USER MOD reduce.3.24.130724 H: found=0, std=0, add=1057, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 1057 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 100 MET CE :methyl -161:sc= -0.198 (180deg=-0.784) USER MOD Set 1.2: A 108 THR OG1 : rot 81:sc= 1.2 USER MOD Set 2.1: A 19 TYR OH : rot 15:sc= -1.41! USER MOD Set 2.2: A 102 THR OG1 : rot 168:sc= -0.0463 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -179:sc= 0.65 (180deg=0.525) USER MOD Single : A 3 GLN : amide:sc= -0.245 K(o=-0.24,f=-1.5) USER MOD Single : A 5 SER OG : rot 1:sc= 0.232 USER MOD Single : A 9 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 13 THR OG1 : rot -120:sc= -0.251 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= -0.196 USER MOD Single : A 31 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 32 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 SER OG : rot -118:sc= -0.655! USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 174:sc= 0.484 (180deg=0.31) USER MOD Single : A 52 GLN : amide:sc= 0.572 K(o=0.57,f=-6.6!) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 173:sc= 1.18 USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 ASN : amide:sc= 0.889 K(o=0.89,f=0) USER MOD Single : A 66 ASN : amide:sc= 0 X(o=0,f=-0.0082) USER MOD Single : A 70 THR OG1 : rot -90:sc= -0.0541 USER MOD Single : A 75 THR OG1 : rot 96:sc= 1.28 USER MOD Single : A 85 GLN : amide:sc= -1.2 K(o=-1.2,f=-2.7) USER MOD Single : A 94 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 109 TYR OH : rot -162:sc= 1.16 USER MOD Single : A 110 ASN : amide:sc= 0.562 K(o=0.56,f=-0.011) USER MOD Single : A 112 MET CE :methyl -134:sc= -2.05 (180deg=-5.9!) USER MOD Single : A 130 HIS : no HD1:sc= -0.414 X(o=-0.41,f=-0.62) USER MOD Single : A 131 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 132 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 133 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 134 HIS : no HD1:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 135 HIS : no HD1:sc= -0.376 X(o=-0.38,f=-0.44) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -24.588 0.413 -26.119 1.00 0.00 N ATOM 2 CA MET A 1 -24.363 1.870 -26.264 1.00 0.00 C ATOM 3 C MET A 1 -25.157 2.643 -25.216 1.00 0.00 C ATOM 4 O MET A 1 -25.244 3.873 -25.278 1.00 0.00 O ATOM 5 CB MET A 1 -24.767 2.344 -27.671 1.00 0.00 C ATOM 6 CG MET A 1 -26.268 2.285 -27.947 1.00 0.00 C ATOM 7 SD MET A 1 -26.923 0.603 -27.964 1.00 0.00 S ATOM 8 CE MET A 1 -28.659 0.922 -28.285 1.00 0.00 C ATOM 0 H1 MET A 1 -24.026 -0.097 -26.830 1.00 0.00 H new ATOM 0 H2 MET A 1 -24.299 0.110 -25.167 1.00 0.00 H new ATOM 0 H3 MET A 1 -25.597 0.202 -26.258 1.00 0.00 H new ATOM 0 HA MET A 1 -23.300 2.062 -26.117 1.00 0.00 H new ATOM 0 HB2 MET A 1 -24.424 3.369 -27.809 1.00 0.00 H new ATOM 0 HB3 MET A 1 -24.249 1.733 -28.410 1.00 0.00 H new ATOM 0 HG2 MET A 1 -26.793 2.865 -27.188 1.00 0.00 H new ATOM 0 HG3 MET A 1 -26.473 2.757 -28.908 1.00 0.00 H new ATOM 0 HE1 MET A 1 -29.201 -0.023 -28.325 1.00 0.00 H new ATOM 0 HE2 MET A 1 -29.069 1.542 -27.488 1.00 0.00 H new ATOM 0 HE3 MET A 1 -28.763 1.441 -29.238 1.00 0.00 H new ATOM 20 N ALA A 2 -25.732 1.913 -24.253 1.00 0.00 N ATOM 21 CA ALA A 2 -26.602 2.501 -23.237 1.00 0.00 C ATOM 22 C ALA A 2 -27.763 3.249 -23.891 1.00 0.00 C ATOM 23 O ALA A 2 -28.082 3.013 -25.059 1.00 0.00 O ATOM 24 CB ALA A 2 -25.806 3.416 -22.314 1.00 0.00 C ATOM 0 H ALA A 2 -25.606 0.905 -24.159 1.00 0.00 H new ATOM 0 HA ALA A 2 -27.021 1.697 -22.632 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -26.471 3.844 -21.564 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -25.023 2.841 -21.819 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -25.354 4.217 -22.898 1.00 0.00 H new ATOM 30 N GLN A 3 -28.400 4.142 -23.149 1.00 0.00 N ATOM 31 CA GLN A 3 -29.521 4.898 -23.685 1.00 0.00 C ATOM 32 C GLN A 3 -29.022 6.101 -24.488 1.00 0.00 C ATOM 33 O GLN A 3 -29.060 7.242 -24.021 1.00 0.00 O ATOM 34 CB GLN A 3 -30.471 5.335 -22.561 1.00 0.00 C ATOM 35 CG GLN A 3 -31.707 6.079 -23.045 1.00 0.00 C ATOM 36 CD GLN A 3 -32.469 5.329 -24.123 1.00 0.00 C ATOM 37 OE1 GLN A 3 -32.208 5.497 -25.312 1.00 0.00 O ATOM 38 NE2 GLN A 3 -33.419 4.504 -23.716 1.00 0.00 N ATOM 0 H GLN A 3 -28.162 4.360 -22.181 1.00 0.00 H new ATOM 0 HA GLN A 3 -30.082 4.252 -24.360 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -30.786 4.453 -22.003 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -29.925 5.973 -21.866 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -32.370 6.260 -22.199 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -31.409 7.054 -23.430 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -33.605 4.392 -22.719 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -33.966 3.979 -24.399 1.00 0.00 H new ATOM 47 N ARG A 4 -28.490 5.805 -25.677 1.00 0.00 N ATOM 48 CA ARG A 4 -28.066 6.817 -26.651 1.00 0.00 C ATOM 49 C ARG A 4 -26.967 7.739 -26.117 1.00 0.00 C ATOM 50 O ARG A 4 -26.647 8.755 -26.736 1.00 0.00 O ATOM 51 CB ARG A 4 -29.263 7.648 -27.117 1.00 0.00 C ATOM 52 CG ARG A 4 -30.302 6.837 -27.876 1.00 0.00 C ATOM 53 CD ARG A 4 -31.396 7.724 -28.445 1.00 0.00 C ATOM 54 NE ARG A 4 -30.851 8.763 -29.318 1.00 0.00 N ATOM 55 CZ ARG A 4 -30.723 8.645 -30.638 1.00 0.00 C ATOM 56 NH1 ARG A 4 -31.106 7.533 -31.257 1.00 0.00 N ATOM 57 NH2 ARG A 4 -30.212 9.647 -31.339 1.00 0.00 N ATOM 0 H ARG A 4 -28.340 4.847 -25.994 1.00 0.00 H new ATOM 0 HA ARG A 4 -27.644 6.273 -27.496 1.00 0.00 H new ATOM 0 HB2 ARG A 4 -29.735 8.109 -26.250 1.00 0.00 H new ATOM 0 HB3 ARG A 4 -28.908 8.457 -27.755 1.00 0.00 H new ATOM 0 HG2 ARG A 4 -29.818 6.291 -28.685 1.00 0.00 H new ATOM 0 HG3 ARG A 4 -30.743 6.095 -27.210 1.00 0.00 H new ATOM 0 HD2 ARG A 4 -32.105 7.114 -29.004 1.00 0.00 H new ATOM 0 HD3 ARG A 4 -31.950 8.188 -27.629 1.00 0.00 H new ATOM 0 HE ARG A 4 -30.549 9.637 -28.887 1.00 0.00 H new ATOM 0 HH11 ARG A 4 -31.502 6.761 -30.720 1.00 0.00 H new ATOM 0 HH12 ARG A 4 -31.004 7.452 -32.269 1.00 0.00 H new ATOM 0 HH21 ARG A 4 -29.919 10.503 -30.867 1.00 0.00 H new ATOM 0 HH22 ARG A 4 -30.111 9.563 -32.351 1.00 0.00 H new ATOM 71 N SER A 5 -26.382 7.382 -24.986 1.00 0.00 N ATOM 72 CA SER A 5 -25.332 8.182 -24.373 1.00 0.00 C ATOM 73 C SER A 5 -24.504 7.321 -23.434 1.00 0.00 C ATOM 74 O SER A 5 -25.016 6.363 -22.857 1.00 0.00 O ATOM 75 CB SER A 5 -25.933 9.365 -23.604 1.00 0.00 C ATOM 76 OG SER A 5 -26.624 10.247 -24.477 1.00 0.00 O ATOM 0 H SER A 5 -26.619 6.535 -24.469 1.00 0.00 H new ATOM 0 HA SER A 5 -24.689 8.572 -25.162 1.00 0.00 H new ATOM 0 HB2 SER A 5 -26.617 8.996 -22.840 1.00 0.00 H new ATOM 0 HB3 SER A 5 -25.141 9.907 -23.088 1.00 0.00 H new ATOM 0 HG SER A 5 -26.585 9.899 -25.392 1.00 0.00 H new ATOM 82 N GLU A 6 -23.227 7.653 -23.296 1.00 0.00 N ATOM 83 CA GLU A 6 -22.349 6.926 -22.392 1.00 0.00 C ATOM 84 C GLU A 6 -22.739 7.185 -20.945 1.00 0.00 C ATOM 85 O GLU A 6 -23.325 8.221 -20.625 1.00 0.00 O ATOM 86 CB GLU A 6 -20.890 7.328 -22.601 1.00 0.00 C ATOM 87 CG GLU A 6 -20.350 7.024 -23.984 1.00 0.00 C ATOM 88 CD GLU A 6 -18.866 7.296 -24.083 1.00 0.00 C ATOM 89 OE1 GLU A 6 -18.484 8.466 -24.306 1.00 0.00 O ATOM 90 OE2 GLU A 6 -18.073 6.348 -23.918 1.00 0.00 O ATOM 0 H GLU A 6 -22.778 8.419 -23.798 1.00 0.00 H new ATOM 0 HA GLU A 6 -22.457 5.864 -22.612 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -20.789 8.397 -22.412 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -20.275 6.814 -21.863 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -20.545 5.980 -24.228 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -20.880 7.628 -24.721 1.00 0.00 H new ATOM 97 N ILE A 7 -22.415 6.240 -20.076 1.00 0.00 N ATOM 98 CA ILE A 7 -22.696 6.388 -18.660 1.00 0.00 C ATOM 99 C ILE A 7 -21.702 7.353 -18.014 1.00 0.00 C ATOM 100 O ILE A 7 -20.540 7.424 -18.422 1.00 0.00 O ATOM 101 CB ILE A 7 -22.699 5.019 -17.930 1.00 0.00 C ATOM 102 CG1 ILE A 7 -21.463 4.176 -18.279 1.00 0.00 C ATOM 103 CG2 ILE A 7 -23.970 4.252 -18.265 1.00 0.00 C ATOM 104 CD1 ILE A 7 -20.239 4.485 -17.441 1.00 0.00 C ATOM 0 H ILE A 7 -21.958 5.364 -20.328 1.00 0.00 H new ATOM 0 HA ILE A 7 -23.697 6.808 -18.562 1.00 0.00 H new ATOM 0 HB ILE A 7 -22.665 5.218 -16.859 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -21.712 3.121 -18.161 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -21.218 4.330 -19.330 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -23.963 3.292 -17.748 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -24.838 4.829 -17.947 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -24.021 4.084 -19.341 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -19.413 3.845 -17.753 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -19.960 5.530 -17.576 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -20.462 4.302 -16.390 1.00 0.00 H new ATOM 116 N PRO A 8 -22.160 8.125 -17.020 1.00 0.00 N ATOM 117 CA PRO A 8 -21.332 9.130 -16.351 1.00 0.00 C ATOM 118 C PRO A 8 -20.088 8.533 -15.702 1.00 0.00 C ATOM 119 O PRO A 8 -20.158 7.525 -14.995 1.00 0.00 O ATOM 120 CB PRO A 8 -22.258 9.726 -15.282 1.00 0.00 C ATOM 121 CG PRO A 8 -23.368 8.743 -15.130 1.00 0.00 C ATOM 122 CD PRO A 8 -23.523 8.087 -16.472 1.00 0.00 C ATOM 0 HA PRO A 8 -20.955 9.866 -17.061 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -21.729 9.871 -14.340 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -22.636 10.701 -15.588 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -23.136 8.007 -14.360 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -24.291 9.239 -14.829 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -23.893 7.066 -16.381 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -24.227 8.626 -17.105 1.00 0.00 H new ATOM 130 N HIS A 9 -18.950 9.155 -15.959 1.00 0.00 N ATOM 131 CA HIS A 9 -17.699 8.741 -15.348 1.00 0.00 C ATOM 132 C HIS A 9 -17.339 9.711 -14.238 1.00 0.00 C ATOM 133 O HIS A 9 -17.539 10.916 -14.375 1.00 0.00 O ATOM 134 CB HIS A 9 -16.566 8.691 -16.377 1.00 0.00 C ATOM 135 CG HIS A 9 -16.788 7.706 -17.482 1.00 0.00 C ATOM 136 ND1 HIS A 9 -16.671 6.344 -17.315 1.00 0.00 N ATOM 137 CD2 HIS A 9 -17.114 7.894 -18.779 1.00 0.00 C ATOM 138 CE1 HIS A 9 -16.917 5.739 -18.460 1.00 0.00 C ATOM 139 NE2 HIS A 9 -17.187 6.656 -19.370 1.00 0.00 N ATOM 0 H HIS A 9 -18.867 9.952 -16.590 1.00 0.00 H new ATOM 0 HA HIS A 9 -17.829 7.738 -14.942 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -16.438 9.683 -16.809 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -15.636 8.444 -15.866 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -17.286 8.844 -19.263 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -16.900 4.672 -18.626 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -17.412 6.476 -20.348 1.00 0.00 H new ATOM 148 N PHE A 10 -16.828 9.185 -13.141 1.00 0.00 N ATOM 149 CA PHE A 10 -16.455 10.013 -12.004 1.00 0.00 C ATOM 150 C PHE A 10 -15.053 10.578 -12.203 1.00 0.00 C ATOM 151 O PHE A 10 -14.064 9.847 -12.120 1.00 0.00 O ATOM 152 CB PHE A 10 -16.532 9.193 -10.714 1.00 0.00 C ATOM 153 CG PHE A 10 -17.859 8.513 -10.533 1.00 0.00 C ATOM 154 CD1 PHE A 10 -18.985 9.241 -10.185 1.00 0.00 C ATOM 155 CD2 PHE A 10 -17.983 7.146 -10.728 1.00 0.00 C ATOM 156 CE1 PHE A 10 -20.210 8.619 -10.033 1.00 0.00 C ATOM 157 CE2 PHE A 10 -19.204 6.518 -10.575 1.00 0.00 C ATOM 158 CZ PHE A 10 -20.319 7.255 -10.229 1.00 0.00 C ATOM 0 H PHE A 10 -16.661 8.187 -13.011 1.00 0.00 H new ATOM 0 HA PHE A 10 -17.152 10.848 -11.926 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -15.742 8.442 -10.719 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -16.345 9.847 -9.862 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -18.905 10.307 -10.031 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -17.115 6.565 -11.003 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -21.081 9.198 -9.762 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -19.286 5.452 -10.726 1.00 0.00 H new ATOM 0 HZ PHE A 10 -21.275 6.767 -10.112 1.00 0.00 H new ATOM 168 N PRO A 11 -14.951 11.885 -12.484 1.00 0.00 N ATOM 169 CA PRO A 11 -13.692 12.534 -12.804 1.00 0.00 C ATOM 170 C PRO A 11 -12.951 13.007 -11.562 1.00 0.00 C ATOM 171 O PRO A 11 -13.295 14.039 -10.982 1.00 0.00 O ATOM 172 CB PRO A 11 -14.117 13.733 -13.667 1.00 0.00 C ATOM 173 CG PRO A 11 -15.615 13.821 -13.568 1.00 0.00 C ATOM 174 CD PRO A 11 -16.052 12.847 -12.505 1.00 0.00 C ATOM 0 HA PRO A 11 -13.001 11.856 -13.304 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -13.650 14.652 -13.312 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -13.804 13.596 -14.702 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -15.924 14.834 -13.311 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -16.078 13.579 -14.525 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -16.184 13.334 -11.539 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -17.001 12.372 -12.755 1.00 0.00 H new ATOM 182 N ARG A 12 -11.947 12.229 -11.155 1.00 0.00 N ATOM 183 CA ARG A 12 -11.121 12.549 -9.994 1.00 0.00 C ATOM 184 C ARG A 12 -11.969 12.604 -8.720 1.00 0.00 C ATOM 185 O ARG A 12 -12.514 13.645 -8.350 1.00 0.00 O ATOM 186 CB ARG A 12 -10.359 13.864 -10.235 1.00 0.00 C ATOM 187 CG ARG A 12 -9.401 14.266 -9.121 1.00 0.00 C ATOM 188 CD ARG A 12 -10.018 15.315 -8.209 1.00 0.00 C ATOM 189 NE ARG A 12 -10.403 16.520 -8.946 1.00 0.00 N ATOM 190 CZ ARG A 12 -11.593 17.109 -8.846 1.00 0.00 C ATOM 191 NH1 ARG A 12 -12.542 16.573 -8.089 1.00 0.00 N ATOM 192 NH2 ARG A 12 -11.837 18.219 -9.529 1.00 0.00 N ATOM 0 H ARG A 12 -11.685 11.361 -11.622 1.00 0.00 H new ATOM 0 HA ARG A 12 -10.385 11.757 -9.853 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -9.796 13.775 -11.164 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -11.084 14.666 -10.377 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -9.131 13.387 -8.536 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -8.480 14.655 -9.554 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -10.895 14.896 -7.715 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -9.307 15.580 -7.427 1.00 0.00 H new ATOM 0 HE ARG A 12 -9.716 16.935 -9.576 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -12.361 15.707 -7.581 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -13.452 17.027 -8.015 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -11.115 18.618 -10.128 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -12.747 18.673 -9.455 1.00 0.00 H new ATOM 206 N THR A 13 -12.097 11.459 -8.071 1.00 0.00 N ATOM 207 CA THR A 13 -12.889 11.349 -6.859 1.00 0.00 C ATOM 208 C THR A 13 -11.992 11.027 -5.667 1.00 0.00 C ATOM 209 O THR A 13 -11.085 10.204 -5.770 1.00 0.00 O ATOM 210 CB THR A 13 -13.966 10.257 -7.019 1.00 0.00 C ATOM 211 OG1 THR A 13 -14.723 10.500 -8.213 1.00 0.00 O ATOM 212 CG2 THR A 13 -14.907 10.227 -5.823 1.00 0.00 C ATOM 0 H THR A 13 -11.659 10.587 -8.367 1.00 0.00 H new ATOM 0 HA THR A 13 -13.382 12.305 -6.681 1.00 0.00 H new ATOM 0 HB THR A 13 -13.463 9.292 -7.083 1.00 0.00 H new ATOM 0 HG1 THR A 13 -15.667 10.626 -7.982 1.00 0.00 H new ATOM 0 HG21 THR A 13 -15.654 9.447 -5.967 1.00 0.00 H new ATOM 0 HG22 THR A 13 -14.337 10.021 -4.917 1.00 0.00 H new ATOM 0 HG23 THR A 13 -15.404 11.192 -5.727 1.00 0.00 H new ATOM 220 N ALA A 14 -12.232 11.695 -4.546 1.00 0.00 N ATOM 221 CA ALA A 14 -11.427 11.496 -3.348 1.00 0.00 C ATOM 222 C ALA A 14 -12.178 10.662 -2.317 1.00 0.00 C ATOM 223 O ALA A 14 -11.631 10.297 -1.270 1.00 0.00 O ATOM 224 CB ALA A 14 -11.032 12.841 -2.755 1.00 0.00 C ATOM 0 H ALA A 14 -12.980 12.381 -4.441 1.00 0.00 H new ATOM 0 HA ALA A 14 -10.524 10.953 -3.628 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -10.431 12.682 -1.860 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -10.452 13.405 -3.486 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -11.930 13.401 -2.494 1.00 0.00 H new ATOM 230 N ALA A 15 -13.430 10.356 -2.620 1.00 0.00 N ATOM 231 CA ALA A 15 -14.281 9.633 -1.692 1.00 0.00 C ATOM 232 C ALA A 15 -14.475 8.185 -2.123 1.00 0.00 C ATOM 233 O ALA A 