A 5 13.300 -3.918 -9.379 1.00 0.00 N ATOM 51 CA ARG A 5 14.064 -5.182 -9.246 1.00 0.00 C ATOM 52 C ARG A 5 15.538 -4.985 -8.857 1.00 0.00 C ATOM 53 O ARG A 5 16.099 -5.807 -8.130 1.00 0.00 O ATOM 54 CB ARG A 5 13.978 -5.980 -10.562 1.00 0.00 C ATOM 55 CG ARG A 5 12.554 -6.466 -10.880 1.00 0.00 C ATOM 56 CD ARG A 5 12.538 -7.262 -12.190 1.00 0.00 C ATOM 57 NE ARG A 5 11.175 -7.722 -12.526 1.00 0.00 N ATOM 58 CZ ARG A 5 10.817 -8.405 -13.600 1.00 0.00 C ATOM 59 NH1 ARG A 5 11.679 -8.767 -14.510 1.00 0.00 N ATOM 60 NH2 ARG A 5 9.572 -8.744 -13.781 1.00 0.00 N ATOM 0 H ARG A 5 12.865 -3.811 -10.295 1.00 0.00 H new ATOM 0 HA ARG A 5 13.603 -5.732 -8.426 1.00 0.00 H new ATOM 0 HB2 ARG A 5 14.334 -5.357 -11.382 1.00 0.00 H new ATOM 0 HB3 ARG A 5 14.645 -6.840 -10.503 1.00 0.00 H new ATOM 0 HG2 ARG A 5 12.185 -7.089 -10.065 1.00 0.00 H new ATOM 0 HG3 ARG A 5 11.881 -5.612 -10.958 1.00 0.00 H new ATOM 0 HD2 ARG A 5 12.924 -6.642 -12.999 1.00 0.00 H new ATOM 0 HD3 ARG A 5 13.202 -8.122 -12.103 1.00 0.00 H new ATOM 0 HE ARG A 5 10.436 -7.489 -11.863 1.00 0.00 H new ATOM 0 HH11 ARG A 5 12.664 -8.524 -14.405 1.00 0.00 H new ATOM 0 HH12 ARG A 5 11.368 -9.293 -15.326 1.00 0.00 H new ATOM 0 HH21 ARG A 5 8.867 -8.482 -13.092 1.00 0.00 H new ATOM 0 HH22 ARG A 5 9.303 -9.271 -14.612 1.00 0.00 H new ATOM 74 N THR A 6 16.146 -3.890 -9.319 1.00 0.00 N ATOM 75 CA THR A 6 17.492 -3.418 -8.937 1.00 0.00 C ATOM 76 C THR A 6 17.436 -2.089 -8.160 1.00 0.00 C ATOM 77 O THR A 6 16.368 -1.493 -7.997 1.00 0.00 O ATOM 78 CB THR A 6 18.404 -3.365 -10.179 1.00 0.00 C ATOM 79 OG1 THR A 6 19.751 -3.228 -9.787 1.00 0.00 O ATOM 80 CG2 THR A 6 18.075 -2.226 -11.148 1.00 0.00 C ATOM 0 H THR A 6 15.699 -3.276 -10.000 1.00 0.00 H new ATOM 0 HA THR A 6 17.934 -4.133 -8.243 1.00 0.00 H new ATOM 0 HB THR A 6 18.230 -4.304 -10.704 1.00 0.00 H new ATOM 0 HG1 THR A 6 20.322 -3.197 -10.583 1.00 0.00 H new ATOM 0 HG21 THR A 6 18.761 -2.258 -11.994 1.00 0.00 H new ATOM 0 HG22 THR A 6 17.052 -2.337 -11.506 1.00 0.00 H new ATOM 0 HG23 THR A 6 18.177 -1.270 -10.634 1.00 0.00 H new ATOM 88 N ILE A 7 18.585 -1.605 -7.679 1.00 0.00 N ATOM 89 CA ILE A 7 18.751 -0.314 -6.985 1.00 0.00 C ATOM 90 C ILE A 7 19.685 0.556 -7.836 1.00 0.00 C ATOM 91 O ILE A 7 20.701 0.066 -8.334 1.00 0.00 O ATOM 92 CB ILE A 7 19.295 -0.509 -5.550 1.00 0.00 C ATOM 93 CG1 ILE A 7 18.406 -1.494 -4.751 1.00 0.00 C ATOM 94 CG2 ILE A 7 19.401 0.848 -4.823 1.00 0.00 C ATOM 95 CD1 ILE A 7 18.893 -1.777 -3.326 1.00 0.00 C ATOM 0 H ILE A 7 19.462 -2.118 -7.763 1.00 0.00 H new ATOM 0 HA ILE A 7 17.786 0.180 -6.874 1.00 0.00 H new ATOM 0 HB ILE A 7 20.294 -0.940 -5.619 1.00 0.00 H new ATOM 0 HG12 ILE A 7 17.394 -1.092 -4.702 1.00 0.00 H new ATOM 0 HG13 ILE A 7 18.349 -2.436 -5.296 1.00 0.00 H new ATOM 0 HG21 ILE A 7 19.785 0.692 -3.815 1.00 0.00 H new ATOM 0 HG22 ILE A 7 20.078 1.503 -5.372 1.00 0.00 H new ATOM 0 HG23 ILE A 7 18.415 1.309 -4.768 1.00 0.00 H new ATOM 0 HD11 ILE A 7 18.212 -2.476 -2.841 1.00 0.00 H new ATOM 0 HD12 ILE A 7 19.892 -2.211 -3.362 1.00 0.00 H new ATOM 0 HD13 ILE A 7 18.922 -0.846 -2.760 1.00 0.00 H new ATOM 107 N SER A 8 19.372 1.845 -8.014 1.00 0.00 N ATOM 108 CA SER A 8 20.055 2.736 -8.972 1.00 0.00 C ATOM 109 C SER A 8 21.312 3.433 -8.451 1.00 0.00 C ATOM 110 O SER A 8 21.675 4.526 -8.894 1.00 0.00 O ATOM 111 CB SER A 8 19.043 3.709 -9.595 1.00 0.00 C ATOM 112 OG SER A 8 18.382 4.449 -8.579 1.00 0.00 O ATOM 0 H SER A 8 18.628 2.309 -7.492 1.00 0.00 H new ATOM 0 HA SER A 8 20.455 2.088 -9.752 1.00 0.00 H new ATOM 0 HB2 SER A 8 19.554 4.389 -10.276 1.00 0.00 H new ATOM 0 HB3 SER A 8 18.312 3.156 -10.186 1.00 0.00 H new ATOM 0 HG SER A 8 17.741 5.067 -8.989 1.00 0.00 H new ATOM 118 N SER A 9 22.009 2.772 -7.529 1.00 0.00 N ATOM 119 CA SER A 9 23.291 3.145 -6.903 1.00 0.00 C ATOM 120 C SER A 9 24.500 3.095 -7.861 1.00 0.00 C ATOM 121 O SER A 9 25.560 2.526 -7.590 1.00 0.00 O ATOM 122 CB SER A 9 23.505 2.332 -5.621 1.00 0.00 C ATOM 123 OG SER A 9 23.286 0.945 -5.832 1.00 0.00 O ATOM 0 H SER A 9 21.667 1.883 -7.164 1.00 0.00 H new ATOM 0 HA SER A 9 23.222 4.199 -6.633 1.00 0.00 H new ATOM 0 HB2 SER A 9 24.521 2.488 -5.257 1.00 0.00 H new ATOM 0 HB3 SER A 9 22.829 2.693 -4.845 1.00 0.00 H new ATOM 0 HG SER A 9 23.433 0.459 -4.994 1.00 0.00 H new ATOM 129 N THR A 10 24.315 3.768 -8.991 1.00 0.00 N ATOM 130 CA THR A 10 25.270 4.123 -10.042 1.00 0.00 C ATOM 131 C THR A 10 24.968 5.574 -10.435 1.00 0.00 C ATOM 132 O THR A 10 25.713 6.475 -10.062 1.00 0.00 O ATOM 133 CB THR A 10 25.175 3.175 -11.252 1.00 0.00 C ATOM 134 OG1 THR A 10 23.832 3.007 -11.670 1.00 0.00 O ATOM 135 CG2 THR A 10 25.729 1.785 -10.946 1.00 0.00 C ATOM 0 H THR A 10 23.386 4.120 -9.222 1.00 0.00 H new ATOM 0 HA THR A 10 26.293 4.024 -9.678 1.00 0.00 H new ATOM 0 HB THR A 10 25.769 3.644 -12.036 1.00 0.00 H new ATOM 0 HG1 THR A 10 23.802 2.402 -12.440 1.00 0.00 H new ATOM 0 HG21 THR A 10 25.639 1.155 -11.831 1.00 0.00 H new ATOM 0 HG22 THR A 10 26.779 1.866 -10.663 1.00 0.00 H new ATOM 0 HG23 THR A 10 25.165 1.341 -10.125 1.00 0.00 H new ATOM 143 N ALA A 11 23.795 5.827 -11.031 1.00 0.00 N ATOM 144 CA ALA A 11 23.289 7.159 -11.382 1.00 0.00 C ATOM 145 C ALA A 11 22.870 7.989 -10.152 1.00 0.00 C ATOM 146 O ALA A 11 23.280 9.141 -10.015 1.00 0.00 O ATOM 147 CB ALA A 11 22.123 6.977 -12.364 1.00 0.00 C ATOM 0 H ALA A 11 23.149 5.081 -11.291 1.00 0.00 H new ATOM 0 HA ALA A 11 24.093 7.730 -11.847 1.00 0.00 H new ATOM 0 HB1 ALA A 11 21.726 7.953 -12.643 1.00 0.00 H new ATOM 0 HB2 ALA A 11 22.476 6.461 -13.257 1.00 0.00 H new ATOM 0 HB3 ALA A 11 21.337 6.388 -11.891 1.00 0.00 H new ATOM 153 N GLN A 12 22.115 7.395 -9.218 1.00 0.00 N ATOM 154 CA GLN A 12 21.731 8.036 -7.949 1.00 0.00 C ATOM 155 C GLN A 12 22.918 8.103 -6.960 1.00 0.00 C ATOM 156 O GLN A 12 22.925 8.934 -6.055 1.00 0.00 O ATOM 157 CB GLN A 12 20.485 7.311 -7.400 1.00 0.00 C ATOM 158 CG GLN A 12 19.874 7.842 -6.090 1.00 0.00 C ATOM 159 CD GLN A 12 19.528 9.331 -6.074 1.00 0.00 C ATOM 160 OE1 GLN A 12 18.433 9.765 -6.406 1.00 0.00 O ATOM 161 NE2 GLN A 12 20.447 10.166 -5.650 1.00 0.00 N ATOM 0 H GLN A 12 21.750 6.448 -9.321 1.00 0.00 H new ATOM 0 HA GLN A 12 21.464 9.080 -8.111 1.00 0.00 H new ATOM 0 HB2 GLN A 12 19.712 7.341 -8.168 1.00 0.00 H new ATOM 0 HB3 GLN A 12 20.744 6.263 -7.250 1.00 0.00 H new ATOM 0 HG2 GLN A 12 18.967 7.275 -5.878 1.00 0.00 H new ATOM 0 HG3 GLN A 12 20.573 7.642 -5.278 1.00 0.00 H new ATOM 0 HE21 GLN A 12 21.364 9.817 -5.370 1.00 0.00 H new ATOM 0 HE22 GLN A 12 20.245 11.165 -5.600 1.00 0.00 H new ATOM 170 N GLU A 13 23.962 7.287 -7.149 1.00 0.00 N ATOM 171 CA GLU A 13 25.208 7.382 -6.370 1.00 0.00 C ATOM 172 C GLU A 13 26.107 8.538 -6.850 1.00 0.00 C ATOM 173 O GLU A 13 26.540 9.356 -6.043 1.00 0.00 O ATOM 174 CB GLU A 13 25.924 6.022 -6.416 1.00 0.00 C ATOM 175 CG GLU A 13 27.083 5.886 -5.421 1.00 0.00 C ATOM 176 CD GLU A 13 26.577 5.766 -3.971 1.00 0.00 C ATOM 177 OE1 GLU A 13 26.139 4.660 -3.570 1.00 0.00 O ATOM 178 OE2 GLU A 13 26.610 6.774 -3.223 1.00 0.00 O ATOM 0 H GLU A 13 23.969 6.542 -7.845 1.00 0.00 H new ATOM 0 HA GLU A 13 24.967 7.619 -5.334 1.00 0.00 H new ATOM 0 HB2 GLU A 13 25.197 5.235 -6.219 1.00 0.00 H new ATOM 0 HB3 GLU A 13 26.305 5.859 -7.424 1.00 0.00 H new ATOM 0 HG2 GLU A 13 27.678 5.008 -5.673 1.00 0.00 H new ATOM 0 HG3 GLU A 13 27.740 6.751 -5.507 1.00 0.00 H new ATOM 185 N ARG A 14 26.363 8.656 -8.163 1.00 0.00 N ATOM 186 CA ARG A 14 27.312 9.660 -8.697 1.00 0.00 C ATOM 187 C ARG A 14 26.887 11.097 -8.396 1.00 0.00 C ATOM 188 O ARG A 14 27.740 11.898 -8.019 1.00 0.00 O ATOM 189 CB ARG A 14 27.653 9.457 -10.186 1.00 0.00 C ATOM 190 CG ARG A 14 26.474 9.522 -11.173 1.00 0.00 C ATOM 191 CD ARG A 14 26.815 10.273 -12.465 1.00 0.00 C ATOM 192 NE ARG A 14 26.555 11.715 -12.315 1.00 0.00 N ATOM 193 CZ ARG A 14 25.504 12.391 -12.731 1.00 0.00 C ATOM 194 NH1 ARG A 14 24.476 11.852 -13.318 1.00 0.00 N ATOM 195 NH2 ARG A 14 25.432 13.657 -12.523 1.00 0.00 N ATOM 0 H ARG A 14 25.929 8.072 -8.878 1.00 0.00 H new ATOM 0 HA ARG A 14 28.240 9.486 -8.153 1.00 0.00 H new ATOM 0 HB2 ARG A 14 28.383 10.213 -10.475 1.00 0.00 H new ATOM 0 HB3 ARG A 14 28.138 8.487 -10.296 1.00 0.00 H new ATOM 0 HG2 ARG A 14 26.159 8.508 -11.421 1.00 0.00 H new ATOM 0 HG3 ARG A 14 25.628 10.010 -10.688 1.00 0.00 H new ATOM 0 HD2 ARG A 14 27.863 10.112 -12.719 1.00 0.00 H new ATOM 0 HD3 ARG A 14 26.223 9.876 -13.289 1.00 0.00 H new ATOM 0 HE ARG A 14 27.274 12.254 -11.832 1.00 0.00 H new ATOM 0 HH11 ARG A 14 24.452 10.845 -13.481 1.00 0.00 H new ATOM 0 HH12 ARG A 14 23.694 12.436 -13.615 1.00 0.00 H new ATOM 0 HH21 ARG A 14 26.188 14.138 -12.036 1.00 0.00 H new ATOM 0 HH22 ARG A 14 24.618 14.181 -12.845 1.00 0.00 H new ATOM 209 N VAL A 15 25.576 11.384 -8.424 1.00 0.00 N ATOM 210 CA VAL A 15 25.027 12.700 -8.033 1.00 0.00 C ATOM 211 C VAL A 15 25.346 13.074 -6.580 1.00 0.00 C ATOM 212 O VAL A 15 25.391 14.259 -6.258 1.00 0.00 O ATOM 213 CB VAL A 15 23.519 12.858 -8.304 1.00 0.00 C ATOM 214 CG1 VAL A 15 23.216 12.822 -9.804 1.00 0.00 C ATOM 215 CG2 VAL A 15 22.656 11.813 -7.600 1.00 0.00 C ATOM 0 H VAL A 15 24.865 10.714 -8.717 1.00 0.00 H new ATOM 0 HA VAL A 15 25.543 13.402 -8.688 1.00 0.00 H new ATOM 0 HB VAL A 15 23.259 13.833 -7.891 1.00 0.00 H new ATOM 0 HG11 VAL A 15 22.143 12.936 -9.961 1.00 0.00 H new ATOM 0 HG12 VAL A 15 23.744 13.635 -10.302 1.00 0.00 H new ATOM 0 HG13 VAL A 15 23.544 11.869 -10.219 1.00 0.00 H new ATOM 0 HG21 VAL A 15 21.607 11.988 -7.838 1.00 0.00 H new ATOM 0 HG22 VAL A 15 22.943 10.817 -7.937 1.00 0.00 H new ATOM 0 HG23 VAL A 15 22.801 11.887 -6.522 1.00 0.00 H new ATOM 225 N ASP A 16 25.623 12.104 -5.702 1.00 0.00 N ATOM 226 CA ASP A 16 26.040 12.391 -4.320 1.00 0.00 C ATOM 227 C ASP A 16 27.467 12.969 -4.263 1.00 0.00 C ATOM 228 O ASP A 16 27.737 13.923 -3.533 1.00 0.00 O ATOM 229 CB ASP A 16 25.933 11.110 -3.483 1.00 0.00 C ATOM 230 CG ASP A 16 26.063 11.390 -1.980 1.00 0.00 C ATOM 231 OD1 ASP A 16 25.026 11.695 -1.344 1.00 0.00 O ATOM 232 OD2 ASP A 16 27.183 11.268 -1.428 1.00 0.00 O ATOM 0 H ASP A 16 25.566 11.110 -5.922 1.00 0.00 H new ATOM 0 HA ASP A 16 25.376 13.150 -3.907 1.00 0.00 H new ATOM 0 HB2 ASP A 16 24.976 10.628 -3.680 1.00 0.00 H new ATOM 0 HB3 ASP A 16 26.711 10.411 -3.790 1.00 0.00 H new ATOM 237 N LEU A 17 28.377 12.439 -5.086 1.00 0.00 N ATOM 238 CA LEU A 17 29.806 12.766 -5.050 1.00 0.00 C ATOM 239 C LEU A 17 30.073 14.178 -5.578 1.00 0.00 C ATOM 240 O LEU A 17 30.815 14.953 -4.977 1.00 0.00 O ATOM 241 CB LEU A 17 30.584 11.703 -5.822 1.00 0.00 C ATOM 242 CG LEU A 17 30.421 10.268 -5.278 1.00 0.00 C ATOM 243 CD1 LEU A 17 31.608 9.470 -5.789 1.00 0.00 C ATOM 244 CD2 LEU A 17 30.428 10.137 -3.751 1.00 0.00 C ATOM 0 H LEU A 17 28.137 11.759 -5.808 1.00 0.00 H new ATOM 0 HA LEU A 17 30.149 12.762 -4.016 1.00 0.00 H new ATOM 0 HB2 LEU A 17 30.264 11.721 -6.864 1.00 0.00 H new ATOM 0 HB3 LEU A 17 31.642 11.965 -5.809 1.00 0.00 H new ATOM 0 HG LEU A 17 29.445 9.919 -5.615 1.00 0.00 H new ATOM 0 HD11 LEU A 17 31.538 8.443 -5.430 1.00 0.00 H new ATOM 0 HD12 LEU A 17 31.607 9.474 -6.879 1.00 0.00 H new ATOM 0 HD13 LEU A 17 32.532 9.919 -5.426 1.00 0.00 H new ATOM 0 HD21 LEU A 17 30.307 9.089 -3.475 1.00 0.00 H new ATOM 0 HD22 LEU A 17 31.374 10.509 -3.358 1.00 0.00 H new ATOM 0 HD23 LEU A 17 29.607 10.719 -3.332 1.00 0.00 H new ATOM 256 N GLU A 18 29.390 14.547 -6.659 1.00 0.00 N ATOM 257 CA GLU A 18 29.354 15.919 -7.174 1.00 0.00 C ATOM 258 C GLU A 18 28.637 16.887 -6.220 1.00 0.00 C ATOM 259 O GLU A 18 29.086 18.021 -6.077 1.00 0.00 O ATOM 260 CB GLU A 18 28.771 15.955 -8.594 1.00 0.00 C ATOM 261 CG GLU A 18 27.424 15.251 -8.739 1.00 0.00 C ATOM 262 CD GLU A 18 27.246 14.801 -10.200 1.00 0.00 C ATOM 263 OE1 GLU A 18 26.801 15.608 -11.041 1.00 0.00 O ATOM 264 OE2 GLU A 18 27.531 13.632 -10.545 1.00 0.00 O ATOM 0 H GLU A 18 28.836 13.893 -7.212 1.00 0.00 H new ATOM 0 HA GLU A 18 30.383 16.273 -7.233 1.00 0.00 H new ATOM 0 HB2 GLU A 18 28.659 16.995 -8.902 1.00 0.00 H new ATOM 0 HB3 GLU A 18 29.484 15.495 -9.278 1.00 0.00 H new ATOM 0 HG2 GLU A 18 27.376 14.390 -8.072 1.00 0.00 H new ATOM 0 HG3 GLU A 18 26.615 15.923 -8.451 1.00 0.00 H new ATOM 271 N ALA A 19 27.610 16.462 -5.473 1.00 0.00 N ATOM 272 CA ALA A 19 27.028 17.297 -4.418 1.00 0.00 C ATOM 273 C ALA A 19 28.035 17.588 -3.283 1.00 0.00 C ATOM 274 O ALA A 19 28.111 18.720 -2.809 1.00 0.00 O ATOM 275 CB ALA A 19 25.735 16.637 -3.927 1.00 0.00 C ATOM 0 H ALA A 19 27.168 15.549 -5.580 1.00 0.00 H new ATOM 0 HA ALA A 19 26.780 18.278 -4.823 1.00 0.00 H new ATOM 0 HB1 ALA A 19 25.290 17.248 -3.141 1.00 0.00 H new ATOM 0 HB2 ALA A 19 25.034 16.547 -4.757 1.00 0.00 H new ATOM 0 HB3 ALA A 19 25.959 15.646 -3.533 1.00 0.00 H new ATOM 281 N VAL A 20 28.880 16.617 -2.904 1.00 0.00 N ATOM 282 CA VAL A 20 29.998 16.811 -1.950 1.00 0.00 C ATOM 283 C VAL A 20 31.110 17.686 -2.548 1.00 0.00 C ATOM 284 O VAL A 20 31.649 18.565 -1.865 1.00 0.00 O ATOM 285 CB VAL A 20 30.536 15.452 -1.450 1.00 0.00 C ATOM 286 CG1 VAL A 20 31.792 15.589 -0.578 1.00 0.00 C ATOM 287 CG2 VAL A 20 29.480 14.734 -0.598 1.00 0.00 C ATOM 0 H VAL A 20 28.811 15.661 -3.252 1.00 0.00 H new ATOM 0 HA VAL A 20 29.610 17.349 -1.085 1.00 0.00 H new ATOM 0 HB VAL A 20 30.781 14.888 -2.350 1.00 0.00 H new ATOM 0 HG11 VAL A 20 32.122 14.601 -0.257 1.00 0.00 H new ATOM 0 HG12 VAL A 20 32.584 16.067 -1.154 1.00 0.00 H new ATOM 0 HG13 VAL A 20 31.563 16.197 0.297 1.00 0.00 H new ATOM 0 HG21 VAL A 20 29.877 13.779 -0.255 1.00 0.00 H new ATOM 0 HG22 VAL A 20 29.226 15.352 0.263 1.00 0.00 H new ATOM 0 HG23 VAL A 20 28.586 14.561 -1.197 1.00 0.00 H new ATOM 297 N ARG A 21 31.409 17.540 -3.845 1.00 0.00 N ATOM 298 CA ARG A 21 32.333 18.434 -4.563 1.00 0.00 C ATOM 299 C ARG A 21 31.829 19.876 -4.556 1.00 0.00 C ATOM 300 O ARG A 21 32.599 20.764 -4.226 1.00 0.00 O ATOM 301 CB ARG A 21 32.576 17.889 -5.982 1.00 0.00 C ATOM 302 CG ARG A 21 33.630 18.659 -6.797 1.00 0.00 C ATOM 303 CD ARG A 21 34.993 18.836 -6.108 1.00 0.00 C ATOM 304 NE ARG A 21 35.591 17.545 -5.710 1.00 0.00 N ATOM 305 CZ ARG A 21 36.681 17.370 -4.980 1.00 0.00 C ATOM 306 NH1 ARG A 21 37.383 18.374 -4.533 1.00 0.00 N ATOM 307 NH2 ARG A 21 37.090 16.170 -4.684 1.00 0.00 N ATOM 0 H ARG A 21 31.019 16.800 -4.428 1.00 0.00 H new ATOM 0 HA ARG A 21 33.293 18.455 -4.047 1.00 0.00 H new ATOM 0 HB2 ARG A 21 32.885 16.846 -5.908 1.00 0.00 H new ATOM 0 HB3 ARG A 21 31.633 17.904 -6.528 1.00 0.00 H new ATOM 0 HG2 ARG A 21 33.784 18.140 -7.743 1.00 0.00 H new ATOM 0 HG3 ARG A 21 33.231 19.645 -7.036 1.00 0.00 H new ATOM 0 HD2 ARG A 21 35.673 19.357 -6.782 1.00 0.00 H new ATOM 0 HD3 ARG A 21 34.873 19.466 -5.226 1.00 0.00 H new ATOM 0 HE ARG A 21 35.115 16.702 -6.031 1.00 0.00 H new ATOM 0 HH11 ARG A 21 37.097 19.330 -4.743 1.00 0.00 H new ATOM 0 HH12 ARG A 21 38.218 18.203 -3.973 1.00 0.00 H new ATOM 0 HH21 ARG A 21 36.570 15.358 -5.015 1.00 0.00 H new ATOM 0 HH22 ARG A 21 37.931 16.042 -4.121 1.00 0.00 H new ATOM 321 N LEU A 22 30.541 20.124 -4.789 1.00 0.00 N ATOM 322 CA LEU A 22 29.938 21.458 -4.678 1.00 0.00 C ATOM 323 C LEU A 22 29.855 21.944 -3.238 1.00 0.00 C ATOM 324 O LEU A 22 30.108 23.118 -3.025 1.00 0.00 O ATOM 325 CB LEU A 22 28.594 21.551 -5.409 1.00 0.00 C ATOM 326 CG LEU A 22 28.789 21.904 -6.895 1.00 0.00 C ATOM 327 CD1 LEU A 22 29.241 20.728 -7.753 1.00 0.00 C ATOM 328 CD2 LEU A 22 27.476 22.425 -7.446 1.00 0.00 C ATOM 0 H LEU A 22 29.877 19.400 -5.063 1.00 0.00 H new ATOM 0 HA LEU A 22 30.614 22.144 -5.189 1.00 0.00 H new ATOM 0 HB2 LEU A 22 28.065 20.602 -5.325 1.00 0.00 H new ATOM 0 HB3 LEU A 22 27.970 22.307 -4.932 1.00 0.00 H new ATOM 0 HG LEU A 22 29.581 22.652 -6.939 1.00 0.00 H new ATOM 0 HD11 LEU A 22 29.357 21.055 -8.786 1.00 0.00 H new ATOM 0 HD12 LEU A 22 30.195 20.353 -7.382 1.00 0.00 H new ATOM 0 HD13 LEU A 22 28.495 19.935 -7.705 1.00 0.00 H new ATOM 0 HD21 LEU A 22 27.599 22.679 -8.499 1.00 0.00 H new ATOM 0 HD22 LEU A 22 26.709 21.657 -7.345 1.00 0.00 H new ATOM 0 HD23 LEU A 22 27.175 23.313 -6.891 1.00 0.00 H new ATOM 340 N ALA A 23 29.631 21.095 -2.235 1.00 0.00 N ATOM 341 CA ALA A 23 29.780 21.519 -0.839 1.00 0.00 C ATOM 342 C ALA A 23 31.215 22.034 -0.580 1.00 0.00 C ATOM 343 O ALA A 23 31.405 23.017 0.132 1.00 0.00 O ATOM 344 CB ALA A 23 29.372 20.358 0.071 1.00 0.00 C ATOM 0 H ALA A 23 29.349 20.122 -2.358 1.00 0.00 H new ATOM 0 HA ALA A 23 29.122 22.359 -0.616 1.00 0.00 H new ATOM 0 HB1 ALA A 23 29.478 20.658 1.113 1.00 0.00 H new ATOM 0 HB2 ALA A 23 28.334 20.089 -0.126 1.00 0.00 H new ATOM 0 HB3 ALA A 23 30.013 19.499 -0.126 1.00 0.00 H new ATOM 350 N SER A 24 32.207 21.453 -1.267 1.00 0.00 N ATOM 351 CA SER A 24 33.596 21.933 -1.286 1.00 0.00 C ATOM 352 C SER A 24 33.799 23.216 -2.121 1.00 0.00 C ATOM 353 O SER A 24 34.535 24.100 -1.670 1.00 0.00 O ATOM 354 CB SER A 24 34.562 20.821 -1.732 1.00 0.00 C ATOM 355 OG SER A 24 34.309 19.595 -1.054 1.00 0.00 O ATOM 0 H SER A 24 32.064 20.619 -1.837 1.00 0.00 H new ATOM 0 HA SER A 24 33.830 22.208 -0.257 1.00 0.00 H new ATOM 0 HB2 SER A 24 34.468 20.668 -2.807 1.00 0.00 H new ATOM 0 HB3 SER A 24 35.589 21.135 -1.544 1.00 0.00 H new ATOM 0 HG SER A 24 33.444 19.235 -1.341 1.00 0.00 H new ATOM 361 N ILE A 25 33.146 23.402 -3.289 1.00 0.00 N ATOM 362 CA ILE A 25 33.315 24.666 -4.039 1.00 0.00 C ATOM 363 C ILE A 25 32.586 25.821 -3.327 1.00 0.00 C ATOM 364 O ILE A 25 33.090 26.940 -3.265 1.00 0.00 O ATOM 365 CB ILE A 25 32.879 24.578 -5.516 1.00 0.00 C ATOM 366 CG1 ILE A 25 33.162 23.250 -6.243 1.00 0.00 C ATOM 367 CG2 ILE A 25 33.577 25.702 -6.300 1.00 0.00 C ATOM 368 CD1 ILE A 25 34.583 22.687 -6.181 1.00 0.00 C ATOM 0 H ILE A 25 32.520 22.722 -3.720 1.00 0.00 H new ATOM 0 HA ILE A 25 34.387 24.865 -4.053 1.00 0.00 H new ATOM 0 HB ILE A 25 31.793 24.666 -5.487 1.00 0.00 H new ATOM 0 HG12 ILE A 25 32.486 22.497 -5.838 1.00 0.00 H new ATOM 0 HG13 ILE A 25 32.900 23.381 -7.293 1.00 0.00 H new ATOM 0 HG21 ILE A 25 33.279 25.654 -7.347 1.00 0.00 H new ATOM 0 HG22 ILE A 25 33.289 26.668 -5.885 1.00 0.00 H new ATOM 0 HG23 ILE A 25 34.658 25.582 -6.224 1.00 0.00 H new ATOM 0 HD11 ILE A 25 34.628 21.751 -6.737 1.00 0.00 H new ATOM 0 HD12 ILE A 25 35.278 23.403 -6.619 1.00 0.00 H new ATOM 0 HD13 ILE A 25 34.857 22.505 -5.142 1.00 0.00 H new ATOM 380 N VAL A 26 31.427 25.540 -2.722 1.00 0.00 N ATOM 381 CA VAL A 26 30.658 26.488 -1.905 1.00 0.00 C ATOM 382 C VAL A 26 31.460 26.864 -0.664 1.00 0.00 C ATOM 383 O VAL A 26 31.649 28.052 -0.452 1.00 0.00 O ATOM 