USER MOD reduce.3.24.130724 H: found=0, std=0, add=903, rem=0, adj=25 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 Single : A 3 CYS SG : rot -11:sc= -4.76! USER MOD Single : A 4 THR OG1 : rot -35:sc= 0.831 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 HIS : no HD1:sc= -4.48 K(o=-4.5,f=-11!) USER MOD Single : A 10 HIS : no HE2:sc= -2.07 K(o=-2.1,f=-9.7!) USER MOD Single : A 12 LYS NZ :NH3+ -123:sc=-0.00397 (180deg=-0.85) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot -96:sc= 0.288 USER MOD Single : A 21 THR OG1 : rot 150:sc= -1.87 USER MOD Single : A 24 MET CE :methyl -131:sc= -1.16 (180deg=-4.29!) USER MOD Single : A 27 MET CE :methyl 145:sc= -0.23 (180deg=-0.975) USER MOD Single : A 28 LYS NZ :NH3+ 179:sc= -1.91 (180deg=-1.97) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 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= -2.77! C(o=-2.8!,f=-9.7!) USER MOD Single : A 38 SER OG : rot -150:sc= -3.72! USER MOD Single : A 39 THR OG1 : rot -167:sc= -1.61! USER MOD Single : A 44 MET CE :methyl 174:sc= -2.71 (180deg=-2.91) USER MOD Single : A 45 ASN :FLIP amide:sc= -0.556 F(o=-1.9,f=-0.56) USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 ASN : amide:sc= -0.0556 X(o=-0.056,f=0.26) USER MOD Single : A 58 SER OG : rot 59:sc= 0.35 USER MOD Single : A 66 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 71 THR OG1 : rot -176:sc= -7.68! USER MOD Single : A 75 MET CE :methyl 150:sc= -0.123 (180deg=-0.723) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 GLN : amide:sc= -0.0434 X(o=-0.043,f=-0.34) 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 84 GLN : amide:sc= -5.22! C(o=-5.2!,f=-14!) USER MOD Single : A 86 LYS NZ :NH3+ 161:sc= 1.3 (180deg=1.11) USER MOD Single : A 88 ASN : amide:sc= -4.33! C(o=-4.3!,f=-7.4!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 ASN : amide:sc= -1.52 K(o=-1.5,f=-7.5!) 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= -2.53 K(o=-2.5,f=-11!) USER MOD Single : A 100 SER OG : rot -99:sc= 1.99 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot -129:sc= -1.48 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N CYS A 3 13.498 8.415 -0.516 1.00 0.00 N ATOM 2 CA CYS A 3 12.581 8.432 0.611 1.00 0.00 C ATOM 3 C CYS A 3 13.114 9.422 1.648 1.00 0.00 C ATOM 4 O CYS A 3 12.339 10.031 2.386 1.00 0.00 O ATOM 5 CB CYS A 3 12.385 7.035 1.202 1.00 0.00 C ATOM 6 SG CYS A 3 14.007 6.306 1.633 1.00 0.00 S ATOM 0 HA CYS A 3 11.595 8.754 0.277 1.00 0.00 H new ATOM 0 HB2 CYS A 3 11.755 7.092 2.090 1.00 0.00 H new ATOM 0 HB3 CYS A 3 11.869 6.397 0.485 1.00 0.00 H new ATOM 0 HG CYS A 3 14.958 7.029 1.120 1.00 0.00 H new ATOM 11 N THR A 4 14.432 9.552 1.674 1.00 0.00 N ATOM 12 CA THR A 4 15.077 10.456 2.610 1.00 0.00 C ATOM 13 C THR A 4 15.904 11.501 1.857 1.00 0.00 C ATOM 14 O THR A 4 16.530 12.364 2.471 1.00 0.00 O ATOM 15 CB THR A 4 15.903 9.617 3.586 1.00 0.00 C ATOM 16 OG1 THR A 4 16.412 10.569 4.518 1.00 0.00 O ATOM 17 CG2 THR A 4 17.156 9.026 2.936 1.00 0.00 C ATOM 0 H THR A 4 15.071 9.046 1.061 1.00 0.00 H new ATOM 0 HA THR A 4 14.342 11.020 3.185 1.00 0.00 H new ATOM 0 HB THR A 4 15.286 8.811 3.984 1.00 0.00 H new ATOM 0 HG1 THR A 4 16.612 11.408 4.052 1.00 0.00 H new ATOM 0 HG21 THR A 4 17.706 8.440 3.672 1.00 0.00 H new ATOM 0 HG22 THR A 4 16.866 8.384 2.104 1.00 0.00 H new ATOM 0 HG23 THR A 4 17.790 9.833 2.568 1.00 0.00 H new ATOM 25 N PHE A 5 15.880 11.389 0.537 1.00 0.00 N ATOM 26 CA PHE A 5 16.621 12.313 -0.306 1.00 0.00 C ATOM 27 C PHE A 5 16.099 13.742 -0.141 1.00 0.00 C ATOM 28 O PHE A 5 16.880 14.693 -0.119 1.00 0.00 O ATOM 29 CB PHE A 5 16.405 11.868 -1.754 1.00 0.00 C ATOM 30 CG PHE A 5 17.610 12.108 -2.665 1.00 0.00 C ATOM 31 CD1 PHE A 5 18.590 11.171 -2.758 1.00 0.00 C ATOM 32 CD2 PHE A 5 17.701 13.261 -3.381 1.00 0.00 C ATOM 33 CE1 PHE A 5 19.709 11.393 -3.603 1.00 0.00 C ATOM 34 CE2 PHE A 5 18.820 13.484 -4.227 1.00 0.00 C ATOM 35 CZ PHE A 5 19.800 12.546 -4.320 1.00 0.00 C ATOM 0 H PHE A 5 15.359 10.673 0.030 1.00 0.00 H new ATOM 0 HA PHE A 5 17.676 12.305 -0.031 1.00 0.00 H new ATOM 0 HB2 PHE A 5 16.161 10.806 -1.764 1.00 0.00 H new ATOM 0 HB3 PHE A 5 15.543 12.397 -2.161 1.00 0.00 H new ATOM 0 HD1 PHE A 5 18.517 10.256 -2.188 1.00 0.00 H new ATOM 0 HD2 PHE A 5 16.923 14.006 -3.306 1.00 0.00 H new ATOM 0 HE1 PHE A 5 20.487 10.648 -3.677 1.00 0.00 H new ATOM 0 HE2 PHE A 5 18.892 14.399 -4.797 1.00 0.00 H new ATOM 0 HZ PHE A 5 20.651 12.716 -4.963 1.00 0.00 H new ATOM 44 N PHE A 6 14.784 13.849 -0.030 1.00 0.00 N ATOM 45 CA PHE A 6 14.150 15.147 0.132 1.00 0.00 C ATOM 46 C PHE A 6 14.377 15.695 1.542 1.00 0.00 C ATOM 47 O PHE A 6 15.058 16.705 1.716 1.00 0.00 O ATOM 48 CB PHE A 6 12.649 14.941 -0.086 1.00 0.00 C ATOM 49 CG PHE A 6 11.979 16.059 -0.889 1.00 0.00 C ATOM 50 CD1 PHE A 6 11.786 17.280 -0.325 1.00 0.00 C ATOM 51 CD2 PHE A 6 11.577 15.828 -2.168 1.00 0.00 C ATOM 52 CE1 PHE A 6 11.164 18.317 -1.070 1.00 0.00 C ATOM 53 CE2 PHE A 6 10.955 16.865 -2.913 1.00 0.00 C ATOM 54 CZ PHE A 6 10.761 18.087 -2.349 1.00 0.00 C ATOM 0 H PHE A 6 14.139 13.059 -0.049 1.00 0.00 H new ATOM 0 HA PHE A 6 14.571 15.859 -0.578 1.00 0.00 H new ATOM 0 HB2 PHE A 6 12.494 13.993 -0.602 1.00 0.00 H new ATOM 0 HB3 PHE A 6 12.159 14.860 0.884 1.00 0.00 H new ATOM 0 HD1 PHE A 6 12.106 17.462 0.690 1.00 0.00 H new ATOM 0 HD2 PHE A 6 11.731 14.857 -2.616 1.00 0.00 H new ATOM 0 HE1 PHE A 6 11.011 19.287 -0.622 1.00 0.00 H new ATOM 0 HE2 PHE A 6 10.636 16.683 -3.929 1.00 0.00 H new ATOM 0 HZ PHE A 6 10.287 18.875 -2.916 1.00 0.00 H new ATOM 63 N GLU A 7 13.795 15.007 2.512 1.00 0.00 N ATOM 64 CA GLU A 7 13.925 15.413 3.901 1.00 0.00 C ATOM 65 C GLU A 7 13.621 14.235 4.830 1.00 0.00 C ATOM 66 O GLU A 7 14.536 13.572 5.316 1.00 0.00 O ATOM 67 CB GLU A 7 13.017 16.604 4.212 1.00 0.00 C ATOM 68 CG GLU A 7 13.838 17.832 4.610 1.00 0.00 C ATOM 69 CD GLU A 7 13.187 18.572 5.780 1.00 0.00 C ATOM 70 OE1 GLU A 7 11.943 18.688 5.756 1.00 0.00 O ATOM 71 OE2 GLU A 7 13.948 19.006 6.672 1.00 0.00 O ATOM 0 H GLU A 7 13.231 14.170 2.364 1.00 0.00 H new ATOM 0 HA GLU A 7 14.954 15.729 4.071 1.00 0.00 H new ATOM 0 HB2 GLU A 7 12.407 16.838 3.340 1.00 0.00 H new ATOM 0 HB3 GLU A 7 12.333 16.343 5.019 1.00 0.00 H new ATOM 0 HG2 GLU A 7 14.847 17.525 4.885 1.00 0.00 H new ATOM 0 HG3 GLU A 7 13.931 18.504 3.757 1.00 0.00 H new ATOM 76 N LYS A 8 12.334 14.011 5.046 1.00 0.00 N ATOM 77 CA LYS A 8 11.898 12.924 5.908 1.00 0.00 C ATOM 78 C LYS A 8 11.461 11.739 5.045 1.00 0.00 C ATOM 79 O LYS A 8 12.283 10.911 4.657 1.00 0.00 O ATOM 80 CB LYS A 8 10.821 13.409 6.879 1.00 0.00 C ATOM 81 CG LYS A 8 11.410 13.672 8.266 1.00 0.00 C ATOM 82 CD LYS A 8 10.491 14.575 9.091 1.00 0.00 C ATOM 83 CE LYS A 8 10.414 14.100 10.542 1.00 0.00 C ATOM 84 NZ LYS A 8 11.264 14.945 11.411 1.00 0.00 N ATOM 0 H LYS A 8 11.578 14.563 4.640 1.00 0.00 H new ATOM 0 HA LYS A 8 12.722 12.578 6.531 1.00 0.00 H new ATOM 0 HB2 LYS A 8 10.365 14.321 6.495 1.00 0.00 H new ATOM 0 HB3 LYS A 8 10.030 12.663 6.952 1.00 0.00 H new ATOM 0 HG2 LYS A 8 11.559 12.726 8.787 1.00 0.00 H new ATOM 0 HG3 LYS A 8 12.390 14.139 8.166 1.00 0.00 H new ATOM 0 HD2 LYS A 8 10.859 15.600 9.059 1.00 0.00 H new ATOM 0 HD3 LYS A 8 9.493 14.581 8.653 1.00 0.00 H new ATOM 0 HE2 LYS A 8 9.381 14.136 10.888 1.00 0.00 H new ATOM 0 HE3 LYS A 8 10.736 13.061 10.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 11.200 14.608 12.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 12.252 14.890 11.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 10.939 15.932 11.361 1.00 0.00 H new ATOM 94 N HIS A 9 10.165 11.696 4.769 1.00 0.00 N ATOM 95 CA HIS A 9 9.608 10.627 3.959 1.00 0.00 C ATOM 96 C HIS A 9 8.121 10.891 3.713 1.00 0.00 C ATOM 97 O HIS A 9 7.328 9.955 3.616 1.00 0.00 O ATOM 98 CB HIS A 9 9.869 9.265 4.603 1.00 0.00 C ATOM 99 CG HIS A 9 9.593 9.224 6.088 1.00 0.00 C ATOM 100 ND1 HIS A 9 8.891 10.218 6.746 1.00 0.00 N ATOM 101 CD2 HIS A 9 9.932 8.300 7.032 1.00 0.00 C ATOM 102 CE1 HIS A 9 8.817 9.897 8.029 1.00 0.00 C ATOM 103 NE2 HIS A 9 9.463 8.709 8.205 1.00 0.00 N ATOM 0 H HIS A 9 9.486 12.385 5.092 1.00 0.00 H new ATOM 0 HA HIS A 9 10.103 10.606 2.988 1.00 0.00 H new ATOM 0 HB2 HIS A 9 9.251 8.516 4.108 1.00 0.00 H new ATOM 0 HB3 HIS A 9 10.908 8.986 4.429 1.00 0.00 H new ATOM 0 HD2 HIS A 9 10.487 7.391 6.856 1.00 0.00 H new ATOM 0 HE1 HIS A 9 8.330 10.475 8.801 1.00 0.00 H new ATOM 0 HE2 HIS A 9 9.569 8.216 9.092 1.00 0.00 H new ATOM 110 N HIS A 10 7.787 12.169 3.618 1.00 0.00 N ATOM 111 CA HIS A 10 6.410 12.569 3.384 1.00 0.00 C ATOM 112 C HIS A 10 5.477 11.723 4.253 1.00 0.00 C ATOM 113 O HIS A 10 4.458 11.227 3.775 1.00 0.00 O ATOM 114 CB HIS A 10 6.067 12.492 1.895 1.00 0.00 C ATOM 115 CG HIS A 10 7.108 13.109 0.993 1.00 0.00 C ATOM 116 ND1 HIS A 10 6.848 14.204 0.188 1.00 0.00 N ATOM 117 CD2 HIS A 10 8.413 12.773 0.777 1.00 0.00 C ATOM 118 CE1 HIS A 10 7.953 14.505 -0.479 1.00 0.00 C ATOM 119 NE2 HIS A 10 8.922 13.617 -0.113 1.00 0.00 N ATOM 0 H HIS A 10 8.447 12.942 3.699 1.00 0.00 H new ATOM 0 HA HIS A 10 6.275 13.611 3.674 1.00 0.00 H new ATOM 0 HB2 HIS A 10 5.934 11.447 1.617 1.00 0.00 H new ATOM 0 HB3 HIS A 10 5.113 12.991 1.726 1.00 0.00 H new ATOM 0 HD1 HIS A 10 5.957 14.696 0.120 1.00 0.00 H new ATOM 0 HD2 HIS A 10 8.942 11.959 1.250 1.00 0.00 H new ATOM 0 HE1 HIS A 10 8.067 15.312 -1.188 1.00 0.00 H new ATOM 126 N ARG A 11 5.858 11.585 5.514 1.00 0.00 N ATOM 127 CA ARG A 11 5.067 10.808 6.453 1.00 0.00 C ATOM 128 C ARG A 11 5.308 9.312 6.239 1.00 0.00 C ATOM 129 O ARG A 11 4.384 8.508 6.352 1.00 0.00 O ATOM 130 CB ARG A 11 3.576 11.105 6.297 1.00 0.00 C ATOM 131 CG ARG A 11 2.842 10.948 7.630 1.00 0.00 C ATOM 132 CD ARG A 11 3.538 11.744 8.735 1.00 0.00 C ATOM 133 NE ARG A 11 4.299 10.830 9.616 1.00 0.00 N ATOM 134 CZ ARG A 11 4.789 11.175 10.814 1.00 0.00 C ATOM 135 NH1 ARG A 11 4.601 12.417 11.282 1.00 0.00 N ATOM 136 NH2 ARG A 11 5.468 10.280 11.543 1.00 0.00 N ATOM 0 H ARG A 11 6.704 11.998 5.907 1.00 0.00 H new ATOM 0 HA ARG A 11 5.377 11.090 7.459 1.00 0.00 H new ATOM 0 HB2 ARG A 11 3.441 12.119 5.921 1.00 0.00 H new ATOM 0 HB3 ARG A 11 3.143 10.431 5.558 1.00 0.00 H new ATOM 0 HG2 ARG A 11 1.812 11.289 7.525 1.00 0.00 H new ATOM 0 HG3 ARG A 11 2.802 9.894 7.906 1.00 0.00 H new ATOM 0 HD2 ARG A 11 4.210 12.481 8.295 1.00 0.00 H new ATOM 0 HD3 ARG A 11 2.800 12.294 9.319 1.00 0.00 H new ATOM 0 HE ARG A 11 4.461 9.877 9.290 1.00 0.00 H new ATOM 0 HH11 ARG A 11 4.085 13.099 10.726 1.00 0.00 H new ATOM 0 HH12 ARG A 11 4.974 12.680 12.194 1.00 0.00 H new ATOM 0 HH21 ARG A 11 5.612 9.335 11.186 1.00 0.00 H new ATOM 0 HH22 ARG A 11 5.841 10.543 12.455 1.00 0.00 H new ATOM 147 N LYS A 12 6.555 8.983 5.933 1.00 0.00 N ATOM 148 CA LYS A 12 6.928 7.598 5.701 1.00 0.00 C ATOM 149 C LYS A 12 5.958 6.973 4.698 1.00 0.00 C ATOM 150 O LYS A 12 5.659 5.783 4.775 1.00 0.00 O ATOM 151 CB LYS A 12 7.014 6.837 7.027 1.00 0.00 C ATOM 152 CG LYS A 12 5.623 6.612 7.622 1.00 0.00 C ATOM 153 CD LYS A 12 5.634 5.446 8.613 1.00 0.00 C ATOM 154 CE LYS A 12 6.763 5.603 9.632 1.00 0.00 C ATOM 155 NZ LYS A 12 6.387 6.581 10.678 1.00 0.00 N ATOM 0 H LYS A 12 7.319 9.652 5.840 1.00 0.00 H new ATOM 0 HA LYS A 12 7.923 7.541 5.260 1.00 0.00 H new ATOM 0 HB2 LYS A 12 7.505 5.877 6.868 1.00 0.00 H new ATOM 0 HB3 LYS A 12 7.629 7.396 7.732 1.00 0.00 H new ATOM 0 HG2 LYS A 12 5.288 7.519 8.125 1.00 0.00 H new ATOM 0 HG3 LYS A 12 4.910 6.408 6.823 1.00 0.00 H new ATOM 0 HD2 LYS A 12 4.676 5.395 9.131 1.00 0.00 H new ATOM 0 HD3 LYS A 12 5.754 4.507 8.073 1.00 0.00 H new ATOM 0 HE2 LYS A 12 6.984 4.639 10.090 1.00 0.00 H new ATOM 0 HE3 LYS A 12 7.672 5.932 9.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 7.094 7.343 10.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 5.454 6.983 10.