USER MOD reduce.3.24.130724 H: found=0, std=0, add=918, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 920 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 TYR OH : rot -159:sc= 1.33 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ -145:sc= 0.993 (180deg=-0.38) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 GLN : amide:sc= -0.95 K(o=-0.95,f=0) USER MOD Single : A 27 LYS NZ :NH3+ -175:sc= 2.41 (180deg=2.32) USER MOD Single : A 28 LYS NZ :NH3+ -173:sc=-0.00705 (180deg=-0.0687) USER MOD Single : A 29 LYS NZ :NH3+ -162:sc= -0.114 (180deg=-0.506) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 42 ASN : amide:sc= -0.188 X(o=-0.19,f=-0.41) USER MOD Single : A 43 LYS NZ :NH3+ 160:sc= 1.29 (180deg=1.17) USER MOD Single : A 47 MET CE :methyl -160:sc= 0 (180deg=-0.403) USER MOD Single : A 50 CYS SG : rot 24:sc= 1.28 USER MOD Single : A 51 TYR OH : rot 70:sc= 1.04 USER MOD Single : A 52 LYS NZ :NH3+ -160:sc= 0.222! (180deg=-0.489!) USER MOD Single : A 54 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0152) USER MOD Single : A 57 SER OG : rot -49:sc= 0.186 USER MOD Single : A 58 SER OG : rot -161:sc= -1.1 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 TYR OH : rot 167:sc= 0.322 USER MOD Single : A 65 GLN : amide:sc= -1.5! K(o=-1.5!,f=-0.05) USER MOD Single : A 70 LYS NZ :NH3+ -171:sc=-0.00261 (180deg=-0.113) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ -133:sc= -0.751 (180deg=-2.89!) USER MOD Single : B 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 68 ASN : amide:sc= -0.0275 X(o=-0.028,f=-0.18) USER MOD Single : B 70 LYS NZ :NH3+ -162:sc= -0.0576 (180deg=-0.32) USER MOD Single : B 75 THR OG1 : rot -64:sc= 0.473 USER MOD ----------------------------------------------------------------- ATOM 18 N ALA A 2 7.430 12.673 -5.468 1.00 0.00 N ATOM 19 CA ALA A 2 8.861 12.449 -5.565 1.00 0.00 C ATOM 20 C ALA A 2 9.097 11.007 -5.998 1.00 0.00 C ATOM 21 O ALA A 2 10.017 10.701 -6.737 1.00 0.00 O ATOM 22 CB ALA A 2 9.548 12.729 -4.232 1.00 0.00 C ATOM 0 HA ALA A 2 9.288 13.131 -6.301 1.00 0.00 H new ATOM 0 HB1 ALA A 2 10.619 12.554 -4.331 1.00 0.00 H new ATOM 0 HB2 ALA A 2 9.375 13.766 -3.944 1.00 0.00 H new ATOM 0 HB3 ALA A 2 9.141 12.067 -3.467 1.00 0.00 H new ATOM 28 N TYR A 3 8.255 10.126 -5.499 1.00 0.00 N ATOM 29 CA TYR A 3 8.276 8.728 -5.851 1.00 0.00 C ATOM 30 C TYR A 3 7.253 8.438 -6.939 1.00 0.00 C ATOM 31 O TYR A 3 6.337 9.247 -7.177 1.00 0.00 O ATOM 32 CB TYR A 3 7.967 7.853 -4.625 1.00 0.00 C ATOM 33 CG TYR A 3 9.059 7.800 -3.568 1.00 0.00 C ATOM 34 CD1 TYR A 3 9.263 8.858 -2.693 1.00 0.00 C ATOM 35 CD2 TYR A 3 9.880 6.682 -3.440 1.00 0.00 C ATOM 36 CE1 TYR A 3 10.244 8.812 -1.727 1.00 0.00 C ATOM 37 CE2 TYR A 3 10.865 6.624 -2.468 1.00 0.00 C ATOM 38 CZ TYR A 3 11.040 7.693 -1.612 1.00 0.00 C ATOM 39 OH TYR A 3 12.015 7.651 -0.626 1.00 0.00 O ATOM 0 H TYR A 3 7.527 10.368 -4.827 1.00 0.00 H new ATOM 0 HA TYR A 3 9.275 8.492 -6.218 1.00 0.00 H new ATOM 0 HB2 TYR A 3 7.052 8.220 -4.160 1.00 0.00 H new ATOM 0 HB3 TYR A 3 7.766 6.838 -4.966 1.00 0.00 H new ATOM 0 HD1 TYR A 3 8.639 9.736 -2.771 1.00 0.00 H new ATOM 0 HD2 TYR A 3 9.746 5.846 -4.110 1.00 0.00 H new ATOM 0 HE1 TYR A 3 10.389 9.650 -1.062 1.00 0.00 H new ATOM 0 HE2 TYR A 3 11.492 5.749 -2.380 1.00 0.00 H new ATOM 0 HH TYR A 3 12.696 6.988 -0.867 1.00 0.00 H new ATOM 49 N PHE A 4 7.409 7.316 -7.602 1.00 0.00 N ATOM 50 CA PHE A 4 6.437 6.871 -8.575 1.00 0.00 C ATOM 51 C PHE A 4 5.530 5.886 -7.885 1.00 0.00 C ATOM 52 O PHE A 4 5.861 5.402 -6.791 1.00 0.00 O ATOM 53 CB PHE A 4 7.106 6.205 -9.775 1.00 0.00 C ATOM 54 CG PHE A 4 8.118 7.059 -10.465 1.00 0.00 C ATOM 55 CD1 PHE A 4 7.731 8.033 -11.356 1.00 0.00 C ATOM 56 CD2 PHE A 4 9.461 6.885 -10.213 1.00 0.00 C ATOM 57 CE1 PHE A 4 8.666 8.821 -11.983 1.00 0.00 C ATOM 58 CE2 PHE A 4 10.401 7.658 -10.830 1.00 0.00 C ATOM 59 CZ PHE A 4 10.006 8.634 -11.720 1.00 0.00 C ATOM 0 H PHE A 4 8.206 6.690 -7.484 1.00 0.00 H new ATOM 0 HA PHE A 4 5.880 7.728 -8.953 1.00 0.00 H new ATOM 0 HB2 PHE A 4 7.589 5.286 -9.443 1.00 0.00 H new ATOM 0 HB3 PHE A 4 6.337 5.920 -10.493 1.00 0.00 H new ATOM 0 HD1 PHE A 4 6.682 8.180 -11.565 1.00 0.00 H new ATOM 0 HD2 PHE A 4 9.775 6.123 -9.515 1.00 0.00 H new ATOM 0 HE1 PHE A 4 8.352 9.584 -12.680 1.00 0.00 H new ATOM 0 HE2 PHE A 4 11.450 7.506 -10.622 1.00 0.00 H new ATOM 0 HZ PHE A 4 10.745 9.251 -12.210 1.00 0.00 H new ATOM 69 N LEU A 5 4.434 5.564 -8.486 1.00 0.00 N ATOM 70 CA LEU A 5 3.481 4.712 -7.856 1.00 0.00 C ATOM 71 C LEU A 5 3.363 3.421 -8.627 1.00 0.00 C ATOM 72 O LEU A 5 3.370 3.423 -9.854 1.00 0.00 O ATOM 73 CB LEU A 5 2.143 5.447 -7.791 1.00 0.00 C ATOM 74 CG LEU A 5 0.955 4.693 -7.228 1.00 0.00 C ATOM 75 CD1 LEU A 5 1.169 4.328 -5.764 1.00 0.00 C ATOM 76 CD2 LEU A 5 -0.291 5.523 -7.398 1.00 0.00 C ATOM 0 H LEU A 5 4.174 5.881 -9.420 1.00 0.00 H new ATOM 0 HA LEU A 5 3.798 4.464 -6.843 1.00 0.00 H new ATOM 0 HB2 LEU A 5 2.283 6.348 -7.193 1.00 0.00 H new ATOM 0 HB3 LEU A 5 1.888 5.771 -8.800 1.00 0.00 H new ATOM 0 HG LEU A 5 0.843 3.759 -7.778 1.00 0.00 H new ATOM 0 HD11 LEU A 5 0.298 3.788 -5.392 1.00 0.00 H new ATOM 0 HD12 LEU A 5 2.053 3.697 -5.672 1.00 0.00 H new ATOM 0 HD13 LEU A 5 1.309 5.237 -5.179 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -1.147 4.982 -6.994 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -0.174 6.467 -6.866 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -0.455 5.721 -8.457 1.00 0.00 H new ATOM 88 N ASP A 6 3.276 2.335 -7.911 1.00 0.00 N ATOM 89 CA ASP A 6 3.140 1.017 -8.530 1.00 0.00 C ATOM 90 C ASP A 6 2.209 0.168 -7.742 1.00 0.00 C ATOM 91 O ASP A 6 2.088 0.324 -6.527 1.00 0.00 O ATOM 92 CB ASP A 6 4.475 0.267 -8.660 1.00 0.00 C ATOM 93 CG ASP A 6 5.372 0.734 -9.790 1.00 0.00 C ATOM 94 OD1 ASP A 6 5.918 1.851 -9.725 1.00 0.00 O ATOM 95 OD2 ASP A 6 5.603 -0.053 -10.741 1.00 0.00 O ATOM 0 H ASP A 6 3.296 2.322 -6.891 1.00 0.00 H new ATOM 0 HA ASP A 6 2.753 1.199 -9.533 1.00 0.00 H new ATOM 0 HB2 ASP A 6 5.020 0.364 -7.721 1.00 0.00 H new ATOM 0 HB3 ASP A 6 4.265 -0.794 -8.799 1.00 0.00 H new ATOM 100 N PHE A 7 1.547 -0.717 -8.414 1.00 0.00 N ATOM 101 CA PHE A 7 0.654 -1.656 -7.784 1.00 0.00 C ATOM 102 C PHE A 7 0.914 -3.042 -8.278 1.00 0.00 C ATOM 103 O PHE A 7 1.266 -3.238 -9.443 1.00 0.00 O ATOM 104 CB PHE A 7 -0.821 -1.309 -8.028 1.00 0.00 C ATOM 105 CG PHE A 7 -1.398 -0.254 -7.127 1.00 0.00 C ATOM 106 CD1 PHE A 7 -1.180 1.085 -7.362 1.00 0.00 C ATOM 107 CD2 PHE A 7 -2.186 -0.617 -6.049 1.00 0.00 C ATOM 108 CE1 PHE A 7 -1.728 2.044 -6.541 1.00 0.00 C ATOM 109 CE2 PHE A 7 -2.743 0.340 -5.226 1.00 0.00 C ATOM 110 CZ PHE A 7 -2.514 1.672 -5.472 1.00 0.00 C ATOM 0 H PHE A 7 1.606 -0.816 -9.427 1.00 0.00 H new ATOM 0 HA PHE A 7 0.847 -1.598 -6.713 1.00 0.00 H new ATOM 0 HB2 PHE A 7 -0.932 -0.979 -9.061 1.00 0.00 H new ATOM 0 HB3 PHE A 7 -1.412 -2.218 -7.918 1.00 0.00 H new ATOM 0 HD1 PHE A 7 -0.571 1.387 -8.201 1.00 0.00 H new ATOM 0 HD2 PHE A 7 -2.367 -1.663 -5.849 1.00 0.00 H new ATOM 0 HE1 PHE A 7 -1.542 3.090 -6.735 1.00 0.00 H new ATOM 0 HE2 PHE A 7 -3.358 0.042 -4.390 1.00 0.00 H new ATOM 0 HZ PHE A 7 -2.948 2.424 -4.830 1.00 0.00 H new ATOM 120 N ASP A 8 0.815 -3.970 -7.371 1.00 0.00 N ATOM 121 CA ASP A 8 0.853 -5.391 -7.653 1.00 0.00 C ATOM 122 C ASP A 8 -0.373 -5.796 -8.467 1.00 0.00 C ATOM 123 O ASP A 8 -1.441 -5.186 -8.326 1.00 0.00 O ATOM 124 CB ASP A 8 0.900 -6.155 -6.308 1.00 0.00 C ATOM 125 CG ASP A 8 0.356 -7.565 -6.368 1.00 0.00 C ATOM 126 OD1 ASP A 8 1.050 -8.475 -6.846 1.00 0.00 O ATOM 127 OD2 ASP A 8 -0.801 -7.773 -5.931 1.00 0.00 O ATOM 0 H ASP A 8 0.702 -3.760 -6.379 1.00 0.00 H new ATOM 0 HA ASP A 8 1.738 -5.636 -8.240 1.00 0.00 H new ATOM 0 HB2 ASP A 8 1.933 -6.192 -5.962 1.00 0.00 H new ATOM 0 HB3 ASP A 8 0.335 -5.592 -5.565 1.00 0.00 H new ATOM 132 N GLU A 9 -0.202 -6.790 -9.325 1.00 0.00 N ATOM 133 CA GLU A 9 -1.267 -7.341 -10.169 1.00 0.00 C ATOM 134 C GLU A 9 -2.575 -7.633 -9.415 1.00 0.00 C ATOM 135 O GLU A 9 -3.666 -7.388 -9.946 1.00 0.00 O ATOM 136 CB GLU A 9 -0.781 -8.611 -10.840 1.00 0.00 C ATOM 137 CG GLU A 9 -0.035 -8.394 -12.140 1.00 0.00 C ATOM 138 CD GLU A 9 -0.966 -7.984 -13.256 1.00 0.00 C ATOM 139 OE1 GLU A 9 -1.782 -8.838 -13.692 1.00 0.00 O ATOM 140 OE2 GLU A 9 -0.905 -6.840 -13.731 1.00 0.00 O ATOM 0 H GLU A 9 0.698 -7.250 -9.462 1.00 0.00 H new ATOM 0 HA GLU A 9 -1.499 -6.571 -10.905 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -0.130 -9.145 -10.148 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -1.639 -9.255 -11.032 1.00 0.00 H new ATOM 0 HG2 GLU A 9 0.725 -7.626 -11.999 1.00 0.00 H new ATOM 0 HG3 GLU A 9 0.485 -9.310 -12.418 1.00 0.00 H new ATOM 147 N ARG A 10 -2.478 -8.121 -8.188 1.00 0.00 N ATOM 148 CA ARG A 10 -3.675 -8.459 -7.434 1.00 0.00 C ATOM 149 C ARG A 10 -4.224 -7.183 -6.825 1.00 0.00 C ATOM 150 O ARG A 10 -5.424 -6.933 -6.863 1.00 0.00 O ATOM 151 CB ARG A 10 -3.427 -9.494 -6.301 1.00 0.00 C ATOM 152 CG ARG A 10 -2.774 -10.828 -6.689 1.00 0.00 C ATOM 153 CD ARG A 10 -1.292 -10.671 -6.985 1.00 0.00 C ATOM 154 NE ARG A 10 -0.617 -11.940 -7.229 1.00 0.00 N ATOM 155 CZ ARG A 10 0.693 -12.061 -7.483 1.00 0.00 C ATOM 156 NH1 ARG A 10 1.490 -11.000 -7.465 1.00 0.00 N ATOM 157 NH2 ARG A 10 1.212 -13.255 -7.716 1.00 0.00 N ATOM 0 H ARG A 10 -1.599 -8.290 -7.700 1.00 0.00 H new ATOM 0 HA ARG A 10 -4.378 -8.921 -8.127 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -2.801 -9.021 -5.544 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -4.385 -9.713 -5.830 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -2.908 -11.546 -5.880 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -3.277 -11.237 -7.565 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -1.168 -10.028 -7.856 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -0.812 -10.167 -6.146 1.00 0.00 H new ATOM 0 HE ARG A 10 -1.179 -12.791 -7.205 1.00 0.00 H new ATOM 0 HH11 ARG A 10 1.107 -10.078 -7.256 1.00 0.00 H new ATOM 0 HH12 ARG A 10 2.485 -11.107 -7.660 1.00 0.00 H new ATOM 0 HH21 ARG A 10 0.615 -14.082 -7.702 1.00 0.00 H new ATOM 0 HH22 ARG A 10 2.209 -13.349 -7.910 1.00 0.00 H new ATOM 171 N ALA A 11 -3.309 -6.354 -6.310 1.00 0.00 N ATOM 172 CA ALA A 11 -3.639 -5.069 -5.673 1.00 0.00 C ATOM 173 C ALA A 11 -4.450 -4.152 -6.606 1.00 0.00 C ATOM 174 O ALA A 11 -5.259 -3.341 -6.145 1.00 0.00 O ATOM 175 CB ALA A 11 -2.372 -4.368 -5.201 1.00 0.00 C ATOM 0 H ALA A 11 -2.309 -6.556 -6.323 1.00 0.00 H new ATOM 0 HA ALA A 11 -4.267 -5.286 -4.809 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -2.634 -3.419 -4.732 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -1.855 -4.999 -4.478 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -1.719 -4.183 -6.054 1.00 0.00 H new ATOM 181 N LEU A 12 -4.220 -4.295 -7.912 1.00 0.00 N ATOM 182 CA LEU A 12 -4.978 -3.575 -8.944 1.00 0.00 C ATOM 183 C LEU A 12 -6.460 -3.860 -8.786 1.00 0.00 C ATOM 184 O LEU A 12 -7.296 -2.953 -8.673 1.00 0.00 O ATOM 185 CB LEU A 12 -4.546 -4.033 -10.348 1.00 0.00 C ATOM 186 CG LEU A 12 -3.081 -3.847 -10.763 1.00 0.00 C ATOM 187 CD1 LEU A 12 -2.843 -4.510 -12.107 1.00 0.00 C ATOM 188 CD2 LEU A 12 -2.721 -2.381 -10.859 1.00 0.00 C ATOM 0 H LEU A 12 -3.502 -4.914 -8.288 1.00 0.00 H new ATOM 0 HA LEU A 12 -4.781 -2.509 -8.828 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -4.783 -5.093 -10.438 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -5.165 -3.505 -11.073 1.00 0.00 H new ATOM 0 HG LEU A 12 -2.452 -4.308 -10.001 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -1.801 -4.376 -12.399 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -3.065 -5.575 -12.032 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -3.491 -4.056 -12.857 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -1.677 -2.281 -11.155 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -3.356 -1.898 -11.602 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -2.870 -1.905 -9.890 1.00 0.00 H new ATOM 200 N LYS A 13 -6.762 -5.124 -8.696 1.00 0.00 N ATOM 201 CA LYS A 13 -8.126 -5.591 -8.668 1.00 0.00 C ATOM 202 C LYS A 13 -8.713 -5.262 -7.315 1.00 0.00 C ATOM 203 O LYS A 13 -9.896 -4.994 -7.184 1.00 0.00 O ATOM 204 CB LYS A 13 -8.157 -7.114 -8.909 1.00 0.00 C ATOM 205 CG LYS A 13 -7.146 -7.605 -9.953 1.00 0.00 C ATOM 206 CD LYS A 13 -7.279 -6.896 -11.293 1.00 0.00 C ATOM 207 CE LYS A 13 -6.091 -7.217 -12.184 1.00 0.00 C ATOM 208 NZ LYS A 13 -6.172 -6.544 -13.495 1.00 0.00 N ATOM 0 H LYS A 13 -6.066 -5.868 -8.639 1.00 0.00 H new ATOM 0 HA LYS A 13 -8.710 -5.106 -9.450 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -7.965 -7.624 -7.965 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -9.159 -7.400 -9.227 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -6.136 -7.458 -9.570 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -7.277 -8.677 -10.101 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -8.203 -7.203 -11.784 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -7.344 -5.819 -11.137 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -5.172 -6.917 -11.681 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -6.035 -8.295 -12.