USER MOD reduce.3.24.130724 H: found=0, std=0, add=465, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 466 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 157 TYR OH : rot 180:sc= 0.444 USER MOD Set 1.2: A 184 LYS NZ :NH3+ -149:sc= 0.478 (180deg=0) USER MOD Single : A 153 THR OG1 : rot -20:sc= 0.372 USER MOD Single : A 164 THR OG1 : rot 180:sc= 0 USER MOD Single : A 166 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 167 GLN : amide:sc= -1.11! K(o=-1.1!,f=0) USER MOD Single : A 172 THR OG1 : rot 180:sc= 0.155 USER MOD Single : A 174 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 175 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 185 LYS NZ :NH3+ 147:sc= -0.31 (180deg=-1.14!) USER MOD Single : A 193 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 196 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 198 ASN : amide:sc= -2.35 K(o=-2.4,f=-9.6!) USER MOD Single : A 205 THR OG1 : rot 101:sc= 0.168 USER MOD Single : A 206 TYR OH : rot 180:sc= 0 USER MOD Single : A 210 TYR OH : rot 180:sc= 0 USER MOD Single : A 211 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 153 -1.104 -0.759 -2.765 1.00 0.00 N ATOM 2 CA THR A 153 -0.433 -0.608 -4.085 1.00 0.00 C ATOM 3 C THR A 153 -0.046 0.848 -4.343 1.00 0.00 C ATOM 4 O THR A 153 -0.621 1.513 -5.181 1.00 0.00 O ATOM 5 CB THR A 153 -1.362 -1.090 -5.211 1.00 0.00 C ATOM 6 OG1 THR A 153 -2.595 -0.424 -4.982 1.00 0.00 O ATOM 7 CG2 THR A 153 -1.663 -2.580 -5.054 1.00 0.00 C ATOM 0 HA THR A 153 0.472 -1.215 -4.069 1.00 0.00 H new ATOM 0 HB THR A 153 -0.911 -0.902 -6.185 1.00 0.00 H new ATOM 0 HG1 THR A 153 -2.635 -0.120 -4.051 1.00 0.00 H new ATOM 0 HG21 THR A 153 -2.322 -2.905 -5.859 1.00 0.00 H new ATOM 0 HG22 THR A 153 -0.732 -3.146 -5.096 1.00 0.00 H new ATOM 0 HG23 THR A 153 -2.150 -2.754 -4.094 1.00 0.00 H new ATOM 15 N GLY A 154 0.922 1.302 -3.594 1.00 0.00 N ATOM 16 CA GLY A 154 1.443 2.686 -3.779 1.00 0.00 C ATOM 17 C GLY A 154 1.114 3.641 -2.652 1.00 0.00 C ATOM 18 O GLY A 154 0.329 3.343 -1.775 1.00 0.00 O ATOM 0 H GLY A 154 1.378 0.768 -2.855 1.00 0.00 H new ATOM 0 HA2 GLY A 154 2.526 2.640 -3.893 1.00 0.00 H new ATOM 0 HA3 GLY A 154 1.041 3.090 -4.708 1.00 0.00 H new ATOM 22 N GLU A 155 1.746 4.781 -2.735 1.00 0.00 N ATOM 23 CA GLU A 155 1.518 5.832 -1.702 1.00 0.00 C ATOM 24 C GLU A 155 1.200 7.072 -2.507 1.00 0.00 C ATOM 25 O GLU A 155 1.558 7.112 -3.664 1.00 0.00 O ATOM 26 CB GLU A 155 2.789 6.037 -0.883 1.00 0.00 C ATOM 27 CG GLU A 155 3.128 4.756 -0.108 1.00 0.00 C ATOM 28 CD GLU A 155 1.986 4.427 0.854 1.00 0.00 C ATOM 29 OE1 GLU A 155 1.664 5.308 1.633 1.00 0.00 O ATOM 30 OE2 GLU A 155 1.503 3.312 0.754 1.00 0.00 O ATOM 0 H GLU A 155 2.408 5.029 -3.470 1.00 0.00 H new ATOM 0 HA GLU A 155 0.725 5.577 -0.999 1.00 0.00 H new ATOM 0 HB2 GLU A 155 3.616 6.303 -1.541 1.00 0.00 H new ATOM 0 HB3 GLU A 155 2.654 6.867 -0.189 1.00 0.00 H new ATOM 0 HG2 GLU A 155 3.284 3.929 -0.801 1.00 0.00 H new ATOM 0 HG3 GLU A 155 4.058 4.888 0.445 1.00 0.00 H new ATOM 37 N GLU A 156 0.566 8.053 -1.926 1.00 0.00 N ATOM 38 CA GLU A 156 0.245 9.219 -2.786 1.00 0.00 C ATOM 39 C GLU A 156 1.127 10.418 -2.509 1.00 0.00 C ATOM 40 O GLU A 156 1.394 10.820 -1.393 1.00 0.00 O ATOM 41 CB GLU A 156 -1.237 9.609 -2.597 1.00 0.00 C ATOM 42 CG GLU A 156 -1.559 9.937 -1.145 1.00 0.00 C ATOM 43 CD GLU A 156 -3.046 10.274 -1.049 1.00 0.00 C ATOM 44 OE1 GLU A 156 -3.425 11.245 -1.685 1.00 0.00 O ATOM 45 OE2 GLU A 156 -3.716 9.539 -0.344 1.00 0.00 O ATOM 0 H GLU A 156 0.272 8.099 -0.951 1.00 0.00 H new ATOM 0 HA GLU A 156 0.432 8.918 -3.817 1.00 0.00 H new ATOM 0 HB2 GLU A 156 -1.468 10.471 -3.223 1.00 0.00 H new ATOM 0 HB3 GLU A 156 -1.873 8.790 -2.934 1.00 0.00 H new ATOM 0 HG2 GLU A 156 -1.319 9.090 -0.502 1.00 0.00 H new ATOM 0 HG3 GLU A 156 -0.956 10.778 -0.803 1.00 0.00 H new ATOM 52 N TYR A 157 1.546 10.931 -3.626 1.00 0.00 N ATOM 53 CA TYR A 157 2.425 12.114 -3.695 1.00 0.00 C ATOM 54 C TYR A 157 1.536 13.103 -4.375 1.00 0.00 C ATOM 55 O TYR A 157 0.397 12.803 -4.666 1.00 0.00 O ATOM 56 CB TYR A 157 3.619 11.805 -4.569 1.00 0.00 C ATOM 57 CG TYR A 157 4.587 10.852 -3.881 1.00 0.00 C ATOM 58 CD1 TYR A 157 4.211 9.592 -3.468 1.00 0.00 C ATOM 59 CD2 TYR A 157 5.882 11.263 -3.683 1.00 0.00 C ATOM 60 CE1 TYR A 157 5.120 8.754 -2.869 1.00 0.00 C ATOM 61 CE2 TYR A 157 6.794 10.429 -3.085 1.00 0.00 C ATOM 62 CZ TYR A 157 6.423 9.167 -2.672 1.00 0.00 C ATOM 63 OH TYR A 157 7.343 8.334 -2.070 1.00 0.00 O ATOM 0 H TYR A 157 1.298 10.553 -4.540 1.00 0.00 H new ATOM 0 HA TYR A 157 2.816 12.449 -2.734 1.00 0.00 H new ATOM 0 HB2 TYR A 157 3.280 11.365 -5.507 1.00 0.00 H new ATOM 0 HB3 TYR A 157 4.136 12.731 -4.820 1.00 0.00 H new ATOM 0 HD1 TYR A 157 3.194 9.261 -3.616 1.00 0.00 H new ATOM 0 HD2 TYR A 157 6.186 12.250 -4.000 1.00 0.00 H new ATOM 0 HE1 TYR A 157 4.814 7.768 -2.551 1.00 0.00 H new ATOM 0 HE2 TYR A 157 7.810 10.764 -2.937 1.00 0.00 H new ATOM 0 HH TYR A 157 8.209 8.789 -2.015 1.00 0.00 H new ATOM 73 N ILE A 158 2.070 14.258 -4.603 1.00 0.00 N ATOM 74 CA ILE A 158 1.332 15.250 -5.349 1.00 0.00 C ATOM 75 C ILE A 158 2.333 15.579 -6.436 1.00 0.00 C ATOM 76 O ILE A 158 3.519 15.440 -6.214 1.00 0.00 O ATOM 77 CB ILE A 158 1.032 16.401 -4.374 1.00 0.00 C ATOM 78 CG1 ILE A 158 1.725 17.680 -4.760 1.00 0.00 C ATOM 79 CG2 ILE A 158 1.580 16.048 -2.987 1.00 0.00 C ATOM 80 CD1 ILE A 158 0.961 18.842 -4.101 1.00 0.00 C ATOM 0 H ILE A 158 2.999 14.545 -4.294 1.00 0.00 H new ATOM 0 HA ILE A 158 0.368 14.975 -5.776 1.00 0.00 H new ATOM 0 HB ILE A 158 -0.049 16.539 -4.390 1.00 0.00 H new ATOM 0 HG12 ILE A 158 2.763 17.668 -4.428 1.00 0.00 H new ATOM 0 HG13 ILE A 158 1.738 17.796 -5.844 1.00 0.00 H new ATOM 0 HG21 ILE A 158 1.369 16.862 -2.294 1.00 0.00 H new ATOM 0 HG22 ILE A 158 1.104 15.135 -2.629 1.00 0.00 H new ATOM 0 HG23 ILE A 158 2.657 15.895 -3.050 1.00 0.00 H new ATOM 0 HD11 ILE A 158 1.439 19.786 -4.362 1.00 0.00 H new ATOM 0 HD12 ILE A 158 -0.070 18.847 -4.456 1.00 0.00 H new ATOM 0 HD13 ILE A 158 0.972 18.717 -3.018 1.00 0.00 H new ATOM 92 N ALA A 159 1.868 16.004 -7.575 1.00 0.00 N ATOM 93 CA ALA A 159 2.871 16.354 -8.608 1.00 0.00 C ATOM 94 C ALA A 159 3.095 17.817 -8.372 1.00 0.00 C ATOM 95 O ALA A 159 2.178 18.487 -7.949 1.00 0.00 O ATOM 96 CB ALA A 159 2.334 16.195 -10.021 1.00 0.00 C ATOM 0 H ALA A 159 0.886 16.120 -7.827 1.00 0.00 H new ATOM 0 HA ALA A 159 3.753 15.718 -8.533 1.00 0.00 H new ATOM 0 HB1 ALA A 159 3.110 16.465 -10.738 1.00 0.00 H new ATOM 0 HB2 ALA A 159 2.035 15.159 -10.182 1.00 0.00 H new ATOM 0 HB3 ALA A 159 1.471 16.847 -10.158 1.00 0.00 H new ATOM 102 N VAL A 160 4.287 18.264 -8.641 1.00 0.00 N ATOM 103 CA VAL A 160 4.578 19.710 -8.456 1.00 0.00 C ATOM 104 C VAL A 160 5.157 20.261 -9.747 1.00 0.00 C ATOM 105 O VAL A 