USER MOD reduce.3.24.130724 H: found=0, std=0, add=555, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 553 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 NoAdj-H: A 147 HIS HE2 : A 147 HIS NE2 : A 187 ZNZN :(H bumps) USER MOD NoAdj-H: A 169 HIS HE2 : A 169 HIS NE2 : A 188 ZNZN :(H bumps) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 SER OG : rot 170:sc= 0.0625 USER MOD Single : A 129 MET CE :methyl 159:sc= -0.596 (180deg=-1.55) USER MOD Single : A 130 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 SER OG : rot -162:sc= 1.19 USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 ASN : amide:sc= -0.876 X(o=-0.88,f=-0.6) USER MOD Single : A 148 HIS : no HD1:sc= -0.143 X(o=-0.14,f=0) USER MOD Single : A 150 LYS NZ :NH3+ -160:sc= 1.19 (180deg=0.559) USER MOD Single : A 153 LYS NZ :NH3+ 169:sc=-0.00552 (180deg=-0.141) USER MOD Single : A 157 GLN : amide:sc= 0.72 K(o=0.72,f=0) USER MOD Single : A 159 LYS NZ :NH3+ 136:sc= 0.452 (180deg=-0.33) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 162 HIS : no HD1:sc= -0.886 K(o=-0.89,f=-1.8) USER MOD Single : A 165 GLN : amide:sc= -0.682 X(o=-0.68,f=-0.88) USER MOD Single : A 166 SER OG : rot 103:sc= 1.42 USER MOD Single : A 168 SER OG : rot 180:sc= -0.078 USER MOD Single : A 170 MET CE :methyl 180:sc= -2.72! (180deg=-2.72!) USER MOD Single : A 173 SER OG : rot -50:sc= 0.0069 USER MOD Single : A 177 LYS NZ :NH3+ -147:sc= 0.0122 (180deg=-0.0239) USER MOD Single : A 179 GLN : amide:sc= -0.4 K(o=-0.4,f=-2.6!) USER MOD Single : A 180 GLN : amide:sc= -0.227 X(o=-0.23,f=-0.63) USER MOD Single : A 183 SER OG : rot 180:sc= -0.19 USER MOD Single : A 185 GLN : amide:sc= 0.741 K(o=0.74,f=-7.3!) USER MOD Single : B 1 A O2' : rot 44:sc= -1.24 USER MOD Single : B 1 A O5' : rot 180:sc= 0 USER MOD Single : B 2 G O2' : rot 50:sc= 1.08 USER MOD Single : B 3 G O2' : rot 180:sc= 0 USER MOD Single : B 4 A O2' : rot 180:sc= -0.0553 USER MOD Single : B 5 G O2' : rot 41:sc= 0.572 USER MOD Single : B 6 A O2' : rot -80:sc= 0.536 USER MOD Single : B 7 U O2' : rot 179:sc= 0 USER MOD Single : B 7 U O3' : rot 132:sc= 0.0988 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 124 18.445 -7.289 8.770 1.00 0.00 N ATOM 2 CA PRO A 124 19.700 -6.573 8.530 1.00 0.00 C ATOM 3 C PRO A 124 19.534 -5.459 7.503 1.00 0.00 C ATOM 4 O PRO A 124 18.671 -5.549 6.630 1.00 0.00 O ATOM 5 CB PRO A 124 20.700 -7.632 8.088 1.00 0.00 C ATOM 6 CG PRO A 124 20.272 -8.869 8.883 1.00 0.00 C ATOM 7 CD PRO A 124 18.903 -8.505 9.455 1.00 0.00 C ATOM 0 HA PRO A 124 20.047 -6.063 9.429 1.00 0.00 H new ATOM 0 HB2 PRO A 124 20.652 -7.807 7.013 1.00 0.00 H new ATOM 0 HB3 PRO A 124 21.725 -7.340 8.318 1.00 0.00 H new ATOM 0 HG2 PRO A 124 20.213 -9.750 8.244 1.00 0.00 H new ATOM 0 HG3 PRO A 124 20.985 -9.097 9.675 1.00 0.00 H new ATOM 0 HD2 PRO A 124 18.195 -9.320 9.303 1.00 0.00 H new ATOM 0 HD3 PRO A 124 18.969 -8.337 10.530 1.00 0.00 H new ATOM 15 N LYS A 125 20.360 -4.415 7.608 1.00 0.00 N ATOM 16 CA LYS A 125 20.312 -3.271 6.706 1.00 0.00 C ATOM 17 C LYS A 125 20.393 -3.712 5.248 1.00 0.00 C ATOM 18 O LYS A 125 20.875 -4.800 4.932 1.00 0.00 O ATOM 19 CB LYS A 125 21.460 -2.315 7.037 1.00 0.00 C ATOM 20 CG LYS A 125 21.269 -1.698 8.426 1.00 0.00 C ATOM 21 CD LYS A 125 22.404 -0.729 8.764 1.00 0.00 C ATOM 22 CE LYS A 125 23.757 -1.440 8.746 1.00 0.00 C ATOM 23 NZ LYS A 125 24.838 -0.536 9.178 1.00 0.00 N ATOM 0 H LYS A 125 21.082 -4.343 8.325 1.00 0.00 H new ATOM 0 HA LYS A 125 19.359 -2.759 6.843 1.00 0.00 H new ATOM 0 HB2 LYS A 125 22.408 -2.851 6.999 1.00 0.00 H new ATOM 0 HB3 LYS A 125 21.510 -1.526 6.287 1.00 0.00 H new ATOM 0 HG2 LYS A 125 20.315 -1.172 8.465 1.00 0.00 H new ATOM 0 HG3 LYS A 125 21.228 -2.489 9.175 1.00 0.00 H new ATOM 0 HD2 LYS A 125 22.411 0.092 8.047 1.00 0.00 H new ATOM 0 HD3 LYS A 125 22.232 -0.292 9.748 1.00 0.00 H new ATOM 0 HE2 LYS A 125 23.723 -2.310 9.402 1.00 0.00 H new ATOM 0 HE3 LYS A 125 23.965 -1.806 7.741 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 25.745 -1.044 9.156 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 24.884 0.282 8.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 24.649 -0.206 10.146 1.00 0.00 H new ATOM 37 N GLY A 126 19.917 -2.849 4.347 1.00 0.00 N ATOM 38 CA GLY A 126 19.914 -3.146 2.920 1.00 0.00 C ATOM 39 C GLY A 126 19.078 -2.170 2.110 1.00 0.00 C ATOM 40 O GLY A 126 19.314 -1.982 0.916 1.00 0.00 O ATOM 0 H GLY A 126 19.528 -1.937 4.586 1.00 0.00 H new ATOM 0 HA2 GLY A 126 20.939 -3.131 2.550 1.00 0.00 H new ATOM 0 HA3 GLY A 126 19.534 -4.156 2.766 1.00 0.00 H new ATOM 44 N LYS A 127 18.098 -1.542 2.766 1.00 0.00 N ATOM 45 CA LYS A 127 17.176 -0.620 2.113 1.00 0.00 C ATOM 46 C LYS A 127 16.986 0.631 2.960 1.00 0.00 C ATOM 47 O LYS A 127 17.175 0.602 4.177 1.00 0.00 O ATOM 48 CB LYS A 127 15.831 -1.319 1.886 1.00 0.00 C ATOM 49 CG LYS A 127 16.007 -2.587 1.039 1.00 0.00 C ATOM 50 CD LYS A 127 14.657 -3.269 0.831 1.00 0.00 C ATOM 51 CE LYS A 127 14.868 -4.590 0.085 1.00 0.00 C ATOM 52 NZ LYS A 127 13.594 -5.306 -0.110 1.00 0.00 N ATOM 0 H LYS A 127 17.925 -1.661 3.764 1.00 0.00 H new ATOM 0 HA LYS A 127 17.592 -0.320 1.151 1.00 0.00 H new ATOM 0 HB2 LYS A 127 15.385 -1.578 2.846 1.00 0.00 H new ATOM 0 HB3 LYS A 127 15.142 -0.637 1.388 1.00 0.00 H new ATOM 0 HG2 LYS A 127 16.447 -2.332 0.075 1.00 0.00 H new ATOM 0 HG3 LYS A 127 16.697 -3.271 1.533 1.00 0.00 H new ATOM 0 HD2 LYS A 127 14.178 -3.453 1.792 1.00 0.00 H new ATOM 0 HD3 LYS A 127 13.992 -2.619 0.263 1.00 0.00 H new ATOM 0 HE2 LYS A 127 15.329 -4.394 -0.883 1.00 0.00 H new ATOM 0 HE3 LYS A 127 15.559 -5.220 0.645 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 13.770 -6.196 -0.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 13.167 -5.514 0.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 12.944 -4.714 -0.665 1.00 0.00 H new ATOM 66 N SER A 128 16.610 1.737 2.313 1.00 0.00 N ATOM 67 CA SER A 128 16.464 3.019 2.991 1.00 0.00 C ATOM 68 C SER A 128 15.656 3.994 2.127 1.00 0.00 C ATOM 69 O SER A 128 15.048 3.589 1.140 1.00 0.00 O ATOM 70 CB SER A 128 17.860 3.567 3.292 1.00 0.00 C ATOM 71 OG SER A 128 17.775 4.684 4.146 1.00 0.00 O ATOM 0 H SER A 128 16.401 1.766 1.315 1.00 0.00 H new ATOM 0 HA SER A 128 15.918 2.890 3.926 1.00 0.00 H new ATOM 0 HB2 SER A 128 18.470 2.792 3.756 1.00 0.00 H new ATOM 0 HB3 SER A 128 18.355 3.848 2.363 1.00 0.00 H new ATOM 0 HG SER A 128 18.672 4.925 4.459 1.00 0.00 H new ATOM 77 N MET A 129 15.650 5.275 2.507 1.00 0.00 N ATOM 78 CA MET A 129 14.917 6.343 1.835 1.00 0.00 C ATOM 79 C MET A 129 15.760 7.616 1.800 1.00 0.00 C ATOM 80 O MET A 129 15.243 8.724 1.951 1.00 0.00 O ATOM 81 CB MET A 129 13.580 6.596 2.540 1.00 0.00 C ATOM 82 CG MET A 129 12.505 5.557 2.238 1.00 0.00 C ATOM 83 SD MET A 129 11.691 5.775 0.637 1.00 0.00 S ATOM 84 CE MET A 129 12.603 4.577 -0.363 1.00 0.00 C ATOM 0 H MET A 129 16.174 5.604 3.318 1.00 0.00 H new ATOM 0 HA MET A 129 14.709 6.038 0.809 1.00 0.00 H new ATOM 0 HB2 MET A 129 13.750 6.624 3.616 1.00 0.00 H new ATOM 0 HB3 MET A 129 13.210 7.579 2.250 1.00 0.00 H new ATOM 0 HG2 MET A 129 12.955 4.565 2.272 1.00 0.00 H new ATOM 0 HG3 MET A 129 11.751 5.592 3.024 1.00 0.00 H new ATOM 0 HE1 MET A 129 12.013 4.311 -1.240 1.00 0.00 H new ATOM 0 HE2 MET A 129 13.549 5.014 -0.681 1.00 0.00 H new ATOM 0 HE3 MET A 129 12.797 3.682 0.228 1.00 0.00 H new ATOM 94 N GLN A 130 17.071 7.471 1.605 1.00 0.00 N ATOM 95 CA GLN A 130 17.968 8.618 1.530 1.00 0.00 C ATOM 96 C GLN A 130 17.787 9.369 0.214 1.00 0.00 C ATOM 97 O GLN A 130 17.183 8.853 -0.725 1.00 0.00 O ATOM 98 CB GLN A 130 19.423 8.166 1.663 1.00 0.00 C ATOM 99 CG GLN A 130 19.661 7.450 2.994 1.00 0.00 C ATOM 100 CD GLN A 130 21.147 7.284 3.277 1.00 0.00 C ATOM 101 OE1 GLN A 130 21.820 8.235 3.672 1.00 0.00 O ATOM 102 NE2 GLN A 130 21.686 6.082 3.078 1.00 0.00 N ATOM 0 H GLN A 130 17.533 6.568 1.496 1.00 0.00 H new ATOM 0 HA GLN A 130 17.721 9.289 2.353 1.00 0.00 H new ATOM 0 HB2 GLN A 130 19.676 7.500 0.838 1.00 0.00 H new ATOM 0 HB3 GLN A 130 20.083 9.030 1.589 1.00 0.00 H new ATOM 0 HG2 GLN A 130 19.196 8.016 3.801 1.00 0.00 H new ATOM 0 HG3 GLN A 130 19.181 6.471 2.973 1.00 0.00 H new ATOM 0 HE21 GLN A 130 21.105 5.310 2.750 1.00 0.00 H new ATOM 0 HE22 GLN A 130 22.680 5.933 3.254 1.00 0.00 H new ATOM 111 N LYS A 131 18.319 10.598 0.156 1.00 0.00 N ATOM 112 CA LYS A 131 18.307 11.499 -0.990 1.00 0.00 C ATOM 113 C LYS A 131 16.917 11.917 -1.490 1.00 0.00 C ATOM 114 O LYS A 131 16.783 12.993 -2.063 1.00 0.00 O ATOM 115 CB LYS A 131 19.154 10.869 -2.097 1.00 0.00 C ATOM 116 CG LYS A 131 19.401 11.816 -3.269 1.00 0.00 C ATOM 117 CD LYS A 131 20.209 13.055 -2.881 1.00 0.00 C ATOM 118 CE LYS A 131 21.572 12.642 -2.325 1.00 0.00 C ATOM 119 NZ LYS A 131 22.399 13.823 -2.021 1.00 0.00 N ATOM 0 H LYS A 131 18.796 11.008 0.959 1.00 0.00 H new ATOM 0 HA LYS A 131 18.736 12.445 -0.661 1.00 0.00 H new ATOM 0 HB2 LYS A 131 20.112 10.556 -1.681 1.00 0.00 H new ATOM 0 HB3 LYS A 131 18.656 9.970 -2.461 1.00 0.00 H new ATOM 0 HG2 LYS A 131 19.928 11.279 -4.057 1.00 0.00 H new ATOM 0 HG3 LYS A 131 18.443 12.130 -3.683 1.00 0.00 H new ATOM 0 HD2 LYS A 131 20.342 13.698 -3.751 1.00 0.00 H new ATOM 0 HD3 LYS A 131 19.664 13.635 -2.136 1.00 0.00 H new ATOM 0 HE2 LYS A 131 21.435 12.047 -1.422 1.00 0.00 H new ATOM 0 HE3 LYS A 131 22.087 12.009 -3.