USER MOD reduce.3.24.130724 H: found=0, std=0, add=903, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 739 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 28 LYS NZ :NH3+ -122:sc= -2.86! (180deg=-3.97!) USER MOD Set 1.2: A 84 GLN : amide:sc= -1.18 K(o=-4,f=-3.2) USER MOD Set 2.1: A 10 HIS : no HD1:sc= -0.504 K(o=-0.5,f=-1.5) USER MOD Set 2.2: A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 3 CYS SG : rot 115:sc= -6.62! USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0168) USER MOD Single : A 9 HIS : no HD1:sc= -6.76! C(o=-6.8!,f=-6.3!) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot -101:sc= -1.06 USER MOD Single : A 21 THR OG1 : rot -121:sc= -2.36! USER MOD Single : A 24 MET CE :methyl -119:sc= -2.04! (180deg=-2.75!) USER MOD Single : A 27 MET CE :methyl 169:sc= -4.16! (180deg=-5.06!) USER MOD Single : A 30 THR OG1 : rot 180:sc= -0.261 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 GLN : amide:sc= -14.6! C(o=-15!,f=-22!) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot -126:sc= -2.05 USER MOD Single : A 44 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 45 ASN : amide:sc= -3.14! C(o=-3.1!,f=-1.6!) USER MOD Single : A 53 GLN : amide:sc= -0.037 K(o=-0.037,f=-0.74) USER MOD Single : A 56 ASN : amide:sc= -3.3! C(o=-3.3!,f=-3.8!) USER MOD Single : A 58 SER OG : rot 180:sc= -2.23! USER MOD Single : A 66 GLN : amide:sc= -0.155 X(o=-0.16,f=-0.015) USER MOD Single : A 71 THR OG1 : rot 88:sc= 1.19 USER MOD Single : A 75 MET CE :methyl -169:sc= -0.97 (180deg=-1.82) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 GLN : amide:sc=-0.00485 X(o=-0.0049,f=-0.019) USER MOD Single : A 81 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= -7.11! C(o=-7.1!,f=-4.3!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 ASN : amide:sc=-0.00356 X(o=-0.0036,f=-0.027) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 GLN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 100 SER OG : rot 58:sc= -0.299 USER MOD Single : A 102 SER OG : rot 90:sc= 0.683 USER MOD Single : A 104 SER OG : rot -61:sc= 0.912 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N CYS A 3 14.795 7.766 -1.002 1.00 0.00 N ATOM 2 CA CYS A 3 14.264 8.221 0.273 1.00 0.00 C ATOM 3 C CYS A 3 15.424 8.769 1.107 1.00 0.00 C ATOM 4 O CYS A 3 15.248 9.713 1.876 1.00 0.00 O ATOM 5 CB CYS A 3 13.513 7.106 1.002 1.00 0.00 C ATOM 6 SG CYS A 3 11.708 7.348 0.826 1.00 0.00 S ATOM 0 HA CYS A 3 13.533 9.012 0.105 1.00 0.00 H new ATOM 0 HB2 CYS A 3 13.800 6.137 0.594 1.00 0.00 H new ATOM 0 HB3 CYS A 3 13.786 7.102 2.057 1.00 0.00 H new ATOM 0 HG CYS A 3 11.204 6.368 0.136 1.00 0.00 H new ATOM 11 N THR A 4 16.583 8.154 0.927 1.00 0.00 N ATOM 12 CA THR A 4 17.771 8.569 1.654 1.00 0.00 C ATOM 13 C THR A 4 18.258 9.929 1.149 1.00 0.00 C ATOM 14 O THR A 4 18.434 10.860 1.934 1.00 0.00 O ATOM 15 CB THR A 4 18.819 7.461 1.519 1.00 0.00 C ATOM 16 OG1 THR A 4 18.342 6.427 2.375 1.00 0.00 O ATOM 17 CG2 THR A 4 20.168 7.854 2.125 1.00 0.00 C ATOM 0 H THR A 4 16.725 7.371 0.288 1.00 0.00 H new ATOM 0 HA THR A 4 17.557 8.708 2.714 1.00 0.00 H new ATOM 0 HB THR A 4 18.953 7.214 0.466 1.00 0.00 H new ATOM 0 HG1 THR A 4 18.961 5.668 2.347 1.00 0.00 H new ATOM 0 HG21 THR A 4 20.875 7.033 2.003 1.00 0.00 H new ATOM 0 HG22 THR A 4 20.550 8.740 1.619 1.00 0.00 H new ATOM 0 HG23 THR A 4 20.042 8.069 3.186 1.00 0.00 H new ATOM 25 N PHE A 5 18.460 10.002 -0.158 1.00 0.00 N ATOM 26 CA PHE A 5 18.922 11.233 -0.776 1.00 0.00 C ATOM 27 C PHE A 5 18.077 12.425 -0.323 1.00 0.00 C ATOM 28 O PHE A 5 18.577 13.325 0.351 1.00 0.00 O ATOM 29 CB PHE A 5 18.768 11.059 -2.289 1.00 0.00 C ATOM 30 CG PHE A 5 20.092 10.874 -3.032 1.00 0.00 C ATOM 31 CD1 PHE A 5 20.952 9.892 -2.653 1.00 0.00 C ATOM 32 CD2 PHE A 5 20.408 11.692 -4.072 1.00 0.00 C ATOM 33 CE1 PHE A 5 22.182 9.721 -3.343 1.00 0.00 C ATOM 34 CE2 PHE A 5 21.637 11.521 -4.762 1.00 0.00 C ATOM 35 CZ PHE A 5 22.498 10.538 -4.383 1.00 0.00 C ATOM 0 H PHE A 5 18.312 9.229 -0.806 1.00 0.00 H new ATOM 0 HA PHE A 5 19.956 11.427 -0.492 1.00 0.00 H new ATOM 0 HB2 PHE A 5 18.131 10.196 -2.482 1.00 0.00 H new ATOM 0 HB3 PHE A 5 18.255 11.931 -2.694 1.00 0.00 H new ATOM 0 HD1 PHE A 5 20.700 9.242 -1.828 1.00 0.00 H new ATOM 0 HD2 PHE A 5 19.724 12.472 -4.373 1.00 0.00 H new ATOM 0 HE1 PHE A 5 22.866 8.942 -3.041 1.00 0.00 H new ATOM 0 HE2 PHE A 5 21.888 12.171 -5.587 1.00 0.00 H new ATOM 0 HZ PHE A 5 23.432 10.407 -4.908 1.00 0.00 H new ATOM 44 N PHE A 6 16.810 12.394 -0.711 1.00 0.00 N ATOM 45 CA PHE A 6 15.891 13.460 -0.353 1.00 0.00 C ATOM 46 C PHE A 6 16.184 13.987 1.052 1.00 0.00 C ATOM 47 O PHE A 6 16.512 15.161 1.224 1.00 0.00 O ATOM 48 CB PHE A 6 14.482 12.864 -0.377 1.00 0.00 C ATOM 49 CG PHE A 6 13.407 13.828 -0.883 1.00 0.00 C ATOM 50 CD1 PHE A 6 13.131 13.903 -2.212 1.00 0.00 C ATOM 51 CD2 PHE A 6 12.728 14.610 -0.002 1.00 0.00 C ATOM 52 CE1 PHE A 6 12.134 14.798 -2.681 1.00 0.00 C ATOM 53 CE2 PHE A 6 11.729 15.506 -0.471 1.00 0.00 C ATOM 54 CZ PHE A 6 11.454 15.580 -1.801 1.00 0.00 C ATOM 0 H PHE A 6 16.399 11.647 -1.270 1.00 0.00 H new ATOM 0 HA PHE A 6 15.994 14.290 -1.053 1.00 0.00 H new ATOM 0 HB2 PHE A 6 14.485 11.976 -1.009 1.00 0.00 H new ATOM 0 HB3 PHE A 6 14.219 12.539 0.630 1.00 0.00 H new ATOM 0 HD1 PHE A 6 13.670 13.281 -2.911 1.00 0.00 H new ATOM 0 HD2 PHE A 6 12.948 14.550 1.054 1.00 0.00 H new ATOM 0 HE1 PHE A 6 11.916 14.858 -3.737 1.00 0.00 H new ATOM 0 HE2 PHE A 6 11.189 16.127 0.228 1.00 0.00 H new ATOM 0 HZ PHE A 6 10.695 16.260 -2.158 1.00 0.00 H new ATOM 63 N GLU A 7 16.056 13.095 2.024 1.00 0.00 N ATOM 64 CA GLU A 7 16.303 13.456 3.410 1.00 0.00 C ATOM 65 C GLU A 7 16.031 12.261 4.325 1.00 0.00 C ATOM 66 O GLU A 7 16.962 11.655 4.855 1.00 0.00 O ATOM 67 CB GLU A 7 15.460 14.665 3.820 1.00 0.00 C ATOM 68 CG GLU A 7 16.327 15.740 4.477 1.00 0.00 C ATOM 69 CD GLU A 7 15.512 16.572 5.469 1.00 0.00 C ATOM 70 OE1 GLU A 7 14.807 17.489 4.996 1.00 0.00 O ATOM 71 OE2 GLU A 7 15.613 16.272 6.678 1.00 0.00 O ATOM 0 H GLU A 7 15.784 12.123 1.879 1.00 0.00 H new ATOM 0 HA GLU A 7 17.352 13.735 3.512 1.00 0.00 H new ATOM 0 HB2 GLU A 7 14.962 15.080 2.944 1.00 0.00 H new ATOM 0 HB3 GLU A 7 14.678 14.350 4.511 1.00 0.00 H new ATOM 0 HG2 GLU A 7 17.165 15.271 4.993 1.00 0.00 H new ATOM 0 HG3 GLU A 7 16.748 16.391 3.711 1.00 0.00 H new ATOM 76 N LYS A 8 14.751 11.957 4.485 1.00 0.00 N ATOM 77 CA LYS A 8 14.346 10.846 5.329 1.00 0.00 C ATOM 78 C LYS A 8 13.560 9.836 4.490 1.00 0.00 C ATOM 79 O LYS A 8 14.144 8.951 3.868 1.00 0.00 O ATOM 80 CB LYS A 8 13.583 11.353 6.554 1.00 0.00 C ATOM 81 CG LYS A 8 14.488 12.201 7.451 1.00 0.00 C ATOM 82 CD LYS A 8 13.668 13.193 8.276 1.00 0.00 C ATOM 83 CE LYS A 8 14.579 14.177 9.014 1.00 0.00 C ATOM 84 NZ LYS A 8 15.339 13.481 10.077 1.00 0.00 N ATOM 0 H LYS A 8 13.981 12.461 4.044 1.00 0.00 H new ATOM 0 HA LYS A 8 15.220 10.326 5.720 1.00 0.00 H new ATOM 0 HB2 LYS A 8 12.725 11.944 6.234 1.00 0.00 H new ATOM 0 HB3 LYS A 8 13.193 10.507 7.120 1.00 0.00 H new ATOM 0 HG2 LYS A 8 15.057 11.552 8.117 1.00 0.00 H new ATOM 0 HG3 LYS A 8 15.210 12.741 6.838 1.00 0.00 H new ATOM 0 HD2 LYS A 8 12.989 13.741 7.623 1.00 0.00 H new ATOM 0 HD3 LYS A 8 13.052 12.652 8.995 1.00 0.00 H new ATOM 0 HE2 LYS A 8 15.269 14.641 8.310 1.00 0.00 H new ATOM 0 HE3 LYS A 8 13.982 14.978 9.450 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 15.888 14.176 10.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 14.678 12.987 10.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 15.986 12.790 9.646 1.00 0.00 H new ATOM 94 N HIS A 9 12.244 10.003 4.500 1.00 0.00 N ATOM 95 CA HIS A 9 11.372 9.117 3.748 1.00 0.00 C ATOM 96 C HIS A 9 9.915 9.524 3.967 1.00 0.00 C ATOM 97 O HIS A 9 9.030 8.672 4.028 1.00 0.00 O ATOM 98 CB HIS A 9 11.640 7.655 4.111 1.00 0.00 C ATOM 99 CG HIS A 9 12.225 7.461 5.489 1.00 0.00 C ATOM 100 ND1 HIS A 9 13.216 6.533 5.759 1.00 0.00 N ATOM 101 CD2 HIS A 9 11.951 8.086 6.670 1.00 0.00 C ATOM 102 CE1 HIS A 9 13.516 6.604 7.047 1.00 0.00 C ATOM 103 NE2 HIS A 9 12.731 7.566 7.611 1.00 0.00 N ATOM 0 H HIS A 9 11.762 10.738 5.017 1.00 0.00 H new ATOM 0 HA HIS A 9 11.583 9.211 2.683 1.00 0.00 H new ATOM 0 HB2 HIS A 9 10.706 7.097 4.042 1.00 0.00 H new ATOM 0 HB3 HIS A 9 12.321 7.228 3.375 1.00 0.00 H new ATOM 0 HD2 HIS A 9 11.223 8.871 6.815 1.00 0.00 H new ATOM 0 HE1 HIS A 9 14.253 6.005 7.561 1.00 0.00 H new ATOM 0 HE2 HIS A 9 12.741 7.841 8.593 1.00 0.00 H new ATOM 110 N HIS A 10 9.709 10.829 4.080 1.00 0.00 N ATOM 111 CA HIS A 10 8.373 11.360 4.291 1.00 0.00 C ATOM 112 C HIS A 10 7.680 10.576 5.408 1.00 0.00 C ATOM 113 O HIS A 10 6.541 10.139 5.249 1.00 0.00 O ATOM 114 CB HIS A 10 7.576 11.362 2.986 1.00 0.00 C ATOM 115 CG HIS A 10 8.404 11.671 1.761 1.00 0.00 C ATOM 116 ND1 HIS A 10 8.571 10.771 0.723 1.00 0.00 N ATOM 117 CD2 HIS A 10 9.109 12.788 1.421 1.00 0.00 C ATOM 118 CE1 HIS A 10 9.345 11.333 -0.196 1.00 0.00 C ATOM 119 NE2 HIS A 10 9.677 12.581 0.239 1.00 0.00 N ATOM 0 H HIS A 10 10.445 11.533 4.029 1.00 0.00 H new ATOM 0 HA HIS A 10 8.438 12.400 4.610 1.00 0.00 H new ATOM 0 HB2 HIS A 10 7.106 10.387 2.858 1.00 0.00 H new ATOM 0 HB3 HIS A 10 6.773 12.095 3.064 1.00 0.00 H new ATOM 0 HD2 HIS A 10 9.191 13.688 2.013 1.00 0.00 H new ATOM 0 HE1 HIS A 10 9.657 10.881 -1.126 1.00 0.00 H new ATOM 0 HE2 HIS A 10 10.265 13.247 -0.262 1.00 0.00 H new ATOM 126 N ARG A 11 8.395 10.423 6.512 1.00 0.00 N ATOM 127 CA ARG A 11 7.864 9.700 7.655 1.00 0.00 C ATOM 128 C ARG A 11 7.731 8.211 7.326 1.00 0.00 C ATOM 129 O ARG A 11 6.978 7.492 7.981 1.00 0.00 O ATOM 130 CB ARG A 11 6.495 10.248 8.066 1.00 0.00 C ATOM 131 CG ARG A 11 6.623 11.211 9.248 1.00 0.00 C ATOM 132 CD ARG A 11 6.860 10.447 10.553 1.00 0.00 C ATOM 133 NE ARG A 11 6.635 11.341 11.711 1.00 0.00 N ATOM 134 CZ ARG A 11 7.162 11.143 12.926 1.00 0.00 C ATOM 135 NH1 ARG A 11 7.948 10.081 13.151 1.00 0.00 N ATOM 136 NH2 ARG A 11 6.903 12.007 13.917 1.00 0.00 N ATOM 0 H ARG A 11 9.339 10.788 6.640 1.00 0.00 H new ATOM 0 HA ARG A 11 8.560 9.832 8.483 1.00 0.00 H new ATOM 0 HB2 ARG A 11 6.036 10.762 7.221 1.00 0.00 H new ATOM 0 HB3 ARG A 11 5.835 9.423 8.334 1.00 0.00 H new ATOM 0 HG2 ARG A 11 7.448 11.902 9.072 1.00 0.00 H new ATOM 0 HG3 ARG A 11 5.717 11.811 9.333 1.00 0.00 H new ATOM 0 HD2 ARG A 11 6.189 9.590 10.609 1.00 0.00 H new ATOM 0 HD3 ARG A 11 7.878 10.057 10.576 1.00 0.00 H new ATOM 0 HE ARG A 11 6.041 12.159 11.575 1.00 0.00 H new ATOM 0 HH11 ARG A 11 8.145 9.423 12.397 1.00 0.00 H new ATOM 0 HH12 ARG A 11 8.349 9.930 14.077 1.00 0.00 H new ATOM 0 HH21 ARG A 11 6.305 12.815 13.746 1.00 0.00 H new ATOM 0 HH22 ARG A 11 7.304 11.857 14.843 1.00 0.00 H new ATOM 147 N LYS A 12 8.473 7.794 6.310 1.00 0.00 N ATOM 148 CA LYS A 12 8.447 6.404 5.887 1.00 0.00 C ATOM 149 C LYS A 12 7.089 6.092 5.256 1.00 0.00 C ATOM 150 O LYS A 12 6.518 5.030 5.497 1.00 0.00 O ATOM 151 CB LYS A 12 8.811 5.482 7.052 1.00 0.00 C ATOM 152 CG LYS A 12 10.230 5.761 7.551 1.00 0.00 C ATOM 153 CD LYS A 12 10.667 4.714 8.577 1.00 0.00 C ATOM 154 CE LYS A 12 11.306 5.378 9.799 1.00 0.00 C ATOM 155 NZ LYS A 12 11.637 4.364 10.825 1.00 0.00 N ATOM 0 H LYS A 12 9.095 8.394 5.768 1.00 0.00 H new ATOM 0 HA LYS A 12 9.202 6.225 5.122 1.00 0.00 H new ATOM 0 HB2 LYS A 12 8.101 5.623 7.867 1.00 0.00 H new ATOM 0 HB3 LYS A 12 8.731 4.442 6.736 1.00 0.00 H new ATOM 0 HG2 LYS A 12 10.922 5.761 6.709 1.00 0.00 H new ATOM 0 HG3 LYS A 12 10.273 6.754 7.999 1.00 0.00 H new ATOM 0 HD2 LYS A 12 9.806 4.123 8.888 1.00 0.00 H new ATOM 0 HD3 LYS A 12 11.377 4.025 8.120 1.00 0.00 H new ATOM 0 HE2 LYS A 12 12.209 5.910 9.501 1.00 0.00 H new ATOM 0 HE3 LYS A 12 10.623 6.118 10.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 12.070 4.831 11.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 10.769 3.874 11.