160 5.636 21.374 -9.807 1.00 0.00 O ATOM 106 CB VAL A 160 5.558 19.853 -7.299 1.00 0.00 C ATOM 107 CG1 VAL A 160 4.891 19.251 -6.051 1.00 0.00 C ATOM 108 CG2 VAL A 160 6.839 19.067 -7.611 1.00 0.00 C ATOM 0 H VAL A 160 5.066 17.698 -8.978 1.00 0.00 H new ATOM 0 HA VAL A 160 3.674 20.272 -8.222 1.00 0.00 H new ATOM 0 HB VAL A 160 5.813 20.901 -7.140 1.00 0.00 H new ATOM 0 HG11 VAL A 160 5.567 19.337 -5.200 1.00 0.00 H new ATOM 0 HG12 VAL A 160 3.968 19.789 -5.836 1.00 0.00 H new ATOM 0 HG13 VAL A 160 4.665 18.200 -6.231 1.00 0.00 H new ATOM 0 HG21 VAL A 160 7.540 19.170 -6.783 1.00 0.00 H new ATOM 0 HG22 VAL A 160 6.595 18.014 -7.751 1.00 0.00 H new ATOM 0 HG23 VAL A 160 7.293 19.458 -8.521 1.00 0.00 H new ATOM 118 N GLY A 161 5.088 19.434 -10.755 1.00 0.00 N ATOM 119 CA GLY A 161 5.539 19.857 -12.103 1.00 0.00 C ATOM 120 C GLY A 161 4.396 19.487 -13.034 1.00 0.00 C ATOM 121 O GLY A 161 3.562 18.684 -12.670 1.00 0.00 O ATOM 0 H GLY A 161 4.736 18.478 -10.698 1.00 0.00 H new ATOM 0 HA2 GLY A 161 5.742 20.927 -12.133 1.00 0.00 H new ATOM 0 HA3 GLY A 161 6.461 19.349 -12.388 1.00 0.00 H new ATOM 125 N ASP A 162 4.374 20.067 -14.199 1.00 0.00 N ATOM 126 CA ASP A 162 3.292 19.719 -15.155 1.00 0.00 C ATOM 127 C ASP A 162 3.882 18.911 -16.303 1.00 0.00 C ATOM 128 O ASP A 162 4.423 19.477 -17.233 1.00 0.00 O ATOM 129 CB ASP A 162 2.651 21.004 -15.684 1.00 0.00 C ATOM 130 CG ASP A 162 1.366 20.654 -16.448 1.00 0.00 C ATOM 131 OD1 ASP A 162 1.463 19.926 -17.422 1.00 0.00 O ATOM 132 OD2 ASP A 162 0.344 21.144 -15.997 1.00 0.00 O ATOM 0 H ASP A 162 5.049 20.758 -14.527 1.00 0.00 H new ATOM 0 HA ASP A 162 2.528 19.123 -14.655 1.00 0.00 H new ATOM 0 HB2 ASP A 162 2.424 21.678 -14.858 1.00 0.00 H new ATOM 0 HB3 ASP A 162 3.347 21.527 -16.340 1.00 0.00 H new ATOM 137 N PHE A 163 3.766 17.614 -16.220 1.00 0.00 N ATOM 138 CA PHE A 163 4.325 16.782 -17.321 1.00 0.00 C ATOM 139 C PHE A 163 3.159 16.295 -18.168 1.00 0.00 C ATOM 140 O PHE A 163 2.039 16.196 -17.706 1.00 0.00 O ATOM 141 CB PHE A 163 5.060 15.572 -16.745 1.00 0.00 C ATOM 142 CG PHE A 163 5.777 14.762 -17.841 1.00 0.00 C ATOM 143 CD1 PHE A 163 6.492 15.383 -18.854 1.00 0.00 C ATOM 144 CD2 PHE A 163 5.722 13.379 -17.818 1.00 0.00 C ATOM 145 CE1 PHE A 163 7.135 14.635 -19.819 1.00 0.00 C ATOM 146 CE2 PHE A 163 6.366 12.633 -18.782 1.00 0.00 C ATOM 147 CZ PHE A 163 7.074 13.259 -19.784 1.00 0.00 C ATOM 0 H PHE A 163 3.320 17.105 -15.457 1.00 0.00 H new ATOM 0 HA PHE A 163 5.026 17.369 -17.915 1.00 0.00 H new ATOM 0 HB2 PHE A 163 5.788 15.907 -16.006 1.00 0.00 H new ATOM 0 HB3 PHE A 163 4.350 14.930 -16.224 1.00 0.00 H new ATOM 0 HD1 PHE A 163 6.546 16.461 -18.888 1.00 0.00 H new ATOM 0 HD2 PHE A 163 5.169 12.879 -17.037 1.00 0.00 H new ATOM 0 HE1 PHE A 163 7.688 15.130 -20.604 1.00 0.00 H new ATOM 0 HE2 PHE A 163 6.315 11.555 -18.751 1.00 0.00 H new ATOM 0 HZ PHE A 163 7.579 12.674 -20.539 1.00 0.00 H new ATOM 157 N THR A 164 3.480 16.011 -19.395 1.00 0.00 N ATOM 158 CA THR A 164 2.475 15.503 -20.357 1.00 0.00 C ATOM 159 C THR A 164 3.060 14.180 -20.831 1.00 0.00 C ATOM 160 O THR A 164 4.228 13.934 -20.615 1.00 0.00 O ATOM 161 CB THR A 164 2.372 16.566 -21.449 1.00 0.00 C ATOM 162 OG1 THR A 164 1.980 17.725 -20.727 1.00 0.00 O ATOM 163 CG2 THR A 164 1.220 16.351 -22.436 1.00 0.00 C ATOM 0 H THR A 164 4.420 16.113 -19.778 1.00 0.00 H new ATOM 0 HA THR A 164 1.468 15.331 -19.976 1.00 0.00 H new ATOM 0 HB THR A 164 3.305 16.586 -22.012 1.00 0.00 H new ATOM 0 HG1 THR A 164 1.886 18.479 -21.345 1.00 0.00 H new ATOM 0 HG21 THR A 164 1.221 17.151 -23.177 1.00 0.00 H new ATOM 0 HG22 THR A 164 1.345 15.392 -22.938 1.00 0.00 H new ATOM 0 HG23 THR A 164 0.273 16.357 -21.897 1.00 0.00 H new ATOM 171 N ALA A 165 2.278 13.353 -21.462 1.00 0.00 N ATOM 172 CA ALA A 165 2.866 12.075 -21.937 1.00 0.00 C ATOM 173 C ALA A 165 3.368 12.275 -23.356 1.00 0.00 C ATOM 174 O ALA A 165 2.799 13.003 -24.143 1.00 0.00 O ATOM 175 CB ALA A 165 1.794 10.994 -21.913 1.00 0.00 C ATOM 0 H ALA A 165 1.289 13.499 -21.664 1.00 0.00 H new ATOM 0 HA ALA A 165 3.692 11.772 -21.294 1.00 0.00 H new ATOM 0 HB1 ALA A 165 2.219 10.052 -22.261 1.00 0.00 H new ATOM 0 HB2 ALA A 165 1.424 10.871 -20.895 1.00 0.00 H new ATOM 0 HB3 ALA A 165 0.971 11.284 -22.566 1.00 0.00 H new ATOM 181 N GLN A 166 4.447 11.596 -23.613 1.00 0.00 N ATOM 182 CA GLN A 166 5.090 11.643 -24.949 1.00 0.00 C ATOM 183 C GLN A 166 4.930 10.245 -25.516 1.00 0.00 C ATOM 184 O GLN A 166 4.687 10.056 -26.692 1.00 0.00 O ATOM 185 CB GLN A 166 6.566 11.998 -24.781 1.00 0.00 C ATOM 186 CG GLN A 166 7.235 12.040 -26.156 1.00 0.00 C ATOM 187 CD GLN A 166 8.705 12.419 -25.974 1.00 0.00 C ATOM 188 OE1 GLN A 166 9.456 11.735 -25.307 1.00 0.00 O ATOM 189 NE2 GLN A 166 9.155 13.500 -26.550 1.00 0.00 N ATOM 0 H GLN A 166 4.920 10.997 -22.936 1.00 0.00 H new ATOM 0 HA GLN A 166 4.647 12.389 -25.609 1.00 0.00 H new ATOM 0 HB2 GLN A 166 6.666 12.964 -24.286 1.00 0.00 H new ATOM 0 HB3 GLN A 166 7.059 11.262 -24.146 1.00 0.00 H new ATOM 0 HG2 GLN A 166 7.153 11.070 -26.646 1.00 0.00 H new ATOM 0 HG3 GLN A 166 6.734 12.765 -26.798 1.00 0.00 H new ATOM 0 HE21 GLN A 166 8.529 14.077 -27.111 1.00 0.00 H new ATOM 0 HE22 GLN A 166 10.133 13.767 -26.439 1.00 0.00 H new ATOM 198 N GLN A 167 5.078 9.304 -24.626 1.00 0.00 N ATOM 199 CA GLN A 167 4.941 7.874 -25.020 1.00 0.00 C ATOM 200 C GLN A 167 3.822 7.293 -24.163 1.00 0.00 C ATOM 201 O GLN A 167 3.512 7.854 -23.131 1.00 0.00 O ATOM 202 CB GLN A 167 6.270 7.169 -24.747 1.00 0.00 C ATOM 203 CG GLN A 167 6.195 5.698 -25.180 1.00 0.00 C ATOM 204 CD GLN A 167 7.547 5.020 -24.936 1.00 0.00 C ATOM 205 OE1 GLN A 167 7.722 3.853 -25.224 1.00 0.00 O ATOM 206 NE2 GLN A 167 8.531 5.702 -24.412 1.00 0.00 N ATOM 0 H GLN A 167 5.288 9.464 -23.641 1.00 0.00 H new ATOM 0 HA GLN A 167 4.702 7.750 -26.076 1.00 0.00 H new ATOM 0 HB2 GLN A 167 7.073 7.672 -25.285 1.00 0.00 H new ATOM 0 HB3 GLN A 167 6.510 7.230 -23.686 1.00 0.00 H new ATOM 0 HG2 GLN A 167 5.413 5.184 -24.621 1.00 0.00 H new ATOM 0 HG3 GLN A 167 5.929 5.632 -26.235 1.00 0.00 H new ATOM 0 HE21 GLN A 167 8.397 6.683 -24.166 1.00 0.00 H new ATOM 0 HE22 GLN A 167 9.433 5.254 -24.249 1.00 0.00 H new ATOM 215 N VAL A 168 3.257 6.205 -24.629 1.00 0.00 N ATOM 216 CA VAL A 168 2.196 5.492 -23.853 1.00 0.00 C ATOM 217 C VAL A 168 2.627 5.481 -22.393 1.00 0.00 C ATOM 218 O VAL A 168 1.926 5.955 -21.522 1.00 0.00 O ATOM 219 CB VAL A 168 2.064 4.058 -24.381 1.00 0.00 C ATOM 220 CG1 VAL A 168 0.994 3.313 -23.573 1.00 0.00 C ATOM 221 CG2 VAL A 168 1.620 4.105 -25.845 1.00 0.00 C ATOM 0 H VAL A 168 3.490 5.776 -25.525 1.00 0.00 H new ATOM 0 HA VAL A 168 1.231 5.988 -23.955 1.00 0.00 H new ATOM 0 HB VAL A 168 3.023 3.548 -24.290 1.00 0.00 H new ATOM 0 HG11 VAL A 168 0.899 2.294 -23.947 