USER MOD reduce.3.24.130724 H: found=0, std=0, add=682, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 681 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 Single : A 5 THR OG1 : rot -92:sc= 0.0573 USER MOD Single : A 10 LYS NZ :NH3+ 141:sc= -2.99 (180deg=-5.75!) USER MOD Single : A 14 SER OG : rot -93:sc= 0.32 USER MOD Single : A 18 LYS NZ :NH3+ -166:sc= -0.0297 (180deg=-0.424) USER MOD Single : A 23 SER OG : rot 180:sc= 0.0193 USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 161:sc= -0.165 (180deg=-1.05) USER MOD Single : A 30 LYS NZ :NH3+ -142:sc= -4.93! (180deg=-9.39!) USER MOD Single : A 32 GLN : amide:sc= 0 X(o=0,f=-0.027) USER MOD Single : A 35 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 36 ASN : amide:sc= -2.11! C(o=-2.1!,f=-4.8!) USER MOD Single : A 37 SER OG : rot 80:sc= 1.1 USER MOD Single : A 38 ASN : amide:sc= -2.29! C(o=-2.3!,f=-6.9!) USER MOD Single : A 44 GLN : amide:sc= -0.838 K(o=-0.84,f=-2.2!) USER MOD Single : A 47 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 48 HIS : no HD1:sc= -0.432 K(o=-0.43,f=-1.3) USER MOD Single : A 51 MET CE :methyl 160:sc= -0.0517 (180deg=-0.633) USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 180:sc= -0.0483 USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= -0.123 K(o=-0.12,f=-4.2!) USER MOD Single : A 75 THR OG1 : rot 78:sc= 1.23 USER MOD Single : A 76 GLN : amide:sc= -2.41 K(o=-2.4,f=-1.6!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 27 N VAL A 3 -4.757 -15.926 15.353 1.00 0.00 N ATOM 28 CA VAL A 3 -3.407 -16.224 15.815 1.00 0.00 C ATOM 29 C VAL A 3 -2.889 -15.105 16.714 1.00 0.00 C ATOM 30 O VAL A 3 -2.961 -13.926 16.365 1.00 0.00 O ATOM 31 CB VAL A 3 -2.473 -16.399 14.616 1.00 0.00 C ATOM 32 CG1 VAL A 3 -1.171 -17.060 15.072 1.00 0.00 C ATOM 33 CG2 VAL A 3 -3.152 -17.284 13.569 1.00 0.00 C ATOM 0 HA VAL A 3 -3.434 -17.150 16.390 1.00 0.00 H new ATOM 0 HB VAL A 3 -2.252 -15.423 14.183 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -0.507 -17.184 14.217 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -0.687 -16.432 15.820 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -1.391 -18.036 15.505 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -2.488 -17.410 12.714 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -3.372 -18.259 14.004 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -4.080 -16.814 13.242 1.00 0.00 H new ATOM 43 N TRP A 4 -2.368 -15.487 17.875 1.00 0.00 N ATOM 44 CA TRP A 4 -1.838 -14.522 18.832 1.00 0.00 C ATOM 45 C TRP A 4 -0.424 -14.132 18.460 1.00 0.00 C ATOM 46 O TRP A 4 0.330 -14.930 17.906 1.00 0.00 O ATOM 47 CB TRP A 4 -1.862 -15.118 20.245 1.00 0.00 C ATOM 48 CG TRP A 4 -3.241 -15.015 20.808 1.00 0.00 C ATOM 49 CD1 TRP A 4 -3.605 -14.183 21.807 1.00 0.00 C ATOM 50 CD2 TRP A 4 -4.443 -15.735 20.412 1.00 0.00 C ATOM 51 NE1 TRP A 4 -4.953 -14.352 22.059 1.00 0.00 N ATOM 52 CE2 TRP A 4 -5.514 -15.298 21.225 1.00 0.00 C ATOM 53 CE3 TRP A 4 -4.705 -16.720 19.442 1.00 0.00 C ATOM 54 CZ2 TRP A 4 -6.801 -15.815 21.079 1.00 0.00 C ATOM 55 CZ3 TRP A 4 -5.999 -17.243 19.292 1.00 0.00 C ATOM 56 CH2 TRP A 4 -7.045 -16.793 20.110 1.00 0.00 C ATOM 0 H TRP A 4 -2.301 -16.459 18.177 1.00 0.00 H new ATOM 0 HA TRP A 4 -2.464 -13.630 18.810 1.00 0.00 H new ATOM 0 HB2 TRP A 4 -1.547 -16.161 20.216 1.00 0.00 H new ATOM 0 HB3 TRP A 4 -1.156 -14.589 20.886 1.00 0.00 H new ATOM 0 HD1 TRP A 4 -2.950 -13.498 22.324 1.00 0.00 H new ATOM 0 HE1 TRP A 4 -5.470 -13.840 22.774 1.00 0.00 H new ATOM 0 HE3 TRP A 4 -3.906 -17.076 18.809 1.00 0.00 H new ATOM 0 HZ2 TRP A 4 -7.604 -15.462 21.710 1.00 0.00 H new ATOM 0 HZ3 TRP A 4 -6.190 -17.996 18.542 1.00 0.00 H new ATOM 0 HH2 TRP A 4 -8.038 -17.201 19.992 1.00 0.00 H new ATOM 67 N THR A 5 -0.079 -12.885 18.764 1.00 0.00 N ATOM 68 CA THR A 5 1.245 -12.369 18.454 1.00 0.00 C ATOM 69 C THR A 5 2.313 -13.438 18.712 1.00 0.00 C ATOM 70 O THR A 5 2.057 -14.414 19.418 1.00 0.00 O ATOM 71 CB THR A 5 1.528 -11.111 19.315 1.00 0.00 C ATOM 72 OG1 THR A 5 0.683 -11.115 20.453 1.00 0.00 O ATOM 73 CG2 THR A 5 1.269 -9.836 18.497 1.00 0.00 C ATOM 0 H THR A 5 -0.697 -12.216 19.223 1.00 0.00 H new ATOM 0 HA THR A 5 1.280 -12.098 17.399 1.00 0.00 H new ATOM 0 HB THR A 5 2.572 -11.128 19.629 1.00 0.00 H new ATOM 0 HG1 THR A 5 -0.138 -10.619 20.253 1.00 0.00 H new ATOM 0 HG21 THR A 5 1.472 -8.961 19.114 1.00 0.00 H new ATOM 0 HG22 THR A 5 1.922 -9.824 17.625 1.00 0.00 H new ATOM 0 HG23 THR A 5 0.229 -9.818 18.171 1.00 0.00 H new ATOM 81 N PRO A 6 3.494 -13.250 18.176 1.00 0.00 N ATOM 82 CA PRO A 6 4.631 -14.195 18.376 1.00 0.00 C ATOM 83 C PRO A 6 4.793 -14.580 19.844 1.00 0.00 C ATOM 84 O PRO A 6 3.975 -14.204 20.685 1.00 0.00 O ATOM 85 CB PRO A 6 5.844 -13.394 17.891 1.00 0.00 C ATOM 86 CG PRO A 6 5.304 -12.474 16.850 1.00 0.00 C ATOM 87 CD PRO A 6 3.878 -12.122 17.289 1.00 0.00 C ATOM 0 HA PRO A 6 4.490 -15.136 17.844 1.00 0.00 H new ATOM 0 HB2 PRO A 6 6.304 -12.839 18.709 1.00 0.00 H new ATOM 0 HB3 PRO A 6 6.612 -14.049 17.479 1.00 0.00 H new ATOM 0 HG2 PRO A 6 5.918 -11.577 16.766 1.00 0.00 H new ATOM 0 HG3 PRO A 6 5.303 -12.952 15.870 1.00 0.00 H new ATOM 0 HD2 PRO A 6 3.845 -11.169 17.817 1.00 0.00 H new ATOM 0 HD3 PRO A 6 3.206 -12.037 16.435 1.00 0.00 H new ATOM 95 N GLU A 7 5.843 -15.342 20.143 1.00 0.00 N ATOM 96 CA GLU A 7 6.111 -15.771 21.519 1.00 0.00 C ATOM 97 C GLU A 7 5.797 -14.653 22.514 1.00 0.00 C ATOM 98 O GLU A 7 5.620 -14.904 23.705 1.00 0.00 O ATOM 99 CB GLU A 7 7.578 -16.181 21.664 1.00 0.00 C ATOM 100 CG GLU A 7 8.482 -15.002 21.297 1.00 0.00 C ATOM 101 CD GLU A 7 9.944 -15.407 21.438 1.00 0.00 C ATOM 102 OE1 GLU A 7 10.265 -16.526 21.074 1.00 0.00 O ATOM 103 OE2 GLU A 7 10.722 -14.592 21.907 1.00 0.00 O ATOM 0 H GLU A 7 6.520 -15.675 19.457 1.00 0.00 H new ATOM 0 HA GLU A 7 5.467 -16.623 21.737 1.00 0.00 H new ATOM 0 HB2 GLU A 7 7.777 -16.500 22.687 1.00 0.00 H new ATOM 0 HB3 GLU A 7 7.793 -17.032 21.018 1.00 0.00 H new ATOM 0 HG2 GLU A 7 8.281 -14.683 20.274 1.00 0.00 H new ATOM 0 HG3 GLU A 7 8.267 -14.152 21.945 1.00 0.00 H new ATOM 110 N VAL A 8 5.711 -13.421 22.012 1.00 0.00 N ATOM 111 CA VAL A 8 5.399 -12.276 22.860 1.00 0.00 C ATOM 112 C VAL A 8 4.278 -12.644 23.824 1.00 0.00 C ATOM 113 O VAL A 8 4.193 -12.110 24.928 1.00 0.00 O ATOM 114 CB VAL A 8 4.953 -11.094 21.984 1.00 0.00 C ATOM 115 CG1 VAL A 8 4.328 -9.998 22.856 1.00 0.00 C ATOM 116 CG2 VAL A 8 6.161 -10.527 21.236 1.00 0.00 C ATOM 0 H VAL A 8 5.852 -13.193 21.028 1.00 0.00 H new ATOM 0 HA VAL A 8 6.286 -11.994 23.427 1.00 0.00 H new ATOM 0 HB VAL A 8 4.210 -11.443 21.267 1.00 0.00 H new ATOM 0 HG11 VAL A 8 4.016 -9.165 22.226 1.00 0.00 H new ATOM 0 HG12 VAL A 8 3.462 -10.401 23.381 1.00 0.00 H new ATOM 0 HG13 VAL A 8 5.062 -9.648 23.582 1.00 0.00 H new ATOM 0 HG21 VAL A 8 5.844 -9.689 20.615 1.00 0.00 H new ATOM 0 HG22 VAL A 8 6.906 -10.185 21.954 1.00 0.00 H new ATOM 0 HG23 VAL A 8 6.595 -11.302 20.605 1.00 0.00 H new ATOM 126 N LEU A 9 3.429 -13.570 23.404 1.00 0.00 N ATOM 127 CA LEU A 9 2.334 -14.008 24.251 1.00 0.00 C ATOM 128 C LEU A 9 2.881 -14.647 25.518 1.00 0.00 C ATOM 129 O LEU A 9 2.394 -14.389 26.618 1.00 0.00 O ATOM 130 CB LEU A 9 1.459 -15.012 23.500 1.00 0.00 C ATOM 131 CG LEU A 9 0.372 -15.594 24.449 1.00 0.00 C ATOM 132 CD1 LEU A 9 -0.973 -15.689 23.718 1.00 0.00 C ATOM 133 CD2 LEU A 9 0.781 -17.000 24.929 1.00 0.00 C ATOM 0 H LEU A 9 3.477 -14.027 22.493 1.00 0.00 H new ATOM 0 HA LEU A 9 1.729 -13.142 24.521 1.00 0.00 H new ATOM 0 HB2 LEU A 9 0.985 -14.526 22.647 1.00 0.00 H new ATOM 0 HB3 LEU A 9 2.076 -15.819 23.104 1.00 0.00 H new ATOM 0 HG LEU A 9 0.276 -14.929 25.307 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -1.726 -16.098 24.392 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -1.280 -14.696 23.391 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -0.870 -16.341 22.851 1.00 0.00 H new ATOM 0 HD21 LEU A 9 0.012 -17.396 25.592 1.00 0.00 H new ATOM 0 HD22 LEU A 9 0.893 -17.660 24.069 1.00 0.00 H new ATOM 0 HD23 LEU A 9 1.728 -16.940 25.466 1.00 0.00 H new ATOM 145 N LYS A 10 3.904 -15.480 25.352 1.00 0.00 N ATOM 146 CA LYS A 10 4.523 -16.150 26.486 1.00 0.00 C ATOM 147 C LYS A 10 5.166 -15.125 27.410 1.00 0.00 C ATOM 148 O LYS A 10 5.081 -15.235 28.630 1.00 0.00 O ATOM 149 CB LYS A 10 5.582 -17.133 25.994 1.00 0.00 C ATOM 150 CG LYS A 10 6.130 -17.925 27.184 1.00 0.00 C ATOM 151 CD LYS A 10 7.121 -18.987 26.689 1.00 0.00 C ATOM 152 CE LYS A 10 8.458 -18.332 26.316 1.00 0.00 C ATOM 153 NZ LYS A 10 9.497 -19.387 26.149 1.00 0.00 N ATOM 0 H LYS A 10 4.319 -15.705 24.448 1.00 0.00 H new ATOM 0 HA LYS A 10 3.755 -16.694 27.036 1.00 0.00 H new ATOM 0 HB2 LYS A 10 5.151 -17.812 25.258 1.00 0.00 H new ATOM 0 HB3 LYS A 10 6.390 -16.596 25.497 1.00 0.00 H new ATOM 0 HG2 LYS A 10 6.624 -17.252 27.884 1.00 0.00 H new ATOM 0 HG3 LYS A 10 5.311 -18.401 27.724 1.00 0.00 H new ATOM 0 HD2 LYS A 10 7.279 -19.737 27.464 1.00 0.00 H new ATOM 0 HD3 LYS A 10 6.708 -19.505 25.824 1.00 0.00 H new ATOM 0 HE2 LYS A 10 8.351 -17.762 25.393 1.00 0.00 H new ATOM 0 HE3 LYS A 10 8.760 -17.629 27.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 10.112 -19.145 25.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 10.069 -19.451 27.