15 -15.133 7.905 -3.123 1.00 0.00 O ATOM 234 CB ALA A 15 -15.627 10.326 -1.564 1.00 0.00 C ATOM 0 H ALA A 15 -13.879 10.598 -3.503 1.00 0.00 H new ATOM 0 HA ALA A 15 -13.786 9.629 -0.721 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -16.256 9.774 -0.865 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -15.480 11.341 -1.195 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -16.113 10.361 -2.539 1.00 0.00 H new ATOM 240 N ILE A 16 -13.886 7.273 -1.366 1.00 0.00 N ATOM 241 CA ILE A 16 -14.097 5.849 -1.572 1.00 0.00 C ATOM 242 C ILE A 16 -14.948 5.313 -0.427 1.00 0.00 C ATOM 243 O ILE A 16 -14.743 5.693 0.728 1.00 0.00 O ATOM 244 CB ILE A 16 -12.758 5.080 -1.640 1.00 0.00 C ATOM 245 CG1 ILE A 16 -11.842 5.706 -2.701 1.00 0.00 C ATOM 246 CG2 ILE A 16 -13.003 3.609 -1.952 1.00 0.00 C ATOM 247 CD1 ILE A 16 -10.467 5.074 -2.774 1.00 0.00 C ATOM 0 H ILE A 16 -13.253 7.496 -0.598 1.00 0.00 H new ATOM 0 HA ILE A 16 -14.606 5.703 -2.525 1.00 0.00 H new ATOM 0 HB ILE A 16 -12.267 5.149 -0.669 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -12.322 5.623 -3.676 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -11.732 6.770 -2.490 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -12.049 3.083 -1.996 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -13.624 3.170 -1.171 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -13.511 3.520 -2.912 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -9.879 5.570 -3.546 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -9.966 5.181 -1.812 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -10.565 4.016 -3.017 1.00 0.00 H new ATOM 259 N ASP A 17 -15.914 4.461 -0.731 1.00 0.00 N ATOM 260 CA ASP A 17 -16.855 4.009 0.284 1.00 0.00 C ATOM 261 C ASP A 17 -17.200 2.540 0.088 1.00 0.00 C ATOM 262 O ASP A 17 -17.153 2.040 -1.033 1.00 0.00 O ATOM 263 CB ASP A 17 -18.131 4.853 0.217 1.00 0.00 C ATOM 264 CG ASP A 17 -18.930 4.819 1.503 1.00 0.00 C ATOM 265 OD1 ASP A 17 -19.714 3.869 1.706 1.00 0.00 O ATOM 266 OD2 ASP A 17 -18.785 5.760 2.312 1.00 0.00 O ATOM 0 H ASP A 17 -16.067 4.072 -1.661 1.00 0.00 H new ATOM 0 HA ASP A 17 -16.389 4.126 1.263 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -17.866 5.885 -0.013 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -18.755 4.494 -0.602 1.00 0.00 H new ATOM 271 N ALA A 18 -17.515 1.869 1.198 1.00 0.00 N ATOM 272 CA ALA A 18 -17.993 0.484 1.198 1.00 0.00 C ATOM 273 C ALA A 18 -17.071 -0.459 0.431 1.00 0.00 C ATOM 274 O ALA A 18 -17.282 -0.746 -0.750 1.00 0.00 O ATOM 275 CB ALA A 18 -19.414 0.402 0.661 1.00 0.00 C ATOM 0 H ALA A 18 -17.445 2.275 2.131 1.00 0.00 H new ATOM 0 HA ALA A 18 -17.989 0.152 2.236 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -19.747 -0.636 0.671 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -20.075 1.001 1.287 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -19.439 0.782 -0.360 1.00 0.00 H new ATOM 281 N TYR A 19 -16.046 -0.939 1.108 1.00 0.00 N ATOM 282 CA TYR A 19 -15.117 -1.879 0.513 1.00 0.00 C ATOM 283 C TYR A 19 -15.325 -3.271 1.096 1.00 0.00 C ATOM 284 O TYR A 19 -15.416 -3.437 2.315 1.00 0.00 O ATOM 285 CB TYR A 19 -13.677 -1.415 0.745 1.00 0.00 C ATOM 286 CG TYR A 19 -12.631 -2.358 0.195 1.00 0.00 C ATOM 287 CD1 TYR A 19 -12.566 -2.638 -1.163 1.00 0.00 C ATOM 288 CD2 TYR A 19 -11.706 -2.965 1.035 1.00 0.00 C ATOM 289 CE1 TYR A 19 -11.611 -3.498 -1.668 1.00 0.00 C ATOM 290 CE2 TYR A 19 -10.747 -3.823 0.537 1.00 0.00 C ATOM 291 CZ TYR A 19 -10.703 -4.085 -0.816 1.00 0.00 C ATOM 292 OH TYR A 19 -9.744 -4.930 -1.319 1.00 0.00 O ATOM 0 H TYR A 19 -15.835 -0.692 2.075 1.00 0.00 H new ATOM 0 HA TYR A 19 -15.303 -1.922 -0.560 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -13.544 -0.435 0.288 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -13.514 -1.292 1.816 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -13.274 -2.176 -1.835 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -11.738 -2.762 2.095 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -11.577 -3.709 -2.727 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -10.035 -4.287 1.203 1.00 0.00 H new ATOM 0 HH TYR A 19 -9.690 -4.822 -2.292 1.00 0.00 H new ATOM 302 N GLY A 20 -15.416 -4.262 0.225 1.00 0.00 N ATOM 303 CA GLY A 20 -15.558 -5.629 0.679 1.00 0.00 C ATOM 304 C GLY A 20 -16.361 -6.476 -0.281 1.00 0.00 C ATOM 305 O GLY A 20 -15.871 -6.859 -1.345 1.00 0.00 O ATOM 0 H GLY A 20 -15.394 -4.145 -0.788 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -14.570 -6.070 0.809 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -16.041 -5.636 1.656 1.00 0.00 H new ATOM 309 N LYS A 21 -17.601 -6.754 0.084 1.00 0.00 N ATOM 310 CA LYS A 21 -18.461 -7.595 -0.729 1.00 0.00 C ATOM 311 C LYS A 21 -18.952 -6.819 -1.944 1.00 0.00 C ATOM 312 O LYS A 21 -19.659 -5.820 -1.814 1.00 0.00 O ATOM 313 CB LYS A 21 -19.641 -8.103 0.098 1.00 0.00 C ATOM 314 CG LYS A 21 -20.524 -9.090 -0.645 1.00 0.00 C ATOM 315 CD LYS A 21 -21.666 -9.568 0.231 1.00 0.00 C ATOM 316 CE LYS A 21 -22.559 -10.557 -0.498 1.00 0.00 C ATOM 317 NZ LYS A 21 -23.707 -10.993 0.342 1.00 0.00 N ATOM 0 H LYS A 21 -18.035 -6.408 0.940 1.00 0.00 H new ATOM 0 HA LYS A 21 -17.889 -8.456 -1.075 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -19.262 -8.577 1.003 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -20.246 -7.253 0.413 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -20.923 -8.620 -1.544 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -19.928 -9.943 -0.969 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -21.264 -10.035 1.130 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -22.259 -8.712 0.554 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -22.933 -10.101 -1.415 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -21.973 -11.428 -0.791 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -24.292 -11.667 -0.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -23.351 -11.451 1.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -24.282 -10.166 0.601 1.00 0.00 H new ATOM 331 N GLY A 22 -18.564 -7.283 -3.121 1.00 0.00 N ATOM 332 CA GLY A 22 -18.889 -6.575 -4.343 1.00 0.00 C ATOM 333 C GLY A 22 -17.746 -5.686 -4.790 1.00 0.00 C ATOM 334 O GLY A 22 -17.828 -5.023 -5.824 1.00 0.00 O ATOM 0 H GLY A 22 -18.028 -8.140 -3.253 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -19.122 -7.293 -5.130 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -19.783 -5.970 -4.188 1.00 0.00 H new ATOM 338 N GLY A 23 -16.677 -5.677 -4.004 1.00 0.00 N ATOM 339 CA GLY A 23 -15.517 -4.877 -4.331 1.00 0.00 C ATOM 340 C GLY A 23 -15.588 -3.496 -3.718 1.00 0.00 C ATOM 341 O GLY A 23 -15.539 -3.351 -2.497 1.00 0.00 O ATOM 0 H GLY A 23 -16.595 -6.214 -3.141 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -14.617 -5.383 -3.980 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -15.432 -4.789 -5.414 1.00 0.00 H new ATOM 345 N PHE A 24 -15.702 -2.487 -4.566 1.00 0.00 N ATOM 346 CA PHE A 24 -15.799 -1.107 -4.122 1.00 0.00 C ATOM 347 C PHE A 24 -17.193 -0.572 -4.419 1.00 0.00 C ATOM 348 O PHE A 24 -17.484 -0.173 -5.551 1.00 0.00 O ATOM 349 CB PHE A 24 -14.760 -0.232 -4.835 1.00 0.00 C ATOM 350 CG PHE A 24 -13.346 -0.738 -4.747 1.00 0.00 C ATOM 351 CD1 PHE A 24 -12.897 -1.741 -5.595 1.00 0.00 C ATOM 352 CD2 PHE A 24 -12.462 -0.203 -3.826 1.00 0.00 C ATOM 353 CE1 PHE A 24 -11.597 -2.199 -5.524 1.00 0.00 C ATOM 354 CE2 PHE A 24 -11.161 -0.658 -3.750 1.00 0.00 C ATOM 355 CZ PHE A 24 -10.729 -1.658 -4.599 1.00 0.00 C ATOM 0 H PHE A 24 -15.730 -2.601 -5.579 1.00 0.00 H new ATOM 0 HA PHE A 24 -15.608 -1.076 -3.049 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -15.036 -0.147 -5.886 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -14.799 0.772 -4.413 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -13.574 -2.169 -6.320 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -12.794 0.579 -3.159 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -11.260 -2.979 -6.191 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -10.481 -0.232 -3.027 1.00 0.00 H new ATOM 0 HZ PHE A 24 -9.712 -2.016 -4.539 1.00 0.00 H new ATOM 365 N TYR A 25 -18.063 -0.574 -3.427 1.00 0.00 N ATOM 366 CA TYR A 25 -19.418 -0.105 -3.643 1.00 0.00 C ATOM 367 C TYR A 25 -19.518 1.373 -3.301 1.00 0.00 C ATOM 368 O TYR A 25 -19.740 1.751 -2.153 1.00 0.00 O ATOM 369 CB TYR A 25 -20.407 -0.919 -2.800 1.00 0.00 C ATOM 370 CG TYR A 25 -21.849 -0.492 -2.969 1.00 0.00 C ATOM 371 CD1 TYR A 25 -22.542 -0.767 -4.139 1.00 0.00 C ATOM 372 CD2 TYR A 25 -22.514 0.182 -1.954 1.00 0.00 C ATOM 373 CE1 TYR A 25 -23.858 -0.380 -4.294 1.00 0.00 C ATOM 374 CE2 TYR A 25 -23.829 0.569 -2.102 1.00 0.00 C ATOM 375 CZ TYR A 25 -24.497 0.285 -3.272 1.00 0.00 C ATOM 376 OH TYR A 25 -25.811 0.665 -3.418 1.00 0.00 O ATOM 0 H TYR A 25 -17.861 -0.890 -2.478 1.00 0.00 H new ATOM 0 HA TYR A 25 -19.673 -0.239 -4.694 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -20.316 -1.972 -3.066 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -20.132 -0.831 -1.749 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -22.044 -1.292 -4.941 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -21.994 0.407 -1.035 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -24.383 -0.598 -5.212 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -24.333 1.093 -1.303 1.00 0.00 H new ATOM 0 HH TYR A 25 -26.112 1.122 -2.605 1.00 0.00 H new ATOM 386 N PHE A 26 -19.350 2.210 -4.307 1.00 0.00 N ATOM 387 CA PHE A 26 -19.447 3.643 -4.118 1.00 0.00 C ATOM 388 C PHE A 26 -20.112 4.289 -5.318 1.00 0.00 C ATOM 389 O PHE A 26 -19.804 3.947 -6.462 1.00 0.00 O ATOM 390 CB PHE A 26 -18.064 4.266 -3.858 1.00 0.00 C ATOM 391 CG PHE A 26 -17.105 4.183 -5.018 1.00 0.00 C ATOM 392 CD1 PHE A 26 -16.371 3.031 -5.249 1.00 0.00 C ATOM 393 CD2 PHE A 26 -16.932 5.265 -5.870 1.00 0.00 C ATOM 394 CE1 PHE A 26 -15.487 2.956 -6.309 1.00 0.00 C ATOM 395 CE2 PHE A 26 -16.049 5.195 -6.932 1.00 0.00 C ATOM 396 CZ PHE A 26 -15.325 4.040 -7.151 1.00 0.00 C ATOM 0 H PHE A 26 -19.146 1.921 -5.264 1.00 0.00 H new ATOM 0 HA PHE A 26 -20.063 3.828 -3.238 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -18.198 5.314 -3.590 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -17.614 3.771 -2.997 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -16.491 2.181 -4.593 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -17.493 6.172 -5.702 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -14.923 2.051 -6.479 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -15.926 6.043 -7.589 1.00 0.00 H new ATOM 0 HZ PHE A 26 -14.633 3.984 -7.979 1.00 0.00 H new ATOM 406 N ALA A 27 -21.035 5.197 -5.039 1.00 0.00 N ATOM 407 CA ALA A 27 -21.709 5.985 -6.063 1.00 0.00 C ATOM 408 C ALA A 27 -22.488 5.118 -7.053 1.00 0.00 C ATOM 409 O ALA A 27 -21.989 4.760 -8.123 1.00 0.00 O ATOM 410 CB ALA A 27 -20.715 6.881 -6.789 1.00 0.00 C ATOM 0 H ALA A 27 -21.340 5.410 -4.089 1.00 0.00 H new ATOM 0 HA ALA A 27 -22.441 6.612 -5.554 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -21.237 7.462 -7.550 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -20.246 7.557 -6.075 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -19.950 6.266 -7.263 1.00 0.00 H new ATOM 416 N GLY A 28 -23.703 4.750 -6.667 1.00 0.00 N ATOM 417 CA GLY A 28 -24.613 4.102 -7.593 1.00 0.00 C ATOM 418 C GLY A 28 -24.530 2.587 -7.585 1.00 0.00 C ATOM 419 O GLY A 28 -25.456 1.914 -7.132 1.00 0.00 O ATOM 0 H GLY A 28 -24.075 4.889 -5.728 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -25.633 4.401 -7.352 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -24.405 4.461 -8.601 1.00 0.00 H new ATOM 423 N MET A 29 -23.427 2.045 -8.084 1.00 0.00 N ATOM 424 CA MET A 29 -23.320 0.605 -8.285 1.00 0.00 C ATOM 425 C MET A 29 -21.966 0.081 -7.818 1.00 0.00 C ATOM 426 O MET A 29 -20.991 0.833 -7.745 1.00 0.00 O ATOM 427 CB MET A 29 -23.535 0.277 -9.767 1.00 0.00 C ATOM 428 CG MET A 29 -23.718 -1.205 -10.055 1.00 0.00 C ATOM 429 SD MET A 29 -25.170 -1.893 -9.237 1.00 0.00 S ATOM 430 CE MET A 29 -25.073 -3.604 -9.762 1.00 0.00 C ATOM 0 H MET A 29 -22.599 2.575 -8.355 1.00 0.00 H new ATOM 0 HA MET A 29 -24.089 0.114 -7.689 1.00 0.00 H new ATOM 0 HB2 MET A 29 -24.412 0.816 -10.124 1.00 0.00 H new ATOM 0 HB3 MET A 29 -22.681 0.644 -10.337 1.00 0.00 H new ATOM 0 HG2 MET A 29 -23.806 -1.355 -11.131 1.00 0.00 H new ATOM 0 HG3 MET A 29 -22.830 -1.747 -9.729 1.00 0.00 H new ATOM 0 HE1 MET A 29 -25.906 -4.163 -9.336 1.00 0.00 H new ATOM 0 HE2 MET A 29 -25.120 -3.654 -10.850 1.00 0.00 H new ATOM 0 HE3 MET A 29 -24.133 -4.037 -9.419 1.00 0.00 H new ATOM 440 N SER A 30 -21.919 -1.207 -7.500 1.00 0.00 N ATOM 441 CA SER A 30 -20.696 -1.855 -7.055 1.00 0.00 C ATOM 442 C SER A 30 -19.631 -1.833 -8.149 1.00 0.00 C ATOM 443 O SER A 30 -19.929 -2.033 -9.327 1.00 0.00 O ATOM 444 CB SER A 30 -21.001 -3.300 -6.658 1.00 0.00 C ATOM 445 OG SER A 30 -22.135 -3.360 -5.811 1.00 0.00 O ATOM 0 H SER A 30 -22.727 -1.829 -7.544 1.00 0.00 H new ATOM 0 HA SER A 30 -20.309 -1.309 -6.195 1.00 0.00 H new ATOM 0 HB2 SER A 30 -21.177 -3.898 -7.552 1.00 0.00 H new ATOM 0 HB3 SER A 30 -20.139 -3.732 -6.150 1.00 0.00 H new ATOM 0 HG SER A 30 -22.314 -4.293 -5.570 1.00 0.00 H new ATOM 451 N HIS A 31 -18.396 -1.571 -7.757 1.00 0.00 N ATOM 452 CA HIS A 31 -17.280 -1.565 -8.690 1.00 0.00 C ATOM 453 C HIS A 31 -16.255 -2.609 -8.270 1.00 0.00 C ATOM 454 O HIS A 31 -15.558 -2.435 -7.275 1.00 0.00 O ATOM 455 CB HIS A 31 -16.629 -0.178 -8.744 1.00 0.00 C ATOM 456 CG HIS A 31 -17.533 0.900 -9.261 1.00 0.00 C ATOM 457 ND1 HIS A 31 -18.087 1.873 -8.457 1.00 0.00 N ATOM 458 CD2 HIS A 31 -17.961 1.167 -10.517 1.00 0.00 C ATOM 459 CE1 HIS A 31 -18.814 2.691 -9.197 1.00 0.00 C ATOM 460 NE2 HIS A 31 -18.754 2.284 -10.451 1.00 0.00 N ATOM 0 H HIS A 31 -18.139 -1.358 -6.793 1.00 0.00 H new ATOM 0 HA HIS A 31 -17.653 -1.807 -9.685 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -16.292 0.093 -7.743 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -15.742 -0.228 -9.376 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -17.722 0.604 -11.407 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -19.364 3.548 -8.837 1.00 0.00 H new ATOM 0 HE2 HIS A 31 -19.221 2.728 -11.242 1.00 0.00 H new ATOM 469 N GLN A 32 -16.178 -3.699 -9.016 1.00 0.00 N ATOM 470 CA GLN A 32 -15.285 -4.793 -8.665 1.00 0.00 C ATOM 471 C GLN A 32 -14.210 -4.987 -9.729 1.00 0.00 C ATOM 472 O GLN A 32 -14.226 -4.326 -10.766 1.00 0.00 O ATOM 473 CB GLN A 32 -16.083 -6.083 -8.463 1.00 0.00 C ATOM 474 CG GLN A 32 -16.980 -6.442 -9.634 1.00 0.00 C ATOM 475 CD GLN A 32 -17.833 -7.659 -9.351 1.00 0.00 C ATOM 476 OE1 GLN A 32 -17.440 -8.790 -9.635 1.00 0.00 O ATOM 477 NE2 GLN A 32 -19.002 -7.435 -8.776 1.00 0.00 N ATOM 0 H GLN A 32 -16.721 -3.850 -9.866 1.00 0.00 H new ATOM 0 HA GLN A 32 -14.786 -4.540 -7.729 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -15.388 -6.904 -8.285 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -16.695 -5.983 -7.567 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -17.625 -5.595 -9.868 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -16.366 -6.628 -10.515 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -19.288 -6.481 -8.558 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -19.618 -8.216 -8.550 1.00 0.00 H new ATOM 486 N GLY A 33 -13.284 -5.899 -9.463 1.00 0.00 N ATOM 487 CA GLY A 33 -12.171 -6.111 -10.365 1.00 0.00 C ATOM 488 C GLY A 33 -10.977 -5.278 -9.961 1.00 0.00 C ATOM 489 O GLY A 33 -10.402 -5.485 -8.892 1.00 0.00 O ATOM 0 H GLY A 33 -13.285 -6.497 -8.636 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -11.898 -7.166 -10.369 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -12.469 -5.856 -11.382 1.00 0.00 H new ATOM 493 N SER A 34 -10.616 -4.327 -10.801 1.00 0.00 N ATOM 494 CA SER A 34 -9.548 -3.399 -10.488 1.00 0.00 C ATOM 495 C SER A 34 -9.904 -2.007 -11.001 1.00 0.00 C ATOM 496 O SER A 34 -10.365 -1.849 -12.134 1.00 0.00 O ATOM 497 CB SER A 34 -8.226 -3.889 -11.081 1.00 0.00 C