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -5.339 -6.794 -14.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -7.035 -6.849 -13.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -6.199 -5.514 -13.355 1.00 0.00 H new ATOM 222 N GLU A 14 -7.840 -5.223 -6.329 1.00 0.00 N ATOM 223 CA GLU A 14 -8.186 -4.950 -4.964 1.00 0.00 C ATOM 224 C GLU A 14 -8.795 -3.573 -4.743 1.00 0.00 C ATOM 225 O GLU A 14 -9.816 -3.468 -4.072 1.00 0.00 O ATOM 226 CB GLU A 14 -7.013 -5.194 -4.046 1.00 0.00 C ATOM 227 CG GLU A 14 -6.634 -6.674 -3.926 1.00 0.00 C ATOM 228 CD GLU A 14 -7.792 -7.552 -3.465 1.00 0.00 C ATOM 229 OE1 GLU A 14 -8.661 -7.907 -4.284 1.00 0.00 O ATOM 230 OE2 GLU A 14 -7.849 -7.920 -2.274 1.00 0.00 O ATOM 0 H GLU A 14 -6.843 -5.386 -6.468 1.00 0.00 H new ATOM 0 HA GLU A 14 -8.976 -5.657 -4.711 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -6.152 -4.634 -4.411 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -7.249 -4.805 -3.055 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -6.277 -7.031 -4.892 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -5.807 -6.775 -3.223 1.00 0.00 H new ATOM 237 N TRP A 15 -8.226 -2.509 -5.319 1.00 0.00 N ATOM 238 CA TRP A 15 -8.839 -1.196 -5.087 1.00 0.00 C ATOM 239 C TRP A 15 -10.169 -1.125 -5.823 1.00 0.00 C ATOM 240 O TRP A 15 -11.111 -0.451 -5.400 1.00 0.00 O ATOM 241 CB TRP A 15 -7.924 0.033 -5.437 1.00 0.00 C ATOM 242 CG TRP A 15 -7.804 0.424 -6.904 1.00 0.00 C ATOM 243 CD1 TRP A 15 -8.752 1.056 -7.672 1.00 0.00 C ATOM 244 CD2 TRP A 15 -6.660 0.289 -7.743 1.00 0.00 C ATOM 245 NE1 TRP A 15 -8.279 1.257 -8.936 1.00 0.00 N ATOM 246 CE2 TRP A 15 -7.001 0.810 -9.007 1.00 0.00 C ATOM 247 CE3 TRP A 15 -5.394 -0.234 -7.562 1.00 0.00 C ATOM 248 CZ2 TRP A 15 -6.116 0.820 -10.071 1.00 0.00 C ATOM 249 CZ3 TRP A 15 -4.515 -0.215 -8.619 1.00 0.00 C ATOM 250 CH2 TRP A 15 -4.880 0.304 -9.859 1.00 0.00 C ATOM 0 H TRP A 15 -7.396 -2.521 -5.912 1.00 0.00 H new ATOM 0 HA TRP A 15 -8.996 -1.114 -4.011 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -8.297 0.897 -4.888 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -6.922 -0.175 -5.061 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -9.731 1.351 -7.325 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -8.803 1.676 -9.704 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -5.101 -0.649 -6.609 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -6.399 1.223 -11.032 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -3.519 -0.611 -8.485 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -4.164 0.295 -10.668 1.00 0.00 H new ATOM 261 N ARG A 16 -10.255 -1.884 -6.893 1.00 0.00 N ATOM 262 CA ARG A 16 -11.431 -1.876 -7.733 1.00 0.00 C ATOM 263 C ARG A 16 -12.596 -2.670 -7.115 1.00 0.00 C ATOM 264 O ARG A 16 -13.766 -2.439 -7.454 1.00 0.00 O ATOM 265 CB ARG A 16 -11.069 -2.380 -9.120 1.00 0.00 C ATOM 266 CG ARG A 16 -9.879 -1.636 -9.690 1.00 0.00 C ATOM 267 CD ARG A 16 -9.548 -2.008 -11.114 1.00 0.00 C ATOM 268 NE ARG A 16 -10.620 -1.638 -12.044 1.00 0.00 N ATOM 269 CZ ARG A 16 -10.488 -0.741 -13.038 1.00 0.00 C ATOM 270 NH1 ARG A 16 -9.301 -0.197 -13.302 1.00 0.00 N ATOM 271 NH2 ARG A 16 -11.533 -0.411 -13.783 1.00 0.00 N ATOM 0 H ARG A 16 -9.519 -2.518 -7.203 1.00 0.00 H new ATOM 0 HA ARG A 16 -11.786 -0.849 -7.817 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -10.844 -3.446 -9.074 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -11.925 -2.263 -9.785 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -10.076 -0.565 -9.641 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -9.008 -1.829 -9.063 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -8.623 -1.513 -11.412 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -9.370 -3.082 -11.176 1.00 0.00 H new ATOM 0 HE ARG A 16 -11.527 -2.091 -11.929 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -8.485 -0.460 -12.749 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -9.208 0.482 -14.057 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -12.442 -0.838 -13.604 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -11.428 0.270 -14.536 1.00 0.00 H new ATOM 285 N LYS A 17 -12.288 -3.569 -6.194 1.00 0.00 N ATOM 286 CA LYS A 17 -13.307 -4.399 -5.548 1.00 0.00 C ATOM 287 C LYS A 17 -13.743 -3.846 -4.192 1.00 0.00 C ATOM 288 O LYS A 17 -14.682 -4.367 -3.584 1.00 0.00 O ATOM 289 CB LYS A 17 -12.834 -5.889 -5.438 1.00 0.00 C ATOM 290 CG LYS A 17 -11.480 -6.098 -4.736 1.00 0.00 C ATOM 291 CD LYS A 17 -11.540 -5.987 -3.204 1.00 0.00 C ATOM 292 CE LYS A 17 -11.915 -7.303 -2.556 1.00 0.00 C ATOM 293 NZ LYS A 17 -10.817 -8.292 -2.667 1.00 0.00 N ATOM 0 H LYS A 17 -11.337 -3.747 -5.872 1.00 0.00 H new ATOM 0 HA LYS A 17 -14.189 -4.372 -6.188 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -13.595 -6.456 -4.901 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -12.773 -6.309 -6.442 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -11.093 -7.082 -5.003 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -10.770 -5.363 -5.115 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -10.572 -5.659 -2.826 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -12.267 -5.224 -2.924 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -12.153 -7.138 -1.505 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -12.814 -7.700 -3.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -11.218 -9.244 -2.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -10.222 -8.059 -3.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -10.240 -8.268 -1.802 1.00 0.00 H new ATOM 307 N LEU A 18 -13.071 -2.814 -3.715 1.00 0.00 N ATOM 308 CA LEU A 18 -13.381 -2.290 -2.394 1.00 0.00 C ATOM 309 C LEU A 18 -14.308 -1.074 -2.380 1.00 0.00 C ATOM 310 O LEU A 18 -15.033 -0.866 -1.407 1.00 0.00 O ATOM 311 CB LEU A 18 -12.117 -2.111 -1.529 1.00 0.00 C ATOM 312 CG LEU A 18 -10.934 -1.319 -2.103 1.00 0.00 C ATOM 313 CD1 LEU A 18 -11.219 0.162 -2.236 1.00 0.00 C ATOM 314 CD2 LEU A 18 -9.703 -1.547 -1.268 1.00 0.00 C ATOM 0 H LEU A 18 -12.322 -2.329 -4.209 1.00 0.00 H new ATOM 0 HA LEU A 18 -13.981 -3.065 -1.918 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -12.419 -1.627 -0.600 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -11.753 -3.104 -1.267 1.00 0.00 H new ATOM 0 HG LEU A 18 -10.765 -1.692 -3.113 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -10.344 0.665 -2.647 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -12.069 0.311 -2.902 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -11.449 0.578 -1.255 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -8.870 -0.980 -1.685 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -9.891 -1.218 -0.246 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -9.455 -2.608 -1.268 1.00 0.00 H new ATOM 326 N GLY A 19 -14.278 -0.267 -3.415 1.00 0.00 N ATOM 327 CA GLY A 19 -15.192 0.847 -3.452 1.00 0.00 C ATOM 328 C GLY A 19 -14.575 2.129 -3.959 1.00 0.00 C ATOM 329 O GLY A 19 -13.408 2.424 -3.685 1.00 0.00 O ATOM 0 H GLY A 19 -13.653 -0.355 -4.216 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -16.040 0.588 -4.086 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -15.584 1.016 -2.449 1.00 0.00 H new ATOM 333 N SER A 20 -15.374 2.902 -4.651 1.00 0.00 N ATOM 334 CA SER A 20 -14.957 4.138 -5.256 1.00 0.00 C ATOM 335 C SER A 20 -14.574 5.219 -4.217 1.00 0.00 C ATOM 336 O SER A 20 -13.558 5.895 -4.370 1.00 0.00 O ATOM 337 CB SER A 20 -16.062 4.629 -6.185 1.00 0.00 C ATOM 338 OG SER A 20 -16.370 3.635 -7.152 1.00 0.00 O ATOM 0 H SER A 20 -16.357 2.682 -4.812 1.00 0.00 H new ATOM 0 HA SER A 20 -14.049 3.947 -5.828 1.00 0.00 H new ATOM 0 HB2 SER A 20 -16.953 4.871 -5.606 1.00 0.00 H new ATOM 0 HB3 SER A 20 -15.747 5.546 -6.683 1.00 0.00 H new ATOM 0 HG SER A 20 -17.082 3.961 -7.741 1.00 0.00 H new ATOM 344 N THR A 21 -15.345 5.365 -3.163 1.00 0.00 N ATOM 345 CA THR A 21 -15.035 6.381 -2.169 1.00 0.00 C ATOM 346 C THR A 21 -13.875 5.908 -1.280 1.00 0.00 C ATOM 347 O THR A 21 -13.065 6.710 -0.792 1.00 0.00 O ATOM 348 CB THR A 21 -16.263 6.701 -1.311 1.00 0.00 C ATOM 349 OG1 THR A 21 -17.392 6.902 -2.177 1.00 0.00 O ATOM 350 CG2 THR A 21 -16.036 7.973 -0.510 1.00 0.00 C ATOM 0 H THR A 21 -16.177 4.808 -2.969 1.00 0.00 H new ATOM 0 HA THR A 21 -14.739 7.292 -2.689 1.00 0.00 H new ATOM 0 HB THR A 21 -16.441 5.873 -0.625 1.00 0.00 H new ATOM 0 HG1 THR A 21 -18.185 7.106 -1.639 1.00 0.00 H new ATOM 0 HG21 THR A 21 -16.918 8.185 0.094 1.00 0.00 H new ATOM 0 HG22 THR A 21 -15.173 7.843 0.143 1.00 0.00 H new ATOM 0 HG23 THR A 21 -15.854 8.804 -1.191 1.00 0.00 H new ATOM 358 N VAL A 22 -13.784 4.608 -1.112 1.00 0.00 N ATOM 359 CA VAL A 22 -12.735 4.015 -0.326 1.00 0.00 C ATOM 360 C VAL A 22 -11.393 4.166 -1.044 1.00 0.00 C ATOM 361 O VAL A 22 -10.397 4.551 -0.431 1.00 0.00 O ATOM 362 CB VAL A 22 -13.017 2.519 -0.020 1.00 0.00 C ATOM 363 CG1 VAL A 22 -11.905 1.930 0.821 1.00 0.00 C ATOM 364 CG2 VAL A 22 -14.352 2.355 0.697 1.00 0.00 C ATOM 0 H VAL A 22 -14.436 3.936 -1.517 1.00 0.00 H new ATOM 0 HA VAL A 22 -12.696 4.542 0.627 1.00 0.00 H new ATOM 0 HB VAL A 22 -13.063 1.985 -0.969 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -12.120 0.881 1.025 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -10.961 2.009 0.282 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -11.832 2.476 1.762 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -14.528 1.299 0.901 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -14.331 2.907 1.636 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -15.153 2.741 0.067 1.00 0.00 H new ATOM 374 N ARG A 23 -11.382 3.917 -2.361 1.00 0.00 N ATOM 375 CA ARG A 23 -10.147 4.011 -3.135 1.00 0.00 C ATOM 376 C ARG A 23 -9.614 5.447 -3.140 1.00 0.00 C ATOM 377 O ARG A 23 -8.415 5.654 -3.137 1.00 0.00 O ATOM 378 CB ARG A 23 -10.309 3.497 -4.583 1.00 0.00 C ATOM 379 CG ARG A 23 -11.102 4.414 -5.485 1.00 0.00 C ATOM 380 CD ARG A 23 -11.174 3.910 -6.905 1.00 0.00 C ATOM 381 NE ARG A 23 -11.686 4.955 -7.789 1.00 0.00 N ATOM 382 CZ ARG A 23 -11.437 5.045 -9.094 1.00 0.00 C ATOM 383 NH1 ARG A 23 -10.943 4.005 -9.751 1.00 0.00 N ATOM 384 NH2 ARG A 23 -11.755 6.150 -9.751 1.00 0.00 N ATOM 0 H ARG A 23 -12.205 3.653 -2.902 1.00 0.00 H new ATOM 0 HA ARG A 23 -9.423 3.362 -2.642 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -9.320 3.348 -5.016 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -10.796 2.522 -4.557 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -12.112 4.522 -5.090 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -10.649 5.406 -5.478 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -10.184 3.596 -7.237 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -11.820 3.033 -6.955 1.00 0.00 H new ATOM 0 HE ARG A 23 -12.281 5.672 -7.374 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -10.753 3.133 -9.257 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -10.753 4.077 -10.751 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -12.190 6.930 -9.257 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -11.565 6.221 -10.751 1.00 0.00 H new ATOM 398 N GLU A 24 -10.521 6.429 -3.116 1.00 0.00 N ATOM 399 CA GLU A 24 -10.136 7.836 -3.094 1.00 0.00 C ATOM 400 C GLU A 24 -9.402 8.174 -1.812 1.00 0.00 C ATOM 401 O GLU A 24 -8.384 8.863 -1.842 1.00 0.00 O ATOM 402 CB GLU A 24 -11.347 8.741 -3.261 1.00 0.00 C ATOM 403 CG GLU A 24 -11.983 8.688 -4.634 1.00 0.00 C ATOM 404 CD GLU A 24 -11.073 9.204 -5.726 1.00 0.00 C ATOM 405 OE1 GLU A 24 -10.782 10.403 -5.755 1.00 0.00 O ATOM 406 OE2 GLU A 24 -10.668 8.420 -6.609 1.00 0.00 O ATOM 0 H GLU A 24 -11.529 6.270 -3.111 1.00 0.00 H new ATOM 0 HA GLU A 24 -9.464 8.007 -3.935 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -12.095 8.468 -2.517 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -11.049 9.768 -3.051 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -12.264 7.659 -4.859 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -12.901 9.275 -4.626 1.00 0.00 H new ATOM 413 N GLN A 25 -9.891 7.636 -0.695 1.00 0.00 N ATOM 414 CA GLN A 25 -9.268 7.857 0.609 1.00 0.00 C ATOM 415 C GLN A 25 -7.838 7.334 0.614 1.00 0.00 C ATOM 416 O GLN A 25 -6.928 7.949 1.185 1.00 0.00 O ATOM 417 CB GLN A 25 -10.070 7.184 1.726 1.00 0.00 C ATOM 418 CG GLN A 25 -11.448 7.769 1.955 1.00 0.00 C ATOM 419 CD GLN A 25 -12.167 7.117 3.114 1.00 0.00 C ATOM 420 OE1 GLN A 25 -12.026 7.532 4.270 1.00 0.00 O ATOM 421 NE2 GLN A 25 -12.971 6.134 2.823 1.00 0.00 N ATOM 0 H GLN A 25 -10.720 7.042 -0.668 1.00 0.00 H new ATOM 0 HA GLN A 25 -9.256 8.931 0.792 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -10.174 6.124 1.493 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -9.502 7.252 2.654 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -11.359 8.839 2.142 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -12.044 7.653 1.050 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -13.062 5.818 1.857 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -13.510 5.680 