USER MOD reduce.3.24.130724 H: found=0, std=0, add=731, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 732 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 154 THR OG1 : rot 130:sc= 0.0533 USER MOD Set 1.2: A 156 LYS NZ :NH3+ 145:sc= -0.28 (180deg=-0.859) USER MOD Set 2.1: A 90 TYR OH : rot -140:sc= 1.17 USER MOD Set 2.2: A 105 SER OG : rot -110:sc= -0.37 USER MOD Set 2.3: A 111 SER OG : rot -118:sc= 0.357 USER MOD Set 2.4: A 115 HIS : no HD1:sc= 1.25 K(o=2.4,f=-7!) USER MOD Set 3.1: A 93 TYR OH : rot -165:sc= -0.167! USER MOD Set 3.2: A 150 HIS : no HE2:sc= -0.258! C(o=-0.43!,f=-8.5!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 81:sc= 0.941 USER MOD Single : A 72 THR OG1 : rot -128:sc= 0.0886 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0.138 USER MOD Single : A 82 SER OG : rot 66:sc= 0.575 USER MOD Single : A 85 SER OG : rot 180:sc= 0.0789 USER MOD Single : A 87 SER OG : rot 180:sc= -0.476 USER MOD Single : A 95 LYS NZ :NH3+ -164:sc= 2.19 (180deg=1.47) USER MOD Single : A 96 SER OG : rot 80:sc= 0.013 USER MOD Single : A 100 GLN : amide:sc= 0.155 X(o=0.15,f=0) USER MOD Single : A 107 ASN : amide:sc= -0.409 K(o=-0.41,f=-9.7!) USER MOD Single : A 113 SER OG : rot 90:sc= 1.29 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 123 CYS SG : rot 180:sc= -2.36! USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ -171:sc= -0.0053 (180deg=-0.101) USER MOD Single : A 140 THR OG1 : rot 93:sc= 1.27 USER MOD Single : A 141 GLN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 144 LYS NZ :NH3+ -167:sc= 1.22 (180deg=0.946) USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 ASN : amide:sc= 0.122 K(o=0.12,f=-0.64) USER MOD ----------------------------------------------------------------- ATOM 67 N LYS A 67 -4.569 3.376 -13.401 1.00 0.00 N ATOM 68 CA LYS A 67 -3.449 2.494 -13.589 1.00 0.00 C ATOM 69 C LYS A 67 -2.226 3.162 -13.004 1.00 0.00 C ATOM 70 O LYS A 67 -1.559 2.614 -12.163 1.00 0.00 O ATOM 71 CB LYS A 67 -3.158 2.158 -15.087 1.00 0.00 C ATOM 72 CG LYS A 67 -4.296 1.523 -15.898 1.00 0.00 C ATOM 73 CD LYS A 67 -5.369 2.535 -16.263 1.00 0.00 C ATOM 74 CE LYS A 67 -6.474 1.920 -17.092 1.00 0.00 C ATOM 75 NZ LYS A 67 -7.534 2.904 -17.382 1.00 0.00 N ATOM 0 HA LYS A 67 -3.692 1.553 -13.095 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -2.860 3.079 -15.588 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -2.302 1.484 -15.122 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -3.890 1.081 -16.808 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -4.743 0.713 -15.322 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -5.793 2.958 -15.352 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -4.917 3.358 -16.816 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -6.062 1.539 -18.027 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -6.900 1.069 -16.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -8.279 2.454 -17.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -7.942 3.248 -16.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -7.130 3.704 -17.909 1.00 0.00 H new ATOM 89 N SER A 68 -1.971 4.376 -13.442 1.00 0.00 N ATOM 90 CA SER A 68 -0.785 5.106 -13.052 1.00 0.00 C ATOM 91 C SER A 68 -1.136 6.343 -12.189 1.00 0.00 C ATOM 92 O SER A 68 -2.291 6.790 -12.170 1.00 0.00 O ATOM 93 CB SER A 68 -0.059 5.521 -14.327 1.00 0.00 C ATOM 94 OG SER A 68 0.131 4.389 -15.170 1.00 0.00 O ATOM 0 H SER A 68 -2.582 4.886 -14.080 1.00 0.00 H new ATOM 0 HA SER A 68 -0.146 4.472 -12.438 1.00 0.00 H new ATOM 0 HB2 SER A 68 -0.635 6.283 -14.852 1.00 0.00 H new ATOM 0 HB3 SER A 68 0.905 5.965 -14.078 1.00 0.00 H new ATOM 0 HG SER A 68 0.596 4.664 -15.987 1.00 0.00 H new ATOM 100 N LEU A 69 -0.123 6.902 -11.515 1.00 0.00 N ATOM 101 CA LEU A 69 -0.262 8.084 -10.636 1.00 0.00 C ATOM 102 C LEU A 69 -0.718 9.290 -11.407 1.00 0.00 C ATOM 103 O LEU A 69 -1.377 10.180 -10.868 1.00 0.00 O ATOM 104 CB LEU A 69 1.061 8.406 -9.958 1.00 0.00 C ATOM 105 CG LEU A 69 1.432 7.553 -8.769 1.00 0.00 C ATOM 106 CD1 LEU A 69 2.880 7.766 -8.407 1.00 0.00 C ATOM 107 CD2 LEU A 69 0.564 7.936 -7.594 1.00 0.00 C ATOM 0 H LEU A 69 0.832 6.546 -11.561 1.00 0.00 H new ATOM 0 HA LEU A 69 -1.012 7.839 -9.884 1.00 0.00 H new ATOM 0 HB2 LEU A 69 1.855 8.321 -10.700 1.00 0.00 H new ATOM 0 HB3 LEU A 69 1.035 9.447 -9.637 1.00 0.00 H new ATOM 0 HG LEU A 69 1.279 6.504 -9.021 1.00 0.00 H new ATOM 0 HD11 LEU A 69 3.135 7.145 -7.548 1.00 0.00 H new ATOM 0 HD12 LEU A 69 3.511 7.492 -9.253 1.00 0.00 H new ATOM 0 HD13 LEU A 69 3.042 8.815 -8.158 1.00 0.00 H new ATOM 0 HD21 LEU A 69 0.827 7.323 -6.732 1.00 0.00 H new ATOM 0 HD22 LEU A 69 0.721 8.987 -7.353 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -0.484 7.774 -7.848 1.00 0.00 H new ATOM 119 N THR A 70 -0.376 9.304 -12.667 1.00 0.00 N ATOM 120 CA THR A 70 -0.757 10.355 -13.580 1.00 0.00 C ATOM 121 C THR A 70 -2.316 10.477 -13.678 1.00 0.00 C ATOM 122 O THR A 70 -2.854 11.527 -14.013 1.00 0.00 O ATOM 123 CB THR A 70 -0.140 10.061 -14.971 1.00 0.00 C ATOM 124 OG1 THR A 70 1.283 9.805 -14.824 1.00 0.00 O ATOM 125 CG2 THR A 70 -0.319 11.242 -15.907 1.00 0.00 C ATOM 0 H THR A 70 0.187 8.571 -13.099 1.00 0.00 H new ATOM 0 HA THR A 70 -0.379 11.308 -13.209 1.00 0.00 H new ATOM 0 HB THR A 70 -0.648 9.192 -15.390 1.00 0.00 H new ATOM 0 HG1 THR A 70 1.420 8.881 -14.529 1.00 0.00 H new ATOM 0 HG21 THR A 70 0.123 11.009 -16.876 1.00 0.00 H new ATOM 0 HG22 THR A 70 -1.382 11.448 -16.033 1.00 0.00 H new ATOM 0 HG23 THR A 70 0.173 12.118 -15.485 1.00 0.00 H new ATOM 133 N GLU A 71 -3.012 9.409 -13.330 1.00 0.00 N ATOM 134 CA GLU A 71 -4.470 9.364 -13.388 1.00 0.00 C ATOM 135 C GLU A 71 -5.059 9.468 -11.982 1.00 0.00 C ATOM 136 O GLU A 71 -6.256 9.219 -11.775 1.00 0.00 O ATOM 137 CB GLU A 71 -4.889 8.025 -13.947 1.00 0.00 C ATOM 138 CG GLU A 71 -4.318 7.682 -15.286 1.00 0.00 C ATOM 139 CD GLU A 71 -4.599 6.257 -15.620 1.00 0.00 C ATOM 140 OE1 GLU A 71 -3.772 5.387 -15.263 1.00 0.00 O ATOM 141 OE2 GLU A 71 -5.637 5.975 -16.238 1.00 0.00 O ATOM 0 H GLU A 71 -2.585 8.544 -12.998 1.00 0.00 H new ATOM 0 HA GLU A 71 -4.822 10.190 -14.006 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -4.601 7.248 -13.238 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -5.976 8.004 -14.018 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -4.746 8.332 -16.049 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -3.242 7.857 -15.285 1.00 0.00 H new ATOM 148 N THR A 72 -4.242 9.807 -11.022 1.00 0.00 N ATOM 149 CA THR A 72 -4.668 9.804 -9.656 1.00 0.00 C ATOM 150 C THR A 72 -4.911 11.230 -9.129 1.00 0.00 C ATOM 151 O THR A 72 -4.177 12.164 -9.482 1.00 0.00 O ATOM 152 CB THR A 72 -3.602 9.113 -8.820 1.00 0.00 C ATOM 153 OG1 THR A 72 -3.211 7.913 -9.490 1.00 0.00 O ATOM 154 CG2 THR A 72 -4.157 8.746 -7.483 1.00 0.00 C ATOM 0 H THR A 72 -3.273 10.090 -11.166 1.00 0.00 H new ATOM 0 HA THR A 72 -5.616 9.270 -9.585 1.00 0.00 H new ATOM 0 HB THR A 72 -2.753 9.784 -8.689 1.00 0.00 H new ATOM 0 HG1 THR A 72 -3.264 7.158 -8.867 1.00 0.00 H new ATOM 0 HG21 THR A 72 -3.386 8.252 -6.892 1.00 0.00 H new ATOM 0 HG22 THR A 72 -4.488 9.647 -6.967 1.00 0.00 H new ATOM 0 HG23 THR A 72 -5.003 8.071 -7.613 1.00 0.00 H new ATOM 162 N GLU A 73 -5.938 11.383 -8.291 1.00 0.00 N ATOM 163 CA GLU A 73 -6.279 12.671 -7.713 1.00 0.00 C ATOM 164 C GLU A 73 -5.468 12.918 -6.435 1.00 0.00 C ATOM 165 O GLU A 73 -4.969 11.967 -5.813 1.00 0.00 O ATOM 166 CB GLU A 73 -7.778 12.759 -7.424 1.00 0.00 C ATOM 167 CG GLU A 73 -8.283 11.778 -6.381 1.00 0.00 C ATOM 168 CD GLU A 73 -9.755 11.926 -6.135 1.00 0.00 C ATOM 169 OE1 GLU A 73 -10.184 12.958 -5.553 1.00 0.00 O ATOM 170 OE2 GLU A 73 -10.523 11.041 -6.533 1.00 0.00 O ATOM 0 H GLU A 73 -6.549 10.620 -8.000 1.00 0.00 H new ATOM 0 HA GLU A 73 -6.028 13.446 -8.437 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -8.011 13.771 -7.094 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -8.323 12.593 -8.353 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -8.071 10.760 -6.708 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -7.742 11.932 -5.447 1.00 0.00 H new ATOM 177 N LEU A 74 -5.359 14.173 -6.044 1.00 0.00 N ATOM 178 CA LEU A 74 -4.550 14.573 -4.915 1.00 0.00 C ATOM 179 C LEU A 74 -5.455 15.002 -3.756 1.00 0.00 C ATOM 180 O LEU A 74 -6.444 15.717 -3.958 1.00 0.00 O ATOM 181 CB LEU A 74 -3.620 15.738 -5.375 1.00 0.00 C ATOM 182 CG LEU A 74 -2.445 16.197 -4.459 1.00 0.00 C ATOM 183 CD1 LEU A 74 -2.909 16.915 -3.206 1.00 0.00 C ATOM 184 CD2 LEU A 74 -1.555 15.025 -4.101 1.00 0.00 C ATOM 0 H LEU A 74 -5.834 14.948 -6.506 1.00 0.00 H new ATOM 0 HA LEU A 74 -3.937 13.744 -4.562 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -3.191 15.452 -6.336 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -4.252 16.608 -5.554 1.00 0.00 H new ATOM 0 HG LEU A 74 -1.871 16.921 -5.037 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -2.043 17.208 -2.613 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -3.475 17.804 -3.485 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -3.543 16.250 -2.619 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -0.742 15.368 -3.461 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -2.140 14.272 -3.572 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -1.142 14.590 -5.011 1.00 0.00 H new ATOM 196 N LEU A 75 -5.149 14.512 -2.575 1.00 0.00 N ATOM 197 CA LEU A 75 -5.825 14.906 -1.357 1.00 0.00 C ATOM 198 C LEU A 75 -4.792 15.321 -0.316 1.00 0.00 C ATOM 199 O LEU A 75 -3.711 14.716 -0.235 1.00 0.00 O ATOM 200 CB LEU A 75 -6.706 13.774 -0.762 1.00 0.00 C ATOM 201 CG LEU A 75 -8.032 13.419 -1.465 1.00 0.00 C ATOM 202 CD1 LEU A 75 -8.929 14.636 -1.609 1.00 0.00 C ATOM 203 CD2 LEU A 75 -7.802 12.745 -2.798 1.00 0.00 C ATOM 0 H LEU A 75 -4.414 13.820 -2.431 1.00 0.00 H new ATOM 0 HA LEU A 75 -6.483 15.736 -1.613 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -6.100 12.869 -0.724 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -6.940 14.044 0.268 1.00 0.00 H new ATOM 0 HG LEU A 75 -8.548 12.702 -0.827 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -9.854 14.349 -2.109 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -9.159 15.037 -0.622 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -8.418 15.396 -2.200 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -8.762 12.512 -3.259 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -7.239 13.412 -3.451 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -7.239 11.824 -2.648 1.00 0.00 H new ATOM 215 N PRO A 76 -5.048 16.393 0.438 1.00 0.00 N ATOM 216 CA PRO A 76 -4.194 16.787 1.551 1.00 0.00 C ATOM 217 C PRO A 76 -4.411 15.857 2.753 1.00 0.00 C ATOM 218 O PRO A 76 -5.532 15.440 3.031 1.00 0.00 O ATOM 219 CB PRO A 76 -4.653 18.218 1.883 