ATOM 498 OG SER A 34 -8.394 -4.330 -12.417 1.00 0.00 O ATOM 0 H SER A 34 -11.051 -4.177 -11.711 1.00 0.00 H new ATOM 0 HA SER A 34 -9.426 -3.343 -9.406 1.00 0.00 H new ATOM 0 HB2 SER A 34 -7.491 -3.085 -11.051 1.00 0.00 H new ATOM 0 HB3 SER A 34 -7.832 -4.704 -10.473 1.00 0.00 H new ATOM 0 HG SER A 34 -8.172 -5.283 -12.477 1.00 0.00 H new ATOM 504 N LEU A 35 -9.718 -1.006 -10.158 1.00 0.00 N ATOM 505 CA LEU A 35 -10.089 0.356 -10.502 1.00 0.00 C ATOM 506 C LEU A 35 -8.863 1.245 -10.607 1.00 0.00 C ATOM 507 O LEU A 35 -7.957 1.172 -9.774 1.00 0.00 O ATOM 508 CB LEU A 35 -11.053 0.927 -9.459 1.00 0.00 C ATOM 509 CG LEU A 35 -12.396 0.206 -9.351 1.00 0.00 C ATOM 510 CD1 LEU A 35 -13.223 0.806 -8.226 1.00 0.00 C ATOM 511 CD2 LEU A 35 -13.156 0.279 -10.670 1.00 0.00 C ATOM 0 H LEU A 35 -9.311 -1.111 -9.228 1.00 0.00 H new ATOM 0 HA LEU A 35 -10.584 0.332 -11.473 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -10.565 0.901 -8.484 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -11.239 1.975 -9.695 1.00 0.00 H new ATOM 0 HG LEU A 35 -12.208 -0.844 -9.126 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -14.178 0.285 -8.158 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -12.685 0.702 -7.284 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -13.400 1.862 -8.428 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -14.109 -0.241 -10.570 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -13.337 1.322 -10.928 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -12.566 -0.192 -11.456 1.00 0.00 H new ATOM 523 N LEU A 36 -8.841 2.077 -11.635 1.00 0.00 N ATOM 524 CA LEU A 36 -7.766 3.031 -11.828 1.00 0.00 C ATOM 525 C LEU A 36 -8.250 4.433 -11.494 1.00 0.00 C ATOM 526 O LEU A 36 -8.918 5.079 -12.303 1.00 0.00 O ATOM 527 CB LEU A 36 -7.252 2.990 -13.269 1.00 0.00 C ATOM 528 CG LEU A 36 -6.617 1.669 -13.705 1.00 0.00 C ATOM 529 CD1 LEU A 36 -6.225 1.730 -15.171 1.00 0.00 C ATOM 530 CD2 LEU A 36 -5.403 1.349 -12.843 1.00 0.00 C ATOM 0 H LEU A 36 -9.564 2.109 -12.354 1.00 0.00 H new ATOM 0 HA LEU A 36 -6.947 2.762 -11.161 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -8.083 3.212 -13.939 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -6.518 3.785 -13.397 1.00 0.00 H new ATOM 0 HG LEU A 36 -7.351 0.874 -13.574 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -5.774 0.783 -15.467 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -7.112 1.915 -15.777 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -5.507 2.536 -15.322 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -4.964 0.406 -13.168 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -4.666 2.145 -12.943 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -5.709 1.267 -11.800 1.00 0.00 H new ATOM 542 N PHE A 37 -7.943 4.885 -10.292 1.00 0.00 N ATOM 543 CA PHE A 37 -8.295 6.231 -9.876 1.00 0.00 C ATOM 544 C PHE A 37 -7.313 7.222 -10.480 1.00 0.00 C ATOM 545 O PHE A 37 -6.211 7.410 -9.966 1.00 0.00 O ATOM 546 CB PHE A 37 -8.301 6.348 -8.346 1.00 0.00 C ATOM 547 CG PHE A 37 -9.358 5.512 -7.675 1.00 0.00 C ATOM 548 CD1 PHE A 37 -9.131 4.175 -7.395 1.00 0.00 C ATOM 549 CD2 PHE A 37 -10.579 6.067 -7.330 1.00 0.00 C ATOM 550 CE1 PHE A 37 -10.101 3.406 -6.783 1.00 0.00 C ATOM 551 CE2 PHE A 37 -11.555 5.305 -6.718 1.00 0.00 C ATOM 552 CZ PHE A 37 -11.316 3.972 -6.444 1.00 0.00 C ATOM 0 H PHE A 37 -7.450 4.339 -9.585 1.00 0.00 H new ATOM 0 HA PHE A 37 -9.300 6.457 -10.232 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -7.323 6.054 -7.965 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -8.449 7.392 -8.072 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -8.184 3.728 -7.658 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -10.770 7.109 -7.542 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -9.911 2.364 -6.570 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -12.503 5.750 -6.454 1.00 0.00 H new ATOM 0 HZ PHE A 37 -12.077 3.373 -5.966 1.00 0.00 H new ATOM 562 N LEU A 38 -7.702 7.817 -11.597 1.00 0.00 N ATOM 563 CA LEU A 38 -6.846 8.751 -12.307 1.00 0.00 C ATOM 564 C LEU A 38 -7.359 10.176 -12.138 1.00 0.00 C ATOM 565 O LEU A 38 -8.542 10.386 -11.859 1.00 0.00 O ATOM 566 CB LEU A 38 -6.797 8.391 -13.798 1.00 0.00 C ATOM 567 CG LEU A 38 -6.296 6.980 -14.118 1.00 0.00 C ATOM 568 CD1 LEU A 38 -6.366 6.721 -15.615 1.00 0.00 C ATOM 569 CD2 LEU A 38 -4.875 6.784 -13.610 1.00 0.00 C ATOM 0 H LEU A 38 -8.612 7.667 -12.033 1.00 0.00 H new ATOM 0 HA LEU A 38 -5.841 8.687 -11.889 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -7.798 8.506 -14.215 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -6.155 9.110 -14.307 1.00 0.00 H new ATOM 0 HG LEU A 38 -6.941 6.263 -13.610 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -6.007 5.714 -15.827 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -7.398 6.817 -15.953 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -5.744 7.446 -16.139 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -4.539 5.775 -13.848 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -4.215 7.508 -14.087 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -4.852 6.929 -12.530 1.00 0.00 H new ATOM 581 N PRO A 39 -6.471 11.173 -12.296 1.00 0.00 N ATOM 582 CA PRO A 39 -6.855 12.588 -12.250 1.00 0.00 C ATOM 583 C PRO A 39 -7.930 12.926 -13.283 1.00 0.00 C ATOM 584 O PRO A 39 -8.741 13.829 -13.080 1.00 0.00 O ATOM 585 CB PRO A 39 -5.551 13.327 -12.570 1.00 0.00 C ATOM 586 CG PRO A 39 -4.468 12.368 -12.215 1.00 0.00 C ATOM 587 CD PRO A 39 -5.022 11.001 -12.502 1.00 0.00 C ATOM 0 HA PRO A 39 -7.285 12.863 -11.287 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -5.503 13.605 -13.623 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -5.467 14.248 -11.993 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -3.570 12.557 -12.803 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -4.189 12.464 -11.166 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -4.795 10.680 -13.519 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -4.607 10.249 -11.831 1.00 0.00 H new ATOM 595 N ASP A 40 -7.928 12.192 -14.394 1.00 0.00 N ATOM 596 CA ASP A 40 -8.939 12.368 -15.435 1.00 0.00 C ATOM 597 C ASP A 40 -10.293 11.851 -14.956 1.00 0.00 C ATOM 598 O ASP A 40 -11.282 12.585 -14.941 1.00 0.00 O ATOM 599 CB ASP A 40 -8.526 11.633 -16.716 1.00 0.00 C ATOM 600 CG ASP A 40 -9.599 11.691 -17.790 1.00 0.00 C ATOM 601 OD1 ASP A 40 -9.636 12.683 -18.549 1.00 0.00 O ATOM 602 OD2 ASP A 40 -10.407 10.745 -17.881 1.00 0.00 O ATOM 0 H ASP A 40 -7.237 11.469 -14.597 1.00 0.00 H new ATOM 0 HA ASP A 40 -9.023 13.433 -15.651 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -7.606 12.071 -17.102 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -8.309 10.591 -16.480 1.00 0.00 H new ATOM 607 N ALA A 41 -10.319 10.587 -14.553 1.00 0.00 N ATOM 608 CA ALA A 41 -11.531 9.945 -14.060 1.00 0.00 C ATOM 609 C ALA A 41 -11.193 8.595 -13.446 1.00 0.00 C ATOM 610 O ALA A 41 -10.052 8.135 -13.526 1.00 0.00 O ATOM 611 CB ALA A 41 -12.555 9.778 -15.179 1.00 0.00 C ATOM 0 H ALA A 41 -9.501 9.978 -14.559 1.00 0.00 H new ATOM 0 HA ALA A 41 -11.970 10.584 -13.294 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -13.450 9.297 -14.784 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -12.817 10.757 -15.582 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -12.131 9.161 -15.971 1.00 0.00 H new ATOM 617 N VAL A 42 -12.181 7.968 -12.830 1.00 0.00 N ATOM 618 CA VAL A 42 -12.007 6.631 -12.289 1.00 0.00 C ATOM 619 C VAL A 42 -12.372 5.606 -13.353 1.00 0.00 C ATOM 620 O VAL A 42 -13.547 5.362 -13.623 1.00 0.00 O ATOM 621 CB VAL A 42 -12.882 6.399 -11.033 1.00 0.00 C ATOM 622 CG1 VAL A 42 -12.613 5.026 -10.432 1.00 0.00 C ATOM 623 CG2 VAL A 42 -12.644 7.495 -10.003 1.00 0.00 C ATOM 0 H VAL A 42 -13.111 8.363 -12.692 1.00 0.00 H new ATOM 0 HA VAL A 42 -10.963 6.522 -11.995 1.00 0.00 H new ATOM 0 HB VAL A 42 -13.928 6.436 -11.336 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -13.239 4.886 -9.551 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -12.844 4.255 -11.168 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -11.564 4.953 -10.147 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -13.268 7.314 -9.128 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -11.595 7.494 -9.707 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -12.898 8.463 -10.436 1.00 0.00 H new ATOM 633 N TRP A 43 -11.353 5.032 -13.974 1.00 0.00 N ATOM 634 CA TRP A 43 -11.554 4.092 -15.066 1.00 0.00 C ATOM 635 C TRP A 43 -11.347 2.662 -14.589 1.00 0.00 C ATOM 636 O TRP A 43 -10.801 2.433 -13.508 1.00 0.00 O ATOM 637 CB TRP A 43 -10.601 4.409 -16.223 1.00 0.00 C ATOM 638 CG TRP A 43 -10.873 5.736 -16.875 1.00 0.00 C ATOM 639 CD1 TRP A 43 -10.253 6.926 -16.615 1.00 0.00 C ATOM 640 CD2 TRP A 43 -11.839 6.004 -17.897 1.00 0.00 C ATOM 641 NE1 TRP A 43 -10.781 7.917 -17.411 1.00 0.00 N ATOM 642 CE2 TRP A 43 -11.754 7.375 -18.207 1.00 0.00 C ATOM 643 CE3 TRP A 43 -12.767 5.216 -18.579 1.00 0.00 C ATOM 644 CZ2 TRP A 43 -12.564 7.972 -19.169 1.00 0.00 C ATOM 645 CZ3 TRP A 43 -13.570 5.809 -19.535 1.00 0.00 C ATOM 646 CH2 TRP A 43 -13.463 7.174 -19.822 1.00 0.00 C ATOM 0 H TRP A 43 -10.375 5.202 -13.739 1.00 0.00 H new ATOM 0 HA TRP A 43 -12.580 4.191 -15.420 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -9.576 4.398 -15.853 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -10.678 3.622 -16.973 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -9.464 7.068 -15.891 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -10.494 8.896 -17.408 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -12.856 4.161 -18.364 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -12.486 9.026 -19.392 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -14.292 5.209 -20.069 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -14.104 7.607 -20.575 1.00 0.00 H new ATOM 657 N GLY A 44 -11.791 1.707 -15.392 1.00 0.00 N ATOM 658 CA GLY A 44 -11.648 0.314 -15.031 1.00 0.00 C ATOM 659 C GLY A 44 -10.381 -0.293 -15.594 1.00 0.00 C ATOM 660 O GLY A 44 -9.984 0.018 -16.719 1.00 0.00 O ATOM 0 H GLY A 44 -12.248 1.873 -16.288 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -11.643 0.220 -13.945 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -12.510 -0.245 -15.395 1.00 0.00 H new ATOM 664 N TRP A 45 -9.742 -1.147 -14.809 1.00 0.00 N ATOM 665 CA TRP A 45 -8.537 -1.834 -15.239 1.00 0.00 C ATOM 666 C TRP A 45 -8.901 -3.256 -15.665 1.00 0.00 C ATOM 667 O TRP A 45 -9.901 -3.809 -15.204 1.00 0.00 O ATOM 668 CB TRP A 45 -7.511 -1.835 -14.100 1.00 0.00 C ATOM 669 CG TRP A 45 -6.102 -2.130 -14.525 1.00 0.00 C ATOM 670 CD1 TRP A 45 -5.584 -2.053 -15.787 1.00 0.00 C ATOM 671 CD2 TRP A 45 -5.021 -2.520 -13.672 1.00 0.00 C ATOM 672 NE1 TRP A 45 -4.253 -2.393 -15.772 1.00 0.00 N ATOM 673 CE2 TRP A 45 -3.884 -2.680 -14.485 1.00 0.00 C ATOM 674 CE3 TRP A 45 -4.906 -2.757 -12.300 1.00 0.00 C ATOM 675 CZ2 TRP A 45 -2.648 -3.063 -13.968 1.00 0.00 C ATOM 676 CZ3 TRP A 45 -3.680 -3.136 -11.789 1.00 0.00 C ATOM 677 CH2 TRP A 45 -2.566 -3.287 -12.621 1.00 0.00 C ATOM 0 H TRP A 45 -10.043 -1.381 -13.863 1.00 0.00 H new ATOM 0 HA TRP A 45 -8.090 -1.321 -16.091 1.00 0.00 H new ATOM 0 HB2 TRP A 45 -7.532 -0.862 -13.610 1.00 0.00 H new ATOM 0 HB3 TRP A 45 -7.814 -2.573 -13.357 1.00 0.00 H new ATOM 0 HD1 TRP A 45 -6.140 -1.767 -16.668 1.00 0.00 H new ATOM 0 HE1 TRP A 45 -3.640 -2.426 -16.586 1.00 0.00 H new ATOM 0 HE3 TRP A 45 -5.761 -2.646 -11.650 1.00 0.00 H new ATOM 0 HZ2 TRP A 45 -1.786 -3.179 -14.608 1.00 0.00 H new ATOM 0 HZ3 TRP A 45 -3.580 -3.319 -10.729 1.00 0.00 H new ATOM 0 HH2 TRP A 45 -1.622 -3.587 -12.191 1.00 0.00 H new ATOM 688 N ASP A 46 -8.108 -3.843 -16.549 1.00 0.00 N ATOM 689 CA ASP A 46 -8.462 -5.128 -17.145 1.00 0.00 C ATOM 690 C ASP A 46 -7.715 -6.281 -16.468 1.00 0.00 C ATOM 691 O ASP A 46 -7.557 -7.361 -17.035 1.00 0.00 O ATOM 692 CB ASP A 46 -8.169 -5.095 -18.649 1.00 0.00 C ATOM 693 CG ASP A 46 -8.867 -6.203 -19.412 1.00 0.00 C ATOM 694 OD1 ASP A 46 -10.117 -6.217 -19.442 1.00 0.00 O ATOM 695 OD2 ASP A 46 -8.170 -7.052 -20.003 1.00 0.00 O ATOM 0 H ASP A 46 -7.221 -3.456 -16.870 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.528 -5.300 -16.993 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -8.479 -4.131 -19.053 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -7.093 -5.175 -18.806 1.00 0.00 H new ATOM 700 N VAL A 47 -7.278 -6.053 -15.238 1.00 0.00 N ATOM 701 CA VAL A 47 -6.600 -7.087 -14.466 1.00 0.00 C ATOM 702 C VAL A 47 -7.551 -7.677 -13.430 1.00 0.00 C ATOM 703 O VAL A 47 -8.206 -6.948 -12.689 1.00 0.00 O ATOM 704 CB VAL A 47 -5.331 -6.539 -13.778 1.00 0.00 C ATOM 705 CG1 VAL A 47 -4.739 -7.559 -12.819 1.00 0.00 C ATOM 706 CG2 VAL A 47 -4.300 -6.141 -14.823 1.00 0.00 C ATOM 0 H VAL A 47 -7.380 -5.162 -14.752 1.00 0.00 H new ATOM 0 HA VAL A 47 -6.291 -7.872 -15.156 1.00 0.00 H new ATOM 0 HB VAL A 47 -5.614 -5.659 -13.200 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -3.847 -7.143 -12.351 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -5.472 -7.804 -12.050 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -4.473 -8.463 -13.368 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -3.409 -5.756 -14.327 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -4.034 -7.012 -15.422 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -4.717 -5.369 -15.470 1.00 0.00 H new ATOM 716 N THR A 48 -7.638 -8.997 -13.395 1.00 0.00 N ATOM 717 CA THR A 48 -8.589 -9.672 -12.528 1.00 0.00 C ATOM 718 C THR A 48 -7.964 -10.046 -11.183 1.00 0.00 C ATOM 719 O THR A 48 -8.594 -9.902 -10.132 1.00 0.00 O ATOM 720 CB THR A 48 -9.123 -10.944 -13.212 1.00 0.00 C ATOM 721 OG1 THR A 48 -9.481 -10.646 -14.569 1.00 0.00 O ATOM 722 CG2 THR A 48 -10.338 -11.494 -12.476 1.00 0.00 C ATOM 0 H THR A 48 -7.061 -9.622 -13.958 1.00 0.00 H new ATOM 0 HA THR A 48 -9.409 -8.978 -12.343 1.00 0.00 H new ATOM 0 HB THR A 48 -8.337 -11.699 -13.191 1.00 0.00 H new ATOM 0 HG1 THR A 48 -9.819 -11.457 -15.004 1.00 0.00 H new ATOM 0 HG21 THR A 48 -10.694 -12.392 -12.981 1.00 0.00 H new ATOM 0 HG22 THR A 48 -10.062 -11.740 -11.451 1.00 0.00 H new ATOM 0 HG23 THR A 48 -11.129 -10.744 -12.469 1.00 0.00 H new ATOM 730 N LYS A 49 -6.732 -10.537 -11.222 1.00 0.00 N ATOM 731 CA LYS A 49 -6.067 -11.036 -10.025 1.00 0.00 C ATOM 732 C LYS A 49 -4.599 -10.613 -10.000 1.00 0.00 C ATOM 733 O LYS A 49 -4.054 -10.190 -11.022 1.00 0.00 O ATOM 734 CB LYS A 49 -6.173 -12.566 -9.985 1.00 0.00 C ATOM 735 CG LYS A 49 -7.604 -13.071 -9.930 1.00 0.00 C ATOM 736 CD LYS A 49 -7.685 -14.580 -10.052 1.00 0.00 C ATOM 737 CE LYS A 49 -9.129 -15.055 -10.003 1.00 0.00 C ATOM 738 NZ LYS A 49 -9.779 -14.724 -8.708 1.00 0.00 N ATOM 0 H LYS A 49 -6.172 -10.600 -12.072 1.00 0.00 H new ATOM 0 HA LYS A 49 -6.557 -10.611 -9.149 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -5.683 -12.980 -10.867 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -5.631 -12.938 -9.115 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -8.061 -12.759 -8.991 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -8.180 -12.612 -10.733 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -7.226 -14.898 -10.988 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -7.118 -15.044 -9.245 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -9.689 -14.597 -10.818 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -9.162 -16.133 -10.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -10.788 -14.973 -8.