USER MOD reduce.3.24.130724 H: found=0, std=0, add=269, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 270 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 157 HIS HE2 : A 157 HIS NE2 : A 201 ZNZN :(H bumps) USER MOD NoAdj-H: A 161 HIS HE2 : A 161 HIS NE2 : A 201 ZNZN :(H bumps) USER MOD Set 1.1: A 137 LYS NZ :NH3+ -109:sc= 0.905 (180deg=-0.00594) USER MOD Set 1.2: A 147 SER OG : rot 180:sc= -0.552 USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD Single : A 133 SER OG : rot -15:sc= 0.852! USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 139 TYR OH : rot 180:sc= -0.553 USER MOD Single : A 140 GLN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 SER OG : rot 64:sc= 0.356 USER MOD Single : A 150 GLN : amide:sc= -1.07 K(o=-1.1,f=-2.3) USER MOD Single : A 153 SER OG : rot 180:sc= -0.548 USER MOD Single : A 162 THR OG1 : rot 180:sc= 0 USER MOD Single : A 164 SER OG : rot 180:sc= 0 USER MOD Single : A 167 SER OG : rot 180:sc= 0 USER MOD Single : A 168 SER OG : rot -71:sc= 0.937 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 129 2.712 20.650 17.630 1.00 0.00 N ATOM 2 CA GLY A 129 3.673 20.850 16.561 1.00 0.00 C ATOM 3 C GLY A 129 3.874 19.603 15.722 1.00 0.00 C ATOM 4 O GLY A 129 4.954 19.384 15.173 1.00 0.00 O ATOM 0 HA2 GLY A 129 3.335 21.665 15.920 1.00 0.00 H new ATOM 0 HA3 GLY A 129 4.628 21.155 16.988 1.00 0.00 H new ATOM 8 N SER A 130 2.832 18.784 15.624 1.00 0.00 N ATOM 9 CA SER A 130 2.901 17.550 14.850 1.00 0.00 C ATOM 10 C SER A 130 1.662 17.388 13.975 1.00 0.00 C ATOM 11 O SER A 130 0.584 17.049 14.462 1.00 0.00 O ATOM 12 CB SER A 130 3.041 16.345 15.783 1.00 0.00 C ATOM 13 OG SER A 130 3.247 15.152 15.048 1.00 0.00 O ATOM 0 H SER A 130 1.931 18.952 16.070 1.00 0.00 H new ATOM 0 HA SER A 130 3.777 17.604 14.204 1.00 0.00 H new ATOM 0 HB2 SER A 130 3.876 16.504 16.465 1.00 0.00 H new ATOM 0 HB3 SER A 130 2.144 16.249 16.395 1.00 0.00 H new ATOM 0 HG SER A 130 3.335 14.397 15.667 1.00 0.00 H new ATOM 19 N SER A 131 1.826 17.632 12.678 1.00 0.00 N ATOM 20 CA SER A 131 0.721 17.518 11.734 1.00 0.00 C ATOM 21 C SER A 131 1.022 16.466 10.671 1.00 0.00 C ATOM 22 O SER A 131 2.132 16.399 10.145 1.00 0.00 O ATOM 23 CB SER A 131 0.449 18.868 11.068 1.00 0.00 C ATOM 24 OG SER A 131 1.646 19.611 10.913 1.00 0.00 O ATOM 0 H SER A 131 2.713 17.910 12.258 1.00 0.00 H new ATOM 0 HA SER A 131 -0.166 17.209 12.287 1.00 0.00 H new ATOM 0 HB2 SER A 131 -0.013 18.710 10.094 1.00 0.00 H new ATOM 0 HB3 SER A 131 -0.261 19.437 11.669 1.00 0.00 H new ATOM 0 HG SER A 131 1.445 20.469 10.484 1.00 0.00 H new ATOM 30 N GLY A 132 0.023 15.645 10.359 1.00 0.00 N ATOM 31 CA GLY A 132 0.200 14.607 9.361 1.00 0.00 C ATOM 32 C GLY A 132 -1.120 14.062 8.851 1.00 0.00 C ATOM 33 O GLY A 132 -2.073 14.814 8.647 1.00 0.00 O ATOM 0 H GLY A 132 -0.905 15.681 10.780 1.00 0.00 H new ATOM 0 HA2 GLY A 132 0.773 15.006 8.524 1.00 0.00 H new ATOM 0 HA3 GLY A 132 0.785 13.793 9.788 1.00 0.00 H new ATOM 37 N SER A 133 -1.175 12.750 8.644 1.00 0.00 N ATOM 38 CA SER A 133 -2.386 12.105 8.149 1.00 0.00 C ATOM 39 C SER A 133 -3.492 12.149 9.199 1.00 0.00 C ATOM 40 O SER A 133 -3.309 11.694 10.329 1.00 0.00 O ATOM 41 CB SER A 133 -2.095 10.655 7.759 1.00 0.00 C ATOM 42 OG SER A 133 -2.332 9.777 8.846 1.00 0.00 O ATOM 0 H SER A 133 -0.396 12.113 8.811 1.00 0.00 H new ATOM 0 HA SER A 133 -2.723 12.650 7.267 1.00 0.00 H new ATOM 0 HB2 SER A 133 -2.721 10.370 6.914 1.00 0.00 H new ATOM 0 HB3 SER A 133 -1.059 10.564 7.433 1.00 0.00 H new ATOM 0 HG SER A 133 -2.399 10.294 9.676 1.00 0.00 H new ATOM 48 N SER A 134 -4.641 12.699 8.818 1.00 0.00 N ATOM 49 CA SER A 134 -5.776 12.806 9.727 1.00 0.00 C ATOM 50 C SER A 134 -7.058 12.325 9.054 1.00 0.00 C ATOM 51 O SER A 134 -7.880 13.127 8.613 1.00 0.00 O ATOM 52 CB SER A 134 -5.945 14.252 10.198 1.00 0.00 C ATOM 53 OG SER A 134 -6.803 14.325 11.323 1.00 0.00 O ATOM 0 H SER A 134 -4.810 13.077 7.886 1.00 0.00 H new ATOM 0 HA SER A 134 -5.579 12.171 10.591 1.00 0.00 H new ATOM 0 HB2 SER A 134 -4.971 14.671 10.452 1.00 0.00 H new ATOM 0 HB3 SER A 134 -6.351 14.857 9.387 1.00 0.00 H