USER MOD reduce.3.24.130724 H: found=0, std=0, add=1052, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 1066 hydrogens (31 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 -111:sc= -0.0113 (180deg=-0.406) USER MOD Single : A 1 MET N :NH3+ 149:sc= -0.891 (180deg=-1.56) USER MOD Single : A 2 LYS NZ :NH3+ -158:sc= -0.0313 (180deg=-0.347) USER MOD Single : A 3 LYS NZ :NH3+ 141:sc= -0.151 (180deg=-1.29!) USER MOD Single : A 5 GLN : amide:sc= -3.98! C(o=-4!,f=-8!) USER MOD Single : A 13 ASN : amide:sc= -6.47! C(o=-6.5!,f=-7.2!) USER MOD Single : A 15 ASN : amide:sc= -0.0167 K(o=-0.017,f=-1.4!) USER MOD Single : A 16 ASN : amide:sc= -5.55! C(o=-5.5!,f=-9.4!) USER MOD Single : A 21 THR OG1 : rot 149:sc= -1.9! USER MOD Single : A 28 HIS : no HD1:sc= -0.253 X(o=-0.25,f=-0.4) USER MOD Single : A 29 MET CE :methyl -158:sc= -0.0804 (180deg=-0.644) USER MOD Single : A 31 ASN : amide:sc= -3.88! C(o=-3.9!,f=-3.8!) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ -134:sc= -0.0493 (180deg=-0.367) USER MOD Single : A 42 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot 16:sc= 0.246 USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 GLN : amide:sc= -1.28 K(o=-1.3,f=-0.24) USER MOD Single : A 61 THR OG1 : rot 19:sc= 0.915 USER MOD Single : A 63 GLN : amide:sc= -6.88 X(o=-6.9,f=-6.6!) USER MOD Single : A 64 HIS : no HD1:sc= -1.11 X(o=-1.1,f=-1.4) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ -137:sc= -0.892! (180deg=-1.23!) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 HIS : no HD1:sc= -2.56! K(o=-2.6!,f=-1.5) USER MOD Single : A 81 THR OG1 : rot 180:sc=-0.00779 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc= -8.53! K(o=-8.5!,f=-4.2) USER MOD Single : A 105 MET CE :methyl -164:sc= -0.0905 (180deg=-0.494) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= 0 K(o=0,f=0.63) USER MOD Single : A 119 ASN : amide:sc= -4.86! C(o=-4.9!,f=-10!) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 APC O2' : rot 3:sc= 0.347 USER MOD Single : A 130 APC O3' : rot -112:sc= -0.762! USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 14.708 14.698 8.440 1.00 0.00 N ATOM 2 CA MET A 1 15.304 15.720 7.534 1.00 0.00 C ATOM 3 C MET A 1 15.790 15.040 6.253 1.00 0.00 C ATOM 4 O MET A 1 16.608 15.570 5.526 1.00 0.00 O ATOM 5 CB MET A 1 16.480 16.403 8.236 1.00 0.00 C ATOM 6 CG MET A 1 17.645 15.419 8.367 1.00 0.00 C ATOM 7 SD MET A 1 19.052 16.252 9.142 1.00 0.00 S ATOM 8 CE MET A 1 18.424 16.215 10.838 1.00 0.00 C ATOM 0 H1 MET A 1 14.856 14.982 9.429 1.00 0.00 H new ATOM 0 H2 MET A 1 13.688 14.619 8.251 1.00 0.00 H new ATOM 0 H3 MET A 1 15.163 13.778 8.272 1.00 0.00 H new ATOM 0 HA MET A 1 14.553 16.469 7.283 1.00 0.00 H new ATOM 0 HB2 MET A 1 16.794 17.280 7.670 1.00 0.00 H new ATOM 0 HB3 MET A 1 16.174 16.753 9.222 1.00 0.00 H new ATOM 0 HG2 MET A 1 17.343 14.559 8.965 1.00 0.00 H new ATOM 0 HG3 MET A 1 17.928 15.041 7.385 1.00 0.00 H new ATOM 0 HE1 MET A 1 18.176 17.228 11.156 1.00 0.00 H new ATOM 0 HE2 MET A 1 17.531 15.592 10.882 1.00 0.00 H new ATOM 0 HE3 MET A 1 19.186 15.803 11.499 1.00 0.00 H new ATOM 20 N LYS A 2 15.285 13.870 5.969 1.00 0.00 N ATOM 21 CA LYS A 2 15.707 13.150 4.735 1.00 0.00 C ATOM 22 C LYS A 2 14.471 12.544 4.060 1.00 0.00 C ATOM 23 O LYS A 2 13.353 12.925 4.345 1.00 0.00 O ATOM 24 CB LYS A 2 16.698 12.043 5.107 1.00 0.00 C ATOM 25 CG LYS A 2 16.206 11.308 6.355 1.00 0.00 C ATOM 26 CD LYS A 2 14.886 10.595 6.052 1.00 0.00 C ATOM 27 CE LYS A 2 14.585 9.591 7.167 1.00 0.00 C ATOM 28 NZ LYS A 2 15.498 8.419 7.043 1.00 0.00 N ATOM 0 H LYS A 2 14.596 13.381 6.541 1.00 0.00 H new ATOM 0 HA LYS A 2 16.190 13.843 4.046 1.00 0.00 H new ATOM 0 HB2 LYS A 2 16.803 11.343 4.279 1.00 0.00 H new ATOM 0 HB3 LYS A 2 17.684 12.471 5.290 1.00 0.00 H new ATOM 0 HG2 LYS A 2 16.954 10.585 6.680 1.00 0.00 H new ATOM 0 HG3 LYS A 2 16.068 12.015 7.173 1.00 0.00 H new ATOM 0 HD2 LYS A 2 14.077 11.321 5.973 1.00 0.00 H new ATOM 0 HD3 LYS A 2 14.949 10.082 5.092 1.00 0.00 H new ATOM 0 HE2 LYS A 2 14.714 10.064 8.141 1.00 0.00 H new ATOM 0 HE3 LYS A 2 13.547 9.264 7.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 15.079 7.600 7.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 15.638 8.193 6.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 16.415 8.646 7.478 1.00 0.00 H new ATOM 42 N LYS A 3 14.658 11.613 3.163 1.00 0.00 N ATOM 43 CA LYS A 3 13.487 11.002 2.471 1.00 0.00 C ATOM 44 C LYS A 3 13.298 9.547 2.943 1.00 0.00 C ATOM 45 O LYS A 3 14.225 8.889 3.368 1.00 0.00 O ATOM 46 CB LYS A 3 13.728 11.067 0.951 1.00 0.00 C ATOM 47 CG LYS A 3 13.158 9.830 0.249 1.00 0.00 C ATOM 48 CD LYS A 3 14.196 8.710 0.293 1.00 0.00 C ATOM 49 CE LYS A 3 14.510 8.242 -1.129 1.00 0.00 C ATOM 50 NZ LYS A 3 14.919 9.411 -1.958 1.00 0.00 N ATOM 0 H LYS A 3 15.568 11.250 2.880 1.00 0.00 H new ATOM 0 HA LYS A 3 12.576 11.549 2.712 1.00 0.00 H new ATOM 0 HB2 LYS A 3 13.264 11.966 0.544 1.00 0.00 H new ATOM 0 HB3 LYS A 3 14.797 11.142 0.752 1.00 0.00 H new ATOM 0 HG2 LYS A 3 12.238 9.510 0.738 1.00 0.00 H new ATOM 0 HG3 LYS A 3 12.904 10.067 -0.784 1.00 0.00 H new ATOM 0 HD2 LYS A 3 15.105 9.063 0.779 1.00 0.00 H new ATOM 0 HD3 LYS A 3 13.820 7.876 0.886 1.00 0.00 H new ATOM 0 HE2 LYS A 3 15.307 7.499 -1.111 1.00 0.00 H new ATOM 0 HE3 LYS A 3 13.635 7.761 -1.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 15.695 9.132 -2.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 14.109 9.736 -2.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 15.239 10.182 -1.337 1.00 0.00 H new ATOM 64 N LEU A 4 12.088 9.056 2.862 1.00 0.00 N ATOM 65 CA LEU A 4 11.787 7.655 3.290 1.00 0.00 C ATOM 66 C LEU A 4 10.835 7.039 2.258 1.00 0.00 C ATOM 67 O LEU A 4 9.808 7.597 1.989 1.00 0.00 O ATOM 68 CB LEU A 4 11.102 7.708 4.674 1.00 0.00 C ATOM 69 CG LEU A 4 10.226 6.488 4.927 1.00 0.00 C ATOM 70 CD1 LEU A 4 8.914 6.596 4.144 1.00 0.00 C ATOM 71 CD2 LEU A 4 10.974 5.206 4.551 1.00 0.00 C ATOM 0 H LEU A 4 11.283 9.575 2.512 1.00 0.00 H new ATOM 0 HA LEU A 4 12.695 7.056 3.357 1.00 0.00 H new ATOM 0 HB2 LEU A 4 11.862 7.775 5.452 1.00 0.00 H new ATOM 0 HB3 LEU A 4 10.495 8.610 4.743 1.00 0.00 H new ATOM 0 HG LEU A 4 9.987 6.449 5.990 1.00 0.00 H new ATOM 0 HD11 LEU A 4 8.301 5.715 4.337 1.00 0.00 H new ATOM 0 HD12 LEU A 4 8.375 7.489 4.459 1.00 0.00 H new ATOM 0 HD13 LEU A 4 9.131 6.660 3.078 1.00 0.00 H new ATOM 0 HD21 LEU A 4 10.334 4.343 4.738 1.00 0.00 H new ATOM 0 HD22 LEU A 4 11.242 5.237 3.495 1.00 0.00 H new ATOM 0 HD23 LEU A 4 11.879 5.123 5.152 1.00 0.00 H new ATOM 83 N GLN A 5 11.142 5.905 1.680 1.00 0.00 N ATOM 84 CA GLN A 5 10.188 5.321 0.680 1.00 0.00 C ATOM 85 C GLN A 5 9.292 4.286 1.353 1.00 0.00 C ATOM 86 O GLN A 5 9.564 3.820 2.438 1.00 0.00 O ATOM 87 CB GLN A 5 10.945 4.643 -0.460 1.00 0.00 C ATOM 88 CG GLN A 5 11.885 5.659 -1.106 1.00 0.00 C ATOM 89 CD GLN A 5 13.321 5.383 -0.654 1.00 0.00 C ATOM 90 OE1 GLN A 5 13.759 5.881 0.363 1.00 0.00 O ATOM 91 NE2 GLN A 5 14.078 4.597 -1.370 1.00 0.00 N ATOM 0 H GLN A 5 11.991 5.366 1.850 1.00 0.00 H new ATOM 0 HA GLN A 5 9.584 6.135 0.279 1.00 0.00 H new ATOM 0 HB2 GLN A 5 11.512 3.793 -0.082 1.00 0.00 H new ATOM 0 HB3 GLN A 5 10.244 4.255 -1.199 1.00 0.00 H new ATOM 0 HG2 GLN A 5 11.816 5.596 -2.192 1.00 0.00 H new ATOM 0 HG3 GLN A 5 11.592 6.671 -0.826 1.00 0.00 H new ATOM 0 HE21 GLN A 5 13.713 4.177 -2.225 1.00 0.00 H new ATOM 0 HE22 GLN A 5 15.035 4.403 -1.075 1.00 0.00 H new ATOM 100 N ILE A 6 8.223 3.922 0.705 1.00 0.00 N ATOM 101 CA ILE A 6 7.299 2.918 1.292 1.00 0.00 C ATOM 102 C ILE A 6 6.991 1.849 0.242 1.00 0.00 C ATOM 103 O ILE A 6 6.415 2.127 -0.791 1.00 0.00 O ATOM 104 CB ILE A 6 6.009 3.633 1.728 1.00 0.00 C ATOM 105 CG1 ILE A 6 6.170 4.099 3.191 1.00 0.00 C ATOM 106 CG2 ILE A 6 4.790 2.703 1.580 1.00 0.00 C ATOM 107 CD1 ILE A 6 5.207 3.350 4.131 1.00 0.00 C ATOM 0 H ILE A 6 7.949 4.279 -0.210 1.00 0.00 H new ATOM 0 HA ILE A 6 7.753 2.438 2.159 1.00 0.00 H new ATOM 0 HB ILE A 6 5.838 4.498 1.087 1.00 0.00 H new ATOM 0 HG12 ILE A 6 7.198 3.935 3.515 1.00 0.00 H new ATOM 0 HG13 ILE A 6 5.983 5.171 3.255 1.00 0.00 H new ATOM 0 HG21 ILE A 6 3.890 3.231 1.894 1.00 0.00 H new ATOM 0 HG22 ILE A 6 4.688 2.400 0.538 1.00 0.00 H new ATOM 0 HG23 ILE A 6 4.929 1.819 2.203 1.00 0.00 H new ATOM 0 HD11 ILE A 6 5.348 3.703 5.153 1.00 0.00 H new ATOM 0 HD12 ILE A 6 4.179 3.536 3.821 1.00 0.00 H new ATOM 0 HD13 ILE A 6 5.412 2.280 4.085 1.00 0.00 H new ATOM 119 N ALA A 7 7.353 0.626 0.506 1.00 0.00 N ATOM 120 CA ALA A 7 7.056 -0.454 -0.469 1.00 0.00 C ATOM 121 C ALA A 7 5.652 -0.978 -0.183 1.00 0.00 C ATOM 122 O ALA A 7 5.466 -2.122 0.185 1.00 0.00 O ATOM 123 CB ALA A 7 8.072 -1.586 -0.314 1.00 0.00 C ATOM 0 H ALA A 7 7.840 0.330 1.352 1.00 0.00 H new ATOM 0 HA ALA A 7 7.116 -0.070 -1.487 1.00 0.00 H new ATOM 0 HB1 ALA A 7 7.849 -2.376 -1.032 1.00 0.00 H new ATOM 0 HB2 ALA A 7 9.076 -1.202 -0.497 1.00 0.00 H new ATOM 0 HB3 ALA A 7 8.016 -1.989 0.697 1.00 0.00 H new ATOM 129 N VAL A 8 4.659 -0.143 -0.331 1.00 0.00 N ATOM 130 CA VAL A 8 3.269 -0.594 -0.046 1.00 0.00 C ATOM 131 C VAL A 8 2.743 -1.421 -1.221 1.00 0.00 C ATOM 132 O VAL A 8 2.596 -2.619 -1.124 1.00 0.00 O ATOM 133 CB VAL A 8 2.344 0.615 0.202 1.00 0.00 C ATOM 134 CG1 VAL A 8 2.645 1.747 -0.785 1.00 0.00 C ATOM 135 CG2 VAL A 8 0.879 0.185 0.041 1.00 0.00 C ATOM 0 H VAL A 8 4.750 0.826 -0.635 1.00 0.00 H new ATOM 0 HA VAL A 8 3.280 -1.209 0.854 1.00 0.00 H new ATOM 0 HB VAL A 8 2.520 0.977 1.215 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.979 2.587 -0.589 1.00 0.00 H new ATOM 0 HG12 VAL A 8 3.680 2.068 -0.666 1.00 0.00 H new ATOM 0 HG13 VAL A 8 2.491 1.392 -1.804 1.00 0.00 H new ATOM 0 HG21 VAL A 8 0.227 1.041 0.217 1.00 0.00 H new ATOM 0 HG22 VAL A 8 0.719 -0.191 -0.969 1.00 0.00 H new ATOM 0 HG23 VAL A 8 0.649 -0.600 0.761 1.00 0.00 H new ATOM 145 N GLY A 9 2.440 -0.809 -2.326 1.00 0.00 N ATOM 146 CA GLY A 9 1.908 -1.601 -3.456 1.00 0.00 C ATOM 147 C GLY A 9 0.663 -2.321 -2.978 1.00 0.00 C ATOM 148 O GLY A 9 0.712 -3.442 -2.511 1.00 0.00 O ATOM 0 H GLY A 9 2.537 0.193 -2.493 1.00 0.00 H new ATOM 0 HA2 GLY A 9 1.673 -0.952 -4.299 1.00 0.00 H new ATOM 0 HA3 GLY A 9 2.653 -2.317 -3.803 1.00 0.00 H new ATOM 152 N ILE A 10 -0.455 -1.674 -3.080 1.00 0.00 N ATOM 153 CA ILE A 10 -1.713 -2.312 -2.615 1.00 0.00 C ATOM 154 C ILE A 10 -1.759 -3.717 -3.185 1.00 0.00 C ATOM 155 O ILE A 10 -0.967 -4.079 -4.031 1.00 0.00 O ATOM 156 CB ILE A 10 -2.959 -1.527 -3.060 1.00 0.00 C ATOM 157 CG1 ILE A 10 -2.576 -0.113 -3.510 1.00 0.00 C ATOM 158 CG2 ILE A 10 -3.927 -1.427 -1.874 1.00 0.00 C ATOM 159 CD1 ILE A 10 -3.831 0.639 -3.958 1.00 0.00 C ATOM 0 H ILE A 10 -0.556 -0.734 -3.463 1.00 0.00 H new ATOM 0 HA ILE A 10 -1.721 -2.327 -1.525 1.00 0.00 H new ATOM 0 HB ILE A 10 -3.426 -2.047 -3.897 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -2.092 0.421 -2.693 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -1.858 -0.163 -4.328 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -4.816 -0.872 -2.175 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -4.215 -2.428 -1.554 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -3.439 -0.909 -1.049 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -3.558 1.645 -4.278 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -4.296 0.108 -4.788 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -4.534 0.701 -3.127 1.00 0.00 H new ATOM 171 N ILE A 11 -2.655 -4.522 -2.720 1.00 0.00 N ATOM 172 CA ILE A 11 -2.720 -5.911 -3.229 1.00 0.00 C ATOM 173 C ILE A 11 -4.161 -6.244 -3.606 1.00 0.00 C ATOM 174 O ILE A 11 -4.950 -6.658 -2.781 1.00 0.00 O ATOM 175 CB ILE A 11 -2.222 -6.861 -2.136 1.00 0.00 C ATOM 176 CG1 ILE A 11 -2.600 -6.292 -0.770 1.00 0.00 C ATOM 177 CG2 ILE A 11 -0.699 -6.978 -2.216 1.00 0.00 C ATOM 178 CD1 ILE A 11 -1.951 -7.131 0.330 1.00 0.00 C ATOM 0 H ILE A 11 -3.347 -4.282 -2.010 1.00 0.00 H new ATOM 0 HA ILE A 11 -2.092 -6.020 -4.114 1.00 0.00 H new ATOM 0 HB ILE A 11 -2.675 -7.843 -2.274 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -2.272 -5.255 -0.693 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -3.684 -6.293 -0.651 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -0.345 -7.654 -1.438 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -0.415 -7.369 -3.193 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -0.251 -5.995 -2.074 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -2.221 -6.725 1.305 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -2.301 -8.161 0.257 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -0.867 -7.107 0.214 1.00 0.00 H new ATOM 190 N ARG A 12 -4.498 -6.073 -4.854 1.00 0.00 N ATOM 191 CA ARG A 12 -5.885 -6.377 -5.314 1.00 0.00 C ATOM 192 C ARG A 12 -6.006 -7.887 -5.407 1.00 0.00 C ATOM 193 O ARG A 12 -5.065 -8.596 -5.107 1.00 0.00 O ATOM 194 CB ARG A 12 -6.116 -5.716 -6.675 1.00 0.00 C ATOM 195 CG ARG A 12 -5.397 -4.369 -6.662 1.00 0.00 C ATOM 196 CD ARG A 12 -5.989 -3.401 -7.699 1.00 0.00 C ATOM 197 NE ARG A 12 -6.096 -4.095 -9.018 1.00 0.00 N ATOM 198 CZ ARG A 12 -6.719 -3.524 -10.015 1.00 0.00 C ATOM 199 NH1 ARG A 12 -8.022 -3.550 -10.077 1.00 0.00 N ATOM 200 NH2 ARG A 12 -6.035 -2.927 -10.953 1.00 0.00 N ATOM 0 H ARG A 12 -3.869 -5.733 -5.581 1.00 0.00 H new ATOM 0 HA ARG A 12 -6.635 -5.991 -4.624 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -5.733 -6.347 -7.477 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -7.182 -5.579 -6.858 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -5.469 -3.927 -5.668 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -4.337 -4.520 -6.868 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -6.972 -3.059 -7.374 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -5.358 -2.517 -7.790 1.00 0.00 H new ATOM 0 HE ARG A 12 -5.681 -5.019 -9.141 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -8.558 -4.017 -9.346 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -8.504 -3.103 -10.857 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -5.016 -2.907 -10.907 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -6.519 -2.481 -11.732 1.00 0.00 H new ATOM 214 N ASN A 13 -7.145 -8.420 -5.740 1.00 0.00 N ATOM 215 CA ASN A 13 -7.218 -9.900 -5.730 1.00 0.00 C ATOM 216 C ASN A 13 -8.235 -10.494 -6.727 1.00 0.00 C ATOM 217 O ASN A 13 -7.866 -11.253 -7.568 1.00 0.00 O ATOM 218 CB ASN A 13 -7.532 -10.306 -4.281 1.00 0.00 C ATOM 219 CG ASN A 13 -8.696 -11.304 -4.202 1.00 0.00 C ATOM 220 OD1 ASN A 13 -9.654 -11.080 -3.489 1.00 0.00 O ATOM 221 ND2 ASN A 13 -8.647 -12.404 -4.904 1.00 0.00 N ATOM 0 H ASN A 13 -7.993 -7.920 -6.007 1.00 0.00 H new ATOM 0 HA ASN A 13 -6.266 -10.309 -6.069 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -6.644 -10.748 -3.828 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -7.777 -9.417 -3.700 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -9.413 -13.076 -4.854 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -7.843 -12.592 -5.502 1.00 0.00 H new ATOM 228 N GLU A 14 -9.500 -10.214 -6.637 1.00 0.00 N ATOM 229 CA GLU A 14 -10.454 -10.894 -7.584 1.00 0.00 C ATOM 230 C GLU A 14 -10.677 -10.053 -8.836 1.00 0.00 C ATOM 231 O GLU A 14 -10.907 -10.558 -9.916 1.00 0.00 O ATOM 232 CB GLU A 14 -11.787 -11.088 -6.859 1.00 0.00 C ATOM 233 CG GLU A 14 -12.736 -11.925 -7.719 1.00 0.00 C ATOM 234 CD GLU A 14 -13.036 -13.243 -7.002 1.00 0.00 C ATOM 235 OE1 GLU A 14 -12.092 -13.930 -6.649 1.00 0.00 O ATOM 236 OE2 GLU A 14 -14.205 -13.541 -6.817 1.00 0.00 O ATOM 0 H GLU A 14 -9.919 -9.564 -5.972 1.00 0.00 H new ATOM 0 HA GLU A 14 -10.034 -11.852 -7.892 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -11.621 -11.582 -5.901 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -12.237 -10.119 -6.644 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -13.661 -11.377 -7.900 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -12.286 -12.121 -8.692 1.00 0.00 H new ATOM 