384 CB VAL A 26 29.283 25.914 -1.521 1.00 0.00 C ATOM 385 CG1 VAL A 26 28.498 26.858 -0.603 1.00 0.00 C ATOM 386 CG2 VAL A 26 28.407 25.662 -2.762 1.00 0.00 C ATOM 0 H VAL A 26 30.985 24.623 -2.788 1.00 0.00 H new ATOM 0 HA VAL A 26 30.477 27.386 -2.495 1.00 0.00 H new ATOM 0 HB VAL A 26 29.495 24.979 -1.003 1.00 0.00 H new ATOM 0 HG11 VAL A 26 27.535 26.410 -0.359 1.00 0.00 H new ATOM 0 HG12 VAL A 26 29.063 27.027 0.314 1.00 0.00 H new ATOM 0 HG13 VAL A 26 28.338 27.809 -1.111 1.00 0.00 H new ATOM 0 HG21 VAL A 26 27.444 25.257 -2.451 1.00 0.00 H new ATOM 0 HG22 VAL A 26 28.251 26.600 -3.294 1.00 0.00 H new ATOM 0 HG23 VAL A 26 28.905 24.950 -3.420 1.00 0.00 H new ATOM 396 N ASP A 27 32.034 25.922 0.093 1.00 0.00 N ATOM 397 CA ASP A 27 32.954 26.246 1.197 1.00 0.00 C ATOM 398 C ASP A 27 34.110 27.155 0.740 1.00 0.00 C ATOM 399 O ASP A 27 34.398 28.172 1.375 1.00 0.00 O ATOM 400 CB ASP A 27 33.518 24.955 1.799 1.00 0.00 C ATOM 401 CG ASP A 27 34.621 25.239 2.833 1.00 0.00 C ATOM 402 OD1 ASP A 27 34.383 26.027 3.779 1.00 0.00 O ATOM 403 OD2 ASP A 27 35.722 24.652 2.700 1.00 0.00 O ATOM 0 H ASP A 27 31.878 24.922 -0.038 1.00 0.00 H new ATOM 0 HA ASP A 27 32.384 26.790 1.950 1.00 0.00 H new ATOM 0 HB2 ASP A 27 32.713 24.393 2.272 1.00 0.00 H new ATOM 0 HB3 ASP A 27 33.919 24.328 1.003 1.00 0.00 H new ATOM 408 N SER A 28 34.713 26.851 -0.416 1.00 0.00 N ATOM 409 CA SER A 28 35.771 27.683 -1.011 1.00 0.00 C ATOM 410 C SER A 28 35.291 29.122 -1.288 1.00 0.00 C ATOM 411 O SER A 28 36.045 30.076 -1.089 1.00 0.00 O ATOM 412 CB SER A 28 36.314 27.042 -2.298 1.00 0.00 C ATOM 413 OG SER A 28 36.758 25.711 -2.070 1.00 0.00 O ATOM 0 H SER A 28 34.483 26.023 -0.966 1.00 0.00 H new ATOM 0 HA SER A 28 36.578 27.742 -0.281 1.00 0.00 H new ATOM 0 HB2 SER A 28 35.536 27.041 -3.062 1.00 0.00 H new ATOM 0 HB3 SER A 28 37.139 27.641 -2.684 1.00 0.00 H new ATOM 0 HG SER A 28 35.984 25.128 -1.925 1.00 0.00 H new ATOM 419 N ARG A 29 34.015 29.299 -1.659 1.00 0.00 N ATOM 420 CA ARG A 29 33.342 30.603 -1.818 1.00 0.00 C ATOM 421 C ARG A 29 32.924 31.246 -0.488 1.00 0.00 C ATOM 422 O ARG A 29 33.038 32.463 -0.355 1.00 0.00 O ATOM 423 CB ARG A 29 32.143 30.400 -2.762 1.00 0.00 C ATOM 424 CG ARG A 29 31.406 31.690 -3.129 1.00 0.00 C ATOM 425 CD ARG A 29 32.210 32.642 -4.015 1.00 0.00 C ATOM 426 NE ARG A 29 31.328 33.693 -4.566 1.00 0.00 N ATOM 427 CZ ARG A 29 31.560 34.456 -5.618 1.00 0.00 C ATOM 428 NH1 ARG A 29 32.710 34.454 -6.229 1.00 0.00 N ATOM 429 NH2 ARG A 29 30.637 35.246 -6.081 1.00 0.00 N ATOM 0 H ARG A 29 33.399 28.513 -1.865 1.00 0.00 H new ATOM 0 HA ARG A 29 34.050 31.312 -2.247 1.00 0.00 H new ATOM 0 HB2 ARG A 29 32.493 29.922 -3.677 1.00 0.00 H new ATOM 0 HB3 ARG A 29 31.438 29.713 -2.293 1.00 0.00 H new ATOM 0 HG2 ARG A 29 30.479 31.432 -3.640 1.00 0.00 H new ATOM 0 HG3 ARG A 29 31.130 32.211 -2.212 1.00 0.00 H new ATOM 0 HD2 ARG A 29 33.014 33.098 -3.436 1.00 0.00 H new ATOM 0 HD3 ARG A 29 32.678 32.086 -4.828 1.00 0.00 H new ATOM 0 HE ARG A 29 30.444 33.845 -4.080 1.00 0.00 H new ATOM 0 HH11 ARG A 29 33.463 33.851 -5.897 1.00 0.00 H new ATOM 0 HH12 ARG A 29 32.858 35.055 -7.040 1.00 0.00 H new ATOM 0 HH21 ARG A 29 29.722 35.281 -5.631 1.00 0.00 H new ATOM 0 HH22 ARG A 29 30.827 35.831 -6.894 1.00 0.00 H new ATOM 443 N LEU A 30 32.501 30.482 0.522 1.00 0.00 N ATOM 444 CA LEU A 30 32.187 31.033 1.848 1.00 0.00 C ATOM 445 C LEU A 30 33.451 31.570 2.553 1.00 0.00 C ATOM 446 O LEU A 30 33.388 32.594 3.233 1.00 0.00 O ATOM 447 CB LEU A 30 31.432 30.015 2.721 1.00 0.00 C ATOM 448 CG LEU A 30 30.083 29.501 2.178 1.00 0.00 C ATOM 449 CD1 LEU A 30 29.396 28.618 3.226 1.00 0.00 C ATOM 450 CD2 LEU A 30 29.116 30.622 1.766 1.00 0.00 C ATOM 0 H LEU A 30 32.367 29.474 0.448 1.00 0.00 H new ATOM 0 HA LEU A 30 31.519 31.881 1.698 1.00 0.00 H new ATOM 0 HB2 LEU A 30 32.083 29.156 2.882 1.00 0.00 H new ATOM 0 HB3 LEU A 30 31.255 30.468 3.696 1.00 0.00 H new ATOM 0 HG LEU A 30 30.320 28.931 1.280 1.00 0.00 H new ATOM 0 HD11 LEU A 30 28.444 28.260 2.833 1.00 0.00 H new ATOM 0 HD12 LEU A 30 30.035 27.767 3.460 1.00 0.00 H new ATOM 0 HD13 LEU A 30 29.219 29.199 4.131 1.00 0.00 H new ATOM 0 HD21 LEU A 30 28.189 30.185 1.394 1.00 0.00 H new ATOM 0 HD22 LEU A 30 28.900 31.251 2.629 1.00 0.00 H new ATOM 0 HD23 LEU A 30 29.572 31.226 0.982 1.00 0.00 H new ATOM 462 N ILE A 31 34.608 30.942 2.318 1.00 0.00 N ATOM 463 CA ILE A 31 35.934 31.440 2.726 1.00 0.00 C ATOM 464 C ILE A 31 36.360 32.639 1.849 1.00 0.00 C ATOM 465 O ILE A 31 36.958 33.596 2.347 1.00 0.00 O ATOM 466 CB ILE A 31 36.957 30.276 2.655 1.00 0.00 C ATOM 467 CG1 ILE A 31 36.608 29.189 3.701 1.00 0.00 C ATOM 468 CG2 ILE A 31 38.402 30.766 2.876 1.00 0.00 C ATOM 469 CD1 ILE A 31 37.347 27.860 3.491 1.00 0.00 C ATOM 0 H ILE A 31 34.654 30.050 1.826 1.00 0.00 H new ATOM 0 HA ILE A 31 35.893 31.801 3.754 1.00 0.00 H new ATOM 0 HB ILE A 31 36.896 29.852 1.653 1.00 0.00 H new ATOM 0 HG12 ILE A 31 36.840 29.569 4.696 1.00 0.00 H new ATOM 0 HG13 ILE A 31 35.534 29.004 3.673 1.00 0.00 H new ATOM 0 HG21 ILE A 31 39.086 29.919 2.818 1.00 0.00 H new ATOM 0 HG22 ILE A 31 38.661 31.495 2.108 1.00 0.00 H new ATOM 0 HG23 ILE A 31 38.482 31.231 3.859 1.00 0.00 H new ATOM 0 HD11 ILE A 31 37.048 27.152 4.264 1.00 0.00 H new ATOM 0 HD12 ILE A 31 37.096 27.455 2.511 1.00 0.00 H new ATOM 0 HD13 ILE A 31 38.422 28.028 3.549 1.00 0.00 H new ATOM 481 N GLY A 32 36.029 32.609 0.552 1.00 0.00 N ATOM 482 CA GLY A 32 36.455 33.582 -0.458 1.00 0.00 C ATOM 483 C GLY A 32 35.771 34.943 -0.360 1.00 0.00 C ATOM 484 O GLY A 32 36.408 35.981 -0.547 1.00 0.00 O ATOM 0 H GLY A 32 35.434 31.877 0.164 1.00 0.00 H new ATOM 0 HA2 GLY A 32 37.532 33.725 -0.374 1.00 0.00 H new ATOM 0 HA3 GLY A 32 36.265 33.165 -1.447 1.00 0.00 H new ATOM 488 N THR A 33 34.469 34.932 -0.065 1.00 0.00 N ATOM 489 CA THR A 33 33.648 36.149 0.094 1.00 0.00 C ATOM 490 C THR A 33 32.448 36.007 1.054 1.00 0.00 C ATOM 491 O THR A 33 32.051 36.992 1.679 1.00 0.00 O ATOM 492 CB THR A 33 33.194 36.637 -1.296 1.00 0.00 C ATOM 493 OG1 THR A 33 32.608 37.917 -1.227 1.00 0.00 O ATOM 494 CG2 THR A 33 32.189 35.693 -1.957 1.00 0.00 C ATOM 0 H THR A 33 33.942 34.070 0.073 1.00 0.00 H new ATOM 0 HA THR A 33 34.287 36.891 0.573 1.00 0.00 H new ATOM 0 HB THR A 33 34.101 36.667 -1.900 1.00 0.00 H new ATOM 0 HG1 THR A 33 32.332 38.199 -2.124 1.00 0.00 H new ATOM 0 HG21 THR A 33 31.906 36.088 -2.933 1.00 0.00 H new ATOM 0 HG22 THR A 33 32.641 34.709 -2.082 1.00 0.00 H new ATOM 0 HG23 THR A 33 31.302 35.608 -1.329 1.00 0.00 H new ATOM 502 N GLY A 34 31.889 34.797 1.231 1.00 0.00 N ATOM 503 CA GLY A 34 30.791 34.532 2.188 1.00 0.00 C ATOM 504 C GLY A 34 29.385 34.391 1.592 1.00 0.00 C ATOM 505 O GLY A 34 28.418 34.155 2.318 1.00 0.00 O ATOM 0 H GLY A 34 32.185 33.969 0.714 1.00 0.00 H new ATOM 0 HA2 GLY A 34 31.025 33.616 2.731 1.00 0.00 H new ATOM 0 HA3 GLY A 34 30.773 35.340 2.919 1.00 0.00 H new ATOM 509 N SER A 35 29.281 34.469 0.267 1.00 0.00 N ATOM 510 CA SER A 35 28.044 34.360 -0.514 1.00 0.00 C ATOM 511 C SER A 35 28.340 33.630 -1.818 1.00 0.00 C ATOM 512 O SER A 35 29.344 33.910 -2.473 1.00 0.00 O ATOM 513 CB SER A 35 27.457 35.744 -0.829 1.00 0.00 C ATOM 514 OG SER A 35 27.044 36.403 0.358 1.00 0.00 O ATOM 0 H SER A 35 30.098 34.618 -0.325 1.00 0.00 H new ATOM 0 HA SER A 35 27.313 33.807 0.076 1.00 0.00 H new ATOM 0 HB2 SER A 35 28.202 36.350 -1.345 1.00 0.00 H new ATOM 0 HB3 SER A 35 26.608 35.638 -1.505 1.00 0.00 H new ATOM 0 HG SER A 35 26.675 37.283 0.132 1.00 0.00 H new ATOM 520 N VAL A 36 27.470 32.704 -2.205 1.00 0.00 N ATOM 521 CA VAL A 36 27.538 31.973 -3.486 1.00 0.00 C ATOM 522 C VAL A 36 26.354 32.356 -4.377 1.00 0.00 C ATOM 523 O VAL A 36 25.258 32.634 -3.885 1.00 0.00 O ATOM 524 CB VAL A 36 27.643 30.459 -3.227 1.00 0.00 C ATOM 525 CG1 VAL A 36 26.323 29.833 -2.779 1.00 0.00 C ATOM 526 CG2 VAL A 36 28.126 29.722 -4.472 1.00 0.00 C ATOM 0 H VAL A 36 26.675 32.427 -1.630 1.00 0.00 H new ATOM 0 HA VAL A 36 28.439 32.258 -4.030 1.00 0.00 H new ATOM 0 HB VAL A 36 28.364 30.353 -2.417 1.00 0.00 H new ATOM 0 HG11 VAL A 36 26.465 28.765 -2.613 1.00 0.00 H new ATOM 0 HG12 VAL A 36 25.993 30.303 -1.853 1.00 0.00 H new ATOM 0 HG13 VAL A 36 25.568 29.983 -3.551 1.00 0.00 H new ATOM 0 HG21 VAL A 36 28.191 28.655 -4.261 1.00 0.00 H new ATOM 0 HG22 VAL A 36 27.423 29.888 -5.289 1.00 0.00 H new ATOM 0 HG23 VAL A 36 29.109 30.096 -4.758 1.00 0.00 H new ATOM 536 N ASP A 37 26.577 32.392 -5.690 1.00 0.00 N ATOM 537 CA ASP A 37 25.642 32.932 -6.678 1.00 0.00 C ATOM 538 C ASP A 37 25.478 31.973 -7.864 1.00 0.00 C ATOM 539 O ASP A 37 26.365 31.162 -8.146 1.00 0.00 O ATOM 540 CB ASP A 37 26.141 34.304 -7.167 1.00 0.00 C ATOM 541 CG ASP A 37 26.676 35.213 -6.041 1.00 0.00 C ATOM 542 OD1 ASP A 37 27.891 35.145 -5.723 1.00 0.00 O ATOM 543 OD2 ASP A 37 25.883 36.011 -5.486 1.00 0.00 O ATOM 0 H ASP A 37 27.437 32.037 -6.108 1.00 0.00 H new ATOM 0 HA ASP A 37 24.667 33.049 -6.205 1.00 0.00 H new ATOM 0 HB2 ASP A 37 26.930 34.151 -7.903 1.00 0.00 H new ATOM 0 HB3 ASP A 37 25.325 34.816 -7.677 1.00 0.00 H new ATOM 548 N GLU A 38 24.363 32.078 -8.592 1.00 0.00 N ATOM 549 CA GLU A 38 24.072 31.206 -9.741 1.00 0.00 C ATOM 550 C GLU A 38 25.212 31.197 -10.772 1.00 0.00 C