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 23.319 13.515 -1.645 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 22.547 14.376 -2.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 21.916 14.413 -1.314 1.00 0.00 H new ATOM 133 N ARG A 132 15.876 11.100 -1.291 1.00 0.00 N ATOM 134 CA ARG A 132 14.523 11.394 -1.748 1.00 0.00 C ATOM 135 C ARG A 132 13.512 10.770 -0.799 1.00 0.00 C ATOM 136 O ARG A 132 13.792 9.746 -0.176 1.00 0.00 O ATOM 137 CB ARG A 132 14.303 10.806 -3.140 1.00 0.00 C ATOM 138 CG ARG A 132 15.119 11.500 -4.237 1.00 0.00 C ATOM 139 CD ARG A 132 14.685 12.956 -4.399 1.00 0.00 C ATOM 140 NE ARG A 132 15.357 13.576 -5.547 1.00 0.00 N ATOM 141 CZ ARG A 132 16.445 14.350 -5.465 1.00 0.00 C ATOM 142 NH1 ARG A 132 17.037 14.582 -4.295 1.00 0.00 N ATOM 143 NH2 ARG A 132 16.947 14.901 -6.559 1.00 0.00 N ATOM 0 H ARG A 132 15.956 10.208 -0.802 1.00 0.00 H new ATOM 0 HA ARG A 132 14.394 12.476 -1.776 1.00 0.00 H new ATOM 0 HB2 ARG A 132 14.561 9.747 -3.123 1.00 0.00 H new ATOM 0 HB3 ARG A 132 13.244 10.872 -3.390 1.00 0.00 H new ATOM 0 HG2 ARG A 132 16.180 11.458 -3.989 1.00 0.00 H new ATOM 0 HG3 ARG A 132 14.991 10.971 -5.181 1.00 0.00 H new ATOM 0 HD2 ARG A 132 13.605 13.005 -4.534 1.00 0.00 H new ATOM 0 HD3 ARG A 132 14.918 13.513 -3.491 1.00 0.00 H new ATOM 0 HE ARG A 132 14.967 13.404 -6.474 1.00 0.00 H new ATOM 0 HH11 ARG A 132 16.662 14.167 -3.442 1.00 0.00 H new ATOM 0 HH12 ARG A 132 17.866 15.175 -4.252 1.00 0.00 H new ATOM 0 HH21 ARG A 132 16.504 14.735 -7.463 1.00 0.00 H new ATOM 0 HH22 ARG A 132 17.777 15.491 -6.498 1.00 0.00 H new ATOM 157 N ARG A 133 12.330 11.379 -0.678 1.00 0.00 N ATOM 158 CA ARG A 133 11.297 10.902 0.234 1.00 0.00 C ATOM 159 C ARG A 133 10.553 9.684 -0.295 1.00 0.00 C ATOM 160 O ARG A 133 9.611 9.211 0.335 1.00 0.00 O ATOM 161 CB ARG A 133 10.312 12.028 0.559 1.00 0.00 C ATOM 162 CG ARG A 133 10.987 13.288 1.098 1.00 0.00 C ATOM 163 CD ARG A 133 11.837 12.959 2.319 1.00 0.00 C ATOM 164 NE ARG A 133 11.017 12.487 3.436 1.00 0.00 N ATOM 165 CZ ARG A 133 11.478 11.728 4.437 1.00 0.00 C ATOM 166 NH1 ARG A 133 12.746 11.335 4.461 1.00 0.00 N ATOM 167 NH2 ARG A 133 10.667 11.358 5.421 1.00 0.00 N ATOM 0 H ARG A 133 12.067 12.210 -1.207 1.00 0.00 H new ATOM 0 HA ARG A 133 11.805 10.587 1.146 1.00 0.00 H new ATOM 0 HB2 ARG A 133 9.752 12.282 -0.341 1.00 0.00 H new ATOM 0 HB3 ARG A 133 9.591 11.669 1.293 1.00 0.00 H new ATOM 0 HG2 ARG A 133 11.611 13.733 0.323 1.00 0.00 H new ATOM 0 HG3 ARG A 133 10.231 14.027 1.363 1.00 0.00 H new ATOM 0 HD2 ARG A 133 12.570 12.196 2.058 1.00 0.00 H new ATOM 0 HD3 ARG A 133 12.394 13.845 2.625 1.00 0.00 H new ATOM 0 HE ARG A 133 10.033 12.753 3.452 1.00 0.00 H new ATOM 0 HH11 ARG A 133 13.380 11.612 3.711 1.00 0.00 H new ATOM 0 HH12 ARG A 133 13.086 10.757 5.229 1.00 0.00 H new ATOM 0 HH21 ARG A 133 9.690 11.652 5.415 1.00 0.00 H new ATOM 0 HH22 ARG A 133 11.021 10.779 6.183 1.00 0.00 H new ATOM 181 N SER A 134 10.971 9.176 -1.453 1.00 0.00 N ATOM 182 CA SER A 134 10.379 7.987 -2.050 1.00 0.00 C ATOM 183 C SER A 134 11.202 7.474 -3.223 1.00 0.00 C ATOM 184 O SER A 134 11.735 8.265 -4.000 1.00 0.00 O ATOM 185 CB SER A 134 8.977 8.312 -2.565 1.00 0.00 C ATOM 186 OG SER A 134 8.327 7.109 -2.919 1.00 0.00 O ATOM 0 H SER A 134 11.730 9.580 -2.002 1.00 0.00 H new ATOM 0 HA SER A 134 10.346 7.220 -1.277 1.00 0.00 H new ATOM 0 HB2 SER A 134 8.407 8.837 -1.799 1.00 0.00 H new ATOM 0 HB3 SER A 134 9.037 8.975 -3.428 1.00 0.00 H new ATOM 0 HG SER A 134 7.565 7.308 -3.502 1.00 0.00 H new ATOM 192 N LYS A 135 11.294 6.146 -3.339 1.00 0.00 N ATOM 193 CA LYS A 135 11.899 5.430 -4.458 1.00 0.00 C ATOM 194 C LYS A 135 11.236 4.064 -4.539 1.00 0.00 C ATOM 195 O LYS A 135 10.734 3.563 -3.532 1.00 0.00 O ATOM 196 CB LYS A 135 13.409 5.260 -4.248 1.00 0.00 C ATOM 197 CG LYS A 135 14.184 6.472 -4.760 1.00 0.00 C ATOM 198 CD LYS A 135 15.684 6.308 -4.506 1.00 0.00 C ATOM 199 CE LYS A 135 16.287 5.110 -5.237 1.00 0.00 C ATOM 200 NZ LYS A 135 16.421 5.362 -6.681 1.00 0.00 N ATOM 0 H LYS A 135 10.932 5.516 -2.623 1.00 0.00 H new ATOM 0 HA LYS A 135 11.754 5.993 -5.380 1.00 0.00 H new ATOM 0 HB2 LYS A 135 13.616 5.115 -3.188 1.00 0.00 H new ATOM 0 HB3 LYS A 135 13.751 4.363 -4.765 1.00 0.00 H new ATOM 0 HG2 LYS A 135 14.004 6.600 -5.827 1.00 0.00 H new ATOM 0 HG3 LYS A 135 13.824 7.374 -4.266 1.00 0.00 H new ATOM 0 HD2 LYS A 135 16.201 7.215 -4.819 1.00 0.00 H new ATOM 0 HD3 LYS A 135 15.855 6.197 -3.435 1.00 0.00 H new ATOM 0 HE2 LYS A 135 17.266 4.882 -4.815 1.00 0.00 H new ATOM 0 HE3 LYS A 135 15.659 4.233 -5.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 16.834 4.526 -7.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 15.484 5.555 -7.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 17.040 6.183 -6.834 1.00 0.00 H new ATOM 214 N GLY A 136 11.230 3.453 -5.726 1.00 0.00 N ATOM 215 CA GLY A 136 10.563 2.178 -5.930 1.00 0.00 C ATOM 216 C GLY A 136 9.046 2.349 -5.887 1.00 0.00 C ATOM 217 O GLY A 136 8.329 1.410 -5.546 1.00 0.00 O ATOM 0 H GLY A 136 11.683 3.828 -6.560 1.00 0.00 H new ATOM 0 HA2 GLY A 136 10.859 1.757 -6.891 1.00 0.00 H new ATOM 0 HA3 GLY A 136 10.876 1.471 -5.162 1.00 0.00 H new ATOM 221 N ASP A 137 8.562 3.547 -6.226 1.00 0.00 N ATOM 222 CA ASP A 137 7.162 3.938 -6.138 1.00 0.00 C ATOM 223 C ASP A 137 6.203 2.981 -6.841 1.00 0.00 C ATOM 224 O ASP A 137 6.589 2.219 -7.723 1.00 0.00 O ATOM 225 CB ASP A 137 6.999 5.333 -6.728 1.00 0.00 C ATOM 226 CG ASP A 137 7.585 6.389 -5.809 1.00 0.00 C ATOM 227 OD1 ASP A 137 8.817 6.588 -5.870 1.00 0.00 O ATOM 228 OD2 ASP A 137 6.794 6.995 -5.050 1.00 0.00 O ATOM 0 H ASP A 137 9.159 4.294 -6.581 1.00 0.00 H new ATOM 0 HA ASP A 137 6.899 3.914 -5.081 1.00 0.00 H new ATOM 0 HB2 ASP A 137 7.490 5.379 -7.700 1.00 0.00 H new ATOM 0 HB3 ASP A 137 5.942 5.539 -6.895 1.00 0.00 H new ATOM 233 N ARG A 138 4.928 3.042 -6.429 1.00 0.00 N ATOM 234 CA ARG A 138 3.863 2.236 -7.002 1.00 0.00 C ATOM 235 C ARG A 138 2.534 2.986 -7.022 1.00 0.00 C ATOM 236 O ARG A 138 2.313 3.905 -6.235 1.00 0.00 O ATOM 237 CB ARG A 138 3.716 0.932 -6.206 1.00 0.00 C ATOM 238 CG ARG A 138 4.967 0.067 -6.362 1.00 0.00 C ATOM 239 CD ARG A 138 4.783 -1.296 -5.699 1.00 0.00 C ATOM 240 NE ARG A 138 6.084 -1.919 -5.429 1.00 0.00 N ATOM 241 CZ ARG A 138 6.915 -1.521 -4.466 1.00 0.00 C ATOM 242 NH1 ARG A 138 6.583 -0.545 -3.627 1.00 0.00 N ATOM 243 NH2 ARG A 138 8.101 -2.103 -4.339 1.00 0.00 N ATOM 0 H ARG A 138 4.614 3.661 -5.681 1.00 0.00 H new ATOM 0 HA ARG A 138 4.131 2.011 -8.034 1.00 0.00 H new ATOM 0 HB2 ARG A 138 3.552 1.158 -5.152 1.00 0.00 H new ATOM 0 HB3 ARG A 138 2.841 0.383 -6.554 1.00 0.00 H new ATOM 0 HG2 ARG A 138 5.189 -0.068 -7.421 1.00 0.00 H new ATOM 0 HG3 ARG A 138 5.822 0.577 -5.919 1.00 0.00 H new ATOM 0 HD2 ARG A 138 4.228 -1.181 -4.768 1.00 0.00 H new ATOM 0 HD3 ARG A 138 4.191 -1.944 -6.345 1.00 0.00 H new ATOM 0 HE ARG A 138 6.370 -2.704 -6.014 1.00 0.00 H new ATOM 0 HH11 ARG A 138 5.677 -0.085 -3.713 1.00 0.00 H new ATOM 0 HH12 ARG A 138 7.234 -0.256 -2.897 1.00 0.00 H new ATOM 0 HH21 ARG A 138 8.373 -2.851 -4.977 1.00 0.00 H new ATOM 0 HH22 ARG A 138 8.741 -1.802 -3.604 1.00 0.00 H new ATOM 257 N CYS A 139 1.659 2.562 -7.936 1.00 0.00 N ATOM 258 CA CYS A 139 0.296 3.015 -8.115 1.00 0.00 C ATOM 259 C CYS A 139 -0.433 3.048 -6.772 1.00 0.00 C ATOM 260 O CYS A 139 -0.572 2.030 -6.104 1.00 0.00 O ATOM 261 CB CYS A 139 -0.369 2.061 -9.123 1.00 0.00 C ATOM 262 SG CYS A 139 -2.168 2.249 -9.164 1.00 0.00 S ATOM 0 H CYS A 139 1.911 1.842 -8.614 1.00 0.00 H new ATOM 0 HA CYS A 139 0.260 4.033 -8.503 1.00 0.00 H new