243 N ASN A 15 -10.576 -8.788 -8.693 1.00 0.00 N ATOM 244 CA ASN A 15 -10.734 -7.862 -9.845 1.00 0.00 C ATOM 245 C ASN A 15 -10.118 -6.562 -9.388 1.00 0.00 C ATOM 246 O ASN A 15 -9.356 -5.914 -10.076 1.00 0.00 O ATOM 247 CB ASN A 15 -12.218 -7.669 -10.171 1.00 0.00 C ATOM 248 CG ASN A 15 -12.360 -7.118 -11.591 1.00 0.00 C ATOM 249 OD1 ASN A 15 -11.434 -6.546 -12.130 1.00 0.00 O ATOM 250 ND2 ASN A 15 -13.489 -7.269 -12.227 1.00 0.00 N ATOM 0 H ASN A 15 -10.385 -8.327 -7.803 1.00 0.00 H new ATOM 0 HA ASN A 15 -10.259 -8.243 -10.749 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -12.747 -8.618 -10.083 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -12.672 -6.983 -9.456 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -13.593 -6.907 -13.175 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -14.268 -7.749 -11.776 1.00 0.00 H new ATOM 257 N ASN A 16 -10.428 -6.229 -8.178 1.00 0.00 N ATOM 258 CA ASN A 16 -9.883 -5.032 -7.538 1.00 0.00 C ATOM 259 C ASN A 16 -9.996 -5.281 -6.044 1.00 0.00 C ATOM 260 O ASN A 16 -10.236 -4.377 -5.272 1.00 0.00 O ATOM 261 CB ASN A 16 -10.698 -3.798 -7.938 1.00 0.00 C ATOM 262 CG ASN A 16 -9.799 -2.560 -7.936 1.00 0.00 C ATOM 263 OD1 ASN A 16 -9.840 -1.763 -8.853 1.00 0.00 O ATOM 264 ND2 ASN A 16 -8.982 -2.360 -6.937 1.00 0.00 N ATOM 0 H ASN A 16 -11.064 -6.766 -7.588 1.00 0.00 H new ATOM 0 HA ASN A 16 -8.852 -4.846 -7.838 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -11.131 -3.942 -8.928 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -11.527 -3.658 -7.244 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -8.380 -1.537 -6.927 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -8.946 -3.027 -6.166 1.00 0.00 H new ATOM 271 N GLU A 17 -9.841 -6.521 -5.617 1.00 0.00 N ATOM 272 CA GLU A 17 -9.966 -6.777 -4.162 1.00 0.00 C ATOM 273 C GLU A 17 -8.647 -6.438 -3.488 1.00 0.00 C ATOM 274 O GLU A 17 -7.785 -7.275 -3.310 1.00 0.00 O ATOM 275 CB GLU A 17 -10.356 -8.232 -3.904 1.00 0.00 C ATOM 276 CG GLU A 17 -11.659 -8.535 -4.651 1.00 0.00 C ATOM 277 CD GLU A 17 -12.397 -9.691 -3.971 1.00 0.00 C ATOM 278 OE1 GLU A 17 -11.895 -10.801 -4.018 1.00 0.00 O ATOM 279 OE2 GLU A 17 -13.455 -9.446 -3.416 1.00 0.00 O ATOM 0 H GLU A 17 -9.640 -7.333 -6.201 1.00 0.00 H new ATOM 0 HA GLU A 17 -10.753 -6.149 -3.745 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -9.564 -8.900 -4.241 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -10.485 -8.404 -2.835 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -12.293 -7.648 -4.668 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -11.442 -8.791 -5.688 1.00 0.00 H new ATOM 286 N ILE A 18 -8.485 -5.199 -3.116 1.00 0.00 N ATOM 287 CA ILE A 18 -7.225 -4.784 -2.458 1.00 0.00 C ATOM 288 C ILE A 18 -7.267 -5.181 -0.991 1.00 0.00 C ATOM 289 O ILE A 18 -8.305 -5.168 -0.363 1.00 0.00 O ATOM 290 CB ILE A 18 -7.053 -3.261 -2.541 1.00 0.00 C ATOM 291 CG1 ILE A 18 -8.409 -2.567 -2.301 1.00 0.00 C ATOM 292 CG2 ILE A 18 -6.480 -2.875 -3.908 1.00 0.00 C ATOM 293 CD1 ILE A 18 -9.088 -2.211 -3.630 1.00 0.00 C ATOM 0 H ILE A 18 -9.175 -4.458 -3.241 1.00 0.00 H new ATOM 0 HA ILE A 18 -6.393 -5.273 -2.964 1.00 0.00 H new ATOM 0 HB ILE A 18 -6.356 -2.933 -1.770 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -9.059 -3.222 -1.721 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -8.259 -1.663 -1.711 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -6.361 -1.793 -3.960 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -5.511 -3.354 -4.045 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -7.161 -3.203 -4.694 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -10.042 -1.723 -3.432 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -8.446 -1.537 -4.197 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -9.258 -3.120 -4.206 1.00 0.00 H new ATOM 305 N PHE A 19 -6.137 -5.496 -0.432 1.00 0.00 N ATOM 306 CA PHE A 19 -6.086 -5.840 1.023 1.00 0.00 C ATOM 307 C PHE A 19 -6.050 -4.515 1.803 1.00 0.00 C ATOM 308 O PHE A 19 -5.254 -4.328 2.701 1.00 0.00 O ATOM 309 CB PHE A 19 -4.815 -6.646 1.308 1.00 0.00 C ATOM 310 CG PHE A 19 -4.922 -7.341 2.646 1.00 0.00 C ATOM 311 CD1 PHE A 19 -6.076 -8.061 2.977 1.00 0.00 C ATOM 312 CD2 PHE A 19 -3.858 -7.273 3.552 1.00 0.00 C ATOM 313 CE1 PHE A 19 -6.165 -8.710 4.215 1.00 0.00 C ATOM 314 CE2 PHE A 19 -3.949 -7.922 4.790 1.00 0.00 C ATOM 315 CZ PHE A 19 -5.102 -8.639 5.121 1.00 0.00 C ATOM 0 H PHE A 19 -5.240 -5.532 -0.916 1.00 0.00 H new ATOM 0 HA PHE A 19 -6.950 -6.436 1.318 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -4.659 -7.382 0.520 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -3.948 -5.985 1.302 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -6.897 -8.116 2.278 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -2.966 -6.720 3.297 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -7.055 -9.266 4.470 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -3.128 -7.868 5.489 1.00 0.00 H new ATOM 0 HZ PHE A 19 -5.172 -9.138 6.076 1.00 0.00 H new ATOM 325 N ILE A 20 -6.887 -3.580 1.422 1.00 0.00 N ATOM 326 CA ILE A 20 -6.909 -2.245 2.065 1.00 0.00 C ATOM 327 C ILE A 20 -7.647 -2.276 3.389 1.00 0.00 C ATOM 328 O ILE A 20 -8.573 -3.030 3.600 1.00 0.00 O ATOM 329 CB ILE A 20 -7.640 -1.276 1.142 1.00 0.00 C ATOM 330 CG1 ILE A 20 -7.644 0.125 1.753 1.00 0.00 C ATOM 331 CG2 ILE A 20 -9.080 -1.750 0.955 1.00 0.00 C ATOM 332 CD1 ILE A 20 -6.241 0.719 1.663 1.00 0.00 C ATOM 0 H ILE A 20 -7.569 -3.698 0.673 1.00 0.00 H new ATOM 0 HA ILE A 20 -5.879 -1.936 2.245 1.00 0.00 H new ATOM 0 HB ILE A 20 -7.131 -1.244 0.178 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -8.355 0.762 1.227 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -7.966 0.080 2.793 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -9.607 -1.060 0.296 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -9.081 -2.746 0.513 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -9.581 -1.782 1.922 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -6.240 1.718 2.098 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -5.542 0.085 2.209 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -5.937 0.778 0.618 1.00 0.00 H new ATOM 344 N THR A 21 -7.259 -1.399 4.253 1.00 0.00 N ATOM 345 CA THR A 21 -7.931 -1.277 5.572 1.00 0.00 C ATOM 346 C THR A 21 -9.337 -0.726 5.325 1.00 0.00 C ATOM 347 O THR A 21 -9.564 0.466 5.386 1.00 0.00 O ATOM 348 CB THR A 21 -7.146 -0.292 6.426 1.00 0.00 C ATOM 349 OG1 THR A 21 -7.936 0.109 7.535 1.00 0.00 O ATOM 350 CG2 THR A 21 -6.793 0.928 5.578 1.00 0.00 C ATOM 0 H THR A 21 -6.490 -0.746 4.104 1.00 0.00 H new ATOM 0 HA THR A 21 -7.982 -2.240 6.080 1.00 0.00 H new ATOM 0 HB THR A 21 -6.233 -0.763 6.790 1.00 0.00 H new ATOM 0 HG1 THR A 21 -7.353 0.303 8.299 1.00 0.00 H new ATOM 0 HG21 THR A 21 -6.230 1.640 6.181 1.00 0.00 H new ATOM 0 HG22 THR A 21 -6.188 0.616 4.726 1.00 0.00 H new ATOM 0 HG23 THR A 21 -7.708 1.400 5.220 1.00 0.00 H new ATOM 358 N ARG A 22 -10.275 -1.572 5.013 1.00 0.00 N ATOM 359 CA ARG A 22 -11.647 -1.077 4.726 1.00 0.00 C ATOM 360 C ARG A 22 -12.378 -0.786 6.037 1.00 0.00 C ATOM 361 O ARG A 22 -13.108 -1.613 6.547 1.00 0.00 O ATOM 362 CB ARG A 22 -12.399 -2.139 3.922 1.00 0.00 C ATOM 363 CG ARG A 22 -13.861 -1.721 3.761 1.00 0.00 C ATOM 364 CD ARG A 22 -13.982 -0.716 2.616 1.00 0.00 C ATOM 365 NE ARG A 22 -15.311 -0.044 2.682 1.00 0.00 N ATOM 366 CZ ARG A 22 -15.523 1.057 2.014 1.00 0.00 C ATOM 367 NH1 ARG A 22 -14.849 2.136 2.304 1.00 0.00 N ATOM 368 NH2 ARG A 22 -16.409 1.078 1.057 1.00 0.00 N ATOM 0 H ARG A 22 -10.152 -2.582 4.944 1.00 0.00 H new ATOM 0 HA ARG A 22 -11.595 -0.155 4.148 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -11.936 -2.264 2.943 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -12.339 -3.103 4.428 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -14.480 -2.595 3.558 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -14.228 -1.279 4.687 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -13.185 0.024 2.682 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -13.867 -1.224 1.659 1.00 0.00 H new ATOM 0 HE ARG A 22 -16.056 -0.446 3.251 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -14.156 2.119 3.053 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -15.015 2.996 1.782 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -16.936 0.234 0.831 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -16.575 1.938 0.535 1.00 0.00 H new ATOM 382 N ARG A 23 -12.175 0.395 6.573 1.00 0.00 N ATOM 383 CA ARG A 23 -12.835 0.793 7.854 1.00 0.00 C ATOM 384 C ARG A 23 -13.029 -0.427 8.752 1.00 0.00 C ATOM 385 O ARG A 23 -14.138 -0.805 9.071 1.00 0.00 O ATOM 386 CB ARG A 23 -14.189 1.446 7.559 1.00 0.00 C ATOM 387 CG ARG A 23 -14.902 0.688 6.436 1.00 0.00 C ATOM 388 CD ARG A 23 -16.393 1.040 6.439 1.00 0.00 C ATOM 389 NE ARG A 23 -17.186 -0.176 6.102 1.00 0.00 N ATOM 390 CZ ARG A 23 -18.471 -0.203 6.326 1.00 0.00 C ATOM 391 NH1 ARG A 23 -19.164 0.902 6.296 1.00 0.00 N ATOM 392 NH2 ARG A 23 -19.066 -1.338 6.576 1.00 0.00 N ATOM 0 H ARG A 23 -11.570 1.110 6.169 1.00 0.00 H new ATOM 0 HA ARG A 23 -12.197 1.509 8.371 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -14.806 1.446 8.458 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -14.045 2.488 7.272 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -14.460 0.945 5.473 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -14.772 -0.386 6.570 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -16.687 1.420 7.417 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -16.593 1.831 5.716 1.00 0.00 H new ATOM 0 HE ARG A 23 -16.723 -0.989 5.695 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -18.701 1.789 6.097 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -20.169 0.879 6.471 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -18.526 -2.203 6.596 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -20.071 -1.359 6.751 1.00 0.00 H new ATOM 406 N ALA A 24 -11.951 -1.042 9.159 1.00 0.00 N ATOM 407 CA ALA A 24 -12.059 -2.238 10.037 1.00 0.00 C ATOM 408 C ALA A 24 -13.136 -1.994 11.096 1.00 0.00 C ATOM 409 O ALA A 24 -13.930 -2.861 11.403 1.00 0.00 O ATOM 410 CB ALA A 24 -10.718 -2.483 10.729 1.00 0.00 C ATOM 0 H ALA A 24 -10.999 -0.765 8.919 1.00 0.00 H new ATOM 0 HA ALA A 24 -12.325 -3.108 9.436 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -10.796 -3.359 11.373 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -9.946 -2.652 9.978 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -10.455 -1.613 11.330 1.00 0.00 H new ATOM 416 N ALA A 25 -13.170 -0.813 11.652 1.00 0.00 N ATOM 417 CA ALA A 25 -14.196 -0.503 12.687 1.00 0.00 C ATOM 418 C ALA A 25 -15.519 -0.164 11.998 1.00 0.00 C ATOM 419 O ALA A 25 -15.617 -0.170 10.787 1.00 0.00 O ATOM 420 CB ALA A 25 -13.732 0.694 13.520 1.00 0.00 C ATOM 0 H ALA A 25 -12.530 -0.049 11.433 1.00 0.00 H new ATOM 0 HA ALA A 25 -14.334 -1.366 13.339 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -14.481 0.922 14.278 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -12.786 0.454 14.006 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -13.598 1.559 12.871 1.00 0.00 H new ATOM 426 N ASP A 26 -16.536 0.136 12.756 1.00 0.00 N ATOM 427 CA ASP A 26 -17.847 0.478 12.138 1.00 0.00 C ATOM 428 C ASP A 26 -17.808 1.923 11.634 1.00 0.00 C ATOM 429 O ASP A 26 -17.726 2.857 12.406 1.00 0.00 O ATOM 430 CB ASP A 26 -18.960 0.323 13.179 1.00 0.00 C ATOM 431 CG ASP A 26 -18.835 1.427 14.230 1.00 0.00 C ATOM 432 OD1 ASP A 26 -19.404 2.486 14.019 1.00 0.00 O ATOM 433 OD2 ASP A 26 -18.175 1.194 15.229 1.00 0.00 O ATOM 0 H ASP A 26 -16.516 0.159 13.776 1.00 0.00 H new ATOM 0 HA ASP A 26 -18.043 -0.192 11.301 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -19.935 0.376 12.695 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -18.894 -0.655 13.655 1.00 0.00 H new ATOM 438 N ALA A 27 -17.859 2.112 10.344 1.00 0.00 N ATOM 439 CA ALA A 27 -17.815 3.496 9.794 1.00 0.00 C ATOM 440 C ALA A 27 -19.161 3.845 9.159 1.00 0.00 C ATOM 441 O ALA A 27 -19.564 4.991 9.134 1.00 0.00 O ATOM 442 CB ALA A 27 -16.718 3.587 8.730 1.00 0.00 C ATOM 0 H ALA A 27 -17.929 1.369 9.648 1.00 0.00 H new ATOM 0 HA ALA A 27 -17.604 4.196 10.603 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -16.685 4.599 8.327 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -15.755 3.344 9.179 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -16.932 2.883 7.926 1.00 0.00 H new ATOM 448 N HIS A 28 -19.861 2.875 8.639 1.00 0.00 N ATOM 449 CA HIS A 28 -21.173 3.176 8.003 1.00 0.00 C ATOM 450 C HIS A 28 -20.983 4.339 7.029 1.00 0.00 C ATOM 451 O HIS A 28 -21.889 5.110 6.782 1.00 0.00 O ATOM 452 CB HIS A 28 -22.181 3.578 9.083 1.00 0.00 C ATOM 453 CG HIS A 28 -23.422 2.735 8.965 1.00 0.00 C ATOM 454 ND1 HIS A 28 -23.928 2.328 7.740 1.00 0.00 N ATOM 455 CD2 HIS A 28 -24.275 2.222 9.911 1.00 0.00 C ATOM 456 CE1 HIS A 28 -25.036 1.604 7.980 1.00 0.00 C ATOM 457 NE2 HIS A 28 -25.294 1.508 9.286 1.00 0.00 N ATOM 0 H HIS A 28 -19.583 1.894 8.627 1.00 0.00 H new ATOM 0 HA HIS A 28 -21.544 2.298 7.473 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -21.738 3.452 10.071 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -22.436 4.633 8.980 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -24.171 2.353 10.978 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -25.644 1.154 7.209 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -26.070 1.017 9.730 1.00 0.00 H new ATOM 465 N MET A 29 -19.802 4.479 6.485 1.00 0.00 N ATOM 466 CA MET A 29 -19.547 5.604 5.542 1.00 0.00 C ATOM 467 C MET A 29 -18.677 5.121 4.372 1.00 0.00 C ATOM 468 O MET A 29 -19.165 4.510 3.442 1.00 0.00 O ATOM 469 CB MET A 29 -18.829 6.730 6.298 1.00 0.00 C ATOM 470 CG MET A 29 -19.852 7.742 6.824 1.00 0.00 C ATOM 471 SD MET A 29 -20.816 8.418 5.446 1.00 0.00 S ATOM 472 CE MET A 29 -19.506 9.437 4.725 1.00 0.00 C ATOM 0 H MET A 29 -19.006 3.864 6.653 1.00 0.00 H new ATOM 0 HA MET A 29 -20.493 5.972 5.143 1.00 0.00 H new ATOM 0 HB2 MET A 29 -18.256 6.315 7.127 1.00 0.00 H new ATOM 0 HB3 MET A 29 -18.119 7.228 5.638 1.00 0.00 H new ATOM 0 HG2 MET A 29 -20.516 7.261 7.542 1.00 0.00 H new ATOM 0 HG3 MET A 29 -19.341 8.548 7.352 1.00 0.00 H new ATOM 0 HE1 MET A 29 -19.951 10.227 4.120 1.00 0.00 H new ATOM 0 HE2 MET A 29 -18.911 9.882 5.522 1.00 0.00 H new ATOM 0 HE3 MET A 29 -18.866 8.816 4.098 1.00 0.00 H new ATOM 482 N ALA A 30 -17.395 5.394 4.417 1.00 0.00 N ATOM 483 CA ALA A 30 -16.471 4.972 3.324 1.00 0.00 C ATOM 484 C ALA A 30 -15.306 5.957 3.278 1.00 0.00 C ATOM 485 O ALA A 30 -15.136 6.769 4.166 1.00 0.00 O ATOM 486 CB ALA A 30 -17.185 4.976 1.970 1.00 0.00 C ATOM 0 H ALA A 30 -16.945 5.900 5.180 1.00 0.00 H new ATOM 0 HA ALA A 30 -16.120 3.959 3.522 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -16.489 4.665 1.191 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -18.028 4.285 2.001 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -17.547 5.981 1.753 1.00 0.00 H new ATOM 492 N ASN A 31 -14.491 5.889 2.259 1.00 0.00 N ATOM 493 CA ASN A 31 -13.328 6.817 2.172 1.00 0.00 C ATOM 494 C ASN A 31 -12.208 6.305 3.093 1.00 0.00 C ATOM 495 O ASN A 31 -11.103 6.809 3.082 1.00 0.00 O ATOM 496 CB ASN A 31 -13.778 8.242 2.569 1.00 0.00 C ATOM 497 CG ASN A 31 -13.173 8.667 3.916 1.00 0.00 C ATOM 498 OD1 ASN A 31 -11.970 8.754 4.053 1.00 0.00 O ATOM 499 ND2 ASN A 31 -13.964 8.934 4.919 1.00 0.00 N ATOM 0 H ASN A 31 -14.581 5.231 1.484 1.00 0.00 H new ATOM 0 HA ASN A 31 -12.945 6.855 1.152 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -13.478 8.949 1.795 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -14.866 8.278 2.630 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -13.571 9.216 5.817 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -14.975 8.861 4.805 1.00 0.00 H new ATOM 506 N LYS A 32 -12.502 5.313 3.892 1.00 0.00 N ATOM 507 CA LYS A 32 -11.490 4.749 4.824 1.00 0.00 C ATOM 508 C LYS A 32 -10.614 3.726 4.086 1.00 0.00 C ATOM 509 O LYS A 32 -10.505 2.581 4.482 1.00 0.00 O ATOM 510 CB LYS A 32 -12.233 4.081 5.979 1.00 0.00 C ATOM 511 CG LYS A 32 -11.235 3.506 6.987 1.00 0.00 C ATOM 512 CD LYS A 32 -10.182 4.560 7.326 1.00 0.00 C ATOM 513 CE LYS A 32 -9.178 3.977 8.324 1.00 0.00 C ATOM 514 NZ LYS A 32 -9.024 4.910 9.474 1.00 0.00 N ATOM 0 H LYS A 32 -13.417 4.865 3.936 1.00 0.00 H new ATOM 0 HA LYS A 32 -10.841 5.537 5.206 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -12.882 4.806 6.471 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -12.874 3.287 5.597 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -11.756 3.194 7.892 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -10.756 2.619 6.573 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -9.667 4.879 6.420 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -10.660 5.444 7.749 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -9.521 3.004 8.675 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -8.215 3.820 7.