USER MOD reduce.3.24.130724 H: found=0, std=0, add=819, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 817 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 141:sc= 0.0275 (180deg=0) USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot 92:sc= 0.172 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot -106:sc= -0.42 USER MOD Single : A 37 CYS SG : rot 180:sc= 0 USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 100:sc= 0.103 USER MOD Single : A 48 ASN : amide:sc= -2.14! C(o=-2.1!,f=-6.8!) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot -141:sc= 0.91 USER MOD Single : A 59 THR OG1 : rot 94:sc= 0.967 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 MET CE :methyl -138:sc= 0 (180deg=-0.0711) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 89 MET CE :methyl -120:sc= -4.41 (180deg=-8.07!) USER MOD Single : A 90 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -8.232 -40.163 -25.389 1.00 0.00 N ATOM 2 CA MET A 1 -7.830 -40.604 -26.714 1.00 0.00 C ATOM 3 C MET A 1 -8.921 -40.308 -27.745 1.00 0.00 C ATOM 4 O MET A 1 -10.109 -40.390 -27.438 1.00 0.00 O ATOM 5 CB MET A 1 -7.547 -42.108 -26.688 1.00 0.00 C ATOM 6 CG MET A 1 -6.130 -42.390 -26.185 1.00 0.00 C ATOM 7 SD MET A 1 -4.955 -42.158 -27.508 1.00 0.00 S ATOM 8 CE MET A 1 -3.450 -41.999 -26.562 1.00 0.00 C ATOM 0 H1 MET A 1 -7.917 -40.857 -24.682 1.00 0.00 H new ATOM 0 H2 MET A 1 -7.800 -39.240 -25.184 1.00 0.00 H new ATOM 0 H3 MET A 1 -9.268 -40.076 -25.351 1.00 0.00 H new ATOM 0 HA MET A 1 -6.929 -40.060 -26.999 1.00 0.00 H new ATOM 0 HB2 MET A 1 -8.271 -42.607 -26.044 1.00 0.00 H new ATOM 0 HB3 MET A 1 -7.671 -42.522 -27.688 1.00 0.00 H new ATOM 0 HG2 MET A 1 -5.891 -41.725 -25.355 1.00 0.00 H new ATOM 0 HG3 MET A 1 -6.066 -43.410 -25.806 1.00 0.00 H new ATOM 0 HE1 MET A 1 -2.609 -41.847 -27.239 1.00 0.00 H new ATOM 0 HE2 MET A 1 -3.532 -41.146 -25.888 1.00 0.00 H new ATOM 0 HE3 MET A 1 -3.288 -42.907 -25.980 1.00 0.00 H new ATOM 18 N ASP A 2 -8.479 -39.969 -28.947 1.00 0.00 N ATOM 19 CA ASP A 2 -9.403 -39.660 -30.025 1.00 0.00 C ATOM 20 C ASP A 2 -8.791 -40.100 -31.357 1.00 0.00 C ATOM 21 O ASP A 2 -7.573 -40.226 -31.473 1.00 0.00 O ATOM 22 CB ASP A 2 -9.675 -38.157 -30.103 1.00 0.00 C ATOM 23 CG ASP A 2 -10.377 -37.562 -28.880 1.00 0.00 C ATOM 24 OD1 ASP A 2 -11.611 -37.605 -28.769 1.00 0.00 O ATOM 25 OD2 ASP A 2 -9.592 -37.030 -28.006 1.00 0.00 O ATOM 0 H ASP A 2 -7.493 -39.901 -29.198 1.00 0.00 H new ATOM 0 HA ASP A 2 -10.338 -40.186 -29.830 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -8.727 -37.639 -30.247 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -10.284 -37.959 -30.985 1.00 0.00 H new ATOM 30 N LEU A 3 -9.665 -40.321 -32.328 1.00 0.00 N ATOM 31 CA LEU A 3 -9.226 -40.744 -33.647 1.00 0.00 C ATOM 32 C LEU A 3 -8.523 -39.577 -34.344 1.00 0.00 C ATOM 33 O LEU A 3 -7.329 -39.650 -34.632 1.00 0.00 O ATOM 34 CB LEU A 3 -10.399 -41.319 -34.443 1.00 0.00 C ATOM 35 CG LEU A 3 -10.163 -42.683 -35.095 1.00 0.00 C ATOM 36 CD1 LEU A 3 -10.583 -43.818 -34.158 1.00 0.00 C ATOM 37 CD2 LEU A 3 -10.864 -42.771 -36.452 1.00 0.00 C ATOM 0 H LEU A 3 -10.675 -40.215 -32.228 1.00 0.00 H new ATOM 0 HA LEU A 3 -8.499 -41.552 -33.566 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -11.259 -41.400 -33.778 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -10.666 -40.607 -35.224 1.00 0.00 H new ATOM 0 HG LEU A 3 -9.094 -42.794 -35.277 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -10.405 -44.777 -34.645 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -10.001 -43.765 -33.238 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -11.643 -43.722 -33.922 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -10.680 -43.750 -36.894 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -11.936 -42.629 -36.317 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -10.476 -41.996 -37.113 1.00 0.00 H new ATOM 49 N ILE A 4 -9.293 -38.529 -34.596 1.00 0.00 N ATOM 50 CA ILE A 4 -8.759 -37.349 -35.254 1.00 0.00 C ATOM 51 C ILE A 4 -7.369 -37.042 -34.693 1.00 0.00 C ATOM 52 O ILE A 4 -6.363 -37.488 -35.241 1.00 0.00 O ATOM 53 CB ILE A 4 -9.741 -36.181 -35.138 1.00 0.00 C ATOM 54 CG1 ILE A 4 -9.037 -34.846 -35.393 1.00 0.00 C ATOM 55 CG2 ILE A 4 -10.460 -36.201 -33.787 1.00 0.00 C ATOM 56 CD1 ILE A 4 -9.953 -33.878 -36.144 1.00 0.00 C ATOM 0 H ILE A 4 -10.283 -38.472 -34.356 1.00 0.00 H new ATOM 0 HA ILE A 4 -8.639 -37.530 -36.322 1.00 0.00 H new ATOM 0 HB ILE A 4 -10.502 -36.297 -35.909 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -8.734 -34.403 -34.444 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -8.128 -35.015 -35.971 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -11.152 -35.361 -33.731 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -11.013 -37.134 -33.683 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -9.727 -36.122 -32.984 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -9.429 -32.937 -36.312 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -10.234 -34.313 -37.103 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -10.850 -33.693 -35.553 1.00 0.00 H new ATOM 68 N GLY A 5 -7.359 -36.283 -33.607 1.00 0.00 N ATOM 69 CA GLY A 5 -6.109 -35.912 -32.965 1.00 0.00 C ATOM 70 C GLY A 5 -5.505 -34.667 -33.619 1.00 0.00 C ATOM 71 O GLY A 5 -5.094 -33.736 -32.929 1.00 0.00 O ATOM 0 H GLY A 5 -8.196 -35.915 -33.155 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -6.282 -35.723 -31.906 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -5.403 -36.740 -33.030 1.00 0.00 H new ATOM 75 N PHE A 6 -5.471 -34.691 -34.944 1.00 0.00 N ATOM 76 CA PHE A 6 -4.925 -33.576 -35.699 1.00 0.00 C ATOM 77 C PHE A 6 -5.707 -32.291 -35.420 1.00 0.00 C ATOM 78 O PHE A 6 -5.161 -31.335 -34.870 1.00 0.00 O ATOM 79 CB PHE A 6 -5.061 -33.931 -37.181 1.00 0.00 C ATOM 80 CG PHE A 6 -3.903 -33.433 -38.048 1.00 0.00 C ATOM 81 CD1 PHE A 6 -2.629 -33.821 -37.770 1.00 0.00 C ATOM 82 CD2 PHE A 6 -4.147 -32.603 -39.098 1.00 0.00 C ATOM 83 CE1 PHE A 6 -1.554 -33.359 -38.574 1.00 0.00 C ATOM 84 CE2 PHE A 6 -3.072 -32.142 -39.902 1.00 0.00 C ATOM 85 CZ PHE A 6 -1.798 -32.529 -39.624 1.00 0.00 C ATOM 0 H PHE A 6 -5.813 -35.465 -35.514 1.00 0.00 H new ATOM 0 HA PHE A 6 -3.886 -33.406 -35.415 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -5.136 -35.014 -37.279 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -5.993 -33.511 -37.561 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -2.435 -34.481 -36.937 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -5.158 -32.295 -39.320 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -0.543 -33.666 -38.352 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -3.266 -31.483 -40.736 1.00 0.00 H new ATOM 0 HZ PHE A 6 -0.981 -32.178 -40.236 1.00 0.00 H new ATOM 95 N GLY A 7 -6.972 -32.308 -35.813 1.00 0.00 N ATOM 96 CA GLY A 7 -7.834 -31.156 -35.612 1.00 0.00 C ATOM 97 C GLY A 7 -7.578 -30.510 -34.249 1.00 0.00 C ATOM 98 O GLY A 7 -7.352 -29.304 -34.162 1.00 0.00 O ATOM 0 H GLY A 7 -7.421 -33.102 -36.270 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -7.661 -30.426 -36.403 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -8.878 -31.462 -35.683 1.00 0.00 H new ATOM 102 N TYR A 8 -7.621 -31.342 -33.219 1.00 0.00 N ATOM 103 CA TYR A 8 -7.396 -30.867 -31.864 1.00 0.00 C ATOM 104 C TYR A 8 -6.042 -30.165 -31.746 1.00 0.00 C ATOM 105 O TYR A 8 -5.960 -29.048 -31.238 1.00 0.00 O ATOM 106 CB TYR A 8 -7.390 -32.113 -30.976 1.00 0.00 C ATOM 107 CG TYR A 8 -7.721 -31.833 -29.509 1.00 0.00 C ATOM 108 CD1 TYR A 8 -8.888 -31.176 -29.178 1.00 0.00 C ATOM 109 CD2 TYR A 8 -6.852 -32.239 -28.516 1.00 0.00 C ATOM 110 CE1 TYR A 8 -9.200 -30.912 -27.797 1.00 0.00 C ATOM 111 CE2 TYR A 8 -7.164 -31.976 -27.135 1.00 0.00 C ATOM 112 CZ TYR A 8 -8.322 -31.325 -26.844 1.00 0.00 C ATOM 113 OH TYR A 8 -8.617 -31.077 -25.539 1.00 0.00 O ATOM 0 H TYR A 8 -7.808 -32.342 -33.295 1.00 0.00 H new ATOM 0 HA TYR A 8 -8.166 -30.151 -31.576 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -8.110 -32.831 -31.370 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -6.408 -32.583 -31.033 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -9.568 -30.859 -29.955 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -5.938 -32.754 -28.775 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -10.110 -30.398 -27.525 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -6.494 -32.289 -26.348 1.00 0.00 H new ATOM 0 HH TYR A 8 -7.901 -31.429 -24.969 1.00 0.00 H new ATOM 123 N ALA A 9 -5.013 -30.849 -32.225 1.00 0.00 N ATOM 124 CA ALA A 9 -3.667 -30.305 -32.180 1.00 0.00 C ATOM 125 C ALA A 9 -3.599 -29.049 -33.052 1.00 0.00 C ATOM 126 O ALA A 9 -2.752 -28.184 -32.837 1.00 0.00 O ATOM 127 CB ALA A 9 -2.668 -31.376 -32.621 1.00 0.00 C ATOM 0 H ALA A 9 -5.085 -31.775 -32.646 1.00 0.00 H new ATOM 0 HA ALA A 9 -3.405 -30.014 -31.163 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -1.658 -30.967 -32.587 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -2.735 -32.234 -31.952 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -2.898 -31.691 -33.639 1.00 0.00 H new ATOM 133 N ALA A 10 -4.504 -28.990 -34.018 1.00 0.00 N ATOM 134 CA ALA A 10 -4.557 -27.855 -34.924 1.00 0.00 C ATOM 135 C ALA A 10 -4.970 -26.605 -34.144 1.00 0.00 C ATOM 136 O ALA A 10 -4.192 -25.660 -34.022 1.00 0.00 O ATOM 137 CB ALA A 10 -5.515 -28.166 -36.076 1.00 0.00 C ATOM 0 H ALA A 10 -5.206 -29.709 -34.193 1.00 0.00 H new ATOM 0 HA ALA A 10 -3.576 -27.664 -35.358 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -5.555 -27.315 -36.756 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -5.162 -29.045 -36.615 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -6.511 -28.360 -35.678 1.00 0.00 H new ATOM 143 N LEU A 11 -6.194 -26.640 -33.637 1.00 0.00 N ATOM 144 CA LEU A 11 -6.719 -25.521 -32.873 1.00 0.00 C ATOM 145 C LEU A 11 -5.783 -25.227 -31.699 1.00 0.00 C ATOM 146 O LEU A 11 -5.530 -24.067 -31.377 1.00 0.00 O ATOM 147 CB LEU A 11 -8.165 -25.792 -32.453 1.00 0.00 C ATOM 148 CG LEU A 11 -8.358 -26.806 -31.324 1.00 0.00 C ATOM 149 CD1 LEU A 11 -8.379 -26.111 -29.961 1.00 0.00 C ATOM 150 CD2 LEU A 11 -9.611 -27.653 -31.555 1.00 0.00 C ATOM 0 H LEU A 11 -6.837 -27.425 -33.740 1.00 0.00 H new ATOM 0 HA LEU A 11 -6.752 -24.622 -33.488 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -8.616 -24.848 -32.147 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -8.716 -26.141 -33.326 1.00 0.00 H new ATOM 0 HG LEU A 11 -7.506 -27.486 -31.326 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -8.517 -26.854 -29.176 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -7.435 -25.589 -29.804 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -9.199 -25.394 -29.931 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -9.724 -28.365 -30.738 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -10.486 -27.005 -31.595 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -9.516 -28.193 -32.497 1.00 0.00 H new ATOM 162 N VAL A 12 -5.294 -26.298 -31.090 1.00 0.00 N ATOM 163 CA VAL A 12 -4.391 -26.169 -29.959 1.00 0.00 C ATOM 164 C VAL A 12 -3.198 -25.299 -30.361 1.00 0.00 C ATOM 165 O VAL A 12 -2.864 -24.339 -29.668 1.00 0.00 O ATOM 166 CB VAL A 12 -3.979 -27.554 -29.458 1.00 0.00 C ATOM 167 CG1 VAL A 12 -2.640 -27.495 -28.720 1.00 0.00 C ATOM 168 CG2 VAL A 12 -5.067 -28.162 -28.570 1.00 0.00 C ATOM 0 H VAL A 12 -5.506 -27.259 -31.359 1.00 0.00 H new ATOM 0 HA VAL A 12 -4.890 -25.672 -29.127 1.00 0.00 H new ATOM 0 HB VAL A 12 -3.855 -28.200 -30.327 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -2.371 -28.493 -28.374 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -1.869 -27.124 -29.395 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -2.725 -26.825 -27.864 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -4.749 -29.147 -28.227 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -5.237 -27.516 -27.709 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -5.991 -28.258 -29.140 1.00 0.00 H new ATOM 178 N THR A 13 -2.588 -25.667 -31.478 1.00 0.00 N ATOM 179 CA THR A 13 -1.439 -24.933 -31.980 1.00 0.00 C ATOM 180 C THR A 13 -1.827 -23.487 -32.298 1.00 0.00 C ATOM 181 O THR A 13 -1.023 -22.573 -32.127 1.00 0.00 O ATOM 182 CB THR A 13 -0.883 -25.692 -33.186 1.00 0.00 C ATOM 183 OG1 THR A 13 -0.127 -26.753 -32.610 1.00 0.00 O ATOM 184 CG2 THR A 13 0.152 -24.877 -33.965 1.00 0.00 C ATOM 0 H THR A 13 -2.868 -26.464 -32.050 1.00 0.00 H new ATOM 0 HA THR A 13 -0.652 -24.868 -31.228 1.00 0.00 H new ATOM 0 HB THR A 13 -1.702 -25.968 -33.850 1.00 0.00 H new ATOM 0 HG1 THR A 13 -0.697 -27.544 -32.509 1.00 0.00 H new ATOM 0 HG21 THR A 13 0.514 -25.462 -34.810 1.00 0.00 H new ATOM 0 HG22 THR A 13 -0.308 -23.958 -34.330 1.00 0.00 H new ATOM 0 HG23 THR A 13 0.988 -24.629 -33.310 1.00 0.00 H new ATOM 192 N PHE A 14 -3.060 -23.327 -32.756 1.00 0.00 N ATOM 193 CA PHE A 14 -3.565 -22.008 -33.100 1.00 0.00 C ATOM 194 C PHE A 14 -3.640 -21.110 -31.863 1.00 0.00 C ATOM 195 O PHE A 14 -3.044 -20.034 -31.836 1.00 0.00 O ATOM 196 CB PHE A 14 -4.975 -22.201 -33.661 1.00 0.00 C ATOM 197 CG PHE A 14 -5.364 -21.181 -34.733 1.00 0.00 C ATOM 198 CD1 PHE A 14 -5.854 -19.966 -34.369 1.00 0.00 C ATOM 199 CD2 PHE A 14 -5.219 -21.490 -36.049 1.00 0.00 C ATOM 200 CE1 PHE A 14 -6.215 -19.019 -35.365 1.00 0.00 C ATOM 201 CE2 PHE A 14 -5.579 -20.543 -37.045 1.00 0.00 C ATOM 202 CZ PHE A 14 -6.069 -19.328 -36.681 1.00 0.00 C ATOM 0 H PHE A 14 -3.724 -24.088 -32.897 1.00 0.00 H new ATOM 0 HA PHE A 14 -2.901 -21.532 -33.822 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -5.053 -23.203 -34.082 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -5.692 -22.143 -32.842 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -5.969 -19.721 -33.323 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -4.830 -22.455 -36.337 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -6.605 -18.054 -35.077 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -5.464 -20.788 -38.090 1.00 0.00 H new ATOM 0 HZ PHE A 14 -6.342 -18.608 -37.438 1.00 0.00 H new ATOM 212 N GLY A 15 -4.376 -21.585 -30.869 1.00 0.00 N ATOM 213 CA GLY A 15 -4.536 -20.839 -29.633 1.00 0.00 C ATOM 214 C GLY A 15 -3.191 -20.649 -28.929 1.00 0.00 C ATOM 215 O GLY A 15 -3.001 -19.680 -28.196 1.00 0.00 O ATOM 0 H GLY A 15 -4.868 -22.478 -30.895 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -4.980 -19.866 -29.846 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -5.225 -21.366 -28.973 1.00 0.00 H new ATOM 219 N SER A 16 -2.291 -21.590 -29.177 1.00 0.00 N ATOM 220 CA SER A 16 -0.969 -21.538 -28.577 1.00 0.00 C ATOM 221 C SER A 16 -0.173 -20.372 -29.164 1.00 0.00 C ATOM 222 O SER A 16 0.452 -19.609 -28.429 1.00 0.00 O ATOM 223 CB SER A 16 -0.217 -22.854 -28.787 1.00 0.00 C ATOM 224 OG SER A 16 0.143 -23.466 -27.552 1.00 0.00 O ATOM 0 H SER A 16 -2.452 -22.393 -29.785 1.00 0.00 H new ATOM 0 HA SER A 16 -1.086 -21.385 -27.504 1.00 0.00 H new ATOM 0 HB2 SER A 16 -0.839 -23.539 -29.363 1.00 0.00 H new ATOM 0 HB3 SER A 16 0.682 -22.668 -29.375 1.00 0.00 H new ATOM 0 HG SER A 16 0.619 -24.304 -27.729 1.00 0.00 H new ATOM 230 N ILE A 17 -0.220 -20.270 -30.485 1.00 0.00 N ATOM 231 CA ILE A 17 0.489 -19.209 -31.180 1.00 0.00 C ATOM 232 C ILE A 17 -0.181 -17.868 -30.875 1.00 0.00 C ATOM 233 O ILE A 17 0.403 -17.015 -30.208 1.00 0.00 O ATOM 234 CB ILE A 17 0.589 -19.521 -32.674 1.00 0.00 C ATOM 235 CG1 ILE A 17 1.480 -20.740 -32.921 1.00 0.00 C ATOM 236 CG2 ILE A 17 1.063 -18.296 -33.459 1.00 0.00 C ATOM 237 CD1 ILE A 17 1.292 -21.278 -34.341 1.00 0.00 C ATOM 0 H ILE A 17 -0.738 -20.905 -31.092 1.00 0.00 H new ATOM 0 HA ILE A 17 1.517 -19.140 -30.823 1.00 0.00 H new ATOM 0 HB ILE A 17 -0.407 -19.771 -33.038 1.00 0.00 H new ATOM 0 HG12 ILE A 17 2.524 -20.469 -32.766 1.00 0.00 H new ATOM 0 HG13 ILE A 17 1.243 -21.521 -32.198 1.00 0.00 H new ATOM 0 HG21 ILE A 17 1.126 -18.545 -34.518 1.00 0.00 H new ATOM 0 HG22 ILE A 17 0.356 -17.478 -33.319 1.00 0.00 H new ATOM 0 HG23 ILE A 17 2.046 -17.991 -33.099 1.00 0.00 H new ATOM 0 HD11 ILE A 17 1.937 -22.144 -34.490 1.00 0.00 H new ATOM 0 HD12 ILE A 17 0.252 -21.571 -34.484 1.00 0.00 H new ATOM 0 HD13 ILE A 17 1.553 -20.503 -35.061 1.00 0.00 H new ATOM 249 N PHE A 18 -1.398 -17.724 -31.378 1.00 0.00 N ATOM 250 CA PHE A 18 -2.154 -16.501 -31.168 1.00 0.00 C ATOM 251 C PHE A 18 -2.132 -16.088 -29.694 1.00 0.00 C ATOM 252 O PHE A 18 -2.042 -14.903 -29.379 1.00 0.00 O ATOM 253 CB PHE A 18 -3.599 -16.791 -31.581 1.00 0.00 C ATOM 254 CG PHE A 18 -4.053 -16.031 -32.829 1.00 0.00 C ATOM 255 CD1 PHE A 18 -3.825 -16.552 -34.064 1.00 0.00 C ATOM 256 CD2 PHE A 18 -4.686 -14.834 -32.702 1.00 0.00 C ATOM 257 CE1 PHE A 18 -4.247 -15.846 -35.221 1.00 0.00 C ATOM 258 CE2 PHE A 18 -5.109 -14.128 -33.859 1.00 0.00 C ATOM 259 CZ PHE A 18 -4.880 -14.649 -35.095 1.00 0.00 C ATOM 0 H PHE A 18 -1.879 -18.434 -31.930 1.00 0.00 H new ATOM 0 HA PHE A 18 -1.718 -15.690 -31.752 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -3.707 -17.861 -31.760 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -4.261 -16.538 -30.753 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -3.323 -17.503 -34.165 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -4.867 -14.420 -31.721 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -4.065 -16.260 -36.202 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -5.612 -13.178 -33.758 1.00 0.00 H new ATOM 0 HZ PHE A 18 -5.201 -14.112 -35.976 1.00 0.00 H new ATOM 269 N GLY A 19 -2.215 -17.090 -28.831 1.00 0.00 N ATOM 270 CA GLY A 19 -2.205 -16.846 -27.399 1.00 0.00 C ATOM 271 C GLY A 19 -1.122 -15.832 -27.023 1.00 0.00 C ATOM 272 O GLY A 19 -1.415 -14.803 -26.416 1.00 0.00 O ATOM 0 H GLY A 19 -2.289 -18.072 -29.096 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -3.180 -16.476 -27.083 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -2.032 -17.782 -26.868 1.00 0.00 H new ATOM 276 N TYR A 20 0.105 -16.159 -27.399 1.00 0.00 N ATOM 277 CA TYR A 20 1.233 -15.289 -27.108 1.00 0.00 C ATOM 278 C TYR A 20 1.404 -15.098 -25.600 1.00 0.00 C ATOM 279 O TYR A 20 0.486 -15.370 -24.828 1.00 0.00 O ATOM 280 CB TYR A 20 0.899 -13.939 -27.746 1.00 0.00 C ATOM 281 CG TYR A 20 1.942 -13.453 -28.756 1.00 0.00 C ATOM 282 CD1 TYR A 20 3.053 -12.759 -28.320 1.00 0.00 C ATOM 283 CD2 TYR A 20 1.771 -13.709 -30.101 1.00 0.00 C ATOM 284 CE1 TYR A 20 4.034 -12.302 -29.270 1.00 0.00 C ATOM 285 CE2 TYR A 20 2.752 -13.252 -31.051 1.00 0.00 C ATOM 286 CZ TYR A 20 3.835 -12.571 -30.588 1.00 0.00 C ATOM 287 OH TYR A 20 4.762 -12.139 -31.485 1.00 0.00 O ATOM 0 H TYR A 20 0.344 -17.014 -27.902 1.00 0.00 H new ATOM 0 HA TYR A 20 2.158 -15.717 -27.494 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -0.067 -14.013 -28.244 1.00 0.00 H new ATOM 0 HB3 TYR A 20 0.795 -13.192 -26.959 1.00 0.00 H new ATOM 0 HD1 TYR A 20 3.186 -12.559 -27.267 1.00 0.00 H new ATOM 0 HD2 TYR A 20 0.902 -14.252 -30.441 1.00 0.00 H new ATOM 0 HE1 TYR A 20 4.908 -11.758 -28.943 1.00 0.00 H new ATOM 0 HE2 TYR A 20 2.631 -13.445 -32.107 1.00 0.00 H new ATOM 0 HH TYR A 20 4.490 -12.403 -32.389 1.00 0.00 H new ATOM 297 N LYS A 21 2.586 -14.632 -25.225 1.00 0.00 N ATOM 298 CA LYS A 21 2.890 -14.402 -23.823 1.00 0.00 C ATOM 299 C LYS A 21 1.810 -13.507 -23.212 1.00 0.00 C ATOM 300 O LYS A 21 1.595 -12.386 -23.672 1.00 0.00 O ATOM 301 CB LYS A 21 4.308 -13.850 -23.665 1.00 0.00 C ATOM 302 CG LYS A 21 4.649 -13.628 -22.190 1.00 0.00 C ATOM 303 CD LYS A 21 6.012 -12.950 -22.039 1.00 0.00 C ATOM 304 CE LYS A 21 6.606 -13.216 -20.654 1.00 0.00 C ATOM 305 NZ LYS A 21 6.858 -11.941 -19.945 1.00 0.00 N ATOM 0 H LYS A 21 3.345 -14.407 -25.868 1.00 0.00 H new ATOM 0 HA LYS A 21 2.876 -15.342 -23.271 1.00 0.00 H new ATOM 0 HB2 LYS A 21 5.023 -14.544 -24.107 1.00 0.00 H new ATOM 0 HB3 LYS A 21 4.399 -12.909 -24.208 1.00 0.00 H new ATOM 0 HG2 LYS A 21 3.879 -13.013 -21.724 1.00 0.00 H new ATOM 0 HG3 LYS A 21 4.654 -14.584 -21.666 1.00 0.00 H new ATOM 0 HD2 LYS A 21 6.692 -13.318 -22.807 1.00 0.00 H new ATOM 0 HD3 LYS A 21 5.907 -11.876 -22.194 1.00 0.00 H new ATOM 0 HE2 LYS A 21 5.923 -13.834 -20.071 1.00 0.00 H new ATOM 0 HE3 LYS A 21 7.537 -13.775 -20.752 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 7.261 -12.139 -19.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 7.527 -11.365 -20.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 5.963 -11.422 -19.835 1.00 0.00 H new ATOM 319 N ARG A 22 1.159 -14.035 -22.186 1.00 0.00 N ATOM 320 CA ARG A 22 0.106 -13.297 -21.508 1.00 0.00 C ATOM 321 C ARG A 22 0.632 -12.706 -20.198 1.00 0.00 C ATOM 322 O ARG A 22 1.728 -13.046 -19.755 1.00 0.00 O ATOM 323 CB ARG A 22 -1.092 -14.199 -21.207 1.00 0.00 C ATOM 324 CG ARG A 22 -1.933 -14.431 -22.464 1.00 0.00 C ATOM 325 CD ARG A 22 -2.855 -15.640 -22.292 1.00 0.00 C ATOM 326 NE ARG A 22 -3.640 -15.858 -23.527 1.00 0.00 N ATOM 327 CZ ARG A 22 -4.375 -16.952 -23.767 1.00 0.00 C ATOM 328 NH1 ARG A 22 -4.429 -17.935 -22.858 1.00 0.00 N ATOM 329 NH2 ARG A 22 -5.055 -17.064 -24.917 1.00 0.00 N ATOM 0 H ARG A 22 1.340 -14.965 -21.808 1.00 0.00 H new ATOM 0 HA ARG A 22 -0.216 -12.493 -22.170 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -0.743 -15.155 -20.817 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -1.708 -13.744 -20.431 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -2.528 -13.543 -22.677 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -1.277 -14.588 -23.321 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -2.265 -16.528 -22.065 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -3.526 -15.479 -21.448 1.00 0.00 H new ATOM 0 HE ARG A 22 -3.620 -15.129 -24.241 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -3.911 -17.850 -21.984 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -4.989 -18.768 -23.040 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -5.013 -16.316 -25.609 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -5.615 -17.897 -25.100 1.00 0.00 H new ATOM 343 N ARG A 23 -0.174 -11.830 -19.617 1.00 0.00 N ATOM 344 CA ARG A 23 0.197 -11.187 -18.367 1.00 0.00 C ATOM 345 C ARG A 23 0.501 -12.240 -17.299 1.00 0.00 C ATOM 346 O ARG A 23 1.611 -12.290 -16.771 1.00 0.00 O ATOM 347 CB ARG A 23 -0.922 -10.271 -17.866 1.00 0.00 C ATOM 348 CG ARG A 23 -0.358 -8.938 -17.372 1.00 0.00 C ATOM 349 CD ARG A 23 -1.471 -8.039 -16.830 1.00 0.00 C ATOM 350 NE ARG A 23 -1.334 -7.890 -15.364 1.00 0.00 N ATOM 351 CZ ARG A 23 -1.838 -6.866 -14.662 1.00 0.00 C ATOM 352 NH1 ARG A 23 -2.515 -5.894 -15.288 1.00 0.00 N ATOM 353 NH2 ARG A 23 -1.665 -6.814 -13.334 1.00 0.00 N ATOM 0 H ARG A 23 -1.082 -11.550 -19.988 1.00 0.00 H new ATOM 0 HA ARG A 23 1.087 -10.586 -18.554 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -1.638 -10.092 -18.669 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -1.465 -10.762 -17.058 1.00 0.00 H new ATOM 0 HG2 ARG A 23 0.381 -9.119 -16.591 1.00 0.00 H new ATOM 0 HG3 ARG A 23 0.158 -8.432 -18.188 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -1.425 -7.061 -17.309 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -2.444 -8.466 -17.071 1.00 0.00 H new ATOM 0 HE ARG A 23 -0.824 -8.612 -14.856 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -2.647 -5.934 -16.299 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -2.899 -5.114 -14.754 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -1.150 -7.554 -12.857 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -2.049 -6.034 -12.800 1.00 0.00 H new ATOM 367 N GLY A 24 -0.504 -13.055 -17.013 1.00 0.00 N ATOM 368 CA GLY A 24 -0.357 -14.103 -16.018 1.00 0.00 C ATOM 369 C GLY A 24 -0.561 -13.551 -14.606 1.00 0.00 C ATOM 370 O GLY A 24 -0.219 -12.402 -14.329 1.00 0.00 O ATOM 0 H GLY A 24 -1.423 -13.010 -17.453 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -1.080 -14.896 -16.210 1.00 0.00 H new ATOM 0 HA3 GLY A 24 0.634 -14.549 -16.098 1.00 0.00 H new ATOM 374 N GLY A 25 -1.117 -14.395 -13.749 1.00 0.00 N ATOM 375 CA GLY A 25 -1.370 -14.005 -12.372 1.00 0.00 C ATOM 376 C GLY A 25 -2.753 -13.367 -12.229 1.00 0.00 C ATOM 377 O GLY A 25 -2.909 -12.164 -12.432 1.00 0.00 O ATOM 0 H GLY A 25 -1.399 -15.347 -13.981 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -1.300 -14.879 -11.724 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -0.605 -13.302 -12.043 1.00 0.00 H new ATOM 381 N VAL A 26 -3.721 -14.201 -11.879 1.00 0.00 N ATOM 382 CA VAL A 26 -5.086 -13.732 -11.705 1.00 0.00 C ATOM 383 C VAL A 26 -5.125 -12.694 -10.582 1.00 0.00 C ATOM 384 O VAL A 26 -5.652 -11.598 -10.763 1.00 0.00 O ATOM 385 CB VAL A 26 -6.019 -14.919 -11.456 1.00 0.00 C ATOM 386 CG1 VAL A 26 -7.005 -14.613 -10.327 1.00 0.00 C ATOM 387 CG2 VAL A 26 -6.756 -15.316 -12.736 1.00 0.00 C ATOM 0 H VAL A 26 -3.588 -15.198 -11.711 1.00 0.00 H new ATOM 0 HA VAL A 26 -5.440 -13.242 -12.612 1.00 0.00 H new ATOM 0 HB VAL A 26 -5.408 -15.767 -11.146 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -7.657 -15.473 -10.170 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -6.454 -14.403 -9.410 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -7.607 -13.745 -10.595 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -7.412 -16.162 -12.531 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -7.350 -14.473 -13.090 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -6.032 -15.596 -13.501 1.00 0.00 H new ATOM 397 N PRO A 27 -4.546 -13.087 -9.416 1.00 0.00 N ATOM 398 CA PRO A 27 -4.510 -12.203 -8.263 1.00 0.00 C ATOM 399 C PRO A 27 -3.466 -11.100 -8.450 1.00 0.00 C ATOM 400 O PRO A 27 -2.587 -10.924 -7.609 1.00 0.00 O ATOM 401 CB PRO A 27 -4.210 -13.110 -7.081 1.00 0.00 C ATOM 402 CG PRO A 27 -3.631 -14.386 -7.671 1.00 0.00 C ATOM 403 CD PRO A 27 -3.912 -14.378 -9.165 1.00 0.00 C ATOM 0 HA PRO A 27 -5.449 -11.671 -8.112 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -3.503 -12.640 -6.398 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -5.114 -13.319 -6.510 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -2.558 -14.440 -7.485 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -4.081 -15.262 -7.203 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -2.993 -14.487 -9.741 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -4.566 -15.202 -9.449 1.00 0.00 H new ATOM 411 N SER A 28 -3.599 -10.386 -9.559 1.00 0.00 N ATOM 412 CA SER A 28 -2.678 -9.305 -9.867 1.00 0.00 C ATOM 413 C SER A 28 -3.444 -7.986 -9.993 1.00 0.00 C ATOM 414 O SER A 28 -3.163 -7.030 -9.273 1.00 0.00 O ATOM 415 CB SER A 28 -1.902 -9.593 -11.153 1.00 0.00 C ATOM 416 OG SER A 28 -2.658 -9.272 -12.317 1.00 0.00 O ATOM 0 H SER A 28 -4.330 -10.535 -10.254 1.00 0.00 H new ATOM 0 HA SER A 28 -1.959 -9.224 -9.052 1.00 0.00 H new ATOM 0 HB2 SER A 28 -0.975 -9.019 -11.153 1.00 0.00 H new ATOM 0 HB3 SER A 28 -1.624 -10.647 -11.180 1.00 0.00 H new ATOM 0 HG SER A 28 -2.970 -10.098 -12.742 1.00 0.00 H new ATOM 422 N LEU A 29 -4.396 -7.978 -10.915 1.00 0.00 N ATOM 423 CA LEU A 29 -5.204 -6.792 -11.144 1.00 0.00 C ATOM 424 C LEU A 29 -5.682 -6.237 -9.801 1.00 0.00 C ATOM 425 O LEU A 29 -5.584 -5.037 -9.551 1.00 0.00 O ATOM 426 CB LEU A 29 -6.340 -7.099 -12.122 1.00 0.00 C ATOM 427 CG LEU A 29 -7.165 -8.351 -11.820 1.00 0.00 C ATOM 428 CD1 LEU A 29 -8.623 -7.990 -11.529 1.00 0.00 C ATOM 429 CD2 LEU A 29 -7.043 -9.374 -12.951 1.00 0.00 C ATOM 0 H LEU A 29 -4.626 -8.773 -11.511 1.00 0.00 H new ATOM 0 HA LEU A 29 -4.608 -6.011 -11.617 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -7.013 -6.242 -12.147 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -5.915 -7.200 -13.121 1.00 0.00 H new ATOM 0 HG LEU A 29 -6.763 -8.816 -10.920 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -9.187 -8.898 -11.318 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -8.668 -7.326 -10.666 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -9.054 -7.489 -12.396 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -7.639 -10.254 -12.711 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -7.404 -8.934 -13.880 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -5.999 -9.664 -13.068 1.00 0.00 H new ATOM 441 N ILE A 30 -6.189 -7.138 -8.972 1.00 0.00 N ATOM 442 CA ILE A 30 -6.682 -6.754 -7.660 1.00 0.00 C ATOM 443 C ILE A 30 -5.528 -6.188 -6.831 1.00 0.00 C ATOM 444 O ILE A 30 -5.728 -5.294 -6.010 1.00 0.00 O ATOM 445 CB ILE A 30 -7.401 -7.928 -6.993 1.00 0.00 C ATOM 446 CG1 ILE A 30 -8.428 -7.434 -5.973 1.00 0.00 C ATOM 447 CG2 ILE A 30 -6.399 -8.903 -6.372 1.00 0.00 C ATOM 448 CD1 ILE A 30 -7.777 -6.511 -4.942 1.00 0.00 C ATOM 0 H ILE A 30 -6.269 -8.133 -9.183 1.00 0.00 H new ATOM 0 HA ILE A 30 -7.427 -5.964 -7.750 1.00 0.00 H new ATOM 0 HB ILE A 30 -7.948 -8.475 -7.761 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -9.230 -6.903 -6.487 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -8.883 -8.286 -5.468 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -6.936 -9.728 -5.904 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -5.741 -9.292 -7.149 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -5.805 -8.384 -5.620 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -8.529 -6.174 -4.229 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -6.992 -7.052 -4.413 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -7.345 -5.648 -5.448 1.00 0.00 H new ATOM 460 N ALA A 31 -4.344 -6.733 -7.074 1.00 0.00 N ATOM 461 CA ALA A 31 -3.157 -6.294 -6.360 1.00 0.00 C ATOM 462 C ALA A 31 -2.846 -4.845 -6.740 1.00 0.00 C ATOM 463 O ALA A 31 -2.934 -3.948 -5.904 1.00 0.00 O ATOM 464 CB ALA A 31 -1.996 -7.240 -6.670 1.00 0.00 C ATOM 0 H ALA A 31 -4.182 -7.475 -7.755 1.00 0.00 H new ATOM 0 HA ALA A 31 -3.323 -6.324 -5.283 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -1.106 -6.911 -6.135 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -2.256 -8.251 -6.355 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -1.798 -7.234 -7.742 1.00 0.00 H new ATOM 470 N GLY A 32 -2.488 -4.661 -8.003 1.00 0.00 N ATOM 471 CA GLY A 32 -2.163 -3.337 -8.504 1.00 0.00 C ATOM 472 C GLY A 32 -3.276 -2.339 -8.177 1.00 0.00 C ATOM 473 O GLY A 32 -3.006 -1.230 -7.719 1.00 0.00 O ATOM 0 H GLY A 32 -2.416 -5.408 -8.694 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -1.225 -2.998 -8.064 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -2.013 -3.379 -9.583 1.00 0.00 H new ATOM 477 N LEU A 33 -4.504 -2.769 -8.426 1.00 0.00 N ATOM 478 CA LEU A 33 -5.659 -1.927 -8.164 1.00 0.00 C ATOM 479 C LEU A 33 -5.593 -1.410 -6.725 1.00 0.00 C ATOM 480 O LEU A 33 -5.672 -0.205 -6.491 1.00 0.00 O ATOM 481 CB LEU A 33 -6.953 -2.676 -8.489 1.00 0.00 C ATOM 482 CG LEU A 33 -8.243 -2.051 -7.952 1.00 0.00 C ATOM 483 CD1 LEU A 33 -9.122 -1.541 -9.095 1.00 0.00 C ATOM 484 CD2 LEU A 33 -8.991 -3.032 -7.047 1.00 0.00 C ATOM 0 H LEU A 33 -4.724 -3.689 -8.806 1.00 0.00 H new ATOM 0 HA LEU A 33 -5.650 -1.055 -8.817 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.038 -2.761 -9.572 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -6.872 -3.689 -8.095 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.977 -1.188 -7.341 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -10.032 -1.102 -8.686 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -8.578 -0.786 -9.663 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -9.383 -2.371 -9.751 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -9.904 -2.564 -6.679 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -9.246 -3.928 -7.613 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -8.357 -3.305 -6.203 1.00 0.00 H new ATOM 496 N PHE A 34 -5.447 -2.347 -5.800 1.00 0.00 N ATOM 497 CA PHE A 34 -5.369 -2.001 -4.391 1.00 0.00 C ATOM 498 C PHE A 34 -4.252 -0.987 -4.136 1.00 0.00 C ATOM 499 O PHE A 34 -4.428 -0.044 -3.367 1.00 0.00 O ATOM 500 CB PHE A 34 -5.055 -3.291 -3.631 1.00 0.00 C ATOM 501 CG PHE A 34 -5.433 -3.248 -2.149 1.00 0.00 C ATOM 502 CD1 PHE A 34 -4.711 -2.484 -1.285 1.00 0.00 C ATOM 503 CD2 PHE A 34 -6.490 -3.973 -1.695 1.00 0.00 C ATOM 504 CE1 PHE A 34 -5.062 -2.444 0.091 1.00 0.00 C ATOM 505 CE2 PHE A 34 -6.840 -3.933 -0.320 1.00 0.00 C ATOM 506 CZ PHE A 34 -6.119 -3.169 0.544 1.00 0.00 C ATOM 0 H PHE A 34 -5.381 -3.345 -5.999 1.00 0.00 H new ATOM 0 HA PHE A 34 -6.308 -1.555 -4.065 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -5.583 -4.118 -4.106 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -3.989 -3.501 -3.718 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -3.871 -1.908 -1.645 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -7.063 -4.579 -2.381 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -4.489 -1.838 0.777 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -7.679 -4.509 0.040 1.00 0.00 H new ATOM 0 HZ PHE A 34 -6.386 -3.138 1.590 1.00 0.00 H new ATOM 516 N VAL A 35 -3.126 -1.217 -4.797 1.00 0.00 N ATOM 517 CA VAL A 35 -1.980 -0.336 -4.651 1.00 0.00 C ATOM 518 C VAL A 35 -2.358 1.068 -5.127 1.00 0.00 C ATOM 519 O VAL A 35 -1.934 2.062 -4.539 1.00 0.00 O ATOM 520 CB VAL A 35 -0.777 -0.916 -5.397 1.00 0.00 C ATOM 521 CG1 VAL A 35 0.396 0.068 -5.395 1.00 0.00 C ATOM 522 CG2 VAL A 35 -0.362 -2.264 -4.806 1.00 0.00 C ATOM 0 H VAL A 35 -2.984 -2.000 -5.434 1.00 0.00 H new ATOM 0 HA VAL A 35 -1.689 -0.257 -3.603 1.00 0.00 H new ATOM 0 HB VAL A 35 -1.074 -1.082 -6.433 1.00 0.00 H new ATOM 0 HG11 VAL A 35 1.238 -0.369 -5.932 1.00 0.00 H new ATOM 0 HG12 VAL A 35 0.095 0.994 -5.884 1.00 0.00 H new ATOM 0 HG13 VAL A 35 0.691 0.280 -4.367 1.00 0.00 H new ATOM 0 HG21 VAL A 35 0.495 -2.654 -5.355 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -0.093 -2.134 -3.758 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -1.192 -2.966 -4.883 1.00 0.00 H new ATOM 532 N GLY A 36 -3.153 1.105 -6.186 1.00 0.00 N ATOM 533 CA GLY A 36 -3.594 2.371 -6.747 1.00 0.00 C ATOM 534 C GLY A 36 -4.641 3.034 -5.850 1.00 0.00 C ATOM 535 O GLY A 36 -4.746 4.259 -5.811 1.00 0.00 O ATOM 0 H GLY A 36 -3.503 0.279 -6.671 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -2.739 3.037 -6.867 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -4.012 2.207 -7.740 1.00 0.00 H new ATOM 539 N CYS A 37 -5.391 2.194 -5.151 1.00 0.00 N ATOM 540 CA CYS A 37 -6.427 2.683 -4.257 1.00 0.00 C ATOM 541 C CYS A 37 -5.751 3.309 -3.035 1.00 0.00 C ATOM 542 O CYS A 37 -6.080 4.429 -2.646 1.00 0.00 O ATOM 543 CB CYS A 37 -7.403 1.573 -3.862 1.00 0.00 C ATOM 544 SG CYS A 37 -8.976 1.769 -4.777 1.00 0.00 S ATOM 0 H CYS A 37 -5.302 1.179 -5.186 1.00 0.00 H new ATOM 0 HA CYS A 37 -7.025 3.438 -4.768 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -6.966 0.598 -4.079 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -7.590 1.607 -2.789 1.00 0.00 H new ATOM 0 HG CYS A 37 -9.797 0.821 -4.436 1.00 0.00 H new ATOM 550 N LEU A 38 -4.819 2.560 -2.465 1.00 0.00 N ATOM 551 CA LEU A 38 -4.094 3.028 -1.296 1.00 0.00 C ATOM 552 C LEU A 38 -3.194 4.199 -1.695 1.00 0.00 C ATOM 553 O LEU A 38 -2.900 5.068 -0.875 1.00 0.00 O ATOM 554 CB LEU A 38 -3.341 1.872 -0.634 1.00 0.00 C ATOM 555 CG LEU A 38 -1.936 1.592 -1.170 1.00 0.00 C ATOM 556 