ATOM 551 O GLU A 38 25.606 30.136 -11.260 1.00 0.00 O ATOM 552 CB GLU A 38 22.764 31.670 -10.404 1.00 0.00 C ATOM 553 CG GLU A 38 22.197 30.653 -11.407 1.00 0.00 C ATOM 554 CD GLU A 38 21.806 31.329 -12.735 1.00 0.00 C ATOM 555 OE1 GLU A 38 22.673 31.448 -13.637 1.00 0.00 O ATOM 556 OE2 GLU A 38 20.631 31.746 -12.886 1.00 0.00 O ATOM 0 H GLU A 38 23.635 32.768 -8.405 1.00 0.00 H new ATOM 0 HA GLU A 38 23.970 30.185 -9.372 1.00 0.00 H new ATOM 0 HB2 GLU A 38 22.020 31.860 -9.630 1.00 0.00 H new ATOM 0 HB3 GLU A 38 22.940 32.616 -10.916 1.00 0.00 H new ATOM 0 HG2 GLU A 38 22.937 29.876 -11.597 1.00 0.00 H new ATOM 0 HG3 GLU A 38 21.324 30.163 -10.976 1.00 0.00 H new ATOM 563 N ASP A 39 25.803 32.365 -11.040 1.00 0.00 N ATOM 564 CA ASP A 39 26.900 32.536 -11.989 1.00 0.00 C ATOM 565 C ASP A 39 28.238 31.960 -11.499 1.00 0.00 C ATOM 566 O ASP A 39 29.114 31.700 -12.326 1.00 0.00 O ATOM 567 CB ASP A 39 27.053 34.020 -12.352 1.00 0.00 C ATOM 568 CG ASP A 39 27.175 34.932 -11.120 1.00 0.00 C ATOM 569 OD1 ASP A 39 26.125 35.343 -10.569 1.00 0.00 O ATOM 570 OD2 ASP A 39 28.319 35.243 -10.712 1.00 0.00 O ATOM 0 H ASP A 39 25.523 33.237 -10.591 1.00 0.00 H new ATOM 0 HA ASP A 39 26.634 31.961 -12.876 1.00 0.00 H new ATOM 0 HB2 ASP A 39 27.936 34.146 -12.979 1.00 0.00 H new ATOM 0 HB3 ASP A 39 26.194 34.333 -12.945 1.00 0.00 H new ATOM 575 N PHE A 40 28.397 31.705 -10.193 1.00 0.00 N ATOM 576 CA PHE A 40 29.543 30.961 -9.674 1.00 0.00 C ATOM 577 C PHE A 40 29.341 29.444 -9.815 1.00 0.00 C ATOM 578 O PHE A 40 30.300 28.736 -10.117 1.00 0.00 O ATOM 579 CB PHE A 40 29.785 31.385 -8.219 1.00 0.00 C ATOM 580 CG PHE A 40 30.972 30.708 -7.569 1.00 0.00 C ATOM 581 CD1 PHE A 40 32.265 31.247 -7.711 1.00 0.00 C ATOM 582 CD2 PHE A 40 30.783 29.535 -6.816 1.00 0.00 C ATOM 583 CE1 PHE A 40 33.359 30.624 -7.086 1.00 0.00 C ATOM 584 CE2 PHE A 40 31.870 28.930 -6.168 1.00 0.00 C ATOM 585 CZ PHE A 40 33.160 29.472 -6.305 1.00 0.00 C ATOM 0 H PHE A 40 27.738 32.008 -9.475 1.00 0.00 H new ATOM 0 HA PHE A 40 30.431 31.197 -10.261 1.00 0.00 H new ATOM 0 HB2 PHE A 40 29.933 32.464 -8.186 1.00 0.00 H new ATOM 0 HB3 PHE A 40 28.891 31.167 -7.635 1.00 0.00 H new ATOM 0 HD1 PHE A 40 32.416 32.139 -8.300 1.00 0.00 H new ATOM 0 HD2 PHE A 40 29.798 29.099 -6.737 1.00 0.00 H new ATOM 0 HE1 PHE A 40 34.352 31.030 -7.206 1.00 0.00 H new ATOM 0 HE2 PHE A 40 31.716 28.048 -5.564 1.00 0.00 H new ATOM 0 HZ PHE A 40 33.998 29.003 -5.810 1.00 0.00 H new ATOM 595 N LEU A 41 28.110 28.938 -9.629 1.00 0.00 N ATOM 596 CA LEU A 41 27.769 27.500 -9.552 1.00 0.00 C ATOM 597 C LEU A 41 27.528 26.835 -10.908 1.00 0.00 C ATOM 598 O LEU A 41 27.885 25.668 -11.075 1.00 0.00 O ATOM 599 CB LEU A 41 26.537 27.355 -8.632 1.00 0.00 C ATOM 600 CG LEU A 41 26.864 27.548 -7.144 1.00 0.00 C ATOM 601 CD1 LEU A 41 25.569 27.698 -6.347 1.00 0.00 C ATOM 602 CD2 LEU A 41 27.644 26.368 -6.559 1.00 0.00 C ATOM 0 H LEU A 41 27.292 29.538 -9.524 1.00 0.00 H new ATOM 0 HA LEU A 41 28.631 26.973 -9.144 1.00 0.00 H new ATOM 0 HB2 LEU A 41 25.783 28.084 -8.929 1.00 0.00 H new ATOM 0 HB3 LEU A 41 26.099 26.367 -8.776 1.00 0.00 H new ATOM 0 HG LEU A 41 27.482 28.443 -7.071 1.00 0.00 H new ATOM 0 HD11 LEU A 41 25.805 27.835 -5.292 1.00 0.00 H new ATOM 0 HD12 LEU A 41 25.016 28.564 -6.710 1.00 0.00 H new ATOM 0 HD13 LEU A 41 24.960 26.802 -6.470 1.00 0.00 H new ATOM 0 HD21 LEU A 41 27.850 26.555 -5.505 1.00 0.00 H new ATOM 0 HD22 LEU A 41 27.054 25.457 -6.658 1.00 0.00 H new ATOM 0 HD23 LEU A 41 28.585 26.251 -7.097 1.00 0.00 H new ATOM 614 N ARG A 42 27.009 27.559 -11.906 1.00 0.00 N ATOM 615 CA ARG A 42 26.836 27.030 -13.276 1.00 0.00 C ATOM 616 C ARG A 42 28.152 26.602 -13.946 1.00 0.00 C ATOM 617 O ARG A 42 28.147 25.784 -14.860 1.00 0.00 O ATOM 618 CB ARG A 42 26.051 28.049 -14.114 1.00 0.00 C ATOM 619 CG ARG A 42 26.746 29.403 -14.322 1.00 0.00 C ATOM 620 CD ARG A 42 25.725 30.371 -14.936 1.00 0.00 C ATOM 621 NE ARG A 42 26.330 31.654 -15.339 1.00 0.00 N ATOM 622 CZ ARG A 42 25.696 32.803 -15.502 1.00 0.00 C ATOM 623 NH1 ARG A 42 24.447 32.973 -15.170 1.00 0.00 N ATOM 624 NH2 ARG A 42 26.327 33.830 -15.997 1.00 0.00 N ATOM 0 H ARG A 42 26.697 28.524 -11.794 1.00 0.00 H new ATOM 0 HA ARG A 42 26.262 26.106 -13.207 1.00 0.00 H new ATOM 0 HB2 ARG A 42 25.846 27.611 -15.091 1.00 0.00 H new ATOM 0 HB3 ARG A 42 25.088 28.224 -13.635 1.00 0.00 H new ATOM 0 HG2 ARG A 42 27.116 29.791 -13.373 1.00 0.00 H new ATOM 0 HG3 ARG A 42 27.609 29.292 -14.979 1.00 0.00 H new ATOM 0 HD2 ARG A 42 25.263 29.903 -15.805 1.00 0.00 H new ATOM 0 HD3 ARG A 42 24.930 30.559 -14.215 1.00 0.00 H new ATOM 0 HE ARG A 42 27.336 31.655 -15.509 1.00 0.00 H new ATOM 0 HH11 ARG A 42 23.917 32.201 -14.766 1.00 0.00 H new ATOM 0 HH12 ARG A 42 24.000 33.878 -15.314 1.00 0.00 H new ATOM 0 HH21 ARG A 42 27.309 33.747 -16.259 1.00 0.00 H new ATOM 0 HH22 ARG A 42 25.838 34.717 -16.123 1.00 0.00 H new ATOM 638 N GLU A 43 29.282 27.094 -13.434 1.00 0.00 N ATOM 639 CA GLU A 43 30.640 26.698 -13.845 1.00 0.00 C ATOM 640 C GLU A 43 31.178 25.451 -13.121 1.00 0.00 C ATOM 641 O GLU A 43 32.267 24.983 -13.451 1.00 0.00 O ATOM 642 CB GLU A 43 31.612 27.872 -13.631 1.00 0.00 C ATOM 643 CG GLU A 43 31.083 29.193 -14.198 1.00 0.00 C ATOM 644 CD GLU A 43 32.225 30.189 -14.469 1.00 0.00 C ATOM 645 OE1 GLU A 43 32.880 30.660 -13.507 1.00 0.00 O ATOM 646 OE2 GLU A 43 32.484 30.508 -15.657 1.00 0.00 O ATOM 0 H GLU A 43 29.282 27.801 -12.699 1.00 0.00 H new ATOM 0 HA GLU A 43 30.570 26.435 -14.900 1.00 0.00 H new ATOM 0 HB2 GLU A 43 31.802 27.990 -12.564 1.00 0.00 H new ATOM 0 HB3 GLU A 43 32.567 27.637 -14.101 1.00 0.00 H new ATOM 0 HG2 GLU A 43 30.539 29.001 -15.123 1.00 0.00 H new ATOM 0 HG3 GLU A 43 30.374 29.633 -13.497 1.00 0.00 H new ATOM 653 N GLN A 44 30.456 24.901 -12.133 1.00 0.00 N ATOM 654 CA GLN A 44 30.944 23.848 -11.221 1.00 0.00 C ATOM 655 C GLN A 44 30.182 22.526 -11.352 1.00 0.00 C ATOM 656 O GLN A 44 30.679 21.497 -10.899 1.00 0.00 O ATOM 657 CB GLN A 44 30.827 24.301 -9.753 1.00 0.00 C ATOM 658 CG GLN A 44 31.292 25.733 -9.487 1.00 0.00 C ATOM 659 CD GLN A 44 32.739 26.032 -9.875 1.00 0.00 C ATOM 660 OE1 GLN A 44 33.598 25.169 -10.002 1.00 0.00 O ATOM 661 NE2 GLN A 44 33.060 27.295 -10.037 1.00 0.00 N ATOM 0 H GLN A 44 29.494 25.180 -11.939 1.00 0.00 H new ATOM 0 HA GLN A 44 31.983 23.682 -11.507 1.00 0.00 H new ATOM 0 HB2 GLN A 44 29.787 24.207 -9.440 1.00 0.00 H new ATOM 0 HB3 GLN A 44 31.410 23.623 -9.130 1.00 0.00 H new ATOM 0 HG2 GLN A 44 30.639 26.416 -10.030 1.00 0.00 H new ATOM 0 HG3 GLN A 44 31.166 25.947 -8.426 1.00 0.00 H new ATOM 0 HE21 GLN A 44 32.349 28.019 -9.933 1.00 0.00 H new ATOM 0 HE22 GLN A 44 34.020 27.552 -10.267 1.00 0.00 H new ATOM 670 N ILE A 45 28.979 22.549 -11.948 1.00 0.00 N ATOM 671 CA ILE A 45 28.121 21.362 -12.120 1.00 0.00 C ATOM 672 C ILE A 45 28.858 20.177 -12.751 1.00 0.00 C ATOM 673 O ILE A 45 28.883 19.091 -12.174 1.00 0.00 O ATOM 674 CB ILE A 45 26.855 21.654 -12.965 1.00 0.00 C ATOM 675 CG1 ILE A 45 26.931 22.858 -13.931 1.00 0.00 C ATOM 676 CG2 ILE A 45 25.664 21.832 -12.025 1.00 0.00 C ATOM 677 CD1 ILE A 45 25.874 22.802 -15.043 1.00 0.00 C ATOM 0 H ILE A 45 28.569 23.402 -12.329 1.00 0.00 H new ATOM 0 HA ILE A 45 27.824 21.097 -11.105 1.00 0.00 H new ATOM 0 HB ILE A 45 26.749 20.789 -13.620 1.00 0.00 H new ATOM 0 HG12 ILE A 45 26.805 23.780 -13.364 1.00 0.00 H new ATOM 0 HG13 ILE A 45 27.923 22.893 -14.381 1.00 0.00 H new ATOM 0 HG21 ILE A 45 24.767 22.038 -12.609 1.00 0.00 H new ATOM 0 HG22 ILE A 45 25.518 20.920 -11.446 1.00 0.00 H new ATOM 0 HG23 ILE A 45 25.856 22.665 -11.349 1.00 0.00 H new ATOM 0 HD11 ILE A 45 25.978 23.674 -15.688 1.00 0.00 H new ATOM 0 HD12 ILE A 45 26.013 21.896 -15.632 1.00 0.00 H new ATOM 0 HD13 ILE A 45 24.879 22.796 -14.599 1.00 0.00 H new ATOM 689 N ARG A 46 29.437 20.369 -13.947 1.00 0.00 N ATOM 690 CA ARG A 46 30.277 19.429 -14.719 1.00 0.00 C ATOM 691 C ARG A 46 29.661 18.110 -15.198 1.00 0.00 C ATOM 692 O ARG A 46 30.208 17.490 -16.110 1.00 0.00 O ATOM 693 CB ARG A 46 31.670 19.236 -14.077 1.00 0.00 C ATOM 694 CG ARG A 46 32.455 20.530 -13.805 1.00 0.00 C ATOM 695 CD ARG A 46 32.773 21.356 -15.058 1.00 0.00 C ATOM 696 NE ARG A 46 33.371 22.651 -14.678 1.00 0.00 N ATOM 697 CZ ARG A 46 34.640 23.012 -14.684 1.00 0.00 C ATOM 698 NH1 ARG A 46 35.597 22.231 -15.097 1.00 0.00 N ATOM 699 NH2 ARG A 46 34.951 24.198 -14.251 1.00 0.00 N ATOM 0 H ARG A 46 29.323 21.254 -14.441 1.00 0.00 H new ATOM 0 HA ARG A 46 30.382 19.959 -15.666 1.00 0.00 H new ATOM 0 HB2 ARG A 46 31.547 18.701 -13.135 1.00 0.00 H new ATOM 0 HB3 ARG A 46 32.267 18.599 -14.730 1.00 0.00 H new ATOM 0 HG2 ARG A 46 31.883 21.148 -13.113 1.00 0.00 H new ATOM 0 HG3 ARG A 46 33.390 20.275 -13.306 1.00 0.00 H new ATOM 0 HD2 ARG A 46 33.460 20.805 -15.701 1.00 0.00 H new ATOM 0 HD3 ARG A 46 31.862 21.523 -15.633 1.00 0.00 H new ATOM 0 HE ARG A 46 32.712 23.365 -14.368 1.00 0.00 H new ATOM 0 HH11 ARG A 46 35.380 21.294 -15.436 1.00 0.00 H new ATOM 0 HH12 ARG A 46 36.563 22.557 -15.082 1.00 0.00 H new ATOM 0 HH21 ARG A 46 34.221 24.827 -13.916 1.00 0.00 H new ATOM 0 HH22 ARG A 46 35.925 24.500 -14.246 1.00 0.00 H new ATOM 713 N ASP A 47 28.513 17.714 -14.662 1.00 0.00 N ATOM 714 CA ASP A 47 