ATOM 0 HB2 CYS A 139 0.036 2.247 -10.118 1.00 0.00 H new ATOM 0 HB3 CYS A 139 -0.119 1.032 -8.865 1.00 0.00 H new ATOM 267 N TYR A 140 -0.894 4.236 -6.383 1.00 0.00 N ATOM 268 CA TYR A 140 -1.632 4.435 -5.141 1.00 0.00 C ATOM 269 C TYR A 140 -3.042 3.846 -5.217 1.00 0.00 C ATOM 270 O TYR A 140 -3.799 3.953 -4.254 1.00 0.00 O ATOM 271 CB TYR A 140 -1.725 5.933 -4.851 1.00 0.00 C ATOM 272 CG TYR A 140 -0.485 6.585 -4.273 1.00 0.00 C ATOM 273 CD1 TYR A 140 0.703 5.864 -4.070 1.00 0.00 C ATOM 274 CD2 TYR A 140 -0.537 7.943 -3.923 1.00 0.00 C ATOM 275 CE1 TYR A 140 1.819 6.486 -3.495 1.00 0.00 C ATOM 276 CE2 TYR A 140 0.575 8.576 -3.357 1.00 0.00 C ATOM 277 CZ TYR A 140 1.758 7.845 -3.129 1.00 0.00 C ATOM 278 OH TYR A 140 2.840 8.448 -2.560 1.00 0.00 O ATOM 0 H TYR A 140 -0.764 5.090 -6.925 1.00 0.00 H new ATOM 0 HA TYR A 140 -1.097 3.920 -4.342 1.00 0.00 H new ATOM 0 HB2 TYR A 140 -1.980 6.446 -5.779 1.00 0.00 H new ATOM 0 HB3 TYR A 140 -2.551 6.097 -4.159 1.00 0.00 H new ATOM 0 HD1 TYR A 140 0.757 4.825 -4.359 1.00 0.00 H new ATOM 0 HD2 TYR A 140 -1.444 8.505 -4.092 1.00 0.00 H new ATOM 0 HE1 TYR A 140 2.726 5.923 -3.332 1.00 0.00 H new ATOM 0 HE2 TYR A 140 0.527 9.623 -3.095 1.00 0.00 H new ATOM 0 HH TYR A 140 2.630 9.386 -2.370 1.00 0.00 H new ATOM 288 N ASN A 141 -3.412 3.221 -6.339 1.00 0.00 N ATOM 289 CA ASN A 141 -4.761 2.712 -6.521 1.00 0.00 C ATOM 290 C ASN A 141 -4.791 1.185 -6.551 1.00 0.00 C ATOM 291 O ASN A 141 -5.764 0.605 -6.094 1.00 0.00 O ATOM 292 CB ASN A 141 -5.335 3.297 -7.814 1.00 0.00 C ATOM 293 CG ASN A 141 -6.786 2.908 -8.023 1.00 0.00 C ATOM 294 OD1 ASN A 141 -7.687 3.682 -7.713 1.00 0.00 O ATOM 295 ND2 ASN A 141 -7.038 1.715 -8.550 1.00 0.00 N ATOM 0 H ASN A 141 -2.791 3.059 -7.131 1.00 0.00 H new ATOM 0 HA ASN A 141 -5.373 3.019 -5.673 1.00 0.00 H new ATOM 0 HB2 ASN A 141 -5.252 4.384 -7.788 1.00 0.00 H new ATOM 0 HB3 ASN A 141 -4.742 2.952 -8.661 1.00 0.00 H new ATOM 0 HD21 ASN A 141 -8.002 1.420 -8.707 1.00 0.00 H new ATOM 0 HD22 ASN A 141 -6.268 1.094 -8.797 1.00 0.00 H new ATOM 302 N CYS A 142 -3.752 0.539 -7.082 1.00 0.00 N ATOM 303 CA CYS A 142 -3.698 -0.908 -7.130 1.00 0.00 C ATOM 304 C CYS A 142 -2.469 -1.438 -6.402 1.00 0.00 C ATOM 305 O CYS A 142 -2.534 -2.452 -5.707 1.00 0.00 O ATOM 306 CB CYS A 142 -3.776 -1.354 -8.588 1.00 0.00 C ATOM 307 SG CYS A 142 -2.178 -1.145 -9.400 1.00 0.00 S ATOM 0 H CYS A 142 -2.938 1.004 -7.484 1.00 0.00 H new ATOM 0 HA CYS A 142 -4.551 -1.334 -6.602 1.00 0.00 H new ATOM 0 HB2 CYS A 142 -4.082 -2.399 -8.639 1.00 0.00 H new ATOM 0 HB3 CYS A 142 -4.535 -0.773 -9.112 1.00 0.00 H new ATOM 312 N GLY A 143 -1.344 -0.739 -6.571 1.00 0.00 N ATOM 313 CA GLY A 143 -0.075 -1.118 -5.979 1.00 0.00 C ATOM 314 C GLY A 143 0.911 -1.604 -7.035 1.00 0.00 C ATOM 315 O GLY A 143 1.934 -2.197 -6.694 1.00 0.00 O ATOM 0 H GLY A 143 -1.296 0.113 -7.130 1.00 0.00 H new ATOM 0 HA2 GLY A 143 0.349 -0.266 -5.448 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -0.237 -1.904 -5.241 1.00 0.00 H new ATOM 319 N GLY A 144 0.619 -1.359 -8.322 1.00 0.00 N ATOM 320 CA GLY A 144 1.500 -1.726 -9.414 1.00 0.00 C ATOM 321 C GLY A 144 2.663 -0.759 -9.531 1.00 0.00 C ATOM 322 O GLY A 144 2.647 0.306 -8.928 1.00 0.00 O ATOM 0 H GLY A 144 -0.240 -0.899 -8.623 1.00 0.00 H new ATOM 0 HA2 GLY A 144 1.878 -2.736 -9.256 1.00 0.00 H new ATOM 0 HA3 GLY A 144 0.939 -1.739 -10.348 1.00 0.00 H new ATOM 326 N LEU A 145 3.686 -1.115 -10.303 1.00 0.00 N ATOM 327 CA LEU A 145 4.902 -0.320 -10.409 1.00 0.00 C ATOM 328 C LEU A 145 5.095 0.208 -11.828 1.00 0.00 C ATOM 329 O LEU A 145 5.776 1.211 -12.035 1.00 0.00 O ATOM 330 CB LEU A 145 6.135 -1.136 -10.010 1.00 0.00 C ATOM 331 CG LEU A 145 5.917 -2.652 -10.012 1.00 0.00 C ATOM 332 CD1 LEU A 145 7.262 -3.360 -10.043 1.00 0.00 C ATOM 333 CD2 LEU A 145 5.200 -3.075 -8.729 1.00 0.00 C ATOM 0 H LEU A 145 3.694 -1.962 -10.871 1.00 0.00 H new ATOM 0 HA LEU A 145 4.791 0.521 -9.724 1.00 0.00 H new ATOM 0 HB2 LEU A 145 6.950 -0.897 -10.693 1.00 0.00 H new ATOM 0 HB3 LEU A 145 6.453 -0.828 -9.014 1.00 0.00 H new ATOM 0 HG LEU A 145 5.322 -2.916 -10.886 1.00 0.00 H new ATOM 0 HD11 LEU A 145 7.105 -4.439 -10.044 1.00 0.00 H new ATOM 0 HD12 LEU A 145 7.805 -3.071 -10.943 1.00 0.00 H new ATOM 0 HD13 LEU A 145 7.842 -3.079 -9.164 1.00 0.00 H new ATOM 0 HD21 LEU A 145 5.048 -4.154 -8.736 1.00 0.00 H new ATOM 0 HD22 LEU A 145 5.806 -2.800 -7.866 1.00 0.00 H new ATOM 0 HD23 LEU A 145 4.234 -2.573 -8.669 1.00 0.00 H new ATOM 345 N ASP A 146 4.498 -0.470 -12.801 1.00 0.00 N ATOM 346 CA ASP A 146 4.610 -0.124 -14.203 1.00 0.00 C ATOM 347 C ASP A 146 3.744 1.085 -14.564 1.00 0.00 C ATOM 348 O ASP A 146 3.767 1.548 -15.707 1.00 0.00 O ATOM 349 CB ASP A 146 4.192 -1.361 -14.999 1.00 0.00 C ATOM 350 CG ASP A 146 4.281 -1.147 -16.502 1.00 0.00 C ATOM 351 OD1 ASP A 146 5.420 -1.139 -17.010 1.00 0.00 O ATOM 352 OD2 ASP A 146 3.212 -0.994 -17.131 1.00 0.00 O ATOM 0 H ASP A 146 3.914 -1.288 -12.630 1.00 0.00 H new ATOM 0 HA ASP A 146 5.634 0.164 -14.439 1.00 0.00 H new ATOM 0 HB2 ASP A 146 4.827 -2.201 -14.717 1.00 0.00 H new ATOM 0 HB3 ASP A 146 3.170 -1.631 -14.734 1.00 0.00 H new ATOM 357 N HIS A 147 2.978 1.607 -13.598 1.00 0.00 N ATOM 358 CA HIS A 147 2.053 2.708 -13.828 1.00 0.00 C ATOM 359 C HIS A 147 1.749 3.458 -12.529 1.00 0.00 C ATOM 360 O HIS A 147 2.360 3.189 -11.493 1.00 0.00 O ATOM 361 CB HIS A 147 0.769 2.128 -14.427 1.00 0.00 C ATOM 362 CG HIS A 147 0.056 1.190 -13.492 1.00 0.00 C ATOM 363 ND1 HIS A 147 0.334 -0.141 -13.293 1.00 0.00 N ATOM 364 CD2 HIS A 147 -0.997 1.505 -12.672 1.00 0.00 C ATOM 365 CE1 HIS A 147 -0.522 -0.609 -12.370 1.00 0.00 C ATOM 366 NE2 HIS A 147 -1.368 0.357 -11.964 1.00 0.00 N ATOM 0 H HIS A 147 2.987 1.272 -12.635 1.00 0.00 H new ATOM 0 HA HIS A 147 2.501 3.427 -14.514 1.00 0.00 H new ATOM 0 HB2 HIS A 147 0.098 2.945 -14.695 1.00 0.00 H new ATOM 0 HB3 HIS A 147 1.011 1.599 -15.349 1.00 0.00 H new ATOM 0 HD1 HIS A 147 1.062 -0.679 -13.763 1.00 0.00 H new ATOM 0 HD2 HIS A 147 -1.462 2.476 -12.587 1.00 0.00 H new ATOM 0 HE1 HIS A 147 -0.531 -1.624 -12.002 1.00 0.00 H new ATOM 374 N HIS A 148 0.805 4.403 -12.585 1.00 0.00 N ATOM 375 CA HIS A 148 0.366 5.176 -11.431 1.00 0.00 C ATOM 376 C HIS A 148 -1.160 5.155 -11.327 1.00 0.00 C ATOM 377 O HIS A 148 -1.846 4.713 -12.247 1.00 0.00 O ATOM 378 CB HIS A 148 0.872 6.610 -11.555 1.00 0.00 C ATOM 379 CG HIS A 148 2.355 6.762 -11.339 1.00 0.00 C ATOM 380 ND1 HIS A 148 3.192 7.580 -12.103 1.00 0.00 N ATOM 381 CD2 HIS A 148 3.093 6.144 -10.367 1.00 0.00 C ATOM 382 CE1 HIS A 148 4.409 7.435 -11.571 1.00 0.00 C ATOM 383 NE2 HIS A 148 4.384 6.576 -10.534 1.00 0.00 N ATOM 0 H HIS A 148 0.321 4.652 -13.448 1.00 0.00 H new ATOM 0 HA HIS A 148 0.776 4.731 -10.525 1.00 0.00 H new ATOM 0 HB2 HIS A 148 0.620 6.988 -12.546 1.00 0.00 H new ATOM 0 HB3 HIS A 148 0.345 7.233 -10.832 1.00 0.00 H new ATOM 0 HD2 HIS A 148 2.732 5.454 -9.618 1.00 0.00 H new ATOM 0 HE1 HIS A 148 5.295 7.940 -11.926 1.00 0.00 H new ATOM 0 HE2 HIS A 148 5.186 6.295 -9.970 1.00 0.00 H new ATOM 391 N ALA A 149 -1.691 5.643 -10.209 1.00 0.00 N ATOM 392 CA ALA A 149 -3.113 5.572 -9.881 1.00 0.00 C ATOM 393 C ALA A 149 -4.029 6.171 -10.950 1.00 0.00 C ATOM 394 O ALA A 149 -5.142 5.681 -11.123 1.00 0.00 O ATOM 395 CB ALA A 149 -3.334 6.284 -8.549 1.00 0.00 C ATOM 0 H ALA A 149 -1.135 6.108 -9.492 1.00 0.00 H new ATOM 0 HA ALA A 149 -3.380 4.517 -9.822 1.00 0.00 H new ATOM 0 HB1 ALA A 149 -4.391 6.243 -8.285 1.00 0.00 H new ATOM 0 HB2 ALA A 149 -2.747 5.794 -7.773 1.00 0.00 H new ATOM 0 HB3 ALA A 149 -3.023 7.325 -8.637 1.00 0.00 H new ATOM 401 N LYS A 150 -3.585 7.210 -11.668 1.00 0.00 N ATOM 402 CA LYS A 150 -4.394 7.818 -12.716 1.00 0.00 C ATOM 403 C LYS A 150 -4.373 6.992 -14.002 1.00 0.00 C ATOM 404 O LYS A 150 -5.216 7.183 -14.876 1.00 0.00 O ATOM 405 CB LYS A 150 -3.934 9.245 -13.019 1.00 0.00 C ATOM 406 CG LYS A 150 -2.534 9.360 -13.629 1.00 0.00 C ATOM 407 CD LYS A 150 -1.382 9.190 -12.630 1.00 0.00 C ATOM 408 CE LYS A 150 -1.474 10.197 -11.486 1.00 0.00 C ATOM 409 NZ LYS A 150 -1.449 11.582 -11.987 1.00 0.00 N ATOM 0 H LYS A 150 -2.670 7.642 -11.538 1.00 0.00 H new ATOM 0 HA LYS A 150 -5.417 7.847 -12.340 1.00 0.00 H new ATOM 0 HB2 LYS A 150 -4.650 9.704 -13.701 1.00 0.00 H new ATOM 0 HB3 LYS A 150 -3.959 9.822 -12.095 1.00 0.00 H new ATOM 0 HG2 LYS A 150 -2.431 8.609 -14.412 1.00 0.00 H new ATOM 0 HG3 LYS A 150 -2.440 10.335 -14.108 1.00 0.00 H new ATOM 0 HD2 LYS A 150 -1.397 8.178 -12.226 1.00 0.00 H new ATOM 0 HD3 LYS A 150 -0.430 9.313 -13.147 1.00 0.00 H new ATOM 0 HE2 LYS A 150 -2.392 10.028 -10.924 1.00 0.00 H new ATOM 0 HE3 LYS A 150 -0.645 10.043 -10.