USER MOD reduce.3.24.130724 H: found=0, std=0, add=822, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 825 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 18 CYS SG : rot 139:sc= 0.547 USER MOD Set 1.2: A 73 TYR OH : rot 180:sc= 0.498 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 35 CYS SG : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ -142:sc= -0.118 (180deg=-0.363) USER MOD Single : A 39 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 40 THR OG1 : rot 78:sc= 0.0446 USER MOD Single : A 42 CYS SG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 130:sc=-0.000371 USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 75 MET CE :methyl -151:sc= -0.251 (180deg=-1.19) USER MOD Single : A 77 THR OG1 : rot 99:sc= 1.25 USER MOD Single : A 78 MET CE :methyl 163:sc= -1.21 (180deg=-1.31) USER MOD Single : A 82 THR OG1 : rot 96:sc= 1.26 USER MOD Single : A 84 SER OG : rot 123:sc= 0.276 USER MOD Single : A 87 THR OG1 : rot 81:sc= 0.0622 USER MOD Single : A 88 SER OG : rot 180:sc= -0.044 USER MOD Single : A 90 CYS SG : rot 180:sc= 0 USER MOD Single : A 121 CYS SG : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot -73:sc= 1.01 USER MOD Single : A 128 MET CE :methyl -168:sc= -1.7 (180deg=-2.48) USER MOD ----------------------------------------------------------------- ATOM 55 N GLU A 6 11.843 5.730 -7.082 1.00 31.13 N ATOM 56 CA GLU A 6 12.527 5.582 -8.361 1.00 55.42 C ATOM 57 C GLU A 6 11.769 6.309 -9.469 1.00 64.45 C ATOM 58 O GLU A 6 12.293 7.208 -10.127 1.00 62.25 O ATOM 59 CB GLU A 6 12.677 4.102 -8.717 1.00 32.23 C ATOM 60 CG GLU A 6 12.644 3.828 -10.211 1.00 42.30 C ATOM 61 CD GLU A 6 13.134 2.436 -10.560 1.00 40.31 C ATOM 62 OE1 GLU A 6 12.718 1.474 -9.881 1.00 52.13 O ATOM 63 OE2 GLU A 6 13.933 2.309 -11.511 1.00 41.01 O ATOM 0 HA GLU A 6 13.518 6.027 -8.268 1.00 55.42 H new ATOM 0 HB2 GLU A 6 13.618 3.733 -8.309 1.00 32.23 H new ATOM 0 HB3 GLU A 6 11.878 3.539 -8.235 1.00 32.23 H new ATOM 0 HG2 GLU A 6 11.625 3.953 -10.577 1.00 42.30 H new ATOM 0 HG3 GLU A 6 13.260 4.566 -10.726 1.00 42.30 H new ATOM 70 N PRO A 7 10.507 5.910 -9.682 1.00 74.32 N ATOM 71 CA PRO A 7 9.650 6.508 -10.710 1.00 11.50 C ATOM 72 C PRO A 7 9.244 7.938 -10.366 1.00 21.51 C ATOM 73 O PRO A 7 8.959 8.744 -11.253 1.00 21.53 O ATOM 74 CB PRO A 7 8.423 5.593 -10.726 1.00 51.42 C ATOM 75 CG PRO A 7 8.384 4.988 -9.366 1.00 21.43 C ATOM 76 CD PRO A 7 9.818 4.844 -8.936 1.00 32.35 C ATOM 0 HA PRO A 7 10.157 6.580 -11.672 1.00 11.50 H new ATOM 0 HB2 PRO A 7 7.513 6.155 -10.936 1.00 51.42 H new ATOM 0 HB3 PRO A 7 8.510 4.828 -11.497 1.00 51.42 H new ATOM 0 HG2 PRO A 7 7.830 5.621 -8.673 1.00 21.43 H new ATOM 0 HG3 PRO A 7 7.883 4.020 -9.383 1.00 21.43 H new ATOM 0 HD2 PRO A 7 9.929 4.971 -7.859 1.00 32.35 H new ATOM 0 HD3 PRO A 7 10.215 3.859 -9.184 1.00 32.35 H new ATOM 84 N LEU A 8 9.220 8.246 -9.074 1.00 63.00 N ATOM 85 CA LEU A 8 8.850 9.579 -8.612 1.00 53.35 C ATOM 86 C LEU A 8 9.925 10.599 -8.974 1.00 52.13 C ATOM 87 O LEU A 8 9.690 11.807 -8.928 1.00 63.11 O ATOM 88 CB LEU A 8 8.626 9.573 -7.099 1.00 75.33 C ATOM 89 CG LEU A 8 7.640 10.611 -6.562 1.00 72.13 C ATOM 90 CD1 LEU A 8 6.390 9.932 -6.025 1.00 14.02 C ATOM 91 CD2 LEU A 8 8.295 11.459 -5.482 1.00 14.22 C ATOM 0 H LEU A 8 9.452 7.591 -8.328 1.00 63.00 H new ATOM 0 HA LEU A 8 7.923 9.864 -9.109 1.00 53.35 H new ATOM 0 HB2 LEU A 8 8.275 8.583 -6.808 1.00 75.33 H new ATOM 0 HB3 LEU A 8 9.587 9.727 -6.609 1.00 75.33 H new ATOM 0 HG LEU A 8 7.348 11.266 -7.383 1.00 72.13 H new ATOM 0 HD11 LEU A 8 5.700 10.686 -5.647 1.00 14.02 H new ATOM 0 HD12 LEU A 8 5.910 9.369 -6.825 1.00 14.02 H new ATOM 0 HD13 LEU A 8 6.663 9.253 -5.217 1.00 14.02 H new ATOM 0 HD21 LEU A 8 7.579 12.192 -5.111 1.00 14.22 H new ATOM 0 HD22 LEU A 8 8.616 10.818 -4.661 1.00 14.22 H new ATOM 0 HD23 LEU A 8 9.160 11.975 -5.899 1.00 14.22 H new ATOM 103 N PHE A 9 11.104 10.105 -9.336 1.00 71.25 N ATOM 104 CA PHE A 9 12.215 10.973 -9.708 1.00 23.12 C ATOM 105 C PHE A 9 11.867 11.807 -10.937 1.00 73.01 C ATOM 106 O PHE A 9 12.488 12.838 -11.198 1.00 35.22 O ATOM 107 CB PHE A 9 13.470 10.141 -9.981 1.00 4.41 C ATOM 108 CG PHE A 9 14.723 10.963 -10.083 1.00 44.32 C ATOM 109 CD1 PHE A 9 15.063 11.860 -9.083 1.00 51.34 C ATOM 110 CD2 PHE A 9 15.561 10.839 -11.180 1.00 5.24 C ATOM 111 CE1 PHE A 9 16.215 12.618 -9.174 1.00 65.12 C ATOM 112 CE2 PHE A 9 16.715 11.594 -11.276 1.00 24.33 C ATOM 113 CZ PHE A 9 17.042 12.485 -10.272 1.00 42.05 C ATOM 0 H PHE A 9 11.315 9.108 -9.380 1.00 71.25 H new ATOM 0 HA PHE A 9 12.409 11.649 -8.876 1.00 23.12 H new ATOM 0 HB2 PHE A 9 13.590 9.407 -9.184 1.00 4.41 H new ATOM 0 HB3 PHE A 9 13.333 9.585 -10.908 1.00 4.41 H new ATOM 0 HD1 PHE A 9 14.420 11.968 -8.222 1.00 51.34 H new ATOM 0 HD2 PHE A 9 15.310 10.145 -11.968 1.00 5.24 H new ATOM 0 HE1 PHE A 9 16.468 13.313 -8.387 1.00 65.12 H new ATOM 0 HE2 PHE A 9 17.361 11.487 -12.135 1.00 24.33 H new ATOM 0 HZ PHE A 9 17.943 13.076 -10.346 1.00 42.05 H new ATOM 123 N TYR A 10 10.870 11.353 -11.689 1.00 42.20 N ATOM 124 CA TYR A 10 10.440 12.055 -12.893 1.00 21.13 C ATOM 125 C TYR A 10 9.633 13.300 -12.538 1.00 50.14 C ATOM 126 O TYR A 10 10.017 14.421 -12.875 1.00 33.20 O ATOM 127 CB TYR A 10 9.606 11.128 -13.778 1.00 60.33 C ATOM 128 CG TYR A 10 10.040 11.122 -15.227 1.00 13.22 C ATOM 129 CD1 TYR A 10 11.059 10.285 -15.664 1.00 54.24 C ATOM 130 CD2 TYR A 10 9.429 11.954 -16.158 1.00 65.40 C ATOM 131 CE1 TYR A 10 11.458 10.278 -16.987 1.00 23.43 C ATOM 132 CE2 TYR A 10 9.822 11.952 -17.483 1.00 33.43 C ATOM 133 CZ TYR A 10 10.837 11.112 -17.892 1.00 12.31 C ATOM 134 OH TYR A 10 11.231 11.107 -19.210 1.00 62.43 O ATOM 0 H TYR A 10 10.345 10.502 -11.486 1.00 42.20 H new ATOM 0 HA TYR A 10 11.330 12.365 -13.440 1.00 21.13 H new ATOM 0 HB2 TYR A 10 9.666 10.113 -13.385 1.00 60.33 H new ATOM 0 HB3 TYR A 10 8.560 11.430 -13.722 1.00 60.33 H new ATOM 0 HD1 TYR A 10 11.547 9.629 -14.958 1.00 54.24 H new ATOM 0 HD2 TYR A 10 8.634 12.613 -15.841 1.00 65.40 H new ATOM 0 HE1 TYR A 10 12.253 9.622 -17.310 1.00 23.43 H new ATOM 0 HE2 TYR A 10 9.337 12.604 -18.194 1.00 33.43 H new ATOM 0 HH TYR A 10 10.692 11.751 -19.715 1.00 62.43 H new ATOM 144 N THR A 11 8.511 13.095 -11.855 1.00 50.51 N ATOM 145 CA THR A 11 7.648 14.199 -11.455 1.00 11.54 C ATOM 146 C THR A 11 8.437 15.274 -10.716 1.00 1.23 C ATOM 147 O THR A 11 8.179 16.467 -10.877 1.00 4.54 O ATOM 148 CB THR A 11 6.496 13.714 -10.554 1.00 42.13 C ATOM 149 OG1 THR A 11 5.773 14.836 -10.037 1.00 15.21 O ATOM 150 CG2 THR A 11 7.027 12.872 -9.404 1.00 13.13 C ATOM 0 H THR A 11 8.179 12.174 -11.567 1.00 50.51 H new ATOM 0 HA THR A 11 7.232 14.621 -12.369 1.00 11.54 H new ATOM 0 HB THR A 11 5.828 13.098 -11.156 1.00 42.13 H new ATOM 0 HG1 THR A 11 5.042 14.519 -9.467 1.00 15.21 H new ATOM 0 HG21 THR A 11 6.196 12.541 -8.781 1.00 13.13 H new ATOM 0 HG22 THR A 11 7.552 12.003 -9.801 1.00 13.13 H new ATOM 0 HG23 THR A 11 7.715 13.468 -8.804 1.00 13.13 H new ATOM 158 N ILE A 12 9.399 14.844 -9.906 1.00 61.15 N ATOM 159 CA ILE A 12 10.227 15.771 -9.144 1.00 71.45 C ATOM 160 C ILE A 12 11.064 16.648 -10.069 1.00 53.11 C ATOM 161 O ILE A 12 11.215 17.846 -9.835 1.00 54.44 O ATOM 162 CB ILE A 12 11.164 15.024 -8.177 1.00 61.52 C ATOM 163 CG1 ILE A 12 10.352 14.312 -7.093 1.00 51.11 C ATOM 164 CG2 ILE A 12 12.160 15.989 -7.553 1.00 12.54 C ATOM 165 CD1 ILE A 12 11.143 13.274 -6.329 1.00 71.52 C ATOM 0 H ILE A 12 9.624 13.860 -9.761 1.00 61.15 H new ATOM 0 HA ILE A 12 9.548 16.399 -8.567 1.00 71.45 H new ATOM 0 HB ILE A 12 11.719 14.274 -8.740 1.00 61.52 H new ATOM 0 HG12 ILE A 12 9.969 15.053 -6.392 1.00 51.11 H new ATOM 0 HG13 ILE A 12 9.488 13.832 -7.554 1.00 51.11 H new ATOM 0 HG21 ILE A 12 12.815 15.446 -6.872 1.00 12.54 H new ATOM 0 HG22 ILE A 12 12.757 16.454 -8.338 1.00 12.54 H new ATOM 0 HG23 ILE A 12 11.623 16.760 -7.001 1.00 12.54 H new ATOM 0 HD11 ILE A 12 10.504 12.810 -5.577 1.00 71.52 H new ATOM 0 HD12 ILE A 12 11.504 12.511 -7.019 1.00 71.52 H new ATOM 0 HD13 ILE A 12 11.992 13.751 -5.839 1.00 71.52 H new ATOM 177 N ASN A 13 11.604 16.042 -11.121 1.00 44.55 N ATOM 178 CA ASN A 13 12.425 16.769 -12.083 1.00 43.12 C ATOM 179 C ASN A 13 11.570 17.706 -12.930 1.00 51.42 C ATOM 180 O ASN A 13 12.090 18.563 -13.646 1.00 63.24 O ATOM 181 CB ASN A 13 13.176 15.789 -12.987 1.00 44.51 C ATOM 182 CG ASN A 13 14.678 15.995 -12.940 1.00 62.24 C ATOM 183 OD1 ASN A 13 15.374 15.388 -12.126 1.00 12.55 O ATOM 184 ND2 ASN A 13 15.185 16.854 -13.817 1.00 63.32 N ATOM 0 H ASN A 13 11.488 15.050 -11.329 1.00 44.55 H new ATOM 0 HA ASN A 13 13.147 17.368 -11.528 1.00 43.12 H new ATOM 0 HB2 ASN A 13 12.942 14.768 -12.685 1.00 44.51 H new ATOM 0 HB3 ASN A 13 12.828 15.906 -14.013 1.00 44.51 H new ATOM 0 HD21 ASN A 13 16.189 17.033 -13.834 1.00 63.32 H new ATOM 0 HD22 ASN A 13 14.570 17.335 -14.474 1.00 63.32 H new ATOM 191 N LEU A 14 10.255 17.539 -12.843 1.00 70.21 N ATOM 192 CA LEU A 14 9.326 18.370 -13.601 1.00 31.02 C ATOM 193 C LEU A 14 8.951 19.623 -12.815 1.00 61.33 C ATOM 194 O LEU A 14 8.629 20.659 -13.398 1.00 33.25 O ATOM 195 CB LEU A 14 8.066 17.575 -13.947 1.00 14.20 C ATOM 196 CG LEU A 14 7.599 17.656 -15.401 1.00 2.20 C ATOM 197 CD1 LEU A 14 7.246 16.273 -15.926 1.00 41.41 C ATOM 198 CD2 LEU A 14 6.410 18.597 -15.528 1.00 33.31 C ATOM 0 H LEU A 14 9.808 16.836 -12.255 1.00 70.21 H new ATOM 0 HA LEU A 14 9.820 18.676 -14.523 1.00 31.02 H new ATOM 0 HB2 LEU A 14 8.242 16.528 -13.701 1.00 14.20 H new ATOM 0 HB3 LEU A 14 7.255 17.921 -13.306 1.00 14.20 H new ATOM 0 HG LEU A 14 8.416 18.053 -16.003 1.00 2.20 H new ATOM 0 HD11 LEU A 14 6.916 16.350 -16.962 1.00 41.41 H new ATOM 0 HD12 LEU A 14 8.123 15.628 -15.872 1.00 41.41 H new ATOM 0 HD13 LEU A 14 6.445 15.848 -15.321 1.00 41.41 H new ATOM 0 HD21 LEU A 14 6.091 18.642 -16.569 1.00 33.31 H new ATOM 0 HD22 LEU A 14 5.588 18.230 -14.913 1.00 33.31 H new ATOM 0 HD23 LEU A 14 6.697 19.594 -15.193 1.00 33.31 H new ATOM 210 N ILE A 15 8.998 19.521 -11.491 1.00 71.34 N ATOM 211 CA ILE A 15 8.666 20.646 -10.627 1.00 5.42 C ATOM 212 C ILE A 15 9.831 21.626 -10.530 1.00 13.51 C ATOM 213 O ILE A 15 9.630 22.829 -10.357 1.00 30.15 O ATOM 214 CB ILE A 15 8.287 20.176 -9.210 1.00 60.33 C ATOM 215 CG1 ILE A 15 7.091 19.224 -9.269 1.00 72.50 C ATOM 216 CG2 ILE A 15 7.977 21.370 -8.321 1.00 11.34 C ATOM 217 CD1 ILE A 15 5.853 19.845 -9.877 1.00 61.15 C ATOM 0 H ILE A 15 9.263 18.671 -10.994 1.00 71.34 H new ATOM 0 HA ILE A 15 7.808 21.146 -11.076 1.00 5.42 H new ATOM 0 HB ILE A 15 9.134 19.640 -8.782 1.00 60.33 H new ATOM 0 HG12 ILE A 15 7.367 18.343 -9.848 1.00 72.50 H new ATOM 0 HG13 ILE A 15 6.858 18.883 -8.260 1.00 72.50 H new ATOM 0 HG21 ILE A 15 7.711 21.021 -7.323 1.00 11.34 H new ATOM 0 HG22 ILE A 15 8.854 22.014 -8.258 1.00 11.34 H new ATOM 0 HG23 ILE A 15 7.144 21.931 -8.743 1.00 11.34 H new ATOM 0 HD11 ILE A 15 5.046 19.113 -9.886 1.00 61.15 H new ATOM 0 HD12 ILE A 15 5.552 20.710 -9.286 1.00 61.15 H new ATOM 0 HD13 ILE A 15 6.068 20.161 -10.898 1.00 61.15 H new ATOM 229 N ILE A 16 11.047 21.105 -10.645 1.00 22.44 N ATOM 230 CA ILE A 16 12.244 21.934 -10.573 1.00 14.20 C ATOM 231 C ILE A 16 12.154 23.113 -11.537 1.00 30.44 C ATOM 232 O ILE A 16 12.246 24.276 -11.144 1.00 63.11 O ATOM 233 CB ILE A 16 13.512 21.121 -10.891 1.00 4.02 C ATOM 234 CG1 ILE A 16 14.079 20.499 -9.613 1.00 61.31 C ATOM 235 CG2 ILE A 16 14.553 22.004 -11.563 1.00 11.20 C ATOM 236 CD1 ILE A 16 14.851 21.477 -8.756 1.00 23.24 C ATOM 0 H ILE A 16 11.230 20.112 -10.789 1.00 22.44 H new ATOM 0 HA ILE A 16 12.309 22.307 -9.551 