USER MOD reduce.3.24.130724 H: found=0, std=0, add=434, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 434 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 141 HIS HD1 : A 141 HIS ND1 : A 195 ZNZN :(H bumps) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0666) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 ASN : amide:sc=-0.00418 X(o=-0.0042,f=-0.016) USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 LYS NZ :NH3+ -173:sc=-0.00608 (180deg=-0.0748) USER MOD Single : A 153 SER OG : rot 180:sc= 0 USER MOD Single : A 156 SER OG : rot 180:sc= 0 USER MOD Single : A 157 THR OG1 : rot -23:sc= 0.404 USER MOD Single : A 158 THR OG1 : rot 180:sc= 0 USER MOD Single : A 160 THR OG1 : rot 180:sc= 0 USER MOD Single : A 162 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0147) USER MOD Single : A 167 TYR OH : rot 48:sc= 0.27 USER MOD Single : A 169 LYS NZ :NH3+ -116:sc= -0.0756 (180deg=-1.42!) USER MOD Single : A 171 CYS SG : rot -107:sc= -1.04 USER MOD Single : A 172 TYR OH : rot 51:sc= 0.514 USER MOD Single : A 174 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 175 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 117 -5.574 -14.152 -4.595 1.00 0.00 N ATOM 2 CA ALA A 117 -4.115 -14.110 -4.328 1.00 0.00 C ATOM 3 C ALA A 117 -3.399 -13.291 -5.356 1.00 0.00 C ATOM 4 O ALA A 117 -3.752 -13.299 -6.536 1.00 0.00 O ATOM 5 CB ALA A 117 -3.523 -15.534 -4.331 1.00 0.00 C ATOM 0 HA ALA A 117 -3.978 -13.654 -3.348 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -2.452 -15.483 -4.134 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -4.007 -16.131 -3.558 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -3.691 -15.996 -5.304 1.00 0.00 H new ATOM 11 N GLU A 118 -2.357 -12.555 -4.912 1.00 0.00 N ATOM 12 CA GLU A 118 -1.521 -11.781 -5.790 1.00 0.00 C ATOM 13 C GLU A 118 -0.169 -11.788 -5.127 1.00 0.00 C ATOM 14 O GLU A 118 0.219 -12.802 -4.548 1.00 0.00 O ATOM 15 CB GLU A 118 -2.087 -10.360 -6.055 1.00 0.00 C ATOM 16 CG GLU A 118 -1.619 -9.733 -7.385 1.00 0.00 C ATOM 17 CD GLU A 118 -2.270 -8.363 -7.579 1.00 0.00 C ATOM 18 OE1 GLU A 118 -3.528 -8.301 -7.609 1.00 0.00 O ATOM 19 OE2 GLU A 118 -1.516 -7.360 -7.706 1.00 0.00 O ATOM 0 H GLU A 118 -2.090 -12.496 -3.929 1.00 0.00 H new ATOM 0 HA GLU A 118 -1.466 -12.205 -6.792 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -3.176 -10.408 -6.052 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -1.794 -9.705 -5.234 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -0.534 -9.632 -7.386 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -1.879 -10.389 -8.216 1.00 0.00 H new ATOM 26 N LYS A 119 0.600 -10.679 -5.220 1.00 0.00 N ATOM 27 CA LYS A 119 1.960 -10.643 -4.755 1.00 0.00 C ATOM 28 C LYS A 119 2.143 -9.473 -3.838 1.00 0.00 C ATOM 29 O LYS A 119 1.485 -8.446 -3.978 1.00 0.00 O ATOM 30 CB LYS A 119 2.989 -10.641 -5.889 1.00 0.00 C ATOM 31 CG LYS A 119 4.260 -11.444 -5.564 1.00 0.00 C ATOM 32 CD LYS A 119 5.356 -11.360 -6.638 1.00 0.00 C ATOM 33 CE LYS A 119 4.979 -12.040 -7.962 1.00 0.00 C ATOM 34 NZ LYS A 119 6.097 -11.970 -8.931 1.00 0.00 N ATOM 0 H LYS A 119 0.275 -9.800 -5.622 1.00 0.00 H new ATOM 0 HA LYS A 119 2.145 -11.566 -4.205 1.00 0.00 H new ATOM 0 HB2 LYS A 119 2.529 -11.052 -6.788 1.00 0.00 H new ATOM 0 HB3 LYS A 119 3.267 -9.612 -6.115 1.00 0.00 H new ATOM 0 HG2 LYS A 119 4.668 -11.088 -4.618 1.00 0.00 H new ATOM 0 HG3 LYS A 119 3.988 -12.490 -5.421 1.00 0.00 H new ATOM 0 HD2 LYS A 119 5.583 -10.312 -6.831 1.00 0.00 H new ATOM 0 HD3 LYS A 119 6.266 -11.818 -6.251 1.00 0.00 H new ATOM 0 HE2 LYS A 119 4.717 -13.082 -7.778 1.00 0.00 H new ATOM 0 HE3 LYS A 119 4.097 -11.559 -8.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 5.818 -12.436 -9.818 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 6.329 -10.974 -9.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 6.930 -12.450 -8.535 1.00 0.00 H new ATOM 48 N CYS A 120 3.062 -9.634 -2.859 1.00 0.00 N ATOM 49 CA CYS A 120 3.383 -8.652 -1.859 1.00 0.00 C ATOM 50 C CYS A 120 4.621 -7.917 -2.297 1.00 0.00 C ATOM 51 O CYS A 120 5.640 -8.526 -2.621 1.00 0.00 O ATOM 52 CB CYS A 120 3.607 -9.274 -0.466 1.00 0.00 C ATOM 53 SG CYS A 120 3.672 -8.026 0.849 1.00 0.00 S ATOM 0 H CYS A 120 3.607 -10.491 -2.761 1.00 0.00 H new ATOM 0 HA CYS A 120 2.536 -7.972 -1.764 1.00 0.00 H new ATOM 0 HB2 CYS A 120 2.804 -9.980 -0.253 1.00 0.00 H new ATOM 0 HB3 CYS A 120 4.538 -9.842 -0.470 1.00 0.00 H new ATOM 58 N SER A 121 4.523 -6.567 -2.336 1.00 0.00 N ATOM 59 CA SER A 121 5.555 -5.669 -2.795 1.00 0.00 C ATOM 60 C SER A 121 6.681 -5.546 -1.789 1.00 0.00 C ATOM 61 O SER A 121 7.837 -5.398 -2.179 1.00 0.00 O ATOM 62 CB SER A 121 4.964 -4.258 -3.057 1.00 0.00 C ATOM 63 OG SER A 121 5.884 -3.397 -3.722 1.00 0.00 O ATOM 0 H SER A 121 3.682 -6.076 -2.032 1.00 0.00 H new ATOM 0 HA SER A 121 5.956 -6.087 -3.719 1.00 0.00 H new ATOM 0 HB2 SER A 121 4.060 -4.352 -3.658 1.00 0.00 H new ATOM 0 HB3 SER A 121 4.671 -3.808 -2.108 1.00 0.00 H new ATOM 0 HG SER A 121 5.467 -2.522 -3.866 1.00 0.00 H new ATOM 69 N ARG A 122 6.363 -5.585 -0.471 1.00 0.00 N ATOM 70 CA ARG A 122 7.296 -5.213 0.569 1.00 0.00 C ATOM 71 C ARG A 122 8.263 -6.321 0.860 1.00 0.00 C ATOM 72 O ARG A 122 9.474 -6.125 0.767 1.00 0.00 O ATOM 73 CB ARG A 122 6.580 -4.836 1.887 1.00 0.00 C ATOM 74 CG ARG A 122 7.482 -4.445 3.077 1.00 0.00 C ATOM 75 CD ARG A 122 8.367 -3.221 2.815 1.00 0.00 C ATOM 76 NE ARG A 122 9.208 -2.951 4.024 1.00 0.00 N ATOM 77 CZ ARG A 122 10.179 -1.987 4.031 1.00 0.00 C ATOM 78 NH1 ARG A 122 10.404 -1.208 2.932 1.00 0.00 N ATOM 79 NH2 ARG A 122 10.930 -1.799 5.155 1.00 0.00 N ATOM 0 H ARG A 122 5.450 -5.877 -0.122 1.00 0.00 H new ATOM 0 HA ARG A 122 7.832 -4.342 0.191 1.00 0.00 H new ATOM 0 HB2 ARG A 122 5.906 -4.004 1.683 1.00 0.00 H new ATOM 0 HB3 ARG A 122 5.961 -5.680 2.192 1.00 0.00 H new ATOM 0 HG2 ARG A 122 6.854 -4.247 3.946 1.00 0.00 H new ATOM 0 HG3 ARG A 122 8.118 -5.293 3.331 1.00 0.00 H new ATOM 0 HD2 ARG A 122 9.003 -3.397 1.947 1.00 0.00 H new ATOM 0 HD3 ARG A 122 7.749 -2.353 2.587 1.00 0.00 H new ATOM 0 HE ARG A 122 9.052 -3.502 4.868 1.00 0.00 H new ATOM 0 HH11 ARG A 122 9.844 -1.341 2.090 1.00 0.00 H new ATOM 0 HH12 ARG A 122 11.132 -0.494 2.954 1.00 0.00 H new ATOM 0 HH21 ARG A 122 10.765 -2.375 5.981 1.00 0.00 H new ATOM 0 HH22 ARG A 122 11.656 -1.083 5.169 1.00 0.00 H new ATOM 93 N CYS A 123 7.744 -7.513 1.233 1.00 0.00 N ATOM 94 CA CYS A 123 8.556 -8.557 1.811 1.00 