3.561 1.00 0.00 H new ATOM 430 N LEU A 26 -7.648 6.215 -0.051 1.00 0.00 N ATOM 431 CA LEU A 26 -6.348 5.589 -0.177 1.00 0.00 C ATOM 432 C LEU A 26 -5.428 6.456 -1.030 1.00 0.00 C ATOM 433 O LEU A 26 -4.289 6.691 -0.677 1.00 0.00 O ATOM 434 CB LEU A 26 -6.501 4.205 -0.803 1.00 0.00 C ATOM 435 CG LEU A 26 -7.390 3.223 -0.036 1.00 0.00 C ATOM 436 CD1 LEU A 26 -7.589 1.958 -0.838 1.00 0.00 C ATOM 437 CD2 LEU A 26 -6.786 2.894 1.320 1.00 0.00 C ATOM 0 H LEU A 26 -8.397 5.709 -0.524 1.00 0.00 H new ATOM 0 HA LEU A 26 -5.905 5.483 0.813 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -6.906 4.324 -1.808 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -5.510 3.763 -0.909 1.00 0.00 H new ATOM 0 HG LEU A 26 -8.359 3.695 0.124 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -8.223 1.269 -0.280 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -8.065 2.201 -1.788 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -6.622 1.490 -1.026 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -7.435 2.195 1.847 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -5.803 2.443 1.181 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -6.686 3.808 1.905 1.00 0.00 H new ATOM 449 N LYS A 27 -5.976 6.975 -2.119 1.00 0.00 N ATOM 450 CA LYS A 27 -5.249 7.827 -3.064 1.00 0.00 C ATOM 451 C LYS A 27 -4.762 9.118 -2.410 1.00 0.00 C ATOM 452 O LYS A 27 -3.719 9.667 -2.792 1.00 0.00 O ATOM 453 CB LYS A 27 -6.138 8.145 -4.266 1.00 0.00 C ATOM 454 CG LYS A 27 -6.390 6.961 -5.193 1.00 0.00 C ATOM 455 CD LYS A 27 -7.512 7.245 -6.194 1.00 0.00 C ATOM 456 CE LYS A 27 -7.281 8.522 -6.992 1.00 0.00 C ATOM 457 NZ LYS A 27 -8.379 8.775 -7.939 1.00 0.00 N ATOM 0 H LYS A 27 -6.950 6.818 -2.379 1.00 0.00 H new ATOM 0 HA LYS A 27 -4.368 7.279 -3.397 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -7.096 8.519 -3.905 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -5.678 8.949 -4.840 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -5.474 6.722 -5.733 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -6.647 6.084 -4.599 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -7.601 6.404 -6.881 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -8.459 7.322 -5.660 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -7.187 9.366 -6.309 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -6.340 8.446 -7.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -8.149 9.604 -8.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -8.508 7.944 -8.551 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -9.257 8.956 -7.412 1.00 0.00 H new ATOM 471 N LYS A 28 -5.503 9.593 -1.428 1.00 0.00 N ATOM 472 CA LYS A 28 -5.126 10.796 -0.709 1.00 0.00 C ATOM 473 C LYS A 28 -3.900 10.536 0.146 1.00 0.00 C ATOM 474 O LYS A 28 -2.976 11.342 0.213 1.00 0.00 O ATOM 475 CB LYS A 28 -6.269 11.293 0.177 1.00 0.00 C ATOM 476 CG LYS A 28 -7.578 11.589 -0.554 1.00 0.00 C ATOM 477 CD LYS A 28 -7.400 12.554 -1.723 1.00 0.00 C ATOM 478 CE LYS A 28 -6.765 13.869 -1.294 1.00 0.00 C ATOM 479 NZ LYS A 28 -7.537 14.556 -0.238 1.00 0.00 N ATOM 0 H LYS A 28 -6.371 9.164 -1.109 1.00 0.00 H new ATOM 0 HA LYS A 28 -4.899 11.566 -1.447 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -6.462 10.546 0.946 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -5.944 12.199 0.688 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -8.002 10.655 -0.922 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -8.295 12.009 0.151 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -6.779 12.085 -2.487 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -8.370 12.753 -2.178 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -5.754 13.679 -0.934 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -6.677 14.525 -2.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -7.129 15.497 -0.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -8.527 14.657 -0.542 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -7.499 13.998 0.639 1.00 0.00 H new ATOM 493 N LYS A 29 -3.872 9.396 0.768 1.00 0.00 N ATOM 494 CA LYS A 29 -2.770 9.051 1.617 1.00 0.00 C ATOM 495 C LYS A 29 -1.570 8.636 0.789 1.00 0.00 C ATOM 496 O LYS A 29 -0.442 8.711 1.230 1.00 0.00 O ATOM 497 CB LYS A 29 -3.216 7.984 2.576 1.00 0.00 C ATOM 498 CG LYS A 29 -4.417 8.462 3.345 1.00 0.00 C ATOM 499 CD LYS A 29 -4.965 7.439 4.272 1.00 0.00 C ATOM 500 CE LYS A 29 -6.207 7.978 4.952 1.00 0.00 C ATOM 501 NZ LYS A 29 -5.949 9.244 5.671 1.00 0.00 N ATOM 0 H LYS A 29 -4.602 8.686 0.704 1.00 0.00 H new ATOM 0 HA LYS A 29 -2.451 9.916 2.199 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -3.460 7.072 2.032 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -2.407 7.738 3.263 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -4.145 9.351 3.915 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -5.195 8.760 2.642 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -5.206 6.529 3.723 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -4.217 7.173 5.018 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -6.986 8.138 4.207 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -6.586 7.235 5.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -6.712 9.416 6.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -5.041 9.179 6.173 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -5.912 10.029 4.990 1.00 0.00 H new ATOM 515 N LEU A 30 -1.825 8.239 -0.422 1.00 0.00 N ATOM 516 CA LEU A 30 -0.765 7.903 -1.330 1.00 0.00 C ATOM 517 C LEU A 30 -0.024 9.146 -1.798 1.00 0.00 C ATOM 518 O LEU A 30 1.187 9.129 -1.866 1.00 0.00 O ATOM 519 CB LEU A 30 -1.255 7.066 -2.513 1.00 0.00 C ATOM 520 CG LEU A 30 -1.738 5.646 -2.186 1.00 0.00 C ATOM 521 CD1 LEU A 30 -2.236 4.947 -3.439 1.00 0.00 C ATOM 522 CD2 LEU A 30 -0.625 4.832 -1.535 1.00 0.00 C ATOM 0 H LEU A 30 -2.764 8.139 -0.808 1.00 0.00 H new ATOM 0 HA LEU A 30 -0.061 7.282 -0.777 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -2.071 7.602 -2.997 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -0.446 6.994 -3.240 1.00 0.00 H new ATOM 0 HG LEU A 30 -2.565 5.726 -1.481 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -2.574 3.942 -3.185 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -3.065 5.512 -3.865 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -1.427 4.885 -4.167 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -0.990 3.829 -1.312 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.224 4.766 -2.216 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -0.312 5.318 -0.611 1.00 0.00 H new ATOM 534 N VAL A 31 -0.746 10.248 -2.055 1.00 0.00 N ATOM 535 CA VAL A 31 -0.087 11.477 -2.535 1.00 0.00 C ATOM 536 C VAL A 31 0.872 12.043 -1.483 1.00 0.00 C ATOM 537 O VAL A 31 1.930 12.596 -1.818 1.00 0.00 O ATOM 538 CB VAL A 31 -1.086 12.585 -3.071 1.00 0.00 C ATOM 539 CG1 VAL A 31 -2.019 13.106 -2.001 1.00 0.00 C ATOM 540 CG2 VAL A 31 -0.336 13.743 -3.715 1.00 0.00 C ATOM 0 H VAL A 31 -1.758 10.317 -1.943 1.00 0.00 H new ATOM 0 HA VAL A 31 0.495 11.174 -3.405 1.00 0.00 H new ATOM 0 HB VAL A 31 -1.699 12.093 -3.826 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -2.678 13.861 -2.429 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -2.617 12.284 -1.608 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -1.436 13.549 -1.194 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -1.050 14.485 -4.072 1.00 0.00 H new ATOM 0 HG22 VAL A 31 0.327 14.201 -2.980 1.00 0.00 H new ATOM 0 HG23 VAL A 31 0.253 13.373 -4.554 1.00 0.00 H new ATOM 550 N GLU A 32 0.538 11.864 -0.218 1.00 0.00 N ATOM 551 CA GLU A 32 1.414 12.333 0.834 1.00 0.00 C ATOM 552 C GLU A 32 2.661 11.436 1.004 1.00 0.00 C ATOM 553 O GLU A 32 3.775 11.948 1.204 1.00 0.00 O ATOM 554 CB GLU A 32 0.666 12.571 2.157 1.00 0.00 C ATOM 555 CG GLU A 32 -0.090 11.376 2.691 1.00 0.00 C ATOM 556 CD GLU A 32 -0.814 11.675 3.975 1.00 0.00 C ATOM 557 OE1 GLU A 32 -0.211 11.527 5.061 1.00 0.00 O ATOM 558 OE2 GLU A 32 -1.993 12.079 3.934 1.00 0.00 O ATOM 0 H GLU A 32 -0.316 11.406 0.100 1.00 0.00 H new ATOM 0 HA GLU A 32 1.784 13.308 0.518 1.00 0.00 H new ATOM 0 HB2 GLU A 32 1.385 12.892 2.910 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -0.037 13.392 2.016 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -0.809 11.042 1.943 1.00 0.00 H new ATOM 0 HG3 GLU A 32 0.607 10.554 2.854 1.00 0.00 H new ATOM 565 N VAL A 33 2.507 10.112 0.853 1.00 0.00 N ATOM 566 CA VAL A 33 3.657 9.206 1.036 1.00 0.00 C ATOM 567 C VAL A 33 4.537 9.214 -0.174 1.00 0.00 C ATOM 568 O VAL A 33 5.684 8.838 -0.119 1.00 0.00 O ATOM 569 CB VAL A 33 3.269 7.743 1.380 1.00 0.00 C ATOM 570 CG1 VAL A 33 2.218 7.740 2.402 1.00 0.00 C ATOM 571 CG2 VAL A 33 2.857 6.911 0.176 1.00 0.00 C ATOM 0 H VAL A 33 1.628 9.653 0.612 1.00 0.00 H new ATOM 0 HA VAL A 33 4.193 9.599 1.900 1.00 0.00 H new ATOM 0 HB VAL A 33 4.169 7.264 1.766 1.00 0.00 H new ATOM 0 HG11 VAL A 33 1.947 6.712 2.642 1.00 0.00 H new ATOM 0 HG12 VAL A 33 2.583 8.238 3.300 1.00 0.00 H new ATOM 0 HG13 VAL A 33 1.342 8.267 2.025 1.00 0.00 H new ATOM 0 HG21 VAL A 33 2.602 5.902 0.501 1.00 0.00 H new ATOM 0 HG22 VAL A 33 1.991 7.368 -0.303 1.00 0.00 H new ATOM 0 HG23 VAL A 33 3.683 6.865 -0.534 1.00 0.00 H new ATOM 581 N LEU A 34 4.003 9.671 -1.265 1.00 0.00 N ATOM 582 CA LEU A 34 4.782 9.743 -2.484 1.00 0.00 C ATOM 583 C LEU A 34 5.921 10.759 -2.390 1.00 0.00 C ATOM 584 O LEU A 34 6.762 10.833 -3.288 1.00 0.00 O ATOM 585 CB LEU A 34 3.944 9.971 -3.756 1.00 0.00 C ATOM 586 CG LEU A 34 3.062 8.809 -4.235 1.00 0.00 C ATOM 587 CD1 LEU A 34 2.291 9.212 -5.466 1.00 0.00 C ATOM 588 CD2 LEU A 34 3.898 7.594 -4.556 1.00 0.00 C ATOM 0 H LEU A 34 3.041 9.999 -1.347 1.00 0.00 H new ATOM 0 HA LEU A 34 5.221 8.750 -2.584 1.00 0.00 H new ATOM 0 HB2 LEU A 34 3.301 10.835 -3.586 1.00 0.00 H new ATOM 0 HB3 LEU A 34 4.625 10.234 -4.566 1.00 0.00 H new ATOM 0 HG LEU A 34 2.370 8.563 -3.430 1.00 0.00 H new ATOM 0 HD11 LEU A 34 1.670 8.379 -5.795 1.00 0.00 H new ATOM 0 HD12 LEU A 34 1.657 10.068 -5.234 1.00 0.00 H new ATOM 0 HD13 LEU A 34 2.988 9.481 -6.260 1.00 0.00 H new ATOM 0 HD21 LEU A 34 3.250 6.785 -4.893 1.00 0.00 H new ATOM 0 HD22 LEU A 34 4.610 7.840 -5.343 1.00 0.00 H new ATOM 0 HD23 LEU A 34 4.438 7.278 -3.664 1.00 0.00 H new ATOM 600 N GLU A 35 5.903 11.591 -1.369 1.00 0.00 N ATOM 601 CA GLU A 35 6.992 12.466 -1.104 1.00 0.00 C ATOM 602 C GLU A 35 7.692 12.138 0.216 1.00 0.00 C ATOM 603 O GLU A 35 8.791 12.621 0.473 1.00 0.00 O ATOM 604 CB GLU A 35 6.557 13.908 -1.201 1.00 0.00 C ATOM 605 CG GLU A 35 6.276 14.315 -2.633 1.00 0.00 C ATOM 606 CD GLU A 35 5.980 15.768 -2.819 1.00 0.00 C ATOM 607 OE1 GLU A 35 6.703 16.610 -2.257 1.00 0.00 O ATOM 608 OE2 GLU A 35 5.080 16.099 -3.614 1.00 0.00 O ATOM 0 H GLU A 35 5.129 11.669 -0.710 1.00 0.00 H new ATOM 0 HA GLU A 35 7.745 12.308 -1.876 1.00 0.00 H new ATOM 0 HB2 GLU A 35 5.662 14.059 -0.598 1.00 0.00 H new ATOM 0 HB3 GLU A 35 7.333 14.551 -0.786 1.00 0.00 H new ATOM 0 HG2 GLU A 35 7.137 14.051 -3.248 1.00 0.00 H new ATOM 0 HG3 GLU A 35 5.430 13.735 -3.003 1.00 0.00 H new ATOM 615 N SER A 36 7.065 11.297 1.026 1.00 0.00 N ATOM 616 CA SER A 36 7.614 10.886 2.307 1.00 0.00 C ATOM 617 C SER A 36 6.910 9.584 2.768 1.00 0.00 C ATOM 618 O SER A 36 5.880 9.625 3.444 1.00 0.00 O ATOM 619 CB SER A 36 7.446 12.012 3.352 1.00 0.00 C ATOM 620 OG SER A 36 8.105 11.721 4.584 1.00 0.00 O ATOM 0 H SER A 36 6.159 10.880 0.811 1.00 0.00 H new ATOM 0 HA SER A 36 8.681 10.691 2.203 1.00 0.00 H new ATOM 0 HB2 SER A 36 7.841 12.943 2.944 1.00 0.00 H new ATOM 0 HB3 SER A 36 6.384 12.172 3.541 1.00 0.00 H new ATOM 0 HG SER A 36 7.971 12.463 5.210 1.00 0.00 H new ATOM 626 N PRO A 37 7.392 8.419 2.300 1.00 0.00 N ATOM 627 CA PRO A 37 6.786 7.140 2.620 1.00 0.00 C ATOM 628 C PRO A 37 7.439 6.371 3.769 1.00 0.00 C ATOM 629 O PRO A 37 6.975 5.285 4.122 1.00 0.00 O ATOM 630 CB PRO A 37 6.955 6.383 1.317 1.00 0.00 C ATOM 631 CG PRO A 37 8.260 6.875 0.762 1.00 0.00 C ATOM 632 CD PRO A 37 8.493 8.259 1.334 1.00 0.00 C ATOM 0 HA PRO A 37 5.762 7.269 2.972 1.00 0.00 H new ATOM 0 HB2 PRO A 37 6.976 5.306 1.484 1.00 0.00 H new ATOM 0 HB3 PRO A 37 6.131 6.584 0.632 1.00 0.00 H new ATOM 0 HG2 PRO A 37 9.073 6.203 1.036 1.00 0.00 H new ATOM 0 HG3 PRO A 37 8.227 6.909 -0.327 1.00 0.00 H new ATOM 0 HD2 PRO A 37 9.467 8.335 1.818 1.00 0.00 H new ATOM 0 HD3 PRO A 37 8.462 9.025 0.559 1.00 0.00 H new ATOM 640 N ARG A 38 8.473 6.902 4.364 1.00 0.00 N ATOM 641 CA ARG A 38 9.154 6.179 5.419 1.00 0.00 C ATOM 642 C ARG A 38 8.501 6.495 6.752 1.00 0.00 C ATOM 643 O ARG A 38 8.978 7.337 7.517 1.00 0.00 O ATOM 644 CB ARG A 38 10.652 6.497 5.452 1.00 0.00 C ATOM 645 CG ARG A 38 11.360 6.301 4.122 1.00 0.00 C ATOM 646 CD ARG A 38 12.824 6.664 4.238 1.00 0.00 C ATOM 647 NE ARG A 38 13.521 6.655 2.942 1.00 0.00 N ATOM 648 CZ ARG A 38 14.769 7.103 2.750 1.00 0.00 C ATOM 649 NH1 ARG A 38 15.474 7.586 3.776 1.00 0.00 N ATOM 650 NH2 ARG A 38 15.311 7.060 1.541 1.00 0.00 N ATOM 0 H ARG A 38 8.863 7.819 4.145 1.00 0.00 H new ATOM 0 HA ARG A 38 9.063 5.111 5.219 1.00 0.00 H new ATOM 0 HB2 ARG A 