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 6.349 6.104 11.602 1.00 0.00 H new ATOM 165 N TRP A 13 5.492 7.805 3.777 1.00 0.00 N ATOM 166 CA TRP A 13 4.562 7.350 2.758 1.00 0.00 C ATOM 167 C TRP A 13 5.336 6.479 1.767 1.00 0.00 C ATOM 168 O TRP A 13 4.880 5.397 1.398 1.00 0.00 O ATOM 169 CB TRP A 13 3.857 8.533 2.091 1.00 0.00 C ATOM 170 CG TRP A 13 2.533 8.921 2.751 1.00 0.00 C ATOM 171 CD1 TRP A 13 1.993 8.425 3.872 1.00 0.00 C ATOM 172 CD2 TRP A 13 1.597 9.914 2.282 1.00 0.00 C ATOM 173 NE1 TRP A 13 0.784 9.023 4.160 1.00 0.00 N ATOM 174 CE2 TRP A 13 0.535 9.957 3.160 1.00 0.00 C ATOM 175 CE3 TRP A 13 1.646 10.748 1.151 1.00 0.00 C ATOM 176 CZ2 TRP A 13 -0.558 10.818 3.002 1.00 0.00 C ATOM 177 CZ3 TRP A 13 0.547 11.602 1.006 1.00 0.00 C ATOM 178 CH2 TRP A 13 -0.531 11.658 1.882 1.00 0.00 C ATOM 0 H TRP A 13 5.742 8.792 3.716 1.00 0.00 H new ATOM 0 HA TRP A 13 3.767 6.750 3.201 1.00 0.00 H new ATOM 0 HB2 TRP A 13 4.524 9.395 2.105 1.00 0.00 H new ATOM 0 HB3 TRP A 13 3.672 8.290 1.045 1.00 0.00 H new ATOM 0 HD1 TRP A 13 2.448 7.653 4.475 1.00 0.00 H new ATOM 0 HE1 TRP A 13 0.184 8.818 4.959 1.00 0.00 H new ATOM 0 HE3 TRP A 13 2.467 10.731 0.450 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 -1.377 10.833 3.706 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 0.535 12.265 0.153 1.00 0.00 H new ATOM 0 HH2 TRP A 13 -1.343 12.346 1.700 1.00 0.00 H new ATOM 188 N ASP A 14 6.494 6.982 1.364 1.00 0.00 N ATOM 189 CA ASP A 14 7.335 6.262 0.422 1.00 0.00 C ATOM 190 C ASP A 14 8.081 5.148 1.159 1.00 0.00 C ATOM 191 O ASP A 14 8.443 4.137 0.560 1.00 0.00 O ATOM 192 CB ASP A 14 8.375 7.190 -0.208 1.00 0.00 C ATOM 193 CG ASP A 14 9.096 6.619 -1.429 1.00 0.00 C ATOM 194 OD1 ASP A 14 8.382 6.162 -2.348 1.00 0.00 O ATOM 195 OD2 ASP A 14 10.346 6.651 -1.417 1.00 0.00 O ATOM 0 H ASP A 14 6.870 7.879 1.672 1.00 0.00 H new ATOM 0 HA ASP A 14 6.694 5.855 -0.360 1.00 0.00 H new ATOM 0 HB2 ASP A 14 7.883 8.119 -0.497 1.00 0.00 H new ATOM 0 HB3 ASP A 14 9.118 7.444 0.548 1.00 0.00 H new ATOM 199 N ILE A 15 8.287 5.371 2.449 1.00 0.00 N ATOM 200 CA ILE A 15 8.984 4.398 3.274 1.00 0.00 C ATOM 201 C ILE A 15 8.043 3.231 3.580 1.00 0.00 C ATOM 202 O ILE A 15 8.477 2.080 3.644 1.00 0.00 O ATOM 203 CB ILE A 15 9.558 5.070 4.523 1.00 0.00 C ATOM 204 CG1 ILE A 15 10.689 6.033 4.157 1.00 0.00 C ATOM 205 CG2 ILE A 15 10.004 4.026 5.550 1.00 0.00 C ATOM 206 CD1 ILE A 15 11.911 5.272 3.639 1.00 0.00 C ATOM 0 H ILE A 15 7.984 6.210 2.943 1.00 0.00 H new ATOM 0 HA ILE A 15 9.840 3.986 2.740 1.00 0.00 H new ATOM 0 HB ILE A 15 8.769 5.662 4.986 1.00 0.00 H new ATOM 0 HG12 ILE A 15 10.343 6.733 3.397 1.00 0.00 H new ATOM 0 HG13 ILE A 15 10.967 6.622 5.031 1.00 0.00 H new ATOM 0 HG21 ILE A 15 10.408 4.529 6.428 1.00 0.00 H new ATOM 0 HG22 ILE A 15 9.150 3.415 5.843 1.00 0.00 H new ATOM 0 HG23 ILE A 15 10.772 3.389 5.111 1.00 0.00 H new ATOM 0 HD11 ILE A 15 12.700 5.980 3.386 1.00 0.00 H new ATOM 0 HD12 ILE A 15 12.269 4.590 4.410 1.00 0.00 H new ATOM 0 HD13 ILE A 15 11.636 4.703 2.751 1.00 0.00 H new ATOM 217 N LEU A 16 6.775 3.565 3.761 1.00 0.00 N ATOM 218 CA LEU A 16 5.770 2.559 4.060 1.00 0.00 C ATOM 219 C LEU A 16 5.341 1.872 2.761 1.00 0.00 C ATOM 220 O LEU A 16 5.073 0.672 2.747 1.00 0.00 O ATOM 221 CB LEU A 16 4.609 3.175 4.842 1.00 0.00 C ATOM 222 CG LEU A 16 3.688 2.189 5.565 1.00 0.00 C ATOM 223 CD1 LEU A 16 2.586 1.685 4.631 1.00 0.00 C ATOM 224 CD2 LEU A 16 4.489 1.039 6.179 1.00 0.00 C ATOM 0 H LEU A 16 6.419 4.519 3.706 1.00 0.00 H new ATOM 0 HA LEU A 16 6.185 1.787 4.708 1.00 0.00 H new ATOM 0 HB2 LEU A 16 5.019 3.865 5.579 1.00 0.00 H new ATOM 0 HB3 LEU A 16 4.006 3.766 4.153 1.00 0.00 H new ATOM 0 HG LEU A 16 3.200 2.715 6.386 1.00 0.00 H new ATOM 0 HD11 LEU A 16 1.945 0.986 5.168 1.00 0.00 H new ATOM 0 HD12 LEU A 16 1.991 2.529 4.282 1.00 0.00 H new ATOM 0 HD13 LEU A 16 3.036 1.181 3.776 1.00 0.00 H new ATOM 0 HD21 LEU A 16 3.811 0.353 6.686 1.00 0.00 H new ATOM 0 HD22 LEU A 16 5.022 0.506 5.392 1.00 0.00 H new ATOM 0 HD23 LEU A 16 5.206 1.438 6.897 1.00 0.00 H new ATOM 235 N LEU A 17 5.288 2.665 1.700 1.00 0.00 N ATOM 236 CA LEU A 17 4.896 2.149 0.400 1.00 0.00 C ATOM 237 C LEU A 17 6.041 1.318 -0.182 1.00 0.00 C ATOM 238 O LEU A 17 5.816 0.436 -1.009 1.00 0.00 O ATOM 239 CB LEU A 17 4.438 3.289 -0.513 1.00 0.00 C ATOM 240 CG LEU A 17 4.324 2.952 -2.001 1.00 0.00 C ATOM 241 CD1 LEU A 17 5.707 2.814 -2.639 1.00 0.00 C ATOM 242 CD2 LEU A 17 3.465 1.704 -2.217 1.00 0.00 C ATOM 0 H LEU A 17 5.510 3.660 1.715 1.00 0.00 H new ATOM 0 HA LEU A 17 4.038 1.484 0.498 1.00 0.00 H new ATOM 0 HB2 LEU A 17 3.466 3.639 -0.165 1.00 0.00 H new ATOM 0 HB3 LEU A 17 5.135 4.120 -0.401 1.00 0.00 H new ATOM 0 HG LEU A 17 3.820 3.779 -2.501 1.00 0.00 H new ATOM 0 HD11 LEU A 17 5.597 2.574 -3.697 1.00 0.00 H new ATOM 0 HD12 LEU A 17 6.251 3.752 -2.534 1.00 0.00 H new ATOM 0 HD13 LEU A 17 6.259 2.017 -2.142 1.00 0.00 H new ATOM 0 HD21 LEU A 17 3.400 1.487 -3.283 1.00 0.00 H new ATOM 0 HD22 LEU A 17 3.917 0.857 -1.701 1.00 0.00 H new ATOM 0 HD23 LEU A 17 2.465 1.878 -1.821 1.00 0.00 H new ATOM 253 N GLU A 18 7.246 1.629 0.274 1.00 0.00 N ATOM 254 CA GLU A 18 8.427 0.923 -0.190 1.00 0.00 C ATOM 255 C GLU A 18 8.763 -0.230 0.759 1.00 0.00 C ATOM 256 O GLU A 18 9.440 -1.182 0.371 1.00 0.00 O ATOM 257 CB GLU A 18 9.615 1.876 -0.336 1.00 0.00 C ATOM 258 CG GLU A 18 10.831 1.152 -0.919 1.00 0.00 C ATOM 259 CD GLU A 18 11.555 2.031 -1.940 1.00 0.00 C ATOM 260 OE1 GLU A 18 10.869 2.500 -2.873 1.00 0.00 O ATOM 261 OE2 GLU A 18 12.779 2.215 -1.764 1.00 0.00 O ATOM 0 H GLU A 18 7.429 2.361 0.960 1.00 0.00 H new ATOM 0 HA GLU A 18 8.214 0.508 -1.175 1.00 0.00 H new ATOM 0 HB2 GLU A 18 9.340 2.710 -0.982 1.00 0.00 H new ATOM 0 HB3 GLU A 18 9.870 2.297 0.637 1.00 0.00 H new ATOM 0 HG2 GLU A 18 11.517 0.881 -0.116 1.00 0.00 H new ATOM 0 HG3 GLU A 18 10.513 0.224 -1.394 1.00 0.00 H new ATOM 266 N LYS A 19 8.276 -0.107 1.985 1.00 0.00 N ATOM 267 CA LYS A 19 8.516 -1.126 2.992 1.00 0.00 C ATOM 268 C LYS A 19 7.604 -2.324 2.726 1.00 0.00 C ATOM 269 O LYS A 19 8.024 -3.473 2.864 1.00 0.00 O ATOM 270 CB LYS A 19 8.365 -0.538 4.396 1.00 0.00 C ATOM 271 CG LYS A 19 9.700 0.006 4.909 1.00 0.00 C ATOM 272 CD LYS A 19 9.532 0.667 6.279 1.00 0.00 C ATOM 273 CE LYS A 19 10.414 -0.013 7.328 1.00 0.00 C ATOM 274 NZ LYS A 19 10.453 0.788 8.571 1.00 0.00 N ATOM 0 H LYS A 19 7.716 0.684 2.304 1.00 0.00 H new ATOM 0 HA LYS A 19 9.543 -1.487 2.932 1.00 0.00 H new ATOM 0 HB2 LYS A 19 7.624 0.261 4.382 1.00 0.00 H new ATOM 0 HB3 LYS A 19 7.995 -1.304 5.077 1.00 0.00 H new ATOM 0 HG2 LYS A 19 10.425 -0.805 4.979 1.00 0.00 H new ATOM 0 HG3 LYS A 19 10.099 0.730 4.198 1.00 0.00 H new ATOM 0 HD2 LYS A 19 9.791 1.724 6.211 1.00 0.00 H new ATOM 0 HD3 LYS A 19 8.488 0.614 6.587 1.00 0.00 H new ATOM 0 HE2 LYS A 19 10.030 -1.010 7.543 1.00 0.00 H new ATOM 0 HE3 LYS A 19 11.424 -0.138 6.937 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 11.056 0.312 9.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 10.840 1.731 8.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 9.490 0.885 8.952 1.00 0.00 H new ATOM 284 N SER A 20 6.371 -2.017 2.348 1.00 0.00 N ATOM 285 CA SER A 20 5.396 -3.056 2.062 1.00 0.00 C ATOM 286 C SER A 20 6.093 -4.275 1.456 1.00 0.00 C ATOM 287 O SER A 20 6.032 -5.371 2.014 1.00 0.00 O ATOM 288 CB SER A 20 4.307 -2.542 1.117 1.00 0.00 C ATOM 289 OG SER A 20 4.854 -1.838 0.006 1.00 0.00 O ATOM 0 H SER A 20 6.025 -1.064 2.233 1.00 0.00 H new ATOM 0 HA SER A 20 4.920 -3.347 2.998 1.00 0.00 H new ATOM 0 HB2 SER A 20 3.713 -3.382 0.757 1.00 0.00 H new ATOM 0 HB3 SER A 20 3.631 -1.886 1.665 1.00 0.00 H new ATOM 0 HG SER A 20 4.842 -0.876 0.191 1.00 0.00 H new ATOM 294 N THR A 21 6.739 -4.046 0.323 1.00 0.00 N ATOM 295 CA THR A 21 7.446 -5.113 -0.365 1.00 0.00 C ATOM 296 C THR A 21 6.495 -5.872 -1.293 1.00 0.00 C ATOM 297 O THR A 21 6.875 -6.253 -2.399 1.00 0.00 O ATOM 298 CB THR A 21 8.102 -6.003 0.693 1.00 0.00 C ATOM 299 OG1 THR A 21 9.229 -6.564 0.024 1.00 0.00 O ATOM 300 CG2 THR A 21 7.241 -7.216 1.053 1.00 0.00 C ATOM 0 H THR A 21 6.788 -3.137 -0.137 1.00 0.00 H new ATOM 0 HA THR A 21 8.230 -4.717 -1.010 1.00 0.00 H new ATOM 0 HB THR A 21 8.297 -5.416 1.591 1.00 0.00 H new ATOM 0 HG1 THR A 21 9.943 -6.736 0.673 1.00 0.00 H new ATOM 0 HG21 THR A 21 7.752 -7.814 1.807 1.00 0.00 H new ATOM 0 HG22 THR A 21 6.282 -6.878 1.446 1.00 0.00 H new ATOM 0 HG23 THR A 21 7.074 -7.821 0.162 1.00 0.00 H new ATOM 308 N GLY A 22 5.279 -6.068 -0.808 1.00 0.00 N ATOM 309 CA GLY A 22 4.270 -6.774 -1.581 1.00 0.00 C ATOM 310 C GLY A 22 4.709 -8.211 -1.870 1.00 0.00 C ATOM 311 O GLY A 22 3.968 -8.978 -2.483 1.00 0.00 O ATOM 0 H GLY A 22 4.968 -5.751 0.110 1.00 0.00 H new ATOM 0 HA2 GLY A 22 3.327 -6.781 -1.035 1.00 0.00 H new ATOM 0 HA3 GLY A 22 4.091 -6.249 -2.519 1.00 0.00 H new ATOM 315 N VAL A 23 5.912 -8.532 -1.416 1.00 0.00 N ATOM 316 CA VAL A 23 6.458 -9.863 -1.620 1.00 0.00 C ATOM 317 C VAL A 23 5.562 -10.889 -0.922 1.00 0.00 C ATOM 318 O VAL A 23 5.538 -12.058 -1.303 1.00 0.00 O ATOM 319 CB VAL A 23 7.910 -9.912 -1.140 1.00 0.00 C ATOM 320 CG1 VAL A 23 8.539 -11.275 -1.435 1.00 0.00 C ATOM 321 CG2 VAL A 23 8.732 -8.782 -1.764 1.00 0.00 C ATOM 0 H VAL A 23 6.524 -7.893 -0.908 1.00 0.00 H new ATOM 0 HA VAL A 23 6.472 -10.112 -2.681 1.00 0.00 H new ATOM 0 HB VAL A 23 7.911 -9.770 -0.059 1.00 0.00 H new ATOM 0 HG11 VAL A 23 9.571 -11.283 -1.084 1.00 0.00 H new ATOM 0 HG12 VAL A 23 7.975 -12.054 -0.923 1.00 0.00 H new ATOM 0 HG13 VAL A 23 8.520 -11.460 -2.509 1.00 0.00 H new ATOM 0 HG21 VAL A 23 9.760 -8.840 -1.406 1.00 0.00 H new ATOM 0 HG22 VAL A 23 8.719 -8.880 -2.850 1.00 0.00 H new ATOM 0 HG23 VAL A 23 8.303 -7.821 -1.481 1.00 0.00 H new ATOM 331 N MET A 24 4.849 -10.413 0.089 1.00 0.00 N ATOM 332 CA MET A 24 3.955 -11.275 0.843 1.00 0.00 C ATOM 333 C MET A 24 4.719 -12.050 1.919 1.00 0.00 C ATOM 334 O MET A 24 4.252 -13.085 2.393 1.00 0.00 O ATOM 335 CB MET A 24 3.272 -12.260 -0.107 1.00 0.00 C ATOM 336 CG MET A 24 4.029 -13.589 -0.156 1.00 0.00 C ATOM 337 SD MET A 24 3.100 -14.853 0.693 1.00 0.00 S ATOM 338 CE MET A 24 4.438 -15.853 1.320 1.00 0.00 C ATOM 0 H MET A 24 4.872 -9.443 0.403 1.00 0.00 H new ATOM 0 HA MET A 24 3.207 -10.651 1.332 1.00 0.00 H new ATOM 0 HB2 MET A 24 2.246 -12.433 0.219 1.00 0.00 H new ATOM 0 HB3 MET A 24 3.220 -11.830 -1.107 1.00 0.00 H new ATOM 0 HG2 MET A 24 4.196 -13.883 -1.192 1.00 0.00 H new ATOM 0 HG3 MET A 24 5.010 -13.475 0.306 1.00 0.00 H new ATOM 0 HE1 MET A 24 4.251 -16.900 1.083 1.00 0.00 H new ATOM 0 HE2 MET A 24 5.374 -15.538 0.859 1.00 0.00 H new ATOM 0 HE3 MET A 24 4.507 -15.732 2.401 1.00 0.00 H new ATOM 346 N GLU A 25 5.879 -11.517 2.275 1.00 0.00 N ATOM 347 CA GLU A 25 6.711 -12.147 3.286 1.00 0.00 C ATOM 348 C GLU A 25 7.958 -11.299 3.550 1.00 0.00 C ATOM 349 O GLU A 25 8.388 -11.160 4.693 1.00 0.00 O ATOM 350 CB GLU A 25 7.093 -13.570 2.876 1.00 0.00 C ATOM 351 CG GLU A 25 7.217 -14.478 4.101 1.00 0.00 C ATOM 352 CD GLU A 25 6.809 -15.914 3.763 1.00 0.00 C ATOM 353 OE1 GLU A 25 6.988 -16.292 2.585 1.00 0.00 O ATOM 354 OE2 GLU A 25 6.328 -16.601 4.689 1.00 0.00 O ATOM 0 H GLU A 25 6.262 -10.657 1.882 1.00 0.00 H new ATOM 0 HA GLU A 25 6.137 -12.214 4.210 1.00 0.00 H new ATOM 0 HB2 GLU A 25 6.341 -13.971 2.196 1.00 0.00 H new ATOM 0 HB3 GLU A 25 8.038 -13.555 2.333 1.00 0.00 H new ATOM 0 HG2 GLU A 25 8.244 -14.464 4.466 1.00 0.00 H new ATOM 0 HG3 GLU A 25 6.588 -14.097 4.906 1.00 0.00 H new ATOM 359 N ALA A 26 8.503 -10.756 2.471 1.00 0.00 N ATOM 360 CA ALA A 26 9.692 -9.926 2.571 1.00 0.00 C ATOM 361 C ALA A 26 9.432 -8.786 3.557 1.00 0.00 C ATOM 362 O ALA A 26 10.367 -8.141 4.028 1.00 0.00 O ATOM 363 CB ALA A 26 10.078 -9.417 1.180 1.00 0.00 C ATOM 0 H ALA A 26 8.144 -10.874 1.524 1.00 0.00 H new ATOM 0 HA ALA A 26 10.533 -10.505 2.952 1.00 0.00 H new ATOM 0 HB1 ALA A 26 10.970 -8.795 1.255 1.00 0.00 H new ATOM 0 HB2 ALA A 26 10.281 -10.265 0.526 1.00 0.00 H new ATOM 0 HB3 ALA A 26 9.258 -8.829 0.767 1.00 0.00 H new ATOM 369 N MET A 27 8.155 -8.572 3.842 1.00 0.00 N ATOM 370 CA MET A 27 7.760 -7.521 4.763 1.00 0.00 C ATOM 371 C MET A 27 6.241 -7.341 4.771 1.00 0.00 C ATOM 372 O MET A 27 5.745 -6.224 4.918 1.00 0.00 O ATOM 373 CB MET A 27 8.428 -6.206 4.356 1.00 0.00 C ATOM 374 CG MET A 27 9.268 -5.639 5.503 1.00 0.00 C ATOM 375 SD MET A 27 8.201 -5.059 6.811 1.00 0.00 S ATOM 376 CE MET A 27 8.542 -6.291 8.057 1.00 0.00 C ATOM 0 H MET A 27 7.381 -9.109 3.451 1.00 0.00 H new ATOM 0 HA MET A 27 8.079 -7.805 5.766 1.00 0.00 H new ATOM 0 HB2 MET A 27 9.061 -6.370 3.484 1.00 0.00 H new ATOM 0 HB3 MET A 27 7.667 -5.482 4.066 1.00 0.00 H new ATOM 0 HG2 MET A 27 9.942 -6.406 5.885 1.00 0.00 H new ATOM 0 HG3 MET A 27 9.890 -4.821 5.140 1.00 0.00 H new ATOM 0 HE1 MET A 27 8.511 -5.829 9.044 1.00 0.00 H new ATOM 0 HE2 MET A 27 7.793 -7.081 8.002 1.00 0.00 H new ATOM 0 HE3 MET A 27 9.531 -6.717 7.887 1.00 0.00 H new ATOM 384 N LYS A 28 5.544 -8.457 4.612 1.00 0.00 N ATOM 385 CA LYS A 28 4.091 -8.436 4.599 1.00 0.00 C ATOM 386 C LYS A 28 3.562 -9.527 5.534 1.00 0.00 C ATOM 387 O LYS A 28 2.352 -9.689 5.680 1.00 0.00 O ATOM 388 CB LYS A 28 3.567 -8.546 3.166 1.00 0.00 C ATOM 389 CG LYS A 28 4.022 -7.355 2.323 1.00 0.00 C ATOM 390 CD LYS A 28 3.408 -6.051 2.837 1.00 0.00 C ATOM 391 CE LYS A 28 2.495 -5.422 1.783 1.00 0.00 C ATOM 392 NZ LYS A 28 1.931 -4.147 2.281 1.00 0.00 N ATOM 0 H LYS A 28 5.958 -9.381 4.491 1.00 0.00 H new ATOM 0 HA LYS A 28 3.719 -7.484 4.977 1.00 0.00 H new ATOM 0 HB2 LYS A 28 3.923 -9.472 2.715 1.00 0.00 H new ATOM 0 HB3 LYS A 28 2.478 -8.594 3.176 1.00 0.00 H new ATOM 0 HG2 LYS A 28 5.109 -7.283 2.347 1.00 0.00 H new ATOM 0 HG3 LYS A 28 3.735 -7.511 1.283 1.00 0.00 H new ATOM 0 HD2 LYS A 28 2.839 -6.246 3.746 1.00 0.00 H new ATOM 0 HD3 LYS A 28 4.201 -5.351 3.101 1.00 0.00 H new ATOM 0 HE2 LYS A 28 3.057 -5.245 0.866 1.00 0.00 H new ATOM 0 HE3 LYS A 28 1.688 -6.111 1.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 1.327 -3.724 1.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 1.364 -4.328 3.