USER MOD reduce.3.24.130724 H: found=0, std=0, add=520, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 521 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 91 GLN : amide:sc= 0.00123 K(o=0.28,f=-1.7!) USER MOD Set 1.2: A 139 TYR OH : rot 180:sc= 0.283 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0.0692 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 SER OG : rot -52:sc= 1.06 USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 SER OG : rot 180:sc= 0.0782 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 MET CE :methyl 178:sc= -1.78! (180deg=-2!) USER MOD Single : A 111 THR OG1 : rot 103:sc= 1.2 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 THR OG1 : rot -139:sc= -0.893 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 SER OG : rot 180:sc= 0.0287 USER MOD Single : A 134 ASN : amide:sc= -1.97 K(o=-2,f=-8.9!) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 23 N ALA A 81 176.125 14.287 -7.264 1.00 0.00 N ATOM 24 CA ALA A 81 175.014 13.765 -6.417 1.00 0.00 C ATOM 25 C ALA A 81 175.346 13.961 -4.936 1.00 0.00 C ATOM 26 O ALA A 81 176.491 14.166 -4.578 1.00 0.00 O ATOM 27 CB ALA A 81 174.948 12.273 -6.746 1.00 0.00 C ATOM 0 HA ALA A 81 174.070 14.276 -6.607 1.00 0.00 H new ATOM 0 HB1 ALA A 81 174.153 11.807 -6.164 1.00 0.00 H new ATOM 0 HB2 ALA A 81 174.743 12.143 -7.809 1.00 0.00 H new ATOM 0 HB3 ALA A 81 175.901 11.804 -6.500 1.00 0.00 H new ATOM 33 N LYS A 82 174.361 13.916 -4.073 1.00 0.00 N ATOM 34 CA LYS A 82 174.630 14.120 -2.623 1.00 0.00 C ATOM 35 C LYS A 82 174.480 12.810 -1.850 1.00 0.00 C ATOM 36 O LYS A 82 173.763 11.912 -2.248 1.00 0.00 O ATOM 37 CB LYS A 82 173.576 15.131 -2.168 1.00 0.00 C ATOM 38 CG LYS A 82 173.758 16.443 -2.936 1.00 0.00 C ATOM 39 CD LYS A 82 172.694 17.449 -2.489 1.00 0.00 C ATOM 40 CE LYS A 82 172.846 18.743 -3.291 1.00 0.00 C ATOM 41 NZ LYS A 82 173.661 19.640 -2.427 1.00 0.00 N ATOM 0 H LYS A 82 173.384 13.747 -4.313 1.00 0.00 H new ATOM 0 HA LYS A 82 175.647 14.470 -2.444 1.00 0.00 H new ATOM 0 HB2 LYS A 82 172.576 14.732 -2.341 1.00 0.00 H new ATOM 0 HB3 LYS A 82 173.667 15.309 -1.097 1.00 0.00 H new ATOM 0 HG2 LYS A 82 174.754 16.847 -2.756 1.00 0.00 H new ATOM 0 HG3 LYS A 82 173.676 16.263 -4.008 1.00 0.00 H new ATOM 0 HD2 LYS A 82 171.698 17.031 -2.638 1.00 0.00 H new ATOM 0 HD3 LYS A 82 172.798 17.655 -1.424 1.00 0.00 H new ATOM 0 HE2 LYS A 82 173.339 18.560 -4.246 1.00 0.00 H new ATOM 0 HE3 LYS A 82 171.875 19.185 -3.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 173.808 20.549 -2.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 173.163 19.802 -1.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 174.582 19.196 -2.237 1.00 0.00 H new ATOM 55 N THR A 83 175.159 12.716 -0.732 1.00 0.00 N ATOM 56 CA THR A 83 175.078 11.480 0.115 1.00 0.00 C ATOM 57 C THR A 83 173.603 11.129 0.363 1.00 0.00 C ATOM 58 O THR A 83 173.234 9.981 0.511 1.00 0.00 O ATOM 59 CB THR A 83 175.771 11.855 1.427 1.00 0.00 C ATOM 60 OG1 THR A 83 176.961 12.577 1.141 1.00 0.00 O ATOM 61 CG2 THR A 83 176.120 10.584 2.205 1.00 0.00 C ATOM 0 H THR A 83 175.770 13.446 -0.366 1.00 0.00 H new ATOM 0 HA THR A 83 175.545 10.614 -0.353 1.00 0.00 H new ATOM 0 HB THR A 83 175.103 12.473 2.027 1.00 0.00 H new ATOM 0 HG1 THR A 83 177.406 12.820 1.980 1.00 0.00 H new ATOM 0 HG21 THR A 83 176.613 10.853 3.139 1.00 0.00 H new ATOM 0 HG22 THR A 83 175.208 10.029 2.423 1.00 0.00 H new ATOM 0 HG23 THR A 83 176.788 9.963 1.607 1.00 0.00 H new ATOM 69 N GLU A 84 172.769 12.135 0.398 1.00 0.00 N ATOM 70 CA GLU A 84 171.304 11.929 0.625 1.00 0.00 C ATOM 71 C GLU A 84 170.729 10.866 -0.317 1.00 0.00 C ATOM 72 O GLU A 84 169.848 10.111 0.052 1.00 0.00 O ATOM 73 CB GLU A 84 170.679 13.288 0.303 1.00 0.00 C ATOM 74 CG GLU A 84 171.061 14.297 1.387 1.00 0.00 C ATOM 75 CD GLU A 84 170.518 15.678 1.015 1.00 0.00 C ATOM 76 OE1 GLU A 84 169.310 15.846 1.046 1.00 0.00 O ATOM 77 OE2 GLU A 84 171.321 16.544 0.707 1.00 0.00 O ATOM 0 H GLU A 84 173.045 13.109 0.277 1.00 0.00 H new ATOM 0 HA GLU A 84 171.101 11.584 1.639 1.00 0.00 H new ATOM 0 HB2 GLU A 84 171.024 13.637 -0.671 1.00 0.00 H new ATOM 0 HB3 GLU A 84 169.595 13.196 0.243 1.00 0.00 H new ATOM 0 HG2 GLU A 84 170.657 13.983 2.349 1.00 0.00 H new ATOM 0 HG3 GLU A 84 172.145 14.338 1.495 1.00 0.00 H new ATOM 84 N ASP A 85 171.214 10.811 -1.527 1.00 0.00 N ATOM 85 CA ASP A 85 170.691 9.805 -2.501 1.00 0.00 C ATOM 86 C ASP A 85 171.038 8.387 -2.039 1.00 0.00 C ATOM 87 O ASP A 85 170.204 7.501 -2.044 1.00 0.00 O ATOM 88 CB ASP A 85 171.393 10.125 -3.823 1.00 0.00 C ATOM 89 CG ASP A 85 170.500 9.703 -4.991 1.00 0.00 C ATOM 90 OD1 ASP A 85 169.295 9.848 -4.873 1.00 0.00 O ATOM 91 OD2 ASP A 85 171.038 9.240 -5.984 1.00 0.00 O ATOM 0 H ASP A 85 171.950 11.419 -1.886 1.00 0.00 H new ATOM 0 HA ASP A 85 169.606 9.851 -2.595 1.00 0.00 H new ATOM 0 HB2 ASP A 85 171.609 11.192 -3.883 1.00 0.00 H new ATOM 0 HB3 ASP A 85 172.349 9.603 -3.875 1.00 0.00 H new ATOM 96 N PHE A 86 172.267 8.169 -1.656 1.00 0.00 N ATOM 97 CA PHE A 86 172.693 6.808 -1.206 1.00 0.00 C ATOM 98 C PHE A 86 172.229 6.484 0.219 1.00 0.00 C ATOM 99 O PHE A 86 171.852 5.359 0.498 1.00 0.00 O ATOM 100 CB PHE A 86 174.222 6.828 -1.271 1.00 0.00 C ATOM 101 CG PHE A 86 174.671 6.757 -2.715 1.00 0.00 C ATOM 102 CD1 PHE A 86 174.161 5.765 -3.567 1.00 0.00 C ATOM 103 CD2 PHE A 86 175.600 7.684 -3.203 1.00 0.00 C ATOM 104 CE1 PHE A 86 174.581 5.703 -4.901 1.00 0.00 C ATOM 105 CE2 PHE A 86 176.020 7.621 -4.537 1.00 0.00 C ATOM 106 CZ PHE A 86 175.511 6.631 -5.386 1.00 0.00 C ATOM 0 H PHE A 86 173.000 8.878 -1.635 1.00 0.00 H new ATOM 0 HA PHE A 86 172.249 6.040 -1.839 1.00 0.00 H new ATOM 0 HB2 PHE A 86 174.604 7.737 -0.805 1.00 0.00 H new ATOM 0 HB3 PHE A 86 174.631 5.987 -0.711 1.00 0.00 H new ATOM 0 HD1 PHE A 86 173.444 5.049 -3.193 1.00 0.00 H new ATOM 0 HD2 PHE A 86 175.993 8.449 -2.549 1.00 0.00 H new ATOM 0 HE1 PHE A 86 174.188 4.940 -5.556 1.00 0.00 H new ATOM 0 HE2 PHE A 86 176.737 8.337 -4.911 1.00 0.00 H new ATOM 0 HZ PHE A 86 175.836 6.583 -6.415 1.00 0.00 H new ATOM 116 N VAL A 87 172.278 7.426 1.137 1.00 0.00 N ATOM 117 CA VAL A 87 171.866 7.106 2.535 1.00 0.00 C ATOM 118 C VAL A 87 170.360 6.836 2.610 1.00 0.00 C ATOM 119 O VAL A 87 169.919 5.925 3.285 1.00 0.00 O ATOM 120 CB VAL A 87 172.252 8.333 3.361 1.00 0.00 C ATOM 121 CG1 VAL A 87 173.762 8.565 3.271 1.00 0.00 C ATOM 122 CG2 VAL A 87 171.518 9.576 2.859 1.00 0.00 C ATOM 0 H VAL A 87 172.581 8.387 0.977 1.00 0.00 H new ATOM 0 HA VAL A 87 172.353 6.205 2.908 1.00 0.00 H new ATOM 0 HB VAL A 87 171.968 8.152 4.398 1.00 0.00 H new ATOM 0 HG11 VAL A 87 174.031 9.441 3.862 1.00 0.00 H new ATOM 0 HG12 VAL A 87 174.288 7.692 3.656 1.00 0.00 H new ATOM 0 HG13 VAL A 87 174.044 8.728 2.231 1.00 0.00 H new ATOM 0 HG21 VAL A 87 171.807 10.437 3.461 1.00 0.00 H new ATOM 0 HG22 VAL A 87 171.780 9.757 1.817 1.00 0.00 H new ATOM 0 HG23 VAL A 87 170.442 9.421 2.941 1.00 0.00 H new ATOM 132 N LYS A 88 169.571 7.622 1.924 1.00 0.00 N ATOM 133 CA LYS A 88 168.088 7.419 1.950 1.00 0.00 C ATOM 134 C LYS A 88 167.737 6.027 1.426 1.00 0.00 C ATOM 135 O LYS A 88 166.793 5.402 1.866 1.00 0.00 O ATOM 136 CB LYS A 88 167.515 8.496 1.027 1.00 0.00 C ATOM 137 CG LYS A 88 167.394 9.813 1.796 1.00 0.00 C ATOM 138 CD LYS A 88 166.649 10.840 0.941 1.00 0.00 C ATOM 139 CE LYS A 88 166.188 12.000 1.827 1.00 0.00 C ATOM 140 NZ LYS A 88 166.328 13.214 0.975 1.00 0.00 N ATOM 0 H LYS A 88 169.889 8.399 1.345 1.00 0.00 H new ATOM 0 HA LYS A 88 167.683 7.494 2.959 1.00 0.00 H new ATOM 0 HB2 LYS A 88 168.161 8.627 0.159 1.00 0.00 H new ATOM 0 HB3 LYS A 88 166.538 8.189 0.654 1.00 0.00 H new ATOM 0 HG2 LYS A 88 166.862 9.651 2.733 1.00 0.00 H new ATOM 0 HG3 LYS A 88 168.385 10.188 2.052 1.00 0.00 H new ATOM 0 HD2 LYS A 88 167.299 11.210 0.148 1.00 0.00 H new ATOM 0 HD3 LYS A 88 165.791 10.373 0.458 1.00 0.00 H new ATOM 0 HE2 LYS A 88 165.157 11.863 2.152 1.00 0.00 H new ATOM 0 HE3 LYS A 88 166.799 12.076 2.