USER MOD reduce.3.24.130724 H: found=0, std=0, add=797, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 795 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 21 LYS NZ :NH3+ -109:sc= 0.501 (180deg=0) USER MOD Set 1.2: A 108 CYS SG : rot -43:sc= 0.17 USER MOD Set 2.1: A 56 CYS SG : rot -113:sc= 0.897 USER MOD Set 2.2: A 80 SER OG : rot 95:sc= 1.04 USER MOD Set 3.1: A 45 ASN : amide:sc= -3.4 K(o=-9.6,f=-8!) USER MOD Set 3.2: A 47 THR OG1 : rot 180:sc= 0 USER MOD Set 3.3: A 93 ASN : amide:sc= -6.22! C(o=-9.6!,f=-6.9!) USER MOD Set 4.1: A 28 HIS : no HE2:sc= -0.62 K(o=-0.87,f=-2.2!) USER MOD Set 4.2: A 30 TYR OH : rot 165:sc= -0.253 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 HIS : no HE2:sc= -2.05! C(o=-2.1!,f=-4.4!) USER MOD Single : A 13 ASN : amide:sc= -3.45 K(o=-3.4,f=-8.9!) USER MOD Single : A 24 THR OG1 : rot 180:sc= -0.413 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 CYS SG : rot 31:sc= 0.397 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= -1.05 K(o=-1.1,f=-1.7) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 46 MET CE :methyl -147:sc= -1.32 (180deg=-4.09!) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 29:sc= 0.0846 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 72 GLN : amide:sc= 0.152 K(o=0.15,f=-1.1) USER MOD Single : A 75 GLN : amide:sc= -0.274 K(o=-0.27,f=-1) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 SER OG : rot 79:sc= 0.00304 USER MOD Single : A 85 ASN : amide:sc= -0.681 K(o=-0.68,f=-2!) USER MOD Single : A 95 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 66 N PRO A 8 9.467 -3.762 6.354 1.00 0.00 N ATOM 67 CA PRO A 8 8.539 -4.830 6.737 1.00 0.00 C ATOM 68 C PRO A 8 8.566 -6.000 5.759 1.00 0.00 C ATOM 69 O PRO A 8 8.870 -5.829 4.579 1.00 0.00 O ATOM 70 CB PRO A 8 7.173 -4.140 6.708 1.00 0.00 C ATOM 71 CG PRO A 8 7.339 -3.010 5.752 1.00 0.00 C ATOM 72 CD PRO A 8 8.764 -2.552 5.896 1.00 0.00 C ATOM 0 HA PRO A 8 8.793 -5.263 7.705 1.00 0.00 H new ATOM 0 HB2 PRO A 8 6.391 -4.824 6.380 1.00 0.00 H new ATOM 0 HB3 PRO A 8 6.889 -3.783 7.698 1.00 0.00 H new ATOM 0 HG2 PRO A 8 7.133 -3.330 4.730 1.00 0.00 H new ATOM 0 HG3 PRO A 8 6.644 -2.201 5.979 1.00 0.00 H new ATOM 0 HD2 PRO A 8 9.166 -2.187 4.951 1.00 0.00 H new ATOM 0 HD3 PRO A 8 8.854 -1.738 6.616 1.00 0.00 H new ATOM 80 N LYS A 9 8.246 -7.189 6.258 1.00 0.00 N ATOM 81 CA LYS A 9 8.231 -8.388 5.429 1.00 0.00 C ATOM 82 C LYS A 9 7.138 -8.303 4.369 1.00 0.00 C ATOM 83 O LYS A 9 7.284 -8.838 3.269 1.00 0.00 O ATOM 84 CB LYS A 9 8.019 -9.631 6.297 1.00 0.00 C ATOM 85 CG LYS A 9 8.974 -9.720 7.475 1.00 0.00 C ATOM 86 CD LYS A 9 10.332 -10.255 7.053 1.00 0.00 C ATOM 87 CE LYS A 9 11.137 -10.737 8.251 1.00 0.00 C ATOM 88 NZ LYS A 9 12.435 -11.339 7.840 1.00 0.00 N ATOM 0 H LYS A 9 7.993 -7.348 7.233 1.00 0.00 H new ATOM 0 HA LYS A 9 9.195 -8.464 4.926 1.00 0.00 H new ATOM 0 HB2 LYS A 9 6.995 -9.633 6.669 1.00 0.00 H new ATOM 0 HB3 LYS A 9 8.135 -10.520 5.678 1.00 0.00 H new ATOM 0 HG2 LYS A 9 9.094 -8.733 7.923 1.00 0.00 H new ATOM 0 HG3 LYS A 9 8.549 -10.368 8.241 1.00 0.00 H new ATOM 0 HD2 LYS A 9 10.198 -11.076 6.349 1.00 0.00 H new ATOM 0 HD3 LYS A 9 10.886 -9.475 6.531 1.00 0.00 H new ATOM 0 HE2 LYS A 9 11.322 -9.900 8.925 1.00 0.00 H new ATOM 0 HE3 LYS A 9 10.556 -11.472 8.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 12.954 -11.655 8.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 12.258 -12.153 7.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 13.001 -10.630 7.331 1.00 0.00 H new ATOM 102 N ILE A 10 6.044 -7.628 4.706 1.00 0.00 N ATOM 103 CA ILE A 10 4.928 -7.471 3.781 1.00 0.00 C ATOM 104 C ILE A 10 5.032 -6.159 3.012 1.00 0.00 C ATOM 105 O ILE A 10 5.382 -5.121 3.576 1.00 0.00 O ATOM 106 CB ILE A 10 3.577 -7.516 4.518 1.00 0.00 C ATOM 107 CG1 ILE A 10 3.710 -6.900 5.912 1.00 0.00 C ATOM 108 CG2 ILE A 10 3.071 -8.948 4.611 1.00 0.00 C ATOM 109 CD1 ILE A 10 4.229 -7.868 6.953 1.00 0.00 C ATOM 0 H ILE A 10 5.907 -7.181 5.613 1.00 0.00 H new ATOM 0 HA ILE A 10 4.978 -8.304 3.080 1.00 0.00 H new ATOM 0 HB ILE A 10 2.852 -6.932 3.952 1.00 0.00 H new ATOM 0 HG12 ILE A 10 4.380 -6.042 5.859 1.00 0.00 H new ATOM 0 HG13 ILE A 10 2.737 -6.525 6.229 1.00 0.00 H new ATOM 0 HG21 ILE A 10 2.115 -8.963 5.135 1.00 0.00 H new ATOM 0 HG22 ILE A 10 2.941 -9.354 3.608 1.00 0.00 H new ATOM 0 HG23 ILE A 10 3.793 -9.554 5.157 1.00 0.00 H new ATOM 0 HD11 ILE A 10 4.298 -7.363 7.917 1.00 0.00 H new ATOM 0 HD12 ILE A 10 3.547 -8.715 7.035 1.00 0.00 H new ATOM 0 HD13 ILE A 10 5.216 -8.224 6.659 1.00 0.00 H new ATOM 121 N HIS A 11 4.724 -6.211 1.719 1.00 0.00 N ATOM 122 CA HIS A 11 4.780 -5.025 0.872 1.00 0.00 C ATOM 123 C HIS A 11 3.591 -4.983 -0.083 1.00 0.00 C ATOM 124 O HIS A 11 3.072 -6.022 -0.490 1.00 0.00 O ATOM 125 CB HIS A 11 6.087 -5.001 0.078 1.00 0.00 C ATOM 126 CG HIS A 11 6.043 -5.822 -1.174 1.00 0.00 C ATOM 127 ND1 HIS A 11 5.600 -5.327 -2.382 1.00 0.00 N ATOM 128 CD2 HIS A 11 6.391 -7.110 -1.401 1.00 0.00 C ATOM 129 CE1 HIS A 11 5.676 -6.276 -3.298 1.00 0.00 C ATOM 130 NE2 HIS A 11 6.153 -7.368 -2.728 1.00 0.00 N ATOM 0 H HIS A 11 4.433 -7.061 1.236 1.00 0.00 H new ATOM 0 HA HIS A 11 4.738 -4.147 1.516 1.00 0.00 H new ATOM 0 HB2 HIS A 11 6.326 -3.970 -0.182 1.00 0.00 H new ATOM 0 HB3 HIS A 11 6.895 -5.365 0.713 1.00 0.00 H new ATOM 0 HD1 HIS A 11 5.266 -4.377 -2.543 1.00 0.00 H new ATOM 0 HD2 HIS A 11 6.783 -7.805 -0.674 1.00 0.00 H new ATOM 0 HE1 HIS A 11 5.396 -6.176 -4.336 1.00 0.00 H new ATOM 138 N PHE A 12 3.163 -3.775 -0.435 1.00 0.00 N ATOM 139 CA PHE A 12 2.034 -3.597 -1.340 1.00 0.00 C ATOM 140 C PHE A 12 2.498 -3.591 -2.794 1.00 0.00 C ATOM 141 O PHE A 12 3.604 -3.151 -3.101 1.00 0.00 O ATOM 142 CB PHE A 12 1.298 -2.294 -1.022 1.00 0.00 C ATOM 143 CG PHE A 12 0.348 -2.409 0.136 1.00 0.00 C ATOM 144 CD1 PHE A 12 -0.888 -3.014 -0.023 1.00 0.00 C ATOM 145 CD2 PHE A 12 0.691 -1.910 1.382 1.00 0.00 C ATOM 146 CE1 PHE A 12 -1.764 -3.122 1.041 1.00 0.00 C ATOM 147 CE2 PHE A 12 -0.181 -2.015 2.449 1.00 0.00 C ATOM 148 CZ PHE A 12 -1.410 -2.621 2.278 1.00 0.00 C ATOM 0 H PHE A 12 3.581 -2.905 -0.107 1.00 0.00 H new ATOM 0 HA PHE A 12 1.352 -4.435 -1.198 1.00 0.00 H new ATOM 0 HB2 PHE A 12 2.030 -1.516 -0.805 1.00 0.00 H new ATOM 0 HB3 PHE A 12 0.745 -1.974 -1.905 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -1.170 -3.406 -0.989 1.00 0.00 H new ATOM 0 HD2 PHE A 12 1.650 -1.434 1.521 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -2.724 -3.598 0.905 1.00 0.00 H new ATOM 0 HE2 PHE A 12 0.099 -1.623 3.416 1.00 0.00 H new ATOM 0 HZ PHE A 12 -2.093 -2.703 3.110 1.00 0.00 H new ATOM 158 N ASN A 13 1.642 -4.084 -3.683 1.00 0.00 N ATOM 159 CA ASN A 13 1.964 -4.137 -5.105 1.00 0.00 C ATOM 160 C ASN A 13 2.560 -2.814 -5.577 1.00 0.00 C ATOM 161 O ASN A 13 3.361 -2.780 -6.511 1.00 0.00 O ATOM 162 CB ASN A 13 0.711 -4.465 -5.921 1.00 0.00 C ATOM 163 CG ASN A 13 -0.504 -3.689 -5.451 1.00 0.00 C ATOM 164 OD1 ASN A 13 -0.424 -2.897 -4.512 1.00 0.00 O ATOM 165 ND2 ASN A 13 -1.638 -3.914 -6.104 1.00 0.00 N ATOM 0 H ASN A 13 0.721 -4.452 -3.445 1.00 0.00 H new ATOM 0 HA ASN A 13 2.704 -4.923 -5.256 1.00 0.00 H new ATOM 0 HB2 ASN A 13 0.897 -4.243 -6.972 1.00 0.00 H new ATOM 0 HB3 ASN A 13 0.505 -5.533 -5.853 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -2.489 -3.421 -5.833 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -1.658 -4.580 -6.877 1.00 0.00 H new ATOM 172 N PHE A 14 2.163 -1.726 -4.925 1.00 0.00 N ATOM 173 CA PHE A 14 2.657 -0.401 -5.279 1.00 0.00 C ATOM 174 C PHE A 14 2.942 0.425 -4.027 1.00 0.00 C ATOM 175 O PHE A 14 2.371 0.177 -2.965 1.00 0.00 O ATOM 176 CB PHE A 14 1.642 0.327 -6.163 1.00 0.00 C ATOM 177 CG PHE A 14 0.214 0.028 -5.806 1.00 0.00 C ATOM 178 CD1 PHE A 14 -0.311 0.436 -4.591 1.00 0.00 C ATOM 179 CD2 PHE A 14 -0.604 -0.661 -6.687 1.00 0.00 C ATOM 180 CE1 PHE A 14 -1.624 0.161 -4.260 1.00 0.00 C ATOM 181 CE2 PHE A 14 -1.919 -0.939 -6.362 1.00 0.00 C ATOM 182 CZ PHE A 14 -2.430 -0.526 -5.147 1.00 0.00 C ATOM 0 H PHE A 14 1.501 -1.736 -4.149 1.00 0.00 H new ATOM 0 HA PHE A 14 3.588 -0.524 -5.833 1.00 0.00 H new ATOM 0 HB2 PHE A 14 1.810 1.401 -6.087 1.00 0.00 H new ATOM 0 HB3 PHE A 14 1.814 0.051 -7.203 1.00 0.00 H new ATOM 0 HD1 PHE A 14 0.313 0.975 -3.894 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -0.210 -0.985 -7.639 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -2.020 0.483 -3.308 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -2.546 -1.478 -7.057 1.00 0.00 H new ATOM 0 HZ PHE A 14 -3.457 -0.740 -4.891 1.00 0.00 H new ATOM 192 N GLU A 15 3.829 1.406 -4.162 1.00 0.00 N ATOM 193 CA GLU A 15 4.191 2.266 -3.042 1.00 0.00 C ATOM 194 C GLU A 15 3.156 3.372 -2.849 1.00 0.00 C ATOM 195 O GLU A 15 2.842 3.753 -1.720 1.00 0.00 O ATOM 196 CB GLU A 15 5.574 2.881 -3.268 1.00 0.00 C ATOM 197 CG GLU A 15 6.037 3.774 -2.129 1.00 0.00 C ATOM 198 CD GLU A 15 7.144 4.723 -2.544 1.00 0.00 C ATOM 199 OE1 GLU A 15 8.137 4.251 -3.137 1.00 0.00 O ATOM 200 OE2 GLU A 15 7.018 5.936 -2.277 1.00 0.00 O ATOM 0 H GLU A 15 4.309 1.625 -5.035 1.00 0.00 H new ATOM 0 HA GLU A 15 4.217 1.654 -2.141 1.00 0.00 H new ATOM 0 HB2 GLU A 15 6.300 2.080 -3.409 1.00 0.00 H new ATOM 0 HB3 GLU A 15 5.558 3.462 -4.190 1.00 0.00 H new ATOM 0 HG2 GLU A 15 5.190 4.350 -1.757 1.00 0.00 H new ATOM 0 HG3 GLU A 15 6.386 3.153 -1.304 1.00 0.00 H new ATOM 207 N LEU A 16 2.631 3.882 -3.957 1.00 0.00 N ATOM 208 CA LEU A 16 1.632 4.944 -3.911 1.00 0.00 C ATOM 209 C LEU A 16 0.414 4.583 -4.756 1.00 0.00 C ATOM 210 O LEU A 16 0.544 4.012 -5.840 1.00 0.00 O ATOM 211 CB LEU A 16 2.236 6.261 -4.402 1.00 0.00 C ATOM 212 CG LEU A 16 1.247 7.399 -4.658 1.00 0.00 C ATOM 213 CD1 LEU A 16 1.051 8.228 -3.398 1.00 0.00 C ATOM 214 CD2 LEU A 16 1.727 8.274 -5.806 1.00 0.00 C ATOM 0 H LEU A 16 2.880 3.578 -4.898 1.00 0.00 H new ATOM 0 HA LEU A 16 1.311 5.062 -2.876 1.00 0.00 H new ATOM 0 HB2 LEU A 16 2.966 6.599 -3.666 1.00 0.00 H new ATOM 0 HB3 LEU A 16 2.781 6.066 -5.325 1.00 0.00 H new ATOM 0 HG LEU A 16 0.286 6.965 -4.936 1.00 0.00 H new ATOM 0 HD11 LEU A 16 0.344 9.033 -3.599 1.00 0.00 H new ATOM 0 HD12 LEU A 16 0.662 7.593 -2.602 1.00 0.00 H new ATOM 0 HD13 LEU A 16 2.006 8.652 -3.089 1.00 0.00 H new ATOM 0 HD21 LEU A 16 1.011 9.079 -5.974 1.00 0.00 H new ATOM 0 HD22 LEU A 16 2.699 8.699 -5.557 1.00 0.00 H new ATOM 0 HD23 LEU A 16 1.815 7.672 -6.710 1.00 0.00 H new ATOM 226 N LEU A 17 -0.768 4.921 -4.255 1.00 0.00 N ATOM 227 CA LEU A 17 -2.010 4.635 -4.965 1.00 0.00 C ATOM 228 C LEU A 17 -2.780 5.919 -5.255 1.00 0.00 C ATOM 229 O LEU A 17 -3.463 6.457 -4.383 1.00 0.00 O ATOM 230 CB LEU A 17 -2.881 3.680 -4.146 1.00 0.00 C ATOM 231 CG LEU A 17 -4.331 3.531 -4.607 1.00 0.00 C ATOM 232 CD1 LEU A 17 -4.394 2.813 -5.946 1.00 0.00 C ATOM 233 CD2 LEU A 17 -5.149 2.787 -3.562 1.00 0.00 C ATOM 0 H LEU A 17 -0.893 5.394 -3.360 1.00 0.00 H new ATOM 0 HA LEU A 17 -1.756 4.163 -5.914 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -2.414 2.695 -4.157 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -2.883 4.020 -3.110 1.00 0.00 H new ATOM 0 HG LEU A 17 -4.757 4.527 -4.731 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -5.434 2.716 -6.258 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -3.843 3.385 -6.692 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -3.950 1.822 -5.849 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -6.178 2.690 -3.907 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -4.724 1.796 -3.405 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -5.131 3.342 -2.624 1.00 0.00 H new ATOM 245 N ASP A 18 -2.665 6.405 -6.486 1.00 0.00 N ATOM 246 CA ASP A 18 -3.353 7.625 -6.894 1.00 0.00 C ATOM 247 C ASP A 18 -4.770 7.318 -7.368 1.00 0.00 C ATOM 248 O ASP A 18 -4.980 6.932 -8.519 1.00 0.00 O ATOM 249 CB ASP A 18 -2.572 8.330 -8.004 1.00 0.00 C ATOM 250 CG ASP A 18 -2.274 7.413 -9.174 1.00 0.00 C ATOM 251 OD1 ASP A 18 -1.849 