38 10.786 7.530 5.773 1.00 0.00 H new ATOM 0 HB3 ARG A 38 11.130 5.866 6.201 1.00 0.00 H new ATOM 0 HG2 ARG A 38 11.261 5.264 3.801 1.00 0.00 H new ATOM 0 HG3 ARG A 38 10.887 6.917 3.358 1.00 0.00 H new ATOM 0 HD2 ARG A 38 12.913 7.654 4.686 1.00 0.00 H new ATOM 0 HD3 ARG A 38 13.314 5.963 4.913 1.00 0.00 H new ATOM 0 HE ARG A 38 13.020 6.283 2.135 1.00 0.00 H new ATOM 0 HH11 ARG A 38 15.063 7.615 4.709 1.00 0.00 H new ATOM 0 HH12 ARG A 38 16.424 7.926 3.627 1.00 0.00 H new ATOM 0 HH21 ARG A 38 14.778 6.686 0.756 1.00 0.00 H new ATOM 0 HH22 ARG A 38 16.261 7.401 1.396 1.00 0.00 H new ATOM 664 N ILE A 39 7.379 5.873 7.001 1.00 0.00 N ATOM 665 CA ILE A 39 6.639 6.129 8.204 1.00 0.00 C ATOM 666 C ILE A 39 6.882 5.015 9.205 1.00 0.00 C ATOM 667 O ILE A 39 6.213 3.987 9.191 1.00 0.00 O ATOM 668 CB ILE A 39 5.117 6.295 7.935 1.00 0.00 C ATOM 669 CG1 ILE A 39 4.882 7.216 6.703 1.00 0.00 C ATOM 670 CG2 ILE A 39 4.444 6.889 9.179 1.00 0.00 C ATOM 671 CD1 ILE A 39 3.423 7.421 6.345 1.00 0.00 C ATOM 0 H ILE A 39 6.957 5.181 6.381 1.00 0.00 H new ATOM 0 HA ILE A 39 6.995 7.073 8.616 1.00 0.00 H new ATOM 0 HB ILE A 39 4.681 5.319 7.720 1.00 0.00 H new ATOM 0 HG12 ILE A 39 5.336 8.188 6.899 1.00 0.00 H new ATOM 0 HG13 ILE A 39 5.399 6.791 5.843 1.00 0.00 H new ATOM 0 HG21 ILE A 39 3.376 7.007 8.994 1.00 0.00 H new ATOM 0 HG22 ILE A 39 4.594 6.221 10.027 1.00 0.00 H new ATOM 0 HG23 ILE A 39 4.883 7.862 9.401 1.00 0.00 H new ATOM 0 HD11 ILE A 39 3.350 8.075 5.476 1.00 0.00 H new ATOM 0 HD12 ILE A 39 2.966 6.459 6.114 1.00 0.00 H new ATOM 0 HD13 ILE A 39 2.902 7.877 7.187 1.00 0.00 H new ATOM 683 N GLU A 40 7.854 5.252 10.052 1.00 0.00 N ATOM 684 CA GLU A 40 8.323 4.339 11.093 1.00 0.00 C ATOM 685 C GLU A 40 7.174 3.797 11.976 1.00 0.00 C ATOM 686 O GLU A 40 7.169 2.632 12.344 1.00 0.00 O ATOM 687 CB GLU A 40 9.421 5.094 11.880 1.00 0.00 C ATOM 688 CG GLU A 40 9.391 5.042 13.399 1.00 0.00 C ATOM 689 CD GLU A 40 9.788 3.717 14.008 1.00 0.00 C ATOM 690 OE1 GLU A 40 10.893 3.215 13.709 1.00 0.00 O ATOM 691 OE2 GLU A 40 9.012 3.162 14.817 1.00 0.00 O ATOM 0 H GLU A 40 8.373 6.130 10.042 1.00 0.00 H new ATOM 0 HA GLU A 40 8.744 3.433 10.657 1.00 0.00 H new ATOM 0 HB2 GLU A 40 10.387 4.708 11.554 1.00 0.00 H new ATOM 0 HB3 GLU A 40 9.380 6.142 11.583 1.00 0.00 H new ATOM 0 HG2 GLU A 40 10.056 5.815 13.786 1.00 0.00 H new ATOM 0 HG3 GLU A 40 8.384 5.290 13.735 1.00 0.00 H new ATOM 698 N ALA A 41 6.190 4.622 12.250 1.00 0.00 N ATOM 699 CA ALA A 41 5.048 4.216 13.073 1.00 0.00 C ATOM 700 C ALA A 41 4.235 3.113 12.396 1.00 0.00 C ATOM 701 O ALA A 41 3.588 2.301 13.060 1.00 0.00 O ATOM 702 CB ALA A 41 4.153 5.411 13.368 1.00 0.00 C ATOM 0 H ALA A 41 6.147 5.586 11.918 1.00 0.00 H new ATOM 0 HA ALA A 41 5.442 3.822 14.010 1.00 0.00 H new ATOM 0 HB1 ALA A 41 3.310 5.092 13.980 1.00 0.00 H new ATOM 0 HB2 ALA A 41 4.724 6.170 13.904 1.00 0.00 H new ATOM 0 HB3 ALA A 41 3.784 5.829 12.432 1.00 0.00 H new ATOM 708 N ASN A 42 4.298 3.069 11.080 1.00 0.00 N ATOM 709 CA ASN A 42 3.531 2.122 10.300 1.00 0.00 C ATOM 710 C ASN A 42 4.383 0.969 9.794 1.00 0.00 C ATOM 711 O ASN A 42 3.902 0.169 8.997 1.00 0.00 O ATOM 712 CB ASN A 42 2.917 2.836 9.100 1.00 0.00 C ATOM 713 CG ASN A 42 1.912 3.899 9.475 1.00 0.00 C ATOM 714 OD1 ASN A 42 1.198 3.787 10.474 1.00 0.00 O ATOM 715 ND2 ASN A 42 1.861 4.941 8.699 1.00 0.00 N ATOM 0 H ASN A 42 4.884 3.690 10.522 1.00 0.00 H new ATOM 0 HA ASN A 42 2.759 1.713 10.952 1.00 0.00 H new ATOM 0 HB2 ASN A 42 3.714 3.293 8.513 1.00 0.00 H new ATOM 0 HB3 ASN A 42 2.432 2.100 8.459 1.00 0.00 H new ATOM 0 HD21 ASN A 42 1.214 5.702 8.908 1.00 0.00 H new ATOM 0 HD22 ASN A 42 2.468 4.998 7.881 1.00 0.00 H new ATOM 722 N LYS A 43 5.633 0.877 10.253 1.00 0.00 N ATOM 723 CA LYS A 43 6.556 -0.163 9.767 1.00 0.00 C ATOM 724 C LYS A 43 6.059 -1.565 10.120 1.00 0.00 C ATOM 725 O LYS A 43 5.508 -1.788 11.208 1.00 0.00 O ATOM 726 CB LYS A 43 7.996 0.069 10.280 1.00 0.00 C ATOM 727 CG LYS A 43 8.212 -0.192 11.768 1.00 0.00 C ATOM 728 CD LYS A 43 9.604 0.242 12.203 1.00 0.00 C ATOM 729 CE LYS A 43 9.828 -0.003 13.685 1.00 0.00 C ATOM 730 NZ LYS A 43 11.100 0.580 14.156 1.00 0.00 N ATOM 0 H LYS A 43 6.031 1.502 10.954 1.00 0.00 H new ATOM 0 HA LYS A 43 6.581 -0.089 8.680 1.00 0.00 H new ATOM 0 HB2 LYS A 43 8.672 -0.572 9.714 1.00 0.00 H new ATOM 0 HB3 LYS A 43 8.278 1.100 10.065 1.00 0.00 H new ATOM 0 HG2 LYS A 43 7.462 0.346 12.348 1.00 0.00 H new ATOM 0 HG3 LYS A 43 8.076 -1.253 11.978 1.00 0.00 H new ATOM 0 HD2 LYS A 43 10.352 -0.302 11.626 1.00 0.00 H new ATOM 0 HD3 LYS A 43 9.741 1.301 11.984 1.00 0.00 H new ATOM 0 HE2 LYS A 43 9.001 0.425 14.252 1.00 0.00 H new ATOM 0 HE3 LYS A 43 9.827 -1.076 13.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 11.067 0.697 15.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 11.886 -0.053 13.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 11.244 1.507 13.707 1.00 0.00 H new ATOM 744 N LEU A 44 6.229 -2.479 9.205 1.00 0.00 N ATOM 745 CA LEU A 44 5.784 -3.835 9.372 1.00 0.00 C ATOM 746 C LEU A 44 6.769 -4.579 10.277 1.00 0.00 C ATOM 747 O LEU A 44 7.953 -4.247 10.323 1.00 0.00 O ATOM 748 CB LEU A 44 5.643 -4.518 7.996 1.00 0.00 C ATOM 749 CG LEU A 44 5.008 -5.914 7.978 1.00 0.00 C ATOM 750 CD1 LEU A 44 3.589 -5.869 8.518 1.00 0.00 C ATOM 751 CD2 LEU A 44 5.013 -6.487 6.572 1.00 0.00 C ATOM 0 H LEU A 44 6.686 -2.301 8.311 1.00 0.00 H new ATOM 0 HA LEU A 44 4.803 -3.852 9.847 1.00 0.00 H new ATOM 0 HB2 LEU A 44 5.051 -3.867 7.353 1.00 0.00 H new ATOM 0 HB3 LEU A 44 6.635 -4.590 7.550 1.00 0.00 H new ATOM 0 HG LEU A 44 5.603 -6.562 8.622 1.00 0.00 H new ATOM 0 HD11 LEU A 44 3.159 -6.870 8.495 1.00 0.00 H new ATOM 0 HD12 LEU A 44 3.602 -5.503 9.545 1.00 0.00 H new ATOM 0 HD13 LEU A 44 2.986 -5.202 7.902 1.00 0.00 H new ATOM 0 HD21 LEU A 44 4.558 -7.478 6.581 1.00 0.00 H new ATOM 0 HD22 LEU A 44 4.445 -5.833 5.911 1.00 0.00 H new ATOM 0 HD23 LEU A 44 6.040 -6.562 6.213 1.00 0.00 H new ATOM 763 N ARG A 45 6.270 -5.594 10.962 1.00 0.00 N ATOM 764 CA ARG A 45 7.020 -6.323 11.985 1.00 0.00 C ATOM 765 C ARG A 45 8.300 -6.970 11.450 1.00 0.00 C ATOM 766 O ARG A 45 9.339 -6.908 12.092 1.00 0.00 O ATOM 767 CB ARG A 45 6.113 -7.375 12.634 1.00 0.00 C ATOM 768 CG ARG A 45 6.722 -8.134 13.806 1.00 0.00 C ATOM 769 CD ARG A 45 7.154 -7.182 14.910 1.00 0.00 C ATOM 770 NE ARG A 45 7.443 -7.875 16.158 1.00 0.00 N ATOM 771 CZ ARG A 45 8.037 -7.339 17.233 1.00 0.00 C ATOM 772 NH1 ARG A 45 8.564 -6.101 17.187 1.00 0.00 N ATOM 773 NH2 ARG A 45 8.125 -8.053 18.345 1.00 0.00 N ATOM 0 H ARG A 45 5.321 -5.943 10.826 1.00 0.00 H new ATOM 0 HA ARG A 45 7.340 -5.595 12.731 1.00 0.00 H new ATOM 0 HB2 ARG A 45 5.203 -6.883 12.976 1.00 0.00 H new ATOM 0 HB3 ARG A 45 5.818 -8.096 11.871 1.00 0.00 H new ATOM 0 HG2 ARG A 45 5.996 -8.846 14.199 1.00 0.00 H new ATOM 0 HG3 ARG A 45 7.581 -8.711 13.463 1.00 0.00 H new ATOM 0 HD2 ARG A 45 8.040 -6.634 14.588 1.00 0.00 H new ATOM 0 HD3 ARG A 45 6.368 -6.446 15.080 1.00 0.00 H new ATOM 0 HE ARG A 45 7.169 -8.856 16.219 1.00 0.00 H new ATOM 0 HH11 ARG A 45 8.514 -5.557 16.325 1.00 0.00 H new ATOM 0 HH12 ARG A 45 9.013 -5.707 18.014 1.00 0.00 H new ATOM 0 HH21 ARG A 45 7.743 -8.998 18.376 1.00 0.00 H new ATOM 0 HH22 ARG A 45 8.575 -7.658 19.171 1.00 0.00 H new ATOM 787 N GLY A 46 8.219 -7.576 10.286 1.00 0.00 N ATOM 788 CA GLY A 46 9.376 -8.258 9.747 1.00 0.00 C ATOM 789 C GLY A 46 9.896 -7.625 8.484 1.00 0.00 C ATOM 790 O GLY A 46 10.768 -8.176 7.828 1.00 0.00 O ATOM 0 H GLY A 46 7.382 -7.612 9.704 1.00 0.00 H new ATOM 0 HA2 GLY A 46 10.168 -8.266 10.496 1.00 0.00 H new ATOM 0 HA3 GLY A 46 9.117 -9.298 9.546 1.00 0.00 H new ATOM 794 N MET A 47 9.370 -6.468 8.146 1.00 0.00 N ATOM 795 CA MET A 47 9.766 -5.760 6.929 1.00 0.00 C ATOM 796 C MET A 47 9.798 -4.274 7.224 1.00 0.00 C ATOM 797 O MET A 47 8.775 -3.609 7.121 1.00 0.00 O ATOM 798 CB MET A 47 8.769 -5.994 5.773 1.00 0.00 C ATOM 799 CG MET A 47 8.583 -7.427 5.299 1.00 0.00 C ATOM 800 SD MET A 47 10.033 -8.126 4.494 1.00 0.00 S ATOM 801 CE MET A 47 9.384 -9.741 4.055 1.00 0.00 C ATOM 0 H MET A 47 8.659 -5.987 8.697 1.00 0.00 H new ATOM 0 HA MET A 47 10.743 -6.137 6.625 1.00 0.00 H new ATOM 0 HB2 MET A 47 7.796 -5.611 6.082 1.00 0.00 H new ATOM 0 HB3 MET A 47 9.092 -5.395 4.921 1.00 0.00 H new ATOM 0 HG2 MET A 47 8.319 -8.050 6.153 1.00 0.00 H new ATOM 0 HG3 MET A 47 7.742 -7.463 4.606 1.00 0.00 H new ATOM 0 HE1 MET A 47 10.210 -10.429 3.877 1.00 0.00 H new ATOM 0 HE2 MET A 47 8.767 -10.119 4.870 1.00 0.00 H new ATOM 0 HE3 MET A 47 8.780 -9.657 3.151 1.00 0.00 H new ATOM 811 N PRO A 48 10.937 -3.734 7.645 1.00 0.00 N ATOM 812 CA PRO A 48 11.062 -2.309 7.983 1.00 0.00 C ATOM 813 C PRO A 48 10.929 -1.371 6.767 1.00 0.00 C ATOM 814 O PRO A 48 10.852 -0.153 6.928 1.00 0.00 O ATOM 815 CB PRO A 48 12.460 -2.202 8.604 1.00 0.00 C ATOM 816 CG PRO A 48 12.831 -3.605 8.946 1.00 0.00 C ATOM 817 CD PRO A 48 12.197 -4.452 7.893 1.00 0.00 C ATOM 0 HA PRO A 48 10.259 -1.993 8.649 1.00 0.00 H new ATOM 0 HB2 PRO A 48 13.172 -1.764 7.904 1.00 0.00 H new ATOM 0 HB3 PRO A 48 12.452 -1.567 9.490 1.00 0.00 H new ATOM 0 HG2 PRO A 48 13.913 -3.734 8.955 1.00 0.00 H new ATOM 0 HG3 PRO A 48 12.470 -3.876 9.938 1.00 0.00 H new ATOM 0 HD2 PRO A 48 12.813 -4.518 6.996 1.00 0.00 H new ATOM 0 HD3 PRO A 48 12.025 -5.472 8.238 1.00 0.00 H new ATOM 825 N ASP A 49 10.918 -1.934 5.559 1.00 0.00 N ATOM 826 CA ASP A 49 10.737 -1.129 4.341 1.00 0.00 C ATOM 827 C ASP A 49 9.307 -1.226 3.852 1.00 0.00 C ATOM 828 O ASP A 49 8.945 -0.664 2.812 1.00 0.00 O ATOM 829 CB ASP A 49 11.695 -1.547 3.208 1.00 0.00 C ATOM 830 CG ASP A 49 13.149 -1.378 3.558 1.00 0.00 C ATOM 831 OD1 ASP A 49 13.675 -0.246 3.473 1.00 0.00 O ATOM 832 OD2 ASP A 49 13.803 -2.385 3.931 1.00 0.00 O ATOM 0 H ASP A 49 11.031 -2.934 5.393 1.00 0.00 H new ATOM 0 HA ASP A 49 10.970 -0.099 4.610 1.00 0.00 H new ATOM 0 HB2 ASP A 49 11.510 -2.590 2.953 1.00 0.00 H new ATOM 0 HB3 ASP A 49 11.473 -0.957 2.319 1.00 0.00 H new ATOM 837 N CYS A 50 8.498 -1.933 4.596 1.00 0.00 N ATOM 838 CA CYS A 50 7.110 -2.087 4.281 1.00 0.00 C ATOM 839 C CYS A 50 6.325 -1.353 5.345 1.00 0.00 C ATOM 840 O CYS A 50 6.688 -1.397 6.518 1.00 0.00 O ATOM 841 CB CYS A 50 6.737 -3.574 4.246 1.00 0.00 C ATOM 842 SG CYS A 50 5.048 -3.936 3.715 1.00 0.00 S ATOM 0 H CYS A 50 8.790 -2.420 5.443 1.00 0.00 H new ATOM 0 HA CYS A 50 6.884 -1.676 3.297 1.00 0.00 H new ATOM 0 HB2 CYS A 50 7.428 -4.089 3.579 1.00 0.00 H new ATOM 0 HB3 CYS A 50 6.884 -3.992 5.242 1.00 0.00 H new ATOM 0 HG CYS A 50 4.603 -2.956 2.986 1.00 0.00 H new ATOM 848 N TYR A 51 5.299 -0.644 4.948 1.00 0.00 N ATOM 849 CA TYR A 51 4.518 0.146 5.869 1.00 0.00 C ATOM 850 C TYR A 51 3.047 -0.080 5.579 1.00 0.00 C ATOM 851 O TYR A 51 2.678 -0.440 4.451 1.00 0.00 O ATOM 852 CB TYR A 51 4.885 1.641 5.747 1.00 0.00 C ATOM 853 CG TYR A 51 6.379 1.905 5.853 1.00 0.00 C ATOM 854 CD1 TYR A 51 7.019 1.946 7.075 1.00 0.00 C ATOM 855 CD2 TYR A 51 7.148 2.059 4.717 1.00 0.00 C ATOM 856 CE1 TYR A 51 8.383 2.143 7.166 1.00 0.00 C ATOM 857 CE2 TYR A 51 8.514 2.243 4.796 1.00 0.00 C ATOM 858 CZ TYR A 51 9.123 2.287 6.015 1.00 0.00 C ATOM 859 OH TYR A 51 10.490 2.442 6.090 1.00 0.00 O ATOM 0 H TYR A 51 4.981 -0.597 3.980 1.00 0.00 H new ATOM 0 HA TYR A 51 4.734 -0.160 6.893 1.00 0.00 H new ATOM 0 HB2 TYR A 51 4.523 2.020 4.791 1.00 0.00 H new ATOM 0 HB3 TYR A 51 4.368 2.200 6.527 1.00 0.00 H new ATOM 0 HD1 TYR A 51 6.441 1.821 7.979 1.00 0.00 H new ATOM 0 HD2 TYR A 51 6.672 2.035 3.748 1.00 0.00 H new ATOM 0 HE1 TYR A 51 8.864 2.184 8.132 1.00 0.00 H new ATOM 0 HE2 TYR A 51 9.099 2.352 3.894 1.00 0.00 H new ATOM 0 HH TYR A 51 10.900 1.598 6.373 1.00 0.00 H new ATOM 869 N LYS A 52 2.217 0.105 6.575 1.00 0.00 N ATOM 870 CA LYS A 52 0.792 -0.154 6.452 1.00 0.00 C ATOM 871 C LYS A 52 0.012 1.100 6.747 1.00 0.00 C ATOM 872 O LYS A 52 0.319 1.820 7.687 1.00 0.00 O ATOM 873 CB LYS A 52 0.345 -1.163 7.496 1.00 0.00 C ATOM 874 CG LYS A 52 1.149 -2.445 7.595 1.00 0.00 C ATOM 875 CD LYS A 52 0.666 -3.287 8.779 1.00 0.00 C ATOM 876 CE LYS A 52 0.712 -2.488 10.089 1.00 0.00 C ATOM 877 NZ LYS A 52 0.333 -3.298 11.251 1.00 0.00 N ATOM 0 H LYS A 52 2.503 0.439 7.495 1.00 0.00 H new ATOM 0 HA LYS A 52 0.616 -0.517 5.439 1.00 0.00 H new ATOM 0 HB2 LYS A 52 0.363 -0.675 8.470 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -0.692 -1.427 7.291 1.00 0.00 H new ATOM 0 HG2 LYS A 52 1.052 -3.015 6.671 1.00 0.00 H new ATOM 0 HG3 LYS A 52 2.207 -2.210 7.715 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -0.353 -3.627 8.594 1.00 0.00 H new ATOM 0 HD3 LYS A 52 1.288 -4.178 8.872 1.00 0.00 H new ATOM 0 HE2 LYS A 52 1.718 -2.094 10.236 1.00 0.00 H new ATOM 0 HE3 LYS A 52 0.042 -1.631 10.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 0.051 -2.673 12.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -0.463 -3.917 10.