1.00 0.00 H new ATOM 0 HG12 VAL A 168 1.283 3.288 -22.522 1.00 0.00 H new ATOM 0 HG13 VAL A 168 0.038 3.827 -23.674 1.00 0.00 H new ATOM 0 HG21 VAL A 168 1.524 3.089 -26.229 1.00 0.00 H new ATOM 0 HG22 VAL A 168 0.658 4.613 -25.917 1.00 0.00 H new ATOM 0 HG23 VAL A 168 2.361 4.646 -26.433 1.00 0.00 H new ATOM 231 N GLY A 169 3.792 4.913 -22.221 1.00 0.00 N ATOM 232 CA GLY A 169 4.482 4.850 -20.906 1.00 0.00 C ATOM 233 C GLY A 169 4.116 5.986 -19.957 1.00 0.00 C ATOM 234 O GLY A 169 3.667 5.766 -18.854 1.00 0.00 O ATOM 0 H GLY A 169 4.313 4.471 -22.978 1.00 0.00 H new ATOM 0 HA2 GLY A 169 4.244 3.900 -20.428 1.00 0.00 H new ATOM 0 HA3 GLY A 169 5.559 4.862 -21.072 1.00 0.00 H new ATOM 238 N ASP A 170 4.319 7.180 -20.435 1.00 0.00 N ATOM 239 CA ASP A 170 4.069 8.396 -19.616 1.00 0.00 C ATOM 240 C ASP A 170 2.593 8.756 -19.447 1.00 0.00 C ATOM 241 O ASP A 170 1.729 8.317 -20.179 1.00 0.00 O ATOM 242 CB ASP A 170 4.755 9.543 -20.280 1.00 0.00 C ATOM 243 CG ASP A 170 6.191 9.168 -20.614 1.00 0.00 C ATOM 244 OD1 ASP A 170 6.932 8.944 -19.672 1.00 0.00 O ATOM 245 OD2 ASP A 170 6.453 9.129 -21.806 1.00 0.00 O ATOM 0 H ASP A 170 4.655 7.368 -21.380 1.00 0.00 H new ATOM 0 HA ASP A 170 4.450 8.185 -18.617 1.00 0.00 H new ATOM 0 HB2 ASP A 170 4.222 9.819 -21.190 1.00 0.00 H new ATOM 0 HB3 ASP A 170 4.741 10.414 -19.625 1.00 0.00 H new ATOM 250 N LEU A 171 2.378 9.568 -18.448 1.00 0.00 N ATOM 251 CA LEU A 171 1.087 10.125 -18.088 1.00 0.00 C ATOM 252 C LEU A 171 1.130 11.634 -18.235 1.00 0.00 C ATOM 253 O LEU A 171 2.120 12.219 -18.629 1.00 0.00 O ATOM 254 CB LEU A 171 0.847 9.732 -16.701 1.00 0.00 C ATOM 255 CG LEU A 171 -0.446 9.039 -16.620 1.00 0.00 C ATOM 256 CD1 LEU A 171 -0.627 7.799 -17.494 1.00 0.00 C ATOM 257 CD2 LEU A 171 -0.797 8.722 -15.165 1.00 0.00 C ATOM 0 H LEU A 171 3.128 9.878 -17.830 1.00 0.00 H new ATOM 0 HA LEU A 171 0.285 9.761 -18.731 1.00 0.00 H new ATOM 0 HB2 LEU A 171 1.647 9.080 -16.350 1.00 0.00 H new ATOM 0 HB3 LEU A 171 0.845 10.610 -16.055 1.00 0.00 H new ATOM 0 HG LEU A 171 -1.146 9.758 -17.046 1.00 0.00 H new ATOM 0 HD11 LEU A 171 -1.624 7.386 -17.338 1.00 0.00 H new ATOM 0 HD12 LEU A 171 -0.508 8.072 -18.542 1.00 0.00 H new ATOM 0 HD13 LEU A 171 0.121 7.053 -17.226 1.00 0.00 H new ATOM 0 HD21 LEU A 171 -1.758 8.209 -15.126 1.00 0.00 H new ATOM 0 HD22 LEU A 171 -0.026 8.082 -14.736 1.00 0.00 H new ATOM 0 HD23 LEU A 171 -0.857 9.649 -14.595 1.00 0.00 H new ATOM 269 N THR A 172 0.009 12.196 -17.898 1.00 0.00 N ATOM 270 CA THR A 172 -0.174 13.664 -17.995 1.00 0.00 C ATOM 271 C THR A 172 -0.715 14.254 -16.698 1.00 0.00 C ATOM 272 O THR A 172 -1.902 14.201 -16.449 1.00 0.00 O ATOM 273 CB THR A 172 -1.126 13.930 -19.130 1.00 0.00 C ATOM 274 OG1 THR A 172 -0.400 13.540 -20.285 1.00 0.00 O ATOM 275 CG2 THR A 172 -1.366 15.436 -19.291 1.00 0.00 C ATOM 0 H THR A 172 -0.805 11.688 -17.552 1.00 0.00 H new ATOM 0 HA THR A 172 0.790 14.140 -18.176 1.00 0.00 H new ATOM 0 HB THR A 172 -2.076 13.420 -18.971 1.00 0.00 H new ATOM 0 HG1 THR A 172 -0.953 13.680 -21.082 1.00 0.00 H new ATOM 0 HG21 THR A 172 -2.057 15.608 -20.116 1.00 0.00 H new ATOM 0 HG22 THR A 172 -1.792 15.837 -18.371 1.00 0.00 H new ATOM 0 HG23 THR A 172 -0.420 15.935 -19.500 1.00 0.00 H new ATOM 283 N PHE A 173 0.166 14.796 -15.904 1.00 0.00 N ATOM 284 CA PHE A 173 -0.290 15.427 -14.633 1.00 0.00 C ATOM 285 C PHE A 173 0.126 16.883 -14.576 1.00 0.00 C ATOM 286 O PHE A 173 0.931 17.335 -15.367 1.00 0.00 O ATOM 287 CB PHE A 173 0.314 14.690 -13.446 1.00 0.00 C ATOM 288 CG PHE A 173 1.842 14.625 -13.556 1.00 0.00 C ATOM 289 CD1 PHE A 173 2.632 15.715 -13.243 1.00 0.00 C ATOM 290 CD2 PHE A 173 2.450 13.457 -13.972 1.00 0.00 C ATOM 291 CE1 PHE A 173 4.006 15.640 -13.345 1.00 0.00 C ATOM 292 CE2 PHE A 173 3.825 13.382 -14.074 1.00 0.00 C ATOM 293 CZ PHE A 173 4.604 14.472 -13.761 1.00 0.00 C ATOM 0 H PHE A 173 1.171 14.830 -16.076 1.00 0.00 H new ATOM 0 HA PHE A 173 -1.378 15.368 -14.594 1.00 0.00 H new ATOM 0 HB2 PHE A 173 0.034 15.193 -12.521 1.00 0.00 H new ATOM 0 HB3 PHE A 173 -0.093 13.680 -13.395 1.00 0.00 H new ATOM 0 HD1 PHE A 173 2.169 16.634 -12.915 1.00 0.00 H new ATOM 0 HD2 PHE A 173 1.846 12.596 -14.219 1.00 0.00 H new ATOM 0 HE1 PHE A 173 4.613 16.499 -13.098 1.00 0.00 H new ATOM 0 HE2 PHE A 173 4.291 12.464 -14.401 1.00 0.00 H new ATOM 0 HZ PHE A 173 5.679 14.412 -13.841 1.00 0.00 H new ATOM 303 N LYS A 174 -0.448 17.572 -13.628 1.00 0.00 N ATOM 304 CA LYS A 174 -0.118 18.996 -13.446 1.00 0.00 C ATOM 305 C LYS A 174 0.430 19.399 -12.099 1.00 0.00 C ATOM 306 O LYS A 174 0.075 18.900 -11.050 1.00 0.00 O ATOM 307 CB LYS A 174 -1.354 19.781 -13.715 1.00 0.00 C ATOM 308 CG LYS A 174 -2.446 19.498 -12.671 1.00 0.00 C ATOM 309 CD LYS A 174 -3.700 20.328 -12.990 1.00 0.00 C ATOM 310 CE LYS A 174 -4.256 19.946 -14.368 1.00 0.00 C ATOM 311 NZ LYS A 174 -5.515 20.701 -14.623 1.00 0.00 N ATOM 0 H LYS A 174 -1.135 17.199 -12.972 1.00 0.00 H new ATOM 0 HA LYS A 174 0.697 19.199 -14.140 1.00 0.00 H new ATOM 0 HB2 LYS A 174 -1.117 20.845 -13.714 1.00 0.00 H new ATOM 0 HB3 LYS A 174 -1.730 19.539 -14.709 1.00 0.00 H new ATOM 0 HG2 LYS A 174 -2.693 18.436 -12.668 1.00 0.00 H new ATOM 0 HG3 LYS A 174 -2.081 19.743 -11.674 1.00 0.00 H new ATOM 0 HD2 LYS A 174 -4.459 20.161 -12.225 1.00 0.00 H new ATOM 0 HD3 LYS A 174 -3.456 21.390 -12.971 1.00 0.00 H new ATOM 0 HE2 LYS A 174 -3.522 20.169 -15.143 1.00 0.00 H new ATOM 0 HE3 LYS A 174 -4.448 18.874 -14.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 174 -5.892 20.442 -15.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 174 -6.215 20.467 -13.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 174 -5.318 21.722 -14.600 1.00 0.00 H new ATOM 325 N LYS A 175 1.316 20.327 -12.276 1.00 0.00 N ATOM 326 CA LYS A 175 1.977 21.099 -11.204 1.00 0.00 C ATOM 327 C LYS A 175 1.081 21.401 -9.994 1.00 0.00 C ATOM 328 O LYS A 175 0.527 22.473 -9.859 1.00 0.00 O ATOM 329 CB LYS A 175 2.467 22.342 -11.899 1.00 0.00 C ATOM 330 CG LYS A 175 3.111 23.275 -10.872 1.00 0.00 C ATOM 331 CD LYS A 175 4.093 24.191 -11.588 1.00 0.00 C ATOM 332 CE LYS A 175 4.816 25.013 -10.524 1.00 0.00 C ATOM 333 NZ LYS A 175 5.799 25.926 -11.170 1.00 0.00 N ATOM 0 H LYS A 175 1.632 20.601 -13.206 1.00 0.00 H new ATOM 0 HA LYS A 175 2.785 20.527 -10.747 1.00 0.00 H new ATOM 0 HB2 LYS A 175 3.189 22.080 -12.672 1.00 0.00 H new ATOM 0 HB3 LYS A 175 1.638 22.846 -12.395 1.00 0.00 H new ATOM 0 HG2 LYS A 175 2.346 23.864 -10.366 1.00 0.00 H new ATOM 0 HG3 LYS A 175 3.626 22.695 -10.106 1.00 0.00 H new ATOM 0 HD2 LYS A 175 4.806 23.608 -12.171 1.00 0.00 H new ATOM 0 HD3 LYS A 175 3.569 24.844 -12.286 1.00 0.00 H new ATOM 0 HE2 LYS A 175 4.095 25.591 -9.946 1.00 0.00 H new ATOM 0 HE3 LYS A 175 5.327 24.351 -9.