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 -1.174 12.225 -11.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 -0.761 11.658 -12.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 -2.394 11.842 -12.335 1.00 0.00 H new ATOM 423 N GLU A 151 -3.410 6.077 -14.103 1.00 0.00 N ATOM 424 CA GLU A 151 -3.261 5.182 -15.244 1.00 0.00 C ATOM 425 C GLU A 151 -3.821 3.803 -14.922 1.00 0.00 C ATOM 426 O GLU A 151 -3.907 2.948 -15.803 1.00 0.00 O ATOM 427 CB GLU A 151 -1.782 5.021 -15.588 1.00 0.00 C ATOM 428 CG GLU A 151 -1.031 6.346 -15.600 1.00 0.00 C ATOM 429 CD GLU A 151 0.391 6.145 -16.103 1.00 0.00 C ATOM 430 OE1 GLU A 151 1.167 5.484 -15.378 1.00 0.00 O ATOM 431 OE2 GLU A 151 0.700 6.647 -17.209 1.00 0.00 O ATOM 0 H GLU A 151 -2.702 5.936 -13.382 1.00 0.00 H new ATOM 0 HA GLU A 151 -3.805 5.615 -16.083 1.00 0.00 H new ATOM 0 HB2 GLU A 151 -1.316 4.351 -14.865 1.00 0.00 H new ATOM 0 HB3 GLU A 151 -1.691 4.548 -16.566 1.00 0.00 H new ATOM 0 HG2 GLU A 151 -1.551 7.061 -16.238 1.00 0.00 H new ATOM 0 HG3 GLU A 151 -1.012 6.770 -14.596 1.00 0.00 H new ATOM 438 N CYS A 152 -4.202 3.593 -13.657 1.00 0.00 N ATOM 439 CA CYS A 152 -4.744 2.336 -13.193 1.00 0.00 C ATOM 440 C CYS A 152 -6.030 1.999 -13.944 1.00 0.00 C ATOM 441 O CYS A 152 -6.627 2.863 -14.582 1.00 0.00 O ATOM 442 CB CYS A 152 -4.956 2.421 -11.683 1.00 0.00 C ATOM 443 SG CYS A 152 -4.783 0.752 -11.018 1.00 0.00 S ATOM 0 H CYS A 152 -4.137 4.305 -12.929 1.00 0.00 H new ATOM 0 HA CYS A 152 -4.046 1.524 -13.396 1.00 0.00 H new ATOM 0 HB2 CYS A 152 -4.226 3.092 -11.230 1.00 0.00 H new ATOM 0 HB3 CYS A 152 -5.943 2.824 -11.456 1.00 0.00 H new ATOM 448 N LYS A 153 -6.463 0.737 -13.864 1.00 0.00 N ATOM 449 CA LYS A 153 -7.615 0.261 -14.616 1.00 0.00 C ATOM 450 C LYS A 153 -8.594 -0.555 -13.777 1.00 0.00 C ATOM 451 O LYS A 153 -9.557 -1.109 -14.310 1.00 0.00 O ATOM 452 CB LYS A 153 -7.141 -0.520 -15.842 1.00 0.00 C ATOM 453 CG LYS A 153 -5.959 -1.448 -15.576 1.00 0.00 C ATOM 454 CD LYS A 153 -6.297 -2.576 -14.612 1.00 0.00 C ATOM 455 CE LYS A 153 -7.431 -3.442 -15.147 1.00 0.00 C ATOM 456 NZ LYS A 153 -7.071 -4.108 -16.410 1.00 0.00 N ATOM 0 H LYS A 153 -6.025 0.026 -13.279 1.00 0.00 H new ATOM 0 HA LYS A 153 -8.176 1.138 -14.939 1.00 0.00 H new ATOM 0 HB2 LYS A 153 -7.973 -1.111 -16.226 1.00 0.00 H new ATOM 0 HB3 LYS A 153 -6.864 0.187 -16.624 1.00 0.00 H new ATOM 0 HG2 LYS A 153 -5.618 -1.873 -16.520 1.00 0.00 H new ATOM 0 HG3 LYS A 153 -5.131 -0.866 -15.171 1.00 0.00 H new ATOM 0 HD2 LYS A 153 -5.413 -3.192 -14.446 1.00 0.00 H new ATOM 0 HD3 LYS A 153 -6.580 -2.159 -13.646 1.00 0.00 H new ATOM 0 HE2 LYS A 153 -7.694 -4.194 -14.403 1.00 0.00 H new ATOM 0 HE3 LYS A 153 -8.316 -2.825 -15.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 153 -7.788 -4.825 -16.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 153 -7.027 -3.403 -17.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 153 -6.143 -4.567 -16.308 1.00 0.00 H new ATOM 470 N LEU A 154 -8.352 -0.630 -12.471 1.00 0.00 N ATOM 471 CA LEU A 154 -9.255 -1.268 -11.529 1.00 0.00 C ATOM 472 C LEU A 154 -9.729 -0.238 -10.499 1.00 0.00 C ATOM 473 O LEU A 154 -9.141 0.843 -10.402 1.00 0.00 O ATOM 474 CB LEU A 154 -8.576 -2.518 -10.934 1.00 0.00 C ATOM 475 CG LEU A 154 -7.125 -2.308 -10.522 1.00 0.00 C ATOM 476 CD1 LEU A 154 -7.107 -1.344 -9.354 1.00 0.00 C ATOM 477 CD2 LEU A 154 -6.521 -3.627 -10.062 1.00 0.00 C ATOM 0 H LEU A 154 -7.514 -0.244 -12.037 1.00 0.00 H new ATOM 0 HA LEU A 154 -10.158 -1.629 -12.021 1.00 0.00 H new ATOM 0 HB2 LEU A 154 -9.144 -2.846 -10.064 1.00 0.00 H new ATOM 0 HB3 LEU A 154 -8.620 -3.324 -11.666 1.00 0.00 H new ATOM 0 HG LEU A 154 -6.553 -1.921 -11.366 1.00 0.00 H new ATOM 0 HD11 LEU A 154 -6.078 -1.175 -9.038 1.00 0.00 H new ATOM 0 HD12 LEU A 154 -7.554 -0.397 -9.657 1.00 0.00 H new ATOM 0 HD13 LEU A 154 -7.677 -1.765 -8.526 1.00 0.00 H new ATOM 0 HD21 LEU A 154 -5.483 -3.469 -9.769 1.00 0.00 H new ATOM 0 HD22 LEU A 154 -7.085 -4.008 -9.210 1.00 0.00 H new ATOM 0 HD23 LEU A 154 -6.562 -4.350 -10.877 1.00 0.00 H new ATOM 489 N PRO A 155 -10.781 -0.544 -9.724 1.00 0.00 N ATOM 490 CA PRO A 155 -11.321 0.358 -8.719 1.00 0.00 C ATOM 491 C PRO A 155 -10.304 0.541 -7.591 1.00 0.00 C ATOM 492 O PRO A 155 -9.318 -0.192 -7.542 1.00 0.00 O ATOM 493 CB PRO A 155 -12.610 -0.304 -8.228 1.00 0.00 C ATOM 494 CG PRO A 155 -12.390 -1.787 -8.516 1.00 0.00 C ATOM 495 CD PRO A 155 -11.528 -1.784 -9.781 1.00 0.00 C ATOM 0 HA PRO A 155 -11.528 1.354 -9.111 1.00 0.00 H new ATOM 0 HB2 PRO A 155 -12.773 -0.123 -7.166 1.00 0.00 H new ATOM 0 HB3 PRO A 155 -13.483 0.081 -8.755 1.00 0.00 H new ATOM 0 HG2 PRO A 155 -11.886 -2.286 -7.688 1.00 0.00 H new ATOM 0 HG3 PRO A 155 -13.334 -2.309 -8.675 1.00 0.00 H new ATOM 0 HD2 PRO A 155 -10.861 -2.646 -9.806 1.00 0.00 H new ATOM 0 HD3 PRO A 155 -12.145 -1.832 -10.679 1.00 0.00 H new ATOM 503 N PRO A 156 -10.515 1.495 -6.679 1.00 0.00 N ATOM 504 CA PRO A 156 -9.539 1.795 -5.649 1.00 0.00 C ATOM 505 C PRO A 156 -9.338 0.606 -4.713 1.00 0.00 C ATOM 506 O PRO A 156 -10.150 0.353 -3.826 1.00 0.00 O ATOM 507 CB PRO A 156 -10.070 3.036 -4.925 1.00 0.00 C ATOM 508 CG PRO A 156 -11.573 3.010 -5.204 1.00 0.00 C ATOM 509 CD PRO A 156 -11.680 2.355 -6.580 1.00 0.00 C ATOM 0 HA PRO A 156 -8.551 1.990 -6.067 1.00 0.00 H new ATOM 0 HB2 PRO A 156 -9.861 2.995 -3.856 1.00 0.00 H new ATOM 0 HB3 PRO A 156 -9.609 3.948 -5.305 1.00 0.00 H new ATOM 0 HG2 PRO A 156 -12.110 2.439 -4.447 1.00 0.00 H new ATOM 0 HG3 PRO A 156 -11.996 4.014 -5.206 1.00 0.00 H new ATOM 0 HD2 PRO A 156 -12.602 1.782 -6.674 1.00 0.00 H new ATOM 0 HD3 PRO A 156 -11.687 3.102 -7.373 1.00 0.00 H new ATOM 517 N GLN A 157 -8.240 -0.123 -4.925 1.00 0.00 N ATOM 518 CA GLN A 157 -7.837 -1.215 -4.052 1.00 0.00 C ATOM 519 C GLN A 157 -7.288 -0.621 -2.758 1.00 0.00 C ATOM 520 O GLN A 157 -6.966 0.567 -2.713 1.00 0.00 O ATOM 521 CB GLN A 157 -6.725 -2.022 -4.721 1.00 0.00 C ATOM 522 CG GLN A 157 -7.082 -2.431 -6.144 1.00 0.00 C ATOM 523 CD GLN A 157 -8.288 -3.356 -6.192 1.00 0.00 C ATOM 524 OE1 GLN A 157 -8.286 -4.435 -5.609 1.00 0.00 O ATOM 525 NE2 GLN A 157 -9.334 -2.940 -6.893 1.00 0.00 N ATOM 0 H GLN A 157 -7.608 0.032 -5.710 1.00 0.00 H new ATOM 0 HA GLN A 157 -8.692 -1.860 -3.852 1.00 0.00 H new ATOM 0 HB2 GLN A 157 -5.809 -1.432 -4.734 1.00 0.00 H new ATOM 0 HB3 GLN A 157 -6.521 -2.914 -4.129 1.00 0.00 H new ATOM 0 HG2 GLN A 157 -7.287 -1.539 -6.736 1.00 0.00 H new ATOM 0 HG3 GLN A 157 -6.227 -2.928 -6.602 1.00 0.00 H new ATOM 0 HE21 GLN A 157 -9.304 -2.037 -7.366 1.00 0.00 H new ATOM 0 HE22 GLN A 157 -10.168 -3.523 -6.959 1.00 0.00 H new ATOM 534 N PRO A 158 -7.166 -1.421 -1.697 1.00 0.00 N ATOM 535 CA PRO A 158 -6.511 -0.971 -0.489 1.00 0.00 C ATOM 536 C PRO A 158 -5.023 -0.845 -0.779 1.00 0.00 C ATOM 537 O PRO A 158 -4.384 -1.784 -1.252 1.00 0.00 O ATOM 538 CB PRO A 158 -6.832 -2.031 0.557 1.00 0.00 C ATOM 539 CG PRO A 158 -7.062 -3.302 -0.267 1.00 0.00 C ATOM 540 CD PRO A 158 -7.619 -2.794 -1.596 1.00 0.00 C ATOM 0 HA PRO A 158 -6.843 0.004 -0.131 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -6.012 -2.156 1.264 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -7.716 -1.765 1.137 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -6.135 -3.857 -0.410 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -7.763 -3.975 0.227 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -7.253 -3.392 -2.431 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -8.707 -2.852 -1.615 1.00 0.00 H new ATOM 548 N LYS A 159 -4.468 0.331 -0.487 1.00 0.00 N ATOM 549 CA LYS A 159 -3.058 0.608 -0.711 1.00 0.00 C ATOM 550 C LYS A 159 -2.243 -0.107 0.358 1.00 0.00 C ATOM 551 O LYS A 159 -2.271 0.270 1.529 1.00 0.00 O ATOM 552 CB LYS A 159 -2.777 2.115 -0.763 1.00 0.00 C ATOM 553 CG LYS A 159 -3.455 2.934 0.332 1.00 0.00 C ATOM 554 CD LYS A 159 -2.944 4.379 0.296 1.00 0.00 C ATOM 555 CE LYS A 159 -2.127 4.669 1.554 1.00 0.00 C ATOM 556 NZ LYS A 159 -2.981 4.657 2.758 1.00 0.00 N ATOM 0 H LYS A 159 -4.986 1.114 -0.089 1.00 0.00 H new ATOM 0 HA LYS A 159 -2.760 0.225 -1.687 1.00 0.00 H new ATOM 0 HB2 LYS A 159 -1.700 2.271 -0.699 1.00 0.00 H new ATOM 0 HB3 LYS A 159 -3.097 2.496 -1.733 1.00 0.00 H new ATOM 0 HG2 LYS A 159 -4.536 2.918 0.193 1.00 0.00 H new ATOM 0 HG3 LYS A 159 -3.252 2.492 1.307 1.00 0.00 H new ATOM 0 HD2 LYS A 159 -2.331 4.536 -0.591 1.00 0.00 H new ATOM 0 HD3 LYS A 159 -3.784 5.070 0.229 1.00 0.00 H new ATOM 0 HE2 LYS A 159 -1.337 3.925 1.658 1.00 0.00 H new ATOM 0 HE3 LYS A 159 -1.640 5.640 1.