0.00 C ATOM 95 C CYS A 123 9.119 -9.438 0.722 1.00 0.00 C ATOM 96 O CYS A 123 10.112 -10.130 0.939 1.00 0.00 O ATOM 97 CB CYS A 123 7.779 -9.392 2.868 1.00 0.00 C ATOM 98 SG CYS A 123 6.311 -10.271 2.236 1.00 0.00 S ATOM 0 H CYS A 123 6.758 -7.757 1.135 1.00 0.00 H new ATOM 0 HA CYS A 123 9.382 -8.081 2.340 1.00 0.00 H new ATOM 0 HB2 CYS A 123 8.461 -10.123 3.303 1.00 0.00 H new ATOM 0 HB3 CYS A 123 7.466 -8.728 3.674 1.00 0.00 H new ATOM 103 N GLY A 124 8.509 -9.397 -0.489 1.00 0.00 N ATOM 104 CA GLY A 124 9.043 -10.033 -1.669 1.00 0.00 C ATOM 105 C GLY A 124 8.393 -11.361 -1.907 1.00 0.00 C ATOM 106 O GLY A 124 8.614 -11.980 -2.946 1.00 0.00 O ATOM 0 H GLY A 124 7.627 -8.912 -0.651 1.00 0.00 H new ATOM 0 HA2 GLY A 124 8.888 -9.389 -2.535 1.00 0.00 H new ATOM 0 HA3 GLY A 124 10.119 -10.166 -1.559 1.00 0.00 H new ATOM 110 N ASP A 125 7.565 -11.829 -0.942 1.00 0.00 N ATOM 111 CA ASP A 125 6.859 -13.084 -1.026 1.00 0.00 C ATOM 112 C ASP A 125 5.532 -12.798 -1.671 1.00 0.00 C ATOM 113 O ASP A 125 5.289 -11.689 -2.142 1.00 0.00 O ATOM 114 CB ASP A 125 6.617 -13.727 0.367 1.00 0.00 C ATOM 115 CG ASP A 125 7.958 -13.942 1.071 1.00 0.00 C ATOM 116 OD1 ASP A 125 8.785 -14.730 0.541 1.00 0.00 O ATOM 117 OD2 ASP A 125 8.172 -13.320 2.146 1.00 0.00 O ATOM 0 H ASP A 125 7.381 -11.319 -0.078 1.00 0.00 H new ATOM 0 HA ASP A 125 7.459 -13.790 -1.600 1.00 0.00 H new ATOM 0 HB2 ASP A 125 5.977 -13.083 0.970 1.00 0.00 H new ATOM 0 HB3 ASP A 125 6.097 -14.678 0.255 1.00 0.00 H new ATOM 122 N SER A 126 4.637 -13.810 -1.710 1.00 0.00 N ATOM 123 CA SER A 126 3.294 -13.656 -2.206 1.00 0.00 C ATOM 124 C SER A 126 2.406 -13.494 -1.010 1.00 0.00 C ATOM 125 O SER A 126 2.789 -13.839 0.108 1.00 0.00 O ATOM 126 CB SER A 126 2.803 -14.874 -3.019 1.00 0.00 C ATOM 127 OG SER A 126 3.594 -15.043 -4.187 1.00 0.00 O ATOM 0 H SER A 126 4.850 -14.755 -1.391 1.00 0.00 H new ATOM 0 HA SER A 126 3.270 -12.798 -2.878 1.00 0.00 H new ATOM 0 HB2 SER A 126 2.854 -15.773 -2.405 1.00 0.00 H new ATOM 0 HB3 SER A 126 1.758 -14.736 -3.297 1.00 0.00 H new ATOM 0 HG SER A 126 3.272 -15.819 -4.691 1.00 0.00 H new ATOM 133 N VAL A 127 1.187 -12.955 -1.235 1.00 0.00 N ATOM 134 CA VAL A 127 0.168 -12.890 -0.219 1.00 0.00 C ATOM 135 C VAL A 127 -1.030 -13.543 -0.849 1.00 0.00 C ATOM 136 O VAL A 127 -1.311 -13.350 -2.031 1.00 0.00 O ATOM 137 CB VAL A 127 -0.089 -11.481 0.308 1.00 0.00 C ATOM 138 CG1 VAL A 127 -0.762 -10.571 -0.739 1.00 0.00 C ATOM 139 CG2 VAL A 127 -0.908 -11.572 1.606 1.00 0.00 C ATOM 0 H VAL A 127 0.904 -12.559 -2.132 1.00 0.00 H new ATOM 0 HA VAL A 127 0.470 -13.408 0.691 1.00 0.00 H new ATOM 0 HB VAL A 127 0.870 -11.011 0.524 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -0.922 -9.581 -0.312 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -0.120 -10.488 -1.616 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -1.721 -10.999 -1.031 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -1.096 -10.569 1.989 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -1.858 -12.067 1.403 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -0.352 -12.145 2.348 1.00 0.00 H new ATOM 149 N TYR A 128 -1.719 -14.406 -0.073 1.00 0.00 N ATOM 150 CA TYR A 128 -2.714 -15.302 -0.600 1.00 0.00 C ATOM 151 C TYR A 128 -3.780 -15.366 0.453 1.00 0.00 C ATOM 152 O TYR A 128 -4.655 -14.503 0.504 1.00 0.00 O ATOM 153 CB TYR A 128 -2.162 -16.712 -1.015 1.00 0.00 C ATOM 154 CG TYR A 128 -0.972 -17.196 -0.204 1.00 0.00 C ATOM 155 CD1 TYR A 128 0.325 -16.743 -0.512 1.00 0.00 C ATOM 156 CD2 TYR A 128 -1.123 -18.128 0.840 1.00 0.00 C ATOM 157 CE1 TYR A 128 1.432 -17.158 0.237 1.00 0.00 C ATOM 158 CE2 TYR A 128 -0.019 -18.548 1.593 1.00 0.00 C ATOM 159 CZ TYR A 128 1.260 -18.057 1.296 1.00 0.00 C ATOM 160 OH TYR A 128 2.373 -18.473 2.060 1.00 0.00 O ATOM 0 H TYR A 128 -1.585 -14.484 0.935 1.00 0.00 H new ATOM 0 HA TYR A 128 -3.105 -14.928 -1.546 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -2.966 -17.442 -0.924 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -1.878 -16.680 -2.067 1.00 0.00 H new ATOM 0 HD1 TYR A 128 0.468 -16.064 -1.340 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -2.103 -18.524 1.063 1.00 0.00 H new ATOM 0 HE1 TYR A 128 2.417 -16.785 -0.002 1.00 0.00 H new ATOM 0 HE2 TYR A 128 -0.153 -19.250 2.403 1.00 0.00 H new ATOM 0 HH TYR A 128 2.077 -19.097 2.756 1.00 0.00 H new ATOM 170 N ALA A 129 -3.715 -16.386 1.328 1.00 0.00 N ATOM 171 CA ALA A 129 -4.545 -16.526 2.494 1.00 0.00 C ATOM 172 C ALA A 129 -3.586 -16.581 3.648 1.00 0.00 C ATOM 173 O ALA A 129 -3.772 -17.342 4.596 1.00 0.00 O ATOM 174 CB ALA A 129 -5.385 -17.817 2.461 1.00 0.00 C ATOM 0 H ALA A 129 -3.052 -17.153 1.220 1.00 0.00 H new ATOM 0 HA ALA A 129 -5.256 -15.702 2.561 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -5.995 -17.877 3.362 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -6.033 -17.807 1.585 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -4.722 -18.681 2.413 1.00 0.00 H new ATOM 180 N ALA A 130 -2.521 -15.744 3.578 1.00 0.00 N ATOM 181 CA ALA A 130 -1.482 -15.661 4.568 1.00 0.00 C ATOM 182 C ALA A 130 -1.959 -14.712 5.630 1.00 0.00 C ATOM 183 O ALA A 130 -2.560 -15.138 6.617 1.00 0.00 O ATOM 184 CB ALA A 130 -0.146 -15.177 3.966 1.00 0.00 C ATOM 0 H ALA A 130 -2.381 -15.101 2.799 1.00 0.00 H new ATOM 0 HA ALA A 130 -1.287 -16.650 4.982 1.00 0.00 H new ATOM 0 HB1 ALA A 130 0.610 -15.129 4.750 1.00 0.00 H new ATOM 0 HB2 ALA A 130 0.177 -15.873 3.192 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -0.281 -14.187 3.531 1.00 0.00 H new ATOM 190 N GLU A 131 -1.715 -13.397 5.436 1.00 0.00 N ATOM 191 CA GLU A 131 -2.193 -12.366 6.320 1.00 0.00 C ATOM 192 C GLU A 131 -2.806 -11.317 5.441 1.00 0.00 C ATOM 193 O GLU A 131 -2.581 -10.125 5.649 1.00 0.00 O ATOM 194 CB GLU A 131 -1.056 -11.698 7.134 1.00 0.00 C ATOM 195 CG GLU A 131 -0.274 -12.674 8.030 1.00 0.00 C ATOM 196 CD GLU A 131 0.779 -11.897 8.818 1.00 0.00 C ATOM 197 OE1 GLU A 131 1.681 -11.299 8.172 1.00 0.00 O ATOM 198 OE2 GLU A 131 0.696 -11.890 10.076 1.00 0.00 O ATOM 0 H GLU A 131 -1.174 -13.041 4.648 1.00 0.00 H new ATOM 0 HA GLU A 131 -2.889 -12.805 7.035 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -0.362 -11.218 6.444 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -1.482 -10.911 7.756 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -0.954 -13.184 8.713 1.00 0.00 H new ATOM 0 HG3 GLU A 131 0.203 -13.442 7.422 1.00 0.00 H new ATOM 205 N LYS