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 1.143 -3.879 11.548 1.00 0.00 H new ATOM 891 N ILE A 53 -1.004 1.331 5.994 1.00 0.00 N ATOM 892 CA ILE A 53 -1.904 2.415 6.247 1.00 0.00 C ATOM 893 C ILE A 53 -3.274 1.805 6.424 1.00 0.00 C ATOM 894 O ILE A 53 -3.552 0.741 5.861 1.00 0.00 O ATOM 895 CB ILE A 53 -1.960 3.431 5.083 1.00 0.00 C ATOM 896 CG1 ILE A 53 -0.547 3.821 4.652 1.00 0.00 C ATOM 897 CG2 ILE A 53 -2.727 4.669 5.546 1.00 0.00 C ATOM 898 CD1 ILE A 53 -0.498 4.755 3.459 1.00 0.00 C ATOM 0 H ILE A 53 -1.242 0.771 5.175 1.00 0.00 H new ATOM 0 HA ILE A 53 -1.563 2.961 7.127 1.00 0.00 H new ATOM 0 HB ILE A 53 -2.467 2.981 4.229 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -0.041 4.296 5.492 1.00 0.00 H new ATOM 0 HG13 ILE A 53 0.011 2.916 4.414 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -2.773 5.394 4.733 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -3.738 4.383 5.835 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -2.217 5.114 6.400 1.00 0.00 H new ATOM 0 HD11 ILE A 53 0.540 4.983 3.218 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -0.973 4.277 2.603 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -1.026 5.678 3.698 1.00 0.00 H new ATOM 910 N LYS A 54 -4.102 2.423 7.206 1.00 0.00 N ATOM 911 CA LYS A 54 -5.412 1.925 7.447 1.00 0.00 C ATOM 912 C LYS A 54 -6.369 3.068 7.650 1.00 0.00 C ATOM 913 O LYS A 54 -6.115 3.977 8.446 1.00 0.00 O ATOM 914 CB LYS A 54 -5.386 0.955 8.631 1.00 0.00 C ATOM 915 CG LYS A 54 -4.759 1.531 9.890 1.00 0.00 C ATOM 916 CD LYS A 54 -4.327 0.440 10.837 1.00 0.00 C ATOM 917 CE LYS A 54 -5.492 -0.419 11.346 1.00 0.00 C ATOM 918 NZ LYS A 54 -6.449 0.344 12.173 1.00 0.00 N ATOM 0 H LYS A 54 -3.884 3.291 7.696 1.00 0.00 H new ATOM 0 HA LYS A 54 -5.766 1.367 6.581 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -6.407 0.645 8.855 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -4.837 0.059 8.341 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -3.899 2.144 9.622 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -5.474 2.185 10.388 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -3.604 -0.202 10.334 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -3.817 0.889 11.689 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -6.018 -0.850 10.494 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -5.096 -1.250 11.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -7.177 -0.299 12.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -5.944 0.791 12.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -6.901 1.079 11.592 1.00 0.00 H new ATOM 932 N LEU A 55 -7.415 3.053 6.877 1.00 0.00 N ATOM 933 CA LEU A 55 -8.459 4.032 6.941 1.00 0.00 C ATOM 934 C LEU A 55 -9.149 3.906 8.280 1.00 0.00 C ATOM 935 O LEU A 55 -9.848 2.915 8.544 1.00 0.00 O ATOM 936 CB LEU A 55 -9.449 3.802 5.802 1.00 0.00 C ATOM 937 CG LEU A 55 -8.880 3.854 4.382 1.00 0.00 C ATOM 938 CD1 LEU A 55 -9.975 3.630 3.366 1.00 0.00 C ATOM 939 CD2 LEU A 55 -8.187 5.176 4.125 1.00 0.00 C ATOM 0 H LEU A 55 -7.569 2.339 6.165 1.00 0.00 H new ATOM 0 HA LEU A 55 -8.047 5.036 6.837 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -9.916 2.828 5.947 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -10.239 4.549 5.881 1.00 0.00 H new ATOM 0 HG LEU A 55 -8.143 3.057 4.283 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -9.553 3.670 2.362 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -10.429 2.653 3.530 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -10.734 4.405 3.472 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -7.791 5.188 3.109 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -8.901 5.991 4.246 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -7.369 5.302 4.834 1.00 0.00 H new ATOM 951 N ARG A 56 -8.958 4.899 9.110 1.00 0.00 N ATOM 952 CA ARG A 56 -9.404 4.864 10.493 1.00 0.00 C ATOM 953 C ARG A 56 -10.918 4.909 10.622 1.00 0.00 C ATOM 954 O ARG A 56 -11.465 4.481 11.630 1.00 0.00 O ATOM 955 CB ARG A 56 -8.757 5.995 11.298 1.00 0.00 C ATOM 956 CG ARG A 56 -7.237 5.917 11.350 1.00 0.00 C ATOM 957 CD ARG A 56 -6.647 7.082 12.126 1.00 0.00 C ATOM 958 NE ARG A 56 -5.176 7.045 12.144 1.00 0.00 N ATOM 959 CZ ARG A 56 -4.367 8.002 11.652 1.00 0.00 C ATOM 960 NH1 ARG A 56 -4.875 9.038 10.975 1.00 0.00 N ATOM 961 NH2 ARG A 56 -3.050 7.907 11.822 1.00 0.00 N ATOM 0 H ARG A 56 -8.486 5.765 8.850 1.00 0.00 H new ATOM 0 HA ARG A 56 -9.082 3.908 10.905 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -9.048 6.951 10.863 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -9.148 5.975 12.315 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -6.935 4.978 11.815 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -6.837 5.914 10.336 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -6.980 8.020 11.681 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -7.023 7.063 13.149 1.00 0.00 H new ATOM 0 HE ARG A 56 -4.733 6.227 12.564 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -5.882 9.107 10.828 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -4.255 9.759 10.605 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -2.657 7.111 12.324 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -2.434 8.630 11.450 1.00 0.00 H new ATOM 975 N SER A 57 -11.585 5.375 9.602 1.00 0.00 N ATOM 976 CA SER A 57 -13.012 5.499 9.628 1.00 0.00 C ATOM 977 C SER A 57 -13.624 4.619 8.518 1.00 0.00 C ATOM 978 O SER A 57 -14.701 4.929 7.969 1.00 0.00 O ATOM 979 CB SER A 57 -13.372 6.984 9.439 1.00 0.00 C ATOM 980 OG SER A 57 -14.749 7.242 9.699 1.00 0.00 O ATOM 0 H SER A 57 -11.152 5.679 8.730 1.00 0.00 H new ATOM 0 HA SER A 57 -13.417 5.158 10.581 1.00 0.00 H new ATOM 0 HB2 SER A 57 -12.758 7.592 10.104 1.00 0.00 H new ATOM 0 HB3 SER A 57 -13.134 7.287 8.419 1.00 0.00 H new ATOM 0 HG SER A 57 -15.300 6.591 9.217 1.00 0.00 H new ATOM 986 N SER A 58 -12.956 3.514 8.215 1.00 0.00 N ATOM 987 CA SER A 58 -13.423 2.606 7.191 1.00 0.00 C ATOM 988 C SER A 58 -13.022 1.154 7.507 1.00 0.00 C ATOM 989 O SER A 58 -13.878 0.252 7.555 1.00 0.00 O ATOM 990 CB SER A 58 -12.895 3.047 5.815 1.00 0.00 C ATOM 991 OG SER A 58 -13.286 2.165 4.787 1.00 0.00 O ATOM 0 H SER A 58 -12.088 3.230 8.668 1.00 0.00 H new ATOM 0 HA SER A 58 -14.512 2.640 7.169 1.00 0.00 H new ATOM 0 HB2 SER A 58 -13.262 4.049 5.591 1.00 0.00 H new ATOM 0 HB3 SER A 58 -11.807 3.106 5.847 1.00 0.00 H new ATOM 0 HG SER A 58 -12.705 2.293 4.008 1.00 0.00 H new ATOM 997 N GLY A 59 -11.747 0.921 7.734 1.00 0.00 N ATOM 998 CA GLY A 59 -11.290 -0.424 7.997 1.00 0.00 C ATOM 999 C GLY A 59 -10.478 -0.983 6.852 1.00 0.00 C ATOM 1000 O GLY A 59 -9.766 -1.966 7.010 1.00 0.00 O ATOM 0 H GLY A 59 -11.019 1.635 7.742 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -10.687 -0.430 8.905 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -12.149 -1.069 8.180 1.00 0.00 H new ATOM 1004 N TYR A 60 -10.591 -0.369 5.688 1.00 0.00 N ATOM 1005 CA TYR A 60 -9.809 -0.799 4.544 1.00 0.00 C ATOM 1006 C TYR A 60 -8.382 -0.354 4.706 1.00 0.00 C ATOM 1007 O TYR A 60 -8.117 0.727 5.212 1.00 0.00 O ATOM 1008 CB TYR A 60 -10.394 -0.306 3.232 1.00 0.00 C ATOM 1009 CG TYR A 60 -11.683 -0.985 2.856 1.00 0.00 C ATOM 1010 CD1 TYR A 60 -12.906 -0.501 3.286 1.00 0.00 C ATOM 1011 CD2 TYR A 60 -11.672 -2.113 2.065 1.00 0.00 C ATOM 1012 CE1 TYR A 60 -14.080 -1.122 2.935 1.00 0.00 C ATOM 1013 CE2 TYR A 60 -12.837 -2.742 1.710 1.00 0.00 C ATOM 1014 CZ TYR A 60 -14.038 -2.245 2.145 1.00 0.00 C ATOM 1015 OH TYR A 60 -15.210 -2.878 1.787 1.00 0.00 O ATOM 0 H TYR A 60 -11.211 0.422 5.511 1.00 0.00 H new ATOM 0 HA TYR A 60 -9.839 -1.888 4.506 1.00 0.00 H new ATOM 0 HB2 TYR A 60 -10.565 0.768 3.301 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -9.665 -0.462 2.437 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -12.938 0.381 3.909 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -10.729 -2.509 1.718 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -15.027 -0.731 3.277 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -12.809 -3.626 1.090 1.00 0.00 H new ATOM 0 HH TYR A 60 -15.004 -3.655 1.226 1.00 0.00 H new ATOM 1025 N ARG A 61 -7.474 -1.188 4.315 1.00 0.00 N ATOM 1026 CA ARG A 61 -6.075 -0.946 4.539 1.00 0.00 C ATOM 1027 C ARG A 61 -5.337 -0.979 3.229 1.00 0.00 C ATOM 1028 O ARG A 61 -5.876 -1.416 2.229 1.00 0.00 O ATOM 1029 CB ARG A 61 -5.545 -2.035 5.460 1.00 0.00 C ATOM 1030 CG ARG A 61 -6.343 -2.159 6.740 1.00 0.00 C ATOM 1031 CD ARG A 61 -5.942 -3.363 7.533 1.00 0.00 C ATOM 1032 NE ARG A 61 -6.767 -3.491 8.747 1.00 0.00 N ATOM 1033 CZ ARG A 61 -6.317 -3.690 9.994 1.00 0.00 C ATOM 1034 NH1 ARG A 61 -5.017 -3.749 10.233 1.00 0.00 N ATOM 1035 NH2 ARG A 61 -7.180 -3.810 11.000 1.00 0.00 N ATOM 0 H ARG A 61 -7.677 -2.061 3.829 1.00 0.00 H new ATOM 0 HA ARG A 61 -5.930 0.033 4.995 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -5.560 -2.989 4.934 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -4.504 -1.823 5.705 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -6.202 -1.263 7.344 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -7.405 -2.219 6.501 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -6.047 -4.259 6.921 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -4.890 -3.288 7.809 1.00 0.00 H new ATOM 0 HE ARG A 61 -7.778 -3.422 8.627 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -4.352 -3.643 9.467 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -4.680 -3.901 11.184 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -8.183 -3.751 10.822 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -6.839 -3.961 11.949 1.00 0.00 H new ATOM 1049 N LEU A 62 -4.125 -0.526 3.242 1.00 0.00 N ATOM 1050 CA LEU A 62 -3.276 -0.536 2.087 1.00 0.00 C ATOM 1051 C LEU A 62 -1.865 -0.771 2.574 1.00 0.00 C ATOM 1052 O LEU A 62 -1.369 -0.045 3.419 1.00 0.00 O ATOM 1053 CB LEU A 62 -3.434 0.795 1.305 1.00 0.00 C ATOM 1054 CG LEU A 62 -2.627 0.986 -0.002 1.00 0.00 C ATOM 1055 CD1 LEU A 62 -3.267 2.074 -0.841 1.00 0.00 C ATOM 1056 CD2 LEU A 62 -1.181 1.388 0.285 1.00 0.00 C ATOM 0 H LEU A 62 -3.685 -0.129 4.072 1.00 0.00 H new ATOM 0 HA LEU A 62 -3.544 -1.329 1.389 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -4.490 0.913 1.062 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -3.169 1.609 1.980 1.00 0.00 H new ATOM 0 HG LEU A 62 -2.630 0.034 -0.533 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -2.697 2.207 -1.761 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -4.290 1.790 -1.086 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -3.274 3.009 -0.280 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -0.645 1.513 -0.656 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -1.167 2.327 0.838 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -0.698 0.611 0.877 1.00 0.00 H new ATOM 1068 N VAL A 63 -1.260 -1.799 2.087 1.00 0.00 N ATOM 1069 CA VAL A 63 0.063 -2.188 2.505 1.00 0.00 C ATOM 1070 C VAL A 63 1.002 -1.932 1.355 1.00 0.00 C ATOM 1071 O VAL A 63 0.742 -2.383 0.250 1.00 0.00 O ATOM 1072 CB VAL A 63 0.092 -3.697 2.852 1.00 0.00 C ATOM 1073 CG1 VAL A 63 1.439 -4.113 3.422 1.00 0.00 C ATOM 1074 CG2 VAL A 63 -1.042 -4.058 3.797 1.00 0.00 C ATOM 0 H VAL A 63 -1.667 -2.408 1.377 1.00 0.00 H new ATOM 0 HA VAL A 63 0.357 -1.619 3.387 1.00 0.00 H new ATOM 0 HB VAL A 63 -0.053 -4.253 1.925 1.00 0.00 H new ATOM 0 HG11 VAL A 63 1.423 -5.178 3.654 1.00 0.00 H new ATOM 0 HG12 VAL A 63 2.221 -3.913 2.690 1.00 0.00 H new ATOM 0 HG13 VAL A 63 1.640 -3.547 4.331 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -1.000 -5.123 4.026 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -0.944 -3.485 4.719 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -1.997 -3.826 3.325 1.00 0.00 H new ATOM 1084 N TYR A 64 2.069 -1.223 1.594 1.00 0.00 N ATOM 1085 CA TYR A 64 3.000 -0.899 0.538 1.00 0.00 C ATOM 1086 C TYR A 64 4.422 -1.137 0.997 1.00 0.00 C ATOM 1087 O TYR A 64 4.666 -1.416 2.162 1.00 0.00 O ATOM 1088 CB TYR A 64 2.820 0.561 0.058 1.00 0.00 C ATOM 1089 CG TYR A 64 3.143 1.619 1.104 1.00 0.00 C ATOM 1090 CD1 TYR A 64 2.235 1.946 2.097 1.00 0.00 C ATOM 1091 CD2 TYR A 64 4.368 2.279 1.101 1.00 0.00 C ATOM 1092 CE1 TYR A 64 2.529 2.893 3.048 1.00 0.00 C ATOM 1093 CE2 TYR A 64 4.664 3.227 2.058 1.00 0.00 C ATOM 1094 CZ TYR A 64 3.737 3.527 3.029 1.00 0.00 C ATOM 1095 OH TYR A 64 4.021 4.468 3.995 1.00 0.00 O ATOM 0 H TYR A 64 2.320 -0.855 2.512 1.00 0.00 H new ATOM 0 HA TYR A 64 2.791 -1.555 -0.307 1.00 0.00 H new ATOM 0 HB2 TYR A 64 3.456 0.724 -0.812 1.00 0.00 H new ATOM 0 HB3 TYR A 64 1.789 0.697 -0.270 1.00 0.00 H new ATOM 0 HD1 TYR A 64 1.278 1.447 2.124 1.00 0.00 H new ATOM 0 HD2 TYR A 64 5.097 2.046 0.339 1.00 0.00 H new ATOM 0 HE1 TYR A 64 1.804 3.136 3.811 1.00 0.00 H new ATOM 0 HE2 TYR A 64 5.619 3.731 2.045 1.00 0.00 H new ATOM 0 HH TYR A 64 4.978 4.677 3.976 1.00 0.00 H new ATOM 1105 N GLN A 65 5.326 -1.030 0.086 1.00 0.00 N ATOM 1106 CA GLN A 65 6.723 -1.175 0.326 1.00 0.00 C ATOM 1107 C GLN A 65 7.409 -0.005 -0.334 1.00 0.00 C ATOM 1108 O GLN A 65 6.995 0.431 -1.415 1.00 0.00 O ATOM 1109 CB GLN A 65 7.223 -2.476 -0.298 1.00 0.00 C ATOM 1110 CG GLN A 65 8.714 -2.745 -0.094 1.00 0.00 C ATOM 1111 CD GLN A 65 9.212 -3.928 -0.901 1.00 0.00 C ATOM 1112 OE1 