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 9.037 -20.302 25.969 1.00 0.00 H new ATOM 167 N ALA A 11 5.810 -14.126 26.816 1.00 0.00 N ATOM 168 CA ALA A 11 6.459 -13.078 27.592 1.00 0.00 C ATOM 169 C ALA A 11 5.418 -12.289 28.374 1.00 0.00 C ATOM 170 O ALA A 11 5.673 -11.834 29.488 1.00 0.00 O ATOM 171 CB ALA A 11 7.231 -12.135 26.667 1.00 0.00 C ATOM 0 H ALA A 11 5.896 -14.021 25.805 1.00 0.00 H new ATOM 0 HA ALA A 11 7.157 -13.542 28.289 1.00 0.00 H new ATOM 0 HB1 ALA A 11 7.711 -11.356 27.260 1.00 0.00 H new ATOM 0 HB2 ALA A 11 7.990 -12.698 26.125 1.00 0.00 H new ATOM 0 HB3 ALA A 11 6.542 -11.677 25.957 1.00 0.00 H new ATOM 177 N ARG A 12 4.242 -12.128 27.779 1.00 0.00 N ATOM 178 CA ARG A 12 3.168 -11.388 28.427 1.00 0.00 C ATOM 179 C ARG A 12 2.782 -12.057 29.741 1.00 0.00 C ATOM 180 O ARG A 12 2.634 -11.392 30.767 1.00 0.00 O ATOM 181 CB ARG A 12 1.943 -11.335 27.511 1.00 0.00 C ATOM 182 CG ARG A 12 0.914 -10.322 28.054 1.00 0.00 C ATOM 183 CD ARG A 12 1.205 -8.928 27.490 1.00 0.00 C ATOM 184 NE ARG A 12 0.958 -8.913 26.053 1.00 0.00 N ATOM 185 CZ ARG A 12 1.456 -7.954 25.282 1.00 0.00 C ATOM 186 NH1 ARG A 12 2.187 -7.010 25.808 1.00 0.00 N ATOM 187 NH2 ARG A 12 1.217 -7.957 23.999 1.00 0.00 N ATOM 0 H ARG A 12 4.010 -12.497 26.857 1.00 0.00 H new ATOM 0 HA ARG A 12 3.519 -10.376 28.628 1.00 0.00 H new ATOM 0 HB2 ARG A 12 2.246 -11.052 26.503 1.00 0.00 H new ATOM 0 HB3 ARG A 12 1.489 -12.324 27.441 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -0.094 -10.632 27.779 1.00 0.00 H new ATOM 0 HG3 ARG A 12 0.954 -10.299 29.143 1.00 0.00 H new ATOM 0 HD2 ARG A 12 0.576 -8.188 27.984 1.00 0.00 H new ATOM 0 HD3 ARG A 12 2.240 -8.653 27.693 1.00 0.00 H new ATOM 0 HE ARG A 12 0.393 -9.652 25.633 1.00 0.00 H new ATOM 0 HH11 ARG A 12 2.375 -7.009 26.810 1.00 0.00 H new ATOM 0 HH12 ARG A 12 2.570 -6.273 25.217 1.00 0.00 H new ATOM 0 HH21 ARG A 12 0.647 -8.697 23.588 1.00 0.00 H new ATOM 0 HH22 ARG A 12 1.600 -7.220 23.407 1.00 0.00 H new ATOM 201 N ALA A 13 2.626 -13.377 29.707 1.00 0.00 N ATOM 202 CA ALA A 13 2.262 -14.126 30.906 1.00 0.00 C ATOM 203 C ALA A 13 3.506 -14.421 31.736 1.00 0.00 C ATOM 204 O ALA A 13 3.511 -14.252 32.955 1.00 0.00 O ATOM 205 CB ALA A 13 1.584 -15.439 30.511 1.00 0.00 C ATOM 0 H ALA A 13 2.745 -13.947 28.869 1.00 0.00 H new ATOM 0 HA ALA A 13 1.571 -13.528 31.500 1.00 0.00 H new ATOM 0 HB1 ALA A 13 1.314 -15.994 31.410 1.00 0.00 H new ATOM 0 HB2 ALA A 13 0.685 -15.225 29.933 1.00 0.00 H new ATOM 0 HB3 ALA A 13 2.269 -16.035 29.908 1.00 0.00 H new ATOM 211 N SER A 14 4.563 -14.852 31.057 1.00 0.00 N ATOM 212 CA SER A 14 5.821 -15.161 31.724 1.00 0.00 C ATOM 213 C SER A 14 6.493 -13.880 32.202 1.00 0.00 C ATOM 214 O SER A 14 7.425 -13.917 33.004 1.00 0.00 O ATOM 215 CB SER A 14 6.753 -15.909 30.771 1.00 0.00 C ATOM 216 OG SER A 14 7.905 -16.339 31.485 1.00 0.00 O ATOM 0 H SER A 14 4.573 -14.995 30.047 1.00 0.00 H new ATOM 0 HA SER A 14 5.610 -15.794 32.586 1.00 0.00 H new ATOM 0 HB2 SER A 14 6.238 -16.766 30.338 1.00 0.00 H new ATOM 0 HB3 SER A 14 7.044 -15.261 29.944 1.00 0.00 H new ATOM 0 HG SER A 14 8.610 -15.663 31.405 1.00 0.00 H new ATOM 222 N VAL A 15 6.012 -12.748 31.695 1.00 0.00 N ATOM 223 CA VAL A 15 6.566 -11.451 32.065 1.00 0.00 C ATOM 224 C VAL A 15 8.028 -11.347 31.641 1.00 0.00 C ATOM 225 O VAL A 15 8.369 -10.585 30.734 1.00 0.00 O ATOM 226 CB VAL A 15 6.459 -11.246 33.579 1.00 0.00 C ATOM 227 CG1 VAL A 15 6.662 -9.767 33.915 1.00 0.00 C ATOM 228 CG2 VAL A 15 5.072 -11.689 34.053 1.00 0.00 C ATOM 0 H VAL A 15 5.241 -12.704 31.028 1.00 0.00 H new ATOM 0 HA VAL A 15 5.994 -10.678 31.551 1.00 0.00 H new ATOM 0 HB VAL A 15 7.225 -11.838 34.080 1.00 0.00 H new ATOM 0 HG11 VAL A 15 6.585 -9.625 34.993 1.00 0.00 H new ATOM 0 HG12 VAL A 15 7.648 -9.449 33.576 1.00 0.00 H new ATOM 0 HG13 VAL A 15 5.898 -9.172 33.415 1.00 0.00 H new ATOM 0 HG21 VAL A 15 4.992 -11.544 35.130 1.00 0.00 H new ATOM 0 HG22 VAL A 15 4.309 -11.095 33.550 1.00 0.00 H new ATOM 0 HG23 VAL A 15 4.926 -12.743 33.817 1.00 0.00 H new ATOM 238 N ILE A 16 8.891 -12.115 32.304 1.00 0.00 N ATOM 239 CA ILE A 16 10.321 -12.101 31.998 1.00 0.00 C ATOM 240 C ILE A 16 10.683 -13.280 31.105 1.00 0.00 C ATOM 241 O ILE A 16 10.293 -14.420 31.363 1.00 0.00 O ATOM 242 CB ILE A 16 11.129 -12.168 33.293 1.00 0.00 C ATOM 243 CG1 ILE A 16 10.642 -11.077 34.258 1.00 0.00 C ATOM 244 CG2 ILE A 16 12.613 -11.954 32.983 1.00 0.00 C ATOM 245 CD1 ILE A 16 10.686 -9.697 33.586 1.00 0.00 C ATOM 0 H ILE A 16 8.626 -12.753 33.054 1.00 0.00 H new ATOM 0 HA ILE A 16 10.557 -11.176 31.472 1.00 0.00 H new ATOM 0 HB ILE A 16 10.994 -13.146 33.754 1.00 0.00 H new ATOM 0 HG12 ILE A 16 9.624 -11.298 34.580 1.00 0.00 H new ATOM 0 HG13 ILE A 16 11.265 -11.071 35.152 1.00 0.00 H new ATOM 0 HG21 ILE A 16 13.188 -12.002 33.907 1.00 0.00 H new ATOM 0 HG22 ILE A 16 12.958 -12.731 32.300 1.00 0.00 H new ATOM 0 HG23 ILE A 16 12.751 -10.977 32.520 1.00 0.00 H new ATOM 0 HD11 ILE A 16 10.337 -8.939 34.288 1.00 0.00 H new ATOM 0 HD12 ILE A 16 11.709 -9.470 33.287 1.00 0.00 H new ATOM 0 HD13 ILE A 16 10.043 -9.700 32.706 1.00 0.00 H new ATOM 257 N GLY A 17 11.429 -12.994 30.043 1.00 0.00 N ATOM 258 CA GLY A 17 11.836 -14.032 29.106 1.00 0.00 C ATOM 259 C GLY A 17 12.349 -15.255 29.851 1.00 0.00 C ATOM 260 O GLY A 17 12.878 -15.145 30.957 1.00 0.00 O ATOM 0 H GLY A 17 11.762 -12.058 29.811 1.00 0.00 H new ATOM 0 HA2 GLY A 17 10.992 -14.311 28.475 1.00 0.00 H new ATOM 0 HA3 GLY A 17 12.614 -13.649 28.446 1.00 0.00 H new ATOM 264 N LYS A 18 12.184 -16.424 29.240 1.00 0.00 N ATOM 265 CA LYS A 18 12.628 -17.671 29.857 1.00 0.00 C ATOM 266 C LYS A 18 12.972 -18.703 28.787 1.00 0.00 C ATOM 267 O LYS A 18 12.436 -19.813 28.785 1.00 0.00 O ATOM 268 CB LYS A 18 11.528 -18.223 30.766 1.00 0.00 C ATOM 269 CG LYS A 18 12.122 -19.279 31.703 1.00 0.00 C ATOM 270 CD LYS A 18 10.996 -20.103 32.326 1.00 0.00 C ATOM 271 CE LYS A 18 11.560 -20.958 33.463 1.00 0.00 C ATOM 272 NZ LYS A 18 12.662 -21.814 32.942 1.00 0.00 N ATOM 0 H LYS A 18 11.749 -16.535 28.324 1.00 0.00 H new ATOM 0 HA LYS A 18 13.520 -17.466 30.449 1.00 0.00 H new ATOM 0 HB2 LYS A 18 11.082 -17.416 31.347 1.00 0.00 H new ATOM 0 HB3 LYS A 18 10.731 -18.661 30.165 1.00 0.00 H new ATOM 0 HG2 LYS A 18 12.800 -19.930 31.151 1.00 0.00 H new ATOM 0 HG3 LYS A 18 12.709 -18.797 32.485 1.00 0.00 H new ATOM 0 HD2 LYS A 18 10.215 -19.444 32.705 1.00 0.00 H new ATOM 0 HD3 LYS A 18 10.536 -20.740 31.571 1.00 0.00 H new ATOM 0 HE2 LYS A 18 11.930 -20.318 34.264 1.00 0.00 H new ATOM 0 HE3 LYS A 18 10.773 -21.580 33.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 12.885 -22.554 33.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 12.365 -22.256 32.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 13.506 -21.230 32.776 1.00 0.00 H new ATOM 286 N PRO A 19 13.854 -18.358 27.886 1.00 0.00 N ATOM 287 CA PRO A 19 14.284 -19.272 26.786 1.00 0.00 C ATOM 288 C PRO A 19 14.978 -20.523 27.322 1.00 0.00 C ATOM 289 O PRO A 19 15.718 -20.464 28.305 1.00 0.00 O ATOM 290 CB PRO A 19 15.244 -18.410 25.942 1.00 0.00 C ATOM 291 CG PRO A 19 15.703 -17.326 26.861 1.00 0.00 C ATOM 292 CD PRO A 19 14.541 -17.059 27.812 1.00 0.00 C ATOM 0 HA PRO A 19 13.440 -19.649 26.208 1.00 0.00 H new ATOM 0 HB2 PRO A 19 16.085 -18.999 25.576 1.00 0.00 H new ATOM 0 HB3 PRO A 19 14.739 -17.998 25.068 1.00 0.00 H new ATOM 0 HG2 PRO A 19 16.594 -17.631 27.410 1.00 0.00 H new ATOM 0 HG3 PRO A 19 15.965 -16.427 26.303 1.00 0.00 H new ATOM 0 HD2 PRO A 19 14.891 -16.733 28.792 1.00 0.00 H new ATOM 0 HD3 PRO A 19 13.883 -16.278 27.432 1.00 0.00 H new ATOM 300 N ILE A 20 14.738 -21.652 26.663 1.00 0.00 N ATOM 301 CA ILE A 20 15.349 -22.912 27.070 1.00 0.00 C ATOM 302 C ILE A 20 16.728 -23.069 26.435 1.00 0.00 C ATOM 303 O ILE A 20 16.950 -22.664 25.294 1.00 0.00 O ATOM 304 CB ILE A 20 14.440 -24.083 26.680 1.00 0.00 C ATOM 305 CG1 ILE A 20 14.211 -24.065 25.173 1.00 0.00 C ATOM 306 CG2 ILE A 20 13.096 -23.957 27.407 1.00 0.00 C ATOM 307 CD1 ILE A 20 13.432 -25.316 24.757 1.00 0.00 C ATOM 0 H ILE A 20 14.128 -21.720 25.849 1.00 0.00 H new ATOM 0 HA ILE A 20 15.473 -22.909 28.153 1.00 0.00 H new ATOM 0 HB ILE A 20 14.915 -25.022 26.965 1.00 0.00 H new ATOM 0 HG12 ILE A 20 13.658 -23.169 24.890 1.00 0.00 H new ATOM 0 HG13 ILE A 20 15.167 -24.029 24.650 1.00 0.00 H new ATOM 0 HG21 ILE A 20 12.452 -24.791 27.128 1.00 0.00 H new ATOM 0 HG22 ILE A 20 13.262 -23.972 28.484 1.00 0.00 H new ATOM 0 HG23 ILE A 20 12.617 -23.019 27.127 1.00 0.00 H new ATOM 0 HD11 ILE A 20 13.269 -25.302 23.679 1.00 0.00 H new ATOM 0 HD12 ILE A 20 14.002 -26.206 25.026 1.00 0.00 H new ATOM 0 HD13 ILE A 20 12.470 -25.333 25.269 1.00 0.00 H new ATOM 319 N GLY A 21 17.640 -23.667 27.187 1.00 0.00 N ATOM 320 CA GLY A 21 18.995 -23.897 26.707 1.00 0.00 C ATOM 321 C GLY A 21 18.970 -24.837 25.518 1.00 0.00 C ATOM 322 O GLY A 21 18.012 -25.587 25.357 1.00 0.00 O ATOM 0 H GLY A 21 17.466 -24.003 28.134 1.00 0.00 H new ATOM 0 HA2 GLY A 21 19.455 -22.950 26.423 1.00 0.00 H new ATOM 0 HA3 GLY A 21 19.605 -24.322 27.504 1.00 0.00 H new ATOM 326 N GLU A 22 20.015 -24.771 24.688 1.00 0.00 N ATOM 327 CA GLU A 22 20.130 -25.617 23.497 1.00 0.00 C ATOM 328 C GLU A 22 19.242 -25.094 22.374 1.00 0.00 C ATOM 329 O GLU A 22 18.406 -24.217 22.587 1.00 0.00 O ATOM 330 CB GLU A 22 19.753 -27.073 23.823 1.00 0.00 C ATOM 331 CG GLU A 22 20.599 -27.566 25.004 1.00 0.00 C ATOM 332 CD GLU A 22 20.196 -28.989 25.376 1.00 0.00 C ATOM 333 OE1 GLU A 22 19.007 -29.255 25.416 1.00 0.00 O ATOM 334 OE2 GLU A 22 21.084 -29.790 25.618 1.00 0.00 O ATOM 0 H GLU A 22 20.800 -24.134 24.821 1.00 0.00 H new ATOM 0 HA GLU A 22 21.168 -25.588 23.167 1.00 0.00 H new ATOM 0 HB2 GLU A 22 18.693 -27.140 24.068 1.00 0.00 H new ATOM 0 HB3 GLU A 22 19.920 -27.707 22.952 1.00 0.00 H new ATOM 0 HG2 GLU A 22 21.657 -27.535 24.742 1.00 0.00 H new ATOM 0 HG3 GLU A 22 20.463 -26.905 25.860 1.00 0.00 H new ATOM 341 N SER A 23 19.436 -25.639 21.179 1.00 0.00 N ATOM 342 CA SER A 23 18.652 -25.226 20.021 1.00 0.00 C ATOM 343 C SER A 23 17.188 -25.610 20.200 1.00 0.00 C ATOM 344 O SER A 23 16.320 -25.115 19.485 1.00 0.00 O ATOM 345 CB SER A 23 19.203 -25.864 18.744 1.00 0.00 C ATOM 346 OG SER A 23 20.622 -25.886 18.806 1.00 0.00 O ATOM 0 H SER A 23 20.126 -26.365 20.987 1.00 0.00 H new ATOM 0 HA SER A 23 18.724 -24.142 19.933 1.00 0.00 H new ATOM 0 HB2 SER