new ATOM 0 HG SER A 134 -6.893 15.259 11.605 1.00 0.00 H new ATOM 59 N GLY A 135 -7.221 11.007 8.978 1.00 0.00 N ATOM 60 CA GLY A 135 -8.404 10.441 8.358 1.00 0.00 C ATOM 61 C GLY A 135 -8.342 8.929 8.264 1.00 0.00 C ATOM 62 O GLY A 135 -7.317 8.366 7.881 1.00 0.00 O ATOM 0 H GLY A 135 -6.555 10.322 9.335 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -9.285 10.731 8.931 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -8.522 10.860 7.359 1.00 0.00 H new ATOM 66 N GLU A 136 -9.442 8.270 8.617 1.00 0.00 N ATOM 67 CA GLU A 136 -9.506 6.814 8.573 1.00 0.00 C ATOM 68 C GLU A 136 -9.797 6.325 7.158 1.00 0.00 C ATOM 69 O GLU A 136 -10.273 7.082 6.312 1.00 0.00 O ATOM 70 CB GLU A 136 -10.581 6.300 9.533 1.00 0.00 C ATOM 71 CG GLU A 136 -10.036 5.880 10.888 1.00 0.00 C ATOM 72 CD GLU A 136 -10.959 4.923 11.617 1.00 0.00 C ATOM 73 OE1 GLU A 136 -12.187 5.004 11.402 1.00 0.00 O ATOM 74 OE2 GLU A 136 -10.455 4.093 12.402 1.00 0.00 O ATOM 0 H GLU A 136 -10.299 8.721 8.936 1.00 0.00 H new ATOM 0 HA GLU A 136 -8.536 6.424 8.882 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -11.330 7.079 9.677 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -11.089 5.451 9.076 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -9.063 5.408 10.754 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -9.879 6.766 11.503 1.00 0.00 H new ATOM 81 N LYS A 137 -9.507 5.053 6.906 1.00 0.00 N ATOM 82 CA LYS A 137 -9.737 4.460 5.594 1.00 0.00 C ATOM 83 C LYS A 137 -10.725 3.301 5.687 1.00 0.00 C ATOM 84 O LYS A 137 -10.895 2.681 6.736 1.00 0.00 O ATOM 85 CB LYS A 137 -8.417 3.971 4.994 1.00 0.00 C ATOM 86 CG LYS A 137 -7.495 5.096 4.557 1.00 0.00 C ATOM 87 CD LYS A 137 -6.459 4.611 3.555 1.00 0.00 C ATOM 88 CE LYS A 137 -5.480 5.714 3.187 1.00 0.00 C ATOM 89 NZ LYS A 137 -4.070 5.237 3.216 1.00 0.00 N ATOM 0 H LYS A 137 -9.112 4.412 7.594 1.00 0.00 H new ATOM 0 HA LYS A 137 -10.162 5.226 4.946 1.00 0.00 H new ATOM 0 HB2 LYS A 137 -7.900 3.353 5.729 1.00 0.00 H new ATOM 0 HB3 LYS A 137 -8.631 3.334 4.136 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -8.084 5.899 4.113 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -6.992 5.514 5.429 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -5.914 3.765 3.974 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -6.961 4.254 2.656 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -5.715 6.091 2.192 1.00 0.00 H new ATOM 0 HE3 LYS A 137 -5.596 6.548 3.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 -3.578 5.658 4.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 -4.056 4.201 3.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -3.590 5.519 2.337 1.00 0.00 H new ATOM 103 N PRO A 138 -11.393 3.001 4.563 1.00 0.00 N ATOM 104 CA PRO A 138 -12.374 1.914 4.491 1.00 0.00 C ATOM 105 C PRO A 138 -11.723 0.538 4.590 1.00 0.00 C ATOM 106 O PRO A 138 -12.403 -0.467 4.797 1.00 0.00 O ATOM 107 CB PRO A 138 -13.015 2.105 3.115 1.00 0.00 C ATOM 108 CG PRO A 138 -11.981 2.814 2.310 1.00 0.00 C ATOM 109 CD PRO A 138 -11.240 3.698 3.275 1.00 0.00 C ATOM 0 HA PRO A 138 -13.085 1.952 5.316 1.00 0.00 H new ATOM 0 HB2 PRO A 138 -13.279 1.148 2.665 1.00 0.00 H new ATOM 0 HB3 PRO A 138 -13.933 2.689 3.183 1.00 0.00 H new ATOM 0 HG2 PRO A 138 -11.305 2.105 1.832 1.00 0.00 H new ATOM 0 HG3 PRO A 138 -12.440 3.402 1.516 1.00 0.00 H new ATOM 0 HD2 PRO A 138 -10.191 3.805 2.998 1.00 0.00 H new ATOM 0 HD3 PRO A 138 -11.665 4.701 3.308 1.00 0.00 H new ATOM 117 N TYR A 139 -10.404 0.501 4.440 1.00 0.00 N ATOM 118 CA TYR A 139 -9.662 -0.752 4.510 1.00 0.00 C ATOM 119 C TYR A 139 -8.465 -0.625 5.448 1.00 0.00 C ATOM 120 O TYR A 139 -7.882 0.450 5.585 1.00 0.00 O ATOM 121 CB TYR A 139 -9.189 -1.168 3.115 1.00 0.00 C ATOM 122 CG TYR A 139 -10.290 -1.173 2.079 1.00 0.00 C ATOM 123 CD1 TYR A 139 -11.251 -2.176 2.064 1.00 0.00 C ATOM 124 CD2 TYR A 139 -10.368 -0.175 1.115 1.00 0.00 C ATOM 125 CE1 TYR A 139 -12.259 -2.185 1.118 1.00 0.00 C ATOM 126 CE2 TYR A 139 -11.373 -0.175 0.167 1.00 0.00 C ATOM 127 CZ TYR A 139 -12.316 -1.182 0.173 1.00 0.00 C ATOM 128 OH TYR A 139 -13.317 -1.187 -0.771 