1.00 14.20 H new ATOM 0 HB ILE A 16 13.247 20.317 -11.578 1.00 4.02 H new ATOM 0 HG12 ILE A 16 13.260 20.083 -9.027 1.00 61.31 H new ATOM 0 HG13 ILE A 16 14.733 19.669 -9.882 1.00 61.31 H new ATOM 0 HG21 ILE A 16 15.444 21.415 -11.781 1.00 11.20 H new ATOM 0 HG22 ILE A 16 14.146 22.404 -12.492 1.00 11.20 H new ATOM 0 HG23 ILE A 16 14.816 22.827 -10.898 1.00 11.20 H new ATOM 0 HD11 ILE A 16 15.223 20.967 -7.868 1.00 23.24 H new ATOM 0 HD12 ILE A 16 15.691 21.875 -9.325 1.00 23.24 H new ATOM 0 HD13 ILE A 16 14.196 22.295 -8.457 1.00 23.24 H new ATOM 248 N PRO A 17 11.968 22.807 -12.829 1.00 53.03 N ATOM 249 CA PRO A 17 11.859 23.827 -13.876 1.00 51.41 C ATOM 250 C PRO A 17 10.563 24.624 -13.776 1.00 54.25 C ATOM 251 O PRO A 17 10.547 25.834 -14.007 1.00 62.13 O ATOM 252 CB PRO A 17 11.887 23.011 -15.171 1.00 12.50 C ATOM 253 CG PRO A 17 11.384 21.665 -14.781 1.00 34.41 C ATOM 254 CD PRO A 17 11.849 21.442 -13.368 1.00 74.14 C ATOM 0 HA PRO A 17 12.655 24.569 -13.807 1.00 51.41 H new ATOM 0 HB2 PRO A 17 11.257 23.462 -15.937 1.00 12.50 H new ATOM 0 HB3 PRO A 17 12.895 22.953 -15.581 1.00 12.50 H new ATOM 0 HG2 PRO A 17 10.297 21.621 -14.845 1.00 34.41 H new ATOM 0 HG3 PRO A 17 11.774 20.895 -15.446 1.00 34.41 H new ATOM 0 HD2 PRO A 17 11.135 20.846 -12.799 1.00 74.14 H new ATOM 0 HD3 PRO A 17 12.802 20.913 -13.337 1.00 74.14 H new ATOM 262 N CYS A 18 9.478 23.939 -13.431 1.00 51.44 N ATOM 263 CA CYS A 18 8.176 24.584 -13.302 1.00 11.15 C ATOM 264 C CYS A 18 8.261 25.803 -12.389 1.00 44.20 C ATOM 265 O CYS A 18 7.950 26.922 -12.799 1.00 24.42 O ATOM 266 CB CYS A 18 7.146 23.594 -12.755 1.00 52.34 C ATOM 267 SG CYS A 18 5.445 24.208 -12.784 1.00 22.12 S ATOM 0 H CYS A 18 9.474 22.938 -13.236 1.00 51.44 H new ATOM 0 HA CYS A 18 7.862 24.915 -14.292 1.00 11.15 H new ATOM 0 HB2 CYS A 18 7.199 22.673 -13.336 1.00 52.34 H new ATOM 0 HB3 CYS A 18 7.412 23.339 -11.729 1.00 52.34 H new ATOM 0 HG CYS A 18 4.645 23.252 -13.153 1.00 22.12 H new ATOM 273 N VAL A 19 8.684 25.579 -11.149 1.00 12.13 N ATOM 274 CA VAL A 19 8.810 26.659 -10.177 1.00 74.11 C ATOM 275 C VAL A 19 9.824 27.699 -10.640 1.00 21.35 C ATOM 276 O VAL A 19 9.569 28.902 -10.576 1.00 41.12 O ATOM 277 CB VAL A 19 9.232 26.125 -8.796 1.00 30.53 C ATOM 278 CG1 VAL A 19 9.194 27.236 -7.758 1.00 51.44 C ATOM 279 CG2 VAL A 19 8.341 24.964 -8.379 1.00 10.35 C ATOM 0 H VAL A 19 8.945 24.659 -10.794 1.00 12.13 H new ATOM 0 HA VAL A 19 7.828 27.125 -10.093 1.00 74.11 H new ATOM 0 HB VAL A 19 10.257 25.761 -8.865 1.00 30.53 H new ATOM 0 HG11 VAL A 19 9.495 26.839 -6.789 1.00 51.44 H new ATOM 0 HG12 VAL A 19 9.878 28.032 -8.052 1.00 51.44 H new ATOM 0 HG13 VAL A 19 8.182 27.634 -7.688 1.00 51.44 H new ATOM 0 HG21 VAL A 19 8.653 24.599 -7.401 1.00 10.35 H new ATOM 0 HG22 VAL A 19 7.306 25.300 -8.327 1.00 10.35 H new ATOM 0 HG23 VAL A 19 8.425 24.160 -9.110 1.00 10.35 H new ATOM 289 N LEU A 20 10.975 27.227 -11.105 1.00 45.42 N ATOM 290 CA LEU A 20 12.030 28.117 -11.580 1.00 22.43 C ATOM 291 C LEU A 20 11.498 29.076 -12.640 1.00 20.25 C ATOM 292 O LEU A 20 11.810 30.267 -12.625 1.00 74.01 O ATOM 293 CB LEU A 20 13.193 27.302 -12.150 1.00 53.21 C ATOM 294 CG LEU A 20 14.453 27.235 -11.287 1.00 12.15 C ATOM 295 CD1 LEU A 20 15.118 25.874 -11.417 1.00 74.42 C ATOM 296 CD2 LEU A 20 15.422 28.343 -11.671 1.00 3.21 C ATOM 0 H LEU A 20 11.202 26.234 -11.164 1.00 45.42 H new ATOM 0 HA LEU A 20 12.386 28.703 -10.733 1.00 22.43 H new ATOM 0 HB2 LEU A 20 12.844 26.285 -12.328 1.00 53.21 H new ATOM 0 HB3 LEU A 20 13.463 27.721 -13.120 1.00 53.21 H new ATOM 0 HG LEU A 20 14.164 27.377 -10.246 1.00 12.15 H new ATOM 0 HD11 LEU A 20 16.013 25.846 -10.796 1.00 74.42 H new ATOM 0 HD12 LEU A 20 14.425 25.098 -11.091 1.00 74.42 H new ATOM 0 HD13 LEU A 20 15.393 25.701 -12.457 1.00 74.42 H new ATOM 0 HD21 LEU A 20 16.313 28.280 -11.046 1.00 3.21 H new ATOM 0 HD22 LEU A 20 15.704 28.233 -12.718 1.00 3.21 H new ATOM 0 HD23 LEU A 20 14.944 29.312 -11.524 1.00 3.21 H new ATOM 308 N ILE A 21 10.693 28.549 -13.556 1.00 13.12 N ATOM 309 CA ILE A 21 10.115 29.359 -14.621 1.00 13.44 C ATOM 310 C ILE A 21 9.360 30.557 -14.052 1.00 61.45 C ATOM 311 O ILE A 21 9.552 31.691 -14.491 1.00 2.33 O ATOM 312 CB ILE A 21 9.157 28.534 -15.500 1.00 22.41 C ATOM 313 CG1 ILE A 21 9.948 27.707 -16.516 1.00 50.33 C ATOM 314 CG2 ILE A 21 8.167 29.447 -16.207 1.00 61.12 C ATOM 315 CD1 ILE A 21 9.372 26.329 -16.753 1.00 63.30 C ATOM 0 H ILE A 21 10.426 27.565 -13.582 1.00 13.12 H new ATOM 0 HA ILE A 21 10.944 29.712 -15.234 1.00 13.44 H new ATOM 0 HB ILE A 21 8.597 27.851 -14.861 1.00 22.41 H new ATOM 0 HG12 ILE A 21 9.982 28.246 -17.463 1.00 50.33 H new ATOM 0 HG13 ILE A 21 10.977 27.607 -16.169 1.00 50.33 H new ATOM 0 HG21 ILE A 21 7.497 28.849 -16.824 1.00 61.12 H new ATOM 0 HG22 ILE A 21 7.585 29.996 -15.466 1.00 61.12 H new ATOM 0 HG23 ILE A 21 8.709 30.152 -16.838 1.00 61.12 H new ATOM 0 HD11 ILE A 21 9.983 25.800 -17.484 1.00 63.30 H new ATOM 0 HD12 ILE A 21 9.363 25.772 -15.816 1.00 63.30 H new ATOM 0 HD13 ILE A 21 8.353 26.420 -17.130 1.00 63.30 H new ATOM 327 N THR A 22 8.501 30.297 -13.072 1.00 31.42 N ATOM 328 CA THR A 22 7.717 31.352 -12.442 1.00 45.12 C ATOM 329 C THR A 22 8.616 32.468 -11.923 1.00 2.35 C ATOM 330 O THR A 22 8.435 33.636 -12.269 1.00 23.34 O ATOM 331 CB THR A 22 6.872 30.805 -11.277 1.00 33.11 C ATOM 332 OG1 THR A 22 6.062 29.714 -11.729 1.00 71.04 O ATOM 333 CG2 THR A 22 5.984 31.894 -10.694 1.00 41.43 C ATOM 0 H THR A 22 8.330 29.364 -12.697 1.00 31.42 H new ATOM 0 HA THR A 22 7.051 31.751 -13.207 1.00 45.12 H new ATOM 0 HB THR A 22 7.550 30.456 -10.499 1.00 33.11 H new ATOM 0 HG1 THR A 22 5.529 29.371 -10.982 1.00 71.04 H new ATOM 0 HG21 THR A 22 5.397 31.484 -9.873 1.00 41.43 H new ATOM 0 HG22 THR A 22 6.605 32.710 -10.324 1.00 41.43 H new ATOM 0 HG23 THR A 22 5.314 32.270 -11.467 1.00 41.43 H new ATOM 341 N SER A 23 9.586 32.102 -11.090 1.00 53.13 N ATOM 342 CA SER A 23 10.511 33.074 -10.520 1.00 44.02 C ATOM 343 C SER A 23 11.144 33.928 -11.614 1.00 44.15 C ATOM 344 O SER A 23 11.311 35.138 -11.456 1.00 13.32 O ATOM 345 CB SER A 23 11.602 32.362 -9.718 1.00 63.55 C ATOM 346 OG SER A 23 12.891 32.810 -10.101 1.00 22.42 O ATOM 0 H SER A 23 9.751 31.140 -10.795 1.00 53.13 H new ATOM 0 HA SER A 23 9.948 33.727 -9.854 1.00 44.02 H new ATOM 0 HB2 SER A 23 11.452 32.543 -8.654 1.00 63.55 H new ATOM 0 HB3 SER A 23 11.527 31.286 -9.872 1.00 63.55 H new ATOM 0 HG SER A 23 13.571 32.341 -9.573 1.00 22.42 H new ATOM 352 N LEU A 24 11.496 33.290 -12.725 1.00 73.22 N ATOM 353 CA LEU A 24 12.111 33.990 -13.848 1.00 32.42 C ATOM 354 C LEU A 24 11.243 35.159 -14.302 1.00 61.10 C ATOM 355 O LEU A 24 11.753 36.216 -14.673 1.00 20.31 O ATOM 356 CB LEU A 24 12.337 33.025 -15.013 1.00 64.02 C ATOM 357 CG LEU A 24 13.795 32.716 -15.355 1.00 24.22 C ATOM 358 CD1 LEU A 24 14.084 31.234 -15.172 1.00 73.24 C ATOM 359 CD2 LEU A 24 14.114 33.152 -16.778 1.00 31.25 C ATOM 0 H LEU A 24 11.366 32.289 -12.872 1.00 73.22 H new ATOM 0 HA LEU A 24 13.073 34.383 -13.517 1.00 32.42 H new ATOM 0 HB2 LEU A 24 11.831 32.087 -14.785 1.00 64.02 H new ATOM 0 HB3 LEU A 24 11.856 33.438 -15.900 1.00 64.02 H new ATOM 0 HG LEU A 24 14.434 33.277 -14.673 1.00 24.22 H new ATOM 0 HD11 LEU A 24 15.126 31.033 -15.420 1.00 73.24 H new ATOM 0 HD12 LEU A 24 13.897 30.952 -14.136 1.00 73.24 H new ATOM 0 HD13 LEU A 24 13.436 30.653 -15.829 1.00 73.24 H new ATOM 0 HD21 LEU A 24 15.156 32.924 -17.003 1.00 31.25 H new ATOM 0 HD22 LEU A 24 13.467 32.620 -17.475 1.00 31.25 H new ATOM 0 HD23 LEU A 24 13.948 34.225 -16.876 1.00 31.25 H new ATOM 371 N ALA A 25 9.929 34.962 -14.268 1.00 42.21 N ATOM 372 CA ALA A 25 8.991 36.002 -14.672 1.00 75.42 C ATOM 373 C ALA A 25 8.919 37.112 -13.630 1.00 2.32 C ATOM 374 O ALA A 25 8.576 38.252 -13.946 1.00 61.11 O ATOM 375 CB ALA A 25 7.611 35.405 -14.905 1.00 75.25 C ATOM 0 H ALA A 25 9.490 34.092 -13.965 1.00 42.21 H new ATOM 0 HA ALA A 25 9.350 36.438 -15.604 1.00 75.42 H new ATOM 0 HB1 ALA A 25 6.920 36.192 -15.206 1.00 75.25 H new ATOM 0 HB2 ALA A 25 7.668 34.652 -15.691 1.00 75.25 H new ATOM 0 HB3 ALA A 25 7.255 34.942 -13.985 1.00 75.25 H new ATOM 381 N ILE A 26 9.245 36.773 -12.387 1.00 74.21 N ATOM 382 CA ILE A 26 9.217 37.742 -11.299 1.00 5.30 C ATOM 383 C ILE A 26 10.513 38.546 -11.246 1.00 75.41 C ATOM 384 O ILE A 26 10.499 39.773 -11.349 1.00 44.01 O ATOM 385 CB ILE A 26 8.997 37.055 -9.938 1.00 52.33 C ATOM 386 CG1 ILE A 26 7.585 36.470 -9.861 1.00 63.20 C ATOM 387 CG2 ILE A 26 9.230 38.041 -8.803 1.00 41.13 C ATOM 388 CD1 ILE A 26 7.411 35.457 -8.751 1.00 1.32 C ATOM 0 H ILE A 26 9.532 35.834 -12.109 1.00 74.21 H new ATOM 0 HA ILE A 26 8.382 38.414 -11.497 1.00 5.30 H new ATOM 0 HB ILE A 26 9.714 36.240 -9.838 1.00 52.33 H new ATOM 0 HG12 ILE A 26 6.872 37.281 -9.717 1.00 63.20 H new ATOM 0 HG13 ILE A 26 7.343 35.999 -10.814 1.00 63.20 H new ATOM 0 HG21 ILE A 26 9.071 37.541 -7.848 1.00 41.13 H new ATOM 0 HG22 ILE A 26 10.253 38.415 -8.850 1.00 41.13 H new ATOM 0 HG23 ILE A 26 8.534 38.874 -8.896 1.00 41.13 H new ATOM 0 HD11 ILE A 26 6.387 35.084 -8.756 1.00 1.32 H new ATOM 0 HD12 ILE A 26 8.100 34.626 -8.905 1.00 1.32 H new ATOM 0 HD13 ILE A 26 7.621 35.929 -7.791 1.00 1.32 H new ATOM 400 N LEU A 27 11.630 37.846 -11.087 1.00 22.43 N ATOM 401 CA LEU A 27 12.936 38.493 -11.022 1.00 51.21 C ATOM 402 C LEU A 27 13.152 39.403 -12.227 1.00 5.42 C ATOM 403 O LEU A 27 13.857 40.409 -12.140 1.00 24.13 O ATOM 404 CB LEU A 27 14.046 37.442 -10.956 1.00 54.34 C ATOM 405 CG LEU A 27 15.032 37.580 -9.796 1.00 61.43 C ATOM 406 CD1 LEU A 27 15.768 36.269 -9.564 1.00 2.33 C ATOM 407 CD2 LEU A 27 16.018 38.707 -10.065 1.00 62.03 C ATOM 0 H LEU A 27 11.658 36.830 -11.001 1.00 22.43 H new ATOM 0 HA LEU A 27 12.968 39.102 -10.119 1.00 51.21 H new ATOM 0 HB2 LEU A 27 13.583 36.457 -10.898 1.00 54.34 H new ATOM 0 HB3 LEU A 27 14.607 37.476 -11.890 1.00 54.34 H new ATOM 0 HG LEU A 27 14.471 37.823 -8.894 1.00 61.43 H new ATOM 0 HD11 LEU A 27 16.466 36.385 -8.735 1.00 2.33 H new ATOM 0 HD12 LEU A 27 15.049 35.485 -9.326 1.00 2.33 H new ATOM 0 HD13 LEU A 27 16.317 35.996 -10.465 1.00 2.33 H new ATOM 0 HD21 LEU A 27 16.712 38.791 -9.229 1.00 62.03 H new ATOM 0 HD22 LEU A 27 16.574 38.494 -10.978 1.00 62.03 H new ATOM 0 HD23 LEU A 27 15.475 39.645 -10.181 1.00 62.03 H new ATOM 419 N VAL A 28 12.540 39.045 -13.351 1.00 33.14 N ATOM 420 CA VAL A 28 12.663 39.831 -14.573 1.00 35.15 C ATOM 421 C VAL A 28 11.731 41.037 -14.546 1.00 11.41 C ATOM 422 O VAL A 28 12.119 42.143 -14.923 1.00 11.30 O ATOM 423 CB VAL A 28 12.350 38.982 -15.819 1.00 42.34 C ATOM 424 CG1 VAL A 28 11.995 39.876 -16.998 1.00 72.41 C ATOM 425 CG2 VAL A 28 13.528 38.081 -16.159 1.00 11.32 C ATOM 0 H VAL A 28 11.954 38.215 -13.441 1.00 33.14 H new ATOM 0 HA VAL A 28 13.696 40.175 -14.627 1.00 35.15 H new ATOM 0 HB VAL A 28 11.489 38.350 -15.600 1.00 42.34 H new ATOM 0 HG11 VAL A 28 11.777 39.259 -17.870 1.00 72.41 H new ATOM 0 HG12 VAL A 28 11.119 40.475 -16.749 1.00 72.41 H new ATOM 0 HG13 VAL A 28 12.834 40.535 -17.221 1.00 72.41 H new ATOM 0 HG21 VAL A 28 13.290 37.488 -17.042 1.00 11.32 H new ATOM 0 HG22 VAL A 28 14.408 38.692 -16.359 1.00 11.32 H new ATOM 0 HG23 VAL A 28 13.732 37.416 -15.320 1.00 11.32 H new ATOM 435 N PHE A 29 10.500 40.817 -14.097 1.00 54.42 N ATOM 436 CA PHE A 29 9.511 41.887 -14.021 1.00 61.24 C ATOM 437 C PHE A 29 9.854 42.866 -12.903 1.00 44.40 C ATOM 438 O PHE A 29 9.343 43.986 -12.865 1.00 32.34 O ATOM 439 CB PHE A 29 8.115 41.304 -13.794 1.00 13.24 C ATOM 440 CG PHE A 29 7.395 40.958 -15.066 1.00 12.05 C ATOM 441 CD1 PHE A 29 8.083 40.426 -16.144 1.00 31.52 C ATOM 442 CD2 PHE A 29 6.030 41.166 -15.183 1.00 71.31 C ATOM 443 CE1 PHE A 29 7.423 40.106 -17.316 1.00 24.54 C ATOM 444 CE2 PHE A 29 5.365 40.847 -16.352 1.00 50.21 C ATOM 445 CZ PHE A 29 6.063 40.318 -17.420 1.00 73.31 C ATOM 0 H PHE A 29 10.163 39.908 -13.780 1.00 54.42 H new ATOM 0 HA PHE A 29 9.522 42.427 -14.968 1.00 61.24 H new ATOM 0 HB2 PHE A 29 8.200 40.408 -13.179 1.00 13.24 H new ATOM 0 HB3 PHE A 29 7.518 42.021 -13.231 1.00 13.24 H new ATOM 0 HD1 PHE A 29 9.147 40.259 -16.068 1.00 31.52 H new ATOM 0 HD2 PHE A 29 5.480 41.582 -14.352 1.00 71.31 H new ATOM 0 HE1 PHE A 29 7.971 39.691 -18.149 1.00 24.54 H new ATOM 0 HE2 PHE A 29 4.300 41.011 -16.430 1.00 50.21 H new ATOM 0 HZ PHE A 29 5.545 40.071 -18.335 1.00 73.31 H new ATOM 455 N TYR A 30 10.723 42.437 -11.995 1.00 22.23 N ATOM 456 CA TYR A 30 11.133 43.274 -10.873 1.00 61.33 C ATOM 457 C TYR A 30 12.367 44.097 -11.230 1.00 62.42 C ATOM 458 O TYR A 30 12.579 45.185 -10.693 1.00 64.32 O ATOM 459 CB TYR A 30 11.420 42.410 -9.644 1.00 1.43 C ATOM 460 CG TYR A 30 10.490 42.681 -8.483 1.00 12.50 C ATOM 461 CD1 TYR A 30 9.119 42.495 -8.608 1.00 55.24 C ATOM 462 CD2 TYR A 30 10.982 43.125 -7.262 1.00 35.35 C ATOM 463 CE1 TYR A 30 8.264 42.742 -7.551 1.00 5.10 C ATOM 464 CE2 TYR A 30 10.135 43.373 -6.198 1.00 62.33 C ATOM 465 CZ TYR A 30 8.778 43.180 -6.348 1.00 14.20 C ATOM 466 OH TYR A 30 7.931 43.428 -5.292 1.00 20.43 O ATOM 0 H TYR A 30 11.157 41.514 -12.014 1.00 22.23 H new ATOM 0 HA TYR A 30 10.316 43.958 -10.645 1.00 61.33 H new ATOM 0 HB2 TYR A 30 11.343 41.359 -9.923 1.00 1.43 H new ATOM 0 HB3 TYR A 30 12.448 42.580 -9.323 1.00 1.43 H new ATOM 0 HD1 TYR A 30 8.714 42.151 -9.548 1.00 55.24 H new ATOM 0 HD2 TYR A 30 12.044 43.279 -7.142 1.00 35.35 H new ATOM 0 HE1 TYR A 30 7.200 42.593 -7.666 1.00 5.10 H new ATOM 0 HE2 TYR A 30 10.534 43.716 -5.255 1.00 62.33 H new ATOM 0 HH TYR A 30 8.452 43.729 -4.518 1.00 20.43 H new ATOM 476 N LEU A 31 13.178 43.570 -12.141 1.00 24.53 N ATOM 477 CA LEU A 31 14.392 44.254 -12.572 1.00 3.11 C ATOM 478 C LEU A 31 14.414 44.421 -14.088 1.00 23.51 C ATOM 479 O LEU A 31 15.157 43.745 -14.800 1.00 43.14 O ATOM 480 CB LEU A 31 15.629 43.478 -12.114 1.00 53.35 C ATOM 481 CG LEU A 31 16.117 43.769 -10.695 1.00 14.32 C ATOM 482 CD1 LEU A 31 16.002 42.527 -9.826 1.00 34.33 C ATOM 483 CD2 LEU A 31 17.551 44.276 -10.717 1.00 64.13 C ATOM 0 H LEU A 31 13.017 42.671 -12.595 1.00 24.53 H new ATOM 0 HA LEU A 31 14.403 45.244 -12.116 1.00 3.11 H new ATOM 0 HB2 LEU A 31 15.414 42.412 -12.191 1.00 53.35 H new ATOM 0 HB3 LEU A 31 16.443 43.690 -12.807 1.00 53.35 H new ATOM 0 HG LEU A 31 15.485 44.547 -10.267 1.00 14.32 H new ATOM 0 HD11 LEU A 31 16.354 42.753 -8.820 1.00 34.33 H new ATOM 0 HD12 LEU A 31 14.961 42.208 -9.783 1.00 34.33 H new ATOM 0 HD13 LEU A 31 16.609 41.728 -10.251 1.00 34.33 H new ATOM 0 HD21 LEU A 31 17.881 44.478 -9.698 1.00 64.13 H new ATOM 0 HD22 LEU A 31 18.197 43.521 -11.165 1.00 64.13 H new ATOM 0 HD23 LEU A 31 17.604 45.193 -11.304 1.00 64.13 H new ATOM 495 N PRO A 32 13.582 45.343 -14.594 1.00 63.44 N ATOM 496 CA PRO A 32 13.490 45.622 -16.031 1.00 33.35 C ATOM 497 C PRO A 32 14.739 46.311 -16.569 1.00 12.01 C ATOM 498 O PRO A 32 14.764 47.531 -16.734 1.00 20.44 O ATOM 499 CB PRO A 32 12.279 46.552 -16.134 1.00 12.43 C ATOM 500 CG PRO A 32 12.188 47.206 -14.798 1.00 22.42 C ATOM 501 CD PRO A 32 12.668 46.184 -13.804 1.00 43.31 C ATOM 0 HA PRO A 32 13.395 44.709 -16.619 1.00 33.35 H new ATOM 0 HB2 PRO A 32 12.412 47.288 -16.927 1.00 12.43 H new ATOM 0 HB3 PRO A 32 11.371 45.995 -16.365 1.00 12.43 H new ATOM 0 HG2 PRO A 32 12.803 48.105 -14.761 1.00 22.42 H new ATOM 0 HG3 PRO A 32 11.164 47.511 -14.581 1.00 22.42 H new ATOM 0 HD2 PRO A 32 13.179 46.651 -12.962 1.00 43.31 H new ATOM 0 HD3 PRO A 32 11.842 45.604 -13.393 1.00 43.31 H new ATOM 509 N SER A 33 15.773 45.522 -16.842 1.00 3.32 N ATOM 510 CA SER A 33 17.027 46.058 -17.359 1.00 23.25 C ATOM 511 C SER A 33 16.886 46.454 -18.825 1.00 75.21 C ATOM 512 O SER A 33 15.927 46.067 -19.494 1.00 11.40 O ATOM 513 CB SER A 33 18.149 45.029 -17.203 1.00 34.35 C ATOM 514 OG SER A 33 18.752 45.122 -15.924 1.00 32.34 O ATOM 0 H SER A 33 15.767 44.510 -16.714 1.00 3.32 H new ATOM 0 HA SER A 33 17.277 46.949 -16.783 1.00 23.25 H new ATOM 0 HB2 SER A 33 17.749 44.025 -17.348 1.00 34.35 H new ATOM 0 HB3 SER A 33 18.901 45.187 -17.976 1.00 34.35 H new ATOM 0 HG SER A 33 19.464 44.453 -15.849 1.00 32.34 H new ATOM 520 N ASP A 34 17.847 47.227 -19.318 1.00 32.00 N ATOM 521 CA ASP A 34 17.831 47.676 -20.705 1.00 62.45 C ATOM 522 C ASP A 34 18.575 46.692 -21.603 1.00 61.31 C ATOM 523 O ASP A 34 18.832 46.976 -22.774 1.00 1.15 O ATOM 524 CB ASP A 34 18.459 49.066 -20.821 1.00 75.45 C ATOM 525 CG ASP A 34 18.318 49.872 -19.546 1.00 4.35 C ATOM 526 OD1 ASP A 34 17.208 50.382 -19.284 1.00 64.30 O ATOM 527 OD2 ASP A 34 19.319 49.994 -18.808 1.00 34.40 O ATOM 0 H ASP A 34 18.647 47.556 -18.778 1.00 32.00 H new ATOM 0 HA ASP A 34 16.793 47.726 -21.033 1.00 62.45 H new ATOM 0 HB2 ASP A 34 19.516 48.965 -21.069 1.00 75.45 H new ATOM 0 HB3 ASP A 34 17.989 49.606 -21.643 1.00 75.45 H new ATOM 532 N CYS A 35 18.919 45.535 -21.047 1.00 52.32 N ATOM 533 CA CYS A 35 19.635 44.510 -21.797 1.00 24.41 C ATOM 534 C CYS A 35 18.662 43.591 -22.528 1.00 30.42 C ATOM 535 O CYS A 35 19.064 42.596 -23.130 1.00 43.32 O ATOM 536 CB CYS A 35 20.523 43.690 -20.859 1.00 63.05 C ATOM 537 SG CYS A 35 21.868 44.634 -20.104 1.00 33.34 S ATOM 0 H CYS A 35 18.714 45.284 -20.080 1.00 52.32 H new ATOM 0 HA CYS A 35 20.262 45.007 -22.537 1.00 24.41 H new ATOM 0 HB2 CYS A 35 19.904 43.265 -20.069 1.00 63.05 H new ATOM 0 HB3 CYS A 35 20.948 42.855 -21.416 1.00 63.05 H new ATOM 0 HG CYS A 35 22.561 43.856 -19.327 1.00 33.34 H new ATOM 543 N GLY A 36 17.378 43.930 -22.468 1.00 73.15 N ATOM 544 CA GLY A 36 16.366 43.124 -23.127 1.00 44.23 C ATOM 545 C GLY A 36 16.029 41.867 -22.350 1.00 1.52 C ATOM 546 O GLY A 36 15.611 40.865 -22.929 1.00 45.51 O ATOM 0 H GLY A 36 17.020 44.748 -21.975 1.00 73.15 H new ATOM 0 HA2 GLY A 36 15.462 43.719 -23.260 1.00 44.23 H new ATOM 0 HA3 GLY A 36 16.716 42.849 -24.122 1.00 44.23 H new ATOM 550 N GLU A 37 16.212 41.920 -21.034 1.00 41.31 N ATOM 551 CA GLU A 37 15.926 40.776 -20.177 1.00 62.32 C ATOM 552 C GLU A 37 14.445 40.414 -20.229 1.00 73.32 C ATOM 553 O GLU A 37 14.066 39.265 -20.002 1.00 31.54 O ATOM 554 CB GLU A 37 16.339 41.075 -18.734 1.00 61.35 C ATOM 555 CG GLU A 37 16.612 39.829 -17.909 1.00 31.22 C ATOM 556 CD GLU A 37 17.797 39.994 -16.977 1.00 15.43 C ATOM 557 OE1 GLU A 37 17.615 40.572 -15.884 1.00 51.14 O ATOM 558 OE2 GLU A 37 18.904 39.547 -17.339 1.00 65.02 O ATOM 0 H GLU A 37 16.557 42.742 -20.539 1.00 41.31 H new ATOM 0 HA GLU A 37 16.503 39.927 -20.544 1.00 62.32 H new ATOM 0 HB2 GLU A 37 17.233 41.698 -18.743 1.00 61.35 H new ATOM 0 HB3 GLU A 37 15.551 41.654 -18.252 1.00 61.35 H new ATOM 0 HG2 GLU A 37 15.726 39.584 -17.324 1.00 31.22 H new ATOM 0 HG3 GLU A 37 16.795 38.988 -18.578 1.00 31.22 H new ATOM 565 N LYS A 38 13.610 41.403 -20.530 1.00 3.13 N ATOM 566 CA LYS A 38 12.170 41.191 -20.613 1.00 1.31 C ATOM 567 C LYS A 38 11.829 40.202 -21.722 1.00 72.15 C ATOM 568 O LYS A 38 11.154 39.200 -21.487 1.00 53.24 O ATOM 569 CB LYS A 38 11.452 42.520 -20.861 1.00 30.21 C ATOM 570 CG LYS A 38 11.826 43.608 -19.869 1.00 34.40 C ATOM 571 CD LYS A 38 11.677 43.129 -18.434 1.00 40.25 C ATOM 572 CE LYS A 38 10.298 42.539 -18.184 1.00 31.22 C ATOM 573 NZ LYS A 38 9.213 43.448 -18.646 1.00 11.22 N ATOM 0 H LYS A 38 13.906 42.360 -20.721 1.00 3.13 H new ATOM 0 HA LYS A 38 11.834 40.775 -19.663 1.00 1.31 H new ATOM 0 HB2 LYS A 38 11.682 42.865 -21.869 1.00 30.21 H new ATOM 0 HB3 LYS A 38 10.375 42.355 -20.818 1.00 30.21 H new ATOM 0 HG2 LYS A 38 12.855 43.923 -20.044 1.00 34.40 H new ATOM 0 HG3 LYS A 38 11.194 44.481 -20.030 1.00 34.40 H new ATOM 0 HD2 LYS A 38 12.439 42.380 -18.218 1.00 40.25 H new ATOM 0 HD3 LYS A 38 11.847 43.962 -17.752 1.00 40.25 H new ATOM 0 HE2 LYS A 38 10.214 41.582 -18.699 1.00 31.22 H new ATOM 0 HE3 LYS A 38 10.176 42.340 -17.119 1.00 31.22 H new ATOM 0 HZ1 LYS A 38 8.418 43.408 -17.976 1.00 11.22 H new ATOM 0 HZ2 LYS A 38 9.574 44.422 -18.697 1.00 11.22 H new ATOM 0 HZ3 LYS A 38 8.887 43.150 -19.588 1.00 11.22 H new ATOM 587 N MET A 39 12.301 40.489 -22.931 1.00 51.21 N ATOM 588 CA MET A 39 12.047 39.622 -24.076 1.00 43.41 C ATOM 589 C MET A 39 12.538 38.204 -23.803 1.00 75.12 C ATOM 590 O MET A 39 11.841 37.229 -24.089 1.00 1.14 O ATOM 591 CB MET A 39 12.732 40.179 -25.326 1.00 14.30 C ATOM 592 CG MET A 39 12.178 41.522 -25.775 1.00 34.31 C ATOM 593 SD MET A 39 12.557 41.888 -27.499 1.00 41.21 S ATOM 594 CE MET A 39 11.250 43.047 -27.895 1.00 35.52 C ATOM 0 H MET A 39 12.861 41.315 -23.143 1.00 51.21 H new ATOM 0 HA MET A 39 10.971 39.589 -24.244 1.00 43.41 H new ATOM 0 HB2 MET A 39 13.799 40.283 -25.130 1.00 14.30 H new ATOM 0 HB3 MET A 39 12.626 39.461 -26.139 1.00 14.30 H new ATOM 0 HG2 MET A 39 11.097 41.530 -25.635 1.00 34.31 H new ATOM 0 HG3 MET A 39 12.587 42.309 -25.142 1.00 34.31 H new ATOM 0 HE1 MET A 39 11.349 43.367 -28.932 1.00 35.52 H new ATOM 0 HE2 MET A 39 10.282 42.566 -27.754 1.00 35.52 H new ATOM 0 HE3 MET A 39 11.322 43.915 -27.239 1.00 35.52 H new ATOM 604 N THR A 40 13.741 38.095 -23.249 1.00 20.40 N ATOM 605 CA THR A 40 14.325 36.796 -22.939 1.00 73.41 C ATOM 606 C THR A 40 13.413 35.987 -22.023 1.00 52.52 C ATOM 607 O THR A 40 13.243 34.781 -22.206 1.00 54.34 O ATOM 608 CB THR A 40 15.704 36.945 -22.270 1.00 20.32 C ATOM 609 OG1 THR A 40 16.560 37.751 -23.087 1.00 24.23 O ATOM 610 CG2 THR A 40 16.345 35.584 -22.042 1.00 41.15 C ATOM 0 H THR A 40 14.330 38.891 -23.006 1.00 20.40 H new ATOM 0 HA THR A 40 14.444 36.269 -23.886 1.00 73.41 H new ATOM 0 HB THR A 40 15.564 37.429 -21.303 1.00 20.32 H new ATOM 0 HG1 THR A 40 16.323 38.695 -22.977 1.00 24.23 H new ATOM 0 HG21 THR A 40 17.318 35.715 -21.568 1.00 41.15 H new ATOM 0 HG22 THR A 40 15.705 34.984 -21.396 1.00 41.15 H new ATOM 0 HG23 THR A 40 16.472 35.077 -22.998 1.00 41.15 H new ATOM 618 N LEU A 41 12.827 36.658 -21.037 1.00 45.43 N ATOM 619 CA LEU A 41 11.931 36.002 -20.092 1.00 52.01 C ATOM 620 C LEU A 41 10.789 35.302 -20.821 1.00 73.23 C ATOM 621 O LEU A 41 10.602 34.092 -20.687 1.00 24.22 O ATOM 622 CB LEU A 41 11.369 37.022 -19.100 1.00 74.30 C ATOM 623 CG LEU A 41 10.345 36.488 -18.097 1.00 4.33 C ATOM 624 CD1 LEU A 41 8.939 36.577 -18.670 1.00 5.54 C ATOM 625 CD2 LEU A 41 10.676 35.054 -17.710 1.00 14.13 C ATOM 0 H LEU A 41 12.957 37.656 -20.872 1.00 45.43 H new ATOM 0 HA LEU A 41 12.504 35.252 -19.547 1.00 52.01 H new ATOM 0 HB2 LEU A 41 12.201 37.455 -18.544 1.00 74.30 H new ATOM 0 HB3 LEU A 41 10.907 37.832 -19.665 1.00 74.30 H new ATOM 0 HG LEU A 41 10.388 37.105 -17.199 1.00 4.33 H new ATOM 0 HD11 LEU A 41 8.224 36.193 -17.942 1.00 5.54 H new ATOM 0 HD12 LEU A 41 8.703 37.617 -18.896 1.00 5.54 H new ATOM 0 HD13 LEU A 41 8.880 35.985 -19.584 1.00 5.54 H new ATOM 0 HD21 LEU A 41 9.937 34.690 -16.996 1.00 14.13 H new ATOM 0 HD22 LEU A 41 10.661 34.424 -18.600 1.00 14.13 H new ATOM 0 HD23 LEU A 41 11.667 35.019 -17.257 1.00 14.13 H new ATOM 637 N CYS A 42 10.029 36.069 -21.594 1.00 53.44 N ATOM 638 CA CYS A 42 8.905 35.522 -22.347 1.00 2.52 C ATOM 639 C CYS A 42 9.349 34.344 -23.207 1.00 43.24 C ATOM 640 O CYS A 42 8.598 33.389 -23.405 1.00 33.14 O ATOM 641 CB CYS A 42 8.279 36.605 -23.227 1.00 33.10 C ATOM 642 SG CYS A 42 7.300 35.961 -24.604 