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -9.323 -15.262 -7.943 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -9.681 -13.706 -8.521 1.00 0.00 H new ATOM 752 N PRO A 50 -3.944 -10.701 -8.825 1.00 0.00 N ATOM 753 CA PRO A 50 -2.507 -10.434 -8.698 1.00 0.00 C ATOM 754 C PRO A 50 -1.669 -11.314 -9.626 1.00 0.00 C ATOM 755 O PRO A 50 -2.166 -12.291 -10.187 1.00 0.00 O ATOM 756 CB PRO A 50 -2.203 -10.761 -7.231 1.00 0.00 C ATOM 757 CG PRO A 50 -3.509 -10.614 -6.532 1.00 0.00 C ATOM 758 CD PRO A 50 -4.553 -11.040 -7.525 1.00 0.00 C ATOM 0 HA PRO A 50 -2.261 -9.409 -8.976 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -1.808 -11.771 -7.124 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -1.456 -10.082 -6.821 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -3.545 -11.234 -5.636 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -3.669 -9.584 -6.214 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -4.770 -12.105 -7.448 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -5.494 -10.511 -7.371 1.00 0.00 H new ATOM 766 N GLU A 51 -0.400 -10.938 -9.787 1.00 0.00 N ATOM 767 CA GLU A 51 0.542 -11.622 -10.685 1.00 0.00 C ATOM 768 C GLU A 51 0.218 -11.373 -12.163 1.00 0.00 C ATOM 769 O GLU A 51 1.091 -11.507 -13.019 1.00 0.00 O ATOM 770 CB GLU A 51 0.630 -13.127 -10.396 1.00 0.00 C ATOM 771 CG GLU A 51 1.227 -13.450 -9.034 1.00 0.00 C ATOM 772 CD GLU A 51 1.678 -14.892 -8.917 1.00 0.00 C ATOM 773 OE1 GLU A 51 0.871 -15.748 -8.503 1.00 0.00 O ATOM 774 OE2 GLU A 51 2.856 -15.174 -9.233 1.00 0.00 O ATOM 0 H GLU A 51 0.010 -10.144 -9.295 1.00 0.00 H new ATOM 0 HA GLU A 51 1.521 -11.187 -10.482 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -0.368 -13.560 -10.458 1.00 0.00 H new ATOM 0 HB3 GLU A 51 1.232 -13.603 -11.170 1.00 0.00 H new ATOM 0 HG2 GLU A 51 2.077 -12.792 -8.850 1.00 0.00 H new ATOM 0 HG3 GLU A 51 0.488 -13.241 -8.260 1.00 0.00 H new ATOM 781 N GLN A 52 -1.025 -10.998 -12.468 1.00 0.00 N ATOM 782 CA GLN A 52 -1.388 -10.608 -13.831 1.00 0.00 C ATOM 783 C GLN A 52 -0.887 -9.201 -14.128 1.00 0.00 C ATOM 784 O GLN A 52 -1.001 -8.708 -15.253 1.00 0.00 O ATOM 785 CB GLN A 52 -2.903 -10.654 -14.047 1.00 0.00 C ATOM 786 CG GLN A 52 -3.520 -12.038 -13.923 1.00 0.00 C ATOM 787 CD GLN A 52 -4.974 -12.048 -14.357 1.00 0.00 C ATOM 788 OE1 GLN A 52 -5.878 -11.806 -13.558 1.00 0.00 O ATOM 789 NE2 GLN A 52 -5.210 -12.322 -15.632 1.00 0.00 N ATOM 0 H GLN A 52 -1.791 -10.956 -11.796 1.00 0.00 H new ATOM 0 HA GLN A 52 -0.919 -11.322 -14.508 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -3.380 -9.992 -13.324 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -3.127 -10.258 -15.038 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -2.954 -12.744 -14.531 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -3.447 -12.377 -12.890 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -4.433 -12.517 -16.264 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -6.168 -12.337 -15.981 1.00 0.00 H new ATOM 798 N ILE A 53 -0.345 -8.553 -13.106 1.00 0.00 N ATOM 799 CA ILE A 53 0.189 -7.211 -13.249 1.00 0.00 C ATOM 800 C ILE A 53 1.556 -7.264 -13.919 1.00 0.00 C ATOM 801 O ILE A 53 2.593 -7.358 -13.261 1.00 0.00 O ATOM 802 CB ILE A 53 0.300 -6.490 -11.886 1.00 0.00 C ATOM 803 CG1 ILE A 53 -1.050 -6.525 -11.163 1.00 0.00 C ATOM 804 CG2 ILE A 53 0.768 -5.052 -12.078 1.00 0.00 C ATOM 805 CD1 ILE A 53 -1.026 -5.882 -9.794 1.00 0.00 C ATOM 0 H ILE A 53 -0.265 -8.940 -12.166 1.00 0.00 H new ATOM 0 HA ILE A 53 -0.503 -6.643 -13.871 1.00 0.00 H new ATOM 0 HB ILE A 53 1.038 -7.009 -11.274 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -1.794 -6.020 -11.778 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -1.371 -7.562 -11.062 1.00 0.00 H new ATOM 0 HG21 ILE A 53 0.840 -4.560 -11.108 1.00 0.00 H new ATOM 0 HG22 ILE A 53 1.746 -5.049 -12.560 1.00 0.00 H new ATOM 0 HG23 ILE A 53 0.053 -4.517 -12.703 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -2.017 -5.946 -9.345 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -0.307 -6.401 -9.161 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -0.737 -4.835 -9.889 1.00 0.00 H new ATOM 817 N ASP A 54 1.536 -7.257 -15.238 1.00 0.00 N ATOM 818 CA ASP A 54 2.754 -7.296 -16.026 1.00 0.00 C ATOM 819 C ASP A 54 2.976 -5.939 -16.685 1.00 0.00 C ATOM 820 O ASP A 54 2.089 -5.085 -16.662 1.00 0.00 O ATOM 821 CB ASP A 54 2.659 -8.409 -17.077 1.00 0.00 C ATOM 822 CG ASP A 54 3.938 -8.577 -17.872 1.00 0.00 C ATOM 823 OD1 ASP A 54 4.870 -9.244 -17.373 1.00 0.00 O ATOM 824 OD2 ASP A 54 4.015 -8.022 -18.986 1.00 0.00 O ATOM 0 H ASP A 54 0.680 -7.224 -15.792 1.00 0.00 H new ATOM 0 HA ASP A 54 3.605 -7.511 -15.379 1.00 0.00 H new ATOM 0 HB2 ASP A 54 2.418 -9.350 -16.582 1.00 0.00 H new ATOM 0 HB3 ASP A 54 1.839 -8.189 -17.760 1.00 0.00 H new ATOM 829 N ARG A 55 4.150 -5.746 -17.273 1.00 0.00 N ATOM 830 CA ARG A 55 4.495 -4.484 -17.914 1.00 0.00 C ATOM 831 C ARG A 55 3.511 -4.159 -19.038 1.00 0.00 C ATOM 832 O ARG A 55 3.197 -2.994 -19.281 1.00 0.00 O ATOM 833 CB ARG A 55 5.928 -4.543 -18.450 1.00 0.00 C ATOM 834 CG ARG A 55 6.946 -4.916 -17.381 1.00 0.00 C ATOM 835 CD ARG A 55 8.371 -4.938 -17.919 1.00 0.00 C ATOM 836 NE ARG A 55 8.539 -5.868 -19.039 1.00 0.00 N ATOM 837 CZ ARG A 55 8.622 -7.196 -18.912 1.00 0.00 C ATOM 838 NH1 ARG A 55 8.484 -7.764 -17.721 1.00 0.00 N ATOM 839 NH2 ARG A 55 8.833 -7.959 -19.980 1.00 0.00 N ATOM 0 H ARG A 55 4.884 -6.453 -17.319 1.00 0.00 H new ATOM 0 HA ARG A 55 4.431 -3.688 -17.172 1.00 0.00 H new ATOM 0 HB2 ARG A 55 5.978 -5.270 -19.261 1.00 0.00 H new ATOM 0 HB3 ARG A 55 6.192 -3.574 -18.874 1.00 0.00 H new ATOM 0 HG2 ARG A 55 6.882 -4.204 -16.558 1.00 0.00 H new ATOM 0 HG3 ARG A 55 6.699 -5.897 -16.974 1.00 0.00 H new ATOM 0 HD2 ARG A 55 8.649 -3.934 -18.241 1.00 0.00 H new ATOM 0 HD3 ARG A 55 9.054 -5.216 -17.116 1.00 0.00 H new ATOM 0 HE ARG A 55 8.596 -5.475 -19.979 1.00 0.00 H new ATOM 0 HH11 ARG A 55 8.314 -7.187 -16.897 1.00 0.00 H new ATOM 0 HH12 ARG A 55 8.548 -8.778 -17.629 1.00 0.00 H new ATOM 0 HH21 ARG A 55 8.932 -7.531 -20.901 1.00 0.00 H new ATOM 0 HH22 ARG A 55 8.896 -8.972 -19.879 1.00 0.00 H new ATOM 853 N TYR A 56 3.005 -5.194 -19.701 1.00 0.00 N ATOM 854 CA TYR A 56 2.026 -5.007 -20.768 1.00 0.00 C ATOM 855 C TYR A 56 0.643 -4.703 -20.196 1.00 0.00 C ATOM 856 O TYR A 56 -0.158 -4.013 -20.822 1.00 0.00 O ATOM 857 CB TYR A 56 1.964 -6.241 -21.668 1.00 0.00 C ATOM 858 CG TYR A 56 3.255 -6.521 -22.402 1.00 0.00 C ATOM 859 CD1 TYR A 56 3.603 -5.796 -23.533 1.00 0.00 C ATOM 860 CD2 TYR A 56 4.125 -7.510 -21.964 1.00 0.00 C ATOM 861 CE1 TYR A 56 4.784 -6.047 -24.205 1.00 0.00 C ATOM 862 CE2 TYR A 56 5.306 -7.767 -22.629 1.00 0.00 C ATOM 863 CZ TYR A 56 5.630 -7.035 -23.750 1.00 0.00 C ATOM 864 OH TYR A 56 6.804 -7.291 -24.413 1.00 0.00 O ATOM 0 H TYR A 56 3.254 -6.166 -19.520 1.00 0.00 H new ATOM 0 HA TYR A 56 2.345 -4.154 -21.367 1.00 0.00 H new ATOM 0 HB2 TYR A 56 1.705 -7.109 -21.062 1.00 0.00 H new ATOM 0 HB3 TYR A 56 1.163 -6.110 -22.396 1.00 0.00 H new ATOM 0 HD1 TYR A 56 2.940 -5.023 -23.894 1.00 0.00 H new ATOM 0 HD2 TYR A 56 3.873 -8.088 -21.087 1.00 0.00 H new ATOM 0 HE1 TYR A 56 5.043 -5.472 -25.082 1.00 0.00 H new ATOM 0 HE2 TYR A 56 5.973 -8.538 -22.273 1.00 0.00 H new ATOM 0 HH TYR A 56 7.283 -8.016 -23.961 1.00 0.00 H new ATOM 874 N SER A 57 0.373 -5.211 -18.999 1.00 0.00 N ATOM 875 CA SER A 57 -0.901 -4.963 -18.335 1.00 0.00 C ATOM 876 C SER A 57 -0.954 -3.527 -17.816 1.00 0.00 C ATOM 877 O SER A 57 -2.029 -2.972 -17.579 1.00 0.00 O ATOM 878 CB SER A 57 -1.090 -5.949 -17.181 1.00 0.00 C ATOM 879 OG SER A 57 -0.922 -7.288 -17.621 1.00 0.00 O ATOM 0 H SER A 57 1.019 -5.796 -18.469 1.00 0.00 H new ATOM 0 HA SER A 57 -1.707 -5.104 -19.055 1.00 0.00 H new ATOM 0 HB2 SER A 57 -0.373 -5.730 -16.390 1.00 0.00 H new ATOM 0 HB3 SER A 57 -2.085 -5.826 -16.752 1.00 0.00 H new ATOM 0 HG SER A 57 -0.933 -7.890 -16.848 1.00 0.00 H new ATOM 885 N LEU A 58 0.221 -2.927 -17.662 1.00 0.00 N ATOM 886 CA LEU A 58 0.337 -1.553 -17.194 1.00 0.00 C ATOM 887 C LEU A 58 0.285 -0.578 -18.367 1.00 0.00 C ATOM 888 O LEU A 58 0.708 0.570 -18.244 1.00 0.00 O ATOM 889 CB LEU A 58 1.650 -1.371 -16.424 1.00 0.00 C ATOM 890 CG LEU A 58 1.799 -2.232 -15.170 1.00 0.00 C ATOM 891 CD1 LEU A 58 3.181 -2.054 -14.563 1.00 0.00 C ATOM 892 CD2 LEU A 58 0.725 -1.883 -14.151 1.00 0.00 C ATOM 0 H LEU A 58 1.115 -3.378 -17.857 1.00 0.00 H new ATOM 0 HA LEU A 58 -0.502 -1.343 -16.530 1.00 0.00 H new ATOM 0 HB2 LEU A 58 2.479 -1.591 -17.096 1.00 0.00 H new ATOM 0 HB3 LEU A 58 1.741 -0.323 -16.138 1.00 0.00 H new ATOM 0 HG LEU A 58 1.678 -3.277 -15.456 1.00 0.00 H new ATOM 0 HD11 LEU A 58 3.269 -2.674 -13.671 1.00 0.00 H new ATOM 0 HD12 LEU A 58 3.938 -2.352 -15.288 1.00 0.00 H new ATOM 0 HD13 LEU A 58 3.328 -1.008 -14.293 1.00 0.00 H new ATOM 0 HD21 LEU A 58 0.848 -2.506 -13.265 1.00 0.00 H new ATOM 0 HD22 LEU A 58 0.816 -0.833 -13.871 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -0.259 -2.059 -14.585 1.00 0.00 H new ATOM 904 N GLN A 59 -0.248 -1.046 -19.496 1.00 0.00 N ATOM 905 CA GLN A 59 -0.354 -0.240 -20.711 1.00 0.00 C ATOM 906 C GLN A 59 -0.979 1.124 -20.429 1.00 0.00 C ATOM 907 O GLN A 59 -0.352 2.160 -20.638 1.00 0.00 O ATOM 908 CB GLN A 59 -1.196 -0.977 -21.753 1.00 0.00 C ATOM 909 CG GLN A 59 -1.389 -0.191 -23.039 1.00 0.00 C ATOM 910 CD GLN A 59 -2.509 -0.740 -23.895 1.00 0.00 C ATOM 911 OE1 GLN A 59 -3.664 -0.340 -23.747 1.00 0.00 O ATOM 912 NE2 GLN A 59 -2.185 -1.651 -24.797 1.00 0.00 N ATOM 0 H GLN A 59 -0.617 -1.992 -19.593 1.00 0.00 H new ATOM 0 HA GLN A 59 0.655 -0.081 -21.091 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -0.720 -1.929 -21.986 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -2.172 -1.205 -21.325 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -1.600 0.850 -22.796 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -0.461 -0.203 -23.610 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -1.216 -1.956 -24.888 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -2.904 -2.049 -25.401 1.00 0.00 H new ATOM 921 N ARG A 60 -2.214 1.113 -19.933 1.00 0.00 N ATOM 922 CA ARG A 60 -2.952 2.348 -19.684 1.00 0.00 C ATOM 923 C ARG A 60 -2.296 3.157 -18.564 1.00 0.00 C ATOM 924 O ARG A 60 -2.517 4.364 -18.442 1.00 0.00 O ATOM 925 CB ARG A 60 -4.406 2.028 -19.325 1.00 0.00 C ATOM 926 CG ARG A 60 -5.350 3.211 -19.481 1.00 0.00 C ATOM 927 CD ARG A 60 -6.773 2.847 -19.088 1.00 0.00 C ATOM 928 NE ARG A 60 -7.263 1.659 -19.796 1.00 0.00 N ATOM 929 CZ ARG A 60 -8.543 1.274 -19.808 1.00 0.00 C ATOM 930 NH1 ARG A 60 -9.482 2.056 -19.289 1.00 0.00 N ATOM 931 NH2 ARG A 60 -8.889 0.133 -20.389 1.00 0.00 N ATOM 0 H ARG A 60 -2.724 0.262 -19.696 1.00 0.00 H new ATOM 0 HA ARG A 60 -2.935 2.949 -20.593 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -4.755 1.211 -19.956 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -4.447 1.675 -18.294 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -5.002 4.039 -18.863 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -5.334 3.556 -20.515 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -6.816 2.670 -18.013 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -7.432 3.689 -19.299 1.00 0.00 H new ATOM 0 HE ARG A 60 -6.587 1.093 -20.309 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -9.228 2.955 -18.879 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -10.457 1.758 -19.300 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -8.178 -0.452 -20.828 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -9.866 -0.159 -20.397 1.00 0.00 H new ATOM 945 N VAL A 61 -1.480 2.484 -17.759 1.00 0.00 N ATOM 946 CA VAL A 61 -0.771 3.136 -16.667 1.00 0.00 C ATOM 947 C VAL A 61 0.387 3.968 -17.210 1.00 0.00 C ATOM 948 O VAL A 61 0.493 5.157 -16.919 1.00 0.00 O ATOM 949 CB VAL A 61 -0.241 2.109 -15.643 1.00 0.00 C ATOM 950 CG1 VAL A 61 0.471 2.805 -14.493 1.00 0.00 C ATOM 951 CG2 VAL A 61 -1.376 1.236 -15.122 1.00 0.00 C ATOM 0 H VAL A 61 -1.294 1.485 -17.844 1.00 0.00 H new ATOM 0 HA VAL A 61 -1.479 3.789 -16.157 1.00 0.00 H new ATOM 0 HB VAL A 61 0.481 1.469 -16.149 1.00 0.00 H new ATOM 0 HG11 VAL A 61 0.835 2.060 -13.786 1.00 0.00 H new ATOM 0 HG12 VAL A 61 1.313 3.379 -14.880 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -0.224 3.476 -13.988 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -0.982 0.519 -14.402 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -2.124 1.863 -14.638 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -1.834 0.701 -15.954 1.00 0.00 H new ATOM 961 N PHE A 62 1.241 3.344 -18.022 1.00 0.00 N ATOM 962 CA PHE A 62 2.352 4.051 -18.657 1.00 0.00 C ATOM 963 C PHE A 62 1.828 5.125 -19.603 1.00 0.00 C ATOM 964 O PHE A 62 2.425 6.194 -19.748 1.00 0.00 O ATOM 965 CB PHE A 62 3.251 3.086 -19.439 1.00 0.00 C ATOM 966 CG PHE A 62 4.095 2.188 -18.579 1.00 0.00 C ATOM 967 CD1 PHE A 62 5.166 2.701 -17.866 1.00 0.00 C ATOM 968 CD2 PHE A 62 3.832 0.831 -18.499 1.00 0.00 C ATOM 969 CE1 PHE A 62 5.957 1.879 -17.089 1.00 0.00 C ATOM 970 CE2 PHE A 62 4.619 0.002 -17.722 1.00 0.00 C ATOM 971 CZ PHE A 62 5.683 0.527 -17.015 1.00 0.00 C ATOM 0 H PHE A 62 1.184 2.353 -18.255 1.00 0.00 H new ATOM 0 HA PHE A 62 2.940 4.515 -17.865 1.00 0.00 H new ATOM 0 HB2 PHE A 62 2.626 2.468 -20.084 1.00 0.00 H new ATOM 0 HB3 PHE A 62 3.906 3.666 -20.090 1.00 0.00 H new ATOM 0 HD1 PHE A 62 5.385 3.757 -17.919 1.00 0.00 H new ATOM 0 HD2 PHE A 62 3.002 0.415 -19.050 1.00 0.00 H new ATOM 0 HE1 PHE A 62 6.790 2.292 -16.539 1.00 0.00 H new ATOM 0 HE2 PHE A 62 4.402 -1.055 -17.668 1.00 0.00 H new ATOM 0 HZ PHE A 62 6.299 -0.118 -16.406 1.00 0.00 H new ATOM 981 N ASP A 63 0.699 4.828 -20.235 1.00 0.00 N ATOM 982 CA ASP A 63 0.075 5.737 -21.191 1.00 0.00 C ATOM 983 C ASP A 63 -0.278 7.073 -20.540 1.00 0.00 C ATOM 984 O ASP A 63 -0.158 8.129 -21.158 1.00 0.00 O ATOM 985 CB ASP A 63 -1.182 5.093 -21.779 1.00 0.00 C ATOM 986 CG ASP A 63 -1.811 5.930 -22.871 1.00 0.00 C ATOM 987 OD1 ASP A 63 -1.249 5.975 -23.987 1.00 0.00 O ATOM 988 OD2 ASP A 63 -2.878 6.526 -22.628 1.00 0.00 O ATOM 0 H ASP A 63 0.191 3.954 -20.101 1.00 0.00 H new ATOM 0 HA ASP A 63 0.791 5.931 -21.989 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -0.929 4.111 -22.180 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -1.910 4.935 -20.983 1.00 0.00 H new ATOM 993 N ASN A 64 -0.691 7.025 -19.280 1.00 0.00 N ATOM 994 CA ASN A 64 -1.100 8.230 -18.568 1.00 0.00 C ATOM 995 C ASN A 64 -0.112 8.572 -17.458 1.00 0.00 C ATOM 996 O ASN A 64 -0.396 9.407 -16.599 1.00 0.00 O ATOM 997 CB ASN A 64 -2.505 8.054 -17.980 1.00 0.00 C ATOM 998 CG ASN A 64 -3.575 7.932 -19.048 1.00 0.00 C ATOM 999 OD1 ASN A 64 -4.109 8.934 -19.522 1.00 0.00 O ATOM 1000 ND2 ASN A 64 -3.904 6.707 -19.428 1.00 0.00 N ATOM 0 H ASN A 64 -0.752 6.168 -18.731 1.00 0.00 H new ATOM 0 HA ASN A 64 -1.114 9.053 -19.283 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -2.522 7.164 -17.351 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -2.734 8.904 -17.337 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -4.623 6.569 -20.138 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -3.438 5.901 -19.011 1.00 0.00 H new ATOM 1007 N ALA A 65 1.067 7.955 -17.507 1.00 0.00 N ATOM 1008 CA ALA A 65 2.072 8.113 -16.455 1.00 0.00 C ATOM 1009 C ALA A 65 2.641 9.529 -16.406 1.00 0.00 C ATOM 1010 O ALA A 65 3.369 9.881 -15.480 1.00 0.00 O ATOM 1011 CB ALA A 65 3.195 7.103 -16.642 1.00 0.00 C ATOM 0 H ALA A 65 1.352 7.338 -18.268 1.00 0.00 H new ATOM 0 HA ALA A 65 1.574 7.930 -15.503 1.00 0.00 H new ATOM 0 HB1 ALA A 65 3.935 7.232 -15.853 1.00 0.00 H new ATOM 0 HB2 ALA A 65 2.787 6.093 -16.596 1.00 0.00 H new ATOM 0 HB3 ALA A 65 3.667 7.260 -17.612 1.00 0.00 H new ATOM 1017 N ASN A 66 2.308 10.341 -17.399 1.00 0.00 N ATOM 1018 CA ASN A 66 2.773 11.722 -17.443 1.00 0.00 C ATOM 1019 C ASN A 66 2.060 12.559 -16.385 1.00 0.00 C ATOM 1020 O ASN A 66 2.597 13.551 -15.893 1.00 0.00 O ATOM 1021 CB ASN A 66 2.552 12.318 -18.836 1.00 0.00 C ATOM 1022 CG ASN A 66 2.970 13.775 -18.919 1.00 0.00 C ATOM 1023 OD1 ASN A 66 2.150 14.680 -18.755 1.00 0.00 O ATOM 1024 ND2 ASN A 66 4.253 14.010 -19.151 1.00 0.00 N ATOM 0 H ASN A 66 1.718 10.069 -18.185 1.00 0.00 H new ATOM 0 HA ASN A 66 3.842 11.733 -17.229 1.00 0.00 H new ATOM 0 HB2 ASN A 66 3.115 11.740 -19.568 1.00 0.00 H new ATOM 0 HB3 ASN A 66 1.499 12.230 -19.102 1.00 0.00 H new ATOM 0 HD21 ASN A 66 4.595 14.970 -19.199 1.00 0.00 H new ATOM 0 HD22 ASN A 66 4.899 13.231 -19.281 1.00 0.00 H new ATOM 1031 N ALA