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 166.030 14.052 1.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 167.321 13.323 0.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 165.730 13.116 0.130 1.00 0.00 H new ATOM 154 N ALA A 89 168.499 5.543 0.485 1.00 0.00 N ATOM 155 CA ALA A 89 168.231 4.190 -0.090 1.00 0.00 C ATOM 156 C ALA A 89 168.275 3.113 0.995 1.00 0.00 C ATOM 157 O ALA A 89 167.327 2.370 1.173 1.00 0.00 O ATOM 158 CB ALA A 89 169.349 3.959 -1.109 1.00 0.00 C ATOM 0 H ALA A 89 169.302 6.028 0.085 1.00 0.00 H new ATOM 0 HA ALA A 89 167.241 4.137 -0.542 1.00 0.00 H new ATOM 0 HB1 ALA A 89 169.220 2.982 -1.575 1.00 0.00 H new ATOM 0 HB2 ALA A 89 169.310 4.734 -1.874 1.00 0.00 H new ATOM 0 HB3 ALA A 89 170.314 3.996 -0.604 1.00 0.00 H new ATOM 164 N PHE A 90 169.365 3.007 1.710 1.00 0.00 N ATOM 165 CA PHE A 90 169.465 1.955 2.769 1.00 0.00 C ATOM 166 C PHE A 90 168.685 2.362 4.025 1.00 0.00 C ATOM 167 O PHE A 90 167.883 1.606 4.541 1.00 0.00 O ATOM 168 CB PHE A 90 170.961 1.837 3.073 1.00 0.00 C ATOM 169 CG PHE A 90 171.692 1.411 1.821 1.00 0.00 C ATOM 170 CD1 PHE A 90 171.397 0.179 1.231 1.00 0.00 C ATOM 171 CD2 PHE A 90 172.658 2.250 1.247 1.00 0.00 C ATOM 172 CE1 PHE A 90 172.066 -0.218 0.070 1.00 0.00 C ATOM 173 CE2 PHE A 90 173.327 1.852 0.084 1.00 0.00 C ATOM 174 CZ PHE A 90 173.030 0.618 -0.506 1.00 0.00 C ATOM 0 H PHE A 90 170.188 3.600 1.608 1.00 0.00 H new ATOM 0 HA PHE A 90 169.038 1.008 2.440 1.00 0.00 H new ATOM 0 HB2 PHE A 90 171.348 2.792 3.427 1.00 0.00 H new ATOM 0 HB3 PHE A 90 171.126 1.111 3.869 1.00 0.00 H new ATOM 0 HD1 PHE A 90 170.652 -0.466 1.672 1.00 0.00 H new ATOM 0 HD2 PHE A 90 172.886 3.203 1.702 1.00 0.00 H new ATOM 0 HE1 PHE A 90 171.839 -1.171 -0.384 1.00 0.00 H new ATOM 0 HE2 PHE A 90 174.072 2.497 -0.358 1.00 0.00 H new ATOM 0 HZ PHE A 90 173.544 0.311 -1.405 1.00 0.00 H new ATOM 184 N GLN A 91 168.955 3.532 4.546 1.00 0.00 N ATOM 185 CA GLN A 91 168.282 3.985 5.809 1.00 0.00 C ATOM 186 C GLN A 91 166.758 3.800 5.760 1.00 0.00 C ATOM 187 O GLN A 91 166.165 3.367 6.732 1.00 0.00 O ATOM 188 CB GLN A 91 168.633 5.468 5.936 1.00 0.00 C ATOM 189 CG GLN A 91 170.119 5.616 6.268 1.00 0.00 C ATOM 190 CD GLN A 91 170.495 7.099 6.276 1.00 0.00 C ATOM 191 OE1 GLN A 91 169.882 7.898 5.595 1.00 0.00 O ATOM 192 NE2 GLN A 91 171.485 7.504 7.024 1.00 0.00 N ATOM 0 H GLN A 91 169.617 4.200 4.150 1.00 0.00 H new ATOM 0 HA GLN A 91 168.621 3.395 6.661 1.00 0.00 H new ATOM 0 HB2 GLN A 91 168.404 5.987 5.005 1.00 0.00 H new ATOM 0 HB3 GLN A 91 168.028 5.930 6.716 1.00 0.00 H new ATOM 0 HG2 GLN A 91 170.331 5.171 7.240 1.00 0.00 H new ATOM 0 HG3 GLN A 91 170.722 5.081 5.534 1.00 0.00 H new ATOM 0 HE21 GLN A 91 172.000 6.834 7.596 1.00 0.00 H new ATOM 0 HE22 GLN A 91 171.744 8.490 7.037 1.00 0.00 H new ATOM 201 N VAL A 92 166.110 4.121 4.663 1.00 0.00 N ATOM 202 CA VAL A 92 164.618 3.950 4.611 1.00 0.00 C ATOM 203 C VAL A 92 164.258 2.478 4.870 1.00 0.00 C ATOM 204 O VAL A 92 163.309 2.181 5.572 1.00 0.00 O ATOM 205 CB VAL A 92 164.197 4.406 3.205 1.00 0.00 C ATOM 206 CG1 VAL A 92 162.714 4.096 2.964 1.00 0.00 C ATOM 207 CG2 VAL A 92 164.413 5.916 3.081 1.00 0.00 C ATOM 0 H VAL A 92 166.540 4.488 3.814 1.00 0.00 H new ATOM 0 HA VAL A 92 164.100 4.534 5.371 1.00 0.00 H new ATOM 0 HB VAL A 92 164.798 3.874 2.467 1.00 0.00 H new ATOM 0 HG11 VAL A 92 162.431 4.425 1.964 1.00 0.00 H new ATOM 0 HG12 VAL A 92 162.547 3.023 3.053 1.00 0.00 H new ATOM 0 HG13 VAL A 92 162.108 4.620 3.703 1.00 0.00 H new ATOM 0 HG21 VAL A 92 164.116 6.245 2.085 1.00 0.00 H new ATOM 0 HG22 VAL A 92 163.811 6.432 3.829 1.00 0.00 H new ATOM 0 HG23 VAL A 92 165.466 6.147 3.241 1.00 0.00 H new ATOM 217 N PHE A 93 165.030 1.560 4.338 1.00 0.00 N ATOM 218 CA PHE A 93 164.751 0.112 4.589 1.00 0.00 C ATOM 219 C PHE A 93 164.978 -0.172 6.076 1.00 0.00 C ATOM 220 O PHE A 93 164.199 -0.866 6.700 1.00 0.00 O ATOM 221 CB PHE A 93 165.759 -0.654 3.727 1.00 0.00 C ATOM 222 CG PHE A 93 165.396 -2.119 3.707 1.00 0.00 C ATOM 223 CD1 PHE A 93 165.549 -2.899 4.860 1.00 0.00 C ATOM 224 CD2 PHE A 93 164.906 -2.696 2.532 1.00 0.00 C ATOM 225 CE1 PHE A 93 165.211 -4.258 4.835 1.00 0.00 C ATOM 226 CE2 PHE A 93 164.566 -4.053 2.506 1.00 0.00 C ATOM 227 CZ PHE A 93 164.719 -4.834 3.658 1.00 0.00 C ATOM 0 H PHE A 93 165.837 1.750 3.744 1.00 0.00 H new ATOM 0 HA PHE A 93 163.730 -0.178 4.341 1.00 0.00 H new ATOM 0 HB2 PHE A 93 165.762 -0.256 2.712 1.00 0.00 H new ATOM 0 HB3 PHE A 93 166.766 -0.524 4.124 1.00 0.00 H new ATOM 0 HD1 PHE A 93 165.927 -2.453 5.768 1.00 0.00 H new ATOM 0 HD2 PHE A 93 164.790 -2.094 1.643 1.00 0.00 H new ATOM 0 HE1 PHE A 93 165.330 -4.861 5.723 1.00 0.00 H new ATOM 0 HE2 PHE A 93 164.186 -4.498 1.598 1.00 0.00 H new ATOM 0 HZ PHE A 93 164.457 -5.882 3.638 1.00 0.00 H new ATOM 237 N ASP A 94 166.041 0.344 6.644 1.00 0.00 N ATOM 238 CA ASP A 94 166.318 0.088 8.095 1.00 0.00 C ATOM 239 C ASP A 94 165.224 0.712 8.967 1.00 0.00 C ATOM 240 O ASP A 94 165.384 1.793 9.501 1.00 0.00 O ATOM 241 CB ASP A 94 167.668 0.752 8.373 1.00 0.00 C ATOM 242 CG ASP A 94 168.299 0.127 9.618 1.00 0.00 C ATOM 243 OD1 ASP A 94 167.671 0.172 10.662 1.00 0.00 O ATOM 244 OD2 ASP A 94 169.401 -0.387 9.505 1.00 0.00 O ATOM 0 H ASP A 94 166.728 0.930 6.169 1.00 0.00 H new ATOM 0 HA ASP A 94 166.335 -0.978 8.323 1.00 0.00 H new ATOM 0 HB2 ASP A 94 168.330 0.627 7.516 1.00 0.00 H new ATOM 0 HB3 ASP A 94 167.534 1.824 8.519 1.00 0.00 H new ATOM 249 N LYS A 95 164.111 0.039 9.102 1.00 0.00 N ATOM 250 CA LYS A 95 162.990 0.584 9.928 1.00 0.00 C ATOM 251 C LYS A 95 163.419 0.749 11.389 1.00 0.00 C ATOM 252 O LYS A 95 163.028 1.696 12.045 1.00 0.00 O ATOM 253 CB LYS A 95 161.865 -0.450 9.817 1.00 0.00 C ATOM 254 CG LYS A 95 161.454 -0.603 8.350 1.00 0.00 C ATOM 255 CD LYS A 95 160.013 -1.113 8.272 1.00 0.00 C ATOM 256 CE LYS A 95 159.523 -1.035 6.825 1.00 0.00 C ATOM 257 NZ LYS A 95 158.114 -1.519 6.870 1.00 0.00 N ATOM 0 H LYS A 95 163.929 -0.869 8.674 1.00 0.00 H new ATOM 0 HA LYS A 95 162.678 1.569 9.580 1.00 0.00 H new ATOM 0 HB2 LYS A 95 162.198 -1.409 10.214 1.00 0.00 H new ATOM 0 HB3 LYS A 95 161.009 -0.137 10.415 1.00 0.00 H new ATOM 0 HG2 LYS A 95 161.540 0.354 7.836 1.00 0.00 H new ATOM 0 HG3 LYS A 95 162.124 -1.298 7.844 1.00 0.00 H new ATOM 0 HD2 LYS A 95 159.960 -2.141 8.630 1.00 0.00 H new ATOM 0 HD3 LYS A 95 159.369 -0.516 8.918 1.00 0.00 H new ATOM 0 HE2 LYS A 95 159.578 -0.015 6.444 1.00 0.00 H new ATOM 0 HE3 LYS A 95 160.133 -1.655 6.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 157.708 -1.495 5.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 158.093 -2.494 7.