A 132 -3.600 -11.730 4.416 1.00 0.00 N ATOM 206 CA LYS A 132 -4.040 -10.807 3.397 1.00 0.00 C ATOM 207 C LYS A 132 -5.123 -9.911 3.922 1.00 0.00 C ATOM 208 O LYS A 132 -6.092 -10.364 4.529 1.00 0.00 O ATOM 209 CB LYS A 132 -4.529 -11.482 2.098 1.00 0.00 C ATOM 210 CG LYS A 132 -4.571 -10.514 0.902 1.00 0.00 C ATOM 211 CD LYS A 132 -4.797 -11.217 -0.441 1.00 0.00 C ATOM 212 CE LYS A 132 -4.802 -10.233 -1.617 1.00 0.00 C ATOM 213 NZ LYS A 132 -4.970 -10.934 -2.909 1.00 0.00 N ATOM 0 H LYS A 132 -3.931 -12.687 4.296 1.00 0.00 H new ATOM 0 HA LYS A 132 -3.154 -10.228 3.138 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -3.872 -12.319 1.859 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -5.525 -11.894 2.261 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -5.366 -9.786 1.061 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -3.634 -9.959 0.860 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -4.016 -11.961 -0.596 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -5.746 -11.752 -0.414 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -5.608 -9.511 -1.486 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -3.869 -9.670 -1.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -5.105 -10.236 -3.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -4.122 -11.503 -3.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -5.801 -11.557 -2.860 1.00 0.00 H new ATOM 227 N VAL A 133 -4.940 -8.598 3.678 1.00 0.00 N ATOM 228 CA VAL A 133 -5.851 -7.551 4.036 1.00 0.00 C ATOM 229 C VAL A 133 -5.798 -6.616 2.865 1.00 0.00 C ATOM 230 O VAL A 133 -4.848 -6.631 2.080 1.00 0.00 O ATOM 231 CB VAL A 133 -5.501 -6.799 5.320 1.00 0.00 C ATOM 232 CG1 VAL A 133 -5.796 -7.703 6.534 1.00 0.00 C ATOM 233 CG2 VAL A 133 -4.030 -6.331 5.308 1.00 0.00 C ATOM 0 H VAL A 133 -4.108 -8.248 3.203 1.00 0.00 H new ATOM 0 HA VAL A 133 -6.835 -7.972 4.245 1.00 0.00 H new ATOM 0 HB VAL A 133 -6.117 -5.903 5.390 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -5.548 -7.171 7.453 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -6.853 -7.968 6.542 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -5.195 -8.610 6.467 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -3.810 -5.799 6.234 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -3.373 -7.197 5.222 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -3.867 -5.666 4.460 1.00 0.00 H new ATOM 243 N ILE A 134 -6.852 -5.786 2.719 1.00 0.00 N ATOM 244 CA ILE A 134 -6.964 -4.824 1.656 1.00 0.00 C ATOM 245 C ILE A 134 -6.895 -3.493 2.346 1.00 0.00 C ATOM 246 O ILE A 134 -7.517 -3.289 3.388 1.00 0.00 O ATOM 247 CB ILE A 134 -8.260 -4.980 0.861 1.00 0.00 C ATOM 248 CG1 ILE A 134 -8.305 -6.394 0.221 1.00 0.00 C ATOM 249 CG2 ILE A 134 -8.367 -3.863 -0.202 1.00 0.00 C ATOM 250 CD1 ILE A 134 -9.591 -6.697 -0.554 1.00 0.00 C ATOM 0 H ILE A 134 -7.648 -5.783 3.356 1.00 0.00 H new ATOM 0 HA ILE A 134 -6.174 -4.950 0.916 1.00 0.00 H new ATOM 0 HB ILE A 134 -9.119 -4.882 1.525 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -7.455 -6.502 -0.453 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -8.185 -7.139 1.007 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -9.294 -3.983 -0.763 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -8.364 -2.891 0.290 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -7.519 -3.927 -0.884 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -9.538 -7.704 -0.967 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -10.446 -6.625 0.118 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -9.705 -5.978 -1.365 1.00 0.00 H new ATOM 262 N GLY A 135 -6.116 -2.553 1.760 1.00 0.00 N ATOM 263 CA GLY A 135 -5.993 -1.202 2.235 1.00 0.00 C ATOM 264 C GLY A 135 -7.009 -0.407 1.491 1.00 0.00 C ATOM 265 O GLY A 135 -8.095 -0.136 2.003 1.00 0.00 O ATOM 0 H GLY A 135 -5.555 -2.741 0.929 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -6.168 -1.150 3.310 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -4.989 -0.816 2.056 1.00 0.00 H new ATOM 269 N ALA A 136 -6.667 -0.039 0.237 1.00 0.00 N ATOM 270 CA ALA A 136 -7.553 0.638 -0.670 1.00 0.00 C ATOM 271 C ALA A 136 -8.075 -0.400 -1.619 1.00 0.00 C ATOM 272 O ALA A 136 -9.276 -0.660 -1.666 1.00 0.00 O ATOM 273 CB ALA A 136 -6.842 1.741 -1.467 1.00 0.00 C ATOM 0 H ALA A 136 -5.744 -0.218 -0.159 1.00 0.00 H new ATOM 0 HA ALA A 136 -8.349 1.122 -0.104 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -7.554 2.222 -2.138 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -6.434 2.482 -0.779 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -6.032 1.304 -2.051 1.00 0.00 H new ATOM 279 N GLY A 137 -7.163 -1.032 -2.388 1.00 0.00 N ATOM 280 CA GLY A 137 -7.540 -2.061 -3.318 1.00 0.00 C ATOM 281 C GLY A 137 -6.285 -2.664 -3.854 1.00 0.00 C ATOM 282 O GLY A 137 -6.159 -2.849 -5.064 1.00 0.00 O ATOM 0 H GLY A 137 -6.163 -0.831 -2.366 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -8.149 -2.819 -2.825 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -8.141 -1.645 -4.127 1.00 0.00 H new ATOM 286 N LYS A 138 -5.320 -2.980 -2.955 1.00 0.00 N ATOM 287 CA LYS A 138 -4.035 -3.523 -3.328 1.00 0.00 C ATOM 288 C LYS A 138 -3.741 -4.677 -2.392 1.00 0.00 C ATOM 289 O LYS A 138 -4.255 -4.687 -1.274 1.00 0.00 O ATOM 290 CB LYS A 138 -2.898 -2.478 -3.181 1.00 0.00 C ATOM 291 CG LYS A 138 -2.936 -1.296 -4.169 1.00 0.00 C ATOM 292 CD LYS A 138 -2.267 -1.538 -5.536 1.00 0.00 C ATOM 293 CE LYS A 138 -3.082 -2.381 -6.528 1.00 0.00 C ATOM 294 NZ LYS A 138 -2.409 -2.439 -7.847 1.00 0.00 N ATOM 0 H LYS A 138 -5.434 -2.856 -1.949 1.00 0.00 H new ATOM 0 HA LYS A 138 -4.075 -3.833 -4.372 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -2.927 -2.079 -2.167 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -1.943 -2.991 -3.295 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -3.978 -1.024 -4.339 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -2.455 -0.439 -3.698 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -2.056 -0.572 -5.994 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -1.308 -2.029 -5.370 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -3.210 -3.390 -6.135 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -4.079 -1.954 -6.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -2.977 -3.014 -8.