A 67 0.856 12.139 -16.023 1.00 0.00 N ATOM 1032 CA ALA A 67 0.073 12.841 -15.017 1.00 0.00 C ATOM 1033 C ALA A 67 0.168 12.134 -13.673 1.00 0.00 C ATOM 1034 O ALA A 67 -0.448 12.550 -12.692 1.00 0.00 O ATOM 1035 CB ALA A 67 -1.380 12.939 -15.455 1.00 0.00 C ATOM 0 H ALA A 67 0.400 11.314 -16.412 1.00 0.00 H new ATOM 0 HA ALA A 67 0.478 13.847 -14.908 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -1.955 13.466 -14.694 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -1.440 13.484 -16.397 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -1.788 11.937 -15.589 1.00 0.00 H new ATOM 1041 N ILE A 68 0.949 11.065 -13.632 1.00 0.00 N ATOM 1042 CA ILE A 68 1.070 10.262 -12.430 1.00 0.00 C ATOM 1043 C ILE A 68 2.407 10.512 -11.743 1.00 0.00 C ATOM 1044 O ILE A 68 3.468 10.232 -12.299 1.00 0.00 O ATOM 1045 CB ILE A 68 0.927 8.755 -12.734 1.00 0.00 C ATOM 1046 CG1 ILE A 68 -0.391 8.480 -13.468 1.00 0.00 C ATOM 1047 CG2 ILE A 68 0.991 7.950 -11.444 1.00 0.00 C ATOM 1048 CD1 ILE A 68 -0.578 7.028 -13.858 1.00 0.00 C ATOM 0 H ILE A 68 1.508 10.735 -14.419 1.00 0.00 H new ATOM 0 HA ILE A 68 0.259 10.561 -11.766 1.00 0.00 H new ATOM 0 HB ILE A 68 1.752 8.450 -13.378 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -1.222 8.786 -12.832 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -0.432 9.097 -14.366 1.00 0.00 H new ATOM 0 HG21 ILE A 68 0.889 6.889 -11.672 1.00 0.00 H new ATOM 0 HG22 ILE A 68 1.948 8.125 -10.953 1.00 0.00 H new ATOM 0 HG23 ILE A 68 0.182 8.258 -10.782 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -1.531 6.909 -14.373 1.00 0.00 H new ATOM 0 HD12 ILE A 68 0.232 6.722 -14.520 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -0.569 6.407 -12.962 1.00 0.00 H new ATOM 1060 N ASP A 69 2.340 11.068 -10.547 1.00 0.00 N ATOM 1061 CA ASP A 69 3.521 11.274 -9.718 1.00 0.00 C ATOM 1062 C ASP A 69 3.652 10.125 -8.732 1.00 0.00 C ATOM 1063 O ASP A 69 4.716 9.529 -8.584 1.00 0.00 O ATOM 1064 CB ASP A 69 3.415 12.603 -8.965 1.00 0.00 C ATOM 1065 CG ASP A 69 4.522 12.804 -7.948 1.00 0.00 C ATOM 1066 OD1 ASP A 69 5.589 13.337 -8.321 1.00 0.00 O ATOM 1067 OD2 ASP A 69 4.311 12.463 -6.767 1.00 0.00 O ATOM 0 H ASP A 69 1.471 11.389 -10.121 1.00 0.00 H new ATOM 0 HA ASP A 69 4.405 11.307 -10.355 1.00 0.00 H new ATOM 0 HB2 ASP A 69 3.437 13.423 -9.683 1.00 0.00 H new ATOM 0 HB3 ASP A 69 2.451 12.650 -8.458 1.00 0.00 H new ATOM 1072 N THR A 70 2.546 9.804 -8.077 1.00 0.00 N ATOM 1073 CA THR A 70 2.510 8.714 -7.123 1.00 0.00 C ATOM 1074 C THR A 70 1.543 7.634 -7.597 1.00 0.00 C ATOM 1075 O THR A 70 0.429 7.939 -8.022 1.00 0.00 O ATOM 1076 CB THR A 70 2.058 9.204 -5.736 1.00 0.00 C ATOM 1077 OG1 THR A 70 2.700 10.445 -5.416 1.00 0.00 O ATOM 1078 CG2 THR A 70 2.381 8.174 -4.663 1.00 0.00 C ATOM 0 H THR A 70 1.657 10.290 -8.193 1.00 0.00 H new ATOM 0 HA THR A 70 3.519 8.309 -7.047 1.00 0.00 H new ATOM 0 HB THR A 70 0.978 9.350 -5.766 1.00 0.00 H new ATOM 0 HG1 THR A 70 3.544 10.266 -4.951 1.00 0.00 H new ATOM 0 HG21 THR A 70 2.052 8.544 -3.692 1.00 0.00 H new ATOM 0 HG22 THR A 70 1.867 7.240 -4.889 1.00 0.00 H new ATOM 0 HG23 THR A 70 3.457 7.999 -4.639 1.00 0.00 H new ATOM 1086 N LEU A 71 1.969 6.384 -7.529 1.00 0.00 N ATOM 1087 CA LEU A 71 1.124 5.271 -7.924 1.00 0.00 C ATOM 1088 C LEU A 71 0.906 4.333 -6.746 1.00 0.00 C ATOM 1089 O LEU A 71 1.837 3.665 -6.286 1.00 0.00 O ATOM 1090 CB LEU A 71 1.749 4.511 -9.096 1.00 0.00 C ATOM 1091 CG LEU A 71 0.904 3.364 -9.653 1.00 0.00 C ATOM 1092 CD1 LEU A 71 -0.409 3.890 -10.215 1.00 0.00 C ATOM 1093 CD2 LEU A 71 1.672 2.607 -10.723 1.00 0.00 C ATOM 0 H LEU A 71 2.897 6.115 -7.203 1.00 0.00 H new ATOM 0 HA LEU A 71 0.159 5.666 -8.243 1.00 0.00 H new ATOM 0 HB2 LEU A 71 1.949 5.218 -9.901 1.00 0.00 H new ATOM 0 HB3 LEU A 71 2.711 4.111 -8.777 1.00 0.00 H new ATOM 0 HG LEU A 71 0.679 2.677 -8.837 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -0.996 3.059 -10.606 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -0.969 4.389 -9.424 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -0.203 4.599 -11.017 1.00 0.00 H new ATOM 0 HD21 LEU A 71 1.055 1.795 -11.108 1.00 0.00 H new ATOM 0 HD22 LEU A 71 1.927 3.286 -11.537 1.00 0.00 H new ATOM 0 HD23 LEU A 71 2.586 2.196 -10.293 1.00 0.00 H new ATOM 1105 N ILE A 72 -0.321 4.298 -6.252 1.00 0.00 N ATOM 1106 CA ILE A 72 -0.673 3.437 -5.135 1.00 0.00 C ATOM 1107 C ILE A 72 -1.224 2.116 -5.649 1.00 0.00 C ATOM 1108 O ILE A 72 -2.249 2.091 -6.329 1.00 0.00 O ATOM 1109 CB ILE A 72 -1.730 4.090 -4.217 1.00 0.00 C ATOM 1110 CG1 ILE A 72 -1.248 5.456 -3.723 1.00 0.00 C ATOM 1111 CG2 ILE A 72 -2.043 3.180 -3.037 1.00 0.00 C ATOM 1112 CD1 ILE A 72 -2.270 6.183 -2.874 1.00 0.00 C ATOM 0 H ILE A 72 -1.094 4.859 -6.610 1.00 0.00 H new ATOM 0 HA ILE A 72 0.236 3.272 -4.556 1.00 0.00 H new ATOM 0 HB ILE A 72 -2.642 4.237 -4.796 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -0.334 5.323 -3.144 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -0.993 6.076 -4.583 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.789 3.654 -2.400 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -2.430 2.229 -3.403 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -1.134 3.004 -2.462 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -1.863 7.144 -2.558 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -3.177 6.347 -3.457 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -2.507 5.582 -1.996 1.00 0.00 H new ATOM 1124 N VAL A 73 -0.539 1.027 -5.339 1.00 0.00 N ATOM 1125 CA VAL A 73 -0.998 -0.292 -5.739 1.00 0.00 C ATOM 1126 C VAL A 73 -1.650 -1.005 -4.564 1.00 0.00 C ATOM 1127 O VAL A 73 -0.982 -1.358 -3.590 1.00 0.00 O ATOM 1128 CB VAL A 73 0.153 -1.157 -6.296 1.00 0.00 C ATOM 1129 CG1 VAL A 73 -0.338 -2.554 -6.645 1.00 0.00 C ATOM 1130 CG2 VAL A 73 0.773 -0.495 -7.515 1.00 0.00 C ATOM 0 H VAL A 73 0.335 1.031 -4.813 1.00 0.00 H new ATOM 0 HA VAL A 73 -1.730 -0.152 -6.534 1.00 0.00 H new ATOM 0 HB VAL A 73 0.915 -1.247 -5.522 1.00 0.00 H new ATOM 0 HG11 VAL A 73 0.491 -3.144 -7.035 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -0.736 -3.034 -5.751 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -1.122 -2.486 -7.399 1.00 0.00 H new ATOM 0 HG21 VAL A 73 1.583 -1.118 -7.895 1.00 0.00 H new ATOM 0 HG22 VAL A 73 0.015 -0.374 -8.288 1.00 0.00 H new ATOM 0 HG23 VAL A 73 1.167 0.483 -7.237 1.00 0.00 H new ATOM 1140 N GLY A 74 -2.958 -1.186 -4.653 1.00 0.00 N ATOM 1141 CA GLY A 74 -3.681 -1.910 -3.632 1.00 0.00 C ATOM 1142 C GLY A 74 -3.872 -3.356 -4.024 1.00 0.00 C ATOM 1143 O GLY A 74 -4.661 -3.661 -4.919 1.00 0.00 O ATOM 0 H GLY A 74 -3.535 -0.841 -5.420 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -3.138 -1.854 -2.689 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -4.652 -1.443 -3.469 1.00 0.00 H new ATOM 1147 N THR A 75 -3.153 -4.247 -3.357 1.00 0.00 N ATOM 1148 CA THR A 75 -3.140 -5.654 -3.737 1.00 0.00 C ATOM 1149 C THR A 75 -4.315 -6.429 -3.136 1.00 0.00 C ATOM 1150 O THR A 75 -4.388 -7.656 -3.248 1.00 0.00 O ATOM 1151 CB THR A 75 -1.811 -6.310 -3.328 1.00 0.00 C ATOM 1152 OG1 THR A 75 -1.511 -6.000 -1.962 1.00 0.00 O ATOM 1153 CG2 THR A 75 -0.681 -5.827 -4.221 1.00 0.00 C ATOM 0 H THR A 75 -2.571 -4.022 -2.550 1.00 0.00 H new ATOM 0 HA THR A 75 -3.244 -5.692 -4.821 1.00 0.00 H new ATOM 0 HB THR A 75 -1.911 -7.390 -3.440 1.00 0.00 H new ATOM 0 HG1 THR A 75 -1.823 -6.728 -1.385 1.00 0.00 H new ATOM 0 HG21 THR A 75 0.252 -6.302 -3.917 1.00 0.00 H new ATOM 0 HG22 THR A 75 -0.899 -6.087 -5.257 1.00 0.00 H new ATOM 0 HG23 THR A 75 -0.583 -4.745 -4.131 1.00 0.00 H new ATOM 1161 N GLY A 76 -5.232 -5.713 -2.503 1.00 0.00 N ATOM 1162 CA GLY A 76 -6.434 -6.336 -1.994 1.00 0.00 C ATOM 1163 C GLY A 76 -6.273 -6.896 -0.595 1.00 0.00 C ATOM 1164 O GLY A 76 -6.039 -6.152 0.358 1.00 0.00 O ATOM 0 H GLY A 76 -5.164 -4.710 -2.333 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -7.242 -5.604 -1.994 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -6.731 -7.140 -2.668 1.00 0.00 H new ATOM 1168 N ALA A 77 -6.389 -8.215 -0.479 1.00 0.00 N ATOM 1169 CA ALA A 77 -6.409 -8.876 0.823 1.00 0.00 C ATOM 1170 C ALA A 77 -5.026 -9.354 1.246 1.00 0.00 C ATOM 1171 O ALA A 77 -4.765 -9.557 2.433 1.00 0.00 O ATOM 1172 CB ALA A 77 -7.381 -10.048 0.800 1.00 0.00 C ATOM 0 H ALA A 77 -6.471 -8.850 -1.273 1.00 0.00 H new ATOM 0 HA ALA A 77 -6.739 -8.140 1.556 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -7.388 -10.534 1.776 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -8.382 -9.686 0.568 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -7.069 -10.765 0.040 1.00 0.00 H new ATOM 1178 N ASP A 78 -4.139 -9.539 0.283 1.00 0.00 N ATOM 1179 CA ASP A 78 -2.799 -10.020 0.579 1.00 0.00 C ATOM 1180 C ASP A 78 -1.768 -9.094 -0.037 1.00 0.00 C ATOM 1181 O ASP A 78 -2.062 -8.390 -0.998 1.00 0.00 O ATOM 1182 CB ASP A 78 -2.606 -11.449 0.070 1.00 0.00 C ATOM 1183 CG ASP A 78 -1.306 -12.056 0.557 1.00 0.00 C ATOM 1184 OD1 ASP A 78 -1.029 -11.964 1.772 1.00 0.00 O ATOM 1185 OD2 ASP A 78 -0.555 -12.614 -0.263 1.00 0.00 O ATOM 0 H ASP A 78 -4.320 -9.365 -0.706 1.00 0.00 H new ATOM 0 HA ASP A 78 -2.666 -10.028 1.661 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -3.441 -12.067 0.401 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -2.621 -11.450 -1.020 1.00 0.00 H new ATOM 1190 N VAL A 79 -0.568 -9.085 0.522 1.00 0.00 N ATOM 1191 CA VAL A 79 0.469 -8.173 0.069 1.00 0.00 C ATOM 1192 C VAL A 79 1.322 -8.802 -1.027 1.00 0.00 C ATOM 1193 O VAL A 79 2.161 -9.666 -0.763 1.00 0.00 O ATOM 1194 CB VAL A 79 1.385 -7.731 1.228 1.00 0.00 C ATOM 1195 CG1 VAL A 79 2.408 -6.714 0.744 1.00 0.00 C ATOM 1196 CG2 VAL A 79 0.560 -7.162 2.374 1.00 0.00 C ATOM 0 H VAL A 79 -0.289 -9.698 1.288 1.00 0.00 H new ATOM 0 HA VAL A 79 -0.042 -7.298 -0.331 1.00 0.00 H new ATOM 0 HB VAL A 79 1.922 -8.606 1.595 1.00 0.00 H new ATOM 0 HG11 VAL A 79 3.045 -6.414 1.576 1.00 0.00 H new ATOM 0 HG12 VAL A 79 3.021 -7.159 -0.040 1.00 0.00 H new ATOM 0 HG13 VAL A 79 1.892 -5.839 0.349 1.00 0.00 H new ATOM 0 HG21 VAL A 79 1.223 -6.855 3.183 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -0.006 -6.299 2.022 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -0.129 -7.923 2.739 1.00 0.00 H new ATOM 1206 N TRP A 80 1.090 -8.374 -2.256 1.00 0.00 N ATOM 1207 CA TRP A 80 1.909 -8.793 -3.378 1.00 0.00 C ATOM 1208 C TRP A 80 2.950 -7.721 -3.665 1.00 0.00 C ATOM 1209 O TRP A 80 2.612 -6.603 -4.047 1.00 0.00 O ATOM 1210 CB TRP A 80 1.040 -9.045 -4.618 1.00 0.00 C ATOM 1211 CG TRP A 80 1.833 -9.338 -5.859 1.00 0.00 C ATOM 1212 CD1 TRP A 80 2.418 -10.523 -6.199 1.00 0.00 C ATOM 1213 CD2 TRP A 80 2.128 -8.425 -6.924 1.00 0.00 C ATOM 1214 NE1 TRP A 80 3.061 -10.401 -7.407 1.00 0.00 N ATOM 1215 CE2 TRP A 80 2.897 -9.124 -7.872 1.00 0.00 C ATOM 1216 CE3 TRP A 80 1.816 -7.084 -7.168 1.00 0.00 C ATOM 1217 CZ2 TRP A 80 3.359 -8.527 -9.042 1.00 0.00 C ATOM 1218 CZ3 TRP A 80 2.277 -6.492 -8.330 1.00 0.00 C ATOM 1219 CH2 TRP A 80 3.041 -7.215 -9.255 1.00 0.00 C ATOM 0 H TRP A 80 0.336 -7.733 -2.502 1.00 0.00 H new ATOM 0 HA TRP A 80 2.412 -9.727 -3.127 1.00 0.00 H new ATOM 0 HB2 TRP A 80 0.371 -9.882 -4.418 1.00 0.00 H new ATOM 0 HB3 TRP A 80 0.413 -8.171 -4.796 1.00 0.00 H new ATOM 0 HD1 TRP A 80 2.381 -11.425 -5.606 1.00 0.00 H new ATOM 0 HE1 TRP A 80 3.577 -11.142 -7.881 1.00 0.00 H new ATOM 0 HE3 TRP A 80 1.225 -6.520 -6.461 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 3.949 -9.082 -9.757 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 2.044 -5.456 -8.527 1.00 0.00 H new ATOM 0 HH2 TRP A 80 3.386 -6.726 -10.154 1.00 0.00 H new ATOM 1230 N ILE A 81 4.212 -8.050 -3.455 1.00 0.00 N ATOM 1231 CA ILE A 81 5.278 -7.086 -3.655 1.00 0.00 C ATOM 1232 C ILE A 81 5.741 -7.090 -5.109 1.00 0.00 C ATOM 1233 O ILE A 81 6.071 -8.142 -5.669 1.00 0.00 O ATOM 1234 CB ILE A 81 6.472 -7.339 -2.699 1.00 0.00 C ATOM 1235 CG1 ILE A 81 7.579 -6.302 -2.921 1.00 0.00 C ATOM 1236 CG2 ILE A 81 7.023 -8.748 -2.866 1.00 0.00 C ATOM 1237 CD1 ILE A 81 7.159 -4.884 -2.596 1.00 0.00 C ATOM 0 H ILE A 81 4.522 -8.972 -3.148 1.00 0.00 H new ATOM 0 HA ILE A 81 4.876 -6.101 -3.420 1.00 0.00 H new ATOM 0 HB ILE A 81 6.104 -7.238 -1.678 1.00 0.00 H new ATOM 0 HG12 ILE A 81 8.440 -6.566 -2.307 1.00 0.00 H new ATOM 0 HG13 ILE A 81 7.903 -6.346 -3.961 1.00 0.00 H new ATOM 0 HG21 ILE A 81 7.859 -8.895 -2.182 1.00 0.00 H new ATOM 0 HG22 ILE A 81 6.240 -9.473 -2.644 1.00 0.00 H new ATOM 0 HG23 ILE A 81 7.365 -8.886 -3.892 1.00 0.00 H new ATOM 0 HD11 ILE A 81 7.994 -4.207 -2.777 1.00 0.00 H new ATOM 0 HD12 ILE A 81 6.317 -4.600 -3.228 1.00 0.00 H new ATOM 0 HD13 ILE A 81 6.863 -4.823 -1.549 1.00 0.00 H new ATOM 1249 N ALA A 82 5.723 -5.918 -5.723 1.00 0.00 N ATOM 1250 CA ALA A 82 6.166 -5.766 -7.099 1.00 0.00 C ATOM 1251 C ALA A 82 7.641 -6.134 -7.227 1.00 0.00 C ATOM 1252 O ALA A 82 8.468 -5.697 -6.422 1.00 0.00 O ATOM 1253 CB ALA A 82 5.925 -4.340 -7.577 1.00 0.00 C ATOM 0 H ALA A 82 5.404 -5.053 -5.287 1.00 0.00 H new ATOM 0 HA ALA A 82 5.588 -6.443 -7.728 1.00 0.00 H new ATOM 0 HB1 ALA A 82 6.261 -4.240 -8.609 1.00 0.00 H new ATOM 0 HB2 ALA A 82 4.861 -4.112 -7.519 1.00 0.00 H new ATOM 0 HB3 ALA A 82 6.480 -3.646 -6.946 1.00 0.00 H new ATOM 1259 N PRO A 83 7.979 -6.960 -8.232 1.00 0.00 N ATOM 1260 CA PRO A 83 9.357 -7.400 -8.473 1.00 0.00 C ATOM 1261 C PRO A 83 10.317 -6.224 -8.621 1.00 0.00 C ATOM 1262 O PRO A 83 9.924 -5.145 -9.077 1.00 0.00 O ATOM 1263 CB PRO A 83 9.262 -8.188 -9.781 1.00 0.00 C ATOM 1264 CG PRO A 83 7.839 -8.621 -9.864 1.00 0.00 C ATOM 1265 CD PRO A 83 7.039 -7.533 -9.210 1.00 0.00 C ATOM 0 HA PRO A 83 9.750 -7.986 -7.642 1.00 0.00 H new ATOM 0 HB2 PRO A 83 9.538 -7.570 -10.636 1.00 0.00 H new ATOM 0 HB3 PRO A 83 9.936 -9.045 -9.776 1.00 0.00 H new ATOM 0 HG2 PRO A 83 7.533 -8.761 -10.901 1.00 0.00 H new ATOM 0 HG3 PRO A 83 7.691 -9.574 -9.356 1.00 0.00 H new ATOM 0 HD2 PRO A 83 6.707 -6.788 -9.933 1.00 0.00 H new ATOM 0 HD3 PRO A 83 6.145 -7.927 -8.726 1.00 0.00 H new ATOM 1273 N ARG A 84 11.568 -6.443 -8.228 1.00 0.00 N ATOM 1274 CA ARG A 84 12.585 -5.395 -8.231 1.00 0.00 C ATOM 1275 C ARG A 84 12.658 -4.676 -9.574 1.00 0.00 C ATOM 1276 O ARG A 84 12.639 -3.450 -9.619 1.00 0.00 O ATOM 1277 CB ARG A 84 13.960 -5.979 -7.883 1.00 0.00 C ATOM 1278 CG ARG A 84 15.065 -4.932 -7.838 1.00 0.00 C ATOM 1279 CD ARG A 84 14.914 -4.005 -6.643 1.00 0.00 C ATOM 1280 NE ARG A 84 15.462 -4.590 -5.417 1.00 0.00 N ATOM 1281 CZ ARG A 84 14.747 -4.862 -4.327 1.00 0.00 C ATOM 1282 NH1 ARG A 84 13.431 -4.692 -4.330 1.00 0.00 N ATOM 1283 NH2 ARG A 84 15.349 -5.327 -3.238 1.00 0.00 N ATOM 0 H ARG A 84 11.905 -7.348 -7.900 1.00 0.00 H new ATOM 0 HA ARG A 84 12.297 -4.666 -7.473 1.00 0.00 H new ATOM 0 HB2 ARG A 84 13.901 -6.477 -6.915 1.00 0.00 H new ATOM 0 HB3 ARG A 84 14.220 -6.741 -8.618 1.00 0.00 H new ATOM 0 HG2 ARG A 84 16.035 -5.428 -7.793 1.00 0.00 H new ATOM 0 HG3 ARG A 84 15.049 -4.346 -8.757 1.00 0.00 H new ATOM 0 HD2 ARG A 84 15.419 -3.062 -6.851 1.00 0.00 H new ATOM 0 HD3 ARG A 84 13.859 -3.776 -6.494 1.00 0.00 H new ATOM 0 HE ARG A 84 16.459 -4.804 -5.397 1.00 0.00 H new ATOM 0 HH11 ARG A 84 12.963 -4.352 -5.170 1.00 0.00 H new ATOM 0 HH12 ARG A 84 12.888 -4.902 -3.493 1.00 0.00 H new ATOM 0 HH21 ARG A 84 16.358 -5.475 -3.237 1.00 0.00 H new ATOM 0 HH22 ARG A 84 14.802 -5.536 -2.403 1.00 0.00 H new ATOM 1297 N GLN A 85 12.734 -5.439 -10.661 1.00 0.00 N ATOM 1298 CA GLN A 85 12.865 -4.855 -11.993 1.00 0.00 C ATOM 1299 C GLN A 85 11.656 -3.988 -12.334 1.00 0.00 C ATOM 1300 O GLN A 85 11.806 -2.871 -12.816 1.00 0.00 O ATOM 1301 CB GLN A 85 13.046 -5.939 -13.064 1.00 0.00 C ATOM 1302 CG GLN A 85 14.382 -6.667 -12.999 1.00 0.00 C ATOM 1303 CD GLN A 85 14.442 -7.706 -11.896 1.00 0.00 C ATOM 1304 OE1 GLN A 85 14.816 -7.411 -10.764 1.00 0.00 O ATOM 1305 NE2 GLN A 85 14.087 -8.935 -12.224 1.00 0.00 N ATOM 0 H GLN A 85 12.707 -6.459 -10.646 1.00 0.00 H new ATOM 0 HA GLN A 85 13.756 -4.227 -11.982 1.00 0.00 H new ATOM 0 HB2 GLN A 85 12.243 -6.669 -12.965 1.00 0.00 H new ATOM 0 HB3 