27.753 16.535 -15.126 1.00 0.00 C ATOM 715 C ASP A 47 26.248 16.619 -14.796 1.00 0.00 C ATOM 716 O ASP A 47 25.410 16.089 -15.530 1.00 0.00 O ATOM 717 CB ASP A 47 28.362 15.266 -14.496 1.00 0.00 C ATOM 718 CG ASP A 47 28.042 13.958 -15.250 1.00 0.00 C ATOM 719 OD1 ASP A 47 27.517 13.985 -16.389 1.00 0.00 O ATOM 720 OD2 ASP A 47 28.376 12.876 -14.714 1.00 0.00 O ATOM 0 H ASP A 47 28.069 18.201 -13.883 1.00 0.00 H new ATOM 0 HA ASP A 47 27.830 16.501 -16.213 1.00 0.00 H new ATOM 0 HB2 ASP A 47 29.444 15.385 -14.445 1.00 0.00 H new ATOM 0 HB3 ASP A 47 28.002 15.176 -13.471 1.00 0.00 H new ATOM 725 N ALA A 48 25.887 17.330 -13.722 1.00 0.00 N ATOM 726 CA ALA A 48 24.502 17.561 -13.322 1.00 0.00 C ATOM 727 C ALA A 48 23.788 18.640 -14.156 1.00 0.00 C ATOM 728 O ALA A 48 24.424 19.515 -14.750 1.00 0.00 O ATOM 729 CB ALA A 48 24.477 17.914 -11.837 1.00 0.00 C ATOM 0 H ALA A 48 26.565 17.767 -13.098 1.00 0.00 H new ATOM 0 HA ALA A 48 23.946 16.642 -13.508 1.00 0.00 H new ATOM 0 HB1 ALA A 48 23.448 18.090 -11.522 1.00 0.00 H new ATOM 0 HB2 ALA A 48 24.897 17.090 -11.260 1.00 0.00 H new ATOM 0 HB3 ALA A 48 25.067 18.814 -11.667 1.00 0.00 H new ATOM 735 N ARG A 49 22.447 18.605 -14.143 1.00 0.00 N ATOM 736 CA ARG A 49 21.591 19.589 -14.829 1.00 0.00 C ATOM 737 C ARG A 49 21.408 20.867 -13.996 1.00 0.00 C ATOM 738 O ARG A 49 21.631 21.966 -14.506 1.00 0.00 O ATOM 739 CB ARG A 49 20.250 18.918 -15.200 1.00 0.00 C ATOM 740 CG ARG A 49 19.530 19.600 -16.373 1.00 0.00 C ATOM 741 CD ARG A 49 20.164 19.275 -17.732 1.00 0.00 C ATOM 742 NE ARG A 49 19.403 19.902 -18.832 1.00 0.00 N ATOM 743 CZ ARG A 49 19.694 19.855 -20.122 1.00 0.00 C ATOM 744 NH1 ARG A 49 20.735 19.212 -20.574 1.00 0.00 N ATOM 745 NH2 ARG A 49 18.936 20.459 -20.991 1.00 0.00 N ATOM 0 H ARG A 49 21.919 17.885 -13.650 1.00 0.00 H new ATOM 0 HA ARG A 49 22.078 19.913 -15.749 1.00 0.00 H new ATOM 0 HB2 ARG A 49 20.433 17.874 -15.453 1.00 0.00 H new ATOM 0 HB3 ARG A 49 19.596 18.925 -14.328 1.00 0.00 H new ATOM 0 HG2 ARG A 49 18.485 19.290 -16.382 1.00 0.00 H new ATOM 0 HG3 ARG A 49 19.541 20.679 -16.221 1.00 0.00 H new ATOM 0 HD2 ARG A 49 21.195 19.628 -17.750 1.00 0.00 H new ATOM 0 HD3 ARG A 49 20.194 18.195 -17.875 1.00 0.00 H new ATOM 0 HE ARG A 49 18.567 20.425 -18.570 1.00 0.00 H new ATOM 0 HH11 ARG A 49 21.354 18.725 -19.926 1.00 0.00 H new ATOM 0 HH12 ARG A 49 20.930 19.196 -21.575 1.00 0.00 H new ATOM 0 HH21 ARG A 49 18.112 20.973 -20.679 1.00 0.00 H new ATOM 0 HH22 ARG A 49 19.166 20.419 -21.984 1.00 0.00 H new ATOM 759 N TYR A 50 21.048 20.719 -12.717 1.00 0.00 N ATOM 760 CA TYR A 50 20.702 21.805 -11.796 1.00 0.00 C ATOM 761 C TYR A 50 21.489 21.697 -10.478 1.00 0.00 C ATOM 762 O TYR A 50 21.512 20.629 -9.862 1.00 0.00 O ATOM 763 CB TYR A 50 19.182 21.751 -11.508 1.00 0.00 C ATOM 764 CG TYR A 50 18.273 21.440 -12.689 1.00 0.00 C ATOM 765 CD1 TYR A 50 18.411 22.148 -13.896 1.00 0.00 C ATOM 766 CD2 TYR A 50 17.258 20.470 -12.569 1.00 0.00 C ATOM 767 CE1 TYR A 50 17.534 21.907 -14.969 1.00 0.00 C ATOM 768 CE2 TYR A 50 16.387 20.208 -13.646 1.00 0.00 C ATOM 769 CZ TYR A 50 16.521 20.934 -14.849 1.00 0.00 C ATOM 770 OH TYR A 50 15.679 20.706 -15.893 1.00 0.00 O ATOM 0 H TYR A 50 20.987 19.801 -12.277 1.00 0.00 H new ATOM 0 HA TYR A 50 20.965 22.755 -12.261 1.00 0.00 H new ATOM 0 HB2 TYR A 50 19.008 21.000 -10.738 1.00 0.00 H new ATOM 0 HB3 TYR A 50 18.880 22.712 -11.090 1.00 0.00 H new ATOM 0 HD1 TYR A 50 19.196 22.882 -14.000 1.00 0.00 H new ATOM 0 HD2 TYR A 50 17.146 19.923 -11.645 1.00 0.00 H new ATOM 0 HE1 TYR A 50 17.637 22.468 -15.886 1.00 0.00 H new ATOM 0 HE2 TYR A 50 15.620 19.454 -13.551 1.00 0.00 H new ATOM 0 HH TYR A 50 15.039 20.005 -15.650 1.00 0.00 H new ATOM 780 N ALA A 51 22.115 22.785 -10.014 1.00 0.00 N ATOM 781 CA ALA A 51 22.696 22.867 -8.663 1.00 0.00 C ATOM 782 C ALA A 51 21.805 23.760 -7.774 1.00 0.00 C ATOM 783 O ALA A 51 21.247 24.743 -8.261 1.00 0.00 O ATOM 784 CB ALA A 51 24.141 23.375 -8.748 1.00 0.00 C ATOM 0 H ALA A 51 22.235 23.636 -10.563 1.00 0.00 H new ATOM 0 HA ALA A 51 22.731 21.879 -8.204 1.00 0.00 H new ATOM 0 HB1 ALA A 51 24.566 23.434 -7.746 1.00 0.00 H new ATOM 0 HB2 ALA A 51 24.733 22.689 -9.353 1.00 0.00 H new ATOM 0 HB3 ALA A 51 24.153 24.364 -9.205 1.00 0.00 H new ATOM 790 N VAL A 52 21.637 23.430 -6.491 1.00 0.00 N ATOM 791 CA VAL A 52 20.664 24.072 -5.582 1.00 0.00 C ATOM 792 C VAL A 52 21.296 24.309 -4.206 1.00 0.00 C ATOM 793 O VAL A 52 22.022 23.461 -3.686 1.00 0.00 O ATOM 794 CB VAL A 52 19.367 23.234 -5.494 1.00 0.00 C ATOM 795 CG1 VAL A 52 18.380 23.786 -4.454 1.00 0.00 C ATOM 796 CG2 VAL A 52 18.646 23.174 -6.848 1.00 0.00 C ATOM 0 H VAL A 52 22.181 22.695 -6.039 1.00 0.00 H new ATOM 0 HA VAL A 52 20.389 25.047 -5.985 1.00 0.00 H new ATOM 0 HB VAL A 52 19.684 22.236 -5.191 1.00 0.00 H new ATOM 0 HG11 VAL A 52 17.487 23.161 -4.432 1.00 0.00 H new ATOM 0 HG12 VAL A 52 18.849 23.783 -3.470 1.00 0.00 H new ATOM 0 HG13 VAL A 52 18.103 24.806 -4.721 1.00 0.00 H new ATOM 0 HG21 VAL A 52 17.739 22.578 -6.751 1.00 0.00 H new ATOM 0 HG22 VAL A 52 18.384 24.183 -7.166 1.00 0.00 H new ATOM 0 HG23 VAL A 52 19.302 22.718 -7.590 1.00 0.00 H new ATOM 806 N ILE A 53 21.009 25.469 -3.608 1.00 0.00 N ATOM 807 CA ILE A 53 21.681 25.972 -2.398 1.00 0.00 C ATOM 808 C ILE A 53 20.753 26.216 -1.208 1.00 0.00 C ATOM 809 O ILE A 53 19.740 26.898 -1.330 1.00 0.00 O ATOM 810 CB ILE A 53 22.515 27.225 -2.783 1.00 0.00 C ATOM 811 CG1 ILE A 53 23.982 26.833 -3.032 1.00 0.00 C ATOM 812 CG2 ILE A 53 22.444 28.433 -1.817 1.00 0.00 C ATOM 813 CD1 ILE A 53 24.704 26.294 -1.792 1.00 0.00 C ATOM 0 H ILE A 53 20.288 26.101 -3.956 1.00 0.00 H new ATOM 0 HA ILE A 53 22.343 25.187 -2.032 1.00 0.00 H new ATOM 0 HB ILE A 53 22.039 27.586 -3.695 1.00 0.00 H new ATOM 0 HG12 ILE A 53 24.017 26.077 -3.817 1.00 0.00 H new ATOM 0 HG13 ILE A 53 24.522 27.704 -3.404 1.00 0.00 H new ATOM 0 HG21 ILE A 53 23.069 29.241 -2.198 1.00 0.00 H new ATOM 0 HG22 ILE A 53 21.413 28.777 -1.740 1.00 0.00 H new ATOM 0 HG23 ILE A 53 22.801 28.132 -0.832 1.00 0.00 H new ATOM 0 HD11 ILE A 53 25.732 26.041 -2.051 1.00 0.00 H new ATOM 0 HD12 ILE A 53 24.703 27.055 -1.011 1.00 0.00 H new ATOM 0 HD13 ILE A 53 24.191 25.403 -1.431 1.00 0.00 H new ATOM 825 N ARG A 54 21.173 25.734 -0.031 1.00 0.00 N ATOM 826 CA ARG A 54 20.552 25.993 1.279 1.00 0.00 C ATOM 827 C ARG A 54 21.637 26.379 2.299 1.00 0.00 C ATOM 828 O ARG A 54 22.096 25.558 3.086 1.00 0.00 O ATOM 829 CB ARG A 54 19.764 24.743 1.721 1.00 0.00 C ATOM 830 CG ARG A 54 18.682 24.233 0.752 1.00 0.00 C ATOM 831 CD ARG A 54 17.505 25.203 0.587 1.00 0.00 C ATOM 832 NE ARG A 54 16.569 24.731 -0.456 1.00 0.00 N ATOM 833 CZ ARG A 54 15.583 23.857 -0.326 1.00 0.00 C ATOM 834 NH1 ARG A 54 15.308 23.279 0.809 1.00 0.00 N ATOM 835 NH2 ARG A 54 14.847 23.538 -1.352 1.00 0.00 N ATOM 0 H ARG A 54 21.990 25.127 0.040 1.00 0.00 H new ATOM 0 HA ARG A 54 19.853 26.827 1.211 1.00 0.00 H new ATOM 0 HB2 ARG A 54 20.475 23.935 1.894 1.00 0.00 H new ATOM 0 HB3 ARG A 54 19.290 24.960 2.678 1.00 0.00 H new ATOM 0 HG2 ARG A 54 19.134 24.053 -0.223 1.00 0.00 H new ATOM 0 HG3 ARG A 54 18.306 23.275 1.111 1.00 0.00 H new ATOM 0 HD2 ARG A 54 16.977 25.304 1.535 1.00 0.00 H new ATOM 0 HD3 ARG A 54 17.879 26.192 0.324 1.00 0.00 H new ATOM 0 HE ARG A 54 16.699 25.126 -1.387 1.00 0.00 H new ATOM 0 HH11 ARG A 54 15.861 23.495 1.638 1.00 0.00 H new ATOM 0 HH12 ARG A 54 14.540 22.611 0.868 1.00 0.00 H new ATOM 0 HH21 ARG A 54 15.029 23.962 -2.262 1.00 0.00 H new ATOM 0 HH22 ARG A 54 14.089 22.864 -1.246 1.00 0.00 H new ATOM 849 N ILE A 55 22.090 27.631 2.257 1.00 0.00 N ATOM 850 CA ILE A 55 23.005 28.219 3.262 1.00 0.00 C ATOM 851 C ILE A 55 22.182 28.999 4.307 1.00 0.00 C ATOM 852 O ILE A 55 21.347 29.815 3.908 1.00 0.00 O ATOM 853 CB ILE A 55 24.053 29.130 2.579 1.00 0.00 C ATOM 854 CG1 ILE A 55 24.984 28.337 1.640 1.00 0.00 C ATOM 855 CG2 ILE A 55 24.935 29.872 3.605 1.00 0.00 C ATOM 856 CD1 ILE A 55 25.472 29.179 0.467 1.00 0.00 C ATOM 0 H ILE A 55 21.834 28.284 1.516 1.00 0.00 H new ATOM 0 HA ILE A 55 23.548 27.421 3.768 1.00 0.00 H new ATOM 0 HB ILE A 55 23.475 29.852 2.002 1.00 0.00 H new ATOM 0 HG12 ILE A 55 25.842 27.972 2.205 1.00 0.00 H new ATOM 0 HG13 ILE A 55 24.456 27.462 1.262 1.00 0.00 H new ATOM 0 HG21 ILE A 55 25.655 30.499 3.080 1.00 0.00 H new ATOM 0 HG22 ILE A 55 24.307 30.496 4.241 1.00 0.00 H new ATOM 0 HG23 ILE A 55 25.467 29.146 4.220 1.00 0.00 H new ATOM 0 HD11 ILE A 55 26.124 28.578 -0.166 1.00 0.00 H new ATOM 0 HD12 ILE A 55 24.617 29.522 -0.115 1.00 0.00 H new ATOM 0 HD13 ILE A 55 26.024 30.040 0.842 1.00 0.00 H new ATOM 868 N PRO A 56 22.409 28.819 5.623 1.00 0.00 N ATOM 869 CA PRO A 56 21.725 29.611 6.648 1.00 0.00 C ATOM 870 C PRO A 56 22.128 31.097 6.576 1.00 0.00 C ATOM 871 O PRO A 56 23.312 31.438 6.525 1.00 0.00 O ATOM 872 CB PRO A 56 22.093 28.958 7.985 1.00 0.00 C ATOM 873 CG PRO A 56 23.442 28.298 7.707 1.00 0.00 C ATOM 874 CD PRO A 56 23.316 27.862 6.249 1.00 0.00 C ATOM 0 HA PRO A 56 20.644 29.614 6.508 1.00 0.00 H new ATOM 0 HB2 PRO A 56 22.165 29.696 8.784 1.00 0.00 H new ATOM 0 HB3 PRO A 56 21.345 28.227 8.293 1.00 0.00 H new ATOM 0 HG2 PRO A 56 24.269 28.993 7.850 1.00 0.00 H new ATOM 0 HG3 PRO A 56 