USER MOD reduce.3.24.130724 H: found=0, std=0, add=727, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 727 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 216 ASN : amide:sc= 0.535 K(o=1.3,f=-0.65) USER MOD Set 1.2: A 217 SER OG : rot -75:sc= 0.718 USER MOD Set 2.1: A 182 HIS :FLIP no HE2:sc= -3.26! C(o=-5.6!,f=-2.7!) USER MOD Set 2.2: A 192 THR OG1 : rot 107:sc= 0.585 USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 159 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 162 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 165 LYS NZ :NH3+ 147:sc= -0.0335 (180deg=-0.709) USER MOD Single : A 168 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 173 SER OG : rot 180:sc= 0 USER MOD Single : A 180 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 181 GLN : amide:sc= 0 X(o=0,f=-0.098) USER MOD Single : A 187 ASN : amide:sc=-0.00763 X(o=-0.0076,f=-0.24) USER MOD Single : A 188 SER OG : rot 180:sc= 0.103 USER MOD Single : A 190 TYR OH : rot 180:sc= 0 USER MOD Single : A 193 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 201 HIS : no HD1:sc= -0.0478 K(o=-0.048,f=-0.57) USER MOD Single : A 202 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 207 GLN : amide:sc= -0.71 X(o=-0.71,f=-0.85) USER MOD Single : A 211 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 224 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 225 HIS : no HD1:sc= -4.16 K(o=-4.2,f=-5.5!) USER MOD Single : A 233 LYS NZ :NH3+ 152:sc= -0.231 (180deg=-0.912) USER MOD Single : A 234 ASN : amide:sc= -0.78 K(o=-0.78,f=-1.5) USER MOD Single : A 235 THR OG1 : rot -57:sc= 1.28 USER MOD Single : A 236 TYR OH : rot 180:sc= 0 USER MOD Single : A 240 TYR OH : rot 180:sc= 0 USER MOD Single : A 242 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 245 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 247 SER OG : rot 180:sc= 0 USER MOD Single : A 248 ASN : amide:sc= -0.0124 X(o=-0.012,f=-0.012) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 155 -8.787 -8.222 -19.430 1.00 0.00 N ATOM 2 CA ALA A 155 -7.781 -7.931 -18.376 1.00 0.00 C ATOM 3 C ALA A 155 -8.315 -6.914 -17.371 1.00 0.00 C ATOM 4 O ALA A 155 -9.391 -6.346 -17.560 1.00 0.00 O ATOM 5 CB ALA A 155 -6.494 -7.422 -19.005 1.00 0.00 C ATOM 0 HA ALA A 155 -7.573 -8.858 -17.841 1.00 0.00 H new ATOM 0 HB1 ALA A 155 -5.765 -7.212 -18.223 1.00 0.00 H new ATOM 0 HB2 ALA A 155 -6.095 -8.179 -19.680 1.00 0.00 H new ATOM 0 HB3 ALA A 155 -6.699 -6.509 -19.564 1.00 0.00 H new ATOM 13 N GLU A 156 -7.555 -6.690 -16.304 1.00 0.00 N ATOM 14 CA GLU A 156 -7.950 -5.741 -15.270 1.00 0.00 C ATOM 15 C GLU A 156 -7.306 -4.379 -15.507 1.00 0.00 C ATOM 16 O GLU A 156 -6.542 -4.200 -16.457 1.00 0.00 O ATOM 17 CB GLU A 156 -7.565 -6.271 -13.887 1.00 0.00 C ATOM 18 CG GLU A 156 -8.438 -7.419 -13.411 1.00 0.00 C ATOM 19 CD GLU A 156 -8.027 -7.939 -12.048 1.00 0.00 C ATOM 20 OE1 GLU A 156 -6.840 -7.790 -11.688 1.00 0.00 O ATOM 21 OE2 GLU A 156 -8.892 -8.496 -11.338 1.00 0.00 O ATOM 0 H GLU A 156 -6.662 -7.153 -16.133 1.00 0.00 H new ATOM 0 HA GLU A 156 -9.033 -5.622 -15.315 1.00 0.00 H new ATOM 0 HB2 GLU A 156 -6.526 -6.601 -13.910 1.00 0.00 H new ATOM 0 HB3 GLU A 156 -7.625 -5.456 -13.165 1.00 0.00 H new ATOM 0 HG2 GLU A 156 -9.476 -7.089 -13.372 1.00 0.00 H new ATOM 0 HG3 GLU A 156 -8.389 -8.232 -14.135 1.00 0.00 H new ATOM 28 N LYS A 157 -7.618 -3.419 -14.640 1.00 0.00 N ATOM 29 CA LYS A 157 -7.070 -2.072 -14.761 1.00 0.00 C ATOM 30 C LYS A 157 -5.736 -1.954 -14.030 1.00 0.00 C ATOM 31 O LYS A 157 -5.530 -2.576 -12.988 1.00 0.00 O ATOM 32 CB LYS A 157 -8.057 -1.040 -14.209 1.00 0.00 C ATOM 33 CG LYS A 157 -9.501 -1.298 -14.605 1.00 0.00 C ATOM 34 CD LYS A 157 -10.461 -0.422 -13.813 1.00 0.00 C ATOM 35 CE LYS A 157 -10.453 1.012 -14.319 1.00 0.00 C ATOM 36 NZ LYS A 157 -11.570 1.272 -15.269 1.00 0.00 N ATOM 0 H LYS A 157 -8.247 -3.549 -13.847 1.00 0.00 H new ATOM 0 HA LYS A 157 -6.903 -1.875 -15.820 1.00 0.00 H new ATOM 0 HB2 LYS A 157 -7.985 -1.028 -13.121 1.00 0.00 H new ATOM 0 HB3 LYS A 157 -7.766 -0.050 -14.559 1.00 0.00 H new ATOM 0 HG2 LYS A 157 -9.627 -1.107 -15.671 1.00 0.00 H new ATOM 0 HG3 LYS A 157 -9.743 -2.348 -14.439 1.00 0.00 H new ATOM 0 HD2 LYS A 157 -11.470 -0.829 -13.885 1.00 0.00 H new ATOM 0 HD3 LYS A 157 -10.185 -0.439 -12.759 1.00 0.00 H new ATOM 0 HE2 LYS A 157 -10.529 1.696 -13.474 1.00 0.00 H new ATOM 0 HE3 LYS A 157 -9.502 1.218 -14.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 157 -11.529 2.260 -15.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 157 -11.484 0.637 -16.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 157 -12.478 1.100 -14.792 1.00 0.00 H new ATOM 50 N VAL A 158 -4.837 -1.149 -14.584 1.00 0.00 N ATOM 51 CA VAL A 158 -3.523 -0.941 -13.986 1.00 0.00 C ATOM 52 C VAL A 158 -3.385 0.485 -13.467 1.00 0.00 C ATOM 53 O VAL A 158 -3.678 1.445 -14.181 1.00 0.00 O ATOM 54 CB VAL A 158 -2.391 -1.219 -14.998 1.00 0.00 C ATOM 55 CG1 VAL A 158 -1.034 -1.231 -14.301 1.00 0.00 C ATOM 56 CG2 VAL A 158 -2.641 -2.528 -15.735 1.00 0.00 C ATOM 0 H VAL A 158 -4.994 -0.629 -15.447 1.00 0.00 H new ATOM 0 HA VAL A 158 -3.435 -1.643 -13.156 1.00 0.00 H new ATOM 0 HB VAL A 158 -2.382 -0.415 -15.734 1.00 0.00 H new ATOM 0 HG11 VAL A 158 -0.251 -1.429 -15.033 1.00 0.00 H new ATOM 0 HG12 VAL A 158 -0.857 -0.263 -13.833 1.00 0.00 H new ATOM 0 HG13 VAL A 158 -1.023 -2.010 -13.539 1.00 0.00 H new ATOM 0 HG21 VAL A 158 -1.832 -2.707 -16.444 1.00 0.00 H new ATOM 0 HG22 VAL A 158 -2.682 -3.347 -15.017 1.00 0.00 H new ATOM 0 HG23 VAL A 158 -3.588 -2.468 -16.272 1.00 0.00 H new ATOM 66 N MET A 159 -2.947 0.619 -12.220 1.00 0.00 N ATOM 67 CA MET A 159 -2.782 1.933 -11.610 1.00 0.00 C ATOM 68 C MET A 159 -1.382 2.106 -11.030 1.00 0.00 C ATOM 69 O MET A 159 -0.725 1.132 -10.660 1.00 0.00 O ATOM 70 CB MET A 159 -3.829 2.141 -10.513 1.00 0.00 C ATOM 71 CG MET A 159 -4.438 3.534 -10.517 1.00 0.00 C ATOM 72 SD MET A 159 -5.110 4.007 -8.911 1.00 0.00 S ATOM 73 CE MET A 159 -5.138 5.790 -9.070 1.00 0.00 C ATOM 0 H MET A 159 -2.701 -0.163 -11.614 1.00 0.00 H new ATOM 0 HA MET A 159 -2.921 2.682 -12.390 1.00 0.00 H new ATOM 0 HB2 MET A 159 -4.623 1.405 -10.635 1.00 0.00 H new ATOM 0 HB3 MET A 159 -3.369 1.956 -9.542 1.00 0.00 H new ATOM 0 HG2 MET A 159 -3.679 4.257 -10.815 1.00 0.00 H new ATOM 0 HG3 MET A 159 -5.230 3.577 -11.264 1.00 0.00 H new ATOM 0 HE1 MET A 159 -5.530 6.231 -8.154 1.00 0.00 H new ATOM 0 HE2 MET A 159 -4.126 6.156 -9.244 1.00 0.00 H new ATOM 0 HE3 MET A 159 -5.775 6.071 -9.909 1.00 0.00 H new ATOM 83 N GLU A 160 -0.937 3.355 -10.949 1.00 0.00 N ATOM 84 CA GLU A 160 0.379 3.668 -10.407 1.00 0.00 C ATOM 85 C GLU A 160 0.249 4.587 -9.197 1.00 0.00 C ATOM 86 O GLU A 160 -0.461 5.592 -9.239 1.00 0.00 O ATOM 87 CB GLU A 160 1.256 4.330 -11.472 1.00 0.00 C ATOM 88 CG GLU A 160 1.470 3.466 -12.705 1.00 0.00 C ATOM 89 CD GLU A 160 2.811 3.717 -13.366 1.00 0.00 C ATOM 90 OE1 GLU A 160 3.838 3.270 -12.814 1.00 0.00 O ATOM 91 OE2 GLU A 160 2.834 4.359 -14.438 1.00 0.00 O ATOM 0 H GLU A 160 -1.471 4.169 -11.253 1.00 0.00 H new ATOM 0 HA GLU A 160 0.851 2.736 -10.095 1.00 0.00 H new ATOM 0 HB2 GLU A 160 0.799 5.272 -11.773 1.00 0.00 H new ATOM 0 HB3 GLU A 160 2.225 4.571 -11.035 1.00 0.00 H new ATOM 0 HG2 GLU A 160 1.398 2.415 -12.425 1.00 0.00 H new ATOM 0 HG3 GLU A 160 0.673 3.660 -13.423 1.00 0.00 H new ATOM 98 N ILE A 161 0.932 4.227 -8.120 1.00 0.00 N ATOM 99 CA ILE A 161 0.896 5.005 -6.889 1.00 0.00 C ATOM 100 C ILE A 161 2.286 5.475 -6.508 1.00 0.00 C ATOM 101 O ILE A 161 3.224 4.705 -6.555 1.00 0.00 O ATOM 102 CB ILE A 161 0.293 4.171 -5.737 1.00 0.00 C ATOM 103 CG1 ILE A 161 -1.057 3.586 -6.162 1.00 0.00 C ATOM 104 CG2 ILE A 161 0.146 5.006 -4.470 1.00 0.00 C ATOM 105 CD1 ILE A 161 -2.120 4.634 -6.407 1.00 0.00 C ATOM 0 H ILE A 161 1.521 3.396 -8.074 1.00 0.00 H new ATOM 0 HA ILE A 161 0.266 5.878 -7.063 1.00 0.00 H new ATOM 0 HB ILE A 161 0.976 3.351 -5.514 1.00 0.00 H new ATOM 0 HG12 ILE A 161 -0.920 3.000 -7.071 1.00 0.00 H new ATOM 0 HG13 ILE A 161 -1.406 2.900 -5.390 1.00 0.00 H new ATOM 0 HG21 ILE A 161 -0.281 4.392 -3.677 1.00 0.00 H new ATOM 0 HG22 ILE A 161 1.125 5.371 -4.159 1.00 0.00 H new ATOM 0 HG23 ILE A 161 -0.511 5.853 -4.667 1.00 0.00 H new ATOM 0 HD11 ILE A 161 -3.049 4.147 -6.704 1.00 0.00 H new ATOM 0 HD12 ILE A 161 -2.286 5.205 -5.493 1.00 0.00 H new ATOM 0 HD13 ILE A 161 -1.792 5.306 -7.200 1.00 0.00 H new ATOM 117 N LYS A 162 2.413 6.749 -6.147 1.00 0.00 N ATOM 118 CA LYS A 162 3.708 7.310 -5.767 1.00 0.00 C ATOM 119 C LYS A 162 3.670 7.888 -4.353 1.00 0.00 C ATOM 120 O LYS A 162 2.793 8.688 -4.028 1.00 0.00 O ATOM 121 CB LYS A 162 4.124 8.397 -6.762 1.00 0.00 C ATOM 122 CG LYS A 162 5.547 8.894 -6.565 1.00 0.00 C ATOM 123 CD LYS A 162 5.981 9.811 -7.699 1.00 0.00 C ATOM 124 CE LYS A 162 5.780 11.274 -7.337 1.00 0.00 C ATOM 125 NZ LYS A 162 6.267 12.184 -8.411 1.00 0.00 N ATOM 0 H LYS A 162 1.638 7.411 -6.109 1.00 0.00 H new ATOM 0 HA LYS A 162 4.440 6.503 -5.785 1.00 0.00 H new ATOM 0 HB2 LYS A 162 4.021 8.008 -7.775 1.00 0.00 H new ATOM 0 HB3 LYS A 162 3.439 9.240 -6.673 1.00 0.00 H new ATOM 0 HG2 LYS A 162 5.619 9.427 -5.617 1.00 0.00 H new ATOM 0 HG3 LYS A 162 6.225 8.043 -6.504 1.00 0.00 H new ATOM 0 HD2 LYS A 162 7.031 9.633 -7.931 1.00 0.00 H new ATOM 0 HD3 LYS A 162 5.411 9.575 -8.598 1.00 0.00 H new ATOM 0 HE2 LYS A 162 4.722 11.461 -7.155 1.00 0.00 H new ATOM 0 HE3 LYS A 162 6.307 11.494 -6.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 6.112 13.172 -8.