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 2.705 -3.492 2.512 1.00 0.00 H new ATOM 402 N VAL A 29 4.495 -10.244 6.142 1.00 0.00 N ATOM 403 CA VAL A 29 4.137 -11.314 7.057 1.00 0.00 C ATOM 404 C VAL A 29 3.850 -10.722 8.439 1.00 0.00 C ATOM 405 O VAL A 29 4.357 -11.213 9.446 1.00 0.00 O ATOM 406 CB VAL A 29 5.239 -12.375 7.079 1.00 0.00 C ATOM 407 CG1 VAL A 29 6.524 -11.818 7.696 1.00 0.00 C ATOM 408 CG2 VAL A 29 4.776 -13.632 7.817 1.00 0.00 C ATOM 0 H VAL A 29 5.498 -10.105 6.019 1.00 0.00 H new ATOM 0 HA VAL A 29 3.229 -11.815 6.722 1.00 0.00 H new ATOM 0 HB VAL A 29 5.456 -12.654 6.048 1.00 0.00 H new ATOM 0 HG11 VAL A 29 7.291 -12.592 7.700 1.00 0.00 H new ATOM 0 HG12 VAL A 29 6.870 -10.967 7.109 1.00 0.00 H new ATOM 0 HG13 VAL A 29 6.327 -11.498 8.719 1.00 0.00 H new ATOM 0 HG21 VAL A 29 5.578 -14.370 7.818 1.00 0.00 H new ATOM 0 HG22 VAL A 29 4.517 -13.376 8.844 1.00 0.00 H new ATOM 0 HG23 VAL A 29 3.902 -14.047 7.315 1.00 0.00 H new ATOM 418 N THR A 30 3.038 -9.675 8.442 1.00 0.00 N ATOM 419 CA THR A 30 2.678 -9.011 9.683 1.00 0.00 C ATOM 420 C THR A 30 1.213 -9.284 10.028 1.00 0.00 C ATOM 421 O THR A 30 0.436 -8.352 10.236 1.00 0.00 O ATOM 422 CB THR A 30 3.001 -7.523 9.534 1.00 0.00 C ATOM 423 OG1 THR A 30 4.352 -7.414 9.973 1.00 0.00 O ATOM 424 CG2 THR A 30 2.218 -6.653 10.519 1.00 0.00 C ATOM 0 H THR A 30 2.619 -9.270 7.605 1.00 0.00 H new ATOM 0 HA THR A 30 3.254 -9.401 10.522 1.00 0.00 H new ATOM 0 HB THR A 30 2.782 -7.205 8.515 1.00 0.00 H new ATOM 0 HG1 THR A 30 4.643 -6.480 9.908 1.00 0.00 H new ATOM 0 HG21 THR A 30 2.484 -5.606 10.371 1.00 0.00 H new ATOM 0 HG22 THR A 30 1.149 -6.783 10.349 1.00 0.00 H new ATOM 0 HG23 THR A 30 2.462 -6.949 11.539 1.00 0.00 H new ATOM 432 N SER A 31 0.878 -10.564 10.077 1.00 0.00 N ATOM 433 CA SER A 31 -0.481 -10.972 10.393 1.00 0.00 C ATOM 434 C SER A 31 -1.407 -10.661 9.216 1.00 0.00 C ATOM 435 O SER A 31 -2.628 -10.746 9.342 1.00 0.00 O ATOM 436 CB SER A 31 -0.983 -10.277 11.661 1.00 0.00 C ATOM 437 OG SER A 31 -1.283 -11.209 12.696 1.00 0.00 O ATOM 0 H SER A 31 1.524 -11.334 9.903 1.00 0.00 H new ATOM 0 HA SER A 31 -0.483 -12.047 10.575 1.00 0.00 H new ATOM 0 HB2 SER A 31 -0.227 -9.575 12.013 1.00 0.00 H new ATOM 0 HB3 SER A 31 -1.875 -9.695 11.427 1.00 0.00 H new ATOM 0 HG SER A 31 -1.598 -10.727 13.489 1.00 0.00 H new ATOM 442 N GLU A 32 -0.792 -10.306 8.097 1.00 0.00 N ATOM 443 CA GLU A 32 -1.545 -9.983 6.898 1.00 0.00 C ATOM 444 C GLU A 32 -2.429 -8.758 7.141 1.00 0.00 C ATOM 445 O GLU A 32 -2.097 -7.654 6.712 1.00 0.00 O ATOM 446 CB GLU A 32 -2.381 -11.179 6.437 1.00 0.00 C ATOM 447 CG GLU A 32 -1.549 -12.130 5.575 1.00 0.00 C ATOM 448 CD GLU A 32 -1.965 -13.584 5.804 1.00 0.00 C ATOM 449 OE1 GLU A 32 -2.205 -13.927 6.982 1.00 0.00 O ATOM 450 OE2 GLU A 32 -2.034 -14.320 4.795 1.00 0.00 O ATOM 0 H GLU A 32 0.221 -10.235 7.996 1.00 0.00 H new ATOM 0 HA GLU A 32 -0.839 -9.746 6.102 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -2.767 -11.713 7.305 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -3.243 -10.828 5.869 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -1.672 -11.874 4.523 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -0.492 -12.009 5.811 1.00 0.00 H new ATOM 455 N GLU A 33 -3.536 -8.993 7.828 1.00 0.00 N ATOM 456 CA GLU A 33 -4.470 -7.922 8.134 1.00 0.00 C ATOM 457 C GLU A 33 -3.720 -6.700 8.667 1.00 0.00 C ATOM 458 O GLU A 33 -4.081 -5.564 8.364 1.00 0.00 O ATOM 459 CB GLU A 33 -5.534 -8.389 9.129 1.00 0.00 C ATOM 460 CG GLU A 33 -6.940 -8.041 8.634 1.00 0.00 C ATOM 461 CD GLU A 33 -7.779 -9.305 8.431 1.00 0.00 C ATOM 462 OE1 GLU A 33 -7.552 -9.977 7.402 1.00 0.00 O ATOM 463 OE2 GLU A 33 -8.627 -9.569 9.310 1.00 0.00 O ATOM 0 H GLU A 33 -3.808 -9.910 8.182 1.00 0.00 H new ATOM 0 HA GLU A 33 -4.980 -7.638 7.214 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -5.452 -9.466 9.275 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -5.360 -7.922 10.098 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -7.431 -7.386 9.354 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -6.873 -7.490 7.696 1.00 0.00 H new ATOM 468 N LYS A 34 -2.689 -6.975 9.453 1.00 0.00 N ATOM 469 CA LYS A 34 -1.884 -5.912 10.031 1.00 0.00 C ATOM 470 C LYS A 34 -0.754 -5.551 9.066 1.00 0.00 C ATOM 471 O LYS A 34 -0.171 -4.472 9.161 1.00 0.00 O ATOM 472 CB LYS A 34 -1.400 -6.305 11.428 1.00 0.00 C ATOM 473 CG LYS A 34 -2.429 -5.921 12.493 1.00 0.00 C ATOM 474 CD LYS A 34 -3.479 -7.021 12.663 1.00 0.00 C ATOM 475 CE LYS A 34 -3.942 -7.118 14.117 1.00 0.00 C ATOM 476 NZ LYS A 34 -5.416 -7.232 14.187 1.00 0.00 N ATOM 0 H LYS A 34 -2.393 -7.918 9.703 1.00 0.00 H new ATOM 0 HA LYS A 34 -2.484 -5.012 10.169 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -1.217 -7.379 11.465 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -0.451 -5.813 11.640 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -1.925 -5.744 13.443 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -2.917 -4.988 12.212 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -4.334 -6.815 12.019 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -3.063 -7.977 12.346 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -3.482 -7.983 14.594 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -3.613 -6.237 14.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -5.712 -7.297 15.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -5.850 -6.394 13.750 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -5.723 -8.086 13.678 1.00 0.00 H new ATOM 486 N GLU A 35 -0.475 -6.477 8.160 1.00 0.00 N ATOM 487 CA GLU A 35 0.577 -6.271 7.178 1.00 0.00 C ATOM 488 C GLU A 35 0.307 -5.001 6.370 1.00 0.00 C ATOM 489 O GLU A 35 1.238 -4.359 5.887 1.00 0.00 O ATOM 490 CB GLU A 35 0.716 -7.487 6.260 1.00 0.00 C ATOM 491 CG GLU A 35 -0.219 -7.372 5.053 1.00 0.00 C ATOM 492 CD GLU A 35 0.513 -6.782 3.847 1.00 0.00 C ATOM 493 OE1 GLU A 35 0.857 -5.582 3.922 1.00 0.00 O ATOM 494 OE2 GLU A 35 0.714 -7.544 2.876 1.00 0.00 O ATOM 0 H GLU A 35 -0.959 -7.372 8.085 1.00 0.00 H new ATOM 0 HA GLU A 35 1.522 -6.147 7.707 1.00 0.00 H new ATOM 0 HB2 GLU A 35 1.748 -7.574 5.919 1.00 0.00 H new ATOM 0 HB3 GLU A 35 0.487 -8.396 6.817 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -0.613 -8.356 4.798 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -1.072 -6.744 5.308 1.00 0.00 H new ATOM 499 N GLN A 36 -0.972 -4.676 6.247 1.00 0.00 N ATOM 500 CA GLN A 36 -1.376 -3.494 5.505 1.00 0.00 C ATOM 501 C GLN A 36 -2.076 -2.499 6.433 1.00 0.00 C ATOM 502 O GLN A 36 -2.131 -1.306 6.140 1.00 0.00 O ATOM 503 CB GLN A 36 -2.275 -3.868 4.325 1.00 0.00 C ATOM 504 CG GLN A 36 -1.521 -3.738 2.999 1.00 0.00 C ATOM 505 CD GLN A 36 -1.642 -2.321 2.437 1.00 0.00 C ATOM 506 OE1 GLN A 36 -2.680 -1.904 1.949 1.00 0.00 O ATOM 507 NE2 GLN A 36 -0.526 -1.604 2.533 1.00 0.00 N ATOM 0 H GLN A 36 -1.742 -5.211 6.649 1.00 0.00 H new ATOM 0 HA GLN A 36 -0.482 -3.019 5.102 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -2.633 -4.891 4.445 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -3.153 -3.222 4.313 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -0.470 -3.985 3.148 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -1.918 -4.454 2.279 1.00 0.00 H new ATOM 0 HE21 GLN A 36 0.309 -2.013 2.953 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -0.505 -0.645 2.187 1.00 0.00 H new ATOM 514 N LEU A 37 -2.593 -3.027 7.532 1.00 0.00 N ATOM 515 CA LEU A 37 -3.288 -2.200 8.505 1.00 0.00 C ATOM 516 C LEU A 37 -2.268 -1.592 9.471 1.00 0.00 C ATOM 517 O LEU A 37 -2.151 -0.371 9.568 1.00 0.00 O ATOM 518 CB LEU A 37 -4.391 -3.000 9.198 1.00 0.00 C ATOM 519 CG LEU A 37 -5.565 -3.427 8.316 1.00 0.00 C ATOM 520 CD1 LEU A 37 -6.370 -4.547 8.978 1.00 0.00 C ATOM 521 CD2 LEU A 37 -6.443 -2.228 7.952 1.00 0.00 C ATOM 0 H LEU A 37 -2.545 -4.017 7.771 1.00 0.00 H new ATOM 0 HA LEU A 37 -3.793 -1.371 8.010 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -3.945 -3.894 9.633 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -4.780 -2.404 10.024 1.00 0.00 H new ATOM 0 HG LEU A 37 -5.164 -3.826 7.385 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -7.199 -4.832 8.330 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -5.725 -5.410 9.143 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -6.761 -4.198 9.934 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -7.270 -2.560 7.324 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -6.837 -1.776 8.862 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -5.848 -1.493 7.410 1.00 0.00 H new ATOM 532 N SER A 38 -1.557 -2.472 10.161 1.00 0.00 N ATOM 533 CA SER A 38 -0.552 -2.037 11.116 1.00 0.00 C ATOM 534 C SER A 38 0.572 -1.293 10.390 1.00 0.00 C ATOM 535 O SER A 38 1.328 -0.546 11.010 1.00 0.00 O ATOM 536 CB SER A 38 0.015 -3.224 11.897 1.00 0.00 C ATOM 537 OG SER A 38 -0.956 -3.808 12.760 1.00 0.00 O ATOM 0 H SER A 38 -1.657 -3.484 10.078 1.00 0.00 H new ATOM 0 HA SER A 38 -1.026 -1.361 11.828 1.00 0.00 H new ATOM 0 HB2 SER A 38 0.379 -3.977 11.198 1.00 0.00 H new ATOM 0 HB3 SER A 38 0.872 -2.895 12.485 1.00 0.00 H new ATOM 0 HG SER A 38 -0.509 -4.195 13.541 1.00 0.00 H new ATOM 542 N THR A 39 0.647 -1.524 9.088 1.00 0.00 N ATOM 543 CA THR A 39 1.666 -0.886 8.272 1.00 0.00 C ATOM 544 C THR A 39 1.125 0.409 7.661 1.00 0.00 C ATOM 545 O THR A 39 1.891 1.322 7.356 1.00 0.00 O ATOM 546 CB THR A 39 2.139 -1.898 7.228 1.00 0.00 C ATOM 547 OG1 THR A 39 0.990 -2.123 6.415 1.00 0.00 O ATOM 548 CG2 THR A 39 2.439 -3.270 7.837 1.00 0.00 C ATOM 0 H THR A 39 0.019 -2.144 8.578 1.00 0.00 H new ATOM 0 HA THR A 39 2.527 -0.592 8.873 1.00 0.00 H new ATOM 0 HB THR A 39 3.032 -1.517 6.732 1.00 0.00 H new ATOM 0 HG1 THR A 39 1.141 -2.906 5.845 1.00 0.00 H new ATOM 0 HG21 THR A 39 2.771 -3.951 7.053 1.00 0.00 H new ATOM 0 HG22 THR A 39 3.223 -3.171 8.588 1.00 0.00 H new ATOM 0 HG23 THR A 39 1.537 -3.666 8.304 1.00 0.00 H new ATOM 556 N ALA A 40 -0.189 0.447 7.501 1.00 0.00 N ATOM 557 CA ALA A 40 -0.841 1.614 6.932 1.00 0.00 C ATOM 558 C ALA A 40 -1.596 2.359 8.035 1.00 0.00 C ATOM 559 O ALA A 40 -2.272 3.352 7.767 1.00 0.00 O ATOM 560 CB ALA A 40 -1.758 1.180 5.788 1.00 0.00 C ATOM 0 H ALA A 40 -0.821 -0.312 7.756 1.00 0.00 H new ATOM 0 HA ALA A 40 -0.104 2.301 6.515 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -2.247 2.056 5.361 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -1.169 0.682 5.018 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -2.513 0.492 6.168 1.00 0.00 H new ATOM 566 N ILE A 41 -1.456 1.851 9.250 1.00 0.00 N ATOM 567 CA ILE A 41 -2.117 2.457 10.394 1.00 0.00 C ATOM 568 C ILE A 41 -1.062 2.914 11.403 1.00 0.00 C ATOM 569 O ILE A 41 -1.224 3.949 12.050 1.00 0.00 O ATOM 570 CB ILE A 41 -3.155 1.498 10.981 1.00 0.00 C ATOM 571 CG1 ILE A 41 -4.293 2.269 11.654 1.00 0.00 C ATOM 572 CG2 ILE A 41 -2.499 0.496 11.935 1.00 0.00 C ATOM 573 CD1 ILE A 41 -3.887 2.736 13.053 1.00 0.00 C ATOM 0 H ILE A 41 -0.895 1.027 9.468 1.00 0.00 H new ATOM 0 HA ILE A 41 -2.672 3.344 10.089 1.00 0.00 H new ATOM 0 HB ILE A 41 -3.592 0.925 10.163 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -4.564 3.130 11.044 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -5.177 1.635 11.721 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -3.259 -0.174 12.338 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -1.752 -0.086 11.394 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -2.018 1.033 12.753 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -4.714 3.281 13.509 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -3.640 1.871 13.668 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -3.018 3.390 12.980 1.00 0.00 H new ATOM 584 N ASP A 42 -0.005 2.122 11.508 1.00 0.00 N ATOM 585 CA ASP A 42 1.075 2.434 12.428 1.00 0.00 C ATOM 586 C ASP A 42 1.143 3.948 12.635 1.00 0.00 C ATOM 587 O ASP A 42 0.913 4.439 13.739 1.00 0.00 O ATOM 588 CB ASP A 42 2.423 1.972 11.871 1.00 0.00 C ATOM 589 CG ASP A 42 3.238 1.078 12.808 1.00 0.00 C ATOM 590 OD1 ASP A 42 3.438 1.504 13.966 1.00 0.00 O ATOM 591 OD2 ASP A 42 3.643 -0.010 12.344 1.00 0.00 O ATOM 0 H ASP A 42 0.126 1.265 10.971 1.00 0.00 H new ATOM 0 HA ASP A 42 0.877 1.918 13.368 1.00 0.00 H new ATOM 0 HB2 ASP A 42 2.249 1.433 10.940 1.00 0.00 H new ATOM 0 HB3 ASP A 42 3.018 2.851 11.624 1.00 0.00 H new ATOM 595 N ARG A 43 1.461 4.647 11.554 1.00 0.00 N ATOM 596 CA ARG A 43 1.561 6.096 11.603 1.00 0.00 C ATOM 597 C ARG A 43 0.760 6.722 10.460 1.00 0.00 C ATOM 598 O ARG A 43 0.525 7.930 10.452 1.00 0.00 O ATOM 599 CB ARG A 43 3.019 6.549 11.504 1.00 0.00 C ATOM 600 CG ARG A 43 3.630 6.740 12.894 1.00 0.00 C ATOM 601 CD ARG A 43 3.063 7.988 13.575 1.00 0.00 C ATOM 602 NE ARG A 43 3.636 8.127 14.933 1.00 0.00 N ATOM 603 CZ ARG A 43 3.177 8.981 15.859 1.00 0.00 C ATOM 604 NH1 ARG A 43 2.135 9.775 15.578 1.00 0.00 N ATOM 605 NH2 ARG A 43 3.760 9.039 17.064 1.00 0.00 N ATOM 0 H ARG A 43 1.652 4.237 10.640 1.00 0.00 H new ATOM 0 HA ARG A 43 1.154 6.426 12.559 1.00 0.00 H new ATOM 0 HB2 ARG A 43 3.596 5.810 10.948 1.00 0.00 H new ATOM 0 HB3 ARG A 43 3.076 7.484 10.946 1.00 0.00 H new ATOM 0 HG2 ARG A 43 3.427 5.862 13.508 1.00 0.00 H new ATOM 0 HG3 ARG A 43 4.713 6.827 12.810 1.00 0.00 H new ATOM 0 HD2 ARG A 43 3.293 8.873 12.982 1.00 0.00 H new ATOM 0 HD3 ARG A 43 1.977 7.918 13.635 1.00 0.00 H new ATOM 0 HE ARG A 43 4.430 7.536 15.180 1.00 0.00 H new ATOM 0 HH11 ARG A 43 1.692 9.729 14.660 1.00 0.00 H new ATOM 0 HH12 ARG A 43 1.785 10.425 16.282 1.00 0.00 H new ATOM 0 HH21 ARG A 43 4.553 8.434 17.277 1.00 0.00 H new ATOM 0 HH22 ARG A 43 3.411 9.689 17.769 1.00 0.00 H new ATOM 616 N MET A 44 0.364 5.874 9.523 1.00 0.00 N ATOM 617 CA MET A 44 -0.406 6.329 8.378 1.00 0.00 C ATOM 618 C MET A 44 -1.839 6.680 8.784 1.00 0.00 C ATOM 619 O MET A 44 -2.509 7.453 8.103 1.00 0.00 O ATOM 620 CB MET A 44 -0.431 5.233 7.311 1.00 0.00 C ATOM 621 CG MET A 44 0.594 5.515 6.211 1.00 0.00 C ATOM 622 SD MET A 44 0.346 4.396 4.842 1.00 0.00 S ATOM 623 CE MET A 44 1.166 5.306 3.544 1.00 0.00 C ATOM 0 H MET A 44 0.562 4.873 9.533 1.00 0.00 H new ATOM 0 HA MET A 44 0.068 7.226 7.979 1.00 0.00 H new ATOM 0 HB2 MET A 44 -0.220 4.268 7.771 1.00 0.00 H new ATOM 0 HB3 MET A 44 -1.428 5.167 6.876 1.00 0.00 H new ATOM 0 HG2 MET A 44 0.499 6.546 5.870 