23.620 27.450 8.368 1.00 0.00 H new ATOM 0 HD2 PRO A 56 24.288 27.864 5.755 1.00 0.00 H new ATOM 0 HD3 PRO A 56 22.924 26.847 6.177 1.00 0.00 H new ATOM 882 N GLY A 57 21.133 31.990 6.579 1.00 0.00 N ATOM 883 CA GLY A 57 21.319 33.450 6.591 1.00 0.00 C ATOM 884 C GLY A 57 21.453 34.128 5.219 1.00 0.00 C ATOM 885 O GLY A 57 21.634 35.348 5.172 1.00 0.00 O ATOM 0 H GLY A 57 20.151 31.714 6.573 1.00 0.00 H new ATOM 0 HA2 GLY A 57 20.474 33.899 7.114 1.00 0.00 H new ATOM 0 HA3 GLY A 57 22.212 33.677 7.174 1.00 0.00 H new ATOM 889 N GLN A 58 21.343 33.385 4.107 1.00 0.00 N ATOM 890 CA GLN A 58 21.290 33.937 2.740 1.00 0.00 C ATOM 891 C GLN A 58 20.233 33.220 1.869 1.00 0.00 C ATOM 892 O GLN A 58 19.870 32.079 2.171 1.00 0.00 O ATOM 893 CB GLN A 58 22.709 33.944 2.140 1.00 0.00 C ATOM 894 CG GLN A 58 23.234 32.615 1.594 1.00 0.00 C ATOM 895 CD GLN A 58 24.703 32.747 1.172 1.00 0.00 C ATOM 896 OE1 GLN A 58 25.065 32.642 0.007 1.00 0.00 O ATOM 897 NE2 GLN A 58 25.600 33.008 2.103 1.00 0.00 N ATOM 0 H GLN A 58 21.287 32.367 4.130 1.00 0.00 H new ATOM 0 HA GLN A 58 20.951 34.972 2.773 1.00 0.00 H new ATOM 0 HB2 GLN A 58 22.733 34.676 1.333 1.00 0.00 H new ATOM 0 HB3 GLN A 58 23.400 34.293 2.907 1.00 0.00 H new ATOM 0 HG2 GLN A 58 23.137 31.840 2.354 1.00 0.00 H new ATOM 0 HG3 GLN A 58 22.632 32.303 0.741 1.00 0.00 H new ATOM 0 HE21 GLN A 58 25.312 33.098 3.077 1.00 0.00 H new ATOM 0 HE22 GLN A 58 26.581 33.120 1.849 1.00 0.00 H new ATOM 906 N PRO A 59 19.701 33.863 0.809 1.00 0.00 N ATOM 907 CA PRO A 59 18.599 33.310 0.021 1.00 0.00 C ATOM 908 C PRO A 59 19.000 32.062 -0.781 1.00 0.00 C ATOM 909 O PRO A 59 20.149 31.903 -1.203 1.00 0.00 O ATOM 910 CB PRO A 59 18.125 34.452 -0.885 1.00 0.00 C ATOM 911 CG PRO A 59 19.376 35.314 -1.048 1.00 0.00 C ATOM 912 CD PRO A 59 20.051 35.189 0.315 1.00 0.00 C ATOM 0 HA PRO A 59 17.799 32.957 0.673 1.00 0.00 H new ATOM 0 HB2 PRO A 59 17.764 34.081 -1.844 1.00 0.00 H new ATOM 0 HB3 PRO A 59 17.307 35.012 -0.432 1.00 0.00 H new ATOM 0 HG2 PRO A 59 20.016 34.950 -1.852 1.00 0.00 H new ATOM 0 HG3 PRO A 59 19.127 36.349 -1.283 1.00 0.00 H new ATOM 0 HD2 PRO A 59 21.132 35.302 0.228 1.00 0.00 H new ATOM 0 HD3 PRO A 59 19.703 35.965 0.997 1.00 0.00 H new ATOM 920 N VAL A 60 18.020 31.185 -1.025 1.00 0.00 N ATOM 921 CA VAL A 60 18.156 30.007 -1.898 1.00 0.00 C ATOM 922 C VAL A 60 18.544 30.415 -3.327 1.00 0.00 C ATOM 923 O VAL A 60 17.929 31.296 -3.934 1.00 0.00 O ATOM 924 CB VAL A 60 16.878 29.131 -1.864 1.00 0.00 C ATOM 925 CG1 VAL A 60 15.574 29.911 -2.094 1.00 0.00 C ATOM 926 CG2 VAL A 60 16.901 27.987 -2.887 1.00 0.00 C ATOM 0 H VAL A 60 17.090 31.273 -0.614 1.00 0.00 H new ATOM 0 HA VAL A 60 18.970 29.394 -1.511 1.00 0.00 H new ATOM 0 HB VAL A 60 16.889 28.734 -0.849 1.00 0.00 H new ATOM 0 HG11 VAL A 60 14.728 29.225 -2.055 1.00 0.00 H new ATOM 0 HG12 VAL A 60 15.462 30.670 -1.319 1.00 0.00 H new ATOM 0 HG13 VAL A 60 15.606 30.392 -3.071 1.00 0.00 H new ATOM 0 HG21 VAL A 60 15.978 27.412 -2.811 1.00 0.00 H new ATOM 0 HG22 VAL A 60 16.990 28.399 -3.892 1.00 0.00 H new ATOM 0 HG23 VAL A 60 17.751 27.336 -2.685 1.00 0.00 H new ATOM 936 N VAL A 61 19.561 29.740 -3.871 1.00 0.00 N ATOM 937 CA VAL A 61 19.971 29.810 -5.287 1.00 0.00 C ATOM 938 C VAL A 61 19.624 28.487 -5.975 1.00 0.00 C ATOM 939 O VAL A 61 19.839 27.416 -5.407 1.00 0.00 O ATOM 940 CB VAL A 61 21.471 30.159 -5.415 1.00 0.00 C ATOM 941 CG1 VAL A 61 21.964 30.163 -6.867 1.00 0.00 C ATOM 942 CG2 VAL A 61 21.768 31.538 -4.815 1.00 0.00 C ATOM 0 H VAL A 61 20.145 29.107 -3.324 1.00 0.00 H new ATOM 0 HA VAL A 61 19.426 30.611 -5.786 1.00 0.00 H new ATOM 0 HB VAL A 61 21.998 29.377 -4.868 1.00 0.00 H new ATOM 0 HG11 VAL A 61 23.024 30.415 -6.891 1.00 0.00 H new ATOM 0 HG12 VAL A 61 21.816 29.176 -7.304 1.00 0.00 H new ATOM 0 HG13 VAL A 61 21.403 30.901 -7.440 1.00 0.00 H new ATOM 0 HG21 VAL A 61 22.830 31.759 -4.918 1.00 0.00 H new ATOM 0 HG22 VAL A 61 21.187 32.296 -5.340 1.00 0.00 H new ATOM 0 HG23 VAL A 61 21.498 31.541 -3.759 1.00 0.00 H new ATOM 952 N GLU A 62 19.105 28.557 -7.201 1.00 0.00 N ATOM 953 CA GLU A 62 18.778 27.403 -8.051 1.00 0.00 C ATOM 954 C GLU A 62 19.337 27.652 -9.461 1.00 0.00 C ATOM 955 O GLU A 62 18.938 28.604 -10.137 1.00 0.00 O ATOM 956 CB GLU A 62 17.251 27.184 -8.105 1.00 0.00 C ATOM 957 CG GLU A 62 16.629 26.874 -6.738 1.00 0.00 C ATOM 958 CD GLU A 62 15.101 26.711 -6.828 1.00 0.00 C ATOM 959 OE1 GLU A 62 14.382 27.721 -7.021 1.00 0.00 O ATOM 960 OE2 GLU A 62 14.586 25.578 -6.671 1.00 0.00 O ATOM 0 H GLU A 62 18.892 29.448 -7.649 1.00 0.00 H new ATOM 0 HA GLU A 62 19.229 26.503 -7.633 1.00 0.00 H new ATOM 0 HB2 GLU A 62 16.778 28.076 -8.517 1.00 0.00 H new ATOM 0 HB3 GLU A 62 17.034 26.364 -8.789 1.00 0.00 H new ATOM 0 HG2 GLU A 62 17.069 25.961 -6.337 1.00 0.00 H new ATOM 0 HG3 GLU A 62 16.868 27.676 -6.040 1.00 0.00 H new ATOM 967 N VAL A 63 20.286 26.823 -9.904 1.00 0.00 N ATOM 968 CA VAL A 63 21.002 26.952 -11.181 1.00 0.00 C ATOM 969 C VAL A 63 20.317 26.138 -12.285 1.00 0.00 C ATOM 970 O VAL A 63 19.716 25.099 -12.012 1.00 0.00 O ATOM 971 CB VAL A 63 22.452 26.483 -10.982 1.00 0.00 C ATOM 972 CG1 VAL A 63 23.325 26.701 -12.215 1.00 0.00 C ATOM 973 CG2 VAL A 63 23.132 27.188 -9.807 1.00 0.00 C ATOM 0 H VAL A 63 20.590 26.012 -9.365 1.00 0.00 H new ATOM 0 HA VAL A 63 20.991 27.996 -11.495 1.00 0.00 H new ATOM 0 HB VAL A 63 22.366 25.415 -10.783 1.00 0.00 H new ATOM 0 HG11 VAL A 63 24.337 26.350 -12.011 1.00 0.00 H new ATOM 0 HG12 VAL A 63 22.911 26.146 -13.057 1.00 0.00 H new ATOM 0 HG13 VAL A 63 23.352 27.763 -12.459 1.00 0.00 H new ATOM 0 HG21 VAL A 63 24.154 26.823 -9.706 1.00 0.00 H new ATOM 0 HG22 VAL A 63 23.146 28.263 -9.986 1.00 0.00 H new ATOM 0 HG23 VAL A 63 22.581 26.981 -8.890 1.00 0.00 H new ATOM 983 N GLY A 64 20.453 26.560 -13.546 1.00 0.00 N ATOM 984 CA GLY A 64 19.907 25.835 -14.694 1.00 0.00 C ATOM 985 C GLY A 64 18.401 26.072 -14.845 1.00 0.00 C ATOM 986 O GLY A 64 17.996 27.104 -15.389 1.00 0.00 O ATOM 0 H GLY A 64 20.946 27.416 -13.798 1.00 0.00 H new ATOM 0 HA2 GLY A 64 20.419 26.152 -15.603 1.00 0.00 H new ATOM 0 HA3 GLY A 64 20.098 24.768 -14.576 1.00 0.00 H new ATOM 990 N THR A 65 17.581 25.145 -14.339 1.00 0.00 N ATOM 991 CA THR A 65 16.105 25.244 -14.340 1.00 0.00 C ATOM 992 C THR A 65 15.544 24.576 -13.080 1.00 0.00 C ATOM 993 O THR A 65 16.125 23.626 -12.562 1.00 0.00 O ATOM 994 CB THR A 65 15.468 24.589 -15.591 1.00 0.00 C ATOM 995 OG1 THR A 65 16.166 24.910 -16.780 1.00 0.00 O ATOM 996 CG2 THR A 65 14.020 25.031 -15.822 1.00 0.00 C ATOM 0 H THR A 65 17.924 24.287 -13.908 1.00 0.00 H new ATOM 0 HA THR A 65 15.852 26.304 -14.358 1.00 0.00 H new ATOM 0 HB THR A 65 15.515 23.520 -15.382 1.00 0.00 H new ATOM 0 HG1 THR A 65 15.731 24.475 -17.543 1.00 0.00 H new ATOM 0 HG21 THR A 65 13.627 24.539 -16.712 1.00 0.00 H new ATOM 0 HG22 THR A 65 13.414 24.757 -14.959 1.00 0.00 H new ATOM 0 HG23 THR A 65 13.987 26.112 -15.960 1.00 0.00 H new ATOM 1004 N LYS A 66 14.404 25.041 -12.562 1.00 0.00 N ATOM 1005 CA LYS A 66 13.734 24.407 -11.418 1.00 0.00 C ATOM 1006 C LYS A 66 13.125 23.047 -11.833 1.00 0.00 C ATOM 1007 O LYS A 66 12.384 22.999 -12.822 1.00 0.00 O ATOM 1008 CB LYS A 66 12.686 25.373 -10.838 1.00 0.00 C ATOM 1009 CG LYS A 66 12.202 24.924 -9.453 1.00 0.00 C ATOM 1010 CD LYS A 66 11.159 25.900 -8.888 1.00 0.00 C ATOM 1011 CE LYS A 66 10.799 25.565 -7.434 1.00 0.00 C ATOM 1012 NZ LYS A 66 11.836 26.041 -6.478 1.00 0.00 N ATOM 0 H LYS A 66 13.919 25.864 -12.920 1.00 0.00 H new ATOM 0 HA LYS A 66 14.460 24.196 -10.633 1.00 0.00 H new ATOM 0 HB2 LYS A 66 13.114 26.373 -10.767 1.00 0.00 H new ATOM 0 HB3 LYS A 66 11.836 25.437 -11.517 1.00 0.00 H new ATOM 0 HG2 LYS A 66 11.771 23.925 -9.521 1.00 0.00 H new ATOM 0 HG3 LYS A 66 13.050 24.859 -8.772 1.00 0.00 H new ATOM 0 HD2 LYS A 66 11.546 26.918 -8.942 1.00 0.00 H new ATOM 0 HD3 LYS A 66 10.259 25.868 -9.503 1.00 0.00 H new ATOM 0 HE2 LYS A 66 9.840 26.019 -7.184 1.00 0.00 H new ATOM 0 HE3 LYS A 66 10.678 24.487 -7.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 11.605 25.707 -5.