GLN A 85 12.942 -5.482 -14.048 1.00 0.00 H new ATOM 0 HG2 GLN A 85 14.572 -7.152 -13.957 1.00 0.00 H new ATOM 0 HG3 GLN A 85 15.179 -5.939 -12.847 1.00 0.00 H new ATOM 0 HE21 GLN A 85 13.782 -9.141 -13.175 1.00 0.00 H new ATOM 0 HE22 GLN A 85 14.118 -9.678 -11.526 1.00 0.00 H new ATOM 1314 N LEU A 86 10.462 -4.506 -12.071 1.00 0.00 N ATOM 1315 CA LEU A 86 9.229 -3.768 -12.334 1.00 0.00 C ATOM 1316 C LEU A 86 9.182 -2.484 -11.507 1.00 0.00 C ATOM 1317 O LEU A 86 8.830 -1.417 -12.012 1.00 0.00 O ATOM 1318 CB LEU A 86 8.011 -4.643 -12.020 1.00 0.00 C ATOM 1319 CG LEU A 86 6.651 -4.011 -12.324 1.00 0.00 C ATOM 1320 CD1 LEU A 86 6.523 -3.704 -13.807 1.00 0.00 C ATOM 1321 CD2 LEU A 86 5.526 -4.928 -11.872 1.00 0.00 C ATOM 0 H LEU A 86 10.320 -5.435 -11.675 1.00 0.00 H new ATOM 0 HA LEU A 86 9.208 -3.499 -13.390 1.00 0.00 H new ATOM 0 HB2 LEU A 86 8.096 -5.571 -12.586 1.00 0.00 H new ATOM 0 HB3 LEU A 86 8.040 -4.911 -10.964 1.00 0.00 H new ATOM 0 HG LEU A 86 6.577 -3.074 -11.772 1.00 0.00 H new ATOM 0 HD11 LEU A 86 5.549 -3.255 -14.003 1.00 0.00 H new ATOM 0 HD12 LEU A 86 7.309 -3.010 -14.104 1.00 0.00 H new ATOM 0 HD13 LEU A 86 6.619 -4.627 -14.379 1.00 0.00 H new ATOM 0 HD21 LEU A 86 4.566 -4.463 -12.096 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.599 -5.880 -12.397 1.00 0.00 H new ATOM 0 HD23 LEU A 86 5.605 -5.099 -10.798 1.00 0.00 H new ATOM 1333 N ARG A 87 9.556 -2.601 -10.238 1.00 0.00 N ATOM 1334 CA ARG A 87 9.572 -1.465 -9.322 1.00 0.00 C ATOM 1335 C ARG A 87 10.600 -0.429 -9.775 1.00 0.00 C ATOM 1336 O ARG A 87 10.359 0.778 -9.725 1.00 0.00 O ATOM 1337 CB ARG A 87 9.914 -1.949 -7.909 1.00 0.00 C ATOM 1338 CG ARG A 87 9.656 -0.924 -6.817 1.00 0.00 C ATOM 1339 CD ARG A 87 10.112 -1.445 -5.464 1.00 0.00 C ATOM 1340 NE ARG A 87 9.687 -0.585 -4.360 1.00 0.00 N ATOM 1341 CZ ARG A 87 10.357 -0.461 -3.215 1.00 0.00 C ATOM 1342 NH1 ARG A 87 11.528 -1.067 -3.054 1.00 0.00 N ATOM 1343 NH2 ARG A 87 9.856 0.277 -2.236 1.00 0.00 N ATOM 0 H ARG A 87 9.855 -3.480 -9.816 1.00 0.00 H new ATOM 0 HA ARG A 87 8.586 -1.001 -9.320 1.00 0.00 H new ATOM 0 HB2 ARG A 87 9.333 -2.846 -7.694 1.00 0.00 H new ATOM 0 HB3 ARG A 87 10.965 -2.236 -7.880 1.00 0.00 H new ATOM 0 HG2 ARG A 87 10.182 0.002 -7.050 1.00 0.00 H new ATOM 0 HG3 ARG A 87 8.593 -0.686 -6.780 1.00 0.00 H new ATOM 0 HD2 ARG A 87 9.715 -2.449 -5.312 1.00 0.00 H new ATOM 0 HD3 ARG A 87 11.199 -1.528 -5.458 1.00 0.00 H new ATOM 0 HE ARG A 87 8.827 -0.048 -4.473 1.00 0.00 H new ATOM 0 HH11 ARG A 87 11.919 -1.631 -3.809 1.00 0.00 H new ATOM 0 HH12 ARG A 87 12.037 -0.969 -2.175 1.00 0.00 H new ATOM 0 HH21 ARG A 87 8.960 0.748 -2.360 1.00 0.00 H new ATOM 0 HH22 ARG A 87 10.366 0.374 -1.358 1.00 0.00 H new ATOM 1357 N GLU A 88 11.741 -0.924 -10.225 1.00 0.00 N ATOM 1358 CA GLU A 88 12.853 -0.082 -10.634 1.00 0.00 C ATOM 1359 C GLU A 88 12.544 0.590 -11.975 1.00 0.00 C ATOM 1360 O GLU A 88 12.922 1.741 -12.208 1.00 0.00 O ATOM 1361 CB GLU A 88 14.114 -0.950 -10.717 1.00 0.00 C ATOM 1362 CG GLU A 88 15.422 -0.196 -10.552 1.00 0.00 C ATOM 1363 CD GLU A 88 15.921 0.419 -11.840 1.00 0.00 C ATOM 1364 OE1 GLU A 88 15.899 -0.273 -12.880 1.00 0.00 O ATOM 1365 OE2 GLU A 88 16.354 1.588 -11.810 1.00 0.00 O ATOM 0 H GLU A 88 11.923 -1.923 -10.317 1.00 0.00 H new ATOM 0 HA GLU A 88 13.015 0.712 -9.905 1.00 0.00 H new ATOM 0 HB2 GLU A 88 14.057 -1.722 -9.949 1.00 0.00 H new ATOM 0 HB3 GLU A 88 14.124 -1.459 -11.681 1.00 0.00 H new ATOM 0 HG2 GLU A 88 15.289 0.590 -9.809 1.00 0.00 H new ATOM 0 HG3 GLU A 88 16.180 -0.877 -10.164 1.00 0.00 H new ATOM 1372 N ALA A 89 11.837 -0.129 -12.841 1.00 0.00 N ATOM 1373 CA ALA A 89 11.425 0.406 -14.133 1.00 0.00 C ATOM 1374 C ALA A 89 10.461 1.572 -13.951 1.00 0.00 C ATOM 1375 O ALA A 89 10.591 2.602 -14.610 1.00 0.00 O ATOM 1376 CB ALA A 89 10.786 -0.683 -14.981 1.00 0.00 C ATOM 0 H ALA A 89 11.536 -1.089 -12.670 1.00 0.00 H new ATOM 0 HA ALA A 89 12.312 0.772 -14.649 1.00 0.00 H new ATOM 0 HB1 ALA A 89 10.484 -0.266 -15.942 1.00 0.00 H new ATOM 0 HB2 ALA A 89 11.505 -1.486 -15.143 1.00 0.00 H new ATOM 0 HB3 ALA A 89 9.910 -1.078 -14.466 1.00 0.00 H new ATOM 1382 N LEU A 90 9.502 1.407 -13.044 1.00 0.00 N ATOM 1383 CA LEU A 90 8.541 2.464 -12.744 1.00 0.00 C ATOM 1384 C LEU A 90 9.247 3.680 -12.155 1.00 0.00 C ATOM 1385 O LEU A 90 8.875 4.822 -12.432 1.00 0.00 O ATOM 1386 CB LEU A 90 7.462 1.959 -11.785 1.00 0.00 C ATOM 1387 CG LEU A 90 6.528 0.896 -12.367 1.00 0.00 C ATOM 1388 CD1 LEU A 90 5.534 0.425 -11.320 1.00 0.00 C ATOM 1389 CD2 LEU A 90 5.793 1.441 -13.580 1.00 0.00 C ATOM 0 H LEU A 90 9.370 0.552 -12.504 1.00 0.00 H new ATOM 0 HA LEU A 90 8.061 2.760 -13.677 1.00 0.00 H new ATOM 0 HB2 LEU A 90 7.947 1.550 -10.899 1.00 0.00 H new ATOM 0 HB3 LEU A 90 6.862 2.808 -11.457 1.00 0.00 H new ATOM 0 HG LEU A 90 7.133 0.044 -12.678 1.00 0.00 H new ATOM 0 HD11 LEU A 90 4.879 -0.331 -11.754 1.00 0.00 H new ATOM 0 HD12 LEU A 90 6.072 -0.003 -10.474 1.00 0.00 H new ATOM 0 HD13 LEU A 90 4.936 1.271 -10.979 1.00 0.00 H new ATOM 0 HD21 LEU A 90 5.133 0.672 -13.981 1.00 0.00 H new ATOM 0 HD22 LEU A 90 5.203 2.309 -13.288 1.00 0.00 H new ATOM 0 HD23 LEU A 90 6.515 1.733 -14.342 1.00 0.00 H new ATOM 1401 N ARG A 91 10.278 3.425 -11.357 1.00 0.00 N ATOM 1402 CA ARG A 91 11.108 4.489 -10.808 1.00 0.00 C ATOM 1403 C ARG A 91 11.774 5.278 -11.937 1.00 0.00 C ATOM 1404 O ARG A 91 11.962 6.489 -11.838 1.00 0.00 O ATOM 1405 CB ARG A 91 12.168 3.902 -9.869 1.00 0.00 C ATOM 1406 CG ARG A 91 13.175 4.922 -9.372 1.00 0.00 C ATOM 1407 CD ARG A 91 14.234 4.283 -8.489 1.00 0.00 C ATOM 1408 NE ARG A 91 15.312 5.220 -8.181 1.00 0.00 N ATOM 1409 CZ ARG A 91 16.355 4.938 -7.403 1.00 0.00 C ATOM 1410 NH1 ARG A 91 16.444 3.764 -6.789 1.00 0.00 N ATOM 1411 NH2 ARG A 91 17.302 5.847 -7.214 1.00 0.00 N ATOM 0 H ARG A 91 10.559 2.486 -11.075 1.00 0.00 H new ATOM 0 HA ARG A 91 10.475 5.168 -10.237 1.00 0.00 H new ATOM 0 HB2 ARG A 91 11.670 3.449 -9.012 1.00 0.00 H new ATOM 0 HB3 ARG A 91 12.699 3.104 -10.388 1.00 0.00 H new ATOM 0 HG2 ARG A 91 13.654 5.405 -10.224 1.00 0.00 H new ATOM 0 HG3 ARG A 91 12.657 5.702 -8.813 1.00 0.00 H new ATOM 0 HD2 ARG A 91 13.776 3.937 -7.563 1.00 0.00 H new ATOM 0 HD3 ARG A 91 14.645 3.406 -8.989 1.00 0.00 H new ATOM 0 HE ARG A 91 15.262 6.153 -8.590 1.00 0.00 H new ATOM 0 HH11 ARG A 91 15.709 3.068 -6.911 1.00 0.00 H new ATOM 0 HH12 ARG A 91 17.248 3.559 -6.195 1.00 0.00 H new ATOM 0 HH21 ARG A 91 17.230 6.759 -7.664 1.00 0.00 H new ATOM 0 HH22 ARG A 91 18.102 5.634 -6.618 1.00 0.00 H new ATOM 1425 N GLY A 92 12.095 4.582 -13.021 1.00 0.00 N ATOM 1426 CA GLY A 92 12.726 5.218 -14.164 1.00 0.00 C ATOM 1427 C GLY A 92 11.776 6.121 -14.924 1.00 0.00 C ATOM 1428 O GLY A 92 12.201 6.946 -15.733 1.00 0.00 O ATOM 0 H GLY A 92 11.928 3.582 -13.130 1.00 0.00 H new ATOM 0 HA2 GLY A 92 13.582 5.801 -13.824 1.00 0.00 H new ATOM 0 HA3 GLY A 92 13.109 4.451 -14.837 1.00 0.00 H new ATOM 1432 N VAL A 93 10.485 5.957 -14.669 1.00 0.00 N ATOM 1433 CA VAL A 93 9.464 6.796 -15.282 1.00 0.00 C ATOM 1434 C VAL A 93 9.126 7.954 -14.339 1.00 0.00 C ATOM 1435 O VAL A 93 8.249 8.774 -14.618 1.00 0.00 O ATOM 1436 CB VAL A 93 8.185 5.980 -15.602 1.00 0.00 C ATOM 1437 CG1 VAL A 93 7.242 6.760 -16.510 1.00 0.00 C ATOM 1438 CG2 VAL A 93 8.543 4.644 -16.238 1.00 0.00 C ATOM 0 H VAL A 93 10.118 5.245 -14.037 1.00 0.00 H new ATOM 0 HA VAL A 93 9.854 7.187 -16.222 1.00 0.00 H new ATOM 0 HB VAL A 93 7.670 5.793 -14.660 1.00 0.00 H new ATOM 0 HG11 VAL A 93 6.355 6.160 -16.715 1.00 0.00 H new ATOM 0 HG12 VAL A 93 6.947 7.687 -16.018 1.00 0.00 H new ATOM 0 HG13 VAL A 93 7.748 6.992 -17.447 1.00 0.00 H new ATOM 0 HG21 VAL A 93 7.631 4.088 -16.454 1.00 0.00 H new ATOM 0 HG22 VAL A 93 9.091 4.817 -17.164 1.00 0.00 H new ATOM 0 HG23 VAL A 93 9.164 4.069 -15.551 1.00 0.00 H new ATOM 1448 N ASN A 94 9.856 8.006 -13.219 1.00 0.00 N ATOM 1449 CA ASN A 94 9.682 9.035 -12.188 1.00 0.00 C ATOM 1450 C ASN A 94 8.382 8.834 -11.421 1.00 0.00 C ATOM 1451 O ASN A 94 7.909 9.737 -10.732 1.00 0.00 O ATOM 1452 CB ASN A 94 9.731 10.450 -12.783 1.00 0.00 C ATOM 1453 CG ASN A 94 11.110 10.829 -13.282 1.00 0.00 C ATOM 1454 OD1 ASN A 94 11.926 11.368 -12.534 1.00 0.00 O ATOM 1455 ND2 ASN A 94 11.380 10.564 -14.549 1.00 0.00 N ATOM 0 H ASN A 94 10.589 7.331 -13.001 1.00 0.00 H new ATOM 0 HA ASN A 94 10.515 8.931 -11.493 1.00 0.00 H new ATOM 0 HB2 ASN A 94 9.020 10.518 -13.607 1.00 0.00 H new ATOM 0 HB3 ASN A 94 9.413 11.168 -12.027 1.00 0.00 H new ATOM 0 HD21 ASN A 94 12.291 10.807 -14.938 1.00 0.00 H new ATOM 0 HD22 ASN A 94 10.677 10.116 -15.137 1.00 0.00 H new ATOM 1462 N VAL A 95 7.828 7.635 -11.517 1.00 0.00 N ATOM 1463 CA VAL A 95 6.586 7.316 -10.837 1.00 0.00 C ATOM 1464 C VAL A 95 6.871 6.708 -9.467 1.00 0.00 C ATOM 1465 O VAL A 95 7.504 5.655 -9.363 1.00 0.00 O ATOM 1466 CB VAL A 95 5.721 6.342 -11.667 1.00 0.00 C ATOM 1467 CG1 VAL A 95 4.420 6.025 -10.948 1.00 0.00 C ATOM 1468 CG2 VAL A 95 5.441 6.921 -13.045 1.00 0.00 C ATOM 0 H VAL A 95 8.221 6.867 -12.061 1.00 0.00 H new ATOM 0 HA VAL A 95 6.031 8.246 -10.713 1.00 0.00 H new ATOM 0 HB VAL A 95 6.277 5.412 -11.788 1.00 0.00 H new ATOM 0 HG11 VAL A 95 3.828 5.337 -11.552 1.00 0.00 H new ATOM 0 HG12 VAL A 95 4.639 5.565 -9.985 1.00 0.00 H new ATOM 0 HG13 VAL A 95 3.858 6.945 -10.790 1.00 0.00 H new ATOM 0 HG21 VAL A 95 4.830 6.222 -13.616 1.00 0.00 H new ATOM 0 HG22 VAL A 95 4.909 7.867 -12.941 1.00 0.00 H new ATOM 0 HG23 VAL A 95 6.383 7.090 -13.567 1.00 0.00 H new ATOM 1478 N VAL A 96 6.421 7.385 -8.422 1.00 0.00 N ATOM 1479 CA VAL A 96 6.601 6.902 -7.061 1.00 0.00 C ATOM 1480 C VAL A 96 5.662 5.731 -6.794 1.00 0.00 C ATOM 1481 O VAL A 96 4.466 5.916 -6.566 1.00 0.00 O ATOM 1482 CB VAL A 96 6.347 8.016 -6.021 1.00 0.00 C ATOM 1483 CG1 VAL A 96 6.583 7.507 -4.606 1.00 0.00 C ATOM 1484 CG2 VAL A 96 7.226 9.224 -6.309 1.00 0.00 C ATOM 0 H VAL A 96 5.926 8.274 -8.491 1.00 0.00 H new ATOM 0 HA VAL A 96 7.636 6.576 -6.961 1.00 0.00 H new ATOM 0 HB VAL A 96 5.303 8.320 -6.099 1.00 0.00 H new ATOM 0 HG11 VAL A 96 6.397 8.311 -3.894 1.00 0.00 H new ATOM 0 HG12 VAL A 96 5.907 6.677 -4.400 1.00 0.00 H new ATOM 0 HG13 VAL A 96 7.614 7.168 -4.509 1.00 0.00 H new ATOM 0 HG21 VAL A 96 7.034 9.999 -5.567 1.00 0.00 H new ATOM 0 HG22 VAL A 96 8.275 8.930 -6.264 1.00 0.00 H new ATOM 0 HG23 VAL A 96 7.000 9.610 -7.303 1.00 0.00 H new ATOM 1494 N LEU A 97 6.208 4.526 -6.854 1.00 0.00 N ATOM 1495 CA LEU A 97 5.425 3.315 -6.656 1.00 0.00 C ATOM 1496 C LEU A 97 5.403 2.908 -5.187 1.00 0.00 C ATOM 1497 O LEU A 97 6.449 2.836 -4.539 1.00 0.00 O ATOM 1498 CB LEU A 97 6.004 2.170 -7.487 1.00 0.00 C ATOM 1499 CG LEU A 97 5.290 0.827 -7.324 1.00 0.00 C ATOM 1500 CD1 LEU A 97 3.915 0.874 -7.967 1.00 0.00 C ATOM 1501 CD2 LEU A 97 6.126 -0.299 -7.907 1.00 0.00 C ATOM 0 H LEU A 97 7.197 4.360 -7.040 1.00 0.00 H new ATOM 0 HA LEU A 97 4.404 3.523 -6.977 1.00 0.00 H new ATOM 0 HB2 LEU A 97 5.976 2.454 -8.539 1.00 0.00 H new ATOM 0 HB3 LEU A 97 7.053 2.041 -7.220 1.00 0.00 H new ATOM 0 HG LEU A 97 5.160 0.632 -6.260 1.00 0.00 H new ATOM 0 HD11 LEU A 97 3.422 -0.090 -7.841 1.00 0.00 H new ATOM 0 HD12 LEU A 97 3.318 1.652 -7.492 1.00 0.00 H new ATOM 0 HD13 LEU A 97 4.018 1.093 -9.030 1.00 0.00 H new ATOM 0 HD21 LEU A 97 5.600 -1.245 -7.781 1.00 0.00 H new ATOM 0 HD22 LEU A 97 6.294 -0.116 -8.968 1.00 0.00 H new ATOM 0 HD23 LEU A 97 7.085 -0.345 -7.391 1.00 0.00 H new ATOM 1513 N ASP A 98 4.213 2.641 -4.667 1.00 0.00 N ATOM 1514 CA ASP A 98 4.073 2.101 -3.322 1.00 0.00 C ATOM 1515 C ASP A 98 3.013 1.007 -3.308 1.00 0.00 C ATOM 1516 O ASP A 98 1.939 1.161 -3.893 1.00 0.00 O ATOM 1517 CB ASP A 98 3.715 3.199 -2.318 1.00 0.00 C ATOM 1518 CG ASP A 98 3.744 2.693 -0.888 1.00 0.00 C ATOM 1519 OD1 ASP A 98 4.854 2.492 -0.348 1.00 0.00 O ATOM 1520 OD2 ASP A 98 2.666 2.471 -0.305 1.00 0.00 O ATOM 0 H ASP A 98 3.330 2.790 -5.156 1.00 0.00 H new ATOM 0 HA ASP A 98 5.031 1.675 -3.025 1.00 0.00 H new ATOM 0 HB2 ASP A 98 4.414 4.029 -2.423 1.00 0.00 H new ATOM 0 HB3 ASP A 98 2.722 3.588 -2.545 1.00 0.00 H new ATOM 1525 N THR A 99 3.334 -0.108 -2.669 1.00 0.00 N ATOM 1526 CA THR A 99 2.417 -1.230 -2.583 1.00 0.00 C ATOM 1527 C THR A 99 1.830 -1.326 -1.179 1.00 0.00 C ATOM 1528 O THR A 99 2.569 -1.422 -0.195 1.00 0.00 O ATOM 1529 CB THR A 99 3.125 -2.550 -2.941 1.00 0.00 C ATOM 1530 OG1 THR A 99 3.825 -2.400 -4.184 1.00 0.00 O ATOM 1531 CG2 THR A 99 2.121 -3.685 -3.056 1.00 0.00 C ATOM 0 H THR A 99 4.228 -0.258 -2.201 1.00 0.00 H new ATOM 0 HA THR A 99 1.613 -1.062 -3.299 1.00 0.00 H new ATOM 0 HB THR A 99 3.832 -2.790 -2.147 1.00 0.00 H new ATOM 0 HG1 THR A 99 4.276 -3.240 -4.409 1.00 0.00 H new ATOM 0 HG21 THR A 99 2.643 -4.608 -3.310 1.00 0.00 H new ATOM 0 HG22 THR A 99 1.603 -3.810 -2.105 1.00 0.00 H new ATOM 0 HG23 THR A 99 1.396 -3.452 -3.836 1.00 0.00 H new ATOM 1539 N MET A 100 0.507 -1.308 -1.093 1.00 0.00 N ATOM 1540 CA MET A 100 -0.173 -1.271 0.190 1.00 0.00 C ATOM 1541 C MET A 100 -1.487 -2.046 0.110 1.00 0.00 C ATOM 1542 O MET A 100 -1.951 -2.387 -0.983 1.00 0.00 O ATOM 1543 CB MET A 100 -0.439 0.192 0.574 1.00 0.00 C ATOM 1544 CG MET A 100 -0.854 0.399 2.021 1.00 0.00 C ATOM 1545 SD MET A 100 -1.267 2.119 2.381 1.00 0.00 S ATOM 1546 CE MET A 100 0.253 2.946 1.918 1.00 0.00 C ATOM 0 H MET A 100 -0.116 -1.319 -1.900 1.00 0.00 H new ATOM 0 HA MET A 100 0.454 -1.737 0.950 1.00 0.00 H new ATOM 0 HB2 MET A 100 0.462 0.774 0.381 1.00 0.00 H new ATOM 0 HB3 MET A 100 -1.220 0.588 -0.075 1.00 0.00 H new ATOM 0 HG2 MET A 100 -1.714 -0.232 2.243 1.00 0.00 H new ATOM 0 HG3 MET A 100 -0.045 0.078 2.677 1.00 0.00 H new ATOM 0 HE1 MET A 100 0.287 3.931 2.383 1.00 0.00 H new ATOM 0 HE2 MET A 100 1.105 2.356 2.255 1.00 0.00 H new ATOM 0 HE3 MET A 100 0.292 3.055 0.834 1.00 0.00 H new ATOM 1556 N GLN A 101 -2.072 -2.349 1.262 1.00 0.00 N ATOM 1557 CA GLN A 101 -3.392 -2.958 1.298 1.00 0.00 C ATOM 1558 C GLN A 101 -4.450 -1.897 1.033 1.00 0.00 C ATOM 1559 O GLN A 101 -4.263 -0.733 1.386 1.00 0.00 O ATOM 1560 CB GLN A 101 -3.641 -3.646 2.641 1.00 0.00 C ATOM 1561 CG GLN A 101 -2.708 -4.819 2.899 1.00 0.00 C ATOM 1562 CD GLN A 101 -3.056 -5.584 4.160 1.00 0.00 C ATOM 1563 OE1 GLN A 101 -3.570 -5.018 5.127 1.00 0.00 O ATOM 1564 NE2 GLN A 101 -2.782 -6.879 4.153 1.00 0.00 N ATOM 0 H GLN A 101 -1.655 -2.184 2.178 1.00 0.00 H new ATOM 0 HA GLN A 101 -3.449 -3.720 0.521 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -3.525 -2.916 3.442 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -4.672 -3.997 2.676 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -2.742 -5.498 2.047 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -1.684 -4.453 2.973 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -2.356 -7.306 3.330 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -2.997 -7.450 4.970 1.00 0.00 H new ATOM 1573 N THR A 102 -5.555 -2.305 0.425 1.00 0.00 N ATOM 1574 CA THR A 102 -6.568 -1.374 -0.061 1.00 0.00 C ATOM 1575 C THR A 102 -7.065 -0.410 1.022 1.00 0.00 C ATOM 1576 O THR A 102 -7.218 0.779 0.762 1.00 0.00 O ATOM 1577 CB THR A 102 -7.759 -2.142 -0.652 1.00 0.00 C ATOM 1578 OG1 THR A 102 -7.272 -3.216 -1.473 1.00 0.00 O ATOM 1579 CG2 THR A 102 -8.634 -1.217 -1.483 1.00 0.00 C ATOM 0 H THR A 102 -5.776 -3.286 0.254 1.00 0.00 H new ATOM 0 HA THR A 102 -6.089 -0.773 -0.834 1.00 0.00 H new ATOM 0 HB THR A 102 -8.359 -2.544 0.164 1.00 0.00 H new ATOM 0 HG1 THR A 102 -8.012 -3.817 -1.698 1.00 0.00 H new ATOM 0 HG21 THR A 102 -9.472 -1.780 -1.893 1.00 0.00 H new ATOM 0 HG22 THR A 102 -9.011 -0.411 -0.854 1.00 0.00 H new ATOM 0 HG23 THR A 102 -8.046 -0.796 -2.299 1.00 0.00 H new ATOM 1587 N GLY A 103 -7.294 -0.918 2.231 1.00 0.00 N ATOM 1588 CA GLY A 103 -7.816 -0.085 3.312 1.00 0.00 C ATOM 1589 C GLY A 103 -6.962 1.150 3.586 1.00 0.00 C ATOM 1590 O GLY A 103 -7.402 2.282 3.346 1.00 0.00 O ATOM 0 H GLY A 103 -7.129 -1.892 2.485 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -8.829 0.230 3.062 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -7.883 -0.682 4.222 1.00 0.00 H new ATOM 