USER MOD reduce.3.24.130724 H: found=0, std=0, add=573, rem=0, adj=9 USER MOD reduce.3.24.130724 removed 576 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 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 8 MET CE :methyl -109:sc= -0.264 (180deg=-2.33!) USER MOD Single : A 9 LYS NZ :NH3+ -165:sc= 0.597 (180deg=-0.323!) USER MOD Single : A 11 THR OG1 : rot 180:sc= -0.0491 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00683) USER MOD Single : A 42 THR OG1 : rot -33:sc= 0.409 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ -131:sc= -1.92! (180deg=-5.11!) USER MOD Single : A 48 ASN : amide:sc= 1.24 K(o=1.2,f=0.035) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 4 7.954 19.689 6.690 1.00 0.00 N ATOM 2 CA MET A 4 7.967 18.211 6.766 1.00 0.00 C ATOM 3 C MET A 4 9.198 17.660 6.064 1.00 0.00 C ATOM 4 O MET A 4 9.980 18.420 5.492 1.00 0.00 O ATOM 5 CB MET A 4 6.707 17.623 6.122 1.00 0.00 C ATOM 6 CG MET A 4 5.410 18.070 6.772 1.00 0.00 C ATOM 7 SD MET A 4 5.333 17.655 8.523 1.00 0.00 S ATOM 8 CE MET A 4 3.713 18.288 8.936 1.00 0.00 C ATOM 0 HA MET A 4 7.991 17.926 7.818 1.00 0.00 H new ATOM 0 HB2 MET A 4 6.687 17.901 5.068 1.00 0.00 H new ATOM 0 HB3 MET A 4 6.765 16.535 6.163 1.00 0.00 H new ATOM 0 HG2 MET A 4 5.301 19.148 6.653 1.00 0.00 H new ATOM 0 HG3 MET A 4 4.570 17.606 6.255 1.00 0.00 H new ATOM 0 HE1 MET A 4 3.511 18.109 9.992 1.00 0.00 H new ATOM 0 HE2 MET A 4 3.679 19.359 8.737 1.00 0.00 H new ATOM 0 HE3 MET A 4 2.960 17.783 8.331 1.00 0.00 H new ATOM 20 N VAL A 5 9.370 16.346 6.109 1.00 0.00 N ATOM 21 CA VAL A 5 10.492 15.703 5.443 1.00 0.00 C ATOM 22 C VAL A 5 10.052 15.148 4.095 1.00 0.00 C ATOM 23 O VAL A 5 9.062 14.420 4.006 1.00 0.00 O ATOM 24 CB VAL A 5 11.083 14.553 6.291 1.00 0.00 C ATOM 25 CG1 VAL A 5 12.319 13.967 5.626 1.00 0.00 C ATOM 26 CG2 VAL A 5 11.405 15.030 7.699 1.00 0.00 C ATOM 0 H VAL A 5 8.746 15.705 6.600 1.00 0.00 H new ATOM 0 HA VAL A 5 11.263 16.461 5.305 1.00 0.00 H new ATOM 0 HB VAL A 5 10.332 13.767 6.361 1.00 0.00 H new ATOM 0 HG11 VAL A 5 12.716 13.160 6.242 1.00 0.00 H new ATOM 0 HG12 VAL A 5 12.053 13.576 4.644 1.00 0.00 H new ATOM 0 HG13 VAL A 5 13.075 14.744 5.515 1.00 0.00 H new ATOM 0 HG21 VAL A 5 11.819 14.204 8.277 1.00 0.00 H new ATOM 0 HG22 VAL A 5 12.132 15.840 7.651 1.00 0.00 H new ATOM 0 HG23 VAL A 5 10.494 15.388 8.179 1.00 0.00 H new ATOM 36 N ILE A 6 10.779 15.507 3.049 1.00 0.00 N ATOM 37 CA ILE A 6 10.473 15.026 1.713 1.00 0.00 C ATOM 38 C ILE A 6 11.075 13.639 1.496 1.00 0.00 C ATOM 39 O ILE A 6 12.286 13.445 1.628 1.00 0.00 O ATOM 40 CB ILE A 6 10.999 15.998 0.637 1.00 0.00 C ATOM 41 CG1 ILE A 6 10.425 17.400 0.866 1.00 0.00 C ATOM 42 CG2 ILE A 6 10.639 15.495 -0.754 1.00 0.00 C ATOM 43 CD1 ILE A 6 10.938 18.431 -0.114 1.00 0.00 C ATOM 0 H ILE A 6 11.585 16.130 3.100 1.00 0.00 H new ATOM 0 HA ILE A 6 9.389 14.965 1.621 1.00 0.00 H new ATOM 0 HB ILE A 6 12.085 16.050 0.713 1.00 0.00 H new ATOM 0 HG12 ILE A 6 9.338 17.354 0.797 1.00 0.00 H new ATOM 0 HG13 ILE A 6 10.667 17.722 1.879 1.00 0.00 H new ATOM 0 HG21 ILE A 6 11.017 16.192 -1.502 1.00 0.00 H new ATOM 0 HG22 ILE A 6 11.086 14.514 -0.913 1.00 0.00 H new ATOM 0 HG23 ILE A 6 9.555 15.419 -0.844 1.00 0.00 H new ATOM 0 HD11 ILE A 6 10.489 19.399 0.108 1.00 0.00 H new ATOM 0 HD12 ILE A 6 12.022 18.505 -0.030 1.00 0.00 H new ATOM 0 HD13 ILE A 6 10.673 18.133 -1.128 1.00 0.00 H new ATOM 55 N GLY A 7 10.220 12.679 1.172 1.00 0.00 N ATOM 56 CA GLY A 7 10.667 11.313 0.988 1.00 0.00 C ATOM 57 C GLY A 7 10.130 10.397 2.068 1.00 0.00 C ATOM 58 O GLY A 7 10.395 10.605 3.254 1.00 0.00 O ATOM 0 H GLY A 7 9.220 12.823 1.033 1.00 0.00 H new ATOM 0 HA2 GLY A 7 10.343 10.953 0.011 1.00 0.00 H new ATOM 0 HA3 GLY A 7 11.757 11.283 0.994 1.00 0.00 H new ATOM 62 N MET A 8 9.379 9.385 1.663 1.00 0.00 N ATOM 63 CA MET A 8 8.727 8.499 2.614 1.00 0.00 C ATOM 64 C MET A 8 9.299 7.085 2.540 1.00 0.00 C ATOM 65 O MET A 8 9.509 6.533 1.455 1.00 0.00 O ATOM 66 CB MET A 8 7.209 8.473 2.382 1.00 0.00 C ATOM 67 CG MET A 8 6.794 7.920 1.029 1.00 0.00 C ATOM 68 SD MET A 8 5.017 8.025 0.756 1.00 0.00 S ATOM 69 CE MET A 8 4.871 7.147 -0.794 1.00 0.00 C ATOM 0 H MET A 8 9.206 9.157 0.684 1.00 0.00 H new ATOM 0 HA MET A 8 8.921 8.889 3.613 1.00 0.00 H new ATOM 0 HB2 MET A 8 6.744 7.874 3.165 1.00 0.00 H new ATOM 0 HB3 MET A 8 6.820 9.486 2.482 1.00 0.00 H new ATOM 0 HG2 MET A 8 7.312 8.468 0.242 1.00 0.00 H new ATOM 0 HG3 MET A 8 7.109 6.879 0.953 1.00 0.00 H new ATOM 0 HE1 MET A 8 4.634 7.852 -1.591 1.00 0.00 H new ATOM 0 HE2 MET A 8 5.813 6.648 -1.019 1.00 0.00 H new ATOM 0 HE3 MET A 8 4.076 6.405 -0.718 1.00 0.00 H new ATOM 79 N LYS A 9 9.566 6.528 3.707 1.00 0.00 N ATOM 80 CA LYS A 9 10.042 5.163 3.840 1.00 0.00 C ATOM 81 C LYS A 9 8.915 4.295 4.384 1.00 0.00 C ATOM 82 O LYS A 9 8.327 4.624 5.411 1.00 0.00 O ATOM 83 CB LYS A 9 11.216 5.135 4.820 1.00 0.00 C ATOM 84 CG LYS A 9 12.121 3.925 4.680 1.00 0.00 C ATOM 85 CD LYS A 9 13.254 4.191 3.701 1.00 0.00 C ATOM 86 CE LYS A 9 14.135 5.343 4.175 1.00 0.00 C ATOM 87 NZ LYS A 9 15.321 5.555 3.302 1.00 0.00 N ATOM 0 H LYS A 9 9.458 7.014 4.597 1.00 0.00 H new ATOM 0 HA LYS A 9 10.364 4.786 2.869 1.00 0.00 H new ATOM 0 HB2 LYS A 9 11.812 6.037 4.680 1.00 0.00 H new ATOM 0 HB3 LYS A 9 10.825 5.165 5.837 1.00 0.00 H new ATOM 0 HG2 LYS A 9 12.534 3.663 5.654 1.00 0.00 H new ATOM 0 HG3 LYS A 9 11.537 3.069 4.340 1.00 0.00 H new ATOM 0 HD2 LYS A 9 13.858 3.291 3.587 1.00 0.00 H new ATOM 0 HD3 LYS A 9 12.842 4.425 2.719 1.00 0.00 H new ATOM 0 HE2 LYS A 9 13.544 6.258 4.206 1.00 0.00 H new ATOM 0 HE3 LYS A 9 14.469 5.144 5.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 16.009 6.162 3.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 15.761 4.638 3.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 15.023 6.014 2.417 1.00 0.00 H new ATOM 101 N PHE A 10 8.597 3.201 3.708 1.00 0.00 N ATOM 102 CA PHE A 10 7.541 2.317 4.184 1.00 0.00 C ATOM 103 C PHE A 10 7.763 0.888 3.716 1.00 0.00 C ATOM 104 O PHE A 10 8.321 0.648 2.644 1.00 0.00 O ATOM 105 CB PHE A 10 6.158 2.826 3.743 1.00 0.00 C ATOM 106 CG PHE A 10 5.936 2.852 2.254 1.00 0.00 C ATOM 107 CD1 PHE A 10 6.349 3.935 1.496 1.00 0.00 C ATOM 108 CD2 PHE A 10 5.300 1.798 1.619 1.00 0.00 C ATOM 109 CE1 PHE A 10 6.132 3.965 0.132 1.00 0.00 C ATOM 110 CE2 PHE A 10 5.078 1.824 0.257 1.00 0.00 C ATOM 111 CZ PHE A 10 5.497 2.907 -0.489 1.00 0.00 C ATOM 0 H PHE A 10 9.046 2.906 2.841 1.00 0.00 H new ATOM 0 HA PHE A 10 7.574 2.320 5.273 1.00 0.00 H new ATOM 0 HB2 PHE A 10 5.393 2.197 4.198 1.00 0.00 H new ATOM 0 HB3 PHE A 10 6.016 3.833 4.134 1.00 0.00 H new ATOM 0 HD1 PHE A 10 6.846 4.765 1.976 1.00 0.00 H new ATOM 0 HD2 PHE A 10 4.974 0.946 2.197 1.00 0.00 H new ATOM 0 HE1 PHE A 10 6.459 4.815 -0.448 1.00 0.00 H new ATOM 0 HE2 PHE A 10 4.577 0.997 -0.225 1.00 0.00 H new ATOM 0 HZ PHE A 10 5.329 2.927 -1.556 1.00 0.00 H new ATOM 121 N THR A 11 7.347 -0.060 4.536 1.00 0.00 N ATOM 122 CA THR A 11 7.464 -1.458 4.183 1.00 0.00 C ATOM 123 C THR A 11 6.129 -1.959 3.644 1.00 0.00 C ATOM 124 O THR A 11 5.067 -1.537 4.113 1.00 0.00 O ATOM 125 CB THR A 11 7.920 -2.317 5.392 1.00 0.00 C ATOM 126 OG1 THR A 11 8.642 -3.465 4.930 1.00 0.00 O ATOM 127 CG2 THR A 11 6.742 -2.788 6.236 1.00 0.00 C ATOM 0 H THR A 11 6.926 0.115 5.449 1.00 0.00 H new ATOM 0 HA THR A 11 8.228 -1.555 3.411 1.00 0.00 H new ATOM 0 HB THR A 11 8.557 -1.687 6.012 1.00 0.00 H new ATOM 0 HG1 THR A 11 8.929 -4.002 5.698 1.00 0.00 H new ATOM 0 HG21 THR A 11 7.108 -3.386 7.071 1.00 0.00 H new ATOM 0 HG22 THR A 11 6.200 -1.923 6.619 1.00 0.00 H new ATOM 0 HG23 THR A 11 6.074 -3.393 5.623 1.00 0.00 H new ATOM 135 N VAL A 12 6.176 -2.820 2.647 1.00 0.00 N ATOM 136 CA VAL A 12 4.964 -3.411 2.122 1.00 0.00 C ATOM 137 C VAL A 12 5.004 -4.921 2.296 1.00 0.00 C ATOM 138 O VAL A 12 5.912 -5.602 1.812 1.00 0.00 O ATOM 139 CB VAL A 12 4.718 -3.027 0.641 1.00 0.00 C ATOM 140 CG1 VAL A 12 5.890 -3.420 -0.250 1.00 0.00 C ATOM 141 CG2 VAL A 12 3.424 -3.650 0.133 1.00 0.00 C ATOM 0 H VAL A 12 7.035 -3.124 2.188 1.00 0.00 H new ATOM 0 HA VAL A 12 4.125 -3.010 2.691 1.00 0.00 H new ATOM 0 HB VAL A 12 4.625 -1.942 0.596 1.00 0.00 H new ATOM 