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 175 6.288 26.483 -10.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 175 6.495 25.366 -11.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 175 5.302 26.568 -11.820 1.00 0.00 H new ATOM 347 N GLY A 176 0.963 20.421 -9.146 1.00 0.00 N ATOM 348 CA GLY A 176 0.157 20.568 -7.901 1.00 0.00 C ATOM 349 C GLY A 176 -1.110 19.713 -7.931 1.00 0.00 C ATOM 350 O GLY A 176 -2.188 20.208 -7.667 1.00 0.00 O ATOM 0 H GLY A 176 1.399 19.506 -9.264 1.00 0.00 H new ATOM 0 HA2 GLY A 176 0.764 20.285 -7.041 1.00 0.00 H new ATOM 0 HA3 GLY A 176 -0.116 21.615 -7.768 1.00 0.00 H new ATOM 354 N GLU A 177 -0.959 18.457 -8.251 1.00 0.00 N ATOM 355 CA GLU A 177 -2.159 17.554 -8.244 1.00 0.00 C ATOM 356 C GLU A 177 -1.818 16.366 -7.383 1.00 0.00 C ATOM 357 O GLU A 177 -0.787 16.378 -6.752 1.00 0.00 O ATOM 358 CB GLU A 177 -2.509 17.058 -9.655 1.00 0.00 C ATOM 359 CG GLU A 177 -1.479 16.078 -10.219 1.00 0.00 C ATOM 360 CD GLU A 177 -2.193 15.297 -11.324 1.00 0.00 C ATOM 361 OE1 GLU A 177 -2.591 15.937 -12.281 1.00 0.00 O ATOM 362 OE2 GLU A 177 -2.304 14.097 -11.141 1.00 0.00 O ATOM 0 H GLU A 177 -0.077 18.017 -8.513 1.00 0.00 H new ATOM 0 HA GLU A 177 -3.020 18.105 -7.865 1.00 0.00 H new ATOM 0 HB2 GLU A 177 -3.486 16.576 -9.632 1.00 0.00 H new ATOM 0 HB3 GLU A 177 -2.592 17.914 -10.325 1.00 0.00 H new ATOM 0 HG2 GLU A 177 -0.613 16.609 -10.615 1.00 0.00 H new ATOM 0 HG3 GLU A 177 -1.114 15.407 -9.442 1.00 0.00 H new ATOM 369 N ILE A 178 -2.675 15.383 -7.361 1.00 0.00 N ATOM 370 CA ILE A 178 -2.376 14.158 -6.572 1.00 0.00 C ATOM 371 C ILE A 178 -2.075 12.964 -7.494 1.00 0.00 C ATOM 372 O ILE A 178 -2.732 12.746 -8.492 1.00 0.00 O ATOM 373 CB ILE A 178 -3.584 13.867 -5.718 1.00 0.00 C ATOM 374 CG1 ILE A 178 -4.094 15.161 -5.039 1.00 0.00 C ATOM 375 CG2 ILE A 178 -3.236 12.786 -4.664 1.00 0.00 C ATOM 376 CD1 ILE A 178 -3.111 15.728 -4.000 1.00 0.00 C ATOM 0 H ILE A 178 -3.568 15.376 -7.855 1.00 0.00 H new ATOM 0 HA ILE A 178 -1.492 14.318 -5.955 1.00 0.00 H new ATOM 0 HB ILE A 178 -4.384 13.486 -6.353 1.00 0.00 H new ATOM 0 HG12 ILE A 178 -4.280 15.916 -5.803 1.00 0.00 H new ATOM 0 HG13 ILE A 178 -5.048 14.957 -4.553 1.00 0.00 H new ATOM 0 HG21 ILE A 178 -4.113 12.580 -4.050 1.00 0.00 H new ATOM 0 HG22 ILE A 178 -2.925 11.872 -5.169 1.00 0.00 H new ATOM 0 HG23 ILE A 178 -2.425 13.144 -4.030 1.00 0.00 H new ATOM 0 HD11 ILE A 178 -3.528 16.634 -3.561 1.00 0.00 H new ATOM 0 HD12 ILE A 178 -2.944 14.989 -3.216 1.00 0.00 H new ATOM 0 HD13 ILE A 178 -2.164 15.963 -4.485 1.00 0.00 H new ATOM 388 N LEU A 179 -1.065 12.238 -7.096 1.00 0.00 N ATOM 389 CA LEU A 179 -0.615 11.007 -7.813 1.00 0.00 C ATOM 390 C LEU A 179 -0.492 9.843 -6.828 1.00 0.00 C ATOM 391 O LEU A 179 -0.553 10.051 -5.633 1.00 0.00 O ATOM 392 CB LEU A 179 0.728 11.226 -8.427 1.00 0.00 C ATOM 393 CG LEU A 179 0.670 12.282 -9.526 1.00 0.00 C ATOM 394 CD1 LEU A 179 2.037 12.273 -10.106 1.00 0.00 C ATOM 395 CD2 LEU A 179 -0.281 11.879 -10.658 1.00 0.00 C ATOM 0 H LEU A 179 -0.510 12.457 -6.268 1.00 0.00 H new ATOM 0 HA LEU A 179 -1.350 10.780 -8.585 1.00 0.00 H new ATOM 0 HB2 LEU A 179 1.435 11.537 -7.658 1.00 0.00 H new ATOM 0 HB3 LEU A 179 1.098 10.288 -8.840 1.00 0.00 H new ATOM 0 HG LEU A 179 0.334 13.236 -9.120 1.00 0.00 H new ATOM 0 HD11 LEU A 179 2.096 13.006 -10.911 1.00 0.00 H new ATOM 0 HD12 LEU A 179 2.762 12.525 -9.332 1.00 0.00 H new ATOM 0 HD13 LEU A 179 2.258 11.281 -10.501 1.00 0.00 H new ATOM 0 HD21 LEU A 179 -0.292 12.659 -11.419 1.00 0.00 H new ATOM 0 HD22 LEU A 179 0.058 10.943 -11.102 1.00 0.00 H new ATOM 0 HD23 LEU A 179 -1.287 11.747 -10.259 1.00 0.00 H new ATOM 407 N LEU A 180 -0.321 8.658 -7.356 1.00 0.00 N ATOM 408 CA LEU A 180 -0.063 7.460 -6.503 1.00 0.00 C ATOM 409 C LEU A 180 1.272 6.913 -6.987 1.00 0.00 C ATOM 410 O LEU A 180 1.644 7.196 -8.105 1.00 0.00 O ATOM 411 CB LEU A 180 -1.149 6.446 -6.728 1.00 0.00 C ATOM 412 CG LEU A 180 -2.227 6.525 -5.665 1.00 0.00 C ATOM 413 CD1 LEU A 180 -3.357 5.597 -6.101 1.00 0.00 C ATOM 414 CD2 LEU A 180 -1.679 5.995 -4.329 1.00 0.00 C ATOM 0 H LEU A 180 -0.350 8.468 -8.358 1.00 0.00 H new ATOM 0 HA LEU A 180 -0.044 7.697 -5.439 1.00 0.00 H new ATOM 0 HB2 LEU A 180 -1.595 6.604 -7.710 1.00 0.00 H new ATOM 0 HB3 LEU A 180 -0.716 5.446 -6.732 1.00 0.00 H new ATOM 0 HG LEU A 180 -2.562 7.555 -5.544 1.00 0.00 H new ATOM 0 HD11 LEU A 180 -4.156 5.624 -5.361 1.00 0.00 H new ATOM 0 HD12 LEU A 180 -3.745 5.924 -7.066 1.00 0.00 H new ATOM 0 HD13 LEU A 180 -2.978 4.579 -6.189 1.00 0.00 H new ATOM 0 HD21 LEU A 180 -2.457 6.054 -3.568 1.00 0.00 H new ATOM 0 HD22 LEU A 180 -1.367 4.958 -4.450 1.00 0.00 H new ATOM 0 HD23 LEU A 180 -0.824 6.598 -4.022 1.00 0.00 H new ATOM 426 N VAL A 181 1.964 6.158 -6.176 1.00 0.00 N ATOM 427 CA VAL A 181 3.288 5.647 -6.627 1.00 0.00 C ATOM 428 C VAL A 181 3.445 4.159 -6.704 1.00 0.00 C ATOM 429 O VAL A 181 3.361 3.469 -5.712 1.00 0.00 O ATOM 430 CB VAL A 181 4.324 6.178 -5.705 1.00 0.00 C ATOM 431 CG1 VAL A 181 5.692 5.644 -6.096 1.00 0.00 C ATOM 432 CG2 VAL A 181 4.260 7.661 -5.859 1.00 0.00 C ATOM 0 H VAL A 181 1.676 5.878 -5.238 1.00 0.00 H new ATOM 0 HA VAL A 181 3.390 5.992 -7.656 1.00 0.00 H new ATOM 0 HB VAL A 181 4.156 5.878 -4.671 1.00 0.00 H new ATOM 0 HG11 VAL A 181 6.445 6.039 -5.414 1.00 0.00 H new ATOM 0 HG12 VAL A 181 5.687 4.555 -6.040 1.00 0.00 H new ATOM 0 HG13 VAL A 181 5.926 5.954 -7.114 1.00 0.00 H new ATOM 0 HG21 VAL A 181 4.999 8.127 -5.207 1.00 0.00 H new ATOM 0 HG22 VAL A 181 4.470 7.929 -6.895 1.00 0.00 H new ATOM 0 HG23 VAL A 181 3.264 8.012 -5.588 1.00 0.00 H new ATOM 442 N ILE A 182 3.683 3.707 -7.898 1.00 0.00 N ATOM 443 CA ILE A 182 3.897 2.262 -8.080 1.00 0.00 C ATOM 444 C ILE A 182 5.271 2.133 -8.753 1.00 0.00 C ATOM 445 O ILE A 182 5.398 1.808 -9.909 1.00 0.00 O ATOM 446 CB ILE A 182 2.822 1.648 -8.986 1.00 0.00 C ATOM 447 CG1 ILE A 182 1.455 2.392 -8.931 1.00 0.00 C ATOM 448 CG2 ILE A 182 2.711 0.250 -8.407 1.00 0.00 C ATOM 449 CD1 ILE A 182 0.739 2.297 -7.594 1.00 0.00 C ATOM 0 H ILE A 182 3.737 4.273 -8.745 1.00 0.00 H new ATOM 0 HA ILE A 182 3.846 1.738 -7.126 1.00 0.00 H new ATOM 0 HB ILE A 182 3.084 1.694 -10.043 1.00 0.00 H new ATOM 0 HG12 ILE A 182 1.618 3.443 -9.167 1.00 0.00 H new ATOM 0 HG13 ILE A 182 0.804 1.988 -9.707 1.00 0.00 H new ATOM 0 HG21 ILE A 182 1.965 -0.317 -8.965 1.00 0.00 H new ATOM 0 HG22 ILE A 182 3.676 -0.251 -8.479 1.00 0.00 H new ATOM 0 HG23 ILE A 182 2.412 0.312 -7.361 1.00 0.00 H new ATOM 0 HD11 ILE A 182 -0.203 2.843 -7.646 1.00 0.00 H new ATOM 0 HD12 ILE A 182 0.540 1.251 -7.362 1.00 0.00 H new ATOM 0 HD13 ILE A 182 1.366 2.729 -6.814 1.00 0.00 H new ATOM 461 N GLU A 183 6.226 2.435 -7.926 1.00 0.00 N ATOM 462 CA GLU A 183 7.714 2.398 -8.148 1.00 0.00 C ATOM 463 C GLU A 183 8.324 