1.00 0.00 C ATOM 220 CG PRO A 76 -5.531 18.613 0.744 1.00 0.00 C ATOM 221 CD PRO A 76 -6.145 17.345 0.250 1.00 0.00 C ATOM 0 HA PRO A 76 -3.133 16.732 1.308 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -5.194 18.250 2.829 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -3.803 18.893 1.979 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -6.296 19.319 1.066 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -4.956 19.102 -0.042 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -7.030 17.068 0.823 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -6.450 17.417 -0.794 1.00 0.00 H new ATOM 229 N ILE A 77 -3.342 15.566 3.472 1.00 0.00 N ATOM 230 CA ILE A 77 -3.381 14.614 4.604 1.00 0.00 C ATOM 231 C ILE A 77 -4.035 15.224 5.843 1.00 0.00 C ATOM 232 O ILE A 77 -4.399 14.516 6.777 1.00 0.00 O ATOM 233 CB ILE A 77 -1.953 14.094 4.998 1.00 0.00 C ATOM 234 CG1 ILE A 77 -1.107 15.152 5.781 1.00 0.00 C ATOM 235 CG2 ILE A 77 -1.199 13.612 3.764 1.00 0.00 C ATOM 236 CD1 ILE A 77 -0.768 16.437 5.038 1.00 0.00 C ATOM 0 H ILE A 77 -2.422 15.971 3.302 1.00 0.00 H new ATOM 0 HA ILE A 77 -3.981 13.774 4.254 1.00 0.00 H new ATOM 0 HB ILE A 77 -2.106 13.255 5.677 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -1.648 15.416 6.690 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -0.174 14.681 6.091 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -0.212 13.255 4.057 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -1.753 12.800 3.293 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -1.092 14.436 3.058 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -0.180 17.088 5.686 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -0.192 16.199 4.144 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -1.689 16.946 4.752 1.00 0.00 H new ATOM 248 N THR A 78 -4.158 16.523 5.841 1.00 0.00 N ATOM 249 CA THR A 78 -4.705 17.260 6.939 1.00 0.00 C ATOM 250 C THR A 78 -6.209 17.047 7.050 1.00 0.00 C ATOM 251 O THR A 78 -6.763 16.899 8.144 1.00 0.00 O ATOM 252 CB THR A 78 -4.380 18.722 6.714 1.00 0.00 C ATOM 253 OG1 THR A 78 -4.447 18.962 5.292 1.00 0.00 O ATOM 254 CG2 THR A 78 -2.986 19.051 7.220 1.00 0.00 C ATOM 0 H THR A 78 -3.873 17.109 5.056 1.00 0.00 H new ATOM 0 HA THR A 78 -4.270 16.915 7.877 1.00 0.00 H new ATOM 0 HB THR A 78 -5.087 19.349 7.256 1.00 0.00 H new ATOM 0 HG1 THR A 78 -4.243 19.903 5.109 1.00 0.00 H new ATOM 0 HG21 THR A 78 -2.776 20.107 7.047 1.00 0.00 H new ATOM 0 HG22 THR A 78 -2.927 18.839 8.288 1.00 0.00 H new ATOM 0 HG23 THR A 78 -2.253 18.444 6.689 1.00 0.00 H new ATOM 262 N GLU A 79 -6.847 16.978 5.918 1.00 0.00 N ATOM 263 CA GLU A 79 -8.261 16.759 5.842 1.00 0.00 C ATOM 264 C GLU A 79 -8.567 15.276 5.697 1.00 0.00 C ATOM 265 O GLU A 79 -9.270 14.843 4.782 1.00 0.00 O ATOM 266 CB GLU A 79 -8.907 17.634 4.764 1.00 0.00 C ATOM 267 CG GLU A 79 -8.238 17.586 3.406 1.00 0.00 C ATOM 268 CD GLU A 79 -8.792 18.630 2.476 1.00 0.00 C ATOM 269 OE1 GLU A 79 -8.337 19.798 2.540 1.00 0.00 O ATOM 270 OE2 GLU A 79 -9.693 18.320 1.670 1.00 0.00 O ATOM 0 H GLU A 79 -6.393 17.074 5.010 1.00 0.00 H new ATOM 0 HA GLU A 79 -8.718 17.074 6.780 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -9.948 17.331 4.649 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -8.912 18.667 5.112 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -7.165 17.736 3.524 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -8.376 16.598 2.967 1.00 0.00 H new ATOM 277 N ALA A 80 -8.022 14.506 6.639 1.00 0.00 N ATOM 278 CA ALA A 80 -8.130 13.042 6.686 1.00 0.00 C ATOM 279 C ALA A 80 -9.587 12.547 6.694 1.00 0.00 C ATOM 280 O ALA A 80 -9.863 11.388 6.379 1.00 0.00 O ATOM 281 CB ALA A 80 -7.387 12.507 7.901 1.00 0.00 C ATOM 0 H ALA A 80 -7.478 14.890 7.412 1.00 0.00 H new ATOM 0 HA ALA A 80 -7.675 12.659 5.773 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -7.471 11.421 7.930 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -6.336 12.788 7.837 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -7.821 12.929 8.808 1.00 0.00 H new ATOM 287 N ASP A 81 -10.504 13.430 7.033 1.00 0.00 N ATOM 288 CA ASP A 81 -11.936 13.115 7.084 1.00 0.00 C ATOM 289 C ASP A 81 -12.479 12.964 5.669 1.00 0.00 C ATOM 290 O ASP A 81 -13.422 12.224 5.421 1.00 0.00 O ATOM 291 CB ASP A 81 -12.706 14.252 7.787 1.00 0.00 C ATOM 292 CG ASP A 81 -12.975 15.461 6.894 1.00 0.00 C ATOM 293 OD1 ASP A 81 -12.007 16.150 6.481 1.00 0.00 O ATOM 294 OD2 ASP A 81 -14.144 15.713 6.556 1.00 0.00 O ATOM 0 H ASP A 81 -10.286 14.394 7.284 1.00 0.00 H new ATOM 0 HA ASP A 81 -12.067 12.185 7.638 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -13.657 13.863 8.151 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -12.139 14.576 8.660 1.00 0.00 H new ATOM 299 N SER A 82 -11.839 13.640 4.749 1.00 0.00 N ATOM 300 CA SER A 82 -12.283 13.698 3.384 1.00 0.00 C ATOM 301 C SER A 82 -11.609 12.633 2.517 1.00 0.00 C ATOM 302 O SER A 82 -11.838 12.566 1.306 1.00 0.00 O ATOM 303 CB SER A 82 -12.024 15.095 2.846 1.00 0.00 C ATOM 304 OG SER A 82 -12.641 16.074 3.688 1.00 0.00 O ATOM 0 H SER A 82 -10.987 14.170 4.931 1.00 0.00 H new ATOM 0 HA SER A 82 -13.352 13.486 3.350 1.00 0.00 H new ATOM 0 HB2 SER A 82 -10.951 15.278 2.791 1.00 0.00 H new ATOM 0 HB3 SER A 82 -12.414 15.180 1.832 1.00 0.00 H new ATOM 0 HG SER A 82 -12.207 16.070 4.566 1.00 0.00 H new ATOM 310 N ILE A 83 -10.800 11.800 3.134 1.00 0.00 N ATOM 311 CA ILE A 83 -10.133 10.731 2.425 1.00 0.00 C ATOM 312 C ILE A 83 -11.134 9.589 2.244 1.00 0.00 C ATOM 313 O ILE A 83 -11.807 9.211 3.206 1.00 0.00 O ATOM 314 CB ILE A 83 -8.888 10.217 3.211 1.00 0.00 C ATOM 315 CG1 ILE A 83 -7.974 11.388 3.610 1.00 0.00 C ATOM 316 CG2 ILE A 83 -8.105 9.183 2.398 1.00 0.00 C ATOM 317 CD1 ILE A 83 -7.451 12.220 2.462 1.00 0.00 C ATOM 0 H ILE A 83 -10.588 11.843 4.131 1.00 0.00 H new ATOM 0 HA ILE A 83 -9.784 11.102 1.461 1.00 0.00 H new ATOM 0 HB ILE A 83 -9.247 9.731 4.118 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -8.523 12.040 4.289 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -7.125 10.991 4.166 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -7.243 8.844 2.973 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -8.749 8.332 2.174 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -7.764 9.635 1.466 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -6.818 13.018 2.850 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -6.869 11.589 1.791 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -8.289 12.654 1.916 1.00 0.00 H new ATOM 329 N PRO A 84 -11.307 9.085 1.012 1.00 0.00 N ATOM 330 CA PRO A 84 -12.231 7.979 0.723 1.00 0.00 C ATOM 331 C PRO A 84 -11.965 6.724 1.574 1.00 0.00 C ATOM 332 O PRO A 84 -10.836 6.212 1.652 1.00 0.00 O ATOM 333 CB PRO A 84 -11.967 7.676 -0.748 1.00 0.00 C ATOM 334 CG PRO A 84 -11.483 8.965 -1.302 1.00 0.00 C ATOM 335 CD PRO A 84 -10.660 9.584 -0.219 1.00 0.00 C ATOM 0 HA PRO A 84 -13.261 8.255 0.950 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -11.224 6.887 -0.865 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -12.872 7.339 -1.254 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -10.890 8.807 -2.203 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -12.317 9.611 -1.578 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -9.616 9.277 -0.280 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -10.676 10.673 -0.271 1.00 0.00 H new ATOM 343 N SER A 85 -13.012 6.216 2.160 1.00 0.00 N ATOM 344 CA SER A 85 -12.978 5.052 3.010 1.00 0.00 C ATOM 345 C SER A 85 -13.271 3.798 2.173 1.00 0.00 C ATOM 346 O SER A 85 -13.905 2.840 2.623 1.00 0.00 O ATOM 347 CB SER A 85 -14.034 5.271 4.078 1.00 0.00 C ATOM 348 OG SER A 85 -15.252 5.721 3.483 1.00 0.00 O ATOM 0 H SER A 85 -13.946 6.612 2.058 1.00 0.00 H new ATOM 0 HA SER A 85 -12.002 4.907 3.472 1.00 0.00 H new ATOM 0 HB2 SER A 85 -14.208 4.343 4.623 1.00 0.00 H new ATOM 0 HB3 SER A 85 -13.682 6.005 4.803 1.00 0.00 H new ATOM 0 HG SER A 85 -15.926 5.857 4.181 1.00 0.00 H new ATOM 354 N ALA A 86 -12.733 3.803 0.997 1.00 0.00 N ATOM 355 CA ALA A 86 -12.979 2.792 0.002 1.00 0.00 C ATOM 356 C ALA A 86 -11.745 1.936 -0.192 1.00 0.00 C ATOM 357 O ALA A 86 -10.698 2.199 0.421 1.00 0.00 O ATOM 358 CB ALA A 86 -13.369 3.459 -1.307 1.00 0.00 C ATOM 0 H ALA A 86 -12.089 4.530 0.686 1.00 0.00 H new ATOM 0 HA ALA A 86 -13.794 2.149 0.335 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -13.556 2.696 -2.063 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -14.272 4.052 -1.159 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -12.559 4.108 -1.640 1.00 0.00 H new ATOM 364 N SER A 87 -11.861 0.941 -1.046 1.00 0.00 N ATOM 365 CA SER A 87 -10.779 0.037 -1.313 1.00 0.00 C ATOM 366 C SER A 87 -10.014 0.534 -2.525 1.00 0.00 C ATOM 367 O SER A 87 -10.618 1.042 -3.494 1.00 0.00 O ATOM 368 CB SER A 87 -11.330 -1.391 -1.551 1.00 0.00 C ATOM 369 OG SER A 87 -10.292 -2.366 -1.629 1.00 0.00 O ATOM 0 H SER A 87 -12.712 0.742 -1.572 1.00 0.00 H new ATOM 0 HA SER A 87 -10.104 -0.003 -0.458 1.00 0.00 H new ATOM 0 HB2 SER A 87 -12.012 -1.654 -0.743 1.00 0.00 H new ATOM 0 HB3 SER A 87 -11.909 -1.405 -2.474 1.00 0.00 H new ATOM 0 HG SER A 87 -10.685 -3.251 -1.778 1.00 0.00 H new ATOM 375 N GLY A 88 -8.718 0.421 -2.474 1.00 0.00 N ATOM 376 CA GLY A 88 -7.919 0.856 -3.560 1.00 0.00 C ATOM 377 C GLY A 88 -6.480 0.959 -3.178 1.00 0.00 C ATOM 378 O GLY A 88 -6.023 0.310 -2.223 1.00 0.00 O ATOM 0 H GLY A 88 -8.201 0.030 -1.687 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -8.026 0.160 -4.392 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -8.274 1.826 -3.908 1.00 0.00 H new ATOM 382 N VAL A 89 -5.785 1.782 -3.879 1.00 0.00 N ATOM 383 CA VAL A 89 -4.383 1.985 -3.678 1.00 0.00 C ATOM 384 C VAL A 89 -4.151 3.458 -3.354 1.00 0.00 C ATOM 385 O VAL A 89 -4.929 4.314 -3.778 1.00 0.00 O ATOM 386 CB VAL A 89 -3.582 1.527 -4.950 1.00 0.00 C ATOM 387 CG1 VAL A 89 -4.074 2.222 -6.205 1.00 0.00 C ATOM 388 CG2 VAL A 89 -2.076 1.702 -4.784 1.00 0.00 C ATOM 0 H VAL A 89 -6.179 2.350 -4.629 1.00 0.00 H new ATOM 0 HA VAL A 89 -4.023 1.383 -2.844 1.00 0.00 H new ATOM 0 HB VAL A 89 -3.771 0.459 -5.062 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -3.495 1.878 -7.062 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -5.127 1.988 -6.361 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -3.954 3.300 -6.095 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -1.569 1.371 -5.690 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -1.849 2.753 -4.605 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -1.732 1.107 -3.938 1.00 0.00 H new ATOM 398 N TYR A 90 -3.151 3.749 -2.573 1.00 0.00 N ATOM 399 CA TYR A 90 -2.857 5.113 -2.223 1.00 0.00 C ATOM 400 C TYR A 90 -1.353 5.367 -2.275 1.00 0.00 