1.00 0.00 O ATOM 0 H TYR A 139 -9.827 1.324 4.269 1.00 0.00 H new ATOM 0 HA TYR A 139 -10.330 -1.518 4.904 1.00 0.00 H new ATOM 0 HB2 TYR A 139 -8.400 -0.490 2.791 1.00 0.00 H new ATOM 0 HB3 TYR A 139 -8.750 -2.164 3.171 1.00 0.00 H new ATOM 0 HD1 TYR A 139 -11.210 -2.962 2.804 1.00 0.00 H new ATOM 0 HD2 TYR A 139 -9.630 0.614 1.107 1.00 0.00 H new ATOM 0 HE1 TYR A 139 -12.998 -2.973 1.119 1.00 0.00 H new ATOM 0 HE2 TYR A 139 -11.420 0.609 -0.575 1.00 0.00 H new ATOM 0 HH TYR A 139 -13.214 -0.411 -1.361 1.00 0.00 H new ATOM 138 N GLN A 140 -8.106 -1.731 6.090 1.00 0.00 N ATOM 139 CA GLN A 140 -6.979 -1.744 7.016 1.00 0.00 C ATOM 140 C GLN A 140 -6.372 -3.140 7.115 1.00 0.00 C ATOM 141 O GLN A 140 -7.077 -4.120 7.358 1.00 0.00 O ATOM 142 CB GLN A 140 -7.423 -1.270 8.400 1.00 0.00 C ATOM 143 CG GLN A 140 -6.270 -1.036 9.363 1.00 0.00 C ATOM 144 CD GLN A 140 -6.708 -1.053 10.814 1.00 0.00 C ATOM 145 OE1 GLN A 140 -7.811 -0.618 11.147 1.00 0.00 O ATOM 146 NE2 GLN A 140 -5.844 -1.558 11.687 1.00 0.00 N ATOM 0 H GLN A 140 -8.578 -2.629 5.987 1.00 0.00 H new ATOM 0 HA GLN A 140 -6.219 -1.063 6.633 1.00 0.00 H new ATOM 0 HB2 GLN A 140 -7.990 -0.345 8.293 1.00 0.00 H new ATOM 0 HB3 GLN A 140 -8.099 -2.010 8.829 1.00 0.00 H new ATOM 0 HG2 GLN A 140 -5.511 -1.803 9.208 1.00 0.00 H new ATOM 0 HG3 GLN A 140 -5.804 -0.076 9.139 1.00 0.00 H new ATOM 0 HE21 GLN A 140 -4.941 -1.907 11.367 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -6.084 -1.597 12.678 1.00 0.00 H new ATOM 155 N CYS A 141 -5.059 -3.224 6.924 1.00 0.00 N ATOM 156 CA CYS A 141 -4.356 -4.499 6.990 1.00 0.00 C ATOM 157 C CYS A 141 -4.353 -5.045 8.415 1.00 0.00 C ATOM 158 O CYS A 141 -4.143 -4.304 9.376 1.00 0.00 O ATOM 159 CB CYS A 141 -2.919 -4.340 6.490 1.00 0.00 C ATOM 160 SG CYS A 141 -2.050 -5.916 6.210 1.00 0.00 S ATOM 0 H CYS A 141 -4.461 -2.423 6.722 1.00 0.00 H new ATOM 0 HA CYS A 141 -4.880 -5.208 6.349 1.00 0.00 H new ATOM 0 HB2 CYS A 141 -2.930 -3.773 5.559 1.00 0.00 H new ATOM 0 HB3 CYS A 141 -2.357 -3.751 7.215 1.00 0.00 H new ATOM 165 N LYS A 142 -4.587 -6.346 8.545 1.00 0.00 N ATOM 166 CA LYS A 142 -4.610 -6.994 9.852 1.00 0.00 C ATOM 167 C LYS A 142 -3.330 -7.789 10.087 1.00 0.00 C ATOM 168 O LYS A 142 -3.326 -8.766 10.835 1.00 0.00 O ATOM 169 CB LYS A 142 -5.825 -7.917 9.965 1.00 0.00 C ATOM 170 CG LYS A 142 -5.797 -9.082 8.991 1.00 0.00 C ATOM 171 CD LYS A 142 -6.670 -8.817 7.777 1.00 0.00 C ATOM 172 CE LYS A 142 -6.547 -9.930 6.748 1.00 0.00 C ATOM 173 NZ LYS A 142 -7.560 -10.999 6.963 1.00 0.00 N ATOM 0 H LYS A 142 -4.764 -6.974 7.761 1.00 0.00 H new ATOM 0 HA LYS A 142 -4.680 -6.218 10.614 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -5.882 -8.306 10.982 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -6.730 -7.334 9.795 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -4.771 -9.264 8.670 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -6.138 -9.986 9.495 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -7.710 -8.722 8.089 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -6.386 -7.868 7.323 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -6.665 -9.514 5.747 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -5.547 -10.362 6.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -7.443 -11.739 6.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -7.432 -11.414 7.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -8.514 -10.593 6.890 1.00 0.00 H new ATOM 187 N GLU A 143 -2.247 -7.363 9.445 1.00 0.00 N ATOM 188 CA GLU A 143 -0.962 -8.037 9.586 1.00 0.00 C ATOM 189 C GLU A 143 0.101 -7.076 10.114 1.00 0.00 C ATOM 190 O GLU A 143 0.991 -7.471 10.867 1.00 0.00 O ATOM 191 CB GLU A 143 -0.516 -8.620 8.243 1.00 0.00 C ATOM 192 CG GLU A 143 -1.611 -9.384 7.518 1.00 0.00 C ATOM 193 CD GLU A 143 -2.223 -10.478 8.372 1.00 0.00 C ATOM 194 OE1 GLU A 143 -1.582 -10.885 9.364 1.00 0.00 O ATOM 195 OE2 GLU A 143 -3.342 -10.926 8.048 1.00 0.00 O ATOM 0 H GLU A 143 -2.234 -6.555 8.823 1.00 0.00 H new ATOM 0 HA GLU A 143 -1.083 -8.848 10.304 1.00 0.00 H new ATOM 0 HB2 GLU A 143 -0.165 -7.810 7.603 1.00 0.00 H