1.00 40.45 S ATOM 0 H CYS A 42 10.170 37.072 -21.716 1.00 53.44 H new ATOM 0 HA CYS A 42 8.160 35.168 -21.635 1.00 2.52 H new ATOM 0 HB2 CYS A 42 7.644 37.239 -22.608 1.00 33.10 H new ATOM 0 HB3 CYS A 42 9.072 37.239 -23.624 1.00 33.10 H new ATOM 0 HG CYS A 42 6.810 36.952 -25.289 1.00 40.45 H new ATOM 648 N ILE A 43 10.574 34.420 -23.718 1.00 75.34 N ATOM 649 CA ILE A 43 11.117 33.360 -24.558 1.00 71.34 C ATOM 650 C ILE A 43 11.457 32.124 -23.733 1.00 31.34 C ATOM 651 O ILE A 43 11.363 30.996 -24.217 1.00 21.12 O ATOM 652 CB ILE A 43 12.379 33.826 -25.307 1.00 43.22 C ATOM 653 CG1 ILE A 43 12.023 34.910 -26.327 1.00 73.51 C ATOM 654 CG2 ILE A 43 13.054 32.648 -25.993 1.00 25.55 C ATOM 655 CD1 ILE A 43 13.167 35.850 -26.634 1.00 53.33 C ATOM 0 H ILE A 43 11.208 35.204 -23.565 1.00 75.34 H new ATOM 0 HA ILE A 43 10.345 33.108 -25.285 1.00 71.34 H new ATOM 0 HB ILE A 43 13.076 34.249 -24.584 1.00 43.22 H new ATOM 0 HG12 ILE A 43 11.696 34.434 -27.252 1.00 73.51 H new ATOM 0 HG13 ILE A 43 11.179 35.488 -25.951 1.00 73.51 H new ATOM 0 HG21 ILE A 43 13.944 32.994 -26.518 1.00 25.55 H new ATOM 0 HG22 ILE A 43 13.338 31.906 -25.247 1.00 25.55 H new ATOM 0 HG23 ILE A 43 12.364 32.198 -26.707 1.00 25.55 H new ATOM 0 HD11 ILE A 43 12.843 36.592 -27.364 1.00 53.33 H new ATOM 0 HD12 ILE A 43 13.480 36.354 -25.719 1.00 53.33 H new ATOM 0 HD13 ILE A 43 14.005 35.283 -27.040 1.00 53.33 H new ATOM 667 N SER A 44 11.851 32.344 -22.482 1.00 73.03 N ATOM 668 CA SER A 44 12.207 31.248 -21.589 1.00 12.03 C ATOM 669 C SER A 44 10.977 30.421 -21.227 1.00 30.22 C ATOM 670 O SER A 44 10.979 29.196 -21.353 1.00 51.22 O ATOM 671 CB SER A 44 12.862 31.791 -20.318 1.00 24.15 C ATOM 672 OG SER A 44 12.609 30.943 -19.211 1.00 20.12 O ATOM 0 H SER A 44 11.932 33.271 -22.065 1.00 73.03 H new ATOM 0 HA SER A 44 12.916 30.604 -22.109 1.00 12.03 H new ATOM 0 HB2 SER A 44 13.937 31.884 -20.471 1.00 24.15 H new ATOM 0 HB3 SER A 44 12.482 32.791 -20.108 1.00 24.15 H new ATOM 0 HG SER A 44 13.452 30.743 -18.753 1.00 20.12 H new ATOM 678 N VAL A 45 9.927 31.100 -20.775 1.00 71.54 N ATOM 679 CA VAL A 45 8.689 30.429 -20.396 1.00 1.23 C ATOM 680 C VAL A 45 8.127 29.615 -21.556 1.00 12.14 C ATOM 681 O VAL A 45 7.620 28.509 -21.364 1.00 62.21 O ATOM 682 CB VAL A 45 7.624 31.439 -19.928 1.00 44.21 C ATOM 683 CG1 VAL A 45 6.232 30.836 -20.035 1.00 42.05 C ATOM 684 CG2 VAL A 45 7.910 31.892 -18.504 1.00 53.52 C ATOM 0 H VAL A 45 9.909 32.114 -20.662 1.00 71.54 H new ATOM 0 HA VAL A 45 8.932 29.759 -19.571 1.00 1.23 H new ATOM 0 HB VAL A 45 7.666 32.313 -20.579 1.00 44.21 H new ATOM 0 HG11 VAL A 45 5.493 31.564 -19.700 1.00 42.05 H new ATOM 0 HG12 VAL A 45 6.031 30.566 -21.072 1.00 42.05 H new ATOM 0 HG13 VAL A 45 6.172 29.945 -19.410 1.00 42.05 H new ATOM 0 HG21 VAL A 45 7.148 32.605 -18.189 1.00 53.52 H new ATOM 0 HG22 VAL A 45 7.897 31.029 -17.838 1.00 53.52 H new ATOM 0 HG23 VAL A 45 8.890 32.367 -18.463 1.00 53.52 H new ATOM 694 N LEU A 46 8.219 30.169 -22.759 1.00 45.04 N ATOM 695 CA LEU A 46 7.720 29.494 -23.953 1.00 4.24 C ATOM 696 C LEU A 46 8.551 28.253 -24.264 1.00 14.03 C ATOM 697 O LEU A 46 8.019 27.147 -24.367 1.00 35.11 O ATOM 698 CB LEU A 46 7.741 30.448 -25.148 1.00 53.22 C ATOM 699 CG LEU A 46 6.787 30.109 -26.294 1.00 71.31 C ATOM 700 CD1 LEU A 46 5.361 30.499 -25.935 1.00 64.24 C ATOM 701 CD2 LEU A 46 7.225 30.802 -27.576 1.00 1.11 C ATOM 0 H LEU A 46 8.634 31.084 -22.935 1.00 45.04 H new ATOM 0 HA LEU A 46 6.693 29.183 -23.762 1.00 4.24 H new ATOM 0 HB2 LEU A 46 7.506 31.451 -24.791 1.00 53.22 H new ATOM 0 HB3 LEU A 46 8.756 30.480 -25.544 1.00 53.22 H new ATOM 0 HG LEU A 46 6.817 29.032 -26.459 1.00 71.31 H new ATOM 0 HD11 LEU A 46 4.696 30.250 -26.762 1.00 64.24 H new ATOM 0 HD12 LEU A 46 5.049 29.956 -25.043 1.00 64.24 H new ATOM 0 HD13 LEU A 46 5.315 31.571 -25.742 1.00 64.24 H new ATOM 0 HD21 LEU A 46 6.534 30.549 -28.381 1.00 1.11 H new ATOM 0 HD22 LEU A 46 7.226 31.881 -27.424 1.00 1.11 H new ATOM 0 HD23 LEU A 46 8.229 30.473 -27.843 1.00 1.11 H new ATOM 713 N LEU A 47 9.857 28.443 -24.410 1.00 41.11 N ATOM 714 CA LEU A 47 10.762 27.338 -24.707 1.00 44.41 C ATOM 715 C LEU A 47 10.599 26.212 -23.691 1.00 41.33 C ATOM 716 O LEU A 47 10.715 25.035 -24.031 1.00 12.21 O ATOM 717 CB LEU A 47 12.212 27.828 -24.714 1.00 15.32 C ATOM 718 CG LEU A 47 13.114 27.240 -25.799 1.00 51.11 C ATOM 719 CD1 LEU A 47 13.021 28.063 -27.074 1.00 40.25 C ATOM 720 CD2 LEU A 47 14.554 27.167 -25.313 1.00 61.32 C ATOM 0 H LEU A 47 10.313 29.351 -24.328 1.00 41.11 H new ATOM 0 HA LEU A 47 10.511 26.951 -25.694 1.00 44.41 H new ATOM 0 HB2 LEU A 47 12.207 28.913 -24.822 1.00 15.32 H new ATOM 0 HB3 LEU A 47 12.654 27.606 -23.743 1.00 15.32 H new ATOM 0 HG LEU A 47 12.774 26.228 -26.019 1.00 51.11 H new ATOM 0 HD11 LEU A 47 13.670 27.629 -27.835 1.00 40.25 H new ATOM 0 HD12 LEU A 47 11.992 28.064 -27.432 1.00 40.25 H new ATOM 0 HD13 LEU A 47 13.335 29.087 -26.870 1.00 40.25 H new ATOM 0 HD21 LEU A 47 15.182 26.746 -26.098 1.00 61.32 H new ATOM 0 HD22 LEU A 47 14.906 28.169 -25.065 1.00 61.32 H new ATOM 0 HD23 LEU A 47 14.607 26.534 -24.427 1.00 61.32 H new ATOM 732 N ALA A 48 10.327 26.582 -22.444 1.00 45.31 N ATOM 733 CA ALA A 48 10.144 25.603 -21.380 1.00 13.42 C ATOM 734 C ALA A 48 8.929 24.722 -21.649 1.00 31.34 C ATOM 735 O ALA A 48 8.945 23.523 -21.368 1.00 31.54 O ATOM 736 CB ALA A 48 10.003 26.304 -20.037 1.00 12.33 C ATOM 0 H ALA A 48 10.229 27.553 -22.146 1.00 45.31 H new ATOM 0 HA ALA A 48 11.026 24.963 -21.353 1.00 13.42 H new ATOM 0 HB1 ALA A 48 9.867 25.561 -19.251 1.00 12.33 H new ATOM 0 HB2 ALA A 48 10.902 26.886 -19.834 1.00 12.33 H new ATOM 0 HB3 ALA A 48 9.139 26.968 -20.062 1.00 12.33 H new ATOM 742 N LEU A 49 7.877 25.323 -22.193 1.00 73.51 N ATOM 743 CA LEU A 49 6.652 24.592 -22.500 1.00 20.54 C ATOM 744 C LEU A 49 6.923 23.467 -23.494 1.00 3.20 C ATOM 745 O LEU A 49 6.533 22.320 -23.273 1.00 41.13 O ATOM 746 CB LEU A 49 5.595 25.542 -23.063 1.00 53.44 C ATOM 747 CG LEU A 49 4.193 24.958 -23.240 1.00 54.32 C ATOM 748 CD1 LEU A 49 3.595 24.587 -21.892 1.00 23.22 C ATOM 749 CD2 LEU A 49 3.293 25.944 -23.971 1.00 74.10 C ATOM 0 H LEU A 49 7.847 26.314 -22.431 1.00 73.51 H new ATOM 0 HA LEU A 49 6.280 24.152 -21.575 1.00 20.54 H new ATOM 0 HB2 LEU A 49 5.526 26.408 -22.404 1.00 53.44 H new ATOM 0 HB3 LEU A 49 5.940 25.905 -24.031 1.00 53.44 H new ATOM 0 HG LEU A 49 4.271 24.052 -23.842 1.00 54.32 H new ATOM 0 HD11 LEU A 49 2.597 24.173 -22.038 1.00 23.22 H new ATOM 0 HD12 LEU A 49 4.228 23.845 -21.405 1.00 23.22 H new ATOM 0 HD13 LEU A 49 3.531 25.476 -21.265 1.00 23.22 H new ATOM 0 HD21 LEU A 49 2.299 25.512 -24.088 1.00 74.10 H new ATOM 0 HD22 LEU A 49 3.222 26.867 -23.396 1.00 74.10 H new ATOM 0 HD23 LEU A 49 3.713 26.160 -24.953 1.00 74.10 H new ATOM 761 N THR A 50 7.597 23.803 -24.590 1.00 31.11 N ATOM 762 CA THR A 50 7.922 22.822 -25.618 1.00 13.21 C ATOM 763 C THR A 50 8.732 21.668 -25.040 1.00 31.41 C ATOM 764 O THR A 50 8.511 20.507 -25.385 1.00 71.32 O ATOM 765 CB THR A 50 8.713 23.462 -26.774 1.00 64.42 C ATOM 766 OG1 THR A 50 7.849 24.289 -27.561 1.00 62.00 O ATOM 767 CG2 THR A 50 9.342 22.393 -27.656 1.00 33.01 C ATOM 0 H THR A 50 7.928 24.747 -24.788 1.00 31.11 H new ATOM 0 HA THR A 50 6.976 22.441 -26.002 1.00 13.21 H new ATOM 0 HB THR A 50 9.508 24.073 -26.346 1.00 64.42 H new ATOM 0 HG1 THR A 50 8.360 24.693 -28.293 1.00 62.00 H new ATOM 0 HG21 THR A 50 9.896 22.869 -28.466 1.00 33.01 H new ATOM 0 HG22 THR A 50 10.022 21.784 -27.061 1.00 33.01 H new ATOM 0 HG23 THR A 50 8.560 21.760 -28.074 1.00 33.01 H new ATOM 775 N VAL A 51 9.671 21.993 -24.157 1.00 40.12 N ATOM 776 CA VAL A 51 10.513 20.982 -23.529 1.00 45.24 C ATOM 777 C VAL A 51 9.674 19.963 -22.768 1.00 73.53 C ATOM 778 O VAL A 51 9.963 18.766 -22.788 1.00 34.13 O ATOM 779 CB VAL A 51 11.529 21.620 -22.562 1.00 34.50 C ATOM 780 CG1 VAL A 51 12.019 20.594 -21.551 1.00 43.31 C ATOM 781 CG2 VAL A 51 12.694 22.220 -23.333 1.00 41.22 C ATOM 0 H VAL A 51 9.868 22.949 -23.860 1.00 40.12 H new ATOM 0 HA VAL A 51 11.053 20.477 -24.330 1.00 45.24 H new ATOM 0 HB VAL A 51 11.032 22.423 -22.018 1.00 34.50 H new ATOM 0 HG11 VAL A 51 12.736 21.062 -20.876 1.00 43.31 H new ATOM 0 HG12 VAL A 51 11.173 20.216 -20.977 1.00 43.31 H new ATOM 0 HG13 VAL A 51 12.500 19.768 -22.075 1.00 43.31 H new ATOM 0 HG21 VAL A 51 13.402 22.666 -22.634 1.00 41.22 H new ATOM 0 HG22 VAL A 51 13.193 21.438 -23.905 1.00 41.22 H new ATOM 0 HG23 VAL A 51 12.324 22.987 -24.013 1.00 41.22 H new ATOM 791 N PHE A 52 8.632 20.444 -22.098 1.00 40.12 N ATOM 792 CA PHE A 52 7.749 19.575 -21.329 1.00 63.54 C ATOM 793 C PHE A 52 7.060 18.560 -22.237 1.00 15.20 C ATOM 794 O PHE A 52 6.949 17.381 -21.898 1.00 41.03 O ATOM 795 CB PHE A 52 6.702 20.405 -20.585 1.00 53.23 C ATOM 796 CG PHE A 52 7.208 20.997 -19.301 1.00 13.11 C ATOM 797 CD1 PHE A 52 7.754 20.188 -18.318 1.00 4.11 C ATOM 798 CD2 PHE A 52 7.136 22.362 -19.076 1.00 42.54 C ATOM 799 CE1 PHE A 52 8.221 20.730 -17.135 1.00 24.50 C ATOM 800 CE2 PHE A 52 7.602 22.910 -17.896 1.00 31.42 C ATOM 801 CZ PHE A 52 8.144 22.092 -16.923 1.00 50.14 C ATOM 0 H PHE A 52 8.378 21.432 -22.072 1.00 40.12 H new ATOM 0 HA PHE A 52 8.355 19.034 -20.603 1.00 63.54 H new ATOM 0 HB2 PHE A 52 6.358 21.209 -21.236 1.00 53.23 H new ATOM 0 HB3 PHE A 52 5.838 19.777 -20.370 1.00 53.23 H new ATOM 0 HD1 PHE A 52 7.816 19.122 -18.478 1.00 4.11 H new ATOM 0 HD2 PHE A 52 6.711 23.006 -19.832 1.00 42.54 H new ATOM 0 HE1 PHE A 52 8.646 20.088 -16.377 1.00 24.50 H new ATOM 0 HE2 PHE A 52 7.543 23.976 -17.734 1.00 31.42 H new ATOM 0 HZ PHE A 52 8.507 22.517 -15.999 1.00 50.14 H new ATOM 811 N LEU A 53 6.596 19.027 -23.391 1.00 45.12 N ATOM 812 CA LEU A 53 5.916 18.162 -24.349 1.00 24.01 C ATOM 813 C LEU A 53 6.752 16.922 -24.651 1.00 53.15 C ATOM 814 O LEU A 53 6.309 15.794 -24.433 1.00 71.54 O ATOM 815 CB LEU A 53 5.630 18.926 -25.643 1.00 1.23 C ATOM 816 CG LEU A 53 4.233 19.536 -25.767 1.00 63.32 C ATOM 817 CD1 LEU A 53 4.189 20.540 -26.909 1.00 33.43 C ATOM 818 CD2 LEU A 53 3.192 18.445 -25.972 1.00 50.25 C ATOM 0 H LEU A 53 6.678 20.000 -23.686 1.00 45.12 H new ATOM 0 HA LEU A 53 4.972 17.843 -23.907 1.00 24.01 H new ATOM 0 HB2 LEU A 53 6.364 19.726 -25.739 1.00 1.23 H new ATOM 0 HB3 LEU A 53 5.785 18.249 -26.483 1.00 1.23 H new ATOM 0 HG LEU A 53 4.002 20.061 -24.840 1.00 63.32 H new ATOM 0 HD11 LEU A 53 3.187 20.964 -26.982 1.00 33.43 H new ATOM 0 HD12 LEU A 53 4.908 21.338 -26.720 1.00 33.43 H new ATOM 0 HD13 LEU A 53 4.440 20.039 -27.844 1.00 33.43 H new ATOM 0 HD21 LEU A 53 2.204 18.897 -26.058 1.00 50.25 H new ATOM 0 HD22 LEU A 53 3.419 17.892 -26.883 1.00 50.25 H new ATOM 0 HD23 LEU A 53 3.207 17.764 -25.121 1.00 50.25 H new ATOM 830 N LEU A 54 7.963 17.139 -25.153 1.00 33.12 N ATOM 831 CA LEU A 54 8.862 16.039 -25.483 1.00 61.14 C ATOM 832 C LEU A 54 9.091 15.140 -24.272 1.00 42.25 C ATOM 833 O LEU A 54 9.252 13.927 -24.408 1.00 62.52 O ATOM 834 CB LEU A 54 10.199 16.582 -25.990 1.00 3.21 C ATOM 835 CG LEU A 54 11.099 15.581 -26.715 1.00 25.14 C ATOM 836 CD1 LEU A 54 10.679 15.441 -28.169 1.00 63.04 C ATOM 837 CD2 LEU A 54 12.557 16.006 -26.617 1.00 43.30 C ATOM 0 H LEU A 54 8.345 18.066 -25.340 1.00 33.12 H new ATOM 0 HA LEU A 54 8.396 15.445 -26.269 1.00 61.14 H new ATOM 0 HB2 LEU A 54 9.998 17.414 -26.665 1.00 3.21 H new ATOM 0 HB3 LEU A 54 10.750 16.986 -25.141 1.00 3.21 H new ATOM 0 HG LEU A 54 10.992 14.609 -26.233 1.00 25.14 H new ATOM 0 HD11 LEU A 54 11.331 14.725 -28.669 1.00 63.04 H new ATOM 0 HD12 LEU A 54 9.648 15.089 -28.218 1.00 