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 7.283 12.024 -8.567 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 5.747 11.992 -9.291 1.00 0.00 H new ATOM 139 N LEU A 163 4.633 7.496 -3.517 1.00 0.00 N ATOM 140 CA LEU A 163 4.700 8.002 -2.148 1.00 0.00 C ATOM 141 C LEU A 163 6.080 8.565 -1.858 1.00 0.00 C ATOM 142 O LEU A 163 7.086 8.002 -2.282 1.00 0.00 O ATOM 143 CB LEU A 163 4.385 6.902 -1.130 1.00 0.00 C ATOM 144 CG LEU A 163 3.377 5.849 -1.586 1.00 0.00 C ATOM 145 CD1 LEU A 163 3.082 4.878 -0.452 1.00 0.00 C ATOM 146 CD2 LEU A 163 2.097 6.508 -2.082 1.00 0.00 C ATOM 0 H LEU A 163 5.371 6.836 -3.762 1.00 0.00 H new ATOM 0 HA LEU A 163 3.953 8.790 -2.056 1.00 0.00 H new ATOM 0 HB2 LEU A 163 5.315 6.398 -0.867 1.00 0.00 H new ATOM 0 HB3 LEU A 163 4.008 7.370 -0.221 1.00 0.00 H new ATOM 0 HG LEU A 163 3.810 5.290 -2.416 1.00 0.00 H new ATOM 0 HD11 LEU A 163 2.362 4.132 -0.789 1.00 0.00 H new ATOM 0 HD12 LEU A 163 4.004 4.381 -0.149 1.00 0.00 H new ATOM 0 HD13 LEU A 163 2.668 5.424 0.396 1.00 0.00 H new ATOM 0 HD21 LEU A 163 1.393 5.740 -2.402 1.00 0.00 H new ATOM 0 HD22 LEU A 163 1.654 7.094 -1.277 1.00 0.00 H new ATOM 0 HD23 LEU A 163 2.327 7.162 -2.923 1.00 0.00 H new ATOM 158 N ILE A 164 6.133 9.668 -1.123 1.00 0.00 N ATOM 159 CA ILE A 164 7.409 10.279 -0.779 1.00 0.00 C ATOM 160 C ILE A 164 7.740 10.040 0.696 1.00 0.00 C ATOM 161 O ILE A 164 6.901 10.233 1.575 1.00 0.00 O ATOM 162 CB ILE A 164 7.434 11.796 -1.135 1.00 0.00 C ATOM 163 CG1 ILE A 164 8.827 12.192 -1.624 1.00 0.00 C ATOM 164 CG2 ILE A 164 7.013 12.682 0.039 1.00 0.00 C ATOM 165 CD1 ILE A 164 9.890 12.080 -0.557 1.00 0.00 C ATOM 0 H ILE A 164 5.315 10.154 -0.756 1.00 0.00 H new ATOM 0 HA ILE A 164 8.183 9.801 -1.379 1.00 0.00 H new ATOM 0 HB ILE A 164 6.705 11.955 -1.930 1.00 0.00 H new ATOM 0 HG12 ILE A 164 9.101 11.559 -2.468 1.00 0.00 H new ATOM 0 HG13 ILE A 164 8.797 13.218 -1.991 1.00 0.00 H new ATOM 0 HG21 ILE A 164 7.048 13.728 -0.264 1.00 0.00 H new ATOM 0 HG22 ILE A 164 5.998 12.426 0.342 1.00 0.00 H new ATOM 0 HG23 ILE A 164 7.693 12.524 0.876 1.00 0.00 H new ATOM 0 HD11 ILE A 164 10.854 12.376 -0.971 1.00 0.00 H new ATOM 0 HD12 ILE A 164 9.638 12.734 0.278 1.00 0.00 H new ATOM 0 HD13 ILE A 164 9.947 11.049 -0.207 1.00 0.00 H new ATOM 177 N LYS A 165 8.964 9.616 0.944 1.00 0.00 N ATOM 178 CA LYS A 165 9.424 9.337 2.295 1.00 0.00 C ATOM 179 C LYS A 165 9.653 10.632 3.068 1.00 0.00 C ATOM 180 O LYS A 165 10.777 11.122 3.168 1.00 0.00 O ATOM 181 CB LYS A 165 10.709 8.507 2.246 1.00 0.00 C ATOM 182 CG LYS A 165 10.585 7.150 2.921 1.00 0.00 C ATOM 183 CD LYS A 165 10.177 7.280 4.379 1.00 0.00 C ATOM 184 CE LYS A 165 11.100 8.221 5.141 1.00 0.00 C ATOM 185 NZ LYS A 165 11.382 7.741 6.524 1.00 0.00 N ATOM 0 H LYS A 165 9.666 9.455 0.221 1.00 0.00 H new ATOM 0 HA LYS A 165 8.654 8.767 2.815 1.00 0.00 H new ATOM 0 HB2 LYS A 165 10.997 8.360 1.205 1.00 0.00 H new ATOM 0 HB3 LYS A 165 11.512 9.068 2.723 1.00 0.00 H new ATOM 0 HG2 LYS A 165 9.849 6.546 2.390 1.00 0.00 H new ATOM 0 HG3 LYS A 165 11.537 6.623 2.856 1.00 0.00 H new ATOM 0 HD2 LYS A 165 9.153 7.648 4.439 1.00 0.00 H new ATOM 0 HD3 LYS A 165 10.191 6.297 4.850 1.00 0.00 H new ATOM 0 HE2 LYS A 165 12.039 8.325 4.597 1.00 0.00 H new ATOM 0 HE3 LYS A 165 10.647 9.211 5.188 1.00 0.00 H new ATOM 0 HZ1 LYS A 165 12.347 8.017 6.797 1.00 0.00 H new ATOM 0 HZ2 LYS A 165 10.700 8.165 7.185 1.00 0.00 H new ATOM 0 HZ3 LYS A 165 11.297 6.705 6.556 1.00 0.00 H new ATOM 199 N GLY A 166 8.575 11.176 3.613 1.00 0.00 N ATOM 200 CA GLY A 166 8.673 12.405 4.374 1.00 0.00 C ATOM 201 C GLY A 166 9.139 12.161 5.798 1.00 0.00 C ATOM 202 O GLY A 166 9.600 11.065 6.118 1.00 0.00 O ATOM 0 H GLY A 166 7.634 10.789 3.542 1.00 0.00 H new ATOM 0 HA2 GLY A 166 9.367 13.084 3.878 1.00 0.00 H new ATOM 0 HA3 GLY A 166 7.701 12.899 4.391 1.00 0.00 H new ATOM 206 N PRO A 167 9.030 13.165 6.688 1.00 0.00 N ATOM 207 CA PRO A 167 9.450 13.019 8.086 1.00 0.00 C ATOM 208 C PRO A 167 8.618 11.981 8.839 1.00 0.00 C ATOM 209 O PRO A 167 9.042 11.470 9.875 1.00 0.00 O ATOM 210 CB PRO A 167 9.231 14.415 8.680 1.00 0.00 C ATOM 211 CG PRO A 167 8.230 15.062 7.787 1.00 0.00 C ATOM 212 CD PRO A 167 8.490 14.511 6.414 1.00 0.00 C ATOM 0 HA PRO A 167 10.479 12.669 8.163 1.00 0.00 H new ATOM 0 HB2 PRO A 167 8.865 14.355 9.705 1.00 0.00 H new ATOM 0 HB3 PRO A 167 10.161 14.983 8.707 1.00 0.00 H new ATOM 0 HG2 PRO A 167 7.214 14.839 8.112 1.00 0.00 H new ATOM 0 HG3 PRO A 167 8.338 16.147 7.800 1.00 0.00 H new ATOM 0 HD2 PRO A 167 7.578 14.466 5.819 1.00 0.00 H new ATOM 0 HD3 PRO A 167 9.201 15.125 5.861 1.00 0.00 H new ATOM 220 N LYS A 168 7.428 11.680 8.320 1.00 0.00 N ATOM 221 CA LYS A 168 6.540 10.712 8.957 1.00 0.00 C ATOM 222 C LYS A 168 6.659 9.313 8.342 1.00 0.00 C ATOM 223 O LYS A 168 5.996 8.382 8.802 1.00 0.00 O ATOM 224 CB LYS A 168 5.089 11.193 8.863 1.00 0.00 C ATOM 225 CG LYS A 168 4.684 12.140 9.984 1.00 0.00 C ATOM 226 CD LYS A 168 3.854 11.431 11.045 1.00 0.00 C ATOM 227 CE LYS A 168 3.500 12.361 12.193 1.00 0.00 C ATOM 228 NZ LYS A 168 2.724 11.663 13.256 1.00 0.00 N ATOM 0 H LYS A 168 7.059 12.092 7.463 1.00 0.00 H new ATOM 0 HA LYS A 168 6.844 10.637 10.001 1.00 0.00 H new ATOM 0 HB2 LYS A 168 4.943 11.694 7.906 1.00 0.00 H new ATOM 0 HB3 LYS A 168 4.427 10.327 8.874 1.00 0.00 H new ATOM 0 HG2 LYS A 168 5.577 12.564 10.443 1.00 0.00 H new ATOM 0 HG3 LYS A 168 4.113 12.971 9.570 1.00 0.00 H new ATOM 0 HD2 LYS A 168 2.940 11.044 10.594 1.00 0.00 H new ATOM 0 HD3 LYS A 168 4.408 10.574 11.428 1.00 0.00 H new ATOM 0 HE2 LYS A 168 4.414 12.772 12.622 1.00 0.00 H new ATOM 0 HE3 LYS A 168 2.920 13.202 11.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 168 2.503 12.332 14.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 168 1.840 11.292 12.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 168 3.287 10.876 13.637 1.00 0.00 H new ATOM 242 N GLY A 169 7.492 9.154 7.308 1.00 0.00 N ATOM 243 CA GLY A 169 7.643 7.853 6.686 1.00 0.00 C ATOM 244 C GLY A 169 6.898 7.751 5.370 1.00 0.00 C ATOM 245 O GLY A 169 6.754 8.743 4.654 1.00 0.00 O ATOM 0 H GLY A 169 8.057 9.898 6.898 1.00 0.00 H new ATOM 0 HA2 GLY A 169 8.701 7.655 6.517 1.00 0.00 H new ATOM 0 HA3 GLY A 169 7.279 7.083 7.367 1.00 0.00 H new ATOM 249 N LEU A 170 6.430 6.551 5.044 1.00 0.00 N ATOM 250 CA LEU A 170 5.704 6.327 3.800 1.00 0.00 C ATOM 251 C LEU A 170 4.459 7.207 3.727 1.00 0.00 C ATOM 252 O LEU A 170 4.105 7.714 2.662 1.00 0.00 O ATOM 253 CB LEU A 170 5.306 4.855 3.673 1.00 0.00 C ATOM 254 CG LEU A 170 6.364 3.948 3.045 1.00 0.00 C ATOM 255 CD1 LEU A 170 6.584 4.321 1.586 1.00 0.00 C ATOM 256 CD2 LEU A 170 7.669 4.034 3.822 1.00 0.00 C ATOM 0 H LEU A 170 6.541 5.719 5.624 1.00 0.00 H new ATOM 0 HA LEU A 170 6.364 6.592 2.974 1.00 0.00 H new ATOM 0 HB2 LEU A 170 5.065 4.473 4.665 1.00 0.00 H new ATOM 0 HB3 LEU A 170 4.395 4.791 3.077 1.00 0.00 H new ATOM 0 HG LEU A 170 6.007 2.919 3.088 1.00 0.00 H new ATOM 0 HD11 LEU A 170 7.340 3.666 1.153 1.00 0.00 H new ATOM 0 HD12 LEU A 170 5.649 4.209 1.037 1.00 0.00 H new ATOM 0 HD13 LEU A 170 6.920 5.356 1.522 1.00 0.00 H new ATOM 0 HD21 LEU A 170 8.411 3.382 3.361 1.00 0.00 H new ATOM 0 HD22 LEU A 170 8.032 5.062 3.811 1.00 0.00 H new ATOM 0 HD23 LEU A 170 7.500 3.720 4.852 1.00 0.00 H new ATOM 268 N GLY A 171 3.803 7.389 4.868 1.00 0.00 N ATOM 269 CA GLY A 171 2.609 8.212 4.915 1.00 0.00 C ATOM 270 C GLY A 171 1.324 7.403 4.912 1.00 0.00 C ATOM 271 O GLY A 171 0.256 7.933 4.606 1.00 0.00 O ATOM 0 H GLY A 171 4.077 6.981 5.762 1.00 0.00 H new ATOM 0 HA2 GLY A 171 2.638 8.832 5.811 1.00 0.00 H new ATOM 0 HA3 GLY A 171 2.607 8.888 4.060 1.00 0.00 H new ATOM 275 N PHE A 172 1.417 6.123 5.262 1.00 0.00 N ATOM 276 CA PHE A 172 0.243 5.259 5.304 1.00 0.00 C ATOM 277 C PHE A 172 0.580 3.916 5.953 1.00 0.00 C ATOM 278 O PHE A 172 1.657 3.742 6.520 1.00 0.00 O ATOM 279 CB PHE A 172 -0.335 5.065 3.890 1.00 0.00 C ATOM 280 CG PHE A 172 0.395 4.059 3.039 1.00 0.00 C ATOM 281 CD1 PHE A 172 1.745 4.204 2.765 1.00 0.00 C ATOM 282 CD2 PHE A 172 -0.278 2.966 2.517 1.00 0.00 C ATOM 283 CE1 PHE A 172 2.409 3.277 1.984 1.00 0.00 C ATOM 284 CE2 PHE A 172 0.380 2.037 1.737 1.00 0.00 C ATOM 285 CZ PHE A 172 1.726 2.192 1.469 1.00 0.00 C ATOM 0 H PHE A 172 2.290 5.663 5.520 1.00 0.00 H new ATOM 0 HA PHE A 172 -0.519 5.741 5.916 1.00 0.00 H new ATOM 0 HB2 PHE A 172 -1.377 4.757 3.978 1.00 0.00 H new ATOM 0 HB3 PHE A 172 -0.329 6.026 3.376 1.00 0.00 H new ATOM 0 HD1 PHE A 172 2.284 5.050 3.166 1.00 0.00 H new ATOM 0 HD2 PHE A 172 -1.331 2.840 2.723 1.00 0.00 H new ATOM 0 HE1 PHE A 172 3.462 3.401 1.776 1.00 0.00 H new ATOM 0 HE2 PHE A 172 -0.157 1.190 1.337 1.00 0.00 H new ATOM 0 HZ PHE A 172 2.243 1.467 0.858 1.00 0.00 H new ATOM 295 N SER A 173 -0.350 2.972 5.864 1.00 0.00 N ATOM 296 CA SER A 173 -0.153 1.650 6.440 1.00 0.00 C ATOM 297 C SER A 173 -0.580 0.560 5.465 1.00 0.00 C ATOM 298 O SER A 173 -1.319 0.815 4.514 1.00 0.00 O ATOM 299 CB SER A 173 -0.934 1.517 7.750 1.00 0.00 C ATOM 300 OG SER A 173 -0.113 1.816 8.866 1.00 0.00 O ATOM 0 H SER A 173 -1.248 3.099 5.398 1.00 0.00 H new ATOM 0 HA SER A 173 0.910 1.528 6.647 1.00 0.00 H new ATOM 0 HB2 SER A 173 -1.792 2.189 7.735 1.00 0.00 H new ATOM 0 HB3 SER A 173 -1.324 0.504 7.843 1.00 0.00 H new ATOM 0 HG SER A 173 -0.636 1.725 9.690 1.00 0.00 H new ATOM 306 N ILE A 174 -0.111 -0.657 5.714 1.00 0.00 N ATOM 307 CA ILE A 174 -0.443 -1.792 4.868 1.00 0.00 C ATOM 308 C ILE A 174 -1.121 -2.890 5.678 1.00 0.00 C ATOM 309 O ILE A 174 -0.991 -2.947 6.900 1.00 0.00 O ATOM 310 CB ILE A 174 0.815 -2.376 4.178 1.00 0.00 C ATOM 311 CG1 ILE A 174 1.809 -2.926 5.215 1.00 0.00 C ATOM 312 CG2 ILE A 174 1.479 -1.320 3.303 1.00 0.00 C ATOM 313 CD1 ILE A 174 2.084 -4.411 5.064 1.00 0.00 C ATOM 0 H ILE A 174 0.502 -0.881 6.498 1.00 0.00 H new ATOM 0 HA ILE A 174 -1.127 -1.428 4.101 1.00 0.00 H new ATOM 0 HB ILE A 174 0.501 -3.205 3.544 1.00 0.00 H new ATOM 0 HG12 ILE A 174 2.749 -2.380 5.130 1.00 0.00 H new ATOM 0 HG13 ILE A 174 1.420 -2.737 6.215 1.00 0.00 H new ATOM 0 HG21 ILE A 174 2.361 -1.746 2.825 1.00 0.00 H new ATOM 0 HG22 ILE A 174 0.777 -0.987 2.538 1.00 0.00 H new ATOM 0 HG23 ILE A 174 1.774 -0.470 3.919 1.00 0.00 H new ATOM 0 HD11 ILE A 174 2.793 -4.729 5.828 1.00 0.00 H new ATOM 0 HD12 ILE A 174 1.153 -4.967 5.179 1.00 0.00 H new ATOM 0 HD13 ILE A 174 2.503 -4.605 4.077 1.00 0.00 H new ATOM 325 N ALA A 175 -1.834 -3.764 4.987 1.00 0.00 N ATOM 326 CA ALA A 175 -2.520 -4.872 5.632 1.00 0.00 C ATOM 327 C ALA A 175 -2.173 -6.167 4.918 1.00 0.00 C ATOM 328 O ALA A 175 -2.118 -6.204 3.692 1.00 0.00 O ATOM 329 CB ALA A 175 -4.020 -4.630 5.630 1.00 0.00 C ATOM 0 H ALA A 175 -1.953 -3.727 3.975 1.00 0.00 H new ATOM 0 HA ALA A 175 -2.195 -4.950 6.669 1.00 0.00 H new ATOM 0 HB1 ALA A 175 -4.524 -5.466 6.115 1.00 0.00 H new ATOM 0 HB2 ALA A 175 -4.241 -3.710 6.171 1.00 0.00 H new ATOM 0 HB3 ALA A 175 -4.373 -4.541 4.603 1.00 0.00 H new ATOM 335 N GLY A 176 -1.922 -7.225 5.681 1.00 0.00 N ATOM 336 CA GLY A 176 -1.548 -8.487 5.071 1.00 0.00 C ATOM 337 C GLY A 176 -2.607 -9.548 5.156 1.00 0.00 C ATOM 338 O GLY A 176 -3.153 -9.826 6.223 1.00 0.00 O ATOM 0 H GLY A 176 -1.970 -7.233 6.700 1.00 0.00 H new ATOM 0 HA2 GLY A 176 -1.306 -8.314 4.022 1.00 0.00 H new ATOM 0 HA3 GLY A 176 -0.641 -8.855 5.551 1.00 0.00 H new ATOM 342 N GLY A 177 -2.889 -10.147 4.013 1.00 0.00 N ATOM 343 CA GLY A 177 -3.880 -11.190 3.950 1.00 0.00 C ATOM 344 C GLY A 177 -3.352 -12.553 4.379 1.00 0.00 C ATOM 345 O GLY A 177 -4.126 -13.431 4.755 1.00 0.00 O ATOM 0 H GLY A 177 -2.444 -9.926 3.122 1.00 0.00 H new ATOM 0 HA2 GLY A 177 -4.723 -10.919 4.585 1.00 0.00 H new ATOM 0 HA3 GLY A 177 -4.259 -11.260 2.930 1.00 0.00 H new ATOM 349 N VAL A 178 -2.037 -12.741 4.304 1.00 0.00 N ATOM 350 CA VAL A 178 -1.432 -14.022 4.671 1.00 0.00 C ATOM 351 C VAL A 178 -1.051 -14.093 6.152 1.00 0.00 C ATOM 352 O VAL A 178 -0.185 -13.355 6.621 1.00 0.00 O ATOM 353 CB VAL A 178 -0.176 -14.311 3.826 1.00 0.00 C ATOM 354 CG1 VAL A 178 0.295 -15.741 4.041 1.00 0.00 C ATOM 355 CG2 VAL A 178 -0.446 -14.046 2.351 1.00 0.00 C ATOM 0 H VAL A 178 -1.373 -12.031 3.995 1.00 0.00 H new ATOM 0 HA VAL A 178 -2.195 -14.775 4.473 1.00 0.00 H new ATOM 0 HB VAL A 178 0.618 -13.638 4.150 1.00 0.00 H new ATOM 0 HG11 VAL A 178 1.183 -15.927 3.436 1.00 0.00 H new ATOM 0 HG12 VAL A 178 0.535 -15.891 5.094 1.00 0.00 H new ATOM 0 HG13 VAL A 178 -0.495 -16.432 3.747 1.00 0.00 H new ATOM 0 HG21 VAL A 178 0.454 -14.256 1.773 1.00 0.00 H new ATOM 0 HG22 VAL A 178 -1.256 -14.689 2.008 1.00 0.00 H new ATOM 0 HG23 VAL A 178 -0.729 -13.002 2.215 1.00 0.00 H new ATOM 365 N GLY A 179 -1.694 -15.010 6.873 1.00 0.00 N ATOM 366 CA GLY A 179 -1.412 -15.205 8.287 1.00 0.00 C ATOM 367 C GLY A 179 -2.152 -14.231 9.177 1.00 0.00 C ATOM 368 O GLY A 179 -2.890 -14.631 10.077 1.00 0.00 O ATOM 0 H GLY A 179 -2.413 -15.628 6.498 1.00 0.00 H new ATOM 0 HA2 GLY A 179 -1.682 -16.223 8.569 1.00 0.00 H new ATOM 0 HA3 GLY A 179 -0.340 -15.101 8.456 1.00 0.00 H new ATOM 372 N ASN A 180 -1.957 -12.951 8.916 1.00 0.00 N ATOM 373 CA ASN A 180 -2.610 -11.898 9.687 1.00 0.00 C ATOM 374 C ASN A 180 -3.649 -11.208 8.817 1.00 0.00 C ATOM 375 O ASN A 180 -3.646 -9.986 8.660 1.00 0.00 O ATOM 376 CB ASN A 180 -1.578 -10.889 10.199 1.00 0.00 C ATOM 377 CG ASN A 180 -1.150 -11.175 11.625 1.00 0.00 C ATOM 378 OD1 ASN A 180 -1.595 -10.513 12.562 1.00 0.00 O ATOM 379 ND2 ASN A 180 -0.282 -12.165 11.795 1.00 0.00 N ATOM 0 H ASN A 180 -1.348 -12.610 8.172 1.00 0.00 H new ATOM 0 HA ASN A 180 -3.105 -12.340 10.552 1.00 0.00 H new ATOM 0 HB2 ASN A 180 -0.703 -10.907 9.549 1.00 0.00 H new ATOM 0 HB3 ASN A 180 -1.997 -9.884 10.143 1.00 0.00 H new ATOM 0 HD21 ASN A 180 0.043 -12.403 12.732 1.00 0.00 H new ATOM 0 HD22 ASN A 180 0.060 -12.687 10.988 1.00 0.00 H new ATOM 386 N GLN A 181 -4.516 -12.016 8.225 1.00 0.00 N ATOM 387 CA GLN A 181 -5.548 -11.533 7.331 1.00 0.00 C ATOM 388 C GLN A 181 -6.305 -10.325 7.864 1.00 0.00 C ATOM 389 O GLN A 181 -7.052 -10.413 8.839 1.00 0.00 O ATOM 390 CB GLN A 181 -6.527 -12.659 7.015 1.00 0.00 C ATOM 391 CG GLN A 181 -7.021 -12.625 5.586 1.00 0.00 C ATOM 392 CD GLN A 181 -7.852 -13.837 5.217 1.00 0.00 C ATOM 393 OE1 GLN A 181 -8.684 -14.299 5.999 1.00 0.00 O ATOM 394 NE2 GLN A 181 -7.630 -14.360 4.016 1.00 0.00 N ATOM 0 H GLN A 181 -4.520 -13.028 8.354 1.00 0.00 H new ATOM 0 HA GLN A 181 -5.040 -11.202 6.425 1.00 0.00 H new ATOM 0 HB2 GLN A 181 -6.044 -13.618 7.204 1.00 0.00 H new ATOM 0 HB3 GLN A 181 -7.380 -12.593 7.691 1.00 0.00 H new ATOM 0 HG2 GLN A 181 -7.616 -11.724 5.434 1.00 0.00 H new ATOM 0 HG3 GLN A 181 -6.166 -12.559 4.913 1.00 0.00 H new ATOM 0 HE21 GLN A 181 -6.931 -13.945 3.400 1.00 0.00 H new ATOM 0 HE22 GLN A 181 -8.159 -15.177 3.710 1.00 0.00 H new ATOM 403 N HIS A 182 -6.130 -9.211 7.168 1.00 0.00 N ATOM 404 CA HIS A 182 -6.810 -7.970 7.496 1.00 0.00 C ATOM 405 C HIS A 182 -7.964 -7.754 6.509 1.00 0.00 C ATOM 406 O HIS A 182 -8.938 -7.066 6.820 1.00 0.00 O ATOM 407 CB HIS A 182 -5.814 -6.793 7.450 1.00 0.00 C ATOM 408 CG HIS A 182 -6.443 -5.438 7.261 1.00 0.00 C ATOM 409 ND1 HIS A 182 -6.954 -4.862 6.139 1.00 0.00 N flip ATOM 410 CD2 HIS A 182 -6.612 -4.518 8.272 1.00 0.00 C flip ATOM 411 CE1 HIS A 182 -7.436 -3.596 6.457 1.00 0.00 C flip ATOM 412 NE2 HIS A 182 -7.208 -3.438 7.748 1.00 0.00 N flip ATOM 0 H HIS A 182 -5.512 -9.144 6.360 1.00 0.00 H new ATOM 0 HA HIS A 182 -7.216 -8.026 8.506 1.00 0.00 H new ATOM 0 HB2 HIS A 182 -5.240 -6.785 8.377 1.00 0.00 H new ATOM 0 HB3 HIS A 182 -5.107 -6.966 6.639 1.00 0.00 H new ATOM 0 HD1 HIS A 182 -6.980 -5.290 5.213 1.00 0.00 H new ATOM 0 HD2 HIS A 182 -6.317 -4.644 9.303 1.00 0.00 H new ATOM 0 HE1 HIS A 182 -7.901 -2.889 5.786 1.00 0.00 H new ATOM 420 N ILE A 183 -7.841 -8.338 5.316 1.00 0.00 N ATOM 421 CA ILE A 183 -8.863 -8.199 4.288 1.00 0.00 C ATOM 422 C ILE A 183 -9.825 -9.390 4.334 1.00 0.00 C ATOM 423 O ILE A 183 -9.388 -10.538 4.401 1.00 0.00 O ATOM 424 CB ILE A 183 -8.241 -8.113 2.873 1.00 0.00 C ATOM 425 CG1 ILE A 183 -6.871 -7.409 2.905 1.00 0.00 C ATOM 426 CG2 ILE A 183 -9.189 -7.392 1.925 1.00 0.00 C ATOM 427 CD1 ILE A 183 -5.702 -8.361 2.765 1.00 0.00 C ATOM 0 H ILE A 183 -7.043 -8.911 5.042 1.00 0.00 H new ATOM 0 HA ILE A 183 -9.402 -7.273 4.490 1.00 0.00 H new ATOM 0 HB ILE A 183 -8.084 -9.129 2.511 1.00 0.00 H new ATOM 0 HG12 ILE A 183 -6.830 -6.674 2.101 1.00 0.00 H new ATOM 0 HG13 ILE A 183 -6.774 -6.862 3.843 1.00 0.00 H new ATOM 0 HG21 ILE A 183 -8.740 -7.338 0.933 1.00 0.00 H new ATOM 0 HG22 ILE A 183 -10.131 -7.937 1.868 1.00 0.00 H new ATOM 0 HG23 ILE A 183 -9.376 -6.384 2.294 1.00 0.00 H new ATOM 0 HD11 ILE A 183 -4.769 -7.798 2.796 1.00 0.00 H new ATOM 0 HD12 ILE A 183 -5.719 -9.081 3.583 1.00 0.00 H new ATOM 0 HD13 ILE A 183 -5.775 -8.890 1.815 1.00 0.00 H new ATOM 439 N PRO A 184 -11.154 -9.144 4.312 1.00 0.00 N ATOM 440 CA PRO A 184 -12.148 -10.221 4.367 1.00 0.00 C ATOM 441 C PRO A 184 -12.209 -11.036 3.080 1.00 0.00 C ATOM 442 O PRO A 184 -13.095 -10.837 2.248 1.00 0.00 O ATOM 443 CB PRO A 184 -13.465 -9.478 4.597 1.00 0.00 C ATOM 444 CG PRO A 184 -13.242 -8.134 4.001 1.00 0.00 C ATOM 445 CD PRO A 184 -11.793 -7.813 4.246 1.00 0.00 C ATOM 0 HA PRO A 184 -11.911 -10.949 5.143 1.00 0.00 H new ATOM 0 HB2 PRO A 184 -14.299 -9.991 4.119 1.00 0.00 H new ATOM 0 HB3 PRO A 184 -13.701 -9.407 5.659 1.00 0.00 H new ATOM 0 HG2 PRO A 184 -13.467 -8.137 2.934 1.00 0.00 H new ATOM 0 HG3 PRO A 184 -13.891 -7.389 4.462 1.00 0.00 H new ATOM 0 HD2 PRO A 184 -11.375 -7.206 3.443 1.00 0.00 H new ATOM 0 HD3 PRO A 184 -11.656 -7.255 5.172 1.00 0.00 H new ATOM 453 N GLY A 185 -11.267 -11.961 2.929 1.00 0.00 N ATOM 454 CA GLY A 185 -11.235 -12.803 1.747 1.00 0.00 C ATOM 455 C GLY A 185 -10.165 -12.389 0.754 1.00 0.00 C ATOM 456 O GLY A 185 -10.460 -12.148 -0.417 1.00 0.00 O ATOM 0 H GLY A 185 -10.525 -12.143 3.604 1.00 0.00 H new ATOM 0 HA2 GLY A 185 -11.063 -13.836 2.048 1.00 0.00 H new ATOM 0 HA3 GLY A 185 -12.209 -12.771 1.258 1.00 0.00 H new ATOM 460 N ASP A 186 -8.922 -12.314 1.217 1.00 0.00 N ATOM 461 CA ASP A 186 -7.807 -11.933 0.356 1.00 0.00 C ATOM 462 C ASP A 186 -6.472 -12.179 1.052 1.00 0.00 C ATOM 463 O ASP A 186 -6.275 -11.767 2.195 1.00 0.00 O ATOM 464 CB ASP A 186 -7.921 -10.461 -0.047 1.00 0.00 C ATOM 465 CG ASP A 186 -8.685 -10.274 -1.344 1.00 0.00 C ATOM 466 OD1 ASP A 186 -8.168 -10.690 -2.402 1.00 0.00 O ATOM 467 OD2 ASP A 186 -9.798 -9.711 -1.301 1.00 0.00 O ATOM 0 H ASP A 186 -8.661 -12.512 2.183 1.00 0.00 H new ATOM 0 HA ASP A 186 -7.849 -12.551 -0.541 1.00 0.00 H new ATOM 0 HB2 ASP A 186 -8.420 -9.907 0.748 1.00 0.00 H new ATOM 0 HB3 ASP A 186 -6.922 -10.038 -0.153 1.00 0.00 H new ATOM 472 N ASN A 187 -5.559 -12.851 0.356 1.00 0.00 N ATOM 473 CA ASN A 187 -4.242 -13.149 0.912 1.00 0.00 C ATOM 474 C ASN A 187 -3.173 -12.249 0.294 1.00 0.00 C ATOM 475 O ASN A 187 -2.007 -12.633 0.198 1.00 0.00 O ATOM 476 CB ASN A 187 -3.878 -14.621 0.690 1.00 0.00 C ATOM 477 CG ASN A 187 -5.041 -15.560 0.954 1.00 0.00 C ATOM 478 OD1 ASN A 187 -5.928 -15.718 0.116 1.00 0.00 O ATOM 479 ND2 ASN A 187 -5.042 -16.188 2.123 1.00 0.00 N ATOM 0 H ASN A 187 -5.706 -13.199 -0.592 1.00 0.00 H new ATOM 0 HA ASN A 187 -4.283 -12.956 1.984 1.00 0.00 H new ATOM 0 HB2 ASN A 187 -3.534 -14.755 -0.336 1.00 0.00 H new ATOM 0 HB3 ASN A 187 -3.046 -14.887 1.342 1.00 0.00 H new ATOM 0 HD21 ASN A 187 -5.799 -16.831 2.356 1.00 0.00 H new ATOM 0 HD22 ASN A 187 -4.286 -16.027 2.789 1.00 0.00 H new ATOM 486 N SER A 188 -3.577 -11.050 -0.118 1.00 0.00 N ATOM 487 CA SER A 188 -2.653 -10.093 -0.721 1.00 0.00 C ATOM 488 C SER A 188 -2.443 -8.902 0.211 1.00 0.00 C ATOM 489 O SER A 188 -2.753 -8.978 1.399 1.00 0.00 O ATOM 490 CB SER A 188 -3.186 -9.620 -2.076 1.00 0.00 C ATOM 491 OG SER A 188 -2.133 -9.159 -2.905 1.00 0.00 O ATOM 0 H SER A 188 -4.539 -10.718 -0.045 1.00 0.00 H new ATOM 0 HA SER A 188 -1.694 -10.586 -0.878 1.00 0.00 H new ATOM 0 HB2 SER A 188 -3.710 -10.438 -2.570 1.00 0.00 H new ATOM 0 HB3 SER A 188 -3.912 -8.821 -1.926 1.00 0.00 H new ATOM 0 HG SER A 188 -2.499 -8.864 -3.765 1.00 0.00 H new ATOM 497 N ILE A 189 -1.921 -7.800 -0.326 1.00 0.00 N ATOM 498 CA ILE A 189 -1.688 -6.611 0.476 1.00 0.00 C ATOM 499 C ILE A 189 -2.719 -5.532 0.145 1.00 0.00 C ATOM 500 O ILE A 189 -2.978 -5.231 -1.021 1.00 0.00 O ATOM 501 CB ILE A 189 -0.227 -6.087 0.289 1.00 0.00 C ATOM 502 CG1 ILE A 189 0.690 -6.762 1.309 1.00 0.00 C ATOM 503 CG2 ILE A 189 -0.118 -4.567 0.434 1.00 0.00 C ATOM 504 CD1 ILE A 189 0.431 -6.308 2.732 1.00 0.00 C ATOM 0 H ILE A 189 -1.655 -7.711 -1.307 1.00 0.00 H new ATOM 0 HA ILE A 189 -1.806 -6.875 1.527 1.00 0.00 H new ATOM 0 HB ILE A 189 0.077 -6.336 -0.728 1.00 0.00 H new ATOM 0 HG12 ILE A 189 0.558 -7.842 1.249 1.00 0.00 H new ATOM 0 HG13 ILE A 189 1.728 -6.553 1.050 1.00 0.00 H new ATOM 0 HG21 ILE A 189 0.919 -4.262 0.294 1.00 0.00 H new ATOM 0 HG22 ILE A 189 -0.743 -4.084 -0.317 1.00 0.00 H new ATOM 0 HG23 ILE A 189 -0.452 -4.271 1.428 1.00 0.00 H new ATOM 0 HD11 ILE A 189 1.113 -6.823 3.408 1.00 0.00 H new ATOM 0 HD12 ILE A 189 0.591 -5.232 2.805 1.00 0.00 H new ATOM 0 HD13 ILE A 189 -0.597 -6.542 3.007 1.00 0.00 H new ATOM 516 N TYR A 190 -3.280 -4.949 1.191 1.00 0.00 N ATOM 517 CA TYR A 190 -4.262 -3.889 1.048 1.00 0.00 C ATOM 