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 12.305 3.673 10.428 1.00 0.00 H new ATOM 165 N TRP A 13 6.610 7.039 4.462 1.00 0.00 N ATOM 166 CA TRP A 13 5.330 6.878 3.794 1.00 0.00 C ATOM 167 C TRP A 13 5.573 6.150 2.470 1.00 0.00 C ATOM 168 O TRP A 13 4.946 5.128 2.196 1.00 0.00 O ATOM 169 CB TRP A 13 4.632 8.229 3.614 1.00 0.00 C ATOM 170 CG TRP A 13 3.105 8.151 3.662 1.00 0.00 C ATOM 171 CD1 TRP A 13 2.343 7.353 4.423 1.00 0.00 C ATOM 172 CD2 TRP A 13 2.180 8.939 2.884 1.00 0.00 C ATOM 173 NE1 TRP A 13 1.000 7.568 4.192 1.00 0.00 N ATOM 174 CE2 TRP A 13 0.897 8.562 3.226 1.00 0.00 C ATOM 175 CE3 TRP A 13 2.418 9.936 1.922 1.00 0.00 C ATOM 176 CZ2 TRP A 13 -0.248 9.132 2.656 1.00 0.00 C ATOM 177 CZ3 TRP A 13 1.264 10.495 1.361 1.00 0.00 C ATOM 178 CH2 TRP A 13 -0.034 10.128 1.695 1.00 0.00 C ATOM 0 H TRP A 13 7.085 7.920 4.267 1.00 0.00 H new ATOM 0 HA TRP A 13 4.652 6.278 4.401 1.00 0.00 H new ATOM 0 HB2 TRP A 13 4.975 8.910 4.392 1.00 0.00 H new ATOM 0 HB3 TRP A 13 4.934 8.658 2.659 1.00 0.00 H new ATOM 0 HD1 TRP A 13 2.731 6.633 5.128 1.00 0.00 H new ATOM 0 HE1 TRP A 13 0.225 7.086 4.647 1.00 0.00 H new ATOM 0 HE3 TRP A 13 3.413 10.246 1.638 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 -1.242 8.821 2.942 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 1.391 11.266 0.616 1.00 0.00 H new ATOM 0 HH2 TRP A 13 -0.874 10.609 1.216 1.00 0.00 H new ATOM 188 N ASP A 14 6.487 6.704 1.687 1.00 0.00 N ATOM 189 CA ASP A 14 6.821 6.120 0.399 1.00 0.00 C ATOM 190 C ASP A 14 7.570 4.804 0.620 1.00 0.00 C ATOM 191 O ASP A 14 7.547 3.922 -0.237 1.00 0.00 O ATOM 192 CB ASP A 14 7.727 7.051 -0.409 1.00 0.00 C ATOM 193 CG ASP A 14 7.982 6.613 -1.853 1.00 0.00 C ATOM 194 OD1 ASP A 14 8.953 5.852 -2.051 1.00 0.00 O ATOM 195 OD2 ASP A 14 7.199 7.048 -2.724 1.00 0.00 O ATOM 0 H ASP A 14 7.006 7.551 1.919 1.00 0.00 H new ATOM 0 HA ASP A 14 5.893 5.956 -0.149 1.00 0.00 H new ATOM 0 HB2 ASP A 14 7.282 8.046 -0.420 1.00 0.00 H new ATOM 0 HB3 ASP A 14 8.685 7.136 0.104 1.00 0.00 H new ATOM 199 N ILE A 15 8.216 4.715 1.773 1.00 0.00 N ATOM 200 CA ILE A 15 8.971 3.522 2.116 1.00 0.00 C ATOM 201 C ILE A 15 8.014 2.456 2.656 1.00 0.00 C ATOM 202 O ILE A 15 8.134 1.281 2.316 1.00 0.00 O ATOM 203 CB ILE A 15 10.112 3.867 3.077 1.00 0.00 C ATOM 204 CG1 ILE A 15 9.598 3.998 4.512 1.00 0.00 C ATOM 205 CG2 ILE A 15 10.855 5.122 2.616 1.00 0.00 C ATOM 206 CD1 ILE A 15 9.493 2.628 5.185 1.00 0.00 C ATOM 0 H ILE A 15 8.232 5.449 2.481 1.00 0.00 H new ATOM 0 HA ILE A 15 9.447 3.105 1.229 1.00 0.00 H new ATOM 0 HB ILE A 15 10.830 3.047 3.066 1.00 0.00 H new ATOM 0 HG12 ILE A 15 10.269 4.638 5.085 1.00 0.00 H new ATOM 0 HG13 ILE A 15 8.621 4.481 4.509 1.00 0.00 H new ATOM 0 HG21 ILE A 15 11.660 5.346 3.316 1.00 0.00 H new ATOM 0 HG22 ILE A 15 11.273 4.954 1.623 1.00 0.00 H new ATOM 0 HG23 ILE A 15 10.162 5.963 2.580 1.00 0.00 H new ATOM 0 HD11 ILE A 15 9.125 2.750 6.204 1.00 0.00 H new ATOM 0 HD12 ILE A 15 8.803 1.999 4.623 1.00 0.00 H new ATOM 0 HD13 ILE A 15 10.476 2.158 5.208 1.00 0.00 H new ATOM 217 N LEU A 16 7.086 2.906 3.488 1.00 0.00 N ATOM 218 CA LEU A 16 6.111 2.006 4.078 1.00 0.00 C ATOM 219 C LEU A 16 5.257 1.388 2.968 1.00 0.00 C ATOM 220 O LEU A 16 4.787 0.259 3.097 1.00 0.00 O ATOM 221 CB LEU A 16 5.294 2.730 5.150 1.00 0.00 C ATOM 222 CG LEU A 16 4.119 1.947 5.741 1.00 0.00 C ATOM 223 CD1 LEU A 16 2.993 1.793 4.717 1.00 0.00 C ATOM 224 CD2 LEU A 16 4.582 0.596 6.291 1.00 0.00 C ATOM 0 H LEU A 16 6.989 3.882 3.767 1.00 0.00 H new ATOM 0 HA LEU A 16 6.612 1.185 4.591 1.00 0.00 H new ATOM 0 HB2 LEU A 16 5.964 3.009 5.963 1.00 0.00 H new ATOM 0 HB3 LEU A 16 4.909 3.656 4.722 1.00 0.00 H new ATOM 0 HG LEU A 16 3.717 2.515 6.579 1.00 0.00 H new ATOM 0 HD11 LEU A 16 2.170 1.233 5.162 1.00 0.00 H new ATOM 0 HD12 LEU A 16 2.639 2.779 4.414 1.00 0.00 H new ATOM 0 HD13 LEU A 16 3.366 1.257 3.844 1.00 0.00 H new ATOM 0 HD21 LEU A 16 3.728 0.060 6.705 1.00 0.00 H new ATOM 0 HD22 LEU A 16 5.024 0.008 5.487 1.00 0.00 H new ATOM 0 HD23 LEU A 16 5.324 0.757 7.073 1.00 0.00 H new ATOM 235 N LEU A 17 5.082 2.157 1.902 1.00 0.00 N ATOM 236 CA LEU A 17 4.293 1.700 0.771 1.00 0.00 C ATOM 237 C LEU A 17 5.226 1.124 -0.296 1.00 0.00 C ATOM 238 O LEU A 17 4.796 0.350 -1.149 1.00 0.00 O ATOM 239 CB LEU A 17 3.392 2.824 0.257 1.00 0.00 C ATOM 240 CG LEU A 17 2.422 2.447 -0.864 1.00 0.00 C ATOM 241 CD1 LEU A 17 1.865 1.037 -0.656 1.00 0.00 C ATOM 242 CD2 LEU A 17 1.310 3.488 -1.001 1.00 0.00 C ATOM 0 H LEU A 17 5.473 3.093 1.798 1.00 0.00 H new ATOM 0 HA LEU A 17 3.621 0.898 1.075 1.00 0.00 H new ATOM 0 HB2 LEU A 17 2.814 3.211 1.096 1.00 0.00 H new ATOM 0 HB3 LEU A 17 4.025 3.638 -0.096 1.00 0.00 H new ATOM 0 HG LEU A 17 2.973 2.440 -1.804 1.00 0.00 H new ATOM 0 HD11 LEU A 17 1.178 0.794 -1.467 1.00 0.00 H new ATOM 0 HD12 LEU A 17 2.685 0.319 -0.648 1.00 0.00 H new ATOM 0 HD13 LEU A 17 1.334 0.992 0.295 1.00 0.00 H new ATOM 0 HD21 LEU A 17 0.635 3.195 -1.805 1.00 0.00 H new ATOM 0 HD22 LEU A 17 0.754 3.552 -0.066 1.00 0.00 H new ATOM 0 HD23 LEU A 17 1.747 4.460 -1.230 1.00 0.00 H new ATOM 253 N GLU A 18 6.487 1.524 -0.212 1.00 0.00 N ATOM 254 CA GLU A 18 7.485 1.057 -1.161 1.00 0.00 C ATOM 255 C GLU A 18 8.633 0.364 -0.424 1.00 0.00 C ATOM 256 O GLU A 18 9.789 0.470 -0.831 1.00 0.00 O ATOM 257 CB GLU A 18 8.002 2.210 -2.023 1.00 0.00 C ATOM 258 CG GLU A 18 8.484 1.702 -3.384 1.00 0.00 C ATOM 259 CD GLU A 18 8.571 2.846 -4.396 1.00 0.00 C ATOM 260 OE1 GLU A 18 9.306 3.812 -4.099 1.00 0.00 O ATOM 261 OE2 GLU A 18 7.900 2.729 -5.445 1.00 0.00 O ATOM 0 H GLU A 18 6.840 2.166 0.498 1.00 0.00 H new ATOM 0 HA GLU A 18 7.016 0.332 -1.826 1.00 0.00 H new ATOM 0 HB2 GLU A 18 7.211 2.946 -2.165 1.00 0.00 H new ATOM 0 HB3 GLU A 18 8.819 2.715 -1.509 1.00 0.00 H new ATOM 0 HG2 GLU A 18 9.462 1.232 -3.276 1.00 0.00 H new ATOM 0 HG3 GLU A 18 7.802 0.936 -3.753 1.00 0.00 H new ATOM 266 N LYS A 19 8.274 -0.328 0.647 1.00 0.00 N ATOM 267 CA LYS A 19 9.260 -1.038 1.444 1.00 0.00 C ATOM 268 C LYS A 19 8.553 -2.081 2.311 1.00 0.00 C ATOM 269 O LYS A 19 9.087 -3.165 2.545 1.00 0.00 O ATOM 270 CB LYS A 19 10.115 -0.051 2.242 1.00 0.00 C ATOM 271 CG LYS A 19 11.546 -0.571 2.402 1.00 0.00 C ATOM 272 CD LYS A 19 12.014 -0.448 3.854 1.00 0.00 C ATOM 273 CE LYS A 19 13.296 -1.250 4.086 1.00 0.00 C ATOM 274 NZ LYS A 19 13.113 -2.209 5.198 1.00 0.00 N ATOM 0 H LYS A 19 7.314 -0.412 0.982 1.00 0.00 H new ATOM 0 HA LYS A 19 9.955 -1.577 0.800 1.00 0.00 H new ATOM 0 HB2 LYS A 19 10.129 0.915 1.737 1.00 0.00 H new ATOM 0 HB3 LYS A 19 9.670 0.110 3.224 1.00 0.00 H new ATOM 0 HG2 LYS A 19 11.596 -1.613 2.087 1.00 0.00 H new ATOM 0 HG3 LYS A 19 12.216 -0.009 1.751 1.00 0.00 H new ATOM 0 HD2 LYS A 19 12.188 0.600 4.096 1.00 0.00 H new ATOM 0 HD3 LYS A 19 11.231 -0.805 4.524 1.00 0.00 H new ATOM 0 HE2 LYS A 19 13.566 -1.786 3.176 1.00 0.00 H new ATOM 0 HE3 LYS A 19 14.119 -0.573 4.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 13.992 -2.745 5.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 12.877 -1.691 6.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 12.341 -2.866 4.966 1.00 0.00 H new ATOM 284 N SER A 20 7.364 -1.717 2.767 1.00 0.00 N ATOM 285 CA SER A 20 6.578 -2.608 3.604 1.00 0.00 C ATOM 286 C SER A 20 5.568 -3.376 2.748 1.00 0.00 C ATOM 287 O SER A 20 5.266 -4.535 3.028 1.00 0.00 O ATOM 288 CB SER A 20 5.857 -1.833 4.708 1.00 0.00 C ATOM 289 OG SER A 20 4.452 -2.072 4.698 1.00 0.00 O ATOM 0 H SER A 20 6.925 -0.817 2.573 1.00 0.00 H new ATOM 0 HA SER A 20 7.256 -3.317 4.079 1.00 0.00 H new ATOM 0 HB2 SER A 20 6.266 -2.118 5.677 1.00 0.00 H new ATOM 0 HB3 SER A 20 6.044 -0.766 4.584 1.00 0.00 H new ATOM 0 HG SER A 20 3.995 -1.319 4.269 1.00 0.00 H new ATOM 294 N THR A 21 5.075 -2.699 1.722 1.00 0.00 N ATOM 295 CA THR A 21 4.105 -3.303 0.824 1.00 0.00 C ATOM 296 C THR A 21 4.623 -3.276 -0.617 1.00 0.00 C ATOM 297 O THR A 21 4.022 -2.645 -1.484 1.00 0.00 O ATOM 298 CB THR A 21 2.774 -2.570 1.003 1.00 0.00 C ATOM 299 OG1 THR A 21 3.131 -1.191 0.993 1.00 0.00 O ATOM 300 CG2 THR A 21 2.169 -2.789 2.393 1.00 0.00 C ATOM 0 H THR A 21 5.329 -1.738 1.492 1.00 0.00 H new ATOM 0 HA THR A 21 3.948 -4.355 1.062 1.00 0.00 H new ATOM 0 HB THR A 21 2.069 -2.906 0.242 1.00 0.00 H new ATOM 0 HG1 THR A 21 2.850 -0.774 1.834 1.00 0.00 H new ATOM 0 HG21 THR A 21 1.226 -2.248 2.469 1.00 0.00 H new ATOM 0 HG22 THR A 21 1.990 -3.853 2.549 1.00 0.00 H new ATOM 0 HG23 THR A 21 2.860 -2.422 3.152 1.00 0.00 H new ATOM 308 N GLY A 22 5.734 -3.968 -0.825 1.00 0.00 N ATOM 309 CA GLY A 22 6.339 -4.031 -2.144 1.00 0.00 C ATOM 310 C GLY A 22 7.800 -4.476 -2.055 1.00 0.00 C ATOM 311 O GLY A 22 8.629 -4.063 -2.865 1.00 0.00 O ATOM 0 H GLY A 22 6.230 -4.489 -0.102 1.00 0.00 H new ATOM 0 HA2 GLY A 22 5.781 -4.726 -2.771 1.00 0.00 H new ATOM 0 HA3 GLY A 22 6.281 -3.053 -2.622 1.00 0.00 H new ATOM 315 N VAL A 23 8.072 -5.314 -1.065 1.00 0.00 N ATOM 316 CA VAL A 23 9.418 -5.821 -0.861 1.00 0.00 C ATOM 317 C VAL A 23 9.390 -7.350 -0.870 1.00 0.00 C ATOM 318 O VAL A 23 9.620 -7.973 -1.905 1.00 0.00 O ATOM 319 CB VAL A 23 10.005 -5.240 0.427 1.00 0.00 C ATOM 320 CG1 VAL A 23 11.258 -6.008 0.854 1.00 0.00 C ATOM 321 CG2 VAL A 23 10.302 -3.748 0.271 1.00 0.00 C ATOM 0 H VAL A 23 7.382 -5.655 -0.395 1.00 0.00 H new ATOM 0 HA VAL A 23 10.073 -5.505 -1.673 1.00 0.00 H new ATOM 0 HB VAL A 23 9.260 -5.351 1.214 1.00 0.00 H new ATOM 0 HG11 VAL A 23 11.655 -5.575 1.772 1.00 0.00 H new ATOM 0 HG12 VAL A 23 11.003 -7.053 1.027 1.00 0.00 H new ATOM 0 HG13 VAL A 23 12.010 -5.944 0.067 1.00 0.00 H new ATOM 0 HG21 VAL A 23 10.718 -3.361 1.201 1.00 0.00 H new ATOM 0 HG22 VAL A 23 11.020 -3.602 -0.536 1.00 0.00 H new ATOM 0 HG23 VAL A 23 9.380 -3.216 0.037 1.00 0.00 H new ATOM 331 N MET A 24 9.107 -7.912 0.297 1.00 0.00 N ATOM 332 CA MET A 24 9.047 -9.356 0.437 1.00 0.00 C ATOM 333 C MET A 24 7.735 -9.789 1.095 1.00 0.00 C ATOM 334 O MET A 24 7.402 -10.973 1.104 1.00 0.00 O ATOM 335 CB MET A 24 10.226 -9.837 1.284 1.00 0.00 C ATOM 336 CG MET A 24 9.910 -9.727 2.777 1.00 0.00 C ATOM 337 SD MET A 24 11.258 -10.397 3.737 1.00 0.00 S ATOM 338 CE MET A 24 10.447 -11.813 4.462 1.00 0.00 C ATOM 0 H MET A 24 8.917 -7.392 1.154 1.00 0.00 H new ATOM 0 HA MET A 24 9.098 -9.801 -0.557 1.00 0.00 H new ATOM 0 HB2 MET A 24 10.460 -10.872 1.034 1.00 0.00 H new ATOM 0 HB3 MET A 24 11.111 -9.245 1.051 1.00 0.00 H new ATOM 0 HG2 MET A 24 9.744 -8.684 3.046 1.00 0.00 H new ATOM 0 HG3 MET A 24 8.989 -10.265 3.003 1.00 0.00 H new ATOM 0 HE1 MET A 24 10.453 -11.719 5.548 1.00 0.00 H new ATOM 0 HE2 MET A 24 9.417 -11.863 4.108 1.00 0.00 H new ATOM 0 HE3 MET A 24 10.975 -12.722 4.173 1.00 0.00 H new ATOM 346 N GLU A 25 7.025 -8.806 1.629 1.00 0.00 N ATOM 347 CA GLU A 25 5.758 -9.070 2.289 1.00 0.00 C ATOM 348 C GLU A 25 5.965 -9.222 3.796 1.00 0.00 C ATOM 349 O GLU A 25 5.017 -9.488 4.533 1.00 0.00 O ATOM 350 CB GLU A 25 5.081 -10.309 1.699 1.00 0.00 C ATOM 351 CG GLU A 25 5.084 -10.260 0.170 1.00 0.00 C ATOM 352 CD GLU A 25 5.435 -11.627 -0.421 1.00 0.00 C ATOM 353 OE1 GLU A 25 4.750 -12.602 -0.044 1.00 0.00 O ATOM 354 OE2 GLU A 25 6.382 -11.666 -1.237 1.00 0.00 O ATOM 0 H GLU A 25 7.303 -7.825 1.618 1.00 0.00 H new ATOM 0 HA GLU A 25 5.098 -8.220 2.118 1.00 0.00 H new ATOM 0 HB2 GLU A 25 5.598 -11.207 2.039 1.00 0.00 H new ATOM 0 HB3 GLU A 25 4.055 -10.375 2.062 1.00 0.00 H new ATOM 0 HG2 GLU A 25 4.104 -9.945 -0.189 1.00 0.00 H new ATOM 0 HG3 GLU A 25 5.803 -9.516 -0.172 1.00 0.00 H new ATOM 359 N ALA A 26 7.211 -9.048 4.210 1.00 0.00 N ATOM 360 CA ALA A 26 7.555 -9.164 5.618 1.00 0.00 C ATOM 361 C ALA A 26 6.777 -8.116 6.416 1.00 0.00 C ATOM 362 O ALA A 26 6.640 -8.233 7.633 1.00 0.00 O ATOM 363 CB ALA A 26 9.069 -9.019 5.787 1.00 0.00 C ATOM 0 H ALA A 26 7.995 -8.828 3.596 1.00 0.00 H new ATOM 0 HA ALA A 26 7.276 -10.145 6.002 1.00 0.00 H new ATOM 0 HB1 ALA A 26 9.327 -9.106 6.842 1.00 0.00 H new ATOM 0 HB2 ALA A 26 9.575 -9.803 5.224 1.00 0.00 H new ATOM 0 HB3 ALA A 26 9.385 -8.044 5.415 1.00 0.00 H new ATOM 369 N MET A 27 6.287 -7.116 5.699 1.00 0.00 N ATOM 370 CA MET A 27 5.526 -6.048 6.325 1.00 0.00 C ATOM 371 C MET A 27 4.137 -5.922 5.696 1.00 0.00 C ATOM 372 O MET A 27 3.275 -5.221 6.221 1.00 0.00 O ATOM 373 CB MET A 27 6.279 -4.725 6.170 1.00 0.00 C ATOM 374 CG MET A 27 7.031 -4.368 7.453 1.00 0.00 C ATOM 375 SD MET A 27 8.114 -5.707 7.918 1.00 0.00 S ATOM 376 CE MET A 27 9.097 -5.841 6.434 1.00 0.00 C ATOM 0 H MET A 27 6.402 -7.023 4.690 1.00 0.00 H new ATOM 0 HA MET A 27 5.405 -6.286 7.382 1.00 0.00 H new ATOM 0 HB2 MET A 27 6.982 -4.798 5.340 1.00 0.00 H new ATOM 0 HB3 MET A 27 5.576 -3.929 5.923 1.00 0.00 H new ATOM 0 HG2 MET A 27 7.610 -3.456 7.303 1.00 0.00 H new ATOM 0 HG3 MET A 27 6.322 -4.167 8.256 1.00 0.00 H new ATOM 0 HE1 MET A 27 9.949 -6.495 6.620 1.00 0.00 H new ATOM 0 HE2 MET A 27 8.489 -6.257 5.631 1.00 0.00 H new ATOM 0 HE3 MET A 27 9.454 -4.853 6.144 1.00 0.00 H new ATOM 384 N LYS A 28 3.963 -6.615 4.580 1.00 0.00 N ATOM 385 CA LYS A 28 2.694 -6.590 3.873 1.00 0.00 C ATOM 386 C LYS A 28 1.886 -7.836 4.241 1.00 0.00 C ATOM 387 O LYS A 28 0.681 -7.892 4.000 1.00 0.00 O ATOM 388 CB LYS A 28 2.921 -6.427 2.368 1.00 0.00 C ATOM 389 CG LYS A 28 2.889 -7.781 1.658 1.00 0.00 C ATOM 390 CD LYS A 28 1.487 -8.090 1.128 1.00 0.00 C ATOM 391 CE LYS A 28 0.921 -6.899 0.350 1.00 0.00 C ATOM 392 NZ LYS A 28 0.008 -6.108 1.205 1.00 0.00 N ATOM 0 H LYS A 28 4.680 -7.197 4.148 1.00 0.00 H new ATOM 0 HA LYS A 28 2.105 -5.725 4.178 1.00 0.00 H new ATOM 0 HB2 LYS A 28 2.154 -5.775 1.950 1.00 0.00 H new ATOM 0 HB3 LYS A 28 3.882 -5.943 2.192 1.00 0.00 H new ATOM 0 HG2 LYS A 28 3.601 -7.780 0.833 1.00 0.00 H new ATOM 0 HG3 LYS A 28 3.202 -8.565 2.348 1.00 0.00 H new ATOM 0 HD2 LYS A 28 1.524 -8.967 0.482 1.00 0.00 H new ATOM 0 HD3 LYS A 28 0.825 -8.334 1.959 1.00 0.00 H new ATOM 0 HE2 LYS A 28 1.736 -6.268 -0.003 1.00 0.00 H new ATOM 0 HE3 LYS A 28 0.387 -7.254 -0.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -0.931 -6.063 0.761 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -0.072 -6.559 2.