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 12.765 25.669 -6.760 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 11.863 27.081 -6.484 1.00 0.00 H new ATOM 1026 N PRO A 67 13.420 21.945 -11.118 1.00 0.00 N ATOM 1027 CA PRO A 67 13.018 20.593 -11.497 1.00 0.00 C ATOM 1028 C PRO A 67 11.537 20.269 -11.248 1.00 0.00 C ATOM 1029 O PRO A 67 10.876 20.826 -10.371 1.00 0.00 O ATOM 1030 CB PRO A 67 13.913 19.655 -10.694 1.00 0.00 C ATOM 1031 CG PRO A 67 14.268 20.463 -9.456 1.00 0.00 C ATOM 1032 CD PRO A 67 14.312 21.895 -9.974 1.00 0.00 C ATOM 0 HA PRO A 67 13.134 20.480 -12.575 1.00 0.00 H new ATOM 0 HB2 PRO A 67 13.394 18.732 -10.434 1.00 0.00 H new ATOM 0 HB3 PRO A 67 14.803 19.373 -11.256 1.00 0.00 H new ATOM 0 HG2 PRO A 67 13.523 20.342 -8.669 1.00 0.00 H new ATOM 0 HG3 PRO A 67 15.227 20.157 -9.037 1.00 0.00 H new ATOM 0 HD2 PRO A 67 13.994 22.597 -9.203 1.00 0.00 H new ATOM 0 HD3 PRO A 67 15.326 22.173 -10.260 1.00 0.00 H new ATOM 1040 N THR A 68 11.046 19.304 -12.033 1.00 0.00 N ATOM 1041 CA THR A 68 9.606 18.972 -12.127 1.00 0.00 C ATOM 1042 C THR A 68 9.088 18.031 -11.022 1.00 0.00 C ATOM 1043 O THR A 68 7.896 18.036 -10.708 1.00 0.00 O ATOM 1044 CB THR A 68 9.303 18.436 -13.541 1.00 0.00 C ATOM 1045 OG1 THR A 68 7.916 18.344 -13.786 1.00 0.00 O ATOM 1046 CG2 THR A 68 9.913 17.056 -13.810 1.00 0.00 C ATOM 0 H THR A 68 11.635 18.722 -12.629 1.00 0.00 H new ATOM 0 HA THR A 68 9.053 19.895 -11.956 1.00 0.00 H new ATOM 0 HB THR A 68 9.761 19.165 -14.210 1.00 0.00 H new ATOM 0 HG1 THR A 68 7.766 18.002 -14.692 1.00 0.00 H new ATOM 0 HG21 THR A 68 9.662 16.738 -14.822 1.00 0.00 H new ATOM 0 HG22 THR A 68 10.997 17.110 -13.705 1.00 0.00 H new ATOM 0 HG23 THR A 68 9.515 16.337 -13.094 1.00 0.00 H new ATOM 1054 N GLY A 69 9.980 17.243 -10.407 1.00 0.00 N ATOM 1055 CA GLY A 69 9.666 16.229 -9.383 1.00 0.00 C ATOM 1056 C GLY A 69 10.113 14.820 -9.779 1.00 0.00 C ATOM 1057 O GLY A 69 10.621 14.062 -8.953 1.00 0.00 O ATOM 0 H GLY A 69 10.977 17.293 -10.614 1.00 0.00 H new ATOM 0 HA2 GLY A 69 10.147 16.507 -8.445 1.00 0.00 H new ATOM 0 HA3 GLY A 69 8.591 16.225 -9.201 1.00 0.00 H new ATOM 1061 N ASP A 70 10.018 14.506 -11.072 1.00 0.00 N ATOM 1062 CA ASP A 70 10.577 13.306 -11.710 1.00 0.00 C ATOM 1063 C ASP A 70 12.091 13.457 -11.955 1.00 0.00 C ATOM 1064 O ASP A 70 12.583 13.438 -13.087 1.00 0.00 O ATOM 1065 CB ASP A 70 9.782 12.962 -12.976 1.00 0.00 C ATOM 1066 CG ASP A 70 8.273 12.837 -12.714 1.00 0.00 C ATOM 1067 OD1 ASP A 70 7.841 11.800 -12.154 1.00 0.00 O ATOM 1068 OD2 ASP A 70 7.508 13.764 -13.081 1.00 0.00 O ATOM 0 H ASP A 70 9.528 15.106 -11.735 1.00 0.00 H new ATOM 0 HA ASP A 70 10.474 12.457 -11.034 1.00 0.00 H new ATOM 0 HB2 ASP A 70 9.953 13.732 -13.728 1.00 0.00 H new ATOM 0 HB3 ASP A 70 10.154 12.024 -13.390 1.00 0.00 H new ATOM 1073 N VAL A 71 12.829 13.670 -10.862 1.00 0.00 N ATOM 1074 CA VAL A 71 14.268 13.966 -10.837 1.00 0.00 C ATOM 1075 C VAL A 71 15.021 13.114 -9.802 1.00 0.00 C ATOM 1076 O VAL A 71 14.444 12.603 -8.840 1.00 0.00 O ATOM 1077 CB VAL A 71 14.533 15.477 -10.639 1.00 0.00 C ATOM 1078 CG1 VAL A 71 13.971 16.312 -11.807 1.00 0.00 C ATOM 1079 CG2 VAL A 71 13.980 16.029 -9.320 1.00 0.00 C ATOM 0 H VAL A 71 12.423 13.640 -9.927 1.00 0.00 H new ATOM 0 HA VAL A 71 14.665 13.690 -11.814 1.00 0.00 H new ATOM 0 HB VAL A 71 15.619 15.568 -10.609 1.00 0.00 H new ATOM 0 HG11 VAL A 71 14.177 17.368 -11.631 1.00 0.00 H new ATOM 0 HG12 VAL A 71 14.444 16.000 -12.738 1.00 0.00 H new ATOM 0 HG13 VAL A 71 12.894 16.159 -11.878 1.00 0.00 H new ATOM 0 HG21 VAL A 71 14.203 17.094 -9.249 1.00 0.00 H new ATOM 0 HG22 VAL A 71 12.901 15.881 -9.288 1.00 0.00 H new ATOM 0 HG23 VAL A 71 14.443 15.505 -8.484 1.00 0.00 H new ATOM 1089 N LEU A 72 16.331 12.975 -10.008 1.00 0.00 N ATOM 1090 CA LEU A 72 17.303 12.397 -9.077 1.00 0.00 C ATOM 1091 C LEU A 72 17.860 13.492 -8.184 1.00 0.00 C ATOM 1092 O LEU A 72 18.093 14.602 -8.659 1.00 0.00 O ATOM 1093 CB LEU A 72 18.479 11.775 -9.850 1.00 0.00 C ATOM 1094 CG LEU A 72 18.060 10.630 -10.770 1.00 0.00 C ATOM 1095 CD1 LEU A 72 19.224 10.196 -11.659 1.00 0.00 C ATOM 1096 CD2 LEU A 72 17.576 9.435 -9.963 1.00 0.00 C ATOM 0 H LEU A 72 16.768 13.280 -10.878 1.00 0.00 H new ATOM 0 HA LEU A 72 16.800 11.632 -8.485 1.00 0.00 H new ATOM 0 HB2 LEU A 72 18.965 12.550 -10.444 1.00 0.00 H new ATOM 0 HB3 LEU A 72 19.219 11.408 -9.139 1.00 0.00 H new ATOM 0 HG LEU A 72 17.245 10.993 -11.396 1.00 0.00 H new ATOM 0 HD11 LEU A 72 18.903 9.380 -12.306 1.00 0.00 H new ATOM 0 HD12 LEU A 72 19.548 11.038 -12.271 1.00 0.00 H new ATOM 0 HD13 LEU A 72 20.053 9.860 -11.035 1.00 0.00 H new ATOM 0 HD21 LEU A 72 17.283 8.633 -10.641 1.00 0.00 H new ATOM 0 HD22 LEU A 72 18.378 9.086 -9.313 1.00 0.00 H new ATOM 0 HD23 LEU A 72 16.719 9.728 -9.357 1.00 0.00 H new ATOM 1108 N GLN A 73 18.125 13.172 -6.920 1.00 0.00 N ATOM 1109 CA GLN A 73 18.607 14.146 -5.930 1.00 0.00 C ATOM 1110 C GLN A 73 19.939 13.722 -5.293 1.00 0.00 C ATOM 1111 O GLN A 73 20.000 12.725 -4.577 1.00 0.00 O ATOM 1112 CB GLN A 73 17.528 14.357 -4.853 1.00 0.00 C ATOM 1113 CG GLN A 73 16.294 15.089 -5.405 1.00 0.00 C ATOM 1114 CD GLN A 73 15.348 15.575 -4.306 1.00 0.00 C ATOM 1115 OE1 GLN A 73 15.157 14.946 -3.271 1.00 0.00 O ATOM 1116 NE2 GLN A 73 14.720 16.715 -4.485 1.00 0.00 N ATOM 0 H GLN A 73 18.013 12.229 -6.547 1.00 0.00 H new ATOM 0 HA GLN A 73 18.797 15.086 -6.447 1.00 0.00 H new ATOM 0 HB2 GLN A 73 17.225 13.391 -4.450 1.00 0.00 H new ATOM 0 HB3 GLN A 73 17.949 14.930 -4.026 1.00 0.00 H new ATOM 0 HG2 GLN A 73 16.620 15.942 -6.000 1.00 0.00 H new ATOM 0 HG3 GLN A 73 15.752 14.422 -6.075 1.00 0.00 H new ATOM 0 HE21 GLN A 73 14.868 17.250 -5.341 1.00 0.00 H new ATOM 0 HE22 GLN A 73 14.084 17.065 -3.768 1.00 0.00 H new ATOM 1125 N GLY A 74 21.006 14.481 -5.551 1.00 0.00 N ATOM 1126 CA GLY A 74 22.305 14.376 -4.867 1.00 0.00 C ATOM 1127 C GLY A 74 22.355 15.413 -3.745 1.00 0.00 C ATOM 1128 O GLY A 74 21.802 16.494 -3.928 1.00 0.00 O ATOM 0 H GLY A 74 20.994 15.210 -6.264 1.00 0.00 H new ATOM 0 HA2 GLY A 74 22.438 13.373 -4.461 1.00 0.00 H new ATOM 0 HA3 GLY A 74 23.118 14.544 -5.573 1.00 0.00 H new ATOM 1132 N ARG A 75 22.976 15.137 -2.592 1.00 0.00 N ATOM 1133 CA ARG A 75 22.865 16.010 -1.399 1.00 0.00 C ATOM 1134 C ARG A 75 24.071 15.913 -0.453 1.00 0.00 C ATOM 1135 O ARG A 75 24.566 14.823 -0.175 1.00 0.00 O ATOM 1136 CB ARG A 75 21.558 15.670 -0.652 1.00 0.00 C ATOM 1137 CG ARG A 75 21.184 16.719 0.409 1.00 0.00 C ATOM 1138 CD ARG A 75 19.875 16.336 1.112 1.00 0.00 C ATOM 1139 NE ARG A 75 19.513 17.310 2.164 1.00 0.00 N ATOM 1140 CZ ARG A 75 19.952 17.353 3.411 1.00 0.00 C ATOM 1141 NH1 ARG A 75 20.840 16.516 3.869 1.00 0.00 N ATOM 1142 NH2 ARG A 75 19.499 18.253 4.236 1.00 0.00 N ATOM 0 H ARG A 75 23.564 14.315 -2.452 1.00 0.00 H new ATOM 0 HA ARG A 75 22.849 17.042 -1.748 1.00 0.00 H new ATOM 0 HB2 ARG A 75 20.745 15.584 -1.373 1.00 0.00 H new ATOM 0 HB3 ARG A 75 21.662 14.697 -0.172 1.00 0.00 H new ATOM 0 HG2 ARG A 75 21.986 16.803 1.143 1.00 0.00 H new ATOM 0 HG3 ARG A 75 21.078 17.697 -0.061 1.00 0.00 H new ATOM 0 HD2 ARG A 75 19.071 16.278 0.378 1.00 0.00 H new ATOM 0 HD3 ARG A 75 19.976 15.344 1.553 1.00 0.00 H new ATOM 0 HE ARG A 75 18.846 18.034 1.897 1.00 0.00 H new ATOM 0 HH11 ARG A 75 21.223 15.794 3.259 1.00 0.00 H new ATOM 0 HH12 ARG A 75 21.152 16.583 4.838 1.00 0.00 H new ATOM 0 HH21 ARG A 75 18.803 18.929 3.922 1.00 0.00 H new ATOM 0 HH22 ARG A 75 19.841 18.282 5.197 1.00 0.00 H new ATOM 1156 N ALA A 76 24.511 17.065 0.055 1.00 0.00 N ATOM 1157 CA ALA A 76 25.686 17.209 0.918 1.00 0.00 C ATOM 1158 C ALA A 76 25.545 18.315 1.979 1.00 0.00 C ATOM 1159 O ALA A 76 24.690 19.197 1.877 1.00 0.00 O ATOM 1160 CB ALA A 76 26.881 17.471 -0.004 1.00 0.00 C ATOM 0 H ALA A 76 24.044 17.953 -0.129 1.00 0.00 H new ATOM 0 HA ALA A 76 25.817 16.295 1.497 1.00 0.00 H new ATOM 0 HB1 ALA A 76 27.784 17.586 0.595 1.00 0.00 H new ATOM 0 HB2 ALA A 76 27.004 16.631 -0.688 1.00 0.00 H new ATOM 0 HB3 ALA A 76 26.706 18.382 -0.576 1.00 0.00 H new ATOM 1166 N THR A 77 26.452 18.298 2.959 1.00 0.00 N ATOM 1167 CA THR A 77 26.602 19.323 4.008 1.00 0.00 C ATOM 1168 C THR A 77 28.010 19.919 3.906 1.00 0.00 C ATOM 1169 O THR A 77 28.992 19.180 3.808 1.00 0.00 O ATOM 1170 CB THR A 77 26.358 18.734 5.409 1.00 0.00 C ATOM 1171 OG1 THR A 77 25.093 18.106 5.461 1.00 0.00 O ATOM 1172 CG2 THR A 77 26.371 19.790 6.520 1.00 0.00 C ATOM 0 H THR A 77 27.131 17.542 3.052 1.00 0.00 H new ATOM 0 HA THR A 77 25.856 20.103 3.858 1.00 0.00 H new ATOM 0 HB THR A 77 27.174 18.031 5.576 1.00 0.00 H new ATOM 0 HG1 THR A 77 24.949 17.734 6.356 1.00 0.00 H new ATOM 0 HG21 THR A 77 26.193 19.309 7.482 1.00 0.00 H new ATOM 0 HG22 THR A 77 27.340 20.288 6.537 1.00 0.00 H new ATOM 0 HG23 THR A 77 25.589 20.525 6.332 1.00 0.00 H new ATOM 1180 N GLY A 78 28.107 21.248 3.892 1.00 0.00 N ATOM 1181 CA GLY A 78 29.374 21.979 3.789 1.00 0.00 C ATOM 1182 C GLY A 78 30.007 22.342 5.140 1.00 0.00 C ATOM 1183 O GLY A 78 29.462 22.055 6.211 1.00 0.00 O ATOM 0 H GLY A 78 27.293 21.860 3.953 1.00 0.00 H new ATOM 0 HA2 GLY A 78 30.082 21.377 3.220 1.00 0.00 H new ATOM 0 HA3 GLY A 78 29.206 22.895 3.222 1.00 0.00 H new ATOM 1187 N GLU A 79 31.188 22.958 5.088 1.00 0.00 N ATOM 1188 CA GLU A 79 32.040 23.185 6.262 1.00 0.00 C ATOM 1189 C GLU A 79 31.706 24.444 7.090 1.00 0.00 C ATOM 1190 O GLU A 79 32.154 24.520 8.239 1.00 0.00 O ATOM 1191 CB GLU A 79 33.516 23.174 5.836 1.00 0.00 C ATOM 1192 CG GLU A 79 34.014 21.820 5.307 1.00 0.00 C ATOM 1193 CD GLU A 79 34.016 20.735 6.402 1.00 0.00 C ATOM 1194 OE1 GLU A 79 34.941 20.726 7.251 1.00 0.00 O ATOM 1195 OE2 GLU A 79 33.101 19.876 6.420 1.00 0.00 O ATOM 0 H GLU A 79 31.587 23.319 4.221 1.00 0.00 H new ATOM 0 HA GLU A 79 31.833 22.360 6.944 1.00 0.00 H new ATOM 0 HB2 GLU A 79 33.664 23.929 5.064 1.00 0.00 H new ATOM 0 HB3 GLU A 79 34.130 23.465 6.688 1.00 0.00 H new ATOM 0 HG2 GLU A 79 33.380 21.499 4.480 1.00 0.00 H new ATOM 0 HG3 GLU A 79 35.022 21.935 4.910 1.00 0.00 H new ATOM 1202 N GLU A 80 30.901 25.398 6.598 1.00 0.00 N ATOM 1203 CA GLU A 80 30.377 26.501 7.428 1.00 0.00 C ATOM 1204 C GLU A 80 28.987 26.179 8.011 1.00 0.00 C ATOM 1205 O GLU A 80 28.358 27.016 8.667 1.00 0.00 O ATOM 1206 CB GLU A 80 30.307 27.787 6.611 1.00 0.00 C ATOM 1207 CG GLU A 80 31.653 28.227 6.040 1.00 0.00 C ATOM 1208 CD GLU A 80 32.581 28.814 7.122 1.00 0.00 