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 157.556 -0.906 7.498 1.00 0.00 H new ATOM 271 N GLU A 96 164.212 -0.159 11.909 1.00 0.00 N ATOM 272 CA GLU A 96 164.651 -0.041 13.335 1.00 0.00 C ATOM 273 C GLU A 96 165.955 0.764 13.450 1.00 0.00 C ATOM 274 O GLU A 96 166.607 0.741 14.475 1.00 0.00 O ATOM 275 CB GLU A 96 164.869 -1.482 13.800 1.00 0.00 C ATOM 276 CG GLU A 96 163.548 -2.250 13.726 1.00 0.00 C ATOM 277 CD GLU A 96 162.560 -1.669 14.740 1.00 0.00 C ATOM 278 OE1 GLU A 96 163.002 -1.252 15.797 1.00 0.00 O ATOM 279 OE2 GLU A 96 161.377 -1.653 14.440 1.00 0.00 O ATOM 0 H GLU A 96 164.572 -0.972 11.410 1.00 0.00 H new ATOM 0 HA GLU A 96 163.913 0.484 13.942 1.00 0.00 H new ATOM 0 HB2 GLU A 96 165.619 -1.967 13.175 1.00 0.00 H new ATOM 0 HB3 GLU A 96 165.250 -1.492 14.821 1.00 0.00 H new ATOM 0 HG2 GLU A 96 163.133 -2.184 12.720 1.00 0.00 H new ATOM 0 HG3 GLU A 96 163.718 -3.307 13.933 1.00 0.00 H new ATOM 286 N SER A 97 166.312 1.505 12.425 1.00 0.00 N ATOM 287 CA SER A 97 167.544 2.365 12.447 1.00 0.00 C ATOM 288 C SER A 97 168.745 1.740 13.178 1.00 0.00 C ATOM 289 O SER A 97 169.487 2.437 13.845 1.00 0.00 O ATOM 290 CB SER A 97 167.110 3.649 13.150 1.00 0.00 C ATOM 291 OG SER A 97 168.185 4.579 13.136 1.00 0.00 O ATOM 0 H SER A 97 165.787 1.551 11.551 1.00 0.00 H new ATOM 0 HA SER A 97 167.902 2.517 11.429 1.00 0.00 H new ATOM 0 HB2 SER A 97 166.240 4.074 12.650 1.00 0.00 H new ATOM 0 HB3 SER A 97 166.814 3.433 14.177 1.00 0.00 H new ATOM 0 HG SER A 97 168.991 4.152 13.494 1.00 0.00 H new ATOM 297 N THR A 98 168.951 0.449 13.060 1.00 0.00 N ATOM 298 CA THR A 98 170.120 -0.174 13.760 1.00 0.00 C ATOM 299 C THR A 98 171.422 0.398 13.188 1.00 0.00 C ATOM 300 O THR A 98 172.398 0.569 13.894 1.00 0.00 O ATOM 301 CB THR A 98 170.013 -1.676 13.487 1.00 0.00 C ATOM 302 OG1 THR A 98 169.989 -1.899 12.083 1.00 0.00 O ATOM 303 CG2 THR A 98 168.729 -2.221 14.115 1.00 0.00 C ATOM 0 H THR A 98 168.371 -0.191 12.518 1.00 0.00 H new ATOM 0 HA THR A 98 170.121 0.028 14.831 1.00 0.00 H new ATOM 0 HB THR A 98 170.872 -2.187 13.922 1.00 0.00 H new ATOM 0 HG1 THR A 98 169.922 -2.860 11.906 1.00 0.00 H new ATOM 0 HG21 THR A 98 168.654 -3.291 13.920 1.00 0.00 H new ATOM 0 HG22 THR A 98 168.749 -2.049 15.191 1.00 0.00 H new ATOM 0 HG23 THR A 98 167.868 -1.712 13.682 1.00 0.00 H new ATOM 311 N GLY A 99 171.432 0.713 11.918 1.00 0.00 N ATOM 312 CA GLY A 99 172.656 1.300 11.294 1.00 0.00 C ATOM 313 C GLY A 99 173.512 0.215 10.623 1.00 0.00 C ATOM 314 O GLY A 99 174.645 0.463 10.256 1.00 0.00 O ATOM 0 H GLY A 99 170.642 0.588 11.284 1.00 0.00 H new ATOM 0 HA2 GLY A 99 172.368 2.048 10.555 1.00 0.00 H new ATOM 0 HA3 GLY A 99 173.245 1.813 12.054 1.00 0.00 H new ATOM 318 N LYS A 100 172.990 -0.977 10.457 1.00 0.00 N ATOM 319 CA LYS A 100 173.787 -2.062 9.808 1.00 0.00 C ATOM 320 C LYS A 100 172.947 -2.752 8.730 1.00 0.00 C ATOM 321 O LYS A 100 171.732 -2.778 8.813 1.00 0.00 O ATOM 322 CB LYS A 100 174.109 -3.042 10.938 1.00 0.00 C ATOM 323 CG LYS A 100 174.942 -2.334 12.008 1.00 0.00 C ATOM 324 CD LYS A 100 175.613 -3.376 12.905 1.00 0.00 C ATOM 325 CE LYS A 100 176.254 -2.679 14.107 1.00 0.00 C ATOM 326 NZ LYS A 100 176.750 -3.784 14.973 1.00 0.00 N ATOM 0 H LYS A 100 172.048 -1.244 10.743 1.00 0.00 H new ATOM 0 HA LYS A 100 174.688 -1.685 9.324 1.00 0.00 H new ATOM 0 HB2 LYS A 100 173.187 -3.425 11.375 1.00 0.00 H new ATOM 0 HB3 LYS A 100 174.656 -3.899 10.545 1.00 0.00 H new ATOM 0 HG2 LYS A 100 175.697 -1.703 11.538 1.00 0.00 H new ATOM 0 HG3 LYS A 100 174.306 -1.680 12.605 1.00 0.00 H new ATOM 0 HD2 LYS A 100 174.878 -4.106 13.244 1.00 0.00 H new ATOM 0 HD3 LYS A 100 176.370 -3.923 12.342 1.00 0.00 H new ATOM 0 HE2 LYS A 100 177.069 -2.025 13.796 1.00 0.00 H new ATOM 0 HE3 LYS A 100 175.531 -2.058 14.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 177.203 -3.385 15.820 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 175.952 -4.386 15.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 177.442 -4.354 14.446 1.00 0.00 H new ATOM 340 N VAL A 101 173.573 -3.322 7.730 1.00 0.00 N ATOM 341 CA VAL A 101 172.789 -4.021 6.664 1.00 0.00 C ATOM 342 C VAL A 101 173.594 -5.191 6.090 1.00 0.00 C ATOM 343 O VAL A 101 174.804 -5.242 6.205 1.00 0.00 O ATOM 344 CB VAL A 101 172.509 -2.965 5.587 1.00 0.00 C ATOM 345 CG1 VAL A 101 171.655 -1.844 6.181 1.00 0.00 C ATOM 346 CG2 VAL A 101 173.832 -2.380 5.079 1.00 0.00 C ATOM 0 H VAL A 101 174.585 -3.334 7.606 1.00 0.00 H new ATOM 0 HA VAL A 101 171.861 -4.440 7.054 1.00 0.00 H new ATOM 0 HB VAL A 101 171.977 -3.431 4.758 1.00 0.00 H new ATOM 0 HG11 VAL A 101 171.456 -1.094 5.416 1.00 0.00 H new ATOM 0 HG12 VAL A 101 170.712 -2.256 6.539 1.00 0.00 H new ATOM 0 HG13 VAL A 101 172.188 -1.382 7.012 1.00 0.00 H new ATOM 0 HG21 VAL A 101 173.629 -1.630 4.314 1.00 0.00 H new ATOM 0 HG22 VAL A 101 174.367 -1.917 5.908 1.00 0.00 H new ATOM 0 HG23 VAL A 101 174.442 -3.176 4.653 1.00 0.00 H new ATOM 356 N SER A 102 172.922 -6.123 5.468 1.00 0.00 N ATOM 357 CA SER A 102 173.619 -7.299 4.868 1.00 0.00 C ATOM 358 C SER A 102 174.128 -6.954 3.468 1.00 0.00 C ATOM 359 O SER A 102 173.519 -6.178 2.757 1.00 0.00 O ATOM 360 CB SER A 102 172.541 -8.380 4.775 1.00 0.00 C ATOM 361 OG SER A 102 171.357 -7.816 4.225 1.00 0.00 O ATOM 0 H SER A 102 171.909 -6.120 5.349 1.00 0.00 H new ATOM 0 HA SER A 102 174.480 -7.614 5.458 1.00 0.00 H new ATOM 0 HB2 SER A 102 172.889 -9.204 4.152 1.00 0.00 H new ATOM 0 HB3 SER A 102 172.336 -8.792 5.763 1.00 0.00 H new ATOM 0 HG SER A 102 170.664 -8.506 4.162 1.00 0.00 H new ATOM 367 N VAL A 103 175.236 -7.526 3.062 1.00 0.00 N ATOM 368 CA VAL A 103 175.779 -7.230 1.695 1.00 0.00 C ATOM 369 C VAL A 103 174.732 -7.567 0.623 1.00 0.00 C ATOM 370 O VAL A 103 174.588 -6.852 -0.352 1.00 0.00 O ATOM 371 CB VAL A 103 177.019 -8.124 1.543 1.00 0.00 C ATOM 372 CG1 VAL A 103 177.626 -7.944 0.147 1.00 0.00 C ATOM 373 CG2 VAL A 103 178.059 -7.735 2.596 1.00 0.00 C ATOM 0 H VAL A 103 175.787 -8.183 3.614 1.00 0.00 H new ATOM 0 HA VAL A 103 176.029 -6.176 1.574 1.00 0.00 H new ATOM 0 HB VAL A 103 176.726 -9.165 1.678 1.00 0.00 H new ATOM 0 HG11 VAL A 103 178.505 -8.581 0.047 1.00 0.00 H new ATOM 0 HG12 VAL A 103 176.890 -8.220 -0.608 1.00 0.00 H new ATOM 0 HG13 VAL A 103 177.916 -6.902 0.008 1.00 0.00 H new ATOM 0 HG21 VAL A 103 178.939 -8.369 2.489 1.00 0.00 H new ATOM 0 HG22 VAL A 103 178.344 -6.692 2.458 1.00 0.00 H new ATOM 0 HG23 VAL A 103 177.636 -7.867 3.592 1.00 0.00 H new ATOM 383 N GLY A 104 174.006 -8.648 0.788 1.00 0.00 N ATOM 384 CA GLY A 104 172.977 -9.029 -0.229 1.00 0.00 C ATOM 385 C GLY A 104 171.954 -7.900 -0.392 1.00 0.00 C ATOM 386 O GLY A 104 171.550 -7.572 -1.492 1.00 0.00 O ATOM 0 H GLY A 104 174.083 -9.282 1.583 1.00 0.00 H new ATOM 0 HA2 GLY A 104 173.458 -9.235 -1.185 1.00 0.00 H new ATOM 0 HA3 GLY A 104 172.473 -9.945 0.078 1.00 0.00 H new ATOM 390 N ASP A 105 171.543 -7.300 0.696 1.00 0.00 N ATOM 391 CA ASP A 105 170.554 -6.183 0.620 1.00 0.00 C ATOM 392 C ASP A 105 171.257 -4.880 0.240 1.00 0.00 C ATOM 393 O ASP A 105 170.744 -4.086 -0.526 1.00 0.00 O ATOM 394 CB ASP A 105 169.956 -6.081 2.024 1.00 0.00 C ATOM 395 CG ASP A 105 168.777 -5.107 2.008 1.00 0.00 C ATOM 396 OD1 ASP A 105 169.014 -3.923 1.828 1.00 0.00 O ATOM 397 OD2 ASP A 105 167.657 -5.560 2.177 1.00 0.00 O ATOM 0 H ASP A 105 171.852 -7.537 1.639 1.00 0.00 H new ATOM 0 HA ASP A 105 169.788 -6.363 -0.135 1.00 0.00 H new ATOM 0 HB2 ASP A 105 169.625 -7.063 2.362 1.00 0.00 H new ATOM 0 HB3 ASP A 105 170.714 -5.740 2.729 1.00 0.00 H new ATOM 402 N LEU A 106 172.427 -4.657 0.781 1.00 0.00 N ATOM 403 CA LEU A 106 173.178 -3.402 0.469 1.00 0.00 C ATOM 404 C LEU A 106 173.461 -3.320 -1.035 1.00 0.00 C ATOM 405 O LEU A 106 173.232 -2.302 -1.660 1.00 0.00 O ATOM 406 CB LEU A 106 174.488 -3.514 1.258 1.00 0.00 C ATOM 407 CG LEU A 106 175.344 -2.265 1.023 1.00 0.00 C ATOM 408 CD1 LEU A 106 174.732 -1.077 1.766 1.00 0.00 C ATOM 409 CD2 LEU A 106 176.761 -2.517 1.543 1.00 0.00 C ATOM 0 H LEU A 106 172.897 -5.291 1.427 1.00 0.00 H new ATOM 0 HA LEU A 106 172.618 -2.506 0.738 1.00 0.00 H new ATOM 0 HB2 LEU A 106 174.275 -3.625 2.321 1.00 0.00 H new ATOM 0 HB3 LEU A 106 175.035 -4.404 0.948 1.00 0.00 H new ATOM 0 HG LEU A 106 175.380 -2.044 -0.044 1.00 0.00 H new ATOM 0 HD11 LEU A 106 175.342 -0.189 1.598 1.00 0.00 H new ATOM 0 HD12 LEU A 106 173.722 -0.898 1.397 1.00 0.00 H new ATOM 0 HD13 LEU A 106 174.695 -1.295 2.833 1.00 0.00 H new ATOM 0 HD21 LEU A 106 177.373 -1.630 1.377 1.00 0.00 H new ATOM 0 HD22 LEU A 106 176.723 -2.737 2.610 1.00 0.00 H new ATOM 0 HD23 LEU A 106 177.198 -3.363 1.013 1.00 0.00 H new ATOM 421 N ARG A 107 173.974 -4.373 -1.617 1.00 0.00 N ATOM 422 CA ARG A 107 174.287 -4.339 -3.077 1.00 0.00 C ATOM 423 C ARG A 107 173.006 -4.235 -3.912 1.00 0.00 C ATOM 424 O ARG A 107 173.017 -3.693 -5.002 1.00 0.00 O ATOM 425 CB ARG A 107 175.021 -5.649 -3.373 1.00 0.00 C ATOM 426 CG ARG A 107 175.822 -5.503 -4.669 1.00 0.00 C ATOM 427 CD ARG A 107 175.915 -6.861 -5.369 1.00 0.00 C ATOM 428 NE ARG A 107 176.603 -6.580 -6.660 1.00 0.00 N ATOM 429 CZ ARG A 107 176.029 -6.900 -7.789 1.00 0.00 C ATOM 430 NH1 ARG A 107 174.928 -6.302 -8.152 1.00 0.00 N ATOM 431 NH2 ARG A 107 176.559 -7.816 -8.552 1.00 0.00 N ATOM 0 H ARG A 107 174.189 -5.252 -1.147 1.00 0.00 H new ATOM 0 HA ARG A 107 174.893 -3.470 -3.333 1.00 0.00 H new ATOM 0 HB2 ARG A 107 175.687 -5.900 -2.547 1.00 0.00 H new ATOM 0 HB3 ARG A 107 174.306 -6.466 -3.465 1.00 0.00 H new ATOM 0 HG2 ARG A 107 175.343 -4.776 -5.325 1.00 0.00 H new ATOM 0 HG3 ARG A 107 176.821 -5.126 -4.451 1.00 0.00 H new ATOM 0 HD2 ARG A 107 176.477 -7.577 -4.769 1.00 0.00 H new ATOM 0 HD3 ARG A 107 174.926 -7.289 -5.533 1.00 0.00 H new ATOM 0 HE ARG A 107 177.522 -6.138 -6.662 1.00 0.00 H new ATOM 0 HH11 ARG A 107 174.516 -5.585 -7.555 1.00 0.00 H new ATOM 0 HH12 ARG A 107 174.479 -6.551 -9.033 1.00 0.00 H new ATOM 0 HH21 ARG A 107 177.421 -8.281 -8.267 1.00 0.00 H new ATOM 0 HH22 ARG A 107 176.112 -8.067 -9.434 1.00 0.00 H new ATOM 445 N TYR A 108 171.909 -4.768 -3.423 1.00 0.00 N ATOM 446 CA TYR A 108 170.642 -4.714 -4.217 1.00 0.00 C ATOM 447 C TYR A 108 170.113 -3.277 -4.315 1.00 0.00 C ATOM 448 O TYR A 108 169.768 -2.817 -5.387 1.00 0.00 O ATOM 449 CB TYR A 108 169.653 -5.617 -3.475 1.00 0.00 C ATOM 450 CG TYR A 108 168.357 -5.695 -4.248 1.00 0.00 C ATOM 451 CD1 TYR A 108 168.177 -6.692 -5.215 1.00 0.00 C ATOM 452 CD2 TYR A 108 167.336 -4.772 -3.997 1.00 0.00 C ATOM 453 CE1 TYR A 108 166.976 -6.766 -5.930 1.00 0.00 C ATOM 454 CE2 TYR A 108 166.134 -4.846 -4.712 1.00 0.00 C ATOM 455 CZ TYR A 108 165.955 -5.842 -5.679 1.00 0.00 C ATOM 456 OH TYR A 108 164.771 -5.914 -6.384 1.00 0.00 O ATOM 0 H TYR A 108 171.838 -5.233 -2.518 1.00 0.00 H new ATOM 0 HA TYR A 108 170.797 -5.049 -5.243 1.00 0.00 H new ATOM 0 HB2 TYR A 108 170.076 -6.614 -3.354 1.00 0.00 H new ATOM 0 HB3 TYR A 108 169.468 -5.226 -2.475 1.00 0.00 H new ATOM 0 HD1 TYR A 108 168.965 -7.404 -5.409 1.00 0.00 H new ATOM 0 HD2 TYR A 108 167.475 -4.003 -3.252 1.00 0.00 H new ATOM 0 HE1 TYR A 108 166.837 -7.536 -6.675 1.00 0.00 H new ATOM 0 HE2 TYR A 108 165.345 -4.135 -4.517 1.00 0.00 H new ATOM 0 HH TYR A 108 164.169 -5.200 -6.087 1.00 0.00 H new ATOM 466 N MET A 109 170.028 -2.573 -3.210 1.00 0.00 N ATOM 467 CA MET A 109 169.498 -1.178 -3.262 1.00 0.00 C ATOM 468 C MET A 109 170.478 -0.258 -3.971 1.00 0.00 C ATOM 469 O MET A 109 170.072 0.609 -4.722 1.00 0.00 O ATOM 470 CB MET A 109 169.321 -0.759 -1.809 1.00 0.00 C ATOM 471 CG MET A 109 167.903 -1.113 -1.348 1.00 0.00 C ATOM 472 SD MET A 109 166.976 0.397 -0.952 1.00 0.00 S ATOM 473 CE MET A 109 167.238 1.258 -2.529 1.00 0.00 C ATOM 0 H MET A 109 170.301 -2.903 -2.284 1.00 0.00 H new ATOM 0 HA MET A 109 168.561 -1.121 -3.816 1.00 0.00 H new ATOM 0 HB2 MET A 109 170.056 -1.263 -1.181 1.00 0.00 H new ATOM 0 HB3 MET A 109 169.493 0.312 -1.704 1.00 0.00 H new ATOM 0 HG2 MET A 109 167.387 -1.670 -2.130 1.00 0.00 H new ATOM 0 HG3 MET A 109 167.949 -1.760 -0.472 1.00 0.00 H new ATOM 0 HE1 MET A 109 166.712 2.213 -2.514 1.00 0.00 H new ATOM 0 HE2 MET A 109 168.304 1.433 -2.675 1.00 0.00 H new ATOM 0 HE3 MET A 109 166.855 0.646 -3.346 1.00 0.00 H new ATOM 483 N LEU A 110 171.762 -0.429 -3.760 1.00 0.00 N ATOM 484 CA LEU A 110 172.752 0.454 -4.457 1.00 0.00 C ATOM 485 C LEU A 110 172.497 0.375 -5.966 1.00 0.00 C ATOM 486 O LEU A 110 172.458 1.373 -6.658 1.00 0.00 O ATOM 487 CB LEU A 110 174.125 -0.127 -4.108 1.00 0.00 C ATOM 488 CG LEU A 110 175.169 0.990 -4.089 1.00 0.00 C ATOM 489 CD1 LEU A 110 174.992 1.833 -2.825 1.00 0.00 C ATOM 490 CD2 LEU A 110 176.571 0.376 -4.095 1.00 0.00 C ATOM 0 H LEU A 110 172.164 -1.134 -3.142 1.00 0.00 H new ATOM 0 HA LEU A 110 172.681 1.500 -4.158 1.00 0.00 H new ATOM 0 HB2 LEU A 110 174.086 -0.618 -3.136 1.00 0.00 H new ATOM 0 HB3 LEU A 110 174.405 -0.887 -4.838 1.00 0.00 H new ATOM 0 HG LEU A 110 175.041 1.621 -4.969 1.00 0.00 H new ATOM 0 HD11 LEU A 110 175.736 2.629 -2.812 1.00 0.00 H new ATOM 0 HD12 LEU A 110 173.993 2.270 -2.816 1.00 0.00 H new ATOM 0 HD13 LEU A 110 175.120 1.202 -1.946 1.00 0.00 H new ATOM 0 HD21 LEU A 110 177.316 1.171 -4.081 1.00 0.00 H new ATOM 0 HD22 LEU A 110 176.696 -0.254 -3.214 1.00 0.00 H new ATOM 0 HD23 LEU A 110 176.700 -0.227 -4.994 1.00 0.00 H new ATOM 502 N THR A 111 172.289 -0.818 -6.457 1.00 0.00 N ATOM 503 CA THR A 111 172.003 -0.999 -7.912 1.00 0.00 C ATOM 504 C THR A 111 170.712 -0.261 -8.291 1.00 0.00 C ATOM 505 O THR A 111 170.520 0.144 -9.421 1.00 0.00 O ATOM 506 CB THR A 111 171.824 -2.508 -8.100 1.00 0.00 C ATOM 507 OG1 THR A 111 172.923 -3.191 -7.514 1.00 0.00 O ATOM 508 CG2 THR A 111 171.755 -2.834 -9.592 1.00 0.00 C ATOM 0 H THR A 111 172.305 -1.679 -5.911 1.00 0.00 H new ATOM 0 HA THR A 111 172.800 -0.600 -8.540 1.00 0.00 H new ATOM 0 HB THR A 111 170.900 -2.827 -7.618 1.00 0.00 H new ATOM 0 HG1 THR A 111 172.648 -3.578 -6.657 1.00 0.00 H new ATOM 0 HG21 THR A 111 171.628 -3.908 -9.724 1.00 0.00 H new ATOM 0 HG22 THR A 111 170.910 -2.311 -10.040 1.00 0.00 H new ATOM 0 HG23 THR A 111 172.678 -2.516 -10.077 1.00 0.00 H new ATOM 516 N GLY A 112 169.842 -0.064 -7.334 1.00 0.00 N ATOM 517 CA GLY A 112 168.568 0.668 -7.583 1.00 0.00 C ATOM 518 C GLY A 112 168.774 2.182 -7.402 1.00 0.00 C ATOM 519 O GLY A 112 167.933 2.979 -7.770 1.00 0.00 O ATOM 0 H GLY A 112 169.965 -0.386 -6.374 1.00 0.00 H new ATOM 0 HA2 GLY A 112 168.214 0.461 -8.593 1.00 0.00 H new ATOM 0 HA3 GLY A 112 167.798 0.315 -6.897 1.00 0.00 H new ATOM 523 N LEU A 113 169.870 2.577 -6.798 1.00 0.00 N ATOM 524 CA LEU A 113 170.131 4.025 -6.533 1.00 0.00 C ATOM 525 C LEU A 113 170.984 4.675 -7.639 1.00 0.00 C ATOM 526 O LEU A 113 171.428 5.798 -7.493 1.00 0.00 O ATOM 527 CB LEU A 113 170.915 4.026 -5.211 1.00 0.00 C ATOM 528 CG LEU A 113 170.441 5.166 -4.296 1.00 0.00 C ATOM 529 CD1 LEU A 113 170.645 6.517 -4.984 1.00 0.00 C ATOM 530 CD2 LEU A 113 168.959 4.981 -3.965 1.00 0.00 C ATOM 0 H LEU A 113 170.604 1.947 -6.474 1.00 0.00 H new ATOM 0 HA LEU A 113 169.203 4.595 -6.496 1.00 0.00 H new ATOM 0 HB2 LEU A 113 170.785 3.069 -4.705 1.00 0.00 H new ATOM 0 HB3 LEU A 113 171.980 4.136 -5.415 1.00 0.00 H new ATOM 0 HG LEU A 113 171.026 5.143 -3.376 1.00 0.00 H new ATOM 0 HD11 LEU A 113 170.305 7.316 -4.325 1.00 0.00 H new ATOM 0 HD12 LEU A 113 171.703 6.656 -5.207 1.00 0.00 H new ATOM 0 HD13 LEU A 113 170.072 6.543 -5.911 1.00 0.00 H new ATOM 0 HD21 LEU A 113 168.627 5.791 -3.316 1.00 0.00 H new ATOM 0 HD22 LEU A 113 168.376 4.992 -4.886 1.00 0.00 H new ATOM 0 HD23 LEU A 113 168.816 4.027 -3.457 1.00 0.00 H new ATOM 542 N GLY A 114 171.245 3.986 -8.721 1.00 