A 23 18.816 -26.877 18.634 1.00 0.00 H new ATOM 0 HB3 SER A 23 18.874 -25.300 17.871 1.00 0.00 H new ATOM 0 HG SER A 23 20.979 -26.296 17.990 1.00 0.00 H new ATOM 352 N TYR A 24 16.921 -26.503 21.149 1.00 0.00 N ATOM 353 CA TYR A 24 15.554 -26.952 21.397 1.00 0.00 C ATOM 354 C TYR A 24 14.602 -25.759 21.406 1.00 0.00 C ATOM 355 O TYR A 24 13.397 -25.913 21.217 1.00 0.00 O ATOM 356 CB TYR A 24 15.488 -27.689 22.747 1.00 0.00 C ATOM 357 CG TYR A 24 15.885 -29.138 22.565 1.00 0.00 C ATOM 358 CD1 TYR A 24 17.217 -29.466 22.283 1.00 0.00 C ATOM 359 CD2 TYR A 24 14.921 -30.149 22.675 1.00 0.00 C ATOM 360 CE1 TYR A 24 17.583 -30.805 22.107 1.00 0.00 C ATOM 361 CE2 TYR A 24 15.288 -31.486 22.500 1.00 0.00 C ATOM 362 CZ TYR A 24 16.619 -31.814 22.216 1.00 0.00 C ATOM 363 OH TYR A 24 16.981 -33.134 22.044 1.00 0.00 O ATOM 0 H TYR A 24 17.625 -26.927 21.753 1.00 0.00 H new ATOM 0 HA TYR A 24 15.253 -27.633 20.601 1.00 0.00 H new ATOM 0 HB2 TYR A 24 16.152 -27.209 23.466 1.00 0.00 H new ATOM 0 HB3 TYR A 24 14.479 -27.628 23.155 1.00 0.00 H new ATOM 0 HD1 TYR A 24 17.960 -28.687 22.202 1.00 0.00 H new ATOM 0 HD2 TYR A 24 13.895 -29.895 22.895 1.00 0.00 H new ATOM 0 HE1 TYR A 24 18.609 -31.060 21.887 1.00 0.00 H new ATOM 0 HE2 TYR A 24 14.545 -32.266 22.584 1.00 0.00 H new ATOM 0 HH TYR A 24 16.193 -33.706 22.154 1.00 0.00 H new ATOM 373 N LYS A 25 15.154 -24.573 21.612 1.00 0.00 N ATOM 374 CA LYS A 25 14.345 -23.364 21.625 1.00 0.00 C ATOM 375 C LYS A 25 13.758 -23.109 20.239 1.00 0.00 C ATOM 376 O LYS A 25 12.995 -22.165 20.033 1.00 0.00 O ATOM 377 CB LYS A 25 15.199 -22.173 22.066 1.00 0.00 C ATOM 378 CG LYS A 25 14.371 -20.884 21.982 1.00 0.00 C ATOM 379 CD LYS A 25 15.010 -19.801 22.850 1.00 0.00 C ATOM 380 CE LYS A 25 16.400 -19.459 22.311 1.00 0.00 C ATOM 381 NZ LYS A 25 16.322 -19.223 20.841 1.00 0.00 N ATOM 0 H LYS A 25 16.150 -24.422 21.771 1.00 0.00 H new ATOM 0 HA LYS A 25 13.525 -23.492 22.332 1.00 0.00 H new ATOM 0 HB2 LYS A 25 15.552 -22.324 23.086 1.00 0.00 H new ATOM 0 HB3 LYS A 25 16.082 -22.092 21.432 1.00 0.00 H new ATOM 0 HG2 LYS A 25 14.312 -20.546 20.947 1.00 0.00 H new ATOM 0 HG3 LYS A 25 13.350 -21.074 22.314 1.00 0.00 H new ATOM 0 HD2 LYS A 25 14.383 -18.910 22.856 1.00 0.00 H new ATOM 0 HD3 LYS A 25 15.084 -20.145 23.881 1.00 0.00 H new ATOM 0 HE2 LYS A 25 16.787 -18.572 22.812 1.00 0.00 H new ATOM 0 HE3 LYS A 25 17.094 -20.273 22.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 17.159 -18.690 20.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 16.288 -20.136 20.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 15.464 -18.678 20.622 1.00 0.00 H new ATOM 395 N ARG A 26 14.117 -23.965 19.290 1.00 0.00 N ATOM 396 CA ARG A 26 13.626 -23.830 17.928 1.00 0.00 C ATOM 397 C ARG A 26 12.108 -23.905 17.900 1.00 0.00 C ATOM 398 O ARG A 26 11.470 -23.440 16.956 1.00 0.00 O ATOM 399 CB ARG A 26 14.217 -24.928 17.045 1.00 0.00 C ATOM 400 CG ARG A 26 13.755 -24.724 15.600 1.00 0.00 C ATOM 401 CD ARG A 26 14.451 -25.736 14.689 1.00 0.00 C ATOM 402 NE ARG A 26 15.878 -25.446 14.617 1.00 0.00 N ATOM 403 CZ ARG A 26 16.720 -26.274 14.008 1.00 0.00 C ATOM 404 NH1 ARG A 26 16.273 -27.370 13.458 1.00 0.00 N ATOM 405 NH2 ARG A 26 17.992 -25.991 13.958 1.00 0.00 N ATOM 0 H ARG A 26 14.744 -24.756 19.439 1.00 0.00 H new ATOM 0 HA ARG A 26 13.936 -22.858 17.544 1.00 0.00 H new ATOM 0 HB2 ARG A 26 15.306 -24.905 17.097 1.00 0.00 H new ATOM 0 HB3 ARG A 26 13.902 -25.908 17.404 1.00 0.00 H new ATOM 0 HG2 ARG A 26 12.674 -24.844 15.533 1.00 0.00 H new ATOM 0 HG3 ARG A 26 13.984 -23.709 15.275 1.00 0.00 H new ATOM 0 HD2 ARG A 26 14.296 -26.746 15.069 1.00 0.00 H new ATOM 0 HD3 ARG A 26 14.014 -25.700 13.691 1.00 0.00 H new ATOM 0 HE ARG A 26 16.237 -24.591 15.042 1.00 0.00 H new ATOM 0 HH11 ARG A 26 15.278 -27.590 13.496 1.00 0.00 H new ATOM 0 HH12 ARG A 26 16.919 -28.006 12.990 1.00 0.00 H new ATOM 0 HH21 ARG A 26 18.341 -25.134 14.387 1.00 0.00 H new ATOM 0 HH22 ARG A 26 18.638 -26.627 13.490 1.00 0.00 H new ATOM 419 N ILE A 27 11.534 -24.492 18.942 1.00 0.00 N ATOM 420 CA ILE A 27 10.088 -24.619 19.019 1.00 0.00 C ATOM 421 C ILE A 27 9.429 -23.245 18.946 1.00 0.00 C ATOM 422 O ILE A 27 8.429 -23.058 18.254 1.00 0.00 O ATOM 423 CB ILE A 27 9.696 -25.308 20.333 1.00 0.00 C ATOM 424 CG1 ILE A 27 8.169 -25.320 20.472 1.00 0.00 C ATOM 425 CG2 ILE A 27 10.308 -24.556 21.518 1.00 0.00 C ATOM 426 CD1 ILE A 27 7.761 -26.256 21.609 1.00 0.00 C ATOM 0 H ILE A 27 12.042 -24.883 19.736 1.00 0.00 H new ATOM 0 HA ILE A 27 9.745 -25.220 18.177 1.00 0.00 H new ATOM 0 HB ILE A 27 10.070 -26.332 20.324 1.00 0.00 H new ATOM 0 HG12 ILE A 27 7.805 -24.312 20.670 1.00 0.00 H new ATOM 0 HG13 ILE A 27 7.712 -25.647 19.538 1.00 0.00 H new ATOM 0 HG21 ILE A 27 10.026 -25.050 22.448 1.00 0.00 H new ATOM 0 HG22 ILE A 27 11.394 -24.552 21.424 1.00 0.00 H new ATOM 0 HG23 ILE A 27 9.941 -23.530 21.527 1.00 0.00 H new ATOM 0 HD11 ILE A 27 6.675 -26.261 21.704 1.00 0.00 H new ATOM 0 HD12 ILE A 27 8.111 -27.265 21.393 1.00 0.00 H new ATOM 0 HD13 ILE A 27 8.205 -25.910 22.542 1.00 0.00 H new ATOM 438 N LEU A 28 9.999 -22.283 19.658 1.00 0.00 N ATOM 439 CA LEU A 28 9.464 -20.926 19.665 1.00 0.00 C ATOM 440 C LEU A 28 10.025 -20.127 18.494 1.00 0.00 C ATOM 441 O LEU A 28 9.400 -19.179 18.018 1.00 0.00 O ATOM 442 CB LEU A 28 9.825 -20.246 20.992 1.00 0.00 C ATOM 443 CG LEU A 28 8.831 -20.672 22.096 1.00 0.00 C ATOM 444 CD1 LEU A 28 9.504 -20.572 23.468 1.00 0.00 C ATOM 445 CD2 LEU A 28 7.597 -19.755 22.072 1.00 0.00 C ATOM 0 H LEU A 28 10.829 -22.415 20.237 1.00 0.00 H new ATOM 0 HA LEU A 28 8.380 -20.967 19.562 1.00 0.00 H new ATOM 0 HB2 LEU A 28 10.840 -20.515 21.283 1.00 0.00 H new ATOM 0 HB3 LEU A 28 9.804 -19.163 20.872 1.00 0.00 H new ATOM 0 HG LEU A 28 8.523 -21.702 21.914 1.00 0.00 H new ATOM 0 HD11 LEU A 28 8.798 -20.874 24.242 1.00 0.00 H new ATOM 0 HD12 LEU A 28 10.374 -21.228 23.495 1.00 0.00 H new ATOM 0 HD13 LEU A 28 9.819 -19.544 23.645 1.00 0.00 H new ATOM 0 HD21 LEU A 28 6.901 -20.061 22.853 1.00 0.00 H new ATOM 0 HD22 LEU A 28 7.906 -18.724 22.245 1.00 0.00 H new ATOM 0 HD23 LEU A 28 7.108 -19.828 21.101 1.00 0.00 H new ATOM 457 N ALA A 29 11.212 -20.506 18.041 1.00 0.00 N ATOM 458 CA ALA A 29 11.848 -19.806 16.933 1.00 0.00 C ATOM 459 C ALA A 29 11.088 -20.043 15.630 1.00 0.00 C ATOM 460 O ALA A 29 10.864 -19.117 14.853 1.00 0.00 O ATOM 461 CB ALA A 29 13.298 -20.279 16.786 1.00 0.00 C ATOM 0 H ALA A 29 11.750 -21.286 18.419 1.00 0.00 H new ATOM 0 HA ALA A 29 11.834 -18.737 17.147 1.00 0.00 H new ATOM 0 HB1 ALA A 29 13.770 -19.753 15.956 1.00 0.00 H new ATOM 0 HB2 ALA A 29 13.844 -20.070 17.706 1.00 0.00 H new ATOM 0 HB3 ALA A 29 13.313 -21.351 16.591 1.00 0.00 H new ATOM 467 N LYS A 30 10.697 -21.292 15.400 1.00 0.00 N ATOM 468 CA LYS A 30 9.971 -21.641 14.186 1.00 0.00 C ATOM 469 C LYS A 30 8.573 -21.042 14.220 1.00 0.00 C ATOM 470 O LYS A 30 7.958 -20.809 13.181 1.00 0.00 O ATOM 471 CB LYS A 30 9.893 -23.166 14.051 1.00 0.00 C ATOM 472 CG LYS A 30 8.963 -23.743 15.121 1.00 0.00 C ATOM 473 CD LYS A 30 9.026 -25.271 15.088 1.00 0.00 C ATOM 474 CE LYS A 30 7.861 -25.849 15.899 1.00 0.00 C ATOM 475 NZ LYS A 30 7.564 -24.952 17.048 1.00 0.00 N ATOM 0 H LYS A 30 10.869 -22.073 16.033 1.00 0.00 H new ATOM 0 HA LYS A 30 10.501 -21.235 13.324 1.00 0.00 H new ATOM 0 HB2 LYS A 30 9.528 -23.433 13.059 1.00 0.00 H new ATOM 0 HB3 LYS A 30 10.888 -23.599 14.152 1.00 0.00 H new ATOM 0 HG2 LYS A 30 9.255 -23.378 16.106 1.00 0.00 H new ATOM 0 HG3 LYS A 30 7.941 -23.408 14.947 1.00 0.00 H new ATOM 0 HD2 LYS A 30 8.977 -25.625 14.058 1.00 0.00 H new ATOM 0 HD3 LYS A 30 9.975 -25.615 15.499 1.00 0.00 H new ATOM 0 HE2 LYS A 30 6.979 -25.952 15.267 1.00 0.00 H new ATOM 0 HE3 LYS A 30 8.114 -26.847 16.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 7.317 -25.524 17.881 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 8.401 -24.373 17.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 6.766 -24.331 16.806 1.00 0.00 H new ATOM 489 N LEU A 31 8.079 -20.800 15.427 1.00 0.00 N ATOM 490 CA LEU A 31 6.750 -20.228 15.591 1.00 0.00 C ATOM 491 C LEU A 31 6.700 -18.835 14.980 1.00 0.00 C ATOM 492 O LEU A 31 5.715 -18.459 14.348 1.00 0.00 O ATOM 493 CB LEU A 31 6.379 -20.160 17.078 1.00 0.00 C ATOM 494 CG LEU A 31 5.009 -19.482 17.253 1.00 0.00 C ATOM 495 CD1 LEU A 31 3.937 -20.234 16.446 1.00 0.00 C ATOM 496 CD2 LEU A 31 4.634 -19.486 18.738 1.00 0.00 C ATOM 0 H LEU A 31 8.573 -20.989 16.299 1.00 0.00 H new ATOM 0 HA LEU A 31 6.031 -20.867 15.078 1.00 0.00 H new ATOM 0 HB2 LEU A 31 6.352 -21.165 17.500 1.00 0.00 H new ATOM 0 HB3 LEU A 31 7.141 -19.604 17.625 1.00 0.00 H new ATOM 0 HG LEU A 31 5.065 -18.456 16.889 1.00 0.00 H new ATOM 0 HD11 LEU A 31 2.972 -19.744 16.578 1.00 0.00 H new ATOM 0 HD12 LEU A 31 4.206 -20.227 15.390 1.00 0.00 H new ATOM 0 HD13 LEU A 31 3.873 -21.264 16.798 1.00 0.00 H new ATOM 0 HD21 LEU A 31 3.664 -19.007 18.870 1.00 0.00 H new ATOM 0 HD22 LEU A 31 4.583 -20.514 19.098 1.00 0.00 H new ATOM 0 HD23 LEU A 31 5.388 -18.940 19.305 1.00 0.00 H new ATOM 508 N GLN A 32 7.765 -18.072 15.185 1.00 0.00 N ATOM 509 CA GLN A 32 7.832 -16.714 14.663 1.00 0.00 C ATOM 510 C GLN A 32 7.654 -16.714 13.149 1.00 0.00 C ATOM 511 O GLN A 32 7.003 -15.832 12.590 1.00 0.00 O ATOM 512 CB GLN A 32 9.180 -16.087 15.022 1.00 0.00 C ATOM 513 CG GLN A 32 9.269 -15.897 16.537 1.00 0.00 C ATOM 514 CD GLN A 32 10.639 -15.345 16.916 1.00 0.00 C ATOM 515 OE1 GLN A 32 11.659 -15.982 16.654 1.00 0.00 O ATOM 516 NE2 GLN A 32 10.724 -14.192 17.521 1.00 0.00 N ATOM 0 H GLN A 32 8.590 -18.368 15.706 1.00 0.00 H new ATOM 0 HA GLN A 32 7.028 -16.130 15.110 1.00 0.00 H new ATOM 0 HB2 GLN A 32 9.993 -16.726 14.677 1.00 0.00 H new ATOM 0 HB3 GLN A 32 9.292 -15.127 14.518 1.00 0.00 H new ATOM 0 HG2 GLN A 32 