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 159 -2.502 4.134 3.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 159 -3.158 5.634 3.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 159 -3.886 4.195 2.537 1.00 0.00 H new ATOM 570 N LYS A 160 -1.519 -1.145 -0.061 1.00 0.00 N ATOM 571 CA LYS A 160 -0.744 -1.986 0.837 1.00 0.00 C ATOM 572 C LYS A 160 0.600 -1.351 1.158 1.00 0.00 C ATOM 573 O LYS A 160 1.027 -0.391 0.511 1.00 0.00 O ATOM 574 CB LYS A 160 -0.499 -3.334 0.160 1.00 0.00 C ATOM 575 CG LYS A 160 -1.806 -4.056 -0.130 1.00 0.00 C ATOM 576 CD LYS A 160 -1.647 -5.069 -1.254 1.00 0.00 C ATOM 577 CE LYS A 160 -3.030 -5.248 -1.880 1.00 0.00 C ATOM 578 NZ LYS A 160 -2.994 -6.172 -3.026 1.00 0.00 N ATOM 0 H LYS A 160 -1.457 -1.424 -1.040 1.00 0.00 H new ATOM 0 HA LYS A 160 -1.302 -2.110 1.765 1.00 0.00 H new ATOM 0 HB2 LYS A 160 0.048 -3.181 -0.770 1.00 0.00 H new ATOM 0 HB3 LYS A 160 0.127 -3.956 0.800 1.00 0.00 H new ATOM 0 HG2 LYS A 160 -2.151 -4.563 0.771 1.00 0.00 H new ATOM 0 HG3 LYS A 160 -2.572 -3.329 -0.400 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -0.929 -4.716 -1.995 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -1.270 -6.017 -0.871 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -3.723 -5.627 -1.129 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -3.410 -4.280 -2.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -3.950 -6.268 -3.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -2.352 -5.798 -3.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -2.655 -7.103 -2.711 1.00 0.00 H new ATOM 592 N CYS A 161 1.259 -1.907 2.174 1.00 0.00 N ATOM 593 CA CYS A 161 2.621 -1.573 2.536 1.00 0.00 C ATOM 594 C CYS A 161 3.539 -1.795 1.330 1.00 0.00 C ATOM 595 O CYS A 161 3.523 -2.871 0.734 1.00 0.00 O ATOM 596 CB CYS A 161 2.977 -2.474 3.718 1.00 0.00 C ATOM 597 SG CYS A 161 4.701 -2.277 4.206 1.00 0.00 S ATOM 0 H CYS A 161 0.844 -2.617 2.777 1.00 0.00 H new ATOM 0 HA CYS A 161 2.738 -0.528 2.822 1.00 0.00 H new ATOM 0 HB2 CYS A 161 2.330 -2.239 4.563 1.00 0.00 H new ATOM 0 HB3 CYS A 161 2.790 -3.514 3.453 1.00 0.00 H new ATOM 602 N HIS A 162 4.335 -0.789 0.963 1.00 0.00 N ATOM 603 CA HIS A 162 5.296 -0.887 -0.125 1.00 0.00 C ATOM 604 C HIS A 162 6.441 -1.832 0.237 1.00 0.00 C ATOM 605 O HIS A 162 7.427 -1.907 -0.490 1.00 0.00 O ATOM 606 CB HIS A 162 5.898 0.494 -0.415 1.00 0.00 C ATOM 607 CG HIS A 162 4.977 1.441 -1.129 1.00 0.00 C ATOM 608 ND1 HIS A 162 4.122 1.115 -2.185 1.00 0.00 N ATOM 609 CD2 HIS A 162 4.866 2.770 -0.845 1.00 0.00 C ATOM 610 CE1 HIS A 162 3.523 2.275 -2.513 1.00 0.00 C ATOM 611 NE2 HIS A 162 3.946 3.281 -1.726 1.00 0.00 N ATOM 0 H HIS A 162 4.327 0.123 1.420 1.00 0.00 H new ATOM 0 HA HIS A 162 4.768 -1.270 -0.998 1.00 0.00 H new ATOM 0 HB2 HIS A 162 6.204 0.947 0.528 1.00 0.00 H new ATOM 0 HB3 HIS A 162 6.799 0.364 -1.014 1.00 0.00 H new ATOM 0 HD2 HIS A 162 5.397 3.314 -0.078 1.00 0.00 H new ATOM 0 HE1 HIS A 162 2.797 2.384 -3.305 1.00 0.00 H new ATOM 0 HE2 HIS A 162 3.637 4.252 -1.775 1.00 0.00 H new ATOM 619 N PHE A 163 6.325 -2.552 1.353 1.00 0.00 N ATOM 620 CA PHE A 163 7.452 -3.279 1.904 1.00 0.00 C ATOM 621 C PHE A 163 7.117 -4.726 2.242 1.00 0.00 C ATOM 622 O PHE A 163 7.979 -5.600 2.130 1.00 0.00 O ATOM 623 CB PHE A 163 7.836 -2.518 3.164 1.00 0.00 C ATOM 624 CG PHE A 163 9.255 -2.683 3.629 1.00 0.00 C ATOM 625 CD1 PHE A 163 9.652 -3.871 4.250 1.00 0.00 C ATOM 626 CD2 PHE A 163 10.158 -1.632 3.450 1.00 0.00 C ATOM 627 CE1 PHE A 163 10.984 -4.010 4.673 1.00 0.00 C ATOM 628 CE2 PHE A 163 11.480 -1.762 3.882 1.00 0.00 C ATOM 629 CZ PHE A 163 11.890 -2.955 4.483 1.00 0.00 C ATOM 0 H PHE A 163 5.461 -2.643 1.887 1.00 0.00 H new ATOM 0 HA PHE A 163 8.261 -3.335 1.176 1.00 0.00 H new ATOM 0 HB2 PHE A 163 7.652 -1.457 2.994 1.00 0.00 H new ATOM 0 HB3 PHE A 163 7.172 -2.831 3.970 1.00 0.00 H new ATOM 0 HD1 PHE A 163 8.943 -4.672 4.402 1.00 0.00 H new ATOM 0 HD2 PHE A 163 9.833 -0.717 2.977 1.00 0.00 H new ATOM 0 HE1 PHE A 163 11.310 -4.926 5.143 1.00 0.00 H new ATOM 0 HE2 PHE A 163 12.178 -0.948 3.753 1.00 0.00 H new ATOM 0 HZ PHE A 163 12.915 -3.066 4.805 1.00 0.00 H new ATOM 639 N CYS A 164 5.875 -4.981 2.656 1.00 0.00 N ATOM 640 CA CYS A 164 5.411 -6.331 2.925 1.00 0.00 C ATOM 641 C CYS A 164 4.012 -6.588 2.354 1.00 0.00 C ATOM 642 O CYS A 164 3.419 -7.640 2.599 1.00 0.00 O ATOM 643 CB CYS A 164 5.427 -6.520 4.430 1.00 0.00 C ATOM 644 SG CYS A 164 4.094 -5.517 5.113 1.00 0.00 S ATOM 0 H CYS A 164 5.171 -4.259 2.812 1.00 0.00 H new ATOM 0 HA CYS A 164 6.068 -7.049 2.435 1.00 0.00 H new ATOM 0 HB2 CYS A 164 5.287 -7.570 4.687 1.00 0.00 H new ATOM 0 HB3 CYS A 164 6.388 -6.216 4.845 1.00 0.00 H new ATOM 649 N GLN A 165 3.502 -5.615 1.600 1.00 0.00 N ATOM 650 CA GLN A 165 2.165 -5.620 1.014 1.00 0.00 C ATOM 651 C GLN A 165 1.064 -5.946 2.025 1.00 0.00 C ATOM 652 O GLN A 165 0.040 -6.523 1.662 1.00 0.00 O ATOM 653 CB GLN A 165 2.091 -6.490 -0.246 1.00 0.00 C ATOM 654 CG GLN A 165 2.874 -5.866 -1.403 1.00 0.00 C ATOM 655 CD GLN A 165 4.375 -5.914 -1.168 1.00 0.00 C ATOM 656 OE1 GLN A 165 5.003 -6.967 -1.292 1.00 0.00 O ATOM 657 NE2 GLN A 165 4.970 -4.775 -0.831 1.00 0.00 N ATOM 0 H GLN A 165 4.029 -4.772 1.373 1.00 0.00 H new ATOM 0 HA GLN A 165 1.970 -4.595 0.697 1.00 0.00 H new ATOM 0 HB2 GLN A 165 2.488 -7.482 -0.029 1.00 0.00 H new ATOM 0 HB3 GLN A 165 1.049 -6.621 -0.539 1.00 0.00 H new ATOM 0 HG2 GLN A 165 2.635 -6.392 -2.327 1.00 0.00 H new ATOM 0 HG3 GLN A 165 2.561 -4.830 -1.535 1.00 0.00 H new ATOM 0 HE21 GLN A 165 4.420 -3.921 -0.737 1.00 0.00 H new ATOM 0 HE22 GLN A 165 5.976 -4.755 -0.666 1.00 0.00 H new ATOM 666 N SER A 166 1.266 -5.583 3.294 1.00 0.00 N ATOM 667 CA SER A 166 0.232 -5.705 4.311 1.00 0.00 C ATOM 668 C SER A 166 -0.582 -4.417 4.387 1.00 0.00 C ATOM 669 O SER A 166 -0.037 -3.362 4.692 1.00 0.00 O ATOM 670 CB SER A 166 0.909 -5.970 5.649 1.00 0.00 C ATOM 671 OG SER A 166 1.618 -7.193 5.589 1.00 0.00 O ATOM 0 H SER A 166 2.146 -5.199 3.639 1.00 0.00 H new ATOM 0 HA SER A 166 -0.443 -6.524 4.062 1.00 0.00 H new ATOM 0 HB2 SER A 166 1.591 -5.155 5.891 1.00 0.00 H new ATOM 0 HB3 SER A 166 0.164 -6.009 6.444 1.00 0.00 H new ATOM 0 HG SER A 166 2.576 -7.011 5.489 1.00 0.00 H new ATOM 677 N ILE A 167 -1.888 -4.499 4.107 1.00 0.00 N ATOM 678 CA ILE A 167 -2.816 -3.381 4.249 1.00 0.00 C ATOM 679 C ILE A 167 -3.023 -2.998 5.704 1.00 0.00 C ATOM 680 O ILE A 167 -3.464 -1.888 5.998 1.00 0.00 O ATOM 681 CB ILE A 167 -4.184 -3.750 3.666 1.00 0.00 C ATOM 682 CG1 ILE A 167 -4.746 -4.999 4.350 1.00 0.00 C ATOM 683 CG2 ILE A 167 -4.041 -3.976 2.164 1.00 0.00 C ATOM 684 CD1 ILE A 167 -5.821 -5.675 3.506 1.00 0.00 C ATOM 0 H ILE A 167 -2.331 -5.355 3.772 1.00 0.00 H new ATOM 0 HA ILE A 167 -2.377 -2.539 3.713 1.00 0.00 H new ATOM 0 HB ILE A 167 -4.884 -2.933 3.844 1.00 0.00 H new ATOM 0 HG12 ILE A 167 -3.937 -5.704 4.540 1.00 0.00 H new ATOM 0 HG13 ILE A 167 -5.164 -4.725 5.319 1.00 0.00 H new ATOM 0 HG21 ILE A 167 -5.011 -4.239 1.742 1.00 0.00 H new ATOM 0 HG22 ILE A 167 -3.675 -3.064 1.692 1.00 0.00 H new ATOM 0 HG23 ILE A 167 -3.335 -4.786 1.984 1.00 0.00 H new ATOM 0 HD11 ILE A 167 -6.193 -6.557 4.028 1.00 0.00 H new ATOM 0 HD12 ILE A 167 -6.643 -4.979 3.338 1.00 0.00 H new ATOM 0 HD13 ILE A 167 -5.397 -5.973 2.547 1.00 0.00 H new ATOM 696 N SER A 168 -2.706 -3.915 6.615 1.00 0.00 N ATOM 697 CA SER A 168 -2.782 -3.693 8.052 1.00 0.00 C ATOM 698 C SER A 168 -2.094 -2.386 8.439 1.00 0.00 C ATOM 699 O SER A 168 -2.629 -1.610 9.233 1.00 0.00 O ATOM 700 CB SER A 168 -2.212 -4.907 8.780 1.00 0.00 C ATOM 701 OG SER A 168 -0.842 -5.056 8.500 1.00 0.00 O ATOM 0 H SER A 168 -2.383 -4.850 6.368 1.00 0.00 H new ATOM 0 HA SER A 168 -3.823 -3.584 8.357 1.00 0.00 H new ATOM 0 HB2 SER A 168 -2.359 -4.795 9.854 1.00 0.00 H new ATOM 0 HB3 SER A 168 -2.750 -5.805 8.477 1.00 0.00 H new ATOM 0 HG SER A 168 -0.494 -5.838 8.977 1.00 0.00 H new ATOM 707 N HIS A 169 -0.907 -2.155 7.880 1.00 0.00 N ATOM 708 CA HIS A 169 -0.104 -0.969 8.129 1.00 0.00 C ATOM 709 C HIS A 169 0.393 -0.384 6.807 1.00 0.00 C ATOM 710 O HIS A 169 -0.103 -0.729 5.736 1.00 0.00 O ATOM 711 CB HIS A 169 1.068 -1.339 9.045 1.00 0.00 C ATOM 712 CG HIS A 169 1.932 -2.447 8.490 1.00 0.00 