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -8.342 4.515 10.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -8.679 5.829 9.131 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -9.944 5.038 9.942 1.00 0.00 H new ATOM 528 N LEU A 33 -9.998 4.132 3.013 1.00 0.00 N ATOM 529 CA LEU A 33 -9.132 3.200 2.227 1.00 0.00 C ATOM 530 C LEU A 33 -7.701 3.763 2.194 1.00 0.00 C ATOM 531 O LEU A 33 -7.368 4.569 1.352 1.00 0.00 O ATOM 532 CB LEU A 33 -9.692 3.101 0.797 1.00 0.00 C ATOM 533 CG LEU A 33 -11.040 2.363 0.794 1.00 0.00 C ATOM 534 CD1 LEU A 33 -11.282 1.767 -0.594 1.00 0.00 C ATOM 535 CD2 LEU A 33 -11.043 1.234 1.831 1.00 0.00 C ATOM 0 H LEU A 33 -10.056 5.079 2.640 1.00 0.00 H new ATOM 0 HA LEU A 33 -9.118 2.210 2.682 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -9.817 4.100 0.380 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -8.982 2.576 0.158 1.00 0.00 H new ATOM 0 HG LEU A 33 -11.828 3.073 1.046 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -12.237 1.242 -0.603 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -11.300 2.566 -1.335 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -10.481 1.068 -0.834 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -12.007 0.725 1.812 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -10.252 0.522 1.596 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -10.873 1.651 2.824 1.00 0.00 H new ATOM 547 N GLU A 34 -6.855 3.360 3.112 1.00 0.00 N ATOM 548 CA GLU A 34 -5.460 3.905 3.136 1.00 0.00 C ATOM 549 C GLU A 34 -4.529 3.060 2.252 1.00 0.00 C ATOM 550 O GLU A 34 -4.804 2.843 1.089 1.00 0.00 O ATOM 551 CB GLU A 34 -4.954 3.912 4.582 1.00 0.00 C ATOM 552 CG GLU A 34 -3.734 4.831 4.691 1.00 0.00 C ATOM 553 CD GLU A 34 -2.757 4.265 5.723 1.00 0.00 C ATOM 554 OE1 GLU A 34 -2.898 4.598 6.888 1.00 0.00 O ATOM 555 OE2 GLU A 34 -1.887 3.505 5.332 1.00 0.00 O ATOM 0 H GLU A 34 -7.068 2.681 3.842 1.00 0.00 H new ATOM 0 HA GLU A 34 -5.465 4.921 2.742 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -5.742 4.255 5.253 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -4.690 2.901 4.891 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -3.244 4.919 3.721 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -4.046 5.834 4.982 1.00 0.00 H new ATOM 562 N PHE A 35 -3.421 2.589 2.780 1.00 0.00 N ATOM 563 CA PHE A 35 -2.492 1.774 1.943 1.00 0.00 C ATOM 564 C PHE A 35 -1.567 0.940 2.836 1.00 0.00 C ATOM 565 O PHE A 35 -0.920 1.469 3.718 1.00 0.00 O ATOM 566 CB PHE A 35 -1.623 2.693 1.082 1.00 0.00 C ATOM 567 CG PHE A 35 -2.484 3.490 0.140 1.00 0.00 C ATOM 568 CD1 PHE A 35 -2.925 2.918 -1.060 1.00 0.00 C ATOM 569 CD2 PHE A 35 -2.836 4.805 0.462 1.00 0.00 C ATOM 570 CE1 PHE A 35 -3.717 3.664 -1.938 1.00 0.00 C ATOM 571 CE2 PHE A 35 -3.630 5.549 -0.415 1.00 0.00 C ATOM 572 CZ PHE A 35 -4.068 4.978 -1.615 1.00 0.00 C ATOM 0 H PHE A 35 -3.126 2.734 3.745 1.00 0.00 H new ATOM 0 HA PHE A 35 -3.090 1.118 1.311 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -1.050 3.366 1.720 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -0.904 2.101 0.516 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -2.654 1.902 -1.307 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -2.495 5.245 1.387 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -4.057 3.226 -2.865 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -3.905 6.563 -0.167 1.00 0.00 H new ATOM 0 HZ PHE A 35 -4.679 5.554 -2.294 1.00 0.00 H new ATOM 582 N PRO A 36 -1.510 -0.338 2.559 1.00 0.00 N ATOM 583 CA PRO A 36 -0.642 -1.264 3.308 1.00 0.00 C ATOM 584 C PRO A 36 0.831 -0.896 3.076 1.00 0.00 C ATOM 585 O PRO A 36 1.420 -1.267 2.081 1.00 0.00 O ATOM 586 CB PRO A 36 -0.956 -2.645 2.719 1.00 0.00 C ATOM 587 CG PRO A 36 -1.900 -2.438 1.507 1.00 0.00 C ATOM 588 CD PRO A 36 -2.311 -0.964 1.490 1.00 0.00 C ATOM 0 HA PRO A 36 -0.813 -1.231 4.384 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -0.039 -3.145 2.408 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -1.429 -3.281 3.467 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -1.396 -2.706 0.578 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -2.777 -3.080 1.590 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -2.105 -0.507 0.522 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -3.379 -0.849 1.676 1.00 0.00 H new ATOM 596 N GLY A 37 1.422 -0.157 3.980 1.00 0.00 N ATOM 597 CA GLY A 37 2.847 0.253 3.814 1.00 0.00 C ATOM 598 C GLY A 37 3.752 -0.970 3.618 1.00 0.00 C ATOM 599 O GLY A 37 3.338 -2.002 3.133 1.00 0.00 O ATOM 0 H GLY A 37 0.974 0.182 4.832 1.00 0.00 H new ATOM 0 HA2 GLY A 37 2.940 0.920 2.957 1.00 0.00 H new ATOM 0 HA3 GLY A 37 3.172 0.814 4.690 1.00 0.00 H new ATOM 603 N GLY A 38 4.996 -0.842 3.992 1.00 0.00 N ATOM 604 CA GLY A 38 5.962 -1.968 3.833 1.00 0.00 C ATOM 605 C GLY A 38 7.381 -1.414 3.967 1.00 0.00 C ATOM 606 O GLY A 38 8.270 -2.069 4.479 1.00 0.00 O ATOM 0 H GLY A 38 5.389 0.004 4.405 1.00 0.00 H new ATOM 0 HA2 GLY A 38 5.781 -2.732 4.589 1.00 0.00 H new ATOM 0 HA3 GLY A 38 5.832 -2.444 2.861 1.00 0.00 H new ATOM 610 N LYS A 39 7.585 -0.200 3.517 1.00 0.00 N ATOM 611 CA LYS A 39 8.930 0.441 3.611 1.00 0.00 C ATOM 612 C LYS A 39 9.933 -0.302 2.729 1.00 0.00 C ATOM 613 O LYS A 39 10.452 -1.330 3.098 1.00 0.00 O ATOM 614 CB LYS A 39 9.411 0.418 5.064 1.00 0.00 C ATOM 615 CG LYS A 39 10.890 0.819 5.127 1.00 0.00 C ATOM 616 CD LYS A 39 11.028 2.313 4.833 1.00 0.00 C ATOM 617 CE LYS A 39 12.471 2.625 4.426 1.00 0.00 C ATOM 618 NZ LYS A 39 13.278 2.924 5.642 1.00 0.00 N ATOM 0 H LYS A 39 6.866 0.380 3.083 1.00 0.00 H new ATOM 0 HA LYS A 39 8.853 1.473 3.268 1.00 0.00 H new ATOM 0 HB2 LYS A 39 8.813 1.102 5.666 1.00 0.00 H new ATOM 0 HB3 LYS A 39 9.276 -0.578 5.486 1.00 0.00 H new ATOM 0 HG2 LYS A 39 11.297 0.593 6.112 1.00 0.00 H new ATOM 0 HG3 LYS A 39 11.465 0.241 4.404 1.00 0.00 H new ATOM 0 HD2 LYS A 39 10.344 2.602 4.035 1.00 0.00 H new ATOM 0 HD3 LYS A 39 10.754 2.894 5.714 1.00 0.00 H new ATOM 0 HE2 LYS A 39 12.900 1.778 3.891 1.00 0.00 H new ATOM 0 HE3 LYS A 39 12.492 3.476 3.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 13.852 3.776 5.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 12.643 3.085 6.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 13.904 2.120 5.850 1.00 0.00 H new ATOM 632 N ILE A 40 10.231 0.225 1.573 1.00 0.00 N ATOM 633 CA ILE A 40 11.225 -0.457 0.689 1.00 0.00 C ATOM 634 C ILE A 40 12.632 -0.110 1.175 1.00 0.00 C ATOM 635 O ILE A 40 12.931 1.026 1.481 1.00 0.00 O ATOM 636 CB ILE A 40 11.034 -0.035 -0.787 1.00 0.00 C ATOM 637 CG1 ILE A 40 12.395 0.090 -1.504 1.00 0.00 C ATOM 638 CG2 ILE A 40 10.285 1.298 -0.872 1.00 0.00 C ATOM 639 CD1 ILE A 40 13.027 1.455 -1.208 1.00 0.00 C ATOM 0 H ILE A 40 9.835 1.089 1.203 1.00 0.00 H new ATOM 0 HA ILE A 40 11.076 -1.536 0.740 1.00 0.00 H new ATOM 0 HB ILE A 40 10.446 -0.808 -1.281 1.00 0.00 H new ATOM 0 HG12 ILE A 40 13.062 -0.707 -1.175 1.00 0.00 H new ATOM 0 HG13 ILE A 40 12.260 -0.031 -2.579 1.00 0.00 H new ATOM 0 HG21 ILE A 40 10.160 1.579 -1.918 1.00 0.00 H new ATOM 0 HG22 ILE A 40 9.306 1.196 -0.404 1.00 0.00 H new ATOM 0 HG23 ILE A 40 10.855 2.069 -0.355 1.00 0.00 H new ATOM 0 HD11 ILE A 40 13.987 1.530 -1.720 1.00 0.00 H new ATOM 0 HD12 ILE A 40 12.365 2.246 -1.560 1.00 0.00 H new ATOM 0 HD13 ILE A 40 13.179 1.560 -0.134 1.00 0.00 H new ATOM 651 N GLU A 41 13.498 -1.082 1.252 1.00 0.00 N ATOM 652 CA GLU A 41 14.879 -0.795 1.722 1.00 0.00 C ATOM 653 C GLU A 41 15.777 -2.022 1.525 1.00 0.00 C ATOM 654 O GLU A 41 16.961 -1.898 1.293 1.00 0.00 O ATOM 655 CB GLU A 41 14.828 -0.411 3.201 1.00 0.00 C ATOM 656 CG GLU A 41 14.572 -1.656 4.058 1.00 0.00 C ATOM 657 CD GLU A 41 14.963 -1.365 5.507 1.00 0.00 C ATOM 658 OE1 GLU A 41 15.945 -0.668 5.708 1.00 0.00 O ATOM 659 OE2 GLU A 41 14.278 -1.849 6.394 1.00 0.00 O ATOM 0 H GLU A 41 13.310 -2.055 1.011 1.00 0.00 H new ATOM 0 HA GLU A 41 15.297 0.028 1.142 1.00 0.00 H new ATOM 0 HB2 GLU A 41 15.767 0.057 3.496 1.00 0.00 H new ATOM 0 HB3 GLU A 41 14.040 0.323 3.367 1.00 0.00 H new ATOM 0 HG2 GLU A 41 13.521 -1.939 4.003 1.00 0.00 H new ATOM 0 HG3 GLU A 41 15.149 -2.498 3.676 1.00 0.00 H new ATOM 666 N MET A 42 15.230 -3.205 1.628 1.00 0.00 N ATOM 667 CA MET A 42 16.065 -4.429 1.458 1.00 0.00 C ATOM 668 C MET A 42 16.653 -4.465 0.044 1.00 0.00 C ATOM 669 O MET A 42 16.086 -3.935 -0.891 1.00 0.00 O ATOM 670 CB MET A 42 15.206 -5.676 1.688 1.00 0.00 C ATOM 671 CG MET A 42 14.575 -5.607 3.078 1.00 0.00 C ATOM 672 SD MET A 42 15.004 -7.096 4.014 1.00 0.00 S ATOM 673 CE MET A 42 13.669 -6.992 5.232 1.00 0.00 C ATOM 0 H MET A 42 14.243 -3.376 1.822 1.00 0.00 H new ATOM 0 HA MET A 42 16.877 -4.410 2.184 1.00 0.00 H new ATOM 0 HB2 MET A 42 14.429 -5.742 0.926 1.00 0.00 H new ATOM 0 HB3 MET A 42 15.817 -6.574 1.598 1.00 0.00 H new ATOM 0 HG2 MET A 42 14.927 -4.720 3.605 1.00 0.00 H new ATOM 0 HG3 MET A 42 13.492 -5.518 2.993 1.00 0.00 H new ATOM 0 HE1 MET A 42 13.742 -7.830 5.925 1.00 0.00 H new ATOM 0 HE2 MET A 42 13.753 -6.056 5.785 1.00 0.00 H new ATOM 0 HE3 MET A 42 12.707 -7.026 4.721 1.00 0.00 H new ATOM 683 N GLY A 43 17.789 -5.089 -0.114 1.00 0.00 N ATOM 684 CA GLY A 43 18.421 -5.164 -1.461 1.00 0.00 C ATOM 685 C GLY A 43 18.728 -3.753 -1.962 1.00 0.00 C ATOM 686 O GLY A 43 19.356 -2.963 -1.285 1.00 0.00 O ATOM 0 H GLY A 43 18.307 -5.551 0.634 1.00 0.00 H new ATOM 0 HA2 GLY A 43 19.338 -5.751 -1.411 1.00 0.00 H new ATOM 0 HA3 GLY A 43 17.755 -5.672 -2.159 1.00 0.00 H new ATOM 690 N GLU A 44 18.285 -3.433 -3.143 1.00 0.00 N ATOM 691 CA GLU A 44 18.541 -2.076 -3.699 1.00 0.00 C ATOM 692 C GLU A 44 17.574 -1.815 -4.854 1.00 0.00 C ATOM 693 O GLU A 44 17.811 -0.975 -5.699 1.00 0.00 O ATOM 694 CB GLU A 44 19.983 -1.992 -4.206 1.00 0.00 C ATOM 695 CG GLU A 44 20.375 -3.322 -4.853 1.00 0.00 C ATOM 696 CD GLU A 44 20.872 -4.291 -3.777 1.00 0.00 C ATOM 697 OE1 GLU A 44 21.435 -3.825 -2.801 1.00 0.00 O ATOM 698 OE2 GLU A 44 20.679 -5.484 -3.949 1.00 0.00 O ATOM 0 H GLU A 44 17.754 -4.056 -3.751 1.00 0.00 H new ATOM 0 HA GLU A 44 18.391 -1.328 -2.921 1.00 0.00 H new ATOM 0 HB2 GLU A 44 20.079 -1.182 -4.929 1.00 0.00 H new ATOM 0 HB3 GLU A 44 20.657 -1.764 -3.380 1.00 0.00 H new ATOM 0 HG2 GLU A 44 19.519 -3.750 -5.375 1.00 0.00 H new ATOM 0 HG3 GLU A 44 21.154 -3.160 -5.598 1.00 0.00 H new ATOM 705 N THR A 45 16.486 -2.531 -4.895 1.00 0.00 N ATOM 706 CA THR A 45 15.501 -2.334 -5.990 1.00 0.00 C ATOM 707 C THR A 45 14.106 -2.596 -5.426 1.00 0.00 C ATOM 708 O THR A 45 13.933 -3.494 -4.640 1.00 0.00 O ATOM 709 CB THR A 45 15.824 -3.323 -7.120 1.00 0.00 C ATOM 710 OG1 THR A 45 16.880 -2.795 -7.912 1.00 0.00 O ATOM 711 CG2 THR A 45 14.597 -3.558 -8.005 1.00 0.00 C ATOM 0 H THR A 45 16.237 -3.247 -4.213 1.00 0.00 H new ATOM 0 HA THR A 45 15.544 -1.320 -6.386 1.00 0.00 H new ATOM 0 HB THR A 45 16.121 -4.275 -6.679 1.00 0.00 H new ATOM 0 HG1 THR A 45 17.327 -2.073 -7.422 1.00 0.00 H new ATOM 0 HG21 THR A 45 14.850 -4.262 -8.798 1.00 0.00 H new ATOM 0 HG22 THR A 45 13.786 -3.967 -7.402 1.00 0.00 H new ATOM 0 HG23 THR A 45 14.280 -2.613 -8.446 1.00 0.00 H new ATOM 719 N PRO A 46 13.148 -1.807 -5.837 1.00 0.00 N ATOM 720 CA PRO A 46 11.758 -1.952 -5.366 1.00 0.00 C ATOM 721 C PRO A 46 11.316 -3.420 -5.381 1.00 0.00 C ATOM 722 O PRO A 46 10.368 -3.787 -4.720 1.00 0.00 O ATOM 723 CB PRO A 46 10.936 -1.099 -6.338 1.00 0.00 C ATOM 724 CG PRO A 46 11.937 -0.271 -7.190 1.00 0.00 C ATOM 725 CD PRO A 46 13.358 -0.716 -6.803 1.00 0.00 C ATOM 0 HA PRO A 46 11.632 -1.628 -4.333 1.00 0.00 H new ATOM 0 HB2 PRO A 46 10.320 -1.731 -6.977 1.00 0.00 H new ATOM 0 HB3 PRO A 46 10.259 -0.441 -5.793 1.00 0.00 H new ATOM 0 HG2 PRO A 46 11.761 -0.434 -8.253 1.00 0.00 H new ATOM 0 HG3 PRO A 46 11.806 0.795 -7.005 1.00 0.00 H new ATOM 0 HD2 PRO A 46 13.918 -1.058 -7.673 1.00 0.00 H new ATOM 0 HD3 PRO A 46 13.925 0.103 -6.361 1.00 0.00 H new ATOM 733 N GLU A 47 11.990 -4.274 -6.106 1.00 0.00 N ATOM 734 CA GLU A 47 11.588 -5.708 -6.110 1.00 0.00 C ATOM 735 C GLU A 47 12.071 -6.361 -4.814 1.00 0.00 C ATOM 736 O GLU A 47 11.322 -6.527 -3.888 1.00 0.00 O ATOM 737 CB GLU A 47 12.203 -6.425 -7.313 1.00 0.00 C ATOM 738 CG GLU A 47 11.089 -6.952 -8.220 1.00 0.00 C ATOM 739 CD GLU A 47 11.603 -7.050 -9.657 1.00 0.00 C ATOM 740 OE1 GLU A 47 12.348 -6.171 -10.059 1.00 0.00 O ATOM 741 OE2 GLU A 47 11.246 -8.002 -10.331 1.00 0.00 O ATOM 0 H GLU A 47 12.794 -4.042 -6.690 1.00 0.00 H new ATOM 0 HA GLU A 47 10.503 -5.782 -6.180 1.00 0.00 H new ATOM 0 HB2 GLU A 47 12.845 -5.741 -7.868 1.00 0.00 H new ATOM 0 HB3 GLU A 47 12.832 -7.249 -6.976 1.00 0.00 H new ATOM 0 HG2 GLU A 47 10.757 -7.931 -7.874 1.00 0.00 H new ATOM 0 HG3 GLU A 47 10.225 -6.288 -8.176 1.00 0.00 H new ATOM 748 N GLN A 48 13.316 -6.731 -4.721 1.00 0.00 N ATOM 749 CA GLN A 48 13.789 -7.365 -3.452 1.00 0.00 C ATOM 750 C GLN A 48 13.334 -6.519 -2.269 1.00 0.00 C ATOM 751 O GLN A 48 13.055 -7.016 -1.204 1.00 0.00 O ATOM 752 CB GLN A 48 15.315 -7.446 -3.429 1.00 0.00 C ATOM 753 CG GLN A 48 15.780 -8.663 -4.233 1.00 0.00 C ATOM 754 CD GLN A 48 17.298 -8.608 -4.415 1.00 0.00 C ATOM 755 OE1 GLN A 48 17.808 -7.739 -5.095 1.00 0.00 O ATOM 756 NE2 GLN A 48 18.048 -9.502 -3.831 1.00 0.00 N ATOM 0 H GLN A 48 14.019 -6.626 -5.452 1.00 0.00 H new ATOM 0 HA GLN A 48 13.373 -8.370 -3.390 1.00 0.00 H new ATOM 0 HB2 GLN A 48 15.743 -6.536 -3.849 1.00 0.00 H new ATOM 0 HB3 GLN A 48 15.669 -7.520 -2.401 1.00 0.00 H new ATOM 0 HG2 GLN A 48 15.498 -9.581 -3.718 1.00 0.00 H new ATOM 0 HG3 GLN A 48 15.287 -8.679 -5.205 1.00 0.00 H new ATOM 0 HE21 GLN A 48 17.621 -10.232 -3.260 1.00 0.00 H new ATOM 0 HE22 GLN A 48 19.061 -9.471 -3.945 1.00 0.00 H new ATOM 765 N ALA A 49 13.274 -5.242 -2.447 1.00 0.00 N ATOM 766 CA ALA A 49 12.857 -4.355 -1.335 1.00 0.00 C ATOM 767 C ALA A 49 11.408 -4.643 -0.942 1.00 0.00 C ATOM 768 O ALA A 49 11.134 -5.051 0.156 1.00 0.00 O ATOM 769 CB ALA A 49 12.984 -2.900 -1.780 1.00 0.00 C ATOM 0 H ALA A 49 13.497 -4.766 -3.321 1.00 0.00 H new ATOM 0 HA ALA A 49 13.498 -4.538 -0.473 1.00 0.00 H new ATOM 0 HB1 ALA A 49 12.679 -2.243 -0.966 1.00 0.00 H new ATOM 0 HB2 ALA A 49 14.020 -2.690 -2.047 1.00 0.00 H new ATOM 0 HB3 ALA A 49 12.344 -2.727 -2.645 1.00 0.00 H new ATOM 775 N VAL A 50 10.481 -4.418 -1.827 1.00 0.00 N ATOM 776 CA VAL A 50 9.042 -4.659 -1.493 1.00 0.00 C ATOM 777 C VAL A 50 8.771 -6.159 -1.329 1.00 0.00 C ATOM 778 O VAL A 50 8.164 -6.596 -0.375 1.00 0.00 O ATOM 779 CB VAL A 50 8.173 -4.077 -2.617 1.00 0.00 C ATOM 780 CG1 VAL A 50 8.043 -5.072 -3.776 1.00 0.00 C ATOM 781 CG2 VAL A 50 6.784 -3.766 -2.076 1.00 0.00 C ATOM 0 H VAL A 50 10.653 -4.076 -2.772 1.00 0.00 H new ATOM 0 HA VAL A 50 8.799 -4.171 -0.549 1.00 0.00 H new ATOM 0 HB VAL A 50 8.649 -3.167 -2.983 1.00 0.00 H new ATOM 0 HG11 VAL A 50 7.423 -4.638 -4.560 