518 C TYR A 190 -3.943 -2.769 2.021 1.00 0.00 C ATOM 519 O TYR A 190 -3.312 -2.996 3.048 1.00 0.00 O ATOM 520 CB TYR A 190 -5.667 -4.424 1.304 1.00 0.00 C ATOM 521 CG TYR A 190 -6.209 -5.263 0.172 1.00 0.00 C ATOM 522 CD1 TYR A 190 -5.659 -6.505 -0.122 1.00 0.00 C ATOM 523 CD2 TYR A 190 -7.275 -4.819 -0.595 1.00 0.00 C ATOM 524 CE1 TYR A 190 -6.158 -7.278 -1.150 1.00 0.00 C ATOM 525 CE2 TYR A 190 -7.780 -5.586 -1.626 1.00 0.00 C ATOM 526 CZ TYR A 190 -7.219 -6.815 -1.900 1.00 0.00 C ATOM 527 OH TYR A 190 -7.719 -7.584 -2.925 1.00 0.00 O ATOM 0 H TYR A 190 -3.069 -5.196 2.158 1.00 0.00 H new ATOM 0 HA TYR A 190 -4.223 -3.504 0.029 1.00 0.00 H new ATOM 0 HB2 TYR A 190 -5.659 -5.021 2.216 1.00 0.00 H new ATOM 0 HB3 TYR A 190 -6.340 -3.585 1.478 1.00 0.00 H new ATOM 0 HD1 TYR A 190 -4.828 -6.871 0.463 1.00 0.00 H new ATOM 0 HD2 TYR A 190 -7.718 -3.857 -0.383 1.00 0.00 H new ATOM 0 HE1 TYR A 190 -5.720 -8.241 -1.367 1.00 0.00 H new ATOM 0 HE2 TYR A 190 -8.610 -5.225 -2.215 1.00 0.00 H new ATOM 0 HH TYR A 190 -8.465 -7.114 -3.352 1.00 0.00 H new ATOM 537 N VAL A 191 -4.371 -1.562 1.699 1.00 0.00 N ATOM 538 CA VAL A 191 -4.111 -0.420 2.560 1.00 0.00 C ATOM 539 C VAL A 191 -5.100 -0.386 3.723 1.00 0.00 C ATOM 540 O VAL A 191 -6.277 -0.707 3.553 1.00 0.00 O ATOM 541 CB VAL A 191 -4.198 0.894 1.763 1.00 0.00 C ATOM 542 CG1 VAL A 191 -3.825 2.080 2.636 1.00 0.00 C ATOM 543 CG2 VAL A 191 -3.306 0.827 0.533 1.00 0.00 C ATOM 0 H VAL A 191 -4.898 -1.346 0.852 1.00 0.00 H new ATOM 0 HA VAL A 191 -3.102 -0.523 2.958 1.00 0.00 H new ATOM 0 HB VAL A 191 -5.228 1.030 1.434 1.00 0.00 H new ATOM 0 HG11 VAL A 191 -3.894 2.998 2.052 1.00 0.00 H new ATOM 0 HG12 VAL A 191 -4.508 2.137 3.483 1.00 0.00 H new ATOM 0 HG13 VAL A 191 -2.805 1.957 3.000 1.00 0.00 H new ATOM 0 HG21 VAL A 191 -3.378 1.763 -0.020 1.00 0.00 H new ATOM 0 HG22 VAL A 191 -2.273 0.666 0.841 1.00 0.00 H new ATOM 0 HG23 VAL A 191 -3.627 0.003 -0.105 1.00 0.00 H new ATOM 553 N THR A 192 -4.619 -0.016 4.909 1.00 0.00 N ATOM 554 CA THR A 192 -5.476 0.027 6.095 1.00 0.00 C ATOM 555 C THR A 192 -5.521 1.414 6.742 1.00 0.00 C ATOM 556 O THR A 192 -6.498 1.753 7.410 1.00 0.00 O ATOM 557 CB THR A 192 -5.007 -1.008 7.120 1.00 0.00 C ATOM 558 OG1 THR A 192 -5.711 -0.862 8.340 1.00 0.00 O ATOM 559 CG2 THR A 192 -3.526 -0.922 7.432 1.00 0.00 C ATOM 0 H THR A 192 -3.650 0.256 5.075 1.00 0.00 H new ATOM 0 HA THR A 192 -6.488 -0.208 5.764 1.00 0.00 H new ATOM 0 HB THR A 192 -5.208 -1.976 6.660 1.00 0.00 H new ATOM 0 HG1 THR A 192 -6.346 -1.601 8.442 1.00 0.00 H new ATOM 0 HG21 THR A 192 -3.264 -1.685 8.165 1.00 0.00 H new ATOM 0 HG22 THR A 192 -2.952 -1.083 6.520 1.00 0.00 H new ATOM 0 HG23 THR A 192 -3.296 0.064 7.836 1.00 0.00 H new ATOM 567 N LYS A 193 -4.473 2.214 6.557 1.00 0.00 N ATOM 568 CA LYS A 193 -4.437 3.549 7.149 1.00 0.00 C ATOM 569 C LYS A 193 -3.661 4.531 6.276 1.00 0.00 C ATOM 570 O LYS A 193 -2.603 4.205 5.748 1.00 0.00 O ATOM 571 CB LYS A 193 -3.814 3.485 8.545 1.00 0.00 C ATOM 572 CG LYS A 193 -4.540 4.336 9.571 1.00 0.00 C ATOM 573 CD LYS A 193 -4.375 5.817 9.277 1.00 0.00 C ATOM 574 CE LYS A 193 -4.466 6.647 10.545 1.00 0.00 C ATOM 575 NZ LYS A 193 -5.836 7.195 10.750 1.00 0.00 N ATOM 0 H LYS A 193 -3.649 1.966 6.010 1.00 0.00 H new ATOM 0 HA LYS A 193 -5.463 3.909 7.224 1.00 0.00 H new ATOM 0 HB2 LYS A 193 -3.806 2.449 8.884 1.00 0.00 H new ATOM 0 HB3 LYS A 193 -2.775 3.809 8.486 1.00 0.00 H new ATOM 0 HG2 LYS A 193 -5.599 4.080 9.575 1.00 0.00 H new ATOM 0 HG3 LYS A 193 -4.155 4.116 10.567 1.00 0.00 H new ATOM 0 HD2 LYS A 193 -3.412 5.989 8.796 1.00 0.00 H new ATOM 0 HD3 LYS A 193 -5.144 6.138 8.574 1.00 0.00 H new ATOM 0 HE2 LYS A 193 -4.188 6.033 11.402 1.00 0.00 H new ATOM 0 HE3 LYS A 193 -3.750 7.467 10.495 1.00 0.00 H new ATOM 0 HZ1 LYS A 193 -5.858 7.756 11.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 193 -6.092 7.801 9.944 1.00 0.00 H new ATOM 0 HZ3 LYS A 193 -6.516 6.411 10.823 1.00 0.00 H new ATOM 589 N ILE A 194 -4.196 5.741 6.136 1.00 0.00 N ATOM 590 CA ILE A 194 -3.555 6.779 5.336 1.00 0.00 C ATOM 591 C ILE A 194 -3.257 8.006 6.191 1.00 0.00 C ATOM 592 O ILE A 194 -4.104 8.449 6.968 1.00 0.00 O ATOM 593 CB ILE A 194 -4.416 7.229 4.131 1.00 0.00 C ATOM 594 CG1 ILE A 194 -5.364 6.118 3.659 1.00 0.00 C ATOM 595 CG2 ILE A 194 -3.519 7.695 2.992 1.00 0.00 C ATOM 596 CD1 ILE A 194 -4.661 4.923 3.053 1.00 0.00 C ATOM 0 H ILE A 194 -5.075 6.027 6.568 1.00 0.00 H new ATOM 0 HA ILE A 194 -2.634 6.337 4.956 1.00 0.00 H new ATOM 0 HB ILE A 194 -5.037 8.063 4.457 1.00 0.00 H new ATOM 0 HG12 ILE A 194 -5.964 5.783 4.505 1.00 0.00 H new ATOM 0 HG13 ILE A 194 -6.054 6.532 2.924 1.00 0.00 H new ATOM 0 HG21 ILE A 194 -4.135 8.009 2.149 1.00 0.00 H new ATOM 0 HG22 ILE A 194 -2.909 8.533 3.329 1.00 0.00 H new ATOM 0 HG23 ILE A 194 -2.870 6.876 2.682 1.00 0.00 H new ATOM 0 HD11 ILE A 194 -5.400 4.184 2.745 1.00 0.00 H new ATOM 0 HD12 ILE A 194 -4.084 5.242 2.185 1.00 0.00 H new ATOM 0 HD13 ILE A 194 -3.992 4.481 3.792 1.00 0.00 H new ATOM 608 N ILE A 195 -2.064 8.562 6.040 1.00 0.00 N ATOM 609 CA ILE A 195 -1.686 9.745 6.798 1.00 0.00 C ATOM 610 C ILE A 195 -2.272 10.986 6.129 1.00 0.00 C ATOM 611 O ILE A 195 -1.917 11.324 4.999 1.00 0.00 O ATOM 612 CB ILE A 195 -0.149 9.876 6.905 1.00 0.00 C ATOM 613 CG1 ILE A 195 0.438 8.621 7.559 1.00 0.00 C ATOM 614 CG2 ILE A 195 0.242 11.123 7.690 1.00 0.00 C ATOM 615 CD1 ILE A 195 0.064 8.461 9.017 1.00 0.00 C ATOM 0 H ILE A 195 -1.346 8.216 5.404 1.00 0.00 H new ATOM 0 HA ILE A 195 -2.084 9.649 7.808 1.00 0.00 H new ATOM 0 HB ILE A 195 0.259 9.975 5.899 1.00 0.00 H new ATOM 0 HG12 ILE A 195 0.100 7.743 7.008 1.00 0.00 H new ATOM 0 HG13 ILE A 195 1.524 8.652 7.473 1.00 0.00 H new ATOM 0 HG21 ILE A 195 1.328 11.190 7.750 1.00 0.00 H new ATOM 0 HG22 ILE A 195 -0.149 12.007 7.187 1.00 0.00 H new ATOM 0 HG23 ILE A 195 -0.174 11.065 8.696 1.00 0.00 H new ATOM 0 HD11 ILE A 195 0.516 7.551 9.411 1.00 0.00 H new ATOM 0 HD12 ILE A 195 0.426 9.320 9.582 1.00 0.00 H new ATOM 0 HD13 ILE A 195 -1.020 8.397 9.110 1.00 0.00 H new ATOM 627 N GLU A 196 -3.199 11.638 6.834 1.00 0.00 N ATOM 628 CA GLU A 196 -3.892 12.833 6.335 1.00 0.00 C ATOM 629 C GLU A 196 -2.965 13.781 5.571 1.00 0.00 C ATOM 630 O GLU A 196 -2.326 14.654 6.160 1.00 0.00 O ATOM 631 CB GLU A 196 -4.554 13.576 7.498 1.00 0.00 C ATOM 632 CG GLU A 196 -5.343 14.804 7.073 1.00 0.00 C ATOM 633 CD GLU A 196 -6.372 14.494 6.005 1.00 0.00 C ATOM 634 OE1 GLU A 196 -6.790 13.322 5.904 1.00 0.00 O ATOM 635 OE2 GLU A 196 -6.760 15.425 5.267 1.00 0.00 O ATOM 0 H GLU A 196 -3.492 11.354 7.769 1.00 0.00 H new ATOM 0 HA GLU A 196 -4.650 12.491 5.630 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -5.221 12.891 8.022 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -3.785 13.878 8.209 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -5.844 15.228 7.943 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -4.655 15.562 6.700 1.00 0.00 H new ATOM 642 N GLY A 197 -2.912 13.601 4.255 1.00 0.00 N ATOM 643 CA GLY A 197 -2.079 14.439 3.414 1.00 0.00 C ATOM 644 C GLY A 197 -0.623 14.450 3.842 1.00 0.00 C ATOM 645 O GLY A 197 0.073 15.450 3.668 1.00 0.00 O ATOM 0 H GLY A 197 -3.436 12.884 3.754 1.00 0.00 H new ATOM 0 HA2 GLY A 197 -2.146 14.090 2.383 1.00 0.00 H new ATOM 0 HA3 GLY A 197 -2.464 15.458 3.431 1.00 0.00 H new ATOM 649 N GLY A 198 -0.162 13.337 4.403 1.00 0.00 N ATOM 650 CA GLY A 198 1.217 13.248 4.845 1.00 0.00 C ATOM 651 C GLY A 198 2.177 12.989 3.700 1.00 0.00 C ATOM 652 O GLY A 198 3.144 13.727 3.512 1.00 0.00 O ATOM 0 H GLY A 198 -0.718 12.496 4.559 1.00 0.00 H new ATOM 0 HA2 GLY A 198 1.495 14.175 5.346 1.00 0.00 H new ATOM 0 HA3 GLY A 198 1.309 12.449 5.580 1.00 0.00 H new ATOM 656 N ALA A 199 1.910 11.937 2.934 1.00 0.00 N ATOM 657 CA ALA A 199 2.758 11.580 1.804 1.00 0.00 C ATOM 658 C ALA A 199 2.034 10.629 0.856 1.00 0.00 C ATOM 659 O ALA A 199 1.875 10.918 -0.329 1.00 0.00 O ATOM 660 CB ALA A 199 4.057 10.958 2.300 1.00 0.00 C ATOM 0 H ALA A 199 1.113 11.317 3.076 1.00 0.00 H new ATOM 0 HA ALA A 199 2.993 12.489 1.250 1.00 0.00 H new ATOM 0 HB1 ALA A 199 4.683 10.695 1.447 1.00 0.00 H new ATOM 0 HB2 ALA A 199 4.585 11.673 2.931 1.00 0.00 H new ATOM 0 HB3 ALA A 199 3.834 10.060 2.877 1.00 0.00 H new ATOM 666 N ALA A 200 1.597 9.492 1.388 1.00 0.00 N ATOM 667 CA ALA A 200 0.891 8.497 0.593 1.00 0.00 C ATOM 668 C ALA A 200 -0.461 9.027 0.126 1.00 0.00 C ATOM 669 O ALA A 200 -0.831 8.868 -1.036 1.00 0.00 O ATOM 670 CB ALA A 200 0.715 7.212 1.392 1.00 0.00 C ATOM 0 H ALA A 200 1.720 9.238 2.368 1.00 0.00 H new ATOM 0 HA ALA A 200 1.490 8.280 -0.292 1.00 0.00 H new ATOM 0 HB1 ALA A 200 0.186 6.476 0.786 1.00 0.00 H new ATOM 0 HB2 ALA A 200 1.693 6.818 1.668 1.00 0.00 H new ATOM 0 HB3 ALA A 200 0.140 7.420 2.294 1.00 0.00 H new ATOM 676 N HIS A 201 -1.199 9.648 1.039 1.00 0.00 N ATOM 677 CA HIS A 201 -2.511 10.189 0.714 1.00 0.00 C ATOM 678 C HIS A 201 -2.429 11.244 -0.391 1.00 0.00 C ATOM 679 O HIS A 201 -3.090 11.125 -1.419 1.00 0.00 O ATOM 680 CB HIS A 201 -3.134 10.808 1.964 1.00 0.00 C ATOM 681 CG HIS A 201 -4.624 10.909 1.908 1.00 0.00 C ATOM 682 ND1 HIS A 201 -5.394 11.400 2.938 1.00 0.00 N ATOM 683 CD2 HIS A 201 -5.489 10.575 0.918 1.00 0.00 C ATOM 684 CE1 HIS A 201 -6.674 11.348 2.552 1.00 0.00 C ATOM 685 NE2 HIS A 201 -6.787 10.856 1.333 1.00 0.00 N ATOM 0 H HIS A 201 -0.911 9.789 2.007 1.00 0.00 H new ATOM 0 HA HIS A 201 -3.131 9.369 0.352 1.00 0.00 H new ATOM 0 HB2 HIS A 201 -2.852 10.213 2.832 1.00 0.00 H new ATOM 0 HB3 HIS A 201 -2.717 11.804 2.111 1.00 0.00 H new ATOM 0 HD2 HIS A 201 -5.214 10.158 -0.039 1.00 0.00 H new ATOM 0 HE1 HIS A 201 -7.507 11.668 3.160 1.00 0.00 H new ATOM 0 HE2 HIS A 201 -7.647 10.712 0.804 1.00 0.00 H new ATOM 693 N LYS A 202 -1.627 12.281 -0.170 1.00 0.00 N ATOM 694 CA LYS A 202 -1.484 13.354 -1.151 1.00 0.00 C ATOM 695 C LYS A 202 -0.728 12.902 -2.401 1.00 0.00 C ATOM 696 O LYS A 202 -1.194 13.101 -3.523 1.00 0.00 O ATOM 697 CB LYS A 202 -0.767 14.550 -0.522 1.00 0.00 C ATOM 698 CG LYS A 202 -1.221 15.892 -1.076 1.00 0.00 C ATOM 699 CD LYS A 202 -0.656 16.145 -2.469 1.00 0.00 C ATOM 700 CE LYS A 202 0.017 17.507 -2.571 1.00 0.00 C ATOM 701 NZ LYS A 202 1.368 17.413 -3.189 1.00 0.00 N ATOM 0 H LYS A 202 -1.068 12.402 0.675 1.00 0.00 H new ATOM 0 HA LYS A 202 -2.489 13.642 -1.459 1.00 0.00 H new ATOM 0 HB2 LYS A 202 -0.932 14.536 0.555 1.00 0.00 H new ATOM 0 HB3 LYS A 202 0.306 14.445 -0.681 1.00 0.00 H new ATOM 0 HG2 LYS A 202 -2.310 15.921 -1.114 1.00 0.00 H new ATOM 0 HG3 LYS A 202 -0.904 16.690 -0.404 1.00 0.00 H new ATOM 0 HD2 LYS A 202 0.064 15.365 -2.716 1.00 0.00 H new ATOM 0 HD3 LYS A 202 -1.459 16.081 -3.203 1.00 0.00 H new ATOM 0 HE2 LYS A 202 -0.607 18.177 -3.162 1.00 0.00 H new ATOM 0 HE3 LYS A 202 0.102 17.945 -1.