6.263 -8.934 1.00 0.00 O ATOM 252 OD2 ASP A 18 -2.466 7.845 -10.329 1.00 0.00 O ATOM 0 H ASP A 18 -2.102 5.973 -7.219 1.00 0.00 H new ATOM 0 HA ASP A 18 -3.414 8.285 -6.028 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -3.142 9.190 -8.356 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -1.636 8.713 -7.599 1.00 0.00 H new ATOM 257 N ILE A 19 -5.738 7.490 -6.475 1.00 0.00 N ATOM 258 CA ILE A 19 -7.134 7.231 -6.803 1.00 0.00 C ATOM 259 C ILE A 19 -7.648 8.222 -7.842 1.00 0.00 C ATOM 260 O ILE A 19 -8.734 8.051 -8.394 1.00 0.00 O ATOM 261 CB ILE A 19 -8.030 7.307 -5.552 1.00 0.00 C ATOM 262 CG1 ILE A 19 -7.878 8.669 -4.871 1.00 0.00 C ATOM 263 CG2 ILE A 19 -7.685 6.184 -4.585 1.00 0.00 C ATOM 264 CD1 ILE A 19 -8.722 8.819 -3.625 1.00 0.00 C ATOM 0 H ILE A 19 -5.581 7.808 -5.518 1.00 0.00 H new ATOM 0 HA ILE A 19 -7.179 6.222 -7.212 1.00 0.00 H new ATOM 0 HB ILE A 19 -9.069 7.189 -5.859 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.830 8.821 -4.611 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -8.148 9.452 -5.579 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -8.326 6.251 -3.706 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -7.839 5.222 -5.074 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -6.642 6.273 -4.281 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -8.564 9.808 -3.195 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -9.774 8.699 -3.882 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -8.437 8.058 -2.899 1.00 0.00 H new ATOM 276 N GLY A 20 -6.857 9.258 -8.106 1.00 0.00 N ATOM 277 CA GLY A 20 -7.248 10.260 -9.080 1.00 0.00 C ATOM 278 C GLY A 20 -8.456 11.061 -8.636 1.00 0.00 C ATOM 279 O GLY A 20 -8.906 10.939 -7.496 1.00 0.00 O ATOM 0 H GLY A 20 -5.953 9.421 -7.663 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -6.412 10.937 -9.256 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -7.468 9.772 -10.030 1.00 0.00 H new ATOM 283 N LYS A 21 -8.981 11.885 -9.536 1.00 0.00 N ATOM 284 CA LYS A 21 -10.144 12.710 -9.232 1.00 0.00 C ATOM 285 C LYS A 21 -11.363 11.844 -8.932 1.00 0.00 C ATOM 286 O LYS A 21 -11.669 10.908 -9.671 1.00 0.00 O ATOM 287 CB LYS A 21 -10.448 13.650 -10.401 1.00 0.00 C ATOM 288 CG LYS A 21 -9.291 14.565 -10.763 1.00 0.00 C ATOM 289 CD LYS A 21 -9.730 15.671 -11.707 1.00 0.00 C ATOM 290 CE LYS A 21 -10.205 16.899 -10.945 1.00 0.00 C ATOM 291 NZ LYS A 21 -9.087 17.838 -10.653 1.00 0.00 N ATOM 0 H LYS A 21 -8.619 11.999 -10.483 1.00 0.00 H new ATOM 0 HA LYS A 21 -9.915 13.303 -8.347 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -10.717 13.055 -11.274 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -11.317 14.259 -10.150 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -8.875 15.003 -9.856 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -8.497 13.982 -11.229 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -8.901 15.945 -12.359 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -10.533 15.306 -12.348 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -10.969 17.414 -11.527 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -10.672 16.588 -10.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -8.873 17.817 -9.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -8.244 17.552 -11.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -9.363 18.802 -10.929 1.00 0.00 H new ATOM 305 N VAL A 22 -12.057 12.163 -7.844 1.00 0.00 N ATOM 306 CA VAL A 22 -13.244 11.415 -7.448 1.00 0.00 C ATOM 307 C VAL A 22 -14.439 12.342 -7.257 1.00 0.00 C ATOM 308 O VAL A 22 -14.280 13.552 -7.094 1.00 0.00 O ATOM 309 CB VAL A 22 -13.004 10.630 -6.144 1.00 0.00 C ATOM 310 CG1 VAL A 22 -11.985 9.523 -6.367 1.00 0.00 C ATOM 311 CG2 VAL A 22 -12.552 11.567 -5.034 1.00 0.00 C ATOM 0 H VAL A 22 -11.817 12.934 -7.221 1.00 0.00 H new ATOM 0 HA VAL A 22 -13.458 10.712 -8.253 1.00 0.00 H new ATOM 0 HB VAL A 22 -13.944 10.169 -5.839 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -11.828 8.980 -5.435 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -12.354 8.837 -7.130 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -11.041 9.958 -6.696 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -12.387 10.996 -4.120 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -11.624 12.058 -5.328 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -13.321 12.320 -4.858 1.00 0.00 H new ATOM 321 N PHE A 23 -15.637 11.766 -7.278 1.00 0.00 N ATOM 322 CA PHE A 23 -16.860 12.541 -7.107 1.00 0.00 C ATOM 323 C PHE A 23 -17.247 12.631 -5.634 1.00 0.00 C ATOM 324 O PHE A 23 -17.159 11.649 -4.896 1.00 0.00 O ATOM 325 CB PHE A 23 -18.003 11.913 -7.908 1.00 0.00 C ATOM 326 CG PHE A 23 -19.089 12.886 -8.266 1.00 0.00 C ATOM 327 CD1 PHE A 23 -18.787 14.079 -8.903 1.00 0.00 C ATOM 328 CD2 PHE A 23 -20.413 12.607 -7.967 1.00 0.00 C ATOM 329 CE1 PHE A 23 -19.786 14.975 -9.233 1.00 0.00 C ATOM 330 CE2 PHE A 23 -21.416 13.500 -8.295 1.00 0.00 C ATOM 331 CZ PHE A 23 -21.102 14.685 -8.930 1.00 0.00 C ATOM 0 H PHE A 23 -15.786 10.766 -7.412 1.00 0.00 H new ATOM 0 HA PHE A 23 -16.675 13.549 -7.478 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -17.599 11.479 -8.823 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -18.434 11.096 -7.330 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -17.760 14.311 -9.144 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -20.664 11.681 -7.472 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -19.538 15.902 -9.728 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -22.444 13.271 -8.055 1.00 0.00 H new ATOM 0 HZ PHE A 23 -21.884 15.384 -9.189 1.00 0.00 H new ATOM 341 N THR A 24 -17.674 13.817 -5.211 1.00 0.00 N ATOM 342 CA THR A 24 -18.072 14.037 -3.827 1.00 0.00 C ATOM 343 C THR A 24 -19.322 13.237 -3.480 1.00 0.00 C ATOM 344 O THR A 24 -20.186 13.018 -4.329 1.00 0.00 O ATOM 345 CB THR A 24 -18.337 15.529 -3.549 1.00 0.00 C ATOM 346 OG1 THR A 24 -18.671 15.719 -2.169 1.00 0.00 O ATOM 347 CG2 THR A 24 -19.466 16.050 -4.425 1.00 0.00 C ATOM 0 H THR A 24 -17.753 14.640 -5.808 1.00 0.00 H new ATOM 0 HA THR A 24 -17.244 13.700 -3.203 1.00 0.00 H new ATOM 0 HB THR A 24 -17.430 16.086 -3.783 1.00 0.00 H new ATOM 0 HG1 THR A 24 -18.836 16.670 -2.000 1.00 0.00 H new ATOM 0 HG21 THR A 24 -19.635 17.105 -4.211 1.00 0.00 H new ATOM 0 HG22 THR A 24 -19.197 15.931 -5.475 1.00 0.00 H new ATOM 0 HG23 THR A 24 -20.376 15.487 -4.218 1.00 0.00 H new ATOM 355 N GLY A 25 -19.413 12.803 -2.227 1.00 0.00 N ATOM 356 CA GLY A 25 -20.563 12.033 -1.790 1.00 0.00 C ATOM 357 C GLY A 25 -20.754 10.767 -2.602 1.00 0.00 C ATOM 358 O GLY A 25 -21.856 10.485 -3.074 1.00 0.00 O ATOM 0 H GLY A 25 -18.711 12.971 -1.506 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -20.444 11.772 -0.738 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -21.459 12.649 -1.866 1.00 0.00 H new ATOM 362 N SER A 26 -19.679 10.003 -2.767 1.00 0.00 N ATOM 363 CA SER A 26 -19.732 8.763 -3.532 1.00 0.00 C ATOM 364 C SER A 26 -18.802 7.714 -2.932 1.00 0.00 C ATOM 365 O SER A 26 -17.801 8.046 -2.297 1.00 0.00 O ATOM 366 CB SER A 26 -19.353 9.023 -4.991 1.00 0.00 C ATOM 367 OG SER A 26 -19.386 7.825 -5.748 1.00 0.00 O ATOM 0 H SER A 26 -18.760 10.221 -2.381 1.00 0.00 H new ATOM 0 HA SER A 26 -20.753 8.383 -3.491 1.00 0.00 H new ATOM 0 HB2 SER A 26 -20.040 9.750 -5.424 1.00 0.00 H new ATOM 0 HB3 SER A 26 -18.355 9.460 -5.039 1.00 0.00 H new ATOM 0 HG SER A 26 -19.142 8.018 -6.677 1.00 0.00 H new ATOM 373 N ALA A 27 -19.140 6.445 -3.138 1.00 0.00 N ATOM 374 CA ALA A 27 -18.335 5.346 -2.619 1.00 0.00 C ATOM 375 C ALA A 27 -17.595 4.630 -3.743 1.00 0.00 C ATOM 376 O ALA A 27 -18.207 3.962 -4.577 1.00 0.00 O ATOM 377 CB ALA A 27 -19.211 4.366 -1.853 1.00 0.00 C ATOM 0 H ALA A 27 -19.966 6.153 -3.661 1.00 0.00 H new ATOM 0 HA ALA A 27 -17.593 5.762 -1.938 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -18.597 3.551 -1.471 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -19.690 4.880 -1.020 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -19.975 3.964 -2.518 1.00 0.00 H new ATOM 383 N HIS A 28 -16.273 4.774 -3.761 1.00 0.00 N ATOM 384 CA HIS A 28 -15.449 4.141 -4.784 1.00 0.00 C ATOM 385 C HIS A 28 -14.946 2.780 -4.311 1.00 0.00 C ATOM 386 O HIS A 28 -14.970 2.480 -3.117 1.00 0.00 O ATOM 387 CB HIS A 28 -14.264 5.038 -5.143 1.00 0.00 C ATOM 388 CG HIS A 28 -14.658 6.290 -5.865 1.00 0.00 C ATOM 389 ND1 HIS A 28 -14.506 6.453 -7.226 1.00 0.00 N ATOM 390 CD2 HIS A 28 -15.202 7.442 -5.409 1.00 0.00 C ATOM 391 CE1 HIS A 28 -14.938 7.651 -7.575 1.00 0.00 C ATOM 392 NE2 HIS A 28 -15.367 8.272 -6.490 1.00 0.00 N ATOM 0 H HIS A 28 -15.750 5.323 -3.079 1.00 0.00 H new ATOM 0 HA HIS A 28 -16.065 3.994 -5.671 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -13.733 5.307 -4.230 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -13.567 4.475 -5.763 1.00 0.00 H new ATOM 0 HD1 HIS A 28 -14.120 5.757 -7.864 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -15.459 7.667 -4.384 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -14.940 8.055 -8.577 1.00 0.00 H new ATOM 400 N CYS A 29 -14.494 1.961 -5.255 1.00 0.00 N ATOM 401 CA CYS A 29 -13.988 0.632 -4.934 1.00 0.00 C ATOM 402 C CYS A 29 -12.553 0.463 -5.425 1.00 0.00 C ATOM 403 O CYS A 29 -12.286 0.528 -6.626 1.00 0.00 O ATOM 404 CB CYS A 29 -14.882 -0.441 -5.557 1.00 0.00 C ATOM 405 SG CYS A 29 -14.962 -0.379 -7.362 1.00 0.00 S ATOM 0 H CYS A 29 -14.468 2.194 -6.248 1.00 0.00 H new ATOM 0 HA CYS A 29 -13.998 0.519 -3.850 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -14.518 -1.423 -5.254 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -15.890 -0.337 -5.156 1.00 0.00 H new ATOM 0 HG CYS A 29 -13.835 0.067 -7.831 1.00 0.00 H new ATOM 411 N TYR A 30 -11.635 0.249 -4.490 1.00 0.00 N ATOM 412 CA TYR A 30 -10.227 0.076 -4.827 1.00 0.00 C ATOM 413 C TYR A 30 -9.685 -1.227 -4.249 1.00 0.00 C ATOM 414 O TYR A 30 -10.203 -1.742 -3.259 1.00 0.00 O ATOM 415 CB TYR A 30 -9.407 1.258 -4.307 1.00 0.00 C ATOM 416 CG TYR A 30 -9.907 2.601 -4.790 1.00 0.00 C ATOM 417 CD1 TYR A 30 -10.058 2.861 -6.146 1.00 0.00 C ATOM 418 CD2 TYR A 30 -10.228 3.609 -3.889 1.00 0.00 C ATOM 419 CE1 TYR A 30 -10.513 4.087 -6.592 1.00 0.00 C ATOM 420 CE2 TYR A 30 -10.686 4.837 -4.326 1.00 0.00 C ATOM 421 CZ TYR A 30 -10.826 5.072 -5.678 1.00 0.00 C ATOM 422 OH TYR A 30 -11.281 6.293 -6.118 1.00 0.00 O ATOM 0 H TYR A 30 -11.840 0.191 -3.493 1.00 0.00 H new ATOM 0 HA TYR A 30 -10.142 0.034 -5.913 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -9.419 1.246 -3.217 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -8.369 1.133 -4.616 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -9.816 2.092 -6.864 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -10.118 3.430 -2.830 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -10.623 4.273 -7.650 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -10.933 5.609 -3.613 1.00 0.00 H new ATOM 0 HH TYR A 30 -11.679 6.783 -5.369 1.00 0.00 H new ATOM 432 N GLU A 31 -8.637 -1.755 -4.875 1.00 0.00 N ATOM 433 CA GLU A 31 -8.024 -2.998 -4.423 1.00 0.00 C ATOM 434 C GLU A 31 -6.534 -2.805 -4.156 1.00 0.00 C ATOM 435 O GLU A 31 -5.829 -2.172 -4.942 1.00 0.00 O ATOM 436 CB GLU A 31 -8.228 -4.101 -5.464 1.00 0.00 C ATOM 437 CG GLU A 31 -7.926 -5.495 -4.941 1.00 0.00 C ATOM 438 CD GLU A 31 -8.096 -6.566 -6.001 1.00 0.00 C ATOM 439 OE1 GLU A 31 -7.286 -6.593 -6.951 1.00 0.00 O ATOM 440 OE2 GLU A 31 -9.039 -7.376 -5.881 1.00 0.00 O ATOM 0 H GLU A 31 -8.196 -1.341 -5.696 1.00 0.00 H new ATOM 0 HA GLU A 31 -8.507 -3.293 -3.491 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -9.259 -4.070 -5.817 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -7.590 -3.899 -6.325 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -6.904 -5.523 -4.562 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -8.584 -5.714 -4.100 1.00 0.00 H new ATOM 447 N ALA A 32 -6.063 -3.353 -3.041 1.00 0.00 N ATOM 448 CA ALA A 32 -4.658 -3.242 -2.670 1.00 0.00 C ATOM 449 C ALA A 32 -4.082 -4.602 -2.290 1.00 0.00 C ATOM 450 O ALA A 32 -4.457 -5.183 -1.271 1.00 0.00 O ATOM 451 CB ALA A 32 -4.490 -2.257 -1.523 1.00 0.00 C ATOM 0 H ALA A 32 -6.634 -3.878 -2.379 1.00 0.00 H new ATOM 0 HA ALA A 32 -4.108 -2.872 -3.535 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -3.435 -2.185 -1.257 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -4.855 -1.277 -1.829 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -5.059 -2.603 -0.660 1.00 0.00 H new ATOM 457 N ILE A 33 -3.169 -5.104 -3.115 1.00 0.00 N ATOM 458 CA ILE A 33 -2.542 -6.396 -2.864 1.00 0.00 C ATOM 459 C ILE A 33 -1.303 -6.245 -1.988 1.00 0.00 C ATOM 460 O ILE A 33 -0.535 -5.294 -2.139 1.00 0.00 O ATOM 461 CB ILE A 33 -2.144 -7.093 -4.179 1.00 0.00 C ATOM 462 CG1 ILE A 33 -3.192 -6.825 -5.261 1.00 0.00 C ATOM 463 CG2 ILE A 33 -1.977 -8.589 -3.955 1.00 0.00 C ATOM 464 CD1 ILE A 33 -4.607 -7.130 -4.822 1.00 0.00 C ATOM 0 H ILE A 33 -2.847 -4.636 -3.962 1.00 0.00 H new ATOM 0 HA ILE A 33 -3.279 -7.009 -2.345 1.00 0.00 H new ATOM 0 HB ILE A 33 -1.190 -6.686 -4.515 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -3.131 -5.779 -5.563 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -2.956 -7.425 -6.140 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -1.696 -9.068 -4.893 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -1.198 -8.761 -3.212 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -2.917 -9.011 -3.600 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -5.296 -6.916 -5.640 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -4.684 -8.182 -4.548 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -4.862 -6.511 -3.962 1.00 0.00 H new ATOM 476 N LEU A 34 -1.115 -7.188 -1.072 1.00 0.00 N ATOM 477 CA LEU A 34 0.032 -7.162 -0.171 1.00 0.00 C ATOM 478 C LEU A 34 0.797 -8.481 -0.223 1.00 0.00 C ATOM 479 O LEU A 34 0.302 -9.515 0.226 1.00 0.00 O ATOM 480 CB LEU A 34 -0.426 -6.881 1.261 1.00 0.00 C ATOM 481 CG LEU A 34 0.673 -6.505 2.256 1.00 0.00 C ATOM 482 CD1 LEU A 34 1.098 -5.058 2.061 1.00 0.00 C ATOM 483 CD2 LEU A 34 0.202 -6.737 3.684 1.00 0.00 C ATOM 0 H LEU A 34 -1.742 -7.980 -0.933 1.00 0.00 H new ATOM 0 HA LEU A 34 0.699 -6.364 -0.496 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -1.157 -6.073 1.235 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -0.941 -7.765 1.636 1.00 0.00 H new ATOM 0 HG LEU A 34 1.537 -7.143 2.072 1.00 0.00 H new ATOM 0 HD11 LEU A 34 1.880 -4.809 2.778 1.00 0.00 H new ATOM 0 HD12 LEU A 34 1.478 -4.924 1.048 1.00 0.00 H new ATOM 0 HD13 LEU A 34 0.241 -4.403 2.217 1.00 0.00 H new ATOM 0 HD21 LEU A 34 0.997 -6.464 4.378 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -0.678 -6.125 3.881 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -0.051 -7.789 3.817 1.00 0.00 H new ATOM 495 N TYR A 35 2.005 -8.436 -0.773 1.00 0.00 N ATOM 496 CA TYR A 35 2.838 -9.628 -0.884 1.00 0.00 C ATOM 497 C TYR A 35 3.646 -9.849 0.391 1.00 0.00 C ATOM 498 O TYR A 35 4.443 -9.001 0.789 1.00 0.00 O ATOM 499 CB TYR A 35 3.781 -9.507 -2.083 1.00 0.00 C ATOM 500 CG TYR A 35 3.065 -9.472 -3.414 1.00 0.00 C ATOM 501 CD1 TYR A 35 2.195 -8.436 -3.731 1.00 0.00 C ATOM 502 CD2 TYR A 35 3.258 -10.476 -4.356 1.00 0.00 C ATOM 503 CE1 TYR A 35 1.538 -8.401 -4.946 1.00 0.00 C ATOM 504 CE2 TYR A 35 2.607 -10.448 -5.574 1.00 0.00 C ATOM 505 CZ TYR A 35 1.748 -9.408 -5.864 1.00 0.00 C ATOM 506 OH TYR A 35 1.097 -9.377 -7.076 1.00 0.00 O ATOM 0 H TYR A 35 2.429 -7.588 -1.149 1.00 0.00 H new ATOM 0 HA TYR A 35 2.182 -10.486 -1.030 1.00 0.00 H new ATOM 0 HB2 TYR A 35 4.377 -8.600 -1.976 1.00 0.00 H new ATOM 0 HB3 TYR A 35 4.475 -10.347 -2.075 1.00 0.00 H new ATOM 0 HD1 TYR A 35 2.029 -7.644 -3.015 1.00 0.00 H new ATOM 0 HD2 TYR A 35 3.929 -11.292 -4.132 1.00 0.00 H new ATOM 0 HE1 TYR A 35 0.864 -7.589 -5.175 1.00 0.00 H new ATOM 0 HE2 TYR A 35 2.769 -11.236 -6.295 1.00 0.00 H new ATOM 0 HH TYR A 35 1.356 -10.159 -7.607 1.00 0.00 H new ATOM 516 N ASN A 36 3.432 -10.997 1.027 1.00 0.00 N ATOM 517 CA ASN A 36 4.139 -11.331 2.258 1.00 0.00 C ATOM 518 C ASN A 36 5.504 -11.943 1.952 1.00 0.00 C ATOM 519 O ASN A 36 5.598 -12.991 1.314 1.00 0.00 O ATOM 520 CB ASN A 36 3.310 -12.303 3.099 1.00 0.00 C ATOM 521 CG ASN A 36 4.033 -12.741 4.359 1.00 0.00 C ATOM 522 OD1 ASN A 36 4.739 -11.953 4.988 1.00 0.00 O ATOM 523 ND2 ASN A 36 3.859 -14.003 4.732 1.00 0.00 N ATOM 0 H ASN A 36 2.775 -11.710 0.710 1.00 0.00 H new ATOM 0 HA ASN A 36 4.290 -10.411 2.822 1.00 0.00 H new ATOM 0 HB2 ASN A 36 2.366 -11.830 3.371 1.00 0.00 H new ATOM 0 HB3 ASN A 36 3.066 -13.180 2.500 1.00 0.00 H new ATOM 0 HD21 ASN A 36 4.320 -14.355 5.571 1.00 0.00 H new ATOM 0 HD22 ASN A 36 3.264 -14.621 4.180 1.00 0.00 H new ATOM 530 N LYS A 37 6.559 -11.280 2.413 1.00 0.00 N ATOM 531 CA LYS A 37 7.919 -11.757 2.192 1.00 0.00 C ATOM 532 C LYS A 37 8.471 -12.428 3.446 1.00 0.00 C ATOM 533 O LYS A 37 9.639 -12.253 3.792 1.00 0.00 O ATOM 534 CB LYS A 37 8.828 -10.598 1.778 1.00 0.00 C ATOM 535 CG LYS A 37 8.216 -9.692 0.724 1.00 0.00 C ATOM 536 CD LYS A 37 8.397 -10.262 -0.673 1.00 0.00 C ATOM 537 CE LYS A 37 7.249 -11.185 -1.052 1.00 0.00 C ATOM 538 NZ LYS A 37 7.680 -12.242 -2.009 1.00 0.00 N ATOM 0 H LYS A 37 6.498 -10.410 2.942 1.00 0.00 H new ATOM 0 HA LYS A 37 7.893 -12.494 1.389 1.00 0.00 H new ATOM 0 HB2 LYS A 37 9.070 -10.004 2.659 1.00 0.00 H new ATOM 0 HB3 LYS A 37 9.767 -11.001 1.398 1.00 0.00 H new ATOM 0 HG2 LYS A 37 7.154 -9.559 0.929 1.00 0.00 H new ATOM 0 HG3 LYS A 37 8.677 -8.706 0.778 1.00 0.00 H new ATOM 0 HD2 LYS A 37 8.463 -9.447 -1.394 1.00 0.00 H new ATOM 0 HD3 LYS A 37 9.338 -10.810 -0.724 1.00 0.00 H new ATOM 0 HE2 LYS A 37 6.846 -11.651 -0.153 1.00 0.00 H new ATOM 0 HE3 LYS A 37 6.444 -10.600 -1.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 6.869 -12.850 -2.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 8.041 -11.798 -2.877 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 8.431 -12.817 -1.576 1.00 0.00 H new ATOM 552 N GLY A 38 7.623 -13.196 4.123 1.00 0.00 N ATOM 553 CA GLY A 38 8.046 -13.882 5.330 1.00 0.00 C ATOM 554 C GLY A 38 8.200 -15.376 5.125 1.00 0.00 C ATOM 555 O GLY A 38 7.581 -15.954 4.231 1.00 0.00 O ATOM 0 H GLY A 38 6.651 -13.355 3.857 1.00 0.00 H new ATOM 0 HA2 GLY A 38 8.995 -13.465 5.667 1.00 0.00 H new ATOM 0 HA3 GLY A 38 7.319 -13.700 6.121 1.00 0.00 H new ATOM 559 N SER A 39 9.030 -16.003 5.953 1.00 0.00 N ATOM 560 CA SER A 39 9.268 -17.438 5.854 1.00 0.00 C ATOM 561 C SER A 39 8.047 -18.225 6.322 1.00 0.00 C ATOM 562 O SER A 39 7.793 -19.334 5.852 1.00 0.00 O ATOM 563 CB SER A 39 10.492 -17.832 6.684 1.00 0.00 C ATOM 564 OG SER A 39 10.962 -19.118 6.320 1.00 0.00 O ATOM 0 H SER A 39 9.548 -15.540 6.699 1.00 0.00 H new ATOM 0 HA SER A 39 9.455 -17.679 4.807 1.00 0.00 H new ATOM 0 HB2 SER A 39 11.285 -17.098 6.540 1.00 0.00 H new ATOM 0 HB3 SER A 39 10.236 -17.821 7.743 1.00 0.00 H new ATOM 0 HG SER A 39 11.745 -19.346 6.863 1.00 0.00 H new ATOM 570 N ILE A 40 7.297 -17.643 7.251 1.00 0.00 N ATOM 571 CA ILE A 40 6.103 -18.288 7.782 1.00 0.00 C ATOM 572 C ILE A 40 4.947 -17.299 7.894 1.00 0.00 C ATOM 573 O ILE A 40 5.127 -16.095 7.710 1.00 0.00 O ATOM 574 CB ILE A 40 6.367 -18.910 9.166 1.00 0.00 C ATOM 575 CG1 ILE A 40 6.735 -17.822 10.177 1.00 0.00 C ATOM 576 CG2 ILE A 40 7.473 -19.952 9.076 1.00 0.00 C ATOM 577 CD1 ILE A 40 6.502 -18.229 11.615 1.00 0.00 C ATOM 0 H ILE A 40 7.495 -16.726 7.652 1.00 0.00 H new ATOM 0 HA ILE A 40 5.835 -19.079 7.082 1.00 0.00 H new ATOM 0 HB ILE A 40 5.456 -19.403 9.506 1.00 0.00 H new ATOM 0 HG12 ILE A 40 7.785 -17.558 10.048 1.00 0.00 H new ATOM 0 HG13 ILE A 40 6.152 -16.926 9.963 1.00 0.00 H new ATOM 0 HG21 ILE A 40 7.648 -20.383 10.062 1.00 0.00 H new ATOM 0 HG22 ILE A 40 7.175 -20.740 8.384 1.00 0.00 H new ATOM 0 HG23 ILE A 40 8.388 -19.481 8.718 1.00 0.00 H new ATOM 0 HD11 ILE A 40 6.785 -17.409 12.276 1.00 0.00 H new ATOM 0 HD12 ILE A 40 5.448 -18.465 11.760 1.00 0.00 H new ATOM 0 HD13 ILE A 40 7.105 -19.107 11.847 1.00 0.00 H new ATOM 589 N ASP A 41 3.762 -17.815 8.200 1.00 0.00 N ATOM 590 CA ASP A 41 2.576 -16.978 8.340 1.00 0.00 C ATOM 591 C ASP A 41 2.925 -15.649 9.004 1.00 0.00 C ATOM 592 O ASP A 41 3.713 -15.604 9.948 1.00 0.00 O ATOM 593 CB ASP A 41 1.506 -17.704 9.156 1.00 0.00 C ATOM 594 CG ASP A 41 2.102 -18.630 10.199 1.00 0.00 C ATOM 595 OD1 ASP A 41 2.746 -18.125 11.142 1.00 0.00 O ATOM 596 OD2 ASP A 41 1.924 -19.859 10.071 1.00 0.00 O ATOM 0 H ASP A 41 3.597 -18.809 8.356 1.00 0.00 H new ATOM 0 HA ASP A 41 2.185 -16.775 7.343 1.00 0.00 H new ATOM 0 HB2 ASP A 41 0.868 -16.970 9.648 1.00 0.00 H new ATOM 0 HB3 ASP A 41 0.869 -18.280 8.484 1.00 0.00 H new ATOM 601 N ALA A 42 2.334 -14.570 8.502 1.00 0.00 N ATOM 602 CA ALA A 42 2.582 -13.241 9.046 1.00 0.00 C ATOM 603 C ALA A 42 1.280 -12.573 9.478 1.00 0.00 C ATOM 604 O ALA A 42 0.316 -12.515 8.713 1.00 0.00 O ATOM 605 CB ALA A 42 3.305 -12.377 8.023 1.00 0.00 C ATOM 0 H ALA A 42 1.680 -14.590 7.719 1.00 0.00 H new ATOM 0 HA ALA A 42 3.215 -13.349 9.927 1.00 0.00 H new ATOM 0 HB1 ALA A 42 3.483 -11.387 8.444 1.00 0.00 H new ATOM 0 HB2 ALA A 42 4.258 -12.839 7.765 1.00 0.00 H new ATOM 0 HB3 ALA A 42 2.692 -12.285 7.126 1.00 0.00 H new ATOM 611 N LEU A 43 1.258 -12.072 10.708 1.00 0.00 N ATOM 612 CA LEU A 43 0.074 -11.408 11.243 1.00 0.00 C ATOM 613 C LEU A 43 0.082 -9.922 10.902 1.00 0.00 C ATOM 614 O LEU A 43 0.910 -9.163 11.405 1.00 0.00 O ATOM 615 CB LEU A 43 0.001 -11.595 12.759 1.00 0.00 C ATOM 616 CG LEU A 43 -0.278 -13.017 13.248 1.00 0.00 C ATOM 617 CD1 LEU A 43 1.000 -13.841 13.251 1.00 0.00 C ATOM 618 CD2 LEU A 43 -0.902 -12.991 14.636 1.00 0.00 C ATOM 0 H LEU A 43 2.046 -12.113 11.354 1.00 0.00 H new ATOM 0 HA LEU A 43 -0.805 -11.862 10.785 1.00 0.00 H new ATOM 0 HB2 LEU A 43 0.944 -11.262 13.192 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -0.777 -10.939 13.149 1.00 0.00 H new ATOM 0 HG LEU A 43 -0.985 -13.484 12.563 1.00 0.00 H new ATOM 0 HD11 LEU A 43 0.782 -14.850 13.602 1.00 0.00 H new ATOM 0 HD12 LEU A 43 1.405 -13.888 12.240 1.00 0.00 H new ATOM 0 HD13 LEU A 43 1.731 -13.377 13.913 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -1.094 -14.011 14.968 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -0.219 -12.505 15.333 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -1.841 -12.438 14.603 1.00 0.00 H new ATOM 630 N PHE A 44 -0.848 -9.511 10.045 1.00 0.00 N ATOM 631 CA PHE A 44 -0.949 -8.115 9.637 1.00 0.00 C ATOM 632 C PHE A 44 -2.238 -7.488 10.161 1.00 0.00 C ATOM 633 O PHE A 44 -3.253 -8.165 10.311 1.00 0.00 O ATOM 634 CB PHE A 44 -0.895 -8.001 8.113 1.00 0.00 C ATOM 635 CG PHE A 44 -2.169 -8.419 7.435 1.00 0.00 C ATOM 636 CD1 PHE A 44 -2.440 -9.758 7.205 1.00 0.00 C ATOM 637 CD2 PHE A 44 -3.096 -7.472 7.029 1.00 0.00 C ATOM 638 CE1 PHE A 44 -3.612 -10.146 6.582 1.00 0.00 C ATOM 639 CE2 PHE A 44 -4.269 -7.854 6.406 1.00 0.00 C ATOM 640 CZ PHE A 44 -4.527 -9.192 6.182 1.00 0.00 C ATOM 0 H PHE A 44 -1.542 -10.126 9.620 1.00 0.00 H new ATOM 0 HA PHE A 44 -0.103 -7.575 10.064 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -0.670 -6.970 7.842 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -0.076 -8.615 7.739 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -1.727 -10.508 7.516 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -2.900 -6.424 7.201 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -3.811 -11.193 6.409 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -4.984 -7.106 6.094 1.00 0.00 H new ATOM 0 HZ PHE A 44 -5.443 -9.492 5.695 1.00 0.00 H new ATOM 650 N ASN A 45 -2.187 -6.189 10.437 1.00 0.00 N ATOM 651 CA ASN A 45 -3.349 -5.469 10.944 1.00 0.00 C ATOM 652 C ASN A 45 -3.337 -4.017 10.477 1.00 0.00 C ATOM 653 O ASN A 45 -2.275 -3.421 10.299 1.00 0.00 O ATOM 654 CB ASN A 45 -3.382 -5.524 12.473 1.00 0.00 C