CD1 LEU A 38 -0.952 2.675 -0.723 1.00 0.00 C ATOM 557 CD2 LEU A 38 -1.466 0.191 -0.772 1.00 0.00 C ATOM 0 H LEU A 38 -4.549 1.632 -2.791 1.00 0.00 H new ATOM 0 HA LEU A 38 -4.787 3.400 -0.542 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -3.267 2.077 0.434 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -3.937 0.966 -0.744 1.00 0.00 H new ATOM 0 HG LEU A 38 -1.974 1.622 -2.259 1.00 0.00 H new ATOM 0 HD11 LEU A 38 0.039 2.451 -1.118 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -1.282 3.644 -1.098 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -0.911 2.702 0.366 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -0.464 0.018 -1.166 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -1.448 0.108 0.315 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -2.150 -0.552 -1.181 1.00 0.00 H new ATOM 569 N ALA A 39 -2.781 4.186 -2.954 1.00 0.00 N ATOM 570 CA ALA A 39 -1.921 5.236 -3.471 1.00 0.00 C ATOM 571 C ALA A 39 -2.700 6.553 -3.513 1.00 0.00 C ATOM 572 O ALA A 39 -2.276 7.547 -2.926 1.00 0.00 O ATOM 573 CB ALA A 39 -1.388 4.829 -4.846 1.00 0.00 C ATOM 0 H ALA A 39 -3.027 3.464 -3.631 1.00 0.00 H new ATOM 0 HA ALA A 39 -1.060 5.383 -2.819 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -0.743 5.617 -5.234 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -0.818 3.904 -4.756 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -2.223 4.675 -5.529 1.00 0.00 H new ATOM 579 N GLY A 40 -3.824 6.516 -4.213 1.00 0.00 N ATOM 580 CA GLY A 40 -4.666 7.694 -4.339 1.00 0.00 C ATOM 581 C GLY A 40 -5.204 8.132 -2.976 1.00 0.00 C ATOM 582 O GLY A 40 -4.861 9.206 -2.485 1.00 0.00 O ATOM 0 H GLY A 40 -4.172 5.689 -4.699 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -4.095 8.507 -4.787 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -5.498 7.481 -5.011 1.00 0.00 H new ATOM 586 N TYR A 41 -6.039 7.277 -2.403 1.00 0.00 N ATOM 587 CA TYR A 41 -6.628 7.562 -1.105 1.00 0.00 C ATOM 588 C TYR A 41 -5.550 7.912 -0.078 1.00 0.00 C ATOM 589 O TYR A 41 -5.752 8.782 0.768 1.00 0.00 O ATOM 590 CB TYR A 41 -7.333 6.276 -0.670 1.00 0.00 C ATOM 591 CG TYR A 41 -8.440 6.492 0.363 1.00 0.00 C ATOM 592 CD1 TYR A 41 -9.672 6.970 -0.036 1.00 0.00 C ATOM 593 CD2 TYR A 41 -8.208 6.209 1.693 1.00 0.00 C ATOM 594 CE1 TYR A 41 -10.715 7.173 0.936 1.00 0.00 C ATOM 595 CE2 TYR A 41 -9.251 6.412 2.666 1.00 0.00 C ATOM 596 CZ TYR A 41 -10.453 6.884 2.239 1.00 0.00 C ATOM 597 OH TYR A 41 -11.438 7.076 3.157 1.00 0.00 O ATOM 0 H TYR A 41 -6.322 6.387 -2.814 1.00 0.00 H new ATOM 0 HA TYR A 41 -7.309 8.410 -1.171 1.00 0.00 H new ATOM 0 HB2 TYR A 41 -7.760 5.793 -1.549 1.00 0.00 H new ATOM 0 HB3 TYR A 41 -6.593 5.590 -0.257 1.00 0.00 H new ATOM 0 HD1 TYR A 41 -9.854 7.192 -1.077 1.00 0.00 H new ATOM 0 HD2 TYR A 41 -7.244 5.835 2.005 1.00 0.00 H new ATOM 0 HE1 TYR A 41 -11.683 7.546 0.637 1.00 0.00 H new ATOM 0 HE2 TYR A 41 -9.082 6.194 3.710 1.00 0.00 H new ATOM 0 HH TYR A 41 -11.110 6.827 4.046 1.00 0.00 H new ATOM 607 N GLY A 42 -4.427 7.216 -0.186 1.00 0.00 N ATOM 608 CA GLY A 42 -3.317 7.442 0.723 1.00 0.00 C ATOM 609 C GLY A 42 -2.771 8.864 0.580 1.00 0.00 C ATOM 610 O GLY A 42 -3.048 9.726 1.413 1.00 0.00 O ATOM 0 H GLY A 42 -4.263 6.496 -0.889 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -3.644 7.276 1.750 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -2.524 6.722 0.520 1.00 0.00 H new ATOM 614 N ALA A 43 -2.006 9.066 -0.483 1.00 0.00 N ATOM 615 CA ALA A 43 -1.420 10.369 -0.746 1.00 0.00 C ATOM 616 C ALA A 43 -2.458 11.457 -0.467 1.00 0.00 C ATOM 617 O ALA A 43 -2.271 12.285 0.423 1.00 0.00 O ATOM 618 CB ALA A 43 -0.901 10.414 -2.185 1.00 0.00 C ATOM 0 H ALA A 43 -1.779 8.349 -1.172 1.00 0.00 H new ATOM 0 HA ALA A 43 -0.571 10.548 -0.087 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -0.461 11.392 -2.383 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -0.145 9.641 -2.323 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -1.727 10.241 -2.875 1.00 0.00 H new ATOM 624 N TYR A 44 -3.531 11.420 -1.244 1.00 0.00 N ATOM 625 CA TYR A 44 -4.600 12.393 -1.091 1.00 0.00 C ATOM 626 C TYR A 44 -4.134 13.789 -1.509 1.00 0.00 C ATOM 627 O TYR A 44 -4.670 14.369 -2.453 1.00 0.00 O ATOM 628 CB TYR A 44 -4.945 12.409 0.400 1.00 0.00 C ATOM 629 CG TYR A 44 -6.393 12.800 0.699 1.00 0.00 C ATOM 630 CD1 TYR A 44 -7.424 11.959 0.332 1.00 0.00 C ATOM 631 CD2 TYR A 44 -6.669 13.993 1.336 1.00 0.00 C ATOM 632 CE1 TYR A 44 -8.788 12.327 0.613 1.00 0.00 C ATOM 633 CE2 TYR A 44 -8.033 14.360 1.617 1.00 0.00 C ATOM 634 CZ TYR A 44 -9.025 13.509 1.242 1.00 0.00 C ATOM 635 OH TYR A 44 -10.313 13.857 1.508 1.00 0.00 O ATOM 0 H TYR A 44 -3.683 10.732 -1.981 1.00 0.00 H new ATOM 0 HA TYR A 44 -5.453 12.127 -1.715 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -4.753 11.421 0.818 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -4.279 13.105 0.909 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -7.208 11.025 -0.166 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -5.862 14.651 1.624 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -9.604 11.679 0.330 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -8.263 15.291 2.115 1.00 0.00 H new ATOM 0 HH TYR A 44 -10.330 14.726 1.961 1.00 0.00 H new ATOM 645 N ARG A 45 -3.142 14.288 -0.788 1.00 0.00 N ATOM 646 CA ARG A 45 -2.599 15.606 -1.073 1.00 0.00 C ATOM 647 C ARG A 45 -1.093 15.514 -1.330 1.00 0.00 C ATOM 648 O ARG A 45 -0.431 16.532 -1.531 1.00 0.00 O ATOM 649 CB ARG A 45 -2.853 16.569 0.088 1.00 0.00 C ATOM 650 CG ARG A 45 -3.789 17.703 -0.335 1.00 0.00 C ATOM 651 CD ARG A 45 -3.775 18.838 0.691 1.00 0.00 C ATOM 652 NE ARG A 45 -4.881 18.659 1.658 1.00 0.00 N ATOM 653 CZ ARG A 45 -4.804 17.893 2.755 1.00 0.00 C ATOM 654 NH1 ARG A 45 -3.673 17.229 3.030 1.00 0.00 N ATOM 655 NH2 ARG A 45 -5.858 17.790 3.576 1.00 0.00 N ATOM 0 H ARG A 45 -2.699 13.804 -0.007 1.00 0.00 H new ATOM 0 HA ARG A 45 -3.101 15.987 -1.962 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -3.289 16.026 0.927 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -1.907 16.984 0.435 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -3.485 18.085 -1.310 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -4.804 17.320 -0.445 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -2.820 18.853 1.217 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -3.875 19.798 0.185 1.00 0.00 H new ATOM 0 HE ARG A 45 -5.757 19.150 1.478 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -2.871 17.307 2.405 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -3.614 16.646 3.865 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -6.719 18.295 3.366 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -5.799 17.207 4.411 1.00 0.00 H new ATOM 669 N VAL A 46 -0.596 14.286 -1.316 1.00 0.00 N ATOM 670 CA VAL A 46 0.819 14.049 -1.546 1.00 0.00 C ATOM 671 C VAL A 46 1.100 14.084 -3.049 1.00 0.00 C ATOM 672 O VAL A 46 2.242 13.920 -3.475 1.00 0.00 O ATOM 673 CB VAL A 46 1.242 12.734 -0.889 1.00 0.00 C ATOM 674 CG1 VAL A 46 2.472 12.145 -1.583 1.00 0.00 C ATOM 675 CG2 VAL A 46 1.497 12.925 0.608 1.00 0.00 C ATOM 0 H VAL A 46 -1.148 13.445 -1.149 1.00 0.00 H new ATOM 0 HA VAL A 46 1.418 14.835 -1.085 1.00 0.00 H new ATOM 0 HB VAL A 46 0.422 12.025 -1.001 1.00 0.00 H new ATOM 0 HG11 VAL A 46 2.752 11.211 -1.096 1.00 0.00 H new ATOM 0 HG12 VAL A 46 2.242 11.954 -2.631 1.00 0.00 H new ATOM 0 HG13 VAL A 46 3.300 12.851 -1.517 1.00 0.00 H new ATOM 0 HG21 VAL A 46 1.796 11.975 1.050 1.00 0.00 H new ATOM 0 HG22 VAL A 46 2.291 13.658 0.751 1.00 0.00 H new ATOM 0 HG23 VAL A 46 0.586 13.279 1.090 1.00 0.00 H new ATOM 685 N SER A 47 0.039 14.300 -3.812 1.00 0.00 N ATOM 686 CA SER A 47 0.157 14.358 -5.259 1.00 0.00 C ATOM 687 C SER A 47 0.128 15.815 -5.728 1.00 0.00 C ATOM 688 O SER A 47 -0.585 16.640 -5.159 1.00 0.00 O ATOM 689 CB SER A 47 -0.959 13.561 -5.936 1.00 0.00 C ATOM 690 OG SER A 47 -0.903 13.663 -7.356 1.00 0.00 O ATOM 0 H SER A 47 -0.907 14.437 -3.455 1.00 0.00 H new ATOM 0 HA SER A 47 1.109 13.910 -5.542 1.00 0.00 H new ATOM 0 HB2 SER A 47 -0.884 12.513 -5.645 1.00 0.00 H new ATOM 0 HB3 SER A 47 -1.926 13.921 -5.585 1.00 0.00 H new ATOM 0 HG SER A 47 -0.477 12.861 -7.725 1.00 0.00 H new ATOM 696 N ASN A 48 0.912 16.086 -6.761 1.00 0.00 N ATOM 697 CA ASN A 48 0.986 17.428 -7.313 1.00 0.00 C ATOM 698 C ASN A 48 1.810 18.315 -6.377 1.00 0.00 C ATOM 699 O ASN A 48 2.878 18.797 -6.753 1.00 0.00 O ATOM 700 CB ASN A 48 -0.408 18.047 -7.444 1.00 0.00 C ATOM 701 CG ASN A 48 -0.401 19.205 -8.444 1.00 0.00 C ATOM 702 OD1 ASN A 48 0.539 19.405 -9.195 1.00 0.00 O ATOM 703 ND2 ASN A 48 -1.500 19.954 -8.411 1.00 0.00 N ATOM 0 H ASN A 48 1.502 15.399 -7.230 1.00 0.00 H new ATOM 0 HA ASN A 48 1.446 17.362 -8.299 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -1.119 17.287 -7.768 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -0.744 18.404 -6.471 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -1.593 20.752 -9.040 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -2.250 19.731 -7.757 1.00 0.00 H new ATOM 710 N ASP A 49 1.283 18.504 -5.176 1.00 0.00 N ATOM 711 CA ASP A 49 1.957 19.324 -4.184 1.00 0.00 C ATOM 712 C ASP A 49 3.188 18.580 -3.663 1.00 0.00 C ATOM 713 O ASP A 49 4.002 19.149 -2.939 1.00 0.00 O ATOM 714 CB ASP A 49 1.040 19.613 -2.994 1.00 0.00 C ATOM 715 CG ASP A 49 1.038 21.067 -2.517 1.00 0.00 C ATOM 716 OD1 ASP A 49 1.700 21.934 -3.107 1.00 0.00 O ATOM 717 OD2 ASP A 49 0.310 21.299 -1.478 1.00 0.00 O ATOM 0 H ASP A 49 0.397 18.103 -4.868 1.00 0.00 H new ATOM 0 HA ASP A 49 2.239 20.264 -4.659 1.00 0.00 H new ATOM 0 HB2 ASP A 49 0.021 19.333 -3.263 1.00 0.00 H new ATOM 0 HB3 ASP A 49 1.337 18.974 -2.162 1.00 0.00 H new ATOM 722 N LYS A 50 3.285 17.317 -4.053 1.00 0.00 N ATOM 723 CA LYS A 50 4.402 16.488 -3.635 1.00 0.00 C ATOM 724 C LYS A 50 4.546 15.309 -4.598 1.00 0.00 C ATOM 725 O LYS A 50 3.728 15.137 -5.501 1.00 0.00 O ATOM 726 CB LYS A 50 4.242 16.071 -2.172 1.00 0.00 C ATOM 727 CG LYS A 50 5.257 16.790 -1.281 1.00 0.00 C ATOM 728 CD LYS A 50 5.344 16.130 0.096 1.00 0.00 C ATOM 729 CE LYS A 50 6.757 16.245 0.672 1.00 0.00 C ATOM 730 NZ LYS A 50 7.035 15.120 1.591 1.00 0.00 N ATOM 0 H LYS A 50 2.608 16.848 -4.654 1.00 0.00 H new ATOM 0 HA LYS A 50 5.333 17.053 -3.681 1.00 0.00 H new ATOM 0 HB2 LYS A 50 3.231 16.299 -1.834 1.00 0.00 H new ATOM 0 HB3 LYS A 50 4.373 14.993 -2.081 1.00 0.00 H new ATOM 0 HG2 LYS A 50 6.237 16.777 -1.757 1.00 0.00 H new ATOM 0 HG3 LYS A 50 4.971 17.836 -1.169 1.00 0.00 H new ATOM 0 HD2 LYS A 50 4.632 16.600 0.774 1.00 0.00 H new ATOM 0 HD3 LYS A 50 5.064 15.080 0.018 1.00 0.00 H new ATOM 0 HE2 LYS A 50 7.487 16.250 -0.138 1.00 0.00 H new ATOM 0 HE3 LYS A 50 6.864 17.191 1.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 7.998 15.213 1.