1.00 0.00 H new ATOM 0 HG3 MET A 44 1.604 5.401 6.606 1.00 0.00 H new ATOM 0 HE1 MET A 44 1.198 4.699 2.639 1.00 0.00 H new ATOM 0 HE2 MET A 44 0.619 6.227 3.344 1.00 0.00 H new ATOM 0 HE3 MET A 44 2.182 5.548 3.855 1.00 0.00 H new ATOM 631 N ASN A 45 -2.265 6.092 9.893 1.00 0.00 N ATOM 632 CA ASN A 45 -3.606 6.333 10.398 1.00 0.00 C ATOM 633 C ASN A 45 -3.945 7.816 10.246 1.00 0.00 C ATOM 634 O ASN A 45 -4.581 8.216 9.272 1.00 0.00 O ATOM 635 CB ASN A 45 -3.708 5.973 11.882 1.00 0.00 C ATOM 636 CG ASN A 45 -5.014 6.497 12.484 1.00 0.00 C ATOM 637 OD1 ASN A 45 -6.048 6.461 11.648 1.00 0.00 O flip ATOM 638 ND2 ASN A 45 -5.079 6.905 13.632 1.00 0.00 N flip ATOM 0 H ASN A 45 -1.706 5.450 10.455 1.00 0.00 H new ATOM 0 HA ASN A 45 -4.298 5.713 9.828 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -3.656 4.891 12.002 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -2.860 6.394 12.421 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -4.246 6.905 14.221 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -5.966 7.246 14.003 1.00 0.00 H new ATOM 644 N GLU A 46 -3.506 8.594 11.226 1.00 0.00 N ATOM 645 CA GLU A 46 -3.755 10.026 11.213 1.00 0.00 C ATOM 646 C GLU A 46 -2.680 10.745 10.394 1.00 0.00 C ATOM 647 O GLU A 46 -2.881 11.877 9.959 1.00 0.00 O ATOM 648 CB GLU A 46 -3.823 10.583 12.637 1.00 0.00 C ATOM 649 CG GLU A 46 -4.856 11.707 12.737 1.00 0.00 C ATOM 650 CD GLU A 46 -4.483 12.699 13.840 1.00 0.00 C ATOM 651 OE1 GLU A 46 -3.282 13.040 13.913 1.00 0.00 O ATOM 652 OE2 GLU A 46 -5.405 13.094 14.584 1.00 0.00 O ATOM 0 H GLU A 46 -2.980 8.260 12.033 1.00 0.00 H new ATOM 0 HA GLU A 46 -4.722 10.203 10.742 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -4.081 9.784 13.332 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -2.843 10.958 12.932 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -4.925 12.228 11.782 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -5.840 11.284 12.941 1.00 0.00 H new ATOM 657 N GLY A 47 -1.564 10.056 10.210 1.00 0.00 N ATOM 658 CA GLY A 47 -0.457 10.615 9.451 1.00 0.00 C ATOM 659 C GLY A 47 -0.806 10.714 7.965 1.00 0.00 C ATOM 660 O GLY A 47 -0.374 11.641 7.283 1.00 0.00 O ATOM 0 H GLY A 47 -1.402 9.117 10.573 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -0.210 11.604 9.837 1.00 0.00 H new ATOM 0 HA3 GLY A 47 0.428 9.992 9.580 1.00 0.00 H new ATOM 664 N LEU A 48 -1.584 9.744 7.507 1.00 0.00 N ATOM 665 CA LEU A 48 -1.996 9.710 6.114 1.00 0.00 C ATOM 666 C LEU A 48 -3.200 10.635 5.920 1.00 0.00 C ATOM 667 O LEU A 48 -3.148 11.566 5.117 1.00 0.00 O ATOM 668 CB LEU A 48 -2.249 8.269 5.666 1.00 0.00 C ATOM 669 CG LEU A 48 -2.764 8.093 4.235 1.00 0.00 C ATOM 670 CD1 LEU A 48 -1.663 7.561 3.317 1.00 0.00 C ATOM 671 CD2 LEU A 48 -4.011 7.206 4.208 1.00 0.00 C ATOM 0 H LEU A 48 -1.940 8.976 8.076 1.00 0.00 H new ATOM 0 HA LEU A 48 -1.199 10.084 5.471 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -1.319 7.709 5.768 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -2.969 7.818 6.349 1.00 0.00 H new ATOM 0 HG LEU A 48 -3.055 9.072 3.854 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -2.056 7.445 2.307 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -0.829 8.263 3.304 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -1.318 6.595 3.685 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -4.357 7.096 3.180 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -3.768 6.225 4.616 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -4.797 7.664 4.809 1.00 0.00 H new ATOM 682 N ASP A 49 -4.254 10.347 6.668 1.00 0.00 N ATOM 683 CA ASP A 49 -5.468 11.141 6.588 1.00 0.00 C ATOM 684 C ASP A 49 -5.101 12.626 6.569 1.00 0.00 C ATOM 685 O ASP A 49 -5.741 13.419 5.881 1.00 0.00 O ATOM 686 CB ASP A 49 -6.369 10.892 7.799 1.00 0.00 C ATOM 687 CG ASP A 49 -7.648 11.732 7.836 1.00 0.00 C ATOM 688 OD1 ASP A 49 -7.789 12.591 6.939 1.00 0.00 O ATOM 689 OD2 ASP A 49 -8.455 11.496 8.762 1.00 0.00 O ATOM 0 H ASP A 49 -4.293 9.574 7.333 1.00 0.00 H new ATOM 0 HA ASP A 49 -5.998 10.856 5.679 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -6.644 9.837 7.818 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -5.797 11.088 8.706 1.00 0.00 H new ATOM 693 N ALA A 50 -4.070 12.958 7.333 1.00 0.00 N ATOM 694 CA ALA A 50 -3.609 14.334 7.413 1.00 0.00 C ATOM 695 C ALA A 50 -2.855 14.689 6.130 1.00 0.00 C ATOM 696 O ALA A 50 -3.304 15.533 5.356 1.00 0.00 O ATOM 697 CB ALA A 50 -2.748 14.512 8.664 1.00 0.00 C ATOM 0 H ALA A 50 -3.541 12.297 7.902 1.00 0.00 H new ATOM 0 HA ALA A 50 -4.453 15.018 7.499 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -2.402 15.544 8.724 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -3.339 14.275 9.549 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -1.888 13.844 8.612 1.00 0.00 H new ATOM 703 N PHE A 51 -1.722 14.027 5.945 1.00 0.00 N ATOM 704 CA PHE A 51 -0.902 14.263 4.769 1.00 0.00 C ATOM 705 C PHE A 51 -1.741 14.193 3.491 1.00 0.00 C ATOM 706 O PHE A 51 -1.475 14.914 2.531 1.00 0.00 O ATOM 707 CB PHE A 51 0.155 13.158 4.732 1.00 0.00 C ATOM 708 CG PHE A 51 1.510 13.572 5.309 1.00 0.00 C ATOM 709 CD1 PHE A 51 1.671 13.685 6.654 1.00 0.00 C ATOM 710 CD2 PHE A 51 2.555 13.828 4.475 1.00 0.00 C ATOM 711 CE1 PHE A 51 2.929 14.070 7.190 1.00 0.00 C ATOM 712 CE2 PHE A 51 3.812 14.213 5.011 1.00 0.00 C ATOM 713 CZ PHE A 51 3.973 14.326 6.357 1.00 0.00 C ATOM 0 H PHE A 51 -1.353 13.328 6.589 1.00 0.00 H new ATOM 0 HA PHE A 51 -0.453 15.255 4.822 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -0.216 12.296 5.286 1.00 0.00 H new ATOM 0 HB3 PHE A 51 0.294 12.837 3.700 1.00 0.00 H new ATOM 0 HD1 PHE A 51 0.842 13.482 7.316 1.00 0.00 H new ATOM 0 HD2 PHE A 51 2.428 13.738 3.406 1.00 0.00 H new ATOM 0 HE1 PHE A 51 3.056 14.159 8.259 1.00 0.00 H new ATOM 0 HE2 PHE A 51 4.641 14.416 4.350 1.00 0.00 H new ATOM 0 HZ PHE A 51 4.930 14.619 6.764 1.00 0.00 H new ATOM 722 N ILE A 52 -2.735 13.319 3.522 1.00 0.00 N ATOM 723 CA ILE A 52 -3.616 13.146 2.379 1.00 0.00 C ATOM 724 C ILE A 52 -4.377 14.449 2.124 1.00 0.00 C ATOM 725 O ILE A 52 -4.424 14.933 0.994 1.00 0.00 O ATOM 726 CB ILE A 52 -4.525 11.932 2.581 1.00 0.00 C ATOM 727 CG1 ILE A 52 -4.481 11.005 1.365 1.00 0.00 C ATOM 728 CG2 ILE A 52 -5.952 12.367 2.921 1.00 0.00 C ATOM 729 CD1 ILE A 52 -4.281 9.550 1.792 1.00 0.00 C ATOM 0 H ILE A 52 -2.951 12.722 4.321 1.00 0.00 H new ATOM 0 HA ILE A 52 -3.036 12.934 1.481 1.00 0.00 H new ATOM 0 HB ILE A 52 -4.151 11.362 3.432 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -5.408 11.097 0.799 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -3.671 11.308 0.702 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -6.578 11.485 3.060 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -5.944 12.955 3.839 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -6.352 12.971 2.107 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -4.253 8.912 0.909 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -3.341 9.457 2.337 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -5.105 9.243 2.436 1.00 0.00 H new ATOM 740 N GLN A 53 -4.953 14.979 3.193 1.00 0.00 N ATOM 741 CA GLN A 53 -5.709 16.216 3.099 1.00 0.00 C ATOM 742 C GLN A 53 -4.761 17.409 2.963 1.00 0.00 C ATOM 743 O GLN A 53 -5.205 18.547 2.823 1.00 0.00 O ATOM 744 CB GLN A 53 -6.633 16.386 4.306 1.00 0.00 C ATOM 745 CG GLN A 53 -7.715 17.430 4.025 1.00 0.00 C ATOM 746 CD GLN A 53 -8.415 17.857 5.319 1.00 0.00 C ATOM 747 OE1 GLN A 53 -9.415 17.293 5.729 1.00 0.00 O ATOM 748 NE2 GLN A 53 -7.834 18.883 5.934 1.00 0.00 N ATOM 0 H GLN A 53 -4.911 14.574 4.128 1.00 0.00 H new ATOM 0 HA GLN A 53 -6.334 16.170 2.207 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -7.099 15.431 4.549 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -6.049 16.687 5.176 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -7.269 18.301 3.544 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -8.447 17.022 3.329 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -6.997 19.309 5.535 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -8.225 19.244 6.804 1.00 0.00 H new ATOM 755 N LEU A 54 -3.471 17.107 3.008 1.00 0.00 N ATOM 756 CA LEU A 54 -2.456 18.140 2.892 1.00 0.00 C ATOM 757 C LEU A 54 -1.790 18.042 1.518 1.00 0.00 C ATOM 758 O LEU A 54 -1.297 19.037 0.990 1.00 0.00 O ATOM 759 CB LEU A 54 -1.472 18.060 4.060 1.00 0.00 C ATOM 760 CG LEU A 54 -0.923 19.394 4.569 1.00 0.00 C ATOM 761 CD1 LEU A 54 -1.980 20.150 5.377 1.00 0.00 C ATOM 762 CD2 LEU A 54 0.368 19.189 5.363 1.00 0.00 C ATOM 0 H LEU A 54 -3.106 16.162 3.123 1.00 0.00 H new ATOM 0 HA LEU A 54 -2.910 19.129 2.957 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -1.964 17.553 4.890 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -0.631 17.435 3.758 1.00 0.00 H new ATOM 0 HG LEU A 54 -0.675 20.012 3.706 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -1.564 21.095 5.727 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -2.847 20.347 4.747 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -2.283 19.548 6.233 1.00 0.00 H new ATOM 0 HD21 LEU A 54 0.737 20.153 5.713 1.00 0.00 H new ATOM 0 HD22 LEU A 54 0.170 18.544 6.219 1.00 0.00 H new ATOM 0 HD23 LEU A 54 1.118 18.724 4.724 1.00 0.00 H new ATOM 773 N TYR A 55 -1.794 16.831 0.980 1.00 0.00 N ATOM 774 CA TYR A 55 -1.197 16.589 -0.322 1.00 0.00 C ATOM 775 C TYR A 55 -2.209 15.962 -1.282 1.00 0.00 C ATOM 776 O TYR A 55 -2.695 16.625 -2.198 1.00 0.00 O ATOM 777 CB TYR A 55 -0.056 15.598 -0.084 1.00 0.00 C ATOM 778 CG TYR A 55 1.306 16.258 0.137 1.00 0.00 C ATOM 779 CD1 TYR A 55 2.057 16.672 -0.946 1.00 0.00 C ATOM 780 CD2 TYR A 55 1.786 16.439 1.418 1.00 0.00 C ATOM 781 CE1 TYR A 55 3.339 17.293 -0.738 1.00 0.00 C ATOM 782 CE2 TYR A 55 3.069 17.060 1.625 1.00 0.00 C ATOM 783 CZ TYR A 55 3.781 17.457 0.537 1.00 0.00 C ATOM 784 OH TYR A 55 4.993 18.044 0.733 1.00 0.00 O ATOM 0 H TYR A 55 -2.201 16.007 1.422 1.00 0.00 H new ATOM 0 HA TYR A 55 -0.854 17.523 -0.767 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -0.296 14.985 0.785 1.00 0.00 H new ATOM 0 HB3 TYR A 55 0.012 14.926 -0.939 1.00 0.00 H new ATOM 0 HD1 TYR A 55 1.682 16.530 -1.949 1.00 0.00 H new ATOM 0 HD2 TYR A 55 1.200 16.115 2.265 1.00 0.00 H new ATOM 0 HE1 TYR A 55 3.936 17.621 -1.576 1.00 0.00 H new ATOM 0 HE2 TYR A 55 3.457 17.207 2.622 1.00 0.00 H new ATOM 0 HH TYR A 55 5.179 18.097 1.694 1.00 0.00 H new ATOM 793 N ASN A 56 -2.497 14.692 -1.042 1.00 0.00 N ATOM 794 CA ASN A 56 -3.442 13.968 -1.875 1.00 0.00 C ATOM 795 C ASN A 56 -3.487 12.503 -1.434 1.00 0.00 C ATOM 796 O ASN A 56 -4.552 11.982 -1.106 1.00 0.00 O ATOM 797 CB ASN A 56 -3.024 14.007 -3.345 1.00 0.00 C ATOM 798 CG ASN A 56 -4.110 14.652 -4.209 1.00 0.00 C ATOM 799 OD1 ASN A 56 -4.684 15.673 -3.869 1.00 0.00 O ATOM 800 ND2 ASN A 56 -4.361 13.998 -5.339 1.00 0.00 N ATOM 0 H ASN A 56 -2.092 14.145 -0.282 1.00 0.00 H new ATOM 0 HA ASN A 56 -4.418 14.441 -1.766 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -2.094 14.566 -3.447 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -2.828 12.994 -3.698 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -5.072 14.346 -5.983 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -3.843 13.148 -5.562 1.00 0.00 H new ATOM 806 N GLU A 57 -2.317 11.881 -1.440 1.00 0.00 N ATOM 807 CA GLU A 57 -2.208 10.487 -1.045 1.00 0.00 C ATOM 808 C GLU A 57 -1.021 9.827 -1.749 1.00 0.00 C ATOM 809 O GLU A 57 -0.612 8.727 -1.383 1.00 0.00 O ATOM 810 CB GLU A 57 -3.507 9.733 -1.335 1.00 0.00 C ATOM 811 CG GLU A 57 -3.263 8.224 -1.393 1.00 0.00 C ATOM 812 CD GLU A 57 -2.722 7.808 -2.763 1.00 0.00 C ATOM 813 OE1 GLU A 57 -3.074 8.497 -3.745 1.00 0.00 O ATOM 814 OE2 GLU A 57 -1.968 6.811 -2.797 1.00 0.00 O ATOM 0 H GLU A 57 -1.436 12.317 -1.712 1.00 0.00 H new ATOM 0 HA GLU A 57 -2.035 10.446 0.030 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -4.242 9.957 -0.562 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -3.926 10.074 -2.282 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -2.555 7.936 -0.616 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -4.193 7.694 -1.189 1.00 0.00 H new ATOM 819 N SER A 58 -0.503 10.527 -2.747 1.00 0.00 N ATOM 820 CA SER A 58 0.629 10.022 -3.505 1.00 0.00 C ATOM 821 C SER A 58 1.728 11.085 -3.575 1.00 0.00 C ATOM 822 O SER A 58 2.303 11.320 -4.637 1.00 0.00 O ATOM 823 CB SER A 58 0.205 9.604 -4.914 1.00 0.00 C ATOM 824 OG SER A 58 -0.977 8.810 -4.902 1.00 0.00 O ATOM 0 H SER A 58 -0.846 11.439 -3.048 1.00 0.00 H new ATOM 0 HA SER A 58 1.017 9.140 -2.995 1.00 0.00 H new ATOM 0 HB2 SER A 58 0.038 10.494 -5.521 1.00 0.00 H new ATOM 0 HB3 SER A 58 1.013 9.044 -5.385 1.00 0.00 H new ATOM 0 HG SER A 58 -1.707 9.316 -4.487 1.00 0.00 H new ATOM 829 N GLU A 59 1.987 11.699 -2.430 1.00 0.00 N ATOM 830 CA GLU A 59 3.007 12.731 -2.349 1.00 0.00 C ATOM 831 C GLU A 59 4.280 12.171 -1.712 1.00 0.00 C ATOM 832 O GLU A 59 5.061 12.913 -1.119 1.00 0.00 O ATOM 833 CB GLU A 59 2.496 13.947 -1.573 1.00 0.00 C ATOM 834 CG GLU A 59 2.561 13.702 -0.064 1.00 0.00 C ATOM 835 CD GLU A 59 3.665 14.545 0.580 1.00 0.00 C ATOM 836 OE1 GLU A 59 4.486 15.089 -0.189 1.00 0.00 O ATOM 837 OE2 GLU A 59 3.662 14.625 1.827 1.00 0.00 O ATOM 0 H GLU A 59 1.509 11.502 -1.551 1.00 0.00 H new ATOM 0 HA GLU A 59 3.244 13.059 -3.361 1.00 0.00 H new ATOM 0 HB2 GLU A 59 3.092 14.823 -1.829 1.00 0.00 H new ATOM 0 HB3 GLU A 59 