0.00 N ATOM 543 CA GLY A 114 172.101 4.582 -9.798 1.00 0.00 C ATOM 544 C GLY A 114 173.502 3.971 -9.696 1.00 0.00 C ATOM 545 O GLY A 114 174.495 4.600 -10.007 1.00 0.00 O ATOM 0 H GLY A 114 170.906 3.042 -8.907 1.00 0.00 H new ATOM 0 HA2 GLY A 114 171.670 4.382 -10.779 1.00 0.00 H new ATOM 0 HA3 GLY A 114 172.151 5.665 -9.687 1.00 0.00 H new ATOM 549 N GLU A 115 173.568 2.737 -9.281 1.00 0.00 N ATOM 550 CA GLU A 115 174.882 2.039 -9.172 1.00 0.00 C ATOM 551 C GLU A 115 174.958 0.889 -10.177 1.00 0.00 C ATOM 552 O GLU A 115 174.172 -0.036 -10.122 1.00 0.00 O ATOM 553 CB GLU A 115 174.941 1.504 -7.743 1.00 0.00 C ATOM 554 CG GLU A 115 176.388 1.149 -7.392 1.00 0.00 C ATOM 555 CD GLU A 115 177.138 2.413 -6.959 1.00 0.00 C ATOM 556 OE1 GLU A 115 176.801 3.479 -7.447 1.00 0.00 O ATOM 557 OE2 GLU A 115 178.037 2.292 -6.144 1.00 0.00 O ATOM 0 H GLU A 115 172.761 2.176 -9.010 1.00 0.00 H new ATOM 0 HA GLU A 115 175.716 2.707 -9.388 1.00 0.00 H new ATOM 0 HB2 GLU A 115 174.559 2.251 -7.047 1.00 0.00 H new ATOM 0 HB3 GLU A 115 174.305 0.624 -7.646 1.00 0.00 H new ATOM 0 HG2 GLU A 115 176.407 0.410 -6.591 1.00 0.00 H new ATOM 0 HG3 GLU A 115 176.881 0.698 -8.253 1.00 0.00 H new ATOM 564 N LYS A 116 175.906 0.921 -11.078 1.00 0.00 N ATOM 565 CA LYS A 116 176.032 -0.198 -12.058 1.00 0.00 C ATOM 566 C LYS A 116 177.425 -0.816 -11.953 1.00 0.00 C ATOM 567 O LYS A 116 178.175 -0.883 -12.906 1.00 0.00 O ATOM 568 CB LYS A 116 175.754 0.391 -13.441 1.00 0.00 C ATOM 569 CG LYS A 116 174.342 0.979 -13.471 1.00 0.00 C ATOM 570 CD LYS A 116 174.060 1.568 -14.854 1.00 0.00 C ATOM 571 CE LYS A 116 172.649 2.159 -14.880 1.00 0.00 C ATOM 572 NZ LYS A 116 172.224 2.078 -16.305 1.00 0.00 N ATOM 0 H LYS A 116 176.593 1.668 -11.177 1.00 0.00 H new ATOM 0 HA LYS A 116 175.322 -1.001 -11.861 1.00 0.00 H new ATOM 0 HB2 LYS A 116 176.486 1.164 -13.672 1.00 0.00 H new ATOM 0 HB3 LYS A 116 175.854 -0.381 -14.204 1.00 0.00 H new ATOM 0 HG2 LYS A 116 173.610 0.205 -13.238 1.00 0.00 H new ATOM 0 HG3 LYS A 116 174.243 1.752 -12.709 1.00 0.00 H new ATOM 0 HD2 LYS A 116 174.793 2.340 -15.088 1.00 0.00 H new ATOM 0 HD3 LYS A 116 174.156 0.795 -15.616 1.00 0.00 H new ATOM 0 HE2 LYS A 116 171.974 1.598 -14.234 1.00 0.00 H new ATOM 0 HE3 LYS A 116 172.646 3.190 -14.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 171.264 2.465 -16.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 172.881 2.627 -16.895 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 172.230 1.085 -16.613 1.00 0.00 H new ATOM 586 N LEU A 117 177.741 -1.302 -10.785 1.00 0.00 N ATOM 587 CA LEU A 117 179.046 -1.975 -10.547 1.00 0.00 C ATOM 588 C LEU A 117 178.873 -3.470 -10.817 1.00 0.00 C ATOM 589 O LEU A 117 177.808 -4.020 -10.601 1.00 0.00 O ATOM 590 CB LEU A 117 179.370 -1.719 -9.075 1.00 0.00 C ATOM 591 CG LEU A 117 179.489 -0.213 -8.829 1.00 0.00 C ATOM 592 CD1 LEU A 117 179.679 0.047 -7.334 1.00 0.00 C ATOM 593 CD2 LEU A 117 180.696 0.335 -9.595 1.00 0.00 C ATOM 0 H LEU A 117 177.133 -1.259 -9.967 1.00 0.00 H new ATOM 0 HA LEU A 117 179.846 -1.607 -11.190 1.00 0.00 H new ATOM 0 HB2 LEU A 117 178.589 -2.140 -8.442 1.00 0.00 H new ATOM 0 HB3 LEU A 117 180.302 -2.216 -8.806 1.00 0.00 H new ATOM 0 HG LEU A 117 178.581 0.283 -9.173 1.00 0.00 H new ATOM 0 HD11 LEU A 117 179.764 1.120 -7.159 1.00 0.00 H new ATOM 0 HD12 LEU A 117 178.822 -0.344 -6.785 1.00 0.00 H new ATOM 0 HD13 LEU A 117 180.587 -0.449 -6.991 1.00 0.00 H new ATOM 0 HD21 LEU A 117 180.781 1.408 -9.420 1.00 0.00 H new ATOM 0 HD22 LEU A 117 181.602 -0.162 -9.250 1.00 0.00 H new ATOM 0 HD23 LEU A 117 180.565 0.150 -10.661 1.00 0.00 H new ATOM 605 N THR A 118 179.900 -4.136 -11.274 1.00 0.00 N ATOM 606 CA THR A 118 179.783 -5.601 -11.539 1.00 0.00 C ATOM 607 C THR A 118 180.629 -6.384 -10.532 1.00 0.00 C ATOM 608 O THR A 118 181.695 -5.939 -10.157 1.00 0.00 O ATOM 609 CB THR A 118 180.320 -5.792 -12.958 1.00 0.00 C ATOM 610 OG1 THR A 118 181.498 -5.017 -13.124 1.00 0.00 O ATOM 611 CG2 THR A 118 179.264 -5.345 -13.971 1.00 0.00 C ATOM 0 H THR A 118 180.814 -3.730 -11.475 1.00 0.00 H new ATOM 0 HA THR A 118 178.758 -5.960 -11.442 1.00 0.00 H new ATOM 0 HB THR A 118 180.551 -6.845 -13.121 1.00 0.00 H new ATOM 0 HG1 THR A 118 181.491 -4.596 -14.009 1.00 0.00 H new ATOM 0 HG21 THR A 118 179.648 -5.482 -14.982 1.00 0.00 H new ATOM 0 HG22 THR A 118 178.361 -5.942 -13.842 1.00 0.00 H new ATOM 0 HG23 THR A 118 179.029 -4.293 -13.811 1.00 0.00 H new ATOM 619 N ASP A 119 180.156 -7.523 -10.059 1.00 0.00 N ATOM 620 CA ASP A 119 180.924 -8.329 -9.037 1.00 0.00 C ATOM 621 C ASP A 119 182.438 -8.358 -9.314 1.00 0.00 C ATOM 622 O ASP A 119 183.237 -8.456 -8.401 1.00 0.00 O ATOM 623 CB ASP A 119 180.349 -9.742 -9.152 1.00 0.00 C ATOM 624 CG ASP A 119 180.816 -10.586 -7.965 1.00 0.00 C ATOM 625 OD1 ASP A 119 181.938 -10.390 -7.528 1.00 0.00 O ATOM 626 OD2 ASP A 119 180.043 -11.412 -7.510 1.00 0.00 O ATOM 0 H ASP A 119 179.265 -7.932 -10.339 1.00 0.00 H new ATOM 0 HA ASP A 119 180.818 -7.893 -8.044 1.00 0.00 H new ATOM 0 HB2 ASP A 119 179.260 -9.701 -9.176 1.00 0.00 H new ATOM 0 HB3 ASP A 119 180.671 -10.201 -10.087 1.00 0.00 H new ATOM 631 N ALA A 120 182.836 -8.228 -10.556 1.00 0.00 N ATOM 632 CA ALA A 120 184.296 -8.199 -10.878 1.00 0.00 C ATOM 633 C ALA A 120 184.938 -6.987 -10.194 1.00 0.00 C ATOM 634 O ALA A 120 185.909 -7.113 -9.473 1.00 0.00 O ATOM 635 CB ALA A 120 184.367 -8.044 -12.400 1.00 0.00 C ATOM 0 H ALA A 120 182.214 -8.141 -11.359 1.00 0.00 H new ATOM 0 HA ALA A 120 184.819 -9.093 -10.538 1.00 0.00 H new ATOM 0 HB1 ALA A 120 185.410 -8.015 -12.714 1.00 0.00 H new ATOM 0 HB2 ALA A 120 183.868 -8.889 -12.875 1.00 0.00 H new ATOM 0 HB3 ALA A 120 183.873 -7.118 -12.695 1.00 0.00 H new ATOM 641 N GLU A 121 184.385 -5.817 -10.403 1.00 0.00 N ATOM 642 CA GLU A 121 184.938 -4.590 -9.756 1.00 0.00 C ATOM 643 C GLU A 121 184.529 -4.537 -8.276 1.00 0.00 C ATOM 644 O GLU A 121 185.322 -4.216 -7.413 1.00 0.00 O ATOM 645 CB GLU A 121 184.321 -3.422 -10.524 1.00 0.00 C ATOM 646 CG GLU A 121 185.047 -3.246 -11.859 1.00 0.00 C ATOM 647 CD GLU A 121 184.355 -4.087 -12.933 1.00 0.00 C ATOM 648 OE1 GLU A 121 184.728 -5.238 -13.087 1.00 0.00 O ATOM 649 OE2 GLU A 121 183.466 -3.564 -13.584 1.00 0.00 O ATOM 0 H GLU A 121 183.571 -5.660 -10.997 1.00 0.00 H new ATOM 0 HA GLU A 121 186.027 -4.566 -9.785 1.00 0.00 H new ATOM 0 HB2 GLU A 121 183.261 -3.607 -10.697 1.00 0.00 H new ATOM 0 HB3 GLU A 121 184.394 -2.507 -9.935 1.00 0.00 H new ATOM 0 HG2 GLU A 121 185.047 -2.195 -12.149 1.00 0.00 H new ATOM 0 HG3 GLU A 121 186.089 -3.549 -11.761 1.00 0.00 H new ATOM 656 N VAL A 122 183.292 -4.854 -7.989 1.00 0.00 N ATOM 657 CA VAL A 122 182.807 -4.832 -6.570 1.00 0.00 C ATOM 658 C VAL A 122 183.619 -5.805 -5.707 1.00 0.00 C ATOM 659 O VAL A 122 183.880 -5.534 -4.550 1.00 0.00 O ATOM 660 CB VAL A 122 181.334 -5.266 -6.631 1.00 0.00 C ATOM 661 CG1 VAL A 122 180.732 -5.259 -5.220 1.00 0.00 C ATOM 662 CG2 VAL A 122 180.549 -4.293 -7.513 1.00 0.00 C ATOM 0 H VAL A 122 182.592 -5.129 -8.678 1.00 0.00 H new ATOM 0 HA VAL A 122 182.919 -3.845 -6.122 1.00 0.00 H new ATOM 0 HB VAL A 122 181.276 -6.271 -7.048 1.00 0.00 H new ATOM 0 HG11 VAL A 122 179.688 -5.567 -5.268 1.00 0.00 H new ATOM 0 HG12 VAL A 122 181.285 -5.951 -4.585 1.00 0.00 H new ATOM 0 HG13 VAL A 122 180.795 -4.254 -4.803 1.00 0.00 H new ATOM 0 HG21 VAL A 122 179.505 -4.602 -7.555 1.00 0.00 H new ATOM 0 HG22 VAL A 122 180.614 -3.289 -7.094 1.00 0.00 H new ATOM 0 HG23 VAL A 122 180.969 -4.294 -8.519 1.00 0.00 H new ATOM 672 N ASP A 123 184.024 -6.926 -6.253 1.00 0.00 N ATOM 673 CA ASP A 123 184.821 -7.897 -5.440 1.00 0.00 C ATOM 674 C ASP A 123 186.153 -7.251 -5.042 1.00 0.00 C ATOM 675 O ASP A 123 186.633 -7.428 -3.939 1.00 0.00 O ATOM 676 CB ASP A 123 185.036 -9.118 -6.336 1.00 0.00 C ATOM 677 CG ASP A 123 185.838 -10.178 -5.577 1.00 0.00 C ATOM 678 OD1 ASP A 123 187.014 -9.948 -5.344 1.00 0.00 O ATOM 679 OD2 ASP A 123 185.263 -11.201 -5.242 1.00 0.00 O ATOM 0 H ASP A 123 183.840 -7.209 -7.216 1.00 0.00 H new ATOM 0 HA ASP A 123 184.316 -8.185 -4.518 1.00 0.00 H new ATOM 0 HB2 ASP A 123 184.075 -9.528 -6.646 1.00 0.00 H new ATOM 0 HB3 ASP A 123 185.566 -8.827 -7.243 1.00 0.00 H new ATOM 684 N GLU A 124 186.738 -6.487 -5.931 1.00 0.00 N ATOM 685 CA GLU A 124 188.030 -5.804 -5.607 1.00 0.00 C ATOM 686 C GLU A 124 187.836 -4.875 -4.403 1.00 0.00 C ATOM 687 O GLU A 124 188.625 -4.867 -3.478 1.00 0.00 O ATOM 688 CB GLU A 124 188.376 -4.987 -6.855 1.00 0.00 C ATOM 689 CG GLU A 124 188.725 -5.932 -8.006 1.00 0.00 C ATOM 690 CD GLU A 124 190.176 -6.398 -7.866 1.00 0.00 C ATOM 691 OE1 GLU A 124 190.614 -6.577 -6.743 1.00 0.00 O ATOM 692 OE2 GLU A 124 190.824 -6.565 -8.886 1.00 0.00 O ATOM 0 H GLU A 124 186.377 -6.306 -6.868 1.00 0.00 H new ATOM 0 HA GLU A 124 188.820 -6.511 -5.352 1.00 0.00 H new ATOM 0 HB2 GLU A 124 187.533 -4.354 -7.133 1.00 0.00 H new ATOM 0 HB3 GLU A 124 189.216 -4.325 -6.647 1.00 0.00 H new ATOM 0 HG2 GLU A 124 188.054 -6.791 -8.000 1.00 0.00 H new ATOM 0 HG3 GLU A 124 188.586 -5.425 -8.961 1.00 0.00 H new ATOM 699 N LEU A 125 186.782 -4.097 -4.415 1.00 0.00 N ATOM 700 CA LEU A 125 186.514 -3.163 -3.275 1.00 0.00 C ATOM 701 C LEU A 125 186.312 -3.962 -1.983 1.00 0.00 C ATOM 702 O LEU A 125 186.910 -3.682 -0.961 1.00 0.00 O ATOM 703 CB LEU A 125 185.216 -2.422 -3.653 1.00 0.00 C ATOM 704 CG LEU A 125 185.451 -0.902 -3.670 1.00 0.00 C ATOM 705 CD1 LEU A 125 185.906 -0.428 -2.287 1.00 0.00 C ATOM 706 CD2 LEU A 125 186.525 -0.557 -4.707 1.00 0.00 C ATOM 0 H LEU A 125 186.093 -4.068 -5.167 1.00 0.00 H new ATOM 0 HA LEU A 125 187.340 -2.473 -3.105 1.00 0.00 H new ATOM 0 HB2 LEU A 125 184.872 -2.754 -4.633 1.00 0.00 H new ATOM 0 HB3 LEU A 125 184.429 -2.667 -2.939 1.00 0.00 H new ATOM 0 HG LEU A 125 184.519 -0.402 -3.932 1.00 0.00 H new ATOM 0 HD11 LEU A 125 186.070 0.649 -2.307 1.00 0.00 H new ATOM 0 HD12 LEU A 125 185.138 -0.664 -1.551 1.00 0.00 H new ATOM 0 HD13 LEU A 125 186.834 -0.931 -2.017 1.00 0.00 H new ATOM 0 HD21 LEU A 125 186.689 0.521 -4.716 1.00 0.00 H new ATOM 0 HD22 LEU A 125 187.455 -1.063 -4.450 1.00 0.00 H new ATOM 0 HD23 LEU A 125 186.196 -0.882 -5.694 1.00 0.00 H new ATOM 718 N LEU A 126 185.463 -4.956 -2.034 1.00 0.00 N ATOM 719 CA LEU A 126 185.191 -5.798 -0.826 1.00 0.00 C ATOM 720 C LEU A 126 186.474 -6.471 -0.321 1.00 0.00 C ATOM 721 O LEU A 126 186.537 -6.936 0.801 1.00 0.00 O ATOM 722 CB LEU A 126 184.201 -6.864 -1.303 1.00 0.00 C ATOM 723 CG LEU A 126 182.790 -6.272 -1.343 1.00 0.00 C ATOM 724 CD1 LEU A 126 181.909 -7.117 -2.265 1.00 0.00 C ATOM 725 CD2 LEU A 126 182.192 -6.267 0.069 1.00 0.00 C ATOM 0 H LEU A 126 184.941 -5.224 -2.868 1.00 0.00 H new ATOM 0 HA LEU A 126 184.803 -5.200 -0.002 1.00 0.00 H new ATOM 0 HB2 LEU A 126 184.485 -7.221 -2.293 1.00 0.00 H new ATOM 0 HB3 LEU A 126 184.227 -7.724 -0.634 1.00 0.00 H new ATOM 0 HG LEU A 126 182.838 -5.250 -1.719 1.00 0.00 H new ATOM 0 HD11 LEU A 126 180.904 -6.696 -2.294 1.00 0.00 H new ATOM 0 HD12 LEU A 126 182.331 -7.119 -3.270 1.00 0.00 H new ATOM 0 HD13 LEU A 126 181.864 -8.139 -1.889 1.00 0.00 H new ATOM 0 HD21 LEU A 126 181.188 -5.845 0.037 1.00 0.00 H new ATOM 0 HD22 LEU A 126 182.145 -7.288 0.448 1.00 0.00 H new ATOM 0 HD23 LEU A 126 182.818 -5.664 0.727 1.00 0.00 H new ATOM 737 N LYS A 127 187.482 -6.558 -1.156 1.00 0.00 N ATOM 738 CA LYS A 127 188.750 -7.241 -0.746 1.00 0.00 C ATOM 739 C LYS A 127 189.342 -6.599 0.515 1.00 0.00 C ATOM 740 O LYS A 127 190.114 -7.214 1.227 1.00 0.00 O ATOM 741 CB LYS A 127 189.705 -7.034 -1.925 1.00 0.00 C ATOM 742 CG LYS A 127 191.003 -7.803 -1.670 1.00 0.00 C ATOM 743 CD LYS A 127 191.922 -7.674 -2.887 1.00 0.00 C ATOM 744 CE LYS A 127 192.634 -6.321 -2.847 1.00 0.00 C ATOM 745 NZ LYS A 127 193.540 -6.328 -4.029 1.00 0.00 N ATOM 0 H LYS A 127 187.481 -6.185 -2.105 1.00 0.00 H new ATOM 0 HA LYS A 127 188.580 -8.293 -0.515 1.00 0.00 H new ATOM 0 HB2 LYS A 127 189.240 -7.380 -2.848 1.00 0.00 H new ATOM 0 HB3 LYS A 127 189.918 -5.973 -2.053 1.00 0.00 H new ATOM 0 HG2 LYS A 127 191.501 -7.413 -0.782 1.00 0.00 H new ATOM 0 HG3 LYS A 127 190.784 -8.853 -1.477 1.00 0.00 H new ATOM 0 HD2 LYS A 127 192.654 -8.482 -2.891 1.00 0.00 H new ATOM 0 HD3 LYS A 127 191.342 -7.765 -3.805 1.00 0.00 H new ATOM 0 HE2 LYS A 127 191.921 -5.498 -2.901 1.00 0.00 H new ATOM 0 HE3 LYS A 127 193.195 -6.197 -1.921 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 194.064 -5.431 -4.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 194.212 -7.118 -3.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 192.978 -6.440 -4.897 1.00 0.00 H new ATOM 759 N GLY A 128 188.986 -5.367 0.793 1.00 0.00 N ATOM 760 CA GLY A 128 189.527 -4.682 2.004 1.00 0.00 C ATOM 761 C GLY A 128 188.401 -4.404 3.009 1.00 0.00 C ATOM 762 O GLY A 128 188.661 -4.066 4.150 1.00 0.00 O ATOM 0 H GLY A 128 188.344 -4.808 0.231 1.00 0.00 H new ATOM 0 HA2 GLY A 128 190.293 -5.303 2.469 1.00 0.00 H new ATOM 0 HA3 GLY A 128 190.006 -3.746 1.717 1.00 0.00 H new ATOM 766 N VAL A 129 187.156 -4.537 2.607 1.00 0.00 N ATOM 767 CA VAL A 129 186.030 -4.274 3.556 1.00 0.00 C ATOM 768 C VAL A 129 185.988 -5.357 4.639 1.00 0.00 C ATOM 769 O VAL A 129 186.030 -6.541 4.368 1.00 0.00 O ATOM 770 CB VAL A 129 184.756 -4.283 2.703 1.00 0.00 C ATOM 771 CG1 VAL A 129 183.536 -4.022 3.591 1.00 0.00 C ATOM 772 CG2 VAL A 129 184.850 -3.185 1.639 1.00 0.00 C ATOM 0 H VAL A 129 186.875 -4.815 1.667 1.00 0.00 H new ATOM 0 HA VAL A 129 186.143 -3.322 4.075 1.00 0.00 H new ATOM 0 HB VAL A 129 184.652 -5.256 2.222 1.00 0.00 H new ATOM 0 HG11 VAL A 129 182.633 -4.029 2.980 1.00 0.00 H new ATOM 0 HG12 VAL A 129 183.466 -4.800 4.351 1.00 0.00 H new ATOM 0 HG13 VAL A 129 183.639 -3.051 4.074 1.00 0.00 H new ATOM 0 HG21 VAL A 129 183.945 -3.189 1.031 1.00 0.00 H new ATOM 0 HG22 VAL A 129 184.956 -2.215 2.125 1.00 0.00 H new ATOM 0 HG23 VAL A 129 185.716 -3.368 1.003 1.00 0.00 H new ATOM 782 N GLU A 130 185.923 -4.929 5.871 1.00 0.00 N ATOM 783 CA GLU A 130 185.897 -5.878 7.022 1.00 0.00 C ATOM 784 C GLU A 130 184.472 -6.098 7.539 1.00 0.00 C ATOM 785 O GLU A 130 183.920 -5.277 8.245 1.00 0.00 O ATOM 786 CB GLU A 130 186.743 -5.197 8.097 1.00 0.00 C ATOM 787 CG GLU A 130 186.978 -6.170 9.254 1.00 0.00 C ATOM 788 CD GLU A 130 187.938 -7.275 8.809 1.00 0.00 C ATOM 789 OE1 GLU A 130 188.825 -6.982 8.023 1.00 0.00 O ATOM 790 OE2 GLU A 130 187.770 -8.396 9.260 1.00 0.00 O ATOM 0 H GLU A 130 185.886 -3.944 6.133 1.00 0.00 H new ATOM 0 HA GLU A 130 186.273 -6.861 6.739 1.00 0.00 H new ATOM 0 HB2 GLU A 130 187.697 -4.878 7.676 1.00 0.00 H new ATOM 0 HB3 GLU A 130 186.239 -4.301 8.458 1.00 0.00 H new ATOM 0 HG2 GLU A 130 187.392 -5.638 10.111 1.00 0.00 H new ATOM 0 HG3 GLU A 130 186.031 -6.604 9.575 1.00 0.00 H new ATOM 797 N VAL A 131 183.893 -7.225 7.210 1.00 0.00 N ATOM 798 CA VAL A 131 182.521 -7.548 7.694 1.00 0.00 C ATOM 799 C VAL A 131 182.625 -8.240 9.060 1.00 0.00 C ATOM 800 O VAL A 131 183.668 -8.753 9.419 1.00 0.00 O ATOM 801 CB VAL A 131 181.933 -8.491 6.635 1.00 0.00 C ATOM 802 CG1 VAL A 131 182.798 -9.753 6.496 1.00 0.00 C ATOM 803 CG2 VAL A 131 180.517 -8.888 7.048 1.00 