0 HG11 VAL A 12 5.677 -3.133 -1.280 1.00 0.00 H new ATOM 0 HG12 VAL A 12 6.792 -2.910 0.089 1.00 0.00 H new ATOM 0 HG13 VAL A 12 6.041 -4.498 -0.198 1.00 0.00 H new ATOM 0 HG21 VAL A 12 3.269 -3.369 -0.909 1.00 0.00 H new ATOM 0 HG22 VAL A 12 3.488 -4.735 0.210 1.00 0.00 H new ATOM 0 HG23 VAL A 12 2.588 -3.292 0.734 1.00 0.00 H new ATOM 151 N ILE A 13 4.046 -5.436 3.037 1.00 0.00 N ATOM 152 CA ILE A 13 3.934 -6.863 3.227 1.00 0.00 C ATOM 153 C ILE A 13 2.746 -7.378 2.420 1.00 0.00 C ATOM 154 O ILE A 13 1.601 -6.972 2.618 1.00 0.00 O ATOM 155 CB ILE A 13 3.843 -7.234 4.738 1.00 0.00 C ATOM 156 CG1 ILE A 13 3.975 -8.753 4.968 1.00 0.00 C ATOM 157 CG2 ILE A 13 2.567 -6.702 5.374 1.00 0.00 C ATOM 158 CD1 ILE A 13 2.737 -9.562 4.652 1.00 0.00 C ATOM 0 H ILE A 13 3.334 -4.886 3.517 1.00 0.00 H new ATOM 0 HA ILE A 13 4.836 -7.353 2.860 1.00 0.00 H new ATOM 0 HB ILE A 13 4.688 -6.750 5.228 1.00 0.00 H new ATOM 0 HG12 ILE A 13 4.799 -9.126 4.359 1.00 0.00 H new ATOM 0 HG13 ILE A 13 4.245 -8.924 6.010 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.541 -6.982 6.427 1.00 0.00 H new ATOM 0 HG22 ILE A 13 2.542 -5.616 5.286 1.00 0.00 H new ATOM 0 HG23 ILE A 13 1.702 -7.127 4.865 1.00 0.00 H new ATOM 0 HD11 ILE A 13 2.932 -10.617 4.846 1.00 0.00 H new ATOM 0 HD12 ILE A 13 1.912 -9.224 5.279 1.00 0.00 H new ATOM 0 HD13 ILE A 13 2.474 -9.429 3.603 1.00 0.00 H new ATOM 170 N THR A 14 3.043 -8.230 1.464 1.00 0.00 N ATOM 171 CA THR A 14 2.036 -8.768 0.576 1.00 0.00 C ATOM 172 C THR A 14 1.913 -10.272 0.808 1.00 0.00 C ATOM 173 O THR A 14 2.673 -10.840 1.590 1.00 0.00 O ATOM 174 CB THR A 14 2.422 -8.479 -0.892 1.00 0.00 C ATOM 175 OG1 THR A 14 3.080 -7.208 -0.971 1.00 0.00 O ATOM 176 CG2 THR A 14 1.201 -8.459 -1.803 1.00 0.00 C ATOM 0 H THR A 14 3.987 -8.569 1.280 1.00 0.00 H new ATOM 0 HA THR A 14 1.075 -8.295 0.780 1.00 0.00 H new ATOM 0 HB THR A 14 3.085 -9.277 -1.225 1.00 0.00 H new ATOM 0 HG1 THR A 14 3.327 -7.025 -1.902 1.00 0.00 H new ATOM 0 HG21 THR A 14 1.514 -8.253 -2.826 1.00 0.00 H new ATOM 0 HG22 THR A 14 0.702 -9.427 -1.764 1.00 0.00 H new ATOM 0 HG23 THR A 14 0.512 -7.683 -1.471 1.00 0.00 H new ATOM 184 N ASP A 15 0.961 -10.907 0.137 1.00 0.00 N ATOM 185 CA ASP A 15 0.755 -12.353 0.242 1.00 0.00 C ATOM 186 C ASP A 15 2.032 -13.130 -0.111 1.00 0.00 C ATOM 187 O ASP A 15 2.221 -14.267 0.321 1.00 0.00 O ATOM 188 CB ASP A 15 -0.390 -12.768 -0.689 1.00 0.00 C ATOM 189 CG ASP A 15 -0.757 -14.234 -0.570 1.00 0.00 C ATOM 190 OD1 ASP A 15 -1.453 -14.601 0.400 1.00 0.00 O ATOM 191 OD2 ASP A 15 -0.383 -15.018 -1.466 1.00 0.00 O ATOM 0 H ASP A 15 0.310 -10.440 -0.494 1.00 0.00 H new ATOM 0 HA ASP A 15 0.499 -12.592 1.274 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -1.268 -12.161 -0.467 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -0.107 -12.554 -1.720 1.00 0.00 H new ATOM 196 N ASP A 16 2.914 -12.497 -0.883 1.00 0.00 N ATOM 197 CA ASP A 16 4.169 -13.121 -1.307 1.00 0.00 C ATOM 198 C ASP A 16 5.281 -12.908 -0.274 1.00 0.00 C ATOM 199 O ASP A 16 6.322 -13.570 -0.317 1.00 0.00 O ATOM 200 CB ASP A 16 4.603 -12.551 -2.664 1.00 0.00 C ATOM 201 CG ASP A 16 5.935 -13.097 -3.139 1.00 0.00 C ATOM 202 OD1 ASP A 16 5.957 -14.203 -3.718 1.00 0.00 O ATOM 203 OD2 ASP A 16 6.969 -12.427 -2.936 1.00 0.00 O ATOM 0 H ASP A 16 2.782 -11.547 -1.230 1.00 0.00 H new ATOM 0 HA ASP A 16 3.996 -14.193 -1.398 1.00 0.00 H new ATOM 0 HB2 ASP A 16 3.839 -12.777 -3.408 1.00 0.00 H new ATOM 0 HB3 ASP A 16 4.667 -11.465 -2.592 1.00 0.00 H new ATOM 208 N GLY A 17 5.047 -12.020 0.679 1.00 0.00 N ATOM 209 CA GLY A 17 6.066 -11.714 1.661 1.00 0.00 C ATOM 210 C GLY A 17 6.231 -10.220 1.869 1.00 0.00 C ATOM 211 O GLY A 17 5.490 -9.423 1.295 1.00 0.00 O ATOM 0 H GLY A 17 4.173 -11.507 0.790 1.00 0.00 H new ATOM 0 HA2 GLY A 17 5.807 -12.185 2.609 1.00 0.00 H new ATOM 0 HA3 GLY A 17 7.016 -12.142 1.342 1.00 0.00 H new ATOM 215 N LYS A 18 7.214 -9.841 2.671 1.00 0.00 N ATOM 216 CA LYS A 18 7.420 -8.445 3.036 1.00 0.00 C ATOM 217 C LYS A 18 8.686 -7.889 2.383 1.00 0.00 C ATOM 218 O LYS A 18 9.706 -8.576 2.304 1.00 0.00 O ATOM 219 CB LYS A 18 7.528 -8.322 4.561 1.00 0.00 C ATOM 220 CG LYS A 18 7.738 -6.898 5.052 1.00 0.00 C ATOM 221 CD LYS A 18 8.153 -6.871 6.514 1.00 0.00 C ATOM 222 CE LYS A 18 7.027 -7.295 7.445 1.00 0.00 C ATOM 223 NZ LYS A 18 7.485 -7.365 8.858 1.00 0.00 N ATOM 0 H LYS A 18 7.887 -10.485 3.085 1.00 0.00 H new ATOM 0 HA LYS A 18 6.568 -7.866 2.679 1.00 0.00 H new ATOM 0 HB2 LYS A 18 6.620 -8.721 5.013 1.00 0.00 H new ATOM 0 HB3 LYS A 18 8.355 -8.941 4.908 1.00 0.00 H new ATOM 0 HG2 LYS A 18 8.503 -6.412 4.446 1.00 0.00 H new ATOM 0 HG3 LYS A 18 6.818 -6.328 4.923 1.00 0.00 H new ATOM 0 HD2 LYS A 18 9.008 -7.531 6.658 1.00 0.00 H new ATOM 0 HD3 LYS A 18 8.479 -5.865 6.778 1.00 0.00 H new ATOM 0 HE2 LYS A 18 6.201 -6.589 7.364 1.00 0.00 H new ATOM 0 HE3 LYS A 18 6.645 -8.268 7.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 6.693 -7.657 9.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 8.257 -8.057 8.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 7.826 -6.430 9.159 1.00 0.00 H new ATOM 237 N LYS A 19 8.611 -6.652 1.908 1.00 0.00 N ATOM 238 CA LYS A 19 9.779 -5.959 1.380 1.00 0.00 C ATOM 239 C LYS A 19 9.624 -4.456 1.601 1.00 0.00 C ATOM 240 O LYS A 19 8.545 -3.902 1.399 1.00 0.00 O ATOM 241 CB LYS A 19 9.976 -6.272 -0.108 1.00 0.00 C ATOM 242 CG LYS A 19 11.245 -5.672 -0.696 1.00 0.00 C ATOM 243 CD LYS A 19 11.514 -6.186 -2.104 1.00 0.00 C ATOM 244 CE LYS A 19 10.424 -5.775 -3.083 1.00 0.00 C ATOM 245 NZ LYS A 19 10.676 -6.309 -4.448 1.00 0.00 N ATOM 0 H LYS A 19 7.750 -6.106 1.878 1.00 0.00 H new ATOM 0 HA LYS A 19 10.665 -6.307 1.910 1.00 0.00 H new ATOM 0 HB2 LYS A 19 10.000 -7.353 -0.243 1.00 0.00 H new ATOM 0 HB3 LYS A 19 9.116 -5.900 -0.665 1.00 0.00 H new ATOM 0 HG2 LYS A 19 11.158 -4.586 -0.716 1.00 0.00 H new ATOM 0 HG3 LYS A 19 12.092 -5.912 -0.053 1.00 0.00 H new ATOM 0 HD2 LYS A 19 12.474 -5.805 -2.451 1.00 0.00 H new ATOM 0 HD3 LYS A 19 11.591 -7.273 -2.084 1.00 0.00 H new ATOM 0 HE2 LYS A 19 9.459 -6.135 -2.725 1.00 0.00 H new ATOM 0 HE3 LYS A 19 10.364 -4.687 -3.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 9.912 -6.007 -5.085 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 11.585 -5.946 -4.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 10.708 -7.348 -4.414 1.00 0.00 H new ATOM 259 N ILE A 20 10.692 -3.805 2.037 1.00 0.00 N ATOM 260 CA ILE A 20 10.642 -2.379 2.330 1.00 0.00 C ATOM 261 C ILE A 20 11.204 -1.576 1.158 1.00 0.00 C ATOM 262 O ILE A 20 12.218 -1.950 0.567 1.00 0.00 O ATOM 263 CB ILE A 20 11.399 -2.059 3.656 1.00 0.00 C ATOM 264 CG1 ILE A 20 11.195 -0.597 4.106 1.00 0.00 C ATOM 265 CG2 ILE A 20 12.884 -2.385 3.531 1.00 0.00 C ATOM 266 CD1 ILE A 20 12.132 0.408 3.462 1.00 0.00 C ATOM 0 H ILE A 20 11.601 -4.239 2.196 1.00 0.00 H new ATOM 0 HA ILE A 20 9.601 -2.088 2.469 1.00 0.00 H new ATOM 0 HB ILE A 20 10.969 -2.697 4.429 1.00 0.00 H new ATOM 0 HG12 ILE A 20 10.168 -0.305 3.888 1.00 0.00 H new ATOM 0 HG13 ILE A 20 11.318 -0.545 5.188 1.00 0.00 H new ATOM 0 HG21 ILE A 20 13.388 -2.153 4.469 1.00 0.00 H new ATOM 0 HG22 ILE A 20 13.006 -3.445 3.306 1.00 0.00 H new ATOM 0 HG23 ILE A 20 13.321 -1.791 2.728 1.00 0.00 H new ATOM 0 HD11 ILE A 20 11.911 1.406 3.841 1.00 0.00 H new ATOM 0 HD12 ILE A 20 13.163 0.149 3.701 1.00 0.00 H new ATOM 0 HD13 ILE A 20 11.995 0.392 2.381 1.00 0.00 H new ATOM 278 N LEU A 21 10.519 -0.497 0.804 1.00 0.00 N ATOM 279 CA LEU A 21 10.970 0.378 -0.267 1.00 0.00 C ATOM 280 C LEU A 21 10.763 1.836 0.126 1.00 0.00 C ATOM 281 O LEU A 21 10.130 2.128 1.143 1.00 0.00 O ATOM 282 CB LEU A 21 10.246 0.043 -1.582 1.00 0.00 C ATOM 283 CG LEU A 21 8.719 0.195 -1.578 1.00 0.00 C ATOM 284 CD1 LEU A 21 8.308 1.607 -1.967 1.00 0.00 C ATOM 285 CD2 LEU A 21 8.082 -0.815 -2.516 1.00 0.00 C ATOM 0 H LEU A 21 9.646 -0.207 1.245 1.00 0.00 H new ATOM 0 HA LEU A 21 12.036 0.218 -0.429 1.00 0.00 H new ATOM 0 HB2 LEU A 21 10.651 0.682 -2.367 1.00 0.00 H new ATOM 0 HB3 LEU A 21 10.486 -0.985 -1.852 1.00 0.00 H new ATOM 0 HG LEU A 21 8.366 0.005 -0.564 1.00 0.00 H new ATOM 0 HD11 LEU A 21 7.221 1.686 -1.956 1.00 0.00 H new