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 202 1.793 18.361 -3.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 202 1.972 16.794 -2.611 1.00 0.00 H new ATOM 0 HZ3 LYS A 202 1.285 17.018 -4.148 1.00 0.00 H new ATOM 715 N ASP A 203 0.448 12.313 -2.202 1.00 0.00 N ATOM 716 CA ASP A 203 1.278 11.856 -3.317 1.00 0.00 C ATOM 717 C ASP A 203 0.722 10.596 -3.977 1.00 0.00 C ATOM 718 O ASP A 203 0.594 10.530 -5.200 1.00 0.00 O ATOM 719 CB ASP A 203 2.713 11.604 -2.844 1.00 0.00 C ATOM 720 CG ASP A 203 3.717 11.716 -3.974 1.00 0.00 C ATOM 721 OD1 ASP A 203 3.778 12.788 -4.611 1.00 0.00 O ATOM 722 OD2 ASP A 203 4.444 10.731 -4.221 1.00 0.00 O ATOM 0 H ASP A 203 0.849 12.140 -1.280 1.00 0.00 H new ATOM 0 HA ASP A 203 1.272 12.649 -4.065 1.00 0.00 H new ATOM 0 HB2 ASP A 203 2.967 12.320 -2.062 1.00 0.00 H new ATOM 0 HB3 ASP A 203 2.778 10.611 -2.400 1.00 0.00 H new ATOM 727 N GLY A 204 0.422 9.591 -3.166 1.00 0.00 N ATOM 728 CA GLY A 204 -0.083 8.335 -3.691 1.00 0.00 C ATOM 729 C GLY A 204 -1.547 8.376 -4.078 1.00 0.00 C ATOM 730 O GLY A 204 -1.968 7.670 -4.994 1.00 0.00 O ATOM 0 H GLY A 204 0.519 9.622 -2.151 1.00 0.00 H new ATOM 0 HA2 GLY A 204 0.506 8.055 -4.564 1.00 0.00 H new ATOM 0 HA3 GLY A 204 0.064 7.555 -2.944 1.00 0.00 H new ATOM 734 N ARG A 205 -2.334 9.181 -3.374 1.00 0.00 N ATOM 735 CA ARG A 205 -3.763 9.272 -3.654 1.00 0.00 C ATOM 736 C ARG A 205 -4.434 7.919 -3.435 1.00 0.00 C ATOM 737 O ARG A 205 -5.419 7.586 -4.094 1.00 0.00 O ATOM 738 CB ARG A 205 -3.997 9.751 -5.090 1.00 0.00 C ATOM 739 CG ARG A 205 -3.287 11.055 -5.418 1.00 0.00 C ATOM 740 CD ARG A 205 -2.758 11.062 -6.843 1.00 0.00 C ATOM 741 NE ARG A 205 -1.887 9.918 -7.109 1.00 0.00 N ATOM 742 CZ ARG A 205 -1.549 9.502 -8.330 1.00 0.00 C ATOM 743 NH1 ARG A 205 -2.005 10.127 -9.409 1.00 0.00 N ATOM 744 NH2 ARG A 205 -0.752 8.453 -8.471 1.00 0.00 N ATOM 0 H ARG A 205 -2.011 9.776 -2.611 1.00 0.00 H new ATOM 0 HA ARG A 205 -4.203 9.996 -2.969 1.00 0.00 H new ATOM 0 HB2 ARG A 205 -3.660 8.979 -5.782 1.00 0.00 H new ATOM 0 HB3 ARG A 205 -5.067 9.879 -5.252 1.00 0.00 H new ATOM 0 HG2 ARG A 205 -3.975 11.889 -5.281 1.00 0.00 H new ATOM 0 HG3 ARG A 205 -2.462 11.205 -4.722 1.00 0.00 H new ATOM 0 HD2 ARG A 205 -3.595 11.050 -7.541 1.00 0.00 H new ATOM 0 HD3 ARG A 205 -2.208 11.986 -7.021 1.00 0.00 H new ATOM 0 HE ARG A 205 -1.514 9.406 -6.310 1.00 0.00 H new ATOM 0 HH11 ARG A 205 -2.620 10.934 -9.309 1.00 0.00 H new ATOM 0 HH12 ARG A 205 -1.740 9.800 -10.338 1.00 0.00 H new ATOM 0 HH21 ARG A 205 -0.399 7.966 -7.647 1.00 0.00 H new ATOM 0 HH22 ARG A 205 -0.491 8.132 -9.404 1.00 0.00 H new ATOM 758 N LEU A 206 -3.886 7.141 -2.503 1.00 0.00 N ATOM 759 CA LEU A 206 -4.416 5.821 -2.187 1.00 0.00 C ATOM 760 C LEU A 206 -5.123 5.829 -0.837 1.00 0.00 C ATOM 761 O LEU A 206 -4.662 6.465 0.110 1.00 0.00 O ATOM 762 CB LEU A 206 -3.286 4.791 -2.176 1.00 0.00 C ATOM 763 CG LEU A 206 -2.226 5.012 -1.093 1.00 0.00 C ATOM 764 CD1 LEU A 206 -2.519 4.151 0.125 1.00 0.00 C ATOM 765 CD2 LEU A 206 -0.834 4.719 -1.631 1.00 0.00 C ATOM 0 H LEU A 206 -3.070 7.407 -1.952 1.00 0.00 H new ATOM 0 HA LEU A 206 -5.141 5.551 -2.955 1.00 0.00 H new ATOM 0 HB2 LEU A 206 -3.719 3.799 -2.044 1.00 0.00 H new ATOM 0 HB3 LEU A 206 -2.797 4.799 -3.150 1.00 0.00 H new ATOM 0 HG LEU A 206 -2.261 6.059 -0.792 1.00 0.00 H new ATOM 0 HD11 LEU A 206 -1.755 4.322 0.884 1.00 0.00 H new ATOM 0 HD12 LEU A 206 -3.497 4.413 0.529 1.00 0.00 H new ATOM 0 HD13 LEU A 206 -2.516 3.100 -0.163 1.00 0.00 H new ATOM 0 HD21 LEU A 206 -0.098 4.883 -0.844 1.00 0.00 H new ATOM 0 HD22 LEU A 206 -0.784 3.683 -1.965 1.00 0.00 H new ATOM 0 HD23 LEU A 206 -0.621 5.381 -2.470 1.00 0.00 H new ATOM 777 N GLN A 207 -6.244 5.119 -0.754 1.00 0.00 N ATOM 778 CA GLN A 207 -7.009 5.051 0.486 1.00 0.00 C ATOM 779 C GLN A 207 -7.245 3.605 0.910 1.00 0.00 C ATOM 780 O GLN A 207 -6.851 2.669 0.213 1.00 0.00 O ATOM 781 CB GLN A 207 -8.346 5.780 0.329 1.00 0.00 C ATOM 782 CG GLN A 207 -9.159 5.320 -0.872 1.00 0.00 C ATOM 783 CD GLN A 207 -9.972 4.075 -0.583 1.00 0.00 C ATOM 784 OE1 GLN A 207 -10.925 4.108 0.195 1.00 0.00 O ATOM 785 NE2 GLN A 207 -9.598 2.966 -1.211 1.00 0.00 N ATOM 0 H GLN A 207 -6.641 4.585 -1.527 1.00 0.00 H new ATOM 0 HA GLN A 207 -6.427 5.542 1.266 1.00 0.00 H new ATOM 0 HB2 GLN A 207 -8.937 5.634 1.233 1.00 0.00 H new ATOM 0 HB3 GLN A 207 -8.158 6.850 0.240 1.00 0.00 H new ATOM 0 HG2 GLN A 207 -9.828 6.123 -1.182 1.00 0.00 H new ATOM 0 HG3 GLN A 207 -8.487 5.125 -1.708 1.00 0.00 H new ATOM 0 HE21 GLN A 207 -8.801 2.984 -1.848 1.00 0.00 H new ATOM 0 HE22 GLN A 207 -10.107 2.096 -1.057 1.00 0.00 H new ATOM 794 N ILE A 208 -7.887 3.430 2.060 1.00 0.00 N ATOM 795 CA ILE A 208 -8.172 2.099 2.581 1.00 0.00 C ATOM 796 C ILE A 208 -9.069 1.321 1.624 1.00 0.00 C ATOM 797 O ILE A 208 -10.227 1.680 1.407 1.00 0.00 O ATOM 798 CB ILE A 208 -8.839 2.170 3.974 1.00 0.00 C ATOM 799 CG1 ILE A 208 -7.987 3.010 4.928 1.00 0.00 C ATOM 800 CG2 ILE A 208 -9.048 0.772 4.542 1.00 0.00 C ATOM 801 CD1 ILE A 208 -8.601 3.176 6.300 1.00 0.00 C ATOM 0 H ILE A 208 -8.220 4.194 2.649 1.00 0.00 H new ATOM 0 HA ILE A 208 -7.219 1.580 2.678 1.00 0.00 H new ATOM 0 HB ILE A 208 -9.814 2.645 3.865 1.00 0.00 H new ATOM 0 HG12 ILE A 208 -7.007 2.545 5.032 1.00 0.00 H new ATOM 0 HG13 ILE A 208 -7.828 3.995 4.489 1.00 0.00 H new ATOM 0 HG21 ILE A 208 -9.518 0.844 5.523 1.00 0.00 H new ATOM 0 HG22 ILE A 208 -9.690 0.200 3.873 1.00 0.00 H new ATOM 0 HG23 ILE A 208 -8.085 0.270 4.638 1.00 0.00 H new ATOM 0 HD11 ILE A 208 -7.943 3.782 6.922 1.00 0.00 H new ATOM 0 HD12 ILE A 208 -9.569 3.669 6.208 1.00 0.00 H new ATOM 0 HD13 ILE A 208 -8.735 2.197 6.760 1.00 0.00 H new ATOM 813 N GLY A 209 -8.523 0.253 1.053 1.00 0.00 N ATOM 814 CA GLY A 209 -9.280 -0.561 0.123 1.00 0.00 C ATOM 815 C GLY A 209 -8.487 -0.932 -1.120 1.00 0.00 C ATOM 816 O GLY A 209 -8.856 -1.861 -1.838 1.00 0.00 O ATOM 0 H GLY A 209 -7.568 -0.063 1.219 1.00 0.00 H new ATOM 0 HA2 GLY A 209 -9.604 -1.472 0.626 1.00 0.00 H new ATOM 0 HA3 GLY A 209 -10.180 -0.023 -0.174 1.00 0.00 H new ATOM 820 N ASP A 210 -7.399 -0.207 -1.380 1.00 0.00 N ATOM 821 CA ASP A 210 -6.568 -0.476 -2.552 1.00 0.00 C ATOM 822 C ASP A 210 -5.652 -1.677 -2.316 1.00 0.00 C ATOM 823 O ASP A 210 -5.234 -1.939 -1.189 1.00 0.00 O ATOM 824 CB ASP A 210 -5.732 0.760 -2.895 1.00 0.00 C ATOM 825 CG ASP A 210 -6.379 1.615 -3.968 1.00 0.00 C ATOM 826 OD1 ASP A 210 -7.229 2.460 -3.620 1.00 0.00 O ATOM 827 OD2 ASP A 210 -6.036 1.437 -5.156 1.00 0.00 O ATOM 0 H ASP A 210 -7.075 0.566 -0.799 1.00 0.00 H new ATOM 0 HA ASP A 210 -7.227 -0.711 -3.388 1.00 0.00 H new ATOM 0 HB2 ASP A 210 -5.587 1.358 -1.996 1.00 0.00 H new ATOM 0 HB3 ASP A 210 -4.744 0.445 -3.231 1.00 0.00 H new ATOM 832 N LYS A 211 -5.343 -2.399 -3.392 1.00 0.00 N ATOM 833 CA LYS A 211 -4.471 -3.568 -3.306 1.00 0.00 C ATOM 834 C LYS A 211 -3.118 -3.280 -3.952 1.00 0.00 C ATOM 835 O LYS A 211 -3.049 -2.797 -5.077 1.00 0.00 O ATOM 836 CB LYS A 211 -5.123 -4.771 -3.988 1.00 0.00 C ATOM 837 CG LYS A 211 -4.283 -6.038 -3.919 1.00 0.00 C ATOM 838 CD LYS A 211 -4.083 -6.662 -5.292 1.00 0.00 C ATOM 839 CE LYS A 211 -5.404 -7.110 -5.898 1.00 0.00 C ATOM 840 NZ LYS A 211 -5.283 -8.430 -6.573 1.00 0.00 N ATOM 0 H LYS A 211 -5.683 -2.195 -4.332 1.00 0.00 H new ATOM 0 HA LYS A 211 -4.315 -3.797 -2.252 1.00 0.00 H new ATOM 0 HB2 LYS A 211 -6.091 -4.961 -3.524 1.00 0.00 H new ATOM 0 HB3 LYS A 211 -5.313 -4.527 -5.033 1.00 0.00 H new ATOM 0 HG2 LYS A 211 -3.312 -5.806 -3.481 1.00 0.00 H new ATOM 0 HG3 LYS A 211 -4.767 -6.759 -3.260 1.00 0.00 H new ATOM 0 HD2 LYS A 211 -3.604 -5.941 -5.954 1.00 0.00 H new ATOM 0 HD3 LYS A 211 -3.411 -7.516 -5.210 1.00 0.00 H new ATOM 0 HE2 LYS A 211 -6.161 -7.170 -5.116 1.00 0.00 H new ATOM 0 HE3 LYS A 211 -5.746 -6.365 -6.616 1.00 0.00 H new ATOM 0 HZ1 LYS A 211 -6.204 -8.701 -6.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 211 -4.579 -8.367 -7.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 211 -4.981 -9.147 -5.882 1.00 0.00 H new ATOM 854 N ILE A 212 -2.046 -3.578 -3.232 1.00 0.00 N ATOM 855 CA ILE A 212 -0.697 -3.343 -3.734 1.00 0.00 C ATOM 856 C ILE A 212 -0.119 -4.588 -4.398 1.00 0.00 C ATOM 857 O ILE A 212 0.038 -5.626 -3.757 1.00 0.00 O ATOM 858 CB ILE A 212 0.233 -2.904 -2.587 1.00 0.00 C ATOM 859 CG1 ILE A 212 -0.389 -1.727 -1.834 1.00 0.00 C ATOM 860 CG2 ILE A 212 1.620 -2.548 -3.111 1.00 0.00 C ATOM 861 CD1 ILE A 212 -0.441 -0.444 -2.637 1.00 0.00 C ATOM 0 H ILE A 212 -2.083 -3.984 -2.297 1.00 0.00 H new ATOM 0 HA ILE A 212 -0.763 -2.551 -4.481 1.00 0.00 H new ATOM 0 HB ILE A 212 0.350 -3.738 -1.895 1.00 0.00 H new ATOM 0 HG12 ILE A 212 -1.401 -1.996 -1.531 1.00 0.00 H new ATOM 0 HG13 ILE A 212 0.180 -1.550 -0.922 1.00 0.00 H new ATOM 0 HG21 ILE A 212 2.255 -2.242 -2.280 1.00 0.00 H new ATOM 0 HG22 ILE A 212 2.058 -3.417 -3.601 1.00 0.00 H new ATOM 0 HG23 ILE A 212 1.540 -1.730 -3.827 1.00 0.00 H new ATOM 0 HD11 ILE A 212 -0.895 0.344 -2.035 1.00 0.00 H new ATOM 0 HD12 ILE A 212 0.570 -0.149 -2.918 1.00 0.00 H new ATOM 0 HD13 ILE A 212 -1.036 -0.602 -3.537 1.00 0.00 H new ATOM 873 N LEU A 213 0.201 -4.476 -5.686 1.00 0.00 N ATOM 874 CA LEU A 213 0.771 -5.607 -6.422 1.00 0.00 C ATOM 875 C LEU A 213 2.307 -5.565 -6.454 1.00 0.00 C ATOM 876 O LEU A 213 2.949 -6.522 -6.884 1.00 0.00 O ATOM 877 CB LEU A 213 0.197 -5.666 -7.848 1.00 0.00 C ATOM 878 CG LEU A 213 0.825 -4.702 -8.866 1.00 0.00 C ATOM 879 CD1 LEU A 213 1.844 -5.428 -9.734 1.00 0.00 C ATOM 880 CD2 LEU A 213 -0.254 -4.064 -9.731 1.00 0.00 C ATOM 0 H LEU A 213 0.078 -3.626 -6.237 1.00 0.00 H new ATOM 0 HA LEU A 213 0.488 -6.515 -5.890 1.00 0.00 H new ATOM 0 HB2 LEU A 213 0.311 -6.683 -8.222 1.00 0.00 H new ATOM 0 HB3 LEU A 213 -0.873 -5.463 -7.797 1.00 0.00 H new ATOM 0 HG LEU A 213 1.341 -3.913 -8.319 1.00 0.00 H new ATOM 0 HD11 LEU A 213 2.278 -4.728 -10.449 1.00 0.00 H new ATOM 0 HD12 LEU A 213 2.633 -5.838 -9.103 1.00 0.00 H new ATOM 0 HD13 LEU A 213 1.352 -6.238 -10.272 1.00 0.00 H new ATOM 0 HD21 LEU A 213 0.208 -3.384 -10.447 1.00 0.00 H new ATOM 0 HD22 LEU A 213 -0.797 -4.842 -10.268 1.00 0.00 H new ATOM 0 HD23 LEU A 213 -0.947 -3.509 -9.098 1.00 0.00 H new ATOM 892 N ALA A 214 2.898 -4.457 -6.002 1.00 0.00 N ATOM 893 CA ALA A 214 4.357 -4.306 -5.983 1.00 0.00 C ATOM 894 C ALA A 214 4.751 -2.897 -5.555 1.00 0.00 C ATOM 895 O ALA A 214 4.003 -1.941 -5.767 1.00 0.00 O ATOM 896 CB ALA A 214 4.953 -4.615 -7.351 1.00 0.00 C ATOM 0 H ALA A 214 2.389 -3.649 -5.643 1.00 0.00 H new ATOM 0 HA ALA A 214 4.754 -5.017 -5.259 1.00 0.00 H new ATOM 0 HB1 ALA A 214 6.036 -4.496 -7.311 1.00 0.00 H new ATOM 0 HB2 ALA A 214 4.711 -5.640 -7.630 1.00 0.00 H new ATOM 0 HB3 ALA A 214 4.540 -3.930 -8.091 1.00 0.00 H new ATOM 902 N VAL A 215 5.930 -2.774 -4.958 1.00 0.00 N ATOM 903 CA VAL A 215 6.429 -1.479 -4.506 1.00 0.00 C ATOM 904 C VAL A 215 7.780 -1.188 -5.150 1.00 0.00 C ATOM 905 O VAL A 215 8.730 -1.944 -4.962 1.00 0.00 O ATOM 906 CB VAL A 215 6.580 -1.435 -2.968 1.00 0.00 C ATOM 907 CG1 VAL A 215 6.729 -0.002 -2.483 1.00 0.00 C ATOM 908 CG2 VAL A 215 5.400 -2.116 -2.283 1.00 0.00 C ATOM 0 H VAL A 215 6.560 -3.555 -4.775 1.00 0.00 H new ATOM 0 HA VAL A 215 5.702 -0.723 -4.803 1.00 0.00 H new ATOM 0 HB VAL A 215 7.485 -1.982 -2.703 1.00 0.00 H new ATOM 0 HG11 VAL A 215 6.834 0.006 -1.398 1.00 0.00 H new ATOM 0 HG12 VAL A 215 7.614 0.445 -2.936 1.00 0.00 H new ATOM 0 HG13 VAL A 215 5.847 0.572 -2.766 1.00 0.00 H new ATOM 0 HG21 VAL A 215 5.531 -2.071 -1.202 1.00 0.00 H new ATOM 0 HG22 VAL A 215 4.476 -1.607 -2.558 1.00 0.00 H new ATOM 0 HG23 VAL A 215 5.348 -3.158 -2.599 1.00 0.00 H new ATOM 918 N ASN A 216 7.857 -0.099 -5.919 1.00 0.00 N ATOM 919 CA ASN A 216 9.093 0.274 -6.609 1.00 0.00 C ATOM 920 C ASN A 216 9.539 -0.870 -7.531 1.00 0.00 C ATOM 921 O ASN A 216 9.190 -0.899 -8.710 1.00 0.00 O ATOM 922 CB ASN A 216 10.184 0.640 -5.590 1.00 0.00 C ATOM 923 CG ASN A 216 11.534 0.905 -6.232 1.00 0.00 C ATOM 924 OD1 ASN A 216 12.396 0.028 -6.275 1.00 0.00 O ATOM 925 ND2 ASN A 216 11.723 2.120 -6.735 1.00 0.00 N ATOM 0 H ASN A 216 7.078 0.539 -6.079 1.00 0.00 H new ATOM 0 HA ASN A 216 8.913 1.154 -7.226 1.00 0.00 H new ATOM 0 HB2 ASN A 216 9.872 1.525 -5.035 1.00 0.00 H new ATOM 0 HB3 ASN A 216 10.285 -0.170 -4.868 1.00 0.00 H new ATOM 0 HD21 ASN A 216 12.611 2.356 -7.179 1.00 0.00 H new ATOM 0 HD22 ASN A 216 10.980 2.817 -6.677 1.00 0.00 H new ATOM 932 N SER A 217 10.276 -1.825 -6.974 1.00 0.00 N ATOM 933 CA SER A 217 10.730 -2.989 -7.722 1.00 0.00 C ATOM 934 C SER A 217 10.648 -4.254 -6.855 1.00 0.00 C ATOM 935 O SER A 217 11.224 -5.286 -7.199 1.00 0.00 O ATOM 936 CB SER A 217 12.164 -2.780 -8.212 1.00 0.00 C ATOM 937 OG SER A 217 13.064 -2.656 -7.124 1.00 0.00 O ATOM 0 H SER A 217 10.573 -1.814 -5.998 1.00 0.00 H new ATOM 0 HA SER A 217 10.078 -3.117 -8.586 1.00 0.00 H new ATOM 0 HB2 SER A 217 12.462 -3.619 -8.840 1.00 0.00 H new ATOM 0 HB3 SER A 217 12.213 -1.885 -8.832 1.00 0.00 H new ATOM 0 HG SER A 217 12.962 -1.772 -6.714 1.00 0.00 H new ATOM 943 N VAL A 218 9.935 -4.166 -5.723 1.00 0.00 N ATOM 944 CA VAL A 218 9.787 -5.284 -4.813 1.00 0.00 C ATOM 945 C VAL A 218 8.361 -5.839 -4.842 1.00 0.00 C ATOM 946 O VAL A 218 7.389 -5.085 -4.895 1.00 0.00 O ATOM 947 CB VAL A 218 10.157 -4.853 -3.378 1.00 0.00 C ATOM 948 CG1 VAL A 218 9.306 -3.674 -2.925 1.00 0.00 C ATOM 949 CG2 VAL A 218 10.034 -6.018 -2.408 1.00 0.00 C ATOM 0 H VAL A 218 9.452 -3.319 -5.424 1.00 0.00 H new ATOM 0 HA VAL A 218 10.464 -6.074 -5.138 1.00 0.00 H new ATOM 0 HB VAL A 218 11.199 -4.532 -3.384 1.00 0.00 H new ATOM 0 HG11 VAL A 218 9.587 -3.391 -1.911 1.00 0.00 H new ATOM 0 HG12 VAL A 218 9.467 -2.830 -3.596 1.00 0.00 H new ATOM 0 HG13 VAL A 218 8.253 -3.956 -2.944 1.00 0.00 H new ATOM 0 HG21 VAL A 218 10.301 -5.686 -1.405 1.00 0.00 H new ATOM 0 HG22 VAL A 218 9.008 -6.385 -2.408 1.00 0.00 H new ATOM 0 HG23 VAL A 218 10.706 -6.820 -2.715 1.00 0.00 H new ATOM 959 N GLY A 219 8.252 -7.161 -4.797 1.00 0.00 N ATOM 960 CA GLY A 219 6.954 -7.805 -4.808 1.00 0.00 C ATOM 961 C GLY A 219 6.569 -8.329 -3.438 1.00 0.00 C ATOM 962 O GLY A 219 7.122 -9.324 -2.969 1.00 0.00 O ATOM 0 H GLY A 219 9.045 -7.801 -4.753 1.00 0.00 H new ATOM 0 HA2 GLY A 219 6.200 -7.096 -5.150 1.00 0.00 H new ATOM 0 HA3 GLY A 219 6.964 -8.629 -5.522 1.00 0.00 H new ATOM 966 N LEU A 220 5.622 -7.658 -2.794 1.00 0.00 N ATOM 967 CA LEU A 220 5.167 -8.061 -1.470 1.00 0.00 C ATOM 968 C LEU A 220 3.801 -8.714 -1.551 1.00 0.00 C ATOM 969 O LEU A 220 2.938 -8.497 -0.698 1.00 0.00 O ATOM 970 CB LEU A 220 5.104 -6.860 -0.528 1.00 0.00 C ATOM 971 CG LEU A 220 4.642 -5.548 -1.168 1.00 0.00 C ATOM 972 CD1 LEU A 220 3.224 -5.689 -1.700 1.00 0.00 C ATOM 973 CD2 LEU A 220 4.729 -4.406 -0.161 1.00 0.00 C ATOM 0 H LEU A 220 5.154 -6.832 -3.168 1.00 0.00 H new ATOM 0 HA LEU A 220 5.884 -8.781 -1.076 1.00 0.00 H new ATOM 0 HB2 LEU A 220 4.431 -7.100 0.295 1.00 0.00 H new ATOM 0 HB3 LEU A 220 6.093 -6.706 -0.096 1.00 0.00 H new ATOM 0 HG LEU A 220 5.301 -5.317 -2.005 1.00 0.00 H new ATOM 0 HD11 LEU A 220 2.910 -4.748 -2.152 1.00 0.00 H new ATOM 0 HD12 LEU A 220 3.194 -6.480 -2.450 1.00 0.00 H new ATOM 0 HD13 LEU A 220 2.551 -5.940 -0.880 1.00 0.00 H new ATOM 0 HD21 LEU A 220 4.397 -3.480 -0.631 1.00 0.00 H new ATOM 0 HD22 LEU A 220 4.092 -4.627 0.695 1.00 0.00 H new ATOM 0 HD23 LEU A 220 5.760 -4.294 0.174 1.00 0.00 H new ATOM 985 N GLU A 221 3.605 -9.516 -2.581 1.00 0.00 N ATOM 986 CA GLU A 221 2.345 -10.194 -2.769 1.00 0.00 C ATOM 987 C GLU A 221 2.426 -11.610 -2.254 1.00 0.00 C ATOM 988 O GLU A 221 3.505 -12.111 -1.942 1.00 0.00 O ATOM 989 CB GLU A 221 1.962 -10.193 -4.241 1.00 0.00 C ATOM 990 CG GLU A 221 2.090 -8.827 -4.878 1.00 0.00 C ATOM 991 CD GLU A 221 1.586 -8.807 -6.306 1.00 0.00 C ATOM 992 OE1 GLU A 221 0.361 -8.666 -6.503 1.00 0.00 O ATOM 993 OE2 GLU A 221 2.417 -8.935 -7.230 1.00 0.00 O ATOM 0 H GLU A 221 4.304 -9.711 -3.297 1.00 0.00 H new ATOM 0 HA GLU A 221 1.578 -9.662 -2.205 1.00 0.00 H new ATOM 0 HB2 GLU A 221 2.595 -10.900 -4.777 1.00 0.00 H new ATOM 0 HB3 GLU A 221 0.935 -10.543 -4.345 1.00 0.00 H new ATOM 0 HG2 GLU A 221 1.532 -8.100 -4.288 1.00 0.00 H new ATOM 0 HG3 GLU A 221 3.135 -8.517 -4.860 1.00 0.00 H new ATOM 1000 N ASP A 222 1.271 -12.244 -2.164 1.00 0.00 N ATOM 1001 CA ASP A 222 1.173 -13.620 -1.685 1.00 0.00 C ATOM 1002 C ASP A 222 1.978 -13.842 -0.399 1.00 0.00 C ATOM 1003 O ASP A 222 2.415 -14.957 -0.117 1.00 0.00 O ATOM 1004 CB ASP A 222 1.631 -14.588 -2.785 1.00 0.00 C ATOM 1005 CG ASP A 222 3.131 -14.567 -3.029 1.00 0.00 C ATOM 1006 OD1 ASP A 222 3.889 -14.939 -2.109 1.00 0.00 O ATOM 1007 OD2 ASP A 222 3.545 -14.175 -4.140 1.00 0.00 O ATOM 0 H ASP A 222 0.376 -11.826 -2.418 1.00 0.00 H new ATOM 0 HA ASP A 222 0.128 -13.816 -1.443 1.00 0.00 H new ATOM 0 HB2 ASP A 222 1.330 -15.600 -2.515 1.00 0.00 H new ATOM 0 HB3 ASP A 222 1.117 -14.339 -3.713 1.00 0.00 H new ATOM 1012 N VAL A 223 2.165 -12.778 0.378 1.00 0.00 N ATOM 1013 CA VAL A 223 2.913 -12.880 1.621 1.00 0.00 C ATOM 1014 C VAL A 223 2.201 -12.128 2.747 1.00 0.00 C ATOM 1015 O VAL A 223 1.313 -11.315 2.494 1.00 0.00 O ATOM 1016 CB VAL A 223 4.366 -12.371 1.443 1.00 0.00 C ATOM 1017 CG1 VAL A 223 4.439 -10.848 1.387 1.00 0.00 C ATOM 1018 CG2 VAL A 223 5.258 -12.920 2.546 1.00 0.00 C ATOM 0 H VAL A 223 1.811 -11.845 0.169 1.00 0.00 H new ATOM 0 HA VAL A 223 2.963 -13.933 1.897 1.00 0.00 H new ATOM 0 HB VAL A 223 4.728 -12.740 0.483 1.00 0.00 H new ATOM 0 HG11 VAL A 223 5.476 -10.538 1.262 1.00 0.00 H new ATOM 0 HG12 VAL A 223 3.848 -10.486 0.546 1.00 0.00 H new ATOM 0 HG13 VAL A 223 4.045 -10.431 2.314 1.00 0.00 H new ATOM 0 HG21 VAL A 223 6.275 -12.554 2.407 1.00 0.00 H new ATOM 0 HG22 VAL A 223 4.883 -12.591 3.515 1.00 0.00 H new ATOM 0 HG23 VAL A 223 5.256 -14.009 2.507 1.00 0.00 H new ATOM 1028 N MET A 224 2.583 -12.418 3.984 1.00 0.00 N ATOM 1029 CA MET A 224 1.964 -11.781 5.137 1.00 0.00 C ATOM 1030 C MET A 224 2.280 -10.298 5.202 1.00 0.00 C ATOM 1031 O MET A 224 3.131 -9.785 4.476 1.00 0.00 O ATOM 1032 CB MET A 224 2.428 -12.426 6.441 1.00 0.00 C ATOM 1033 CG MET A 224 2.556 -13.941 6.375 1.00 0.00 C ATOM 1034 SD MET A 224 2.254 -14.733 7.968 1.00 0.00 S ATOM 1035 CE MET A 224 3.924 -15.152 8.465 1.00 0.00 C ATOM 0 H MET A 224 3.317 -13.088 4.213 1.00 0.00 H new ATOM 0 HA MET A 224 0.889 -11.915 5.017 1.00 0.00 H new ATOM 0 HB2 MET A 224 3.393 -12.003 6.720 1.00 0.00 H new ATOM 0 HB3 MET A 224 1.725 -12.166 7.232 1.00 0.00 H new ATOM 0 HG2 MET A 224 1.851 -14.330 5.641 1.00 0.00 H new ATOM 0 HG3 MET A 224 3.555 -14.203 6.027 1.00 0.00 H new ATOM 0 HE1 MET A 224 3.901 -15.650 9.434 1.00 0.00 H new ATOM 0 HE2 MET A 224 4.367 -15.819 7.725 1.00 0.00 H new ATOM 0 HE3 MET A 224 4.521 -14.243 8.538 1.00 0.00 H new ATOM 1045 N HIS A 225 1.584 -9.631 6.107 1.00 0.00 N ATOM 1046 CA HIS A 225 1.752 -8.206 6.338 1.00 0.00 C ATOM 1047 C HIS A 225 3.208 -7.868 6.703 1.00 0.00 C ATOM 1048 O HIS A 225 3.716 -6.810 6.332 1.00 0.00 O ATOM 1049 CB HIS A 225 0.797 -7.792 7.471 1.00 0.00 C ATOM 1050 CG HIS A 225 1.038 -6.441 8.056 1.00 0.00 C ATOM 1051 ND1 HIS A 225 0.676 -5.257 7.460 1.00 0.00 N ATOM 1052 CD2 HIS A 225 1.610 -6.114 9.231 1.00 0.00 C ATOM 1053 CE1 HIS A 225 1.038 -4.261 8.280 1.00 0.00 C ATOM 1054 NE2 HIS A 225 1.611 -4.729 9.373 1.00 0.00 N ATOM 0 H HIS A 225 0.882 -10.066 6.706 1.00 0.00 H new ATOM 0 HA HIS A 225 1.517 -7.656 5.427 1.00 0.00 H new ATOM 0 HB2 HIS A 225 -0.224 -7.827 7.092 1.00 0.00 H new ATOM 0 HB3 HIS A 225 0.867 -8.531 8.269 1.00 0.00 H new ATOM 0 HD2 HIS A 225 2.006 -6.816 9.950 1.00 0.00 H new ATOM 0 HE1 HIS A 225 0.881 -3.213 8.074 1.00 0.00 H new ATOM 0 HE2 HIS A 225 1.978 -4.189 10.157 1.00 0.00 H new ATOM 1062 N GLU A 226 3.864 -8.759 7.449 1.00 0.00 N ATOM 1063 CA GLU A 226 5.244 -8.533 7.884 1.00 0.00 C ATOM 1064 C GLU A 226 6.220 -8.424 6.710 1.00 0.00 C ATOM 1065 O GLU A 226 6.985 -7.458 6.610 1.00 0.00 O ATOM 1066 CB GLU A 226 5.688 -9.666 8.810 1.00 0.00 C ATOM 1067 CG GLU A 226 6.999 -9.386 9.523 1.00 