ATOM 655 CG ASN A 45 -4.602 -4.834 13.051 1.00 0.00 C ATOM 656 OD1 ASN A 45 -5.640 -4.733 12.396 1.00 0.00 O ATOM 657 ND2 ASN A 45 -4.482 -4.353 14.283 1.00 0.00 N ATOM 0 H ASN A 45 -1.353 -5.614 10.318 1.00 0.00 H new ATOM 0 HA ASN A 45 -4.244 -5.951 10.550 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -3.369 -6.565 12.797 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -2.481 -5.056 12.870 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -5.269 -3.877 14.724 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -3.603 -4.460 14.789 1.00 0.00 H new ATOM 664 N MET A 46 -4.525 -3.454 10.281 1.00 0.00 N ATOM 665 CA MET A 46 -4.650 -2.070 9.836 1.00 0.00 C ATOM 666 C MET A 46 -4.997 -1.153 11.005 1.00 0.00 C ATOM 667 O MET A 46 -5.848 -1.480 11.833 1.00 0.00 O ATOM 668 CB MET A 46 -5.720 -1.957 8.749 1.00 0.00 C ATOM 669 CG MET A 46 -5.538 -2.949 7.611 1.00 0.00 C ATOM 670 SD MET A 46 -4.069 -2.609 6.622 1.00 0.00 S ATOM 671 CE MET A 46 -4.279 -0.860 6.295 1.00 0.00 C ATOM 0 H MET A 46 -5.414 -3.934 10.423 1.00 0.00 H new ATOM 0 HA MET A 46 -3.690 -1.758 9.425 1.00 0.00 H new ATOM 0 HB2 MET A 46 -6.701 -2.109 9.199 1.00 0.00 H new ATOM 0 HB3 MET A 46 -5.709 -0.945 8.343 1.00 0.00 H new ATOM 0 HG2 MET A 46 -5.471 -3.957 8.020 1.00 0.00 H new ATOM 0 HG3 MET A 46 -6.418 -2.924 6.968 1.00 0.00 H new ATOM 0 HE1 MET A 46 -3.873 -0.622 5.312 1.00 0.00 H new ATOM 0 HE2 MET A 46 -5.340 -0.610 6.320 1.00 0.00 H new ATOM 0 HE3 MET A 46 -3.752 -0.282 7.054 1.00 0.00 H new ATOM 681 N THR A 47 -4.333 -0.003 11.066 1.00 0.00 N ATOM 682 CA THR A 47 -4.570 0.960 12.134 1.00 0.00 C ATOM 683 C THR A 47 -5.415 2.130 11.641 1.00 0.00 C ATOM 684 O THR A 47 -5.234 2.634 10.533 1.00 0.00 O ATOM 685 CB THR A 47 -3.247 1.503 12.705 1.00 0.00 C ATOM 686 OG1 THR A 47 -2.491 0.435 13.289 1.00 0.00 O ATOM 687 CG2 THR A 47 -3.509 2.576 13.751 1.00 0.00 C ATOM 0 H THR A 47 -3.627 0.284 10.388 1.00 0.00 H new ATOM 0 HA THR A 47 -5.108 0.432 12.922 1.00 0.00 H new ATOM 0 HB THR A 47 -2.678 1.946 11.887 1.00 0.00 H new ATOM 0 HG1 THR A 47 -1.650 0.788 13.648 1.00 0.00 H new ATOM 0 HG21 THR A 47 -2.560 2.944 14.140 1.00 0.00 H new ATOM 0 HG22 THR A 47 -4.059 3.400 13.297 1.00 0.00 H new ATOM 0 HG23 THR A 47 -4.096 2.153 14.567 1.00 0.00 H new ATOM 695 N PRO A 48 -6.361 2.573 12.483 1.00 0.00 N ATOM 696 CA PRO A 48 -7.252 3.690 12.154 1.00 0.00 C ATOM 697 C PRO A 48 -6.518 5.026 12.119 1.00 0.00 C ATOM 698 O PRO A 48 -5.711 5.342 12.994 1.00 0.00 O ATOM 699 CB PRO A 48 -8.276 3.673 13.291 1.00 0.00 C ATOM 700 CG PRO A 48 -7.567 3.027 14.431 1.00 0.00 C ATOM 701 CD PRO A 48 -6.633 2.019 13.820 1.00 0.00 C ATOM 0 HA PRO A 48 -7.693 3.582 11.163 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -8.600 4.682 13.547 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -9.168 3.113 13.012 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -7.017 3.764 15.017 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -8.273 2.545 15.107 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -5.719 1.912 14.404 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -7.091 1.031 13.760 1.00 0.00 H new ATOM 709 N PRO A 49 -6.803 5.832 11.085 1.00 0.00 N ATOM 710 CA PRO A 49 -6.180 7.148 10.912 1.00 0.00 C ATOM 711 C PRO A 49 -6.655 8.155 11.953 1.00 0.00 C ATOM 712 O PRO A 49 -7.449 7.825 12.835 1.00 0.00 O ATOM 713 CB PRO A 49 -6.632 7.572 9.512 1.00 0.00 C ATOM 714 CG PRO A 49 -7.904 6.830 9.283 1.00 0.00 C ATOM 715 CD PRO A 49 -7.754 5.520 10.005 1.00 0.00 C ATOM 0 HA PRO A 49 -5.097 7.106 11.031 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -6.787 8.649 9.455 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -5.884 7.317 8.761 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -8.757 7.391 9.665 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -8.077 6.672 8.219 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -8.707 5.167 10.399 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -7.372 4.740 9.347 1.00 0.00 H new ATOM 723 N THR A 50 -6.165 9.386 11.847 1.00 0.00 N ATOM 724 CA THR A 50 -6.538 10.441 12.780 1.00 0.00 C ATOM 725 C THR A 50 -7.204 11.606 12.055 1.00 0.00 C ATOM 726 O THR A 50 -8.010 12.332 12.636 1.00 0.00 O ATOM 727 CB THR A 50 -5.315 10.966 13.554 1.00 0.00 C ATOM 728 OG1 THR A 50 -4.343 11.487 12.641 1.00 0.00 O ATOM 729 CG2 THR A 50 -4.689 9.860 14.391 1.00 0.00 C ATOM 0 H THR A 50 -5.508 9.677 11.123 1.00 0.00 H new ATOM 0 HA THR A 50 -7.244 10.003 13.485 1.00 0.00 H new ATOM 0 HB THR A 50 -5.649 11.761 14.221 1.00 0.00 H new ATOM 0 HG1 THR A 50 -3.569 11.820 13.142 1.00 0.00 H new ATOM 0 HG21 THR A 50 -3.827 10.254 14.929 1.00 0.00 H new ATOM 0 HG22 THR A 50 -5.422 9.485 15.105 1.00 0.00 H new ATOM 0 HG23 THR A 50 -4.369 9.047 13.739 1.00 0.00 H new ATOM 737 N SER A 51 -6.862 11.778 10.782 1.00 0.00 N ATOM 738 CA SER A 51 -7.424 12.857 9.978 1.00 0.00 C ATOM 739 C SER A 51 -8.856 12.535 9.563 1.00 0.00 C ATOM 740 O SER A 51 -9.295 11.388 9.643 1.00 0.00 O ATOM 741 CB SER A 51 -6.563 13.099 8.737 1.00 0.00 C ATOM 742 OG SER A 51 -5.373 13.792 9.069 1.00 0.00 O ATOM 0 H SER A 51 -6.198 11.184 10.285 1.00 0.00 H new ATOM 0 HA SER A 51 -7.435 13.762 10.585 1.00 0.00 H new ATOM 0 HB2 SER A 51 -6.314 12.145 8.272 1.00 0.00 H new ATOM 0 HB3 SER A 51 -7.129 13.673 8.004 1.00 0.00 H new ATOM 0 HG SER A 51 -4.840 13.933 8.259 1.00 0.00 H new ATOM 748 N ALA A 52 -9.581 13.557 9.119 1.00 0.00 N ATOM 749 CA ALA A 52 -10.963 13.384 8.689 1.00 0.00 C ATOM 750 C ALA A 52 -11.042 12.536 7.423 1.00 0.00 C ATOM 751 O ALA A 52 -11.870 11.630 7.322 1.00 0.00 O ATOM 752 CB ALA A 52 -11.618 14.738 8.461 1.00 0.00 C ATOM 0 H ALA A 52 -9.234 14.513 9.048 1.00 0.00 H new ATOM 0 HA ALA A 52 -11.501 12.861 9.480 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -12.650 14.594 8.140 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -11.603 15.310 9.389 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -11.071 15.282 7.691 1.00 0.00 H new ATOM 758 N LEU A 53 -10.176 12.836 6.461 1.00 0.00 N ATOM 759 CA LEU A 53 -10.149 12.101 5.201 1.00 0.00 C ATOM 760 C LEU A 53 -9.745 10.648 5.427 1.00 0.00 C ATOM 761 O LEU A 53 -10.403 9.728 4.944 1.00 0.00 O ATOM 762 CB LEU A 53 -9.179 12.766 4.222 1.00 0.00 C ATOM 763 CG LEU A 53 -9.763 13.878 3.351 1.00 0.00 C ATOM 764 CD1 LEU A 53 -10.855 13.330 2.445 1.00 0.00 C ATOM 765 CD2 LEU A 53 -10.302 15.007 4.217 1.00 0.00 C ATOM 0 H LEU A 53 -9.484 13.582 6.529 1.00 0.00 H new ATOM 0 HA LEU A 53 -11.153 12.117 4.777 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -8.345 13.177 4.791 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -8.770 11.996 3.568 1.00 0.00 H new ATOM 0 HG LEU A 53 -8.966 14.277 2.724 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -11.259 14.136 1.833 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -10.438 12.558 1.799 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -11.652 12.903 3.053 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -10.714 15.790 3.580 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -11.085 14.622 4.871 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -9.494 15.419 4.822 1.00 0.00 H new ATOM 777 N GLY A 54 -8.658 10.449 6.167 1.00 0.00 N ATOM 778 CA GLY A 54 -8.187 9.105 6.446 1.00 0.00 C ATOM 779 C GLY A 54 -9.287 8.200 6.964 1.00 0.00 C ATOM 780 O GLY A 54 -9.503 7.110 6.436 1.00 0.00 O ATOM 0 H GLY A 54 -8.096 11.194 6.578 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -7.765 8.675 5.537 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -7.383 9.151 7.180 1.00 0.00 H new ATOM 784 N ALA A 55 -9.984 8.652 8.001 1.00 0.00 N ATOM 785 CA ALA A 55 -11.067 7.876 8.591 1.00 0.00 C ATOM 786 C ALA A 55 -11.984 7.307 7.513 1.00 0.00 C ATOM 787 O ALA A 55 -12.259 6.107 7.489 1.00 0.00 O ATOM 788 CB ALA A 55 -11.862 8.734 9.564 1.00 0.00 C ATOM 0 H ALA A 55 -9.818 9.553 8.450 1.00 0.00 H new ATOM 0 HA ALA A 55 -10.628 7.041 9.136 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -12.668 8.141 9.997 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -11.205 9.088 10.358 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -12.284 9.588 9.035 1.00 0.00 H new ATOM 794 N CYS A 56 -12.455 8.176 6.625 1.00 0.00 N ATOM 795 CA CYS A 56 -13.343 7.760 5.545 1.00 0.00 C ATOM 796 C CYS A 56 -12.909 6.415 4.972 1.00 0.00 C ATOM 797 O CYS A 56 -13.677 5.452 4.970 1.00 0.00 O ATOM 798 CB CYS A 56 -13.364 8.816 4.439 1.00 0.00 C ATOM 799 SG CYS A 56 -14.111 10.387 4.932 1.00 0.00 S ATOM 0 H CYS A 56 -12.237 9.172 6.632 1.00 0.00 H new ATOM 0 HA CYS A 56 -14.347 7.653 5.954 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -12.342 9.000 4.108 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -13.910 8.419 3.583 1.00 0.00 H new ATOM 0 HG CYS A 56 -15.222 10.562 4.281 1.00 0.00 H new ATOM 805 N PHE A 57 -11.674 6.355 4.485 1.00 0.00 N ATOM 806 CA PHE A 57 -11.138 5.129 3.907 1.00 0.00 C ATOM 807 C PHE A 57 -11.406 3.935 4.819 1.00 0.00 C ATOM 808 O PHE A 57 -11.270 4.029 6.039 1.00 0.00 O ATOM 809 CB PHE A 57 -9.634 5.270 3.661 1.00 0.00 C ATOM 810 CG PHE A 57 -9.298 6.149 2.490 1.00 0.00 C ATOM 811 CD1 PHE A 57 -9.348 7.528 2.606 1.00 0.00 C ATOM 812 CD2 PHE A 57 -8.932 5.595 1.274 1.00 0.00 C ATOM 813 CE1 PHE A 57 -9.040 8.339 1.530 1.00 0.00 C ATOM 814 CE2 PHE A 57 -8.622 6.401 0.195 1.00 0.00 C ATOM 815 CZ PHE A 57 -8.675 7.775 0.323 1.00 0.00 C ATOM 0 H PHE A 57 -11.025 7.142 4.479 1.00 0.00 H new ATOM 0 HA PHE A 57 -11.640 4.957 2.955 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -9.164 5.676 4.557 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -9.206 4.281 3.497 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -9.631 7.975 3.548 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -8.888 4.521 1.168 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -9.085 9.413 1.633 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -8.338 5.957 -0.748 1.00 0.00 H new ATOM 0 HZ PHE A 57 -8.432 8.407 -0.518 1.00 0.00 H new ATOM 825 N VAL A 58 -11.788 2.812 4.218 1.00 0.00 N ATOM 826 CA VAL A 58 -12.075 1.600 4.974 1.00 0.00 C ATOM 827 C VAL A 58 -11.210 0.438 4.498 1.00 0.00 C ATOM 828 O VAL A 58 -11.415 -0.097 3.408 1.00 0.00 O ATOM 829 CB VAL A 58 -13.559 1.203 4.857 1.00 0.00 C ATOM 830 CG1 VAL A 58 -13.817 -0.114 5.573 1.00 0.00 C ATOM 831 CG2 VAL A 58 -14.450 2.304 5.411 1.00 0.00 C ATOM 0 H VAL A 58 -11.906 2.717 3.209 1.00 0.00 H new ATOM 0 HA VAL A 58 -11.846 1.816 6.018 1.00 0.00 H new ATOM 0 HB VAL A 58 -13.800 1.069 3.802 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -14.870 -0.379 5.480 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -13.205 -0.897 5.126 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -13.561 -0.011 6.627 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -15.495 2.007 5.320 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -14.210 2.472 6.461 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -14.284 3.223 4.849 1.00 0.00 H new ATOM 841 N PHE A 59 -10.243 0.050 5.323 1.00 0.00 N ATOM 842 CA PHE A 59 -9.346 -1.049 4.987 1.00 0.00 C ATOM 843 C PHE A 59 -9.780 -2.337 5.681 1.00 0.00 C ATOM 844 O PHE A 59 -9.988 -2.361 6.894 1.00 0.00 O ATOM 845 CB PHE A 59 -7.909 -0.702 5.382 1.00 0.00 C ATOM 846 CG PHE A 59 -7.190 0.129 4.358 1.00 0.00 C ATOM 847 CD1 PHE A 59 -7.371 1.502 4.311 1.00 0.00 C ATOM 848 CD2 PHE A 59 -6.333 -0.462 3.444 1.00 0.00 C ATOM 849 CE1 PHE A 59 -6.711 2.269 3.369 1.00 0.00 C ATOM 850 CE2 PHE A 59 -5.670 0.300 2.501 1.00 0.00 C ATOM 851 CZ PHE A 59 -5.859 1.668 2.464 1.00 0.00 C ATOM 0 H PHE A 59 -10.061 0.481 6.229 1.00 0.00 H new ATOM 0 HA PHE A 59 -9.391 -1.205 3.909 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -7.921 -0.165 6.331 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -7.353 -1.625 5.545 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -8.035 1.978 5.018 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -6.181 -1.531 3.469 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -6.862 3.338 3.341 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -5.005 -0.173 1.794 1.00 0.00 H new ATOM 0 HZ PHE A 59 -5.341 2.266 1.729 1.00 0.00 H new ATOM 861 N SER A 60 -9.913 -3.406 4.903 1.00 0.00 N ATOM 862 CA SER A 60 -10.326 -4.697 5.441 1.00 0.00 C ATOM 863 C SER A 60 -9.699 -5.841 4.650 1.00 0.00 C ATOM 864 O SER A 60 -9.269 -5.677 3.508 1.00 0.00 O ATOM 865 CB SER A 60 -11.851 -4.819 5.416 1.00 0.00 C ATOM 866 OG SER A 60 -12.423 -4.316 6.611 1.00 0.00 O ATOM 0 H SER A 60 -9.741 -3.404 3.898 1.00 0.00 H new ATOM 0 HA SER A 60 -9.981 -4.761 6.473 1.00 0.00 H new ATOM 0 HB2 SER A 60 -12.249 -4.272 4.561 1.00 0.00 H new ATOM 0 HB3 SER A 60 -12.133 -5.864 5.286 1.00 0.00 H new ATOM 0 HG SER A 60 -11.843 -3.620 6.984 1.00 0.00 H new ATOM 872 N PRO A 61 -9.647 -7.029 5.270 1.00 0.00 N ATOM 873 CA PRO A 61 -10.156 -7.236 6.629 1.00 0.00 C ATOM 874 C PRO A 61 -9.300 -6.538 7.681 1.00 0.00 C ATOM 875 O PRO A 61 -8.071 -6.568 7.617 1.00 0.00 O ATOM 876 CB PRO A 61 -10.088 -8.754 6.806 1.00 0.00 C ATOM 877 CG PRO A 61 -9.019 -9.198 5.868 1.00 0.00 C ATOM 878 CD PRO A 61 -9.085 -8.262 4.693 1.00 0.00 C ATOM 0 HA PRO A 61 -11.157 -6.823 6.757 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -9.848 -9.022 7.835 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -11.043 -9.223 6.569 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -8.040 -9.157 6.345 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -9.178 -10.230 5.555 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -8.099 -8.090 4.260 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -9.717 -8.658 3.899 1.00 0.00 H new ATOM 886 N LYS A 62 -9.957 -5.910 8.650 1.00 0.00 N ATOM 887 CA LYS A 62 -9.257 -5.206 9.718 1.00 0.00 C ATOM 888 C LYS A 62 -7.964 -5.925 10.088 1.00 0.00 C ATOM 889 O LYS A 62 -6.981 -5.294 10.473 1.00 0.00 O ATOM 890 CB LYS A 62 -10.156 -5.084 10.951 1.00 0.00 C ATOM 891 CG LYS A 62 -10.823 -6.390 11.349 1.00 0.00 C ATOM 892 CD LYS A 62 -11.972 -6.157 12.316 1.00 0.00 C ATOM 893 CE LYS A 62 -12.608 -7.468 12.751 1.00 0.00 C ATOM 894 NZ LYS A 62 -13.706 -7.883 11.835 1.00 0.00 N ATOM 0 H LYS A 62 -10.974 -5.874 8.718 1.00 0.00 H new ATOM 0 HA LYS A 62 -9.007 -4.208 9.358 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -9.562 -4.719 11.789 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -10.926 -4.337 10.757 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -11.193 -6.897 10.458 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -10.087 -7.050 11.809 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -11.609 -5.619 13.192 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -12.724 -5.525 11.844 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -11.847 -8.248 12.782 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -12.999 -7.364 13.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -14.113 -8.781 12.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -14.444 -7.151 11.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -13.328 -8.008 10.874 1.00 0.00 H new ATOM 908 N GLU A 63 -7.973 -7.249 9.966 1.00 0.00 N ATOM 909 CA GLU A 63 -6.799 -8.053 10.287 1.00 0.00 C ATOM 910 C GLU A 63 -6.830 -9.384 9.541 1.00 0.00 C ATOM 911 O GLU A 63 -7.791 -9.690 8.835 1.00 0.00 O ATOM 912 CB GLU A 63 -6.721 -8.302 11.794 1.00 0.00 C ATOM 913 CG GLU A 63 -7.448 -9.558 12.242 1.00 0.00 C ATOM 914 CD GLU A 63 -8.947 -9.473 12.026 1.00 0.00 C ATOM 915 OE1 GLU A 63 -9.394 -9.702 10.882 1.00 0.00 O ATOM 916 OE2 GLU A 63 -9.672 -9.177 12.998 1.00 0.00 O ATOM 0 H GLU A 63 -8.779 -7.787 9.648 1.00 0.00 H new ATOM 0 HA GLU A 63 -5.914 -7.500 9.971 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -5.674 -8.374 12.088 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -7.141 -7.443 12.318 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -7.054 -10.415 11.696 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -7.246 -9.733 13.299 1.00 0.00 H new ATOM 923 N GLY A 64 -5.772 -10.172 9.703 1.00 0.00 N ATOM 924 CA GLY A 64 -5.697 -11.460 9.040 1.00 0.00 C ATOM 925 C GLY A 64 -4.271 -11.944 8.871 1.00 0.00 C ATOM 926 O GLY A 64 -3.330 -11.293 9.326 1.00 0.00 O ATOM 0 H GLY A 64 -4.965 -9.941 10.282 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -6.261 -12.194 9.615 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -6.172 -11.389 8.061 1.00 0.00 H new ATOM 930 N ILE A 65 -4.109 -13.088 8.216 1.00 0.00 N ATOM 931 CA ILE A 65 -2.787 -13.658 7.989 1.00 0.00 C ATOM 932 C ILE A 65 -2.489 -13.780 6.498 1.00 0.00 C ATOM 933 O ILE A 65 -3.379 -14.074 5.699 1.00 0.00 O ATOM 934 CB ILE A 65 -2.652 -15.046 8.643 1.00 0.00 C ATOM 935 CG1 ILE A 65 -3.036 -14.976 10.122 1.00 0.00 C ATOM 936 CG2 ILE A 65 -1.233 -15.571 8.483 1.00 0.00 C ATOM 937 CD1 ILE A 65 -3.249 -16.333 10.756 1.00 0.00 C ATOM 0 H ILE A 65 -4.877 -13.639 7.833 1.00 0.00 H new ATOM 0 HA ILE A 65 -2.068 -12.978 8.446 1.00 0.00 H new ATOM 0 HB ILE A 65 -3.332 -15.735 8.142 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -2.254 -14.448 10.667 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -3.948 -14.389 10.225 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -1.153 -16.553 8.950 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -0.993 -15.653 7.423 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -0.535 -14.884 8.961 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -3.519 -16.206 11.805 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -4.051 -16.856 10.236 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -2.331 -16.916 10.685 1.00 0.00 H new ATOM 949 N ILE A 66 -1.233 -13.553 6.131 1.00 0.00 N ATOM 950 CA ILE A 66 -0.818 -13.641 4.736 1.00 0.00 C ATOM 951 C ILE A 66 0.199 -14.759 4.534 1.00 0.00 C ATOM 952 O ILE A 66 1.377 -14.605 4.855 1.00 0.00 O ATOM 953 CB ILE A 66 -0.209 -12.314 4.246 1.00 0.00 C ATOM 954 CG1 ILE A 66 -1.146 -11.148 4.567 1.00 0.00 C ATOM 955 CG2 ILE A 66 0.072 -12.380 2.752 1.00 0.00 C ATOM 956 CD1 ILE A 66 -0.618 -9.805 4.111 1.00 0.00 C ATOM 0 H ILE A 66 -0.485 -13.307 6.779 1.00 0.00 H new ATOM 0 HA ILE A 66 -1.713 -13.858 4.153 1.00 0.00 H new ATOM 0 HB ILE A 66 0.735 -12.150 4.766 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -2.112 -11.329 4.096 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -1.317 -11.116 5.643 1.00 0.00 H new ATOM 0 HG21 ILE A 66 0.502 -11.435 2.421 1.00 0.00 H new ATOM 0 HG22 ILE A 66 0.774 -13.189 2.549 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -0.858 -12.563 2.215 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -1.334 -9.025 4.371 1.00 0.00 H new ATOM 0 HD12 ILE A 66 0.334 -9.603 4.602 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -0.473 -9.819 3.031 1.00 0.00 H new ATOM 968 N GLU A 67 -0.265 -15.884 3.999 1.00 0.00 N ATOM 969 CA GLU A 67 0.606 -17.028 3.754 1.00 0.00 C ATOM 970 C GLU A 67 1.953 -16.577 3.196 1.00 0.00 C ATOM 971 O GLU A 67 2.060 -15.560 2.511 1.00 0.00 O ATOM 972 CB GLU A 67 -0.060 -18.004 2.782 1.00 0.00 C ATOM 973 CG GLU A 67 -0.512 -17.357 1.483 1.00 0.00 C ATOM 974 CD GLU A 67 -1.479 -18.227 0.703 1.00 0.00 C ATOM 975 OE1 GLU A 67 -1.076 -19.334 0.287 1.00 0.00 O ATOM 976 OE2 GLU A 67 -2.636 -17.802 0.509 1.00 0.00 O ATOM 0 H GLU A 67 -1.238 -16.028 3.727 1.00 0.00 H new ATOM 0 HA GLU A 67 0.777 -17.533 4.705 1.00 0.00 H new ATOM 0 HB2 GLU A 67 0.638 -18.809 2.553 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -0.922 -18.459 3.271 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -0.986 -16.401 1.704 1.00 0.00 H new ATOM 0 HG3 GLU A 67 0.360 -17.145 0.864 1.00 0.00 H new ATOM 983 N PRO A 68 3.006 -17.351 3.497 1.00 0.00 N ATOM 984 CA PRO A 68 4.365 -17.052 3.036 1.00 0.00 C ATOM 985 C PRO A 68 4.524 -17.250 1.533 1.00 0.00 C ATOM 986 O PRO A 68 3.975 -18.191 0.959 1.00 0.00 O ATOM 987 CB PRO A 68 5.228 -18.057 3.803 1.00 0.00 C ATOM 988 CG PRO A 68 4.310 -19.190 4.109 1.00 0.00 C ATOM 989 CD PRO A 68 2.951 -18.578 4.309 1.00 0.00 C ATOM 0 HA PRO A 68 4.637 -16.012 3.215 1.00 0.00 H new ATOM 0 HB2 PRO A 68 6.078 -18.387 3.205 1.00 0.00 H new ATOM 0 HB3 PRO A 68 5.632 -17.617 4.715 1.00 0.00 H new ATOM 0 HG2 PRO A 68 4.296 -19.913 3.293 1.00 0.00 H new ATOM 0 HG3 PRO A 68 4.633 -19.724 5.003 1.00 0.00 H new ATOM 0 HD2 PRO A 68 2.157 -19.246 3.975 1.00 0.00 H new ATOM 0 HD3 PRO A 68 2.761 -18.357 5.359 1.00 0.00 H new ATOM 997 N SER A 69 5.280 -16.358 0.900 1.00 0.00 N ATOM 998 CA SER A 69 5.508 -16.434 -0.539 1.00 0.00 C ATOM 999 C SER A 69 4.192 -16.332 -1.304 1.00 0.00 C ATOM 1000 O SER A 69 4.063 -16.853 -2.411 1.00 0.00 O ATOM 1001 CB SER A 69 6.219 -17.741 -0.896 1.00 0.00 C ATOM 1002 OG SER A 69 7.252 -18.029 0.031 1.00 0.00 O ATOM 0 H SER A 69 5.745 -15.575 1.360 1.00 0.00 H new ATOM 0 HA SER A 69 6.141 -15.594 -0.826 1.00 0.00 H new ATOM 0 HB2 SER A 69 5.499 -18.559 -0.908 1.00 0.00 H new ATOM 0 HB3 SER A 69 6.637 -17.669 -1.900 1.00 0.00 H new ATOM 0 HG SER A 69 7.690 -18.870 -0.218 1.00 0.00 H new ATOM 1008 N GLY A 70 3.217 -15.655 -0.705 1.00 0.00 N ATOM 1009 CA GLY A 70 1.924 -15.496 -1.343 1.00 0.00 C ATOM 1010 C GLY A 70 1.484 -14.047 -1.410 1.00 0.00 C ATOM 1011 O GLY A 70 2.313 -13.144 -1.521 1.00 0.00 O ATOM 0 H GLY A 70 3.300 -15.214 0.211 1.00 0.00 H new ATOM 0 HA2 GLY A 70 1.967 -15.906 -2.352 1.00 0.00 H new ATOM 0 HA3 GLY A 70 1.179 -16.074 -0.796 1.00 0.00 H new ATOM 1015 N VAL A 71 0.175 -13.824 -1.343 1.00 0.00 N ATOM 1016 CA VAL A 71 -0.373 -12.474 -1.397 1.00 0.00 C ATOM 1017 C VAL A 71 -1.730 -12.404 -0.705 1.00 0.00 C ATOM 1018 O VAL A 71 -2.365 -13.429 -0.459 1.00 0.00 O ATOM 1019 CB VAL A 71 -0.525 -11.987 -2.850 1.00 0.00 C ATOM 1020 CG1 VAL A 71 0.835 -11.889 -3.525 1.00 0.00 C ATOM 1021 CG2 VAL A 71 -1.449 -12.913 -3.628 1.00 0.00 C ATOM 0 H VAL A 71 -0.525 -14.560 -1.251 1.00 0.00 H new ATOM 0 HA VAL A 71 0.332 -11.826 -0.876 1.00 0.00 H new ATOM 0 HB VAL A 71 -0.971 -10.992 -2.837 1.00 0.00 H new ATOM 0 HG11 VAL A 71 0.708 -11.543 -4.551 1.00 0.00 H new ATOM 0 HG12 VAL A 71 1.462 -11.184 -2.980 1.00 0.00 H new ATOM 0 HG13 VAL A 71 1.311 -12.870 -3.529 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -1.545 -12.554 -4.653 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -1.033 -13.921 -3.634 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -2.431 -12.928 -3.155 1.00 0.00 H new ATOM 1031 N GLN A 72 -2.168 -11.189 -0.394 1.00 0.00 N ATOM 1032 CA GLN A 72 -3.450 -10.985 0.271 1.00 0.00 C ATOM 1033 C GLN A 72 -4.155 -9.748 -0.275 1.00 0.00 C ATOM 1034 O GLN A 72 -3.583 -8.659 -0.307 1.00 0.00 O ATOM 1035 CB GLN A 72 -3.250 -10.849 1.781 1.00 0.00 C ATOM 1036 CG GLN A 72 -4.503 -10.415 2.524 1.00 0.00 C ATOM 1037 CD GLN A 72 -5.707 -11.273 2.189 1.00 0.00 C ATOM 1038 OE1 GLN A 72 -5.600 -12.494 2.069 1.00 0.00 O ATOM 1039 NE2 GLN A 72 -6.863 -10.638 2.036 1.00 0.00 N ATOM 0 H GLN A 72 -1.654 -10.330 -0.592 1.00 0.00 H new ATOM 0 HA GLN A 72 -4.076 -11.855 0.073 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -2.913 -11.805 2.182 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -2.457 -10.126 1.970 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -4.318 -10.459 3.597 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -4.723 -9.376 2.281 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -6.907 -9.625 2.144 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -7.708 -11.163 1.810 1.00 0.00 H new ATOM 1048 N ALA A 73 -5.401 -9.924 -0.703 1.00 0.00 N ATOM 1049 CA ALA A 73 -6.185 -8.821 -1.245 1.00 0.00 C ATOM 1050 C ALA A 73 -6.755 -7.952 -0.129 1.00 0.00 C ATOM 1051 O ALA A 73 -7.295 -8.461 0.853 1.00 0.00 O ATOM 1052 CB ALA A 73 -7.306 -9.353 -2.126 1.00 0.00 C ATOM 0 H ALA A 73 -5.889 -10.820 -0.685 1.00 0.00 H new ATOM 0 HA ALA A 73 -5.524 -8.202 -1.851 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -7.883 -8.518 -2.524 