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 0.385 -5.145 1.317 1.00 0.00 H new ATOM 402 N VAL A 29 2.582 -8.804 4.819 1.00 0.00 N ATOM 403 CA VAL A 29 1.944 -10.046 5.223 1.00 0.00 C ATOM 404 C VAL A 29 2.093 -10.223 6.735 1.00 0.00 C ATOM 405 O VAL A 29 2.116 -11.347 7.232 1.00 0.00 O ATOM 406 CB VAL A 29 2.523 -11.216 4.423 1.00 0.00 C ATOM 407 CG1 VAL A 29 3.812 -11.733 5.065 1.00 0.00 C ATOM 408 CG2 VAL A 29 1.495 -12.338 4.273 1.00 0.00 C ATOM 0 H VAL A 29 3.581 -8.754 5.017 1.00 0.00 H new ATOM 0 HA VAL A 29 0.877 -10.016 5.004 1.00 0.00 H new ATOM 0 HB VAL A 29 2.769 -10.853 3.425 1.00 0.00 H new ATOM 0 HG11 VAL A 29 4.203 -12.564 4.478 1.00 0.00 H new ATOM 0 HG12 VAL A 29 4.550 -10.931 5.096 1.00 0.00 H new ATOM 0 HG13 VAL A 29 3.602 -12.073 6.079 1.00 0.00 H new ATOM 0 HG21 VAL A 29 1.931 -13.157 3.701 1.00 0.00 H new ATOM 0 HG22 VAL A 29 1.204 -12.699 5.259 1.00 0.00 H new ATOM 0 HG23 VAL A 29 0.616 -11.959 3.751 1.00 0.00 H new ATOM 418 N THR A 30 2.192 -9.095 7.423 1.00 0.00 N ATOM 419 CA THR A 30 2.338 -9.112 8.869 1.00 0.00 C ATOM 420 C THR A 30 1.150 -9.824 9.518 1.00 0.00 C ATOM 421 O THR A 30 0.180 -9.184 9.917 1.00 0.00 O ATOM 422 CB THR A 30 2.514 -7.668 9.343 1.00 0.00 C ATOM 423 OG1 THR A 30 3.275 -7.052 8.307 1.00 0.00 O ATOM 424 CG2 THR A 30 3.409 -7.560 10.578 1.00 0.00 C ATOM 0 H THR A 30 2.174 -8.164 7.007 1.00 0.00 H new ATOM 0 HA THR A 30 3.219 -9.678 9.170 1.00 0.00 H new ATOM 0 HB THR A 30 1.537 -7.239 9.566 1.00 0.00 H new ATOM 0 HG1 THR A 30 3.434 -6.112 8.533 1.00 0.00 H new ATOM 0 HG21 THR A 30 3.500 -6.514 10.871 1.00 0.00 H new ATOM 0 HG22 THR A 30 2.969 -8.130 11.397 1.00 0.00 H new ATOM 0 HG23 THR A 30 4.397 -7.959 10.348 1.00 0.00 H new ATOM 432 N SER A 31 1.266 -11.142 9.602 1.00 0.00 N ATOM 433 CA SER A 31 0.213 -11.949 10.194 1.00 0.00 C ATOM 434 C SER A 31 -1.141 -11.567 9.592 1.00 0.00 C ATOM 435 O SER A 31 -2.184 -11.830 10.188 1.00 0.00 O ATOM 436 CB SER A 31 0.183 -11.785 11.715 1.00 0.00 C ATOM 437 OG SER A 31 0.488 -13.003 12.389 1.00 0.00 O ATOM 0 H SER A 31 2.073 -11.670 9.270 1.00 0.00 H new ATOM 0 HA SER A 31 0.419 -12.996 9.972 1.00 0.00 H new ATOM 0 HB2 SER A 31 0.898 -11.018 12.011 1.00 0.00 H new ATOM 0 HB3 SER A 31 -0.803 -11.437 12.023 1.00 0.00 H new ATOM 0 HG SER A 31 0.460 -12.857 13.358 1.00 0.00 H new ATOM 442 N GLU A 32 -1.080 -10.953 8.420 1.00 0.00 N ATOM 443 CA GLU A 32 -2.288 -10.532 7.732 1.00 0.00 C ATOM 444 C GLU A 32 -3.012 -9.454 8.541 1.00 0.00 C ATOM 445 O GLU A 32 -3.096 -8.304 8.115 1.00 0.00 O ATOM 446 CB GLU A 32 -3.208 -11.724 7.460 1.00 0.00 C ATOM 447 CG GLU A 32 -2.412 -12.924 6.941 1.00 0.00 C ATOM 448 CD GLU A 32 -3.335 -13.950 6.282 1.00 0.00 C ATOM 449 OE1 GLU A 32 -3.976 -13.572 5.277 1.00 0.00 O ATOM 450 OE2 GLU A 32 -3.378 -15.088 6.795 1.00 0.00 O ATOM 0 H GLU A 32 -0.212 -10.737 7.929 1.00 0.00 H new ATOM 0 HA GLU A 32 -2.005 -10.107 6.769 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -3.733 -11.999 8.375 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -3.967 -11.443 6.730 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -1.666 -12.586 6.222 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -1.873 -13.391 7.765 1.00 0.00 H new ATOM 455 N GLU A 33 -3.516 -9.865 9.696 1.00 0.00 N ATOM 456 CA GLU A 33 -4.230 -8.949 10.569 1.00 0.00 C ATOM 457 C GLU A 33 -3.441 -7.648 10.732 1.00 0.00 C ATOM 458 O GLU A 33 -4.017 -6.561 10.697 1.00 0.00 O ATOM 459 CB GLU A 33 -4.512 -9.594 11.927 1.00 0.00 C ATOM 460 CG GLU A 33 -6.000 -9.910 12.087 1.00 0.00 C ATOM 461 CD GLU A 33 -6.264 -10.664 13.392 1.00 0.00 C ATOM 462 OE1 GLU A 33 -5.700 -11.770 13.532 1.00 0.00 O ATOM 463 OE2 GLU A 33 -7.025 -10.116 14.220 1.00 0.00 O ATOM 0 H GLU A 33 -3.444 -10.820 10.047 1.00 0.00 H new ATOM 0 HA GLU A 33 -5.190 -8.713 10.110 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -3.930 -10.510 12.026 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -4.191 -8.924 12.725 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -6.575 -8.984 12.075 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -6.341 -10.508 11.242 1.00 0.00 H new ATOM 468 N LYS A 34 -2.138 -7.802 10.907 1.00 0.00 N ATOM 469 CA LYS A 34 -1.264 -6.652 11.076 1.00 0.00 C ATOM 470 C LYS A 34 -0.699 -6.243 9.714 1.00 0.00 C ATOM 471 O LYS A 34 -0.232 -5.118 9.545 1.00 0.00 O ATOM 472 CB LYS A 34 -0.190 -6.946 12.124 1.00 0.00 C ATOM 473 CG LYS A 34 -0.808 -7.098 13.516 1.00 0.00 C ATOM 474 CD LYS A 34 0.252 -7.485 14.548 1.00 0.00 C ATOM 475 CE LYS A 34 -0.071 -6.884 15.917 1.00 0.00 C ATOM 476 NZ LYS A 34 -1.159 -7.642 16.573 1.00 0.00 N ATOM 0 H LYS A 34 -1.665 -8.705 10.936 1.00 0.00 H new ATOM 0 HA LYS A 34 -1.825 -5.799 11.458 1.00 0.00 H new ATOM 0 HB2 LYS A 34 0.343 -7.859 11.857 1.00 0.00 H new ATOM 0 HB3 LYS A 34 0.544 -6.140 12.134 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -1.283 -6.162 13.811 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -1.589 -7.858 13.490 1.00 0.00 H new ATOM 0 HD2 LYS A 34 0.308 -8.571 14.627 1.00 0.00 H new ATOM 0 HD3 LYS A 34 1.231 -7.139 14.217 1.00 0.00 H new ATOM 0 HE2 LYS A 34 0.819 -6.897 16.546 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -0.365 -5.841 15.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -1.365 -7.220 17.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -2.013 -7.608 15.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -0.865 -8.631 16.700 1.00 0.00 H new ATOM 486 N GLU A 35 -0.759 -7.179 8.778 1.00 0.00 N ATOM 487 CA GLU A 35 -0.260 -6.929 7.437 1.00 0.00 C ATOM 488 C GLU A 35 -1.015 -5.762 6.797 1.00 0.00 C ATOM 489 O GLU A 35 -0.496 -5.097 5.902 1.00 0.00 O ATOM 490 CB GLU A 35 -0.358 -8.187 6.571 1.00 0.00 C ATOM 491 CG GLU A 35 -1.511 -8.074 5.570 1.00 0.00 C ATOM 492 CD GLU A 35 -1.409 -9.157 4.495 1.00 0.00 C ATOM 493 OE1 GLU A 35 -1.236 -10.332 4.887 1.00 0.00 O ATOM 494 OE2 GLU A 35 -1.508 -8.788 3.305 1.00 0.00 O ATOM 0 H GLU A 35 -1.146 -8.112 8.922 1.00 0.00 H new ATOM 0 HA GLU A 35 0.793 -6.658 7.508 1.00 0.00 H new ATOM 0 HB2 GLU A 35 0.579 -8.339 6.036 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -0.507 -9.060 7.207 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -2.463 -8.164 6.094 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -1.497 -7.089 5.102 1.00 0.00 H new ATOM 499 N GLN A 36 -2.231 -5.550 7.281 1.00 0.00 N ATOM 500 CA GLN A 36 -3.063 -4.476 6.767 1.00 0.00 C ATOM 501 C GLN A 36 -3.407 -3.490 7.886 1.00 0.00 C ATOM 502 O GLN A 36 -3.526 -2.290 7.645 1.00 0.00 O ATOM 503 CB GLN A 36 -4.332 -5.029 6.115 1.00 0.00 C ATOM 504 CG GLN A 36 -5.083 -5.955 7.074 1.00 0.00 C ATOM 505 CD GLN A 36 -5.777 -5.154 8.177 1.00 0.00 C ATOM 506 OE1 GLN A 36 -5.931 -3.946 8.101 1.00 0.00 O ATOM 507 NE2 GLN A 36 -6.188 -5.892 9.205 1.00 0.00 N ATOM 0 H GLN A 36 -2.659 -6.104 8.023 1.00 0.00 H new ATOM 0 HA GLN A 36 -2.502 -3.944 5.999 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -4.981 -4.205 5.817 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -4.071 -5.574 5.208 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -5.822 -6.535 6.521 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -4.387 -6.666 7.519 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -6.028 -6.899 9.206 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -6.664 -5.450 9.992 1.00 0.00 H new ATOM 514 N LEU A 37 -3.558 -4.033 9.085 1.00 0.00 N ATOM 515 CA LEU A 37 -3.885 -3.217 10.241 1.00 0.00 C ATOM 516 C LEU A 37 -2.686 -2.336 10.595 1.00 0.00 C ATOM 517 O LEU A 37 -2.775 -1.110 10.541 1.00 0.00 O ATOM 518 CB LEU A 37 -4.366 -4.095 11.398 1.00 0.00 C ATOM 519 CG LEU A 37 -4.914 -3.355 12.620 1.00 0.00 C ATOM 520 CD1 LEU A 37 -6.430 -3.524 12.731 1.00 0.00 C ATOM 521 CD2 LEU A 37 -4.193 -3.794 13.896 1.00 0.00 C ATOM 0 H LEU A 37 -3.460 -5.029 9.281 1.00 0.00 H new ATOM 0 HA LEU A 37 -4.715 -2.548 10.012 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -5.143 -4.761 11.023 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -3.536 -4.723 11.721 1.00 0.00 H new ATOM 0 HG LEU A 37 -4.719 -2.291 12.490 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -6.793 -2.988 13.608 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -6.907 -3.122 11.837 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -6.672 -4.582 12.827 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -4.602 -3.253 14.749 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -4.334 -4.865 14.044 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -3.129 -3.578 13.805 1.00 0.00 H new ATOM 532 N SER A 38 -1.592 -2.995 10.947 1.00 0.00 N ATOM 533 CA SER A 38 -0.376 -2.287 11.310 1.00 0.00 C ATOM 534 C SER A 38 0.252 -1.655 10.065 1.00 0.00 C ATOM 535 O SER A 38 1.098 -0.769 10.174 1.00 0.00 O ATOM 536 CB SER A 38 0.624 -3.222 11.993 1.00 0.00 C ATOM 537 OG SER A 38 0.260 -3.499 13.342 1.00 0.00 O ATOM 0 H SER A 38 -1.522 -4.012 10.989 1.00 0.00 H new ATOM 0 HA SER A 38 -0.637 -1.500 12.018 1.00 0.00 H new ATOM 0 HB2 SER A 38 0.686 -4.156 11.435 1.00 0.00 H new ATOM 0 HB3 SER A 38 1.616 -2.771 11.970 1.00 0.00 H new ATOM 0 HG SER A 38 0.922 -4.100 13.743 1.00 0.00 H new ATOM 542 N THR A 39 -0.185 -2.137 8.911 1.00 0.00 N ATOM 543 CA THR A 39 0.324 -1.632 7.647 1.00 0.00 C ATOM 544 C THR A 39 -0.553 -0.485 7.140 1.00 0.00 C ATOM 545 O THR A 39 -0.168 0.235 6.221 1.00 0.00 O ATOM 546 CB THR A 39 0.414 -2.805 6.671 1.00 0.00 C ATOM 547 OG1 THR A 39 0.845 -3.897 7.479 1.00 0.00 O ATOM 548 CG2 THR A 39 1.540 -2.632 5.649 1.00 0.00 C ATOM 0 H THR A 39 -0.886 -2.872 8.825 1.00 0.00 H new ATOM 0 HA THR A 39 1.322 -1.210 7.762 1.00 0.00 H new ATOM 0 HB THR A 39 -0.537 -2.916 6.149 1.00 0.00 H new ATOM 0 HG1 THR A 39 1.646 -4.300 7.084 1.00 0.00 H new ATOM 0 HG21 THR A 39 1.560 -3.493 4.980 1.00 0.00 H new ATOM 0 HG22 THR A 39 1.369 -1.725 5.069 1.00 0.00 H new ATOM 0 HG23 THR A 39 2.495 -2.555 6.169 1.00 0.00 H new ATOM 556 N ALA A 40 -1.716 -0.351 7.762 1.00 0.00 N ATOM 557 CA ALA A 40 -2.650 0.695 7.385 1.00 0.00 C ATOM 558 C ALA A 40 -2.906 1.603 8.589 1.00 0.00 C ATOM 559 O ALA A 40 -3.706 2.533 8.511 1.00 0.00 O ATOM 560 CB ALA A 40 -3.936 0.063 6.847 1.00 0.00 C ATOM 0 H ALA A 40 -2.032 -0.950 8.525 1.00 0.00 H new ATOM 0 HA ALA A 40 -2.233 1.312 6.589 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -4.637 0.849 6.564 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -3.704 -0.548 5.974 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -4.384 -0.563 7.619 1.00 0.00 H new ATOM 566 N ILE A 41 -2.210 1.301 9.675 1.00 0.00 N ATOM 567 CA ILE A 41 -2.352 2.078 10.895 1.00 0.00 C ATOM 568 C ILE A 41 -0.986 2.638 11.299 1.00 0.00 C ATOM 569 O ILE A 41 -0.886 3.785 11.734 1.00 0.00 O ATOM 570 CB ILE A 41 -3.021 1.244 11.988 1.00 0.00 C ATOM 571 CG1 ILE A 41 -4.453 0.873 11.596 1.00 0.00 C ATOM 572 CG2 ILE A 41 -2.963 1.959 13.338 1.00 0.00 C ATOM 573 CD1 ILE A 41 -5.131 0.057 12.699 1.00 0.00 C ATOM 0 H ILE A 41 -1.546 0.529 9.736 1.00 0.00 H new ATOM 0 HA ILE A 41 -3.011 2.930 10.729 1.00 0.00 H new ATOM 0 HB ILE A 41 -2.465 0.313 12.094 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -5.027 1.779 11.404 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -4.443 0.300 10.669 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -3.446 1.343 14.097 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -1.923 2.128 13.616 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -3.479 2.916 13.265 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -6.147 -0.193 12.394 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -4.568 -0.860 12.871 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -5.162 0.642 13.618 1.00 0.00 H new ATOM 584 N ASP A 42 0.031 1.804 11.142 1.00 0.00 N ATOM 585 CA ASP A 42 1.385 2.201 11.484 1.00 0.00 C ATOM 586 C ASP A 42 1.484 3.728 11.464 1.00 0.00 C ATOM 587 O ASP A 42 1.575 4.362 12.514 1.00 0.00 O ATOM 588 CB ASP A 42 2.394 1.650 10.475 1.00 0.00 C ATOM 589 CG ASP A 42 3.445 0.704 11.062 1.00 0.00 C ATOM 590 OD1 ASP A 42 3.049 -0.418 11.443 1.00 0.00 O ATOM 591 OD2 ASP A 42 4.620 1.126 11.116 1.00 0.00 O ATOM 0 H ASP A 42 -0.056 0.854 10.782 1.00 0.00 H new ATOM 0 HA ASP A 42 1.612 1.804 12.474 1.00 0.00 H new ATOM 0 HB2 ASP A 42 1.850 1.123 9.691 1.00 0.00 H new ATOM 0 HB3 ASP A 42 2.905 2.488 10.001 1.00 0.00 H new ATOM 595 N ARG A 43 1.465 4.275 10.257 1.00 0.00 N ATOM 596 CA ARG A 43 1.551 5.716 10.086 1.00 0.00 C ATOM 597 C ARG A 43 0.414 6.213 9.193 1.00 0.00 C ATOM 598 O ARG A 43 0.231 7.418 9.027 1.00 0.00 O ATOM 599 CB ARG A 43 2.891 6.116 9.466 1.00 0.00 C ATOM 600 CG ARG A 43 4.049 5.809 10.416 1.00 0.00 C ATOM 601 CD ARG A 43 4.063 6.780 11.598 1.00 0.00 C ATOM 602 NE ARG A 43 4.551 6.092 12.813 1.00 0.00 N ATOM 603 CZ ARG A 43 4.578 6.647 14.032 1.00 0.00 C ATOM 604 NH1 ARG A 43 4.142 7.903 14.206 1.00 0.00 N ATOM 605 NH2 ARG A 43 5.039 5.948 15.078 1.00 0.00 N ATOM 0 H ARG A 43 1.391 3.746 9.388 1.00 0.00 H new ATOM 0 HA ARG A 43 1.468 6.174 11.072 1.00 0.00 H new ATOM 0 HB2 ARG A 43 3.035 5.581 8.527 1.00 0.00 H new ATOM 0 HB3 ARG A 43 2.883 7.180 9.229 1.00 0.00 H new ATOM 0 HG2 ARG A 43 3.962 4.786 10.782 1.00 0.00 H new ATOM 0 HG3 ARG A 43 4.994 5.875 9.876 1.00 0.00 H new ATOM 0 HD2 ARG A 43 4.703 7.633 11.371 1.00 0.00 H new ATOM 0 HD3 ARG A 43 3.060 7.171 11.770 1.00 0.00 H new ATOM 0 HE ARG A 43 4.888 5.134 12.717 1.00 0.00 H new ATOM 0 HH11 ARG A 43 3.790 8.435 13.410 1.00 0.00 H new ATOM 0 HH12 ARG A 43 4.162 8.326 15.134 1.00 0.00 H new ATOM 0 HH21 ARG A 43 5.370 4.992 14.947 1.00 0.00 H new ATOM 0 HH22 ARG A 43 5.059 6.372 16.006 1.00 0.00 H new ATOM 616 N MET A 44 -0.323 5.260 8.640 1.00 0.00 N ATOM 617 CA MET A 44 -1.438 5.587 7.767 1.00 0.00 C ATOM 618 C MET A 44 -2.573 6.247 8.553 1.00 0.00 C ATOM 619 O MET A 44 -3.450 6.882 7.967 1.00 0.00 O ATOM 620 CB MET A 44 -1.954 4.310 7.099 1.00 0.00 C ATOM 621 CG MET A 44 -1.163 3.999 5.827 1.00 0.00 C ATOM 622 SD MET A 44 -2.166 3.041 4.703 1.00 0.00 S ATOM 623 CE MET A 44 -1.032 2.885 3.333 1.00 0.00 C ATOM 0 H MET A 44 -0.170 4.261 8.780 1.00 0.00 H new ATOM 0 HA MET A 44 -1.090 6.289 7.009 1.00 0.00 H new ATOM 0 HB2 MET A 44 -1.875 3.474 7.794 1.00 0.00 H new ATOM 0 HB3 MET A 44 -3.010 4.424 6.856 1.00 0.00 H new ATOM 0 