0.00 C ATOM 1068 CD GLU A 226 7.772 -10.649 9.846 1.00 0.00 C ATOM 1069 OE1 GLU A 226 7.603 -11.650 9.118 1.00 0.00 O ATOM 1070 OE2 GLU A 226 8.547 -10.638 10.825 1.00 0.00 O ATOM 0 H GLU A 226 3.463 -9.642 7.764 1.00 0.00 H new ATOM 0 HA GLU A 226 5.261 -7.581 8.414 1.00 0.00 H new ATOM 0 HB2 GLU A 226 4.910 -9.844 9.553 1.00 0.00 H new ATOM 0 HB3 GLU A 226 5.788 -10.582 8.228 1.00 0.00 H new ATOM 0 HG2 GLU A 226 7.615 -8.737 8.900 1.00 0.00 H new ATOM 0 HG3 GLU A 226 6.797 -8.843 10.446 1.00 0.00 H new ATOM 1077 N ASP A 227 6.195 -9.409 5.820 1.00 0.00 N ATOM 1078 CA ASP A 227 7.086 -9.407 4.664 1.00 0.00 C ATOM 1079 C ASP A 227 6.835 -8.185 3.799 1.00 0.00 C ATOM 1080 O ASP A 227 7.765 -7.597 3.242 1.00 0.00 O ATOM 1081 CB ASP A 227 6.895 -10.675 3.841 1.00 0.00 C ATOM 1082 CG ASP A 227 7.129 -11.929 4.659 1.00 0.00 C ATOM 1083 OD1 ASP A 227 6.479 -12.079 5.715 1.00 0.00 O ATOM 1084 OD2 ASP A 227 7.962 -12.761 4.244 1.00 0.00 O ATOM 0 H ASP A 227 5.572 -10.215 5.875 1.00 0.00 H new ATOM 0 HA ASP A 227 8.113 -9.374 5.026 1.00 0.00 H new ATOM 0 HB2 ASP A 227 5.884 -10.693 3.433 1.00 0.00 H new ATOM 0 HB3 ASP A 227 7.580 -10.663 2.994 1.00 0.00 H new ATOM 1089 N ALA A 228 5.570 -7.794 3.702 1.00 0.00 N ATOM 1090 CA ALA A 228 5.198 -6.629 2.920 1.00 0.00 C ATOM 1091 C ALA A 228 5.864 -5.388 3.487 1.00 0.00 C ATOM 1092 O ALA A 228 6.327 -4.520 2.747 1.00 0.00 O ATOM 1093 CB ALA A 228 3.692 -6.467 2.892 1.00 0.00 C ATOM 0 H ALA A 228 4.789 -8.268 4.155 1.00 0.00 H new ATOM 0 HA ALA A 228 5.541 -6.769 1.895 1.00 0.00 H new ATOM 0 HB1 ALA A 228 3.431 -5.589 2.301 1.00 0.00 H new ATOM 0 HB2 ALA A 228 3.239 -7.352 2.445 1.00 0.00 H new ATOM 0 HB3 ALA A 228 3.320 -6.343 3.909 1.00 0.00 H new ATOM 1099 N VAL A 229 5.934 -5.325 4.816 1.00 0.00 N ATOM 1100 CA VAL A 229 6.575 -4.209 5.494 1.00 0.00 C ATOM 1101 C VAL A 229 8.030 -4.113 5.057 1.00 0.00 C ATOM 1102 O VAL A 229 8.547 -3.025 4.798 1.00 0.00 O ATOM 1103 CB VAL A 229 6.513 -4.368 7.024 1.00 0.00 C ATOM 1104 CG1 VAL A 229 7.003 -3.102 7.712 1.00 0.00 C ATOM 1105 CG2 VAL A 229 5.099 -4.724 7.469 1.00 0.00 C ATOM 0 H VAL A 229 5.553 -6.036 5.441 1.00 0.00 H new ATOM 0 HA VAL A 229 6.040 -3.299 5.223 1.00 0.00 H new ATOM 0 HB VAL A 229 7.172 -5.186 7.315 1.00 0.00 H new ATOM 0 HG11 VAL A 229 6.952 -3.232 8.793 1.00 0.00 H new ATOM 0 HG12 VAL A 229 8.034 -2.904 7.418 1.00 0.00 H new ATOM 0 HG13 VAL A 229 6.374 -2.262 7.418 1.00 0.00 H new ATOM 0 HG21 VAL A 229 5.075 -4.832 8.553 1.00 0.00 H new ATOM 0 HG22 VAL A 229 4.413 -3.932 7.168 1.00 0.00 H new ATOM 0 HG23 VAL A 229 4.797 -5.662 7.004 1.00 0.00 H new ATOM 1115 N ALA A 230 8.679 -5.270 4.956 1.00 0.00 N ATOM 1116 CA ALA A 230 10.069 -5.324 4.521 1.00 0.00 C ATOM 1117 C ALA A 230 10.202 -4.775 3.108 1.00 0.00 C ATOM 1118 O ALA A 230 11.197 -4.133 2.765 1.00 0.00 O ATOM 1119 CB ALA A 230 10.597 -6.750 4.593 1.00 0.00 C ATOM 0 H ALA A 230 8.266 -6.178 5.169 1.00 0.00 H new ATOM 0 HA ALA A 230 10.666 -4.705 5.191 1.00 0.00 H new ATOM 0 HB1 ALA A 230 11.636 -6.770 4.264 1.00 0.00 H new ATOM 0 HB2 ALA A 230 10.534 -7.110 5.620 1.00 0.00 H new ATOM 0 HB3 ALA A 230 9.999 -7.392 3.946 1.00 0.00 H new ATOM 1125 N ALA A 231 9.182 -5.025 2.300 1.00 0.00 N ATOM 1126 CA ALA A 231 9.161 -4.552 0.919 1.00 0.00 C ATOM 1127 C ALA A 231 9.133 -3.027 0.874 1.00 0.00 C ATOM 1128 O ALA A 231 9.806 -2.408 0.050 1.00 0.00 O ATOM 1129 CB ALA A 231 7.964 -5.130 0.170 1.00 0.00 C ATOM 0 H ALA A 231 8.355 -5.554 2.576 1.00 0.00 H new ATOM 0 HA ALA A 231 10.072 -4.895 0.428 1.00 0.00 H new ATOM 0 HB1 ALA A 231 7.967 -4.765 -0.857 1.00 0.00 H new ATOM 0 HB2 ALA A 231 8.026 -6.218 0.169 1.00 0.00 H new ATOM 0 HB3 ALA A 231 7.042 -4.820 0.663 1.00 0.00 H new ATOM 1135 N LEU A 232 8.350 -2.426 1.767 1.00 0.00 N ATOM 1136 CA LEU A 232 8.235 -0.974 1.830 1.00 0.00 C ATOM 1137 C LEU A 232 9.495 -0.343 2.422 1.00 0.00 C ATOM 1138 O LEU A 232 9.966 0.688 1.944 1.00 0.00 O ATOM 1139 CB LEU A 232 7.017 -0.571 2.665 1.00 0.00 C ATOM 1140 CG LEU A 232 5.723 -1.317 2.331 1.00 0.00 C ATOM 1141 CD1 LEU A 232 4.748 -1.244 3.496 1.00 0.00 C ATOM 1142 CD2 LEU A 232 5.090 -0.748 1.071 1.00 0.00 C ATOM 0 H LEU A 232 7.786 -2.924 2.456 1.00 0.00 H new ATOM 0 HA LEU A 232 8.112 -0.608 0.811 1.00 0.00 H new ATOM 0 HB2 LEU A 232 7.249 -0.732 3.718 1.00 0.00 H new ATOM 0 HB3 LEU A 232 6.845 0.498 2.536 1.00 0.00 H new ATOM 0 HG LEU A 232 5.967 -2.364 2.152 1.00 0.00 H new ATOM 0 HD11 LEU A 232 3.834 -1.780 3.240 1.00 0.00 H new ATOM 0 HD12 LEU A 232 5.200 -1.698 4.378 1.00 0.00 H new ATOM 0 HD13 LEU A 232 4.510 -0.201 3.707 1.00 0.00 H new ATOM 0 HD21 LEU A 232 4.171 -1.290 0.849 1.00 0.00 H new ATOM 0 HD22 LEU A 232 4.861 0.307 1.223 1.00 0.00 H new ATOM 0 HD23 LEU A 232 5.784 -0.852 0.237 1.00 0.00 H new ATOM 1154 N LYS A 233 10.028 -0.965 3.471 1.00 0.00 N ATOM 1155 CA LYS A 233 11.228 -0.458 4.137 1.00 0.00 C ATOM 1156 C LYS A 233 12.395 -0.333 3.169 1.00 0.00 C ATOM 1157 O LYS A 233 13.153 0.637 3.206 1.00 0.00 O ATOM 1158 CB LYS A 233 11.615 -1.371 5.302 1.00 0.00 C ATOM 1159 CG LYS A 233 12.579 -0.728 6.285 1.00 0.00 C ATOM 1160 CD LYS A 233 12.613 -1.483 7.604 1.00 0.00 C ATOM 1161 CE LYS A 233 13.792 -2.442 7.666 1.00 0.00 C ATOM 1162 NZ LYS A 233 15.095 -1.735 7.519 1.00 0.00 N ATOM 0 H LYS A 233 9.649 -1.820 3.879 1.00 0.00 H new ATOM 0 HA LYS A 233 10.997 0.537 4.518 1.00 0.00 H new ATOM 0 HB2 LYS A 233 10.712 -1.669 5.834 1.00 0.00 H new ATOM 0 HB3 LYS A 233 12.066 -2.280 4.905 1.00 0.00 H new ATOM 0 HG2 LYS A 233 13.579 -0.703 5.852 1.00 0.00 H new ATOM 0 HG3 LYS A 233 12.283 0.306 6.463 1.00 0.00 H new ATOM 0 HD2 LYS A 233 12.676 -0.774 8.429 1.00 0.00 H new ATOM 0 HD3 LYS A 233 11.684 -2.038 7.731 1.00 0.00 H new ATOM 0 HE2 LYS A 233 13.775 -2.977 8.616 1.00 0.00 H new ATOM 0 HE3 LYS A 233 13.694 -3.189 6.878 1.00 0.00 H new ATOM 0 HZ1 LYS A 233 15.838 -2.269 8.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 233 15.337 -1.659 6.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 233 15.022 -0.783 7.930 1.00 0.00 H new ATOM 1176 N ASN A 234 12.529 -1.323 2.309 1.00 0.00 N ATOM 1177 CA ASN A 234 13.602 -1.349 1.318 1.00 0.00 C ATOM 1178 C ASN A 234 13.562 -0.125 0.401 1.00 0.00 C ATOM 1179 O ASN A 234 14.557 0.206 -0.243 1.00 0.00 O ATOM 1180 CB ASN A 234 13.514 -2.625 0.480 1.00 0.00 C ATOM 1181 CG ASN A 234 13.961 -3.854 1.246 1.00 0.00 C ATOM 1182 OD1 ASN A 234 13.217 -4.825 1.375 1.00 0.00 O ATOM 1183 ND2 ASN A 234 15.186 -3.819 1.761 1.00 0.00 N ATOM 0 H ASN A 234 11.906 -2.129 2.272 1.00 0.00 H new ATOM 0 HA ASN A 234 14.547 -1.330 1.860 1.00 0.00 H new ATOM 0 HB2 ASN A 234 12.487 -2.764 0.143 1.00 0.00 H new ATOM 0 HB3 ASN A 234 14.130 -2.513 -0.412 1.00 0.00 H new ATOM 0 HD21 ASN A 234 15.541 -4.618 2.287 1.00 0.00 H new ATOM 0 HD22 ASN A 234 15.771 -2.993 1.631 1.00 0.00 H new ATOM 1190 N THR A 235 12.410 0.537 0.330 1.00 0.00 N ATOM 1191 CA THR A 235 12.256 1.711 -0.526 1.00 0.00 C ATOM 1192 C THR A 235 13.101 2.884 -0.024 1.00 0.00 C ATOM 1193 O THR A 235 13.922 2.727 0.881 1.00 0.00 O ATOM 1194 CB THR A 235 10.784 2.116 -0.619 1.00 0.00 C ATOM 1195 OG1 THR A 235 10.354 2.731 0.582 1.00 0.00 O ATOM 1196 CG2 THR A 235 9.852 0.957 -0.903 1.00 0.00 C ATOM 0 H THR A 235 11.572 0.282 0.853 1.00 0.00 H new ATOM 0 HA THR A 235 12.612 1.445 -1.521 1.00 0.00 H new ATOM 0 HB THR A 235 10.734 2.810 -1.458 1.00 0.00 H new ATOM 0 HG1 THR A 235 10.502 2.120 1.334 1.00 0.00 H new ATOM 0 HG21 THR A 235 8.825 1.320 -0.955 1.00 0.00 H new ATOM 0 HG22 THR A 235 10.123 0.497 -1.853 1.00 0.00 H new ATOM 0 HG23 THR A 235 9.936 0.219 -0.105 1.00 0.00 H new ATOM 1204 N TYR A 236 12.903 4.058 -0.626 1.00 0.00 N ATOM 1205 CA TYR A 236 13.654 5.253 -0.255 1.00 0.00 C ATOM 1206 C TYR A 236 12.758 6.497 -0.348 1.00 0.00 C ATOM 1207 O TYR A 236 11.566 6.416 -0.051 1.00 0.00 O ATOM 1208 CB TYR A 236 14.903 5.356 -1.146 1.00 0.00 C ATOM 1209 CG TYR A 236 14.594 5.480 -2.622 1.00 0.00 C ATOM 1210 CD1 TYR A 236 14.139 4.386 -3.347 1.00 0.00 C ATOM 1211 CD2 TYR A 236 14.758 6.688 -3.289 1.00 0.00 C ATOM 1212 CE1 TYR A 236 13.857 4.491 -4.696 1.00 0.00 C ATOM 1213 CE2 TYR A 236 14.477 6.801 -4.638 1.00 0.00 C ATOM 1214 CZ TYR A 236 14.027 5.700 -5.336 1.00 0.00 C ATOM 1215 OH TYR A 236 13.749 5.808 -6.679 1.00 0.00 O ATOM 0 H TYR A 236 12.226 4.204 -1.375 1.00 0.00 H new ATOM 0 HA TYR A 236 13.985 5.186 0.781 1.00 0.00 H new ATOM 0 HB2 TYR A 236 15.490 6.220 -0.834 1.00 0.00 H new ATOM 0 HB3 TYR A 236 15.524 4.474 -0.988 1.00 0.00 H new ATOM 0 HD1 TYR A 236 14.003 3.438 -2.848 1.00 0.00 H new ATOM 0 HD2 TYR A 236 15.110 7.552 -2.745 1.00 0.00 H new ATOM 0 HE1 TYR A 236 13.505 3.630 -5.246 1.00 0.00 H new ATOM 0 HE2 TYR A 236 14.609 7.747 -5.143 1.00 0.00 H new ATOM 0 HH TYR A 236 13.920 6.726 -6.976 1.00 0.00 H new ATOM 1225 N ASP A 237 13.320 7.650 -0.740 1.00 0.00 N ATOM 1226 CA ASP A 237 12.559 8.895 -0.846 1.00 0.00 C ATOM 1227 C ASP A 237 11.210 8.676 -1.529 1.00 0.00 C ATOM 1228 O ASP A 237 10.200 8.498 -0.865 1.00 0.00 O ATOM 1229 CB ASP A 237 13.373 9.951 -1.600 1.00 0.00 C ATOM 1230 CG ASP A 237 14.449 10.581 -0.737 1.00 0.00 C ATOM 1231 OD1 ASP A 237 15.501 9.939 -0.534 1.00 0.00 O ATOM 1232 OD2 ASP A 237 14.240 11.719 -0.265 1.00 0.00 O ATOM 0 H ASP A 237 14.305 7.742 -0.989 1.00 0.00 H new ATOM 0 HA ASP A 237 12.362 9.251 0.165 1.00 0.00 H new ATOM 0 HB2 ASP A 237 13.835 9.493 -2.474 1.00 0.00 H new ATOM 0 HB3 ASP A 237 12.703 10.729 -1.965 1.00 0.00 H new ATOM 1237 N VAL A 238 11.194 8.670 -2.850 1.00 0.00 N ATOM 1238 CA VAL A 238 9.949 8.463 -3.573 1.00 0.00 C ATOM 1239 C VAL A 238 9.824 7.018 -4.047 1.00 0.00 C ATOM 1240 O VAL A 238 10.655 6.523 -4.807 1.00 0.00 O ATOM 1241 CB VAL A 238 9.795 9.473 -4.744 1.00 0.00 C ATOM 1242 CG1 VAL A 238 10.325 8.935 -6.063 1.00 0.00 C ATOM 1243 CG2 VAL A 238 8.344 9.890 -4.887 1.00 0.00 C ATOM 0 H VAL A 238 12.016 8.804 -3.439 1.00 0.00 H new ATOM 0 HA VAL A 238 9.127 8.651 -2.882 1.00 0.00 H new ATOM 0 HB VAL A 238 10.403 10.343 -4.495 1.00 0.00 H new ATOM 0 HG11 VAL A 238 10.190 9.685 -6.842 1.00 0.00 H new ATOM 0 HG12 VAL A 238 11.385 8.704 -5.962 1.00 0.00 H new ATOM 0 HG13 VAL A 238 9.780 8.030 -6.332 1.00 0.00 H new ATOM 0 HG21 VAL A 238 8.248 10.598 -5.710 1.00 0.00 H new ATOM 0 HG22 VAL A 238 