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -6.880 -9.926 -2.950 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -7.958 -9.997 -1.536 1.00 0.00 H new ATOM 1058 N ILE A 74 -6.630 -6.638 -0.287 1.00 0.00 N ATOM 1059 CA ILE A 74 -7.133 -5.699 0.708 1.00 0.00 C ATOM 1060 C ILE A 74 -8.187 -4.775 0.107 1.00 0.00 C ATOM 1061 O ILE A 74 -7.934 -4.090 -0.883 1.00 0.00 O ATOM 1062 CB ILE A 74 -5.997 -4.845 1.301 1.00 0.00 C ATOM 1063 CG1 ILE A 74 -4.907 -5.745 1.887 1.00 0.00 C ATOM 1064 CG2 ILE A 74 -6.542 -3.903 2.364 1.00 0.00 C ATOM 1065 CD1 ILE A 74 -5.178 -6.173 3.312 1.00 0.00 C ATOM 0 H ILE A 74 -6.185 -6.200 -1.094 1.00 0.00 H new ATOM 0 HA ILE A 74 -7.583 -6.293 1.503 1.00 0.00 H new ATOM 0 HB ILE A 74 -5.558 -4.246 0.503 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -4.806 -6.633 1.263 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -3.953 -5.218 1.850 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -5.727 -3.306 2.774 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -7.286 -3.243 1.918 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -7.003 -4.484 3.163 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -4.365 -6.808 3.662 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -5.250 -5.292 3.949 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -6.115 -6.728 3.353 1.00 0.00 H new ATOM 1077 N GLN A 75 -9.369 -4.761 0.715 1.00 0.00 N ATOM 1078 CA GLN A 75 -10.462 -3.920 0.241 1.00 0.00 C ATOM 1079 C GLN A 75 -10.334 -2.502 0.787 1.00 0.00 C ATOM 1080 O GLN A 75 -10.088 -2.305 1.977 1.00 0.00 O ATOM 1081 CB GLN A 75 -11.809 -4.518 0.652 1.00 0.00 C ATOM 1082 CG GLN A 75 -12.232 -5.706 -0.197 1.00 0.00 C ATOM 1083 CD GLN A 75 -11.441 -6.960 0.121 1.00 0.00 C ATOM 1084 OE1 GLN A 75 -11.132 -7.236 1.280 1.00 0.00 O ATOM 1085 NE2 GLN A 75 -11.110 -7.728 -0.910 1.00 0.00 N ATOM 0 H GLN A 75 -9.594 -5.322 1.536 1.00 0.00 H new ATOM 0 HA GLN A 75 -10.408 -3.877 -0.847 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -11.756 -4.828 1.696 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -12.575 -3.745 0.588 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -13.293 -5.901 -0.040 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -12.105 -5.458 -1.251 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -11.387 -7.461 -1.855 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -10.579 -8.585 -0.758 1.00 0.00 H new ATOM 1094 N ILE A 76 -10.501 -1.518 -0.091 1.00 0.00 N ATOM 1095 CA ILE A 76 -10.405 -0.118 0.304 1.00 0.00 C ATOM 1096 C ILE A 76 -11.625 0.669 -0.161 1.00 0.00 C ATOM 1097 O ILE A 76 -11.869 0.805 -1.360 1.00 0.00 O ATOM 1098 CB ILE A 76 -9.135 0.541 -0.265 1.00 0.00 C ATOM 1099 CG1 ILE A 76 -7.895 -0.265 0.129 1.00 0.00 C ATOM 1100 CG2 ILE A 76 -9.017 1.976 0.226 1.00 0.00 C ATOM 1101 CD1 ILE A 76 -6.749 -0.127 -0.849 1.00 0.00 C ATOM 0 H ILE A 76 -10.703 -1.665 -1.080 1.00 0.00 H new ATOM 0 HA ILE A 76 -10.357 -0.099 1.393 1.00 0.00 H new ATOM 0 HB ILE A 76 -9.207 0.554 -1.353 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -7.561 0.056 1.115 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -8.167 -1.317 0.212 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -8.114 2.428 -0.185 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -9.888 2.545 -0.099 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -8.964 1.985 1.315 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -5.904 -0.725 -0.506 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -7.066 -0.476 -1.832 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -6.450 0.919 -0.914 1.00 0.00 H new ATOM 1113 N SER A 77 -12.388 1.188 0.796 1.00 0.00 N ATOM 1114 CA SER A 77 -13.584 1.961 0.485 1.00 0.00 C ATOM 1115 C SER A 77 -13.487 3.369 1.065 1.00 0.00 C ATOM 1116 O SER A 77 -13.495 3.553 2.283 1.00 0.00 O ATOM 1117 CB SER A 77 -14.828 1.257 1.031 1.00 0.00 C ATOM 1118 OG SER A 77 -15.361 0.353 0.079 1.00 0.00 O ATOM 0 H SER A 77 -12.199 1.087 1.793 1.00 0.00 H new ATOM 0 HA SER A 77 -13.665 2.038 -0.599 1.00 0.00 H new ATOM 0 HB2 SER A 77 -14.574 0.720 1.945 1.00 0.00 H new ATOM 0 HB3 SER A 77 -15.582 1.998 1.296 1.00 0.00 H new ATOM 0 HG SER A 77 -16.154 -0.085 0.452 1.00 0.00 H new ATOM 1124 N PHE A 78 -13.395 4.360 0.185 1.00 0.00 N ATOM 1125 CA PHE A 78 -13.296 5.752 0.608 1.00 0.00 C ATOM 1126 C PHE A 78 -14.526 6.543 0.171 1.00 0.00 C ATOM 1127 O PHE A 78 -15.085 6.300 -0.899 1.00 0.00 O ATOM 1128 CB PHE A 78 -12.032 6.393 0.031 1.00 0.00 C ATOM 1129 CG PHE A 78 -11.987 7.885 0.198 1.00 0.00 C ATOM 1130 CD1 PHE A 78 -11.985 8.455 1.461 1.00 0.00 C ATOM 1131 CD2 PHE A 78 -11.947 8.718 -0.909 1.00 0.00 C ATOM 1132 CE1 PHE A 78 -11.944 9.827 1.618 1.00 0.00 C ATOM 1133 CE2 PHE A 78 -11.904 10.091 -0.758 1.00 0.00 C ATOM 1134 CZ PHE A 78 -11.904 10.647 0.507 1.00 0.00 C ATOM 0 H PHE A 78 -13.387 4.225 -0.826 1.00 0.00 H new ATOM 0 HA PHE A 78 -13.242 5.772 1.696 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -11.159 5.955 0.514 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -11.964 6.152 -1.030 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -12.016 7.819 2.333 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -11.949 8.289 -1.900 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -11.943 10.258 2.608 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -11.870 10.729 -1.629 1.00 0.00 H new ATOM 0 HZ PHE A 78 -11.873 11.720 0.627 1.00 0.00 H new ATOM 1144 N SER A 79 -14.941 7.489 1.006 1.00 0.00 N ATOM 1145 CA SER A 79 -16.107 8.313 0.709 1.00 0.00 C ATOM 1146 C SER A 79 -16.155 9.535 1.621 1.00 0.00 C ATOM 1147 O SER A 79 -16.254 9.410 2.841 1.00 0.00 O ATOM 1148 CB SER A 79 -17.390 7.495 0.867 1.00 0.00 C ATOM 1149 OG SER A 79 -18.537 8.322 0.778 1.00 0.00 O ATOM 0 H SER A 79 -14.487 7.704 1.894 1.00 0.00 H new ATOM 0 HA SER A 79 -16.026 8.654 -0.323 1.00 0.00 H new ATOM 0 HB2 SER A 79 -17.432 6.726 0.096 1.00 0.00 H new ATOM 0 HB3 SER A 79 -17.382 6.982 1.829 1.00 0.00 H new ATOM 0 HG SER A 79 -18.728 8.517 -0.163 1.00 0.00 H new ATOM 1155 N SER A 80 -16.082 10.718 1.019 1.00 0.00 N ATOM 1156 CA SER A 80 -16.113 11.964 1.775 1.00 0.00 C ATOM 1157 C SER A 80 -16.749 13.082 0.955 1.00 0.00 C ATOM 1158 O SER A 80 -17.098 12.891 -0.211 1.00 0.00 O ATOM 1159 CB SER A 80 -14.698 12.366 2.195 1.00 0.00 C ATOM 1160 OG SER A 80 -14.714 13.091 3.413 1.00 0.00 O ATOM 0 H SER A 80 -16.001 10.839 0.009 1.00 0.00 H new ATOM 0 HA SER A 80 -16.717 11.803 2.668 1.00 0.00 H new ATOM 0 HB2 SER A 80 -14.081 11.474 2.307 1.00 0.00 H new ATOM 0 HB3 SER A 80 -14.242 12.973 1.413 1.00 0.00 H new ATOM 0 HG SER A 80 -14.559 12.477 4.161 1.00 0.00 H new ATOM 1166 N ILE A 81 -16.897 14.250 1.572 1.00 0.00 N ATOM 1167 CA ILE A 81 -17.490 15.399 0.899 1.00 0.00 C ATOM 1168 C ILE A 81 -16.573 16.615 0.978 1.00 0.00 C ATOM 1169 O ILE A 81 -16.951 17.717 0.580 1.00 0.00 O ATOM 1170 CB ILE A 81 -18.858 15.762 1.505 1.00 0.00 C ATOM 1171 CG1 ILE A 81 -18.708 16.106 2.989 1.00 0.00 C ATOM 1172 CG2 ILE A 81 -19.841 14.616 1.318 1.00 0.00 C ATOM 1173 CD1 ILE A 81 -18.349 17.553 3.240 1.00 0.00 C ATOM 0 H ILE A 81 -16.614 14.425 2.536 1.00 0.00 H new ATOM 0 HA ILE A 81 -17.628 15.117 -0.145 1.00 0.00 H new ATOM 0 HB ILE A 81 -19.248 16.638 0.986 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -19.642 15.877 3.503 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -17.939 15.468 3.426 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -20.803 14.888 1.752 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -19.966 14.414 0.254 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -19.459 13.724 1.814 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -18.259 17.725 4.313 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -17.400 17.782 2.755 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -19.129 18.197 2.834 1.00 0.00 H new ATOM 1185 N ILE A 82 -15.365 16.406 1.491 1.00 0.00 N ATOM 1186 CA ILE A 82 -14.393 17.485 1.619 1.00 0.00 C ATOM 1187 C ILE A 82 -13.625 17.689 0.318 1.00 0.00 C ATOM 1188 O ILE A 82 -12.607 17.038 0.076 1.00 0.00 O ATOM 1189 CB ILE A 82 -13.391 17.208 2.755 1.00 0.00 C ATOM 1190 CG1 ILE A 82 -14.118 17.137 4.100 1.00 0.00 C ATOM 1191 CG2 ILE A 82 -12.314 18.282 2.786 1.00 0.00 C ATOM 1192 CD1 ILE A 82 -13.415 16.272 5.122 1.00 0.00 C ATOM 0 H ILE A 82 -15.036 15.500 1.825 1.00 0.00 H new ATOM 0 HA ILE A 82 -14.954 18.390 1.853 1.00 0.00 H new ATOM 0 HB ILE A 82 -12.912 16.246 2.570 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -14.224 18.145 4.500 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -15.125 16.751 3.940 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -11.614 18.072 3.594 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -11.780 18.289 1.836 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -12.776 19.256 2.950 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -13.986 16.268 6.050 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -13.333 15.254 4.742 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -12.418 16.670 5.311 1.00 0.00 H new ATOM 1204 N LEU A 83 -14.117 18.598 -0.517 1.00 0.00 N ATOM 1205 CA LEU A 83 -13.475 18.891 -1.794 1.00 0.00 C ATOM 1206 C LEU A 83 -12.019 19.298 -1.592 1.00 0.00 C ATOM 1207 O LEU A 83 -11.606 19.633 -0.483 1.00 0.00 O ATOM 1208 CB LEU A 83 -14.231 20.004 -2.523 1.00 0.00 C ATOM 1209 CG LEU A 83 -15.741 19.808 -2.665 1.00 0.00 C ATOM 1210 CD1 LEU A 83 -16.375 21.018 -3.334 1.00 0.00 C ATOM 1211 CD2 LEU A 83 -16.042 18.542 -3.453 1.00 0.00 C ATOM 0 H LEU A 83 -14.958 19.145 -0.333 1.00 0.00 H new ATOM 0 HA LEU A 83 -13.498 17.986 -2.400 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -14.054 20.941 -1.996 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -13.804 20.114 -3.520 1.00 0.00 H new ATOM 0 HG LEU A 83 -16.170 19.703 -1.669 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -17.450 20.861 -3.427 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -16.189 21.906 -2.731 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -15.941 21.155 -4.325 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -17.121 18.418 -3.544 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -15.600 18.618 -4.446 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -15.621 17.681 -2.934 1.00 0.00 H new ATOM 1223 N GLY A 84 -11.246 19.267 -2.673 1.00 0.00 N ATOM 1224 CA GLY A 84 -9.845 19.636 -2.593 1.00 0.00 C ATOM 1225 C GLY A 84 -8.934 18.431 -2.468 1.00 0.00 C ATOM 1226 O GLY A 84 -9.366 17.358 -2.049 1.00 0.00 O ATOM 0 H GLY A 84 -11.565 18.993 -3.602 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -9.571 20.204 -3.482 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -9.694 20.292 -1.736 1.00 0.00 H new ATOM 1230 N ASN A 85 -7.668 18.607 -2.835 1.00 0.00 N ATOM 1231 CA ASN A 85 -6.694 17.524 -2.764 1.00 0.00 C ATOM 1232 C ASN A 85 -6.447 17.108 -1.317 1.00 0.00 C ATOM 1233 O ASN A 85 -6.664 17.889 -0.390 1.00 0.00 O ATOM 1234 CB ASN A 85 -5.377 17.951 -3.415 1.00 0.00 C ATOM 1235 CG ASN A 85 -4.773 19.173 -2.750 1.00 0.00 C ATOM 1236 OD1 ASN A 85 -5.288 19.666 -1.746 1.00 0.00 O ATOM 1237 ND2 ASN A 85 -3.674 19.668 -3.308 1.00 0.00 N ATOM 0 H ASN A 85 -7.293 19.489 -3.184 1.00 0.00 H new ATOM 0 HA ASN A 85 -7.099 16.669 -3.305 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -4.667 17.126 -3.366 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -5.548 18.162 -4.470 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -3.223 20.489 -2.905 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -3.281 19.227 -4.140 1.00 0.00 H new ATOM 1244 N PHE A 86 -5.993 15.874 -1.131 1.00 0.00 N ATOM 1245 CA PHE A 86 -5.716 15.353 0.203 1.00 0.00 C ATOM 1246 C PHE A 86 -4.648 14.266 0.152 1.00 0.00 C ATOM 1247 O PHE A 86 -4.614 13.458 -0.776 1.00 0.00 O ATOM 1248 CB PHE A 86 -6.996 14.798 0.832 1.00 0.00 C ATOM 1249 CG PHE A 86 -7.475 13.526 0.193 1.00 0.00 