ATOM 0 HD12 LEU A 21 8.731 2.318 -1.257 1.00 0.00 H new ATOM 0 HD13 LEU A 21 8.678 1.831 -2.968 1.00 0.00 H new ATOM 0 HD21 LEU A 21 6.999 -0.693 -2.501 1.00 0.00 H new ATOM 0 HD22 LEU A 21 8.451 -0.654 -3.529 1.00 0.00 H new ATOM 0 HD23 LEU A 21 8.338 -1.824 -2.193 1.00 0.00 H new ATOM 297 N GLU A 22 11.300 2.750 -0.662 1.00 0.00 N ATOM 298 CA GLU A 22 11.189 4.164 -0.353 1.00 0.00 C ATOM 299 C GLU A 22 10.909 4.985 -1.603 1.00 0.00 C ATOM 300 O GLU A 22 11.292 4.604 -2.709 1.00 0.00 O ATOM 301 CB GLU A 22 12.462 4.653 0.337 1.00 0.00 C ATOM 302 CG GLU A 22 13.736 4.379 -0.446 1.00 0.00 C ATOM 303 CD GLU A 22 14.976 4.756 0.330 1.00 0.00 C ATOM 304 OE1 GLU A 22 15.184 5.961 0.580 1.00 0.00 O ATOM 305 OE2 GLU A 22 15.746 3.851 0.712 1.00 0.00 O ATOM 0 H GLU A 22 11.815 2.540 -1.517 1.00 0.00 H new ATOM 0 HA GLU A 22 10.346 4.297 0.325 1.00 0.00 H new ATOM 0 HB2 GLU A 22 12.379 5.726 0.511 1.00 0.00 H new ATOM 0 HB3 GLU A 22 12.539 4.176 1.314 1.00 0.00 H new ATOM 0 HG2 GLU A 22 13.780 3.321 -0.706 1.00 0.00 H new ATOM 0 HG3 GLU A 22 13.712 4.937 -1.382 1.00 0.00 H new ATOM 312 N SER A 23 10.212 6.097 -1.419 1.00 0.00 N ATOM 313 CA SER A 23 9.910 7.006 -2.512 1.00 0.00 C ATOM 314 C SER A 23 10.147 8.447 -2.076 1.00 0.00 C ATOM 315 O SER A 23 9.720 8.851 -0.993 1.00 0.00 O ATOM 316 CB SER A 23 8.465 6.818 -2.977 1.00 0.00 C ATOM 317 OG SER A 23 8.234 5.474 -3.363 1.00 0.00 O ATOM 0 H SER A 23 9.843 6.392 -0.515 1.00 0.00 H new ATOM 0 HA SER A 23 10.572 6.781 -3.348 1.00 0.00 H new ATOM 0 HB2 SER A 23 7.781 7.094 -2.175 1.00 0.00 H new ATOM 0 HB3 SER A 23 8.258 7.483 -3.815 1.00 0.00 H new ATOM 0 HG SER A 23 7.304 5.373 -3.656 1.00 0.00 H new ATOM 323 N GLY A 24 10.825 9.216 -2.919 1.00 0.00 N ATOM 324 CA GLY A 24 11.159 10.591 -2.586 1.00 0.00 C ATOM 325 C GLY A 24 9.969 11.534 -2.666 1.00 0.00 C ATOM 326 O GLY A 24 10.116 12.742 -2.480 1.00 0.00 O ATOM 0 H GLY A 24 11.153 8.910 -3.835 1.00 0.00 H new ATOM 0 HA2 GLY A 24 11.573 10.623 -1.578 1.00 0.00 H new ATOM 0 HA3 GLY A 24 11.939 10.942 -3.262 1.00 0.00 H new ATOM 330 N ALA A 25 8.796 10.987 -2.937 1.00 0.00 N ATOM 331 CA ALA A 25 7.582 11.781 -3.008 1.00 0.00 C ATOM 332 C ALA A 25 6.446 11.086 -2.269 1.00 0.00 C ATOM 333 O ALA A 25 6.180 9.906 -2.502 1.00 0.00 O ATOM 334 CB ALA A 25 7.200 12.027 -4.459 1.00 0.00 C ATOM 0 H ALA A 25 8.659 9.992 -3.112 1.00 0.00 H new ATOM 0 HA ALA A 25 7.766 12.742 -2.528 1.00 0.00 H new ATOM 0 HB1 ALA A 25 6.288 12.623 -4.499 1.00 0.00 H new ATOM 0 HB2 ALA A 25 8.006 12.562 -4.962 1.00 0.00 H new ATOM 0 HB3 ALA A 25 7.032 11.073 -4.958 1.00 0.00 H new ATOM 340 N PRO A 26 5.780 11.800 -1.350 1.00 0.00 N ATOM 341 CA PRO A 26 4.615 11.276 -0.628 1.00 0.00 C ATOM 342 C PRO A 26 3.450 11.025 -1.580 1.00 0.00 C ATOM 343 O PRO A 26 3.075 11.909 -2.352 1.00 0.00 O ATOM 344 CB PRO A 26 4.271 12.388 0.374 1.00 0.00 C ATOM 345 CG PRO A 26 5.476 13.267 0.420 1.00 0.00 C ATOM 346 CD PRO A 26 6.102 13.174 -0.940 1.00 0.00 C ATOM 0 HA PRO A 26 4.817 10.320 -0.144 1.00 0.00 H new ATOM 0 HB2 PRO A 26 3.390 12.945 0.055 1.00 0.00 H new ATOM 0 HB3 PRO A 26 4.048 11.975 1.358 1.00 0.00 H new ATOM 0 HG2 PRO A 26 5.201 14.295 0.654 1.00 0.00 H new ATOM 0 HG3 PRO A 26 6.170 12.938 1.193 1.00 0.00 H new ATOM 0 HD2 PRO A 26 5.686 13.910 -1.628 1.00 0.00 H new ATOM 0 HD3 PRO A 26 7.178 13.344 -0.903 1.00 0.00 H new ATOM 354 N ARG A 27 2.878 9.833 -1.530 1.00 0.00 N ATOM 355 CA ARG A 27 1.898 9.436 -2.528 1.00 0.00 C ATOM 356 C ARG A 27 0.676 8.788 -1.882 1.00 0.00 C ATOM 357 O ARG A 27 0.667 8.516 -0.682 1.00 0.00 O ATOM 358 CB ARG A 27 2.544 8.476 -3.532 1.00 0.00 C ATOM 359 CG ARG A 27 2.103 8.696 -4.973 1.00 0.00 C ATOM 360 CD ARG A 27 2.729 9.948 -5.585 1.00 0.00 C ATOM 361 NE ARG A 27 2.375 11.167 -4.858 1.00 0.00 N ATOM 362 CZ ARG A 27 1.703 12.189 -5.383 1.00 0.00 C ATOM 363 NH1 ARG A 27 1.309 12.156 -6.652 1.00 0.00 N ATOM 364 NH2 ARG A 27 1.425 13.244 -4.628 1.00 0.00 N ATOM 0 H ARG A 27 3.072 9.130 -0.817 1.00 0.00 H new ATOM 0 HA ARG A 27 1.559 10.331 -3.050 1.00 0.00 H new ATOM 0 HB2 ARG A 27 3.627 8.582 -3.474 1.00 0.00 H new ATOM 0 HB3 ARG A 27 2.308 7.452 -3.243 1.00 0.00 H new ATOM 0 HG2 ARG A 27 2.376 7.826 -5.571 1.00 0.00 H new ATOM 0 HG3 ARG A 27 1.017 8.780 -5.010 1.00 0.00 H new ATOM 0 HD2 ARG A 27 3.813 9.839 -5.597 1.00 0.00 H new ATOM 0 HD3 ARG A 27 2.406 10.041 -6.622 1.00 0.00 H new ATOM 0 HE ARG A 27 2.663 11.239 -3.882 1.00 0.00 H new ATOM 0 HH11 ARG A 27 1.521 11.343 -7.231 1.00 0.00 H new ATOM 0 HH12 ARG A 27 0.794 12.943 -7.047 1.00 0.00 H new ATOM 0 HH21 ARG A 27 1.726 13.267 -3.654 1.00 0.00 H new ATOM 0 HH22 ARG A 27 0.911 14.032 -5.022 1.00 0.00 H new ATOM 378 N ARG A 28 -0.352 8.551 -2.691 1.00 0.00 N ATOM 379 CA ARG A 28 -1.584 7.928 -2.224 1.00 0.00 C ATOM 380 C ARG A 28 -1.628 6.469 -2.678 1.00 0.00 C ATOM 381 O ARG A 28 -0.908 6.082 -3.602 1.00 0.00 O ATOM 382 CB ARG A 28 -2.789 8.695 -2.780 1.00 0.00 C ATOM 383 CG ARG A 28 -4.103 8.389 -2.082 1.00 0.00 C ATOM 384 CD ARG A 28 -5.205 9.341 -2.524 1.00 0.00 C ATOM 385 NE ARG A 28 -5.731 9.024 -3.852 1.00 0.00 N ATOM 386 CZ ARG A 28 -5.389 9.665 -4.971 1.00 0.00 C ATOM 387 NH1 ARG A 28 -4.494 10.648 -4.943 1.00 0.00 N ATOM 388 NH2 ARG A 28 -5.966 9.329 -6.118 1.00 0.00 N ATOM 0 H ARG A 28 -0.354 8.784 -3.684 1.00 0.00 H new ATOM 0 HA ARG A 28 -1.618 7.958 -1.135 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -2.591 9.764 -2.703 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -2.893 8.466 -3.841 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -4.400 7.362 -2.297 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -3.969 8.463 -1.003 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -6.018 9.309 -1.799 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -4.819 10.360 -2.525 1.00 0.00 H new ATOM 0 HE ARG A 28 -6.404 8.262 -3.927 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -4.061 10.919 -4.060 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -4.240 11.131 -5.805 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -6.665 8.586 -6.139 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -5.711 9.814 -6.978 1.00 0.00 H new ATOM 402 N ILE A 29 -2.461 5.666 -2.022 1.00 0.00 N ATOM 403 CA ILE A 29 -2.608 4.251 -2.367 1.00 0.00 C ATOM 404 C ILE A 29 -2.999 4.074 -3.833 1.00 0.00 C ATOM 405 O ILE A 29 -2.397 3.270 -4.546 1.00 0.00 O ATOM 406 CB ILE A 29 -3.657 3.559 -1.464 1.00 0.00 C ATOM 407 CG1 ILE A 29 -3.177 3.537 -0.010 1.00 0.00 C ATOM 408 CG2 ILE A 29 -3.948 2.145 -1.948 1.00 0.00 C ATOM 409 CD1 ILE A 29 -1.882 2.779 0.196 1.00 0.00 C ATOM 0 H ILE A 29 -3.048 5.971 -1.245 1.00 0.00 H new ATOM 0 HA ILE A 29 -1.638 3.781 -2.203 1.00 0.00 H new ATOM 0 HB ILE A 29 -4.582 4.132 -1.520 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -3.045 4.563 0.335 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -3.952 3.089 0.612 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -4.688 1.682 -1.295 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -4.334 2.181 -2.967 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -3.030 1.558 -1.929 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -1.607 2.808 1.250 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -2.013 1.743 -0.116 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -1.092 3.240 -0.398 1.00 0.00 H new ATOM 421 N LYS A 30 -3.993 4.839 -4.275 1.00 0.00 N ATOM 422 CA LYS A 30 -4.477 4.769 -5.656 1.00 0.00 C ATOM 423 C LYS A 30 -3.345 4.996 -6.653 1.00 0.00 C ATOM 424 O LYS A 30 -3.292 4.351 -7.698 1.00 0.00 O ATOM 425 CB LYS A 30 -5.579 5.811 -5.874 1.00 0.00 C ATOM 426 CG LYS A 30 -6.192 5.805 -7.269 1.00 0.00 C ATOM 427 CD LYS A 30 -6.969 4.526 -7.542 1.00 0.00 C ATOM 428 CE LYS A 30 -7.743 4.616 -8.850 1.00 0.00 C ATOM 429 NZ LYS A 30 -6.847 4.715 -10.031 1.00 0.00 N ATOM 0 H LYS A 30 -4.484 5.520 -3.695 1.00 0.00 H new ATOM 0 HA LYS A 30 -4.880 3.770 -5.823 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -6.370 5.642 -5.143 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -5.169 6.801 -5.676 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -6.855 6.663 -7.378 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -5.403 5.916 -8.013 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -6.281 3.682 -7.582 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -7.660 4.336 -6.721 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -8.380 3.738 -8.953 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -8.400 5.485 -8.