3.772 -7.816 1.00 0.00 C ATOM 464 O GLU A 183 7.744 4.795 -8.104 1.00 0.00 O ATOM 465 CB GLU A 183 8.023 2.072 -9.583 1.00 0.00 C ATOM 466 CG GLU A 183 9.512 1.787 -9.679 1.00 0.00 C ATOM 467 CD GLU A 183 9.830 0.414 -9.093 1.00 0.00 C ATOM 468 OE1 GLU A 183 9.309 -0.548 -9.630 1.00 0.00 O ATOM 469 OE2 GLU A 183 10.583 0.417 -8.132 1.00 0.00 O ATOM 0 H GLU A 183 6.006 2.747 -6.980 1.00 0.00 H new ATOM 0 HA GLU A 183 8.138 1.631 -7.500 1.00 0.00 H new ATOM 0 HB2 GLU A 183 7.446 1.208 -9.912 1.00 0.00 H new ATOM 0 HB3 GLU A 183 7.750 2.904 -10.232 1.00 0.00 H new ATOM 0 HG2 GLU A 183 9.830 1.827 -10.721 1.00 0.00 H new ATOM 0 HG3 GLU A 183 10.071 2.556 -9.145 1.00 0.00 H new ATOM 476 N LYS A 184 9.487 3.740 -7.214 1.00 0.00 N ATOM 477 CA LYS A 184 10.229 4.994 -6.870 1.00 0.00 C ATOM 478 C LYS A 184 11.567 4.919 -7.603 1.00 0.00 C ATOM 479 O LYS A 184 12.393 4.086 -7.289 1.00 0.00 O ATOM 480 CB LYS A 184 10.433 5.054 -5.359 1.00 0.00 C ATOM 481 CG LYS A 184 9.038 5.124 -4.748 1.00 0.00 C ATOM 482 CD LYS A 184 9.133 5.364 -3.245 1.00 0.00 C ATOM 483 CE LYS A 184 7.714 5.306 -2.674 1.00 0.00 C ATOM 484 NZ LYS A 184 7.744 5.590 -1.213 1.00 0.00 N ATOM 0 H LYS A 184 9.963 2.880 -6.941 1.00 0.00 H new ATOM 0 HA LYS A 184 9.685 5.891 -7.167 1.00 0.00 H new ATOM 0 HB2 LYS A 184 10.971 4.175 -5.003 1.00 0.00 H new ATOM 0 HB3 LYS A 184 11.025 5.925 -5.080 1.00 0.00 H new ATOM 0 HG2 LYS A 184 8.468 5.926 -5.216 1.00 0.00 H new ATOM 0 HG3 LYS A 184 8.501 4.196 -4.942 1.00 0.00 H new ATOM 0 HD2 LYS A 184 9.765 4.610 -2.776 1.00 0.00 H new ATOM 0 HD3 LYS A 184 9.588 6.333 -3.040 1.00 0.00 H new ATOM 0 HE2 LYS A 184 7.078 6.032 -3.181 1.00 0.00 H new ATOM 0 HE3 LYS A 184 7.280 4.322 -2.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 184 6.975 5.072 -0.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 184 8.657 5.286 -0.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 184 7.621 6.611 -1.055 1.00 0.00 H new ATOM 498 N LYS A 185 11.710 5.819 -8.543 1.00 0.00 N ATOM 499 CA LYS A 185 12.839 5.847 -9.522 1.00 0.00 C ATOM 500 C LYS A 185 14.097 5.011 -9.308 1.00 0.00 C ATOM 501 O LYS A 185 15.139 5.500 -8.924 1.00 0.00 O ATOM 502 CB LYS A 185 13.329 7.317 -9.767 1.00 0.00 C ATOM 503 CG LYS A 185 14.105 8.141 -8.728 1.00 0.00 C ATOM 504 CD LYS A 185 13.403 8.322 -7.411 1.00 0.00 C ATOM 505 CE LYS A 185 13.769 7.198 -6.443 1.00 0.00 C ATOM 506 NZ LYS A 185 15.224 7.268 -6.135 1.00 0.00 N ATOM 0 H LYS A 185 11.046 6.582 -8.677 1.00 0.00 H new ATOM 0 HA LYS A 185 12.339 5.362 -10.360 1.00 0.00 H new ATOM 0 HB2 LYS A 185 13.952 7.287 -10.661 1.00 0.00 H new ATOM 0 HB3 LYS A 185 12.441 7.898 -10.017 1.00 0.00 H new ATOM 0 HG2 LYS A 185 15.066 7.659 -8.548 1.00 0.00 H new ATOM 0 HG3 LYS A 185 14.315 9.124 -9.149 1.00 0.00 H new ATOM 0 HD2 LYS A 185 13.675 9.284 -6.978 1.00 0.00 H new ATOM 0 HD3 LYS A 185 12.324 8.337 -7.568 1.00 0.00 H new ATOM 0 HE2 LYS A 185 13.187 7.288 -5.526 1.00 0.00 H new ATOM 0 HE3 LYS A 185 13.525 6.231 -6.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 15.388 6.952 -5.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 15.747 6.653 -6.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 15.555 8.248 -6.242 1.00 0.00 H new ATOM 520 N PRO A 186 13.944 3.732 -9.565 1.00 0.00 N ATOM 521 CA PRO A 186 15.058 2.768 -9.604 1.00 0.00 C ATOM 522 C PRO A 186 16.181 3.448 -10.368 1.00 0.00 C ATOM 523 O PRO A 186 17.279 3.640 -9.885 1.00 0.00 O ATOM 524 CB PRO A 186 14.471 1.550 -10.317 1.00 0.00 C ATOM 525 CG PRO A 186 13.135 2.064 -10.930 1.00 0.00 C ATOM 526 CD PRO A 186 12.672 3.043 -9.876 1.00 0.00 C ATOM 0 HA PRO A 186 15.466 2.457 -8.642 1.00 0.00 H new ATOM 0 HB2 PRO A 186 15.145 1.179 -11.089 1.00 0.00 H new ATOM 0 HB3 PRO A 186 14.299 0.728 -9.622 1.00 0.00 H new ATOM 0 HG2 PRO A 186 13.286 2.544 -11.897 1.00 0.00 H new ATOM 0 HG3 PRO A 186 12.418 1.258 -11.083 1.00 0.00 H new ATOM 0 HD2 PRO A 186 11.912 3.728 -10.252 1.00 0.00 H new ATOM 0 HD3 PRO A 186 12.248 2.544 -9.005 1.00 0.00 H new ATOM 534 N ASP A 187 15.812 3.784 -11.572 1.00 0.00 N ATOM 535 CA ASP A 187 16.743 4.459 -12.506 1.00 0.00 C ATOM 536 C ASP A 187 16.158 5.778 -13.035 1.00 0.00 C ATOM 537 O ASP A 187 16.555 6.245 -14.084 1.00 0.00 O ATOM 538 CB ASP A 187 16.987 3.477 -13.609 1.00 0.00 C ATOM 539 CG ASP A 187 15.791 3.455 -14.565 1.00 0.00 C ATOM 540 OD1 ASP A 187 14.704 3.177 -14.085 1.00 0.00 O ATOM 541 OD2 ASP A 187 16.042 3.720 -15.729 1.00 0.00 O ATOM 0 H ASP A 187 14.881 3.613 -11.953 1.00 0.00 H new ATOM 0 HA ASP A 187 17.673 4.738 -12.011 1.00 0.00 H new ATOM 0 HB2 ASP A 187 17.893 3.746 -14.153 1.00 0.00 H new ATOM 0 HB3 ASP A 187 17.149 2.483 -13.193 1.00 0.00 H new ATOM 546 N GLY A 188 15.236 6.350 -12.306 1.00 0.00 N ATOM 547 CA GLY A 188 14.615 7.633 -12.755 1.00 0.00 C ATOM 548 C GLY A 188 13.140 7.409 -13.087 1.00 0.00 C ATOM 549 O GLY A 188 12.472 8.333 -13.508 1.00 0.00 O ATOM 0 H GLY A 188 14.886 5.985 -11.420 1.00 0.00 H new ATOM 0 HA2 GLY A 188 14.710 8.386 -11.973 1.00 0.00 H new ATOM 0 HA3 GLY A 188 15.140 8.014 -13.631 1.00 0.00 H new ATOM 553 N TRP A 189 12.660 6.203 -12.894 1.00 0.00 N ATOM 554 CA TRP A 189 11.246 5.928 -13.278 1.00 0.00 C ATOM 555 C TRP A 189 10.287 5.329 -12.250 1.00 0.00 C ATOM 556 O TRP A 189 10.473 4.244 -11.744 1.00 0.00 O ATOM 557 CB TRP A 189 11.332 5.057 -14.482 1.00 0.00 C ATOM 558 CG TRP A 189 11.437 6.002 -15.681 1.00 0.00 C ATOM 559 CD1 TRP A 189 10.381 6.606 -16.284 1.00 0.00 C ATOM 560 CD2 TRP A 189 12.572 6.383 -16.298 1.00 0.00 C ATOM 561 NE1 TRP A 189 10.953 7.319 -17.234 1.00 0.00 N ATOM 562 CE2 TRP A 189 12.273 7.251 -17.324 1.00 0.00 C ATOM 563 CE3 TRP A 189 13.883 6.044 -16.046 1.00 0.00 C ATOM 564 CZ2 TRP A 189 13.285 7.779 -18.100 1.00 0.00 C ATOM 565 CZ3 TRP A 189 14.896 6.569 -16.818 1.00 0.00 C ATOM 566 CH2 TRP A 189 14.597 7.437 -17.847 1.00 0.00 C ATOM 0 H TRP A 189 13.174 5.417 -12.497 1.00 0.00 H new ATOM 0 HA TRP A 189 10.781 6.902 -13.427 1.00 0.00 H new ATOM 0 HB2 TRP A 189 12.200 4.400 -14.427 1.00 0.00 H new ATOM 0 HB3 TRP A 189 10.453 4.418 -14.565 1.00 0.00 H new ATOM 0 HD1 TRP A 189 9.331 6.523 -16.044 1.00 0.00 H new ATOM 0 HE1 TRP A 189 10.404 7.897 -17.871 1.00 0.00 H new ATOM 0 HE3 TRP A 189 14.118 5.364 -15.240 1.00 0.00 H new ATOM 0 HZ2 TRP A 189 13.050 8.460 -18.905 1.00 0.00 H new ATOM 0 HZ3 TRP A 189 15.923 6.301 -16.618 1.00 0.00 H new ATOM 0 HH2 TRP A 189 15.390 7.849 -18.454 1.00 0.00 H new ATOM 577 N TRP A 190 9.256 6.087 -11.997 1.00 0.00 N ATOM 578 CA TRP A 190 8.201 5.697 -11.028 1.00 0.00 C ATOM 579 C TRP A 190 7.040 5.244 -11.906 1.00 0.00 C ATOM 580 O TRP A 190 6.930 5.764 -13.001 1.00 0.00 O ATOM 581 CB TRP A 190 7.735 6.904 -10.232 1.00 0.00 C ATOM 582 CG TRP A 190 8.848 7.645 -9.487 1.00 0.00 C ATOM 583 CD1 