1.469 14.164 -1.866 1.00 0.00 H new ATOM 0 HG2 GLU A 59 1.600 13.946 0.390 1.00 0.00 H new ATOM 0 HG3 GLU A 59 2.746 12.645 0.129 1.00 0.00 H new ATOM 842 N ILE A 60 4.449 10.865 -1.855 1.00 0.00 N ATOM 843 CA ILE A 60 5.614 10.195 -1.302 1.00 0.00 C ATOM 844 C ILE A 60 6.872 10.696 -2.016 1.00 0.00 C ATOM 845 O ILE A 60 7.891 10.956 -1.377 1.00 0.00 O ATOM 846 CB ILE A 60 5.438 8.677 -1.358 1.00 0.00 C ATOM 847 CG1 ILE A 60 6.151 8.087 -2.578 1.00 0.00 C ATOM 848 CG2 ILE A 60 3.957 8.295 -1.322 1.00 0.00 C ATOM 849 CD1 ILE A 60 5.374 8.380 -3.862 1.00 0.00 C ATOM 0 H ILE A 60 3.798 10.252 -2.346 1.00 0.00 H new ATOM 0 HA ILE A 60 5.728 10.439 -0.246 1.00 0.00 H new ATOM 0 HB ILE A 60 5.904 8.247 -0.472 1.00 0.00 H new ATOM 0 HG12 ILE A 60 7.155 8.504 -2.653 1.00 0.00 H new ATOM 0 HG13 ILE A 60 6.261 7.010 -2.453 1.00 0.00 H new ATOM 0 HG21 ILE A 60 3.860 7.210 -1.363 1.00 0.00 H new ATOM 0 HG22 ILE A 60 3.508 8.665 -0.400 1.00 0.00 H new ATOM 0 HG23 ILE A 60 3.446 8.738 -2.177 1.00 0.00 H new ATOM 0 HD11 ILE A 60 5.902 7.950 -4.713 1.00 0.00 H new ATOM 0 HD12 ILE A 60 4.379 7.941 -3.793 1.00 0.00 H new ATOM 0 HD13 ILE A 60 5.287 9.458 -3.996 1.00 0.00 H new ATOM 860 N ASP A 61 6.759 10.814 -3.330 1.00 0.00 N ATOM 861 CA ASP A 61 7.875 11.279 -4.138 1.00 0.00 C ATOM 862 C ASP A 61 7.503 12.609 -4.796 1.00 0.00 C ATOM 863 O ASP A 61 8.215 13.601 -4.643 1.00 0.00 O ATOM 864 CB ASP A 61 8.204 10.279 -5.249 1.00 0.00 C ATOM 865 CG ASP A 61 9.672 10.252 -5.679 1.00 0.00 C ATOM 866 OD1 ASP A 61 10.489 10.856 -4.951 1.00 0.00 O ATOM 867 OD2 ASP A 61 9.945 9.627 -6.726 1.00 0.00 O ATOM 0 H ASP A 61 5.913 10.596 -3.856 1.00 0.00 H new ATOM 0 HA ASP A 61 8.740 11.392 -3.485 1.00 0.00 H new ATOM 0 HB2 ASP A 61 7.920 9.281 -4.915 1.00 0.00 H new ATOM 0 HB3 ASP A 61 7.590 10.510 -6.119 1.00 0.00 H new ATOM 871 N GLU A 62 6.390 12.587 -5.514 1.00 0.00 N ATOM 872 CA GLU A 62 5.916 13.780 -6.196 1.00 0.00 C ATOM 873 C GLU A 62 7.074 14.478 -6.912 1.00 0.00 C ATOM 874 O GLU A 62 7.597 15.479 -6.425 1.00 0.00 O ATOM 875 CB GLU A 62 5.223 14.731 -5.219 1.00 0.00 C ATOM 876 CG GLU A 62 4.747 15.999 -5.931 1.00 0.00 C ATOM 877 CD GLU A 62 5.277 17.253 -5.233 1.00 0.00 C ATOM 878 OE1 GLU A 62 4.669 17.633 -4.210 1.00 0.00 O ATOM 879 OE2 GLU A 62 6.281 17.802 -5.738 1.00 0.00 O ATOM 0 H GLU A 62 5.803 11.762 -5.639 1.00 0.00 H new ATOM 0 HA GLU A 62 5.181 13.480 -6.943 1.00 0.00 H new ATOM 0 HB2 GLU A 62 4.373 14.228 -4.758 1.00 0.00 H new ATOM 0 HB3 GLU A 62 5.910 14.997 -4.416 1.00 0.00 H new ATOM 0 HG2 GLU A 62 5.084 15.986 -6.968 1.00 0.00 H new ATOM 0 HG3 GLU A 62 3.657 16.022 -5.950 1.00 0.00 H new ATOM 884 N PRO A 63 7.451 13.907 -8.087 1.00 0.00 N ATOM 885 CA PRO A 63 8.537 14.464 -8.876 1.00 0.00 C ATOM 886 C PRO A 63 8.094 15.738 -9.597 1.00 0.00 C ATOM 887 O PRO A 63 8.879 16.352 -10.319 1.00 0.00 O ATOM 888 CB PRO A 63 8.941 13.352 -9.830 1.00 0.00 C ATOM 889 CG PRO A 63 7.770 12.383 -9.861 1.00 0.00 C ATOM 890 CD PRO A 63 6.854 12.721 -8.695 1.00 0.00 C ATOM 0 HA PRO A 63 9.385 14.774 -8.265 1.00 0.00 H new ATOM 0 HB2 PRO A 63 9.148 13.747 -10.825 1.00 0.00 H new ATOM 0 HB3 PRO A 63 9.850 12.856 -9.489 1.00 0.00 H new ATOM 0 HG2 PRO A 63 7.232 12.465 -10.805 1.00 0.00 H new ATOM 0 HG3 PRO A 63 8.123 11.355 -9.783 1.00 0.00 H new ATOM 0 HD2 PRO A 63 5.837 12.919 -9.034 1.00 0.00 H new ATOM 0 HD3 PRO A 63 6.798 11.897 -7.984 1.00 0.00 H new ATOM 895 N LEU A 64 6.839 16.100 -9.376 1.00 0.00 N ATOM 896 CA LEU A 64 6.282 17.289 -9.996 1.00 0.00 C ATOM 897 C LEU A 64 5.754 16.936 -11.387 1.00 0.00 C ATOM 898 O LEU A 64 5.270 17.804 -12.111 1.00 0.00 O ATOM 899 CB LEU A 64 7.310 18.422 -9.999 1.00 0.00 C ATOM 900 CG LEU A 64 6.747 19.840 -10.120 1.00 0.00 C ATOM 901 CD1 LEU A 64 6.442 20.429 -8.741 1.00 0.00 C ATOM 902 CD2 LEU A 64 7.684 20.736 -10.932 1.00 0.00 C ATOM 0 H LEU A 64 6.192 15.590 -8.775 1.00 0.00 H new ATOM 0 HA LEU A 64 5.435 17.658 -9.418 1.00 0.00 H new ATOM 0 HB2 LEU A 64 7.891 18.361 -9.079 1.00 0.00 H new ATOM 0 HB3 LEU A 64 8.002 18.256 -10.825 1.00 0.00 H new ATOM 0 HG LEU A 64 5.803 19.787 -10.663 1.00 0.00 H new ATOM 0 HD11 LEU A 64 6.043 21.437 -8.856 1.00 0.00 H new ATOM 0 HD12 LEU A 64 5.708 19.804 -8.233 1.00 0.00 H new ATOM 0 HD13 LEU A 64 7.358 20.466 -8.151 1.00 0.00 H new ATOM 0 HD21 LEU A 64 7.260 21.737 -11.002 1.00 0.00 H new ATOM 0 HD22 LEU A 64 8.655 20.787 -10.440 1.00 0.00 H new ATOM 0 HD23 LEU A 64 7.806 20.323 -11.933 1.00 0.00 H new ATOM 913 N ILE A 65 5.863 15.657 -11.720 1.00 0.00 N ATOM 914 CA ILE A 65 5.402 15.178 -13.012 1.00 0.00 C ATOM 915 C ILE A 65 3.988 14.613 -12.865 1.00 0.00 C ATOM 916 O ILE A 65 3.244 14.533 -13.842 1.00 0.00 O ATOM 917 CB ILE A 65 6.403 14.183 -13.602 1.00 0.00 C ATOM 918 CG1 ILE A 65 6.081 12.754 -13.162 1.00 0.00 C ATOM 919 CG2 ILE A 65 7.840 14.579 -13.254 1.00 0.00 C ATOM 920 CD1 ILE A 65 5.242 12.031 -14.218 1.00 0.00 C ATOM 0 H ILE A 65 6.264 14.939 -11.117 1.00 0.00 H new ATOM 0 HA ILE A 65 5.346 16.000 -13.726 1.00 0.00 H new ATOM 0 HB ILE A 65 6.314 14.213 -14.688 1.00 0.00 H new ATOM 0 HG12 ILE A 65 7.007 12.205 -12.990 1.00 0.00 H new ATOM 0 HG13 ILE A 65 5.542 12.774 -12.215 1.00 0.00 H new ATOM 0 HG21 ILE A 65 8.531 13.855 -13.685 1.00 0.00 H new ATOM 0 HG22 ILE A 65 8.052 15.569 -13.658 1.00 0.00 H new ATOM 0 HG23 ILE A 65 7.961 14.595 -12.171 1.00 0.00 H new ATOM 0 HD11 ILE A 65 5.027 11.017 -13.880 1.00 0.00 H new ATOM 0 HD12 ILE A 65 4.306 12.569 -14.370 1.00 0.00 H new ATOM 0 HD13 ILE A 65 5.794 11.991 -15.157 1.00 0.00 H new ATOM 931 N GLN A 66 3.659 14.238 -11.638 1.00 0.00 N ATOM 932 CA GLN A 66 2.346 13.683 -11.352 1.00 0.00 C ATOM 933 C GLN A 66 2.187 13.443 -9.850 1.00 0.00 C ATOM 934 O GLN A 66 1.440 14.152 -9.180 1.00 0.00 O ATOM 935 CB GLN A 66 2.112 12.393 -12.141 1.00 0.00 C ATOM 936 CG GLN A 66 0.635 12.236 -12.509 1.00 0.00 C ATOM 937 CD GLN A 66 0.417 12.453 -14.009 1.00 0.00 C ATOM 938 OE1 GLN A 66 0.525 11.545 -14.815 1.00 0.00 O ATOM 939 NE2 GLN A 66 0.104 13.704 -14.334 1.00 0.00 N ATOM 0 H GLN A 66 4.278 14.307 -10.830 1.00 0.00 H new ATOM 0 HA GLN A 66 1.592 14.404 -11.667 1.00 0.00 H new ATOM 0 HB2 GLN A 66 2.717 12.402 -13.047 1.00 0.00 H new ATOM 0 HB3 GLN A 66 2.436 11.537 -11.550 1.00 0.00 H new ATOM 0 HG2 GLN A 66 0.290 11.241 -12.228 1.00 0.00 H new ATOM 0 HG3 GLN A 66 0.038 12.951 -11.944 1.00 0.00 H new ATOM 0 HE21 GLN A 66 0.030 14.416 -13.608 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -0.062 13.951 -15.310 1.00 0.00 H new ATOM 946 N LEU A 67 2.904 12.438 -9.364 1.00 0.00 N ATOM 947 CA LEU A 67 2.851 12.096 -7.954 1.00 0.00 C ATOM 948 C LEU A 67 1.734 11.077 -7.722 1.00 0.00 C ATOM 949 O LEU A 67 1.859 10.195 -6.875 1.00 0.00 O ATOM 950 CB LEU A 67 2.720 13.358 -7.100 1.00 0.00 C ATOM 951 CG LEU A 67 1.293 13.783 -6.746 1.00 0.00 C ATOM 952 CD1 LEU A 67 0.950 13.403 -5.303 1.00 0.00 C ATOM 953 CD2 LEU A 67 1.083 15.274 -7.011 1.00 0.00 C ATOM 0 H LEU A 67 3.524 11.851 -9.923 1.00 0.00 H new ATOM 0 HA LEU A 67 3.783 11.624 -7.642 1.00 0.00 H new ATOM 0 HB2 LEU A 67 3.273 13.205 -6.173 1.00 0.00 H new ATOM 0 HB3 LEU A 67 3.203 14.181 -7.627 1.00 0.00 H new ATOM 0 HG LEU A 67 0.604 13.241 -7.394 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -0.069 13.716 -5.077 1.00 0.00 H new ATOM 0 HD12 LEU A 67 1.033 12.323 -5.182 1.00 0.00 H new ATOM 0 HD13 LEU A 67 1.641 13.899 -4.622 1.00 0.00 H new ATOM 0 HD21 LEU A 67 0.061 15.549 -6.751 1.00 0.00 H new ATOM 0 HD22 LEU A 67 1.780 15.853 -6.405 1.00 0.00 H new ATOM 0 HD23 LEU A 67 1.258 15.484 -8.066 1.00 0.00 H new ATOM 964 N ASP A 68 0.666 11.233 -8.490 1.00 0.00 N ATOM 965 CA ASP A 68 -0.474 10.338 -8.379 1.00 0.00 C ATOM 966 C ASP A 68 -0.086 8.958 -8.915 1.00 0.00 C ATOM 967 O ASP A 68 -0.387 7.940 -8.293 1.00 0.00 O ATOM 968 CB ASP A 68 -1.658 10.850 -9.200 1.00 0.00 C ATOM 969 CG ASP A 68 -3.029 10.655 -8.549 1.00 0.00 C ATOM 970 OD1 ASP A 68 -3.149 11.023 -7.360 1.00 0.00 O ATOM 971 OD2 ASP A 68 -3.925 10.144 -9.254 1.00 0.00 O ATOM 0 H ASP A 68 0.566 11.966 -9.192 1.00 0.00 H new ATOM 0 HA ASP A 68 -0.761 10.285 -7.329 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -1.513 11.913 -9.395 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -1.656 10.345 -10.166 1.00 0.00 H new ATOM 975 N ASP A 69 0.573 8.969 -10.063 1.00 0.00 N ATOM 976 CA ASP A 69 1.005 7.732 -10.691 1.00 0.00 C ATOM 977 C ASP A 69 2.321 7.276 -10.058 1.00 0.00 C ATOM 978 O ASP A 69 2.778 6.160 -10.303 1.00 0.00 O ATOM 979 CB ASP A 69 1.244 7.927 -12.189 1.00 0.00 C ATOM 980 CG ASP A 69 2.607 8.517 -12.555 1.00 0.00 C ATOM 981 OD1 ASP A 69 3.617 7.850 -12.242 1.00 0.00 O ATOM 982 OD2 ASP A 69 2.609 9.621 -13.140 1.00 0.00 O ATOM 0 H ASP A 69 0.819 9.816 -10.576 1.00 0.00 H new ATOM 0 HA ASP A 69 0.221 6.989 -10.545 1.00 0.00 H new ATOM 0 HB2 ASP A 69 1.136 6.963 -12.687 1.00 0.00 H new ATOM 0 HB3 ASP A 69 0.465 8.579 -12.584 1.00 0.00 H new ATOM 986 N ASP A 70 2.893 8.161 -9.256 1.00 0.00 N ATOM 987 CA ASP A 70 4.148 7.864 -8.586 1.00 0.00 C ATOM 988 C ASP A 70 3.889 6.886 -7.439 1.00 0.00 C ATOM 989 O ASP A 70 4.723 6.029 -7.148 1.00 0.00 O ATOM 990 CB ASP A 70 4.771 9.131 -7.996 1.00 0.00 C ATOM 991 CG ASP A 70 6.296 9.106 -7.878 1.00 0.00 C ATOM 992 OD1 ASP A 70 6.777 8.580 -6.851 1.00 0.00 O ATOM 993 OD2 ASP A 70 6.946 9.615 -8.817 1.00 0.00 O ATOM 0 H ASP A 70 2.511 9.085 -9.055 1.00 0.00 H new ATOM 0 HA ASP A 70 4.830 7.436 -9.321 1.00 0.00 H new ATOM 0 HB2 ASP A 70 4.483 9.981 -8.614 1.00 0.00 H new ATOM 0 HB3 ASP A 70 4.348 9.299 -7.006 1.00 0.00 H new ATOM 997 N THR A 71 2.729 7.044 -6.818 1.00 0.00 N ATOM 998 CA THR A 71 2.350 6.185 -5.709 1.00 0.00 C ATOM 999 C THR A 71 1.199 5.264 -6.118 1.00 0.00 C ATOM 1000 O THR A 71 0.980 4.225 -5.496 1.00 0.00 O ATOM 1001 CB THR A 71 2.018 7.078 -4.512 1.00 0.00 C ATOM 1002 OG1 THR A 71 2.889 8.197 -4.661 1.00 0.00 O ATOM 1003 CG2 THR A 71 2.438 6.453 -3.181 1.00 0.00 C ATOM 0 H THR A 71 2.039 7.754 -7.062 1.00 0.00 H new ATOM 0 HA THR A 71 3.168 5.524 -5.423 1.00 0.00 H new ATOM 0 HB THR A 71 0.947 7.280 -4.496 1.00 0.00 H new ATOM 0 HG1 THR A 71 2.785 8.797 -3.893 1.00 0.00 H new ATOM 0 HG21 THR A 71 2.180 7.128 -2.365 1.00 0.00 H new ATOM 0 HG22 THR A 71 1.920 5.504 -3.045 1.00 0.00 H new ATOM 0 HG23 THR A 71 3.514 6.282 -3.183 1.00 0.00 H new ATOM 1011 N ALA A 72 0.494 5.678 -7.161 1.00 0.00 N ATOM 1012 CA ALA A 72 -0.629 4.902 -7.659 1.00 0.00 C ATOM 1013 C ALA A 72 -0.106 3.756 -8.528 1.00 0.00 C ATOM 1014 O ALA A 72 -0.699 2.679 -8.562 1.00 0.00 O ATOM 1015 CB ALA A 72 -1.586 5.821 -8.422 1.00 0.00 C ATOM 0 H ALA A 72 0.679 6.540 -7.674 1.00 0.00 H new ATOM 0 HA ALA A 72 -1.188 4.462 -6.833 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -2.429 5.239 -8.796 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -1.951 6.601 -7.754 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -1.060 6.278 -9.260 1.00 0.00 H new ATOM 1021 N GLU A 73 0.998 4.027 -9.208 1.00 0.00 N ATOM 1022 CA GLU A 73 1.607 3.032 -10.074 1.00 0.00 C ATOM 1023 C GLU A 73 2.012 1.800 -9.264 1.00 0.00 C ATOM 1024 O GLU A 73 2.020 0.686 -9.783 1.00 0.00 O ATOM 1025 CB GLU A 73 2.808 3.617 -10.821 1.00 0.00 C ATOM 1026 CG GLU A 73 3.561 2.527 -11.585 1.00 0.00 C ATOM 1027 CD GLU A 73 4.842 3.081 -12.211 1.00 0.00 C ATOM 1028 OE1 GLU A 73 4.736 3.641 -13.322 1.00 0.00 O ATOM 1029 OE2 GLU A 73 5.901 2.932 -11.562 1.00 0.00 O ATOM 0 H GLU A 73 1.487 4.922 -9.177 1.00 0.00 H new ATOM 0 HA GLU A 73 0.871 2.727 -10.818 1.00 0.00 H new ATOM 0 HB2 GLU A 73 2.470 4.386 -11.516 1.00 0.00 H new ATOM 0 HB3 GLU A 73 3.481 4.101 -10.113 1.00 0.00 H new ATOM 0 HG2 GLU A 73 3.807 1.708 -10.909 1.00 0.00 H new ATOM 0 HG3 GLU A 73 2.920 2.115 -12.364 1.00 0.00 H new ATOM 1034 N LEU A 74 2.338 2.042 -8.002 1.00 0.00 N ATOM 1035 CA LEU A 74 2.744 0.965 -7.115 1.00 0.00 C ATOM 1036 C LEU A 74 1.501 0.351 -6.465 1.00 0.00 C ATOM 1037 O LEU A 74 1.228 -0.836 -6.639 1.00 0.00 O ATOM 1038 CB LEU A 74 3.782 1.463 -6.107 1.00 0.00 C ATOM 1039 CG LEU A 74 5.175 0.841 -6.217 1.00 0.00 C ATOM 1040 CD1 LEU A 74 5.146 -0.639 -5.831 1.00 0.00 C ATOM 1041 CD2 LEU A 74 5.765 1.058 -7.612 1.00 0.00 C ATOM 0 H LEU A 74 2.329 2.968 -7.573 1.00 0.00 H new ATOM 0 HA LEU A 74 3.236 0.172 -7.678 1.00 0.00 H new ATOM 0 HB2 LEU A 74 3.878 2.543 -6.218 1.00 0.00 H new ATOM 0 HB3 LEU A 74 3.402 1.278 -5.102 1.00 0.00 H new ATOM 0 HG LEU A 74 5.831 1.346 -5.508 1.00 0.00 H new ATOM 0 HD11 LEU A 74 6.149 -1.057 -5.918 1.00 0.00 H new ATOM 0 HD12 LEU A 74 4.798 -0.740 -4.803 1.00 0.00 H new ATOM 0 HD13 LEU A 74 4.470 -1.176 -6.497 1.00 0.00 H new ATOM 0 HD21 LEU A 74 6.756 0.606 -7.662 1.00 0.00 H new ATOM 0 HD22 LEU A 74 5.117 0.596 -8.357 1.00 0.00 H new ATOM 0 HD23 LEU A 74 5.843 2.127 -7.812 1.00 0.00 H new ATOM 1052 N MET A 75 0.783 1.187 -5.730 1.00 0.00 N ATOM 1053 CA MET A 75 -0.423 0.741 -5.053 1.00 0.00 C ATOM 1054 C MET A 75 -1.358 0.012 -6.021 1.00 0.00 C ATOM 1055 O MET A 75 -2.077 -0.903 -5.625 1.00 0.00 O ATOM 1056 CB MET A 75 -1.149 1.947 -4.454 1.00 0.00 C ATOM 1057 CG MET A 75 -1.976 2.674 -5.518 1.00 0.00 C ATOM 1058 SD MET A 75 -3.629 2.003 -5.568 1.00 0.00 S ATOM 1059 CE MET A 75 -4.532 3.444 -6.111 1.00 0.00 C ATOM 0 H MET A 75 1.013 2.171 -5.588 1.00 0.00 H new ATOM 0 HA MET A 75 -0.137 0.048 -4.262 1.00 0.00 H new ATOM 0 HB2 MET A 75 -1.800 1.618 -3.644 1.00 0.00 H new ATOM 0 HB3 MET A 75 -0.423 2.634 -4.020 1.00 0.00 H new ATOM 0 HG2 MET A 75 -2.014 3.740 -5.295 1.00 0.00 H new ATOM 0 HG3 MET A 75 -1.502 2.569 -6.494 1.00 0.00 H new ATOM 0 HE1 MET A 75 -5.402 3.132 -6.689 1.00 0.00 H new ATOM 0 HE2 MET A 75 -4.859 4.017 -5.243 1.00 0.00 H new ATOM 0 HE3 MET A 75 -3.887 4.064 -6.733 1.00 0.00 H new ATOM 1067 N LYS A 76 -1.316 0.446 -7.273 1.00 0.00 N ATOM 1068 CA LYS A 76 -2.150 -0.153 -8.301 1.00 0.00 C ATOM 1069 C LYS A 76 -1.496 -1.446 -8.792 1.00 0.00 C ATOM 1070 O LYS A 76 -2.137 -2.496 -8.826 1.00 0.00 O ATOM 1071 CB LYS A 76 -2.433 0.855 -9.417 1.00 0.00 C ATOM 1072 CG LYS A 76 -3.246 2.040 -8.892 1.00 0.00 C ATOM 1073 CD LYS A 76 -3.321 3.158 -9.934 1.00 0.00 C ATOM 1074 CE LYS A 76 -4.088 2.699 -11.176 1.00 0.00 C ATOM 1075 NZ LYS A 76 -3.463 3.245 -12.402 1.00 0.00 N ATOM 0 H LYS A 76 -0.717 1.205 -7.598 1.00 0.00 H new ATOM 0 HA LYS A 76 -3.124 -0.422 -7.892 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -1.492 1.212 -9.837 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -2.977 0.365 -10.225 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -4.252 1.710 -8.635 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -2.792 2.421 -7.977 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -3.811 4.031 -9.502 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -2.314 3.465 -10.217 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -4.101 1.610 -11.221 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -5.125 3.027 -11.