8.488 -15.215 16.872 1.00 0.00 H new ATOM 0 HG3 GLN A 32 9.099 -16.848 17.041 1.00 0.00 H new ATOM 0 HE21 GLN A 32 9.877 -13.666 17.737 1.00 0.00 H new ATOM 0 HE22 GLN A 32 11.637 -13.817 17.778 1.00 0.00 H new ATOM 525 N ARG A 33 8.236 -17.711 12.490 1.00 0.00 N ATOM 526 CA ARG A 33 8.137 -17.817 11.040 1.00 0.00 C ATOM 527 C ARG A 33 6.675 -17.929 10.622 1.00 0.00 C ATOM 528 O ARG A 33 6.270 -17.403 9.585 1.00 0.00 O ATOM 529 CB ARG A 33 8.902 -19.046 10.545 1.00 0.00 C ATOM 530 CG ARG A 33 9.044 -18.975 9.023 1.00 0.00 C ATOM 531 CD ARG A 33 9.716 -20.249 8.512 1.00 0.00 C ATOM 532 NE ARG A 33 10.118 -20.082 7.118 1.00 0.00 N ATOM 533 CZ ARG A 33 11.249 -19.460 6.802 1.00 0.00 C ATOM 534 NH1 ARG A 33 12.008 -18.973 7.745 1.00 0.00 N ATOM 535 NH2 ARG A 33 11.598 -19.334 5.552 1.00 0.00 N ATOM 0 H ARG A 33 8.778 -18.452 12.934 1.00 0.00 H new ATOM 0 HA ARG A 33 8.573 -16.921 10.597 1.00 0.00 H new ATOM 0 HB2 ARG A 33 9.886 -19.088 11.012 1.00 0.00 H new ATOM 0 HB3 ARG A 33 8.374 -19.956 10.830 1.00 0.00 H new ATOM 0 HG2 ARG A 33 8.064 -18.858 8.561 1.00 0.00 H new ATOM 0 HG3 ARG A 33 9.634 -18.103 8.743 1.00 0.00 H new ATOM 0 HD2 ARG A 33 10.588 -20.480 9.124 1.00 0.00 H new ATOM 0 HD3 ARG A 33 9.031 -21.092 8.602 1.00 0.00 H new ATOM 0 HE ARG A 33 9.522 -20.448 6.376 1.00 0.00 H new ATOM 0 HH11 ARG A 33 11.733 -19.070 8.722 1.00 0.00 H new ATOM 0 HH12 ARG A 33 12.877 -18.495 7.505 1.00 0.00 H new ATOM 0 HH21 ARG A 33 11.003 -19.713 4.816 1.00 0.00 H new ATOM 0 HH22 ARG A 33 12.466 -18.856 5.311 1.00 0.00 H new ATOM 549 N ILE A 34 5.891 -18.625 11.437 1.00 0.00 N ATOM 550 CA ILE A 34 4.473 -18.811 11.153 1.00 0.00 C ATOM 551 C ILE A 34 3.766 -17.465 11.121 1.00 0.00 C ATOM 552 O ILE A 34 2.919 -17.221 10.266 1.00 0.00 O ATOM 553 CB ILE A 34 3.830 -19.697 12.221 1.00 0.00 C ATOM 554 CG1 ILE A 34 4.644 -20.988 12.377 1.00 0.00 C ATOM 555 CG2 ILE A 34 2.394 -20.040 11.815 1.00 0.00 C ATOM 556 CD1 ILE A 34 4.813 -21.685 11.020 1.00 0.00 C ATOM 0 H ILE A 34 6.212 -19.069 12.297 1.00 0.00 H new ATOM 0 HA ILE A 34 4.376 -19.294 10.181 1.00 0.00 H new ATOM 0 HB ILE A 34 3.815 -19.161 13.170 1.00 0.00 H new ATOM 0 HG12 ILE A 34 5.623 -20.759 12.799 1.00 0.00 H new ATOM 0 HG13 ILE A 34 4.144 -21.658 13.077 1.00 0.00 H new ATOM 0 HG21 ILE A 34 1.941 -20.671 12.579 1.00 0.00 H new ATOM 0 HG22 ILE A 34 1.816 -19.122 11.713 1.00 0.00 H new ATOM 0 HG23 ILE A 34 2.402 -20.571 10.863 1.00 0.00 H new ATOM 0 HD11 ILE A 34 5.393 -22.599 11.150 1.00 0.00 H new ATOM 0 HD12 ILE A 34 3.832 -21.932 10.613 1.00 0.00 H new ATOM 0 HD13 ILE A 34 5.334 -21.020 10.332 1.00 0.00 H new ATOM 568 N HIS A 35 4.109 -16.593 12.061 1.00 0.00 N ATOM 569 CA HIS A 35 3.483 -15.281 12.121 1.00 0.00 C ATOM 570 C HIS A 35 3.607 -14.569 10.775 1.00 0.00 C ATOM 571 O HIS A 35 2.615 -14.100 10.219 1.00 0.00 O ATOM 572 CB HIS A 35 4.167 -14.441 13.201 1.00 0.00 C ATOM 573 CG HIS A 35 3.516 -13.089 13.279 1.00 0.00 C ATOM 574 ND1 HIS A 35 2.228 -12.920 13.759 1.00 0.00 N ATOM 575 CD2 HIS A 35 3.963 -11.833 12.951 1.00 0.00 C ATOM 576 CE1 HIS A 35 1.944 -11.605 13.705 1.00 0.00 C ATOM 577 NE2 HIS A 35 2.967 -10.898 13.219 1.00 0.00 N ATOM 0 H HIS A 35 4.808 -16.768 12.783 1.00 0.00 H new ATOM 0 HA HIS A 35 2.427 -15.406 12.359 1.00 0.00 H new ATOM 0 HB2 HIS A 35 4.098 -14.945 14.165 1.00 0.00 H new ATOM 0 HB3 HIS A 35 5.227 -14.332 12.973 1.00 0.00 H new ATOM 0 HD2 HIS A 35 4.938 -11.605 12.547 1.00 0.00 H new ATOM 0 HE1 HIS A 35 1.004 -11.175 14.017 1.00 0.00 H new ATOM 0 HE2 HIS A 35 3.010 -9.889 13.075 1.00 0.00 H new ATOM 585 N ASN A 36 4.827 -14.498 10.253 1.00 0.00 N ATOM 586 CA ASN A 36 5.058 -13.845 8.968 1.00 0.00 C ATOM 587 C ASN A 36 4.414 -14.640 7.834 1.00 0.00 C ATOM 588 O ASN A 36 3.807 -14.071 6.926 1.00 0.00 O ATOM 589 CB ASN A 36 6.560 -13.713 8.713 1.00 0.00 C ATOM 590 CG ASN A 36 6.806 -12.994 7.390 1.00 0.00 C ATOM 591 OD1 ASN A 36 5.939 -12.982 6.516 1.00 0.00 O ATOM 592 ND2 ASN A 36 7.942 -12.384 7.194 1.00 0.00 N ATOM 0 H ASN A 36 5.664 -14.880 10.694 1.00 0.00 H new ATOM 0 HA ASN A 36 4.606 -12.854 9.001 1.00 0.00 H new ATOM 0 HB2 ASN A 36 7.028 -13.161 9.528 1.00 0.00 H new ATOM 0 HB3 ASN A 36 7.021 -14.700 8.690 1.00 0.00 H new ATOM 0 HD21 ASN A 36 8.114 -11.896 6.315 1.00 0.00 H new ATOM 0 HD22 ASN A 36 8.659 -12.395 7.920 1.00 0.00 H new ATOM 599 N SER A 37 4.554 -15.963 7.897 1.00 0.00 N ATOM 600 CA SER A 37 3.993 -16.849 6.879 1.00 0.00 C ATOM 601 C SER A 37 2.592 -17.298 7.276 1.00 0.00 C ATOM 602 O SER A 37 2.091 -18.310 6.787 1.00 0.00 O ATOM 603 CB SER A 37 4.893 -18.071 6.694 1.00 0.00 C ATOM 604 OG SER A 37 6.227 -17.638 6.460 1.00 0.00 O ATOM 0 H SER A 37 5.053 -16.446 8.644 1.00 0.00 H new ATOM 0 HA SER A 37 3.933 -16.301 5.939 1.00 0.00 H new ATOM 0 HB2 SER A 37 4.854 -18.704 7.580 1.00 0.00 H new ATOM 0 HB3 SER A 37 4.541 -18.673 5.856 1.00 0.00 H new ATOM 0 HG SER A 37 6.648 -17.400 7.312 1.00 0.00 H new ATOM 610 N ASN A 38 1.971 -16.553 8.184 1.00 0.00 N ATOM 611 CA ASN A 38 0.636 -16.902 8.653 1.00 0.00 C ATOM 612 C ASN A 38 -0.266 -17.278 7.481 1.00 0.00 C ATOM 613 O ASN A 38 -0.490 -16.481 6.571 1.00 0.00 O ATOM 614 CB ASN A 38 0.025 -15.718 9.404 1.00 0.00 C ATOM 615 CG ASN A 38 -0.086 -14.512 8.476 1.00 0.00 C ATOM 616 OD1 ASN A 38 0.501 -14.505 7.393 1.00 0.00 O ATOM 617 ND2 ASN A 38 -0.805 -13.484 8.835 1.00 0.00 N ATOM 0 H ASN A 38 2.366 -15.712 8.606 1.00 0.00 H new ATOM 0 HA ASN A 38 0.719 -17.759 9.322 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -0.961 -15.987 9.783 1.00 0.00 H new ATOM 0 HB3 ASN A 38 0.641 -15.467 10.267 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -0.881 -12.675 8.219 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -1.291 -13.490 9.732 1.00 0.00 H new ATOM 624 N ILE A 39 -0.778 -18.501 7.519 1.00 0.00 N ATOM 625 CA ILE A 39 -1.657 -18.986 6.465 1.00 0.00 C ATOM 626 C ILE A 39 -0.997 -18.817 5.104 1.00 0.00 C ATOM 627 O ILE A 39 -1.546 -18.160 4.218 1.00 0.00 O ATOM 628 CB ILE A 39 -2.980 -18.219 6.486 1.00 0.00 C ATOM 629 CG1 ILE A 39 -3.431 -18.030 7.928 1.00 0.00 C ATOM 630 CG2 ILE A 39 -4.045 -19.008 5.721 1.00 0.00 C ATOM 631 CD1 ILE A 39 -4.775 -17.303 7.955 1.00 0.00 C ATOM 0 H ILE A 39 -0.600 -19.173 8.266 1.00 0.00 H new ATOM 0 HA ILE A 39 -1.850 -20.044 6.640 1.00 0.00 H new ATOM 0 HB ILE A 39 -2.842 -17.246 6.014 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -3.520 -18.998 8.421 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -2.686 -17.458 8.481 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -4.987 -18.459 5.738 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -3.724 -19.146 4.689 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -4.184 -19.982 6.191 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -5.096 -17.169 8.988 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -4.671 -16.328 7.478 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -5.518 -17.892 7.418 1.00 0.00 H new ATOM 643 N LEU A 40 0.186 -19.408 4.942 1.00 0.00 N ATOM 644 CA LEU A 40 0.920 -19.314 3.676 1.00 0.00 C ATOM 645 C LEU A 40 0.937 -20.663 2.975 1.00 0.00 C ATOM 646 O LEU A 40 1.346 -21.665 3.553 1.00 0.00 O ATOM 647 CB LEU A 40 2.358 -18.855 3.932 1.00 0.00 C ATOM 648 CG LEU A 40 3.081 -18.615 2.596 1.00 0.00 C ATOM 649 CD1 LEU A 40 2.400 -17.476 1.810 1.00 0.00 C ATOM 650 CD2 LEU A 40 4.545 -18.253 2.878 1.00 0.00 C ATOM 0 H LEU A 40 0.656 -19.954 5.664 1.00 0.00 H new ATOM 0 HA LEU A 40 0.417 -18.586 3.040 1.00 0.00 H new ATOM 0 HB2 LEU A 40 2.356 -17.939 4.523 1.00 0.00 H new ATOM 0 HB3 LEU A 40 2.891 -19.608 4.513 1.00 0.00 H new ATOM 0 HG LEU A 40 3.034 -19.522 1.994 1.00 0.00 H new ATOM 0 HD11 LEU A 40 2.925 -17.320 0.867 1.00 0.00 H new ATOM 0 HD12 LEU A 40 1.363 -17.743 1.608 1.00 0.00 H new ATOM 0 HD13 LEU A 40 2.431 -16.559 2.398 1.00 0.00 H new ATOM 0 HD21 LEU A 40 5.065 -18.081 1.936 1.00 0.00 H new ATOM 0 HD22 LEU A 40 4.586 -17.349 3.485 1.00 0.00 H new ATOM 0 HD23 LEU A 40 5.026 -19.072 3.414 1.00 0.00 H new ATOM 662 N ASP A 41 0.500 -20.675 1.721 1.00 0.00 N ATOM 663 CA ASP A 41 0.463 -21.909 0.943 1.00 0.00 C ATOM 664 C ASP A 41 1.752 -22.697 1.111 1.00 0.00 C ATOM 665 O ASP A 41 1.732 -23.921 1.227 1.00 0.00 O ATOM 666 CB ASP A 41 0.242 -21.589 -0.539 1.00 0.00 C ATOM 667 CG ASP A 41 -1.176 -21.069 -0.759 1.00 0.00 C ATOM 668 OD1 ASP A 41 -1.999 -21.256 0.120 1.00 0.00 O ATOM 669 OD2 ASP A 41 -1.415 -20.487 -1.806 1.00 0.00 O ATOM 0 H ASP A 41 0.168 -19.849 1.223 1.00 0.00 H new ATOM 0 HA ASP A 41 -0.364 -22.517 1.310 1.00 0.00 H new ATOM 0 HB2 ASP A 41 0.966 -20.844 -0.870 1.00 0.00 H new ATOM 0 HB3 ASP A 41 0.407 -22.483 -1.140 1.00 0.00 H new ATOM 674 N GLU A 42 2.867 -21.993 1.129 1.00 0.00 N ATOM 675 CA GLU A 42 4.156 -22.642 1.293 1.00 0.00 C ATOM 676 C GLU A 42 4.298 -23.216 2.698 1.00 0.00 C ATOM 677 O GLU A 42 4.906 -24.267 2.891 1.00 0.00 O ATOM 678 CB GLU A 42 5.263 -21.630 1.045 1.00 0.00 C ATOM 679 CG GLU A 42 5.264 -21.207 -0.426 1.00 0.00 C ATOM 680 CD GLU A 42 5.643 -22.389 -1.313 1.00 0.00 C ATOM 681 OE1 GLU A 42 6.248 -23.317 -0.802 1.00 0.00 O ATOM 682 OE2 GLU A 42 5.322 -22.349 -2.489 1.00 0.00 O ATOM 0 H GLU A 42 2.908 -20.978 1.033 1.00 0.00 H new ATOM 0 HA GLU A 42 4.229 -23.460 0.576 1.00 0.00 H new ATOM 0 HB2 GLU A 42 5.120 -20.758 1.683 1.00 0.00 H new ATOM 0 HB3 GLU A 42 6.228 -22.062 1.309 1.00 0.00 H new ATOM 0 HG2 GLU A 42 4.279 -20.834 -0.706 1.00 0.00 H new ATOM 0 HG3 GLU A 42 5.969 -20.389 -0.576 1.00 0.00 H new ATOM 689 N ARG A 43 3.742 -22.512 3.681 1.00 0.00 N ATOM 690 CA ARG A 43 3.820 -22.958 5.072 1.00 0.00 C ATOM 691 C ARG A 43 2.655 -23.876 5.417 1.00 0.00 C ATOM 692 O ARG A 43 2.714 -24.627 6.387 1.00 0.00 O ATOM 693 CB ARG A 43 3.818 -21.745 6.010 1.00 0.00 C ATOM 694 CG ARG A 43 4.346 -22.144 7.399 1.00 0.00 C ATOM 695 CD ARG A 43 