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -2.309 -1.477 -8.228 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -1.468 -2.868 -7.738 1.00 0.00 H new ATOM 308 N PRO A 139 -2.939 -5.673 -2.791 1.00 0.00 N ATOM 309 CA PRO A 139 -2.593 -6.822 -1.962 1.00 0.00 C ATOM 310 C PRO A 139 -1.573 -6.434 -0.918 1.00 0.00 C ATOM 311 O PRO A 139 -0.579 -5.800 -1.266 1.00 0.00 O ATOM 312 CB PRO A 139 -1.978 -7.822 -2.953 1.00 0.00 C ATOM 313 CG PRO A 139 -1.415 -6.956 -4.083 1.00 0.00 C ATOM 314 CD PRO A 139 -2.418 -5.811 -4.155 1.00 0.00 C ATOM 0 HA PRO A 139 -3.452 -7.226 -1.427 1.00 0.00 H new ATOM 0 HB2 PRO A 139 -1.195 -8.415 -2.481 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -2.727 -8.521 -3.326 1.00 0.00 H new ATOM 0 HG2 PRO A 139 -0.409 -6.600 -3.859 1.00 0.00 H new ATOM 0 HG3 PRO A 139 -1.357 -7.504 -5.023 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -1.941 -4.890 -4.490 1.00 0.00 H new ATOM 0 HD3 PRO A 139 -3.218 -6.031 -4.862 1.00 0.00 H new ATOM 322 N TRP A 140 -1.816 -6.795 0.365 1.00 0.00 N ATOM 323 CA TRP A 140 -0.956 -6.406 1.456 1.00 0.00 C ATOM 324 C TRP A 140 -1.011 -7.455 2.525 1.00 0.00 C ATOM 325 O TRP A 140 -2.077 -7.991 2.818 1.00 0.00 O ATOM 326 CB TRP A 140 -1.349 -5.083 2.164 1.00 0.00 C ATOM 327 CG TRP A 140 -1.454 -3.846 1.302 1.00 0.00 C ATOM 328 CD1 TRP A 140 -2.548 -3.050 1.121 1.00 0.00 C ATOM 329 CD2 TRP A 140 -0.390 -3.255 0.532 1.00 0.00 C ATOM 330 NE1 TRP A 140 -2.249 -2.006 0.282 1.00 0.00 N ATOM 331 CE2 TRP A 140 -0.931 -2.121 -0.109 1.00 0.00 C ATOM 332 CE3 TRP A 140 0.943 -3.617 0.349 1.00 0.00 C ATOM 333 CZ2 TRP A 140 -0.154 -1.345 -0.961 1.00 0.00 C ATOM 334 CZ3 TRP A 140 1.731 -2.823 -0.496 1.00 0.00 C ATOM 335 CH2 TRP A 140 1.187 -1.705 -1.144 1.00 0.00 C ATOM 0 H TRP A 140 -2.615 -7.361 0.649 1.00 0.00 H new ATOM 0 HA TRP A 140 0.025 -6.277 0.998 1.00 0.00 H new ATOM 0 HB2 TRP A 140 -2.310 -5.235 2.656 1.00 0.00 H new ATOM 0 HB3 TRP A 140 -0.617 -4.888 2.948 1.00 0.00 H new ATOM 0 HD1 TRP A 140 -3.514 -3.218 1.575 1.00 0.00 H new ATOM 0 HE1 TRP A 140 -2.893 -1.269 -0.004 1.00 0.00 H new ATOM 0 HE3 TRP A 140 1.357 -4.483 0.843 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 -0.573 -0.488 -1.468 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 2.770 -3.076 -0.650 1.00 0.00 H new ATOM 0 HH2 TRP A 140 1.812 -1.112 -1.795 1.00 0.00 H new ATOM 346 N HIS A 141 0.155 -7.744 3.161 1.00 0.00 N ATOM 347 CA HIS A 141 0.203 -8.347 4.478 1.00 0.00 C ATOM 348 C HIS A 141 0.034 -7.181 5.412 1.00 0.00 C ATOM 349 O HIS A 141 0.300 -6.041 5.033 1.00 0.00 O ATOM 350 CB HIS A 141 1.510 -9.059 4.901 1.00 0.00 C ATOM 351 CG HIS A 141 1.870 -10.282 4.113 1.00 0.00 C ATOM 352 ND1 HIS A 141 2.988 -10.375 3.322 1.00 0.00 N ATOM 353 CD2 HIS A 141 1.303 -11.511 4.149 1.00 0.00 C ATOM 354 CE1 HIS A 141 3.074 -11.624 2.883 1.00 0.00 C ATOM 355 NE2 HIS A 141 2.070 -12.333 3.372 1.00 0.00 N ATOM 0 H HIS A 141 1.074 -7.558 2.759 1.00 0.00 H new ATOM 0 HA HIS A 141 -0.550 -9.135 4.493 1.00 0.00 H new ATOM 0 HB2 HIS A 141 2.331 -8.346 4.825 1.00 0.00 H new ATOM 0 HB3 HIS A 141 1.426 -9.338 5.951 1.00 0.00 H new ATOM 0 HD2 HIS A 141 0.411 -11.790 4.691 1.00 0.00 H new ATOM 0 HE1 HIS A 141 3.844 -12.003 2.228 1.00 0.00 H new ATOM 0 HE2 HIS A 141 1.898 -13.323 3.199 1.00 0.00 H new ATOM 363 N LYS A 142 -0.474 -7.429 6.637 1.00 0.00 N ATOM 364 CA LYS A 142 -0.883 -6.394 7.559 1.00 0.00 C ATOM 365 C LYS A 142 0.229 -5.547 8.151 1.00 0.00 C ATOM 366 O LYS A 142 -0.052 -4.639 8.929 1.00 0.00 O ATOM 367 CB LYS A 142 -1.792 -6.955 8.687 1.00 0.00 C ATOM 368 CG LYS A 142 -1.293 -8.220 9.421 1.00 0.00 C ATOM 369 CD LYS A 142 -0.044 -8.075 10.311 1.00 0.00 C ATOM 370 CE LYS A 142 -0.226 -7.115 11.495 1.00 0.00 C ATOM 371 NZ LYS A 142 1.016 -7.031 12.299 1.00 0.00 N ATOM 0 H LYS A 142 -0.606 -8.372 7.001 1.00 0.00 H new ATOM 0 HA LYS A 142 -1.450 -5.709 6.929 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -1.939 -6.169 9.427 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -2.769 -7.175 8.258 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -2.108 -8.593 10.042 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -1.087 -8.985 8.672 1.00 0.00 H new ATOM 0 HD2 LYS A 142 0.233 -9.058 10.693 1.00 0.00 H new ATOM 0 HD3 LYS A 142 0.787 -7.726 9.698 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -0.495 -6.124 11.128 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -1.049 -7.457 12.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 0.871 -6.377 13.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 1.257 -7.974 12.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 1.793 -6.683 11.702 1.00 0.00 H new ATOM 385 N ASN A 143 1.510 -5.811 7.801 1.00 0.00 N ATOM 386 CA ASN A 143 2.649 -5.053 8.267 1.00 0.00 C ATOM 387 C ASN A 143 3.395 -4.514 7.062 1.00 0.00 C ATOM 388 O ASN A 143 4.289 -3.680 7.196 1.00 0.00 O ATOM 389 CB ASN A 143 3.587 -5.959 9.113 1.00 0.00 C ATOM 390 CG ASN A 143 4.624 -5.136 9.895 1.00 0.00 C ATOM 391 OD1 ASN A 143 4.257 -4.293 10.723 1.00 0.00 O ATOM 392 ND2 ASN A 143 5.937 -5.395 9.617 1.00 0.00 N ATOM 0 H ASN A 143 1.764 -6.575 7.175 1.00 0.00 H new ATOM 0 HA ASN A 143 2.312 -4.229 8.895 1.00 0.00 H new ATOM 0 HB2 ASN A 143 2.991 -6.549 9.810 1.00 0.00 H new ATOM 0 HB3 ASN A 143 4.101 -6.662 8.458 1.00 0.00 H new ATOM 0 HD21 ASN A 143 6.672 -4.881 10.103 1.00 0.00 H new ATOM 0 HD22 ASN A 143 6.182 -6.102 8.924 1.00 0.00 H new ATOM 399 N CYS A 144 3.039 -4.999 5.853 1.00 0.00 N ATOM 400 CA CYS A 144 3.765 -4.791 4.625 1.00 0.00 C ATOM 401 C CYS A 144 3.171 -3.676 3.785 1.00 0.00 C ATOM 402 O CYS A 144 3.236 -3.738 2.558 1.00 0.00 O ATOM 403 CB CYS A 144 3.717 -6.080 3.762 1.00 0.00 C ATOM 404 SG CYS A 144 4.775 -7.455 4.320 1.00 0.00 S ATOM 0 H CYS A 144 2.201 -5.566 5.723 1.00 0.00 H new ATOM 0 HA CYS A 144 4.784 -4.527 4.909 1.00 0.00 H new ATOM 0 HB2 CYS A 144 2.686 -6.432 3.727 1.00 0.00 H new ATOM 0 HB3 CYS A 144 4.000 -5.821 2.742 1.00 0.00 H new ATOM 409 N PHE A 145 2.575 -2.613 4.382 1.00 0.00 N ATOM 410 CA PHE A 145 1.895 -1.602 3.592 1.00 0.00 C ATOM 411 C PHE A 145 2.915 -0.607 3.102 1.00 0.00 C ATOM 412 O PHE A 145 3.347 0.239 3.873 1.00 0.00 O ATOM 413 CB PHE A 145 0.835 -0.785 4.390 1.00 0.00 C ATOM 414 CG PHE A 145 -0.507 -1.467 4.500 1.00 0.00 C ATOM 415 CD1 PHE A 145 -0.646 -2.798 4.933 1.00 0.00 C ATOM 416 CD2 PHE A 145 -1.673 -0.735 4.210 1.00 0.00 C ATOM 417 CE1 PHE A 145 -1.911 -3.384 5.042 1.00 0.00 C ATOM 418 CE2 PHE A 145 -2.937 -1.323 4.308 1.00 0.00 C ATOM 419 CZ PHE A 145 -3.057 -2.655 4.715 1.00 0.00 C ATOM 0 H PHE A 145 2.561 -2.451 5.389 1.00 0.00 