new ATOM 0 HB3 GLU A 143 0.331 -9.285 8.409 1.00 0.00 H new ATOM 0 HG2 GLU A 143 -2.392 -8.688 7.211 1.00 0.00 H new ATOM 0 HG3 GLU A 143 -1.201 -9.824 6.609 1.00 0.00 H new ATOM 202 N CYS A 144 0.000 -5.814 9.712 1.00 0.00 N ATOM 203 CA CYS A 144 0.952 -4.796 10.142 1.00 0.00 C ATOM 204 C CYS A 144 0.226 -3.572 10.693 1.00 0.00 C ATOM 205 O CYS A 144 0.672 -2.957 11.661 1.00 0.00 O ATOM 206 CB CYS A 144 1.853 -4.386 8.976 1.00 0.00 C ATOM 207 SG CYS A 144 0.948 -3.826 7.497 1.00 0.00 S ATOM 0 H CYS A 144 -0.731 -5.471 9.089 1.00 0.00 H new ATOM 0 HA CYS A 144 1.567 -5.220 10.936 1.00 0.00 H new ATOM 0 HB2 CYS A 144 2.516 -3.587 9.307 1.00 0.00 H new ATOM 0 HB3 CYS A 144 2.484 -5.232 8.704 1.00 0.00 H new ATOM 212 N GLY A 145 -0.895 -3.224 10.070 1.00 0.00 N ATOM 213 CA GLY A 145 -1.665 -2.076 10.512 1.00 0.00 C ATOM 214 C GLY A 145 -1.797 -1.018 9.435 1.00 0.00 C ATOM 215 O GLY A 145 -2.113 0.137 9.724 1.00 0.00 O ATOM 0 H GLY A 145 -1.284 -3.717 9.266 1.00 0.00 H new ATOM 0 HA2 GLY A 145 -2.658 -2.404 10.818 1.00 0.00 H new ATOM 0 HA3 GLY A 145 -1.189 -1.639 11.390 1.00 0.00 H new ATOM 219 N LYS A 146 -1.554 -1.410 8.189 1.00 0.00 N ATOM 220 CA LYS A 146 -1.648 -0.487 7.064 1.00 0.00 C ATOM 221 C LYS A 146 -3.104 -0.161 6.748 1.00 0.00 C ATOM 222 O LYS A 146 -4.020 -0.715 7.354 1.00 0.00 O ATOM 223 CB LYS A 146 -0.968 -1.085 5.830 1.00 0.00 C ATOM 224 CG LYS A 146 0.302 -0.359 5.423 1.00 0.00 C ATOM 225 CD LYS A 146 0.375 -0.163 3.918 1.00 0.00 C ATOM 226 CE LYS A 146 0.980 1.185 3.560 1.00 0.00 C ATOM 227 NZ LYS A 146 -0.024 2.282 3.638 1.00 0.00 N ATOM 0 H LYS A 146 -1.290 -2.361 7.933 1.00 0.00 H new ATOM 0 HA LYS A 146 -1.139 0.437 7.340 1.00 0.00 H new ATOM 0 HB2 LYS A 146 -0.731 -2.131 6.027 1.00 0.00 H new ATOM 0 HB3 LYS A 146 -1.669 -1.069 4.996 1.00 0.00 H new ATOM 0 HG2 LYS A 146 0.343 0.611 5.919 1.00 0.00 H new ATOM 0 HG3 LYS A 146 1.170 -0.926 5.759 1.00 0.00 H new ATOM 0 HD2 LYS A 146 0.972 -0.960 3.475 1.00 0.00 H new ATOM 0 HD3 LYS A 146 -0.625 -0.239 3.491 1.00 0.00 H new ATOM 0 HE2 LYS A 146 1.808 1.402 4.235 1.00 0.00 H new ATOM 0 HE3 LYS A 146 1.393 1.142 2.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 0.428 3.184 3.387 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 -0.802 2.088 2.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 -0.400 2.341 4.606 1.00 0.00 H new ATOM 241 N SER A 147 -3.309 0.741 5.793 1.00 0.00 N ATOM 242 CA SER A 147 -4.654 1.143 5.398 1.00 0.00 C ATOM 243 C SER A 147 -4.676 1.612 3.946 1.00 0.00 C ATOM 244 O SER A 147 -3.803 2.363 3.510 1.00 0.00 O ATOM 245 CB SER A 147 -5.166 2.257 6.313 1.00 0.00 C ATOM 246 OG SER A 147 -4.661 3.519 5.912 1.00 0.00 O ATOM 0 H SER A 147 -2.561 1.207 5.279 1.00 0.00 H new ATOM 0 HA SER A 147 -5.308 0.276 5.492 1.00 0.00 H new ATOM 0 HB2 SER A 147 -6.256 2.275 6.294 1.00 0.00 H new ATOM 0 HB3 SER A 147 -4.868 2.053 7.341 1.00 0.00 H new ATOM 0 HG SER A 147 -5.004 4.214 6.511 1.00 0.00 H new ATOM 252 N PHE A 148 -5.682 1.164 3.202 1.00 0.00 N ATOM 253 CA PHE A 148 -5.819 1.535 1.798 1.00 0.00 C ATOM 254 C PHE A 148 -7.218 2.073 1.512 1.00 0.00 C ATOM 255 O PHE A 148 -8.139 1.893 2.309 1.00 0.00 O ATOM 256 CB PHE A 148 -5.529 0.331 0.899 1.00 0.00 C ATOM 257 CG PHE A 148 -4.124 -0.184 1.022 1.00 0.00 C ATOM 258 CD1 PHE A 148 -3.764 -1.010 2.074 1.00 0.00 C ATOM 259 CD2 PHE A 148 -3.163 0.157 0.084 1.00 0.00 C ATOM 260 CE1 PHE A 148 -2.472 -1.485 2.190 1.00 0.00 C ATOM 261 CE2 PHE A 148 -1.868 -0.315 0.194 1.00 0.00 C ATOM 262 CZ PHE A 148 -1.523 -1.138 1.248 1.00 0.00 C ATOM 0 H PHE A 148 -6.414 0.544 3.548 1.00 0.00 H new ATOM 0 HA PHE A 148 -5.095 2.322 1.584 1.00 0.00 H new ATOM 0 HB2 PHE A 148 -6.224 -0.472 1.145 1.00 0.00 H new ATOM 0 HB3 PHE A 148 -5.716 0.609 -0.138 1.00 0.00 H new ATOM 0 HD1 PHE A 148 -4.502 -1.286 2.812 1.00 0.00 H new ATOM 0 HD2 PHE A 148 -3.429 0.799 -0.743 1.00 0.00 H new ATOM 0 HE1 PHE A 148 -2.204 -2.127 3.016 1.00 0.00 H new ATOM 0 HE2 PHE A 148 -1.128 -0.041 -0.543 1.00 0.00 H new ATOM 0 HZ PHE A 148 -0.513 -1.510 1.336 1.00 0.00 H new ATOM 272 N SER A 149 -7.369 2.735 0.370 1.00 