1594 N PRO A 104 -5.729 0.966 4.092 1.00 0.00 N ATOM 1595 CA PRO A 104 -4.804 2.078 4.341 1.00 0.00 C ATOM 1596 C PRO A 104 -4.498 2.866 3.068 1.00 0.00 C ATOM 1597 O PRO A 104 -4.202 4.061 3.121 1.00 0.00 O ATOM 1598 CB PRO A 104 -3.538 1.391 4.870 1.00 0.00 C ATOM 1599 CG PRO A 104 -3.999 0.066 5.371 1.00 0.00 C ATOM 1600 CD PRO A 104 -5.145 -0.330 4.486 1.00 0.00 C ATOM 0 HA PRO A 104 -5.221 2.807 5.036 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -2.792 1.278 4.083 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -3.075 1.975 5.666 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -3.197 -0.670 5.325 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -4.313 0.130 6.413 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -4.807 -0.899 3.620 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -5.866 -0.953 5.015 1.00 0.00 H new ATOM 1608 N ALA A 105 -4.580 2.190 1.923 1.00 0.00 N ATOM 1609 CA ALA A 105 -4.374 2.841 0.636 1.00 0.00 C ATOM 1610 C ALA A 105 -5.467 3.870 0.377 1.00 0.00 C ATOM 1611 O ALA A 105 -5.191 4.961 -0.118 1.00 0.00 O ATOM 1612 CB ALA A 105 -4.332 1.817 -0.488 1.00 0.00 C ATOM 0 H ALA A 105 -4.788 1.193 1.863 1.00 0.00 H new ATOM 0 HA ALA A 105 -3.413 3.355 0.666 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -4.177 2.327 -1.439 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -3.514 1.118 -0.313 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -5.275 1.271 -0.518 1.00 0.00 H new ATOM 1618 N ILE A 106 -6.702 3.521 0.726 1.00 0.00 N ATOM 1619 CA ILE A 106 -7.830 4.437 0.601 1.00 0.00 C ATOM 1620 C ILE A 106 -7.584 5.696 1.427 1.00 0.00 C ATOM 1621 O ILE A 106 -7.787 6.816 0.947 1.00 0.00 O ATOM 1622 CB ILE A 106 -9.154 3.774 1.052 1.00 0.00 C ATOM 1623 CG1 ILE A 106 -9.518 2.619 0.115 1.00 0.00 C ATOM 1624 CG2 ILE A 106 -10.284 4.797 1.100 1.00 0.00 C ATOM 1625 CD1 ILE A 106 -10.731 1.827 0.563 1.00 0.00 C ATOM 0 H ILE A 106 -6.947 2.604 1.100 1.00 0.00 H new ATOM 0 HA ILE A 106 -7.921 4.702 -0.452 1.00 0.00 H new ATOM 0 HB ILE A 106 -9.012 3.377 2.057 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -9.704 3.017 -0.882 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -8.665 1.945 0.035 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -11.204 4.308 1.419 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -10.029 5.588 1.806 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -10.427 5.228 0.109 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -10.927 1.027 -0.150 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -10.542 1.398 1.547 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -11.597 2.487 0.615 1.00 0.00 H new ATOM 1637 N ARG A 107 -7.132 5.510 2.664 1.00 0.00 N ATOM 1638 CA ARG A 107 -6.831 6.644 3.535 1.00 0.00 C ATOM 1639 C ARG A 107 -5.692 7.485 2.966 1.00 0.00 C ATOM 1640 O ARG A 107 -5.818 8.700 2.837 1.00 0.00 O ATOM 1641 CB ARG A 107 -6.469 6.182 4.947 1.00 0.00 C ATOM 1642 CG ARG A 107 -7.620 5.539 5.696 1.00 0.00 C ATOM 1643 CD ARG A 107 -7.258 5.296 7.152 1.00 0.00 C ATOM 1644 NE ARG A 107 -8.318 4.600 7.877 1.00 0.00 N ATOM 1645 CZ ARG A 107 -8.486 4.663 9.195 1.00 0.00 C ATOM 1646 NH1 ARG A 107 -7.739 5.477 9.929 1.00 0.00 N ATOM 1647 NH2 ARG A 107 -9.428 3.930 9.774 1.00 0.00 N ATOM 0 H ARG A 107 -6.967 4.595 3.083 1.00 0.00 H new ATOM 0 HA ARG A 107 -7.732 7.255 3.588 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -5.645 5.471 4.886 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -6.110 7.038 5.518 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -8.499 6.181 5.639 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -7.884 4.594 5.221 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -6.340 4.710 7.203 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -7.054 6.250 7.638 1.00 0.00 H new ATOM 0 HE ARG A 107 -8.970 4.030 7.339 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -7.030 6.060 9.483 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -7.873 5.520 10.939 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -10.020 3.321 9.209 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -9.560 3.975 10.784 1.00 0.00 H new ATOM 1661 N THR A 108 -4.591 6.830 2.617 1.00 0.00 N ATOM 1662 CA THR A 108 -3.417 7.523 2.099 1.00 0.00 C ATOM 1663 C THR A 108 -3.742 8.248 0.788 1.00 0.00 C ATOM 1664 O THR A 108 -3.262 9.359 0.543 1.00 0.00 O ATOM 1665 CB THR A 108 -2.252 6.536 1.881 1.00 0.00 C ATOM 1666 OG1 THR A 108 -2.044 5.765 3.073 1.00 0.00 O ATOM 1667 CG2 THR A 108 -0.969 7.272 1.529 1.00 0.00 C ATOM 0 H THR A 108 -4.486 5.818 2.683 1.00 0.00 H new ATOM 0 HA THR A 108 -3.115 8.264 2.839 1.00 0.00 H new ATOM 0 HB THR A 108 -2.514 5.879 1.052 1.00 0.00 H new ATOM 0 HG1 THR A 108 -2.691 5.029 3.104 1.00 0.00 H new ATOM 0 HG21 THR A 108 -0.165 6.551 1.381 1.00 0.00 H new ATOM 0 HG22 THR A 108 -1.117 7.844 0.613 1.00 0.00 H new ATOM 0 HG23 THR A 108 -0.704 7.950 2.341 1.00 0.00 H new ATOM 1675 N TYR A 109 -4.572 7.622 -0.041 1.00 0.00 N ATOM 1676 CA TYR A 109 -5.029 8.233 -1.283 1.00 0.00 C ATOM 1677 C TYR A 109 -5.813 9.506 -0.993 1.00 0.00 C ATOM 1678 O TYR A 109 -5.561 10.547 -1.595 1.00 0.00 O ATOM 1679 CB TYR A 109 -5.893 7.242 -2.072 1.00 0.00 C ATOM 1680 CG TYR A 109 -6.587 7.836 -3.277 1.00 0.00 C ATOM 1681 CD1 TYR A 109 -5.866 8.269 -4.383 1.00 0.00 C ATOM 1682 CD2 TYR A 109 -7.971 7.963 -3.306 1.00 0.00 C ATOM 1683 CE1 TYR A 109 -6.505 8.809 -5.483 1.00 0.00 C ATOM 1684 CE2 TYR A 109 -8.615 8.500 -4.400 1.00 0.00 C ATOM 1685 CZ TYR A 109 -7.880 8.921 -5.487 1.00 0.00 C ATOM 1686 OH TYR A 109 -8.526 9.459 -6.574 1.00 0.00 O ATOM 0 H TYR A 109 -4.943 6.687 0.127 1.00 0.00 H new ATOM 0 HA TYR A 109 -4.158 8.494 -1.884 1.00 0.00 H new ATOM 0 HB2 TYR A 109 -5.265 6.414 -2.402 1.00 0.00 H new ATOM 0 HB3 TYR A 109 -6.646 6.824 -1.404 1.00 0.00 H new ATOM 0 HD1 TYR A 109 -4.789 8.182 -4.383 1.00 0.00 H new ATOM 0 HD2 TYR A 109 -8.552 7.635 -2.457 1.00 0.00 H new ATOM 0 HE1 TYR A 109 -5.931 9.142 -6.335 1.00 0.00 H new ATOM 0 HE2 TYR A 109 -9.691 8.590 -4.405 1.00 0.00 H new ATOM 0 HH TYR A 109 -9.432 9.729 -6.316 1.00 0.00 H new ATOM 1696 N ASN A 110 -6.740 9.417 -0.044 1.00 0.00 N ATOM 1697 CA ASN A 110 -7.577 10.554 0.340 1.00 0.00 C ATOM 1698 C ASN A 110 -6.725 11.723 0.839 1.00 0.00 C ATOM 1699 O ASN A 110 -7.100 12.887 0.696 1.00 0.00 O ATOM 1700 CB ASN A 110 -8.582 10.122 1.417 1.00 0.00 C ATOM 1701 CG ASN A 110 -9.457 11.259 1.915 1.00 0.00 C ATOM 1702 OD1 ASN A 110 -9.135 11.922 2.901 1.00 0.00 O ATOM 1703 ND2 ASN A 110 -10.574 11.492 1.239 1.00 0.00 N ATOM 0 H ASN A 110 -6.933 8.562 0.478 1.00 0.00 H new ATOM 0 HA ASN A 110 -8.123 10.893 -0.541 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -9.218 9.333 1.015 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -8.039 9.695 2.260 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -11.200 12.242 1.531 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -10.807 10.921 0.427 1.00 0.00 H new ATOM 1710 N ILE A 111 -5.571 11.410 1.408 1.00 0.00 N ATOM 1711 CA ILE A 111 -4.662 12.437 1.894 1.00 0.00 C ATOM 1712 C ILE A 111 -3.891 13.079 0.739 1.00 0.00 C ATOM 1713 O ILE A 111 -3.883 14.304 0.588 1.00 0.00 O ATOM 1714 CB ILE A 111 -3.657 11.862 2.918 1.00 0.00 C ATOM 1715 CG1 ILE A 111 -4.404 11.238 4.100 1.00 0.00 C ATOM 1716 CG2 ILE A 111 -2.702 12.949 3.399 1.00 0.00 C ATOM 1717 CD1 ILE A 111 -3.504 10.510 5.077 1.00 0.00 C ATOM 0 H ILE A 111 -5.242 10.454 1.545 1.00 0.00 H new ATOM 0 HA ILE A 111 -5.272 13.195 2.385 1.00 0.00 H new ATOM 0 HB ILE A 111 -3.069 11.084 2.430 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -4.943 12.022 4.632 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -5.150 10.541 3.719 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -2.002 12.526 4.119 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -2.150 13.350 2.549 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -3.271 13.749 3.873 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -4.105 10.095 5.886 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -2.984 9.703 4.561 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -2.774 11.207 5.488 1.00 0.00 H new ATOM 1729 N MET A 112 -3.267 12.248 -0.090 1.00 0.00 N ATOM 1730 CA MET A 112 -2.383 12.745 -1.139 1.00 0.00 C ATOM 1731 C MET A 112 -3.153 13.294 -2.339 1.00 0.00 C ATOM 1732 O MET A 112 -2.603 14.073 -3.124 1.00 0.00 O ATOM 1733 CB MET A 112 -1.417 11.651 -1.602 1.00 0.00 C ATOM 1734 CG MET A 112 -0.447 11.196 -0.524 1.00 0.00 C ATOM 1735 SD MET A 112 0.838 10.098 -1.164 1.00 0.00 S ATOM 1736 CE MET A 112 -0.149 8.777 -1.857 1.00 0.00 C ATOM 0 H MET A 112 -3.356 11.232 -0.057 1.00 0.00 H new ATOM 0 HA MET A 112 -1.817 13.568 -0.703 1.00 0.00 H new ATOM 0 HB2 MET A 112 -1.993 10.792 -1.946 1.00 0.00 H new ATOM 0 HB3 MET A 112 -0.850 12.018 -2.457 1.00 0.00 H new ATOM 0 HG2 MET A 112 0.020 12.069 -0.069 1.00 0.00 H new ATOM 0 HG3 MET A 112 -0.999 10.683 0.263 1.00 0.00 H new ATOM 0 HE1 MET A 112 0.265 7.816 -1.553 1.00 0.00 H new ATOM 0 HE2 MET A 112 -1.174 8.861 -1.496 1.00 0.00 H new ATOM 0 HE3 MET A 112 -0.140 8.848 -2.945 1.00 0.00 H new ATOM 1746 N ILE A 113 -4.413 12.896 -2.489 1.00 0.00 N ATOM 1747 CA ILE A 113 -5.231 13.382 -3.600 1.00 0.00 C ATOM 1748 C ILE A 113 -5.444 14.890 -3.488 1.00 0.00 C ATOM 1749 O ILE A 113 -5.473 15.597 -4.493 1.00 0.00 O ATOM 1750 CB ILE A 113 -6.600 12.655 -3.691 1.00 0.00 C ATOM 1751 CG1 ILE A 113 -7.360 13.077 -4.955 1.00 0.00 C ATOM 1752 CG2 ILE A 113 -7.448 12.924 -2.456 1.00 0.00 C ATOM 1753 CD1 ILE A 113 -6.650 12.711 -6.242 1.00 0.00 C ATOM 0 H ILE A 113 -4.888 12.245 -1.863 1.00 0.00 H new ATOM 0 HA ILE A 113 -4.684 13.161 -4.517 1.00 0.00 H new ATOM 0 HB ILE A 113 -6.401 11.585 -3.745 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -8.345 12.611 -4.949 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -7.517 14.155 -4.931 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -8.401 12.402 -2.548 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -6.923 12.568 -1.570 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -7.628 13.995 -2.365 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -7.246 13.040 -7.093 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -5.676 13.199 -6.271 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -6.517 11.630 -6.289 1.00 0.00 H new ATOM 1765 N GLY A 114 -5.565 15.379 -2.262 1.00 0.00 N ATOM 1766 CA GLY A 114 -5.710 16.802 -2.047 1.00 0.00 C ATOM 1767 C GLY A 114 -4.367 17.494 -1.945 1.00 0.00 C ATOM 1768 O GLY A 114 -4.255 18.691 -2.199 1.00 0.00 O ATOM 0 H GLY A 114 -5.565 14.814 -1.413 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -6.282 17.237 -2.866 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -6.279 16.976 -1.134 1.00 0.00 H new ATOM 1772 N GLU A 115 -3.346 16.725 -1.591 1.00 0.00 N ATOM 1773 CA GLU A 115 -2.003 17.256 -1.414 1.00 0.00 C ATOM 1774 C GLU A 115 -1.379 17.610 -2.765 1.00 0.00 C ATOM 1775 O GLU A 115 -1.226 18.786 -3.100 1.00 0.00 O ATOM 1776 CB GLU A 115 -1.144 16.225 -0.664 1.00 0.00 C ATOM 1777 CG GLU A 115 0.143 16.779 -0.057 1.00 0.00 C ATOM 1778 CD GLU A 115 1.207 17.103 -1.086 1.00 0.00 C ATOM 1779 OE1 GLU A 115 1.811 16.162 -1.641 1.00 0.00 O ATOM 1780 OE2 GLU A 115 1.445 18.300 -1.346 1.00 0.00 O ATOM 0 H GLU A 115 -3.425 15.723 -1.420 1.00 0.00 H new ATOM 0 HA GLU A 115 -2.053 18.172 -0.825 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -1.744 15.785 0.133 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -0.887 15.419 -1.352 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -0.091 17.681 0.509 1.00 0.00 H new ATOM 0 HG3 GLU A 115 0.543 16.053 0.651 1.00 0.00 H new ATOM 1787 N ARG A 116 -1.046 16.591 -3.549 1.00 0.00 N ATOM 1788 CA ARG A 116 -0.348 16.801 -4.811 1.00 0.00 C ATOM 1789 C ARG A 116 -1.301 16.767 -6.001 1.00 0.00 C ATOM 1790 O ARG A 116 -1.037 17.398 -7.019 1.00 0.00 O ATOM 1791 CB ARG A 116 0.766 15.763 -4.994 1.00 0.00 C ATOM 1792 CG ARG A 116 0.364 14.343 -4.627 1.00 0.00 C ATOM 1793 CD ARG A 116 1.499 13.358 -4.869 1.00 0.00 C ATOM 1794 NE ARG A 116 2.746 13.776 -4.229 1.00 0.00 N ATOM 1795 CZ ARG A 116 3.415 13.047 -3.334 1.00 0.00 C ATOM 1796 NH1 ARG A 116 2.941 11.877 -2.931 1.00 0.00 N ATOM 1797 NH2 ARG A 116 4.572 13.486 -2.861 1.00 0.00 N ATOM 0 H ARG A 116 -1.247 15.615 -3.334 1.00 0.00 H new ATOM 0 HA ARG A 116 0.097 17.795 -4.771 1.00 0.00 H new ATOM 0 HB2 ARG A 116 1.094 15.778 -6.033 1.00 0.00 H new ATOM 0 HB3 ARG A 116 1.622 16.055 -4.386 1.00 0.00 H new ATOM 0 HG2 ARG A 116 0.068 14.308 -3.578 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -0.506 14.048 -5.214 1.00 0.00 H new ATOM 0 HD2 ARG A 116 1.211 12.377 -4.492 1.00 0.00 H new ATOM 0 HD3 ARG A 116 1.662 13.252 -5.942 1.00 0.00 H new ATOM 0 HE ARG A 116 3.130 14.686 -4.484 1.00 0.00 H new ATOM 0 HH11 ARG A 116 2.059 11.528 -3.305 1.00 0.00 H new ATOM 0 HH12 ARG A 116 3.458 11.326 -2.246 1.00 0.00 H new ATOM 0 HH21 ARG A 116 4.948 14.378 -3.181 1.00 0.00 H new ATOM 0 HH22 ARG A 116 5.087 12.932 -2.177 1.00 0.00 H new ATOM 1811 N ARG A 117 -2.405 16.027 -5.867 1.00 0.00 N ATOM 1812 CA ARG A 117 -3.384 15.858 -6.955 1.00 0.00 C ATOM 1813 C ARG A 117 -2.792 15.072 -8.133 1.00 0.00 C ATOM 1814 O ARG A 117 -3.444 14.892 -9.158 1.00 0.00 O ATOM 1815 CB ARG A 117 -3.927 17.210 -7.464 1.00 0.00 C ATOM 1816 CG ARG A 117 -4.909 17.899 -6.525 1.00 0.00 C ATOM 1817 CD ARG A 117 -4.210 18.600 -5.371 1.00 0.00 C ATOM 1818 NE ARG A 117 -3.415 19.744 -5.815 1.00 0.00 N ATOM 1819 CZ ARG A 117 -3.110 20.787 -5.041 1.00 0.00 C ATOM 1820 NH1 ARG A 117 -3.531 20.839 -3.784 1.00 0.00 N ATOM 1821 NH2 ARG A 117 -2.382 21.783 -5.527 1.00 0.00 N ATOM 0 H ARG A 117 -2.648 15.530 -5.010 1.00 0.00 H new ATOM 0 HA ARG A 117 -4.212 15.291 -6.530 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -3.086 17.880 -7.642 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -4.416 17.050 -8.425 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -5.496 18.626 -7.087 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -5.608 17.162 -6.130 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -4.954 18.936 -4.649 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -3.564 17.890 -4.855 1.00 0.00 H new ATOM 0 HE ARG A 117 -3.072 19.745 -6.776 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -4.092 20.078 -3.402 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -3.293 21.640 -3.199 1.00 0.00 H new ATOM 0 HH21 ARG A 117 -2.055 21.752 -6.493 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -2.149 22.580 -4.935 1.00 0.00 H new ATOM 1835 N ARG A 118 -1.563 14.590 -7.976 1.00 0.00 N ATOM 1836 CA ARG A 118 -0.885 13.857 -9.041 1.00 0.00 C ATOM 1837 C ARG A 118 -0.790 12.382 -8.683 1.00 0.00 C ATOM 1838 O ARG A 118 0.105 11.673 -9.137 1.00 0.00 O ATOM 1839 CB ARG A 118 0.530 14.400 -9.256 1.00 0.00 C ATOM 1840 CG ARG A 118 0.639 15.912 -9.242 1.00 0.00 C ATOM 1841 CD ARG A 118 2.092 16.344 -9.336 1.00 0.00 C ATOM 1842 NE ARG A 118 2.303 17.684 -8.795 1.00 0.00 N ATOM 1843 CZ ARG A 118 3.458 18.103 -8.278 1.00 0.00 C ATOM 1844 NH1 ARG A 118 4.525 17.311 -8.290 1.00 0.00 N ATOM 1845 NH2 ARG A 118 3.550 19.323 -7.766 1.00 0.00 N ATOM 0 H ARG A 118 -1.016 14.694 -7.122 1.00 0.00 H new ATOM 0 HA ARG A 118 -1.465 13.982 -9.956 1.00 0.00 H new ATOM 0 HB2 ARG A 118 1.181 13.996 -8.481 1.00 0.00 H new ATOM 0 HB3 ARG A 118 0.904 14.031 -10.211 1.00 0.00 H new ATOM 0 HG2 ARG A 118 0.075 16.330 -10.076 1.00 0.00 H new ATOM 0 HG3 ARG A 118 0.195 16.306 -8.327 1.00 0.00 H new ATOM 0 HD2 ARG A 118 2.717 15.633 -8.796 1.00 0.00 H new ATOM 0 HD3 ARG A 118 2.410 16.320 -10.378 1.00 0.00 H new ATOM 0 HE ARG A 118 1.520 18.338 -8.814 1.00 0.00 H new ATOM 0 HH11 ARG A 118 4.463 16.377 -8.696 1.00 0.00 H new ATOM 0 HH12 ARG A 118 5.406 17.637 -7.893 1.00 0.00 H new ATOM 0 HH21 ARG A 118 2.737 19.940 -7.768 1.00 0.00 H new ATOM 0 HH22 ARG A 118 4.433 19.645 -7.370 1.00 0.00 H new ATOM 1859 N VAL A 119 -1.716 11.923 -7.867 1.00 0.00 N ATOM 1860 CA VAL A 119 -1.665 10.564 -7.363 