C ATOM 713 ND1 HIS A 169 1.907 -3.766 8.879 1.00 0.00 N ATOM 714 CD2 HIS A 169 2.879 -2.338 7.510 1.00 0.00 C ATOM 715 CE1 HIS A 169 2.819 -4.422 8.151 1.00 0.00 C ATOM 716 NE2 HIS A 169 3.451 -3.591 7.299 1.00 0.00 N ATOM 0 H HIS A 169 -0.471 -2.806 7.227 1.00 0.00 H new ATOM 0 HA HIS A 169 -0.709 -0.209 8.623 1.00 0.00 H new ATOM 0 HB2 HIS A 169 1.684 -0.455 9.210 1.00 0.00 H new ATOM 0 HB3 HIS A 169 0.679 -1.643 10.017 1.00 0.00 H new ATOM 0 HD1 HIS A 169 1.302 -4.171 9.594 1.00 0.00 H new ATOM 0 HD2 HIS A 169 3.141 -1.431 6.986 1.00 0.00 H new ATOM 0 HE1 HIS A 169 3.022 -5.479 8.236 1.00 0.00 H new ATOM 724 N MET A 170 1.377 0.507 6.887 1.00 0.00 N ATOM 725 CA MET A 170 2.013 1.122 5.741 1.00 0.00 C ATOM 726 C MET A 170 3.517 0.912 5.883 1.00 0.00 C ATOM 727 O MET A 170 3.987 0.623 6.981 1.00 0.00 O ATOM 728 CB MET A 170 1.708 2.619 5.759 1.00 0.00 C ATOM 729 CG MET A 170 0.234 2.943 5.558 1.00 0.00 C ATOM 730 SD MET A 170 -0.263 3.309 3.857 1.00 0.00 S ATOM 731 CE MET A 170 -0.018 1.693 3.078 1.00 0.00 C ATOM 0 H MET A 170 1.760 0.825 7.777 1.00 0.00 H new ATOM 0 HA MET A 170 1.652 0.688 4.809 1.00 0.00 H new ATOM 0 HB2 MET A 170 2.037 3.037 6.710 1.00 0.00 H new ATOM 0 HB3 MET A 170 2.289 3.109 4.978 1.00 0.00 H new ATOM 0 HG2 MET A 170 -0.357 2.100 5.916 1.00 0.00 H new ATOM 0 HG3 MET A 170 -0.020 3.799 6.184 1.00 0.00 H new ATOM 0 HE1 MET A 170 -0.282 1.754 2.022 1.00 0.00 H new ATOM 0 HE2 MET A 170 1.027 1.398 3.174 1.00 0.00 H new ATOM 0 HE3 MET A 170 -0.651 0.953 3.568 1.00 0.00 H new ATOM 741 N VAL A 171 4.278 1.062 4.801 1.00 0.00 N ATOM 742 CA VAL A 171 5.723 0.966 4.888 1.00 0.00 C ATOM 743 C VAL A 171 6.224 1.988 5.894 1.00 0.00 C ATOM 744 O VAL A 171 7.301 1.840 6.466 1.00 0.00 O ATOM 745 CB VAL A 171 6.365 1.214 3.532 1.00 0.00 C ATOM 746 CG1 VAL A 171 6.233 2.685 3.173 1.00 0.00 C ATOM 747 CG2 VAL A 171 7.852 0.900 3.572 1.00 0.00 C ATOM 0 H VAL A 171 3.918 1.248 3.865 1.00 0.00 H new ATOM 0 HA VAL A 171 5.995 -0.039 5.210 1.00 0.00 H new ATOM 0 HB VAL A 171 5.864 0.575 2.804 1.00 0.00 H new ATOM 0 HG11 VAL A 171 6.693 2.865 2.201 1.00 0.00 H new ATOM 0 HG12 VAL A 171 5.178 2.956 3.131 1.00 0.00 H new ATOM 0 HG13 VAL A 171 6.734 3.290 3.929 1.00 0.00 H new ATOM 0 HG21 VAL A 171 8.289 1.085 2.591 1.00 0.00 H new ATOM 0 HG22 VAL A 171 8.338 1.536 4.312 1.00 0.00 H new ATOM 0 HG23 VAL A 171 7.996 -0.146 3.842 1.00 0.00 H new ATOM 757 N ALA A 172 5.417 3.030 6.098 1.00 0.00 N ATOM 758 CA ALA A 172 5.711 4.083 7.034 1.00 0.00 C ATOM 759 C ALA A 172 5.797 3.555 8.460 1.00 0.00 C ATOM 760 O ALA A 172 6.244 4.259 9.368 1.00 0.00 O ATOM 761 CB ALA A 172 4.615 5.138 6.928 1.00 0.00 C ATOM 0 H ALA A 172 4.533 3.156 5.605 1.00 0.00 H new ATOM 0 HA ALA A 172 6.682 4.516 6.792 1.00 0.00 H new ATOM 0 HB1 ALA A 172 4.819 5.946 7.630 1.00 0.00 H new ATOM 0 HB2 ALA A 172 4.590 5.536 5.914 1.00 0.00 H new ATOM 0 HB3 ALA A 172 3.651 4.687 7.164 1.00 0.00 H new ATOM 767 N SER A 173 5.364 2.308 8.638 1.00 0.00 N ATOM 768 CA SER A 173 5.283 1.636 9.925 1.00 0.00 C ATOM 769 C SER A 173 5.611 0.153 9.795 1.00 0.00 C ATOM 770 O SER A 173 5.376 -0.602 10.738 1.00 0.00 O ATOM 771 CB SER A 173 3.859 1.788 10.454 1.00 0.00 C ATOM 772 OG SER A 173 3.852 1.750 11.862 1.00 0.00 O ATOM 0 H SER A 173 5.051 1.723 7.863 1.00 0.00 H new ATOM 0 HA SER A 173 6.006 2.085 10.606 1.00 0.00 H new ATOM 0 HB2 SER A 173 3.434 2.730 10.107 1.00 0.00 H new ATOM 0 HB3 SER A 173 3.230 0.990 10.059 1.00 0.00 H new ATOM 0 HG SER A 173 4.359 0.970 12.171 1.00 0.00 H new ATOM 778 N CYS A 174 6.145 -0.279 8.643 1.00 0.00 N ATOM 779 CA CYS A 174 6.370 -1.706 8.419 1.00 0.00 C ATOM 780 C CYS A 174 7.131 -2.326 9.590 1.00 0.00 C ATOM 781 O CYS A 174 8.139 -1.773 10.033 1.00 0.00 O ATOM 782 CB CYS A 174 7.096 -1.951 7.094 1.00 0.00 C ATOM 783 SG CYS A 174 6.897 -3.685 6.621 1.00 0.00 S ATOM 0 H CYS A 174 6.422 0.327 7.871 1.00 0.00 H new ATOM 0 HA CYS A 174 5.397 -2.194 8.355 1.00 0.00 H new ATOM 0 HB2 CYS A 174 6.692 -1.301 6.318 1.00 0.00 H new ATOM 0 HB3 CYS A 174 8.154 -1.708 7.194 1.00 0.00 H new ATOM 788 N PRO A 175 6.669 -3.474 10.107 1.00 0.00 N ATOM 789 CA PRO A 175 7.335 -4.171 11.186 1.00 0.00 C ATOM 790 C PRO A 175 8.614 -4.831 10.687 1.00 0.00 C ATOM 791 O PRO A 175 9.439 -5.260 11.494 1.00 0.00 O ATOM 792 CB PRO A 175 6.335 -5.232 11.647 1.00 0.00 C ATOM 793 CG PRO A 175 5.555 -5.544 10.375 1.00 0.00 C ATOM 794 CD PRO A 175 5.478 -4.186 9.688 1.00 0.00 C ATOM 0 HA PRO A 175 7.622 -3.496 11.993 1.00 0.00 H new ATOM 0 HB2 PRO A 175 6.837 -6.116 12.040 1.00 0.00 H new ATOM 0 HB3 PRO A 175 5.685 -4.857 12.437 1.00 0.00 H new ATOM 0 HG2 PRO A 175 6.066 -6.282 9.757 1.00 0.00 H new ATOM 0 HG3 PRO A 175 4.565 -5.943 10.595 1.00 0.00 H new ATOM 0 HD2 PRO A 175 5.447 -4.295 8.604 1.00 0.00 H new ATOM 0 HD3 PRO A 175 4.576 -3.649 9.980 1.00 0.00 H new ATOM 802 N LEU A 176 8.782 -4.911 9.360 1.00 0.00 N ATOM 803 CA LEU A 176 9.964 -5.510 8.779 1.00 0.00 C ATOM 804 C LEU A 176 11.076 -4.482 8.681 1.00 0.00 C ATOM 805 O LEU A 176 12.198 -4.736 9.111 1.00 0.00 O ATOM 806 CB LEU A 176 9.631 -6.020 7.381 1.00 0.00 C ATOM 807 CG LEU A 176 8.435 -6.969 7.397 1.00 0.00 C ATOM 808 CD1 LEU A 176 8.258 -7.542 5.995 1.00 0.00 C ATOM 809 CD2 LEU A 176 8.680 -8.096 8.392 1.00 0.00 C ATOM 0 H LEU A 176 8.107 -4.565 8.679 1.00 0.00 H new ATOM 0 HA LEU A 176 10.294 -6.335 9.411 1.00 0.00 H new ATOM 0 HB2 LEU A 176 9.417 -5.175 6.727 1.00 0.00 H new ATOM 0 HB3 LEU A 176 10.498 -6.534 6.965 1.00 0.00 H new ATOM 0 HG LEU A 176 7.535 -6.432 7.698 1.00 0.00 H new ATOM 0 HD11 LEU A 176 7.407 -8.224 5.985 1.00 0.00 H new ATOM 0 HD12 LEU A 176 8.081 -6.730 5.290 1.00 0.00 H new ATOM 0 HD13 LEU A 176 9.159 -8.083 5.706 1.00 0.00 H new ATOM 0 HD21 LEU A 176 7.823 -8.769 8.398 1.00 0.00 H new ATOM 0 HD22 LEU A 176 9.573 -8.649 8.102 1.00 0.00 H new ATOM 0 HD23 LEU A 176 8.820 -7.677 9.389 1.00 0.00 H new ATOM 821 N LYS A 177 10.787 -3.305 8.116 1.00 0.00 N ATOM 822 CA LYS A 177 11.830 -2.312 7.918 1.00 0.00 C ATOM 823 C LYS A 177 12.493 -1.928 9.230 1.00 0.00 C ATOM 824 O LYS A 177 13.568 -1.340 9.225 1.00 0.00 O ATOM 825 CB LYS A 177 11.279 -1.090 7.200 1.00 0.00 C ATOM 826 CG LYS A 177 10.474 -0.242 8.171 1.00 0.00 C ATOM 827 CD LYS A 177 10.018 1.051 7.490 1.00 0.00 C ATOM 828 CE LYS A 177 11.150 2.067 7.360 1.00 0.00 C ATOM 829 NZ LYS A 177 11.443 2.712 8.653 1.00 0.00 N ATOM 0 H LYS A 177 9.859 -3.027 7.796 1.00 0.00 H new ATOM 0 HA LYS A 177 12.599 -2.758 7.287 1.00 0.00 H new ATOM 0 HB2 LYS A 177 12.097 -0.503 6.782 1.00 0.00 H new ATOM 0 HB3 LYS A 177 10.650 -1.400 6.366 1.00 0.00 H new ATOM 0 HG2 LYS A 177 9.607 -0.802 8.522 1.00 0.00 H new ATOM 0 HG3 LYS A 177 11.078 -0.007 9.047 1.00 0.00 H new ATOM 0 HD2 LYS A 177 9.626 0.819 6.500 1.00 0.00 H new ATOM 0 HD3 LYS A 177 9.201 1.492 8.061 1.00 0.00 H new ATOM 0 HE2 LYS A 177 12.046 1.570 6.988 1.00 0.00 H new ATOM 0 HE3 LYS A 177 10.878 2.826 6.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 177 11.747 3.693 8.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 177 10.588 2.708 9.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 177 12.202 2.191 9.137 1.00 0.00 H new ATOM 843 N ALA A 178 11.855 -2.263 10.351 1.00 0.00 N ATOM 844 CA ALA A 178 12.351 -1.950 11.670 1.00 0.00 C ATOM 845 C ALA A 178 13.733 -2.541 11.926 1.00 0.00 C ATOM 846 O ALA A 178 14.418 -2.139 12.862 1.00 0.00 O ATOM 847 CB ALA A 178 11.366 -2.494 12.691 1.00 0.00 C ATOM 0 H ALA A 178 10.968 -2.766 10.357 1.00 0.00 H new ATOM 0 HA ALA A 178 12.447 -0.867 11.753 1.00 0.00 H new ATOM 0 HB1 ALA A 178 11.722 -2.268 13.696 1.00 0.00 H new ATOM 0 HB2 ALA A 178 10.391 -2.031 12.539 1.00 0.00 H new ATOM 0 HB3 ALA A 178 11.277 -3.574 12.572 1.00 0.00 H new ATOM 853 N GLN A 179 14.142 -3.497 11.090 1.00 0.00 N ATOM 854 CA GLN A 179 15.457 -4.096 11.162 1.00 0.00 C ATOM 855 C GLN A 179 16.008 -4.362 9.757 1.00 0.00 C ATOM 856 O GLN A 179 16.979 -5.094 9.598 1.00 0.00 O ATOM 857 CB GLN A 179 15.398 -5.370 12.013 1.00 0.00 C ATOM 858 CG GLN A 179 14.367 -6.366 11.485 1.00 0.00 C ATOM 859 CD GLN A 179 12.964 -6.110 12.024 1.00 0.00 C ATOM 860 OE1 GLN A 179 12.783 -5.516 13.085 1.00 0.00 O ATOM 861 NE2 GLN A 179 11.949 -6.560 11.295 1.00 0.00 N ATOM 0 H GLN A 179 13.559 -3.873 10.342 1.00 0.00 H new ATOM 0 HA GLN A 179 16.146 -3.403 11.645 1.00 0.00 H new ATOM 0 HB2 GLN A 179 16.381 -5.841 12.029 1.00 0.00 H new ATOM 0 HB3 GLN A 179 15.154 -5.107 13.042 1.00 0.00 H new ATOM 0 HG2 GLN A 