7.731 9.012 -5.090 1.00 0.00 H new ATOM 0 HG23 VAL A 238 8.008 10.361 -3.963 1.00 0.00 H new ATOM 1253 N VAL A 239 8.780 6.351 -3.584 1.00 0.00 N ATOM 1254 CA VAL A 239 8.535 4.968 -3.944 1.00 0.00 C ATOM 1255 C VAL A 239 7.213 4.829 -4.686 1.00 0.00 C ATOM 1256 O VAL A 239 6.191 5.350 -4.242 1.00 0.00 O ATOM 1257 CB VAL A 239 8.527 4.073 -2.690 1.00 0.00 C ATOM 1258 CG1 VAL A 239 7.328 4.367 -1.794 1.00 0.00 C ATOM 1259 CG2 VAL A 239 8.565 2.609 -3.083 1.00 0.00 C ATOM 0 H VAL A 239 8.085 6.750 -2.953 1.00 0.00 H new ATOM 0 HA VAL A 239 9.342 4.646 -4.602 1.00 0.00 H new ATOM 0 HB VAL A 239 9.424 4.301 -2.114 1.00 0.00 H new ATOM 0 HG11 VAL A 239 7.358 3.716 -0.921 1.00 0.00 H new ATOM 0 HG12 VAL A 239 7.361 5.408 -1.472 1.00 0.00 H new ATOM 0 HG13 VAL A 239 6.407 4.188 -2.349 1.00 0.00 H new ATOM 0 HG21 VAL A 239 8.559 1.991 -2.185 1.00 0.00 H new ATOM 0 HG22 VAL A 239 7.692 2.373 -3.692 1.00 0.00 H new ATOM 0 HG23 VAL A 239 9.471 2.409 -3.655 1.00 0.00 H new ATOM 1269 N TYR A 240 7.231 4.127 -5.810 1.00 0.00 N ATOM 1270 CA TYR A 240 6.016 3.938 -6.584 1.00 0.00 C ATOM 1271 C TYR A 240 5.430 2.550 -6.362 1.00 0.00 C ATOM 1272 O TYR A 240 6.046 1.545 -6.710 1.00 0.00 O ATOM 1273 CB TYR A 240 6.285 4.119 -8.076 1.00 0.00 C ATOM 1274 CG TYR A 240 7.083 5.351 -8.412 1.00 0.00 C ATOM 1275 CD1 TYR A 240 8.445 5.409 -8.157 1.00 0.00 C ATOM 1276 CD2 TYR A 240 6.472 6.455 -8.989 1.00 0.00 C ATOM 1277 CE1 TYR A 240 9.180 6.537 -8.467 1.00 0.00 C ATOM 1278 CE2 TYR A 240 7.199 7.587 -9.304 1.00 0.00 C ATOM 1279 CZ TYR A 240 8.553 7.623 -9.040 1.00 0.00 C ATOM 1280 OH TYR A 240 9.282 8.749 -9.350 1.00 0.00 O ATOM 0 H TYR A 240 8.063 3.685 -6.201 1.00 0.00 H new ATOM 0 HA TYR A 240 5.304 4.690 -6.245 1.00 0.00 H new ATOM 0 HB2 TYR A 240 6.816 3.243 -8.447 1.00 0.00 H new ATOM 0 HB3 TYR A 240 5.332 4.161 -8.604 1.00 0.00 H new ATOM 0 HD1 TYR A 240 8.939 4.559 -7.709 1.00 0.00 H new ATOM 0 HD2 TYR A 240 5.412 6.429 -9.195 1.00 0.00 H new ATOM 0 HE1 TYR A 240 10.240 6.568 -8.262 1.00 0.00 H new ATOM 0 HE2 TYR A 240 6.710 8.439 -9.754 1.00 0.00 H new ATOM 0 HH TYR A 240 8.691 9.422 -9.748 1.00 0.00 H new ATOM 1290 N LEU A 241 4.222 2.505 -5.829 1.00 0.00 N ATOM 1291 CA LEU A 241 3.531 1.251 -5.612 1.00 0.00 C ATOM 1292 C LEU A 241 2.579 1.015 -6.768 1.00 0.00 C ATOM 1293 O LEU A 241 1.941 1.948 -7.255 1.00 0.00 O ATOM 1294 CB LEU A 241 2.767 1.274 -4.291 1.00 0.00 C ATOM 1295 CG LEU A 241 3.648 1.381 -3.046 1.00 0.00 C ATOM 1296 CD1 LEU A 241 3.692 2.813 -2.541 1.00 0.00 C ATOM 1297 CD2 LEU A 241 3.156 0.445 -1.952 1.00 0.00 C ATOM 0 H LEU A 241 3.698 3.330 -5.537 1.00 0.00 H new ATOM 0 HA LEU A 241 4.258 0.441 -5.560 1.00 0.00 H new ATOM 0 HB2 LEU A 241 2.074 2.115 -4.302 1.00 0.00 H new ATOM 0 HB3 LEU A 241 2.167 0.367 -4.218 1.00 0.00 H new ATOM 0 HG LEU A 241 4.659 1.082 -3.321 1.00 0.00 H new ATOM 0 HD11 LEU A 241 4.324 2.867 -1.655 1.00 0.00 H new ATOM 0 HD12 LEU A 241 4.100 3.460 -3.317 1.00 0.00 H new ATOM 0 HD13 LEU A 241 2.684 3.141 -2.288 1.00 0.00 H new ATOM 0 HD21 LEU A 241 3.799 0.539 -1.077 1.00 0.00 H new ATOM 0 HD22 LEU A 241 2.133 0.707 -1.681 1.00 0.00 H new ATOM 0 HD23 LEU A 241 3.183 -0.583 -2.313 1.00 0.00 H new ATOM 1309 N LYS A 242 2.496 -0.221 -7.222 1.00 0.00 N ATOM 1310 CA LYS A 242 1.634 -0.557 -8.335 1.00 0.00 C ATOM 1311 C LYS A 242 0.416 -1.329 -7.847 1.00 0.00 C ATOM 1312 O LYS A 242 0.532 -2.280 -7.075 1.00 0.00 O ATOM 1313 CB LYS A 242 2.426 -1.362 -9.363 1.00 0.00 C ATOM 1314 CG LYS A 242 1.595 -1.845 -10.541 1.00 0.00 C ATOM 1315 CD LYS A 242 1.878 -1.036 -11.801 1.00 0.00 C ATOM 1316 CE LYS A 242 2.036 -1.933 -13.018 1.00 0.00 C ATOM 1317 NZ LYS A 242 3.469 -2.188 -13.337 1.00 0.00 N ATOM 0 H LYS A 242 3.016 -1.009 -6.836 1.00 0.00 H new ATOM 0 HA LYS A 242 1.276 0.357 -8.809 1.00 0.00 H new ATOM 0 HB2 LYS A 242 3.246 -0.749 -9.737 1.00 0.00 H new ATOM 0 HB3 LYS A 242 2.873 -2.224 -8.868 1.00 0.00 H new ATOM 0 HG2 LYS A 242 1.808 -2.897 -10.729 1.00 0.00 H new ATOM 0 HG3 LYS A 242 0.536 -1.773 -10.293 1.00 0.00 H new ATOM 0 HD2 LYS A 242 1.065 -0.330 -11.971 1.00 0.00 H new ATOM 0 HD3 LYS A 242 2.785 -0.449 -11.661 1.00 0.00 H new ATOM 0 HE2 LYS A 242 1.530 -2.881 -12.838 1.00 0.00 H new ATOM 0 HE3 LYS A 242 1.550 -1.470 -13.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 242 3.534 -2.803 -14.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 242 3.947 -1.285 -13.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 242 3.927 -2.653 -12.528 1.00 0.00 H new ATOM 1331 N VAL A 243 -0.753 -0.884 -8.285 1.00 0.00 N ATOM 1332 CA VAL A 243 -2.010 -1.494 -7.885 1.00 0.00 C ATOM 1333 C VAL A 243 -2.860 -1.849 -9.106 1.00 0.00 C ATOM 1334 O VAL A 243 -2.820 -1.165 -10.129 1.00 0.00 O ATOM 1335 CB VAL A 243 -2.793 -0.524 -6.958 1.00 0.00 C ATOM 1336 CG1 VAL A 243 -4.230 -0.985 -6.702 1.00 0.00 C ATOM 1337 CG2 VAL A 243 -2.045 -0.321 -5.643 1.00 0.00 C ATOM 0 H VAL A 243 -0.856 -0.095 -8.923 1.00 0.00 H new ATOM 0 HA VAL A 243 -1.789 -2.414 -7.345 1.00 0.00 H new ATOM 0 HB VAL A 243 -2.860 0.431 -7.479 1.00 0.00 H new ATOM 0 HG11 VAL A 243 -4.730 -0.270 -6.048 1.00 0.00 H new ATOM 0 HG12 VAL A 243 -4.766 -1.048 -7.649 1.00 0.00 H new ATOM 0 HG13 VAL A 243 -4.218 -1.965 -6.226 1.00 0.00 H new ATOM 0 HG21 VAL A 243 -2.608 0.361 -5.006 1.00 0.00 H new ATOM 0 HG22 VAL A 243 -1.932 -1.280 -5.137 1.00 0.00 H new ATOM 0 HG23 VAL A 243 -1.061 0.101 -5.846 1.00 0.00 H new ATOM 1347 N ALA A 244 -3.641 -2.914 -8.973 1.00 0.00 N ATOM 1348 CA ALA A 244 -4.525 -3.362 -10.035 1.00 0.00 C ATOM 1349 C ALA A 244 -5.965 -3.371 -9.537 1.00 0.00 C ATOM 1350 O ALA A 244 -6.249 -3.878 -8.451 1.00 0.00 O ATOM 1351 CB ALA A 244 -4.114 -4.744 -10.518 1.00 0.00 C ATOM 0 H ALA A 244 -3.678 -3.487 -8.130 1.00 0.00 H new ATOM 0 HA ALA A 244 -4.450 -2.673 -10.876 1.00 0.00 H new ATOM 0 HB1 ALA A 244 -4.786 -5.066 -11.314 1.00 0.00 H new ATOM 0 HB2 ALA A 244 -3.093 -4.708 -10.898 1.00 0.00 H new ATOM 0 HB3 ALA A 244 -4.168 -5.450 -9.689 1.00 0.00 H new ATOM 1357 N LYS A 245 -6.873 -2.800 -10.319 1.00 0.00 N ATOM 1358 CA LYS A 245 -8.275 -2.742 -9.927 1.00 0.00 C ATOM 1359 C LYS A 245 -9.055 -3.932 -10.494 1.00 0.00 C ATOM 1360 O LYS A 245 -9.179 -4.068 -11.711 1.00 0.00 O ATOM 1361 CB LYS A 245 -8.904 -1.432 -10.403 1.00 0.00 C ATOM 1362 CG LYS A 245 -8.077 -0.203 -10.063 1.00 0.00 C ATOM 1363 CD LYS A 245 -7.922 -0.032 -8.559 1.00 0.00 C ATOM 1364 CE LYS A 245 -7.613 1.412 -8.184 1.00 0.00 C ATOM 1365 NZ LYS A 245 -8.617 1.964 -7.231 1.00 0.00 N ATOM 0 H LYS A 245 -6.666 -2.373 -11.222 1.00 0.00 H new ATOM 0 HA LYS A 245 -8.323 -2.788 -8.839 1.00 0.00 H new ATOM 0 HB2 LYS A 245 -9.045 -1.478 -11.483 1.00 0.00 H new ATOM 0 HB3 LYS A 245 -9.893 -1.330 -9.956 1.00 0.00 H new ATOM 0 HG2 LYS A 245 -7.093 -0.287 -10.524 1.00 0.00 H new ATOM 0 HG3 LYS A 245 -8.551 0.684 -10.484 1.00 0.00 H new ATOM 0 HD2 LYS A 245 -8.838 -0.349 -8.061 1.00 0.00 H new ATOM 0 HD3 LYS A 245 -7.123 -0.680 -8.200 1.00 0.00 H new ATOM 0 HE2 LYS A 245 -6.620 1.467 -7.738 1.00 0.00 H new ATOM 0 HE3 LYS A 245 -7.592 2.025 -9.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 245 -8.372 2.948 -7.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 245 -9.561 1.935 -7.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 245 -8.619 1.395 -6.361 1.00 0.00 H new ATOM 1379 N PRO A 246 -9.597 -4.816 -9.625 1.00 0.00 N ATOM 1380 CA PRO A 246 -10.360 -5.984 -10.075 1.00 0.00 C ATOM 1381 C PRO A 246 -11.780 -5.618 -10.496 1.00 0.00 C ATOM 1382 O PRO A 246 -12.570 -5.127 -9.689 1.00 0.00 O ATOM 1383 CB PRO A 246 -10.381 -6.878 -8.837 1.00 0.00 C ATOM 1384 CG PRO A 246 -10.349 -5.926 -7.693 1.00 0.00 C ATOM 1385 CD PRO A 246 -9.515 -4.756 -8.146 1.00 0.00 C ATOM 0 HA PRO A 246 -9.918 -6.455 -10.953 1.00 0.00 H new ATOM 0 HB2 PRO A 246 -11.276 -7.500 -8.811 1.00 0.00 H new ATOM 0 HB3 PRO A 246 -9.524 -7.551 -8.818 1.00 0.00 H new ATOM 0 HG2 PRO A 246 -11.356 -5.606 -7.424 1.00 0.00 H new ATOM 0 HG3 PRO A 246 -9.916 -6.394 -6.809 1.00 0.00 H new ATOM 0 HD2 PRO A 246 -9.905 -3.814 -7.761 1.00 0.00 H new ATOM 0 HD3 PRO A 246 -8.485 -4.840 -7.799 1.00 0.00 H new ATOM 1393 N SER A 247 -12.099 -5.858 -11.765 1.00 0.00 N ATOM 1394 CA SER A 247 -13.426 -5.551 -12.293 1.00 0.00 C ATOM 1395 C SER A 247 -14.126 -6.813 -12.782 1.00 0.00 C ATOM 1396 O SER A 247 -13.484 -7.739 -13.277 1.00 0.00 O ATOM 1397 CB SER A 247 -13.320 -4.538 -13.435 1.00 0.00 C ATOM 1398 OG SER A 247 -12.755 -3.318 -12.985 1.00 0.00 O ATOM 0 H SER A 247 -11.458 -6.264 -12.447 1.00 0.00 H new ATOM 0 HA SER A 247 -14.019 -5.121 -11.486 1.00 0.00 H new ATOM 0 HB2 SER A 247 -12.708 -4.952 -14.237 1.00 0.00 H new ATOM 0 HB3 SER A 247 -14.309 -4.352 -13.853 1.00 0.00 H new ATOM 0 HG SER A 247 -12.697 -2.689 -13.734 1.00 0.00 H new ATOM 1404 N ASN A 248 -15.451 -6.839 -12.642 1.00 0.00 N ATOM 1405 CA ASN A 248 -16.256 -7.986 -13.068 1.00 0.00 C ATOM 1406 C ASN A 248 -15.973 -9.209 -12.203 1.00 0.00 C ATOM 1407 O ASN A 248 -16.822 -9.635 -11.419 1.00 0.00 O ATOM 1408 CB ASN A 248 -15.999 -8.312 -14.542 1.00 0.00 C ATOM 1409 CG ASN A 248 -16.146 -7.096 -15.436 1.00 0.00 C ATOM 1410 OD1 ASN A 248 -15.156 -6.495 -15.854 1.00 0.00 O ATOM 1411 ND2 ASN A 248 -17.387 -6.725 -15.733 1.00 0.00 N ATOM 0 H ASN A 248 -15.992 -6.076 -12.235 1.00 0.00 H new ATOM 0 HA ASN A 248 -17.305 -7.716 -12.947 1.00 0.00 H new ATOM 0 HB2 ASN A 248 -14.995 -8.721 -14.651 1.00 0.00 H new ATOM 0 HB3 ASN A 248 -16.695 -9.085 -14.867 1.00 0.00 H new ATOM 0 HD21 ASN A 248 -17.548 -5.913 -16.329 1.00 0.00 H new ATOM 0 HD22 ASN A 248 -18.179 -7.252 -15.365 1.00 0.00 H new ATOM 1418 N ALA A 249 -14.778 -9.771 -12.346 1.00 0.00 N ATOM 1419 CA ALA A 249 -14.389 -10.944 -11.574 1.00 0.00 C ATOM 1420 C ALA A 249 -14.414 -10.647 -10.079 1.00 0.00 C ATOM 1421 O ALA A 249 -14.767 -9.509 -9.709 1.00 0.00 O ATOM 1422 CB ALA A 249 -13.007 -11.420 -11.995 1.00 0.00 C ATOM 1423 OXT ALA A 249 -14.083 -11.557 -9.291 1.00 0.00 O ATOM 0 H ALA A 249 -14.062 -9.433 -12.989 1.00 0.00 H new ATOM 0 HA ALA A 249 -15.110 -11.736 -11.775 1.00 0.00 H new ATOM 0 HB1 ALA A 249 -12.730 -12.297 -11.410 1.00 0.00 H new ATOM 0 HB2 ALA A 249 -13.018 -11.679 -13.054 1.00 0.00 H new ATOM 0 HB3 ALA A 249 -12.281 -10.625 -11.824 1.00 0.00 H new TER 1429 ALA A 249