TRP A 190 10.080 7.969 -9.966 1.00 0.00 C ATOM 584 CD2 TRP A 190 8.750 8.094 -8.216 1.00 0.00 C ATOM 585 NE1 TRP A 190 10.634 8.586 -8.956 1.00 0.00 N ATOM 586 CE2 TRP A 190 9.919 8.715 -7.853 1.00 0.00 C ATOM 587 CE3 TRP A 190 7.716 8.024 -7.311 1.00 0.00 C ATOM 588 CZ2 TRP A 190 10.059 9.258 -6.592 1.00 0.00 C ATOM 589 CZ3 TRP A 190 7.853 8.566 -6.051 1.00 0.00 C ATOM 590 CH2 TRP A 190 9.026 9.184 -5.688 1.00 0.00 C ATOM 0 H TRP A 190 9.099 6.992 -12.440 1.00 0.00 H new ATOM 0 HA TRP A 190 8.557 4.941 -10.328 1.00 0.00 H new ATOM 0 HB2 TRP A 190 7.243 7.602 -10.910 1.00 0.00 H new ATOM 0 HB3 TRP A 190 6.986 6.579 -9.510 1.00 0.00 H new ATOM 0 HD1 TRP A 190 10.497 7.766 -10.941 1.00 0.00 H new ATOM 0 HE1 TRP A 190 11.583 8.954 -9.017 1.00 0.00 H new ATOM 0 HE3 TRP A 190 6.791 7.541 -7.590 1.00 0.00 H new ATOM 0 HZ2 TRP A 190 10.983 9.743 -6.314 1.00 0.00 H new ATOM 0 HZ3 TRP A 190 7.036 8.505 -5.347 1.00 0.00 H new ATOM 0 HH2 TRP A 190 9.135 9.608 -4.701 1.00 0.00 H new ATOM 601 N ILE A 191 6.204 4.333 -11.465 1.00 0.00 N ATOM 602 CA ILE A 191 5.068 3.995 -12.368 1.00 0.00 C ATOM 603 C ILE A 191 3.900 4.513 -11.543 1.00 0.00 C ATOM 604 O ILE A 191 3.490 3.863 -10.610 1.00 0.00 O ATOM 605 CB ILE A 191 4.956 2.471 -12.580 1.00 0.00 C ATOM 606 CG1 ILE A 191 6.340 1.777 -12.713 1.00 0.00 C ATOM 607 CG2 ILE A 191 4.221 2.271 -13.872 1.00 0.00 C ATOM 608 CD1 ILE A 191 7.168 2.298 -13.891 1.00 0.00 C ATOM 0 H ILE A 191 6.253 3.838 -10.575 1.00 0.00 H new ATOM 0 HA ILE A 191 5.146 4.412 -13.372 1.00 0.00 H new ATOM 0 HB ILE A 191 4.452 2.036 -11.717 1.00 0.00 H new ATOM 0 HG12 ILE A 191 6.902 1.923 -11.790 1.00 0.00 H new ATOM 0 HG13 ILE A 191 6.191 0.704 -12.829 1.00 0.00 H new ATOM 0 HG21 ILE A 191 4.115 1.204 -14.069 1.00 0.00 H new ATOM 0 HG22 ILE A 191 3.233 2.727 -13.803 1.00 0.00 H new ATOM 0 HG23 ILE A 191 4.780 2.736 -14.684 1.00 0.00 H new ATOM 0 HD11 ILE A 191 8.122 1.772 -13.926 1.00 0.00 H new ATOM 0 HD12 ILE A 191 6.625 2.128 -14.821 1.00 0.00 H new ATOM 0 HD13 ILE A 191 7.347 3.366 -13.766 1.00 0.00 H new ATOM 620 N ALA A 192 3.370 5.658 -11.882 1.00 0.00 N ATOM 621 CA ALA A 192 2.365 6.269 -10.963 1.00 0.00 C ATOM 622 C ALA A 192 0.961 6.161 -11.488 1.00 0.00 C ATOM 623 O ALA A 192 0.780 5.799 -12.624 1.00 0.00 O ATOM 624 CB ALA A 192 2.710 7.722 -10.793 1.00 0.00 C ATOM 0 H ALA A 192 3.581 6.184 -12.730 1.00 0.00 H new ATOM 0 HA ALA A 192 2.400 5.730 -10.016 1.00 0.00 H new ATOM 0 HB1 ALA A 192 1.989 8.191 -10.124 1.00 0.00 H new ATOM 0 HB2 ALA A 192 3.710 7.811 -10.368 1.00 0.00 H new ATOM 0 HB3 ALA A 192 2.682 8.218 -11.763 1.00 0.00 H new ATOM 630 N LYS A 193 0.012 6.476 -10.651 1.00 0.00 N ATOM 631 CA LYS A 193 -1.406 6.480 -11.085 1.00 0.00 C ATOM 632 C LYS A 193 -1.845 7.928 -10.907 1.00 0.00 C ATOM 633 O LYS A 193 -1.189 8.665 -10.199 1.00 0.00 O ATOM 634 CB LYS A 193 -2.165 5.547 -10.170 1.00 0.00 C ATOM 635 CG LYS A 193 -1.906 4.085 -10.517 1.00 0.00 C ATOM 636 CD LYS A 193 -2.548 3.221 -9.433 1.00 0.00 C ATOM 637 CE LYS A 193 -2.306 1.749 -9.770 1.00 0.00 C ATOM 638 NZ LYS A 193 -2.827 0.892 -8.668 1.00 0.00 N ATOM 0 H LYS A 193 0.164 6.733 -9.676 1.00 0.00 H new ATOM 0 HA LYS A 193 -1.573 6.147 -12.109 1.00 0.00 H new ATOM 0 HB2 LYS A 193 -1.873 5.733 -9.136 1.00 0.00 H new ATOM 0 HB3 LYS A 193 -3.233 5.755 -10.242 1.00 0.00 H new ATOM 0 HG2 LYS A 193 -2.326 3.845 -11.494 1.00 0.00 H new ATOM 0 HG3 LYS A 193 -0.835 3.891 -10.574 1.00 0.00 H new ATOM 0 HD2 LYS A 193 -2.123 3.460 -8.458 1.00 0.00 H new ATOM 0 HD3 LYS A 193 -3.617 3.424 -9.373 1.00 0.00 H new ATOM 0 HE2 LYS A 193 -2.800 1.494 -10.707 1.00 0.00 H new ATOM 0 HE3 LYS A 193 -1.241 1.568 -9.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 193 -2.662 -0.109 -8.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 193 -2.336 1.129 -7.782 1.00 0.00 H new ATOM 0 HZ3 LYS A 193 -3.847 1.057 -8.553 1.00 0.00 H new ATOM 652 N ASP A 194 -2.919 8.313 -11.536 1.00 0.00 N ATOM 653 CA ASP A 194 -3.371 9.727 -11.377 1.00 0.00 C ATOM 654 C ASP A 194 -4.825 9.774 -10.930 1.00 0.00 C ATOM 655 O ASP A 194 -5.357 8.790 -10.457 1.00 0.00 O ATOM 656 CB ASP A 194 -3.207 10.438 -12.704 1.00 0.00 C ATOM 657 CG ASP A 194 -4.303 10.016 -13.679 1.00 0.00 C ATOM 658 OD1 ASP A 194 -4.554 8.826 -13.788 1.00 0.00 O ATOM 659 OD2 ASP A 194 -4.830 10.942 -14.264 1.00 0.00 O ATOM 0 H ASP A 194 -3.494 7.727 -12.141 1.00 0.00 H new ATOM 0 HA ASP A 194 -2.769 10.221 -10.615 1.00 0.00 H new ATOM 0 HB2 ASP A 194 -3.244 11.517 -12.552 1.00 0.00 H new ATOM 0 HB3 ASP A 194 -2.229 10.209 -13.127 1.00 0.00 H new ATOM 664 N ALA A 195 -5.433 10.917 -11.094 1.00 0.00 N ATOM 665 CA ALA A 195 -6.844 11.065 -10.669 1.00 0.00 C ATOM 666 C ALA A 195 -7.768 10.915 -11.880 1.00 0.00 C ATOM 667 O ALA A 195 -8.737 11.632 -12.034 1.00 0.00 O ATOM 668 CB ALA A 195 -6.985 12.439 -10.045 1.00 0.00 C ATOM 0 H ALA A 195 -5.011 11.750 -11.503 1.00 0.00 H new ATOM 0 HA ALA A 195 -7.121 10.297 -9.947 1.00 0.00 H new ATOM 0 HB1 ALA A 195 -8.014 12.586 -9.718 1.00 0.00 H new ATOM 0 HB2 ALA A 195 -6.317 12.519 -9.187 1.00 0.00 H new ATOM 0 HB3 ALA A 195 -6.725 13.201 -10.780 1.00 0.00 H new ATOM 674 N LYS A 196 -7.416 9.969 -12.705 1.00 0.00 N ATOM 675 CA LYS A 196 -8.246 9.640 -13.898 1.00 0.00 C ATOM 676 C LYS A 196 -8.482 8.131 -13.857 1.00 0.00 C ATOM 677 O LYS A 196 -9.562 7.653 -14.138 1.00 0.00 O ATOM 678 CB LYS A 196 -7.492 10.028 -15.165 1.00 0.00 C ATOM 679 CG LYS A 196 -8.411 9.819 -16.369 1.00 0.00 C ATOM 680 CD LYS A 196 -7.762 10.459 -17.600 1.00 0.00 C ATOM 681 CE LYS A 196 -8.646 10.174 -18.814 1.00 0.00 C ATOM 682 NZ LYS A 196 -8.031 10.764 -20.036 1.00 0.00 N ATOM 0 H LYS A 196 -6.575 9.401 -12.602 1.00 0.00 H new ATOM 0 HA LYS A 196 -9.193 10.181 -13.894 1.00 0.00 H new ATOM 0 HB2 LYS A 196 -7.173 11.069 -15.110 1.00 0.00 H new ATOM 0 HB3 LYS A 196 -6.591 9.423 -15.268 1.00 0.00 H new ATOM 0 HG2 LYS A 196 -8.575 8.755 -16.539 1.00 0.00 H new ATOM 0 HG3 LYS A 196 -9.387 10.266 -16.181 1.00 0.00 H new ATOM 0 HD2 LYS A 196 -7.652 11.534 -17.455 1.00 0.00 H new ATOM 0 HD3 LYS A 196 -6.762 10.054 -17.755 1.00 0.00 H new ATOM 0 HE2 LYS A 196 -8.769 9.098 -18.941 1.00 0.00 H new ATOM 0 HE3 LYS A 196 -9.640 10.593 -18.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 196 -8.636 10.567 -20.859 1.00 0.00 H new ATOM 0 HZ2 LYS A 196 -7.935 11.792 -19.