HG2 MET A 44 -0.850 4.927 5.348 1.00 0.00 H new ATOM 0 HG3 MET A 44 -0.257 3.448 6.078 1.00 0.00 H new ATOM 0 HE1 MET A 44 -1.502 2.309 2.536 1.00 0.00 H new ATOM 0 HE2 MET A 44 -0.773 3.876 2.961 1.00 0.00 H new ATOM 0 HE3 MET A 44 -0.128 2.374 3.665 1.00 0.00 H new ATOM 631 N ASN A 45 -2.520 6.075 9.865 1.00 0.00 N ATOM 632 CA ASN A 45 -3.533 6.647 10.736 1.00 0.00 C ATOM 633 C ASN A 45 -3.570 8.164 10.542 1.00 0.00 C ATOM 634 O ASN A 45 -4.288 8.665 9.678 1.00 0.00 O ATOM 635 CB ASN A 45 -3.217 6.366 12.206 1.00 0.00 C ATOM 636 CG ASN A 45 -4.047 7.263 13.126 1.00 0.00 C ATOM 637 OD1 ASN A 45 -3.626 7.651 14.204 1.00 0.00 O ATOM 638 ND2 ASN A 45 -5.248 7.570 12.644 1.00 0.00 N ATOM 0 H ASN A 45 -1.792 5.548 10.347 1.00 0.00 H new ATOM 0 HA ASN A 45 -4.491 6.195 10.480 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -3.421 5.319 12.432 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -2.156 6.531 12.392 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -5.878 8.163 13.184 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -5.539 7.212 11.734 1.00 0.00 H new ATOM 644 N GLU A 46 -2.787 8.852 11.359 1.00 0.00 N ATOM 645 CA GLU A 46 -2.721 10.302 11.288 1.00 0.00 C ATOM 646 C GLU A 46 -1.788 10.736 10.155 1.00 0.00 C ATOM 647 O GLU A 46 -1.830 11.885 9.718 1.00 0.00 O ATOM 648 CB GLU A 46 -2.271 10.896 12.625 1.00 0.00 C ATOM 649 CG GLU A 46 -3.473 11.183 13.528 1.00 0.00 C ATOM 650 CD GLU A 46 -3.567 12.674 13.858 1.00 0.00 C ATOM 651 OE1 GLU A 46 -3.589 13.468 12.893 1.00 0.00 O ATOM 652 OE2 GLU A 46 -3.616 12.986 15.067 1.00 0.00 O ATOM 0 H GLU A 46 -2.193 8.432 12.074 1.00 0.00 H new ATOM 0 HA GLU A 46 -3.720 10.682 11.076 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -1.593 10.204 13.125 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -1.715 11.817 12.449 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -4.389 10.858 13.035 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -3.386 10.608 14.450 1.00 0.00 H new ATOM 657 N GLY A 47 -0.971 9.793 9.710 1.00 0.00 N ATOM 658 CA GLY A 47 -0.031 10.063 8.636 1.00 0.00 C ATOM 659 C GLY A 47 -0.747 10.137 7.286 1.00 0.00 C ATOM 660 O GLY A 47 -0.470 11.024 6.480 1.00 0.00 O ATOM 0 H GLY A 47 -0.941 8.841 10.074 1.00 0.00 H new ATOM 0 HA2 GLY A 47 0.487 11.003 8.829 1.00 0.00 H new ATOM 0 HA3 GLY A 47 0.728 9.281 8.607 1.00 0.00 H new ATOM 664 N LEU A 48 -1.654 9.193 7.081 1.00 0.00 N ATOM 665 CA LEU A 48 -2.413 9.141 5.843 1.00 0.00 C ATOM 666 C LEU A 48 -3.294 10.387 5.736 1.00 0.00 C ATOM 667 O LEU A 48 -3.422 10.972 4.661 1.00 0.00 O ATOM 668 CB LEU A 48 -3.191 7.827 5.746 1.00 0.00 C ATOM 669 CG LEU A 48 -3.589 7.385 4.337 1.00 0.00 C ATOM 670 CD1 LEU A 48 -3.897 8.592 3.450 1.00 0.00 C ATOM 671 CD2 LEU A 48 -2.518 6.481 3.724 1.00 0.00 C ATOM 0 H LEU A 48 -1.880 8.458 7.751 1.00 0.00 H new ATOM 0 HA LEU A 48 -1.742 9.151 4.984 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -2.589 7.038 6.196 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -4.097 7.919 6.346 1.00 0.00 H new ATOM 0 HG LEU A 48 -4.504 6.797 4.409 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -4.177 8.249 2.454 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -4.720 9.161 3.883 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -3.014 9.227 3.380 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -2.825 6.181 2.722 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -1.574 7.023 3.667 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -2.391 5.595 4.346 1.00 0.00 H new ATOM 682 N ASP A 49 -3.880 10.758 6.866 1.00 0.00 N ATOM 683 CA ASP A 49 -4.745 11.924 6.912 1.00 0.00 C ATOM 684 C ASP A 49 -3.927 13.175 6.588 1.00 0.00 C ATOM 685 O ASP A 49 -4.387 14.051 5.857 1.00 0.00 O ATOM 686 CB ASP A 49 -5.352 12.103 8.305 1.00 0.00 C ATOM 687 CG ASP A 49 -5.844 13.518 8.619 1.00 0.00 C ATOM 688 OD1 ASP A 49 -4.977 14.363 8.931 1.00 0.00 O ATOM 689 OD2 ASP A 49 -7.074 13.722 8.538 1.00 0.00 O ATOM 0 H ASP A 49 -3.772 10.271 7.756 1.00 0.00 H new ATOM 0 HA ASP A 49 -5.544 11.780 6.185 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -6.188 11.412 8.412 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -4.607 11.820 9.049 1.00 0.00 H new ATOM 693 N ALA A 50 -2.727 13.219 7.148 1.00 0.00 N ATOM 694 CA ALA A 50 -1.839 14.349 6.928 1.00 0.00 C ATOM 695 C ALA A 50 -1.115 14.170 5.592 1.00 0.00 C ATOM 696 O ALA A 50 -1.397 14.881 4.629 1.00 0.00 O ATOM 697 CB ALA A 50 -0.869 14.472 8.104 1.00 0.00 C ATOM 0 H ALA A 50 -2.349 12.491 7.754 1.00 0.00 H new ATOM 0 HA ALA A 50 -2.406 15.278 6.874 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -0.203 15.319 7.939 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -1.431 14.626 9.025 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -0.280 13.558 8.187 1.00 0.00 H new ATOM 703 N PHE A 51 -0.197 13.216 5.576 1.00 0.00 N ATOM 704 CA PHE A 51 0.569 12.935 4.374 1.00 0.00 C ATOM 705 C PHE A 51 -0.280 13.147 3.120 1.00 0.00 C ATOM 706 O PHE A 51 0.184 13.733 2.143 1.00 0.00 O ATOM 707 CB PHE A 51 0.993 11.466 4.447 1.00 0.00 C ATOM 708 CG PHE A 51 1.881 11.132 5.646 1.00 0.00 C ATOM 709 CD1 PHE A 51 2.735 12.068 6.141 1.00 0.00 C ATOM 710 CD2 PHE A 51 1.816 9.900 6.218 1.00 0.00 C ATOM 711 CE1 PHE A 51 3.559 11.758 7.255 1.00 0.00 C ATOM 712 CE2 PHE A 51 2.640 9.590 7.332 1.00 0.00 C ATOM 713 CZ PHE A 51 3.494 10.526 7.827 1.00 0.00 C ATOM 0 H PHE A 51 0.034 12.627 6.376 1.00 0.00 H new ATOM 0 HA PHE A 51 1.428 13.604 4.315 1.00 0.00 H new ATOM 0 HB2 PHE A 51 0.100 10.843 4.485 1.00 0.00 H new ATOM 0 HB3 PHE A 51 1.524 11.206 3.531 1.00 0.00 H new ATOM 0 HD1 PHE A 51 2.786 13.047 5.687 1.00 0.00 H new ATOM 0 HD2 PHE A 51 1.138 9.157 5.825 1.00 0.00 H new ATOM 0 HE1 PHE A 51 4.237 12.501 7.648 1.00 0.00 H new ATOM 0 HE2 PHE A 51 2.589 8.611 7.786 1.00 0.00 H new ATOM 0 HZ PHE A 51 4.121 10.291 8.675 1.00 0.00 H new ATOM 722 N ILE A 52 -1.510 12.660 3.188 1.00 0.00 N ATOM 723 CA ILE A 52 -2.429 12.790 2.070 1.00 0.00 C ATOM 724 C ILE A 52 -2.737 14.270 1.837 1.00 0.00 C ATOM 725 O ILE A 52 -2.650 14.757 0.710 1.00 0.00 O ATOM 726 CB ILE A 52 -3.675 11.931 2.298 1.00 0.00 C ATOM 727 CG1 ILE A 52 -4.343 11.570 0.969 1.00 0.00 C ATOM 728 CG2 ILE A 52 -4.646 12.619 3.259 1.00 0.00 C ATOM 729 CD1 ILE A 52 -5.110 12.765 0.398 1.00 0.00 C ATOM 0 H ILE A 52 -1.892 12.175 4.000 1.00 0.00 H new ATOM 0 HA ILE A 52 -1.972 12.412 1.156 1.00 0.00 H new ATOM 0 HB ILE A 52 -3.365 10.997 2.767 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -3.587 11.244 0.255 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -5.025 10.732 1.116 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -5.523 11.988 3.404 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -4.154 12.783 4.218 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -4.954 13.577 2.841 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -5.575 12.481 -0.546 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -5.881 13.073 1.104 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -4.421 13.592 0.229 1.00 0.00 H new ATOM 740 N GLN A 53 -3.089 14.947 2.921 1.00 0.00 N ATOM 741 CA GLN A 53 -3.410 16.362 2.849 1.00 0.00 C ATOM 742 C GLN A 53 -2.152 17.176 2.541 1.00 0.00 C ATOM 743 O GLN A 53 -2.230 18.383 2.315 1.00 0.00 O ATOM 744 CB GLN A 53 -4.069 16.841 4.144 1.00 0.00 C ATOM 745 CG GLN A 53 -4.343 18.346 4.096 1.00 0.00 C ATOM 746 CD GLN A 53 -5.740 18.667 4.631 1.00 0.00 C ATOM 747 OE1 GLN A 53 -6.293 17.960 5.457 1.00 0.00 O ATOM 748 NE2 GLN A 53 -6.277 19.768 4.115 1.00 0.00 N ATOM 0 H GLN A 53 -3.159 14.541 3.854 1.00 0.00 H new ATOM 0 HA GLN A 53 -4.124 16.512 2.039 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -5.004 16.302 4.301 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -3.423 16.612 4.991 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -3.594 18.874 4.685 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -4.252 18.703 3.070 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -5.759 20.314 3.427 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -7.207 20.067 4.407 1.00 0.00 H new ATOM 755 N LEU A 54 -1.023 16.484 2.538 1.00 0.00 N ATOM 756 CA LEU A 54 0.250 17.128 2.261 1.00 0.00 C ATOM 757 C LEU A 54 0.710 16.750 0.851 1.00 0.00 C ATOM 758 O LEU A 54 1.341 17.553 0.165 1.00 0.00 O ATOM 759 CB LEU A 54 1.269 16.792 3.351 1.00 0.00 C ATOM 760 CG LEU A 54 1.412 17.819 4.475 1.00 0.00 C ATOM 761 CD1 LEU A 54 0.681 17.358 5.737 1.00 0.00 C ATOM 762 CD2 LEU A 54 2.886 18.131 4.748 1.00 0.00 C ATOM 0 H LEU A 54 -0.963 15.483 2.723 1.00 0.00 H new ATOM 0 HA LEU A 54 0.142 18.212 2.282 1.00 0.00 H new ATOM 0 HB2 LEU A 54 0.995 15.834 3.794 1.00 0.00 H new ATOM 0 HB3 LEU A 54 2.243 16.659 2.881 1.00 0.00 H new ATOM 0 HG LEU A 54 0.940 18.747 4.151 1.00 0.00 H new ATOM 0 HD11 LEU A 54 0.799 18.107 6.520 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -0.378 17.227 5.517 1.00 0.00 H new ATOM 0 HD13 LEU A 54 1.101 16.410 6.075 1.00 0.00 H new ATOM 0 HD21 LEU A 54 2.960 18.864 5.551 1.00 0.00 H new ATOM 0 HD22 LEU A 54 3.403 17.217 5.041 1.00 0.00 H new ATOM 0 HD23 LEU A 54 3.346 18.534 3.846 1.00 0.00 H new ATOM 773 N TYR A 55 0.377 15.528 0.461 1.00 0.00 N ATOM 774 CA TYR A 55 0.749 15.035 -0.854 1.00 0.00 C ATOM 775 C TYR A 55 -0.488 14.622 -1.654 1.00 0.00 C ATOM 776 O TYR A 55 -0.795 15.222 -2.684 1.00 0.00 O ATOM 777 CB TYR A 55 1.620 13.802 -0.612 1.00 0.00 C ATOM 778 CG TYR A 55 2.945 14.105 0.091 1.00 0.00 C ATOM 779 CD1 TYR A 55 3.950 14.765 -0.585 1.00 0.00 C ATOM 780 CD2 TYR A 55 3.135 13.717 1.402 1.00 0.00 C ATOM 781 CE1 TYR A 55 5.197 15.051 0.077 1.00 0.00 C ATOM 782 CE2 TYR A 55 4.382 14.001 2.063 1.00 0.00 C ATOM 783 CZ TYR A 55 5.352 14.654 1.368 1.00 0.00 C ATOM 784 OH TYR A 55 6.529 14.923 1.993 1.00 0.00 O ATOM 0 H TYR A 55 -0.146 14.865 1.033 1.00 0.00 H new ATOM 0 HA TYR A 55 1.268 15.808 -1.421 1.00 0.00 H new ATOM 0 HB2 TYR A 55 1.058 13.085 -0.013 1.00 0.00 H new ATOM 0 HB3 TYR A 55 1.829 13.324 -1.569 1.00 0.00 H new ATOM 0 HD1 TYR A 55 3.802 15.067 -1.611 1.00 0.00 H new ATOM 0 HD2 TYR A 55 2.348 13.200 1.932 1.00 0.00 H new ATOM 0 HE1 TYR A 55 5.991 15.569 -0.441 1.00 0.00 H new ATOM 0 HE2 TYR A 55 4.544 13.702 3.088 1.00 0.00 H new ATOM 0 HH TYR A 55 6.497 14.582 2.911 1.00 0.00 H new ATOM 793 N ASN A 56 -1.164 13.601 -1.151 1.00 0.00 N ATOM 794 CA ASN A 56 -2.361 13.100 -1.806 1.00 0.00 C ATOM 795 C ASN A 56 -2.438 11.582 -1.628 1.00 0.00 C ATOM 796 O ASN A 56 -3.478 10.976 -1.880 1.00 0.00 O ATOM 797 CB ASN A 56 -2.334 13.399 -3.306 1.00 0.00 C ATOM 798 CG ASN A 56 -3.360 12.547 -4.054 1.00 0.00 C ATOM 799 OD1 ASN A 56 -4.461 12.303 -3.587 1.00 0.00 O ATOM 800 ND2 ASN A 56 -2.941 12.109 -5.238 1.00 0.00 N ATOM 0 H ASN A 56 -0.906 13.106 -0.297 1.00 0.00 H new ATOM 0 HA ASN A 56 -3.223 13.592 -1.355 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -2.542 14.456 -3.473 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -1.337 13.204 -3.701 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -3.554 11.532 -5.814 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -2.007 12.350 -5.570 1.00 0.00 H new ATOM 806 N GLU A 57 -1.324 11.012 -1.194 1.00 0.00 N ATOM 807 CA GLU A 57 -1.251 9.577 -0.979 1.00 0.00 C ATOM 808 C GLU A 57 -1.145 8.845 -2.319 1.00 0.00 C ATOM 809 O GLU A 57 -1.496 7.670 -2.417 1.00 0.00 O ATOM 810 CB GLU A 57 -2.456 9.082 -0.177 1.00 0.00 C ATOM 811 CG GLU A 57 -2.333 7.588 0.130 1.00 0.00 C ATOM 812 CD GLU A 57 -0.881 7.204 0.417 1.00 0.00 C ATOM 813 OE1 GLU A 57 -0.081 7.251 -0.542 1.00 0.00 O ATOM 814 OE2 GLU A 57 -0.602 6.873 1.590 1.00 0.00 O ATOM 0 H GLU A 57 -0.464 11.518 -0.985 1.00 0.00 H new ATOM 0 HA GLU A 57 -0.355 9.360 -0.397 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -2.533 9.643 0.754 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -3.372 9.268 -0.738 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -2.956 7.337 0.989 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -2.706 7.008 -0.714 1.00 0.00 H new ATOM 819 N SER A 58 -0.660 9.569 -3.316 1.00 0.00 N ATOM 820 CA SER A 58 -0.504 9.002 -4.645 1.00 0.00 C ATOM 821 C SER A 58 0.890 9.325 -5.191 1.00 0.00 C ATOM 822 O SER A 58 1.461 8.541 -5.945 1.00 0.00 O ATOM 823 CB SER A 58 -1.581 9.525 -5.597 1.00 0.00 C ATOM 824 OG SER A 58 -2.000 8.530 -6.527 1.00 0.00 O ATOM 0 H SER A 58 -0.370 10.543 -3.231 1.00 0.00 H new ATOM 0 HA SER A 58 -0.617 7.920 -4.571 1.00 0.00 H new ATOM 0 HB2 SER A 58 -2.440 9.867 -5.020 1.00 0.00 H new ATOM 0 HB3 SER A 58 -1.197 10.389 -6.139 1.00 0.00 H new ATOM 0 HG SER A 58 -2.689 8.902 -7.116 1.00 0.00 H new ATOM 829 N GLU A 59 1.394 10.482 -4.787 1.00 0.00 N ATOM 830 CA GLU A 59 2.709 10.918 -5.227 1.00 0.00 C ATOM 831 C GLU A 59 3.687 10.923 -4.050 1.00 0.00 C ATOM 832 O GLU A 59 4.782 10.373 -4.146 1.00 0.00 O ATOM 833 CB GLU A 59 2.637 12.297 -5.886 1.00 0.00 C ATOM 834 CG GLU A 59 1.490 13.125 -5.303 1.00 0.00 C ATOM 835 CD GLU A 59 0.178 12.839 -6.038 1.00 0.00 C ATOM 836 OE1 GLU A 59 0.180 11.893 -6.855 1.00 0.00 O ATOM 837 OE2 GLU A 59 -0.796 13.574 -5.765 1.00 0.00 O ATOM 0 H GLU A 59 0.916 11.130 -4.161 1.00 0.00 H new ATOM 0 HA GLU A 59 3.073 10.213 -5.974 1.00 0.00 H new ATOM 0 HB2 GLU A 59 3.580 12.823 -5.740 1.00 0.00 H new ATOM 0 HB3 GLU A 59 2.498 12.183 -6.961 1.00 0.00 H new ATOM 0 HG2 GLU A 59 1.374 12.897 -4.243 1.00 0.00 H new