C ATOM 1250 CD1 PHE A 86 -6.985 12.299 0.610 1.00 0.00 C ATOM 1251 CD2 PHE A 86 -8.415 13.557 -0.825 1.00 0.00 C ATOM 1252 CE1 PHE A 86 -7.423 11.127 0.023 1.00 0.00 C ATOM 1253 CE2 PHE A 86 -8.857 12.388 -1.415 1.00 0.00 C ATOM 1254 CZ PHE A 86 -8.361 11.172 -0.990 1.00 0.00 C ATOM 0 H PHE A 86 -5.809 15.215 -1.887 1.00 0.00 H new ATOM 0 HA PHE A 86 -5.344 16.174 0.816 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -6.822 14.619 1.893 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -7.782 15.550 0.760 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -6.253 12.258 1.403 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -8.807 14.506 -1.161 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -7.032 10.177 0.356 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -9.590 12.426 -2.208 1.00 0.00 H new ATOM 0 HZ PHE A 86 -8.706 10.257 -1.449 1.00 0.00 H new ATOM 1264 N GLU A 87 -3.776 14.253 1.156 1.00 0.00 N ATOM 1265 CA GLU A 87 -2.706 13.265 1.225 1.00 0.00 C ATOM 1266 C GLU A 87 -2.735 12.522 2.557 1.00 0.00 C ATOM 1267 O GLU A 87 -2.265 13.032 3.574 1.00 0.00 O ATOM 1268 CB GLU A 87 -1.346 13.941 1.035 1.00 0.00 C ATOM 1269 CG GLU A 87 -0.233 12.975 0.666 1.00 0.00 C ATOM 1270 CD GLU A 87 1.017 13.683 0.178 1.00 0.00 C ATOM 1271 OE1 GLU A 87 1.122 13.926 -1.042 1.00 0.00 O ATOM 1272 OE2 GLU A 87 1.888 13.995 1.016 1.00 0.00 O ATOM 0 H GLU A 87 -3.790 14.915 1.932 1.00 0.00 H new ATOM 0 HA GLU A 87 -2.861 12.543 0.423 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -1.432 14.698 0.256 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -1.076 14.459 1.955 1.00 0.00 H new ATOM 0 HG2 GLU A 87 0.015 12.364 1.534 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -0.588 12.297 -0.110 1.00 0.00 H new ATOM 1279 N GLU A 88 -3.292 11.315 2.543 1.00 0.00 N ATOM 1280 CA GLU A 88 -3.384 10.503 3.750 1.00 0.00 C ATOM 1281 C GLU A 88 -2.348 9.383 3.733 1.00 0.00 C ATOM 1282 O GLU A 88 -1.904 8.951 2.670 1.00 0.00 O ATOM 1283 CB GLU A 88 -4.789 9.911 3.887 1.00 0.00 C ATOM 1284 CG GLU A 88 -5.842 10.929 4.291 1.00 0.00 C ATOM 1285 CD GLU A 88 -5.571 11.540 5.651 1.00 0.00 C ATOM 1286 OE1 GLU A 88 -5.362 10.773 6.615 1.00 0.00 O ATOM 1287 OE2 GLU A 88 -5.568 12.785 5.753 1.00 0.00 O ATOM 0 H GLU A 88 -3.686 10.878 1.710 1.00 0.00 H new ATOM 0 HA GLU A 88 -3.183 11.147 4.606 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -5.078 9.459 2.938 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -4.766 9.111 4.627 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -5.883 11.721 3.543 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -6.821 10.449 4.301 1.00 0.00 H new ATOM 1294 N GLU A 89 -1.966 8.920 4.920 1.00 0.00 N ATOM 1295 CA GLU A 89 -0.981 7.852 5.041 1.00 0.00 C ATOM 1296 C GLU A 89 -1.457 6.781 6.018 1.00 0.00 C ATOM 1297 O GLU A 89 -1.692 7.059 7.195 1.00 0.00 O ATOM 1298 CB GLU A 89 0.364 8.418 5.502 1.00 0.00 C ATOM 1299 CG GLU A 89 0.953 9.443 4.547 1.00 0.00 C ATOM 1300 CD GLU A 89 0.428 10.843 4.798 1.00 0.00 C ATOM 1301 OE1 GLU A 89 0.169 11.179 5.972 1.00 0.00 O ATOM 1302 OE2 GLU A 89 0.277 11.604 3.818 1.00 0.00 O ATOM 0 H GLU A 89 -2.323 9.268 5.810 1.00 0.00 H new ATOM 0 HA GLU A 89 -0.857 7.394 4.060 1.00 0.00 H new ATOM 0 HB2 GLU A 89 0.238 8.878 6.482 1.00 0.00 H new ATOM 0 HB3 GLU A 89 1.072 7.598 5.623 1.00 0.00 H new ATOM 0 HG2 GLU A 89 2.039 9.443 4.644 1.00 0.00 H new ATOM 0 HG3 GLU A 89 0.725 9.152 3.522 1.00 0.00 H new ATOM 1309 N PHE A 90 -1.596 5.556 5.523 1.00 0.00 N ATOM 1310 CA PHE A 90 -2.045 4.443 6.351 1.00 0.00 C ATOM 1311 C PHE A 90 -0.873 3.547 6.740 1.00 0.00 C ATOM 1312 O PHE A 90 0.114 3.444 6.011 1.00 0.00 O ATOM 1313 CB PHE A 90 -3.104 3.623 5.611 1.00 0.00 C ATOM 1314 CG PHE A 90 -4.261 4.444 5.118 1.00 0.00 C ATOM 1315 CD1 PHE A 90 -4.123 5.267 4.011 1.00 0.00 C ATOM 1316 CD2 PHE A 90 -5.487 4.394 5.762 1.00 0.00 C ATOM 1317 CE1 PHE A 90 -5.186 6.023 3.555 1.00 0.00 C ATOM 1318 CE2 PHE A 90 -6.554 5.148 5.310 1.00 0.00 C ATOM 1319 CZ PHE A 90 -6.402 5.965 4.206 1.00 0.00 C ATOM 0 H PHE A 90 -1.404 5.309 4.552 1.00 0.00 H new ATOM 0 HA PHE A 90 -2.483 4.854 7.260 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -2.637 3.122 4.763 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -3.478 2.844 6.275 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -3.173 5.318 3.499 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -5.610 3.759 6.627 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -5.066 6.659 2.690 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -7.505 5.099 5.819 1.00 0.00 H new ATOM 0 HZ PHE A 90 -7.233 6.557 3.853 1.00 0.00 H new ATOM 1329 N LEU A 91 -0.988 2.901 7.895 1.00 0.00 N ATOM 1330 CA LEU A 91 0.062 2.013 8.383 1.00 0.00 C ATOM 1331 C LEU A 91 -0.513 0.658 8.782 1.00 0.00 C ATOM 1332 O LEU A 91 -1.668 0.559 9.195 1.00 0.00 O ATOM 1333 CB LEU A 91 0.779 2.647 9.577 1.00 0.00 C ATOM 1334 CG LEU A 91 1.600 3.901 9.277 1.00 0.00 C ATOM 1335 CD1 LEU A 91 2.068 4.554 10.569 1.00 0.00 C ATOM 1336 CD2 LEU A 91 2.788 3.561 8.389 1.00 0.00 C ATOM 0 H LEU A 91 -1.797 2.975 8.511 1.00 0.00 H new ATOM 0 HA LEU A 91 0.778 1.860 7.576 1.00 0.00 H new ATOM 0 HB2 LEU A 91 0.034 2.897 10.332 1.00 0.00 H new ATOM 0 HB3 LEU A 91 1.440 1.900 10.017 1.00 0.00 H new ATOM 0 HG LEU A 91 0.965 4.609 8.745 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.651 5.445 10.336 1.00 0.00 H new ATOM 0 HD12 LEU A 91 1.202 4.833 11.170 1.00 0.00 H new ATOM 0 HD13 LEU A 91 2.686 3.852 11.128 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.361 4.466 8.186 1.00 0.00 H new ATOM 0 HD22 LEU A 91 3.424 2.834 8.895 1.00 0.00 H new ATOM 0 HD23 LEU A 91 2.431 3.139 7.450 1.00 0.00 H new ATOM 1348 N VAL A 92 0.302 -0.385 8.658 1.00 0.00 N ATOM 1349 CA VAL A 92 -0.123 -1.735 9.008 1.00 0.00 C ATOM 1350 C VAL A 92 0.814 -2.357 10.036 1.00 0.00 C ATOM 1351 O VAL A 92 1.962 -2.679 9.730 1.00 0.00 O ATOM 1352 CB VAL A 92 -0.183 -2.644 7.767 1.00 0.00 C ATOM 1353 CG1 VAL A 92 -0.760 -4.004 8.128 1.00 0.00 C ATOM 1354 CG2 VAL A 92 -0.998 -1.987 6.663 1.00 0.00 C ATOM 0 H VAL A 92 1.261 -0.320 8.317 1.00 0.00 H new ATOM 0 HA VAL A 92 -1.122 -1.651 9.436 1.00 0.00 H new ATOM 0 HB VAL A 92 0.832 -2.792 7.399 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -0.794 -4.632 7.238 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -0.131 -4.477 8.882 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -1.768 -3.878 8.523 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -1.029 -2.644 5.794 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -2.013 -1.806 7.018 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -0.537 -1.039 6.385 1.00 0.00 H new ATOM 1364 N ASN A 93 0.317 -2.525 11.257 1.00 0.00 N ATOM 1365 CA ASN A 93 1.111 -3.109 12.332 1.00 0.00 C ATOM 1366 C ASN A 93 1.262 -4.615 12.140 1.00 0.00 C ATOM 1367 O ASN A 93 0.281 -5.358 12.177 1.00 0.00 O ATOM 1368 CB ASN A 93 0.464 -2.819 13.688 1.00 0.00 C ATOM 1369 CG ASN A 93 -0.888 -3.491 13.839 1.00 0.00 C ATOM 1370 OD1 ASN A 93 -0.992 -4.583 14.397 1.00 0.00 O ATOM 1371 ND2 ASN A 93 -1.931 -2.838 13.340 1.00 0.00 N ATOM 0 H ASN A 93 -0.632 -2.265 11.527 1.00 0.00 H new ATOM 0 HA ASN A 93 2.102 -2.656 12.305 1.00 0.00 H new ATOM 0 HB2 ASN A 93 1.127 -3.159 14.484 1.00 0.00 H new ATOM 0 HB3 ASN A 93 0.347 -1.742 13.809 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -2.866 -3.240 13.411 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -1.797 -1.935 12.886 1.00 0.00 H new ATOM 1378 N VAL A 94 2.498 -5.059 11.934 1.00 0.00 N ATOM 1379 CA VAL A 94 2.779 -6.476 11.738 1.00 0.00 C ATOM 1380 C VAL A 94 3.561 -7.049 12.914 1.00 0.00 C ATOM 1381 O VAL A 94 4.599 -6.515 13.302 1.00 0.00 O ATOM 1382 CB VAL A 94 3.574 -6.716 10.441 1.00 0.00 C ATOM 1383 CG1 VAL A 94 4.080 -8.149 10.382 1.00 0.00 C ATOM 1384 CG2 VAL A 94 2.719 -6.394 9.225 1.00 0.00 C ATOM 0 H VAL A 94 3.321 -4.457 11.899 1.00 0.00 H new ATOM 0 HA VAL A 94 1.817 -6.982 11.664 1.00 0.00 H new ATOM 0 HB VAL A 94 4.437 -6.051 10.437 1.00 0.00 H new ATOM 0 HG11 VAL A 94 4.639 -8.300 9.459 1.00 0.00 H new ATOM 0 HG12 VAL A 94 4.730 -8.341 11.236 1.00 0.00 H new ATOM 0 HG13 VAL A 94 3.234 -8.835 10.410 1.00 0.00 H new ATOM 0 HG21 VAL A 94 3.297 -6.569 8.317 1.00 0.00 H new ATOM 0 HG22 VAL A 94 1.836 -7.033 9.222 1.00 0.00 H new ATOM 0 HG23 VAL A 94 2.411 -5.349 9.263 1.00 0.00 H new ATOM 1394 N ASN A 95 3.055 -8.142 13.478 1.00 0.00 N ATOM 1395 CA ASN A 95 3.707 -8.789 14.611 1.00 0.00 C ATOM 1396 C ASN A 95 5.110 -9.258 14.236 1.00 0.00 C ATOM 1397 O ASN A 95 5.306 -9.903 13.207 1.00 0.00 O ATOM 1398 CB ASN A 95 2.873 -9.976 15.096 1.00 0.00 C ATOM 1399 CG ASN A 95 3.644 -10.877 16.041 1.00 0.00 C ATOM 1400 OD1 ASN A 95 3.975 -10.482 17.160 1.00 0.00 O ATOM 1401 ND2 ASN A 95 3.933 -12.093 15.595 1.00 0.00 N ATOM 0 H ASN A 95 2.196 -8.597 13.169 1.00 0.00 H new ATOM 0 HA ASN A 95 3.790 -8.059 15.416 1.00 0.00 H new ATOM 0 HB2 ASN A 95 1.979 -9.607 15.599 1.00 0.00 H new ATOM 0 HB3 ASN A 95 2.539 -10.557 14.236 1.00 0.00 H new ATOM 0 HD21 ASN A 95 4.450 -12.744 16.187 1.00 0.00 H new ATOM 0 HD22 ASN A 95 3.638 -12.377 14.661 1.00 0.00 H new ATOM 1408 N GLY A 96 6.083 -8.928 15.080 1.00 0.00 N ATOM 1409 CA GLY A 96 7.455 -9.324 14.821 1.00 0.00 C ATOM 1410 C GLY A 96 8.266 -8.217 14.176 1.00 0.00 C ATOM 1411 O GLY A 96 9.376 -7.917 14.613 1.00 0.00 O ATOM 0 H GLY A 96 5.946 -8.394 15.938 1.00 0.00 H new ATOM 0 HA2 GLY A 96 7.928 -9.618 15.758 1.00 0.00 H new ATOM 0 HA3 GLY A 96 7.461 -10.200 14.172 1.00 0.00 H new ATOM 1415 N SER A 97 7.710 -7.610 13.132 1.00 0.00 N ATOM 1416 CA SER A 97 8.391 -6.534 12.422 1.00 0.00 C ATOM 1417 C SER A 97 8.414 -5.260 13.260 1.00 0.00 C ATOM 1418 O SER A 97 7.433 -4.894 13.908 1.00 0.00 O ATOM 1419 CB SER A 97 7.704 -6.264 11.082 1.00 0.00 C ATOM 1420 OG SER A 97 8.300 -7.021 10.042 1.00 0.00 O ATOM 0 H SER A 97 6.790 -7.845 12.759 1.00 0.00 H new ATOM 0 HA SER A 97 9.419 -6.846 12.239 1.00 0.00 H new ATOM 0 HB2 SER A 97 6.645 -6.512 11.156 1.00 0.00 H new ATOM 0 HB3 SER A 97 7.767 -5.202 10.845 1.00 0.00 H new ATOM 0 HG SER A 97 7.842 -6.832 9.196 1.00 0.00 H new ATOM 1426 N PRO A 98 9.562 -4.565 13.248 1.00 0.00 N ATOM 1427 CA PRO A 98 9.742 -3.320 14.001 1.00 0.00 C ATOM 1428 C PRO A 98 8.926 -2.170 13.422 1.00 0.00 C ATOM 1429 O PRO A 98 8.203 -1.485 14.145 1.00 0.00 O ATOM 1430 CB PRO A 98 11.240 -3.036 13.862 1.00 0.00 C ATOM 1431 CG PRO A 98 11.640 -3.719 12.600 1.00 0.00 C ATOM 1432 CD PRO A 98 10.772 -4.942 12.497 1.00 0.00 C ATOM 0 HA PRO A 98 9.406 -3.415 15.034 1.00 0.00 H new ATOM 0 HB2 PRO A 98 11.437 -1.965 13.812 1.00 0.00 H new ATOM 0 HB3 PRO A 98 11.797 -3.423 14.715 1.00 0.00 H new ATOM 0 HG2 PRO A 98 11.496 -3.065 11.740 1.00 0.00 H new ATOM 0 HG3 PRO A 98 12.695 -3.990 12.621 1.00 0.00 H new ATOM 0 HD2 PRO A 98 10.542 -5.185 11.460 1.00 0.00 H new ATOM 0 HD3 PRO A 98 11.257 -5.817 12.930 1.00 0.00 H new ATOM 1440 N GLU A 99 9.046 -1.964 12.114 1.00 0.00 N ATOM 1441 CA GLU A 99 8.318 -0.895 11.440 1.00 0.00 C ATOM 1442 C GLU A 99 7.150 -1.456 10.634 1.00 0.00 C ATOM 1443 O GLU A 99 7.279 -2.447 9.914 1.00 0.00 O ATOM 1444 CB GLU A 99 9.256 -0.111 10.520 1.00 0.00 C ATOM 1445 CG GLU A 99 8.879 1.354 10.372 1.00 0.00 C ATOM 1446 CD GLU A 99 7.911 1.594 9.230 1.00 0.00 C ATOM 1447 OE1 GLU A 99 8.233 1.207 8.087 1.00 0.00 O ATOM 1448 OE2 GLU A 99 6.831 2.170 9.479 1.00 0.00 O ATOM 0 H GLU A 99 9.640 -2.523 11.501 1.00 0.00 H new ATOM 0 HA GLU A 99 7.922 -0.224 12.202 1.00 0.00 H new ATOM 0 HB2 GLU A 99 10.272 -0.179 10.908 1.00 0.00 H new ATOM 0 HB3 GLU A 99 9.259 -0.578 9.535 1.00 0.00 H new ATOM 0 HG2 GLU A 99 8.433 1.706 11.302 1.00 0.00 H new ATOM 0 HG3 GLU A 99 9.781 1.943 10.208 1.00 0.00 H new ATOM 1455 N PRO A 100 5.982 -0.809 10.757 1.00 0.00 N ATOM 1456 CA PRO A 100 4.768 -1.225 10.049 1.00 0.00 C ATOM 1457 C PRO A 100 4.859 -0.976 8.547 1.00 0.00 C