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 196 -7.092 10.345 -20.189 1.00 0.00 H new ATOM 696 N GLY A 197 -7.438 7.432 -13.501 1.00 0.00 N ATOM 697 CA GLY A 197 -7.506 5.951 -13.380 1.00 0.00 C ATOM 698 C GLY A 197 -6.203 5.390 -13.933 1.00 0.00 C ATOM 699 O GLY A 197 -5.567 4.549 -13.329 1.00 0.00 O ATOM 0 H GLY A 197 -6.526 7.834 -13.286 1.00 0.00 H new ATOM 0 HA2 GLY A 197 -7.640 5.656 -12.339 1.00 0.00 H new ATOM 0 HA3 GLY A 197 -8.359 5.559 -13.934 1.00 0.00 H new ATOM 703 N ASN A 198 -5.847 5.887 -15.081 1.00 0.00 N ATOM 704 CA ASN A 198 -4.591 5.448 -15.735 1.00 0.00 C ATOM 705 C ASN A 198 -3.334 5.641 -14.904 1.00 0.00 C ATOM 706 O ASN A 198 -3.301 6.398 -13.952 1.00 0.00 O ATOM 707 CB ASN A 198 -4.455 6.207 -17.021 1.00 0.00 C ATOM 708 CG ASN A 198 -4.877 7.665 -16.832 1.00 0.00 C ATOM 709 OD1 ASN A 198 -6.047 7.968 -16.929 1.00 0.00 O ATOM 710 ND2 ASN A 198 -4.003 8.593 -16.562 1.00 0.00 N ATOM 0 H ASN A 198 -6.380 6.586 -15.598 1.00 0.00 H new ATOM 0 HA ASN A 198 -4.673 4.372 -15.886 1.00 0.00 H new ATOM 0 HB2 ASN A 198 -3.423 6.164 -17.368 1.00 0.00 H new ATOM 0 HB3 ASN A 198 -5.070 5.742 -17.791 1.00 0.00 H new ATOM 0 HD21 ASN A 198 -4.307 9.558 -16.435 1.00 0.00 H new ATOM 0 HD22 ASN A 198 -3.015 8.354 -16.477 1.00 0.00 H new ATOM 717 N GLU A 199 -2.324 4.920 -15.309 1.00 0.00 N ATOM 718 CA GLU A 199 -1.016 5.053 -14.646 1.00 0.00 C ATOM 719 C GLU A 199 0.048 5.239 -15.714 1.00 0.00 C ATOM 720 O GLU A 199 -0.108 4.766 -16.822 1.00 0.00 O ATOM 721 CB GLU A 199 -0.786 3.791 -13.827 1.00 0.00 C ATOM 722 CG GLU A 199 0.555 3.196 -14.195 1.00 0.00 C ATOM 723 CD GLU A 199 0.914 2.132 -13.163 1.00 0.00 C ATOM 724 OE1 GLU A 199 1.167 2.557 -12.048 1.00 0.00 O ATOM 725 OE2 GLU A 199 0.916 0.973 -13.544 1.00 0.00 O ATOM 0 H GLU A 199 -2.358 4.245 -16.073 1.00 0.00 H new ATOM 0 HA GLU A 199 -0.976 5.915 -13.980 1.00 0.00 H new ATOM 0 HB2 GLU A 199 -0.814 4.024 -12.763 1.00 0.00 H new ATOM 0 HB3 GLU A 199 -1.581 3.070 -14.017 1.00 0.00 H new ATOM 0 HG2 GLU A 199 0.514 2.757 -15.192 1.00 0.00 H new ATOM 0 HG3 GLU A 199 1.320 3.972 -14.220 1.00 0.00 H new ATOM 732 N GLY A 200 1.104 5.923 -15.356 1.00 0.00 N ATOM 733 CA GLY A 200 2.171 6.188 -16.353 1.00 0.00 C ATOM 734 C GLY A 200 3.563 6.062 -15.788 1.00 0.00 C ATOM 735 O GLY A 200 3.807 5.405 -14.800 1.00 0.00 O ATOM 0 H GLY A 200 1.269 6.304 -14.424 1.00 0.00 H new ATOM 0 HA2 GLY A 200 2.061 5.493 -17.186 1.00 0.00 H new ATOM 0 HA3 GLY A 200 2.040 7.192 -16.756 1.00 0.00 H new ATOM 739 N LEU A 201 4.419 6.739 -16.495 1.00 0.00 N ATOM 740 CA LEU A 201 5.867 6.805 -16.186 1.00 0.00 C ATOM 741 C LEU A 201 6.208 8.218 -15.752 1.00 0.00 C ATOM 742 O LEU A 201 6.437 9.080 -16.578 1.00 0.00 O ATOM 743 CB LEU A 201 6.662 6.449 -17.429 1.00 0.00 C ATOM 744 CG LEU A 201 6.606 4.954 -17.745 1.00 0.00 C ATOM 745 CD1 LEU A 201 7.464 4.728 -18.990 1.00 0.00 C ATOM 746 CD2 LEU A 201 7.235 4.161 -16.603 1.00 0.00 C ATOM 0 H LEU A 201 4.154 7.278 -17.320 1.00 0.00 H new ATOM 0 HA LEU A 201 6.113 6.103 -15.389 1.00 0.00 H new ATOM 0 HB2 LEU A 201 6.276 7.012 -18.278 1.00 0.00 H new ATOM 0 HB3 LEU A 201 7.700 6.751 -17.292 1.00 0.00 H new ATOM 0 HG LEU A 201 5.573 4.637 -17.889 1.00 0.00 H new ATOM 0 HD11 LEU A 201 7.453 3.670 -19.253 1.00 0.00 H new ATOM 0 HD12 LEU A 201 7.064 5.312 -19.819 1.00 0.00 H new ATOM 0 HD13 LEU A 201 8.488 5.041 -18.788 1.00 0.00 H new ATOM 0 HD21 LEU A 201 7.193 3.096 -16.833 1.00 0.00 H new ATOM 0 HD22 LEU A 201 8.275 4.464 -16.479 1.00 0.00 H new ATOM 0 HD23 LEU A 201 6.688 4.355 -15.681 1.00 0.00 H new ATOM 758 N VAL A 202 6.229 8.414 -14.461 1.00 0.00 N ATOM 759 CA VAL A 202 6.542 9.775 -13.943 1.00 0.00 C ATOM 760 C VAL A 202 7.899 9.654 -13.250 1.00 0.00 C ATOM 761 O VAL A 202 8.266 8.587 -12.810 1.00 0.00 O ATOM 762 CB VAL A 202 5.432 10.193 -12.957 1.00 0.00 C ATOM 763 CG1 VAL A 202 4.065 9.886 -13.590 1.00 0.00 C ATOM 764 CG2 VAL A 202 5.544 9.429 -11.639 1.00 0.00 C ATOM 0 H VAL A 202 6.046 7.703 -13.753 1.00 0.00 H new ATOM 0 HA VAL A 202 6.586 10.533 -14.725 1.00 0.00 H new ATOM 0 HB VAL A 202 5.538 11.258 -12.751 1.00 0.00 H new ATOM 0 HG11 VAL A 202 3.272 10.177 -12.902 1.00 0.00 H new ATOM 0 HG12 VAL A 202 3.961 10.444 -14.520 1.00 0.00 H new ATOM 0 HG13 VAL A 202 3.992 8.818 -13.797 1.00 0.00 H new ATOM 0 HG21 VAL A 202 4.748 9.746 -10.966 1.00 0.00 H new ATOM 0 HG22 VAL A 202 5.454 8.360 -11.830 1.00 0.00 H new ATOM 0 HG23 VAL A 202 6.511 9.635 -11.180 1.00 0.00 H new ATOM 774 N PRO A 203 8.617 10.738 -13.170 1.00 0.00 N ATOM 775 CA PRO A 203 9.966 10.790 -12.549 1.00 0.00 C ATOM 776 C PRO A 203 9.904 11.069 -11.044 1.00 0.00 C ATOM 777 O PRO A 203 8.842 11.189 -10.465 1.00 0.00 O ATOM 778 CB PRO A 203 10.633 11.887 -13.316 1.00 0.00 C ATOM 779 CG PRO A 203 9.461 12.922 -13.358 1.00 0.00 C ATOM 780 CD PRO A 203 8.219 12.064 -13.705 1.00 0.00 C ATOM 0 HA PRO A 203 10.505 9.844 -12.604 1.00 0.00 H new ATOM 0 HB2 PRO A 203 11.517 12.275 -12.809 1.00 0.00 H new ATOM 0 HB3 PRO A 203 10.949 11.571 -14.310 1.00 0.00 H new ATOM 0 HG2 PRO A 203 9.341 13.429 -12.401 1.00 0.00 H new ATOM 0 HG3 PRO A 203 9.636 13.693 -14.108 1.00 0.00 H new ATOM 0 HD2 PRO A 203 7.313 12.443 -13.231 1.00 0.00 H new ATOM 0 HD3 PRO A 203 8.028 12.033 -14.778 1.00 0.00 H new ATOM 788 N ARG A 204 11.067 11.160 -10.459 1.00 0.00 N ATOM 789 CA ARG A 204 11.139 11.574 -9.022 1.00 0.00 C ATOM 790 C ARG A 204 10.863 13.051 -8.973 1.00 0.00 C ATOM 791 O ARG A 204 9.942 13.519 -8.341 1.00 0.00 O ATOM 792 CB ARG A 204 12.528 11.363 -8.473 1.00 0.00 C ATOM 793 CG ARG A 204 12.661 11.981 -7.062 1.00 0.00 C ATOM 794 CD ARG A 204 14.136 11.999 -6.653 1.00 0.00 C ATOM 795 NE ARG A 204 14.205 12.524 -5.262 1.00 0.00 N ATOM 796 CZ ARG A 204 14.582 11.724 -4.304 1.00 0.00 C ATOM 797 NH1 ARG A 204 15.851 11.631 -4.016 1.00 0.00 N ATOM 798 NH2 ARG A 204 13.667 11.041 -3.669 1.00 0.00 N ATOM 0 H ARG A 204 11.964 10.969 -10.905 1.00 0.00 H new ATOM 0 HA ARG A 204 10.427 10.989 -8.440 1.00 0.00 H new ATOM 0 HB2 ARG A 204 12.749 10.296 -8.430 1.00 0.00 H new ATOM 0 HB3 ARG A 204 13.261 11.813 -9.143 1.00 0.00 H new ATOM 0 HG2 ARG A 204 12.258 12.994 -7.057 1.00 0.00 H new ATOM 0 HG3 ARG A 204 12.080 11.403 -6.343 1.00 0.00 H new ATOM 0 HD2 ARG A 204 14.562 10.997 -6.707 1.00 0.00 H new ATOM 0 HD3 ARG A 204 14.714 12.628 -7.330 1.00 0.00 H new ATOM 0 HE ARG A 204 13.961 13.494 -5.061 1.00 0.00 H new ATOM 0 HH11 ARG A 204 16.534 12.180 -4.538 1.00 0.00 H new ATOM 0 HH12 ARG A 204 16.160 11.009 -3.269 1.00 0.00 H new ATOM 0 HH21 ARG A 204 12.685 11.141 -3.927 1.00 0.00 H new ATOM 0 HH22 ARG A 204 13.934 10.408 -2.915 1.00 0.00 H new ATOM 812 N THR A 205 11.742 13.686 -9.677 1.00 0.00 N ATOM 813 CA THR A 205 11.774 15.179 -9.835 1.00 0.00 C ATOM 814 C THR A 205 10.483 15.952 -9.493 1.00 0.00 C ATOM 815 O THR A 205 10.555 16.925 -8.771 1.00 0.00 O ATOM 816 CB THR A 205 12.157 15.523 -11.282 1.00 0.00 C ATOM 817 OG1 THR A 205 11.092 15.015 -12.066 1.00 0.00 O ATOM 818 CG2 THR A 205 13.369 14.711 -11.748 1.00 0.00 C ATOM 0 H THR A 205 12.489 13.211 -10.184 1.00 0.00 H new ATOM 0 HA THR A 205 12.506 15.503 -9.095 1.00 0.00 H new ATOM 0 HB THR A 205 12.358 16.591 -11.363 1.00 0.00 H new ATOM 