5.880 -22.131 7.410 1.00 0.00 C ATOM 696 NE ARG A 43 6.373 -20.857 6.895 1.00 0.00 N ATOM 697 CZ ARG A 43 7.553 -20.761 6.298 1.00 0.00 C ATOM 698 NH1 ARG A 43 8.306 -21.817 6.164 1.00 0.00 N ATOM 699 NH2 ARG A 43 7.959 -19.608 5.839 1.00 0.00 N ATOM 0 H ARG A 43 3.236 -21.637 3.543 1.00 0.00 H new ATOM 0 HA ARG A 43 4.748 -23.516 5.199 1.00 0.00 H new ATOM 0 HB2 ARG A 43 4.438 -20.952 5.592 1.00 0.00 H new ATOM 0 HB3 ARG A 43 2.807 -21.346 6.098 1.00 0.00 H new ATOM 0 HG2 ARG A 43 3.964 -21.455 8.152 1.00 0.00 H new ATOM 0 HG3 ARG A 43 3.982 -23.137 7.662 1.00 0.00 H new ATOM 0 HD2 ARG A 43 6.246 -22.288 8.425 1.00 0.00 H new ATOM 0 HD3 ARG A 43 6.263 -22.951 6.802 1.00 0.00 H new ATOM 0 HE ARG A 43 5.797 -20.022 6.997 1.00 0.00 H new ATOM 0 HH11 ARG A 43 7.988 -22.719 6.519 1.00 0.00 H new ATOM 0 HH12 ARG A 43 9.213 -21.741 5.704 1.00 0.00 H new ATOM 0 HH21 ARG A 43 7.369 -18.782 5.940 1.00 0.00 H new ATOM 0 HH22 ARG A 43 8.867 -19.533 5.380 1.00 0.00 H new ATOM 713 N GLN A 44 1.596 -23.819 4.620 1.00 0.00 N ATOM 714 CA GLN A 44 0.433 -24.659 4.870 1.00 0.00 C ATOM 715 C GLN A 44 0.860 -26.101 5.132 1.00 0.00 C ATOM 716 O GLN A 44 0.280 -26.786 5.977 1.00 0.00 O ATOM 717 CB GLN A 44 -0.528 -24.606 3.669 1.00 0.00 C ATOM 718 CG GLN A 44 -1.421 -23.362 3.755 1.00 0.00 C ATOM 719 CD GLN A 44 -2.426 -23.367 2.607 1.00 0.00 C ATOM 720 OE1 GLN A 44 -2.466 -24.310 1.817 1.00 0.00 O ATOM 721 NE2 GLN A 44 -3.244 -22.362 2.472 1.00 0.00 N ATOM 0 H GLN A 44 1.518 -23.209 3.806 1.00 0.00 H new ATOM 0 HA GLN A 44 -0.081 -24.281 5.754 1.00 0.00 H new ATOM 0 HB2 GLN A 44 0.041 -24.589 2.740 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -1.145 -25.504 3.649 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -1.946 -23.345 4.710 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -0.810 -22.461 3.711 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -3.207 -21.583 3.129 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -3.921 -22.355 1.709 1.00 0.00 H new ATOM 730 N GLY A 45 1.877 -26.557 4.413 1.00 0.00 N ATOM 731 CA GLY A 45 2.359 -27.913 4.593 1.00 0.00 C ATOM 732 C GLY A 45 3.017 -28.066 5.951 1.00 0.00 C ATOM 733 O GLY A 45 2.738 -29.014 6.685 1.00 0.00 O ATOM 0 H GLY A 45 2.376 -26.013 3.709 1.00 0.00 H new ATOM 0 HA2 GLY A 45 1.530 -28.615 4.503 1.00 0.00 H new ATOM 0 HA3 GLY A 45 3.072 -28.159 3.807 1.00 0.00 H new ATOM 737 N LEU A 46 3.898 -27.128 6.276 1.00 0.00 N ATOM 738 CA LEU A 46 4.598 -27.174 7.548 1.00 0.00 C ATOM 739 C LEU A 46 3.603 -27.010 8.695 1.00 0.00 C ATOM 740 O LEU A 46 3.686 -27.685 9.718 1.00 0.00 O ATOM 741 CB LEU A 46 5.669 -26.066 7.609 1.00 0.00 C ATOM 742 CG LEU A 46 6.813 -26.482 8.556 1.00 0.00 C ATOM 743 CD1 LEU A 46 7.899 -25.400 8.552 1.00 0.00 C ATOM 744 CD2 LEU A 46 6.284 -26.683 9.989 1.00 0.00 C ATOM 0 H LEU A 46 4.141 -26.335 5.682 1.00 0.00 H new ATOM 0 HA LEU A 46 5.093 -28.141 7.644 1.00 0.00 H new ATOM 0 HB2 LEU A 46 6.064 -25.877 6.611 1.00 0.00 H new ATOM 0 HB3 LEU A 46 5.220 -25.135 7.956 1.00 0.00 H new ATOM 0 HG LEU A 46 7.233 -27.425 8.206 1.00 0.00 H new ATOM 0 HD11 LEU A 46 8.708 -25.694 9.221 1.00 0.00 H new ATOM 0 HD12 LEU A 46 8.290 -25.280 7.541 1.00 0.00 H new ATOM 0 HD13 LEU A 46 7.473 -24.456 8.890 1.00 0.00 H new ATOM 0 HD21 LEU A 46 7.106 -26.976 10.642 1.00 0.00 H new ATOM 0 HD22 LEU A 46 5.848 -25.751 10.350 1.00 0.00 H new ATOM 0 HD23 LEU A 46 5.523 -27.464 9.990 1.00 0.00 H new ATOM 756 N MET A 47 2.659 -26.096 8.515 1.00 0.00 N ATOM 757 CA MET A 47 1.663 -25.828 9.542 1.00 0.00 C ATOM 758 C MET A 47 1.121 -27.129 10.123 1.00 0.00 C ATOM 759 O MET A 47 0.983 -27.267 11.339 1.00 0.00 O ATOM 760 CB MET A 47 0.510 -25.014 8.944 1.00 0.00 C ATOM 761 CG MET A 47 -0.303 -24.377 10.069 1.00 0.00 C ATOM 762 SD MET A 47 0.570 -22.905 10.666 1.00 0.00 S ATOM 763 CE MET A 47 -0.265 -21.695 9.612 1.00 0.00 C ATOM 0 H MET A 47 2.562 -25.530 7.672 1.00 0.00 H new ATOM 0 HA MET A 47 2.137 -25.261 10.343 1.00 0.00 H new ATOM 0 HB2 MET A 47 0.901 -24.242 8.282 1.00 0.00 H new ATOM 0 HB3 MET A 47 -0.129 -25.658 8.340 1.00 0.00 H new ATOM 0 HG2 MET A 47 -1.296 -24.106 9.710 1.00 0.00 H new ATOM 0 HG3 MET A 47 -0.442 -25.089 10.883 1.00 0.00 H new ATOM 0 HE1 MET A 47 0.128 -20.700 9.819 1.00 0.00 H new ATOM 0 HE2 MET A 47 -0.091 -21.943 8.565 1.00 0.00 H new ATOM 0 HE3 MET A 47 -1.336 -21.712 9.816 1.00 0.00 H new ATOM 773 N HIS A 48 0.820 -28.081 9.249 1.00 0.00 N ATOM 774 CA HIS A 48 0.299 -29.368 9.689 1.00 0.00 C ATOM 775 C HIS A 48 1.345 -30.120 10.507 1.00 0.00 C ATOM 776 O HIS A 48 1.046 -30.655 11.574 1.00 0.00 O ATOM 777 CB HIS A 48 -0.103 -30.208 8.476 1.00 0.00 C ATOM 778 CG HIS A 48 -0.676 -31.517 8.943 1.00 0.00 C ATOM 779 ND1 HIS A 48 0.125 -32.590 9.297 1.00 0.00 N ATOM 780 CD2 HIS A 48 -1.970 -31.941 9.117 1.00 0.00 C ATOM 781 CE1 HIS A 48 -0.686 -33.598 9.665 1.00 0.00 C ATOM 782 NE2 HIS A 48 -1.974 -33.255 9.574 1.00 0.00 N ATOM 0 H HIS A 48 0.927 -27.987 8.239 1.00 0.00 H new ATOM 0 HA HIS A 48 -0.575 -29.190 10.316 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -0.837 -29.671 7.875 1.00 0.00 H new ATOM 0 HB3 HIS A 48 0.763 -30.384 7.839 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -2.851 -31.345 8.928 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -0.338 -34.566 9.994 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -2.786 -33.832 9.793 1.00 0.00 H new ATOM 790 N GLU A 49 2.573 -30.152 10.000 1.00 0.00 N ATOM 791 CA GLU A 49 3.657 -30.837 10.695 1.00 0.00 C ATOM 792 C GLU A 49 4.056 -30.066 11.945 1.00 0.00 C ATOM 793 O GLU A 49 4.629 -30.624 12.876 1.00 0.00 O ATOM 794 CB GLU A 49 4.868 -30.982 9.773 1.00 0.00 C ATOM 795 CG GLU A 49 4.524 -31.942 8.633 1.00 0.00 C ATOM 796 CD GLU A 49 5.708 -32.062 7.678 1.00 0.00 C ATOM 797 OE1 GLU A 49 6.719 -31.431 7.938 1.00 0.00 O ATOM 798 OE2 GLU A 49 5.587 -32.788 6.705 1.00 0.00 O ATOM 0 H GLU A 49 2.841 -29.716 9.118 1.00 0.00 H new ATOM 0 HA GLU A 49 3.307 -31.828 10.985 1.00 0.00 H new ATOM 0 HB2 GLU A 49 5.152 -30.009 9.371 1.00 0.00 H new ATOM 0 HB3 GLU A 49 5.724 -31.357 10.334 1.00 0.00 H new ATOM 0 HG2 GLU A 49 4.270 -32.922 9.036 1.00 0.00 H new ATOM 0 HG3 GLU A 49 3.647 -31.582 8.095 1.00 0.00 H new ATOM 805 N LEU A 50 3.750 -28.777 11.953 1.00 0.00 N ATOM 806 CA LEU A 50 4.089 -27.931 13.089 1.00 0.00 C ATOM 807 C LEU A 50 3.427 -28.452 14.358 1.00 0.00 C ATOM 808 O LEU A 50 4.028 -28.454 15.431 1.00 0.00 O ATOM 809 CB LEU A 50 3.630 -26.492 12.823 1.00 0.00 C ATOM 810 CG LEU A 50 4.401 -25.513 13.730 1.00 0.00 C ATOM 811 CD1 LEU A 50 5.745 -25.137 13.091 1.00 0.00 C ATOM 812 CD2 LEU A 50 3.576 -24.239 13.938 1.00 0.00 C ATOM 0 H LEU A 50 3.271 -28.296 11.192 1.00 0.00 H new ATOM 0 HA LEU A 50 5.171 -27.948 13.224 1.00 0.00 H new ATOM 0 HB2 LEU A 50 3.796 -26.237 11.776 1.00 0.00 H new ATOM 0 HB3 LEU A 50 2.559 -26.404 13.007 1.00 0.00 H new ATOM 0 HG LEU A 50 4.581 -26.000 14.688 1.00 0.00 H new ATOM 0 HD11 LEU A 50 6.277 -24.445 13.744 1.00 0.00 H new ATOM 0 HD12 LEU A 50 6.345 -26.036 12.949 1.00 0.00 H new ATOM 0 HD13 LEU A 50 5.569 -24.662 12.126 1.00 0.00 H new ATOM 0 HD21 LEU A 50 4.126 -23.550 14.580 1.00 0.00 H new ATOM 0 HD22 LEU A 50 3.389 -23.766 12.974 1.00 0.00 H new ATOM 0 HD23 LEU A 50 2.626 -24.493 14.408 1.00 0.00 H new ATOM 824 N MET A 51 2.183 -28.891 14.226 1.00 0.00 N ATOM 825 CA MET A 51 1.442 -29.411 15.365 1.00 0.00 C ATOM 826 C MET A 51 2.128 -30.656 15.916 1.00 0.00 C ATOM 827 O MET A 51 2.164 -30.871 17.128 1.00 0.00 O ATOM 828 CB MET A 51 0.016 -29.756 14.937 1.00 0.00 C ATOM 829 CG MET A 51 -0.727 -28.473 14.565 1.00 0.00 C ATOM 830 SD MET A 51 -2.338 -28.891 13.845 1.00 0.00 S ATOM 831 CE MET A 51 -3.126 -29.514 15.351 1.00 0.00 C ATOM 0 H MET A 51 1.668 -28.897 13.345 1.00 0.00 H new ATOM 0 HA MET A 51 1.413 -28.650 16.145 1.00 0.00 H new ATOM 0 HB2 MET A 51 0.035 -30.438 14.087 1.00 0.00 H new ATOM 0 HB3 MET A 51 -0.504 -30.269 15.746 1.00 0.00 H new ATOM 0 HG2 MET A 51 -0.863 -27.850 15.449 1.00 0.00 H new ATOM 0 HG3 MET A 51 -0.139 -27.893 13.854 1.00 0.00 H new ATOM 0 HE1 MET A 51 -4.209 -29.495 15.230 1.00 0.00 H new ATOM 0 HE2 MET A 51 -2.800 -30.537 15.536 1.00 0.00 H new ATOM 0 HE3 MET A 51 -2.844 -28.885 16.196 1.00 0.00 H new ATOM 841 N GLU A 52 2.670 -31.476 15.019 1.00 0.00 N ATOM 842 CA GLU A 52 3.352 -32.699 15.433 1.00 0.00 C ATOM 843 C GLU A 52 4.583 -32.376 16.274 1.00 0.00 C ATOM 844 O GLU A 52 4.770 -32.932 17.355 1.00 0.00 O ATOM 845 CB GLU A 52 3.778 -33.499 14.200 1.00 0.00 C ATOM 846 CG GLU A 52 2.537 -34.024 13.477 1.00 0.00 C ATOM 847 CD GLU A 52 2.945 -34.743 12.195 1.00 0.00 C ATOM 848 OE1 GLU A 52 4.134 -34.802 11.925 1.00 0.00 O ATOM 849 OE2 GLU A 52 2.065 -35.225 11.504 1.00 0.00 O ATOM 0 H GLU A 52 2.651 -31.319 14.011 1.00 0.00 H new ATOM 0 HA GLU A 52 2.660 -33.288 16.035 1.00 0.00 H new ATOM 0 HB2 GLU A 52 4.363 -32.869 13.530 1.00 0.00 H new ATOM 0 HB3 GLU A 52 4.418 -34.330 14.496 1.00 0.00 H new ATOM 0 HG2 GLU A 52 1.988 -34.706 14.127 1.00 0.00 H new ATOM 0 HG3 GLU A 52 1.866 -33.198 13.242 1.00 0.00 H new ATOM 856 N LEU A 53 5.416 -31.469 15.775 1.00 0.00 N ATOM 857 CA LEU A 53 6.625 -31.079 16.493 1.00 0.00 C ATOM 858 C LEU A 53 6.263 -30.429 17.824 1.00 0.00 C ATOM 859 O LEU A 53 6.912 -30.674 18.841 1.00 0.00 O ATOM 860 CB LEU A 53 7.453 -30.105 15.635 1.00 0.00 C ATOM 861 CG LEU A 53 8.387 -30.887 14.704 1.00 0.00 C ATOM 862 CD1 LEU A 53 7.567 -31.778 13.772 1.00 0.00 C ATOM 863 CD2 LEU A 53 9.211 -29.902 13.871 1.00 0.00 C ATOM 0 H LEU A 53 5.278 -30.993 14.883 1.00 0.00 H new ATOM 0 HA LEU A 53 7.220 -31.971 16.692 1.00 0.00 H new ATOM 0 HB2 LEU A 53 6.789 -29.471 15.048 1.00 0.00 H new ATOM 0 HB3 LEU A 53 8.036 -29.446 16.279 1.00 0.00 H new ATOM 0 HG LEU A 53 9.051 -31.511 15.302 1.00 0.00 H new ATOM 0 HD11 LEU A 53 8.237 -32.330 