1.00 0.00 H new ATOM 0 HG12 VAL A 50 9.032 -5.295 -4.177 1.00 0.00 H new ATOM 0 HG13 VAL A 50 7.582 -5.992 -3.416 1.00 0.00 H new ATOM 0 HG21 VAL A 50 6.167 -3.353 -2.874 1.00 0.00 H new ATOM 0 HG22 VAL A 50 6.326 -4.681 -1.700 1.00 0.00 H new ATOM 0 HG23 VAL A 50 6.863 -3.041 -1.266 1.00 0.00 H new ATOM 791 N VAL A 51 9.213 -6.929 -2.267 1.00 0.00 N ATOM 792 CA VAL A 51 9.006 -8.403 -2.233 1.00 0.00 C ATOM 793 C VAL A 51 9.568 -8.992 -0.929 1.00 0.00 C ATOM 794 O VAL A 51 8.982 -9.874 -0.333 1.00 0.00 O ATOM 795 CB VAL A 51 9.728 -9.008 -3.442 1.00 0.00 C ATOM 796 CG1 VAL A 51 11.216 -9.145 -3.138 1.00 0.00 C ATOM 797 CG2 VAL A 51 9.148 -10.382 -3.758 1.00 0.00 C ATOM 0 H VAL A 51 9.725 -6.595 -3.083 1.00 0.00 H new ATOM 0 HA VAL A 51 7.942 -8.634 -2.273 1.00 0.00 H new ATOM 0 HB VAL A 51 9.591 -8.352 -4.301 1.00 0.00 H new ATOM 0 HG11 VAL A 51 11.725 -9.576 -4.000 1.00 0.00 H new ATOM 0 HG12 VAL A 51 11.635 -8.162 -2.922 1.00 0.00 H new ATOM 0 HG13 VAL A 51 11.352 -9.795 -2.274 1.00 0.00 H new ATOM 0 HG21 VAL A 51 9.666 -10.806 -4.618 1.00 0.00 H new ATOM 0 HG22 VAL A 51 9.277 -11.038 -2.897 1.00 0.00 H new ATOM 0 HG23 VAL A 51 8.086 -10.285 -3.985 1.00 0.00 H new ATOM 807 N ARG A 52 10.691 -8.501 -0.475 1.00 0.00 N ATOM 808 CA ARG A 52 11.277 -9.019 0.792 1.00 0.00 C ATOM 809 C ARG A 52 10.506 -8.375 1.936 1.00 0.00 C ATOM 810 O ARG A 52 10.261 -8.978 2.963 1.00 0.00 O ATOM 811 CB ARG A 52 12.760 -8.645 0.863 1.00 0.00 C ATOM 812 CG ARG A 52 13.508 -9.316 -0.291 1.00 0.00 C ATOM 813 CD ARG A 52 13.792 -10.775 0.059 1.00 0.00 C ATOM 814 NE ARG A 52 14.056 -11.538 -1.193 1.00 0.00 N ATOM 815 CZ ARG A 52 14.616 -12.714 -1.136 1.00 0.00 C ATOM 816 NH1 ARG A 52 15.896 -12.817 -0.904 1.00 0.00 N ATOM 817 NH2 ARG A 52 13.895 -13.787 -1.312 1.00 0.00 N ATOM 0 H ARG A 52 11.227 -7.762 -0.929 1.00 0.00 H new ATOM 0 HA ARG A 52 11.204 -10.105 0.849 1.00 0.00 H new ATOM 0 HB2 ARG A 52 12.877 -7.563 0.806 1.00 0.00 H new ATOM 0 HB3 ARG A 52 13.181 -8.962 1.817 1.00 0.00 H new ATOM 0 HG2 ARG A 52 12.914 -9.260 -1.203 1.00 0.00 H new ATOM 0 HG3 ARG A 52 14.443 -8.790 -0.486 1.00 0.00 H new ATOM 0 HD2 ARG A 52 14.651 -10.840 0.727 1.00 0.00 H new ATOM 0 HD3 ARG A 52 12.943 -11.206 0.589 1.00 0.00 H new ATOM 0 HE ARG A 52 13.798 -11.140 -2.096 1.00 0.00 H new ATOM 0 HH11 ARG A 52 16.459 -11.977 -0.767 1.00 0.00 H new ATOM 0 HH12 ARG A 52 16.334 -13.737 -0.859 1.00 0.00 H new ATOM 0 HH21 ARG A 52 12.895 -13.705 -1.494 1.00 0.00 H new ATOM 0 HH22 ARG A 52 14.332 -14.708 -1.268 1.00 0.00 H new ATOM 831 N GLU A 53 10.072 -7.164 1.729 1.00 0.00 N ATOM 832 CA GLU A 53 9.253 -6.473 2.755 1.00 0.00 C ATOM 833 C GLU A 53 7.884 -7.135 2.761 1.00 0.00 C ATOM 834 O GLU A 53 7.079 -6.933 3.640 1.00 0.00 O ATOM 835 CB GLU A 53 9.097 -5.002 2.388 1.00 0.00 C ATOM 836 CG GLU A 53 10.460 -4.328 2.443 1.00 0.00 C ATOM 837 CD GLU A 53 10.679 -3.732 3.834 1.00 0.00 C ATOM 838 OE1 GLU A 53 9.809 -3.902 4.672 1.00 0.00 O ATOM 839 OE2 GLU A 53 11.713 -3.118 4.038 1.00 0.00 O ATOM 0 H GLU A 53 10.253 -6.621 0.885 1.00 0.00 H new ATOM 0 HA GLU A 53 9.728 -6.541 3.734 1.00 0.00 H new ATOM 0 HB2 GLU A 53 8.670 -4.907 1.389 1.00 0.00 H new ATOM 0 HB3 GLU A 53 8.408 -4.514 3.077 1.00 0.00 H new ATOM 0 HG2 GLU A 53 11.244 -5.051 2.218 1.00 0.00 H new ATOM 0 HG3 GLU A 53 10.521 -3.545 1.687 1.00 0.00 H new ATOM 846 N LEU A 54 7.631 -7.925 1.757 1.00 0.00 N ATOM 847 CA LEU A 54 6.334 -8.631 1.636 1.00 0.00 C ATOM 848 C LEU A 54 6.344 -9.867 2.538 1.00 0.00 C ATOM 849 O LEU A 54 5.483 -10.052 3.376 1.00 0.00 O ATOM 850 CB LEU A 54 6.165 -9.050 0.172 1.00 0.00 C ATOM 851 CG LEU A 54 5.104 -8.178 -0.501 1.00 0.00 C ATOM 852 CD1 LEU A 54 3.801 -8.242 0.293 1.00 0.00 C ATOM 853 CD2 LEU A 54 5.594 -6.729 -0.553 1.00 0.00 C ATOM 0 H LEU A 54 8.287 -8.113 0.999 1.00 0.00 H new ATOM 0 HA LEU A 54 5.510 -7.985 1.940 1.00 0.00 H new ATOM 0 HB2 LEU A 54 7.114 -8.954 -0.355 1.00 0.00 H new ATOM 0 HB3 LEU A 54 5.875 -10.099 0.116 1.00 0.00 H new ATOM 0 HG LEU A 54 4.928 -8.544 -1.513 1.00 0.00 H new ATOM 0 HD11 LEU A 54 3.049 -7.619 -0.191 1.00 0.00 H new ATOM 0 HD12 LEU A 54 3.448 -9.273 0.331 1.00 0.00 H new ATOM 0 HD13 LEU A 54 3.974 -7.880 1.306 1.00 0.00 H new ATOM 0 HD21 LEU A 54 4.839 -6.106 -1.033 1.00 0.00 H new ATOM 0 HD22 LEU A 54 5.772 -6.368 0.460 1.00 0.00 H new ATOM 0 HD23 LEU A 54 6.521 -6.679 -1.124 1.00 0.00 H new ATOM 865 N GLN A 55 7.316 -10.716 2.356 1.00 0.00 N ATOM 866 CA GLN A 55 7.406 -11.960 3.179 1.00 0.00 C ATOM 867 C GLN A 55 7.760 -11.636 4.636 1.00 0.00 C ATOM 868 O GLN A 55 7.348 -12.327 5.547 1.00 0.00 O ATOM 869 CB GLN A 55 8.496 -12.873 2.607 1.00 0.00 C ATOM 870 CG GLN A 55 9.787 -12.074 2.394 1.00 0.00 C ATOM 871 CD GLN A 55 10.743 -12.323 3.562 1.00 0.00 C ATOM 872 OE1 GLN A 55 11.349 -11.401 4.071 1.00 0.00 O ATOM 873 NE2 GLN A 55 10.906 -13.536 4.014 1.00 0.00 N ATOM 0 H GLN A 55 8.060 -10.603 1.667 1.00 0.00 H new ATOM 0 HA GLN A 55 6.435 -12.454 3.151 1.00 0.00 H new ATOM 0 HB2 GLN A 55 8.681 -13.704 3.288 1.00 0.00 H new ATOM 0 HB3 GLN A 55 8.164 -13.303 1.662 1.00 0.00 H new ATOM 0 HG2 GLN A 55 10.258 -12.368 1.456 1.00 0.00 H new ATOM 0 HG3 GLN A 55 9.560 -11.011 2.317 1.00 0.00 H new ATOM 0 HE21 GLN A 55 10.398 -14.311 3.588 1.00 0.00 H new ATOM 0 HE22 GLN A 55 11.541 -13.709 4.793 1.00 0.00 H new ATOM 882 N GLU A 56 8.550 -10.624 4.869 1.00 0.00 N ATOM 883 CA GLU A 56 8.951 -10.313 6.272 1.00 0.00 C ATOM 884 C GLU A 56 7.740 -9.905 7.123 1.00 0.00 C ATOM 885 O GLU A 56 7.750 -10.066 8.327 1.00 0.00 O ATOM 886 CB GLU A 56 10.006 -9.200 6.284 1.00 0.00 C ATOM 887 CG GLU A 56 9.529 -7.988 5.489 1.00 0.00 C ATOM 888 CD GLU A 56 8.804 -7.008 6.418 1.00 0.00 C ATOM 889 OE1 GLU A 56 8.375 -7.436 7.477 1.00 0.00 O ATOM 890 OE2 GLU A 56 8.692 -5.845 6.056 1.00 0.00 O ATOM 0 H GLU A 56 8.933 -10.003 4.156 1.00 0.00 H new ATOM 0 HA GLU A 56 9.377 -11.216 6.708 1.00 0.00 H new ATOM 0 HB2 GLU A 56 10.218 -8.905 7.312 1.00 0.00 H new ATOM 0 HB3 GLU A 56 10.939 -9.573 5.861 1.00 0.00 H new ATOM 0 HG2 GLU A 56 10.378 -7.494 5.017 1.00 0.00 H new ATOM 0 HG3 GLU A 56 8.861 -8.307 4.689 1.00 0.00 H new ATOM 897 N GLU A 57 6.697 -9.384 6.532 1.00 0.00 N ATOM 898 CA GLU A 57 5.517 -8.989 7.360 1.00 0.00 C ATOM 899 C GLU A 57 4.666 -10.226 7.680 1.00 0.00 C ATOM 900 O GLU A 57 4.758 -10.790 8.754 1.00 0.00 O ATOM 901 CB GLU A 57 4.666 -7.947 6.619 1.00 0.00 C ATOM 902 CG GLU A 57 5.543 -7.142 5.664 1.00 0.00 C ATOM 903 CD GLU A 57 5.194 -5.657 5.777 1.00 0.00 C ATOM 904 OE1 GLU A 57 4.217 -5.251 5.170 1.00 0.00 O ATOM 905 OE2 GLU A 57 5.909 -4.950 6.469 1.00 0.00 O ATOM 0 H GLU A 57 6.610 -9.217 5.530 1.00 0.00 H new ATOM 0 HA GLU A 57 5.875 -8.549 8.291 1.00 0.00 H new ATOM 0 HB2 GLU A 57 3.870 -8.443 6.064 1.00 0.00 H new ATOM 0 HB3 GLU A 57 4.187 -7.280 7.336 1.00 0.00 H new ATOM 0 HG2 GLU A 57 6.595 -7.298 5.901 1.00 0.00 H new ATOM 0 HG3 GLU A 57 5.393 -7.484 4.640 1.00 0.00 H new ATOM 912 N VAL A 58 3.838 -10.650 6.763 1.00 0.00 N ATOM 913 CA VAL A 58 2.978 -11.838 7.008 1.00 0.00 C ATOM 914 C VAL A 58 3.797 -13.115 6.790 1.00 0.00 C ATOM 915 O VAL A 58 4.316 -13.695 7.722 1.00 0.00 O ATOM 916 CB VAL A 58 1.809 -11.792 6.029 1.00 0.00 C ATOM 917 CG1 VAL A 58 0.985 -13.071 6.127 1.00 0.00 C ATOM 918 CG2 VAL A 58 0.920 -10.589 6.353 1.00 0.00 C ATOM 0 H VAL A 58 3.722 -10.218 5.846 1.00 0.00 H new ATOM 0 HA VAL A 58 2.604 -11.834 8.032 1.00 0.00 H new ATOM 0 HB VAL A 58 2.201 -11.700 5.016 1.00 0.00 H new ATOM 0 HG11 VAL A 58 0.154 -13.024 5.423 1.00 0.00 H new ATOM 0 HG12 VAL A 58 1.614 -13.928 5.889 1.00 0.00 H new ATOM 0 HG13 VAL A 58 0.596 -13.177 7.140 1.00 0.00 H new ATOM 0 HG21 VAL A 58 0.084 -10.555 5.654 1.00 0.00 H new ATOM 0 HG22 VAL A 58 0.539 -10.682 7.370 1.00 0.00 H new ATOM 0 HG23 VAL A 58 1.503 -9.672 6.266 1.00 0.00 H new ATOM 928 N GLY A 59 3.929 -13.550 5.562 1.00 0.00 N ATOM 929 CA GLY A 59 4.732 -14.781 5.300 1.00 0.00 C ATOM 930 C GLY A 59 4.156 -15.595 4.130 1.00 0.00 C ATOM 931 O GLY A 59 4.426 -16.774 4.010 1.00 0.00 O ATOM 0 H GLY A 59 3.520 -13.110 4.738 1.00 0.00 H new ATOM 0 HA2 GLY A 59 5.762 -14.503 5.078 1.00 0.00 H new ATOM 0 HA3 GLY A 59 4.755 -15.399 6.198 1.00 0.00 H new ATOM 935 N ILE A 60 3.387 -14.997 3.255 1.00 0.00 N ATOM 936 CA ILE A 60 2.844 -15.780 2.105 1.00 0.00 C ATOM 937 C ILE A 60 3.940 -15.893 1.035 1.00 0.00 C ATOM 938 O ILE A 60 5.107 -16.003 1.357 1.00 0.00 O ATOM 939 CB ILE A 60 1.609 -15.082 1.526 1.00 0.00 C ATOM 940 CG1 ILE A 60 2.007 -13.709 0.998 1.00 0.00 C ATOM 941 CG2 ILE A 60 0.542 -14.920 2.615 1.00 0.00 C ATOM 942 CD1 ILE A 60 1.550 -13.569 -0.454 1.00 0.00 C ATOM 0 H ILE A 60 3.115 -14.014 3.286 1.00 0.00 H new ATOM 0 HA ILE A 60 2.547 -16.774 2.439 1.00 0.00 H new ATOM 0 HB ILE A 60 1.203 -15.685 0.714 1.00 0.00 H new ATOM 0 HG12 ILE A 60 1.556 -12.928 1.609 1.00 0.00 H new ATOM 0 HG13 ILE A 60 3.087 -13.581 1.064 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -0.333 -14.423 2.196 1.00 0.00 H new ATOM 0 HG22 ILE A 60 0.256 -15.902 2.993 1.00 0.00 H new ATOM 0 HG23 ILE A 60 0.944 -14.320 3.432 1.00 0.00 H new ATOM 0 HD11 ILE A 60 1.835 -12.587 -0.832 1.00 0.00 H new ATOM 0 HD12 ILE A 60 2.022 -14.342 -1.060 1.00 0.00 H new ATOM 0 HD13 ILE A 60 0.467 -13.678 -0.507 1.00 0.00 H new ATOM 954 N THR A 61 3.599 -15.870 -0.230 1.00 0.00 N ATOM 955 CA THR A 61 4.673 -15.981 -1.265 1.00 0.00 C ATOM 956 C THR A 61 4.263 -15.257 -2.567 1.00 0.00 C ATOM 957 O THR A 61 4.814 -14.215 -2.863 1.00 0.00 O ATOM 958 CB THR A 61 4.988 -17.464 -1.511 1.00 0.00 C ATOM 959 OG1 THR A 61 5.842 -17.928 -0.473 1.00 0.00 O ATOM 960 CG2 THR A 61 5.691 -17.647 -2.861 1.00 0.00 C ATOM 0 H THR A 61 2.647 -15.781 -0.585 1.00 0.00 H new ATOM 0 HA THR A 61 5.577 -15.490 -0.904 1.00 0.00 H new ATOM 0 HB THR A 61 4.057 -18.031 -1.521 1.00 0.00 H new ATOM 0 HG1 THR A 61 5.786 -17.319 0.293 1.00 0.00 H new ATOM 0 HG21 THR A 61 5.907 -18.704 -3.019 1.00 0.00 H new ATOM 0 HG22 THR A 61 5.044 -17.286 -3.660 1.00 0.00 H new ATOM 0 HG23 THR A 61 6.623 -17.082 -2.865 1.00 0.00 H new ATOM 968 N PRO A 62 3.319 -15.795 -3.317 1.00 0.00 N ATOM 969 CA PRO A 62 2.881 -15.150 -4.568 1.00 0.00 C ATOM 970 C PRO A 62 2.328 -13.767 -4.271 1.00 0.00 C ATOM 971 O PRO A 62 2.401 -13.279 -3.163 1.00 0.00 O ATOM 972 CB PRO A 62 1.783 -16.058 -5.130 1.00 0.00 C ATOM 973 CG PRO A 62 1.548 -17.188 -4.106 1.00 0.00 C ATOM 974 CD PRO A 62 2.615 -17.049 -3.001 1.00 0.00 C ATOM 0 HA PRO A 62 3.700 -15.025 -5.276 1.00 0.00 H new ATOM 0 HB2 PRO A 62 0.865 -15.493 -5.295 1.00 0.00 H new ATOM 0 HB3 PRO A 62 2.082 -16.470 -6.094 1.00 0.00 H new ATOM 0 HG2 PRO A 62 0.547 -17.117 -3.682 1.00 0.00 H new ATOM 0 HG3 PRO A 62 1.622 -18.163 -4.588 1.00 0.00 H new ATOM 0 HD2 PRO A 62 2.158 -17.008 -2.012 1.00 0.00 H new ATOM 0 HD3 PRO A 62 3.299 -17.898 -3.002 1.00 0.00 H new ATOM 982 N GLN A 63 1.787 -13.145 -5.270 1.00 0.00 N ATOM 983 CA GLN A 63 1.220 -11.782 -5.136 1.00 0.00 C ATOM 984 C GLN A 63 1.333 -11.123 -6.501 1.00 0.00 C ATOM 985 O GLN A 63 0.604 -10.217 -6.826 1.00 0.00 O ATOM 986 CB GLN A 63 2.011 -10.960 -4.116 1.00 0.00 C ATOM 987 CG GLN A 63 3.507 -11.099 -4.403 1.00 0.00 C ATOM 988 CD GLN A 63 4.276 -9.934 -3.763 1.00 0.00 C ATOM 989 OE1 GLN A 63 5.342 -10.126 -3.212 1.00 0.00 O ATOM 990 NE2 GLN A 63 3.785 -8.726 -3.820 1.00 0.00 N ATOM 0 H GLN A 63 1.711 -13.539 -6.208 1.00 0.00 H new ATOM 0 HA GLN A 63 0.186 -11.836 -4.794 1.00 0.00 H new ATOM 0 HB2 GLN A 63 1.715 -9.912 -4.169 1.00 0.00 H new ATOM 0 HB3 GLN A 63 1.790 -11.303 -3.105 1.00 0.00 H new ATOM 0 HG2 GLN A 63 3.874 -12.047 -4.010 1.00 0.00 H new ATOM 0 HG3 GLN A 63 3.679 -11.112 -5.479 1.00 0.00 H new ATOM 0 HE21 GLN A 63 2.891 -8.560 -4.282 1.00 0.00 H new ATOM 0 HE22 GLN A 63 4.296 -7.948 -3.403 1.00 0.00 H new ATOM 999 N HIS A 64 2.249 -11.587 -7.313 1.00 0.00 N ATOM 1000 CA HIS A 64 2.396 -10.992 -8.666 1.00 0.00 C ATOM 1001 C HIS A 64 2.409 -9.477 -8.527 1.00 0.00 C ATOM 1002 O HIS A 64 1.547 -8.781 -9.025 1.00 0.00 O ATOM 1003 CB HIS A 64 1.209 -11.427 -9.504 1.00 0.00 C ATOM 1004 CG HIS A 64 1.667 -12.332 -10.615 1.00 0.00 C ATOM 1005 ND1 HIS A 64 0.775 -13.048 -11.397 1.00 0.00 N ATOM 1006 CD2 HIS A 64 2.917 -12.652 -11.083 1.00 0.00 C ATOM 1007 CE1 HIS A 64 1.496 -13.759 -12.285 1.00 0.00 C ATOM 1008 NE2 HIS A 64 2.807 -13.552 -12.137 1.00 0.00 N ATOM 0 H HIS A 64 2.895 -12.346 -7.096 1.00 0.00 H new ATOM 0 HA HIS A 64 3.320 -11.319 -9.142 1.00 0.00 H new ATOM 0 HB2 HIS A 64 0.482 -11.945 -8.878 1.00 0.00 H new ATOM 0 HB3 HIS A 64 0.707 -10.553 -9.919 1.00 0.00 H new ATOM 0 HD2 HIS A 64 3.846 -12.263 -10.692 1.00 0.00 H new ATOM 0 HE1 HIS A 64 1.066 -14.416 -13.026 1.00 0.00 H new ATOM 0 HE2 HIS A 64 3.565 -13.965 -12.680 1.00 0.00 H new ATOM 1016 N PHE A 65 3.375 -8.971 -7.825 1.00 0.00 N ATOM 1017 CA PHE A 65 3.462 -7.508 -7.606 1.00 0.00 C ATOM 1018 C PHE A 65 3.605 -6.770 -8.935 1.00 0.00 C ATOM 1019 O PHE A 65 4.080 -7.304 -9.918 1.00 0.00 O ATOM 1020 CB PHE A 65 4.677 -7.219 -6.734 1.00 0.00 C ATOM 1021 CG PHE A 65 5.877 -7.938 -7.306 1.00 0.00 C ATOM 1022 CD1 PHE A 65 6.412 -7.536 -8.538 1.00 0.00 C ATOM 1023 CD2 PHE A 65 6.449 -9.009 -6.611 1.00 0.00 C ATOM 1024 CE1 PHE A 65 7.520 -8.205 -9.071 1.00 0.00 C ATOM 1025 CE2 PHE A 65 7.557 -9.678 -7.145 1.00 0.00 C ATOM 1026 CZ PHE A 65 8.092 -9.277 -8.375 1.00 0.00 C ATOM 0 H PHE A 65 4.118 -9.516 -7.388 1.00 0.00 H new ATOM 0 HA PHE A 65 2.550 -7.164 -7.118 1.00 0.00 H new ATOM 0 HB2 PHE A 65 4.865 -6.146 -6.694 1.00 0.00 H new ATOM 0 HB3 PHE A 65 4.493 -7.548 -5.711 1.00 0.00 H new ATOM 0 HD1 PHE A 65 5.969 -6.710 -9.076 1.00 0.00 H new ATOM 0 HD2 PHE A 65 6.036 -9.320 -5.663 1.00 0.00 H new ATOM 0 HE1 PHE A 65 7.934 -7.894 -10.019 1.00 0.00 H new ATOM 0 HE2 PHE A 65 7.999 -10.504 -6.608 1.00 0.00 H new ATOM 0 HZ PHE A 65 8.946 -9.794 -8.787 1.00 0.00 H new ATOM 1036 N SER A 66 3.205 -5.533 -8.951 1.00 0.00 N ATOM 1037 CA SER A 66 3.311 -4.707 -10.182 1.00 0.00 C ATOM 1038 C SER A 66 3.437 -3.251 -9.746 1.00 0.00 C ATOM 1039 O SER A 66 2.785 -2.827 -8.821 1.00 0.00 O ATOM 1040 CB SER A 66 2.054 -4.879 -11.032 1.00 0.00 C ATOM 1041 OG SER A 66 2.388 -5.556 -12.236 1.00 0.00 O ATOM 0 H SER A 66 2.802 -5.050 -8.148 1.00 0.00 H new ATOM 0 HA SER A 66 4.174 -5.011 -10.775 1.00 0.00 H new ATOM 0 HB2 SER A 66 1.303 -5.444 -10.480 1.00 0.00 H new ATOM 0 HB3 SER A 66 1.618 -3.906 -11.258 1.00 0.00 H new ATOM 0 HG SER A 66 1.582 -5.669 -12.782 1.00 0.00 H new ATOM 1047 N LEU A 67 4.273 -2.483 -10.380 1.00 0.00 N ATOM 1048 CA LEU A 67 4.423 -1.064 -9.952 1.00 0.00 C ATOM 1049 C LEU A 67 3.125 -0.301 -10.222 1.00 0.00 C ATOM 1050 O LEU A 67 2.455 0.126 -9.314 1.00 0.00 O ATOM 1051 CB LEU A 67 5.571 -0.401 -10.730 1.00 0.00 C ATOM 1052 CG LEU A 67 6.242 0.733 -9.919 1.00 0.00 C ATOM 1053 CD1 LEU A 67 6.329 1.983 -10.792 1.00 0.00 C ATOM 1054 CD2 LEU A 67 5.447 1.075 -8.648 1.00 0.00 C ATOM 0 H LEU A 67 4.854 -2.770 -11.168 1.00 0.00 H new ATOM 0 HA LEU A 67 4.646 -1.039 -8.885 1.00 0.00 H new ATOM 0 HB2 LEU A 67 6.317 -1.153 -10.987 1.00 0.00 H new ATOM 0 HB3 LEU A 67 5.188 0.002 -11.668 1.00 0.00 H new ATOM 0 HG LEU A 67 7.233 0.391 -9.620 1.00 0.00 H new ATOM 0 HD11 LEU A 67 6.801 2.788 -10.229 1.00 0.00 H new ATOM 0 HD12 LEU A 67 6.922 1.766 -11.680 1.00 0.00 H new ATOM 0 HD13 LEU A 67 5.326 2.289 -11.091 1.00 0.00 H new ATOM 0 HD21 LEU A 67 5.952 1.876 -8.107 1.00 0.00 H new ATOM 0 HD22 LEU A 67 4.443 1.399 -8.923 1.00 0.00 H new ATOM 0 HD23 LEU A 67 5.381 0.193 -8.011 1.00 0.00 H new ATOM 1066 N PHE A 68 2.787 -0.122 -11.468 1.00 0.00 N ATOM 1067 CA PHE A 68 1.548 0.623 -11.839 1.00 0.00 C ATOM 1068 C PHE A 68 1.845 2.131 -11.785 1.00 0.00 C ATOM 1069 O PHE A 68 1.552 2.863 -12.711 1.00 0.00 O ATOM 1070 CB PHE A 68 0.384 0.219 -10.900 1.00 0.00 C ATOM 1071 CG PHE A 68 -0.251 1.433 -10.254 1.00 0.00 C ATOM 1072 CD1 PHE A 68 -1.269 2.126 -10.918 1.00 