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -7.419 4.740 -10.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -6.280 5.584 -9.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -6.214 3.890 -10.057 1.00 0.00 H new ATOM 443 N ASP A 31 -2.443 5.904 -6.315 1.00 0.00 N ATOM 444 CA ASP A 31 -1.326 6.240 -7.187 1.00 0.00 C ATOM 445 C ASP A 31 -0.334 5.090 -7.270 1.00 0.00 C ATOM 446 O ASP A 31 -0.057 4.576 -8.353 1.00 0.00 O ATOM 447 CB ASP A 31 -0.619 7.501 -6.685 1.00 0.00 C ATOM 448 CG ASP A 31 -1.464 8.745 -6.839 1.00 0.00 C ATOM 449 OD1 ASP A 31 -2.469 8.879 -6.119 1.00 0.00 O ATOM 450 OD2 ASP A 31 -1.131 9.590 -7.698 1.00 0.00 O ATOM 0 H ASP A 31 -2.462 6.425 -5.438 1.00 0.00 H new ATOM 0 HA ASP A 31 -1.723 6.426 -8.185 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -0.358 7.372 -5.635 1.00 0.00 H new ATOM 0 HB3 ASP A 31 0.315 7.631 -7.232 1.00 0.00 H new ATOM 455 N VAL A 32 0.183 4.676 -6.122 1.00 0.00 N ATOM 456 CA VAL A 32 1.193 3.623 -6.073 1.00 0.00 C ATOM 457 C VAL A 32 0.644 2.316 -6.642 1.00 0.00 C ATOM 458 O VAL A 32 1.273 1.681 -7.488 1.00 0.00 O ATOM 459 CB VAL A 32 1.691 3.393 -4.632 1.00 0.00 C ATOM 460 CG1 VAL A 32 2.735 2.284 -4.587 1.00 0.00 C ATOM 461 CG2 VAL A 32 2.253 4.684 -4.054 1.00 0.00 C ATOM 0 H VAL A 32 -0.079 5.052 -5.211 1.00 0.00 H new ATOM 0 HA VAL A 32 2.034 3.951 -6.684 1.00 0.00 H new ATOM 0 HB VAL A 32 0.843 3.080 -4.023 1.00 0.00 H new ATOM 0 HG11 VAL A 32 3.070 2.141 -3.560 1.00 0.00 H new ATOM 0 HG12 VAL A 32 2.297 1.357 -4.958 1.00 0.00 H new ATOM 0 HG13 VAL A 32 3.585 2.559 -5.211 1.00 0.00 H new ATOM 0 HG21 VAL A 32 2.601 4.506 -3.036 1.00 0.00 H new ATOM 0 HG22 VAL A 32 3.087 5.025 -4.668 1.00 0.00 H new ATOM 0 HG23 VAL A 32 1.475 5.447 -4.043 1.00 0.00 H new ATOM 471 N LEU A 33 -0.546 1.938 -6.198 1.00 0.00 N ATOM 472 CA LEU A 33 -1.165 0.697 -6.635 1.00 0.00 C ATOM 473 C LEU A 33 -1.545 0.788 -8.111 1.00 0.00 C ATOM 474 O LEU A 33 -1.446 -0.192 -8.854 1.00 0.00 O ATOM 475 CB LEU A 33 -2.408 0.406 -5.791 1.00 0.00 C ATOM 476 CG LEU A 33 -2.963 -1.014 -5.898 1.00 0.00 C ATOM 477 CD1 LEU A 33 -1.980 -2.011 -5.305 1.00 0.00 C ATOM 478 CD2 LEU A 33 -4.310 -1.113 -5.199 1.00 0.00 C ATOM 0 H LEU A 33 -1.103 2.475 -5.533 1.00 0.00 H new ATOM 0 HA LEU A 33 -0.450 -0.116 -6.506 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -2.170 0.606 -4.746 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -3.192 1.106 -6.079 1.00 0.00 H new ATOM 0 HG LEU A 33 -3.105 -1.253 -6.952 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -2.389 -3.018 -5.388 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -1.036 -1.957 -5.846 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -1.810 -1.774 -4.255 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -4.691 -2.131 -5.285 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -4.193 -0.857 -4.146 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -5.013 -0.422 -5.664 1.00 0.00 H new ATOM 490 N GLY A 34 -1.965 1.980 -8.526 1.00 0.00 N ATOM 491 CA GLY A 34 -2.367 2.200 -9.898 1.00 0.00 C ATOM 492 C GLY A 34 -1.197 2.161 -10.862 1.00 0.00 C ATOM 493 O GLY A 34 -1.281 1.539 -11.921 1.00 0.00 O ATOM 0 H GLY A 34 -2.033 2.803 -7.927 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -3.095 1.442 -10.185 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -2.865 3.166 -9.976 1.00 0.00 H new ATOM 497 N GLU A 35 -0.101 2.813 -10.491 1.00 0.00 N ATOM 498 CA GLU A 35 1.096 2.847 -11.325 1.00 0.00 C ATOM 499 C GLU A 35 1.768 1.475 -11.394 1.00 0.00 C ATOM 500 O GLU A 35 2.522 1.190 -12.324 1.00 0.00 O ATOM 501 CB GLU A 35 2.083 3.898 -10.813 1.00 0.00 C ATOM 502 CG GLU A 35 1.960 5.252 -11.506 1.00 0.00 C ATOM 503 CD GLU A 35 0.590 5.890 -11.362 1.00 0.00 C ATOM 504 OE1 GLU A 35 -0.299 5.596 -12.192 1.00 0.00 O ATOM 505 OE2 GLU A 35 0.406 6.711 -10.440 1.00 0.00 O ATOM 0 H GLU A 35 -0.016 3.327 -9.614 1.00 0.00 H new ATOM 0 HA GLU A 35 0.786 3.121 -12.334 1.00 0.00 H new ATOM 0 HB2 GLU A 35 1.931 4.034 -9.742 1.00 0.00 H new ATOM 0 HB3 GLU A 35 3.098 3.524 -10.946 1.00 0.00 H new ATOM 0 HG2 GLU A 35 2.711 5.929 -11.098 1.00 0.00 H new ATOM 0 HG3 GLU A 35 2.184 5.129 -12.566 1.00 0.00 H new ATOM 512 N LEU A 36 1.494 0.626 -10.411 1.00 0.00 N ATOM 513 CA LEU A 36 1.985 -0.747 -10.438 1.00 0.00 C ATOM 514 C LEU A 36 0.984 -1.651 -11.150 1.00 0.00 C ATOM 515 O LEU A 36 1.222 -2.849 -11.325 1.00 0.00 O ATOM 516 CB LEU A 36 2.250 -1.254 -9.020 1.00 0.00 C ATOM 517 CG LEU A 36 3.362 -0.521 -8.264 1.00 0.00 C ATOM 518 CD1 LEU A 36 3.525 -1.097 -6.868 1.00 0.00 C ATOM 519 CD2 LEU A 36 4.676 -0.602 -9.028 1.00 0.00 C ATOM 0 H LEU A 36 0.938 0.862 -9.589 1.00 0.00 H new ATOM 0 HA LEU A 36 2.926 -0.767 -10.988 1.00 0.00 H new ATOM 0 HB2 LEU A 36 1.328 -1.175 -8.444 1.00 0.00 H new ATOM 0 HB3 LEU A 36 2.504 -2.313 -9.071 1.00 0.00 H new ATOM 0 HG LEU A 36 3.080 0.528 -8.176 1.00 0.00 H new ATOM 0 HD11 LEU A 36 4.319 -0.564 -6.345 1.00 0.00 H new ATOM 0 HD12 LEU A 36 2.591 -0.987 -6.318 1.00 0.00 H new ATOM 0 HD13 LEU A 36 3.782 -2.154 -6.938 1.00 0.00 H new ATOM 0 HD21 LEU A 36 5.452 -0.075 -8.473 1.00 0.00 H new ATOM 0 HD22 LEU A 36 4.962 -1.647 -9.149 1.00 0.00 H new ATOM 0 HD23 LEU A 36 4.555 -0.142 -10.009 1.00 0.00 H new ATOM 531 N GLU A 37 -0.139 -1.051 -11.545 1.00 0.00 N ATOM 532 CA GLU A 37 -1.190 -1.728 -12.299 1.00 0.00 C ATOM 533 C GLU A 37 -1.710 -2.951 -11.543 1.00 0.00 C ATOM 534 O GLU A 37 -1.880 -4.036 -12.109 1.00 0.00 O ATOM 535 CB GLU A 37 -0.683 -2.123 -13.688 1.00 0.00 C ATOM 536 CG GLU A 37 -1.799 -2.319 -14.702 1.00 0.00 C ATOM 537 CD GLU A 37 -1.288 -2.742 -16.059 1.00 0.00 C ATOM 538 OE1 GLU A 37 -0.792 -1.880 -16.811 1.00 0.00 O ATOM 539 OE2 GLU A 37 -1.387 -3.942 -16.385 1.00 0.00 O ATOM 0 H GLU A 37 -0.345 -0.072 -11.348 1.00 0.00 H new ATOM 0 HA GLU A 37 -2.021 -1.033 -12.420 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -0.002 -1.353 -14.051 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -0.108 -3.045 -13.608 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -2.494 -3.071 -14.330 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -2.359 -1.390 -14.803 1.00 0.00 H new ATOM 546 N ILE A 38 -1.959 -2.767 -10.258 1.00 0.00 N ATOM 547 CA ILE A 38 -2.535 -3.818 -9.437 1.00 0.00 C ATOM 548 C ILE A 38 -3.993 -3.486 -9.130 1.00 0.00 C ATOM 549 O ILE A 38 -4.284 -2.467 -8.505 1.00 0.00 O ATOM 550 CB ILE A 38 -1.748 -4.002 -8.120 1.00 0.00 C ATOM 551 CG1 ILE A 38 -0.274 -4.302 -8.420 1.00 0.00 C ATOM 552 CG2 ILE A 38 -2.359 -5.118 -7.281 1.00 0.00 C ATOM 553 CD1 ILE A 38 0.599 -4.385 -7.183 1.00 0.00 C ATOM 0 H ILE A 38 -1.771 -1.897 -9.760 1.00 0.00 H new ATOM 0 HA ILE A 38 -2.479 -4.754 -9.993 1.00 0.00 H new ATOM 0 HB ILE A 38 -1.806 -3.075 -7.550 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -0.208 -5.245 -8.963 1.00 0.00 H new ATOM 0 HG13 ILE A 38 0.118 -3.527 -9.078 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -1.791 -5.232 -6.358 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -3.393 -4.869 -7.042 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -2.331 -6.052 -7.842 1.00 0.00 H new ATOM 0 HD11 ILE A 38 1.627 -4.600 -7.477 1.00 0.00 H new ATOM 0 HD12 ILE A 38 0.565 -3.435 -6.649 1.00 0.00 H new ATOM 0 HD13 ILE A 38 0.234 -5.180 -6.533 1.00 0.00 H new ATOM 565 N PRO A 39 -4.925 -4.329 -9.590 1.00 0.00 N ATOM 566 CA PRO A 39 -6.359 -4.088 -9.430 1.00 0.00 C ATOM 567 C PRO A 39 -6.813 -4.170 -7.975 1.00 0.00 C ATOM 568 O PRO A 39 -6.805 -5.241 -7.366 1.00 0.00 O ATOM 569 CB PRO A 39 -7.019 -5.201 -10.259 1.00 0.00 C ATOM 570 CG PRO A 39 -5.924 -5.780 -11.093 1.00 0.00 C ATOM 571 CD PRO A 39 -4.663 -5.583 -10.306 1.00 0.00 C ATOM 0 HA PRO A 39 -6.629 -3.083 -9.754 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -7.464 -5.959 -9.614 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -7.819 -4.803 -10.883 