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 6.350 15.133 2.373 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 6.953 14.221 1.074 1.00 0.00 H new ATOM 744 N ARG A 51 5.591 14.526 -4.374 1.00 0.00 N ATOM 745 CA ARG A 51 5.852 13.368 -5.211 1.00 0.00 C ATOM 746 C ARG A 51 4.722 12.346 -5.072 1.00 0.00 C ATOM 747 O ARG A 51 4.120 12.222 -4.006 1.00 0.00 O ATOM 748 CB ARG A 51 7.179 12.704 -4.835 1.00 0.00 C ATOM 749 CG ARG A 51 8.173 13.734 -4.294 1.00 0.00 C ATOM 750 CD ARG A 51 9.592 13.435 -4.782 1.00 0.00 C ATOM 751 NE ARG A 51 9.858 11.981 -4.705 1.00 0.00 N ATOM 752 CZ ARG A 51 11.000 11.404 -5.104 1.00 0.00 C ATOM 753 NH1 ARG A 51 11.988 12.154 -5.611 1.00 0.00 N ATOM 754 NH2 ARG A 51 11.154 10.078 -4.996 1.00 0.00 N ATOM 0 H ARG A 51 6.267 14.671 -3.624 1.00 0.00 H new ATOM 0 HA ARG A 51 5.910 13.712 -6.244 1.00 0.00 H new ATOM 0 HB2 ARG A 51 7.004 11.933 -4.085 1.00 0.00 H new ATOM 0 HB3 ARG A 51 7.602 12.209 -5.709 1.00 0.00 H new ATOM 0 HG2 ARG A 51 7.877 14.733 -4.614 1.00 0.00 H new ATOM 0 HG3 ARG A 51 8.151 13.729 -3.204 1.00 0.00 H new ATOM 0 HD2 ARG A 51 9.713 13.781 -5.808 1.00 0.00 H new ATOM 0 HD3 ARG A 51 10.316 13.978 -4.175 1.00 0.00 H new ATOM 0 HE ARG A 51 9.126 11.381 -4.324 1.00 0.00 H new ATOM 0 HH11 ARG A 51 11.871 13.164 -5.693 1.00 0.00 H new ATOM 0 HH12 ARG A 51 12.857 11.715 -5.915 1.00 0.00 H new ATOM 0 HH21 ARG A 51 10.402 9.507 -4.610 1.00 0.00 H new ATOM 0 HH22 ARG A 51 12.023 9.639 -5.300 1.00 0.00 H new ATOM 768 N ASP A 52 4.467 11.641 -6.164 1.00 0.00 N ATOM 769 CA ASP A 52 3.419 10.634 -6.177 1.00 0.00 C ATOM 770 C ASP A 52 4.028 9.275 -6.525 1.00 0.00 C ATOM 771 O ASP A 52 3.745 8.277 -5.864 1.00 0.00 O ATOM 772 CB ASP A 52 2.356 10.959 -7.229 1.00 0.00 C ATOM 773 CG ASP A 52 1.305 9.868 -7.445 1.00 0.00 C ATOM 774 OD1 ASP A 52 1.574 8.840 -8.083 1.00 0.00 O ATOM 775 OD2 ASP A 52 0.153 10.110 -6.918 1.00 0.00 O ATOM 0 H ASP A 52 4.968 11.747 -7.046 1.00 0.00 H new ATOM 0 HA ASP A 52 2.956 10.616 -5.190 1.00 0.00 H new ATOM 0 HB2 ASP A 52 1.849 11.879 -6.939 1.00 0.00 H new ATOM 0 HB3 ASP A 52 2.854 11.156 -8.178 1.00 0.00 H new ATOM 780 N VAL A 53 4.853 9.279 -7.562 1.00 0.00 N ATOM 781 CA VAL A 53 5.504 8.059 -8.005 1.00 0.00 C ATOM 782 C VAL A 53 6.260 7.434 -6.831 1.00 0.00 C ATOM 783 O VAL A 53 6.584 6.247 -6.857 1.00 0.00 O ATOM 784 CB VAL A 53 6.404 8.353 -9.207 1.00 0.00 C ATOM 785 CG1 VAL A 53 6.973 7.060 -9.795 1.00 0.00 C ATOM 786 CG2 VAL A 53 5.654 9.156 -10.271 1.00 0.00 C ATOM 0 H VAL A 53 5.085 10.109 -8.108 1.00 0.00 H new ATOM 0 HA VAL A 53 4.765 7.331 -8.340 1.00 0.00 H new ATOM 0 HB VAL A 53 7.240 8.959 -8.859 1.00 0.00 H new ATOM 0 HG11 VAL A 53 7.609 7.297 -10.648 1.00 0.00 H new ATOM 0 HG12 VAL A 53 7.561 6.543 -9.036 1.00 0.00 H new ATOM 0 HG13 VAL A 53 6.155 6.417 -10.120 1.00 0.00 H new ATOM 0 HG21 VAL A 53 6.317 9.351 -11.114 1.00 0.00 H new ATOM 0 HG22 VAL A 53 4.789 8.588 -10.613 1.00 0.00 H new ATOM 0 HG23 VAL A 53 5.321 10.102 -9.845 1.00 0.00 H new ATOM 796 N LYS A 54 6.520 8.260 -5.828 1.00 0.00 N ATOM 797 CA LYS A 54 7.232 7.803 -4.647 1.00 0.00 C ATOM 798 C LYS A 54 6.352 6.816 -3.877 1.00 0.00 C ATOM 799 O LYS A 54 6.843 5.812 -3.363 1.00 0.00 O ATOM 800 CB LYS A 54 7.699 8.995 -3.808 1.00 0.00 C ATOM 801 CG LYS A 54 8.327 8.528 -2.494 1.00 0.00 C ATOM 802 CD LYS A 54 8.009 9.502 -1.357 1.00 0.00 C ATOM 803 CE LYS A 54 8.458 8.937 -0.009 1.00 0.00 C ATOM 804 NZ LYS A 54 8.132 9.881 1.084 1.00 0.00 N ATOM 0 H LYS A 54 6.250 9.243 -5.809 1.00 0.00 H new ATOM 0 HA LYS A 54 8.138 7.268 -4.931 1.00 0.00 H new ATOM 0 HB2 LYS A 54 8.424 9.581 -4.374 1.00 0.00 H new ATOM 0 HB3 LYS A 54 6.854 9.650 -3.598 1.00 0.00 H new ATOM 0 HG2 LYS A 54 7.955 7.535 -2.242 1.00 0.00 H new ATOM 0 HG3 LYS A 54 9.407 8.443 -2.613 1.00 0.00 H new ATOM 0 HD2 LYS A 54 8.506 10.455 -1.540 1.00 0.00 H new ATOM 0 HD3 LYS A 54 6.938 9.701 -1.333 1.00 0.00 H new ATOM 0 HE2 LYS A 54 7.969 7.980 0.172 1.00 0.00 H new ATOM 0 HE3 LYS A 54 9.531 8.748 -0.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 8.444 9.482 1.992 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 8.618 10.785 0.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 7.105 10.040 1.110 1.00 0.00 H new ATOM 818 N VAL A 55 5.068 7.137 -3.820 1.00 0.00 N ATOM 819 CA VAL A 55 4.116 6.291 -3.122 1.00 0.00 C ATOM 820 C VAL A 55 3.764 5.090 -4.003 1.00 0.00 C ATOM 821 O VAL A 55 3.405 4.028 -3.497 1.00 0.00 O ATOM 822 CB VAL A 55 2.891 7.110 -2.711 1.00 0.00 C ATOM 823 CG1 VAL A 55 2.098 7.565 -3.938 1.00 0.00 C ATOM 824 CG2 VAL A 55 2.002 6.322 -1.746 1.00 0.00 C ATOM 0 H VAL A 55 4.665 7.972 -4.246 1.00 0.00 H new ATOM 0 HA VAL A 55 4.554 5.902 -2.203 1.00 0.00 H new ATOM 0 HB VAL A 55 3.244 8.000 -2.191 1.00 0.00 H new ATOM 0 HG11 VAL A 55 1.233 8.145 -3.617 1.00 0.00 H new ATOM 0 HG12 VAL A 55 2.733 8.182 -4.573 1.00 0.00 H new ATOM 0 HG13 VAL A 55 1.762 6.692 -4.498 1.00 0.00 H new ATOM 0 HG21 VAL A 55 1.139 6.927 -1.470 1.00 0.00 H new ATOM 0 HG22 VAL A 55 1.663 5.406 -2.229 1.00 0.00 H new ATOM 0 HG23 VAL A 55 2.570 6.071 -0.850 1.00 0.00 H new ATOM 834 N SER A 56 3.879 5.300 -5.306 1.00 0.00 N ATOM 835 CA SER A 56 3.577 4.248 -6.262 1.00 0.00 C ATOM 836 C SER A 56 4.565 3.092 -6.097 1.00 0.00 C ATOM 837 O SER A 56 4.159 1.941 -5.944 1.00 0.00 O ATOM 838 CB SER A 56 3.617 4.780 -7.697 1.00 0.00 C ATOM 839 OG SER A 56 2.598 4.202 -8.508 1.00 0.00 O ATOM 0 H SER A 56 4.177 6.182 -5.722 1.00 0.00 H new ATOM 0 HA SER A 56 2.568 3.886 -6.065 1.00 0.00 H new ATOM 0 HB2 SER A 56 3.500 5.864 -7.685 1.00 0.00 H new ATOM 0 HB3 SER A 56 4.593 4.569 -8.135 1.00 0.00 H new ATOM 0 HG SER A 56 2.952 4.030 -9.405 1.00 0.00 H new ATOM 845 N LEU A 57 5.843 3.438 -6.134 1.00 0.00 N ATOM 846 CA LEU A 57 6.892 2.443 -5.990 1.00 0.00 C ATOM 847 C LEU A 57 6.958 1.983 -4.532 1.00 0.00 C ATOM 848 O LEU A 57 6.850 0.792 -4.248 1.00 0.00 O ATOM 849 CB LEU A 57 8.220 2.983 -6.525 1.00 0.00 C ATOM 850 CG LEU A 57 9.424 2.046 -6.403 1.00 0.00 C ATOM 851 CD1 LEU A 57 10.314 2.131 -7.644 1.00 0.00 C ATOM 852 CD2 LEU A 57 10.206 2.323 -5.117 1.00 0.00 C ATOM 0 H LEU A 57 6.176 4.394 -6.262 1.00 0.00 H new ATOM 0 HA LEU A 57 6.666 1.563 -6.592 1.00 0.00 H new ATOM 0 HB2 LEU A 57 8.088 3.238 -7.577 1.00 0.00 H new ATOM 0 HB3 LEU A 57 8.451 3.909 -5.999 1.00 0.00 H new ATOM 0 HG LEU A 57 9.055 1.022 -6.342 1.00 0.00 H new ATOM 0 HD11 LEU A 57 11.162 1.455 -7.531 1.00 0.00 H new ATOM 0 HD12 LEU A 57 9.738 1.846 -8.525 1.00 0.00 H new ATOM 0 HD13 LEU A 57 10.677 3.152 -7.762 1.00 0.00 H new ATOM 0 HD21 LEU A 57 11.056 1.644 -5.055 1.00 0.00 H new ATOM 0 HD22 LEU A 57 10.564 3.353 -5.123 1.00 0.00 H new ATOM 0 HD23 LEU A 57 9.556 2.170 -4.256 1.00 0.00 H new ATOM 864 N PHE A 58 7.134 2.953 -3.647 1.00 0.00 N ATOM 865 CA PHE A 58 7.215 2.664 -2.226 1.00 0.00 C ATOM 866 C PHE A 58 6.130 1.669 -1.806 1.00 0.00 C ATOM 867 O PHE A 58 6.388 0.760 -1.019 1.00 0.00 O ATOM 868 CB PHE A 58 6.993 3.984 -1.487 1.00 0.00 C ATOM 869 CG PHE A 58 6.930 3.843 0.036 1.00 0.00 C ATOM 870 CD1 PHE A 58 8.075 3.875 0.769 1.00 0.00 C ATOM 871 CD2 PHE A 58 5.730 3.685 0.655 1.00 0.00 C ATOM 872 CE1 PHE A 58 8.017 3.743 2.182 1.00 0.00 C ATOM 873 CE2 PHE A 58 5.672 3.554 2.068 1.00 0.00 C ATOM 874 CZ PHE A 58 6.817 3.586 2.801 1.00 0.00 C ATOM 0 H PHE A 58 7.223 3.940 -3.887 1.00 0.00 H new ATOM 0 HA PHE A 58 8.184 2.225 -1.991 1.00 0.00 H new ATOM 0 HB2 PHE A 58 7.798 4.672 -1.745 1.00 0.00 H new ATOM 0 HB3 PHE A 58 6.064 4.433 -1.839 1.00 0.00 H new ATOM 0 HD1 PHE A 58 9.028 4.001 0.277 1.00 0.00 H new ATOM 0 HD2 PHE A 58 4.821 3.659 0.072 1.00 0.00 H new ATOM 0 HE1 PHE A 58 8.926 3.767 2.765 1.00 0.00 H new ATOM 0 HE2 PHE A 58 4.719 3.429 2.560 1.00 0.00 H new ATOM 0 HZ PHE A 58 6.773 3.487 3.876 1.00 0.00 H new ATOM 884 N THR A 59 4.940 1.877 -2.350 1.00 0.00 N ATOM 885 CA THR A 59 3.815 1.010 -2.042 1.00 0.00 C ATOM 886 C THR A 59 4.003 -0.361 -2.696 1.00 0.00 C ATOM 887 O THR A 59 3.973 -1.386 -2.016 1.00 0.00 O ATOM 888 CB THR A 59 2.535 1.722 -2.483 1.00 0.00 C ATOM 889 OG1 THR A 59 2.460 2.862 -1.630 1.00 0.00 O ATOM 890 CG2 THR A 59 1.275 0.923 -2.147 1.00 0.00 C ATOM 0 H THR A 59 4.730 2.633 -3.002 1.00 0.00 H new ATOM 0 HA THR A 59 3.746 0.818 -0.971 1.00 0.00 H new ATOM 0 HB THR A 59 2.574 1.905 -3.557 1.00 0.00 H new ATOM 0 HG1 THR A 59 2.878 3.630 -2.073 1.00 0.00 H new ATOM 0 HG21 THR A 59 0.395 1.473 -2.481 1.00 0.00 H new ATOM 0 HG22 THR A 59 1.312 -0.043 -2.650 1.00 0.00 H new ATOM 0 HG23 THR A 59 1.219 0.769 -1.069 1.00 0.00 H new ATOM 898 N ALA A 60 4.194 -0.335 -4.006 1.00 0.00 N ATOM 899 CA ALA A 60 4.388 -1.562 -4.759 1.00 0.00 C ATOM 900 C ALA A 60 5.384 -2.457 -4.020 1.00 0.00 C ATOM 901 O ALA A 60 5.192 -3.669 -3.935 1.00 0.00 O ATOM 902 CB ALA A 60 4.849 -1.224 -6.178 1.00 0.00 C ATOM 0 H ALA A 60 4.219 0.517 -4.566 1.00 0.00 H new ATOM 0 HA ALA A 60 3.451 -2.112 -4.844 1.00 0.00 H new ATOM 0 HB1 ALA A 60 4.994 -2.145 -6.742 1.00 0.00 H new ATOM 0 HB2 ALA A 60 4.093 -0.612 -6.670 1.00 0.00 H new ATOM 0 HB3 ALA A 60 5.789 -0.673 -6.134 1.00 0.00 H new ATOM 908 N PHE A 61 6.428 -1.825 -3.503 1.00 0.00 N ATOM 909 CA PHE A 61 7.455 -2.549 -2.774 1.00 0.00 C ATOM 910 C PHE A 61 6.931 -3.029 -1.419 1.00 0.00 C ATOM 911 O PHE A 61 7.183 -4.164 -1.018 1.00 0.00 O ATOM 912 CB PHE A 61 8.612 -1.574 -2.543 1.00 0.00 C ATOM 913 CG PHE A 61 9.993 -2.169 -2.825 1.00 0.00 C ATOM 914 CD1 PHE A 61 10.332 -2.531 -4.091 1.00 0.00 C ATOM 915 CD2 PHE A 61 10.882 -2.335 -1.809 1.00 0.00 C ATOM 916 CE1 PHE A 61 11.614 -3.084 -4.352 1.00 0.00 C ATOM 917 CE2 PHE A 61 12.164 -2.887 -2.070 1.00 0.00 C ATOM 918 CZ PHE A 61 12.503 -3.250 -3.337 1.00 0.00 C ATOM 0 H PHE A 61 6.584 -0.820 -3.575 1.00 0.00 H new ATOM 0 HA PHE A 61 7.768 -3.424 -3.344 1.00 0.00 H new ATOM 0 HB2 PHE A 61 8.468 -0.699 -3.177 1.00 0.00 H new ATOM 0 HB3 PHE A 61 8.581 -1.228 -1.510 1.00 0.00 H new ATOM 0 HD1 PHE A 61 9.627 -2.398 -4.898 1.00 0.00 H new ATOM 0 HD2 PHE A 61 10.613 -2.047 -0.804 1.00 0.00 H new ATOM 0 HE1 PHE A 61 11.883 -3.373 -5.357 1.00 0.00 H new ATOM 0 HE2 PHE A 61 12.870 -3.019 -1.263 1.00 0.00 H new ATOM 0 HZ PHE A 61 13.478 -3.670 -3.536 1.00 0.00 H new ATOM 928 N PHE A 62 6.210 -2.140 -0.751 1.00 0.00 N ATOM 929 CA PHE A 62 5.648 -2.458 0.551 1.00 0.00 C ATOM 930 C PHE A 62 4.695 -3.652 0.459 1.00 0.00 C ATOM 931 O PHE A 62 4.928 -4.686 1.084 1.00 0.00 O ATOM 932 CB PHE A 62 4.863 -1.229 1.012 1.00 0.00 C ATOM 933 CG PHE A 62 4.927 -0.979 2.520 1.00 0.00 C ATOM 934 CD1 PHE A 62 6.040 -0.424 3.071 1.00 0.00 C ATOM 935 CD2 PHE A 62 3.871 -1.312 3.310 1.00 0.00 C ATOM 936 CE1 PHE A 62 6.099 -0.192 4.470 1.00 0.00 C ATOM 937 CE2 PHE A 62 3.930 -1.080 4.709 1.00 0.00 C ATOM 938 CZ PHE A 62 5.043 -0.525 5.260 1.00 0.00 C ATOM 0 H PHE A 62 6.002 -1.200 -1.087 1.00 0.00 H new ATOM 0 HA PHE A 62 6.446 -2.716 1.248 1.00 0.00 H new ATOM 0 HB2 PHE A 62 5.245 -0.351 0.492 1.00 0.00 H new ATOM 0 HB3 PHE A 62 3.820 -1.345 0.717 1.00 0.00 H new ATOM 0 HD1 PHE A 62 6.879 -0.160 2.444 1.00 0.00 H new ATOM 0 HD2 PHE A 62 2.987 -1.753 2.873 1.00 0.00 H new ATOM 0 HE1 PHE A 62 6.983 0.249 4.907 1.00 0.00 H new ATOM 0 HE2 PHE A 62 3.091 -1.344 5.336 1.00 0.00 H new ATOM 0 HZ PHE A 62 5.088 -0.349 6.325 1.00 0.00 H new ATOM 948 N LEU A 63 3.643 -3.470 -0.325 1.00 0.00 N ATOM 949 CA LEU A 63 2.654 -4.519 -0.506 1.00 0.00 C ATOM 950 C LEU A 63 3.341 -5.772 -1.054 1.00 0.00 C ATOM 951 O LEU A 63 3.010 -6.888 -0.658 1.00 0.00 O ATOM 952 CB LEU A 63 1.498 -4.021 -1.376 1.00 0.00 C ATOM 953 CG LEU A 63 0.094 -4.421 -0.919 1.00 0.00 C ATOM 954 CD1 LEU A 63 -0.373 -3.546 0.247 1.00 0.00 C ATOM 955 CD2 LEU A 63 -0.893 -4.392 -2.088 1.00 0.00 C ATOM 0 H LEU A 63 3.454 -2.612 -0.842 1.00 0.00 H new ATOM 0 HA LEU A 63 2.208 -4.792 0.450 1.00 0.00 H new ATOM 0 HB2 LEU A 63 1.547 -2.933 -1.423 1.00 0.00 H new ATOM 0 HB3 LEU A 63 1.647 -4.391 -2.390 1.00 0.00 H new ATOM 0 HG LEU A 63 0.133 -5.448 -0.556 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -1.374 -3.851 0.553 1.00 0.00 H new ATOM 0 HD12 LEU A 63 0.313 -3.661 1.086 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -0.392 -2.502 -0.066 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -1.883 -4.680 -1.735 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -0.935 -3.385 -2.504 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -0.565 -5.090 -2.859 1.00 0.00 H new ATOM 967 N ALA A 64 4.284 -5.544 -1.956 1.00 0.00 N ATOM 968 CA ALA A 64 5.019 -6.641 -2.562 1.00 0.00 C ATOM 969 C ALA A 64 5.647 -7.498 -1.462 1.00 0.00 C ATOM 970 