179 14.347 -6.317 10.396 1.00 0.00 H new ATOM 0 HG3 GLN A 179 14.675 -7.377 11.753 1.00 0.00 H new ATOM 0 HE21 GLN A 179 12.128 -7.050 10.418 1.00 0.00 H new ATOM 0 HE22 GLN A 179 10.990 -6.416 11.612 1.00 0.00 H new ATOM 870 N GLN A 180 15.389 -3.765 8.733 1.00 0.00 N ATOM 871 CA GLN A 180 15.801 -3.923 7.343 1.00 0.00 C ATOM 872 C GLN A 180 16.153 -2.567 6.732 1.00 0.00 C ATOM 873 O GLN A 180 16.833 -2.491 5.712 1.00 0.00 O ATOM 874 CB GLN A 180 14.667 -4.556 6.534 1.00 0.00 C ATOM 875 CG GLN A 180 14.077 -5.803 7.176 1.00 0.00 C ATOM 876 CD GLN A 180 14.908 -7.048 6.879 1.00 0.00 C ATOM 877 OE1 GLN A 180 15.945 -7.279 7.493 1.00 0.00 O ATOM 878 NE2 GLN A 180 14.462 -7.865 5.930 1.00 0.00 N ATOM 0 H GLN A 180 14.581 -3.154 8.852 1.00 0.00 H new ATOM 0 HA GLN A 180 16.680 -4.567 7.316 1.00 0.00 H new ATOM 0 HB2 GLN A 180 13.875 -3.819 6.398 1.00 0.00 H new ATOM 0 HB3 GLN A 180 15.039 -4.811 5.542 1.00 0.00 H new ATOM 0 HG2 GLN A 180 14.012 -5.659 8.255 1.00 0.00 H new ATOM 0 HG3 GLN A 180 13.060 -5.951 6.813 1.00 0.00 H new ATOM 0 HE21 GLN A 180 13.597 -7.648 5.436 1.00 0.00 H new ATOM 0 HE22 GLN A 180 14.985 -8.709 5.696 1.00 0.00 H new ATOM 887 N GLY A 181 15.677 -1.499 7.379 1.00 0.00 N ATOM 888 CA GLY A 181 15.932 -0.119 7.017 1.00 0.00 C ATOM 889 C GLY A 181 15.219 0.794 8.011 1.00 0.00 C ATOM 890 O GLY A 181 14.304 1.531 7.628 1.00 0.00 O ATOM 0 H GLY A 181 15.080 -1.586 8.202 1.00 0.00 H new ATOM 0 HA2 GLY A 181 17.004 0.080 7.024 1.00 0.00 H new ATOM 0 HA3 GLY A 181 15.578 0.077 6.005 1.00 0.00 H new ATOM 894 N PRO A 182 15.621 0.744 9.292 1.00 0.00 N ATOM 895 CA PRO A 182 14.917 1.364 10.403 1.00 0.00 C ATOM 896 C PRO A 182 14.590 2.841 10.194 1.00 0.00 C ATOM 897 O PRO A 182 13.564 3.316 10.671 1.00 0.00 O ATOM 898 CB PRO A 182 15.833 1.191 11.613 1.00 0.00 C ATOM 899 CG PRO A 182 16.647 -0.050 11.268 1.00 0.00 C ATOM 900 CD PRO A 182 16.806 0.048 9.761 1.00 0.00 C ATOM 0 HA PRO A 182 13.945 0.886 10.525 1.00 0.00 H new ATOM 0 HB2 PRO A 182 16.472 2.062 11.761 1.00 0.00 H new ATOM 0 HB3 PRO A 182 15.263 1.054 12.532 1.00 0.00 H new ATOM 0 HG2 PRO A 182 17.612 -0.053 11.775 1.00 0.00 H new ATOM 0 HG3 PRO A 182 16.131 -0.964 11.560 1.00 0.00 H new ATOM 0 HD2 PRO A 182 17.712 0.593 9.496 1.00 0.00 H new ATOM 0 HD3 PRO A 182 16.885 -0.941 9.309 1.00 0.00 H new ATOM 908 N SER A 183 15.444 3.572 9.479 1.00 0.00 N ATOM 909 CA SER A 183 15.210 4.980 9.203 1.00 0.00 C ATOM 910 C SER A 183 16.117 5.457 8.073 1.00 0.00 C ATOM 911 O SER A 183 17.005 4.725 7.631 1.00 0.00 O ATOM 912 CB SER A 183 15.469 5.801 10.467 1.00 0.00 C ATOM 913 OG SER A 183 15.145 7.158 10.247 1.00 0.00 O ATOM 0 H SER A 183 16.308 3.205 9.080 1.00 0.00 H new ATOM 0 HA SER A 183 14.173 5.113 8.894 1.00 0.00 H new ATOM 0 HB2 SER A 183 14.875 5.408 11.292 1.00 0.00 H new ATOM 0 HB3 SER A 183 16.516 5.713 10.758 1.00 0.00 H new ATOM 0 HG SER A 183 15.314 7.671 11.065 1.00 0.00 H new ATOM 919 N ALA A 184 15.891 6.688 7.609 1.00 0.00 N ATOM 920 CA ALA A 184 16.676 7.305 6.553 1.00 0.00 C ATOM 921 C ALA A 184 16.807 8.813 6.776 1.00 0.00 C ATOM 922 O ALA A 184 17.377 9.513 5.937 1.00 0.00 O ATOM 923 CB ALA A 184 15.991 7.037 5.214 1.00 0.00 C ATOM 0 H ALA A 184 15.146 7.287 7.965 1.00 0.00 H new ATOM 0 HA ALA A 184 17.678 6.877 6.558 1.00 0.00 H new ATOM 0 HB1 ALA A 184 16.569 7.495 4.411 1.00 0.00 H new ATOM 0 HB2 ALA A 184 15.926 5.962 5.047 1.00 0.00 H new ATOM 0 HB3 ALA A 184 14.988 7.463 5.227 1.00 0.00 H new ATOM 929 N GLN A 185 16.281 9.318 7.901 1.00 0.00 N ATOM 930 CA GLN A 185 16.335 10.739 8.218 1.00 0.00 C ATOM 931 C GLN A 185 17.784 11.173 8.420 1.00 0.00 C ATOM 932 O GLN A 185 18.669 10.338 8.606 1.00 0.00 O ATOM 933 CB GLN A 185 15.498 11.018 9.472 1.00 0.00 C ATOM 934 CG GLN A 185 14.050 10.547 9.300 1.00 0.00 C ATOM 935 CD GLN A 185 13.428 11.121 8.033 1.00 0.00 C ATOM 936 OE1 GLN A 185 13.349 10.441 7.013 1.00 0.00 O ATOM 937 NE2 GLN A 185 12.984 12.377 8.079 1.00 0.00 N ATOM 0 H GLN A 185 15.811 8.752 8.607 1.00 0.00 H new ATOM 0 HA GLN A 185 15.921 11.314 7.390 1.00 0.00 H new ATOM 0 HB2 GLN A 185 15.946 10.514 10.329 1.00 0.00 H new ATOM 0 HB3 GLN A 185 15.510 12.086 9.688 1.00 0.00 H new ATOM 0 HG2 GLN A 185 14.022 9.458 9.260 1.00 0.00 H new ATOM 0 HG3 GLN A 185 13.461 10.850 10.166 1.00 0.00 H new ATOM 0 HE21 GLN A 185 13.064 12.915 8.942 1.00 0.00 H new ATOM 0 HE22 GLN A 185 12.564 12.800 7.251 1.00 0.00 H new ATOM 946 N GLY A 186 18.031 12.485 8.383 1.00 0.00 N ATOM 947 CA GLY A 186 19.369 13.030 8.542 1.00 0.00 C ATOM 948 C GLY A 186 19.383 14.530 8.299 1.00 0.00 C ATOM 949 O GLY A 186 19.233 14.924 7.125 1.00 0.00 O ATOM 950 OXT GLY A 186 19.547 15.269 9.298 1.00 0.00 O ATOM 0 H GLY A 186 17.308 13.191 8.242 1.00 0.00 H new ATOM 0 HA2 GLY A 186 19.734 12.818 9.547 1.00 0.00 H new ATOM 0 HA3 GLY A 186 20.050 12.540 7.846 1.00 0.00 H new TER 954 GLY A 186 ATOM 955 O5' A B 1 10.849 8.050 4.885 1.00 0.00 O ATOM 956 C5' A B 1 9.636 7.431 5.266 1.00 0.00 C ATOM 957 C4' A B 1 8.527 7.837 4.295 1.00 0.00 C ATOM 958 O4' A B 1 8.819 7.261 3.026 1.00 0.00 O ATOM 959 C3' A B 1 7.189 7.257 4.753 1.00 0.00 C ATOM 960 O3' A B 1 6.125 8.030 4.237 1.00 0.00 O ATOM 961 C2' A B 1 7.198 5.941 4.017 1.00 0.00 C ATOM 962 O2' A B 1 5.896 5.436 3.907 1.00 0.00 O ATOM 963 C1' A B 1 7.736 6.419 2.686 1.00 0.00 C ATOM 964 N9 A B 1 8.065 5.306 1.779 1.00 0.00 N ATOM 965 C8 A B 1 7.486 5.052 0.564 1.00 0.00 C ATOM 966 N7 A B 1 7.970 4.011 -0.055 1.00 0.00 N ATOM 967 C5 A B 1 8.917 3.511 0.835 1.00 0.00 C ATOM 968 C6 A B 1 9.768 2.392 0.798 1.00 0.00 C ATOM 969 N6 A B 1 9.838 1.552 -0.235 1.00 0.00 N ATOM 970 N1 A B 1 10.551 2.145 1.859 1.00 0.00 N ATOM 971 C2 A B 1 10.488 2.956 2.907 1.00 0.00 C ATOM 972 N3 A B 1 9.742 4.042 3.069 1.00 0.00 N ATOM 973 C4 A B 1 8.967 4.276 1.973 1.00 0.00 C ATOM 0 H5' A B 1 9.370 7.724 6.282 1.00 0.00 H new ATOM 0 H5'' A B 1 9.754 6.347 5.267 1.00 0.00 H new ATOM 0 H4' A B 1 8.470 8.925 4.250 1.00 0.00 H new ATOM 0 H3' A B 1 7.069 7.206 5.835 1.00 0.00 H new ATOM 0 H2' A B 1 7.765 5.131 4.477 1.00 0.00 H new ATOM 0 HO2' A B 1 5.284 6.160 3.657 1.00 0.00 H new ATOM 0 HO5' A B 1 11.559 7.790 5.509 1.00 0.00 H new ATOM 0 H1' A B 1 7.000 6.971 2.101 1.00 0.00 H new ATOM 0 H8 A B 1 6.695 5.662 0.153 1.00 0.00 H new ATOM 0 H61 A B 1 10.476 0.757 -0.203 1.00 0.00 H new ATOM 0 H62 A B 1 9.254 1.705 -1.057 1.00 0.00 H new ATOM 0 H2 A B 1 11.128 2.699 3.738 1.00 0.00 H new ATOM 986 P G B 2 5.257 9.010 5.159 1.00 0.00 P ATOM 987 OP1 G B 2 5.681 10.403 4.905 1.00 0.00 O ATOM 988 OP2 G B 2 5.262 8.483 6.540 1.00 0.00 O ATOM 989 O5' G B 2 3.781 8.801 4.553 1.00 0.00 O ATOM 990 C5' G B 2 3.308 9.629 3.505 1.00 0.00 C ATOM 991 C4' G B 2 1.995 9.122 2.906 1.00 0.00 C ATOM 992 O4' G B 2 2.242 8.153 1.896 1.00 0.00 O ATOM 993 C3' G B 2 1.041 8.497 3.938 1.00 0.00 C ATOM 994 O3' G B 2 0.070 9.353 4.522 1.00 0.00 O ATOM 995 C2' G B 2 0.367 7.370 3.160 1.00 0.00 C ATOM 996 O2' G B 2 -0.864 7.755 2.584 1.00 0.00 O ATOM 997 C1' G B 2 1.343 7.066 2.032 1.00 0.00 C ATOM 998 N9 G B 2 2.108 5.848 2.335 1.00 0.00 N ATOM 999 C8 G B 2 3.032 5.616 3.327 1.00 0.00 C ATOM 1000 N7 G B 2 3.456 4.391 3.357 1.00 0.00 N ATOM 1001 C5 G B 2 2.828 3.781 2.282 1.00 0.00 C ATOM 1002 C6 G B 2 2.956 2.457 1.790 1.00 0.00 C ATOM 1003 O6 G B 2 3.635 1.535 2.226 1.00 0.00 O ATOM 1004 N1 G B 2 2.191 2.236 0.665 1.00 0.00 N ATOM 1005 C2 G B 2 1.380 3.179 0.079 1.00 0.00 C ATOM 1006 N2 G B 2 0.712 2.805 -1.010 1.00 0.00 N ATOM 1007 N3 G B 2 1.235 4.425 0.538 1.00 0.00 N ATOM 1008 C4 G B 2 2.004 4.665 1.636 1.00 0.00 C ATOM 0 H5' G B 2 4.064 9.685 2.721 1.00 0.00 H new ATOM 0 H5'' G B 2 3.165 10.641 3.883 1.00 0.00 H new ATOM 0 H4' G B 2 1.513 10.008 2.494 1.00 0.00 H new ATOM 0 H3' G B 2 1.615 8.189 4.812 1.00 0.00 H new ATOM 0 H2' G B 2 0.149 6.531 3.821 1.00 0.00 H new ATOM 0 HO2' G B 2 -0.748 8.597 2.097 1.00 0.00 H new ATOM 0 H1' G B 2 0.785 6.916 1.108 1.00 0.00 H new ATOM 0 H8 G B 2 3.371 6.378 4.013 1.00 0.00 H new ATOM 0 H1 G B 2 2.229 1.310 0.238 1.00 0.00 H new ATOM 0 H21 G B 2 0.097 3.467 -1.483 1.00 0.00 H new ATOM 0 H22 G B 2 0.816 1.857 -1.371 1.00 0.00 H new ATOM 1020 P G B 3 -0.446 10.709 3.824 1.00 0.00 P ATOM 1021 OP1 G B 3 0.665 11.684 3.822 1.00 0.00 O ATOM 1022 OP2 G B 3 -1.733 11.077 4.450 1.00 0.00 O ATOM 1023 O5' G B 3 -0.741 10.256 2.308 1.00 0.00 O ATOM 1024 C5' G B 3 -1.620 10.979 1.483 1.00 0.00 C ATOM 1025 C4' G B 3 -1.586 10.373 0.082 1.00 0.00 C ATOM 1026 O4' G B 3 -2.262 