C ATOM 401 O TYR A 90 -0.542 4.448 -2.053 1.00 0.00 O ATOM 402 CB TYR A 90 -3.435 5.466 -0.841 1.00 0.00 C ATOM 403 CG TYR A 90 -2.879 4.636 0.289 1.00 0.00 C ATOM 404 CD1 TYR A 90 -1.732 5.032 0.949 1.00 0.00 C ATOM 405 CD2 TYR A 90 -3.491 3.455 0.683 1.00 0.00 C ATOM 406 CE1 TYR A 90 -1.207 4.287 1.958 1.00 0.00 C ATOM 407 CE2 TYR A 90 -2.964 2.695 1.702 1.00 0.00 C ATOM 408 CZ TYR A 90 -1.821 3.117 2.334 1.00 0.00 C ATOM 409 OH TYR A 90 -1.282 2.371 3.354 1.00 0.00 O ATOM 0 H TYR A 90 -2.522 3.058 -2.164 1.00 0.00 H new ATOM 0 HA TYR A 90 -3.335 5.764 -2.955 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -3.239 6.518 -0.635 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -4.518 5.343 -0.870 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -1.243 5.950 0.658 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -4.391 3.128 0.184 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -0.310 4.614 2.462 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -3.445 1.776 2.001 1.00 0.00 H new ATOM 0 HH TYR A 90 -1.344 1.419 3.131 1.00 0.00 H new ATOM 419 N ALA A 91 -0.999 6.580 -2.590 1.00 0.00 N ATOM 420 CA ALA A 91 0.370 7.005 -2.686 1.00 0.00 C ATOM 421 C ALA A 91 0.614 8.155 -1.745 1.00 0.00 C ATOM 422 O ALA A 91 -0.011 9.214 -1.871 1.00 0.00 O ATOM 423 CB ALA A 91 0.672 7.437 -4.099 1.00 0.00 C ATOM 0 H ALA A 91 -1.671 7.320 -2.792 1.00 0.00 H new ATOM 0 HA ALA A 91 1.021 6.174 -2.416 1.00 0.00 H new ATOM 0 HB1 ALA A 91 1.711 7.758 -4.167 1.00 0.00 H new ATOM 0 HB2 ALA A 91 0.506 6.601 -4.778 1.00 0.00 H new ATOM 0 HB3 ALA A 91 0.018 8.264 -4.374 1.00 0.00 H new ATOM 429 N VAL A 92 1.496 7.954 -0.815 1.00 0.00 N ATOM 430 CA VAL A 92 1.820 8.953 0.158 1.00 0.00 C ATOM 431 C VAL A 92 2.992 9.802 -0.323 1.00 0.00 C ATOM 432 O VAL A 92 4.105 9.277 -0.607 1.00 0.00 O ATOM 433 CB VAL A 92 2.158 8.327 1.534 1.00 0.00 C ATOM 434 CG1 VAL A 92 2.480 9.401 2.557 1.00 0.00 C ATOM 435 CG2 VAL A 92 1.012 7.459 2.027 1.00 0.00 C ATOM 0 H VAL A 92 2.017 7.083 -0.708 1.00 0.00 H new ATOM 0 HA VAL A 92 0.940 9.584 0.282 1.00 0.00 H new ATOM 0 HB VAL A 92 3.040 7.700 1.406 1.00 0.00 H new ATOM 0 HG11 VAL A 92 2.714 8.934 3.514 1.00 0.00 H new ATOM 0 HG12 VAL A 92 3.338 9.981 2.218 1.00 0.00 H new ATOM 0 HG13 VAL A 92 1.620 10.060 2.675 1.00 0.00 H new ATOM 0 HG21 VAL A 92 1.271 7.030 2.995 1.00 0.00 H new ATOM 0 HG22 VAL A 92 0.113 8.067 2.129 1.00 0.00 H new ATOM 0 HG23 VAL A 92 0.829 6.657 1.312 1.00 0.00 H new ATOM 445 N TYR A 93 2.724 11.085 -0.423 1.00 0.00 N ATOM 446 CA TYR A 93 3.673 12.089 -0.815 1.00 0.00 C ATOM 447 C TYR A 93 4.035 12.937 0.375 1.00 0.00 C ATOM 448 O TYR A 93 3.151 13.445 1.075 1.00 0.00 O ATOM 449 CB TYR A 93 3.090 12.990 -1.907 1.00 0.00 C ATOM 450 CG TYR A 93 3.030 12.358 -3.261 1.00 0.00 C ATOM 451 CD1 TYR A 93 1.944 11.601 -3.676 1.00 0.00 C ATOM 452 CD2 TYR A 93 4.080 12.520 -4.126 1.00 0.00 C ATOM 453 CE1 TYR A 93 1.934 11.024 -4.935 1.00 0.00 C ATOM 454 CE2 TYR A 93 4.077 11.960 -5.363 1.00 0.00 C ATOM 455 CZ TYR A 93 3.016 11.216 -5.772 1.00 0.00 C ATOM 456 OH TYR A 93 3.044 10.654 -7.025 1.00 0.00 O ATOM 0 H TYR A 93 1.799 11.467 -0.224 1.00 0.00 H new ATOM 0 HA TYR A 93 4.560 11.588 -1.203 1.00 0.00 H new ATOM 0 HB2 TYR A 93 2.084 13.291 -1.615 1.00 0.00 H new ATOM 0 HB3 TYR A 93 3.689 13.899 -1.970 1.00 0.00 H new ATOM 0 HD1 TYR A 93 1.102 11.461 -3.014 1.00 0.00 H new ATOM 0 HD2 TYR A 93 4.931 13.108 -3.816 1.00 0.00 H new ATOM 0 HE1 TYR A 93 1.091 10.431 -5.258 1.00 0.00 H new ATOM 0 HE2 TYR A 93 4.919 12.106 -6.023 1.00 0.00 H new ATOM 0 HH TYR A 93 3.958 10.687 -7.378 1.00 0.00 H new ATOM 466 N ASP A 94 5.308 13.113 0.600 1.00 0.00 N ATOM 467 CA ASP A 94 5.764 13.918 1.720 1.00 0.00 C ATOM 468 C ASP A 94 5.608 15.406 1.401 1.00 0.00 C ATOM 469 O ASP A 94 5.084 15.787 0.337 1.00 0.00 O ATOM 470 CB ASP A 94 7.232 13.619 2.080 1.00 0.00 C ATOM 471 CG ASP A 94 8.222 14.190 1.089 1.00 0.00 C ATOM 472 OD1 ASP A 94 8.461 13.572 0.055 1.00 0.00 O ATOM 473 OD2 ASP A 94 8.779 15.279 1.358 1.00 0.00 O ATOM 0 H ASP A 94 6.053 12.714 0.029 1.00 0.00 H new ATOM 0 HA ASP A 94 5.145 13.659 2.579 1.00 0.00 H new ATOM 0 HB2 ASP A 94 7.445 14.024 3.069 1.00 0.00 H new ATOM 0 HB3 ASP A 94 7.371 12.540 2.140 1.00 0.00 H new ATOM 478 N LYS A 95 6.085 16.228 2.308 1.00 0.00 N ATOM 479 CA LYS A 95 6.015 17.681 2.213 1.00 0.00 C ATOM 480 C LYS A 95 6.684 18.248 0.946 1.00 0.00 C ATOM 481 O LYS A 95 6.289 19.299 0.457 1.00 0.00 O ATOM 482 CB LYS A 95 6.608 18.363 3.470 1.00 0.00 C ATOM 483 CG LYS A 95 7.973 17.824 3.947 1.00 0.00 C ATOM 484 CD LYS A 95 7.853 16.758 5.052 1.00 0.00 C ATOM 485 CE LYS A 95 7.343 17.349 6.365 1.00 0.00 C ATOM 486 NZ LYS A 95 7.165 16.315 7.413 1.00 0.00 N ATOM 0 H LYS A 95 6.546 15.902 3.158 1.00 0.00 H new ATOM 0 HA LYS A 95 4.952 17.912 2.146 1.00 0.00 H new ATOM 0 HB2 LYS A 95 6.711 19.429 3.267 1.00 0.00 H new ATOM 0 HB3 LYS A 95 5.893 18.261 4.287 1.00 0.00 H new ATOM 0 HG2 LYS A 95 8.505 17.398 3.097 1.00 0.00 H new ATOM 0 HG3 LYS A 95 8.575 18.654 4.316 1.00 0.00 H new ATOM 0 HD2 LYS A 95 7.177 15.969 4.723 1.00 0.00 H new ATOM 0 HD3 LYS A 95 8.826 16.295 5.217 1.00 0.00 H new ATOM 0 HE2 LYS A 95 8.045 18.105 6.718 1.00 0.00 H new ATOM 0 HE3 LYS A 95 6.393 17.853 6.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 6.575 16.696 8.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 6.701 15.480 7.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 8.094 16.043 7.794 1.00 0.00 H new ATOM 500 N SER A 96 7.673 17.550 0.428 1.00 0.00 N ATOM 501 CA SER A 96 8.412 17.995 -0.755 1.00 0.00 C ATOM 502 C SER A 96 7.793 17.439 -2.048 1.00 0.00 C ATOM 503 O SER A 96 8.316 17.664 -3.151 1.00 0.00 O ATOM 504 CB SER A 96 9.859 17.528 -0.632 1.00 0.00 C ATOM 505 OG SER A 96 10.386 17.875 0.653 1.00 0.00 O ATOM 0 H SER A 96 7.994 16.659 0.807 1.00 0.00 H new ATOM 0 HA SER A 96 8.366 19.083 -0.808 1.00 0.00 H new ATOM 0 HB2 SER A 96 9.913 16.449 -0.775 1.00 0.00 H new ATOM 0 HB3 SER A 96 10.463 17.985 -1.416 1.00 0.00 H new ATOM 0 HG SER A 96 10.075 17.228 1.320 1.00 0.00 H new ATOM 511 N ASP A 97 6.684 16.731 -1.888 1.00 0.00 N ATOM 512 CA ASP A 97 5.963 16.082 -2.984 1.00 0.00 C ATOM 513 C ASP A 97 6.814 15.028 -3.665 1.00 0.00 C ATOM 514 O ASP A 97 7.336 15.203 -4.777 1.00 0.00 O ATOM 515 CB ASP A 97 5.320 17.067 -3.989 1.00 0.00 C ATOM 516 CG ASP A 97 4.583 16.367 -5.130 1.00 0.00 C ATOM 517 OD1 ASP A 97 3.507 15.778 -4.896 1.00 0.00 O ATOM 518 OD2 ASP A 97 5.055 16.429 -6.287 1.00 0.00 O ATOM 0 H ASP A 97 6.248 16.586 -0.977 1.00 0.00 H new ATOM 0 HA ASP A 97 5.118 15.572 -2.521 1.00 0.00 H new ATOM 0 HB2 ASP A 97 4.622 17.714 -3.458 1.00 0.00 H new ATOM 0 HB3 ASP A 97 6.096 17.709 -4.406 1.00 0.00 H new ATOM 523 N GLU A 98 7.063 14.000 -2.916 1.00 0.00 N ATOM 524 CA GLU A 98 7.735 12.844 -3.381 1.00 0.00 C ATOM 525 C GLU A 98 7.059 11.638 -2.878 1.00 0.00 C ATOM 526 O GLU A 98 6.516 11.626 -1.766 1.00 0.00 O ATOM 527 CB GLU A 98 9.201 12.816 -3.012 1.00 0.00 C ATOM 528 CG GLU A 98 10.094 13.357 -4.093 1.00 0.00 C ATOM 529 CD GLU A 98 9.975 12.566 -5.395 1.00 0.00 C ATOM 530 OE1 GLU A 98 9.433 11.416 -5.395 1.00 0.00 O ATOM 531 OE2 GLU A 98 10.452 13.062 -6.426 1.00 0.00 O ATOM 0 H GLU A 98 6.792 13.948 -1.934 1.00 0.00 H new ATOM 0 HA GLU A 98 7.693 12.870 -4.470 1.00 0.00 H new ATOM 0 HB2 GLU A 98 9.351 13.396 -2.102 1.00 0.00 H new ATOM 0 HB3 GLU A 98 9.493 11.790 -2.788 1.00 0.00 H new ATOM 0 HG2 GLU A 98 9.842 14.401 -4.281 1.00 0.00 H new ATOM 0 HG3 GLU A 98 11.129 13.335 -3.751 1.00 0.00 H new ATOM 538 N LEU A 99 7.075 10.636 -3.684 1.00 0.00 N ATOM 539 CA LEU A 99 6.427 9.424 -3.367 1.00 0.00 C ATOM 540 C LEU A 99 7.393 8.552 -2.649 1.00 0.00 C ATOM 541 O LEU A 99 8.443 8.190 -3.181 1.00 0.00 O ATOM 542 CB LEU A 99 5.846 8.770 -4.640 1.00 0.00 C ATOM 543 CG LEU A 99 5.109 7.420 -4.521 1.00 0.00 C ATOM 544 CD1 LEU A 99 6.090 6.246 -4.397 1.00 0.00 C ATOM 545 CD2 LEU A 99 4.161 7.461 -3.338 1.00 0.00 C ATOM 0 H LEU A 99 7.544 10.640 -4.590 1.00 0.00 H new ATOM 0 HA LEU A 99 5.575 9.599 -2.710 1.00 0.00 H new ATOM 0 HB2 LEU A 99 5.155 9.483 -5.089 1.00 0.00 H new ATOM 0 HB3 LEU A 99 6.667 8.635 -5.344 1.00 0.00 H new ATOM 0 HG LEU A 99 4.536 7.260 -5.434 1.00 0.00 H new ATOM 0 HD11 LEU A 99 5.532 5.313 -4.315 1.00 0.00 H new ATOM 0 HD12 LEU A 99 6.729 6.211 -5.279 1.00 0.00 H new ATOM 0 HD13 LEU A 99 6.706 6.379 -3.508 1.00 0.00 H new ATOM 0 HD21 LEU A 99 3.641 6.507 -3.255 1.00 0.00 H new ATOM 0 HD22 LEU A 99 4.727 7.647 -2.425 1.00 0.00 H new ATOM 0 HD23 LEU A 99 3.433 8.259 -3.483 1.00 0.00 H new ATOM 557 N GLN A 100 7.063 8.269 -1.440 1.00 0.00 N ATOM 558 CA GLN A 100 7.875 7.447 -0.614 1.00 0.00 C ATOM 559 C GLN A 100 7.122 6.233 -0.091 1.00 0.00 C ATOM 560 O GLN A 100 7.735 5.287 0.402 1.00 0.00 O ATOM 561 CB GLN A 100 8.535 8.272 0.494 1.00 0.00 C ATOM 562 CG GLN A 100 9.605 9.215 -0.052 1.00 0.00 C ATOM 563 CD GLN A 100 10.266 10.059 1.002 1.00 0.00 C ATOM 564 OE1 GLN A 100 11.259 9.653 1.600 1.00 0.00 O ATOM 565 NE2 GLN A 100 9.774 11.243 1.202 1.00 0.00 N ATOM 0 H GLN A 100 6.212 8.605 -0.990 1.00 0.00 H new ATOM 0 HA GLN A 100 8.679 7.043 -1.229 1.00 0.00 H new ATOM 0 HB2 GLN A 100 7.774 8.852 1.016 1.00 0.00 H new ATOM 0 HB3 GLN A 100 8.983 7.601 1.227 1.00 0.00 H new ATOM 0 HG2 GLN A 100 10.367 8.627 -0.564 1.00 0.00 H new ATOM 0 HG3 GLN A 100 9.153 9.869 -0.797 1.00 0.00 H new ATOM 0 HE21 GLN A 100 8.948 11.546 0.686 1.00 0.00 H new ATOM 0 HE22 GLN A 100 10.214 11.871 1.875 1.00 0.00 H new ATOM 574 N PHE A 101 5.795 6.232 -0.197 1.00 0.00 N ATOM 575 CA PHE A 101 5.056 5.064 0.242 1.00 0.00 C ATOM 576 C PHE A 101 3.781 4.835 -0.561 1.00 0.00 C ATOM 577 O PHE A 101 2.875 5.652 -0.541 1.00 0.00 O ATOM 578 CB PHE A 101 4.743 5.141 1.754 1.00 0.00 C ATOM 579 CG PHE A 101 3.990 3.946 2.285 1.00 0.00 C ATOM 580 CD1 PHE A 101 4.627 2.731 2.449 1.00 0.00 C ATOM 581 CD2 PHE A 101 2.649 4.041 2.620 1.00 0.00 C ATOM 582 CE1 PHE A 101 3.942 1.634 2.932 1.00 0.00 C ATOM 583 CE2 PHE A 101 1.963 2.947 3.103 1.00 0.00 C ATOM 584 CZ PHE A 101 2.610 1.742 3.258 1.00 0.00 C ATOM 0 H PHE A 101 5.232 6.997 -0.569 1.00 0.00 H new ATOM 0 HA PHE A 101 5.701 4.205 0.061 1.00 0.00 H new ATOM 0 HB2 PHE A 101 5.679 5.242 2.304 1.00 0.00 H new ATOM 0 HB3 PHE A 101 4.160 6.041 1.949 1.00 0.00 H new ATOM 0 HD1 PHE A 101 5.673 2.638 2.196 1.00 0.00 H new ATOM 0 HD2 PHE A 101 2.135 4.983 2.501 1.00 0.00 H new ATOM 0 HE1 PHE A 101 4.452 0.690 3.054 1.00 0.00 H new ATOM 0 HE2 PHE A 101 0.918 3.035 3.360 1.00 0.00 H new ATOM 0 HZ PHE A 101 2.073 0.884 3.635 1.00 0.00 H new ATOM 594 N VAL A 102 3.738 3.741 -1.284 1.00 0.00 N ATOM 595 CA VAL A 102 2.517 3.303 -1.945 1.00 0.00 C ATOM 596 C VAL A 102 2.037 2.048 -1.267 1.00 0.00 C ATOM 597 O VAL A 102 