0.00 C ATOM 0 H VAL A 131 184.319 -7.941 6.621 1.00 0.00 H new ATOM 0 HA VAL A 131 181.892 -6.667 7.823 1.00 0.00 H new ATOM 0 HB VAL A 131 181.912 -7.975 5.675 1.00 0.00 H new ATOM 0 HG11 VAL A 131 182.365 -10.409 5.741 1.00 0.00 H new ATOM 0 HG12 VAL A 131 183.807 -9.471 6.196 1.00 0.00 H new ATOM 0 HG13 VAL A 131 182.836 -10.275 7.452 1.00 0.00 H new ATOM 0 HG21 VAL A 131 180.094 -9.558 6.299 1.00 0.00 H new ATOM 0 HG22 VAL A 131 180.548 -9.395 8.013 1.00 0.00 H new ATOM 0 HG23 VAL A 131 179.897 -7.995 7.127 1.00 0.00 H new ATOM 813 N ASP A 132 181.566 -8.241 9.831 1.00 0.00 N ATOM 814 CA ASP A 132 181.623 -8.882 11.182 1.00 0.00 C ATOM 815 C ASP A 132 181.127 -10.333 11.137 1.00 0.00 C ATOM 816 O ASP A 132 180.808 -10.867 10.093 1.00 0.00 O ATOM 817 CB ASP A 132 180.704 -8.032 12.061 1.00 0.00 C ATOM 818 CG ASP A 132 181.344 -6.663 12.304 1.00 0.00 C ATOM 819 OD1 ASP A 132 182.563 -6.593 12.336 1.00 0.00 O ATOM 820 OD2 ASP A 132 180.604 -5.705 12.458 1.00 0.00 O ATOM 0 H ASP A 132 180.667 -7.827 9.585 1.00 0.00 H new ATOM 0 HA ASP A 132 182.644 -8.923 11.561 1.00 0.00 H new ATOM 0 HB2 ASP A 132 179.734 -7.910 11.579 1.00 0.00 H new ATOM 0 HB3 ASP A 132 180.527 -8.535 13.012 1.00 0.00 H new ATOM 825 N SER A 133 181.080 -10.967 12.282 1.00 0.00 N ATOM 826 CA SER A 133 180.628 -12.395 12.358 1.00 0.00 C ATOM 827 C SER A 133 179.122 -12.544 12.069 1.00 0.00 C ATOM 828 O SER A 133 178.613 -13.649 12.019 1.00 0.00 O ATOM 829 CB SER A 133 180.937 -12.836 13.788 1.00 0.00 C ATOM 830 OG SER A 133 180.364 -11.908 14.700 1.00 0.00 O ATOM 0 H SER A 133 181.338 -10.554 13.178 1.00 0.00 H new ATOM 0 HA SER A 133 181.136 -13.003 11.610 1.00 0.00 H new ATOM 0 HB2 SER A 133 180.537 -13.834 13.967 1.00 0.00 H new ATOM 0 HB3 SER A 133 182.015 -12.893 13.938 1.00 0.00 H new ATOM 0 HG SER A 133 180.559 -12.189 15.618 1.00 0.00 H new ATOM 836 N ASN A 134 178.413 -11.465 11.847 1.00 0.00 N ATOM 837 CA ASN A 134 176.957 -11.568 11.525 1.00 0.00 C ATOM 838 C ASN A 134 176.724 -11.309 10.026 1.00 0.00 C ATOM 839 O ASN A 134 175.622 -11.462 9.533 1.00 0.00 O ATOM 840 CB ASN A 134 176.277 -10.495 12.375 1.00 0.00 C ATOM 841 CG ASN A 134 174.760 -10.679 12.311 1.00 0.00 C ATOM 842 OD1 ASN A 134 174.105 -10.128 11.449 1.00 0.00 O ATOM 843 ND2 ASN A 134 174.169 -11.436 13.194 1.00 0.00 N ATOM 0 H ASN A 134 178.782 -10.514 11.875 1.00 0.00 H new ATOM 0 HA ASN A 134 176.558 -12.560 11.739 1.00 0.00 H new ATOM 0 HB2 ASN A 134 176.619 -10.563 13.408 1.00 0.00 H new ATOM 0 HB3 ASN A 134 176.549 -9.503 12.014 1.00 0.00 H new ATOM 0 HD21 ASN A 134 173.158 -11.565 13.160 1.00 0.00 H new ATOM 0 HD22 ASN A 134 174.718 -11.899 13.918 1.00 0.00 H new ATOM 850 N GLY A 135 177.748 -10.925 9.296 1.00 0.00 N ATOM 851 CA GLY A 135 177.579 -10.666 7.836 1.00 0.00 C ATOM 852 C GLY A 135 176.986 -9.272 7.615 1.00 0.00 C ATOM 853 O GLY A 135 176.374 -9.005 6.597 1.00 0.00 O ATOM 0 H GLY A 135 178.693 -10.781 9.653 1.00 0.00 H new ATOM 0 HA2 GLY A 135 178.542 -10.745 7.331 1.00 0.00 H new ATOM 0 HA3 GLY A 135 176.926 -11.421 7.398 1.00 0.00 H new ATOM 857 N GLU A 136 177.152 -8.387 8.566 1.00 0.00 N ATOM 858 CA GLU A 136 176.588 -7.014 8.423 1.00 0.00 C ATOM 859 C GLU A 136 177.701 -5.981 8.240 1.00 0.00 C ATOM 860 O GLU A 136 178.778 -6.098 8.794 1.00 0.00 O ATOM 861 CB GLU A 136 175.827 -6.757 9.724 1.00 0.00 C ATOM 862 CG GLU A 136 174.588 -7.653 9.778 1.00 0.00 C ATOM 863 CD GLU A 136 173.755 -7.299 11.011 1.00 0.00 C ATOM 864 OE1 GLU A 136 174.124 -7.723 12.094 1.00 0.00 O ATOM 865 OE2 GLU A 136 172.762 -6.608 10.851 1.00 0.00 O ATOM 0 H GLU A 136 177.655 -8.559 9.436 1.00 0.00 H new ATOM 0 HA GLU A 136 175.944 -6.932 7.547 1.00 0.00 H new ATOM 0 HB2 GLU A 136 176.471 -6.958 10.580 1.00 0.00 H new ATOM 0 HB3 GLU A 136 175.534 -5.709 9.785 1.00 0.00 H new ATOM 0 HG2 GLU A 136 173.993 -7.523 8.874 1.00 0.00 H new ATOM 0 HG3 GLU A 136 174.885 -8.701 9.816 1.00 0.00 H new ATOM 872 N ILE A 137 177.428 -4.968 7.467 1.00 0.00 N ATOM 873 CA ILE A 137 178.434 -3.895 7.224 1.00 0.00 C ATOM 874 C ILE A 137 177.763 -2.530 7.427 1.00 0.00 C ATOM 875 O ILE A 137 176.556 -2.441 7.556 1.00 0.00 O ATOM 876 CB ILE A 137 178.885 -4.110 5.767 1.00 0.00 C ATOM 877 CG1 ILE A 137 179.727 -5.389 5.689 1.00 0.00 C ATOM 878 CG2 ILE A 137 179.736 -2.927 5.285 1.00 0.00 C ATOM 879 CD1 ILE A 137 178.836 -6.575 5.314 1.00 0.00 C ATOM 0 H ILE A 137 176.538 -4.835 6.986 1.00 0.00 H new ATOM 0 HA ILE A 137 179.287 -3.926 7.902 1.00 0.00 H new ATOM 0 HB ILE A 137 178.002 -4.193 5.134 1.00 0.00 H new ATOM 0 HG12 ILE A 137 180.519 -5.269 4.950 1.00 0.00 H new ATOM 0 HG13 ILE A 137 180.211 -5.575 6.647 1.00 0.00 H new ATOM 0 HG21 ILE A 137 180.045 -3.097 4.254 1.00 0.00 H new ATOM 0 HG22 ILE A 137 179.149 -2.010 5.341 1.00 0.00 H new ATOM 0 HG23 ILE A 137 180.619 -2.832 5.917 1.00 0.00 H new ATOM 0 HD11 ILE A 137 179.440 -7.481 5.260 1.00 0.00 H new ATOM 0 HD12 ILE A 137 178.060 -6.700 6.069 1.00 0.00 H new ATOM 0 HD13 ILE A 137 178.372 -6.390 4.345 1.00 0.00 H new ATOM 891 N ASP A 138 178.532 -1.473 7.452 1.00 0.00 N ATOM 892 CA ASP A 138 177.934 -0.116 7.642 1.00 0.00 C ATOM 893 C ASP A 138 177.704 0.547 6.279 1.00 0.00 C ATOM 894 O ASP A 138 178.634 0.790 5.533 1.00 0.00 O ATOM 895 CB ASP A 138 178.971 0.662 8.452 1.00 0.00 C ATOM 896 CG ASP A 138 178.399 2.027 8.841 1.00 0.00 C ATOM 897 OD1 ASP A 138 178.230 2.849 7.956 1.00 0.00 O ATOM 898 OD2 ASP A 138 178.141 2.227 10.016 1.00 0.00 O ATOM 0 H ASP A 138 179.547 -1.489 7.349 1.00 0.00 H new ATOM 0 HA ASP A 138 176.969 -0.151 8.148 1.00 0.00 H new ATOM 0 HB2 ASP A 138 179.243 0.102 9.347 1.00 0.00 H new ATOM 0 HB3 ASP A 138 179.882 0.791 7.867 1.00 0.00 H new ATOM 903 N TYR A 139 176.470 0.819 5.945 1.00 0.00 N ATOM 904 CA TYR A 139 176.158 1.444 4.620 1.00 0.00 C ATOM 905 C TYR A 139 176.733 2.864 4.511 1.00 0.00 C ATOM 906 O TYR A 139 177.216 3.266 3.469 1.00 0.00 O ATOM 907 CB TYR A 139 174.618 1.469 4.538 1.00 0.00 C ATOM 908 CG TYR A 139 174.037 2.437 5.550 1.00 0.00 C ATOM 909 CD1 TYR A 139 173.833 3.776 5.193 1.00 0.00 C ATOM 910 CD2 TYR A 139 173.700 1.996 6.833 1.00 0.00 C ATOM 911 CE1 TYR A 139 173.293 4.673 6.122 1.00 0.00 C ATOM 912 CE2 TYR A 139 173.160 2.893 7.761 1.00 0.00 C ATOM 913 CZ TYR A 139 172.956 4.231 7.407 1.00 0.00 C ATOM 914 OH TYR A 139 172.423 5.114 8.322 1.00 0.00 O ATOM 0 H TYR A 139 175.658 0.635 6.535 1.00 0.00 H new ATOM 0 HA TYR A 139 176.606 0.880 3.801 1.00 0.00 H new ATOM 0 HB2 TYR A 139 174.308 1.758 3.534 1.00 0.00 H new ATOM 0 HB3 TYR A 139 174.224 0.469 4.718 1.00 0.00 H new ATOM 0 HD1 TYR A 139 174.092 4.116 4.201 1.00 0.00 H new ATOM 0 HD2 TYR A 139 173.856 0.963 7.108 1.00 0.00 H new ATOM 0 HE1 TYR A 139 173.136 5.706 5.848 1.00 0.00 H new ATOM 0 HE2 TYR A 139 172.900 2.552 8.752 1.00 0.00 H new ATOM 0 HH TYR A 139 172.245 4.645 9.164 1.00 0.00 H new ATOM 924 N LYS A 140 176.661 3.628 5.572 1.00 0.00 N ATOM 925 CA LYS A 140 177.175 5.032 5.521 1.00 0.00 C ATOM 926 C LYS A 140 178.689 5.040 5.291 1.00 0.00 C ATOM 927 O LYS A 140 179.214 5.861 4.563 1.00 0.00 O ATOM 928 CB LYS A 140 176.834 5.647 6.888 1.00 0.00 C ATOM 929 CG LYS A 140 175.899 6.844 6.699 1.00 0.00 C ATOM 930 CD LYS A 140 175.610 7.486 8.058 1.00 0.00 C ATOM 931 CE LYS A 140 175.249 8.960 7.860 1.00 0.00 C ATOM 932 NZ LYS A 140 174.877 9.450 9.215 1.00 0.00 N ATOM 0 H LYS A 140 176.270 3.342 6.469 1.00 0.00 H new ATOM 0 HA LYS A 140 176.727 5.596 4.703 1.00 0.00 H new ATOM 0 HB2 LYS A 140 176.360 4.900 7.525 1.00 0.00 H new ATOM 0 HB3 LYS A 140 177.747 5.963 7.393 1.00 0.00 H new ATOM 0 HG2 LYS A 140 176.356 7.573 6.030 1.00 0.00 H new ATOM 0 HG3 LYS A 140 174.968 6.522 6.232 1.00 0.00 H new ATOM 0 HD2 LYS A 140 174.791 6.963 8.552 1.00 0.00 H new ATOM 0 HD3 LYS A 140 176.482 7.398 8.706 1.00 0.00 H new ATOM 0 HE2 LYS A 140 176.091 9.522 7.454 1.00 0.00 H new ATOM 0 HE3 LYS A 140 174.422 9.073 7.