H new ATOM 0 HA PHE A 145 1.385 -2.137 2.791 1.00 0.00 H new ATOM 0 HB2 PHE A 145 1.218 -0.594 5.393 1.00 0.00 H new ATOM 0 HB3 PHE A 145 0.701 0.184 3.910 1.00 0.00 H new ATOM 0 HD1 PHE A 145 0.233 -3.373 5.184 1.00 0.00 H new ATOM 0 HD2 PHE A 145 -1.590 0.298 3.907 1.00 0.00 H new ATOM 0 HE1 PHE A 145 -2.003 -4.405 5.381 1.00 0.00 H new ATOM 0 HE2 PHE A 145 -3.820 -0.749 4.070 1.00 0.00 H new ATOM 0 HZ PHE A 145 -4.031 -3.118 4.776 1.00 0.00 H new ATOM 429 N ARG A 146 3.314 -0.654 1.804 1.00 0.00 N ATOM 430 CA ARG A 146 4.128 0.407 1.249 1.00 0.00 C ATOM 431 C ARG A 146 3.205 1.439 0.688 1.00 0.00 C ATOM 432 O ARG A 146 2.159 1.133 0.121 1.00 0.00 O ATOM 433 CB ARG A 146 5.084 0.042 0.087 1.00 0.00 C ATOM 434 CG ARG A 146 6.240 -0.889 0.469 1.00 0.00 C ATOM 435 CD ARG A 146 7.200 -1.072 -0.714 1.00 0.00 C ATOM 436 NE ARG A 146 8.411 -1.826 -0.260 1.00 0.00 N ATOM 437 CZ ARG A 146 9.335 -2.336 -1.131 1.00 0.00 C ATOM 438 NH1 ARG A 146 9.200 -2.170 -2.479 1.00 0.00 N ATOM 439 NH2 ARG A 146 10.406 -3.028 -0.640 1.00 0.00 N ATOM 0 H ARG A 146 3.081 -1.404 1.153 1.00 0.00 H new ATOM 0 HA ARG A 146 4.759 0.718 2.082 1.00 0.00 H new ATOM 0 HB2 ARG A 146 4.504 -0.430 -0.706 1.00 0.00 H new ATOM 0 HB3 ARG A 146 5.499 0.962 -0.325 1.00 0.00 H new ATOM 0 HG2 ARG A 146 6.780 -0.477 1.322 1.00 0.00 H new ATOM 0 HG3 ARG A 146 5.847 -1.857 0.779 1.00 0.00 H new ATOM 0 HD2 ARG A 146 6.703 -1.612 -1.520 1.00 0.00 H new ATOM 0 HD3 ARG A 146 7.491 -0.101 -1.114 1.00 0.00 H new ATOM 0 HE ARG A 146 8.553 -1.965 0.740 1.00 0.00 H new ATOM 0 HH11 ARG A 146 8.400 -1.659 -2.852 1.00 0.00 H new ATOM 0 HH12 ARG A 146 9.899 -2.557 -3.113 1.00 0.00 H new ATOM 0 HH21 ARG A 146 10.510 -3.160 0.366 1.00 0.00 H new ATOM 0 HH22 ARG A 146 11.101 -3.413 -1.280 1.00 0.00 H new ATOM 453 N CYS A 147 3.641 2.706 0.803 1.00 0.00 N ATOM 454 CA CYS A 147 3.051 3.854 0.177 1.00 0.00 C ATOM 455 C CYS A 147 3.416 3.785 -1.285 1.00 0.00 C ATOM 456 O CYS A 147 4.518 3.373 -1.640 1.00 0.00 O ATOM 457 CB CYS A 147 3.616 5.130 0.827 1.00 0.00 C ATOM 458 SG CYS A 147 2.858 6.636 0.204 1.00 0.00 S ATOM 0 H CYS A 147 4.456 2.946 1.368 1.00 0.00 H new ATOM 0 HA CYS A 147 1.967 3.872 0.294 1.00 0.00 H new ATOM 0 HB2 CYS A 147 3.469 5.076 1.906 1.00 0.00 H new ATOM 0 HB3 CYS A 147 4.691 5.173 0.653 1.00 0.00 H new ATOM 463 N ALA A 148 2.470 4.141 -2.177 1.00 0.00 N ATOM 464 CA ALA A 148 2.682 4.040 -3.601 1.00 0.00 C ATOM 465 C ALA A 148 3.278 5.318 -4.131 1.00 0.00 C ATOM 466 O ALA A 148 3.793 5.344 -5.247 1.00 0.00 O ATOM 467 CB ALA A 148 1.375 3.751 -4.347 1.00 0.00 C ATOM 0 H ALA A 148 1.552 4.501 -1.916 1.00 0.00 H new ATOM 0 HA ALA A 148 3.369 3.210 -3.769 1.00 0.00 H new ATOM 0 HB1 ALA A 148 1.574 3.682 -5.416 1.00 0.00 H new ATOM 0 HB2 ALA A 148 0.955 2.809 -3.994 1.00 0.00 H new ATOM 0 HB3 ALA A 148 0.664 4.557 -4.162 1.00 0.00 H new ATOM 473 N LYS A 149 3.238 6.403 -3.321 1.00 0.00 N ATOM 474 CA LYS A 149 3.773 7.694 -3.670 1.00 0.00 C ATOM 475 C LYS A 149 5.207 7.716 -3.215 1.00 0.00 C ATOM 476 O LYS A 149 6.115 7.713 -4.044 1.00 0.00 O ATOM 477 CB LYS A 149 2.954 8.847 -3.028 1.00 0.00 C ATOM 478 CG LYS A 149 3.236 10.278 -3.533 1.00 0.00 C ATOM 479 CD LYS A 149 4.510 10.940 -2.985 1.00 0.00 C ATOM 480 CE LYS A 149 4.539 12.460 -3.195 1.00 0.00 C ATOM 481 NZ LYS A 149 5.747 13.058 -2.577 1.00 0.00 N ATOM 0 H LYS A 149 2.819 6.380 -2.391 1.00 0.00 H new ATOM 0 HA LYS A 149 3.712 7.851 -4.747 1.00 0.00 H new ATOM 0 HB2 LYS A 149 1.896 8.637 -3.183 1.00 0.00 H new ATOM 0 HB3 LYS A 149 3.129 8.828 -1.952 1.00 0.00 H new ATOM 0 HG2 LYS A 149 3.301 10.253 -4.621 1.00 0.00 H new ATOM 0 HG3 LYS A 149 2.383 10.908 -3.279 1.00 0.00 H new ATOM 0 HD2 LYS A 149 4.594 10.725 -1.920 1.00 0.00 H new ATOM 0 HD3 LYS A 149 5.380 10.496 -3.469 1.00 0.00 H new ATOM 0 HE2 LYS A 149 4.523 12.684 -4.262 1.00 0.00 H new ATOM 0 HE3 LYS A 149 3.645 12.908 -2.762 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 5.744 14.086 -2.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 5.747 12.862 -1.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 6.598 12.645 -3.009 1.00 0.00 H new ATOM 495 N CYS A 150 5.438 7.749 -1.879 1.00 0.00 N ATOM 496 CA CYS A 150 6.737 8.036 -1.320 1.00 0.00 C ATOM 497 C CYS A 150 7.517 6.776 -1.013 1.00 0.00 C ATOM 498 O CYS A 150 8.746 6.807 -0.997 1.00 0.00 O ATOM 499 CB CYS A 150 6.655 9.002 -0.102 1.00 0.00 C ATOM 500 SG CYS A 150 5.954 8.344 1.451 1.00 0.00 S ATOM 0 H CYS A 150 4.716 7.575 -1.180 1.00 0.00 H new ATOM 0 HA CYS A 150 7.300 8.565 -2.089 1.00 0.00 H new ATOM 0 HB2 CYS A 150 7.662 9.363 0.110 1.00 0.00 H new ATOM 0 HB3 CYS A 150 6.062 9.867 -0.398 1.00 0.00 H new ATOM 505 N GLY A 151 6.824 5.630 -0.791 1.00 0.00 N ATOM 506 CA GLY A 151 7.455 4.341 -0.594 1.00 0.00 C ATOM 507 C GLY A 151 7.804 4.063 0.838 1.00 0.00 C ATOM 508 O GLY A 151 8.508 3.093 1.120 1.00 0.00 O ATOM 0 H GLY A 151 5.806 5.596 -0.747 1.00 0.00 H new ATOM 0 HA2 GLY A 151 6.788 3.559 -0.956 1.00 0.00 H new ATOM 0 HA3 GLY A 151 8.361 4.292 -1.198 1.00 0.00 H new ATOM 512 N LYS A 152 7.316 4.901 1.785 1.00 0.00 N ATOM 513 CA LYS A 152 7.560 4.741 3.200 1.00 0.00 C ATOM 514 C LYS A 152 6.650 3.655 3.711 1.00 0.00 C ATOM 515 O LYS A 152 5.460 3.638 3.401 1.00 0.00 O ATOM 516 CB LYS A 152 7.328 6.070 3.963 1.00 0.00 C ATOM 517 CG LYS A 152 7.656 6.054 5.468 1.00 0.00 C ATOM 518 CD LYS A 152 6.444 5.866 6.402 1.00 0.00 C ATOM 519 CE LYS A 152 5.448 7.040 6.421 1.00 0.00 C ATOM 520 NZ LYS A 152 6.086 8.301 6.866 1.00 0.00 N ATOM 0 H LYS A 152 6.737 5.711 1.563 1.00 0.00 H new ATOM 0 HA LYS A 152 8.600 4.462 3.367 1.00 0.00 H new ATOM 0 HB2 LYS A 152 7.928 6.847 3.489 1.00 0.00 H new ATOM 0 HB3 LYS A 152 6.283 6.357 3.843 1.00 0.00 H new ATOM 0 HG2 LYS A 152 8.370 5.253 5.659 1.00 0.00 H new ATOM 0 HG3 LYS A 152 8.151 6.990 5.726 1.00 0.00 H new ATOM 0 HD2 LYS A 152 5.912 4.963 6.104 1.00 0.00 H new ATOM 0 HD3 LYS A 152 6.808 5.702 7.416 1.00 0.00 H new ATOM 0 HE2 LYS A 152 5.030 7.177 5.424 1.00 0.00 H new ATOM 0 HE3 LYS A 152 4.617 6.800 7.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 5.360 9.037 6.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 6.565 8.145 7.