2.859 1.211 -0.849 1.00 0.00 O ATOM 598 CB VAL A 102 2.655 3.029 -3.482 1.00 0.00 C ATOM 599 CG1 VAL A 102 2.812 4.304 -4.258 1.00 0.00 C ATOM 600 CG2 VAL A 102 3.821 2.109 -3.783 1.00 0.00 C ATOM 0 H VAL A 102 4.539 3.128 -1.434 1.00 0.00 H new ATOM 0 HA VAL A 102 1.809 4.127 -1.856 1.00 0.00 H new ATOM 0 HB VAL A 102 1.732 2.539 -3.793 1.00 0.00 H new ATOM 0 HG11 VAL A 102 2.905 4.075 -5.320 1.00 0.00 H new ATOM 0 HG12 VAL A 102 1.939 4.937 -4.098 1.00 0.00 H new ATOM 0 HG13 VAL A 102 3.706 4.828 -3.920 1.00 0.00 H new ATOM 0 HG21 VAL A 102 3.885 1.942 -4.858 1.00 0.00 H new ATOM 0 HG22 VAL A 102 4.746 2.567 -3.431 1.00 0.00 H new ATOM 0 HG23 VAL A 102 3.672 1.156 -3.276 1.00 0.00 H new ATOM 610 N GLY A 103 0.755 1.916 -1.129 1.00 0.00 N ATOM 611 CA GLY A 103 0.212 0.763 -0.494 1.00 0.00 C ATOM 612 C GLY A 103 -1.199 0.529 -0.915 1.00 0.00 C ATOM 613 O GLY A 103 -1.859 1.443 -1.418 1.00 0.00 O ATOM 0 H GLY A 103 0.066 2.596 -1.449 1.00 0.00 H new ATOM 0 HA2 GLY A 103 0.817 -0.110 -0.740 1.00 0.00 H new ATOM 0 HA3 GLY A 103 0.256 0.886 0.588 1.00 0.00 H new ATOM 617 N ILE A 104 -1.655 -0.675 -0.738 1.00 0.00 N ATOM 618 CA ILE A 104 -3.009 -1.049 -1.066 1.00 0.00 C ATOM 619 C ILE A 104 -3.747 -1.426 0.201 1.00 0.00 C ATOM 620 O ILE A 104 -3.164 -2.035 1.111 1.00 0.00 O ATOM 621 CB ILE A 104 -3.070 -2.209 -2.108 1.00 0.00 C ATOM 622 CG1 ILE A 104 -2.189 -3.401 -1.678 1.00 0.00 C ATOM 623 CG2 ILE A 104 -2.664 -1.703 -3.478 1.00 0.00 C ATOM 624 CD1 ILE A 104 -2.223 -4.582 -2.637 1.00 0.00 C ATOM 0 H ILE A 104 -1.095 -1.438 -0.358 1.00 0.00 H new ATOM 0 HA ILE A 104 -3.492 -0.190 -1.531 1.00 0.00 H new ATOM 0 HB ILE A 104 -4.099 -2.566 -2.158 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -1.159 -3.059 -1.578 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -2.510 -3.739 -0.693 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -2.710 -2.521 -4.197 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -3.343 -0.909 -3.788 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -1.646 -1.315 -3.436 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -1.577 -5.375 -2.260 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -3.244 -4.954 -2.720 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -1.872 -4.264 -3.619 1.00 0.00 H new ATOM 636 N SER A 105 -4.985 -1.027 0.301 1.00 0.00 N ATOM 637 CA SER A 105 -5.782 -1.291 1.478 1.00 0.00 C ATOM 638 C SER A 105 -7.259 -1.389 1.093 1.00 0.00 C ATOM 639 O SER A 105 -7.667 -0.874 0.040 1.00 0.00 O ATOM 640 CB SER A 105 -5.572 -0.164 2.517 1.00 0.00 C ATOM 641 OG SER A 105 -4.202 -0.069 2.913 1.00 0.00 O ATOM 0 H SER A 105 -5.474 -0.509 -0.429 1.00 0.00 H new ATOM 0 HA SER A 105 -5.470 -2.238 1.919 1.00 0.00 H new ATOM 0 HB2 SER A 105 -5.897 0.787 2.095 1.00 0.00 H new ATOM 0 HB3 SER A 105 -6.193 -0.354 3.392 1.00 0.00 H new ATOM 0 HG SER A 105 -4.108 -0.372 3.840 1.00 0.00 H new ATOM 647 N ARG A 106 -8.053 -2.059 1.929 1.00 0.00 N ATOM 648 CA ARG A 106 -9.485 -2.176 1.690 1.00 0.00 C ATOM 649 C ARG A 106 -10.128 -0.869 2.138 1.00 0.00 C ATOM 650 O ARG A 106 -11.208 -0.506 1.706 1.00 0.00 O ATOM 651 CB ARG A 106 -10.082 -3.401 2.448 1.00 0.00 C ATOM 652 CG ARG A 106 -11.371 -4.001 1.824 1.00 0.00 C ATOM 653 CD ARG A 106 -12.598 -3.094 1.919 1.00 0.00 C ATOM 654 NE ARG A 106 -13.691 -3.551 1.042 1.00 0.00 N ATOM 655 CZ ARG A 106 -14.782 -2.836 0.718 1.00 0.00 C ATOM 656 NH1 ARG A 106 -15.013 -1.663 1.293 1.00 0.00 N ATOM 657 NH2 ARG A 106 -15.650 -3.315 -0.164 1.00 0.00 N ATOM 0 H ARG A 106 -7.726 -2.527 2.775 1.00 0.00 H new ATOM 0 HA ARG A 106 -9.685 -2.347 0.632 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -9.324 -4.182 2.497 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -10.299 -3.103 3.474 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -11.181 -4.227 0.775 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -11.594 -4.947 2.318 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -12.949 -3.065 2.951 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -12.318 -2.076 1.649 1.00 0.00 H new ATOM 0 HE ARG A 106 -13.613 -4.489 0.648 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -14.360 -1.298 1.986 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -15.843 -1.126 1.042 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -15.489 -4.225 -0.595 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -16.478 -2.773 -0.410 1.00 0.00 H new ATOM 671 N ASN A 107 -9.465 -0.172 3.014 1.00 0.00 N ATOM 672 CA ASN A 107 -9.911 1.136 3.395 1.00 0.00 C ATOM 673 C ASN A 107 -8.741 2.061 3.428 1.00 0.00 C ATOM 674 O ASN A 107 -7.880 1.974 4.316 1.00 0.00 O ATOM 675 CB ASN A 107 -10.695 1.132 4.713 1.00 0.00 C ATOM 676 CG ASN A 107 -11.276 2.506 5.092 1.00 0.00 C ATOM 677 OD1 ASN A 107 -10.665 3.554 4.899 1.00 0.00 O ATOM 678 ND2 ASN A 107 -12.484 2.510 5.528 1.00 0.00 N ATOM 0 H ASN A 107 -8.613 -0.488 3.478 1.00 0.00 H new ATOM 0 HA ASN A 107 -10.620 1.494 2.648 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -11.509 0.411 4.639 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -10.039 0.791 5.514 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -12.954 3.395 5.721 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -12.974 1.629 5.682 1.00 0.00 H new ATOM 685 N ILE A 108 -8.684 2.896 2.420 1.00 0.00 N ATOM 686 CA ILE A 108 -7.638 3.872 2.251 1.00 0.00 C ATOM 687 C ILE A 108 -7.590 4.849 3.430 1.00 0.00 C ATOM 688 O ILE A 108 -6.566 4.946 4.101 1.00 0.00 O ATOM 689 CB ILE A 108 -7.817 4.647 0.916 1.00 0.00 C ATOM 690 CG1 ILE A 108 -7.753 3.674 -0.276 1.00 0.00 C ATOM 691 CG2 ILE A 108 -6.763 5.739 0.780 1.00 0.00 C ATOM 692 CD1 ILE A 108 -7.970 4.328 -1.627 1.00 0.00 C ATOM 0 H ILE A 108 -9.382 2.915 1.676 1.00 0.00 H new ATOM 0 HA ILE A 108 -6.690 3.335 2.218 1.00 0.00 H new ATOM 0 HB ILE A 108 -8.797 5.125 0.921 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -6.781 3.181 -0.276 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -8.505 2.897 -0.137 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -6.907 6.269 -0.162 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -6.857 6.441 1.609 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -5.770 5.290 0.795 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -7.909 3.573 -2.411 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -8.954 4.797 -1.651 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -7.203 5.085 -1.792 1.00 0.00 H new ATOM 704 N ALA A 109 -8.714 5.523 3.692 1.00 0.00 N ATOM 705 CA ALA A 109 -8.826 6.538 4.753 1.00 0.00 C ATOM 706 C ALA A 109 -8.304 6.053 6.082 1.00 0.00 C ATOM 707 O ALA A 109 -7.474 6.725 6.703 1.00 0.00 O ATOM 708 CB ALA A 109 -10.263 6.992 4.910 1.00 0.00 C ATOM 0 H ALA A 109 -9.580 5.381 3.172 1.00 0.00 H new ATOM 0 HA ALA A 109 -8.205 7.378 4.441 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -10.324 7.742 5.699 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -10.613 7.423 3.972 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -10.888 6.138 5.172 1.00 0.00 H new ATOM 714 N ALA A 110 -8.765 4.892 6.499 1.00 0.00 N ATOM 715 CA ALA A 110 -8.378 4.309 7.773 1.00 0.00 C ATOM 716 C ALA A 110 -6.873 4.097 7.844 1.00 0.00 C ATOM 717 O ALA A 110 -6.213 4.585 8.766 1.00 0.00 O ATOM 718 CB ALA A 110 -9.106 2.995 7.989 1.00 0.00 C ATOM 0 H ALA A 110 -9.421 4.322 5.964 1.00 0.00 H new ATOM 0 HA ALA A 110 -8.658 5.004 8.564 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -8.808 2.567 8.946 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -10.182 3.171 7.989 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -8.851 2.302 7.187 1.00 0.00 H new ATOM 724 N SER A 111 -6.336 3.429 6.835 1.00 0.00 N ATOM 725 CA SER A 111 -4.926 3.116 6.772 1.00 0.00 C ATOM 726 C SER A 111 -4.091 4.412 6.750 1.00 0.00 C ATOM 727 O SER A 111 -3.142 4.579 7.552 1.00 0.00 O ATOM 728 CB SER A 111 -4.651 2.253 5.527 1.00 0.00 C ATOM 729 OG SER A 111 -3.305 1.818 5.465 1.00 0.00 O ATOM 0 H SER A 111 -6.872 3.090 6.036 1.00 0.00 H new ATOM 0 HA SER A 111 -4.636 2.551 7.658 1.00 0.00 H new ATOM 0 HB2 SER A 111 -5.311 1.386 5.535 1.00 0.00 H new ATOM 0 HB3 SER A 111 -4.888 2.826 4.630 1.00 0.00 H new ATOM 0 HG SER A 111 -2.883 2.173 4.655 1.00 0.00 H new ATOM 735 N VAL A 112 -4.478 5.341 5.876 1.00 0.00 N ATOM 736 CA VAL A 112 -3.802 6.621 5.725 1.00 0.00 C ATOM 737 C VAL A 112 -3.760 7.381 7.051 1.00 0.00 C ATOM 738 O VAL A 112 -2.670 7.712 7.542 1.00 0.00 O ATOM 739 CB VAL A 112 -4.464 7.487 4.600 1.00 0.00 C ATOM 740 CG1 VAL A 112 -3.922 8.908 4.582 1.00 0.00 C ATOM 741 CG2 VAL A 112 -4.222 6.848 3.245 1.00 0.00 C ATOM 0 H VAL A 112 -5.275 5.222 5.251 1.00 0.00 H new ATOM 0 HA VAL A 112 -2.775 6.417 5.423 1.00 0.00 H new ATOM 0 HB VAL A 112 -5.532 7.532 4.812 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -4.408 9.473 3.787 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -4.122 9.386 5.541 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -2.847 8.885 4.405 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -4.685 7.456 2.468 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -3.150 6.780 3.061 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -4.657 5.849 3.231 1.00 0.00 H new ATOM 751 N SER A 113 -4.921 7.574 7.651 1.00 0.00 N ATOM 752 CA SER A 113 -5.043 8.313 8.901 1.00 0.00 C ATOM 753 C SER A 113 -4.244 7.635 10.040 1.00 0.00 C ATOM 754 O SER A 113 -3.642 8.311 10.888 1.00 0.00 O ATOM 755 CB SER A 113 -6.522 8.435 9.270 1.00 0.00 C ATOM 756 OG SER A 113 -7.272 8.943 8.163 1.00 0.00 O ATOM 0 H SER A 113 -5.808 7.224 7.288 1.00 0.00 H new ATOM 0 HA SER A 113 -4.621 9.308 8.764 1.00 0.00 H new ATOM 0 HB2 SER A 113 -6.911 7.460 9.565 1.00 0.00 H new ATOM 0 HB3 SER A 113 -6.636 9.097 10.129 1.00 0.00 H new ATOM 0 HG SER A 113 -7.581 8.197 7.607 1.00 0.00 H new ATOM 762 N ALA A 114 -4.213 6.310 10.028 1.00 0.00 N ATOM 763 CA ALA A 114 -3.497 5.551 11.034 1.00 0.00 C ATOM 764 C ALA A 114 -1.978 5.760 10.934 1.00 0.00 C ATOM 765 O ALA A 114 -1.345 6.265 11.873 1.00 0.00 O ATOM 766 CB ALA A 114 -3.848 4.071 10.940 1.00 0.00 C ATOM 0 H ALA A 114 -4.681 5.738 9.325 1.00 0.00 H new ATOM 0 HA ALA A 114 -3.811 5.921 12.010 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -3.301 3.518 11.703 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -4.919 3.940 11.095 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -3.576 3.694 9.954 1.00 0.00 H new ATOM 772 N HIS A 115 -1.393 5.435 9.781 1.00 0.00 N ATOM 773 CA HIS A 115 0.069 5.523 9.658 1.00 0.00 C ATOM 774 C HIS A 115 0.613 6.933 9.536 1.00 0.00 C ATOM 775 O HIS A 115 1.757 7.171 9.894 1.00 0.00 O ATOM 776 CB HIS A 115 0.718 4.562 8.619 1.00 0.00 C ATOM 777 CG HIS A 115 0.203 4.608 7.220 1.00 0.00 C ATOM 778 ND1 HIS A 115 0.421 5.658 6.349 1.00 0.00 