13.114 1.00 0.00 H new ATOM 0 HD12 LEU A 53 6.980 -32.480 14.364 1.00 0.00 H new ATOM 0 HD13 LEU A 53 6.898 -31.160 13.173 1.00 0.00 H new ATOM 0 HD21 LEU A 53 9.877 -30.454 13.208 1.00 0.00 H new ATOM 0 HD22 LEU A 53 8.542 -29.279 13.277 1.00 0.00 H new ATOM 0 HD23 LEU A 53 9.802 -29.270 14.534 1.00 0.00 H new ATOM 875 N ILE A 54 5.230 -29.602 17.813 1.00 0.00 N ATOM 876 CA ILE A 54 4.811 -28.928 19.032 1.00 0.00 C ATOM 877 C ILE A 54 4.355 -29.942 20.074 1.00 0.00 C ATOM 878 O ILE A 54 4.692 -29.829 21.252 1.00 0.00 O ATOM 879 CB ILE A 54 3.675 -27.950 18.725 1.00 0.00 C ATOM 880 CG1 ILE A 54 4.222 -26.769 17.894 1.00 0.00 C ATOM 881 CG2 ILE A 54 3.055 -27.431 20.035 1.00 0.00 C ATOM 882 CD1 ILE A 54 4.816 -25.679 18.803 1.00 0.00 C ATOM 0 H ILE A 54 4.673 -29.383 16.987 1.00 0.00 H new ATOM 0 HA ILE A 54 5.661 -28.376 19.432 1.00 0.00 H new ATOM 0 HB ILE A 54 2.903 -28.465 18.154 1.00 0.00 H new ATOM 0 HG12 ILE A 54 4.986 -27.128 17.205 1.00 0.00 H new ATOM 0 HG13 ILE A 54 3.421 -26.345 17.288 1.00 0.00 H new ATOM 0 HG21 ILE A 54 2.248 -26.736 19.805 1.00 0.00 H new ATOM 0 HG22 ILE A 54 2.659 -28.270 20.608 1.00 0.00 H new ATOM 0 HG23 ILE A 54 3.818 -26.919 20.621 1.00 0.00 H new ATOM 0 HD11 ILE A 54 5.193 -24.860 18.190 1.00 0.00 H new ATOM 0 HD12 ILE A 54 4.043 -25.304 19.474 1.00 0.00 H new ATOM 0 HD13 ILE A 54 5.633 -26.100 19.389 1.00 0.00 H new ATOM 894 N ASP A 55 3.583 -30.927 19.635 1.00 0.00 N ATOM 895 CA ASP A 55 3.086 -31.944 20.540 1.00 0.00 C ATOM 896 C ASP A 55 4.221 -32.831 21.021 1.00 0.00 C ATOM 897 O ASP A 55 4.305 -33.158 22.202 1.00 0.00 O ATOM 898 CB ASP A 55 2.028 -32.793 19.834 1.00 0.00 C ATOM 899 CG ASP A 55 1.483 -33.847 20.789 1.00 0.00 C ATOM 900 OD1 ASP A 55 2.014 -33.960 21.882 1.00 0.00 O ATOM 901 OD2 ASP A 55 0.541 -34.528 20.415 1.00 0.00 O ATOM 0 H ASP A 55 3.291 -31.040 18.664 1.00 0.00 H new ATOM 0 HA ASP A 55 2.639 -31.453 21.404 1.00 0.00 H new ATOM 0 HB2 ASP A 55 1.217 -32.157 19.480 1.00 0.00 H new ATOM 0 HB3 ASP A 55 2.462 -33.274 18.957 1.00 0.00 H new ATOM 906 N LEU A 56 5.092 -33.218 20.096 1.00 0.00 N ATOM 907 CA LEU A 56 6.215 -34.078 20.441 1.00 0.00 C ATOM 908 C LEU A 56 7.150 -33.385 21.424 1.00 0.00 C ATOM 909 O LEU A 56 7.595 -33.985 22.401 1.00 0.00 O ATOM 910 CB LEU A 56 6.987 -34.454 19.172 1.00 0.00 C ATOM 911 CG LEU A 56 6.150 -35.422 18.317 1.00 0.00 C ATOM 912 CD1 LEU A 56 6.736 -35.483 16.903 1.00 0.00 C ATOM 913 CD2 LEU A 56 6.154 -36.836 18.931 1.00 0.00 C ATOM 0 H LEU A 56 5.043 -32.953 19.112 1.00 0.00 H new ATOM 0 HA LEU A 56 5.825 -34.979 20.914 1.00 0.00 H new ATOM 0 HB2 LEU A 56 7.220 -33.557 18.598 1.00 0.00 H new ATOM 0 HB3 LEU A 56 7.937 -34.918 19.438 1.00 0.00 H new ATOM 0 HG LEU A 56 5.123 -35.059 18.283 1.00 0.00 H new ATOM 0 HD11 LEU A 56 6.146 -36.168 16.294 1.00 0.00 H new ATOM 0 HD12 LEU A 56 6.713 -34.489 16.457 1.00 0.00 H new ATOM 0 HD13 LEU A 56 7.766 -35.836 16.951 1.00 0.00 H new ATOM 0 HD21 LEU A 56 5.556 -37.504 18.311 1.00 0.00 H new ATOM 0 HD22 LEU A 56 7.177 -37.207 18.982 1.00 0.00 H new ATOM 0 HD23 LEU A 56 5.731 -36.798 19.935 1.00 0.00 H new ATOM 925 N TYR A 57 7.441 -32.119 21.160 1.00 0.00 N ATOM 926 CA TYR A 57 8.321 -31.353 22.032 1.00 0.00 C ATOM 927 C TYR A 57 7.678 -31.162 23.403 1.00 0.00 C ATOM 928 O TYR A 57 8.322 -31.346 24.434 1.00 0.00 O ATOM 929 CB TYR A 57 8.622 -29.988 21.390 1.00 0.00 C ATOM 930 CG TYR A 57 9.796 -30.109 20.438 1.00 0.00 C ATOM 931 CD1 TYR A 57 9.788 -31.089 19.437 1.00 0.00 C ATOM 932 CD2 TYR A 57 10.892 -29.246 20.564 1.00 0.00 C ATOM 933 CE1 TYR A 57 10.875 -31.205 18.565 1.00 0.00 C ATOM 934 CE2 TYR A 57 11.978 -29.363 19.691 1.00 0.00 C ATOM 935 CZ TYR A 57 11.970 -30.343 18.693 1.00 0.00 C ATOM 936 OH TYR A 57 13.041 -30.459 17.832 1.00 0.00 O ATOM 0 H TYR A 57 7.084 -31.603 20.356 1.00 0.00 H new ATOM 0 HA TYR A 57 9.254 -31.900 22.164 1.00 0.00 H new ATOM 0 HB2 TYR A 57 7.744 -29.628 20.854 1.00 0.00 H new ATOM 0 HB3 TYR A 57 8.846 -29.254 22.164 1.00 0.00 H new ATOM 0 HD1 TYR A 57 8.943 -31.754 19.339 1.00 0.00 H new ATOM 0 HD2 TYR A 57 10.898 -28.490 21.335 1.00 0.00 H new ATOM 0 HE1 TYR A 57 10.869 -31.960 17.793 1.00 0.00 H new ATOM 0 HE2 TYR A 57 12.823 -28.697 19.787 1.00 0.00 H new ATOM 0 HH TYR A 57 13.716 -29.785 18.056 1.00 0.00 H new ATOM 946 N GLU A 58 6.403 -30.794 23.397 1.00 0.00 N ATOM 947 CA GLU A 58 5.676 -30.581 24.639 1.00 0.00 C ATOM 948 C GLU A 58 5.382 -31.904 25.316 1.00 0.00 C ATOM 949 O GLU A 58 5.161 -31.961 26.513 1.00 0.00 O ATOM 950 CB GLU A 58 4.371 -29.838 24.370 1.00 0.00 C ATOM 951 CG GLU A 58 4.676 -28.416 23.892 1.00 0.00 C ATOM 952 CD GLU A 58 5.317 -27.609 25.017 1.00 0.00 C ATOM 953 OE1 GLU A 58 5.146 -27.990 26.164 1.00 0.00 O ATOM 954 OE2 GLU A 58 5.972 -26.625 24.716 1.00 0.00 O ATOM 0 H GLU A 58 5.855 -30.638 22.551 1.00 0.00 H new ATOM 0 HA GLU A 58 6.299 -29.978 25.300 1.00 0.00 H new ATOM 0 HB2 GLU A 58 3.788 -30.368 23.617 1.00 0.00 H new ATOM 0 HB3 GLU A 58 3.766 -29.806 25.276 1.00 0.00 H new ATOM 0 HG2 GLU A 58 5.344 -28.449 23.032 1.00 0.00 H new ATOM 0 HG3 GLU A 58 3.757 -27.930 23.563 1.00 0.00 H new ATOM 961 N GLU A 59 5.362 -32.972 24.538 1.00 0.00 N ATOM 962 CA GLU A 59 5.094 -34.296 25.081 1.00 0.00 C ATOM 963 C GLU A 59 6.387 -34.950 25.563 1.00 0.00 C ATOM 964 O GLU A 59 6.359 -35.966 26.259 1.00 0.00 O ATOM 965 CB GLU A 59 4.430 -35.179 24.021 1.00 0.00 C ATOM 966 CG GLU A 59 4.285 -36.624 24.539 1.00 0.00 C ATOM 967 CD GLU A 59 5.560 -37.432 24.280 1.00 0.00 C ATOM 968 OE1 GLU A 59 6.465 -36.905 23.655 1.00 0.00 O ATOM 969 OE2 GLU A 59 5.610 -38.571 24.716 1.00 0.00 O ATOM 0 H GLU A 59 5.527 -32.951 23.532 1.00 0.00 H new ATOM 0 HA GLU A 59 4.418 -34.188 25.929 1.00 0.00 H new ATOM 0 HB2 GLU A 59 3.449 -34.777 23.766 1.00 0.00 H new ATOM 0 HB3 GLU A 59 5.025 -35.171 23.108 1.00 0.00 H new ATOM 0 HG2 GLU A 59 4.070 -36.611 25.607 1.00 0.00 H new ATOM 0 HG3 GLU A 59 3.439 -37.106 24.049 1.00 0.00 H new ATOM 976 N SER A 60 7.524 -34.392 25.162 1.00 0.00 N ATOM 977 CA SER A 60 8.809 -34.984 25.530 1.00 0.00 C ATOM 978 C SER A 60 8.900 -35.256 27.029 1.00 0.00 C ATOM 979 O SER A 60 9.033 -36.408 27.453 1.00 0.00 O ATOM 980 CB SER A 60 9.927 -34.014 25.150 1.00 0.00 C ATOM 981 OG SER A 60 11.127 -34.395 25.813 1.00 0.00 O ATOM 0 H SER A 60 7.586 -33.547 24.593 1.00 0.00 H new ATOM 0 HA SER A 60 8.906 -35.932 25.000 1.00 0.00 H new ATOM 0 HB2 SER A 60 10.077 -34.019 24.070 1.00 0.00 H new ATOM 0 HB3 SER A 60 9.652 -32.997 25.428 1.00 0.00 H new ATOM 0 HG SER A 60 11.846 -33.775 25.570 1.00 0.00 H new ATOM 987 N GLN A 61 8.813 -34.194 27.835 1.00 0.00 N ATOM 988 CA GLN A 61 8.874 -34.318 29.303 1.00 0.00 C ATOM 989 C GLN A 61 7.549 -33.962 29.948 1.00 0.00 C ATOM 990 O GLN A 61 7.102 -34.623 30.886 1.00 0.00 O ATOM 991 CB GLN A 61 10.001 -33.443 29.887 1.00 0.00 C ATOM 992 CG GLN A 61 11.058 -33.199 28.812 1.00 0.00 C ATOM 993 CD GLN A 61 12.315 -32.642 29.454 1.00 0.00 C ATOM 994 OE1 GLN A 61 13.298 -33.362 29.620 1.00 0.00 O ATOM 995 NE2 GLN A 61 12.337 -31.398 29.835 1.00 0.00 N ATOM 0 H GLN A 61 8.700 -33.237 27.501 1.00 0.00 H new ATOM 0 HA GLN A 61 9.091 -35.362 29.528 1.00 0.00 H new ATOM 0 HB2 GLN A 61 9.596 -32.494 30.237 1.00 0.00 H new ATOM 0 HB3 GLN A 61 10.450 -33.936 30.750 1.00 0.00 H new ATOM 0 HG2 GLN A 61 11.284 -34.130 28.292 1.00 0.00 H new ATOM 0 HG3 GLN A 61 10.678 -32.501 28.066 1.00 0.00 H new ATOM 0 HE21 GLN A 61 11.518 -30.807 29.694 1.00 0.00 H new ATOM 0 HE22 GLN A 61 13.173 -31.014 30.275 1.00 0.00 H new ATOM 1004 N PRO A 62 6.906 -32.935 29.468 1.00 0.00 N ATOM 1005 CA PRO A 62 5.608 -32.480 30.021 1.00 0.00 C ATOM 1006 C PRO A 62 4.429 -32.983 29.199 1.00 0.00 C ATOM 1007 O PRO A 62 3.875 -32.269 28.382 1.00 0.00 O ATOM 1008 CB PRO A 62 5.727 -30.948 29.883 1.00 0.00 C ATOM 1009 CG PRO A 62 6.661 -30.698 28.714 1.00 0.00 C ATOM 1010 CD PRO A 62 7.371 -32.039 28.400 1.00 0.00 C ATOM 0 HA PRO A 62 5.428 -32.840 31.034 1.00 0.00 H new ATOM 0 HB2 PRO A 62 4.751 -30.497 29.705 1.00 0.00 H new ATOM 0 HB3 PRO A 62 6.121 -30.504 30.797 1.00 0.00 H new ATOM 0 HG2 PRO A 62 6.105 -30.345 27.846 1.00 0.00 H new ATOM 0 HG3 PRO A 62 7.389 -29.926 28.962 1.00 0.00 H new ATOM 0 HD2 PRO A 62 7.099 -32.415 27.414 1.00 0.00 H new ATOM 0 HD3 PRO A 62 8.456 -31.931 28.411 1.00 0.00 H new ATOM 1018 N SER A 63 4.059 -34.236 29.462 1.00 0.00 N ATOM 1019 CA SER A 63 2.941 -34.856 28.769 1.00 0.00 C ATOM 1020 C SER A 63 1.612 -34.288 29.250 1.00 0.00 C ATOM 1021 O SER A 63 0.731 -33.977 28.451 1.00 0.00 O ATOM 1022 CB SER A 63 2.967 -36.366 29.012 1.00 0.00 C ATOM 1023 OG SER A 63 2.199 -37.013 28.009 1.00 0.00 O ATOM 0 H SER A 63 4.518 -34.836 30.148 1.00 0.00 H new ATOM 0 HA SER A 63 3.038 -34.646 27.704 1.00 0.00 H new ATOM 0 HB2 SER A 63 3.994 -36.732 28.993 1.00 0.00 H new ATOM 0 HB3 SER A 63 2.565 -36.595 29.999 1.00 0.00 H new ATOM 0 HG SER A 63 2.214 -37.981 28.159 1.00 0.00 H new ATOM 1029 N SER A 64 1.471 -34.155 30.571 1.00 0.00 N ATOM 1030 CA SER A 64 0.241 -33.621 31.165 1.00 0.00 C ATOM 1031 C SER A 64 0.535 -32.364 31.978 1.00 0.00 C ATOM 1032 O SER A 64 -0.377 -31.737 32.519 1.00 0.00 O ATOM 1033 CB SER A 64 -0.397 -34.679 32.064 1.00 0.00 C ATOM 1034 OG SER A 64 0.397 -34.844 33.230 1.00 0.00 O ATOM 0 H SER A 64 2.190 -34.408 31.248 1.00 0.00 H new ATOM 0 HA SER A 64 -0.448 -33.360 30.361 1.00 0.00 H new ATOM 0 HB2 SER A 64 -1.408 -34.378 32.338 1.00 0.00 H new ATOM 0 HB3 SER A 64 -0.480 -35.625 31.529 1.00 0.00 H new ATOM 0 HG SER A 64 -0.010 -35.521 33.810 1.00 0.00 H new ATOM 1040 N GLU A 65 1.809 -32.009 32.073 1.00 0.00 N ATOM 1041 CA GLU A 65 2.206 -30.832 32.837 1.00 0.00 C ATOM 1042 C GLU A 65 1.668 -29.557 32.192 1.00 0.00 C ATOM 1043 O GLU A 65 0.478 -29.257 32.282 1.00 0.00 O ATOM 1044 CB GLU A 65 3.731 -30.760 32.924 1.00 0.00 C ATOM 