0.00 N ATOM 273 CA SER A 149 -8.654 3.304 -0.020 1.00 0.00 C ATOM 274 C SER A 149 -9.244 2.548 -1.207 1.00 0.00 C ATOM 275 O SER A 149 -10.081 3.077 -1.938 1.00 0.00 O ATOM 276 CB SER A 149 -8.494 4.784 -0.373 1.00 0.00 C ATOM 277 OG SER A 149 -8.187 4.951 -1.746 1.00 0.00 O ATOM 0 H SER A 149 -6.618 2.891 -0.302 1.00 0.00 H new ATOM 0 HA SER A 149 -9.337 3.211 0.825 1.00 0.00 H new ATOM 0 HB2 SER A 149 -9.413 5.319 -0.135 1.00 0.00 H new ATOM 0 HB3 SER A 149 -7.703 5.223 0.236 1.00 0.00 H new ATOM 0 HG SER A 149 -8.935 4.627 -2.290 1.00 0.00 H new ATOM 283 N GLN A 150 -8.802 1.308 -1.390 1.00 0.00 N ATOM 284 CA GLN A 150 -9.286 0.479 -2.488 1.00 0.00 C ATOM 285 C GLN A 150 -9.212 -1.001 -2.126 1.00 0.00 C ATOM 286 O GLN A 150 -8.158 -1.501 -1.734 1.00 0.00 O ATOM 287 CB GLN A 150 -8.472 0.748 -3.755 1.00 0.00 C ATOM 288 CG GLN A 150 -8.609 2.170 -4.275 1.00 0.00 C ATOM 289 CD GLN A 150 -10.030 2.509 -4.680 1.00 0.00 C ATOM 290 OE1 GLN A 150 -10.844 1.621 -4.936 1.00 0.00 O ATOM 291 NE2 GLN A 150 -10.337 3.800 -4.740 1.00 0.00 N ATOM 0 H GLN A 150 -8.110 0.855 -0.793 1.00 0.00 H new ATOM 0 HA GLN A 150 -10.329 0.737 -2.673 1.00 0.00 H new ATOM 0 HB2 GLN A 150 -7.421 0.544 -3.552 1.00 0.00 H new ATOM 0 HB3 GLN A 150 -8.787 0.053 -4.534 1.00 0.00 H new ATOM 0 HG2 GLN A 150 -8.278 2.868 -3.505 1.00 0.00 H new ATOM 0 HG3 GLN A 150 -7.949 2.305 -5.132 1.00 0.00 H new ATOM 0 HE21 GLN A 150 -9.631 4.503 -4.520 1.00 0.00 H new ATOM 0 HE22 GLN A 150 -11.278 4.089 -5.006 1.00 0.00 H new ATOM 300 N ARG A 151 -10.337 -1.695 -2.261 1.00 0.00 N ATOM 301 CA ARG A 151 -10.400 -3.117 -1.946 1.00 0.00 C ATOM 302 C ARG A 151 -9.301 -3.884 -2.676 1.00 0.00 C ATOM 303 O ARG A 151 -8.713 -4.816 -2.130 1.00 0.00 O ATOM 304 CB ARG A 151 -11.769 -3.684 -2.323 1.00 0.00 C ATOM 305 CG ARG A 151 -11.946 -5.147 -1.950 1.00 0.00 C ATOM 306 CD ARG A 151 -13.183 -5.357 -1.091 1.00 0.00 C ATOM 307 NE ARG A 151 -13.326 -6.748 -0.668 1.00 0.00 N ATOM 308 CZ ARG A 151 -14.459 -7.262 -0.203 1.00 0.00 C ATOM 309 NH1 ARG A 151 -15.542 -6.504 -0.101 1.00 0.00 N ATOM 310 NH2 ARG A 151 -14.510 -8.537 0.161 1.00 0.00 N ATOM 0 H ARG A 151 -11.217 -1.296 -2.586 1.00 0.00 H new ATOM 0 HA ARG A 151 -10.249 -3.233 -0.873 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -12.544 -3.096 -1.831 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -11.916 -3.571 -3.397 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -12.025 -5.748 -2.856 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -11.065 -5.496 -1.412 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -13.127 -4.715 -0.212 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -14.068 -5.055 -1.651 1.00 0.00 H new ATOM 0 HE ARG A 151 -12.511 -7.358 -0.733 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -15.506 -5.524 -0.380 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -16.411 -6.901 0.256 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -13.679 -9.123 0.084 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -15.380 -8.931 0.518 1.00 0.00 H new ATOM 324 N GLY A 152 -9.030 -3.484 -3.915 1.00 0.00 N ATOM 325 CA GLY A 152 -8.003 -4.144 -4.700 1.00 0.00 C ATOM 326 C GLY A 152 -6.604 -3.815 -4.218 1.00 0.00 C ATOM 327 O GLY A 152 -5.732 -4.684 -4.182 1.00 0.00 O ATOM 0 H GLY A 152 -9.503 -2.715 -4.389 1.00 0.00 H new ATOM 0 HA2 GLY A 152 -8.154 -5.223 -4.657 1.00 0.00 H new ATOM 0 HA3 GLY A 152 -8.103 -3.849 -5.745 1.00 0.00 H new ATOM 331 N SER A 153 -6.387 -2.557 -3.849 1.00 0.00 N ATOM 332 CA SER A 153 -5.082 -2.114 -3.373 1.00 0.00 C ATOM 333 C SER A 153 -4.671 -2.882 -2.120 1.00 0.00 C ATOM 334 O SER A 153 -3.566 -3.420 -2.042 1.00 0.00 O ATOM 335 CB SER A 153 -5.105 -0.613 -3.080 1.00 0.00 C ATOM 336 OG SER A 153 -5.267 0.137 -4.272 1.00 0.00 O ATOM 0 H SER A 153 -7.098 -1.826 -3.871 1.00 0.00 H new ATOM 0 HA SER A 153 -4.351 -2.313 -4.156 1.00 0.00 H new ATOM 0 HB2 SER A 153 -5.918 -0.386 -2.391 1.00 0.00 H new ATOM 0 HB3 SER A 153 -4.178 -0.321 -2.586 1.00 0.00 H new ATOM 0 HG SER A 153 -5.280 1.093 -4.058 1.00 0.00 H new ATOM 342 N LEU A 154 -5.569 -2.928 -1.142 