ATOM 0 HG3 GLU A 59 1.729 14.186 -5.377 1.00 0.00 H new ATOM 842 N ILE A 60 3.256 11.552 -2.966 1.00 0.00 N ATOM 843 CA ILE A 60 4.080 11.637 -1.773 1.00 0.00 C ATOM 844 C ILE A 60 5.222 12.625 -2.015 1.00 0.00 C ATOM 845 O ILE A 60 6.071 12.823 -1.148 1.00 0.00 O ATOM 846 CB ILE A 60 4.550 10.245 -1.347 1.00 0.00 C ATOM 847 CG1 ILE A 60 3.361 9.318 -1.093 1.00 0.00 C ATOM 848 CG2 ILE A 60 5.481 10.328 -0.136 1.00 0.00 C ATOM 849 CD1 ILE A 60 2.614 9.016 -2.394 1.00 0.00 C ATOM 0 H ILE A 60 2.347 12.008 -2.890 1.00 0.00 H new ATOM 0 HA ILE A 60 3.499 12.022 -0.935 1.00 0.00 H new ATOM 0 HB ILE A 60 5.125 9.813 -2.166 1.00 0.00 H new ATOM 0 HG12 ILE A 60 3.710 8.387 -0.645 1.00 0.00 H new ATOM 0 HG13 ILE A 60 2.681 9.781 -0.378 1.00 0.00 H new ATOM 0 HG21 ILE A 60 5.801 9.325 0.147 1.00 0.00 H new ATOM 0 HG22 ILE A 60 6.354 10.929 -0.389 1.00 0.00 H new ATOM 0 HG23 ILE A 60 4.952 10.789 0.698 1.00 0.00 H new ATOM 0 HD11 ILE A 60 1.773 8.355 -2.186 1.00 0.00 H new ATOM 0 HD12 ILE A 60 2.246 9.946 -2.826 1.00 0.00 H new ATOM 0 HD13 ILE A 60 3.291 8.532 -3.098 1.00 0.00 H new ATOM 860 N ASP A 61 5.207 13.220 -3.199 1.00 0.00 N ATOM 861 CA ASP A 61 6.231 14.183 -3.568 1.00 0.00 C ATOM 862 C ASP A 61 5.708 15.598 -3.316 1.00 0.00 C ATOM 863 O ASP A 61 6.266 16.334 -2.504 1.00 0.00 O ATOM 864 CB ASP A 61 6.587 14.067 -5.051 1.00 0.00 C ATOM 865 CG ASP A 61 7.914 14.717 -5.449 1.00 0.00 C ATOM 866 OD1 ASP A 61 8.960 14.116 -5.128 1.00 0.00 O ATOM 867 OD2 ASP A 61 7.850 15.803 -6.067 1.00 0.00 O ATOM 0 H ASP A 61 4.501 13.053 -3.916 1.00 0.00 H new ATOM 0 HA ASP A 61 7.118 13.980 -2.968 1.00 0.00 H new ATOM 0 HB2 ASP A 61 6.622 13.011 -5.320 1.00 0.00 H new ATOM 0 HB3 ASP A 61 5.787 14.519 -5.638 1.00 0.00 H new ATOM 871 N GLU A 62 4.642 15.936 -4.028 1.00 0.00 N ATOM 872 CA GLU A 62 4.037 17.250 -3.891 1.00 0.00 C ATOM 873 C GLU A 62 3.312 17.637 -5.181 1.00 0.00 C ATOM 874 O GLU A 62 2.106 17.877 -5.170 1.00 0.00 O ATOM 875 CB GLU A 62 5.086 18.300 -3.517 1.00 0.00 C ATOM 876 CG GLU A 62 5.016 18.639 -2.027 1.00 0.00 C ATOM 877 CD GLU A 62 4.625 20.103 -1.815 1.00 0.00 C ATOM 878 OE1 GLU A 62 3.701 20.552 -2.527 1.00 0.00 O ATOM 879 OE2 GLU A 62 5.258 20.740 -0.946 1.00 0.00 O ATOM 0 H GLU A 62 4.182 15.323 -4.701 1.00 0.00 H new ATOM 0 HA GLU A 62 3.306 17.210 -3.084 1.00 0.00 H new ATOM 0 HB2 GLU A 62 6.081 17.929 -3.763 1.00 0.00 H new ATOM 0 HB3 GLU A 62 4.928 19.203 -4.107 1.00 0.00 H new ATOM 0 HG2 GLU A 62 4.290 17.990 -1.537 1.00 0.00 H new ATOM 0 HG3 GLU A 62 5.982 18.446 -1.561 1.00 0.00 H new ATOM 884 N PRO A 63 4.096 17.686 -6.290 1.00 0.00 N ATOM 885 CA PRO A 63 3.541 18.039 -7.585 1.00 0.00 C ATOM 886 C PRO A 63 2.730 16.880 -8.168 1.00 0.00 C ATOM 887 O PRO A 63 1.579 17.060 -8.563 1.00 0.00 O ATOM 888 CB PRO A 63 4.741 18.413 -8.440 1.00 0.00 C ATOM 889 CG PRO A 63 5.952 17.813 -7.743 1.00 0.00 C ATOM 890 CD PRO A 63 5.529 17.407 -6.340 1.00 0.00 C ATOM 0 HA PRO A 63 2.836 18.868 -7.528 1.00 0.00 H new ATOM 0 HB2 PRO A 63 4.638 18.020 -9.451 1.00 0.00 H new ATOM 0 HB3 PRO A 63 4.837 19.495 -8.527 1.00 0.00 H new ATOM 0 HG2 PRO A 63 6.321 16.949 -8.295 1.00 0.00 H new ATOM 0 HG3 PRO A 63 6.766 18.537 -7.702 1.00 0.00 H new ATOM 0 HD2 PRO A 63 5.734 16.353 -6.154 1.00 0.00 H new ATOM 0 HD3 PRO A 63 6.070 17.975 -5.583 1.00 0.00 H new ATOM 895 N LEU A 64 3.363 15.716 -8.204 1.00 0.00 N ATOM 896 CA LEU A 64 2.714 14.528 -8.733 1.00 0.00 C ATOM 897 C LEU A 64 3.051 14.386 -10.218 1.00 0.00 C ATOM 898 O LEU A 64 2.217 13.947 -11.008 1.00 0.00 O ATOM 899 CB LEU A 64 1.211 14.565 -8.444 1.00 0.00 C ATOM 900 CG LEU A 64 0.322 15.070 -9.581 1.00 0.00 C ATOM 901 CD1 LEU A 64 -0.312 13.903 -10.341 1.00 0.00 C ATOM 902 CD2 LEU A 64 -0.727 16.054 -9.060 1.00 0.00 C ATOM 0 H LEU A 64 4.318 15.570 -7.876 1.00 0.00 H new ATOM 0 HA LEU A 64 3.090 13.635 -8.234 1.00 0.00 H new ATOM 0 HB2 LEU A 64 0.888 13.559 -8.176 1.00 0.00 H new ATOM 0 HB3 LEU A 64 1.044 15.196 -7.571 1.00 0.00 H new ATOM 0 HG LEU A 64 0.948 15.612 -10.290 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -0.939 14.290 -11.144 1.00 0.00 H new ATOM 0 HD12 LEU A 64 0.472 13.275 -10.763 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -0.921 13.312 -9.657 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -1.346 16.398 -9.888 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -1.355 15.558 -8.319 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -0.229 16.908 -8.600 1.00 0.00 H new ATOM 913 N ILE A 65 4.276 14.766 -10.553 1.00 0.00 N ATOM 914 CA ILE A 65 4.733 14.687 -11.930 1.00 0.00 C ATOM 915 C ILE A 65 5.848 13.643 -12.033 1.00 0.00 C ATOM 916 O ILE A 65 6.225 13.239 -13.132 1.00 0.00 O ATOM 917 CB ILE A 65 5.138 16.071 -12.440 1.00 0.00 C ATOM 918 CG1 ILE A 65 4.021 17.089 -12.209 1.00 0.00 C ATOM 919 CG2 ILE A 65 5.563 16.011 -13.910 1.00 0.00 C ATOM 920 CD1 ILE A 65 2.738 16.672 -12.933 1.00 0.00 C ATOM 0 H ILE A 65 4.965 15.129 -9.895 1.00 0.00 H new ATOM 0 HA ILE A 65 3.924 14.357 -12.582 1.00 0.00 H new ATOM 0 HB ILE A 65 6.003 16.406 -11.867 1.00 0.00 H new ATOM 0 HG12 ILE A 65 3.825 17.183 -11.141 1.00 0.00 H new ATOM 0 HG13 ILE A 65 4.340 18.070 -12.562 1.00 0.00 H new ATOM 0 HG21 ILE A 65 5.846 17.008 -14.248 1.00 0.00 H new ATOM 0 HG22 ILE A 65 6.413 15.337 -14.016 1.00 0.00 H new ATOM 0 HG23 ILE A 65 4.733 15.645 -14.514 1.00 0.00 H new ATOM 0 HD11 ILE A 65 1.960 17.414 -12.752 1.00 0.00 H new ATOM 0 HD12 ILE A 65 2.931 16.603 -14.004 1.00 0.00 H new ATOM 0 HD13 ILE A 65 2.409 15.702 -12.560 1.00 0.00 H new ATOM 931 N GLN A 66 6.344 13.237 -10.873 1.00 0.00 N ATOM 932 CA GLN A 66 7.408 12.249 -10.819 1.00 0.00 C ATOM 933 C GLN A 66 7.370 11.502 -9.484 1.00 0.00 C ATOM 934 O GLN A 66 8.359 11.478 -8.754 1.00 0.00 O ATOM 935 CB GLN A 66 8.773 12.900 -11.045 1.00 0.00 C ATOM 936 CG GLN A 66 9.773 11.893 -11.616 1.00 0.00 C ATOM 937 CD GLN A 66 10.141 12.244 -13.059 1.00 0.00 C ATOM 938 OE1 GLN A 66 9.954 11.467 -13.982 1.00 0.00 O ATOM 939 NE2 GLN A 66 10.670 13.455 -13.203 1.00 0.00 N ATOM 0 H GLN A 66 6.029 13.574 -9.964 1.00 0.00 H new ATOM 0 HA GLN A 66 7.250 11.528 -11.621 1.00 0.00 H new ATOM 0 HB2 GLN A 66 8.669 13.743 -11.729 1.00 0.00 H new ATOM 0 HB3 GLN A 66 9.150 13.298 -10.103 1.00 0.00 H new ATOM 0 HG2 GLN A 66 10.673 11.879 -11.001 1.00 0.00 H new ATOM 0 HG3 GLN A 66 9.346 10.891 -11.579 1.00 0.00 H new ATOM 0 HE21 GLN A 66 10.799 14.055 -12.388 1.00 0.00 H new ATOM 0 HE22 GLN A 66 10.947 13.784 -14.128 1.00 0.00 H new ATOM 946 N LEU A 67 6.217 10.910 -9.205 1.00 0.00 N ATOM 947 CA LEU A 67 6.039 10.164 -7.971 1.00 0.00 C ATOM 948 C LEU A 67 4.575 9.733 -7.850 1.00 0.00 C ATOM 949 O LEU A 67 4.258 8.805 -7.107 1.00 0.00 O ATOM 950 CB LEU A 67 6.542 10.976 -6.776 1.00 0.00 C ATOM 951 CG LEU A 67 7.814 10.458 -6.103 1.00 0.00 C ATOM 952 CD1 LEU A 67 8.955 11.469 -6.236 1.00 0.00 C ATOM 953 CD2 LEU A 67 7.549 10.084 -4.643 1.00 0.00 C ATOM 0 H LEU A 67 5.398 10.932 -9.812 1.00 0.00 H new ATOM 0 HA LEU A 67 6.641 9.255 -7.984 1.00 0.00 H new ATOM 0 HB2 LEU A 67 6.720 11.999 -7.106 1.00 0.00 H new ATOM 0 HB3 LEU A 67 5.749 11.015 -6.029 1.00 0.00 H new ATOM 0 HG LEU A 67 8.126 9.549 -6.617 1.00 0.00 H new ATOM 0 HD11 LEU A 67 9.848 11.076 -5.749 1.00 0.00 H new ATOM 0 HD12 LEU A 67 9.165 11.644 -7.291 1.00 0.00 H new ATOM 0 HD13 LEU A 67 8.667 12.407 -5.763 1.00 0.00 H new ATOM 0 HD21 LEU A 67 8.470 9.719 -4.188 1.00 0.00 H new ATOM 0 HD22 LEU A 67 7.200 10.962 -4.100 1.00 0.00 H new ATOM 0 HD23 LEU A 67 6.789 9.304 -4.599 1.00 0.00 H new ATOM 964 N ASP A 68 3.723 10.428 -8.588 1.00 0.00 N ATOM 965 CA ASP A 68 2.301 10.128 -8.572 1.00 0.00 C ATOM 966 C ASP A 68 2.082 8.690 -9.045 1.00 0.00 C ATOM 967 O ASP A 68 1.482 7.884 -8.335 1.00 0.00 O ATOM 968 CB ASP A 68 1.531 11.058 -9.513 1.00 0.00 C ATOM 969 CG ASP A 68 0.020 10.824 -9.560 1.00 0.00 C ATOM 970 OD1 ASP A 68 -0.511 10.344 -8.536 1.00 0.00 O ATOM 971 OD2 ASP A 68 -0.569 11.130 -10.619 1.00 0.00 O ATOM 0 H ASP A 68 3.990 11.198 -9.201 1.00 0.00 H new ATOM 0 HA ASP A 68 1.939 10.266 -7.553 1.00 0.00 H new ATOM 0 HB2 ASP A 68 1.715 12.089 -9.211 1.00 0.00 H new ATOM 0 HB3 ASP A 68 1.932 10.945 -10.520 1.00 0.00 H new ATOM 975 N ASP A 69 2.580 8.411 -10.241 1.00 0.00 N ATOM 976 CA ASP A 69 2.446 7.084 -10.817 1.00 0.00 C ATOM 977 C ASP A 69 3.566 6.187 -10.286 1.00 0.00 C ATOM 978 O ASP A 69 3.454 4.963 -10.319 1.00 0.00 O ATOM 979 CB ASP A 69 2.560 7.132 -12.342 1.00 0.00 C ATOM 980 CG ASP A 69 1.590 6.217 -13.091 1.00 0.00 C ATOM 981 OD1 ASP A 69 0.386 6.274 -12.763 1.00 0.00 O ATOM 982 OD2 ASP A 69 2.074 5.480 -13.978 1.00 0.00 O ATOM 0 H ASP A 69 3.077 9.082 -10.827 1.00 0.00 H new ATOM 0 HA ASP A 69 1.467 6.693 -10.541 1.00 0.00 H new ATOM 0 HB2 ASP A 69 2.396 8.158 -12.672 1.00 0.00 H new ATOM 0 HB3 ASP A 69 3.579 6.865 -12.624 1.00 0.00 H new ATOM 986 N ASP A 70 4.621 6.831 -9.810 1.00 0.00 N ATOM 987 CA ASP A 70 5.761 6.107 -9.273 1.00 0.00 C ATOM 988 C ASP A 70 5.353 5.417 -7.970 1.00 0.00 C ATOM 989 O ASP A 70 5.937 4.402 -7.592 1.00 0.00 O ATOM 990 CB ASP A 70 6.920 7.056 -8.963 1.00 0.00 C ATOM 991 CG ASP A 70 8.311 6.507 -9.285 1.00 0.00 C ATOM 992 OD1 ASP A 70 8.648 5.448 -8.713 1.00 0.00 O ATOM 993 OD2 ASP A 70 9.005 7.157 -10.096 1.00 0.00 O ATOM 0 H ASP A 70 4.711 7.847 -9.785 1.00 0.00 H new ATOM 0 HA ASP A 70 6.081 5.380 -10.019 1.00 0.00 H new ATOM 0 HB2 ASP A 70 6.772 7.980 -9.522 1.00 0.00 H new ATOM 0 HB3 ASP A 70 6.884 7.315 -7.905 1.00 0.00 H new ATOM 997 N THR A 71 4.354 5.993 -7.320 1.00 0.00 N ATOM 998 CA THR A 71 3.861 5.445 -6.067 1.00 0.00 C ATOM 999 C THR A 71 2.445 4.896 -6.246 1.00 0.00 C ATOM 1000 O THR A 71 2.154 3.775 -5.832 1.00 0.00 O ATOM 1001 CB THR A 71 3.958 6.540 -5.002 1.00 0.00 C ATOM 1002 OG1 THR A 71 5.203 7.179 -5.273 1.00 0.00 O ATOM 1003 CG2 THR A 71 4.130 5.971 -3.593 1.00 0.00 C ATOM 0 H THR A 71 3.872 6.834 -7.637 1.00 0.00 H new ATOM 0 HA THR A 71 4.465 4.599 -5.740 1.00 0.00 H new ATOM 0 HB THR A 71 3.062 7.160 -5.036 1.00 0.00 H new ATOM 0 HG1 THR A 71 5.068 7.891 -5.932 1.00 0.00 H new ATOM 0 HG21 THR A 71 4.194 6.789 -2.876 1.00 0.00 H new ATOM 0 HG22 THR A 71 3.276 5.340 -3.349 1.00 0.00 H new ATOM 0 HG23 THR A 71 5.044 5.378 -3.549 1.00 0.00 H new ATOM 1011 N ALA A 72 1.601 5.710 -6.863 1.00 0.00 N ATOM 1012 CA ALA A 72 0.223 5.320 -7.103 1.00 0.00 C ATOM 1013 C ALA A 72 0.198 3.990 -7.861 1.00 0.00 C ATOM 1014 O ALA A 72 -0.575 3.094 -7.526 1.00 0.00 O ATOM 1015 CB ALA A 72 -0.502 6.435 -7.858 1.00 0.00 C ATOM 0 H ALA A 72 1.846 6.639 -7.204 1.00 0.00 H new ATOM 0 HA ALA A 72 -0.302 5.172 -6.159 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -1.536 6.140 -8.037 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -0.483 7.349 -7.264 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -0.005 6.612 -8.812 1.00 0.00 H new ATOM 1021 N GLU A 73 1.053 3.905 -8.870 1.00 0.00 N ATOM 1022 CA GLU A 73 1.140 2.701 -9.678 1.00 0.00 C ATOM 1023 C GLU A 73 1.673 1.537 -8.842 1.00 0.00 C ATOM 1024 O GLU A 73 1.550 0.377 -9.234 1.00 0.00 O ATOM 1025 CB GLU A 73 2.011 2.933 -10.915 1.00 0.00 C ATOM 1026 CG GLU A 73 1.721 1.886 -11.993 1.00 0.00 C ATOM 1027 CD GLU A 73 1.287 2.551 -13.301 1.00 0.00 C ATOM 1028 OE1 GLU A 73 0.499 3.518 -13.212 1.00 0.00 O ATOM 1029 OE2 GLU A 73 1.752 2.078 -14.360 1.00 0.00 O ATOM 0 H GLU A 73 1.692 4.651 -9.146 1.00 0.00 H new ATOM 0 HA GLU A 73 0.138 2.445 -10.022 1.00 0.00 H new ATOM 0 HB2 GLU A 73 1.826 3.931 -11.313 1.00 0.00 H new ATOM 0 HB3 GLU A 73 3.064 2.891 -10.636 1.00 0.00 H new ATOM 0 HG2 GLU A 73 2.611 1.281 -12.166 1.00 0.00 H new ATOM 0 HG3 GLU A 73 0.939 1.210 -11.647 1.00 0.00 H new ATOM 1034 N LEU A 74 2.257 1.886 -7.704 1.00 0.00 N ATOM 1035 CA LEU A 74 2.810 0.884 -6.809 1.00 0.00 C ATOM 1036 C LEU A 74 1.676 0.234 -6.014 1.00 0.00 C ATOM 1037 O LEU A 74 1.523 -0.986 -6.028 1.00 0.00 O ATOM 1038 CB LEU A 74 3.904 1.496 -5.931 1.00 0.00 C ATOM 1039 CG LEU A 74 5.059 0.566 -5.553 1.00 0.00 C ATOM 1040 CD1 LEU A 74 4.535 -0.755 -4.986 1.00 0.00 C ATOM 1041 CD2 LEU A 74 5.999 0.348 -6.741 1.00 0.00 C ATOM 0 H LEU A 74 2.359 2.848 -7.382 1.00 0.00 H new ATOM 0 HA LEU A 74 3.295 0.091 -7.378 1.00 0.00 H new ATOM 0 HB2 LEU A 74 4.316 2.362 -6.449 1.00 0.00 H new ATOM 0 HB3 LEU A 74 3.443 1.862 -5.014 1.00 0.00 H new ATOM 0 HG LEU A 74 5.641 1.046 -4.766 1.00 0.00 H new ATOM 0 HD11 LEU A 74 5.376 -1.398 -4.725 1.00 0.00 H new ATOM 0 HD12 LEU A 74 3.939 -0.558 -4.095 1.00 0.00 H new ATOM 0 HD13 LEU A 74 3.916 -1.252 -5.733 1.00 0.00 H new ATOM 0 HD21 LEU A 74 6.811 -0.316 -6.445 1.00 0.00 H new ATOM 0 HD22 LEU A 74 5.445 -0.100 -7.566 1.00 0.00 H new ATOM 0 HD23 LEU A 74 6.411 1.306 -7.059 1.00 0.00 H new ATOM 1052 N MET A 75 0.910 1.078 -5.339 1.00 0.00 N ATOM 1053 CA MET A 75 -0.206 0.601 -4.540 1.00 0.00 C ATOM 1054 C MET A 75 -1.401 0.244 -5.425 1.00 0.00 C ATOM 1055 O MET A 75 -2.267 -0.531 -5.023 1.00 0.00 O ATOM 1056 CB MET A 75 -0.617 1.683 -3.539 1.00 0.00 C ATOM 1057 CG MET A 75 -0.922 3.002 -4.252 1.00 0.00 C ATOM 1058 SD MET A 75 -2.388 3.747 -3.556 1.00 0.00 S ATOM 1059 CE MET A 75 -2.145 5.442 -4.063 1.00 0.00 C ATOM 0 H MET A 75 1.040 2.090 -5.329 1.00 0.00 H new ATOM 0 HA MET A 75 0.110 -0.297 -4.009 1.00 0.00 H new ATOM 0 HB2 MET A 75 -1.495 1.354 -2.983 1.00 0.00 H new ATOM 0 HB3 MET A 75 0.182 1.834 -2.813 1.00 0.00 H new ATOM 0 HG2 MET A 75 -0.076 3.682 -4.153 1.00 0.00 H new ATOM 0 HG3 MET A 75 -1.065 2.824 -5.318 1.00 0.00 H new ATOM 0 HE1 MET A 75 -2.863 6.082 -3.550 1.00 0.00 H new ATOM 0 HE2 MET A 75 -1.133 5.756 -3.809 1.00 0.00 H new ATOM 0 HE3 MET A 75 -2.291 5.524 -5.140 1.00 0.00 H new ATOM 1067 N LYS A 76 -1.412 0.828 -6.615 1.00 0.00 N ATOM 1068 CA LYS A 76 -2.486 0.581 -7.562 1.00 0.00 C ATOM 1069 C LYS A 76 -2.205 -0.718 -8.318 1.00 0.00 C ATOM 1070 O LYS A 76 -2.998 -1.658 -8.260 1.00 0.00 O ATOM 1071 CB LYS A 76 -2.686 1.793 -8.473 1.00 0.00 C ATOM 1072 CG LYS A 76 -3.203 2.996 -7.682 1.00 0.00 C ATOM 1073 CD LYS A 76 -4.662 3.297 -8.033 1.00 0.00 C ATOM 1074 CE LYS A 76 -5.227 4.397 -7.133 1.00 0.00 C ATOM 1075 NZ LYS A 76 -4.869 5.733 -7.660 1.00 0.00 N ATOM 0 H LYS A 76 -0.693 1.472 -6.945 1.00 0.00 H new ATOM 0 HA LYS A 76 -3.432 0.446 -7.038 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -1.743 2.049 -8.955 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -3.392 1.544 -9.265 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -3.116 2.798 -6.614 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -2.586 3.869 -7.896 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -4.733 3.604 -9.076 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -5.260 2.392 -7.926 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -6.311 4.303 -7.071 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -4.838 4.283 -6.