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -3.996 2.924 -13.236 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -3.473 4.284 -12.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -2.480 2.911 -12.469 1.00 0.00 H new ATOM 1085 N GLN A 77 -0.229 -1.329 -9.159 1.00 0.00 N ATOM 1086 CA GLN A 77 0.519 -2.476 -9.646 1.00 0.00 C ATOM 1087 C GLN A 77 0.459 -3.618 -8.630 1.00 0.00 C ATOM 1088 O GLN A 77 0.599 -4.785 -8.994 1.00 0.00 O ATOM 1089 CB GLN A 77 1.967 -2.095 -9.959 1.00 0.00 C ATOM 1090 CG GLN A 77 2.732 -3.280 -10.549 1.00 0.00 C ATOM 1091 CD GLN A 77 2.627 -3.295 -12.076 1.00 0.00 C ATOM 1092 OE1 GLN A 77 2.830 -2.297 -12.747 1.00 0.00 O ATOM 1093 NE2 GLN A 77 2.301 -4.480 -12.584 1.00 0.00 N ATOM 0 H GLN A 77 0.299 -0.457 -9.129 1.00 0.00 H new ATOM 0 HA GLN A 77 0.060 -2.817 -10.574 1.00 0.00 H new ATOM 0 HB2 GLN A 77 1.983 -1.261 -10.661 1.00 0.00 H new ATOM 0 HB3 GLN A 77 2.462 -1.755 -9.049 1.00 0.00 H new ATOM 0 HG2 GLN A 77 3.780 -3.225 -10.253 1.00 0.00 H new ATOM 0 HG3 GLN A 77 2.335 -4.211 -10.144 1.00 0.00 H new ATOM 0 HE21 GLN A 77 2.145 -5.275 -11.964 1.00 0.00 H new ATOM 0 HE22 GLN A 77 2.207 -4.594 -13.593 1.00 0.00 H new ATOM 1100 N ALA A 78 0.252 -3.243 -7.376 1.00 0.00 N ATOM 1101 CA ALA A 78 0.173 -4.221 -6.306 1.00 0.00 C ATOM 1102 C ALA A 78 -1.269 -4.716 -6.178 1.00 0.00 C ATOM 1103 O ALA A 78 -1.572 -5.855 -6.530 1.00 0.00 O ATOM 1104 CB ALA A 78 0.694 -3.601 -5.007 1.00 0.00 C ATOM 0 H ALA A 78 0.137 -2.274 -7.078 1.00 0.00 H new ATOM 0 HA ALA A 78 0.799 -5.085 -6.529 1.00 0.00 H new ATOM 0 HB1 ALA A 78 0.635 -4.335 -4.204 1.00 0.00 H new ATOM 0 HB2 ALA A 78 1.731 -3.293 -5.141 1.00 0.00 H new ATOM 0 HB3 ALA A 78 0.088 -2.732 -4.750 1.00 0.00 H new ATOM 1110 N ARG A 79 -2.120 -3.835 -5.674 1.00 0.00 N ATOM 1111 CA ARG A 79 -3.524 -4.168 -5.495 1.00 0.00 C ATOM 1112 C ARG A 79 -4.084 -4.805 -6.768 1.00 0.00 C ATOM 1113 O ARG A 79 -5.123 -5.463 -6.732 1.00 0.00 O ATOM 1114 CB ARG A 79 -4.345 -2.924 -5.150 1.00 0.00 C ATOM 1115 CG ARG A 79 -4.398 -2.703 -3.637 1.00 0.00 C ATOM 1116 CD ARG A 79 -4.327 -1.214 -3.297 1.00 0.00 C ATOM 1117 NE ARG A 79 -2.931 -0.831 -2.990 1.00 0.00 N ATOM 1118 CZ ARG A 79 -2.226 -1.318 -1.961 1.00 0.00 C ATOM 1119 NH1 ARG A 79 -2.785 -2.211 -1.131 1.00 0.00 N ATOM 1120 NH2 ARG A 79 -0.965 -0.914 -1.759 1.00 0.00 N ATOM 0 H ARG A 79 -1.865 -2.891 -5.384 1.00 0.00 H new ATOM 0 HA ARG A 79 -3.595 -4.876 -4.669 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -3.908 -2.050 -5.633 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -5.357 -3.032 -5.541 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -5.318 -3.128 -3.236 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -3.570 -3.228 -3.160 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -4.699 -0.623 -4.134 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -4.969 -0.997 -2.443 1.00 0.00 H new ATOM 0 HE ARG A 79 -2.477 -0.153 -3.601 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -3.746 -2.518 -1.284 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -2.250 -2.583 -0.347 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -0.540 -0.234 -2.390 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -0.430 -1.286 -0.975 1.00 0.00 H new ATOM 1131 N ASP A 80 -3.372 -4.586 -7.864 1.00 0.00 N ATOM 1132 CA ASP A 80 -3.785 -5.130 -9.147 1.00 0.00 C ATOM 1133 C ASP A 80 -3.029 -6.434 -9.410 1.00 0.00 C ATOM 1134 O ASP A 80 -3.596 -7.388 -9.942 1.00 0.00 O ATOM 1135 CB ASP A 80 -3.466 -4.160 -10.285 1.00 0.00 C ATOM 1136 CG ASP A 80 -4.054 -4.543 -11.644 1.00 0.00 C ATOM 1137 OD1 ASP A 80 -4.158 -5.763 -11.895 1.00 0.00 O ATOM 1138 OD2 ASP A 80 -4.385 -3.606 -12.403 1.00 0.00 O ATOM 0 H ASP A 80 -2.511 -4.039 -7.890 1.00 0.00 H new ATOM 0 HA ASP A 80 -4.861 -5.301 -9.111 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -3.833 -3.171 -10.013 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -2.383 -4.082 -10.383 1.00 0.00 H new ATOM 1142 N MET A 81 -1.762 -6.434 -9.024 1.00 0.00 N ATOM 1143 CA MET A 81 -0.923 -7.606 -9.212 1.00 0.00 C ATOM 1144 C MET A 81 -1.495 -8.815 -8.468 1.00 0.00 C ATOM 1145 O MET A 81 -1.149 -9.956 -8.773 1.00 0.00 O ATOM 1146 CB MET A 81 0.489 -7.310 -8.699 1.00 0.00 C ATOM 1147 CG MET A 81 1.199 -8.599 -8.279 1.00 0.00 C ATOM 1148 SD MET A 81 2.962 -8.326 -8.204 1.00 0.00 S ATOM 1149 CE MET A 81 3.133 -7.879 -6.485 1.00 0.00 C ATOM 0 H MET A 81 -1.296 -5.642 -8.582 1.00 0.00 H new ATOM 0 HA MET A 81 -0.891 -7.841 -10.276 1.00 0.00 H new ATOM 0 HB2 MET A 81 1.065 -6.810 -9.477 1.00 0.00 H new ATOM 0 HB3 MET A 81 0.437 -6.626 -7.852 1.00 0.00 H new ATOM 0 HG2 MET A 81 0.831 -8.927 -7.307 1.00 0.00 H new ATOM 0 HG3 MET A 81 0.976 -9.395 -8.989 1.00 0.00 H new ATOM 0 HE1 MET A 81 4.181 -7.674 -6.265 1.00 0.00 H new ATOM 0 HE2 MET A 81 2.538 -6.989 -6.279 1.00 0.00 H new ATOM 0 HE3 MET A 81 2.785 -8.701 -5.859 1.00 0.00 H new ATOM 1157 N TYR A 82 -2.358 -8.523 -7.506 1.00 0.00 N ATOM 1158 CA TYR A 82 -2.980 -9.573 -6.717 1.00 0.00 C ATOM 1159 C TYR A 82 -3.753 -8.984 -5.534 1.00 0.00 C ATOM 1160 O TYR A 82 -4.652 -9.626 -4.994 1.00 0.00 O ATOM 1161 CB TYR A 82 -1.835 -10.435 -6.184 1.00 0.00 C ATOM 1162 CG TYR A 82 -1.968 -11.922 -6.518 1.00 0.00 C ATOM 1163 CD1 TYR A 82 -2.590 -12.313 -7.686 1.00 0.00 C ATOM 1164 CD2 TYR A 82 -1.467 -12.871 -5.651 1.00 0.00 C ATOM 1165 CE1 TYR A 82 -2.715 -13.713 -8.001 1.00 0.00 C ATOM 1166 CE2 TYR A 82 -1.592 -14.271 -5.965 1.00 0.00 C ATOM 1167 CZ TYR A 82 -2.210 -14.623 -7.125 1.00 0.00 C ATOM 1168 OH TYR A 82 -2.329 -15.945 -7.422 1.00 0.00 O ATOM 0 H TYR A 82 -2.641 -7.576 -7.255 1.00 0.00 H new ATOM 0 HA TYR A 82 -3.684 -10.143 -7.323 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -0.895 -10.064 -6.592 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -1.781 -10.320 -5.101 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -2.983 -11.570 -8.364 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -0.981 -12.564 -4.737 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -3.199 -14.033 -8.912 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -1.204 -15.024 -5.295 1.00 0.00 H new ATOM 0 HH TYR A 82 -1.923 -16.479 -6.708 1.00 0.00 H new ATOM 1177 N GLY A 83 -3.374 -7.769 -5.168 1.00 0.00 N ATOM 1178 CA GLY A 83 -4.019 -7.085 -4.060 1.00 0.00 C ATOM 1179 C GLY A 83 -2.984 -6.539 -3.074 1.00 0.00 C ATOM 1180 O GLY A 83 -3.264 -6.406 -1.884 1.00 0.00 O ATOM 0 H GLY A 83 -2.628 -7.240 -5.619 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -4.631 -6.267 -4.440 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -4.690 -7.772 -3.545 1.00 0.00 H new ATOM 1184 N GLN A 84 -1.809 -6.237 -3.607 1.00 0.00 N ATOM 1185 CA GLN A 84 -0.731 -5.708 -2.790 1.00 0.00 C ATOM 1186 C GLN A 84 -0.115 -6.820 -1.938 1.00 0.00 C ATOM 1187 O GLN A 84 0.983 -6.665 -1.407 1.00 0.00 O ATOM 1188 CB GLN A 84 -1.222 -4.554 -1.913 1.00 0.00 C ATOM 1189 CG GLN A 84 -0.071 -3.949 -1.106 1.00 0.00 C ATOM 1190 CD GLN A 84 1.032 -3.428 -2.030 1.00 0.00 C ATOM 1191 OE1 GLN A 84 1.014 -2.296 -2.484 1.00 0.00 O ATOM 1192 NE2 GLN A 84 1.991 -4.316 -2.282 1.00 0.00 N ATOM 0 H GLN A 84 -1.580 -6.349 -4.595 1.00 0.00 H new ATOM 0 HA GLN A 84 0.040 -5.315 -3.452 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -1.676 -3.785 -2.538 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -1.997 -4.912 -1.235 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -0.446 -3.135 -0.486 1.00 0.00 H new ATOM 0 HG3 GLN A 84 0.339 -4.701 -0.432 1.00 0.00 H new ATOM 0 HE21 GLN A 84 1.945 -5.248 -1.869 1.00 0.00 H new ATOM 0 HE22 GLN A 84 2.772 -4.065 -2.888 1.00 0.00 H new ATOM 1199 N GLU A 85 -0.851 -7.917 -1.833 1.00 0.00 N ATOM 1200 CA GLU A 85 -0.392 -9.055 -1.055 1.00 0.00 C ATOM 1201 C GLU A 85 -1.439 -10.169 -1.074 1.00 0.00 C ATOM 1202 O GLU A 85 -1.506 -10.979 -0.150 1.00 0.00 O ATOM 1203 CB GLU A 85 -0.059 -8.639 0.380 1.00 0.00 C ATOM 1204 CG GLU A 85 1.210 -9.338 0.873 1.00 0.00 C ATOM 1205 CD GLU A 85 0.886 -10.353 1.970 1.00 0.00 C ATOM 1206 OE1 GLU A 85 0.717 -9.905 3.125 1.00 0.00 O ATOM 1207 OE2 GLU A 85 0.813 -11.554 1.630 1.00 0.00 O ATOM 0 H GLU A 85 -1.762 -8.042 -2.274 1.00 0.00 H new ATOM 0 HA GLU A 85 0.522 -9.436 -1.510 1.00 0.00 H new ATOM 0 HB2 GLU A 85 0.075 -7.558 0.427 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -0.893 -8.886 1.037 1.00 0.00 H new ATOM 0 HG2 GLU A 85 1.699 -9.842 0.039 1.00 0.00 H new ATOM 0 HG3 GLU A 85 1.913 -8.597 1.254 1.00 0.00 H new ATOM 1212 N LYS A 86 -2.233 -10.174 -2.135 1.00 0.00 N ATOM 1213 CA LYS A 86 -3.275 -11.175 -2.287 1.00 0.00 C ATOM 1214 C LYS A 86 -4.296 -11.017 -1.159 1.00 0.00 C ATOM 1215 O LYS A 86 -4.858 -12.002 -0.683 1.00 0.00 O ATOM 1216 CB LYS A 86 -2.664 -12.576 -2.371 1.00 0.00 C ATOM 1217 CG LYS A 86 -3.655 -13.571 -2.977 1.00 0.00 C ATOM 1218 CD LYS A 86 -4.101 -13.122 -4.369 1.00 0.00 C ATOM 1219 CE LYS A 86 -5.577 -12.717 -4.370 1.00 0.00 C ATOM 1220 NZ LYS A 86 -5.907 -11.965 -5.600 1.00 0.00 N ATOM 0 H LYS A 86 -2.175 -9.500 -2.898 1.00 0.00 H new ATOM 0 HA LYS A 86 -3.810 -11.028 -3.225 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -1.758 -12.546 -2.976 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -2.372 -12.909 -1.375 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -3.194 -14.557 -3.039 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -4.524 -13.666 -2.326 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -3.490 -12.281 -4.697 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -3.942 -13.930 -5.084 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -6.204 -13.606 -4.301 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -5.793 -12.106 -3.494 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -6.936 -11.976 -5.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -5.582 -10.982 -5.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -5.435 -12.407 -6.414 1.00 0.00 H new ATOM 1230 N LEU A 87 -4.505 -9.769 -0.764 1.00 0.00 N ATOM 1231 CA LEU A 87 -5.448 -9.470 0.299 1.00 0.00 C ATOM 1232 C LEU A 87 -6.504 -8.492 -0.222 1.00 0.00 C ATOM 1233 O LEU A 87 -7.390 -8.073 0.522 1.00 0.00 O ATOM 1234 CB LEU A 87 -4.712 -8.972 1.545 1.00 0.00 C ATOM 1235 CG LEU A 87 -3.420 -9.711 1.899 1.00 0.00 C ATOM 1236 CD1 LEU A 87 -2.739 -9.073 3.113 1.00 0.00 C ATOM 1237 CD2 LEU A 87 -3.682 -11.203 2.109 1.00 0.00 C ATOM 0 H LEU A 87 -4.037 -8.954 -1.161 1.00 0.00 H new ATOM 0 HA LEU A 87 -5.973 -10.374 0.607 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -4.478 -7.916 1.407 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -5.391 -9.039 2.395 1.00 0.00 H new ATOM 0 HG LEU A 87 -2.733 -9.620 1.058 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -1.823 -9.617 3.344 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.497 -8.034 2.890 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -3.411 -9.114 3.970 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -2.747 -11.705 2.359 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.395 -11.336 2.923 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.091 -11.633 1.195 1.00 0.00 H new ATOM 1248 N ASN A 88 -6.374 -8.157 -1.497 1.00 0.00 N ATOM 1249 CA ASN A 88 -7.306 -7.236 -2.127 1.00 0.00 C ATOM 1250 C ASN A 88 -8.717 -7.504 -1.599 1.00 0.00 C ATOM 1251 O ASN A 88 -9.489 -6.571 -1.382 1.00 0.00 O ATOM 1252 CB ASN A 88 -7.326 -7.425 -3.645 1.00 0.00 C ATOM 1253 CG ASN A 88 -7.010 -6.113 -4.366 1.00 0.00 C ATOM 1254 OD1 ASN A 88 -6.434 -5.193 -3.810 1.00 0.00 O ATOM 1255 ND2 ASN A 88 -7.420 -6.079 -5.631 1.00 0.00 N ATOM 0 H ASN A 88 -5.638 -8.506 -2.111 1.00 0.00 H new ATOM 0 HA ASN A 88 -6.986 -6.221 -1.894 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -6.598 -8.185 -3.930 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -8.305 -7.789 -3.957 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -7.258 -5.246 -6.198 