9.124 0.067 1.00 0.00 O ATOM 1027 C3' G B 3 -2.286 11.294 -0.919 1.00 0.00 C ATOM 1028 O3' G B 3 -1.429 11.482 -2.020 1.00 0.00 O ATOM 1029 C2' G B 3 -3.535 10.514 -1.308 1.00 0.00 C ATOM 1030 O2' G B 3 -3.933 10.764 -2.640 1.00 0.00 O ATOM 1031 C1' G B 3 -3.053 9.084 -1.102 1.00 0.00 C ATOM 1032 N9 G B 3 -4.167 8.123 -0.994 1.00 0.00 N ATOM 1033 C8 G B 3 -4.438 7.052 -1.808 1.00 0.00 C ATOM 1034 N7 G B 3 -5.511 6.392 -1.486 1.00 0.00 N ATOM 1035 C5 G B 3 -5.997 7.078 -0.373 1.00 0.00 C ATOM 1036 C6 G B 3 -7.147 6.822 0.423 1.00 0.00 C ATOM 1037 O6 G B 3 -7.981 5.931 0.289 1.00 0.00 O ATOM 1038 N1 G B 3 -7.284 7.736 1.456 1.00 0.00 N ATOM 1039 C2 G B 3 -6.417 8.770 1.700 1.00 0.00 C ATOM 1040 N2 G B 3 -6.696 9.544 2.746 1.00 0.00 N ATOM 1041 N3 G B 3 -5.334 9.025 0.955 1.00 0.00 N ATOM 1042 C4 G B 3 -5.183 8.141 -0.067 1.00 0.00 C ATOM 0 H5' G B 3 -1.328 12.029 1.448 1.00 0.00 H new ATOM 0 H5'' G B 3 -2.632 10.943 1.886 1.00 0.00 H new ATOM 0 H4' G B 3 -0.540 10.242 -0.195 1.00 0.00 H new ATOM 0 H3' G B 3 -2.534 12.283 -0.533 1.00 0.00 H new ATOM 0 H2' G B 3 -4.424 10.774 -0.733 1.00 0.00 H new ATOM 0 HO2' G B 3 -4.736 10.242 -2.845 1.00 0.00 H new ATOM 0 H1' G B 3 -2.480 8.730 -1.959 1.00 0.00 H new ATOM 0 H8 G B 3 -3.813 6.780 -2.646 1.00 0.00 H new ATOM 0 H1 G B 3 -8.086 7.632 2.078 1.00 0.00 H new ATOM 0 H21 G B 3 -6.087 10.329 2.977 1.00 0.00 H new ATOM 0 H22 G B 3 -7.519 9.352 3.317 1.00 0.00 H new ATOM 1054 P A B 4 -1.492 12.835 -2.882 1.00 0.00 P ATOM 1055 OP1 A B 4 -0.199 13.537 -2.712 1.00 0.00 O ATOM 1056 OP2 A B 4 -2.754 13.539 -2.562 1.00 0.00 O ATOM 1057 O5' A B 4 -1.603 12.333 -4.398 1.00 0.00 O ATOM 1058 C5' A B 4 -0.518 11.658 -5.006 1.00 0.00 C ATOM 1059 C4' A B 4 -0.766 11.423 -6.489 1.00 0.00 C ATOM 1060 O4' A B 4 -1.850 10.525 -6.662 1.00 0.00 O ATOM 1061 C3' A B 4 -1.100 12.724 -7.214 1.00 0.00 C ATOM 1062 O3' A B 4 -0.507 12.707 -8.500 1.00 0.00 O ATOM 1063 C2' A B 4 -2.617 12.655 -7.320 1.00 0.00 C ATOM 1064 O2' A B 4 -3.130 13.364 -8.432 1.00 0.00 O ATOM 1065 C1' A B 4 -2.857 11.156 -7.428 1.00 0.00 C ATOM 1066 N9 A B 4 -4.185 10.840 -6.897 1.00 0.00 N ATOM 1067 C8 A B 4 -4.765 11.299 -5.744 1.00 0.00 C ATOM 1068 N7 A B 4 -5.974 10.855 -5.544 1.00 0.00 N ATOM 1069 C5 A B 4 -6.203 10.038 -6.650 1.00 0.00 C ATOM 1070 C6 A B 4 -7.292 9.237 -7.042 1.00 0.00 C ATOM 1071 N6 A B 4 -8.417 9.115 -6.336 1.00 0.00 N ATOM 1072 N1 A B 4 -7.202 8.549 -8.191 1.00 0.00 N ATOM 1073 C2 A B 4 -6.094 8.654 -8.911 1.00 0.00 C ATOM 1074 N3 A B 4 -5.002 9.362 -8.659 1.00 0.00 N ATOM 1075 C4 A B 4 -5.127 10.041 -7.492 1.00 0.00 C ATOM 0 H5' A B 4 -0.358 10.702 -4.507 1.00 0.00 H new ATOM 0 H5'' A B 4 0.393 12.242 -4.877 1.00 0.00 H new ATOM 0 H4' A B 4 0.149 11.006 -6.910 1.00 0.00 H new ATOM 0 H3' A B 4 -0.744 13.626 -6.716 1.00 0.00 H new ATOM 0 H2' A B 4 -3.126 13.124 -6.478 1.00 0.00 H new ATOM 0 HO2' A B 4 -4.106 13.283 -8.449 1.00 0.00 H new ATOM 0 H1' A B 4 -2.818 10.814 -8.462 1.00 0.00 H new ATOM 0 H8 A B 4 -4.265 11.970 -5.061 1.00 0.00 H new ATOM 0 H61 A B 4 -9.170 8.517 -6.676 1.00 0.00 H new ATOM 0 H62 A B 4 -8.524 9.620 -5.456 1.00 0.00 H new ATOM 0 H2 A B 4 -6.079 8.085 -9.829 1.00 0.00 H new ATOM 1087 P G B 5 -0.206 14.062 -9.303 1.00 0.00 P ATOM 1088 OP1 G B 5 -0.799 15.199 -8.568 1.00 0.00 O ATOM 1089 OP2 G B 5 -0.566 13.837 -10.719 1.00 0.00 O ATOM 1090 O5' G B 5 1.390 14.154 -9.209 1.00 0.00 O ATOM 1091 C5' G B 5 2.032 14.558 -8.019 1.00 0.00 C ATOM 1092 C4' G B 5 3.209 13.636 -7.711 1.00 0.00 C ATOM 1093 O4' G B 5 2.709 12.369 -7.307 1.00 0.00 O ATOM 1094 C3' G B 5 4.116 13.402 -8.919 1.00 0.00 C ATOM 1095 O3' G B 5 5.442 13.274 -8.451 1.00 0.00 O ATOM 1096 C2' G B 5 3.554 12.087 -9.449 1.00 0.00 C ATOM 1097 O2' G B 5 4.439 11.370 -10.286 1.00 0.00 O ATOM 1098 C1' G B 5 3.247 11.364 -8.144 1.00 0.00 C ATOM 1099 N9 G B 5 2.263 10.286 -8.356 1.00 0.00 N ATOM 1100 C8 G B 5 1.120 10.312 -9.110 1.00 0.00 C ATOM 1101 N7 G B 5 0.448 9.192 -9.098 1.00 0.00 N ATOM 1102 C5 G B 5 1.208 8.364 -8.280 1.00 0.00 C ATOM 1103 C6 G B 5 0.987 7.014 -7.881 1.00 0.00 C ATOM 1104 O6 G B 5 0.038 6.287 -8.158 1.00 0.00 O ATOM 1105 N1 G B 5 2.007 6.525 -7.088 1.00 0.00 N ATOM 1106 C2 G B 5 3.088 7.261 -6.676 1.00 0.00 C ATOM 1107 N2 G B 5 3.947 6.656 -5.866 1.00 0.00 N ATOM 1108 N3 G B 5 3.312 8.526 -7.041 1.00 0.00 N ATOM 1109 C4 G B 5 2.338 9.013 -7.848 1.00 0.00 C ATOM 0 H5' G B 5 1.323 14.542 -7.192 1.00 0.00 H new ATOM 0 H5'' G B 5 2.383 15.585 -8.118 1.00 0.00 H new ATOM 0 H4' G B 5 3.793 14.123 -6.930 1.00 0.00 H new ATOM 0 H3' G B 5 4.138 14.185 -9.677 1.00 0.00 H new ATOM 0 H2' G B 5 2.697 12.216 -10.110 1.00 0.00 H new ATOM 0 HO2' G B 5 5.347 11.417 -9.919 1.00 0.00 H new ATOM 0 H1' G B 5 4.131 10.889 -7.717 1.00 0.00 H new ATOM 0 H8 G B 5 0.802 11.182 -9.666 1.00 0.00 H new ATOM 0 H1 G B 5 1.952 5.551 -6.789 1.00 0.00 H new ATOM 0 H21 G B 5 4.769 7.157 -5.529 1.00 0.00 H new ATOM 0 H22 G B 5 3.785 5.690 -5.581 1.00 0.00 H new ATOM 1121 P A B 6 6.687 13.439 -9.445 1.00 0.00 P ATOM 1122 OP1 A B 6 6.478 14.677 -10.231 1.00 0.00 O ATOM 1123 OP2 A B 6 6.917 12.155 -10.143 1.00 0.00 O ATOM 1124 O5' A B 6 7.907 13.690 -8.435 1.00 0.00 O ATOM 1125 C5' A B 6 8.474 12.621 -7.710 1.00 0.00 C ATOM 1126 C4' A B 6 9.696 13.130 -6.952 1.00 0.00 C ATOM 1127 O4' A B 6 9.293 13.769 -5.754 1.00 0.00 O ATOM 1128 C3' A B 6 10.593 11.961 -6.551 1.00 0.00 C ATOM 1129 O3' A B 6 11.943 12.382 -6.419 1.00 0.00 O ATOM 1130 C2' A B 6 9.999 11.618 -5.190 1.00 0.00 C ATOM 1131 O2' A B 6 10.855 10.840 -4.384 1.00 0.00 O ATOM 1132 C1' A B 6 9.793 13.024 -4.657 1.00 0.00 C ATOM 1133 N9 A B 6 8.889 13.055 -3.490 1.00 0.00 N ATOM 1134 C8 A B 6 7.954 12.132 -3.088 1.00 0.00 C ATOM 1135 N7 A B 6 7.323 12.451 -1.992 1.00 0.00 N ATOM 1136 C5 A B 6 7.887 13.677 -1.637 1.00 0.00 C ATOM 1137 C6 A B 6 7.682 14.557 -0.558 1.00 0.00 C ATOM 1138 N6 A B 6 6.800 14.343 0.420 1.00 0.00 N ATOM 1139 N1 A B 6 8.420 15.673 -0.497 1.00 0.00 N ATOM 1140 C2 A B 6 9.311 15.904 -1.448 1.00 0.00 C ATOM 1141 N3 A B 6 9.608 15.170 -2.510 1.00 0.00 N ATOM 1142 C4 A B 6 8.839 14.054 -2.545 1.00 0.00 C ATOM 0 H5' A B 6 8.759 11.816 -8.387 1.00 0.00 H new ATOM 0 H5'' A B 6 7.744 12.209 -7.014 1.00 0.00 H new ATOM 0 H4' A B 6 10.228 13.822 -7.605 1.00 0.00 H new ATOM 0 H3' A B 6 10.619 11.137 -7.264 1.00 0.00 H new ATOM 0 H2' A B 6 9.105 10.995 -5.221 1.00 0.00 H new ATOM 0 HO2' A B 6 10.798 9.901 -4.658 1.00 0.00 H new ATOM 0 H1' A B 6 10.723 13.450 -4.281 1.00 0.00 H new ATOM 0 H8 A B 6 7.758 11.220 -3.633 1.00 0.00 H new ATOM 0 H61 A B 6 6.700 15.022 1.175 1.00 0.00 H new ATOM 0 H62 A B 6 6.225 13.500 0.413 1.00 0.00 H new ATOM 0 H2 A B 6 9.875 16.819 -1.344 1.00 0.00 H new ATOM 1154 P U B 7 12.806 12.811 -7.708 1.00 0.00 P ATOM 1155 OP1 U B 7 11.944 12.702 -8.903 1.00 0.00 O ATOM 1156 OP2 U B 7 14.081 12.063 -7.661 1.00 0.00 O ATOM 1157 O5' U B 7 13.139 14.370 -7.456 1.00 0.00 O ATOM 1158 C5' U B 7 12.197 15.389 -7.717 1.00 0.00 C ATOM 1159 C4' U B 7 12.809 16.758 -7.413 1.00 0.00 C ATOM 1160 O4' U B 7 11.807 17.754 -7.528 1.00 0.00 O ATOM 1161 C3' U B 7 13.246 16.830 -5.957 1.00 0.00 C ATOM 1162 O3' U B 7 14.090 17.952 -5.779 1.00 0.00 O ATOM 1163 C2' U B 7 11.894 17.013 -5.281 1.00 0.00 C ATOM 1164 O2' U B 7 12.010 17.651 -4.025 1.00 0.00 O ATOM 1165 C1' U B 7 11.113 17.856 -6.290 1.00 0.00 C ATOM 1166 N1 U B 7 9.674 17.487 -6.444 1.00 0.00 N ATOM 1167 C2 U B 7 8.969 18.123 -7.460 1.00 0.00 C ATOM 1168 O2 U B 7 9.478 18.956 -8.203 1.00 0.00 O ATOM 1169 N3 U B 7 7.635 17.781 -7.604 1.00 0.00 N ATOM 1170 C4 U B 7 6.944 16.868 -6.823 1.00 0.00 C ATOM 1171 O4 U B 7 5.755 16.630 -7.035 1.00 0.00 O ATOM 1172 C5 U B 7 7.745 16.267 -5.783 1.00 0.00 C ATOM 1173 C6 U B 7 9.051 16.580 -5.624 1.00 0.00 C ATOM 0 H5' U B 7 11.306 15.237 -7.108 1.00 0.00 H new ATOM 0 H5'' U B 7 11.882 15.346 -8.760 1.00 0.00 H new ATOM 0 H4' U B 7 13.642 16.905 -8.101 1.00 0.00 H new ATOM 0 H3' U B 7 13.814 15.981 -5.577 1.00 0.00 H new ATOM 0 H2' U B 7 11.402 16.068 -5.051 1.00 0.00 H new ATOM 0 HO2' U B 7 11.119 17.767 -3.633 1.00 0.00 H new ATOM 0 HO3' U B 7 13.798 18.460 -4.993 1.00 0.00 H new ATOM 0 H1' U B 7 11.072 18.881 -5.921 1.00 0.00 H new ATOM 0 H3 U B 7 7.115 18.242 -8.351 1.00 0.00 H new ATOM 0 H5 U B 7 7.290 15.550 -5.116 1.00 0.00 H new ATOM 0 H6 U B 7 9.616 16.106 -4.835 1.00 0.00 H new TER 1185 U B 7 HETATM 1186 ZN ZN A 187 -2.754 0.621 -10.410 1.00 0.00 ZN HETATM 1187 ZN ZN A 188 4.943 -3.683 5.776 1.00 0.00 ZN