C ATOM 1209 OE1 GLU A 80 32.483 30.033 7.409 1.00 0.00 O ATOM 1210 OE2 GLU A 80 33.416 28.074 7.699 1.00 0.00 O ATOM 0 H GLU A 80 30.596 25.430 5.625 1.00 0.00 H new ATOM 0 HA GLU A 80 31.065 26.632 8.263 1.00 0.00 H new ATOM 0 HB2 GLU A 80 29.603 27.648 5.791 1.00 0.00 H new ATOM 0 HB3 GLU A 80 29.911 28.585 7.239 1.00 0.00 H new ATOM 0 HG2 GLU A 80 32.142 27.375 5.568 1.00 0.00 H new ATOM 0 HG3 GLU A 80 31.489 28.972 5.261 1.00 0.00 H new ATOM 1217 N GLY A 81 28.504 24.958 7.777 1.00 0.00 N ATOM 1218 CA GLY A 81 27.219 24.423 8.239 1.00 0.00 C ATOM 1219 C GLY A 81 26.084 24.555 7.220 1.00 0.00 C ATOM 1220 O GLY A 81 24.910 24.437 7.578 1.00 0.00 O ATOM 0 H GLY A 81 29.028 24.276 7.229 1.00 0.00 H new ATOM 0 HA2 GLY A 81 27.346 23.370 8.491 1.00 0.00 H new ATOM 0 HA3 GLY A 81 26.932 24.938 9.156 1.00 0.00 H new ATOM 1224 N GLU A 82 26.412 24.815 5.954 1.00 0.00 N ATOM 1225 CA GLU A 82 25.479 24.906 4.840 1.00 0.00 C ATOM 1226 C GLU A 82 25.049 23.540 4.286 1.00 0.00 C ATOM 1227 O GLU A 82 25.602 22.496 4.633 1.00 0.00 O ATOM 1228 CB GLU A 82 26.088 25.800 3.749 1.00 0.00 C ATOM 1229 CG GLU A 82 27.177 25.203 2.836 1.00 0.00 C ATOM 1230 CD GLU A 82 28.617 25.279 3.389 1.00 0.00 C ATOM 1231 OE1 GLU A 82 28.813 25.200 4.624 1.00 0.00 O ATOM 1232 OE2 GLU A 82 29.558 25.330 2.565 1.00 0.00 O ATOM 0 H GLU A 82 27.378 24.974 5.669 1.00 0.00 H new ATOM 0 HA GLU A 82 24.558 25.356 5.212 1.00 0.00 H new ATOM 0 HB2 GLU A 82 25.275 26.148 3.112 1.00 0.00 H new ATOM 0 HB3 GLU A 82 26.509 26.679 4.237 1.00 0.00 H new ATOM 0 HG2 GLU A 82 26.934 24.158 2.644 1.00 0.00 H new ATOM 0 HG3 GLU A 82 27.146 25.719 1.876 1.00 0.00 H new ATOM 1239 N THR A 83 24.083 23.545 3.368 1.00 0.00 N ATOM 1240 CA THR A 83 23.554 22.356 2.682 1.00 0.00 C ATOM 1241 C THR A 83 23.531 22.596 1.169 1.00 0.00 C ATOM 1242 O THR A 83 23.150 23.665 0.694 1.00 0.00 O ATOM 1243 CB THR A 83 22.168 21.993 3.248 1.00 0.00 C ATOM 1244 OG1 THR A 83 22.324 21.414 4.526 1.00 0.00 O ATOM 1245 CG2 THR A 83 21.363 20.998 2.407 1.00 0.00 C ATOM 0 H THR A 83 23.627 24.407 3.067 1.00 0.00 H new ATOM 0 HA THR A 83 24.205 21.501 2.862 1.00 0.00 H new ATOM 0 HB THR A 83 21.616 22.933 3.261 1.00 0.00 H new ATOM 0 HG1 THR A 83 21.444 21.183 4.890 1.00 0.00 H new ATOM 0 HG21 THR A 83 20.404 20.807 2.888 1.00 0.00 H new ATOM 0 HG22 THR A 83 21.194 21.414 1.414 1.00 0.00 H new ATOM 0 HG23 THR A 83 21.917 20.064 2.319 1.00 0.00 H new ATOM 1253 N VAL A 84 23.943 21.576 0.416 1.00 0.00 N ATOM 1254 CA VAL A 84 23.999 21.561 -1.054 1.00 0.00 C ATOM 1255 C VAL A 84 23.117 20.442 -1.587 1.00 0.00 C ATOM 1256 O VAL A 84 23.146 19.328 -1.071 1.00 0.00 O ATOM 1257 CB VAL A 84 25.448 21.414 -1.556 1.00 0.00 C ATOM 1258 CG1 VAL A 84 25.551 21.277 -3.081 1.00 0.00 C ATOM 1259 CG2 VAL A 84 26.260 22.648 -1.155 1.00 0.00 C ATOM 0 H VAL A 84 24.261 20.698 0.827 1.00 0.00 H new ATOM 0 HA VAL A 84 23.624 22.514 -1.429 1.00 0.00 H new ATOM 0 HB VAL A 84 25.833 20.502 -1.100 1.00 0.00 H new ATOM 0 HG11 VAL A 84 26.598 21.177 -3.367 1.00 0.00 H new ATOM 0 HG12 VAL A 84 25.000 20.394 -3.405 1.00 0.00 H new ATOM 0 HG13 VAL A 84 25.128 22.163 -3.555 1.00 0.00 H new ATOM 0 HG21 VAL A 84 27.284 22.541 -1.511 1.00 0.00 H new ATOM 0 HG22 VAL A 84 25.813 23.538 -1.598 1.00 0.00 H new ATOM 0 HG23 VAL A 84 26.262 22.745 -0.069 1.00 0.00 H new ATOM 1269 N LEU A 85 22.376 20.733 -2.650 1.00 0.00 N ATOM 1270 CA LEU A 85 21.538 19.786 -3.380 1.00 0.00 C ATOM 1271 C LEU A 85 21.870 19.856 -4.882 1.00 0.00 C ATOM 1272 O LEU A 85 22.255 20.900 -5.406 1.00 0.00 O ATOM 1273 CB LEU A 85 20.065 20.094 -3.036 1.00 0.00 C ATOM 1274 CG LEU A 85 19.015 19.162 -3.672 1.00 0.00 C ATOM 1275 CD1 LEU A 85 18.893 17.828 -2.938 1.00 0.00 C ATOM 1276 CD2 LEU A 85 17.641 19.814 -3.633 1.00 0.00 C ATOM 0 H LEU A 85 22.340 21.673 -3.044 1.00 0.00 H new ATOM 0 HA LEU A 85 21.728 18.753 -3.088 1.00 0.00 H new ATOM 0 HB2 LEU A 85 19.949 20.054 -1.953 1.00 0.00 H new ATOM 0 HB3 LEU A 85 19.847 21.117 -3.342 1.00 0.00 H new ATOM 0 HG LEU A 85 19.351 18.984 -4.694 1.00 0.00 H new ATOM 0 HD11 LEU A 85 18.140 17.211 -3.428 1.00 0.00 H new ATOM 0 HD12 LEU A 85 19.853 17.313 -2.958 1.00 0.00 H new ATOM 0 HD13 LEU A 85 18.599 18.007 -1.904 1.00 0.00 H new ATOM 0 HD21 LEU A 85 16.908 19.146 -4.085 1.00 0.00 H new ATOM 0 HD22 LEU A 85 17.362 20.012 -2.598 1.00 0.00 H new ATOM 0 HD23 LEU A 85 17.667 20.752 -4.188 1.00 0.00 H new ATOM 1288 N VAL A 86 21.719 18.739 -5.585 1.00 0.00 N ATOM 1289 CA VAL A 86 21.928 18.588 -7.031 1.00 0.00 C ATOM 1290 C VAL A 86 20.728 17.852 -7.601 1.00 0.00 C ATOM 1291 O VAL A 86 20.327 16.839 -7.031 1.00 0.00 O ATOM 1292 CB VAL A 86 23.208 17.786 -7.334 1.00 0.00 C ATOM 1293 CG1 VAL A 86 23.334 17.512 -8.834 1.00 0.00 C ATOM 1294 CG2 VAL A 86 24.460 18.536 -6.867 1.00 0.00 C ATOM 0 H VAL A 86 21.433 17.865 -5.144 1.00 0.00 H new ATOM 0 HA VAL A 86 22.039 19.574 -7.482 1.00 0.00 H new ATOM 0 HB VAL A 86 23.130 16.844 -6.791 1.00 0.00 H new ATOM 0 HG11 VAL A 86 24.245 16.945 -9.025 1.00 0.00 H new ATOM 0 HG12 VAL A 86 22.471 16.938 -9.173 1.00 0.00 H new ATOM 0 HG13 VAL A 86 23.376 18.458 -9.374 1.00 0.00 H new ATOM 0 HG21 VAL A 86 25.346 17.943 -7.095 1.00 0.00 H new ATOM 0 HG22 VAL A 86 24.523 19.495 -7.381 1.00 0.00 H new ATOM 0 HG23 VAL A 86 24.403 18.704 -5.792 1.00 0.00 H new ATOM 1304 N GLU A 87 20.168 18.327 -8.712 1.00 0.00 N ATOM 1305 CA GLU A 87 18.970 17.730 -9.311 1.00 0.00 C ATOM 1306 C GLU A 87 19.107 17.541 -10.831 1.00 0.00 C ATOM 1307 O GLU A 87 19.627 18.406 -11.538 1.00 0.00 O ATOM 1308 CB GLU A 87 17.704 18.509 -8.891 1.00 0.00 C ATOM 1309 CG GLU A 87 17.585 18.615 -7.358 1.00 0.00 C ATOM 1310 CD GLU A 87 16.198 19.085 -6.885 1.00 0.00 C ATOM 1311 OE1 GLU A 87 15.286 18.233 -6.758 1.00 0.00 O ATOM 1312 OE2 GLU A 87 16.031 20.294 -6.596 1.00 0.00 O ATOM 0 H GLU A 87 20.528 19.133 -9.223 1.00 0.00 H new ATOM 0 HA GLU A 87 18.859 16.720 -8.916 1.00 0.00 H new ATOM 0 HB2 GLU A 87 17.731 19.509 -9.324 1.00 0.00 H new ATOM 0 HB3 GLU A 87 16.821 18.012 -9.291 1.00 0.00 H new ATOM 0 HG2 GLU A 87 17.801 17.643 -6.916 1.00 0.00 H new ATOM 0 HG3 GLU A 87 18.341 19.308 -6.989 1.00 0.00 H new ATOM 1319 N GLU A 88 18.659 16.388 -11.338 1.00 0.00 N ATOM 1320 CA GLU A 88 18.661 16.069 -12.774 1.00 0.00 C ATOM 1321 C GLU A 88 17.542 15.083 -13.164 1.00 0.00 C ATOM 1322 O GLU A 88 17.084 14.339 -12.299 1.00 0.00 O ATOM 1323 CB GLU A 88 20.049 15.543 -13.166 1.00 0.00 C ATOM 1324 CG GLU A 88 20.549 14.361 -12.334 1.00 0.00 C ATOM 1325 CD GLU A 88 21.851 13.827 -12.947 1.00 0.00 C ATOM 1326 OE1 GLU A 88 22.889 14.515 -12.859 1.00 0.00 O ATOM 1327 OE2 GLU A 88 21.867 12.717 -13.529 1.00 0.00 O ATOM 0 H GLU A 88 18.280 15.640 -10.758 1.00 0.00 H new ATOM 0 HA GLU A 88 18.450 16.981 -13.332 1.00 0.00 H new ATOM 0 HB2 GLU A 88 20.026 15.246 -14.215 1.00 0.00 H new ATOM 0 HB3 GLU A 88 20.768 16.358 -13.081 1.00 0.00 H new ATOM 0 HG2 GLU A 88 20.719 14.672 -11.303 1.00 0.00 H new ATOM 0 HG3 GLU A 88 19.795 13.574 -12.309 1.00 0.00 H new ATOM 1334 N PRO A 89 17.064 15.056 -14.423 1.00 0.00 N ATOM 1335 CA PRO A 89 15.912 14.241 -14.826 1.00 0.00 C ATOM 1336 C PRO A 89 16.109 12.729 -14.605 1.00 0.00 C ATOM 1337 O PRO A 89 17.177 12.170 -14.879 1.00 0.00 O ATOM 1338 CB PRO A 89 15.637 14.589 -16.292 1.00 0.00 C ATOM 1339 CG PRO A 89 16.975 15.135 -16.789 1.00 0.00 C ATOM 1340 CD PRO A 89 17.528 15.844 -15.556 1.00 0.00 C ATOM 0 HA PRO A 89 15.054 14.474 -14.195 1.00 0.00 H new ATOM 0 HB2 PRO A 89 15.326 13.713 -16.860 1.00 0.00 H new ATOM 0 HB3 PRO A 89 14.842 15.329 -16.386 1.00 0.00 H new ATOM 0 HG2 PRO A 89 17.637 14.338 -17.128 1.00 0.00 H new ATOM 0 HG3 PRO A 89 16.846 15.821 -17.627 1.00 0.00 H new ATOM 0 HD2 PRO A 89 18.617 15.891 -15.584 1.00 0.00 H new ATOM 0 HD3 PRO A 89 17.166 16.870 -15.496 1.00 0.00 H new ATOM 1348 N ARG A 90 15.040 12.080 -14.120 1.00 0.00 N ATOM 1349 CA ARG A 90 14.969 10.646 -13.792 1.00 0.00 C ATOM 1350 C ARG A 90 14.607 9.776 -15.006 1.00 0.00 C ATOM 1351 O ARG A 90 15.323 8.779 -15.252 1.00 0.00 O ATOM 1352 CB ARG A 90 14.007 10.446 -12.608 1.00 0.00 C ATOM 1353 CG ARG A 90 14.089 9.031 -12.018 1.00 0.00 C ATOM 1354 CD ARG A 90 13.285 8.940 -10.716 1.00 0.00 C ATOM 1355 NE ARG A 90 13.367 7.592 -10.126 1.00 0.00 N ATOM 1356 CZ ARG A 90 12.899 7.218 -8.950 1.00 0.00 C ATOM 1357 NH1 ARG A 90 12.286 8.044 -8.152 1.00 0.00 N ATOM 1358 NH2 ARG A 90 13.039 5.987 -8.551 1.00 0.00 N ATOM 1359 OXT ARG A 90 13.617 10.086 -15.710 1.00 0.00 O ATOM 0 H ARG A 90 14.160 12.562 -13.937 1.00 0.00 H new ATOM 0 HA ARG A 90 15.961 10.307 -13.495 1.00 0.00 H new ATOM 0 HB2 ARG A 90 14.236 11.175 -11.830 1.00 0.00 H new ATOM 0 HB3 ARG A 90 12.986 10.641 -12.936 1.00 0.00 H new ATOM 0 HG2 ARG A 90 13.707 8.308 -12.739 1.00 0.00 H new ATOM 0 HG3 ARG A 90 15.130 8.771 -11.827 1.00 0.00 H new ATOM 0 HD2 ARG A 90 13.660 9.674 -10.003 1.00 0.00 H new ATOM 0 HD3 ARG A 90 12.242 9.190 -10.912 1.00 0.00 H new ATOM 0 HE ARG A 90 13.833 6.875 -10.683 1.00 0.00 H new ATOM 0 HH11 ARG A 90 12.154 9.017 -8.428 1.00 0.00 H new ATOM 0 HH12 ARG A 90 11.938 7.718 -7.250 1.00 0.00 H new ATOM 0 HH21 ARG A 90 13.512 5.308 -9.148 1.00 0.00 H new ATOM 0 HH22 ARG A 90 12.676 5.701 -7.642 1.00 0.00 H new TER 1373 ARG A 90