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -6.100 -6.837 -11.291 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -5.863 -5.281 -12.060 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -4.480 -6.410 -9.621 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -3.789 -5.505 -10.953 1.00 0.00 H new ATOM 579 N ILE A 40 -7.218 -3.029 -7.428 1.00 0.00 N ATOM 580 CA ILE A 40 -7.731 -2.961 -6.064 1.00 0.00 C ATOM 581 C ILE A 40 -9.088 -3.662 -5.983 1.00 0.00 C ATOM 582 O ILE A 40 -9.580 -3.989 -4.906 1.00 0.00 O ATOM 583 CB ILE A 40 -7.860 -1.490 -5.589 1.00 0.00 C ATOM 584 CG1 ILE A 40 -8.220 -1.429 -4.100 1.00 0.00 C ATOM 585 CG2 ILE A 40 -8.891 -0.740 -6.425 1.00 0.00 C ATOM 586 CD1 ILE A 40 -8.376 -0.022 -3.564 1.00 0.00 C ATOM 0 H ILE A 40 -7.201 -2.132 -7.913 1.00 0.00 H new ATOM 0 HA ILE A 40 -7.024 -3.467 -5.406 1.00 0.00 H new ATOM 0 HB ILE A 40 -6.894 -1.004 -5.725 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -9.150 -1.974 -3.938 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -7.447 -1.942 -3.528 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -8.965 0.289 -6.074 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -8.585 -0.746 -7.471 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -9.862 -1.227 -6.328 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -8.630 -0.062 -2.505 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -7.440 0.522 -3.692 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -9.170 0.489 -4.109 1.00 0.00 H new ATOM 598 N GLU A 41 -9.666 -3.908 -7.151 1.00 0.00 N ATOM 599 CA GLU A 41 -10.964 -4.555 -7.269 1.00 0.00 C ATOM 600 C GLU A 41 -10.952 -5.956 -6.659 1.00 0.00 C ATOM 601 O GLU A 41 -11.975 -6.441 -6.181 1.00 0.00 O ATOM 602 CB GLU A 41 -11.345 -4.655 -8.746 1.00 0.00 C ATOM 603 CG GLU A 41 -12.839 -4.724 -8.990 1.00 0.00 C ATOM 604 CD GLU A 41 -13.532 -3.440 -8.598 1.00 0.00 C ATOM 605 OE1 GLU A 41 -13.355 -2.430 -9.310 1.00 0.00 O ATOM 606 OE2 GLU A 41 -14.233 -3.429 -7.564 1.00 0.00 O ATOM 0 H GLU A 41 -9.245 -3.663 -8.047 1.00 0.00 H new ATOM 0 HA GLU A 41 -11.692 -3.953 -6.725 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -10.940 -3.793 -9.275 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -10.875 -5.541 -9.173 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -13.026 -4.931 -10.044 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -13.262 -5.553 -8.423 1.00 0.00 H new ATOM 613 N THR A 42 -9.792 -6.598 -6.676 1.00 0.00 N ATOM 614 CA THR A 42 -9.697 -7.989 -6.262 1.00 0.00 C ATOM 615 C THR A 42 -8.696 -8.169 -5.114 1.00 0.00 C ATOM 616 O THR A 42 -8.381 -9.292 -4.716 1.00 0.00 O ATOM 617 CB THR A 42 -9.295 -8.877 -7.464 1.00 0.00 C ATOM 618 OG1 THR A 42 -9.440 -10.265 -7.146 1.00 0.00 O ATOM 619 CG2 THR A 42 -7.861 -8.601 -7.895 1.00 0.00 C ATOM 0 H THR A 42 -8.909 -6.180 -6.970 1.00 0.00 H new ATOM 0 HA THR A 42 -10.678 -8.296 -5.900 1.00 0.00 H new ATOM 0 HB THR A 42 -9.964 -8.630 -8.288 1.00 0.00 H new ATOM 0 HG1 THR A 42 -9.243 -10.405 -6.196 1.00 0.00 H new ATOM 0 HG21 THR A 42 -7.606 -9.239 -8.741 1.00 0.00 H new ATOM 0 HG22 THR A 42 -7.764 -7.555 -8.187 1.00 0.00 H new ATOM 0 HG23 THR A 42 -7.185 -8.811 -7.066 1.00 0.00 H new ATOM 627 N VAL A 43 -8.200 -7.067 -4.566 1.00 0.00 N ATOM 628 CA VAL A 43 -7.230 -7.155 -3.483 1.00 0.00 C ATOM 629 C VAL A 43 -7.623 -6.238 -2.329 1.00 0.00 C ATOM 630 O VAL A 43 -8.257 -5.203 -2.537 1.00 0.00 O ATOM 631 CB VAL A 43 -5.784 -6.822 -3.951 1.00 0.00 C ATOM 632 CG1 VAL A 43 -5.436 -7.542 -5.246 1.00 0.00 C ATOM 633 CG2 VAL A 43 -5.580 -5.332 -4.114 1.00 0.00 C ATOM 0 H VAL A 43 -8.448 -6.118 -4.847 1.00 0.00 H new ATOM 0 HA VAL A 43 -7.237 -8.190 -3.143 1.00 0.00 H new ATOM 0 HB VAL A 43 -5.112 -7.176 -3.169 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -4.419 -7.286 -5.543 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -5.509 -8.619 -5.095 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -6.130 -7.238 -6.029 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -4.559 -5.138 -4.442 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -6.279 -4.948 -4.858 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -5.756 -4.834 -3.160 1.00 0.00 H new ATOM 643 N VAL A 44 -7.268 -6.631 -1.113 1.00 0.00 N ATOM 644 CA VAL A 44 -7.570 -5.832 0.065 1.00 0.00 C ATOM 645 C VAL A 44 -6.347 -5.033 0.488 1.00 0.00 C ATOM 646 O VAL A 44 -5.245 -5.575 0.622 1.00 0.00 O ATOM 647 CB VAL A 44 -8.053 -6.706 1.246 1.00 0.00 C ATOM 648 CG1 VAL A 44 -8.401 -5.851 2.459 1.00 0.00 C ATOM 649 CG2 VAL A 44 -9.247 -7.555 0.834 1.00 0.00 C ATOM 0 H VAL A 44 -6.770 -7.499 -0.917 1.00 0.00 H new ATOM 0 HA VAL A 44 -8.378 -5.152 -0.203 1.00 0.00 H new ATOM 0 HB VAL A 44 -7.235 -7.370 1.525 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -8.737 -6.494 3.273 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -7.519 -5.294 2.777 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -9.196 -5.153 2.196 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -9.571 -8.162 1.679 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -10.064 -6.906 0.520 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -8.963 -8.206 0.008 1.00 0.00 H new ATOM 659 N VAL A 45 -6.547 -3.742 0.689 1.00 0.00 N ATOM 660 CA VAL A 45 -5.466 -2.855 1.067 1.00 0.00 C ATOM 661 C VAL A 45 -5.540 -2.524 2.554 1.00 0.00 C ATOM 662 O VAL A 45 -6.580 -2.103 3.069 1.00 0.00 O ATOM 663 CB VAL A 45 -5.500 -1.546 0.246 1.00 0.00 C ATOM 664 CG1 VAL A 45 -4.319 -0.653 0.600 1.00 0.00 C ATOM 665 CG2 VAL A 45 -5.513 -1.844 -1.247 1.00 0.00 C ATOM 0 H VAL A 45 -7.454 -3.285 0.596 1.00 0.00 H new ATOM 0 HA VAL A 45 -4.530 -3.373 0.858 1.00 0.00 H new ATOM 0 HB VAL A 45 -6.418 -1.015 0.498 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -4.365 0.262 0.009 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -4.357 -0.403 1.660 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -3.388 -1.178 0.384 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -5.537 -0.908 -1.805 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -4.616 -2.403 -1.514 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -6.395 -2.435 -1.492 1.00 0.00 H new ATOM 675 N LYS A 46 -4.432 -2.733 3.237 1.00 0.00 N ATOM 676 CA LYS A 46 -4.332 -2.440 4.649 1.00 0.00 C ATOM 677 C LYS A 46 -3.253 -1.399 4.907 1.00 0.00 C ATOM 678 O LYS A 46 -2.184 -1.423 4.292 1.00 0.00 O ATOM 679 CB LYS A 46 -4.007 -3.709 5.435 1.00 0.00 C ATOM 680 CG LYS A 46 -5.214 -4.501 5.899 1.00 0.00 C ATOM 681 CD LYS A 46 -4.775 -5.702 6.722 1.00 0.00 C ATOM 682 CE LYS A 46 -5.942 -6.368 7.425 1.00 0.00 C ATOM 683 NZ LYS A 46 -5.479 -7.369 8.422 1.00 0.00 N ATOM 0 H LYS A 46 -3.578 -3.110 2.827 1.00 0.00 H new ATOM 0 HA LYS A 46 -5.293 -2.046 4.979 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -3.385 -4.354 4.814 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -3.413 -3.436 6.307 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -5.868 -3.864 6.494 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -5.792 -4.834 5.037 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -4.283 -6.426 6.073 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -4.040 -5.385 7.462 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -6.548 -5.611 7.923 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -6.581 -6.855 6.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -6.302 -7.805 8.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -4.921 -8.104 7.942 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -4.889 -6.899 9.138 1.00 0.00 H new ATOM 697 N LYS A 47 -3.540 -0.487 5.815 1.00 0.00 N ATOM 698 CA LYS A 47 -2.571 0.505 6.240 1.00 0.00 C ATOM 699 C LYS A 47 -2.445 0.490 7.748 1.00 0.00 C ATOM 700 O LYS A 47 -3.410 0.775 8.455 1.00 0.00 O ATOM 701 CB LYS A 47 -2.977 1.901 5.775 1.00 0.00 C ATOM 702 CG LYS A 47 -2.688 2.165 4.310 1.00 0.00 C ATOM 703 CD LYS A 47 -2.852 3.637 3.953 1.00 0.00 C ATOM 704 CE LYS A 47 -1.747 4.503 4.549 1.00 0.00 C ATOM 705 NZ LYS A 47 -1.890 4.697 6.018 1.00 0.00 N ATOM 0 H LYS A 47 -4.446 -0.412 6.277 1.00 0.00 H new ATOM 0 HA LYS A 47 -1.610 0.256 5.790 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -4.043 2.039 5.956 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -2.453 2.642 6.379 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -1.672 1.846 4.078 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -3.359 1.566 3.694 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -2.853 3.748 2.869 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -3.820 3.990 4.310 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -0.781 4.044 4.341 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -1.750 5.476 4.057 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -1.801 5.708 6.