0.00 C ATOM 1073 CD2 PHE A 68 0.181 1.860 -8.993 1.00 0.00 C ATOM 1074 CE1 PHE A 68 -1.856 3.247 -10.322 1.00 0.00 C ATOM 1075 CE2 PHE A 68 -0.405 2.982 -8.396 1.00 0.00 C ATOM 1076 CZ PHE A 68 -1.424 3.676 -9.061 1.00 0.00 C ATOM 0 H PHE A 68 3.327 -0.467 -12.262 1.00 0.00 H new ATOM 0 HA PHE A 68 1.238 0.372 -12.853 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -0.369 -0.329 -11.466 1.00 0.00 H new ATOM 0 HB3 PHE A 68 0.755 -0.454 -10.127 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -1.602 1.795 -11.891 1.00 0.00 H new ATOM 0 HD2 PHE A 68 0.966 1.324 -8.481 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -2.642 3.782 -10.834 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -0.072 3.313 -7.423 1.00 0.00 H new ATOM 0 HZ PHE A 68 -1.877 4.542 -8.601 1.00 0.00 H new ATOM 1086 N GLU A 69 2.437 2.597 -10.718 1.00 0.00 N ATOM 1087 CA GLU A 69 2.767 4.045 -10.614 1.00 0.00 C ATOM 1088 C GLU A 69 3.078 4.364 -9.158 1.00 0.00 C ATOM 1089 O GLU A 69 2.987 3.512 -8.303 1.00 0.00 O ATOM 1090 CB GLU A 69 1.583 4.887 -11.089 1.00 0.00 C ATOM 1091 CG GLU A 69 1.917 5.522 -12.441 1.00 0.00 C ATOM 1092 CD GLU A 69 1.353 6.944 -12.490 1.00 0.00 C ATOM 1093 OE1 GLU A 69 1.229 7.547 -11.435 1.00 0.00 O ATOM 1094 OE2 GLU A 69 1.053 7.405 -13.579 1.00 0.00 O ATOM 0 H GLU A 69 2.707 2.034 -9.912 1.00 0.00 H new ATOM 0 HA GLU A 69 3.629 4.276 -11.240 1.00 0.00 H new ATOM 0 HB2 GLU A 69 0.693 4.264 -11.178 1.00 0.00 H new ATOM 0 HB3 GLU A 69 1.358 5.662 -10.357 1.00 0.00 H new ATOM 0 HG2 GLU A 69 2.997 5.542 -12.588 1.00 0.00 H new ATOM 0 HG3 GLU A 69 1.496 4.924 -13.249 1.00 0.00 H new ATOM 1101 N LYS A 70 3.460 5.572 -8.861 1.00 0.00 N ATOM 1102 CA LYS A 70 3.779 5.903 -7.446 1.00 0.00 C ATOM 1103 C LYS A 70 3.755 7.417 -7.241 1.00 0.00 C ATOM 1104 O LYS A 70 3.600 8.180 -8.175 1.00 0.00 O ATOM 1105 CB LYS A 70 5.169 5.366 -7.115 1.00 0.00 C ATOM 1106 CG LYS A 70 6.085 5.569 -8.320 1.00 0.00 C ATOM 1107 CD LYS A 70 7.468 6.023 -7.844 1.00 0.00 C ATOM 1108 CE LYS A 70 8.021 5.010 -6.839 1.00 0.00 C ATOM 1109 NZ LYS A 70 8.766 5.730 -5.767 1.00 0.00 N ATOM 0 H LYS A 70 3.565 6.337 -9.527 1.00 0.00 H new ATOM 0 HA LYS A 70 3.036 5.448 -6.791 1.00 0.00 H new ATOM 0 HB2 LYS A 70 5.574 5.882 -6.244 1.00 0.00 H new ATOM 0 HB3 LYS A 70 5.112 4.308 -6.860 1.00 0.00 H new ATOM 0 HG2 LYS A 70 6.170 4.641 -8.885 1.00 0.00 H new ATOM 0 HG3 LYS A 70 5.658 6.313 -8.992 1.00 0.00 H new ATOM 0 HD2 LYS A 70 8.145 6.114 -8.694 1.00 0.00 H new ATOM 0 HD3 LYS A 70 7.400 7.008 -7.383 1.00 0.00 H new ATOM 0 HE2 LYS A 70 7.206 4.431 -6.404 1.00 0.00 H new ATOM 0 HE3 LYS A 70 8.680 4.304 -7.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 9.650 5.224 -5.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 8.987 6.695 -6.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 8.182 5.774 -4.908 1.00 0.00 H new ATOM 1123 N LEU A 71 3.919 7.858 -6.022 1.00 0.00 N ATOM 1124 CA LEU A 71 3.920 9.321 -5.752 1.00 0.00 C ATOM 1125 C LEU A 71 5.047 9.666 -4.780 1.00 0.00 C ATOM 1126 O LEU A 71 5.786 8.810 -4.332 1.00 0.00 O ATOM 1127 CB LEU A 71 2.577 9.749 -5.141 1.00 0.00 C ATOM 1128 CG LEU A 71 2.125 8.753 -4.059 1.00 0.00 C ATOM 1129 CD1 LEU A 71 3.252 8.516 -3.047 1.00 0.00 C ATOM 1130 CD2 LEU A 71 0.908 9.322 -3.322 1.00 0.00 C ATOM 0 H LEU A 71 4.052 7.266 -5.202 1.00 0.00 H new ATOM 0 HA LEU A 71 4.071 9.850 -6.693 1.00 0.00 H new ATOM 0 HB2 LEU A 71 2.671 10.745 -4.708 1.00 0.00 H new ATOM 0 HB3 LEU A 71 1.820 9.811 -5.923 1.00 0.00 H new ATOM 0 HG LEU A 71 1.868 7.808 -4.538 1.00 0.00 H new ATOM 0 HD11 LEU A 71 2.917 7.809 -2.288 1.00 0.00 H new ATOM 0 HD12 LEU A 71 4.123 8.110 -3.561 1.00 0.00 H new ATOM 0 HD13 LEU A 71 3.518 9.460 -2.571 1.00 0.00 H new ATOM 0 HD21 LEU A 71 0.586 8.618 -2.555 1.00 0.00 H new ATOM 0 HD22 LEU A 71 1.176 10.270 -2.855 1.00 0.00 H new ATOM 0 HD23 LEU A 71 0.096 9.483 -4.031 1.00 0.00 H new ATOM 1142 N GLU A 72 5.163 10.913 -4.434 1.00 0.00 N ATOM 1143 CA GLU A 72 6.215 11.338 -3.473 1.00 0.00 C ATOM 1144 C GLU A 72 5.739 12.622 -2.796 1.00 0.00 C ATOM 1145 O GLU A 72 5.980 13.715 -3.269 1.00 0.00 O ATOM 1146 CB GLU A 72 7.529 11.594 -4.217 1.00 0.00 C ATOM 1147 CG GLU A 72 8.713 11.216 -3.318 1.00 0.00 C ATOM 1148 CD GLU A 72 10.020 11.563 -4.030 1.00 0.00 C ATOM 1149 OE1 GLU A 72 9.970 12.326 -4.982 1.00 0.00 O ATOM 1150 OE2 GLU A 72 11.051 11.061 -3.613 1.00 0.00 O ATOM 0 H GLU A 72 4.568 11.666 -4.779 1.00 0.00 H new ATOM 0 HA GLU A 72 6.389 10.560 -2.730 1.00 0.00 H new ATOM 0 HB2 GLU A 72 7.557 11.010 -5.137 1.00 0.00 H new ATOM 0 HB3 GLU A 72 7.598 12.643 -4.503 1.00 0.00 H new ATOM 0 HG2 GLU A 72 8.649 11.750 -2.370 1.00 0.00 H new ATOM 0 HG3 GLU A 72 8.683 10.151 -3.087 1.00 0.00 H new ATOM 1157 N TYR A 73 5.050 12.496 -1.697 1.00 0.00 N ATOM 1158 CA TYR A 73 4.539 13.697 -0.992 1.00 0.00 C ATOM 1159 C TYR A 73 5.660 14.269 -0.138 1.00 0.00 C ATOM 1160 O TYR A 73 6.646 13.610 0.125 1.00 0.00 O ATOM 1161 CB TYR A 73 3.353 13.301 -0.111 1.00 0.00 C ATOM 1162 CG TYR A 73 2.224 14.283 -0.313 1.00 0.00 C ATOM 1163 CD1 TYR A 73 1.592 14.374 -1.559 1.00 0.00 C ATOM 1164 CD2 TYR A 73 1.809 15.098 0.745 1.00 0.00 C ATOM 1165 CE1 TYR A 73 0.544 15.283 -1.746 1.00 0.00 C ATOM 1166 CE2 TYR A 73 0.762 16.008 0.557 1.00 0.00 C ATOM 1167 CZ TYR A 73 0.129 16.100 -0.688 1.00 0.00 C ATOM 1168 OH TYR A 73 -0.904 16.996 -0.873 1.00 0.00 O ATOM 0 H TYR A 73 4.819 11.606 -1.256 1.00 0.00 H new ATOM 0 HA TYR A 73 4.207 14.447 -1.710 1.00 0.00 H new ATOM 0 HB2 TYR A 73 3.021 12.293 -0.361 1.00 0.00 H new ATOM 0 HB3 TYR A 73 3.654 13.287 0.937 1.00 0.00 H new ATOM 0 HD1 TYR A 73 1.913 13.743 -2.375 1.00 0.00 H new ATOM 0 HD2 TYR A 73 2.296 15.025 1.706 1.00 0.00 H new ATOM 0 HE1 TYR A 73 0.056 15.354 -2.707 1.00 0.00 H new ATOM 0 HE2 TYR A 73 0.443 16.639 1.373 1.00 0.00 H new ATOM 0 HH TYR A 73 -1.067 17.484 -0.039 1.00 0.00 H new ATOM 1178 N GLU A 74 5.540 15.492 0.288 1.00 0.00 N ATOM 1179 CA GLU A 74 6.631 16.075 1.103 1.00 0.00 C ATOM 1180 C GLU A 74 6.122 16.441 2.499 1.00 0.00 C ATOM 1181 O GLU A 74 4.938 16.579 2.733 1.00 0.00 O ATOM 1182 CB GLU A 74 7.171 17.327 0.411 1.00 0.00 C ATOM 1183 CG GLU A 74 8.499 16.999 -0.273 1.00 0.00 C ATOM 1184 CD GLU A 74 9.076 18.267 -0.907 1.00 0.00 C ATOM 1185 OE1 GLU A 74 8.324 18.976 -1.555 1.00 0.00 O ATOM 1186 OE2 GLU A 74 10.259 18.507 -0.732 1.00 0.00 O ATOM 0 H GLU A 74 4.744 16.105 0.109 1.00 0.00 H new ATOM 0 HA GLU A 74 7.427 15.337 1.204 1.00 0.00 H new ATOM 0 HB2 GLU A 74 6.451 17.689 -0.323 1.00 0.00 H new ATOM 0 HB3 GLU A 74 7.312 18.126 1.139 1.00 0.00 H new ATOM 0 HG2 GLU A 74 9.202 16.590 0.453 1.00 0.00 H new ATOM 0 HG3 GLU A 74 8.348 16.235 -1.036 1.00 0.00 H new ATOM 1193 N PHE A 75 7.026 16.600 3.426 1.00 0.00 N ATOM 1194 CA PHE A 75 6.639 16.960 4.819 1.00 0.00 C ATOM 1195 C PHE A 75 7.476 18.175 5.250 1.00 0.00 C ATOM 1196 O PHE A 75 8.288 18.652 4.483 1.00 0.00 O ATOM 1197 CB PHE A 75 6.924 15.762 5.731 1.00 0.00 C ATOM 1198 CG PHE A 75 5.641 15.295 6.378 1.00 0.00 C ATOM 1199 CD1 PHE A 75 4.448 15.287 5.645 1.00 0.00 C ATOM 1200 CD2 PHE A 75 5.645 14.872 7.713 1.00 0.00 C ATOM 1201 CE1 PHE A 75 3.259 14.856 6.248 1.00 0.00 C ATOM 1202 CE2 PHE A 75 4.457 14.441 8.314 1.00 0.00 C ATOM 1203 CZ PHE A 75 3.263 14.434 7.583 1.00 0.00 C ATOM 0 H PHE A 75 8.029 16.494 3.275 1.00 0.00 H new ATOM 0 HA PHE A 75 5.580 17.209 4.883 1.00 0.00 H new ATOM 0 HB2 PHE A 75 7.367 14.951 5.153 1.00 0.00 H new ATOM 0 HB3 PHE A 75 7.648 16.040 6.497 1.00 0.00 H new ATOM 0 HD1 PHE A 75 4.444 15.613 4.615 1.00 0.00 H new ATOM 0 HD2 PHE A 75 6.565 14.878 8.279 1.00 0.00 H new ATOM 0 HE1 PHE A 75 2.339 14.849 5.683 1.00 0.00 H new ATOM 0 HE2 PHE A 75 4.461 14.113 9.343 1.00 0.00 H new ATOM 0 HZ PHE A 75 2.346 14.103 8.048 1.00 0.00 H new ATOM 1213 N PRO A 76 7.265 18.647 6.456 1.00 0.00 N ATOM 1214 CA PRO A 76 8.011 19.811 6.970 1.00 0.00 C ATOM 1215 C PRO A 76 9.515 19.574 6.811 1.00 0.00 C ATOM 1216 O PRO A 76 10.299 20.498 6.734 1.00 0.00 O ATOM 1217 CB PRO A 76 7.611 19.905 8.449 1.00 0.00 C ATOM 1218 CG PRO A 76 6.464 18.889 8.688 1.00 0.00 C ATOM 1219 CD PRO A 76 6.291 18.069 7.399 1.00 0.00 C ATOM 0 HA PRO A 76 7.785 20.734 6.436 1.00 0.00 H new ATOM 0 HB2 PRO A 76 8.462 19.680 9.091 1.00 0.00 H new ATOM 0 HB3 PRO A 76 7.285 20.916 8.694 1.00 0.00 H new ATOM 0 HG2 PRO A 76 6.700 18.236 9.528 1.00 0.00 H new ATOM 0 HG3 PRO A 76 5.539 19.408 8.938 1.00 0.00 H new ATOM 0 HD2 PRO A 76 6.488 17.011 7.573 1.00 0.00 H new ATOM 0 HD3 PRO A 76 5.274 18.145 7.014 1.00 0.00 H new ATOM 1227 N ASP A 77 9.910 18.336 6.747 1.00 0.00 N ATOM 1228 CA ASP A 77 11.351 18.004 6.574 1.00 0.00 C ATOM 1229 C ASP A 77 11.453 16.506 6.315 1.00 0.00 C ATOM 1230 O ASP A 77 12.398 15.851 6.711 1.00 0.00 O ATOM 1231 CB ASP A 77 12.129 18.363 7.846 1.00 0.00 C ATOM 1232 CG ASP A 77 11.321 17.944 9.076 1.00 0.00 C ATOM 1233 OD1 ASP A 77 10.797 16.843 9.069 1.00 0.00 O ATOM 1234 OD2 ASP A 77 11.242 18.732 10.004 1.00 0.00 O ATOM 0 H ASP A 77 9.289 17.529 6.808 1.00 0.00 H new ATOM 0 HA ASP A 77 11.773 18.568 5.742 1.00 0.00 H new ATOM 0 HB2 ASP A 77 13.097 17.862 7.846 1.00 0.00 H new ATOM 0 HB3 ASP A 77 12.325 19.435 7.875 1.00 0.00 H new ATOM 1239 N ARG A 78 10.463 15.958 5.665 1.00 0.00 N ATOM 1240 CA ARG A 78 10.466 14.500 5.389 1.00 0.00 C ATOM 1241 C ARG A 78 9.909 14.227 3.989 1.00 0.00 C ATOM 1242 O ARG A 78 8.717 14.092 3.802 1.00 0.00 O ATOM 1243 CB ARG A 78 9.584 13.806 6.427 1.00 0.00 C ATOM 1244 CG ARG A 78 10.405 12.765 7.187 1.00 0.00 C ATOM 1245 CD ARG A 78 11.470 13.472 8.030 1.00 0.00 C ATOM 1246 NE ARG A 78 11.407 12.987 9.442 1.00 0.00 N ATOM 1247 CZ ARG A 78 10.254 12.743 10.004 1.00 0.00 C ATOM 1248 NH1 ARG A 78 9.618 13.696 10.626 1.00 0.00 N ATOM 1249 NH2 ARG A 78 9.740 11.544 9.945 1.00 0.00 N ATOM 0 H ARG A 78 9.650 16.463 5.313 1.00 0.00 H new ATOM 0 HA ARG A 78 11.487 14.121 5.442 1.00 0.00 H new ATOM 0 HB2 ARG A 78 9.177 14.540 7.122 1.00 0.00 H new ATOM 0 HB3 ARG A 78 8.736 13.327 5.937 1.00 0.00 H new ATOM 0 HG2 ARG A 78 9.754 12.170 7.828 1.00 0.00 H new ATOM 0 HG3 ARG A 78 10.878 12.077 6.486 1.00 0.00 H new ATOM 0 HD2 ARG A 78 12.460 13.282 7.615 1.00 0.00 H new ATOM 0 HD3 ARG A 78 11.313 14.550 8.000 1.00 0.00 H new ATOM 0 HE ARG A 78 12.269 12.846 9.969 1.00 0.00 H new ATOM 0 HH11 ARG A 78 10.021 14.632 10.673 1.00 0.00 H new ATOM 0 HH12 ARG A 78 8.717 13.506 11.065 1.00 0.00 H new ATOM 0 HH21 ARG A 78 10.239 10.798 9.460 1.00 0.00 H new ATOM 0 HH22 ARG A 78 8.839 11.353 10.384 1.00 0.00 H new ATOM 1263 N HIS A 79 10.760 14.130 3.004 1.00 0.00 N ATOM 1264 CA HIS A 79 10.271 13.849 1.626 1.00 0.00 C ATOM 1265 C HIS A 79 9.976 12.355 1.515 1.00 0.00 C ATOM 1266 O HIS A 79 10.849 11.556 1.238 1.00 0.00 O ATOM 1267 CB HIS A 79 11.352 14.237 0.620 1.00 0.00 C ATOM 1268 CG HIS A 79 10.741 14.378 -0.744 1.00 0.00 C ATOM 1269 ND1 HIS A 79 11.451 14.884 -1.819 1.00 0.00 N ATOM 1270 CD2 HIS A 79 9.490 14.081 -1.225 1.00 0.00 C ATOM 1271 CE1 HIS A 79 10.632 14.879 -2.883 1.00 0.00 C ATOM 1272 NE2 HIS A 79 9.423 14.399 -2.577 1.00 0.00 N ATOM 0 H HIS A 79 11.771 14.233 3.094 1.00 0.00 H new ATOM 0 HA HIS A 79 9.368 14.423 1.418 1.00 0.00 H new ATOM 0 HB2 HIS A 79 11.821 15.174 0.918 1.00 0.00 H new ATOM 0 HB3 HIS A 79 12.136 13.480 0.602 1.00 0.00 H new ATOM 0 HD2 HIS A 79 8.682 13.664 -0.643 1.00 0.00 H new ATOM 0 HE1 HIS A 79 10.916 15.221 -3.867 1.00 0.00 H new ATOM 0 HE2 HIS A 79 8.623 14.289 -3.201 1.00 0.00 H new ATOM 1280 N ILE A 80 8.754 11.966 1.760 1.00 0.00 N ATOM 1281 CA ILE A 80 8.409 10.518 1.703 1.00 0.00 C ATOM 1282 C ILE A 80 8.105 10.071 0.274 1.00 0.00 C ATOM 1283 O ILE A 80 7.726 10.846 -0.581 1.00 0.00 O ATOM 1284 CB ILE A 80 7.182 10.247 2.574 1.00 0.00 C ATOM 1285 CG1 ILE A 80 7.383 10.862 3.960 1.00 0.00 C ATOM 1286 CG2 ILE A 80 6.994 8.736 2.719 1.00 0.00 C ATOM 1287 CD1 ILE A 80 8.787 10.528 4.467 1.00 0.00 C ATOM 0 H ILE A 80 7.981 12.588 1.997 1.00 0.00 H new ATOM 0 HA ILE A 80 9.269 9.957 2.069 1.00 0.00 H new ATOM 0 HB ILE A 80 6.303 10.690 2.106 1.00 0.00 H new ATOM 0 HG12 ILE A 80 7.249 11.943 3.913 1.00 0.00 H new ATOM 0 HG13 ILE A 80 6.634 10.478 4.652 1.00 0.00 H new ATOM 0 HG21 ILE A 80 6.120 8.536 3.339 1.00 0.00 H new ATOM 0 HG22 ILE A 80 6.850 8.291 1.734 1.00 0.00 H new ATOM 0 HG23 ILE A 80 7.878 8.303 3.187 1.00 0.00 H new ATOM 0 HD11 ILE A 80 8.931 10.966 5.455 1.00 0.00 H new ATOM 0 HD12 ILE A 80 8.903 9.446 4.529 1.00 0.00 H new ATOM 0 HD13 ILE A 80 9.528 10.934 3.779 1.00 0.00 H new ATOM 1299 N THR A 81 8.247 8.798 0.044 1.00 0.00 N ATOM 1300 CA THR A 81 7.957 8.203 -1.282 1.00 0.00 C ATOM 1301 C THR A 81 7.066 6.991 -1.024 1.00 0.00 C ATOM 1302 O THR A 81 7.080 6.435 0.055 1.00 0.00 O ATOM 1303 CB THR A 81 9.264 7.746 -1.933 1.00 0.00 C ATOM 1304 OG1 THR A 81 10.288 8.692 -1.652 1.00 0.00 O ATOM 1305 CG2 THR A 81 9.076 7.627 -3.445 1.00 0.00 C ATOM 0 H THR A 81 8.562 8.127 0.744 1.00 0.00 H new ATOM 0 HA THR A 81 7.473 8.921 -1.945 1.00 0.00 H new ATOM 0 HB THR A 81 9.546 6.773 -1.531 1.00 0.00 H new ATOM 0 HG1 THR A 81 11.126 8.400 -2.067 1.00 0.00 H new ATOM 0 HG21 THR A 81 10.010 7.301 -3.903 1.00 0.00 H new ATOM 0 HG22 THR A 81 8.294 6.898 -3.658 1.00 0.00 H new ATOM 0 HG23 THR A 81 8.790 8.596 -3.854 1.00 0.00 H new ATOM 1313 N LEU A 82 6.280 6.575 -1.969 1.00 0.00 N ATOM 1314 CA LEU A 82 5.405 5.406 -1.693 1.00 0.00 C ATOM 1315 C LEU A 82 5.304 4.506 -2.920 1.00 0.00 C ATOM 1316 O LEU A 82 4.370 4.596 -3.687 1.00 0.00 O ATOM 1317 CB LEU A 82 4.012 5.906 -1.307 1.00 0.00 C ATOM 1318 CG LEU A 82 3.514 5.130 -0.088 1.00 0.00 C ATOM 1319 CD1 LEU A 82 3.868 5.901 1.184 1.00 0.00 C ATOM 1320 CD2 LEU A 82 1.997 4.963 -0.175 1.00 0.00 C ATOM 0 H LEU A 82 6.203 6.981 -2.901 1.00 0.00 H new ATOM 0 HA LEU A 82 5.835 4.826 -0.876 1.00 0.00 H new ATOM 0 HB2 LEU A 82 4.045 6.972 -1.084 1.00 0.00 H new ATOM 0 HB3 LEU A 82 3.323 5.776 -2.141 1.00 0.00 H new ATOM 0 HG LEU A 82 3.987 4.148 -0.064 1.00 0.00 H new ATOM 0 HD11 LEU A 82 3.514 5.349 2.055 1.00 0.00 H new ATOM 0 HD12 LEU A 82 4.949 6.022 1.247 1.00 0.00 H new ATOM 0 HD13 LEU A 82 3.394 6.882 1.159 1.00 0.00 H new ATOM 0 HD21 LEU A 82 1.641 4.410 0.694 1.00 0.00 H new ATOM 0 HD22 LEU A 82 1.524 5.945 -0.199 1.00 0.00 H new ATOM 0 HD23 LEU A 82 1.743 4.416 -1.083 1.00 0.00 H new ATOM 1332 N TRP A 83 6.248 3.624 -3.112 1.00 0.00 N ATOM 1333 CA TRP A 83 6.167 2.717 -4.293 1.00 0.00 C ATOM 1334 C TRP A 83 4.828 1.968 -4.262 1.00 0.00 C ATOM 1335 O TRP A 83 4.607 1.110 -3.432 1.00 0.00 O ATOM 1336 CB TRP A 83 7.314 1.707 -4.243 1.00 0.00 C ATOM 1337 CG TRP A 83 8.616 2.425 -4.378 1.00 0.00 C ATOM 1338 CD1 TRP A 83 9.240 3.095 -3.384 1.00 0.00 C ATOM 1339 CD2 TRP A 83 9.460 2.560 -5.558 1.00 0.00 C ATOM 1340 NE1 TRP A 83 10.418 3.629 -3.877 1.00 0.00 N ATOM 1341 CE2 TRP A 83 10.596 3.327 -5.212 1.00 0.00 C ATOM 1342 CE3 TRP A 83 9.349 2.094 -6.880 1.00 0.00 C ATOM 1343 CZ2 TRP A 83 11.591 3.623 -6.146 1.00 0.00 C ATOM 1344 CZ3 TRP A 83 10.347 2.389 -7.822 1.00 0.00 C ATOM 1345 CH2 TRP A 83 11.466 3.151 -7.456 1.00 0.00 C ATOM 0 H TRP A 83 7.062 3.493 -2.511 1.00 0.00 H new ATOM 0 HA TRP A 83 6.241 3.303 -5.209 1.00 0.00 H new ATOM 0 HB2 TRP A 83 7.286 1.156 -3.303 1.00 0.00 H new ATOM 0 HB3 TRP A 83 7.205 0.976 -5.045 1.00 0.00 H new ATOM 0 HD1 TRP A 83 8.879 3.197 -2.371 1.00 0.00 H new ATOM 0 HE1 TRP A 83 11.074 4.178 -3.322 1.00 0.00 H new ATOM 0 HE3 TRP A 83 8.491 1.506 -7.172 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 12.450 4.212 -5.859 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 10.253 2.027 -8.835 1.00 0.00 H new ATOM 0 HH2 TRP A 83 12.231 3.373 -8.186 1.00 0.00 H new ATOM 1356 N PHE A 84 3.929 2.286 -5.160 1.00 0.00 N ATOM 1357 CA PHE A 84 2.609 1.584 -5.171 1.00 0.00 C ATOM 1358 C PHE A 84 2.712 0.310 -5.996 1.00 0.00 C ATOM 1359 O PHE A 84 2.212 0.242 -7.094 1.00 0.00 O ATOM 1360 CB PHE A 84 