1.00 0.00 N ATOM 343 CA LEU A 154 -5.302 -3.630 0.109 1.00 0.00 C ATOM 344 C LEU A 154 -4.885 -5.073 -0.155 1.00 0.00 C ATOM 345 O LEU A 154 -3.882 -5.547 0.378 1.00 0.00 O ATOM 346 CB LEU A 154 -6.540 -3.601 1.007 1.00 0.00 C ATOM 347 CG LEU A 154 -6.569 -4.625 2.142 1.00 0.00 C ATOM 348 CD1 LEU A 154 -5.437 -4.366 3.124 1.00 0.00 C ATOM 349 CD2 LEU A 154 -7.914 -4.592 2.855 1.00 0.00 C ATOM 0 H LEU A 154 -6.488 -2.488 -1.191 1.00 0.00 H new ATOM 0 HA LEU A 154 -4.482 -3.121 0.615 1.00 0.00 H new ATOM 0 HB2 LEU A 154 -6.626 -2.605 1.441 1.00 0.00 H new ATOM 0 HB3 LEU A 154 -7.421 -3.755 0.383 1.00 0.00 H new ATOM 0 HG LEU A 154 -6.431 -5.618 1.714 1.00 0.00 H new ATOM 0 HD11 LEU A 154 -5.474 -5.105 3.925 1.00 0.00 H new ATOM 0 HD12 LEU A 154 -4.481 -4.440 2.605 1.00 0.00 H new ATOM 0 HD13 LEU A 154 -5.543 -3.367 3.547 1.00 0.00 H new ATOM 0 HD21 LEU A 154 -7.917 -5.327 3.660 1.00 0.00 H new ATOM 0 HD22 LEU A 154 -8.081 -3.598 3.270 1.00 0.00 H new ATOM 0 HD23 LEU A 154 -8.708 -4.827 2.146 1.00 0.00 H new ATOM 361 N ALA A 155 -5.660 -5.766 -0.982 1.00 0.00 N ATOM 362 CA ALA A 155 -5.369 -7.154 -1.320 1.00 0.00 C ATOM 363 C ALA A 155 -3.923 -7.316 -1.777 1.00 0.00 C ATOM 364 O ALA A 155 -3.206 -8.195 -1.301 1.00 0.00 O ATOM 365 CB ALA A 155 -6.323 -7.646 -2.398 1.00 0.00 C ATOM 0 H ALA A 155 -6.495 -5.389 -1.431 1.00 0.00 H new ATOM 0 HA ALA A 155 -5.509 -7.757 -0.423 1.00 0.00 H new ATOM 0 HB1 ALA A 155 -6.094 -8.684 -2.640 1.00 0.00 H new ATOM 0 HB2 ALA A 155 -7.349 -7.576 -2.036 1.00 0.00 H new ATOM 0 HB3 ALA A 155 -6.211 -7.031 -3.291 1.00 0.00 H new ATOM 371 N VAL A 156 -3.501 -6.461 -2.705 1.00 0.00 N ATOM 372 CA VAL A 156 -2.141 -6.509 -3.226 1.00 0.00 C ATOM 373 C VAL A 156 -1.117 -6.414 -2.100 1.00 0.00 C ATOM 374 O VAL A 156 -0.007 -6.935 -2.210 1.00 0.00 O ATOM 375 CB VAL A 156 -1.886 -5.374 -4.235 1.00 0.00 C ATOM 376 CG1 VAL A 156 -0.520 -5.534 -4.886 1.00 0.00 C ATOM 377 CG2 VAL A 156 -2.985 -5.338 -5.285 1.00 0.00 C ATOM 0 H VAL A 156 -4.082 -5.727 -3.110 1.00 0.00 H new ATOM 0 HA VAL A 156 -2.030 -7.467 -3.733 1.00 0.00 H new ATOM 0 HB VAL A 156 -1.897 -4.425 -3.698 1.00 0.00 H new ATOM 0 HG11 VAL A 156 -0.358 -4.723 -5.596 1.00 0.00 H new ATOM 0 HG12 VAL A 156 0.254 -5.505 -4.119 1.00 0.00 H new ATOM 0 HG13 VAL A 156 -0.476 -6.489 -5.410 1.00 0.00 H new ATOM 0 HG21 VAL A 156 -2.789 -4.530 -5.990 1.00 0.00 H new ATOM 0 HG22 VAL A 156 -3.009 -6.288 -5.819 1.00 0.00 H new ATOM 0 HG23 VAL A 156 -3.947 -5.170 -4.800 1.00 0.00 H new ATOM 387 N HIS A 157 -1.498 -5.744 -1.017 1.00 0.00 N ATOM 388 CA HIS A 157 -0.613 -5.580 0.131 1.00 0.00 C ATOM 389 C HIS A 157 -0.805 -6.716 1.131 1.00 0.00 C ATOM 390 O HIS A 157 0.037 -6.939 2.000 1.00 0.00 O ATOM 391 CB HIS A 157 -0.871 -4.236 0.813 1.00 0.00 C ATOM 392 CG HIS A 157 -0.165 -4.085 2.125 1.00 0.00 C ATOM 393 ND1 HIS A 157 1.074 -3.491 2.249 1.00 0.00 N ATOM 394 CD2 HIS A 157 -0.531 -4.453 3.375 1.00 0.00 C ATOM 395 CE1 HIS A 157 1.439 -3.502 3.519 1.00 0.00 C ATOM 396 NE2 HIS A 157 0.483 -4.080 4.223 1.00 0.00 N ATOM 0 H HIS A 157 -2.413 -5.306 -0.910 1.00 0.00 H new ATOM 0 HA HIS A 157 0.416 -5.605 -0.228 1.00 0.00 H new ATOM 0 HB2 HIS A 157 -0.557 -3.433 0.146 1.00 0.00 H new ATOM 0 HB3 HIS A 157 -1.943 -4.118 0.971 1.00 0.00 H new ATOM 0 HD1 HIS A 157 1.622 -3.104 1.481 1.00 0.00 H new ATOM 0 HD2 HIS A 157 -1.450 -4.948 3.654 1.00 0.00 H new ATOM 0 HE1 HIS A 157 2.363 -3.105 3.914 1.00 0.00 H new ATOM 404 N GLU A 158 -1.919 -7.430 1.002 1.00 0.00 N ATOM 405 CA GLU A 158 -2.222 -8.541 1.897 1.00 0.00 C ATOM 406 C GLU A 158 -1.701 -9.857 1.325 1.00 0.00 C ATOM 407 O GLU A 158 -1.639 -10.868 2.024 1.00 0.00 O ATOM 408 CB GLU A 158 -3.730 -8.638 2.134 1.00 0.00 C ATOM 409 CG GLU A 158 -4.333 -7.380 2.738 1.00 0.00 C ATOM 410 CD GLU A 158 -5.263 -7.678 3.898 1.00 0.00 C ATOM 411 OE1 GLU A 158 -6.296 -8.344 3.676 1.00 0.00 O ATOM 412 OE2 GLU A 158 -4.958 -7.245 5.029 1.00 0.00 O ATOM 0 H GLU A 158 -2.626 -7.259 0.287 1.00 0.00 H new ATOM 0 HA GLU A 158 -1.723 -8.354 2.848 1.00 0.00 H new ATOM 0 HB2 GLU A 158 -4.225 -8.850 1.186 1.00 0.00 H new ATOM 