O ALA A 64 5.569 -8.725 -1.506 1.00 0.00 O ATOM 971 CB ALA A 64 6.063 -6.081 -3.532 1.00 0.00 C ATOM 0 H ALA A 64 4.556 -4.616 -2.282 1.00 0.00 H new ATOM 0 HA ALA A 64 4.349 -7.281 -3.136 1.00 0.00 H new ATOM 0 HB1 ALA A 64 6.615 -6.903 -3.987 1.00 0.00 H new ATOM 0 HB2 ALA A 64 5.564 -5.504 -4.311 1.00 0.00 H new ATOM 0 HB3 ALA A 64 6.755 -5.436 -2.990 1.00 0.00 H new ATOM 977 N THR A 65 6.254 -6.819 -0.500 1.00 0.00 N ATOM 978 CA THR A 65 6.894 -7.503 0.611 1.00 0.00 C ATOM 979 C THR A 65 5.843 -8.151 1.515 1.00 0.00 C ATOM 980 O THR A 65 6.089 -9.202 2.104 1.00 0.00 O ATOM 981 CB THR A 65 7.783 -6.493 1.339 1.00 0.00 C ATOM 982 OG1 THR A 65 8.944 -6.398 0.519 1.00 0.00 O ATOM 983 CG2 THR A 65 8.311 -7.031 2.671 1.00 0.00 C ATOM 0 H THR A 65 6.316 -5.801 -0.467 1.00 0.00 H new ATOM 0 HA THR A 65 7.525 -8.320 0.262 1.00 0.00 H new ATOM 0 HB THR A 65 7.221 -5.576 1.515 1.00 0.00 H new ATOM 0 HG1 THR A 65 9.574 -5.762 0.917 1.00 0.00 H new ATOM 0 HG21 THR A 65 8.936 -6.275 3.147 1.00 0.00 H new ATOM 0 HG22 THR A 65 7.472 -7.272 3.324 1.00 0.00 H new ATOM 0 HG23 THR A 65 8.901 -7.930 2.492 1.00 0.00 H new ATOM 991 N ILE A 66 4.694 -7.496 1.597 1.00 0.00 N ATOM 992 CA ILE A 66 3.605 -7.995 2.419 1.00 0.00 C ATOM 993 C ILE A 66 3.112 -9.327 1.851 1.00 0.00 C ATOM 994 O ILE A 66 3.236 -10.366 2.499 1.00 0.00 O ATOM 995 CB ILE A 66 2.507 -6.938 2.552 1.00 0.00 C ATOM 996 CG1 ILE A 66 2.970 -5.772 3.427 1.00 0.00 C ATOM 997 CG2 ILE A 66 1.207 -7.560 3.067 1.00 0.00 C ATOM 998 CD1 ILE A 66 2.964 -6.161 4.907 1.00 0.00 C ATOM 0 H ILE A 66 4.494 -6.624 1.107 1.00 0.00 H new ATOM 0 HA ILE A 66 3.952 -8.190 3.434 1.00 0.00 H new ATOM 0 HB ILE A 66 2.301 -6.534 1.561 1.00 0.00 H new ATOM 0 HG12 ILE A 66 3.974 -5.467 3.131 1.00 0.00 H new ATOM 0 HG13 ILE A 66 2.317 -4.913 3.270 1.00 0.00 H new ATOM 0 HG21 ILE A 66 0.443 -6.787 3.153 1.00 0.00 H new ATOM 0 HG22 ILE A 66 0.870 -8.328 2.371 1.00 0.00 H new ATOM 0 HG23 ILE A 66 1.381 -8.008 4.045 1.00 0.00 H new ATOM 0 HD11 ILE A 66 3.297 -5.314 5.507 1.00 0.00 H new ATOM 0 HD12 ILE A 66 1.954 -6.442 5.205 1.00 0.00 H new ATOM 0 HD13 ILE A 66 3.637 -7.004 5.064 1.00 0.00 H new ATOM 1010 N MET A 67 2.564 -9.254 0.648 1.00 0.00 N ATOM 1011 CA MET A 67 2.051 -10.441 -0.015 1.00 0.00 C ATOM 1012 C MET A 67 3.164 -11.467 -0.240 1.00 0.00 C ATOM 1013 O MET A 67 2.983 -12.653 0.028 1.00 0.00 O ATOM 1014 CB MET A 67 1.437 -10.050 -1.360 1.00 0.00 C ATOM 1015 CG MET A 67 -0.088 -10.176 -1.324 1.00 0.00 C ATOM 1016 SD MET A 67 -0.795 -8.773 -0.476 1.00 0.00 S ATOM 1017 CE MET A 67 -1.551 -9.600 0.914 1.00 0.00 C ATOM 0 H MET A 67 2.464 -8.391 0.114 1.00 0.00 H new ATOM 0 HA MET A 67 1.291 -10.891 0.624 1.00 0.00 H new ATOM 0 HB2 MET A 67 1.715 -9.025 -1.607 1.00 0.00 H new ATOM 0 HB3 MET A 67 1.840 -10.688 -2.147 1.00 0.00 H new ATOM 0 HG2 MET A 67 -0.481 -10.234 -2.339 1.00 0.00 H new ATOM 0 HG3 MET A 67 -0.373 -11.099 -0.819 1.00 0.00 H new ATOM 0 HE1 MET A 67 -2.042 -8.865 1.552 1.00 0.00 H new ATOM 0 HE2 MET A 67 -2.288 -10.317 0.554 1.00 0.00 H new ATOM 0 HE3 MET A 67 -0.785 -10.124 1.486 1.00 0.00 H new ATOM 1027 N GLY A 68 4.291 -10.971 -0.732 1.00 0.00 N ATOM 1028 CA GLY A 68 5.433 -11.830 -0.996 1.00 0.00 C ATOM 1029 C GLY A 68 5.756 -11.866 -2.491 1.00 0.00 C ATOM 1030 O GLY A 68 6.255 -12.870 -2.998 1.00 0.00 O ATOM 0 H GLY A 68 4.437 -9.986 -0.954 1.00 0.00 H new ATOM 0 HA2 GLY A 68 6.300 -11.470 -0.441 1.00 0.00 H new ATOM 0 HA3 GLY A 68 5.224 -12.839 -0.641 1.00 0.00 H new ATOM 1034 N VAL A 69 5.460 -10.759 -3.155 1.00 0.00 N ATOM 1035 CA VAL A 69 5.713 -10.652 -4.582 1.00 0.00 C ATOM 1036 C VAL A 69 7.062 -11.298 -4.906 1.00 0.00 C ATOM 1037 O VAL A 69 7.252 -11.832 -5.998 1.00 0.00 O ATOM 1038 CB VAL A 69 5.631 -9.188 -5.020 1.00 0.00 C ATOM 1039 CG1 VAL A 69 6.629 -8.894 -6.142 1.00 0.00 C ATOM 1040 CG2 VAL A 69 4.207 -8.821 -5.442 1.00 0.00 C ATOM 0 H VAL A 69 5.047 -9.928 -2.731 1.00 0.00 H new ATOM 0 HA VAL A 69 4.951 -11.189 -5.146 1.00 0.00 H new ATOM 0 HB VAL A 69 5.897 -8.567 -4.165 1.00 0.00 H new ATOM 0 HG11 VAL A 69 6.550 -7.847 -6.434 1.00 0.00 H new ATOM 0 HG12 VAL A 69 7.641 -9.097 -5.791 1.00 0.00 H new ATOM 0 HG13 VAL A 69 6.408 -9.528 -7.001 1.00 0.00 H new ATOM 0 HG21 VAL A 69 4.176 -7.775 -5.749 1.00 0.00 H new ATOM 0 HG22 VAL A 69 3.900 -9.453 -6.276 1.00 0.00 H new ATOM 0 HG23 VAL A 69 3.528 -8.973 -4.603 1.00 0.00 H new ATOM 1050 N ARG A 70 7.964 -11.227 -3.938 1.00 0.00 N ATOM 1051 CA ARG A 70 9.289 -11.798 -4.107 1.00 0.00 C ATOM 1052 C ARG A 70 9.190 -13.196 -4.723 1.00 0.00 C ATOM 1053 O ARG A 70 8.214 -13.910 -4.497 1.00 0.00 O ATOM 1054 CB ARG A 70 10.024 -11.889 -2.769 1.00 0.00 C ATOM 1055 CG ARG A 70 11.529 -12.065 -2.981 1.00 0.00 C ATOM 1056 CD ARG A 70 12.222 -10.711 -3.143 1.00 0.00 C ATOM 1057 NE ARG A 70 13.059 -10.425 -1.956 1.00 0.00 N ATOM 1058 CZ ARG A 70 13.565 -9.218 -1.668 1.00 0.00 C ATOM 1059 NH1 ARG A 70 13.324 -8.179 -2.478 1.00 0.00 N ATOM 1060 NH2 ARG A 70 14.314 -9.051 -0.569 1.00 0.00 N ATOM 0 H ARG A 70 7.803 -10.783 -3.034 1.00 0.00 H new ATOM 0 HA ARG A 70 9.850 -11.142 -4.773 1.00 0.00 H new ATOM 0 HB2 ARG A 70 9.838 -10.987 -2.186 1.00 0.00 H new ATOM 0 HB3 ARG A 70 9.634 -12.727 -2.192 1.00 0.00 H new ATOM 0 HG2 ARG A 70 11.959 -12.599 -2.134 1.00 0.00 H new ATOM 0 HG3 ARG A 70 11.706 -12.676 -3.866 1.00 0.00 H new ATOM 0 HD2 ARG A 70 12.839 -10.714 -4.041 1.00 0.00 H new ATOM 0 HD3 ARG A 70 11.478 -9.925 -3.271 1.00 0.00 H new ATOM 0 HE ARG A 70 13.263 -11.194 -1.318 1.00 0.00 H new ATOM 0 HH11 ARG A 70 12.755 -8.306 -3.315 1.00 0.00 H new ATOM 0 HH12 ARG A 70 13.710 -7.261 -2.258 1.00 0.00 H new ATOM 0 HH21 ARG A 70 14.499 -9.842 0.048 1.00 0.00 H new ATOM 0 HH22 ARG A 70 14.699 -8.133 -0.349 1.00 0.00 H new ATOM 1074 N PHE A 71 10.214 -13.544 -5.489 1.00 0.00 N ATOM 1075 CA PHE A 71 10.254 -14.843 -6.139 1.00 0.00 C ATOM 1076 C PHE A 71 9.677 -15.929 -5.229 1.00 0.00 C ATOM 1077 O PHE A 71 8.755 -16.644 -5.619 1.00 0.00 O ATOM 1078 CB PHE A 71 11.725 -15.157 -6.418 1.00 0.00 C ATOM 1079 CG PHE A 71 11.942 -16.393 -7.293 1.00 0.00 C ATOM 1080 CD1 PHE A 71 11.762 -16.314 -8.638 1.00 0.00 C ATOM 1081 CD2 PHE A 71 12.316 -17.571 -6.725 1.00 0.00 C ATOM 1082 CE1 PHE A 71 11.963 -17.461 -9.451 1.00 0.00 C ATOM 1083 CE2 PHE A 71 12.517 -18.719 -7.537 1.00 0.00 C ATOM 1084 CZ PHE A 71 12.337 -18.639 -8.883 1.00 0.00 C ATOM 0 H PHE A 71 11.022 -12.949 -5.674 1.00 0.00 H new ATOM 0 HA PHE A 71 9.662 -14.820 -7.054 1.00 0.00 H new ATOM 0 HB2 PHE A 71 12.184 -14.296 -6.903 1.00 0.00 H new ATOM 0 HB3 PHE A 71 12.242 -15.301 -5.469 1.00 0.00 H new ATOM 0 HD1 PHE A 71 11.466 -15.378 -9.089 1.00 0.00 H new ATOM 0 HD2 PHE A 71 12.460 -17.633 -5.656 1.00 0.00 H new ATOM 0 HE1 PHE A 71 11.819 -17.398 -10.519 1.00 0.00 H new ATOM 0 HE2 PHE A 71 12.813 -19.655 -7.086 1.00 0.00 H new ATOM 0 HZ PHE A 71 12.491 -19.511 -9.501 1.00 0.00 H new ATOM 1094 N LYS A 72 10.243 -16.019 -4.035 1.00 0.00 N ATOM 1095 CA LYS A 72 9.795 -17.006 -3.067 1.00 0.00 C ATOM 1096 C LYS A 72 10.219 -18.400 -3.533 1.00 0.00 C ATOM 1097 O LYS A 72 11.211 -18.945 -3.051 1.00 0.00 O ATOM 1098 CB LYS A 72 8.292 -16.871 -2.820 1.00 0.00 C ATOM 1099 CG LYS A 72 7.994 -16.693 -1.329 1.00 0.00 C ATOM 1100 CD LYS A 72 6.743 -17.473 -0.923 1.00 0.00 C ATOM 1101 CE LYS A 72 6.514 -17.394 0.588 1.00 0.00 C ATOM 1102 NZ LYS A 72 7.348 -18.394 1.291 1.00 0.00 N ATOM 0 H LYS A 72 11.008 -15.425 -3.715 1.00 0.00 H new ATOM 0 HA LYS A 72 10.270 -16.834 -2.101 1.00 0.00 H new ATOM 0 HB2 LYS A 72 7.904 -16.018 -3.376 1.00 0.00 H new ATOM 0 HB3 LYS A 72 7.778 -17.756 -3.194 1.00 0.00 H new ATOM 0 HG2 LYS A 72 8.846 -17.034 -0.741 1.00 0.00 H new ATOM 0 HG3 LYS A 72 7.856 -15.635 -1.106 1.00 0.00 H new ATOM 0 HD2 LYS A 72 5.875 -17.074 -1.447 1.00 0.00 H new ATOM 0 HD3 LYS A 72 6.846 -18.515 -1.225 1.00 0.00 H new ATOM 0 HE2 LYS A 72 6.756 -16.393 0.947 1.00 0.00 H new ATOM 0 HE3 LYS A 72 5.461 -17.567 0.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 7.181 -18.327 2.315 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 7.098 -19.348 0.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 8.352 -18.211 1.092 1.00 0.00 H new ATOM 1116 N ARG A 73 9.447 -18.937 -4.466 1.00 0.00 N ATOM 1117 CA ARG A 73 9.730 -20.257 -5.003 1.00 0.00 C ATOM 1118 C ARG A 73 8.884 -20.515 -6.252 1.00 0.00 C ATOM 1119 O ARG A 73 9.422 -20.747 -7.333 1.00 0.00 O ATOM 1120 CB ARG A 73 9.443 -21.346 -3.968 1.00 0.00 C ATOM 1121 CG ARG A 73 10.468 -22.478 -4.063 1.00 0.00 C ATOM 1122 CD ARG A 73 9.776 -23.841 -4.121 1.00 0.00 C ATOM 1123 NE ARG A 73 9.911 -24.532 -2.819 1.00 0.00 N ATOM 1124 CZ ARG A 73 9.249 -25.650 -2.490 1.00 0.00 C ATOM 1125 NH1 ARG A 73 8.403 -26.210 -3.365 1.00 0.00 N ATOM 1126 NH2 ARG A 73 9.433 -26.208 -1.286 1.00 0.00 N ATOM 0 H ARG A 73 8.625 -18.482 -4.864 1.00 0.00 H new ATOM 0 HA ARG A 73 10.788 -20.289 -5.263 1.00 0.00 H new ATOM 0 HB2 ARG A 73 9.463 -20.915 -2.967 1.00 0.00 H new ATOM 0 HB3 ARG A 73 8.440 -21.745 -4.123 1.00 0.00 H new ATOM 0 HG2 ARG A 73 11.085 -22.341 -4.951 1.00 0.00 H new ATOM 0 HG3 ARG A 73 11.136 -22.442 -3.202 1.00 0.00 H new ATOM 0 HD2 ARG A 73 8.722 -23.713 -4.367 1.00 0.00 H new ATOM 0 HD3 ARG A 73 10.216 -24.448 -4.912 1.00 0.00 H new ATOM 0 HE ARG A 73 10.547 -24.132 -2.129 1.00 0.00 H new ATOM 0 HH11 ARG A 73 8.263 -25.786 -4.282 1.00 0.00 H new ATOM 0 HH12 ARG A 73 7.899 -27.061 -3.114 1.00 0.00 H new ATOM 0 HH21 ARG A 73 10.077 -25.782 -0.620 1.00 0.00 H new ATOM 0 HH22 ARG A 73 8.929 -27.059 -1.036 1.00 0.00 H new ATOM 1140 N SER A 74 7.574 -20.465 -6.061 1.00 0.00 N ATOM 1141 CA SER A 74 6.648 -20.690 -7.158 1.00 0.00 C ATOM 1142 C SER A 74 5.350 -19.918 -6.915 1.00 0.00 C ATOM 1143 O SER A 74 5.213 -19.231 -5.903 1.00 0.00 O ATOM 1144 CB SER A 74 6.353 -22.182 -7.333 1.00 0.00 C ATOM 1145 OG SER A 74 6.553 -22.612 -8.676 1.00 0.00 O ATOM 0 H SER A 74 7.132 -20.272 -5.162 1.00 0.00 H new ATOM 0 HA SER A 74 7.112 -20.328 -8.076 1.00 0.00 H new ATOM 0 HB2 SER A 74 6.996 -22.759 -6.668 1.00 0.00 H new ATOM 0 HB3 SER A 74 5.324 -22.385 -7.037 1.00 0.00 H new ATOM 0 HG SER A 74 6.356 -23.569 -8.746 1.00 0.00 H new ATOM 1151 N LYS A 75 4.431 -20.055 -7.859 1.00 0.00 N ATOM 1152 CA LYS A 75 3.150 -19.378 -7.761 1.00 0.00 C ATOM 1153 C LYS A 75 3.342 -17.887 -8.045 1.00 0.00 C ATOM 1154 O LYS A 75 3.052 -17.047 -7.194 1.00 0.00 O ATOM 1155 CB LYS A 75 2.494 -19.667 -6.409 1.00 0.00 C ATOM 1156 CG LYS A 75 1.136 -20.347 -6.592 1.00 0.00 C ATOM 1157 CD LYS A 75 1.273 -21.870 -6.544 1.00 0.00 C ATOM 1158 CE LYS A 75 0.565 -22.445 -5.316 1.00 0.00 C ATOM 1159 NZ LYS A 75 1.414 -23.462 -4.656 1.00 0.00 N ATOM 0 H LYS A 75 4.549 -20.626 -8.696 1.00 0.00 H new ATOM 0 HA LYS A 75 2.459 -19.759 -8.513 1.00 0.00 H new ATOM 0 HB2 LYS A 75 3.147 -20.305 -5.813 1.00 0.00 H new ATOM 0 HB3 LYS A 75 2.367 -18.736 -5.856 1.00 0.00 H new ATOM 0 HG2 LYS A 75 0.451 -20.015 -5.811 1.00 0.00 H new ATOM 0 HG3 LYS A 75 0.701 -20.048 -7.546 1.00 0.00 H new ATOM 0 HD2 LYS A 75 0.850 -22.306 -7.449 1.00 0.00 H new ATOM 0 HD3 LYS A 75 2.328 -22.143 -6.521 1.00 0.00 H new ATOM 0 HE2 LYS A 75 0.335 -21.644 -4.614 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -0.384 -22.892 -5.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 0.918 -23.842 -3.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 1.613 -24.235 -5.