ATOM 1458 O PRO A 100 5.907 -0.581 8.036 1.00 0.00 O ATOM 1459 CB PRO A 100 3.677 -0.350 10.670 1.00 0.00 C ATOM 1460 CG PRO A 100 4.396 0.856 11.168 1.00 0.00 C ATOM 1461 CD PRO A 100 5.756 0.379 11.598 1.00 0.00 C ATOM 0 HA PRO A 100 4.584 -2.295 10.150 1.00 0.00 H new ATOM 0 HB2 PRO A 100 2.918 -0.083 9.935 1.00 0.00 H new ATOM 0 HB3 PRO A 100 3.167 -0.870 11.481 1.00 0.00 H new ATOM 0 HG2 PRO A 100 4.477 1.612 10.387 1.00 0.00 H new ATOM 0 HG3 PRO A 100 3.861 1.313 12.001 1.00 0.00 H new ATOM 0 HD2 PRO A 100 6.519 1.139 11.433 1.00 0.00 H new ATOM 0 HD3 PRO A 100 5.778 0.130 12.659 1.00 0.00 H new ATOM 1469 N VAL A 101 3.755 -1.210 7.845 1.00 0.00 N ATOM 1470 CA VAL A 101 3.710 -1.009 6.401 1.00 0.00 C ATOM 1471 C VAL A 101 2.977 0.280 6.048 1.00 0.00 C ATOM 1472 O VAL A 101 1.747 0.325 6.034 1.00 0.00 O ATOM 1473 CB VAL A 101 3.021 -2.189 5.692 1.00 0.00 C ATOM 1474 CG1 VAL A 101 3.231 -2.105 4.188 1.00 0.00 C ATOM 1475 CG2 VAL A 101 3.536 -3.513 6.237 1.00 0.00 C ATOM 0 H VAL A 101 2.880 -1.539 8.252 1.00 0.00 H new ATOM 0 HA VAL A 101 4.743 -0.941 6.058 1.00 0.00 H new ATOM 0 HB VAL A 101 1.950 -2.133 5.889 1.00 0.00 H new ATOM 0 HG11 VAL A 101 2.737 -2.947 3.704 1.00 0.00 H new ATOM 0 HG12 VAL A 101 2.809 -1.173 3.813 1.00 0.00 H new ATOM 0 HG13 VAL A 101 4.298 -2.135 3.967 1.00 0.00 H new ATOM 0 HG21 VAL A 101 3.038 -4.336 5.724 1.00 0.00 H new ATOM 0 HG22 VAL A 101 4.611 -3.581 6.072 1.00 0.00 H new ATOM 0 HG23 VAL A 101 3.328 -3.572 7.305 1.00 0.00 H new ATOM 1485 N LYS A 102 3.741 1.329 5.763 1.00 0.00 N ATOM 1486 CA LYS A 102 3.166 2.621 5.407 1.00 0.00 C ATOM 1487 C LYS A 102 2.697 2.627 3.956 1.00 0.00 C ATOM 1488 O LYS A 102 3.352 2.062 3.078 1.00 0.00 O ATOM 1489 CB LYS A 102 4.190 3.737 5.627 1.00 0.00 C ATOM 1490 CG LYS A 102 3.611 5.133 5.477 1.00 0.00 C ATOM 1491 CD LYS A 102 4.342 6.137 6.351 1.00 0.00 C ATOM 1492 CE LYS A 102 5.595 6.663 5.668 1.00 0.00 C ATOM 1493 NZ LYS A 102 6.240 7.752 6.453 1.00 0.00 N ATOM 0 H LYS A 102 4.761 1.310 5.772 1.00 0.00 H new ATOM 0 HA LYS A 102 2.303 2.795 6.050 1.00 0.00 H new ATOM 0 HB2 LYS A 102 4.617 3.635 6.625 1.00 0.00 H new ATOM 0 HB3 LYS A 102 5.007 3.614 4.917 1.00 0.00 H new ATOM 0 HG2 LYS A 102 3.674 5.444 4.434 1.00 0.00 H new ATOM 0 HG3 LYS A 102 2.554 5.120 5.743 1.00 0.00 H new ATOM 0 HD2 LYS A 102 3.678 6.969 6.585 1.00 0.00 H new ATOM 0 HD3 LYS A 102 4.612 5.668 7.297 1.00 0.00 H new ATOM 0 HE2 LYS A 102 6.303 5.846 5.530 1.00 0.00 H new ATOM 0 HE3 LYS A 102 5.339 7.034 4.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 7.090 8.083 5.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 5.573 8.542 6.563 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 6.508 7.392 7.391 1.00 0.00 H new ATOM 1507 N LEU A 103 1.560 3.269 3.709 1.00 0.00 N ATOM 1508 CA LEU A 103 1.004 3.350 2.362 1.00 0.00 C ATOM 1509 C LEU A 103 0.438 4.740 2.090 1.00 0.00 C ATOM 1510 O LEU A 103 -0.438 5.218 2.811 1.00 0.00 O ATOM 1511 CB LEU A 103 -0.089 2.296 2.177 1.00 0.00 C ATOM 1512 CG LEU A 103 -0.772 2.270 0.809 1.00 0.00 C ATOM 1513 CD1 LEU A 103 0.119 1.591 -0.220 1.00 0.00 C ATOM 1514 CD2 LEU A 103 -2.118 1.568 0.898 1.00 0.00 C ATOM 0 H LEU A 103 1.005 3.741 4.423 1.00 0.00 H new ATOM 0 HA LEU A 103 1.808 3.160 1.651 1.00 0.00 H new ATOM 0 HB2 LEU A 103 0.346 1.314 2.362 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -0.852 2.455 2.939 1.00 0.00 H new ATOM 0 HG LEU A 103 -0.942 3.298 0.490 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -0.384 1.582 -1.187 1.00 0.00 H new ATOM 0 HD12 LEU A 103 1.059 2.137 -0.305 1.00 0.00 H new ATOM 0 HD13 LEU A 103 0.321 0.567 0.093 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -2.589 1.559 -0.085 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -1.972 0.543 1.240 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -2.759 2.098 1.603 1.00 0.00 H new ATOM 1526 N THR A 104 0.943 5.383 1.042 1.00 0.00 N ATOM 1527 CA THR A 104 0.488 6.718 0.672 1.00 0.00 C ATOM 1528 C THR A 104 -0.665 6.649 -0.323 1.00 0.00 C ATOM 1529 O THR A 104 -0.693 5.780 -1.195 1.00 0.00 O ATOM 1530 CB THR A 104 1.629 7.552 0.062 1.00 0.00 C ATOM 1531 OG1 THR A 104 2.773 7.522 0.924 1.00 0.00 O ATOM 1532 CG2 THR A 104 1.190 8.992 -0.155 1.00 0.00 C ATOM 0 H THR A 104 1.667 5.001 0.434 1.00 0.00 H new ATOM 0 HA THR A 104 0.146 7.200 1.588 1.00 0.00 H new ATOM 0 HB THR A 104 1.890 7.119 -0.903 1.00 0.00 H new ATOM 0 HG1 THR A 104 3.495 8.053 0.528 1.00 0.00 H new ATOM 0 HG21 THR A 104 2.013 9.562 -0.587 1.00 0.00 H new ATOM 0 HG22 THR A 104 0.338 9.014 -0.834 1.00 0.00 H new ATOM 0 HG23 THR A 104 0.905 9.433 0.800 1.00 0.00 H new ATOM 1540 N ILE A 105 -1.613 7.570 -0.188 1.00 0.00 N ATOM 1541 CA ILE A 105 -2.766 7.615 -1.078 1.00 0.00 C ATOM 1542 C ILE A 105 -3.190 9.053 -1.358 1.00 0.00 C ATOM 1543 O ILE A 105 -3.769 9.718 -0.499 1.00 0.00 O ATOM 1544 CB ILE A 105 -3.962 6.845 -0.488 1.00 0.00 C ATOM 1545 CG1 ILE A 105 -3.633 5.355 -0.377 1.00 0.00 C ATOM 1546 CG2 ILE A 105 -5.203 7.056 -1.344 1.00 0.00 C ATOM 1547 CD1 ILE A 105 -4.752 4.531 0.222 1.00 0.00 C ATOM 0 H ILE A 105 -1.605 8.295 0.529 1.00 0.00 H new ATOM 0 HA ILE A 105 -2.463 7.141 -2.011 1.00 0.00 H new ATOM 0 HB ILE A 105 -4.164 7.229 0.512 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -3.399 4.968 -1.369 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -2.737 5.234 0.232 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -6.040 6.505 -0.914 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -5.446 8.118 -1.377 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -5.013 6.696 -2.355 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -4.448 3.485 0.270 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -4.972 4.891 1.227 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -5.643 4.622 -0.399 1.00 0.00 H new ATOM 1559 N ARG A 106 -2.898 9.525 -2.566 1.00 0.00 N ATOM 1560 CA ARG A 106 -3.249 10.884 -2.959 1.00 0.00 C ATOM 1561 C ARG A 106 -4.445 10.884 -3.907 1.00 0.00 C ATOM 1562 O ARG A 106 -4.593 9.988 -4.737 1.00 0.00 O ATOM 1563 CB ARG A 106 -2.056 11.569 -3.628 1.00 0.00 C ATOM 1564 CG ARG A 106 -1.836 11.140 -5.069 1.00 0.00 C ATOM 1565 CD ARG A 106 -0.716 11.934 -5.722 1.00 0.00 C ATOM 1566 NE ARG A 106 0.490 11.959 -4.898 1.00 0.00 N ATOM 1567 CZ ARG A 106 1.514 12.776 -5.119 1.00 0.00 C ATOM 1568 NH1 ARG A 106 1.478 13.631 -6.131 1.00 0.00 N ATOM 1569 NH2 ARG A 106 2.576 12.739 -4.325 1.00 0.00 N ATOM 0 H ARG A 106 -2.420 8.987 -3.288 1.00 0.00 H new ATOM 0 HA ARG A 106 -3.519 11.437 -2.059 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -2.204 12.648 -3.598 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -1.155 11.355 -3.053 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -1.596 10.077 -5.101 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -2.758 11.276 -5.635 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -0.482 11.499 -6.694 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -1.053 12.955 -5.903 1.00 0.00 H new ATOM 0 HE ARG A 106 0.549 11.314 -4.110 1.00 0.00 H new ATOM 0 HH11 ARG A 106 0.662 13.663 -6.743 1.00 0.00 H new ATOM 0 HH12 ARG A 106 2.266 14.257 -6.298 1.00 0.00 H new ATOM 0 HH21 ARG A 106 2.607 12.083 -3.544 1.00 0.00 H new ATOM 0 HH22 ARG A 106 3.362 13.366 -4.495 1.00 0.00 H new ATOM 1583 N GLY A 107 -5.298 11.896 -3.776 1.00 0.00 N ATOM 1584 CA GLY A 107 -6.470 11.993 -4.627 1.00 0.00 C ATOM 1585 C GLY A 107 -7.088 13.377 -4.607 1.00 0.00 C ATOM 1586 O GLY A 107 -6.849 14.158 -3.685 1.00 0.00 O ATOM 0 H GLY A 107 -5.198 12.650 -3.096 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -6.195 11.736 -5.650 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -7.212 11.263 -4.303 1.00 0.00 H new ATOM 1590 N CYS A 108 -7.883 13.683 -5.626 1.00 0.00 N ATOM 1591 CA CYS A 108 -8.535 14.984 -5.723 1.00 0.00 C ATOM 1592 C CYS A 108 -10.051 14.839 -5.645 1.00 0.00 C ATOM 1593 O CYS A 108 -10.676 14.250 -6.527 1.00 0.00 O ATOM 1594 CB CYS A 108 -8.144 15.677 -7.029 1.00 0.00 C ATOM 1595 SG CYS A 108 -8.903 17.302 -7.258 1.00 0.00 S ATOM 0 H CYS A 108 -8.092 13.048 -6.397 1.00 0.00 H new ATOM 0 HA CYS A 108 -8.202 15.593 -4.883 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -7.060 15.787 -7.059 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -8.423 15.036 -7.866 1.00 0.00 H new ATOM 0 HG CYS A 108 -10.156 17.248 -6.915 1.00 0.00 H new ATOM 1601 N VAL A 109 -10.638 15.380 -4.581 1.00 0.00 N ATOM 1602 CA VAL A 109 -12.081 15.311 -4.386 1.00 0.00 C ATOM 1603 C VAL A 109 -12.789 16.446 -5.116 1.00 0.00 C ATOM 1604 O VAL A 109 -12.509 17.621 -4.877 1.00 0.00 O ATOM 1605 CB VAL A 109 -12.449 15.368 -2.892 1.00 0.00 C ATOM 1606 CG1 VAL A 109 -13.959 15.356 -2.712 1.00 0.00 C ATOM 1607 CG2 VAL A 109 -11.806 14.211 -2.141 1.00 0.00 C ATOM 0 H VAL A 109 -10.136 15.871 -3.841 1.00 0.00 H new ATOM 0 HA VAL A 109 -12.410 14.357 -4.797 1.00 0.00 H new ATOM 0 HB VAL A 109 -12.065 16.300 -2.477 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -14.199 15.397 -1.650 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -14.392 16.220 -3.215 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -14.369 14.442 -3.142 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -12.076 14.267 -1.087 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -12.158 13.267 -2.557 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -10.722 14.270 -2.241 1.00 0.00 H new ATOM 1617 N ILE A 110 -13.708 16.088 -6.007 1.00 0.00 N ATOM 1618 CA ILE A 110 -14.457 17.077 -6.771 1.00 0.00 C ATOM 1619 C ILE A 110 -15.955 16.796 -6.714 1.00 0.00 C ATOM 1620 O ILE A 110 -16.377 15.678 -6.424 1.00 0.00 O ATOM 1621 CB ILE A 110 -14.008 17.109 -8.244 1.00 0.00 C ATOM 1622 CG1 ILE A 110 -14.097 15.710 -8.857 1.00 0.00 C ATOM 1623 CG2 ILE A 110 -12.592 17.653 -8.354 1.00 0.00 C ATOM 1624 CD1 ILE A 110 -14.207 15.718 -10.366 1.00 0.00 C ATOM 0 H ILE A 110 -13.951 15.120 -6.217 1.00 0.00 H new ATOM 0 HA ILE A 110 -14.254 18.047 -6.317 1.00 0.00 H new ATOM 0 HB ILE A 110 -14.674 17.771 -8.798 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -13.215 15.139 -8.568 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -14.962 15.194 -8.440 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -12.289 17.669 -9.401 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -12.559 18.665 -7.951 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -11.912 17.015 -7.789 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -14.266 14.693 -10.732 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -15.104 16.261 -10.663 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -13.330 16.205 -10.792 1.00 0.00 H new ATOM 1636 N GLY A 111 -16.755 17.821 -6.994 1.00 0.00 N ATOM 1637 CA GLY A 111 -18.197 17.664 -6.971 1.00 0.00 C ATOM 1638 C GLY A 111 -18.897 18.583 -7.952 1.00 0.00 C ATOM 1639 O GLY A 111 -18.268 19.208 -8.806 1.00 0.00 O ATOM 0 H GLY A 111 -16.430 18.757 -7.236 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -18.450 16.630 -7.203 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -18.565 17.864 -5.965 1.00 0.00 H new ATOM 1643 N PRO A 112 -20.230 18.672 -7.838 1.00 0.00 N ATOM 1644 CA PRO A 112 -21.045 19.518 -8.716 1.00 0.00 C ATOM 1645 C PRO A 112 -20.824 21.005 -8.456 1.00 0.00 C ATOM 1646 O PRO A 112 -19.839 21.396 -7.829 1.00 0.00 O ATOM 1647 CB PRO A 112 -22.479 19.120 -8.360 1.00 0.00 C ATOM 1648 CG PRO A 112 -22.395 18.607 -6.964 1.00 0.00 C ATOM 1649 CD PRO A 112 -21.045 17.955 -6.844 1.00 0.00 C ATOM 0 HA PRO A 112 -20.797 19.373 -9.767 1.00 0.00 H new ATOM 0 HB2 PRO A 112 -23.155 19.972 -8.428 1.00 0.00 H new ATOM 0 HB3 PRO A 112 -22.858 18.357 -9.040 1.00 0.00 H new ATOM 0 HG2 PRO A 112 -22.503 19.417 -6.243 1.00 0.00 H new ATOM 0 HG3 PRO A 112 -23.193 17.893 -6.762 1.00 0.00 H new ATOM 0 HD2 PRO A 112 -20.636 18.059 -5.839 1.00 0.00 H new ATOM 0 HD3 PRO A 112 -21.094 16.888 -7.059 1.00 0.00 H new