1.538 2.471 -5.806 1.00 0.00 C ATOM 1361 CG PHE A 84 1.059 3.487 -4.799 1.00 0.00 C ATOM 1362 CD1 PHE A 84 1.841 4.606 -4.503 1.00 0.00 C ATOM 1363 CD2 PHE A 84 -0.173 3.306 -4.162 1.00 0.00 C ATOM 1364 CE1 PHE A 84 1.391 5.547 -3.569 1.00 0.00 C ATOM 1365 CE2 PHE A 84 -0.624 4.244 -3.229 1.00 0.00 C ATOM 1366 CZ PHE A 84 0.158 5.366 -2.932 1.00 0.00 C ATOM 0 H PHE A 84 4.051 2.997 -5.882 1.00 0.00 H new ATOM 0 HA PHE A 84 2.338 1.354 -4.141 1.00 0.00 H new ATOM 0 HB2 PHE A 84 1.943 2.976 -6.683 1.00 0.00 H new ATOM 0 HB3 PHE A 84 0.702 1.861 -6.148 1.00 0.00 H new ATOM 0 HD1 PHE A 84 2.793 4.745 -4.995 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -0.777 2.440 -4.391 1.00 0.00 H new ATOM 0 HE1 PHE A 84 1.995 6.412 -3.340 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -1.575 4.103 -2.738 1.00 0.00 H new ATOM 0 HZ PHE A 84 -0.190 6.092 -2.212 1.00 0.00 H new ATOM 1376 N TRP A 85 3.329 -0.706 -5.478 1.00 0.00 N ATOM 1377 CA TRP A 85 3.429 -1.967 -6.254 1.00 0.00 C ATOM 1378 C TRP A 85 2.108 -2.738 -6.148 1.00 0.00 C ATOM 1379 O TRP A 85 1.920 -3.550 -5.265 1.00 0.00 O ATOM 1380 CB TRP A 85 4.578 -2.810 -5.702 1.00 0.00 C ATOM 1381 CG TRP A 85 5.868 -2.224 -6.172 1.00 0.00 C ATOM 1382 CD1 TRP A 85 6.617 -1.334 -5.483 1.00 0.00 C ATOM 1383 CD2 TRP A 85 6.567 -2.464 -7.426 1.00 0.00 C ATOM 1384 NE1 TRP A 85 7.730 -1.009 -6.237 1.00 0.00 N ATOM 1385 CE2 TRP A 85 7.745 -1.683 -7.443 1.00 0.00 C ATOM 1386 CE3 TRP A 85 6.293 -3.278 -8.540 1.00 0.00 C ATOM 1387 CZ2 TRP A 85 8.622 -1.708 -8.530 1.00 0.00 C ATOM 1388 CZ3 TRP A 85 7.174 -3.306 -9.633 1.00 0.00 C ATOM 1389 CH2 TRP A 85 8.336 -2.522 -9.628 1.00 0.00 C ATOM 0 H TRP A 85 3.767 -0.721 -4.557 1.00 0.00 H new ATOM 0 HA TRP A 85 3.624 -1.742 -7.303 1.00 0.00 H new ATOM 0 HB2 TRP A 85 4.545 -2.827 -4.613 1.00 0.00 H new ATOM 0 HB3 TRP A 85 4.486 -3.842 -6.040 1.00 0.00 H new ATOM 0 HD1 TRP A 85 6.384 -0.941 -4.504 1.00 0.00 H new ATOM 0 HE1 TRP A 85 8.451 -0.352 -5.939 1.00 0.00 H new ATOM 0 HE3 TRP A 85 5.400 -3.885 -8.555 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 9.516 -1.102 -8.521 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 6.955 -3.935 -10.483 1.00 0.00 H new ATOM 0 HH2 TRP A 85 9.009 -2.547 -10.472 1.00 0.00 H new ATOM 1400 N LEU A 86 1.182 -2.489 -7.039 1.00 0.00 N ATOM 1401 CA LEU A 86 -0.120 -3.213 -6.970 1.00 0.00 C ATOM 1402 C LEU A 86 0.089 -4.692 -7.311 1.00 0.00 C ATOM 1403 O LEU A 86 0.728 -5.032 -8.286 1.00 0.00 O ATOM 1404 CB LEU A 86 -1.104 -2.603 -7.970 1.00 0.00 C ATOM 1405 CG LEU A 86 -1.852 -1.434 -7.324 1.00 0.00 C ATOM 1406 CD1 LEU A 86 -2.456 -1.870 -5.986 1.00 0.00 C ATOM 1407 CD2 LEU A 86 -0.883 -0.271 -7.096 1.00 0.00 C ATOM 0 H LEU A 86 1.271 -1.821 -7.805 1.00 0.00 H new ATOM 0 HA LEU A 86 -0.521 -3.124 -5.960 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -0.569 -2.258 -8.855 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -1.814 -3.361 -8.302 1.00 0.00 H new ATOM 0 HG LEU A 86 -2.656 -1.115 -7.988 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -2.986 -1.031 -5.535 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -3.153 -2.692 -6.152 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -1.660 -2.198 -5.317 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -1.416 0.561 -6.636 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -0.076 -0.593 -6.438 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -0.467 0.048 -8.051 1.00 0.00 H new ATOM 1419 N VAL A 87 -0.455 -5.573 -6.514 1.00 0.00 N ATOM 1420 CA VAL A 87 -0.302 -7.035 -6.787 1.00 0.00 C ATOM 1421 C VAL A 87 -1.706 -7.640 -6.965 1.00 0.00 C ATOM 1422 O VAL A 87 -2.694 -6.975 -6.732 1.00 0.00 O ATOM 1423 CB VAL A 87 0.469 -7.700 -5.620 1.00 0.00 C ATOM 1424 CG1 VAL A 87 1.250 -6.631 -4.847 1.00 0.00 C ATOM 1425 CG2 VAL A 87 -0.493 -8.414 -4.658 1.00 0.00 C ATOM 0 H VAL A 87 -1.000 -5.344 -5.683 1.00 0.00 H new ATOM 0 HA VAL A 87 0.272 -7.207 -7.698 1.00 0.00 H new ATOM 0 HB VAL A 87 1.153 -8.437 -6.040 1.00 0.00 H new ATOM 0 HG11 VAL A 87 1.792 -7.099 -4.026 1.00 0.00 H new ATOM 0 HG12 VAL A 87 1.957 -6.142 -5.517 1.00 0.00 H new ATOM 0 HG13 VAL A 87 0.556 -5.891 -4.448 1.00 0.00 H new ATOM 0 HG21 VAL A 87 0.075 -8.872 -3.848 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.196 -7.692 -4.244 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -1.041 -9.186 -5.198 1.00 0.00 H new ATOM 1435 N GLU A 88 -1.827 -8.871 -7.400 1.00 0.00 N ATOM 1436 CA GLU A 88 -3.204 -9.419 -7.596 1.00 0.00 C ATOM 1437 C GLU A 88 -3.274 -10.957 -7.489 1.00 0.00 C ATOM 1438 O GLU A 88 -4.197 -11.556 -8.003 1.00 0.00 O ATOM 1439 CB GLU A 88 -3.699 -9.006 -8.984 1.00 0.00 C ATOM 1440 CG GLU A 88 -3.714 -7.478 -9.098 1.00 0.00 C ATOM 1441 CD GLU A 88 -4.510 -7.071 -10.339 1.00 0.00 C ATOM 1442 OE1 GLU A 88 -5.472 -7.755 -10.651 1.00 0.00 O ATOM 1443 OE2 GLU A 88 -4.146 -6.084 -10.956 1.00 0.00 O ATOM 0 H GLU A 88 -1.058 -9.503 -7.622 1.00 0.00 H new ATOM 0 HA GLU A 88 -3.827 -9.013 -6.799 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -3.052 -9.430 -9.752 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -4.700 -9.402 -9.156 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -4.161 -7.040 -8.206 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -2.695 -7.097 -9.164 1.00 0.00 H new ATOM 1450 N ARG A 89 -2.357 -11.617 -6.828 1.00 0.00 N ATOM 1451 CA ARG A 89 -2.490 -13.109 -6.733 1.00 0.00 C ATOM 1452 C ARG A 89 -1.665 -13.664 -5.568 1.00 0.00 C ATOM 1453 O ARG A 89 -0.850 -14.543 -5.731 1.00 0.00 O ATOM 1454 CB ARG A 89 -2.068 -13.768 -8.057 1.00 0.00 C ATOM 1455 CG ARG A 89 -0.547 -13.918 -8.133 1.00 0.00 C ATOM 1456 CD ARG A 89 -0.163 -15.398 -8.062 1.00 0.00 C ATOM 1457 NE ARG A 89 -0.186 -15.970 -9.439 1.00 0.00 N ATOM 1458 CZ ARG A 89 0.418 -17.098 -9.690 1.00 0.00 C ATOM 1459 NH1 ARG A 89 1.713 -17.185 -9.560 1.00 0.00 N ATOM 1460 NH2 ARG A 89 -0.268 -18.137 -10.082 1.00 0.00 N ATOM 0 H ARG A 89 -1.546 -11.208 -6.363 1.00 0.00 H new ATOM 0 HA ARG A 89 -3.537 -13.345 -6.543 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -2.539 -14.747 -8.147 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -2.420 -13.167 -8.895 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -0.176 -13.482 -9.060 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -0.078 -13.372 -7.314 1.00 0.00 H new ATOM 0 HD2 ARG A 89 0.829 -15.509 -7.624 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -0.858 -15.937 -7.418 1.00 0.00 H new ATOM 0 HE ARG A 89 -0.675 -15.478 -10.186 1.00 0.00 H new ATOM 0 HH11 ARG A 89 2.251 -16.371 -9.262 1.00 0.00 H new ATOM 0 HH12 ARG A 89 2.187 -18.067 -9.756 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -1.280 -18.068 -10.193 1.00 0.00 H new ATOM 0 HH22 ARG A 89 0.208 -19.018 -10.278 1.00 0.00 H new ATOM 1474 N TRP A 90 -1.895 -13.176 -4.383 1.00 0.00 N ATOM 1475 CA TRP A 90 -1.142 -13.694 -3.207 1.00 0.00 C ATOM 1476 C TRP A 90 -1.667 -15.081 -2.837 1.00 0.00 C ATOM 1477 O TRP A 90 -2.783 -15.436 -3.163 1.00 0.00 O ATOM 1478 CB TRP A 90 -1.343 -12.751 -2.024 1.00 0.00 C ATOM 1479 CG TRP A 90 -2.775 -12.800 -1.579 1.00 0.00 C ATOM 1480 CD1 TRP A 90 -3.355 -13.859 -0.968 1.00 0.00 C ATOM 1481 CD2 TRP A 90 -3.814 -11.778 -1.692 1.00 0.00 C ATOM 1482 NE1 TRP A 90 -4.676 -13.555 -0.698 1.00 0.00 N ATOM 1483 CE2 TRP A 90 -5.008 -12.287 -1.123 1.00 0.00 C ATOM 1484 CE3 TRP A 90 -3.840 -10.476 -2.225 1.00 0.00 C ATOM 1485 CZ2 TRP A 90 -6.181 -11.535 -1.084 1.00 0.00 C ATOM 1486 CZ3 TRP A 90 -5.025 -9.716 -2.186 1.00 0.00 C ATOM 1487 CH2 TRP A 90 -6.190 -10.246 -1.616 1.00 0.00 C ATOM 0 H TRP A 90 -2.571 -12.441 -4.177 1.00 0.00 H new ATOM 0 HA TRP A 90 -0.082 -13.757 -3.453 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -0.686 -13.037 -1.202 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -1.074 -11.733 -2.307 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -2.865 -14.791 -0.730 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -5.327 -14.193 -0.239 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -2.947 -10.058 -2.666 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -7.077 -11.948 -0.645 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -5.036 -8.718 -2.598 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -7.095 -9.657 -1.589 1.00 0.00 H new ATOM 1498 N GLU A 91 -0.881 -15.868 -2.151 1.00 0.00 N ATOM 1499 CA GLU A 91 -1.361 -17.229 -1.760 1.00 0.00 C ATOM 1500 C GLU A 91 -2.270 -17.119 -0.532 1.00 0.00 C ATOM 1501 O GLU A 91 -2.019 -16.341 0.358 1.00 0.00 O ATOM 1502 CB GLU A 91 -0.170 -18.144 -1.425 1.00 0.00 C ATOM 1503 CG GLU A 91 0.358 -17.836 -0.017 1.00 0.00 C ATOM 1504 CD GLU A 91 -0.023 -18.978 0.926 1.00 0.00 C ATOM 1505 OE1 GLU A 91 0.616 -20.016 0.857 1.00 0.00 O ATOM 1506 OE2 GLU A 91 -0.949 -18.798 1.698 1.00 0.00 O ATOM 0 H GLU A 91 0.063 -15.632 -1.846 1.00 0.00 H new ATOM 0 HA GLU A 91 -1.914 -17.656 -2.596 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -0.476 -19.188 -1.486 1.00 0.00 H new ATOM 0 HB3 GLU A 91 0.624 -18.002 -2.158 1.00 0.00 H new ATOM 0 HG2 GLU A 91 1.441 -17.714 -0.041 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -0.060 -16.896 0.343 1.00 0.00 H new ATOM 1513 N GLY A 92 -3.308 -17.917 -0.484 1.00 0.00 N ATOM 1514 CA GLY A 92 -4.251 -17.912 0.682 1.00 0.00 C ATOM 1515 C GLY A 92 -4.339 -16.531 1.348 1.00 0.00 C ATOM 1516 O GLY A 92 -5.250 -15.769 1.096 1.00 0.00 O ATOM 0 H GLY A 92 -3.547 -18.585 -1.217 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -5.243 -18.216 0.347 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -3.923 -18.648 1.416 1.00 0.00 H new ATOM 1520 N GLU A 93 -3.408 -16.213 2.210 1.00 0.00 N ATOM 1521 CA GLU A 93 -3.444 -14.897 2.907 1.00 0.00 C ATOM 1522 C GLU A 93 -2.606 -13.866 2.158 1.00 0.00 C ATOM 1523 O GLU A 93 -1.700 -14.211 1.427 1.00 0.00 O ATOM 1524 CB GLU A 93 -2.853 -15.044 4.301 1.00 0.00 C ATOM 1525 CG GLU A 93 -3.802 -15.854 5.185 1.00 0.00 C ATOM 1526 CD GLU A 93 -4.487 -14.917 6.181 1.00 0.00 C ATOM 1527 OE1 GLU A 93 -5.237 -14.062 5.739 1.00 0.00 O ATOM 1528 OE2 GLU A 93 -4.250 -15.068 7.367 1.00 0.00 O ATOM 0 H GLU A 93 -2.622 -16.812 2.461 1.00 0.00 H new ATOM 0 HA GLU A 93 -4.482 -14.569 2.953 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -1.883 -15.539 4.244 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -2.684 -14.061 4.739 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -4.548 -16.359 4.571 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -3.250 -16.629 5.717 1.00 0.00 H new ATOM 1535 N PRO A 94 -2.930 -12.622 2.391 1.00 0.00 N ATOM 1536 CA PRO A 94 -2.218 -11.491 1.782 1.00 0.00 C ATOM 1537 C PRO A 94 -0.949 -11.183 2.585 1.00 0.00 C ATOM 1538 O PRO A 94 -0.451 -12.011 3.317 1.00 0.00 O ATOM 1539 CB PRO A 94 -3.200 -10.327 1.924 1.00 0.00 C ATOM 1540 CG PRO A 94 -4.175 -10.715 3.061 1.00 0.00 C ATOM 1541 CD PRO A 94 -4.051 -12.232 3.266 1.00 0.00 C ATOM 0 HA PRO A 94 -1.919 -11.683 0.751 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -2.674 -9.402 2.162 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -3.738 -10.157 0.992 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -3.928 -10.181 3.979 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -5.198 -10.444 2.800 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -3.848 -12.478 4.308 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -4.971 -12.748 2.990 1.00 0.00 H new ATOM 1549 N TRP A 95 -0.450 -9.978 2.469 1.00 0.00 N ATOM 1550 CA TRP A 95 0.764 -9.580 3.233 1.00 0.00 C ATOM 1551 C TRP A 95 1.236 -8.195 2.777 1.00 0.00 C ATOM 1552 O TRP A 95 1.647 -8.005 1.651 1.00 0.00 O ATOM 1553 CB TRP A 95 1.882 -10.604 3.026 1.00 0.00 C ATOM 1554 CG TRP A 95 2.257 -10.715 1.585 1.00 0.00 C ATOM 1555 CD1 TRP A 95 1.523 -10.287 0.531 1.00 0.00 C ATOM 1556 CD2 TRP A 95 3.457 -11.316 1.031 1.00 0.00 C ATOM 1557 NE1 TRP A 95 2.203 -10.586 -0.634 1.00 0.00 N ATOM 1558 CE2 TRP A 95 3.398 -11.228 -0.376 1.00 0.00 C ATOM 1559 CE3 TRP A 95 4.581 -11.928 1.613 1.00 0.00 C ATOM 1560 CZ2 TRP A 95 4.419 -11.731 -1.179 1.00 0.00 C ATOM 1561 CZ3 TRP A 95 5.609 -12.434 0.806 1.00 0.00 C ATOM 1562 CH2 TRP A 95 5.528 -12.337 -0.588 1.00 0.00 C ATOM 0 H TRP A 95 -0.838 -9.249 1.871 1.00 0.00 H new ATOM 0 HA TRP A 95 0.514 -9.543 4.293 1.00 0.00 H new ATOM 0 HB2 TRP A 95 2.756 -10.315 3.610 1.00 0.00 H new ATOM 0 HB3 TRP A 95 1.560 -11.577 3.396 1.00 0.00 H new ATOM 0 HD1 TRP A 95 0.564 -9.793 0.591 1.00 0.00 H new ATOM 0 HE1 TRP A 95 1.864 -10.360 -1.569 1.00 0.00 H new ATOM 0 HE3 TRP A 95 4.653 -12.009 2.688 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 4.352 -11.652 -2.254 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 6.469 -12.902 1.262 1.00 0.00 H new ATOM 0 HH2 TRP A 95 6.322 -12.730 -1.205 1.00 0.00 H new ATOM 1573 N GLY A 96 1.179 -7.227 3.649 1.00 0.00 N ATOM 1574 CA GLY A 96 1.626 -5.853 3.274 1.00 0.00 C ATOM 1575 C GLY A 96 1.121 -4.858 4.319 1.00 0.00 C ATOM 1576 O GLY A 96 1.784 -3.898 4.654 1.00 0.00 O ATOM 0 H GLY A 96 0.842 -7.327 4.607 1.00 0.00 H new ATOM 0 HA2 GLY A 96 2.714 -5.815 3.214 1.00 0.00 H new ATOM 0 HA3 GLY A 96 1.243 -5.589 2.288 1.00 0.00 H new ATOM 1580 N LYS A 97 -0.054 -5.087 4.827 1.00 0.00 N ATOM 1581 CA LYS A 97 -0.637 -4.169 5.850 1.00 0.00 C ATOM 1582 C LYS A 97 0.438 -3.698 6.833 1.00 0.00 C ATOM 1583 O LYS A 97 0.690 -4.324 7.842 1.00 0.00 O ATOM 1584 CB LYS A 97 -1.740 -4.894 6.637 1.00 0.00 C ATOM 1585 CG LYS A 97 -1.544 -6.414 6.569 1.00 0.00 C ATOM 1586 CD LYS A 97 -0.122 -6.789 6.998 1.00 0.00 C ATOM 1587 CE LYS A 97 -0.065 -6.928 8.520 1.00 0.00 C ATOM 1588 NZ LYS A 97 1.317 -7.311 8.930 1.00 0.00 N ATOM 0 H LYS A 97 -0.645 -5.879 4.577 1.00 0.00 H new ATOM 0 HA LYS A 97 -1.053 -3.306 5.330 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -1.727 -4.567 7.677 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -2.717 -4.630 6.232 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -2.268 -6.910 7.215 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -1.729 -6.766 5.554 1.00 0.00 H new ATOM 0 HD2 LYS A 97 0.176 -7.725 6.526 1.00 0.00 H new ATOM 0 HD3 LYS A 97 0.582 -6.026 6.666 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -0.349 -5.988 8.993 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -0.778 -7.682 8.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 1.358 -7.406 9.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 1.571 -8.218 8.