GLN A 65 10.141 -4.624 -0.505 1.00 0.00 O ATOM 1113 NE2 GLN A 65 8.630 -4.144 -2.052 1.00 0.00 N ATOM 0 H GLN A 65 5.104 -0.830 -0.889 1.00 0.00 H new ATOM 0 HA GLN A 65 6.932 -1.202 1.395 1.00 0.00 H new ATOM 0 HB2 GLN A 65 6.656 -3.307 0.122 1.00 0.00 H new ATOM 0 HB3 GLN A 65 7.013 -2.455 -1.367 1.00 0.00 H new ATOM 0 HG2 GLN A 65 9.281 -1.856 -0.372 1.00 0.00 H new ATOM 0 HG3 GLN A 65 8.905 -2.926 0.964 1.00 0.00 H new ATOM 0 HE21 GLN A 65 7.860 -3.548 -2.354 1.00 0.00 H new ATOM 0 HE22 GLN A 65 8.946 -4.909 -2.648 1.00 0.00 H new ATOM 1122 N VAL A 66 8.412 0.500 0.292 1.00 0.00 N ATOM 1123 CA VAL A 66 9.143 1.618 -0.232 1.00 0.00 C ATOM 1124 C VAL A 66 10.399 1.100 -0.879 1.00 0.00 C ATOM 1125 O VAL A 66 11.141 0.317 -0.280 1.00 0.00 O ATOM 1126 CB VAL A 66 9.499 2.640 0.873 1.00 0.00 C ATOM 1127 CG1 VAL A 66 10.259 3.836 0.309 1.00 0.00 C ATOM 1128 CG2 VAL A 66 8.237 3.107 1.537 1.00 0.00 C ATOM 0 H VAL A 66 8.757 0.154 1.187 1.00 0.00 H new ATOM 0 HA VAL A 66 8.520 2.137 -0.961 1.00 0.00 H new ATOM 0 HB VAL A 66 10.147 2.148 1.599 1.00 0.00 H new ATOM 0 HG11 VAL A 66 10.492 4.532 1.115 1.00 0.00 H new ATOM 0 HG12 VAL A 66 11.185 3.494 -0.153 1.00 0.00 H new ATOM 0 HG13 VAL A 66 9.644 4.338 -0.438 1.00 0.00 H new ATOM 0 HG21 VAL A 66 8.482 3.828 2.317 1.00 0.00 H new ATOM 0 HG22 VAL A 66 7.590 3.578 0.797 1.00 0.00 H new ATOM 0 HG23 VAL A 66 7.722 2.254 1.979 1.00 0.00 H new ATOM 1138 N ILE A 67 10.594 1.471 -2.108 1.00 0.00 N ATOM 1139 CA ILE A 67 11.751 1.070 -2.846 1.00 0.00 C ATOM 1140 C ILE A 67 12.470 2.329 -3.281 1.00 0.00 C ATOM 1141 O ILE A 67 12.017 3.027 -4.174 1.00 0.00 O ATOM 1142 CB ILE A 67 11.341 0.244 -4.101 1.00 0.00 C ATOM 1143 CG1 ILE A 67 10.451 -0.944 -3.687 1.00 0.00 C ATOM 1144 CG2 ILE A 67 12.582 -0.253 -4.844 1.00 0.00 C ATOM 1145 CD1 ILE A 67 9.905 -1.747 -4.843 1.00 0.00 C ATOM 0 H ILE A 67 9.949 2.065 -2.630 1.00 0.00 H new ATOM 0 HA ILE A 67 12.393 0.445 -2.226 1.00 0.00 H new ATOM 0 HB ILE A 67 10.774 0.889 -4.772 1.00 0.00 H new ATOM 0 HG12 ILE A 67 11.027 -1.606 -3.041 1.00 0.00 H new ATOM 0 HG13 ILE A 67 9.616 -0.568 -3.095 1.00 0.00 H new ATOM 0 HG21 ILE A 67 12.277 -0.828 -5.718 1.00 0.00 H new ATOM 0 HG22 ILE A 67 13.182 0.600 -5.162 1.00 0.00 H new ATOM 0 HG23 ILE A 67 13.173 -0.885 -4.182 1.00 0.00 H new ATOM 0 HD11 ILE A 67 9.290 -2.562 -4.462 1.00 0.00 H new ATOM 0 HD12 ILE A 67 9.299 -1.103 -5.479 1.00 0.00 H new ATOM 0 HD13 ILE A 67 10.731 -2.157 -5.424 1.00 0.00 H new ATOM 1157 N ASP A 68 13.560 2.632 -2.645 1.00 0.00 N ATOM 1158 CA ASP A 68 14.298 3.842 -2.958 1.00 0.00 C ATOM 1159 C ASP A 68 15.095 3.731 -4.233 1.00 0.00 C ATOM 1160 O ASP A 68 15.188 4.698 -4.974 1.00 0.00 O ATOM 1161 CB ASP A 68 15.193 4.309 -1.806 1.00 0.00 C ATOM 1162 CG ASP A 68 14.451 5.079 -0.737 1.00 0.00 C ATOM 1163 OD1 ASP A 68 14.267 6.309 -0.897 1.00 0.00 O ATOM 1164 OD2 ASP A 68 14.087 4.508 0.301 1.00 0.00 O ATOM 0 H ASP A 68 13.968 2.064 -1.903 1.00 0.00 H new ATOM 0 HA ASP A 68 13.534 4.604 -3.112 1.00 0.00 H new ATOM 0 HB2 ASP A 68 15.669 3.440 -1.352 1.00 0.00 H new ATOM 0 HB3 ASP A 68 15.990 4.936 -2.207 1.00 0.00 H new ATOM 1169 N GLU A 69 15.631 2.544 -4.518 1.00 0.00 N ATOM 1170 CA GLU A 69 16.482 2.354 -5.715 1.00 0.00 C ATOM 1171 C GLU A 69 15.712 2.596 -7.035 1.00 0.00 C ATOM 1172 O GLU A 69 16.237 3.196 -7.973 1.00 0.00 O ATOM 1173 CB GLU A 69 17.138 0.960 -5.735 1.00 0.00 C ATOM 1174 CG GLU A 69 16.148 -0.191 -5.720 1.00 0.00 C ATOM 1175 CD GLU A 69 16.784 -1.523 -5.967 1.00 0.00 C ATOM 1176 OE1 GLU A 69 16.973 -1.898 -7.141 1.00 0.00 O ATOM 1177 OE2 GLU A 69 17.076 -2.241 -4.992 1.00 0.00 O ATOM 0 H GLU A 69 15.500 1.705 -3.952 1.00 0.00 H new ATOM 0 HA GLU A 69 17.267 3.107 -5.645 1.00 0.00 H new ATOM 0 HB2 GLU A 69 17.762 0.877 -6.625 1.00 0.00 H new ATOM 0 HB3 GLU A 69 17.798 0.869 -4.873 1.00 0.00 H new ATOM 0 HG2 GLU A 69 15.640 -0.212 -4.756 1.00 0.00 H new ATOM 0 HG3 GLU A 69 15.385 -0.014 -6.478 1.00 0.00 H new ATOM 1184 N LYS A 70 14.469 2.143 -7.091 1.00 0.00 N ATOM 1185 CA LYS A 70 13.663 2.286 -8.300 1.00 0.00 C ATOM 1186 C LYS A 70 12.689 3.431 -8.158 1.00 0.00 C ATOM 1187 O LYS A 70 11.945 3.749 -9.097 1.00 0.00 O ATOM 1188 CB LYS A 70 12.913 0.988 -8.623 1.00 0.00 C ATOM 1189 CG LYS A 70 13.822 -0.183 -8.918 1.00 0.00 C ATOM 1190 CD LYS A 70 13.053 -1.424 -9.316 1.00 0.00 C ATOM 1191 CE LYS A 70 13.988 -2.620 -9.455 1.00 0.00 C ATOM 1192 NZ LYS A 70 15.053 -2.408 -10.459 1.00 0.00 N ATOM 0 H LYS A 70 13.995 1.675 -6.318 1.00 0.00 H new ATOM 0 HA LYS A 70 14.340 2.502 -9.127 1.00 0.00 H new ATOM 0 HB2 LYS A 70 12.268 0.733 -7.782 1.00 0.00 H new ATOM 0 HB3 LYS A 70 12.264 1.158 -9.482 1.00 0.00 H new ATOM 0 HG2 LYS A 70 14.510 0.087 -9.719 1.00 0.00 H new ATOM 0 HG3 LYS A 70 14.427 -0.400 -8.038 1.00 0.00 H new ATOM 0 HD2 LYS A 70 12.289 -1.639 -8.569 1.00 0.00 H new ATOM 0 HD3 LYS A 70 12.536 -1.250 -10.260 1.00 0.00 H new ATOM 0 HE2 LYS A 70 14.445 -2.831 -8.488 1.00 0.00 H new ATOM 0 HE3 LYS A 70 13.406 -3.499 -9.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 15.561 -3.301 -10.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 14.629 -2.085 -11.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 15.719 -1.689 -10.112 1.00 0.00 H new ATOM 1206 N VAL A 71 12.703 4.044 -6.967 1.00 0.00 N ATOM 1207 CA VAL A 71 11.834 5.160 -6.615 1.00 0.00 C ATOM 1208 C VAL A 71 10.344 4.764 -6.801 1.00 0.00 C ATOM 1209 O VAL A 71 9.683 5.119 -7.777 1.00 0.00 O ATOM 1210 CB VAL A 71 12.205 6.448 -7.414 1.00 0.00 C ATOM 1211 CG1 VAL A 71 11.360 7.614 -6.990 1.00 0.00 C ATOM 1212 CG2 VAL A 71 13.684 6.778 -7.250 1.00 0.00 C ATOM 0 H VAL A 71 13.332 3.769 -6.212 1.00 0.00 H new ATOM 0 HA VAL A 71 11.985 5.396 -5.562 1.00 0.00 H new ATOM 0 HB VAL A 71 12.007 6.252 -8.468 1.00 0.00 H new ATOM 0 HG11 VAL A 71 11.642 8.496 -7.565 1.00 0.00 H new ATOM 0 HG12 VAL A 71 10.309 7.386 -7.168 1.00 0.00 H new ATOM 0 HG13 VAL A 71 11.514 7.808 -5.929 1.00 0.00 H new ATOM 0 HG21 VAL A 71 13.921 7.679 -7.815 1.00 0.00 H new ATOM 0 HG22 VAL A 71 13.905 6.943 -6.195 1.00 0.00 H new ATOM 0 HG23 VAL A 71 14.285 5.948 -7.622 1.00 0.00 H new ATOM 1222 N VAL A 72 9.851 3.959 -5.893 1.00 0.00 N ATOM 1223 CA VAL A 72 8.536 3.381 -6.026 1.00 0.00 C ATOM 1224 C VAL A 72 7.864 3.248 -4.671 1.00 0.00 C ATOM 1225 O VAL A 72 8.520 2.954 -3.670 1.00 0.00 O ATOM 1226 CB VAL A 72 8.617 1.912 -6.568 1.00 0.00 C ATOM 1227 CG1 VAL A 72 7.277 1.380 -6.961 1.00 0.00 C ATOM 1228 CG2 VAL A 72 9.635 1.706 -7.667 1.00 0.00 C ATOM 0 H VAL A 72 10.347 3.687 -5.044 1.00 0.00 H new ATOM 0 HA VAL A 72 7.987 4.039 -6.700 1.00 0.00 H new ATOM 0 HB VAL A 72 8.979 1.328 -5.722 1.00 0.00 H new ATOM 0 HG11 VAL A 72 7.384 0.360 -7.330 1.00 0.00 H new ATOM 0 HG12 VAL A 72 6.615 1.385 -6.095 1.00 0.00 H new ATOM 0 HG13 VAL A 72 6.852 2.007 -7.745 1.00 0.00 H new ATOM 0 HG21 VAL A 72 9.624 0.663 -7.982 1.00 0.00 H new ATOM 0 HG22 VAL A 72 9.388 2.344 -8.516 1.00 0.00 H new ATOM 0 HG23 VAL A 72 10.627 1.963 -7.296 1.00 0.00 H new ATOM 1238 N VAL A 73 6.591 3.487 -4.654 1.00 0.00 N ATOM 1239 CA VAL A 73 5.748 3.111 -3.576 1.00 0.00 C ATOM 1240 C VAL A 73 4.928 1.969 -4.130 1.00 0.00 C ATOM 1241 O VAL A 73 3.953 2.172 -4.857 1.00 0.00 O ATOM 1242 CB VAL A 73 4.840 4.267 -3.094 1.00 0.00 C ATOM 1243 CG1 VAL A 73 3.870 3.801 -2.017 1.00 0.00 C ATOM 1244 CG2 VAL A 73 5.703 5.386 -2.564 1.00 0.00 C ATOM 0 H VAL A 73 6.101 3.962 -5.412 1.00 0.00 H new ATOM 0 HA VAL A 73 6.327 2.834 -2.695 1.00 0.00 H new ATOM 0 HB VAL A 73 4.250 4.620 -3.939 1.00 0.00 H new ATOM 0 HG11 VAL A 73 3.247 4.638 -1.701 1.00 0.00 H new ATOM 0 HG12 VAL A 73 3.237 3.008 -2.416 1.00 0.00 H new ATOM 0 HG13 VAL A 73 4.430 3.423 -1.162 1.00 0.00 H new ATOM 0 HG21 VAL A 73 5.069 6.204 -2.223 1.00 0.00 H new ATOM 0 HG22 VAL A 73 6.303 5.020 -1.731 1.00 0.00 H new ATOM 0 HG23 VAL A 73 6.362 5.744 -3.355 1.00 0.00 H new ATOM 1254 N PHE A 74 5.407 0.786 -3.886 1.00 0.00 N ATOM 1255 CA PHE A 74 4.843 -0.401 -4.457 1.00 0.00 C ATOM 1256 C PHE A 74 3.840 -1.022 -3.524 1.00 0.00 C ATOM 1257 O PHE A 74 4.199 -1.613 -2.516 1.00 0.00 O ATOM 1258 CB PHE A 74 5.965 -1.390 -4.832 1.00 0.00 C ATOM 1259 CG PHE A 74 5.495 -2.724 -5.343 1.00 0.00 C ATOM 1260 CD1 PHE A 74 4.510 -2.810 -6.311 1.00 0.00 C ATOM 1261 CD2 PHE A 74 6.050 -3.895 -4.855 1.00 0.00 C ATOM 1262 CE1 PHE A 74 4.087 -4.032 -6.771 1.00 0.00 C ATOM 1263 CE2 PHE A 74 5.628 -5.122 -5.319 1.00 0.00 C ATOM 1264 CZ PHE A 74 4.644 -5.187 -6.279 1.00 0.00 C ATOM 0 H PHE A 74 6.209 0.616 -3.279 1.00 0.00 H new ATOM 0 HA PHE A 74 4.309 -0.135 -5.369 1.00 0.00 H new ATOM 0 HB2 PHE A 74 6.596 -0.929 -5.592 1.00 0.00 H new ATOM 0 HB3 PHE A 74 6.591 -1.554 -3.955 1.00 0.00 H new ATOM 0 HD1 PHE A 74 4.070 -1.907 -6.708 1.00 0.00 H new ATOM 0 HD2 PHE A 74 6.823 -3.846 -4.102 1.00 0.00 H new ATOM 0 HE1 PHE A 74 3.313 -4.086 -7.523 1.00 0.00 H new ATOM 0 HE2 PHE A 74 6.068 -6.029 -4.931 1.00 0.00 H new ATOM 0 HZ PHE A 74 4.310 -6.146 -6.646 1.00 0.00 H new ATOM 1274 N VAL A 75 2.601 -0.861 -3.853 1.00 0.00 N ATOM 1275 CA VAL A 75 1.529 -1.400 -3.076 1.00 0.00 C ATOM 1276 C VAL A 75 1.407 -2.901 -3.332 1.00 0.00 C ATOM 1277 O VAL A 75 1.256 -3.343 -4.475 1.00 0.00 O ATOM 1278 CB VAL A 75 0.200 -0.689 -3.385 1.00 0.00 C ATOM 1279 CG1 VAL A 75 -0.901 -1.202 -2.481 1.00 0.00 C ATOM 1280 CG2 VAL A 75 0.358 0.822 -3.242 1.00 0.00 C ATOM 0 H VAL A 75 2.298 -0.345 -4.679 1.00 0.00 H new ATOM 0 HA VAL A 75 1.753 -1.234 -2.022 1.00 0.00 H new ATOM 0 HB VAL A 75 -0.078 -0.908 -4.416 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -1.833 -0.687 -2.715 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -1.029 -2.273 -2.636 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -0.634 -1.015 -1.441 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -0.591 1.310 -3.464 1.00 0.00 H new ATOM 0 HG22 VAL A 75 0.659 1.061 -2.222 1.00 0.00 H new ATOM 0 HG23 VAL A 75 1.119 1.176 -3.938 1.00 0.00 H new ATOM 1290 N ILE A 76 1.496 -3.647 -2.260 1.00 0.00 N ATOM 1291 CA ILE A 76 1.477 -5.094 -2.269 1.00 0.00 C ATOM 1292 C ILE A 76 0.036 -5.609 -2.301 1.00 0.00 C ATOM 1293 O ILE A 76 -0.321 -6.429 -3.136 1.00 0.00 O ATOM 1294 CB ILE A 76 2.165 -5.641 -0.984 1.00 0.00 C ATOM 1295 CG1 ILE A 76 3.580 -5.043 -0.810 1.00 0.00 C ATOM 1296 CG2 ILE A 76 2.222 -7.170 -0.987 1.00 0.00 C ATOM 1297 CD1 ILE A 76 4.554 -5.378 -1.924 1.00 0.00 C ATOM 0 H ILE A 76 1.587 -3.253 -1.323 1.00 0.00 H new ATOM 0 HA ILE A 76 2.010 -5.436 -3.157 1.00 0.00 H new ATOM 0 HB ILE A 76 1.558 -5.330 -0.134 1.00 0.00 H new ATOM 0 HG12 ILE A 76 3.494 -3.959 -0.735 1.00 0.00 H new ATOM 0 HG13 ILE A 76 3.995 -5.396 0.134 1.00 0.00 H new ATOM 0 HG21 ILE A 76 2.708 -7.518 -0.076 1.00 0.00 H new ATOM 0 HG22 ILE A 76 1.210 -7.572 -1.034 1.00 0.00 H new ATOM 0 HG23 ILE A 76 2.788 -7.511 -1.853 1.00 0.00 H new ATOM 0 HD11 ILE A 76 5.519 -4.916 -1.715 1.00 0.00 H new ATOM 0 HD12 ILE A 76 4.676 -6.459 -1.988 1.00 0.00 H new ATOM 0 HD13 ILE A 76 4.168 -5.000 -2.871 1.00 0.00 H new ATOM 1309 N SER A 77 -0.779 -5.131 -1.381 1.00 0.00 N ATOM 1310 CA SER A 77 -2.149 -5.565 -1.295 1.00 0.00 C ATOM 1311 C SER A 77 -2.971 -4.445 -0.688 1.00 0.00 C ATOM 1312 O SER A 77 -2.422 -3.570 -0.009 1.00 0.00 O ATOM 1313 CB SER A 77 -2.251 -6.850 -0.446 1.00 0.00 C ATOM 1314 OG SER A 77 -3.555 -7.416 -0.512 1.00 0.00 O ATOM 0 H SER A 77 -0.509 -4.439 -0.682 1.00 0.00 H new ATOM 0 HA SER A 77 -2.532 -5.797 -2.289 1.00 0.00 H new ATOM 0 HB2 SER A 77 -1.519 -7.578 -0.796 1.00 0.00 H new ATOM 0 HB3 SER A 77 -2.004 -6.623 0.591 1.00 0.00 H new ATOM 0 HG SER A 77 -3.587 -8.229 0.034 1.00 0.00 H new ATOM 1320 N VAL A 78 -4.263 -4.464 -0.933 1.00 0.00 N ATOM 1321 CA VAL A 78 -5.178 -3.437 -0.479 1.00 0.00 C ATOM 1322 C VAL A 78 -6.478 -4.139 -0.107 1.00 0.00 C ATOM 1323 O VAL A 78 -6.886 -5.050 -0.811 1.00 0.00 O ATOM 1324 CB VAL A 78 -5.523 -2.425 -1.624 1.00 0.00 C ATOM 1325 CG1 VAL A 78 -6.232 -1.218 -1.076 1.00 0.00 C ATOM 1326 CG2 VAL A 78 -4.313 -2.002 -2.433 1.00 0.00 C ATOM 0 H VAL A 78 -4.717 -5.208 -1.464 1.00 0.00 H new ATOM 0 HA VAL A 78 -4.721 -2.895 0.349 1.00 0.00 H new ATOM 0 HB VAL A 78 -6.188 -2.955 -2.307 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -6.461 -0.530 -1.890 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -7.158 -1.529 -0.592 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -5.592 -0.719 -0.348 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -4.621 -1.301 -3.209 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -3.587 -1.521 -1.777 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -3.860 -2.879 -2.895 1.00 0.00 H new ATOM 1336 N GLY A 79 -7.083 -3.779 0.992 1.00 0.00 N ATOM 1337 CA GLY A 79 -8.350 -4.343 1.321 1.00 0.00 C ATOM 1338 C GLY A 79 -8.460 -4.586 2.781 1.00 0.00 C ATOM 1339 O GLY A 79 -7.661 -4.048 3.566 1.00 0.00 O ATOM 0 H GLY A 79 -6.719 -3.104 1.665 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -9.146 -3.671 0.999 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -8.486 -5.280 0.781 1.00 0.00 H new ATOM 1343 N LYS A 80 -9.426 -5.355 3.174 1.00 0.00 N ATOM 1344 CA LYS A 80 -9.586 -5.667 4.555 1.00 0.00 C ATOM 1345 C LYS A 80 -8.913 -6.972 4.886 1.00 0.00 C ATOM 1346 O LYS A 80 -9.441 -8.055 4.620 1.00 0.00 O ATOM 1347 CB LYS A 80 -11.060 -5.682 4.971 1.00 0.00 C ATOM 1348 CG LYS A 80 -11.719 -4.313 4.925 1.00 0.00 C ATOM 1349 CD LYS A 80 -13.199 -4.312 5.345 1.00 0.00 C ATOM 1350 CE LYS A 80 -13.441 -4.604 6.841 1.00 0.00 C ATOM 1351 NZ LYS A 80 -13.231 -6.016 7.232 1.00 0.00 N ATOM 0 H LYS A 80 -10.117 -5.778 2.554 1.00 0.00 H new ATOM 0 HA LYS A 80 -9.102 -4.877 5.129 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -11.607 -6.361 4.317 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -11.139 -6.080 5.982 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -11.168 -3.635 5.576 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -11.640 -3.918 3.912 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -13.631 -3.341 5.103 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -13.732 -5.055 4.752 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -12.778 -3.974 7.433 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -14.462 -4.318 7.