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -2.823 4.355 6.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -1.146 4.164 6.513 1.00 0.00 H new ATOM 719 N ASN A 48 -1.262 0.133 8.230 1.00 0.00 N ATOM 720 CA ASN A 48 -0.973 0.110 9.664 1.00 0.00 C ATOM 721 C ASN A 48 -1.877 -0.902 10.374 1.00 0.00 C ATOM 722 O ASN A 48 -2.105 -0.818 11.583 1.00 0.00 O ATOM 723 CB ASN A 48 -1.164 1.515 10.254 1.00 0.00 C ATOM 724 CG ASN A 48 -0.286 1.782 11.462 1.00 0.00 C ATOM 725 OD1 ASN A 48 -0.663 1.498 12.600 1.00 0.00 O ATOM 726 ND2 ASN A 48 0.880 2.361 11.222 1.00 0.00 N ATOM 0 H ASN A 48 -0.476 -0.148 7.644 1.00 0.00 H new ATOM 0 HA ASN A 48 0.062 -0.196 9.814 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -0.948 2.257 9.485 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -2.209 1.644 10.537 1.00 0.00 H new ATOM 0 HD21 ASN A 48 1.505 2.589 11.995 1.00 0.00 H new ATOM 0 HD22 ASN A 48 1.153 2.579 10.264 1.00 0.00 H new ATOM 733 N GLY A 49 -2.383 -1.868 9.612 1.00 0.00 N ATOM 734 CA GLY A 49 -3.275 -2.872 10.163 1.00 0.00 C ATOM 735 C GLY A 49 -4.731 -2.602 9.831 1.00 0.00 C ATOM 736 O GLY A 49 -5.580 -3.480 9.972 1.00 0.00 O ATOM 0 H GLY A 49 -2.189 -1.973 8.616 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -2.994 -3.853 9.779 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -3.153 -2.907 11.246 1.00 0.00 H new ATOM 740 N GLN A 50 -5.015 -1.390 9.372 1.00 0.00 N ATOM 741 CA GLN A 50 -6.385 -0.964 9.102 1.00 0.00 C ATOM 742 C GLN A 50 -6.800 -1.325 7.683 1.00 0.00 C ATOM 743 O GLN A 50 -6.008 -1.199 6.754 1.00 0.00 O ATOM 744 CB GLN A 50 -6.502 0.549 9.279 1.00 0.00 C ATOM 745 CG GLN A 50 -6.072 1.045 10.645 1.00 0.00 C ATOM 746 CD GLN A 50 -6.039 2.556 10.719 1.00 0.00 C ATOM 747 OE1 GLN A 50 -6.815 3.242 10.052 1.00 0.00 O ATOM 748 NE2 GLN A 50 -5.142 3.087 11.530 1.00 0.00 N ATOM 0 H GLN A 50 -4.310 -0.679 9.177 1.00 0.00 H new ATOM 0 HA GLN A 50 -7.041 -1.477 9.805 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -5.897 1.041 8.518 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -7.536 0.846 9.105 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -6.756 0.661 11.401 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -5.084 0.650 10.879 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -4.518 2.483 12.065 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -5.074 4.101 11.621 1.00 0.00 H new ATOM 757 N ILE A 51 -8.042 -1.762 7.518 1.00 0.00 N ATOM 758 CA ILE A 51 -8.587 -2.016 6.189 1.00 0.00 C ATOM 759 C ILE A 51 -9.017 -0.687 5.576 1.00 0.00 C ATOM 760 O ILE A 51 -9.953 -0.042 6.060 1.00 0.00 O ATOM 761 CB ILE A 51 -9.790 -3.002 6.207 1.00 0.00 C ATOM 762 CG1 ILE A 51 -9.354 -4.409 6.643 1.00 0.00 C ATOM 763 CG2 ILE A 51 -10.453 -3.068 4.835 1.00 0.00 C ATOM 764 CD1 ILE A 51 -9.089 -4.554 8.129 1.00 0.00 C ATOM 0 H ILE A 51 -8.689 -1.948 8.284 1.00 0.00 H new ATOM 0 HA ILE A 51 -7.806 -2.487 5.592 1.00 0.00 H new ATOM 0 HB ILE A 51 -10.511 -2.625 6.933 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -10.127 -5.121 6.354 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -8.450 -4.681 6.098 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -11.292 -3.763 4.869 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -10.814 -2.078 4.557 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -9.728 -3.411 4.097 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -8.787 -5.578 8.346 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -8.293 -3.870 8.425 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -9.996 -4.318 8.685 1.00 0.00 H new ATOM 776 N VAL A 52 -8.327 -0.276 4.523 1.00 0.00 N ATOM 777 CA VAL A 52 -8.492 1.065 3.981 1.00 0.00 C ATOM 778 C VAL A 52 -8.829 1.039 2.496 1.00 0.00 C ATOM 779 O VAL A 52 -8.925 -0.025 1.885 1.00 0.00 O ATOM 780 CB VAL A 52 -7.219 1.905 4.191 1.00 0.00 C ATOM 781 CG1 VAL A 52 -6.926 2.082 5.673 1.00 0.00 C ATOM 782 CG2 VAL A 52 -6.032 1.271 3.479 1.00 0.00 C ATOM 0 H VAL A 52 -7.647 -0.852 4.026 1.00 0.00 H new ATOM 0 HA VAL A 52 -9.323 1.519 4.520 1.00 0.00 H new ATOM 0 HB VAL A 52 -7.389 2.891 3.759 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -6.022 2.679 5.796 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -7.764 2.589 6.151 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -6.782 1.105 6.135 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -5.143 1.881 3.640 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -5.862 0.270 3.875 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -6.240 1.208 2.411 1.00 0.00 H new ATOM 792 N ILE A 53 -9.018 2.225 1.929 1.00 0.00 N ATOM 793 CA ILE A 53 -9.322 2.363 0.515 1.00 0.00 C ATOM 794 C ILE A 53 -8.166 3.037 -0.221 1.00 0.00 C ATOM 795 O ILE A 53 -7.093 3.250 0.348 1.00 0.00 O ATOM 796 CB ILE A 53 -10.626 3.164 0.287 1.00 0.00 C ATOM 797 CG1 ILE A 53 -10.548 4.539 0.965 1.00 0.00 C ATOM 798 CG2 ILE A 53 -11.823 2.381 0.807 1.00 0.00 C ATOM 799 CD1 ILE A 53 -11.765 5.411 0.722 1.00 0.00 C ATOM 0 H ILE A 53 -8.965 3.110 2.434 1.00 0.00 H new ATOM 0 HA ILE A 53 -9.465 1.359 0.115 1.00 0.00 H new ATOM 0 HB ILE A 53 -10.749 3.321 -0.785 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -10.422 4.398 2.038 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -9.661 5.061 0.606 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -12.734 2.956 0.640 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -11.893 1.430 0.279 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -11.701 2.196 1.874 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -11.636 6.366 1.232 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -11.881 5.584 -0.348 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -12.654 4.911 1.107 1.00 0.00 H new ATOM 811 N ASP A 54 -8.395 3.389 -1.477 1.00 0.00 N ATOM 812 CA ASP A 54 -7.348 3.941 -2.332 1.00 0.00 C ATOM 813 C ASP A 54 -7.134 5.434 -2.076 1.00 0.00 C ATOM 814 O ASP A 54 -6.185 6.028 -2.588 1.00 0.00 O ATOM 815 CB ASP A 54 -7.700 3.714 -3.804 1.00 0.00 C ATOM 816 CG ASP A 54 -8.930 4.490 -4.236 1.00 0.00 C ATOM 817 OD1 ASP A 54 -10.049 4.097 -3.853 1.00 0.00 O ATOM 818 OD2 ASP A 54 -8.786 5.492 -4.960 1.00 0.00 O ATOM 0 H ASP A 54 -9.304 3.302 -1.932 1.00 0.00 H new ATOM 0 HA ASP A 54 -6.419 3.424 -2.092 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -6.854 4.006 -4.425 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -7.868 2.650 -3.974 1.00 0.00 H new ATOM 823 N GLU A 55 -8.007 6.028 -1.268 1.00 0.00 N ATOM 824 CA GLU A 55 -7.944 7.460 -0.979 1.00 0.00 C ATOM 825 C GLU A 55 -7.084 7.712 0.264 1.00 0.00 C ATOM 826 O GLU A 55 -7.063 8.808 0.820 1.00 0.00 O ATOM 827 CB GLU A 55 -9.366 8.005 -0.781 1.00 0.00 C ATOM 828 CG GLU A 55 -9.609 9.382 -1.391 1.00 0.00 C ATOM 829 CD GLU A 55 -9.060 10.522 -0.556 1.00 0.00 C ATOM 830 OE1 GLU A 55 -9.744 10.945 0.405 1.00 0.00 O ATOM 831 OE2 GLU A 55 -7.953 11.011 -0.859 1.00 0.00 O ATOM 0 H GLU A 55 -8.770 5.539 -0.799 1.00 0.00 H new ATOM 0 HA GLU A 55 -7.483 7.980 -1.819 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -10.075 7.300 -1.215 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -9.577 8.053 0.287 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -9.155 9.417 -2.381 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -10.681 9.526 -1.527 1.00 0.00 H new ATOM 838 N GLU A 56 -6.364 6.686 0.691 1.00 0.00 N ATOM 839 CA GLU A 56 -5.491 6.798 1.847 1.00 0.00 C ATOM 840 C GLU A 56 -4.103 7.279 1.443 1.00 0.00 C ATOM 841 O GLU A 56 -3.477 6.721 0.537 1.00 0.00 O ATOM 842 CB GLU A 56 -5.390 5.454 2.562 1.00 0.00 C ATOM 843 CG GLU A 56 -6.630 5.101 