1045 CG GLU A 65 4.257 -31.913 33.780 1.00 0.00 C ATOM 1046 CD GLU A 65 5.782 -31.899 33.789 1.00 0.00 C ATOM 1047 OE1 GLU A 65 6.351 -31.019 33.165 1.00 0.00 O ATOM 1048 OE2 GLU A 65 6.359 -32.768 34.421 1.00 0.00 O ATOM 0 H GLU A 65 2.580 -32.513 31.635 1.00 0.00 H new ATOM 0 HA GLU A 65 1.786 -30.917 33.839 1.00 0.00 H new ATOM 0 HB2 GLU A 65 4.164 -30.810 31.925 1.00 0.00 H new ATOM 0 HB3 GLU A 65 4.035 -29.806 33.356 1.00 0.00 H new ATOM 0 HG2 GLU A 65 3.878 -31.824 34.798 1.00 0.00 H new ATOM 0 HG3 GLU A 65 3.896 -32.863 33.387 1.00 0.00 H new ATOM 1055 N ARG A 66 2.557 -28.809 31.549 1.00 0.00 N ATOM 1056 CA ARG A 66 2.175 -27.563 30.896 1.00 0.00 C ATOM 1057 C ARG A 66 1.472 -27.836 29.578 1.00 0.00 C ATOM 1058 O ARG A 66 0.836 -26.950 29.008 1.00 0.00 O ATOM 1059 CB ARG A 66 3.412 -26.703 30.650 1.00 0.00 C ATOM 1060 CG ARG A 66 3.934 -26.179 31.987 1.00 0.00 C ATOM 1061 CD ARG A 66 5.198 -25.352 31.752 1.00 0.00 C ATOM 1062 NE ARG A 66 5.694 -24.819 33.019 1.00 0.00 N ATOM 1063 CZ ARG A 66 6.513 -25.525 33.794 1.00 0.00 C ATOM 1064 NH1 ARG A 66 6.867 -26.731 33.439 1.00 0.00 N ATOM 1065 NH2 ARG A 66 6.955 -25.017 34.911 1.00 0.00 N ATOM 0 H ARG A 66 3.546 -29.043 31.466 1.00 0.00 H new ATOM 0 HA ARG A 66 1.487 -27.031 31.552 1.00 0.00 H new ATOM 0 HB2 ARG A 66 4.183 -27.289 30.149 1.00 0.00 H new ATOM 0 HB3 ARG A 66 3.166 -25.871 29.991 1.00 0.00 H new ATOM 0 HG2 ARG A 66 3.173 -25.569 32.473 1.00 0.00 H new ATOM 0 HG3 ARG A 66 4.150 -27.011 32.656 1.00 0.00 H new ATOM 0 HD2 ARG A 66 5.964 -25.970 31.284 1.00 0.00 H new ATOM 0 HD3 ARG A 66 4.984 -24.534 31.064 1.00 0.00 H new ATOM 0 HE ARG A 66 5.406 -23.886 33.315 1.00 0.00 H new ATOM 0 HH11 ARG A 66 6.516 -27.130 32.569 1.00 0.00 H new ATOM 0 HH12 ARG A 66 7.495 -27.274 34.032 1.00 0.00 H new ATOM 0 HH21 ARG A 66 6.673 -24.078 35.191 1.00 0.00 H new ATOM 0 HH22 ARG A 66 7.583 -25.559 35.505 1.00 0.00 H new ATOM 1079 N LEU A 67 1.593 -29.062 29.086 1.00 0.00 N ATOM 1080 CA LEU A 67 0.964 -29.420 27.822 1.00 0.00 C ATOM 1081 C LEU A 67 -0.462 -28.898 27.765 1.00 0.00 C ATOM 1082 O LEU A 67 -0.959 -28.544 26.697 1.00 0.00 O ATOM 1083 CB LEU A 67 0.958 -30.938 27.648 1.00 0.00 C ATOM 1084 CG LEU A 67 0.214 -31.326 26.338 1.00 0.00 C ATOM 1085 CD1 LEU A 67 0.985 -32.427 25.597 1.00 0.00 C ATOM 1086 CD2 LEU A 67 -1.198 -31.839 26.664 1.00 0.00 C ATOM 0 H LEU A 67 2.113 -29.816 29.535 1.00 0.00 H new ATOM 0 HA LEU A 67 1.539 -28.965 27.015 1.00 0.00 H new ATOM 0 HB2 LEU A 67 1.981 -31.312 27.618 1.00 0.00 H new ATOM 0 HB3 LEU A 67 0.472 -31.407 28.503 1.00 0.00 H new ATOM 0 HG LEU A 67 0.145 -30.440 25.707 1.00 0.00 H new ATOM 0 HD11 LEU A 67 0.454 -32.690 24.682 1.00 0.00 H new ATOM 0 HD12 LEU A 67 1.983 -32.067 25.347 1.00 0.00 H new ATOM 0 HD13 LEU A 67 1.066 -33.307 26.235 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -1.710 -32.108 25.740 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -1.127 -32.716 27.308 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -1.760 -31.058 27.176 1.00 0.00 H new ATOM 1098 N ASN A 68 -1.112 -28.847 28.922 1.00 0.00 N ATOM 1099 CA ASN A 68 -2.482 -28.357 28.993 1.00 0.00 C ATOM 1100 C ASN A 68 -2.541 -26.889 28.578 1.00 0.00 C ATOM 1101 O ASN A 68 -3.448 -26.471 27.863 1.00 0.00 O ATOM 1102 CB ASN A 68 -3.016 -28.509 30.417 1.00 0.00 C ATOM 1103 CG ASN A 68 -4.443 -27.982 30.497 1.00 0.00 C ATOM 1104 OD1 ASN A 68 -5.280 -28.325 29.661 1.00 0.00 O ATOM 1105 ND2 ASN A 68 -4.775 -27.161 31.456 1.00 0.00 N ATOM 0 H ASN A 68 -0.716 -29.136 29.816 1.00 0.00 H new ATOM 0 HA ASN A 68 -3.098 -28.943 28.311 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -2.989 -29.557 30.714 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -2.379 -27.964 31.113 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -5.728 -26.803 31.514 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -4.081 -26.878 32.148 1.00 0.00 H new ATOM 1112 N ALA A 69 -1.560 -26.112 29.031 1.00 0.00 N ATOM 1113 CA ALA A 69 -1.502 -24.691 28.695 1.00 0.00 C ATOM 1114 C ALA A 69 -1.135 -24.497 27.227 1.00 0.00 C ATOM 1115 O ALA A 69 -1.648 -23.599 26.560 1.00 0.00 O ATOM 1116 CB ALA A 69 -0.476 -23.985 29.577 1.00 0.00 C ATOM 0 H ALA A 69 -0.800 -26.439 29.627 1.00 0.00 H new ATOM 0 HA ALA A 69 -2.488 -24.259 28.869 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -0.441 -22.927 29.318 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -0.760 -24.094 30.624 1.00 0.00 H new ATOM 0 HB3 ALA A 69 0.507 -24.430 29.420 1.00 0.00 H new ATOM 1122 N PHE A 70 -0.246 -25.352 26.732 1.00 0.00 N ATOM 1123 CA PHE A 70 0.189 -25.277 25.342 1.00 0.00 C ATOM 1124 C PHE A 70 -0.990 -25.513 24.407 1.00 0.00 C ATOM 1125 O PHE A 70 -0.929 -25.184 23.222 1.00 0.00 O ATOM 1126 CB PHE A 70 1.289 -26.314 25.074 1.00 0.00 C ATOM 1127 CG PHE A 70 2.616 -25.799 25.581 1.00 0.00 C ATOM 1128 CD1 PHE A 70 3.337 -24.878 24.814 1.00 0.00 C ATOM 1129 CD2 PHE A 70 3.122 -26.236 26.809 1.00 0.00 C ATOM 1130 CE1 PHE A 70 4.565 -24.393 25.275 1.00 0.00 C ATOM 1131 CE2 PHE A 70 4.350 -25.751 27.272 1.00 0.00 C ATOM 1132 CZ PHE A 70 5.073 -24.830 26.504 1.00 0.00 C ATOM 0 H PHE A 70 0.186 -26.103 27.271 1.00 0.00 H new ATOM 0 HA PHE A 70 0.591 -24.281 25.156 1.00 0.00 H new ATOM 0 HB2 PHE A 70 1.042 -27.255 25.566 1.00 0.00 H new ATOM 0 HB3 PHE A 70 1.353 -26.521 24.006 1.00 0.00 H new ATOM 0 HD1 PHE A 70 2.945 -24.541 23.866 1.00 0.00 H new ATOM 0 HD2 PHE A 70 2.565 -26.948 27.400 1.00 0.00 H new ATOM 0 HE1 PHE A 70 5.121 -23.681 24.683 1.00 0.00 H new ATOM 0 HE2 PHE A 70 4.740 -26.087 28.221 1.00 0.00 H new ATOM 0 HZ PHE A 70 6.022 -24.457 26.860 1.00 0.00 H new ATOM 1142 N ARG A 71 -2.062 -26.082 24.943 1.00 0.00 N ATOM 1143 CA ARG A 71 -3.241 -26.353 24.134 1.00 0.00 C ATOM 1144 C ARG A 71 -3.623 -25.112 23.341 1.00 0.00 C ATOM 1145 O ARG A 71 -4.186 -25.210 22.251 1.00 0.00 O ATOM 1146 CB ARG A 71 -4.411 -26.766 25.025 1.00 0.00 C ATOM 1147 CG ARG A 71 -4.132 -28.144 25.624 1.00 0.00 C ATOM 1148 CD ARG A 71 -5.253 -28.523 26.593 1.00 0.00 C ATOM 1149 NE ARG A 71 -6.516 -28.643 25.876 1.00 0.00 N ATOM 1150 CZ ARG A 71 -7.655 -28.870 26.520 1.00 0.00 C ATOM 1151 NH1 ARG A 71 -7.654 -29.007 27.818 1.00 0.00 N ATOM 1152 NH2 ARG A 71 -8.774 -28.961 25.854 1.00 0.00 N ATOM 0 H ARG A 71 -2.139 -26.361 25.921 1.00 0.00 H new ATOM 0 HA ARG A 71 -3.011 -27.167 23.446 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -4.553 -26.034 25.820 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -5.333 -26.790 24.445 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -4.058 -28.888 24.830 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -3.175 -28.137 26.145 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -5.015 -29.466 27.086 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -5.340 -27.768 27.374 1.00 0.00 H new ATOM 0 HE ARG A 71 -6.525 -28.551 24.860 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -6.779 -28.940 28.337 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -8.529 -29.181 28.313 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -8.773 -28.858 24.839 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -9.649 -29.135 26.348 1.00 0.00 H new ATOM 1166 N GLU A 72 -3.301 -23.945 23.885 1.00 0.00 N ATOM 1167 CA GLU A 72 -3.605 -22.701 23.199 1.00 0.00 C ATOM 1168 C GLU A 72 -2.889 -22.675 21.860 1.00 0.00 C ATOM 1169 O GLU A 72 -3.484 -22.356 20.834 1.00 0.00 O ATOM 1170 CB GLU A 72 -3.150 -21.508 24.046 1.00 0.00 C ATOM 1171 CG GLU A 72 -4.018 -21.418 25.302 1.00 0.00 C ATOM 1172 CD GLU A 72 -3.525 -20.286 26.199 1.00 0.00 C ATOM 1173 OE1 GLU A 72 -2.612 -19.588 25.792 1.00 0.00 O ATOM 1174 OE2 GLU A 72 -4.072 -20.134 27.279 1.00 0.00 O ATOM 0 H GLU A 72 -2.836 -23.836 24.786 1.00 0.00 H new ATOM 0 HA GLU A 72 -4.681 -22.634 23.041 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -2.102 -21.622 24.322 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -3.229 -20.587 23.469 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -5.058 -21.246 25.024 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -3.986 -22.363 25.844 1.00 0.00 H new ATOM 1181 N LEU A 73 -1.610 -23.027 21.877 1.00 0.00 N ATOM 1182 CA LEU A 73 -0.826 -23.044 20.649 1.00 0.00 C ATOM 1183 C LEU A 73 -1.411 -24.076 19.690 1.00 0.00 C ATOM 1184 O LEU A 73 -1.545 -23.834 18.495 1.00 0.00 O ATOM 1185 CB LEU A 73 0.642 -23.382 20.969 1.00 0.00 C ATOM 1186 CG LEU A 73 1.585 -22.713 19.949 1.00 0.00 C ATOM 1187 CD1 LEU A 73 1.177 -23.110 18.521 1.00 0.00 C ATOM 1188 CD2 LEU A 73 1.529 -21.168 20.108 1.00 0.00 C ATOM 0 H LEU A 73 -1.099 -23.301 22.716 1.00 0.00 H new ATOM 0 HA LEU A 73 -0.861 -22.061 20.180 1.00 0.00 H new ATOM 0 HB2 LEU A 73 0.888 -23.045 21.976 1.00 0.00 H new ATOM 0 HB3 LEU A 73 0.785 -24.462 20.951 1.00 0.00 H new ATOM 0 HG LEU A 73 2.605 -23.050 20.133 1.00 0.00 H new ATOM 0 HD11 LEU A 73 1.847 -22.634 17.805 1.00 0.00 H new ATOM 0 HD12 LEU A 73 1.240 -24.193 18.412 1.00 0.00 H new ATOM 0 HD13 LEU A 73 0.154 -22.785 18.331 1.00 0.00 H new ATOM 0 HD21 LEU A 73 2.198 -20.703 19.384 1.00 0.00 H new ATOM 0 HD22 LEU A 73 0.510 -20.821 19.936 1.00 0.00 H new ATOM 0 HD23 LEU A 73 1.840 -20.895 21.116 1.00 0.00 H new ATOM 1200 N ARG A 74 -1.774 -25.228 20.233 1.00 0.00 N ATOM 1201 CA ARG A 74 -2.349 -26.288 19.426 1.00 0.00 C ATOM 1202 C ARG A 74 -3.662 -25.830 18.819 1.00 0.00 C ATOM 1203 O ARG A 74 -3.950 -26.101 17.654 1.00 0.00 O ATOM 1204 CB ARG A 74 -2.569 -27.535 20.280 1.00 0.00 C ATOM 1205 CG ARG A 74 -3.195 -28.635 19.423 1.00 0.00 C ATOM 1206 CD ARG A 74 -3.234 -29.942 20.212 1.00 0.00 C ATOM 1207 NE ARG A 74 -4.111 -29.804 21.369 1.00 0.00 N ATOM 1208 CZ ARG A 74 -4.219 -30.777 22.265 1.00 0.00 C ATOM 1209 NH1 ARG A 74 -3.532 -31.877 22.119 1.00 0.00 N ATOM 1210 NH2 ARG A 74 -5.011 -30.634 23.292 1.00 0.00 N ATOM 