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 2.309 -23.025 -4.356 1.00 0.00 H new ATOM 1173 N LYS A 76 3.829 -17.604 -9.244 1.00 0.00 N ATOM 1174 CA LYS A 76 4.063 -16.229 -9.651 1.00 0.00 C ATOM 1175 C LYS A 76 2.769 -15.641 -10.217 1.00 0.00 C ATOM 1176 O LYS A 76 2.771 -15.055 -11.298 1.00 0.00 O ATOM 1177 CB LYS A 76 5.248 -16.150 -10.615 1.00 0.00 C ATOM 1178 CG LYS A 76 4.899 -16.779 -11.965 1.00 0.00 C ATOM 1179 CD LYS A 76 6.093 -17.546 -12.538 1.00 0.00 C ATOM 1180 CE LYS A 76 5.629 -18.762 -13.341 1.00 0.00 C ATOM 1181 NZ LYS A 76 6.740 -19.725 -13.513 1.00 0.00 N ATOM 0 H LYS A 76 4.068 -18.303 -9.947 1.00 0.00 H new ATOM 0 HA LYS A 76 4.340 -15.619 -8.791 1.00 0.00 H new ATOM 0 HB2 LYS A 76 5.536 -15.109 -10.759 1.00 0.00 H new ATOM 0 HB3 LYS A 76 6.108 -16.662 -10.183 1.00 0.00 H new ATOM 0 HG2 LYS A 76 4.051 -17.454 -11.847 1.00 0.00 H new ATOM 0 HG3 LYS A 76 4.592 -16.001 -12.664 1.00 0.00 H new ATOM 0 HD2 LYS A 76 6.681 -16.887 -13.177 1.00 0.00 H new ATOM 0 HD3 LYS A 76 6.746 -17.869 -11.727 1.00 0.00 H new ATOM 0 HE2 LYS A 76 4.796 -19.246 -12.831 1.00 0.00 H new ATOM 0 HE3 LYS A 76 5.263 -18.443 -14.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 6.408 -20.544 -14.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 7.523 -19.265 -14.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 7.071 -20.043 -12.580 1.00 0.00 H new ATOM 1195 N ILE A 77 1.695 -15.820 -9.462 1.00 0.00 N ATOM 1196 CA ILE A 77 0.397 -15.315 -9.875 1.00 0.00 C ATOM 1197 C ILE A 77 -0.027 -14.182 -8.938 1.00 0.00 C ATOM 1198 O ILE A 77 -0.929 -13.411 -9.259 1.00 0.00 O ATOM 1199 CB ILE A 77 -0.619 -16.455 -9.960 1.00 0.00 C ATOM 1200 CG1 ILE A 77 -0.670 -17.243 -8.650 1.00 0.00 C ATOM 1201 CG2 ILE A 77 -0.330 -17.359 -11.161 1.00 0.00 C ATOM 1202 CD1 ILE A 77 -1.697 -18.375 -8.730 1.00 0.00 C ATOM 0 H ILE A 77 1.697 -16.308 -8.566 1.00 0.00 H new ATOM 0 HA ILE A 77 0.454 -14.894 -10.879 1.00 0.00 H new ATOM 0 HB ILE A 77 -1.607 -16.021 -10.114 1.00 0.00 H new ATOM 0 HG12 ILE A 77 0.315 -17.656 -8.431 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -0.925 -16.573 -7.828 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -1.067 -18.161 -11.198 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -0.385 -16.773 -12.079 1.00 0.00 H new ATOM 0 HG23 ILE A 77 0.668 -17.787 -11.063 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -1.713 -18.919 -7.786 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -2.685 -17.957 -8.925 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -1.426 -19.056 -9.537 1.00 0.00 H new ATOM 1214 N MET A 78 0.644 -14.119 -7.797 1.00 0.00 N ATOM 1215 CA MET A 78 0.348 -13.093 -6.811 1.00 0.00 C ATOM 1216 C MET A 78 0.958 -11.750 -7.217 1.00 0.00 C ATOM 1217 O MET A 78 0.278 -10.725 -7.201 1.00 0.00 O ATOM 1218 CB MET A 78 0.906 -13.517 -5.451 1.00 0.00 C ATOM 1219 CG MET A 78 -0.220 -13.709 -4.432 1.00 0.00 C ATOM 1220 SD MET A 78 -0.728 -15.420 -4.400 1.00 0.00 S ATOM 1221 CE MET A 78 0.575 -16.112 -3.397 1.00 0.00 C ATOM 0 H MET A 78 1.391 -14.761 -7.533 1.00 0.00 H new ATOM 0 HA MET A 78 -0.734 -12.975 -6.750 1.00 0.00 H new ATOM 0 HB2 MET A 78 1.467 -14.445 -5.558 1.00 0.00 H new ATOM 0 HB3 MET A 78 1.604 -12.762 -5.089 1.00 0.00 H new ATOM 0 HG2 MET A 78 0.118 -13.403 -3.442 1.00 0.00 H new ATOM 0 HG3 MET A 78 -1.068 -13.074 -4.690 1.00 0.00 H new ATOM 0 HE1 MET A 78 0.893 -17.065 -3.820 1.00 0.00 H new ATOM 0 HE2 MET A 78 1.421 -15.425 -3.374 1.00 0.00 H new ATOM 0 HE3 MET A 78 0.209 -16.270 -2.383 1.00 0.00 H new ATOM 1231 N PRO A 79 2.268 -11.799 -7.580 1.00 0.00 N ATOM 1232 CA PRO A 79 2.976 -10.599 -7.990 1.00 0.00 C ATOM 1233 C PRO A 79 2.565 -10.173 -9.401 1.00 0.00 C ATOM 1234 O PRO A 79 1.570 -10.661 -9.935 1.00 0.00 O ATOM 1235 CB PRO A 79 4.450 -10.957 -7.883 1.00 0.00 C ATOM 1236 CG PRO A 79 4.510 -12.476 -7.868 1.00 0.00 C ATOM 1237 CD PRO A 79 3.105 -12.995 -7.612 1.00 0.00 C ATOM 0 HA PRO A 79 2.742 -9.738 -7.364 1.00 0.00 H new ATOM 0 HB2 PRO A 79 5.012 -10.552 -8.724 1.00 0.00 H new ATOM 0 HB3 PRO A 79 4.888 -10.540 -6.976 1.00 0.00 H new ATOM 0 HG2 PRO A 79 4.889 -12.853 -8.818 1.00 0.00 H new ATOM 0 HG3 PRO A 79 5.193 -12.823 -7.092 1.00 0.00 H new ATOM 0 HD2 PRO A 79 2.787 -13.680 -8.398 1.00 0.00 H new ATOM 0 HD3 PRO A 79 3.050 -13.542 -6.671 1.00 0.00 H new ATOM 1245 N ALA A 80 3.351 -9.268 -9.964 1.00 0.00 N ATOM 1246 CA ALA A 80 3.081 -8.771 -11.302 1.00 0.00 C ATOM 1247 C ALA A 80 2.068 -7.628 -11.222 1.00 0.00 C ATOM 1248 O ALA A 80 2.290 -6.556 -11.785 1.00 0.00 O ATOM 1249 CB ALA A 80 2.594 -9.922 -12.185 1.00 0.00 C ATOM 0 H ALA A 80 4.175 -8.866 -9.518 1.00 0.00 H new ATOM 0 HA ALA A 80 3.990 -8.374 -11.755 1.00 0.00 H new ATOM 0 HB1 ALA A 80 2.391 -9.550 -13.189 1.00 0.00 H new ATOM 0 HB2 ALA A 80 3.362 -10.694 -12.233 1.00 0.00 H new ATOM 0 HB3 ALA A 80 1.681 -10.343 -11.763 1.00 0.00 H new ATOM 1255 N GLY A 81 0.977 -7.894 -10.519 1.00 0.00 N ATOM 1256 CA GLY A 81 -0.071 -6.901 -10.358 1.00 0.00 C ATOM 1257 C GLY A 81 0.417 -5.720 -9.516 1.00 0.00 C ATOM 1258 O GLY A 81 -0.034 -4.591 -9.703 1.00 0.00 O ATOM 0 H GLY A 81 0.796 -8.784 -10.054 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -0.394 -6.546 -11.337 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -0.939 -7.357 -9.882 1.00 0.00 H new ATOM 1262 N LEU A 82 1.332 -6.022 -8.606 1.00 0.00 N ATOM 1263 CA LEU A 82 1.886 -5.000 -7.735 1.00 0.00 C ATOM 1264 C LEU A 82 2.488 -3.881 -8.586 1.00 0.00 C ATOM 1265 O LEU A 82 1.908 -2.803 -8.702 1.00 0.00 O ATOM 1266 CB LEU A 82 2.874 -5.619 -6.744 1.00 0.00 C ATOM 1267 CG LEU A 82 2.456 -5.590 -5.273 1.00 0.00 C ATOM 1268 CD1 LEU A 82 2.066 -4.175 -4.841 1.00 0.00 C ATOM 1269 CD2 LEU A 82 1.340 -6.601 -5.000 1.00 0.00 C ATOM 0 H LEU A 82 1.703 -6.960 -8.453 1.00 0.00 H new ATOM 0 HA LEU A 82 1.100 -4.550 -7.128 1.00 0.00 H new ATOM 0 HB2 LEU A 82 3.045 -6.656 -7.032 1.00 0.00 H new ATOM 0 HB3 LEU A 82 3.828 -5.100 -6.840 1.00 0.00 H new ATOM 0 HG LEU A 82 3.313 -5.886 -4.669 1.00 0.00 H new ATOM 0 HD11 LEU A 82 1.773 -4.183 -3.791 1.00 0.00 H new ATOM 0 HD12 LEU A 82 2.916 -3.506 -4.976 1.00 0.00 H new ATOM 0 HD13 LEU A 82 1.231 -3.826 -5.448 1.00 0.00 H new ATOM 0 HD21 LEU A 82 1.061 -6.560 -3.947 1.00 0.00 H new ATOM 0 HD22 LEU A 82 0.473 -6.360 -5.614 1.00 0.00 H new ATOM 0 HD23 LEU A 82 1.690 -7.604 -5.244 1.00 0.00 H new ATOM 1281 N VAL A 83 3.645 -4.176 -9.162 1.00 0.00 N ATOM 1282 CA VAL A 83 4.332 -3.208 -10.000 1.00 0.00 C ATOM 1283 C VAL A 83 3.379 -2.716 -11.090 1.00 0.00 C ATOM 1284 O VAL A 83 3.234 -1.512 -11.296 1.00 0.00 O ATOM 1285 CB VAL A 83 5.617 -3.821 -10.561 1.00 0.00 C ATOM 1286 CG1 VAL A 83 6.265 -2.890 -11.588 1.00 0.00 C ATOM 1287 CG2 VAL A 83 6.597 -4.164 -9.437 1.00 0.00 C ATOM 0 H VAL A 83 4.123 -5.072 -9.065 1.00 0.00 H new ATOM 0 HA VAL A 83 4.631 -2.339 -9.414 1.00 0.00 H new ATOM 0 HB VAL A 83 5.352 -4.748 -11.069 1.00 0.00 H new ATOM 0 HG11 VAL A 83 7.176 -3.349 -11.971 1.00 0.00 H new ATOM 0 HG12 VAL A 83 5.572 -2.718 -12.411 1.00 0.00 H new ATOM 0 HG13 VAL A 83 6.509 -1.939 -11.114 1.00 0.00 H new ATOM 0 HG21 VAL A 83 7.502 -4.598 -9.863 1.00 0.00 H new ATOM 0 HG22 VAL A 83 6.853 -3.258 -8.888 1.00 0.00 H new ATOM 0 HG23 VAL A 83 6.135 -4.881 -8.758 1.00 0.00 H new ATOM 1297 N ALA A 84 2.753 -3.672 -11.760 1.00 0.00 N ATOM 1298 CA ALA A 84 1.817 -3.351 -12.825 1.00 0.00 C ATOM 1299 C ALA A 84 0.858 -2.262 -12.342 1.00 0.00 C ATOM 1300 O ALA A 84 0.428 -1.417 -13.126 1.00 0.00 O ATOM 1301 CB ALA A 84 1.085 -4.621 -13.261 1.00 0.00 C ATOM 0 H ALA A 84 2.875 -4.670 -11.586 1.00 0.00 H new ATOM 0 HA ALA A 84 2.344 -2.964 -13.697 1.00 0.00 H new ATOM 0 HB1 ALA A 84 0.383 -4.380 -14.060 1.00 0.00 H new ATOM 0 HB2 ALA A 84 1.808 -5.352 -13.622 1.00 0.00 H new ATOM 0 HB3 ALA A 84 0.541 -5.037 -12.413 1.00 0.00 H new ATOM 1307 N GLY A 85 0.550 -2.316 -11.055 1.00 0.00 N ATOM 1308 CA GLY A 85 -0.351 -1.344 -10.459 1.00 0.00 C ATOM 1309 C GLY A 85 0.340 0.010 -10.285 1.00 0.00 C ATOM 1310 O GLY A 85 -0.200 1.041 -10.682 1.00 0.00 O ATOM 0 H GLY A 85 0.908 -3.018 -10.408 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -1.234 -1.228 -11.088 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -0.695 -1.708 -9.491 1.00 0.00 H new ATOM 1314 N LEU A 86 1.523 -0.038 -9.692 1.00 0.00 N ATOM 1315 CA LEU A 86 2.294 1.172 -9.461 1.00 0.00 C ATOM 1316 C LEU A 86 2.317 2.009 -10.741 1.00 0.00 C ATOM 1317 O LEU A 86 2.125 3.223 -10.697 1.00 0.00 O ATOM 1318 CB LEU A 86 3.685 0.827 -8.926 1.00 0.00 C ATOM 1319 CG LEU A 86 4.838 0.958 -9.923 1.00 0.00 C ATOM 1320 CD1 LEU A 86 5.101 2.425 -10.269 1.00 0.00 C ATOM 1321 CD2 LEU A 86 6.095 0.258 -9.403 1.00 0.00 C ATOM 0 H LEU A 86 1.967 -0.896 -9.364 1.00 0.00 H new ATOM 0 HA LEU A 86 1.824 1.782 -8.690 1.00 0.00 H new ATOM 0 HB2 LEU A 86 3.894 1.471 -8.072 1.00 0.00 H new ATOM 0 HB3 LEU A 86 3.666 -0.198 -8.555 1.00 0.00 H new ATOM 0 HG LEU A 86 4.549 0.457 -10.847 1.00 0.00 H new ATOM 0 HD11 LEU A 86 5.925 2.489 -10.979 1.00 0.00 H new ATOM 0 HD12 LEU A 86 4.205 2.861 -10.712 1.00 0.00 H new ATOM 0 HD13 LEU A 86 5.360 2.972 -9.362 1.00 0.00 H new ATOM 0 HD21 LEU A 86 6.899 0.366 -10.131 1.00 0.00 H new ATOM 0 HD22 LEU A 86 6.398 0.709 -8.458 1.00 0.00 H new ATOM 0 HD23 LEU A 86 5.885 -0.800 -9.249 1.00 0.00 H new ATOM 1333 N SER A 87 2.553 1.327 -11.852 1.00 0.00 N ATOM 1334 CA SER A 87 2.604 1.992 -13.143 1.00 0.00 C ATOM 1335 C SER A 87 1.207 2.474 -13.538 1.00 0.00 C ATOM 1336 O SER A 87 1.025 3.639 -13.891 1.00 0.00 O ATOM 1337 CB SER A 87 3.170 1.064 -14.219 1.00 0.00 C ATOM 1338 OG SER A 87 4.501 1.419 -14.584 1.00 0.00 O ATOM 0 H SER A 87 2.711 0.320 -11.885 1.00 0.00 H new ATOM 0 HA SER A 87 3.268 2.852 -13.059 1.00 0.00 H new ATOM 0 HB2 SER A 87 3.156 0.036 -13.856 1.00 0.00 H new ATOM 0 HB3 SER A 87 2.531 1.099 -15.101 1.00 0.00 H new ATOM 0 HG SER A 87 4.827 0.802 -15.272 1.00 0.00 H new ATOM 1344 N LEU A 88 0.256 1.554 -13.467 1.00 0.00 N ATOM 1345 CA LEU A 88 -1.119 1.871 -13.813 1.00 0.00 C ATOM 1346 C LEU A 88 -1.557 3.124 -13.051 1.00 0.00 C ATOM 1347 O LEU A 88 -2.416 3.870 -13.518 1.00 0.00 O ATOM 1348 CB LEU A 88 -2.024 0.660 -13.576 1.00 0.00 C ATOM 1349 CG LEU A 88 -2.756 0.119 -14.806 1.00 0.00 C ATOM 1350 CD1 LEU A 88 -3.723 1.161 -15.370 1.00 0.00 C ATOM 1351 CD2 LEU A 88 -1.765 -0.374 -15.861 1.00 0.00 C ATOM 0 H LEU A 88 0.411 0.589 -13.175 1.00 0.00 H new ATOM 0 HA LEU A 88 -1.201 2.099 -14.876 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -1.420 -0.143 -13.155 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -2.767 0.928 -12.824 1.00 0.00 H new ATOM 0 HG LEU A 88 -3.352 -0.740 -14.499 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -4.230 0.751 -16.243 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -4.461 1.421 -14.611 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -3.168 2.054 -15.658 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -2.312 -0.753 -16.724 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -1.123 0.451 -16.171 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -1.153 -1.172 -15.440 1.00 0.00 H new ATOM 1363 N MET A 89 -0.946 3.316 -11.891 1.00 0.00 N ATOM 1364 CA MET A 89 -1.262 4.465 -11.060 1.00 0.00 C ATOM 1365 C MET A 89 -0.600 5.733 -11.604 1.00 0.00 C ATOM 1366 O MET A 89 -1.286 6.676 -11.998 1.00 0.00 O ATOM 1367 CB MET A 89 -0.780 4.210 -9.631 1.00 0.00 C ATOM 1368 CG MET A 89 -1.769 4.776 -8.610 1.00 0.00 C ATOM 1369 SD MET A 89 -2.164 6.469 -9.015 1.00 0.00 S ATOM 1370 CE MET A 89 -0.536 7.195 -8.931 1.00 0.00 C ATOM 0 H MET A 89 -0.234 2.695 -11.507 1.00 0.00 H new ATOM 0 HA MET A 89 -2.342 4.609 -11.068 1.00 0.00 H new ATOM 0 HB2 MET A 89 -0.659 3.139 -9.470 1.00 0.00 H new ATOM 0 HB3 MET A 89 0.199 4.667 -9.487 1.00 0.00 H new ATOM 0 HG2 MET A 89 -2.678 4.174 -8.600 1.00 0.00 H new ATOM 0 HG3 MET A 89 -1.341 4.723 -7.609 1.00 0.00 H new ATOM 0 HE1 MET A 89 -0.526 7.979 -8.173 1.00 0.00 H new ATOM 0 HE2 MET A 89 0.192 6.427 -8.669 