N ATOM 779 CD2 HIS A 115 -0.503 3.692 6.530 1.00 0.00 C ATOM 780 CE1 HIS A 115 -0.137 5.372 5.190 1.00 0.00 C ATOM 781 NE2 HIS A 115 -0.699 4.188 5.281 1.00 0.00 N ATOM 0 H HIS A 115 -1.884 5.119 8.945 1.00 0.00 H new ATOM 0 HA HIS A 115 0.390 5.152 10.631 1.00 0.00 H new ATOM 0 HB2 HIS A 115 1.787 4.771 8.590 1.00 0.00 H new ATOM 0 HB3 HIS A 115 0.602 3.542 8.986 1.00 0.00 H new ATOM 0 HD2 HIS A 115 -0.849 2.739 6.901 1.00 0.00 H new ATOM 0 HE1 HIS A 115 -0.133 6.004 4.314 1.00 0.00 H new ATOM 0 HE2 HIS A 115 -1.204 3.715 4.531 1.00 0.00 H new ATOM 790 N LEU A 116 -0.183 7.874 9.061 1.00 0.00 N ATOM 791 CA LEU A 116 0.314 9.245 8.945 1.00 0.00 C ATOM 792 C LEU A 116 0.326 9.963 10.275 1.00 0.00 C ATOM 793 O LEU A 116 1.087 10.888 10.463 1.00 0.00 O ATOM 794 CB LEU A 116 -0.414 10.056 7.882 1.00 0.00 C ATOM 795 CG LEU A 116 -0.181 9.615 6.435 1.00 0.00 C ATOM 796 CD1 LEU A 116 -0.948 10.504 5.492 1.00 0.00 C ATOM 797 CD2 LEU A 116 1.302 9.647 6.090 1.00 0.00 C ATOM 0 H LEU A 116 -1.146 7.729 8.757 1.00 0.00 H new ATOM 0 HA LEU A 116 1.348 9.155 8.612 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -1.484 10.013 8.088 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -0.113 11.099 7.977 1.00 0.00 H new ATOM 0 HG LEU A 116 -0.537 8.590 6.329 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -0.775 10.181 4.465 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -2.013 10.441 5.717 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -0.613 11.534 5.610 1.00 0.00 H new ATOM 0 HD21 LEU A 116 1.442 9.330 5.057 1.00 0.00 H new ATOM 0 HD22 LEU A 116 1.682 10.661 6.213 1.00 0.00 H new ATOM 0 HD23 LEU A 116 1.844 8.973 6.753 1.00 0.00 H new ATOM 809 N LYS A 117 -0.512 9.539 11.194 1.00 0.00 N ATOM 810 CA LYS A 117 -0.479 10.113 12.525 1.00 0.00 C ATOM 811 C LYS A 117 0.547 9.416 13.386 1.00 0.00 C ATOM 812 O LYS A 117 0.945 9.929 14.436 1.00 0.00 O ATOM 813 CB LYS A 117 -1.855 10.099 13.187 1.00 0.00 C ATOM 814 CG LYS A 117 -2.851 11.061 12.567 1.00 0.00 C ATOM 815 CD LYS A 117 -2.330 12.475 12.654 1.00 0.00 C ATOM 816 CE LYS A 117 -3.315 13.483 12.129 1.00 0.00 C ATOM 817 NZ LYS A 117 -2.759 14.843 12.206 1.00 0.00 N ATOM 0 H LYS A 117 -1.214 8.812 11.052 1.00 0.00 H new ATOM 0 HA LYS A 117 -0.185 11.157 12.422 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -2.261 9.089 13.135 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -1.741 10.342 14.243 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -3.027 10.793 11.525 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -3.809 10.986 13.081 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -2.094 12.709 13.692 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -1.400 12.552 12.090 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -3.569 13.247 11.096 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -4.239 13.430 12.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -3.454 15.524 11.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -2.539 15.073 13.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -1.890 14.895 11.637 1.00 0.00 H new ATOM 831 N SER A 118 0.962 8.249 12.946 1.00 0.00 N ATOM 832 CA SER A 118 1.962 7.501 13.635 1.00 0.00 C ATOM 833 C SER A 118 3.340 8.068 13.267 1.00 0.00 C ATOM 834 O SER A 118 4.151 8.394 14.148 1.00 0.00 O ATOM 835 CB SER A 118 1.854 6.028 13.253 1.00 0.00 C ATOM 836 OG SER A 118 2.523 5.202 14.190 1.00 0.00 O ATOM 0 H SER A 118 0.609 7.801 12.100 1.00 0.00 H new ATOM 0 HA SER A 118 1.823 7.580 14.713 1.00 0.00 H new ATOM 0 HB2 SER A 118 0.804 5.741 13.197 1.00 0.00 H new ATOM 0 HB3 SER A 118 2.280 5.875 12.261 1.00 0.00 H new ATOM 0 HG SER A 118 2.435 4.264 13.920 1.00 0.00 H new ATOM 842 N VAL A 119 3.581 8.213 11.970 1.00 0.00 N ATOM 843 CA VAL A 119 4.811 8.784 11.473 1.00 0.00 C ATOM 844 C VAL A 119 4.496 9.959 10.501 1.00 0.00 C ATOM 845 O VAL A 119 4.384 9.795 9.273 1.00 0.00 O ATOM 846 CB VAL A 119 5.777 7.700 10.852 1.00 0.00 C ATOM 847 CG1 VAL A 119 5.131 6.909 9.718 1.00 0.00 C ATOM 848 CG2 VAL A 119 7.099 8.316 10.406 1.00 0.00 C ATOM 0 H VAL A 119 2.925 7.936 11.239 1.00 0.00 H new ATOM 0 HA VAL A 119 5.365 9.194 12.317 1.00 0.00 H new ATOM 0 HB VAL A 119 5.986 6.989 11.651 1.00 0.00 H new ATOM 0 HG11 VAL A 119 5.843 6.180 9.331 1.00 0.00 H new ATOM 0 HG12 VAL A 119 4.248 6.391 10.093 1.00 0.00 H new ATOM 0 HG13 VAL A 119 4.840 7.591 8.919 1.00 0.00 H new ATOM 0 HG21 VAL A 119 7.738 7.540 9.984 1.00 0.00 H new ATOM 0 HG22 VAL A 119 6.909 9.079 9.652 1.00 0.00 H new ATOM 0 HG23 VAL A 119 7.597 8.769 11.263 1.00 0.00 H new ATOM 858 N PRO A 120 4.288 11.166 11.065 1.00 0.00 N ATOM 859 CA PRO A 120 3.898 12.376 10.310 1.00 0.00 C ATOM 860 C PRO A 120 5.008 12.976 9.438 1.00 0.00 C ATOM 861 O PRO A 120 4.871 14.091 8.917 1.00 0.00 O ATOM 862 CB PRO A 120 3.491 13.375 11.406 1.00 0.00 C ATOM 863 CG PRO A 120 3.358 12.562 12.639 1.00 0.00 C ATOM 864 CD PRO A 120 4.350 11.457 12.500 1.00 0.00 C ATOM 0 HA PRO A 120 3.110 12.134 9.597 1.00 0.00 H new ATOM 0 HB2 PRO A 120 4.243 14.155 11.527 1.00 0.00 H new ATOM 0 HB3 PRO A 120 2.553 13.872 11.158 1.00 0.00 H new ATOM 0 HG2 PRO A 120 3.560 13.161 13.527 1.00 0.00 H new ATOM 0 HG3 PRO A 120 2.346 12.170 12.743 1.00 0.00 H new ATOM 0 HD2 PRO A 120 5.349 11.765 12.811 1.00 0.00 H new ATOM 0 HD3 PRO A 120 4.081 10.590 13.104 1.00 0.00 H new ATOM 872 N GLU A 121 6.087 12.252 9.250 1.00 0.00 N ATOM 873 CA GLU A 121 7.155 12.733 8.413 1.00 0.00 C ATOM 874 C GLU A 121 6.679 12.819 6.958 1.00 0.00 C ATOM 875 O GLU A 121 6.931 13.800 6.259 1.00 0.00 O ATOM 876 CB GLU A 121 8.401 11.854 8.528 1.00 0.00 C ATOM 877 CG GLU A 121 9.577 12.361 7.702 1.00 0.00 C ATOM 878 CD GLU A 121 10.059 13.740 8.134 1.00 0.00 C ATOM 879 OE1 GLU A 121 9.308 14.741 8.006 1.00 0.00 O ATOM 880 OE2 GLU A 121 11.191 13.859 8.618 1.00 0.00 O ATOM 0 H GLU A 121 6.246 11.333 9.664 1.00 0.00 H new ATOM 0 HA GLU A 121 7.433 13.730 8.755 1.00 0.00 H new ATOM 0 HB2 GLU A 121 8.700 11.795 9.575 1.00 0.00 H new ATOM 0 HB3 GLU A 121 8.153 10.841 8.210 1.00 0.00 H new ATOM 0 HG2 GLU A 121 10.402 11.653 7.782 1.00 0.00 H new ATOM 0 HG3 GLU A 121 9.288 12.396 6.652 1.00 0.00 H new ATOM 887 N LEU A 122 5.904 11.845 6.543 1.00 0.00 N ATOM 888 CA LEU A 122 5.418 11.806 5.172 1.00 0.00 C ATOM 889 C LEU A 122 4.105 12.577 5.012 1.00 0.00 C ATOM 890 O LEU A 122 3.369 12.379 4.056 1.00 0.00 O ATOM 891 CB LEU A 122 5.268 10.365 4.675 1.00 0.00 C ATOM 892 CG LEU A 122 6.548 9.517 4.627 1.00 0.00 C ATOM 893 CD1 LEU A 122 6.260 8.169 3.998 1.00 0.00 C ATOM 894 CD2 LEU A 122 7.658 10.229 3.865 1.00 0.00 C ATOM 0 H LEU A 122 5.594 11.069 7.128 1.00 0.00 H new ATOM 0 HA LEU A 122 6.167 12.301 4.554 1.00 0.00 H new ATOM 0 HB2 LEU A 122 4.547 9.857 5.315 1.00 0.00 H new ATOM 0 HB3 LEU A 122 4.840 10.393 3.673 1.00 0.00 H new ATOM 0 HG LEU A 122 6.889 9.367 5.651 1.00 0.00 H new ATOM 0 HD11 LEU A 122 7.175 7.578 3.970 1.00 0.00 H new ATOM 0 HD12 LEU A 122 5.508 7.645 4.588 1.00 0.00 H new ATOM 0 HD13 LEU A 122 5.890 8.313 2.983 1.00 0.00 H new ATOM 0 HD21 LEU A 122 8.549 9.602 3.850 1.00 0.00 H new ATOM 0 HD22 LEU A 122 7.332 10.421 2.843 1.00 0.00 H new ATOM 0 HD23 LEU A 122 7.888 11.174 4.356 1.00 0.00 H new ATOM 906 N CYS A 123 3.832 13.470 5.931 1.00 0.00 N ATOM 907 CA CYS A 123 2.656 14.284 5.843 1.00 0.00 C ATOM 908 C CYS A 123 2.863 15.439 4.882 1.00 0.00 C ATOM 909 O CYS A 123 3.540 16.419 5.191 1.00 0.00 O ATOM 910 CB CYS A 123 2.193 14.772 7.218 1.00 0.00 C ATOM 911 SG CYS A 123 1.507 13.461 8.261 1.00 0.00 S ATOM 0 H CYS A 123 4.414 13.648 6.750 1.00 0.00 H new ATOM 0 HA CYS A 123 1.857 13.659 5.445 1.00 0.00 H new ATOM 0 HB2 CYS A 123 3.036 15.231 7.734 1.00 0.00 H new ATOM 0 HB3 CYS A 123 1.440 15.549 7.084 1.00 0.00 H new ATOM 0 HG CYS A 123 1.143 13.962 9.404 1.00 0.00 H new ATOM 917 N GLY A 124 2.364 15.253 3.692 1.00 0.00 N ATOM 918 CA GLY A 124 2.363 16.285 2.700 1.00 0.00 C ATOM 919 C GLY A 124 1.086 16.221 1.912 1.00 0.00 C ATOM 920 O GLY A 124 0.234 17.108 2.001 1.00 0.00 O ATOM 0 H GLY A 124 1.945 14.376 3.384 1.00 0.00 H new ATOM 0 HA2 GLY A 124 2.461 17.261 3.175 1.00 0.00 H new ATOM 0 HA3 GLY A 124 3.219 16.166 2.036 1.00 0.00 H new ATOM 924 N SER A 125 0.914 15.138 1.200 1.00 0.00 N ATOM 925 CA SER A 125 -0.266 14.922 0.408 1.00 0.00 C ATOM 926 C SER A 125 -0.399 13.443 0.078 1.00 0.00 C ATOM 927 O SER A 125 0.552 12.691 0.232 1.00 0.00 O ATOM 928 CB SER A 125 -0.211 15.794 -0.851 1.00 0.00 C ATOM 929 OG SER A 125 1.055 15.675 -1.503 1.00 0.00 O ATOM 0 H SER A 125 1.593 14.378 1.154 1.00 0.00 H new ATOM 0 HA SER A 125 -1.153 15.214 0.970 1.00 0.00 H new ATOM 0 HB2 SER A 125 -1.006 15.500 -1.536 1.00 0.00 H new ATOM 0 HB3 SER A 125 -0.390 16.836 -0.584 1.00 0.00 H new ATOM 0 HG SER A 125 1.065 16.239 -2.304 1.00 0.00 H new ATOM 935 N VAL A 126 -1.552 13.027 -0.326 1.00 0.00 N ATOM 936 CA VAL A 126 -1.772 11.651 -0.660 1.00 0.00 C ATOM 937 C VAL A 126 -2.596 11.557 -1.941 1.00 0.00 C ATOM 938 O VAL A 126 -3.518 12.339 -2.158 1.00 0.00 O ATOM 939 CB VAL A 126 -2.458 10.873 0.531 1.00 0.00 C ATOM 940 CG1 VAL A 126 -3.816 11.464 0.900 1.00 0.00 C ATOM 941 CG2 VAL A 126 -2.575 9.376 0.243 1.00 0.00 C ATOM 0 H VAL A 126 -2.370 13.626 -0.436 1.00 0.00 H new ATOM 0 HA VAL A 126 -0.807 11.174 -0.834 1.00 0.00 H new ATOM 0 HB VAL A 126 -1.803 10.995 1.394 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -4.249 10.896 1.723 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -3.690 12.503 1.203 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -4.480 11.416 0.037 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -3.052 8.879 1.088 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -3.175 9.224 -0.654 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -1.581 8.956 0.090 1.00 0.00 H new ATOM 951 N LYS A 127 -2.215 10.672 -2.804 1.00 0.00 N ATOM 952 CA LYS A 127 -2.958 10.416 -4.003 1.00 0.00 C ATOM 953 C LYS A 127 -3.663 9.101 -3.852 1.00 0.00 C ATOM 954 O LYS A 127 -3.045 8.101 -3.517 1.00 0.00 O ATOM 955 CB LYS A 127 -2.074 10.459 -5.267 1.00 0.00 C ATOM 956 CG LYS A 127 -1.678 11.869 -5.671 1.00 0.00 C ATOM 957 CD LYS A 127 -0.940 11.925 -7.005 1.00 0.00 C ATOM 958 CE LYS A 127 -0.715 13.375 -7.411 1.00 0.00 C ATOM 959 NZ LYS A 127 0.043 13.523 -8.671 1.00 0.00 N ATOM 0 H LYS A 127 -1.376 10.101 -2.700 1.00 0.00 H new ATOM 0 HA LYS A 127 -3.693 11.209 -4.142 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -1.173 9.871 -5.093 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -2.608 9.988 -6.092 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -2.573 12.488 -5.732 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -1.045 12.299 -4.894 1.00 0.00 H new ATOM 0 HD2 LYS A 127 0.016 11.408 -6.924 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -1.517 11.409 -7.772 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -1.681 13.868 -7.517 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -0.181 13.889 -6.