0 H ARG A 74 -1.681 -25.450 21.224 1.00 0.00 H new ATOM 0 HA ARG A 74 -1.658 -26.532 18.619 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -1.621 -27.877 20.694 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -3.219 -27.301 21.123 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -4.204 -28.348 19.126 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -2.619 -28.769 18.508 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -3.587 -30.751 19.573 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -2.229 -30.209 20.538 1.00 0.00 H new ATOM 0 HE ARG A 74 -4.650 -28.947 21.491 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -2.912 -31.989 21.316 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -3.615 -32.625 22.807 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -5.548 -29.774 23.406 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -5.094 -31.382 23.980 1.00 0.00 H new ATOM 1224 N THR A 75 -4.453 -25.129 19.617 1.00 0.00 N ATOM 1225 CA THR A 75 -5.735 -24.633 19.151 1.00 0.00 C ATOM 1226 C THR A 75 -5.542 -23.681 17.977 1.00 0.00 C ATOM 1227 O THR A 75 -6.246 -23.773 16.972 1.00 0.00 O ATOM 1228 CB THR A 75 -6.450 -23.909 20.274 1.00 0.00 C ATOM 1229 OG1 THR A 75 -6.724 -24.820 21.330 1.00 0.00 O ATOM 1230 CG2 THR A 75 -7.758 -23.321 19.750 1.00 0.00 C ATOM 0 H THR A 75 -4.230 -24.893 20.584 1.00 0.00 H new ATOM 0 HA THR A 75 -6.336 -25.482 18.825 1.00 0.00 H new ATOM 0 HB THR A 75 -5.817 -23.105 20.648 1.00 0.00 H new ATOM 0 HG1 THR A 75 -5.909 -24.968 21.854 1.00 0.00 H new ATOM 0 HG21 THR A 75 -8.272 -22.800 20.558 1.00 0.00 H new ATOM 0 HG22 THR A 75 -7.544 -22.619 18.944 1.00 0.00 H new ATOM 0 HG23 THR A 75 -8.393 -24.123 19.374 1.00 0.00 H new ATOM 1238 N GLN A 76 -4.589 -22.767 18.110 1.00 0.00 N ATOM 1239 CA GLN A 76 -4.325 -21.809 17.048 1.00 0.00 C ATOM 1240 C GLN A 76 -4.030 -22.542 15.746 1.00 0.00 C ATOM 1241 O GLN A 76 -4.636 -22.262 14.713 1.00 0.00 O ATOM 1242 CB GLN A 76 -3.123 -20.937 17.431 1.00 0.00 C ATOM 1243 CG GLN A 76 -3.518 -19.999 18.574 1.00 0.00 C ATOM 1244 CD GLN A 76 -2.302 -19.213 19.053 1.00 0.00 C ATOM 1245 OE1 GLN A 76 -1.228 -19.302 18.459 1.00 0.00 O ATOM 1246 NE2 GLN A 76 -2.405 -18.449 20.108 1.00 0.00 N ATOM 0 H GLN A 76 -3.994 -22.670 18.932 1.00 0.00 H new ATOM 0 HA GLN A 76 -5.203 -21.178 16.910 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -2.286 -21.566 17.735 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -2.791 -20.358 16.569 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -4.295 -19.312 18.239 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -3.936 -20.575 19.399 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -3.296 -18.376 20.600 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -1.595 -17.926 20.440 1.00 0.00 H new ATOM 1255 N LEU A 77 -3.102 -23.484 15.804 1.00 0.00 N ATOM 1256 CA LEU A 77 -2.735 -24.249 14.625 1.00 0.00 C ATOM 1257 C LEU A 77 -3.902 -25.106 14.165 1.00 0.00 C ATOM 1258 O LEU A 77 -4.191 -25.203 12.974 1.00 0.00 O ATOM 1259 CB LEU A 77 -1.516 -25.134 14.931 1.00 0.00 C ATOM 1260 CG LEU A 77 -0.202 -24.331 14.840 1.00 0.00 C ATOM 1261 CD1 LEU A 77 0.211 -24.166 13.377 1.00 0.00 C ATOM 1262 CD2 LEU A 77 -0.360 -22.948 15.492 1.00 0.00 C ATOM 0 H LEU A 77 -2.592 -23.736 16.651 1.00 0.00 H new ATOM 0 HA LEU A 77 -2.477 -23.556 13.824 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -1.615 -25.561 15.929 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -1.484 -25.968 14.230 1.00 0.00 H new ATOM 0 HG LEU A 77 0.572 -24.882 15.375 1.00 0.00 H new ATOM 0 HD11 LEU A 77 1.140 -23.598 13.323 1.00 0.00 H new ATOM 0 HD12 LEU A 77 0.360 -25.148 12.928 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -0.572 -23.634 12.836 1.00 0.00 H new ATOM 0 HD21 LEU A 77 0.579 -22.400 15.416 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -1.147 -22.393 14.981 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -0.625 -23.069 16.542 1.00 0.00 H new ATOM 1274 N GLU A 78 -4.575 -25.716 15.118 1.00 0.00 N ATOM 1275 CA GLU A 78 -5.709 -26.553 14.799 1.00 0.00 C ATOM 1276 C GLU A 78 -6.813 -25.711 14.175 1.00 0.00 C ATOM 1277 O GLU A 78 -7.535 -26.173 13.290 1.00 0.00 O ATOM 1278 CB GLU A 78 -6.220 -27.229 16.069 1.00 0.00 C ATOM 1279 CG GLU A 78 -7.363 -28.180 15.716 1.00 0.00 C ATOM 1280 CD GLU A 78 -7.846 -28.904 16.967 1.00 0.00 C ATOM 1281 OE1 GLU A 78 -7.477 -28.483 18.051 1.00 0.00 O ATOM 1282 OE2 GLU A 78 -8.574 -29.872 16.824 1.00 0.00 O ATOM 0 H GLU A 78 -4.358 -25.648 16.112 1.00 0.00 H new ATOM 0 HA GLU A 78 -5.403 -27.318 14.086 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -5.412 -27.778 16.552 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -6.564 -26.478 16.780 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -8.186 -27.622 15.269 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -7.028 -28.904 14.974 1.00 0.00 H new ATOM 1289 N LYS A 79 -6.937 -24.471 14.637 1.00 0.00 N ATOM 1290 CA LYS A 79 -7.953 -23.573 14.116 1.00 0.00 C ATOM 1291 C LYS A 79 -7.661 -23.251 12.661 1.00 0.00 C ATOM 1292 O LYS A 79 -8.558 -23.258 11.816 1.00 0.00 O ATOM 1293 CB LYS A 79 -7.977 -22.285 14.935 1.00 0.00 C ATOM 1294 CG LYS A 79 -9.144 -21.407 14.475 1.00 0.00 C ATOM 1295 CD LYS A 79 -9.162 -20.098 15.273 1.00 0.00 C ATOM 1296 CE LYS A 79 -9.692 -20.340 16.693 1.00 0.00 C ATOM 1297 NZ LYS A 79 -10.012 -19.031 17.328 1.00 0.00 N ATOM 0 H LYS A 79 -6.349 -24.070 15.367 1.00 0.00 H new ATOM 0 HA LYS A 79 -8.926 -24.059 14.186 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -8.079 -22.518 15.995 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -7.036 -21.748 14.816 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -9.051 -21.192 13.410 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -10.086 -21.939 14.612 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -8.156 -19.680 15.320 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -9.788 -19.364 14.765 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -10.582 -20.968 16.659 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -8.948 -20.873 17.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -10.372 -19.191 18.291 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -9.152 -18.447 17.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -10.736 -18.540 16.765 1.00 0.00 H new ATOM 1311 N ALA A 80 -6.397 -22.970 12.376 1.00 0.00 N ATOM 1312 CA ALA A 80 -5.995 -22.647 11.017 1.00 0.00 C ATOM 1313 C ALA A 80 -6.238 -23.837 10.104 1.00 0.00 C ATOM 1314 O ALA A 80 -6.402 -23.686 8.896 1.00 0.00 O ATOM 1315 CB ALA A 80 -4.514 -22.257 10.966 1.00 0.00 C ATOM 0 H ALA A 80 -5.641 -22.959 13.060 1.00 0.00 H new ATOM 0 HA ALA A 80 -6.592 -21.801 10.678 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -4.235 -22.019 9.939 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -4.345 -21.386 11.599 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -3.906 -23.088 11.324 1.00 0.00 H new ATOM 1321 N LEU A 81 -6.254 -25.026 10.692 1.00 0.00 N ATOM 1322 CA LEU A 81 -6.468 -26.239 9.916 1.00 0.00 C ATOM 1323 C LEU A 81 -7.844 -26.200 9.259 1.00 0.00 C ATOM 1324 O LEU A 81 -8.007 -26.568 8.098 1.00 0.00 O ATOM 1325 CB LEU A 81 -6.348 -27.472 10.830 1.00 0.00 C ATOM 1326 CG LEU A 81 -5.783 -28.669 10.038 1.00 0.00 C ATOM 1327 CD1 LEU A 81 -6.652 -28.924 8.793 1.00 0.00 C ATOM 1328 CD2 LEU A 81 -4.314 -28.384 9.619 1.00 0.00 C ATOM 0 H LEU A 81 -6.123 -25.176 11.692 1.00 0.00 H new ATOM 0 HA LEU A 81 -5.709 -26.304 9.136 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -5.697 -27.246 11.675 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.325 -27.726 11.240 1.00 0.00 H new ATOM 0 HG LEU A 81 -5.799 -29.557 10.670 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -6.250 -29.770 8.236 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -7.674 -29.145 9.102 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -6.648 -28.037 8.159 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -3.923 -29.235 9.060 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -4.281 -27.492 8.993 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -3.706 -28.225 10.510 1.00 0.00 H new ATOM 1340 N GLY A 82 -8.835 -25.745 10.014 1.00 0.00 N ATOM 1341 CA GLY A 82 -10.190 -25.664 9.496 1.00 0.00 C ATOM 1342 C GLY A 82 -10.262 -24.663 8.352 1.00 0.00 C ATOM 1343 O GLY A 82 -11.200 -24.682 7.554 1.00 0.00 O ATOM 0 H GLY A 82 -8.726 -25.430 10.978 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -10.513 -26.646 9.149 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -10.873 -25.366 10.292 1.00 0.00 H new ATOM 1347 N LEU A 83 -9.261 -23.793 8.280 1.00 0.00 N ATOM 1348 CA LEU A 83 -9.205 -22.787 7.230 1.00 0.00 C ATOM 1349 C LEU A 83 -10.527 -22.037 7.142 1.00 0.00 C ATOM 1350 O LEU A 83 -10.874 -21.491 6.095 1.00 0.00 O ATOM 1351 CB LEU A 83 -8.905 -23.458 5.887 1.00 0.00 C ATOM 1352 CG LEU A 83 -7.495 -24.071 5.918 1.00 0.00 C ATOM 1353 CD1 LEU A 83 -7.324 -25.017 4.722 1.00 0.00 C ATOM 1354 CD2 LEU A 83 -6.418 -22.965 5.860 1.00 0.00 C ATOM 0 H LEU A 83 -8.480 -23.765 8.935 1.00 0.00 H new ATOM 0 HA LEU A 83 -8.413 -22.077 7.468 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -9.644 -24.232 5.683 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -8.977 -22.728 5.081 1.00 0.00 H new ATOM 0 HG LEU A 83 -7.375 -24.625 6.849 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -6.325 -25.452 4.742 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -8.068 -25.812 4.778 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -7.458 -24.459 3.795 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -5.428 -23.420 5.883 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -6.533 -22.393 4.939 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -6.532 -22.301 6.717 1.00 0.00 H new