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -14.029 -6.337 7.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -13.167 -6.607 6.378 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -12.349 -6.098 7.776 1.00 0.00 H new ATOM 1715 N GLU B 54 -1.906 -8.750 12.977 1.00 0.00 N ATOM 1716 CA GLU B 54 -2.042 -8.423 11.573 1.00 0.00 C ATOM 1717 C GLU B 54 -0.671 -8.396 10.889 1.00 0.00 C ATOM 1718 O GLU B 54 -0.508 -8.899 9.789 1.00 0.00 O ATOM 1719 CB GLU B 54 -2.743 -7.076 11.411 1.00 0.00 C ATOM 1720 CG GLU B 54 -2.102 -5.949 12.209 1.00 0.00 C ATOM 1721 CD GLU B 54 -2.695 -4.622 11.907 1.00 0.00 C ATOM 1722 OE1 GLU B 54 -3.678 -4.222 12.552 1.00 0.00 O ATOM 1723 OE2 GLU B 54 -2.203 -3.943 11.004 1.00 0.00 O ATOM 0 HA GLU B 54 -2.648 -9.194 11.096 1.00 0.00 H new ATOM 0 HB2 GLU B 54 -2.748 -6.804 10.355 1.00 0.00 H new ATOM 0 HB3 GLU B 54 -3.784 -7.179 11.718 1.00 0.00 H new ATOM 0 HG2 GLU B 54 -2.210 -6.157 13.274 1.00 0.00 H new ATOM 0 HG3 GLU B 54 -1.033 -5.921 11.996 1.00 0.00 H new ATOM 1730 N ASP B 55 0.318 -7.879 11.599 1.00 0.00 N ATOM 1731 CA ASP B 55 1.673 -7.732 11.084 1.00 0.00 C ATOM 1732 C ASP B 55 2.271 -9.062 10.742 1.00 0.00 C ATOM 1733 O ASP B 55 2.951 -9.201 9.735 1.00 0.00 O ATOM 1734 CB ASP B 55 2.562 -7.008 12.088 1.00 0.00 C ATOM 1735 CG ASP B 55 2.113 -5.604 12.324 1.00 0.00 C ATOM 1736 OD1 ASP B 55 1.192 -5.386 13.124 1.00 0.00 O ATOM 1737 OD2 ASP B 55 2.641 -4.685 11.686 1.00 0.00 O ATOM 0 H ASP B 55 0.204 -7.546 12.557 1.00 0.00 H new ATOM 0 HA ASP B 55 1.612 -7.135 10.174 1.00 0.00 H new ATOM 0 HB2 ASP B 55 2.560 -7.553 13.032 1.00 0.00 H new ATOM 0 HB3 ASP B 55 3.590 -7.003 11.725 1.00 0.00 H new ATOM 1742 N ALA B 56 1.952 -10.051 11.548 1.00 0.00 N ATOM 1743 CA ALA B 56 2.458 -11.398 11.369 1.00 0.00 C ATOM 1744 C ALA B 56 1.893 -12.029 10.112 1.00 0.00 C ATOM 1745 O ALA B 56 2.509 -12.899 9.505 1.00 0.00 O ATOM 1746 CB ALA B 56 2.121 -12.243 12.575 1.00 0.00 C ATOM 0 H ALA B 56 1.331 -9.945 12.350 1.00 0.00 H new ATOM 0 HA ALA B 56 3.542 -11.344 11.263 1.00 0.00 H new ATOM 0 HB1 ALA B 56 2.505 -13.253 12.431 1.00 0.00 H new ATOM 0 HB2 ALA B 56 2.575 -11.806 13.464 1.00 0.00 H new ATOM 0 HB3 ALA B 56 1.039 -12.281 12.702 1.00 0.00 H new ATOM 1752 N GLU B 57 0.737 -11.571 9.703 1.00 0.00 N ATOM 1753 CA GLU B 57 0.109 -12.094 8.527 1.00 0.00 C ATOM 1754 C GLU B 57 0.616 -11.354 7.311 1.00 0.00 C ATOM 1755 O GLU B 57 0.877 -11.937 6.272 1.00 0.00 O ATOM 1756 CB GLU B 57 -1.409 -11.991 8.632 1.00 0.00 C ATOM 1757 CG GLU B 57 -2.004 -12.829 9.740 1.00 0.00 C ATOM 1758 CD GLU B 57 -1.575 -14.276 9.661 1.00 0.00 C ATOM 1759 OE1 GLU B 57 -1.910 -14.957 8.671 1.00 0.00 O ATOM 1760 OE2 GLU B 57 -0.903 -14.762 10.606 1.00 0.00 O ATOM 0 H GLU B 57 0.213 -10.833 10.173 1.00 0.00 H new ATOM 0 HA GLU B 57 0.362 -13.150 8.429 1.00 0.00 H new ATOM 0 HB2 GLU B 57 -1.682 -10.948 8.792 1.00 0.00 H new ATOM 0 HB3 GLU B 57 -1.851 -12.295 7.683 1.00 0.00 H new ATOM 0 HG2 GLU B 57 -1.706 -12.417 10.704 1.00 0.00 H new ATOM 0 HG3 GLU B 57 -3.091 -12.772 9.691 1.00 0.00 H new ATOM 1767 N LEU B 58 0.817 -10.076 7.462 1.00 0.00 N ATOM 1768 CA LEU B 58 1.291 -9.276 6.368 1.00 0.00 C ATOM 1769 C LEU B 58 2.733 -9.567 5.992 1.00 0.00 C ATOM 1770 O LEU B 58 3.089 -9.422 4.835 1.00 0.00 O ATOM 1771 CB LEU B 58 1.022 -7.777 6.555 1.00 0.00 C ATOM 1772 CG LEU B 58 -0.398 -7.266 6.194 1.00 0.00 C ATOM 1773 CD1 LEU B 58 -0.707 -7.520 4.729 1.00 0.00 C ATOM 1774 CD2 LEU B 58 -1.484 -7.875 7.067 1.00 0.00 C ATOM 0 H LEU B 58 0.660 -9.566 8.331 1.00 0.00 H new ATOM 0 HA LEU B 58 0.692 -9.583 5.511 1.00 0.00 H new ATOM 0 HB2 LEU B 58 1.218 -7.525 7.597 1.00 0.00 H new ATOM 0 HB3 LEU B 58 1.744 -7.225 5.953 1.00 0.00 H new ATOM 0 HG LEU B 58 -0.395 -6.193 6.383 1.00 0.00 H new ATOM 0 HD11 LEU B 58 -1.708 -7.153 4.499 1.00 0.00 H new ATOM 0 HD12 LEU B 58 0.022 -6.999 4.108 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -0.657 -8.590 4.527 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -2.455 -7.480 6.768 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -1.481 -8.959 6.949 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -1.296 -7.623 8.111 1.00 0.00 H new ATOM 1786 N VAL B 59 3.558 -10.019 6.952 1.00 0.00 N ATOM 1787 CA VAL B 59 4.952 -10.372 6.627 1.00 0.00 C ATOM 1788 C VAL B 59 5.000 -11.563 5.666 1.00 0.00 C ATOM 1789 O VAL B 59 5.869 -11.628 4.798 1.00 0.00 O ATOM 1790 CB VAL B 59 5.864 -10.651 7.878 1.00 0.00 C ATOM 1791 CG1 VAL B 59 5.882 -9.482 8.829 1.00 0.00 C ATOM 1792 CG2 VAL B 59 5.504 -11.948 8.596 1.00 0.00 C ATOM 0 H VAL B 59 3.296 -10.146 7.930 1.00 0.00 H new ATOM 0 HA VAL B 59 5.366 -9.486 6.146 1.00 0.00 H new ATOM 0 HB VAL B 59 6.875 -10.780 7.492 1.00 0.00 H new ATOM 0 HG11 VAL B 59 6.523 -9.715 9.679 1.00 0.00 H new ATOM 0 HG12 VAL B 59 6.266 -8.601 8.315 1.00 0.00 H new ATOM 0 HG13 VAL B 59 4.870 -9.284 9.181 1.00 0.00 H new ATOM 0 HG21 VAL B 59 6.167 -12.087 9.450 1.00 0.00 H new ATOM 0 HG22 VAL B 59 4.472 -11.898 8.942 1.00 0.00 H new ATOM 0 HG23 VAL B 59 5.616 -12.787 7.909 1.00 0.00 H new ATOM 1802 N GLU B 60 4.037 -12.478 5.788 1.00 0.00 N ATOM 1803 CA GLU B 60 3.995 -13.608 4.905 1.00 0.00 C ATOM 1804 C GLU B 60 3.320 -13.257 3.584 1.00 0.00 C ATOM 1805 O GLU B 60 3.757 -13.694 2.542 1.00 0.00 O ATOM 1806 CB GLU B 60 3.387 -14.871 5.545 1.00 0.00 C ATOM 1807 CG GLU B 60 1.992 -14.720 6.103 1.00 0.00 C ATOM 1808 CD GLU B 60 1.392 -16.040 6.485 1.00 0.00 C ATOM 1809 OE1 GLU B 60 1.851 -16.658 7.470 1.00 0.00 O ATOM 1810 OE2 GLU B 60 0.472 -16.500 5.783 1.00 0.00 O ATOM 0 H GLU B 60 3.292 -12.447 6.484 1.00 0.00 H new ATOM 0 HA GLU B 60 5.034 -13.863 4.694 1.00 0.00 H new ATOM 0 HB2 GLU B 60 3.375 -15.664 4.797 1.00 0.00 H new ATOM 0 HB3 GLU B 60 4.045 -15.201 6.349 1.00 0.00 H new ATOM 0 HG2 GLU B 60 2.020 -14.068 6.976 1.00 0.00 H new ATOM 0 HG3 GLU B 60 1.356 -14.234 5.363 1.00 0.00 H new ATOM 1817 N ILE B 61 2.285 -12.421 3.637 1.00 0.00 N ATOM 1818 CA ILE B 61 1.564 -12.001 2.426 1.00 0.00 C ATOM 1819 C ILE B 61 2.481 -11.217 1.467 1.00 0.00 C ATOM 1820 O ILE B 61 2.437 -11.416 0.240 1.00 0.00 O ATOM 1821 CB ILE B 61 0.284 -11.168 2.773 1.00 0.00 C ATOM 1822 CG1 ILE B 61 -0.697 -12.033 3.580 1.00 0.00 C ATOM 1823 CG2 ILE B 61 -0.393 -10.623 1.506 1.00 0.00 C ATOM 1824 CD1 ILE B 61 -1.940 -11.301 4.048 1.00 0.00 C ATOM 0 H ILE B 61 1.923 -12.019 4.502 1.00 0.00 H new ATOM 0 HA ILE B 61 1.242 -12.909 1.917 1.00 0.00 H new ATOM 0 HB ILE B 61 0.587 -10.312 3.376 1.00 0.00 H new ATOM 0 HG12 ILE B 61 -1.000 -12.884 2.969 1.00 0.00 H new ATOM 0 HG13 ILE B 61 -0.177 -12.434 4.450 1.00 0.00 H new ATOM 0 HG21 ILE B 61 -1.278 -10.050 1.784 1.00 0.00 H new ATOM 0 HG22 ILE B 61 0.303 -9.978 0.970 1.00 0.00 H new ATOM 0 HG23 ILE B 61 -0.686 -11.454 0.864 1.00 0.00 H new ATOM 0 HD11 ILE B 61 -2.576 -11.986 4.609 1.00 0.00 H new ATOM 0 HD12 ILE B 61 -1.652 -10.467 4.688 1.00 0.00 H new ATOM 0 HD13 ILE B 61 -2.487 -10.923 3.184 1.00 0.00 H new ATOM 1836 N VAL B 62 3.331 -10.364 2.017 1.00 0.00 N ATOM 1837 CA VAL B 62 4.237 -9.589 1.192 1.00 0.00 C ATOM 1838 C VAL B 62 5.305 -10.485 0.548 1.00 0.00 C ATOM 1839 O VAL B 62 5.468 -10.473 -0.681 1.00 0.00 O ATOM 1840 CB VAL B 62 4.862 -8.352 1.943 1.00 0.00 C ATOM 1841 CG1 VAL B 62 5.665 -8.753 3.163 1.00 0.00 C ATOM 1842 CG2 VAL B 62 5.715 -7.512 1.005 1.00 0.00 C ATOM 0 H VAL B 62 3.411 -10.194 3.019 1.00 0.00 H new ATOM 0 HA VAL B 62 3.637 -9.161 0.388 1.00 0.00 H new ATOM 0 HB VAL B 62 4.022 -7.751 2.291 1.00 0.00 H new ATOM 0 HG11 VAL B 62 6.072 -7.861 3.640 1.00 0.00 H new ATOM 0 HG12 VAL B 62 5.020 -9.279 3.867 1.00 0.00 H new ATOM 0 HG13 VAL B 62 6.483 -9.408 2.861 1.00 0.00 H new ATOM 0 HG21 VAL B 62 6.132 -6.666 1.552 1.00 0.00 H new ATOM 0 HG22 VAL B 62 6.526 -8.122 0.606 1.00 0.00 H new ATOM 0 HG23 VAL B 62 5.099 -7.145 0.184 1.00 0.00 H new ATOM 1852 N LYS B 63 5.958 -11.331 1.363 1.00 0.00 N ATOM 1853 CA LYS B 63 7.007 -12.225 0.868 1.00 0.00 C ATOM 1854 C LYS B 63 6.415 -13.223 -0.128 1.00 0.00 C ATOM 1855 O LYS B 63 7.092 -13.672 -1.050 1.00 0.00 O ATOM 1856 CB LYS B 63 7.714 -12.960 2.022 1.00 0.00 C ATOM 1857 CG LYS B 63 6.831 -13.947 2.760 1.00 0.00 C ATOM 1858 CD LYS B 63 7.540 -14.624 3.929 1.00 0.00 C ATOM 1859 CE LYS B 63 8.776 -15.370 3.464 1.00 0.00 C ATOM 1860 NZ LYS B 63 9.393 -16.162 4.547 1.00 0.00 N ATOM 0 H LYS B 63 5.775 -11.411 2.363 1.00 0.00 H new ATOM 0 HA LYS B 63 7.758 -11.620 0.360 1.00 0.00 H new ATOM 0 HB2 LYS B 63 8.580 -13.490 1.625 1.00 0.00 H new ATOM 0 HB3 LYS B 63 8.089 -12.223 2.732 1.00 0.00 H new ATOM 0 HG2 LYS B 63 5.946 -13.428 3.130 1.00 0.00 H new ATOM 0 HG3 LYS B 63 6.485 -14.709 2.062 1.00 0.00 H new ATOM 0 HD2 LYS B 63 7.821 -13.875 4.670 1.00 0.00 H new ATOM 0 HD3 LYS B 63 6.857 -15.317 4.420 1.00 0.00 H new ATOM 0 HE2 LYS B 63 8.510 -16.031 2.640 1.00 0.00 H new ATOM 0 HE3 LYS B 63 9.504 -14.657 3.078 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 10.234 -16.654 4.182 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 9.672 -15.529 5.324 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 8.708 -16.861 4.899 1.00 0.00 H new ATOM 1874 N GLU B 64 5.142 -13.548 0.074 1.00 0.00 N ATOM 1875 CA GLU B 64 4.387 -14.395 -0.810 1.00 0.00 C ATOM 1876 C GLU B 64 4.324 -13.758 -2.179 1.00 0.00 C ATOM 1877 O GLU B 64 4.832 -14.296 -3.140 1.00 0.00 O ATOM 1878 CB GLU B 64 2.973 -14.573 -0.271 1.00 0.00 C ATOM 1879 CG GLU B 64 2.059 -15.350 -1.171 1.00 0.00 C ATOM 1880 CD GLU B 64 2.434 -16.802 -1.281 1.00 0.00 C ATOM 1881 OE1 GLU B 64 1.976 -17.612 -0.462 1.00 0.00 O ATOM 1882 OE2 GLU B 64 3.182 -17.158 -2.202 1.00 0.00 O ATOM 0 H GLU B 64 4.606 -13.217 0.876 1.00 0.00 H new ATOM 0 HA GLU B 64 4.872 -15.369 -0.878 1.00 0.00 H new ATOM 0 HB2 GLU B 64 3.026 -15.076 0.694 1.00 0.00 H new ATOM 0 HB3 GLU B 64 2.538 -13.589 -0.094 1.00 0.00 H new ATOM 0 HG2 GLU B 64 1.038 -15.272 -0.797 1.00 0.00 H new ATOM 0 HG3 GLU B 64 2.070 -14.902 -2.165 1.00 0.00 H new ATOM 1889 N ARG B 65 3.755 -12.567 -2.248 1.00 0.00 N ATOM 1890 CA ARG B 65 3.606 -11.885 -3.521 1.00 0.00 C ATOM 1891 C ARG B 65 4.943 -11.456 -4.081 1.00 0.00 C ATOM 1892 O ARG B 65 5.069 -11.233 -5.262 1.00 0.00 O ATOM 1893 CB ARG B 65 2.632 -10.712 -3.440 1.00 0.00 C ATOM 1894 CG ARG B 65 1.228 -11.139 -3.075 1.00 0.00 C ATOM 1895 CD ARG B 65 0.248 -9.989 -3.128 1.00 0.00 C ATOM 1896 NE ARG B 65 -1.089 -10.418 -2.692 1.00 0.00 N ATOM 1897 CZ ARG B 65 -2.208 -9.694 -2.807 1.00 0.00 C ATOM 1898 NH1 ARG B 65 -2.202 -8.546 -3.490 1.00 0.00 N ATOM 1899 NH2 ARG B 65 -3.348 -10.148 -2.276 1.00 0.00 N ATOM 0 H ARG B 65 3.391 -12.056 -1.444 1.00 0.00 H new ATOM 0 HA ARG B 65 3.173 -12.606 -4.214 1.00 0.00 H new ATOM 0 HB2 ARG B 65 2.993 -9.997 -2.701 1.00 0.00 H new ATOM 0 HB3 ARG B 65 2.612 -10.196 -4.400 1.00 0.00 H new ATOM 0 HG2 ARG B 65 0.901 -11.924 -3.756 1.00 0.00 H new ATOM 0 HG3 ARG B 65 1.229 -11.567 -2.072 1.00 0.00 H new ATOM 0 HD2 ARG B 65 0.599 -9.177 -2.491 1.00 0.00 H new ATOM 0 HD3 ARG B 65 0.195 -9.597 -4.144 1.00 0.00 H new ATOM 0 HE ARG B 65 -1.170 -11.342 -2.268 1.00 0.00 H new ATOM 0 HH11 ARG B 65 -1.341 -8.217 -3.927 1.00 0.00 H new ATOM 0 HH12 ARG B 65 -3.058 -7.998 -3.574 1.00 0.00 H new ATOM 0 HH21 ARG B 65 -3.362 -11.042 -1.786 1.00 0.00 H new ATOM 0 HH22 ARG B 65 -4.204 -9.600 -2.361 1.00 0.00 H new ATOM 1913 N LEU B 66 5.958 -11.413 -3.237 1.00 0.00 N ATOM 1914 CA LEU B 66 7.303 -11.052 -3.700 1.00 0.00 C ATOM 1915 C LEU B 66 7.976 -12.185 -4.485 1.00 0.00 C ATOM 1916 O LEU B 66 9.058 -11.989 -5.053 1.00 0.00 O ATOM 1917 CB LEU B 66 8.222 -10.553 -2.571 1.00 0.00 C ATOM 1918 CG LEU B 66 7.887 -9.181 -1.961 1.00 0.00 C ATOM 1919 CD1 LEU B 66 8.886 -8.824 -0.874 1.00 0.00 C ATOM 1920 CD2 LEU B 66 7.857 -8.093 -3.030 1.00 0.00 C ATOM 0 H LEU B 66 5.888 -11.619 -2.240 1.00 0.00 H new ATOM 0 HA LEU B 66 7.152 -10.215 -4.381 1.00 0.00 H new ATOM 0 HB2 LEU B 66 8.210 -11.293 -1.771 1.00 0.00 H new ATOM 0 HB3 LEU B 66 9.242 -10.515 -2.954 1.00 0.00 H new ATOM 0 HG LEU B 66 6.893 -9.246 -1.518 1.00 0.00 H new ATOM 0 HD11 LEU B 66 8.634 -7.850 -0.454 1.00 0.00 H new ATOM 0 HD12 LEU B 66 8.853 -9.578 -0.088 1.00 0.00 H new ATOM 0 HD13 LEU B 66 9.889 -8.787 -1.299 1.00 0.00 H new ATOM 0 HD21 LEU B 66 7.618 -7.135 -2.568 1.00 0.00 H new ATOM 0 HD22 LEU B 66 8.833 -8.030 -3.512 1.00 0.00 H new ATOM 0 HD23 LEU B 66 7.099 -8.336 -3.775 1.00 0.00 H new ATOM 1932 N ARG B 67 7.348 -13.364 -4.525 1.00 0.00 N ATOM 1933 CA ARG B 67 7.883 -14.482 -5.310 1.00 0.00 C ATOM 1934 C ARG B 67 7.777 -14.130 -6.803 1.00 0.00 C ATOM 1935 O ARG B 67 8.705 -14.364 -7.579 1.00 0.00 O ATOM 1936 CB ARG B 67 7.143 -15.816 -4.976 1.00 0.00 C ATOM 1937 CG ARG B 67 5.697 -15.901 -5.474 1.00 0.00 C ATOM 1938 CD ARG B 67 4.896 -17.005 -4.792 1.00 0.00 C ATOM 1939 NE ARG B 67 5.348 -18.369 -5.082 1.00 0.00 N ATOM 1940 CZ ARG B 67 4.933 -19.462 -4.397 1.00 0.00 C ATOM 1941 NH1 ARG B 67 4.205 -19.323 -3.293 1.00 0.00 N ATOM 1942 NH2 ARG B 67 5.262 -20.680 -4.809 1.00 0.00 N ATOM 0 H ARG B 67 6.480 -13.568 -4.030 1.00 0.00 H new ATOM 0 HA ARG B 67 8.931 -14.640 -5.054 1.00 0.00 H new ATOM 0 HB2 ARG B 67 7.708 -16.644 -5.405 1.00 0.00 H new ATOM 0 HB3 ARG B 67 7.147 -15.954 -3.895 1.00 0.00 H new ATOM 0 HG2 ARG B 67 5.203 -14.944 -5.305 1.00 0.00 H new ATOM 0 HG3 ARG B 67 5.699 -16.073 -6.550 1.00 0.00 H new ATOM 0 HD2 ARG B 67 4.934 -16.847 -3.714 1.00 0.00 H new ATOM 0 HD3 ARG B 67 3.852 -16.913 -5.091 1.00 0.00 H new ATOM 0 HE ARG B 67 6.013 -18.503 -5.843 1.00 0.00 H new ATOM 0 HH11 ARG B 67 3.957 -18.391 -2.959 1.00 0.00 H new ATOM 0 HH12 ARG B 67 3.894 -20.148 -2.780 1.00 0.00 H new ATOM 0 HH21 ARG B 67 5.831 -20.798 -5.647 1.00 0.00 H new ATOM 0 HH22 ARG B 67 4.946 -21.498 -4.288 1.00 0.00 H new ATOM 1956 N ASN B 68 6.656 -13.505 -7.153 1.00 0.00 N ATOM 1957 CA ASN B 68 6.334 -13.022 -8.498 1.00 0.00 C ATOM 1958 C ASN B 68 5.242 -11.974 -8.352 1.00 0.00 C ATOM 1959 O ASN B 68 4.049 -12.314 -8.286 1.00 0.00 O ATOM 1960 CB ASN B 68 5.824 -14.131 -9.467 1.00 0.00 C ATOM 1961 CG ASN B 68 6.846 -15.188 -9.862 1.00 0.00 C ATOM 1962 OD1 ASN B 68 6.941 -16.245 -9.237 1.00 0.00 O ATOM 1963 ND2 ASN B 68 7.622 -14.913 -10.878 1.00 0.00 N ATOM 0 H ASN B 68 5.914 -13.312 -6.480 1.00 0.00 H new ATOM 0 HA ASN B 68 7.253 -12.630 -8.935 1.00 0.00 H new ATOM 0 HB2 ASN B 68 4.974 -14.631 -9.002 1.00 0.00 H new ATOM 0 HB3 ASN B 68 5.455 -13.653 -10.374 1.00 0.00 H new ATOM 0 HD21 ASN B 68 8.332 -15.583 -11.174 1.00 0.00 H new ATOM 0 HD22 ASN B 68 7.518 -14.028 -11.375 1.00 0.00 H new ATOM 1970 N PRO B 69 5.620 -10.710 -8.178 1.00 0.00 N ATOM 1971 CA PRO B 69 4.665 -9.629 -7.995 1.00 0.00 C ATOM 1972 C PRO B 69 4.084 -9.095 -9.306 1.00 0.00 C ATOM 1973 O PRO B 69 2.881 -9.232 -9.550 1.00 0.00 O ATOM 1974 CB PRO B 69 5.459 -8.535 -7.269 1.00 0.00 C ATOM 1975 CG PRO B 69 6.900 -8.965 -7.277 1.00 0.00 C ATOM 1976 CD PRO B 69 7.004 -10.238 -8.085 1.00 0.00 C ATOM 0 HA PRO B 69 3.796 -9.977 -7.438 1.00 0.00 H new ATOM 0 HB2 PRO B 69 5.340 -7.574 -7.770 1.00 0.00 H new ATOM 0 HB3 PRO B 69 5.099 -8.409 -6.248 1.00 0.00 H new ATOM 0 HG2 PRO B 69 7.527 -8.186 -7.711 1.00 0.00 H new ATOM 0 HG3 PRO B 69 7.254 -9.130 -6.259 1.00 0.00 H new ATOM 0 HD2 PRO B 69 7.430 -10.052 -9.071 1.00 0.00 H new ATOM 0 HD3 PRO B 69 7.644 -10.971 -7.595 1.00 0.00 H new ATOM 1984 N LYS B 70 4.962 -8.562 -10.165 1.00 0.00 N ATOM 1985 CA LYS B 70 4.583 -7.879 -11.409 1.00 0.00 C ATOM 1986 C LYS B 70 3.897 -6.551 -11.099 1.00 0.00 C ATOM 1987 O LYS B 70 2.678 -6.487 -10.983 1.00 0.00 O ATOM 1988 CB LYS B 70 3.715 -8.725 -12.394 1.00 0.00 C ATOM 1989 CG LYS B 70 4.411 -9.888 -13.115 1.00 0.00 C ATOM 1990 CD LYS B 70 4.909 -10.970 -12.173 1.00 0.00 C ATOM 1991 CE LYS B 70 5.411 -12.182 -12.936 1.00 0.00 C ATOM 1992 NZ LYS B 70 4.323 -12.874 -13.667 1.00 0.00 N ATOM 0 H LYS B 70 5.970 -8.593 -10.013 1.00 0.00 H new ATOM 0 HA LYS B 70 5.522 -7.707 -11.936 1.00 0.00 H new ATOM 0 HB2 LYS B 70 2.869 -9.129 -11.838 1.00 0.00 H new ATOM 0 HB3 LYS B 70 3.308 -8.053 -13.150 1.00 0.00 H new ATOM 0 HG2 LYS B 70 3.717 -10.330 -13.830 1.00 0.00 H new ATOM 0 HG3 LYS B 70 5.253 -9.499 -13.687 1.00 0.00 H new ATOM 0 HD2 LYS B 70 5.711 -10.572 -11.551 1.00 0.00 H new ATOM 0 HD3 LYS B 70 4.104 -11.269 -11.502 1.00 0.00 H new ATOM 0 HE2 LYS B 70 6.181 -11.871 -13.643 1.00 0.00 H new ATOM 0 HE3 LYS B 70 5.879 -12.879 -12.241 1.00 0.00 H new ATOM 0 HZ1 LYS B 70 4.629 -13.837 -13.914 1.00 0.00 H new ATOM 0 HZ2 LYS B 70 3.477 -12.923 -13.065 1.00 0.00 H new ATOM 0 HZ3 LYS B 70 4.099 -12.348 -14.536 1.00 0.00 H new ATOM 2006 N PRO B 71 4.684 -5.488 -10.880 1.00 0.00 N ATOM 2007 CA PRO B 71 4.139 -4.172 -10.616 1.00 0.00 C ATOM 2008 C PRO B 71 3.790 -3.442 -11.899 1.00 0.00 C ATOM 2009 O PRO B 71 4.302 -3.768 -12.979 1.00 0.00 O ATOM 2010 CB PRO B 71 5.277 -3.453 -9.897 1.00 0.00 C ATOM 2011 CG PRO B 71 6.528 -4.092 -10.403 1.00 0.00 C ATOM 2012 CD PRO B 71 6.163 -5.490 -10.848 1.00 0.00 C ATOM 0 HA PRO B 71 3.215 -4.218 -10.039 1.00 0.00 H new ATOM 0 HB2 PRO B 71 5.266 -2.385 -10.113 1.00 0.00 H new ATOM 0 HB3 PRO B 71 5.190 -3.561 -8.816 1.00 0.00 H new ATOM 0 HG2 PRO B 71 6.945 -3.520 -11.232 1.00 0.00 H new ATOM 0 HG3 PRO B 71 7.288 -4.122 -9.623 1.00 0.00 H new ATOM 0 HD2 PRO B 71 6.582 -5.718 -11.828 1.00 0.00 H new ATOM 0 HD3 PRO B 71 6.545 -6.240 -10.156 1.00 0.00 H new ATOM 2020 N VAL B 72 2.898 -2.506 -11.798 1.00 0.00 N ATOM 2021 CA VAL B 72 2.518 -1.688 -12.917 1.00 0.00 C ATOM 2022 C VAL B 72 2.767 -0.231 -12.548 1.00 0.00 C ATOM 2023 O VAL B 72 2.256 0.233 -11.518 1.00 0.00 O ATOM 2024 CB VAL B 72 1.009 -1.873 -13.278 1.00 0.00 C ATOM 2025 CG1 VAL B 72 0.637 -1.081 -14.526 1.00 0.00 C ATOM 2026 CG2 VAL B 72 0.651 -3.346 -13.452 1.00 0.00 C ATOM 0 H VAL B 72 2.407 -2.283 -10.932 1.00 0.00 H new ATOM 0 HA VAL B 72 3.109 -1.983 -13.784 1.00 0.00 H new ATOM 0 HB VAL B 72 0.429 -1.483 -12.442 1.00 0.00 H new ATOM 0 HG11 VAL B 72 -0.419 -1.231 -14.751 1.00 0.00 H new ATOM 0 HG12 VAL B 72 0.825 -0.021 -14.354 1.00 0.00 H new ATOM 0 HG13 VAL B 72 1.239 -1.424 -15.367 1.00 0.00 H new ATOM 0 HG21 VAL B 72 -0.406 -3.436 -13.702 1.00 0.00 H new ATOM 0 HG22 VAL B 72 1.252 -3.774 -14.254 1.00 0.00 H new ATOM 0 HG23 VAL B 72 0.851 -3.881 -12.524 1.00 0.00 H new ATOM 2036 N ARG B 73 3.581 0.463 -13.349 1.00 0.00 N ATOM 2037 CA ARG B 73 3.846 1.882 -13.155 1.00 0.00 C ATOM 2038 C ARG B 73 2.574 2.678 -13.327 1.00 0.00 C ATOM 2039 O ARG B 73 2.046 2.787 -14.445 1.00 0.00 O ATOM 2040 CB ARG B 73 4.887 2.404 -14.161 1.00 0.00 C ATOM 2041 CG ARG B 73 6.344 2.083 -13.859 1.00 0.00 C ATOM 2042 CD ARG B 73 6.767 2.697 -12.541 1.00 0.00 C ATOM 2043 NE ARG B 73 8.224 2.691 -12.347 1.00 0.00 N ATOM 2044 CZ ARG B 73 8.829 3.111 -11.234 1.00 0.00 C ATOM 2045 NH1 ARG B 73 8.141 3.205 -10.102 1.00 0.00 N ATOM 2046 NH2 ARG B 73 10.142 3.337 -11.229 1.00 0.00 N ATOM 0 H ARG B 73 4.070 0.054 -14.145 1.00 0.00 H new ATOM 0 HA ARG B 73 4.236 2.003 -12.144 1.00 0.00 H new ATOM 0 HB2 ARG B 73 4.645 1.999 -15.144 1.00 0.00 H new ATOM 0 HB3 ARG B 73 4.783 3.487 -14.228 1.00 0.00 H new ATOM 0 HG2 ARG B 73 6.483 1.003 -13.824 1.00 0.00 H new ATOM 0 HG3 ARG B 73 6.978 2.460 -14.661 1.00 0.00 H new ATOM 0 HD2 ARG B 73 6.403 3.723 -12.491 1.00 0.00 H new ATOM 0 HD3 ARG B 73 6.295 2.152 -11.724 1.00 0.00 H new ATOM 0 HE ARG B 73 8.808 2.345 -13.109 1.00 0.00 H new ATOM 0 HH11 ARG B 73 7.152 2.956 -10.084 1.00 0.00 H new ATOM 0 HH12 ARG B 73 8.602 3.526 -9.250 1.00 0.00 H new ATOM 0 HH21 ARG B 73 10.688 3.189 -12.078 1.00 0.00 H new ATOM 0 HH22 ARG B 73 10.601 3.658 -10.377 1.00 0.00 H new ATOM 2060 N VAL B 74 2.078 3.223 -12.258 1.00 0.00 N ATOM 2061 CA VAL B 74 0.874 3.995 -12.303 1.00 0.00 C ATOM 2062 C VAL B 74 1.059 5.353 -11.632 1.00 0.00 C ATOM 2063 O VAL B 74 2.136 5.679 -11.086 1.00 0.00 O ATOM 2064 CB VAL B 74 -0.365 3.256 -11.696 1.00 0.00 C ATOM 2065 CG1 VAL B 74 -0.730 2.018 -12.505 1.00 0.00 C ATOM 2066 CG2 VAL B 74 -0.131 2.885 -10.249 1.00 0.00 C ATOM 0 H VAL B 74 2.496 3.145 -11.331 1.00 0.00 H new ATOM 0 HA VAL B 74 0.663 4.145 -13.362 1.00 0.00 H new ATOM 0 HB VAL B 74 -1.203 3.951 -11.741 1.00 0.00 H new ATOM 0 HG11 VAL B 74 -1.594 1.531 -12.054 1.00 0.00 H new ATOM 0 HG12 VAL B 74 -0.970 2.309 -13.528 1.00 0.00 H new ATOM 0 HG13 VAL B 74 0.113 1.327 -12.513 1.00 0.00 H new ATOM 0 HG21 VAL B 74 -1.010 2.373 -9.858 1.00 0.00 H new ATOM 0 HG22 VAL B 74 0.734 2.226 -10.178 1.00 0.00 H new ATOM 0 HG23 VAL B 74 0.052 3.788 -9.667 1.00 0.00 H new ATOM 2076 N THR B 75 0.037 6.135 -11.722 1.00 0.00 N ATOM 2077 CA THR B 75 -0.032 7.440 -11.162 1.00 0.00 C ATOM 2078 C THR B 75 -1.355 7.546 -10.428 1.00 0.00 C ATOM 2079 O THR B 75 -2.266 6.765 -10.697 1.00 0.00 O ATOM 2080 CB THR B 75 0.027 8.527 -12.282 1.00 0.00 C ATOM 2081 OG1 THR B 75 -0.929 8.230 -13.314 1.00 0.00 O ATOM 2082 CG2 THR B 75 1.413 8.638 -12.895 1.00 0.00 C ATOM 0 H THR B 75 -0.816 5.866 -12.213 1.00 0.00 H new ATOM 0 HA THR B 75 0.811 7.603 -10.490 1.00 0.00 H new ATOM 0 HB THR B 75 -0.214 9.483 -11.816 1.00 0.00 H new ATOM 0 HG1 THR B 75 -0.684 7.389 -13.754 1.00 0.00 H new ATOM 0 HG21 THR B 75 1.408 9.405 -13.669 1.00 0.00 H new ATOM 0 HG22 THR B 75 2.132 8.907 -12.122 1.00 0.00 H new ATOM 0 HG23 THR B 75 1.694 7.681 -13.335 1.00 0.00 H new ATOM 2090 N LEU B 76 -1.480 8.484 -9.534 1.00 0.00 N ATOM 2091 CA LEU B 76 -2.746 8.689 -8.837 1.00 0.00 C ATOM 2092 C LEU B 76 -3.735 9.324 -9.769 1.00 0.00 C ATOM 2093 O LEU B 76 -4.937 9.192 -9.607 1.00 0.00 O ATOM 2094 CB LEU B 76 -2.550 9.552 -7.609 1.00 0.00 C ATOM 2095 CG LEU B 76 -1.723 8.929 -6.511 1.00 0.00 C ATOM 2096 CD1 LEU B 76 -1.439 9.938 -5.435 1.00 0.00 C ATOM 2097 CD2 LEU B 76 -2.438 7.735 -5.912 1.00 0.00 C ATOM 0 H LEU B 76 -0.733 9.123 -9.262 1.00 0.00 H new ATOM 0 HA LEU B 76 -3.129 7.722 -8.511 1.00 0.00 H new ATOM 0 HB2 LEU B 76 -2.077 10.486 -7.913 1.00 0.00 H new ATOM 0 HB3 LEU B 76 -3.529 9.807 -7.204 1.00 0.00 H new ATOM 0 HG LEU B 76 -0.782 8.593 -6.946 1.00 0.00 H new ATOM 0 HD11 LEU B 76 -0.842 9.474 -4.650 1.00 0.00 H new ATOM 0 HD12 LEU B 76 -0.890 10.778 -5.860 1.00 0.00 H new ATOM 0 HD13 LEU B 76 -2.379 10.294 -5.013 1.00 0.00 H new ATOM 0 HD21 LEU B 76 -1.824 7.302 -5.123 1.00 0.00 H new ATOM 0 HD22 LEU B 76 -3.393 8.054 -5.495 1.00 0.00 H new ATOM 0 HD23 LEU B 76 -2.612 6.989 -6.687 1.00 0.00 H new ATOM 2109 N ASP B 77 -3.197 9.987 -10.766 1.00 0.00 N ATOM 2110 CA ASP B 77 -3.968 10.647 -11.798 1.00 0.00 C ATOM 2111 C ASP B 77 -4.800 9.651 -12.601 1.00 0.00 C ATOM 2112 O ASP B 77 -5.946 9.937 -12.973 1.00 0.00 O ATOM 2113 CB ASP B 77 -3.023 11.404 -12.733 1.00 0.00 C ATOM 2114 CG ASP B 77 -3.736 12.043 -13.896 1.00 0.00 C ATOM 2115 OD1 ASP B 77 -4.311 13.139 -13.725 1.00 0.00 O ATOM 2116 OD2 ASP B 77 -3.718 11.473 -15.009 1.00 0.00 O ATOM 0 H ASP B 77 -2.189 10.086 -10.886 1.00 0.00 H new ATOM 0 HA ASP B 77 -4.655 11.343 -11.317 1.00 0.00 H new ATOM 0 HB2 ASP B 77 -2.500 12.174 -12.167 1.00 0.00 H new ATOM 0 HB3 ASP B 77 -2.266 10.717 -13.111 1.00 0.00 H new ATOM 2121 N GLU B 78 -4.250 8.472 -12.829 1.00 0.00 N ATOM 2122 CA GLU B 78 -4.918 7.491 -13.662 1.00 0.00 C ATOM 2123 C GLU B 78 -5.821 6.560 -12.863 1.00 0.00 C ATOM 2124 O GLU B 78 -6.664 5.877 -13.449 1.00 0.00 O ATOM 2125 CB GLU B 78 -3.912 6.690 -14.485 1.00 0.00 C ATOM 2126 CG GLU B 78 -2.923 5.893 -13.661 1.00 0.00 C ATOM 2127 CD GLU B 78 -1.879 5.241 -14.507 1.00 0.00 C ATOM 2128 OE1 GLU B 78 -2.141 4.160 -15.075 1.00 0.00 O ATOM 2129 OE2 GLU B 78 -0.775 5.833 -14.642 1.00 0.00 O ATOM 0 H GLU B 78 -3.350 8.173 -12.452 1.00 0.00 H new ATOM 0 HA GLU B 78 -5.559 8.050 -14.344 1.00 0.00 H new ATOM 0 HB2 GLU B 78 -4.456 6.007 -15.137 1.00 0.00 H new ATOM 0 HB3 GLU B 78 -3.361 7.375 -15.129 1.00 0.00 H new ATOM 0 HG2 GLU B 78 -2.443 6.551 -12.937 1.00 0.00 H new ATOM 0 HG3 GLU B 78 -3.457 5.130 -13.094 1.00 0.00 H new ATOM 2136 N LEU B 79 -5.652 6.531 -11.544 1.00 0.00 N ATOM 2137 CA LEU B 79 -6.451 5.648 -10.711 1.00 0.00 C ATOM 2138 C LEU B 79 -7.888 6.135 -10.658 1.00 0.00 C ATOM 2139 O LEU B 79 -8.752 5.537 -11.320 1.00 0.00 O ATOM 2140 CB LEU B 79 -5.881 5.528 -9.290 1.00 0.00 C ATOM 2141 CG LEU B 79 -4.427 5.056 -9.163 1.00 0.00 C ATOM 2142 CD1 LEU B 79 -4.068 4.842 -7.710 1.00 0.00 C ATOM 2143 CD2 LEU B 79 -4.175 3.793 -9.968 1.00 0.00 C ATOM 2144 OXT LEU B 79 -8.150 7.161 -10.002 1.00 0.00 O ATOM 0 H LEU B 79 -4.976 7.103 -11.037 1.00 0.00 H new ATOM 0 HA LEU B 79 -6.421 4.656 -11.162 1.00 0.00 H new ATOM 0 HB2 LEU B 79 -5.965 6.502 -8.808 1.00 0.00 H new ATOM 0 HB3 LEU B 79 -6.512 4.839 -8.729 1.00 0.00 H new ATOM 0 HG LEU B 79 -3.787 5.838 -9.572 1.00 0.00 H new ATOM 0 HD11 LEU B 79 -3.033 4.507 -7.636 1.00 0.00 H new ATOM 0 HD12 LEU B 79 -4.186 5.778 -7.164 1.00 0.00 H new ATOM 0 HD13 LEU B 79 -4.725 4.086 -7.280 1.00 0.00 H new ATOM 0 HD21 LEU B 79 -3.134 3.490 -9.853 1.00 0.00 H new ATOM 0 HD22 LEU B 79 -4.827 2.997 -9.609 1.00 0.00 H new ATOM 0 HD23 LEU B 79 -4.383 3.985 -11.021 1.00 0.00 H new