0 HB3 GLU A 158 -3.932 -9.481 2.795 1.00 0.00 H new ATOM 0 HG2 GLU A 158 -3.531 -6.725 3.079 1.00 0.00 H new ATOM 0 HG3 GLU A 158 -4.881 -6.838 1.967 1.00 0.00 H new ATOM 419 N ARG A 159 -1.328 -9.834 0.050 1.00 0.00 N ATOM 420 CA ARG A 159 -0.814 -11.025 -0.617 1.00 0.00 C ATOM 421 C ARG A 159 0.711 -11.003 -0.669 1.00 0.00 C ATOM 422 O ARG A 159 1.363 -12.036 -0.509 1.00 0.00 O ATOM 423 CB ARG A 159 -1.382 -11.127 -2.034 1.00 0.00 C ATOM 424 CG ARG A 159 -1.026 -9.944 -2.919 1.00 0.00 C ATOM 425 CD ARG A 159 0.144 -10.266 -3.836 1.00 0.00 C ATOM 426 NE ARG A 159 -0.146 -11.392 -4.718 1.00 0.00 N ATOM 427 CZ ARG A 159 0.663 -11.789 -5.694 1.00 0.00 C ATOM 428 NH1 ARG A 159 1.806 -11.153 -5.912 1.00 0.00 N ATOM 429 NH2 ARG A 159 0.330 -12.823 -6.455 1.00 0.00 N ATOM 0 H ARG A 159 -1.372 -9.005 -0.542 1.00 0.00 H new ATOM 0 HA ARG A 159 -1.128 -11.897 -0.043 1.00 0.00 H new ATOM 0 HB2 ARG A 159 -1.014 -12.042 -2.499 1.00 0.00 H new ATOM 0 HB3 ARG A 159 -2.467 -11.213 -1.976 1.00 0.00 H new ATOM 0 HG2 ARG A 159 -1.892 -9.663 -3.518 1.00 0.00 H new ATOM 0 HG3 ARG A 159 -0.776 -9.085 -2.297 1.00 0.00 H new ATOM 0 HD2 ARG A 159 0.386 -9.389 -4.436 1.00 0.00 H new ATOM 0 HD3 ARG A 159 1.024 -10.494 -3.234 1.00 0.00 H new ATOM 0 HE ARG A 159 -1.018 -11.902 -4.577 1.00 0.00 H new ATOM 0 HH11 ARG A 159 2.066 -10.357 -5.330 1.00 0.00 H new ATOM 0 HH12 ARG A 159 2.425 -11.460 -6.662 1.00 0.00 H new ATOM 0 HH21 ARG A 159 -0.549 -13.315 -6.291 1.00 0.00 H new ATOM 0 HH22 ARG A 159 0.952 -13.126 -7.204 1.00 0.00 H new ATOM 443 N LEU A 160 1.273 -9.821 -0.894 1.00 0.00 N ATOM 444 CA LEU A 160 2.722 -9.665 -0.967 1.00 0.00 C ATOM 445 C LEU A 160 3.360 -9.853 0.405 1.00 0.00 C ATOM 446 O LEU A 160 4.577 -10.006 0.520 1.00 0.00 O ATOM 447 CB LEU A 160 3.078 -8.284 -1.522 1.00 0.00 C ATOM 448 CG LEU A 160 3.567 -7.256 -0.502 1.00 0.00 C ATOM 449 CD1 LEU A 160 4.019 -5.983 -1.201 1.00 0.00 C ATOM 450 CD2 LEU A 160 2.475 -6.950 0.513 1.00 0.00 C ATOM 0 H LEU A 160 0.748 -8.957 -1.029 1.00 0.00 H new ATOM 0 HA LEU A 160 3.112 -10.432 -1.637 1.00 0.00 H new ATOM 0 HB2 LEU A 160 3.850 -8.408 -2.282 1.00 0.00 H new ATOM 0 HB3 LEU A 160 2.199 -7.879 -2.024 1.00 0.00 H new ATOM 0 HG LEU A 160 4.421 -7.678 0.029 1.00 0.00 H new ATOM 0 HD11 LEU A 160 4.364 -5.263 -0.459 1.00 0.00 H new ATOM 0 HD12 LEU A 160 4.833 -6.214 -1.888 1.00 0.00 H new ATOM 0 HD13 LEU A 160 3.184 -5.558 -1.758 1.00 0.00 H new ATOM 0 HD21 LEU A 160 2.841 -6.216 1.231 1.00 0.00 H new ATOM 0 HD22 LEU A 160 1.602 -6.549 -0.002 1.00 0.00 H new ATOM 0 HD23 LEU A 160 2.199 -7.865 1.038 1.00 0.00 H new ATOM 462 N HIS A 161 2.531 -9.844 1.444 1.00 0.00 N ATOM 463 CA HIS A 161 3.015 -10.017 2.810 1.00 0.00 C ATOM 464 C HIS A 161 3.857 -11.283 2.931 1.00 0.00 C ATOM 465 O HIS A 161 4.921 -11.277 3.552 1.00 0.00 O ATOM 466 CB HIS A 161 1.839 -10.077 3.786 1.00 0.00 C ATOM 467 CG HIS A 161 1.685 -8.839 4.614 1.00 0.00 C ATOM 468 ND1 HIS A 161 2.625 -8.428 5.536 1.00 0.00 N ATOM 469 CD2 HIS A 161 0.693 -7.919 4.656 1.00 0.00 C ATOM 470 CE1 HIS A 161 2.217 -7.310 6.109 1.00 0.00 C ATOM 471 NE2 HIS A 161 1.048 -6.980 5.593 1.00 0.00 N ATOM 0 H HIS A 161 1.522 -9.719 1.367 1.00 0.00 H new ATOM 0 HA HIS A 161 3.641 -9.160 3.059 1.00 0.00 H new ATOM 0 HB2 HIS A 161 0.920 -10.246 3.225 1.00 0.00 H new ATOM 0 HB3 HIS A 161 1.970 -10.933 4.448 1.00 0.00 H new ATOM 0 HD1 HIS A 161 3.499 -8.912 5.743 1.00 0.00 H new ATOM 0 HD2 HIS A 161 -0.210 -7.923 4.063 1.00 0.00 H new ATOM 0 HE1 HIS A 161 2.750 -6.759 6.870 1.00 0.00 H new ATOM 479 N THR A 162 3.375 -12.369 2.335 1.00 0.00 N ATOM 480 CA THR A 162 4.082 -13.643 2.378 1.00 0.00 C ATOM 481 C THR A 162 5.400 -13.566 1.616 1.00 0.00 C ATOM 482 O THR A 162 5.422 -13.270 0.422 1.00 0.00 O ATOM 483 CB THR A 162 3.227 -14.780 1.788 1.00 0.00 C ATOM 484 OG1 THR A 162 3.986 -15.994 1.749 1.00 0.00 O ATOM 485 CG2 THR A 162 2.750 -14.428 0.387 1.00 0.00 C ATOM 0 H THR A 162 2.497 -12.392 1.816 1.00 0.00 H new ATOM 0 HA THR A 162 4.284 -13.857 3.427 1.00 0.00 H new ATOM 0 HB THR A 162 2.355 -14.918 2.427 1.00 0.00 H new ATOM 0 HG1 THR A 162 