63.04 H new ATOM 0 HD13 LEU A 54 10.756 16.409 -28.665 1.00 63.04 H new ATOM 0 HD21 LEU A 54 13.183 15.282 -27.139 1.00 43.30 H new ATOM 0 HD22 LEU A 54 12.681 16.988 -27.073 1.00 43.30 H new ATOM 0 HD23 LEU A 54 12.853 16.053 -25.569 1.00 43.30 H new ATOM 849 N LEU A 55 9.103 15.743 -23.089 1.00 34.13 N ATOM 850 CA LEU A 55 9.310 14.997 -21.852 1.00 75.23 C ATOM 851 C LEU A 55 8.351 13.814 -21.763 1.00 61.54 C ATOM 852 O LEU A 55 8.776 12.658 -21.751 1.00 30.20 O ATOM 853 CB LEU A 55 9.120 15.914 -20.643 1.00 33.55 C ATOM 854 CG LEU A 55 10.238 15.889 -19.600 1.00 10.21 C ATOM 855 CD1 LEU A 55 10.744 17.297 -19.327 1.00 45.05 C ATOM 856 CD2 LEU A 55 9.754 15.236 -18.313 1.00 54.45 C ATOM 0 H LEU A 55 8.972 16.746 -22.960 1.00 34.13 H new ATOM 0 HA LEU A 55 10.331 14.614 -21.853 1.00 75.23 H new ATOM 0 HB2 LEU A 55 9.008 16.937 -21.002 1.00 33.55 H new ATOM 0 HB3 LEU A 55 8.185 15.645 -20.151 1.00 33.55 H new ATOM 0 HG LEU A 55 11.064 15.297 -19.995 1.00 10.21 H new ATOM 0 HD11 LEU A 55 11.539 17.260 -18.582 1.00 45.05 H new ATOM 0 HD12 LEU A 55 11.131 17.730 -20.250 1.00 45.05 H new ATOM 0 HD13 LEU A 55 9.925 17.912 -18.953 1.00 45.05 H new ATOM 0 HD21 LEU A 55 10.563 15.227 -17.583 1.00 54.45 H new ATOM 0 HD22 LEU A 55 8.911 15.800 -17.914 1.00 54.45 H new ATOM 0 HD23 LEU A 55 9.441 14.213 -18.520 1.00 54.45 H new ATOM 868 N ILE A 56 7.057 14.110 -21.704 1.00 23.01 N ATOM 869 CA ILE A 56 6.039 13.070 -21.620 1.00 0.51 C ATOM 870 C ILE A 56 5.857 12.370 -22.962 1.00 32.30 C ATOM 871 O ILE A 56 5.433 11.215 -23.019 1.00 0.43 O ATOM 872 CB ILE A 56 4.684 13.645 -21.165 1.00 63.13 C ATOM 873 CG1 ILE A 56 4.886 14.638 -20.019 1.00 35.23 C ATOM 874 CG2 ILE A 56 3.748 12.523 -20.743 1.00 71.52 C ATOM 875 CD1 ILE A 56 4.798 16.085 -20.450 1.00 61.02 C ATOM 0 H ILE A 56 6.689 15.061 -21.713 1.00 23.01 H new ATOM 0 HA ILE A 56 6.385 12.348 -20.880 1.00 0.51 H new ATOM 0 HB ILE A 56 4.230 14.174 -22.003 1.00 63.13 H new ATOM 0 HG12 ILE A 56 4.137 14.450 -19.250 1.00 35.23 H new ATOM 0 HG13 ILE A 56 5.861 14.462 -19.564 1.00 35.23 H new ATOM 0 HG21 ILE A 56 2.795 12.945 -20.424 1.00 71.52 H new ATOM 0 HG22 ILE A 56 3.584 11.850 -21.585 1.00 71.52 H new ATOM 0 HG23 ILE A 56 4.194 11.969 -19.917 1.00 71.52 H new ATOM 0 HD11 ILE A 56 4.951 16.732 -19.586 1.00 61.02 H new ATOM 0 HD12 ILE A 56 5.565 16.289 -21.197 1.00 61.02 H new ATOM 0 HD13 ILE A 56 3.814 16.278 -20.878 1.00 61.02 H new ATOM 1056 N SER A 69 -3.395 12.558 -16.312 1.00 1.24 N ATOM 1057 CA SER A 69 -2.841 13.713 -15.615 1.00 44.20 C ATOM 1058 C SER A 69 -2.104 14.631 -16.586 1.00 15.30 C ATOM 1059 O SER A 69 -2.102 15.852 -16.424 1.00 32.30 O ATOM 1060 CB SER A 69 -1.891 13.259 -14.505 1.00 65.55 C ATOM 1061 OG SER A 69 -1.660 14.300 -13.573 1.00 11.23 O ATOM 0 HA SER A 69 -3.667 14.269 -15.171 1.00 44.20 H new ATOM 0 HB2 SER A 69 -2.313 12.395 -13.992 1.00 65.55 H new ATOM 0 HB3 SER A 69 -0.944 12.940 -14.941 1.00 65.55 H new ATOM 0 HG SER A 69 -1.051 13.984 -12.873 1.00 11.23 H new ATOM 1067 N VAL A 70 -1.480 14.035 -17.596 1.00 64.23 N ATOM 1068 CA VAL A 70 -0.740 14.797 -18.595 1.00 51.40 C ATOM 1069 C VAL A 70 -1.644 15.802 -19.300 1.00 14.44 C ATOM 1070 O VAL A 70 -1.208 16.890 -19.675 1.00 20.32 O ATOM 1071 CB VAL A 70 -0.101 13.872 -19.648 1.00 12.23 C ATOM 1072 CG1 VAL A 70 0.996 13.026 -19.020 1.00 34.23 C ATOM 1073 CG2 VAL A 70 -1.160 12.993 -20.296 1.00 24.41 C ATOM 0 H VAL A 70 -1.472 13.026 -17.745 1.00 64.23 H new ATOM 0 HA VAL A 70 0.049 15.331 -18.065 1.00 51.40 H new ATOM 0 HB VAL A 70 0.350 14.490 -20.424 1.00 12.23 H new ATOM 0 HG11 VAL A 70 1.436 12.379 -19.779 1.00 34.23 H new ATOM 0 HG12 VAL A 70 1.767 13.677 -18.607 1.00 34.23 H new ATOM 0 HG13 VAL A 70 0.573 12.415 -18.223 1.00 34.23 H new ATOM 0 HG21 VAL A 70 -0.692 12.346 -21.037 1.00 24.41 H new ATOM 0 HG22 VAL A 70 -1.642 12.382 -19.533 1.00 24.41 H new ATOM 0 HG23 VAL A 70 -1.906 13.621 -20.782 1.00 24.41 H new ATOM 1083 N GLY A 71 -2.909 15.431 -19.476 1.00 21.22 N ATOM 1084 CA GLY A 71 -3.856 16.311 -20.135 1.00 1.24 C ATOM 1085 C GLY A 71 -4.283 17.468 -19.253 1.00 30.45 C ATOM 1086 O GLY A 71 -4.290 18.618 -19.688 1.00 53.31 O ATOM 0 H GLY A 71 -3.295 14.536 -19.174 1.00 21.22 H new ATOM 0 HA2 GLY A 71 -3.409 16.701 -21.050 1.00 1.24 H new ATOM 0 HA3 GLY A 71 -4.736 15.738 -20.429 1.00 1.24 H new ATOM 1090 N GLU A 72 -4.641 17.161 -18.010 1.00 33.14 N ATOM 1091 CA GLU A 72 -5.074 18.184 -17.066 1.00 12.54 C ATOM 1092 C GLU A 72 -3.966 19.205 -16.824 1.00 1.32 C ATOM 1093 O GLU A 72 -4.224 20.404 -16.717 1.00 51.40 O ATOM 1094 CB GLU A 72 -5.491 17.544 -15.740 1.00 25.21 C ATOM 1095 CG GLU A 72 -6.939 17.808 -15.364 1.00 41.44 C ATOM 1096 CD GLU A 72 -7.235 17.479 -13.914 1.00 72.43 C ATOM 1097 OE1 GLU A 72 -6.370 16.861 -13.258 1.00 40.52 O ATOM 1098 OE2 GLU A 72 -8.331 17.837 -13.436 1.00 14.03 O ATOM 0 H GLU A 72 -4.640 16.213 -17.634 1.00 33.14 H new ATOM 0 HA GLU A 72 -5.932 18.699 -17.498 1.00 12.54 H new ATOM 0 HB2 GLU A 72 -5.331 16.468 -15.800 1.00 25.21 H new ATOM 0 HB3 GLU A 72 -4.845 17.919 -14.946 1.00 25.21 H new ATOM 0 HG2 GLU A 72 -7.173 18.856 -15.550 1.00 41.44 H new ATOM 0 HG3 GLU A 72 -7.591 17.217 -16.007 1.00 41.44 H new ATOM 1105 N TYR A 73 -2.732 18.721 -16.738 1.00 31.21 N ATOM 1106 CA TYR A 73 -1.584 19.589 -16.506 1.00 13.43 C ATOM 1107 C TYR A 73 -1.426 20.597 -17.640 1.00 4.41 C ATOM 1108 O TYR A 73 -1.123 21.769 -17.408 1.00 23.41 O ATOM 1109 CB TYR A 73 -0.308 18.757 -16.366 1.00 15.32 C ATOM 1110 CG TYR A 73 0.816 19.486 -15.665 1.00 71.02 C ATOM 1111 CD1 TYR A 73 0.599 20.145 -14.461 1.00 21.50 C ATOM 1112 CD2 TYR A 73 2.095 19.517 -16.208 1.00 34.14 C ATOM 1113 CE1 TYR A 73 1.623 20.812 -13.818 1.00 1.35 C ATOM 1114 CE2 TYR A 73 3.125 20.181 -15.570 1.00 71.24 C ATOM 1115 CZ TYR A 73 2.884 20.827 -14.376 1.00 2.11 C ATOM 1116 OH TYR A 73 3.908 21.491 -13.739 1.00 34.22 O ATOM 0 H TYR A 73 -2.501 17.731 -16.826 1.00 31.21 H new ATOM 0 HA TYR A 73 -1.756 20.136 -15.579 1.00 13.43 H new ATOM 0 HB2 TYR A 73 -0.538 17.845 -15.815 1.00 15.32 H new ATOM 0 HB3 TYR A 73 0.029 18.454 -17.357 1.00 15.32 H new ATOM 0 HD1 TYR A 73 -0.387 20.135 -14.021 1.00 21.50 H new ATOM 0 HD2 TYR A 73 2.287 19.014 -17.144 1.00 34.14 H new ATOM 0 HE1 TYR A 73 1.437 21.319 -12.883 1.00 1.35 H new ATOM 0 HE2 TYR A 73 4.114 20.194 -16.004 1.00 71.24 H new ATOM 0 HH TYR A 73 4.731 21.404 -14.264 1.00 34.22 H new ATOM 1126 N LEU A 74 -1.633 20.134 -18.867 1.00 50.04 N ATOM 1127 CA LEU A 74 -1.514 20.994 -20.040 1.00 34.20 C ATOM 1128 C LEU A 74 -2.674 21.982 -20.110 1.00 74.35 C ATOM 1129 O LEU A 74 -2.489 23.148 -20.456 1.00 1.21 O ATOM 1130 CB LEU A 74 -1.471 20.149 -21.314 1.00 71.32 C ATOM 1131 CG LEU A 74 -0.165 20.198 -22.108 1.00 72.13 C ATOM 1132 CD1 LEU A 74 0.196 21.634 -22.452 1.00 44.54 C ATOM 1133 CD2 LEU A 74 0.960 19.536 -21.326 1.00 73.43 C ATOM 0 H LEU A 74 -1.884 19.168 -19.076 1.00 50.04 H new ATOM 0 HA LEU A 74 -0.585 21.558 -19.954 1.00 34.20 H new ATOM 0 HB2 LEU A 74 -1.671 19.112 -21.045 1.00 71.32 H new ATOM 0 HB3 LEU A 74 -2.282 20.471 -21.967 1.00 71.32 H new ATOM 0 HG LEU A 74 -0.307 19.648 -23.038 1.00 72.13 H new ATOM 0 HD11 LEU A 74 1.128 21.650 -23.017 1.00 44.54 H new ATOM 0 HD12 LEU A 74 -0.600 22.075 -23.052 1.00 44.54 H new ATOM 0 HD13 LEU A 74 0.319 22.208 -21.534 1.00 44.54 H new ATOM 0 HD21 LEU A 74 1.882 19.580 -21.906 1.00 73.43 H new ATOM 0 HD22 LEU A 74 1.102 20.058 -20.380 1.00 73.43 H new ATOM 0 HD23 LEU A 74 0.704 18.495 -21.131 1.00 73.43 H new ATOM 1145 N MET A 75 -3.870 21.507 -19.779 1.00 34.43 N ATOM 1146 CA MET A 75 -5.060 22.349 -19.801 1.00 53.53 C ATOM 1147 C MET A 75 -4.854 23.604 -18.958 1.00 70.21 C ATOM 1148 O MET A 75 -4.999 24.724 -19.448 1.00 64.12 O ATOM 1149 CB MET A 75 -6.273 21.570 -19.289 1.00 52.32 C ATOM 1150 CG MET A 75 -7.529 21.787 -20.118 1.00 62.32 C ATOM 1151 SD MET A 75 -8.857 20.649 -19.677 1.00 43.45 S ATOM 1152 CE MET A 75 -8.089 19.074 -20.046 1.00 31.43 C ATOM 0 H MET A 75 -4.041 20.543 -19.492 1.00 34.43 H new ATOM 0 HA MET A 75 -5.241 22.651 -20.833 1.00 53.53 H new ATOM 0 HB2 MET A 75 -6.034 20.507 -19.279 1.00 52.32 H new ATOM 0 HB3 MET A 75 -6.473 21.862 -18.258 1.00 52.32 H new ATOM 0 HG2 MET A 75 -7.875 22.812 -19.985 1.00 62.32 H new ATOM 0 HG3 MET A 75 -7.288 21.666 -21.174 1.00 62.32 H new ATOM 0 HE1 MET A 75 -8.856 18.352 -20.327 1.00 31.43 H new ATOM 0 HE2 MET A 75 -7.386 19.196 -20.870 1.00 31.43 H new ATOM 0 HE3 MET A 75 -7.557 18.713 -19.166 1.00 31.43 H new ATOM 1162 N PHE A 76 -4.516 23.408 -17.688 1.00 1.42 N ATOM 1163 CA PHE A 76 -4.291 24.524 -16.776 1.00 51.23 C ATOM 1164 C PHE A 76 -3.097 25.361 -17.225 1.00 52.54 C ATOM 1165 O PHE A 76 -3.085 26.583 -17.067 1.00 22.33 O ATOM 1166 CB PHE A 76 -4.061 24.010 -15.354 1.00 34.14 C ATOM 1167 CG PHE A 76 -5.213 23.213 -14.811 1.00 14.41 C ATOM 1168 CD1 PHE A 76 -6.515 23.668 -14.952 1.00 64.21 C ATOM 1169 CD2 PHE A 76 -4.995 22.010 -14.159 1.00 1.41 C ATOM 1170 CE1 PHE A 76 -7.577 22.937 -14.454 1.00 51.21 C ATOM 1171 CE2 PHE A 76 -6.053 21.275 -13.659 1.00 52.33 C ATOM 1172 CZ PHE A 76 -7.346 21.740 -13.806 1.00 23.20 C ATOM 0 H PHE A 76 -4.392 22.487 -17.267 1.00 1.42 H new ATOM 0 HA PHE A 76 -5.180 25.155 -16.788 1.00 51.23 H new ATOM 0 HB2 PHE A 76 -3.163 23.392 -15.340 1.00 34.14 H new ATOM 0 HB3 PHE A 76 -3.874 24.858 -14.695 1.00 34.14 H new ATOM 0 HD1 PHE A 76 -6.702 24.604 -15.457 1.00 64.21 H new ATOM 0 HD2 PHE A 76 -3.986 21.642 -14.040 1.00 1.41 H new ATOM 0 HE1 PHE A 76 -8.587 23.302 -14.572 1.00 51.21 H new ATOM 0 HE2 PHE A 76 -5.870 20.338 -13.154 1.00 52.33 H new ATOM 0 HZ PHE A 76 -8.174 21.168 -13.415 1.00 23.20 H new ATOM 1182 N THR A 77 -2.093 24.696 -17.787 1.00 62.31 N ATOM 1183 CA THR A 77 -0.893 25.376 -18.258 1.00 11.32 C ATOM 1184 C THR A 77 -1.217 26.338 -19.395 1.00 71.14 C ATOM 1185 O THR A 77 -0.672 27.439 -19.464 1.00 11.12 O ATOM 1186 CB THR A 77 0.171 24.371 -18.737 1.00 43.55 C ATOM 1187 OG1 THR A 77 0.728 23.675 -17.617 1.00 34.11 O ATOM 1188 CG2 THR A 77 1.279 25.080 -19.501 1.00 44.45 C ATOM 0 H THR A 77 -2.087 23.686 -17.927 1.00 62.31 H new ATOM 0 HA THR A 77 -0.496 25.938 -17.413 1.00 11.32 H new ATOM 0 HB THR A 77 -0.311 23.657 -19.405 1.00 43.55 H new ATOM 0 HG1 THR A 77 0.294 22.801 -17.526 1.00 34.11 H new ATOM 0 HG21 THR A 77 2.019 24.350 -19.829 1.00 44.45 H new ATOM 0 HG22 THR A 77 0.857 25.585 -20.370 1.00 44.45 H new ATOM 0 HG23 THR A 77 1.757 25.814 -18.852 1.00 44.45 H new ATOM 1196 N MET A 78 -2.108 25.915 -20.286 1.00 62.43 N ATOM 1197 CA MET A 78 -2.505 26.740 -21.421 1.00 14.44 C ATOM 1198 C MET A 78 -3.344 27.929 -20.960 1.00 61.35 C ATOM 1199 O MET A 78 -3.317 28.995 -21.575 1.00 74.02 O ATOM 1200 CB MET A 78 -3.293 25.908 -22.434 1.00 21.50 C ATOM 1201 CG MET A 78 -2.419 24.999 -23.284 1.00 12.13 C ATOM 1202 SD MET A 78 -1.889 25.782 -24.819 1.00 12.42 S ATOM 1203 CE MET A 78 -0.159 26.082 -24.466 1.00 62.12 C ATOM 0 H MET A 78 -2.569 25.006 -20.244 1.00 62.43 H new ATOM 0 HA MET A 78 -1.601 27.118 -21.898 1.00 14.44 H new ATOM 0 HB2 MET A 78 -4.025 25.301 -21.902 1.00 21.50 H new ATOM 0 HB3 MET A 78 -3.850 26.579 -23.088 1.00 21.50 H new ATOM 0 HG2 MET A 78 -1.541 24.704 -22.709 1.00 12.13 H new ATOM 0 HG3 MET A 78 -2.969 24.087 -23.517 1.00 12.13 H new ATOM 0 HE1 MET A 78 0.374 26.277 -25.397 1.00 62.12 H new ATOM 0 HE2 MET A 78 -0.066 26.946 -23.808 1.00 62.12 H new ATOM 0 HE3 MET A 78 0.270 25.207 -23.979 1.00 62.12 H new ATOM 1213 N VAL A 79 -4.088 27.738 -19.876 1.00 21.34 N ATOM 1214 CA VAL A 79 -4.934 28.794 -19.333 1.00 