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -5.260 6.468 -7.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -3.834 5.826 -7.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -5.261 5.845 -8.617 1.00 0.00 H new ATOM 1085 N GLN A 77 -1.076 -0.731 -9.010 1.00 0.00 N ATOM 1086 CA GLN A 77 -0.681 -1.900 -9.777 1.00 0.00 C ATOM 1087 C GLN A 77 -0.659 -3.140 -8.882 1.00 0.00 C ATOM 1088 O GLN A 77 -1.072 -4.220 -9.301 1.00 0.00 O ATOM 1089 CB GLN A 77 0.677 -1.683 -10.446 1.00 0.00 C ATOM 1090 CG GLN A 77 0.930 -2.735 -11.529 1.00 0.00 C ATOM 1091 CD GLN A 77 2.020 -2.273 -12.498 1.00 0.00 C ATOM 1092 OE1 GLN A 77 3.041 -1.728 -12.111 1.00 0.00 O ATOM 1093 NE2 GLN A 77 1.748 -2.521 -13.777 1.00 0.00 N ATOM 0 H GLN A 77 -0.421 0.050 -9.056 1.00 0.00 H new ATOM 0 HA GLN A 77 -1.417 -2.058 -10.565 1.00 0.00 H new ATOM 0 HB2 GLN A 77 0.714 -0.687 -10.886 1.00 0.00 H new ATOM 0 HB3 GLN A 77 1.467 -1.730 -9.697 1.00 0.00 H new ATOM 0 HG2 GLN A 77 1.226 -3.676 -11.065 1.00 0.00 H new ATOM 0 HG3 GLN A 77 0.008 -2.926 -12.078 1.00 0.00 H new ATOM 0 HE21 GLN A 77 0.874 -2.981 -14.033 1.00 0.00 H new ATOM 0 HE22 GLN A 77 2.413 -2.251 -14.502 1.00 0.00 H new ATOM 1100 N ALA A 78 -0.174 -2.943 -7.664 1.00 0.00 N ATOM 1101 CA ALA A 78 -0.093 -4.032 -6.706 1.00 0.00 C ATOM 1102 C ALA A 78 -1.506 -4.424 -6.265 1.00 0.00 C ATOM 1103 O ALA A 78 -1.918 -5.570 -6.437 1.00 0.00 O ATOM 1104 CB ALA A 78 0.790 -3.612 -5.530 1.00 0.00 C ATOM 0 H ALA A 78 0.167 -2.045 -7.319 1.00 0.00 H new ATOM 0 HA ALA A 78 0.366 -4.910 -7.160 1.00 0.00 H new ATOM 0 HB1 ALA A 78 0.851 -4.429 -4.811 1.00 0.00 H new ATOM 0 HB2 ALA A 78 1.790 -3.373 -5.893 1.00 0.00 H new ATOM 0 HB3 ALA A 78 0.360 -2.735 -5.047 1.00 0.00 H new ATOM 1110 N ARG A 79 -2.207 -3.450 -5.704 1.00 0.00 N ATOM 1111 CA ARG A 79 -3.564 -3.678 -5.237 1.00 0.00 C ATOM 1112 C ARG A 79 -4.497 -3.934 -6.422 1.00 0.00 C ATOM 1113 O ARG A 79 -5.692 -4.165 -6.239 1.00 0.00 O ATOM 1114 CB ARG A 79 -4.081 -2.479 -4.440 1.00 0.00 C ATOM 1115 CG ARG A 79 -4.662 -1.412 -5.370 1.00 0.00 C ATOM 1116 CD ARG A 79 -6.169 -1.603 -5.550 1.00 0.00 C ATOM 1117 NE ARG A 79 -6.482 -1.850 -6.975 1.00 0.00 N ATOM 1118 CZ ARG A 79 -7.705 -1.731 -7.508 1.00 0.00 C ATOM 1119 NH1 ARG A 79 -8.739 -1.368 -6.737 1.00 0.00 N ATOM 1120 NH2 ARG A 79 -7.895 -1.976 -8.811 1.00 0.00 N ATOM 0 H ARG A 79 -1.861 -2.501 -5.562 1.00 0.00 H new ATOM 0 HA ARG A 79 -3.548 -4.553 -4.587 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -4.845 -2.808 -3.736 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -3.269 -2.051 -3.852 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -4.464 -0.421 -4.961 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -4.167 -1.461 -6.340 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -6.513 -2.441 -4.943 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -6.700 -0.718 -5.201 1.00 0.00 H new ATOM 0 HE ARG A 79 -5.718 -2.129 -7.590 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -8.595 -1.182 -5.744 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -9.670 -1.277 -7.143 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -7.108 -2.253 -9.398 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -8.827 -1.885 -9.216 1.00 0.00 H new ATOM 1131 N ASP A 80 -3.917 -3.885 -7.613 1.00 0.00 N ATOM 1132 CA ASP A 80 -4.682 -4.109 -8.828 1.00 0.00 C ATOM 1133 C ASP A 80 -4.378 -5.509 -9.366 1.00 0.00 C ATOM 1134 O ASP A 80 -5.279 -6.211 -9.823 1.00 0.00 O ATOM 1135 CB ASP A 80 -4.307 -3.094 -9.910 1.00 0.00 C ATOM 1136 CG ASP A 80 -4.845 -3.411 -11.307 1.00 0.00 C ATOM 1137 OD1 ASP A 80 -5.865 -4.130 -11.373 1.00 0.00 O ATOM 1138 OD2 ASP A 80 -4.224 -2.925 -12.277 1.00 0.00 O ATOM 0 H ASP A 80 -2.926 -3.693 -7.762 1.00 0.00 H new ATOM 0 HA ASP A 80 -5.739 -4.003 -8.585 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -4.674 -2.113 -9.610 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -3.220 -3.026 -9.962 1.00 0.00 H new ATOM 1142 N MET A 81 -3.106 -5.873 -9.294 1.00 0.00 N ATOM 1143 CA MET A 81 -2.673 -7.176 -9.769 1.00 0.00 C ATOM 1144 C MET A 81 -3.413 -8.299 -9.039 1.00 0.00 C ATOM 1145 O MET A 81 -4.005 -9.170 -9.674 1.00 0.00 O ATOM 1146 CB MET A 81 -1.167 -7.326 -9.543 1.00 0.00 C ATOM 1147 CG MET A 81 -0.380 -6.361 -10.431 1.00 0.00 C ATOM 1148 SD MET A 81 0.503 -7.270 -11.689 1.00 0.00 S ATOM 1149 CE MET A 81 2.184 -6.908 -11.210 1.00 0.00 C ATOM 0 H MET A 81 -2.362 -5.288 -8.914 1.00 0.00 H new ATOM 0 HA MET A 81 -2.899 -7.249 -10.833 1.00 0.00 H new ATOM 0 HB2 MET A 81 -0.932 -7.136 -8.496 1.00 0.00 H new ATOM 0 HB3 MET A 81 -0.864 -8.351 -9.756 1.00 0.00 H new ATOM 0 HG2 MET A 81 -1.059 -5.646 -10.896 1.00 0.00 H new ATOM 0 HG3 MET A 81 0.322 -5.787 -9.826 1.00 0.00 H new ATOM 0 HE1 MET A 81 2.872 -7.402 -11.896 1.00 0.00 H new ATOM 0 HE2 MET A 81 2.348 -5.831 -11.244 1.00 0.00 H new ATOM 0 HE3 MET A 81 2.360 -7.270 -10.197 1.00 0.00 H new ATOM 1157 N TYR A 82 -3.355 -8.241 -7.717 1.00 0.00 N ATOM 1158 CA TYR A 82 -4.014 -9.242 -6.895 1.00 0.00 C ATOM 1159 C TYR A 82 -4.445 -8.651 -5.551 1.00 0.00 C ATOM 1160 O TYR A 82 -5.102 -9.322 -4.756 1.00 0.00 O ATOM 1161 CB TYR A 82 -2.973 -10.336 -6.648 1.00 0.00 C ATOM 1162 CG TYR A 82 -3.432 -11.737 -7.057 1.00 0.00 C ATOM 1163 CD1 TYR A 82 -4.700 -12.170 -6.727 1.00 0.00 C ATOM 1164 CD2 TYR A 82 -2.579 -12.567 -7.755 1.00 0.00 C ATOM 1165 CE1 TYR A 82 -5.133 -13.489 -7.112 1.00 0.00 C ATOM 1166 CE2 TYR A 82 -3.012 -13.885 -8.140 1.00 0.00 C ATOM 1167 CZ TYR A 82 -4.267 -14.281 -7.799 1.00 0.00 C ATOM 1168 OH TYR A 82 -4.676 -15.526 -8.162 1.00 0.00 O ATOM 0 H TYR A 82 -2.862 -7.517 -7.194 1.00 0.00 H new ATOM 0 HA TYR A 82 -4.908 -9.620 -7.392 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -2.064 -10.088 -7.196 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -2.714 -10.344 -5.589 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -5.367 -11.520 -6.180 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -1.586 -12.228 -8.013 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -6.123 -13.841 -6.861 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -2.355 -14.544 -8.687 1.00 0.00 H new ATOM 0 HH TYR A 82 -3.955 -15.979 -8.648 1.00 0.00 H new ATOM 1177 N GLY A 83 -4.056 -7.402 -5.338 1.00 0.00 N ATOM 1178 CA GLY A 83 -4.395 -6.714 -4.104 1.00 0.00 C ATOM 1179 C GLY A 83 -3.146 -6.466 -3.255 1.00 0.00 C ATOM 1180 O GLY A 83 -3.196 -6.559 -2.030 1.00 0.00 O ATOM 0 H GLY A 83 -3.510 -6.849 -5.999 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -4.878 -5.764 -4.334 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -5.113 -7.308 -3.537 1.00 0.00 H new ATOM 1184 N GLN A 84 -2.055 -6.155 -3.941 1.00 0.00 N ATOM 1185 CA GLN A 84 -0.796 -5.892 -3.266 1.00 0.00 C ATOM 1186 C GLN A 84 0.034 -7.174 -3.173 1.00 0.00 C ATOM 1187 O GLN A 84 1.260 -7.130 -3.257 1.00 0.00 O ATOM 1188 CB GLN A 84 -1.033 -5.290 -1.879 1.00 0.00 C ATOM 1189 CG GLN A 84 0.109 -4.350 -1.487 1.00 0.00 C ATOM 1190 CD GLN A 84 -0.416 -2.942 -1.197 1.00 0.00 C ATOM 1191 OE1 GLN A 84 -0.896 -2.239 -2.071 1.00 0.00 O ATOM 1192 NE2 GLN A 84 -0.300 -2.572 0.074 1.00 0.00 N ATOM 0 H GLN A 84 -2.018 -6.079 -4.958 1.00 0.00 H new ATOM 0 HA GLN A 84 -0.237 -5.162 -3.852 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -1.977 -4.744 -1.872 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -1.121 -6.088 -1.142 1.00 0.00 H new ATOM 0 HG2 GLN A 84 0.620 -4.740 -0.607 1.00 0.00 H new ATOM 0 HG3 GLN A 84 0.844 -4.310 -2.291 1.00 0.00 H new ATOM 0 HE21 GLN A 84 0.112 -3.210 0.755 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -0.623 -1.650 0.368 1.00 0.00 H new ATOM 1199 N GLU A 85 -0.667 -8.284 -3.003 1.00 0.00 N ATOM 1200 CA GLU A 85 -0.010 -9.576 -2.898 1.00 0.00 C ATOM 1201 C GLU A 85 -1.051 -10.698 -2.851 1.00 0.00 C ATOM 1202 O GLU A 85 -0.793 -11.766 -2.298 1.00 0.00 O ATOM 1203 CB GLU A 85 0.907 -9.627 -1.675 1.00 0.00 C ATOM 1204 CG GLU A 85 1.969 -10.717 -1.833 1.00 0.00 C ATOM 1205 CD GLU A 85 3.002 -10.326 -2.891 1.00 0.00 C ATOM 1206 OE1 GLU A 85 3.675 -9.294 -2.674 1.00 0.00 O ATOM 1207 OE2 GLU A 85 3.097 -11.066 -3.893 1.00 0.00 O ATOM 0 H GLU A 85 -1.684 -8.316 -2.935 1.00 0.00 H new ATOM 0 HA GLU A 85 0.611 -9.719 -3.782 1.00 0.00 H new ATOM 0 HB2 GLU A 85 1.391 -8.660 -1.538 1.00 0.00 H new ATOM 0 HB3 GLU A 85 0.315 -9.817 -0.780 1.00 0.00 H new ATOM 0 HG2 GLU A 85 2.467 -10.886 -0.878 1.00 0.00 H new ATOM 0 HG3 GLU A 85 1.492 -11.656 -2.114 1.00 0.00 H new ATOM 1212 N LYS A 86 -2.204 -10.417 -3.440 1.00 0.00 N ATOM 1213 CA LYS A 86 -3.283 -11.390 -3.472 1.00 0.00 C ATOM 1214 C LYS A 86 -4.005 -11.390 -2.122 1.00 0.00 C ATOM 1215 O LYS A 86 -4.439 -12.438 -1.647 1.00 0.00 O ATOM 1216 CB LYS A 86 -2.755 -12.764 -3.888 1.00 0.00 C ATOM 1217 CG LYS A 86 -3.884 -13.648 -4.421 1.00 0.00 C ATOM 1218 CD LYS A 86 -4.171 -14.808 -3.466 1.00 0.00 C ATOM 1219 CE LYS A 86 -4.416 -16.106 -4.238 1.00 0.00 C ATOM 1220 NZ LYS A 86 -5.804 -16.575 -4.035 1.00 0.00 N ATOM 0 H LYS A 86 -2.415 -9.530 -3.898 1.00 0.00 H new ATOM 0 HA LYS A 86 -4.020 -11.117 -4.227 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -1.988 -12.646 -4.654 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -2.281 -13.249 -3.035 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -4.786 -13.051 -4.554 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -3.612 -14.039 -5.402 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -3.330 -14.939 -2.785 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -5.043 -14.574 -2.855 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -4.232 -15.945 -5.300 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -3.715 -16.872 -3.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -5.954 -17.457 -4.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -5.967 -16.748 -3.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -6.468 -15.850 -4.374 1.00 0.00 H new ATOM 1230 N LEU A 87 -4.109 -10.203 -1.543 1.00 0.00 N ATOM 1231 CA LEU A 87 -4.769 -10.054 -0.257 1.00 0.00 C ATOM 1232 C LEU A 87 -5.916 -9.051 -0.392 1.00 0.00 C ATOM 1233 O LEU A 87 -6.546 -8.686 0.600 1.00 0.00 O ATOM 1234 CB LEU A 87 -3.754 -9.685 0.827 1.00 0.00 C ATOM 1235 CG LEU A 87 -4.266 -9.728 2.268 1.00 0.00 C ATOM 1236 CD1 LEU A 87 -3.596 -10.856 3.054 1.00 0.00 C ATOM 1237 CD2 LEU A 87 -4.093 -8.371 2.953 1.00 0.00 C ATOM 0 H LEU A 87 -3.748 -9.336 -1.940 1.00 0.00 H new ATOM 0 HA LEU A 87 -5.207 -11.001 0.059 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -2.903 -10.361 0.745 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -3.384 -8.680 0.624 1.00 0.00 H new ATOM 0 HG LEU A 87 -5.334 -9.942 2.244 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -3.978 -10.865 4.075 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -3.814 -11.811 2.577 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -2.518 -10.697 3.071 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -4.465 -8.430 3.976 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -3.037 -8.102 2.966 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.654 -7.613 2.406 1.00 0.00 H new ATOM 1248 N ASN A 88 -6.154 -8.633 -1.627 1.00 0.00 N ATOM 1249 CA ASN A 88 -7.214 -7.680 -1.904 1.00 0.00 C ATOM 1250 C ASN A 88 -8.450 -8.044 -1.078 1.00 0.00 C ATOM 1251 O ASN A 88 -9.244 -7.173 -0.726 1.00 0.00 O ATOM 1252 CB ASN A 88 -7.608 -7.708 -3.382 1.00 0.00 C ATOM 1253 CG ASN A 88 -7.876 -6.296 -3.905 1.00 0.00 C ATOM 1254 OD1 ASN A 88 -8.853 -6.033 -4.587 1.00 0.00 O ATOM 1255 ND2 ASN A 88 -6.957 -5.403 -3.548 1.00 0.00 N ATOM 0 H ASN A 88 -5.630 -8.938 -2.447 1.00 0.00 H new ATOM 0 HA ASN A 88 -6.849 -6.686 -1.647 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -6.812 -8.171 -3.965 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -8.498 -8.323 -3.513 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -7.046 -4.432 -3.847 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -6.163 -5.689 -2.976 1.00 0.00 H new ATOM 1261 N GLU A 89 -8.573 -9.332 -0.794 1.00 0.00 N ATOM 1262 CA GLU A 89 -9.699 -9.822 -0.016 1.00 0.00 C ATOM 1263 C GLU A 89 -9.875 -8.981 1.250 1.00 0.00 C ATOM 1264 O GLU A 89 -11.001 -8.689 1.653 1.00 0.00 O ATOM 1265 CB GLU A 89 -9.524 -11.302 0.328 1.00 0.00 C ATOM 1266 CG GLU A 89 -10.851 -12.054 0.205 1.00 0.00 C ATOM 1267 CD GLU A 89 -10.986 -13.112 1.303 1.00 0.00 C ATOM 1268 OE1 GLU A 89 -10.042 -13.922 1.428 1.00 0.00 O ATOM 1269 OE2 GLU A 89 -12.029 -13.087 1.990 1.00 0.00 O ATOM 0 H GLU A 89 -7.912 -10.051 -1.088 1.00 0.00 H new ATOM 0 HA GLU A 89 -10.602 -9.728 -0.619 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -8.786 -11.749 -0.338 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -9.139 -11.400 1.343 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -11.680 -11.349 0.270 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -10.914 -12.530 -0.773 1.00 0.00 H new ATOM 1274 N LYS A 90 -8.748 -8.616 1.841 1.00 0.00 N ATOM 1275 CA LYS A 90 -8.764 -7.814 3.054 1.00 0.00 C ATOM 1276 C LYS A 90 -7.958 -6.534 2.824 1.00 0.00 C ATOM 1277 O LYS A 90 -8.134 -5.550 3.540 1.00 0.00 O ATOM 1278 CB LYS A 90 -8.281 -8.640 4.247 1.00 0.00 C ATOM 1279 CG LYS A 90 -9.421 -9.475 4.833 1.00 0.00 C ATOM 1280 CD LYS A 90 -8.993 -10.147 6.140 1.00 0.00 C ATOM 1281 CE LYS A 90 -10.210 -10.550 6.974 1.00 0.00 C ATOM 1282 NZ LYS A 90 -10.512 -11.987 6.790 1.00 0.00 N ATOM 0 H LYS A 90 -7.817 -8.860 1.503 1.00 0.00 H new ATOM 0 HA LYS A 90 -9.782 -7.510 3.298 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -7.468 -9.296 3.935 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -7.879 -7.978 5.014 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -10.287 -8.838 5.014 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -9.728 -10.234 4.113 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -8.391 -11.028 5.920 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -8.364 -9.467 6.714 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -10.020 -10.344 8.027 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -11.073 -9.951 6.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -11.341 -12.244 7.363 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -10.713 -12.174 5.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -9.694 -12.555 7.090 1.00 0.00 H new ATOM 1292 N LEU A 91 -7.092 -6.589 1.822 1.00 0.00 N ATOM 1293 CA LEU A 91 -6.259 -5.447 1.489 1.00 0.00 C ATOM 1294 C LEU A 91 -7.089 -4.427 0.707 1.00 0.00 C ATOM 1295 O LEU A 91 -6.821 -3.227 0.766 1.00 0.00 O ATOM 1296 CB LEU A 91 -4.994 -5.900 0.759 1.00 0.00 C ATOM 1297 CG LEU A 91 -3.671 -5.360 1.307 1.00 0.00 C ATOM 1298 CD1 LEU A 91 -3.366 -3.975 0.733 1.00 0.00 C ATOM 1299 CD2 LEU A 91 -3.672 -5.359 2.837 1.00 0.00 C ATOM 0 H LEU A 91 -6.950 -7.407 1.230 1.00 0.00 H new ATOM 0 HA LEU A 91 -5.914 -4.950 2.396 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -4.956 -6.989 0.782 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -5.078 -5.606 -0.287 1.00 0.00 H new ATOM 0 HG LEU A 91 -2.870 -6.026 0.986 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -2.421 -3.613 1.138 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -3.295 -4.039 -0.353 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -4.165 -3.285 1.004 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -2.721 -4.971 3.201 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -4.484 -4.729 3.200 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -3.812 -6.377 3.201 1.00 0.00 H new ATOM 1310 N ASN A 92 -8.078 -4.940 -0.008 1.00 0.00 N ATOM 1311 CA ASN A 92 -8.949 -4.089 -0.800 1.00 0.00 C ATOM 1312 C ASN A 92 -9.816 -3.243 0.133 1.00 0.00 C ATOM 1313 O ASN A 92 -10.084 -2.076 -0.150 1.00 0.00 O ATOM 1314 CB ASN A 92 -9.879 -4.923 -1.685 1.00 0.00 C ATOM 1315 CG ASN A 92 -10.638 -4.036 -2.673 1.00 0.00 C ATOM 1316 OD1 ASN A 92 -10.061 -3.271 -3.429 1.00 0.00 O ATOM 1317 ND2 ASN A 92 -11.958 -4.179 -2.626 1.00 0.00 N ATOM 0 H ASN A 92 -8.296 -5.935 -0.056 1.00 0.00 H new ATOM 0 HA ASN A 92 -8.321 -3.459 -1.430 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -9.298 -5.666 -2.231 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -10.588 -5.468 -1.062 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -12.553 -3.630 -3.247 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -12.377 -4.838 -1.969 1.00 0.00 H new ATOM 1323 N THR A 93 -10.232 -3.865 1.227 1.00 0.00 N ATOM 1324 CA THR A 93 -11.064 -3.183 2.204 1.00 0.00 C ATOM 1325 C THR A 93 -10.211 -2.272 3.087 1.00 0.00 C ATOM 1326 O THR A 93 -10.653 -1.195 3.486 1.00 0.00 O ATOM 1327 CB THR A 93 -11.836 -4.244 2.991 1.00 0.00 C ATOM 1328 OG1 THR A 93 -12.886 -4.634 2.111 1.00 0.00 O ATOM 1329 CG2 THR A 93 -12.562 -3.661 4.204 1.00 0.00 C ATOM 0 H THR A 93 -10.009 -4.833 1.458 1.00 0.00 H new ATOM 0 HA THR A 93 -11.788 -2.528 1.719 1.00 0.00 H new ATOM 0 HB THR A 93 -11.148 -5.023 3.321 1.00 0.00 H new ATOM 0 HG1 THR A 93 -13.435 -5.322 2.542 1.00 0.00 H new ATOM 0 HG21 THR A 93 -13.094 -4.456 4.727 1.00 0.00 H new ATOM 0 HG22 THR A 93 -11.836 -3.206 4.878 1.00 0.00 H new ATOM 0 HG23 THR A 93 -13.274 -2.905 3.873 1.00 0.00 H new ATOM 1337 N ILE A 94 -9.003 -2.736 3.369 1.00 0.00 N ATOM 1338 CA ILE A 94 -8.083 -1.976 4.199 1.00 0.00 C ATOM 1339 C ILE A 94 -7.511 -0.812 3.385 1.00 0.00 C ATOM 1340 O ILE A 94 -7.299 0.276 3.916 1.00 0.00 O ATOM 1341 CB ILE A 94 -7.014 -2.895 4.793 1.00 0.00 C ATOM 1342 CG1 ILE A 94 -7.620 -3.841 5.831 1.00 0.00 C ATOM 1343 CG2 ILE A 94 -5.851 -2.083 5.367 1.00 0.00 C ATOM 1344 CD1 ILE A 94 -8.118 -3.068 7.054 1.00 0.00 C ATOM 0 H ILE A 94 -8.639 -3.629 3.037 1.00 0.00 H new ATOM 0 HA ILE A 94 -8.607 -1.543 5.051 1.00 0.00 H new ATOM 0 HB ILE A 94 -6.610 -3.513 3.991 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -8.446 -4.394 5.385 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -6.875 -4.574 6.139 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -5.105 -2.760 5.783 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -5.398 -1.486 4.575 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -6.220 -1.423 6.152 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -8.544 -3.765 7.776 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -7.285 -2.535 7.512 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -8.881 -2.353 6.746 1.00 0.00 H new ATOM 1355 N ILE A 95 -7.279 -1.083 2.109 1.00 0.00 N ATOM 1356 CA ILE A 95 -6.736 -0.073 1.217 1.00 0.00 C ATOM 1357 C ILE A 95 -7.832 0.936 0.868 1.00 0.00 C ATOM 1358 O ILE A 95 -7.617 2.144 0.948 1.00 0.00 O ATOM 1359 CB ILE A 95 -6.091 -0.728 -0.006 1.00 0.00 C ATOM 1360 CG1 ILE A 95 -5.156 0.249 -0.722 1.00 0.00 C ATOM 1361 CG2 ILE A 95 -7.154 -1.299 -0.946 1.00 0.00 C ATOM 1362 CD1 ILE A 95 -4.235 -0.488 -1.696 1.00 0.00 C ATOM 0 H ILE A 95 -7.457 -1.987 1.672 1.00 0.00 H new ATOM 0 HA ILE A 95 -5.938 0.481 1.711 1.00 0.00 H new ATOM 0 HB ILE A 95 -5.481 -1.564 0.336 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -5.744 0.991 -1.262 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -4.558 0.789 0.012 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -6.669 -1.759 -1.807 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -7.742 -2.049 -0.417 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -7.809 -0.496 -1.284 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -3.581 0.229 -2.192 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -3.631 -1.212 -1.149 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -4.836 -1.007 -2.443 1.00 0.00 H new ATOM 1373 N LYS A 96 -8.983 0.402 0.489 1.00 0.00 N ATOM 1374 CA LYS A 96 -10.114 1.239 0.127 1.00 0.00 C ATOM 1375 C LYS A 96 -10.598 1.998 1.365 1.00 0.00 C ATOM 1376 O LYS A 96 -11.183 3.073 1.248 1.00 0.00 O ATOM 1377 CB LYS A 96 -11.205 0.406 -0.549 1.00 0.00 C ATOM 1378 CG LYS A 96 -12.298 1.303 -1.134 1.00 0.00 C ATOM 1379 CD LYS A 96 -13.676 0.654 -0.989 1.00 0.00 C ATOM 1380 CE LYS A 96 -14.594 1.054 -2.144 1.00 0.00 C ATOM 1381 NZ LYS A 96 -15.206 -0.145 -2.759 1.00 0.00 N ATOM 0 H LYS A 96 -9.157 -0.601 0.425 1.00 0.00 H new ATOM 0 HA LYS A 96 -9.814 1.985 -0.609 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -10.766 -0.201 -1.341 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -11.643 -0.282 0.174 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -12.291 2.268 -0.627 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -12.091 1.495 -2.187 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -13.570 -0.431 -0.963 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -14.125 0.954 -0.042 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -15.375 1.722 -1.781 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -14.026 1.605 -2.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -15.826 0.145 -3.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -14.458 -0.769 -3.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -15.765 -0.655 -2.045 1.00 0.00 H new ATOM 1391 N GLN A 97 -10.335 1.407 2.521 1.00 0.00 N ATOM 1392 CA GLN A 97 -10.737 2.014 3.779 1.00 0.00 C ATOM 1393 C GLN A 97 -9.768 3.134 4.161 1.00 0.00 C ATOM 1394 O GLN A 97 -10.190 4.201 4.605 1.00 0.00 O ATOM 1395 CB GLN A 97 -10.827 0.965 4.889 1.00 0.00 C ATOM 1396 CG GLN A 97 -10.936 1.629 6.263 1.00 0.00 C ATOM 1397 CD GLN A 97 -11.701 0.738 7.244 1.00 0.00 C ATOM 1398 OE1 GLN A 97 -11.646 -0.480 7.190 1.00 0.00 O ATOM 1399 NE2 GLN A 97 -12.418 1.411 8.140 1.00 0.00 N ATOM 0 H GLN A 97 -9.849 0.515 2.613 1.00 0.00 H new ATOM 0 HA GLN A 97 -11.729 2.446 3.651 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -11.693 0.325 4.720 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -9.946 0.323 4.860 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -9.939 1.832 6.653 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -11.443 2.589 6.168 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -12.420 2.431 8.130 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -12.966 0.907 8.837 1.00 0.00 H new ATOM 1406 N ILE A 98 -8.486 2.854 3.976 1.00 0.00 N ATOM 1407 CA ILE A 98 -7.453 3.825 4.295 1.00 0.00 C ATOM 1408 C ILE A 98 -7.455 4.931 3.238 1.00 0.00 C ATOM 1409 O ILE A 98 -6.803 5.960 3.410 1.00 0.00 O ATOM 1410 CB ILE A 98 -6.099 3.132 4.458 1.00 0.00 C ATOM 1411 CG1 ILE A 98 -5.401 3.587 5.742 1.00 0.00 C ATOM 1412 CG2 ILE A 98 -5.222 3.346 3.222 1.00 0.00 C ATOM 1413 CD1 ILE A 98 -6.311 3.398 6.957 1.00 0.00 C ATOM 0 H ILE A 98 -8.139 1.968 3.609 1.00 0.00 H new ATOM 0 HA ILE A 98 -7.659 4.300 5.254 1.00 0.00 H new ATOM 0 HB ILE A 98 -6.272 2.060 4.549 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -4.481 3.020 5.881 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -5.118 4.636 5.654 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -4.265 2.843 3.363 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -5.722 2.934 2.345 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -5.053 4.413 3.076 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -5.791 3.729 7.856 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -7.219 3.986 6.826 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -6.572 2.344 7.056 1.00 0.00 H new ATOM 1424 N LEU A 99 -8.195 4.682 2.168 1.00 0.00 N ATOM 1425 CA LEU A 99 -8.290 5.645 1.084 1.00 0.00 C ATOM 1426 C LEU A 99 -9.709 6.216 1.037 1.00 0.00 C ATOM 1427 O LEU A 99 -9.960 7.210 0.359 1.00 0.00 O ATOM 1428 CB LEU A 99 -7.839 5.013 -0.235 1.00 0.00 C ATOM 1429 CG LEU A 99 -6.401 5.315 -0.666 1.00 0.00 C ATOM 1430 CD1 LEU A 99 -5.443 4.227 -0.177 1.00 0.00 C ATOM 1431 CD2 LEU A 99 -6.315 5.519 -2.179 1.00 0.00 C ATOM 0 H LEU A 99 -8.734 3.828 2.028 1.00 0.00 H new ATOM 0 HA LEU A 99 -7.614 6.482 1.259 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -7.954 3.932 -0.155 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -8.512 5.348 -1.024 1.00 0.00 H new ATOM 0 HG LEU A 99 -6.092 6.249 -0.198 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -4.428 4.465 -0.496 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -5.478 4.174 0.911 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -5.739 3.266 -0.597 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -5.283 5.732 -2.459 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -6.650 4.615 -2.688 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -6.950 6.356 -2.470 1.00 0.00 H new ATOM 1442 N SER A 100 -10.600 5.562 1.768 1.00 0.00 N ATOM 1443 CA SER A 100 -11.987 5.992 1.819 1.00 0.00 C ATOM 1444 C SER A 100 -12.312 6.547 3.207 1.00 0.00 C ATOM 1445 O SER A 100 -13.394 7.092 3.423 1.00 0.00 O ATOM 1446 CB SER A 100 -12.934 4.841 1.473 1.00 0.00 C ATOM 1447 OG SER A 100 -12.737 4.369 0.144 1.00 0.00 O ATOM 0 H SER A 100 -10.388 4.737 2.330 1.00 0.00 H new ATOM 0 HA SER A 100 -12.128 6.778 1.078 1.00 0.00 H new ATOM 0 HB2 SER A 100 -12.780 4.022 2.175 1.00 0.00 H new ATOM 0 HB3 SER A 100 -13.966 5.172 1.591 1.00 0.00 H new ATOM 0 HG SER A 100 -11.809 4.072 0.037 1.00 0.00 H new ATOM 1452 N ILE A 101 -11.356 6.391 4.111 1.00 0.00 N ATOM 1453 CA ILE A 101 -11.527 6.870 5.471 1.00 0.00 C ATOM 1454 C ILE A 101 -11.726 8.387 5.452 1.00 0.00 C ATOM 1455 O ILE A 101 -12.390 8.942 6.327 1.00 0.00 O ATOM 1456 CB ILE A 101 -10.361 6.414 6.350 1.00 0.00 C ATOM 1457 CG1 ILE A 101 -10.541 6.893 7.793 1.00 0.00 C ATOM 1458 CG2 ILE A 101 -9.022 6.862 