0 HG1 THR A 205 10.497 15.749 -12.324 1.00 0.00 H new ATOM 0 HG21 THR A 205 13.613 14.979 -12.776 1.00 0.00 H new ATOM 0 HG22 THR A 205 14.221 14.928 -11.104 1.00 0.00 H new ATOM 0 HG23 THR A 205 13.136 13.647 -11.696 1.00 0.00 H new ATOM 826 N TYR A 206 9.346 15.536 -9.990 1.00 0.00 N ATOM 827 CA TYR A 206 8.094 16.303 -9.692 1.00 0.00 C ATOM 828 C TYR A 206 7.147 15.531 -8.765 1.00 0.00 C ATOM 829 O TYR A 206 5.948 15.595 -8.939 1.00 0.00 O ATOM 830 CB TYR A 206 7.382 16.580 -10.998 1.00 0.00 C ATOM 831 CG TYR A 206 8.344 17.245 -11.978 1.00 0.00 C ATOM 832 CD1 TYR A 206 8.975 18.434 -11.666 1.00 0.00 C ATOM 833 CD2 TYR A 206 8.589 16.652 -13.198 1.00 0.00 C ATOM 834 CE1 TYR A 206 9.841 19.018 -12.568 1.00 0.00 C ATOM 835 CE2 TYR A 206 9.454 17.235 -14.098 1.00 0.00 C ATOM 836 CZ TYR A 206 10.086 18.422 -13.789 1.00 0.00 C ATOM 837 OH TYR A 206 10.951 19.007 -14.691 1.00 0.00 O ATOM 0 H TYR A 206 9.228 14.712 -10.580 1.00 0.00 H new ATOM 0 HA TYR A 206 8.374 17.226 -9.184 1.00 0.00 H new ATOM 0 HB2 TYR A 206 7.003 15.650 -11.421 1.00 0.00 H new ATOM 0 HB3 TYR A 206 6.521 17.226 -10.824 1.00 0.00 H new ATOM 0 HD1 TYR A 206 8.790 18.908 -10.713 1.00 0.00 H new ATOM 0 HD2 TYR A 206 8.099 15.723 -13.450 1.00 0.00 H new ATOM 0 HE1 TYR A 206 10.330 19.947 -12.317 1.00 0.00 H new ATOM 0 HE2 TYR A 206 9.638 16.760 -15.050 1.00 0.00 H new ATOM 0 HH TYR A 206 11.007 18.453 -15.497 1.00 0.00 H new ATOM 847 N LEU A 207 7.716 14.844 -7.809 1.00 0.00 N ATOM 848 CA LEU A 207 6.929 14.007 -6.843 1.00 0.00 C ATOM 849 C LEU A 207 7.204 14.415 -5.400 1.00 0.00 C ATOM 850 O LEU A 207 8.253 14.096 -4.879 1.00 0.00 O ATOM 851 CB LEU A 207 7.295 12.511 -6.906 1.00 0.00 C ATOM 852 CG LEU A 207 6.638 11.668 -8.011 1.00 0.00 C ATOM 853 CD1 LEU A 207 5.341 11.121 -7.411 1.00 0.00 C ATOM 854 CD2 LEU A 207 6.285 12.493 -9.252 1.00 0.00 C ATOM 0 H LEU A 207 8.723 14.826 -7.650 1.00 0.00 H new ATOM 0 HA LEU A 207 5.890 14.167 -7.132 1.00 0.00 H new ATOM 0 HB2 LEU A 207 8.376 12.433 -7.021 1.00 0.00 H new ATOM 0 HB3 LEU A 207 7.043 12.062 -5.945 1.00 0.00 H new ATOM 0 HG LEU A 207 7.332 10.890 -8.331 1.00 0.00 H new ATOM 0 HD11 LEU A 207 4.826 10.510 -8.153 1.00 0.00 H new ATOM 0 HD12 LEU A 207 5.573 10.512 -6.537 1.00 0.00 H new ATOM 0 HD13 LEU A 207 4.699 11.951 -7.115 1.00 0.00 H new ATOM 0 HD21 LEU A 207 5.824 11.847 -9.999 1.00 0.00 H new ATOM 0 HD22 LEU A 207 5.588 13.284 -8.977 1.00 0.00 H new ATOM 0 HD23 LEU A 207 7.192 12.936 -9.665 1.00 0.00 H new ATOM 866 N GLU A 208 6.282 15.100 -4.785 1.00 0.00 N ATOM 867 CA GLU A 208 6.493 15.416 -3.338 1.00 0.00 C ATOM 868 C GLU A 208 5.441 14.636 -2.552 1.00 0.00 C ATOM 869 O GLU A 208 4.412 14.311 -3.098 1.00 0.00 O ATOM 870 CB GLU A 208 6.331 16.919 -3.130 1.00 0.00 C ATOM 871 CG GLU A 208 7.575 17.592 -3.731 1.00 0.00 C ATOM 872 CD GLU A 208 7.589 19.086 -3.392 1.00 0.00 C ATOM 873 OE1 GLU A 208 7.443 19.376 -2.216 1.00 0.00 O ATOM 874 OE2 GLU A 208 7.748 19.852 -4.326 1.00 0.00 O ATOM 0 H GLU A 208 5.417 15.447 -5.200 1.00 0.00 H new ATOM 0 HA GLU A 208 7.491 15.136 -3.001 1.00 0.00 H new ATOM 0 HB2 GLU A 208 5.424 17.280 -3.616 1.00 0.00 H new ATOM 0 HB3 GLU A 208 6.240 17.154 -2.070 1.00 0.00 H new ATOM 0 HG2 GLU A 208 8.476 17.116 -3.345 1.00 0.00 H new ATOM 0 HG3 GLU A 208 7.582 17.458 -4.813 1.00 0.00 H new ATOM 881 N PRO A 209 5.688 14.335 -1.305 1.00 0.00 N ATOM 882 CA PRO A 209 4.728 13.554 -0.483 1.00 0.00 C ATOM 883 C PRO A 209 3.410 14.304 -0.275 1.00 0.00 C ATOM 884 O PRO A 209 3.333 15.497 -0.499 1.00 0.00 O ATOM 885 CB PRO A 209 5.490 13.296 0.808 1.00 0.00 C ATOM 886 CG PRO A 209 6.393 14.552 0.907 1.00 0.00 C ATOM 887 CD PRO A 209 6.902 14.713 -0.537 1.00 0.00 C ATOM 0 HA PRO A 209 4.414 12.624 -0.957 1.00 0.00 H new ATOM 0 HB2 PRO A 209 4.822 13.205 1.665 1.00 0.00 H new ATOM 0 HB3 PRO A 209 6.074 12.377 0.760 1.00 0.00 H new ATOM 0 HG2 PRO A 209 5.835 15.427 1.240 1.00 0.00 H new ATOM 0 HG3 PRO A 209 7.212 14.408 1.612 1.00 0.00 H new ATOM 0 HD2 PRO A 209 7.225 15.732 -0.750 1.00 0.00 H new ATOM 0 HD3 PRO A 209 7.747 14.059 -0.752 1.00 0.00 H new ATOM 895 N TYR A 210 2.410 13.579 0.150 1.00 0.00 N ATOM 896 CA TYR A 210 1.077 14.202 0.398 1.00 0.00 C ATOM 897 C TYR A 210 0.672 13.925 1.849 1.00 0.00 C ATOM 898 O TYR A 210 1.427 13.307 2.573 1.00 0.00 O ATOM 899 CB TYR A 210 0.077 13.591 -0.551 1.00 0.00 C ATOM 900 CG TYR A 210 -1.197 14.437 -0.592 1.00 0.00 C ATOM 901 CD1 TYR A 210 -1.153 15.760 -0.974 1.00 0.00 C ATOM 902 CD2 TYR A 210 -2.407 13.885 -0.252 1.00 0.00 C ATOM 903 CE1 TYR A 210 -2.293 16.524 -1.019 1.00 0.00 C ATOM 904 CE2 TYR A 210 -3.558 14.644 -0.293 1.00 0.00 C ATOM 905 CZ TYR A 210 -3.511 15.969 -0.677 1.00 0.00 C ATOM 906 OH TYR A 210 -4.665 16.724 -0.719 1.00 0.00 O ATOM 0 H TYR A 210 2.459 12.577 0.337 1.00 0.00 H new ATOM 0 HA TYR A 210 1.114 15.279 0.235 1.00 0.00 H new ATOM 0 HB2 TYR A 210 0.508 13.521 -1.550 1.00 0.00 H new ATOM 0 HB3 TYR A 210 -0.162 12.576 -0.235 1.00 0.00 H new ATOM 0 HD1 TYR A 210 -0.206 16.204 -1.243 1.00 0.00 H new ATOM 0 HD2 TYR A 210 -2.458 12.849 0.050 1.00 0.00 H new ATOM 0 HE1 TYR A 210 -2.237 17.559 -1.322 1.00 0.00 H new ATOM 0 HE2 TYR A 210 -4.504 14.198 -0.022 1.00 0.00 H new ATOM 0 HH TYR A 210 -5.427 16.171 -0.448 1.00 0.00 H new ATOM 916 N SER A 211 -0.489 14.379 2.242 1.00 0.00 N ATOM 917 CA SER A 211 -0.936 14.142 3.646 1.00 0.00 C ATOM 918 C SER A 211 -2.228 13.318 3.713 1.00 0.00 C ATOM 919 O SER A 211 -3.033 13.502 4.604 1.00 0.00 O ATOM 920 CB SER A 211 -1.149 15.500 4.307 1.00 0.00 C ATOM 921 OG SER A 211 -2.141 16.105 3.491 1.00 0.00 O ATOM 0 H SER A 211 -1.142 14.900 1.657 1.00 0.00 H new ATOM 0 HA SER A 211 -0.170 13.567 4.167 1.00 0.00 H new ATOM 0 HB2 SER A 211 -1.484 15.397 5.339 1.00 0.00 H new ATOM 0 HB3 SER A 211 -0.231 16.087 4.327 1.00 0.00 H new ATOM 0 HG SER A 211 -2.352 16.996 3.839 1.00 0.00 H new ATOM 927 N GLU A 212 -2.396 12.429 2.771 1.00 0.00 N ATOM 928 CA GLU A 212 -3.592 11.533 2.798 1.00 0.00 C ATOM 929 C GLU A 212 -3.100 10.113 2.516 1.00 0.00 C ATOM 930 O GLU A 212 -1.967 10.038 2.071 1.00 0.00 O ATOM 931 CB GLU A 212 -4.584 12.015 1.719 1.00 0.00 C ATOM 932 CG GLU A 212 -5.881 11.176 1.638 1.00 0.00 C ATOM 933 CD GLU A 212 -6.659 11.209 2.958 1.00 0.00 C ATOM 934 OE1 GLU A 212 -6.231 10.532 3.878 1.00 0.00 O ATOM 935 OE2 GLU A 212 -7.649 11.919 2.965 1.00 0.00 O ATOM 936 OXT GLU A 212 -3.864 9.192 2.753 1.00 0.00 O ATOM 0 H GLU A 212 -1.761 12.283 1.986 1.00 0.00 H new ATOM 0 HA GLU A 212 -4.103 11.551 3.760 1.00 0.00 H new ATOM 0 HB2 GLU A 212 -4.847 13.054 1.920 1.00 0.00 H new ATOM 0 HB3 GLU A 212 -4.088 11.994 0.749 1.00 0.00 H new ATOM 0 HG2 GLU A 212 -6.511 11.556 0.834 1.00 0.00 H new ATOM 0 HG3 GLU A 212 -5.633 10.145 1.387 1.00 0.00 H new TER 943 GLU A 212