1.00 0.00 H new ATOM 0 HE3 MET A 89 -0.278 7.623 -9.900 1.00 0.00 H new ATOM 1380 N MET A 90 0.725 5.716 -11.608 1.00 0.00 N ATOM 1381 CA MET A 90 1.487 6.852 -12.097 1.00 0.00 C ATOM 1382 C MET A 90 0.869 7.416 -13.378 1.00 0.00 C ATOM 1383 O MET A 90 0.878 8.627 -13.595 1.00 0.00 O ATOM 1384 CB MET A 90 2.928 6.420 -12.373 1.00 0.00 C ATOM 1385 CG MET A 90 3.742 7.571 -12.968 1.00 0.00 C ATOM 1386 SD MET A 90 4.725 6.981 -14.335 1.00 0.00 S ATOM 1387 CE MET A 90 5.988 6.087 -13.446 1.00 0.00 C ATOM 0 H MET A 90 1.290 4.933 -11.280 1.00 0.00 H new ATOM 0 HA MET A 90 1.472 7.631 -11.335 1.00 0.00 H new ATOM 0 HB2 MET A 90 3.393 6.081 -11.447 1.00 0.00 H new ATOM 0 HB3 MET A 90 2.932 5.574 -13.060 1.00 0.00 H new ATOM 0 HG2 MET A 90 3.074 8.363 -13.305 1.00 0.00 H new ATOM 0 HG3 MET A 90 4.389 8.003 -12.204 1.00 0.00 H new ATOM 0 HE1 MET A 90 6.692 5.651 -14.155 1.00 0.00 H new ATOM 0 HE2 MET A 90 6.518 6.770 -12.782 1.00 0.00 H new ATOM 0 HE3 MET A 90 5.527 5.294 -12.858 1.00 0.00 H new ATOM 1397 N ILE A 91 0.347 6.512 -14.194 1.00 0.00 N ATOM 1398 CA ILE A 91 -0.274 6.904 -15.447 1.00 0.00 C ATOM 1399 C ILE A 91 -1.692 7.411 -15.173 1.00 0.00 C ATOM 1400 O ILE A 91 -2.092 8.454 -15.687 1.00 0.00 O ATOM 1401 CB ILE A 91 -0.216 5.756 -16.457 1.00 0.00 C ATOM 1402 CG1 ILE A 91 -0.495 6.257 -17.875 1.00 0.00 C ATOM 1403 CG2 ILE A 91 -1.162 4.623 -16.053 1.00 0.00 C ATOM 1404 CD1 ILE A 91 0.666 5.921 -18.813 1.00 0.00 C ATOM 0 H ILE A 91 0.342 5.509 -14.011 1.00 0.00 H new ATOM 0 HA ILE A 91 0.277 7.727 -15.903 1.00 0.00 H new ATOM 0 HB ILE A 91 0.795 5.349 -16.453 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -1.413 5.805 -18.250 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -0.654 7.335 -17.859 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -1.102 3.820 -16.787 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -0.875 4.241 -15.073 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -2.184 5.000 -16.011 1.00 0.00 H new ATOM 0 HD11 ILE A 91 0.442 6.288 -19.815 1.00 0.00 H new ATOM 0 HD12 ILE A 91 1.577 6.395 -18.448 1.00 0.00 H new ATOM 0 HD13 ILE A 91 0.807 4.841 -18.845 1.00 0.00 H new ATOM 1416 N LEU A 92 -2.411 6.648 -14.363 1.00 0.00 N ATOM 1417 CA LEU A 92 -3.776 7.007 -14.014 1.00 0.00 C ATOM 1418 C LEU A 92 -3.808 8.457 -13.526 1.00 0.00 C ATOM 1419 O LEU A 92 -4.838 9.123 -13.617 1.00 0.00 O ATOM 1420 CB LEU A 92 -4.352 6.007 -13.010 1.00 0.00 C ATOM 1421 CG LEU A 92 -5.342 6.575 -11.991 1.00 0.00 C ATOM 1422 CD1 LEU A 92 -6.274 5.481 -11.463 1.00 0.00 C ATOM 1423 CD2 LEU A 92 -4.610 7.299 -10.860 1.00 0.00 C ATOM 0 H LEU A 92 -2.075 5.784 -13.939 1.00 0.00 H new ATOM 0 HA LEU A 92 -4.421 6.951 -14.891 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -4.849 5.211 -13.564 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -3.525 5.550 -12.467 1.00 0.00 H new ATOM 0 HG LEU A 92 -5.965 7.313 -12.495 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -6.968 5.911 -10.741 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -6.835 5.050 -12.292 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -5.684 4.702 -10.980 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -5.337 7.693 -10.150 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -3.946 6.600 -10.350 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -4.024 8.120 -11.273 1.00 0.00 H new ATOM 1435 N ARG A 93 -2.669 8.903 -13.019 1.00 0.00 N ATOM 1436 CA ARG A 93 -2.554 10.261 -12.516 1.00 0.00 C ATOM 1437 C ARG A 93 -2.076 11.199 -13.627 1.00 0.00 C ATOM 1438 O ARG A 93 -2.646 12.271 -13.826 1.00 0.00 O ATOM 1439 CB ARG A 93 -1.576 10.333 -11.342 1.00 0.00 C ATOM 1440 CG ARG A 93 -2.317 10.252 -10.006 1.00 0.00 C ATOM 1441 CD ARG A 93 -2.612 11.650 -9.456 1.00 0.00 C ATOM 1442 NE ARG A 93 -4.066 11.919 -9.510 1.00 0.00 N ATOM 1443 CZ ARG A 93 -4.645 13.020 -9.014 1.00 0.00 C ATOM 1444 NH1 ARG A 93 -3.897 13.962 -8.423 1.00 0.00 N ATOM 1445 NH2 ARG A 93 -5.972 13.180 -9.107 1.00 0.00 N ATOM 0 H ARG A 93 -1.817 8.348 -12.946 1.00 0.00 H new ATOM 0 HA ARG A 93 -3.540 10.572 -12.172 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -0.856 9.517 -11.413 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -1.010 11.263 -11.392 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -3.250 9.704 -10.136 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -1.718 9.694 -9.287 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -2.257 11.728 -8.428 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -2.073 12.399 -10.036 1.00 0.00 H new ATOM 0 HE ARG A 93 -4.665 11.222 -9.953 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -2.887 13.840 -8.351 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -4.338 14.801 -8.045 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -6.542 12.463 -9.556 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -6.412 14.019 -8.729 1.00 0.00 H new ATOM 1459 N LEU A 94 -1.036 10.761 -14.321 1.00 0.00 N ATOM 1460 CA LEU A 94 -0.476 11.549 -15.406 1.00 0.00 C ATOM 1461 C LEU A 94 -1.503 11.658 -16.534 1.00 0.00 C ATOM 1462 O LEU A 94 -1.332 12.450 -17.460 1.00 0.00 O ATOM 1463 CB LEU A 94 0.867 10.967 -15.851 1.00 0.00 C ATOM 1464 CG LEU A 94 2.044 11.945 -15.884 1.00 0.00 C ATOM 1465 CD1 LEU A 94 3.030 11.654 -14.751 1.00 0.00 C ATOM 1466 CD2 LEU A 94 2.725 11.938 -17.254 1.00 0.00 C ATOM 0 H LEU A 94 -0.567 9.871 -14.153 1.00 0.00 H new ATOM 0 HA LEU A 94 -0.263 12.564 -15.070 1.00 0.00 H new ATOM 0 HB2 LEU A 94 1.123 10.144 -15.184 1.00 0.00 H new ATOM 0 HB3 LEU A 94 0.744 10.543 -16.848 1.00 0.00 H new ATOM 0 HG LEU A 94 1.657 12.951 -15.723 1.00 0.00 H new ATOM 0 HD11 LEU A 94 3.857 12.363 -14.797 1.00 0.00 H new ATOM 0 HD12 LEU A 94 2.521 11.752 -13.792 1.00 0.00 H new ATOM 0 HD13 LEU A 94 3.415 10.640 -14.856 1.00 0.00 H new ATOM 0 HD21 LEU A 94 3.558 12.641 -17.250 1.00 0.00 H new ATOM 0 HD22 LEU A 94 3.097 10.937 -17.470 1.00 0.00 H new ATOM 0 HD23 LEU A 94 2.006 12.231 -18.019 1.00 0.00 H new ATOM 1478 N VAL A 95 -2.548 10.851 -16.421 1.00 0.00 N ATOM 1479 CA VAL A 95 -3.602 10.846 -17.420 1.00 0.00 C ATOM 1480 C VAL A 95 -4.084 12.280 -17.653 1.00 0.00 C ATOM 1481 O VAL A 95 -4.394 12.659 -18.781 1.00 0.00 O ATOM 1482 CB VAL A 95 -4.726 9.901 -16.991 1.00 0.00 C ATOM 1483 CG1 VAL A 95 -6.075 10.365 -17.544 1.00 0.00 C ATOM 1484 CG2 VAL A 95 -4.425 8.463 -17.418 1.00 0.00 C ATOM 0 H VAL A 95 -2.687 10.196 -15.652 1.00 0.00 H new ATOM 0 HA VAL A 95 -3.225 10.470 -18.371 1.00 0.00 H new ATOM 0 HB VAL A 95 -4.785 9.923 -15.903 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -6.856 9.675 -17.224 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -6.297 11.364 -17.170 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -6.034 10.386 -18.633 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -5.239 7.811 -17.101 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -4.326 8.419 -18.503 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -3.495 8.133 -16.955 1.00 0.00 H new ATOM 1494 N LEU A 96 -4.132 13.038 -16.567 1.00 0.00 N ATOM 1495 CA LEU A 96 -4.570 14.421 -16.639 1.00 0.00 C ATOM 1496 C LEU A 96 -3.350 15.331 -16.793 1.00 0.00 C ATOM 1497 O LEU A 96 -3.473 16.470 -17.243 1.00 0.00 O ATOM 1498 CB LEU A 96 -5.448 14.768 -15.435 1.00 0.00 C ATOM 1499 CG LEU A 96 -4.951 14.269 -14.077 1.00 0.00 C ATOM 1500 CD1 LEU A 96 -5.110 15.349 -13.004 1.00 0.00 C ATOM 1501 CD2 LEU A 96 -5.647 12.965 -13.683 1.00 0.00 C ATOM 0 H LEU A 96 -3.875 12.720 -15.633 1.00 0.00 H new ATOM 0 HA LEU A 96 -5.197 14.577 -17.517 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -5.551 15.852 -15.386 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -6.444 14.360 -15.607 1.00 0.00 H new ATOM 0 HG LEU A 96 -3.886 14.053 -14.162 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -4.749 14.968 -12.048 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -4.532 16.229 -13.285 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -6.162 15.619 -12.913 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -5.275 12.633 -12.714 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -6.723 13.131 -13.622 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -5.440 12.201 -14.433 1.00 0.00 H new ATOM 1513 N LEU A 97 -2.200 14.795 -16.411 1.00 0.00 N ATOM 1514 CA LEU A 97 -0.959 15.545 -16.501 1.00 0.00 C ATOM 1515 C LEU A 97 -1.224 17.007 -16.137 1.00 0.00 C ATOM 1516 O LEU A 97 -0.678 17.915 -16.764 1.00 0.00 O ATOM 1517 CB LEU A 97 -0.319 15.360 -17.878 1.00 0.00 C ATOM 1518 CG LEU A 97 1.194 15.576 -17.950 1.00 0.00 C ATOM 1519 CD1 LEU A 97 1.791 14.871 -19.169 1.00 0.00 C ATOM 1520 CD2 LEU A 97 1.536 17.067 -17.925 1.00 0.00 C ATOM 0 H LEU A 97 -2.102 13.851 -16.039 1.00 0.00 H new ATOM 0 HA LEU A 97 -0.232 15.165 -15.784 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -0.539 14.351 -18.226 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -0.798 16.048 -18.574 1.00 0.00 H new ATOM 0 HG LEU A 97 1.646 15.127 -17.066 1.00 0.00 H new ATOM 0 HD11 LEU A 97 2.867 15.041 -19.196 1.00 0.00 H new ATOM 0 HD12 LEU A 97 1.594 13.801 -19.103 1.00 0.00 H new ATOM 0 HD13 LEU A 97 1.338 15.268 -20.077 1.00 0.00 H new ATOM 0 HD21 LEU A 97 2.617 17.193 -17.977 1.00 0.00 H new ATOM 0 HD22 LEU A 97 1.071 17.561 -18.778 1.00 0.00 H new ATOM 0 HD23 LEU A 97 1.163 17.510 -17.002 1.00 0.00 H new ATOM 1532 N LEU A 98 -2.061 17.191 -15.127 1.00 0.00 N ATOM 1533 CA LEU A 98 -2.405 18.527 -14.673 1.00 0.00 C ATOM 1534 C LEU A 98 -1.447 18.944 -13.555 1.00 0.00 C ATOM 1535 O LEU A 98 -1.192 20.131 -13.362 1.00 0.00 O ATOM 1536 CB LEU A 98 -3.881 18.595 -14.276 1.00 0.00 C ATOM 1537 CG LEU A 98 -4.886 18.606 -15.429 1.00 0.00 C ATOM 1538 CD1 LEU A 98 -6.320 18.712 -14.905 1.00 0.00 C ATOM 1539 CD2 LEU A 98 -4.559 19.714 -16.432 1.00 0.00 C ATOM 0 H LEU A 98 -2.511 16.436 -14.610 1.00 0.00 H new ATOM 0 HA LEU A 98 -2.283 19.247 -15.482 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -4.104 17.742 -13.634 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -4.035 19.493 -13.678 1.00 0.00 H new ATOM 0 HG LEU A 98 -4.806 17.658 -15.960 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -7.015 18.718 -15.745 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -6.536 17.859 -14.261 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -6.432 19.634 -14.335 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -5.289 19.699 -17.241 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -4.593 20.681 -15.930 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -3.561 19.552 -16.840 1.00 0.00 H new ATOM 1551 N LEU A 99 -0.942 17.943 -12.848 1.00 0.00 N ATOM 1552 CA LEU A 99 -0.018 18.191 -11.755 1.00 0.00 C ATOM 1553 C LEU A 99 1.177 18.992 -12.274 1.00 0.00 C ATOM 1554 O LEU A 99 1.573 19.986 -11.667 1.00 0.00 O ATOM 1555 CB LEU A 99 0.372 16.876 -11.075 1.00 0.00 C ATOM 1556 CG LEU A 99 1.837 16.459 -11.212 1.00 0.00 C ATOM 1557 CD1 LEU A 99 2.748 17.380 -10.397 1.00 0.00 C ATOM 1558 CD2 LEU A 99 2.026 14.988 -10.838 1.00 0.00 C ATOM 0 H LEU A 99 -1.156 16.959 -13.011 1.00 0.00 H new ATOM 0 HA LEU A 99 -0.495 18.794 -10.983 1.00 0.00 H new ATOM 0 HB2 LEU A 99 0.135 16.954 -10.014 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -0.251 16.080 -11.483 1.00 0.00 H new ATOM 0 HG LEU A 99 2.126 16.564 -12.258 1.00 0.00 H new ATOM 0 HD11 LEU A 99 3.784 17.061 -10.512 1.00 0.00 H new ATOM 0 HD12 LEU A 99 2.642 18.405 -10.753 1.00 0.00 H new ATOM 0 HD13 LEU A 99 2.468 17.331 -9.345 1.00 0.00 H new ATOM 0 HD21 LEU A 99 3.077 14.718 -10.944 1.00 0.00 H new ATOM 0 HD22 LEU A 99 1.714 14.832 -9.805 1.00 0.00 H new ATOM 0 HD23 LEU A 99 1.422 14.364 -11.498 1.00 0.00 H new TER 1570 LEU A 99