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 6.782 8.607 6.156 1.00 0.00 H new ATOM 534 N SER A 153 7.223 2.695 4.481 1.00 0.00 N ATOM 535 CA SER A 153 6.529 1.507 4.918 1.00 0.00 C ATOM 536 C SER A 153 5.760 1.784 6.180 1.00 0.00 C ATOM 537 O SER A 153 6.180 2.560 7.038 1.00 0.00 O ATOM 538 CB SER A 153 7.452 0.276 5.101 1.00 0.00 C ATOM 539 OG SER A 153 8.529 0.535 5.996 1.00 0.00 O ATOM 0 H SER A 153 8.188 2.746 4.806 1.00 0.00 H new ATOM 0 HA SER A 153 5.837 1.247 4.117 1.00 0.00 H new ATOM 0 HB2 SER A 153 6.865 -0.563 5.476 1.00 0.00 H new ATOM 0 HB3 SER A 153 7.852 -0.023 4.132 1.00 0.00 H new ATOM 0 HG SER A 153 9.083 -0.269 6.082 1.00 0.00 H new ATOM 545 N LEU A 154 4.565 1.162 6.256 1.00 0.00 N ATOM 546 CA LEU A 154 3.508 1.499 7.166 1.00 0.00 C ATOM 547 C LEU A 154 2.987 0.196 7.701 1.00 0.00 C ATOM 548 O LEU A 154 3.340 -0.880 7.213 1.00 0.00 O ATOM 549 CB LEU A 154 2.339 2.218 6.440 1.00 0.00 C ATOM 550 CG LEU A 154 2.739 3.528 5.717 1.00 0.00 C ATOM 551 CD1 LEU A 154 2.136 3.598 4.300 1.00 0.00 C ATOM 552 CD2 LEU A 154 2.388 4.773 6.553 1.00 0.00 C ATOM 0 H LEU A 154 4.324 0.380 5.648 1.00 0.00 H new ATOM 0 HA LEU A 154 3.886 2.165 7.942 1.00 0.00 H new ATOM 0 HB2 LEU A 154 1.905 1.534 5.711 1.00 0.00 H new ATOM 0 HB3 LEU A 154 1.560 2.443 7.168 1.00 0.00 H new ATOM 0 HG LEU A 154 3.823 3.518 5.605 1.00 0.00 H new ATOM 0 HD11 LEU A 154 2.437 4.530 3.822 1.00 0.00 H new ATOM 0 HD12 LEU A 154 2.495 2.755 3.710 1.00 0.00 H new ATOM 0 HD13 LEU A 154 1.049 3.558 4.365 1.00 0.00 H new ATOM 0 HD21 LEU A 154 2.685 5.671 6.011 1.00 0.00 H new ATOM 0 HD22 LEU A 154 1.314 4.798 6.736 1.00 0.00 H new ATOM 0 HD23 LEU A 154 2.917 4.733 7.505 1.00 0.00 H new ATOM 564 N GLU A 155 2.118 0.293 8.735 1.00 0.00 N ATOM 565 CA GLU A 155 1.566 -0.811 9.482 1.00 0.00 C ATOM 566 C GLU A 155 0.419 -1.434 8.713 1.00 0.00 C ATOM 567 O GLU A 155 0.624 -1.950 7.618 1.00 0.00 O ATOM 568 CB GLU A 155 1.159 -0.367 10.917 1.00 0.00 C ATOM 569 CG GLU A 155 0.399 0.977 10.990 1.00 0.00 C ATOM 570 CD GLU A 155 -0.058 1.238 12.424 1.00 0.00 C ATOM 571 OE1 GLU A 155 -0.900 0.448 12.929 1.00 0.00 O ATOM 572 OE2 GLU A 155 0.423 2.233 13.031 1.00 0.00 O ATOM 0 H GLU A 155 1.781 1.196 9.070 1.00 0.00 H new ATOM 0 HA GLU A 155 2.330 -1.579 9.606 1.00 0.00 H new ATOM 0 HB2 GLU A 155 0.536 -1.145 11.360 1.00 0.00 H new ATOM 0 HB3 GLU A 155 2.059 -0.293 11.528 1.00 0.00 H new ATOM 0 HG2 GLU A 155 1.043 1.788 10.651 1.00 0.00 H new ATOM 0 HG3 GLU A 155 -0.463 0.954 10.323 1.00 0.00 H new ATOM 579 N SER A 156 -0.815 -1.422 9.276 1.00 0.00 N ATOM 580 CA SER A 156 -2.005 -1.984 8.681 1.00 0.00 C ATOM 581 C SER A 156 -2.712 -0.876 7.938 1.00 0.00 C ATOM 582 O SER A 156 -2.064 0.027 7.407 1.00 0.00 O ATOM 583 CB SER A 156 -2.912 -2.668 9.742 1.00 0.00 C ATOM 584 OG SER A 156 -3.258 -1.789 10.809 1.00 0.00 O ATOM 0 H SER A 156 -0.991 -1.001 10.188 1.00 0.00 H new ATOM 0 HA SER A 156 -1.740 -2.777 7.982 1.00 0.00 H new ATOM 0 HB2 SER A 156 -3.822 -3.027 9.261 1.00 0.00 H new ATOM 0 HB3 SER A 156 -2.399 -3.541 10.146 1.00 0.00 H new ATOM 0 HG SER A 156 -3.829 -2.261 11.450 1.00 0.00 H new ATOM 590 N THR A 157 -4.067 -0.928 7.871 1.00 0.00 N ATOM 591 CA THR A 157 -4.871 0.050 7.178 1.00 0.00 C ATOM 592 C THR A 157 -5.083 1.206 8.119 1.00 0.00 C ATOM 593 O THR A 157 -5.958 1.181 8.984 1.00 0.00 O ATOM 594 CB THR A 157 -6.216 -0.481 6.699 1.00 0.00 C ATOM 595 OG1 THR A 157 -6.040 -1.691 5.976 1.00 0.00 O ATOM 596 CG2 THR A 157 -6.919 0.554 5.792 1.00 0.00 C ATOM 0 H THR A 157 -4.616 -1.668 8.309 1.00 0.00 H new ATOM 0 HA THR A 157 -4.338 0.345 6.274 1.00 0.00 H new ATOM 0 HB THR A 157 -6.836 -0.668 7.576 1.00 0.00 H new ATOM 0 HG1 THR A 157 -5.123 -1.737 5.633 1.00 0.00 H new ATOM 0 HG21 THR A 157 -7.878 0.155 5.460 1.00 0.00 H new ATOM 0 HG22 THR A 157 -7.083 1.476 6.351 1.00 0.00 H new ATOM 0 HG23 THR A 157 -6.293 0.762 4.924 1.00 0.00 H new ATOM 604 N THR A 158 -4.240 2.246 7.951 1.00 0.00 N ATOM 605 CA THR A 158 -4.306 3.493 8.665 1.00 0.00 C ATOM 606 C THR A 158 -4.310 4.497 7.539 1.00 0.00 C ATOM 607 O THR A 158 -5.099 4.342 6.607 1.00 0.00 O ATOM 608 CB THR A 158 -3.169 3.681 9.676 1.00 0.00 C ATOM 609 OG1 THR A 158 -1.889 3.381 9.121 1.00 0.00 O ATOM 610 CG2 THR A 158 -3.419 2.738 10.872 1.00 0.00 C ATOM 0 H THR A 158 -3.471 2.217 7.282 1.00 0.00 H new ATOM 0 HA THR A 158 -5.178 3.581 9.313 1.00 0.00 H new ATOM 0 HB THR A 158 -3.162 4.728 9.979 1.00 0.00 H new ATOM 0 HG1 THR A 158 -1.197 3.517 9.802 1.00 0.00 H new ATOM 0 HG21 THR A 158 -2.619 2.858 11.603 1.00 0.00 H new ATOM 0 HG22 THR A 158 -4.374 2.984 11.336 1.00 0.00 H new ATOM 0 HG23 THR A 158 -3.440 1.706 10.523 1.00 0.00 H new ATOM 618 N LEU A 159 -3.408 5.515 7.587 1.00 0.00 N ATOM 619 CA LEU A 159 -3.080 6.468 6.541 1.00 0.00 C ATOM 620 C LEU A 159 -4.279 7.038 5.805 1.00 0.00 C ATOM 621 O LEU A 159 -5.275 7.386 6.440 1.00 0.00 O ATOM 622 CB LEU A 159 -1.918 6.010 5.612 1.00 0.00 C ATOM 623 CG LEU A 159 -2.114 4.698 4.807 1.00 0.00 C ATOM 624 CD1 LEU A 159 -1.426 4.800 3.436 1.00 0.00 C ATOM 625 CD2 LEU A 159 -1.616 3.438 5.546 1.00 0.00 C ATOM 0 H LEU A 159 -2.861 5.686 8.431 1.00 0.00 H new ATOM 0 HA LEU A 159 -2.678 7.326 7.081 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -1.720 6.813 4.902 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -1.023 5.898 6.224 1.00 0.00 H new ATOM 0 HG LEU A 159 -3.190 4.583 4.680 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -1.574 3.871 2.885 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -1.857 5.628 2.873 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -0.359 4.973 3.576 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -1.785 2.560 4.923 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -0.550 3.535 5.754 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -2.160 3.328 6.484 1.00 0.00 H new ATOM 637 N THR A 160 -4.214 7.159 4.455 1.00 0.00 N ATOM 638 CA THR A 160 -5.329 7.610 3.662 1.00 0.00 C ATOM 639 C THR A 160 -5.347 6.773 2.406 1.00 0.00 C ATOM 640 O THR A 160 -4.320 6.314 1.906 1.00 0.00 O ATOM 641 CB THR A 160 -5.323 9.119 3.397 1.00 0.00 C ATOM 642 OG1 THR A 160 -6.515 9.558 2.754 1.00 0.00 O ATOM 643 CG2 THR A 160 -4.087 9.582 2.600 1.00 0.00 C ATOM 0 H THR A 160 -3.379 6.942 3.910 1.00 0.00 H new ATOM 0 HA THR A 160 -6.258 7.468 4.214 1.00 0.00 H new ATOM 0 HB THR A 160 -5.274 9.585 4.381 1.00 0.00 H new ATOM 0 HG1 THR A 160 -6.469 10.526 2.606 1.00 0.00 H new ATOM 0 HG21 THR A 160 -4.138 10.659 2.443 1.00 0.00 H new ATOM 0 HG22 THR A 160 -3.183 9.339 3.158 1.00 0.00 H new ATOM 0 HG23 THR A 160 -4.065 9.075 1.635 1.00 0.00 H new ATOM 651 N GLU A 161 -6.577 6.525 1.906 1.00 0.00 N ATOM 652 CA GLU A 161 -6.857 5.705 0.758 1.00 0.00 C ATOM 653 C