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 174.616 10.455 9.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 174.069 8.902 9.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 175.685 9.336 9.859 1.00 0.00 H new ATOM 946 N LYS A 141 179.388 4.136 5.926 1.00 0.00 N ATOM 947 CA LYS A 141 180.873 4.082 5.775 1.00 0.00 C ATOM 948 C LYS A 141 181.271 3.651 4.361 1.00 0.00 C ATOM 949 O LYS A 141 182.181 4.202 3.771 1.00 0.00 O ATOM 950 CB LYS A 141 181.345 3.047 6.799 1.00 0.00 C ATOM 951 CG LYS A 141 181.166 3.607 8.211 1.00 0.00 C ATOM 952 CD LYS A 141 182.234 4.670 8.478 1.00 0.00 C ATOM 953 CE LYS A 141 182.081 5.204 9.905 1.00 0.00 C ATOM 954 NZ LYS A 141 183.075 4.439 10.708 1.00 0.00 N ATOM 0 H LYS A 141 178.992 3.429 6.546 1.00 0.00 H new ATOM 0 HA LYS A 141 181.325 5.060 5.938 1.00 0.00 H new ATOM 0 HB2 LYS A 141 180.776 2.124 6.688 1.00 0.00 H new ATOM 0 HB3 LYS A 141 182.392 2.799 6.625 1.00 0.00 H new ATOM 0 HG2 LYS A 141 180.172 4.040 8.318 1.00 0.00 H new ATOM 0 HG3 LYS A 141 181.245 2.805 8.945 1.00 0.00 H new ATOM 0 HD2 LYS A 141 183.228 4.243 8.343 1.00 0.00 H new ATOM 0 HD3 LYS A 141 182.137 5.486 7.761 1.00 0.00 H new ATOM 0 HE2 LYS A 141 182.277 6.275 9.949 1.00 0.00 H new ATOM 0 HE3 LYS A 141 181.069 5.050 10.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 183.032 4.748 11.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 182.859 3.423 10.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 184.030 4.611 10.333 1.00 0.00 H new ATOM 968 N PHE A 142 180.615 2.649 3.827 1.00 0.00 N ATOM 969 CA PHE A 142 180.977 2.159 2.462 1.00 0.00 C ATOM 970 C PHE A 142 180.583 3.188 1.407 1.00 0.00 C ATOM 971 O PHE A 142 181.211 3.295 0.372 1.00 0.00 O ATOM 972 CB PHE A 142 180.211 0.850 2.273 1.00 0.00 C ATOM 973 CG PHE A 142 180.735 0.118 1.060 1.00 0.00 C ATOM 974 CD1 PHE A 142 182.105 -0.149 0.939 1.00 0.00 C ATOM 975 CD2 PHE A 142 179.848 -0.305 0.061 1.00 0.00 C ATOM 976 CE1 PHE A 142 182.588 -0.837 -0.179 1.00 0.00 C ATOM 977 CE2 PHE A 142 180.332 -0.997 -1.057 1.00 0.00 C ATOM 978 CZ PHE A 142 181.703 -1.263 -1.176 1.00 0.00 C ATOM 0 H PHE A 142 179.847 2.151 4.277 1.00 0.00 H new ATOM 0 HA PHE A 142 182.051 2.003 2.357 1.00 0.00 H new ATOM 0 HB2 PHE A 142 180.317 0.225 3.160 1.00 0.00 H new ATOM 0 HB3 PHE A 142 179.147 1.055 2.153 1.00 0.00 H new ATOM 0 HD1 PHE A 142 182.788 0.177 1.709 1.00 0.00 H new ATOM 0 HD2 PHE A 142 178.792 -0.098 0.153 1.00 0.00 H new ATOM 0 HE1 PHE A 142 183.645 -1.040 -0.273 1.00 0.00 H new ATOM 0 HE2 PHE A 142 179.649 -1.325 -1.827 1.00 0.00 H new ATOM 0 HZ PHE A 142 182.077 -1.797 -2.037 1.00 0.00 H new ATOM 988 N ILE A 143 179.568 3.965 1.673 1.00 0.00 N ATOM 989 CA ILE A 143 179.145 5.017 0.703 1.00 0.00 C ATOM 990 C ILE A 143 180.125 6.197 0.781 1.00 0.00 C ATOM 991 O ILE A 143 180.588 6.694 -0.229 1.00 0.00 O ATOM 992 CB ILE A 143 177.724 5.415 1.153 1.00 0.00 C ATOM 993 CG1 ILE A 143 176.743 4.295 0.800 1.00 0.00 C ATOM 994 CG2 ILE A 143 177.272 6.701 0.457 1.00 0.00 C ATOM 995 CD1 ILE A 143 175.496 4.415 1.678 1.00 0.00 C ATOM 0 H ILE A 143 179.010 3.916 2.526 1.00 0.00 H new ATOM 0 HA ILE A 143 179.144 4.681 -0.334 1.00 0.00 H new ATOM 0 HB ILE A 143 177.741 5.580 2.230 1.00 0.00 H new ATOM 0 HG12 ILE A 143 176.467 4.357 -0.253 1.00 0.00 H new ATOM 0 HG13 ILE A 143 177.214 3.324 0.950 1.00 0.00 H new ATOM 0 HG21 ILE A 143 176.267 6.961 0.790 1.00 0.00 H new ATOM 0 HG22 ILE A 143 177.958 7.510 0.707 1.00 0.00 H new ATOM 0 HG23 ILE A 143 177.268 6.549 -0.622 1.00 0.00 H new ATOM 0 HD11 ILE A 143 174.796 3.618 1.427 1.00 0.00 H new ATOM 0 HD12 ILE A 143 175.780 4.332 2.727 1.00 0.00 H new ATOM 0 HD13 ILE A 143 175.022 5.381 1.506 1.00 0.00 H new ATOM 1007 N GLU A 144 180.446 6.642 1.969 1.00 0.00 N ATOM 1008 CA GLU A 144 181.401 7.785 2.114 1.00 0.00 C ATOM 1009 C GLU A 144 182.770 7.418 1.530 1.00 0.00 C ATOM 1010 O GLU A 144 183.498 8.277 1.067 1.00 0.00 O ATOM 1011 CB GLU A 144 181.514 8.026 3.621 1.00 0.00 C ATOM 1012 CG GLU A 144 180.185 8.566 4.154 1.00 0.00 C ATOM 1013 CD GLU A 144 180.117 10.077 3.922 1.00 0.00 C ATOM 1014 OE1 GLU A 144 181.137 10.726 4.074 1.00 0.00 O ATOM 1015 OE2 GLU A 144 179.044 10.557 3.597 1.00 0.00 O ATOM 0 H GLU A 144 180.088 6.264 2.846 1.00 0.00 H new ATOM 0 HA GLU A 144 181.056 8.672 1.582 1.00 0.00 H new ATOM 0 HB2 GLU A 144 181.771 7.097 4.130 1.00 0.00 H new ATOM 0 HB3 GLU A 144 182.316 8.735 3.827 1.00 0.00 H new ATOM 0 HG2 GLU A 144 179.353 8.073 3.652 1.00 0.00 H new ATOM 0 HG3 GLU A 144 180.091 8.346 5.218 1.00 0.00 H new ATOM 1022 N ASP A 145 183.129 6.154 1.542 1.00 0.00 N ATOM 1023 CA ASP A 145 184.455 5.753 0.977 1.00 0.00 C ATOM 1024 C ASP A 145 184.343 5.461 -0.529 1.00 0.00 C ATOM 1025 O ASP A 145 185.344 5.376 -1.216 1.00 0.00 O ATOM 1026 CB ASP A 145 184.891 4.516 1.761 1.00 0.00 C ATOM 1027 CG ASP A 145 186.407 4.345 1.645 1.00 0.00 C ATOM 1028 OD1 ASP A 145 186.878 4.150 0.536 1.00 0.00 O ATOM 1029 OD2 ASP A 145 187.071 4.412 2.666 1.00 0.00 O ATOM 0 H ASP A 145 182.565 5.390 1.916 1.00 0.00 H new ATOM 0 HA ASP A 145 185.191 6.551 1.074 1.00 0.00 H new ATOM 0 HB2 ASP A 145 184.605 4.617 2.808 1.00 0.00 H new ATOM 0 HB3 ASP A 145 184.384 3.631 1.376 1.00 0.00 H new ATOM 1034 N VAL A 146 183.147 5.355 -1.056 1.00 0.00 N ATOM 1035 CA VAL A 146 182.992 5.126 -2.526 1.00 0.00 C ATOM 1036 C VAL A 146 182.784 6.495 -3.188 1.00 0.00 C ATOM 1037 O VAL A 146 183.294 6.776 -4.255 1.00 0.00 O ATOM 1038 CB VAL A 146 181.759 4.218 -2.665 1.00 0.00 C ATOM 1039 CG1 VAL A 146 181.325 4.125 -4.134 1.00 0.00 C ATOM 1040 CG2 VAL A 146 182.111 2.817 -2.163 1.00 0.00 C ATOM 0 H VAL A 146 182.274 5.417 -0.533 1.00 0.00 H new ATOM 0 HA VAL A 146 183.853 4.657 -3.002 1.00 0.00 H new ATOM 0 HB VAL A 146 180.943 4.639 -2.078 1.00 0.00 H new ATOM 0 HG11 VAL A 146 180.451 3.479 -4.215 1.00 0.00 H new ATOM 0 HG12 VAL A 146 181.076 5.120 -4.504 1.00 0.00 H new ATOM 0 HG13 VAL A 146 182.139 3.710 -4.728 1.00 0.00 H new ATOM 0 HG21 VAL A 146 181.241 2.167 -2.258 1.00 0.00 H new ATOM 0 HG22 VAL A 146 182.932 2.414 -2.756 1.00 0.00 H new ATOM 0 HG23 VAL A 146 182.411 2.870 -1.116 1.00 0.00 H new ATOM 1050 N LEU A 147 182.050 7.350 -2.525 1.00 0.00 N ATOM 1051 CA LEU A 147 181.799 8.728 -3.052 1.00 0.00 C ATOM 1052 C LEU A 147 183.117 9.464 -3.329 1.00 0.00 C ATOM 1053 O LEU A 147 183.157 10.410 -4.093 1.00 0.00 O ATOM 1054 CB LEU A 147 181.016 9.443 -1.948 1.00 0.00 C ATOM 1055 CG LEU A 147 179.526 9.445 -2.295 1.00 0.00 C ATOM 1056 CD1 LEU A 147 178.978 8.022 -2.185 1.00 0.00 C ATOM 1057 CD2 LEU A 147 178.776 10.357 -1.323 1.00 0.00 C ATOM 0 H LEU A 147 181.607 7.151 -1.628 1.00 0.00 H new ATOM 0 HA LEU A 147 181.255 8.701 -3.996 1.00 0.00 H new ATOM 0 HB2 LEU A 147 181.177 8.944 -0.992 1.00 0.00 H new ATOM 0 HB3 LEU A 147 181.375 10.466 -1.837 1.00 0.00 H new ATOM 0 HG LEU A 147 179.390 9.811 -3.313 1.00 0.00 H new ATOM 0 HD11 LEU A 147 177.916 8.021 -2.432 1.00 0.00 H new ATOM 0 HD12 LEU A 147 179.512 7.372 -2.878 1.00 0.00 H new ATOM 0 HD13 LEU A 147 179.114 7.657 -1.167 1.00 0.00 H new ATOM 0 HD21 LEU A 147 177.715 10.358 -1.571 1.00 0.00 H new ATOM 0 HD22 LEU A 147 178.911 9.993 -0.305 1.00 0.00 H new ATOM 0 HD23 LEU A 147 179.168 11.371 -1.400 1.00 0.00 H new