3.364 1.00 0.00 C ATOM 844 CD GLU A 56 -6.787 5.964 4.598 1.00 0.00 C ATOM 845 OE1 GLU A 56 -7.282 7.103 4.474 1.00 0.00 O ATOM 846 OE2 GLU A 56 -6.406 5.508 5.697 1.00 0.00 O ATOM 0 H GLU A 56 -6.368 5.765 0.253 1.00 0.00 H new ATOM 0 HA GLU A 56 -5.922 7.534 2.526 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -5.209 4.672 1.825 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -4.528 5.470 3.229 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -7.511 5.212 2.732 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -6.581 4.053 3.661 1.00 0.00 H new ATOM 853 N GLU A 57 -3.636 8.320 2.116 1.00 0.00 N ATOM 854 CA GLU A 57 -2.300 8.852 1.885 1.00 0.00 C ATOM 855 C GLU A 57 -1.264 7.950 2.545 1.00 0.00 C ATOM 856 O GLU A 57 -1.503 7.414 3.628 1.00 0.00 O ATOM 857 CB GLU A 57 -2.182 10.267 2.463 1.00 0.00 C ATOM 858 CG GLU A 57 -3.190 11.259 1.904 1.00 0.00 C ATOM 859 CD GLU A 57 -2.919 11.639 0.462 1.00 0.00 C ATOM 860 OE1 GLU A 57 -2.174 12.613 0.228 1.00 0.00 O ATOM 861 OE2 GLU A 57 -3.469 10.986 -0.444 1.00 0.00 O ATOM 0 H GLU A 57 -4.167 8.817 2.832 1.00 0.00 H new ATOM 0 HA GLU A 57 -2.122 8.890 0.810 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -2.302 10.216 3.545 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -1.177 10.642 2.272 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -4.190 10.832 1.978 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -3.182 12.160 2.518 1.00 0.00 H new ATOM 868 N ILE A 58 -0.123 7.773 1.900 1.00 0.00 N ATOM 869 CA ILE A 58 0.947 6.981 2.480 1.00 0.00 C ATOM 870 C ILE A 58 1.887 7.892 3.260 1.00 0.00 C ATOM 871 O ILE A 58 2.211 8.993 2.810 1.00 0.00 O ATOM 872 CB ILE A 58 1.738 6.201 1.408 1.00 0.00 C ATOM 873 CG1 ILE A 58 0.775 5.405 0.523 1.00 0.00 C ATOM 874 CG2 ILE A 58 2.749 5.269 2.064 1.00 0.00 C ATOM 875 CD1 ILE A 58 1.465 4.613 -0.566 1.00 0.00 C ATOM 0 H ILE A 58 0.085 8.164 0.981 1.00 0.00 H new ATOM 0 HA ILE A 58 0.496 6.248 3.149 1.00 0.00 H new ATOM 0 HB ILE A 58 2.281 6.913 0.786 1.00 0.00 H new ATOM 0 HG12 ILE A 58 0.201 4.722 1.149 1.00 0.00 H new ATOM 0 HG13 ILE A 58 0.064 6.092 0.065 1.00 0.00 H new ATOM 0 HG21 ILE A 58 3.298 4.727 1.294 1.00 0.00 H new ATOM 0 HG22 ILE A 58 3.447 5.853 2.663 1.00 0.00 H new ATOM 0 HG23 ILE A 58 2.227 4.559 2.705 1.00 0.00 H new ATOM 0 HD11 ILE A 58 0.720 4.075 -1.152 1.00 0.00 H new ATOM 0 HD12 ILE A 58 2.017 5.292 -1.216 1.00 0.00 H new ATOM 0 HD13 ILE A 58 2.156 3.900 -0.116 1.00 0.00 H new ATOM 887 N PHE A 59 2.305 7.442 4.434 1.00 0.00 N ATOM 888 CA PHE A 59 3.113 8.264 5.319 1.00 0.00 C ATOM 889 C PHE A 59 4.488 7.649 5.540 1.00 0.00 C ATOM 890 O PHE A 59 4.651 6.428 5.507 1.00 0.00 O ATOM 891 CB PHE A 59 2.405 8.452 6.665 1.00 0.00 C ATOM 892 CG PHE A 59 1.039 9.066 6.548 1.00 0.00 C ATOM 893 CD1 PHE A 59 0.896 10.410 6.250 1.00 0.00 C ATOM 894 CD2 PHE A 59 -0.099 8.301 6.736 1.00 0.00 C ATOM 895 CE1 PHE A 59 -0.356 10.982 6.142 1.00 0.00 C ATOM 896 CE2 PHE A 59 -1.357 8.866 6.629 1.00 0.00 C ATOM 897 CZ PHE A 59 -1.485 10.209 6.331 1.00 0.00 C ATOM 0 H PHE A 59 2.097 6.511 4.795 1.00 0.00 H new ATOM 0 HA PHE A 59 3.245 9.236 4.843 1.00 0.00 H new ATOM 0 HB2 PHE A 59 2.317 7.484 7.158 1.00 0.00 H new ATOM 0 HB3 PHE A 59 3.023 9.081 7.306 1.00 0.00 H new ATOM 0 HD1 PHE A 59 1.775 11.019 6.100 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -0.004 7.251 6.969 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -0.452 12.032 5.910 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -2.237 8.259 6.778 1.00 0.00 H new ATOM 0 HZ PHE A 59 -2.466 10.653 6.246 1.00 0.00 H new ATOM 907 N ASP A 60 5.474 8.507 5.749 1.00 0.00 N ATOM 908 CA ASP A 60 6.833 8.074 6.058 1.00 0.00 C ATOM 909 C ASP A 60 6.887 7.391 7.422 1.00 0.00 C ATOM 910 O ASP A 60 6.599 8.009 8.449 1.00 0.00 O ATOM 911 CB ASP A 60 7.784 9.274 6.036 1.00 0.00 C ATOM 912 CG ASP A 60 9.190 8.916 6.475 1.00 0.00 C ATOM 913 OD1 ASP A 60 9.794 8.009 5.872 1.00 0.00 O ATOM 914 OD2 ASP A 60 9.706 9.556 7.414 1.00 0.00 O ATOM 0 H ASP A 60 5.359 9.520 5.710 1.00 0.00 H new ATOM 0 HA ASP A 60 7.145 7.355 5.300 1.00 0.00 H new ATOM 0 HB2 ASP A 60 7.817 9.687 5.028 1.00 0.00 H new ATOM 0 HB3 ASP A 60 7.392 10.055 6.688 1.00 0.00 H new ATOM 919 N GLY A 61 7.249 6.116 7.424 1.00 0.00 N ATOM 920 CA GLY A 61 7.314 5.357 8.657 1.00 0.00 C ATOM 921 C GLY A 61 6.052 4.556 8.904 1.00 0.00 C ATOM 922 O GLY A 61 5.842 4.034 10.002 1.00 0.00 O ATOM 0 H GLY A 61 7.501 5.590 6.587 1.00 0.00 H new ATOM 0 HA2 GLY A 61 8.169 4.682 8.621 1.00 0.00 H new ATOM 0 HA3 GLY A 61 7.479 6.038 9.492 1.00 0.00 H new ATOM 926 N ASP A 62 5.205 4.463 7.889 1.00 0.00 N ATOM 927 CA ASP A 62 3.958 3.715 7.998 1.00 0.00 C ATOM 928 C ASP A 62 4.128 2.313 7.408 1.00 0.00 C ATOM 929 O ASP A 62 5.069 2.061 6.652 1.00 0.00 O ATOM 930 CB ASP A 62 2.828 4.465 7.283 1.00 0.00 C ATOM 931 CG ASP A 62 1.443 4.000 7.698 1.00 0.00 C ATOM 932 OD1 ASP A 62 1.333 3.151 8.611 1.00 0.00 O ATOM 933 OD2 ASP A 62 0.451 4.501 7.124 1.00 0.00 O ATOM 0 H ASP A 62 5.358 4.897 6.978 1.00 0.00 H new ATOM 0 HA ASP A 62 3.697 3.617 9.052 1.00 0.00 H new ATOM 0 HB2 ASP A 62 2.922 5.531 7.488 1.00 0.00 H new ATOM 0 HB3 ASP A 62 2.940 4.336 6.206 1.00 0.00 H new ATOM 938 N ILE A 63 3.228 1.411 7.757 1.00 0.00 N ATOM 939 CA ILE A 63 3.306 0.029 7.303 1.00 0.00 C ATOM 940 C ILE A 63 2.161 -0.285 6.346 1.00 0.00 C ATOM 941 O ILE A 63 0.992 -0.066 6.667 1.00 0.00 O ATOM 942 CB ILE A 63 3.263 -0.956 8.494 1.00 0.00 C ATOM 943 CG1 ILE A 63 4.414 -0.671 9.468 1.00 0.00 C ATOM 944 CG2 ILE A 63 3.318 -2.400 8.012 1.00 0.00 C ATOM 945 CD1 ILE A 63 5.788 -0.808 8.851 1.00 0.00 C ATOM 0 H ILE A 63 2.428 1.610 8.358 1.00 0.00 H new ATOM 0 HA ILE A 63 4.257 -0.092 6.784 1.00 0.00 H new ATOM 0 HB ILE A 63 2.319 -0.811 9.018 1.00 0.00 H new ATOM 0 HG12 ILE A 63 4.302 0.339 9.861 1.00 0.00 H new ATOM 0 HG13 ILE A 63 4.337 -1.353 10.315 1.00 0.00 H new ATOM 0 HG21 ILE A 63 3.286 -3.071 8.870 1.00 0.00 H new ATOM 0 HG22 ILE A 63 2.465 -2.600 7.363 1.00 0.00 H new ATOM 0 HG23 ILE A 63 4.242 -2.563 7.457 1.00 0.00 H new ATOM 0 HD11 ILE A 63 6.547 -0.591 9.602 1.00 0.00 H new ATOM 0 HD12 ILE A 63 5.922 -1.825 8.483 1.00 0.00 H new ATOM 0 HD13 ILE A 63 5.886 -0.107 8.022 1.00 0.00 H new ATOM 957 N ILE A 64 2.503 -0.788 5.169 1.00 0.00 N ATOM 958 CA ILE A 64 1.506 -1.123 4.167 1.00 0.00 C ATOM 959 C ILE A 64 1.353 -2.637 4.053 1.00 0.00 C ATOM 960 O ILE A 64 2.339 -3.366 3.932 1.00 0.00 O ATOM 961 CB ILE A 64 1.881 -0.541 2.783 1.00 0.00 C ATOM 962 CG1 ILE A 64 2.090 0.977 2.870 1.00 0.00 C ATOM 963 CG2 ILE A 64 0.808 -0.868 1.753 1.00 0.00 C ATOM 964 CD1 ILE A 64 0.862 1.743 3.319 1.00 0.00 C ATOM 0 H ILE A 64 3.465 -0.973 4.886 1.00 0.00 H new ATOM 0 HA ILE A 64 0.561 -0.683 4.486 1.00 0.00 H new ATOM 0 HB ILE A 64 2.817 -1.001 2.466 1.00 0.00 H new ATOM 0 HG12 ILE A 64 2.907 1.182 3.562 1.00 0.00 H new ATOM 0 HG13 ILE A 64 2.400 1.347 1.893 1.00 0.00 H new ATOM 0 HG21 ILE A 64 1.091 -0.450 0.787 1.00 0.00 H new ATOM 0 HG22 ILE A 64 0.706 -1.950 1.664 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -0.143 -0.439 2.069 1.00 0.00 H new ATOM 0 HD11 ILE A 64 1.091 2.808 3.355 1.00 0.00 H new ATOM 0 HD12 ILE A 64 0.048 1.570 2.615 1.00 0.00 H new ATOM 0 HD13 ILE A 64 0.563 1.402 4.310 1.00 0.00 H new ATOM 976 N GLU A 65 0.116 -3.106 4.103 1.00 0.00 N ATOM 977 CA GLU A 65 -0.175 -4.523 3.956 1.00 0.00 C ATOM 978 C GLU A 65 -1.125 -4.725 2.784 1.00 0.00 C ATOM 979 O GLU A 65 -2.150 -4.058 2.692 1.00 0.00 O ATOM 980 CB GLU A 65 -0.809 -5.083 5.233 1.00 0.00 C ATOM 981 CG GLU A 65 -0.035 -4.781 6.504 1.00 0.00 C ATOM 982 CD GLU A 65 -0.692 -5.376 7.733 1.00 0.00 C ATOM 983 OE1 GLU A 65 -1.664 -4.778 8.243 1.00 0.00 O ATOM 984 OE2 GLU A 65 -0.247 -6.450 8.190 1.00 0.00 O ATOM 0 H GLU A 65 -0.707 -2.521 4.245 1.00 0.00 H new ATOM 0 HA GLU A 65 0.759 -5.054 3.772 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -1.816 -4.678 5.331 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -0.908 -6.164 5.131 1.00 0.00 H new ATOM 0 HG2 GLU A 65 0.978 -5.172 6.411 1.00 0.00 H new ATOM 0 HG3 GLU A 65 0.050 -3.701 6.627 1.00 0.00 H new ATOM 991 N VAL A 66 -0.786 -5.625 1.879 1.00 0.00 N