4.21 C ATOM 1215 C VAL A 79 -4.094 29.930 -18.760 1.00 11.41 C ATOM 1216 O VAL A 79 -4.269 31.093 -19.127 1.00 54.01 O ATOM 1217 CB VAL A 79 -5.868 28.256 -18.233 1.00 71.22 C ATOM 1218 CG1 VAL A 79 -6.378 29.393 -17.362 1.00 0.34 C ATOM 1219 CG2 VAL A 79 -7.026 27.485 -18.849 1.00 22.31 C ATOM 0 H VAL A 79 -4.122 26.861 -19.356 1.00 21.34 H new ATOM 0 HA VAL A 79 -5.537 29.172 -20.158 1.00 4.21 H new ATOM 0 HB VAL A 79 -5.301 27.573 -17.601 1.00 71.22 H new ATOM 0 HG11 VAL A 79 -7.036 28.993 -16.591 1.00 0.34 H new ATOM 0 HG12 VAL A 79 -5.534 29.899 -16.893 1.00 0.34 H new ATOM 0 HG13 VAL A 79 -6.930 30.103 -17.977 1.00 0.34 H new ATOM 0 HG21 VAL A 79 -7.676 27.112 -18.058 1.00 22.31 H new ATOM 0 HG22 VAL A 79 -7.594 28.145 -19.505 1.00 22.31 H new ATOM 0 HG23 VAL A 79 -6.638 26.646 -19.426 1.00 22.31 H new ATOM 1229 N LEU A 80 -3.181 29.587 -17.858 1.00 51.11 N ATOM 1230 CA LEU A 80 -2.312 30.579 -17.233 1.00 73.43 C ATOM 1231 C LEU A 80 -1.411 31.243 -18.269 1.00 54.33 C ATOM 1232 O LEU A 80 -1.291 32.468 -18.308 1.00 61.24 O ATOM 1233 CB LEU A 80 -1.460 29.925 -16.144 1.00 71.21 C ATOM 1234 CG LEU A 80 -1.454 30.626 -14.785 1.00 40.03 C ATOM 1235 CD1 LEU A 80 -2.554 30.071 -13.893 1.00 45.13 C ATOM 1236 CD2 LEU A 80 -0.096 30.479 -14.115 1.00 63.42 C ATOM 0 H LEU A 80 -3.023 28.630 -17.543 1.00 51.11 H new ATOM 0 HA LEU A 80 -2.942 31.345 -16.782 1.00 73.43 H new ATOM 0 HB2 LEU A 80 -1.810 28.903 -16.002 1.00 71.21 H new ATOM 0 HB3 LEU A 80 -0.433 29.863 -16.503 1.00 71.21 H new ATOM 0 HG LEU A 80 -1.645 31.687 -14.944 1.00 40.03 H new ATOM 0 HD11 LEU A 80 -2.534 30.582 -12.930 1.00 45.13 H new ATOM 0 HD12 LEU A 80 -3.522 30.229 -14.368 1.00 45.13 H new ATOM 0 HD13 LEU A 80 -2.395 29.003 -13.741 1.00 45.13 H new ATOM 0 HD21 LEU A 80 -0.110 30.984 -13.149 1.00 63.42 H new ATOM 0 HD22 LEU A 80 0.125 29.422 -13.968 1.00 63.42 H new ATOM 0 HD23 LEU A 80 0.672 30.926 -14.747 1.00 63.42 H new ATOM 1248 N VAL A 81 -0.782 30.427 -19.109 1.00 4.51 N ATOM 1249 CA VAL A 81 0.106 30.936 -20.148 1.00 12.11 C ATOM 1250 C VAL A 81 -0.583 32.011 -20.981 1.00 1.41 C ATOM 1251 O VAL A 81 -0.061 33.115 -21.145 1.00 74.24 O ATOM 1252 CB VAL A 81 0.583 29.807 -21.080 1.00 42.15 C ATOM 1253 CG1 VAL A 81 1.094 30.379 -22.394 1.00 3.41 C ATOM 1254 CG2 VAL A 81 1.657 28.972 -20.399 1.00 41.33 C ATOM 0 H VAL A 81 -0.871 29.411 -19.090 1.00 4.51 H new ATOM 0 HA VAL A 81 0.969 31.369 -19.643 1.00 12.11 H new ATOM 0 HB VAL A 81 -0.265 29.158 -21.299 1.00 42.15 H new ATOM 0 HG11 VAL A 81 1.427 29.566 -23.040 1.00 3.41 H new ATOM 0 HG12 VAL A 81 0.293 30.930 -22.887 1.00 3.41 H new ATOM 0 HG13 VAL A 81 1.929 31.052 -22.198 1.00 3.41 H new ATOM 0 HG21 VAL A 81 1.982 28.179 -21.072 1.00 41.33 H new ATOM 0 HG22 VAL A 81 2.507 29.607 -20.148 1.00 41.33 H new ATOM 0 HG23 VAL A 81 1.252 28.531 -19.488 1.00 41.33 H new ATOM 1264 N THR A 82 -1.760 31.683 -21.505 1.00 64.14 N ATOM 1265 CA THR A 82 -2.521 32.620 -22.322 1.00 65.33 C ATOM 1266 C THR A 82 -2.691 33.957 -21.611 1.00 32.13 C ATOM 1267 O THR A 82 -2.662 35.015 -22.240 1.00 74.43 O ATOM 1268 CB THR A 82 -3.911 32.057 -22.674 1.00 43.45 C ATOM 1269 OG1 THR A 82 -3.773 30.844 -23.423 1.00 12.32 O ATOM 1270 CG2 THR A 82 -4.715 33.067 -23.479 1.00 41.22 C ATOM 0 H THR A 82 -2.207 30.775 -21.378 1.00 64.14 H new ATOM 0 HA THR A 82 -1.955 32.771 -23.241 1.00 65.33 H new ATOM 0 HB THR A 82 -4.442 31.851 -21.744 1.00 43.45 H new ATOM 0 HG1 THR A 82 -3.838 30.076 -22.817 1.00 12.32 H new ATOM 0 HG21 THR A 82 -5.693 32.648 -23.716 1.00 41.22 H new ATOM 0 HG22 THR A 82 -4.843 33.979 -22.895 1.00 41.22 H new ATOM 0 HG23 THR A 82 -4.186 33.299 -24.403 1.00 41.22 H new ATOM 1278 N PHE A 83 -2.868 33.903 -20.295 1.00 13.32 N ATOM 1279 CA PHE A 83 -3.044 35.111 -19.497 1.00 51.42 C ATOM 1280 C PHE A 83 -1.730 35.878 -19.374 1.00 74.05 C ATOM 1281 O PHE A 83 -1.711 37.108 -19.414 1.00 11.10 O ATOM 1282 CB PHE A 83 -3.573 34.757 -18.106 1.00 24.03 C ATOM 1283 CG PHE A 83 -5.010 35.138 -17.896 1.00 32.04 C ATOM 1284 CD1 PHE A 83 -5.384 36.470 -17.826 1.00 14.33 C ATOM 1285 CD2 PHE A 83 -5.987 34.164 -17.769 1.00 14.04 C ATOM 1286 CE1 PHE A 83 -6.706 36.823 -17.632 1.00 14.43 C ATOM 1287 CE2 PHE A 83 -7.311 34.511 -17.575 1.00 12.22 C ATOM 1288 CZ PHE A 83 -7.671 35.843 -17.507 1.00 72.23 C ATOM 0 H PHE A 83 -2.893 33.036 -19.759 1.00 13.32 H new ATOM 0 HA PHE A 83 -3.770 35.747 -20.003 1.00 51.42 H new ATOM 0 HB2 PHE A 83 -3.463 33.684 -17.946 1.00 24.03 H new ATOM 0 HB3 PHE A 83 -2.960 35.256 -17.355 1.00 24.03 H new ATOM 0 HD1 PHE A 83 -4.634 37.241 -17.924 1.00 14.33 H new ATOM 0 HD2 PHE A 83 -5.711 33.121 -17.822 1.00 14.04 H new ATOM 0 HE1 PHE A 83 -6.984 37.865 -17.578 1.00 14.43 H new ATOM 0 HE2 PHE A 83 -8.063 33.742 -17.477 1.00 12.22 H new ATOM 0 HZ PHE A 83 -8.705 36.117 -17.356 1.00 72.23 H new ATOM 1298 N SER A 84 -0.634 35.141 -19.225 1.00 11.42 N ATOM 1299 CA SER A 84 0.684 35.751 -19.092 1.00 31.23 C ATOM 1300 C SER A 84 1.078 36.478 -20.373 1.00 50.54 C ATOM 1301 O SER A 84 1.663 37.561 -20.330 1.00 41.15 O ATOM 1302 CB SER A 84 1.730 34.686 -18.754 1.00 54.31 C ATOM 1303 OG SER A 84 2.341 34.951 -17.503 1.00 62.34 O ATOM 0 H SER A 84 -0.632 34.121 -19.193 1.00 11.42 H new ATOM 0 HA SER A 84 0.641 36.478 -18.281 1.00 31.23 H new ATOM 0 HB2 SER A 84 1.259 33.703 -18.731 1.00 54.31 H new ATOM 0 HB3 SER A 84 2.490 34.657 -19.535 1.00 54.31 H new ATOM 0 HG SER A 84 2.221 34.180 -16.910 1.00 62.34 H new ATOM 1309 N ILE A 85 0.753 35.876 -21.512 1.00 70.21 N ATOM 1310 CA ILE A 85 1.071 36.466 -22.806 1.00 45.12 C ATOM 1311 C ILE A 85 0.286 37.754 -23.031 1.00 61.34 C ATOM 1312 O ILE A 85 0.830 38.750 -23.507 1.00 2.51 O ATOM 1313 CB ILE A 85 0.775 35.489 -23.959 1.00 72.11 C ATOM 1314 CG1 ILE A 85 1.625 34.225 -23.817 1.00 21.24 C ATOM 1315 CG2 ILE A 85 1.032 36.159 -25.301 1.00 23.44 C ATOM 1316 CD1 ILE A 85 3.074 34.424 -24.203 1.00 52.33 C ATOM 0 H ILE A 85 0.269 34.979 -21.565 1.00 70.21 H new ATOM 0 HA ILE A 85 2.138 36.690 -22.796 1.00 45.12 H new ATOM 0 HB ILE A 85 -0.276 35.204 -23.913 1.00 72.11 H new ATOM 0 HG12 ILE A 85 1.577 33.879 -22.785 1.00 21.24 H new ATOM 0 HG13 ILE A 85 1.197 33.438 -24.438 1.00 21.24 H new ATOM 0 HG21 ILE A 85 0.818 35.456 -26.106 1.00 23.44 H new ATOM 0 HG22 ILE A 85 0.387 37.032 -25.401 1.00 23.44 H new ATOM 0 HG23 ILE A 85 2.075 36.470 -25.359 1.00 23.44 H new ATOM 0 HD11 ILE A 85 3.616 33.487 -24.077 1.00 52.33 H new ATOM 0 HD12 ILE A 85 3.133 34.741 -25.244 1.00 52.33 H new ATOM 0 HD13 ILE A 85 3.519 35.188 -23.566 1.00 52.33 H new ATOM 1328 N VAL A 86 -0.997 37.726 -22.685 1.00 1.22 N ATOM 1329 CA VAL A 86 -1.858 38.892 -22.846 1.00 65.01 C ATOM 1330 C VAL A 86 -1.245 40.123 -22.186 1.00 73.54 C ATOM 1331 O VAL A 86 -1.258 41.216 -22.753 1.00 10.13 O ATOM 1332 CB VAL A 86 -3.255 38.645 -22.248 1.00 74.44 C ATOM 1333 CG1 VAL A 86 -3.932 39.964 -21.907 1.00 65.23 C ATOM 1334 CG2 VAL A 86 -4.109 37.831 -23.210 1.00 11.52 C ATOM 0 H VAL A 86 -1.463 36.909 -22.291 1.00 1.22 H new ATOM 0 HA VAL A 86 -1.956 39.068 -23.917 1.00 65.01 H new ATOM 0 HB VAL A 86 -3.141 38.075 -21.326 1.00 74.44 H new ATOM 0 HG11 VAL A 86 -4.918 39.769 -21.486 1.00 65.23 H new ATOM 0 HG12 VAL A 86 -3.327 40.506 -21.180 1.00 65.23 H new ATOM 0 HG13 VAL A 86 -4.036 40.564 -22.811 1.00 65.23 H new ATOM 0 HG21 VAL A 86 -5.093 37.665 -22.772 1.00 11.52 H new ATOM 0 HG22 VAL A 86 -4.217 38.373 -24.149 1.00 11.52 H new ATOM 0 HG23 VAL A 86 -3.630 36.870 -23.399 1.00 11.52 H new ATOM 1344 N THR A 87 -0.708 39.937 -20.984 1.00 51.54 N ATOM 1345 CA THR A 87 -0.091 41.032 -20.246 1.00 40.13 C ATOM 1346 C THR A 87 1.279 41.378 -20.819 1.00 31.23 C ATOM 1347 O THR A 87 1.724 42.523 -20.739 1.00 65.44 O ATOM 1348 CB THR A 87 0.061 40.687 -18.753 1.00 5.11 C ATOM 1349 OG1 THR A 87 -0.514 39.403 -18.485 1.00 40.44 O ATOM 1350 CG2 THR A 87 -0.608 41.740 -17.883 1.00 55.00 C ATOM 0 H THR A 87 -0.688 39.039 -20.501 1.00 51.54 H new ATOM 0 HA THR A 87 -0.751 41.893 -20.347 1.00 40.13 H new ATOM 0 HB THR A 87 1.124 40.665 -18.515 1.00 5.11 H new ATOM 0 HG1 THR A 87 0.121 38.701 -18.738 1.00 40.44 H new ATOM 0 HG21 THR A 87 -0.487 41.474 -16.833 1.00 55.00 H new ATOM 0 HG22 THR A 87 -0.147 42.710 -18.067 1.00 55.00 H new ATOM 0 HG23 THR A 87 -1.670 41.791 -18.125 1.00 55.00 H new ATOM 1358 N SER A 88 1.942 40.381 -21.396 1.00 44.43 N ATOM 1359 CA SER A 88 3.264 40.580 -21.980 1.00 31.01 C ATOM 1360 C SER A 88 3.211 41.607 -23.107 1.00 4.23 C ATOM 1361 O SER A 88 3.917 42.616 -23.077 1.00 20.44 O ATOM 1362 CB SER A 88 3.816 39.255 -22.508 1.00 72.51 C ATOM 1363 OG SER A 88 4.371 39.413 -23.802 1.00 60.23 O ATOM 0 H SER A 88 1.586 39.428 -21.472 1.00 44.43 H new ATOM 0 HA SER A 88 3.926 40.956 -21.200 1.00 31.01 H new ATOM 0 HB2 SER A 88 4.578 38.877 -21.826 1.00 72.51 H new ATOM 0 HB3 SER A 88 3.019 38.512 -22.539 1.00 72.51 H new ATOM 0 HG SER A 88 4.718 38.552 -24.116 1.00 60.23 H new ATOM 1369 N VAL A 89 2.369 41.343 -24.101 1.00 4.22 N ATOM 1370 CA VAL A 89 2.223 42.244 -25.238 1.00 15.02 C ATOM 1371 C VAL A 89 1.550 43.548 -24.823 1.00 25.03 C ATOM 1372 O VAL A 89 1.708 44.577 -25.481 1.00 61.44 O ATOM 1373 CB VAL A 89 1.402 41.593 -26.367 1.00 51.22 C ATOM 1374 CG1 VAL A 89 1.996 40.247 -26.752 1.00 5.01 C ATOM 1375 CG2 VAL A 89 -0.053 41.443 -25.949 1.00 71.14 C ATOM 0 H VAL A 89 1.778 40.513 -24.142 1.00 4.22 H new ATOM 0 HA VAL A 89 3.227 42.457 -25.604 1.00 15.02 H new ATOM 0 HB VAL A 89 1.440 42.243 -27.241 1.00 51.22 H new ATOM 0 HG11 VAL A 89 1.402 39.802 -27.551 1.00 5.01 H new ATOM 0 HG12 VAL A 89 3.021 40.387 -27.096 1.00 5.01 H new ATOM 0 HG13 VAL A 89 1.991 39.586 -25.885 1.00 5.01 H new ATOM 0 HG21 VAL A 89 -0.618 40.981 -26.759 1.00 71.14 H new ATOM 0 HG22 VAL A 89 -0.113 40.815 -25.060 1.00 71.14 H new ATOM 0 HG23 VAL A 89 -0.471 42.425 -25.728 1.00 71.14 H new ATOM 1385 N CYS A 90 0.801 43.498 -23.727 1.00 4.01 N ATOM 1386 CA CYS A 90 0.104 44.676 -23.223 1.00 41.01 C ATOM 1387 C CYS A 90 1.095 45.720 -22.719 1.00 10.12 C ATOM 1388 O CYS A 90 0.819 46.919 -22.750 1.00 41.41 O ATOM 1389 CB CYS A 90 -0.858 44.284 -22.100 1.00 65.25 C ATOM 1390 SG CYS A 90 -2.605 44.440 -22.537 1.00 71.44 S ATOM 0 H CYS A 90 0.661 42.655 -23.171 1.00 4.01 H new ATOM 0 HA CYS A 90 -0.466 45.110 -24.045 1.00 41.01 H new ATOM 0 HB2 CYS A 90 -0.658 43.253 -21.808 1.00 65.25 H new ATOM 0 HB3 CYS A 90 -0.655 44.907 -21.229 1.00 65.25 H new ATOM 0 HG CYS A 90 -3.339 44.084 -21.525 1.00 71.44 H new ATOM 1396 N VAL A 91 2.250 45.256 -22.252 1.00 71.34 N ATOM 1397 CA VAL A 91 3.282 46.149 -21.740 1.00 62.04 C ATOM 1398 C VAL A 91 4.121 46.727 -22.875 1.00 20.22 C ATOM 1399 O VAL A 91 4.387 47.929 -22.915 1.00 24.32 O ATOM 1400 CB VAL A 91 4.211 45.424 -20.748 1.00 74.42 C ATOM 1401 CG1 VAL A 91 5.491 46.216 -20.538 1.00 5.52 C ATOM 1402 CG2 VAL A 91 3.496 45.188 -19.426 1.00 24.11 C ATOM 0 H VAL A 91 2.494 44.266 -22.218 1.00 71.34 H new ATOM 0 HA VAL A 91 2.770 46.959 -21.221 1.00 62.04 H new ATOM 0 HB VAL A 91 4.478 44.455 -21.169 1.00 74.42 H new ATOM 0 HG11 VAL A 91 6.134 45.688 -19.834 1.00 5.52 H new ATOM 0 HG12 VAL A 91 6.010 46.328 -21.490 1.00 5.52 H new ATOM 0 HG13 VAL A 91 5.248 47.201 -20.139 1.00 5.52 H new ATOM 0 HG21 VAL A 91 4.166 44.675 -18.736 1.00 24.11 H new ATOM 0 HG22 VAL A 91 3.198 46.145 -18.998 1.00 24.11 H new ATOM 0 HG23 VAL A 91 2.611 44.575 -19.595 1.00 24.11 H new ATOM 1412 N LEU A 92 4.535 45.864 -23.796 1.00 74.30 N ATOM 1413 CA LEU A 92 5.343 46.288 -24.934 1.00 25.15 C ATOM 1414 C LEU A 92 4.593 47.305 -25.787 1.00 15.35 C ATOM 1415 O