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -7.897 -6.885 -6.034 1.00 0.00 H new ATOM 1261 N GLU A 89 -9.009 -8.781 -1.406 1.00 0.00 N ATOM 1262 CA GLU A 89 -10.313 -9.183 -0.907 1.00 0.00 C ATOM 1263 C GLU A 89 -10.753 -8.261 0.232 1.00 0.00 C ATOM 1264 O GLU A 89 -11.920 -7.882 0.314 1.00 0.00 O ATOM 1265 CB GLU A 89 -10.301 -10.645 -0.455 1.00 0.00 C ATOM 1266 CG GLU A 89 -9.345 -10.847 0.721 1.00 0.00 C ATOM 1267 CD GLU A 89 -9.230 -12.329 1.087 1.00 0.00 C ATOM 1268 OE1 GLU A 89 -10.299 -12.960 1.239 1.00 0.00 O ATOM 1269 OE2 GLU A 89 -8.078 -12.797 1.207 1.00 0.00 O ATOM 0 H GLU A 89 -8.365 -9.551 -1.586 1.00 0.00 H new ATOM 0 HA GLU A 89 -11.034 -9.094 -1.720 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -11.307 -10.948 -0.166 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -10.001 -11.284 -1.286 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -8.361 -10.455 0.466 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -9.699 -10.282 1.583 1.00 0.00 H new ATOM 1274 N LYS A 90 -9.795 -7.927 1.084 1.00 0.00 N ATOM 1275 CA LYS A 90 -10.067 -7.057 2.215 1.00 0.00 C ATOM 1276 C LYS A 90 -9.136 -5.845 2.157 1.00 0.00 C ATOM 1277 O LYS A 90 -9.228 -4.947 2.993 1.00 0.00 O ATOM 1278 CB LYS A 90 -9.978 -7.839 3.527 1.00 0.00 C ATOM 1279 CG LYS A 90 -11.234 -7.629 4.376 1.00 0.00 C ATOM 1280 CD LYS A 90 -12.137 -8.863 4.333 1.00 0.00 C ATOM 1281 CE LYS A 90 -13.569 -8.481 3.952 1.00 0.00 C ATOM 1282 NZ LYS A 90 -14.457 -8.551 5.134 1.00 0.00 N ATOM 0 H LYS A 90 -8.828 -8.244 1.013 1.00 0.00 H new ATOM 0 HA LYS A 90 -11.088 -6.678 2.166 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -9.852 -8.901 3.314 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -9.099 -7.519 4.086 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -10.949 -7.418 5.407 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -11.782 -6.760 4.012 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -11.744 -9.581 3.613 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -12.134 -9.354 5.306 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -13.585 -7.473 3.538 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -13.936 -9.151 3.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -15.425 -8.289 4.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -14.456 -9.520 5.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -14.116 -7.894 5.864 1.00 0.00 H new ATOM 1292 N LEU A 91 -8.261 -5.858 1.163 1.00 0.00 N ATOM 1293 CA LEU A 91 -7.313 -4.771 0.985 1.00 0.00 C ATOM 1294 C LEU A 91 -7.978 -3.645 0.190 1.00 0.00 C ATOM 1295 O LEU A 91 -7.604 -2.481 0.323 1.00 0.00 O ATOM 1296 CB LEU A 91 -6.018 -5.286 0.354 1.00 0.00 C ATOM 1297 CG LEU A 91 -4.809 -5.380 1.288 1.00 0.00 C ATOM 1298 CD1 LEU A 91 -4.124 -4.019 1.434 1.00 0.00 C ATOM 1299 CD2 LEU A 91 -5.205 -5.970 2.642 1.00 0.00 C ATOM 0 H LEU A 91 -8.188 -6.605 0.472 1.00 0.00 H new ATOM 0 HA LEU A 91 -7.026 -4.355 1.951 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -6.208 -6.275 -0.063 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -5.759 -4.633 -0.480 1.00 0.00 H new ATOM 0 HG LEU A 91 -4.084 -6.061 0.841 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -3.268 -4.112 2.102 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -3.785 -3.675 0.457 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -4.830 -3.299 1.847 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -4.327 -6.025 3.286 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -5.958 -5.335 3.109 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -5.613 -6.971 2.498 1.00 0.00 H new ATOM 1310 N ASN A 92 -8.953 -4.031 -0.620 1.00 0.00 N ATOM 1311 CA ASN A 92 -9.674 -3.069 -1.436 1.00 0.00 C ATOM 1312 C ASN A 92 -10.272 -1.988 -0.534 1.00 0.00 C ATOM 1313 O ASN A 92 -10.181 -0.800 -0.839 1.00 0.00 O ATOM 1314 CB ASN A 92 -10.820 -3.740 -2.195 1.00 0.00 C ATOM 1315 CG ASN A 92 -11.765 -4.465 -1.233 1.00 0.00 C ATOM 1316 OD1 ASN A 92 -11.350 -5.146 -0.310 1.00 0.00 O ATOM 1317 ND2 ASN A 92 -13.054 -4.279 -1.499 1.00 0.00 N ATOM 0 H ASN A 92 -9.261 -4.997 -0.729 1.00 0.00 H new ATOM 0 HA ASN A 92 -8.972 -2.639 -2.150 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -11.375 -2.991 -2.760 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -10.416 -4.449 -2.917 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -13.764 -4.719 -0.914 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -13.333 -3.696 -2.288 1.00 0.00 H new ATOM 1323 N THR A 93 -10.870 -2.439 0.559 1.00 0.00 N ATOM 1324 CA THR A 93 -11.483 -1.525 1.507 1.00 0.00 C ATOM 1325 C THR A 93 -10.461 -1.077 2.553 1.00 0.00 C ATOM 1326 O THR A 93 -10.464 0.080 2.973 1.00 0.00 O ATOM 1327 CB THR A 93 -12.706 -2.220 2.112 1.00 0.00 C ATOM 1328 OG1 THR A 93 -13.390 -1.179 2.802 1.00 0.00 O ATOM 1329 CG2 THR A 93 -12.330 -3.213 3.213 1.00 0.00 C ATOM 0 H THR A 93 -10.943 -3.425 0.809 1.00 0.00 H new ATOM 0 HA THR A 93 -11.820 -0.613 1.015 1.00 0.00 H new ATOM 0 HB THR A 93 -13.254 -2.740 1.326 1.00 0.00 H new ATOM 0 HG1 THR A 93 -14.197 -1.541 3.223 1.00 0.00 H new ATOM 0 HG21 THR A 93 -13.233 -3.678 3.608 1.00 0.00 H new ATOM 0 HG22 THR A 93 -11.676 -3.982 2.802 1.00 0.00 H new ATOM 0 HG23 THR A 93 -11.812 -2.688 4.015 1.00 0.00 H new ATOM 1337 N ILE A 94 -9.610 -2.015 2.943 1.00 0.00 N ATOM 1338 CA ILE A 94 -8.584 -1.730 3.932 1.00 0.00 C ATOM 1339 C ILE A 94 -7.612 -0.691 3.368 1.00 0.00 C ATOM 1340 O ILE A 94 -7.020 0.082 4.119 1.00 0.00 O ATOM 1341 CB ILE A 94 -7.905 -3.024 4.385 1.00 0.00 C ATOM 1342 CG1 ILE A 94 -8.835 -3.847 5.279 1.00 0.00 C ATOM 1343 CG2 ILE A 94 -6.566 -2.731 5.067 1.00 0.00 C ATOM 1344 CD1 ILE A 94 -8.336 -5.288 5.410 1.00 0.00 C ATOM 0 H ILE A 94 -9.610 -2.973 2.592 1.00 0.00 H new ATOM 0 HA ILE A 94 -9.028 -1.298 4.829 1.00 0.00 H new ATOM 0 HB ILE A 94 -7.692 -3.625 3.501 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -8.896 -3.388 6.266 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -9.842 -3.844 4.863 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -6.104 -3.668 5.379 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -5.907 -2.217 4.368 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -6.733 -2.100 5.940 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -9.015 -5.851 6.050 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -8.299 -5.751 4.424 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -7.338 -5.289 5.849 1.00 0.00 H new ATOM 1355 N ILE A 95 -7.480 -0.706 2.049 1.00 0.00 N ATOM 1356 CA ILE A 95 -6.590 0.225 1.376 1.00 0.00 C ATOM 1357 C ILE A 95 -7.306 1.566 1.196 1.00 0.00 C ATOM 1358 O ILE A 95 -6.742 2.619 1.491 1.00 0.00 O ATOM 1359 CB ILE A 95 -6.074 -0.377 0.069 1.00 0.00 C ATOM 1360 CG1 ILE A 95 -4.783 0.312 -0.381 1.00 0.00 C ATOM 1361 CG2 ILE A 95 -7.152 -0.338 -1.016 1.00 0.00 C ATOM 1362 CD1 ILE A 95 -5.065 1.343 -1.475 1.00 0.00 C ATOM 0 H ILE A 95 -7.974 -1.348 1.429 1.00 0.00 H new ATOM 0 HA ILE A 95 -5.705 0.414 1.983 1.00 0.00 H new ATOM 0 HB ILE A 95 -5.834 -1.425 0.248 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -4.311 0.801 0.471 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -4.079 -0.433 -0.751 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -6.759 -0.772 -1.935 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -8.020 -0.909 -0.687 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -7.446 0.695 -1.200 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -4.131 1.818 -1.777 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -5.514 0.847 -2.335 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -5.750 2.100 -1.094 1.00 0.00 H new ATOM 1373 N LYS A 96 -8.536 1.484 0.712 1.00 0.00 N ATOM 1374 CA LYS A 96 -9.333 2.678 0.490 1.00 0.00 C ATOM 1375 C LYS A 96 -9.534 3.408 1.819 1.00 0.00 C ATOM 1376 O LYS A 96 -9.863 4.593 1.836 1.00 0.00 O ATOM 1377 CB LYS A 96 -10.642 2.323 -0.220 1.00 0.00 C ATOM 1378 CG LYS A 96 -10.425 2.171 -1.728 1.00 0.00 C ATOM 1379 CD LYS A 96 -11.718 1.750 -2.429 1.00 0.00 C ATOM 1380 CE LYS A 96 -11.447 1.338 -3.876 1.00 0.00 C ATOM 1381 NZ LYS A 96 -12.720 1.124 -4.602 1.00 0.00 N ATOM 0 H LYS A 96 -9.000 0.609 0.467 1.00 0.00 H new ATOM 0 HA LYS A 96 -8.811 3.366 -0.175 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -11.041 1.395 0.189 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -11.384 3.099 -0.032 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -10.072 3.114 -2.145 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -9.648 1.429 -1.914 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -12.174 0.920 -1.890 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -12.432 2.574 -2.409 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -10.862 2.109 -4.376 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -10.853 0.424 -3.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -12.517 0.845 -5.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -13.265 0.372 -4.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -13.273 2.005 -4.600 1.00 0.00 H new ATOM 1391 N GLN A 97 -9.326 2.671 2.900 1.00 0.00 N ATOM 1392 CA GLN A 97 -9.479 3.233 4.230 1.00 0.00 C ATOM 1393 C GLN A 97 -8.109 3.520 4.846 1.00 0.00 C ATOM 1394 O GLN A 97 -7.870 4.614 5.355 1.00 0.00 O ATOM 1395 CB GLN A 97 -10.301 2.305 5.127 1.00 0.00 C ATOM 1396 CG GLN A 97 -11.778 2.704 5.122 1.00 0.00 C ATOM 1397 CD GLN A 97 -12.491 2.154 3.884 1.00 0.00 C ATOM 1398 OE1 GLN A 97 -11.911 1.997 2.822 1.00 0.00 O ATOM 1399 NE2 GLN A 97 -13.775 1.873 4.080 1.00 0.00 N ATOM 0 H GLN A 97 -9.053 1.689 2.881 1.00 0.00 H new ATOM 0 HA GLN A 97 -10.021 4.175 4.145 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -10.198 1.276 4.783 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -9.914 2.341 6.145 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -12.263 2.328 6.023 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -11.865 3.790 5.143 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -14.197 2.029 4.995 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -14.338 1.502 3.315 1.00 0.00 H new ATOM 1406 N ILE A 98 -7.244 2.517 4.781 1.00 0.00 N ATOM 1407 CA ILE A 98 -5.904 2.648 5.326 1.00 0.00 C ATOM 1408 C ILE A 98 -5.026 3.410 4.332 1.00 0.00 C ATOM 1409 O ILE A 98 -3.846 3.643 4.592 1.00 0.00 O ATOM 1410 CB ILE A 98 -5.347 1.276 5.712 1.00 0.00 C ATOM 1411 CG1 ILE A 98 -4.665 1.327 7.082 1.00 0.00 C ATOM 1412 CG2 ILE A 98 -4.413 0.739 4.627 1.00 0.00 C ATOM 1413 CD1 ILE A 98 -5.666 1.697 8.179 1.00 0.00 C ATOM 0 H ILE A 98 -7.446 1.611 4.359 1.00 0.00 H new ATOM 0 HA ILE A 98 -5.922 3.230 6.247 1.00 0.00 H new ATOM 0 HB ILE A 98 -6.181 0.579 5.793 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -4.217 0.359 7.305 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -3.855 2.056 7.062 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -4.031 -0.237 4.926 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -4.961 0.642 3.690 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -3.580 1.428 4.490 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -5.156 1.726 9.142 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -6.095 2.676 7.965 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -6.461 0.952 8.212 1.00 0.00 H new ATOM 1424 N LEU A 99 -5.635 3.779 3.215 1.00 0.00 N ATOM 1425 CA LEU A 99 -4.923 4.511 2.181 1.00 0.00 C ATOM 1426 C LEU A 99 -5.629 5.845 1.928 1.00 0.00 C ATOM 1427 O LEU A 99 -4.977 6.869 1.734 1.00 0.00 O ATOM 1428 CB LEU A 99 -4.768 3.650 0.925 1.00 0.00 C ATOM 1429 CG LEU A 99 -3.497 3.885 0.105 1.00 0.00 C ATOM 1430 CD1 LEU A 99 -3.657 5.097 -0.816 1.00 0.00 C ATOM 1431 CD2 LEU A 99 -2.273 4.013 1.013 1.00 0.00 C ATOM 0 H LEU A 99 -6.614 3.585 3.003 1.00 0.00 H new ATOM 0 HA LEU A 99 -3.909 4.743 2.508 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -4.797 2.601 1.221 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -5.630 3.823 0.281 1.00 0.00 H new ATOM 0 HG LEU A 99 -3.335 3.015 -0.531 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -2.741 5.243 -1.388 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -4.488 4.927 -1.500 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -3.856 5.986 -0.217 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -1.384 4.179 0.404 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -2.410 4.854 1.692 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -2.151 3.097 1.590 1.00 0.00 H new ATOM 1442 N SER A 100 -6.953 5.788 1.938 1.00 0.00 N ATOM 1443 CA SER A 100 -7.755 6.979 1.713 1.00 0.00 C ATOM 1444 C SER A 100 -8.507 7.353 2.991 1.00 0.00 C ATOM 1445 O SER A 100 -8.766 8.530 3.240 1.00 0.00 O ATOM 1446 CB SER A 100 -8.739 6.769 0.560 1.00 0.00 C ATOM 1447 OG SER A 100 -10.093 6.819 0.999 1.00 0.00 O ATOM 0 H SER A 100 -7.490 4.936 2.098 1.00 0.00 H new ATOM 0 HA SER A 100 -7.086 7.796 1.441 1.00 0.00 H new ATOM 0 HB2 SER A 100 -8.576 7.533 -0.200 1.00 0.00 H new ATOM 0 HB3 SER A 100 -8.546 5.805 0.089 1.00 0.00 H new ATOM 0 HG SER A 100 -10.434 5.907 1.113 1.00 0.00 H new ATOM 1452 N ILE A 101 -8.837 6.332 3.767 1.00 0.00 N ATOM 1453 CA ILE A 101 -9.553 6.540 5.013 1.00 0.00 C ATOM 1454 C ILE A 101 -10.900 7.202 4.717 1.00 0.00 C ATOM 1455 O ILE A 101 -11.538 7.751 5.615 1.00 0.00 O ATOM 1456 CB ILE A 101 -8.689 7.320 6.005 1.00 0.00 C ATOM 1457 CG1 ILE A 101 -8.571 6.573 7.336 1.00 0.00 C ATOM 1458 CG2 ILE A 101 -9.218 8.743 6.192 