3.435 -16.712 1.374 1.00 0.00 H new ATOM 0 HG21 THR A 162 2.148 -15.246 -0.009 1.00 0.00 H new ATOM 0 HG22 THR A 162 2.148 -13.520 0.425 1.00 0.00 H new ATOM 0 HG23 THR A 162 3.612 -14.265 -0.260 1.00 0.00 H new ATOM 493 N GLY A 163 6.499 -13.835 2.315 1.00 0.00 N ATOM 494 CA GLY A 163 7.806 -13.791 1.687 1.00 0.00 C ATOM 495 C GLY A 163 8.785 -14.763 2.316 1.00 0.00 C ATOM 496 O GLY A 163 8.607 -15.179 3.461 1.00 0.00 O ATOM 0 H GLY A 163 6.507 -14.082 3.304 1.00 0.00 H new ATOM 0 HA2 GLY A 163 7.704 -14.019 0.626 1.00 0.00 H new ATOM 0 HA3 GLY A 163 8.206 -12.780 1.759 1.00 0.00 H new ATOM 500 N SER A 164 9.820 -15.126 1.567 1.00 0.00 N ATOM 501 CA SER A 164 10.828 -16.060 2.057 1.00 0.00 C ATOM 502 C SER A 164 11.577 -15.474 3.249 1.00 0.00 C ATOM 503 O SER A 164 11.840 -14.273 3.303 1.00 0.00 O ATOM 504 CB SER A 164 11.815 -16.409 0.941 1.00 0.00 C ATOM 505 OG SER A 164 11.556 -17.699 0.415 1.00 0.00 O ATOM 0 H SER A 164 9.983 -14.788 0.619 1.00 0.00 H new ATOM 0 HA SER A 164 10.320 -16.969 2.380 1.00 0.00 H new ATOM 0 HB2 SER A 164 11.745 -15.668 0.145 1.00 0.00 H new ATOM 0 HB3 SER A 164 12.834 -16.368 1.326 1.00 0.00 H new ATOM 0 HG SER A 164 12.199 -17.897 -0.297 1.00 0.00 H new ATOM 511 N GLY A 165 11.918 -16.332 4.206 1.00 0.00 N ATOM 512 CA GLY A 165 12.634 -15.882 5.386 1.00 0.00 C ATOM 513 C GLY A 165 12.371 -16.760 6.593 1.00 0.00 C ATOM 514 O GLY A 165 11.654 -16.381 7.519 1.00 0.00 O ATOM 0 H GLY A 165 11.711 -17.331 4.185 1.00 0.00 H new ATOM 0 HA2 GLY A 165 13.703 -15.870 5.176 1.00 0.00 H new ATOM 0 HA3 GLY A 165 12.342 -14.857 5.615 1.00 0.00 H new ATOM 518 N PRO A 166 12.960 -17.966 6.592 1.00 0.00 N ATOM 519 CA PRO A 166 12.800 -18.926 7.689 1.00 0.00 C ATOM 520 C PRO A 166 13.504 -18.473 8.963 1.00 0.00 C ATOM 521 O PRO A 166 14.593 -18.948 9.284 1.00 0.00 O ATOM 522 CB PRO A 166 13.449 -20.199 7.142 1.00 0.00 C ATOM 523 CG PRO A 166 14.431 -19.720 6.130 1.00 0.00 C ATOM 524 CD PRO A 166 13.829 -18.483 5.522 1.00 0.00 C ATOM 0 HA PRO A 166 11.755 -19.052 7.972 1.00 0.00 H new ATOM 0 HB2 PRO A 166 13.941 -20.764 7.934 1.00 0.00 H new ATOM 0 HB3 PRO A 166 12.708 -20.859 6.692 1.00 0.00 H new ATOM 0 HG2 PRO A 166 15.392 -19.499 6.593 1.00 0.00 H new ATOM 0 HG3 PRO A 166 14.611 -20.481 5.370 1.00 0.00 H new ATOM 0 HD2 PRO A 166 14.595 -17.760 5.241 1.00 0.00 H new ATOM 0 HD3 PRO A 166 13.262 -18.713 4.620 1.00 0.00 H new ATOM 532 N SER A 167 12.875 -17.553 9.687 1.00 0.00 N ATOM 533 CA SER A 167 13.443 -17.034 10.925 1.00 0.00 C ATOM 534 C SER A 167 14.875 -16.553 10.707 1.00 0.00 C ATOM 535 O SER A 167 15.721 -16.664 11.594 1.00 0.00 O ATOM 536 CB SER A 167 13.415 -18.108 12.014 1.00 0.00 C ATOM 537 OG SER A 167 12.141 -18.174 12.632 1.00 0.00 O ATOM 0 H SER A 167 11.971 -17.152 9.437 1.00 0.00 H new ATOM 0 HA SER A 167 12.838 -16.186 11.245 1.00 0.00 H new ATOM 0 HB2 SER A 167 13.663 -19.077 11.580 1.00 0.00 H new ATOM 0 HB3 SER A 167 14.176 -17.890 12.764 1.00 0.00 H new ATOM 0 HG SER A 167 12.148 -18.869 13.323 1.00 0.00 H new ATOM 543 N SER A 168 15.138 -16.019 9.518 1.00 0.00 N ATOM 544 CA SER A 168 16.467 -15.525 9.180 1.00 0.00 C ATOM 545 C SER A 168 16.486 -14.935 7.773 1.00 0.00 C ATOM 546 O SER A 168 16.536 -13.718 7.598 1.00 0.00 O ATOM 547 CB SER A 168 17.496 -16.652 9.286 1.00 0.00 C ATOM 548 OG SER A 168 16.982 -17.863 8.758 1.00 0.00 O ATOM 0 H SER A 168 14.448 -15.918 8.773 1.00 0.00 H new ATOM 0 HA SER A 168 16.726 -14.738 9.889 1.00 0.00 H new ATOM 0 HB2 SER A 168 18.402 -16.373 8.749 1.00 0.00 H new ATOM 0 HB3 SER A 168 17.776 -16.796 10.330 1.00 0.00 H new ATOM 0 HG SER A 168 16.298 -18.219 9.363 1.00 0.00 H new ATOM 554 N GLY A 169 16.445 -15.808 6.771 1.00 0.00 N ATOM 555 CA GLY A 169 16.458 -15.357 5.392 1.00 0.00 C ATOM 556 C GLY A 169 17.680 -14.521 5.067 1.00 0.00 C ATOM 557 O GLY A 169 18.203 -14.630 3.960 1.00 0.00 O ATOM 0 H GLY A 169 16.403 -16.820 6.890 1.00 0.00 H new ATOM 0 HA2 GLY A 169 16.427 -16.222 4.730 1.00 0.00 H new ATOM 0 HA3 GLY A 169 15.559 -14.773 5.196 1.00 0.00 H new TER 561 GLY A 169 HETATM 562 ZN ZN A 201 0.229 -5.211 5.968 1.00 0.00 ZN