LEU A 92 5.169 48.290 -26.246 1.00 15.51 O ATOM 1416 CB LEU A 92 5.733 45.079 -25.786 1.00 45.32 C ATOM 1417 CG LEU A 92 7.233 44.851 -25.980 1.00 72.44 C ATOM 1418 CD1 LEU A 92 7.563 43.369 -25.891 1.00 72.21 C ATOM 1419 CD2 LEU A 92 7.691 45.421 -27.315 1.00 11.44 C ATOM 0 H LEU A 92 4.324 44.866 -23.777 1.00 74.30 H new ATOM 0 HA LEU A 92 6.247 46.761 -24.550 1.00 25.15 H new ATOM 0 HB2 LEU A 92 5.306 44.186 -25.331 1.00 45.32 H new ATOM 0 HB3 LEU A 92 5.272 45.188 -26.768 1.00 45.32 H new ATOM 0 HG LEU A 92 7.766 45.370 -25.183 1.00 72.44 H new ATOM 0 HD11 LEU A 92 8.634 43.226 -26.031 1.00 72.21 H new ATOM 0 HD12 LEU A 92 7.271 42.989 -24.912 1.00 72.21 H new ATOM 0 HD13 LEU A 92 7.020 42.828 -26.666 1.00 72.21 H new ATOM 0 HD21 LEU A 92 8.761 45.250 -27.436 1.00 11.44 H new ATOM 0 HD22 LEU A 92 7.151 44.930 -28.125 1.00 11.44 H new ATOM 0 HD23 LEU A 92 7.490 46.492 -27.342 1.00 11.44 H new ATOM 1632 N GLY A 108 -0.429 49.658 -11.641 1.00 43.13 N ATOM 1633 CA GLY A 108 0.139 48.605 -10.820 1.00 70.33 C ATOM 1634 C GLY A 108 -0.061 47.228 -11.423 1.00 14.30 C ATOM 1635 O GLY A 108 -0.004 46.221 -10.718 1.00 32.52 O ATOM 0 HA2 GLY A 108 1.205 48.788 -10.686 1.00 70.33 H new ATOM 0 HA3 GLY A 108 -0.317 48.635 -9.830 1.00 70.33 H new ATOM 1639 N ILE A 109 -0.298 47.185 -12.730 1.00 14.23 N ATOM 1640 CA ILE A 109 -0.509 45.922 -13.426 1.00 44.11 C ATOM 1641 C ILE A 109 0.598 44.924 -13.101 1.00 51.42 C ATOM 1642 O ILE A 109 0.329 43.769 -12.771 1.00 51.31 O ATOM 1643 CB ILE A 109 -0.571 46.124 -14.952 1.00 24.03 C ATOM 1644 CG1 ILE A 109 -0.565 44.772 -15.668 1.00 23.24 C ATOM 1645 CG2 ILE A 109 0.595 46.983 -15.420 1.00 73.41 C ATOM 1646 CD1 ILE A 109 -1.721 43.877 -15.279 1.00 4.04 C ATOM 0 H ILE A 109 -0.349 48.010 -13.328 1.00 14.23 H new ATOM 0 HA ILE A 109 -1.464 45.527 -13.081 1.00 44.11 H new ATOM 0 HB ILE A 109 -1.499 46.640 -15.198 1.00 24.03 H new ATOM 0 HG12 ILE A 109 -0.592 44.940 -16.745 1.00 23.24 H new ATOM 0 HG13 ILE A 109 0.371 44.258 -15.449 1.00 23.24 H new ATOM 0 HG21 ILE A 109 0.538 47.117 -16.500 1.00 73.41 H new ATOM 0 HG22 ILE A 109 0.549 47.956 -14.931 1.00 73.41 H new ATOM 0 HG23 ILE A 109 1.534 46.492 -15.165 1.00 73.41 H new ATOM 0 HD11 ILE A 109 -1.653 42.936 -15.825 1.00 4.04 H new ATOM 0 HD12 ILE A 109 -1.683 43.678 -14.208 1.00 4.04 H new ATOM 0 HD13 ILE A 109 -2.662 44.371 -15.523 1.00 4.04 H new ATOM 1658 N ASP A 110 1.843 45.379 -13.195 1.00 73.32 N ATOM 1659 CA ASP A 110 2.991 44.527 -12.908 1.00 61.03 C ATOM 1660 C ASP A 110 3.030 44.147 -11.431 1.00 62.35 C ATOM 1661 O ASP A 110 3.591 43.116 -11.061 1.00 25.44 O ATOM 1662 CB ASP A 110 4.289 45.235 -13.300 1.00 11.31 C ATOM 1663 CG ASP A 110 5.491 44.313 -13.245 1.00 50.25 C ATOM 1664 OD1 ASP A 110 5.925 43.970 -12.126 1.00 75.21 O ATOM 1665 OD2 ASP A 110 5.999 43.936 -14.322 1.00 72.53 O ATOM 0 H ASP A 110 2.083 46.332 -13.468 1.00 73.32 H new ATOM 0 HA ASP A 110 2.892 43.615 -13.497 1.00 61.03 H new ATOM 0 HB2 ASP A 110 4.190 45.638 -14.308 1.00 11.31 H new ATOM 0 HB3 ASP A 110 4.453 46.082 -12.633 1.00 11.31 H new ATOM 1670 N ARG A 111 2.432 44.987 -10.593 1.00 75.54 N ATOM 1671 CA ARG A 111 2.400 44.740 -9.157 1.00 21.41 C ATOM 1672 C ARG A 111 1.402 43.637 -8.816 1.00 55.24 C ATOM 1673 O ARG A 111 1.719 42.703 -8.079 1.00 1.11 O ATOM 1674 CB ARG A 111 2.037 46.022 -8.405 1.00 73.43 C ATOM 1675 CG ARG A 111 3.189 46.605 -7.604 1.00 41.54 C ATOM 1676 CD ARG A 111 4.350 46.999 -8.504 1.00 70.14 C ATOM 1677 NE ARG A 111 5.036 48.195 -8.022 1.00 31.43 N ATOM 1678 CZ ARG A 111 5.845 48.203 -6.968 1.00 73.11 C ATOM 1679 NH1 ARG A 111 6.068 47.085 -6.291 1.00 1.22 N ATOM 1680 NH2 ARG A 111 6.433 49.331 -6.590 1.00 75.13 N ATOM 0 H ARG A 111 1.963 45.845 -10.884 1.00 75.54 H new ATOM 0 HA ARG A 111 3.393 44.415 -8.848 1.00 21.41 H new ATOM 0 HB2 ARG A 111 1.690 46.767 -9.121 1.00 73.43 H new ATOM 0 HB3 ARG A 111 1.205 45.815 -7.731 1.00 73.43 H new ATOM 0 HG2 ARG A 111 2.844 47.478 -7.051 1.00 41.54 H new ATOM 0 HG3 ARG A 111 3.528 45.875 -6.869 1.00 41.54 H new ATOM 0 HD2 ARG A 111 5.059 46.173 -8.563 1.00 70.14 H new ATOM 0 HD3 ARG A 111 3.981 47.175 -9.515 1.00 70.14 H new ATOM 0 HE ARG A 111 4.886 49.072 -8.522 1.00 31.43 H new ATOM 0 HH11 ARG A 111 5.618 46.216 -6.579 1.00 1.22 H new ATOM 0 HH12 ARG A 111 6.690 47.094 -5.482 1.00 1.22 H new ATOM 0 HH21 ARG A 111 6.264 50.193 -7.109 1.00 75.13 H new ATOM 0 HH22 ARG A 111 7.054 49.336 -5.781 1.00 75.13 H new ATOM 1694 N LEU A 112 0.194 43.753 -9.358 1.00 31.54 N ATOM 1695 CA LEU A 112 -0.852 42.766 -9.111 1.00 52.03 C ATOM 1696 C LEU A 112 -0.496 41.425 -9.744 1.00 62.22 C ATOM 1697 O LEU A 112 -0.622 40.375 -9.113 1.00 3.43 O ATOM 1698 CB LEU A 112 -2.190 43.264 -9.662 1.00 63.54 C ATOM 1699 CG LEU A 112 -3.256 43.612 -8.623 1.00 41.12 C ATOM 1700 CD1 LEU A 112 -3.520 42.425 -7.710 1.00 65.11 C ATOM 1701 CD2 LEU A 112 -2.832 44.828 -7.812 1.00 34.33 C ATOM 0 H LEU A 112 -0.085 44.519 -9.970 1.00 31.54 H new ATOM 0 HA LEU A 112 -0.939 42.626 -8.033 1.00 52.03 H new ATOM 0 HB2 LEU A 112 -2.003 44.148 -10.271 1.00 63.54 H new ATOM 0 HB3 LEU A 112 -2.594 42.499 -10.326 1.00 63.54 H new ATOM 0 HG LEU A 112 -4.181 43.853 -9.146 1.00 41.12 H new ATOM 0 HD11 LEU A 112 -4.281 42.692 -6.977 1.00 65.11 H new ATOM 0 HD12 LEU A 112 -3.868 41.580 -8.304 1.00 65.11 H new ATOM 0 HD13 LEU A 112 -2.600 42.151 -7.194 1.00 65.11 H new ATOM 0 HD21 LEU A 112 -3.602 45.062 -7.077 1.00 34.33 H new ATOM 0 HD22 LEU A 112 -1.894 44.614 -7.299 1.00 34.33 H new ATOM 0 HD23 LEU A 112 -2.695 45.680 -8.478 1.00 34.33 H new ATOM 1713 N PHE A 113 -0.048 41.467 -10.995 1.00 32.22 N ATOM 1714 CA PHE A 113 0.328 40.255 -11.713 1.00 62.12 C ATOM 1715 C PHE A 113 1.473 39.537 -11.005 1.00 64.44 C ATOM 1716 O PHE A 113 1.616 38.318 -11.110 1.00 60.41 O ATOM 1717 CB PHE A 113 0.733 40.593 -13.149 1.00 64.04 C ATOM 1718 CG PHE A 113 1.492 39.492 -13.833 1.00 72.33 C ATOM 1719 CD1 PHE A 113 0.862 38.304 -14.169 1.00 65.11 C ATOM 1720 CD2 PHE A 113 2.834 39.644 -14.140 1.00 5.10 C ATOM 1721 CE1 PHE A 113 1.557 37.288 -14.799 1.00 4.52 C ATOM 1722 CE2 PHE A 113 3.534 38.632 -14.770 1.00 44.50 C ATOM 1723 CZ PHE A 113 2.895 37.453 -15.099 1.00 25.23 C ATOM 0 H PHE A 113 0.063 42.327 -11.532 1.00 32.22 H new ATOM 0 HA PHE A 113 -0.536 39.591 -11.733 1.00 62.12 H new ATOM 0 HB2 PHE A 113 -0.163 40.819 -13.727 1.00 64.04 H new ATOM 0 HB3 PHE A 113 1.344 41.495 -13.143 1.00 64.04 H new ATOM 0 HD1 PHE A 113 -0.184 38.170 -13.936 1.00 65.11 H new ATOM 0 HD2 PHE A 113 3.339 40.564 -13.884 1.00 5.10 H new ATOM 0 HE1 PHE A 113 1.054 36.367 -15.056 1.00 4.52 H new ATOM 0 HE2 PHE A 113 4.580 38.763 -15.005 1.00 44.50 H new ATOM 0 HZ PHE A 113 3.441 36.661 -15.590 1.00 25.23 H new ATOM 1733 N LEU A 114 2.288 40.300 -10.285 1.00 55.44 N ATOM 1734 CA LEU A 114 3.421 39.738 -9.560 1.00 5.42 C ATOM 1735 C LEU A 114 2.948 38.857 -8.408 1.00 44.40 C ATOM 1736 O LEU A 114 3.476 37.766 -8.191 1.00 54.33 O ATOM 1737 CB LEU A 114 4.316 40.858 -9.026 1.00 44.31 C ATOM 1738 CG LEU A 114 5.706 40.965 -9.656 1.00 54.10 C ATOM 1739 CD1 LEU A 114 6.602 39.839 -9.166 1.00 30.40 C ATOM 1740 CD2 LEU A 114 5.606 40.948 -11.174 1.00 75.54 C ATOM 0 H LEU A 114 2.185 41.310 -10.188 1.00 55.44 H new ATOM 0 HA LEU A 114 3.994 39.122 -10.253 1.00 5.42 H new ATOM 0 HB2 LEU A 114 3.800 41.807 -9.169 1.00 44.31 H new ATOM 0 HB3 LEU A 114 4.436 40.719 -7.952 1.00 44.31 H new ATOM 0 HG LEU A 114 6.150 41.913 -9.352 1.00 54.10 H new ATOM 0 HD11 LEU A 114 7.586 39.932 -9.625 1.00 30.40 H new ATOM 0 HD12 LEU A 114 6.700 39.897 -8.082 1.00 30.40 H new ATOM 0 HD13 LEU A 114 6.163 38.880 -9.439 1.00 30.40 H new ATOM 0 HD21 LEU A 114 6.604 41.025 -11.605 1.00 75.54 H new ATOM 0 HD22 LEU A 114 5.142 40.016 -11.498 1.00 75.54 H new ATOM 0 HD23 LEU A 114 5.000 41.790 -11.508 1.00 75.54 H new ATOM 1752 N TRP A 115 1.951 39.337 -7.675 1.00 13.34 N ATOM 1753 CA TRP A 115 1.405 38.592 -6.546 1.00 32.10 C ATOM 1754 C TRP A 115 0.442 37.510 -7.023 1.00 24.43 C ATOM 1755 O TRP A 115 0.453 36.389 -6.513 1.00 30.21 O ATOM 1756 CB TRP A 115 0.689 39.539 -5.581 1.00 64.20 C ATOM 1757 CG TRP A 115 0.177 38.856 -4.349 1.00 70.12 C ATOM 1758 CD1 TRP A 115 -1.036 38.249 -4.193 1.00 74.34 C ATOM 1759 CD2 TRP A 115 0.863 38.713 -3.101 1.00 31.53 C ATOM 1760 NE1 TRP A 115 -1.146 37.737 -2.923 1.00 71.41 N ATOM 1761 CE2 TRP A 115 0.006 38.007 -2.233 1.00 40.03 C ATOM 1762 CE3 TRP A 115 2.118 39.109 -2.632 1.00 11.43 C ATOM 1763 CZ2 TRP A 115 0.365 37.693 -0.925 1.00 65.14 C ATOM 1764 CZ3 TRP A 115 2.473 38.797 -1.333 1.00 41.12 C ATOM 1765 CH2 TRP A 115 1.600 38.094 -0.492 1.00 61.15 C ATOM 0 H TRP A 115 1.504 40.238 -7.842 1.00 13.34 H new ATOM 0 HA TRP A 115 2.233 38.112 -6.025 1.00 32.10 H new ATOM 0 HB2 TRP A 115 1.374 40.335 -5.288 1.00 64.20 H new ATOM 0 HB3 TRP A 115 -0.145 40.012 -6.099 1.00 64.20 H new ATOM 0 HD1 TRP A 115 -1.797 38.181 -4.956 1.00 74.34 H new ATOM 0 HE1 TRP A 115 -1.955 37.237 -2.554 1.00 71.41 H new ATOM 0 HE3 TRP A 115 2.799 39.649 -3.273 1.00 11.43 H new ATOM 0 HZ2 TRP A 115 -0.307 37.152 -0.275 1.00 65.14 H new ATOM 0 HZ3 TRP A 115 3.440 39.100 -0.960 1.00 41.12 H new ATOM 0 HH2 TRP A 115 1.908 37.864 0.517 1.00 61.15 H new ATOM 1776 N ILE A 116 -0.388 37.852 -8.002 1.00 65.33 N ATOM 1777 CA ILE A 116 -1.355 36.908 -8.548 1.00 20.32 C ATOM 1778 C ILE A 116 -0.666 35.644 -9.052 1.00 40.45 C ATOM 1779 O ILE A 116 -1.275 34.577 -9.120 1.00 32.44 O ATOM 1780 CB ILE A 116 -2.164 37.533 -9.700 1.00 22.13 C ATOM 1781 CG1 ILE A 116 -3.611 37.039 -9.662 1.00 73.45 C ATOM 1782 CG2 ILE A 116 -1.520 37.204 -11.038 1.00 72.23 C ATOM 1783 CD1 ILE A 116 -4.610 38.056 -10.167 1.00 55.01 C ATOM 0 H ILE A 116 -0.410 38.776 -8.434 1.00 65.33 H new ATOM 0 HA ILE A 116 -2.035 36.649 -7.737 1.00 20.32 H new ATOM 0 HB ILE A 116 -2.167 38.616 -9.577 1.00 22.13 H new ATOM 0 HG12 ILE A 116 -3.693 36.133 -10.262 1.00 73.45 H new ATOM 0 HG13 ILE A 116 -3.867 36.768 -8.638 1.00 73.45 H new ATOM 0 HG21 ILE A 116 -2.103 37.652 -11.842 1.00 72.23 H new ATOM 0 HG22 ILE A 116 -0.505 37.601 -11.061 1.00 72.23 H new ATOM 0 HG23 ILE A 116 -1.490 36.123 -11.171 1.00 72.23 H new ATOM 0 HD11 ILE A 116 -5.615 37.638 -10.111 1.00 55.01 H new ATOM 0 HD12 ILE A 116 -4.556 38.955 -9.553 1.00 55.01 H new ATOM 0 HD13 ILE A 116 -4.380 38.310 -11.202 1.00 55.01 H new ATOM 1795 N PHE A 117 0.609 35.773 -9.405 1.00 31.11 N ATOM 1796 CA PHE A 117 1.382 34.641 -9.903 1.00 2.31 C ATOM 1797 C PHE A 117 1.890 33.780 -8.750 1.00 42.31 C ATOM 1798 O PHE A 117 1.571 32.595 -8.658 1.00 34.02 O ATOM 1799 CB PHE A 117 2.561 35.133 -10.745 1.00 41.11 C ATOM 1800 CG PHE A 117 2.624 34.510 -12.110 1.00 54.34 C ATOM 1801 CD1 PHE A 117 1.522 34.538 -12.950 1.00 33.41 C ATOM 1802 CD2 PHE A 117 3.784 33.897 -12.554 1.00 42.12 C ATOM 1803 CE1 PHE A 117 1.576 33.966 -14.207 1.00 71.31 C ATOM 1804 CE2 PHE A 117 3.844 33.324 -13.810 1.00 45.04 C ATOM 1805 CZ PHE A 117 2.739 33.357 -14.637 1.00 53.24 C ATOM 0 H PHE A 117 1.128 36.649 -9.355 1.00 31.11 H new ATOM 0 HA PHE A 117 0.728 34.032 -10.527 1.00 2.31 H new ATOM 0 HB2 PHE A 117 2.494 36.216 -10.851 1.00 41.11 H new ATOM 0 HB3 PHE A 117 3.489 34.921 -10.215 1.00 41.11 H new ATOM 0 HD1 PHE A 117 0.610 35.012 -12.618 1.00 33.41 H new ATOM 0 HD2 PHE A 117 4.651 33.867 -11.911 1.00 42.12 H new ATOM 0 HE1 PHE A 117 0.710 33.995 -14.852 1.00 71.31 H new ATOM 0 HE2 PHE A 117 4.755 32.850 -14.145 1.00 45.04 H new ATOM 0 HZ PHE A 117 2.784 32.908 -15.618 1.00 53.24 H new ATOM 1815 N VAL A 118 2.684 34.385 -7.873 1.00 5.53 N ATOM 1816 CA VAL