5.761 1.00 0.00 C ATOM 1459 CD1 ILE A 101 -11.970 6.645 8.278 1.00 0.00 C ATOM 0 H ILE A 101 -10.460 5.939 3.928 1.00 0.00 H new ATOM 0 HA ILE A 101 -12.422 6.436 5.918 1.00 0.00 H new ATOM 0 HB ILE A 101 -10.356 5.324 6.371 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -9.837 6.373 8.443 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -10.310 7.956 7.859 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -8.210 6.525 6.405 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -8.899 6.431 4.767 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -9.001 7.949 5.690 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -12.071 6.994 9.306 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -12.670 7.186 7.640 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -12.189 5.578 8.234 1.00 0.00 H new ATOM 1470 N SER A 102 -11.138 9.016 4.445 1.00 0.00 N ATOM 1471 CA SER A 102 -11.242 10.458 4.299 1.00 0.00 C ATOM 1472 C SER A 102 -9.893 11.041 3.873 1.00 0.00 C ATOM 1473 O SER A 102 -9.483 12.091 4.365 1.00 0.00 O ATOM 1474 CB SER A 102 -11.713 11.110 5.601 1.00 0.00 C ATOM 1475 OG SER A 102 -13.129 11.042 5.751 1.00 0.00 O ATOM 0 H SER A 102 -10.588 8.553 3.722 1.00 0.00 H new ATOM 0 HA SER A 102 -11.982 10.670 3.528 1.00 0.00 H new ATOM 0 HB2 SER A 102 -11.235 10.617 6.447 1.00 0.00 H new ATOM 0 HB3 SER A 102 -11.396 12.153 5.619 1.00 0.00 H new ATOM 0 HG SER A 102 -13.369 10.218 6.225 1.00 0.00 H new ATOM 1480 N VAL A 103 -9.241 10.333 2.963 1.00 0.00 N ATOM 1481 CA VAL A 103 -7.946 10.766 2.464 1.00 0.00 C ATOM 1482 C VAL A 103 -8.004 10.881 0.940 1.00 0.00 C ATOM 1483 O VAL A 103 -7.548 11.872 0.372 1.00 0.00 O ATOM 1484 CB VAL A 103 -6.853 9.812 2.951 1.00 0.00 C ATOM 1485 CG1 VAL A 103 -6.945 9.597 4.463 1.00 0.00 C ATOM 1486 CG2 VAL A 103 -6.915 8.479 2.202 1.00 0.00 C ATOM 0 H VAL A 103 -9.585 9.462 2.558 1.00 0.00 H new ATOM 0 HA VAL A 103 -7.696 11.752 2.855 1.00 0.00 H new ATOM 0 HB VAL A 103 -5.888 10.272 2.737 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -6.157 8.915 4.782 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -6.827 10.552 4.974 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -7.917 9.170 4.711 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -6.128 7.820 2.567 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -7.886 8.012 2.369 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -6.776 8.654 1.135 1.00 0.00 H new ATOM 1496 N SER A 104 -8.569 9.854 0.321 1.00 0.00 N ATOM 1497 CA SER A 104 -8.692 9.828 -1.125 1.00 0.00 C ATOM 1498 C SER A 104 -9.896 10.664 -1.563 1.00 0.00 C ATOM 1499 O SER A 104 -10.418 10.480 -2.662 1.00 0.00 O ATOM 1500 CB SER A 104 -8.828 8.394 -1.642 1.00 0.00 C ATOM 1501 OG SER A 104 -8.327 8.254 -2.968 1.00 0.00 O ATOM 0 H SER A 104 -8.946 9.034 0.796 1.00 0.00 H new ATOM 0 HA SER A 104 -7.785 10.255 -1.552 1.00 0.00 H new ATOM 0 HB2 SER A 104 -8.290 7.717 -0.978 1.00 0.00 H new ATOM 0 HB3 SER A 104 -9.877 8.098 -1.618 1.00 0.00 H new ATOM 0 HG SER A 104 -8.836 8.834 -3.573 1.00 0.00 H new ATOM 1506 N GLU A 105 -10.301 11.566 -0.681 1.00 0.00 N ATOM 1507 CA GLU A 105 -11.434 12.432 -0.963 1.00 0.00 C ATOM 1508 C GLU A 105 -12.742 11.644 -0.861 1.00 0.00 C ATOM 1509 O GLU A 105 -13.684 11.899 -1.609 1.00 0.00 O ATOM 1510 CB GLU A 105 -11.295 13.087 -2.339 1.00 0.00 C ATOM 1511 CG GLU A 105 -11.557 14.592 -2.258 1.00 0.00 C ATOM 1512 CD GLU A 105 -10.265 15.386 -2.471 1.00 0.00 C ATOM 1513 OE1 GLU A 105 -9.959 15.662 -3.651 1.00 0.00 O ATOM 1514 OE2 GLU A 105 -9.616 15.698 -1.451 1.00 0.00 O ATOM 0 H GLU A 105 -9.865 11.716 0.229 1.00 0.00 H new ATOM 0 HA GLU A 105 -11.452 13.228 -0.218 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -10.294 12.909 -2.731 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -11.996 12.629 -3.036 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -12.292 14.878 -3.010 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -11.984 14.839 -1.286 1.00 0.00 H new ATOM 1519 N GLU A 106 -12.758 10.705 0.072 1.00 0.00 N ATOM 1520 CA GLU A 106 -13.935 9.878 0.282 1.00 0.00 C ATOM 1521 C GLU A 106 -15.205 10.726 0.176 1.00 0.00 C ATOM 1522 O GLU A 106 -16.232 10.253 -0.307 1.00 0.00 O ATOM 1523 CB GLU A 106 -13.868 9.161 1.632 1.00 0.00 C ATOM 1524 CG GLU A 106 -15.201 8.485 1.961 1.00 0.00 C ATOM 1525 CD GLU A 106 -15.762 9.001 3.287 1.00 0.00 C ATOM 1526 OE1 GLU A 106 -15.100 8.755 4.318 1.00 0.00 O ATOM 1527 OE2 GLU A 106 -16.842 9.628 3.241 1.00 0.00 O ATOM 0 H GLU A 106 -11.975 10.498 0.692 1.00 0.00 H new ATOM 0 HA GLU A 106 -13.963 9.116 -0.497 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -13.073 8.415 1.613 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -13.616 9.876 2.415 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -15.916 8.674 1.161 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -15.062 7.405 2.016 1.00 0.00 H new ATOM 1532 N GLY A 107 -15.092 11.964 0.635 1.00 0.00 N ATOM 1533 CA GLY A 107 -16.217 12.882 0.596 1.00 0.00 C ATOM 1534 C GLY A 107 -16.891 12.867 -0.777 1.00 0.00 C ATOM 1535 O GLY A 107 -18.053 13.248 -0.906 1.00 0.00 O ATOM 0 H GLY A 107 -14.238 12.352 1.036 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -16.941 12.608 1.363 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -15.875 13.891 0.826 1.00 0.00 H new ATOM 1539 N GLU A 108 -16.133 12.422 -1.768 1.00 0.00 N ATOM 1540 CA GLU A 108 -16.642 12.351 -3.127 1.00 0.00 C ATOM 1541 C GLU A 108 -16.737 10.894 -3.583 1.00 0.00 C ATOM 1542 O GLU A 108 -17.833 10.348 -3.703 1.00 0.00 O ATOM 1543 CB GLU A 108 -15.770 13.168 -4.082 1.00 0.00 C ATOM 1544 CG GLU A 108 -16.565 14.323 -4.697 1.00 0.00 C ATOM 1545 CD GLU A 108 -15.659 15.227 -5.536 1.00 0.00 C ATOM 1546 OE1 GLU A 108 -15.494 14.912 -6.734 1.00 0.00 O ATOM 1547 OE2 GLU A 108 -15.151 16.213 -4.959 1.00 0.00 O ATOM 0 H GLU A 108 -15.169 12.107 -1.657 1.00 0.00 H new ATOM 0 HA GLU A 108 -17.643 12.782 -3.142 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -14.906 13.561 -3.546 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -15.387 12.523 -4.873 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -17.366 13.926 -5.320 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -17.036 14.907 -3.906 1.00 0.00 H new ATOM 1552 N LYS A 109 -15.575 10.305 -3.826 1.00 0.00 N ATOM 1553 CA LYS A 109 -15.514 8.922 -4.266 1.00 0.00 C ATOM 1554 C LYS A 109 -14.231 8.704 -5.070 1.00 0.00 C ATOM 1555 O LYS A 109 -14.057 9.289 -6.138 1.00 0.00 O ATOM 1556 CB LYS A 109 -16.789 8.545 -5.025 1.00 0.00 C ATOM 1557 CG LYS A 109 -16.524 7.397 -6.001 1.00 0.00 C ATOM 1558 CD LYS A 109 -16.266 7.926 -7.413 1.00 0.00 C ATOM 1559 CE LYS A 109 -17.524 7.822 -8.277 1.00 0.00 C ATOM 1560 NZ LYS A 109 -17.527 8.875 -9.316 1.00 0.00 N ATOM 0 H LYS A 109 -14.668 10.761 -3.726 1.00 0.00 H new ATOM 0 HA LYS A 109 -15.471 8.250 -3.409 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -17.566 8.254 -4.318 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -17.163 9.412 -5.570 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -15.664 6.819 -5.663 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -17.379 6.720 -6.013 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -15.941 8.965 -7.362 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -15.456 7.361 -7.874 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -17.570 6.839 -8.747 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -18.411 7.918 -7.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -18.388 8.790 -9.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -17.505 9.811 -8.862 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -16.690 8.766 -9.924 1.00 0.00 H new ATOM 1570 N GLU A 110 -13.366 7.861 -4.527 1.00 0.00 N ATOM 1571 CA GLU A 110 -12.105 7.558 -5.181 1.00 0.00 C ATOM 1572 C GLU A 110 -11.221 8.806 -5.235 1.00 0.00 C ATOM 1573 O GLU A 110 -10.292 8.947 -4.441 1.00 0.00 O ATOM 1574 CB GLU A 110 -12.336 6.990 -6.583 1.00 0.00 C ATOM 1575 CG GLU A 110 -11.694 5.609 -6.727 1.00 0.00 C ATOM 1576 CD GLU A 110 -12.069 4.967 -8.066 1.00 0.00 C ATOM 1577 OE1 GLU A 110 -12.334 5.741 -9.011 1.00 0.00 O ATOM 1578 OE2 GLU A 110 -12.080 3.718 -8.113 1.00 0.00 O ATOM 0 H GLU A 110 -13.514 7.378 -3.641 1.00 0.00 H new ATOM 0 HA GLU A 110 -11.590 6.796 -4.596 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -13.406 6.920 -6.779 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -11.919 7.668 -7.327 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -10.610 5.698 -6.653 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -12.017 4.966 -5.908 1.00 0.00 H new ATOM 1583 N LEU A 111 -11.543 9.681 -6.177 1.00 0.00 N ATOM 1584 CA LEU A 111 -10.791 10.912 -6.344 1.00 0.00 C ATOM 1585 C LEU A 111 -11.436 11.753 -7.447 1.00 0.00 C ATOM 1586 O LEU A 111 -11.705 12.937 -7.253 1.00 0.00 O ATOM 1587 CB LEU A 111 -9.312 10.607 -6.587 1.00 0.00 C ATOM 1588 CG LEU A 111 -8.412 11.817 -6.845 1.00 0.00 C ATOM 1589 CD1 LEU A 111 -7.387 11.987 -5.721 1.00 0.00 C ATOM 1590 CD2 LEU A 111 -7.745 11.723 -8.218 1.00 0.00 C ATOM 0 H LEU A 111 -12.315 9.561 -6.833 1.00 0.00 H new ATOM 0 HA LEU A 111 -10.824 11.506 -5.431 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -8.925 10.069 -5.721 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -9.236 9.934 -7.441 1.00 0.00 H new ATOM 0 HG LEU A 111 -9.036 12.711 -6.851 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -6.760 12.854 -5.929 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -7.906 12.133 -4.774 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -6.764 11.095 -5.659 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -7.111 12.596 -8.375 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -7.137 10.820 -8.266 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -8.511 11.687 -8.993 1.00 0.00 H new ATOM 1601 N VAL A 112 -11.666 11.107 -8.581 1.00 0.00 N ATOM 1602 CA VAL A 112 -12.275 11.781 -9.715 1.00 0.00 C ATOM 1603 C VAL A 112 -11.329 12.872 -10.223 1.00 0.00 C ATOM 1604 O VAL A 112 -11.643 14.058 -10.140 1.00 0.00 O ATOM 1605 CB VAL A 112 -13.654 12.319 -9.327 1.00 0.00 C ATOM 1606 CG1 VAL A 112 -14.284 13.097 -10.483 1.00 0.00 C ATOM 1607 CG2 VAL A 112 -14.573 11.186 -8.863 1.00 0.00 C ATOM 0 H VAL A 112 -11.442 10.125 -8.739 1.00 0.00 H new ATOM 0 HA VAL A 112 -12.434 11.080 -10.535 1.00 0.00 H new ATOM 0 HB VAL A 112 -13.523 13.008 -8.492 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -15.263 13.468 -10.181 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -13.643 13.938 -10.748 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -14.396 12.440 -11.346 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -15.547 11.595 -8.593 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -14.694 10.462 -9.669 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -14.133 10.693 -7.996 1.00 0.00 H new ATOM 1617 N PRO A 113 -10.161 12.419 -10.751 1.00 0.00 N ATOM 1618 CA PRO A 113 -9.167 13.343 -11.271 1.00 0.00 C ATOM 1619 C PRO A 113 -9.600 13.908 -12.626 1.00 0.00 C ATOM 1620 O PRO A 113 -10.630 13.509 -13.168 1.00 0.00 O ATOM 1621 CB PRO A 113 -7.881 12.536 -11.348 1.00 0.00 C ATOM 1622 CG PRO A 113 -8.303 11.076 -11.311 1.00 0.00 C ATOM 1623 CD PRO A 113 -9.756 11.021 -10.865 1.00 0.00 C ATOM 0 HA PRO A 113 -9.034 14.219 -10.636 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -7.333 12.761 -12.263 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -7.220 12.773 -10.514 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -8.188 10.621 -12.295 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -7.671 10.513 -10.624 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -10.373 10.488 -11.589 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -9.859 10.500 -9.913 1.00 0.00 H new ATOM 1628 N ARG A 114 -8.793 14.828 -13.133 1.00 0.00 N ATOM 1629 CA ARG A 114 -9.079 15.451 -14.414 1.00 0.00 C ATOM 1630 C ARG A 114 -10.581 15.714 -14.551 1.00 0.00 C ATOM 1631 O ARG A 114 -11.218 16.198 -13.617 1.00 0.00 O ATOM 1632 CB ARG A 114 -8.615 14.568 -15.573 1.00 0.00 C ATOM 1633 CG ARG A 114 -8.853 15.258 -16.918 1.00 0.00 C ATOM 1634 CD ARG A 114 -7.822 16.363 -17.157 1.00 0.00 C ATOM 1635 NE ARG A 114 -7.654 16.592 -18.609 1.00 0.00 N ATOM 1636 CZ ARG A 114 -6.745 17.422 -19.139 1.00 0.00 C ATOM 1637 NH1 ARG A 114 -5.916 18.105 -18.339 1.00 0.00 N ATOM 1638 NH2 ARG A 114 -6.664 17.568 -20.469 1.00 0.00 N ATOM 0 H ARG A 114 -7.941 15.157 -12.680 1.00 0.00 H new ATOM 0 HA ARG A 114 -8.535 16.395 -14.453 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -7.555 14.340 -15.460 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -9.149 13.618 -15.548 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -8.798 14.524 -17.722 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -9.857 15.681 -16.941 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -8.144 17.284 -16.670 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -6.867 16.084 -16.712 1.00 0.00 H new ATOM 0 HE ARG A 114 -8.269 16.086 -19.247 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -5.977 17.993 -17.327 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -5.224 18.737 -18.742 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -7.295 17.047 -21.079 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -5.972 18.200 -20.871 1.00 0.00 H new TER 1649 ARG A 114