ATOM 992 CA VAL A 66 -1.666 -5.925 0.759 1.00 0.00 C ATOM 993 C VAL A 66 -2.024 -7.401 0.740 1.00 0.00 C ATOM 994 O VAL A 66 -1.183 -8.261 0.468 1.00 0.00 O ATOM 995 CB VAL A 66 -1.055 -5.505 -0.596 1.00 0.00 C ATOM 996 CG1 VAL A 66 -1.880 -6.047 -1.759 1.00 0.00 C ATOM 997 CG2 VAL A 66 -0.975 -3.991 -0.681 1.00 0.00 C ATOM 0 H VAL A 66 0.084 -6.158 1.894 1.00 0.00 H new ATOM 0 HA VAL A 66 -2.574 -5.339 0.902 1.00 0.00 H new ATOM 0 HB VAL A 66 -0.051 -5.925 -0.663 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -1.428 -5.737 -2.701 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -1.906 -7.136 -1.710 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.896 -5.656 -1.698 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.543 -3.703 -1.639 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -1.976 -3.568 -0.592 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -0.349 -3.614 0.127 1.00 0.00 H new ATOM 1007 N ILE A 67 -3.278 -7.681 1.039 1.00 0.00 N ATOM 1008 CA ILE A 67 -3.775 -9.042 1.088 1.00 0.00 C ATOM 1009 C ILE A 67 -4.871 -9.217 0.050 1.00 0.00 C ATOM 1010 O ILE A 67 -6.000 -8.771 0.243 1.00 0.00 O ATOM 1011 CB ILE A 67 -4.339 -9.381 2.483 1.00 0.00 C ATOM 1012 CG1 ILE A 67 -3.336 -8.988 3.573 1.00 0.00 C ATOM 1013 CG2 ILE A 67 -4.675 -10.864 2.572 1.00 0.00 C ATOM 1014 CD1 ILE A 67 -3.881 -9.145 4.973 1.00 0.00 C ATOM 0 H ILE A 67 -3.980 -6.973 1.254 1.00 0.00 H new ATOM 0 HA ILE A 67 -2.944 -9.716 0.879 1.00 0.00 H new ATOM 0 HB ILE A 67 -5.255 -8.811 2.637 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -2.440 -9.599 3.469 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -3.034 -7.951 3.422 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -5.072 -11.088 3.562 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -5.420 -11.114 1.817 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -3.773 -11.452 2.401 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -3.120 -8.850 5.695 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -4.761 -8.513 5.094 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -4.157 -10.186 5.142 1.00 0.00 H new ATOM 1026 N ARG A 68 -4.535 -9.830 -1.069 1.00 0.00 N ATOM 1027 CA ARG A 68 -5.512 -10.023 -2.123 1.00 0.00 C ATOM 1028 C ARG A 68 -6.429 -11.181 -1.763 1.00 0.00 C ATOM 1029 O ARG A 68 -5.995 -12.156 -1.144 1.00 0.00 O ATOM 1030 CB ARG A 68 -4.823 -10.250 -3.475 1.00 0.00 C ATOM 1031 CG ARG A 68 -4.121 -11.584 -3.615 1.00 0.00 C ATOM 1032 CD ARG A 68 -3.301 -11.639 -4.896 1.00 0.00 C ATOM 1033 NE ARG A 68 -2.754 -12.970 -5.146 1.00 0.00 N ATOM 1034 CZ ARG A 68 -1.454 -13.233 -5.279 1.00 0.00 C ATOM 1035 NH1 ARG A 68 -0.555 -12.261 -5.151 1.00 0.00 N ATOM 1036 NH2 ARG A 68 -1.050 -14.467 -5.549 1.00 0.00 N ATOM 0 H ARG A 68 -3.605 -10.199 -1.270 1.00 0.00 H new ATOM 0 HA ARG A 68 -6.116 -9.121 -2.219 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -5.568 -10.163 -4.266 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -4.095 -9.454 -3.634 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -3.471 -11.748 -2.756 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -4.857 -12.388 -3.616 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -3.926 -11.341 -5.738 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -2.485 -10.919 -4.834 1.00 0.00 H new ATOM 0 HE ARG A 68 -3.409 -13.748 -5.224 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -0.859 -11.308 -4.950 1.00 0.00 H new ATOM 0 HH12 ARG A 68 0.438 -12.468 -5.254 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -1.734 -15.216 -5.655 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -0.055 -14.667 -5.651 1.00 0.00 H new ATOM 1050 N VAL A 69 -7.698 -11.069 -2.123 1.00 0.00 N ATOM 1051 CA VAL A 69 -8.671 -12.076 -1.743 1.00 0.00 C ATOM 1052 C VAL A 69 -8.636 -13.248 -2.713 1.00 0.00 C ATOM 1053 O VAL A 69 -8.871 -13.100 -3.914 1.00 0.00 O ATOM 1054 CB VAL A 69 -10.107 -11.496 -1.628 1.00 0.00 C ATOM 1055 CG1 VAL A 69 -10.563 -10.849 -2.929 1.00 0.00 C ATOM 1056 CG2 VAL A 69 -11.089 -12.574 -1.191 1.00 0.00 C ATOM 0 H VAL A 69 -8.074 -10.297 -2.673 1.00 0.00 H new ATOM 0 HA VAL A 69 -8.393 -12.433 -0.751 1.00 0.00 H new ATOM 0 HB VAL A 69 -10.083 -10.716 -0.867 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -11.572 -10.456 -2.806 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -9.886 -10.035 -3.187 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -10.558 -11.592 -3.726 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -12.089 -12.147 -1.117 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -11.093 -13.381 -1.923 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -10.789 -12.967 -0.220 1.00 0.00 H new ATOM 1066 N ILE A 70 -8.290 -14.409 -2.186 1.00 0.00 N ATOM 1067 CA ILE A 70 -8.218 -15.613 -2.986 1.00 0.00 C ATOM 1068 C ILE A 70 -9.522 -16.396 -2.867 1.00 0.00 C ATOM 1069 O ILE A 70 -10.015 -16.647 -1.766 1.00 0.00 O ATOM 1070 CB ILE A 70 -7.013 -16.501 -2.574 1.00 0.00 C ATOM 1071 CG1 ILE A 70 -6.963 -17.782 -3.418 1.00 0.00 C ATOM 1072 CG2 ILE A 70 -7.064 -16.843 -1.089 1.00 0.00 C ATOM 1073 CD1 ILE A 70 -6.687 -17.533 -4.886 1.00 0.00 C ATOM 0 H ILE A 70 -8.054 -14.541 -1.203 1.00 0.00 H new ATOM 0 HA ILE A 70 -8.069 -15.319 -4.025 1.00 0.00 H new ATOM 0 HB ILE A 70 -6.103 -15.931 -2.760 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -6.191 -18.440 -3.019 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -7.912 -18.308 -3.320 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -6.208 -17.466 -0.829 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -7.036 -15.924 -0.503 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -7.985 -17.384 -0.872 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -6.666 -18.484 -5.419 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -7.472 -16.901 -5.302 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -5.724 -17.035 -4.996 1.00 0.00 H new ATOM 1085 N TYR A 71 -10.102 -16.742 -4.001 1.00 0.00 N ATOM 1086 CA TYR A 71 -11.312 -17.544 -4.011 1.00 0.00 C ATOM 1087 C TYR A 71 -10.959 -19.021 -3.853 1.00 0.00 C ATOM 1088 O TYR A 71 -10.736 -19.739 -4.827 1.00 0.00 O ATOM 1089 CB TYR A 71 -12.139 -17.281 -5.286 1.00 0.00 C ATOM 1090 CG TYR A 71 -11.370 -17.418 -6.586 1.00 0.00 C ATOM 1091 CD1 TYR A 71 -10.437 -16.462 -6.972 1.00 0.00 C ATOM 1092 CD2 TYR A 71 -11.585 -18.498 -7.432 1.00 0.00 C ATOM 1093 CE1 TYR A 71 -9.737 -16.584 -8.156 1.00 0.00 C ATOM 1094 CE2 TYR A 71 -10.889 -18.627 -8.618 1.00 0.00 C ATOM 1095 CZ TYR A 71 -9.968 -17.666 -8.975 1.00 0.00 C ATOM 1096 OH TYR A 71 -9.269 -17.794 -10.153 1.00 0.00 O ATOM 0 H TYR A 71 -9.757 -16.482 -4.925 1.00 0.00 H new ATOM 0 HA TYR A 71 -11.936 -17.255 -3.165 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -12.981 -17.973 -5.304 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -12.554 -16.275 -5.231 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -10.257 -15.609 -6.335 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -12.309 -19.251 -7.158 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -9.012 -15.835 -8.438 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -11.065 -19.476 -9.262 1.00 0.00 H new ATOM 0 HH TYR A 71 -9.550 -18.613 -10.613 1.00 0.00 H new ATOM 1106 N GLY A 72 -10.859 -19.453 -2.603 1.00 0.00 N ATOM 1107 CA GLY A 72 -10.483 -20.819 -2.317 1.00 0.00 C ATOM 1108 C GLY A 72 -11.673 -21.748 -2.330 1.00 0.00 C ATOM 1109 O GLY A 72 -12.413 -21.834 -1.348 1.00 0.00 O ATOM 0 H GLY A 72 -11.033 -18.877 -1.780 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -9.752 -21.155 -3.053 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -9.998 -20.865 -1.342 1.00 0.00 H new ATOM 1113 N GLY A 73 -11.867 -22.428 -3.447 1.00 0.00 N ATOM 1114 CA GLY A 73 -12.959 -23.366 -3.556 1.00 0.00 C ATOM 1115 C GLY A 73 -12.519 -24.776 -3.234 1.00 0.00 C ATOM 1116 O GLY A 73 -13.326 -25.542 -2.670 1.00 0.00 O ATOM 1117 OXT GLY A 73 -11.363 -25.128 -3.550 1.00 0.00 O ATOM 0 H GLY A 73 -11.286 -22.346 -4.281 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -13.761 -23.071 -2.879 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -13.367 -23.334 -4.566 1.00 0.00 H new TER 1121 GLY A 73