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 0.161 14.533 -8.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 0.978 13.080 -8.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -0.476 13.060 -9.445 1.00 0.00 H new ATOM 973 N VAL A 128 -4.952 9.109 -4.044 1.00 0.00 N ATOM 974 CA VAL A 128 -5.752 7.924 -3.808 1.00 0.00 C ATOM 975 C VAL A 128 -6.385 7.400 -5.091 1.00 0.00 C ATOM 976 O VAL A 128 -6.923 8.166 -5.907 1.00 0.00 O ATOM 977 CB VAL A 128 -6.838 8.161 -2.712 1.00 0.00 C ATOM 978 CG1 VAL A 128 -6.194 8.551 -1.391 1.00 0.00 C ATOM 979 CG2 VAL A 128 -7.838 9.223 -3.138 1.00 0.00 C ATOM 0 H VAL A 128 -5.479 9.921 -4.364 1.00 0.00 H new ATOM 0 HA VAL A 128 -5.069 7.160 -3.438 1.00 0.00 H new ATOM 0 HB VAL A 128 -7.377 7.223 -2.579 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -6.969 8.711 -0.642 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -5.529 7.753 -1.061 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -5.621 9.469 -1.523 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -8.579 9.362 -2.351 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -7.317 10.164 -3.315 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -8.337 8.907 -4.054 1.00 0.00 H new ATOM 989 N GLY A 129 -6.296 6.118 -5.277 1.00 0.00 N ATOM 990 CA GLY A 129 -6.838 5.495 -6.435 1.00 0.00 C ATOM 991 C GLY A 129 -7.881 4.488 -6.063 1.00 0.00 C ATOM 992 O GLY A 129 -7.562 3.348 -5.709 1.00 0.00 O ATOM 0 H GLY A 129 -5.843 5.477 -4.625 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -7.274 6.251 -7.089 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -6.041 5.008 -6.997 1.00 0.00 H new ATOM 996 N ILE A 130 -9.115 4.911 -6.106 1.00 0.00 N ATOM 997 CA ILE A 130 -10.227 4.061 -5.772 1.00 0.00 C ATOM 998 C ILE A 130 -10.691 3.344 -7.013 1.00 0.00 C ATOM 999 O ILE A 130 -11.033 3.977 -8.026 1.00 0.00 O ATOM 1000 CB ILE A 130 -11.449 4.844 -5.147 1.00 0.00 C ATOM 1001 CG1 ILE A 130 -11.111 5.486 -3.786 1.00 0.00 C ATOM 1002 CG2 ILE A 130 -12.670 3.937 -4.993 1.00 0.00 C ATOM 1003 CD1 ILE A 130 -10.154 6.650 -3.845 1.00 0.00 C ATOM 0 H ILE A 130 -9.379 5.859 -6.375 1.00 0.00 H new ATOM 0 HA ILE A 130 -9.873 3.361 -5.015 1.00 0.00 H new ATOM 0 HB ILE A 130 -11.680 5.646 -5.848 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -12.038 5.821 -3.320 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -10.687 4.720 -3.136 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -13.493 4.505 -4.560 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -12.966 3.556 -5.970 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -12.422 3.102 -4.338 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -9.981 7.030 -2.838 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -9.208 6.322 -4.276 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -10.580 7.440 -4.463 1.00 0.00 H new ATOM 1015 N VAL A 131 -10.667 2.055 -6.959 1.00 0.00 N ATOM 1016 CA VAL A 131 -11.175 1.271 -8.021 1.00 0.00 C ATOM 1017 C VAL A 131 -12.364 0.484 -7.491 1.00 0.00 C ATOM 1018 O VAL A 131 -12.275 -0.169 -6.446 1.00 0.00 O ATOM 1019 CB VAL A 131 -10.080 0.362 -8.681 1.00 0.00 C ATOM 1020 CG1 VAL A 131 -9.474 -0.632 -7.707 1.00 0.00 C ATOM 1021 CG2 VAL A 131 -10.613 -0.337 -9.923 1.00 0.00 C ATOM 0 H VAL A 131 -10.294 1.520 -6.175 1.00 0.00 H new ATOM 0 HA VAL A 131 -11.505 1.920 -8.832 1.00 0.00 H new ATOM 0 HB VAL A 131 -9.273 1.027 -8.987 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -8.723 -1.233 -8.220 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -9.006 -0.094 -6.882 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -10.256 -1.284 -7.318 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -9.829 -0.959 -10.355 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -11.464 -0.962 -9.652 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -10.929 0.408 -10.653 1.00 0.00 H new ATOM 1031 N GLU A 132 -13.492 0.620 -8.151 1.00 0.00 N ATOM 1032 CA GLU A 132 -14.728 -0.033 -7.730 1.00 0.00 C ATOM 1033 C GLU A 132 -14.720 -1.527 -7.973 1.00 0.00 C ATOM 1034 O GLU A 132 -15.623 -2.247 -7.535 1.00 0.00 O ATOM 1035 CB GLU A 132 -15.937 0.636 -8.366 1.00 0.00 C ATOM 1036 CG GLU A 132 -16.172 2.039 -7.838 1.00 0.00 C ATOM 1037 CD GLU A 132 -16.580 2.047 -6.380 1.00 0.00 C ATOM 1038 OE1 GLU A 132 -15.736 1.787 -5.490 1.00 0.00 O ATOM 1039 OE2 GLU A 132 -17.751 2.312 -6.087 1.00 0.00 O ATOM 0 H GLU A 132 -13.587 1.184 -8.995 1.00 0.00 H new ATOM 0 HA GLU A 132 -14.799 0.092 -6.649 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -15.799 0.677 -9.446 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -16.823 0.029 -8.181 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -15.263 2.627 -7.961 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -16.948 2.523 -8.432 1.00 0.00 H new ATOM 1046 N GLU A 133 -13.722 -1.986 -8.669 1.00 0.00 N ATOM 1047 CA GLU A 133 -13.523 -3.387 -8.888 1.00 0.00 C ATOM 1048 C GLU A 133 -12.661 -3.910 -7.748 1.00 0.00 C ATOM 1049 O GLU A 133 -11.560 -3.413 -7.531 1.00 0.00 O ATOM 1050 CB GLU A 133 -12.839 -3.631 -10.236 1.00 0.00 C ATOM 1051 CG GLU A 133 -13.600 -3.042 -11.406 1.00 0.00 C ATOM 1052 CD GLU A 133 -12.975 -3.353 -12.738 1.00 0.00 C ATOM 1053 OE1 GLU A 133 -13.326 -4.396 -13.348 1.00 0.00 O ATOM 1054 OE2 GLU A 133 -12.152 -2.562 -13.229 1.00 0.00 O ATOM 0 H GLU A 133 -13.017 -1.392 -9.105 1.00 0.00 H new ATOM 0 HA GLU A 133 -14.480 -3.908 -8.912 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -11.837 -3.203 -10.210 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -12.724 -4.704 -10.389 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -14.622 -3.422 -11.394 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -13.660 -1.961 -11.284 1.00 0.00 H new ATOM 1061 N PRO A 134 -13.144 -4.898 -6.994 1.00 0.00 N ATOM 1062 CA PRO A 134 -12.430 -5.427 -5.822 1.00 0.00 C ATOM 1063 C PRO A 134 -11.371 -6.468 -6.181 1.00 0.00 C ATOM 1064 O PRO A 134 -11.006 -7.319 -5.357 1.00 0.00 O ATOM 1065 CB PRO A 134 -13.548 -6.071 -5.015 1.00 0.00 C ATOM 1066 CG PRO A 134 -14.545 -6.529 -6.029 1.00 0.00 C ATOM 1067 CD PRO A 134 -14.436 -5.591 -7.206 1.00 0.00 C ATOM 0 HA PRO A 134 -11.878 -4.647 -5.297 1.00 0.00 H new ATOM 0 HB2 PRO A 134 -13.176 -6.907 -4.423 1.00 0.00 H new ATOM 0 HB3 PRO A 134 -13.992 -5.360 -4.319 1.00 0.00 H new ATOM 0 HG2 PRO A 134 -14.342 -7.556 -6.333 1.00 0.00 H new ATOM 0 HG3 PRO A 134 -15.553 -6.513 -5.614 1.00 0.00 H new ATOM 0 HD2 PRO A 134 -14.447 -6.134 -8.151 1.00 0.00 H new ATOM 0 HD3 PRO A 134 -15.267 -4.886 -7.233 1.00 0.00 H new ATOM 1075 N ASP A 135 -10.852 -6.366 -7.371 1.00 0.00 N ATOM 1076 CA ASP A 135 -9.879 -7.303 -7.854 1.00 0.00 C ATOM 1077 C ASP A 135 -8.513 -6.990 -7.285 1.00 0.00 C ATOM 1078 O ASP A 135 -8.035 -5.849 -7.352 1.00 0.00 O ATOM 1079 CB ASP A 135 -9.838 -7.329 -9.370 1.00 0.00 C ATOM 1080 CG ASP A 135 -8.798 -8.294 -9.887 1.00 0.00 C ATOM 1081 OD1 ASP A 135 -9.071 -9.508 -9.967 1.00 0.00 O ATOM 1082 OD2 ASP A 135 -7.693 -7.865 -10.220 1.00 0.00 O ATOM 0 H ASP A 135 -11.092 -5.630 -8.035 1.00 0.00 H new ATOM 0 HA ASP A 135 -10.176 -8.296 -7.516 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -10.818 -7.610 -9.755 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -9.623 -6.328 -9.745 1.00 0.00 H new ATOM 1087 N LYS A 136 -7.889 -8.001 -6.737 1.00 0.00 N ATOM 1088 CA LYS A 136 -6.620 -7.859 -6.073 1.00 0.00 C ATOM 1089 C LYS A 136 -5.494 -7.564 -7.038 1.00 0.00 C ATOM 1090 O LYS A 136 -4.552 -6.843 -6.686 1.00 0.00 O ATOM 1091 CB LYS A 136 -6.309 -9.099 -5.243 1.00 0.00 C ATOM 1092 CG LYS A 136 -7.305 -9.354 -4.112 1.00 0.00 C ATOM 1093 CD LYS A 136 -7.293 -8.250 -3.047 1.00 0.00 C ATOM 1094 CE LYS A 136 -5.945 -8.146 -2.329 1.00 0.00 C ATOM 1095 NZ LYS A 136 -5.604 -9.386 -1.593 1.00 0.00 N ATOM 0 H LYS A 136 -8.251 -8.954 -6.740 1.00 0.00 H new ATOM 0 HA LYS A 136 -6.700 -6.999 -5.408 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -6.290 -9.968 -5.900 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -5.310 -8.999 -4.818 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -8.308 -9.438 -4.530 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -7.075 -10.309 -3.640 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -7.526 -7.294 -3.516 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -8.077 -8.446 -2.316 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -5.163 -7.932 -3.058 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -5.970 -7.308 -1.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -4.765 -9.219 -1.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -6.404 -9.662 -0.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -5.404 -10.148 -2.271 1.00 0.00 H new ATOM 1109 N ALA A 137 -5.590 -8.064 -8.249 1.00 0.00 N ATOM 1110 CA ALA A 137 -4.539 -7.845 -9.209 1.00 0.00 C ATOM 1111 C ALA A 137 -4.589 -6.437 -9.723 1.00 0.00 C ATOM 1112 O ALA A 137 -3.565 -5.831 -9.900 1.00 0.00 O ATOM 1113 CB ALA A 137 -4.575 -8.838 -10.342 1.00 0.00 C ATOM 0 H ALA A 137 -6.376 -8.618 -8.587 1.00 0.00 H new ATOM 0 HA ALA A 137 -3.591 -7.999 -8.693 1.00 0.00 H new ATOM 0 HB1 ALA A 137 -3.762 -8.627 -11.036 1.00 0.00 H new ATOM 0 HB2 ALA A 137 -4.461 -9.847 -9.945 1.00 0.00 H new ATOM 0 HB3 ALA A 137 -5.528 -8.759 -10.865 1.00 0.00 H new ATOM 1119 N VAL A 138 -5.790 -5.910 -9.931 1.00 0.00 N ATOM 1120 CA VAL A 138 -5.953 -4.513 -10.351 1.00 0.00 C ATOM 1121 C VAL A 138 -5.326 -3.577 -9.307 1.00 0.00 C ATOM 1122 O VAL A 138 -4.591 -2.650 -9.657 1.00 0.00 O ATOM 1123 CB VAL A 138 -7.446 -4.132 -10.588 1.00 0.00 C ATOM 1124 CG1 VAL A 138 -7.586 -2.664 -10.984 1.00 0.00 C ATOM 1125 CG2 VAL A 138 -8.052 -5.009 -11.666 1.00 0.00 C ATOM 0 H VAL A 138 -6.665 -6.422 -9.818 1.00 0.00 H new ATOM 0 HA VAL A 138 -5.439 -4.398 -11.305 1.00 0.00 H new ATOM 0 HB VAL A 138 -7.980 -4.291 -9.651 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -8.638 -2.429 -11.142 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -7.189 -2.033 -10.189 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -7.031 -2.481 -11.904 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -9.094 -4.730 -11.819 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -7.500 -4.875 -12.597 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -7.997 -6.053 -11.359 1.00 0.00 H new ATOM 1135 N LEU A 139 -5.580 -3.868 -8.029 1.00 0.00 N ATOM 1136 CA LEU A 139 -5.003 -3.095 -6.924 1.00 0.00 C ATOM 1137 C LEU A 139 -3.476 -3.138 -6.989 1.00 0.00 C ATOM 1138 O LEU A 139 -2.802 -2.107 -6.928 1.00 0.00 O ATOM 1139 CB LEU A 139 -5.446 -3.670 -5.565 1.00 0.00 C ATOM 1140 