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 1.986 -6.577 8.623 1.00 0.00 H new ATOM 1602 N GLU A 98 1.057 -2.583 6.562 1.00 0.00 N ATOM 1603 CA GLU A 98 2.093 -2.070 7.502 1.00 0.00 C ATOM 1604 C GLU A 98 1.401 -1.640 8.796 1.00 0.00 C ATOM 1605 O GLU A 98 0.879 -0.547 8.894 1.00 0.00 O ATOM 1606 CB GLU A 98 2.802 -0.867 6.880 1.00 0.00 C ATOM 1607 CG GLU A 98 4.264 -0.849 7.332 1.00 0.00 C ATOM 1608 CD GLU A 98 5.014 -2.017 6.686 1.00 0.00 C ATOM 1609 OE1 GLU A 98 4.355 -2.903 6.167 1.00 0.00 O ATOM 1610 OE2 GLU A 98 6.235 -2.004 6.717 1.00 0.00 O ATOM 0 H GLU A 98 0.892 -2.008 5.736 1.00 0.00 H new ATOM 0 HA GLU A 98 2.828 -2.848 7.708 1.00 0.00 H new ATOM 0 HB2 GLU A 98 2.747 -0.921 5.793 1.00 0.00 H new ATOM 0 HB3 GLU A 98 2.306 0.056 7.179 1.00 0.00 H new ATOM 0 HG2 GLU A 98 4.730 0.096 7.052 1.00 0.00 H new ATOM 0 HG3 GLU A 98 4.321 -0.923 8.418 1.00 0.00 H new ATOM 1617 N GLY A 99 1.374 -2.490 9.786 1.00 0.00 N ATOM 1618 CA GLY A 99 0.693 -2.119 11.058 1.00 0.00 C ATOM 1619 C GLY A 99 -0.724 -1.640 10.734 1.00 0.00 C ATOM 1620 O GLY A 99 -1.176 -0.623 11.219 1.00 0.00 O ATOM 0 H GLY A 99 1.792 -3.420 9.769 1.00 0.00 H new ATOM 0 HA2 GLY A 99 0.658 -2.975 11.731 1.00 0.00 H new ATOM 0 HA3 GLY A 99 1.250 -1.334 11.570 1.00 0.00 H new ATOM 1624 N GLN A 100 -1.420 -2.370 9.906 1.00 0.00 N ATOM 1625 CA GLN A 100 -2.805 -1.973 9.527 1.00 0.00 C ATOM 1626 C GLN A 100 -3.647 -3.249 9.358 1.00 0.00 C ATOM 1627 O GLN A 100 -3.100 -4.329 9.264 1.00 0.00 O ATOM 1628 CB GLN A 100 -2.720 -1.134 8.233 1.00 0.00 C ATOM 1629 CG GLN A 100 -3.533 -1.742 7.081 1.00 0.00 C ATOM 1630 CD GLN A 100 -3.862 -0.634 6.078 1.00 0.00 C ATOM 1631 OE1 GLN A 100 -3.709 -0.811 4.887 1.00 0.00 O ATOM 1632 NE2 GLN A 100 -4.312 0.512 6.517 1.00 0.00 N ATOM 0 H GLN A 100 -1.086 -3.231 9.473 1.00 0.00 H new ATOM 0 HA GLN A 100 -3.287 -1.363 10.291 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -3.080 -0.125 8.434 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -1.677 -1.045 7.930 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -2.966 -2.536 6.595 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -4.450 -2.192 7.461 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -4.440 0.660 7.518 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -4.535 1.258 5.859 1.00 0.00 H new ATOM 1641 N PRO A 101 -4.950 -3.100 9.353 1.00 0.00 N ATOM 1642 CA PRO A 101 -5.854 -4.256 9.231 1.00 0.00 C ATOM 1643 C PRO A 101 -5.658 -4.923 7.877 1.00 0.00 C ATOM 1644 O PRO A 101 -5.452 -6.116 7.782 1.00 0.00 O ATOM 1645 CB PRO A 101 -7.266 -3.668 9.338 1.00 0.00 C ATOM 1646 CG PRO A 101 -7.127 -2.128 9.418 1.00 0.00 C ATOM 1647 CD PRO A 101 -5.627 -1.793 9.450 1.00 0.00 C ATOM 0 HA PRO A 101 -5.669 -5.012 9.994 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -7.866 -3.954 8.474 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -7.775 -4.053 10.222 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -7.606 -1.656 8.560 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -7.623 -1.745 10.310 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -5.349 -1.141 8.622 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -5.357 -1.274 10.370 1.00 0.00 H new ATOM 1655 N GLY A 102 -5.724 -4.159 6.827 1.00 0.00 N ATOM 1656 CA GLY A 102 -5.548 -4.741 5.479 1.00 0.00 C ATOM 1657 C GLY A 102 -6.616 -5.805 5.259 1.00 0.00 C ATOM 1658 O GLY A 102 -6.635 -6.825 5.913 1.00 0.00 O ATOM 0 H GLY A 102 -5.893 -3.153 6.848 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -5.628 -3.964 4.719 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -4.554 -5.179 5.384 1.00 0.00 H new ATOM 1662 N GLU A 103 -7.514 -5.570 4.356 1.00 0.00 N ATOM 1663 CA GLU A 103 -8.582 -6.585 4.107 1.00 0.00 C ATOM 1664 C GLU A 103 -9.035 -6.515 2.649 1.00 0.00 C ATOM 1665 O GLU A 103 -9.313 -5.454 2.127 1.00 0.00 O ATOM 1666 CB GLU A 103 -9.773 -6.321 5.032 1.00 0.00 C ATOM 1667 CG GLU A 103 -10.191 -4.855 4.929 1.00 0.00 C ATOM 1668 CD GLU A 103 -11.306 -4.571 5.937 1.00 0.00 C ATOM 1669 OE1 GLU A 103 -12.134 -5.444 6.138 1.00 0.00 O ATOM 1670 OE2 GLU A 103 -11.313 -3.484 6.493 1.00 0.00 O ATOM 0 H GLU A 103 -7.563 -4.730 3.780 1.00 0.00 H new ATOM 0 HA GLU A 103 -8.184 -7.579 4.310 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -10.608 -6.967 4.759 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -9.507 -6.562 6.061 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -9.336 -4.207 5.124 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -10.535 -4.634 3.918 1.00 0.00 H new ATOM 1677 N TRP A 104 -9.117 -7.642 1.982 1.00 0.00 N ATOM 1678 CA TRP A 104 -9.563 -7.614 0.558 1.00 0.00 C ATOM 1679 C TRP A 104 -10.808 -6.738 0.479 1.00 0.00 C ATOM 1680 O TRP A 104 -11.707 -6.851 1.288 1.00 0.00 O ATOM 1681 CB TRP A 104 -9.892 -9.029 0.044 1.00 0.00 C ATOM 1682 CG TRP A 104 -9.071 -10.048 0.772 1.00 0.00 C ATOM 1683 CD1 TRP A 104 -7.719 -10.057 0.833 1.00 0.00 C ATOM 1684 CD2 TRP A 104 -9.523 -11.199 1.545 1.00 0.00 C ATOM 1685 NE1 TRP A 104 -7.312 -11.139 1.592 1.00 0.00 N ATOM 1686 CE2 TRP A 104 -8.387 -11.872 2.055 1.00 0.00 C ATOM 1687 CE3 TRP A 104 -10.793 -11.721 1.850 1.00 0.00 C ATOM 1688 CZ2 TRP A 104 -8.507 -13.018 2.841 1.00 0.00 C ATOM 1689 CZ3 TRP A 104 -10.917 -12.876 2.640 1.00 0.00 C ATOM 1690 CH2 TRP A 104 -9.776 -13.522 3.135 1.00 0.00 C ATOM 0 H TRP A 104 -8.898 -8.565 2.357 1.00 0.00 H new ATOM 0 HA TRP A 104 -8.762 -7.217 -0.065 1.00 0.00 H new ATOM 0 HB2 TRP A 104 -10.952 -9.238 0.185 1.00 0.00 H new ATOM 0 HB3 TRP A 104 -9.695 -9.090 -1.026 1.00 0.00 H new ATOM 0 HD1 TRP A 104 -7.065 -9.336 0.365 1.00 0.00 H new ATOM 0 HE1 TRP A 104 -6.337 -11.368 1.786 1.00 0.00 H new ATOM 0 HE3 TRP A 104 -11.679 -11.231 1.474 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 -7.625 -13.512 3.220 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 -11.897 -13.268 2.867 1.00 0.00 H new ATOM 0 HH2 TRP A 104 -9.878 -14.409 3.743 1.00 0.00 H new ATOM 1701 N MET A 105 -10.865 -5.855 -0.471 1.00 0.00 N ATOM 1702 CA MET A 105 -12.051 -4.966 -0.571 1.00 0.00 C ATOM 1703 C MET A 105 -12.662 -5.084 -1.959 1.00 0.00 C ATOM 1704 O MET A 105 -12.012 -4.832 -2.947 1.00 0.00 O ATOM 1705 CB MET A 105 -11.623 -3.516 -0.327 1.00 0.00 C ATOM 1706 CG MET A 105 -12.839 -2.692 0.099 1.00 0.00 C ATOM 1707 SD MET A 105 -13.906 -2.404 -1.335 1.00 0.00 S ATOM 1708 CE MET A 105 -15.471 -2.303 -0.432 1.00 0.00 C ATOM 0 H MET A 105 -10.146 -5.709 -1.180 1.00 0.00 H new ATOM 0 HA MET A 105 -12.788 -5.261 0.176 1.00 0.00 H new ATOM 0 HB2 MET A 105 -10.855 -3.477 0.445 1.00 0.00 H new ATOM 0 HB3 MET A 105 -11.185 -3.097 -1.233 1.00 0.00 H new ATOM 0 HG2 MET A 105 -13.392 -3.217 0.878 1.00 0.00 H new ATOM 0 HG3 MET A 105 -12.517 -1.741 0.523 1.00 0.00 H new ATOM 0 HE1 MET A 105 -16.301 -2.411 -1.130 1.00 0.00 H new ATOM 0 HE2 MET A 105 -15.515 -3.100 0.310 1.00 0.00 H new ATOM 0 HE3 MET A 105 -15.541 -1.337 0.068 1.00 0.00 H new ATOM 1718 N SER A 106 -13.909 -5.458 -2.040 1.00 0.00 N ATOM 1719 CA SER A 106 -14.565 -5.579 -3.369 1.00 0.00 C ATOM 1720 C SER A 106 -15.008 -4.187 -3.828 1.00 0.00 C ATOM 1721 O SER A 106 -16.182 -3.920 -3.989 1.00 0.00 O ATOM 1722 CB SER A 106 -15.788 -6.491 -3.257 1.00 0.00 C ATOM 1723 OG SER A 106 -16.338 -6.701 -4.551 1.00 0.00 O ATOM 0 H SER A 106 -14.501 -5.685 -1.241 1.00 0.00 H new ATOM 0 HA SER A 106 -13.866 -6.005 -4.089 1.00 0.00 H new ATOM 0 HB2 SER A 106 -15.505 -7.444 -2.810 1.00 0.00 H new ATOM 0 HB3 SER A 106 -16.533 -6.040 -2.601 1.00 0.00 H new ATOM 0 HG SER A 106 -17.121 -7.286 -4.483 1.00 0.00 H new ATOM 1729 N LEU A 107 -14.074 -3.296 -4.032 1.00 0.00 N ATOM 1730 CA LEU A 107 -14.433 -1.921 -4.471 1.00 0.00 C ATOM 1731 C LEU A 107 -14.697 -1.933 -5.980 1.00 0.00 C ATOM 1732 O LEU A 107 -15.685 -1.406 -6.439 1.00 0.00 O ATOM 1733 CB LEU A 107 -13.282 -0.961 -4.110 1.00 0.00 C ATOM 1734 CG LEU A 107 -13.163 0.158 -5.144 1.00 0.00 C ATOM 1735 CD1 LEU A 107 -12.683 1.438 -4.454 1.00 0.00 C ATOM 1736 CD2 LEU A 107 -12.150 -0.263 -6.211 1.00 0.00 C ATOM 0 H LEU A 107 -13.075 -3.465 -3.912 1.00 0.00 H new ATOM 0 HA LEU A 107 -15.336 -1.578 -3.966 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -13.456 -0.533 -3.123 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -12.344 -1.514 -4.057 1.00 0.00 H new ATOM 0 HG LEU A 107 -14.132 0.343 -5.608 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -12.597 2.238 -5.190 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -13.399 1.727 -3.685 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -11.710 1.261 -3.995 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -12.056 0.528 -6.955 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -11.181 -0.439 -5.744 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -12.491 -1.178 -6.695 1.00 0.00 H new ATOM 1748 N VAL A 108 -13.817 -2.534 -6.742 1.00 0.00 N ATOM 1749 CA VAL A 108 -13.996 -2.599 -8.226 1.00 0.00 C ATOM 1750 C VAL A 108 -13.513 -1.303 -8.869 1.00 0.00 C ATOM 1751 O VAL A 108 -14.024 -0.238 -8.584 1.00 0.00 O ATOM 1752 CB VAL A 108 -15.466 -2.816 -8.584 1.00 0.00 C ATOM 1753 CG1 VAL A 108 -15.585 -2.993 -10.092 1.00 0.00 C ATOM 1754 CG2 VAL A 108 -15.986 -4.071 -7.879 1.00 0.00 C ATOM 0 H VAL A 108 -12.972 -2.988 -6.395 1.00 0.00 H new ATOM 0 HA VAL A 108 -13.409 -3.438 -8.601 1.00 0.00 H new ATOM 0 HB VAL A 108 -16.055 -1.956 -8.264 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -16.630 -3.149 -10.359 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -15.212 -2.100 -10.594 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -14.998 -3.857 -10.404 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -17.034 -4.224 -8.135 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -15.404 -4.935 -8.199 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -15.890 -3.948 -6.800 1.00 0.00 H new ATOM 1764 N GLY A 109 -12.534 -1.391 -9.741 1.00 0.00 N ATOM 1765 CA GLY A 109 -12.004 -0.168 -10.415 1.00 0.00 C ATOM 1766 C GLY A 109 -12.016 0.990 -9.424 1.00 0.00 C ATOM 1767 O GLY A 109 -12.939 1.779 -9.385 1.00 0.00 O ATOM 0 H GLY A 109 -12.080 -2.263 -10.013 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -10.990 -0.346 -10.774 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -12.613 0.076 -11.286 1.00 0.00 H new ATOM 1771 N LEU A 110 -11.014 1.073 -8.602 1.00 0.00 N ATOM 1772 CA LEU A 110 -10.965 2.151 -7.583 1.00 0.00 C ATOM 1773 C LEU A 110 -11.440 3.477 -8.177 1.00 0.00 C ATOM 1774 O LEU A 110 -11.561 3.632 -9.375 1.00 0.00 O ATOM 1775 CB LEU A 110 -9.541 2.295 -7.073 1.00 0.00 C ATOM 1776 CG LEU A 110 -9.511 1.944 -5.594 1.00 0.00 C ATOM 1777 CD1 LEU A 110 -8.654 0.697 -5.367 1.00 0.00 C ATOM 1778 CD2 LEU A 110 -8.923 3.122 -4.835 1.00 0.00 C ATOM 0 H LEU A 110 -10.219 0.434 -8.592 1.00 0.00 H new ATOM 0 HA LEU A 110 -11.627 1.888 -6.758 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -8.873 1.638 -7.630 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -9.187 3.314 -7.226 1.00 0.00 H new ATOM 0 HG LEU A 110 -10.521 1.736 -5.240 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -8.639 0.454 -4.304 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -9.074 -0.140 -5.925 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -7.637 0.887 -5.710 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -8.893 2.890 -3.770 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -7.912 3.317 -5.193 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -9.542 4.005 -4.997 1.00 0.00 H new ATOM 1790 N ASN A 111 -11.739 4.432 -7.336 1.00 0.00 N ATOM 1791 CA ASN A 111 -12.245 5.737 -7.847 1.00 0.00 C ATOM 1792 C ASN A 111 -11.709 6.912 -7.023 1.00 0.00 C ATOM 1793 O ASN A 111 -11.980 8.054 -7.330 1.00 0.00 O ATOM 1794 CB ASN A 111 -13.766 5.722 -7.731 1.00 0.00 C ATOM 1795 CG ASN A 111 -14.377 6.484 -8.908 1.00 0.00 C ATOM 1796 OD1 ASN A 111 -14.213 7.683 -9.023 1.00 0.00 O ATOM 1797 ND2 ASN A 111 -15.079 5.833 -9.796 1.00 0.00 N ATOM 0 H ASN A 111 -11.655 4.364 -6.322 1.00 0.00 H new ATOM 0 HA ASN A 111 -11.914 5.865 -8.878 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -14.130 4.695 -7.721 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -14.074 6.178 -6.790 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -15.490 6.331 -10.586 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -15.217 4.827 -9.700 1.00 0.00 H new ATOM 1804 N ALA A 112 -10.996 6.652 -5.958 1.00 0.00 N ATOM 1805 CA ALA A 112 -10.498 7.768 -5.098 1.00 0.00 C ATOM 1806 C ALA A 112 -11.658 8.272 -4.236 1.00 0.00 C ATOM 1807 O ALA A 112 -11.486 9.094 -3.357 1.00 0.00 O ATOM 1808 CB ALA A 112 -9.974 8.917 -5.959 1.00 0.00 C ATOM 0 H ALA A 112 -10.737 5.716 -5.646 1.00 0.00 H new ATOM 0 HA ALA A 112 -9.684 7.404 -4.472 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -9.616 9.720 -5.315 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -9.155 8.560 -6.583 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -10.777 9.292 -6.594 1.00 0.00 H new ATOM 1814 N ASP A 113 -12.839 7.769 -4.478 1.00 0.00 N ATOM 1815 CA ASP A 113 -14.018 8.185 -3.687 1.00 0.00 C ATOM 1816 C ASP A 113 -13.999 7.427 -2.365 1.00 0.00 C ATOM 1817 O ASP A 113 -14.654 7.792 -1.409 1.00 0.00 O ATOM 1818 CB ASP A 113 -15.276 7.814 -4.473 1.00 0.00 C ATOM 1819 CG ASP A 113 -16.179 9.041 -4.617 1.00 0.00 C ATOM 1820 OD1 ASP A 113 -15.646 10.131 -4.753 1.00 0.00 O ATOM 1821 OD2 ASP A 113 -17.387 8.872 -4.591 1.00 0.00 O ATOM 0 H ASP A 113 -13.033 7.078 -5.203 1.00 0.00 H new ATOM 0 HA ASP A 113 -14.004 9.258 -3.497 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -15.002 7.435 -5.458 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -15.812 7.014 -3.962 1.00 0.00 H new ATOM 1826 N ASP A 114 -13.252 6.360 -2.319 1.00 0.00 N ATOM 1827 CA ASP A 114 -13.173 5.544 -1.083 1.00 0.00 C ATOM 1828 C ASP A 114 -11.791 5.711 -0.446 1.00 0.00 C ATOM 1829 O ASP A 114 -11.558 5.302 0.675 1.00 0.00 O ATOM 1830 CB ASP A 114 -13.394 4.086 -1.465 1.00 0.00 C ATOM 1831 CG ASP A 114 -14.892 3.781 -1.458 1.00 0.00 C ATOM 1832 OD1 ASP A 114 -15.636 4.553 -2.041 1.00 0.00 O ATOM 1833 OD2 ASP A 114 -15.271 2.780 -0.873 1.00 0.00 O ATOM 0 H ASP A 114 -12.687 6.017 -3.096 1.00 0.00 H new ATOM 0 HA ASP A 114 -13.929 5.864 -0.366 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -12.976 3.890 -2.453 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -12.875 3.432 -0.764 1.00 0.00 H new ATOM 1838 N PHE A 115 -10.875 6.309 -1.151 1.00 0.00 N ATOM 1839 CA PHE A 115 -9.509 6.507 -0.592 1.00 0.00 C ATOM 1840 C PHE A 115 -9.330 7.968 -0.154 1.00 0.00 C ATOM 1841 O PHE A 115 -9.928 8.862 -0.719 1.00 0.00 O ATOM 1842 CB PHE A 115 -8.481 6.160 -1.665 1.00 0.00 C ATOM 1843 CG PHE A 115 -8.211 4.673 -1.642 1.00 0.00 C ATOM 1844 CD1 PHE A 115 -9.187 3.778 -2.093 1.00 0.00 C ATOM 1845 CD2 PHE A 115 -6.982 4.189 -1.183 1.00 0.00 C ATOM 1846 CE1 PHE A 115 -8.936 2.400 -2.088 1.00 0.00 C ATOM 1847 CE2 PHE A 115 -6.727 2.811 -1.178 1.00 0.00 C ATOM 1848 CZ PHE A 115 -7.704 1.917 -1.631 1.00 0.00 C ATOM 0 H PHE A 115 -11.013 6.671 -2.095 1.00 0.00 H new ATOM 0 HA PHE A 115 -9.370 5.861 0.275 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -8.849 6.458 -2.647 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -7.557 6.711 -1.490 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -10.137 4.151 -2.446 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -6.228 4.878 -0.832 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -9.692 1.711 -2.436 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -5.777 2.439 -0.825 1.00 0.00 H new ATOM 0 HZ PHE A 115 -7.508 0.855 -1.628 1.00 0.00 H new ATOM 1858 N PRO A 116 -8.511 8.159 0.854 1.00 0.00 N ATOM 1859 CA PRO A 116 -8.228 9.496 1.409 1.00 0.00 C ATOM 1860 C PRO A 116 -7.534 10.380 0.364 1.00 0.00 C ATOM 1861 O PRO A 116 -6.754 9.896 -0.432 1.00 0.00 O ATOM 1862 CB PRO A 116 -7.287 9.238 2.594 1.00 0.00 C ATOM 1863 CG PRO A 116 -7.024 7.713 2.664 1.00 0.00 C ATOM 1864 CD PRO A 116 -7.804 7.053 1.520 1.00 0.00 C ATOM 0 HA PRO A 116 -9.139 10.016 1.706 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -6.351 9.782 2.465 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -7.735 9.592 3.522 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -5.958 7.504 2.571 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -7.344 7.313 3.626 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -7.134 6.540 0.830 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -8.504 6.308 1.898 1.00 0.00 H new ATOM 1872 N PRO A 117 -7.839 11.654 0.403 1.00 0.00 N ATOM 1873 CA PRO A 117 -7.253 12.632 -0.530 1.00 0.00 C ATOM 1874 C PRO A 117 -5.746 12.773 -0.280 1.00 0.00 C ATOM 1875 O PRO A 117 -4.990 13.105 -1.171 1.00 0.00 O ATOM 1876 CB PRO A 117 -7.972 13.952 -0.217 1.00 0.00 C ATOM 1877 CG PRO A 117 -8.928 13.697 0.977 1.00 0.00 C ATOM 1878 CD PRO A 117 -8.793 12.219 1.375 1.00 0.00 C ATOM 0 HA PRO A 117 -7.374 12.332 -1.571 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -7.251 14.731 0.030 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -8.530 14.299 -1.087 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -8.673 14.344 1.816 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -9.957 13.926 0.699 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -8.425 12.116 2.396 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -9.754 11.707 1.329 1.00 0.00 