GLU A 161 -7.531 6.651 -0.193 1.00 0.00 C ATOM 654 O GLU A 161 -8.487 7.329 0.185 1.00 0.00 O ATOM 655 CB GLU A 161 -7.848 4.551 1.069 1.00 0.00 C ATOM 656 CG GLU A 161 -7.279 3.384 1.910 1.00 0.00 C ATOM 657 CD GLU A 161 -6.897 3.785 3.335 1.00 0.00 C ATOM 658 OE1 GLU A 161 -7.794 4.252 4.084 1.00 0.00 O ATOM 659 OE2 GLU A 161 -5.700 3.617 3.693 1.00 0.00 O ATOM 0 H GLU A 161 -7.421 6.917 2.324 1.00 0.00 H new ATOM 0 HA GLU A 161 -5.945 5.238 0.385 1.00 0.00 H new ATOM 0 HB2 GLU A 161 -8.708 4.967 1.594 1.00 0.00 H new ATOM 0 HB3 GLU A 161 -8.215 4.148 0.125 1.00 0.00 H new ATOM 0 HG2 GLU A 161 -8.018 2.584 1.953 1.00 0.00 H new ATOM 0 HG3 GLU A 161 -6.400 2.980 1.407 1.00 0.00 H new ATOM 666 N LYS A 162 -7.033 6.742 -1.448 1.00 0.00 N ATOM 667 CA LYS A 162 -7.643 7.609 -2.438 1.00 0.00 C ATOM 668 C LYS A 162 -7.310 6.874 -3.680 1.00 0.00 C ATOM 669 O LYS A 162 -6.175 6.371 -3.749 1.00 0.00 O ATOM 670 CB LYS A 162 -7.026 9.028 -2.476 1.00 0.00 C ATOM 671 CG LYS A 162 -7.649 9.959 -3.529 1.00 0.00 C ATOM 672 CD LYS A 162 -7.078 11.385 -3.475 1.00 0.00 C ATOM 673 CE LYS A 162 -7.735 12.356 -4.467 1.00 0.00 C ATOM 674 NZ LYS A 162 -7.489 11.943 -5.870 1.00 0.00 N ATOM 0 H LYS A 162 -6.219 6.225 -1.780 1.00 0.00 H new ATOM 0 HA LYS A 162 -8.702 7.789 -2.255 1.00 0.00 H new ATOM 0 HB2 LYS A 162 -7.135 9.486 -1.493 1.00 0.00 H new ATOM 0 HB3 LYS A 162 -5.957 8.942 -2.671 1.00 0.00 H new ATOM 0 HG2 LYS A 162 -7.480 9.542 -4.522 1.00 0.00 H new ATOM 0 HG3 LYS A 162 -8.728 9.999 -3.380 1.00 0.00 H new ATOM 0 HD2 LYS A 162 -7.199 11.776 -2.465 1.00 0.00 H new ATOM 0 HD3 LYS A 162 -6.007 11.345 -3.676 1.00 0.00 H new ATOM 0 HE2 LYS A 162 -8.808 12.398 -4.281 1.00 0.00 H new ATOM 0 HE3 LYS A 162 -7.344 13.361 -4.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 -7.902 12.646 -6.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 -6.465 11.877 -6.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 -7.928 11.016 -6.041 1.00 0.00 H new ATOM 688 N GLU A 163 -8.264 6.635 -4.660 1.00 0.00 N ATOM 689 CA GLU A 163 -7.744 5.677 -5.599 1.00 0.00 C ATOM 690 C GLU A 163 -7.808 4.293 -5.013 1.00 0.00 C ATOM 691 O GLU A 163 -7.402 4.153 -3.865 1.00 0.00 O ATOM 692 CB GLU A 163 -6.519 5.959 -6.528 1.00 0.00 C ATOM 693 CG GLU A 163 -6.449 5.009 -7.739 1.00 0.00 C ATOM 694 CD GLU A 163 -5.200 5.310 -8.565 1.00 0.00 C ATOM 695 OE1 GLU A 163 -5.098 6.448 -9.096 1.00 0.00 O ATOM 696 OE2 GLU A 163 -4.330 4.404 -8.676 1.00 0.00 O ATOM 0 H GLU A 163 -9.200 7.021 -4.781 1.00 0.00 H new ATOM 0 HA GLU A 163 -8.443 5.813 -6.424 1.00 0.00 H new ATOM 0 HB2 GLU A 163 -6.569 6.988 -6.883 1.00 0.00 H new ATOM 0 HB3 GLU A 163 -5.601 5.867 -5.947 1.00 0.00 H new ATOM 0 HG2 GLU A 163 -6.430 3.974 -7.399 1.00 0.00 H new ATOM 0 HG3 GLU A 163 -7.340 5.126 -8.356 1.00 0.00 H new ATOM 703 N GLY A 164 -8.628 3.318 -5.386 1.00 0.00 N ATOM 704 CA GLY A 164 -8.075 1.989 -5.015 1.00 0.00 C ATOM 705 C GLY A 164 -6.511 1.675 -5.036 1.00 0.00 C ATOM 706 O GLY A 164 -6.146 0.543 -5.350 1.00 0.00 O ATOM 0 H GLY A 164 -9.528 3.373 -5.863 1.00 0.00 H new ATOM 0 HA2 GLY A 164 -8.422 1.778 -4.003 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -8.548 1.260 -5.672 1.00 0.00 H new ATOM 710 N GLU A 165 -5.570 2.633 -4.665 1.00 0.00 N ATOM 711 CA GLU A 165 -4.200 2.434 -4.303 1.00 0.00 C ATOM 712 C GLU A 165 -4.011 3.325 -3.080 1.00 0.00 C ATOM 713 O GLU A 165 -4.807 4.234 -2.816 1.00 0.00 O ATOM 714 CB GLU A 165 -3.263 2.822 -5.472 1.00 0.00 C ATOM 715 CG GLU A 165 -1.782 2.487 -5.245 1.00 0.00 C ATOM 716 CD GLU A 165 -1.016 2.608 -6.561 1.00 0.00 C ATOM 717 OE1 GLU A 165 -0.973 3.735 -7.123 1.00 0.00 O ATOM 718 OE2 GLU A 165 -0.459 1.574 -7.018 1.00 0.00 O ATOM 0 H GLU A 165 -5.823 3.620 -4.626 1.00 0.00 H new ATOM 0 HA GLU A 165 -3.957 1.395 -4.083 1.00 0.00 H new ATOM 0 HB2 GLU A 165 -3.602 2.315 -6.375 1.00 0.00 H new ATOM 0 HB3 GLU A 165 -3.356 3.893 -5.654 1.00 0.00 H new ATOM 0 HG2 GLU A 165 -1.357 3.162 -4.503 1.00 0.00 H new ATOM 0 HG3 GLU A 165 -1.685 1.476 -4.849 1.00 0.00 H new ATOM 725 N ILE A 166 -2.967 3.059 -2.253 1.00 0.00 N ATOM 726 CA ILE A 166 -2.771 3.770 -1.007 1.00 0.00 C ATOM 727 C ILE A 166 -1.663 4.762 -1.204 1.00 0.00 C ATOM 728 O ILE A 166 -0.736 4.526 -1.976 1.00 0.00 O ATOM 729 CB ILE A 166 -2.491 2.879 0.199 1.00 0.00 C ATOM 730 CG1 ILE A 166 -1.152 2.104 0.123 1.00 0.00 C ATOM 731 CG2 ILE A 166 -3.700 1.935 0.365 1.00 0.00 C ATOM 732 CD1 ILE A 166 -0.887 1.236 1.357 1.00 0.00 C ATOM 0 H ILE A 166 -2.258 2.352 -2.446 1.00 0.00 H new ATOM 0 HA ILE A 166 -3.712 4.265 -0.766 1.00 0.00 H new ATOM 0 HB ILE A 166 -2.368 3.513 1.077 1.00 0.00 H new ATOM 0 HG12 ILE A 166 -1.156 1.471 -0.764 1.00 0.00 H new ATOM 0 HG13 ILE A 166 -0.334 2.815 0.004 1.00 0.00 H new ATOM 0 HG21 ILE A 166 -3.536 1.280 1.221 1.00 0.00 H new ATOM 0 HG22 ILE A 166 -4.602 2.525 0.527 1.00 0.00 H new ATOM 0 HG23 ILE A 166 -3.817 1.332 -0.536 1.00 0.00 H new ATOM 0 HD11 ILE A 166 0.066 0.720 1.241 1.00 0.00 H new ATOM 0 HD12 ILE A 166 -0.852 1.867 2.245 1.00 0.00 H new ATOM 0 HD13 ILE A 166 -1.686 0.503 1.464 1.00 0.00 H new ATOM 744 N TYR A 167 -1.762 5.919 -0.512 1.00 0.00 N ATOM 745 CA TYR A 167 -0.775 6.974 -0.583 1.00 0.00 C ATOM 746 C TYR A 167 -0.882 7.588 0.779 1.00 0.00 C ATOM 747 O TYR A 167 -1.994 7.672 1.292 1.00 0.00 O ATOM 748 CB TYR A 167 -1.091 8.107 -1.596 1.00 0.00 C ATOM 749 CG TYR A 167 -1.451 7.596 -2.967 1.00 0.00 C ATOM 750 CD1 TYR A 167 -0.468 7.097 -3.836 1.00 0.00 C ATOM 751 CD2 TYR A 167 -2.783 7.654 -3.417 1.00 0.00 C ATOM 752 CE1 TYR A 167 -0.798 6.698 -5.138 1.00 0.00 C ATOM 753 CE2 TYR A 167 -3.116 7.267 -4.718 1.00 0.00 C ATOM 754 CZ TYR A 167 -2.122 6.792 -5.584 1.00 0.00 C ATOM 755 OH TYR A 167 -2.456 6.423 -6.904 1.00 0.00 O ATOM 0 H TYR A 167 -2.542 6.130 0.111 1.00 0.00 H new ATOM 0 HA TYR A 167 0.186 6.562 -0.890 1.00 0.00 H new ATOM 0 HB2 TYR A 167 -1.915 8.709 -1.212 1.00 0.00 H new ATOM 0 HB3 TYR A 167 -0.226 8.765 -1.676 1.00 0.00 H new ATOM 0 HD1 TYR A 167 0.555 7.020 -3.497 1.00 0.00 H new ATOM 0 HD2 TYR A 167 -3.557 8.002 -2.749 1.00 0.00 H new ATOM 0 HE1 TYR A 167 -0.032 6.318 -5.797 1.00 0.00 H new ATOM 0 HE2 TYR A 167 -4.140 7.334 -5.056 1.00 0.00 H new ATOM 0 HH TYR A 167 -2.053 5.554 -7.113 1.00 0.00 H new ATOM 765 N CYS A 168 0.228 8.003 1.445 1.00 0.00 N ATOM 766 CA CYS A 168 0.152 8.208 2.875 1.00 0.00 C ATOM 767 C CYS A 168 -0.065 9.647 3.233 1.00 0.00 C ATOM 768 O CYS A 168 0.044 10.551 2.405 