A 118 3.237 33.676 -6.725 1.00 62.33 C ATOM 1817 C VAL A 118 2.142 32.961 -5.941 1.00 41.24 C ATOM 1818 O VAL A 118 2.381 31.921 -5.327 1.00 41.23 O ATOM 1819 CB VAL A 118 3.988 34.634 -5.781 1.00 35.30 C ATOM 1820 CG1 VAL A 118 4.522 33.882 -4.571 1.00 74.24 C ATOM 1821 CG2 VAL A 118 5.114 35.337 -6.522 1.00 5.31 C ATOM 0 H VAL A 118 2.959 35.365 -7.935 1.00 5.53 H new ATOM 0 HA VAL A 118 3.939 32.940 -7.116 1.00 62.33 H new ATOM 0 HB VAL A 118 3.288 35.391 -5.428 1.00 35.30 H new ATOM 0 HG11 VAL A 118 5.049 34.575 -3.916 1.00 74.24 H new ATOM 0 HG12 VAL A 118 3.692 33.430 -4.028 1.00 74.24 H new ATOM 0 HG13 VAL A 118 5.208 33.102 -4.901 1.00 74.24 H new ATOM 0 HG21 VAL A 118 5.634 36.010 -5.840 1.00 5.31 H new ATOM 0 HG22 VAL A 118 5.815 34.596 -6.906 1.00 5.31 H new ATOM 0 HG23 VAL A 118 4.701 35.910 -7.352 1.00 5.31 H new ATOM 1831 N PHE A 119 0.939 33.526 -5.967 1.00 64.31 N ATOM 1832 CA PHE A 119 -0.194 32.943 -5.258 1.00 60.23 C ATOM 1833 C PHE A 119 -0.637 31.641 -5.919 1.00 74.11 C ATOM 1834 O PHE A 119 -0.679 30.590 -5.280 1.00 31.34 O ATOM 1835 CB PHE A 119 -1.361 33.931 -5.219 1.00 52.40 C ATOM 1836 CG PHE A 119 -1.999 34.052 -3.865 1.00 33.13 C ATOM 1837 CD1 PHE A 119 -1.273 34.520 -2.781 1.00 72.52 C ATOM 1838 CD2 PHE A 119 -3.325 33.697 -3.675 1.00 12.11 C ATOM 1839 CE1 PHE A 119 -1.857 34.632 -1.534 1.00 15.04 C ATOM 1840 CE2 PHE A 119 -3.915 33.808 -2.430 1.00 22.11 C ATOM 1841 CZ PHE A 119 -3.180 34.275 -1.358 1.00 22.33 C ATOM 0 H PHE A 119 0.724 34.386 -6.471 1.00 64.31 H new ATOM 0 HA PHE A 119 0.121 32.723 -4.238 1.00 60.23 H new ATOM 0 HB2 PHE A 119 -1.006 34.912 -5.534 1.00 52.40 H new ATOM 0 HB3 PHE A 119 -2.116 33.618 -5.941 1.00 52.40 H new ATOM 0 HD1 PHE A 119 -0.238 34.800 -2.913 1.00 72.52 H new ATOM 0 HD2 PHE A 119 -3.904 33.329 -4.509 1.00 12.11 H new ATOM 0 HE1 PHE A 119 -1.280 34.998 -0.698 1.00 15.04 H new ATOM 0 HE2 PHE A 119 -4.950 33.530 -2.296 1.00 22.11 H new ATOM 0 HZ PHE A 119 -3.639 34.361 -0.384 1.00 22.33 H new ATOM 1851 N VAL A 120 -0.969 31.719 -7.204 1.00 43.30 N ATOM 1852 CA VAL A 120 -1.409 30.548 -7.953 1.00 2.21 C ATOM 1853 C VAL A 120 -0.289 29.520 -8.074 1.00 13.54 C ATOM 1854 O VAL A 120 -0.543 28.329 -8.256 1.00 14.21 O ATOM 1855 CB VAL A 120 -1.892 30.933 -9.364 1.00 3.21 C ATOM 1856 CG1 VAL A 120 -0.759 31.559 -10.164 1.00 32.31 C ATOM 1857 CG2 VAL A 120 -2.456 29.718 -10.084 1.00 22.54 C ATOM 0 H VAL A 120 -0.942 32.581 -7.748 1.00 43.30 H new ATOM 0 HA VAL A 120 -2.240 30.112 -7.399 1.00 2.21 H new ATOM 0 HB VAL A 120 -2.688 31.671 -9.268 1.00 3.21 H new ATOM 0 HG11 VAL A 120 -1.119 31.825 -11.158 1.00 32.31 H new ATOM 0 HG12 VAL A 120 -0.406 32.456 -9.654 1.00 32.31 H new ATOM 0 HG13 VAL A 120 0.061 30.846 -10.253 1.00 32.31 H new ATOM 0 HG21 VAL A 120 -2.792 30.009 -11.079 1.00 22.54 H new ATOM 0 HG22 VAL A 120 -1.682 28.955 -10.171 1.00 22.54 H new ATOM 0 HG23 VAL A 120 -3.298 29.318 -9.519 1.00 22.54 H new ATOM 1867 N CYS A 121 0.949 29.989 -7.970 1.00 65.43 N ATOM 1868 CA CYS A 121 2.110 29.110 -8.068 1.00 74.23 C ATOM 1869 C CYS A 121 2.294 28.307 -6.785 1.00 35.14 C ATOM 1870 O CYS A 121 2.450 27.086 -6.820 1.00 43.43 O ATOM 1871 CB CYS A 121 3.370 29.926 -8.359 1.00 62.51 C ATOM 1872 SG CYS A 121 4.893 29.180 -7.731 1.00 61.35 S ATOM 0 H CYS A 121 1.175 30.972 -7.818 1.00 65.43 H new ATOM 0 HA CYS A 121 1.939 28.414 -8.889 1.00 74.23 H new ATOM 0 HB2 CYS A 121 3.462 30.061 -9.437 1.00 62.51 H new ATOM 0 HB3 CYS A 121 3.257 30.918 -7.922 1.00 62.51 H new ATOM 0 HG CYS A 121 5.904 29.942 -8.028 1.00 61.35 H new ATOM 1878 N VAL A 122 2.275 29.001 -5.651 1.00 31.21 N ATOM 1879 CA VAL A 122 2.440 28.353 -4.355 1.00 63.03 C ATOM 1880 C VAL A 122 1.445 27.211 -4.181 1.00 5.01 C ATOM 1881 O VAL A 122 1.821 26.096 -3.818 1.00 61.03 O ATOM 1882 CB VAL A 122 2.262 29.356 -3.200 1.00 20.53 C ATOM 1883 CG1 VAL A 122 1.880 28.631 -1.918 1.00 22.20 C ATOM 1884 CG2 VAL A 122 3.530 30.172 -3.003 1.00 24.13 C ATOM 0 H VAL A 122 2.147 30.012 -5.604 1.00 31.21 H new ATOM 0 HA VAL A 122 3.454 27.954 -4.327 1.00 63.03 H new ATOM 0 HB VAL A 122 1.454 30.040 -3.457 1.00 20.53 H new ATOM 0 HG11 VAL A 122 1.758 29.355 -1.113 1.00 22.20 H new ATOM 0 HG12 VAL A 122 0.943 28.095 -2.068 1.00 22.20 H new ATOM 0 HG13 VAL A 122 2.665 27.922 -1.653 1.00 22.20 H new ATOM 0 HG21 VAL A 122 3.386 30.876 -2.183 1.00 24.13 H new ATOM 0 HG22 VAL A 122 4.359 29.505 -2.768 1.00 24.13 H new ATOM 0 HG23 VAL A 122 3.755 30.721 -3.917 1.00 24.13 H new ATOM 1894 N PHE A 123 0.174 27.496 -4.442 1.00 1.21 N ATOM 1895 CA PHE A 123 -0.876 26.493 -4.313 1.00 74.14 C ATOM 1896 C PHE A 123 -0.835 25.510 -5.480 1.00 21.45 C ATOM 1897 O PHE A 123 -1.179 24.338 -5.330 1.00 63.13 O ATOM 1898 CB PHE A 123 -2.249 27.166 -4.248 1.00 42.30 C ATOM 1899 CG PHE A 123 -3.394 26.210 -4.417 1.00 75.23 C ATOM 1900 CD1 PHE A 123 -3.839 25.445 -3.351 1.00 11.13 C ATOM 1901 CD2 PHE A 123 -4.027 26.076 -5.643 1.00 32.24 C ATOM 1902 CE1 PHE A 123 -4.892 24.564 -3.504 1.00 75.31 C ATOM 1903 CE2 PHE A 123 -5.082 25.196 -5.802 1.00 5.31 C ATOM 1904 CZ PHE A 123 -5.515 24.440 -4.731 1.00 13.02 C ATOM 0 H PHE A 123 -0.154 28.413 -4.744 1.00 1.21 H new ATOM 0 HA PHE A 123 -0.705 25.941 -3.389 1.00 74.14 H new ATOM 0 HB2 PHE A 123 -2.350 27.675 -3.290 1.00 42.30 H new ATOM 0 HB3 PHE A 123 -2.307 27.930 -5.023 1.00 42.30 H new ATOM 0 HD1 PHE A 123 -3.357 25.539 -2.389 1.00 11.13 H new ATOM 0 HD2 PHE A 123 -3.692 26.666 -6.484 1.00 32.24 H new ATOM 0 HE1 PHE A 123 -5.228 23.973 -2.665 1.00 75.31 H new ATOM 0 HE2 PHE A 123 -5.566 25.100 -6.763 1.00 5.31 H new ATOM 0 HZ PHE A 123 -6.339 23.753 -4.852 1.00 13.02 H new ATOM 1914 N GLY A 124 -0.411 25.997 -6.642 1.00 74.30 N ATOM 1915 CA GLY A 124 -0.333 25.149 -7.817 1.00 73.13 C ATOM 1916 C GLY A 124 0.700 24.050 -7.671 1.00 61.44 C ATOM 1917 O GLY A 124 0.375 22.865 -7.759 1.00 71.02 O ATOM 0 H GLY A 124 -0.120 26.963 -6.791 1.00 74.30 H new ATOM 0 HA2 GLY A 124 -1.310 24.703 -8.005 1.00 73.13 H new ATOM 0 HA3 GLY A 124 -0.089 25.760 -8.686 1.00 73.13 H new ATOM 1921 N THR A 125 1.951 24.441 -7.449 1.00 61.13 N ATOM 1922 CA THR A 125 3.036 23.480 -7.294 1.00 42.40 C ATOM 1923 C THR A 125 2.740 22.492 -6.172 1.00 15.42 C ATOM 1924 O THR A 125 2.922 21.285 -6.331 1.00 10.00 O ATOM 1925 CB THR A 125 4.374 24.186 -7.001 1.00 14.30 C ATOM 1926 OG1 THR A 125 4.211 25.115 -5.923 1.00 65.10 O ATOM 1927 CG2 THR A 125 4.881 24.917 -8.235 1.00 4.34 C ATOM 0 H THR A 125 2.238 25.417 -7.373 1.00 61.13 H new ATOM 0 HA THR A 125 3.117 22.940 -8.237 1.00 42.40 H new ATOM 0 HB THR A 125 5.106 23.429 -6.720 1.00 14.30 H new ATOM 0 HG1 THR A 125 3.703 25.893 -6.235 1.00 65.10 H new ATOM 0 HG21 THR A 125 5.827 25.408 -8.004 1.00 4.34 H new ATOM 0 HG22 THR A 125 5.031 24.203 -9.045 1.00 4.34 H new ATOM 0 HG23 THR A 125 4.149 25.665 -8.541 1.00 4.34 H new ATOM 1935 N ILE A 126 2.281 23.012 -5.038 1.00 50.12 N ATOM 1936 CA ILE A 126 1.957 22.174 -3.890 1.00 43.22 C ATOM 1937 C ILE A 126 1.011 21.045 -4.283 1.00 60.13 C ATOM 1938 O ILE A 126 1.210 19.893 -3.901 1.00 20.32 O ATOM 1939 CB ILE A 126 1.315 22.996 -2.757 1.00 23.22 C ATOM 1940 CG1 ILE A 126 2.385 23.790 -2.004 1.00 32.53 C ATOM 1941 CG2 ILE A 126 0.557 22.083 -1.805 1.00 21.22 C ATOM 1942 CD1 ILE A 126 3.351 22.919 -1.231 1.00 43.24 C ATOM 0 H ILE A 126 2.125 24.009 -4.890 1.00 50.12 H new ATOM 0 HA ILE A 126 2.896 21.750 -3.533 1.00 43.22 H new ATOM 0 HB ILE A 126 0.608 23.700 -3.195 1.00 23.22 H new ATOM 0 HG12 ILE A 126 2.945 24.396 -2.716 1.00 32.53 H new ATOM 0 HG13 ILE A 126 1.897 24.478 -1.314 1.00 32.53 H new ATOM 0 HG21 ILE A 126 0.109 22.678 -1.010 1.00 21.22 H new ATOM 0 HG22 ILE A 126 -0.227 21.558 -2.351 1.00 21.22 H new ATOM 0 HG23 ILE A 126 1.245 21.357 -1.371 1.00 21.22 H new ATOM 0 HD11 ILE A 126 4.081 23.548 -0.722 1.00 43.24 H new ATOM 0 HD12 ILE A 126 2.802 22.332 -0.495 1.00 43.24 H new ATOM 0 HD13 ILE A 126 3.866 22.248 -1.919 1.00 43.24 H new ATOM 1954 N GLY A 127 -0.020 21.384 -5.052 1.00 64.00 N ATOM 1955 CA GLY A 127 -0.981 20.387 -5.486 1.00 41.21 C ATOM 1956 C GLY A 127 -0.341 19.282 -6.302 1.00 72.42 C ATOM 1957 O GLY A 127 -0.785 18.135 -6.261 1.00 72.41 O ATOM 0 H GLY A 127 -0.206 22.331 -5.382 1.00 64.00 H new ATOM 0 HA2 GLY A 127 -1.470 19.954 -4.613 1.00 41.21 H new ATOM 0 HA3 GLY A 127 -1.758 20.869 -6.079 1.00 41.21 H new ATOM 1961 N MET A 128 0.704 19.627 -7.047 1.00 72.11 N ATOM 1962 CA MET A 128 1.405 18.654 -7.877 1.00 41.20 C ATOM 1963 C MET A 128 1.967 17.519 -7.027 1.00 50.10 C ATOM 1964 O MET A 128 1.649 16.350 -7.247 1.00 24.03 O ATOM 1965 CB MET A 128 2.535 19.334 -8.652 1.00 62.04 C ATOM 1966 CG MET A 128 2.112 20.624 -9.337 1.00 65.52 C ATOM 1967 SD MET A 128 0.624 20.424 -10.335 1.00 42.25 S ATOM 1968 CE MET A 128 1.010 18.916 -11.221 1.00 32.33 C ATOM 0 H MET A 128 1.084 20.572 -7.093 1.00 72.11 H new ATOM 0 HA MET A 128 0.690 18.234 -8.584 1.00 41.20 H new ATOM 0 HB2 MET A 128 3.356 19.548 -7.968 1.00 62.04 H new ATOM 0 HB3 MET A 128 2.917 18.642 -9.403 1.00 62.04 H new ATOM 0 HG2 MET A 128 1.939 21.391 -8.583 1.00 65.52 H new ATOM 0 HG3 MET A 128 2.925 20.978 -9.971 1.00 65.52 H new ATOM 0 HE1 MET A 128 0.291 18.774 -12.028 1.00 32.33 H new ATOM 0 HE2 MET A 128 2.015 18.986 -11.638 1.00 32.33 H new ATOM 0 HE3 MET A 128 0.959 18.069 -10.537 1.00 32.33 H new ATOM 1978 N PHE A 129 2.803 17.871 -6.056 1.00 64.12 N ATOM 1979 CA PHE A 129 3.411 16.881 -5.174 1.00 54.01 C ATOM 1980 C PHE A 129 2.394 16.357 -4.163 1.00 45.33 C ATOM 1981 O PHE A 129 2.625 15.344 -3.502 1.00 72.34 O ATOM 1982 CB PHE A 129 4.610 17.487 -4.442 1.00 33.33 C ATOM 1983 CG PHE A 129 5.823 16.602 -4.444 1.00 21.40 C ATOM 1984 CD1 PHE A 129 6.367 16.152 -5.636 1.00 51.14 C ATOM 1985 CD2 PHE A 129 6.420 16.218 -3.253 1.00 53.55 C ATOM 1986 CE1 PHE A 129 7.484 15.338 -5.642 1.00 73.32 C ATOM 1987 CE2 PHE A 129 7.537 15.405 -3.253 1.00 33.30 C ATOM 1988 CZ PHE A 129 8.069 14.963 -4.449 1.00 33.24 C ATOM 0 H PHE A 129 3.075 18.834 -5.860 1.00 64.12 H new ATOM 0 HA PHE A 129 3.753 16.046 -5.786 1.00 54.01 H new ATOM 0 HB2 PHE A 129 4.865 18.440 -4.905 1.00 33.33 H new ATOM 0 HB3 PHE A 129 4.327 17.699 -3.411 1.00 33.33 H new ATOM 0 HD1 PHE A 129 5.913 16.441 -6.572 1.00 51.14 H new ATOM 0 HD2 PHE A 129 6.007 16.558 -2.315 1.00 53.55 H new ATOM 0 HE1 PHE A 129 7.899 14.996 -6.579 1.00 73.32 H new ATOM 0 HE2 PHE A 129 7.994 15.115 -2.318 1.00 33.30 H new ATOM 0 HZ PHE A 129 8.941 14.325 -4.451 1.00 33.24 H new ATOM 1998 N LEU A 130 1.270 17.055 -4.048 1.00 41.21 N ATOM 1999 CA LEU A 130 0.217 16.662 -3.118 1.00 5.13 C ATOM 2000 C LEU A 130 -0.678 15.590 -3.730 1.00 71.02 C ATOM 2001 O LEU A 130 -1.438 14.927 -3.025 1.00 71.43 O ATOM 2002 CB LEU A 130 -0.621 17.879 -2.722 1.00 74.33 C ATOM 2003 CG LEU A 130 -1.692 17.638 -1.658 1.00 13.22 C ATOM 2004 CD1 LEU A 130 -1.521 18.608 -0.499 1.00 41.54 C ATOM 2005 CD2 LEU A 130 -3.083 17.766 -2.262 1.00 11.41 C ATOM 0 H LEU A 130 1.064 17.896 -4.587 1.00 41.21 H new ATOM 0 HA LEU A 130 0.689 16.249 -2.227 1.00 5.13 H new ATOM 0 HB2 LEU A 130 0.052 18.657 -2.362 1.00 74.33 H new ATOM 0 HB3 LEU A 130 -1.107 18.267 -3.617 1.00 74.33 H new ATOM 0 HG LEU A 130 -1.575 16.624 -1.276 1.00 13.22 H new ATOM 0 HD11 LEU A 130 -2.292 18.421 0.248 1.00 41.54 H new ATOM 0 HD12 LEU A 130 -0.538 18.468 -0.049 1.00 41.54 H new ATOM 0 HD13 LEU A 130 -1.610 19.631 -0.865 1.00 41.54 H new ATOM 0 HD21 LEU A 130 -3.832 17.591 -1.490 1.00 11.41 H new ATOM 0 HD22 LEU A 130 -3.211 18.768 -2.672 1.00 11.41 H new ATOM 0 HD23 LEU A 130 -3.203 17.031 -3.058 1.00 11.41 H new