CG LEU A 139 -6.945 -3.695 -5.268 1.00 0.00 C ATOM 1141 CD1 LEU A 139 -7.202 -4.360 -3.930 1.00 0.00 C ATOM 1142 CD2 LEU A 139 -7.511 -2.293 -5.260 1.00 0.00 C ATOM 0 H LEU A 139 -6.183 -4.635 -7.732 1.00 0.00 H new ATOM 0 HA LEU A 139 -5.355 -2.068 -7.019 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -5.071 -4.691 -5.493 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -4.956 -3.094 -4.780 1.00 0.00 H new ATOM 0 HG LEU A 139 -7.440 -4.267 -6.053 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -8.273 -4.372 -3.729 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -6.826 -5.383 -3.954 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -6.692 -3.804 -3.143 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -8.579 -2.333 -5.047 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -7.010 -1.703 -4.493 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -7.353 -1.831 -6.235 1.00 0.00 H new ATOM 1154 N THR A 140 -2.954 -4.335 -7.150 1.00 0.00 N ATOM 1155 CA THR A 140 -1.523 -4.565 -7.161 1.00 0.00 C ATOM 1156 C THR A 140 -0.872 -3.997 -8.448 1.00 0.00 C ATOM 1157 O THR A 140 0.255 -3.498 -8.418 1.00 0.00 O ATOM 1158 CB THR A 140 -1.243 -6.077 -7.031 1.00 0.00 C ATOM 1159 OG1 THR A 140 -2.024 -6.604 -5.929 1.00 0.00 O ATOM 1160 CG2 THR A 140 0.237 -6.340 -6.765 1.00 0.00 C ATOM 0 H THR A 140 -3.511 -5.180 -7.278 1.00 0.00 H new ATOM 0 HA THR A 140 -1.080 -4.043 -6.313 1.00 0.00 H new ATOM 0 HB THR A 140 -1.517 -6.565 -7.966 1.00 0.00 H new ATOM 0 HG1 THR A 140 -2.878 -6.945 -6.267 1.00 0.00 H new ATOM 0 HG21 THR A 140 0.406 -7.413 -6.678 1.00 0.00 H new ATOM 0 HG22 THR A 140 0.831 -5.945 -7.589 1.00 0.00 H new ATOM 0 HG23 THR A 140 0.533 -5.850 -5.838 1.00 0.00 H new ATOM 1168 N GLN A 141 -1.599 -4.060 -9.554 1.00 0.00 N ATOM 1169 CA GLN A 141 -1.150 -3.552 -10.815 1.00 0.00 C ATOM 1170 C GLN A 141 -1.027 -2.041 -10.745 1.00 0.00 C ATOM 1171 O GLN A 141 -0.008 -1.482 -11.147 1.00 0.00 O ATOM 1172 CB GLN A 141 -2.129 -3.962 -11.906 1.00 0.00 C ATOM 1173 CG GLN A 141 -1.687 -3.596 -13.286 1.00 0.00 C ATOM 1174 CD GLN A 141 -2.663 -4.042 -14.353 1.00 0.00 C ATOM 1175 OE1 GLN A 141 -3.876 -4.114 -14.125 1.00 0.00 O ATOM 1176 NE2 GLN A 141 -2.155 -4.366 -15.510 1.00 0.00 N ATOM 0 H GLN A 141 -2.530 -4.475 -9.587 1.00 0.00 H new ATOM 0 HA GLN A 141 -0.170 -3.968 -11.050 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -2.281 -5.040 -11.858 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -3.094 -3.495 -11.709 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -1.559 -2.515 -13.347 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -0.713 -4.044 -13.481 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -1.149 -4.294 -15.663 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -2.764 -4.691 -16.261 1.00 0.00 H new ATOM 1185 N ALA A 142 -2.056 -1.388 -10.206 1.00 0.00 N ATOM 1186 CA ALA A 142 -2.035 0.054 -10.032 1.00 0.00 C ATOM 1187 C ALA A 142 -0.853 0.429 -9.155 1.00 0.00 C ATOM 1188 O ALA A 142 -0.039 1.252 -9.532 1.00 0.00 O ATOM 1189 CB ALA A 142 -3.342 0.540 -9.423 1.00 0.00 C ATOM 0 H ALA A 142 -2.912 -1.839 -9.884 1.00 0.00 H new ATOM 0 HA ALA A 142 -1.927 0.537 -11.003 1.00 0.00 H new ATOM 0 HB1 ALA A 142 -3.306 1.623 -9.301 1.00 0.00 H new ATOM 0 HB2 ALA A 142 -4.170 0.276 -10.081 1.00 0.00 H new ATOM 0 HB3 ALA A 142 -3.487 0.070 -8.450 1.00 0.00 H new ATOM 1195 N TRP A 143 -0.733 -0.271 -8.024 1.00 0.00 N ATOM 1196 CA TRP A 143 0.378 -0.115 -7.075 1.00 0.00 C ATOM 1197 C TRP A 143 1.724 -0.161 -7.817 1.00 0.00 C ATOM 1198 O TRP A 143 2.617 0.661 -7.576 1.00 0.00 O ATOM 1199 CB TRP A 143 0.303 -1.267 -6.038 1.00 0.00 C ATOM 1200 CG TRP A 143 1.404 -1.298 -5.007 1.00 0.00 C ATOM 1201 CD1 TRP A 143 1.383 -0.744 -3.762 1.00 0.00 C ATOM 1202 CD2 TRP A 143 2.682 -1.941 -5.137 1.00 0.00 C ATOM 1203 NE1 TRP A 143 2.574 -0.989 -3.116 1.00 0.00 N ATOM 1204 CE2 TRP A 143 3.387 -1.716 -3.947 1.00 0.00 C ATOM 1205 CE3 TRP A 143 3.297 -2.675 -6.155 1.00 0.00 C ATOM 1206 CZ2 TRP A 143 4.673 -2.199 -3.749 1.00 0.00 C ATOM 1207 CZ3 TRP A 143 4.569 -3.151 -5.955 1.00 0.00 C ATOM 1208 CH2 TRP A 143 5.245 -2.910 -4.763 1.00 0.00 C ATOM 0 H TRP A 143 -1.414 -0.973 -7.735 1.00 0.00 H new ATOM 0 HA TRP A 143 0.300 0.848 -6.571 1.00 0.00 H new ATOM 0 HB2 TRP A 143 -0.653 -1.201 -5.519 1.00 0.00 H new ATOM 0 HB3 TRP A 143 0.308 -2.215 -6.576 1.00 0.00 H new ATOM 0 HD1 TRP A 143 0.554 -0.193 -3.343 1.00 0.00 H new ATOM 0 HE1 TRP A 143 2.812 -0.680 -2.174 1.00 0.00 H new ATOM 0 HE3 TRP A 143 2.780 -2.865 -7.084 1.00 0.00 H new ATOM 0 HZ2 TRP A 143 5.202 -2.018 -2.825 1.00 0.00 H new ATOM 0 HZ3 TRP A 143 5.052 -3.721 -6.735 1.00 0.00 H new ATOM 0 HH2 TRP A 143 6.246 -3.295 -4.638 1.00 0.00 H new ATOM 1219 N LYS A 144 1.830 -1.103 -8.730 1.00 0.00 N ATOM 1220 CA LYS A 144 3.031 -1.328 -9.500 1.00 0.00 C ATOM 1221 C LYS A 144 3.338 -0.137 -10.423 1.00 0.00 C ATOM 1222 O LYS A 144 4.466 0.353 -10.438 1.00 0.00 O ATOM 1223 CB LYS A 144 2.895 -2.621 -10.299 1.00 0.00 C ATOM 1224 CG LYS A 144 4.073 -3.568 -10.183 1.00 0.00 C ATOM 1225 CD LYS A 144 5.349 -2.966 -10.706 1.00 0.00 C ATOM 1226 CE LYS A 144 6.470 -3.978 -10.672 1.00 0.00 C ATOM 1227 NZ LYS A 144 7.679 -3.464 -11.327 1.00 0.00 N ATOM 0 H LYS A 144 1.070 -1.744 -8.960 1.00 0.00 H new ATOM 0 HA LYS A 144 3.871 -1.425 -8.812 1.00 0.00 H new ATOM 0 HB2 LYS A 144 1.995 -3.141 -9.971 1.00 0.00 H new ATOM 0 HB3 LYS A 144 2.752 -2.369 -11.350 1.00 0.00 H new ATOM 0 HG2 LYS A 144 4.209 -3.848 -9.138 1.00 0.00 H new ATOM 0 HG3 LYS A 144 3.855 -4.484 -10.733 1.00 0.00 H new ATOM 0 HD2 LYS A 144 5.200 -2.615 -11.727 1.00 0.00 H new ATOM 0 HD3 LYS A 144 5.619 -2.096 -10.107 1.00 0.00 H new ATOM 0 HE2 LYS A 144 6.697 -4.236 -9.638 1.00 0.00 H new ATOM 0 HE3 LYS A 144 6.149 -4.895 -11.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 8.348 -4.245 -11.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 7.424 -3.038 -12.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 8.123 -2.744 -10.721 1.00 0.00 H new ATOM 1241 N LEU A 145 2.342 0.333 -11.174 1.00 0.00 N ATOM 1242 CA LEU A 145 2.536 1.499 -12.051 1.00 0.00 C ATOM 1243 C LEU A 145 2.881 2.737 -11.238 1.00 0.00 C ATOM 1244 O LEU A 145 3.700 3.564 -11.660 1.00 0.00 O ATOM 1245 CB LEU A 145 1.311 1.804 -12.937 1.00 0.00 C ATOM 1246 CG LEU A 145 1.099 0.984 -14.227 1.00 0.00 C ATOM 1247 CD1 LEU A 145 2.280 1.106 -15.161 1.00 0.00 C ATOM 1248 CD2 LEU A 145 0.767 -0.464 -13.950 1.00 0.00 C ATOM 0 H LEU A 145 1.403 -0.066 -11.197 1.00 0.00 H new ATOM 0 HA LEU A 145 3.364 1.239 -12.710 1.00 0.00 H new ATOM 0 HB2 LEU A 145 0.420 1.684 -12.320 1.00 0.00 H new ATOM 0 HB3 LEU A 145 1.363 2.855 -13.220 1.00 0.00 H new ATOM 0 HG LEU A 145 0.230 1.414 -14.725 1.00 0.00 H new ATOM 0 HD11 LEU A 145 2.096 0.516 -16.059 1.00 0.00 H new ATOM 0 HD12 LEU A 145 2.420 2.151 -15.436 1.00 0.00 H new ATOM 0 HD13 LEU A 145 3.177 0.739 -14.663 1.00 0.00 H new ATOM 0 HD21 LEU A 145 0.629 -0.992 -14.893 1.00 0.00 H new ATOM 0 HD22 LEU A 145 1.583 -0.924 -13.393 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -0.150 -0.521 -13.364 1.00 0.00 H new ATOM 1260 N TRP A 146 2.262 2.850 -10.081 1.00 0.00 N ATOM 1261 CA TRP A 146 2.480 3.961 -9.176 1.00 0.00 C ATOM 1262 C TRP A 146 3.910 3.996 -8.672 1.00 0.00 C ATOM 1263 O TRP A 146 4.606 5.031 -8.805 1.00 0.00 O ATOM 1264 CB TRP A 146 1.505 3.905 -8.002 1.00 0.00 C ATOM 1265 CG TRP A 146 0.083 4.224 -8.361 1.00 0.00 C ATOM 1266 CD1 TRP A 146 -0.512 4.124 -9.577 1.00 0.00 C ATOM 1267 CD2 TRP A 146 -0.913 4.694 -7.477 1.00 0.00 C ATOM 1268 NE1 TRP A 146 -1.817 4.501 -9.499 1.00 0.00 N ATOM 1269 CE2 TRP A 146 -2.088 4.863 -8.218 1.00 0.00 C ATOM 1270 CE3 TRP A 146 -0.922 4.992 -6.133 1.00 0.00 C ATOM 1271 CZ2 TRP A 146 -3.259 5.315 -7.646 1.00 0.00 C ATOM 1272 CZ3 TRP A 146 -2.080 5.444 -5.571 1.00 0.00 C ATOM 1273 CH2 TRP A 146 -3.231 5.604 -6.321 1.00 0.00 C ATOM 0 H TRP A 146 1.587 2.167 -9.738 1.00 0.00 H new ATOM 0 HA TRP A 146 2.299 4.878 -9.736 1.00 0.00 H new ATOM 0 HB2 TRP A 146 1.541 2.908 -7.563 1.00 0.00 H new ATOM 0 HB3 TRP A 146 1.839 4.604 -7.235 1.00 0.00 H new ATOM 0 HD1 TRP A 146 -0.019 3.792 -10.479 1.00 0.00 H new ATOM 0 HE1 TRP A 146 -2.481 4.510 -10.273 1.00 0.00 H new ATOM 0 HE3 TRP A 146 -0.030 4.870 -5.536 1.00 0.00 H new ATOM 0 HZ2 TRP A 146 -4.160 5.434 -8.229 1.00 0.00 H new ATOM 0 HZ3 TRP A 146 -2.098 5.682 -4.518 1.00 0.00 H new ATOM 0 HH2 TRP A 146 -4.128 5.967 -5.841 1.00 0.00 H new ATOM 1284 N ILE A 147 4.372 2.879 -8.116 1.00 0.00 N ATOM 1285 CA ILE A 147 5.727 2.831 -7.619 1.00 0.00 C ATOM 1286 C ILE A 147 6.709 3.020 -8.773 1.00 0.00 C ATOM 1287 O ILE A 147 7.661 3.804 -8.657 1.00 0.00 O ATOM 1288 CB ILE A 147 6.055 1.550 -6.765 1.00 0.00 C ATOM 1289 CG1 ILE A 147 7.490 1.621 -6.216 1.00 0.00 C ATOM 1290 CG2 ILE A 147 5.818 0.255 -7.531 1.00 0.00 C ATOM 1291 CD1 ILE A 147 7.900 0.438 -5.364 1.00 0.00 C ATOM 0 H ILE A 147 3.836 2.018 -8.004 1.00 0.00 H new ATOM 0 HA ILE A 147 5.836 3.658 -6.917 1.00 0.00 H new ATOM 0 HB ILE A 147 5.361 1.538 -5.925 1.00 0.00 H new ATOM 0 HG12 ILE A 147 8.182 1.705 -7.054 1.00 0.00 H new ATOM 0 HG13 ILE A 147 7.594 2.531 -5.625 1.00 0.00 H new ATOM 0 HG21 ILE A 147 6.061 -0.595 -6.893 1.00 0.00 H new ATOM 0 HG22 ILE A 147 4.772 0.196 -7.831 1.00 0.00 H new ATOM 0 HG23 ILE A 147 6.452 0.236 -8.418 1.00 0.00 H new ATOM 0 HD11 ILE A 147 8.926 0.575 -5.021 1.00 0.00 H new ATOM 0 HD12 ILE A 147 7.236 0.363 -4.503 1.00 0.00 H new ATOM 0 HD13 ILE A 147 7.833 -0.476 -5.954 1.00 0.00 H new ATOM 1303 N GLU A 148 6.421 2.384 -9.924 1.00 0.00 N ATOM 1304 CA GLU A 148 7.268 2.534 -11.085 1.00 0.00 C ATOM 1305 C GLU A 148 7.383 3.965 -11.580 1.00 0.00 C ATOM 1306 O GLU A 148 8.467 4.352 -11.996 1.00 0.00 O ATOM 1307 CB GLU A 148 6.938 1.587 -12.221 1.00 0.00 C ATOM 1308 CG GLU A 148 7.389 0.159 -11.988 1.00 0.00 C ATOM 1309 CD GLU A 148 7.320 -0.657 -13.250 1.00 0.00 C ATOM 1310 OE1 GLU A 148 7.709 -0.157 -14.316 1.00 0.00 O ATOM 1311 OE2 GLU A 148 6.843 -1.803 -13.214 1.00 0.00 O ATOM 0 H GLU A 148 5.616 1.773 -10.058 1.00 0.00 H new ATOM 0 HA GLU A 148 8.253 2.245 -10.717 1.00 0.00 H new ATOM 0 HB2 GLU A 148 5.860 1.594 -12.384 1.00 0.00 H new ATOM 0 HB3 GLU A 148 7.401 1.958 -13.135 1.00 0.00 H new ATOM 0 HG2 GLU A 148 8.411 0.157 -11.608 1.00 0.00 H new ATOM 0 HG3 GLU A 148 6.764 -0.300 -11.223 1.00 0.00 H new ATOM 1318 N GLU A 149 6.294 4.768 -11.522 1.00 0.00 N ATOM 1319 CA GLU A 149 6.403 6.180 -11.916 1.00 0.00 C ATOM 1320 C GLU A 149 7.500 6.868 -11.131 1.00 0.00 C ATOM 1321 O GLU A 149 8.368 7.521 -11.704 1.00 0.00 O ATOM 1322 CB GLU A 149 5.096 6.992 -11.788 1.00 0.00 C ATOM 1323 CG GLU A 149 4.104 6.834 -12.938 1.00 0.00 C ATOM 1324 CD GLU A 149 3.051 7.943 -12.938 1.00 0.00 C ATOM 1325 