H new ATOM 1886 N ALA A 118 -5.302 12.529 0.925 1.00 0.00 N ATOM 1887 CA ALA A 118 -3.843 12.656 1.224 1.00 0.00 C ATOM 1888 C ALA A 118 -3.030 12.030 0.090 1.00 0.00 C ATOM 1889 O ALA A 118 -2.163 12.655 -0.488 1.00 0.00 O ATOM 1890 CB ALA A 118 -3.521 11.922 2.525 1.00 0.00 C ATOM 0 H ALA A 118 -5.884 12.248 1.714 1.00 0.00 H new ATOM 0 HA ALA A 118 -3.590 13.712 1.322 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -2.457 12.015 2.742 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -4.097 12.358 3.341 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -3.779 10.868 2.422 1.00 0.00 H new ATOM 1896 N ASN A 119 -3.309 10.797 -0.227 1.00 0.00 N ATOM 1897 CA ASN A 119 -2.564 10.116 -1.319 1.00 0.00 C ATOM 1898 C ASN A 119 -3.296 10.357 -2.636 1.00 0.00 C ATOM 1899 O ASN A 119 -3.585 9.446 -3.380 1.00 0.00 O ATOM 1900 CB ASN A 119 -2.495 8.613 -1.034 1.00 0.00 C ATOM 1901 CG ASN A 119 -1.162 8.282 -0.357 1.00 0.00 C ATOM 1902 OD1 ASN A 119 -0.113 8.430 -0.951 1.00 0.00 O ATOM 1903 ND2 ASN A 119 -1.160 7.841 0.871 1.00 0.00 N ATOM 0 H ASN A 119 -4.025 10.230 0.226 1.00 0.00 H new ATOM 0 HA ASN A 119 -1.550 10.512 -1.381 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -3.325 8.315 -0.393 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -2.593 8.051 -1.963 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -0.277 7.621 1.332 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -2.041 7.717 1.370 1.00 0.00 H new ATOM 1910 N GLU A 120 -3.603 11.589 -2.914 1.00 0.00 N ATOM 1911 CA GLU A 120 -4.323 11.936 -4.168 1.00 0.00 C ATOM 1912 C GLU A 120 -3.461 11.693 -5.423 1.00 0.00 C ATOM 1913 O GLU A 120 -3.988 11.294 -6.439 1.00 0.00 O ATOM 1914 CB GLU A 120 -4.698 13.411 -4.112 1.00 0.00 C ATOM 1915 CG GLU A 120 -6.185 13.549 -3.773 1.00 0.00 C ATOM 1916 CD GLU A 120 -6.625 14.998 -3.989 1.00 0.00 C ATOM 1917 OE1 GLU A 120 -5.761 15.835 -4.190 1.00 0.00 O ATOM 1918 OE2 GLU A 120 -7.819 15.245 -3.948 1.00 0.00 O ATOM 0 H GLU A 120 -3.382 12.385 -2.315 1.00 0.00 H new ATOM 0 HA GLU A 120 -5.204 11.298 -4.241 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -4.094 13.922 -3.362 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -4.487 13.887 -5.070 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -6.775 12.881 -4.400 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -6.362 13.254 -2.739 1.00 0.00 H new ATOM 1925 N PRO A 121 -2.176 11.973 -5.351 1.00 0.00 N ATOM 1926 CA PRO A 121 -1.287 11.810 -6.518 1.00 0.00 C ATOM 1927 C PRO A 121 -1.345 10.390 -7.091 1.00 0.00 C ATOM 1928 O PRO A 121 -1.289 10.201 -8.290 1.00 0.00 O ATOM 1929 CB PRO A 121 0.115 12.144 -5.993 1.00 0.00 C ATOM 1930 CG PRO A 121 -0.034 12.660 -4.542 1.00 0.00 C ATOM 1931 CD PRO A 121 -1.499 12.465 -4.131 1.00 0.00 C ATOM 0 HA PRO A 121 -1.584 12.459 -7.341 1.00 0.00 H new ATOM 0 HB2 PRO A 121 0.754 11.261 -6.021 1.00 0.00 H new ATOM 0 HB3 PRO A 121 0.588 12.899 -6.620 1.00 0.00 H new ATOM 0 HG2 PRO A 121 0.628 12.113 -3.871 1.00 0.00 H new ATOM 0 HG3 PRO A 121 0.245 13.712 -4.479 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -1.588 11.749 -3.314 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -1.940 13.400 -3.785 1.00 0.00 H new ATOM 1939 N VAL A 122 -1.458 9.392 -6.267 1.00 0.00 N ATOM 1940 CA VAL A 122 -1.517 8.006 -6.808 1.00 0.00 C ATOM 1941 C VAL A 122 -2.978 7.545 -6.844 1.00 0.00 C ATOM 1942 O VAL A 122 -3.387 6.830 -7.735 1.00 0.00 O ATOM 1943 CB VAL A 122 -0.667 7.090 -5.925 1.00 0.00 C ATOM 1944 CG1 VAL A 122 -1.236 5.667 -5.923 1.00 0.00 C ATOM 1945 CG2 VAL A 122 0.765 7.058 -6.468 1.00 0.00 C ATOM 0 H VAL A 122 -1.512 9.471 -5.251 1.00 0.00 H new ATOM 0 HA VAL A 122 -1.121 7.971 -7.823 1.00 0.00 H new ATOM 0 HB VAL A 122 -0.676 7.475 -4.905 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -0.619 5.029 -5.290 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -2.255 5.683 -5.538 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -1.239 5.275 -6.940 1.00 0.00 H new ATOM 0 HG21 VAL A 122 1.377 6.407 -5.843 1.00 0.00 H new ATOM 0 HG22 VAL A 122 0.758 6.679 -7.490 1.00 0.00 H new ATOM 0 HG23 VAL A 122 1.181 8.066 -6.458 1.00 0.00 H new ATOM 1955 N ILE A 123 -3.773 7.961 -5.897 1.00 0.00 N ATOM 1956 CA ILE A 123 -5.207 7.560 -5.917 1.00 0.00 C ATOM 1957 C ILE A 123 -5.806 8.106 -7.219 1.00 0.00 C ATOM 1958 O ILE A 123 -6.796 7.614 -7.719 1.00 0.00 O ATOM 1959 CB ILE A 123 -5.932 8.147 -4.688 1.00 0.00 C ATOM 1960 CG1 ILE A 123 -5.974 7.102 -3.568 1.00 0.00 C ATOM 1961 CG2 ILE A 123 -7.368 8.543 -5.044 1.00 0.00 C ATOM 1962 CD1 ILE A 123 -5.466 7.736 -2.272 1.00 0.00 C ATOM 0 H ILE A 123 -3.495 8.556 -5.117 1.00 0.00 H new ATOM 0 HA ILE A 123 -5.317 6.476 -5.875 1.00 0.00 H new ATOM 0 HB ILE A 123 -5.387 9.032 -4.360 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -6.992 6.736 -3.434 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -5.358 6.242 -3.833 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -7.861 8.954 -4.163 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -7.353 9.293 -5.835 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -7.913 7.664 -5.387 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -5.493 6.998 -1.471 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -4.442 8.081 -2.413 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -6.101 8.582 -2.008 1.00 0.00 H new ATOM 1974 N ALA A 124 -5.188 9.118 -7.769 1.00 0.00 N ATOM 1975 CA ALA A 124 -5.681 9.711 -9.041 1.00 0.00 C ATOM 1976 C ALA A 124 -5.645 8.636 -10.122 1.00 0.00 C ATOM 1977 O ALA A 124 -6.495 8.562 -10.987 1.00 0.00 O ATOM 1978 CB ALA A 124 -4.762 10.863 -9.446 1.00 0.00 C ATOM 0 H ALA A 124 -4.354 9.562 -7.385 1.00 0.00 H new ATOM 0 HA ALA A 124 -6.698 10.083 -8.915 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -5.118 11.302 -10.378 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -4.763 11.622 -8.664 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -3.748 10.488 -9.586 1.00 0.00 H new ATOM 1984 N LYS A 125 -4.645 7.813 -10.068 1.00 0.00 N ATOM 1985 CA LYS A 125 -4.490 6.728 -11.072 1.00 0.00 C ATOM 1986 C LYS A 125 -5.444 5.565 -10.767 1.00 0.00 C ATOM 1987 O LYS A 125 -6.020 4.985 -11.665 1.00 0.00 O ATOM 1988 CB LYS A 125 -3.045 6.251 -11.034 1.00 0.00 C ATOM 1989 CG LYS A 125 -2.140 7.413 -11.442 1.00 0.00 C ATOM 1990 CD LYS A 125 -2.449 7.829 -12.882 1.00 0.00 C ATOM 1991 CE LYS A 125 -2.910 9.289 -12.906 1.00 0.00 C ATOM 1992 NZ LYS A 125 -1.841 10.141 -13.502 1.00 0.00 N ATOM 0 H LYS A 125 -3.913 7.845 -9.358 1.00 0.00 H new ATOM 0 HA LYS A 125 -4.737 7.105 -12.065 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -2.787 5.903 -10.034 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -2.907 5.407 -11.710 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -2.291 8.257 -10.769 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -1.094 7.119 -11.355 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -1.563 7.706 -13.505 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -3.224 7.185 -13.299 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -3.828 9.382 -13.486 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -3.136 9.626 -11.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -2.155 11.132 -13.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -0.975 10.061 -12.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -1.646 9.824 -14.473 1.00 0.00 H new ATOM 2006 N LEU A 126 -5.637 5.223 -9.519 1.00 0.00 N ATOM 2007 CA LEU A 126 -6.584 4.108 -9.209 1.00 0.00 C ATOM 2008 C LEU A 126 -7.970 4.553 -9.649 1.00 0.00 C ATOM 2009 O LEU A 126 -8.847 3.763 -9.934 1.00 0.00 O ATOM 2010 CB LEU A 126 -6.598 3.811 -7.706 1.00 0.00 C ATOM 2011 CG LEU A 126 -5.224 3.323 -7.203 1.00 0.00 C ATOM 2012 CD1 LEU A 126 -4.152 3.399 -8.298 1.00 0.00 C ATOM 2013 CD2 LEU A 126 -4.793 4.200 -6.030 1.00 0.00 C ATOM 0 H LEU A 126 -5.189 5.658 -8.713 1.00 0.00 H new ATOM 0 HA LEU A 126 -6.276 3.201 -9.729 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -6.886 4.710 -7.161 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -7.353 3.054 -7.493 1.00 0.00 H new ATOM 0 HG LEU A 126 -5.324 2.280 -6.902 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.200 3.046 -7.901 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -4.448 2.774 -9.141 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -4.045 4.431 -8.632 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -3.822 3.866 -5.664 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -4.720 5.237 -6.358 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -5.529 4.124 -5.229 1.00 0.00 H new ATOM 2025 N LYS A 127 -8.165 5.826 -9.732 1.00 0.00 N ATOM 2026 CA LYS A 127 -9.475 6.337 -10.193 1.00 0.00 C ATOM 2027 C LYS A 127 -9.751 5.694 -11.539 1.00 0.00 C ATOM 2028 O LYS A 127 -10.858 5.310 -11.862 1.00 0.00 O ATOM 2029 CB LYS A 127 -9.373 7.842 -10.366 1.00 0.00 C ATOM 2030 CG LYS A 127 -8.803 8.440 -9.087 1.00 0.00 C ATOM 2031 CD LYS A 127 -9.610 9.675 -8.683 1.00 0.00 C ATOM 2032 CE LYS A 127 -9.712 10.630 -9.873 1.00 0.00 C ATOM 2033 NZ LYS A 127 -10.409 11.878 -9.450 1.00 0.00 N ATOM 0 H LYS A 127 -7.474 6.540 -9.501 1.00 0.00 H new ATOM 0 HA LYS A 127 -10.269 6.108 -9.482 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -8.733 8.083 -11.214 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -10.355 8.266 -10.577 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -8.829 7.700 -8.287 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -7.758 8.711 -9.237 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -10.606 9.380 -8.354 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -9.132 10.176 -7.841 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -8.717 10.866 -10.250 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -10.257 10.155 -10.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -10.479 12.528 -10.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -11.364 11.644 -9.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -9.871 12.334 -8.685 1.00 0.00 H new ATOM 2047 N ARG A 128 -8.717 5.568 -12.317 1.00 0.00 N ATOM 2048 CA ARG A 128 -8.840 4.942 -13.653 1.00 0.00 C ATOM 2049 C ARG A 128 -8.845 3.419 -13.483 1.00 0.00 C ATOM 2050 O ARG A 128 -9.353 2.692 -14.314 1.00 0.00 O ATOM 2051 CB ARG A 128 -7.639 5.351 -14.513 1.00 0.00 C ATOM 2052 CG ARG A 128 -7.066 6.693 -14.042 1.00 0.00 C ATOM 2053 CD ARG A 128 -6.337 7.361 -15.209 1.00 0.00 C ATOM 2054 NE ARG A 128 -7.134 8.525 -15.691 1.00 0.00 N ATOM 2055 CZ ARG A 128 -6.602 9.383 -16.517 1.00 0.00 C ATOM 2056 NH1 ARG A 128 -5.726 10.250 -16.089 1.00 0.00 N ATOM 2057 NH2 ARG A 128 -6.946 9.370 -17.775 1.00 0.00 N ATOM 0 H ARG A 128 -7.776 5.879 -12.077 1.00 0.00 H new ATOM 0 HA ARG A 128 -9.762 5.267 -14.136 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -6.868 4.582 -14.459 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -7.942 5.426 -15.557 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -7.867 7.338 -13.680 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -6.380 6.538 -13.209 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -5.347 7.690 -14.893 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -6.192 6.646 -16.019 1.00 0.00 H new ATOM 0 HE ARG A 128 -8.096 8.651 -15.375 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -5.455 10.258 -15.106 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -5.312 10.919 -16.738 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -7.629 8.690 -18.110 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -6.532 10.039 -18.424 1.00 0.00 H new ATOM 2071 N LEU A 129 -8.274 2.938 -12.406 1.00 0.00 N ATOM 2072 CA LEU A 129 -8.227 1.465 -12.155 1.00 0.00 C ATOM 2073 C LEU A 129 -9.534 0.815 -12.616 1.00 0.00 C ATOM 2074 O LEU A 129 -9.486 -0.327 -13.044 1.00 0.00 O ATOM 2075 CB LEU A 129 -8.036 1.208 -10.658 1.00 0.00 C ATOM 2076 CG LEU A 129 -6.905 0.210 -10.452 1.00 0.00 C ATOM 2077 CD1 LEU A 129 -5.602 0.828 -10.959 1.00 0.00 C ATOM 2078 CD2 LEU A 129 -6.771 -0.106 -8.960 1.00 0.00 C ATOM 2079 OXT LEU A 129 -10.559 1.470 -12.535 1.00 0.00 O ATOM 0 H LEU A 129 -7.835 3.509 -11.684 1.00 0.00 H new ATOM 0 HA LEU A 129 -7.395 1.035 -12.712 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -7.808 2.142 -10.144 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -8.959 0.822 -10.224 1.00 0.00 H new ATOM 0 HG LEU A 129 -7.117 -0.709 -10.999 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -4.784 0.121 -10.816 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -5.699 1.062 -12.019 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -5.393 1.742 -10.403 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -5.962 -0.821 -8.811 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -6.552 0.810 -8.412 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -7.704 -0.533 -8.593 1.00 0.00 H new TER 2091 LEU A 129 HETATM 2092 MG MG A 132 7.917 -3.585 6.400 1.00 0.00 MG HETATM 2093 PG APC A 130 5.682 0.505 10.764 1.00 0.00 P HETATM 2094 O1G APC A 130 6.741 0.952 11.891 1.00 0.00 O HETATM 2095 O2G APC A 130 4.608 -0.337 11.339 1.00 0.00 O HETATM 2096 O3G APC A 130 5.040 1.792 10.034 1.00 0.00 O HETATM 2097 PB APC A 130 7.752 0.093 8.773 1.00 0.00 P HETATM 2098 O1B APC A 130 8.922 0.447 9.820 1.00 0.00 O HETATM 2099 O2B APC A 130 8.149 -1.065 7.943 1.00 0.00 O HETATM 2100 O3B APC A 130 6.419 -0.284 9.579 1.00 0.00 O HETATM 2101 PA APC A 130 8.671 2.135 7.866 1.00 0.00 P HETATM 2102 O1A APC A 130 9.826 1.328 7.416 1.00 0.00 O HETATM 2103 O2A APC A 130 8.773 2.851 9.154 1.00 0.00 O HETATM 2104 C3A APC A 130 7.482 1.264 7.911 1.00 0.00 C HETATM 2105 O5' APC A 130 8.385 3.233 6.733 1.00 0.00 O HETATM 2106 C5' APC A 130 9.102 4.460 6.677 1.00 0.00 C HETATM 2107 C4' APC A 130 8.595 5.489 7.689 1.00 0.00 C HETATM 2108 O4' APC A 130 8.262 6.732 7.039 1.00 0.00 O HETATM 2109 C3' APC A 130 7.359 4.994 8.422 1.00 0.00 C HETATM 2110 O3' APC A 130 7.656 4.707 9.792 1.00 0.00 O HETATM 2111 C2' APC A 130 6.328 6.082 8.296 1.00 0.00 C HETATM 2112 O2' APC A 130 5.989 6.625 9.570 1.00 0.00 O HETATM 2113 C1' APC A 130 6.927 7.144 7.391 1.00 0.00 C HETATM 2114 N9 APC A 130 6.095 7.293 6.192 1.00 0.00 N HETATM 2115 C8 APC A 130 5.791 6.371 5.257 1.00 0.00 C HETATM 2116 N7 APC A 130 4.992 6.726 4.304 1.00 0.00 N HETATM 2117 C5 APC A 130 4.729 8.059 4.640 1.00 0.00 C HETATM 2118 C6 APC A 130 3.946 9.052 4.039 1.00 0.00 C HETATM 2119 N6 APC A 130 3.251 8.856 2.917 1.00 0.00 N HETATM 2120 N1 APC A 130 3.910 10.257 4.637 1.00 0.00 N HETATM 2121 C2 APC A 130 4.605 10.477 5.755 1.00 0.00 C HETATM 2122 N3 APC A 130 5.381 9.612 6.406 1.00 0.00 N HETATM 2123 C4 APC A 130 5.398 8.412 5.790 1.00 0.00 C HETATM 0 HO3' APC A 130 7.588 3.742 9.946 1.00 0.00 H new HETATM 0 HO2' APC A 130 6.543 6.206 10.262 1.00 0.00 H new HETATM 0 HN62 APC A 130 2.696 9.615 2.522 1.00 0.00 H new HETATM 0 HN61 APC A 130 3.274 7.947 2.455 1.00 0.00 H new HETATM 0 H5'2 APC A 130 10.159 4.267 6.861 1.00 0.00 H new HETATM 0 H5'1 APC A 130 9.024 4.876 5.672 1.00 0.00 H new HETATM 0 H3A2 APC A 130 7.223 0.935 6.905 1.00 0.00 H new HETATM 0 H3A1 APC A 130 6.627 1.820 8.295 1.00 0.00 H new HETATM 0 H8 APC A 130 6.203 5.363 5.302 1.00 0.00 H new HETATM 0 H4' APC A 130 9.403 5.643 8.404 1.00 0.00 H new HETATM 0 H3' APC A 130 6.991 4.062 7.992 1.00 0.00 H new HETATM 0 H2' APC A 130 5.402 5.689 7.877 1.00 0.00 H new HETATM 0 H2 APC A 130 4.529 11.476 6.183 1.00 0.00 H new HETATM 0 H1' APC A 130 6.965 8.108 7.899 1.00 0.00 H new HETATM 2139 CO CON A 131 8.856 0.867 11.893 1.00 0.00 CO HETATM 2140 N1 CON A 131 10.964 0.784 11.928 1.00 0.00 N HETATM 2141 N2 CON A 131 8.849 1.298 13.958 1.00 0.00 N HETATM 2142 N3 CON A 131 8.944 2.934 11.483 1.00 0.00 N HETATM 2143 N4 CON A 131 8.758 -1.195 12.326 1.00 0.00 N HETATM 2156 O HOH A 133 9.639 -2.395 6.648 1.00 0.00 O HETATM 2159 O HOH A 134 7.845 -3.891 8.487 1.00 0.00 O