1.00 0.00 C ATOM 1861 C VAL A 119 -2.703 9.688 -8.051 1.00 0.00 C ATOM 1862 O VAL A 119 -3.861 10.076 -8.199 1.00 0.00 O ATOM 1863 CB VAL A 119 -1.861 10.528 -5.827 1.00 0.00 C ATOM 1864 CG1 VAL A 119 -3.183 11.165 -5.427 1.00 0.00 C ATOM 1865 CG2 VAL A 119 -1.766 9.103 -5.299 1.00 0.00 C ATOM 0 H VAL A 119 -2.512 12.469 -7.538 1.00 0.00 H new ATOM 0 HA VAL A 119 -0.675 10.167 -7.589 1.00 0.00 H new ATOM 0 HB VAL A 119 -1.058 11.111 -5.376 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -3.293 11.125 -4.343 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -3.200 12.204 -5.756 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -4.005 10.623 -5.895 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -1.907 9.105 -4.218 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -2.538 8.490 -5.764 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -0.785 8.692 -5.536 1.00 0.00 H new ATOM 1875 N ALA A 120 -2.269 8.520 -8.494 1.00 0.00 N ATOM 1876 CA ALA A 120 -3.155 7.560 -9.121 1.00 0.00 C ATOM 1877 C ALA A 120 -3.231 6.304 -8.270 1.00 0.00 C ATOM 1878 O ALA A 120 -2.211 5.818 -7.772 1.00 0.00 O ATOM 1879 CB ALA A 120 -2.676 7.228 -10.525 1.00 0.00 C ATOM 0 H ALA A 120 -1.298 8.214 -8.429 1.00 0.00 H new ATOM 0 HA ALA A 120 -4.151 7.995 -9.200 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -3.354 6.506 -10.979 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -2.657 8.136 -11.127 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -1.673 6.804 -10.476 1.00 0.00 H new ATOM 1885 N ALA A 121 -4.432 5.785 -8.093 1.00 0.00 N ATOM 1886 CA ALA A 121 -4.631 4.613 -7.259 1.00 0.00 C ATOM 1887 C ALA A 121 -5.106 3.427 -8.084 1.00 0.00 C ATOM 1888 O ALA A 121 -6.168 3.471 -8.703 1.00 0.00 O ATOM 1889 CB ALA A 121 -5.621 4.914 -6.145 1.00 0.00 C ATOM 0 H ALA A 121 -5.284 6.155 -8.515 1.00 0.00 H new ATOM 0 HA ALA A 121 -3.671 4.352 -6.813 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -5.758 4.025 -5.530 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -5.238 5.727 -5.528 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -6.578 5.207 -6.578 1.00 0.00 H new ATOM 1895 N ALA A 122 -4.303 2.375 -8.097 1.00 0.00 N ATOM 1896 CA ALA A 122 -4.668 1.136 -8.756 1.00 0.00 C ATOM 1897 C ALA A 122 -5.068 0.110 -7.706 1.00 0.00 C ATOM 1898 O ALA A 122 -4.216 -0.545 -7.102 1.00 0.00 O ATOM 1899 CB ALA A 122 -3.516 0.618 -9.607 1.00 0.00 C ATOM 0 H ALA A 122 -3.385 2.358 -7.653 1.00 0.00 H new ATOM 0 HA ALA A 122 -5.513 1.317 -9.420 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -3.812 -0.312 -10.092 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -3.263 1.358 -10.366 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -2.648 0.437 -8.973 1.00 0.00 H new ATOM 1905 N LEU A 123 -6.362 0.001 -7.466 1.00 0.00 N ATOM 1906 CA LEU A 123 -6.860 -0.852 -6.397 1.00 0.00 C ATOM 1907 C LEU A 123 -7.555 -2.084 -6.959 1.00 0.00 C ATOM 1908 O LEU A 123 -8.457 -1.975 -7.794 1.00 0.00 O ATOM 1909 CB LEU A 123 -7.824 -0.069 -5.500 1.00 0.00 C ATOM 1910 CG LEU A 123 -7.231 1.169 -4.818 1.00 0.00 C ATOM 1911 CD1 LEU A 123 -8.291 1.884 -3.995 1.00 0.00 C ATOM 1912 CD2 LEU A 123 -6.050 0.784 -3.940 1.00 0.00 C ATOM 0 H LEU A 123 -7.086 0.489 -7.993 1.00 0.00 H new ATOM 0 HA LEU A 123 -6.008 -1.182 -5.803 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -8.679 0.242 -6.100 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -8.203 -0.741 -4.730 1.00 0.00 H new ATOM 0 HG LEU A 123 -6.877 1.849 -5.593 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -7.852 2.760 -3.518 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -9.108 2.196 -4.646 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -8.674 1.209 -3.230 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -5.643 1.677 -3.465 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -6.380 0.083 -3.173 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -5.279 0.316 -4.552 1.00 0.00 H new ATOM 1924 N ILE A 124 -7.120 -3.251 -6.510 1.00 0.00 N ATOM 1925 CA ILE A 124 -7.732 -4.506 -6.913 1.00 0.00 C ATOM 1926 C ILE A 124 -8.655 -5.011 -5.807 1.00 0.00 C ATOM 1927 O ILE A 124 -8.341 -4.887 -4.621 1.00 0.00 O ATOM 1928 CB ILE A 124 -6.662 -5.580 -7.226 1.00 0.00 C ATOM 1929 CG1 ILE A 124 -5.670 -5.054 -8.268 1.00 0.00 C ATOM 1930 CG2 ILE A 124 -7.315 -6.865 -7.723 1.00 0.00 C ATOM 1931 CD1 ILE A 124 -4.549 -6.022 -8.585 1.00 0.00 C ATOM 0 H ILE A 124 -6.339 -3.354 -5.862 1.00 0.00 H new ATOM 0 HA ILE A 124 -8.308 -4.323 -7.820 1.00 0.00 H new ATOM 0 HB ILE A 124 -6.122 -5.802 -6.306 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -6.210 -4.824 -9.187 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -5.240 -4.119 -7.908 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -6.544 -7.606 -7.937 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -7.987 -7.251 -6.957 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -7.881 -6.658 -8.631 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -3.887 -5.581 -9.330 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -3.984 -6.234 -7.677 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -4.968 -6.949 -8.976 1.00 0.00 H new ATOM 1943 N ALA A 125 -9.799 -5.554 -6.196 1.00 0.00 N ATOM 1944 CA ALA A 125 -10.757 -6.081 -5.240 1.00 0.00 C ATOM 1945 C ALA A 125 -10.298 -7.431 -4.698 1.00 0.00 C ATOM 1946 O ALA A 125 -9.587 -8.174 -5.375 1.00 0.00 O ATOM 1947 CB ALA A 125 -12.130 -6.208 -5.882 1.00 0.00 C ATOM 0 H ALA A 125 -10.086 -5.641 -7.171 1.00 0.00 H new ATOM 0 HA ALA A 125 -10.824 -5.384 -4.405 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -12.837 -6.604 -5.153 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -12.467 -5.227 -6.218 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -12.072 -6.884 -6.735 1.00 0.00 H new ATOM 1953 N VAL A 126 -10.711 -7.737 -3.475 1.00 0.00 N ATOM 1954 CA VAL A 126 -10.328 -8.982 -2.825 1.00 0.00 C ATOM 1955 C VAL A 126 -10.927 -10.196 -3.536 1.00 0.00 C ATOM 1956 O VAL A 126 -12.101 -10.196 -3.914 1.00 0.00 O ATOM 1957 CB VAL A 126 -10.755 -9.002 -1.339 1.00 0.00 C ATOM 1958 CG1 VAL A 126 -9.974 -7.970 -0.545 1.00 0.00 C ATOM 1959 CG2 VAL A 126 -12.251 -8.760 -1.194 1.00 0.00 C ATOM 0 H VAL A 126 -11.314 -7.137 -2.912 1.00 0.00 H new ATOM 0 HA VAL A 126 -9.241 -9.038 -2.883 1.00 0.00 H new ATOM 0 HB VAL A 126 -10.532 -9.992 -0.941 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -10.289 -7.999 0.498 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -8.909 -8.192 -0.609 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -10.163 -6.977 -0.953 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -12.522 -8.780 -0.138 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -12.505 -7.788 -1.616 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -12.799 -9.539 -1.724 1.00 0.00 H new ATOM 1969 N PRO A 127 -10.114 -11.243 -3.742 1.00 0.00 N ATOM 1970 CA PRO A 127 -10.580 -12.505 -4.306 1.00 0.00 C ATOM 1971 C PRO A 127 -11.402 -13.289 -3.288 1.00 0.00 C ATOM 1972 O PRO A 127 -10.898 -14.196 -2.626 1.00 0.00 O ATOM 1973 CB PRO A 127 -9.289 -13.261 -4.663 1.00 0.00 C ATOM 1974 CG PRO A 127 -8.173 -12.288 -4.452 1.00 0.00 C ATOM 1975 CD PRO A 127 -8.676 -11.276 -3.462 1.00 0.00 C ATOM 0 HA PRO A 127 -11.230 -12.358 -5.168 1.00 0.00 H new ATOM 0 HB2 PRO A 127 -9.164 -14.141 -4.032 1.00 0.00 H new ATOM 0 HB3 PRO A 127 -9.313 -13.610 -5.695 1.00 0.00 H new ATOM 0 HG2 PRO A 127 -7.284 -12.793 -4.074 1.00 0.00 H new ATOM 0 HG3 PRO A 127 -7.893 -11.808 -5.390 1.00 0.00 H new ATOM 0 HD2 PRO A 127 -8.470 -11.577 -2.435 1.00 0.00 H new ATOM 0 HD3 PRO A 127 -8.212 -10.301 -3.608 1.00 0.00 H new ATOM 1983 N LEU A 128 -12.668 -12.913 -3.151 1.00 0.00 N ATOM 1984 CA LEU A 128 -13.563 -13.546 -2.189 1.00 0.00 C ATOM 1985 C LEU A 128 -13.854 -14.990 -2.591 1.00 0.00 C ATOM 1986 O LEU A 128 -14.297 -15.799 -1.776 1.00 0.00 O ATOM 1987 CB LEU A 128 -14.867 -12.748 -2.085 1.00 0.00 C ATOM 1988 CG LEU A 128 -15.844 -13.219 -1.005 1.00 0.00 C ATOM 1989 CD1 LEU A 128 -15.211 -13.120 0.376 1.00 0.00 C ATOM 1990 CD2 LEU A 128 -17.125 -12.402 -1.061 1.00 0.00 C ATOM 0 H LEU A 128 -13.100 -12.168 -3.698 1.00 0.00 H new ATOM 0 HA LEU A 128 -13.075 -13.556 -1.214 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -14.619 -11.704 -1.895 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -15.373 -12.785 -3.050 1.00 0.00 H new ATOM 0 HG LEU A 128 -16.087 -14.265 -1.194 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -15.923 -13.460 1.128 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -14.319 -13.745 0.413 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -14.937 -12.084 0.577 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -17.811 -12.747 -0.288 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -16.893 -11.350 -0.897 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -17.591 -12.522 -2.039 1.00 0.00 H new ATOM 2002 N GLU A 129 -13.578 -15.312 -3.845 1.00 0.00 N ATOM 2003 CA GLU A 129 -13.798 -16.653 -4.361 1.00 0.00 C ATOM 2004 C GLU A 129 -12.542 -17.510 -4.215 1.00 0.00 C ATOM 2005 O GLU A 129 -12.502 -18.645 -4.688 1.00 0.00 O ATOM 2006 CB GLU A 129 -14.273 -16.588 -5.819 1.00 0.00 C ATOM 2007 CG GLU A 129 -13.690 -15.428 -6.622 1.00 0.00 C ATOM 2008 CD GLU A 129 -12.271 -15.667 -7.094 1.00 0.00 C ATOM 2009 OE1 GLU A 129 -11.335 -15.569 -6.275 1.00 0.00 O ATOM 2010 OE2 GLU A 129 -12.085 -15.934 -8.300 1.00 0.00 O ATOM 0 H GLU A 129 -13.198 -14.657 -4.528 1.00 0.00 H new ATOM 0 HA GLU A 129 -14.582 -17.129 -3.772 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -14.014 -17.523 -6.315 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -15.360 -16.512 -5.831 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -14.325 -15.242 -7.488 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -13.713 -14.526 -6.010 1.00 0.00 H new ATOM 2017 N HIS A 130 -11.527 -16.935 -3.553 1.00 0.00 N ATOM 2018 CA HIS A 130 -10.260 -17.613 -3.208 1.00 0.00 C ATOM 2019 C HIS A 130 -9.658 -18.387 -4.387 1.00 0.00 C ATOM 2020 O HIS A 130 -8.858 -19.303 -4.198 1.00 0.00 O ATOM 2021 CB HIS A 130 -10.433 -18.535 -1.975 1.00 0.00 C ATOM 2022 CG HIS A 130 -11.128 -19.850 -2.226 1.00 0.00 C ATOM 2023 ND1 HIS A 130 -10.448 -21.011 -2.525 1.00 0.00 N ATOM 2024 CD2 HIS A 130 -12.439 -20.188 -2.196 1.00 0.00 C ATOM 2025 CE1 HIS A 130 -11.308 -21.999 -2.670 1.00 0.00 C ATOM 2026 NE2 HIS A 130 -12.524 -21.530 -2.476 1.00 0.00 N ATOM 0 H HIS A 130 -11.561 -15.967 -3.234 1.00 0.00 H new ATOM 0 HA HIS A 130 -9.551 -16.825 -2.954 1.00 0.00 H new ATOM 0 HB2 HIS A 130 -9.447 -18.741 -1.559 1.00 0.00 H new ATOM 0 HB3 HIS A 130 -10.992 -17.990 -1.214 1.00 0.00 H new ATOM 0 HD2 HIS A 130 -13.266 -19.524 -1.990 1.00 0.00 H new ATOM 0 HE1 HIS A 130 -11.058 -23.022 -2.908 1.00 0.00 H new ATOM 0 HE2 HIS A 130 -13.386 -22.074 -2.526 1.00 0.00 H new ATOM 2035 N HIS A 131 -9.998 -17.986 -5.600 1.00 0.00 N ATOM 2036 CA HIS A 131 -9.579 -18.720 -6.776 1.00 0.00 C ATOM 2037 C HIS A 131 -8.279 -18.156 -7.325 1.00 0.00 C ATOM 2038 O HIS A 131 -8.252 -17.066 -7.891 1.00 0.00 O ATOM 2039 CB HIS A 131 -10.668 -18.680 -7.848 1.00 0.00 C ATOM 2040 CG HIS A 131 -11.077 -20.033 -8.331 1.00 0.00 C ATOM 2041 ND1 HIS A 131 -12.342 -20.546 -8.151 1.00 0.00 N ATOM 2042 CD2 HIS A 131 -10.382 -20.981 -9.002 1.00 0.00 C ATOM 2043 CE1 HIS A 131 -12.408 -21.748 -8.688 1.00 0.00 C ATOM 2044 NE2 HIS A 131 -11.232 -22.034 -9.211 1.00 0.00 N ATOM 0 H HIS A 131 -10.562 -17.158 -5.793 1.00 0.00 H new ATOM 0 HA HIS A 131 -9.411 -19.758 -6.488 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -11.542 -18.166 -7.448 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -10.312 -18.093 -8.695 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -9.350 -20.919 -9.314 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -13.277 -22.389 -8.698 1.00 0.00 H new ATOM 0 HE2 HIS A 131 -10.994 -22.900 -9.694 1.00 0.00 H new ATOM 2053 N HIS A 132 -7.200 -18.896 -7.139 1.00 0.00 N ATOM 2054 CA HIS A 132 -5.899 -18.486 -7.649 1.00 0.00 C ATOM 2055 C HIS A 132 -5.257 -19.618 -8.445 1.00 0.00 C ATOM 2056 O HIS A 132 -4.189 -19.449 -9.027 1.00 0.00 O ATOM 2057 CB HIS A 132 -4.980 -18.036 -6.501 1.00 0.00 C ATOM 2058 CG HIS A 132 -4.656 -19.110 -5.506 1.00 0.00 C ATOM 2059 ND1 HIS A 132 -3.440 -19.754 -5.469 1.00 0.00 N ATOM 2060 CD2 HIS A 132 -5.394 -19.646 -4.504 1.00 0.00 C ATOM 2061 CE1 HIS A 132 -3.443 -20.641 -4.494 1.00 0.00 C ATOM 2062 NE2 HIS A 132 -4.617 -20.594 -3.892 1.00 0.00 N ATOM 0 H HIS A 132 -7.197 -19.785 -6.639 1.00 0.00 H new ATOM 0 HA HIS A 132 -6.044 -17.637 -8.317 1.00 0.00 H new ATOM 0 HB2 HIS A 132 -4.049 -17.658 -6.924 1.00 0.00 H new ATOM 0 HB3 HIS A 132 -5.453 -17.205 -5.978 1.00 0.00 H new ATOM 0 HD2 HIS A 132 -6.405 -19.376 -4.238 1.00 0.00 H new ATOM 0 HE1 HIS A 132 -2.624 -21.295 -4.232 1.00 0.00 H new ATOM 0 HE2 HIS A 132 -4.900 -21.170 -3.099 1.00 0.00 H new ATOM 2071 N HIS A 133 -5.934 -20.771 -8.459 1.00 0.00 N ATOM 2072 CA HIS A 133 -5.497 -21.951 -9.213 1.00 0.00 C ATOM 2073 C HIS A 133 -4.251 -22.576 -8.594 1.00 0.00 C ATOM 2074 O HIS A 133 -3.715 -22.075 -7.604 1.00 0.00 O ATOM 2075 CB HIS A 133 -5.242 -21.617 -10.692 1.00 0.00 C ATOM 2076 CG HIS A 133 -6.478 -21.244 -11.453 1.00 0.00 C ATOM 2077 ND1 HIS A 133 -7.150 -22.124 -12.274 1.00 0.00 N ATOM 2078 CD2 HIS A 133 -7.159 -20.077 -11.524 1.00 0.00 C ATOM 2079 CE1 HIS A 133 -8.188 -21.516 -12.815 1.00 0.00 C ATOM 2080 NE2 HIS A 133 -8.217 -20.273 -12.375 1.00 0.00 N ATOM 0 H HIS A 133 -6.804 -20.913 -7.946 1.00 0.00 H new ATOM 0 HA HIS A 133 -6.309 -22.676 -9.163 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -4.529 -20.795 -10.751 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -4.777 -22.477 -11.173 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -6.915 -19.161 -11.007 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -8.894 -21.960 -13.501 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -8.913 -19.571 -12.627 1.00 0.00 H new ATOM 2089 N HIS A 134 -3.820 -23.692 -9.167 1.00 0.00 N ATOM 2090 CA HIS A 134 -2.626 -24.388 -8.707 1.00 0.00 C ATOM 2091 C HIS A 134 -2.226 -25.450 -9.723 1.00 0.00 C ATOM 2092 O HIS A 134 -3.087 -26.112 -10.303 1.00 0.00 O ATOM 2093 CB HIS A 134 -2.872 -25.047 -7.342 1.00 0.00 C ATOM 2094 CG HIS A 134 -1.646 -25.665 -6.739 1.00 0.00 C ATOM 2095 ND1 HIS A 134 -1.313 -26.996 -6.890 1.00 0.00 N ATOM 2096 CD2 HIS A 134 -0.667 -25.120 -5.981 1.00 0.00 C ATOM 2097 CE1 HIS A 134 -0.184 -27.239 -6.251 1.00 0.00 C ATOM 2098 NE2 HIS A 134 0.228 -26.118 -5.691 1.00 0.00 N ATOM 0 H HIS A 134 -4.284 -24.138 -9.958 1.00 0.00 H new ATOM 0 HA HIS A 134 -1.821 -23.660 -8.602 1.00 0.00 H new ATOM 0 HB2 HIS A 134 -3.267 -24.299 -6.654 1.00 0.00 H new ATOM 0 HB3 HIS A 134 -3.638 -25.815 -7.452 1.00 0.00 H new ATOM 0 HD2 HIS A 134 -0.602 -24.090 -5.663 1.00 0.00 H new ATOM 0 HE1 HIS A 134 0.318 -28.194 -6.196 1.00 0.00 H new ATOM 0 HE2 HIS A 134 1.075 -26.011 -5.133 1.00 0.00 H new ATOM 2107 N HIS A 135 -0.931 -25.605 -9.947 1.00 0.00 N ATOM 2108 CA HIS A 135 -0.441 -26.656 -10.828 1.00 0.00 C ATOM 2109 C HIS A 135 0.467 -27.611 -10.057 1.00 0.00 C ATOM 2110 O HIS A 135 1.641 -27.271 -9.810 1.00 0.00 O ATOM 2111 CB HIS A 135 0.258 -26.080 -12.078 1.00 0.00 C ATOM 2112 CG HIS A 135 1.473 -25.235 -11.810 1.00 0.00 C ATOM 2113 ND1 HIS A 135 2.754 -25.651 -12.098 1.00 0.00 N ATOM 2114 CD2 HIS A 135 1.593 -23.986 -11.301 1.00 0.00 C ATOM 2115 CE1 HIS A 135 3.607 -24.698 -11.774 1.00 0.00 C ATOM 2116 NE2 HIS A 135 2.930 -23.675 -11.288 1.00 0.00 N ATOM 2117 OXT HIS A 135 -0.018 -28.693 -9.669 1.00 0.00 O ATOM 0 H HIS A 135 -0.203 -25.021 -9.535 1.00 0.00 H new ATOM 0 HA HIS A 135 -1.299 -27.222 -11.190 1.00 0.00 H new ATOM 0 HB2 HIS A 135 0.549 -26.908 -12.724 1.00 0.00 H new ATOM 0 HB3 HIS A 135 -0.464 -25.481 -12.633 1.00 0.00 H new ATOM 0 HD2 HIS A 135 0.786 -23.351 -10.967 1.00 0.00 H new ATOM 0 HE1 HIS A 135 4.680 -24.747 -11.888 1.00 0.00 H new ATOM 0 HE2 HIS A 135 3.333 -22.798 -10.957 1.00 0.00 H new TER 2126 HIS A 135