OE1 GLU A 149 3.402 9.120 -12.671 1.00 0.00 O ATOM 1326 OE2 GLU A 149 1.873 7.688 -13.256 1.00 0.00 O ATOM 0 H GLU A 149 5.367 4.472 -11.218 1.00 0.00 H new ATOM 0 HA GLU A 149 6.643 6.156 -12.979 1.00 0.00 H new ATOM 0 HB2 GLU A 149 4.599 6.703 -10.862 1.00 0.00 H new ATOM 0 HB3 GLU A 149 5.353 8.047 -11.696 1.00 0.00 H new ATOM 0 HG2 GLU A 149 4.642 6.844 -13.886 1.00 0.00 H new ATOM 0 HG3 GLU A 149 3.611 5.865 -12.862 1.00 0.00 H new ATOM 1333 N HIS A 150 7.519 6.667 -9.828 1.00 0.00 N ATOM 1334 CA HIS A 150 8.550 7.310 -9.038 1.00 0.00 C ATOM 1335 C HIS A 150 9.895 6.636 -9.120 1.00 0.00 C ATOM 1336 O HIS A 150 10.913 7.305 -9.027 1.00 0.00 O ATOM 1337 CB HIS A 150 8.120 7.703 -7.626 1.00 0.00 C ATOM 1338 CG HIS A 150 7.323 8.981 -7.634 1.00 0.00 C ATOM 1339 ND1 HIS A 150 7.760 10.189 -7.090 1.00 0.00 N ATOM 1340 CD2 HIS A 150 6.100 9.237 -8.142 1.00 0.00 C ATOM 1341 CE1 HIS A 150 6.831 11.105 -7.283 1.00 0.00 C ATOM 1342 NE2 HIS A 150 5.821 10.552 -7.913 1.00 0.00 N ATOM 0 H HIS A 150 6.860 6.087 -9.309 1.00 0.00 H new ATOM 0 HA HIS A 150 8.702 8.270 -9.530 1.00 0.00 H new ATOM 0 HB2 HIS A 150 7.523 6.902 -7.189 1.00 0.00 H new ATOM 0 HB3 HIS A 150 9.001 7.825 -6.996 1.00 0.00 H new ATOM 0 HD1 HIS A 150 8.653 10.339 -6.620 1.00 0.00 H new ATOM 0 HD2 HIS A 150 5.457 8.527 -8.641 1.00 0.00 H new ATOM 0 HE1 HIS A 150 6.891 12.138 -6.974 1.00 0.00 H new ATOM 1351 N ILE A 151 9.915 5.338 -9.328 1.00 0.00 N ATOM 1352 CA ILE A 151 11.174 4.627 -9.576 1.00 0.00 C ATOM 1353 C ILE A 151 11.842 5.181 -10.843 1.00 0.00 C ATOM 1354 O ILE A 151 13.026 5.478 -10.848 1.00 0.00 O ATOM 1355 CB ILE A 151 10.985 3.082 -9.721 1.00 0.00 C ATOM 1356 CG1 ILE A 151 10.489 2.470 -8.411 1.00 0.00 C ATOM 1357 CG2 ILE A 151 12.288 2.408 -10.162 1.00 0.00 C ATOM 1358 CD1 ILE A 151 10.256 0.971 -8.479 1.00 0.00 C ATOM 0 H ILE A 151 9.085 4.746 -9.333 1.00 0.00 H new ATOM 0 HA ILE A 151 11.807 4.793 -8.705 1.00 0.00 H new ATOM 0 HB ILE A 151 10.233 2.910 -10.491 1.00 0.00 H new ATOM 0 HG12 ILE A 151 11.216 2.679 -7.626 1.00 0.00 H new ATOM 0 HG13 ILE A 151 9.559 2.959 -8.123 1.00 0.00 H new ATOM 0 HG21 ILE A 151 12.129 1.334 -10.255 1.00 0.00 H new ATOM 0 HG22 ILE A 151 12.600 2.813 -11.125 1.00 0.00 H new ATOM 0 HG23 ILE A 151 13.064 2.597 -9.420 1.00 0.00 H new ATOM 0 HD11 ILE A 151 9.905 0.613 -7.511 1.00 0.00 H new ATOM 0 HD12 ILE A 151 9.506 0.753 -9.240 1.00 0.00 H new ATOM 0 HD13 ILE A 151 11.189 0.469 -8.735 1.00 0.00 H new ATOM 1370 N LYS A 152 11.057 5.369 -11.881 1.00 0.00 N ATOM 1371 CA LYS A 152 11.565 5.882 -13.142 1.00 0.00 C ATOM 1372 C LYS A 152 12.010 7.344 -13.034 1.00 0.00 C ATOM 1373 O LYS A 152 13.123 7.683 -13.431 1.00 0.00 O ATOM 1374 CB LYS A 152 10.525 5.712 -14.257 1.00 0.00 C ATOM 1375 CG LYS A 152 10.177 4.259 -14.546 1.00 0.00 C ATOM 1376 CD LYS A 152 9.065 4.130 -15.574 1.00 0.00 C ATOM 1377 CE LYS A 152 8.716 2.668 -15.810 1.00 0.00 C ATOM 1378 NZ LYS A 152 7.627 2.502 -16.792 1.00 0.00 N ATOM 0 H LYS A 152 10.056 5.174 -11.879 1.00 0.00 H new ATOM 0 HA LYS A 152 12.448 5.295 -13.395 1.00 0.00 H new ATOM 0 HB2 LYS A 152 9.616 6.247 -13.980 1.00 0.00 H new ATOM 0 HB3 LYS A 152 10.902 6.175 -15.169 1.00 0.00 H new ATOM 0 HG2 LYS A 152 11.065 3.739 -14.906 1.00 0.00 H new ATOM 0 HG3 LYS A 152 9.873 3.769 -13.621 1.00 0.00 H new ATOM 0 HD2 LYS A 152 8.182 4.669 -15.231 1.00 0.00 H new ATOM 0 HD3 LYS A 152 9.375 4.591 -16.512 1.00 0.00 H new ATOM 0 HE2 LYS A 152 9.602 2.138 -16.160 1.00 0.00 H new ATOM 0 HE3 LYS A 152 8.423 2.210 -14.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 7.425 1.490 -16.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 6.773 2.985 -16.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 7.915 2.915 -17.702 1.00 0.00 H new ATOM 1392 N VAL A 153 11.172 8.199 -12.460 1.00 0.00 N ATOM 1393 CA VAL A 153 11.493 9.630 -12.424 1.00 0.00 C ATOM 1394 C VAL A 153 12.490 10.044 -11.320 1.00 0.00 C ATOM 1395 O VAL A 153 13.270 10.970 -11.523 1.00 0.00 O ATOM 1396 CB VAL A 153 10.239 10.559 -12.402 1.00 0.00 C ATOM 1397 CG1 VAL A 153 9.348 10.285 -13.604 1.00 0.00 C ATOM 1398 CG2 VAL A 153 9.448 10.425 -11.110 1.00 0.00 C ATOM 0 H VAL A 153 10.287 7.942 -12.023 1.00 0.00 H new ATOM 0 HA VAL A 153 12.002 9.782 -13.376 1.00 0.00 H new ATOM 0 HB VAL A 153 10.599 11.586 -12.456 1.00 0.00 H new ATOM 0 HG11 VAL A 153 8.479 10.943 -13.570 1.00 0.00 H new ATOM 0 HG12 VAL A 153 9.907 10.469 -14.521 1.00 0.00 H new ATOM 0 HG13 VAL A 153 9.018 9.246 -13.583 1.00 0.00 H new ATOM 0 HG21 VAL A 153 8.585 11.090 -11.141 1.00 0.00 H new ATOM 0 HG22 VAL A 153 9.109 9.395 -10.996 1.00 0.00 H new ATOM 0 HG23 VAL A 153 10.083 10.693 -10.265 1.00 0.00 H new ATOM 1408 N THR A 154 12.487 9.374 -10.178 1.00 0.00 N ATOM 1409 CA THR A 154 13.384 9.777 -9.090 1.00 0.00 C ATOM 1410 C THR A 154 14.160 8.584 -8.494 1.00 0.00 C ATOM 1411 O THR A 154 15.275 8.744 -8.005 1.00 0.00 O ATOM 1412 CB THR A 154 12.632 10.608 -7.980 1.00 0.00 C ATOM 1413 OG1 THR A 154 13.514 10.978 -6.910 1.00 0.00 O ATOM 1414 CG2 THR A 154 11.452 9.850 -7.406 1.00 0.00 C ATOM 0 H THR A 154 11.893 8.569 -9.976 1.00 0.00 H new ATOM 0 HA THR A 154 14.128 10.439 -9.532 1.00 0.00 H new ATOM 0 HB THR A 154 12.266 11.509 -8.473 1.00 0.00 H new ATOM 0 HG1 THR A 154 13.428 11.938 -6.733 1.00 0.00 H new ATOM 0 HG21 THR A 154 10.963 10.459 -6.646 1.00 0.00 H new ATOM 0 HG22 THR A 154 10.742 9.625 -8.202 1.00 0.00 H new ATOM 0 HG23 THR A 154 11.801 8.920 -6.957 1.00 0.00 H new ATOM 1422 N GLY A 155 13.568 7.409 -8.524 1.00 0.00 N ATOM 1423 CA GLY A 155 14.257 6.226 -8.068 1.00 0.00 C ATOM 1424 C GLY A 155 14.055 5.936 -6.604 1.00 0.00 C ATOM 1425 O GLY A 155 14.797 5.143 -6.029 1.00 0.00 O ATOM 0 H GLY A 155 12.617 7.250 -8.858 1.00 0.00 H new ATOM 0 HA2 GLY A 155 13.915 5.370 -8.650 1.00 0.00 H new ATOM 0 HA3 GLY A 155 15.323 6.339 -8.264 1.00 0.00 H new ATOM 1429 N LYS A 156 13.066 6.561 -5.998 1.00 0.00 N ATOM 1430 CA LYS A 156 12.801 6.363 -4.588 1.00 0.00 C ATOM 1431 C LYS A 156 12.097 5.056 -4.294 1.00 0.00 C ATOM 1432 O LYS A 156 11.004 4.796 -4.795 1.00 0.00 O ATOM 1433 CB LYS A 156 11.994 7.510 -4.004 1.00 0.00 C ATOM 1434 CG LYS A 156 12.743 8.813 -3.899 1.00 0.00 C ATOM 1435 CD LYS A 156 11.868 9.862 -3.263 1.00 0.00 C ATOM 1436 CE LYS A 156 12.635 11.136 -2.943 1.00 0.00 C ATOM 1437 NZ LYS A 156 13.135 11.829 -4.149 1.00 0.00 N ATOM 0 H LYS A 156 12.431 7.212 -6.461 1.00 0.00 H new ATOM 0 HA LYS A 156 13.781 6.329 -4.112 1.00 0.00 H new ATOM 0 HB2 LYS A 156 11.108 7.664 -4.620 1.00 0.00 H new ATOM 0 HB3 LYS A 156 11.647 7.224 -3.011 1.00 0.00 H new ATOM 0 HG2 LYS A 156 13.648 8.675 -3.307 1.00 0.00 H new ATOM 0 HG3 LYS A 156 13.057 9.142 -4.890 1.00 0.00 H new ATOM 0 HD2 LYS A 156 11.041 10.097 -3.933 1.00 0.00 H new ATOM 0 HD3 LYS A 156 11.433 9.463 -2.347 1.00 0.00 H new ATOM 0 HE2 LYS A 156 11.988 11.812 -2.384 1.00 0.00 H new ATOM 0 HE3 LYS A 156 13.477 10.893 -2.295 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 13.099 12.857 -3.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 14.117 11.540 -4.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 12.541 11.578 -4.965 1.00 0.00 H new ATOM 1451 N VAL A 157 12.748 4.248 -3.491 1.00 0.00 N ATOM 1452 CA VAL A 157 12.201 3.005 -2.967 1.00 0.00 C ATOM 1453 C VAL A 157 12.627 2.938 -1.490 1.00 0.00 C ATOM 1454 O VAL A 157 13.681 2.367 -1.155 1.00 0.00 O ATOM 1455 CB VAL A 157 12.721 1.724 -3.716 1.00 0.00 C ATOM 1456 CG1 VAL A 157 12.035 0.464 -3.191 1.00 0.00 C ATOM 1457 CG2 VAL A 157 12.535 1.831 -5.227 1.00 0.00 C ATOM 0 H VAL A 157 13.698 4.436 -3.172 1.00 0.00 H new ATOM 0 HA VAL A 157 11.120 3.010 -3.103 1.00 0.00 H new ATOM 0 HB VAL A 157 13.790 1.653 -3.514 1.00 0.00 H new ATOM 0 HG11 VAL A 157 12.414 -0.406 -3.727 1.00 0.00 H new ATOM 0 HG12 VAL A 157 12.242 0.354 -2.127 1.00 0.00 H new ATOM 0 HG13 VAL A 157 10.959 0.545 -3.345 1.00 0.00 H new ATOM 0 HG21 VAL A 157 12.908 0.925 -5.705 1.00 0.00 H new ATOM 0 HG22 VAL A 157 11.476 1.953 -5.456 1.00 0.00 H new ATOM 0 HG23 VAL A 157 13.088 2.692 -5.602 1.00 0.00 H new ATOM 1467 N PRO A 158 11.906 3.642 -0.616 1.00 0.00 N ATOM 1468 CA PRO A 158 12.233 3.737 0.810 1.00 0.00 C ATOM 1469 C PRO A 158 11.828 2.484 1.613 1.00 0.00 C ATOM 1470 O PRO A 158 10.971 1.697 1.167 1.00 0.00 O ATOM 1471 CB PRO A 158 11.419 4.970 1.274 1.00 0.00 C ATOM 1472 CG PRO A 158 10.914 5.585 0.018 1.00 0.00 C ATOM 1473 CD PRO A 158 10.733 4.451 -0.927 1.00 0.00 C ATOM 0 HA PRO A 158 13.307 3.823 0.972 1.00 0.00 H new ATOM 0 HB2 PRO A 158 10.598 4.679 1.930 1.00 0.00 H new ATOM 0 HB3 PRO A 158 12.042 5.668 1.834 1.00 0.00 H new ATOM 0 HG2 PRO A 158 9.974 6.110 0.187 1.00 0.00 H new ATOM 0 HG3 PRO A 158 11.621 6.316 -0.375 1.00 0.00 H new ATOM 0 HD2 PRO A 158 9.802 3.912 -0.752 1.00 0.00 H new ATOM 0 HD3 PRO A 158 10.721 4.778 -1.967 1.00 0.00 H new ATOM 1481 N PRO A 159 12.423 2.306 2.834 1.00 0.00 N ATOM 1482 CA PRO A 159 12.174 1.143 3.735 1.00 0.00 C ATOM 1483 C PRO A 159 10.697 0.890 4.038 1.00 0.00 C ATOM 1484 O PRO A 159 10.318 -0.220 4.367 1.00 0.00 O ATOM 1485 CB PRO A 159 12.889 1.541 5.024 1.00 0.00 C ATOM 1486 CG PRO A 159 13.982 2.435 4.580 1.00 0.00 C ATOM 1487 CD PRO A 159 13.430 3.221 3.431 1.00 0.00 C ATOM 0 HA PRO A 159 12.523 0.220 3.272 1.00 0.00 H new ATOM 0 HB2 PRO A 159 12.214 2.051 5.711 1.00 0.00 H new ATOM 0 HB3 PRO A 159 13.278 0.668 5.548 1.00 0.00 H new ATOM 0 HG2 PRO A 159 14.299 3.095 5.388 1.00 0.00 H new ATOM 0 HG3 PRO A 159 14.857 1.861 4.276 1.00 0.00 H new ATOM 0 HD2 PRO A 159 12.976 4.154 3.765 1.00 0.00 H new ATOM 0 HD3 PRO A 159 14.208 3.484 2.714 1.00 0.00 H new ATOM 1495 N GLY A 160 9.883 1.924 3.914 1.00 0.00 N ATOM 1496 CA GLY A 160 8.464 1.808 4.179 1.00 0.00 C ATOM 1497 C GLY A 160 7.750 0.912 3.185 1.00 0.00 C ATOM 1498 O GLY A 160 6.761 0.264 3.520 1.00 0.00 O ATOM 0 H GLY A 160 10.185 2.856 3.630 1.00 0.00 H new ATOM 0 HA2 GLY A 160 8.318 1.415 5.185 1.00 0.00 H new ATOM 0 HA3 GLY A 160 8.013 2.800 4.156 1.00 0.00 H new ATOM 1502 N ASN A 161 8.251 0.863 1.971 1.00 0.00 N ATOM 1503 CA ASN A 161 7.627 0.058 0.929 1.00 0.00 C ATOM 1504 C ASN A 161 8.304 -1.312 0.844 1.00 0.00 C ATOM 1505 O ASN A 161 7.835 -2.240 0.180 1.00 0.00 O ATOM 1506 CB ASN A 161 7.679 0.808 -0.414 1.00 0.00 C ATOM 1507 CG ASN A 161 7.020 0.058 -1.560 1.00 0.00 C ATOM 1508 OD1 ASN A 161 7.673 -0.669 -2.301 1.00 0.00 O ATOM 1509 ND2 ASN A 161 5.724 0.195 -1.691 1.00 0.00 N ATOM 0 H ASN A 161 9.087 1.368 1.675 1.00 0.00 H new ATOM 0 HA ASN A 161 6.579 -0.110 1.176 1.00 0.00 H new ATOM 0 HB2 ASN A 161 7.192 1.776 -0.298 1.00 0.00 H new ATOM 0 HB3 ASN A 161 8.720 1.003 -0.671 1.00 0.00 H new ATOM 0 HD21 ASN A 161 5.229 -0.311 -2.426 1.00 0.00 H new ATOM 0 HD22 ASN A 161 5.209 0.808 -1.058 1.00 0.00 H new