1.00 0.00 O ATOM 769 CB CYS A 168 1.284 7.526 3.694 1.00 0.00 C ATOM 770 SG CYS A 168 2.945 8.257 3.622 1.00 0.00 S ATOM 0 H CYS A 168 1.136 8.189 1.019 1.00 0.00 H new ATOM 0 HA CYS A 168 -0.744 7.673 3.189 1.00 0.00 H new ATOM 0 HB2 CYS A 168 0.974 7.504 4.739 1.00 0.00 H new ATOM 0 HB3 CYS A 168 1.360 6.491 3.362 1.00 0.00 H new ATOM 775 N LYS A 169 -0.426 9.854 4.519 1.00 0.00 N ATOM 776 CA LYS A 169 -0.802 11.118 5.101 1.00 0.00 C ATOM 777 C LYS A 169 0.402 12.009 5.257 1.00 0.00 C ATOM 778 O LYS A 169 0.284 13.232 5.224 1.00 0.00 O ATOM 779 CB LYS A 169 -1.469 10.891 6.479 1.00 0.00 C ATOM 780 CG LYS A 169 -2.159 12.130 7.076 1.00 0.00 C ATOM 781 CD LYS A 169 -2.784 11.928 8.472 1.00 0.00 C ATOM 782 CE LYS A 169 -4.088 11.110 8.514 1.00 0.00 C ATOM 783 NZ LYS A 169 -3.853 9.653 8.384 1.00 0.00 N ATOM 0 H LYS A 169 -0.458 9.091 5.196 1.00 0.00 H new ATOM 0 HA LYS A 169 -1.513 11.606 4.434 1.00 0.00 H new ATOM 0 HB2 LYS A 169 -2.206 10.094 6.383 1.00 0.00 H new ATOM 0 HB3 LYS A 169 -0.711 10.542 7.180 1.00 0.00 H new ATOM 0 HG2 LYS A 169 -1.430 12.938 7.136 1.00 0.00 H new ATOM 0 HG3 LYS A 169 -2.941 12.456 6.390 1.00 0.00 H new ATOM 0 HD2 LYS A 169 -2.049 11.437 9.110 1.00 0.00 H new ATOM 0 HD3 LYS A 169 -2.979 12.908 8.907 1.00 0.00 H new ATOM 0 HE2 LYS A 169 -4.606 11.308 9.452 1.00 0.00 H new ATOM 0 HE3 LYS A 169 -4.746 11.441 7.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 169 -4.291 9.308 7.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 169 -2.830 9.467 8.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 169 -4.273 9.160 9.198 1.00 0.00 H new ATOM 797 N GLY A 170 1.603 11.398 5.411 1.00 0.00 N ATOM 798 CA GLY A 170 2.847 12.095 5.612 1.00 0.00 C ATOM 799 C GLY A 170 3.326 12.766 4.358 1.00 0.00 C ATOM 800 O GLY A 170 3.905 13.850 4.427 1.00 0.00 O ATOM 0 H GLY A 170 1.710 10.384 5.395 1.00 0.00 H new ATOM 0 HA2 GLY A 170 2.722 12.841 6.397 1.00 0.00 H new ATOM 0 HA3 GLY A 170 3.604 11.392 5.959 1.00 0.00 H new ATOM 804 N CYS A 171 3.095 12.137 3.180 1.00 0.00 N ATOM 805 CA CYS A 171 3.511 12.674 1.903 1.00 0.00 C ATOM 806 C CYS A 171 2.430 13.521 1.285 1.00 0.00 C ATOM 807 O CYS A 171 2.682 14.215 0.303 1.00 0.00 O ATOM 808 CB CYS A 171 3.979 11.598 0.899 1.00 0.00 C ATOM 809 SG CYS A 171 2.794 10.296 0.546 1.00 0.00 S ATOM 0 H CYS A 171 2.612 11.241 3.111 1.00 0.00 H new ATOM 0 HA CYS A 171 4.378 13.298 2.122 1.00 0.00 H new ATOM 0 HB2 CYS A 171 4.240 12.090 -0.038 1.00 0.00 H new ATOM 0 HB3 CYS A 171 4.890 11.140 1.283 1.00 0.00 H new ATOM 0 HG CYS A 171 3.177 9.194 1.118 1.00 0.00 H new ATOM 814 N TYR A 172 1.203 13.503 1.858 1.00 0.00 N ATOM 815 CA TYR A 172 0.133 14.398 1.474 1.00 0.00 C ATOM 816 C TYR A 172 0.298 15.696 2.223 1.00 0.00 C ATOM 817 O TYR A 172 -0.096 16.752 1.730 1.00 0.00 O ATOM 818 CB TYR A 172 -1.274 13.813 1.777 1.00 0.00 C ATOM 819 CG TYR A 172 -1.814 12.922 0.674 1.00 0.00 C ATOM 820 CD1 TYR A 172 -1.025 12.349 -0.347 1.00 0.00 C ATOM 821 CD2 TYR A 172 -3.202 12.691 0.649 1.00 0.00 C ATOM 822 CE1 TYR A 172 -1.617 11.615 -1.383 1.00 0.00 C ATOM 823 CE2 TYR A 172 -3.795 11.949 -0.379 1.00 0.00 C ATOM 824 CZ TYR A 172 -3.003 11.422 -1.404 1.00 0.00 C ATOM 825 OH TYR A 172 -3.602 10.710 -2.466 1.00 0.00 O ATOM 0 H TYR A 172 0.946 12.855 2.603 1.00 0.00 H new ATOM 0 HA TYR A 172 0.197 14.549 0.396 1.00 0.00 H new ATOM 0 HB2 TYR A 172 -1.228 13.242 2.704 1.00 0.00 H new ATOM 0 HB3 TYR A 172 -1.971 14.634 1.943 1.00 0.00 H new ATOM 0 HD1 TYR A 172 0.047 12.478 -0.329 1.00 0.00 H new ATOM 0 HD2 TYR A 172 -3.821 13.094 1.437 1.00 0.00 H new ATOM 0 HE1 TYR A 172 -1.003 11.197 -2.167 1.00 0.00 H new ATOM 0 HE2 TYR A 172 -4.862 11.784 -0.381 1.00 0.00 H new ATOM 0 HH TYR A 172 -3.140 9.854 -2.588 1.00 0.00 H new ATOM 835 N ALA A 173 0.924 15.644 3.424 1.00 0.00 N ATOM 836 CA ALA A 173 1.242 16.801 4.231 1.00 0.00 C ATOM 837 C ALA A 173 2.469 17.482 3.681 1.00 0.00 C ATOM 838 O ALA A 173 2.636 18.692 3.830 1.00 0.00 O ATOM 839 CB ALA A 173 1.529 16.415 5.694 1.00 0.00 C ATOM 0 H ALA A 173 1.220 14.766 3.850 1.00 0.00 H new ATOM 0 HA ALA A 173 0.378 17.464 4.201 1.00 0.00 H new ATOM 0 HB1 ALA A 173 1.764 17.312 6.268 1.00 0.00 H new ATOM 0 HB2 ALA A 173 0.651 15.930 6.121 1.00 0.00 H new ATOM 0 HB3 ALA A 173 2.376 15.729 5.730 1.00 0.00 H new ATOM 845 N LYS A 174 3.343 16.697 3.006 1.00 0.00 N ATOM 846 CA LYS A 174 4.549 17.146 2.353 1.00 0.00 C ATOM 847 C LYS A 174 4.169 17.891 1.101 1.00 0.00 C ATOM 848 O LYS A 174 4.600 19.022 0.886 1.00 0.00 O ATOM 849 CB LYS A 174 5.415 15.925 1.966 1.00 0.00 C ATOM 850 CG LYS A 174 6.795 16.223 1.358 1.00 0.00 C ATOM 851 CD LYS A 174 7.431 14.980 0.703 1.00 0.00 C ATOM 852 CE LYS A 174 7.638 13.790 1.655 1.00 0.00 C ATOM 853 NZ LYS A 174 8.214 12.629 0.936 1.00 0.00 N ATOM 0 H LYS A 174 3.200 15.692 2.911 1.00 0.00 H new ATOM 0 HA LYS A 174 5.113 17.793 3.025 1.00 0.00 H new ATOM 0 HB2 LYS A 174 5.560 15.315 2.857 1.00 0.00 H new ATOM 0 HB3 LYS A 174 4.853 15.321 1.254 1.00 0.00 H new ATOM 0 HG2 LYS A 174 6.698 17.013 0.613 1.00 0.00 H new ATOM 0 HG3 LYS A 174 7.458 16.599 2.137 1.00 0.00 H new ATOM 0 HD2 LYS A 174 6.800 14.660 -0.126 1.00 0.00 H new ATOM 0 HD3 LYS A 174 8.395 15.262 0.280 1.00 0.00 H new ATOM 0 HE2 LYS A 174 8.300 14.083 2.470 1.00 0.00 H new ATOM 0 HE3 LYS A 174 6.685 13.508 2.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 174 8.344 11.839 1.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 174 7.569 12.338 0.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 174 9.134 12.894 0.529 1.00 0.00 H new ATOM 867 N ASN A 175 3.317 17.254 0.263 1.00 0.00 N ATOM 868 CA ASN A 175 2.823 17.811 -0.969 1.00 0.00 C ATOM 869 C ASN A 175 1.609 18.680 -0.606 1.00 0.00 C ATOM 870 O ASN A 175 1.675 19.918 -0.826 1.00 0.00 O ATOM 871 CB ASN A 175 2.385 16.697 -1.957 1.00 0.00 C ATOM 872 CG ASN A 175 2.022 17.279 -3.332 1.00 0.00 C ATOM 873 OD1 ASN A 175 2.879 17.850 -4.016 1.00 0.00 O ATOM 874 ND2 ASN A 175 0.723 17.122 -3.733 1.00 0.00 N ATOM 0 H ASN A 175 2.960 16.317 0.451 1.00 0.00 H new ATOM 0 HA ASN A 175 3.606 18.390 -1.458 1.00 0.00 H new ATOM 0 HB2 ASN A 175 3.190 15.970 -2.069 1.00 0.00 H new ATOM 0 HB3 ASN A 175 1.527 16.163 -1.548 1.00 0.00 H new ATOM 0 HD21 ASN A 175 0.421 17.485 -4.637 1.00 0.00 H new ATOM 0 HD22 ASN A 175 0.057 16.642 -3.128 1.00 0.00 H new TER 881 ASN A 175 HETATM 882 ZN ZN A 195 4.633 -8.768 2.713 1.00 0.00 ZN HETATM 883 ZN ZN A 196 3.319 8.659 1.328 1.00 0.00 ZN