1.00 0.00 C ATOM 1459 CD1 ILE A 101 -9.926 6.012 7.771 1.00 0.00 C ATOM 0 H ILE A 101 -8.621 5.357 3.557 1.00 0.00 H new ATOM 0 HA ILE A 101 -9.765 5.585 5.494 1.00 0.00 H new ATOM 0 HB ILE A 101 -7.684 7.402 5.591 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -7.851 5.760 7.239 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -8.189 7.247 8.103 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -8.586 9.276 6.902 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -9.207 9.264 5.235 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -10.239 8.705 6.573 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -9.815 5.486 8.719 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -10.637 6.830 7.891 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -10.294 5.320 7.013 1.00 0.00 H new ATOM 1470 N SER A 102 -11.296 7.129 3.454 1.00 0.00 N ATOM 1471 CA SER A 102 -12.554 7.716 3.030 1.00 0.00 C ATOM 1472 C SER A 102 -12.391 9.224 2.837 1.00 0.00 C ATOM 1473 O SER A 102 -13.368 9.933 2.599 1.00 0.00 O ATOM 1474 CB SER A 102 -13.666 7.426 4.040 1.00 0.00 C ATOM 1475 OG SER A 102 -14.933 7.263 3.409 1.00 0.00 O ATOM 0 H SER A 102 -10.767 6.672 2.711 1.00 0.00 H new ATOM 0 HA SER A 102 -12.838 7.264 2.079 1.00 0.00 H new ATOM 0 HB2 SER A 102 -13.421 6.523 4.599 1.00 0.00 H new ATOM 0 HB3 SER A 102 -13.723 8.242 4.761 1.00 0.00 H new ATOM 0 HG SER A 102 -15.615 7.078 4.088 1.00 0.00 H new ATOM 1480 N VAL A 103 -11.149 9.672 2.948 1.00 0.00 N ATOM 1481 CA VAL A 103 -10.846 11.084 2.790 1.00 0.00 C ATOM 1482 C VAL A 103 -10.283 11.326 1.388 1.00 0.00 C ATOM 1483 O VAL A 103 -10.296 12.453 0.896 1.00 0.00 O ATOM 1484 CB VAL A 103 -9.900 11.544 3.902 1.00 0.00 C ATOM 1485 CG1 VAL A 103 -9.215 12.860 3.528 1.00 0.00 C ATOM 1486 CG2 VAL A 103 -10.641 11.670 5.234 1.00 0.00 C ATOM 0 H VAL A 103 -10.341 9.082 3.145 1.00 0.00 H new ATOM 0 HA VAL A 103 -11.752 11.682 2.885 1.00 0.00 H new ATOM 0 HB VAL A 103 -9.126 10.785 4.020 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -8.548 13.165 4.335 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -8.639 12.723 2.613 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -9.969 13.631 3.370 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -9.946 11.998 6.007 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -11.445 12.399 5.135 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -11.060 10.702 5.510 1.00 0.00 H new ATOM 1496 N SER A 104 -9.801 10.249 0.785 1.00 0.00 N ATOM 1497 CA SER A 104 -9.234 10.329 -0.551 1.00 0.00 C ATOM 1498 C SER A 104 -10.124 9.580 -1.543 1.00 0.00 C ATOM 1499 O SER A 104 -10.082 9.843 -2.744 1.00 0.00 O ATOM 1500 CB SER A 104 -7.813 9.765 -0.582 1.00 0.00 C ATOM 1501 OG SER A 104 -6.844 10.773 -0.860 1.00 0.00 O ATOM 0 H SER A 104 -9.791 9.316 1.197 1.00 0.00 H new ATOM 0 HA SER A 104 -9.185 11.379 -0.838 1.00 0.00 H new ATOM 0 HB2 SER A 104 -7.587 9.299 0.377 1.00 0.00 H new ATOM 0 HB3 SER A 104 -7.750 8.983 -1.339 1.00 0.00 H new ATOM 0 HG SER A 104 -6.264 10.476 -1.593 1.00 0.00 H new ATOM 1506 N GLU A 105 -10.912 8.659 -1.005 1.00 0.00 N ATOM 1507 CA GLU A 105 -11.810 7.869 -1.829 1.00 0.00 C ATOM 1508 C GLU A 105 -12.460 8.747 -2.901 1.00 0.00 C ATOM 1509 O GLU A 105 -12.755 8.278 -3.998 1.00 0.00 O ATOM 1510 CB GLU A 105 -12.871 7.176 -0.973 1.00 0.00 C ATOM 1511 CG GLU A 105 -13.882 6.431 -1.847 1.00 0.00 C ATOM 1512 CD GLU A 105 -13.227 5.238 -2.547 1.00 0.00 C ATOM 1513 OE1 GLU A 105 -12.114 4.867 -2.115 1.00 0.00 O ATOM 1514 OE2 GLU A 105 -13.853 4.724 -3.498 1.00 0.00 O ATOM 0 H GLU A 105 -10.946 8.443 -0.009 1.00 0.00 H new ATOM 0 HA GLU A 105 -11.227 7.094 -2.327 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -12.391 6.476 -0.289 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -13.389 7.915 -0.361 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -14.714 6.085 -1.233 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -14.296 7.111 -2.591 1.00 0.00 H new ATOM 1519 N GLU A 106 -12.660 10.007 -2.544 1.00 0.00 N ATOM 1520 CA GLU A 106 -13.269 10.956 -3.462 1.00 0.00 C ATOM 1521 C GLU A 106 -14.727 10.577 -3.728 1.00 0.00 C ATOM 1522 O GLU A 106 -15.393 11.199 -4.554 1.00 0.00 O ATOM 1523 CB GLU A 106 -12.478 11.040 -4.769 1.00 0.00 C ATOM 1524 CG GLU A 106 -11.348 12.067 -4.661 1.00 0.00 C ATOM 1525 CD GLU A 106 -11.904 13.463 -4.372 1.00 0.00 C ATOM 1526 OE1 GLU A 106 -12.348 14.109 -5.345 1.00 0.00 O ATOM 1527 OE2 GLU A 106 -11.870 13.853 -3.185 1.00 0.00 O ATOM 0 H GLU A 106 -12.412 10.393 -1.633 1.00 0.00 H new ATOM 0 HA GLU A 106 -13.249 11.943 -2.999 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -12.063 10.061 -5.011 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -13.146 11.314 -5.586 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -10.660 11.774 -3.868 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -10.777 12.084 -5.589 1.00 0.00 H new ATOM 1532 N GLY A 107 -15.181 9.559 -3.012 1.00 0.00 N ATOM 1533 CA GLY A 107 -16.548 9.090 -3.160 1.00 0.00 C ATOM 1534 C GLY A 107 -16.784 8.522 -4.560 1.00 0.00 C ATOM 1535 O GLY A 107 -17.159 7.359 -4.707 1.00 0.00 O ATOM 0 H GLY A 107 -14.626 9.046 -2.327 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -16.756 8.324 -2.413 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -17.240 9.912 -2.976 1.00 0.00 H new ATOM 1539 N GLU A 108 -16.554 9.367 -5.554 1.00 0.00 N ATOM 1540 CA GLU A 108 -16.737 8.963 -6.937 1.00 0.00 C ATOM 1541 C GLU A 108 -15.897 9.846 -7.863 1.00 0.00 C ATOM 1542 O GLU A 108 -16.164 9.925 -9.061 1.00 0.00 O ATOM 1543 CB GLU A 108 -18.215 9.007 -7.331 1.00 0.00 C ATOM 1544 CG GLU A 108 -18.576 7.830 -8.240 1.00 0.00 C ATOM 1545 CD GLU A 108 -18.973 6.603 -7.417 1.00 0.00 C ATOM 1546 OE1 GLU A 108 -19.686 6.802 -6.410 1.00 0.00 O ATOM 1547 OE2 GLU A 108 -18.554 5.494 -7.813 1.00 0.00 O ATOM 0 H GLU A 108 -16.242 10.330 -5.429 1.00 0.00 H new ATOM 0 HA GLU A 108 -16.398 7.932 -7.042 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -18.835 8.982 -6.435 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -18.431 9.945 -7.842 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -19.398 8.113 -8.898 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -17.727 7.585 -8.878 1.00 0.00 H new ATOM 1552 N LYS A 109 -14.899 10.486 -7.273 1.00 0.00 N ATOM 1553 CA LYS A 109 -14.019 11.359 -8.029 1.00 0.00 C ATOM 1554 C LYS A 109 -12.698 10.635 -8.299 1.00 0.00 C ATOM 1555 O LYS A 109 -11.672 11.273 -8.530 1.00 0.00 O ATOM 1556 CB LYS A 109 -13.849 12.700 -7.313 1.00 0.00 C ATOM 1557 CG LYS A 109 -14.385 13.851 -8.168 1.00 0.00 C ATOM 1558 CD LYS A 109 -15.798 14.244 -7.734 1.00 0.00 C ATOM 1559 CE LYS A 109 -16.838 13.751 -8.741 1.00 0.00 C ATOM 1560 NZ LYS A 109 -17.550 14.895 -9.353 1.00 0.00 N ATOM 0 H LYS A 109 -14.680 10.417 -6.279 1.00 0.00 H new ATOM 0 HA LYS A 109 -14.458 11.595 -8.998 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -14.375 12.676 -6.359 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -12.795 12.867 -7.092 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -13.722 14.712 -8.082 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -14.392 13.557 -9.218 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -16.010 13.823 -6.751 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -15.865 15.328 -7.638 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -16.350 13.161 -9.517 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -17.552 13.095 -8.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -18.252 14.543 -10.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -18.031 15.442 -8.611 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -16.867 15.506 -9.845 1.00 0.00 H new ATOM 1570 N GLU A 110 -12.767 9.313 -8.263 1.00 0.00 N ATOM 1571 CA GLU A 110 -11.590 8.495 -8.501 1.00 0.00 C ATOM 1572 C GLU A 110 -11.807 7.593 -9.717 1.00 0.00 C ATOM 1573 O GLU A 110 -11.478 6.408 -9.682 1.00 0.00 O ATOM 1574 CB GLU A 110 -11.236 7.669 -7.261 1.00 0.00 C ATOM 1575 CG GLU A 110 -9.767 7.858 -6.879 1.00 0.00 C ATOM 1576 CD GLU A 110 -9.460 7.192 -5.535 1.00 0.00 C ATOM 1577 OE1 GLU A 110 -9.549 5.947 -5.487 1.00 0.00 O ATOM 1578 OE2 GLU A 110 -9.145 7.944 -4.588 1.00 0.00 O ATOM 0 H GLU A 110 -13.620 8.787 -8.072 1.00 0.00 H new ATOM 0 HA GLU A 110 -10.749 9.156 -8.709 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -11.873 7.965 -6.428 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -11.433 6.614 -7.454 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -9.128 7.433 -7.654 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -9.536 8.922 -6.823 1.00 0.00 H new ATOM 1583 N LEU A 111 -12.360 8.187 -10.763 1.00 0.00 N ATOM 1584 CA LEU A 111 -12.626 7.452 -11.988 1.00 0.00 C ATOM 1585 C LEU A 111 -12.373 8.363 -13.190 1.00 0.00 C ATOM 1586 O LEU A 111 -12.802 9.516 -13.200 1.00 0.00 O ATOM 1587 CB LEU A 111 -14.033 6.850 -11.958 1.00 0.00 C ATOM 1588 CG LEU A 111 -14.108 5.323 -11.956 1.00 0.00 C ATOM 1589 CD1 LEU A 111 -15.251 4.832 -11.064 1.00 0.00 C ATOM 1590 CD2 LEU A 111 -14.219 4.777 -13.381 1.00 0.00 C ATOM 0 H LEU A 111 -12.632 9.170 -10.788 1.00 0.00 H new ATOM 0 HA LEU A 111 -11.944 6.606 -12.079 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -14.546 7.220 -11.071 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -14.584 7.220 -12.823 1.00 0.00 H new ATOM 0 HG LEU A 111 -13.180 4.936 -11.534 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -15.283 3.743 -11.080 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -15.088 5.175 -10.042 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -16.197 5.228 -11.434 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -14.271 3.689 -13.351 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -15.120 5.170 -13.852 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -13.346 5.083 -13.957 1.00 0.00 H new ATOM 1601 N VAL A 112 -11.677 7.812 -14.175 1.00 0.00 N ATOM 1602 CA VAL A 112 -11.363 8.561 -15.379 1.00 0.00 C ATOM 1603 C VAL A 112 -11.431 7.627 -16.588 1.00 0.00 C ATOM 1604 O VAL A 112 -10.409 7.105 -17.033 1.00 0.00 O ATOM 1605 CB VAL A 112 -10.002 9.246 -15.228 1.00 0.00 C ATOM 1606 CG1 VAL A 112 -9.510 9.790 -16.571 1.00 0.00 C ATOM 1607 CG2 VAL A 112 -10.060 10.354 -14.175 1.00 0.00 C ATOM 0 H VAL A 112 -11.322 6.856 -14.163 1.00 0.00 H new ATOM 0 HA VAL A 112 -12.095 9.352 -15.539 1.00 0.00 H new ATOM 0 HB VAL A 112 -9.286 8.498 -14.888 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -8.542 10.272 -16.436 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -9.411 8.970 -17.282 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -10.226 10.517 -16.954 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -9.081 10.824 -14.087 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -10.796 11.101 -14.473 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -10.345 9.927 -13.213 1.00 0.00 H new ATOM 1617 N PRO A 113 -12.677 7.438 -17.099 1.00 0.00 N ATOM 1618 CA PRO A 113 -12.892 6.576 -18.248 1.00 0.00 C ATOM 1619 C PRO A 113 -12.428 7.255 -19.538 1.00 0.00 C ATOM 1620 O PRO A 113 -12.203 8.465 -19.561 1.00 0.00 O ATOM 1621 CB PRO A 113 -14.382 6.273 -18.239 1.00 0.00 C ATOM 1622 CG PRO A 113 -15.019 7.343 -17.367 1.00 0.00 C ATOM 1623 CD PRO A 113 -13.909 8.040 -16.598 1.00 0.00 C ATOM 0 HA PRO A 113 -12.311 5.655 -18.197 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -14.792 6.297 -19.249 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -14.576 5.277 -17.840 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -15.566 8.059 -17.980 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -15.738 6.897 -16.680 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -13.923 9.116 -16.771 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -14.016 7.888 -15.524 1.00 0.00 H new ATOM 1628 N ARG A 114 -12.300 6.449 -20.581 1.00 0.00 N ATOM 1629 CA ARG A 114 -11.867 6.957 -21.872 1.00 0.00 C ATOM 1630 C ARG A 114 -10.665 7.887 -21.701 1.00 0.00 C ATOM 1631 O ARG A 114 -10.111 8.380 -22.682 1.00 0.00 O ATOM 1632 CB ARG A 114 -12.997 7.718 -22.571 1.00 0.00 C ATOM 1633 CG ARG A 114 -13.140 7.270 -24.027 1.00 0.00 C ATOM 1634 CD ARG A 114 -13.288 8.474 -24.959 1.00 0.00 C ATOM 1635 NE ARG A 114 -14.557 8.375 -25.714 1.00 0.00 N ATOM 1636 CZ ARG A 114 -14.963 9.274 -26.623 1.00 0.00 C ATOM 1637 NH1 ARG A 114 -14.202 10.343 -26.893 1.00 0.00 N ATOM 1638 NH2 ARG A 114 -16.130 9.103 -27.260 1.00 0.00 N ATOM 0 H ARG A 114 -12.489 5.447 -20.559 1.00 0.00 H new ATOM 0 HA ARG A 114 -11.584 6.102 -22.487 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -13.935 7.551 -22.041 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -12.797 8.789 -22.534 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -12.268 6.685 -24.319 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -14.008 6.619 -24.127 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -13.271 9.397 -24.380 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -12.446 8.515 -25.650 1.00 0.00 H new ATOM 0 HE ARG A 114 -15.161 7.573 -25.532 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -13.314 10.473 -26.407 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -14.510 11.027 -27.584 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -16.709 8.289 -27.053 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -16.439 9.787 -27.951 1.00 0.00 H new TER 1649 ARG A 114